diff --git a/.gitattributes b/.gitattributes index 8c0d5e60be5ad9c3e31ff9f0c8eb29c4219119d0..3e03efde57f20c986dcbbc8c80fb2c802367b4f6 100644 --- a/.gitattributes +++ b/.gitattributes @@ -36,3 +36,16 @@ saved_model/**/* filter=lfs diff=lfs merge=lfs -text CatPred-DB_Cleaned/kcat_max_wt_singleSeqs_wpdbs_cleaned.csv filter=lfs diff=lfs merge=lfs -text CatPred-DB_Cleaned/ki_mean_wt_singleSeqs_wpdbs_cleaned.csv filter=lfs diff=lfs merge=lfs -text CatPred-DB_Cleaned/km_mean_wt_singleSeqs_wpdbs_cleaned.csv filter=lfs diff=lfs merge=lfs -text +datasets/metabolite_inchi_smiles_brenda_pubchem.tsv filter=lfs diff=lfs merge=lfs -text +datasets/processed/kcat_max_wt_singleSeqs_wpdbs.csv filter=lfs diff=lfs merge=lfs -text +datasets/processed/ki_mean_wt_singleSeqs_wpdbs.csv filter=lfs diff=lfs merge=lfs -text +datasets/processed/km_mean_wt_singleSeqs_wpdbs.csv filter=lfs diff=lfs merge=lfs -text +datasets/splits/kcat-random_train.csv filter=lfs diff=lfs merge=lfs -text +datasets/splits/kcat-random_trainval.csv filter=lfs diff=lfs merge=lfs -text +datasets/splits/kcat-random_trainvaltest.csv filter=lfs diff=lfs merge=lfs -text +datasets/splits/ki-random_train.csv filter=lfs diff=lfs merge=lfs -text +datasets/splits/ki-random_trainval.csv filter=lfs diff=lfs merge=lfs -text +datasets/splits/ki-random_trainvaltest.csv filter=lfs diff=lfs merge=lfs -text +datasets/splits/km-random_train.csv filter=lfs diff=lfs merge=lfs -text +datasets/splits/km-random_trainval.csv filter=lfs diff=lfs merge=lfs -text +datasets/splits/km-random_trainvaltest.csv filter=lfs diff=lfs merge=lfs -text diff --git a/datasets/.DS_Store b/datasets/.DS_Store new file mode 100644 index 0000000000000000000000000000000000000000..f0b8b6c08c64a30e40da45c7b2eb5a4f3dbbd2f8 Binary files /dev/null and b/datasets/.DS_Store differ diff --git a/datasets/all_natural_metabolite_names.json b/datasets/all_natural_metabolite_names.json new file mode 100644 index 0000000000000000000000000000000000000000..32df10164c4d6231f14f02585540270ec97dc118 --- /dev/null +++ b/datasets/all_natural_metabolite_names.json @@ -0,0 +1,23466 @@ +[ + "1-O-(2-amino-2-deoxy-alpha-D-glucopyranosyl)-1D-myo-inositol", + "Beclin1", + "(2,6-beta-D-fructosyl)n", + "isoharderoporphyrinogen", + "trans-2-enoyl-acyl-ACP", + "2 tibolone", + "factor VII", + "piperidine", + "(8E,10E,12Z)-octadec-8,10,12-trienoly-[glycerolipid]", + "4 L-ascorbate", + "(heparan sulfate)-glucosamine", + "hyaluronic acid oligomers", + "4-hydroxybut-2-ynal", + "guattegaumerine", + "N-Formyl-Met-Leu-Phe", + "1-phosphatidyl-myo-inositol 3,4-bisphosphate", + "1-tuberculosinyladenosine", + "hesperetin 7-O-glucoside", + "a (4R,8Z)-4-hydroxysphing-8-enine ceramide", + "4-(gamma-L-glutamylamino)butanoyl-[BtrI acyl-carrier protein]", + "cyclohex-3-ene-1-carbonyl-CoA", + "pituitary adenylate cyclase-activating polypeptide-(1-38)", + "5-methylcytosine34 in mitochondrial tRNAMet(AUA) precursor", + "glycoprotein-alpha-L-fucosyl-(1,2)-D-galactose", + "2,4-dichlorocyclohexan-1-one", + "[acetyl-CoA carboxylase]", + "N-formyl-L-kynurenine", + "beta-D-galactose-6-phosphate", + "(-)-endo-alpha-bergamotene", + "N6-(lipoyl)-lysine", + "piperacillin", + "(1S2R4S)-limonene-1,2-epoxide", + "S-geranylgeranyl-Ras protein", + "5'-phosphonucleotides", + "2'-O-methylcytidine1920 in 23S rRNA", + "1,2-diacyl-3-O-(beta-D-glucopyranosyl)-sn-glycerol", + "protein kinase Czeta", + "3-(2,3-dihydroxyphenyl)propionate", + "mevaldyl-CoA", + "1,3-diaminopropanal", + "O-acylcarnitine", + "D-mannopyranose", + "nicked DNA", + "glutathione", + "4-O-[(2R)-1-glycerophospho]-N-acetyl-beta-D-mannosaminyl-(1->4)-N acetyl-alpha-D-glucosaminyl-diphospho-ditrans,octacis-undecaprenol", + "glutaredoxin", + "major histocompatibility complex class I-presented antigenic peptides", + "cyanidin 3-O-(6-O-(4-coumaroyl))-beta-D-sambubioside", + "tyrosine phosphatase", + "(1S,2R)-3-methylcyclohexa-3,5-diene-1,2-diol", + "fenobucarb", + "caffeoyl-beta-D-glucoside", + "angiotensin IV", + "fecosterol", + "[phosphatase 2A protein]-leucine methyl ester", + "chromogranin A", + "beta-globulin", + "(E,E)-4,8,12-trimethyltrideca-1,3,7,11-tetraene", + "tetracycline", + "1-oxa-2-oxocycloheptane", + "miR-362-5p", + "mature nerve growth factor and smaller fragments", + "Tus1", + "D-erythro-tetracosanoyl-sphingosine", + "[LysW]-C-terminal-L-glutamate", + "(+)-sabinene", + "thiophenol", + "L-arabinose-[arabinose-binding protein][side1]", + "alpha-spectrin II", + "[HPr protein]-serine/threonine", + "S-D-lactoylglutathione", + "(2R,3S)-2-alkyl-3-hydroxyalkanoate", + "Tyr-tRNATyr", + "nucleoside 5'-diphosphate", + "(6aS,11aS)-4-dimethylallyl-3,6a,9-trihydroxypterocarpan", + "2 2-hydroxypurine", + "insulin A and B chains", + "[arabinose-binding protein][side1]", + "Mcl-1", + "type VII collagen", + "[histone H3]-N6-acetyl-L-lysine14", + "amyloid beta 4-42 fragment", + "CREB1 protein", + "(R,S)-stylopine", + "3-methylbutanol", + "4-deoxy-beta-D-gluc-4-enuronosyl-(1,4)-N-acetyl-D-galactosamine 6-sulfate", + "5-taurinomethyluridine34 in tRNA", + "dermatan sulfate", + "phosphorylated OTUB1 protein", + "adenine9 in tRNATrp", + "acacetin", + "hypoxanthine", + "2-hydroxy-3,4-dioxopentyl phosphate", + "D-glucono-1,5-lactone 6-phosphate", + "glycine cleavage system H", + "[SP-STK kinase]-serine/threonine", + "flurbiprofen beta-D-glucuronoside", + "[peptide chain release factor 2]-N5-methyl-L-glutamine", + "naphthoquinol", + "angiotensin receptor", + "diadenosine polyphosphate", + "3 reduced acceptor", + "cholylglycine/out", + "phospho-Crem", + "fragments of gliadin", + "roundabout homolog 1", + "3-bromobenzoyl-CoA", + "7-acetylaminodesacetoxycephalosporanic acid", + "N-alpha-linolenoylethanolamide", + "HSCoM", + "maleylpyruvate", + "myosin bound to actin filament at position n+1", + "soluble (pro)renin receptor", + "1-pyrroline", + "poly[(R)-3-hydroxyoctanoate]n", + "xyloglucan fragment oligosaccharide", + "(glutathion-S-yl)(1H-indol-3-yl)acetonitrile", + "2 o-quinone", + "HrpG", + "MKS1", + "CMP-5,7-diacetamido-3,5,7 9-tetradeoxy-L-glycero-alpha-L-manno-2-nonulopyranosonic acid", + "vinorine", + "proendothelin", + "tartronic semialdehyde", + "maltooligosaccharides", + "processed TatA", + "drebrin", + "2-(3-benzoylphenyl)propionic acid", + "DELTA2-thiazoline-2-carboxylate", + "(9S,10E,12Z)-9-hydroperoxy-10,12-octadecadienoic acid", + "[coiled-coil domain of p54nrb]-Nomega,Nomega-dimethyl-L-arginine", + "L-glutamyl-L-cysteine", + "3-hydroxypropionate", + "a long-chain primary alcohol", + "pro-Der p 9", + "2-(beta-D-glucosyl)-sn-glycerol 3-phosphate", + "GDP-N-formyl-alpha-D-perosamine", + "1,3-alpha-D-galactosyl-lipopolysaccharide", + "influenza A H1 virus hemagglutinin", + "phosphoopsin", + "2 alpha-D-mannose", + "(R,S)-cheilanthifoline", + "phenylpyruvic acid", + "prodigiosin", + "L-allo-isoleucine", + "alpha-selinene", + "S-methyl L-cysteine sulfoxide", + "[putrescine-binding protein][side 1]", + "ammonium", + "5,6-dihydrouracil17 in tRNA", + "goodpasture antigen", + "L-erythrulose 4-phosphate", + "geranylgeraniol", + "4-(gamma-glutamylamino)butanoate", + "[beta-tubulin]-Nomega,Nomega-dimethyl-L-arginine", + "1,3-dicarboxyurea", + "xylitol 5-phosphate", + "lactoyl-CoA", + "N-3-oxodecanoyl-L-homoserine-1,4-lactone", + "2-Aminoethane sulfinate", + "[ATM]-N6-acetyl-L-lysine", + "[RNA]-3'-ribonucleoside-3'-(5'-diphosphoadenosine)", + "foot-and-mouth disease virus protein VP0", + "bovine haemoglobin", + "2 oxidized rubredoxin", + "queuine34 in tRNA", + "N2-methylguanine1207 in 16S rRNA", + "secretory leucoprotease inhibitor", + "1 2-diacyl-3-O-(alpha-D-glucopyranosyl(1->2)-O-alpha-D-glucopyranosyl)-sn glycerol", + "Bri2", + "gasdermin fragment p20", + "1,2-dioleoyl-sn-lysophosphatidylethanolamine", + "axin", + "flavonol 3-O-beta-D-galactoside", + "tyrosine", + "N-tetradecanoylglycylpeptide", + "3-oxo-4-methyl-pentanoyl-[acyl-carrier protein]", + "nuclear factor of activated T cells 5/tonicity enhancer binding protein", + "(S,S)-tartrate", + "[Rv0019c]-serine/threonine phosphate", + "5-methylthioribose 1-phosphate", + "growth factor Spitz", + "22-hydroxydocosahexaenoate", + "digitoxigenin cellobioside", + "matrix metalloproteinase-2", + "malvin", + "GD2", + "Cyanide", + "3-methyl-2-oxo-pentanoic acid", + "(2E,4Z)-5-chloro-2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid", + "selenophosphate", + "alphas1-casein", + "electron transfer protein", + "neoxanthin", + "isopanose", + "inositol 4,5-bisphosphate", + "IFN-gamma-inducible protein 10", + "gamma-Glu-L-Cys", + "galactitol 1-phosphate[side 2]", + "[(1->3)-beta-D-glucosyl]n+1", + "beet arabinan", + "Mg-ATP", + "O-alpha-D-galactopyranosyl-(1,4)-O-beta-D-galactopyranosyl-(1 4)-D-mannose", + "[actividin receptor] phosphate", + "phosphorylated cAMP-response element binding protein", + "5,6-dihydrouracil", + "3-(2-carboxyethenyl)-cis,cis-muconate", + "ganglioside GM2", + "calmodulin-L-methionine (R)-sulfoxide", + "H2AX", + "bacteriochlorophyllide e", + "6-methylpyridine-3-carboxamide", + "2,3-didehydro-D-xylose", + "1D-myo-inositol 1-diphosphate 2,3,4,5,6-pentakisphosphate", + "N-acetyl-D-cystine", + "(-)-solanapyrone A", + "3',4',5,6-tetrahydroxy-3,7-dimethoxyflavone", + "Mus81-Mms4 resolvase", + "ent-isokaurene", + "(+)-sabinone", + "acyclovir phosphate", + "beta-D-glucuronosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-proteoglycan", + "3-phenylpyruvate", + "Z-Leu-Leu-Glu-NH-4-nitroanilide", + "CD166 antigen", + "(4-hydroxybenzoyl)methanol", + "complement componentC3", + "beta-eudesmol", + "4-methoxyindol-3-ylmethyl isothiocyanate", + "cleaved Rad21", + "16-methoxy-2,3-dihydro-3-hydroxytabersonine", + "UDP-3-N-(3-hydroxydodecanoyl)-2-acetamido-3-amino-2 3-dideoxy-alpha-D-glucopyranose", + "(7R)-hydroxy-(5S,6S)-epoxyeicosa-(8Z,11Z,14Z)-trienoic acid", + "dTDP-6-deoxy-alpha-D-allopyranose", + "transcription factor Pax7", + "3-O-beta-cellobiosyl-D-glucose", + "alpha-D-fructofuranose-beta-D-fructofuranose 2',1:2,3'-dianhydride", + "ERK2", + "2-hydroxyethane-1-sulfonate", + "N-methyl-D-aspartate receptor NR2A subunit", + "FAD", + "[(1->6)-alpha-D-glucosyl]n", + "5-methyluracil", + "4-deoxy-erythro-hex-4-ene pyranosyluronate", + "2,3,6-trihydroxypyridine", + "presequence-containing protein", + "synuclein", + "a sulfamate", + "isopropyl beta-D-1-thiogalactopyranose 6'-phosphate[side 2]", + "CHO-COOH", + "pyruvic acid", + "L-Pro", + "EpdD signal peptide", + "a 9-methyl-(4E,8E)-sphinga-4,8-dienine ceramide", + "[LysW]-C-terminal-gamma-(L-glutamyl)-L-glutamate", + "ganglioside GD1a", + "N-arachidonoylphosphatidylethanolamine", + "beta-D-Glucose 1-phosphate", + "3-O-alpha-D-mannopyranosyl-D-mannopyranose", + "beta1-integrin", + "7 H2O", + "dynamin I", + "vascular endothelial growth factor 164", + "glycogen", + "vanillin", + "an N-terminal-lysinyl-[androgen receptor]", + "phosphorylated RNA polymerase II carboxy terminal domain", + "Ii-MHC class II complex", + "RNA polymerase II C-terminal subunit", + "thyroliberin", + "4-alpha-D-nigerosylglucose", + "cAD1 protein", + "sinapoylcholine", + "D-fructuronate", + "(4R,5S)-5-[(1S,2R)-1-carboxy-2-hydroxypropyl]-4-methyl-3-(((3S 5S)-5-[(sulfamoylamino)methyl]pyrrolidin-3-yl)sulfanyl)-4 5-dihydro-1H-pyrrole-2-carboxylic acid", + "rhamnogalacturonan I oligosaccharides with alpha-L-rhamnopyranose at the reducing end and 4-deoxy-4,5-unsaturated D-galactopyranosyluronic acid at the nonreducing end", + "2-chloro-4-nitrophenyl alpha-D-maltotrioside", + "calcitonin gene-related peptide", + "(E)-phenylacetaldehyde oxime", + "beta-methylmalyl-CoA", + "glucoraphanin", + "D-mannitol[side 1]", + "peptide", + "24-oxo-1alpha,23,25-trihydroxyvitamin D3", + "2-hydroxy-3-keto-5-methylthiopent-1-ene 1-phosphate", + "malondialdehyde", + "2-amino-5-hydroxypentanoate", + "2 S-adenosyl-L-homocysteine", + "a (2R)-2-alkyl-3-oxoalkanoate", + "autophagy-related protein kinase Atg1", + "tetrahydropteroylglutamate", + "Phenylalanine", + "phosphorylated cone opsin", + "L-firefly luciferyl-CoA", + "butanoylphosphate", + "tagatose", + "2 raffinose", + "[DsbA protein] with reduced L-cysteine residues", + "ginsenoside C-Mc", + "ADP", + "trans-anethole", + "2 lactulose", + "[Acs protein]-N6-acetyl-L-lysine609", + "(5Z,13E,15S)-6,9alpha-epoxy-11alpha,15-dihydroxyprosta-5,13-dienoate", + "endogenous acceptor molecule", + "CD25", + "phosphorylated protein p105", + "ribonucleoside diphosphate", + "Cd2+[side 1]", + "CLC chloride channel", + "Bid protein", + "cofactor disulfide", + "2-dehydro-3-deoxy-D-gluconate 6-phosphate", + "single-stranded oligodeoxyribonucleotide", + "2-(S)hydroxypropyl-CoM", + "SMT3precursor", + "alpha-D-glucopyranose", + "a [histone H3]-N6-methyl-L-lysine9", + "[Yck2]-L-cysteine", + "deoxyuridine monophosphate", + "n-butyrate", + "N,N'-bis-(3-benzylaminopropyl)butane-1,4-diamine", + "2-octaprenyl-3-methyl-6-methoxy-1,4-benzoquinone", + "2-hydroxy-2,4-pentadienoate", + "1,2-dimyristoyl-sn-glycerol 3-phosphate", + "pseudoazurin", + "[SREBP-1c]-N6-acetyl-L-lysine", + "alpha-1,4-D-galacturonide", + "R-CO-NH-CH2-COOH", + "(4R)-(-)-ipsdienol", + "3-O-(alpha-D-mannosyl)-L-seryl-[protein]", + "Fe3+-hydroxamate complex-[hydroxamate-binding protein][side 1]", + "2-succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylic acid", + "D-cystine(side 2)", + "2-hydroxypropyl-CoM", + "MMP-9", + "dihydrosirohydrochlorin", + "[tyrosine 3-monooxygenase]", + "cyclosporine A[side 1]", + "(2S,2'S)-2,2'-(pentane-1,5-diylbis[oxy[(11S 11aS)-11-hydroxy-7-methoxy-5-oxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2 1-c][1,4]benzodiazepine-8,10(5H)-diyl]carbonyloxymethanediylbenzene-4 1-diyloxycarbonylimino])dipentanedioic acid", + "(1E)-N-(sulfooxy)pent-4-enimidothioic acid", + "cisplatin/out", + "duroquinone", + "precursor peptide MftA(1-28)", + "9-cis,12-cis-Octadecadienoate", + "YapG", + "4-hydroxy-2-methyl-3-oxo-4-[(2E,6E)-farnesyl]-3,4-dihydroquinoline 1-oxide", + "glycerol 3-phosphate", + "5'-CMP", + "Man8GlcNAc", + "phosphorylated pro-apoptotic Bcl-2-associated X protein", + "mogroside IE", + "phosphorylated MKK7", + "2 alpha,alpha-trehalose 6-mycolate", + "sarcosine", + "3-methoxy-5-methylnaphthoate", + "pyridoxamine 5'-phosphate", + "15-oxo-beta-bilirubin", + "ribonuclease B", + "5-fluorocytosine", + "(+)-glaucine", + "caspase-3 propeptide", + "HIVFSFFV", + "complex I subunits", + "fragments of monocyte chemotactic protein 1", + "uridine", + "(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl-CoA", + "tRNA uridine13", + "[PrkD]-serine/threonine phosphate", + "a [homeodomain-interacting protein kinase 2]-L-tyrosine phosphate", + "protein 14-3-3zeta", + "phosphorylated CDK1", + "beta-1,2-glucan/out", + "phosphorylated [low density lipoprotein receptor-related protein]", + "12-oxo-9-dodecenoic acid", + "extracellular matrix protein", + "diphosphate", + "transforming growth factor beta-binding protein", + "tRNA uridine55", + "(-)-cis-isopiperitenol", + "Ag+/out", + "hepatocyte growth factor activator inhibitor-1", + "C4 complement component", + "D-galactofuranosyl-(1->6)-beta-D-galactofuranose", + "histidine/in", + "2,3,2',3'-tetrakis(3-hydroxytetradecanoyl)-D-glucosaminyl-1 6-beta-D-glucosamine 1,4'-bisphosphate", + "amyloid beta-peptide(41-42)", + "heterogeneous nuclear ribonucleoprotein F", + "N-acetyl-alpha-D-galactosaminyl-diphospho-ditrans,octacis-undecaprenol", + "9-hydroxy-12,13-epoxy-10-octadecenoic acid", + "kievitone", + "7-hydroxy-6-methoxy-4-methylcoumarin", + "mitochondrial matrix protein precursor", + "DsrC", + "curcumin", + "Ribose 1-phosphate", + "[histone H4]-L-lysine5", + "[Sam68]-L-tyrosine", + "Rad 21", + "cysteine-rich motor neuron 1 protein", + "human CXCL-2", + "lignoceric acid", + "cis-1,2-dihydro-1,2-dihydroxynaphthalene", + "3,4-dihydroxypyridine", + "2-acyl-sn-lysophosphatidylcholine", + "an N-terminal-methionyl-[RPM1 protein]", + "brevianamide F", + "minoxidil sulfate", + "3-hydroxydesloratadine", + "methanophenazine", + "(3R)-3-hydroxymyristoyl-[acyl-carrier protein]", + "4-hydroxy-4-methyl-2-oxoglutarate", + "IGF-binding protein-5", + "A-band polysaccharide/in", + "dihydrodipicolinate", + "adaptor protein SH2 domain-containing leukocyte protein", + "polyphosphate(n-1)", + "L-glutamyl-tRNAGln(UUG)", + "cobalt-precorrin-6B", + "benzyl benzoate", + "Fba", + "(4-[bis(2-iodoethyl)amino]-3,5-difluorobenzoyl)-L-glutamic acid", + "an N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl alpha-D-galactosaminyl-R", + "DPNRKR", + "corticosteroid-binding globulin", + "albendazole", + "fluoroacetaldehyde", + "5'-acylphosphoadenosine", + "2,8-dihydroxypurine", + "Spitz", + "3-oxoisoapionate", + "L-1-aminopropan-2-ol", + "thioredoxin z", + "phospho-[immunglobulin-alpha]", + "Renin", + "(24S)-3beta-hydroxy-24-methyl-5alpha-cholesta-8(14),22-dien-15-one", + "1-amino-2-hydroxynaphthalene", + "Bid peptide", + "2,3-dioxohexyl phosphate", + "reduced cytochrome c551", + "P1,P3-bis(5'-adenosyl)triphosphate", + "pseudomonoyl C-CoA", + "5-methyl-2-thiouracil54 in tRNA", + "[Rubisco large subunit]-L-lysine", + "uridine44 in tRNASer", + "benzylaldehyde", + "3'-phopsho-5'-hydroxy-DNA", + "sn-glycerol 1-phosphate", + "DNA containing tandem dihydrouracil", + "3'-hydroxy-N-methyl-(S)-coclaurine", + "marine beta-1,3-beta-1,4-xylan", + "DELTA8-trans/cis-C18-phytosphingenine", + "2-methylfumaryl-CoA", + "2-aminomalonate semialdehyde", + "tetrahydrobiopterin", + "mitogen-activated protein kinase kinase 3", + "spore protein B", + "pro-sequence of vasopressin", + "ferulyl-CoA", + "an acetyl-[acyl-carrier protein]", + "5'-phospho-(ribonucleotide)m", + "NO2-", + "crocetin", + "(9E)-12-hydroxyoctadec-9-enoic acid", + "WHWLQL", + "(R)-glycerate", + "glutaric acid", + "butanoyl-L-homoserine lactone", + "reduced co-enzyme Q", + "an N-acyl-L-homoserine", + "4-deoxy-beta-D-gluc-4-enuronosyl-(1,4)-N-acetyl-D-galactosamine", + "dexmedetomidine N1-beta-D-glucuronoside", + "plant RNA helicase 75 L-isoaspartate", + "4-methylthiopentanaldoxime", + "ferricyanide", + "N2-methylguanine2445 in 23S rRNA", + "neopine", + "1-O-[2-(L-cysteinamido)-2-deoxy-alpha-D-glucopyranosyl]-1D-myo-inositol", + "D-ribulose 1,5-diphosphate", + "Codeine", + "acytyl-eIF5A", + "D-mannosylglycoprotein", + "Klebsiella pneumoniae capsule exopolysaccharides", + "central competence regulator sigmax", + "L-aspartate89-[ribosomal protein S12]", + "5-formimidoyltetrahydrofolate", + "Leu-enkephalin", + "p35 protein", + "O4-succinyl-L-homoserine", + "amyloid pbeta A4 protein", + "beta-casein", + "cefamandole", + "dihydromethanophenazine", + "pro-mCASP-3", + "1-acyl-lysophosphatidylserine", + "complement C4b-bound C2", + "a [Co(I) methylated-thiol-specific corrinoid protein]", + "[alpha-D-glucosyl-(1->3)]n+1", + "13-(beta-D-glucopyranosyl)oxydocosanoic acid", + "[RNA polymerase II carboxyl terminal domain]", + "1-propanol", + "(2-N 3-O-bis[(3R)-3-hydroxytetradecanoyl]-4-O-phospho-beta-D-glucosaminyl) (1->6)-(2-N,3-O-bis[(3R)-3-hydroxytetradecanoyl]-alpha-D-glucosaminyl phosphate)", + "8 CO2", + "2,4-diacetylphloroglucinol", + "5-methylcytosine49 in tRNAAsp(GUC)", + "glucoquinovosidodigitoxigenin", + "oxidized [2Fe-2S] ferredoxin", + "phosphorylated IKKalpha protein", + "3-oxo bile acid CoA ester", + "malto-oligomers", + "glucosyl-obacunone", + "S-(2-aminoethyl)-L-cysteine ketimine", + "(2Z,6Z)-farnesyl diphosphate", + "n ADP", + "spectrozyme fVIIa", + "putrescine-[polyamine-binding protein][side 1]", + "phosphorylated G protein-coupled receptor GRK7", + "L-glutamate 5-semialdehyde", + "[PGC-1]-N6-acetyl-L-lysine", + "(2S,3R)-capreomycidine", + "eIF4GI", + "UDP", + "1,4-dithiothreitol", + "L-hexahomomethionine", + "Fe(II)", + "2 Fd-", + "deoxynucleoside phosphate", + "2-deoxystreptamine", + "guanine9 in tRNALysCUU", + "5-methyl-3-oxohexanoyl-[acyl-carrier-protein]", + "fragments of bradykinin", + "4-acetylphenylalanyl-tRNATyr", + "protoporphyrin", + "(5Z,8Z,10E,14Z)-(12R)-12-hydroperoxyeicosa-5,8,10,14-tetraenoate methyl ester", + "2 reduced cytochrome cL", + "5,10-methenyl-tetrahydrofolate", + "wybutosine72 in tRNAPhe", + "10Sa RNA", + "putrescine[side 2]", + "nucleoside 2',3'-cyclic phosphate", + "an N-terminal-Nalpha-acetyl-L-methionyl-[transmembrane protein]", + "3,3',4',5,7-pentahydroxy-8-methoxyflavone", + "4-methylumbelliferol", + "phosphorylated IGF-I receptor", + "LL-diaminopimelate", + "2-methyl-3-oxopropionate", + "transaldolase", + "[leucine-rich repeat kinase 2 phosphoprotein]", + "9-beta-D-arabinosyl 2-fluoroadenine 5'-phosphate", + "4-O-beta-D-mannopyranosyl-N-acetyl-D-glucosamine", + "ethene", + "N-acetyl-7-O(or 9-O-)-acetylneuraminate", + "ricinoleoyl-CoA", + "(4S)-4-methyl-3-oxohexanoyl-[acyl-carrier-protein]", + "agmatine", + "UDP-6-sulfoquinovose", + "ergosta-5,7,22,24(28)-tetraen-3beta-ol", + "(R,R)-butane-2,3-diol", + "propanoyl-CoA", + "MOS1 protein", + "1-naphthol", + "alpha-D-galactosyl-(1-3)-[alpha-L-fucosyl-(1-2)]-D-galactosyl-O-R", + "ginsenoside Rb2", + "prohaptoglobin", + "benzylsulfanol", + "p34cdc2", + "a 5-L-glutamyl-amino acid", + "camalexin", + "D-cellobiose[side 1]", + "MDM2 oncoprotein", + "alpha-D-5-phosphoribosyl-1-diphosphate", + "inulin", + "2 S-allyl-L-Cys sulfoxide", + "phosphorylated Na+/K+ ATPase", + "2,4-diacetamido-2,4,6-trideoxy-alpha-D-mannopyranose", + "[histone H3 protein]", + "calciol", + "4-ethylbenzoyl-CoA", + "decanoyl-[acyl-carrier protein]", + "5,6beta-epoxy-5alpha-cholestan-3beta-ol", + "(4-hydroxyphenyl)ethan-1-one", + "RS toxin", + "[IkappaBbeta phosphoprotein]", + "phenylmethanesulfenic acid", + "2-O-sulfo-alpha,alpha-trehalose", + "lysophosphatidylinositol/in", + "MEK-1", + "phospho-serine/arginine-rich protein 55", + "2 reduced ferredoxin [iron-sulfur] cluster", + "[isocitrate dehydrogenase (NADP+)]", + "N-acetyl-L-aspartate", + "1,2-dihydroxy-5-methylthio-pent-1-ene-3-one", + "N1-methylguanine9 in tRNAGly", + "O-D-mannosyl glucoamylase I", + "maize starch", + "beta-isomerized C-telopeptide", + "mannitol", + "uric acid", + "M3-muscarnic receptor", + "p65 subunit of nuclear factor-kappaB", + "staphyloferrin A", + "3 ATP", + "[Wnt1]-O-(9Z)-hexadec-9-enoyl-L-serine", + "5-phospho-beta-D-ribosylamine", + "stachydrine", + "1-acyl-2-[(3E)-hexadec-3-enoyl]-[glycerolipid]", + "1,6-alpha-D-mannooligosaccharides", + "DNA containing ring-opened N7-methylguanine", + "3'-phosphoadenylylsulfate", + "(10E,12Z)-9-hydroperoxy-10,12-octadecadienoate", + "2-(4-dimethylaminophenyl)-1,3-benzothiazol-6-ol", + "D-galactosamine", + "L-cysteinyl-tRNAPro", + "veratryl alcohol", + "phosphorylated IP3R-2", + "trilobatin", + "hydroxymethylphosphonate", + "6-O-[N-acetyl-alpha-D-glucosaminyl]-1-[1 2-bis(hexadecanoyl)-sn-glycero]phospho-1D-myo-inositol", + "[acceptor protein]-L-threonine", + "dolichyl phosphate", + "factor IXa", + "a 3alpha-hydroxysteroid", + "sulfogalactosylglycerolipid", + "iAD1 protein", + "pyrimidodiazepine", + "maltotetrose", + "1D-myo-inositol 1,2,4,5,6-pentakisphosphate", + "5-methylthio-2,3-dioxopentyl phosphate", + "N-formylaspartic acid", + "6-tuliposide B", + "2-oxopalmitate", + "histone H4-L-arginine", + "2-hydroxy-6,6-dimethyl-3,4-dioxoheptyl phosphate", + "phosphorylated FHA-domain containing protein GarA", + "bacteriochlorophyllide a", + "10-formyl-dihydrofolate", + "juvenile hormone III acid", + "an oxidized flavoprotein", + "4-(6-hydroxypyridin-3-yl)-4-oxobutanoate", + "[glycine-cleavage complex H protein]-S-aminomethyl-N6-dihydrolipoyl-L-lysine", + "berbamunine", + "phosphatidylinositol 4-phosphate", + "N-terminal putative transmembrane segment", + "5-methylcytosine1404 in 16S rRNA", + "O-beta-D-xylosylprotein", + "proclavaminate", + "D-apionolactone", + "(4R,5S)-5-[(1S,2R)-1-carboxy-2-hydroxypropyl]-3-[(6 7-dihydro-5H-pyrazolo[1,2-a][1,2 4]triazol-4-ium-6-yl)sulfanyl]-4-methyl-4 5-dihydro-1H-pyrrole-2-carboxylate", + "2-[(2R,5Z)-2-carboxy-4-methylthiazol-5(2H)-ylidene]ethyl phosphate", + "L-2-aminoadipate", + "N-phenyl-1-naphthalenamine", + "uracil-mismatched double-stranded DNA", + "1-palmitoyl-sn-glycerol 3-phosphate", + "p25", + "3-(1-hydroxyethyl) bacteriochlorophyllide g", + "pro-alpha-defensin", + "3,3',5-triiodothyronine", + "7-ethyl-10[4-(1-piperidino)-1-piperdino]carbonyloxy-camptothecin", + "Trimethylamine N-oxide", + "SNARE-protein", + "gamma-L-glutamyl-L-cysteinyl-beta-alanine", + "N-acetyl-4-aminobiphenyl", + "4-bromophenylalanine", + "protein kinase A", + "miRNAn+1", + "CH3-S-CoM", + "N-3-oxohexanoyl-L-homoserine lactone", + "lipoarabinomannan", + "Glu-plasminogen", + "1-palmitoyl-2-oleoyl-phosphatidylcholine", + "N2-formyl-N1-(5-phospho-D-ribosyl)glycinamide", + "2-acylglycerophosphocholine", + "(ADP-D-ribosyl)n+1-Ras", + "Gag polyprotein", + "ADP-ribose 1'',2''-phosphate", + "[(1->4)-beta-D-glucosyl]n+1", + "3 starch", + "6beta-hydroxyestradiol-17beta", + "ACINUS", + "pseudouridine 5'-phosphate", + "Staphylococcus aureus strain UAMS-1 cell wall", + "2-oxo-5-ureidopentanoic acid", + "2-phospho-4-(cytidine 5'-diphospho)-2C-methyl-D-erythritol", + "5-methylaminomethyl-2-thiouridylate in tRNA", + "androgen receptor", + "phosphorylated-ErbB-2", + "N-acetyl-D-galactosaminyl-(N-acetylneuraminyl)-D-galactosyl-1 4-beta-D-glucosyl-N-acylsphingosine", + "L-cystine-[cystine-binding protein][side 1]", + "Phe-Ala-primaquine", + "histidine kinase Hik34", + "17-(4-hydroxyphenyl)heptadecanoyl-[(phenol)carboxyphthiodiolenone synthase]", + "2 levomedetomidine", + "pro-urokinase plasminogen activator", + "N3-methylcytosine32 in tRNA1Ser", + "6-aminopurine", + "Fibrin, partially degraded", + "daphnin", + "(+)-cubenene", + "2-propenyl 2-propenethiosulfinate", + "phosphatidylinositol-3,4,5-trisphosphate", + "S-ethyl L-cysteine sulfoxide", + "L-glutamyl-[BtrI acyl-carrier protein]", + "3-oxoadipate enol-lactone", + "stearoyl-sn-glycerol", + "2-(alpha-D-galactosyl)-sn-glycerol 3-phosphate", + "plasminogen activator inhibitor 2 N5-pentylglutamine", + "carbamoyl phosphate", + "D-alanyl teichoic acid", + "5-methylcytosine48 in tRNAIle(AAU)", + "19-(4-hydroxyphenyl)nonadecanoate", + "pulmonary vasodilative vasoactive intestinal peptide", + "[TIP5]-N6-acetyl-L-lysine", + "trans-p-hydroxycinnamate", + "DELTA1-piperideine 2-carboxylate", + "(9Z)-12-hydroxy-9-dodecenoic acid", + "beta-hematin", + "phopshorylated membrane type IV collagen", + "p-nitrophenyl-alpha-L-arabinofuranoside", + "a [histone H3]-L-lysine9", + "2 dopaquinone", + "adenosylcobinamide phosphate", + "propionyl-carnitine", + "6-pyruvoyl-5,6,7,8-tetrahydropterin", + "demethyldecarbamoylnovobiocin", + "linear plasmid DNA pDRM-2R", + "DNA containing F5dU", + "striatal-enriched protein tyrosine phosphatase", + "3-amino-5-[(4-hydroxyphenyl)methyl]-4,4-dimethylpyrrolidin-2-one", + "3-deoxycapsidiol", + "crystalline cellulose", + "N-acetyl-DDDIAAL", + "FMN-L-threonyl-[protein]", + "L-threonylcarbamoyladenylate", + "4-acetamido-4 6-dideoxy-alpha-D-galactosyl-(1->4)-N-acetyl-beta-D-mannosaminouronyl (1->4)-N-acetyl-alpha-D-glucosaminyl-diphospho-ditrans octacis-undecaprenol", + "protein-L-methionine (S)-sulfoxide", + "BR13", + "5-oxoprolyl-CD47", + "a 3-dehydropyranoside", + "alpha-D-mannopyranosyl-(1,2)-alpha-D-mannopyranosyl-(1 2)-alpha-D-mannopyranosyl-(1,3)-[alpha-D-mannopyranosyl-(1 2)-alpha-D-mannopyranosyl-(1,3)-[alpha-D-mannopyranosyl-(1 2)-alpha-D-mannopyranosyl-(1,6)]-alpha-D-mannopyranosyl-(1 6)]-beta-D-mannopyranosyl-(1 4)-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1 4)-2-(acetylamino)-2-deoxy-beta-D-glucopyranose", + "ubiquitin-protein", + "4,4-dimethyl-zymosterol", + "DIM-10 protein", + "9alpha-hydroxy-3-oxo-23,24-bisnorcholesta-1,4-dien-22-oyl-CoA", + "(9Z,11E)-(13S)-13-hydroperoxy-octadeca-9,11-dienoate", + "cyclohex-1(6),2-diene-1-carbonyl-CoA", + "acetophenone", + "D-erythro-dihydrosphingosine", + "ampicillin", + "lung surfactant protein D", + "4 isopentenyl diphosphate", + "2-dehydro-3-deoxy-L-arabinonate", + "asialofetuin", + "[insulin receptor kinase]-tyrosine", + "3,7-dimethylocta-1,6-dien-3-ol", + "light-harvesting complex II", + "beta-ketoacyl-[acyl-carrier protein]", + "L1-32 fragment", + "S-geranylgeranyl-Rab", + "glycerophosphodiester", + "alpha-gurjunene", + "heparan sulfate 3-O-sulfo glucosamine", + "adenosine 3',5'-bisphosphate", + "N-1-(5'-phosphoribosyl)-ATP", + "2,3-didehydro-D-glucose", + "7,8-dihydromonapterin", + "aldehyde", + "ophiobolin F", + "an ornithine lipid", + "4-hydroxybenzalacetone", + "2-methyladenosine", + "amyloid-like protein 1", + "glycogen containing alpha-1,6-glucosidic linkages", + "precursor let-7 RNAn", + "4-chlorobenzoate", + "ADP-ribose 1''-phosphate", + "CMP-3-deoxy-D-glycero-D-galacto-nononate", + "N-formyl-Met-Leu-Phe", + "(2R)-2-hydroxy-2-methyl-3-oxobutanoate", + "foot-and-mouth disease virus protein VP3", + "ent-kaur-16-en-19-oate", + "CDP", + "cytosine2278 in 25S rRNA", + "butanoyl-[acyl-carrier protein]", + "S-naringenin", + "alpha1-antitrypsin", + "poly(3-hydroxybutyrate-co-3-hydroxyvalerate)", + "2 ubiquinol-1", + "dopamine sulfate", + "(5S,6S)-6-amino-5-hydroxycyclohexa-1,3-diene-1-carboxylic acid", + "valienone", + "[cullin]-L-lysine", + "2-oxepin-2(3H)-ylideneacetyl-CoA", + "(2S)-5,7,3',4',5'-pentahydroxyflavanone", + "nucleoside 2',3'-cyclic phosphates", + "(6aR,11aR)-3,9-dihydroxypterocarpan", + "(L-cysteinyl)adenylate", + "L-N-acetylphosphinothricin bialophos", + "sn-glycero-3-phosphoinositol", + "long-chain triacylglycerol", + "[MurC]-serine/threonine", + "Gliadin", + "calcitetrol", + "2-hydroxymethylnaphthalene", + "an alpha-eleostearoyl-[glycerolipid]", + "aggrecan", + "(1,4-beta-D-glucosyl)n+1", + "trans-(+)-S-propenyl-L-Cys sulfoxide", + "alpha-1,5-L-arabinobiose", + "7-hydroxy-4'-O-methylisoflavone", + "[Skp1-protein]-O-(N-acetyl-D-glucosaminyl)hydroxyproline", + "LVVYPWTQRF", + "Ac-RRLQ-7-amido-4-methylcoumarin", + "t6A37-tRNA", + "L-methionine (R)-sulfoxide", + "2-carboxy-D-arabinitol", + "dTDP-beta-L-rhamnose", + "estrogenic estrone", + "hv", + "lecithin", + "cystine", + "2-hydroxyphenylacetate", + "long-chain aldehyde", + "(R)-2-benzylsuccinate", + "propionic acid", + "20-methyl-21,22-didehydro-20,21-dihydrobotryococcene", + "DSSARIRRNAKG", + "2-acetamido-4-O-(2-amino-2-deoxy-beta-D-glucopyranosyl)-2-deoxy-D glucose", + "3'-hydroxyltermini DNA", + "2'-deoxy-3'-thiacytidine", + "S-(leukotriene C4)glutathione[side 1]", + "14S,15R-epoxy-eicosatrienoic acid", + "deamido bleomycin B2", + "feline foamy virus Env glycoprotein precursor", + "3'-O-methyleriodictyol", + "1-lyso-phosphatidylethanolamine", + "2-(4-methoxyphenyl)-1,3-benzothiazol-6-yl sulfate", + "gamma-L-glutamylputrescine", + "[AKT1 protein]-serine/threonine phosphate", + "Mgm1", + "clopidogrel", + "3 L-serine", + "[D-GlcA-beta-(1->4)-2-O-Ac-D-GlcA-beta-(1->4)-D-Glc-beta-(1->4)-[3-O CH3-CH2CH(OH)C(O)-D-Gal-beta-(1->4)-D-Glc-beta-(1->4)-D-Glc-beta-(1->4) D-Glc-beta-(1->6)]-2(or3)-O-Ac-D-Glc-alpha-(1->6)]n", + "5-hydroxymethyldeoxycytidylate", + "2-O-beta-D-glucopyranosyl-D-glucopyranose", + "(3R)-3-hydroxyacyl-[acyl-carrier protein]", + "(2E)-3-[2-(beta-D-glucopyranosyloxy)phenyl]prop-2-enoic acid", + "poly-alpha-L-guluronic acid", + "pelargonidin 3-O-beta-D-glucoside", + "2-methyl-6-phytyl-1,4-benzoquinone", + "ferricytochrome", + "3-aminopropanal", + "(-)-alpha-pinene", + "GlcNAc-beta-1,4-GlcNAc", + "[molybdopterin-synthase sulfur-carrier protein]-Gly-Gly", + "17,21-dihydroxy-5beta-pregnane-3,11,20-trione", + "hepatitis C virus NS5A protein", + "2 K+[side 1]", + "1-palmitoyl-2-linoleoylphosphatidylcholine", + "cytochrome c oxidase 4 isoform 1", + "plasmalogen", + "Quinaldate", + "ditrans,polycis-undecaprenyl phosphate", + "1-naphthyl sulfate", + "1D-myo-inositol 1,2,4,6-tetrakisphosphate", + "an S-alkylglutathione", + "1-phosphatidyl-1D-myo-inositol 1,3,4,5-tetrakisphosphate", + "cyanidin 3-O-beta-D-glucoside", + "lacticin 481/in", + "alpha,alpha'-trehalose", + "Ac-RTLK-7-amido-4-methylcoumarin", + "linalyl 6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranoside", + "apo C-phycocyanin beta-subunit", + "D-galactosamine 6-phosphate", + "pyrimidine", + "a long-chain alcohol", + "diphthine methyl ester-[translation elongation factor 2]", + "all-trans retinol", + "3-indoleacrylate", + "lipoamide", + "[RR06]-serine/threonine", + "5-methylcytosine50 in tRNAHis", + "phosphorylated Emi2", + "O-ureido-L-serine", + "4-methoxy-2-nitrobenzoic acid", + "HS-", + "adenosine-5'-diphospho-5'-[DNA]", + "(S)-1-hydroxy-N-methylcanadine", + "D-galactofuranosyl-(1->6)-beta-D-galactofuranosyl-(1->5)-beta-D galactofuranosyl-(1->6)-beta-D-galactofuranose", + "7-decanoylaminodesacetoxycephalosporanic acid", + "NTP", + "oligosaccharide cell wall fragments", + "aspartyl-tRNAAsn", + "phenylalanine/out", + "hesperitin-dihydrochalcon 7-O-beta-D-glucopyranoside", + "phytyl-bacteriochlorophyllide a", + "1,2-diacyl-lysophosphatidylethanolamine", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-leucyl-[RNP F protein]", + "beta-D-glucoside-6-phosphoglycerol", + "2-oxoglutaric semialdehyde", + "4-(beta-D-ribofuranosyl)aniline 5'-phosphate", + "3alpha,7alpha,12alpha-trihydroxy-5beta-cholestanoic acid", + "GagPol polyprotein", + "all-trans-retinyl palmitate", + "9'-O-acetyl-ganglioside GD3", + "2-cis,4-cis/trans-dienoyl-CoA", + "Glu-tRNAGln", + "histidine gammaH2A", + "p-methoxy-ethylamphetamine/out", + "taurine/in", + "9alpha-hydroxyprogesterone", + "L-Gln/in", + "3,4-dihydroxyphenylacetaldehyde", + "12-epi-hapalindole C", + "[beta-GlcNAc-(1 4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-6-N-(beta-D-Asp)-L-Lys-D-Ala-D-Ala)]n", + "(5Z,8Z,11Z)-14,15-dihydroxyeicosatrienoic acid", + "(R)-2-hydroxyacid", + "[histone H3]-L-lysine20", + "Renilla luciferin", + "phosphorylated PDGFRbeta", + "a (3E)-alk-3-enoyl-CoA", + "extracellular matrix components", + "cyclophilin A", + "N8-acetylspermidine", + "S-ribosylhomocysteine", + "beta-isorenieratene", + "procarboxypeptidase R", + "peptidylarginine deiminase 4", + "GHRH-RP", + "sulindac sulfide", + "[TRP channel protein TRPV5]-N-phospho-L-histidine", + "acyclovir/in", + "alpha Factor", + "glucagon peptide fragments", + "heptadecanoyl-CoA", + "halide", + "3-oxo-23,24-bisnorcholest-4-en-22-oyl-CoA", + "an ultra-long-chain di-unsaturated acyl-[acyl-carrier protein]", + "(8R,9Z,12Z)-8-hydroperoxy-9,12-octadecadienoate", + "5-amino-2-oxopentanoate", + "lamin A", + "n-octanal", + "15-demethoxy-aclacinomycin T", + "transcription factor FKHR", + "2 oxidized cytochrome cL", + "4-estrene-3,17-dione", + "phosphorylated bAD protein", + "TRIM39", + "N-acetyl-L-glutamate-gamma-semialdehyde", + "adenine37 in tRNA", + "factor VIIIa", + "(R)-3-hydroxydodecanoyl-[acyl-carrier protein]", + "gibberellin a1", + "2,6-xylidene", + "L-threonylcarbamoyl-AMP", + "phosphorylated OTUD5 protein", + "(1R)-1-phenylethane-1,2-diol", + "3-deoxy-D-arabinoheptulosonate 7-phosphate", + "oxidized ferredoxin Pet F", + "glycosphingolipid", + "Fuc-alpha-(1->2)-Gal-beta-(1->3)[Fuc-alpha-(1->4)]GlcNAc", + "glutathione-glyoxal hemithioacetal", + "shikimate 3-phosphate", + "23S rRNA pseudouridine1911/pseudouridine1915/pseudouridine1917", + "phospho-L-tyrosinyl-PAK1", + "(S)-4-hydroxymandelonitrile", + "methylene blue", + "4-chlorophenol", + "D-Man-alpha-(1->3)-D-Glc-beta-(1->4)-D-Glc-alpha-1 diphosphopolyisoprenol", + "luteinizing-hormone-releasing hormone", + "amphiregulin", + "purine", + "3-O-beta-D-galactosyl-N-acetyl-alpha-D-galactosaminyl-L-threonine [protein]", + "protein N5-alkylglutamine", + "(1,4-alpha-D-glucosyl)n-1", + "desulfated heparin", + "aminoacetaldehyde", + "N-(3-aminopropyl)cadaverine", + "interleukin-3", + "(9Z,11E,13Z)-octadeca-9,11,13-trienoyl-[glycerolipid]", + "Fuc-alpha-(1-3)-Glc", + "L-threonyl-tRNAThr2", + "5'-deoxy-5'-(3-(3-N N-dimethylamino)phenoxy)propyl-5'-methyl-5'-thioadenosine", + "N2-(2-carboxyethyl)-L-lysine", + "hypoxia-inducible transcription factor trans-4-hydroxy-L-proline", + "[Rubisco large subunit]-N6,N6,N6-trimethyl-L-lysine", + "3,5-dihydroxystilbene", + "gibberellin GA3-O(3)-beta-D-glucopyranoside", + "phosphorylated KbpA protein", + "[(1-4)-alpha-D-glucosyl]n", + "connexin36 protein", + "N-ethylglycine", + "protein AN5660", + "phosphorylated central M2 muscarinic receptor", + "2'-O-dimethylguanine26 in initiator tRNAMet", + "gamma-muurolene", + "artemisinic aldehyde", + "trans-o-hydroxybenzylidene pyruvic acid", + "anthranilyl-CoA", + "RCOOH", + "phenylacetyl-7-aminodeacetoxycephalosporanic acid", + "myosin I heavy chain phosphate", + "Pah1", + "2-amino-3-hydroxybenzoic acid", + "131-hydroxy-magnesium-protoporphyrin IX 13-monomethyl ester", + "4'-hydroxy-warfarin beta-D-glucuronoside", + "guanine26 in prolongator tRNAMet", + "adenosine 5'-monophosphate", + "integrin subunit alpha2", + "SOC1 protein", + "3-decanone", + "20-hydroxyarachidonic acid", + "methyl (indol-3-yl)acetate", + "2,3-bis(3-hydroxytetradecanoyl)-D-glucosaminyl-(1->6)-beta-D-2 3-bis(3-hydroxytetradecanoyl)-beta-D-glucosaminyl 1-phosphate", + "leucovorin/in", + "6,7-dimethyl-8-ribityllumazine", + "reduced glutathione[side 2]", + "thiamindiphosphate", + "6 (2S)-methylmalonyl-CoA", + "2 GDP", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-leucyl-[L-A double-stranded RNA virus major coat protein]", + "O-phospho-[tau-protein]", + "phosphorylated GhMPK7", + "bacteriopheophytin a", + "NrdH-redoxin", + "DNA containing a 7,8-dihydro-8-oxo-2'-deoxyguanosine:adenine mismatch", + "RNA helicase LGP2", + "pRb protein", + "LHR/CGR tyrosine O-sulfate", + "taurodeoxycholic acid", + "2-aminobenzoyl-CoA", + "nisin-(leader peptide)", + "S-(5-hydroxy-2-furoyl)-CoA", + "polyuronide", + "4 ferricytochrome c", + "DL-glycerol", + "[IkappaBbeta protein]", + "6 ferrocytochrome b5", + "DNA containing mismatches", + "adrenomedullin", + "2,3-diaminopropanoate", + "iron aerobactin/out", + "phosphorylated CEP89", + "fragments of eIF4GI", + "4-O-beta-D-mannopyranosyl-6-deoxy-6-fluoro-D-glucopyranose", + "cGMP/in", + "4,8-dimethylnonanoyl-CoA", + "2-octenoyl-CoA", + "acetylated chitosan polymer", + "beta-D-GlcNAc-(1->3)-[beta-D-GlcNAc-(1->6)]-beta-D-Gal-(1->4)-beta-D GlcNAc-R", + "AP-DNA", + "montanoyl-CoA", + "3-phosphooxypyruvate", + "phosphorylated rho", + "1-O-(2-amino-2-deoxy-alpha-D-glucopyranosyl)-D-myo-inositol", + "acid sphingomyelinase", + "1,4-benzoquinone", + "2-methyl-1-hexanol", + "a [reduced hydrogenase]", + "ADP-L-glycero-D-manno-heptose", + "indole-3-ethanol acetate", + "(E)-beta-caryophyllene", + "L-Ala-D-Glu", + "furosemide/in", + "5'-phospho-RNA", + "an [amino group carrier protein]-C-terminal-L-glutamate", + "methionine", + "xylo-oligosaccharides", + "EpdC signal peptide", + "3-dehydro-D-glucose", + "menadiol", + "guanine15 in tRNA", + "UDP-NAc-muramoyl-pentapeptide", + "2-nitrophenyl phosphate", + "germacrene C", + "(R)-linalool", + "threo-Ds-isocitrate", + "mycothiol bimane", + "C-terminal [mycofactocin precursor peptide MftA]-glycyl-3-amino-5-[(4-hydroxyphenyl)methyl]-4 4-dimethylpyrrolidin-2-one", + "valerianol", + "bisphenol A", + "N-butanoyl-L-homoserine lactone", + "DNA (lacking 6-O-methylguanine)", + "(4S,5S)-5-hydroxyectoine", + "Schardinger dextrins", + "(S)-styrene glycol", + "3-hydroxy-cis-cis-muconate", + "ketopantoyl lactone", + "membrane-bound inactive transcription factor fragment bZIP28X2", + "5-N-acetyl-9-O-acetyl-neuraminate", + "transcription regulators DELLA", + "Gly-Pro-4-nitroanilide", + "glycine ethyl ester", + "2 L-dehydroascorbic acid", + "all-trans-retinyl acyl ester", + "myosin bound to actin filament at position n", + "(S)-methylmalonyl-CoA", + "xanthurenic acid", + "N-methyl-L-glutamate", + "1-(9Z-octadecenoyl)-2-O-(5Z,8Z,11Z,14Z-eicosatetraenyl)-sn-glycerol", + "notoginsenoside R2", + "21-hydroxy-5alpha-pregnan-3,20-dione", + "phosphorylated Cprk", + "tetrasaccharide of two repeating units", + "[beta-D-fructosyl-(2->1)-]n+1", + "N-acetylglucosaminyl diphosphoryl-undecaprenol", + "3-(imidazol-5-yl)pyruvate", + "(R)-3-amino-2-methylpropanoate", + "decanoic acid", + "potato soluble starch", + "glucagon-like peptide 1 (7-37)", + "cannabidiolate", + "Bid", + "protein tyrosine kinase Yes", + "dolichyl 3-O-(2,3-diacetamido-2 3-dideoxy-beta-D-glucuronsyl)-N-acetyl-alpha-D-glucosaminyl phosphate", + "complement receptor", + "2-acetylaminophenol", + "S-farnesyl protein", + "[protein with EGF-like domain]-3-O-[alpha-D-xylosyl-(1->3)-beta-D-glucosyl]-L-serine", + "5,10-methenyltetrahydromethanopterin", + "ubiquinol-cytochrome c reductase complex core phosphoprotein 2", + "2 3-hydroxyanthranilic acid", + "beta-D-galactosyl-(1->4)-N-acetyl-D-glucosaminyl-R", + "17alpha-hydroxywithaferin A", + "fatty acid", + "1-acylglycerophosphocholine", + "3-solanesyl-4-hydroxybenzoate", + "pyrazole", + "3,4-dihydroxy-L-phenylalanine", + "factor IX", + "tRNA-2-thiouridine", + "sertraline", + "Mn2+", + "[AuA]-N6-acetyl-L-lysine75", + "5-methylcytosine49 in tRNAVal(AAC)", + "RX", + "1,2-dihydroxyheptane-3,4-dione", + "ent-atiserene", + "1-hydroxylycopene", + "DNA-1-ethanoadenine", + "10-epi-junenol", + "9-oxononanoic acid", + "(+)-bulbocapnine", + "osteoprotegerin", + "Cd x glutathione S2/cytoplasm", + "2,3-dimethyl-6-phytylbenzene-1,4-diol", + "glycolate", + "adenine in U6 lncRNA", + "8-O-methylsterigmatocystin", + "2-phenylethyl beta-vicianoside", + "2 dopamine", + "Gcn4 protein", + "phosphorylated Ste50", + "agar", + "protein Kre9", + "Luliberin", + "illudin M", + "N2-citryl-N6-acetyl-N6-hydroxy-L-lysine", + "a [homeodomain-interacting protein kinase 2]-L-tyrosine", + "beta-1,3-xylotriose", + "(3S)-3-hydroxyadipyl-CoA", + "N-terminal L-methionyl-L-glutaminyl-[influenza virus PA-X]", + "cyanidin 3-O-(6-O-caffeoyl)-beta-D-sambubioside", + "[acetylated histone H3 phosphoprotein]", + "pre-F1FO-ATP synthase", + "veratric acid", + "1,4,5,6-tetrahydro-6-oxonicotinate", + "CheY", + "antigen peptide[side 2]", + "1-carboxymethyl-4-hydroxy-cis-muconic semialdehyde", + "2'-deoxyribonucleoside", + "(4-methyl)zymosterone", + "vitamin K epoxide", + "M opsin", + "3-vinyl-8-propyl-12-ethyl-bacteriochlorophyllide d", + "2,3-dehydro-2,6-dimethylheptanoyl-CoA", + "1-oleoyl-sn-glycerol", + "Big-endothelin-1", + "CD154", + "5-methylcytosine1400 in 16S rRNA", + "2-(2-carboxy-4-methylthiazol-5-yl)ethyl phosphate", + "pulcherriminic acid", + "feruloyl beta-D-glucoside", + "N-acetyl-beta-D-hexosaminides", + "serum vitamin D3-binding protein", + "[molybdopterin-synthase sulfur-carrier protein]-Gly-Gly-AMP", + "a (3R)-3-hydroxyacyl-[acyl-carrier protein]", + "oxidized flavodoxin II", + "rosmarinate", + "Rap1b", + "2 17beta-hydroxy-5alpha-androstan-3-one", + "alpha-N-acetylneuraminyl-2,3-beta-D-galactosyl-1 4-beta-D-glucosyl-ceramide", + "ethionamide", + "insulin-like growth factor-II peptide fragments", + "GAG precursor protein of HIV-2", + "xylitol", + "5-methylcytosine27 in vtRNA1.3", + "kaempferol 3-O-beta-D-galactoside", + "quinine", + "DIBOA", + "3-hydroxybenzonitrile", + "beta-amyrin", + "dystrophin", + "(S)-naproxen", + "2-(4-methyl-1,3-thiazol-5-yl)ethyl phosphate", + "cytosine4( in tRNAPro(AGG)", + "limonin", + "[3-methyl-2-oxobutanoate dehydrogenase (acetyl-transferring)] phosphate", + "(+)-exo-5-hydroxycamphor", + "propofol beta-D-glucuronoside", + "L-formylkynurenine", + "(ADP-D-ribosyl)n-RhoA protein", + "oestrone 3-glucuronide", + "carboxylic acid amide", + "hydrolyzed single-stranded DNA", + "D-allose-[allose-binding protein][side 1]", + "[alpha-D-glucosyl-(1-3)]n", + "D-ribosyl-base1", + "ADP-D-ribosyl-(dinitrogen reductase) component of nitrogenase complex", + "2,3-Dihydroxybenzoate", + "netilmycin 2''-phosphate", + "2 ubiquinone-10", + "dTTP", + "carbapenem", + "2-hydroxystearoyl-CoA", + "L-His-L-Leu", + "5-amino-2-(4-amino-3-fluorophenyl)-6 8-difluoro-7-methyl-4H-1-benzopyran-4-one", + "N-acetyl-D-glucosaminyl-N-acetylmuramoyl-L-Ala-D-glutamyl-6-carboxy-L Lys-D-Ala", + "diacylglycerol kinase-zeta", + "Zn2+", + "Fe3+/out", + "procaspase-8", + "trans,octacis-decaprenylphospho-beta-D-erythro-pentofuranosid-2-ulose", + "alpha-ketoglutaramate", + "2-(4-aminophenyl)-1,3-benzothiazol-6-yl sulfate", + "butanaldehyde", + "3-methyl-1,2-didehydro-2,3-dihydrosqualene", + "pro-alpha-defensin-1", + "alpha-D-glucose 1-phosphate", + "AREG", + "(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E)-decaprenyl diphosphate", + "adenine22 in tRNA", + "(2S)-acetoin", + "NCX1", + "2-oxo-isovalerate", + "N-acetyl-D-glucosamine 6-phosphate", + "SETbeta", + "phosphorylated RNA polymerase II C-terminal domain", + "L-N-acetylphosphinothricin", + "heteroglycan", + "nocardicin E", + "synaptojanin I", + "O-D-mannosylprotein chitinase 1", + "TAFI", + "dolichyl stearate", + "ezrin", + "damaged DNA containing nucleotide cross-links", + "131-oxo-magnesium-protoporphyrin IX 13-monomethyl ester", + "[phosphate]n", + "N-acetyl-beta-D-glucosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-N-acetyl beta-D-glucosaminyl-(1->4)-[nascent hyaluronan]", + "TadE prepseudopilin", + "cleaved cohesin", + "OPN-L", + "(+)-cis,cis-nepetalactol", + "collagenase", + "glutaminase C", + "cytidine32/guanosine34 in tRNATrp", + "L-Val", + "O-phospho-L(or D)-serine", + "ethyl L-(+)-3-hydroxybutyrate", + "TRAP protein", + "amyloid-beta1-42", + "CMP-alpha-N-acetylneuraminate", + "16alpha-hydroxy-ent-kauranoate", + "oleic acid esterified to membrane lipid phosphatidylcholine", + "2 aclacinomycin N", + "7,8-dihydroxycoumarin", + "(12Z)-9,15-diepoxyoctadec-12-enoic acid", + "mature mRNA", + "isofucosterol", + "(2R,4S)-2-[(R)-[[(2R)-2-amino-2-phenylacetyl]amino](carboxy)methyl]-5 5-dimethyl-1,3-thiazolidine-4-carboxylic acid", + "9R,13R-12-oxo-phytodienoic acid", + "2-chloro-6-hydroxy-1,4-benzoquinone", + "primary alcohols", + "N3-methylcytosine32 in tRNAThr", + "(1R)-deacetylipecoside", + "palmitoyl-sn-glycerol", + "cyclo(L-leucyl-L-leucyl)", + "(S)-squalene-2,3-epoxide", + "monogalactosyldiacylglycerol", + "[histone H3]-N6,N6-dimethyl-L-lysine27", + "3-[(2E)-3,7-dimethylocta-2 6-dien-1-yl]-3-[(Z)-2-isocyanoethenyl]-3H-indole", + "guanine9 in tRNAThrCGU", + "cis/trans-zeatin", + "20alpha-hydroxyprogesterone", + "ATF6 protein", + "beta-1,3-xylan", + "[dicitrate-binding protein][side 1]", + "3-methylcyclohexene", + "reduced RNase", + "melanin", + "biliverdin IXa", + "gibberellin 12", + "cis-2-chloro-3-methyldienelactone", + "5'-phosphoribosyl-5-amino-imidazole-4-carboxamide", + "L-alanyl-tRNAAla", + "salvianin", + "2-pyrone-4,6-dicarboxylic acid", + "arabinogalactan", + "ubiquinone-6", + "TDP-4-amino-2,3,4,6-tetradeoxy-D-glucose", + "4-[bis(2-iodoethyl)amino]-phenylcarbonate", + "Bb fragment", + "cyanidin-3-O-[D-rhamnosyl-1,6-D-glucoside]-5-O-D-glucoside", + "myristoylated alanine-rich C kinase substrate", + "long-chain diacylglycerol", + "abscisic acid", + "N-arachidoylsphinganine", + "beta-D-glucosyl-5-hydroxymethylcytosine containing DNA", + "D-Ala", + "4-Chlorobenzoate", + "2-oxo-3-methylbutanoate", + "ethylene glycol chitin", + "2,3-didehydroadipyl-CoA", + "2-phenylacetamide", + "ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoate", + "synGAP", + "oxidized 2,6-dichloroindophenol", + "corn bran", + "5alpha-cholesta-8,14-dien-3beta-ol", + "cis-4-hydroxy-L-proline", + "chemotaxis receptors McpT L-glutamate", + "demethylmenaquinone", + "alpha-NADPH", + "7,2',3'-trihydroxy-8-methylisoflavone", + "4,4'-diapolycopene-4,4'-dial", + "an N-terminal-L-methionyl-L-threonyl-[protein]", + "N,N-dimethylaniline N-oxide", + "D-sedoheptulose 7-phosphate", + "blood group B glycoconjugate", + "alpha-D-5-phosphoribosyl 1-diphosphate", + "N5,N10-methylenetetrahydrofolate", + "3-oxo-2((2Z)-pentenyl)-cyclopentane-1-octanoic acid", + "HlyA protein", + "mitogen-activated protein kinase kinase 4", + "2 ferricytochrome c2", + "[SAMP]-Gly-Gly-AMP", + "3-aminopropionaldehyde", + "D-myo-inositol 4-phosphate", + "CXCR4 receptor", + "protocadherin gamma A11", + "i-ribitol", + "protein kinase Hs11", + "juvenile hormone III", + "GPIba", + "N-acetylneuraminate 9-phosphate", + "1,2-diacyl-lysophosphatidylcholine", + "formylkynurenine", + "L-serine O-3-phosphate", + "UDP-N-acetylmannosamine", + "2 L-rhamnopyranose", + "N-acetyl-alpha-D-glucosaminyl-diphospho-trans,octacis-decaprenol", + "Bovine serum albumin", + "SUMO-1 protein", + "3-hydroxy-N6,N6,N6-trimethyl-L-lysine", + "penicillin", + "cortisol", + "(R)-1-phenylethyl acetate", + "heat shock protein 70", + "5-methylcytosine49 in tRNAGly(CCC)", + "C/EBPalpha", + "N7-octanoyldeacetoxycephalosporin C", + "3-oxo-3-phenylpropanoate", + "UDP-2-acetamido-2,6-dideoxy-alpha-D-xylohex-4-ulose", + "nocamycin I", + "SGFRKME-EDANS", + "1-aminohexane", + "[Wnt3a]-L-serine", + "5'-dephospho-DNA", + "5'-dehydrouridine", + "diacylglycerol diphosphate", + "CMP-O9-acetyl-N-acetylneuraminate", + "propeptide of filaggrin", + "(S)-laudanine", + "tRNA uridine38/39", + "phosphorylated eukaryotic elongation factor 2 kinase", + "dimethylsulfonioacetate/out", + "phosphorylated TIA-1", + "1-methyl-4-phenyl-2,3-dihydropyridinium", + "meso-galactarate", + "mycophenolate", + "epithelial growth factor receptor", + "pre-alpha-onocerin", + "reduced electron-transfer flavoprotein", + "Fuc-alpha-(1->2)-Gal-beta-(1->3)-GlcNAc-beta-(1->3)-Gal-beta-(1 >4)GlcNAc", + "L-arginyl-[alpha-synuclein]", + "tetrahydropalmatine", + "thio-molybdenum cofactor", + "(S)-2-amino-1-hydroxyoctadecan-3-one", + "30-hydroxy-11-oxo-beta-amyrin", + "benzoylcholine", + "2-hydroxymuconic acid semialdehyde", + "5-methylcytosine69 in vtRNA1.1", + "2-dehydro-6-phosphogluconate", + "cystatin E", + "uridine 5'-N-arylphosphoramidate", + "sedoheptulose 1,7-bisphosphate", + "[histone H3]-N6,N6-drimethyl-L-lysine 4", + "6-O-alpha-D-glucosaminyl-1-[1 2-bis(hexadecanoyl)-sn-glycero]phospho-1D-myo-inositol", + "cysteamine N-oxide", + "putrescine-[putrescine-binding protein PotF][side 1]", + "17alpha-hydroxy-5alpha-dihydroprogesterone", + "3a-(2-amino-2-carboxyethyl)-4,5-dioxo-4,5,6,7,8,9-hexahydroquinoline-7 9-dicarboxylic acid", + "dCDP", + "a 3'-methoxyflavonoid", + "cholate", + "[sigma factor A]-Nomega-phospho-L-arginine", + "3'-end 3'-dAMP-labeled 5,6-dihydrouracil-guanine duplex", + "phosphorylated CENP-Q", + "2-methyl-4-amino-5-hydroxymethylpyrimidine", + "raucaffricine", + "phosphorylated Notch1 protein", + "naphthalene-cis-1,2-dihydrodiol", + "a [Klebsiella pneumoniae sulfatase]-L-serine", + "alpha-glucan", + "[E2 ubiquitin-conjugating enzyme UbcH5]-L-cysteine", + "2,6,6-trimethyl-4-oxocyclohex-2-ene-1-carbaldehyde", + "9,15,9'-tricis-zeta-carotene", + "4-hydroxy-cyclohexanone", + "histidine kinase Hik34 N-phospho-L-histidine", + "[optineurin protein]", + "reduced HycB", + "factor XIII", + "hypothiocyanous acid", + "glutathione S-transferase-tagged P-selectin glycoprotein ligand-1", + "3-amino-5-hydroxybenzoate", + "phosphorylated glycogen phosphorylase b", + "methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate", + "S-(leukotriene C4)glutathione[side 2]", + "2,3 oxidosqualene", + "2-Acetolactate", + "gellan", + "P-selectin glycoprotein ligand-1", + "uridylyl-[protein-PII GlnB]", + "4 flaviolin", + "Nomega-(ADP-D-ribosyl)-polyarginine", + "n-alkane", + "3-monovinyl chlorophyllide a", + "cis-zeatin", + "(ADP-D-ribosyl)n-beta-transducin repeat-containing protein", + "1D-myo-inositol 1,5-bis(diphosphate) 2,3,4,6-tetrakisphosphate", + "phosphorylated multifunctional protein CAD", + "methylthioalkyl glucosinolate", + "validone", + "[parkin]-Tyr143", + "S-acetyldihydrolipoamide", + "L-Seryl-tRNASec", + "cytidine34 in tRNA", + "5-hydroxycyclohex-1-ene-1-carbonyl-CoA", + "2-dehydro-3-deoxy-L-rhamnonate", + "an aliphatic amide", + "1-palmitoyl-sn-glycero-3-phosphocholine", + "[L-Asp(4-L-Arg)]n-Asp", + "succinate semialdehyde", + "Ebola virus VP30 protein", + "prostaglandin E1/in", + "3,4-dihydroxy-5-all-trans-hexaprenylbenzoate", + "GDP-4-keto-6-deoxy mannose", + "hexadecanoyl-CoA", + "2-amino-4-methylphenol", + "molybdate/out", + "N-acetyl-beta-D-mannosaminouronyl-(1->4)-N-acetyl-alpha-D-glucosaminyl diphospho-ditrans,octacis-undecaprenol", + "4-hydroxy-3-methoxy-benzaldehyde", + "6-deoxy-L-galactose 1-phosphate", + "D-glucopyranose", + "phosphorylated Pfmap2", + "beta-D-mannopyranose", + "Cd2+/in", + "a [methyl-coenzyme M reductase alpha-subunit McrA]-thioglycine465", + "ubiquitinyl-Smad3", + "ethoprophos", + "kappa-B nuclear factor", + "D-altrose", + "DL-2-hydroxyvalerate", + "phoenicoxanthin", + "geranylgeranyl diphosphate", + "heme", + "D-talose", + "1,2-dipalmitoyl-3-O-(beta-D-glucopyranosyl)-sn-glycerol", + "citrulline", + "Gly-Pro", + "D-serine", + "starch", + "cycloaraneosene", + "4 H2O2", + "2'-O-acyl-ADP-ribose", + "chemotaxin C5a", + "hydantoin", + "(2S)-2-amino-4-[[(1R)-1-carboxy-2-(1H-imidazol-4 yl)ethyl]amino]butanoate", + "tRNAGlu", + "a very-long-chain mannosyl-diphosphoinositol-(2'R)-2'-hydroxyphytoceramide", + "juvenile-hormone-III carboxylate", + "2-hydroxyglutarate", + "cytosine49 in tRNALys(UUU)", + "glutamine synthetase-AMP", + "[dihydrolipoyllysine-residue (2-methylpropanoyl)transferase] S-(2-methylpropanoyl)dihydrolipoyllysine", + "(3Z)-hex-3-en-ol", + "Fab determinants of IgA1", + "NPY", + "H2S", + "DSSTKR", + "3-Hydroxy-2-methylpyridine-4,5-dicarboxylate", + "TSH receptor O-sulfate", + "pyridoxamine", + "pilin", + "lipid IIA", + "chitin flakes", + "2-hydroxy-3,4-dioxoheptyl phosphate", + "a [methyl coenzyme-M reductase]-(5S)-C-methyl-L-arginine285", + "phenylacetothiohydroximate", + "glycoprotein alpha-L-fucosyl-1,2-D-galactose", + "7-hydroxy-warfarin", + "mono-beta-D-galactosylacylglycerol", + "O-isopropyl methylphosphonofluoridate", + "organic nitrite", + "incretin hormone", + "TatA", + "Ac-YISRRLL", + "D-glucosamine 6-phosphate", + "propeptide of membrane type-1 matrix metalloproteinase", + "L-galactonate", + "an N-terminal-methionyl-[SNC1 protein]", + "3-D-glucosyl-1,2-diacylglycerol", + "terephthalate", + "N-acetyl-beta-D-galactosaminyl-(1-4)-beta-D-glucuronosyl-proteoglycan", + "poly(Glu:Tyr) phosphate", + "(3Z)-hex-3-en-1-yl acetate", + "pro-peptide", + "[fibroblast growth factor receptor FGFR3]-L-tyrosine", + "androstanediol", + "U6 snRNAn", + "preterminal proteins", + "[(1->4)-beta-D-glucosyl]m-1-(1->4)-D-glucono-1,5-lactone", + "cytosine48 in tRNAGly(UCC)", + "2 arachidonate", + "2-deoxy-scyllo-inosose", + "1,25-dihydroxyvitamin D2", + "cytosine48 in tRNAHis(GUG)", + "ethyl beta-D-glucuronoside", + "L-leucine/in", + "pro-factor V", + "3-phospho-D-glyceroyl phosphate", + "heme[side 2]", + "4-hydroxyphenylethanal", + "5,10-methylene-5,6,7,8-tetrahydrofolate", + "monochloroethene", + "magnesium protoporphyrin IX 13-methyl ester", + "cyclohexanol", + "mature tmRNA", + "rac-4-hydroxynonenal", + "2'-deamino-2'-hydroxyparomamine", + "protein H", + "uracil20b in tRNA", + "component C3b", + "2-keto-4-hydroxypentanoate", + "N6-(dimethylallyl)adenosine 5'-diphosphate", + "N3-acetyldibekacin", + "6-hydroxymethyl-7,8-dihydropterin diphosphate", + "(S)-2-hydroxypropionic acid", + "pikromycin", + "phosphorylated phospholipase Cbeta3", + "N-(3-aminopropyl)-1,3-diaminopropane", + "biocytin", + "D-fructose 6-phosphate", + "core protein of classical swine fever virus", + "(12S)-HPETE", + "N-acetyl-Lys16-histone H4", + "2-acetyl-1-O-alkyl-sn-glycero-3-phosphoric acid", + "alpha-cellobiose", + "Prolipoprotein signal peptide", + "Galphai", + "apigenin", + "2,7-anhydro-alpha-N-acetylneuraminic acid", + "inactive Bid", + "1-C-(indol-3-yl)glycerol 3-phosphate", + "5-methylcytosine48 in tRNATyr(GUA)", + "N-formyl-L-methionine-polypeptide", + "ethyl (2R)-methyl-(3S)-hydroxybutanoate", + "methyl coenzyme M", + "CDP-ribitol", + "seryl-tRNASec", + "4-aminobenzoic acid hydrazide", + "[P35]-serine/threonine phosphate", + "Cav1.2", + "alpha-arylpropionate", + "malate", + "thylakoid protein", + "Raf-1", + "[SAMP3]-Gly-Gly-AMP", + "11-cis-retinyl-ester-[cellular-retinol-binding-protein]", + "glycine/in", + "[asialoglycoprotein]-(O-3-(beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->)))-L threonine", + "L-lactate", + "N-acetyl-alpha-D-glucosaminyl-(1->4)-beta-D-glucuronosyl-(1->4)-N acetyl-alpha-D-glucosaminyl-proteoglycan", + "[protein with EGF-like domain]-3-O-(beta-D-glucosyl)-L-serine", + "3-(methylthio)propionyl-CoA", + "demethylspheroidene", + "L-His", + "3,4-dihydroxy-2-methyl-4-[(2E,6E)-farnesyl]-3,4-dihydroquinoline 1-oxide", + "2 quinol", + "(S)-cholest-5-ene-3beta,24S-diol 3-sulfate", + "2'-deoxyadenosine 5'-phosphate", + "(5')ppPur-mRNA", + "nucleoside diphosphate kinase B", + "amyloid-beta protein 40", + "7 CO2", + "caspase-8", + "[eIF5A]-hypusine", + "chondroitin sulfate A", + "tristetraprolin", + "L-ornithine", + "L-Lys", + "S-methyl-5'-thioinosine", + "lithocholate", + "PIAS3", + "prepilin EpdA", + "phytosphingosine", + "phosphorylated Whi5 G1 protein", + "Spitz protein", + "2 (6aS,11aS)-3,6a,9-trihydroxypterocarpan", + "L-1-phosphatidylcholine", + "zidovudine beta-D-glucuronoside", + "Cadaverine", + "histone deacetylase 4", + "17beta-hydroxyandrost-4-ene-3,11-dione", + "5D-5-O-methyl-chiro-inositol", + "oleoyl-[acyl-carrier protein]", + "JNK2", + "3-sulfolactate", + "wheat graminan", + "2-nitrophenylamine", + "CEP164", + "quercetin 3,4'-disulfate", + "dodecanoyl-CoA", + "N,N-dimethylated casein-bound gamma-glutamine", + "5-methylcytosine38 in tRNAGlyGCC", + "beetle luciferin", + "N1-(gamma-Glu-L-Cys-Gly)-spermidine", + "ompA mRNA", + "lauryl aldehyde", + "troponins T", + "phosphorylated splicing factor 3", + "Precorrin-6X", + "[putrescine-binding protein PotF][side 1]", + "1H-imidazol-4-ylacetaldehyde", + "apo-[C-phycocyanin beta-subunit]", + "2-ethyldibenzothiophene", + "immunglobulin A1", + "[GalNAc-alpha-(1->4)]2-[Glc-beta-(1->3)]-[GalNAc-alpha-(1->4)]2-GalNAc alpha-(1->3)-Bac2,4diNAc-diphospho-tritrans,heptacis-undecaprenol", + "(5Z,9alpha,11alpha,13E,15S)-9,11,15-trihydroxyprosta-5,13-dienoate", + "12-epi-fischerindole G", + "diphenylsulfone", + "formiminoglycine", + "Ras", + "N-methyl-(R)-isosalsoline", + "zerumbone", + "L-leucyl-L-amino acid", + "reduced cytochrome c552", + "7-hexanoylaminodesacetoxycephalosporanic acid", + "fumarate", + "2-methylacetoacetyl-CoA", + "quercitrin", + "hydrogenobyrinic acid", + "pyrroloquinoline-quinone", + "tumor necrosis factor receptor superfamily member 21", + "(8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoyl-[glycerolipid]", + "ADP-beta-D-glycero-D-manno-heptose", + "lactose-6-phosphate", + "N-acetylgalactosaminoglycan", + "microtubule-associated protein 2", + "octanol", + "acrylamide", + "paspalic acid", + "5-aminopentanal", + "2-amino-5-chloro-benzonitrile", + "icariin", + "D-glutamine", + "n methanol", + "utrophin", + "2-deoxy-D-ribose 5-phosphate", + "epsilon-N-acyl-L-lysine", + "syringoyl beta-D-glucoside", + "calf skin collagen type I", + "2-fluoro-2-deoxyadenosine", + "gonadotropin-releasing hormone", + "5-(2-methoxy-2-oxoethyl)-2-thiouridine34 in tRNA", + "4-pregnen-3beta-ol-20-one", + "human neutrophil peptide-1", + "soluble calf-skin collagen", + "p-nitrophenyl 5'-nucleotides", + "laminaritriose", + "2 cyanidin", + "6-phospho-2-dehydro-D-gluconate", + "16-methoxytabersonine", + "abietadienes", + "phospho-L-tyrosinyl-Tc10/Cdc42 GTPase-activating protein", + "5-hydroxyundecanoyl-CoA", + "Arc", + "RNA polymerase II carboxy terminal domain", + "citrate (pro-3S)-lyase", + "[histone H3]-L-lysine9", + "5-hydroxymethyluridine", + "p130Cas", + "3-phospho-(R)-glycerate", + "D-cycloserine", + "(L-cysteinylglycin-S-yl)(1H-indol-3-yl)acetonitrile", + "(+)-didemethylpinoresinol", + "type-IV collagen", + "N6-(DELTA2-isopentenyl)adenine", + "reduced ferredoxin 1", + "2'-deoxyribonucleoside diphosphate", + "CLASP", + "2 FMN", + "3-phospho-D-serine", + "mannosyl-1-phospholipid", + "alpha-D-galactosyl-(1,3)-[alpha-L-fucosyl(1,2)]-D-galactosyl-R", + "D-glycerate", + "scopolamine", + "sirohydrochlorin", + "UDP-beta-L-arabinofuranose", + "diazaborine/cytoplasm", + "SmeZ", + "4-tyramine", + "dextran T10", + "5beta-cholestane-3alpha,7alpha-diol", + "phosphorylated C/EBPbeta", + "HopB1/in", + "grixazone B", + "Asp", + "a protein N6-(octanoyl)lysine", + "processed Mdm2", + "1-cyclopropyl-3,4-dihydroxybutane-1,2-dione", + "cholest-5-en-3-one", + "N4-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc]-L asparaginyl-[protein]", + "glycine betaine/in", + "Asn-tRNAAsn", + "3,5-dihydroxy-2-(3-methylbutanoyl)phenyl beta-D-glucopyranoside", + "[cystic fibrosis transmembrane conductance regulator protein]", + "(2R)-2-[(R)-carboxy-3,6-dihydro-2H-1 3-thiazine-4-carboxylic acid", + "adenine643 in 25S rRNA", + "2 reduced plastocyanin", + "2,2-dichloroethenol", + "[GST-IkappaBalpha phosphoprotein]", + "2,2,6-trimethyl-4-oxocyclohexane-1-carbaldehyde", + "4,5-dioxopentanoate", + "inactive complement component C3b", + "5alpha-cholestane-3beta,5alpha,6beta-triol", + "[DNA ligase]-N6-(5'-adenylyl)-L-lysine", + "N6-dimethyladenosine1779/N6-dimethyladenosine1780 in 18S rRNA", + "CoA-glutathione", + "3-beta-D-galactosyl-1,2-diacylglycerol", + "androsterone 3-O-beta-D-glucuronoside", + "fenoxaprop-P", + "phosphorylated cAMP-responsive element-binding protein", + "ceramide trihexoside", + "AfsR phosphoprotein", + "alpha/beta tubulin heterodimers", + "cytosine48 in tRNAGly(GCC)", + "(S)-aspartate-4-semialdehyde", + "1-oleoyl-2-palmitoyl-3-O-(beta-D-glucopyranosyl)-sn-glycerol", + "acetylsalicylic acid", + "valeric acid", + "androstenedione", + "RNAn", + "Benzoylformate", + "6-(N-acetyl-alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol", + "2 GTP", + "vitamin K hydroquinone", + "ginsenoside Rb3", + "cytosine49 in tRNAVal(AAC)", + "N2-methylguanine67 in tRNATrp", + "2-oxopantoate", + "L-carnitinyl-CoA", + "leukotriene E4/out", + "3alpha-hydroxy-5beta-androstane-17-one", + "coniferol", + "Fba protein", + "Man8GlcNAc2-[bovine ribonuclease B] (isomer 8A1,2,3B1,3)", + "2-dehydro-D-galactose", + "beta-cubebene", + "12alpha-hydroxy-3-oxochol-4,6-dien-24-oyl-CoA", + "Na+[side 1]", + "thymopentin", + "discadenine", + "10-deacetyl-10-butyrylbaccatin III", + "Mn2+/cis", + "Immunoglobulin", + "3',5'-cyclic GMP", + "quinol", + "m-hydroxybenzoate", + "anthranilic acid", + "bleomycin B2", + "2-oxopentanoate", + "6-hydroxy-3-cyanopyridine", + "2 reduced [2Fe-2S] ferredoxin", + "a [histone H3]-N6,N6-dimethyl-L-lysine4", + "(S)-4,5-dihydroxypentane-2,3-dione", + "peptide L-aspartate", + "CDP-2,3-bis-O-(geranylgeranyl)-sn-glycerol", + "DNAn+1", + "[acetyl-CoA carboxylase] phosphate", + "L-glutamate-gamma-semialdehyde", + "methylsulfonyl-D-cyclohexylglycyl-Arg", + "[protein]-L-asparagine-oligosaccharide", + "L-aspartic acid", + "7alpha,12alpha-dihydroxy-3-oxochol-24-oyl-CoA", + "STAT3 protein", + "dehydrotestosterone", + "5-methylcytosine34 in tRNA precursor", + "menaquinol", + "RseA protein", + "9-oxo-[8,12-cis]-prosta-5Z,10,14Z-trienoic acid", + "indol-3-ylmethyl glucosinolate", + "[histone H3]-N6,N6,N6-trimethyl-L-lysine9", + "cyclo[(Z)-alpha,beta-didehydrophenylalanyl-L-leucyl]", + "tRNAn", + "soluble superoxide dismutase 1", + "kynurenine", + "(+)-catechin hydrate", + "glycolaldehyde phosphate", + "calcium-independent phospholipase A2", + "CDP-1L-myo-inositol", + "membrane-anchored SNARE", + "5'-adenylyl sulfate", + "2-methylbutyryl-CoA", + "diclofop", + "2,3-(trans)-(+)-catechin", + "phosphorylated Raf-1 protein", + "[histone 2B]", + "oleoyl-[acyl carrier protein]", + "12-ethyl-8-propyl-3-vinylbacteriochlorophyllide d", + "signal peptides from preproteins", + "[tubulin]-(gamma-(poly-alpha-L-glutamyl)-L-glutamyl)-L-glutamate", + "[smooth muscle myosin light chain kinase]", + "Mca-KKPTPIQLN-Dnp", + "(-)-camphene", + "glycine-betaine", + "3-methoxybenzyl alcohol", + "phosphatidylinositol 5-monophosphate", + "hepatitis virus C polyprotein", + "2-methyl-3-hydroxybutyryl-CoA", + "propan-2-ol", + "Ca2+-ATPase", + "[PapA5]-serine/threonine phosphate", + "oligopeptide/out", + "[histone H2B]-L-lysine12", + "a peptide", + "2,4-dichlorophenyl acetic acid", + "shortened rhamnogalacturonan oligosaccharide containing one 4,5-deoxy-4,5-unsaturated D-galactopyranosyluronic acid at the non-reducing end", + "phosphorylated transcription factor FKHR", + "gamma-hydroxybutyrate", + "propanal", + "germanicol", + "4-oxonon-2-enal", + "propoxur", + "[E2 ubiquitin-conjugating enzyme UbcH5]-S-ubiquitinyl-L-cysteine", + "2,4-dichloroaniline", + "2-methylpropane-1,2-diol", + "monofluoroacetate", + "7-(3-methylbut-2-enyl)-L-tryptophan", + "nucleoside 2'-phosphate", + "metolachlor", + "[protein]-FMN-L-threonine", + "3'-phosphoadenylyl sulfate", + "3-hydroxyquinine", + "cyclic ADP-ribose", + "UMP", + "phosphorylated alpha1 beta-adrenergic receptor", + "collagen type XI", + "2-acetyl-6-(3-acetyl-2,4 6-trihydroxy-5-methyl-phenyl)-3-hydroxy-6-methyl-cyclohexa-2,4-dienone", + "DL-asparagine", + "phosphorylated claudin-3", + "pre-5S rRNA", + "MgAMP", + "1-phosphatidyl-1D-myo-inositol 3-phosphate", + "D-sorbitol 6-phosphate", + "galacturonic acid 1-phosphate", + "[Glu(-Cys)]n+1-Gly", + "23S rRNA pseudouridine2457", + "UDP-glucuronate", + "futalosine", + "amyloidbeta precursor protein", + "6-sulfo-alpha-D-glucosyl-1,6-alpha-D-glucosyl-1,6-alpha-D-glucosyl-1 3-1-O-alkyl-2-O-acylglycerol", + "beta-muricholic acid", + "7-methyl-GMP", + "[L-Asp(4-Arg)]", + "N-3-oxohexanoyl-L-homoserine-1,4-lactone", + "phospho-annexin 2", + "glutathionylspermidine", + "nicotineamide guanine dinucleotide", + "phosphorylated myosin-light chain kinase", + "leukotriene C4[side 1]", + "N-acetyl-alpha-D-glucosamine 6-phosphate", + "3-dehydro-6-deoxoteasterone", + "amyloid-beta", + "Phenol", + "(3)H-dehydroepiandrosterone", + "oleoyl-[glycerolipid]", + "D-2-methyl-3-oxopropionate", + "L-2-hydroxyglutarate", + "xenopsin", + "phosphorylated DREAM", + "lipoylprotein", + "DL-leucine", + "3-O-beta-cellotriosyl-D-glucose", + "DNA-1-ethenoadenine", + "glycoprotein-N-acetyl-alpha-D-galactosaminyl-(1,3)-[alpha-L-fucosyl-(1 2)]-D-galactose", + "DNA with 3'-alpha,beta-unsaturated aldehyde", + "L(or D)-serine", + "N3-acetylgentamicin", + "cyclohex-1-ene-1-carbonyl-CoA", + "7-chlorotetracycline", + "indane", + "(E)-(amino)methanesulfinic acid", + "D-allo-isoleucine", + "semaphorin-4B", + "mannosyl-alpha-(1,6)-mannosyl-alpha-(1,3)-[xylosyl-beta-(1 2)]-mannosyl-alpha-(1,4)-galactosyl-beta-(1,6)-mannosyl-alpha-(1 2)-inositol phosphorylceramide", + "an N-terminal-Nalpha-acetyl-methionyl-[RPM1 protein]", + "pro-Notch 1", + "apulose", + "adenine-43 in U6 snRNA", + "propane-1,2-diol-1-phosphate", + "trypsinogen pro-peptide", + "tRNA pseudouridine32", + "cyanophosphonic acid dimethylamide", + "chitobiosyldiphosphodolichol", + "desulfobenzylglucosinolate", + "chemo-attractant stromal-derived factor-1alpha", + "cocaine", + "synaptosome-associated protein SNAP-25", + "enzyme-MoIV", + "3-phosphoadenylylsulfate", + "DL-4-hydroxyphenylhydantoin", + "phospho-tyrosinyl-plakoglobin", + "SNAP-25", + "Neu5Acalpha-(2,3)-Galbeta-(1,4)-GlcNAcbeta-R", + "3-oxo-octanoyl-L-homoserine lactone", + "benzoylformic acid", + "taxadien-5alpha-yl acetate", + "N6-methyladenine in U6 pre-mRNA", + "c-Jun N-terminal kinase 3", + "5-hydroxymethylcytosine containing DNA", + "ubiquinone-8", + "ferrocytochrome c2", + "coronavirus polyprotein", + "phosphatidylcholine/out", + "protoviolaceinate", + "beta-cellobiose", + "phosphorylated cell division cycle 7", + "UDP-alpha-D-sulfoquinovopyranose", + "UDP-2-acetamido-2,6-dideoxy-beta-L-arabino-hexos-4-ulose", + "13-tigloyloxymultiflorine", + "1,2-benzoquinone", + "matrix metalloproteinase-1", + "a 1-stearidonoyl-2-acyl-[glycerolipid]", + "cis-stilbene oxide", + "Precursor proteins that have already been processed by mitochondrial processing peptidase", + "tricetin", + "DL-2-haloalkanoic acid", + "DNA-tetrahydro-2-furfurylguanosine", + "(2S,3S)-2,3-dihydro-2,3-dihydroxybenzoate", + "(ADP-D-ribosyl)-topoisomerase I", + "3 malonic semialdehyde", + "18-hydroxystearic acid", + "adenosylcob(III)alamin", + "feruloylacetyl-CoA", + "[cytosolic 6-phosphofructokinase]-tyrosine phosphate", + "1-acylglycerone 3-phosphate", + "methyl ferulate", + "3-O-[N-acetyl-beta-D-galactosaminyl-(1->3)-N-acetyl-beta-D-glucosaminyl (1->4)-alpha-D-mannosyl]-L-threonyl-[protein]", + "5,7-dihydroxy-2-methyl-4H-chromen-4-one", + "1-(2-bromophenyl)ethanone", + "sugar beet arabinan", + "8-sphingenine", + "(ADP-D-ribosyl)n+1-tyrosine kinase Syk", + "cholesta-5,7,24-trien-3beta-ol", + "toluene-2,4-dicarbamic acid dibutyl ester", + "D-2 -hydroxyisocaproate", + "2-dodecenoyl-CoA", + "3,3'-diiodothyronine", + "daunomycin", + "cis-p-coumarate", + "tauro-7-ketolithocholic acid", + "N3-acetyl-2-deoxystreptamine antibiotic", + "Fuc-alpha-(1-2)-Xyl", + "[protein]-(S)-2-amino-6-oxohexanoate", + "beta-L-aspartohydroxamic acid", + "4'-demethylrebeccamycin", + "D-ribulose 5-phosphate", + "dolichyl acetate", + "[elongation translation factor 2]", + "PSGL-1 protein tyrosine-O-sulfate", + "[Vibrio cholerae protein NqrC]-L-threonine", + "immunglobulin-alpha", + "mitochondrial aconitase", + "L-threonyl-[protein]", + "phosphorylated chemotaxis protein CheA", + "an N-terminal-Nalpha-acetyl-methionyl-[SNC1 protein]", + "2'-hydroxydaidzein", + "3-hydroxy-2-methylhexanoyl-N-acetylcysteamine", + "2-oxoethanal", + "(-)-5-epieremophilene", + "L-methionyl peptide", + "9-beta-D-arabinosyl-2-fluoroadenine", + "[protein]-trans-4-(beta-L-arabinofuranosyl)oxy-L-proline", + "Val-Asp-Val-Ala-Asp-7-amido-4-methylcoumarin", + "Tyramine", + "1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate", + "N-nonanoyl-6-aminopenicillanic acid", + "asperlicin E", + "(S)-3'-hydroxy-N-methylcoclaurine", + "5-methylcytosine50 in tRNAGlu(CUC)", + "norsolorinic acid anthrone", + "streptokinase precursor", + "Zn2+[side 2]", + "3 NADPH", + "procollagen C-propeptide", + "serine/arginine-rich protein 55", + "bloom syndrome helicase", + "3-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)benzenesulfonate", + "reduced lumiflavin", + "alpha,alpha-trehalose", + "magnesium protoporphyrin", + "iCF10 protein", + "(+)-(10R)-germacrene A", + "3-oxo-2-(2'(Z)-pentenyl)-cyclopentane-1 octanoic acid", + "phosphorylated procaspase-2", + "L-lysine/out", + "2-acetyl-1-alkyl-sn-glycero-3-phosphocholine", + "5-hydroxyundec-cis-2-enoyl-CoA", + "4-aminobutanoate", + "dTDP-4-dehydro-6-deoxy-L-mannose", + "integrin alphaIIbbeta3", + "4-methylbenzyl alcohol", + "GSH-conjugated 4-hydroxy-2-nonenal/in", + "protein dithiol", + "alpha2-macroglobulin", + "[PTEN]-N6-acetyl-L-lysine", + "all-trans-zeta-carotene", + "beta-D-glucosaminyl-(1->4)-N-acetyl-D-glucosamine", + "oxidized coenzyme F420", + "coenzyme Q1", + "mycophenolate mofetil", + "2,2'-bis(2,3-dihydro-3-oxoindolyliden)", + "beta-adrenergic receptor", + "aldose", + "a cardiolipin", + "[eukaryotic translation initiation factor 2]", + "supercoiled DNA", + "glucagon-like peptide", + "benzaldehyde", + "beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide", + "phosphoprotein", + "acetylated ATM kinase", + "nicotinamide mononucleotide", + "fragments of versican V1", + "4-(N-succino)-5-aminoimidazole-4-carboxamide ribonucleotide", + "17-(4-hydroxyphenyl)heptadecanoate", + "cholic acid", + "methylmalonate", + "sapienate", + "S-(2,4-dinitrophenyl)glutathione/cytoplasm", + "nucleoside 3'-phosphates and 3'-phosphooligonucleotides and 2',3'-cyclic phosphates", + "sn-glycerol", + "2 acetate", + "10-desacetyltaxuyunnanin C", + "4-methylumbelliferyl alpha-L-iduronide", + "[factor VII protein with EGF-like domain]-L-serine", + "n-alkanol", + "a (hydroxy)phthioceranyl-[(hydroxy)phthioceranic acid synthase]", + "complement component C3bB", + "6-(alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol", + "2'-O-acetyl-ADP-ribose", + "a [histone H3]-N6,N6,N6-trimethyl-L-lysine4", + "alpha-D-mannopyranose", + "diosgenin 3-O-beta-D-glucopyranoside", + "fragments of Rec8", + "L-2-hydroxyalkanoic acid", + "(1R,2S)-1,2-dihydronaphthalene-1,2-diol", + "sulfate/out", + "profilin", + "arbutin", + "biuret", + "arachidonic acid", + "C16-carnitine[side 2]", + "mannosyl-rhamnosyl-galactose-1-diphospholipid", + "11a-hydroxydemeclocycline", + "delphinidin 3-O-(6''-O-malonyl)-beta-D-glucoside", + "3-furonitrile", + "phylloquinol", + "chlorate", + "heme o", + "diethylstilbestrol", + "[phosphate]n-1", + "phosphorylated Smo", + "[peptide chain release factor 1 or 2]-N5-methyl-L-glutamine", + "PACSIN protein", + "adhesion molecule CD3246", + "8,9-epoxyeicosatrienoic acid", + "gp130", + "(3R)-linalool", + "Uroporphyrinogen III", + "N-acetyl-D-galactosaminyl-alpha-(1->3)-N N'-diacetyl-alpha-D-bacillosaminyl-diphospho-tritrans heptacis-undecaprenol", + "(1R,2R,4S)-limonene-1,2-diol", + "apo-[methylmalonyl-CoA:pyruvate carboxyltransferase]", + "[histone H3]-N6,N6,N6-trimethyl-L-lysine 36", + "pantetheine 4'-phosphate", + "alpha-L-Fuc-(1-6)-D-GlcNAc", + "2-(4-cyanophenyl)-1,3-benzothiazol-6-yl sulfate", + "U6 snRNAn+1", + "ceramide 1-phosphate", + "(31RS)-3-(1-hydroxyethyl) bacteriochlorophyllide a", + "2-[(3S)-3-carboxy-3-(methylamino)propyl]-L-histidine-[translation elongation factor 2]", + "thrombospondin", + "(2S)-5,7,4'-trihydroxyflavanone", + "(5Z,9E,11Z,14Z)-(8S)-8-hydroperoxyicosa-5,9,11,14-tetraenoate", + "proform caspase-8", + "ginsenoside C-O", + "(2R,3S)-butane-2,3-diol", + "pro-endothelial monocyte-activating polypeptide II", + "2'-aminobiphenyl-2,3-diol", + "D-Gln", + "(7S,8S,9Z,12Z)-7,8-dihydroxy-9,12-octadecadienoate", + "EEEIAAL", + "2-heptyl-3-hydroxy-4(1H)-quinolone", + "DRVYIHP", + "phospho-tyrosinyl-Shc protein", + "ClpS adaptor", + "S-aminomethyldihydrolipoylprotein", + "C-terminal [mycofactocin precursor peptide MftA]-glycyl-L-valyl-4-[2-aminoethenyl]phenol", + "2-(4-aminophenyl)-1,3-benzothiazol-6-ol", + "(-)-trans-isopiperitenol", + "12alpha-hydroxy-3-oxochol-4-en-24-oyl-CoA", + "protein TCF3", + "alpha-amyrin", + "[protein DsbE] with reduced L-cysteine residues", + "compound O", + "(-)-kaurenoic acid", + "NPLP4 protein", + "[disabled-1 adaptor protein]-L-tyrosine", + "[AuA]-N6-acetyl-L-lysine125", + "2,4,5-trichloro-2,5-cyclohexadiene-1-ol", + "6-Methylsalicylate", + "2-(acetylamino)-4-O-[2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl]-2 deoxy-beta-D-glucopyranose", + "phytenic acid", + "maltose/in", + "oxidized putidaredoxin", + "protein C inhibitor", + "[octamer-binding protein 4]-L-threonine", + "6-phospho-beta-D-glucosyl-(1->4)-D-glucose[side 2]", + "methacrylyl-CoA", + "maltodextrin", + "12-dehydrotetracycline", + "fluconazole/in", + "UDP-N-acetyl-alpha-D-galactosamine", + "casein macropeptide", + "Glycolate", + "4-Carboxymethyl-4-methylbut-2-en-1,4-olide", + "an N-terminal-glycyl-[protein]", + "apo-H protein", + "beta-amyloid peptide 40", + "[periplasmic sulfatase AtsA]-3-oxo-L-alanine", + "pseudotropine", + "cortisol 21-sulfate", + "cis-1,2-dihydroxy-4-methylcyclohexa-3,5-diene-1-carboxylate", + "2-acetohydroxybutyrate", + "N-hexanoyl -L-homoserine lactone", + "2,4-dihydroxy-3-(hydroxymethyl)-6-methylbenzoic acid", + "UDP-MurNAc-L-Ala-D-Glu-L-Lys-D-Ala", + "6-deoxyerythronolide b", + "phosphorylated claspin", + "S2O32-", + "phosphatidylinositol-3,4-bisphosphate", + "cytosine1402 in 16S rRNA", + "20-O-beta -D-xylopyranosyl-1,6-beta-D-glucopyranosyl-20(S)-protopanaxadiol", + "2 biliverdin", + "retinyl-beta-glucuronide", + "(S)-7,8-styrene oxide", + "delphinidin 3-O-(4-coumaroyl)-rutinoside 5-O-beta-D-glucoside", + "leucocyanidin", + "dolichyl diphosphooligosaccharide", + "pilin EpdA", + "hexanoate", + "arachidic acid", + "[histone H3]-N6-methyl-L-lysine4", + "1D-myo-inositol 3,4,6-trisphosphate", + "glutathione-[glutathione-binding protein][side 1]", + "[beta-catenin]-Nomega-methyl-L-arginine", + "[Wnt3]-L-serine", + "phosphinomethylmalate", + "Staphylococcus aureus strain Xen29 cell wall", + "5-N-acetylneuraminic acid", + "carboxypeptidase D", + "phytanate", + "eriodicytol-7-beta-D-glucopyranoside", + "5-aminolevulinate", + "2'-deoxyguanosine", + "(2S)-2,3,4,5-tetrahydropyridine-2,6-dicarboxylic acid", + "dNTP", + "Leu-Leu", + "fenthion", + "2,8-dimethyldibenzothiophene-5,5-dioxide", + "3-methyl-cis,cis-hexadienedioate", + "p-mtRNAHis", + "very low density lipoprotein", + "10-deacetyl-2-debenzoylbaccatin III", + "histone deacetylase 3", + "4-coumaric aldehyde", + "DIBOA beta-D-glucoside", + "(ADP-D-ribosyl)n-P2X7 ion channel", + "[branched-chain keto-acid dehydrogenase (acetyl-transferring)] phosphate", + "uridine54 in tRNA", + "2-hydroxy-2-(hydroxymethyl)-2H-pyran-3(6H)-one", + "quercetin 3-sulfate", + "NO3-/in", + "[pyruvate dehydrogenase (lipoamide)]", + "phosphorylated Hot1p", + "N-carbamoylputrescine", + "15,9'-dicis-phytofluene", + "2-hydroxy-5-methyl-3,4-dioxohexyl phosphate", + "C20:0-ceramide", + "tiglyl-CoA", + "N-terminal-L-methionyl-L-phenylalanyl-[Arl3 protein]", + "phosphorylated dystrophin Dp71d", + "D-proline betaine", + "Hg", + "adenosine 3'-5'-bisphosphate", + "5-phospho-alpha-D-ribose 1-diphosphate", + "a [pre-mRNA]-containing guanosine-adenosine", + "(E)-1-propenylsulfenic acid", + "2 ferricytochrome b5", + "type III inositol 1,4,5-trisphosphate receptor", + "phosphorylated synaptojanin I", + "dimethyl sulfoxide", + "dichlorodimedon", + "2 feruloyl-CoA", + "mycophenolic acid-phenyl-glucuronide", + "D-galactosylglycosaminoglycan", + "cyclohexan-1,2-dione", + "kaempferol 3-O-glucoside", + "cimetidine", + "9-hydroxy-1,4-androstadiene-3,17-dione", + "pro-matrix metalloprotease 2", + "BMP4", + "hexadec-11-enoic acid", + "TraJ", + "(S)-stylopine", + "fibrillarin", + "arabinoxylan", + "[PABP1]-Nomega,Nomega-dimethyl-L-arginine", + "cefotaxime", + "[ring canal protein]-L-tyrosine phosphate", + "N-acetyl-L-amino acid", + "dithiane", + "cyanidin 3-O-[6-O-(6-O-4-hydroxycinnamoyl-beta-D-glucosyl)-2-O-beta-D-xylosyl beta-D-galactoside]", + "1-phosphatidyl-1D-myo-inositol 1,3,4-trisphosphate", + "exo-alpha-bergamotene", + "peptidyl-glycine", + "cytosine48 in tRNAThr(UGU)", + "1-H-indol-3-yl-acetaldehyde", + "7-dehydro-17alpha-hydroxypregnenolone", + "but-2-enoyl-CoA", + "tricaprylin", + "S-[(Z)-N-hydroxy(phenyl)acetimidoyl]-L-glutathione", + "ssDNA/pppdN(pdN)n-1 hybrid", + "L-methionine-polypeptide", + "S-geranylgeranyl-Rap1A", + "integrin alphaVb3", + "azilsartan medoxomil", + "77- and 35-RNA fragments", + "enterostatin", + "pro-dynorphin", + "3,3',4',5,7,8-hexahydroxyflavone", + "isolichenin", + "(S)-3-hydroxy-3-methyl-5-oxovaleric acid", + "CLE-RS1", + "Escherichia coli O86 antigen bound to farnesyl diphosphate", + "O-acetyl-L-Ser", + "Mg2+[side 2]", + "2,4-dichlorophenyl acetonitrile", + "methyl 4-tolyl sulfide", + "(R)-3-hydroxytetradecanoyl-[acyl-carrier protein]", + "unc mRNA", + "beta-maltose", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-lysyl-[protein]", + "7-oxosteroid", + "NDP-glucose", + "bisdemethoxycurcumin", + "indol-3-yl-pyruvate", + "arabinooligosaccharide", + "bis(diphospho)-1D-myo-inositol tetrakisphosphate", + "calpain 10", + "neomycin 2''-phosphate", + "phosphorylated bloom syndrome helicase", + "2-monoacylglycerol", + "L-galactono-1,5-lactone", + "DsrC-S-S-DsrC", + "ferrocytochrome P-450", + "a [histone H3]-N6-methyl-L-lysine79", + "immunoglobulin G", + "keto-(4-hydroxyphenyl)pyruvate", + "cdc2", + "phosphorylated SIV/17E-Fr Nef protein", + "Staphylococcus aureus cell wall", + "extracellular regulated kinase 2", + "isoliquiritigenin", + "polymannuronic acid exopolysaccharide", + "ferricytochrome b1", + "Aggrecan core protein", + "roxithromycin", + "1-palmitoyl-2-acyl-[glycerolipid]", + "bilirubin IXalpha", + "(9Z)-N-ethyloctadec-9-enamide", + "a [protein]-L-cysteine", + "L-galactono-1,4-lactone", + "4 oxidized ferredoxin [iron-sulfur] cluster", + "reduced lipoamide", + "dihydrostreptomycin", + "interleukin-21", + "1-(2-carboxyphenylamino)-1-deoxy-D-ribulose 5-phosphate", + "surface CD43", + "KQGQPMY", + "aminoacyl-tRNA2", + "N1-methyladenine9 in tRNATrp", + "[PurA]-serine/threonine phosphate", + "[DNA-directed RNA polymerase]", + "lovastatin acid", + "[phosphate-binding protein][side 1]", + "sarpagine", + "1-aminocyclopropane-1-carboxylic acid", + "a long-chain acyl-LipD", + "dITP", + "L-2-aminoadipic acid", + "protein tyrosine", + "RGS protein phosphate", + "insulin receptor kinase substrate 1", + "bromide", + "N-acetyl-9-O-acetyl-neuraminate", + "Oleic acid", + "potato amylopectin type III containing alpha-1,6-glucosidic linkages", + "theanine", + "lipid hydroperoxide", + "2-oxoglutarate semialdehyde", + "5-amino-1-(5-phospho-beta-D-ribosyl)imidazole", + "ADP-5-ethyl-4-methylthiazole-2-carboxylate", + "phosphorylated Smad", + "oxidized flavodoxin I", + "Ni-sirohydrochlorin", + "glycolaldehyde", + "2-dehydro-3-deoxy-D-glucose", + "2-methyl-1,4-benzoquinone", + "adenyl-[glutamine synthetase]", + "dibekacin 2''-phosphate", + "2(alpha-D-mannosyl)-3-phosphoglycerate", + "1-aminocyclopropane-1-carboxylate", + "cobalt-precorrin-6Y", + "oxidized thioredoxin", + "beta-D-glucosyl-5-hydroxymethylcytosine-containing DNA", + "phosphorylated G-protein-coupled receptor", + "[GlcNAc-(1-4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala)]n+1 diphosphoundecaprenol", + "1-O-alkyl-2-acetyl-sn-glycerol", + "(S)-2-methylbutanoyl-CoA", + "cinnamoyl-CoA", + "5'-deoxyinosine", + "insulin-like growth factor II", + "2-(9Z,12Z-octadecadienoyl)-glycerol", + "cytidine4 in tRNAPro", + "desferrioxamine/out", + "3-hydroxypropionyl-CoA", + "Campylobacter jejuni heptasaccharide bound to undecaprenyl diphosphate", + "an S-substituted N-acetyl-L-cysteine", + "D-glycero-beta-D-manno-heptose 1,7-bisphosphate", + "delphinidin 3,5-di-O-beta-D-glucoside", + "histone H3-N6,N6,N6-trimethyl-L-lysine36", + "adenine in MAT2A hairpin 1", + "(S)-2-[5-amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxamido]succinate", + "ethyl (3S)-hydroxybutanoate", + "(S)-3-(dimethylamino)-1-(2-thienyl)-1-propanol", + "synthetic peptide corresponding to residue 69-77 of actin", + "D-glyceraldehyde", + "[factor VII protein with EGF-like domain]-3-O-(beta-D-glucosyl)-L-serine", + "(6E,8Z,11Z,14Z)-(5S)-5-hydroperoxyeicosa-6,8,11,14-tetraenoate", + "indole-3-nitrile", + "8-oxo-7,8-dihydroguanine", + "[tRNAIle2]-cytidine34", + "L-arabinose-[arabinose-binding protein][side 1]", + "2-[4-dimethylaminophenyl]-1,3-benzothiazol-5-ol", + "(2S)-2-hydroxypropyl-CoM", + "3 (R)-methylmalonyl-CoA", + "ubiquinol-6", + "9-beta-D-arabinosyl 2-fluoroadenine", + "sym-homospermine", + "2-acetylphloroglucinol", + "extracellular signal-regulated kinase", + "2-hydroxycinnamate", + "26-hydroxycholesterol", + "an N-methylamine", + "D-glucose disaccharides", + "1,6-anhydro-N-acetylmuramic acid-tripeptide", + "a 2-(long-chain-fatty acyl)-3-mycolipenoyl-trehalose", + "branched glucooligosaccharides", + "tyramine", + "raffinose", + "4-carboxy-2-hydroxymuconate semialdehyde", + "3''-deamino-3''-oxonicotianamine", + "phosphorylated Mig1 protein", + "cobalt-factor II", + "7-hydroxy-warfarin beta-D-glucuronoside", + "beta-glucan", + "benzylamine", + "cleaved Scc1", + "monoanhydrobacterioruberin", + "DNA containing an adenine:7,8-dihydro-8-oxoadenine mismatch", + "kanamycin", + "FKBP8", + "4-acetamidophenol", + "[DsbA protein] carrying a disulfide bond", + "2-hexadecyl-1-alkyl-sn-glycero-3-phosphocholine", + "chitosan pentasaccharide", + "high-molecular-weight kinin", + "big endothelin fragment 22-38", + "2',2'-difluorodeoxycytidine 5'-phosphate", + "[prokaryotic ubiquitin-like protein]-L-glutamine", + "chermerin chem158K", + "D-alanyl lipoteichoic acid", + "zeta-carotene", + "p-coumaryl alcohol", + "coenzyme gamma-F420-2", + "azocasein", + "UDP-N-acetyl-alpha-D-muramoyl-L-alanyl-gamma-D-glutamyl-meso-2 6-diaminoheptanedioate", + "2'-O-succinyl-ADP-ribose", + "gamma-L-glutamyl-L-amino acid", + "phosphorylated ubiquitin ligase Nedd4-2", + "(3R)-3-hydroxy-2-oxo-4-phosphooxybutanoate", + "pteroylpolyglutamate", + "azilsartan", + "(S)-beta-macrocarpene", + "[cullin]-N6-[NEDD8-protein]-yl-L-lysine", + "dTDP-2-deoxy-beta-L-fucose", + "riboflavin", + "23S rRNA uridine2457", + "(20beta)-20-hydroxypregn-4-en-3-one", + "insulin growth factor-binding protein 5", + "pseudonigeran", + "7,8-dihydroneopterin 2',3'-cyclic phosphate", + "alpha-D-glucosylglycogenin-1", + "linolenic acid hydroperoxide", + "D-glycerol 3-phosphate", + "(2S)-2-amino-4-deoxychorismate", + "D-xylose 1-phosphate", + "luteolin 7-O-beta-D-glucuronide", + "DL-2-hydroxyisovalerate", + "3'-phosphoadenylyl-sulfate", + "phosphatidylinositol", + "arabitol", + "factor XIIa", + "trans-12-octadecen-9-ynoic acid", + "trihydroxycoprostanate", + "13 isopentenyl diphosphate", + "arsenite", + "1-oleoyl-2-acyl-[glycerolipid]", + "methylated RNA bacteriophage MS2", + "Nomega-(ADP-D-ribosyl)-agmatine", + "CD40L", + "cis-(2R,3S)-dihydroxy-1-phenylcyclohexa-4,6-diene", + "Salmonella enterica O antigen bound to undecaprenyl diphosphate", + "9,10-epoxy-18-hydroxy octadeca-(12Z)-eneoic acid", + "mannose", + "an N-terminal Nalpha-acetyl-L-methionyl-L-asparginyl-[protein]", + "Phosphoenolpyruvate", + "thymine in single-stranded DNA", + "L-xylitol", + "adenine in NANOG mRNA", + "1-alkenyl-glycero-3-phosphorylcholine", + "isochamigrene", + "1,2-ethanediol", + "adenosylcob(III)yrinic acid a,c-diamide", + "N-acetyl-L-glutamyl 5-phosphate", + "4 2-imino-3-(7-chloroindol-3-yl)propanoate", + "glutaconyl-1-CoA", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-leucyl-[RNP H protein]", + "gp120 protein", + "S-(hydroxynonenyl)glutathione[side 1]", + "eIF2Bepsilon", + "4-hydroxymandelate", + "9H-carbazole", + "silybin B 20-O-sulfate", + "thiamine", + "polygalacturonate", + "3 levan", + "(2-aminoethyl)phosphonate", + "globotetraosylceramide", + "2-aminophenol", + "N-terminal-Nalpha-acetyl-L-methionyl-L-phenylalanyl-[Arl3 protein]", + "3-deoxy-D-arabino-heptulosonate 7-phosphate", + "(S)-nicotine N1-oxide", + "Procollagen type I", + "1-O-(1-hydroxyalkyl)-sn-glycerol", + "tropomyosin 2beta", + "douple-stranded DNA", + "(ADP-D-ribosyl)n-tyrosine kinase Btk", + "7-ethoxyresorufin", + "[(1->4)-alpha-D-galacturonide]n-1", + "7-methylguanosine 5'-phosphate", + "ALDH2 protein", + "TusE-SH", + "streptothricin-D", + "5'-OH DNA", + "Sda1", + "3-hydroxydecanoyl-[acyl-carrier protein]", + "aclacinomycin T", + "5-methylcytosine34 in tRNALeu(CAG) precursor", + "4-methoxycinnamaldehyde", + "Gli1 protein", + "5-methylcytosine38 in Q34tRNAAsp", + "p41 helicase", + "xanthine-mismatched single-stranded DNA", + "2 ferricytochrome c", + "2 5'-deoxyadenosine", + "(+)-catechin", + "prolyl endopeptidase", + "ferricytochrome c(H)", + "holo-[glycyl-carrier protein]", + "4-penten-1-ol", + "prepeptide of epidermal growth factor receptor", + "type IV Flp1 prepilin leader peptide", + "soluble amyloid precursor protein alpha fragment", + "desulforedoxin", + "a [DsbA protein] carrying a disulfide bond", + "beta-1,4-D-glucosamine tetrasaccharide", + "3 toluene", + "pyridin-1-ium-3,5-dicarboxylate mononucleotide", + "3beta,12alpha-dihydroxy-5beta-cholan-24-oic acid", + "long-chain carboxylate", + "2-methylbenzyl alcohol", + "Collagen", + "5-hydroxymethyl cytosine beta-D-glucoside", + "adhesin CTRP", + "hypoxia-inducible factor-proline", + "dsRNA", + "N-acetyl-alpha-D-galactosaminyl-epidermal growth factor receptor", + "CTP:phosphoethanolamine cytidylyltransferase", + "Cu+", + "dynorphin A", + "midkine", + "[ring canal protein]-L-tyrosine", + "1-palmitoyl-sn-lysophosphatidylcholine", + "dihydroceramide", + "chlorpyrifos oxon", + "a 1,2-diacyl-3-O-(beta-D-glucopyranosyl)-sn-glycerol", + "lactotrehalose", + "a [histone H3]-N6,N6-dimethyl-L-lysine36", + "tRNALys", + "protein p165", + "2'-O-methylcytidine56 in tRNALeu(UAG)", + "mannose 1-phosphate", + "mouse CXCL-2", + "methoxysuccinyl-Ala-Ala-Pro-Val", + "(E)-1-(glutathion-S-yl)-N-hydroxy-2-(1H-indol-3-yl)ethan-1-imine", + "11,12-dihydroxyeicosatrienoic acid", + "[p57Kip2]-L-tyrosine", + "a pyrimidine nucleoside", + "junctional adhesion molecule A", + "butan-2-ol", + "mitogen-activated protein kinase kinase-1", + "holo-[L-seryl-carrier protein]", + "N-acetyl-D-cysteine", + "1-O-alpha-D-glucopyranosyl-D-fructofuranose", + "aldehydic forms of oleuropein aglycone", + "4-chloroacetanilide", + "bacteriopheophorbide a", + "2-methylpentanal", + "4-hydroxymandelonitrile", + "lupanine", + "butanoyl-CoA", + "1-methyladenosine", + "[TRP channel protein TRPV5]-L-histidine", + "nitrated DNA", + "L-erythrulose", + "dihydrochalcone", + "N-palmitoyl-D-sphingosine", + "ergothioneine", + "3-(5-oxoisoxazolin-2-yl)-L-alanine", + "vezatin", + "2-chloro-3-methylmaleylacetate", + "2 glutamate", + "prostaglandin D2", + "thiacetazone", + "glycogen synthase kinase-3", + "sterol ester", + "1-methoxy-1'-hydroxyneurosporene", + "cytosine49 in tRNA", + "ent-kaur-16-ene-19-al", + "beta-estradiol", + "3'-end 3'-dAMP-labeled 5,6-dihydrothymine-adenosine duplex", + "3-aminobutanoate", + "a [histone H3]-N6,N6-dimethyl-L-lysine27", + "Xaa-peptide", + "3'-hydroxy-larreatricin", + "acryloyl-CoA", + "phosphatidylserine[side 1]", + "1,2-propanediol", + "prunasin", + "ROOH", + "uridylyl-GlnB", + "3-hydroxy-4-trimethylammoniobutanoate", + "taurocholate 3-sulfate", + "5-amino-6-(1-D-ribitylamino)pyrimidine-2,4(1H,3H)-dione", + "2-(3,4-dihydroxybenzoyloxy)-4,6-dihydroxybenzoate", + "compound Y", + "2 H+ +", + "macrophage-derived chemokine", + "pre-interleukin-1beta", + "n-heptanol", + "RhdA-SSH", + "[branched-chain a-keto acid dehydrogenase (acetyl-transferring)] phosphate", + "histone H3-N6-methyl-L-lysine36", + "N-3-hydroxybutyryl-L-homoserine-1,4-lactone", + "L-seryl-tRNASer", + "(3S)-2-oxo-3-phenylbutanoate", + "N-acetyl-LL-2,6-diaminopimelic acid", + "5-diphospho-1D-myo-inositol 1,2,3,4,6-pentakisphosphate", + "2'-NADP+", + "(-)-(S)-limonene", + "deoxyadenosylcobalamin", + "N-3-oxododecanoyl-L-homoserine lactone", + "coagulin", + "3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)propanoate", + "alpha-D-glucosylglycogenin-2", + "1-oleoyl-sn-lysophosphatidylethanolamine", + "16 oxidized ferredoxin [iron-sulfur] cluster", + "Southampton viral polyprotein precursor p113", + "N-behenoylsphingosine", + "(S)-homoserine lactone", + "streptomycin 2''-phosphate", + "deoxyribonucleotide", + "phosphorylated Rga2 protein", + "complement component C5b", + "guanidinoproclavaminic acid", + "a 21-hydroxysteroid", + "18 H+", + "oryzalexin D", + "2-fluoro-6-hydroxycyclohexa-1-ene-1-carbonyl-CoA", + "2 semiquinone", + "1,2-dioleoyl-3-palmitoylglycerol", + "1-(3-bromophenyl)ethanol", + "blood group antigen", + "fragments of fibronectin", + "phosphatidylcholine[side 2]", + "twitchin", + "eEF2", + "N-acetyl-D-glucosaminyl-1,3-beta-D-galactosyl-1,4-D-glucosylceramide", + "statherin", + "endothelin 1", + "delta-aminolevulinic acid-[dipeptide-binding protein DppA][side 1]", + "2 beta-D-glucose", + "Substance P", + "N-acetyl-L-aspartic acid", + "carboxynorspermidine", + "L-leucine[side 2]", + "3'-O-methyltricetin", + "(E)-4-hydroxyphenylacetaldoxime", + "a-factor", + "N1,N8-bis(glutathionyl)spermidine", + "hyaluronan oligomers", + "(2S)-2,3-diaminopropionate", + "5,5'-diferulic acid", + "alpha-D-xylose 1-phosphate", + "Manalpha(1-6)GlcNAc", + "(R)-reticuline", + "(RS)-tetrahydropapaverine", + "5-O-beta-D-mycaminosyltylactone", + "2-chlorophenol", + "a phosphatidyl-glycerol", + "Tau phosphoprotein", + "17alpha-hydroxyprogesterone", + "3-alpha-mycarosylerythronolide B", + "N1-(gamma-L-glutamyl-L-cysteinyl-glycyl)-spermidine", + "beta-glucuronidase peptide", + "glucosyl ceramide", + "3-methoxy-4-hydroxy-trans-cinnamate", + "lacto-N-fucopentaitol III", + "a 5'-(N7-methyl 5'-triphosphoguanosine)-(purine-ribonucleotide)-[mRNA]", + "N-acetyl-beta-D-glucosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-[nascent hyaluronan]", + "parathion", + "7-heptanoylaminodesacetoxycephalosporanic acid", + "(ribonucleotide)n-2'-phosphate", + "3-[(E)-2-isocyanoethenyl]-1H-indole", + "adhesin Rh1", + "5-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde", + "(L-prolyl)adenylate", + "S-(2-methylpropanoyl)-CoA", + "18S-E pre-rRNA", + "2,3,6-trichlorohydroquinone", + "dihydropterin-sulfamethoxazole", + "alkylnitrile", + "cis-2,3-dihydroxy-2,3-dihydro-p-cumate", + "4-nitrophenyl beta-D-glucoside", + "4-O-beta-D-galactopyranosyl-D-glucose", + "fatty acyl CoA/cis", + "Nedd4", + "2 ferrocyanide", + "tRNA1", + "Alfa-crystallin B N5-pentylglutamine", + "[DsbB protein] with reduced L-cysteine residues", + "Man7GlcNAc2-[ricin A-chain-transmembrane-Leu2]", + "UDP-glucose", + "L-methionine[side 2]", + "[dihydrolipoyllysine-residue succinyltransferase] S-succinyldihydrolipoyllysine", + "(2Z,6E)-farnesyl diphosphate", + "complement component C3a", + "Protocatechuic acid", + "3-oxofumonisin B3", + "2-methyl-1-hexadecanoyl-CoA", + "inositol tetrakisphosphate", + "polysaccharides", + "factor X", + "2-heptanol", + "1,6-dihydro-beta-NADPH", + "cytosine34 in mitochondrial tRNAMet precursor", + "beta-L-arabinose 1-phosphate", + "1,2-dihydro-beta-NADH", + "[KRAB-associated protein 1]-Nomega,Nomega'-dimethyl-L-arginine", + "20-hydroxy-prostaglandin", + "immunglobulin Fab", + "cis-cyclohexa-3,5-diene-1,2-diol", + "Dabcyl-KTSAVLQ", + "1-(5-phosphoribosyl)-4-(N-succinocarboxamide)-5-aminoimidazole", + "4-(trimethylamino)butyrate", + "an aromatic amino acid", + "3alpha,7alpha,12alpha-trihydroxy-5beta-cholestanate", + "2-oxohexanoate", + "(-)-pinoresinol", + "brewers spent grain", + "L-arabino-gamma-lactone", + "growth hormone releasing hormone-(1-44) fragment", + "2,4-dinitrophenyl-S-glutathione[side 1]", + "2,3-dichlorpropane-1-ol", + "S-(1-butenyl)-L-cysteine sulfoxide", + "2 5'-GMP", + "hercynine", + "a reduced acceptor", + "pro-caspase-2", + "dTDP-4-dehydro-2,3,6-trideoxy-alpha-D-hexopyranose", + "(R)-(+)-2-chloropropionamide", + "peptidyl-amino-tRNA2", + "3-geranyl-3-[(Z)-2-isocyanoethenyl]-1H-indole", + "(2S,3R,4S)-4-hydroxy-isoleucine", + "7,8-dihydropteroate", + "CDPribitol", + "phosphorylated Btk", + "pre-16S rRNA", + "mRNA containing N6-methyladenine", + "lysophosphatidate", + "dsDNA", + "4 FADH2", + "4-(2-aminoethyl)benzenesulfonylfluoride/out", + "[(R)-3-hydroxybutanoate](n+1)", + "1,2-diacyl-lysophosphatidylinositol", + "4,5-9,10-diseco-3-hydroxy-5,9,17-trioxoandrosta-1(10),2-diene-4-oic acid", + "3alpha-hydroxypregn-4-en-20-one", + "3-dehydrocarnitine", + "growth hormone-(1-43) fragment", + "(2-hydroxyethyl)phosphonate", + "quercetin 3,3',7-trissulfate", + "abieta-7,13-dien-18-oate", + "2-amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine diphosphate", + "fibrinogen 1", + "2-chlorodienelactone", + "clusterin", + "2 flavocytochrome b2", + "desulfosinigrin", + "cytosine48 in tRNAPhe(GAA)", + "an S-(1-hydroxy-2-oxopropyl)-[protein]-L-lysine", + "L-cysteine", + "3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dien-1-yl]propanoic acid", + "isomaltose", + "3',4',5-trihydroxy-3,6,7-trimethoxyflavone", + "histone H3 N6,N6-dimethyl-L-lysine4", + "monoacetylphloroglucinol", + "3-methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-one", + "glycan-phosphatidylinositol", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-leucyl-[protein]", + "chelerythine", + "phosphoraletd NADPH oxidase 5", + "peptidyl-(2-hydroxylglycine)", + "chemerin chem162R", + "N-octanoyl-6-aminopenicillanic acid", + "[beta-subunit of heterotrimeric G-protein]-L-histidine", + "adenosine 5-phosphosulfate", + "8-demethyl-8-(2,3-O-dimethyl-alpha-L-rhamnosyl)-tetracenomycin C", + "beta-NADH", + "4-nitroaniline", + "alpha-muurolene", + "glycerophosphoinositol", + "cylindrospermopsin", + "alpha-D-Man-(1->6)-[alpha-D-Man-(1->3)]-beta-D-Man(1->4)-beta-D-GlcNAc (1->4)-D-GlcNAc", + "2-cyanopyridine", + "phospho-Ca2+-ATPase", + "L-phenylalanyl-tRNA(Leu)", + "Msmeg1704 in", + "[MAP2 protein]-serine/threonine phosphate", + "thiosulfate", + "5-hydroxy-4-imidazoleacetate", + "protopanaxadiol aglycone", + "4-hydroxy-3,5-dichlorobiphenyl", + "Thr-Gly-Leu-Phe-Gln", + "[DsbB protein] carrying a disulfide bond", + "3-[(3aS,4S,7aS)-7a-methyl-1 5-dioxo-octahydro-1H-inden-4-yl]propanoyl-CoA", + "butanoyl phosphate", + "discoidin domain receptor 1", + "N1-acetylnorspermidine", + "crotonyl-CoA", + "(ADP-D-ribosyl)n+1-aryl hydrocarbon receptor", + "unfolded actin", + "N-benzoylanthranilate", + "polyphosphate700", + "galactolipid", + "N-arylamines", + "propan-2-one", + "L-5,10-methylenetetrahydrofolate", + "(1R,2S)-1-hydroxybutane-1,2,4-tricarboxylate", + "Gly-Pro-glycinamide", + "2'-O-methylcytidine4 in tRNAPro", + "RGS protein", + "NrdH-redoxin disulfide", + "active tBid", + "acetyl-CheY", + "coenzyme B", + "cholesterol oleate", + "gibberellin 44", + "alpha-2 spectrin", + "7-methylguanine1405 in 16S rRNA", + "1-oleoyl-2-alpha-linolenoyl-lysophosphatidylcholine", + "5-phosphoribosylamine", + "D-2-aminoadipic acid", + "phosphorylated MAP kinase", + "5-amino-1(5-phospho-D-ribosyl)imidazole", + "3-methylglutaconyl-CoA", + "8-oxo-GMP", + "4-hydroxytryptamine", + "protein N-phospho-L-histidine", + "gibberellin 5", + "a 7-(dihydroxymethyl)bacteriochlorophyllide c", + "glyphosate", + "L-carnitine", + "a plasmanylethanolamine", + "dehydroisocoproporphyrinogen", + "(3,5-dihydroxyphenyl)(oxo)acetate", + "(S)-3-hydroxyacyl-CoA", + "voriconazole", + "[protein]-N5-(O3-phosphono-D-fructosyl)-L-lysine", + "Dopamine", + "3'-C-ethynylcytidine", + "5'-phospho-dsRNA", + "6 methylmalonyl-CoA", + "UDP-monosaccharide", + "2'-O-methylguanosine2922 in 27S pre-rRNA", + "2,6-diamino-4-hydroxy-5-formamidopyrimidine:Cyt oligodeoxynucleotide", + "beta-citryl-L-glutamate", + "thebaine", + "cytidine1409 in 16S rRNA", + "rho-7 protein", + "beta-hexachlorocyclohexane", + "MtuA protein", + "amyloid beta peptide fragments", + "adhesin Rh2b", + "16S rRNA pseudouridine516", + "Remazol Brilliant Blue-dyed starch", + "mature epidermal growth factor receptor", + "galactose", + "mature bone morphogenetic protein-4", + "Kemptide", + "pVIc", + "L-Rhamnose", + "2 quinone", + "(1S,4S)-4-hydroxy-3-oxocyclohexane-1-carboxylate", + "coagulation factor VIII", + "angiotensin-II", + "2 fragments of complement C4", + "reduced cytochrome c-551", + "Forssman glycolipid", + "an N-terminal L-alanyl-[S5 protein of 30S ribosome]", + "[RNA 3'-phosphate cyclase]-L-histidine", + "prothrombin 1", + "[receptor-protein] phosphate", + "morphine 3-O-beta-D-glucuronoside", + "a DELTA5,7-sterol", + "[ribosomal protein L3]-L-glutamine", + "2 acetyl-CoA", + "2-amino-4-oxopentanoate", + "chemotaxis protein CheA", + "L-allo-isoleucyl-S-[CmaA peptidyl-carrier protein]", + "indol-3-ylacetyl-myo-inositol", + "2,6-bis(N-acetyl-beta-D-glucosaminyl)-alpha-D-mannosyl-R", + "central M2 muscarinic receptor", + "p120 protein", + "beta-D-galactopyranosyl-(1->3)-N-acetyl-D-glucosamine", + "1-methylnicotinamide", + "[protein]-S-myristoyl-L-cysteine", + "16 ATP", + "3-hydroxyaminophenol", + "[amino group carrier protein LysW]-gamma-alpha-aminoadipate", + "6-hydroxycyclohex-1-enecarbonyl-CoA", + "2-aceto-2-hydroxybutyrate", + "P1-P3-bis(5'-adenosyl) triphosphate", + "Gly", + "NF-M", + "large isoform of Mgm1", + "octadecanal", + "alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D glucosamine", + "prostacyclin synthase", + "4-coumaroylquinate", + "ATG16L1", + "benzydamine", + "8-oxo-GTP", + "indole-3-ethanol", + "N4-(2-acetamido-2-deoxy-beta-D-glucopyranosyl)-L-asparagine", + "phenyl sulfate", + "trans-anol", + "NMN", + "2-hydroxychromene-2-carboxylate", + "alpha2,3-sialyl N-acetyllactosaminyl-R", + "phosphorylated MOS1 protein", + "HIV Tat", + "melanopsin", + "5-epi-valiolone 7-phosphate", + "selenate", + "UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-N6-(L-alanyl)-L-lysyl-D-alanyl D-alanine", + "D-3-phosphoglycerate", + "[GAP-43 protein]-S-palmitoyl-L-cysteine", + "phosphorylated parkin", + "N1-methyladenine670 in 25S rRNA", + "xanthan", + "cyanidin 3-O-beta-D-sambubioside", + "L-histidine", + "flurbiprofen", + "(3E)-phycoerythrobilin", + "trans-4-hydroxytamoxifen", + "triglucosyl-(2,3-dihydroxybenzoylserine)3", + "(methylthio)methane-sulfenic acid", + "reduced flavin", + "an N-terminal-L-alanyl-[protein]", + "tryptamine dione", + "cyclopentanone", + "2 D-galactose", + "adiponitrile", + "transforming growth factor-beta N5-alkylglutamine", + "precursor of basic vacuolar chitinase", + "1-pyrroline-5-carboxylate", + "D-Man-alpha-(1->3)-D-Glc-beta-(1->4)-D-Glc-alpha-1-diphosphopolyprenol", + "urocortin", + "soluble starch containing alpha-1,6-glucosidic linkages", + "beta-D-galactosyl-(1->4)-N-acetyl-beta-D-galactosaminyl-(1->3)-beta-D galactosyl-(1->4)-D-glucosyl-(1<->1)-ceramide", + "5''-phosphoribostamycin", + "2 reduced acceptor", + "(2R)-5-[(acetyloxy)methyl]-2-[(R)-[[(2E)-2-(2-amino-1 3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino](carboxy)methyl]-3 6-dihydro-2H-1,3-thiazine-4-carboxylic acid", + "hydrolyzed casein", + "DNA (containing O6-chloroethylguanine)", + "phosphorylated protein kinase C", + "ceftizoxime/in", + "alpha1-adrenergic receptor phosphate", + "(2E,4E)-2,4-dichlorohexa-2,4-dienedioate", + "(5Z)-N-(2-hydroxyethyl)-7-[(1R,4S,5R,6R)-6-[(1E 3S)-3-hydroxyoct-1-en-1-yl]-2 3-dioxabicyclo[2.2.1]hept-5-yl]hept-5-enamide", + "geranyl 6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranoside", + "LEVD", + "beta,chi-carotene", + "CREBH protein", + "alpha-(1-6)-glucosyl cyclohexaamylose", + "5'-terminal oligonucleotide", + "pre-SceD protein", + "vesicle-associated membrane protein", + "S-methyl-L-methionine", + "activated prostasin", + "5-O-[(E)-feruloyl]-[O-beta-D-xylopyranosyl-(1-2)]-O-alpha-L-arabino furanosyl-[1-3]-O-beta-D-xylopyranosyl-(1-4)-D-xylopyranose", + "1D-myo-inositol 4,5-bisphosphate", + "polypeptide", + "obscurin phosphate", + "S-methyl-1-thio-D-xylulose 5-phosphate", + "ent-sandaracopimara-8(14),15-diene", + "D-Man-alpha-(1->3)-D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-GlcNAc diphosphodolichol", + "glycolithocholate 3-sulfate", + "a linoleate-esterified acylceramide", + "3-O-(6-deoxy-alpha-L-galactopyranosyl)-beta-D-galactopyranose", + "methanesulfinate", + "kallidin", + "homo-L-cysteine thiolactone", + "hyaluronate", + "formamide", + "D-citrulline", + "CoM", + "cytosine48 in tRNALys(CUU)", + "thioredoxin 3 disulfide", + "benzoyl-S-CoA", + "tetrahymanol", + "thiacetazone carbodiimide", + "biglycan", + "a linoleate-containing triacyl-sn-glycerol", + "(2R,3S)-3-isopropylmalate", + "[protein phosphatase 6 catalytic subunit]-leucine", + "N-acetyl-D-glucosamine-diphosphorylundecaprenol", + "1-oleoyl-lysophosphatidic acid", + "[TSH receptor]", + "5-O-(1-carboxyvinyl)-3-phosphoshikimate", + "Ac-RKLL", + "(R)-2-(2-naphthyl)propionate", + "(9Z,12Z)-hexadeca-9,12-dienoic acid", + "5-amino-6-ribitylamino-2,4-(1H,3H)-pyrimidinedione", + "(S)-4-hydroxymandelonitrile beta-D-glucoside", + "chondroitin 4,6-bissulfate", + "alpha-isomerized C-telopeptide", + "nervonoyl-CoA", + "membrane-bound carcinoembryonic antigen", + "3'-phosphooligonucleotides", + "DNA (without 6-O-carboxymethylguanine)", + "glutaredoxin disulfide", + "(R)-mandelonitrile", + "Man-alpha-(1-2)-Man-alpha-(1-6)-[Man-alpha-(1-2)-Man-alpha-(1-3)] Manalpha-(1-6)-[Man-alpha-(1-2)-Man-alpha-(1-2)-Man-alpha-(1-3)]-Man beta(1-4)GlcNAc", + "tRNAHis", + "3,5,6-trichloropyridin-2-ol", + "[(4-D-Ala)-(2-GlcNAc)-Rib-ol-P]n-[Gro-P]m-ManNAc-GlcNAc-PP peptidoglycan", + "insulin-like growth factor-binding protein-2", + "glycano-(2 6-alpha-N-acetylneuraminyl)-(N-acetyl-D-galactosaminyl)-glycoprotein", + "glutamate-gamma-semialdehyde", + "4-hydroxybenzaldehyde", + "2-methyl-3-phytyl-1,4-naphthoquinone", + "[Wnt5a]-L-serine", + "monokine induced by IFN-gamma", + "UDP-D-galactopyranose", + "1D-myo-inositol-1,3,4-trisphosphate", + "insulin-like growth factor binding protein-3", + "N-acetyl-beta-D-mannosaminyl-1 4-N-acetyl-D-glucosaminyldiphosphoundecaprenol", + "alginate", + "mature rRNA", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-leucyl-[mTOR protein]", + "palmitoleic aldehyde", + "TRPC3", + "(6R)-6-(L-erythro-1,2-dihydroxypropyl)-5,6,7 8-tetrahydro-4a-hydroxypterin", + "vesicle-associated membrane protein-2", + "gelsolin", + "(5Z,8Z,10E,14Z)-(12S)-12-hydroxyeicosa-5,8,10,14-tetraenoate", + "cytosine48 in tRNASer(CGA)", + "CARMA1", + "poly(A)-mRNA", + "a [Co(I) dimethylamine-specific corrinoid protein]", + "1-phenylpropan-2-one", + "3-oxochola-4,6-dien-24-oyl-CoA", + "disaccharides of alginate", + "[histone H4R3]-Nomega,Nomega'-dimethyl-L-arginine", + "disulfide of insulin A and B chains", + "N2-succinyl-L-ornithine", + "9-hydroxy-10-oxo-12-octadecenoic acid", + "vesicle-associated membrane protein-3", + "N6-dimethyladenine1518/N6-dimethyladenine1519 in 16S rRNA", + "sphingosine-1-phosphate/out", + "(9Z,11E)-(13S)-13-hydroperoxyoctadeca-9,11-dienoate", + "Tic40", + "(S)-mandelamide", + "2-naphthoate", + "alpha-ketoglutarate", + "beta-D-galactosyl-(1->3)-[N-acetyl-beta-D-glucosaminyl-(1->6)]-N-acetyl alpha-D-galactosaminyl-R", + "protein kinase Cdelta", + "2-naphthyl sulfate", + "5alpha-androstane-3,17-dione", + "D-fructose 2-phosphate", + "L-threo-3-hydroxyaspartate", + "diethylamine", + "bicyclogermacrene", + "S-formylmycothiol", + "9-alpha,11-beta-prostaglandin F2", + "D-glucose-1-phosphate", + "alpha-linolenoyl-[glycerolipid]", + "L-glutamate 5-phosphate", + "pectins", + "homo-L-cysteine", + "pilin PilC", + "Ni(II)-pyridinium-3,5-bisthiocarboxylate mononucleotide", + "(R)-allantoin", + "(R)-3-((R)-3-hydroxybutanoyloxy)3butanoate", + "reduced flavodoxin II", + "uracil-mismatched DNA", + "p-cumic aldehyde", + "DELTA8-trans/cis-C-20-phytosphingenine", + "[Rv0019c]-serine/threonine", + "folic acid pentaglutamate", + "growth hormone-releasing hormone", + "tRNA-uridine", + "N6-alkylaminopurine-7-beta-D-glucoside", + "(11aS)-7,8-dimethoxy-1,2,3,10,11,11a-hexahydro-5H-pyrrolo[2,1-c][1 4]benzodiazepin-5-one", + "membrane-acceptor", + "muramyl dipeptide/out", + "2-methylpropanamine", + "caffeoyl aldehyde", + "a 5'-ribonucleotide", + "(+)-valencene", + "bisdemethoxy-curcumin", + "S-geranylgeranyl-protein", + "trans-2-octenoyl-CoA", + "hormone-sensitive lipase", + "phosphorylated phosphorylase kinase", + "thyroxine", + "electron accceptor", + "9-hydroperoxy octadecadienoic acid", + "[histone H3]-N6,N6-dimethyllysine36", + "phytyl diphosphate+ bacteriochlorophyllide a", + "guanine9 in tRNAThrAGU", + "pyranoside", + "propyl-2-nitronate", + "phosphorylated phosphofructokinase 2", + "kallikrein 11", + "Immunoglobulin A", + "D-arabino-2-hexosulose", + "Dimethylamine", + "single-chain tissue-type plasminogen activator", + "(2S)-2-methylacyl-CoA", + "mucin-2", + "3beta-hydroxy-4alpha-methyl-5alpha-cholest-7-ene-4beta-carboxylate", + "Fucalpha1-2Galbeta1-4Glc", + "tetracenomycin C", + "docosenal", + "3'-deoxymononucleotides", + "8 NADP+", + "Neu5Acalpha-(2,3)-Galbeta-(1,4)-[Fucalpha-(1,3)]-GlcNAcbeta-R", + "N-acetylanthranilic acid", + "3-chloro-4-methylumbelliferone", + "a [histone H3]-N6,N6-dimethyl-L-lysine79", + "albendazole S-oxide", + "oxo acid", + "N4-[N-acetyl-beta-D-glucosaminyl-(1-2)-alpha-D-mannosyl-(1-3)-[N-acetyl beta-D-glucosaminyl-(1-2)-alpha-D-mannosyl-(1-6)]-beta-D-mannosyl-(1-4) N-acetyl-beta-D-glucosaminyl-(1-4)-[alpha-L-fucosyl-(1-3)]-N-acetyl beta-D-glucosaminyl]asparagine", + "ethenocytosine-mismatched double-stranded DNA", + "foot-and-mouth disease virus capsid precursor (P1-2A)", + "alpha-glucopyranose", + "chenodeoxycholyltaurine/in", + "NeuAcalpa(2->6)Galbeta(1->4)GlcNAc-R", + "N-acetyl-D-glucosaminyl-phosphatidylinositol", + "[voltage-gated sodium channel NaV1.5]-L-arginine", + "pyrogallate", + "hydrolyzed iota-carrageenan", + "trehalose", + "indan-1-one", + "[heparosan]-D-glucuronate", + "3,6-anhydro-L-galactonate", + "5-carboxylcytosine", + "N-stearoylsphingosine", + "S-L-allo-isoleucyl-[CmaD-protein]-4'-phosphopantetheine", + "caspase-1", + "N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-N-acetyl beta-D-glucosaminyl-R", + "beta-copaene", + "2-(4-nitrophenyl)-1,3-benzothiazol-6-yl sulfate", + "FAT1", + "AMAK", + "a flavone 7-O-beta-D-glucoside", + "(-)-beta-santalene", + "beta-chitin", + "Manalpha(1-6)[Manalpha(1-3)]Manalpha(1-6)[Manalpha(1-)]Manbeta(1 4)GlcNAc", + "maltono-1,5-lactone", + "2-chloro-4-methylhexa-2,4-dienedioate", + "8-vinyl chlorophyllide a", + "beta-D-4-deoxy-DELTA4 5-GlcAp-(1->4)-beta-D-Glcp-(1->4)-alpha-L-Rhap-(1->3)-beta-D-Glcp", + "2-aminophenylmalonate", + "N-methylglycine", + "caldopentamine", + "2-[(2-aminoethylcarbamoyl)methyl]-2-hydroxybutanedioate", + "phosphorylated nuclear factor-kappaB", + "L-tyrosine", + "protein-(SSG)2n", + "xanthosine 5'-phosphate", + "epimedin C", + "2-deoxy-D-galacto-hexodialdose", + "[prokaryotic ubiquitin-like protein]-L-glutamate", + "5-hydroxymethyl-uracil-mismatched double-stranded DNA", + "vitamin K1 2,3-epoxide", + "2 ethynylbenzene", + "mycobilin b", + "type II procollagen", + "7-epi-alpha-selinene", + "wyosine", + "(ADP-D-ribosyl)n+1-NEMO protein", + "diferulic acid", + "Muc2", + "BID", + "L-aspartate", + "3-nitro-O4-sulfo-L-tyrosine", + "3-hydroxyacyl-[acyl-carrier protein]", + "16alpha-hydroxyprogesterone", + "N-acetylisoniazid", + "1,3,8-trihydroxynaphthalene", + "1,3-dimethylxanthine", + "(S)-norlaudanosoline", + "(1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate", + "(9Z,12Z)-15,16-epoxy-9,12-octadecadienoic acid", + "5beta-cholestane-3alpha,7alpha,12alpha,26-tetraol", + "[fibroblast growth factor receptor FGFR3]-L-tyrosine phosphate", + "3,4-dihydroxyphthalate", + "8-oxo-dGDP", + "valeramide", + "(E)-4-hydroxyphenylacetaldehyde oxime", + "O-phosphocholine", + "oligosaccharides", + "O-1-alkyl-2-acyl-sn-glycero-3-phosphoethanolamine", + "N-acetylaspartic acid", + "ginsenoside C-Y", + "8-azaguanosine", + "3-carboxy-cis,cis-muconate", + "3-O-phospho-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3) alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man (1->3)-alpha-D-Man-(1->3)]n-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha D-GlcNAc-diphospho-ditrans,octacis-undecaprenol", + "prostasin", + "doxorubicin", + "oxidized methyl viologen", + "(deoxyribonucleotide)m+n", + "3-isopropylmalate", + "N6-dimethylallyladenine37 in tRNA([Ser]Sec)", + "asialo-GM2", + "tRNATrpCCA", + "alpha2,6-sialyated tumor necrosis factor receptor 1", + "pro-dipeptidyl peptidase I", + "a D-glucosyl-N-acylsphingosine", + "propyl-1-nitronate", + "prepilin EpdE", + "4-trimethylammoniobutanoate", + "PulG prepseudopilin", + "L-aspartate-4-semialdehyde", + "(ADP-D-ribosyl)n-NEMO protein", + "4-hydroxy-3,3',5-trichlorobiphenyl", + "anaphylatoxin C5a", + "vanillyl aldehyde", + "(R)-lactaldehyde", + "anthraniloyl-CoA", + "5-carboxymethylaminomethyluridine34 in tRNA", + "25-hydroxy-vitamin D2", + "[beta-D-fructofuranosyl-(2->6)]n+1 alpha-D-glucopyranoside", + "tetrasaccharides units of hyaluronan", + "3-chloro-D-alanine", + "phosphorylated NFAT", + "trans-zeatin riboside 5'-diphosphate", + "imipramine", + "urokinase receptor", + "D-aldonolactone", + "Atrial natriuretic factor", + "(indol-3-yl)acetate", + "L-histidine[side 2]", + "D-Glc-alpha-(1->3)-D-Glc-alpha-(1->3)-D-Man-alpha-(1->2)-D-Man-alpha-(1 >2)-D-Man-alpha-(1->3)-[D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-[D-Man alpha-(1->2)-D-Man-alpha-(1->6)]-D-Man-alpha-(1->6)]-D-Man-beta-(1->4) D-GlcNAc-beta-(1->4)-D-GlcNAc-diphosphodolichol", + "phosphoprotein phosphatase", + "L-selectin", + "isethionate", + "pyridine 4-carboxylic acid", + "N5-(cytidine 5'-diphosphoramidyl)-L-glutamine", + "vesicle-associated membrane protein-1", + "prophalan-D", + "(-)-(7S)-germacrene D", + "N1-aminopropylagamatine", + "calycosin", + "N-acetyl-lysine-MyoD", + "B domain", + "5-dehydro-D-gluconate", + "(S)-citramalate", + "matrix metalloproteinase-10", + "3alpha,5alpha-allopregnenolone", + "8-methyladenine2503 in 23S rRNA", + "phospho-amylopectin", + "substance P", + "2-oxo-isocaproate", + "N2-dimethylguanine26/N2-dimethylguanine27 in tRNA", + "L-Arg-[apolipoprotein E]", + "MMP1 protein", + "valienol 1-phosphate", + "N6-methyladenine in U6 lncRNA", + "D-glucose[side 1]", + "3-sulfopropanal", + "N-Cbz-L-glutaminyl(gamma-4-nitrophenylester)glycine", + "6-phosphogluconic acid", + "5-hydroxymethyl-uracil", + "5alpha-androstan-3,17-dione", + "(3E,7E)-dolabella-3,7-dien-18-ol", + "an n-alkanal", + "[beta-tubulin]-(gamma-(poly-alpha-L-glutamyl)-L-glutamyl)-L-glutamate", + "24-ethylidenelophenol", + "S-linalool", + "N-terminal-N-methyl-N-(A,P,S)PK-[protein]", + "5alpha-pregn-3,20-dione", + "(2E)-5-methylhexa-2,4-dienoyl-CoA", + "QVLR", + "alpha-D-Glucose 1-phosphate", + "(2R)-2-[(1R)-1-hydroxydecyl]decanoic acid", + "11beta,17,21-trihydroxy-pregn-4-ene-3,20-dione", + "N-acetyl-D-glucosaminyl-1,2-alpha-D-mannosyl-1 3(6)-(N-acetyl-D-glucosaminyl-1,2-alpha-D-mannosyl-1 6(3))-beta-D-mannosyl-1,4-N-acetyl-D-glucosaminyl-R", + "3-methylthioaspartate89-[ribosomal protein S12]", + "MDM-2", + "N,N-dimethyl-1,4-phenylenediamine", + "L-Amino acid", + "gibberellin A9", + "adenine58 in tRNALys3", + "[AuA]-L-lysine125", + "8-ketocoformycin", + "IkappaB kinase", + "3'-C-ethynyluridine 5'-diphosphate", + "(4R,5S)-5-[(1S,2R)-1-carboxy-2-hydroxypropyl]-3--4-methyl-4 5-dihydro-1H-pyrrole-2-carboxylic acid", + "(2R)-ethylmalonyl-CoA", + "[endothelial nitric oxide synthase]", + "methylcorrinoid protein", + "[histone H3R26]-L-arginine", + "tripalmitin", + "curdlan", + "putrescine", + "CREB protein", + "precorrin-6Y", + "anaerobilin", + "mycothiol-mycoredoxin disulfide", + "[StkP]-serine/threonine", + "ADP-ribose-arginine", + "tRNAArg", + "oat beta-glucan", + "alpha-D-galactosyl(1-3)-fucosyl-Skp1 protein", + "RNase 9 protein tyrosine O-sulfate", + "L-histidinyl-tRNAHis", + "5-methylcytosine49 in tRNAGln(UUG)", + "RsiW protein", + "kinectin", + "oxidized soluble guanylate cyclase", + "eIF5A-N6-(4-amino-2-hydroxybutyl)-L-lysine", + "hexanal", + "4 Cu+", + "6,7-dimethyl-8-(D-ribityl)lumazine", + "epsilon-caprolactone", + "low-density lipoprotein receptor", + "D-galactose 6-phosphate[side 2]", + "2-(2-methylthio)ethylmalate", + "methemoglobin", + "[alkylcobalamin reductase]", + "8-ethyl-12-methylbacteriochlorophyllide c", + "xylo-oligosaccharide", + "succinonitrile", + "digalacturonic acid", + "D-3-phenyllactate", + "1,2,3-trichloropropane", + "D-Arabinose 5-phosphate", + "L-Arg-L-Pro-L-Pro-Gly-L-Phe", + "membrane-associated glycoprotein neural cell adhesion molecule", + "cyclo(L-phenylalanyl-L-leucyl)", + "ditrans,polycis-polyprenyl diphosphate (n: 10-55)", + "talin-1", + "(24S)-cholest-5-ene-3beta,24-diol", + "oxidized menadione", + "methylated double-stranded bacteriophage lambda", + "5-carboxymethylaminomethyl-2'-O-methyluridine34 in tRNA", + "protein tau", + "ketopantoate", + "hepatocyte growth factor precursor", + "isomaltooligosaccharides", + "TREM2", + "trigalacturonic acid", + "cysteine-riche protein 2", + "UDP-3-O-[(3R)-3-hydroxymyristoyl]-N-acetyl-alpha-D-glucosamine", + "1D-inositol 3-phosphate", + "dehydrocholic acid", + "1,7-diaminoheptane", + "D-leucine", + "(alginate)n+1", + "4-nitrophenyl maltoheptaoside", + "1-beta-D-arabinosylcytosine", + "5-5-diferulic acid", + "pro-factor XIII", + "CFTR protein", + "trans-didehydroacyl-CoA", + "1-iodo-2,4-dinitrobenzene", + "N-(4-carboxybutyl)penicillin", + "phospho-PACSIN 1 protein", + "a phosphorylated nodulation outer protein L", + "Cd/cytoplasm", + "lipopolysaccharide[side 2]", + "heptanoic acid", + "a (1->6)-alpha-D-glucan containing a (1->2)-alpha-D-glucose branch", + "2,4-diaminopentanoate", + "NADPH oxidase", + "[NFkappaB]-L-lysine", + "9-cis-retinol", + "P-sG polyprotein", + "[alpha-tubulin]-N6-acetyl-L-lysine", + "(2Z)-2-hydroxypenta-2,4-dienoate", + "2 ferrocytochrome c2", + "2 tRNALeu", + "glutamyl-tRNAGlx", + "SREBP-1c", + "N-acetyl-D-methionine", + "S-(4-hydroxy-1-oxononan-3-yl)glutathione", + "double-stranded DNA with abasic site", + "[periplasmic sulfatase AtsA]-L-serine", + "5-methylcytosine48 in tRNAGly(CCC)", + "oligopeptide", + "divinyl protochlorophyllide a", + "2,3-dimethyl-5-phytyl-1,4-benzoquinone", + "ribonuclease 2", + "N1-methylguanine9 in tRNAThrAGU", + "5-aminoimidazole-4-carboxamide ribonucleotide", + "insulin-like growth factor-binding protein-5", + "semenogelin fractions", + "5-L-glutamyl-acceptor", + "konjac glucomannan", + "indole-3-pyruvate", + "rhodotorulic acid/in", + "D-Val", + "immature 16S rRNA", + "epigallocatechin gallate", + "3-oxopalmitoyl-[acyl-carrier protein]", + "(Z)-But-2-ene-1,2,3-tricarboxylate", + "dicaprylin", + "MMP-2 pro-peptide", + "beta-D-glucuronosyl-(1-3)-beta-D-galactosyl-(1-3)-beta-D-galactosyl-(1 4)-beta-D-xylosyl-proteoglycan", + "2 NH3", + "prepilin PilA", + "all-trans-retinyl acyl esters", + "trans-farnesyl diphosphate", + "DNA-base-CH3", + "4-fumarylacetoacetate", + "2-isopropyl-6-methylpyrimidin-4-ol", + "seneciphylline N-oxide", + "myosin light chain", + "2-methyl-4-amino-5-diphosphomethylpyrimidine", + "[actividin receptor]", + "glutamine", + "cembrene C", + "9-trans,11-trans-linoleic acid", + "4-amino-2,4-dioxobutanoate", + "Met", + "acylglycerone phosphate", + "alpha-tubulin N6-acetyl-L-lysine", + "2 CO2", + "6-(S)-lactoyl-7,8-dihydropterin", + "[SRPK2 protein]", + "1,2,4-trichlorobenzene", + "1-(5-phospho-beta-D-ribosyl)-ATP", + "deoxybrevianamide E", + "(9Z,13S,15Z)-12,13-epoxy-9,11,15-octadecatrienoic acid", + "cis-3-octyl-4-nonyloxetan-2-one", + "glutathione/vacuole", + "UDP-2-acetamido-2,6-beta-L-arabino-hexul-4-ose", + "reduced glutathione[side 1]", + "N1-methyl-1,3-diaminopropane", + "complement component C5a", + "transforming growth factor-alpha", + "3'-fucosyllactose", + "[IIA-FPr diphosphoryl transfer protein]-L-histidine", + "illudin S", + "unsaturated 1,4-di-, 1,4-tri- and 1,4-tetrasaccharides of L-guluronate", + "[nucleoside diphosphate kinase B]-L-histidine", + "cis-3,4-leucocyanidin", + "poriferasterol 3-beta-glucoside", + "insulin-like growth factor I", + "His-Leu", + "enzyme N6-(dihydrolipoyl)lysine", + "galactocerebroside", + "DNA containing 8-oxo-2'-deoxyguanosine residues", + "4-xylenol", + "butanone", + "N-(oleoyl)-sphingolipid", + "oxidized cytochrome P-450", + "(1,6-alpha-D-glucosyl)n+1", + "1,2-diacyl-3-beta-D-galactosyl-sn-glycerol", + "neoagarodecaose", + "T-cell immunomodulatory protein", + "pro-islet amyloid polypeptide propeptide", + "UDPglucose", + "N-acyl-D-mannosamine 6-phosphate", + "(S)-dihydroorotate", + "N-acetyl-DEVD-7-amido-4-methylcoumarin", + "L-Glu/in", + "1-alkenyl-2-arachidonoyl-glycero-3-phosphorylcholine", + "arenavirus envelope glycoprotein precursor", + "polygalacturonic acid", + "DNA containing tamdem dihydrouracil", + "phospharylated MyoD", + "DL-glycerol 1-phosphate", + "ipsdienone", + "(3E)-3-octaenoyl-CoA", + "O-D-mannosylprotein Bar1", + "dTDP-3-dehydro-6-deoxy-alpha-D-glucose", + "MYB32", + "D-tryptophan", + "allysyl-elastin", + "(deoxyribonucleotide)40", + "4-pyridoxolactone", + "phospho-L-threonine", + "[histone H3]-N6-methyl-L-lysine 27", + "3-epideacetycinobufagin 3-beta-D-glucuronoside", + "gamma-cyano-alpha-aminobutyric acid", + "cyclin-associated cyclin-dependent kinase", + "prostaglandin", + "2'-O-methylguanine26 in initiator tRNAMet", + "1 2-diacyl-3-O-[alpha-D-glucopyranosyl-(1->6)-O-alpha-D-glucopyranosyl] sn-glycerol", + "protein tyrosine phosphatase TCPTP", + "daidzein 7-O-beta-D-glucopyranoside", + "5beta-cholestan-3alpha,7alpha,12alpha-triol", + "an N-terminal-L-methionyl-L-valyl-[protein]", + "(R)-(-)-3-hydroxy-4-(trimethylamino)butyrate", + "acenaphthenequinone", + "N-caffeoylputrescine", + "nodularin", + "sorbate", + "(2,3-dihydroxybenzoyl)adenylate", + "7,4'-dihydroxyisoflavone", + "(2E)-2-decenoyl-CoA", + "protocatechuic aldehyde", + "5-diphosphomevalonate", + "[RING-E3-ubiquitin-carrier protein TRIM25]-L-cysteine", + "L-glutaminyl-Abeta3-40/42 peptide", + "[sulfide quinone oxidoreductase]-tyrosine", + "L-alpha-glycerophosphocholine", + "polypeptide EA2", + "estradiol sulfate", + "phosphatidylinositol-bisphosphate", + "2 glyoxylate", + "2-deoxy-D-glucose", + "[histone H3]-L-lysine14", + "all-trans-octaprenyl diphosphate", + "inositol hexakisphosphate", + "6-O-alpha-L-fucopyranosyl-N-acetylglucosamine", + "[microsomal membrane protein]", + "N6-(dimethylallyl)adenosine 5'-phosphate", + "caldohexamine", + "(-)-patchoulol", + "N-hydroxy-4-aminobiphenyl", + "dabsyl-L-methionine", + "adenosine1067 in 23S rRNA", + "N-(7-mercaptoheptanoyl)threonine 3-O-phosphate (coenzyme B)", + "molybdate[side 2]", + "3 succinate", + "neurodegeneration-related septin 4", + "muramyl dipeptide/in", + "(-)-drimenol", + "L-tryptophan-tRNATrp", + "harderoheme III", + "GDP-fucose", + "phospho-[RNA polymerase II carboxyl terminal domain]", + "[heparan sulfate]-glucosamine 3-sulfate", + "phenylacetyl-L-cysteinyl-D-valine", + "reduced cellulose", + "Fuc-alpha-(1-2)-Gal-beta-(1-4)-Glc", + "2,4'-dihydroxyacetophenone", + "L-Ala-gamma-D-Glu-m-DAP", + "1-riburonosylcytosine", + "tumor necrosis factor receptor 1", + "malonyl-[acyl-carrier protein] methyl ester", + "LivK signal peptide", + "3''-hydroxygeranylhydroquinone", + "merlin", + "inhibitor-2 of protein phosphatase 2A", + "maxiK channel", + "ureidoglycolate", + "1-benzofuran-6-yl sulfate", + "D-erythro-myristoyl-sphingosine", + "3 brimonidine", + "3alpha,7alpha-dihydroxy-5beta-cholestanate", + "1-oxa-2,3-dioxo-cycloheptane", + "citronellol", + "pectic rhamnogalacturonan I", + "alpha-cyclodextrin", + "cytosine38 in G34tRNAAsp", + "flavuxanthin", + "phosphorylated p38alpha", + "n diphosphate", + "dihydroasparagusate", + "monophenol", + "glycerophosphocholine", + "Aquifex aeolicus 9S rRNA", + "zinc bacteriopheophorbide c", + "Jagged-1", + "D-gluco-hexodialdose", + "6-methyldihydrouracil", + "cis-3,4-dehydroadipyl-CoA semialdehyde", + "3-oxotetradecanoate", + "androsterone 3-sulfate", + "trans-3-octyl-4-nonyloxetan-2-one", + "D-glucosylsphingosine", + "matrix metalloproteinase-9", + "13-hydroperoxylinoleic acid", + "5-(glutathione-S-yl)-N-methyl-alpha-methyldopamine/out", + "N1-methylwyosine37 in tRNAPhe", + "3,4-dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione", + "3-oxo-DELTA1-steroid", + "methanol", + "2 thiosulfate", + "indomethacin/out", + "3alpha-hydroxy-7,12-diketo-5beta-cholanoic acid", + "riboflavin-binding protein", + "phenetidine", + "an amino acid", + "heat shock protein gp96 precursor", + "[tungstate-binding protein][side 1]", + "4-xylene", + "2,3-dimethyl-1,4-naphthohydroquinone", + "protoporphyrin IX", + "2-oxoisocaproate", + "2-(2'-methylthio)ethylmalate", + "NG,NG-dimethyl-L-arginine", + "tibolone", + "dihydroxyacetone 3-phosphate", + "molybdate-[molybdate-binding protein][side 1]", + "glucagon-like peptide-1 (7-36)-amide", + "[aquaporin-2]-serine/threonine", + "EPS8 phosphoprotein", + "[DNA]-N4-methylcytosine", + "3,5-bisdiphospho-1D-myo-inositol 1,2,4,6-tetrakisphosphate", + "biotinyl-5'-AMP", + "2,6-dioxo-6-phenylhexa-3-enoate", + "proheparanase", + "cis-3-decenoyl-[acyl-carrier protein]", + "lividomycin 2''-phosphate", + "2 ascorbate", + "N-methylcyclohexylamine", + "[endothelial nitic oxide synthase] phosphate", + "N-terminal L-lysyl-[protein]", + "17beta-estradiol 3-O-beta-D-glucuronoside", + "enzyme-cysteine", + "9-[hydroxy(phenyl)methyl]-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2 3-f]pyrido[3,2,1-ij]quinolin-11-one", + "ergosta-5,7-diene-3beta-ol", + "phenylacetaldehyde", + "FSTSAQNN", + "N2-dimethylguanine26 in tRNA", + "cytosine49 in tRNAGlu(CUC)", + "oligonucleotides", + "apigenin 7-O-apiosylglucoside -6''-O-malonylester", + "2-aminopurine riboside triphosphate", + "uranylcobalamin", + "[HPr kinase]-serine/threonine phosphate", + "proform matriptase-2", + "processed RNA", + "phosphatidylcholine/in", + "N-acetyl-D-glucosamine units", + "4-nitrophenyl beta-D-N,N',N''-triacetylchitotrioside", + "3-deoxy-alpha-D-manno-oct-2-ulopyranosyl-(2->8)-[3-deoxy-alpha-D-manno oct-2-ulopyranosyl-(2->4)]-3-deoxy-alpha-D-manno-oct-2-ulopyranosyl-(2 >4)-3-deoxy-alpha-D-manno-oct-2-ulopyranosyl-(2->6)-2-deoxy-2-[[(3R)-3 hydroxytetradecanoyl]amino]-3-O-[(3R)-3-hydroxytetradecanoyl]-4-O phosphono-beta-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3 hydroxytetradecanoyl]-2-[[(3R)-3-hydroxytetradecanoyl]amino]-1-O phosphono-alpha-D-glucopyranose", + "S-geranylgeranyl protein", + "4-O-phosphohygromycin B", + "(R)-lactate", + "Bcl10", + "1-phenyl-2-propanol", + "15,16-epoxy-13-hydroperoxyoctadecadienoic acid", + "Janus kinase 2", + "fatty acid N-retinylamide", + "(+)-5-epi-aristolochene", + "2-phospho-3-sulfolactate", + "(E)-glutaconate", + "N1-methyladenine1408 in 16S rRNA", + "factor FXII", + "2-methylbut-2-enoyl-CoA", + "6-decylubiquinol", + "pro-apoAI", + "beta-apo-4'-carotenal", + "sulfoacetaldehyde", + "p190 GTPase", + "thioredoxin-1 disulfide", + "alpha-D-galactosyl-1,3-beta-D-galactosyl-1,4-N-acetyl-D-glucosaminyl-R", + "dihydromonacolin L acid", + "N-acyl-(S)-homoserine", + "3,4,5-trimethoxybenzonitrile", + "L-Asn", + "4-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde", + "4-decanone", + "precursor let-7 RNAn+1", + "trans-cyclohexane-1,2-diol", + "10-hydroxydihydrosanguinarine", + "a 4-hydroxy-3-polyprenylbenzoate", + "UDP-N-acetyl-alpha-D-glucosamine", + "validamycin A", + "[[hydroxymethylglutaryl-CoA reductase (NADPH)] kinase]", + "2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate", + "palmitoleic acid", + "Notch 1", + "3 H2O2", + "N-(4-hydroxycinnamoyl)-anthranilate", + "[BAP1]-N6-monoubiquitinyl-L-lysine", + "N-succinyl-LL-2,6-diaminoheptanedioate", + "a 3-oxo-DELTA5-steroid", + "(S)-2-(2-thienyl)propionate", + "chondroitin sulfate proteoglycan", + "adenosine1408 in 16S rRNA", + "adenosylcobinamide", + "1-lauroyl-sn-glycerol 3-phosphate", + "n-decyl beta-D-glucoside", + "feruloyl-CoA", + "D-Glc-alpha-(1->3)-D-Man-alpha-(1->2)-D-Man-alpha-(1->2)-D-Man-alpha-(1 >3)-[D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-[D-Man-alpha-(1->2)-D-Man alpha-(1->6)]-D-Man-alpha-(1->6)]-D-Man-beta-(1->4)-D-GlcNAc-beta-(1 >4)-D-GlcNAc-diphosphodolichol", + "matrix Gla protein", + "HX", + "beta-amyloid precursor protein APP", + "Man8GlcNAc2-[carboxypeptidase Y-transmembrane-Leu2]", + "9alpha-copalyl diphosphate", + "1-(2-Carboxyphenylamino)-1-deoxy-D-ribulose-5-phosphate", + "colicin M", + "L-DELTA1-pyrroline 5-carboxylate", + "drimenol", + "galactitol[side 1]", + "[anti-anti-sigma factor SpoIIAA]-serine/threonine phosphate", + "insulin peptide fragments", + "L-glutamyl-[L-glutamyl-carrier protein]", + "sAPP-alpha fragment of beta-amyloid precursor protein", + "1-palmitoyl-2-oleoylglycerol", + "S-(11-carboxy)undecanyl-glutathione", + "beta-ionone", + "progelatinase A", + "destarched wheat bran", + "Tea1 protein", + "insecticidal crystal protein", + "beta-D-glucosyl crocetin", + "CoA-[4'-phosphopantetheine]", + "N-glycolylneuraminic acid", + "sisomycin 2''-phosphate", + "5,6-dihydroxyindole-2-carboxylate", + "neuronal nitric oxide synthase", + "N-terminal-(A,P,S)PK-[protein]", + "isobutyrate", + "chloramphenicol", + "tellurite", + "2-acetyloxy-2-methylphenylacetic acid", + "2 oxidized coenzyme F420", + "(3Z)-phycocyanobilin", + "imidazol-5-yl-pyruvate", + "3-methylmercaptopropionyl-CoA", + "Smo", + "6-(2-amino-2-carboxyethyl)-7,8-dioxo-1,2,3,4,5,6,7,8 -octahydroquinoline-2,4-dicarboxylate", + "adenine57/adenine58 in tRNA", + "filamentous haemagglutinin precursor", + "NAD-capped RNA", + "proprotein convertase PCSK9", + "kynurenic acid", + "UDP-N-acetyl-3-dehydro-alpha-D-glucosamine", + "indole-3-acetyl-myo-inositol", + "Bacteriophage lambda N-protein", + "L-iditol", + "ceramide dihexoside", + "2-bromoacrylate", + "indol-3-pyruvate", + "N4-[N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl-(1->3)-[N acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl-(1->6)]-beta-D mannosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->4)-[alpha-L-fucosyl-(1 >6)]-N-acetyl-beta-D-glucosaminyl]asparagine", + "6-phospho-alpha-D-glucopyranose", + "phosphorylated SYP-4 protein", + "5-hydroxyformyl-DL-kynurenine", + "4-beta-D-galactosyl-O-beta-D-xylosylprotein", + "a dynein associated with a microtubule at position n", + "[gamma-tocopherol methyltransferase]-N6-methyl-L-lysine", + "a 3-vinyl bacteriochlorophyllide a", + "nucleoside 5'-monophosphate", + "2,7-dihydroxy-5-methyl-1-naphthoate", + "7-cyano-7-deazaguanine", + "phosphorylated BLT1 receptor", + "ent-beyerene", + "2-aminobenzenesulfonate", + "(-)-endo-fenchol", + "adenine2503 in 23S rRNA", + "apo-[propionyl-CoA carboxylase]", + "butyraldehyde", + "Rho protein", + "human CXCL-8", + "cichoriin", + "[histone H3]-N6,N6,N6-trimethyl-L-lysine4", + "FSHR tyrosine O-sulfate", + "a 2-deoxystreptamine antibiotic", + "D-myo-inositol 3,4-bisphosphate", + "CH3N2H3", + "2'-deoxyinosine 5'-phosphate", + "preflagellin", + "[(R)-3-hydroxybutanoate]n+1", + "fragments of small acid-soluble protein gamma", + "(2R,3S)-2,3-dimethylmalate", + "taurine monochloroamine", + "N-myristoyldihydrosphingosine", + "ErbB4", + "cofilin I", + "adenosylcobalamin 5'-phosphate", + "(R)-3-(indol-3-yl)-2-oxobutanoate", + "Na+/K+ ATPase", + "prostaglandin G2", + "dopachrome", + "Met-Phe-tRNAPhe", + "(+)-kolavelool", + "RhoA GTPase-cysteine", + "hypotaurine", + "truncated cyclin B1", + "mitochondrial-protein[side 1]", + "lauroyl-CoA", + "fragments of poly(A)-binding protein", + "1,2,3,4,5-pentachlorobenzene", + "choline phosphate", + "fusarinine C", + "nonpolar amino acid-[nonpolar amino acid-binding protein][side 1]", + "phosphatidylinositol 3-phosphate", + "Leu-His", + "nucleoside diphosphate", + "guanine9 in tRNA", + "L-Orn-Ala-hArg", + "(+)-albendazole s-oxide", + "[(1->4)-alpha-D-glucosyl]n-1", + "NF-kappaB", + "murine cathelicidin-related antimicrobial peptide", + "Alfa-crystallin B glutamine", + "remaining CCK peptide", + "4-methylumbelliferyl-alpha-N-acetylneuraminic acid glycoproteins or ganglioside", + "polysialic acid capsules of bacteria", + "4-chlorobenzamide", + "[huntingtin]-N-terminal-amino acid", + "oligo-alpha-(1->5)-L-arabinoside", + "3-cresol", + "oxidized cytochrome c6", + "MEF-2C", + "oleoylethanolamide", + "3,5-dihydroxy-4-(2-methylpropanoyl)phenyl beta-D-glucopyranoside", + "14S,15R-dihydroxy-eicosatrienoic acid", + "Rab31", + "(2R)-5-[(carbamoyloxy)methyl]-2-[(S)-carboxy(methoxy)[2-(thiophen-2 yl)acetamido]methyl]-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid", + "N-acetyl-D-galactosaminyl-1,3-D-galactosyl-1,4-D-galactosyl-1 4-D-glucosylceramide", + "N6-dimethyladenine1779/N6-dimethyladenine1780 in 18S rRNA", + "alpha-D-Man-(1->3)-alpha-D-Man-(1->6)-alpha-D-Man", + "a very-long-chain mannosylinositol phospho-(2'R)-2'-hydroxyphytoceramide", + "3,5-diiodo-L-tyrosine", + "ferrocytochrome c554", + "1-(1-alkenyl)-sn-glycero-3-phosphoethanolamine", + "N2-(D-1-carboxyethyl)-L-arginine", + "3-(2-hydroxyphenyl)propanoate", + "N4-[N-acetyl-beta-D-glucosaminyl-(1,2)-alpha-D-mannosyl-(1 3)-[N-acetyl-beta-D-glucosaminyl-(1,2)-alpha-D-mannosyl-(1 6)]-beta-D-mannosyl-(1,4)-N-acetyl-beta-D-glucosaminyl-(1 4)-N-acetyl-beta-D-glucosaminyl]asparagine", + "(2S)-2-isopropylmalate", + "pro matrix metalloproteinase 3", + "3-epi-25,26,27-trinor-23-ene-1alpha-hydroxyvitamin D3", + "protein N6-(octanoyl)lysine", + "syndecan-3", + "N-acetyl-L-citrulline", + "(9Z)-hexadec-9-enoate", + "TAR DNA binding protein 43", + "D-lyxose", + "heat shock protein 70[side 1]", + "sn-1,2-dioleoylglycerol", + "kallikrein 1", + "UDP-alpha-D-glucuronate", + "13-tigloyloxylupanine", + "2-oxocaproate", + "11-cis-retinyl ester-[cellular retinol-binding protein]", + "D-glycero-D-manno-heptose 1-phosphate", + "bradykinin potentiating peptide", + "7-chloro-tryptophan", + "[Skp1-protein]-hydroxyproline", + "dansyl-labeled amine nucleophile", + "[Golgi-specific brefeldin A resistance factor 1] phosphate", + "1-(beta-D-ribofuranosyl)-nicotinamide", + "ds-rRNA", + "(-)-menthone", + "DELTA5-3beta-hydroxysteroid", + "1-(9Z-octadecenoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycerol", + "UDP-GlcNAc", + "[factor IX protein with EGF-like domain]-3-O-(beta-D-glucosyl)-L-serine", + "hemicellulose", + "phosphorylated Mig2 protein", + "PRP31 pre-mRNA processing factor 31 homolog", + "dTDP-6-deoxy-L-lyxo-4-hexulose", + "N-acetyl-L-aspartyl-L-glutamyl-L-glutamate", + "FVG", + "N-acetyl-D-glucosaminyllipooligosaccharide", + "cyclohexane-1-carbonyl-CoA", + "active factor Xa", + "fibrillar procollagen type I", + "poly(ADP-D-ribose)n-1", + "GGSW", + "N-carbobenzoxy-L-Asp-L-Phe-methyl ester", + "mannosyl-alpha-(1,3)-mannosyl-alpha-(1,4)-galactosyl-beta-(1 6)-mannosyl-alpha-(1,2)-inositol phosphorylceramide", + "bacteriochlorophyllide f", + "UDP-MurNAc-pentapeptide", + "4-aminobutyraldehyde", + "estrone-3-sulfate/out", + "5-amino-6-(5-phospho-D-ribitylamino)uracil", + "DNA cytosine", + "VAMP-2", + "4-azido-L-phenylalanine", + "hydrolyzed vasopressin", + "Rab protein", + "N-acetyl-L-alanine", + "styrene glycol", + "4-nitrophenyl D-glucopyranoside", + "4-aminobutanal", + "(5R)-carbapen-2-em-3-carboxylate", + "L-2-amino-4-oxobutanoate", + "human brm protein", + "soluble MHC class I polypeptide-related sequence A", + "3-(3-methylthio)propylmaleate", + "(9Z,15Z)-(13S)-12,13-epoxyoctadeca-9,11,15-trienoate", + "3-dehydro-L-threonate", + "a D-amino acid", + "glycerate", + "trans-4-hydroxy-L-proline betaine", + "3 ADP", + "aromatic amine", + "cyanidin 3-O-(6-O-malonyl)-beta-D-glucoside", + "Ca2+/calmodulin-dependent protein kinase I", + "Slr0077-SSH", + "3beta,4alpha,5alpha-3-hydroxystigmasta-7,24(28)-diene-4-carboxylate", + "chlorite", + "deaminohydroxyblasticidin S", + "(2R)-4-hydroxy-7-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl beta-D-glucopyranoside", + "FcalphaR", + "SCFFbw7 ubiquitin ligase", + "phosphorylated phosphoinositide-dependent kinase", + "(3S)-3-carboxy-3-hydroxypropanoyl-CoA", + "Gal-beta-(1-4)-sorbitol", + "N1-methylguanine9 in tRNAGlyGCC", + "rhamnogalacturonan I", + "thrombomodulin", + "3'-phospho-5'-hydroxy-DNA", + "cytosine38 in tRNAValAAC", + "5alpha-pregnan-3,20-dione", + "3alpha-hydroxy-3,5-dihydromonacolin L acid", + "S-(hydroxynonenyl)glutathione[side 2]", + "4-methyl-5-(2-hydroxyethyl)thiazole", + "tetrahydrofolate", + "D-allose 6-phosphate", + "Benzyl isothiocyanate", + "guanine", + "DL-2-hydroxybutyrate", + "D-galactosylpyranoside", + "n-pentanal", + "complement component C3 zymogen", + "UDP-N-alpha-D-acetylmuramate", + "chalcone", + "heme/out", + "nicotinic acid mononucleotide", + "N2-dimethylguanine26 in initiator tRNAMet", + "5-amino-3-oxohexanoate", + "an isoflavone 7-O-beta-D-glucoside", + "p38", + "kininogen", + "2,4,6-trichloroanisole", + "4-hydroxytamoxifen", + "L-thymidine", + "[beta-D-fructosyl-(2->1)-]m", + "5-chloro-7-iodo-8-quinolinyl sulfate", + "invariant chain", + "11a-hydroxychlortetracycline", + "glucarate", + "D-erythrose 4-phosphate", + "6-(hydroxymethyl)-7,8-dihydropterin", + "DELTA1-piperidine-2-carboxylate", + "alpha-D-mannosyl-1,6-(alpha-D-mannosyl-1,3)-alpha-D-mannosyl-1 6-(N-acetyl-D-glucosaminyl-1,2-alpha-D-mannosyl-1,3)-beta-D-mannosyl-1 4-N-acetyl-D-glucosaminyl-Asn-peptide", + "propanethial S-oxide", + "insulin receptor substrate 1", + "1-(5-phospho-beta-D-ribosyl)-5-[(5-phospho-beta-D ribosylamino)methylideneamino]imidazole-4-carboxamide", + "pterostilbene", + "dTDP", + "biapenem", + "3'-phosphohistidyl-linked tyrosyl-DNA phosphodiesterase I-DNA complex", + "isoamyl acetate", + "pantoate", + "uracil-5-carboxylate", + "anti-sigma factor RsiV", + "(2E,4E)-2,4-decadienoyl-CoA", + "L-oleandrosyl-erythronolide B", + "oxidized 2,6-dichlorophenolindophenol", + "4-aminobenzoylglutamate", + "aklaviketone", + "small peptides", + "oxidized azurin I", + "5-methyl-1-naphthoate", + "protein citrulline", + "3-acetyl-13-hydroxy-pheophorbide a", + "2,4-dichlorocatechol", + "receptor-interacting protein kinase 1", + "methylmalonyl-CoA", + "solid beta-chitin", + "atovaquone", + "phosphatidylinositol 4,5-bisphosphate", + "beta-oxoadipate enol-lactone", + "enterobactin/out", + "[ribosomal protein L3]-N5-methyl-L-glutamine", + "Ac-YISRRLL-7-amido-4-methylcoumarin", + "an intron with a 2',3'-cyclic phosphate and a 5'-hydroxyl terminus", + "D-fructose 1-phosphate", + "ubiquitin-peptide", + "2-O-(alpha-D-glucosyl)-3-phospho-D-glycerate", + "D-allose[side 2]", + "1-acyl-2-[(7Z)-hexadec-7-enoyl]-[glycerolipid]", + "3-nitroacrylate", + "(4-hydroxy-3-[3-methyl-3-butene-1-ynyl]benzyl alcohol)", + "UDP-2-acetamido-2-deoxy-alpha-D-ribo-hex-3-uluronate", + "SU protein", + "a 5-methoxyfurocoumarin", + "poly[(R)-3-hydroxybutanoate]n", + "(+)-cis-sabinol", + "7,9,9'-tricis-neurosporene", + "biotin-histone H4", + "zymosterol", + "birchwood xylan", + "corncob xylan", + "phosphorylated MKK4", + "(4S)-4,5-dihydroxypentan-2,3-dione", + "N-desulfoheparin", + "delphinidin 3-O-beta-D-glucoside", + "3-deoxy-4-O-phosphono-alpha-D-manno-oct-2-ulopyranosyl-(2->6)-2-deoxy-2 [[(3R)-3-hydroxypentadecanoyl]amino]-3-O-[(3R)-3-hydroxytetradecanoyl] 4-O-phosphono-beta-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3 hydroxytetradecanoyl]-2-[[(3R)-3-hydroxytetradecanoyl]amino]-1-O phosphono-alpha-D-glucopyranose", + "m-anisate", + "gum arabic", + "tropoelastin", + "3-oxohexanoyl-[acyl-carrier-protein]", + "3-O-[Rib-ol-P-Rib-ol-P-3-beta-D-GalNAc-(1->3)-beta-D-GlcNAc-(1->4)-O-6 P-alpha-D-Man]-Ser/Thr-[protein]", + "type 1 IGF receptor", + "1-phospho-alpha-D-glucuronate", + "Gal-beta-(1-3)-[Fuc-alpha-(1-4)]-GlcNAc-beta-(1-3)-Gal-beta-(1-4)-Glc", + "RH", + "(+)-endo-beta-bergamotene", + "SO42-", + "4-carboxy-2-hydroxymuconate semialdehyde hemiacetal", + "11a-hydroxydoxycycline", + "heptanedioate", + "tetracenomycin F2", + "(R)-3-(4-hydroxyphenyl)lactate", + "Xylalpha(1-3)Glcbeta-Ser53-EGF-like domain of bovine factor IX(45-87)", + "cyclic pyranopterin phosphate", + "5-aza-2'-deoxycytidine", + "alcohol", + "4-methylumbelliferyl acetate", + "4-amino-2-methyl-5-phosphomethylpyrimidine", + "2,3-bis-O-(geranylgeranyl)-sn-glycero-1-phospho-L-serine", + "peptides SP(3-11)", + "DRVY", + "diacetyl-lysine", + "lipid IV(A)", + "5-amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxylate", + "quercetin 3-O-beta-D-galactoside", + "interleukin-6 receptor", + "alpha-D-Man-(1-2)-alpha-D-Man-(1-2)-alpha-D-Man-(1-3)-[alpha-D-Man-(1 6)-[alpha-D-Man-(1-2)-alpha-D-Man-(1-3)]-alpha-D-Man-(1-6)]-beta-D-Man (1-4)-beta-D-GlcNAc", + "6-O-alpha-D-mannopyranosyl-D-mannopyranose", + "3',5'-cGMP", + "2,2-dialkylglycine", + "D-Mannose", + "(2R)-hydroxy-(3-methylphenyl)acetonitrile", + "PprA protein", + "SQIG", + "acetylated xylan", + "Abeta1-19", + "taurocholate/out", + "SAMTEEAAVAIKAMAK", + "L-ureidosuccinic acid", + "3 H+", + "hydrolyzed poliovirus polyprotein", + "2,3-diphosphoglycerate", + "Acetone cyanhydrin", + "L-beta-phenylalanine", + "(aminomethyl)phosphonate", + "L-histidine-[translation elongation factor 2]", + "angiotensinogen", + "autoinducer-2", + "D-glycero-alpha-D-manno-heptose 7-phosphate", + "gypenoside-5", + "reduced coenzyme F420", + "hydroxyquinol", + "N1-methylguanine748 in 23S rRNA", + "androstane-3alpha,17beta-diol", + "sn-glycero 3-phosphorylcholine", + "2',3'-cNADP+", + "GalNAc-alpha-(1->4)-GalNAc-alpha-(1->3)-Bac2,4diNAc-diphospho-tritrans heptacis-undecaprenol", + "sulfite", + "cinnamyl alcohol", + "cis-dienelactone", + "D-glucuronyl-1,4-N-acetyl-D-glucosaminyl-diphosphodolichol", + "5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate", + "Manalpha(1-6)[GlcNAcbeta(1-2)Manalpha(1-3)]Manbeta(1-4)GlcNAcbeta(1 4)GlcNAc", + "thyrotropin-releasing hormone", + "2,3-didehydropyranose", + "(8R,9Z,12Z)-8-hydroperoxyoctadeca-9,12-dienoate", + "compound Mc", + "L-6-deoxyascorbate", + "4-methylene-L-glutamate", + "7,3',4'-trihydroxyisoflavone", + "heparin-binding epidermal growth factor precursor", + "[PapA5]-serine/threonine", + "Man5-3GlcNAc", + "5-carboxyvanillate", + "[beta-D-xylosyl-(1,2)]-glucuronoxylomannan", + "phosphorylated JNK1", + "N,N',N''-triacetylchitotriose", + "4-deoxy-alpha-L-threo-hex-4-enopyranuronate", + "an anthocyanidin with a 3-hydroxy group", + "5'-IMP", + "C18-phytosphinganine", + "6-phospho-D-gluconate", + "MFLTRFVGRRFLAAASARS", + "11-cis-retinyl acyl ester", + "a 2'-deoxyribonucleoside 5'-phosphate", + "5'-phospho-2'-deoxynucleotides", + "gamma-L-glutamyl-L-cysteine", + "1,6-didemethyltoxoflavin", + "UDP-alpha-D-xylose", + "(S)-allantoin", + "acetylhistone H2A", + "7,8-dihydrofolate", + "(Z,E)-alpha-farnesene", + "3-hydroxypyruvate", + "caldariella quinol", + "prepilin EpdB", + "organomercurial salts", + "recombinant human Kv1.5 channel", + "pro-insulin", + "magnesium-protoporphyrin IX 13-monomethyl ester", + "protein Mia40 disulfide", + "methyl sinapate", + "phospholipid[side 2]", + "ubiquinol Q8", + "6 H2O", + "CMP-5-N-acetyl-9-O-acetyl-neuraminate", + "4-de(dimethylamino)-4-oxoanhydrotetracycline", + "erythrose 4-phosphate", + "7-phenylacetylaminocephalosporanic acid", + "vitamin", + "rye arabinoxylan", + "D-threonine", + "N-carbamoyl-L-homophenylalanine", + "1D-myo-inositol 1,4,5-triphosphate", + "N-acetyl-lysine-histone", + "malathion", + "O-acetyl-ADP-ribose", + "7alpha-hydroxycholesterol 3-sulfate", + "6 CoA", + "(5')pp-mRNA", + "3-epi-1alpha,25-dihydroxy-23-oxovitamin D3", + "apolipoprotein B", + "plastocyanin", + "insulin-like growth factor I peptide fragments", + "12-hydroxyjasmonoyl-L-isoleucine", + "3'-end 3'-dAMP-labeled 7,8-dihydro-8-oxoguanine-cytosine duplex", + "protoporphyrinogen-IX", + "5,7,3',4'-tetrahydroxyflavone", + "[protein I-1]-serine/threonine", + "(12R)-hydroperoxyeicosatetraenoic acid", + "tenuazonic acid", + "diethylstilbestrol sulfate", + "D-erythro-oleoyl-sphingosine", + "4-vinylphenol", + "butan-2,3-dione", + "[phospho-alpha-glucan]", + "Codeinone", + "3-methyl-2-oxopentanoic acid", + "genistin", + "a 2'-deoxyribonucleoside", + "oligoalginate", + "4-Hydroxybenzoate", + "(5Z,11Z,14Z)-8,9-dihydroxyeicosatrienoic acid", + "2-methyl-4-chlorophenol", + "[UBC12]-S-[NEDD8 protein]-yl-L-cysteine", + "(3R)-acetoin", + "2-deoxy-5-keto-D-gluconic acid", + "GDP-D-glycero-alpha-D-manno-heptose", + "11alpha-hydroxy-9,15-dioxoprostanoate", + "abequosyl-mannosyl-rhamnosyl-galactose-1-diphospholipid", + "cell adhesion molecule", + "glutathione disulfide[side 2]", + "phosphorylated VASP protein", + "[pyruvate dehydrogenase A1 (acetyl-transferring)] phosphate", + "IscS-SSH", + "[histone H3]-N6,N6-dimethyl-L-lysine 26", + "an N-terminal-Nalpha-acetyl-glycyl-[protein]", + "epilactose", + "2-oxo-hept-4-ene-1,7-dioate", + "2-iminopropanoate", + "a 3-carbamoyloxymethylcephem", + "D-sorbitol", + "IDPmannose", + "(2S)-3-(4-hydroxyphenyl)-2-isocyanopropanoate", + "N-acetyl-Asp-Glu", + "D-ribose 1,5-bisphosphate", + "(2Z,4E)-2-hydroxy-6-oxohepta-2,4-dienoate", + "dialuric acid", + "N6-methyladenine37 in tRNA1(Val)", + "phloretin glucoside A1", + "3'-phosphopolynucleotide", + "dolichyl diphosphate", + "5-dehydro-2-deoxy-D-gluconate", + "ferricytochrome P-450", + "siroheme", + "[DNMT1]-N6-acetyl-L-lysine", + "aklanonate", + "(4R,5S)-5-[(1S,2R)-1-carboxy-2-hydroxypropyl]-4-methyl-3-([(3S 5S)-5-[(sulfamoylamino)methyl]pyrrolidin-3-yl]sulfanyl)-4 5-dihydro-1H-pyrrole-2-carboxylic acid", + "glycano-(1->3)-(N-acetyl-alpha-D-galactosaminyl)-glycoprotein", + "pent-2-enoyl-CoA", + "HLA class I histocompatibility antigen (combined)", + "5-formyluracil-mismatched double-stranded DNA", + "a [histone H3]-L-lysine36", + "[cullin 2]-N6-[NEDD8-protein]-yl-L-lysine", + "menadione", + "carboxymethylaminomethyl uridine34 in tRNAArg", + "GlcNAcbeta(1->2)Manalpha(1->6)(GlcNAcbeta(1->2)Manalpha(1->3))Manbeta(1 >4)GlcNAcbeta(1->4)(Fucalpha(1->3))GlcNAc", + "hypoxia-inducible factor-trans-4-hydroxy-L-proline", + "denatured ribonuclease A", + "S-farnesylcysteine S-oxide", + "[Pkn5]-serine/threonine", + "sialyl Lewis X", + "a pyrimidine base", + "EpdA signal peptide", + "giantin", + "2 (R)-N-methylcoclaurine", + "Cysteine sulfinate", + "adonixanthin", + "uridine2791 in 21S rRNA", + "cytosine48 in tRNAAla(CGC)", + "O-phosphotropomyosin", + "heat shock protein 90", + "AFGSPWQL", + "IgA1", + "17-hydroxy-5alpha-pregnan-3alpha-ol-20-one", + "histone H3 L-lysine36", + "verapamil [side 2]", + "phenazine-1-carboxylate", + "N-formyl-DL-methionine", + "beta-N-(gamma-L(+)-glutamyl)-4-hydroxymethylphenylhydrazine", + "single-stranded DNA-3-methylcytosine", + "epimedin B", + "(1,4-beta-D-glucosyl)n", + "3 O2", + "7-[(3-hydroxyphenyl)acetyl]aminocephalosporanic acid", + "pro-matrix metalloproteinase-2", + "4-acetamidobutanoyl-CoA", + "reduced electron transferring flavoprotein", + "mature feline foamy virus leader protein Elp", + "7-[(3S)-3-amino-3-carboxypropyl]wyosine72 in tRNA", + "NAD(P)+", + "clavaminate", + "(S)-2-(methylamino)-1-phenylpropan-1-one", + "2-oxobrimonidine", + "N-3-oxododecanoyl-(S)-homoserine lactone", + "N-formimino-L-glutamate", + "2,5-didehydro-3-deoxy-L-galactonate", + "2,3-dimethyl-1,4-naphthoquinone", + "C40-phthioceranyl-[(hydroxy)phthioceranic acid synthase]", + "D-erythrulose 4-phosphate", + "phosphorylated MEK5", + "hemin", + "ubiquitinyl-Smad2", + "5-phospho-D-ribosylglycinamide", + "SIV/17E-Fr Nef protein", + "ADPribose", + "Abeta 1-17", + "6-fluoro-6-hydroxycyclohexa-1-ene-1-carbonyl-CoA", + "carboxymethylated transferrin", + "L-N6-hydroxylysine", + "big endothelin-I", + "ArcA", + "5-nitroanthranilate", + "21S rRNA uridine2819", + "(R)-3-phenyllactoyl-CoA", + "calcitriol", + "N5-hydroxy-L-ornithine", + "RA175/SynCAM1", + "pyrimidine deoxyribonucleoside", + "(2Z,4E)-2-hydroxy-4-(2-methylprop-2-en-1-ylidene)pent-2-enedioic acid", + "Rps25a", + "2-dehydro-3-deoxy-D-arabinonate", + "inactive factor X", + "limonene-1,2-epoxide", + "type III collagen", + "eukaryotic translation initiation factor eIF-5A deoxyhypusine", + "(1S,3R,4S)-3,4-dihydroxycyclohexane-1-carboxylate", + "N-acetylmuramoyl-L-alanine", + "pre-tRNAPro", + "4-nitrophenyl 6-phospho-beta-glucoside", + "(S)-2-hydroxy-3-oxobutyl dihydrogen phosphate", + "2,6-di-O-alpha-D-mannosyl-1-phosphatidyl-1D-myo-inositol", + "D1 protein", + "(2S)-3-(1H-indol-3-yl)-2-isocyanopropanoate", + "Rho-cysteine", + "S-geranylgeranyl-Cdc420", + "kinetin", + "S-geranylgeranyl-Rho10", + "isoorientin", + "(2R)-4-hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl beta-D-glucopyranoside", + "2 methylglyoxal", + "[cobalt-binding protein][side 1]", + "(RhoA) C-terminal S-farnesyl-L-cysteine methyl ester", + "1-benzofuran-5-yl sulfate", + "1,6-alpha-D-mannosyl-1,6-alpha-D-mannooligosaccharides", + "dermatan", + "cetraxate benzyl ester", + "3beta-hydroxytibolone 3-O-sulfate", + "m7G(5')pppR-RNA", + "deoxynogalonate", + "fraxetin", + "cytosine in tRNA precursor", + "pro-caspase-10", + "S,S-dimethyl-beta-propiothetin", + "alpha-L-iduronosyl-(1->3)-2,5-anhydro-D-talitol 4-sulfate", + "alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-(palmitoleoyl)-lipid IVA", + "4 sulfur", + "cyclohexyl isocyanide", + "H2o2", + "phosphorylated neurodegeneration-related septin 4", + "DNA containing apurinic/apyrimidinic sites", + "[GST-IkappaB phosphoprotein]", + "unpolar amino acid-[unpolar amino acid-binding protein][side 1]", + "coniferonoyl-[glycerolipid]", + "2-hydroxy-1,2-diphenylethanone", + "cholera toxin[side 1]", + "protein p100", + "Sindbis virus core protein", + "p125", + "4-hydroxymethyl,4-methyl-zymosterol", + "(3S)-(E,E)-geranyllinalool", + "2-Hydroxybutane-1,2,3-tricarboxylate", + "D-galacturonate", + "glycogen synthase kinase 3", + "PMS-1", + "sphinganine 1-phosphate", + "adenosine 5'-phosphosulfate", + "2-oxoisovalerate", + "hepatocyte growth factor activator inhibitor type 1", + "PDEgamma", + "[myosin light chain 2a]", + "(R)-isosalsoline", + "dihydroxyacetone", + "N-terminal-Nalpha-acetyl-L-seryl1-[histone H4]", + "bacteriochlorophyll c", + "dextrans", + "lamin A/C", + "lactulose", + "4-hydroxybenzyl alcohol", + "57000 Da 3D polymerase", + "cis,cis-9,12-octadecadienal", + "phosphorylated radixin", + "tetrahydropteroylhexaglutamate", + "delta-6 phosphogluconolactone", + "planteose", + "UDP-N-acetylglucosamine", + "phycocyanobilin", + "cytosine48 in tRNAAsp(GUC)", + "5 NADPH", + "(S)-4-hydroxy-tetralin", + "4-methylpentanal", + "m7G(5')pppAm-mRNA", + "4 [FeO(OH)]", + "S-adenosyl-(4-methylthio-2-oxobutanoic acid)", + "peritrophic matrix chitin", + "phosphorylated alpha-actinin", + "L-cysteinyl-[L-cysteinyl-carrier protein]", + "L-serine-[protein]", + "DNA-2-furfurylguanosine", + "beta-NADP+", + "G(5')pppp(5')RNA", + "MftA(1-28)", + "[DsbC protein] carrying a disulfide bond", + "2 oxidized ferredoxin [iron-sulfur] cluster", + "(3R)-3-hydroxydodecanoyl-[acyl-carrier protein]", + "1,17-dihydroxy-androstan-3-one", + "CENP-I", + "BAD protein", + "benzyl isothiocyanate", + "phthalate", + "(3R)-3-hydroxybutanoyl-CoA", + "beta-estradiol/in", + "[G protein alpha subunit]-S-palmitoyl-L-cysteine", + "6-carboxy-5,6,7,8-tetrahydropterin", + "alpha-D-galactosamine 1-phosphate", + "sodium thiosulfate", + "1,3-propanediol", + "cerebroside 3-sulfate", + "(2R,3S)-catechin", + "1-(4-fluorophenyl)ethanol", + "LQYTKRGGVL", + "leucin-rich repeats and immunoglobulin-like domains protein 3", + "2-hydroxy-3-keto-l-phospho-l-hexene", + "4-fluorophenol", + "bleomycin A2", + "Rab5 protein", + "[Lck]-S-palmitoyl-L-cysteine", + "14 diphosphate", + "complement component C3", + "mraZ mRNA", + "siRNA", + "3',5'-di-cGMP", + "5'-phospho-(deoxyribonucleotide)m", + "alpha-L-fucosyl-1-2-D-galactosyl-O-R", + "D-ribose/in", + "stromal cell-derived factor 1beta", + "[PpaC]-serine/threonine phosphate", + "2-methyl-3-butenenitrile", + "cytosine48 in tRNAPro(UGG)", + "[tripeptide-binding protein][side 1]", + "methaemoglobin", + "alpha-D-ribose 5-phosphate", + "an acyl-[acyl-carrier protein]", + "12-epi-hapalindole E", + "phosphoenolpyruvate", + "gamma-carboxy L-glutamate", + "a [macrophage-stimulating protein]-L-tyrosine phosphate", + "ginsenoside Rf", + "D-arabino-1,4-lactone", + "leucine/out", + "thalianol", + "2 reduced rubredoxin", + "nitroethane", + "cyanate", + "(24S)-hydroxycholesterol", + "calmodulin L-lysine", + "L-homoserine lactone", + "D-xylose[side2]", + "(2S,3R)-3-hydroxybutane-1,2,3-tricarboxylate", + "monochloroacetate", + "a [protein]-(S)-2-(C-substituted-aminomethyl)-4-acyl-1,3-thiazole", + "novamethymycin", + "ginsenoside F1", + "UDP-alpha-D-galactopyranose", + "3,5,3',5'-tetramethylbenzidine", + "UDP-N-acetyl-alpha-D-muramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D alanine", + "(E,E,E)-geranylgeranyl diphosphate", + "phosphorylated beta-adrenergic receptor", + "4,4-dimethyl-5alpha-cholesta-8,24-dien-3beta-ol", + "5-cholestene-3alpha,7alpha,26-triol", + "vicianose", + "beta-actin", + "deoxyviolaceinate", + "(2,6-beta-D-fructosyl)n+1", + "growth-factor spitz", + "(R)-methyl phenyl sulfoxide", + "steroid", + "adenine in DNA", + "2-(methylthio)ethanesulfonate", + "2,4-dimethoxybenzyl alcohol", + "reduced rubredoxin", + "4,4-dimethyl-5alpha-cholesta-8-en-3beta-ol", + "pseudouridine54 in tRNA", + "beta2-glycoprotein I", + "protein disulfide isomerase", + "13,14-dihydro-15-ketoprostaglandin F2alpha", + "phosphorylase b", + "2-methylbenzoyl-CoA", + "all-trans-retinol", + "TSH receptor", + "poly[(R)-3-hydroxybutanoate]x", + "2 bilirubin", + "prefimbrillin", + "aminobutyraldehyde", + "3-coumaroyl beta-D-glucoside", + "catestatin", + "(2R/3R)-dihydrokaempferol", + "S-(hydroxymethyl)mycothiol", + "N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-[N-acetyl alpha-neuraminyl-(2->6)]-N-acetyl-beta-D-glucosaminyl-R", + "AMP", + "2 reduced coenzyme F420", + "6-hydroxy-warfarin beta-D-glucuronoside", + "[IRF3 phosphoprotein]", + "Manalpha(1-2)Manalpha(1-2)Manalpha(1-3)[Manalpha(1-6)[Manalpha(1 3)]Manalpha(1-6)]Manbeta(1-4)GlcNAcbeta(1-4)GlcNAc", + "factor H-related protein 5", + "adipyl-L-cysteinyl-D-valine", + "4alpha-methylfecosterol", + "dethiobiotin", + "2-aminocrotonate", + "Gal-beta-1,4(fuc-alpha-1,3)GlcNAc-beta-1-R", + "estrogen 3-sulfate", + "Mig2 protein", + "biochanin A 7-O-[beta-D-apiofuranosyl-(1-6)-beta-D-glucopyranoside]", + "[TruE2]-(L-amino acyl-L-cysteine)", + "hypoxia-inducible transcription factor", + "receptor-type tyrosin-protein phosphatase S", + "2-hydroxymalonate", + "trans-resveratrol", + "trans,trans-farnesyl diphosphate", + "RNAn+1", + "1'-hydroxydemethylspheroidene", + "myosin heavy-chain", + "2-hydroxynaringenin", + "dTDP-4-amino-4,6-dideoxy-alpha-D-glucose", + "DNA (containing O6-[4-oxo-4-(3-pyridyl)butyl]guanine)", + "a [lipoyl-carrier protein]", + "polyphosphate699", + "(4E,8E,10E)-sphinga-4,8,10-trienine ceramide", + "BAM-22P", + "an (8Z,11Z,14Z)-icosa-8,11,14-trienoyl-[glycerolipid]", + "25-hydroxyvitamin D", + "[DNA repair factor Ku70]-L-lysine382", + "[phosphatase 2A protein]-leucine309", + "L-3-phosphoserine", + "carbon dioxide", + "pivalamide", + "3,7,12-trioxo-5beta-cholan-24-oic acid", + "protease-activated receptor 1", + "phospho-arrestin", + "dodecanal", + "sulforaphane-S-glutathione[side 1]", + "truncated Bid peptide", + "(R)-styrene oxide", + "1 2-diacyl-3-O-[alpha-D-glucopyranosyl-(1->6)-alpha-D-glucopyranosyl-(1 >6)-O-alpha-D-glucopyranosyl]-sn-glycerol", + "2beta-hydroxygibberellin 1", + "4alpha-methyl-5alpha-cholest-7-en-3-one", + "Precursor protein of the mating hormone alpha-factor of Saccharomyces cerevisiae", + "[dihydrolipoyllysine-residue acetyltransferase] lipoyllysine", + "[sulfate-binding protein][side 1]", + "chitosan oligosaccharides", + "6-methylhept-5-en-2-one", + "kinesin5B", + "indolelactate", + "tRNA2Thr", + "2 reduced flavodoxin", + "ribitol", + "tRNA-4-thiouridine", + "prostaglandin 9alpha,11beta-F2", + "malonamoyl-[OxyC acyl-carrier protein]", + "[GST-IkappaBalpha protein]", + "antitoxin epsilon", + "haptoglobin", + "acceptor beta-D-glucuronoside", + "alpha-defensin propeptide", + "cellohexaose", + "phosphatidylserine/out", + "4-ethoxyaniline", + "phosphorylated STAT transcription activator protein", + "5-hydroxy-L-kynurenine", + "dentin sialoprotein", + "protoporphyrin-IX", + "alpa2-antiplasmin", + "phosphorylated eukaryotic elongation factor 2", + "Mr 160000 component", + "N-terminal-Ser-Pro-Lys-[protein]", + "capsular polysaccharide/in", + "active complement C4", + "2'-deoxy-9-riburonosylguanine", + "Ku70 double strand break repair protein", + "lipoate", + "dodecanoic acid", + "secologanin", + "D-cysteine", + "1-palmitoylglycerophosphocholine", + "2 O2.-", + "interleukin-33", + "proteins", + "N-acetyl-D-hexosamines", + "2,5-dihydroxymethylfurane", + "N-succinyl-L-glutamate", + "processed matrix Gla protein", + "quaternary amine-[quaternary amine-binding protein][side 1]", + "fumaric acid", + "2 Na+/out", + "peptide fragments", + "5'-phosphoguanylyl-(3',5')-guanosine", + "polygalactosaminoglycan", + "L-iduronic acid", + "poliovirus polyprotein", + "cladribine", + "glycine/out", + "a fatty acyl-CoA", + "procollagen III", + "4'-O-demethylsordarin", + "2-pentanol", + "(E)-nerolidol", + "polygalacturonan", + "sugar phosphate", + "oligo-beta-(1->6)-galactans", + "nomilin 17-beta-D-glucopyranoside", + "N-(3-oxooctanoyl)-L-homoserine lactone", + "4-cyanocyclohexan-1-one", + "procaspase-1", + "2-amino-2'-deoxy-N6-[(2S)-succino]adenylate", + "2'-deoxythymidine", + "lactosylceramide", + "AH2", + "(+)-epicubenol", + "5-formamido-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide", + "D-galactosyl-1,3-beta-D-galactosyl-1,4-beta-D-glucosyl-glycolipid", + "(R)-1-phenyl-1,2-ethanediol", + "D-galactofuranosyl-(1->6)-beta-D-galactofuranosyl-(1->5)-beta-D galactofuranose", + "receptor protein tyrosine kinase variant EPHB4V1", + "chlorogenic acid", + "(E)-2(or 3)-enoyl-CoA", + "tropinone", + "rhodopsin 1", + "(-)-alpha-amorphene", + "cell division cycle 7", + "phosphorylated endothelial nitric oxide synthase", + "2-amino-3-oxo-4-phosphonooxybutyrate", + "D-apulose", + "flagellar rod protein FlgG", + "mature MMP-12", + "beta-D-Glc-(1->4)-[alpha-D-Xyl-(1->6)]-beta-D-Glc-(1->4)-[alpha-D-Xyl (1->6)]-beta-D-Glc-(1->4) D-Glc", + "phosphoguanidinoacetate", + "Urocanate", + "taxa-4(20)-11(12)-diene", + "n H+/in", + "6-phospho-2-dehydro-3-deoxy-D-gluconate", + "corin", + "phosphoenolpyruvate carboxylase", + "amyloid beta peptide 1-40", + "chavicol", + "protein ERK", + "cytosine38 in tRNAGlyGCC", + "4-(beta-D-ribofuranosyl)phenol 5'-phosphate", + "alpha-NADH", + "3 H2O", + "beta-limit dextrin", + "poly(1,4-alpha-D-galactosiduronate)", + "tRNAHis precursor", + "L-pyrrolysine", + "reduced cytochrome c6", + "estrone-3-sulfate/in", + "glucosylglycogenin", + "N-acetyl-D-glucosaminate", + "[Notch1 protein with EGF-like domain 11]-3-O-(beta-D-glucosyl)-L-serine435", + "NAD(P)(+)", + "semidehydroascorbate", + "an anthocyanidin 5-O-beta-D-glucoside 3-O-beta-D-sambubioside", + "cholest-5-ene-3beta,27-diol 3-sulfate", + "[histone H3]-N6-methyl-L-lysine 36", + "2-fluorobenzoate", + "nidogen-1", + "1,4-butanediol", + "2,3-bis-O-geranylgeranyl-sn-glycerol 1-phosphate", + "insoluble cellooligosaccharaide", + "wybutosine in tRNAPhe", + "isoamylalcohol", + "(8R)-hydroxy-(11S,12S)-epoxy-(5Z,9E,14Z)-eicosatrienoic acid", + "glycerophospholipid[side 2]", + "polysaccharide", + "guanosine", + "a (2R,3R)-flavan-3-ol", + "10-deacetylbaccatin III", + "D-galactose-[glucose/galactose-binding protein MglB][side 1]", + "aspartic acid", + "DL-tryptophan", + "3-hydroxy-2-oxo-4-(phosphonooxy)butanoate", + "Cypridina luciferyl sulfate", + "(-)-epicatechin gallate", + "D-gluconolactone", + "phosphorylated RNA polymerase II", + "glucose-dependent insulinotropic peptide", + "factor Bb", + "[trehalose-6-phosphate synthase]-L-cysteine", + "periplakin", + "D-arabinose", + "an N-D-glucosylarylamine", + "prophalan-L", + "fibrin 2", + "cholestane-3beta,5alpha,6beta-triol", + "phosphorylated MEI-S332 protein", + "Nalpha-benzoyl-DL-arginine", + "dimethylsulfonioacetate/in", + "insulin-like growth factor-1 receptor", + "protodeoxyviolaceinate", + "hydroxyproline", + "arseno-mycothiol", + "fragments of aggrecan", + "2 acceptor", + "10-formyltetrahydropteroylpentaglutamate", + "phospho-OTUB1", + "fatty acyl CoA/trans", + "latanoprost/out", + "formyl-tetrahydromethanopterin", + "histone H4 L-lysine20", + "N-acetyl-beta-D-glucosaminyl-1,2-alpha-D-mannosyl-1 6-(N-acetyl-beta-D-glucosaminyl-1,2-alpha-D-mannosyl-1 3)-beta-D-mannosyl-1,4-N-acetylglucosaminyl-R", + "ferrocenium ion", + "Ile-His", + "10-formyl-tetrahydrofolate", + "coumaphos", + "13-dihydrodaunorubicin", + "gamma-butyrobetaine", + "[H-Ras]-S-palmitoyl-L-cysteine", + "mono-beta-D-galactosyldiacylglycerol", + "delphinidin 3-O-(6-malonyl-beta-D-glucoside)", + "3alpha,7alpha,12alpha-trihydroxy-5beta-cholestanoyl-CoA", + "protein M33", + "3-oxocholest-4-en-26-oyl-CoA", + "1-propenylsulfenic acid", + "isorhamnetin", + "N-acetylmannosamine", + "chanoclavine-I aldehyde", + "actin-related protein 2/3 complex subunit 3", + "2 sinapoyl-CoA", + "reduced pyrroloquinoline-quinone", + "glucosedependent insulinotropic polypeptide", + "semaphorin-6A", + "p42 MAPK", + "type I collagen", + "2'-O-methyluridine2791 in 21S rRNA", + "(20S)-ginsenoside Rg3", + "2-oxo-3-mercaptopropanoic acid", + "a methylated protein", + "N-acetyl-D-proline", + "[galactose-binding protein][side 1]", + "N-acetyl-beta-D-glucosaminyl-1,3-beta-D-galactosyl-1 4-N-acetyl-D-glucosaminyl-R", + "4-phospho-D-erythronate", + "lumiflavin", + "UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine", + "O-D-mannosylprotein Kre9", + "1,2-dipalmitoyl-sn-glycerol 3-phosphate", + "9 CO2", + "intercellular adhesion molecule-1", + "hypoxanthine37 in tRNAAla", + "2,4-dichlorobenzoyl-CoA", + "19-(4-hydroxyphenyl)nonadecanoyl-[4-hydroxyphenylalkanoate synthase]", + "H2CO3", + "5'-methyl-thioadenosine", + "(polyphosphate)n-1", + "tripolyphosphate", + "phosphorylated GLH-1", + "1,2-dihydroxynonane-3,4-dione", + "Lanosterol", + "S-(5-deoxy-D-ribos-5-yl)-L-homocysteine", + "CD276 antigen", + "D-mandelate", + "C5b", + "trans-trans-2,4-hexadecadienoyl-CoA", + "ADP-D-ribosyl-[dinitrogen reductase] component of nitrogenase complex", + "coenzyme B-coenzyme M disulfide", + "4-hydroxypyruvate", + "phosphoglucomutase", + "trans-5-O-caffeoyl-D-quinate", + "truncated BID", + "beta-tocopherol", + "kiwellin", + "alpha-humulene", + "N-acetyl-D-glutamate", + "amorphous cellulose", + "5-methylcytosine48 in tRNASer(UGA)", + "[dihydrolipoyllysine-residue(2-methylpropanoyl)transferase] lipoyllysine", + "luciferin", + "beta-D-galactopyranosyl-(1-6)-beta-D-galactopyranosyl-(1-4)-D-glucose", + "ketopantolactone", + "gallotannin", + "pimara-8(14),15-diene", + "pseudouridine1915 in 23S rRNA", + "fatty acid hydroperoxide", + "ferrichrome/out", + "cetraxate", + "14 NADP+", + "nucleoside phosphate", + "polyphosphate", + "an N-terminal L-alanyl-[S18 protein of 30S ribosome]", + "citral", + "amyloid-beta peptide", + "Laminin-1", + "ferrichrome/in", + "4-bromocyclohexan-1-one", + "cyanidin 3-O-(beta-D-xylosyl-(1->2)-beta-D-galactoside)", + "4-chlorocatechol", + "2-(acetamidomethylene)-3-(hydroxymethyl)succinate", + "[Ga protein]-L-cysteine", + "poly(glycerol phosphate)/out", + "3-oxochol-4,6-dien-24-oyl-CoA", + "sn-2-monooleoylglycerol", + "protein tyrosine phosphatase PTP1B", + "2-(4-iodophenyl)-1,3-benzothiazol-6-ol", + "aspartate", + "butyrylthiocholine", + "[DNA]-3'-diphospho-5'-guanosine", + "3-alpha-D-glucopyranosyl-1,2-di-palmitoylglycerol", + "[NCOA2]-Nomega,Nomega-dimethyl-L-arginine", + "[protein p53]-L-lysine370", + "phosphorylated High mobility group box 1 protein", + "isomaltooligosaccharide", + "pentaglycine", + "[histone H4]-N6-acetyl-L-lysine8", + "cytosine49 in tRNAPro(CGG)", + "HNP-1", + "obacunone", + "10beta-hydroxytaxa-4(20),11-dien-5alpha-yl acetate", + "2-deoxy-2-fluoro-beta-D-arabinofuranose", + "2-aminomuconate-6-semialdehyde", + "alpha-1,4-polyglucan", + "[methionine synthase]-methylcob(I)alamin", + "Xylitol", + "acyl-CoA", + "but-3-enoyl-CoA", + "protein histidine", + "(E)-prop-1-en-1-SO-peroxol", + "2 Fe(III)-siderophore", + "trans,octacis-decaprenyl diphosphate", + "3-methylphenol", + "Ndelta-hydroxy-Nomega-methyl-L-arginine", + "[G-protein alpha subunit Galphai]-S-palmitoyl-L-cysteine", + "D-glucose oxime", + "5'-phosphomononucleotides", + "(3-deoxy-alpha-D-manno-oct-2-ulopyranosylonate)-(2->4)-(3-deoxy-alpha-D manno-oct-2-ulopyranosylonate)-(2->6)-2-deoxy-2-[[(3R)-3 hydroxytetradecanoyl]amino]-3-O-[(3R)-3-hydroxytetradecanoyl]-4-O phosphono-beta-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3 hydroxytetradecanoyl]-2-[[(3R)-3-hydroxytetradecanoyl]amino]-1-O phosphono-alpha-D-glucopyranose", + "[3-methyl-2-oxobutanoate dehydrogenase (lipoamide)]", + "acylamide", + "all-trans-13,14-dihydroretinol", + "D-xylono-gamma-lactone", + "5-L-glutamyl-glutathione", + "phospho-L-tyrosinyl-NaV1.2 channel", + "sulfur", + "methyl aklanonate", + "[histone H4R17]-L-arginine", + "5,7-diacetamido-3,5,7 9-tetradeoxy-L-glycero-alpha-L-manno-2-nonulopyranosonic acid", + "[AuA]-L-lysine75", + "phosphate a kinesin associated with a microtubule at position n+1 (toward the plus end)", + "corticosteroids", + "1-stearoyl-2-arachidonoyl-sn-phosphatidic acid", + "24-methylene-5alpha-cholest-8-en-3beta-ol", + "N6-methyladenine2030 in 23S rRNA", + "N-acetyl-4-O-acetylneuraminate", + "2-(4-dimethylaminophenyl)diazenylbenzoate", + "[EGR2]-N6-acetyl-L-lysine", + "glutamine/in", + "[MapZ]-serine/threonine", + "proteoglycan core protein", + "pro-HNP-1", + "4 beta-D-glucose", + "2-oxo-5-guanidinopentanoic acid", + "myosin I heavy chain", + "an N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta D-galactosaminyl-R", + "Glc2Man9GlcNAc2", + "trichodiene", + "Nalpha-acetylated peptide", + "O-isobutyl-S-(2-diethylaminoethyl)methylphosphonothiolate", + "8-oxo-dATP", + "indol-3-ylmethylisothiocyanate", + "cytosine48 in tRNALeu(AAG)", + "4-O-methyl-D-glucuronic acid", + "nogalaviketone", + "oligoglycosylglucosyl-(1->1)-ceramide", + "Fe2+", + "D-Galacturonate", + "immunoglobulin D", + "19000 Da 3C-like viral protease", + "25S rRNA", + "(2S,3R)-2-hydroxy-3-(indol-3-yl)butanoate", + "translation initiation factor eIF4GI", + "(S)-aspartate 4-semialdehyde", + "1-(3,4-diethoxyphenyl)-1,3-dihydroxy-2-(4-methoxyphenyl)-propane", + "glutaryl-7-aminocephalosporanic acid", + "(3R)-citramalyl-CoA", + "[large subunit of Rubisco]-L-lysine", + "UDP-N-acetyl-alpha-D-muramoyl-L-alanyl-L-glutamate", + "trypsinogen", + "miR-1003 RNAn", + "allocryptopine", + "[octamer-binding protein 4]-L-serine", + "mesoporphyrinogen IX", + "2-(4-fluorophenyl)-1,3-benzothiazol-6-yl sulfate", + "glycoprotein N-acetyl-D-glucosaminyl-phospho-D-mannose", + "uroporphyrinogen-III", + "tetrasaccharide-diphosphoryl-lipid", + "polyprotein of IPNV", + "C8-vinyl chlorophyllide a", + "gamma-tocopherol", + "[N-(6-aminohexanoyl)]x", + "(S)-5-oxo-2,5-dihydrofuran-2-acetate", + "3alpha-androstanediol", + "4-hydroxy-3-methylbenzoate", + "protein L-asparagine", + "17-hydroxyprogesterone", + "guanine/out", + "phosphopyruvate kinase", + "oxytocin", + "lactitol", + "18-hydroxycorticosterone", + "D-xylono-1,5-lactone", + "Acetyl-Ala3", + "3-epi-6-deoxocathasterone", + "gastrin releasing peptide", + "(L-seryl)adenylate", + "proMMP-2", + "pyruvate kinase", + "Cholecystokinin", + "L-homocysteine-thiolactone", + "13-hydroperoxyoctadeca-9,11,15-trienoate", + "D-arabitol", + "Man8GlcNAc2-pyridylamine (isomer 8A1,2,3B1,3)", + "(1S,2R)-3-phenylcyclohexa-3,5-diene-1,2-diol", + "D-glucosaminate 6-phosphate[side 2]", + "hypoxia-inducible factor-1", + "3-hydroxy-2-oxobutyrate", + "GDP-mannose", + "O-succinyl-L-homoserine", + "4-hydroxybutanoate", + "2 NO", + "AHNAK nucleoprotein", + "3-benzoic acid", + "4-amino-2-methyl-5-(diphosphooxymethyl)pyrimidine", + "acetone cyanohydrin", + "glyocylate", + "propioin", + "phosphorylated CFTR", + "S-(2E,6E)-farnesyl-L-cysteine", + "[Runx1]-L-tyrosine", + "RIPK1", + "ADP-glucose", + "(2R,3S,4s,5R,6S)-2,3,4,5,6-pentahydroxycyclohexanone", + "VTDYYYPDI", + "DNA*DNA", + "pyrroloquinoline quinone", + "1D-myo-inositol 5-diphosphate 1,2,3,4,6-pentakisphosphate", + "CARDIF", + "(ADP-D-ribosyl)-Ras GTPase", + "6-deoxy-6-sulfo-D-fructose", + "D-altronate", + "1 2-diacyl-3-O-(alpha-D-glucopyranosyl(1-2)-O-alpha-D-glucopyranosyl)sn glycerol", + "(2R,3R)-epigallocatechin", + "MOCAc-Gly-Ser-Pro-Ala-Phe-Leu-Ala-Lys(Dnp)-D-Arg-NH2", + "hyperpolarization-activated cyclic nucleotide-gated channel 1 protein", + "D-sorbose", + "oleuropein agylcone", + "DL-2,3-dihydroxyisovalerate", + "cytochrome c-551", + "iron ferrichrome/in", + "Tyr-Ser-Pro", + "[MgrA]-serine/threonine", + "2,3-bis(3-hydroxytetradecanoyl)-D-glucosaminyl-(beta-D-1,6-)-2 3-bis(3-hydroxytetradecanoyl)-D-glucosaminyl beta-phosphate", + "Notch intracellular domain", + "tulipalin A", + "myosin light chain 2 phosphate", + "(E)-p-hydroxyphenylacetaldehyde oxime", + "1-cyclohexylcarbonyl-CoA", + "cytidine1402 in 16S rRNA", + "1D-myo-inositol 1,4-bisphosphate", + "7-amino-4-trifluoromethylcoumarin", + "gibberellin 1", + "S-adenosyl-L-homocysteine [gamma-tocopherol methyltransferase]-N6-methyl-L-lysine", + "2',3'-cGMP", + "ascopyrone M", + "Ras protein C-terminal S-farnesyl-L-cysteine methyl ester", + "3,4-diacetoxybutynylbithiophene", + "2,5,7,4'-tetrahydroxyisoflavanone", + "nepetalactol", + "azole/in", + "S-methylthioglycolate", + "3-chlorobenzaldehyde", + "10-deoxymethynolide", + "oripavine", + "L-methionine-(R)-S-oxide", + "dehydrovomifoliol", + "geissoschizine", + "2-phosphoglycolate", + "ferrocenium hexafluorophosphate", + "D-tagatose 1-phosphate", + "ammonia", + "mouse pro-growth hormone-releasing hormone", + "ubiquitin-activating enzyme E1", + "phospho-Cdk6", + "[polycomb 2 protein]-N6-methyl-L-lysine191", + "N-hydroxy-2-methylpropan-1-amine", + "2-O-[6-O-octanoyl-alpha-D-glucopyranosyl-(1->6)-alpha-D-glucopyranosyl] D-glycerate", + "2-coumaroyl beta-D-glucoside", + "IgG Fc peptide", + "[(1->4)-beta-D-glucosyl]n+m", + "3-hydroxy-3-(4-hydroxy-3-methoxyphenyl)propionyl-CoA", + "palmitate", + "D-2-hydroxyglutarate", + "lutein", + "5-oxo-D-proline", + "3-hydroxypropanoyl-CoA", + "versiconal", + "L-aspartyl-tRNAAsx", + "fragments of poly(A) binding protein", + "L-erythro-tetrahydrobiopterin", + "Fuc-alpha-(1-2)-Gal-beta-(1-3)-GlcNAc-beta-(1-3)-Gal-beta-(1-4)-Glc", + "(dinitrogen reductase) component of nitrogenase complex", + "thiosulfate/in", + "retinol-[cellular retinol-binding protein]", + "gp43", + "cytosine49 in tRNAGly(GCC)", + "D-erythroascorbic acid", + "immunglobulin Fc", + "(Z)-4-Hydroxyphenylacetaldehyde oxime", + "caffeoyl beta-D-glucoside", + "L-phenylalanyl-L-arginyl-protein", + "diethylstilbestrol-glutamate", + "N2-succinyl-L-glutamate 5-semialdehyde", + "L-alanine", + "aromatic acid", + "prothymosin alpha", + "fluorodiphosphoric acid", + "2-methylthio-N6-L-threonylcarbamoyladenine37 in tRNA", + "Pyr-RTKR-7-amido-4-methylcoumarin", + "N-Acetyl-D-mannosamine", + "an N-terminal-Nalpha-acetyl-L-seryl-[protein]", + "pregn-4-en-3,20-dione", + "a 5'-(N7-methyl 5'-triphosphoguanosine)-(2'-O-methyl-purine-ribonucleotide)-[mRNA]", + "pyroGlu-His-Trp-Ser-Tyr-Gly-Leu-Arg-Pro-Gly", + "malonyl-dephospho-CoA", + "3-hydroxybutan-2-one", + "methyl caffeate", + "2,3,5,6-tetrachloro-1,4-benzoquinone", + "all-trans-retinal", + "(3,4-dihydroxyphenyl)acetaldehyde", + "L-homoserine", + "6-methoxy-3-methyl-2-(all-trans-polyprenyl)-1,4-benzoquinol", + "p130Cas-L-tyrosine", + "glucuronic acid phosphate", + "interleukin-24", + "anionic trypsinogen", + "2-pyrrolesulfenic acid", + "UDP-MurNAc", + "glycogen phosphorylase", + "human proenzyme plasminogen", + "(9R,10E,12Z)-9-hydroperoxy-10,12-octadecadienoate", + "1-oleoyl-2-alpha-linolenoyl-sn-glycero-3-phosphocholine", + "N-acyl-threo-trans-sphingosine", + "cis-coniferyl alcohol", + "2 6-aminohexanoate", + "[acetyl-CoA:carbon-dioxide ligase (ADP-forming)]", + "1D-myo-inositol-1,3,4,6-tetrakisphosphate", + "ethyl 2-methylacetoacetate", + "eukaryotic initiation factor eIF4G", + "fludarabine", + "glucotriose", + "phenylacetonitrile", + "salivary gland mucin 81 D-galactosyl-1,3-N-acetyl-D-galactosamine", + "(2E,4E,6E)-8-hydroxy-2,6-dimethylocta-2,4,6-trienal", + "D-glucose trisaccharides", + "[fibroblast growth factor receptor FGFR2]-L-tyrosine", + "phosphorylated Rab8a protein", + "2-acyl-sn-lysophosphatidylglycerol", + "9-cis-violaxanthin", + "5-formyluracil", + "stromal cell derived factor 1", + "pre-interleukin-18", + "alpha-D-galactosyl-D-ononitol", + "phosphorylated Ca2+/calmodulin-dependent protein kinase I", + "L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala", + "alpha-L-rhamnopyranoside", + "methyl ecgonine", + "azidonorleucine", + "subtilisin/in", + "RNase A", + "(+)-thujopsene", + "[Notch1 protein with EGF-like domain 11]-L-serine435", + "DNA containing 8-hydroxyguanine residues", + "(S)-3-hydroxybutanoate", + "8-methoxykaempferol", + "[protein DsbE] carrying a disulfide bond", + "(3S,5R,6S)-5,6-epoxy-3-hydroxy-5,6-dihydro-12'-apo-beta-caroten-12'-al", + "polar amino acid/in", + "imidazole", + "dimethyl hydrogen phosphate", + "2,3-dihydro-2,3-dihydroxybenzoate", + "2-hydroxymethylphenol", + "trans-3-methylglutaconyl-CoA", + "docosahexaenoate", + "dephosphin", + "Mfge8 protein tyrosine", + "(S)-nicotine", + "proline/in", + "7-dehydro-pregnenolone", + "violaxanthin", + "amyloid beta-protein 1-40", + "3-beta-D-galactosyl-4-beta-D-galactosyl-O-beta-D-xylosylprotein", + "mannotetraose", + "Mi-2", + "enzyme N6-(S-acetyldihydrolipoyl)lysine", + "bacterial peptidoglycan", + "[PrkG]-serine/threonine phosphate", + "(3S)-citryl-[acyl-carrier protein]", + "beta-NAD(P)+", + "IDP", + "1-deoxy-L-glycero-tetrulose 4-phosphate", + "UDP-2-acetamido-2 3-dideoxy-3-[[(3R)-3-hydroxydecanoyl]amino]-alpha-D-glucopyranose", + "H2B ubiquitinated nucleosome", + "hexose 6-phosphate", + "3-oxo-cis-5-dodecenoyl-[acyl-carrier protein]", + "Sre1 protein", + "3 ubiquinol", + "tubulin-GDP-complex", + "(+)-copalyl-diphosphate", + "selenocystathionine", + "sorbose", + "carboxylic acid ester", + "1,6,6-trimethyl-2,7-dioxabicyclo-[3.2.2]nonan-3-one", + "2-(3,5-dihydroxyphenyl)-2-oxoacetate", + "(+/-)-synephrine", + "1-alkenyl-2-oleoyl-glycero-3-phosphorylcholine", + "promatrix metalloproteinase-2", + "7-cyano-7-deazaguanine15 in tRNA", + "N-acetyl-beta-D-galactosaminyl-alpha-R", + "fragments of IL-1R2", + "(-)-gallocatechin", + "peptide-L-methionine (S)-S-oxide", + "4-O-beta-D-mannosyl-N-acetyl-D-glucosamine", + "ferruginol", + "[spermidine-binding protein][side 1]", + "MDM2 p60", + "gastric inhibitory polypeptide", + "doxorubicin/in", + "an N-acetyl L-cysteine-S-conjugate", + "beta-nicotinamide D-nucleotide", + "3,N4-ethenocytosine-mismatched single-stranded DNA", + "2'-O-methylnucleoside32 in tRNA", + "2,5-diamino-6-(1-D-ribitylamino)-4(3H)-pyrimidinone 5'-phosphate", + "[RCR-type E3 ubiquitin transferase]-S-ubiquitinyl-L-cysteine", + "5'-deoxy-5'-(3-(3-N,N-dimethylamino)phenoxy)propyl-5'-thioadenosine", + "(9S,10E,12Z)-9-hydroperoxy-10,12-octadecadienoate", + "(2E)-enoyl-CoA", + "3-maleylpyruvate", + "[Methionine synthase]-cob(II)alamin", + "N-acetyl-MLGPEGG", + "(S)-2,3-Epoxysqualene", + "vermelone", + "PKB protein kinase", + "7,2'-dihydroxy-4'-methoxyisoflavanol", + "capsular polysaccharides", + "truncated apoptosis inducing factor", + "tauro-beta-muricholic acid", + "chitotriose", + "1-haloalkane", + "EndoS", + "smaller DNA fragments", + "L-tyrosyl-L-arginine", + "N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl diphospho-ditrans,octacis-undecaprenol", + "pyranose", + "4-methoxy-2-nitrobenzonitrile", + "nicotinic acid adenine dinucleotide", + "N-carbamoyl-beta-alanine", + "Tyrosine", + "agarose", + "peroxiredoxin-(S-hydroxycysteine)", + "indole acetic acid", + "phosphatidylinositol-5-phosphate", + "nuclear factor-kappaB", + "kaempferol", + "mycoredoxin-1 disulfide", + "(3S)-3,6-diaminohexanoate", + "phosphonate/out", + "keratin-L-citrulline", + "5'-phosphoribosyl-5-formamido-4-imidazolecarboxamide", + "9-[6-deoxy-beta-L-talofuranosyl]-2-fluoro-adenine", + "salicylate", + "flavonol 3-O-rhamnosylglucoside", + "DNA-1-methyladenine", + "an N-terminal-L-cysteinyl-[protein]", + "alpha-amino-gamma-butyrolactone", + "vesicle-associated membrane protein-5", + "aromatic acids", + "diosmetin 7-O-glucoside", + "13-hydroxyoctadecatrienoic acid", + "2-methylhexanal", + "beta-glucan/in", + "polyglutamyl-folate", + "alpha-mating factor", + "tetracosanoyl alcohol", + "L-2-hydroxyphytanate", + "4-amino-5-aminomethyl-2-methyl-pyrimidine", + "MPK18", + "alpha-factor/in", + "Br-", + "21 isopentenyl diphosphate", + "alpha-pinene oxide", + "oligosaccharide containing 6-methyl-D-glucose units", + "phosphotyrosinyl glycogen synthase kinase 3beta", + "2 beta-L-arabinofuranose", + "(2Z, 6E)-farnesyl diphosphate", + "5'-phosphoguanylyl-(3'->5')guanosine", + "O-D-mannosylprotein Pir2/hsp150", + "S-serine", + "5,6-dihydrouracil16 in tRNA", + "dimethylallyl diphosphate", + "5-methoxytryptamine", + "5-bromouracil-mismatched double-stranded DNA", + "Mn2+[side 2]", + "low-molecular mass chitosan", + "protein disulfide", + "phosphorylated splicing factor 3B1", + "2-deoxy-D-ribosyl-base", + "anordiol", + "Glc2Man9GlcNAc2 (G2M9)-protein", + "7-hydroxy-8-methylisoflavone", + "nicotinate beta-D-ribonucleotide", + "6-aminohexanoate oligomer", + "3-(hydrohydroxyphosphoryl)pyruvate", + "beta-myrcene", + "D-Xylulose 5-phosphate", + "N4-acetyl-L-2,4-diaminobutanoate", + "Big endothelin 1", + "PAR-2", + "transferrin", + "galactosaminoglycan", + "iron(III)-N-(2,3-dihydroxybenzoyl)-L-serine trimer complex", + "O-D-mannosylprotein Kex2", + "(Z)-9-tetradecenoic acid", + "delphinidin 3-O-(4-coumaroyl)-rutinoside", + "serine/out", + "biphenyl-2,3-diol", + "2-hydroxy-5-methylmuconic semialdehyde", + "TSHR tyrosine O-sulfate", + "cyanidin 3-O-[[2-O-beta-D-xylosyl]-6-O-(6-O-(4-coumaroyl)-beta-D-glucoside)] 5-O-beta-D-glucoside", + "Gal-beta-(1-3)-GlcNAc-beta-(1-3)-[Fuc-alpha-(1-4)]-Gal-beta-(1-4)-Glc", + "guanosine2922 in 27S pre-rRNA", + "electron transfer flavoprotein", + "daunorubicin", + "apo-[phycoerythrocyanin beta-subunit]", + "L-threo-tetrahydrobiopterin", + "nicotinamide nucleotide", + "Rpl12ab", + "allophanic acid", + "N,N'-diacetyllegionaminate", + "1-(4-bromophenyl)ethanone", + "2 long-chain alcohol", + "histone N6-methyl-L-lysine", + "trans-cinnamate", + "1-(3-indolyl)glycerol-3-phosphate", + "(glucomannan)n", + "alpha-tropomyosin", + "7beta-hydroxy-3,12-diketo-5beta-cholanoyl taurine", + "5-methylcytosine49 in tRNAAsp precursor", + "limit dextrin", + "alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc (1->4)-alpha-D-GlcNAc-diphosphodolichol", + "[cullin 3]-L-lysine", + "CCL11", + "L-2-chloropropionic acid", + "[glycine cleavage system H]-N6-octanoyl-L-lysine", + "4 methylmalonyl-CoA", + "7-carboxy-7-deazaguanine", + "precorrin-2", + "D-myo-inositol 1-phosphate", + "cholesterol[side 1]", + "n-alkanal", + "n-propanol", + "(2E,4Z)-2,4-decadienoyl-CoA", + "Glycophorin A", + "topoisomerase II", + "3-methylbut-2-enal", + "4-coumarate", + "a [DsrC protein]-dithiol", + "1,2-propylene glycol", + "dolichyl phosphooligosaccharide", + "2-O-(6-phospho-alpha-D-mannosyl)-D-glycerate [side 2]", + "1-phenyl-1-propanol", + "amino acid/in", + "ManNAcA-GlcNAc-diphosphorylundecaprenol", + "CH3-SCoM", + "5-methyldeoxycytidine 5'-phosphate", + "delta-cadinene", + "dTDP-4-dehydro-6-deoxy-alpha-D-glucopyranose", + "dihydrostreptomycin 3''alpha,6-bisphosphate", + "(R)-2,3-dihydroxypropane-1-sulfonate", + "(S)-(-)-2-chloropropionamide", + "bacterial surface polysaccharide", + "1,2,4,5-tetrachlorobenzene", + "a reduced flavoprotein", + "peptidyl(2-hydroxylglycine)", + "L-Arg-[glucose-related protein 78]", + "decanoyl-6-aminopenicillanic acid", + "paxillin", + "(Z)-but-2-ene-1,2,3-tricarboxylate", + "[protein phosphatase 6 catalytic subunit]-leucine methyl ester", + "5-L-Glu-Xaa", + "L-aspartyl-tRNAAsp", + "(+)-sesamin", + "[phosphatase 2A-C protein]-leucine methyl ester", + "L-1-phosphatidylserine", + "2-protocatechoylphloroglucinolcarboxylate", + "bilirubin beta-D-glucuronoside", + "mannose 6-phosphate", + "alpha-diketone", + "[isocitrate dehydrogenase 2]-L-lysine413", + "a thioether", + "1-O-(2'-[N-acetyl-L-cysteinyl]amido-2'-deoxy-alpha-D-glucopyranosyl)-D myo-inositol", + "1-(3-C-ethynyl-beta-D-ribopentofuranosyl)uridine 5'-phosphate", + "(24R),25-dihydroxycholecalciferol", + "verapamil [side 1]", + "all-cis-9,12,15-octadecatrienoic acid", + "GlcMan7GlcNAc2", + "C83", + "methiin", + "gypenoside LXXV", + "[protein I-1]-serine/threonine phosphate", + "(+)-isomenthol", + "2-Keto-4-hydroxybutyrate", + "2-hydroxy-5-methylquinone", + "MazF L-arginine", + "11a-hydroxytetracycline", + "Wilms' tumor suppressor protein WT1", + "(Z)-2-methylpropanal oxime", + "[dopamine D1 receptor]phosphate", + "4-methylthio-2-oxobutanoate", + "soluble vascular cell adhesion molecule 1", + "glycogen synthase phosphate", + "indole-3-carbonyl nitrile", + "macrophage factor H-receptor CR4", + "[protein p53]-N6,N6-dimethyl-L-lysine370", + "maniladiol", + "2-deoxy-beta-D-arabinofuranose", + "5,6-dihydrouracil-DNA", + "3-ketoacyl-CoA", + "phosphorylated c-Myc", + "MSIQHFRVALIPFFAAFCLPVFA", + "2',3'-cAMP", + "beta-(1->4)-D-mannosylchitobiosyldiphosphodolichol", + "CPAR-1 protein", + "1-O-alkyl-2-acetyl-sn-glycero-3-phosphocholine", + "RNA/DNA hybrid", + "homoallylglycine", + "a 2-oxocarboxylate", + "UDP-D-glucose", + "N,N-dimethylamphetamine N-oxide", + "phosphorylated target membrane SNARe complex", + "[WntWg]-L-serine", + "(ADP-D-ribosyl)n+1-RalA", + "5-chlorouracil-mismatched double-stranded DNA", + "24-oxo-1alpha,25-dihydroxyvitamin D3", + "3-hydroxyacyl-CoA", + "S-methyl-5-thio-alpha-D-ribose 1-phosphate", + "(R)-3-hydroxy-4-trimethylaminobutyrate", + "an N-methyl carbamate ester", + "chemokines", + "L-Tyrosine", + "(E)-cinnamoyl-CoA", + "D-myo-inositol 1,3,4-trisphosphate", + "titin", + "methyleugenol", + "far upstream element binding protein 1", + "protein C-terminal S-farnesyl-L-cysteine methyl ester", + "3 ferrocytochrome c", + "branched-chain alpha-keto acid decarboxylase/dehydrogenase", + "IgG L peptide", + "adefovir/out", + "(ribonucleotide)n-3'-hydroxyl", + "o-aminoacetophenone", + "4-amino-4-deoxy-N10-methylpteroic acid", + "troponin T", + "n Na+/in", + "2 4-coumaroyl-CoA", + "phosphatidylethanolamine[side 2]", + "(+/-)-alliin", + "D-Phe", + "(S)-N-methylcoclaurine", + "3-epicalcitroic acid", + "xyloglucan acceptor", + "26-deglucotorvoside H", + "2-(4-methylsulfonylphenyl)-1,3-benzothiazol-6-yl sulfate", + "glycochenodeoxycholic acid", + "luteose", + "9,10-anthracenedione", + "S-adenosyl-3-methylthio-1-propylamine", + "3 propionate-3-nitronate", + "stigmast-5-en-3-one", + "D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D-GlcNAc-diphosphodolichol", + "N-tetradecanoyl-(S)-homoserine lactone", + "hypoxia-inducible factor-(3S)-3-hydroxy-L-asparagine", + "lactose/out", + "28S rRNA fragment", + "interleukin-17A", + "N-[(R)-pantothenoyl]-L-cysteine", + "cytosine48 in tRNAGlyGCC", + "18 NADP+", + "L-ribulose", + "2-aminobutyrate", + "coproporphyrinogen III", + "2-oleoylglycerol", + "2 pyrimidine residues (in DNA)", + "alpha-barbatene", + "eIF4G", + "tRNA uridine38", + "[(1->2)-alpha-L-rhamnosyl-(1->4)-alpha-D-galacturonosyl]n+1", + "2-amino-5-chloro-benzoic acid", + "ginsenoside G17", + "Flp1 prepilin leader peptide", + "MSIQHFRVALIP", + "FoxO1a", + "adenylate kinase 5", + "7-beta-D-glucosyl-trans-zeatin", + "7-[(4-hydroxyphenyl)acetyl]aminocephalosporanic acid", + "thyrotropin releasing hormone", + "[estrogen receptor alpha]-L-tyrosine", + "3-vinyl-protochlorophyllide a", + "5'-phospho-U8 snoRNA", + "GlcNAc-beta-(1,4)-GlcNAc", + "1-methylurate", + "6-(2 6-bis[N-acetyl-beta-D-glucosaminyl]-alpha-D-mannosyl)-beta-D-mannosyl-R", + "loganic acid", + "a kinesin associated with a microtubule at position n+1 (toward the plus end)", + "invariant chain CD74 of the major histocompatibility II complex", + "cellobiose[side 1]", + "coenzyme Q0", + "quinonoid 7,8-(6H)-dihydrobiopterin", + "diphenylether", + "7-oxocholesterol 3-sulfate", + "skim milk", + "(9E)-tetradecenoate", + "1-O-hexadecanoyl-sn-glycero-3-phosphocholine", + "protein tyrosine kinase 7", + "Rec8", + "2'-dUDP", + "(S)-malyl-CoA", + "unpolar amino acid[side 2]", + "Procollagen", + "calcein/in", + "[Vac8p]-S-palmitoyl-L-cysteine", + "L-Asp-L-Phe", + "5'-O-beta-D-glucosylpyridoxine", + "Co2+/out", + "mesobiliverdin IXalpha", + "5-carboxymethyl-2-hydroxymuconate", + "mannosyl-alpha-(1,6)-mannosyl-alpha-(1,3)-mannosyl-alpha-(1 4)-galactosyl-beta-(1,6)-mannosyl-alpha-(1,2)-inositol phosphorylceramide", + "dolichyl palmitate", + "1-guanidino-1-deoxy-scyllo-inositol 4-phosphate", + "Acp33A protein", + "MKK3", + "ganglioside GM1", + "alpha-D-xylopyranose", + "H+[side2]", + "Ac-Val-Glu-Ile-Asp-7-amido-4-trifluoromethylcoumarin", + "4-[(2,4-diamino-6-(pteridinyl)methyl)-methylamino]-benzoic acid", + "nitrate", + "phosphatidylinositol-dependent kinase-1", + "4-feruloyl-CoA", + "alpha-nootkatol", + "kaempferol 3-O-glucoside malonylester", + "1D-myo-inositol 1,4,6-trisphosphate", + "light", + "2-chloro-1-phenylethan-1-one", + "phosphotyrosyl-STAT3", + "[HPr kinase]-serine/threonine", + "cyclo(L-phenylalanyl-L-phenylalanyl)", + "chlorophyllin a", + "[histone H2B]-N6-acetyl-L-lysine15", + "1-acyl-2-palmitoyl-sn-glycerol 3-phosphate", + "vanillic acid", + "corticosterone/out", + "alpha-D-glucose 1-fluoride", + "1D-myo-inositol 1,2,3,4,6-pentakisphosphate", + "S6 protein of the 40s ribosomal subunit", + "pullulan", + "4-methylcyclohexan-1-one", + "2'-(5''-triphosphoribosyl)-3'-dephospho-CoA", + "aldicarb", + "2 ATP", + "acetate", + "ethylbenzene", + "vomifoliol", + "monosialoganglioside GM3", + "an N-terminal-L-methionyl-L-tyrosyl-[protein]", + "(20S)-ginsenoside Rg1", + "doripenem", + "5'-dsRNA", + "fractalkine CX3CL1", + "trans-5-O-(4-coumaroyl)shikimate", + "oxidized phenazine methosulfate", + "deoxycytidine", + "hydroxysqualene", + "L-tyrosinyl-tRNAPhe", + "cholest-5-ene-3beta,25-diol", + "24(28)-methylene-24,25-dihydro-lanosterol", + "Lipid A/out", + "(R)-pantetheine", + "[Klebsiella pneumoniae cytoplasmic fumarate reductase]-L-threonine", + "brome mosaic virus RNA", + "PFHLLVYS", + "reduced methanophenazine", + "acetohexamide", + "L-glutamate[side 2]", + "(9Z,11S,12Z)-11-hydroperoxyoctadeca-9,12-dienoate", + "Cdk6", + "D-Tagatose 6-phosphate", + "indole-3-carboxylate", + "hemoglobin", + "2 propanoate", + "[RR06]-serine/threonine phosphate", + "1-arsono-3-phospho-D-glycerate", + "lyso-alkyl-glycerol phospholipid", + "L-2-methyl-3-oxopropionate", + "a (4E)-sphing-4-enine ceramide", + "maltose[side 1]", + "5alpha-cholestan-3beta-ol", + "long-chain carboxylic acid", + "2 NAD+", + "tetrahydrofolate-Glu", + "2-methyl-1-butanol", + "a 3beta-hydroxy-4alpha-methylsteroid-4beta-carboxylate", + "4-androstene-3,17-dione", + "isoxanthopterin", + "a [Co(I) methylamine-specific corrinoid protein]", + "2-hydroxybenzaldehyde", + "5 diphosphate", + "(6E)-8-hydroxycitronellol", + "protease activated receptor-2", + "kanamycin 3'-phosphate", + "D-myo-inositol 1,4,5-trisphosphate", + "dihydrooracin", + "dephospho-beta-tubulin", + "interleukin-7", + "flavivirus polyprotein", + "beta-D-galactosyl-1,3-N-acetylgalactosaminide mucin", + "L-trihomomethionine", + "prostamide H2", + "UDPglucuronic acid", + "phosphorylated ribosomal protein P2", + "(4R)-carvone", + "a [histone H3]-N6-methyl-L-lysine36", + "procollagen trans-3-hydroxy-L-proline", + "dithioerythritol disulfide", + "1,2-hexadecandiol", + "gastric mucin", + "(+)-trans-isopiperitenol", + "a linoleoyl-[glycerolipid]", + "5-hydroxyuracil-mismatched single-stranded DNA", + "(heparan sulfate)-N-sulfoglucosamine", + "5-dehydroquinate", + "H3O+", + "inositol (1,3,4,5,6)-pentakisphosphate", + "penicillin G", + "[SRPK2 protein]-ADP-D-ribose", + "mitochondrial transcription factor A", + "atrial natriuretic peptide", + "histidine-containing protein", + "[eukaryotic translation initiation factor 2]phosphate", + "[procollagen]-L-lysine", + "3-acetylchlorophyllide a", + "7-methyladenine", + "NADP+", + "phosphorylated NF-M", + "(E)-2-(acetamidomethylene)succinate", + "tmRNA-tagged protein", + "EPS8 protein", + "alpha-secretase", + "[tyrosine 3-monooxygenase] phosphate", + "phosphorylcholine", + "ADP-alpha-D-glucose", + "(R)-styrene glycol", + "fucoidan", + "2-aminoprop-2-enoate", + "nonpolar amino acid[side 2]", + "3-hydroxykynurenine", + "oligopeptides derived from immunoglobulin A1", + "UDP-D-galactofuranose", + "(2S)-2-amino-3-oxobutanoate", + "3 diphosphate", + "3-hydroxyethyl-bacteriopheophorbide a", + "talin", + "N-acetyl-L-leucine", + "[(R)-3-hydroxybutanoate]x", + "bacilysin", + "olive oil", + "phosphorylated S20 proteasome", + "carbonyl sulfide", + "2 dithioerythritol", + "3,N4-ethenocytosine", + "tyrosinase", + "[protein]-L-lysine", + "N-[6-O-(N-acetyl-alpha-D-glucosaminyl)phospho-alpha-D-mannosyl]-[alpha L-iduronidase]-L-asparagine", + "hypoxanthine34 in tRNAThr(IGU)", + "beta-D-ribosylnicotinamide", + "dihydrothymine", + "corn starch", + "p32-L-tyrosine", + "(ADP-D-ribosyl)n+1-tyrosine kinase Yes1", + "2,6-dichlorohydroquinone", + "octadecanoate", + "(R)-mandelamide", + "opsin", + "ribosomal S6 protein", + "diolein", + "complement component C2b", + "N-adipyl-6-aminopenicillanic acid", + "laminaripentaose", + "[GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala)]n diphosphoundecaprenol", + "2,4-dihydroxycinnamoyl-CoA", + "CDP-glycerol", + "3 UDP", + "tetracosanoyl-dihydroceramide", + "a long-chain carboxylate", + "quercetin 7-O-beta-D-glucopyranoside", + "(20R,22R)-20,22-dihydroxycholesterol", + "phosphorylated NADPH oxidase", + "1,7-dimethylxanthine", + "trans,octacis-decaprenylphospho-beta-D-ribofuranose 5-phosphate", + "2-oxo-4-hexenedioate", + "tumor necrosis factor-alpha", + "uracil16 in tRNA", + "epithelial cell-derived neutrophil activating peptide-78", + "a-factor-CaaX", + "xenobiotic[side 1]", + "an (R)-3-hydroxytetradecanoyl-[acyl-carrier protein]", + "androst-5-en-3,17-dione", + "desmethylxanthohumol", + "5-hydroxy-L-arginine", + "N6-[[SAMP3]-Gly-Gly]-[[protein]-L-lysine]", + "2 tRNATyr", + "2 ubiquinone-2", + "[histone H3R17]-L-arginine", + "3-methyl-2-buten-1-ol", + "a [sulfatase]-3-oxo-L-alanine", + "molybdopterin", + "cis-(homo)2aconitate", + "cis-2,3-dihydro-2,3-dihydroxybiphenyl", + "[NEDD8 protein]", + "D-glycero-alpha-D-manno-heptose 1-phosphate", + "5alpha-cholesta-8,24-dien-3beta-ol", + "glycosaminoglycan", + "2'-deoxy-2'-fluoro-beta-D-ribofuranosyl-uracil", + "3-hydroxybenzyl alcohol", + "1,2-diacylglycerophosphate", + "pre-part nucleotides", + "18 NADPH", + "C14:0-ceramide", + "fragments of amyloid-beta precursor protein", + "(ADP-D-ribosyl)n+1-tyrosine kinase Btk", + "Dehydroepiandrosterone", + "alpha-ylangene", + "L-(+)-ascorbate", + "(S)-tetrahydropapaverine", + "S-methyl-5-thio-D-ribose", + "5-methylcytosine", + "MARP2/Ankrd2", + "isovanillic acid", + "allopregnanolone", + "protocatechuyl-CoA", + "O-antigen serotype Yv 3-(2-aminoethyl diphosphate)", + "2-oxo-propylphosphonic acid", + "9 H2O", + "orotate", + "synapsin-1", + "(glycerophosphate)n", + "2 R'C(R)SH", + "reduced phenazine ethosulfate", + "ubiquitin-CEP52", + "dTDP-beta-L-rhodosamine", + "S-L-allo-isoleucyl-[CmaA-protein-T-domain]-4'-phosphopantetheine", + "an N-terminal L-methionyl-L-glutamyl-[protein]", + "2-acyl-sn-glycerol 3-phosphate", + "vinyl chloride", + "o-succinylbenzoyl-CoA", + "hexadecylpalmitate", + "cyclohexane-1,2-dione", + "4-demethylwyosine37 in tRNAPhe", + "1-O-hexadecyl-sn-glycero-3-phosphocholine", + "phosphorylated NR1 receptor", + "geranyl phosphate", + "beta-1,4-galactan", + "5alpha-pregnane-3alpha-ol-20-one", + "PprA phosphoprotein", + "actinomycin", + "dTDP-alpha-D-mycaminose", + "L-xylose", + "glycogenin", + "3beta-hydroxy-12-oxo-5beta-cholan-24-oic acid", + "maltose", + "D-ribulose 1,5-bisphosphate", + "coenzyme F420", + "3-hydroxy-L-kynurenine", + "Gli protein", + "phosphorylated Pah1 phosphatidate phosphatase", + "desmoplakin N5-pentylglutamine", + "aliphatic sulfonate-[sulfonate-binding protein][side 1]", + "N-isovaleryl-L-homoserine lactone", + "estrogen receptor beta", + "chondroitin-4-sulfate", + "androst-4-ene-3beta,17beta-diol", + "3,4,5-Trihydroxybenzoate", + "6-lactoyl-5,6,7,8-tetrahydropterin", + "2-hydroxymuconate-6-semialdehyde", + "puromycylpolypeptide", + "metalloprotease/in", + "interleukin IL-1alpha", + "N-glycoprotein", + "pentalenolactone", + "3,6-anhydro-alpha-L-galactopyranose", + "3,4,6-trimethyldibenzothiophene", + "interleukin proIL-18", + "histone L-lysine", + "[EF-Tu translation factor]-serine/threonine phosphate", + "[acceptor protein]-N6-monoubiquitinyl-L-lysine", + "L-phenylalanyl-tRNAPhe", + "L-glutamyl 5-phosphate", + "alpha-D-glucosyl-(1->2)-[(2->6)-alpha-D-fructosyl]n", + "(ADP-D-ribosyl)-Ras", + "1,5-anhydro-4-deoxy-D-glycero-hex-1-en-3-ulose", + "(S)-styrene oxide", + "[elongation translation factor 2]phosphate", + "maltotetraose", + "calciferol", + "Glu-Leu", + "RANTES 4-68", + "acyl-sn-glycerol 3-phosphate", + "7-deoxyloganin", + "3,5-dibromo-4-hydroxybenzoic acid", + "gentamicin C1", + "mature SpeB", + "3,6-anhydro-alpha-L-galactonate", + "alpha-D-glucan", + "LipD", + "N-lignoceroylsphinganine", + "grape monoterpenyl arabinofuranosylglucoside", + "etoposide", + "phosphatidylglycerol", + "a [methyl-Co(III) monomethylamine-specific corrinoid protein]", + "beta-cryptoxanthin", + "apolipoprotein B100", + "astaxanthin", + "(ADP-D-ribosyl)-vimentin", + "D-tyrosyl-tRNATyr", + "succinoglycan/in", + "S-geranylgeranyl-Rho GTPase", + "free intestinal alkaline sphingomyelinase", + "[protein]-3-O-(beta-D-GlcA-(1->3)-beta-D-Gal-(1->3)-beta-D-Gal-(1->4) beta-D-Xyl)-L-serine", + "phosphorylated c-Jun", + "phospho-AKT1S1", + "(3R)-3-hydroxydecanoyl-[acyl-carrier protein]", + "phosphorylated JNK2", + "1-alkyl-sn-glycero-3-phosphocholine", + "coproporphyrin III", + "phosphorylated ErbB2", + "2-oxo acid", + "phosphorylated cAMP-response element-binding protein", + "methylaminomethyl 2-thiouridine34 in tRNAGlu", + "(ADP-D-ribosyl)n+1-tyrosine kinase Csk", + "Scytalone", + "myo-inositol-1-phosphate synthase", + "4 A", + "tRNA(Phe)", + "6-prenyl-2-methoxy-3-methylflaviolin", + "phosphorylated GSK3 protein", + "monosaccharide", + "beta-L-arabinofuranosyl-L-hydroxyproline", + "N,N',N'',N''', N'''',N'''''-hexaacetylchitohexaose", + "71-hydroxychlorophyllide a", + "transferrin[Fe(III)]2", + "2-oxo-2H-pyran-4,6-dicarboxylate", + "5-hydroxybenzimidazolylcobamide", + "[SP-STK]-serine/threonine phosphate", + "(Z)-11-tetradecenoate", + "(+)-cis,trans-nepetalactone", + "4'-O-(1,4-alpha-D-glucosyl)n-alpha,alpha'-trehalose", + "3F3/2 kinase", + "phosphorylated TBP", + "oleamide", + "phosphorylated WRKY1", + "pigment cell-specific melanocyte protein", + "3 adenosyl-L-methionine", + "enterobactin/in", + "propionohydroxamate", + "3,4-dihydro-3,4-dihydroxy-2,2',5,5'-tetrachlorobiphenyl", + "(5-hydroxy-1H-indol-3-yl)acetaldehyde", + "3alpha,12alpha-dihydroxy-7-keto-5beta-cholanoic acid", + "oxidized luciferin", + "hexadecanol", + "human immunoglobulin A1", + "Cdc25C", + "S-adenosyl-4-(methylsulfanyl)-2-oxobutanoate", + "3 alpha-D-glucose", + "2-methylthio-N6-dimethylallyladenine37 in tRNA", + "riboflavin cyclic-4',5'-phosphate", + "DELTA7-ststigmast-7-en-3beta-ol", + "5-carboxymethylaminomethyl-2'-O-methyluridine34 in tRNALeu", + "fragments of amylose", + "gamma-enolase", + "D-Man-alpha-(1->2)-D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-[D-Man-alpha (1->6)]-D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D-GlcNAc diphosphodolichol", + "O-beta-D-glucosyl-trans-zeatin", + "N-terminal Nalpha-acetyl-lysyl-[beta-catenin]", + "3,4-dihydroxyphenethylamine", + "isopentenyl diphosphate", + "o-acetyl-L-homoserine", + "L-saccharopine", + "adenosine polyphosphate-1", + "procaspase-3", + "S-methyl-5-thio-D-ribose 1-phosphate", + "2-phenylethanol", + "ferrocytochrome c550", + "7Me-GpppA-C5", + "PSGL-1 protein", + "5'-TMP", + "2 Ca2+[side 1]", + "hyaluronic acid polymer", + "3-(acyloxy)acyl group of bacterial toxin", + "5-methylcytosine49 in tRNAGlu(UUC)", + "2-deoxy-D-ribosyl-base2", + "o-succinyl-1-benzoate", + "unfolded nascent polypeptide chain", + "guanine9 in tRNAValUAC", + "double-stranded plasmid DNA", + "Net", + "6-hydroxynornicotine", + "1-oxo-D-chiro-inositol", + "homoisocitrate", + "13-deoxycarminomycin", + "(E)-3,7-dimethylocta-1,6-dien-3,8-diol", + "phosphate", + "betacellulin", + "mature hepatocyte growth factor", + "beta-D-ribopyranose", + "triglycine", + "[actin]-L-arginine177", + "alpha-muricholate 3-sulfate", + "His/in", + "2-methyl-1,3-benzothiazol-5-ol", + "RSH", + "p21-activated kinase", + "sordaricin", + "a long-chain fatty acyl-CoA", + "a dynein associated with a microtubule at position n-1 (toward the minus end)", + "beta-D-glucosaminyl-Notch", + "beta-D-glucuronosyl-(1-3)-N-acetyl-beta-D-glucosaminyl-(1-4)-[nascent hyaluronan]", + "L-talose", + "mu-calpain", + "(3E)-4-(2-carboxyphenyl)-2-oxobut-3-enoate", + "phosphorylated p38 MAP kinase", + "D-mannose[side 1]", + "19 S proteasome", + "[Klebsiella pneumoniae sulfatase]-3-oxo-L-alanine", + "5-O-(indol-3-ylacetyl-myo-inositol) D-galactoside", + "1,2-diacyl-sn-lysophosphatidylglycerol", + "(glycerophosphate)n+1", + "dihydroxyacetonephosphate", + "Prostaglandin D2", + "inorganic phosphate", + "laminin", + "protein C/EBPalpha-N6,N6-dimethyl-L-lysine", + "alpha-D-glucose", + "nodavirus provirion", + "[heparan sulfate]-N-sulfo-D-glucosamine", + "C24:1 fatty acid", + "(3R)-3,4-epoxy-3-methylbut-1-ene", + "2-deoxy-D-glucose 6-phosphate[side 2]", + "a 2-acyl-1-lyso-phosphatidylserine", + "acid resistance regulator GdE protein", + "GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala) diphosphoundecaprenol", + "alpha-hydroxymuconic semialdehyde", + "human SP-D protein", + "1,2-dihydroxy-3-oxo-hex-1-ene", + "4,5-dihydroxy-3-methoxycinnamic acid", + "phosphorylated c-Jun N-terminal kinase", + "Man7GlcNAc2", + "Mg-protoporphyrin IX", + "20-oxo-5-O-beta-mycaminosyltylactone", + "questin", + "peptidyl-L-lysyl-peptide", + "5'-methylthioinosine", + "Akt phosphate", + "[E1 NEDD8-activating enzyme]-L-cysteine", + "histone H4 D-aspartate methyl ester", + "phospho-ERK", + "Fe-protein", + "an S-alkyl thiosulfate", + "sulfoquinovosyl diglyceride", + "1-phenylethanol", + "patchoulol", + "MEK-2", + "solavetivone", + "GlcNAcMan5GlcNAc", + "reduced ribonuclease A", + "pGp-ctRNAHis", + "3-oxooctanoyl-[acyl-carrier protein]", + "Zn2+-[zinc-binding protein][side1]", + "[myosin light chain]", + "Mg-deuteroporphyrin IX", + "cytidine34 in tRNALeuCAA", + "meso-diaminopimelate", + "D-idose", + "2-hydroxypyridine", + "streptolysin O", + "cis- and trans-dihydroquercetins", + "[connexin 43]-L-lysine", + "a sugar", + "Ca2+/calmodulin-dependent protein kinase II", + "Ca2+/in", + "aminopeptidase", + "16alpha-hydroxyprgesterone-16-O-D-glucuronate", + "nonanoyl-CoA", + "pheophytin a", + "N-acetyl-D-galactosaminyl-1,3-N-acetyl-D-galactosaminyl-1 3-D-galactosyl-1,4-D-galactosyl-1,4-D-glucosylceramide", + "[(2->1)-beta-D-fructosyl]n", + "uracil2843 in 25S rRNA", + "4-methyl-5-(2-phosphonooxyethyl)thiazole", + "poly[(R)-3-hydroxyoctanoate]n-x", + "alpha-5,6-dimethylbenzimidazole adenine dinucleotide", + "formate acetyltransferase-glycine", + "histone H3 N6-methyl-L-lysine36", + "bovine chymotrypsinogen", + "S-allyl-L-cysteine sulfoxide", + "MicX sRNA", + "phosphorylated JAK1", + "3-methyl-L-tyrosine", + "Arabidopsis thaliana protein AT4G38710", + "[heparan sulfate]-N-sulfoglucosamine", + "cytochrome c6", + "3-O-acetyl-4'-O-demethylpapaveroxine", + "[TGF-beta receptor I]", + "2-(2,4,7-trihydroxy-8-methoxy-1 4-benzoxazin-3-one)-beta-D-glucopyranose", + "parafusin", + "tricin", + "9-adenylylspectinomycin", + "isomaltotetraose", + "Insulin-(SS)", + "2-oxosuccinamate", + "serotonin beta-glucuronoside", + "11-cis-retinol-[retinal-binding-protein]", + "myo-inositol 3-phosphate", + "(9Z)-7,8-dihydroxyoctadeca-9-enoic acid", + "5-amino-6-(D-ribitylamino)uracil", + "laminin V", + "3alpha-hydroxyglycyrrhetic acid", + "ATF6", + "ursodeoxycholyltaurine/out", + "limonin 17-beta-D-glucopyranoside", + "MAPKK", + "protocadherin gamma A5", + "a [histone H4]-N6,N6-dimethyl-L-lysine20", + "UDP-N-acetylmuramyl-L-alanine", + "C-terminal fragment of beta-amyloid precursor protein", + "semaphorin-6D", + "D-Xylose", + "2 NADPH", + "ICAP-1alpha protein", + "L-Tyr-tRNATyr", + "2'-O-methylcytidine56 in initiator tRNAMet", + "1,2-dioleoyl-sn-lysophosphatidylcholine", + "N-formimidoyl-L-glutamate", + "glyceraldehyde", + "dimethylarsinate", + "5-methylpyridine-3-carboxamide", + "6-mercaptopurine-2'-deoxyriboside", + "8 reduced ferredoxin", + "phosphatidyl-1D-myo-inositol", + "heptanoyl-6-aminopenicillanic acid", + "dihydrorhizobitoxine", + "lysine/in", + "(3E,7E)-dolathalia-3,7,11-triene", + "gamma-aminobutylaldehyde", + "3-(methylsulfanyl)propanoate", + "L-lysine", + "MTS-rhodamine [side 2]", + "propanoate", + "3-hydroxy-5-methyltyrosine", + "neomycin B 2''-phosphate", + "indole-3-pyruvic acid", + "human CXCL-1", + "5-aminoimidazole-4-carboxamide ribotide", + "cefoxitin", + "peptides containing C-terminal Asn", + "oleuropein", + "[SoxYZ protein]-S-disulfanyl-L-cysteine", + "[(1,6)-alpha-D-glucosyl]n", + "D-ribulose", + "alpha-synuclein N5-alkylglutamine", + "DNA-RNA hybrid duplex", + "tissue factor", + "pro-nerve growth factor", + "reaction centre protein D1", + "streptokinase", + "ephrin B3", + "neomycin", + "isomethyleugenol", + "prochemerin chem163S", + "(2R)-2-[(R)-carboxy[[(2R)-2-hydroxy-2-phenylacetyl]amino]methyl]-5-[[(1 methyl-1H-tetrazol-5-yl)sulfanyl]methyl]-3,6-dihydro-2H-1 3-thiazine-4-carboxylic acid", + "3-(2-[N-acetyl-beta-D-glucosaminyl]-alpha-D-mannosyl)-beta-D-mannosyl-R", + "pro-urokinase", + "L-gulonic acid", + "5-amino-6-(5-phosphoribosylamino)uracil", + "sinalcohol", + "(S)-2,3,4,5-tetrahydropyridine-2,6-dicarboxylate", + "(S)-cheilanthifoline", + "all-trans-nonaprenyl diphosphate", + "harderoporphyrinogen-S-glutathione", + "integrin CD11b", + "[protein]-tyrosine", + "p-coumaroyl-CoA", + "monocyte chemotactic protein-1", + "hydrochlorothiazide/in", + "sulfate", + "[biotin carboxyl-carrier protein]-N6-biotinyl-L-lysine", + "histone 3", + "9,11alpha-epoxypregn-4-ene-3,20-dione", + "Man5-9GlcNAc", + "4-O-beta-D-mannopyranosyl-6-deoxy-D-glucopyranose", + "phosphorylated cyclin E", + "H-protein-lipoyllysine", + "epoxyqueuosine34 in tRNA", + "chemokine CCL2", + "nornicotine", + "4-amino-4-deoxy-alpha-L-arabinopyranosyl ditrans,octacis-undecaprenyl phosphate", + "Frizzled-7", + "N6-acetyl-N6-hydroxy-L-lysine", + "glutamate receptor subunit NR2B", + "elF4B", + "gapped DNA containing mismatches", + "[biotin carboxyl-carrier protein]-N6-carboxybiotinyl-L-lysine", + "2 oxidized ferredoxin iron-sulfur cluster", + "4-dimethylsulfonium-2-oxobutyrate", + "hypoxia-inducible factor-L-proline", + "L-lysyl-[protein]", + "5alpha-cholesta-7,22-dien-3beta-ol", + "soyasaponin III", + "2,3-dihydroxy-3-methylvalerate", + "3-oxoacyl-[acyl-carrier protein]", + "N7-methylguanine527 in 16S rRNA", + "5-Hydroxytryptophan", + "(2S)-3-sulfolactate", + "type IV Flp1 pilin", + "a quinol", + "1D-myo-inositol 3,4,5,6-tetrakisphosphate", + "leucine-rich repeat-containing protein 4B", + "N-methyl-D-Asp", + "2'-O-methylcytidine1920 in 50S rRNA", + "C20-phytosphinganine", + "an alkane", + "4-hydrazinobenzoic acid", + "LacYTM2 protein", + "7-((3E)-hex-3-enoyl)aminocephalosporanic acid", + "sialic acid polymer of length 12-14", + "sodium alginate", + "brassicasterol", + "N,N',N'''-triacetyl-beta-D-chitotriose", + "21-hydroxyprogesterone", + "[Pkn5]-serine/threonine phosphate", + "debranched sugar beet arabinan", + "(2S,3S)-beta-methyltryptophan", + "polycis-polyprenyl diphosphate", + "S-geranylgeranyl-RhoA GTPase", + "[protein]-N6-[(2S,3R)-2-amino-8-carboxyoctan-3-yl]-L-lysine", + "4alpha-methyl-8,14,24(28)-ergostatrien-3beta-ol", + "(S)-1-(4-pyridyl)ethanol", + "oxidized coenzyme Q", + "a [protein]-(3S)-3-hydroxy-L-lysine", + "CDPglycerol", + "adefovir/in", + "coniferaldehyde", + "an arylamine", + "D-galactosyl-D-galactosyl-D-glucosyl-N-acylsphingosine", + "C3a", + "2-methyl-6-all-trans-nonaprenylbenzene-1,4-diol", + "Mutant form of alkaline phosphatase PhoA61", + "elastic fiber", + "3-deoxy-alpha-D-manno-oct-2-ulopyranosyl-(2->4)-3-deoxy-alpha-D-manno oct-2-ulopyranosyl-(2->6)-2-deoxy-2-[[(3R)-3 hydroxypentadecanoyl]amino]-3-O-[(3R)-3-hydroxytetradecanoyl]-4-O phosphono-beta-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3 hydroxytetradecanoyl]-2-[[(3R)-3-hydroxytetradecanoyl]amino]-1-O phosphono-alpha-D-glucopyranose", + "UDP-N-acetylmuramic acid", + "N1-(5-phospho-D-ribosyl)glycinamide", + "Manalpha(1-2)Manalpha(1-3)Manbeta(1-4)GlcNAc", + "N-palmitoylsphinganine", + "1-acyl-2-oleoyl-sn-glycero-3-phosphoethanolamine", + "glycogen synthase", + "epithelial Na+ channel", + "2-phenylethan-1-ol", + "N2-propionyl-D-tryptophan", + "delta-L-alpha-aminoadipoyl-L-cysteinyl-D-valine", + "glucoamylase I", + "an aldehyde", + "growth hormone releasing hormone (1-44)", + "dibenzothiophene", + "active complement C1q", + "[R-phycocyanin alpha-subunit]-Cys84-phycourobilin", + "2-phenylethanal", + "1-heptanoyl-sn-glycerophosphocholine", + "naringenin", + "6alpha-hydroxy-ent-kaurane", + "3-dehydroecdysone", + "netilmycin", + "interleukin-6", + "hypoxanthine34 in tRNAVal", + "3-oxo-phenylpropanoate", + "CMP-8-amino-3,8-dideoxy-alpha-D-manno-octulosonate", + "pentane-2,4-dione", + "edaravone glucuronide/in", + "5-methyl-dCMP", + "eukaryotic translation initiation factor 4F p220 subunit", + "melphalan", + "D-tagatose 1,6-bisphosphate", + "2-hydroxy-6-oxonona-2,4-diene-1,9-dioate", + "D-ribose 5-phosphate", + "beta-D-GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala) diphospho-ditrans,octacis-undecaprenol", + "mitochondrial tRNAArg(UCU) uridine27", + "a 2,3-bis-(O-geranylgeranyl)-sn-glycero-phospholipid", + "Fe(III)", + "glucosylxyloglucan", + "4',5',7-trihydroxyflavanone 7-O-beta-D-glucoside", + "2-methoxybenzaldehyde", + "[dermatan]-N-acetylgalactosamine", + "alpha-D-Man-(1-3)-alpha-D-Man-(1-6)-[alpha-D-Man-(1-2)-alpha-D-Man-(1 2)-alpha-D-Man-(1-3)]-beta-D-Man-(1-4)-beta-D-GlcNAc-(1-4)-beta-D GlcNAc", + "phosphorylated troponin T", + "[protein]-L-tyrosine phosphate", + "O,O-diethylphosphorothioate", + "19 isopentenyl diphosphate", + "dihydrochelerythrine", + "Pin1", + "cobinamide-[cobalamin-binding protein][side 1]", + "an oxalyl thioester", + "Mn2+/in", + "acetamide", + "interleukin-1beta", + "N-terminal L-arginyl-[protein]", + "D-arabino-hex-3-ulose 6-phosphate", + "sucrose 6-phosphate", + "capsaicin", + "Co2+/in", + "ADP-D-ribose", + "N-carbamoyl-L-alanine", + "isobutanoyl phosphate", + "aciclovir (ACV-MP)", + "4',5',7-trihydroxyflavanone", + "inulooligosaccharides", + "[M3 muscarinic acetylcholine receptor]", + "poly(ADP ribose) polymerase 1", + "a [protein]-L-tyrosine phosphate", + "O-acetylcarnitine", + "Ac-RRLL-7-amido-4-methylcoumarin", + "monacolin L acid", + "3beta,7alpha,12alpha-trihydroxy-5beta-cholan-24-oic acid", + "D-Man-alpha-(1->3)-D-Glc-beta-(1->4)-D-Glc-alpha-1-diphospho-ditrans octacis-undecaprenol", + "[(beta-D-Fruf-(2-1))n+1]-alpha-D-Glup", + "heptanedioyl-CoA", + "butyryl-[acyl-carrier protein]", + "Pro-oxytocin/neurophysin", + "2 diphosphate", + "theobromine", + "N-acetylserotonin", + "des-Arg53-EGF", + "ganglioside GQ1b", + "5-methylcytosine48 in tRNAGly(GCC)", + "ubiquitinylated proteins", + "divinyl chlorophyllide a", + "L-valyl-tRNAMetG34C36", + "4-nitrophenyl laurate", + "tRNA pseudouridine38", + "3alpha-hydroxy-7-oxo-5beta-cholanoic acid", + "6-deoxy-6-fluoro-D-glucose", + "cellobiose", + "38 aa fragment", + "NFkappaB", + "4'-hydroxy-2',3,4-trichlorobiphenyl", + "(2R)-2-[(R)-carboxy[2-(thiophen-2-yl)acetamido]methyl]-5-[(E)-2-(2 4-dinitrophenyl)ethenyl]-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid", + "GMISLM", + "alpha-ketoisocaproic acid", + "8-gingerol 4'-O-beta-D-glucuronoside", + "poly-ADPribose polymerase 1 peptide fragments", + "11-deoxy-beta-rhodomycin T", + "reduced menadione", + "5-methylcytosine48 in tRNAAsp precursor", + "Wiskott-Aldrich syndrome protein", + "4-O-beta-D-glucopyranosyl-D-gluco-hexodialdose", + "hepatocyte growth factor", + "[LynE]-(L-amino acyl-L-cysteine)", + "beta-sitosterol 3-beta-D-glucoside", + "2,6-dichlorocyclohexan-1-one", + "tuftsin", + "flavodoxin", + "2'-O-methyladenosine1067 in 23S rRNA", + "2 indole-3-acetonitrile", + "1L-myo-inositol 1-phosphate", + "3',4',5-trihydroxy-3,7-dimethoxyflavone", + "N2-methylguanine10 in tRNA", + "1-benzofuran-6-ol", + "(-)-carvone", + "plasminogen activator inhibitor-1", + "Leu-Ile", + "a ferrocytochrome", + "5-(2-methoxy-2-oxoethyl)uridine34 in tRNA", + "2-oxobutyrate", + "cAMP-responsive element binding protein", + "Ste50", + "17-beta-estradiol", + "reduced 2,6-dichlorophenol indophenol", + "(5''R)-alpha-5''(6''H)-bithymine", + "RNA nucleotides", + "5-hydroxybenzimidazole", + "8 NAD(P)+", + "a 2'-deoxyribonucleoside 5'-triphosphate", + "histamine H2 receptor", + "methyl (2E,6E)-farnesoate", + "N-acetyl-D-glucosaminyldiphospho-ditrans,polycis-undecaprenol", + "L-triiodothyronine", + "3-amino-5-hydroxybenzoyl-[acyl-carrier protein]", + "lung surfactant protein A", + "a tripeptide[side 2]", + "calmodulin-dependent protein kinase II deltaB", + "[histone H3]-L-lysine79", + "phosphorylated IkappaB kinase", + "2'-AMP", + "cholest-4-en-3-one", + "MrpL32", + "3-methoxybenzaldehyde", + "7-(3-methylbut-2-enyl)-cyclo-L-Trp-Xaa", + "lichenan", + "purine base", + "bovine albumin", + "4-nitrophenyl butyrate", + "5-hydroxyectoine", + "N5,N10-methenyltetrahydrofolate", + "ADP-alpha-D-ribose", + "P1,P6-bis(5'-adenosyl)hexaphosphate", + "Ada protein", + "7,8-dihydroxykynurenate", + "fertilization envelope", + "N-3-oxo-decanoyl-L-homoserine lactone", + "(RhoAA) C-terminal S-farnesyl-L-cysteine", + "5-formamido-1-(5-phosphoribosyl)imidazole-4-carboxamide", + "sialic acid", + "11,11'-dichlorochromopyrrolic acid", + "O-fatty-acyl-L-carnitine", + "DELTA1-pyrroline-5-carboxylate", + "Ac-D-Leu-L-Trp-D-Leu-L-Trp-Gly-S-CoA", + "plastoquinone", + "D-galactosylceramide", + "phosphorylated glutamate receptor subunit GluR1", + "L-arogenate", + "glutaconyal-CoA", + "2 delphinidin", + "isocaprononitrile", + "a dihydroceramide", + "protein L-histidine73", + "(R)-pantoyl lactone", + "magnesium-divinyl-protochlorophyllide", + "SNTE", + "keratan sulfate", + "I-", + "a lipid hydroperoxide", + "methionine-polypeptide", + "cholest-5-en-3beta-ol", + "Man5GlcNAc2", + "ApoE glutamine", + "RCHO", + "2-succinylbenzoyl-CoA", + "8-demethyl tetracenomycin C", + "(S)-4-Hydroxymandelonitrile", + "reduced methyl viologen", + "N1-(3-benzylaminopropyl)butane-1,4-diamine", + "Ran guanine nucleotide-exchange factor RCC1", + "2-O-(alpha-D-mannosyl)-1-phosphatidyl-1D-myo-inositol", + "a steroid", + "4 NH3", + "phosphorylated Cdc25A", + "11alpha-hydroxyprogesterone-11-O-D-glucuronate", + "N1,N12-diacetylspermine", + "epigallocatechin", + "Glu-Asn", + "delta-hexachlorocyclohexane", + "(GlcNAcalpha(1-4))n", + "N3-methyluracil2634 in 25S rRNA", + "caffeate", + "N6-(dimethylallyl)adenosine phosphate", + "2 a mycocerosyl-[mycocerosic acid synthase]", + "biliverdin", + "myristate", + "(4E,6E)-3-oxoocta-4,6-dienoyl-S-ACP", + "beta-D-galactoside", + "1-phospho-alpha-D-galacturonate", + "L-N2-(2-carboxyethyl)arginine", + "(S)-2-(2-naphtyl)propionate", + "2-(acetylamino)-2-deoxy-beta-D-glucopyranose", + "diphosphoinositol polyphosphate", + "brain natriuretic peptide", + "(2-acetamidomethylene)succinate", + "fragments of elastin", + "tRNA containing 5'hydroxy and 2',3'-cyclic phosphate termini", + "ethiofencarb sulfoxide", + "perillyl alcohol", + "3-(indol-3-yl)pyruvate", + "4 hv", + "cyanocobalamin[side 2]", + "2-hydroxy-2-methylpropanoyl-CoA", + "25-hydroxyvitamin D3", + "alpha-L-fucosyl-(1,2)-D-galactose", + "propeptide of proteinase A", + "2'-deoxyribonucleoside 5'-phosphate", + "alpha-L-fucose", + "adenosylcob(I)alamine", + "all-trans-3,4-didehydrolycopene", + "2 reduced adrenodoxin", + "diadenosine 5',5'-P1,P4-tetraphosphate", + "L-proline[side 2]", + "endothelin-3", + "Mn3+", + "2-butyne-1,4-diol", + "beta-phenylalanine", + "stearoyl-acyl-carrier protein", + "9-[beta-L-lyxofuranosyl]-2-fluoro-adenine", + "6-O-beta-D-xylopyranosyl-beta-D-glucopyranose", + "phosphotyrosinyl Bad protein", + "[p27Kip1]-L-tyrosine", + "acylglycerol", + "beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1 >4)-beta-D-GlcNAc-N-Asn-[lysosome-associated membrane glycoprotein 2]", + "alpha-N-acetylneuraminyl-(2->8)-alpha-N-acetylneuraminyl-(2->3)-beta-D galactosyl-R", + "[E2 ubiquitin-conjugating enzyme UBCH7]-S-ubiquitinyl-L-cysteine", + "furan-2,5-dicarbaldehyde", + "tiazofurin adenine dinucleotide", + "(9R,13R)-8-[(1R,2R)-3-oxo-2-((Z)-pent-2-enyl)cyclopentyl]octanoate", + "phosphorylated phosducin", + "8-amino-8-demethyl-D-riboflavin", + "pyridoxal-5'-phosphate", + "2-amino-1-hydroxyoctadecan-3-one", + "serologically defined colon cancer antigen 3", + "(L-glutamyl)adenylate", + "phosphorylated MEF2", + "TDP-43", + "(1,4-beta-D-xylan)n+1", + "tamoxifen", + "stearoyl-[acyl-carrier protein]", + "[SAMP2]-Gly-Gly", + "amyloid beta 1-40 peptide", + "(4S)-4,6-dihydroxy-2,5-dioxohexanoate", + "[acceptor protein]-L-lysine", + "beta-apo-4'-carotenoic acid", + "5-methylcytosine34 in tRNAPro(CGG)", + "1-(3-sn-phosphatidyl)-L-myo-inositol 4,5-bisphosphate", + "oxidized ferrdoxin", + "N4-[N-acetyl-beta-D-glucosaminyl-(1-2)-alpha-D-mannosyl-(1-3)-[N-acetyl beta-D-glucosaminyl-(1-2)-alpha-D-mannosyl-(1-6)]-beta-D-mannosyl-(1-4) N-acetyl-beta-D-glucosaminyl-(1-4)-[alpha-L-fucosyl-(1-6)]-N-acetyl beta-D-glucosaminyl]asparagine", + "Ile", + "carbon disulfide", + "Atf1", + "[DNA-directed eukaryotic RNA polymerase II subunit IIa]", + "germacradien-4-ol", + "baccatin III", + "c-Jun N-terminale kinase", + "L-glutamine", + "D-galactarolactone", + "phosphorylated pyruvate dehydrogenase", + "integrin", + "L-alpha-aminoadipate", + "2 [methionine synthase]-methylcob(I)alamin", + "GDP-alpha-D-mannose", + "glycero-3-phosphoethanolamine", + "2 long-chain aldehyde", + "(2S)-2-[(1R)-1-hydroxydecyl]decanoic acid", + "gingerol 4'-O-beta-D-glucuronoside", + "sinapoyl-CoA", + "(E)-crotonyl-CoA", + "cytosolic SNARE", + "urate/in", + "taurine", + "5-methylcytosine38 in tRNAValAAC", + "moxalactam", + "inhibitory killer cell Ig-like receptor", + "L-isoleucyl-tRNAIle", + "dihydroxyfumaric acid", + "2-Deoxyribose 5-phosphate", + "steroidogenic acute regulatory protein", + "(2S,5S)-5-carboxymethylproline", + "2-aminomuconate semialdehyde", + "ent-7alpha-hydroxykaur-16-en-19-oate", + "N4-[N-acetyl-beta-D-glucosaminyl-(1-2)-alpha-D-mannosyl-(1-3)-[N-acetyl beta-D-glucosaminyl-(1-2)-alpha-D-mannosyl-(1-6)]-beta-D-mannosyl-(1-4) N-acetyl-beta-D-glucosaminyl-(1-4)-N-acetyl-beta-D glucosaminy]asparagine", + "2-ethynylphenol", + "holo-[4-hydroxyphenylalkanoate synthase]", + "2-methylbenzaldehyde", + "1-O-fluoro-4-O-alpha-D-xylopyranosyl-beta-D-xylopyranose", + "(3S)-2-oxo-3-methyl-3-phenylpropanoate", + "glutamine synthase", + "monodehydroascorbate[side 1]", + "double-stranded DNA-3-methylcytosine", + "L-dopachrome", + "collagen I propeptide", + "phosphorylated NF-kappaB", + "6 ferrocytochrome c", + "2'-deoxyadenosine", + "phenylglyoxylate", + "all-trans-retinal-[cellular-retinol-binding-protein]", + "RNA terminal-2',3'-cyclic-phosphate", + "24-methylenecholesterol", + "G(5')ppp(5')RNA", + "N-carboxybenzoyl-L-glutaminylglycine", + "Na+-channel", + "UDP-N-acetylgalactosamine", + "9-hydroxynonanoic acid", + "ferricytochrome P450", + "Nalpha-acetyl-PCNP protein", + "harderoheme IV", + "5,6alpha-epoxy-5alpha-cholestan-3beta-ol", + "cis-Aconitate", + "paxilin tyrosine phosphate", + "2,3,5,6-tetrachlorophenol", + "[GLDH1 protein]-N6-(lipoyl)lysine", + "(11Z,14Z,17Z)-icosa-11,14,17-trienoyl-CoA", + "retinyl ester", + "human protease-activated receptor PAR-1", + "dihydrokaempferol", + "dTDP-4-amino-2,3,4,6-tetradeoxy-alpha-D-erythro-hexopyranose", + "(-)-bornyl diphosphate", + "acceptorH2", + "mRNA-poly(A)", + "beta-1,3-xylobiose", + "Manalpha(1-3)GlcNAc", + "splicing factor 2", + "hexitol phosphate", + "tetrahydropteroylpentaglutamate", + "phosphoribosyldiphosphate", + "2 N-(2,3-dihydroxybenzoyl)-L-serine", + "eukaryotic elongation factor 1A", + "N-cadherin", + "13-deoxydaunorubicin", + "phosphorylated autophagy-related protein kinase Atg1", + "(5Z,8Z,11Z,14Z,17Z)-eicosa-5,8,11,14,17-pentaenoyl-[glycerolipid]", + "6-deoxy-D-glucose", + "(E)-2-benzylidenesuccinyl-CoA", + "phosphorylated p21-activated kinase", + "(-)-beta-caryophyllene", + "taxusin", + "2-methyl-2-phenylpropionic acid", + "5beta-cyprinol", + "eukaryotic initiation factor 1-478", + "S-2-(indol-3-yl)acetyl-CoA", + "7alpha-hydroxy-4-cholesten-3-one", + "cytosine50 in tRNAPro(UGG)", + "caprylate", + "2-acylglycerol", + "epsilon-N-biotinyl-L-lysine", + "[RNA polymerase II]", + "2-phenylethyl benzoate", + "3-methyl-1,2-didehydro-2,3-dihydrobotryococcene", + "fludarabine 5'-phosphate", + "2 alliin", + "methyl-cob(III)alamin", + "oxaloglycolate", + "(4R)-4-hydroxysphinganine ceramide", + "2-dicarboxylic acyl-sn-glycerol 3-phosphate", + "L-erythritol 1-phosphate", + "factor XIIIa", + "N-butyryl-L-homoserine-1,4-lactone", + "oxythiamin", + "uracil in tRNA", + "veratraldehyde", + "(-)-trans carveol", + "1-O-alkyl-sn-glycero-3-phosphocholine", + "N-acetyl-glutamate-gamma-semialdehyde", + "phospho-Mek1", + "STAT1c", + "amidinoproclavaminate", + "D-glucoamine 6-phosphate", + "(9Z)-hexadec-9-enoyl-CoA", + "4-methoxypyridine-3-carboxamide", + "alkane", + "(3R)-3-hydroxybutan-2-one", + "4-(3-methylbut-2-enyl)-L-tryptophan", + "NADH dehydrogenase (ubiquinone) Fe-S protein 3", + "(5S)-5-amino-3-oxohexanoate", + "Manbeta(1-4)GlcNAc", + "5-methylthioribose", + "3-beta-D-galactosyl-4-beta-D-galactosyl-O-beta-D-xylosyl-[protein]", + "3beta-hydroxy-8'-apo-beta-carotenal", + "unidentified product", + "[myosin II heavy-chain] phosphate", + "linoleic acid hydroperoxide", + "alpha-aminoadipate semialdehyde", + "(2S,2'S)-2,2'-(pentane-1,5-diylbis[oxy[(11S 11aS)-11-hydroxy-7-methoxy-5-oxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2 1-c][1,4]benzodiazepine-8,10(5H)-diyl]carbonyloxymethanediylbenzene-4 1-diylcarbamoylimino])dipentanedioic acid", + "Gln-tRNAGln", + "oxidized cytochrome c550", + "ribosomal S2 protein", + "ADAMTS13", + "beta-glucosylceramide", + "3,4-dihydroxy-9,10-seconandrost-1,3,5(10)-triene-9,17-dione", + "Escherichia coli M1 RNA", + "2-phenylethyl 6-O-beta-D-xylopyranosyl-beta-D-glucopyranoside", + "cob(II)yrinic acid a,c-diamide", + "2-oxopropylphosphonic acid", + "2 Ca2+[cytoplasm side]", + "FlaB2", + "collagen", + "phospho-MEK2", + "mitogen-activated protein kinase kinase-4", + "dXMP", + "peptidyl(2-hydroxyglycine)", + "an N-terminal-L-seryl-[protein]", + "DAPK2 protein", + "Gal-beta-(1-4)-GlcNAc-beta-(1-3)-Gal-beta-(1-4)-Glc", + "an [prolipoprotein]-S-1,2-diacyl-sn-glyceryl-L-cysteine", + "domain B", + "17alpha-hydroxypregnenolone", + "trans-2-chloro-3-methyldienelactone", + "[p53]-N6-acetyl-L-lysine", + "UDP-2-acetamido-3-amino-2,3-dideoxy-alpha-D-glucuronate", + "14-hydroxymyristic acid", + "a pyranoside", + "l-4-carboxy-4-hydroxy-2-oxoadipate", + "soluble starch", + "Argonaute 2", + "4-O-beta-D-mannopyranosyl-beta-D-mannopyranose", + "phospho-gemcitabine", + "gentamicin", + "phosphorylated CFTR protein", + "dehydroepiandrosterone 3-O-sulfate", + "protein Npi-phospho-L-histidine", + "D-iditol", + "poly(3-hydroxyoctanoic acid)", + "(9Z,11E,15Z)-(13S)-hydroperoxyoctadeca-9,11,15-trienoate", + "a fatty aldehyde", + "D-xylose-[xylose-binding protein][side1]", + "parasin I", + "3-mercaptopyruvate", + "2-hydroxy-5-(methylthio)-3-oxopent-1-enyl phosphate", + "pro-interleukin-6", + "5-chloro-7-iodo-8-quinolinol", + "phosphorylated Cdc25C", + "coniferyl alcohol", + "N-(4-oxoglutaryl)-L-cysteinylglycine", + "vimentin-L-arginine", + "amylin", + "5 isopentenyl diphosphate", + "(R)-1-aminopropan-2-ol", + "berberine", + "p130Cas-L-tyrosine phosphate", + "cyanidin 3-O-beta-D-galactoside", + "D-Man-alpha-(1->2)-D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-[D-Man-alpha (1->2)-D-Man-alpha-(1->3)-D-Man-alpha-(1->6)]-D-Man-beta-(1->4)-D GlcNAc-beta-(1->4)-D-GlcNAc-diphosphodolichol", + "L-quinate", + "protein-cysteine", + "2-methylphenol", + "UDP-N,N'-diacetylbacillosamine", + "n ATP", + "N-acetoxy-4-aminobiphenyl", + "DNA N4-methylcytosine", + "GluA1 protein", + "(S)-3-hydroxy-4-trimethylaminobutyrate", + "1-riburonosyluracil", + "creatinine", + "topotecan/out", + "8-O-methyldihydrosterigmatocystin", + "heparan sulfate N-acetyl-alpha-D-glucosaminide", + "(E)-geranyl diphosphate", + "myeloid cell leukemia 1", + "85000 Da fragment", + "H+", + "3-aminobutanal", + "Se-methyl-L-selenocysteine", + "integrin subunit beta1", + "2,5-didehydro-D-gluconate", + "guanine2445 in 23S rRNA", + "pimeloyl-CoA", + "adipate", + "L-alpha-aminoadipoyl-L-cysteinyl-D-valine", + "N,N-dihydroxy-L-aspartate", + "G(5')pppR-RNA", + "[PTEN]-L-lysine", + "(E)-indol-3-ylacetaldehyde oxime", + "malonate-semialdehyde", + "(ribonucleotide)m", + "KPGLKR", + "N-ribosylpyrimidine", + "3-methyladenine", + "ROCK2", + "cobalt-precorrin-6A", + "LLGNSSPRTQSPQNC(farnesyl)-OCH3", + "Cys-Gly", + "phosphorylated Hice1 subunit of Augmin complex", + "(3S)-acetoin", + "(E)-oct-2-enal", + "(S)-laudanosine", + "cinnamoylferuloylmethane", + "trans-2,3-didehydroacyl-CoA", + "(+)-isomenthone", + "4-fluorobenzoyl-CoA", + "an ultra-long-chain mono-unsaturated acyl-[acyl-carrier protein]", + "2 starch", + "DNA (without O6-chloroethylguanine)", + "(E)-2-(2-(6-((4-acetoxybenzyl)oxy)-2,3-dihydro-1H-xanthen-4-yl)vinyl)-3 3-dimethyl-1-propyl-3H-indolium", + "pyrimidine 5'-nucleotides", + "N1-methylguanine9 in tRNAThrCGU", + "1G-kestotetraose", + "phosphorylated Rvs167 protein", + "beta-D-galactosyl-1,3-N-acetyl-D-galactosaminyl-R", + "immunglobulin Fd", + "pro-interleukin-37", + "2 L-ascorbate", + "3-formyl-2,4-dihydroxy-6-methylbenzoic acid", + "D-galactosyl-N-acylsphingosine", + "potato amylose", + "globotriaosylceramide", + "p-methoxy-ethylamphetamine/in", + "(31R)-(1-hydroxyethyl)-8-ethyl-12-methyl-bacteriochlorophyllide d", + "penicillin F", + "phosphorylated histone H1", + "isovitexin 2''-O-beta-D-glucoside", + "[PER2 protein]-L-lysine", + "5-amino-levulinate", + "D-Man-alpha-(1->3)-D-Glc-beta-(1->4)-D-Glc-alpha-1 diphosphoundecaprenol", + "N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-glucuronosyl-proteoglycan", + "2-hexanol", + "Oxaloacetate", + "[TruE2]-(S,S)-2-(C-substituted-aminomethyl)-4-acyl-5-methyl-2-oxazoline", + "KiTH", + "alpha-ketoisovalerate", + "glycolithocholic acid", + "dihydroxypropanone", + "cis-oleic acid", + "mitochondrial-protein[side 2]", + "2,5-furandicarboxylic acid", + "4-deoxy-beta-D-gluc-4-enuronosyl (1->4)-beta-D-glucuronan", + "vanillyl alcohol", + "PAF-C", + "alternan", + "von Willebrand factor 176-kD fragment", + "gentisate", + "2,3-bis((R)-3-hydroxytetradecanoyl)-beta-D-glucosaminyl-(1->6)-2 3-bis((R)-3-hydroxytetradecanoyl)-alpha-D-glucosaminyl 1-phosphate", + "Leu", + "C12:0-ceramide", + "2-lysophosphatidate", + "deoxycorticosterone", + "fatty acyl-[acyl carrier protein]", + "(2R/3R)-dihydroquercetin", + "3-dehydrosphinganine", + "16,17alpha-epoxyprogesterone", + "2-pentenoyl-CoA", + "mature mRNAs", + "HCl", + "class I MHC HC", + "Phe-Ala", + "von Willebrand factor 115", + "phosphorylated myelin basic protein", + "(1R,2S)-1,2-epoxypropylphosphonate", + "n-octanol", + "L-rhamnono-1,4-lactone", + "7,12-dimethylbenz[a]anthracene", + "alpha-D-Gal-(1->3)-alpha-D-GlcNAc-diphospho-ditrans octacis-undecaprenol", + "(-)-camphor", + "1-O-cinnamoyl-beta-D-glucose", + "[SAMP3]-Gly-Gly", + "[chaperone Tig]-L-arginine", + "pro-cholecystokinin", + "cytosine48 in tRNALeuCAA", + "N-Acetyl-D-glucosaminylphosphatidylinositol", + "4-hydroxybutanoyl-CoA", + "pyroGlu-His-Trp-Ser-Tyr", + "K+/in", + "cis-2-chloro-5-methyldienelactone", + "aprotinin", + "human complement component C2", + "docosanoyl-[(phenol)carboxyphthiodiolenone synthase]", + "(1R,2S)-epoxypropylphosphonate", + "(6R)-6-(L-erythro-1,2-dihydroxypropyl)-7,8-dihydro-6H-pterin", + "fragments of Yersinia outer proteins", + "serotonin", + "6,7-dichloro-L-tryptophan", + "1-pyrroline-2-carboxylate", + "L-leucyl-protein", + "phospho-tyrosinyl-beta-catenin", + "L-phenylalanyl-protein", + "alpha-N-phenylacetyl-L-glutamine", + "FMNH", + "n H+/out", + "3,4-trans-dihydroxy-cyclohexa-1,5-diene-1-carboxylate", + "(2R,4S)-2-methyl-2,3,3,4-tetrahydroxytetrahydrofuran[side 2]", + "Co-precorrin-2", + "juvenile hormone", + "phosphorylated acetyl-CoA carboxylase 1", + "cholesterol sulfate", + "hydroxyacetate", + "phosphorylated protein kinase Czeta", + "dihydrosanguinarine", + "5'-deoxy-5'-(hydroxyethylthio)adenosine", + "[50S ribosomal protein L16]-(3R)-3-hydroxy-L-Arg81", + "pppGp-tRNAHis", + "a dodecanoyl-[acyl-carrier protein]", + "a plasmenylethanolamine", + "phosphorylated ILK1", + "5 1,3,6,8-tetrahydroxynaphthalene", + "N-3-oxo-tetradecanoyl-L-homoserine lactone", + "L-Dopa", + "2-hydroxymuconate 6-semialdehyde", + "Starvation proteins", + "apo-[propanoyl-CoA:carbon-dioxide ligase (ADP-forming)]", + "3-phospho-DL-glycerate", + "(1R,2R,4aS,4bR,6aS,10aS,10bR,12aS)-2,4b,7,7,10a 12a-hexamethyl-1-[(3R)-3-(4-methylphenyl)butyl]octadecahydrochrysen-2 ol", + "an ultra-long-chain ceramide", + "carlactone", + "aldose 1-phosphate", + "(Z)-icos-5-enoyl-CoA", + "diazaborine/vacuole", + "phosphorylated M1 muscarinic acetylcholine receptor", + "1,25-dihydroxyvitamin D3", + "ecdysone", + "poly(3-hydroxyoctanoate)", + "rne mRNA", + "sgRNAn+1", + "an alpha-Hep-(1->3)-alpha-Hep-(1->5)-[alpha-Kdo-(2->4)]-alpha-Kdo-(2->6) [lipid A]", + "3-hydroxy-2-methylbutanoyl-CoA", + "Asp-Leu", + "Kaposi sarcoma-associated herpesvirus ORF57", + "glucosyl-ichangin", + "isoamyl alcohol", + "cyanidin 3,7-di-O-beta-D-glucoside", + "monocyte chemotactic protein 1", + "23S rRNA", + "oxidized pseudoazurin", + "[ZAP-70]-L-tyrosine", + "cytidine32/guanosine34 in tRNALeu", + "L-Araalpha(1-5)Ara", + "N-acetyl-alpha-D-galactosaminyl-polypeptide Muc1", + "2-methyl-4-amino-5-phosphomethylpyrimidine", + "[protein-PII GlnB]", + "(2E)-4-[(2-amino-2-carboxyethyl)amino]-4-oxobut-2-enoate", + "trimethylpyrrocorphin", + "xanthosine 5'-triphosphate", + "3'-methoxydelphinidin 3-O-glucoside", + "L-prolyl-[L-prolyl-carrier protein]", + "9alpha,11alpha-prostaglandin F2alpha", + "L-glyceraldehyde", + "threo-9,10-phosphonooxy-hydroxy-octadecanoic acid", + "C35-(phenol)carboxyphthiodiolenone-[(phenol)carboxyphthiodiolenone synthase]", + "N-acetyl-D-galactosaminyl-(1->4)-beta-D-glucuronyl-(1->3)-beta-D galactosyl-proteoglycan", + "N6-[[SAMP2]-Gly-Gly]-[[UbaA]-L-cysteine]", + "2-(O-alpha-D-glucopyranosyl)-3-phospho-D-glycerate", + "alpha-D-Man-(1-3)-[alpha-D-Man-(1-6)]-alpha-D-Man-(1-6)-beta-D-Man", + "(3R)-2-oxo-3-phenylbutanoate", + "N-3-hydroxydecanoyl-L-homoserine lactone", + "NeuAcalpha(2,3)-Galbeta(1,4)[Fucalpha1-3]-GlcNAc-R", + "dTDP-3-dehydro-4,6-dideoxy-alpha-D-glucopyranose", + "KDIEDVF", + "(Z)-beta-ocimene", + "4 S-adenosyl-L-methionine", + "(3beta,5xi,6alpha,12beta,13xi)-3,6,12-trihydroxydammar-24-en-20-yl 6-O-beta-D-xylopyranosyl-beta-D-glucopyranoside", + "leukotriene C4/out", + "phosphorylated tau protein", + "1'-oxo-2'-L-hydroxypropyl-tetrahydropterin", + "S6-kinase", + "gastrin-releasing peptide-(14-27)", + "heme oxygenase 1", + "human chorionic gonadotropin alpha", + "15,16-epoxydolabrene", + "human antiprotease alpha2-antiplasmin", + "(+)-bornyl diphosphate", + "[PrkG]-serine/threonine", + "zymogen C1s", + "picornavirus polyprotein", + "1-O-sinapoyl-beta-D-glucopyranose", + "extracellular domain peptide of SpoIVFA", + "alpha-carotene", + "17-(4-hydroxyphenyl)heptadecanoyl adenylate", + "tau-protein", + "a 2-hydroxycarboxylate anion", + "nerylneryl diphosphate", + "NADPh", + "[protein]-N6-acetyl-L-lysine", + "[Fluor de Lys protein]-N6-acyl-L-lysine", + "TPIalpha", + "5-keto-D-gluconate", + "alpha-L-Fucp-1,2-beta-D-Galp-O(CH2)7CH3", + "N-carbamoyl-L-ornithine", + "(20S)-protopanaxatriol", + "galactoxylomannan", + "[TtuB sulfur-carrier protein]", + "L-arginyl-[L-arginyl-carrier protein]", + "cytosine59 in vtRNA1.3", + "3-methylxanthine", + "2 6,7-dimethyl-8-(1-D-ribityl)lumazine", + "ciprofloxacin", + "3-(2-naphthyl)alanyl-tRNATyr", + "phenyl alpha-L-fucosyl-(1->2)-beta-D-galactopyranoside", + "coenzyme alpha-F420-3", + "beta-D-glucuronosyl-(1->4)-N-acetyl-alpha-D-glucosaminyl-proteoglycan", + "lung surfactant", + "dihydrochanoclavine-I aldehyde", + "glucitol", + "1-aminoheptane", + "D-xylopyranose", + "L-Lys-D-Ala-D-Ala", + "D-galactofuranosyl-(1->5)-beta-D-galactofuranosyl-(1->6)-beta-D galactofuranosyl-(1->5)-beta-D-galactofuranose", + "(3R,3S)-acetoin", + "2,3-Diketo-L-gulonic acid", + "gentiobiose", + "(7S)-salutaridinol", + "N-valeryl-6-aminopenicillanic acid", + "1-O-alpha-D-galactosyl-sn-glycerol 3-phosphate", + "DNA with apurinic site", + "5,6-dihydroxyeicosatrienoic acid", + "[citrate (pro-3S)-lyase](thiol form)", + "steroid sulfates", + "ribavirin", + "[G-protein-coupled receptor] phosphate", + "butane-1-sulfenic acid", + "4-Hydroxybenzoyl-CoA", + "3-glutathionyl-2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid", + "double-stranded RNA", + "guanylyl imidodiphosphate", + "NEM", + "cinnamaldehyde", + "L-arginine", + "methylamine", + "pro-vasopressin", + "activated transcription factor TFIIIC", + "phosphorylated MAPKAP-K3", + "2'-O-methylcytidine32/2'-O methylguanosine34 in tRNAPhe", + "biliverdin-IX-alpha", + "phosphorylated EB1c", + "gentamicin 2''-phosphate", + "hexadecanoic acid", + "N-formyl-L-glutamate", + "dihydroneopterin triphosphate", + "delphinidin 3-O-(6''-O-malonyl)-beta-glucoside-3',5'-di-O-beta-D-glucoside", + "WIZ", + "coenzyme F420H2", + "artemisinate", + "mannan", + "3-epi-25,26,27-trinor-23,24-epoxide-1alpha-hydroxyvitamin D3", + "alpha-D-mannose 1-phosphate", + "4-hydroxy-N-desmethyl-tamoxifen beta-D-glucuronoside", + "2-cyclohexen-1-one", + "2-methylbenzoate", + "5-methylcytosine49 in tRNAGly(UCC)", + "pro-urokinase-type plasminogen activator", + "tRNAGlyCysLeu precursor", + "phospho-annexin 4", + "7-hydroxycoumarin", + "[phosphatase 2A protein]-leucine", + "4-O-beta-D-GlcNAc-1 6-anhydro-MurNAc-L-Ala-gamma-D-Glu-m-DAP-D-Ala-D-Ala", + "phloroglucinol", + "13-OH-chlorophyll a", + "Chk2", + "phosphorylated histidine-containing protein", + "anthranilate", + "ADP-D-glucose", + "(1,4-alpha-D-glucosyl)n", + "methyl pyridine-3-carboxylate", + "guanine37 in tRNA", + "mycoredoxin", + "[HBsu]-L-lysine", + "Akt", + "5 NADP+", + "L-xylono-1,5-lactone", + "M protein", + "[cation channel SK4]-N-phospho-L-histidine", + "S-nitrosoglutathione[side 2]", + "positively supercoil DNA", + "sphingosine-1-phosphate/in", + "cytosine49 in tRNAasp precursor", + "oxidized electron", + "TMP", + "tRNAThr2", + "polysulfide", + "2-O-(5Z,8Z,11Z,14Z)-eicosatetraenylglycerol", + "L-glucarate", + "(4E,8E)-sphinga-4,8-dienine", + "phosphorylated stathmin", + "alpha-D-mannosyl-1,6-(N-acetyl-beta-D-glucosaminyl-1 2-alpha-D-mannosyl-1,3)-beta-D-mannosyl-R", + "D-Asp", + "hydrochlorothiazide/out", + "2 fragments of complement component C2", + "phosphorylated SP20 protein", + "3-alpha-L-mycarosylerythronolide B", + "prion protein 94-233", + "alpha-terpinene", + "CD27 protein", + "MSP-1", + "betaine aldehyde hydrate", + "4-hydroxybenzoyl-CoA", + "KbpA protein", + "[thiamine-binding protein][side 1]", + "beta-D-GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-O-P-Glu-L-Lys-D-Ala-D Ala)-diphospho-ditrans,octacis-undecaprenol", + "erythromycin C", + "Dab1 protein", + "2 glutamine", + "processing enhancing protein", + "Naloxone", + "phosphorylated MAPKAPK2", + "thyrotrophin-releasing hormone", + "active thrombin", + "(10E,12Z)-hexadeca-10,12-dienoyl-CoA", + "N-Acetylanthranilate", + "N-acetyl-alpha-neuraminyl-(2->6)-beta-D-galactosyl-R", + "mitogen-activated protein kinase kinase 7", + "2-hydroxy-6-oxohepta-2,4-dienoate", + "N-tetradecanoyl-glycyl-pp60c Src", + "2-methyl-trans-aconitate", + "dodecanoyl-[acyl-carrier protein]", + "phosphorylated dynamin I", + "2-coumarate", + "urotensin II", + "[methyl coenzyme-M reductase subunit McrA]-(5S)-C-methyl-L-arginine275", + "phosphorylated CaV1.2 protein", + "glycyl-HIV1 Nef protein N-terminal peptide", + "[LysW]-C-terminal-gamma-(L-2-aminoadip-2-yl)-L-glutamate54", + "p65/RelA", + "L-xylo-3-hexulose", + "insulin-like growth factor-binding protein-4", + "formate", + "2'-deoxy-D-ribosyl-adenine", + "cyanamide", + "histone H2A-L-citrulline", + "holo-[mycolipanoate synthase]", + "9'-cis-neoxanthin", + "ADP-beta-L-glycero-D-mannoheptose", + "guanosylcobalamin", + "2-amino-5-cyanopyrrolo[2,3-d]pyrimidin-4-one", + "BMP and activin membrane-bound inhibitor homolog", + "heptan-2-one", + "canthaxanthin", + "N-acetyl-alpha-D-galactosaminyl-polypeptide EA2", + "(2R)-2-[(R)-[[(2R)-2-amino-2-phenylacetyl]amino](carboxy)methyl]-5 methyl-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid", + "O-ureido-D-serine", + "(9Z,11E,13S)-13-hydroperoxy-9,11-octadecadienoic acid", + "(S)-lactaldehyde", + "O-benzoylecgonine", + "peptidyl-allysyl-peptide", + "Tyr-Gly-Gly-Phe-L-methionine", + "gasdermin D", + "1,2-diacyl-sn-glycero-3-phosphatide", + "L-menthol", + "dTDP-3-dimethylamino-3,6-dideoxy-alpha-D-galactopyranose", + "N6-(4-hydroxy-3-methyl-2-(E)-butyl)adenosine 5'-phosphate", + "(2S,3S)-3-methylphenylalanine", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-tryptophyl-[protein]", + "(ADP-D-ribosyl)-Rab5 protein", + "fragments of amyloid precursor protein", + "alpha-L-fucosyl-(1,2)-D-galactosyl-R", + "lignocellulose", + "acceptor beta-glucuronoside", + "[SoxY protein]-L-cysteine", + "6-O-alpha-D-Glucopyranosyl-D-fructofuranose", + "3-chloro-5-methylcatechol", + "S-((R)-lactoyl)glutathione", + "4 ferrocytochrome c", + "Arg-Pro-Pro-Gly-Phe-Ser-Pro", + "beta-conglycinin storage protein", + "3-methyl-1-oxo-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,5-dihydrobenzo[4 5]imidazo[1,2-a]pyridine-4-carbonitrile", + "11-cis-retinal", + "phosphorylated G protein-coupled receptor", + "growth hormone releasing hormone-(1-29) fragment", + "pyocyanin", + "bilirubin O-glucuronide", + "glutarate", + "cypemycin(1-18)-L-Cys-L-Leu-L-Val-L-Cys", + "protein L-lysine", + "RCH2NH2", + "C-terminal [mycofactocin precursor peptide]-glycyl-L-valyl-4-[2-aminoethenyl]phenol", + "16 H+", + "etoposide glucuronide", + "gibberellin 53", + "2-[(L-alanin-3-ylcarbamoyl)methyl]-3-(2-aminoethylcarbamoyl)-2 hydroxypropanoate", + "mannan-binding lectin-A-5-hydroxy-L-lysine", + "betulinate", + "phosphorylated FoxO1a", + "an N-terminal N-acetyl-L-alanyl-[S5 protein of 30S ribosome]", + "MAP2", + "4-deoxy-L-erythro-5-hexoseulose", + "D-glycero-D-manno-heptose 1,7-bisphosphate", + "D-myo-inositol 1,3,4,5-tetrakisphosphate", + "human angiotensin I", + "soluble interleukin-6 receptor", + "tetracosanoyl-CoA", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-phenylalany-[protein]", + "3-sulfopropionaldehyde", + "nicked circular DNA", + "Catechol", + "5alpha-androstanedione", + "cochalic acid", + "viomycin", + "2-acyl-1-glycerophosphoserine", + "alpha-ketopantoate", + "alpha-D-galactose 1-phosphate", + "1-palmitoyl-2-arachidonoylphosphatidylcholine", + "5-carboxyluracil", + "mitotic centromere-associated kinesin", + "aggrecan fragments", + "(2S)-4-acetamido-2-aminobutanoate", + "L-Asp/in", + "annexin 4", + "allophanate", + "beta-actin L-histidine73", + "15-oxoprostaglandin F1alpha", + "cadherin", + "mannosyl-alpha-(1,3)-[xylosyl-beta-(1,2)]-mannosyl-alpha-(1 4)-galactosyl-beta-(1,6)-mannosyl-alpha-(1,2)-inositol phosphorylceramide", + "kendrin", + "3,7-diketo-5beta-cholanoic acid", + "abscisate", + "5alpha-androstan-3beta,17beta-diol", + "alpha-keto acid", + "L-alanyl-L-glutamate", + "DraR N-phospho-L-histidine", + "5-guanidino-3-methyl-2-oxopentanoate", + "dinoflagellate luciferin", + "4-methylnitrosamino-1-(3-pyridyl)-1-butanol", + "a polyprenyl diphosphate", + "fibroblast growth factor receptor-1", + "4-hydroxyphenyllactate", + "beta-Ala", + "(3beta,24R)-ergost-7-en-3-ol", + "D-xylitol-5-phosphate", + "loganin", + "[peptide chain release factor 2]-L-glutamine", + "[D-allose-binding protein][side 1]", + "lactococcin G/in", + "an N-terminal-L-methionyl-L-leucyl-[protein]", + "ent-isokaurene-2beta,3beta-diol", + "diisopropyl phosphate", + "1alpha-hydroxytestosterone", + "8-demethyl-8-(2-O-methyl-alpha-L-rhamnosyl)-tetracenomycin C", + "[alpha-tubulin]-L-lysine40", + "L-acylcarnitine", + "7alpha,12alpha-dihydroxycholest-4-en-3-one", + "acetylcholine", + "beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminylglycopeptide", + "pustulan", + "1,2-dioleoyl-phosphatidylglycerol", + "Testosterone acetate", + "Lys-Arg", + "glutamate-1-semialdehyde", + "deoxyhemerythrin", + "m-aminobenzoic acid", + "O-D-mannosylprotein Ggp1/Gas1", + "(-)-trans-acenaphthene-1,2-diol", + "p-ctRNAHis", + "glucosylsphingosine", + "ferredoxin", + "JNK1", + "cystatin C", + "(9R,10E,12Z,15Z)-9-hydroxy-10,12,15-octadecatrienoic acid", + "prekallikrein", + "7-beta-D-glucosyl-cis-zeatin", + "7-O-beta-D-glucosyl-3',4',5,7-tetrahydroxyflavone", + "2-dehydro-3-deoxy-D-xylonate", + "pyridine 3-carboxylic acid", + "5'-dAMP", + "phosphorylase-limit dextrin", + "ginsenoside Rd", + "2-hydroxy-AMP", + "3,7,12-triketo-5beta-cholanoyl taurine", + "5'-triphospho-mRNA", + "epiplakin glutamine", + "pyruvic aldehyde", + "cerebrosterol", + "[(1->4)-beta-D-glucosyl]n", + "hyodeoxycholic acid", + "syn-copalyl diphosphate", + "glucuronylgalactosyl glycosides", + "precursor of flagellin", + "procaspase-7", + "(8Z,11Z,14Z,17Z)-eicosa-8,11,14,17-tetraenoyl-[glycerolipid]", + "P1-5'-O-adenosine-P3-5'-O-adenosine triphosphate", + "3,5,5-trimethylcyclohex-2-en-1-one", + "D-Alanine", + "N-acetyl-D-histidine", + "5-phospho-alpha-D-ribosyl-1-diphosphate", + "immunoglobulin A", + "3 [oxidized NADPH-hemoprotein reductase]", + "thiamine diphosphate-[thiamine-binding protein ThiB][side 1]", + "guar gum", + "luteolin triglucuronide", + "cholecalciferol", + "1-O-(indol-3-yl)acetyl-beta-D-glucose", + "trans-2-enoyl-[acyl-carrier protein]", + "dTDP-beta-L-vancosamine", + "all-trans retinal", + "[Notch 2 protein with EGF-like domain]-3-O-(beta-D-xylosyl)-L-serine", + "phytosulfokine-alpha tyrosine", + "1-phosphatidyl-1D-myo-inositol", + "N-acetyl-S-[(2E,6E)-farnesyl]-L-cysteine", + "arabinose", + "cyclin-dependent kinase", + "(-)-alpha-copaene", + "D-mannose 6-phosphate[side 2]", + "2-dehydro-3,6-dideoxy-6-sulfo-D-gluconate", + "keratin-L-arginine", + "2,7,4'-trihydroxyisoflavanone", + "aclacinomycin S", + "cytidine4 in tRNAGly(GCC)", + "licodione", + "alpha-aryl-alpha-methylmalonate", + "ColE2-Im2 protein complex", + "sulfamethoxazole", + "protein S-4-oxo-4-(3-pyridyl)butyl-L-cysteine", + "N-(7-[(2-sulfoethyl)dithio]heptanoyl)-3-O-phospho-L-threonine", + "adenosine-5'-phosphosulfate", + "L-4-aspartyl phosphate", + "complement component C4b", + "cytarabine 5'-phosphate", + "oxalurate", + "1-acyl-2-[(S)-12-hydroxyoleoyl]-sn-glycero-3-phosphocholine", + "protein proteolytically cleaved into peptide fragments", + "xanthotoxin", + "HC-Pro", + "alpha1,3-fucosyl-alpha2,3-sialyl-N-acetyllactosaminyl-R", + "coenzyme F420-0", + "Reactive Blue 5", + "5-methylcytosine48 in tRNAAspGTC", + "microsomal polypeptides", + "keto-phenylpyruvate", + "(E)-2-methylgeranyl diphosphate", + "phosphorylated Net", + "1,2,3-triacylglycerol", + "a [protein]-L-tyrosine", + "fragments of interleukin 8", + "1-palmitoyl-2-acyl-sn-glycero-3-phosphocholine", + "1,6-anhydro-MurNAc-L-Ala-gamma-D-Glu-m-DAP", + "7-ethyl-10-hydroxycamptothecin 10-O-beta-D-glucuronoside", + "[(1->4)-alpha-D-galacturonide]n", + "(3S,5S)-carbapenam-3-carboxylate", + "N-oleoylethanolamide", + "9alpha-hydroxy-1,4-androstadiene-3,17-dione", + "[PGC-1alpha]-L-lysine", + "2 H2", + "pyridoxal 5'phosphate", + "ataxin-3 protein", + "beta-carboxy-cis-cis-muconate", + "6,7-[8]-dihydrobiopterin", + "Ca2+[side 2]", + "phosphorylated apical membrane antigen 1", + "15-oxoprostaglandin E2", + "sclareol", + "5'-O-phosphonoadenylyl-(3'->5')-adenosine", + "holo-[aryl-carrier protein]", + "[O-GlcNAc transferase]", + "18-hydroxygeranylgeraniol", + "[tau protein]-serine/threonine phosphate", + "a 5-L-glutamyl amino acid", + "12-epi-fischerindole U", + "piceid", + "maltooligosaccharide", + "5-N-acetyl-8-O-acetyl-neuraminate", + "cimetidine S-oxide", + "N5-[(S)-citryl]-D-ornithine", + "D-glucosamine", + "octane", + "fluconazole/out", + "2-oxo-3-hydroxypropionic acid", + "iron(III)-N-(2,3-dihydroxybenzoyl)-L-serine complex", + "holo-[aryl-carrier protein EntB]", + "prostaglandin F2alpha", + "8-demethylnovobiocic acid", + "D-allose", + "heptanaldehyde", + "[beta-D-fructosyl-(2->1)-]n", + "locust bean gum", + "S-(methylthiomethyl)cysteine 4-oxide", + "N-terminal-Ala-Pro-Lys-[protein]", + "5-hydroxymethyl cytosine", + "phosphorylated Pprotein LN", + "dityrosine", + "(2S)-flavan-4-ol", + "(2R)-2,3-dihydroxy-3-methylbutanoate", + "[protein-GlnK]", + "phosphorylated Zap70", + "somatostatin", + "pro-prostasin", + "(S)-reticuline", + "N-acetyl-4-amino-3-methylbenzoic acid", + "UDP-N-acetyl-alpha-D-quinovosamine", + "tetradecanoate", + "3 AMP", + "D-galactose 1-phosphate", + "10-hydroxyoctadecanoic acid", + "wheat flour arabinoxylan", + "2-isopropylmaleate", + "(3S,6E)-nerolidol", + "N1-methylguanine9 in tRNAGlyCCC", + "2 sucrose", + "capsidiol", + "(2R)-2-[(R)-([(2Z)-2-(2-amino-1 3-thiazol-4-yl)-2-([(2-carboxypropan-2 yl)oxy]imino)acetyl]amino)(carboxy)methyl]-5-[(pyridin-1-ium-1 yl)methyl]-3,6-dihydro-2H-1,3-thiazine-4-carboxylate", + "2-Hydroxycyclohexan-1-one", + "MoOS(OH)Dtpp-mP", + "deoxyribonolactone", + "peptide p561", + "5,6,7,8-tetrahydrosarcinapterin", + "benzydamine N-oxide", + "Met-enkephalin", + "glycoursodeoxycholic acid", + "protein S100A10 N5-pentylglutamine", + "S-sulfanyl-MOC3 protein", + "glutaryl-CoA", + "beta-D-glucuronosyl (S)-naproxen", + "Avicel PH 101", + "sisomicin", + "arabinotriose", + "histone H2B", + "N1-methyladenine9 in tRNAAsp", + "[p27]-N6-acetyl-L-lysine", + "6,7-dimethyl-8-(1-D-ribityl)lumazine", + "acarviosine-glucose", + "2-dehydro-3-deoxy-D-arabino-heptonate 7-phosphate", + "benzoic acid amide", + "H+[side 1]", + "Secretin", + "GDP-4-dehydro-3,6-dideoxy-alpha-D-mannose", + "gliadin glutamine", + "pea glutathione reductase", + "nebramycin 5'", + "1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine N-oxide", + "L-djenkolate", + "CovR N-phospho-L-histidine", + "(4E,6E)-2-methyl-3-oxoocta-4,6-dienoyl-S-ACP", + "N-acetyl-lysine-histone H1", + "R-S-S-R", + "fumonisin B1", + "3beta-hydroxy-5alpha-pregnane-20-one", + "heparan sulfate alpha-D-glucosaminide", + "4-hydroxy-2-oxoheptanedioate", + "(20R,22R)-20,22-dihydroxy-cholesterol", + "eicosanoic acid", + "N-terminal L-leucyl-L-arginyl-[protein]", + "podophyllotoxin", + "L-Asp-L-Tyr-L-Met-Gly-L-Trp-L-Met", + "phosphorylated c-Jun N-terminal kinase 3", + "1,4-dihydroxynonane", + "2-chloro-1,4-benzoquinone", + "[SAMP2]-Gly-Gly-AMP", + "marinoloyl C-CoA", + "3-(3,4-dihydroxypyridin-1-yl)-L-alanine", + "ICAM-1", + "PAR-1 receptor", + "N6-(2-aminobenzoyl)-L-Lys", + "L-threonyl-tRNA1Thr", + "mycoredoxin-1", + "apoA-I propeptide", + "geranylhydroquinone", + "manoyl oxide", + "7-chloro-L-tryptophan", + "Nomega-phospho-L-arginine", + "pro-collagen type I", + "base2", + "glucosyl-limonin", + "(-)-matairesinol", + "2-trans-decenoyl-CoA", + "formyl-methionyl-leucine-phenylalanine/in", + "UDP-N-acetyl-alpha-D-mannosaminuronate", + "methionyl peptide", + "alpha-aminoadipic acid", + "thioredoxin z disulfide", + "histidine/out", + "Val-Val-Arg", + "phosphorylated cyclin-associated cyclin-dependent kinase", + "12alpha-hydroxy-3-oxo-5-beta-cholan-24-oic acid", + "spent grain", + "4-hydroxy-3-methoxybenzyl alcohol", + "cell wall of Rhizoctania solani", + "[histone H3]-N6,N6,N6-trimethyl-L-lysine36", + "tabersonine", + "2,3-dihydroxy-2,3-dihydro-p-cumate", + "N-acetylindoxyl", + "(E,E)-piperoyl-CoA", + "7,8-dihydromethanopterin", + "hemopressin", + "trans-4,5-dihydroxycyclohexa-2-enecarbonyl-CoA", + "gibberellin A4", + "1,2-didehydropiperidine-2-carboxylate", + "collagens", + "?", + "n CMP", + "4a-hydroxy-(6R)-L-erythro-5,6,7,8-tetrahydrobiopterin", + "S-succinyldihydrolipoamide", + "2,4,6/3,5-pentahydroxycyclohexanone", + "benzyl viologen", + "negatively supercoiled DNA", + "stathmin 1", + "Nalpha,Nalpha-dimethyl-L-histidine", + "3'-end 3'-dAMP-labeled tetrahydrofuran-T duplex", + "ferrocytochrome b1", + "vanillylamine", + "tRNA uridine38-40", + "2-phospho-4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol", + "hypoxanthine in double-stranded RNA", + "5-methylthio-D-ribose", + "D-lactic acid", + "DELTA7-sterol", + "3,3',5'-triiodo-L-thyronine", + "(ADP-D-ribosyl)n-tyrosine kinase Lyn", + "[(R)-3-hydroxyacyl]n", + "8-hydroxykaempferol", + "2-octaprenyl-6-methoxy-1,4-benzoquinone", + "all-trans-retinyl palmitate-[cellular retinol-binding protein]", + "ethionamide S-oxide", + "N-acetyl-LL-2,6-diaminoheptanedioate", + "pentacarboxylate porphyrinogen III", + "Vicilin", + "pituitary adenylate cyclase-activating polypeptide-(1-27)", + "beta-D-glucopyranose 1-phosphate", + "2,3-epoxy-2,3-dihydro-2-methyl-3-phytyl-1,4-naphthoquinone", + "adenomatous polyposis coli protein", + "2 linolenic acid", + "phaseic acid", + "bovine brain gangliosides", + "meso-2,3-butanediol", + "carboxyphosphonoenolpyruvate", + "N-decanoyl -L-homoserine lactone", + "re-lipopolysaccharide", + "histone H3-L-arginine", + "ClpA unfoldase", + "3-oxo-palmitoyl-[acyl-carrier protein]", + "xanthosine 5'-diphosphate", + "human serotonin transporter", + "1-phosphatidyl-1D-myo-inositol 3,5-bisphosphate", + "[(1->2)-beta-D-glucosyl]n", + "cis-1,2-dihydronaphthalene-1,2-diol", + "N-acetyl-4-aminobenzoic acid", + "heme[side 1]", + "1-acyl-lysophosphatidylinositol", + "(-)-bornane-2,5-dione", + "ethyl 2-ethylacetoacetate", + "p38 MAP kinase", + "spermidine-[spermidine-binding protein][side 1]", + "omega-(methylthio)-(E)-pentanaldehyde oxime", + "HrpK/out", + "(S)-3-amino-2-methylpropanoate", + "a [DsrC protein]-disulfide", + "(S)-2-methylbutanoyl-[2-methylbutanoate polyketide synthase]", + "3,4,5-trimethoxybenzoic acid", + "ferrocyanide", + "glyceraldehyde-3-phosphate", + "oxidized cytochrome b", + "Slr", + "Ca2+/calmodulin-dependent protein kinase IV", + "2,2,2-trifluoro-1-phenylethan-1-ol", + "guanine26 in tRNALeuCAA", + "polar amino acid/out", + "5-enolpyruvoyl-6-hydroxy-2-succinylcyclohex-3-ene-1-carboxylate", + "2'-O-methylcytidine2498 in 23S rRNA", + "basigin", + "[ATM]-L-lysine", + "pro-Der p 3", + "Sty1", + "protein N6-(dihydrolipoyl)lysine", + "Ni2+/in", + "cyclin B", + "Ac-EPNA", + "4,5-dihydroxy-2,3-pentanedione", + "5-hydroxypyrrole-2-carboxylate", + "beta-sitosterol", + "cellular protein[side 1]", + "glucaric acid", + "5-hydroxyuracil-mismatched double-stranded DNA", + "3-bromocyclohexa-1,5-diene-1-carbonyl-CoA", + "phosphorylated cAMP-responsive element binding protein", + "C-terminal fragment C99 of amyloid precursor protein", + "phosphorylated myristoylated alanine-rich C kinase substrate", + "alpha-D-galactosyl-(1,3)-[alpha-L-fucosyl-(1,2)]-D-galactosyl-R", + "[P-110]-L-tyrosine", + "nuclei", + "2 arachidonic acid", + "ataxin-7", + "a malonyl-[acyl-carrier protein]", + "fragments of poly(sialic) acid or oligo(sialic) acids", + "4-Guanidinobutyrate", + "(S)-2-aceto-2-hydroxybutyrate", + "D-kynurenine", + "iron-sirohydrochlorin", + "sinapaldehyde", + "phosphorylated calcium-independent phospholipase A2", + "lipopolysaccharide/in", + "(8E,10R,12Z,15Z)-10-hydroperoxyoctadeca-8,12,15-trienoate", + "N-acetyl-D-mannosamine", + "succinamic acid", + "cis-2-methylaconitate", + "protein phospho-L-histidine", + "N-palmitoyl-D-glucosylsphingosine", + "N7-methylguanosine 5'-phosphate", + "N-hexadecanoyl-sphingenine", + "deoxynucleoside diphosphate", + "caspase-2", + "methylsulfinylalkyl glucosinolate S-oxide", + "withanolide A", + "GDP-6-deoxy-L-galactose", + "(S)-4-hydroxy-2-oxopentanoate", + "mesaconyl-CoA", + "[L-histidine-binding protein][side 1]", + "amyloid precursor protein N-terminal fragments", + "cytidine32/guanosine34 in tRNA", + "cytosine72 in tRNACys", + "adhesin PFF0800c", + "valosin", + "2-hydroxymuconic semialdehyde", + "cytidine diphosphate choline", + "(1,4-alpha-D-glucosyl)n+1", + "torvoside A", + "CDC25A", + "carboxylic acid diol", + "2',3,4,4',6'-pentahydroxychalcone", + "phenylenolpyruvate", + "EB1c", + "(-)-yatein", + "S-ubiquitinyl-[HECT-type E3 ubiquitin transferase]-L-cysteine", + "4 H+", + "phosphorylated corticotropin-releasing factor receptor type 1", + "vinculin", + "novobiocin", + "guanine46 in tRNA", + "Syntaxin", + "iron aerobactin/in", + "tetraprenyl-alpha-curcumene", + "(glucosyl)xyloglucan", + "epimedin A", + "3-(2 4-bis[N-acetyl-beta-D-glucosaminyl]-alpha-D-mannosyl)-beta-D-mannosyl-R", + "phosphorylated p38", + "adenine in RNA", + "SvpA", + "IQLN-Dnp", + "cyanin", + "L1 cell-adhesion molecule", + "D-erythro-C24:1-ceramide", + "1,2-dioleoyl-sn-glycero-3-phosphocholine", + "isopropanol", + "PBP3 protein", + "[Vac8]-S-palmitoyl-L-cysteine", + "L-cysteinyl-tRNACys", + "psilocybin", + "3-epi-1alpha,25-dihydroxy-24-oxo-vitamin D3", + "1'-oxo-2'-hydroxypropyl-tetrahydropterin", + "protein N6-(lipoyl)lysine", + "O-phospho-tau-protein", + "12-hydroxylauric acid", + "dimethylamine", + "norepinephrine", + "2-O-(alpha-D-glucopyranosyl)glycerol", + "8 NADPH", + "5-deoxy-5-methylthio-alpha-D-ribose 1-phosphate", + "[4,5-dihydroxy-9,10-dioxo-3-(3-oxobutanoyl)-9 10-dihydroanthracen-2-yl]acetate", + "3-chloropropionate", + "succinoglycan/out", + "3-oxopalmitoyl-CoA", + "1-methylcyclohexene", + "D-glucose/out", + "nicotinamide ribonucleotide", + "IkappaBalpha", + "L-2-aminoadipate 6-semialdehyde", + "light chain of kininogen", + "cyanidin", + "refolded RNase", + "5'-phospho-(ribonucleotide)-[DNA]", + "GalNAc-alpha-(1-3)-Gal", + "Bacillus subtilis aprE leader-lacZ mRNA", + "D-galactosyl-1,4-D-galactosyl-1,4-D-glucosylceramide", + "(ADP-D-ribosyl)n-rab4", + "DL-norleucine", + "p-tyrosine", + "dynorphin A1-8", + "[D-xylose/L-arabinose-binding protein Saci_2122][side 1]", + "alpha-pinene", + "sgRNAn", + "inosine 5'-triphosphate", + "RNA polymerase II C-terminal domain", + "2-methyl-17beta-estradiol 3-sulfate", + "cobalt-precorrin-7", + "[pyruvate phosphate dikinase] phosphate", + "pro-caspase-6", + "5-chloro-L-tryptophan", + "chemotaxis receptors McpS L-glutamate methyl ester", + "cis-3,4-leucopelargonidin", + "dihydrobiopterin", + "3-phosphonopyruvate", + "phosphorylated BRCA2", + "25S pre-rRNA", + "[pyruvate, phosphate dikinase] phosphate", + "IGFBP-rP1", + "Man7GlcNAc2-[carboxypeptidase Y-transmembrane-Leu2]", + "isolychnose", + "N-methylanthranilate", + "(2S)-2-hydroxy-5-oxopentanoate", + "complement component C3bi", + "Tie2", + "a medium-chain acyl-CoA", + "3 CoA", + "N1-aminopropylagmatine", + "cis-sabinene hydrate", + "cystatin D", + "alpha7 nicotinic acetylcholine receptor", + "osteopontin", + "5-methyl-5,6,7,8-tetrahydrosarcinapterin", + "hydroxymethylglutaryl-CoA", + "coenzyme A", + "guanine37 in tRNAPro(UGG)", + "(1R,2S)-cis-cyclohexa-3,5-diene-1,2-diol", + "L-delta-alpha-aminoadipyl-L-cysteinyl-D-valine", + "UDP-alpha-D-glucose", + "H+/out", + "MAP kinase", + "8-oxo-7,8-dihydroguanine:Cyt oligodeoxynucleotide", + "AKAP450", + "(S)-(2,4-dichlorophenoxy)propanoate", + "allysyl-collagen", + "2 oxidized ferredoxin", + "N-terminal-Nalpha-acetyl-L-seryl1-[histone H2A]", + "4-guanidinobutyraldehyde", + "glycochenodeoxycholate 3-sulfate", + "1-dodecanol", + "7-hydroxy-methotrexate", + "a beta-lactam", + "20 amino acid peptide", + "18-hydroxyoleic acid", + "gamma-linolenoyl-[glycerolipid]", + "(R)-lactoyl-CoA", + "(1R)-menthol", + "9S-RNA", + "D4-GDI(Rho-GDI 2)", + "4 oxidized [2Fe-2S] ferredoxin", + "3-aminopropanesulfonate", + "Msmeg1712/out", + "cADPribose", + "aflatoxin B1", + "beta-D-Gal-beta-(1->3)-alpha-D-GlcNAc-diphospho-ditrans octacis-undecaprenol", + "(R)-2-methylimino-1-phenylpropan-1-ol", + "[beta-GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-6-N-(beta-D-Asp)-L-Lys D-Ala-D-Ala)]n", + "K Ras-cysteine", + "probenecid/in", + "n-caprinaldehyde", + "complement component C4a", + "BRCA2", + "complement component C2", + "5beta-pregnane-17alpha,20beta,21-triol-3,11-dione", + "S-(15-deoxy-DELTA12,14-prostaglandin J2)glutathione[side 1]", + "acetoin", + "2 Cl-", + "menaquinone-4", + "CGSHL", + "(-)-lariciresinol", + "cytosine48 in tRNAGly precursor", + "gp120 oligosaccharides", + "3,5-dihydroxybiphenyl", + "5-aminoimidazole-4-(N-succinylcarboxamide) ribonucleotide", + "diacylphosphatidylethanolamine", + "Escherichia coli O2 antigen bound to undecaprenyl diphosphate", + "poly(3-hydroxybutyrate)", + "a [lipoyl-carrier protein]-N6-(lipoyl)lysine", + "alk-2-enal", + "3-oxobutanoyl-[acyl-carrier protein]", + "sugar beat pulp", + "trans,octacis-decaprenyl phosphate", + "a glucosyloxyanthraquinone", + "uridine32 in tRNA", + "Arabidopsis thaliana RAB-ATa protein", + "mitogen-activated protein kinase kinase-3", + "stearoyl-sn-glycerol 3-phosphate", + "N-acetyl-7-O-acetylneuraminate", + "myrcene", + "3'-C-ethynyluridine", + "Rho-activated kinase", + "galectin-9", + "1,4-alpha-D-glucooligosaccharide", + "tert-butyl hydroperoxide", + "RgpA-HagA polyprotein", + "D-mannitol 1-phosphate", + "[histone H3]-N6,N6-dimethyl-L-lysine79", + "Rac GTPase-cysteine", + "N-(5'-Phospho-D-ribosylformimino)-5-amino-1-(5''-phospho-D-ribosyl)-4 imidazolecarboxamide", + "3-nitro-L-tyrosine", + "propan-2-amine", + "labda-8(17),13(16),14-triene", + "2-amino-3-oxo-4-phosphohydroxybutyrate", + "ginsenoside Rg1", + "carboxypeptidase Y", + "tauroursodeoxycholic acid", + "[Golgi-specific brefeldin A resistance factor 1]", + "N6-methyladenine in RNA", + "1-(3-C-ethynyl-beta-D-ribopentofuranosyl)cytosine 5'-phosphate", + "dienelactone", + "OPN-R", + "2-ethyl-2-hydroxy-3-oxopentanoate", + "tobramycin", + "(S)-1-phenyl-1,2-ethanediol", + "G-CSF receptor", + "soluble intercellular cell adhesion molecule 1", + "N-acetyl-beta-D-galactosaminides", + "phosphorylated Ca2+/calmodulin-dependent protein kinase IV", + "2,4-xylenol", + "oxidzed adrenodoxin", + "[SRC-3]-L-arginine", + "chitosan", + "UDP-2,4-diacetamido-2,4,6-trideoxy-beta-L-altropyranose", + "D-galacturonic acid", + "gamma-fluoro-ATP", + "fatty acid binding protein 5", + "MEP50 phosphoprotein", + "dimethyl-parathion", + "6 alpha-D-mannopyranose", + "Rim 15 protein", + "a [protein]-S-sulfanyl-L-cysteine", + "(ADP-D-ribosyl)-RNA polymerase", + "2''-nucleotidylgentamicin", + "phospholipase Cbeta3", + "3-oxostearoyl-[acyl-carrier protein]", + "2-oxoisobutanoate", + "L-psicose", + "L-glutamyl-tRNAAsp", + "D-tagatose 6-phosphate", + "glycol chitin", + "a long-chain alkane", + "(2R)-2-[(R)-[[(2Z)-2-(2-amino-1 3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino](carboxy)methyl]-5-[(1 methylpyrrolidin-1-ium-1-yl)methyl]-3,6-dihydro-2H-1 3-thiazine-4-carboxylate", + "bilirubin/cytoplasm", + "(8Z,11Z,14Z)-5,6-epoxyeicosatrienoic acid", + "phosphorylated hormone-sensitive lipase", + "protein-L-methionine (R)-sulfoxide", + "toxoflavin", + "proform matriptase", + "N3-methylpseudouridine1915 in 23S rRNA", + "2-methyl-AMP", + "allopurinol/out", + "D-Met", + "[endothelial nitic oxide synthase]", + "RNA-DNA duplex", + "pro-caspase-7", + "4-methyldibenzothiophene-5,5-dioxide", + "D-fucose", + "(Z)-3-methylbutanaloxime", + "(S)-2-hydroxyglutarate", + "mitochondrial matrix protein", + "7-ethyl-10-hydroxy-camptothecin", + "oxidized catecholamine", + "4 acceptor", + "17beta-estradiol 17-(beta-D-glucuronide)/out", + "5,10-methylene tetrahydrofolate", + "2,5-diamino-6-hydroxy-4-(5-phosphoribosylamino)pyrimidine", + "tRNATyr precursor", + "protease-activated receptor-4", + "CDYL1", + "a 1-lyso-phosphoglycerolipid", + "triacetate lactone", + "D-erythro-dihydroneopterin triphosphate", + "(2S,3S)-butane-2,3-diol", + "UDP-N-acetyl-D-glucosamine", + "S-(hercyn-2-yl)-L-cysteine S-oxide", + "prosolanapyrone III", + "D-cystine", + "phosphorylated CD3 epsilon", + "fragments of Ras-GTPase activating protein SH3 domain-binding protein 1", + "[Ras2p]-L-cysteine", + "protoporphyrinogen", + "alpha-2,8-linked polysialic acid", + "O-phosphohydroxy-L-lysine", + "propanoyl phosphate", + "D-maltose", + "3,4,5-trihydroxy-L-phenylalanine", + "guanosine 5'-diphosphate,3'-diphosphate", + "deoxynucleoside 3'-phosphate", + "(6R)-L-erythro-tetrahydrobiopterin", + "pre-LHCP protein", + "O-Carbamoyl-L-serine", + "2-(alpha-D-mannosyl)-3-phosphoglycerate", + "9beta-pimara-7,15-diene", + "2-phenylmalonate", + "gastrin", + "1,2-diacyl-lysophosphatidylglycerol", + "phosphatidylinositol-4,5-bisphosphate", + "[p110 catalytic subunit of PI 3-kinase]-L-tyrosine", + "D-galactosyl-1 3-beta-N-acetyl-D-galactosaminyl-(N-acetylneuraminyl)-D-galactosyl-D glucosyl-N-acylsphingosine", + "corticosterol", + "hydroxylamine", + "2 L-methionine", + "D-Glucose 6-phosphate", + "[L-glutamine-binding protein][side 1]", + "DNA containing 7-hydro-8-oxoguanine", + "a diacylglycerol", + "4-methyl-5-nitrocatechol", + "poly(glucose galactosamine phosphate)/in", + "taurodeoxycholate", + "protease-activated receptor", + "pregnenolone", + "UDP-N-acetyl-beta-L-fucosamine", + "a ribonucleoside 5'-triphosphate", + "benzylglucosinolate", + "retinoblastoma protein Rb", + "2,3-dihydrodipicolinate", + "phosphorylated maize eukaryotic translation initiation factor 5A", + "pelargonidin 3-O-(6-O-malonyl)-beta-D-glucoside", + "pre-23S rRNA", + "1-(6-hydroxypyrid-3-yl)-4-(methylamino)-butan-1-one", + "[nitrate-binding protein][side 1]", + "8-hydroxypurine", + "[(2->1)-beta-D-fructosyl]n+1", + "ERK1/2", + "marinolic acid C", + "N-formylanthranilic acid", + "D-2-aminohexano-6-lactam", + "3-hydroxybenzaldehyde", + "2-phosphonoacetaldehyde", + "2'-O-methyladenosine4 in tRNAHis", + "[Fas-activated serine/threonine phosphoprotein]", + "a dipeptide[side 2]", + "sulfogalactoglycerolipid", + "myosin heavy chain kinase phosphate", + "(S)-2-methylpyrrolidine", + "5-methylcytosine50 in tRNALeuCAA", + "a 5'-end triphospho-adenylyl-adenylyl-cytidyl-adenosine in mRNA", + "n-butyronitrile", + "Nedd4-2", + "[heat shock protein 10]-N6-acetyl-L-lysine56", + "O-Acetyl-L-serine", + "c-di-GMP", + "(3S,5S)-dihydroclavaminate", + "ghrelin", + "(24R)-24-methylcycloart-25-en-3beta-ol", + "[p53]-N6-methyl-L-lysine382", + "alpha-N-acetylneuraminyl-2,8-alpha-N-acetylneuraminyl-2 3-beta-D-galactosyl-1,4-beta-D-glucosylceramide", + "2,3-dioxo-5-methylthio-1-phosphopentane", + "cellulose", + "p70S6K phosphate", + "di-D-fructofuranose 1,2':2,3' dianhydride", + "hyaluronan", + "dioxolane guanosine", + "synaptobrevin-2", + "N-([4-[([[(11S,11aS)-11-hydroxy-7,8-dimethoxy-5-oxo-2,3,11 11a-tetrahydro-1H-pyrrolo[2,1-c][1 4]benzodiazepin-10(5H)-yl]carbonyl]oxy)methyl]phenoxy]carbonyl)-L glutamic acid", + "N(pN)n", + "alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1) ceramide", + "myosin light chain phosphate", + "2 cytochrome cGJ", + "3-oxododecanoic acid", + "Pyrococcus abyssi tRNATyr(GUA) uridine35", + "indole-3-acetic acid", + "3-dehydro-D-sphinganine", + "methotrexate/in", + "L-norisoleucyl-tRNALeu", + "chloroplast-protein[side 2]", + "(2Z,4E)-3-chloro-2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid", + "4-carboxymethylene-3-chlorobut-2-en-4-olide", + "4-hydroxy-3-methoxyphenyl-beta-hydroxypropionyl-CoA", + "2-deoxy-L-scyllo-inosose", + "4a-hydroxytetrahydrobiopterin", + "snake venom toxin", + "[Ras]-L-cysteine", + "pro-colipase", + "phosphatidyl-myo-inositol", + "chito-oligomeric-monomeric mixture", + "pantotheine 4'-phosphate", + "dentin sialophosphoprotein", + "oligomers of alpha 2,8-linked polysialic acid", + "5beta-cholestan-3-one", + "tsukubadiene", + "[histone H4]-N6-acetyl-L-lysine16", + "Malonyl-CoA", + "menadione-glutathione[side 2]", + "[PknJ]-serine/threonine", + "N-stearoyldihydrosphingosine", + "digitoxigenin", + "(-)-2-chloropropionic acid", + "involucrin glutamine", + "3-acetoacetyl-CoA", + "selenium", + "[histone H4]-L-lysine16", + "2 L-glutamate", + "tetracenomycin B2", + "2 NADH", + "Mca-KKPTP", + "PLN", + "2,4-dichlorophenol", + "2-hydroxychromene-2-carboxylic acid", + "tRNAn+1", + "charoninsulfate", + "UDP-MurNAc-L-Ala-L-Glu", + "pantoyl lactone", + "[sulfonate-binding protein][side 1]", + "bovine kappa-casein", + "N4-[N-acetyl-beta-D-glucosaminyl-(1,2)-alpha-D-mannosyl-(1 3)-[N-acetyl-beta-D-glucosaminyl-(1,2)-alpha-D-mannosyl-(1 6)]-[beta-D-xylosyl-(1,2)]-beta-D-mannosyl-(1 4)-N-acetyl-beta-D-glucosaminyl-(1 4)-N-acetyl-beta-D-glucosaminyl]asparagine", + "trans-4-hydroxycyclohexanecarboxylate", + "alpha-D-galactosyl-(1,4)-beta-D-galactosyl-(1,4)-D-glucosylceramide", + "Collagen IV", + "Escherichia coli O16 antigen bound to undecaprenyl diphosphate", + "benzylalcohol", + "factor IX proenzyme", + "ferrocytochrmoe b5", + "N6-L-threonylcarbamoyladenine37 in tRNA", + "antimonite/in", + "quinolinate", + "monobromoacetate", + "N-methylphenylethanolamine", + "bromoxynil", + "2-O-(alpha-D-glucopyranosyl)-3-phospho-D-glycerate", + "DNA", + "2-(glutathione-S-yl)-hydroquinone", + "2-naphthylmethanol", + "10 kDa fragment of (pro)renin receptor", + "pantetheine", + "L-tryptophan", + "phosphorylated AP1", + "7,8-dihydroxanthopterin", + "Klotho", + "5,6,7,8-tetrahydromethanopterin", + "glucan", + "GlcA-beta-(1->2)-D-Man-alpha-(1->3)-D-Glc-beta-(1->4)-D-Glc-alpha-1 diphosphopolyisoprenol", + "(R)-pantolactone", + "2-D-hydroxyisoleucine", + "enhanced green fluorescent protein-T2", + "[tRNAIle2]-2-agmatinylcytidine34", + "pyridoxal", + "demethylsulochrin", + "icosanoyl-[(phenol)carboxyphthiodiolenone synthase]", + "beta-D-galactosyl-(1-4)-D-glucosylceramide", + "propofol", + "3 CO2", + "cAMP-response element binding protein", + "5-bromo-thymidine", + "[alkanesulfonate-binding protein][side 1]", + "(2S)-5,4'-dihydroxy-7-methoxyflavanone", + "(+)-car-3-ene", + "2-bromobenzoyl-CoA", + "5-hydroxycyclohex-1-enecarbonyl-CoA", + "5'-phosphoribosyl-5-formamido-4-imidazole-4-carboxamide", + "caspase-2L", + "prostaglandin E2/in", + "N1-methyluanine748 in 23S rRNA", + "histamine", + "phosphatidylinositol (3,4,5)-trisphosphate", + "isovaleryl-CoA", + "[E2 ubiquitin-conjugating enzyme cullin-1]-L-cysteine", + "alpha-L-rhamnoside", + "reduced electron-transferring-flavoprotein", + "(S)-scoulerine", + "rhodamine 123/out", + "dihydroorotate", + "Hydrogenobyrinate", + "1,1'-dihydroxyneurosporene", + "collagen propeptide", + "[histone H3]-N6,N6,N6-trimethyl-L-lysine 4", + "3alpha,7alpha,12alpha-trihydroxy-5beta-cholanoyl-CoA", + "alpha1 beta-adrenergic receptor", + "(15Z)-12-oxophyto-10,15-dienoate", + "orosomucoid", + "transforming growth factor-beta", + "acetyl-CoA carboxylase", + "phytoene", + "[acyl-carrier protein AcpM]", + "phosphorylated abnormal spindle pole protein", + "filamin A", + "O-phospho-L-threonine", + "myo-inositol-1,2,3,4,6-pentakisphosphate", + "11-dehydrocorticosterone", + "(S)-6-hydroxynicotine", + "p-nitrophenyl alpha-D-galactopyranoside", + "hydroxyacetone phosphate", + "[glucose/galactose-binding protein MglB][side 1]", + "Disrupted in renal carcinoma 2", + "cytosine49 in tRNAGly precursor", + "2alpha,17alpha-diethynyl-A-nor-5alpha-androstane-2beta,17beta-diol dipropionate", + "tropine", + "ribonuclease 2-D-mannose", + "MAP2K", + "hypoxia inducible factor trans-4-hydroxy-L-proline", + "L-dihydroorotate", + "(R)-4'-phospho-N-pantothenoylcysteine", + "2,4,6-trichlorophenol", + "proform prostasin", + "collagen N5-alkylglutamine", + "peptide/out", + "propeptide of collagen III", + "cyanidin 3-O-(6-O-caffeoyl)-beta-D-glucoside", + "cyclo[(->6)-alpha-D-Glc-(1->3)-alpha-D-Glc-(1->6)-alpha-D-Glc-(->3) alpha-D-Glc-(1->)]", + "N6-(D-psicosyl)-L-lysine", + "4-nitrocatechol", + "bovine submaxillary gland mucin", + "reduced peroxiredoxin", + "lysozyme disulfide", + "Ras-CVLL", + "fragments of cohesin", + "demethylmenaquinol", + "SpoIIQ", + "4-chlorocyclohexan-1-one", + "reptin", + "propane-1,3-diol", + "low-molecular weight kininogen", + "caveolin-1", + "3-deoxy-alpha-D-manno-oct-2-ulopyranosyl-(2->8)-3-deoxy-alpha-D-manno oct-2-ulopyranosyl-(2->4)-3-deoxy-alpha-D-manno-oct-2-ulopyranosyl-(2 >6)-2-deoxy-2-[[(3R)-3-hydroxytetradecanoyl]amino]-3-O-[(3R)-3 hydroxytetradecanoyl]-4-O-phosphono-beta-D-glucopyranosyl-(1->6)-2 deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[[(3R)-3 hydroxytetradecanoyl]amino]-1-O-phosphono-alpha-D-glucopyranose", + "nuclear factor-kappaB essential modulator", + "2D-2,3,5/4,6-pentahydroxycyclohexanone", + "Manbeta(1-4)Man", + "[histone H3]-N6,N6,N6-trimethyl-L-lysine27", + "tauro-alpha-muricholic acid", + "2-ethyl-N-hydroxypyridine-4-carbothioamide", + "relaxin fragments", + "N-3-oxooctanoyl-L-homoserine-1,4-lactone", + "vasoconstrictive factor endothelin 1", + "11-hydroxy-12,13-epoxy-9-octadecenoic acid", + "N-acetyl-O-acetylneuraminate", + "5'-deoxy-5'-adenosyl-cobyrinic acid ac-diamide", + "[C-phycocyanin alpha-subunit]-Cys84-phycocyanobilin", + "modified E-cadherin", + "cefotaxime/out", + "SspA zymogen", + "histone H3 L-lysine9", + "3-oxochol-4-en-24-oyl-CoA", + "prostaglandin F2alpha/out", + "phosphorylated SCR-1", + "L-O-phosphoserine", + "(2R,4S)-2-((R)-carboxy[2-carboxy(phenyl)acetamido]methyl)-5 5-dimethyl-1,3-thiazolidine-4-carboxylic acid", + "3'-phosphotyrosyl-linked topoisomerase I-DNA complex", + "(S)-(+)-citramalyl-CoA", + "propeptide of stromelysin", + "alpha-fodrin", + "(4S)-5-oxo-L-leucine", + "ent-(13E)-8alpha-hydroxylabd-13-en-15-yl diphosphate", + "1,2-di-(cis-9-octadecenoyl)-sn-glycerol", + "gemfibrozil", + "1-(2-bromophenyl)ethanol", + "mitochondrial carrier protein", + "2-(3-methylthio)propylmalate", + "5-androstenedione", + "5'-S-methyl-5'-thioadenosine", + "4-O-[1-D-ribitylphospho-(2R)-1-glycerophospho]-N-acetyl-beta-D mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl-diphospho-ditrans octacis-undecaprenol", + "UDP-N-acetyl-2-deoxy-2-amino-alpha-D-galactopyranose", + "16 NADP+", + "ferricytochrome cL", + "phospho-casein", + "phosphorylated insulin receptor kinase substrate 1", + "dTDP-4-dehydro-beta-L-rhamnose", + "2'-O-methylcytidine56 in tRNA", + "N-acetyltryptamine", + "4-O-beta-D-glucopyranosyl-D-glucose", + "phospho-L-tyrosinyl-epidermal growth factor receptor", + "TNF receptor 1a", + "beta-pinacene", + "C3b", + "cCF10 protein", + "cytosine32 in tRNASer", + "4-desmethyllanosterol", + "methanetelluronate", + "DNA (without O6-[4-oxo-4-(3-pyridyl)butyl]guanine)", + "big endothelin-1", + "beta-ureido acid", + "cyanidin-3-O-beta-D-glucoside", + "N-terminal L-alanine-[cypemycin]", + "UDP-2-N,3-O-bis[(3R)-3-hydroxytetradecanoyl]-alpha-D-glucosamine", + "thymidylyl-(3'-5')-thymidylate (in DNA)", + "arrestin", + "UDP-2,3-diacetamido-2,3-dideoxy-alpha-D-mannuronate", + "DL-lactate", + "deiminated filaggrin", + "DNA-guanine", + "wogonoside", + "glyoxylate thiohemiacetals", + "DSSARIRR", + "4-methylphenol", + "3 neokestose", + "N-terminal fragment of 20 amino acids of pro-deltaK protein", + "2,3-dihydroxy-2,3-dihydrobenzoate", + "peptidyl-4-carboxyglutamate", + "N6-alkylaminopurine", + "5beta-pregnan-3,20-dione", + "ganglioside GA1", + "NO3-/out", + "a [protein]-Nomega-phospho-L-arginine", + "xanthine", + "2 L-dopa", + "S-lactoylglutathionylspermidine", + "5-methylcytosine49 in tRNAAspGTC", + "Salmonella typhimurium LT2 antigen bound to undecaprenyl diphosphate", + "erythrodiol", + "a bacteriochlorophyllide e", + "blood group antigen H", + "phosphoribosyladenosine 5'-phosphate", + "UDP-N-acetyl-alpha-D-glucosamine 3'-phosphate", + "UDP-Glc", + "ferrocytochrome", + "MARCKS protein", + "benzoylformate", + "activated PAR-1", + "uridine 5'-N-alkylphosphoramidate", + "bradykinin", + "12alpha-hydroxy-3-oxocholate-4,6-dienoate", + "1D-4-O-methyl-myo-inositol", + "beta-D-mannosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl alpha-D-glucosaminyl-diphosphodolichol", + "6-hydroxycyclohexa-1-ene-1-carbonyl-CoA", + "3-devinyl-3-(1-hydroxyethyl)chlorophyllide a", + "(2S)-2-isopropyl-3-oxosuccinate", + "10beta-cadin-4-en-10-ol", + "PIKE-A", + "2-amino-7,8-dihydro-4-hydroxy-6-(diphosphooxymethyl)pteridine", + "chondroitin 4-sulfate", + "alpha-D-mannosidosis fibroblasts", + "(RS)-coclaurine", + "lysine", + "N-acetyl-D-norleucine", + "demeclocycline", + "tyrosine hydroxylase", + "ACP", + "thioredoxin 1 disulfide", + "cytosine arabinoside", + "[N Ras]-L-cysteine", + "Bcl-2", + "10-N-(n-octylamino)-2-(trifluoromethyl) phenothiazine", + "trimethylamine N-oxide", + "1-(1-alkenyl)-sn-glycero-3-phosphocholine", + "beta-D-glucosyl-1,4-N-acetyl-D-glucosaminyldiphosphoundecaprenol", + "High mobility group box 1 protein", + "4-methylthioheptanaldoxime", + "2,3-bis((3R)-3-hydroxymyristoyl)-beta-D-glucosaminyl 1-phosphate", + "p-hydroxyphenylpyruvate", + "myristoyl-CoA", + "Met-amino acid", + "D-idarate", + "cyclin L2", + "4-O-(beta-L-arabinofuranosyl-(1->2)-beta-L-arabinofuranosyl-(1->2)-beta L-arabinofuranosyl)-(2S,4S)-4-hydroxyproline", + "(5Z,8Z,11Z,14Z,17Z)-eicosapentaenoate", + "(5S,6S)-6-amino-5-hydroxycyclohexane-1,3-diene-1-carboxyate", + "phosphorylated DNA-recombinase RecA", + "veratryl aldehyde", + "2-hydroxy-3-oxosuccinate", + "isatin", + "L-aspartate semialdehyde", + "(2E)-2-(2-methylprop-2-en-1-ylidene)-4-oxopentanedioic acid", + "3-hydroxymyristoyl lipid A", + "pro-brain-derived neurotrophic factor", + "trans-cinnamoyl-CoA", + "[histone H4]-N6-acetyl-L-lysine12", + "Bi3+[side 2]", + "apolipoprotein E", + "guanosine 5'-triphosphate,3'-diphosphate", + "[YezB]-serine/threonine", + "1-deoxy-D-xylulose", + "D-glucose", + "P1,P4-bis(5'-adenosyl) tetraphosphate", + "beta-thujene", + "Val-Asp-Val-Ala-Asp", + "ectoine", + "Heparosan-N-sulfate D-glucuronate", + "3,4-dihydroxybenzoyl-[aryl-carrier protein]", + "a thioglucoside", + "lipopolysaccharide[side 1]", + "L-mandelate", + "phosphoylated RNA polymerase II C-terminal repeat domain", + "GDP-D-mannose", + "ferulic acid", + "3-vinyl bacteriochlorophyllide d", + "3alpha-hydroxy-7-keto-5beta-cholanoyl taurine", + "di-trans,poly-cis-octaprenyl diphosphate", + "C3 protein of complement system", + "amantadine", + "myo-inositol 1-phosphate", + "salicin", + "N-terminal propeptide", + "(R)-mevalonate 5-diphosphate", + "menadione-glutathione[side 1]", + "(1S,2S,4R)-limonene-1,2-diol", + "L-glutamate", + "(5Z,11Z,14Z)-icosa-5,11,14-trienoyl-CoA", + "cefixime", + "1-thiomethyl-D-xylulose 5-phosphate", + "4-nitroanilide", + "(+)-pinoresinol", + "integrin alphaVbeta3", + "transcription factor AP-2alpha", + "(5R)-5-[(1S 2R)-1-carboxy-2-hydroxypropyl]-3-(sulfanyl)-4,5-dihydro-1H-pyrrole-2-carboxylic acid", + "phosphorylated CDK9", + "IgA", + "[(1,3)-beta-D-glucosyl]n+1", + "4-methylthiononanaldoxime", + "gluten peptide", + "2,3-pyridinedicarboxylic acid", + "5-amino-6-ribosylamino-2,4(1H,3H)-pyrimidinedione 5'-phosphate", + "L-methionine S-oxide", + "kaempferol 3,7-bissulfate", + "4-hydroxyphenylglyoxylate", + "endothelin", + "L-Ser", + "cis-5-chloro-2-methyldienelactone", + "procarboxypeptidase Y", + "proangiotensin", + "chitosan oligomers", + "5-methylcytosine48 in tRNAThr(AGU)", + "tissue necrosis factor", + "mannosyl rhamnose", + "glucose", + "alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man (1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha D-Man-(1->6)]-alpha-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc-N Asn-[protein]", + "4-carboxy-2-hydroxypenta-2,4-dienoate", + "benzamidoxime", + "S-(methylsulfanyl)glutathione", + "1,N6-ethenoadenine", + "apo allophycocyanin alpha-subunit", + "proproteinase A", + "(ferrocytochrome c)-subunit", + "PQRKVRMA", + "phosphorylated beta-tubulin", + "N-octanoyl-L-homoserine-1,4-lactone", + "2-mercaptoethanol", + "(+)-alpha-santalene", + "acetylthiocholine", + "2-methyl-4-amino-5-hydroxymethylpyrimidine diphosphate", + "[myosin light-chain] phosphate", + "enhanced green fluorescent protein-T1", + "taxifolin", + "tariquidar [side 1]", + "2 L-leucyl-tRNALeu", + "tylactone", + "aldonic acid-terminated malto-oligosaccharides", + "tRNA TpsiC", + "phospho-light-harvesting complex II", + "phosphorylated Xrs2 protein", + "cyanoalanine", + "phosphorylated HSL protein", + "phosphorylated CEP83", + "pro-apoA-I", + "(R)-3-((R)-3-hydroxybutanoloxy)butanoate", + "beta-(1->6)-D-galactobiose", + "N6-(DELTA2-isopentenyl)adenosine", + "acyl-carrier protein", + "nucleolin", + "insulin-like growth factor binding-related protein-1", + "12 reduced ferredoxin", + "collagen II", + "5,6-dimethylbenzimidazole", + "argininosuccinate", + "4beta-hydroxycholesterol", + "IRAG", + "lignin", + "a (2E)-alk-2-enoyl-CoA", + "versiconol", + "dhurrin", + "deoxylimonate", + "7Me-GpppA-2'OMe-C5", + "luteolin 7-O-glucuronide", + "5-phospho-L-arabinate", + "haloxyfop-P", + "N-Acyl-D-glucosamine", + "2-methylcitrate", + "2-hydroxy-3-oxoadipate", + "phosphorylated PBIP1", + "Usp 45", + "D-glucurono-3,6-lactone", + "phosphorylated 3F3/2 kinase", + "glutathione-4-oxonon-2-enal", + "cholesteryl 3-sulfate", + "M-cadherin", + "cis-(homo)3aconitate", + "[NFkappaB subunit p56]", + "Cdc14", + "a 3'-half-tRNA molecule with a 5'-OH end", + "Latia luciferin", + "Der p 6", + "chenodeoxycholoyl-CoA", + "[(2R)-2,3-dihydro-1H-pyrrol-2-yl]acetic acid", + "dTDP-beta-L-noviose", + "lentinic acid", + "DELTANp63", + "DNA-4-methylcytosine", + "cobyrinate", + "2,5-dihydroxypyridine", + "2-hydroxy-5-carboxymethylmuconate semialdehyde", + "trichlorophenol", + "pro-matrix metalloproteinase-13", + "casein glutamine", + "[Ga protein]-S-palmitoyl-L-cysteine", + "protein Cubitus interruptus", + "ascorbate[side 1]", + "N-acetylmuramate 6-phosphate", + "(5S,6S,7E,9E,11Z,14Z)-5,6-epoxyicosa-7,9,11,14-tetraenoate", + "a carboxylate", + "cannabigerolate", + "monosialylgalactosylgloboside", + "3-deoxy-D-glycero-D-galacto-nononate 9-phosphate", + "human semaphorin 3F", + "queuine", + "[polar amino acid-binding protein][side 1]", + "2-methyl-1,3-benzothiazol-6-yl sulfate", + "[epidermal growth factor receptor 2]-tyrosine", + "phosphatidylserine", + "oxomalonate", + "2-octadecanoylglycerol", + "isopenicillin N", + "heparosan N-sulfate L-iduronate", + "4.55 rRNA precursor", + "1-benzothiophene-5-yl sulfate", + "methylmalonate-semialdehyde", + "hamamelose 2'-phosphate", + "Cab1R protein precursor", + "thiamine triphosphate", + "a sterol 3-beta-D-glucoside", + "N-(7-mercaptoheptanoyl)threonine 3-O-phosphate", + "dihydrofolate", + "phosphorylated Sec2p protein", + "CEP80", + "reduced coenzyme Q10", + "beta-alanopine", + "propeptide of BMP4", + "phosphorylated acetyl-CoA carboxylase", + "3'-sticky-ended double-strand DNA", + "(+)-bornane-2,5-dione", + "3alpha,7beta-dihydroxy-5beta-cholanoyl glycine", + "[amyloid precursor protein]", + "(R)-2,3-dihydroxy-3-methylbutanoate", + "phosphorylated progesterone receptor", + "single stranged DNA", + "Zap70", + "XDP", + "L-ectoine", + "D-fuculose", + "L-cystine-[cystine-binding protein TcyA](side 1)", + "phospho-tyrosinyl gelsolin", + "3-iodo-L-tyrosine", + "protein-L-methionine", + "beta-D-galactosyl-(1->4)-[alpha-L-fucosyl-(1->3)]-N-acetyl-beta-D glucosaminyl-R", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-histidyl-[protein]", + "5'-dIMP", + "GpppA-Cn", + "[K Ras]-L-cysteine", + "(ADP-D-ribosyl)n-RalA", + "reduced 3-acetylpyridine-adenine dinucleotide", + "mas-related G-protein-coupled receptor C11", + "Spo0A N-phospho-L-histidine", + "7beta-hydroxycholesterol", + "4,4-dimethylcholesta-8,14,24-trienol", + "1-octadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycerol", + "cis-3-phenylcyclohexa-3,5-diene-1,2-diol", + "1-cyclohexenylcarbonyl-CoA", + "kappa-neocarraoctaose", + "4-methylsulfanyl-2-oxobutanoate", + "purine ribonucleoside", + "5-iodo-uridine", + "GspG prepseudopilin", + "furfural", + "2 H+[side 2]", + "1-(beta-D-ribofuranosyl)nicotinamide", + "VTIAQGGVLPNIQAV", + "RNA 3'-terminal-phosphate", + "DNA containing an adenine:8-oxoguanine mismatch", + "alpha-aceto-alpha-hydroxybutyrate", + "Pyrococcus abyssi tRNATyr(GUA) pseudouridine35", + "uridine 5'-triphosphate", + "an N,N,N-trimethylornithine lipid", + "6-geranylgeranyl-2-methylbenzene-1,4-diol", + "H2O", + "n-decanol", + "CheB", + "(5alpha)-androstane-3,17-dione", + "1-(2-naphthalenylmethyl)-naphthalene", + "m7G(5')pppRm-RNA", + "ergosterol", + "a [DsbB protein] with reduced L-cysteine residues", + "phosphorylated Smad3", + "poly(3-hydroxyoctanoate-co-3-hydroxyhexanoate)", + "(R)-pantoate", + "5-oxoprolyl-Abeta3-40/42", + "2-lysophosphatidylcholine", + "4-hydroxy-2-methyl-3-oxo-4-farnesyl-3,4-dihydroquinoline-1-oxide", + "3 meso-2,3-diaminosuccinate", + "2 adenosylcob(III)alamin", + "Tyr-Ser-Pro-Nfs1", + "glutaconyl-CoA", + "Canavanine-containing proteins", + "a [protein] with reduced L-cysteine residues", + "ubiquinol-10", + "2-hydroxyoctadecatrienoic acid", + "2-O-(6-O-palmitoyl-alpha-D-mannosyl)-6-O-alpha-D-mannosyl-1 phosphatidyl-1D-myo-inositol", + "Leu-Tyr", + "N3-methyluracil2843 in 25S rRNA", + "alpha-L-Fuc-(1-6)-D-Gal", + "2-O-(alpha-D-glucopyranosyl)-D-glycerate", + "NADPH oxidase 5", + "(R)-mevalonate 5-phosphate", + "3,8-dideoxy-8-oxo-alpha-D-manno-octulosonate", + "Rom2", + "trimethylaminobutyraldehyde", + "phosphorylated Pda1p subunit", + "3-hydroxyflavone", + "pro-collagen type III", + "vesicle associated membrane protein 2", + "piccoloNuA4 peptide", + "cis-(1R,2S)-epoxypropylphosphonic acid", + "Man8GlcNAc2", + "[protein]-N5-alkyl-L-glutamine", + "13-OH-chlorophyllide a", + "phospho-p53", + "quaternary amine[side 2]", + "2-carboxybenzylpyruvic acid", + "Lys-Pro", + "alpha-1,3-glucan", + "(3Z)-4-(2-carboxyphenyl)-2-oxobut-3-enoate", + "interleukin-1 receptor II", + "coumaroyl-CoA", + "1,2-dipalmitoyl-sn-glycero-3-phosphocholine", + "L-myo-inositol 1-phosphate", + "2-dehydro-3-deoxy-D-pentonate", + "reduced ferrdoxin", + "arachidonoate", + "omega-hydroxymenaquinone-4", + "aklavinone", + "L-1-pyrroline-4-hydroxy-2-carboxylate", + "4-chloro-2-methylphenol", + "D-xylose-[xylose-binding protein][side 1]", + "organo-tin compounds", + "guanosine 3',5'-bis(diphosphate)", + "L-seryl-[L-seryl-carrier protein]", + "3-carboxy-cis,cis-muconic acid", + "[neurotensin receptor]", + "type I procollagen", + "single-chain urokinase-type plasminogen activator", + "6-(propan-2-ylamino)-1,3,5-triazine-2,4-diol", + "camelliol C", + "imidazole-4-acetate", + "Cys", + "platelet-activating factor", + "matrix metalloproteinase-3", + "phosphatidyl-N,N-dimethylethanolamine", + "2-hydroxyethiin", + "septin 5", + "histone H4 D-aspartate", + "protein PLN", + "inositol 1,3-bisphosphate", + "8 isopentenyl diphosphate", + "procollagenase", + "16-epivellosimine", + "coenzyme F430", + "1,2-dihydroxyhexane-3,4-dione", + "O,O-diethyl fluorophosphate", + "(deoxyribonucleotide)n+m", + "1,6-anhydro-MurNAc", + "[dermatan]-4-O-sulfo-N-acetylgalactosamine", + "3-O-cellobiosyl-D-glucose", + "6 phosphate", + "aristolochic acid", + "UDPrhamnose", + "BiP/GRP78 protein", + "FVNQHL", + "NFAT2 protein", + "1,5-anhydro-4-deoxy-D-glycero-hex-3-en-2-ulose", + "perforin", + "L-arginyl-[BiP/GRP78 protein]", + "1,2-dioleoylglycerol", + "D-galactofuranosyl-(1->5)-beta-D-galactofuranosyl-(1->6)-beta-D galactofuranose", + "(4Z,8Z)-4,8-dimethyl-12-oxotrideca-4,8-dienal", + "4-hydroxyproline-Argonaute 2", + "sn-1-stearoyl-2-arachidonoyl-glycerol", + "2-naphthol", + "5'-phosphoguanylyl(3'->5')guanosine", + "polyvinyl alcohol", + "Ntau-methyl-L-histidine", + "Man8GlcNAc2-[protein] (isomer 8A1,2,3B1,3)", + "bilirubin IXbeta", + "L-arginyl-[ERF-VII peptide]", + "acceptor-phospho-NAc-muramoyl-pentapeptide", + "irofulven", + "1-carboxybiuret", + "L-ascorbate 6-phosphate[side 2]", + "MHC class II-associated invariant chain Ii", + "cholesta-5,22-dien-3beta-ol", + "low-density lipoprotein receptor-related protein 11", + "UDP-N-acetyl-alpha-D-muramoyl-L-alanyl-D-glutamate", + "ethiofencarb", + "methylcobalamin", + "S-nitrosoglutathione", + "chondroitin sulfate oligosaccharide", + "phosphorylated Vav", + "3 tert-butanol", + "3-methyl-2-buten-1-al", + "a [DsbB protein] carrying a disulfide bond", + "propionaldehyde", + "reduced NADPH-hemoprotein reductase]", + "1D-chiro-inositol", + "(+)-alpha-barbatene", + "[RCR-type E3 ubiquitin transferase]-L-cysteine", + "pro-B-type natriuretic peptide", + "S-(hydroxymethyl)glutathione", + "dTDP-beta-D-fuco-(1->4)-furanose", + "prenyl diphosphate", + "holo-[L-alanyl-carrier protein]", + "phosphonoacetaldehyde", + "N-acetyl-Asp", + "dihydrocoumarin", + "5 sulfur", + "6-hydroxy-L-nicotine", + "glutamate/out", + "(3,5-dihydroxyphenyl)acetyl-CoA", + "6 ferricytochrome b5", + "phosphorhodopsin 1", + "13-dihydrocarminomycin", + "1-phosphatidyl-1D-myo-inositol-4,5-bisphosphate", + "(1,3-beta-D-glucosyl)n-1", + "c-Jun N-terminal kinase", + "5',5'-diadenosine tetraphosphate", + "phosphorylated serotonin N-acetyltransferase", + "pro-nuclear factor-kappa B", + "3-ethylmalate", + "4-fluorobenzonitrile", + "lacto-N-fucopentaose I", + "D-xylose-[xylose-binding protein XylF][side 1]", + "8 H+", + "GpppA-2'OMe-Cn", + "10'-apo-beta-carotene-3,10'-diol", + "myosin phosphatase", + "[E2 ubiquitin-conjugating enzyme UbcH7]-L-cysteine", + "(2R)-5-[(acetyloxy)methyl]-2-[(R)-carboxy[2-(thiophen-2 yl)acetamido]methyl]-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid", + "[DsbE protein] with reduced L-cysteine residues", + "O9a antigenic polysaccharide", + "Factor X", + "(9R,10E,12Z)-9-hydroperoxy-10,12-octadecadienoic acid", + "pinitol", + "18-carbamoyl-3,5,7,9,11,13,15,17-octaoxooctadecanoyl-[OxyC acyl-carrier protein]", + "gamma-linolenate", + "cytosine38 in tRNAGly(GCC)", + "a 1-stearidonoyl 2-acyl-sn-glycerol 3-phosphate", + "cellular prion protein", + "phosphorylated adenylate kinase 1", + "8 (S)-methylmalonyl-CoA", + "Hydroxy-L-Pro", + "2 [corrinoid adenosyltransferase]-cob(II)alamin", + "3-(Indol-3-yl)pyruvate", + "N-acetylglucosamine-(1-4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D Ala)-diphosphoundecaprenol", + "glycochenodeoxycholate", + "N4-[N-acetyl-beta-D-glucosaminyl-(1-2)-alpha-D-mannosyl-(1-3)-[N-acetyl beta-D-glucosaminyl-(1-2)-alpha-D-mannosyl-(1-6)]-beta-D-mannosyl-(1-4) N-acetyl-beta-D-glucosaminyl-(1-4)-N-acetyl-beta-D glucosaminyl]asparagine", + "Ca2+/trans", + "S-adenosyl-L-methionine", + "L-methionyl-tRNAfMet", + "L-DOPA", + "a 3-oxo acid", + "phosphorylated HER2 protein", + "selenocysteinyl-tRNASec", + "deacetylated platelet activating factor", + "3-hydroxypropanal", + "4-methyl-5-(2-hydroxyethyl)-thiazole", + "(2S)-2-acetolactate", + "2-[(3S)-3-amino-3-carboxypropyl]-L-histidine600-[translation elongation factor 2]", + "2,3-dihydroxybenzoate", + "chemerin", + "(-)-gamma-cadinene", + "(+)-cis-3,4-dihydrophenanthrene-3,4-diol", + "UDP-3-O-((3R)-3-hydroxymyristoyl)-alpha-D-glucosamine", + "(2R,3S)-2-methylmalyl-CoA", + "demethylluteothin", + "magnesium mesoporphyrin monomethyl ester", + "[Notch protein with EGF-like domain]-L-serine", + "5-methyuracil54 in tRNA", + "(S)-2-methylamino-1-phenylpropan-1-one", + "N-acetyl-neuraminate 9-phosphate", + "L-arginyl-[beta-actin]", + "L-rhamnulose 1-phosphate", + "(+,-)-5-[(tert-butylamino)-2'-hydroxypropoxy]-3 4-dihydro-1(2H)-naphthalenone", + "(Gly-Pro-Pro)10", + "lycopaoctaene", + "10-formyltetrahydrofolate", + "troponin I", + "eIF5A-Nepsilon-(4-amino-2-hydroxybutyl)lysine", + "cis-9,10-epoxystearic acid", + "phosphorylated CEP164", + "beta-amyloid protein", + "ephrin type-A receptor 4", + "D-gluconate", + "azole/out", + "(S)-ureidoglycolate", + "diphthamide-[translation elongation factor 2]", + "[histone H4]-N-phospho-L-histidine", + "NF-H", + "death-associated protein 5", + "dialkyl ketone", + "globotriose", + "PA3347", + "plasminogen activator inhibitor 2 glutamine", + "N-acetyl-3-aminopropanal", + "H2o", + "phosphorylated casein kinase 1delta", + "CXCL-12", + "phosphorylated nucleoside-diphosphate kinase", + "SP-CMP", + "pro-form influenza hemagglutinin H1", + "divinylprotochlorophyllide", + "L-type Ca2+ channel", + "11 NADPH", + "5-aza-2'-deoxyuridine", + "N-acetyl-alpha-D-glucosaminyl-diphosphodolichol", + "3-dehydro-L-gulonate", + "1-(5-phospho-D-ribosyl)-ATP", + "phosphatidylglycerophosphate", + "(S)-acetohydroxybutyrate", + "2-hydroxypalmitate", + "properdin", + "[histone H3]-N6-acetyl-L-lysine23", + "coagulation factor XIII", + "allysyl-collagen III", + "5-diphospho-1D-myo-inositol pentakisphosphate", + "N-acetyl-beta-D-glucosaminyl-R group", + "2,2,2-trifluoroacetophenone", + "alpha-1,5-L-arabinan", + "Manalpha(1-3)[Man(1-6)]ManbetaGlcNAc-betaGlcNAc", + "DsrC protein", + "vascular cell adhesion molecule 1", + "(n-1) diphosphate", + "9S,13R-12-oxo-phytodienoic acid", + "GSH-conjugated 4-hydroxy-2-nonenal/out", + "guanine966 in 30S rRNA", + "a (4E,8E)-sphinga-4,8-dienine ceramide", + "neopikromycin", + "11-cis-retinoll-[cellular-retinol-binding-protein]", + "4 reduced ferredoxin", + "3,4-dichloropropionanilide", + "3-dehydro-L-erythronate", + "(+/-)-N,N-dimethylpavine", + "beta-D-fructose 6-phosphate", + "mesoheme", + "3,8-divinyl bacteriochlorophyllide a", + "tetrachloroethene", + "5-amino-2,5-dioxopentanoic acid", + "3-mercaptopropanoate", + "poly((R)-3-hydroxybutyrate)", + "4-hydroxy-estrone", + "selenide", + "L-arabinoxylan", + "O(2)", + "dabsyl-L-methionine (S)-sulfoxide", + "isochorismate", + "(S)-3-hydroxy-3-methyl-5-hydroxyvaleric acid", + "an L-arginyl-L-amino acid", + "3-vinyl bacteriochlorophyllide c", + "cob(I)inamide", + "N-hydroxy-L-aspartate", + "(isoquinolin-5-yloxy)acetic acid", + "ss RNA", + "Galbeta(1-3)Galbeta(1-4)Xyl-1-O-Ser", + "demethyllactenocin", + "valienol", + "dibutyrin", + "[MYPT1 phosphoprotein]", + "11-cis-retinol-[cellular retinol-binding protein]", + "[myosin heavy-chain]", + "O-alpha-D-galactosyl-(1->3)-1D-myo-inositol", + "3alpha-hydroxy-7-oxo-5beta-cholan-24-oic acid", + "L-rhamnonate", + "2-octaprenyl-1,4-naphthoquinone", + "D-Pro", + "G(5')ppp-mRNA", + "2-ethyldibenzothiophene-5,5-dioxide", + "(6R)-L-erythro-5,6,7,8-tetrahydrobiopterin", + "a 1-gamma-linolenoyl-2-acyl-[glycerolipid]", + "pre-elafin", + "(8E,10E,12Z)-octadeca-8,10,12-trienoyl-[glycerolipid]", + "neo-iota-carratetraose", + "N-methylhydantoin", + "(S)-2-haloacid", + "C37-phthioceranyl-[(hydroxy)phthioceranic acid synthase]", + "N-tetradecanoyl-glycyl-HIV1 Gag protein N-terminal peptide", + "ceramide", + "dihydropteridine", + "cholesta-5,7-dien-3beta-ol", + "alkyldihydroxyacetone phosphate", + "3-[fluoro(methyl)phosphoryl]oxy-2,2-dimethylbutane", + "DNA containing an adenine:7,8-dihydro-8-oxoguanine mispair", + "N-tetradecanoyl-L-homoserine lactone", + "[cullin 3]-N6-[NEDD8-protein]-yl-L-lysine", + "active C1s protease", + "21-phosphorifampicin", + "3-trans-enoyl-CoA", + "dimethyl disulfide", + "tubulin", + "benzothiophene-5,5-dioxide", + "(+)-(2S,3R,9R)-pristinol", + "a tetradecanoyl-[acyl-carrier protein]", + "dTDP-L-dihydrostreptose", + "a [acyl-carrier protein]", + "wheat gluten", + "5alpha-cholesta-7,24-dien-3beta-ol", + "coniferin", + "[Hippel-Lindau protein]-N6-monoubiquitinyl-L-lysine", + "[NFkappaB]-N6-acetyl-L-lysine", + "1,2-dideoxy-2-ethyl-6-O-phosphonohexo-3,4-diulose", + "L-tryptophan-[L-tryptophan-binding protein][side 1]", + "adipyl-6-aminopenicillanic acid", + "methyl-parathion", + "3,5-dihydroxy-4-(3-methylbutanoyl)phenyl beta-D-glucopyranoside", + "O-D-mannosylprotein Aga2", + "3D-3,5/4-trihydroxycyclohexa-1,2-dione", + "N-carbobenzoxy-L-glutaminylglycine", + "La/SS-B", + "cis-14,15-dihydroxyeicosatrienoic acid", + "(5Z,8Z,11Z,13E)-(15S)-15-hydroperoxyicosa-5,8,11,13-tetraenoate", + "IkappaBalpha-L-tyrosine phosphate", + "3-hydroxy-4-methylanthranilate", + "big endothelin-3", + "tamarixetin", + "polypeptide Muc1", + "hexanoyl-CoA", + "7-methyl-3-oxo-6-octenoyl-CoA", + "2-oxoglutaramate", + "(2R)-2-hydroxy-2-methylbutanedioate", + "decanal", + "succinyladenosine monophosphate", + "9-(5-phospho-beta-D-ribosyl)xanthine", + "2,4-dichloro-cis,cis-muconate", + "3-dimethylallyl-4-hydroxymandelate", + "[histone H3R8]-Nomega,Nomega'-dimethyl-L-arginine", + "mature snRNA", + "14beta-hydroxyonocera-8(26)-ene", + "decorin", + "peptidylamidoglycolate", + "(1R,4R,5S)-(-)-guaia-6,10(14)-diene", + "L-Ribulose 5-phosphate", + "UDP-3-O-(3-hydroxytetradecanoyl)-N-acetyl-alpha-D-glucosamine", + "myosin regulatory light chain", + "N-deacetylated beta-(1->6)-N-acetylglucosamine polymer", + "[eukaryotic translation elongation factor 2]", + "2-decanone", + "3-deoxy-D-manno-octulosonate 8-phosphate", + "UDP-2-acetamido-2,6-dideoxy-alpha-D-xylo-4-hexulose", + "zymosterone", + "hydrolyzed DNA", + "3-amino-2,3-dideoxy-scyllo-inosose", + "2,6-dichloroaniline", + "1-O-alpha-D-galactosyl-D-myo-inositol", + "5-methylcytosine48 in tRNALeu(AAG)", + "[protein]-L-tyrosine", + "mandelic acid", + "N-lignoceroyldihydrosphingosine", + "phenylpyruvate", + "an [amino group carrier protein]-C-terminal-N-(1,5-dicarboxypentan-1-yl)-L-glutamine", + "MHC class I polypeptide-related sequence A", + "trans,trans-diferulic acid", + "8 oxidized ferredoxin", + "3-deoxy-alpha-D-manno-octulopyranosonate", + "estrogen sulfate", + "phosphorylated retinoblastoma-related protein", + "(S)-4-hydroxypentane-2,3-dione 5-phosphate", + "[leucine-rich repeat kinase 2 protein]", + "3-indoleglycolaldehyde", + "glucagon-like peptide 2 (1-33)", + "interleukin-8", + "a 1,2-diacyl-3-O-(beta-D-galactopyranosyl)-sn-glycerol", + "5 neryl diphosphate", + "N-acetyl-alpha-D-muramate 1-phosphate", + "nogalonate", + "monophosphate", + "N-acetyl-6-hydroxytryptophan", + "neuroligin-1", + "[Wnt5]-L-serine", + "L-methionine", + "ribosomal protein S6", + "cholesterol", + "6-O-alpha-D-glucopyranosyl-D-glucose", + "estriol beta-D-glucuronoside", + "CMP-N-acylneuraminate", + "prostaglandin E2/out", + "D-sepiapterin", + "12alpha,13alpha-dihydroxyfumitremorgin C", + "2-devinyl-2-(1-hydroxyethyl)chlorophyllide a", + "phosphorylated BKCa channel ZERO", + "stathmin", + "beta-NAD+", + "GSK-3beta protein", + "[GraR]-serine/threonine phosphate", + "Nomega,Nomega'-dimethyl-L-arginine", + "DNA-PKcs", + "[p27]-L-lysine", + "phosphorylated Crem protein", + "ampicilin", + "Ser", + "3,3,3-trifluoro-2-hydroxy-2-methylpropanamide", + "[histone H4]-N6-acetyl-L-lysine", + "L-Ile", + "neamine", + "Man7GlcNAc2-[bovine ribonuclease B] (isomer 7A1,2,3B3)", + "amyloid beta-precursor protein", + "phosphorylated lamban", + "neopinone", + "2 catechol", + "14,15-dihydroxyeicosatrienoic acid", + "[estrogen receptor alpha]-L-tyrosine phosphate", + "(2S)-2-methylbutanoyl-CoA", + "COX IV precursor", + "prostamide F2alpha", + "acceptor protein", + "methyl jasmonate", + "3-dehydro-D-glucose 6-phosphate", + "glycosylated pilin", + "(R)-1-(5-(3-amino-4-hydroxy-3-methylbutyl)-1-methyl-1H-pyrrol-2-yl)-4 (p-tolyl)butan-1-one", + "NHE-1", + "gamma-actin", + "12-ethyl-8-propyl-3-vinylbacteriochlorophyllide c", + "4 monodehydroascorbate", + "L-2-hydroxyisocaproate", + "dTMP", + "[antifreeze glycoprotein]-(O-3-(alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-alpha-D GalNAc-(1->)))-L-threonine", + "geranyl-diphosphate", + "acidic amino acid/in", + "beta-apo-10'-carotenol", + "16alpha-hydroxy-ent-kaurane", + "1-alkenyl-2-linoleoyl-glycero-3-phosphorylcholine", + "leucopelargonidin", + "11-cis-retinyl palmitate-[cellular retinol-binding protein]", + "succinate", + "2-methyl-1,4-naphthoquinol", + "6,7-dihydroxy-4'-methoxyisoflavone", + "eugenyl beta-primeveroside", + "DrmSP8-36", + "O-alkylglycerone", + "[Yck2p]-L-cysteine", + "SufE", + "4-(2-carboxyphenyl)-4-oxobutanoyl-CoA", + "proform tissue growth factor 1beta", + "3-oxohexanoyl-[acyl-carrier protein]", + "(indole-3-yl)acetaldehyde", + "3-methyl-2-oxovalerate", + "2-methyl-17beta-estradiol", + "Acm acyl carrier protein", + "dihydrofluorouracil", + "N-dodecanoyl-L-homoserine lactone", + "[Klebsiella pneumoniae cytoplasmic fumarate reductase]-FMN-L-threonine", + "O-D-alanyl-poly(ribitol phosphate)", + "beta-D-galactosyl-1,3-(N-acetyl-D-glucosaminyl-1 6)-N-acetyl-D-galactosaminyl-R", + "3-methoxy-4-hydroxy-5-hexaprenylbenzoate", + "Succinyl-CoA", + "hesperitin", + "Orotidine 5'-phosphate", + "methyl indole-3-acetic acid", + "avitag-tagged maltose-binding protein", + "uracil747 in 23S rRNA", + "4-nitrophenyl-alpha-L-fucopyranoside", + "lactococcin/in", + "cytosine50 in tRNAPro(AGG)", + "2-octanol", + "a [methyl-Co(III) methylated-thiol-specific corrinoid protein]", + "1-methylnicotinate", + "BAD phosphoprotein", + "N-succinyl-L-citrulline", + "phosphorylated non-structural protein 2", + "CMP-3-deoxy-D-manno-octulosonate", + "11beta-hydroxyandrost-4-ene-3,17-dione", + "2-(4-methylaminophenyl)-1,3-benzothiazol-6-yl sulfate", + "D-alanyl-D-serine", + "isoelisabethatriene", + "tyrosine aminotransferase", + "2 tRNAPhe", + "4-aminohippuric acid/out", + "(2Z,4E)-4-amino-6-oxohepta-2,4-dienedioate", + "orexin B", + "pro-Mch2alpha", + "itopride", + "alpha-lysine", + "alpha-1,3-mutan", + "amygdalin", + "spinorphin", + "D-phenylalanine", + "phosphorylated penicillin-binding protein", + "[FYN kinase]-tyrosine", + "2-deoxy-2-fluoro-beta-D-ribofuranose", + "N-palmitoylethanolamide", + "acetylphosphate", + "G(5')pppAmACA-[mRNA]", + "polyamine[side 2]", + "N-terminal-L-seryl1-[histone H4]", + "(Z)-3-hexanal", + "DELTA1-pyrroline-2-carboxylate", + "4-hydroxyphenylacetonitrile", + "[G-protein alpha subunit Galphai]-L-cysteine", + "isoprene", + "(13E)-8alpha-hydroxylabd-13-en-15-yl diphosphate", + "Akt1", + "5'-dCMP", + "3-O-cellotriosyl-D-glucose", + "N-tetradecanoyl-glycyl-HIV1 Nef protein N-terminal peptide", + "nicotinate D-ribonucleotide", + "oxyhaemoglobin", + "DNA-1-hydroxyethyladenine", + "Notch epidermal growth factor-like sequence repeat-O-fucose", + "testosterone sulfate", + "HTP-1 protein", + "kaempferol 3-O-beta-D-glucoside", + "6-methoxymellein", + "phosphorylated TRF1", + "1-hydroxy-3,4-didehydro-1,2-dihydrorhodopin", + "[protein]-N6-[1,1-(5-adenosylyl-alpha-D-ribose-1 2-di-O-yl)ethyl]-L-lysine", + "preproendothelin-1", + "1-hexadecanethiol", + "5-exo-(1R)-hydroxycamphor", + "N-terminal-Pro-Pro-Lys-[protein]", + "3'-C-ethynylcytidine 5'-phosphate", + "5-carboxyamino-1-(5-phospho-D-ribosyl)imidazole", + "L-octanoylcarnitine", + "membrane-bound prostaglandin E2 synthase-2", + "phenylacetamide", + "9R,10S-cis-epoxy-13R-hydroxy-11E-octadecenoic acid", + "beta-D-glucuronosyl-(1-3)-N-acetyl-beta-D-glucosaminyl-(1-4)-beta-D glucuronosyl-(1-3)-[nascent hyaluronan]", + "precursor", + "eukaryotic translation initiation factor 4G", + "[bismuth-binding protein][side 1]", + "fragments of spore protein B", + "[AKT1 protein]-serine/threonine", + "(E)-5-(2-bromovinyl)-2'-deoxyuridine", + "N-methyl-2-oxoglutaramate", + "1,4-beta-galactan side chains in pectic rhamnogalacturonan I", + "oxylipin", + "(E)-3-(methoxycarbonyl)pent-2-enedioate", + "heteroduplex DNA", + "2-Phosphoglycolate", + "5'-UMP", + "4-oxalomesaconate", + "palmitoyl-[acyl-carrier protein AcpM]", + "L1-200 fragment", + "2,3-dihydro-16-hydroxytabersonine", + "OASIS protein", + "dimethyl sulfone", + "phosphorylated amyloid precursor protein", + "fragments of alpha-1,4-glucan", + "7-epi-ent-eudesmane-5,11-diol", + "Killer toxin precursors", + "beta-cyclodextrin", + "protein F1", + "glycerophospho-ethanolamine", + "Ac-IAVGRTLK-7-amido-4-methylcoumarin", + "S6K1", + "glycoprotein N-acetyl-D-galactosamine", + "2-deoxy-D-galactose", + "ribostamycin 2''-phosphate", + "4-amino-4-deoxy-alpha-L-arabinopyranosyl di-trans,poly-cis-undecaprenyl phosphate", + "4-hydroxy-trans-2-nonenal", + "fragments of small acid-soluble protein alpha", + "poriferasterol", + "toluene diamine", + "ureidoglycine", + "morphinone", + "ent-kaur-15-ene", + "procollagen I", + "supercoiled plasma DNA", + "1,2-dioleoyl-sn-glycerol-3 phosphate", + "psychosine sulfate", + "2-chlorocyclohexan-1-one", + "protein D-isoaspartate alpha-methyl ester", + "N-acetylphosphinothricin", + "[PknH]-serine/threonine phosphate", + "iridodial", + "alpha-neoendorphin", + "maltoheptaose", + "dGMP", + "adenosine 5'-phosphate", + "glycogenin-2", + "nidogen 1", + "detyrosinated alpha-tubulin", + "ubiquinol-1", + "DNA containing 6-O-methylguanine", + "D-malate", + "collagen N-propeptide", + "3-deoxy-D-arabino-heptulosonic acid 7-phosphate", + "Isopentenyl diphosphate", + "7beta-hydroxysteroid", + "poly(A) RNA", + "3-epi-1alpha,24,25-trihydroxyvitamin D3", + "tissue inhibitor of metalloprotease", + "4-carboxy-4-hydroxy-2-oxoadipate", + "[YegI kinase]-serine/threonine phosphate", + "(9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoate", + "reduced cytochrome b6", + "4-(phosphonooxy)threonine", + "trans-aconitate", + "3-hydroxy-beta-ionone", + "mycocyclosin", + "16 NADPH", + "alpha-iminosuccinate", + "alpha-D-fructofuranose-beta-D-fructofuranose-1,2':2,3'-dianhydride", + "4-O-(beta-D-galactopyranosyl)-D-glucono-1,5-lactone", + "3,5-dichlorocatechol", + "omega-hydroxyphylloquinone", + "(5-oxo-4,5-dihydrofuran-2-yl)acetic acid", + "[histone H3]-N6,N6,N6-trimethyl-L-lysine 27", + "[cullin 1]-N6-[NEDD8-protein]-yl-L-lysine", + "4-chloroaniline", + "beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc-N-Asn [Notch receptor]", + "reduced ferredoxin iron-sulfur cluster", + "sinapoyl-L-malate", + "angelicin", + "(1R,2R)-(-)-2-(N-dichloroacetyl)-amino-1-(4-aminophenyl)-1 3-propanediol", + "an N-terminal-L-methionyl-L-isoleucyl-[protein]", + "D-Gal-(1,3)-beta-GlcNAc-(1,3)-beta-D-Gal-(1,4)-D-Glc", + "potato amylopectin type III", + "11-cis-retinol-[cellular retinaldehyde binding protein]", + "1-myristoyl-sn-glycerol 3-phosphate", + "PAK1", + "myotrophin", + "C5 zymogen", + "apo-[propionyl CoA carboxylase]", + "zinc bacteriopheophorbide d", + "4-methoxybenzoic acid", + "D-methionine", + "GDP-4-acetamido-4,6-dideoxy-alpha-D-mannose", + "4 1-kestose", + "D-Ribulose 1,5-bisphosphate", + "[eIF5A]-deoxyhypusine", + "oxidized [4Fe-4S] cluster", + "L-methionyl-L-amino acid", + "17alpha-hydroxypregnenolone sulfate", + "4-methylumbelliferyl beta-D-cellobioside", + "(+)-carvone", + "interleukin-36gamma", + "pro-growth hormone-releasing hormone", + "N-(5-phospho-beta-D-ribosyl)anthranilate", + "nucleoside 5'-monophosphates", + "9alpha,11beta-prostaglandin F2alphabeta", + "glyoxylic acid", + "phospho-fludarabine", + "[protein-PII]", + "MEI-S332 protein", + "[chloroplastic fructose 1,6-bisphosphate aldolase isoform 2]-N6-methyl-L-lysine", + "2-oxo-3-hydroxybutyrate", + "cytochrome c oxidase subunit", + "1,2-dipalmitoyl-sn-glycerol", + "2 FMNH2", + "D-Galactarate", + "histone H2A ending on Val114", + "2,3-diketo-5-methylthiopentane 1-phosphate", + "o-succinylbenzoate", + "aromatic aldehydes", + "noncrystalline cellulose", + "[p53]-L-lysine382", + "N-nervonoyldihydrosphingosine", + "tetraacetylhistone H4", + "selenium-methyl-L-seleniummethionine", + "2 1D-myo-inositol 1,3,4,5,6-pentakisphosphate", + "2-(glutathion-S-yl)-propan-1-ol", + "Notch protein", + "phospho-PFK2", + "2 cinnamoyl-CoA", + "2-(indol-3-yl)acetaldehyde", + "2 ferrocytochrome", + "fucosylated Lewis antigen", + "5-methylcatechol", + "quinolin-2-ol", + "mature proteins", + "L-firefly luciferin", + "[iso-1-cytochrome c]", + "3-deoxy-D-arabino-hept-2-ulosonate 7-phosphate", + "cytosine1400 in 16S rRNA", + "semenogelin", + "6-(2-amino-2-carboxyethyl)-7,8-dioxo-1,2,3,4,7,8-hexahydroquinoline-2 4-dicarboxylate", + "veratrylaldehyde", + "[procollagen]-L-proline", + "[protein]-3-O-(N-acetyl-beta-D-glucosaminyl)-L-serine", + "NaV1.2 channel", + "3beta-hydroxy-15,16-epoxydolabrene", + "AP1", + "N6-ubiquitinyl-[SDIRIP1 protein]-L-lysine", + "phosphatidyl-L-serine", + "e-", + "S-adenosyl 3-(methylsulfanyl)propylamine", + "2,6-dichlorophenol indophenol", + "alpha-D-glucuronate 1-phosphate", + "myelin basic protein-L-citrulline", + "befunolol", + "2 reduced ferredoxin", + "G protein-coupled receptor GRK1", + "protopanaxadiol", + "2'-deoxyinosine", + "phosphorylated Smad1", + "1-(3-aminopropylidene)pyrrolidin-1-ium", + "proteinase B", + "cone opsin", + "(2S)-2-hydroxypropylphosphonate", + "complement C4 zymogen", + "[acetyl-CoA carboxylase 2]", + "L-lysine-[procollagen]", + "4,5-dioxo-1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylate", + "3-dehydro-shikimate", + "7-ethoxycoumarin", + "daunorubicin/out", + "lentinan", + "phosphodiesterase 5", + "NADP", + "N-acetyl-L-glutamate 5-semialdehyde", + "beta-D-N,N'-diacetylchitobiose", + "alpha-D-galactosyl-(1,4)-beta-D-galactosyl-(1 4)-N-acetyl-beta-D-glucosaminyl-alpha-D-galactosyl-(1 4)-beta-D-glucosylceramide", + "(8E,10R,12Z)-10-hydroperoxyoctadeca-8,12-dienoate", + "tumor necrosis factor alpha receptor I", + "[PBPA]-serine/threonine phosphate", + "nonaflavuxanthin", + "hydropyrenol", + "a long-chain acyl-[(phenol)carboxyphthiodiolenone synthase]", + "choline", + "(6S)-6beta-hydroxyhyoscyamine", + "1-(4'-carboxyphenylazo)-2-naphthol", + "phospho-Cdk2", + "tRNAPro", + "alpha-D-glucopyranose 1-phosphate", + "marneral", + "cyclohexylamine", + "1-heptanol", + "4-Androstene-3,17-dione", + "2-(formylamidomethylene)succinate", + "N-acetyl-D-glucosaminyl-1,2-alpha-D-mannosyl-1 3(6)-(N-acetyl-D-glucosaminyl-1,2-alpha-D-mannosyl-1 6(3))-beta-D-mannosyl-1,4-N-acetyl-D-glucosaminyl-L-Asn", + "[p21Cip1]-L-tyrosine", + "plasmid DNA", + "6-deoxy-L-galactono-1,5-lactone", + "3-(3,4-dihydroxyphenyl)lactate", + "Maleylacetoacetate", + "D-glucosamine 1-phosphate", + "paclitaxel/out", + "propeptide of prostasin", + "activated hepatocyte growth factor", + "neurotensin", + "5-aminopentanoate", + "[histone H3]-N6-methyl-L-lysine36", + "poly-ADP ribose polymerase-1", + "[ribulose-1,5-bisphosphate carboxylase]-N6-methyl-L-lysine", + "H+ Cl-", + "[E2F1]-N6-acetyl-L-lysine", + "xyloglucan", + "tetrachlorohydroquinone", + "2-methyladenine37 in tRNA", + "2 N,N'-diacetylchitobiose", + "luteolin 7-O-[beta-D-glucuronosyl-1 2-beta-D-glucuronide]-4'-O-beta-D-glucuronide", + "phosphorylated C/EBPalpha", + "12-L-hydroxy-5,8,10-heptadecaotrienoic acid", + "vitamin K", + "ubiquinone Q8", + "Bi3+-[bismuth-binding protein][side 1]", + "4-ethylcyclohexa-1,5-diene-1-carbonyl-CoA", + "2-(4-N-acetylaminophenyl)-1,3-benzothiazol-6-yl sulfate", + "a mycoketide-CoA", + "2 succinate", + "pre-rRNA", + "DNA with abasic site", + "(4R)-hydroxy-L-proline", + "Gal-beta-(1-4)-[Fuc-alpha-(1-3)]-GlcNAc-beta-(1-3)-Gal-beta-(1-4)-Glc", + "undecaprenyl diphosphate", + "7-aminomethyl-7-deazaguanine in tRNA(Tyr)", + "a 2-hydroxycarboxylate", + "gp120", + "rusticyanin", + "rapamycin", + "ficaprenol phosphate", + "2-[(3S)-3-amino-3-carboxypropyl]-L-histidine-[translation elongation factor 2]", + "nicotinamide beta-D-ribonucleotide", + "1D-myo-inositol-1,3,4,5-tetrakisphosphate", + "diethyl phosphate", + "(S)-acetoin", + "long-chain alcohol", + "6''-carboxyraffinose", + "estronesulfate", + "7-methylxanthosine", + "GWPA", + "(8E,10S)-10-hydroperoxyoctadeca-8-enoate", + "alpha-D-glucose 6-phosphate", + "nitroglycerin", + "cytosine49 in tRNAGlyGCC", + "probrain derived neurotrophic factor", + "giberellic acid GA4", + "cycloprodigiosin", + "eukaryotic elongation factor 1", + "(5Z,8Z,11Z,13E)-(15S)-15-hydroperoxyeicosa-5,8,11,13-tetraenoate", + "[histone H3]-N6,N6,N6-trimethyllysine27", + "(3R)-3-hydroxy-2-methylidenecyclopentan-1-one", + "succinic acid", + "apo-[C-phycoerythrin alpha-subunit CpeA]", + "beta-1,2-glucan/in", + "phloretin glucoside A3", + "myosin heavy chain phosphate", + "[beta-D-xylosyl-(1,2)]-galactoxylomannan", + "anthocyanidin-3-O-glucoside", + "2,3-dimethylphenol", + "4-nitroacetanilide", + "2-(2'-hydroxyphenyl)benzenesulfinate", + "urate/out", + "ergosta-5,7,24(28)-trien-3beta-ol", + "2-(4-methylaminophenyl)-1,3-benzothiazol-5-yl suflate", + "p48 N-terminal", + "diadenosine 5',5''-P1, P2-diphosphate", + "2-dihydropentaprenyloxyphenazine", + "nuclear mitotic apparatus protein", + "podocalyxin-like protein 1", + "(2S)-liquiritigenin", + "cis-4-hydroxytamoxifen", + "NACHT leucine-rich repeat and pyrin domain-containing protein 1B", + "Fuc-alpha-(1-6)-GlcNAc-beta-Asn", + "peptidoglucan", + "PS1/gamma-secretase complex component", + "GDP-beta-L-galactose", + "6-((N-(7-nitrobenz-2-oxa-1,3-diazol-4-yl)amino)hexanoyl)-sphingosine", + "11beta,17alpha,21-trihydroxypregna-1,4-diene-3,20-dione", + "IGF-binding protein-4", + "[fructose-1,6-bisphosphate aldolase]-lysine", + "an S-(1-hydroxy-2-oxopropyl)-[protein]-L-arginine", + "enol-(4-hydroxyphenyl)pyruvate", + "o-diphenol", + "tetracenomycin A2", + "1-acyl-2-palmitoyl-[glycerolipid]", + "L-2-haloalkanoic acid", + "12-ketochenodeoxycholic acid", + "(1R,3R)-chyrsanthemyl diphosphate", + "4,6-dihydroxypyrazolo(3,4-d)pyrimidine", + "dihydrobisanhydrobacterioruberin", + "racemic ipsenol", + "ethylnitronate", + "ricinoleic acid", + "[nuclear receptor LXR]-L-lysine", + "cytosylcobalamin", + "pentalenene", + "DNA-cytosine", + "(1R,2S)-dihydroxy-3,5-cyclohexadiene-1,4-dicarboxylate", + "oxidized plastocyanin", + "xylene", + "(2R,3R)-butane-2,3-diol", + "pro-caspase-8", + "6-endo-hydroxycineole", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-leucyl-[Arl8b protein]", + "G-protein", + "methymycin", + "2-carboxybenzaldehyde", + "extracellular regulated kinase 1", + "2-amino-2-deoxy-D-gluconate 6-phosphate[side 2]", + "precorrin-6A", + "phospho-[beta-adrenergic receptor]", + "streptothricin-D acid", + "1,2-dehydrocortisone", + "beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosamine", + "4 FAD", + "valienol 7-phosphate", + "N-acetyl-D-glucosaminyl-1,2-(N-acetyl-D-glucosaminyl-1,6)-1 2-alpha-D-mannosyl-1,3(6)-(N-acetyl-D-glucosaminyl-1 2-alpha-D-mannosyl-1,6(3))-beta-D-mannosyl-1 4-N-acetyl-D-glucosaminyl-L-Asn", + "presequence", + "nicotinate", + "5-methylaminomethyl-2-thiouridine34 in tRNA", + "neurokinin B", + "beta1-adrenergic receptor phosphate", + "UDP-4-amino-4-deoxy-beta-L-arabinose", + "caldoheptamine", + "alpha-D-glucopyranosyl-diphospho-ditrans,octacis-undecaprenol", + "Bacteriophage P22 gp7 protein", + "glyoxal", + "beta-selinene", + "(3S)-6-acetamido-3-aminohexanoate", + "N-acetyl-alpha-L-aspartate", + "fluroracetaldehyde", + "cytosine48 in tRNALeu(CAA) precursor", + "[IFN regulatory factor 3 protein]", + "3-hydroxypropionaldehyde", + "dichlorochromopyrrolate", + "6-deoxyerythronolide B", + "(10E)-12-hydroxy-10-dodecenoic acid", + "L-xylulose", + "pent-4-enal", + "GlcNAc-beta-(1,4)-GlcN", + "2-aminobenzoylacetyl-CoA", + "2-(acetamidomethylene)-beta-hydroxymethyl succinate", + "splicing factor 3B1", + "gibberellin a4", + "peroxiredoxin-(S-hydroxy-S-oxocysteine)", + "doxorubicinol", + "complement factor C3", + "3 acetyl-CoA", + "tenascin-C", + "beta-D-fructose", + "lysosomal-cathepsin Z N-acetyl-D-glucosaminyl-phospho-D-mannose", + "3beta-hydroxy-4beta-methyl-5alpha-cholest-7-en-4alpha-oic acid", + "small ubiquitin-related modifier-CENP-I", + "amicyanin", + "a [lipoyl-carrier protein]-L-lysine", + "[myosin II regulatory light chain]", + "2'-fucosyllactitol", + "FSHR tyrosine", + "protein C", + "huntingtin peptide fragments", + "2-hydroxy-2,4-hexadienedioate", + "reduced desulforedoxin", + "L-myo-Inositol 1-phosphate", + "glucogitoroside", + "Benzoyl-CoA", + "phospho-[M3 muscarinic acetylcholine receptor]", + "milk", + "dTDP-beta-L-evernosamine", + "2 reduced [4Fe-4S] ferredoxin", + "cyanocobalamin-[cobalamin-binding protein][side 1]", + "geminin", + "L-threonyl-tRNA2Thr", + "cyanocob(III)alamin", + "D,L-3-hydroxyisobutyrate", + "CEP52", + "1-O-alkyl-2-lyso-sn-glycero-3-phosphocholine", + "D-xylose-[D-xylose-binding protein XylF][side 1]", + "3-hydroxysteroids", + "(3-hydroxy-phenylalkanoic acid)n-x", + "[7-formyl]-chlorophyllide d", + "5-amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide", + "methylitaconate", + "DNA containing 2,6-diamino-4-hydroxyformamidopyrimidine residues", + "guanidine", + "a [protein]-L-lysine", + "1,3-benzoxazol-6-yl sulfate", + "tRNA pseudouridine39", + "(S)-2-chloropropanoate", + "2,3-butanediol", + "4-(ethylamino)-2-hydroxy-6-(isopropylamino)-1,3,5-triazine", + "endothelin-1", + "Ii-p10", + "cytosine beta-D-arabinofuranoside", + "dihydrouracil", + "DADE(pY)LIPQQG", + "a [histone H3]-N6,N6-dimethyl-L-lysine9", + "serine/in", + "matrix metalloproteinase-17", + "5 ohmC-G duplex", + "5'-phosphoribosyl-N-formylglycinamide", + "5beta-cholestan-7alpha-ol-3-one", + "a [histone H3]-L-lysine4", + "(24R)-3alpha,7alpha,12alpha,24,26-pentahydroxy-5beta-cholestane-27-ol", + "o-succinyl-1-benzoyl-CoA", + "kinin light chain", + "deoxyguanidinoproclavaminate", + "glycoprotein bound to polysaccharide cell wall", + "ethanolamine", + "[heparan sulfate]-D-glucosamine", + "(4Z)-2-oxohept-4-enedioate", + "3,6-diketocamphane", + "S-(2-hydroxyethyl)-L-cysteine sulfoxide", + "(Z)-propanethial S-oxide", + "inactive factor VIII", + "a sterol", + "2-Oxo-1,2-dihydroquinoline", + "fimbrilline", + "UDP-sulfoquinovose", + "D-norvaline", + "N-acetyl-lysine-histone H3", + "S-adenosylhomocysteine", + "SP-D protein", + "[L-Asp(4-L-Arg)]n", + "TGFalpha", + "arachidonoyl-CoA", + "Man5GlcNAc3-[protein]", + "N2-methylguanine26 in tRNA", + "phosphorylated retinoblastoma protein", + "alpha(2-6)-sialyllactose", + "(9R,13R)-(15Z)-12-oxophyto-10,15-dienoate", + "NADP+ +", + "2 2',3,4,4',6'-pentahydroxychalcone", + "DNA fragments", + "an aryl sulfate", + "3-amino-4-hydroxybenzoate", + "(Z)-4-hydroxyphenylacetaldehyde oxime", + "3,4-dihydroxy-5-octaprenylbenzoate", + "cefuroxime", + "harderoporphyrinogen", + "androstenone", + "corticosterone/in", + "eukaryotic initiation factor 479-?", + "procollagen 5-(D-galactosyloxy)-L-lysine", + "2-amino-2-deoxy-D-gluconate 6-phosphate", + "7,8-dihydropteroylglutamate", + "Co-methyl-Co-5-hydroxybenzimidazolylcobamide", + "Bap protein", + "5alpha-androst-16-en-3beta-ol", + "undecaprenyl-phosphate", + "xylopentose", + "minoxidil", + "angiotensin-converting enzyme type 2", + "alpha-mannosyl-1,2-oligosaccharide-lipid", + "S-ubiquitinyl-[E2 ubiquitin-conjugating enzyme Ubc13]-L-cysteine", + "gamma-carboxy-L-glutamate", + "(24R,25R)-3alpha,7alpha,12alpha 24-tetrahydroxy-5beta-cholestan-26-oyl-CoA", + "26S proteasome subunit", + "MEK", + "glucose oligomers", + "pro-alpha-mating factor", + "sulfate/in", + "mannotriose", + "2 NADP+", + "4-trimethylaminobutyrate", + "heparin-binding epidermal growth factor", + "5-hydroxy-L-tryptophan", + "chondroitin sulfate proteoglycan 4", + "nicotinate mononucleotide", + "(ADP-D-ribosyl)n-tyrosine kinase Yes1", + "pro-collagen", + "ethyl butanoate", + "nucleoside32 in tRNA", + "pinolenoyl-[glycerolipid]", + "1-stearoyl-2-arachidonoyl-sn-glycerol", + "HopPtoN/in", + "N3-acetylastromicin", + "reduced coenzyme Q1", + "I-kappaBalpha polymer", + "phosphorylated Nedd4", + "Ag+/in", + "maltose[side 2]", + "2,4-hexadien-1-ol", + "porphyran", + "alpha2-antiplasmin", + "4-(2-carboxyphenyl)-4-oxobutanoic acid", + "dGDP", + "[Gialpha1]-L-cysteine", + "fatty acyl-[acyl-carrier protein]", + "2 isomaltose", + "guanosine 3',5'-cyclic phosphate", + "t-anol", + "phospho-[DNA-directed RNA polymerase II subunit IIa]", + "phosphorylated moesin", + "caldariella quinone", + "1-phosphatidyl-myo-inositol", + "1,4-dihydroxy-2-naphthoate", + "trans,trans-2,3,4,5-tetradehydroacyl-CoA", + "phosphorylated p125", + "cadusafos", + "thioredoxin-1", + "active urokinase", + "phosphorylated hypoxia-inducible factor-1", + "nicotinate-adenine dinucleotide phosphate", + "tungstate-[tungstate-binding protein][side 1]", + "MEF-2D", + "MAPKAP-K2", + "3-fucosyllactitol", + "Acetyl phosphate", + "cyclohexa-1,5-diene-1-carbonyl-CoA", + "orotidine 5'-phosphate", + "[(1S,2S)-1-[[(2Z)-2-(2-azaniumyl-1,3-thiazol-4-yl)-2- [[(2-carboxypropan-2-yl)oxy]imino]acetyl]amino]-1-carboxypropan-2 yl]sulfamate", + "[beta-catenin]-Tyr142", + "5-(4-hydroxyphenyl) hydantoin", + "protein(SS)n", + "Arg-Pro-Lys-Pro-Gln-Gln-Phe-Phe-Gly-Leu-Met-NH2", + "13-[(2'-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]docosanoic acid methyl ester", + "L-arabinono-1,4-lactone", + "mycophenolic acid", + "albaflavenone", + "acetylated (1->4)-beta-D-glucuronan", + "S-acetyltrypanothione", + "uracil6666 in apolipoprotein B mRNA", + "15-ketoprostaglandin E", + "lacto-N-fucopentaose II", + "reduced methylene blue", + "bran extract", + "tRNAAsp", + "probenecid/out", + "beta-1,4-mannobiose", + "reduced phenazine methosulfate", + "phospho-L-serine", + "cohesin", + "cyclic Gp(2'-5')Ap(3'-5')", + "cholesta-5,7,22-trien-3beta-ol", + "complement factor B", + "[Stk1]-serine/threonine phosphate", + "4-Chlorobenzoyl-CoA", + "S-adenosyl-D-methionine", + "8-hydroxyguanine", + "histone H3 N6-methyl-L-lysine9", + "wheat-flour arabinoxylan", + "R-S-glutathione", + "leucine/in", + "L-threo-(6R,1'S,2'S)-5,6,7,8-tetrahydrobiopterin", + "7,8-dihydro-7,8-dihydroxykynurenate", + "4-guanidinobutyrate", + "1,3-benzothiazol-6-ol", + "3-oxo-13,17-secoandrost-4-ene-17,13alpha-lactone", + "N-(sulfooxy)biphenyl 4-amine", + "big potassium channel BKCa", + "4 D-mannose", + "(deoxyribonucleotide)n", + "phospho-[neurotensin receptor]", + "S-(1H-pyrrole-2-carbonyl)-[peptidyl-carrier protein]", + "Apocytochrome c", + "serine protease uPA", + "2-methyl-1-(2,4,6-trihydroxyphenyl)propan-1-one", + "24,25-dihydrolanosterol", + "DL-2,3-dichloropropionate", + "platelet IIb/IIIa receptor", + "S-(2E,6E)-farnesyl-[N Ras]-L-cysteine", + "Ac-EPNAAVP-CONH2", + "rifampicin", + "S-sulfanylglutathione", + "phospho-tubulin", + "Man7GlcNAc2-[protein] (isomer 7A1,2,3B3)", + "D-Fructuronate", + "Pda1p subunit", + "E2A homodimer", + "UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysine", + "trans-5-O-caffeoylshikimate", + "[androgen receptor]-L-tyrosine phosphate", + "ATF1", + "ceftizoxime/out", + "(3S)-neomenthol", + "4-methoxybenzaldehyde", + "benzonitrile", + "an N-acyl-L-homoserine lactone", + "UDP-N-acetylmuramoyl-L-alanine", + "[cullin-1]-N6-[NEDD8-protein]-yl-L-lysine", + "docosanoyl-CoA", + "tRNAIle", + "[MYPT1]", + "glycosylated lipophosphoglycan", + "(E)-4-hydroxy-3-methylbut-2-en-1-yl diphosphate", + "S-L-allo-isoleucyl-[CmaA-protein-T-domain]-4'-phosphopantetheinyl-L allo-isoleucyl thioester", + "cyanidin 3-O-(6''-O-4-coumarylglucoside)-5-O-(6'''-O-malonylglucoside)", + "abieta-7,13-dien-18-al", + "[anti-sigma factor antagonist protein]-serine/threonine phosphate", + "Rap-cysteine", + "Nomega-(ADP-D-ribosyl)-L-arginine-human neutrophil peptide-1", + "(R,S)-tetrahydropalmatine", + "adenine1408 in 16S rRNA", + "cis-aconitate", + "LC3-II protein", + "Na+/in", + "2'-O-methyllicodione", + "Nalpha-benzoyl-DL-arginine-4-nitroanilide", + "7 beta-D-glucose", + "Chorismate", + "biphenyl", + "13-hydroperoxyoctadecatrienoic acid", + "Sic1 protein", + "ADP-ribose", + "alpha-haemolysin/out", + "ent-pimara-8(14),15-diene", + "acetylated chitin polymer", + "demethylsertraline", + "5-dehydro-4-deoxy-D-glucuronate", + "4-(2-Aminoethyl)benzene-1,2-diol", + "rye flour arabinoxylan", + "a long-chain-fatty acyl-CoA", + "annexin 1", + "apo allophycocyanin beta-subunit", + "N-acetyl-glucosamine", + "4-hydroxyphenylacetaldehyde", + "N-dodecanoyl-(S)-homoserine lactone", + "2-acetyl-2-devinylchlorophyllide a", + "dCDPdiacylglycerol", + "C16-ceramide", + "tRNAMet", + "3,8-divinyl chlorophyll a", + "[protein DsbG] with reduced L-cysteine residues", + "trihydroxycoprostanoyl-CoA", + "taurocyamine", + "3-aminopropionate", + "[PrkC]-serine/threonine", + "3-hydroxy-3-methylglutarate", + "D-Tagaturonate", + "a long-chain acyl-[acyl-carrier protein]", + "DTGNNSQVSQNY", + "SpoIVFA", + "[histone H3R17]-Nomega,Nomega-dimethyl-L-arginine", + "L-phenylalanyl-[protein]", + "Fucalpha1-2Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glc", + "[G protein alpha subunit]-L-cysteine", + "N-acetyl-D-galactosaminyl-(N-acetylneuraminyl)-D-galactosyl-D glucosylceramide", + "ivory nut mannan", + "7 (S)-methylmalonyl-CoA", + "larreatricin", + "2-bromocyclohexa-1,5-diene-1-carbonyl-CoA", + "reduced vitamin K", + "fibronectin peptide fragments", + "UDP-L-arabinose", + "6 reduced [2Fe-2S] ferredoxin", + "(2R)-2-amino-2-methyl-4-(1-methyl)-5-[4-(4-methylphenyl)butanoyl]-1H pyrrol-2-yl)butyl dihydrogen phosphate", + "cycasin", + "UDP-N-acetyl-D-mannosamine", + "phosphorylated CCDC92", + "DNA lacking 6-O-methylguanine", + "bile acids", + "glutathione S-transferase-tagged P-selectin glycoprotein ligand-1 tyrosine O-sulfate", + "P1,P5-bis(5'-adenosyl)pentaphosphate", + "[ribulose-1,5-bisphosphate carboxylase]-lysine", + "calcein/out", + "(ADP-D-ribosyl)n-aryl hydrocarbon receptor", + "1-palmitoyl-2-lysophosphatidylcholine", + "[hexadecanoyl]-acyl carrier protein", + "3,8-dideoxy-8-oxo-alpha-D-manno-octulosonic acid", + "lamin B2", + "adiponectin-5-hydroxy-L-lysine", + "5-methylcytosine50 in tRNAPro(AGG)", + "2,5-diamino-6-hydroxy-4-(5-phospho-D-ribosylamino)pyrimidine", + "alpha-L-fucosyl-1,2-beta-D-galactosyl-R", + "[arabinose-binding protein][side 1]", + "D-galactono-1,4-lactone", + "N2-methylguanine966 in 30S rRNA", + "MoO2(OH)Dtpp-mGDP", + "perchlorate", + "N-behenoyl-D-sphinganine", + "mature Gag polyprotein", + "allopurinol/in", + "apical membrane antigen 1", + "L-glutamate-5-semialdehyde", + "matrilin 4", + "1-(5'-phosphoribosyl)-5-amino-4-carboxyimidazole", + "retinoblastoma-related protein", + "gibberellin A12 aldehyde", + "ATPase p97", + "lyso-platelet-activating factor", + "polyadenylate", + "acetanilide", + "bisanhydrobacterioruberin", + "1,3,7-trimethyl-5-hydroxyisourate", + "cytochrome c-554", + "cytosine48 in tRNASer(GCU)", + "GDP-4-keto-6-deoxy-D-mannose", + "acylhydroxamate", + "a 5'-hydroxy-guanosine-[premRNA fragment]", + "3-carboxy-2-hydroxyadipate", + "phosphorylated insulin receptor substrate 1", + "cyanidin 3-O-(6-O-(4-coumaroyl))-beta-D-glucoside", + "sulfur-(sulfur carrier)", + "mitochondrial tRNALys(UUU) pseudouridine28", + "5-methylcytosine48 in tRNALeu(CAA) precursor", + "N-methylethanolamine phosphate", + "(S)-3-hydroxy-3-methylglutaryl-CoA", + "N7-methylguanine1405 in 16S rRNA", + "3beta-hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carboxylate", + "indol-3-pyruvic acid", + "RNA bacteriophage MS2", + "ADP-D-ribosyl-[dinitrogen reductase]", + "Gurken protein", + "[BMAL1]-L-lysine", + "DELTA4-androstene-3,17-dione", + "ephrin-A5", + "glycine betaine/out", + "guanine6 in tRNA", + "succinyl-YISRRLL", + "gluconate", + "3-(4-hydroxyphenyl)-2-oxopropanoate", + "trans-diphenylpropene oxide", + "1-phosphatidyl-1D-myo-inositol 4-phosphate", + "2,2-dichloropropionic acid", + "DL-2-hydroxyisocaproate", + "pyridin-1-ium-3-carboxylate-5-thiocarboxylate mononucleotide", + "Phenylacetaldehyde", + "arachidonoyl-7-hydroxy-6-methoxy-4-methylcoumarin ester", + "L-glucitol", + "5-methylsalicylate", + "dihydromonacolin L", + "phospholipase C-gamma1", + "DL-glycerol 3-phosphate", + "1-alkenylglycerophosphoethanolamine", + "19 diphosphate", + "anti-apoptotic C-terminal fragment of endorepellin", + "4-cyanobenzaldehyde", + "(2S,3R,4S)-4-hydroxy-L-isoleucine", + "(4Z,9Z)-hexadec-4,9-dienoyl-[acyl-carrier protein]", + "[histone H3]-N6,N6-dimethyl-L-lysine4", + "2-(2-hydroxyacyl)sphingosine", + "alpha-bisabolol", + "N-methylpropionamide", + "N-acetyl-1-D-myo-inosityl-2-amino-2-deoxy-alpha-D-glucopyranoside", + "L-histidin", + "holocarboxylase", + "abnormal spindle pole protein", + "31R-3-(1-hydroxyethyl)-bacteriochlorophyllide a", + "benzylamine N-oxide", + "beta-ribofuranosylaminobenzene 5'-phosphate", + "fumigaclavine A", + "D1 polypeptide of photosystem II", + "2-oxopropanal", + "myo-inositol 4-phosphate", + "Nalpha-benzyloxycarbonyl-L-glutaminylglycine", + "phosphorylated STAT1c", + "a 4'-hydroxyisoflavone", + "apo-[acetyl-CoA:carbon-dioxide ligase (ADP-forming)]", + "HS-CoB", + "N-acetylglucosamine 1-phosphate", + "4 1,2-benzoquinone", + "dihomo-gamma-linolenic acid", + "(1S)-deacetylisoipecoside", + "erythromycin D", + "histone H3 peptide", + "Ser-Gly-Arg-Gly", + "lipid A-core oligosaccharide[side 2]", + "alpha-1-antitrypsin", + "8-methylnonanoate", + "p60", + "5-fluoro-2'-deoxyuridine", + "4-aminobenzonitrile", + "phosphorylated DVL3", + "L-selenocysteinyl-tRNASec", + "O-D-mannosylprotein", + "papain-like cysteine proteinase precursors", + "(2S,3S)-2-hydroxytridecane-1,2,3-tricarboxylate", + "dichlorvos", + "(R)-3-hydroxybutyryl-CoA", + "penicillin N", + "4-hydroxytamoxifen beta-D-glucuronoside", + "WSTEA", + "dTDP-3-amino-3,6-dideoxy-alpha-D-glucopyranose", + "estrogen receptor alpha", + "2 mycothiol", + "(1R)-menthone", + "formononetin 7-O-beta-D-glucoside", + "vascular endothelial growth factor-165", + "NCO-", + "poly(3-hydroxyalkanoate)", + "androstene oxide", + "2-oxopentanal", + "Spo0F L-histidine", + "3-methylbenzoyl-CoA", + "acid-sensing ion channel 1", + "3-hydroxybutyryl-CoA", + "phosphorylated Rim15 protein", + "xenobiotic/out", + "(-)-borneol", + "7-deoxycylindrospermopsin", + "1-pyrroline-(4R)-hydroxy-2-carboxylate", + "His-Lys-Asp-Met-Gln-Leu-Gly-Arg", + "extracellular domain peptides of SpoIVFA", + "alpha-ribazole 5'-phosphate", + "Pyruvate", + "[p53 protein]-N6-acetyl-L-lysine", + "demethylated methyl group donor", + "Mdm2", + "3-alpha(S)-strictosidine", + "(R,S)-linalool", + "2 dexmedetomidine", + "4-hydroxylactate", + "8-oxoxanthine", + "dihydro-4-coumaroyl-CoA", + "mogrol", + "4-ethylsulfanyl-2-oxobutyric acid", + "adenine2142 in 25S rRNA", + "3-ureidobutanoic acid", + "(2S,4S)-4-hydroxy-2,3,4,5-tetrahydrodipicolinate", + "CoB-S-S-CoM", + "palmitoyl carnitine", + "2-hydroxybut-3-enylglucosinolate", + "24-dihydrolanosterol", + "arsenite[side 2]", + "2-aminoethanethiol", + "cholestan-3beta-ol", + "phosphorylated pocket protein 107", + "an N-terminal-L-methionyl-L-leucyl-[RNP F protein]", + "Naltrexone", + "mycinamicin IV", + "S-methyl 3-phospho-1-thio-D-glycerate", + "but-3-enal", + "Man5GlcNAc", + "Vav", + "phosphorylated MEF-2D", + "amyloid precursor protein", + "prostacyclin", + "L-Fuculose", + "[methyl coenzyme-M reductase subunit McrA]-L-arginine275", + "N1,N8-bis-(gamma-L-glutamyl-L-cysteinyl-glycyl)-spermidine", + "kanamycin B", + "tRNA containing extra residues at the 3'-terminus", + "(5Z,13E)-(15S)-9alpha,15-dihydroxy-11-oxoprosta-5,13-dienoate", + "3-hydroxydesloratadine beta-O-D-glucuronoside", + "retinyl ester-[cellular retinol-binding protein]", + "vitamin B12/out", + "1-propenesulfenic acid", + "a 1-acyl-2-palmitoleoyl-[glycerolipid]", + "5'-AMP", + "reduced adrenodoxin", + "palmitoyl-[(hydroxy)phthioceranic acid synthase]", + "phosphorylated Chk2", + "Prostaglandin I2", + "CD44", + "firefly oxyluciferin", + "N6-ubiquitinyl-[acceptor protein]-L-lysine", + "D-xylitol", + "reduced glutaredoxin", + "myelin-associated glycoprotein", + "adrenal ferredoxin", + "Nalpha-acetylpeptide", + "epoxypropane", + "(S)-propane-1,2-diol", + "a 5-hydroxyfurocoumarin", + "[LynE]-(1S,4R)-2-(C-substituted-aminomethyl)-4-acyl-2-thiazoline", + "2,3-diphospho-D-glycerate", + "(E)-4-(trimethylammonio)but-2-enoyl-CoA", + "hexanoyl-[acyl-carrier protein]", + "interleukin-31", + "p-cresol sulfate", + "15-ketoprostaglandin E2", + "4-hydroxynonanol", + "phloretate", + "4-acetylpyridine", + "mucin", + "carminomycin", + "O-phosphoviomycin", + "1 2-diacyl-3-[3-(alpha-D-N-acetylneuraminyl)-beta-D-galactosyl]-sn glycerol", + "alpha-D-mannosyl-1,6-(alpha-D-mannosyl-1,3)-alpha-D-mannosyl-1 6-(alpha-D-mannosyl-1,3)-beta-D-mannosyl-1,4-N-acetyl-D-glucosaminyl-1 4-N-acetyl-D-glucosaminyl-Asn-peptide", + "phytanoyl-CoA", + "UDP-N-acetyl-3-(1-carboxyvinyl)-D-glucosamine", + "2 accetor", + "junction plakoglobin N5-pentylglutamine", + "kappa-carrageen", + "interleukin-22", + "plasmin", + "2 Man9GlcNAc", + "20alpha-hydroxy-4-pregnen-3-one", + "reduced FAD", + "adenosine-5'-diphospho-5'-(ribonucleotide)-[DNA]", + "TDP-D-galacturonate", + "D-mannose 1-phosphate", + "S-methyl-L-homocysteine", + "[FAK]-L-tyrosine phosphate", + "phosphorylated MMP-9", + "L-arginine[side 2]", + "L-azetidine-2-carboxylic acid", + "L-Ser-L-Pro", + "3-methylbutanoyl-CoA", + "[carrier protein LysW]-C-terminal-L-glutamate", + "L-Asp", + "cystathionine", + "candesartan cilexetil", + "1,2-dihydrosantonin", + "an archaeal dolichyl beta-D-glucosyl phosphate", + "N-acetyl-D-norvaline", + "protein-bound gamma-glutamine", + "L-3-hydroxybutyryl-CoA", + "sweet sorghum starch", + "transforming growth factor beta", + "[glutamine synthetase]-O4-(5'-adenylyl)-L-tyrosine", + "microthecin", + "acetyl-dephospho-CoA", + "Na/+in", + "(4R,8Z)-4-hydroxy-8-sphingenine", + "a hydroxyanthraquinone", + "(9S,13S)-8-[(1R,2R)-3-oxo-2-((Z)-pent-2-enyl)cyclopentyl]octanoate", + "an alpha-parinaroyl-[glycerolipid]", + "pre-mRNA", + "16alpha,17-epoxyprogesterone", + "L-Fuc-alpha-(1->3)-[D-Gal-beta(1->4)]-D-GlcNac", + "3alpha-hydroxy-5beta-pregnan-20-one", + "5'-dUMP", + "lambda CI repressor ext1-lambdacIN-RSEYE", + "alpha-D-ribose 1-methylphosphonate 5-phosphate", + "(R)-nicotine", + "malto-oligosaccharides", + "caseinomacropeptide", + "thymine-mismatched double-stranded DNA", + "O-methyl gibberellin A3", + "10000 Da fragment of von Willebrand factor 115", + "1-beta-D-arabinofuranosylcytosine 5'-phosphate", + "13-hydroxydocosanoic acid", + "N-sulfoaniline", + "acarbose 7'''-phosphate", + "[StkP]-serine/threonine phosphate", + "fluazifop-P", + "alkali soluble 1,3-beta-glucan", + "[c-myc]-N6-acetyl-L-lysine", + "(indol-3-yl)acetamide", + "[acetyl-CoA carboxylase 2] phosphate", + "1-[(4-amino-2-methylpyrimidin-5-yl)methyl]4-hydroxypyrrolidine-2 carboxylic acid", + "erythronate-4-phosphate", + "lysosomal-cathepsin Z D-mannose", + "6-deoxy-6-sulfo-D-fructose 1-phosphate", + "AGL24 protein", + "leucin-rich repeats and immunoglobulin-like domains protein 1", + "9-(phenylcarbonyl)-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2 1-ij]quinolin-11-one", + "1D-3-O-methyl-myo-inositol", + "Ac-SFITRRLQ", + "fusion-active transmembrane protein GP2", + "(8E,10S,12Z)-10-hydroperoxyoctadeca-8,12-dienoate", + "flaviolin", + "a [lipoprotein]-N-acyl-S-1,2-diacyl-sn-glyceryl-L-cysteine", + "(Z)-2-butenoyl-CoA", + "compound Mx-1", + "pro-islet amyloid polypeptide", + "phosphorylated metabotropic glutamate receptor 5", + "2-oxo-3-(phosphooxy)propyl 3-oxoalkanoate", + "1,8-S-dipalmitoyloctanedithiol", + "6-amino-2-oxohexanoic acid", + "dolichyl beta-D-mannosyl phosphate", + "alpha-longipinene", + "3-(1H-indol-3-yl)propanoate", + "2-deoxy-scyllo-inosamine", + "(2S)-methylsuccinyl-CoA", + "apo-[alpha-aminoadipate semialdehyde reductase Lys2]", + "PFK2", + "7 D-glucose", + "Gag protein", + "myosin heavy chain", + "tRNAPhe precursor", + "phosphorylated axin", + "Smad", + "anthocyanidin-3-O-beta-D-glucoside", + "citryl-diaminoethane", + "2 alpha-D-glucose", + "1,2-diricinoleoyl-sn-glycerol", + "caffeolylaldehyde", + "26-deglucoavenacoside", + "a long-chain aldehyde", + "TatA protein", + "2-dehydro-D-gulonate", + "reduced glutathione", + "malonyl-CoA", + "collagen III", + "10-gingerol 5-O-beta-D-glucuronoside", + "malto-aldonic acids", + "3,3,5-trimethyl-4-(propan-2-yl)cyclohexan-1-one", + "GDPmannose", + "carboxylic acid", + "1-O-alkyl-2-acetyl-sn-glycerol 3-phosphocholine", + "platelet-inactivating factor", + "5,10-methenyl tetrahydrofolate", + "dTDP-4-dehydro-6-deoxy-alpha-D-glucose", + "[a protein]-serine/threonine", + "CMP-N-acetylneuraminate", + "oxidized electron acceptor", + "thioredoxin 1", + "naringenin 7-O-glucoside", + "oxidized ferredoxin", + "behenoyl-CoA", + "ketoprofen", + "mature type I IDF receptor", + "desferrioxamine/in", + "trypsinogen tyrosine O-sulfate", + "beta-D-ribosylnicotinate", + "KGISSQY", + "dTDP-3-amino-4,6-dideoxy-alpha-D-glucopyranose", + "angiotensin", + "(glycyl)adenylate", + "2-oxopentanedioate", + "2 reduced cytochrome c", + "alpha-L-arabinofuranose", + "4-hydroxycoumarin", + "DNA-RNA duplex", + "[histone H3.3]-N6-methyl-L-lysine27", + "[histone H4]-L-lysine12", + "proform of transforming growth factor-beta", + "[amino-group carrier protein LysW]-C-terminal-gamma-aminoadipic semialdehyde", + "CD109 propeptide", + "Arabidopsis thaliana protein AT1G7815", + "anaphylatoxin C3a", + "beta-geranylfarnesene", + "deoxycholate", + "coproporphyrinogen-III", + "a glycosylated acceptor", + "phosphorylated Gli1 protein", + "[unpolar amino acid-binding protein][side 1]", + "(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate", + "12-hydroxycholesterol", + "2-hydroxy-5-methylmuconate-6-semialdehyde", + "platelet-derived growth factor receptor-beta", + "cortactin-L-tyrosine", + "thiamine[side 2]", + "N-Acetylglucosamine 6-phosphate", + "an unfolded polypeptide", + "4-O-alpha-D-glucopyranosyl-D-glucose", + "mixed-linkage (1->3,1->4)-beta-D-glucan", + "amino acid", + "(E)-2,4-dimethoxy-6-(4-methoxystyryl)benzaldehyde oxime", + "N-carbamoyl-D-alpha-isoleucine", + "1H-indol-6-yl sulfate", + "UDP-Gal", + "N-acetyl-D-glucosaminyl-N-acetylmuramoyl-L-Ala-D-glutamyl-6-carboxy-L Lys", + "24(28)-methylenecycloartanol", + "S-(2E,6E)-farnesyl-[protein]-L-cysteine", + "valosin containing protein", + "spermidine", + "a 3-oxo-delta1-steroid", + "[alginate]-alpha-L-guluronate", + "phosphorylated extracellular regulated kinase 1", + "(4S)-4-hydroxy-2-oxoheptanedioate", + "alpha-enolase", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-tyrosyl-[protein]", + "apo-[acyl-carrier protein]", + "CMP-5-N-acetyl-9-O-acetylneuraminate", + "Zn2+/out", + "(3S,22S)-2,3:22,23-diepoxy-2,3,22,23-tetrahydrosqualene", + "Lck", + "omega-hydroxy-beta-dihydromenaquinone-9", + "Man3GlcNAc2", + "N-acetylglucosamine", + "hydrolyzed norovirus polyprotein", + "3 Na+/in", + "Der p 3 propeptide", + "3-[(4S)-4-hydroxycyclohexa-1,5-dien-1-yl]-2-oxopropanoate", + "N-acylethanolamine", + "2-amino-3-(3-oxoprop-1-en-1-yl)but-2-enedioate", + "ADAM10", + "[L-glutamate-binding protein][side 1]", + "inosine 5'-phosphate", + "[molybdopterin-synthase sulfur-carrier protein]-Gly-NH-CH2-C(O)SH", + "ginsenoside Rg3", + "DL-lysine", + "3,3'-diiodo-L-thyronine", + "(E)-3-(3-hydroxy-4-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)acrylic acid", + "an omega-(methylthio)alkyl-glucosinolate", + "[beta-D-xylose-(1,2)]-glucuronoxylomannan", + "1-acyl-2-palmitoleoyl-[glycerolipid]", + "gamma-L-Glu-L-Cys", + "quinovosidodigitoxigenin", + "glucuronic acid", + "androstandione", + "(-)-afzelechin", + "homoprotocatechuic acid", + "3-oxo-hexanoyl-[acyl-carrier protein]", + "[flagellum protein FlaB2]-L-asparagine101", + "dibenzothiophene-5-oxide", + "3-buten-1-ol", + "3-hydroxybenzoyl-CoA", + "(3-deoxy-alpha-D-manno-oct-2-ulopyranosylonate)-(2->4)-(3-deoxy-alpha-D manno-oct-2-ulopyranosylonate)-(2->6)-2-deoxy-2-[[(3R)-3 (dodecanoyloxy)tetradecanoyl]amino]-3-O-[(3R)-3 (tetradecanoyloxy)tetradecanoyl]-4-O-phosphono-beta-D-glucopyranosyl-(1 >6)-2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[[(3R)-3 hydroxytetradecanoyl]amino]-1-O-phosphono-alpha-D-glucopyranose", + "[Sam68]-L-tyrosine phosphate", + "SceD", + "7,8-dihydroneopterin 3'-triphosphate", + "6-deoxy-6-sulfo-D-gluconate", + "low molecular weight kininogen", + "5beta-androstane-3alpha,17beta-diol", + "terpentetriene", + "(S)-4-hydroxymandelate", + "an [acyl-carrier protein]", + "UDP-alpha-D-kanosamine", + "carboxylic aldehyde", + "adenosine-3',5'-bisphosphate", + "2-O-phospho-3-sulfolactate", + "A", + "reduced denatured RNase A", + "2,3,5,6-tetrachlorocyclohexane-1,4-diol", + "3 L-methionine", + "(6aS,11aS)-3,6a,9-trihydroxypterocarpan", + "uracil", + "[NLRP1B]-N-terminal-amino acid", + "(6R 7R)-3-methyl-8-oxo-7-[(thiophen-2-ylacetyl)amino]-5-thia-1 azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid", + "N7-pentanoyldeacetoxycephalosporin C", + "dithiothreitol S-oxide", + "N-acetyl-D-alanine", + "phosphorylated actin", + "protein tau phosphate", + "(RS)-1-phenylethanol", + "5-methyluridine54 in tRNA", + "cAMP-response element-binding protein", + "globoside", + "GlcAbeta1-3GalNAc(4-O-sulfate)", + "[histone H4]-L-lysin16", + "beta-hexaprene", + "[oxidized NADPH-P450 reductase]", + "phosphorylated Gli protein", + "fragments of Swedish mutation of amyloid precursor protein", + "beta-amyloid precursor protein pre-peptide", + "p-nitrophenol", + "3-hydroxybenzoyl beta-D-glucoside", + "3',5'-dihydroxy-dihydrokaempferol", + "trans-2,3-dehydracyl-[acyl-carrier protein]", + "L-norleucine", + "beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosamine", + "EGFR110", + "beta-D-galactosyl-(1->3)-N-acetyl-D-glucosaminyl-R", + "phospho-L-tyrosinyl Src family kinase", + "1-beta-D-arabinofuranosylcytosine", + "9S rRNA precursor", + "desglutamyl lentinic acid", + "thymine-guanine-mismatched double-stranded DNA", + "3-oxodecanoyl-[acyl-carrier protein]", + "amyloid beta-protein 1-42", + "GSH-conjugated prostaglandin A2/in", + "(R)-pantothenate", + "6-carboxyhexanoyl-CoA", + "O2-methylcytosine", + "ceftazidime", + "(12R)-HPETE", + "isomaltotriose/out", + "mammalian actin-binding protein-1", + "N-arachidonoylethanolamide", + "5-hydroxypentanoyl-CoA", + "phosphorylated CTP:phosphoethanolamine cytidylyltransferase", + "trans-4-hydroxy-L-proline", + "thiamine diphosphate[side 2]", + "but-1-en-3-one", + "alpha-1,4-glucan", + "heparin", + "nodavirus mature virion", + "all-trans-retinyl ester", + "[G-protein-coupled receptor]phosphate", + "chelirubine", + "1-oleoyl-2-arachidonoyl-sn-glycerol", + "glial fibrillary acidic protein-L-arginine", + "ethylamine", + "aureusidin", + "linoleic acid", + "(2E)-2-enoyl-CoA", + "1-bromo-2,4-dinitrobenzene", + "epidermal growth factor receptor", + "hypoxanthosylcobalamin", + "a PqqA peptide with linked Glu-Tyr residues", + "Poly(A)-binding protein", + "(Z)-phenylacetaldehyde oxime", + "histone H3-L-Arg", + "astromicin", + "O-phospho-L-seryl-tRNASec", + "(S,R)-sulindac", + "actin peptide H methylated at N1-position of histidine", + "proclavaminic acid", + "arabinoxylan oligosaccharides", + "proform G protein-coupled protease activated receptor-2", + "stigmast-5,7-dien-3beta-ol", + "[3-methyl-2-oxobutanoate dehydrogenase (lipoamide)] phosphate", + "2-alpha-D-glucosyl-D-glucose", + "i-erythreitol", + "N-acetyl-D-glucosamine[side 1]", + "pro-collagen type II", + "uracil47 in tRNA", + "1-acyl-sn-glycerol 3-phosphate", + "OTUB1 protein", + "phosphorylated glutamine synthetase", + "3-beta-L-mycarosylerythronolide B", + "[protein]-L-threonine phosphate", + "[beta-tubulin]-L-glutamate", + "mature interleukin-18", + "3-deoxygluconosone", + "7-O-beta-D-glucosyl-5,7,3',4'-tetrahydroxyflavone", + "benzoic acid", + "2-nitroacetanilide", + "acyclovir/out", + "(E,Z)-3,6-nonadienal", + "N-(6R,S)-5-formyl-5,6,7,8-tetrahydropteroic acid", + "Ac-AISRRLL", + "quaternary amine/in", + "5-amino-2,6-dioxy-4-(5'-phosphoribitylamino)pyrimidine", + "heptaprenyl diphosphate", + "methyl benzoylformate", + "nitrous oxide", + "His", + "proteinase-activated receptor 2", + "acetylcadaverine", + "6-methylsalicylate", + "factor Va", + "[Whi3 cell cycle regulator phosphoprotein]", + "(1R,2S,6R)-anticapsin", + "interleukin 1alpha/beta", + "guanine9 in tRNAGly", + "1-amino-9,10-anthracenedione", + "a 2,3-bis-(O-phytanyl)-sn-glycero-phospholipid", + "(S)-2,3,4,5-tetrahydropiperidine-2-carboxylate", + "8'-hydroxyabscisate", + "N-myristoylated p60src-derived peptide", + "4-methyl-3-hydroanthranilic acid methyl ester", + "biliverdin-IX-beta", + "thiol-glyoxylate adducts", + "2-methyl-6-geranylgeranylbenzoquinol", + "25-hydroxycholest-4-en-3-one", + "4-Aminobutanoate", + "edaravone glucuronide/out", + "2-hydroxyacetate", + "[eukaryotic translation initiation factor 2alpha]phosphate", + "SYN1", + "N-acetyl-D-glucosaminyl-diphosphodolichol", + "3-sulfinoalanine", + "caffeic acid", + "N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-beta D-glucosaminyl-R", + "histone H4-L-citrulline", + "promatrix metalloproteinase-9", + "pyrroloquinoline quinol", + "N-(ADP-D-ribosyl)diphthamide-[Escherichia coli elongation factor Tu]", + "(R,S)-5,8,13,13a-tetrahydrocolumbamine", + "(ribonucleotide)n-3'-phosphate", + "17beta-estradiol", + "sitosterol", + "(2R)-O-phospho-3-sulfolactate", + "putrescine-[putrescine-binding protein][side 1]", + "L-erythro-7,8-dihydrobiopterin", + "large rRNA", + "7-(3-amino-3-carboxypropyl)wyosine37 in tRNAPhe", + "gemfibrozil beta-D-glucuronoside", + "SF3B1 protein-L-Thr434", + "3-methoxy-4-hydroxy-5-all-trans-polyprenylbenzoate", + "phenoxyacetate", + "4-methylbenzaldehyde", + "4-trimethylaminobutanoate", + "N-terminal L-alanyl-L-prolyl-L-lysyl-[protein]", + "Citramalyl-CoA", + "(ADP-D-ribosyl)-moesin", + "integrin alphaMb2", + "4-hydroxy-2,5-dimethyl-3(2H)-furanone", + "phosphonate/in", + "an ubiquinol", + "dapsone", + "[DNA]-3'-phosphate", + "tetradecanoyl-CoA", + "VdHog1", + "(S)-lactate", + "S-ubiquitinyl-[E2 ubiquitin-conjugating enzyme]-L-cysteine", + "2 [corrinoid adenosyltransferase]", + "4-amino-5-phosphomethyl-2-methylpyrimidine", + "3-demethylubiquinol-8", + "N-arachidoyl-D-sphinganine", + "N-lauroyl-D-erythro-sphingosylphosphorylcholine", + "DNA-3-methylthymine", + "alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D galactosamine", + "[factor VII protein with EGF-like domain 1]-L-serine", + "(Nomega-L-arginino)succinate", + "alpastatin", + "13-hydroperoxy octadecadienoic acid", + "N-terminal L-glutamyl-[protein]", + "1-pyrroline 2-carboxylate", + "secretory leukocyte protease inhibitor", + "4-carboxymethylene-but-2-ene-4-olide", + "4-hydroxy-2-oxoglutarate", + "D-histidine", + "receptor-interacting protein kinase-1", + "(Z)-2-methylureidoacrylate peracid", + "2,5-dichloro-2,5-cyclohexadiene-1,4-diol", + "4-hydroxy-3-methoxybenzaldehyde", + "D-pantoate", + "16-hydroxytabersonine", + "phenyl pyridine-3-carboxylate", + "arsenate", + "adhesin MTRAP", + "Man6GlcNAc2", + "7-epi-cylindrospermopsin", + "androst-4-ene-3beta-ol-17-one", + "CMP-N-acetylneuraminic acid", + "(3-deoxy-alpha-D-manno-oct-2-ulopyranosylonate)-(2->4)-(3-deoxy-alpha-D manno-oct-2-ulopyranosylonate)-(2->6)-2-deoxy-2-[[(3R)-3 dodecanoyloxytetradecanoyl]amino]-3-O-[(3R)-3-hydroxytetradecanoyl]-4-O phosphono-beta-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3 hydroxytetradecanoyl]-2-[[(3R)-3-hydroxytetradecanoyl]amino]-1-O phosphono-alpha-D-glucopyranose", + "all-trans-decaprenyl diphosphate", + "2 L-ascorbic acid", + "gamma-carotene", + "TRH-like peptide", + "N4-acetyl-L-2,4-diaminobutyrate", + "BH3-only protein Bid", + "[glutamate oxaloacetate transaminase 2]-L-lysine", + "cobyrinic acid", + "beta-sesquiphellandrene", + "filaggrin-L-arginine", + "lipid X", + "(2-methylthio)acetaldehyde", + "3-chlorobenzoate", + "1-amino-4-hydroxynaphthalene", + "CX3CR1 tyrosine O-sulfate", + "2-oxo-5-aminopentanoate", + "11-dehydro,21-hydroxy-pregn-4-en-3,20-dione", + "13-O-coumarylplumieride", + "septin 3", + "N-ribosylpurine", + "H-kininogen", + "magnesium-protoporphyrin IX monomethyl ester", + "guanine37 in tRNAPhe", + "N7-methylguanosine 5'-diphosphate", + "2,3-bisphospho-D-glycerate", + "histone L-citrulline", + "S-(L-prolyl)-[peptidyl-carrier protein]", + "oxidized donor", + "melatonin", + "homoserine", + "Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala)-diphosphoundecaprenol", + "L-arabinonate", + "undecaprenyl-pyrophosphate-linked cellobiose", + "6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranose", + "methiocarb sulfoxide", + "precorrin-4", + "5-methylcytosine49 in tRNAGly(GCC)", + "flavonol 3-O-glucoside", + "[3-methyl-2-oxobutanoate dehydrogenase (acetyl-transferring)]", + "3',5'-cyclic AMP", + "(25S)-5beta-spirostan-3beta-ol", + "[aquaporin-2]-serine/threonine phosphate", + "dehydroepiandrosterone 3-sulfate", + "CDP-L-myo-inositol", + "a phthiocerol", + "amyloid beta-peptide(1-40)", + "glucocochlearin", + "N-acetyl-beta-D-glucosaminyl-1,6-(N-acetyl-beta-D-glucosaminyl-1 3)-N-acetyl-alpha-D-galactosaminyl-R", + "2-(4-methylamino-3-fluorophenyl)-1,3-benzothiazol-6-ol", + "2 D-lactate", + "phosphorylated Gsy2 protein", + "unfolded RNase", + "5-(aminomethyl)-3-furanmethanol phosphate", + "Pro-interleukin-1beta", + "Mid1p", + "[protein]-N6-(O3-phosphono-D-psicosyl)-L-lysine", + "L-Ornithine", + "2-thiouridine34 in tRNA", + "alpha-D-Gal-(1->3)-(alpha-L-Fuc-(1->2))-beta-D-Gal-(1->3)-alpha-D GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans,octacis-undecaprenol", + "vinyl acetate", + "dihydrolipoamide", + "alpha-N-acetylneuraminyl-2,3-beta-D-galactosyl-1 3-N-acetyl-D-galactosaminyl-R", + "calpain 2", + "phosphopantetheine", + "pteridine", + "3-oxomyristoyl-[acyl-carrier protein]", + "2,5-dihydroxyphenylacetate", + "linear maltodextrin", + "pheophorbide a", + "3-hydroxy-5-methyl-thio-pent-2-en-1-yl-phosphate", + "pectin", + "curcumin-beta-D-glucuronide", + "5-methylcytosine40 in tRNAGly precursor", + "CMP-sialic acid", + "D-Glc-beta-(1->4)-Glc-alpha-1-diphospho-ditrans,octacis-undecaprenol", + "Oryzias latipes glycophosphoprotein MU-2", + "scyllo-inositol", + "CNTN2", + "2'-deoxyguanosine 5'-phosphate", + "poly(ADP-D-ribose)n", + "carboxypeptidase R", + "MyD88 adaptor-like", + "D-glucosylceramide", + "L-4-(gamma,gamma-dimethylallyl)tryptophan", + "di-trans-poly-cis-undecaprenyl diphosphate", + "4-amino-4-deoxyprephenate", + "[histone H3 phosphoprotein]", + "syringaldehyde", + "cyclic 2',3'-AMP", + "[(1->4)-alpha-D-glucosyl]n-[glycogenin]", + "N6-(1,2-dicarboxyethyl)AMP", + "pregnanolone", + "chlorophyllide d", + "N-acetyl-alpha-D-galactosaminyl-R", + "LH-beta peptic glycopeptide", + "[alphabeta-tubulin]-L-glutamate", + "L-homomethionine", + "beta-D-glucose 6-phosphate", + "3,4-dichloroaniline", + "O3-[N-acetyl-beta-D-glucosaminyl-(1->3)-N-acetyl-alpha-D galactosaminyl]-L-threonyl/L-seryl-[protein]", + "fibronectin", + "[cullin 1]-L-lysine", + "trioxilin B3", + "(1'S,5'S)-5'-hydroxyaverantin", + "beta-D-galactosyl-1,4-N-acetyl-D-glucosaminyl-R", + "5-aminosalicylic acid", + "linalool", + "(S)-3-(5-oxo-4,5-dihydro-3H-imidazol-4-yl)propanoate", + "6-hydroxytryprostatin B", + "Thr-Leu", + "[elongation factor 2]phosphate", + "furfuryl alcohol", + "(5S,6E,8Z,11Z,14Z)-5-hydroperoxyicosa-6,8,11,14-tetraenoate", + "shikimate", + "2-oxo-3-hydroxypropionate", + "(R)-methylmalonyl-CoA", + "5beta-cholestane-7alpha,12alpha-diol-3-one", + "Ndelta-hydroxy-Nomega-methyl-Nomega-nitroso-L-citrulline", + "casein kinase 1delta", + "L-asparagine-[L-asparagine-binding protein][side 1]", + "NADPH", + "glycogen phosphorylase-limit dextrin", + "[(1->4)-N-acetyl-beta-D-glucosaminyl]n", + "pro-matrix metalloproteinase-3", + "L-isoleucine", + "(+)-pulegone", + "recombinant procaspase-9", + "3,5-dihydroxyphenylacetyl-CoA", + "1-(4'-carboxyphenylazo)-4-naphthol", + "cis,cis-muconate", + "alpha-linolenoyl-CoA", + "DSSTKRGGSW", + "5-hydroxymethyluracil-mismatched double-stranded DNA", + "nocamycin E", + "sepiapterin", + "cartilage oligomeric matrix protein", + "N-octanoyl-L-homoserine lactone", + "potyvirus helper component", + "xanthommatin", + "reduced cytochrome c XoxG", + "8-vinyl protochlorophyllide a", + "(10R)-hydroxy-(8S,9S)-epoxyeicosa-(5Z,11Z,14Z)-trienoic acid", + "GMP", + "castasterone", + "alpha-tocotrienol", + "feruloyl polysaccharide", + "phospho-tyrosinyl-p190 GTPase", + "procollagen type I", + "phosphorylated inositol 1,4,5-trisphosphate receptor-I", + "4-hydroxyacetophenone", + "3-hydroxyhexanoyl-N-acetylcysteamine", + "3-sulfinopropionyl-CoA", + "2 progesterone", + "cob(III)alamin", + "[elongator tRNAMet]-cytidine34", + "N,N',N'',N'''-tetracetyl-beta-D-chitotetraose", + "4-hydroxyphenol", + "[protein-PII GlnZ]", + "8-demethyl-8-alpha-L-rhamnosyltetracenomycin C", + "5beta-cholestane-3alpha,7alpha,12alpha-triol", + "kaempferol 7-O-beta-D-glucoside", + "phosphorylated geminin", + "160 kDa fragment of brm protein", + "phosphorylated glutamate receptor subunit NR2B", + "7-hydroxyisoflavone", + "2 (2E,6E)-farnesyl diphosphate", + "(E)-sphing-4-enine", + "5'-deoxy-5'-(3-phenoxy)propyl-5'-methyl-5'-thioadenosine", + "UDP-N-acetylgalactosamine-4,6-bissulfate", + "[IkappaB protein]", + "extracellular MAP kinase kinase", + "prelamin A", + "methyl 3-(1H-indol-3yl)-2-oxopropanoate", + "[beta-catenin]-Tyr142 phosphate", + "[chicken erythrocyte histone]-N6-acetyl-L-lysine", + "2 L-arginine", + "BirA-avitag-biotin", + "menaquinone", + "Dengue virus DEN4 polyprotein", + "haloacetate", + "reduced phenazine-1-carboxylic acid", + "beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1 >4)-beta-D-GlcNAc-N-Asn-[TIMP-1]", + "N-hexanoyl-L-homoserine-1,4-lactone", + "R-CO-NH2", + "phosphorylated topoisomerase II", + "(6R)-6beta-hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide", + "4-hexadecenoyl-[acyl-carrier protein]", + "feruloyloligosaccharide cell wall fragments", + "L-Lys/out", + "acetylene dicarboxylate", + "beta-D-glucopyranosyl abscisate", + "Glc8 protein", + "9,10,18-trihydroxyoctadecanoic acid", + "amoxicillin", + "phosphorylated angiotensin receptor", + "Eph tyrosine kinase receptor EphA2", + "chondroitin sulfate E", + "D-Leu-Phg-Arg", + "olipopeptide/out", + "1,5-anhydro-D-glucitol", + "plakin", + "4-carboxymuconolactone", + "delta-tocopherol", + "mature tRNA", + "26-desgluco-avenacoside B", + "cytidine32 in tRNA", + "proteinase-activated receptor 2 N-terminus", + "1-(5-Phosphoribosyl)-5-aminoimidazole", + "guanine10 in tRNA", + "plastoquinol", + "cefotiam", + "7,8-diacetoxy-4-methylcoumarin", + "5-N-acetyl-7-O-acetyl-neuraminate", + "L-arginyl tRNAArg", + "quaternary amine/out", + "3-(2-naphthyl)alanine", + "[1,4-(N-acetyl-beta-D-glucosaminyl)]n", + "(R)-sulfolactate", + "a [Co(II) methylamine-specific corrinoid protein]", + "3 FMN", + "(2R)-2-hydroxy-4-(methylsulfanyl)butanoate", + "4 reduced acceptor", + "D-galactofuranose-[galactofuranose-binding protein][side 1]", + "5-amino-4-chloro-2-(2,3-dihydroxyphenyl)-3(2H)-pyridazinone", + "precorrin-3", + "RgpA-Hgp polyprotein", + "1,2-dihydroxy-6,6-dimethylheptane-3,4-dione", + "alpha-D-mannopyranosyl-(1,2)-alpha-D-mannopyranosyl-(1 2)-alpha-D-mannopyranosyl-(1,3)-[alpha-D-mannopyranosyl-(1 3)-[alpha-D-mannopyranosyl-(1,2)-alpha-D-mannopyranosyl-(1 6)]-alpha-D-mannopyranosyl-(1,6)]-beta-D-mannopyranosyl-(1 4)-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1 4)-2-(acetylamino)-2-deoxy-beta-D-glucopyranose", + "[aryl hydrocarbon receptor]-L-tyrosine phosphate", + "CDP-abequose", + "pelargonidin 3-O-beta-D-sambubioside", + "trans-2-enoyl-CoA", + "N6-ubiquitinyl-[Sox6 protein]-L-lysine", + "kynurenate", + "catestatin fragments", + "3-oxo-4-(trimethylamino)butyrate", + "IBV spike protein", + "beta-D-galactosyl-(1->3)-[alpha-L-fucosyl-(1->4)]-N-acetyl-beta-D glucosaminyl-R", + "Galbeta1-4Glc", + "(S)-citramalyl-CoA", + "palmitoleate", + "11-cis-retinal-[cellular retinaldehyde binding protein]", + "diethylmethylamine", + "2 monodehydroascorbate", + "truncated heparan sulfate proteoglycan", + "TRIF protein", + "phosphoethanolamine/in", + "salicylaldehyde", + "[heat-stable phosphocarrier protein]-L-histidine", + "soluble intercellular adhesion molecule 1", + "an [apolipoprotein]-S-1,2-diacyl-sn-glyceryl-L-cysteine", + "(10E,12Z)-12-[(3S)-3-methyl-3-propyloxiran-2-ylidene]dodec-10-enoic acid", + "cytosine40 in tRNA", + "Ac-FISRRLL-7-amido-4-methylcoumarin", + "3 menadione", + "cytosine38 in tRNAGly precursor", + "precursor peptide MftA-glycyl-3-amino-5-[(4-hydroxyphenyl)methyl]-4 4-dimethylpyrrolidin-2-one", + "ginsenoside C-Mc1", + "mastoparan", + "S-(L-histidin-5-yl)-L-cysteine S-oxide", + "sideretin (reduced form)", + "sulfate[side 2]", + "(Z)-3-hexen-1-yl acetate", + "cytosine40 in tRNAGly precursor", + "sandaracopimaradiene", + "[galactofuranose-binding protein][side 1]", + "alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Man-(1 >3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D Man-(1->3)]n-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-GlcNAc diphospho-ditrans,octacis-undecaprenol", + "bradykinin/in", + "lignoceroyl-CoA", + "lactoylglutathione", + "plasma prekallikrein", + "RBCS protein", + "2,3,4,5-tetrahydropyridine-2-carboxylate", + "sIL-6R fragment", + "UDP-N-acetylmuramoyl-L-Ala-D-Glu", + "[protein]-L-serine", + "R'C(R)S-S(R)CR'", + "6 D-glucose", + "eukaryotic translation initiation factor 4G I", + "glycoprotein Ibalpha", + "methyl 4-tolyl sulfoxide", + "monoselenophosphate", + "(R)-exo-5-hydroxycamphor", + "phospho-[DNA-directed RNA polymerase II]", + "2,4-diacetamido-2,4,6-trideoxy-beta-L-altropyranose", + "3-methylbenzaldehyde", + "pyrazine 2,5-dicarboxylic acid", + "caspase 9", + "protein D-aspartate", + "MEK5", + "12-hydroxy-12-oxojasmonoyl-L-isoleucine", + "cis-11-hexadecenal", + "isobutanoate", + "alpha-isopropylmalate", + "cefoperazone", + "(3R)-3-hydroxyacyl-CoA", + "glycoprotein alpha-D-galactosyl-1,3-[alpha-L-fucosyl-1,2]-D-galactose", + "frusemide beta-D-glucuronoside", + "3-bromopropanol", + "reduced ferredoxin [iron-sulfur] cluster", + "chemokine CXCL8", + "phosphorylated microsomal polypeptides", + "phospho-tyrosinyl-Rho protein", + "1alpha,25-dihydroxyvitamin D", + "aerolysin/out", + "5-amino-1-(5-phospho-D-ribosyl)imidazole", + "1,2-diacyl-lysophosphatidic acid", + "[p57Kip2]-L-tyrosine phosphate", + "3-oxohexanoyl-N-acetylcysteamine", + "allopurinol", + "[splicing factor SF3B2]-L-arginine", + "leucovorin/out", + "hopanol", + "fatty acyl-CoA", + "9S rRNA", + "typhasterol", + "cis-1,2-dichloroepoxyethane", + "2 thymine residues (in DNA)", + "ecgonine methyl ester", + "7,8-dihydroneopterin triphosphate", + "low-density lipoprotein receptor-related protein 4", + "4-hydroxy-2',3,5-trichlorobiphenyl", + "(7R)-7-aminocephalosporanate", + "11alpha-hydroxyprogesterone", + "beta-muricholate 3-sulfate", + "gastrin-releasing peptide", + "alpha-D-mannosyl-(1->3)-alpha-D-mannosyl-(1->3)-alpha-D-mannosyl-(1->3) N-acetyl-alpha-D-glucosaminyl-diphospho-ditrans,octacis-undecaprenol", + "phospho-rapamycin", + "alpha-dystroglycan", + "L-arabinopyranose", + "vestitone", + "9 malonyl-CoA", + "uridine-5'-diphosphate", + "(+)-eremophilene", + "phosphorylated autoinducer-2", + "C20:1-ceramide", + "amyloid alpha-peptide", + "5'-phosphoguanylyl(3'-5')guanosine", + "monoacylglycerol", + "Sec2p", + "(5Z,8Z,11Z)-14,15-dihydroxyeicosa-5,8,11-trienoic acid", + "25 kDa synaptosome-associated protein", + "allantoic acid", + "(2E,6E)-farnesyl-diphosphate", + "15-hydroxyprostaglandin", + "Ac-QKSIAVGRTLK", + "magnesium protoporphyrin IX", + "phosphatidylinositol 3,5-bisphosphate", + "2-(hydroxymethyl)-3-(acetamidomethylene)succinate", + "[FHA-1]-serine/threonine phosphate", + "N-acetyl-D-galactosaminyl-(1->4)-beta-D-glucuronyl-(1->3)-beta-D galactosylproteoglycan", + "carboxybiotin-carboxyl-carrier protein", + "methotrexate", + "eburicol", + "N1-methylguanine9 in tRNAArg", + "N,N-dimethylcasein", + "asialo-erythropoietin", + "deoxynucleoside monophosphate", + "(R,Z)-2-(2-carboxy-4-methylthiazol-5(2H)-ylidene)ethyl phosphate", + "2-amino-5-formylamino-6-ribosylamino-4(3H)-pyrimidinone 5'-phosphate", + "(+)-perillyl alcohol", + "peripheral virion attachment protein GP1", + "ethanolamine phosphate", + "indole-3-acetate", + "alkylamine", + "prepilin PilE1 leader peptide", + "11-O-demethyl-17-O-deacetylvindoline", + "4-hydroxynon-2-enoate", + "oxytoxin", + "phosphotyrosinyl-Akt", + "hygromycin", + "an L-amino acid", + "[cysteine desulfurase]-S-sulfanyl-L-cysteine", + "carboxymethyluridine34 in tRNA", + "(5Z,9alpha,11alpha,13E,15S)-9,11-epidioxy-15-hydroxy-prosta-5 13-dienoate", + "N-(3-oxododecanoyl)-homoserine lactone", + "small acid-soluble protein beta", + "4-hydroxynon-2-enal", + "(1R,2S,4S)-limonene-1,2-epoxide", + "phospho-L-tyrosinyl Yes", + "1,4-diguanidinobutane", + "2-formylglutarate", + "Quinoline", + "fibrinopeptide A", + "N(pdN)7", + "N2,6-disulfo-D-glucosamine", + "n-caprinoate", + "S-methyl-1-thio-D-ribulose 5-phosphate", + "4-methyl-muconolactone", + "citryl-L-2,3-diaminopropionic acid", + "N-acetyldemethylphosphinothricin", + "5-diphospho-1D-myo-inositol-pentakisphosphate", + "estradiol-3-beta-D-glucuronoside", + "protease activated receptor 3 zymogen H2O", + "26-deglucoavenacoside B", + "[isocitrate dehydrogenase 2]-N6-acetyl-L-lysine", + "oxamyl", + "an octanoyl-[acyl-carrier protein]", + "soluble vasorin", + "PDE5A phosphoprotein", + "cis-3-hydroxypipecolate", + "(3S)-3-hydroxyacyl-CoA", + "myo-inositol 5-phosphate", + "ADP-ribosyl-[dinitrogen reductase]", + "TDP-6-deoxy-L-talose", + "1-(4-bromophenyl)ethanol", + "phosphorylated BES1", + "aclacinomycin Y", + "T cell antigen receptor zeta", + "N-3-oxo-octanoyl-L-homoserine", + "Raf-1 protein", + "N4-[N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl-(1->3)-[N acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl-(1->6)]-beta-D mannosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-beta-D glucosaminyl]asparagine", + "deamino-NADH", + "1,5-anhydro-D-fructose", + "precorrin-3B", + "phosphorylated TRIM39R", + "4-hydroxynonenal", + "8alpha-hydroxypolypoda-13,17,21-triene", + "Cyanate", + "N1-methylguanine745 in 23S rRNA", + "5-(3-carboxy-3-oxopropenyl)-4,6-dihydroxypyridine-2-carboxylate", + "a [DsbA protein] with reduced L-cysteine residues", + "cis-1,2-dihydrobenzene-1,2-diol", + "thiamine phosphate", + "phosphorylated MEF-2A", + "isopimara-7,15-diene", + "N6-methyladenine-43 in U6 snRNA", + "ubiquitin carboxyl-terminal hydrolase L1", + "thiocholine", + "Nalpha,Nalpha,Nalpha-trimethyl-L-histidine", + "(7R,8S)-diaminopelargonic acid", + "(6S)-6beta-hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide phosphate", + "Tryptophan", + "[protein]-S-methyl-L-cysteine", + "D-ribose-5-phosphate", + "alpha-D-glucose-1-phosphate", + "N-3-oxo-dodecanoyl-L-homoserine lactone", + "phosphorylated ribosomal protein S6", + "(1S,4E,8E,12E)-2,2,5,9,13-pentamethylcyclopentadeca-4,8,12-trien-1-ol", + "N-acetyl-D-mannosamine 6-phosphate", + "[SoxY protein]-S-(2-sulfodisulfanyl)-L-cysteine", + "glycine betaine", + "DL-alanine", + "acetylhistone H", + "sulforaphane", + "phosphorylated AMP-activated protein kinase", + "(carboxymethyl)cellulose with endohydrolysed (1->4)-beta-D-glucosidic linkages", + "sarafotoxin 6b", + "(8E,10S,12Z,15Z)-10-hydroperoxyoctadeca-8,12,15-trienoate", + "5-methyluracil1939 in 23S rRNA", + "von Willebrand factor fragments", + "[(beta-D-Fruf-(2-1))n]-alpha-D-Glup", + "gibberellin A3", + "phosphorylated CLASP", + "(S)-2,3,4,5-tetrahydropyridine-2-carboxylate", + "L-arginyl-tRNAArg", + "3-beta-D-galactosyl-1,2-diacyl-sn-glycerol", + "cytosine8 in tRNA", + "4-hydroxy-hexano-6-lactone", + "lysophosphocholine", + "[histone H2B]-L-lysine15", + "peptide Ntau-methyl-L-histidine", + "a dimycocerosyl phthiodiolone", + "1,3-dibromopropane", + "3 [reduced NADPH-hemoprotein reductase]", + "2,5-dihydroxybenzoate", + "phosphorylated TRPM4 protein", + "dehypoxanthinyl futalosine", + "pyroglutamate", + "2 1,2-benzoquinone", + "N-acetyl-D-muramate", + "phosphorylated Rom2", + "3'-C-ethynyluridine 5'-phosphate", + "Arabidopsis starch", + "L-threonate", + "[RIG-I]-L-lysine", + "2'-O-methyluridine44 in tRNASer", + "1,11-dichloroarcyriaflavin A", + "selina-4(15),7(11)-diene", + "dihydroxyeicosatrienoic acid", + "3-(imidazol-4-yl)-2-oxopropyl phosphate", + "3-(5-oxo-4,5-dihydro-3H-imidazol-4-yl)propanoate", + "netrin receptor UNC5C", + "cefazolin", + "FMNH2", + "D-methionine-[methionine-binding protein][side 1]", + "[S-adenosylhomocysteine hydrolase]-serine/threonine", + "2,3,4,5-tetrahydrodipicolinate", + "chitin powder", + "WRKY1", + "N-montanoylsphingosine", + "N4-bis(aminopropyl)spermidine", + "beta-carotene", + "N-terminal extension peptide", + "sulfoacetyl-CoA", + "phosphorylated histone deacetylase 3", + "1-D-myo-inosityl-2-amino-2-deoxy-alpha-D-glucopyranoside", + "alpha-aminoadipate delta-semialdehyde", + "4,4'-diapolycopen-4-al", + "caffealdehyde", + "2 ubiquinol-10", + "(2R)-2-[(R)-carboxy([(2S)-2-[(4-ethyl-2 3-dioxopiperazine-1-carbonyl)amino]-2-(4 hydroxyphenyl)acetyl]amino)methyl]-5-([(1-methyl-1H-tetrazol-5 yl)sulfanyl]methyl)-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid", + "(S)-2-ureidoglycine", + "N6-dimethylallyladenine37 in tRNA", + "(9R,10E,12Z,15Z)-9-hydroperoxy-10,12,15-octadecatrienoate", + "2-chloropropionamide", + "9alpha-hydroxyandrosta-1,4-diene-3,17-dione", + "TDP-glucose", + "a thiopurine", + "(1'S)-averantin", + "Antithrombin III", + "7-dehydrodesmosterol", + "urea", + "diadenosine 5',5''-P1,P5-pentaposphate", + "peptide-L-methionine-(R)-S-oxide", + "cycloartenol", + "(2R,4S)-2,4-diaminopentanoate", + "iminosuccinate", + "a [Co(I) methanol-specific corrinoid protein]", + "ergosta-5,7,22,24(241)-tetraen-3beta-ol", + "UDP-N-acetyl-D-mannosaminuronic acid", + "norbaeocystin", + "stigmasterol 3-beta-D-glucoside", + "Cre-responsive element modulator", + "[amino group carrier protein LysW]-gamma-aminoadipic semialdehyde", + "[EmbR]-serine/threonine", + "2-methyl-alpha-phenylmalonate", + "retinoic acid", + "methyl beta-D-xylopyranoside 2-deoxy-2-fluoro-3,4-di-O-acetate", + "Fibronectin", + "beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosaminylglycopeptide", + "3,4-dihydroxycyclohexa-1,5-dienecarboxylate", + "3'-C-ethynylcytidine 5'-diphosphate", + "acid trehalase D-aspartate methyl ester", + "3-hydroxypalmitoyl-CoA", + "human alpha2-antiplasmin", + "MAPK", + "eIF5A-Nepsilon-(4-aminobutyl)lysine", + "6-carboxyhex-2-enoyl-CoA", + "Whi5 G1 protein", + "[a protein]-tyrosine phosphate", + "propionyl CoA carboxylase", + "di-trans,poly-cis tetracosaprenyl diphosphate", + "PDGFRbeta", + "2-acetyloxy-2-methylphenylacetonitrile", + "D-Ribulose 5-phosphate", + "L-threonine-[protein]", + "guaia-4,6-diene", + "rifamycin O", + "n L-glutamate", + "cis-4-hydroxy-D-proline betaine", + "[L-glutamate:ammonia ligase (ADP-forming)]", + "kappa-neocarrabiose", + "N-acetyl-D-tryptophan", + "1D-myo-inositol 1-diphosphate pentakisphosphate", + "[Lck]-L-cysteine", + "N-acetyl-D-galactosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-N-acetyl beta-D-galactosaminyl-proteoglycan", + "propanol", + "FkpA", + "cholest-5-ene-3beta,27-diol", + "caspase-3", + "thromboxane B2/in", + "(2E,4E,6E)-4-methylocta-2,4,6-trienedial", + "tetradecanoic acid", + "[myosin-heavy-chain]phosphate", + "filamin C", + "3-acetyl-3-devinylchlorophyllide a", + "syringate", + "pyrrole-2-carboxylate", + "precorrin-6B", + "isopropyl beta-D-1-thiogalactopyranoside[side 1]", + "beta2 subunit of voltage-gated sodium channel", + "alkyl ether plasmanylethanolamine", + "growth factor alpha", + "acetohydroxamate", + "oxidized Photinus luciferin", + "interferon regulatory factor 7", + "7 dNTP", + "corrinoid protein", + "tRNASer", + "(4-amino-2-methylpyrimidin-5-yl)methyl phosphate", + "4,21-dehydrogeissoschizine", + "tRNA precursor", + "Basement membranes surrounding capillaries", + "trans-1,2-dichloroepoxyethane", + "2-hydroxypalmitic acid", + "N-terminal N,N,N-trimethyl-L-alanyl-L-prolyl-L-lysyl-[protein]", + "L-Ala", + "D-glucuronate", + "malonyl-[acyl-carrier protein]", + "Gal-beta-(1-3)-GlcNAc-beta-(1-3)-Gal-beta-(1-4)-Glc", + "N2-dimethylguanine26/guanine27 in tRNA", + "germacra-1(10),4,11(13)-trien-12-oate", + "[WntWg]-O-(9Z)-hexadec-9-enoyl-L-serine", + "N-terminal L-aspartyl-[protein]", + "[(1-4)-alpha-D-glucosyl]n+1", + "hexadecadienoyl-[glycerolipid]", + "2,4-dihydroxy-6-pentylbenzoate", + "2',3'-cyclic AMP", + "N-acetyl-D-glucosaminyl-1,3-beta-D-galactosyl-1 4-beta-D-glucosylceramide", + "IGF-I receptor", + "RGS4 protein", + "5-methylthio-alpha-D-ribose 1-phosphate", + "a [methyl-Co(III) methylamine-specific corrinoid protein]", + "amorpha-4,11-diene", + "3-oxododecanoyl-[acyl carrier protein]", + "Gal-beta-(1-4)[Fuc-alpha-(1-3)]-Glc", + "3'-end 3'-dAMP-labeled alpha-anomeric 2'-deoxyadenosine-thymidine duplex", + "phenylethanal", + "cob(I)yrinic acid a,c-diamide", + "[histone H3R8]-L-arginine", + "Ni2+/out", + "[protein]-3-O-(N-acetyl-beta-D-glucosaminyl)-L-threonine", + "enzyme-S-sulfanylcysteine", + "(2S)-2-[(3-carboxypropanoyl)amino]-6-oxoheptanedioic acid", + "all-trans-geranylfarnesyl diphosphate", + "7-(5-oxoadipoamido)cephalosporanic acid", + "phosphorylated septin 3", + "2-chloro-1-phenylethanol", + "[TSH receptor]phosphate", + "lactose/in", + "Phosphatidyl-L-serine", + "tRNAGln(UUG)", + "Abeta1-16", + "[amyloid-beta]-L-glutamine", + "L-pyrrolysyl-tRNAPyl", + "linear maltodextrins", + "lauroyl-CoA[side 1]", + "oat straw", + "iota-carratetraose", + "2 L-glutamine", + "fibromodulin", + "phosphorylated MKK3", + "prenylated FMNH2", + "N1-acetylspermine", + "collagen fiber", + "acceptor", + "thiamine monophosphate", + "D-alpha-Amino-epsilon-caprolactam", + "membrane type-1 matrix metalloproteinase proenzyme", + "MoO2(OH)Dtpp-mP", + "Nomega-[(2'-phospho-ADP)-D-ribosyl]-histone-L-arginine", + "P1,P4-bis(5'-guanosyl)tetraphosphate", + "monovinyl chlorophyllide a", + "oxidosqualene", + "(1R,2S)-1,2-Dihydroxy-3,5-cyclohexadiene-1,4-dicarboxylate", + "ergosta-5,7,22-trien-3beta-ol", + "[PrkD]-serine/threonine", + "(Z)-2-methylaconitate", + "2-hydroxy-5-methyl-1-naphthoate", + "O-beta-D-galactopyranosyl-(1,4)-O-beta-D-glucopyranosyl-(1 2)-beta-D-fructofuranoside", + "N,N'-diacetylchitobiose 6'-phosphate[side 2]", + "tRNA pseudouridine31", + "PER2 protein", + "SulA", + "(Z)-5-oxohex-2-enedioate", + "(7R)-7-(4-carboxybutanamido)cephalosporanate", + "epsilon-carotene", + "4-nitrophenyl-3-ketovalidamine", + "[BalhA1]-(1S,4R)-2-(C-substituted-aminomethyl)-4-acyl-2-thiazoline", + "D-mannobiose", + "ZntR", + "S-geranylgeranyl-Rab protein", + "(R)-laudanine", + "complement component iC3b", + "[SP-STK]-serine/threonine", + "gingerol", + "callose", + "reduced bovine heart cytochrome c", + "prosequence of urokinase", + "des-Arg-bradykinin", + "diheptanoyl phosphatidylcholine", + "13,14-dihydroprostaglandin F2alpha", + "4-coumaroyl-CoA", + "peptidoglycan bound to undecaprenyl diphosphate", + "a 2-(long-chain-fatty acyl)-trehalose", + "DNA lacking 4-O-methylthymine", + "plugin glutamine", + "validoxylamine A 7'-phosphate", + "phosphorylated beta1-adrenergic receptor", + "trimethylated histone H3(K9)", + "phosphorylated kinesin-like protein 2", + "[HECT-type E3 ubiquitin transferase]-L-cysteine", + "(5S,8R)-dihydroxylinoleic acid", + "U1-70kD", + "phenyl acetate", + "[DNA ligase]-L-lysine", + "protocadherin 7", + "[MAP2 protein]-serine/threonine", + "protoheme", + "1-aminopentane", + "N-acetylated beta-(1->6)-N-acetylglucosamine polymer", + "3-oxo-tetronate 4-phosphate", + "vesicle associated membrane protein 1", + "indole-3-acetic-acid", + "phosphorylated TRAP protein", + "glycolithocholate", + "1-stearoyl-2-acyl-[glycerolipid]", + "phosphorylated synGAP", + "7-O-(beta-D-glucosyl)-apigenin", + "trans-urocanic acid", + "5-hydroxy-1,4-naphthoquinone", + "(S)-2-amino-3-(3-hydroxy-4-oxo-4H-pyridin-1-yl)propanoate", + "(6E)-8-oxolinalool", + "N-hexanoyl-L-homoserine lactone", + "demethylated lysine residues", + "2-oxo-3-hydroxybutyric acid", + "(R)-prunasin", + "2,6-dihydroxybenzoate", + "(S)-nandinine", + "luteothin", + "pro-tissue necrosis factor", + "cytidine", + "2-hydroxycyclohexan-1-one", + "5-methyltetrahydrosarcinapterin", + "1-tetralone", + "4-methoxybenzoate", + "cytosine48 in tRNAAspGTC", + "luciferyl sulfate", + "complement component C1s", + "(S)-mandelonitrile", + "Nomega-phospho-L-Arg", + "pregnenolone 3-sulfate", + "a G protein-coupled receptor", + "dihydrotestosterone 17-O-beta-D-glucuronoside", + "3-deacetyl-3-vinyl-bacteriochlorophyllide a", + "phenoxyacetic acid", + "2-oxocaprylate", + "Cbp1", + "ITP", + "interleukin 1 receptor", + "reduced atovaquone", + "phosphorylated PER2 protein", + "dolichyl D-mannosyl phosphate", + "[elongation factor 2alpha]-serine/threonine phosphate", + "acidic polypeptide tyrosine-O-sulfate", + "Leu-Phe", + "1-phosphatidyl-1D-myo-inositol 5-phosphate", + "isobutyronitrile", + "Moloney murine leukemia virus Env precursor protein", + "1,3,4,6-tetrachloro-1,4-cyclohexadiene", + "MEK2", + "all-trans-retinyl acylamide", + "superoxide", + "L-Leu-7-amido-4-methylcoumarin", + "(9Z,12Z,15Z)-octadeca-9,12,15-trien-6-ynoyl-[glycerolipid]", + "10,16-dihydroxyhexadecanoic acid", + "methylglyoxylate", + "strictosidine", + "testis-specific serine-threonine kinase 3", + "a protein", + "NRCAM", + "phosphorylated histone deacetylase 4", + "VicR N-phospho-L-histidine", + "hypoxia-inducible factor-(4R)-4-hydroxy-L-proline", + "3'-leader of tRNA", + "8-oxo-dGMP", + "angiotensin-(1-9)", + "Nomega-(ADP-D-ribosyl)-MazF-L-arginine", + "N-acetyl-beta-D-glucosaminyl-1,3-beta-D-galactosyl-1 3-(N-acetyl-D-glucosaminyl-1,6)-N-acetyl-D-galactosaminyl-R", + "N1,N8-bis(sinapoyl)-spermidine", + "nitrate[side 2]", + "S-(1H-pyrrole-2-carbonyl)-[peptidyl-carrier protein PigG]", + "4 AH2", + "Fe(II)[side 2]", + "S-bis-lactoyltrypanothione", + "maleamate", + "1-arachidonoylglycerol", + "camptothecin-11", + "CDPcholine", + "flavonol 3-O-glycoside", + "pro-interleukin-6 receptor", + "mature snoRNA", + "cysteine desulfurase", + "a RNA 3'-phosphate", + "4 NAD+", + "2'-hydroxybiphenyl-2-sulfinate", + "thymine", + "(S)-2-amino-6-oxohexanoate", + "1,8-diazacyclotetradecane-2,9-dione", + "xyloglucan oligosaccharides", + "8-hydroxy-warfarin beta-D-glucuronoside", + "tRNA containing ribothymidine at position 54", + "2-(4-chlorophenyl)-5-(2-furyl)-4-oxazoleacetic acid", + "cobalt-precorrin-8X", + "alpha-synuclein", + "pro-matrix metalloproteinase-9", + "1,2-dihydrovomilenine", + "[protein]-N6-D-fructosyl-L-lysine", + "lactate dehydrogenase subunit A mRNA", + "5-L-glutamyl amino acid", + "pro-peptide of growth hormone-releasing hormone", + "2-oxopent-4-enoate", + "thiazolidine-2-carboxylic acid", + "calcium-sensing receptor", + "N-acetyl-PNPQLPF", + "6F-alpha-galactosylsucrose", + "2-[(3S)-3-amino-3-carboxypropyl]-L-histidine699-[translation elongation factor 2]", + "2,3-bis-O-(phytanyl)-sn-glycero-1-phospho-L-serine", + "vesicle associated membrane protein-2", + "N-terminal-histone 2B", + "pseuodomonoyl A-CoA", + "16-hydroxypalmitic acid", + "2-amino-2H-phenoxazin-3-one-1,9-dicarboxylic acid", + "oligopeptide/in", + "2-methylisocitrate", + "L-tyrosinal", + "dTDP-glucose", + "thermoplasmaquinol", + "NDP-alpha-D-glucose", + "23-oxo-24,25,26,27-tetranor-1alpha-hydroxyvitamin D3", + "(R)-lipoate", + "glycogen synthase kinase 3beta", + "phosphorylated PDEgamma", + "Ser-Leu", + "guanine/in", + "heparin-glucosamine", + "3-oxo-octanoyl-[acyl-carrier protein]", + "elemental sulfur", + "proteinase-activated receptor 1E", + "1,3-bisphosphoglycerate", + "[cullin 2]-L-lysine", + "5,5'-diferulate", + "a mycothiol S-conjugate", + "all-trans-retinol-[cellular-retinol-binding-protein]", + "flavonol 3-O-D-xylosylglycoside", + "phosphorylated PACSIN protein", + "(3RS)3-(1-hydroxyethyl)-8-propyl-12-ethyl-bacteriochlorophyllide d", + "1,2-Dehydroreticuline", + "3-hydroxyanthranilic acid", + "(R)-phenylacetylcarbinol", + "dimethylsulfide", + "6 dimethylallyl diphosphate", + "Erythro-3-hydroxyaspartate", + "tert-butanol", + "Rvs167 protein", + "4,8-dimethylnonanoate", + "NuMA", + "PodJ protein", + "N-([4-[([[(11S,11aS)-11-hydroxy-7,8-dimethoxy-5-oxo-2,3,11 11a-tetrahydro-1H-pyrrolo[2,1-c][1 4]benzodiazepin-10(5H)-yl]carbonyl]oxy)methyl]phenyl]carbamoyl)-L glutamic acid", + "(4S)-ectoine", + "GalNAcbeta(1-4)(NeuAcalpha(2-3))Galbeta(1-4)Glc", + "6-methylthiopurine", + "[protein HPr]-L-histidine", + "phosphorylated S opsin", + "dopamine and cAMP-regulated phosphoprotein", + "dichloromethane", + "2-methoxy-6-(all-trans-hexaprenyl)-1,4-benzoquinol", + "5-methylcytosine72 in tRNAThr", + "3,4-Dihydroxybenzoate", + "pro-hepatic growth factor", + "[fructose 1,6-bisphosphate aldolase]-N6,N6,N6-trimethyl-L-lysine", + "serum response factor", + "3-chlorobenzamide", + "all-trans-beta-carotene", + "L-lysyl-tRNALys", + "Fuc-alpha-(1-4)-GlcNAc", + "K+/out", + "phosphorylated p130 Crk-associated substrate", + "epsilon-N-methyl groups in protein-bound methyllysine residues", + "pro-peptides of islet amyloid polypeptide", + "L-tyrosine[side 2]", + "hexose", + "GlcAbeta1-3GalNAc(4,6-O-disulfate)", + "[HBsu]-N6-acetyl-L-lysine", + "N-Formyl-Met", + "glutathione S-conjugates/vacuole", + "[c-Cbl]-L-tyrosine", + "(-)-5'-demethoxyyatein", + "4-amino-2-methyl-5-diphosphomethylpyrimidine", + "3alpha,12alpha-dihydroxy-7-oxo-5beta-cholanate", + "4-coumaryl acetate", + "deacetoxycephalosporin C", + "5-methylcytosine50 in tRNA", + "phosphorylated GRK2 protein", + "theophylline", + "cytosine15 in vtRNA1.3", + "dynorphin A(1-8)", + "L-fucose-1-phosphate", + "fibrinogen", + "cytosine48 in tRNAPro(CGG)", + "D-Glc-beta-(1->4)-Glc-alpha-1-diphosphopolyprenol", + "(2S,3S)-2-methylcitrate", + "reduced FMN", + "microtubule associated protein 1B", + "dimethyl thiophosphate", + "a very-long-chain trans-2,3-dehydroacyl-CoA", + "dimethyl phosphate", + "aromatic aldehyde", + "(R)-3,3-dimethylmalate", + "N-acetyl-D-glucosaminyllipopolysaccharide", + "2,3-bis-O-phytanyl-sn-glycerol 1-phosphate", + "lacto-N-biose I", + "(2S)-ethylmalonyl-CoA", + "sulindac", + "nuclear inclusion protein a", + "[acetylated histone H3 protein]", + "2,3-dihydroxy-3-methylbutanoate", + "Fe3+-enterobactin complex-[enterobactin-binding protein][side 1]", + "Glyoxylate", + "1-O-alkyl-sn-glycero-3-phosphoric acid", + "(+)-(1R,2R)-1,2-diphenylethane-1,2-diol", + "ferrocytochrome c", + "(ribitol phosphate)n+1", + "1-O-vanilloyl-beta-D-glucose", + "beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminyl-R", + "[protein]-tyrosine phosphate", + "[asialoglycoprotein]-(O-3-(alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-alpha D-GalNAc-(1->)))-L-threonine", + "hexan-2-one", + "dolichyl phosphosulfoheptasaccharide", + "processed insulin-like peptide 3", + "5alpha-androstane-3,17-diol", + "Crem protein", + "beta-actin Ntau-methyl-L-histidine73", + "N-[(E,E)-piperoyl]-piperidine", + "YPRPIHPA", + "SNAP25", + "5-bromo-thymine", + "2-phenyl-1,3-benzothiazol-6-ol", + "2 Fd2-", + "[F-actin]-L-methionine", + "hesperetin", + "2-methyl-6-phytylplastoquinone", + "ditrans,octacis-undecaprenyl phosphate", + "a menaquinone", + "phenylglyoxylyl-CoA", + "feruloylagmatine", + "TACI", + "protein Pir2/hsp150", + "2 ferricytochrome", + "erythro-9,10-phosphonooxy-hydroxy-octadecanoic acid", + "digalacturonate", + "luteolin", + "thiobenzamide", + "activated papin-like cysteine proteinases", + "coenzyme B12", + "(2R)-hydroxy-(4-hydroxyphenyl)acetonitrile", + "[protein]-L-glutamine", + "3,4-dihydroxybenzoate", + "4-O-beta-D-galactopyranosyl-D-glucopyranoside", + "strictosidine aglycone", + "semenogelin I", + "O-phospho-L-seryl-tRNACys", + "O-phospho-L-seryl-[protein]", + "L-Arg-tRNAArg", + "secretory leucocyte protease inhibitor", + "[protein with EGF-like domain]-3-O-[alpha-D-xylosyl-(1->3)-alpha-D-xylosyl-(1->3)-beta-D glucosyl]-L-serine", + "lysophosphatidylcholine", + "ribonucleic acid", + "4-methylnitrosamino-1-(3-pyridyl)-1-butanone", + "palmitoylethanolamide", + "methyl beta-D-xylopyranoside 3 deoxy-3-fluoro-2,4-di-O-acetate", + "hypoxia-inducible factor 1alpha-trans-4-hydroxy-L-proline", + "5-methyl-dCTP", + "4-amino-5-diphosphomethyl-2-methylpyrimidine", + "retinoate", + "D-galactofuranosyl-(1->5)-beta-D-galactofuranosyl-(1->6)-beta-D galactofuranosyl-(1->5)-beta-D-galactofuranosyl-(1->6)-beta-D galactofuranose", + "N-arachidonoyl-phosphatidylethanolamine", + "[CmaA-protein-T-domain]-4'-phosphopantetheine", + "2-hydroxyeriodictyol", + "8-demethyl-8-alpha-L-rhamnosyl-tetracenomycin C", + "2 Fe(II)-siderophore", + "apo-[propionyl-CoA:carbon-dioxide ligase (ADP-forming)]", + "[CcmG protein] with reduced L-cysteine residues", + "N-acetyl-5-methoxytryptamine", + "phosphorylated alpha7 nicotinic acetylcholine receptor", + "L-tyrosinyl-[tyrosine-binding protein][side 1]", + "6-hydroxynicotinate", + "Cdc420-cysteine", + "collagen type 1", + "CO", + "5-(dihydroxymethyl)furan-2-carboxylate", + "pro-Mch6", + "thiamine-[thiamine-binding protein][side 1]", + "p50 protein", + "2,3-dihydroxy-isovalerate", + "Manalpha(1-6)[Manalpha(1-3)]Manalpha(1-6)[Manalpha(1-3)]Manbeta(1 4)GlcNAcbeta(1-4)GlcNAc", + "[acceptor protein]-N-terminal-amino acid", + "PMS-2", + "beta-glucomannan", + "2 alpha-D-galactose", + "protein/out", + "2,6-diamino-4-hydroxy-5-formamidopyrimidine", + "vitamin B12/in", + "4-cholest-3-one", + "beta-glycan", + "Man9GlcNAc", + "L-lyxonate", + "benzimidazole", + "SATB1", + "4-(trimethylamino)butyraldehyde", + "mouse double minute 2 homolog", + "a 3-(1-hydroxyethyl) bacteriochlorophyllide a", + "(2R,3S)-2,3-dihydroxy-2,3-dihydro-p-cumate", + "N1-methylguanine37 in tRNAIleUaU", + "a jasmonoyl-L-amino acid", + "2-C-methyl-D-erythritol 4-phosphate", + "2-hydroxypent-2,4-dienoate", + "3'-phosphooligonucleotide", + "ursodeoxycholate", + "(7E,9E,11Z,14Z)-(5S,6S)-5,6-epoxyicosa-7,9,11,14-tetraenoate", + "alpha-D-galactose-1-phosphate", + "Rcp1", + "2-amino-2,3-dimethylbutyramide", + "UDP-2-acetamido-2,6-dideoxy-alpha-D-xylo-hex-4-ulose", + "beta-D-apiofuranosyl-(1-6)-beta-D-glucopyranose", + "methyl (1R,6aR)-6a-acetyl-1-(2-methoxy-2-oxoethyl)-5,5-dimethyl-1,3a,4,5,6 6a-hexahydropentalene-2-carboxylate", + "3-O-alpha-D-glucopyranosyl-D-glucose", + "(R,S)-mandelonitrile", + "(E)-but-2-enoyl-CoA", + "TIA-1", + "2-oleoyl-phosphatidylcholine", + "mature 23S rRNA", + "phosphorylated protein RyR", + "trans-stilbene oxide", + "L-glucono-1,5-lactone", + "tRNA1Thr", + "seizure 6-like protein 2", + "phosphorylated CARMA1", + "p38 phosphate", + "Fe3+-hydroxamate complex[side 2]", + "[SoxY protein]-S-sulfosulfanyl-L-cysteine", + "4-methylphenyl 5-phospho-alpha-D-ribofuranoside", + "2-chloro-9-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-9H-purin-6-amine 5'-phosphate", + "4 NADP+", + "cycloheptanone", + "columbamine", + "20-hydroxyeicosatetraenoic acid", + "deacetylvindoline", + "GlcAbeta(1-3)Galbeta(1-3)Galbeta(1-4)Xyl-1-O-Ser", + "3-phospho-D-glycerate", + "E2A-basic helix-loop-helix protein heterodimer", + "2-(R)-hydroxypropyl-CoM", + "L-glutamyl-tRNAGln", + "myo-inositol tetrakisphosphate", + "prepilin type IV", + "2'-deoxyribonucleoside triphosphate", + "transmembrane protein 132A", + "2'-deoxythymidine 5'-phosphate", + "5,6-dihydroxy-7,9,11,14-eicosatetraenoic acid", + "myosin light-chain", + "LamB", + "RNA-base-CH3", + "O-1-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine", + "3-(hydroxyphosphinoyl)pyruvate", + "isocitrate", + "5,6,7-trihydroxyflavone", + "N-acetyl-lysine-histone H4", + "benzoate", + "[protein DsbC] with reduced L-cysteine residues", + "[DNA repair factor Ku70]-N6-acetyl-L-lysine382", + "dolichyl myristate", + "promyelotic leukemia zinc finger gene", + "N-tetradecanoyl-glycylpeptide", + "GDP-valienol", + "S-farnesylcysteine methyl ester", + "5-phospho-D-ribosylamine", + "(ADP-D-ribosyl)n+1-tyrosine kinase Src", + "Leu-Xaa", + "L-glutamate 1-semialdehyde", + "flagellin", + "5-methylcytosine48 in tRNAAsp(GUC)", + "Manalpha(1->6)[Manalpha(1->3)]Manbeta(1->4)GlcNAcbeta(1->4)[L Fucalpha(1->6)]GlcNAc", + "Collagen type I", + "[E1 NEDD8-activating enzyme]-S-[NEDD8 protein]-yl-L-cysteine", + "maltotriose[side 1]", + "deacetylated rhamnogalacturonan I", + "4-N-trimethylaminobutyraldehyde", + "trans-trans-2,4-hexadienoyl-CoA", + "spinophilin", + "(ribonucleotide)n+m", + "Galbeta1-4GlcNAcbeta1-3Galbeta1-4Glc", + "pyrimidine base", + "PulG pseudopilin", + "N1-methyladenine643 in 25S rRNA", + "taurolithocholate 3-sulfate", + "[Eps15 peptide]-tyrosine", + "cspA mRNA", + "[p53 protein]-L-lysine382", + "CoM-S-S-CoB", + "gitoroside", + "verapamil/out", + "N2-dimethylguanine26 in prolongator tRNAMet", + "(31R)-(1-hydroxyethyl)-8,12-diethyl-bacteriochlorophyllide d", + "phosphorylated merlin", + "S-ribosyl-L-homocysteine", + "Notch S2", + "oxalosuccinate", + "uridine2552 in 23S rRNA", + "mycinamicin VI", + "[STAT3]-L-lysine", + "L-aspartyl-tRNAAsn", + "N-acetylneuraminic acid-alpha-2,6-lactose", + "Fe2+/in", + "[AMPKalpha2]-L-lysine48", + "6-tuliposide A", + "thymidine diphosphate", + "9-riburonosyladenine", + "2 H+", + "a flavanone", + "testicular meiosis-activating sterol", + "[smooth muscle myosin light chain kinase] phosphate", + "nigeran", + "inositol (1,4,5,6)-tetrakisphosphate", + "alpha-apo-10'-carotenal", + "(5-L-glutamyl)-peptide", + "(R)-2-hydroxyglutarate", + "CMP-5,7-bis(acetylamino)-3,5,7 9-tetradeoxy-L-glycero-alpha-L-manno-2-nonulopyranosonic acid", + "poly-N-acetyllactosaminoglycan", + "8-epi-cedrol", + "myelin basic protein-L-arginine", + "precursor tRNA", + "maltose-[maltose-binding protein][side 1]", + "Manalpha(1-2)Manalpha(1-2)Manalpha(1-3)[Manbeta(1-6)]ManbetaGlcNAc-beta GlcNAc", + "4-nitrobenzaldehyde", + "D-Ser", + "phosphocasein", + "N-acyl-D-amino acid", + "laminaribiose", + "epidermal growth factor-like protein with beta-D-xylosylserine", + "3-[(beta-D-glucopyranurnosyl)oxy]-flavone", + "[PpaC]-serine/threonine", + "laminin-5", + "6-thiouric acid", + "cellulosepolysulfate", + "O-alkylglycerone phosphate", + "2-(4-fluorophenyl)-1,3-benzothiazol-6-ol", + "an alkansulfonate", + "cefepime", + "phosphorylated PLN", + "L-histidinal", + "benzyl 6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranoside", + "12 phosphate", + "ethanal", + "(2S)-(2-chlorophenyl)(6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)ethanoic acid", + "cholestanol-7alpha,8alpha-epoxide", + "cytosine49 in tRNAPro(AGG)", + "5-methylcytosine48 in tRNAPhe(GAA)", + "1-tuliposide A", + "a glycoprotein with the oligosaccharide chain attached by N-beta-D-glycosyl linkage to a protein L-asparagine", + "isopentenyl phosphate", + "2,4-divinyl chlorophyllide a", + "phosphorylated MAPK", + "D-Methionine", + "matrix metalloproteinase-13", + "(R)-mevalonate", + "[formate C-acetyltransferase]-glycine", + "7beta-hydroxy-3-keto-5beta-cholanoic acid", + "3-amino-4-hydroxybenzoic acid", + "7-chloro-(4S)-tetracycline", + "N-acetyl-beta-D-glucosaminyl-1,3-N-acetyl-alpha-D-galactosaminyl-R", + "(3S)-2-dihydrobiochanin A", + "enol-phenylpyruvate", + "5-oxoprolyl-Abeta(3-42) peptide", + "2-deoxy-D-ribofuranose", + "cdk2", + "non-structural protein 2", + "GlcNAcMan5GlcNAc2", + "chemokine CCL13", + "reduced adrenal ferredoxin", + "N-acetyl-L-glutamate", + "6-phospho-beta-D-glucosyl-(1,6)-D-glucose", + "S-adenosylmethioninamine", + "UDPgalactose", + "serum amyloid P", + "DNA-thymine", + "proform hepatocyte growth factor", + "D-erythrulose 1-phosphate", + "luteoforol", + "1-lauroyl-rac-glycerol", + "xanthopterin", + "DNA (without 6-O-methylguanine)", + "5-methylcytosine49 in tRNAGlu(CUC)", + "thioredoxin 2 disulfide", + "N6-(dimethylallyl)adenosine 5'-triphosphate", + "a tRNA with a 3' CCA end", + "17-(4-hydroxyphenyl)heptadecanoyl-[4-hydroxyphenylalkanoate synthase]", + "alpha,alpha-trehalose 6,6'-bismycolate", + "uridine34 in tRNA", + "Gag-Pol polyprotein", + "1,2-dihydroxyoctane-3,4-dione", + "catalytic subunit of protein kinase A", + "(2S)-2-hydroxycarboxylate", + "1,3,4,6-tetrachloro-1,4,cyclohexadiene", + "citronellal", + "[P-HLP]-serine/threonine", + "1-chloro-2,4-dinitrobenzene", + "demethylphylloquinol", + "24,25-dihydroxyvitamin D3", + "4-phosphooxy-L-threonine", + "long-chain fatty acyl-CoA", + "2-hydroxyadipate", + "26-desgluco-avenacoside A", + "carbamate", + "4-methyl-5-(2-phosphooxyethyl)thiazole", + "1,6-diaminohexane", + "4-methylamino-4-de(dimethylamino)anhydrotetracycline", + "D-cellotriose", + "dichloroarcyriaflavin A", + "2'-O-methylcytidine1409 in 16S rRNA", + "pilin PilE1", + "phosphorylated splicing factor 2", + "3(3-sn-phosphatidyl)-sn-glycerol 1-phosphate", + "1-[(4-amino-2-methylpyrimidin-5-yl)methyl]pyridinium", + "2-(methylthio)ethansulfonate", + "(5Z,9E,11Z,14Z)-(8R)-8-hydroperoxyicosa-5,9,11,14-tetraenoate", + "D-erythro-1-(imidazol-4-yl)glycerol 3-phosphate", + "guanine2535 in 23S rRNA", + "assembly protein precursor of cytomegalovirus", + "N-acetyl-D-mannosamine-6-phosphate", + "matrix-capsid polyprotein", + "4-(1'-D-ribitylamino)-5-amino-2,6-dihydroxypyrimidine", + "N-acetyl-beta-D-glucosaminyl-D-glucosamine", + "L-DELTA1-pyrroline-5-carboxylate", + "neomorphine", + "L-glutaminyl-CCL2", + "follicular fluid meiosis-activating sterol", + "phospho-histone H1B", + "N-cerotoylsphinganine", + "4-(glutamylamino) butanoate", + "2,5-diamino-6-ribitylamino-4(3H)-pyrimidinone 5'-phosphate", + "surfactant protein B", + "guanine745 in 23S rRNA", + "uracil-containing single-stranded DNA", + "rhamnose", + "myo-inositol phosphate", + "alpha-D-glucosyl-poly(glycerol phosphate)", + "a monosaccharide 1-phosphate", + "bacterial cellulose", + "ipsdienol", + "dea-Arg53-epidermal growth factor", + "D-myo-inositol 1,4-bisphosphate", + "DNA (containing 6-O-methylguanine)", + "propionylthiocholine", + "L-(+)-3-hydroxybutyrate", + "(R)-2-hydroxypropionic acid", + "20 kDa fragment of brm protein", + "1,2-diacyl-3-O-(alpha-D-glucopyranosyl)-sn-glycerol", + "4,4'-disulfanediyldibutanoate", + "interferon-gamma-inducible protein-10", + "1-stearoyl-2-linoleoyl-sn-phosphatidic acid", + "Prz1", + "tryptamine", + "L-Arg", + "adenine34 in tRNAArg", + "phlorisobutyrophenone", + "(+)-2-chloropropionic acid", + "beta-N-acetylglucosaminidase", + "ephrin type-A receptor 7", + "dimethylthetin", + "Cyt-DNA", + "alpha-guaiene", + "a galactosylceramidesulfate", + "IMP", + "[beta-catenin]-L-arginine", + "phospho-tyrosinyl-STAT3", + "1,6-anhydro-N-acetyl-beta-muramate", + "adhesin EBA-175", + "penicillin dihydroF", + "enzyme-MoVI", + "2-propenoyl-CoA", + "(R)-5-diphosphomevalonate", + "4,5-dioxo-3a,4,5,6,7,8,9,9b-octahydro-1H-pyrrolo[2,3-f]quinoline-2,7 9-tricarboxylate", + "an N-terminal-L-methionyl-L-tyrosinyl-[protein]", + "UDP-D-galactose", + "L-glutaminyl-Abeta3-40/42", + "docosa-4,7,10,13,16,19-hexaenoic acid", + "BclxL", + "(4Z,9Z)-octadec-4,9-dienoyl-[acyl-carrier protein]", + "4,4-dimethylcholesta-8,14,24-trien-3-ol", + "N6-methyladenine in NANOG mRNA", + "2 L-citrulline", + "maltoheptaoside", + "2-furoyl-CoA", + "(2S,3S)-3-methylaspartate", + "alpha-NMNH", + "2-O-(6-O-acyl-alpha-D-mannosyl)-6-O-alpha-D-mannosyl-1-phosphatidyl-1D myo-inositol", + "L-glutamyl-tRNAGln(CUG)", + "macrophage inflammatory protein-1 (MIP-1) alpha", + "UDP-alpha-D-GlcNAc", + "mandelate", + "2'-deoxycoformycin", + "MAPKAP-K3", + "N-Formylmethionyl oligopeptides", + "dammarenediol II", + "Flp1 prepilin", + "biliverdin-IX-delta", + "[NFkappaB subunit p56]phosphate", + "(6R)-dihydrobiopterin", + "N6-(1,2-dicarboxyethyl)-AMP", + "epiandrosterone", + "amyloid beta protein 42", + "androsta-1,4-diene-3,17-dione", + "a C21-steroid", + "3'-phosphomononucleotides", + "DELTA4-sphingenine", + "2 pyrimidine residues in DNA", + "3-hydroxy-2-oxo-propionaldehyde", + "amyloid beta-peptide(8-40)", + "5-acetylaminosalicylic acid", + "6-hydroxydopamine", + "gamma-butyrobetainyl-CoA", + "[cullin Cdc53]-L-lysine", + "phospho-L-tyrosine", + "1-archaetidyl-1D-myo-inositol 3-phosphate", + "(-)-secoisolariciresinol", + "1,2-dihydroxy-3-oxo-1-hexene", + "N6-isopentenyladenine", + "protease activated receptor 1", + "galactan", + "1-phosphatidylinositol", + "peptidyl(aminoacyl-tRNA2)", + "ertapenem", + "oligopeptide-[oligopeptide-binding protein][side 1]", + "red chlorophyll catabolite", + "aflatoxin B2", + "amyloid beta40", + "mycobilin a", + "phosphorylated MSK1", + "truncated tyrosine aminotransferase", + "avermectin", + "maltose-binding protein-avitag-biotin", + "3-hydroxy-3-methyl-2-oxobutyrate", + "ent-kaur-16-ene-19-ol", + "a 2-[omega-(methylthio)alkyl]malate", + "[PER2 protein]-N6-acetyl-L-lysine", + "5-methylthio-2,3-dioxo-pentyl phosphate", + "5-amino-2-oxopentanoic acid", + "plumieride coumarate beta-D-glucoside", + "5alpha,20alpha-tetrahydroprogesterone", + "[tau protein]-L-Thr434 phosphate", + "ryanodine receptor", + "palmitoyl-CoA", + "N-phosphotaurocyamine", + "mature apoAI", + "MKK4", + "S-glycolyltrypanothione", + "thymidine 5'-phosphate", + "receptor tyrosine kinase c-Kit", + "wogonin", + "4-bromocyclohexa-1,5-diene-1-carbonyl-CoA", + "(E)-7-((3,7-dimethylocta-2 6-dien-1-yl)oxy)-5-hydroxy-2-methoxy-3-methylnaphthalene-1,4-dione", + "maltose 6'-phosphate", + "beta-D-Gal-(1->4)-alpha-D-GlcNAc-diphospho-ditrans,octacis-undecaprenol", + "geranylgeranyl-bacteriochlorophyll a", + "caffeoyl alcohol", + "plant beta-glucan", + "(3R)-3-hydroxy-4-oxobutanoate", + "[histone H4R17]-Nomega-methyl-L-arginine", + "(6S)-tetrahydrofolate", + "(3S)-3-aminobutanoyl-CoA", + "(8R)-hydroperoxylinoleic acid", + "m7G(5')pppAmACA-[mRNA]", + "2-amino-4-hydroxypteridine", + "versiconol acetate", + "cotinine", + "Notch-1", + "1-alkenyl-2-acylglycerophosphoethanolamine", + "12-oxo-cis-phythodienoic acid", + "2 K+/in", + "2 GSH", + "a 3-oxoacyl-[acyl-carrier protein]", + "[TGF-beta receptor II]", + "24(R/S),25-epoxycholesterol", + "inositol 1,3,4,5,6-pentakisphosphate", + "[TsbR]-serine/threonine phosphate", + "beta-D-galactosyl-R", + "[2-methylbutanoate polyketide synthase]", + "mature 4.5S RNA", + "thermoplasmaquinone", + "desipramine", + "N-formimino-L-aspartic acid", + "(5R)-5,6-dihydro-5-(thymidin-7-yl)thymidine", + "seneciphylline", + "phosphate/out", + "N-eicosanoylsphingosine", + "azurin", + "beta-D-glucuronosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->4)-[nascent hyaluronan]", + "CDP-choline", + "25-hydroxy-vitamin D3", + "electron-transferring-flavoprotein", + "(-)-epigallocatechin gallate", + "root meristem growth factor 7 tyrosine-O-sulfate", + "synaptotagmin-1", + "[(R)-3-hydroxyacyl]n+1", + "Zaire Ebola virus glycoprotein", + "2,5-dioxopentanoate", + "mature apoptosis-inducing factor (62 kDa)", + "2-oxoacid", + "inositol", + "interleukin-6 receptor beta chain", + "Manalpha(1-6)(GlcNAcbeta(1-2)Manalpha(1-3))Manbeta(1-4)GlcNAcbeta(1 4)GlcNAc-1-Asn", + "L-cysteine sulfonate", + "OmpA", + "a 5'-(N7-methyl 5'-triphosphoguanosine)-[mRNA]", + "16-hydroxy-ent-kaurene", + "alpha-D-mannopyranoside", + "pentadecanal", + "interleukin IL-18", + "(R)-2-hydroxyglutaryl-CoA", + "(2E,4E)-2,4-octadienoyl-CoA", + "phosphate[side 2]", + "polyubiquitin", + "acylate", + "palmitoyladenylate cyclase toxin", + "a 6-acetyl-beta-D-galactoside", + "acylcarnitine", + "11alpha-hydroxytestosterone", + "Cell wall protein", + "5-hydroxymethyluracil", + "N-hexadecanoyl-sphingenine 1-phosphate", + "oxidized F420", + "5,7-bis(acetylamino)-3,5,7 9-tetradeoxy-L-glycero-alpha-L-manno-2-nonulopyranosonic acid", + "24,25-dihydro-4,4-dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol", + "phosphorylated Lin-1", + "3-chlorocyclohexan-1-one", + "Staphylococcus aureus cell", + "phosphorylated DNA-dependent protein kinase", + "2-(formamido)-N1-(5-phosphoribosyl)acetamidine", + "[RNA]-3'-(2',3'-cyclophospho)-ribonucleoside", + "alpha1D-adrenergic receptor", + "[Ras2p]-S-palmitoyl-L-cysteine", + "[PSD95]-L-cysteine", + "beechwood xylan", + "pantothenic acid", + "3,7,12-triketo-5beta-cholanoic acid", + "1,1-dichloro-2,2-bis(4-chlorophenyl)ethylene", + "acetyl-histone H4", + "casein N5-alkylglutamine", + "n CDP-ribitol", + "sucrose[side 1]", + "proproteinase B", + "T-cell protein tyrosine phosphatase", + "[nucleoside diphosphate kinase B]-N-phospho-L-histidine", + "Ac-SLRPAPP-CONH2", + "N4-[beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha D-Man-(1->6)]-[beta-D-Xyl-(1->2)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1 >4)-beta-D-GlcNAc]-L-asparaginyl-[protein]", + "beta-lipotropin", + "(R)-3-phosphomevalonate", + "1D-myo-inositol bisdiphosphate tetrakisphosphate", + "ubiquinone-10", + "3-Maleylpyruvate", + "N3-methylcytosine32 in tRNA1Thr", + "oxidized Oplophorus luciferin", + "5-L-glutamylamino acid", + "L-tartrate", + "cache domain containing 1", + "cytochrome c N6-methyl-L-lysine", + "ureidoacrylate", + "holo-[L-arginyl-carrier protein]", + "adenosine in double-stranded RNA", + "[Wnt3]-O-(9Z)-hexadec-9-enoyl-L-serine", + "gamma-linolenoyl-CoA", + "insulin-like growth factor binding protein-4", + "betaine aldehyde", + "malate dehydrogenase", + "2-aminomuconate 6-semialdehyde", + "5-all-trans-decaprenyl-3,4-dihydroxybenzoate", + "acyclovir", + "1-O-[O-(N-acetyl-alpha-neuraminosyl)-(2-3)-O-beta-D-galactopyranosyl-(1 4)-beta-D-glucopyranosyl]-ceramide", + "hedycaryol", + "UDP-N-acetylmuramoyl-L-Ala-D-Glu-L-Lys-D-Ala-D-Ala", + "tetradec-9,12-dienoic acid", + "2-heptyl-1-methoxyquinolin-4(1H)-one", + "polypeptide MUC13", + "3Dpro", + "Wee1A", + "glutamyl-tRNAGln", + "uroporphyrinogen III", + "[Src-family protein tyrosine kinase]-L-tyrosine phosphate", + "outer membrane protein C", + "Ac-IYISRRLL-7-amido-4-methylcoumarin", + "4-(2-aminoethyl)benzenesulfonylfluoride/in", + "apoTroA", + "bis-gamma-glutamylcystine", + "2 formic acid", + "alkylcatechol", + "9,10-syn-copalyl diphosphate", + "selenomethionine", + "cytosine48 in tRNAVal(AAC)", + "2-oxo-gamma-methylselenobutyrate", + "propeptide of urokinase plasminogen activator", + "allylglycine", + "processed mitochondrial glycerol-3-phosphate dehydrogenase", + "pteroate", + "sn-glycerol 3-phosphate", + "L-glutaminyl-CD47", + "(-)-5'-demethylyatein", + "(S)-cholest-5-ene-3beta,24S-diol", + "cyanidin 3-O-(6-O-beta-D-glucosyl-2-O-beta-D-xylosyl-beta-D-galactoside)", + "sphingosine 1-phosphate", + "7-phenol", + "reducing sugar", + "7-amino-4-methylcoumarin", + "gibberellin 110", + "oleyl phosphate", + "myristic acid", + "protein C-terminal S-farnesyl-L-cysteine", + "n-pentanol", + "KRPPGFSPFR", + "adenosine monophosphate", + "uridine2918 in 25S rRNA", + "2-chlorodeoxyadenosine", + "trans-3-chloro-2-methyldienelactone", + "1-oxa-2,5-dioxo-cycloheptane", + "factor VIII", + "butiin", + "protease activated receptor 2", + "L-arginyl-[protein disulfide isomerase]", + "liquiritigenin", + "3-enolpyruvoylanthranilate", + "SpeBz", + "3-oxo-D-isoapionate", + "milk proteins", + "dXTP", + "2-epi-valiolone", + "N-demethylindolmycin", + "pro-mCASP-7", + "3-amino-3-(4-hydroxyphenyl)propanoate", + "(ribonucleotide)n", + "4a-hydroxy-tetrahydrobiopterin", + "Co2+-[cobalt-binding protein][side 1]", + "4,5-dimethoxybenzonitrile", + "anhydrotetracycline", + "D-tagaturonate", + "selegiline N-oxide", + "5-amino-1-(5-phospho-beta-D-ribosyl)imidazole-4-carboxamide", + "glycyrrhizinic acid", + "4-epi-cubebol", + "3 A", + "guanine26 in initiator tRNAMet", + "4-methyl-1,2-benzoquinone", + "1-phosphatidyl-1D-myo-inositol 3,4,5-trisphosphate", + "[histone H3]-N6,N6,N6-trimethyl-L-lysine 26", + "(S)-beta-bisabolene", + "a very-long-chain 3-oxoacyl-CoA", + "[(1R)-2,2,3-trimethyl-5-oxocyclopent-3-enyl]acetate", + "multifunctional protein CAD", + "(2R,3S)-2-methyl-3-hydroxysuccinyl-C1-CoA", + "N-terminal-OLA1", + "guanosine18 in tRNATyr", + "Morphinone", + "delphinidin-3-O-beta-D-glucoside", + "2 (S)-methylmalonyl-CoA", + "N6-[(3R)-3-methyl-D-ornithinyl]-L-lysine", + "purine deoxyribonucleoside", + "N1-methyladenine58 in tRNA3Lys", + "17000 Da fragment", + "S-succinylglutathione", + "(S)-4-hydroxy-2-oxohexanoate", + "(3Z)-phytochromobilin", + "LQYTKR", + "an (S)-2-hydroxy carboxylate", + "3-O-methylgallate", + "bornane-2,6-dione", + "pro-caspase-2L", + "D-alpha-phenylalanine", + "D-arabinitol", + "2',3'-cyclic nucleotides", + "2-butyloctan-1-ol", + "(2-amino-4-hydroxy-7,8-dihydropteridin-6-yl)methyl diphosphate", + "trans-2-hexadecenal", + "alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid IVA", + "phosphorylated cohesin", + "asialo-GM1", + "cytosine72 in tRNAThr", + "phosphorylated adenomatous polyposis coli protein", + "phospho-granulocyte macrophage colony stimulating factor receptor", + "(S)-tetralol", + "L-menthyl-beta-D-glucoside", + "eriodicytol", + "[TruE2]-(1S,4R)-2-(C-substituted-aminomethyl)-4-acyl-2-thiazoline", + "(S)-2-[5-amino1-(5-phospho-D-ribosyl)imidazole-4-carboxamido]succinate", + "N-(3-oxohexanoyl)-L-homoserine lactone", + "[protein]-N6-(3-O-phospho-D-ribulosyl)-L-lysine", + "4-methylpentanoate", + "2-chlorodeoxyadenosine 5'-phosphate", + "amyloid beta peptide", + "hepatocyte growth factor receptor", + "vanillate", + "yeast a-factor mating pheromone C-terminal S-farnesyl-L-cysteine", + "phospho-S6K1", + "Rac-cysteine", + "cisplatin/in", + "glucose-binding protein", + "phosphorylated recombinant human Kv1.5 channel", + "dehydrocorticosterone", + "3-ketoglycyrrhetic acid", + "4-methyl-3-oxoadipyl-CoA", + "myo-inositol 1,3,4,5,6-pentakisphosphate", + "N-formiminoglutamate", + "[eukaryotic translation elongation factor 2] phosphate", + "4,5-dihydroxyphthalate", + "4,11-dicarboxy-8-hydroxy-9-methoxy-2-hydroxy-6-oxo-6-phenyl-hexa-2 4-dienoate", + "cholesta-5,24-dien-3beta-ol", + "alpha-D-glucosamine 1-phosphate", + "kunzeaol", + "histidine", + "all-trans-retinyl ester-[cellular retinol-binding protein]", + "6beta-hydroxyhyoscyamine", + "NudC", + "DNA-2-methylguanosine", + "angiotensin-(1-7)", + "IDP-glucose", + "nitrobenzene", + "5-hydroxytryptamine", + "2-acetyl-1-alkyl-6-phosphocholine", + "Notch1", + "coelenterazine disulfate", + "[Notch 2 protein with EGF-like domain]-L-serine", + "beta-D-fructofuranosyl-[(2,6)beta-D-fructofuranosyl-]n alpha-D-glucopyranoside", + "heterogeneous nuclear ribonucleoprotein K", + "(2E)-2-hydroxypenta-2,4-dienoate", + "sophoraflavanone B", + "5-hydroxymethyluridine-mismatched double-stranded DNA", + "N2-(D-1-carboxyethyl)-L-lysine", + "3-O-alpha-D-glucopyranosyl-3-O-alpha-D-glucopyranosyl-D-glucopyranose", + "Fuc-alpha-(1-2)-Gal-beta-(1-4)-[Fuc-alpha-(1-3)]-GlcNAc-beta-(1-3)-Gal beta-(1-4)-Glc", + "2-acetamido-2-deoxy-alpha-D-glucopyranosyl-(1->6)-phosphatidylinositol", + "DNA-1-methylguanine", + "peptidyl-4-carboxy L-glutamate", + "ClpX unfoldase", + "4 CO2", + "2-deoxy-D-ribosyl-base1", + "Rad9 protein", + "N-3-oxo-dodecanoyl-L-homoserine", + "mucin MUC2 polymer", + "diglucosyl-enterobactin", + "5'-phosphoribosyl-5-formamido-4-imidazole carboxamide", + "6-thiopurine", + "adenylate cyclase toxin", + "phosphorylated ERK", + "a primary alcohol", + "spermidine[side 2]", + "early mitotic inhibitor 1 phosphoprotein", + "protein-L-histidine", + "N-acetyl-beta-D-glucosaminylglycopeptide", + "epsilon-rhodomycinone", + "N-acetylneuraminyl-2,3-beta-D-galactosyl-1,4-beta-D-glucosylceramide", + "S-((3S)-3-amino-3-(3-chloro-4-hydroxyphenyl)propanoyl)-[peptidyl carrier protein SgcC2]", + "N-formyl-o-aminonitrobenzene", + "reduced 1,4-benzoquinone", + "[protein]-L-asparagine", + "an [amino group carrier protein]-C-terminal-N-(1,4-dicarboxybutan-1-yl)-L-glutamine", + "von Willebrand factor", + "[histone H3]-L-lysine", + "3 ferricytochrome c", + "N1-methyladenine645 in 25S rRNA", + "tRNA pseudouridine13", + "N-acetyl-L-glutamate 5-phosphate", + "echinenone", + "p-nitrocatechol", + "obscurin", + "7alpha-hydroxy-dehydroepiandrosterone", + "precursor of transforming growth factor beta", + "D-Glucarate", + "beta-casomorphin", + "L-gulono-1,4-lactone", + "cytosine48 in tRNASer(AGA)", + "ginsenoside C-K", + "5'-deoxy-5'-fluoroadenosine", + "LL-2,6-diaminoheptanedioate", + "trioxilin A3", + "AKT1S1", + "2 A", + "ferric dicitrate/out", + "abieta-8(14),12-diene", + "lactose", + "membrane-tethered membrane type-1 matrix metallo-proteinase", + "L-threonyl-[L-threonyl-carrier protein SyrB1]", + "valganciclovir", + "[O-GlcNAc transferase] phosphate", + "diethyl thiophosphate", + "topotecan/in", + "glycerophospho-choline", + "3 NADP+", + "amyloid beta peptide Abeta42", + "arachidonate", + "[E2 ubiquitin-conjugating enzyme cullin-5]-L-cysteine", + "2-hydroperoxyoctadecatrienoic acid", + "6-diazo-5-oxo-L-norleucine", + "GDP-D-rhamnose", + "3 D-mannose", + "homogentisate", + "2,3-dehydroacyl-CoA", + "(indol-3-yl)acetyl-L-aspartate", + "1-methoxyneurosporene", + "prostaglandin H2", + "Nomega-(ADP-D-ribosyl)-protein-L-arginine", + "palmitic acid", + "[protein phosphatase 4 catalytic subunit]-leucine", + "poly(ADP-D-ribose)", + "2'-deoxycytidine 5'-phosphate", + "soluble TGF-alpha", + "N-acetyl-D-glucosaminyl-1,6-beta-D-(N-acetylglucosaminyl-1 2-beta)-(N-acetyl-D-glucosaminyl-1,4)-beta-D-mannosyl-R", + "reduced [4Fe-4S]-ferredoxin", + "oligomers of polysialic acid", + "D-glycero-beta-D-mannoheptose 1,7-bisphosphate", + "adipyl-7-aminocephalosporanic acid", + "ubiquinol-cytochrome c reductase complex core protein 2", + "Rho GTPase-cysteine", + "Bir1p", + "2-oxo-3-deoxy-D-manno-octulosonate 8-phosphate", + "active 2-hydroxyglutaryl-CoA dehydratase", + "cyclic 3',5'-AMP-GMP", + "cell wall glucan", + "9H-purine-6-amine", + "(2S)-2-hydroxy-2-methylbutanedioate", + "D-arabinose-5-phosphate", + "TadF prepseudopilin", + "beta-D-glucose", + "4-O-methyl-11-deoxy-beta-rhodomycin T", + "[myosin light chain] phosphate", + "6-O-alpha-L-arabinopyranosyl-beta-D-glucopyranoside", + "S-geranylgeranyl-Rho", + "(4-[bis(2-bromoethyl)amino]-3,5-difluorobenzoyl)-L-glutamic acid", + "[LysW]-C-terminal-L-glutamate54", + "6-(alpha-D-glucosaminyl)-1D-myo-inositol 1,2-cyclic phosphate", + "T(6-4)T photoproduct (in DNA)", + "cyanidin 3-O-[[2-O-beta-D-xylosyl]-6-O-(6-O-(4-coumaroyl)-beta-D-glucoside)] 5-O-(6-O-malonyl)-beta-D-glucoside", + "Leu-Cys", + "mitochondrial tRNALys(UUU) uridine28", + "L-Arg-[hemopexin]", + "GlcA-beta-(1->2)-D-Man-alpha-(1->3)-D-Glc-beta-(1->4)-D-Glc-alpha-1 diphosphoundecaprenol", + "abietadienal", + "growth hormone releasing hormone (1-29)", + "N-decanoyl-L-homoserine", + "adhesin MAEBL", + "2 oxidized [4Fe-4S] ferredoxin", + "N1-glutathionylspermidine", + "des-Asp-angiotensin", + "[histone H3]-L-lysine 4", + "(+)-6a-hydroxymaackiain", + "Raf 1 kinase", + "pilin PilA", + "a 12-hydroxyjasmonoyl-L-amino acid", + "5'-phosphoribosyl-5-amino-imidazolecarboxamide", + "N-acetyl-alpha-D-glucosaminyl-1-phosphate", + "mature G protein-coupled protease activated receptor-2", + "D-glucuronyl beta-1,2-D-glucuronic acid", + "phosphorylated p34cdc2", + "L-Rhamnulose", + "phosphorylated alpha2A-adrenergic receptor", + "phosphorylated pyruvate dehydrogenase kinase", + "hexano-6-lactone", + "UDP-2-acetamido-2 3-dideoxy-3-[[(3R)-3-hydroxylauroyl]amino]-alpha-D-glucopyranose", + "carboxymethylaminomethyl 2-thiouridine34 in tRNAGlu", + "insulin receptor substrate-1", + "pelargonidin", + "alpha-defensin", + "(1S,2R)-1-C-(indol-3-yl)glycerol 3-phosphate", + "TRPV3 channel ankyrin repeat domain", + "N-acetyllactosamine", + "S-(2E,6E)-farnesyl-[Rho]-L-cysteine", + "GluA1 phosphoprotein", + "levomedetomidine N1-beta-D-glucuronoside", + "10-gingerol 4'-O-beta-D-glucuronoside", + "1,5-alpha-L-arabinan", + "cofactor sulfide", + "phospho-SREBP-1c", + "phenethyl alcohol", + "pectic acid", + "presequence of pre-SceD", + "5-methylcytosine49 in tRNA", + "[Ras1p]-L-cysteine", + "C-terminal [mycofactocin precursor peptide]-glycyl-3-amino-5-[(4-hydroxyphenyl)methyl]-4 4-dimethylpyrrolidin-2-one", + "gliadin", + "salmochelin S2", + "citramalate", + "ryanodine receptor type 2", + "5-hydroxymarmesin", + "taurolithocholate sulfate", + "neopentalenolactone F", + "minocycline", + "SH-CoB", + "dexmedetomidine N3-beta-D-glucuronoside", + "2 5-dehydro-4-deoxy-D-glucuronate", + "2-oxabicyclo[4.3.1]deca-1(10),6,8-triene-3,5-dione", + "(5Z,8Z,10E,12S,14Z)-12-hydroxyicosa-5,8,10,14-tetraenoic acid", + "Glycogen", + "[SAMP1]-Gly-Gly", + "acetoacetate", + "(S)-2-bromopropionic acid", + "phospho-D-glycerate", + "1,2-dichloroethane", + "[histone H3]-L-lysine 9", + "ADP-D-glycero-beta-D-manno-heptose", + "CDK9", + "D-glucosyl-N-acylsphingosine", + "phenylacetyl-CoA", + "2-methyl-1-[2,4 6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]butan-1-one", + "nigerose", + "[FHA-1]-tyrosine", + "(9Z,12Z)-octadec-9,12-dienoyl-[glycerolipid]", + "proenkephalin", + "1-oleoyl-2-linoleoyl-lysophosphatidylcholine", + "L-1,2-propanediol", + "C4 protein", + "Ras GTPase", + "CBP", + "alpha-1,6-dextran containing a (1->2)-alpha-D-glucose branch", + "triglucosyl-enterobactin", + "N-propionyl-D-leucine", + "myelin proteolipid protein", + "4-nitrophenyl N,N'-diacetyl-beta-D-chitobioside", + "MLGPEGG", + "ganglioside GD3", + "D-aspartate", + "N-lignoceroyl-D-sphinganine", + "Remazol Brilliant Blue dyed starch", + "3-methylcrotonoyl-CoA", + "6-aminopenicillinate", + "electron acceptor", + "[Vac8p]-L-cysteine", + "a phenolphthiocerol", + "fragment Bb", + "4-methyl-2-oxovalerate", + "human complement component C1", + "pre-RBCS protein", + "RPVL", + "3 sucrose", + "O-sinapoylcholine", + "6-deoxotyphasterol", + "N-acetyl-D-mannosaminolactone", + "UDP-N-acetylenolpyruvylglucosamine", + "arterivirus replicase ORF1a", + "[TsbR]-serine/threonine", + "4-(methylsulfanyl)-2-oxobutanoate", + "pseudooxynicotine", + "5-epiaristolochene", + "alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-R", + "5-oxoprolyl-peptide", + "5-oxopentanoate", + "(carboxymethyl)cellulose", + "Cprk", + "16 ADP", + "(pro)-filaggrin", + "claudin-3", + "HMGB1", + "HrpK/in", + "annexin 2", + "[aryl hydrocarbon receptor]-L-tyrosine", + "beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1 >4)-beta-D-GlcNAc-N-Asn-[protein]", + "beta-D-gentiobiosyl crocetin", + "26-deglucotorvoside A", + "pseudouridine", + "7-deoxyloganetate", + "trans-Aconitate", + "[(1->4)-alpha-D-glucosyl]n", + "2-hydroxy-dAMP", + "1-methyladenine", + "L-3-cyanoalanine", + "amyloid beta-peptide 1-40", + "an N-terminal-L-methionyl-L-leucyl-[Arl8b protein]", + "complement component 3b", + "3alpha,5alpha-3-hydroxypregnan-20-one", + "cyclic di-3',5'-adenylate", + "fragments of immunoglobuline G glycopeptide", + "N-acetylhydralazine", + "a [histone H4]-L-lysine20", + "l-Mgm1", + "molybdate", + "vitexin 2''-O-beta-D-glucoside", + "2-(L-cystein-S-yl)-2-(1H-indol-3-yl)acetonitrile", + "ROL-6 protein tyrosine-O-sulfate", + "2 NAD(P)H", + "4-beta-D-galactosyl-2-naphthyl-beta-D-xylopyranoside", + "beta-site amyloid precursor protein-cleaving enzyme 1", + "4-amino-4-deoxychorismate", + "genistein", + "8-oxo-dAMP", + "cytochrome b5", + "6-O-alpha-D-glucosaminyl-1-octadecylphospho-1D-myo-inositol", + "angiotensin(1-7)", + "2-hydro-1,2-dihydroxybenzoate", + "phosphate/in", + "acetoacetyl-[acyl-carrier protein]", + "caspase 1 precursor", + "2-amino-4-hydroxy-6-(erythro-1,2,3-trihydroxypropyl)dihydropteridine triphosphate", + "[(R)-3-hydroxybutanoate]n", + "2-aminoacrylate", + "(5Z,13E,15S)-9alpha,15-dihydroxy-11-oxoprosta-5,13-dienoate", + "[phosphatase 2A-C protein]-leucine", + "[protein DsbC] carrying a disulfide bond", + "UDP-galactofuranose", + "D-allose-[D-allose-binding protein][side 1]", + "CDP-1,2-diacyl-sn-glycerol", + "(R)-2-hydroxypropionate", + "Cas protein", + "a beta-D-galactoside", + "vimentin-L-citrulline", + "4-aminobutanoyl-[BtrI acyl-carrier protein]", + "L-2-haloacid", + "cheno-deoxycholic acid", + "4-Hydroxymandelonitrile", + "malyl-CoA", + "5alpha-Ergosta-7,22-diene-3beta,5alpha-diol", + "Albumin", + "mature 4.55 rRNA", + "N Ras-cysteine", + "2-vinyl-4-ethyl chlorophyllide a", + "1-O-(1-hydroxyalkyl)-sn-glycerol 3-phosphate", + "[alphabeta-tubulin]-(alpha-L-glutamyl-gamma-L-glutamyl)-L-glutamate", + "polyvinyl alcohol containing oxo-groups", + "adenine37 in tRNAAla", + "pyridoxine 5'-phosphate", + "tRNA uridine32", + "[reduced NADH-hemoprotein reductase]", + "decylubiquinone", + "aniline", + "2-oxo-4-carbamoylbutanoic acid", + "(8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoyl-CoA", + "glucose-related protein 78", + "acrylyl-CoA", + "ATF2", + "[galactosamine-binding protein Avi_5305][side 1]", + "D-galactose/out", + "4-nitrophenyl O-beta-D-glucuronoside", + "1D-myo-inositol 3,4,5-trisphosphate", + "MAP2K-phosphate", + "phosphorylated Cdc20", + "RATKML-NH2", + "FVNQHLCGSHLVEALYLVCGERGFFYTPKA", + "[casein kinase 1 delta]", + "1-acyl-2-linoleoyl-sn-glycero-3-phosphocholine", + "(2E,6Z)-farnesyl diphosphate", + "coagulogen", + "MEF-2A", + "[RitR]-serine/threonine", + "(+)-sativene", + "2-hydroxybiphenyl", + "1,2-diacyl-sn-glycerol 3-phosphate", + "N-acetyl-D-valine", + "2,6-dichloroindophenol", + "1,2,3,5-tetrahydroxybenzene", + "C16-ceramide 1-phosphate", + "uracil1939 in 23S rRNA", + "11beta,20beta-dihydroxypregn-4-ene-3-one", + "feruloyl xylooligosaccharide", + "CREB", + "penicillin X", + "insulin-like growth factor binding protein-related protein-1", + "(R)-linalyl beta-vicianoside", + "L-idarate", + "myo-inositol 1,3,4,6-tetrakisphosphate", + "variant-surface-glycoprotein inositol", + "N-acylglycine", + "labda-7,12,14-triene", + "an anthocyanidin 3-O-beta-D-sambubioside", + "4-aminobutanoyl-CoA", + "QRPRLSHKGPMP", + "[L-tryptophan-binding protein][side 1]", + "5S rRNA", + "cytosine38 in tRNAVal precursor", + "1-phospho-D-glucuronate", + "proteinase-activated receptor 4", + "[(1->4)-beta-D-xylan]n+1", + "3-O-L-lysyl-1-O-phosphatidylglycerol", + "phosphorylated big potassium channel BKCa", + "ferrocene", + "5(12)-oxa-3(11)-cyclotaxane", + "methotrexate/out", + "N-acetyl-alpha-D-galactosaminyl-1 3-[alpha-L-fucosyl-1-2]-D-galactosyl-O-R", + "[Goodpasture antigen-binding protein]", + "mitogen-activated protein kinase kinase 1", + "phosphorylated G protein-coupled receptor GRK1", + "2-methyl-N-carbamoyl-beta-alanine", + "cholest-4-en-3-one-27-oic acid", + "reduced polyferredoxin", + "1,1-dimethylhydrazine", + "oleandomycin", + "cyclin G1", + "cobalt-precorrin-5B", + "20alpha-hydroxypregn-4-en-3-one", + "phosphorylated myosin light chain", + "[heparan sulfate]-glucosamine", + "(2S,5R)-5-O-(beta-D-galactosyl)-5-hydroxy-L-lysine-[procollagen]", + "4-hydroxytryptamine 4-phosphate", + "[glucose hexokinase regulatory protein] phosphate", + "2-Hydroxy-2-methyl-3-oxobutanoate", + "lauric acid", + "phytoceramide", + "vancomycin aglycone", + "3 beta-D-glucose", + "(1-hydroxycyclohexan-1-yl)acetyl-CoA", + "linearized DNA", + "human thrombin", + "jasmonic acid", + "DELTA8-trans/cis-C20-phytosphingenine", + "D-apionate", + "D-erythro-sphingosine", + "[glutamate dehydrogenase]-L-lysine", + "p97", + "pro-EGF receptor", + "DELTA4-cholesten-7alpha-ol-3-one", + "4-methylthiooctanaldoxime", + "2-oxo-3-hexenedioate", + "[nuclear receptor LXR]-N6-acetyl-L-lysine", + "methyl beta-D-xylopyranoside 3-deoxy-2,4-di-O-acetate", + "N4-(beta-N-acetylglucosaminyl)-L-asparagine", + "gentiooctaose", + "guaiacol", + "85kDa microtubule-associated protein", + "7-keto-lithocholic acid", + "2-hydroxycaprylate", + "tRNA containing a thionucleotide", + "2,6-diamino-4-hydroxy-5-formamidopyrimidine:Cyt-DNA", + "2 uracil", + "phosphatidylcholine", + "acetylhistone H3", + "diglucosyl-(2,3-dihydroxybenzoylserine)3", + "ferroheme o", + "[thymine DNA glycosylase]-N6-acetyl-L-lysine", + "alpha,alpha-trehalose 6-mycolate", + "poly(ADP-ribosyl)ated-Hrp38", + "[KCa3.1 channel protein]-L-histidine", + "(alginate)n", + "glyceraldehyde 3-phosphate", + "YGGFLRRIRPKLK", + "(R)-phenyllactoyl-CoA", + "Gelatinase", + "aerobactin", + "5-D/L-glutamyl-phenylhydrazine", + "5-amino-2,6-dioxy-4-(5'-phosphoribosylamino)pyrimidine", + "6-Phospho-5-dehydro-2-deoxy-D-gluconate", + "Hg2+", + "[MAP1B protein]-serine/threonine", + "microtubule affinity regulating kinase 2", + "L-2-hydroxystearate", + "3-phosphonooxypyruvate", + "cyanidin-3-O-(6-O-malonyl-beta-D-glucoside)", + "2-((3S)-3-amino-3-carboxypropyl)-L-histidine-[translation elongation factor 2]", + "alkanesulfonate-[alkanesulfonate-binding protein][side 1]", + "(1,3-beta-D-glucosyl)n", + "D-Arg", + "cytosine in RNA", + "1-oleoyl-2-palmitoyl-sn-glycerol", + "gasdermin fragment p30", + "IHSLPPE", + "[Ras1p]-S-palmitoyl-L-cysteine", + "hyperacetylated histone-DNA complex", + "(imidazol-4-yl)acetaldehyde", + "D-4'-phosphopantothenate", + "phospho-[acetyl-CoA carboxylase]", + "ssDNA-ddUFc", + "dimethylmaleate", + "cyclo(L-tyrosyl-L-phenylalanyl)", + "Man5GlcNAc2-[protein]", + "corn flour", + "guanine9 in tRNACysGCA", + "ceftizoxime", + "stearoyl-CoA", + "5-methylcytosine48 in tRNAThr(UGU)", + "testosterone", + "benzothiophene", + "3-oxoadipate", + "1,2-dioleoyl-sn-glycerol", + "4,9(11)-pregnadiene-3,20-dione", + "an N-terminal-Nalpha-acetyl-L-cysteinyl-[protein]", + "acetylated beta-site amyloid precursor protein-cleaving enzyme 1", + "N-oleoyl-D-erythro-ceramide", + "RRFL", + "cytosine1405 in 16S rRNA", + "premnaspirodiene", + "italian rye gras cell walls", + "high mannose N-glycan", + "indomethacin/in", + "[Rho]-L-cysteine", + "2-carboxy-D-arabinitol 1-phosphate", + "propeptide", + "2-(alpha-D-glucosyl)-3-phosphoglycerate", + "activated epithelial sodium channel", + "5'-hydroxy-(ribonucleotide)m", + "alpha,alpha-trehalose 6-phosphate", + "4-methyl-3-oxoadipate enol-lactone", + "L-histidine-[L-histidine-binding protein][side 1]", + "L-Cys", + "[factor VII protein with EGF-like domain 1]-3-O-(beta-D-xylosyl)-L-serine", + "N-(6-aminohexanoyl)-6-aminohexanoate", + "20beta-hydroxycortisol", + "1-(indol-3-yl)glycerol 3-phosphate", + "naphthoquinone", + "(trans)-beta-caryophyllene", + "cyclin B1", + "neuronal cell adhesion molecule 1", + "UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2 6-diaminoheptanedioate", + "(9Z,12Z)-(11S)-11-hydroperoxyoctadeca-9,12-dienoate", + "DNA containing F5dC", + "phosphatidylethanolamine/out", + "2-methyl-cis-aconitate", + "dephospho-CoA", + "2-(S)-hydroxypropyl-CoM", + "oxalic acid", + "mucus glycoprotein", + "5-methylcytosine48 in tRNASer(CGA)", + "collagen type II", + "2-methyl-3-oxohexanoyl-N-acetylcysteamine", + "(E)-alpha-bisabolene", + "a [protein]-N-phospho-L-histidine", + "tetrathionate", + "oxidized flavin", + "GlcMan9GlcNAc2", + "(R)-limonene", + "N-hexacosanoylphytosphingosine", + "methyl vanillate", + "24-methylenedihydrolanosterol", + "1,2-diacyl-sn-lysophosphatidylcholine", + "major histocompatibility complex class I molecules/out", + "3-acetamidopropanal", + "L-histidine decarboxylase precursor", + "alanine/out", + "cumene hydroperoxide", + "[7-(2,6-dichlorophenyl)-5-methyl-benzo[1,2 4]triazin-3-yl]-(4-[2-(1-oxy-pyrrolidin-1-yl)-ethoxy]-phenyl)-amine", + "2-hydroxy-3,4-dioxodecyl phosphate", + "protein kinase CK2alpha", + "gamma-glutamyl-gamma-aminobutyraldehyde", + "an all-trans-retinyl ester", + "glutathione S-conjugates/cytoplasm", + "Ca2+[side 1]", + "beta-L-rhamnopyranose", + "cyclohexa-1,4-diene-1-carbonyl-CoA", + "an [amino-group carrier protein]-C-terminal-gamma-(L-glutamyl)-L-glutamate", + "(ribitol phosphate)n", + "growth differentiation factor-1", + "fragments of dextran", + "a tripeptide-[tripeptide-binding protein][side 1]", + "O3-acetyl-L-serine", + "alpha-synulein", + "wheat bran", + "relaxin-3 fragments", + "myelin basic protein peptide fragments", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-phenylalanyl-L-tyrosyl-[Scc1 protein]", + "thymine-guanine mismatched double-stranded DNA", + "sphingosylphosphorylcholine", + "GDP-alpha-D-glucose", + "cytosine40 in tRNA precursor", + "trans-feruloyl-CoA", + "1-O-(2-acetamido-2-deoxy-alpha-D-glucopyranosyl)-1D-myo-inositol 3-phosphate", + "Man9-glycopeptide", + "UDP-2,3-bis((3R)-3-hydroxymyristoyl)-alpha-D-glucosamine", + "violaceinate", + "Hsp90alpha", + "5,10-methylenetetrahydromethanopterin", + "[PGC-1]-L-lysine", + "phosphorylated TRIM39", + "pro-collagen I", + "alpha-D-galactosyl-(1-3)-1D-myo-inositol", + "phosphorylated histone H1-IIIS", + "cytosine27 in vtRNA1.2", + "(6S)-6-hydroxyhyoscyamine", + "beta-D-galactosyl-(1->4)-L-rhamnose", + "O2-methylthymine", + "peptide fragment", + "(ADP-D-ribosyl)n+1-P2X7 ion channel", + "N-succinyl LL-diaminopimelic acid", + "4-alkylcatechol", + "(6E,8Z,11Z,14Z)-(5S)-hydroperoxyicosa-6,8,11,14-tetraenoate", + "5-chloro-2-methylmaleylacetate", + "N-(7-[(2-sulfoethyl)dithio]heptanoyl)-O3-phospho-L-threonine", + "gibberellin", + "Precorrin-8X", + "phospho-AMP-activated protein kinase", + "an S-substituted L-cysteine", + "(6R,S)-leucovorin", + "(R)-8-oxocitronellyl enol", + "phospho-[RNA polymerase II]", + "resveratrol", + "immunoglobulin Fab", + "assembly protein precursor of CMV (pAP)", + "cytosine48 in tRNAMet(CAU)", + "beta-D-galactosyl-1,3-(N-acetyl-beta-D-glucosaminyl-1 6)-N-acetyl-D-galactosaminyl-R", + "phosphorylated Bcl10", + "pro-hepatocyte growth factor/scatter factor", + "(2E,4Z)-2-hydroxy-6-oxonona-2,4-dienedioate", + "GSH", + "[histone H3]-N6-methyl-L-lysine9", + "CCK8NH2", + "13-cis-retinal", + "[histone H3]-N6,N6-methyl-L-lysine4", + "L-beta-amino-n-butyric acid", + "interleukin-8 precursor", + "1-hexadecyl-sn-glycerol-3-phosphocholine", + "1alpha,25-dihydroxyvitamin D3", + "an archaeal dolichyl phosphate", + "(+)-bisdechlorogeodin", + "[RGS4]-L-cysteine", + "Abeta42", + "fibrillar collagen", + "deoxycytidylate", + "Met-Leu", + "3-dimethylallyl-4-hydroxyphenylpyruvate", + "hydropyrene", + "azithromycin", + "dopamine D1 receptor", + "4-methoxycinnamyl alcohol", + "methyl 4-coumarate", + "(S)-corytuberine", + "protein-L-methionine-(R)-sulfoxide", + "DNA containing a guanine:adenine mismatch", + "UDP-MurNAc-L-Ala-D-Glu", + "(9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid", + "1-O-alkyl-sn-glycerol 3-phosphate", + "colominic acid", + "dehydroergosterol", + "D-tryptophan methyl ester", + "alpha-ketomethiobutyrate", + "5-keto-D-fructose", + "SufS-SSH", + "vanillinic acid", + "reumycin", + "1,2-dihydroxy-5-(methylthio)pent-1-en-3-one", + "phosphorylated protein Cubitus interruptus", + "[trehalose-6-phosphate synthase]-S-methyl-L-cysteine", + "D-glucarolactone", + "holo-[L-glutamyl-carrier protein]", + "reduced rusticyanin", + "6-phospho-D-glucono-1,5-lactone", + "NADPH oxidase A", + "2,6-dihydroxypyridine", + "phosphorylated dynamin 1", + "ferriprotoporphyrin IX", + "L-Rhamnulose 1-phosphate", + "octanoyl-CoA", + "(hydroxymethyl)phosphonate", + "sn-glycero 3-phosphorylethanolamine", + "5 H+", + "1alpha,24,25-trihydroxycholecalciferol", + "1,2-binaphthalene", + "moesin", + "1-deoxy-D-xylulose 5-phosphate", + "lipopolysaccharide", + "SPAGLQV", + "gamma-glutamyltyramine", + "D-amino acid", + "alpha-L-Fuc-(1-3)-D-Gal", + "Asp89-[ribosomal protein S12]", + "indole-3-acetamide", + "2-methyl-6-solanesyl-1,4-benzoquinol", + "histone H3 N6,N6-dimethyl-L-lysine26", + "poly(A) binding protein", + "CDP-ethanolamine", + "sea cucumber muscle tissue", + "5beta-pregnane-3beta-ol-20-one", + "4-hydroxy-trichloroisophthalonitrile", + "N-terminal-ubiquitinyl-[acceptor protein]", + "ceramide phosphate", + "(4S)-3-[5-(4-fluorophenyl)-1,5-dioxopentyl]-4-phenyl-2-oxazolidinone", + "4-methyl-5-(2-phosphono-oxyethyl)-thiazole", + "(3S)-citryl-CoA", + "D-Man-alpha-(1->2)-D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-[D-Man-alpha (1->2)-D-Man-alpha-(1->3)-[D-Man-alpha-(1->2)-D-Man-alpha-(1->6)]-D-Man alpha-(1->6)]-D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D-GlcNAc diphosphodolichol", + "(7S,8R)-diaminononanoate", + "neurexin 3", + "phosphorylated polymerase II C-terminal domain", + "noscapine", + "EGF receptor", + "collagen XII", + "CoASH", + "adhesin Rh2a", + "UDP-2,3-bis(3-hydroxymyristoyl)-alpha-D-glucosamine", + "an omega-aminoaldehyde", + "5alpha-androstan-3alpha,17beta-diol", + "S-propionyltrypanothione", + "L-glutaminyl-Abeta(3-42) peptide", + "juvenile hormone III bisepoxide", + "[DivIVA]-serine/threonine", + "1,2-dipalmitoylphosphatidylcholine", + "HycB", + "VicR L-histidine", + "3-(4-aminophenyl)pyruvate", + "[molybdate-binding protein][side 1]", + "Na+/out", + "N-acetyl-beta-D-glucosaminyl-1,3-N-acetyl-D-galactosaminyl-R", + "(11Z)-hexadec-11-enoyl-CoA", + "5beta-pregnane-3alpha,17alpha,20beta,21-tetraol-11-one", + "TSR4", + "5beta-pregnane-20alpha-ol-3-one", + "HBV preS1", + "erythritol", + "SLPI", + "3-O-[beta-D-Xyl-(1->4)-Rib-ol-P-Rib-ol-P-3-beta-D-GalNAc-(1->3)-beta-D GlcNAc-(1->4)-O-6-P-alpha-D-Man]-Ser/Thr-[protein]", + "cytosine38 in tRNAAsp", + "3'-demethylstaurosporine", + "avitagged BirA", + "1-oleoyl-2-palmitoyl-lysophosphatidylcholine", + "N-3-oxododecanoyl-L-homoserine", + "[eukaryotic translation initiation factor 2alpha]-L-arginine", + "beta-nicotinate D-ribonucleotide", + "2'-deoxyribonuleoside 5'-diphosphate", + "amphetamine", + "SKARRKKVYPYPXENFPPSTARPT", + "(+)-beta-caryophyllene", + "trypsinogen tyrosine", + "cAMP/out", + "N-carbamoyl-D-p-hydroxyphenylglycine", + "3-phosphoshikimate", + "cis-5-hydroxypipecolate", + "aminoglycoside", + "chloroacetaldehyde", + "benzo-pyrene", + "dextran T2000", + "D-Leu-Phg-Arg-4-nitroanilide", + "an N-terminal-Nalpha-acetyl-amino acid-[protein]", + "tRNAAsp-O-5''-beta-D-mannosylqueuosine", + "Nalpha-methylhistidine", + "3-alpha-D-galactosyl-[lipopolysaccharide glucose]", + "N-methyl-L-alanine", + "an N-terminal-Nalpha-acetyl-[iso-1-cytochrome c]", + "5-guanidino-2-oxopentanoate", + "fatty acyl CoA[side 1]", + "thiocyanate", + "[Stk]-serine/threonine", + "5-chlorouracil", + "L-leucine", + "evatromonoside", + "phosphorylated cellular nucleic acid binding protein", + "gibberellin 19", + "interleukin-2", + "4,6-dimethyldibenzothiophene", + "N6-acetyl-N6-hydroxylysine", + "norlanosterol", + "1-linoleoyl lysophosphatidylcholine hydroperoxide", + "6-aminopenicillanic acid", + "(2S,5R)-5-methyl-2-(propan-2-yl)cyclohexan-1-one", + "[GST-IkappaB protein]", + "cytosine48 in tRNAGly(CCC)", + "AMP-activated protein kinase alpha1", + "phosphorylated platelet-derived growth factor receptor-beta", + "2-nitrophenol", + "thermospermine", + "2'-5'-oligoadenylate", + "lysophospholipids", + "2,3-dihydroxy-3-methylpentanoate", + "tartronate semialdehyde", + "oxyntomodulin", + "1H-3-hydroxy-4-oxoquinaldine", + "1,4-beta-D-xylan", + "ephrin type-A receptor 2", + "Rab", + "UDP-4-dehydro-6-deoxy-D-glucose", + "procollagen 5-hydroxy-L-lysine", + "dynorphin 1-8", + "5-Phosphoadenosine 3-phosphosulfate", + "urethane", + "methylphosphonate", + "(E)-beta-farnesene", + "2 ferrocytochrome c 550", + "ErbB2", + "12-phosphonooxyoctadecanoic acid", + "(+)-(S)-allyl-L-cysteine sulfoxide", + "an oxidized electron acceptor", + "(9Z)-12-hydroxyoctadec-9-enoic acid", + "[tubulin]-serine/threonine phosphate", + "DNA-guanosine", + "meconium X-1", + "2-hydroxy-dATP", + "KPGLKRGGAK", + "2 NAD(P)+", + "N-nervonoylsphingosine", + "lysosomal-enzyme N-acetyl-D-glucosaminyl-phospho-D-mannose", + "[Glu(-Cys)]n-Gly", + "cytidine56 in tRNA", + "(1S,2R,5R)-5-methyl-2-(propan-2-yl)cyclohexan-1-ol", + "(-)-epiafzelechin", + "submaxillary glycoprotein", + "[protein]-N6-succinyl-L-lysine", + "Lys", + "syndecan-1", + "lysosomal associated membrane protein 2", + "1-chloro-9,10-anthracenedione", + "2 ferricytochrome cL", + "cytosine48 in tRNALeu(CAA)", + "diphthamide-[Escherichia coli elongation factor Tu]", + "amyloid-beta35-40", + "2 ferrocytochrome b5", + "(4S)-4,5-dihydroxypentane-2,3-dione", + "choline lysoplasmalogen", + "phosphorylated protein PLB", + "HCO3-", + "alpha-D-Man-(1-2)-alpha-D-Man-(1-2)-alpha-D-Man-(1-3)-[alpha-D-Man-(1 2)-alpha-D-Man-(1-3)-[alpha-D-Man-(1-2)-alpha-D-Man-(1-6)]-alpha-D-Man (1-6)]-beta-D-Man-(1-4)-beta-D-GlcNAc", + "Mca-KKVYP", + "activated factor XI", + "trisaccharides of alginate", + "Cys-Leu", + "leukotriene B4/in", + "4-trimethylammoniobutanal", + "gelatin N5-alkylglutamine", + "nodulation outer protein L", + "all-trans-8'-apocarotenol", + "ferricenium ion", + "3-ureidopropionate", + "monoethylglycylxylidine", + "S2-", + "methylaminomethyl uridine34 in tRNAArg", + "aspartyl peptides", + "[DsbG protein] with reduced L-cysteine residues", + "3,4-dihydroxy-2-butanone 4-phosphate", + "N,N,N-trimethylamine", + "phytyl-bacteriochlorophyll a", + "2-nitroimidazole", + "bis-D-fructose 2',1:2,1'-dianhydride", + "nicotinic acid", + "ubiquitin-CEP80", + "octadecanoyl-CoA", + "N-acetyl-SESSSKS", + "di-myo-inositol-1,3'-phosphate", + "[histone-H3]-tridimethyllysine4", + "phospho-prothymosin alpha", + "(+)-citramalate", + "(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl-[glycerolipid]", + "histatin 5", + "alpha-L-Fuc-(1-2)-D-Gal", + "4-hydroxymethylphenylhydrazine", + "heat shock protein 70[side 2]", + "a flavonol 3-O-D-glucoside", + "a N-acetylarylamine", + "4-Oxalocrotonate", + "D-hexose phosphate", + "Phosphatidyl inositol-4,5-bisphosphate", + "[dermatan]-N-acetyl-D-galactosamine", + "fructose acceptor", + "averantin", + "adenylate kinase 1", + "ethyl 2-[4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy]propanoate", + "cytosine49 in tRNAGly(CCC)", + "2-naphthylsulfamate", + "[eukaryotic translation initiation factor 2alpha]-Nomega-methyl-L-arginine", + "sodB mRNA", + "(1H-indol-3-yl)acetaldehyde", + "N-decanoyl-L-homoserine lactone", + "urokinase type plasminogen activator", + "pyruvate dehydrogenase kinase", + "glycoprotein", + "DTGIIFAA", + "N-acetyl-D-galactosamine", + "[beta-D-fructofuranosyl-(2->6)]n alpha-D-glucopyranoside", + "3-Phosphoglycerate", + "2 L-dehydroascorbate", + "3-O-methylphospho-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-[alpha-D-Man-(1 >3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)]n-alpha-D Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-GlcNAc diphospho-ditrans,octacis-undecaprenol", + "12(S)-hydroxy-5,8,10-heptadecatrienoic acid", + "tetrahdrofolic acid", + "alpha-D-mannosyl-(1->3)-N-acetyl-alpha-D-glucosaminyl-diphospho-ditrans octacis-undecaprenol", + "S-D-ribosyl-L-homocysteine", + "2 formate", + "sphingolipid", + "3-deacetyl-3-(1-hydroxyethyl)bacteriochlorophyllide a", + "O-acetylcholine", + "notoginsenoside R1", + "phosphorylated MKK2", + "(+/-)-isoborneol", + "statherin O-sulfate", + "UDP-MurNAc-tetrapeptide", + "UDP-N-acetylmuramoyl-L-alanyl-D-glutamate", + "3-Oxododecanoate", + "MIC adhesin", + "GAB2-N1-237", + "VASP protein", + "2 ferrocytochrome cL", + "1,2-dihydroxynaphthalene", + "LL37", + "phaseolin", + "collagen type XVII", + "membrane form of variant-surface-glycoprotein", + "Gly-tRNAAla", + "C4.4A", + "12 bp RNA/DNA hybrid", + "2-dehydro-3-deoxy-D-octonate 8-phosphate", + "2,3-cis-flavan-3-ol", + "N-heptylpantothenamide", + "2-hydroxyoctanoate", + "Proteoglycan", + "3 menadiol", + "sitosterol 3-beta-D-glucoside", + "N-terminal Nalpha-acetyl-L-lysyl-[Hsp70]", + "N2-methylguanine966 in 16S rRNA", + "N6-([prokaryotic ubiquitin-like protein]-gamma-L-glutamyl)-[proteasome-interacting ATPase]-L-lysine", + "2-dehydropantoyl lactone", + "phospho-[extracellular signal-regulated kinase]", + "proline", + "pectate", + "amyloid beta peptides", + "5-hydroxyeicosatetraenoic acid", + "beta-D-glucuronyl-(1->3)-N-acetyl-beta-D-galactosaminyl-proteoglycan", + "histone H4", + "protein L-cysteine", + "4-chlorobenzonitrile", + "O-antigen serotype 4av", + "3-beta-D-glucuronosyl-3-beta-D-galactosyl-4-beta-D-galactosyl-O-beta-D xylosylprotein", + "pristanal", + "beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc-N-Asn [lysosome-associated membrane glycoprotein 2]", + "3beta,7beta-dihydroxy-5beta-cholan-24-oic acid", + "iota-carrahexaose", + "CoB", + "L-seryl-[protein]", + "CX3CL1", + "blood group A glycoconjugate", + "neoagarooctaose", + "nitroxyl", + "phosphoezrin", + "Rab GDP dissociation factor inhibitor alpha", + "a 6,7-dihydropteridine", + "[eIF5A-precursor]-deoxyhypusine", + "inulotriose", + "alkylaldehyde", + "mature Gag-Pol polyprotein", + "2-O-caffeoyl-3-(4-hydroxyphenyl)lactate", + "dipyridamole/in", + "Mitochondrial intermediate proteins", + "2-butynylalanyl-tRNALeu", + "iron(III) hydroxamates/out", + "progranulin", + "Man9-5GlcNAc", + "4-hydroxymuconic semialdehyde", + "hexamethylene dicarbamic acid dibutyl ester", + "protein D-aspartate methyl ester", + "baohuoside I", + "DNA-base", + "morphine 6-beta-D-glucuronoside", + "2-aminobenzoate", + "3-hydroxyalkanoate", + "(3S)-citramalyl-CoA", + "D-pantothenate", + "N-[(R)-4'-phosphopantothenoyl]-L-cysteine", + "[KRAB-associated protein 1]-L-arginine", + "1-(6-hydroxypyridin-3-yl)-4-(methylamino)butan-1-one", + "hexa-acyl lipid A", + "L-malate", + "activated hepatocyte growth factor/scatter factor", + "deacetylated nuclease-resistant histone-DNA complex", + "n reduced hemoprotein", + "3-dimethylallyl-4-hydroxybenzoate", + "6 ADP", + "5-methylcytosine1407 in 16S rRNA", + "4-amino-5-aminomethyl-2-methylpyrimidine", + "N-(3-oxodecanoyl)-L-homoserine", + "hypoxia-inducible factor L-proline", + "(11E)-hexadecenoate", + "O-phospho-[amyloid precursor protein]", + "DELTA8-phytosphingenine", + "S-(2,3-hydroxy-4-thiobutyl)-L-cysteine", + "3-hydroxypalmitate", + "(L)-lactaldehyde", + "5-hydroxyethylthio-D-ribose 1-phosphate", + "cholecystokinin-8", + "11',12'-dihydro-10'-apo-beta-carotene-3,10'-diol", + "amyloid beta 1-38 peptide", + "[(R)-3-hydroxybutanoate]n-x", + "cinnamate", + "N6-methyladenine in U6 snRNA", + "1-palmitoyl-2-vaccenoyl-sn-glycero-3-phosphoethanolamine", + "3-epi-1alpha,23-dihydroxy-24,25,26,27-tetranor-vitamin D3", + "coxsackievirus and adenovirus receptor", + "tylosin 2'-O-phosphate", + "7,8-dihydroneopterin 3'-phosphate", + "[DivIVA]-serine/threonine phosphate", + "taurine/out", + "gluten", + "pendulan", + "CDP-diacylglycerol", + "a [histone H3]-N6,N6,N6-trimethyl-L-lysine79", + "cis-11,12-epoxyeicosatrienoic acid", + "queuosine34 in tRNA", + "[PknA]-serine/threonine", + "MT1-matrix metalloproteinase", + "[E2 ubiquitin-conjugating enzyme cullin-1]-S-ubiquitinyl-L-cysteine", + "hexacosanoyl alcohol", + "5-carboxyuracil", + "8beta-hydroxygermacra-1(10),4,11(13)-trien-12-oate", + "MLGPEGGRWG", + "3-deoxy-D-manno-octulosonic acid", + "Isopiperitenone", + "[Src-family protein tyrosine kinase]-L-tyrosine", + "peptides", + "BKCa channel ZERO", + "D-lombricine", + "lipopolysaccharide/out", + "(12Z,15Z)-9-epoxyoctadec-12,15-dienoic acid", + "N-acetyl-L-aspartyl-L-glutamate", + "ent-isokauren-2beta-ol", + "(1E,4S,5E,7R)-germacra-1(10),5-dien-11-ol", + "1,2-dihydroxy-6-methylheptane-3,4-dione", + "a substituted beta-amino acid", + "Oxalyl-CoA", + "hydroxyatrazine", + "2-methylspermidine", + "2-Amino-4-hydroxy-6-(D-erythro-1,2,3-trihydroxypropyl)-7 8-dihydropteridine", + "(R)-3,5-bisphosphomevalonate", + "uracil17 in tRNA", + "(5S,8R,9Z,12Z)-5,8-dihydroxy-9,12-octadecadienoate", + "[heparosan]-L-iduronate", + "[(2R)-3,3,4-trimethyl-6-oxo-3,6-dihydro-1H-pyran-2-yl]acetyl-CoA", + "3'-phospho-5'-adenylyl sulfate", + "OmpW", + "chondroitin oligosaccharide", + "[Notch2 protein with EGF-like domain]-3-O-(beta-D-xylosyl)-L-serine", + "12-hydroxydihydrochelirubine", + "a (2R,3R)-dihydroflavonol", + "alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-alpha D-galactosaminyl-R", + "(Z)-butanethial S-oxide", + "LEVD-7-amido-4-trifluoromethylcoumarin", + "tRNA uridine31", + "4 Fe(II)", + "alpha1-PI", + "PAD4 peptides", + "novapikromyin", + "hnu", + "2-aminoadipate-6-semialdehyde", + "(S)-3,5-dihydroxymandelate", + "beta-1,6-linked N-acetylglucosamine oligomers", + "hypoxia-inducible factor 1 alpha-L-proline", + "radixin", + "2,6-diamino-4-hydroxy-5-formamidopyrimidine-DNA", + "ent-isokaur-15-ene", + "3-hydroxy-4H-pyrid-4-one", + "1,2-dichlorovinyl-L-cysteine", + "daunorubicin/in", + "5-hydroxynicotinic acid", + "trans-2-decenoic acid", + "phosphorylated beta-cateniin", + "2,3-trans-enoyl-CoA", + "(ADP-D-ribosyl)n-tyrosine kinase Hck", + "5-methylanthranilate", + "8-hydroxy,9-oxo-eicosa-5Z,11Z,14Z-trienoic acid", + "3-hydroxybutanoyl-[acyl-carrier protein]", + "cytosine50 in tRNAGlu(UUC)", + "2,5-dihydro-5-oxofuran-2-acetate", + "cobalt-precorrin-3B", + "UDP-alpha-D-N-acetylglucosamine", + "L-ascorbate", + "(S)-2-(4-chloro-2-methylphenoxy)propanoate", + "N-acetyl-aspartylglutamate", + "phenacetin", + "dTDP-3-dehydro-6-deoxy-alpha-D-glucopyranose", + "phenyllactate", + "small ubiquitin-related modifier-protein", + "2-arylpropionate", + "5'-dGMP", + "kanamycin A 2''-phosphate", + "1-(4-chlorophenyl)ethanone", + "an N-terminal-L-threonyl-[protein]", + "N-acetyl-D-galactosaminyl-1,3-N-acetyl-D-galactosaminyl-1 3-D-galactosyl-R", + "soluble fibrin fragments", + "magnoflorine", + "active factor VIIIa", + "N-3-oxooctanoyl-L-homoserine lactone", + "phospho-CDC25A", + "GAP-43-3", + "3-geranylgeranyl-L-cysteine", + "[dinitrogen reductase]-L-arginine", + "plasmenylcholine", + "(maltodextrin)n-1", + "cellular protein[side 2]", + "Tau protein", + "ubiquitin", + "D-arabitinol", + "[histone H3.3]-L-lysine27", + "arsenite/out", + "methyl acetate", + "acetyl salicylate", + "adenine1779/adenine1780 in 18S rRNA", + "4-amino-3-methylbenzoic acid", + "Spo0A L-histidine", + "2-methyl-1,4-naphthoquinone", + "N-acylsphingosine", + "1,2-diacyl-sn-glycero-3-phosphocholine", + "type I aminoprocollagen", + "Cyclohexanone", + "peptidyl-L-amino acid", + "2'-hydroxygenistein", + "1-octanol", + "5-iodo-thymine", + "B cell lymphoma-2-interacting domain", + "UDPapiose", + "[histone H3]-N6-methyl-L-lysine27", + "9(10),16-dihydroxyhexadecanoyl-CoA", + "WHWLQLKQGQPMY", + "ethyl acetate", + "beta-crystallin N5-alkylglutamine", + "an [amino-group carrier protein]-C-terminal-L-glutamate", + "apo-[R-phycocyanin alpha-subunit]", + "phosphorylated 85kDa microtubule-associated protein", + "bimatoprost/out", + "butyloxycarbonyl-L-Gln-L-Ala-L-Arg-4-nitroanilide", + "N10-formyltetrahydrofolate", + "silybin B", + "phosphorylated neuronal nitric-oxide synthase", + "dihydrofolate reductase", + "N,N'-dibenzyl-1,4-diaminobutane", + "thromboxane B2", + "glycerol 1,2-cyclic phosphate", + "phosphorylated CXCR4 receptor", + "[BMAL1 protein]-N6-acyl-L-lysine", + "alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-[4-P-L-Ara4N]-lipid A", + "nuclear-encoded polyprotein precursor", + "phosphorylated protein M33", + "L-fuconolactone", + "adenine in tRNA", + "N-(3-oxooctanoyl)-L-homoserine", + "2-oxo-4-methylthiobutanoate", + "ent-kaur-16-en-19-oic acid", + "myricetin", + "[tau protein]-serine/threonine", + "(4S)-4-hydroxy-5-phosphonooxypentane-2,3-dione", + "MetR", + "beta-L-aspartylhydroxamate", + "frataxin", + "chenodeoxycholyltaurine/out", + "[BMAL1 protein]-L-lysine", + "guanosine 3'-diphosphate 5'-triphosphate", + "dalcochinin-8'-O-beta-D-glucopyranoside", + "1H-indol-6-ol", + "4-aminoimidazole", + "Der p 3", + "4-chlorobenzoic acid", + "[protein]-3-O-(beta-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D xylosyl)-L-serine", + "2,6-dichlorophenolindophenol", + "lipid-linked oligosaccharide", + "2-(4-methylamino-3-fluorophenyl)-1,3-benzothiazol-6-yl sulfate", + "(+)-cis,cis-nepetalactone", + "3-(pyrazol-1-yl)-L-alanine", + "ADPmannose", + "coelenteramide disulfate", + "L-xylono-1,4-lactone", + "(2E)-4-oxohex-2-enedioic acid", + "mature caspase-9", + "4 S-adenosyl-L-homocysteine", + "carotenoid beta-end group", + "4 reduced [2Fe-2S] ferredoxin", + "3 FAD", + "DELTA5,7-sterol", + "O-beta-D-xylosyl-[protein]", + "angiotensin II", + "glutathione S-conjugated leukotriene C4/cytoplasm", + "(2R)-2-[(R)-carboxy[(thiophen-2-ylacetyl)amino]methyl]-5-(pyridinium-1 ylmethyl)-3,6-dihydro-2H-1,3-thiazine-4-carboxylate", + "trans-2,3-dehydroacyl-CoA", + "STAT transcription activator protein", + "oligofructosides", + "3 glycogen", + "tissue growth factor-alpha", + "(25S)-3-oxocholest-4-en-26-oyl-CoA", + "VAMP2", + "immunglobulin A1 Fcalpha", + "tauro-alpha-muricholate 3-sulfate", + "[thiamine-binding protein ThiB][side 1]", + "phosphorylated Kemptide", + "7 isopentenyl diphosphate", + "dolichyl arachidonate", + "octaprenyl diphosphate", + "[S-adenosylhomocysteine hydrolase]-serine/threonine phosphate", + "daidzein", + "2-butynylalanine", + "3-oxo-5,6-dehydrosuberyl-CoA semialdehyde", + "diosmetin 7-O-[beta-L-rhamnosyl-(1-2)-beta-D-glucoside]", + "2-oxo-3-hydroxy-4-phospho-butanoate", + "3-phenylpropionate", + "allicin", + "beta-D-Glucose 6-phosphate", + "3-oxosteroid", + "small acid-soluble protein alpha", + "phosphorylated TRPC3", + "cobalt-precorrin-8", + "benzyl (2S,3S)-2-methyl-3-hydroxybutanoate", + "1-oleoyl-2-lysophosphatidylinositol", + "L-threonyl-tRNAThr", + "N6-methyladenine", + "ureidomalonic acid", + "thromboxane B2/out", + "2-oxopropyl-CoM", + "dibekacin", + "insulin", + "(ADP-D-ribosyl)n-acceptor", + "beta-1,3-1,4-glucan", + "beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man (1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc-N-Asn-[protein]", + "D-galactonate", + "6-methylhept-5-en-2-ol", + "a long-chain fatty-acyl adenylate ester", + "3-hydroxysteroid", + "fibrinogen-bound gamma-glutamine", + "5-methylcytosine48 in tRNAVal(CAC)", + "15-cis-phytoene", + "glycocholic acid", + "D-Gal-(1-3)(D-GlcUA-(1-2))-alpha-D-Man-(1-3)-alpha-D-Gal", + "7 CoA", + "tropomyosin 3", + "(-)-trans-carveol", + "(+)-thujan-3-ol", + "Lys(Phe-tRNA2)", + "MMP-2 propeptide", + "E-cadherin with bisecting N-acetyl-D-glucosamine", + "D-lysine", + "2,5-diamino-6-hydroxy-4-(5-phosphoribosylamino)-pyrimidine", + "tRNAAsx", + "5beta-scymnol sulfate", + "N1-methylguanine2535 in 23S rRNA", + "UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysyl-D-alanyl-D alanine", + "N-glycosylated immunoglobulin G", + "hemoprotein HasA/out", + "6-O-methylnorlaudanosoline", + "a long-chain (S)-3-hydroxyacyl-CoA", + "3-(4-methylpent-3-en-1-yl)pent-2-enedioyl-CoA", + "oligonucleotides terminated with 5'-phosphate and 3'-hydroxyl moiety", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-tyrosinyl-[protein]", + "complement factor C5", + "(ADP-D-ribosyl)n+1-rab4", + "Smad5", + "filaggrin", + "phosphorylated Prz1", + "active factor VIII", + "Man7GlcNAc2-[carboxypeptidase Y]", + "Escherichia coli group 1 K30 capsule antigen bound to undecaprenyl diphosphate", + "5-methylcytosine38 in tRNAGly precursor", + "N-Acetylneuraminic acid", + "(5alpha)-androstan-17-beta-ol-3-one", + "4alpha-methyl-8,24(28)-ergostadien-3beta-ol", + "3'-end 3'-dAMP-labeled 1,N6-ethenoadenine-thymidine duplex", + "sedoheptulose", + "nucleoside-diphosphate kinase", + "intermediate of cytochrome c peroxidase", + "7beta-hydroxytaxusin", + "succinoyl-CoA", + "myo-inositol triphosphate", + "pGp-tRNAHis", + "5-aminosalicylate", + "retinaldehyde", + "N-hexanoyl homoserine lactone", + "[pyruvate dehydrogenase (lipoamide)]-phosphate", + "C5a", + "phospho-alpha-glucan", + "mannopyranosyl-oligosaccharides", + "ursodeoxycholate 3-sulfate", + "N6-(DELTA2-isopentenyl)-adenine", + "bimane", + "urea-1-carboxylate", + "a [sulfatase]-L-serine", + "(+)-pisatin", + "prenal", + "N-acetyl-D-neuraminic acid", + "protein L-glutamate", + "an N-terminal-L-methionyl-L-leucyl-[L-A double-stranded RNA virus major coat protein]", + "fusaruside", + "Kemptide phosphate", + "20-hydroxyecdysone", + "diacylglycerol", + "5,12-dihydroxanthommatin", + "(ADP-D-ribosyl)-integrin alpha7", + "phospho-L-tyrosinyl-Abl", + "(3S)-3'-hydroxy-L-isoleucine", + "(2E,6E)-farnesoate", + "(8R)-hydroxy-(11R,12R)-epoxyeicosa-(5Z,9E,14Z)-trienoic acid", + "bilirubin/vacuole", + "a medium chain fatty acid or an aromatic acid or an arylacetic acid", + "Arg-Pro-Pro-Gly-Phe-Ser-Pro-Phe", + "beta-D-mannopyranosyl-(1->2)-D-mannopyranose", + "MFLTR", + "1-methylguanine", + "[GlcNAc-(1-4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala)]n diphosphoundecaprenol", + "D-ribitol", + "oleoylglycerol", + "3beta-sulfooxytibolone O-sulfate", + "5-ribosyl-L-homocysteine", + "3-(uracil-3-yl)-L-alanine", + "galactosylceramide 3'-sulfate", + "GLI1", + "dalnigrein 7-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside", + "17alpha,20alpha-dihydroxypregn-4-en-3-one", + "7beta-hydroxycholesterol 3-sulfate", + "kappa-casein", + "1,1,1-trichloro-2,2-bis(4-chlorophenyl)ethane", + "coelenteramide", + "ethyl propionate", + "a 3-oxoacyl-CoA", + "immunoglobulin Fabalpha", + "phosphorylated CREB", + "N-terminal-ubiquitinyl-[NLRP1B]", + "phosphorylated myosin IIB", + "D-Xylulose", + "nitrogen", + "7alpha,12alpha-dihydroxy-3-oxo-5beta-cholan-24-oic acid", + "L-fuculose", + "phosphoethanolamine", + "Rpt6", + "N1-methyladenine22 in tRNASer", + "pilin type IV", + "phosphatidylethanolamine/in", + "glycerophosphoserine", + "L-norisoleucine", + "adenosine diphosphate", + "paramylon", + "labetalol", + "validone 7-phosphate", + "all-trans-4,4'-diaponeurosporene", + "5-methyl-L-kynurenine", + "4-hydroxy-2-oxo-heptanedioate", + "coastal bermuda grass", + "kallikrein prepeptide", + "SC35", + "protein L-isoaspartate methyl ester", + "D-fructose 1-phosphate[side 2]", + "urokinase plasminogen activator receptor", + "D-mannuronate", + "ferrocytochrome cL", + "VTDsYYYPDI", + "(4R,8E)-4-hydroxy-8-sphingenine", + "phosphorylated MAP1B", + "oxaloacetate 4-methyl ester", + "pre-tRNA", + "artemisinic alcohol", + "GlcA-beta-(1->2)-D-Man-alpha-(1->3)-D-Glc-beta-(1->4)-D-Glc-alpha-1 diphospho-dicis,octatrans-undecaprenol", + "L-Arabinose", + "zidovudine", + "gamma-linolenic acid", + "MEP50 protein", + "phosphorylated Glc8 protein", + "10 gallate", + "single-stranded DNA fragments", + "cefalotin", + "renatured RNase A", + "biliverdin IXalpha", + "gelatinase A", + "(R,S)-4-methoxybenzyl alcohol", + "m-tyramine", + "(4-Hydroxyphenyl)pyruvate", + "gentamicin A", + "2 tRNATrp", + "4-O-dimethylallyl-L-tyrosine", + "TadF prepseudopilin leader peptide", + "L-threo-7,8-dihydrobiopterin", + "upRNA", + "fragments of factor X", + "phosphorylated epithelial Na+ channel", + "stigmasta-5,22-dien-3-one", + "collagen XVII/BP180", + "6-deoxy-6-sulfo-D-glucono-1,5-lactone", + "(ADP-D-ribosyl)-Rab9 protein", + "phosphorylated ATF2", + "5alpha-dihydrotestosterone", + "1,6-anhydro-MurNAc-L-Ala-gamma-D-Glu-m-DAP-D-Ala-D-Ala", + "3alpha,20beta-hydroxysteroid androstanes or pregnane derivatives", + "G-protein-coupled receptor GPR107", + "pro-proteinase-activated receptor 2", + "phosphatidyl-(2-O-alpha-D-manno-pyranosyl)-myo-inositol", + "3 diadenosine 5',5''-P1,P4-tetraphosphate", + "(3S)-2,3-oxidosqualene", + "succinic semialdehyde", + "tryprostatin B", + "phosphorylated adenylate kinase 5", + "palmitoleoyl-[acyl-carrier protein]", + "[sulfide quinone oxidoreductase]-tyrosine phosphate", + "stefin B", + "Swollen chorion", + "histone H3 N6-dimethyl-L-lysine4", + "5,10-methylene tetrahydropteroylpentaglutamate", + "all-trans-4,4'-diapolycopene", + "O-phospho-L-homoserine", + "methyl salicylate", + "ethylene", + "hesperitin-dihydrochalcon", + "vetispiradiene", + "40 kDa C-terminal fragment", + "2-ethylhexyl phthalate", + "2'-O-methylcytidine1402 in 16S rRNA", + "2-dehydro-3-deoxy-6-phospho-D-gluconate", + "N-formyl-L-Met-Leu-Phe", + "methyl-accepting chemotaxis protein B L-glutamate", + "procaspase-6", + "4-coumaroylshikimate", + "3-(2-aminophenyl)-3-oxopropanal", + "dNDP", + "alpha-linoleoyl-[glycerolipid]", + "3',5'-cyclic CMP", + "fragments of Rad21", + "N-hydroxy-L-tyrosine", + "poly[(R)-3-hydroxyalkanoate]n+1", + "3,5-dibromo-4-hydroxybenzonitrile", + "[protein]-trans-4-hydroxy-L-proline", + "2-ketoisocaproate", + "oxidized adrenodoxin", + "donor xyloglucan", + "membrane type IV collagen", + "stearoyl-[acyl-carrier-protein]", + "(8E)-9-[(1E,3Z)-nona-1,3-dien-1-yloxy]non-8-enoic acid", + "N7-adipylaminodeacetoxycephalosporanic acid", + "maltotriose 6''-phosphate[side 2]", + "O-acetyl sialic acid polymer", + "2-chloroethanol", + "[RNA ligase]-L-lysine", + "Cu2+/out", + "[CysO sulfur-carrier protein]-Gly-NH-CH2-C(O)-S-L-cysteine", + "MurNAc-L-Ala-D-isoglutaminyl-L-Lys-(N6-tri-Gly)-D-Ala-D-Ala-diphospho ditrans,octacis-undecaprenyl-GlcNAc", + "guanosine 5'-phosphate", + "2'-O-methylguanosine2251 in 23S rRNA", + "N-[7-[(2-sulfoethyl)dithio]heptanoyl]-O3-phospho-L-threonine", + "cleaved SpoIVFA", + "beta-amyloid peptide", + "[histone H3]-N6-acetyl-L-lysine18", + "oxidized acceptor", + "active basic vacuolar chitinase", + "cyclobutadipyrimidine (in DNA)", + "4'-phosphopantothenate", + "8-ethyl-12-methyl-3-vinylbacteriochlorophyllide d", + "crocetin dialdehyde", + "a 1-alpha-linolenoyl 2-acyl-sn-glycerol 3-phosphate", + "[dihydrolipoyllysine-residue acetyltransferase]-lipoyllysine", + "2-chlorobenzoyl-CoA", + "RhdA", + "L-rhamnose", + "2 phosphate", + "3-oxo-dodecanoyl-[acyl-carrier protein]", + "histone", + "[SmD3 protein]-Nomega,Nomega'-dimethyl-L-arginine", + "MnATP2-", + "Arabidopsis thaliana protein AT3G11330", + "RNA polymerase II C-terminal repeat domain", + "(R)-propane-1,2-diol", + "cis-muurola-4(14),5-diene", + "dextran", + "trans-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide", + "di-trans,poly-cis-nonaprenyl diphosphate", + "endothelin-1 (1-31)", + "neurolysin", + "5-D-(5/6)-5-C-(hydroxymethyl)-2,6-dihydroxycyclohex-2-en-1-one", + "L-5-hydroxytryptophan", + "anthocyanidin", + "D-carboxymethylcysteinyl-6-aminopenicillanic acid", + "phosphorylated casein kinase 1 delta", + "cyclopentanol", + "N-acetyl-beta-D-glucosaminyl-(1->3)-N-acetyl-alpha-D-galactosaminyl Ser/Thr", + "11beta-hydroxytestosterone", + "D-3-hydroxy-3-methylglutaryl-CoA", + "(2E,6E)-farnesyl diphosphate", + "plasminogen activator inhibitor type-1", + "nicotinic acid ribonucleoside", + "guanine1575 in 18S rRNA", + "D-altritol", + "2-ketoglutaramate", + "polyphosphate60", + "Benzoate", + "3-oxocholan-24-oyl-CoA", + "N1-methylguanine9 in tRNAAsp", + "methylisoeugenol", + "presqualene diphosphate", + "reduced pseudoazurin", + "an N-hydroxyarylamine", + "1-beta-D-arabinosylcytosine 5'-phosphate", + "2,6-diaminopyridine-cellulose", + "(5Z,13E)-(15S)-9alpha,11beta,15-trihydroxyprosta-5,13-dienoate", + "pentose", + "camphene", + "sphingosine kinase 2", + "1-methyl-4-phenylpyridinium", + "3'-adenylyl-sulfate", + "hexadecanal", + "alpha-spectrin", + "adenine2030 in 23S rRNA", + "3-oxo-3-ureidopropanoate", + "cytosine49 in tRNAPhe(GAA)", + "[(1->2)-beta-D-glucosyl]n-1", + "topoisomerase-IIalpha", + "1,2-dideoxy-2-ethylhexo-3,4-diulose", + "1,2(or 1,3)-alpha-D-mannosylheteroglycan", + "cytochrome c", + "5-methyluracil747 in 23S rRNA", + "7-oxocholesterol", + "N-dodecanoyl-L-homoserine", + "3,4-dihydroxy-phenylacetaldehyde", + "phenazine-1-carboxylic acid", + "phenethylamine N-oxide", + "D-mannitol 1-phosphate[side 2]", + "4-O-methyl-D-glucuroxylan", + "kanamycin A", + "creatine", + "1-acyl-2-arachidonoyl-lysophosphatidylcholine", + "isowyosine", + "N-((R)-4-Phosphopantothenoyl)-L-Cys", + "pro-kallikrein 1", + "bialaphos", + "ErbB3", + "2-aminoadipate 6-semialdehyde", + "coclaurine", + "arginine/out", + "2 o-diphenol", + "[propionyl-CoA:carbon-dioxide ligase (ADP-forming)]", + "(4E,6E)-2-methyl-3-hydroxyocta-4,6-dienoyl-S-ACP", + "dermatan 4'-sulfate", + "2-amino-3-carboxymuconate semialdehyde", + "[histone H4]-L-histidine", + "4,4'-diapolycopen-4-oate", + "dihydroferuloyl-CoA", + "gluten peptides", + "acetoacyl-[acyl-carrier protein]", + "phosphorylated S6 protein of the 40s ribosomal subunit", + "1H-indole-3-carboxylate", + "baicalein", + "D-galactaro-1,4-lactone", + "phospholipid", + "D-hexose", + "(S)-tetrahydrocolumbamine", + "heregulin", + "eukaryotic translation initiation factor 4B", + "chenodeoxycholylglycine/in", + "cytosine48 in tRNAIle(AAU)", + "an (R)-2-hydroxycarboxylate", + "glycerophosphorylcholine", + "neuregulin receptor ErbB3", + "N-carbamoyl-D-4-hydroxyphenylglycine", + "dimethyl-paraoxon", + "2-amino-4,5-dihydroxy-6-oxo-7-(phosphonooxy)heptanoate", + "a beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-R", + "N-propionyl-D-glutamine", + "hydroxyfenbendazole", + "L-Ala-gamma-D-Glu-meso-diaminopimelic acid/out", + "opine", + "fluoride", + "2,3-dimethyl-6-phytyl-1,4-benzoquinone", + "[methyl-Co(III) trimethylamine-specific corrinoid protein]", + "17beta-estradiol 3-sulfate", + "phosphorylated KCNN2 protein", + "CRE-binding phosphoprotein", + "D-glutamate", + "IGF-binding protein-2", + "(beta-1,4-galactan)n", + "cyclo(L-tryptophanyl-L-tryptophanyl)", + "eukaryotic translation initiation factor eIF-5A hypusine", + "inulotetraose", + "HNP-1 propeptide", + "8-amino-3,8-dideoxy-alpha-D-manno-octulosonate", + "7-aminocoumarin-3-carboxylic acid", + "kappa-neocarratetraose", + "protocatechuoyl beta-D-glucoside", + "4-O-(beta-D-glucopyranosyl)-4-hydroxycinnamate", + "[histone H3]-N6,N6-dimethyl-L-lysine36", + "oligosaccharide phosphate", + "3 Na+[side 1]", + "7,9,7',9'-tetracis-lycopene", + "alpha-N-acetylneuraminyl-2,6-beta-D-galactosyl-1 4-N-acetyl-beta-D-glucosamine", + "(4R,5R)-4,5-dihydroxycyclohexa-1(6),2-diene-1-carboxylate", + "5'-dephospho-RNA", + "sulfane sulfur", + "(-)-albendazole s-oxide", + "(3E)-4,8-dimethylnona-1,3,7-triene", + "2,3-dihydro-2,3-dihydroxybenzoyl-CoA", + "caffeoylglucaric acid", + "Bap31 protein", + "[methyl-coenzyme M reductase alpha-subunit McrA]-glycine465", + "5-methylcytosine50 in tRNAGly precursor", + "2 ferricytochrome P450", + "phosphorylated CREB1 protein", + "LL-37 antimicrobial peptide", + "chondroitin 6-sulfate", + "2-butyloctyl sulfate", + "[p53 protein]-L-lysine", + "3-hydroxy-2-methylpropanoyl-CoA", + "[heparan sulfate]-D-sulfoglucosamine", + "7-deoxyloganate", + "[KCa3.1 channel protein]-N-phospho-L-histidine", + "D-mannan", + "acrylate", + "tritrans,heptacis-undecaprenyl phosphate", + "[amino-group carrier protein LysW]-C-terminal-gamma-(alpha-aminoadipate) phosphate", + "a [histone H3]-N6-methyl-L-lysine27", + "1-linoleoyl-2-acyl-[glycerolipid]", + "(4S)-3-[(5S)-5-(4-fluorophenyl)-5-hydroxypentanoyl]-4-phenyl-1 3-oxazolidin-2-one", + "a beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminyl-R", + "D-beta-phenylalanine", + "11a-hydroxytigecycline", + "1,2-D-glucosyl-5-D-(galactosyloxy)-L-lysine-procollagen", + "acetonitrile", + "2,4-dichlorophenoxyacetate", + "cyclopentylamine", + "[(1->2)-beta-D-glucosyl]n-2", + "protein L-isoaspartate alpha-methyl ester", + "a (5Z,8Z,11Z,14Z)-icosatetra-5,8,11,14-tetraenoyl-[glycerolipid]", + "tetrahydrosarcinapterin", + "2-hydroxy-5-methylthio-pent-1-ene-3-one phosphate", + "meso-Diaminoheptanedioate", + "IkappaB protein", + "[CDC6]-N6-acetyl-L-lysine", + "phospho-CREB", + "diphospho-myo-inositol polyphosphate", + "glucoevatromonoside", + "nicked circular single stranded DNA containing mismatches", + "phospholipid/out", + "N-carbamoyl glycine", + "2'-deoxy-3'-thiacytidine 5'-phosphate", + "chloroalanine", + "cyanidin 3-O-beta-D-rutinoside", + "N-hydroxyaniline", + "10-S-glutathionyl-12-oxo-phytodienoic acid", + "1-acyl-lysophosphatidylglycerol", + "mitochondrial tRNAArg(UCU) pseudouridine27", + "3 Na+[side 2]", + "3-ketosteroids", + "3 menaquinone", + "Isonocardicin A", + "D-galactose/in", + "Prostaglandin H2", + "3-hydroxy-5-methyl-L-tyrosine", + "D-Trp", + "2'-deoxy-1-riburonosylcytosine", + "collagen type IV", + "guanosine 5'-(thio)triphosphate", + "1,2-diacyl-sn-glycerol", + "7-aminocarboxypropyl-demethylwyosine", + "O-antigen serotype Xv (2-aminoethyl diphosphate)", + "estrone sulfate", + "docosenol", + "dTDP-alpha-D-fucopyranose", + "inosine diphosphate", + "(Man)5GlcNAc", + "immunoglobulin A1 Fabalpha fragments", + "feruloyl-polysaccharide", + "acyl-[acyl-carrier protein]", + "Msmeg1704/in", + "Lassa virus glycoprotein precursor protein", + "ganglioside", + "deamino-NAD+", + "phosphorylated Arabidopsis thaliana proteins AT3G11330", + "2 ferrocytochrome c", + "5-oxo-4,5-dihydrofuran-2-acetate", + "DNp63a", + "loganate", + "NCAM", + "a 7-(hydroxymethyl)bacteriochlorophyllide c", + "Trypsinogen", + "arylated EntB", + "phosphorylated Rabin8", + "GEP100", + "3-hydroxybutyrate", + "methyl 4-hydroxybenzoate", + "CH4", + "Oleate", + "D-ononitol", + "gibberellin a9", + "SSH1L protein", + "5-valerolactone", + "CYLD", + "(S)-1-(6-fluoro-2-methyl-3 4-dihydroquinolin-1(2H)-yl)-2-(isoquinolin-5-yloxy)ethanone", + "1,4-alpha-D-glucan", + "5-methyltetrahydrofolate", + "serotonin N-acetyltransferase", + "protein RyR", + "phosphorylated A-kinase anchor protein", + "N-carbamoyl-L-methionine", + "peptidyl-L-alanine", + "Msmeg1704 out", + "apoprotein", + "diethyl-parathion", + "8 NAD(P)H", + "a 3-sn-phosphatidate", + "acyl phosphate", + "UDP-N-acetyl-alpha-D-muramoyl-L-alanyl-D-glutamyl-N6-(L-alanyl)-L-lysyl D-alanyl-D-alanine", + "beta-androstenol", + "fatty acyl-CoA/trans", + "[CpG]-serine/threonine", + "Man6", + "Bi3+-glutathione[side 2]", + "2-hydroxybenzoate", + "orotidine 5-phosphate", + "mannobiose", + "hexanoyl-6-aminopenicillanic acid", + "core 4 oligosaccharide", + "L-hyoscyamine", + "Fe-coproporphyrin III", + "N6-(2-aminobenzoyl)-L-Lys-L-Pro-L-Pro-4-nitroanilide", + "(acetamidomethyl)phosphonate", + "cPD1 protein", + "soya lecithin", + "stachyose", + "biochanin A", + "6-phosphono-D-gluconate", + "9-riburonosylguanine", + "Notch1 protein", + "2-carboxy-cis,cis-muconate", + "isobutylhydantoin", + "[p53]-L-lysine", + "3,6-dichloropyridine-2,5-diol", + "(2E)-3-phenylprop-2-enoyl-CoA", + "phenylacetate", + "[Co(I) glycine betaine-specific corrinoid protein MV8465]", + "CMP-N-glycolneuraminate", + "(+/-)-pavine", + "1H-3-Hydroxy-4-oxoquinaldine", + "apo-[acetyl-CoA carboxylase 2]", + "[dopamine D1 receptor]", + "UDP-4-amino-4-deoxy-beta-L-arabinopyranose", + "Man8GlcNAc2 (isomer 8A1,2,3B1,3)", + "phosphorylated 4E-BP1 protein", + "Fe2+-protoporphyrin IX", + "elastin", + "[protein]-serine/threonine", + "(3S)-linalool", + "O-phospho-L-seryl-[Eukaryotic initiation factor 2]", + "3 nitrite", + "(Glc)4", + "(R)-5-phosphomevalonate", + "[Notch1 protein with EGF-like domain 12]-3-O-(beta-D-xylosyl)-L-serine", + "cytosine34 in tRNA precursor", + "microtubule", + "sorboyl beta-D-glucoside", + "(+)-beta-chamigrene", + "5-caffeoylquinate", + "[beta2-adrenergic receptor] phosphate", + "5-hydroxymethyluracil-mismatched single-stranded DNA", + "interleukin 6 receptor", + "6-hydroxynicotine", + "(2E)-hexadec-2-enoyl-CoA", + "phosphorylated Raf-1 kinase", + "(2R)-2-[((R)-([(2R)-2-amino-2-(4 hydroxyphenyl)acetyl]amino)carboxy)methyl]-5-methyl-3,6-dihydro-2H-1 3-thiazine-4-carboxylic acid", + "4-fluorobenzoic acid", + "(ferricytochrome c)-subunit", + "a [prolipoprotein]-L-cysteine", + "(S)-3-hydroxyisobutyryl-CoA", + "reduced cytochrome c550", + "glucose-dependent insulinotropic polypeptide precursor", + "3,3',4',5,7-pentahydroxyflavone", + "pro-factor B", + "nitrite/in", + "cytosine49 in tRNAGln(UUG)", + "3-oxo-4-methylpentanoyl-[acyl-carrier protein]", + "1-(4-amino-2-methylpyrimid-5-ylmethyl)-3-(beta-hydroxyethyl)-2 methylpyridinium bromide", + "3-hydroxytibolone", + "cytosine49 in tRNAGly(UCC)", + "[PurA]-serine/threonine", + "3-(methylthio)acryloyl-CoA", + "L-pyroglutamate", + "13-hydroxylupanine", + "RyR", + "N-(stearoyl)-sphinganine", + "2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid", + "phospholipid/in", + "tamoxifen beta-D-glucuronoside", + "neuregulin receptor ErbB2", + "3-deoxy-2-dehydro-L-threo-hexarate", + "xyloglucooligosaccharides", + "Munc-18", + "momilactone A", + "myosin II heavy chain", + "adenosylcobyrinic acid a,c-diamide", + "a 4'-methoxyisoflavone", + "inositol pentakisphosphate", + "3alpha-hydroxy-ent-kaurene", + "DELTA1-piperideine-2-carboxylate", + "2,3-dimethylmaleate", + "double-stranded DNA-1-methyladenine", + "beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D GlcNAc-(1->2)-[beta-D-GlcNAc-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1 >4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc-N-Asn-[protein]", + "interleukin-36 receptor antagonist", + "Formyl-CoA", + "3 S-methyl-5'-thioadenosine", + "alpha-D-Xyl-(1->6)-beta-D-Glc-(1->4)-[alpha-D-Xyl-(1->6)]-beta-D-Glc-(1 >4)-[alpha-D-Xyl-(1->6)]-beta-D-Glc-(1->4)-D-Glc", + "25000 Da fragment", + "1alpha,24,25-trihydroxyvitamin D3", + "N3-methylcytosine", + "lithocholic acid", + "methyl-CoM", + "C-terminal [mycofactocin precursor peptide MftA]-glycyl-L-valyl-L-tyrosine", + "2,3-dihydroxybenzoyl-[aryl-carrier protein EntB]", + "2-[(3S)-3-amino-3-carboxypropyl]-L-histidine715-[translation elongation factor 2]", + "3-methylbenzyl alcohol", + "dithiothreitol", + "GDP-D-talometylose", + "tabun", + "1-(5-phosphoribosyl)-5-[(5 phosphoribosylamino)methylideneamino]imidazole-4-carboxamide", + "O-phospho-L-serine", + "alpha-aminoacyl-tRNA2", + "13-hydroperoxyoctadeca-9,11-dienoate", + "guanine1835 in 23S rRNA", + "20-hydroxy-5,8,11,14-eicosatetraenoic acid", + "dipyridamole/out", + "4-trimethylaminobutyraldehyde", + "glucooligosaccharide", + "acetylhistone", + "histone deacetylase 8", + "glutathione amide disulfide", + "3beta-hydroxyandrost-5-en-17-one", + "L-tetrahomomethionine", + "(24R,241R)-fucosterol epoxide", + "phosphorylated pocket protein 130", + "heparan sulfate proteolycan", + "3-methoxy-4',5-dihydroxy-trans-stilbene", + "deamido bleomycin A2", + "1-oleoylglycerophosphocholine", + "(S)-tembetarine", + "n NTP", + "(-)-beta-2',3'-dideoxy-3'-thiacytidine 5'-phosphate", + "neomorphinone", + "HER-2", + "lactosyl-N-acylsphingosine", + "L-alanyl-D-glutamate", + "[D-galactose-binding protein AcbH][side 1]", + "Chondroitin D-glucuronate", + "reaction centre protein D2", + "E-cadherin", + "internexin", + "gliadin N5-alkylglutamine", + "TusE-SSH", + "ethyl (2R)-ethyl-(3S)-hydroxybutanoate", + "thio-NADH", + "CREB-binding phosphoprotein", + "[protein HPr]-Npi-phospho-L-histidine", + "(8R)-HPETE", + "PPS-CONH2", + "protein S100A10 glutamine", + "triolein", + "clofarabine", + "3,4-dihydroxyphenylpropanoate", + "long-chain fatty alcohol", + "methyl viologen", + "S-(prostaglandin A2)glutathione[side 2]", + "1-(2-chlorophenyl)ethanol", + "2-hydroxymethyl-6-methylnaphthalene", + "12-hydroxyoctadecanoic acid", + "phosphonoacetylaldehyde", + "4-O-((2R)-1-glycerophospho)-N-acetyl-beta-D-mannosaminyl-(1->4)-N acetyl-alpha-D-glucosaminyl-diphospho-ditrans,octacis-undecaprenol", + "1,3-dihydroxybenzene", + "Eph tyrosine kinase receptor EphB2", + "N-acetyl-D-galactosaminyl-1,3-D-galactosyl-R", + "erythromycin-2'-O-phosphate", + "4-phosphopantoate", + "itaconate", + "2-amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine", + "ssDNA", + "cyclic dehypoxanthine futalosine", + "28S rRNA", + "[chloroplastic fructose 1,6-bisphosphate aldolase isoform 3]-N6-methyl-L-lysine", + "2-hexenoyl-CoA", + "B-type natriuretic peptide", + "epinephrine", + "dTDP-3-dimethylamino-4,6-dideoxy-alpha-D-glucopyranose", + "coumaric aldehyde", + "Hg(0)", + "2-naphthaldehyde", + "ginsenoside Rg2", + "3-[(1-carboxyvinyl)oxy]benzoate", + "alpha-Kdo-(2->4)-Kdo-(2->6)-[4-P-L-Ara4N]-lipid A", + "KCNN2 protein", + "ovalbumin disulfide", + "27-O-demethylrifamycin SV", + "Gal-beta-1,4GlcNAc-beta-1-R", + "adenosylcobalamin", + "(ADP-D-ribosyl)-p53", + "Isoquinoline", + "tRNAThr1", + "[cullin-1]-L-lysine", + "FLIPL protein", + "2-amino-4,7-dihydroxypteridine", + "delphinidin 3-O-glucoside", + "leachianone G", + "alpha-N-acetylneuraminyl-2,3-beta-D-galactosyl-1 3-(N-acetylneuraminyl-2,6)-N-acetyl-D-galactosaminyl-R", + "biliverdin-IXa", + "2-deoxy-2-[[(3R)-3-hydroxypentadecanoyl]amino]-3-O-[(3R)-3 hydroxytetradecanoyl]-4-O-phosphono-beta-D-glucopyranosyl-(1->6)-2 deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[[(3R)-3 hydroxytetradecanoyl]amino]-1-O-phosphono-alpha-D-glucopyranose", + "abietate", + "3,5,7-trioxododecanoyl-CoA", + "L-Glu", + "2'-O-methyluridine2918 in 25S rRNA", + "3 tert-butyl hydroperoxide", + "phosphorylated Tus1", + "dopamine 3-O-sulfate", + "xylooligosaccharides", + "N-D-ribosylpyrimidine", + "a trans-2,3-dehydroacyl-[acyl-carrier protein]", + "a 2-oxo carboxylate", + "4-fluorocyclohexa-1,5-diene-1-carbonyl-CoA", + "TadE pseudopilin", + "LVCGERGF", + "dTDP-D-fucose", + "2 cob(II)alamin", + "[protein]-S-palmitoyl-L-cysteine", + "cytochrome c peroxidase", + "MOC3 protein", + "an aromatic oxo acid", + "beta-amyloid", + "N-(2,3-dihydroxybenzoyl)-L-serine", + "pyridin-1-ium-3,5-bisthiocarboxylate mononucleotide", + "11 H+", + "phospho-protein kinase C", + "N2-succinyl-L-arginine", + "[very long-chain acyl-CoA dehydrogenase]-L-lysine", + "O-phospho -[tau-protein]", + "(R)-4-phosphopantoate", + "5-methylcytosine40 in tRNA precursor", + "an N-terminal Nalpha-acetyl-L-methionyl-L-aspartyl-[protein]", + "D-chiro-inositol", + "N-carbamoylsarcosine", + "chanoclavine-I", + "5-methylcytosine38 in tRNAVal precursor", + "hexadec-6-enoic acid", + "fumarylpyruvate", + "L-selenocysteine", + "delta-carotene", + "pilin EpdD", + "myo-inositol 6-phosphate", + "4-bromobenzoyl-CoA", + "alpha(2-3)sialyl-lactose", + "hydrogen cyanide", + "lychnose", + "glucovanillin", + "4-hydroxy-N-desmethyl-tamoxifen", + "bovine serum albumin", + "(2S)-sakuranetin", + "'activated' tRNA", + "1D-myo-inositol 1,3,4,5,6-pentakisphosphate", + "(2S,3R)-3-Hydroxybutane-1,2,3-tricarboxylate", + "a 2-methyl-branched Cn-1-fatty aldehyde", + "2 nitric oxide", + "[SAMP1]-Gly-Gly-AMP", + "3-(5-oxoisoxazolin-4-yl)-L-alanine", + "N-acetyl-S-geranylgeranyl-L-cysteine", + "(22S,24R)-22-hydroxy-5alpha-ergostan-3-one", + "8-methyl-nonanoyl-CoA", + "cell wall of Micrococcus lysodeikticus", + "6-gingerol 4'-O-beta-D-glucuronoside", + "estradiol", + "11beta,21-dihydroxypregn-4-en-3,20-dione", + "[E2 ubiquitin-conjugating enzyme]-S-ubiquitinyl-L-cysteine", + "cholest-5-ene-3beta,7alpha,25-triol", + "7-hydroxydodecanoate", + "[E2 NEDD8-conjugating enzyme]-S-[NEDD8-protein]-yl-L-cysteine", + "N6-methyladenine in mRNA", + "cytosine1407 in 16S rRNA", + "H+/in", + "L-2,4-diaminobutanoate", + "a flavanone 7-O-beta-D-glucoside", + "DNA containing 8-oxoguanine residues", + "sesterfisherol", + "plasminon", + "3-hydroxy-L-phenylalanine", + "3 N,N'-diacetylchitobiose", + "2-naphthylamine sulfate", + "neurosporene", + "N-acyl-(S)-homoserine lactone", + "mannitol 1-phosphate", + "apocarboxylase", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-alanyl-[protein]", + "D-xylonolactone", + "phosphorylated Smad5", + "polyarginine", + "alpha-N-acetyl-D-glucosaminyl-(1-4)-beta-D-glucuronosyl-(1-3)-beta-D galactosyl-(1-3)-beta-D-galactosyl-(1-4)-beta-D-xylosyl-proteoglycan", + "detyrosinated tubulin", + "FK506-binding protein 4", + "6 NADP+", + "phosphonate", + "CD26L", + "4-hydroxy-3-methoxybenzoate", + "phosphotyrosine", + "7-nitrocoumarin-3-carboxylic acid", + "3-O-hexadecyl-2-acetyl-sn-glycero-1-phosphocholine", + "5,10-methylene-tetrahydrofolate", + "an aliphatic nitrile", + "4-methyl-3-hydroxyanthranilic acid", + "UDP-2-acetamido-3-amino-2,3-dideoxy-alpha-D-glucopyranose", + "CMP-N-glycoloylneuraminate", + "1D-1-guanidino-3-amino-1,3-dideoxy-scyllo-inositol", + "oleanolate 3-O-beta-D-glucoside", + "[F-actin]-L-methionine-(R)-S-oxide", + "27beta-hydroxywithanone 27-beta-D-glucoside", + "MKK6", + "4 O2", + "acetylsalicylate", + "beta subunit of voltage-gated sodium channel", + "YKY", + "methyl phenyl sulfide", + "H+[side 2]", + "gentisyl-CoA", + "7-O-methylluteone", + "3 purine", + "narbomycin", + "annexin V", + "dTDP-D-glucose", + "pre-snRNA", + "lysosphingomyelin", + "epsilon-(gamma-L-glutamyl)-L-lysine", + "microcystin-LR", + "oligo(3-hydroxybutyrate)", + "mannosylphosphodecaprenol", + "Fibrinogen", + "n H2O", + "N-acyl-D-mannosamine", + "1,2-diacylglycerol", + "canaline", + "hydrogenobyrinic acid a,c-diamide", + "4-hydroxy-L-proline", + "18-hydroxylinolenic acid", + "(-)-epigallocatechin", + "3,5'-diiodo-L-thyronine", + "C3a+SN", + "2 S-adenosylhomocysteine", + "alpha-NAD(P)H", + "beta-tubulin", + "2-(hydroxysulfanyl)hercynine", + "cellodextrin", + "BAF155", + "trimethyl-histone 3 L-lysine 36", + "N-acetyl-lysine4-histone H3", + "7-[(3S)-(3-amino-3-carboxypropyl)-4-methyl]wyosine37 in tRNAPhe", + "HRV 3Cpro precursor 3CD", + "5-O-beta-mycaminosyltylonolide", + "monosaccharides of alginate", + "asperlicin C", + "Ac-HLLPPPS-CONH2", + "[histone H2B]-N6-acetyl-L-lysine12", + "an alpha-amino acid", + "citrus galactan", + "lipid IVB", + "cembrene A", + "3-hydroxy-5-methyl-1-naphthoate", + "polycistronic mRNA precursor", + "(S)-4-amino-5-oxopentanoate", + "L-Glu/out", + "phosphorylated Mid1p", + "TRF1", + "glucagon-like peptide 2", + "nucleoside 3'-phosphates", + "hydroxyacetone", + "5-aminoimidazole-(N-succinylocarboxamide) ribotide", + "Fuc-alpha-(1->2)-Gal-beta-(1->3)-[Fuc-alpha-(1->6)]GlcNAc-beta-(1->3) Gal-beta-(1->4)GlcNAc", + "D-xylose", + "2-acetolactate", + "D-galactosylsphingoside", + "an N-terminal-Nalpha-acetyl-L-alanyl-[protein]", + "N-acetyl-alpha-D-glucosaminyl-(1-4)-beta-D-glucuronosyl-proteoglycan", + "quercetin 4'-O-beta-D-glucopyranoside", + "maltose 6'-phosphate[side 2]", + "interleukin-18", + "D-ribose[side 2]", + "4 H+[side 1]", + "(4R,6S)-trans-carveol", + "fructose 6-phosphate", + "ent-copalyl diphosphate", + "CXCR2", + "2 4-methylcatechol", + "magnesium-protoporphyrin monomethyl ester", + "oleanolic aldehyde", + "L1 adhesion molecule", + "[PykA]-serine/threonine phosphate", + "Nalpha-acetyl-[Orc1p]", + "methimazole", + "N1-methyladenine58 in tRNALys3", + "2-acyl-sn-glycero-3-phosphatidylcholine", + "folate", + "3-O-L-alanyl-1-O-phosphatidylglycerol", + "N2", + "phosphorylated Arabidopsis thaliana proteins AT4G38710", + "type II collagen", + "immunoglobulin A1", + "3,5-bisphosphomevalonate", + "N-Acyl-D-mannosamine", + "2,3-Diphosphoglycerate", + "5-amino-6-(5-phospho-D-ribosylamino)uracil", + "Shc protein", + "D-galactono-1,5-lactone", + "22000 Da 3A-like protein", + "an archaeal dolichyl phosphooligosaccharide", + "phosphatidylinositol 5-phosphate", + "trichloroanisole", + "5-(biotinamido)pentylamine", + "N-heptylpantothenamide 4-phosphate", + "[heat-stable phosphocarrier protein]-Npi-phospho-L-histidine", + "naphthalene-1,2-diol", + "stearidonoyl-[glycerolipid]", + "NO3-", + "3,4,6,7-tetramethyldibenzothiophene", + "PAR2", + "STAU2", + "40 ADP", + "Fe3+/in", + "8 e-", + "1-(5-phosphoribosyl)-ATP", + "alpha-D-ribose 1,2-cyclic-phosphate 5-phosphate", + "[(1->4)-beta-D-glucosyl]n-1", + "zeaxanthin", + "D-proline", + "polyphosphate glass type 15", + "N-formyl-5-hydroxy-L-kynurenine", + "12-epi-hapalindole U", + "[antifreeze glycoprotein]-(O-3-(beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->)))-L threonine", + "beta-L-fucose 1-phosphate", + "beta-D-galactosyl-(1->4)-beta-N-acetyl-D-glucosaminyl-R", + "(20S)-protopanaxadiol", + "uridylyl-GlnZ", + "4beta-hydroxymethyl-4alpha-methyl-5alpha-cholest-7-en-3beta-ol", + "phosphorylated Sty1", + "[T-cell intracellular antigen 1 phosphoprotein]", + "5'-deoxy-5'-methylthioadenosine", + "5-O-methyl-myo-inositol", + "(indol-3-yl)pyruvate", + "mycoredoxin disulfide", + "acetylhistone H4", + "3-methylmuconolactone", + "monoglutamyl folate", + "[protein]-S8-aminomethyldihydrolipoyllysine", + "feruloylputrescine", + "(RS)-tetrahydrocolumbamine", + "N-acetyl-D-glucosamine", + "peracetic acid", + "3-phenylpropanoate", + "5,10-methenyl-5,6,7,8-tetrahydromethanopterin", + "3-amino-2-hydroxy-4-methoxybenzoate", + "(-)-cocaine", + "[histidine kinase ArcB]-N-phospho-L-histidine", + "N2-sulfo-D-glucosamine 3-sulfate units", + "5,7,4'-trihydroxyflavone", + "formyl phosphate", + "peroxyaminoacrylate", + "S-sulfanyl-SufE", + "(RS)-norcoclaurine", + "2-deoxy-5-keto-D-gluconic acid 6-phosphate", + "beta-D-fructofuranosyl-alpha-D-glucopyranoside", + "4-aminohippuric acid/in", + "2-(2-O-(alpha-D-mannopyranosyl)-alpha-D-glucopyranosyl)-3-phospho-D glycerate", + "phosphorylated protein LRP6", + "2-sulfoacetaldehyde", + "an N-terminal-Nalpha-acetyl-L-seryl-[histone H4]", + "D-3,4-dihydroxyphenylalanine", + "rhodotorulic acid/out", + "geranylgeranylchlorophyllide a", + "9-cis,11-trans-linoleic acid", + "protein Ntau-methyl-L-histidine73", + "benzo[a]pyrene", + "catechin", + "geranylgeranyl bacteriopheophytin a", + "5'-phospho-DNA", + "[factor IX protein with EGF-like domain]-L-serine", + "N6-hydroxy-L-lysine", + "tetrahydropteroyl-[gamma-Glu]n", + "mature ds-rRNA", + "alpha-linolenate", + "phospho-HPr", + "5-(glutathione-S-yl)-N-methyl-alpha-methyldopamine/in", + "5-methylphenazine-1-carboxylate", + "alpha-(1,4)-glycosidic linked cyclodextrins", + "2-(1-D-mannosyl)-3-phosphoglycerate", + "cytosine49 in tRNAPro(UGG)", + "S-prenyl-L-cysteine", + "(2R)-2-methylacyl-CoA", + "2-arylpropionic amide", + "2 ferricytochrome c552", + "1,3-beta-D-galactosyl-(alpha-(1,4)-L-fucosyl)-N-acetyl-D-glucosaminyl-R", + "4-vinylguaiacol", + "glycogenin-1", + "1D-myo-inositol 1,3,4,6-tetrakisphosphate", + "[dihydrolipoyllysine-residue (2-methylpropanoyl)transferase] lipoyllysine", + "UDP-N-acetyl-alpha-D-muramoyl-L-alanine", + "5-[(4-hydroxyphenyl)methyl]-3-imino-4,4-dimethylpyrrolidin-2-one", + "[dihydrolipoyllysine-residue acetyltransferase] S-acetyldihydrolipoyllysine", + "[beta-D-fructosyl-(2->1)-]m-1", + "trans-5-O-(4-coumaroyl)-D-quinate", + "K+[side 1]", + "DraR L-histidine", + "wheat straw xylan", + "D-galactose[side 2]", + "ditrans,polycis-polyprenyl diphosphate", + "TDP-D-glucose", + "benzene-1,2,4-triol", + "peptidylglycine", + "5-methylcytosine48 in tRNALeu(CAA)", + "celecoxib/in", + "beta-D-fructofuranose", + "reduced soluble guanylate cyclase", + "cytosine48 in tRNAVal(CAC)", + "TNF-alpha", + "ribosomal protein L12-L-methionine (S)-sulfoxide", + "3beta-hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carbaldehyde", + "poly(3-hydroxypropionate)", + "cis-14,15-epoxyeicosatrienoic acid", + "histone H1", + "human cartilage collagen type II", + "Man3GlcNAc", + "CEP89", + "transforming growth factor-beta1", + "(11E)-11-tetradecenoate", + "membrane-bound stem cell factor", + "(2S,3S)-3-hydroxyarginine", + "type 1 IGF receptor pro-form", + "(S)-1-pyrroline-5-carboxylate", + "heptadecane", + "(4S,5S)-4,5-dihydroxy-2,6-dioxohexanoate", + "(+)-marmesin", + "isobutyraldehyde", + "N6-(dimethylallyl) adenosine 5'-triphosphate", + "Pyr-RTKR", + "flap DNA", + "paraxanthine", + "GlcAbeta(1-3)-Galbeta(1-3)Galbeta(1-4)Xyl", + "stemod-13-ene", + "glycerol 1-phosphate", + "(2S)-2-phospholactate", + "trans-5-chloro-2-methyldienelactone", + "(1R,6S)-6-amino-5-hydroxycyclohexa-2,4-diene-1-carboxylic acid", + "3alpha,7beta-dihydroxy-12-keto-5beta-cholanoic acid", + "long-chain fatty ester", + "phosphorylated Mad3", + "[FHA-1]-tyrosine phosphate", + "3,4-dihydroxyphenylpropanoyl-CoA", + "9-[beta-D-arabinofuranosyl]-2-fluoro-adenine", + "[TGF-beta receptor II] phosphate", + "ribose 5-phosphate", + "2,3-dihydroxypropane-1-sulfonate", + "2-methyl-3-hydroxypyridine-5-carboxylic acid", + "(-)-catechin gallate", + "factor XII", + "D-xylulose-5-phosphate", + "preflagellin leader peptide", + "Man7GlcNAc2-[ricin A-chain]", + "cytosine48 in tRNAThr(CGT)", + "2'-O-methylcytidine56 in elongator tRNAMet", + "Neuromedin B", + "alpha-D-galactosyl-(1-4)-beta-D-galactosyl-(1-4)-D-glucosyl-(1-1) ceramide", + "naringenin 7-O-[beta-L-rhamnosyl-(1-2)-beta-D-glucoside]", + "complement component C2a", + "FAK", + "[Wnt3a]-O-(9Z)-hexadec-9-enoyl-L-serine", + "geranic acid", + "glucobrassicin", + "5,10-dihydrophenazine 1-carboxylate", + "alpha-D-Man-(1->6)-[beta-D-GlcNAc(1->2)-alpha-D-Man(1->3)]-beta-D-Man (1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc", + "senecionine N-oxide", + "pro-thyrotropin-releasing hormone", + "3-hydroxybenzyl 4-hydroxybenzyl (11S,11aS,11'S,11a'S)-8,8'-[pentane-1 5-diylbis(oxy)]bis(11-hydroxy-7-methoxy-5-oxo-2,3,11 11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-10(5H)-carboxylate)", + "caspase-7", + "2-chloro-9-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-9H-purin-6-amine", + "interleukin 12", + "L-tryptophyl-tRNATrp", + "5-(D-galactosyloxy)-L-lysine-procollagen", + "deoxy-5-methylcytidylate", + "histone H3 N6,N6,N6-trimethyl-L-lysine4", + "dolasetron", + "DELTA 4-cholestene-7alpha,12alpha-diol-3-one", + "pro-transforming growth factor-beta1", + "a kinesin associated with a microtubule at position n", + "6-mercaptopurine", + "maltose 1-phosphate", + "C-terminal cholecystokinin 8 Gly Arg Arg peptide", + "aminopyrine", + "phospho-Tea1", + "validamycin B", + "tropomyosin", + "L-seryl-tRNASec", + "1-methylxanthine", + "alpha1-acid glycoprotein", + "trp leader RNA", + "(5Z,13E,15S)-9alpha,11alpha-epidioxy-15-hydroxyprosta-5,13-dienoate", + "DNA-RNA hybrid", + "tRNA pseudouridine38/39", + "4-coumaric acid", + "1,2-dioleoyl-sn-phosphatidylinositol", + "UDP-2-acetamido-2 3-dideoxy-3-[[(3R)-3-hydroxymyristoyl]amino]-alpha-D-glucopyranose", + "5 beta-D-fructofuranose", + "(S)-3-hydroxy-indane", + "5'-deoxy-5'-chloroadenosine", + "3-[(4R)-4-hydroxycyclohexa-1,5-dien-1-yl]-2-oxopropanoate", + "phosphoylated RNA polymerase II C-terminal domain", + "fragments of kininogen", + "3,8'-biflaviolin", + "UDP-N-acetyl-L-pneumosamine", + "(2R,3R)-epicatechin", + "14 H+", + "D-glycero-beta-D-manno-heptose 1-phosphate", + "2-oxo-3(E)-hexenedioate", + "1/2 O2", + "(S)-(cis-S-1-propenyl)thioglycine", + "[HelX protein] carrying a disulfide bond", + "dipalmitin", + "(9Z,12Z)-octadeca-9,12-dien-6-ynoyl-[glycerolipid]", + "L-seryl-[Eukaryotic initiation factor 2]", + "colloidal chitin", + "4-amino-5-phosphonooxymethyl-2-methylpyrimidine", + "holo-[L-cysteinyl-carrier protein]", + "N-acetyl-alpha-D-glucosaminyl-diphospho-ditrans,octacis-undecaprenol", + "adenosine 3',5'-diphosphate", + "L-Ala-gamma-D-Glu-meso-diaminopimelic acid/in", + "Cl-", + "dopamine 4-O-sulfate", + "coenzyme M", + "capping protein alpha", + "(9S,13S,15Z)-12-oxophyto-10,15-dienoate", + "vanilloyl beta-D-glucoside", + "[(1->6)-alpha-D-glucosyl]n+1", + "4-azido-L-phenylalanyl-tRNAPhe", + "taxa-4(20),11(12)-dien-5alpha-yl acetate", + "5-[(5-phospho-1-deoxyribulos-1-ylamino)methylideneamino]-1-(5 phosphoribosyl)imidazole-4-carboxamide", + "VP4", + "alpha-lipoamide", + "hepoxilin B3", + "lysophosphatidylinositol/out", + "D-glycero-alpha,beta-D-manno-heptose 7-phosphate", + "alpha-D-talose", + "thiocarboxy-adenylate-[sulfur-carrier protein ThiS]", + "taxa-4(20),11(12)-dien-5alpha-ol", + "secondary haloalkanes", + "IbpA", + "N-acetyl-D-galactosaminyl-syndecan-3", + "5-methylcytosine50 in tRNAGlu(UUC)", + "p32-L-tyrosine phosphate", + "2 oxidized plastocyanin", + "alpha-D-ribose-1-phosphate", + "trans-2-hexadecenoyl-CoA", + "(+/-)-N-methylpavine", + "ichangin", + "2-octaprenyl-3-methyl-1,4-naphthoquinone", + "3-deoxy-D-manno-octulosonate", + "cefmetazole/in", + "glypican-3", + "phosphinotricyl-alanyl-alanine/in", + "N-(3-oxohexanoyl)-L-homoserine", + "(2R 4S)-2-[[[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino](carboxy)methyl] 5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid", + "6-acetyl-D-glucose", + "galactopyranose", + "deoxyuridine", + "eukaryotic translation initiation factor eIF4GI", + "[Runx2]", + "D-aminoacyl-tRNA", + "streptothricin-F", + "guanine6 in tRNACys", + "kaempferol 3,7-diglucoside", + "phosphorylated protein", + "2-O-alpha-D-mannotriose", + "immunoglobulin E", + "chlorophyll", + "(2R,3E)-phycocyanobilin", + "glyoxylate", + "6alpha-hydroxyprogesterone", + "phosphorylated MAPKK", + "5-aminopentanoic acid", + "glycyl-[glycyl-carrier protein]", + "taurocholate", + "potato amylose containing alpha-1,6-glucosidic linkages", + "geranylgeranyl-chlorophyll", + "tetrahydrofolic acid", + "(6aS,11aS)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan", + "(-)-spiroviolene", + "serine/threonine protein kinase B", + "cytosine49 in tRNAVal(CAC)", + "chorion", + "base", + "1,1'-binaphthalene", + "beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide", + "2,3-dioxobrimonidine", + "11beta,17beta-dihydroxyandrost-4-ene-3-one", + "L-dopa", + "N,N',N'',N''',N''''-pentaacetylchitopentaose", + "alpha-D-glucosyl-(1->2)-[(2->6)-alpha-D-fructosyl]n+1", + "phosphorylated alpha-synuclein", + "D-glucuronolactone", + "1,1'-bis-valienamine", + "DNA where cytosine is partially or completely replaced by hydroxymethylcytosine", + "S-[(E)-N-hydroxy(indol-3-yl)acetimidoyl]-L-glutathione", + "3-amino-4-hydroxybenzaldehyde", + "7-dehydro-17alpha-hydroxy-pregnenolone", + "raucaffrinoline", + "active caspase-7 variant C186A", + "integrin subunit beta3", + "7-[(3S)-3-amino-3-(methoxycarbonyl)propyl]wyosine72 in tRNAPhe", + "arachidonate methyl ester", + "canadine", + "(R)-3-hydroxybutyrate", + "9-cis-retinal", + "(R)-8-oxocitronellal", + "2-phenylacetic acid", + "dTDP-4-dehydro-2,6-dideoxy-alpha-D-glucose", + "S-(calcein-AM)glutathione[side 2]", + "N-acetyl-beta-D-glucosaminyl-(1->6)-[N-acetyl-beta-D-glucosaminyl-(1 >3)]-N-acetyl-alpha-D-galactosaminyl-Ser/Thr", + "[proteasome-interacting ATPase]-L-lysine", + "1-acylglycerone phosphate", + "protoaetioporphyrin", + "1,3-dihydroxy-N-methylacridone", + "flavodoxin hydroquinone", + "[Vac8]-L-cysteine", + "A47934", + "beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosamine", + "[(1->4)-beta-D-mannosyl]n-1", + "limonene-1,2-diol", + "7-cyano-7-carbaguanine15 in tRNA", + "[FHA-1]-serine/threonine", + "(R)-4-dehydropantoate", + "GDP-mannosylpyranose", + "phopshorylated synapsin-1", + "1-hydroxymethylbilane", + "alpha-L-Fuc-(1-3)-D-GlcNAc", + "4-nitrophenol", + "acetyl-CoA carboxylase 1", + "CoA", + "supercoiled pBR322 DNA", + "N-lignoceroylsphingosine", + "ergosterol 3-beta-D-glucoside", + "5alpha-pregnan-3alpha-ol-20-one", + "[TIP5]-L-lysine", + "(R)-3-hydroxybutanoate", + "vitamin K1", + "phosphorylated synuclein", + "(8Z,11Z,14Z)-icosa-8,11,14-trienoyl-[glycerolipid]", + "MESTIATA", + "L-rhamnulose", + "8-demethyl-8-(2,3,4-O-trimethyl-alpha-L-rhamnosyl)-tetracenomycin C", + "3-hydroxy-cis,cis-muconate", + "3-(3,4-dihydroxyphenyl)propanoyl-CoA", + "(+)-delta-cadinene", + "rhodamine 123/in", + "[histone H4]-L-lysine8", + "2'-O-methylcytidine34 in tRNA", + "5(S),12R-dihydroxy-6,10-trans-8,14-ciseicosatetraenoic acid", + "5-taurinomethyl-2-thiouridine34 in tRNA", + "RelB", + "salicoyl beta-D-glucoside", + "N-acetylglucosaminyl at the non-reducing ends of protein-bound oligosaccharides", + "beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D Man-(1->6)]-[beta-D-GlcNAc-(1->4)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1 >4)-beta-D-GlcNAc-N-Asn-[protein]", + "1-O-(2-acetamido-2-deoxy-alpha-D-glucopyranosyl)-D-myo-inositol", + "2-Acetyl-1-alkyl-sn-glycerol", + "coenzyme Q", + "neisserial heparin binding antigen", + "3'-UTR phosphorylated lactate dehydrogenase subunit A mRNA", + "N-isopropylammelide", + "rhizathalene A", + "N5-formyl-5,6,7,8-tetrahydromethanopterin", + "(S)-8-oxocitronellyl enol", + "collagen type V", + "3-exomethylenecephalosporin", + "L-beta-(5-hydroxy-2-pyridyl)-alanine-tRNATyr", + "UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-6-carboxy-L-lysyl-D alanyl-D-alanine", + "L-2-aminohexanedioate", + "miR-324n", + "5-carboxylcytosine mismatched double-stranded DNA", + "TRPM4 protein", + "compound K", + "lactate", + "epoxyestratrienol", + "scopoletin", + "YPLEK-Dnp", + "5-pregnen-3beta-ol-2-one", + "12,18-didecarboxysiroheme", + "phosphorylated NHE-1", + "beta-D-glucosyl-(1<->1)-ceramide", + "ginsenoside Rh2", + "2-fluorobenzoyl-CoA", + "farnesol", + "an N-(stearoyl)-sphingoid base", + "pro-sequence of opiomelanocortin", + "D-galactarate", + "23S rRNA uridine2605", + "abieta-8,11,13-triene", + "HBr", + "alloxan", + "rubber latex", + "sterol", + "6'-N-acetylaminoglycoside", + "troxacitabine", + "phenylglycine", + "7-chloro-5a,11a-dehydrotetracycline", + "D-ribofuranose", + "oxytalan fibre", + "22 H+", + "4-methyl-2-oxopentanoate", + "cAMP-responsive element-binding protein", + "a 2'-hydroxy-beta-oxodihydrochalcone", + "1-(beta-D-ribofuranosyl)-1,4-dihydronicotinamide", + "p60src-derived peptide", + "(R)-2-alkyl-3-oxoalkanoate", + "2-hydroxyphytanoyl-CoA", + "MnIVO2", + "53BP1", + "porcine IgA1", + "O5-(1-carboxyvinyl)-3-phosphoshikimate", + "a glycoprotein with the oligosaccharide chain attached by N-beta-D-glycosyl linkage to protein L-asparagine", + "mature prostasin", + "toyocamycin acid amide", + "1,2-dihydro-beta-NADPH", + "17alpha-hydroxy-pregn-5-en-3,20-dione", + "beta-L-fucopyranose", + "2 ubiquinol", + "C18:1-ceramide", + "4'-methoxy-5,7-dihydroxyflavone", + "single-stranded oligodeoxynucleotide", + "[histidine kinase ArcB]-L-histidine", + "palmitoyl phosphate", + "dTDP-4-dehydro-6-deoxy-beta-D-gulose", + "phosphorylated Atf1", + "histone H3 L-lysine4", + "L-seryl-tRNAThr", + "galactitol", + "onoceranoxide", + "indolmycin", + "cytosine50 in tRNAGlu(CUC)", + "fucosylated micronemal protein 2", + "beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminyl-epidermal growth factor receptor", + "lichenin", + "protocadherin gamma C3", + "Glu-Glu", + "[p53 protein]-N6-acetyl-L-lysine382", + "hexanoyl [acyl carrier protein]", + "all-tans-retinol", + "genistein 7-O-beta-D-glucoside", + "unsaturated algino-oligosaccharides", + "3-dehydrolevoglucosan", + "tetrahydrodipicolinate", + "N-succinyl-L-2,6-diaminoheptanedioate", + "beta-D-mannosyl-R", + "thiamin", + "phosphorylated dephosphin", + "5-methylthioribulose 1-phosphate", + "propane-1,2-diol", + "(3E)-2-oxohex-3-enedioate", + "4 oxidized ferredoxin", + "phosphorylated AID protein", + "[ADP-thiazole synthase]-dehydroalanine", + "pimeloyl-[acyl-carrier protein] methyl ester", + "L-ascorbate[side 1]", + "pantothenate", + "dCTP", + "cobinamide[side 2]", + "histone H3 N6,N6-dimethyl-L-lysine36", + "8alpha-hydroxygermacra-1(10),4,11(13)-trien-12-oate", + "aminoethane", + "poly(A)-binding protein", + "beta-D-fructofuranose 6-phosphate", + "tritrans,heptacis-undecaprenyl diphosphate", + "3,4-dihydroxyphenylalanine", + "[histone H3]-N6-acetyl-L-lysine9", + "4-hydroxypyrazolo(3,4-d)pyrimidine", + "barley arabinoxylan", + "polyphosphate(n)", + "N,N,N-trimethylamine N-oxide", + "(1E)-4-(methylsulfinyl)-N-(sulfooxy)butanimidothioic acid", + "poly-gamma-glutamate folate", + "retinoblastoma phosphoprotein", + "phosphorylated activating transcription factor 2", + "(2S,4S)-5-hydroxyleucine", + "3-hydroxy-4-hydroxymethyl-2-methylpyridine-5-carboxylate", + "acyl-ACP", + "D-Fructose 6-phosphate", + "[endothelial nitric oxide synthase]-L-cysteine", + "N-acetyl-alpha-D-glucosamine 1-phosphate", + "nitrocefin", + "D-ribosyl-base2", + "beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->6)]-beta-D-Man (1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc-N-Asn-[VSG221 protein]", + "alpha-D-glucosylglycogenin", + "leukotriene A4", + "4 H+[side 2]", + "hopan-22-ol", + "[allophycocyanin beta-subunit]-Cys81-phycocyanobilin", + "2 plastoquinol", + "histone L-arginine", + "larchwood xylan", + "MalE", + "tau protein-L-Thr434", + "D-xylonate", + "[SmD3 protein]-L-arginine", + "L-Fuculose 1-phosphate", + "polysialic acid", + "C16-carnitine[side 1]", + "a phosphoprotein", + "L-2,5-diaminopentanoate", + "myosin II heavy chain phosphate", + "(9Z,11E,13S)-13-hydroperoxy-9,11-octadecadienoate", + "beta-mannobiose", + "METP-(639aa)-RSYLLGNSSPRTQSPQNC(farnesyl)-OCH3", + "Ac-HLLP", + "22-cholesten-3beta-ol", + "(5S,6S)-6-amino-5-[(1-carboxyethenyl)oxy]cyclohexa-1 3-diene-1-carboxylate", + "4-hydroxy-2(1H)-quinolone", + "phosphorylated ryanodine receptor type 2", + "kappa-neocarrabiose-sulfate", + "Photinus luciferin", + "ent-kaur-16-en-19-al", + "CXC-chemokine receptor 4", + "1,2-dehydrocortisol", + "glucagon", + "(R)-2-hydroxy-4-methylpentanoyl-CoA", + "guanine9 in tRNATrp", + "3-hydroxyindole", + "(+)-O-methylkolavelool", + "9-hydroxy-10-oxo-(12Z,15Z)-octadecadienoic acid", + "S-acetylthioethanolamine", + "[D-xylose-binding protein XylF][side 1]", + "[thymine DNA glycosylase]-L-lysine", + "a tRNA precursor", + "L-proline", + "(3beta,5alpha)-4,4-dimethylcholesta-8,14-dien-3-ol", + "vasorin", + "4-nitrobenzylalcohol", + "galactosyl-1,3-N-acetylglucosaminyl-1,3-galactosyl-1,4-glucosyl-1 1-ceramide", + "[superoxide dismutase]-serine/threonine phosphate", + "omega-hydroxy-acyl-CoA", + "xanthotoxol", + "iodide", + "stromal cell-derived factor 1", + "3-oxo-23,24-bisnorchola-1,4-dien-22-oate", + "proendothelin-1", + "1,2,3-trihydroxybenzene", + "3-amino-3-deoxy-D-arabino-1,5-lactone", + "L-lysine/in", + "eotaxin", + "Ba fragment", + "(6E)-8-hydroxygeraniol", + "C20:1 fatty acid", + "bone sialoprotein", + "eugenol", + "N1-methylguanine9 in tRNATrp", + "(E,E)-geranyllinalool", + "wybutosine", + "2 ubiquinone", + "D-galactaro-1,5-lactone", + "2-phospho-(R)-glycerate", + "bimatoprost/in", + "phosphorylated JNK", + "N-formylmethionyl-tRNAfMet", + "[NCOA2]-L-arginine", + "an N-terminal-Nalpha-acetyl-[histone 2B]", + "monocyte chemotactic protein-2", + "GFGDLK", + "[cystine-binding protein TcyA](side 1)", + "2'-GMP", + "phospho-tyrosinyl paxillin", + "a [methyl coenzyme-M reductase]-L-arginine285", + "iodine", + "undecanoic acid", + "dTDP-3-dimethylamino-3,6-dideoxy-alpha-D-glucopyranose", + "[Yck2]-S-palmitoyl-L-cysteine", + "3-hydroxy-16-methoxy-2,3-dihydrotabersonine", + "chloramphenicol 3-acetate", + "stearidonoyl-CoA", + "tRNAGly", + "isoniazid", + "tetraprenyl-beta-curcumene", + "12 ADP", + "soluble thrombomodulin", + "N6-acetyl-L-lysine", + "3 palmitoyl-CoA", + "[ComD]-serine/threonine phosphate", + "8-ethyl-12-methyl-3-vinyl-bacteriochlorophyllide d", + "SESSSKS", + "MKK1", + "histone H3(K36)", + "[glutathione-binding protein][side 1]", + "pilin EpdC", + "SP-D protein peptide fragments", + "23S rRNA pseudouridine955/pseudouridine2504/pseudouridine2580", + "2-[4-dimethylaminophenyl]-1,3-benzothiazol-5-yl sulfate", + "[a protein]-serine/threonine phosphate", + "adenine1618 in 23S rRNA", + "3-hydroxypropanoate", + "5-methylcytosine50 in tRNAGlyGCC", + "chitobiose", + "d-glucuronate", + "fibrinogen 2", + "methyl nogalonate", + "n(GSSG)", + "Mgm101", + "methylguanidine", + "calmodulin-L-methionine (S)-sulfoxide", + "3,3'-biflaviolin", + "BES1", + "(R)-2-(4-chloro-2-methylphenoxy)propanoate", + "maize eukaryotic translation initiation factor 5A", + "dihydrolipoic acid", + "[GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala)]n+1 diphosphoundecaprenol", + "rhodopsin", + "amyloid beta42 peptide fragments", + "low molecular-mass polysaccharides", + "[branched-chain keto-acid dehydrogenase (acetyl-transferring)]", + "1,2-dipalmitoyl-sn-lysophosphatidylcholine", + "polymerase II C-terminal domain", + "phosphorylated Rps2", + "[Notch protein with EGF-like domain]-3-O-(beta-D-glucosyl)-L-serine", + "(2R 4S)-2-[(R)-[[(2R)-2-amino-2-(4 hydroxyphenyl)acetyl]amino](carboxy)methyl]-5,5-dimethyl-1 3-thiazolidine-4-carboxylic acid", + "1'-oxo-2'-D-hydroxypropyl-tetrahydropterin", + "HopB1/out", + "5-methylcytosine34 in tRNA", + "FMN", + "5-hydroxymethylcytosine-containing DNA", + "eicosatrienoyl-CoA", + "sn-glycero-3-phosphoethanolamine", + "5-bromo-L-tryptophan", + "APP-CONH2", + "(+)-demethylpiperitol", + "5-methylcytosine48 in tRNAVal(AAC)", + "oleoyl-[acyl-carrier-protein]", + "3-chloro-2-methylmaleylacetate", + "2-oxobutanoate", + "big endothelin", + "4-methylcyclohexa-1,5-diene-1-carbonyl-CoA", + "para-kappa-casein", + "Neuroexocytosis multi-subunit complex", + "2'-(4-methylumbelliferyl)-alpha-D-N-acetylneuraminic acid", + "Rps25b", + "beta-D-xylose", + "1-deoxy-D-altro-heptulose 7-phosphate", + "cytosine50 in tRNAGly precursor", + "6-hydroxy-warfarin", + "chlorophyll a/b", + "1-(5-phosphoribosyl)-AMP", + "allyl alcohol", + "3 malto-oligosaccharides", + "2''-O-acetyl-ADP-D-ribose", + "[G protein-coupled receptor]", + "dalpaniculin-7-O-[beta-D-apiofuranosyl-(1-6)-beta-D-glucopyranoside]", + "phospho-L-aspartate", + "apoA-I", + "alpha-linoleoyl-CoA", + "1-omega-hydroxy acyl-sn-glycerol 3-phosphate", + "10-hydroxynerol", + "glial fibrillary acidic protein L-arginine", + "Cu+/out", + "geranylgeranyl-bacteriochlorophyllide a", + "betulin", + "TDP-3-amino-4,6-dideoxy-alpha-D-glucopyranose", + "phospho-TAK1", + "3 H2", + "3-sulfopyruvate", + "D-galactose[side 1]", + "protein-disulfide", + "(5Z,9alpha,11alpha,13E,15S)-9,11 15-trihydroxy-N-(2-hydroxyethyl)prosta-5,13-dien-1-amide", + "low-density lipoprotein", + "D-ribose/out", + "4-hydroxy-3-methylbut-2-enal", + "(2R)-2-[(R)-carboxy[(1H-tetrazol-1-ylacetyl)amino]methyl]-5-[[(5-methyl 1,3,4-thiadiazol-2-yl)sulfanyl]methyl]-3,6-dihydro-2H-1 3-thiazine-4-carboxylic acid", + "isoprimeverose", + "31 amino-acid fragment of ET-1", + "2-deoxy-D-ribose 1-phosphate", + "amyloid-beta protein 43", + "2-methoxy-6-all-trans-polyprenyl-1,4-benzoquinol", + "L-leucine/out", + "3-coumarate", + "lupan-3beta,20-diol", + "glycogen phosphorylase b", + "phosphorylated Cdk2", + "intermediate density lipoprotein", + "Fkh2p", + "E-cadherin ectodomain", + "4 Cu2+", + "tricyclene", + "alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D glucosamine", + "TRIM39R", + "PLB", + "GlpLYENKPRRP", + "4-aminobutyryl-CoA", + "(2Z,6E)-hedycaryol", + "core 3 oligosaccharide", + "phosphofructokinase 2", + "microRNA 125b", + "pyridine-2,3-dicarboxylate", + "alpha-ribazole-5'-phosphate", + "2-hydroxypurine", + "17alpha-Hydroxypregnenolone", + "protein/in", + "DELTA1-piperideine-6-carboxylate", + "5 ferricytochrome c", + "Tyr", + "4-aminobenzamide", + "(2R)-4-hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ol", + "(Z)-but-1-ene-1,2,4-tricarboxylate", + "fragments of Scc1", + "NeuAcalpha(2,3)-Galbeta(1,4)[SO3H-6]-GlcNAc-R", + "TDP-L-rhamnose", + "serine", + "2-oxo-3-thiopropionic acid", + "L-3-4 dihydroxyphenylalanine", + "a dihydroflavonol", + "chemotaxis receptors McpS L-glutamate", + "tetrahydrocolumbamine", + "Ras protein C-terminal S-farnesyl-L-cysteine", + "2-(2,4-dihydroxy-7,8-dimethoxy-1 4-benzoxazin-3-one)-beta-D-glucopyranose", + "alpha-D-ribose 1-phosphate", + "N-acetylmuramate", + "insulin-like peptide 3", + "beta-1,3-glucan", + "dihydromyricetin", + "15,16-dihydrobiliverdin", + "3-deoxy-D-arabino-hept-2-ulosonate 7-phospate", + "dolichyl N-acetyl-alpha-D-glucosaminyl phosphate", + "transferring receptor", + "(maltodextrin)n", + "6-oxohexanoate", + "Watasenia luciferin", + "beta-D-fructofuranosyl-(2,6)-beta-D-fructofuranosyl-(2 1)-alpha-D-glucopyranoside", + "guanosine2251 in 23S rRNA", + "2 [methionine synthase]-cob(II)alamin", + "cytosine38 in tRNAAsp(GTC)", + "8-demethyltetracenomycin C", + "a flavone", + "[heat stable phosphocarrier protein HPr]-L-histidine", + "Elk1", + "chlorpyrifos", + "[histone H3]-N6,N6-dimethyl-L-lysine 9", + "angiotensinogen propeptide", + "scyllo-inosamine", + "GDP-6-deoxy-alpha-D-altrose", + "2'-deoxynucleoside 5'-phosphate", + "gossypetin 7-O-beta-D-glucoside", + "(1-4)-beta-D-glucosyl-D-mannose", + "2 thioredoxin", + "pentadecanoyl-CoA", + "glutathione-S-conjugate[side 2]", + "plugin N5-alkylglutamine", + "4-(methylnitrosamino)-1-(3pyridyl)-1-butanone", + "3-hydroxypimeloyl-CoA", + "Na+/[side 2]", + "S-nitrosoglutathione[side 1]", + "cyclohexaamylose", + "D-apiose", + "ATPgammaS", + "5'-phosphoribosyl-5-formamido-4-imidazole carboxamide ribonucleotide", + "xenobiotic[side 2]", + "5-methylthio-D-ribose 1-phosphate", + "miRNAn", + "phosphorylated cdc2", + "oleate", + "[acyl-carrier protein]", + "psilocin", + "p27", + "2 3-phospho-D-glycerate", + "D-glucosamine[side 2]", + "1-palmitoyl-2-oleoylphosphatidylcholine", + "N-terminal-N-methyl-N-Ala-Pro-Lys-[protein]", + "2'-deoxynucleoside 5'-diphosphate", + "root meristem growth factor 7 tyrosine", + "pelargonidin 3-O-(6-O-malonyl)-beta-D-glucosyl-5-O-beta-D-glucoside", + "pyrazine-2-carboxylic acid", + "mevalonate", + "O2-", + "palmitic acid hexadecyl ester", + "GlcNAc-beta-1,4-GlcN", + "thymine glycol", + "alpha-D-glucosamine 6-phosphate", + "D-galactofuranose[side 2]", + "chlortetracycline", + "lysine/out", + "(24E)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholest-24-en-26-oyl-CoA", + "(S)-3,5-dihydroxyphenylglycine", + "(E/Z)-n-butyraldoxime", + "butane", + "UDP-N-acetylmuramoyl-L-Ala", + "3-methylcrotonyl-CoA", + "6-pyruvoyltetrahydropterin", + "ent-kaur-16-ene", + "hypoxanthine-containing double-stranded DNA", + "phosphorylated amphiphysin I", + "undecaprenol", + "complement component 3", + "immunoglobulin Fc", + "YapE", + "Glycine", + "CMP-N-acetyl-9-O-acetyl-neuraminate", + "phosphocreatine", + "histone H1-IIIS", + "N-terminal L-asparaginyl-[protein]", + "L-lysine-[U2AF65]", + "9alpha-hydroxy-3-oxo-23,24-bisnorcholest-4-en-22-oyl-CoA", + "oligosaccharide-lipid acceptor", + "10-deoxysarpagine", + "gentobiose", + "luteolin-4'-beta-glucopyranoside", + "2,4,5-trihydroxyphenylacetate", + "3-amino-2,4-dihydroxybenzoate", + "diisopropyl fluorophosphate", + "[(1,6)-alpha-D-glucosyl]n+1", + "coproporphyrinogen-IV", + "keratan oligosaccharides", + "5 (2S)-methylmalonyl-CoA", + "phosphorylated M3-muscarnic receptor", + "HCLS1-associated X1", + "electron transferring flavoprotein", + "phenethylamine", + "alanine/in", + "a 1-linoleoyl 2-acyl-sn-glycerol 3-phosphate", + "trans,octacis-decaprenylphospho-beta-D-arabinofuranose", + "5-methyl-5,6,7,8-tetrahydromethanopterin", + "[endothelial growth-factor]-L-tyrosine phosphate", + "cytosine49 in tRNAGlu(UUC)", + "[CpG]-serine/threonine phosphate", + "(E)-2-(methoxycarbonylmethyl)butenedioate", + "3-methylthiopropanamine", + "UDP-2,3-bis((3R)-3-hydroxymyristoyl)alpha-D-glucosamine", + "Flp1 pilin", + "cyclooctat-9-en-7-ol", + "soyasaponin I", + "Arg-peptides", + "alkylated DNA", + "Man7GlcNAc", + "5-methylcytosine48 in tRNAGlu(UUC)", + "S-geranylgeranyl-N Ras", + "sterol regulatory element binding protein", + "estrone 3-sulfate", + "cis-1,2-cyclohexanediol", + "beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)-[alpha-D-Man-(1->3)]-beta-D-Man (1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc", + "S-geranylgeranyl-Ras-CVLL", + "(2R)-2-hydroxybutane-1,2,4-tricarboxylate", + "Swedish mutation of amyloid precursor protein", + "octopamine", + "(-)-exo-alpha-bergamotene", + "acceptor xyloglucan", + "amyloid precursor protein-DELTANL", + "4-nitrophenyl sulfate", + "N-acetyl-beta-D-galactosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D glucosyl-(1<->1)-ceramide", + "(2S,3S)-hydroxybutane-1,2,3-tricarboxylate", + "propeptide of carboxypeptidase Y", + "SREBP NH2-522 fragment", + "salutaridinol", + "riboflavin-binding protein disulfide", + "insulin-like growth factor-1", + "D-Asn", + "3',5-dihydroxy-3,4',7-trimethoxyflavone", + "5'-deoxyadenosine", + "(6Z,9R,10E,12Z)-9-hydroxy-octadeca-6,10,12-trienoic acid", + "cytosine50 in tRNAPro(CGG)", + "N1-methylguanine9 in tRNACysGCA", + "12 base pair RNA-DNA hybrid", + "1-acyl-2-lysophosphatidylcholine", + "miR-1003 RNAn+1", + "1-acyl-2-arachidonoyl-sn-glycero-3-phosphocholine", + "Manalpha(1-4)Manbeta(1-4)Man", + "3(2)-beta-D-glucosyl-D-cellobiose", + "(2-hydroxyphenyl)acetate", + "L-proline-[L-proline-binding protein][side 1]", + "phospho-YycF", + "N1-(5-phosphoribosyl)-AMP", + "MurNAc-pentapeptide diphosphoryl undecaprenol", + "5-methoxy-N,N-dimethyltryptamine", + "labda-7,13-dienyl diphosphate", + "taxa-4(20),11(12)-dien-5alpha-yl-acetyl-13alpha-ol", + "[RNA 3'-phosphate cyclase]-Ntau-(5'-adenylyl)-L-histidine", + "3-(1H-indol-3-yl)-2-oxopropanoic acid", + "D-apiofuranose", + "5-oxovalerate", + "Nipah virus fusion protein", + "human protease-activated receptor PAR-2", + "alkylaldoxime", + "DNA (containing 6-O-carboxymethylguanine)", + "ssDNA/pppN(pN)n-1 hybrid", + "an N-acylsphingosine", + "reduced flavodoxin", + "parathyroid hormone fragment 13-34", + "[isocitrate dehydrogenase (NADP+)] phosphate", + "[methyl-coenzyme M reductase alpha-subunit McrA]-thioglycine", + "phosphatidylserine/in", + "stearic acid", + "2-amino-4,5-dihydroxy-6-oxo-7-(phosphooxy)heptanoate", + "3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-al", + "UV-damaged DNA containing cyclobutane pyrimidine dimers", + "5-dehydrogluconate", + "(E)-cinnamate", + "deoxyadenosine", + "[phosphate]n+1", + "submaxillary mucin", + "C6:0-ceramide", + "phospho-tyrosinyl Wiskott-Aldrich syndrome protein", + "Mn2+[side 1]", + "Muc2 protein", + "stellata-2,6,19-triene", + "glycophorin", + "benzyl acetate", + "furosemide/out", + "isovanillate", + "eukaryotic initiation factor 4G", + "3-aminopentanedioate", + "CMP-N-glycolylneuraminic acid", + "inositol polyphosphate", + "beta-D-mannopyranosyl-(1->2)-beta-D-mannopyranosyl-(1->2)-D mannopyranose", + "(5Z,8Z,11Z, 13E,15S)-15-hydroperoxy-5,8,11,13-eicosatetraenoic acid", + "2 C2H4", + "N-(stearoyl)-dihydroceramide", + "ubiquinone-1", + "uridylyl-[protein-PII]", + "essential ribosomal elongation factor 2", + "sn-glycero-3-phospho-1-inositol", + "3-methoxy-5,7,3',4'-tetrahydroxyflavone", + "orcinol", + "3-deoxy-alpha-D-manno-octulosonic acid", + "CREB phosphoprotein", + "[elongator tRNAMet]-N4-acetylcytidine34", + "GspG pseudopilin", + "trans-zeatin", + "nomilin", + "5-methylcytosine49 in tRNAPro(AGG)", + "nicotinic acetylcholine receptor", + "phosphorylated serine/threonine protein kinase", + "7alpha-hydroxypregnenolone", + "6-O-beta-D-glucopyranosyl-D-glucose", + "alpha-L-iduronic acid", + "12-oxo-phytodienoic acid", + "thymidine monophosphate", + "neo-delta-carrabiose", + "D-myo-inositol", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-valyl-[protein]", + "phospho-ATF1", + "devancoaminyl vancomycin", + "3-vinyl-bacteriochlorophyllide a", + "beta-D-galactosyl-(1,4)-D-glucosylceramide", + "active protease activated receptor 3", + "nitrosuccinic acid", + "isatinate", + "alkanesulfonate[side 2]", + "(5beta)-androstan-3,17-dione", + "inosine 5'-diphosphate", + "2-endo-hydroxy-1,8-cineole", + "Hemoglobin", + "phosphorylated MAP2", + "5'-methylthioadenosine", + "2-epi-5-epi-valiolone", + "Ni2+[side 2]", + "catecholamine", + "fibrillar collagen type I", + "palmitoleoyl-CoA", + "D-galactonolactone", + "(+)-abscisic acid", + "Mn2+/trans", + "L-anticapsin", + "D-alpha-Lysine", + "(R)-2-methylbutanoyl-CoA", + "UDP-N-acetyl-muramyl-L-alanyl-D-glutamyl-mesodiaminopimelyl-D-alanyl-D alanine", + "hepoxilin A3", + "lipid A 1-(2-aminoethyl diphosphate)", + "colanic acid", + "O-palmitoylglycoprotein", + "fragments of beta-amyloid precursor protein", + "a 3beta-hydroxy-4,4-dimethylsteroid", + "2,3-dihydro-3,16-dihydroxytabersonine", + "alpha-isomaltosyl-(1->3)-isomaltose", + "SCR-1", + "2-dehydro-3-deoxy-D-glucarate", + "ADAM9", + "beta-lactamase signal peptide", + "(5Z,13E)-11alpha-hydroxy-9,15-dioxoprost-5,13-dienoate", + "N-acetyl-D-glucosamine 6-phosphate[side2]", + "1,2-diaminoethane", + "5beta-androstan-3alpha-ol-17-one", + "a 2-deoxy-alpha-D-glucoside", + "Big endothelin-1", + "4-methyl-3-oxopentanoyl-[acyl-carrier-protein]", + "WTQRF", + "diaminopimelate", + "cyclohex-2-ene-1-carbonyl-CoA", + "(4-amino-2-methylpyrimidin-5-yl)methyl diphosphate", + "phenylethylamine", + "D-glucaro-1,5-lactone", + "[disabled-1 adaptor protein]-L-tyrosine phosphate", + "D-erythro-sphinganine", + "calcitroic acid", + "4-methylene-L-glutamine", + "decaprenyl phosphoryl-D-arabinose", + "(2-N 3-O-bis[(3R)-3-hydroxytetradecanoyl]-beta-D-glucosaminyl)-(1->6)-(2-N 3-O-bis[(3R)-3-hydroxytetradecanoyl]-alpha-D-glucosaminyl phosphate)", + "ROL-6 protein tyrosine", + "L-Asp/out", + "N5-ethyl-L-glutamine", + "4-hydroxyphenylpyruvic acid", + "duroquinol", + "biotin-carboxyl-carrier protein", + "processing enhancing protein precursor", + "5-methylcytosine48 in tRNAPro(UGG)", + "[protein-L-cysteine", + "pyrin", + "DNA with an abasic site", + "3-cyanopyridine", + "3''-adenylylstreptomycin", + "hypothiocyanite", + "low density lipoprotein receptor-related protein 1", + "beta-D-galactosyl-(1 4)-N-acetyl-beta-D-glucosaminyl-alpha-D-galactosyl-(1 4)-beta-D-glucosylceramide", + "L-threonine", + "NeuAcalpha(2,3)-Galbeta(1,4)[Fucalpha1-3][SO3H-6]-GlcNAc-R", + "Somatostatin-14", + "(S)-8-oxocitronellal", + "[myosin light-chain]", + "GKLG", + "dicarboxylate", + "cholate 3-sulfate", + "7beta-hydroxy-3-oxochol-4-en-24-oyl-CoA", + "3-hydroxy-4-acetoxybutynylbithiophene", + "CMP-5-N-acetylneuraminic acid", + "1-hydroxynon-2-en-4-one", + "[histone H2B]-L-lysine", + "3-oxobutyryl-CoA", + "6 reduced ferredoxin", + "6-methoxy-5-methyl-2-octaprenyl-1,4-benzoquinol", + "p35 phosphoprotein", + "CC receptor tyrosine", + "a [protein]-(S)-2-(C-substituted-aminomethyl)-4-acyl-1,3-oxazole", + "BP180/type XVII collagen", + "N2-methylguanine6 in tRNACys", + "Mdm2 protein", + "CDP-alpha-D-abequose", + "eriodyctiol", + "lipooligosacccharide", + "Peptidoglycan", + "N-acetyl-D-threonine", + "phosphorylated H2AX", + "protein kinase CK2beta", + "5-bromo-uracil", + "(E)-but-1-en-1-SO-peroxol", + "[E2 ubiquitin-conjugating enzyme cullin-3]-S-ubiquitinyl-L-cysteine", + "linoleoyl-[glycerolipid]", + "isorhamnetin 3-O-beta-D-glucoside", + "phosphorylated PSD-95", + "thymidylyl-(3'-5')-thymidylate", + "caspase-9", + "(2R,4S)-2-[(R)-carboxy([(2R)-2-[(4-ethyl-2 3-dioxopiperazine-1-carbonyl)amino]-2-phenylacetyl]amino)methyl]-5 5-dimethyl-1,3-thiazolidine-4-carboxylic acid", + "[alphabeta-tubulin]-(gamma-L-glutamyl)-L-glutamate", + "chloride", + "(9R)-hydroperoxy-(10E,12Z,15Z)-octadecatrienoic acid", + "activated factor XII", + "reduced riboflavin", + "jasmonoyl-L-Ile", + "phosphorylated rhodopsin", + "glucosylhydroxymethylcytosine residue in DNA", + "isophenoxazine", + "senecionine", + "formyl-L-methionyl peptide", + "proteinase-activated receptor-2", + "AMP-activated protein kinase", + "(9S,10S,11S,12Z)-9,10-epoxy-11-hydroxy-12-octadecenoic acid", + "[TRRAP]-L-lysine", + "5-formyl-5,6,7,8-tetrahydromethanopterin", + "Rga2 protein", + "uric acid ribonucleoside", + "DNA containing 4-O-methylthymine", + "arsenite[side 1]", + "2-methylhydroquinone", + "2'-O-methylisoliquiritigenin", + "xylopentaose", + "tryptophan/out", + "5 CoA", + "phosphorylated protein p165", + "glucosamine 6-phosphate", + "Proteins", + "[RGS4]-S-palmitoyl-L-cysteine", + "(25R)-5beta-cholestane-3alpha,7alpha,12alpha,27-tetraol", + "2-oxoisoleucine", + "Mg-protochlorophyllide", + "ginsenoside Rh1", + "isobutyric acid amide", + "monodemalonylsalvianin", + "ethyl acrylate", + "sinapyl alcohol", + "[Stk1]-serine/threonine", + "reduced 3-acetylpyridine adenine dinucleotide", + "(S)-benzoin", + "4-guanidinobutanal", + "dTDP-4-dehydro-L-rhamnose", + "N-oleoylethanolamine", + "1-(4-methoxyphenyl)ethanol", + "2'-deoxynucleoside", + "linalol", + "N1-methyladenine22 in tRNA", + "(-)-deoxypodophyllotoxin", + "Limulus clotting factor Bbar", + "[protein]-dihydrolipoyllysine", + "NR1 receptor", + "D-xylono-1,4-lactone 5-phosphate", + "(5Z,8Z,11Z,13E)-(15S)-15-hydroxyeicosa-5,8,11,13-tetraenoate", + "Gurken-derived peptide", + "Man7-2GlcNAc", + "N-acetyl-6-diazo-5-oxo-L-norleucine", + "collagen glutamine", + "methoxysuccinyl-Ala-Ala-Pro-Val-4-nitroanilide", + "proline/out", + "N2O", + "SO32-", + "(S)-(+)-cembrene A", + "a (7Z,10Z)-hexadeca-7,10-dienoyl-[glycerolipid]", + "2,3-bis-O-geranylgeranyl-sn-glyceryl 1-phosphate", + "propionohydrazide", + "holo-[acyl-carrier protein]", + "alpha-D-galactosyl-(1->3)-1D-myo-inositol", + "[p73 protein]", + "5'-oligoribonucleotide", + "3,4',5,7-tetrahydroxy-3'-methoxyflavone", + "mycothiol", + "alpha-terpineol", + "(11R)-dihydroartemisinic aldehyde", + "D-nicotine", + "dihydrothymidine", + "fatty aldehyde", + "17alpha-ethinylestradiol", + "[eukaryotic translation initiation factor 2alpha]", + "geranylgeranyl bacteriochlorophyllide a", + "N-acetyl-D-glucosaminyl-1,6-beta-D-(N-acetylglucosaminyl-1 2)-beta-D-mannosyl-R", + "fibrin L-citrulline", + "Src family kinase", + "[Notch protein with EGF-like domain]-3-O-(beta-D-xylosyl)-L-serine", + "1''-O-acetyl-ADP-D-ribose", + "9-beta-D-arabinosyl-2-fluoroadenine 5'-phosphate", + "ethyl acetoacetate", + "histone H2A-L-arginine", + "C34-carboxyphthiodiolenone-[(phenol)carboxyphthiodiolenone synthase]", + "reduced electron transfer flavoprotein", + "tuberculosinyl diphosphate", + "cGMP/out", + "N-acetyl-D-muramate 6-phosphate", + "3-(4-hydroxyphenyl)pyruvate", + "2'-deoxyuridine 5'-phosphate", + "3-hydroxyacyl group of bacterial toxin", + "3-(uracil-1-yl)-L-alanine", + "3 reduced flavoproteins", + "[glucosamine-binding protein Avi_5305][side 1]", + "D-His", + "[isocitrate dehydrogenase 2]-L-lysine", + "5'-mononucleotide", + "3-deacetyl-3-(1-hydroxyethyl)-bacteriochlorophyllide a", + "3,4-dehydroadipyl-CoA semialdehyde", + "kaempferol 3-sulfate", + "transit peptide", + "N6-methyladenine in U6 ncRNA", + "17-O-acetylnorajmaline", + "ethyl (S)-4-chloro-3-hydroxybutanoate", + "a (5-L-glutamyl)-peptide", + "(R)-6-hydroxynicotine", + "5-methylcytosine15 in vtRNA1.3", + "an [amino group carrier protein]-C-terminal-N-(1-carboxy-5-phosphooxy-5-oxopentan-1-yl)-L glutamine", + "beta-chloro-D-alanine", + "oxamate", + "2 methanethiol", + "[protein]-N6-myristoyl-L-lysine", + "o-nitrophenyl alpha-D-galactopyranoside", + "4-O-methyl-D-glucuroxylan methyl ester", + "camphorquinone", + "[N-(6-aminohexanoyl)]n", + "butan-2-one", + "1-methylguanosine", + "sisomycin", + "S1P1R tyrosine", + "ribose-5-phosphate", + "beta-phellandrene", + "glucosylated glycogenin", + "[PknB]-serine/threonine", + "dihydroclavaminate", + "L-norvalyl-tRNALeu", + "carboxymethylaminomethyl 2-thiouridine34 in tRNALys", + "dichloroethene", + "[vascular endothelial growth-factor-1]-L-tyrosine", + "4 alpha-D-mannopyranose", + "3-oxobrimonidine", + "3-hydroxy-5-methylhex-4-enoyl-CoA", + "dynamin 1", + "D-mannono-1,5-lactone", + "4-hydroxybenzoyl beta-D-glucoside", + "2 reduced amicyanin", + "dextran T40", + "bleomycin", + "2,4',5,7-tetrahydroxyisoflavanone", + "[MgrA]-serine/threonine phosphate", + "dolichyl D-xylosyl phosphate", + "17alpha-estradiol-3-glucuronoside", + "IKKalpha", + "ethanolamine lysoplasmalogen", + "[histone H3]-L-lysine18", + "fumitremorgin C", + "lamin c", + "27beta-hydroxywithanone", + "methylene bisphenyl dicarbamic acid dibutyl ester", + "L-Gln", + "beta-D-glucosyl-beta-D-glucosyl-hydroxymethylcytosine containing DNA", + "(4R,8Z)-4-hydroxysphing-8-enine ceramide", + "protein Spitz", + "trans,octacis-decaprenylphospho-beta-D-ribofuranose", + "reduced 2,6-dichlorophenol-indophenol", + "CBP40", + "cobinamide", + "3-deoxy-alpha-D-manno-oct-2-ulopyranosyl-(2->8)-3-deoxy-alpha-D-manno oct-2-ulopyranosyl-(2->4)-3-deoxy-alpha-D-manno-oct-2-ulopyranosyl-(2 >6)-2-deoxy-2-[[(3R)-3-hydroxypentadecanoyl]amino]-3-O-[(3R)-3 hydroxytetradecanoyl]-4-O-phosphono-beta-D-glucopyranosyl-(1->6)-2 deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[[(3R)-3 hydroxytetradecanoyl]amino]-1-O-phosphono-alpha-D-glucopyranose", + "3-O-methylphospho-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1 >3)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D Man-(1->3)-alpha-D-Man-(1->3)]n-alpha-D-Man-(1->3)-alpha-D-Man-(1->3) alpha-D-GlcNAc-diphospho-ditrans,octacis-undecaprenol", + "mitogen-activated protein kinase kinase-7", + "HrpJ/in", + "2-O-(beta-D-mannosyl-(1->2)-beta-D-mannosyl)-di-myo-inositol-1 3'-phosphate", + "1D-myo-inositol 1,2-cyclic phosphate", + "versiconal hemiacetal acetate", + "cholest-5-ene-3beta,7alpha,27-triol", + "gelatinase A propeptide", + "1,5-anhydro-D-mannitol", + "tigloyl-CoA", + "ROH", + "celecoxib/out", + "N1-methylguanine37 in tRNAAsp(GUC)", + "Holocytochrome c", + "petunidin 3-O-[2-O-(4-coumaroyl)-alpha-L-rhamnosyl-(1->6)-beta-D-glucoside]", + "3 di-D-fructofuranose-1,2':2,1'-dianhydride", + "6'-deoxychalcone", + "lymphocyte function associated antigen-1", + "vesicle associated membrane protein-1", + "naringenin chalcone", + "HCN", + "hypoxia-inducible factor-(3S)-3-hydroxy-proline", + "2-dodecenoyl-[acyl-carrier protein]", + "precorrin-3x", + "[hydroxymethylglutaryl-CoA reductase (NADPH)] phosphate", + "2-methyl-6-phytylbenzoquinol", + "agarotetraose", + "3-oxo-5-methylhexanoyl-[acyl-carrier protein]", + "S-adenosyl-4-methylthio-2-oxobutanoate", + "isoscoparin", + "1-acyl-2-oleoyl-sn-glycero-3-phosphocholine", + "2-amino-5-oxocyclohex-1-enecarboxyl-CoA", + "pregnan-3alpha,20beta-diol", + "8-oxocitronellyl enol", + "4 catechol", + "FGF-2", + "polycistronic his operon mRNA precursor", + "N6-benzyl-ATPgammaS", + "caldesmon", + "8-amino-8-demethylriboflavin 5'-phosphate", + "L-citrulline", + "dehydro-D-arabinono-1,4-lactone", + "MAP kinase kinase 3b", + "[Goodpasture antigen-binding phosphoprotein]", + "cucurbitadienol", + "L-leucine-[L-leucine-binding protein][side 1]", + "pre-sodorifen diphosphate", + "1-O-[(E)-2,4-dimethoxy-6-(4-methoxystyryl)benzaldehyde oxime]-beta-D-glucuronate", + "3-O-[N-acetyl-beta-D-galactosaminyl-(1->3)-N-acetyl-beta-D-glucosaminyl (1->4)-6-O-phosphono-alpha-D-mannosyl]-L-threonyl-[protein]", + "inositol 1,4,5,6-tetrakisphosphate", + "[SoxY protein]-S-sulfanyl-L-cysteine", + "collagen type I", + "ticarcillin", + "(S)-3-hydroxyisobutyrate", + "[cytosolic 6-phosphofructokinase]-tyrosine", + "CH3SO3-", + "Asp-Xaa", + "(R,S)-citronellol", + "carotenoid psi-end group", + "tariquidar [side 2]", + "[Notch]-(3-O-beta-D-N-acetylglucosaminyl)fucose", + "phosphorylated cyclin B", + "[alpha-tubulin]-L-lysine", + "beta-D-glucuronyl-(1->3)-D-galactosyl-proteoglycan", + "L-Serine", + "2 pyrocatechol", + "5-hydroxytryptophan", + "N-acetyl-alpha-neuraminate", + "miniplasminogen", + "1,2-dihydroxycyclohexa-3,5-diene-1-carboxylate", + "24-methylcholesterol", + "bilirubin", + "4-([bis(2-iodoethyl)amino]-phenyl)oxycarbonyl-L-glutamic acid", + "1-(beta-D-galactosyl)-2-(2-hydroxyacyl)sphingosine", + "oleic acid", + "N-methylanthraniloyl-CoA", + "[SNAP-25]-L-cysteine", + "lysozyme", + "L-beta-(5-hydroxy-2-pyridyl)-alanine", + "3-O-[N-acetyl-beta-D-glucosaminyl-(1->4)-alpha-D-mannosyl]-L-threonyl [protein]", + "nicotinamide hypoxanthine dinucleotide", + "tartrate-resistant acid phosphatase", + "an omega-hydroxy-methyl-branched lipid", + "kallikrein-10 N5-pentylglutamine", + "C3 protein", + "glucagon-like peptide 1 (7-36)-amide", + "SPR2D N5-pentylglutamine", + "UDP-4-amino-4,6-dideoxy-L-N-acetyl-beta-L-altrosamine", + "phosphorylated MPK18", + "7,8-dihydrobiopterin", + "5,10-methenyltetrahydrofolate", + "ethyl pyruvate", + "relaxed pBR322 DNA", + "[myosin heavy-chain] phosphate", + "guanine26/guanine27 in tRNA", + "terpinolene", + "Mca-KKWLM", + "protein-disulfide isomerase", + "MEK1", + "CDK1", + "3',4',5,7-tetrahydroxyflavone", + "4-methyl-5-(2-phosphono-oxyethyl)thiazole", + "O-antigen serotype 4av (2-aminoethyl diphosphate)", + "toll-like receptor 9", + "outer membrane protein", + "daidzin", + "concanavalin A-precursor", + "L-ribulose 5-phosphate", + "cyclo(L-leucyl-L-phenylalanyl)", + "1-methoxyindol-3-ylmethyl isothiocyanate", + "Fuc-alpha-(1-2)-Gal-beta-(1-3)-[Fuc-alpha-(1-4)]-GlcNAc-beta-(1-3)-Gal beta-(1-4)-Glc", + "2'-deoxyCDP", + "ponciretin", + "6-(1,2-dioxopropyl)-5,6,7,8-tetrahydropterin", + "(D)-limonene", + "L-glutaminyl-tRNAGln", + "rhamnogalacturonan I oligosaccharides with D-galacturonic acid at the reducing end and L-rhamnopyranose at the nonreducing end", + "2,3,4,5,6-pentachlorocyclohexanol", + "2-methylpropanoyl-CoA", + "tobramycin 2''-phosphate", + "norspermidine", + "N-acetyl-beta-D-glucosaminyl-1,2-alpha-D-mannosyl-1 3-(N-acetyl-beta-D-glucosaminyl-1,2-alpha-D-mannosyl-1 6)-(N-acetyl-beta-D-glucosaminyl-1,4)-beta-D-mannosyl-1 4-N-acetyl-beta-D-glucosaminyl-R", + "YycF", + "EGF", + "Lys-Arg-primaquine", + "meconium H-1", + "N6-[[SAMP2]-Gly-Gly]-[[protein]-L-lysine]", + "(1,4-alpha-glucosyl)n+1", + "phospho-tyrosinyl-Shc paxillin", + "tRNA UpsiC", + "diacetyl", + "L-methionine (R,S)-sulfoxide", + "N,N'-diacetylchitobiose", + "isobutyryl-CoA", + "prepilin PilC leader peptide", + "[RNA]-3'-(3'-phospho-ribonucleoside)", + "N-behenoylsphinganine", + "(2S 5R)-5-O-[alpha-D-glucosyl-(1->2)-beta-D-galactosyl]-5-hydroxy-L-lysine [procollagen]", + "(-)-(1R,2S)-ephedrine", + "dopamine D3 receptor", + "8-demethyl-8-(2,3-dimethyl-alpha-L-rhamnosyl)-tetracenomycin C", + "butanol", + "phosphorylated L-type Ca2+ channel", + "syn-pimara-7,15-diene", + "S-Adenosyl-L-homocysteine", + "a 3beta-hydroxysteroid-4alpha-carboxylate", + "N-lauroylsphingosine", + "alditol", + "alpha-D-mannose", + "phosphorylated Fkh2p", + "2',2'-difluorodeoxycytidine", + "Tea1", + "laminin-332", + "(2S)-malate", + "acrosin", + "coenzyme gamma-F420-1", + "thromboxane A2", + "(E,E)-alpha-farnesene", + "N-acetyl-alpha-D-galactosaminyl-1-phosphate", + "cis-nerol", + "(S)-mandelate", + "cytosine49 in tRNALeuCAA", + "cytosine38 in tRNAAspGTC", + "an N-terminal Nalpha-acetyl-L-methionyl-L-glutaminyl-[protein]", + "2-hydroxy-3,4-dioxononyl phosphate", + "a ferricytochrome", + "Spt7p", + "alpha-L-rhamnopyranose", + "6-oxocyclohex-1-ene-1-carbonyl-CoA", + "L-Leu", + "N-trans-feruloyl tyramine", + "reduced ferredoxin 2", + "RCl", + "(10E,12Z)-13-[(2-hydroxypentan-2-yl)oxy]trideca-10,12-dienoic acid", + "16,17-dihydroxyandrost-4-en-3-one", + "gossypetin", + "myosin", + "dephospho-[[hydroxymethylglutaryl-CoA reductase (NADPH)] kinase]", + "glycosylphosphatidylinositol-anchored protein", + "phosphorylated BAF155", + "Acetoacetate", + "validoxylamine A", + "p12 subunit of human DNA polymerase delta", + "beta-stigmasterol", + "limonene", + "neopentalenolactone D", + "omega-N-phospho-D-Arg", + "poly[(R)-3-hydroxyoctanoate]x", + "L-tyrosinyl-tRNATyr", + "albomycin", + "Endothelin 1", + "cis-11-eicosenol", + "O-antigen serotype Yv", + "phosphorylated Wee1A", + "4-(sulfooxy)tamoxifen", + "beta-hydroxyacyl-[acyl-carrier protein]", + "4-carboxymethylenebut-2-en-4-olide", + "(R)-S-(2-pyridyl)cysteine N-oxide", + "L-tryptophan[side 2]", + "nonaprenyl diphosphate", + "5-formylcytosine", + "indol-3-ylacetyl-myo-inositol L-arabinoside", + "matrilin 1", + "sphinganine", + "eriodictyol", + "emodin", + "cyanidin 3-O-beta-D-glucosyl-5-O-(6-O-malonyl)-beta-D-glucoside", + "N8-glutathionylspermidine", + "IL-1R2", + "(7,8-dihydropterin-6-yl)methyl diphosphate", + "11(S),13-dihydrocostunolide", + "alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D glucosyl-(1<->1)-ceramide", + "acrylic acid", + "protopine", + "eIF5A-N6-(4-aminobutyl)-L-lysine", + "Cdk1", + "1-acyl-lysophosphatidylcholine", + "hydroxyphenylpyruvate", + "4-O-beta-D-mannopyranosyl-D-mannose", + "IKKalpha protein", + "23S rRNA pseudouridine746", + "nicotinamide", + "adenylated-tRNA-uridine", + "4(5)-imidazolone-5(4)-propionic acid", + "Ac-AISRRLL-7-amido-4-methylcoumarin", + "Galactitol-1-phosphate", + "(3-hydroxy-phenylalkanoic acid)n", + "truncated glutamic acid decarboxylase67", + "myo-inositol-1,2,3,4,5,6-hexakisphosphate", + "phloretin", + "apolipoprotein A-I", + "oxidized Watasenia luciferin", + "ferricytochrome c554", + "2-O-alpha-D-mannosyl-1-phosphatidyl-1D-myo-inositol", + "(1S,2R,4R)-limonene-1,2-epoxide", + "Rab8a protein", + "procollagen L-lysine", + "Ac-RRLQ", + "melanotropin", + "[pyruvate phosphate dikinase]", + "phospho-p27", + "insulin A chain", + "ketoprofen amide", + "[substrate-binding protein xacG][side 1]", + "31R-3-(1-hydroxyethyl)-chlorophyllide a", + "carbofuran", + "GDP", + "UDP-alpha-N-acetyl-D-glucosamine", + "protein Ggp1/Gas1", + "reduced electron-transfer flavoprotein EtfA-EtfB", + "tRNAPhe", + "2 cyclohexene", + "Factor VIIIa", + "c-Jun", + "Ni2+-[nickel-binding protein][side 1]", + "6-(D-glucose-1-phospho)-D-mannosylglycoprotein", + "collagen I", + "(13epsilon)-9,13-epoxylabda-14-ene", + "demeton-O sulfoxide", + "DRVYIH", + "acceptor-H2", + "angiotensin III", + "(Z)-2-hydroxyethyl N-hydroxy-2-(4-hydroxyphenyl)ethanimidothioate", + "quinolinic acid", + "a 5'-half-tRNA molecule with a 2',3'-cyclic phosphate end", + "connectin", + "guanine26 in tRNALeuTAG", + "YIL", + "CEP83", + "beta-D-glucans", + "phospho-Janus kinase 2", + "SAMTEEAAVAIK", + "poly(glycerol phosphate)/in", + "(S)-2-amino-1-(R)-3-dihydroxyoctadecane", + "meso-zeaxanthin", + "mu-carrageenan", + "naphthalene", + "TGFbeta", + "CFTR", + "N-propionyl-D-allo-isoleucine", + "5-aminovalerate", + "[TveIF-5A-precursor]-deoxyhypusine", + "MgATP2-", + "reduced cytochrome P450", + "5-enolpyruvoyl-6-hydroxy-2-succinyl-cyclohex-3-ene-1-carboxylate", + "C26-desgluco-avenacosides", + "(5beta,17beta)-17-hydroxyandrostan-3-one", + "N-(3,4-dichlorophenyl)-malonamate", + "pakin", + "monosaccharide 1-phosphate", + "2-oxosuccinamic acid", + "micronemal protein 2", + "penicillin K", + "Zn2+/in", + "3-epi-1alpha,23,25-trihydroxyvitamin D3", + "dioxolane guanosine 5'-phosphate", + "2-keto-L-gluconic acid", + "palmitoyl-[acyl carrier protein]", + "1-pentanol", + "trans-L-3-Hydroxyproline", + "O-antigen serotype Xv", + "2-dehydro-L-gulonic acid", + "glutathione[side 2]", + "(R)-1-aminopropan-2-yl phosphate", + "(4S)-Muconolactone", + "peptidoglycan-D-glucosamine", + "tRNA precursors", + "(3R)-vestitone", + "phosphorylated p42 MAPK", + "glucagon-like peptide 1", + "enoyl-ACP", + "[actin]-N-(ADP-D-ribosyl)-L-arginine177", + "kappa-neocarratetraose-sulfate", + "sigmaK", + "(3beta,5xi,6alpha,12beta,13xi)-3,6,12-trihydroxydammar-24-en-20-yl 6-O-alpha-L-arabinopyranosyl-beta-D-glucopyranoside", + "ribonucleotide 5'-phosphomonoester", + "a [histone H3]-N6-methyl-L-lysine4", + "silencing facor Sir3p", + "[hydroxymethylglutaryl-CoA reductase (NADPH)]", + "24-hydroxycholesterol", + "1D-myo-inositol 3,5-bisphosphate", + "4-(4-deoxy-alpha-D-gluc-4-enuronosyl)-D-galacturonate", + "4,4-dimethyl-5alpha-cholesta-8,14,24-triene-3beta-ol", + "6-O-[N-acetyl-alpha-D-glucosaminyl]-1-octadecylphospho-1D-myo-inositol", + "L-methionyl-tRNAMet", + "sidekick-2", + "20-hydroxy-leukotriene E4", + "2-oxocarboxylate", + "GSK3 protein", + "gibberellin 3", + "major histocompatibility complex class I molecules/in", + "gibberellin 4", + "malvidin 3-O-beta-D-glucoside 5-O-(6-O-malonyl)-beta-D-glucoside", + "hesperetin 7-O-[beta-L-rhamnosyl-(1-2)-beta-D-glucoside]", + "[Fe protein]-Nomega-alpha-(ADP-D-ribosyl)-L-arginine", + "laminariheptaose", + "gliadins", + "cyclomaltodextrins", + "adenine58 in tRNA", + "a 3-vinyl bacteriochlorophyllide d", + "Lin-1", + "2-acyl-sn-glycerol", + "citric pectin", + "2'-deoxy-2'-fluoro-beta-D-arabinofuranosyl-uracil", + "laminarioligosaccharide", + "beta-D-fructofuranosyl-(2->1)-beta-D-fructofuranosyl alpha-D-glucopyranoside", + "a long-chain acid anion", + "uracil-mismatched single-stranded DNA", + "dehydroepiandrosterone O-sulfate", + "UDP-3-O-((R)-3-hydroxymyristoyl)-N-acetylglucosamine", + "D-glucarate", + "(+)-borneol", + "[Notch1 protein with EGF-like domain 12]-L-serine", + "styrene", + "N-(4-coumaroyl)-L-homoserine lactone", + "Phe-tRNAPhe", + "dihydrolipoylprotein", + "D-glucuronide", + "O-alpha-galactosyl-1,4-galactosyl-1,3-N-acetylglucosaminyl-1 3-galactosyl-1,4-glucosyl-1,1-ceramide", + "5-dehydro-D-fructose", + "Ala-Leu", + "CHL1", + "hydroxymethylbilane", + "(2E,6E)-(10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoate", + "ursodeoxycholyltaurine/in", + "histone H2A", + "an alpha-2,8-linked polymer of sialic acid", + "human eukaryotic translation initiation factor 4 G I", + "CCDC92", + "norovirus polyprotein", + "oxidized dithiothreitol", + "benzene-1,4-diol", + "aminobutyrate", + "phosphorylated tyrosine hydroxylase", + "3-methyl-6-(propan-2-yl)cyclohex-2-en-1-one", + "HER2 protein", + "protogenin", + "aspartate-4-semialdehyde", + "L-glutamyl-alpha-tubulin", + "(1R,6R)-6-hydroxy-2-succinylcyclohexa-2,4-diene-1-carboxylate", + "7-[(3S)-(3-amino-3-carboxypropyl)]-4-demethylwyosine37 in tRNAPhe", + "cytosine48 in tRNAHis", + "4 Fe(III)", + "cellopentaose", + "N-hydroxy-4-acetylaminobiphenyl", + "2-methyl-3-oxopropanoate", + "4-nitrobenzyl alcohol", + "1-acyl-2-docosahexaenoyl-sn-glycero-3-phosphoethanolamine", + "4-hydroxy-3-methyl-2-(E)-butenyl diphosphate", + "2'-O-methyluridine2552 in 23S rRNA", + "ursolate", + "2-[(2E)-3,7-dimethylocta-2 6-dien-1-yl]-3-[(Z)-2-isocyanoethenyl]-1H-indole", + "N-acetylimidazole", + "IP3R1", + "2 H2O", + "scytalone", + "S-(4-bromophenyl)-3-thiopyruvate", + "lauryl alcohol", + "magnesium mesoporphyrin", + "[STAT3]-N6-acetyl-L-lysine", + "(5Z,11Z,14Z)-8,9-epoxyeicosatrienoic acid", + "6-methoxy-3-methyl-2-all-trans-octaprenyl-1,4-benzoquinol", + "CLE-RS3", + "UDP-4-deoxy-4-formamido-beta-L-arabinopyranose", + "D-xylulose", + "N-acetyl-L-methionine", + "SR protein", + "target membrane SNARe complex", + "20-hydroxy-leukotriene B4", + "abieta-7,13-dien-18-ol", + "GLH-1", + "alpha6 integrin", + "cytidine1920 in 23S rRNA", + "butyric acid", + "anhydromannitol iduronide", + "dammarenediol-II", + "L-3,4-dihydroxyphenylalanine", + "(1Z)-N-(sulfooxy)but-3-enimidothioic acid", + "1-epi-valienol 7-phosphate", + "stromal cell-derived factor 1alpha", + "6-hydroxymethyl-7,8-dihydropteridine", + "Keren", + "angiotensin-converting enzyme-2", + "a 2-oxo-acid", + "NeuAc-alpha-(2->3)-Gal-beta-(1->3)-GalNAc", + "outer membrane protein F", + "membrin", + "contactin-1", + "L-cystine[side 2]", + "(E/Z)-isocapronaldoxime", + "Synaptosome-associated protein", + "(2,1-beta-D-fructosyl)n+1", + "[(1R)-2,2,3-trimethyl-5-oxocyclopent-3-enyl]acetyl-CoA", + "3 alpha-D-mannopyranose", + "1-epi-valienol", + "N-acetyl-beta-D-glucosaminyl-1,3-N-acetyl-beta-D-galactosaminyl-R", + "[TtuB sulfur-carrier protein]-Gly-Gly", + "5-hydroxymethylfurfural", + "2,5-diamino-6-(1-D-ribosylamino)-4(3H)-pyrimidinone 5'-phosphate", + "(1->6)-alpha-D-glucan", + "6 oxidized adrenodoxin", + "6 ATP", + "phosphorylated glycogen synthase kinase 3", + "[IkappaBalpha protein]", + "2-methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid", + "MFR", + "phenylethanol", + "2,3-dihydrotabersonine", + "acidic amino acid/out", + "O-alpha-D-galactosyl-(1-3)-1D-myo-inositol", + "xanthopterin-B2", + "(2Z,4E)-2-hydroxyhexa-2,4-dienedioate", + "hygromycin 2''-phosphate", + "UDP-N-acetyl-3-D-muramate", + "tRNAArgHisLeuPro precursor", + "phosphatidylinositol-glycan-anchored membrane form of acetylcholinesterase", + "clozapine", + "2 [FeO(OH)]", + "(9S)-hydroperoxy-(10E,12Z)-octadecadienoic acid", + "(5Z,13E,15S)-11alpha,15-dihydroxy-9-oxoprosta-5,13-dienoate", + "L-palmitoylcarnitine", + "trans-4-coumaroyl-CoA", + "sulfide", + "adenosine 5'-tetraphosphate", + "[cystine-binding protein][side 1]", + "(3S)-3-hydroxy-N6,N6,N6-trimethyl-L-lysine", + "phosphoribosylaminoimidazole carboxamide", + "5-caffeoylshikimate", + "(S)-2-hydroxy-2-(4-hydroxyphenyl)acetate", + "trichohyalin-L-citrulline", + "fetuin", + "NeuAcalpha(2,3)-Galbeta(1,4)-GlcNAc-R", + "(5Z,8Z,11Z,14Z)-icosatetra-5,8,11,14-tetraenoyl-[glycerolipid]", + "fragments of amylopectin", + "N-acetyl-DEVD", + "cinnamyl acetate", + "n oxidized hemoprotein", + "chitin", + "atrazine", + "7alpha-hydroxy-3-oxochol-4-en-24-oyl-CoA", + "2-oxo-3-phenylpropanoate", + "16S rRNA uridine516", + "choline chloride", + "phosphorylated NF-H", + "ethyl dimethylphosphoramidocyanidate", + "TAKA-amylase A", + "3',4'-O-dimethyleriodictyol", + "tetrahydropteridine", + "reduced 7,8-didemethyl-8-hydroxy-5-deazariboflavin", + "Galbeta1-4GlcNAc-R", + "epithelial sodium channel gamma subunit", + "delta-guaiene", + "11-cis-retinyl palmitate", + "glycogen phosphorylase a", + "[C-phycoerythrin alpha-subunit CpeA]-Cys82-phycoerythrobilin", + "(3Z)-enoyl CoA", + "beta-D-glucose 1-phosphate", + "metampicillin", + "N-2,4,6-trinitrophenyl-D-Tyr-L-Val-amide", + "beta-D-fucose", + "1,2-di-(cis-9-octadecenoyl)-3-octanoyl-sn-glycerol", + "Tyrosine aminotransferase", + "long-chain fatty acyl CoA/cis", + "1,3-dichlorobenzene", + "interleukin 3", + "2-formyl-6-methylnaphthalene", + "1-acyl-2-arachidonoyl-sn-glycerol 3-phosphate", + "[O-beta-D-xylopyranosyl-(1-2)]-O-alpha-L-arabino-furanosyl-[1-3]-O-beta D-xylopyranosyl-(1-4)-D-xylopyranose", + "Sec2p protein", + "chlorophyll a", + "cyanidin 3-O-(2-O-beta-D-glucuronosyl)-beta-D-glucoside", + "dehydroepiandrosterone sulfate/out", + "(2E)-3-(4-hydroxyphenyl)-2-isocyanoprop-2-enoate", + "beta-amyloid precursor protein", + "DRVYIHPFHLLVYS", + "L-lactaldehyde", + "nucleoside triphosphate", + "5 mC-G duplex", + "[P-110]-L-tyrosine phosphate", + "[methyl-coenzyme M reductase alpha-subunit McrA]-glycine", + "2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoate", + "N-acetyl-alpha-L-aspartyl-L-glutamate", + "glyceraldehyde-3-phosphate dehydrogenase", + "N,N-dimethylformamide", + "1-acyl-lysophosphatidylethanolamine", + "1-acyl-sn-glycero-3-phosphocholine", + "von Willebrand factor 140-kD fragment", + "C12-carnitine[side 1]", + "MPK-7", + "5,10-methylene-tetrahydropteroylglutamate", + "neurophysin", + "cortactin", + "12 kDa peptide", + "2 O3-acetyl-L-serine", + "[large subunit of Rubisco]-N6-methyl-L-lysine", + "UDP-N-acetyl-alpha-D-mannosamine", + "tryptophan/in", + "(5Z,11Z,14Z,17Z)-icosa-5,11,14,17-tetraenoyl-CoA", + "n isopentenyl diphosphate", + "11-cis-retinol", + "1-(4-methylphenyl)ethanone", + "ferrocytochrome c552", + "1,8-cineole", + "2-dehydrolactose", + "[(1->6)-alpha-D-glucosyl]m+1", + "phosphorylated microtubule associated protein 1B", + "oxidized polyvinyl alcohol", + "STAT3 phosphoprotein", + "small-molecular-weight chromogenic peptides", + "rhodosaminyl-aklavinone", + "D-(-)-pantolactone", + "ethyl 4-chloroacetoacetate", + "phospholombricine", + "vascular endothelial growth factor", + "2 ferricytochrome c3", + "N2-(D-1,3-dicarboxypropyl)-L-arginine", + "guanine966 in 16S rRNA", + "5-formyluracil-mismatched single-stranded DNA", + "Ac-RTLK", + "reduced cytochrome c-554", + "eriodictyol+ [reduced NADPH-hemoprotein reductase]", + "oleoyl-sn-glycerol 3-phosphate", + "5-methylcytosine50 in tRNAGly(UCC)", + "4-hydroxy-trans-2-nonenoate", + "(S)-tetrahydroberberine", + "fibrinogen-L-citrulline", + "D-galactosamine-[galactosamine-binding protein Avi_5305][side 1]", + "saccharopine", + "phosphorylated MAPKAP-K2", + "dopaquinone", + "4-desmethyllanosterone", + "2'-palmitoyl/stearoyl-2-O-sulfo-alpha,alpha-trehalose", + "decylubiquinol", + "GGVL", + "pro-hepatocyte growth factor", + "feruloyl agmatine", + "2-butanol", + "neurotrophic soluble amyloid precursor protein", + "L-2-aminohexano-6-lactam", + "5 malonyl-CoA", + "reduced flavodoxin I", + "cysteamine", + "tamoxifen sulfate", + "lombricine", + "N-acetylaspartate", + "gentiotetraose", + "guanine26 in tRNASerUCA", + "reduced amicyanin", + "6-aminopyridine-3-carboxamide", + "L-arabino-1,4-lactone 5-phosphate", + "4-O-alpha-D-mannopyranosyl-D-mannopyranose", + "oxidized 3-acetylpyridine adenine dinucleotide", + "PA83", + "sorbitol 6-phosphate", + "poly (ADP-ribose)", + "formylmethanofuran", + "alpha-D-aldose 1-phosphate", + "SKARRKKVYP", + "2-hydroxybenzyl alcohol", + "4-(N-acetyl-beta-D-glucosaminyl)-beta-D-mannosyl-R", + "nuclear factor-kappa B", + "xyloglucan oligosaccharide", + "Ser30-phosphorylated Beclin1", + "3-(4-deoxy-beta-D-gluc-4-enuronosyl)-N-acetyl-D-glucosamine", + "N-acetyl-D-asparagine", + "n-propanal", + "4,4-dimethyl-5alpha-cholesta-8,14-dien-3beta-ol", + "phosphorylated pRb protein", + "alpha-maltose 1-phosphate", + "alpha-ketobutyrate", + "a sphingoid base", + "15-demethylaclacinomycin T", + "3-oxodecanoate", + "7-aminomethyl-7-carbaguanine", + "5alpha-cyprinol", + "3-tolunitrile", + "2 biopterin", + "lanosterol", + "pyruvate", + "4,4-dimethylzymosterol", + "(RS)-2,3-dichloropropan-1-ol", + "(S)-3-sulfolactaldehyde", + "[phycoerythrocyanin alpha-subunit]-Cys84-phycoviolobilin", + "tRNALeu", + "pVP2", + "histone H3 N6,N6-dimethyl-L-lysine9", + "N-hexanoyl-L-homoserine", + "2-acetamido-1-amino-1,2-dideoxy-beta-D-glucose", + "N1-acetylamantadine", + "L-tagatose", + "(25S)-3-oxocholest-4-en-26-oate", + "LAMP 2 protein", + "m7GDP", + "noradrenaline", + "4-hydroxy-3-methylbenzaldehyde", + "2',2'-difluorodeoxycytidine monophosphate", + "[apolipoprotein]-S-1,2-diacyl-sn-glyceryl-L-cysteine", + "5-methylcytosine49 in tRNAGln(CUG)", + "3beta-hydroxyergosta-7,24(241)-diene-4alpha-carboxylate", + "5-formyl-3-hydroxy-2-methylpyridine-4-carboxylate", + "D-Galalpha(1,4)D-Glu-ceramide", + "HSL protein", + "D-mannose-1-phosphate", + "[E2 ubiquitin-conjugating enzyme cullin-5]-S-ubiquitinyl-L-cysteine", + "mature 16S rRNA", + "[SREBP-1c]-L-lysine", + "secologanate", + "3-oxododecanoyl-[acyl-carrier protein]", + "methyl indole-3-acetate", + "mitogen-activated protein kinase kinase 6", + "3,4-dimethoxyphenylacetonitrile", + "protein p105", + "(R)-S-lactoylglutathione", + "(R)-3-phenyllactate", + "beta-D-galactosyl-(1-6)-beta-D-galactopyranoside", + "1-S-monopalmitoyloctanedithiol", + "pro-interleukin-1beta", + "hydroxypyruvate", + "peptide YY (1-36)", + "(1,4-alpha-glucosyl)n", + "3-cyano-L-alanine", + "streptomycin", + "acid trehalase D-aspartate", + "[eukaryotic elongation factor 2]", + "6,7-dihydropteridine", + "2-oxooctanoate", + "xylene-2,2'-diol", + "ranitidine", + "3-oxo-4-methylhexanoyl-[acyl-carrier protein]", + "4-aminobenzoic acid", + "[DNMT1]-L-lysine", + "factor V", + "(R)-phenyllactate", + "monoiodoacetate", + "naproxen", + "beta-D-galacturonate", + "NR2B subunit of NMDA receptor", + "2-dehydro-3-deoxy-L-galactonate", + "octanoyl-[acyl-carrier protein]", + "Man8GlcNAc2-[carboxypeptidase Y]", + "xylose", + "nonaprenyl-4-hydroxybenzoate", + "single-chain urokinase", + "beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-R", + "6-carboxyhexanoate", + "a (2E,4E)-alka-2,4-dienoyl-CoA", + "fibronectin N5-alkylglutamine", + "[SP-STK kinase]-serine/threonine phosphate", + "tubulin-GTP-complex", + "Fe3+-dicitrate[side 2]", + "di-trans,poly-cis-polyprenyl diphosphate", + "retinol", + "2-aminomuconate", + "thymosin beta4", + "2-phenylethylamine", + "labda-7,13(16),14-triene", + "(3S)-3-amino-3-(3-chloro-4-hydroxyphenyl)propanoyl-[peptidyl-carrier protein SgcC2]", + "L-prolylyl-tRNAGlu", + "coniferyl acetate", + "transforming growth factor-alpha peptide fragments", + "ubiquitin ligase Nedd4-2", + "[formate C-acetyltransferase]-glycin-2-yl radical", + "adenine1518/adenine1519 in 16S rRNA", + "acetyl-CoA", + "low density lipoprotein receptor", + "hn", + "13-cis-retinol", + "spermine", + "(R)-4'-phosphopantothenate", + "phosphorylated glycogen phosphorylase a", + "alpha-muricholic acid", + "UDP-3-O-((R)-3-hydroxymyristoyl)-D-glucosamine", + "N,N-dihydroxy-L-tyrosine", + "oleoyl-[CoA]", + "quercetin", + "(6E)-8-methylnon-6-enoyl-CoA", + "pentadecanoic acid", + "endorepellin", + "ethylacetoacetate", + "m7G(5')pppm6Am-mRNA", + "(N-acetylneuraminyl)-D-galactosyl-D-glucosylceramide", + "2-oxopentanedioic acid 5-benzyl ester", + "(7E,9E,11Z,14Z)-(5S,6R)-6-(cystein-S-yl)-5-hydroxyicosa-7,9,11 14-tetraenoate", + "protocatechuic acid", + "acylmono-beta-D-galactosyl-diacylglycerol", + "ferrocytochrome P450", + "decaprenol phosphate", + "oxygen", + "eukaryotic initiation factor eIF4GII", + "[enzyme]-cysteine", + "tRNAPro precursor", + "proteinase-activated receptor 1", + "Notch extracellular truncation fragment", + "phosphorylated MEK2", + "3,3,3-trifluoro-2-hydroxy-2-methylpropanoic acid", + "beta-hydroxybutyryl-CoA", + "11-oxotestosterone", + "methylcob(III)alamin", + "2,3-dihydro-3-hydroxytabersonine", + "[RsbV]-serine/threonine phosphate", + "10-formyl-7,8-dihydrofolate", + "HF", + "LVVYP", + "L-2-amino-6-oxoheptanedioate", + "L-Thr", + "alpha-L-Rha-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Gal-PP decaprenol", + "cleaved Slk19", + "(indole-3-yl)acetamide", + "[alpha-tubulin]-(gamma-(poly-alpha-L-glutamyl)-L-glutamyl)-L-glutamate", + "cis-8,9-epoxyeicosatrienoic acid", + "N2-malonyl-D-tryptophan", + "2-methylcyclohexa-1,5-diene-1-carbonyl-CoA", + "8-carboxy-8-demethylriboflavin 5'-phosphate", + "1D-myo-inositol 5-diphosphate 2,3,4,5,6-pentakisphosphate", + "prearchaellin", + "4-hydroxy-5-methyl-2-methylene-3(2H)-furanone", + "12-oxododecenoic acid", + "deoxycholylglycine/out", + "9,12-octadecadienoyl-CoA", + "retinylamine", + "a palmitoleoyl-[acyl-carrier protein]", + "UDP-L-rhamnose", + "4-fluorobenzoate", + "reduced [2Fe-2S] ferredoxin", + "imidazol-2-one", + "a long-chain 3-oxoacyl-CoA", + "D-glutamic acid", + "3 Na+/out", + "2,6-diamino-4-hydroxyformamidopyrimidine", + "3-oxopimeloyl-CoA", + "cyclo(L-Leu-L-Phe)", + "an N-terminal N-acetyl-L-alanyl-[S18 protein of 30S ribosome]", + "3-(hydroxy)ethyl-13-hydroxy-pheophorbide a", + "D-Thr", + "loxoprofen", + "D-fructose 1,6-diphosphate", + "L-(+)-S-(2-pyridyl)-cysteine sulfoxide", + "roseoflavin", + "N-terminal Nalpha-acetyl-L-methionyl-L-glutaminyl-[influenza virus PA-X]", + "all-trans-retinoic acid", + "[lipoprotein]-N-acyl-S-1,2-diacyl-sn-glyceryl-L-cysteine", + "hop-22(29)-ene", + "filaggrin-L-citrulline", + "a flavonol 3-O-[beta-D-glucosyl-(1->2)-beta-D-glucosyl-(1->2)-beta-D-glucoside]", + "5 (S)-methylmalonyl-CoA", + "amyloid beta protein 40", + "tigecycline", + "asparagusate", + "cytosine2870 in 25S rRNA", + "(ADP-D-ribosyl)-Galphai", + "[rhodopsin]-L-cysteine", + "DL-2-hydroxycaproate", + "D-glucuronic acid 1-phosphate", + "(sulfide)n+1", + "guanine527 in 16S rRNA", + "palmitoyl-CoA[side 2]", + "phosphorylated NFkappaB", + "o-nitroaniline", + "(4E,8E)-sphing-4,8-dienine ceramide", + "p-coumaric acid", + "deacetoxyvindoline", + "9-riburonosylinosine", + "D-methionine[side 2]", + "adenosylcobyric acid", + "fumonisin B3", + "2'-deoxy-beta-D-arabinofuranosyl-uracil", + "4-methyldibenzothiophene", + "phenylalanine/in", + "alpha-N-acetylneuraminyl-(2->6)-beta-D-galactosyl-(1->4)-N-acetyl-beta D-glucosamine", + "insulin-like growth factor binding protein-5", + "cytosine34 in mitochondrial tRNAMet(AUA) precursor", + "full-length glutamic acid decraboxylase67", + "Dermatan L-iduronate", + "acetyl-piccoloNuA4 peptide", + "2'-phospho-(ligated tRNA)", + "ADP-ribosylated essential ribosomal elongation factor 2", + "cytosine48 in tRNATyr(GUA)", + "elafin", + "a [protein]-L-arginine", + "alpha-L-arabinan", + "HOCl", + "7-aminomethyl-7-carbaguanine34 in tRNA", + "2 R-SH", + "(3S)-hydroxybutyryl-CoA", + "interleukin 11R", + "pro-sequence of alpha-mating factor", + "mammalian sterile 20-like kinase 1", + "bicyclo[3.2.0]hept-2-en-6-one", + "a 3-dehydropyranoside (or 3,4-didehydropyranoside)", + "N-Acetylmannosamine", + "cytosine49 in tRNAAsp(GUC)", + "human IgA1", + "(S)-norcoclaurine", + "L-glutamic acid-gamma-monohydroxamate", + "demeton-O", + "[ATP-citrate lyase]-L-histidine", + "N-methyl-D-aspartate receptor NR1 subunit", + "7-carboxy-7-carbaguanine", + "Smoothened protein", + "taxiphyllin", + "pro-matrix metalloproteinase-1", + "vitamin K 2,3-epoxide", + "[epidermal growth factor receptor]-tyrosine", + "6-(L-erythro-1',2'-dihydroxypropyl)-7,8-dihydropterin", + "[SRC-3]-Nomega,Nomega-dimethyl-L-arginine", + "D-phenylglycine", + "deacetylated peptidoglycan", + "rhodamine-EVNLDAEFK-quencher", + "dihydroxyphenylalanine", + "alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man (1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)] alpha-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc-2-pyridylamine", + "phosphorylated p53", + "2-hydroxy-7-methoxy-5-methyl-1-naphthoate", + "prolactin", + "(R)-2-benzylsuccinyl-CoA", + "lactococcin G/out", + "D-glucitol", + "STAT3", + "parkeol", + "2 oxidized [2Fe-2S] ferredoxin", + "O-beta-D-glucosyl-cis-zeatin", + "4-aminobiphenyl", + "fat-soluble vitamin esters", + "pro-uPA", + "interleukin-2 tyrosine kinase", + "alpha-casein glutamine", + "[parkin]-phospho-Tyr143", + "Rpt5", + "amyloid beta 4-38 fragment", + "6-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranoside", + "high molecular weight kininogen", + "insulin-like growth factor-II", + "17-oxo steroids", + "ERK", + "Na+/Ca2+ exchanger isoform 3", + "(9Z,11E,13S)-13-hydroperoxyoctadeca-9,11-dienoate", + "long-chain acid anion", + "3-O-beta-D-galactosyl-N-acetyl-alpha-D-galactosaminyl-L-serine [protein]", + "Nomega-(ADP-D-ribosyl)-agmatine-L-arginine", + "salmochelin S4", + "D-threitol", + "3-O-alpha-D-glucopyranosyl-3-O-alpha-D-glucopyranosyl-3-O-alpha-D glucopyranosyl-D-glucopyranose", + "Cu2+out", + "[(1->3)-beta-D-glucosyl]n", + "lumichrome", + "cis-3-oxo-2-(2'-pentenyl)cyclopentane-1-octanoic acid", + "nezukol", + "cyclo(L-tyrosyl-L-tyrosyl)", + "estrone", + "3-amino-3-deoxy-D-arabinose", + "(+)-germacrene D", + "L-valine", + "mRNAn+1", + "myo-inositol polyphosphate", + "D-bornesitol", + "1-acyl-lysophosphatidic acid", + "pyruvate dehydrogenase", + "2,2'-disulfonyl azobenzene", + "cellotetraose", + "eicosanoyl-CoA", + "(R)-dithiane sulfoxide", + "adenine58 in tRNA3Lys", + "dystrophin Dp71d", + "prothyrotropin-releasing hormone", + "5-deoxy-D-glucuronate", + "[GAP-43 protein]-L-cysteine", + "OH-", + "adenine in U6 ncRNA", + "ent-sandaracopimaradiene", + "membrane-associated transcription factor bZIP28", + "L-serine O-sulfate", + "polyamine-[polyamine-binding protein][side 1]", + "histone H1B", + "a (9Z,12E)-octadeca-9,12-dienoyl-[glycerolipid]", + "selenoprotein K", + "7,8-dihydromonapterin 3'-triphosphate", + "dihydroprogesterone", + "Manalpha(1-6)[Manalpha(1-2)Manalpha(1-2)Manalpha(1-3)]Manbeta(1 4)GlcNAc", + "dehypoxanthine futalosine", + "alpha-D-ribose 1,5-bisphosphate", + "1-hydroxyneurosporene", + "cyclo(L-phenylalanyl-L-tyrosinyl)", + "(1R,6S)-6-amino-5-oxocyclohex-2-ene-1-carboxylate", + "L-arabinan", + "p-coumaryl aldehyde", + "thiophene-2-carbonyl-CoA", + "methyl-coenzyme M", + "3-dehydroshikimate", + "an N-terminal-L-methionyl-[transmembrane protein]", + "glycerol-1-phosphate", + "3beta,12alpha-dihydroxy-5-beta-cholan-24-oic acid", + "(2R)-2-hydroxypalmitic acid", + "peptidyl amide", + "1-amino-1-deoxy-scyllo-inositol", + "(R)-3-hydroxyacyl-CoA", + "7-methylguanosine 5'-diphosphate", + "GluV8", + "(Z)-2-methyl-5-isopropylhexa-2,5-dienal", + "butanoyl [acyl carrier protein]", + "S-benzyl-L-cysteine sulfoxide", + "cis-11-eicosenal", + "Bcl", + "butyronitrile", + "polynucleotides", + "3-oxopropanoate", + "ginsenoside R1", + "[Notch1 protein with EGF-like domain]-3-O-(beta-D-glucosyl)-L-serine", + "2-(2-methylthio)ethylmaleate", + "RNA-DNA heteroduplex", + "L-5,10-methenyl-tetrahydrofolate", + "[RitR]-serine/threonine phosphate", + "2-O-alpha-D-glucopyranosyl-sn-glycerol", + "Nfs1", + "Mg2+/in", + "15-oxoprostaglandin", + "1-methoxyindol-3-ylmethyl-glucosinolate", + "1,12-diamino-3,6,9-triazadodecane", + "interleukin 1-beta", + "GlyA", + "plexin domain-containing protein 2", + "phospho-[MAP kinase kinase]", + "cholesta-7,24-dienol", + "RNA polymerase", + "2,5-dichlorobenzoate", + "wheat starch", + "(S)-2-phenyloxirane", + "N1-methylpseudouridine1191 in yeast 18S rRNA", + "(S)-coclaurine", + "[protein kinase C zeta]-L-tyrosine phosphate", + "phosphorylated goodpasture antigen", + "HSO3-", + "N-arachidonoylethanolamine", + "lycopene", + "oxidized Renilla luciferin", + "nicotine", + "adenine in U6 snRNA", + "5,6-dihydrouracil20b in tRNA", + "2,8-dimethyldibenzothiophene", + "oxidized rubredoxin", + "UDPMur2Ac(oyl-L-Ala-D-gamma-Glu-L-Lys-D-Ala-D-Ala)", + "5-chlorocatechol", + "galactotetraose", + "protein LRP6", + "naringenin-7-beta-glucopyranoside", + "beta-crystallin glutamine", + "D-Ile", + "porphobilinogen", + "(+)-piperitol", + "cholytaurine/out", + "CoA disulfide", + "TAFIa", + "mitochondrial targeting sequence of COX IV", + "an NDP-glycose", + "1-oleoyl-lysophosphatidylcholine", + "mitogen-activated protein kinase phosphatase-1", + "leukotriene D4", + "caspase recruitment domain adaptor-inducing IFN-beta (Cardif)", + "[Runx2]-N-terminal-N6-acetyl-L-lysine", + "an alpha-aminoacid ester", + "carboxymethyl-2-thiouridine34 in tRNA", + "[protein-PIIGlnZ]", + "N-[(7,8-dihydropterin-6-yl)methyl]-4-(beta-D-ribofuranosyl)aniline 5'-phosphate", + "adenylyl-[sulfur-carrier protein ThiS]", + "[PABP1]-L-arginine", + "2-amino-4-hydroxy-pterin", + "5'-OH RNA", + "[EF-Tu translation factor]-serine/threonine", + "phosphorylated VdHog1", + "4-O-(alpha-D-glucopyranosyl)-D-glucono-1,5-lactone", + "hemoprotein HasA/in", + "fragments of starch", + "epidermal growth factor", + "Ac-FISRRLL", + "FVNQHLCGSHLVEAL", + "glycyl-pp60c-Src", + "alpha-cyclopiazonate", + "poly(ribitol phosphate)", + "DL-methionine", + "2-naphthyl beta-D-xylopyranoside", + "cyanidin 3-O-[[2-O-(2-O-sinapoyl)-beta-D-xylosyl]-6-O-(6-O-(4-coumaroyl)-beta-D glucoside)] 5-O-(6-O-malonyl)-beta-D-glucoside", + "synapsin", + "[(1S)-4-hydroxy-2,2,3-trimethylcyclopent-3-enyl]acetate", + "bis(2-ethylhexyl)phthalate", + "ERK5", + "7-chloroindole-3-pyruvic acid", + "desmoplakin", + "UDP-2,3-diacetamido-2,3-dideoxy-alpha-D-glucuronate", + "2'-O-methylcytidine32/2'-O methylguanosine34 in tRNATrp", + "(S)-1-aminoethylphosphonate", + "hypoxanthine34 in tRNAArg2", + "2'-O-acetyl-ADP ribose", + "xenobiotic/in", + "Mg2+/out", + "3-fluorocyclohexa-1,5-diene-1-carbonyl-CoA", + "benzylpenicillin", + "[gamma-tocopherol methyltransferase]-L-lysine", + "Type I collagen", + "ethanol", + "3-oxo-n-butyric acid", + "partially deacetylated xylan", + "3-indoxyl sulfate", + "5alpha-androstane-3beta,17beta-diol", + "a [Co(I) corrinoid Fe-S protein]", + "lactaldehyde", + "(13R)-sclareol", + "3-oxo-octanoate", + "2-C-methyl-D-erythritol 2,4-cyclodiphosphate", + "fragments of C3 protein of complement system", + "(polyphosphate)n+1", + "magnesium protoporphyrin monomethyl ester", + "FFAAFCLPVFA", + "beta-alanine", + "UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2 6-diamino-heptanedioate", + "barley beta-glucan", + "albonoursin", + "(4R)-limonene", + "modified kininogen", + "[factor VII protein with EGF-like domain]-3-O-(beta-D-xylosyl)-L-serine", + "D-gluconate 6-phosphate", + "3-oxosphinganine", + "Phosphonoacetate", + "arabidiol", + "L-Lys/in", + "HB-EGF pro-peptide", + "hemicellulose xylogalacturonan", + "isomaltotriose", + "bentazon", + "(3S,5S)-3,5-diaminohexanoate", + "kinetensin", + "[IkappaB phosphoprotein]", + "1-(3-chlorophenyl)ethanone", + "4-methylthiobutanaldoxime", + "1D-myo-inositol 5-diphosphate pentakisphosphate", + "Morphine", + "2'-deoxymugineic acid", + "desulfo-A47934", + "a 3'-(hydroxy)phthioceranyl-2'-palmitoyl/stearoyl-2-O-sulfo-alpha alpha-trehalose", + "beta-D-GlcNAc-(1->4)-MurNAc-L-Ala-D-isoglutaminyl-L-Lys-D-Ala-D-Ala diphospho-ditrans,octacis-undecaprenol", + "deoxyinosine-containing deoxyoligonucleotide", + "apoptosis inducing factor", + "isoeugenol", + "fibrillar procollagen type III", + "P-selectin glycoprotein ligand-1 tyrosine", + "11-deoxycorticosterone", + "6-methyladenine1618 in 23S rRNA", + "L-5-glutamyl phosphate", + "(-)-ephedrine", + "decanoate", + "methyl beta-D-xylopyranoside 2-deoxy-3,4-di-O-acetate", + "(-)-alpha-terpineol", + "protein PLB", + "DL-glyceraldehyde", + "trans-2-hexenoyl-CoA", + "[protein]-L-cysteine", + "dolabradiene", + "phosphorylated Stargazin", + "acetylacetone", + "a cis-3-alkyl-4-alkyloxetan-2-one", + "NeuAcalpha2-3Galbeta1-4Glc-NAcbeta1-3Galbeta1-4GlcNAcbeta1-3Galbeta1 4Glcbeta1-ceramide", + "3-oxo-5,6-dehydrosuberyl-CoA", + "3-vinyl-8-ethyl-12-methyl-bacteriochlorophyllide d", + "squalene", + "17alpha,20beta-dihydroxy-4-pregnene-3-one", + "a 9-cis-epoxycarotenoid", + "an archaeal dolichyl beta-D-glucuronosyl-(1->3)-beta-D-glucosyl phosphate", + "[dinitrogen reductase]", + "[eIF5A-precursor]-lysine", + "2-oxo-4-methylvaleric acid", + "6-deoxy-L-galactose", + "deamido-NAD+", + "4-cyclopropyl-2-hydroxy-3,4-dioxobutyl phosphate", + "tungstate[side 2]", + "3,5-dimethylcyclohexan-1-one", + "Abl", + "[insulin receptor kinase]-tyrosine phosphate", + "GM3 ganglioside", + "acetylpyruvate", + "ribosomal protein P2", + "(6Z,8E,10E,14Z)-(5S,12R)-5,12-dihydroxyicosa-6,8,10,14-tetraenoate", + "diacetyl-lysyl-tRNALys", + "verruculogen", + "Rab11 protein", + "Ac-RRLL", + "tungstate/in", + "5-hydroxycyclohexylcarbonyl-CoA", + "fibrillin-1", + "[glucose hexokinase regulatory protein]", + "sialyllacto-N-tetraose a", + "geranoyl-CoA", + "dihydrotestosterone", + "L-xylo-hex-3-ulonolactone", + "N-palmitoyldihydroglucosylceramide", + "2 ferricyanide", + "alpha-D-abequose-(1->3)-2-O-acetyl-alpha-L-Rha-(1->2)-alpha-D-Man-(1 >2)-alpha-D-Man-(1->3)-alpha-D-Gal-PP-undecaprenol", + "5-methylcytosine59 in vtRNA1.3", + "L-serine-ethanolamine phosphate", + "tRNACys", + "catchin", + "CERT", + "1-monopalmitoyllysophosphatidylglycerol", + "(gamma-L-glutamyl)-L-amino acid", + "oleoyl-acyl-carrier protein", + "thyrotrophin releasing hormone", + "1,2-dihydroxyundecane-3,4-dione", + "brevican", + "methyl benzoate", + "Faa1p", + "lipid II(A)", + "an acetic ester", + "cyclo-L-Trp-L-Trp", + "histone H3-N6,N6-dimethyl-L-lysine36", + "cobaltsirohydrochlorin", + "omega-N-(L-arginino)succinate", + "3-Methyl-cis,cis-muconate", + "an N-carbamoyl-L-2-amino acid", + "TDP-4-dehydro-2,6-dideoxy-alpha-D-glucose", + "S-(15-deoxy-DELTA12,14-prostaglandin J2)glutathione[side 2]", + "ADP-aldose", + "2 sulfide", + "2'-fucosyllactose", + "phosphorylated phosphoenolpyruvate carboxylase", + "5-(4-hydroxy-but-1-ynyl)-2,2'-bithiophene", + "DELTA9-tetrahydrocannabinolate", + "12-hydroxydodecanoic acid", + "dTDP-2,3 6-trideoxy-3-C-methyl-4-O-methyl-3-nitroso-beta-L-arabino-hexopyranose", + "BubR1", + "Lipid A/in", + "6-chloropurine", + "[elongation factor 3]", + "[pyruvate kinase] phosphate", + "ferrileghemoglobin", + "phosphorylated beta-catenin", + "vascular endothelial growth factor A", + "PAK2", + "malonate", + "dec-9-enoyl-[acyl-carrier protein]", + "4-methyl-2-oxopentanoic acid", + "5-methylaminomethyl-2-selenouridine34 in tRNA", + "phosphate-[phosphate-binding protein][side 1]", + "(+)-5-oxo-1,2-campholide", + "Arylacetonitrile", + "cefotaxime/in", + "L-kynurenine", + "7,8-didemethyl-8-hydroxy-5-deazariboflavin", + "GlnZ", + "5-fluoro-UMP", + "3-epi-1alpha,23,26-trihydroxyvitamin D3", + "ursolic aldehyde", + "6-acetamido-3-aminohexanoate", + "L-thiocysteine", + "reduced electron acceptor", + "4-hydroxy-N-methyltryptamine 4-phosphate", + "polypeptide-O-(alpha-N-acetyl-D-glucosaminyl)hydroxyamino acid", + "D-Arabinose", + "3-oxo-23,24-bisnorcholesta-1,4-dien-22-oyl-CoA", + "mitochondrial glycerol-3-phosphate dehydrogenase", + "compound Mc1", + "cytosine32 in tRNA1Thr", + "chlorophyllide a", + "N-acetyl-D-hexosamine", + "an N-acetyl-D-amino acid", + "L-mannonate", + "opiomelanocortin", + "betaine", + "(2R)-2,3-dihydroxyisovalerate", + "n-nonanal", + "ammeline", + "campesterol", + "dehydroquinic acid", + "ganglioside GA2", + "2-chlorobenzoate", + "ascorbic acid", + "adenine34 in tRNAArg2", + "benzohydroxamic acid", + "diethyl 2-methyl-3-oxosuccinate", + "farnesal", + "2 UDP-D-glucuronate", + "[TveIF-5A-precursor]-lysine", + "[SER-2 tyramine receptor]-Nomega,Nomega'-dimethyl-L-arginine", + "S1P1R tyrosine O-sulfate", + "[epidermal growth factor receptor 2]-tyrosine phosphate", + "5-methylcytosine49 in tRNALys(UUU)", + "8 diphosphate", + "oxothiamin", + "pro-TNF-alpha", + "a kinesin associated with a microtubule at position n-1 (toward the minus end)", + "phosphorylated MYB32", + "formylglycinamidine ribonucleotide", + "Bap", + "p-cumate", + "11alpha-hydroxy-pregn-4-ene-3,20-dione", + "fragments of spore protein A", + "tauropine", + "ADAMTS9 propeptide", + "lithocholate 3-sulfate", + "mature GPI-anchored serine protease prostasin", + "amyloid beta-protein 1-420", + "N-methylpyridinium", + "4,5-dimethoxybenzoic acid", + "phytyl phosphate", + "2-hydroxy-2-methylpropanenitrile", + "MKK", + "3-oxohexanoate", + "kissper", + "(+)-limonene", + "GhMPK7", + "[fructose 1,6-bisphosphate aldolase]-L-lysine", + "2-chloro-2'-deoxyadenosine", + "Gsy2 protein", + "NADH", + "precursor of the large subunit of hydrogenase 3", + "6-hydroxycyclohex-1-ene-1-carbonyl-CoA", + "5-pregnen-3,20-dione", + "3 5'-deoxyadenosine", + "phospho-beta-adrenergic receptor", + "kallikrein", + "phloretin glucoside A2", + "diadenosine 5',5'-P1,P5-pentaphosphate", + "oxidized dinoflagellate luciferin", + "glycyl-HIV1 Gag protein N-terminal peptide", + "a 3-hydroxymethyl ceph-3-em-4-carboxylate", + "myelin basic protein", + "benzil", + "1-alkyl-sn-glycero-3-phosphoethanolamine", + "D-galacturonide", + "a chalcone", + "urokinase plasminogen activator", + "adenosine 3'-phosphate 5'-phosphosulfate", + "Oryzias latipes glycophosphoprotein MU-1", + "5-formylfuran-2-carboxylate", + "1-tetracosanol", + "an N-terminal-L-methionyl-L-seryl-[protein]", + "EGFR135", + "ursolic acid", + "Bad protein", + "oyster glycogen", + "5'phosphoguanylyl(3'-5')guanosine", + "13-(beta-D-glucopyranosyl)oxydocosanoic acid methyl ester", + "ubiquitin fusion ribosomal protein L40 mRNA", + "(S)-3-(imidazol-5-yl)lactate", + "1,1,1-trichloro-2,2-bis-(4-chlorophenyl)ethane", + "sym-homospermidine", + "5-methylcytosine38 in tRNAAspGTC", + "cytosine38 in tRNAAsp precursor", + "2 all-trans-retinal", + "denatured RNase", + "phosphorylated human cardiac sodium channel NaV1.5", + "sterigmatocystin", + "protein Mia40", + "phosphatidyl-N-methylethanolamine", + "2-propene-thioic acid", + "collagene type IV", + "[glutamate oxaloacetate transaminase 2]-N6-acetyl-L-lysine", + "kappa-neocarrahexaose-sulfate", + "7-[(3S)-3-amino-3-(methoxycarbonyl)propyl]wyosine37 in tRNAPhe", + "spheroiden-2-one", + "gamma-endorphin", + "2-oxo-3-hydroxybutanoic acid", + "a phosphatidylethanolamine", + "linoleoyl-CoA", + "lanosterone", + "(S)-4-Amino-5-oxopentanoate", + "N1-methylguanine37 in tRNA", + "L-glutaminyl-peptide", + "5-hydroxy-L-lysine", + "2 (S)-N-methylcoclaurine", + "Gag-Pol precursor polyprotein", + "RNase 9 protein tyrosine", + "(R)-10-hydroxystearate", + "dTDP-4-amino-4,6-dideoxy-alpha-D-galactose", + "cis-1,2-dihydroxy-cyclohexa-3,5-diene-1-carboxylate", + "[HPr protein]-serine/threonine phosphate", + "phosphorylated sodium channel", + "N-acetyl-beta-neuraminate", + "active caspase-3", + "L-galactose", + "[acceptor protein]-S-ubiquitinyl-L-cysteine", + "validienamycin", + "nucleoside 3',5'-cyclic phosphate", + "aurachin C", + "UDP-N-acetylmuramate", + "sn-glycero-3-phosphoglycerol", + "L-Asparagine", + "laminin-5 gamma-2 fragments", + "rac-1,2-propanediol", + "5'-phosphooligonucleotide", + "a (1->6)-alpha-D-glucan", + "cation-independent mannose-6-phosphate receptor", + "nitrate/in", + "N-3-oxododecanoyl-L-homoserine-1,4-lactone", + "Xras2 protein", + "human telomerase", + "pro-Der p 6", + "Rho kinase-2", + "petunidin 3-O-beta-D-glucoside", + "D-glycero-alpha-D-manno-heptose 1,7-bisphosphate", + "interleukin 8", + "N-eicosapentaenoylethanolamide", + "subtilisin/out", + "lupeol", + "(3R)-menthol", + "RNA(A)n", + "(R)-2-haloacid", + "[chloroplastic fructose 1,6-bisphosphate aldolase isoform 2]-L-lysine", + "2-oxo-dAMP", + "alpha-D-glucosylpyranosyl-1,6-D-fructofuranose", + "pentylamine", + "DINHISKS", + "N-acetyl-7,9-O-diacetylneuraminate", + "ADP-6-deoxy-alpha-D-altrose", + "(2R,3R,6S)-Virginiae butanolide-A", + "5-oxo-L-proline", + "2-methylisoborneol", + "gastrin releasing peptide-(1-27)", + "100000 Da fragment", + "phosphorylated I-kappaB", + "fibrin", + "adhesin Rh24", + "3,6-dichloropyridine-2,5-dione", + "1,3,6,8-tetrahydroxynaphthalene", + "[protein p53]-N6-methyl-L-lysine370", + "24-methylenelophenol", + "(8Z,11Z,14Z)-5,6-dihydroxyeicosatrienoic acid", + "1,2-dilauroyl-sn-glycerol 3-phosphate", + "phospho-MKK", + "D-Man-alpha-(1->2)-D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-[D-Man-alpha (1->2)-D-Man-alpha-(1->3)-[D-Man-alpha-(1->6)]-D-Man-alpha-(1->6)]-D Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D-GlcNAc-diphosphodolichol", + "dodecanoyl-(tetradecanoyl)-Kdo2-lipid IVA", + "(hydroxyphosphinyl)pyruvate", + "4-oxo-proline", + "L-amino acid", + "a 4-O-methyl-D-glucopyranuronate ester", + "10-hydroxygeraniol", + "2 retinal", + "Limulus clotting factor B", + "phosphatidylinositol-4-phosphate", + "Ror2", + "5-methylcytosine34 in mitochondrial tRNAMet precursor", + "D-fructose[side 1]", + "toluene", + "L-histidine699-[translation elongation factor 2]", + "sn-glycerol 3-phosphate-[glycerol 3-phosphate-binding protein][side 1]", + "cytosine49 in tRNAVal(UAC)", + "3,4-dimethoxycinnamoyl beta-D-glucoside", + "3-methyl-4-nitrophenol", + "6 oxidized ferredoxin [iron-sulfur] cluster", + "enolpyruvoyl-2-diphospho-5'-guanosine", + "pro-interleukin-18", + "Thr-Gly-Leu-Phe-Gln-Gly-Pro", + "2 lycopene", + "methyl alpha-D-glucose 6-phosphate[side 2]", + "octanoic acid", + "N-acetyl-beta-D-glucosaminyl-(1->)3-N-acetyl-alpha-D-galactosaminyl Ser/Thr", + "beta-1,2-oligofructans", + "UDP-N-acetyl-alpha-D-muramate", + "cytosine49 in tRNAAspGTC", + "L-Glu-4-nitroanilide", + "N-acetyl-D-galactosamine 4-sulfate units", + "N-(3-oxodecanoyl)-L-homoserine lactone", + "adenine670 in 25S rRNA", + "kievitone hydrate", + "cytosine72 in tRNACys(GCA)", + "L-3,4-Dihydroxyphenylalanine", + "oxidized 7,8-didemethyl-8-hydroxy-5-deazariboflavin", + "phosphorylated Gcn4 protein", + "4-[bis(2-iodoethyl)amino]-3,5-difluorobenzoic acid", + "4-anisyl aldehyde", + "adenylyl sulfate", + "5-methylcytosine2278 in 25S rRNA", + "[ATP-citrate lyase]-N-phospho-L-histidine", + "[ribulose-1,5-bisphosphate-carboxylase]-L-lysine", + "phosphorylated dopamine", + "D-arabinono-1,4-lactone", + "antimonite/out", + "[maltose-binding protein][side 1]", + "2 glutathione amide", + "2 putrescine", + "complement C1q zymogen", + "an alpha-linolenoyl-[glycerolipid]", + "cellular nucleic acid binding protein", + "ELFADKVPKTA", + "[androgen receptor]-L-tyrosine", + "arginine-vasopressin", + "(3R)-3-methyl-D-ornithine", + "UDP-beta-L-threo-pentapyranos-4-ulose", + "[protein phosphatase 4 catalytic subunit]-leucine methyl ester", + "dUMP", + "procollagen trans-(2S,4R)-4-hydroxy-L-proline", + "3-epideacetycinobufagin", + "7alpha-hydroxycholest-4-en-3-one", + "[histone H2A]-L-lysine5", + "5-aza-cidofovir", + "2 spermine", + "linear maltooligosaccharides", + "ipsenone", + "L-asparagine", + "8-oxo-2'-deoxyguanosine", + "3alpha-hydroxy-7-keto-5beta-cholanoyl glycine", + "D-arabinose 5-phosphate", + "145000 Da fragment", + "(3-sn-phosphatidyl)-L-serine", + "LHCP protein", + "3,4-didehydropyranoside", + "L-3-aminobutanoyl-CoA", + "UDP-2,3-bis[O-(3R)-3-hydroxymyristoyl]-alpha-D-glucosamine", + "L-2-aminoisobutanoate", + "[(1->6)-alpha-D-glucosyl]m", + "Zn2+-protoporphyrin", + "D-Ala-D-Ala", + "(Z)-3-nonenal", + "O-acetyl-ADP-D-ribose", + "2-chloroacrylate", + "D-Man-alpha-(1->3)-D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D-GlcNAc diphosphodolichol", + "2-amino-6-chloro-benzoic acid", + "APO H-protein N6-(octanoyl)lysine", + "gibberellin 97", + "D-ribose 1-phosphate", + "iron ferrichrome/out", + "profilin 1", + "20beta-hydroxypregn-4-ene-3,11-dione", + "L-arginyl-[protein]", + "tRNAGln(CUG)", + "a (3E,5Z)-alka-3,5-dienoyl-CoA", + "kanamycin C", + "spectinomycin", + "alachlor", + "Mca-KKWLMYPLEK-Dnp", + "alpha-(1-6)-mannobiose", + "N-acetyl-o-aminobenzoic acid", + "3-(ADP)-2-phosphoglycerate", + "(+)-kolavenyl diphosphate", + "octanal", + "UDP-4-amino-4,6-dideoxy-alpha-D-N-acetyl-D-glucosamine", + "m7G5'ppp5'N(3'ppp5'N)n", + "(R)-2-Methyl-3-oxopropanoyl-CoA", + "fibronectinglutamine", + "2 Ca2+[side 2]", + "3-chloroallylaldehyde", + "3alpha,7alpha,12alpha-trihydroxy-5beta-cholestane", + "sulochrin", + "phospho-[DNA-directed RNA polymerase]", + "N6-dimethyladenine2085 in 23S rRNA", + "phosphorylated Nedd4-2", + "(4S)-beta-phellandrene", + "nicotinamide D-ribonucleotide", + "[p53]-N6-acetyl-L-lysine120", + "phosphorylated GLI1", + "85 kDa N-terminal fragment", + "3-ureidopropanoate", + "phosphorylated c-Myc protein", + "beta-D-galactosyl-(1->3)-N-acetyl-beta-D-glucosamine", + "N1-methylguanine9 in tRNALeuCAA", + "ginsenoside 20(S)-Rg3", + "DNA-1-(2-hydroxypropyl)-adenine", + "24-methylidenelophenol", + "proteinase A", + "6-phospho-beta-D-glucosyl-(1,4)-D-glucose", + "RANTES 1-68", + "1,16-hexadecandiol", + "D-fructose 6-phosphate[side 2]", + "N-terminal L-glutaminyl-[protein]", + "(Z)-24-ethylidenelophenol", + "a flavonol", + "p65 protein", + "[RsbS]-serine/threonine phosphate", + "somatostatin-28", + "retinoblastoma protein", + "2 malto-oligosaccharides", + "2-maleylacetate", + "indol-3-acetic acid", + "fucosylated Notch protein", + "Cu+[side 2]", + "5,6,7,8-tetrahydropteridine", + "prothrombin", + "S-adenosyl 3-(methylthio)propylamine", + "beta-D-galactosyl-(1->4)-N-acetyl-beta-D-galactosamine", + "L-glutamate-[L-glutamate-binding protein][side 1]", + "peroxiredoxin disulfide", + "UDP-alpha-D-galactofuranose", + "L-aspartate 4-semialdehyde", + "Zn2+[side2]", + "propionitrile", + "sidekick-1", + "3-(2-(N-acetyl-beta-D-glucosaminyl)-alpha-D-mannosyl)-beta-D-mannosyl-R", + "N-acetyl-beta-D-galactosamine", + "Blc10", + "N3-methyluracil1498 in 16S rRNA", + "eIF4G1 protein", + "Ras protein", + "dentin phosphoprotein", + "N-acetyl-alpha-D-hexosamine 1-phosphate", + "epidermal growth factor peptide fragments", + "[histone H3]-N6-acetyl-L-lysine56", + "uridylyl-[protein-GlnK]", + "4'-O-beta-D-glucosyl-cis-p-coumarate", + "blasticidin S", + "phlorizin", + "(+)-copalyl diphosphate", + "phospho-tyrosinyl-Cas protein", + "Man9GlcNAc2-pyridylamine", + "cerulein", + "2 molybdopterin-synthase sulfur-carrier protein", + "methyl ecgonone", + "adhesin JESEBL", + "L-Arg-[protein-disulfide isomerase]", + "N-1-(5'-phosphoribosyl)-AMP", + "[Man-alpha-(1->6)]-[Man-alpha-(1->3)]-Man-beta-(1->4)-GlcNAc-beta-(1 >4)-GlcNAc", + "a holo-[acyl-carrier protein]", + "insulin B chain", + "D-galactose", + "2 pelargonidin", + "pyrazinoic acid", + "(8S)-3',8-cyclo-7,8-dihydroguanosine 5'-triphosphate", + "dTDP-3-amino-3,6-dideoxy-alpha-D-galactopyranose", + "1,2-dehydroreticulinium", + "pantotheine", + "5beta-cholestan-3alpha,7alpha-diol", + "ferricytochrome c-551", + "eIF5A", + "[L-leucine-binding protein][side 1]", + "2'-dehydrokanamycin A", + "3-O-acetylpapaveroxine", + "GSSG", + "4'-O-methylnorbelladine", + "cladribine 5'-phosphate", + "2-acyl-lysophosphatidic acid", + "guanine9 in tRNALeuCAA", + "dioleoylglycerol", + "CysD", + "hygromycin B", + "90 kDa beta3 chain fragment", + "GlcNAcbeta(1->2)Manalpha(1->6)(GlcNAcbeta(1-2)Manalpha(1->3))Manbeta(1 >4)GlcNAcbeta(1->4)GlcNAc", + "17,21-dihydroxy-pregn-4-ene-3,11,20-trione", + "xylohexaose", + "methenyl-tetrahydromethanopterin", + "adenylylsulfate", + "leukotriene C4", + "beta-caryophyllene", + "4-bromophenylalanyl-tRNATyr", + "proTGF-alpha", + "hypoxanthine-mismatched double-stranded DNA", + "4 H2O", + "phosphorylated Smoothened", + "mRNA", + "cytosine48 in tRNALeu(CAG)", + "Cdc20", + "CREM", + "a 1-linoleoyl-2-acyl-[glycerolipid]", + "(3S,5S)-clavaminate", + "a [methyl-Co(III) corrinoid Fe-S protein]", + "2-methylbutanal", + "[optineurin phosphoprotein]", + "4beta-(S-cysteinyl)-epicatechin", + "phosphorylated Ca2+/calmodulin-dependent protein kinase II", + "serine/threonine-protein kinase PAK2", + "2,5-anhydro-3-O-alpha-L-idopyranuronosyl-D-mannitol", + "5-enolpyruvylshikimate-3-phosphate", + "[TRRAP]-N6-acetyl-L-lysine", + "an N-terminal-Nalpha-acetyl-L-valyl-[protein]", + "CCN3", + "dTDP-4-acetamido-4,6-dideoxy-alpha-D-galactose", + "2 chloride", + "N-substituted aminoacyl-tRNA", + "trask", + "mitogen-activated protein kinase kinase 2", + "N-feruloylglycine", + "pyruvate dehydrogenase complex", + "2 alpha-D-mannopyranose", + "dehydroquinate", + "[histone H3]-N6,N6-dimethyl-L-lysine 27", + "alpha-D-talo-hexodialdose", + "8-oxoguanine", + "p-cresol", + "Dabcyl-KTSAVLQSGFRKME-EDANS", + "(3S,5R,6R)-5,6-dihydroxy-6,7-didehydro-5 6-dihydro-12'-apo-beta-caroten-12'-al", + "SDF-1/CXCL12", + "beta-terpinene", + "(5Z,13E)-(15S)-11alpha,15-dihydroxy-9-oxoprosta-5,13-dienoate", + "GFGDLKSPAGLQV", + "s-Mgm1", + "D-galactose-[galactose-binding protein][side 1]", + "FtsL protein", + "8-gingerol 5-O-beta-D-glucuronoside", + "RS-CH2-CH(NH3+)COO-", + "[C-phycocyanin beta-subunit]-Cys84-phycocyanobilin", + "2 benzyl 2-methyl-3-oxobutyrate", + "(1H-indol-3-yl)acetate", + "3beta,7alpha-dihydroxy-5-cholestenoic acid", + "Elk-1", + "6-methoxy-3-methyl-2-all-trans-polyprenyl-1,4-benzoquinol", + "2 UDP-N-acetylglucosamine", + "(15S)-HPETE", + "compound Mx1", + "6-chloropyridine-3-carboxamide", + "6beta-hydroxycholest-4-en-3-one", + "L-Orn", + "D-glucopyranose 6-phosphate", + "5-(2-hydroxyethyl)-4-methylthiazole", + "2 O2", + "colistin", + "S-(prostaglandin A2)glutathione[side 1]", + "Golgi apparatus protein 1", + "cinnamoyl-diketide-N-acetylcysteamine", + "sn-glycero-3-phosphocholine", + "cAMP response element-binding protein", + "phosphoylated RNA polymerase II C-terminal subunit", + "DREAM", + "[p53]-L-lysine120", + "2,4-dinitrophenyl-glutathione", + "1-carboxyvinyl carboxyphosphonate", + "MPK6", + "Fe3+-enterobactin complex[side 2]", + "(S)-canadine", + "[beta-catenin]-N6-acetyl-L-lysine", + "iron(III)-N-(2,3-dihydroxybenzoyl)-L-serine dimer complex", + "[PknJ]-serine/threonine phosphate", + "lipoxin A4", + "mutan", + "DNA containing N6-methyladenine", + "phosphorylated paramyosin", + "(E)-2-(2-(6-hydroxy-2,3-dihydro-1H-xanthen-4-yl)vinyl)-3 3-dimethyl-1-propyl-3H-indol-1-ium", + "71-hydroxychlorophyll a", + "6-gingerol", + "2 GDP-alpha-D-mannose", + "2,4,5,6-tetrachloroisophthalonitrile", + "folded actin", + "TFAM", + "N-glycosylated lactoferrin", + "PFHLL", + "aminophospholipid[side 2]", + "L-2-amino-3-oxobutanoate", + "dimethyl-histone 3 L-lysine 36", + "O-alpha-galactosyl-1,3-galactosyl-1,3-N-acetylglucosaminyl-1 3-galactosyl-1,4-glucosyl-1,1-ceramide", + "intercellular adhesion molecule 1", + "(ADP-D-ribosyl)n-Rab5", + "UDP-D-xylose", + "3-(1H-imidazol-4-yl)-2-oxopropanoate", + "5,6,7-trihydroxyflavone-7-O-beta-D-glucuronate", + "di-D-fructofuranose 1,2:2,3 dianhydride", + "1-alpha-D-[(1->4)-alpha-D-glucosyl]n-1-alpha-D-glucopyranoside", + "L-arginine-[L-arginine -binding protein][side 1]", + "2beta-hydroxygibberellin", + "dihomolinoleoyl-[glycerolipid]", + "trans-cinnamoyl beta-D-glucoside", + "coagulation factor V", + "fragments of pro-thyrotropin-releasing hormone", + "phosphorylated casein", + "fodrin", + "2 H+[side 1]", + "2-(methylsulfanyl)propanoate", + "methyl beta-D-xylopyranoside 3,4-di-O-acetate", + "corticosterone", + "N-acetyl-beta-D-glucosaminyl-polyribitol phosphate", + "ferrocytochrome c-553", + "GlpLYENKPRRPYIL", + "2 hypoxanthine", + "Proinsulin", + "glycosyl acceptor", + "dithiothreitol disulfide", + "N-acetyl-lysine-heat shock protein 90", + "7alpha,26-dihydroxy-4-cholesten-3-one", + "mature brain derived neurotrophic factor", + "hepatitis A virus polyprotein", + "8-gingerol", + "cob(II)alamin", + "Asn-Leu", + "neuronal glial antigen 2", + "2,2',3,4,4',5,5'-heptachlorobiphenyl", + "beta-D-mannopyranosyl-(1->3)-D-glucopyranose", + "(phosphate)n-1", + "12-oxoeicosatetraenoic acid", + "docosa-7,10,13,16,19-pentaenoic acid", + "Mad3", + "2-oxopropanoate", + "[histone H3]-L-lysine56", + "phosphorylated cdk2", + "2 gamma-glutamylcysteine", + "2 S-methyl-5'-thioadenosine", + "(1'S)-(+)-abscisate", + "Manalpha(1-2)Manalpha(1-2)Manalpha(1-3)[Man(1-6)]ManbetaGlcNac betaGlcNAc", + "3beta-hydroxy-9beta-pimara-7,15-diene-19,6beta-olide", + "GDP-D-perosamine", + "(17beta)-estra-1(10),2,4-triene-3,4,17-triol", + "beta-santalene", + "endogenous acceptor molecule modified", + "Immunoglobulin G1", + "[(1->4)-alpha-D-glucosyl]n+1", + "indole acetonitrile", + "(S)-ureidoglycine", + "glycoprotein D-galactosyl-(1->3)-N-acetyl-D-galactosamine", + "keratan 6'-sulfate", + "3-deoxygluconic acid", + "3-hydroxy-3-(4-hydroxy-3-methoxyphenyl)propanoyl-CoA", + "6-hydroxyhexanoate", + "methyl chloride", + "[E2 ubiquitin-conjugating enzyme cullin-2]-S-ubiquitinyl-L-cysteine", + "[allose-binding protein][side 1]", + "activated factor IX", + "trans-6-hydroxyferuloyl-CoA", + "RNase A disulfide", + "3-diphospho-1D-myo-inositol 1,2,4,5,6-pentakisphosphate", + "(2S,3S)-2,3-dihydroxy-2,3-dihydrobenzoate", + "styrene oxide", + "(3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylate", + "acrolein", + "3-hydroxy-2-methylpyridine-4,5-dicarboxylate", + "N-(5-phospho-D-ribosyl)-anthranilate", + "methylsuccinyl-CoA", + "2-hydroxybutane-1,2,4-tricarboxylate", + "4-maleylacetoacetate", + "alpha-aminoadipate", + "beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc-N-Asn [protein]", + "propeptide of proteinase B", + "a nucleoside diphosphate", + "IgG", + "secalciferol", + "N-terminal-CENP-A", + "alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-[alpha-D-Man-(1->3)-alpha-D-Man (1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)]n-alpha-D-Man-(1->3)-alpha D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-GlcNAc-diphospho-ditrans octacis-undecaprenol", + "pro-tumour necrosis factor-alpha", + "phosphorylated protein kinase CK2alpha", + "5alpha-cholest-22-en-3beta-ol", + "acetyl phosphate", + "leukotriene B4/out", + "Oxalate", + "2-hydroxy-6-oxo-6-(2-hydroxyphenyl)-hexa-2,4-dienoate", + "3alpha-hydroxy-ent-cassadiene", + "NF-kappaB p65/RelA component", + "UDP-2,3-bis((R)-3-hydroxytetradecanoyl)-alpha-D-glucosamine", + "Ac-QKSIAVGRTLK-7-amido-4-methylcoumarin", + "5-methylcytosine72 in tRNACys(GCA)", + "L-glucose", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-threonyl-[protein]", + "3-O-alpha-D-mannopyranosyl-alpha-D-mannopyranose", + "indole-3-acetaldehyde", + "D-ribose", + "L-3-hydroxyisobutyrate", + "tRNASec", + "IGFBP-3", + "6 reduced ferredoxin [iron-sulfur] cluster", + "salicyl alcohol", + "polar amino acid[side 2]", + "pentachlorophenol", + "enkephalin", + "denatured RNase A", + "hepatocyte growth factor/scatter factor", + "vesicle associated membrane protein", + "alpha-N-acetylneuraminyl-2,3-beta-D-galactosyl-1 4-beta-D-glucosylceramide", + "collagen XIV", + "3,5,7,3',4'-pentahydroxyflavone", + "(2E)-3,7-dimethylocta-2,6-diene-1-thiol", + "big-endothelin-1 (1-38)", + "[LarE]-dehydroalanine", + "linolenic acid 9,10-15,16-diepoxide", + "N-[(5S)-5-amino-5-carboxypentanoyl]-L-cysteinyl-D-valine", + "3-O-beta-D-glucopyranosyl-D-glucopyranose", + "aminomalonic acid", + "1-omega-hydroxy-acyl-sn-glycerol 3-phosphate", + "5,6,7,8-tetrahydrobiopterin", + "(10E,12Z)-9-hydroperoxy-10,12,15-octadecatrienoic acid", + "Vasopressin", + "cycloeucalenol", + "phosphorylated mitogen-activated protein kinase phosphatase-1", + "Der p 6 propeptide", + "(R)-ipsdienol", + "geraniol acetate", + "nicked DNA containing mismatches", + "lipid A", + "2-amino-5-chlorophenol", + "N2-acetyl-L-ornithine", + "glycerophosphoglycerol", + "4-chlorocyclohexa-1,5-diene-1-carbonyl-CoA", + "procaspase-9", + "QFVRH", + "4-pregnen-3alpha,20beta-diol", + "L-iduronate", + "(2S)-3-sulfolactaldehyde", + "phosphatidylethanolamine[side 1]", + "7 H+[side 2]", + "8 H2O", + "1,2-dioleoyl-sn-lysophosphatidic acid", + "5-methylcytosine38 in tRNAAsp", + "F2-isoprostane", + "(3S)-(+)-asterisca-2(9),6-diene", + "2-butenoyl-CoA", + "N-formyl-o-aminoacetophenone", + "a very-long-chain ceramide", + "2 K+[side 2]", + "selgin", + "3,4 dihydroxyphenylacetate", + "3-nitrocyclohexan-1-one", + "(S)-2-chloropropionic acid", + "5-amino-6-ribitylamino-2,4(1H,3H)-pyrimidinedione", + "3,3',5-triiodo-L-thyronine", + "resorcinol", + "5-oxo-4,5-dihydrofuran 2-acetate", + "(3R)-3-hydroxy-2-oxo-4-phosphonooxybutanoate", + "tetracenomycin D3", + "2,5-diketo-D-gluconate", + "C5 protein", + "protein-L-methionine (S)-S-oxide", + "Cyt oligodeoxynucleotide", + "[very long-chain acyl-CoA dehydrogenase]-N6-acetyl-L-lysine", + "a [methyl-Co(III) dimethylamine-specific corrinoid protein]", + "5-methylcytosine48 in tRNALys(UUU)", + "RS", + "(13S)-hydroperoxy-(9Z,11E)-octadecadienoic acid", + "phosphorylated dopamine and cAMP-regulated phosphoprotein", + "ppGpp", + "5'-phosphoribosyl-5-amino-4-imidazolecarboxamide", + "N-carbamoyl-D-amino acid", + "L-fucose 1-phosphate", + "processed cytochrome c peroxidase", + "elisabethatriene", + "fragments of brevican", + "furan-2-carbaldehyde", + "N4-methylcytosine1402 in 16S rRNA", + "guanine9 in tRNAArg", + "poly(caprolactone)", + "acetyl-histone H3", + "(-)-threo-iso(homo)2citrate", + "fucosylated transcription regulators DELLA", + "acetylated androgen receptor", + "histine H2A", + "[procollagen]-(2S,5R)-5-hydroxy-L-lysine", + "(R)-2-hydroxypropylphosphonic acid", + "HPr", + "(4E,8E)-sphinga-4,8-dienine ceramide", + "[YegI kinase]-serine/threonine", + "1-butyl alcohol", + "allyl isothiocyanate", + "2-hydroxy-1,4-benzoquinone", + "[Vibrio cholerae protein NqrC]-FMN-L-threonine", + "[protein]-N6-acyl-L-lysine", + "a long-chain acyl-[mycocerosate synthase]", + "corn endosperm xylan", + "D-Leu", + "nucleoside 5'-phosphates", + "4-methoxyindol-3-ylmethyl-glucosinolate", + "cytosine48 in tRNAVal(UAC)", + "(2S)-2-nitrobutanedioate", + "pSu3", + "a 17alpha-hydroxy-C21-steroid", + "chenodeoxycholate", + "trihexosylceramide", + "lactono-1,5-lactone", + "N,N-dimethylamphetamine", + "oxidized azurin", + "[phycoerythrocyanin beta-subunit]-Cys155-phycocyanobilin", + "L-glutamine[side 2]", + "D-mannosyl-1-phosphoundecaprenol", + "oseltamivir", + "leukotriene C4[side 2]", + "[histone H4R3]-Nomega-dimethyl-L-arginine", + "phosphorylated protein kinase Hs11", + "sorbitol", + "[Fe protein]-L-arginine", + "beta-muricholate", + "1D-myo-inositol 1,4,5-trisphosphate", + "mycothione", + "3-methylthio-L-aspartate89-[ribosomal protein S12]", + "abietadiene", + "beta-transducin repeat containing protein", + "tRNAVal", + "D-arabitol 1-phosphate", + "2,5-diaziridinyl-3-(hydroxymethyl)-6-methyl-1,4-benzoquinone", + "holo-[CmaA peptidyl-carrier protein]", + "factor H", + "tributyrin", + "early mitotic inhibitor 1 protein", + "3'-phosphoadenylyl 5'-phosphosulfate", + "5beta-pregnane-3,20-dione", + "2-monooleoylglycerol", + "(12,13S)-oxido-(9Z,11)-octadecadienoic acid", + "2-methyladenine2503 in 23S rRNA", + "androst-4-ene-3,11,17-trione", + "a 1-gamma-linolenoyl 2-acyl-sn-glycerol 3-phosphate", + "arginine", + "methyl gibberellin A4", + "coformycin", + "N-tetradecanoyl-glycyl-pp60c\u0002Src", + "pre-D1 protein", + "D-cystine-[cystine-binding protein](side 1)", + "ceftriaxone", + "arabinoxylans", + "[Wnt]-L-serine", + "F2-isoprostane phospholipid", + "beta-endorphin", + "glutathione-1,4-dihydroxynonane", + "beta-elemene", + "3beta-hydroxy-5beta-pregnane-20-one", + "AVP-CONH2", + "[mannuronan]-beta-D-mannuronate", + "4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol", + "alkaline protease inhibitor", + "beta-D-glucopyranose", + "DRVYIHPFH", + "Pah1 phosphatidate phosphatase", + "reduced cytochrome b", + "7-hydroxyserotonin", + "[LarE]-L-cysteine", + "an isoflavone", + "[GraR]-serine/threonine", + "actin peptide H", + "[SoxYZ protein]-S-(2-sulfodisulfanyl)-L-cysteine", + "vitexin 2''-O-beta-L-rhamnoside", + "N1-methyladenosine1408 in 16S rRNA", + "N-acetyl-alpha-D-galactosamine", + "Galbeta(1-3)Galbeta(1-4)Xyl", + "Der p 9", + "oligoglycosylglucose", + "3alpha,7beta-dihydroxy-5beta-cholanoyl taurine", + "2,2-dimethylcyclopropanecarboxamide", + "N-acetyl-D-galactosaminylglucuronylgalactosyl glycosides", + "CoA-SH", + "3-dehydro-2-deoxy-D-gluconate", + "oryzalexin E", + "[(1->4)-alpha-D-glucosyl]n+2", + "5beta-scymnol", + "5'-GMP", + "thiazole-4-carboxamide adenine dinucleotide", + "sphingomyelin", + "elastin peptides", + "phosphorylated phospholipase C-gamma1", + "UDP-MurNAc-L-Ala-D-Glu-L-Lys-D-Ala-D-Ala", + "(8Z,11Z,14Z)-icosa-8,11,14-trienoyl-CoA", + "1,4-androstadiene-3,17-dione", + "a 5'-triphospho-[mRNA]", + "mature cytochrome c oxidase", + "2 CTP", + "protochlorophyllide a", + "glycocholate", + "L-cystine(side 2)", + "(+)-thujan-3-one", + "H-protein", + "5-methylcytosine48 in tRNAGln(CUG)", + "(1,6-alpha-D-glucosyl)n", + "phosphorylated microtubule affinity regulating kinase 2", + "ferroleghemoglobin", + "Cu2+/in", + "laminin receptor 1", + "2 peptides of 176 kD and 140 kD", + "phosphorylated STAU2", + "7-O-methylvitexin 2''-O-beta-L-rhamnoside", + "Rad53 protein", + "thermoNicotianamine", + "n-nonanol", + "phosphorylated phospholipase D", + "(S)-2-hydroxy-2-phenylacetate", + "oligo-N-acetyllactosaminoglycan", + "Rac1", + "G-protein-coupled protease-activated receptor-2", + "4 malonyl-CoA", + "oxidized cytochrome c XoxG", + "2-hydroxypenta-2,4-dienoic acid", + "(2R,4S)-2-[(R)-carboxy[(phenylacetyl)amino]methyl]-5,5-dimethyl-1 3-thiazolidine-4-carboxylic acid", + "precorrin-5", + "3-O-hexadecyl-sn-glycero-1-phosphocholine", + "[elongation factor 2alpha]-serine/threonine", + "tRNAGlx", + "3-methyl-muconolactone", + "2-acetylaminofluorene", + "nicotianamine", + "XTP", + "type 1 collagen", + "D-aldose", + "7-dehydropregnenolone", + "larchwood arabinogalactan", + "4-deoxy-L-erythro-5-hexoseulose uronic acid", + "3-D-glucuronosyl-N2,6-disulfo-beta-D-glucosamine", + "[beta-D-xylose-(1,2)]-galactoxylomannan", + "donor", + "5-methylcytosine59 in vtRNA1.2", + "phospho-tyrosinyl p130Cas", + "phosphorylated protein HDAC", + "geranyl diphosphate", + "2-methyl-1-[2,4 6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]propan-1-one", + "2,5-diamino-6-beta-ribosylamino-4(3H)-pyrimidinone 5'-phosphate", + "cis-11-eicosenyl acetate", + "C5aR tyrosine O-sulfate", + "cysteine", + "2-amino-2H-isophenoxazine-3-one-1,9-dicarboxylic acid", + "dalpatein-7-O-[beta-D-apiofuranosyl-(1-6)-beta-D-glucopyranoside]", + "Gal-beta-(1-3)-GlcNAc-beta-(1-4)-Glc", + "3-acetylamino-4-hydroxybenzaldehyde", + "7000 Da fragment of von Willebrand factor 115", + "3,4',5-trihydroxystilbene", + "phosphatidyl inositol 4,5-bisphosphate", + "peptide diphthamide", + "2-naphthylamine", + "[GLDH1 protein]-L-lysine", + "fragments of small acid-soluble protein beta", + "ERF-VII peptide", + "complement component C3(NH3)", + "5,6-dihydropyrimidine", + "phenylacetone", + "iota-carrabiose", + "[histone H3]-N6,N6,N6-trimethyllysine36", + "[dinitrogen reductase] component of nitrogenase complex", + "[protein with EGF-like domain]-L-serine", + "sn-1,2-dimyristoylglycerol", + "[Wnt5]-O-(9Z)-hexadec-9-enoyl-L-serine", + "protein-L-methionine (R)-S-oxide", + "[low density lipoprotein receptor-related protein]", + "Golgi phosphoprotein 4", + "linamarin", + "Slr0077", + "phlormethylbutanophenone", + "epsilon-N-(D,L-lipoyl)-L-lysine", + "(3R,5S)-3-hydroxy-1-pyrroline-5-carboxylate", + "3,3'-dihydroxylarreatricin", + "5-methylcytosine48 in tRNAAla(CGC)", + "4-aminophenol", + "pretRNA", + "chaperone Star", + "histone H", + "[E2 ubiquitin-conjugating enzyme UBCH7]-L-cysteine", + "protoheme IX", + "1H-indole-3-yl-beta-D-glucopyranoside", + "[polyamine-binding protein][side 1]", + "O-ethyl-S-(2-diisopropylaminoethyl)methylphosphonothiolate", + "ADPribose-elongation factor 2", + "methylsulfonyl-D-cyclohexylglycyl-Arg-7-amido-4-methylcoumarin", + "prion protein 117-233", + "cholesterol/in", + "L-olivosyl-erythronolide B", + "Lys-tRNALys", + "L-erythro-3-methylaspartate", + "immunoglobulin IgA1", + "(5-deoxy-5-adenosyl)(3-aminopropyl)methylsulfonium salt", + "[E1 ubiquitin-activating enzyme]-S-ubiquitinyl-L-cysteine", + "TSHR tyrosine", + "NIpI protein", + "quinonoid dihydrobiopterin", + "VP3", + "(6E)-8-hydroxynerol", + "1D-myo-inositol 1-phosphate", + "cytochrome P450", + "D-alanine", + "oleoyl-sn-glycerol", + "Rad9 phosphoprotein", + "CovR L-histidine", + "alpha-D-Man-(1-6)-[alpha-D-Man-(1-3)]-beta-D-Man-(1-4)-beta-D-GlcNAc", + "OmpX", + "acetyl-beta1,4-D-mannuronic acid", + "2-oleoyl-3-palmitoylglycerol", + "[histone H2B]-N6-acetyl-L-lysine", + "8-[(1R,2R)-3-oxo-2-((Z)-pent-2-enyl)cyclopentyl]octanoate", + "palmitic acid hexadecyl thio ester", + "amikacin", + "selenite", + "a poly-cis-polyprenyl diphosphate longer by one C5 unit", + "L-(+)-tartrate", + "[carrier protein LysW]-C-terminal-gamma-(L-lysyl)-L-glutamate", + "5alpha-cyprinol sulfate", + "polypeptide-hydroxyamino acid", + "phosphorylated Elk-1", + "guanine37 in tRNAAsp(GUC)", + "laminarin", + "torvoside H", + "hepatitis C virus polyprotein", + "activated interleukin-36 receptor antagonist V2", + "2-iminoacetate", + "(-)-gallocatechin gallate", + "matrix metalloprotease-3", + "actinin-4", + "GDP-4-amino-4,6-dideoxy-alpha-D-mannose", + "N2-dimethylguanine26 in tRNALeu(UAG)", + "SYP-4 protein", + "(3RS)-3-(1-hydroxyethyl) bacteriochlorophyllide d", + "an N-terminal L-alanyl-[L-A virus major coat protein]", + "oligoglycosylglucosyl-(1<->1)-ceramide", + "peptidyl-glycine alpha-amidating monooxygenase", + "ferricytochrome c552", + "glucosyl alpha-(1->3)-D-mannose", + "(3-Methyl)-quinoline", + "guanine9 in tRNALeuGAG", + "3alpha-hydroxy bile acid CoA ester", + "protoporphyrinogen IX", + "fibrillar collagen type III", + "phosphorylated Mus81-Mms4 resolvase", + "17-hydroxylupanine", + "R-CH2-SO3H", + "(N-acetyl-beta-D-glucosaminyl-1,2-alpha-D-mannosyl-1 3)-(N-acetyl-beta-D-glucosaminyl-1,2-alpha-D-mannosyl-1 6)-beta-D-mannosyl-1,4-N-acetyl-beta-D-glucosaminyl-R", + "cytokeratine 18", + "phosphorylated light chain myosin II", + "5-hydroxy-L-lysine-[collagen]", + "actomyosin", + "SPR2D glutamine", + "11-oxo-beta-amyrin", + "protein L-histidine", + "eukaryotic translation initiation factor 4gamma", + "N-acetyl-D-glucosaminyl-Asn", + "Orc1p", + "C5aR tyrosine", + "GSK-3beta phosphoprotein", + "a methyl-branched lipid", + "3-methyl-1-[2,4 6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]propan-1-one", + "phloroisovalerophenone", + "collagen XVIII", + "D-2-hydroxy fatty acid", + "alpha-synuclein glutamine", + "D-sphingosine", + "L-threonyl-tRNAThr1", + "neuronal cell adhesion molecule L1", + "indol-3-acetonitrile", + "(2R)-2-amino-4-oxopentanoate", + "1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate", + "(2R)-2-[(R)-[[(2Z)-2-(2-amino-1 3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino](carboxy)methyl]-5-[[(2 methyl-5,6-dioxo-1,2,5,6-tetrahydro-1,2 4-triazin-3-yl)sulfanyl]methyl]-3,6-dihydro-2H-1 3-thiazine-4-carboxylic acid", + "deadenylated rRNA", + "estriol", + "phosphoinositides", + "poliovirus receptor type I", + "[L-asparagine-binding protein][side 1]", + "O-(5-O-[(E)-feruloyl]-alpha-L-arabinofuranosyl)-(1-3)-O-beta-D xylopyranosyl-(1-4)-D-xylopyranose", + "beta-dihydromenaquinone-9", + "crotonaldehyde", + "5 H2O", + "adenine34 in tRNAThr(AGU)", + "methanesulfenic acid", + "beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosaminyl-R", + "[P35]-serine/threonine", + "N,N',N'',N'''-tetraacetylchitotetraose", + "mevalonolactone", + "hydroquinone-O-beta-D-glucopyranoside", + "(13S,14R)-1,13-dihydroxy-N-methylcanadine", + "5'-deoxy-5'-methyl-thio-D-ribose-1-phosphate", + "C/EBPbeta", + "4-nitrophenyl-5'-TMP", + "2,3,4,5,6-pentahydroxycyclohexanone", + "10-N-(n-octylamino)-2-(trifluoromethyl) phenothiazine N-oxide", + "[Alba protein]-L-lysine16", + "[UbaA]-L-cysteine", + "eicosa-11,14,17-trienoyl-[glycerolipid]", + "5 ferrocytochrome c", + "CO2", + "[p21Cip1]-L-tyrosine phosphate", + "N7-methylguanine46 in tRNA", + "cytosine48 in tRNAGlu(CUC)", + "phosphorylated NR2 receptor", + "6-chloro-L-tryptophan", + "(E)-1-(L-cysteinylglycin-S-yl)-N-hydroxy-2-(1H-indol-3-yl)ethan-1-imine", + "[CDC6]-L-lysine", + "8,9-dihydroxyeicosatrienoic acid", + "17beta-hydroxy-5alpha-androstan-3-one", + "5-methylcytosine38 in G34tRNAAsp", + "D-glycero-D-manno-heptose 7-phosphate", + "cephalosporin C", + "dihydrosphingosine", + "5'-deoxy-5'-adenosyl-cobyrinic acid", + "protein tyrosine O-sulfate", + "3-amino-5-[(4-hydroxyphenyl)methyl]-4,4-dimethyl-2-pyrrolidinone", + "N-acetyl-alpha-D-galactosaminyl-polypeptide MUC13", + "L-cysteate", + "4-amino-1-benzoic acid", + "6-aminopenicillanate", + "cyclodextrins", + "bovine viral diarrhea virus polyprotein", + "fragments of a-factor", + "tRNAiMet", + "(9Z)-(13S)-12,13-epoxyoctadeca-9,11,15-trienoate", + "5-methylcytosine48 in tRNAPro(AGG)", + "relaxin-3", + "(3E,6E)-alpha-farnesene", + "GAB2-C238-676", + "(2R,3R)-dihydrokaempferol", + "3,5-dihydroxy-2-(2-methylpropanoyl)phenyl beta-D-glucopyranoside", + "D-fructose 1,6-bisphosphate", + "arginine/in", + "adenine2085 in 23S rRNA", + "erythromycin A", + "L-leucyl-[protein]", + "phosphonoformate", + "retinyl palmitate", + "aminoacyl-L-lysine", + "esculetin", + "[protein]-N-oligosaccharidyl-L-asparagine", + "(9Z,11R,12Z)-11-hydroperoxyoctadeca-9,12-dienoate", + "N-terminal-[RCC1]", + "S-(2,4-dinitrophenyl)glutathione/vacuole", + "coenzyme-A", + "UDP-beta-L-rhamnose", + "1-alkyl-2-acetyl-sn-glycero-3-phosphate", + "cholest-5,7-dien-3beta-ol", + "Man8GlcNAc2-Asn (isomer 8A1,2,3B1,3)", + "2-amino-5-formylamino-6-(D-ribosylamino)pyrimidin-4(3H)-one 5'-phosphate", + "mature influenza hemagglutinin H1", + "[DsbC protein] with reduced L-cysteine residues", + "DL-nicotine", + "L-aminoacyl-L-amino acid", + "2-hydroxy-2,4-heptadiene-1,7-dioate", + "4-sulfobenzoate", + "isopentenyldehydrorhodopin", + "ribonucleoside triphosphate", + "oat spelt xylan", + "acylphosphate", + "luteolin-7-beta-glucopyranoside", + "glucosyl-nomilin", + "human LL-37", + "D-fructose-1,6-bisphosphate", + "1,6-anhydro-beta-D-glucopyranose", + "tissue factor pathway inhibitor", + "cassava starch", + "cyanidin 3-O-beta-D-glucoside 5-O-(6-O-malonyl)-beta-D-glucoside", + "protein 6-N-methyl-L-lysine", + "8'-hydroxyabscisic acid", + "proacrosin", + "Fuc-alpha-(1-2)-Glc", + "O2.-", + "cumene hydroxide", + "demethylphylloquinone", + "S-methyl-5-thio-D-ribulose 1-phosphate", + "(2Z,4Z)-3-methylhexa-2,4-dienedioate", + "a ribonucleoside", + "[phosphatase 2A protein]-leucine309 methyl ester", + "[amyloid-beta]-N5-alkyl-L-glutamine", + "sinapyl aldehyde", + "Ser-Gly-Gly-Lys", + "2 ferrocytochrome c552", + "episterol", + "phospho-tyrosinyl-p120 protein", + "flavodoxin hydroquinol", + "Keratin", + "N-acetyl-L-azetidine-2-carboxylic acid", + "2-oxosuccinate", + "lipid A (2-aminoethyl diphosphate)", + "inositol 4-phosphate", + "a flavonol 7-O-beta-D-glucoside", + "N5-phenyl-L-glutamine", + "3-methylhexa-2,4-dienedioate", + "lysophosphatidyl choline", + "pimeloyl-[acyl-carrier protein]", + "10 H+", + "N-acetyl-L-cysteine", + "2-(dimethylsulfonio)propanoate", + "L-serine-phosphoethanolamine", + "bacterioruberin", + "protein Aga2", + "aminophospholipid[side 1]", + "phloretic acid", + "Abnormal puromucyl peptides", + "(2S)-2-hydroxy-2-methylbutanenitrile", + "[pyruvate dehydrogenase (lipoamide)] phosphate", + "4-oxononanal", + "a fatty acid", + "1D-myo-inositol 3-phosphate", + "2-(4-cyanophenyl)-1,3-benzothiazol-6-ol", + "egg envelope", + "dalcochinin", + "9-cis-retinoate", + "phlorisovalerophenone", + "N-3-oxo-hexanoyl-L-homoserine", + "3-phospho-L-serine", + "(1R)-camphor", + "2-oxo-4-methylpentanoate", + "L-rhamnopyranose", + "narbonolide", + "D-fructose", + "D-Glu", + "phosphorylated Ebola virus VP30 protein", + "(S)-Norcoclaurine", + "2 ferrocytochrome P450", + "dodecanoate", + "3-phenylpyruvic acid", + "soluble N-terminal fragment APPbeta", + "alpha-Kdo-(2->6)-lipid A", + "podophyllotoxin-4-O-beta-D-glucopyranoside", + "panose", + "beta-1,4-xylobiose", + "ssDNA-dsDNA", + "Acetyl-CoA", + "p-tRNAHis", + "N-methyl-L-proline", + "benzylsuccinate", + "petiveriin", + "Pol polyprotein", + "protein D-isoaspartate", + "allantoin", + "proton-coupled folate transporter", + "L-nicotine", + "beta-D-gentiobiosyl beta-D-glucosyl crocetin", + "GDP-4-dehydro-6-deoxy-D-talose", + "cytosine38 in tRNA", + "cyclo-hexapeptide", + "beta-D-glucuronate", + "L-1-amino-2-propanol", + "reduced cytochrome b5", + "Mg2+", + "2,3-epoxy-2,3-dihydrobenzoyl-CoA", + "stemod-13(17)-ene", + "7-hydroxychlorophyllide a", + "5-methyldeoxycytidine", + "aromatic amines", + "3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholestanoyl-CoA", + "1-acyl-2-eicosapentaenoyl-lysophosphatidic acid", + "3-devinyl-3-(1-hydroxyethyl)-chlorophyllide a", + "2-(2,3-dihydropentaprenyloxy)phenazine", + "human NF-kappaB P65", + "3,5,5-trimethyl-4-(propan-2-yl)cyclohex-2-en-1-one", + "cadherin-6", + "glucosone", + "diethyl 2-methyl-3-hydroxysuccinate", + "L-talarate", + "D-carbamoyl-4-hydroxyphenylglycine", + "(6E)-8-oxogeranial", + "L-dihomomethionine", + "(+)-trans-carveol", + "(2S,5R)-5-hydroxy-L-lysine-[procollagen]", + "a phthiodiolone", + "melilotate", + "ficaprenolphosphate-glucose", + "phosphorylated spliceosome-associated protein 155", + "[protein]", + "(R,R)-Tartrate", + "cyanidin-3-O-D-rhamnosyl-1,6-D-glucoside", + "L-Ala-L-Glu", + "beta-cyclopiazonate", + "SSRIG", + "5-methylcytosine48 in tRNAHis(GUG)", + "di-trans,poly-cis-heptadecaprenyl diphosphate", + "hydroxyglutarate", + "(sulfide)n", + "(1R,2S,5R,6S)-dihydroanticapsin", + "(4S)-limonene", + "L-threonine O-3-phosphate", + "RNA-DNA*DNA hybrid", + "PSD-95", + "5-deoxy-D-ribose", + "2,4-dimethoxybenzaldehyde", + "relaxin", + "a very-long-chain fatty acyl-CoA", + "9alpha-hydroxy-3-oxo-23,24-bisnorchol-4-en-22-oate", + "an ultra-long-chain fatty acyl-CoA", + "phosphorylated STAT3", + "crotonobetainyl-CoA", + "6-(L-erythro-1,2-dihydroxypropyl 3-triphosphate)-7,8-dihydropterin", + "[protein]-N6-(3-O-phospho-D-fructosyl)-L-lysine", + "cytosine48 in tRNAAla(AGC)", + "(5Z,13E)-(15S)-9alpha,11alpha,15-trihydroxyprosta-5,13-dienoate", + "porphyran containing 3,6-anhydrogalactose residues", + "ganglioside GM3", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-seryl-[protein]", + "2 dimethylallyl diphosphate", + "phosphorylated MEK", + "(R)-tetralol", + "[SAMP]-Gly-Gly", + "Pro-Pro-4-nitroanilide", + "homocarnosine", + "oxidatively decarboxylated precursor peptide MftA", + "golgin-160", + "beta-catenin", + "thrombin", + "2 Na+/in", + "6-sulfo-D-quinovose", + "5-bromo-uridine", + "phosphorhodopsin TM5", + "4-hydroxybutyrate", + "12alpha-hydroxy-3-oxocholan-24-oyl-CoA", + "phylloquinone", + "stromelysin", + "(9R,10R,13R)-trihydroxy-11E-octadecenoic acid", + "23S rRNA pseudouridine2605", + "Na/+out", + "12 H+", + "alpha-L-fucopyranose", + "uvaol", + "7-methoxycoumarin", + "glucose 6-phosphate", + "[alpha-D-glucosyl-(1->3)]n", + "beta-L-galactose 1-phosphate", + "xylotriose", + "nerol", + "[RBR-type E3 ubiquitin transferase]-S-ubiquitinyl-L-cysteine", + "[fructose-bisphosphate aldolase]-N6,N6,N6-trimethyl-L-lysine", + "D-pantothenoylcysteine", + "N2-acety-L-ornithine", + "4 porphobilinogen", + "active form of heparanase", + "adenylated glutamine synthetase", + "Man4GlcNAc2", + "Gal-beta-(1->3)-[Fuc-alpha-(1->6)]GlcNAc-beta-(1->3)-Gal-beta-(1 >4)GlcNAc", + "procollagen", + "1,5-diaminopentane", + "O-phospho-[phospho-alpha-glucan]", + "wheat L-arabino-D-xylan", + "[4,5-dihydroxy-10-oxo-3-(3-oxobutanoyl)-9 10-dihydroanthracen-2-yl]acetate", + "3 2-oxoglutarate", + "HGF/SF", + "Tryptamine", + "3-vinyl-chlorophyllide a", + "6-amino-6-deoxyfutalosine", + "2-formylnaphthalene", + "5-methylcytosine49 in tRNALeuCAA", + "3 malonyl-CoA", + "D-alpha-aminoadipate", + "(4R,8E)-4-hydroxysphing-8-enine ceramide", + "(+)-(4R)-limonene", + "allylglycyl-tRNALeu", + "caffeine", + "2-oxostearate", + "4-O-beta-D-glucopyranosyl-D-gluconate", + "2 holo-[mycocerosic acid synthase]", + "[ATP synthase]-tyrosine phosphate", + "16-hydroxypalmitoleic acid", + "long-chain fatty acyl CoA/trans", + "tRNA-like pseudoknotted structures in viral RNA", + "ferricytochrome c3", + "ATP", + "5-carboxylcytosine-mismatched double-stranded DNA", + "protoporphyrinogen-S-glutathione", + "taurochenodeoxycholate 3-sulfate", + "N-acetyl-D-glucosamine 6-sulfate units", + "norbelladine", + "ubiquinone-2", + "Galbeta1-4[Fucalpha1-3]GlcNAc-R", + "myo-inositol-1,2,4,5,6-pentakisphosphate", + "petunidin", + "a phosphatidylglycerol", + "5alpha,6beta,17alpha,27beta-tetrahydroxywithanolide 27-beta-D-glucoside", + "4-nitrophenyl alpha-D-maltohexaoside", + "pyrimidine nucleoside", + "(3R)-3-hydroxydecanoyl-CoA", + "9-cis-3-hydroxy-beta-apo-10'-carotenal", + "2-Hydroxy-3-carboxyadipate", + "products of ATP breakdown", + "an acetoacetyl-[acyl-carrier protein]", + "[histone H3]-N6-methyllysine27", + "(deoxyribonucleotide)n-3'-hydroxyl", + "[tRNAIle2]-lysidine34", + "a 5'-diphospho-[mRNA]", + "L-phenylalanine", + "3 AH2", + "complement component 4b", + "N-methylnicotinate", + "a flavonol 3-O-[6-(4-coumaroyl)-beta-D-glucosyl-(1->2)-beta-D-glucosyl-(1->2)-beta D-glucoside]", + "Methylitaconate", + "guanosine 5'-triphosphate 3'-diphosphate", + "D-Tyr", + "galectin-8", + "(R)-2-(2-thienyl)propionate", + "glycolipid", + "GDP-beta-fucose", + "phospholipase D", + "[IFN regulatory factor 3 phosphoprotein]", + "dAMP", + "[alpha-tubulin]-N6-acetyl-L-lysine40", + "CYR61", + "GPNSKGRSLIGRLDTPPPITGKGAPVEPGFSVDEFSAS", + "N-acetylgalactosaminide mucin", + "TrfA", + "4E-BP1 protein", + "pro-neuropeptide Y", + "Prostaglandin E2", + "(+)-neoisomenthol", + "N6-dimethyladenosine1779/N6-dimethyladenine1780 in 18S rRNA", + "beta-1,2-glucan", + "cellular eukaryotic translation initiation factor 4G", + "dyfonate", + "3-chlorobenzyl alcohol", + "phosphorylated ezrin", + "DNA-1,N6-ethenoadenine", + "(4-hydroxy-3-[3-methyl-3-butene-1-ynyl]benzaldehyde)", + "abieta-8,11,13-trien-12-ol", + "4-(1,2-dihydroxy)ethyl-1,2-dihydroxycyclohexane", + "2-(4-iodophenyl)-1,3-benzothiazol-6-yl sulfate", + "activated complement component C1s", + "compound Mx", + "Man6-glycopeptide", + "2-(formamido)-N1-(5-phospho-D-ribosyl)acetamidine", + "(-)-3,5-cyclohexadiene-1,2-diol-1-carboxylic acid", + "dihydroxyacetone phosphate", + "ethylenediamine-N,N'-diacetate", + "tyramine N-oxide", + "soluble acetylcholinesterase", + "2 reduced cytochrome cGJ", + "an N-terminal L-methionyl-L-aspartyl-[protein]", + "aminopentol", + "estradiol-17beta", + "O-phosphoethanolamine", + "(5-formylfuran-3-yl)methyl phosphate", + "7-oxo-lithocholic acid", + "21-hydroxy-pregn-4-en-3,11,20-trione", + "4-amino-4-deoxy-alpha-L-arabinopyranosyl undecaprenyl phosphate", + "phosphorylated DNA polymerase II", + "butyryl-CoA", + "dehydroandrosterone", + "(2-hydroxymethylphenyl)-beta-D-glucopyranoside", + "2-trans-decenoate", + "N4-methylcytidine1402 in 16S rRNA", + "a [Co(I) monomethylamine-specific corrinoid protein]", + "peptidoglycan", + "[methionine-binding protein][side 1]", + "glucocerebroside", + "cytosine59 in vtRNA1.2", + "L-(-)-methionine S-oxide", + "hapalindole H", + "apigenin-7-beta-glucopyranoside", + "laminin-5/Laminin-322", + "2 CoA", + "N-formyl-L-methionine polypeptide", + "4-nitrophenyl phosphate", + "CDP-1-stearoyl-2-linoleoyl-glycerol", + "olmesartan/in", + "alpha-santonin", + "tamarind seed xyloglucan", + "caldariellaquinol", + "(sulfur carrier)", + "pentanoyl-CoA", + "3alpha,4beta-dihydroxy-5alpha-androstan-17-one", + "a very-long-chain sphinganine", + "phosphorylated neuregulin receptor ErbB2", + "D-galactose-[galactose-binding protein MglB][side 1]", + "kanamycin X", + "S-(2-hydroxyacyl)glutathione", + "3-methylbut-2-en-1-amine", + "alpha-L-arabinofuranosyl-1,4-alpha-D-xylopyranoside", + "(2E,6E)-farnesol", + "[IkappaBalpha phosphoprotein]", + "Mur2Ac(oyl-L-Ala-D-gamma-Glu-L-Lys-D-Ala-D-Ala)-diphosphoundecaprenol", + "filamin-1", + "Fragments of fibrinogen", + "polyneuridine aldehyde", + "(4E)-sphing-4-enine ceramide", + "2-trans,6-trans-farnesyl diphosphate", + "calmodulin L-methionine", + "N-acetylneuraminic acid-alpha-2,3-lactose", + "8-dimethylallylnaringenin", + "huntingtin", + "5-methylcytosine49 in tRNAPro(UGG)", + "cytosine50 in tRNAGlyGCC", + "Ac-RKLL-7-amido-4-methylcoumarin", + "alpha-defensin-1", + "o-phthalic acid", + "bracteatin", + "cytidine56 in initiator tRNAMet", + "pro-matrix metalloprotease 9", + "1,2-hexanediol", + "L-Cit-Ala-hArg", + "3',5'-dimethoxydelphinidin 3-O-glucoside", + "beta-D-glucosyl-cellulose", + "3-oxo-5beta-cholanate", + "cytosine49 in tRNAGln(CUG)", + "CIRCADIAN CLOCK ASSOCIATED1", + "beta-L-arabinofuranosyl-(1->2)-beta-L-arabinofuranose", + "2-deoxy-D-gluconate", + "guanine9 in tRNAGlyCCC", + "3'-AMP", + "apo-[acetyl-CoA carboxylase]", + "5-methylcytosine48 in tRNAMet(CAU)", + "morphinane", + "6G-kestotetraose", + "DNAn", + "a (Z)-hexadec-9-enoyl-[acyl-carrier protein]", + "N-butanoyl homoserine lactone", + "[endothelial nitric oxide synthase]-S-palmitoyl-L-cysteine", + "2-(4-methoxyphenyl)-1,3-benzothiazol-6-ol", + "[RNA ligase]-N6-(5'-adenylyl)-L-lysine", + "dalnigrein", + "1-acyl-2-arachidonoyl-sn-glycerol", + "2 1D-myo-inositol-1,3,4,6-tetrakisphosphate", + "protein L-methionine (R)-sulfoxide", + "L-homocysteine", + "cytosine32 in tRNA1Ser", + "2-keto-3-deoxy-D-glucose", + "glutathione/cytoplasm", + "penicillin-binding protein", + "glucarolactone", + "Arg-Pro", + "4,5-dihydroxypentane-2,3-dione", + "L-Phe", + "activated factor X", + "2-O-methyl-3-methylflaviolin", + "Ndelta,Nomega-dihydroxy-Nomega-methyl-L-arginine", + "pseudomonic acid A", + "2 reduced ferredoxin iron-sulfur cluster", + "membrane-bound inactive transcription factor fragment bZIP28X1", + "delphinidin 3-O-(6''-O-malonyl)-beta-glucoside-3'-O-beta-D-glucoside", + "6,6-kestotetraose", + "ethylenediaminetetraacetate", + "hexadecanoate", + "[protein kinase C zeta]-L-tyrosine", + "5-hydroxy-feruloyl-CoA", + "N-acetyl-D-galactosamine 1-phosphate", + "RANTES protein", + "SREBP-1", + "factor B", + "N-(2,3-dihydroxybenzoyl)-L-serine trimer", + "(9Z,11E,13S,15Z)-13-hydroperoxy-9,11,15-octadecatrienoate", + "2 benzaldehyde", + "N-carbamoyl-putrescine", + "3-O-(alpha-D-mannosyl)-L-threonyl-[protein]", + "beta-(1-3)-D-galactan", + "maleylacetate", + "indoleacetate", + "2-dehydro-3-deoxy-D-galactonate", + "1-(3-Indolyl)glycerol-3-phosphate", + "N-acetyl-D-phenylalanine", + "FASGKR", + "pilin PilB", + "(R)-citramalyl-CoA", + "D-arabinonate", + "[alphabeta-tubulin]-(gamma-(poly-alpha-L-glutamyl)-L-glutamyl)-L glutamate", + "N1-methylguanine9 in tRNALysCUU", + "1,6-beta-D-galactosylgalactogen", + "5'-oxoaverantin", + "N-(3-aminopropyl)-N'-(3-Benzylaminopropyl)butane-1,4-diamine", + "Gag-pro-pol polyprotein", + "[PknH]-serine/threonine", + "3alpha-hydroxytibolone 3-O-sulfate", + "an omega-(methylthio)-2-oxoalkanoate", + "oxalyl-CoA", + "flavonol", + "adenosine 5'-pentaphosphate", + "vesicular integral-membrane protein VIP36", + "2-(glutathion-S-yl)-2-methylbut-3-en-1-ol", + "[CBP/p300]-Nomega,Nomega-dimethyl-L-arginine", + "2-hydroxy-3,4-dioxoundecyl phosphate", + "myo-inositol 1,4-bisphosphate", + "5'-oligonucleotide", + "23S rRNA uridine955/uridine2504/uridine2580", + "N5-phospho-L-glutamine", + "sucrose 6F-phosphate", + "UDP-3-O-[(3R)-3-hydroxymyristoyl]-alpha-D-glucosamine", + "adenylosuccinate", + "(2R)-hydroxy-(2-methylphenyl)acetonitrile", + "bis(1L-myo-inositol) 3,1'-phosphate 1-phosphate", + "[TtuB sulfur-carrier protein]-Gly-NH-CH2-C(O)SH", + "abscisic aldehyde", + "[CmaD -protein]-4'-phosphopantetheine", + "deoxynucleoside", + "CUX1", + "5-methylcytosine49 in tRNAPhe(GAA)", + "phosphorylated Dot6", + "1-O-alkyl-2-lyso-sn-glycero-3-phosphate", + "apo-[alpha-aminoadipate semialdehyde dehydrogenase]", + "2 ubiquinone-1", + "methyl 1H-indole-3-carboxylate", + "(2Z,4E)-4-hydroxy-6-oxohexa-2,4-dienoate", + "a very-long-chain (3R)-3-hydroxyacyl-CoA", + "UDP-glucuronic acid", + "a glycoprotein with the sulfoheptasaccharide chain attached by N-beta-D-glycosyl linkage to a protein L-asparagine", + "phosphorylated Akt", + "S,S'-bis((R)-lactoyl)trypanothione", + "[PBPA]-serine/threonine", + "(beta-1,4-galactan)n+1", + "octan-2-one", + "DNA containing double Holliday junctions", + "(R)-beta-tyrosine", + "glutathione disulfide[side 1]", + "aphidicolan-16beta-ol", + "phosphoric acid swollen cellulose", + "N1-methylguanine9 in tRNA", + "(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl-CoA", + "all-trans-heptaprenyl diphosphate", + "[ATP synthase]-tyrosine", + "cytosine", + "O-octadecyldihydroxyacetone phosphate", + "deoxycholic acid", + "phosphorylated ERK1/2", + "2-amino-6-chloro-benzonitrile", + "phosphorylated ataxin-3 protein", + "narcotine hemiacetal", + "Ac-SFITRRLQ-7-amido-4-methylcoumarin", + "beta-D-glucuronic acid", + "3-oxocholest-4-en-26-oate", + "Cabin1", + "acetylated peptidoglycan", + "cytosine6666 in apolipoprotein B mRNA", + "alpha-D-mannose 6-phosphate", + "3alpha-hydroxytibolone", + "arabinan", + "a 5,6,7,8-tetrahydropteridine", + "succinyl-CoA", + "reduced [4Fe-4S] cluster", + "eicosapentanoate", + "retinol-[cellular retinol-binding protein III]", + "indol-3-ylmethyl isothiocyanate", + "recombinant procaspase-3", + "choline esters", + "an alcohol", + "2-phospho-D-glycerate", + "epidermal growth factor-like protein", + "gelatine", + "3-hydroxyanthranilate", + "(-)-(4S)-limonene", + "[FeO(OH)]", + "ribosomal protein L12-L-methionine", + "Pyrogallol", + "[a protein]-tyrosine", + "[c-myc]-L-lysine", + "[RelA/p65 protein]", + "adenosine in rRNA", + "Precorrin-6Y", + "2-oxo-D-gluconate", + "[histone H4]-N6-acetyl-L-lysine5", + "all-trans-lycopene", + "2 S-adenosyl-L-methionine", + "N2-dimethylguanine26 in tRNALeuCAA", + "malonyl-acyl-carrier protein", + "glutathione S-conjugated leukotriene C4/vacuole", + "Insulin-(SH)2", + "octanoyl-L-carnitine", + "(R)-citrate", + "dolichol", + "phosphorylated extracellular regulated kinase 2", + "(S)-p-hydroxymandelonitrile", + "beta-D-glucuronosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D glucuronosyl-proteoglycan", + "gastrin releasing peptide-(3-27)", + "(ADP-D-ribosyl)n+1-beta-transducin repeat-containing protein", + "cerebroside B", + "sulfamethoxazole hydroxylamine", + "[SER-2 tyramine receptor]-L-arginine", + "16alpha-hydroxy-beta-amyrin", + "4-[bis(2-bromoethyl)amino]-3,5-difluorobenzoic acid", + "phosphorylated tristetraprolin", + "4betaa-hydroxycholesterol 3-sulfate", + "4-hydroxy-2-oxohexanoic acid", + "an oleoyl-[glycerolipid]", + "isoprogesterone", + "YPXENFPPSTARPT", + "3-hydroxybenzamide", + "ZN-alpha2-glycoprotein", + "Der p 9 propeptide", + "phosphatidylserine[side 2]", + "fibroblast growth factor receptor-4", + "cephaloridine", + "5-methylcytosine2870 in 25S rRNA", + "alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man (1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)] alpha-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc-N-Asn-[protein]", + "5-oxoproline", + "C16:0-ceramide", + "double-stranded alkylated DNA", + "L-Phe benzyl ester", + "2 D-mannopyranose", + "L-alanyl-gamma-D-glutamyl-meso-2,6-diaminoheptanedioate", + "phytol", + "1D-1-guanidino-1-deoxy-3-dehydro-scyllo-inositol", + "N-acetyl-EEEIAAL", + "N-acetyl-alpha-D-galactosaminyl-Ser/Thr", + "L-arabinose-[arabinose-binding protein MSMEG_1712][side 1]", + "Pb2+/in", + "phosphorylated myosin", + "3,3-dimethylallyl diphosphate", + "[IIA-FPr diphosphoryl transfer protein]-Npi-phospho-L-histidine", + "3beta-hydroxy-beta-cyclocitral", + "(2S)-2-aminooctadecan-3-one", + "2'-O-myristoyl-ADP-ribose", + "a very-long-chain acyl-CoA", + "N1-methylguanine9 in tRNAValUAC", + "mature brain-derived neurotrophic factor", + "glycerol", + "Prephenate", + "pre-snoRNA", + "isovaleraldehyde", + "27-hydroxycholesterol", + "L-threo-3-methylaspartate", + "4-hydroxy-2-oxoheptane-1,7-dioate", + "LAMP1", + "2 farnesyl diphosphate", + "cornifin-A glutamine", + "a quinone", + "[histone H3 peptide]-N6-methyl-L-lysine9", + "D-2-hydroxyglutaric acid", + "hydroxymalonate", + "5 D-glucose", + "FYTPKA", + "1-monooleoylglycerol", + "3-sulfopropanoate", + "5-pyridoxic acid", + "Cad6B", + "2-amino-3-oxobutanoate", + "an N-terminal-L-methionyl-L-methionyl-[protein]", + "L-allose", + "petunidin-3-O-beta-D-glucoside", + "9-cis,12-cis-linoleic acid", + "aliphatic sulfonate[side 2]", + "ribonucleoside 5'-diphosphate", + "5-epi-valiolone", + "[allophycocyanin alpha-subunit]-Cys81-phycocyanobilin", + "(5Z,8Z,11Z)-14,15-epoxyeicosatrienoic acid", + "cytidine34 in tRNALeuUAA", + "8-oxo-GDP", + "beta-D-lacto-hexodialdose", + "(1,3-beta-D-glucosyl)n+1", + "dehydroascorbate", + "D-ribose-[ribose-binding protein][side 1]", + "rice bran", + "phosphorylated cyclin-dependent kinase", + "BAD", + "ELFADKVPKTAENFR", + "precorrin-1", + "DNA containing apurinic/apyrimidinic site", + "occludin", + "erythronolide B", + "prosolanapyrone II", + "[Whi3 cell cycle regulator protein]", + "Msmeg1712/in", + "Neurokinin A", + "[protein]-N6-(O3-phosphono-D-fructosyl)-L-lysine", + "(protein)-L-cysteine", + "(2R)-2-hydroxypropyl-CoM", + "fructose-bisphosphate aldolase A", + "Ala", + "tmRNA precursor", + "peptide 3-hydroxy-L-aspartate", + "friedelin", + "activated factor V", + "[Ras]-S-palmitoyl-L-cysteine", + "12-oxolithocholic acid", + "D-Glucose", + "flagellum protein FlaB2 with the oligosaccharide chain attached by N-beta-D-glycosyl linkage to a protein L-asparagine", + "beta-estradiol/out", + "4-mercaptobutyric acid", + "5-methylcytosine50 in tRNAGly(CCC)", + "2 citrulline", + "2-oxophytanate", + "thyroglobulin peptide A", + "N-carbamoyl-DL-methionine", + "Src protein", + "lipid transfer protein 1", + "involucrin N5-pentylglutamine", + "C4a", + "holo-[alpha-aminoadipate semialdehyde reductase Lys2]", + "S-(calcein-AM)glutathione[side 1]", + "acetylated rhamnogalacturonan I", + "cytochrome c oxidase 4 precursor protein", + "thyroxine beta-D-glucuronoside", + "[DsbC] with reduced L-cysteine residues", + "[histone H3R2]-Nomega,Nomega'-dimethyl-L-arginine", + "3-epi-1alpha,25-dihydroxyvitamin D3", + "dTDP-6-deoxy-L-mannose", + "hydroxy fatty acids in triacylglycerol", + "6-fluorocyclohexa-1,5-diene-1-carbonyl-CoA", + "1-hydroxy-1,2,4-butanetricarboxylate", + "polynucleotide", + "(1,4-alpha-D-galacturonosyl)n+1", + "9-beta-D-glucosyl-cis-zeatin", + "pyroglutamyl-peptide", + "N-acetyl-D-galactosaminyl-kappa-casein", + "doxycycline", + "16 H2O", + "dimethylsulfoxide", + "soluble tumor necrosis factor receptor 1", + "14 isopentenyl diphosphate", + "L-serine", + "cytosine34 in tRNALeu precursor", + "D-firefly luciferin", + "RNA-DNA/DNA hybrid", + "N-nervonoyl-D-sphinganine", + "1-hexanol", + "2-methyl-1-hexadecanal", + "1-oleoyl-2-acyl-lysophosphatidic acid", + "2,4-dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one", + "2'-O-methylguanine26 in elongator tRNAMet", + "(E)-2'-hydroxybenzylidenepyruvate", + "zeatin", + "nitrate-[nitrate-binding protein][side 1]", + "human circulating complement proteins", + "acetaminophen", + "METP-(639aa)-RSY", + "p55 TNF-alpha RI", + "N3-methylcytosine32 in tRNASer", + "phospho-cytarabine", + "oxalureate", + "[(1,4)-alpha-D-glucosyl]n+1", + "Akt1 phosphate", + "IL18", + "azidonorleucyl-tRNAMet", + "L-arabinose", + "N-acetyl-cortactin", + "cobalt-sirohydrochlorin", + "laminarihexaose", + "(24S)-24-methylcycloart-25-en-3beta-ol", + "staphyloferrin B", + "acetylated promyelotic leukemia zinc finger gene", + "N-terminal L-leucyl-L-lysyl-[protein]", + "NeuAcalpha(2-3)Galbeta(1-4)Glc", + "[histone H3]-N6,N6-dimethyl-L-lysine9", + "an N-terminal-Nalpha-acetyl-L-seryl-[histone H2A]", + "glycine", + "[alpha-synuclein]", + "Atg3 protein", + "DNA with 5'-phosphate terminus", + "2,5-diaminohexanoate", + "xylan", + "[histone H3]-N6,N6-dimethyl-L-lysine 4", + "xylooligosaccharide", + "apo-[phycoerythrocyanin alpha-subunit]", + "Z-Leu-Leu-Glu", + "N-acetylglucosamine-beta-1,6-mannose-alpha-1,3-branch of epidermal growth factor receptor", + "pelargonidin 3-O-(6-caffeoyl-beta-D-glucoside) 5-O-beta-D-glucoside", + "D-glyceraldehyde-3-phosphate", + "alpha-L-colitosyl-(1->2)-beta-D-galactosyl-(1->3)-N-acetyl-D glucosamine", + "an N-terminal-L-methionyl-L-phenylalanyl-L-tyrosyl-[Scc1 protein]", + "[beta-N-acetyl-D-glucosaminyl(1-4)beta-D-glucuronosyl(1-3)]n", + "fragment of kininogen", + "5-methylcytosine34 in tRNALeu precursor", + "Peptides", + "4-dimethylallyl-L-tryptophan", + "GDP-alpha-D-perosamine", + "MCCB protein", + "1-(3-bromophenyl)ethanone", + "C-terminal telopeptide of type I collagen", + "[SoxYZ protein]-S-sulfosulfanyl-L-cysteine", + "ent-sandaracopimaradien-3beta-ol", + "prepilin EpdD", + "deoxycholylglycine/in", + "N2-methylguanine26/guanine27 in tRNA", + "penicillin mX", + "UDP-galacturonic acid", + "oxidized Latia luciferin", + "3-deoxy-L-threo-2-hexulosarate", + "phenylethyl amine", + "HopPtoN/out", + "2,3-dihydroxybenzenesulfonate", + "8-amino-7-oxononanoate", + "apo-citrate lyase", + "maltose/out", + "neuronal nitric-oxide synthase", + "quinic acid", + "[SAP49]-Nomega,Nomega-dimethyl-L-arginine", + "8,12-diethyl-3-vinylbacteriochlorophyllide d", + "geraniol", + "CTP", + "NAPDH", + "daunorubicinol", + "4-methoxybenzonitrile", + "2 2-oxoglutarate", + "21 diphosphate", + "poly(epsilon-caprolactone)", + "delphinidin 3-O-(6''-O-malonyl)-beta-D-glucoside-3',5'-di-O-beta-D-glucoside", + "a 3beta-hydroxysteroid-4alpa-carboxylate", + "1,2-dioleoyl-phosphatidylcholine", + "p75 neurotrophin receptor", + "single-stranded polydeoxyribonucleotide", + "phenanthrene-3,4-diol", + "4-oxobutanoate", + "activated factor XIII", + "(R)-2-hydroxybutane-1,2,4-tricarboxylate", + "4-methylumbelliferyl alpha-D-mannopyranoside", + "[receptor-protein]", + "biliverdin IXbeta", + "globotriosylceramide", + "[protein]-N5-D-ribulosyl-L-lysine", + "beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc-N-Asn [VSG221 protein]", + "3 2,3-dihydroxybenzoate", + "(2S,3R,6S,9S)-(-)-protoillud-7-ene", + "uracil8 in tRNA", + "2-fluoroadenine", + "sucrose 6'-phosphate[side 2]", + "[D-GlcA-beta-(1->4)-2-O-Ac-D-GlcA-beta-(1->4)-D-Glc-beta-(1->4)-[3-O CH3-CH2CH(OH)C(O)-D-Gal-beta-(1->3)-4 6-CH3(COO-)C-D-Glc-beta-(1->4)-D-Glc-beta-(1->4)-D-Glc-beta-(1->6)] 2(or3)-O-Ac-D-Glc-alpha-(1->6)]n", + "[protein] S-methyl-L-cysteine", + "ent-trachylobane", + "phosphorylated IkappaBalpha", + "ferroheme a", + "4-coumaroyl beta-D-glucoside", + "[p110 catalytic subunit of PI 3-kinase]-L-tyrosine phosphate", + "processed Nfs1", + "tannic acid", + "JNK phosphate", + "Tcn1/Crz1", + "5-methylcytosine48 in tRNAGln(UUG)", + "hydralazine", + "protein C zymogen", + "sophoraflavanone G", + "inulobiose", + "N-(N-(7-nitro-2,1 3-benzoxadiazol-4-yl)-epsilon-aminohexanoyl)sphingosylphosphorylcholine", + "cytosine48 in tRNASer(UGA)", + "2,6-dichlorophenol-indophenol", + "Pro-urokinase", + "proform caspase-3", + "stilbene", + "phospho-CREM", + "MucA protein", + "N'-nitrosonornicotine", + "ent-cassa-12,15-diene", + "amyloid beta 12-38 fragment", + "phosphorylated ERK5", + "5alpha-cholest-7-en-3beta-ol", + "1-acyl-2-arachidonoyl-sn-glycerol-3-phosphoinositol", + "N-nervonoylsphinganine", + "(R)-2-hydroxy-4-methylpentanoate", + "phosphorylated Rap1a", + "histone H3 N6,N6,N6-trimethyl-L-lysine26", + "co-enzyme Q", + "27-hydroxycholest-4-en-3-one", + "epithelial sodium channel", + "pro-urokinase type plasminogen activator", + "3alpha,7alpha,12alpha-trihydroxy-5beta-cholanate", + "vitamin D3", + "RNA polymerase II C-terminal domain protein", + "phosphorylated beta2-adrenergic receptor", + "InsL3", + "docosahexaenoyl-CoA", + "interleukin-15", + "phosphatidylcholine[side 1]", + "(1R,6R)-2-succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate", + "3-hydroxy-4-(1H)-pyridone", + "lysosomal-enzyme D-mannose", + "cortisol 21-acetate", + "Zn2+[side 1]", + "L-pipecolate", + "adenine34 in tRNAVal", + "[EF-G translation factor]-serine/threonine", + "procollagen II", + "(+)-corvol ether B", + "glycylpeptide", + "1D-myo-inositol 1,3,4,5-tetrakisphosphate", + "10-oxonortriptyline", + "N-terminal L-leucyl-L-aspartyl-[protein]", + "(Z)-hexadec-6-enoyl-[acyl-carrier protein]", + "D-alanyl-D-alanine", + "IP3R-2", + "N1-methyladenine58 in initiator tRNAMet", + "N-terminal L-leucyl-L-glutamyl-[protein]", + "5-fluorouridine 5'-phosphate", + "carbaryl", + "acetyl-[acyl-carrier protein]", + "fragments of alpha2-antiplasmin", + "soluble TNF-alpha", + "S-geranylgeranyl-Rap", + "hydrolyzed picornavirus polyprotein", + "oxaloacetate", + "[xylose-binding protein][side1]", + "methyl gibberellin A9", + "CMP", + "olmesartan/out", + "G(5')pppPur-mRNA", + "arachidonic aldehyde", + "[TGF-beta receptor I] phosphate", + "7-hydroxymethyl-chlorophyll a", + "N-acetyl-alpha-D-galactosamine 1-phosphate", + "cis-abienol", + "Factor Va", + "NH3", + "phosphorylated MKK1", + "phosphorylated cyclin D", + "Type IV collagen", + "pyrimidine residues in DNA", + "procollagen trans-4-hydroxy-L-proline", + "4-hydroxy-L-glutamate", + "6-biopterin", + "sulfoquinovose", + "adenine9 in tRNAArg", + "frequenin homolog", + "4-O-methyl-D-glucuronoxylan", + "UDP-galactopyranose", + "GABARAP-II protein", + "3'-end 3'-dAMP-labeled (5R,6S)-thymine glycol-thymidine duplex", + "fibrin 1", + "5-oxo-delta-bilirubin", + "keratan", + "D-cellobiose", + "a [Co(I) trimethylamine-specific corrinoid protein]", + "gondotropin-releasing hormone", + "pro-deltaK protein", + "[xylose-binding protein XylF][side 1]", + "formyl-CoA", + "choloyl-CoA", + "c-Myc protein", + "isomaltotriose/in", + "2-dehydro-3-deoxy-6-phosphogalactonate", + "biotin amide", + "MDA5", + "(5R)-5,6-dihydro-5-(thymidin-7-yl)thymidine (in double helical DNA)", + "2-nonanone", + "5-methylcytosine1405 in 16S rRNA", + "(-)-threo-iso(homo)3citrate", + "2-(alpha-D-glucopyranosyl)-sn-glycerol 3-phosphate", + "iron(III)-enterobactin", + "FADH2", + "(1->6)-alpha-D-glucan containing a (1->3)-alpha-D-glucose branch", + "intelectin", + "(R)-mandelate", + "a bacteriochlorophyllide d", + "lipoyl-AMP", + "DsrC protein disulfide", + "IkappaBalpha-L-tyrosine", + "2 1D-myo-inositol 1,4,5-trisphosphate", + "[histone H4R3]-L-arginine", + "N-acetyldopamine", + "p-coumaroylputrescine", + "amyloid beta40 peptide fragments", + "N-amidino-L-aspartic acid", + "Glucagon", + "[PGC-1alpha]-N6-acetyl-L-lysine", + "phosphatidate", + "leukotriene B4", + "acetyl-p50 protein", + "duplex DNA", + "AP DNA", + "2-oxovalerate", + "phosphorylated Elk1", + "[protein]-serine/threonine phosphate", + "kinin heavy chain", + "insulin-like growth factor binding protein-2", + "ergosta-5,7,22,24(28)-tetraen-3-beta-ol", + "TNFalpha", + "ptRNATyr", + "phospho-5-aza-cidofovir", + "apigenin 7-O-apiosylglucoside", + "deoxyguanosine", + "2-deoxy-D-ribose", + "4-(acetylamino)phenylsulfate", + "lactoferrin", + "poly(ADP-ribose) polymerase", + "ethylcarbamate", + "4-bromobenzoic acid", + "TTP", + "2 triphosphate", + "L-sepiapterin", + "3-hydroxybenzoate", + "3-O-sn-phosphatidyl-L-serine", + "olmesartan medoxomil", + "protocatechuate", + "5 acceptor", + "2-amino-3-oxo-3H-phenoxazine-1,9-dicarboxylic acid", + "topoisomerase I", + "elastin fragments", + "core polypeptide pVI", + "Daxx", + "N-acetyl-beta-D-glucosaminyl-1,6-(N-acetyl-beta-D-glucosaminyl-1 3)-N-acetyl-D-galactosaminyl-R", + "[CysO sulfur-carrier protein]-Gly-NH-CH2-C(O)SH", + "11beta-hydroxy-16,17alpha-epoxyprogesterone", + "dihydroflavodoxin", + "phosphorylated Cav1.2", + "amylopectin", + "Alzheimer's disease amyloid precursor protein", + "3,4-Dihydroxyphenylalanine", + "olivetolic acid", + "D-glucose/in", + "phosphorylated Cdk2 interacting protein", + "2,3-epoxyphylloquinone", + "GDP-L-fucose", + "processed COX IV", + "(3S)-squalene-2,3-epoxide", + "4-androsten-3alpha,17beta-diol", + "chondroitin A", + "creatine phosphate", + "C4d", + "an alpha-Hep-(1->3)-4-O-phospho-alpha-Hep-(1->5)-[alpha-Kdo-(2->4)]-alpha Kdo-(2->6)-[lipid A]", + "thioethanolamine", + "neomethymycin", + "sophorose", + "dihydroxyphenylalanine quinone", + "2,4-dihydroxybenzoate", + "5-O-caffeoylquinic acid", + "1-benzothiophene-6-yl sulfate", + "islet amyloid polypeptide", + "xanthine-mismatched double-stranded DNA", + "clarithromycin", + "ferrocytochrome c-551", + "guanine26 in tRNA", + "3-hydroxy-3-methylglutaryl-CoA", + "dehydroepiandrosterone sulfate", + "2-oxopent-3-enoic acid", + "2-methyl-6-phytylbenzene-1,4-diol", + "trans-2-butenoyl-CoA", + "avenacoside", + "2-amino-2,3-dimethylbutyronitrile", + "1,4-thiomorpholine-3-carboxylate", + "carbamoylphosphate", + "NR2 receptor", + "1D-myo-inositol pentakisphosphate", + "ATP +", + "5,6-dihydrouracil20 in tRNA", + "Val-Tyr-Ser", + "mitogen-activated protein kinase kinase", + "H2", + "heparin-binding epidermal growth factor-like growth factor", + "aztreonam", + "(R,S)-S-adenosyl-L-methionine", + "alpha-linoleate", + "D-valine", + "5-phospho-D-xylonate", + "factor X proenzyme", + "cholate/in", + "6-oxocamphor", + "syndecan-2", + "collagen VI", + "R-SH", + "gamma-terpinene", + "L-Fuconate", + "geranial", + "HDAC4", + "poly(3-hydroxydecanoate-co-3-hydroxhyoctanoate)", + "alpha2A-adrenergic receptor", + "oleoyl-CoA", + "reduced plastocyanin", + "5-dehydroshikimate", + "L-3,5,3'-triiodothyronine", + "a DELTA7-sterol", + "ISLR2", + "(4-hydroxyphenyl)acetaldehyde", + "kaempferol 3-O-beta-D-xyloside", + "lipophosphoglycan", + "(1'S,5'R)-hydroxyaverantin", + "LasI", + "a [CheA protein]-N-phospho-L-histidine", + "2 [oxidized NADPH-hemoprotein reductase]", + "ginsenoside 20(S)-Rh2", + "Cab2R protein precursor", + "amphetamine N-oxide", + "tRNA", + "1,2-sn-diacylglycerol", + "deuteroporphyrin IX", + "[IRF3 protein]", + "N2-(carboxyethyl)-L-arginine", + "Galbeta(1->4)GlcNAc-R", + "5,6-dihydro-5-(thymidin-7-yl)thymidine (in double helical DNA)", + "5-hydroxyferuloyl-CoA", + "SIMA135", + "3-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]-2-oxopropanoate", + "FASGKRSQIG", + "cupric-histidine[side 1]", + "L-methionine (S)-sulfoxide", + "oligo(3-hydroxalkanoate)", + "glutaric 5-semialdehyde", + "3-ethyldibenzothiophene-5,5-dioxide", + "cyanuric acid", + "specific double-stranded DNA fragments with terminal 5'-phosphate", + "HrpJ/out", + "2-hydroxy-7-methoxy-5-methyl-1-naphthoyl-CoA", + "alanine", + "glucose-regulated protein of 78 kDa/immunoglobulin heavy-chainbinding protein L-arginine", + "paromamine", + "kanamycin 2''-phosphate", + "7-dehydrocholesterol", + "apulose 4-phosphate", + "reduced coenzyme Q", + "1D-myo-inositol-1,3,4,5,6-pentakisphosphate", + "[reduced NADPH-P450 reductase]", + "N2-dimethylguanine26 in tRNALeuTAG", + "protease-activated receptor-2", + "trichloroethene", + "(2E,6E)-farnesal", + "7-[[(2E)-3,7-dimethylocta-2 6-dien-1-yl]oxy]-5-hydroxy-2-methoxy-3-methylnaphthalene-1,4-dione", + "norsolorinic acid", + "demethyl-4-deoxygadusol", + "(2S)-flavanone", + "11a-hydroxyminocycline", + "DNA polymerase II", + "L-1-phosphatidylethanolamine", + "3,22-dimethyl-1,2,23,24-tetradehydro-2,3,22,23-tetrahydrosqualene", + "L-glutamyl-methotrexate", + "histone H3", + "an N-terminal L-methionyl-L-glutaminyl-[protein]", + "[anti-sigma factor antagonist protein]-serine/threonine", + "3-methyl-2-oxobutanoate", + "anandamide", + "beta-D-galactosyl-(1-4)-D-glucosyl-(1-1)-ceramide", + "all-spectrin", + "1-galloyl-beta-D-glucose", + "(13S,14R)-13-O-acetyl-1-hydroxy-N-methylcanadine", + "L-3,4-dihydroxybutan-2-one 4-phosphate", + "5-dehydro-4-deoxy-D-glucarate", + "2-hydroxy-2-methyl-3-phytyl-2,3-dihydronaphthoquinone", + "Cd2+[side 2]", + "N-acetylmuramate 6-phosphate[side 2]", + "glutathionyl-brostallicin", + "5-methylcytosine50 in tRNAPro(CGG)", + "L-2-hydroxy fatty acid", + "[beta-subunit of heterotrimeric G-protein]-N-phospho-L-histidine", + "UDP-N-acetyl-D-galactosaminyl-bone sialoprotein", + "a (7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl-[glycerolipid]", + "L-methionine-[methionine-binding protein][side 1]", + "Human fibrinogen", + "fatty acyl-CoA/cis", + "N-carbamoyl-L-cysteine", + "9R,10R-trans-epoxy-13R-hydroxy-11E-octadecenoic acid", + "[protein]-O-(beta-L-arabinofuranosyl)-trans-4-hydroxy-L-proline", + "G protein-coupled receptor", + "[fructose-bisphosphate aldolase]-L-lysine", + "UDP-N-acetyl-2-deoxy-2-amino-alpha-D-galactofuranose", + "alpha-D-mannosyl-1,6-(N-acetyl-D-glucosaminyl-1,2-alpha-D-mannosyl-1 3)-beta-D-mannosyl-1,4-N-acetylglucosaminyl-R", + "cornifin-A N5-pentylglutamine", + "glycerone", + "pyridinium-3,5-bisthiocarboxylate mononucleotide", + "phosphorylated SPRH1", + "double-stranded nativeDNA", + "levan", + "11beta-hydroxy-pregn-4-ene-3,20-dione", + "malonate semialdehyde", + "4 NADH", + "11alpha-hydroxy-16alpha,17-epoxyprogesterone", + "chloroethene", + "(2R)-2-((R)-carboxy[2-(thiophen-2-yl)acetamido]methyl)-5-[(E)-2-(2 4-dinitrophenyl)ethenyl]-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid", + "2-aminofluorene", + "polyhydroxyalkanoate latex", + "butanoate", + "caspase-9 propeptide", + "poly(glucose galactosamine phosphate)/out", + "myo-inositol hexakisphosphate", + "glucoiberin", + "sinapate", + "corticotropin-releasing factor receptor type 1", + "dapsone hydroxylamine", + "Nomega-hydroxy-L-arginine", + "hydrazine", + "soyasapogenol B 3-O-beta-D-glucuronide", + "L-phenylalanyl-tRNA(Phe)", + "UDP-2-acetamido-2,6-dideoxy-beta-L-arabino-4-hexulose", + "2 N-carboxy-L-glutamate", + "demethylmacrocin", + "(9R,10)-10-epoxy-(10Z,12Z)-octadecadienoic acid", + "a [histone H4]-N6-methyl-L-lysine20", + "C2 fragment", + "phospho-p38", + "hepta-acyl lipid A", + "3-oxoacyl-CoA", + "apoptosis-inducing factor", + "neryl diphosphate", + "1,2,3,4-tetrachlorobenzene", + "chlorotoluron", + "alpha-actinin-3", + "phosphatidylethanolamine", + "morphine-6-beta-D-glucuronide", + "UDP-MurNAc-peptide", + "phosphorylated IRAG", + "endothelial nitric oxide synthase", + "2 S-allyl-Cys sulfoxide", + "kidney injury molecule-1", + "Leda-1", + "(2E,6E)-farnesoic acid", + "N-stearoylethanolamide", + "ursodeoxycholic acid", + "an N-acetylarylamine", + "crepenynate", + "[cation channel SK4]-L-histidine", + "dehydrotestosterone 17-O-beta-D-glucuronoside", + "inositol 1,4,5-trisphosphate receptor-I", + "3-phospho-D-glyceroyl 1-phosphate", + "fibrin L-arginine", + "guanine37 in tRNAIleUaU", + "cholytaurine/in", + "sortilin-related receptor type I", + "leucine-rich repeat-containing protein 33", + "2-dehydro-L-gulonate", + "full-length (pro)renin receptor", + "L-phosphoseryl-tRNASec", + "3,6-dihydroxypyridine-2,5-dione", + "glycine cleavage system protein-N6-(octanoyl)lysine", + "(S)-8-amino-7-oxononanoic acid", + "[asialoglycoprotein]-(O-3-(alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-alpha D-GalNAc-(1->)))-L-serine", + "cyclo(L-phenylalanyl-L-methionyl)", + "gamma-L-glutamyl-S-(hercyn-2-yl)-L-cysteine S-oxide", + "N-acetyl-beta-D-glucosaminyl-(1->4)-D-glucosamine", + "1H-3-hydroxy-4-oxoquinoline", + "poly(ADP-ribose)polymerase", + "fructose", + "taxadiene-5alpha-ol", + "rpsO mRNA", + "glycano-[(2->6)-alpha-N-acetylneuraminyl]-(N-acetyl-D-galactosaminyl) glycoprotein", + "rebeccamycin", + "calcium-sensing receptor phosphate", + "(5Z,7E,9E,14Z,17Z)-eicosapentaenoate", + "Itaconyl-CoA", + "(R)-lavandulyl diphosphate", + "2-(4-nitrophenyl)-1,3-benzothiazol-6-ol", + "a reduced quinol", + "L-argininosuccinate", + "phosphorylated Rap1b", + "glycocyamine", + "diphthine-[translation elongation factor 2]", + "an acid", + "2-O-(4-deoxy-beta-L-threo-hex-4-enopyranuronosyl)-alpha-L rhamnopyranose", + "(3S,3'S)-astaxanthin", + "nerveglia antigen 2", + "[Foxo1]-L-lysine", + "3-demethylubiquinol-9", + "omega-hydroxy acyl-CoA", + "(-)-5-oxo-1,2-campholide", + "a 2-hydroxy-3-methyl-Cn-fatty-acyl-CoA", + "biliverdin Ixalpha", + "peregrinol diphosphate", + "2 oxidized cytochrome cGJ", + "[SoxY protein]-S-disulfanyl-L-cysteine", + "IHSLPPEGKLG", + "chymotrypsinogen A", + "7,8-dihydroneopterin", + "C24:0 fatty acid", + "L-gulonolactone", + "tylosin", + "(5Z,13E)-(15S)-9alpha,11alpha-epoxy-15-hydroxythromboxa-5,13-dienoate", + "Pho4 protein", + "5-nitrosalicylate", + "hypoxia-inducible factor-L-asparagine", + "(+)-columbianetin", + "alpha -ribazole", + "D-glucono-1,5-lactone", + "activated factor VIII", + "mature F1FO-ATP synthase", + "2,6-dichloro-1,4-benzoquinone", + "ATM kinase", + "2,5-anhydro-4-O-alpha-L-idopyranuronosyl-D-mannitol 6-sulfate", + "ent-cassadiene", + "4-nitrophenyl beta-D-fucoside", + "acetylputrescine", + "rice bran hemicellulose", + "malvidin 3-O-beta-D-glucoside", + "cholesterol 3-beta-D-glucoside", + "ferric dicitrate/in", + "acetoacetyl-CoA", + "1-eicosanol", + "reduced ferredoxin Pet F", + "6-pyruvoyl-tetrahydropterin", + "2 2-acetylphloroglucinol", + "tetrahydropteroyl-[gamma-Glu]n+1", + "alpha-globulin", + "3,5,3'-triiodo-L-thyronine", + "proform caspase-9", + "10 CoA", + "staphylopine", + "2-chloropropionate", + "aminoacetone", + "(2S,3R)-2-amino-3-methyl-4-ketopentanoate", + "archaeine15 in tRNA", + "N-terminus of anti-sigma factor RsiP", + "curcumin phenolic beta-D-monoglucuronide", + "contrapsin-like protease inhibitor-3", + "H2O2", + "(6E,10E)-geranyllinalool", + "1,3,7-trimethylurate", + "2,2-dimethylcyclopropanecarbonitrile", + "[histone H4]-L-lysine", + "calmodulin-L-methionine", + "phosphorylated Rad53 protein", + "glycerol 2-phosphate", + "(S)-2-hydroxypropylphosphonate", + "N-succinyl-L-2-amino-6-oxoheptanedioate", + "HB-EGF", + "(R)-2,3-dihydroxyisovalerate", + "5-carboxymethylaminomethyluridine34 in tRNALeu", + "feruloyltyramine", + "aminoacyl peptide", + "barley-beta-glucan", + "serum albumin", + "prepeptide", + "40 ATP", + "Ac-YSSVSRKLL", + "D-myo-phosphatidylinositol 3,4,5-trisphosphate", + "urea-1,3-dicarboxylate", + "L-homoarginine", + "Gly-Leu-Arg-Pro-Gly", + "5-(4-acetoxybut-1-ynyl)-2,2'-bithiophene", + "(25S)-3beta-hydroxycholest-5-en-26-oate", + "double-stranded DNA fragments with terminal 5'-phosphates", + "(8R,11R,12S)-trihydroxy-(5Z,9E,14Z)-eicosatrienoic acid", + "phospholipase C gamma", + "cyclolaudenol", + "3',5'-cAMP", + "hornein N5-pentylglutamine", + "spore protein A", + "beta-D-galactose", + "alpha-casein N5-alkylglutamine", + "4-guanidinobutyramide", + "growth-factor gurken", + "acetol", + "[splicing factor SF3B2]-Nomega,Nomega'-dimethyl-L-arginine", + "delphinidin 3-O-beta-D-sambubioside", + "7 diphosphate", + "dTDP-4-amino-4,6-dideoxy-D-glucose", + "N,N'-diacetyl-alpha-D-bacillosaminyl-diphospho-tritrans heptacis-undecaprenol", + "leucopterin", + "ursodeoxycholylglycine/in", + "L-arginyl-[acceptor protein]", + "(9E,11E)-tetradecadienoate", + "chloroplast-protein[side 1]", + "(ADP-D-ribosyl)n-p21ras", + "bAD protein", + "L-Arg-[apolipoprotein A-I]", + "N-acetyl-D-glucosaminyl-1,2-(N-acetyl-D-glucosaminyl-1,6)-1 2-alpha-D-mannosyl-1,3(6)-(N-acetyl-D-glucosaminyl-1 2-alpha-D-mannosyl-1,6(3))-beta-D-mannosyl-1 4-N-acetyl-D-glucosaminyl-R", + "1,2-diacyl-3-O-alpha-D-galactosyl-(1->6)-beta-D-galactosyl-sn-glycerol", + "closed I- channel", + "linear DNA duplexes", + "1-phosphatidyl-1D-myo-inositol 3,4-bisphosphate", + "ent-kaurene", + "n-butanal", + "phosphorylated Pin1", + "2-O-caffeoylglucarate", + "plasmepsin 2", + "islet amyloid polypeptide processing intermediate", + "phosphorylated valosin containing protein", + "adhesin MIC2", + "[tau-protein]", + "N-terminal-L-seryl1-[histone H2A]", + "[G-protein-coupled receptor]", + "bone morphogenetic protein", + "amyloid beta protein", + "lavandulyl diphosphate", + "5,5'-bi((R)-lactoyl)trypanothione", + "antheraxanthin", + "fibrillar collagen type I propeptide", + "4-carboxy-2-hydroxyhexa-2,4-dienedioate", + "5'-deoxy-5'-(3-phenoxy)propyl-5'-thioadenosine", + "decarbamoylnovobiocin", + "guanine9 in tRNAAsp", + "(Z)-propanethial oxide", + "trehalose-6-phosphate", + "5-methyltetrahydromethanopterin", + "S-Adenosyl-L-methionine", + "brostallicin", + "matriptase-2", + "a sterol ester", + "2 oxidized flavodoxin", + "[phycoerythrocyanin beta-subunit]-Cys84-phycocyanobilin", + "2-methoxybenzyl alcohol", + "3'-C-ethynylcytidine 5'-triphosphate", + "phosphorylated HIV-Tat", + "pyrazine 2,6-dicarboxylic acid", + "Fumarate", + "4-nitrobenzoate", + "glucuronate", + "pilin EpdE", + "tRNAAsn precursor", + "N-phosphoglycocyamine", + "20:2DELTA11,14", + "ferrioxamine B/out", + "beta-D-Glc-(1->3)-alpha-D-GlcNAc-diphospho-ditrans,octacis-undecaprenol", + "phosphorylated giantin", + "peptide-L-methionine-(S)-S-oxide", + "cholera toxin[side 2]", + "disintegrin and metalloproteinase domain-containing protein 10", + "3alpha,12alpha-dihydroxy-5beta-cholanate", + "amylose", + "phospho-tyrosinyl-FAK", + "beta-Cyano-L-alanine", + "(R)-2-methylmalonyl-CoA", + "4-oxocyclohexanecarboxylate", + "chloroorienticin B", + "6-chloropyridine-2,3,5-triol", + "4.5S RNA precursor", + "monovinyl protochlorophyllide a", + "2-oxo-dATP", + "[acceptor protein]-L-cysteine", + "10 H2O", + "Met-peptide", + "tungstate[side 1]", + "Fragments of peptidoglycan", + "3,3',5,7-tetramethoxyquercetin", + "reduced coenzyme Q0", + "isovitexin", + "beta-D-4-deoxy-DELTA4-GlcAp-(1->3)-beta-D-GalNAc6S", + "methanofuran", + "dCMP", + "taurolithocholic acid", + "D-2-hydroxypropionic acid", + "pro-peptide of thyrotropin-releasing hormone", + "peptidyl-L-glutamate", + "(4R)-ipsdienol", + "(phosphate)n", + "[protein]-L-arginine", + "cytidine56 in elongator tRNAMet", + "celloheptaose", + "deoxyamidinoproclavaminate", + "CysB", + "jasmonoyl-L-isoleucine", + "all-trans-retinyl-ester-[cellular-retinol-binding-protein]", + "protopanaxatriol", + "tenofovir/in", + "hCgA-(360-373)", + "light chain myosin II", + "[myosin II heavy-chain]", + "[L-Asp(4-Arg)]n", + "complement factor C3b", + "N-acetyl-O-acetyl-neuraminate", + "phosphorylated glycogen phosphorylase", + "L-arginyl-peptide", + "D-isoleucine", + "spheroidene", + "(10R,11R,12S)-trihydroxy-(5Z,8Z,14Z)-eicosatrienoic acid", + "beta-D-fructofuranosyl-[(2,6)beta-D-fructofuranosyl-]n+1 alpha-D-glucopyranoside", + "neoagarotetraose", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-phenylalanyl-[protein]", + "peonidin 3-O-beta-D-glucoside", + "1,6-di-O-galloyl-beta-D-glucose", + "ursodeoxycholylglycine/out", + "tobacco mosaic virus RNA", + "2,4-dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one 2-D-glucoside", + "3-deoxy-D-manno-2-octulosonic acid glycoside", + "phosphorylated twitchin", + "2-hydroxybenzoyl-CoA", + "D-glyceraldehyde 3-phosphate", + "alpha-L-rhamnose", + "N-cyclohexyl formamide", + "a ceramide", + "(1'S,5'R)-5'-hydroxyaverantin", + "2-methyl-1,3-benzothiazol-6-ol", + "C30 botryococcene", + "pyridine", + "DELTA4-3,17-androstendione", + "roxithromycin 2'-O-phosphate", + "gentiopentaose", + "RNA*DNA hybrid", + "D-amino acid peptide", + "ginsenoside Ra1", + "gamma-L-glutamyl-L-cysteinyl-L-serine", + "[Co(I) trimethylamine-specific corrinoid protein]", + "phospholipid[side 1]", + "(8R,10E,12Z)-8-hydroperoxy-10,12-octadecadienoate", + "5-amino-4-chloro-2-(2-hydroxymuconoyl)-3(2H)-pyridazinone", + "N-hydroxy-carboxylic acid amide", + "4-[(1->4)-alpha-D-glucosyl]n-1-D-glucose", + "phospho-IKKalpha", + "pro-matrix metalloproteinase-10", + "validamine 7-phosphate", + "5alpha-androstane-17-one 3-sulfate", + "tetralin", + "[histone H3]-L-lysine23", + "K30 capsule polysaccharide", + "UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysine", + "MAP1B", + "2-chloromaleylacetate", + "(3-deoxy-alpha-D-manno-oct-2-ulopyranosylonate)-(2->4)-(3-deoxy-alpha-D manno-oct-2-ulopyranosylonate)-(2->6)-2-deoxy-2-[[(3R)-3 (dodecanoyloxy)tetradecanoyl]amino]-3-O-[(3R)-3-hydroxytetradecanoyl]-4 O-phosphono-beta-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3 hydroxytetradecanoyl]-2-[[(3R)-3-hydroxytetradecanoyl]amino]-1-O phosphono-alpha-D-glucopyranose", + "sugar beet pectin", + "RNA-DNA hybrid", + "3-indole-2-oxopropanoate", + "Nomega-(ADP-D-ribosyl)-L-arginine", + "antigen peptide[side 1]", + "guanine1207 in 16S rRNA", + "testosterone beta-D-glucuronoside", + "26-deglucoavenacoside A", + "16,17-epoxyandrost-4-en-3-one", + "Man6GlcNAc", + "tuliposide F", + "[dihydrolipoyllysine-residue (2-methylpropanoyl)transferase] S-(2-methylbutanoyl)dihydrolipoyllysine", + "pseudomonic acid C", + "N-Acetyl-L-Asp-L-Glu", + "paclitaxel/in", + "lactobiono-1,5-lactone", + "mRNAn", + "focal adhesion kinase", + "trans-2-eicosenoyl-CoA", + "Fe3+", + "cationic antimicrobial peptides from epithelial cells or macrophages", + "bis(beta-D-glucosyl) crocetin", + "dihydrofurano derivative of 7-O-methylluteone", + "MKK2", + "tetracenomycin F1", + "thiamine diphosphate-[thiamine-binding protein][side 1]", + "M1 muscarinic acetylcholine receptor", + "monoamidated dicarboxylate", + "alphaII-spectrin", + "adenine37 in tRNA([Ser]Sec)", + "[protein]-ADP-D-ribose", + "[alpha-D-glucosyl-(1-3)]n+1", + "Co2+[side 2]", + "[BMAL1]-N6-monoubiquitinyl-L-lysine", + "all-trans-hexaprenyl diphosphate", + "1-O-(4-hydroxycinnamoyl)-beta-D-glucoside", + "cobalt-precorrin-4", + "gamma-L-Glutamyl-L-cysteinyl-glycine", + "androst-5-en-17-one 3-sulfate", + "heroin", + "DNA containing an adenine:guanine mismatch", + "alpha-tocopherol", + "zymostenol", + "6 reduced flavodoxin", + "[L-proline-binding protein][side 1]", + "toyocamycin", + "sn-glycero-3-phospho-1-D-myo-inositol", + "phosphatidylinositol 3,4,5-trisphosphate", + "oxidized glutathione", + "trithionate", + "glycopeptide", + "(S)-dithiane sulfoxide", + "cinnamyl aldehyde", + "S-[(Z)-N-hydroxy(p-hydroxyphenyl)acetimidoyl]-L-glutathione", + "malonic semialdehyde", + "5-methylbarbiturate", + "cytochrome c552", + "5-methyl-2-(propan-2-yl)cyclohexan-1-one", + "phosphorylated [microsomal membrane protein]", + "tRNATyrSu3 precursor", + "fenbendazole", + "Smad1", + "7-[(3S)-(3-amino-3-carboxypropyl)]wyosine37 in tRNAPhe", + "1-oleoyl-2-stearoyl-lysophosphatidylcholine", + "chenodeoxycholylglycine/out", + "S-(L-prolyl)-[peptidyl-carrier protein PigG]", + "5beta-androstane-3alpha-ol-17-one", + "o-quinone", + "Cd2+/out", + "gluconapin", + "acetyl-p65 protein", + "N-(ADP-D-ribosyl)diphthamide-[translation elongation factor 2]", + "3-dehydro-20-hydroxyecdysone", + "beta-D-arabinose 1-phosphate", + "2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-glycerol", + "amino acid/out", + "(6S)-hydroxyhyoscyamine", + "(2S,5S)-carboxymethylproline", + "[L-glutamate:ammonia ligase (ADP-forming)] -(AMP)", + "N-formyl-m-aminobenzoic acid", + "androsterone", + "ubiquinol-8", + "alpha-D-fucose", + "trans-resveratrol beta-D-glucuronoside", + "(3S,5S)-carbapen-2-am-3-carboxylate", + "1-(4-hydroxy-2-methylpyrimid-5-ylmethyl)-3-(beta-hydroxyethyl)-2 methylpyridinium bromide", + "L-Tyr benzyl ester", + "D-galactosyl-beta-1,3-N-acetyl-D-glucosamine", + "6-phospho-D-glucosaminate", + "amyloid beta 12-42 fragment", + "poly (ADP-ribose) polymerase", + "(5Z,8Z,10E,14Z)-(12S)-12-hydroperoxyicosa-5,8,10,14-tetraenoate", + "N6-[[SAMP3]-Gly-Gly]-[[UbaA]-L-cysteine]", + "(R)-3-hydroxybutanoyl-CoA", + "[anti-anti-sigma factor SpoIIAA]-serine/threonine", + "O3-[N-acetyl-alpha-D-galactosaminyl]-L-threonyl/L-seryl-[protein]", + "2-O-(6-O-palmitoyl-alpha-D-mannosyl)-1-phosphatidyl-1D-myo-inositol", + "quercetin 3,3'-bissulfate", + "Fuc-alpha-(1-3)-GlcNAc", + "tRNA containing uridine at position 54", + "alpha-D-galactosyl-blood group antigen H", + "damaged DNA", + "CD3 epsilon", + "tetrahydrodictyopterin", + "(R)-ibuprofenoyl-CoA", + "(2R)-5-[(acetyloxy)methyl]-2-[(R)-carboxy[(thiophen-2 ylacetyl)amino]methyl]-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid", + "versican V1", + "(24R)-3alpha,7alpha,12alpha,24 26-pentahydroxy-5beta-cholestane-27-sulfate", + "L-arabinose[side 2]", + "electron donor", + "linolenic acid", + "11S proglobulin", + "L-Arabinonate", + "4'-phosphopantetheine", + "ureidoacrylate peracid", + "O-acetyl-L-serine", + "[trifunctional enzyme]-tyrosine", + "L-asparatate", + "monodehydro-L(+)-ascorbate", + "Pro-opiomelanocortin", + "C37-(phenol)carboxyphthiodiolenone-[(phenol)carboxyphthiodiolenone synthase]", + "1-docosanol", + "miR-21-5p", + "taurochenodeoxycholic acid", + "myristoyl-sn-glycerol", + "C3 zymogen", + "alpha-all-spectrin", + "P1,P3-bis(5'-adenosyl) triphosphate", + "2-heptyl-4(1H)-quinolone", + "cephalosporin", + "[Fluor de Lys protein]-L-lysine", + "phytenal", + "[histone H3]-L-lysine27", + "5-methylcytosine49 in tRNAVal(UAC)", + "L-2,3-diaminopropanoate", + "2'-hydroxyformononetin", + "double-stranded DNA", + "Staphylococcus aureus ATCC 29213 cells", + "K+[side 2]", + "Coproporphyrinogen III", + "phosphorylated CIRCADIAN CLOCK ASSOCIATED1", + "uridine-mismatched double-stranded DNA", + "Phosphatidylethanolamine", + "Man8GlcNAc2-[ricin A-chain-transmembrane-Leu2] (isomer 8A1,2,3B1,3)", + "[protein DsbG] carrying a disulfide bond", + "alpha-linolenic acid", + "6'-sulfo N-acetyllactosamine", + "2,3-bis((R)-3-hydroxytetradecanoyl)-alpha-D-glucosaminyl 1-phosphate", + "desmoglein 2", + "dimethylallyl phosphate", + "a phosphatidylserine", + "1,2-diacyl-3-O-(beta-D-galactosyl)-sn-glycerol", + "ferric citrate[side 1]", + "reduced amylin", + "linoleoyl-[CoA]", + "reduced benzyl viologen", + "sodium channel", + "cysteinylglycine", + "interleukin-37 propeptide", + "2-hydroxyacetophenone", + "peptide YY fragment 3-36", + "oxyluciferin", + "5-hydroperoxyeicosatetraenoic acid", + "ethyl vanillin", + "quinate", + "YPWTQ", + "5-methylcytosine38 in tRNAAsp(GTC)", + "2,5-diamino-6-(5-phospho-D-ribitylamino)pyrimidin-4(3H)-one", + "2-oxopentanedioic acid 5-ethyl ester", + "nonanoate", + "methylarsonite", + "membrane-derived oligosaccharides", + "4-O-beta-D-mannopyranosyl-D-glucose", + "(5Z,13E)-(15S)-11alpha,15-dihydroxy-9-oxoprost-5,13-dienoate", + "methyl beta-D-xylopyranoside 2,4-di-O-acetate", + "2 maltose", + "methylglyoxal", + "L-phenylalanyl-tRNA", + "[beta-adrenergic receptor]", + "beta-neoendorphin", + "dynamin-like protein 1", + "a 3'-hydroxyflavonoid", + "(2R,4S)-2-methyl-2,3,3,4-tetrahydroxytetrahydrofuran-[AI-2-binding protein][side 1]", + "2 [molybdopterin-synthase sulfur-carrier protein]-Gly-NH-CH2-C(O)SH", + "1-hydroxy-2-naphthoic acid", + "(1,4-alpha-D-galacturonosyl)n", + "L-erythrulose 1-phosphate", + "2-oxopentanoic acid", + "vomilenine", + "enterobactin", + "1,2-di-(9Z-octadecenoyl)-sn-glycerol", + "oxidized electron donor", + "5-methylcytidine34 in mitochondrial tRNA", + "cortalcerone", + "[elongation factor 3]phosphate", + "UDP-N-acetyl-D-galactosamine", + "(ADP-D-ribosyl)-Rab31", + "Rho10-cysteine", + "1-[(4-amino-2-methylpyrimidin-5-yl)methyl]pyrrolidine-2-carboxylic acid", + "alpha-Leu", + "4-demethylwyosine", + "beta-glucan/out", + "1-O-[O-2-(acetylamino)-2-deoxy-beta-D-galactopyranosyl-(1-4)-O-[N acetyl-alpha-neuraminosyl-(2-3)]-O-beta-D-galactopyranosyl-(1-4)-beta-D glucopyranosyl]-ceramide", + "prepilin EpdC", + "4-guanidinobutanoate", + "S-geranylgeranyl-K Ras", + "benzylthiophosphorylated myelin basic protein", + "5-cholestene-3beta,7alpha-diol", + "phospho-Ror2", + "cis-3-chloro-2-methyldienelactone", + "2 3'-phosphoadenylyl sulfate", + "L-sorbose[side 1]", + "N-decanoyl-L-homoserine-1,4-lactone", + "an N-terminal-L-methionyl-L-histidyl-[protein]", + "22 NADPH", + "N-carbamoyl-L-aspartate", + "eukaryotic translation initiation factor 4G II", + "5-methylcytosine-mismatched double-stranded DNA", + "(R)-(2,4-dichlorophenoxy)propanoate", + "[cullin 1]-L-lysine720", + "human eukaryotic translation initiation factor 4 G II", + "diacyl-sn-glycerol", + "2-hydroxy-3-oxo-hex-1-enyl phosphate", + "(S)-2-aminoadipate 6-semialdehyde", + "isobutanoyl-CoA", + "phosphorylated histone H2A", + "an S-(1-hydroxy-2-oxopropyl)-[protein]-L-cysteine", + "2-cis,4-trans-xanthoxin", + "I-kappaB", + "activated protease-activated receptor 2", + "phosphorylated 53BP1", + "bis-D-fructose 2',1:2,1' dianhydride", + "alpha-ribazole", + "(2Z)-enoyl CoA", + "lactose 6'-phosphate[side 2]", + "beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-R", + "amyloid beta 12-40 fragment", + "4-amino-4-de(dimethylamino)anhydrotetracycline", + "phospho-AKAP450", + "dTDP-alpha-D-forosamine", + "UDP-2-acetamido-2,6-dideoxy-beta-L-talose", + "[Wnt]-O-(9Z)-hexadec-9-enoyl-L-serine", + "4-carboxy-2-hydroxy-cis,cis-muconate 6-semialdehyde", + "a 1-alpha-linolenoyl-2-acyl-[glycerolipid]", + "palmitoyl-[protein]", + "cyanide", + "mature interleukin-1beta", + "monoglucosyl-(2,3-dihydroxybenzoylserine)3", + "[germ cell-specific protein Zili]-Nomega,Nomega'-dimethyl-L-arginine", + "7 malonyl-CoA", + "(9Z,11E,13S,15Z)-13-hydroperoxyoctadeca-9,11,15-trienoate", + "3-geranyl-4-hydroxybenzoate", + "tRNAGln", + "1,6-dihydro-beta-NADH", + "4-imidazoleacetate", + "2,3-bisphosphoglycerate", + "2'-deamino-2'-hydroxyneamine", + "NH4+", + "ApoE N5-alkylglutamine", + "4-hydroxy-2-nonenal", + "6-decylubiquinone", + "a flavodoxin semiquinone", + "lamban", + "protein L-arginine", + "phosphorylated pyruvate dehydrogenase complex", + "D-glucose 6-phosphate[side 2]", + "N-glycan", + "melibiose/out", + "2-dehydropantolactone", + "[Notch2 protein with EGF-like domain]-3-O-(beta-D-glucosyl)-L-serine", + "methylazoxymethanol", + "NDP", + "methanethiol", + "O-glycan", + "aaX", + "starch containing alpha-1,6-glucosidic linkages", + "3-amino-2-oxopropyl phosphate", + "(20S)-ginsenoside Rh2", + "meropenem", + "tumor necrosis factor alpha", + "5-iodo-thymidine", + "hydroxymethylglutarate", + "[NiFe]-hydrogenase 3", + "apoB-100 protein", + "aminohydroquinone", + "VEAL", + "sulfate-[sulfate-binding protein][side 1]", + "viral nucleocapsid protein of transmissible gastroenteritis coronovirus", + "OmpC", + "1-benzothiophene-5-ol", + "D-3-hydroxyacyl-CoA", + "Ac-SLRP", + "6 oxidized ferredoxin", + "sulforaphane-S-glutathione[side 2]", + "alpha-actinin", + "gonadotrophin-releasing hormone", + "[(1->4)-N-acetyl-beta-D-glucosaminyl]n+1", + "devancosaminyl-vancomycin", + "non-structural protein 4-5", + "phosphorylated Rac-1", + "promastoparan", + "(L-alanyl)adenylate", + "dTDP-6-deoxy-beta-L-talose", + "acetyl-histone", + "alpha-D-glucose 1 phosphate", + "phenol", + "5-methyluridine", + "5alpha-cholesta-8-en-3beta-ol", + "a phytoceramide", + "preendothelin", + "5-phosphoribosyl diphosphate", + "single stranded DNAn+1", + "a 5'-(N7-methyl 5'-triphosphoguanosine)-(2'-O-methyl-purine-ribonucleotide) (ribonucleotide)-[mRNA]", + "heparan sulfate-glucosamine", + "a 5'-(5'-triphosphoguanosine)-[mRNA]", + "a [pre-mRNA fragment]-3'-adenosine-3'-phosphate", + "2-Deoxy-D-glucose 6-phosphate", + "cis-p-toluate diol", + "2 NH4+", + "17-beta-estradiol 3-sulfate", + "prochemerin", + "pyrroline-5-carboxylate", + "4-methylcatechol", + "phosphorylated protein CREB", + "Heparosan-N-sulfate L-iduronate", + "O-phospho-D-serine", + "N-terminal L-lysyl-[beta-catenin]", + "alpha-D-glucosyl-lipopolysaccharide", + "N,N-dimethylaniline", + "3 UDP-N-acetyl-alpha-D-galactosamine", + "lacto-N-biose", + "[E2 ubiquitin-conjugating enzyme cullin-4A]-L-cysteine", + "3-dehydropyranose", + "2 albendazole", + "growth factor macrophage-stimulating protein 1", + "L-sorbose", + "ditrans,octacis-undecaprenyl diphosphate", + "[sigma factor A]-L-arginine", + "propene", + "Phe-Arg", + "ethanol-soluble sugar", + "(S)-homoserine", + "5-methylcytosine48 in tRNAHis", + "(4R,5S)-4,5,6-trihydroxy-2,3-dioxohexanoate", + "2-hydroxy-3,4-dioxohexyl phosphate", + "D-galactaric acid", + "nitrite", + "matrilin 3", + "7beta-hydroxy-3-oxochol-24-oyl-CoA", + "a gamma-linolenoyl-[glycerolipid]", + "5-fluorouracil", + "[beta2-adrenergic receptor]", + "6-aminohexanoate dimer", + "2-O-acetyl-alpha-L-Rha-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3) alpha-D-Gal-PP-decaprenol", + "S-(2E,6E)-farnesyl-[H Ras]-L-cysteine", + "erythromycin B", + "Fe-protoporphyrin IX", + "[AMPKalpha2]-N6-monoubiquitinyl-L-lysine48", + "DNA containing 5-methylcytosine", + "L-Ala-gamma-D-Glu-meso-diaminopimelyl-D-Ala", + "1-hexadecyl-sn-glycero-3-phosphocholine", + "L-arabitol", + "GDP-6-deoxy-D-mannose", + "3-phosphohydroxy-1aminoacetone", + "phosphorylated Na+-channel", + "desmosterol", + "1,2-dihydroxydecane-3,4-dione", + "granulocyte macrophage colony stimulating factor receptor", + "5-pyridoxolactone", + "N-hexanoyl-[acyl-carrier protein]", + "Manalpha(1-6)(Manalpha(1-3))Manalpha(1-6)(Manalpha(1-2)Manalpha(1 3))Manbeta(1-4)GlcNAcbeta(1-4)GlcNAc", + "GDP-4-dehydro-6-deoxy-D-mannose", + "alpha-maltose-1-phosphate", + "G protein-coupled receptor GRK7", + "(4R,5S)-5-[(1S,2R)-1-carboxy-2-hydroxypropyl]-3-([(3S 5S)-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl]sulfanyl)-4-methyl-4 5-dihydro-1H-pyrrole-2-carboxylic acid", + "3beta-hydroxy-5alpha-cholest-8(14)-en-15-one", + "tRNAAla", + "low-molecular-weight kininogen", + "beta-nootkatol", + "1-O-sinapoyl-beta-D-glucose", + "GDP-glucose", + "mesaconyl-C1-CoA", + "m7G5'ppp5'-mRNA", + "double stranded DNA containing mismatches", + "vitamin B12[side 2]", + "5-hydroxy-L-lysine-[U2AF65]", + "cystathionine beta-synthase", + "sulfopyruvate", + "(1-4)-beta-D-glucosyl-D-mannobiose", + "cyanoglucosides", + "phospho-PAF-C", + "lipid A 4'-(2-aminoethyl diphosphate)", + "5,6-dihydroxy-3-methyl-2-oxo-1,2,5,6-tetrahydroquinoline", + "terpentedienyl diphosphate", + "intestinal alkaline sphingomyelinase bound to mucosa", + "2-chlorocatechol", + "hexadecanoyl-[acyl-carrier protein]", + "beta-mercaptopyruvate", + "6-gingerol 5-O-beta-D-glucuronoside", + "2-amino-2-deoxyisochorismate", + "Rab9 protein", + "an alkylcobalamin", + "an N-terminal-L-methionyl-L-leucyl-[RNP H protein]", + "N-acetyl-1,2-dichlorovinyl-L-cysteine", + "decorin peptide fragments", + "delphinidin 3-O-(6''-O-malonyl)-beta-D-glucoside-3'-O-beta-glucoside", + "5beta-pregnane-3alpha,20alpha-diol", + "phosphorylated human serotonin transporter", + "(2R,3S)-2-methylisocitrate", + "N-[L-5-amino-5-carboxypentanoyl]-L-cysteinyl-D-valine", + "beta-D-4-deoxy-Delta4-GlcAp-(1->4)-beta-D-Glcp-(1->4)-alpha-L-Rhap-(1 >3)-D-Glcp", + "connexin-43", + "Endo's fragment", + "nitrate/out", + "2 oxidized adrenodoxin", + "demethoxycurcumin", + "cis,cis-hexadienedioate", + "1-D-myo-inosityl-2-acetamido-2-deoxy-alpha-D-glucopyranoside", + "oxidized cytochrome b6", + "a (2'R)-2'-hydroxyphytoceramide", + "hypoxia-inducible factor 1alpha-L-proline", + "[antifreeze glycoprotein]-(O-3-(beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->)))-L-serine", + "pregnenolone sulfate", + "inactive 2-hydroxyglutaryl-CoA dehydratase", + "5-methylcytosine27 in vtRNA1.2", + "membrane-derived oligosaccharide D-glucose", + "2-O-beta-D-glucopyranosyl-4-hydroxy-7-methoxy-1,4-benzoxazin-3-one", + "diphosphoinositol pentakisphosphate", + "decaprenyl diphosphate", + "9-cis-10'-apo-beta-carotenal", + "saliva", + "5'-phospho-mRNA", + "3 oxidized flavoproteins", + "oleandomycin 2'-O-phosphate", + "D-glucosamine-[glucosamine-binding protein Avi_5305][side 1]", + "SP20 protein", + "morphine-3-beta-D-glucuronide", + "UDP-rhamnose", + "D-xylose-[D-xylose/L-arabinose-binding protein Saci_2122][side 1]", + "4-anisyl alcohol", + "2'-O-methylcytidine32/2'-O-methylguanosine34 in tRNA", + "perakine", + "[connexin 43]-N6-acetyl-L-lysine", + "dihydrozeatin", + "dicinnamoylmethane", + "[ZAP-70]-L-tyrosine phosphate", + "4-coumaroylaldehyde", + "oxidized phospholipids", + "PARP", + "4-N-acetyl-L-2,4-diaminobutanoate", + "N3-acetylsisomicin", + "open Cl- channel", + "echinocandin A", + "17beta-estradiol sulfate", + "cytosine in single-stranded DNA", + "3'-end 3'-dAMP-labeled uracil-guanine duplex", + "cyanidin 3-O-(2-O-beta-D-glucuronosyl-6-O-malonyl-beta-D-glucoside)", + "thrombin fragment 1", + "8 CoA", + "cytochrome c551", + "CDPdiacylglycerol", + "activated stromelysin", + "3,4-dimethoxycinnamate", + "RNA polymerase II", + "versicolorin B", + "acetyl-N-L-Ser-L-Asp-L-Lys-L-Pro", + "p-coumaroylagmatine", + "2-hydroxycaproate", + "all-trans-neurosporene", + "1,3,5-triazine-2,4,6-triol", + "3-(1H-imidazol-4-yl)-2-oxopropanoic acid", + "2-phenylethyl 6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranoside", + "N3-acetylkanamycin B", + "paxilin tyrosine", + "7-ethyl-10-hydroxycamptothecin", + "N-acetylneuraminic acid", + "2,3-dihydrogossypetin", + "myosin light-chain phosphate", + "SMAD1/5/8 protein", + "histone H3-L-citrulline", + "N-palmitoylethanolamine", + "10-hydroxy-alpha-humulene", + "2 bisulfite", + "[N-(6-aminohexanoyl)]n-x", + "5'-phosphodinucleotide", + "sulfo-2-hydroxypropanoate", + "DPNRKRGWPA", + "1-(9Z-octadecenoyl)-2-octadecanoyl-sn-glycerol", + "L-prolyl-tRNAPro", + "PRAS40", + "neuropeptides", + "n Na+/out", + "cytidine 5'-[[hydroxy(2-hydroxyethyl)phosphonoyl]phosphate]", + "2-O-(4-coumaroyl)-3-(4-hydroxyphenyl)lactate", + "hyodeoxycholic acid 6-O-glucuronoside", + "(S)-(2-pyrrolyl)cysteine", + "1-O-hexadecyl-2-acetyl-sn-glycero-3-phosphocholine", + "a 3-(1-hydroxyethyl) bacteriochlorophyllide d", + "peptidyl-tRNALys", + "3-deoxy-D-glycero-D-galacto-nononate", + "guanine67 in tRNATrp", + "Rho-GDI 1", + "a 1-acyl-2-palmitoyl-[glycerolipid]", + "[L-arginine-binding protein][side 1]", + "3,4-dihydroxybenzaldehyde", + "softwood Kraft pulp", + "delphinidin", + "[diguanylate cyclase TpbB]-tyrosine phosphate", + "L-cysteinylglycine", + "beta-1,4-xylan", + "glutamine/out", + "[Stk]-serine/threonine phosphate", + "mature RNA", + "fatty acids", + "(5Z,13E)-6,9alpha-epoxy-11alpha-hydroxy-15-oxoprosta-5,13-dienoate", + "4 NADPH", + "3'-dephospho-CoA", + "(-)-germacrene D", + "sinapoyl beta-D-glucoside", + "[procollagen]-trans-3-hydroxy-L-proline", + "alpha-iduronic acid", + "[SNAP-25]-S-palmitoyl-L-cysteine", + "(9S,13S)-12-oxo-phytodienoic acid", + "D-erythro-sphingosine 1-phosphate", + "casein", + "valeronitrile", + "malonyl-[acyl-carrier protein AcpM]", + "secondary butylamine", + "4'-hydroxy-warfarin", + "all-trans-phytoene", + "D-ribulose-5-phosphate", + "RFC140", + "1-hexadecanol", + "4-hydroxy-2-oxo-1,7-heptanedioate", + "a 5' hydroxy-guanosine-[pre-mRNA fragment]", + "3-devinyl-3-(1-hydroxyethyl)-bacteriochlorophyllide a", + "N6-(2-isopentenyl)adenine", + "[PknA]-serine/threonine phosphate", + "collapsin response mediator protein-2", + "N,N-dimethyl-3-keto-3-(2-thienyl)-1-keto propanamine", + "cefazolin/out", + "plasma kallikrein", + "CDP-2,3-bis-(O-geranylgeranyl)-sn-glycerol", + "gibberellin GA3", + "Ac-SNKTIDEANQ", + "2-dodecanone", + "7''-O-phosphohygromycin B", + "[AI-2-binding protein][side 1]", + "glucagon-like peptide-1", + "2 UDP-glucose", + "type IV Flp1 prepilin", + "DNA containing an adenine:7,8-dihydro-8-oxoguanine mismatch", + "S-farnesylcysteine", + "3-(6-O-cholinephosphoryl-alpha-D-glucopyranosyl)-1 2-dipalmitoylglycerol", + "[histone H3]-N6-methyllysine36", + "pro-peptide of B-type natriuretic peptide", + "trimethylamine-N-oxide", + "phospho-[delta opioid receptor]", + "prion protein 114-233", + "2-hydroxy-6-oxo-7-methylocta-2,4-dienoate", + "[germ cell-specific protein Vasa]-L-arginine", + "N-lignoceroylphytosphinganine", + "5-methylcytosine49 in tRNAGly precursor", + "1-testosterone", + "6-oxocineole", + "O-D-mannosyl-[alpha-dystroglycan]", + "MDM2", + "glycolaldehyde triphosphate", + "pentanesulfonate", + "an oleoyl-[acyl-carrier protein]", + "(9Z,12Z)-hexadeca-9,12-dienoyl-CoA", + "N-acylneuraminate", + "ferricytochrome c-553", + "2-arachidonoylglycerol", + "8-dehydro-3-deoxy-D-manno-octulosonic acid", + "citrus pectin", + "pro-form matriptase", + "phosphorylated protein TCF3", + "ganciclovir phosphate", + "[pyruvate dehydrogenase (acetyl-transferring)] phosphate", + "3-aminopropanoate", + "pyrogallol", + "(-)-alliin", + "progesterone receptor", + "deltaK protein", + "CMP-5-N-acetyl-7-O-acetyl-neuraminate", + "adenylyl-[L-glutamate:ammonia ligase (ADP-forming)]", + "pentanal", + "ubiquinol-2", + "hexacosanoyl-CoA", + "diguanosine 5',5'-P1,P4-tetraphosphate", + "S-ubiquitinyl-[E2 ubiquitin-conjugating enzyme UbcH7]-L-cysteine", + "Gpp", + "aminoacrylate", + "SufS", + "tropate", + "C-terminal fragment", + "phospho-MPK-7", + "[cullin 1]-N6-[NEDD8-protein]-yl-L-lysine720", + "methylethanolamine phosphate", + "[enterobactin-binding protein][side 1]", + "thiophosphate", + "leucodelphinidin", + "oxidized ferredoxin 1", + "actin L-histidine73", + "GDP-4-dehydro-alpha-D-rhamnose", + "withaferin A", + "propeptide of glucose-dependent insulinotropic polypeptide", + "[alpha-tubulin]-L-glutamate", + "metalloprotease/out", + "C4 antisense RNA", + "BAD-phosphate", + "(E)-4-Hydroxyphenylacetaldehyde oxime", + "uracil2634 in 25S rRNA", + "(1R,2S,4R)-limonene-1,2-epoxide", + "L-histidyl-tRNAHis", + "peptide 3-hydroxy-L-asparagine", + "fenthion sulfoxide", + "deoxythymidine", + "protein L-citrulline", + "4-O-beta-D-xylopyranosyl-D-xylose", + "dinucleotides", + "L-1-phosphatidyl-sn-glycerol", + "4-methylpent-2-enoyl-CoA", + "(8R)-hydroperoxyeicosatetraenoic acid", + "a 3'-ribonucleotide", + "alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man (1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D-GlcNAc diphosphodolichol", + "4-amino-2-methyl-phosphomethylpyrimidine", + "reduced renatured RNase A", + "5-(dihydroxymethyl)furan-2-carbaldehyde", + "aldouronic acid", + "pregnane-3,20-dione", + "lauroyl-[acyl-carrier protein]", + "2-hydroxy-ATP", + "sanguinarine", + "beta1-adrenergic receptor", + "Galectin-3", + "2,5-diamino-6-(D-ribosylamino)pyrimidin-4(3H)-one 5'-phosphate", + "6-acetyl-beta-D-galactoside", + "5-guanidino-2-oxopentanoic acid", + "fragments of peptidogylcan", + "rifamycin SV", + "N-(dimethylallyl)adenosine 5'-phosphate", + "[EmbR]-serine/threonine phosphate", + "[protein]-N6-D-ribulosyl-L-lysine", + "3,4-dihydrocoumarin", + "Manalpha(1-6)(Manalpha(1-3))Manalpha(1-6)(GlcNAcbeta(1-2)Manalpha(1 3))Manbeta(1-4)GlcNAcbeta(1-4)GlcNAc-1-Asn", + "mature interleukin-33", + "HClO", + "(1,4-beta-D-glucosyl)n-1", + "[MAP1B protein]-serine/threonine phosphate", + "mature epithelial sodium channel", + "IscS", + "GlcNAc-(1-4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala) diphosphoundecaprenol", + "diisopropyl phosphofluoridate", + "DNA-recombinase RecA", + "MMP-2", + "angiotensin I", + "3-(indol-3-yl)acrylate", + "PMEL17", + "a sphingomyelin", + "(R)-3-hydroxy-3-methyl-5-oxovaleric acid", + "cholesterol ester", + "[PknB]-serine/threonine phosphate", + "[alpha-synuclein]phosphate", + "L-glutamyl-tRNAGlu", + "L-3,4-dihydroxy-2-butanone-4-phosphate", + "reduced ferredoxin", + "1-acyl-glycerone 3-phosphate", + "3-(1-hydroxyethyl) bacteriochlorophyllide a", + "pocket protein p107", + "shortened rhamnogalacturonan oligosaccharide containing one 4-deoxy-4,5-unsaturated D-galactopyranosyluronic acid at the non-reducing end", + "(+)-neomenthol", + "protopanaxatriol aglycone", + "L-arginyl-[RGS4 protein]", + "sinigrin", + "1,2-diacyl-sn-glycero-3-phosphoethanolamine", + "TadF pseudopilin", + "N-linoleoylethanolamide", + "trioleoylglycerol", + "diazinon", + "2-oxo-L-gulonic acid", + "Ykt6", + "nucleoside 5'-triphosphate", + "D-glucose alpha-1-phosphate", + "3-hydroxypropionic acid", + "histone H4 N6-methyl-L-lysine20", + "2-oxoisohexanoate", + "beta-D-GlcNAc-(1->2)-[beta-D-GlcNAc-(1->4)]-alpha-D-Man-(1->3)-[beta-D GlcNAc-(1->2)-[beta-D-GlcNAc-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1 >4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc-N-Asn-[TIMP-1]", + "2-(Nomega-L-arginino)succinate", + "precorrin-3A", + "N1-methylpseudouridine54 in tRNA", + "L-sorbosone", + "(9S,10E,12Z,15Z)-9-hydroperoxy-10,12,15-octadecatrienoic acid", + "rpsT mRNA", + "monomethylated histone H3(K9)", + "phosphorylated peptide LRRKtide", + "(deoxyribonucleotide)m", + "UDP-2-acetamido-3-dehydro-2-deoxy-alpha-D-glucopyranose", + "[peptide chain release factor 1]-L-glutamine", + "glucosylceramide", + "4-anisaldehyde", + "Cu+[side 1]", + "phosphorylated HTP-1 protein", + "phosphorylated BubR1", + "1-oleoyl-2-linoleoyl-sn-glycero-3-phosphocholine", + "3-methyl-2-oxopentanoate", + "beta-D-glucuronosyl-(1,3)-chondroitin", + "[Yck2p]-S-palmitoyl-L-cysteine", + "guanine26 in elongator tRNAMet", + "dibenzothiophene-5,5-dioxide", + "5alpha-dihydroprogesterone", + "outer membrane protein A", + "N7-nonanoyldeacetoxycephalosporin C", + "cob(I)alamin-[alkylcobalamin reductase]", + "6-oxo-1,4,5,6-tetrahydronicotinate", + "3-chlorobenzoyl-CoA", + "hexatrans,tetracis-undecaprenyl diphosphate", + "a 3-oxo-DELTA4-steroid", + "(+)-epi-isozizaene", + "N-succinyl-2-amino-6-oxoheptanedioate", + "2-hydroxymethylglutarate", + "[chloroplastic fructose 1,6-bisphosphate aldolase isoform 3]-L-lysine", + "1L-myo-inositol-1-phosphate", + "[P-HLP]-serine/threonine phosphate", + "2-ethylhexan-1-ol", + "4-methylbenzoyl-CoA", + "2 H2O2", + "protein Bar1", + "diethylenetriamine", + "cellooligosaccharide", + "pyridine 2-carboxylic acid", + "3',5'-cyclic-AMP", + "6 H+", + "1-butanol", + "2 formaldehyde", + "2-propanone", + "4-O-methyl-alpha-D-glucuronic acid", + "membrane type-1 matrix metalloproteinase", + "N-acetyl-5-glutamyl phosphate", + "beta-D-ribofuranose", + "phosphorylated Smad2", + "1-O-galloyl-beta-D-glucose", + "(-)-kaurene", + "homopropargylglycyl-tRNALeu", + "(-)-perillyl alcohol", + "Glu", + "paxillin-L-tyrosine", + "a (2S)-flavan-4-one", + "3',4',5,7-tetrahydroxy-3-methoxyflavone", + "fructose-6-phosphate,2-kinase:fructose-2,6-bisphosphatase", + "(S,S)-gamma-glutamyl-(cis-S-1-propenyl)-thioglycine", + "cephalothin", + "PCNP protein", + "9-cis,11-trans-Octadecadienoate", + "CMP-NAC", + "host zinc-finger antiviral protein", + "ferricytochrome c2", + "selegiline", + "fucosylated Skp1 protein", + "3-hydroxyethyl chlorophyllide a", + "3-chlorocyclohexa-1,5-diene-1-carbonyl-CoA", + "phosphorylase kinase", + "21S rRNA pseudouridine2819", + "Adenosyl-L-methionine", + "pseudouridine1191 in yeast 18S rRNA", + "mature hepatic growth factor", + "phospho-PRAS40", + "(3R,6E)-nerolidol", + "4-amino-5-hydroxymethyl-2-methylpyrimidine", + "17-O-deacetylvindoline", + "cocaethylene", + "L-ribose", + "a 1-stearoyl-2-acyl-[glycerolipid]", + "6beta-hydroxylithocholate", + "transforming growth factor-beta glutamine", + "[protein-PIIGlnB]", + "furan 3-carboxylic acid", + "phospholipid olefinic fatty acid", + "phenethicillin", + "ganglioside GM1a", + "progesterone", + "[polycomb 2 protein]-N6,N6-dimethyl-L-lysine191", + "2-hydroxy-5-methylthio-3-oxopentenyl phosphate", + "grape glycoside", + "spore protein C", + "20alpha-hydroxypregn-4-ene-3,11-dione", + "Phe-Arg-primaquine", + "1'-hydroxyspheroidene", + "4,4'-diapolycopene-4,4'-dioate", + "8-sphingenine ceramide", + "MKK7", + "lymphocytic choriomeningitis virus glycoprotein precursor protein", + "N-ribosylnicotinamide", + "mitochondrial major Ca2+ extruding pathway Na+/Ca2+ exchanger", + "cytidine56 in tRNALeu(UAG)", + "[kinase Btk29]-L-tyrosine", + "vasodilator-stimulated phosphoprotein", + "poly R-478", + "phosphorylated histone H3", + "p23", + "15,173-seco-F430-173-acid", + "protein kinase C", + "N1-methyladenine9 in tRNAArg", + "4-fluoro-L-threonine", + "Glcbeta-Ser53-EGF-like domain of bovine factor IX(45-87)", + "4-methylbenzoic acid", + "neoagarohexaose", + "5,6-epoxyeicosatrienoic acid", + "kappa-neocarrahexaose", + "L-cystathione", + "2 ferricytochrome c 550", + "base1", + "4-amino-2-methyl-5-(phosphooxymethyl)pyrimidine", + "N4-(beta-N-acetyl-D-glucosaminyl)-L-asparagine", + "betulinic acid", + "maize internodes", + "S-geranylgeranyl-Rac GTPase", + "beta-D-glucuronosyl-(1-3)-N-acetyl-beta-D-galactosaminyl-(1-4)-beta-D glucuronosyl-proteoglycan", + "Ac-YSSVSRKLL-7-amido-4-methylcoumarin", + "reduced electron donor", + "taxuyunnanin C", + "(polyphosphate)n", + "(2R)-4-(dimethylsulfaniumyl)-2-hydroxybutanoate", + "pPR", + "1-benzofuran-5-ol", + "cholesteryl oleate", + "PIVQNLQGQMVH", + "splicing factor 3", + "phosphoribose", + "rhamnogalacturonan I oligosaccharide", + "phosphorylated Arabidopsis thaliana proteins AT2G26530", + "(2-amino-1-hydroxyethyl)phosphonate", + "glucooligosaccharides", + "4-hydroxy-3,3'-dichlorobiphenyl", + "mature cytochrome c peroxidase", + "D-2-hydroxyacid", + "D-Glucosaminylphosphatidylinositol", + "membrane protein SpoIVFA", + "UDP-D-galacturonic acid", + "7Me-GpppA-2'OMe-Cn", + "beta-hydroxybutyrate", + "ferricytochrome c550", + "(R)-ibuprofen", + "C12-carnitine[side 2]", + "phosphorylated MKK", + "1,2-dichloro-2-(glutathion-S-yl)-ethan-1-ol", + "alpha-maltose", + "1-aminooctane", + "VYS", + "a [histone H3]-N6,N6,N6-trimethyl-L-lysine27", + "phosphorylated mitogen-activated protein kinase kinase", + "gamma-Glu-Cys-NH2", + "7alpha,12alpha-dihydroxy-3-oxochol-4-en-24-oyl-CoA", + "2-(9Z-octadecenoyl)-glycerol", + "2 2-xylene", + "2 ferrocytochrome c3", + "GDP-4-dehydro-6-deoxy-alpha-D-mannose", + "2 L-cysteine", + "3,3,5-trimethylcyclohexan-1-one", + "25-kDa synaptosome-associated protein", + "6 H+[side 1]", + "ovalbumin", + "6-alpha-D-glucosylmaltose", + "unfolded tubulin", + "N-palmitoyl-sphingosylphosphorylcholine", + "XMP", + "myocillin", + "targeting sequence peptide", + "propeptide of thrombin", + "(2S,4S)-4-hydroxy-2,3,4,5-tetrahydrodipicolinic acid", + "platelet activating factor", + "2-dehydro-3-deoxy-D-galactonate 6-phosphate", + "electron-transferring flavoprotein", + "dolichyl disphosphate", + "3,N4-ethenocytosine-mismatched double-stranded DNA", + "16alpha,17-epoxy GA4", + "hypoxanthine-containing DNA", + "[(1->4)-beta-D-xylan]n", + "[protein]-3-O-(beta-D-xylosyl)-L-serine", + "4-vinylcyclohexene diepoxide", + "D-arabino-3-hexulose 6-phosphate", + "D-myo-phosphatidylinositol 4,5-bisphosphate", + "trans-2,3-epoxysuccinate", + "7,8-diaminononanoate", + "N-acetyl-lysine-alpha-tubulin", + "cationic channel subunit transient receptor potential channel 1", + "protochlorophyllide", + "UDP-N-acetyl-2-amino-2-deoxy-D-glucuronate", + "bovine heart cytochrome c", + "phosphorylated ERK2", + "abietadienol", + "alpha-tubulin", + "2 cytochrome c", + "axonal cytoskeleton protein", + "19-(4-hydroxyphenyl)nonadecanoyl adenylate", + "methyl group donor", + "1-(2-amino-2-deoxy-alpha-D-glucopyranoside)-1D-myo-inositol", + "NO2", + "phosphorylated phospholamban", + "biotin", + "4-(phosphohydroxy)-L-threonine", + "CC receptor tyrosine O-sulfate", + "[dipeptide-binding protein DppA][side 1]", + "(S)-cis-N-methylcanadine", + "3 di-D-fructofuranose 1,2':2,3' dianhydride", + "protein-L-arginine", + "3,4-dihydroxy-trans-cinnamate", + "4 diphosphate", + "phytyl-chlorophyll", + "raffinose/in", + "11-cis-retinol-[cellular-retinol-binding-protein]", + "diethylphosphate", + "InsL3 fragments", + "15-ketoprostaglandin D2", + "glutathione-methylglyoxal hemithioacetal", + "[E2 ubiquitin-conjugating enzyme cullin-4A]-S-ubiquitinyl-L-cysteine", + "C2b", + "cefmetazole/out", + "cyclo-L-Trp-Xaa", + "neomycin B", + "a dimycocerosyl phthiocerol", + "L-sorbose 1-phosphate[side 2]", + "fluoroacetyl-CoA", + "Mg2+[side 1]", + "[antifreeze glycoprotein]-(O-3-(alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-alpha-D GalNAc-(1->)))-L-serine", + "4-hydroxybenzoyl-adenylate", + "a catechol", + "(25R)-3-oxocholest-4-en-26-oate", + "cis-3-hydroxy-L-proline", + "all-trans-phytofluene", + "ferricytochrome b5", + "iota-carrageenan", + "Rad53p", + "2-oxoglutarate", + "4-nitrophenyl palmitate", + "(2R,3S)-2-hydroxybutane-1,2,3-tricarboxylate", + "(R)-2-hydroxypropylphosphonate", + "an N-terminal-L-valyl-[protein]", + "4-deoxy-L-threo-5-hexosulose-uronate", + "chlorogenate", + "human cardiac sodium channel NaV1.5", + "phosphorylated vimentin", + "3-hydroxy-5-phosphonooxypentane-2,4-dione", + "DELTA4-3-oxosteroid", + "(3S,4R)-3',4-dihydroxy-L-isoleucine", + "1-naphthaleneacetic acid", + "mimosine", + "3-hydroxy-kynurenine", + "dihydrourocanate", + "L-2-hydroxy-4-methylthiobutanoic acid", + "5-carbamidamido-2-oxopentanoate", + "D-mannose", + "cortisone", + "ADP-ribose1'',2''-phosphate", + "4-methylthio-2-oxobutanoic acid", + "2,3-monoepoxysqualene", + "(2E)-2-hexadecenoyl-CoA", + "galactobiose", + "ethylene glycol", + "membrane form variant surface glycoproteins", + "chlorophyllide b", + "UDP-xylose", + "N-terminal pro-peptide", + "2-O-alpha-mannosyl-D-glycerate [side 1]", + "pro-kallikrein 11", + "phytosphinganine", + "protein S-methyl-L-cysteine", + "[Notch]-fucose", + "complement C4", + "methyl alpha-D-glucoside[side 1]", + "O-acetyl-L-homoserine", + "prepilin PilC", + "ManNAc", + "alpha1-adrenergic receptor", + "glycyrrhetinic acid", + "3-(O-geranylgeranyl)-sn-glycerol 1-phosphate", + "alpha-D-galactosyl sn-glycerol 3-phosphate", + "delta and notch-like epidermal growth factor-related receptor", + "5-methylcytosine48 in tRNAAla(UGC)", + "iron coprogen/out", + "phosphorylated dopamine D3 receptor", + "3,12-dioxo-5-beta-cholan-24-oic acid", + "cytosine48 in tRNALeu(UAG)", + "pivalate", + "phosphorylated NDUFS4 subunit of complex I", + "tRNATyr", + "N-formylmaleamic acid", + "VGCC", + "[zinc-binding protein][side2]", + "adenine", + "phosphorylated NFAT2 protein", + "[cobalamin-binding protein][side 1]", + "3 ubiquinone", + "NMNH", + "D-cellobiose 6'-phosphate[side 2]", + "obtusifoliol", + "(3S)-2,3-epoxy-2,3-dihydrosqualene", + "Escherichia coli O7 antigen bound to undecaprenyl diphosphate", + "N-terminal-N-methyl-Pro-Pro-Lys-[protein]", + "indoxyl", + "cathepsin L", + "amylin peptide fragments", + "cyclohexan-1,4-dione", + "Gln3", + "stemar-13-ene", + "S-formylglutathione", + "cobalt-factor III", + "mevalonate 5-phosphate", + "sucrose", + "diethylstilbestrol 4-semiquinone", + "2-epi-5-epi-valiolone 7-phosphate", + "hypoxia-inducible factor-alpha-trans-4-hydroxy-L-proline", + "[histone-H3]-dimethyllysine4", + "2-(1,2-epoxy-1,2-dihydrophenyl)acetyl-CoA", + "6-acetamido-3-oxohexanoate", + "malonyl-CoA methyl ester", + "ppG", + "delphinidin 3-O-[2-O-(4-coumaroyl)-alpha-L-rhamnosyl-(1->6)-beta-D-glucoside]", + "3 formaldehyde", + "1-acyl-glycerone phosphate", + "lipid", + "phospho-tyrosinyl-cortactin", + "mesaconate", + "acyl carrier protein", + "phosphonooxypyruvate", + "N-cerotoylsphingosine", + "pseudolaratriene", + "an (E)-omega-(methylthio)alkanal oxime", + "acetaldehyde", + "(3beta,24R)-ergosta-5,7-dien-3-ol", + "4-diphosphocytidyl-2C-methyl-D-erythritol 2-phosphate", + "(2S)-2-nitrosobutanedioate", + "3-chlorobutyrate", + "beta-D-galactosyl-1,3-beta-D-galactosyl-1,4-beta-D-xylosylprotein", + "3-(1H-indol-3-yl)-2-oxopropanoate", + "prostaglandin E2", + "5-methyl-3-oxo-4-hexenoyl-CoA", + "3-oxopropionate", + "UDP-2-acetamido-3-amino-2,3-dideoxy-D-glucuronic acid", + "5S rRNA precursor", + "5-Oxopent-3-ene-1,2,5-tricarboxylate", + "3-hydroxy-9,10-seconandrost-1,3,5(10)-triene-9,17-dione", + "(-)-jasmonate", + "7alpha,12alpha-dihydroxy-5beta-cholestan-3-one", + "(3,5-dihydroxyphenylacetyl)-CoA", + "heparin-binding EGF-like growth factor", + "annexin A1", + "GGAK", + "electron-transfer flavoprotein EtfA-EtfB", + "2-methoxy-6-(all-trans-octaprenyl)phenol", + "1 2-diacyl-3-O-[alpha-D-galactosyl-(1->6)-beta-D-galactosyl]-sn-glycerol", + "methylaminomethyl 2-thiouridine34 in tRNALys", + "fatty acyl CoA[side 2]", + "Gal-beta-(1-4)-Glc", + "1,3-alpha-D-mannosyl-1,2-alpha-D-mannosyl-1 2-alpha-D-mannosyl-D-mannose", + "L-idonate", + "(R)-all-trans-13,14-dihydroretinol", + "N1-methyladenine57/N1-methyladenine58 in tRNA", + "4'-hydroxy-2,3',4-trichlorobiphenyl", + "AID protein", + "butanal", + "alcadein", + "5-fluoro-5,6-dihydrouracil", + "1D-myo-inositol 1,2,3,5,6-pentakisphosphate", + "(3Z)-phycoerythrobilin", + "bisulfite", + "beta-phenylethanal", + "2 [reduced NADPH-hemoprotein reductase]", + "phenylacetic acid", + "beta-apo-10'-carotenal", + "6 AMP", + "peptidyl-tRNA", + "(3R)-hydroxyacyl-CoA", + "phospholipase C gamma-L-tyrosine phosphate", + "8-azaguanine", + "acylic acid", + "methicillin-resistant Staphylococcus aureus cell wall", + "[EF-G translation factor]-serine/threonine phosphate", + "ROCK1", + "yeast a-factor mating pheromone C-terminal S-farnesyl-L-cysteine methyl ester", + "dTDP-beta-L-mycarose", + "SAMP1", + "ginsenoside Re", + "cAMP/in", + "5-Guanidino-2-oxopentanoate", + "amyloid beta precursor protein", + "(ADP-D-ribosyl)n+1-Rab5", + "1,2-diacyl-sn-glycero-3-phosphatidylcholine", + "1-benzothiophene-6-ol", + "GlnB", + "2 1,8-octanedithiol", + "7,12-dimethylbenz[a]anthra-3,4-diol-1,2-epoxide", + "cyanidin 3-O-(6-O-(4-coumaroyl)-beta-D-glucoside)", + "1-fluoro-2,4-dinitrobenzene", + "oxidized glutaredoxin", + "5 reduced acceptor", + "7-(3-methylbut-2-enyl)-cyclo-L-Trp-L-Trp", + "Man9GlcNAc2", + "phosphorylated catchin", + "alpha-conglutin", + "human plasminogen", + "20beta-dihydrocortisol", + "(E)-5-(2-bromovinyl)-2'-deoxyuridine 5'-phosphate", + "HS-CoM", + "beta-Leu", + "1-(3-C-ethynyl-beta-D-ribopentofuranosyl)uridine", + "[ventricular isoform of myosin regulatory light chain MLC2v] phosphate", + "uridine2479 in 23S rRNA", + "mas-related G-protein-coupled receptor X1", + "octanoate", + "trans-farnesyl triphosphate", + "electron-transfer flavoprotein", + "S-geranylgeranyl-Cdc42", + "UDP-2-N-((3R)-3-hydroxyarachidonoyl)-3-O-((3R)-3-hydroxymyristoyl) alpha-D-glucosamine", + "myosin heavy chain kinase", + "8-oxo-7,8-dihydroguanine:Cyt-DNA", + "4-hydroxynon-2-enoic acid", + "TDP-3-dimethylamino-4,6-dideoxy-alpha-D-glucopyranose", + "ClpP protease", + "Staphylococcus aureus cells", + "indole-3-acetyl-beta-1-D-glucoside", + "2R,3S,4S-cis-leucoanthocyanidin", + "D-arginine", + "interferon gamma", + "(-)-bursehernin", + "endostatin", + "myosin light chain 2", + "Rap1A-cysteine", + "a 1-oleoyl-2-acyl-[glycerolipid]", + "insulin beta-chain", + "N-acetyl-D-tyrosine", + "LIX", + "trans-3,4-dihydroxycyclohexa-1,5-dienecarbonyl-CoA", + "diosgenin", + "isopenicillin", + "FlaB2 protein", + "uridinyl-tRNA", + "dADP", + "2 (+)-pulegone", + "mevalonate 3,5-bisphosphate", + "isoxazolin-5-one", + "erythromycin", + "a galactosylceramide", + "rhizobitoxine", + "chemotaxis receptors McpT L-glutamate methyl ester", + "4-hydroxy-6-methylpretetramide", + "1-docosahexaenoyl-sn-glycerol 3-phosphate", + "N2-dimethylguanine26/N2-methylguanine27 in tRNA", + "(8E,10R,12Z)-10-hydroperoxy-8,12-octadecadienoate", + "N-acetyl-D-galactosaminyl-alpha-(1->4)-N-acetyl-D-galactosaminyl-alpha (1->3)-N,N'-diacetyl-alpha-D-bacillosaminyl-diphospho-tritrans heptacis-undecaprenol", + "2,4-dinitrophenol", + "3,5-diiodothyronine", + "a [lipoyl-carrier protein]-N6-octanoyl-L-lysine", + "(4R,5S)-5-[(1S,2R)-1-carboxy-2-hydroxypropyl]-3-[[(3S 5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl]-4-methyl-4 5-dihydro-1H-pyrrole-2-carboxylic acid", + "3-(2,3-dihydroxyphenyl)propanoate", + "oligo(3-hydroxyalkanoate)", + "adenine in mRNA", + "fumitremorgin B", + "[histone H3]-N6-methyl-L-lysine79", + "alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->3)-N-acetyl-beta-D galactosamine", + "azithromycin 2'-O-phosphate", + "nucleoside 5'-phosphate", + "thiamine diphosphate", + "a ribonucleoside 5'-phosphate", + "5-O-(4-coumaroyl)shikimate", + "L-phosphinothricin", + "phosphorylated BcSak1", + "beta-pinene", + "IvaP I9 domain", + "(S)-2,3-dihydroxypropane-1-sulfonate", + "alpha1-antitrypsin null", + "DNA containing an abasic site", + "2,4,6-trihydroxybenzophenone", + "Collagen type III", + "(2S,3S)-2-hydroxybutane-1,2,3-tricarboxylate", + "17alpha-hydroxywithaferin-A-27-beta-D-glucoside", + "4,5-Dihydroxyphthalate", + "octadec-6,9,12,15-tetraenoic acid", + "phospho-cidofovir", + "methyl-histone 3 L-lysine 36", + "trans-1,2-dihydrobenzene-1,2-diol", + "N1-methyladenine in ssDNA", + "tellurium", + "uracil in single-stranded DNA", + "TDP-4-dehydro-2,3,6-trideoxy-D-glucose", + "D-Fructose 1,6-bisphosphate", + "sulfogalactosylceramide", + "mitroxantrone", + "[endothelial nitric oxide synthase] phosphate", + "GSH-conjugated prostaglandin A2/out", + "5-deoxy-5-chloroadenosine", + "S opsin", + "magnesium-protochlorophyllide", + "verapamil/in", + "streptococcal mitogenic exotoxin Z", + "alpha1-microglobulin", + "N-acetyl-beta-D-galactosamine-6-O-sulfate", + "[heat stable phosphocarrier protein HPr]-Npi-phospho-L-histidine", + "(1->6)-beta-D-galactooligosaccharide", + "apiforol", + "Fuc-alpha-(1-2)-Gal-beta-(1-4)-sorbitol", + "N2-(2-carboxyethyl)-L-arginine", + "3,4-dimethylphenol", + "beta-estradiol 3-sulfate", + "reduced 2,6-dichlorophenolindophenol", + "beta-D-Glcp-(1->4)-alpha-L-Rhap-(1->3)-beta-D-Glcp", + "phytyl diphosphate", + "glycyl-tRNAGly", + "1D-myo-inositol 1,2,3,4,5,6-hexakisphosphate", + "nonane-4,6-dione", + "[histone-H3]-trimethyllysine4", + "2-chloro-5-methylmaleylacetate", + "D-Tyr-tRNA", + "(ADP-D-ribosyl)n+1-acceptor", + "3-vinyl-8,12-diethyl-bacteriochlorophyllide d", + "4-O-[(1-D-ribitylphospho)n-(1-D-ribitylphospho)-(2R)-1-glycerophospho] N-acetyl-beta-D-mannosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl diphospho-ditrans,octacis-undecaprenol", + "methylhistidine", + "5'-dTMP", + "ADP-D-ribose 1''-phosphate", + "peptide/in", + "imipenem", + "Ca2+/cis", + "tissue necrosis factor alpha", + "5-hydroxyferulic acid", + "glial fibrillary acidic protein L-citrulline", + "[ventricular isoform of myosin regulatory light chain MLC2v]", + "O-ureidohomoserine", + "a 5'-phospho-[mRNA]", + "zeinoxanthin", + "1-phenylethanone", + "1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine", + "protein-dithiol", + "[DNA-directed RNA polymerase II]", + "[E1 ubiquitin-activating enzyme]-L-cysteine", + "16000 Da Vpg", + "2,4-dinitrophenyl-S-glutathione[side 2]", + "2,5-diamino-6-(5-phospho-D-ribosylamino)pyrimidin-4(3H)-one", + "2-O-(alpha-D-glucosyl)-D-glycerate", + "UDP-alpha-D-galactose", + "lipo-oligosaccharide/out", + "nucleoside 3'-phosphate", + "2 isopentenyl diphosphate", + "6-dehydro-Virginiae butanolide-A", + "1'-hydroxytorulene", + "2'-deoxynucleoside 5'-triphosphate", + "ginsenoside F2", + "D-glucaric acid", + "ferrocene-labeled dideoxy-UTP", + "dalpatein", + "a [methyl-Co(III) methanol-specific corrinoid protein]", + "5alpha-cholesta-7-en-3beta-ol", + "[histone H4R3]-Nomega,Nomega-dimethyl-L-arginine", + "2-methyl phenylacetonitrile", + "2-methyl-1-pyrroline", + "hexa-alpha-(1->5)-arabinofuranoside", + "(-)-limonene", + "(+)-(R)-germacrene A", + "2-methoxyestradiol", + "(3S)-3-amino-3-(3-chloro-4 5-dihydroxyphenyl)propanoyl-[peptidyl-carrier protein SgcC2]", + "(+)-secoisolariciresinol", + "CXCL8", + "taurocholate/in", + "5-pyridoxate", + "L-4-hydroxythreonine", + "proform epithelial sodium channel", + "norleucine", + "[D-Gal-(1-3)(D-GlcUA-(1-2))-alpha-D-Man-(1-3)-alpha-D-Gal]n", + "[1,4-(N-acetyl-beta-D-glucosaminyl)]n+1", + "cholesta-8,24-dien-3beta-ol", + "VAMP 2", + "Na,K-ATPase alpha subunit", + "eEF2 N-(ADP-D-ribosyl)diphthamide", + "alpha-D-galactose", + "tapioca root starch", + "5-hydroxythiophene-2-carbonyl-CoA", + "phosphorylated Munc-18", + "DL-threonine", + "1-pyrroline-4-hydroxy-2-carboxylate", + "phosphorylated hyperpolarization-activated cyclic nucleotide-gated channel 1 protein", + "2 Fe(II)", + "taxa-4(5),11(12)-diene", + "N-acetylmuramate[side 1]", + "streptidine 6-phosphate", + "(2E,4E,6E)-7-hydroxy-4-methylhepta-2,4,6-trienal", + "Lewis antigen", + "16 reduced ferredoxin [iron-sulfur] cluster", + "(31S)-3-(1-hydroxyethyl) bacteriochlorophyllide c", + "peptide fragment 307-709", + "deacetylcephalosporin C", + "a [histone H3]-N6,N6,N6-trimethyl-L-lysine36", + "5-hydroxy-alpha-gurjunene", + "L-Gln/out", + "pregn-4-ene-3,11,20-trione", + "allantoate", + "Pseudomonas aeruginosa O11 antigen bound to undecaprenyl diphosphate", + "phospho-tyrosinyl-ezrin", + "N-acetyl-D-glucosamine-6-phosphate", + "4-coumaroylagmatine", + "cyclohexa-1,5-diene-1-carboxyl-CoA", + "glycerol-3-phosphate/out", + "CCN5", + "4-hydroxy-2-oxovalerate", + "L-usnic acid", + "cobalt-precorrin-3A", + "reduced electron transfer protein", + "major outer membrane protein F", + "choline-O-sulfate", + "Grb2-associated binding protein 1", + "leutinising hormone alpha chain", + "D-amino acid amide", + "bacterial lipoprotein", + "3-O-[alpha-L-Rha-(1->4)-[alpha-L-Rha-(1->2)]-beta-D-Glc]diosgenin", + "(R)-vicianin", + "levans", + "formyl-methionyl-leucine-phenylalanine/out", + "foot-and-mouth disease virus protein VP1", + "4-hydroxyandrostenedione", + "deoxythymidine monophosphate", + "YTPKA", + "lactyl-2-diphospho-5'-guanosine", + "(25S)-5beta-spirostan-3beta-ol 3-O-beta-D-glucoside", + "alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man (1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha D-Man-(1->6)]-alpha-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc-2 pyridylamine", + "scyllo-inosose", + "protein tyrosine phosphatase SHP-1", + "active protease C1s", + "[c-Cbl]-L-tyrosine phosphate", + "D-apiitol", + "(R)-benzoin", + "2,3-(trans)-(+)-gallocatechin", + "4-oxalocrotonate", + "estrogen", + "soluble interleukin 6 receptor", + "guanidinoacetate", + "macrophage factor H-receptor CR3", + "testololactone", + "1-hydroxy-1,2-dihydrorhodopin", + "3-(4-hydroxyphenyl)propionic acid", + "cytosine48 in tRNAGln(UUG)", + "[heat shock protein 10]-L-lysine", + "histidine-tagged Xpr-green fluorescent protein", + "uracil20a in tRNA", + "21-hydroxy-5beta-pregnane-3,20-dione", + "(ribonucleotide)n-2',3'-cyclophosphate", + "phosphorylated m opsin", + "penicillin V", + "activated Rho-activated kinase", + "(31RS)3-(1-hydroxyethyl) bacteriochlorophyllide d", + "pp5'N(3'ppp5'N)n", + "3 acceptor", + "5,6,7,8-tetrahydrofolate", + "n Na+[side 1]", + "7beta-hydroxy-12-keto-5beta-cholanoic acid", + "MAVS", + "4-Hydroxy-2-oxoglutarate", + "IFN-inducible T-cell alpha-chemoattractant", + "23S rRNA uridine746", + "5-oxoprolyl-CCL2", + "melibiose", + "gp41", + "4-benzoylpyridine", + "[Escherichia coli histidine kinase ArcB]-N-phospho-L-histidine", + "7Me-GpppA-Cn", + "acarbose", + "naphthazarin", + "guanine9 in tRNAGlyGCC", + "alpha-Kdo-(2->4)-alpha-Kdo-(2->6)-lipid A", + "4-hydroxyestradiol", + "cytosine48 in tRNALys(UUU)", + "(S,S)-S-adenosyl-L-methionine", + "alpha-D-glucosyl-protein", + "phosphonoacetate", + "Phenylpyruvate", + "11 NADP+", + "3-oxo-valeryl-[acyl-carrier protein]", + "[oxidized NADPH-hemoprotein reductase]", + "Fuc-alpha-(1-2)-Gal", + "cis-3,4-dehydroadipyl-CoA", + "N-terminal-trimethyl-PPKRIA-[RCC1]", + "2'-O-dimethylguanine26 in elongator tRNAMet", + "2,3,5,6-tetrachlorohydroquinone", + "truncated apoptosis-inducing factor", + "all-trans-10'-apo-beta-carotenal", + "matrix-metalloproteinase-9", + "phosphorylated phosphorylase b", + "D-Galactose 6-phosphate", + "CCL11(3-74)", + "lathosterol", + "CDP-4-dehydro-3,6-dideoxy-D-glucose", + "cyclin D", + "histone H3 N6,N6,N6-trimethyl-L-lysine36", + "Nalpha-acetyl-Ser-Gly-Arg-Lys", + "tartrate resistant acid phosphatase", + "3-(2-hydroxyphenyl)propionic acid", + "trimyristin", + "phosphorylated cyclin L2", + "2'-deoxyxanthosine", + "bisdemethoxy-curcumin phenolic beta-D-monoglucuronide", + "3,4-dihydroxy-5-hexaprenylbenzoate", + "CDCP1", + "amyloid beta peptide1-40", + "latanoprost/in", + "(E)-[4-hydroxyphenylacetaldehyde oxime]", + "1-aci-nitro-2-(4-hydroxyphenyl)-ethane", + "cadaverine", + "(11aS,11a'S)-8,8'-[pentane-1,5-diylbis(oxy)]bis(7-methoxy-1,2,3 11a-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-5-one)", + "D-mandelonitrile", + "hypoxia-inducible factor-alpha-L-proline", + "tamoxifen N-oxide", + "UDP-N-acetyl-D-glucosamine 3'-phosphate", + "(3E)-3-decaenoyl-CoA", + "peptidophosphogalactomannan", + "2 peptides of 140 kD and 65 kD", + "1,6-tuliposide D", + "Xaa", + "pro-CD109", + "cefadroxil", + "4-hydroxybenzoyl-[4-hydroxyphenylalkanoate synthase]", + "[Stat5B]-L-tyrosine", + "Asp-tRNAAsn", + "4-hydroxyphenylpyruvate", + "a (Z)-3-oxooctadeca-11-enoyl-[acyl-carrier protein]", + "2-dehydro-3-deoxy-6-phospho-D-galactonate", + "cholest-5-ene-3beta,25-diol 3-sulfate", + "a 12'-apo-carotenal", + "O,O-diethylphosphorodithioate", + "(S)-2,3-oxidosqualene", + "2-N,3-O-bis[(3R)-3-hydroxytetradecanoyl]-beta-D-glucosaminyl-(1->6)-2-N 3-O-bis[(3R)-3-hydroxytetradecanoyl]-alpha-D-glucosaminyl 1-phosphate", + "a 3-oxosteroid", + "sn-glycerol-3-phosphate", + "2 adenosine 3',5'-bisphosphate", + "dimethylglycine", + "cleaved Rac8", + "L-Arg-[calreticulin]", + "N-acetyl-D-asparaginate", + "(4S)-4-hydroxy-L-isoleucine", + "amyloid beta peptide1-42", + "NDP-aldose", + "ganciclovir", + "N-propionyl-D-alanine", + "N-acetyl-D-glucosaminylamine", + "mycolipanoyl-[mycolipanoate synthase]", + "[Sox6 protein]-L-lysine", + "mitogen-activated protein kinase kinase-6", + "dicyanocobinamide[side 2]", + "trypanothione disulfide", + "4-(dimethylamino)azobenzene", + "phospho-JNK", + "3-hydroxyphenylacetate", + "(ADP-D-ribosyl)n-tyrosine kinase Syk", + "taxa-4(20),11-dien-5alpha-ol", + "gentiotriose", + "N-benzylformamide", + "3-[(3aS,4S,7aS)-7a-methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoate", + "2-cresol", + "proteoglycan core protein with xylosylserine", + "poly(ADP-ribose)", + "(R)S-lactoylglutathione", + "chloride intracellular channel protein 1", + "acetylated chitosan oligosaccharide", + "12-hydroxy-oleate", + "Parathyroid hormone", + "inulopentaose", + "poly(sialic) acids or oligo(sialic) acids containing alpha-2,8-linked N-acetylneuraminic acid", + "2'-O-methylguanosine18 in tRNATyr", + "putidaredoxin", + "D-glycero-D-alpha-manno-heptose 1-phosphate", + "tert-butyl methyl sulfide", + "2-methyl-beta-alanine", + "(S)-2,3-epoxysqualene", + "oxidized lipoamide", + "N-terminal-N-methyl-Ser-Pro-Lys-[protein]", + "prostaglandin F2alpha/in", + "2-[(3S)-3-carboxy-3-aminopropyl]-L-histidine-[translation elongation factor 2]", + "oligosaccharide acceptor", + "methotrexate-phenylalanine", + "C18:0-ceramide", + "cobalt-precorrin-2", + "puf mRNA", + "prepilin PilE1", + "pilin EpdB", + "chondroitin sulfate", + "wybutosine37 in tRNAPhe", + "hyaluronic acid", + "glucobiose", + "phospho-PA3347", + "3-phosphatidyl-1'-(3'-O-L-lysyl)glycerol", + "N2-dimethylguanine26/N2-dimethylguanine27", + "2-undecanone", + "codeine", + "(24S)-24-hydroxycholesterol", + "archaellin", + "phosphorylated Src protein", + "[chaperone Tig]-Nomega-phospho-L-arginine", + "5,7,4'-trihydroxy-3'-methoxyflavone", + "(9R,10S,13R)-trihydroxy-11E-octadecenoic acid", + "interleukin-1", + "syn-halima-5,13E-dienyl diphosphate", + "L-Arg-tRNA", + "D-mannose 6-phosphate", + "Ni2+", + "3-oxo-6-octadecenoyl-[acyl-carrier protein]", + "D-p-hydroxyphenylglycine", + "N-acetyl-alpha-D-glucosamine", + "stearoyl-[acyl carrier protein]", + "3alpha,17beta-dihydroxy-5alpha-androstan", + "D-xylono-1,4-lactone", + "Manalpha(1-2)Manalpha(1-3)[Man(1-6)]ManbetaGlcNAc-betaGlcNAc", + "[Wnt5a]-O-(9Z)-hexadec-9-enoyl-L-serine", + "D-Mannose 6-phosphate", + "iron(III) hydroxamates/in", + "Src", + "[peptide chain release factor 1 or 2]-L-glutamine", + "a [histone H3]-L-lysine27", + "5-methyldeoxycytidine diphosphate", + "adenosine 2',5'-phosphate", + "Fuc-alpha-(1-3)-Gal-beta-(1-4)-Glc", + "Rho", + "Serotonin", + "(R)-2-chloropropionic acid", + "Glycerone phosphate", + "S-amino-L-glutathione", + "integrin subunit alpha11", + "3-methylbutanal", + "vellosimine", + "big-endothelin-1", + "2'-deoxy-D-ribosyl-uracil", + "C3.19,S21-cyclocypemycin(1-18)-L-Ala-L-Leu-N-thioethenyl-L-valinamide", + "[E2 ubiquitin-conjugating enzyme cullin-3]-L-cysteine", + "nonpolar amino acid/in", + "2-dehydro-D-xylose", + "hematin", + "5-methylcytosine48 in tRNAVal(UAC)", + "nicotinic acid dinucleotide", + "chymotrypsin", + "(25R)-5beta-cholestane-3alpha,7alpha,12alpha,26-tetraol", + "L-Phe-L-Arg", + "2-oxogluconate", + "(2R,4S)-2-[(R)-carboxy(2-phenylacetamido)methyl]-5,5-dimethyl-1 3-thiazolidine-4-carboxylic acid", + "R-alanine", + "isopulegol", + "3',4',5'-O-trimethyltricetin", + "hydrolyzed protein", + "biopterin", + "hepatitis C virus core protein", + "methyl gallate", + "an N-terminal-L-seryl-[histone H4]", + "4-O-beta-D-galactopyranosyl-D-fructoside", + "2,5-Dihydroxyphenylacetate", + "sphingosine-1-phosphate", + "dolichyl phosphate D-mannose", + "human recombinant B-cell activating factor", + "Laminin", + "phosphorylated PAF-C protein", + "UDP-3-N-(3-hydroxytetradecanoyl)-2-acetamido-3-amino-2 3-dideoxy-alpha-D-glucopyranose", + "Flavivirus sp. polyproteins", + "[beta-tubulin]-L-arginine", + "4-hydroxycinnamoyl-CoA", + "cytosine50 in tRNAGly(CCC)", + "5-methylcytosine48 in tRNAGly precursor", + "N-palmitoyl-DL-dihydrosphingosine", + "vancomycin", + "inactive factor V heavy chain", + "Ac-MLGPEGGRWG", + "Manalpha(1-6)(Manalpha(1-2)Manalpha(1-3))Manbeta(1-4)GlcNAcbeta(1 4)GlcNAc", + "dihydrostreptomycin 6-phosphate", + "1-hexadecyl-2-acetyl-sn-glycerol-3-phosphocholine", + "peptidyl-glutamate", + "Cbz-L-Gln-Gly", + "Phaseollidin", + "DADEYLIPQQG", + "[xylose-binding protein][side 1]", + "ethyl pyridine-3-carboxylate", + "[elongation factor 2]", + "dGTP", + "an N-terminal-L-methionyl-L-alanyl-[protein]", + "protein NDUFS3", + "2-keto fatty acid", + "1-deoxy-D-threo-hexo-2,5-diulose 6-phosphate", + "cerebroside", + "(2S)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline", + "mature matriptase", + "[O-phospho-tau protein]", + "4'''-demalonylsalvianin", + "(9Z,12Z)-hexadeca-9,12,15-trienoyl-CoA", + "3-ethoxy-4-hydroxybenzoylformate", + "[glutamate dehydrogenase]-N6-acetyl-L-lysine", + "activated protease-activated receptor 1", + "1,2-dipalmitoyl-sn-glycero-3-phosphoethanolamine", + "5'-hydroxydihydroquercetin", + "5'-phosphotyrosyl-linked topoisomerase II-DNA complex", + "[reduced NADPH-hemoprotein reductase]", + "D-4-hydroxyphenylglycine", + "nisin", + "an N-terminal L-methionyl-L-asparaginyl-[protein]", + "D-galactose-[D-galactose-binding protein AcbH][side 1]", + "adenine645 in 25S rRNA", + "Notch", + "an N-terminal-Nalpha-acetyl-lysinyl-[androgen receptor]", + "guaran", + "pCcollagen", + "trans-Golgi network integral membrane protein 2", + "Varicella-Zoster virus IE63 protein", + "5alpha,6beta,17alpha,27beta-tetrahydroxywithanolide", + "2 D-glucose", + "ferrocytochrome c(H)", + "9alpha-hydroxy-1,4-androstadiene 3,17-dione", + "(3S,5S)-carbapenam 3-carboxylate", + "3-amino-4,7-dihydroxycoumarin", + "7-deoxyloganetin", + "ferrioxamine B/in", + "complement component C3b", + "D-ornithine", + "bacteriochlorophyll a", + "[RsbV]-serine/threonine", + "5beta-cholestane-3alpha,7alpha,26-triol", + "6alpha-hydroxyprogesteron-6-O-alpha-D-glucuronate", + "1-O-fluoro-beta-D-xylopyranose", + "Arg-Pro-Pro-Gly-Phe-Ser-Pro-Phe-Arg", + "stearate", + "2'-O-methylcytidine32/2'-O methylguanosine34 in tRNALeu", + "p70S6K", + "3-methyl phenylacetonitrile", + "(+)-menthofuran", + "3-epi-1alpha,23,25-trihydroxy-24-oxo-vitamin D3", + "N-cyclohexylformamide", + "barbiturate", + "24,25,26,27-tetranor-1alpha,23-dihydroxyvitamin D3", + "Nalpha-acetyl-[silencing factor Sir3p]", + "6-(2-[N-acetyl-beta-D-glucosaminyl]-alpha-D-mannosyl)-beta-D-mannosyl-R", + "renierapurpurin", + "versican", + "complement component C4", + "2-keto-3-deoxy-6-phosphogalactonate", + "9-methylnorharman", + "L-cystine", + "luteolin 7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide]", + "(-)-medicarpin", + "cytarabine", + "an N-terminal N-acetyl-L-alanyl-[L-A virus major coat protein]", + "ILK1", + "8-ethyl-12-methyl-bacteriochlorophyllide", + "labda-8(17),12,14-triene", + "insulin chain B", + "C-terminal fragments of neuropeptide Y", + "Hsp21 L-methionine", + "O2", + "heme/in", + "DL-tyrosine", + "1,3-alpha-D-mannosyl-1 2-(N-acetyl-alpha-D-glucosaminyl-alpha-D-mannosyl)-1 2-alpha-D-mannosyl-D-mannose", + "2 peptides", + "candesartan", + "H-protein-S-aminomethyldihydrolipoyllysine", + "2-(4-N-acetylaminophenyl)-1,3-benzothiazol-6-ol", + "(8Z,11Z,14Z)-eicosa-8,11,14-trienoyl-[glycerolipid]", + "21-hydroxy-5beta-pregnane-20alpha-ol-3-one", + "[beta-catenin]-L-lysine", + "butyloxycarbonyl-L-Gln-L-Ala-L-Arg", + "2-deoxy-alpha-D-ribose 1-phosphate", + "lysophosphatidic acid", + "human sensitive prion protein Sc", + "3-dehydroquinate", + "phloroisobutyrophenone", + "GDP-6-deoxy-D-talose", + "28000 Da fragment", + "D-Lys", + "(11E)-tetradecenoate", + "(5Z,8Z,10E,14Z)-(12S)-12-hydroperoxyeicosa-5,8,10,14-tetraenoate", + "N2-(1,3-dicarboxypropyl)-L-ornithine", + "colicin E1", + "phospholipase C gamma-L-tyrosine", + "cell adhesion molecule 1", + "a folded polypeptide", + "pre-tRNACys", + "a (3Z)-alk-3-enoyl-CoA", + "2-hydroxy-3-oxopropane-1-sulfonate", + "pyridoxine", + "HBrO", + "dextrin", + "phosphorylated Lck", + "(3S)-3-hydroxycyclocitral", + "complement C4-bound C2 zymogen", + "4-(hydroxymethyl)-2-furancarboxaldehyde phosphate", + "Fuc-alpha-(1-6)-GlcNAc", + "pheophorbide", + "alpha,alpha-trehalose[side 1]", + "DL-isocitrate", + "BtrI acyl-carrier protein", + "3-phosphohydroxypyruvate", + "proTNF-alpha", + "sphingosine", + "2 ADP", + "[HelX protein] with reduced L-cysteine residues", + "PP2A phosphatase with trans-P190", + "(9Z)-octadecenoate", + "3-nitropropanoate", + "digalactosyldiacylglycerol", + "(8R,11S)-dihydroxylinoleic acid", + "procollagen V", + "gallate", + "alpha-actinin-4", + "[asialoglycoprotein]-(O-3-(beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->)))-L serine", + "(3-deoxy-alpha-D-manno-oct-2-ulopyranosylonate)-(2->4)-(3-deoxy-alpha-D manno-oct-2-ulopyranosylonate)-(2->6)-2-deoxy-2-[[(3R)-3-((9Z)-hexadec 9-enoyloxy)tetradecanoyl]amino]-3-O-[(3R)-3-hydroxytetradecanoyl]-4-O phosphono-beta-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3 hydroxytetradecanoyl]-2-[[(3R)-3-hydroxytetradecanoyl]amino]-1-O phosphono-alpha-D-glucopyranose", + "[ADP-thiazole synthase]-L-cysteine", + "palmitoyl-sn-glycerol 3-phosphate", + "(5Z,13E)-(15S)-6,9alpha-epoxy-11a,15-dihydroxyprosta-5,13-dienoate", + "inorganic pyrophosphatase", + "2',3''-cGAMP", + "5-hydroxylysyl-collagen", + "[tau protein]", + "cytosine34 in tRNALeu(CAG) precursor", + "[RING-E3-ubiquitin-carrier protein TRIM25]-S-ubiquitinyl-L-cysteine", + "UDP-D-GlcNAc", + "calcitonin", + "2-nitrobutanedioate", + "3-vinyl bacteriochlorophyllide a", + "fumigaclavine B", + "2-amino-1,3-dihydroxyoctadecane", + "proteolytically processed CLC chloride channel", + "cytosine50 in tRNALeuCAA", + "L-Tyr", + "paraoxon", + "5,6beta-epoxy-5beta-cholestan-3beta-ol", + "2,3-dihydroxyisovalerate", + "S-sulfo-L-cysteine", + "androstanedione", + "[methyl-coenzyme M reductase alpha-subunit McrA]-thioglycine465", + "L-Fucose", + "3-hydroxy-L-proline-[collagen]", + "[pyruvate, phosphate dikinase]", + "N-acetyl-D-leucine", + "an N-terminal-L-methionyl-L-phenylalanyl-[protein]", + "Ac-IYISRRLL", + "Rabin8", + "N6-(D-fructosyl)-L-lysine", + "cholesta-5,7-dien-3-beta-ol", + "nicotinamide ribonucleoside", + "[histone H3]-N6-methyl-L-lysine 4", + "11-deoxycortisol", + "trans-3-hydroxy-L-proline", + "4-hydroxybenzoic acid", + "acyl-L-carnitine", + "cytosine48 in tRNAAla(UGC)", + "pseudouridine 5' phosphate", + "Z-Phe-Arg", + "[tyrosine-binding protein][side 1]", + "2'-O-methylcytidine32 in tRNA", + "alpha-chitin", + "an N-terminal-L-methionyl-L-leucyl-[mTOR protein]", + "guanine748 in 23S rRNA", + "7-butyrylaminocephalosporanic acid", + "N10-formyltetrahydropteroylglutamate", + "methylated O9a antigenic polysaccharide", + "4 acetyl-CoA", + "1-hydroxy-2-methyl-2-(E)-butenyl 4-diphosphate", + "nitrilotriacetate", + "4-phospho-L-aspartate", + "ketotifen", + "pro-caspase-3", + "UDP-beta-L-arabinopyranose", + "homoallylglycyl-tRNALeu", + "GRK2 protein", + "1-alkyl-sn-glycero-3-phosphate", + "[elongation factor 2] phosphate", + "sedoheptulose 7-phosphate", + "reduced amylin peptide fragments", + "Leu-Met", + "(2R/3R)-dihydroflavonol", + "paxillin-L-tyrosine phosphate", + "phosphorylated Raf1", + "phosphorylated neuregulin receptor ErbB3", + "tetrachlorobenzoquinone", + "(ADP-D-ribosyl)n-tyrosine kinase Csk", + "fructan", + "reduced palustrisredoxin", + "N5-methyl-L-glutamine", + "[Hippel-Lindau protein]-L-lysine", + "2 amicyanin", + "N-methylputrescine", + "primeverose", + "alpha-L-Fuc-(1->2)-beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D GalNAc-diphospho-ditrans,octacis-undecaprenol", + "petunidin 3-O-[2-O-(4-coumaroyl)-alpha-L-rhamnosyl-(1->6)-beta-D-glucoside] 5-O-beta-D-glucoside", + "2-cyclohexen-1-ol", + "2 L-tyrosyl-tRNATyr", + "phosphorylated calpain 2", + "tryprostatin A", + "polyphosphate59", + "preadipocyte factor 1", + "a diacyl-sn-glycerol", + "angiostatin 4.5 (AS4.5)", + "8-ethyl-12-methyl-3-vinylbacteriochlorophyllide c", + "Btk", + "1-dicarboxylic acyl-sn-glycerol 3-phosphate", + "2-aryl-2-methylmalonate", + "anserine", + "13 diphosphate", + "phosphorylated type III inositol 1,4,5-trisphosphate receptor", + "1,4-beta-galactan side chains in rhamnogalacturonan I", + "NO", + "mitochondrial antiviral signaling protein", + "2-acylglycerophosphoserine", + "(+)-(1S,2S)-pseudoephedrine", + "reduced cytochrome P-450", + "dimethylated histone H3(K9)", + "1,3-benzothiazol-6-yl sulfate", + "(Z)-phenylmethanethial S-oxide", + "1,2-oleoyl-3-acylglycerol", + "1-(9Z-octadecenoyl)-2-(9Z,12Z-octadecadienoyl)-sn-glycerol", + "UDP-D-galacturonate", + "desacetylmycothiol", + "2,3-dioxopropyl phosphate", + "nicotinamide riboside", + "3,4-dihydroxyphenylacetic acid", + "5-hydroxyanthranilate", + "adenosine4 in tRNAHis", + "(3S)-3-hydroxy-L-enduracididine", + "3,5-dihydroxy-1,4-naphthoquinone", + "bicarbonate", + "[RIG-I]-N6-ubiquitinyl-L-lysine", + "phospho-rhodopsin", + "(4S,7R)-germacra-1(10)E,5E-dien-11-ol", + "fibronactin", + "CoA-disulfide", + "crystallin", + "magnesium-divinyl-protochlorophyllide a", + "(+)-camphor", + "D-aldosyl beta-D-fructoside", + "CDP-glucose", + "beta-L-arabinofuranose", + "palmitoyl-[acyl-carrier protein]", + "di-trans,poly-cis-docosaprenyl diphosphate", + "nicked double stranded DNA containing mismatches", + "7,22-cholestadiene-3beta-ol", + "2-fluorocyclohexa-1,5-diene-1-carbonyl-CoA", + "geranyl 6-O-alpha-L-arabinofuranosyl-beta-D-glucopyranoside", + "RhoA", + "(2Z,4E)-3-chloro-6-(3,5-dichlorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid", + "hippurate", + "4-O-methyl-D-glucuronoxylan methyl ester", + "GlcNAc(Man)5GlcNAc", + "cyclohexane-1,3-dione", + "protein tyrosine-O-sulfate", + "caffeoyl-CoA", + "pro-caspase-9", + "GDP-D-glycero-D-alpha-manno-heptose", + "retinol-[cellular-retinol-binding-protein]", + "4''-oxo-avermectin", + "chondroitin 4'-sulfate", + "Man-glycopeptide", + "(2-hydroxyethyl)sulfanol", + "n Na+[side 2]", + "Cu2+in", + "catechol", + "[germ cell-specific protein Vasa]-Nomega,Nomega'-dimethyl-L-arginine", + "Cry3Aa toxin", + "N-palmitoyldihydrosphingosine", + "guanine2069 in 23S rRNA", + "cobalt-precorrin-5", + "FPHFD", + "EpdE signal peptide", + "4-(beta-D-ribofuranosyl)aminobenzene 5'-phosphate", + "o2", + "L-tryptophanamide", + "S-inosyl-L-homocysteine", + "vindoline", + "N-[6-phospho-alpha-D-mannosyl]-[alpha-L-iduronidase]-L-asparagine", + "[protein]-N6-D-psicosyl-L-lysine", + "9,9'-dicis-zeta-carotene", + "cytosine48 in tRNAGlu(UUC)", + "3-amino-1-hydroxyacetone 1-phosphate", + "3-Hydroxyphenylacetate", + "3-hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-1(10),2-dien-4-oate", + "2'-dCDP", + "IpaB protein", + "glutathione-S-conjugate[side 1]", + "p38alpha", + "glial fibrillary acidic protein", + "Scc1", + "5,10-dihydro-9-dimethylallylphenazine 1-carboxylate", + "DnaA204-protein", + "3alpha-hydroxy-5alpha-pregnan-20-one", + "monochlorodimedon", + "S-(2,4-dinitrophenyl)glutathione", + "phosphorylated Gln3", + "[histone H3]-N6,N6,N6-trimethyl-L-lysine 9", + "(R)-maconelliyl diphosphate", + "1D-myo-inositol 1,3,4-trisphosphate", + "elongation factor 2", + "open I- channel", + "D-erythro-palmitoyl-sphingosine", + "(S)-indan-1-ol", + "3 isopentenyl diphosphate", + "Ii fragments", + "capsorubin", + "(2R)-butan-2-one cyanohydrin", + "Fumarylpyruvate", + "clarithromycin 2'-O-phosphate", + "4-bromobenzonitrile", + "leishmanolysin", + "xylulose", + "pro-transforming growth factor-beta", + "(R)-10-Hydroxystearate", + "S-[(2E,6E)-farnesyl]-L-cysteine", + "2,6-diamino-4-hydroxy-5-(N-methyl)formamidopyrimidine", + "m7G5'ppp5'-U8 snoRNA", + "a 2-arylethylamine", + "(S)-2-hydroxypropylphosphonic acid", + "(12Z,15Z)-9,10-epoxyoctadeca-12,15-dienoic aicd", + "[methionine synthase]-cob(II)alamin", + "3-oxoadipyl-CoA", + "phosphorylated mitotic centromere-associated kinesin", + "junction plakoglobin glutamine", + "5-methylcytosine50 in tRNAAspGTC", + "tryptophan", + "3-methyl-2-oxobutyrate", + "7-methylxanthine", + "single-stranded circular DNA", + "isoprocarb", + "[quaternary amine-binding protein][side 1]", + "beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho ditrans,octacis-undecaprenol", + "indole-3-acetic-acid-L-alanine", + "sedoheptulose monophosphate", + "[histone H3]-N6-methyl-L-lysine 9", + "L-arabinofuranose", + "[E2 ubiquitin-conjugating enzyme Ubc13]-L-cysteine", + "N2-dimethylguanine26 tRNA", + "a nitrile", + "epoxyqueuosine in tRNA(Tyr)", + "QRPRLSHKGPMPF", + "D-aspartic acid", + "18-hydroxypalmitoleic acid", + "O-acetylserine", + "2-caffeoylisocitrate", + "UDP-Mur2Ac(oyl-L-Ala-D-gamma-Glu-L-Lys-D-Ala-D-Ala)", + "(S)-limonene", + "leukotriene C4/in", + "an ubiquinone", + "methiocarb", + "phosphorylated MPK6", + "2-aminobenzonitrile", + "1-hydroxy-2-naphthoate", + "5-bromouracil", + "baciterpenol A", + "2-amino-4-ketopentanoate", + "[DsbG protein] carrying a disulfide bond", + "L-2-methyltryptophan", + "lauroyl-CoA[side 2]", + "apurinic 28S rRNA", + "adenosine 2',5'-bisphosphate", + "tenofovir/out", + "octadec-9,11-dienoyl-CoA", + "dihydroquercetin", + "polyisoprenylated methylated protein", + "fragments of casein", + "[(1,3)-beta-D-glucosyl]n", + "lipid IVA", + "1,5-bisdiphospho-1D-myo-inositol 2,3,4,6-tetrakisphosphate", + "beta-nicotinamide D-ribonucleotide", + "4-(methylthio)-2-oxobutanoate", + "5-formyltetrahydrofolate", + "[Notch3 protein with EGF-like domain 10]-L-serine435", + "protein C/EBPalpha-N6-methyl-L-lysine", + "2 dichlorochromopyrrolate", + "[tRNAIle2]-2-L-lysylcytidine34", + "butyl 2-(4-[[5-(trifluoromethyl)pyridin-2-yl]oxy]phenoxy)propanoate", + "2,5-didehydro-3-deoxy-D-gluconate", + "reduced azurin I", + "arsenite/in", + "(10R)-hydroxy-(11S,12S)-epoxy-(5Z,8Z,14Z)-eicosatrienoic acid", + "Mek1", + "Toll/IL-1 receptor domain-containing adaptor inducing interferon-beta", + "D-Glucuronate", + "7-hydro-8-oxoguanine", + "11 H2O", + "casomorphin", + "(2R)-5-[(carbamoyloxy)methyl]-2-[(R)-carboxy[[(2Z)-2-(furan-2-yl)-2 (methoxyimino)acetyl]amino]methyl]-3,6-dihydro-2H-1 3-thiazine-4-carboxylic acid", + "DDDIAAL", + "chondroitin 6'-sulfate", + "cyanidin 3-O-[[2-O-(2-O-sinapoyl)-beta-D-xylosyl]-6-O-(6-O-(4-coumaroyl)-beta-D glucoside)] 5-O-beta-D-glucoside", + "D-xylosone", + "formic acid", + "urate", + "3-vinyl-8-isobutyl-12-ethyl-bacteriochlorophyllide d", + "4-nitrophenyl acetate", + "DELTA8-sphingenine", + "5-N-acetyl-9-O-acetylneuraminic acid", + "2-oxopentanedioic acid 5-propyl ester", + "DL-Acetoin", + "oxidized flavodoxin", + "cremeomycin", + "trimethylamine", + "2-Oxopent-4-enoate", + "cellotriose", + "D-Tagatose-1,6-bisphosphate", + "7-O-methyl aromadendrin", + "2-aminobenzoic acid", + "valienone 7-phosphate", + "Mg-protoporphyrin IX monomethyl ester", + "5-methylcytosine48 in tRNASer(GCU)", + "CRE-binding protein", + "3-oxo-2-((2Z)-pentenyl)-cyclopentane-1-octanoic acid", + "(4-methyl)zymosterol", + "7-cyano-7-carbaguanine", + "Cypridina luciferin", + "Lys-plasminogen", + "9-riburonosylhypoxanthine", + "oxalate", + "ferricenium hexafluorophosphate", + "DNA-dependent protein kinase", + "[transmembrane adaptor protein LAT]-L-tyrosine", + "3-hydroxy-5-methylnaphthoate", + "profibronectin", + "isepamycin", + "SP(5-11)", + "meso-tartrate", + "dehydroshikimate", + "[glycine-cleavage complex H protein]-N6-lipoyl-L-lysine", + "4-diphosphocytidyl-2C-methyl-D-erythritol", + "vitexin", + "trhombin", + "(7R,8S)-8-amino-7-(carboxyamino)nonanoate", + "transcription factor AP-1", + "cyclohexylmethylphosphonofluoridate", + "5'-hydroxyoligonucleotides", + "Gag precursor polyprotein", + "complement component C3c", + "quizalofop-P", + "sortilin type I", + "gibberellin A12", + "NBD-labelled sphinganine", + "1,2-dioleoyl-lysophosphatidylcholine", + "Proteins with highly abnormal conformation", + "1-acyl-sn-glycero-3-phosphoethanolamine", + "alpha-spinophilin", + "calreticulin", + "(S)-2-arylpropionic acid", + "3'-end 3'-dAMP-labeled urea-thymidine duplex", + "Cycloartenol", + "N4-acetylcytidine", + "thioredoxin 3", + "N6-SAMP1-[molybdopterin synthase MoaE]-L-lysine", + "borneol", + "dicyanocobinamide-[cobalamin-binding protein][side 1]", + "precursor of glucose-binding protein", + "6-geranylgeranyl-2,3-dimethylbenzene-1,4-diol", + "oxaloacetic acid", + "(6S)-5-methyltetrahydrofolate", + "alpha-N-acetylneuraminyl-2,6-beta-D-galactosyl-1 4-N-acetyl-beta-D-glucosaminyl-R", + "coagulation factor XI", + "di-trans,poly-cis-undecaprenyl phosphate", + "beta-D-Glcp-(1->4)-alpha-L-Rhap-(1->3)-D-Glcp", + "tulipalin B", + "4,8-dimethylnona-1,3,7-triene", + "laminin alpha5-chain", + "diethyl-paraoxon", + "peptide p506", + "UDPmannose", + "[Escherichia coli histidine kinase ArcB]-L-histidine", + "stearoylaldehyde", + "aldosterone", + "CDP-4-dehydro-6-deoxy-D-glucose", + "L-arginyl-[calreticulin]", + "Met-Lys-bradykinin", + "5,6-dihydrouracil in tRNA", + "steroid sulfate", + "10 malonyl-CoA", + "acetic acid", + "complement component C4c", + "galactocerebroside 3-sulfate", + "KDIEDVFYKY", + "5-amino-5-(4-hydroxybenzyl)-6-(D-ribitylimino)-5,6-dihydrouracil", + "an N-terminal-L-methionyl-L-lysyl-[protein]", + "[protein]-N-phospho-L-histidine", + "2-pyrone-4,6-dicarboxylate", + "L-carboxymethylhydantoin", + "pyropheophorbide a", + "propionamide", + "N6,N6,N6-trimethyl-L-lysyl-[protein]", + "solanesyl diphosphate", + "RNA polymerase II C-terminal domain phosphoprotein", + "[L-Asp(4-Arg)]n-1", + "8-amino-3,8-dideoxy-D-manno-octulosonic acid", + "3,3',5,5'-tetraiodothyroacetic acid", + "sn-glycerol 3-phosphate[side 2]", + "an omega-(methylsulfinyl)alkyl-glucosinolate", + "Mca-KKVYPYPMEK-Dnp", + "monocyte chemotactic protein MCP-1", + "5-deoxy-D-ribulose 1-phosphate", + "cytosine48 in tRNAGln(CUG)", + "LL-2,6-Diaminoheptanedioate", + "Wilms' tumor suppressor 1", + "dTDP-4-dehydro-6-deoxy-alpha-D-gulopyranose", + "GDP-D-mannunorate", + "4-cresol", + "oleanolic acid", + "1,2-dihydroxy-5-methylhexane-3,4-dione", + "ADAMTS-13", + "Tc10/Cdc42 GTPase-activating protein", + "2 L-tyrosine", + "single-chained chitin", + "carboxylate", + "[L-Asp(4-L-Arg)]n-L-Asp", + "bacteriochlorophyllide g", + "chlorophyllide", + "galactosylsphingosine", + "a [sulfatase]-L-cysteine", + "a [Co(I) glycine betaine-specific corrinoid protein]", + "RANTES", + "caseinmacropeptide", + "(E)-11-tetradecenoyl-CoA", + "glycerophosphoethanolamine", + "alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans octacis-undecaprenol", + "D-cellobiono-1,5-lactone", + "a thiopurine S-methylether", + "nitric oxide", + "[dermatan]-4-O-sulfo-N-acetyl-D-galactosamine", + "C18-8-phytosphingenine", + "dTDP-3,4-didehydro-2,6-dideoxy-alpha-D-glucose", + "tamoxifen N-beta-D-glucuronoside", + "4-O-beta-D-glucopyranosyl-D-mannose", + "[citrate (pro-3S)-lyase](acetyl form)", + "N-acetyl-L-histidine", + "amikacin 2''-phosphate", + "Isochorismate", + "2 L-Ala", + "N1,N4,N8-triacetylspermidine", + "7-adipylaminodesacetoxycephalosporanic acid", + "Glc3Man9GlcNAc2", + "amyloid beta-peptide(1-7)", + "gibberellin 20", + "ovalbumin glycopeptide V", + "[voltage-gated sodium channel NaV1.5]-Nomega,Nomega'-dimethyl-L-arginine", + "(3R,4R)-4'-methoxyisoflavan-2',4,7-triol", + "phosphorylated T-cell protein tyrosine phosphatase", + "5alpha-androstane-3alpha,17beta-diol", + "cis-1,4-polyisoprene", + "lactose[side 1]", + "(RS)-canadine", + "N-acetyl-beta-D-glucosaminyl-(1->4)-N-acetyl-alpha-D-glucosaminyl diphosphodolichol", + "beta2-adrenergic receptor", + "(3E)-4-(2-hydroxyphenyl)-2-oxobut-3-enoate", + "Fe(III)[side 2]", + "activated p21-activated kinase 1", + "procollagen L-proline", + "4,4-dimethyl-5alpha-cholest-7-en-3beta-ol", + "peptidylproline (omega=180)", + "prephenate", + "Rpt2", + "trypanothione", + "2-beta-(R)-1,2-dihydrovomilenine", + "oxidized palustrisredoxin", + "fenbendazole S-oxide", + "phosphorylated glycogen synthase", + "(1E)-2-methyl-N-(sulfooxy)butanimidothioic acid", + "phosphatidic acid", + "beta-phenylethylamine", + "cholesterol 3-sulfate", + "N-terminal-ubiquitinyl-[huntingtin]", + "cobalt-precorrin-5A", + "2-O-(alpha-D-mannopyranosyl)-D-glycerate", + "4-methylsalicylate", + "thiosulfate/out", + "Yersinia outer proteins", + "all-trans-retinoate", + "3,20-dimethyl-1,2,21,22-tetradehydro-2,3,20,21-tetrahydrobotryococcene", + "N-acyl-sphingosine", + "5-methylcytosine in single-stranded DNA", + "N6-[[prokaryotic ubiquitin-like protein]-L-glutamate]-[[protein]-L-lysine]", + "1,3-diphosphoglyceric acid", + "cyclo(L-4-O-methyltyrosine-L-leucine)", + "protein Ntau-methyl-L-histidine", + "a flavonol 3-O-beta-D-glucoside", + "(5')pppAACA-[mRNA]", + "(5Z,13E,15S)-11alpha,15-dihydroxy-9-oxoprost-5,13-dienoate", + "p75 TNF-alpha RII", + "3-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA", + "crocin", + "Stargazin", + "(5Z,8Z,14Z)-11,12-dihydroxyeicosatrienoic acid", + "(-)-kolavenyl diphosphate", + "protein glutamine", + "7-[(3S)-(3-amino-3-carboxypropyl)-4-demethyl]wyosine37 in tRNAPhe", + "pro-form GPI-anchored serine protease prostasin", + "4-hydroxybutanal", + "adhesin BAEBL", + "poly(Glu:Tyr)", + "caffeoylgalactaric acid", + "[BalhA1]-(L-amino acyl-L-cysteine)", + "PodJS", + "meconium H-2", + "3alpha,7beta-dihydroxy-5beta-cholanoic acid", + "acetyl-6-aminopenicillanic acid", + "1-(4-methylphenyl)ethanol", + "DNA containing a 7,8-dihydro-8-oxo-2'-deoxyguanosine:adenine mispair", + "2 ubiquinol-2", + "decaprenyl-4-hydroxybenzoate", + "D-erythro-ascorbate", + "angiostatin", + "3 menaquinol", + "pGp-mtRNAHis", + "N-acetylneuraminate", + "2-oleoyl-phosphatidylglycerol", + "phosphorylated histamine H2 receptor", + "[7-(2,6-dichloro-phenyl)-5-methyl-benzo[1,2 4]triazin-3-yl]-[4-(2-pyrrolidin-1-yl-ethoxy)-phenyl]-amine", + "an ultra-long-chain di-unsaturated 3-oxo-fatty acyl-[acyl-carrier protein]", + "3,4-cis-leucoanthocyanidin", + "2-oleoyl-lysophosphatidylcholine", + "L-norvaline", + "(E)-11-tetradecenoate", + "oxidized Cypridina luciferin", + "ammelide", + "phosphorylated SCFFbw7 ubiquitin ligase", + "factor XI", + "beta-glutamate", + "citrate", + "(S)-2,3-dihydropyridine-2,6-dicarboxylate", + "N-acetyl-D-galactosaminyl-fibronectin", + "tRNA(Leu)", + "(+)-corvol ether A", + "mycinamicin III", + "immunoglobulin G glycopeptide", + "5-methylcytosine48 in tRNALeuCAA", + "TM protein", + "5-methylcytosine48 in tRNALeu(CAG)", + "4-aminobenzoylalanine", + "phosphorylated securin", + "AfsR protein", + "4-androstene-3,17-dione sulfate", + "cyclic 2,3-bisphosphoglycerate", + "glycine-ethyl-ester", + "2-hydroxy-2-methylpropanoate", + "5,10-methylenetetrahydrofolate", + "1-gamma-linolenoyl-2-acyl-[glycerolipid]", + "pro-HGF", + "2,3-didehydrolactose", + "nicotinate adenine dinucleotide", + "ent-kaur-16-en-19-ol", + "2 S-adenosyl 3-(methylthio)propylamine", + "quercetin 3-O-beta-D-glucoside", + "Ras-GTPase activating protein SH3 domain-binding protein 1", + "macrocin", + "6-methylmercaptopurine", + "D-2,3-diketo-4-deoxy-epi-inositol", + "fibrinopeptide B", + "1,8-diaminooctane", + "L-hydroxyproline", + "peptidyl-tRNAL", + "fascin", + "profilaggrin", + "phosphorylated synapsin", + "transgelin-3", + "2-trans,4-cis-decadienoylcarnitine", + "phosphorylated Cabin1", + "perlecan", + "sugar beet pulp", + "(2S)-4-malyl-CoA", + "3,4-dehydroadipyl-CoA", + "proteasome subunit alpha type-2", + "semaphorin-4C", + "N2-formyl-N1-(5-phospho-beta-D-ribosyl)glycinamide", + "phosphorylated IkappaB", + "9000 Da membrane-bound fragment of TNF-alpha", + "2-hydroxypropionate", + "(2S,5R,6R)-3 3-dimethyl-7-oxo-6-[(thiophen-2-ylacetyl)amino]-4-thia-1 azabicyclo[3.2.0]heptane-2-carboxylic acid", + "2 3-(7-chloroindol-3-yl)-2-iminopropanoate", + "butyl 2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate", + "cytosine48 in tRNA", + "hesperetin 7-O-beta-glucopyranoside", + "tritrans,heptacis-undecaprenyl diphosphooligosaccharide", + "2-oxo-L-gulonate", + "Ii protein", + "6-methoxy-5-methyl-2-(all-trans)-hexaprenyl-1,4-benzoquinol", + "aristolochene", + "[myosin II regulatory light chain] phosphate", + "peptide LRRKtide", + "tannin", + "L-rhamno-1,4-lactone", + "10-deoxymethymycin", + "herpesvirus associated ubiquitin-specific protease", + "N1-methylguanine9 in tRNALeuGAG", + "acetoacetyl-CoA synthetase", + "(22R)-22-hydroxycholesterol", + "S-adenosyl-L-homocysteine", + "O-demethylpuromycin", + "3-methylcyclohexa-1,5-diene-1-carbonyl-CoA", + "6-hydroxymellein", + "prostaglandin E1/out", + "DL-lactamide", + "peptidoglycan-N-acetyl-D-glucosamine", + "20S proteasome", + "2-oxo-3-methylpentanoate", + "DNA adenine", + "pseudouridine-5'-monophosphate", + "[fibroblast growth factor receptor FGFR2]-L-tyrosine phosphate", + "cob(I)alamin", + "L-Met", + "(3R,4S,5R)-3,4,5-trihydroxycyclohexane-1,2-dione", + "N-isopropyl ammelide", + "Renilla luciferyl sulfate", + "1,4-beta-D-galactosyl-N-acetyl-D-glucosaminyl-1,3-beta-D-galactosyl-1 4-D-glucosylceramide", + "Fuc-alpha-(1-6)-Gal", + "epiplakin N5-pentylglutamine", + "(13E)-11alpha-hydroxy-9,15-dioxoprost-13-enoate", + "OTUB1", + "cholesteryl esters", + "L-dehydroascorbate", + "5-methylcytosine49 in tRNAGlyGCC", + "fructose 2,6-bisphosphate", + "Elastin", + "(6Z,8E,10E,14Z)-(5S,12R)-5,12,20-trihydroxyicosa-6,8,10,14-tetraenoate", + "butyrate", + "4-phosphoerythronate", + "dTDP-alpha-D-glucose", + "CVB1 protein", + "oligofurostanosides", + "L-threo-dihydrosphingosine", + "mature caspase-8", + "protease-activated receptor-1", + "DL-glycerate", + "fragments of ssDNA", + "4-Aminobutyrate", + "phosphorylated Arabidopsis thaliana proteins AT1G78150", + "protein 14-3-3epsilon", + "glycine cleavage system protein", + "D-bornyl-diphosphate", + "skatole", + "mannosyl-alpha-1,3-tetrasaccharide-diphosphoryl-lipid", + "6-phospho-beta-D-glucosyl-(1->4)-D-glucose", + "2,4',7-trihydroxyisoflavanone", + "citramalyl-CoA", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-methionyl-[protein]", + "3,8-divinyl chlorophyllide a", + "25000 Da fragment of p35", + "L-Trp", + "protoasukamycin", + "protein N5-(5-hydroxy)tryptaminyl-glutamine", + "4 6-CH3(COO-)C-D-Man-beta-(1->4)-D-GlcA-beta-(1->2)-D-Man-alpha-(1->3)-D Glc-beta-(1->4)-D-Glc-alpha-1-diphospho-ditrans,octacis-undecaprenol", + "methyl-accepting chemotaxis protein B L-glutamate methyl ester", + "(Z)-3-hexenal", + "CN-", + "taxa-4,11-diene", + "5'-phosphomonoester oligonucleotides", + "guanosine 5'-triphospho-mRNA", + "beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-GlcNAc-(1->2)-alpha-D Man-(1->6)]-[beta-D-GlcNAc-(1->4)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1 >4)-beta-D-GlcNAc-N-Asn-[Notch receptor]", + "Fibrin", + "1-hydroxyalkyl-sn-glycerol", + "anamorsin", + "cytidylyl molybdenum cofactor", + "meso-2,6-Diaminoheptanedioate", + "acetyl-carnitine", + "(S)-3-hydroxybutanoyl-CoA", + "thioredoxin peroxidase 1", + "5-methyl-2-thiouridine54 in tRNA", + "DNA 6-methylaminopurine", + "succinyl-YISRRLL-7-amido-4-methylcoumarin", + "DNA-3-methylcytosine", + "N1-methyladenine in mRNA", + "Emi2", + "YGGFLRRIRPKL", + "N-acetyl-beta-D-glucosaminyl 1,2-alpha-D-mannosyl-1,6-(N-acetyl-beta-D-glucosaminyl-1 2-alpha-D-mannosyl-1,3)-beta-D-mannosyl-R", + "aerolysin/in", + "HurR protein", + "lipid A-core oligosaccharide[side 1]", + "guanine26 in tRNALeu(UAG)", + "3-oxododecanoate", + "N6-[[SAMP1]-Gly-Gly]-[[protein]-L-lysine]", + "Dab1 phosphoprotein", + "pro-interleukin-33", + "YPMEK-Dnp", + "D-xylotriose", + "tripeptides", + "pro-sigmaK", + "1D-myo-inositol-3,4,5,6-tetrakisphosphate", + "Smad3", + "cytosine50 in tRNA", + "furan-2,5-dicarboxylate", + "CMP-5'-phosphonoformate", + "cholest-5-ene-3beta,7alpha-diol", + "Gd1b", + "2 AH2", + "kallikrein-10 glutamine", + "1,3-diphosphoglycerate", + "beta-D-lactose", + "10 CO2", + "[G protein-coupled receptor]phosphate", + "amphiphysin I", + "nylon-66 polymer", + "glycodeoxycholic acid", + "5-methylcytosine48 in tRNA", + "UDP-GalNAc", + "a disulfide", + "phosphorylated Pho4 protein", + "1,2-di-O-sinapoyl-beta-D-glucopyranose", + "D-Orn", + "TRPM4", + "[myosin-heavy-chain]", + "ERK1", + "(9S,13S)-(15Z)-12-oxophyto-10,15-dienoate", + "gamma-tubulin", + "(S)-3-Hydroxy-3-methylglutaryl-CoA", + "a [Co(II) trimethylamine-specific corrinoid protein]", + "phosphorylated TDP-43", + "N2-methylguanine6 in tRNA", + "demethoxy-curcumin", + "Arg-Pro-Lys-Pro", + "prepilin type IV leader peptide", + "acyldihydroxyacetone phosphate", + "3-hydroxy-2-methylpyridine-5-carboxylate", + "staurosporine", + "kinin", + "pro-L-selectin", + "perillyl aldehyde", + "N-propionyl-D-serine", + "2-phenyl-1,3-benzothiazol-6-yl sulfate", + "6 CO2", + "fish muscle collagen", + "PARP1-XRCC1", + "3-linalylflaviolin", + "5-methylcytosine48 in tRNAThr(CGT)", + "2-amino-1-hydroxyhexadecan-3-one", + "protein L-glutamate methyl ester", + "pro-matrix metalloprotease-3", + "phosphinotricyl-alanyl-alanine/out", + "(5Z,13E)-(15S)-6,9alpha-epoxy-11alpha,15-dihydroxyprosta-5,13-dienoate", + "4alpha-methyl-5alpha-ergosta-8,14,24(28)-trien-3beta-ol", + "8-demethyl-8-formylriboflavin 5'-phosphate", + "Phe", + "granulin", + "factor XIa", + "reduced azurin", + "Immunoglobulin A1", + "5-Androstene-3,17-dione", + "phospho-interleukin-3", + "cortactin-L-tyrosine phosphate", + "activating transcription factor 2", + "a phenol", + "phosphocaveolin-1", + "sn-glycerol-1-phosphate", + "pachyman", + "1-alpha-D-ribofuranosylbenzimidazole 5'-phosphate", + "2'-N-hydroxyrifampicin", + "propionic acid amide", + "Mn2+/out", + "D-3-hydroxybutyryl-CoA", + "2,5-diamino-6-ribosylamino-4(3H)-pyrimidinone 5'-phosphate", + "plasminogen", + "(R)-amygdalin", + "(9Z)-12-phosphonooxyoctadec-9-enoic acid", + "4-coumaraldehyde", + "S-methyl-L-cysteine", + "peptidyl-tRNA1", + "Protein", + "5-Methylthio-5-deoxy-D-ribose 1-phosphate", + "4-chloromuconolactone", + "[SF3B1 protein]-L-Thr434 phosphate", + "2-[(3S)-3-carboxy-3-(dimethylamino)propyl]-L-histidine-[translation elongation factor 2]", + "xylobiose", + "cellobiono-1,5-lactone", + "persulfurated thioredoxin", + "[C-phycocyanin beta-subunit]-Cys82-phycocyanobilin", + "(3beta,5xi,6alpha,12beta,13xi)-3,6,12-trihydroxydammar-24-en-20-yl beta-D-glucopyranoside", + "CMP-5-N-acetyl-8-O-acetyl-neuraminate", + "beta-nicotinamide D-riboside", + "dihydroisopentenyldehydrorhodopin", + "peptidylproline (omega=0)", + "mycophenolic acid-acyl-glucuronide", + "protease-activated receptor 2", + "2-oxoadipate", + "[branched-chain a-keto acid dehydrogenase (acetyl-transferring)]", + "(+)-fenchone", + "calcidiol", + "(2S,5R)-5-methyl-2-(propan-2-yl)cyclohexan-1-ol", + "7-oxocholestanol", + "Cd/vacuole", + "rutinose", + "phospho-TRPM4", + "a 3'-(beta-D-glucopyranosyl)-2'-hydroxy-beta-oxodihydrochalcone", + "SSH1L phosphoprotein", + "aromatic carboxylate", + "5-O-(p-coumaroyl)quinate", + "growth hormone releasing factor", + "leucine5-enkephalin", + "S-((3S)-3-amino-3-(3-chloro-4 5-dihydroxyphenyl)propanoyl)-[peptidyl-carrier protein SgcC2]", + "dATP", + "diglycine", + "[isocitrate dehydrogenase 2]-N6-acetyl-L-lysine413", + "serine hydroxymethyltransferase", + "[Skp1-protein]-O-(alpha-N-acetyl-D-glucosaminyl)hydroxyproline", + "N-acetyl-D-glutamine", + "immunoglobulin M", + "5-methylcytosine72 in tRNACys", + "[histone deacetylase 5] phosphate", + "dehydroepiandrosterone", + "5-(4-coumaroyl)quinate", + "2,4-didehydro-3-deoxy-L-rhamnonate", + "polyribitol phosphate", + "partially de-N-acetylated beta-1,6-linked N-acetylglucosamine oligomer", + "L-histidinol phosphate", + "osteosarcoma-9", + "hypobromous acid", + "calmodulin L-methionine-(S)-sulfoxide", + "thioredoxin", + "3'-O-methylquercetin", + "peptide L-asparagine", + "veratrate", + "benzyl alcohol", + "Nalpha-gamma-L-glutamylhistamine", + "CD23", + "2-(4-methylaminophenyl)-1,3-benzothiazol-5-ol", + "(2R)-3-phosphoglycerate", + "cyhalofop", + "insulin-like growth factor binding protein related protein-1", + "androst-4-ene-3,17-dione", + "3-methyl-2-butenal", + "1-acyl,2-arachidonoyl-sn-glycerol", + "triphosphate", + "TadE prepseudopilin leader peptide", + "(5R)-5-[(1S 2R)-1-carboxy-2-hydroxypropyl]-3-([2 [(iminomethyl)amino]ethyl]sulfanyl)-4,5-dihydro-1H-pyrrole-2-carboxylic acid", + "[histone H3]-N6,N6-dimethyllysine27", + "phytate", + "N1-(5-phospho-beta-D-ribosyl)-ATP", + "3-hydroxy-larreatricin", + "12 oxidized ferredoxin", + "adhesin TRAP", + "3-hydroxycyclohexane-1-carbonyl-CoA", + "7,4'-dihydroxyflavone", + "beta-N-acetylgalactosaminylated oligosaccharides", + "maltohexaose", + "(S)-3-hydroxybutyryl-CoA", + "prenol", + "S-ubiquitinyl-[E1 ubiquitin-activating enzyme]-L-cysteine", + "N-acetyl-D-isoleucine", + "phenyl acetic acid", + "4-nitrocyclohexan-1-one", + "rabbit glycogen", + "n dNTP", + "alpha-L-Rha-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-alpha-D-Gal-PP undecaprenol", + "2 [corrinoid adenosyltransferase]-cob(I)alamin", + "Fuc-alpha-(1->2)-Gal-beta-(1->3)-GlcNAc", + "Grb2-associated binding protein 2", + "guanine34 in tRNA", + "D-galactosamine[side 2]", + "prephytoene diphosphate", + "[protein]-L-histidine", + "(4Z)-hexadec-4-enoyl-[acyl-carrier protein]", + "[H-Ras]-L-cysteine", + "GspG prepseudopilin leader peptide", + "phosphorylated dopamine D1 receptor", + "Uracil-5-carboxylate", + "delphinidin 3-O-[2-O-(4-coumaroyl)-alpha-L-rhamnosyl-(1->6)-beta-D-glucoside] 5-O-beta-D-glucoside", + "4-hydroxybenzoate", + "(15S)HETE", + "rhodopsin TM5", + "norspermine", + "trans-dienelactone", + "[RsbS]-serine/threonine", + "GlcNAc(Man)3GlcNAc", + "amyloid-beta protein 42", + "serotonin beta-D-glucuronoside", + "(Met)enkephalin", + "ATP synthase-alpha (ATP5A1)", + "alpha-factor/out", + "L-beta-lysine", + "phosphorylated eIF2Bepsilon", + "17beta-estradiol 17-(beta-D-glucuronide)/in", + "[histone H3R26]-Nomega,Nomega-dimethyl-L-arginine", + "N-acetyl-beta-D-galactosaminyl-(1->4)-[alpha-N-acetylneuraminyl-(2->3)] beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-ceramide", + "Mfge8 protein tyrosine O-sulfate", + "VEGFR-2", + "3,7-dimethylxanthine", + "caldariellaquinone", + "1-alpha-D-galactosyl-myo-inositol", + "10 levanbiose", + "cyclobutadipyrimidine in DNA", + "primaquine", + "3-sulfinopropanoate", + "L-arginine-[L-arginine-binding protein][side 1]", + "3'-hydroxyformononetin", + "UDP-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala)", + "1-alkenyl-2-acylglycerol", + "[glycerol 3-phosphate-binding protein][side 1]", + "phopsho-JNK", + "serine/threonine protein kinase", + "orysatinol", + "complement component C5 zymogen", + "11-deoxy-cortisol", + "S-sulfocysteine", + "fructooligosaccharides", + "(5Z,8Z,11Z,14Z)-eicosatetra-5,8,11,14-tetraenoyl-[glycerolipid]", + "alpha-mannopyranose", + "dUDP", + "cholate/out", + "Cu+/in", + "miR-324n+1", + "an N-terminal-Nalpha-acetyl-L-methionyl-L-isoleucyl-[protein]", + "CENP-Q", + "beta-D-GlcNAc-(1->4)-MurNAc-L-Ala-gamma-D-O-P-Glu-L-Lys-D-Ala-D-Ala diphospho-ditrans,octacis-undecaprenol", + "D-catechin", + "[Man-alpha-(1->6)]-[Man-alpha-(1->3)]-Man-beta-(1->4)-GlcNAc-beta-(1 >4)-[Fuc-alpha-(1->6)]GlcNAc", + "rhodoquinone", + "thioredoxin 2", + "BLT1 receptor", + "phospholamban", + "rubredoxin", + "peptide-L-methionine", + "mature 5S rRNA", + "1'-hydroxy-gamma-carotene", + "2 AMP", + "mesaconyl-C4-CoA", + "enoyl-CoA", + "(S)-2-phenylpropionate", + "(R)-3-hydroxy-3-methyl-5-hydroxyvaleric acid", + "(+)-cis-isopulegone", + "N1-methylguanine37 in tRNAPro(UGG)", + "myosin light-chain kinase", + "(-)-(2S)-naringenin", + "chlorophyll b", + "2(alpha-D-mannosyl)-D-glycerate", + "miltefosine/in", + "7beta-hydroxy-3-oxo-5beta-cholan-24-oic acid", + "Pfmap2", + "3,5-diiodo-4-hydroxyphenylpyruvate", + "chorismate", + "pentachlorocyclohexanol", + "peptide proteolytically cleaved into fragments or single amino acids", + "T7 DNA adenine", + "tRNA pseudouridine38-40", + "(2Z,4E)-2-hydroxy-6-oxonona-2,4-diene-1,9-dioate", + "guanosine 3'-diphosphate 5'-diphosphate", + "neo-lambda-carrahexaose", + "fragments of eIF4G", + "stearolic acid", + "2 D-alanine", + "2-hydroxy-3,4-dioxooctyl phosphate", + "annexin II", + "single-stranded DNA-1-methyladenine", + "(11Z,14Z)-icosa-11,14-dienoyl-CoA", + "N2-dimethylguanine26 in tRNASerUCA", + "L-pentahomomethionine", + "insulin-like growth factor binding protein", + "myo-inositol", + "[p27Kip1]-L-tyrosine phosphate", + "2-imino-3-(7-chloroindol-3-yl)propanoate", + "VLTGKLTTVFLP", + "a hydroquinone", + "[4Fe-4S]-ferredoxin", + "2C-methyl-D-erythritol-2,4-cyclodiphosphate", + "phosphorylated steroid histone H1", + "2,3-oxidosqualene", + "N-acetyl-D-glucosaminyldiphosphoundecaprenol", + "phytosphingosine 1-phosphate", + "collapsin response mediator protein-4", + "N1-(5-phospho-beta-D-ribosyl)glycinamide", + "2-phenylacetate", + "glial fibrillary acidic protein-L-citrulline", + "2 geranylgeranyl diphosphate", + "phytosulfokine-alpha tyrosine-O-sulfate", + "[superoxide dismutase]-serine/threonine", + "carnitine", + "3-vinyl-chlorophyll a", + "arachidoyl-CoA", + "2-hydroxy-3-methylbutyronitrile", + "salutaridinol 7-O-acetate", + "2-iminobutanoate", + "7alpha-hydroxy-3-oxochol-24-oyl-CoA", + "L-allo-threonine", + "ADP-D-glycero-D-manno-heptose", + "Juvenile hormone acid", + "(-)-epicatechin", + "hyaluronic acid-rich cumulus matrix", + "(2E)-3,7-dimethylocta-2,6-dienal", + "6R-(1'R,2'R)-5,6,7,8-tetrahydrobiopterin", + "pro matrix metalloproteinase 1", + "2-methylbutanoyl-CoA", + "1,2-didehydropiperidine-6-carboxylate", + "diadenosine 5',5''-P1,P3-triphosphate", + "[(1S,2S)-1-[[(2Z)-2-(2-azaniumyl-1 3-thiazol-4-yl)-2-[[(2-carboxypropan-2-yl)oxy]imino]acetyl]amino]-1 carboxypropan-2-yl]sulfamate", + "dTDP-3-dehydro-6-deoxy-alpha-D-galactopyranose", + "histone H3 N6-methyl-L-lysine4", + "adenine in ssDNA", + "thanatos-associated protein 5 (THAP5)", + "(S)-3-acetyloctanal", + "(S)-2-acetolactate", + "C2 complement component", + "3,4,6-trimethyldibenzothiophene-5,5-dioxide", + "iron coprogen/in", + "11,12-epoxyeicosatrienoic acid", + "reduced thioredoxin", + "1-phenylpropionaldehyde", + "[kinase Btk29]-L-tyrosine phosphate", + "cytosine48 in tRNALeu(UAA)", + "syndecan-4", + "4-estrene-17beta-ol-3-one", + "2-dehydro-D-gluconate", + "3-dehydro-L-gulonate 6-phosphate", + "D-xylose[side 2]", + "cyclooctat-9-ene-5,7-diol", + "benzene", + "2-(4-methylsulfonylphenyl)-1,3-benzothiazol-6-ol", + "Rad21", + "protein", + "[(1->2)-beta-D-mannosyl]n", + "nitrosobenzene", + "CUX1 transcription factor", + "homocysteine thiolactone", + "crotyl alcohol", + "mature caspase-3", + "9alpha,11beta-prostaglandin F2", + "choline sulfate", + "[methyl-Co(III) glycine betaine-specific corrinoid protein MV8465]", + "phosphorylated ERK1", + "DELTA6-protoilludene", + "1-alkyl-sn-glycerol", + "1-kestose", + "thymidylyl-(3'->5')-thymidylate", + "(3S)-1,2-diazinane-3-carboxylate", + "cholylglycine/in", + "single-stranded DNA with abasic site", + "S-(4-bromophenyl)-L-cysteine", + "L-lysine-[collagen]", + "[DNA]-cytosine", + "zealexin A1", + "6''-aldehydoraffinose", + "insulin-like growth factor binding proteins", + "prepilin PilB", + "homocysteine", + "alpha-santalene", + "[histone H3]-N6-acetyl-L-lysine20", + "cis-1,2-dichloroethene", + "(ADP-D-ribosyl)n-tyrosine kinase Tec", + "15-cis-4,4'-diapophytoene", + "UTP", + "Fe2+/out", + "butyramide", + "DNA containing a cytosine:adenine mismatch", + "cytosine48 in tRNAThr(AGU)", + "eukaryotic elongation factor 2 kinase", + "tRNATrpCCA containing N6-(dimethylallyl)adenosine", + "streptothricin-F acid", + "[cystic fibrosis transmembrane conductance regulator phosphoprotein]", + "(-)-isopiperitenone", + "13-alpha-hydroxymultiflorine", + "Nalpha-methyl-L-histidine", + "dihydropteridine reductase", + "oxidized polyferredoxin", + "6-pyruvoyl tetrahydropterin", + "cytosine34 in tRNA", + "raffinose/out", + "monacolin J acid", + "glucuronoxylomannan", + "alpha-D-galactosyl-blood group antigen", + "2-methyl-6-phytyl-1,4-benzoquinol", + "an N-terminal-Nalpha-acetyl-L-threonyl-[protein]", + "[HMG-CoA reductase] phosphate", + "UDP-2-acetamido-2,6-dideoxy-beta-L-arabino-hex-4-ulose", + "fatty acyl ethyl ester", + "factor Xa", + "RCONH2", + "phosphorylated inhibitory killer cell Ig-like receptor", + "L-dopaquinone", + "glucosyllysosphingosine", + "3,4,6,7-tetramethyldibenzothiophene-5,5-dioxide", + "n-butanol", + "N-glycolneuraminate", + "oat-spelt xylan", + "Ni-sirohydrochlorin a,c-diamide", + "(+)-aristolochene", + "leukotriene E4/in", + "(S)-(carbamoylamino)glycine", + "securin", + "Tartronate semialdehyde", + "L-alanyl-[L-alanyl-carrier protein]", + "L-methionine-(S)-S-oxide", + "(2S)-4-(beta-methyl)-malyl-CoA", + "[protein]-L-threonine", + "single stranded DNAn", + "inactive factor V", + "vinyl ether phosphatidylethanolamine", + "glucosyl alpha1,3-mannose", + "baicalin", + "di-trans,poly-cis-hexadecaprenyl diphosphate", + "benzamide", + "4 reduced ferredoxin [iron-sulfur] cluster", + "N1-acetylspermidine", + "3-sulfocatechol", + "Mig1 protein", + "N1 fragment", + "activated protein C", + "phosphorylated vasodilator stimulated phosphoprotein", + "N-hydroxy-arylamines", + "5,6-dihydroxy-3-methyl-2-oxo-1,2-dihydroquinoline", + "thioredoxin disulfide", + "an acyl-CoA", + "protein Gurken", + "inactive procaspase-7 variant C186A", + "vinylglycine", + "Hsp21 L-methionine S-oxide", + "1,2-epoxymenth-8-ene", + "phosphorylated Notch protein", + "(4-coumaroyl)acetyl-CoA", + "D-Man-beta-(1->4)-D-GlcA-beta-(1->2)-D-Man-alpha-(1->3)-D-Glc-beta-(1 >4)-D-Glc-alpha-1-diphospho-ditrans,octacis-undecaprenol", + "1-O-alkyl-sn-glycerol", + "ubiquinone", + "17-(allylamino)-17-demethoxygeldanamycin", + "GAP-43", + "IsdC", + "GDP-alpha-L-fucose", + "3-dehydro-L-gulonic acid", + "[germ cell-specific protein Zili]-L-arginine", + "[Notch3 protein with EGF-like domain 10]-3-O-(beta-D-glucosyl)-L-serine435", + "glutaramic acid", + "lambda-carrageenan", + "Ufd2p", + "17beta-estradiolsulfate", + "haloperidol", + "an N-(palmitoyl)-sphingoid base", + "2 5-aminolevulinate", + "maleate", + "N5-acetyl-L-ornithine", + "N-acetylglucosamine oligomers", + "glutamine synthetase", + "nicotinate ribonucleotide", + "4-hydroxyindole-3-carbonyl nitrile", + "2'-O-methyluridine32 in tRNA", + "6'-hydroxychalcone", + "fragments", + "hippuryl-L-phenylalanine", + "bilirubin-glucuronoside", + "novobiocic acid", + "UDP-galactose", + "amyloid beta42", + "Proglucagon", + "beta-defensin propeptide", + "guanidinoproclavaminate", + "nitrous acid", + "plakoglobin", + "c-Myc", + "5-methylcytosine49 in tRNAPro(CGG)", + "homopropargylglycine", + "ethanamine", + "p76Rb", + "(E)-beta-ocimene", + "3''-O-acetyl-ADP-D-ribose", + "cytosine69 in vtRNA1.1", + "[Alba protein]-N6-acetyl-L-lysine16", + "a 5'-(N7-methyl 5'-triphosphoguanosine)-(2'-O-methyl-purine-ribonucleotide)-(2'-O methyl-ribonucleotide)-[mRNA]", + "(R)-cembrene A", + "trimetaphosphate", + "cerebrosteryl ester", + "SREBP-2", + "3-ureidobutyrate", + "5-methylcytosine38 in tRNAGly(GCC)", + "alpha,alpha-trehalose 6-phosphate[side 2]", + "peptide N-(ADP-D-ribosyl)diphthamide", + "N-acetyl-N-hydroxy-4-aminobiphenyl", + "2 plastoquinone", + "4-dimethylaminophenylethylamine", + "Man2GlcNAc2", + "T7 DNA 6-methyladenine", + "fibronectin-bound gamma-glutamine", + "D-glucaric acid 3,6-lactone", + "(2R)-4-hydroxy-7-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ol", + "fibroblast growth factor receptor 1", + "amyloid beta 1-42 peptide", + "elymoclavine", + "5-[(5-phospho-1-deoxy-D-ribulos-1-ylamino)methylideneamino]-1-(5 phospho-beta-D-ribosyl)imidazole-4-carboxamide", + "2-dehydro-D-glucose", + "3Cpro", + "opioid-active enkephalin", + "dextran T70", + "protein with oligosaccharide attached to protein L-asparagine", + "L-fuculose 1-phosphate", + "plant RNA helicase 75 L-isoaspartate alpha-methyl ester", + "3-O-[N-acetyl-beta-D-galactosaminyl-(1->3)-N-acetyl-beta-D-glucosaminyl (1->4)-alpha-D-mannosyl]-L-seryl-[protein]", + "indoleglycerol phosphate", + "type I TGF-beta receptor", + "4 Fe2+", + "calmodulin N6-methyl-L-lysine", + "CREB-binding protein", + "neuropeptide Y", + "16 phosphate", + "alpha,alpha-1,1-trehalose 6-phosphate", + "5-methylcytosine48 in tRNAGlyGCC", + "alpha-D-abequose-(1->3)-alpha-L-Rha-(1->2)-alpha-D-Man-(1->2)-alpha-D Man-(1->3)-alpha-D-Gal-PP-undecaprenol", + "9-beta-D-glucosyl-trans-zeatin", + "[MurC]-serine/threonine phosphate", + "eukaryotic initiation factor", + "2'-deoxyuridine", + "cis-4,5-dihydroxycyclohexa-1(6),2-diene-1,2-dicarboxylate", + "UDP-N-acetylmuramoyl-L-Ala-D-Glu-L-Lys", + "CMP-beta-Kdo", + "1-hexadecanal", + "[hydroxamate-binding protein][side 1]", + "quercetin 7-O-beta-D-glucoside", + "5-amino-6-ribitylamino-2,4(1H,3H)-pyrimidinedione 5'-phosphate", + "L-dTMP", + "adenine9 in tRNAAsp", + "[fructose-1,6-bisphosphate aldolase]-N6-methyl-L-lysine", + "[dinitrogen reductase]-Nomega-alpha-(ADP-D-ribosyl)-L-arginine", + "phosphorylated Bcl", + "a [macrophage-stimulating protein]-L-tyrosine", + "Rap1a", + "NH2-484 fragment", + "hemofiltrate CC chemokine 1", + "thymine glycol-mismatched double-stranded DNA", + "[peptide chain release factor 1]-N5-methyl-L-glutamine", + "adenine22 in tRNASer", + "(2S)-naringenin", + "cyanidin 3-O-(6-O-(4-coumaroyl)-beta-D-glucosyl)-5-O-beta-D-glucoside", + "phosphorylated human glucocorticoid receptor", + "14alpha-methylzymosterol", + "3-methyl-1-(2,4,6-trihydroxyphenyl)butan-1-one", + "[nickel-binding protein][side 1]", + "(1S,2S)-1-hydroxypropane-1,2,3-tricarboxylate", + "Manalpha(1->6)[Manalpha(1->3)]Manbeta(1->4)GlcNAcbeta(1->4)[L Fucalpha(1->3)][L-Fucalpha(1->6)]GlcNAc", + "5-formiminotetrahydrofolate", + "2,2'-iminodipropanoate", + "L-proline betaine", + "O-methyl anthranilate", + "phenyl 5-phospho-alpha-D-ribofuranoside", + "dichlormethane", + "1-(2-acetamido-2-deoxy-alpha-D-glucopyranosyl)-1D-myo-inositol", + "benzoyl-CoA", + "kappa-neocarraoctaose-sulfate", + "(2-aminobenzoyl)acetate", + "D-Glyceraldehyde 3-phosphate", + "glycerol-3-phosphate/in", + "16alpha-hydroxykaurane", + "matrix metalloprotease 9", + "7beta-hydroxy-3,12-diketo-5beta-cholanoic acid", + "UDP-N-MurNAc-L-Ala-D-Glu", + "phosphorylated Blc10", + "VAMP", + "phospho-[adaptor protein SH2 domain-containing leukocyte protein]", + "dTDP-4-amino-4,6-dideoxy-D-galactose", + "2-dehydropantoate", + "CDP-1-stearoyl-2-arachidonoyl-glycerol", + "1-(2-deoxyriburonosyl)thymine", + "tRNATrp", + "bilirubin-IXa", + "phosphorylated Daxx", + "phospho-DNA-recombinase RecA", + "interleukin-1beta propeptide", + "quinolin-2,8-diol", + "(2S,3S)-3-hydroxyasparagine", + "polysialylated neural cell adhesion molecule", + "adiponectin-L-lysine", + "triethylenetetramine", + "RNA", + "Keren protein", + "10 gallic acid", + "2-O-(6-O-acyl-alpha-D-mannosyl)-1-phosphatidyl-1D-myo-inositol", + "an N-acetyl-2-arylethylamine", + "monoglucosyl-enterobactin", + "desmin", + "heparan sulfate", + "1-oleoyl-sn-glycerol 3-phosphate", + "5-carboxymethyl-2-hydroxymuconate semialdehyde", + "poly(ADP-ribose)n", + "5-methylcytosine48 in tRNALeu(UAG)", + "tiazofurin monophosphate", + "1,2-dimyristoyl-sn-glycero-3-phosphocholine", + "5'-inosinate", + "Fe3+-dicitrate-[dicitrate-binding protein][side 1]", + "papaverine", + "2'-deoxy-9-riburonosyladenine", + "quinone", + "spliceosome-associated protein 155", + "propionate", + "[Eps15 peptide]-tyrosine phosphate", + "Manalpha(1-6)[Manalpha(1-3)]Manalpha(1-6)[GlcNAcbeta(1-2)Manalpha(1 3)]Manbeta(1-4)GlcNAcbeta(1-4)GlcNAc", + "naphthalene dihydrodiol", + "adhesion molecule CD2831", + "a [CheA protein]-L-histidine", + "cis,cis-9,12-octadecadienoic acid", + "S-hydroxyglutaryltrypanothione", + "[beta-GlcNAc-(1->4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala)]n", + "[dipeptide-binding protein][side 1]", + "1-phosphatidyl-1D-myo-inositol 3,4,5-triphosphate", + "2-oxo-5-guanidinovaleric acid", + "gamma-L-Glu-L-Cys-Gly", + "(R)-malate", + "5-methylhex-4-enoyl-CoA", + "phospho-ATF2", + "dTDP-6-deoxy-beta-L-mannose", + "Pb2+/out", + "retinyl ester-[cellular retinol-binding protein III]", + "cerebroside 3-sulphate", + "2-hydroxyethylphosphonate", + "(8S)-8-amino-7-oxononanoate", + "(E,E)-farnesyl diphosphate", + "p35", + "DNA-3,N4-ethenocytosine", + "(31RS)3-(1-hydroxyethyl) bacteriochlorophyllide c", + "5D-5-O-methyl-2,3,5/4,6-pentahydroxycyclohexanone", + "cefazolin/in", + "beta-1,4-D-galactosyl-laminin", + "1,2-linked glucuronic acid of non-reducing xylose-oligosaccahrides", + "2-amino-4-hydroxy-6-(erythro-1,2,3-trihydroxypropyl)-dihydropteridine triphosphate", + "D-xylulose 5-phosphate", + "neral", + "[RBR-type E3 ubiquitin transferase]-L-cysteine", + "14,15-epoxyeicosatrienoic acid", + "sphinganine ceramide", + "pentiol", + "genistein beta-D-glucuronoside", + "5-methyl-5-thio-D-ribose 1-phosphate", + "ginsenoside G75", + "a CDP-diacylglycerol", + "ginsenoside Rb1", + "3 FADH2", + "[myosin light chain 2a] phosphate", + "oxidized ferredoxin [iron-sulfur] cluster", + "phosphorylated Myt1", + "lacticin 481/out", + "(+)-(R)-limonene", + "insulin-like growth factor II peptide fragments", + "1,2-diacylglycerol 3-phosphate", + "2-imino-3-(indol-3-yl)propanoate", + "3-hydroxybutyryl-[acyl-carrier protein]", + "(ribonucleotide)n-2',3'-cyclic phosphate", + "oligosaccharide-diphosphodolichol", + "2-O-(4-coumaroyl)-3-(3,4-dihydroxyphenyl)lactate", + "cleaved Bid protein", + "[cullin 4]-L-lysine", + "pppA2'p5'A2'p5'A", + "frusemide", + "phosphorylated Tcn1/Crz1", + "N4-(N-acetyl-beta-D-glucosaminyl-(1,2)-alpha-D-mannosyl-(1 3)-[N-acetyl-beta-D-glucosaminyl-(1,2)-alpha-D-mannosyl-(1 6)]-beta-D-mannosyl-(1,4)-N-acetyl-beta-D-glucosaminyl-(1 4)-[alpha-L-fucosyl-(1,6)]-N-acetyl-beta-D-glucosaminyl)asparagine", + "MFRRPVLQVLRQFVRH", + "ubiquinol", + "phosphorylated MEK-1", + "N7-methylguanine2069 in 23S rRNA", + "3alpha-sulfooxytibolone O-sulfate", + "phosphomononucleotides", + "phosphorylated T cell antigen receptor zeta", + "heparosan N-sulfate D-glucuronate", + "(6S)-6beta-hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide", + "aspartyl-tRNAAsp", + "(S)-carnitine", + "25-hydroxycholesterol", + "a very-long-chain inositol phospho-(2'R)-2'-hydroxyphytoceramide", + "DVL3", + "D-Man-alpha-(1->2)-D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-[D-Man-alpha (1->3)-D-Man-alpha-(1->6)]-D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D GlcNAc-diphosphodolichol", + "MTS-rhodamine [side 1]", + "tRNAPyl", + "(Z)-2-methylbutanal oxime", + "cleaved apoptosis-inducing factor (57 kDa)", + "[9-74] processed variant of hemofiltrate CC chemokine 1", + "7-((3S)-3-amino-3-carboxypropyl)wyosine", + "Prorenin", + "6-hydroxymethyl-7,8-dihydropteridine diphosphate", + "ubiquinone-9", + "S-(2E,6E)-farnesyl-[K Ras]-L-cysteine", + "trans-2,3-dehydropalmitoyl-CoA", + "2-aminobenzoylacetate", + "small ubiquitin-related modifier-Mdm2", + "2 cytochrome cL", + "meso-2,6-diaminoheptanedioate", + "a 6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranoside", + "polar amino acid-[polar amino acid-binding protein][side 1]", + "phosphorylated MEF-2C", + "eicosapentaenoyl-CoA", + "cellular inhibitor of apoptosis 1", + "tetrahydromethanopterin", + "fragments of laminin", + "(2R)-2-[(R)-[[(2Z)-2-(2-amino-1 3-thiazol-4-yl)-2-[[(2-carboxypropan-2 yl)oxy]imino]acetyl]amino](carboxy)methyl]-5-[(pyridin-1-ium-1 yl)methyl]-3,6-dihydro-2H-1,3-thiazine-4-carboxylate", + "N-acetyl-alpha-D-galactosaminyl-polypeptide", + "p21-activated kinase 1", + "beta-glucuronosyl-(1-4)-N-acetyl-alpha-D-glucosaminyl-(1-4)-beta-D glucuronosyl-proteoglycan", + "alpha-D-Man-(1->3)-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-alpha-D GlcNAc-diphosphodolichol", + "dimethyl sulfide", + "EpdB signal peptide", + "atropine", + "2-amino-5-oxohexanoate", + "Clotting factor V", + "3,5-dimethylcyclohex-2-en-1-one", + "5-fluorouracil-mismatched double-stranded DNA", + "cytosine50 in tRNAGly(UCC)", + "beta-secretase 1", + "1alpha,24R,25-trihydroxyvitamin D3", + "10-formyltetrahydropteroylhexaglutamate", + "acetyl-p53", + "2,4-dinitroanisole", + "phosphorylated Na,K-ATPase", + "4-(2-aminoethyl)benzene-1,2-diol", + "3-hydroxy-4-methylanthranilyl-adenylate", + "poly(glycerophosphate)", + "alpha-drebrin", + "JNK", + "4-aminobenzoate", + "amyloid-beta precursor protein", + "(R)-acetoin", + "6 diphosphate", + "EV-A71 viral polyprotein", + "3'-GMP", + "6 reduced adrenodoxin", + "L-alpha-Amino-epsilon-caprolactam", + "ni-carrageenan", + "[DsbE protein] carrying a disulfide bond", + "[RelA/p65 phosphoprotein]", + "protein L-methionine", + "7,12-diketo-5beta-cholanoic acid", + "3-(4-hydroxyphenyl)lactate", + "a fatty acid methyl ester", + "3-hydroxy-2-methylpropanoate", + "cholesteryl ester", + "1-oleoyl-sn-lysophosphatidylcholine", + "vasostatin-1", + "dimyristin", + "phosphorylated maxiK channel", + "itaconyl-CoA", + "flavodoxin semiquinone", + "(2R)-2-[(R)-[2-(2-amino-1 3-thiazol-4-yl)acetamido](carboxy)methyl]-5-[(sulfanyl)methyl]-3 6-dihydro-2H-1,3-thiazine-4-carboxylic acid", + "adenine in double-stranded RNA", + "heavy chain of kininogen", + "[tubulin]-L-glutamate", + "L-tyrosyl-tRNATyr", + "Cd x glutathione S2/vacuole", + "methyl 4-aminosalicylate", + "Rps2", + "protein Kex2", + "proteoglycan core protein with xyloserine", + "adenine in U6 pre-mRNA", + "2-[(3S)-3-amino-3-carboxypropyl]-L-histidine500-[translation elongation factor 2]", + "estradiol 3-sulfate", + "D-glucosylpyranoside", + "Cdc25A", + "ubiquinol-9", + "2-phenylethyl beta-D-glucopyranoside", + "[beta-tubulin]-(alpha-L-glutamyl-gamma-L-glutamyl)-L-glutamate", + "N1-methyladenine", + "retinal", + "xanthoxin", + "[BAP1]-L-lysine", + "N6-[[SAMP1]-Gly-Gly]-[[UbaA]-L-cysteine]", + "acetohydroxybutyrate", + "a medium-chain 3-oxoacyl-[acyl-carrier protein]", + "polyprotein of BSNV", + "a-factor-C", + "coenzyme F420-1", + "2',3'-dideoxycytidine 5'-phosphate", + "2,3-bis-(O-geranylgeranyl)-sn-glycerol 1-phosphate", + "5'-XMP", + "(2S)-2,3-dihydroxypropane-1-sulfonate", + "4 CoA", + "2-(2-oxopropylthio)ethanesulfonate", + "lactosyl-ceramide", + "CDP-2,3-bis-O-(phytanyl)-sn-glycerol", + "L-alpha-glycerophosphate", + "Ac-IAVGRTLK", + "L-erythro-3,5-diaminohexanoate", + "dolichyl oleate", + "7-aminocephalosporanic acid", + "xylotetraose", + "3-fluorobenzoyl-CoA", + "(8S)-HPETE", + "3-(methylthio)propanoate", + "holo-[alpha-aminoadipate semialdehyde dehydrogenase]", + "[(1R)-1-hydroxy-2-(trimethylamino)ethyl]phosphonate", + "GlcMan9GlcNAc", + "Prostaglandin H", + "coenzyme Q10", + "5-hydroxyconiferaldehyde", + "2,3-dihydroxy-p-cumate", + "psoralen", + "pro-Notch1", + "octanaldehyde", + "poly-ADPribose polymerase 1", + "androstane-3,17-dione", + "[acyl carrier protein]", + "L-Arg/in", + "phosphorylated vasodilator-stimulated phosphoprotein", + "2-Phosphoglycerate", + "phosphorylated Varicella-Zoster virus IE63 protein", + "G protein-coupled receptor kinase-2", + "D-asparagine", + "(E)-hexadec-11-enoyl-CoA", + "(+)-abscisate", + "[Notch2 protein with EGF-like domain]-L-serine", + "GTP", + "delta-carrageenan", + "stromal cell-derived factor-1", + "3'-end 3'-dAMP-labeled 5-hydroxycytosine-guanine duplex", + "Asp-tRNAAsp", + "5alpha-pregnan-3-20-dione", + "20beta-hydroxy-pregn-4-ene-3-one", + "alpha-L-fucosyl-(1-2)-D-galactosyl-O-R", + "a dimycocerosyl phenolphthiocerol", + "2-amino-2-deoxy-D-gluconate[side 1]", + "CMP-N-acetyl-beta-neuraminate", + "5-hydroxymethyl-uracil-mismatched single-stranded DNA", + "UDP-N-acetyl-3-O-(1-carboxyvinyl)-D-glucosamine", + "citramalyl-[acyl-carrier protein]", + "Man-beta-(1-4)GlcNAc", + "ginsenoside Rc", + "galactogen", + "Phe-Lys-4-aminobenzyloxycarbonyl-doxorubicin prodrug-albumin", + "carbenicillin", + "O-(indol-3-yl)acetyl-myo-inositol", + "PBIP1", + "Gelatin", + "[protein]-Npi-phospho-L-histidine", + "2 Ca2+[lumen side]", + "dextran T500", + "3,4,5-trihydroxycinnamic acid", + "(ADP-D-ribosyl)n+1-tyrosine kinase Hck", + "5-methylcytosine48 in tRNAGlu(CUC)", + "phospho-CREB1", + "N-methyl-D-aspartate", + "3-oxoisoapionate 4-phosphate", + "4-methylumbelliferone", + "eicosenoic acid", + "p-tyramine", + "3 maltose", + "[E2 ubiquitin-conjugating enzyme cullin-2]-L-cysteine", + "N-acetyl-D-serine", + "foot-and-mouth disease leader protein", + "[SAP49]-L-arginine", + "2,3-trans-3,4-cis-leucocyanidin", + "N6-(L-1,3-dicarboxypropyl)-L-lysine", + "indole-3-acetaldoxime", + "L-leucyl-tRNALeu", + "5-(methylthio)-2,3-dioxopentyl phosphate", + "fragments of RNA", + "His-Lys-Asp-Met-Gln-Leu-Gly", + "glycerophospholipid[side 1]", + "N-decanoyl -[acyl-carrier protein]", + "UDP-2-acetamido-4-amino-2,4,6-trideoxyhexose", + "miltefosine/out", + "(3R)-3-hydroxylauroyl-[acyl-carrier protein]", + "D-alanyl-(R)-lactate", + "methyl 2-(4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy]phenoxy)propanoate", + "(-)-catechin", + "dTDP-6-deoxy-D-xylo-4-hexulose", + "monopalmitoyldihydroxyacetone phosphate", + "gamma-cyclodextrin", + "NH2OH", + "(1->6)-beta-D-galactobiose", + "N-acetyl-beta-D-glucosamine", + "[p73 phosphoprotein]", + "L-cystine-[cystine-binding protein](side 1)", + "D-xylose-[substrate-binding protein xacG][side 1]", + "3-acylglycerophosphocholine", + "hexan-2-ol", + "phosphorylated ErbB3", + "7beta,27-dihydroxycholesterol", + "[vascular endothelial growth-factor-1]-L-tyrosine phosphate", + "17alpha-(N-acetyl-D-glucosaminyl)-estradiol 3-D-glucuronoside", + "pocket protein p130", + "indole", + "5-methylcytosine48 in tRNAAla(AGC)", + "dihydrosphingosine 1-phosphate", + "a RNA 2',3'-cyclic phosphate end", + "1,2-diacyl-lysophosphatidylserine", + "tiazofurin", + "Asn", + "His/out", + "kappa-carrageenan", + "adipic acid", + "tarocystatin", + "D-psicose", + "alpha-D-galactosyl-(1,3)-[alpha-L-fucosyl(1,2)]-D-galactose", + "alpha-D-galacturonosyl-[(1->2)-alpha-L-rhamnosyl-(1->4)-alpha-D galacturonosyl]n", + "glycoprotein D-galactosyl-1,3-N-acetyl-D-galactosamine", + "insulin fragments", + "benzene dihydrodiol", + "5beta-androstan-3,17-dione", + "poly(gamma-glutamic acid)", + "7-epi-alpha-eudesmol", + "4,6-dimethyldibenzothiophene-5,5-dioxide", + "(xylosyl-glucosyl)xyloglucan", + "3-chlorobenzonitrile", + "L-dTDP", + "nonpolar amino acid/out", + "beta-L-rhamnose", + "N-acetyl-9-O-acetylneuraminate", + "glutathione-4-hydroxynon-2-enal", + "phosphoglycolate", + "hydroquinone", + "plant cell wall", + "[eukaryotic elongation factor 2] phosphate", + "D-mannonate", + "5,6-dihydrothymine", + "2-mercaptoethanesulfonate", + "tRNAThr", + "matrix metalloprotease 2", + "N-carbamoyl-glycine", + "2 hydrogen sulfide", + "benzyl (2R,3S)-2-methyl-3-hydroxybutanoate", + "methylthioadenosine", + "(R)-2-hydroxycarboxylate", + "4-beta-D-galactosyl-O-beta-D-xylosyl-[protein]", + "a 1,2-diacyl-sn-glycerol", + "alpha-D-glucosyl-1,6-alpha-D-glucosyl-1,6-alpha-D-glucosyl-1 3-1-O-alkyl-2-O-acylglycerol", + "7-oxo-cholesterol", + "[delta opioid receptor]", + "5-[(4-hydroxyphenyl)methyl]-4,4-dimethylpyrrolidine-2,3-dione", + "N,N'-diacetyl-beta-D-chitobiose", + "(ADP-D-ribosyl)-histone H2B", + "cyanidin 3,5-di-O-beta-D-glucoside", + "uridylyl-[protein-PII GlnZ]", + "[enzyme]-S-sulfanylcysteine", + "inhibitory insulin-like growth factor binding protein-4", + "(9S,10)-epoxy-(10Z,12Z)-octadecadienoic acid", + "3-hydroxy-3-methyl-glutaryl-CoA", + "L-Cysteine sulfinate", + "wheat arabinoxylan", + "Fuc-alpha-(1-2)-Gal-beta-(1-3)-GlcNAc-beta-(1-4)-Glc", + "2-O-[alpha-D-glucopyranosyl-(1->6)-alpha-D-glucopyranosyl]-D-glycerate", + "cyclosporine A [side 2]", + "5beta-cyprinol sulfate", + "low-molecular-weight kinin", + "N-acetyl-L-glutamic gamma-semialdehyde", + "rifamycin B", + "3,4-dehydro-DL-proline", + "(2-hydroxybenzoyl)adenylate", + "Thr", + "phosphatase and tensin homologue-induced kinase 1", + "H+[side1]", + "digallate", + "3-O-sulfated heparan sulfate", + "trans-2,3-dehydroacyl-[acyl-carrier protein]", + "2-(9(10),16-dihydroxyhexadecanoyl)-sn-glycerol 3-phosphate", + "P-selectin glycoprotein ligand-1 tyrosine O-sulfate", + "o-phosphate", + "12-ethyl-8-isobutyl-3-vinylbacteriochlorophyllide d", + "ethyl 4-chloro-3-oxobutanoate", + "acetylated c-Myc", + "truncated neuropeptide Y", + "(Z)-3-ureidoacrylate peracid", + "N-(3-aminopropyl)-4-aminobutanal", + "a [Co(II) dimethylamine-specific corrinoid protein]", + "D-erythritol 1-phosphate", + "acrylonitrile", + "Manalpha(1-2)Manalpha(1-6)(Manalpha(1-2)Manalpha(1-3))Manalpha(1 6)Manalpha(1-2)Manalpha(1-2)Manalpha(1-3)Manbeta(1-4)GlcNAc", + "(3Z)-3-[(4R)-4-hydroxycyclohex-2-en-1-ylidene]-2-oxopropanoate", + "PDE11A phosphoprotein", + "N-acetylisatin", + "phospho-CREBL2", + "o-aminobenzoic acid", + "2,3-diketo-1-phosphohexane", + "cytosine27 in vtRNA1.3", + "5-formylcytosine-mismatched double-stranded DNA", + "ethanolamine-phosphate", + "mesoporphyrinogen-VI", + "N-2,4,6-trinitrophenyl-D-Tyr-L-Val-(S)-alpha-hydroxy-Gly", + "an aliphatic aldoxime", + "phosphorylated phospholipase C gamma", + "pregn-5-en-3,20-dione", + "ascorbate", + "(5Z,8Z,14Z)-11,12-epoxyeicosatrienoic acid", + "UDPglucuronate", + "[protein]-L-serine phosphate", + "8-hydroxy-warfarin", + "3-Fumarylpyruvate", + "adenine9 in tRNA", + "mouse CXCL-1", + "farnesyl diphosphate", + "glucose-dependent insulinotropic polypeptide", + "4-Methylphenol", + "1,1'-dihydroxylycopene", + "3,7-dimethyl-1,6-octadien-3-ol", + "CMP-5-N-acetylneuraminate", + "phosphorylated Rab11 protein", + "Na+/[side 1]", + "(GlcNAcalpha(1-4))n-1", + "3-demethylubiquinol-10", + "2',3'-dideoxycytidine", + "epicatechin", + "(Glc)6", + "(E)-glutaconyl-CoA", + "1-naphthaleneacetamide", + "reduced putidaredoxin", + "SPRH1", + "a 2-oxo acid", + "monodehydroascorbate", + "(3,5-dihydroxyphenyl)glyoxylate", + "glycano-1,3-(N-acetyl-alpha-D-galactosaminyl)-glycoprotein", + "iminodiacetate", + "adenosine", + "heparan sulfate fragment", + "ADP-ribosylated Fe-protein", + "Ac-Val-Glu-Ile-Asp", + "[Wnt1]-L-serine", + "a [protein]-(S,S)-2-(C-substituted-aminomethyl)-4-acyl-2-oxazoline", + "DAPK2 phosphoprotein", + "metabotropic glutamate receptor 5", + "2-trans,6-trans-Farnesol", + "[cullin Cdc53]-N6-[NEDD8-protein]-yl-L-lysine", + "GalNAc-alpha-(1-3)-Gal-[Fuc-alpha-(1-2)]", + "phosphatidylinositol 3,4,5-triphosphate", + "[oligopeptide-binding protein][side 1]", + "cis-4,5-dihydroxycyclohexa-1(6),2-diene-1,4-dicarboxylate", + "L-asparaginyl-tRNAAsn", + "4-hydroxyphenyl acetate", + "3,4-dihydroxy-2,2',5,5'-tetrachlorobiphenyl", + "D-Man-beta-(1->4)-GlcA-beta-(1->2)-D-Man-alpha-(1->3)-D-Glc-beta-(1->4) D-Glc-alpha-1-diphospho-dicis,octatrans-undecaprenol", + "vesicle-associated membrane protein-4", + "P1,P4-bis(5'-adenosyl)tetraphosphate", + "2,3-dihydro-dihydroxybiphenyl", + "4alpha-methyl-5alpha-ergost-8,14,24(28)-trien-3beta-ol", + "big-endothelin-2", + "epoxyeicosatrienoic acid", + "morolate", + "4-chloro-L-threonyl-[L-threonyl-carrier protein SyrB1]", + "disialylgalactosylgloboside", + "1,2-epoxypropane", + "phenylalanine", + "TBP", + "beta-lysine", + "N-3-oxo-octanoyl-L-homoserine lactone", + "phosphorylated cAMP response element-binding protein", + "FixK2", + "Nalpha-acetyl-Ser-Gly-Gly-Lys", + "Twinkle helicase", + "cyanidin 3-O-beta-D-rutinoside 5-O-beta-D-glucoside", + "lividomycin", + "(5S)-HPETE", + "11beta,20alpha-dihydroxypregn-4-ene-3-one", + "[endothelial growth-factor]-L-tyrosine", + "2-dehydro-3-deoxy-D-gluconate", + "phospholipid cyclopropane fatty acid", + "2-methyl-1,3-benzothiazol-5-yl sulfate", + "thrombinogen", + "9-[6-deoxy-beta-L-talofuranosyl]-6-methylpurine", + "activated TGFbeta", + "pyridoxine-5'-beta-D-glucoside", + "2-chloro-2'-deoxyadenosine 5'-phosphate", + "dalpatein 7-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside", + "alpha-tubulin L-lysine", + "(+)-isoafricanol", + "cyclic di-3',5'-guanylate", + "2-hydroxy-2-methylpropanal", + "2,3,5-trihydroxytoluene", + "pro-BMP4", + "dec-9-ynoyl-[acyl-carrier protein]", + "barley", + "transferrin[Fe(II)]2", + "coniferyl aldehyde", + "pyridine-3-carbothioamide", + "phosphorylated CREb protein", + "7-cholesten-3beta-ol", + "PDE11A protein", + "oligosaccharide", + "sn-2-monoacylglycerol", + "prepilin PilB leader peptide", + "6-amino-2-oxo-hexanoic acid", + "ent-kaur-ene", + "phosphorylated SC35", + "L-lysine N6-oxide", + "(S)-linalool", + "cytosine967 in 16S rRNA", + "5-methylcytosine49 in tRNAVal(CAC)", + "a polycis-polyprenyl diphosphate longer by one C5 unit", + "bergapten", + "active factor Va", + "2,4-dinitrotoluene", + "[cullin 4]-N6-[NEDD8-protein]-yl-L-lysine", + "melibiose/in", + "(8R,9Z,12Z)-8-hydroperoxy-10,12-octadecadienoate", + "pyruvic oxime", + "2-chlorocyclohexa-1,5-diene-1-carbonyl-CoA", + "nylon-6 polymer", + "5-oxoprolyl-Abeta3-40/42 peptide", + "alpha-1,6-dextran", + "2,3-dihydroxybiphenyl", + "L-glycerol 3-phosphate", + "N-terminal L-lysyl-[Hsp70]", + "N-[alpha-D-Man-(1-3)-alpha-D-Man-(1-6)-[alpha-D-Man-(1-2)-alpha-D-Man (1-2)-alpha-D-Man-(1-3)]-beta-D-Man-(1-4)-beta-D-GlcNAc-(1-4)-beta-D GlcNAc]-L-aspartate", + "lactin", + "(5Z,9E,11Z,14Z)-(8S)-8-hydroperoxyeicosa-5,9,11,14-tetraenoate", + "3-O-alpha-D-glucopyranosyl-D-glucopyranose", + "a mycolipenoyl-CoA", + "2-amino-4-methylbenzoic acid", + "pentan-2-one", + "(ADP-D-ribosyl)n+1-p21ras", + "L-Tagatose 6-phosphate", + "5beta-androstan-17beta-ol-3-one", + "5-methylcytosine48 in tRNALeu(UAA)", + "2-decenoyl-[acyl-carrier protein]", + "5 di-D-fructose-2,6':2',6 dianhydride", + "3-oxopentanoate", + "3',5'-cyclic-GMP", + "HI", + "[PrkC]-serine/threonine phosphate", + "N-acetyl-O-9-acetylneuraminate", + "N1-methylguanine37 in tRNAPhe", + "L-glutamic acid", + "7 D-glucopyranose", + "(6R)-5,10-methylenetetrahydrofolate", + "phosphoribosylformylglycinamidine", + "N5-methyltetrahydrofolate", + "HIV-1 Tat protein", + "a [histone H4]-N6,N6,N6-trimethyl-L-lysine20", + "Cdk2 interacting protein", + "tBid", + "2-methoxy-6-octaprenyl-1,4-benzoquinol", + "[trifunctional enzyme]-tyrosine phosphate", + "wyosine37 in tRNAPhe", + "N-acetylhistamine", + "protein phosphatase-1 inhibitor-3", + "D-glucose 6-phosphate", + "gamma-L-glutamyl-L-cysteinyl-glycine", + "casbene", + "soluble variant surface glycoprotein", + "OmpF", + "poly-N-acetyllactosamine", + "a [methyl-coenzyme M reductase alpha-subunit McrA]-glycine465", + "Man8GlcNAc2-[ricin A-chain] (isomer 8A1,2,3B1,3)", + "ADP-sugar", + "3',5'-O-dimethyltricetin", + "cyclooctatin", + "[histone H3]-L-lysine36", + "14 NADPH", + "Nidogen", + "fibrinogen N5-(biotinamido)pentyl-glutamine", + "2-(4-dimethylaminophenyl)-1,3-benzothiazol-6-yl sulfate", + "3-[(Z)-2-isocyanoethenyl]-1H-indole", + "rat chymotrypsinogen", + "22 NADP+", + "beta-cholestanol", + "2 nitrate", + "DELTA5-androstenediol", + "Gal-beta-(1-4)-GlcNAc-[Fuc-alpha-(1-4)]-beta-(1-3)-Gal-beta-(1-4)-Glc", + "cytosine38 in Q34tRNAAsp", + "N-behenoyldihydrosphingosine", + "(-)-geosmin", + "8-oxo-dGTP", + "9,10-epoxy-octadecanoic acid", + "2,3-trans-catechin", + "galloyl beta-D-glucoside", + "phosphorylated caspase-9", + "5 CO2", + "pro-TGF-alpha", + "6,8-dihydroxypurine", + "5-hydroxyferulic aldehyde", + "6-amino-2-oxohexanoate", + "HO-", + "(R)-canadine", + "creatine kinase", + "phosphorylated Sic1 protein", + "protein MUC1-MFP6", + "cis-muurola-3,5-diene", + "core 2 oligosaccharide", + "decanoyl-CoA", + "(3S)-3-hydroxybutanoyl-CoA", + "UDP-D-glucuronate", + "alpha-D-galactosyl-(1-4)-beta-D-galactosyl-(1-4)-D-glucosylceramide", + "25-hydroxycholecalciferol", + "an (E)-1-(glutathione-S-yl)-omega-(methylthio)alkylhydroximate", + "protoberberine", + "L-idose", + "a 1,2-diacyl-sn-glycerol 3-phosphate", + "mannosylphosphodolichol", + "[histone H3]-N6,N6-methyl-L-lysine 4", + "1D-myo-inositol 3,4-bisphosphate", + "[alpha-tubulin]-N6-acyl-L-lysine", + "indican", + "effector domain of IgA1", + "hypoxanthine34 in tRNAArg", + "morphine", + "[EGR2]-L-lysine", + "sinapic acid", + "p130 Crk-associated substrate", + "cytosine1404 in 16S rRNA", + "single-stranded DNA", + "[LysW]-gamma-(L-2-aminoadip-2-yl)-L-glutamate", + "paraquat", + "L-fucose", + "acetylcholine chloride", + "D-galactosyl-1,4-beta-D-glucosyl-glycolipid", + "11alpha,17alpha-dihydroxyprogesterone", + "actin", + "[transmembrane adaptor protein LAT]-L-tyrosine phosphate", + "(+)-lariciresinol", + "1-palmitoyl-2-linoleoyl phosphatidylcholine", + "glucosyl-poly(ribitol phosphate)", + "a [methyl-Co(III) glycine betaine-specific corrinoid protein]", + "mannan-binding lectin-A-L-lysine", + "2''-adenylylgentamicin A", + "tRNAMetG34C36", + "N2,N5-dibenzoyl-L-ornithine", + "[T-cell intracellular antigen 1]", + "dTDP-4-dehydro-6-deoxy-D-glucose", + "dopaminyl sulfate", + "2-acetyl-1-hexadecyl-sn-glycero-3-phosphocholine", + "stearidonic acid", + "poly[(R)-3-hydroxybutanoate]n-x", + "TDP-6-deoxy-D-xylo-hexopyranosid-4-ulose", + "N-acetyl-beta-D-galactosaminyl chondroitin oligosaccharide", + "prostaglandin A2/out", + "C3aR tyrosine", + "protoporphyrinogen-XIII", + "5-methylcytosine in tRNA precursor", + "S-(-)-phenylpyridin-4-yl-methynol", + "pppG-p-tRNAHis", + "CLE-RS2", + "N7-methylguanine1575 in 18S rRNA", + "phosphorylase a", + "holo-[(hydroxy)phthioceranic acid synthase]", + "fragments of glucan", + "p-menthane-3,8-diol", + "3-acetaminopropanal", + "thio-NAD+", + "7-(2-hydroxy-3-amino-3-carboxypropyl)wyosine37 in tRNAPhe", + "phosphorylated PLB", + "1alpha,25-dihydroxyvitamin D3-26,23-lactone", + "an ultra-long-chain omega-hydroxyceramide", + "crotonoyl-CoA", + "3'-C-ethynyluridine 5'-triphosphate", + "lipo-oligosaccharide/in", + "chloroacetate", + "[(1->2)-beta-D-mannosyl]n-1", + "closed Cl- channel", + "3alpha,12alpha-dihydroxy-5beta-cholan-24-oic acid", + "2',4',6',4-tetrahydroxychalcone", + "acetohydrazide", + "8,12-diethyl-3-vinylbacteriochlorophyllide c", + "phosphorylated RyR", + "folded tubulin", + "a lyso-ornithine lipid", + "dTDP-4-acetamido-4,6-dideoxy-alpha-D-glucose", + "5-L-glutamyl-amino acid", + "2'-deoxycytidine", + "5-aminomethyl-2-thiouridine in tRNA", + "2 iodide", + "icosanoyl-CoA", + "MnO2+", + "dTDP-L-rhamnose", + "mannose 6-phosphate receptor 300", + "[(1->4)-beta-D-mannosyl]n", + "myosinO", + "histone 2B", + "[ribose-binding protein][side 1]", + "2 aclacinomycin A", + "polyphosphate-n28", + "palmitaldehyde", + "1,3,3'-tri-O-methyl-4alpha-mannobiose", + "laminarioligosaccharides", + "1D-myo-inositol-1,4,6-trisphosphate", + "MEF2", + "cis,cis-Muconate", + "ketodeoxyinositol", + "N-cerotoyl-D-sphinganine", + "pro-opiomelanocortin", + "13-hydroperoxy-9,11-octadecadienoic acid", + "7 H+", + "alpha-L-fucopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->4)-2-acetamido 2-deoxy-D-galactitol", + "epiregulin", + "a 2-acyl-sn-glycerol 3-phosphate", + "4-methylpentanoyl-CoA", + "(RS)-tetrahydropalmitine", + "[Acs protein]-L-lysine609", + "DELTA1-pyrrolidine 2-carboxylate", + "(5Z,8Z,11Z)-14,15-epoxyeicosa-5,8,11-trienoic acid", + "gibberellin 9", + "eupatolide", + "2'-O-beta-D-mannosylsordaricin", + "N2-dimethylguanine26/N2-methylguanine27", + "galactaric acid", + "3 S-adenosyl-L-methionine", + "pyridoxal 5'-phosphate", + "2-chloromandelonitrile", + "VE-cadherin", + "chondroitin", + "L-alanyl-tRNAPro", + "S-methyl-5'-thioadenosine", + "protein S-chloroethyl-L-cysteine", + "gelatin glutamine", + "7-hydroxymethylchlorophyll a", + "uracil1498 in 16S rRNA", + "3,3',5-triiodothyroacetic acid", + "N,N-dimethyl-4-nitrosoaniline", + "phosphorylated Kir6.2 subunit of cardiac ATP-sensitive potassium channel", + "[Gialpha1]-S-palmitoyl-L-cysteine", + "N2-methylguanine1835 in 23S rRNA", + "muconolactone", + "avenacoside A", + "1-palmitoleoyl-2-acyl-[glycerolipid]", + "estradiol 3-O-beta-D-glucuronoside", + "Hydroxymethylbilane", + "[histone deacetylase 5]", + "partitioning-defective 3-like protein splice variant c", + "[beta-tubulin]-(gamma-L-glutamyl)-L-glutamate", + "reduced F420", + "2-acylglycerophosphatidic acid", + "40 H2O", + "4-(hydroxylamino)-N,N-dimethylaniline", + "demethoxy-curcumin phenolic beta-D-monoglucuronide", + "6-monoacetylmorphine", + "[nonpolar amino acid-binding protein][side 1]", + "N,N-dimethyltryptamine", + "(6R)-L-erythro-1',2'-dihydroxypropyltetrahydropterin", + "3-(alpha-D-mannosyl)-beta-D-mannosyl-R", + "D-erythrulose", + "hydrogen sulfide", + "DOPA", + "D-fructose 2,6-bisphosphate", + "myelin proteolipid O-palmitoylprotein", + "glycerol-3-phosphate", + "an acceptor", + "MurNAc-L-Ala-D-isoglutaminyl-L-Lys-(N6-penta-Gly)-D-Ala-D-Ala-diphospho ditrans,octacis-undecaprenyl-GlcNAc", + "[histone H3]-L-lysine4", + "salutaridine", + "5-methylcytosine48 in tRNASer(AGA)", + "3'-phospho-5'-hydroxy-RNA", + "small acid-soluble protein", + "cerotoyl-CoA", + "cytosine50 in tRNAGly(GCC)", + "1,3-beta-D-galactosyl-N-acetyl-D-glucosaminyl-R", + "nucleocapsid protein", + "an alpha,omega-diamine", + "deltoside", + "JAK1", + "7-keto,27-hydroxycholesterol", + "omega-(methylthio)-(E)-hexanaldehyde oxime", + "4-hydroxy-3-methoxy-5-octaprenylbenzoate", + "2-oxo-4-imidazolepropionic acid", + "thioacetate", + "(2S)-2-hydroxy-2-methyl-3-oxobutanoate", + "thyroglobulin", + "neurofilament", + "alpha-ketoisovaleric acid", + "25-hydroxyvitamin D2", + "4-hydroxycinnamate", + "2-keto-3-deoxy-D-gluconic acid", + "cellular eukaryotic translation initiation factor eIF4GII", + "7alpha,12alpha-dihydroxy-3-oxochol-4-enoate", + "maltobiose", + "alpha1D-adrenergic receptor phosphate", + "5beta-androstane-3,17-dione", + "formononetin", + "glycinamide ribonucleotide", + "2 K+/out", + "(-)-beta-2',3'-dideoxy-3'-thiacytidine", + "[Notch1 protein with EGF-like domain]-L-serine", + "2-deoxy-D-glucose[side 1]", + "amyloid-beta1-40", + "1-acyl-sn-lysophosphatidylcholine", + "all-trans-retinylamine", + "gypenoside XVII", + "2-omega-hydroxy-acyl-sn-glycerol 3-phosphate", + "a long-chain ester", + "D-ethionine", + "L-tryptophanyl-tRNATrp", + "cytosine34 in tRNAPro(CGG)", + "retinyl-ester-[cellular-retinol-binding-protein]", + "Msmeg1704/out", + "Glu-tRNAGlx", + "oxidized ferredoxin 2", + "xanthosine", + "L-gulonate", + "phosphotyrosinyl-PIKE-A", + "3-demethylubiquinol-6", + "8 malonyl-CoA", + "6-chloro-3-hydroxypyridine-2,5-dione", + "5-iodo-uracil", + "pseudo-proteinaseA", + "tetradecanal", + "N-acetyl-D-glucosaminyl-poly(ribitol phosphate)", + "eukaryotic initiation factor eIF4GI", + "N,N-dimethylglycine", + "PP2A phosphatase with cis-P190", + "beta-adrenergic receptor phosphate", + "4-acetylphenylalanine", + "propane-1,3-diamine", + "phenylhydrazine", + "5-methylcytosine48 in tRNAPro(CGG)", + "L-arabinitol", + "GDP-beta-L-fucose", + "histone H3 N6,N6,N6-trimethyl-L-lysine9", + "alpha-L-arabinofuranosyl-(1-3)-O-beta-D-xylopyranosyl-(1-4)-D xylopyranose", + "integrin alpha7", + "jasmonate", + "beta-D-glucuronosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->4)-beta-D glucuronosyl-(1->3)-[nascent hyaluronan]", + "ovalbumin glycopeptide IIIA", + "5S precursor rRNA", + "proopiomelanocortin peptidyl(2-hydroxyglycine)", + "D-mannitol", + "dalpaniculin", + "methylarsonate", + "tetracosanoate", + "GlcNAc-beta-1,4-GlcNAc-beta-1,4-GlcN", + "1-phenyl-1,2-ethanediol", + "GDP-L-galactose", + "caspase-7 biosensor vDEVDc", + "myo-inositol pentakisphosphate", + "5-hydroxy-DL-kynurenine", + "human CXCL-6", + "tetrahydrofolyl-Glu2", + "methyl 3-hydroxybenzoate", + "2-aminophenoxazin-3-one", + "scopolin", + "methylmercaptopropionate", + "cyclobis-(1->6)-alpha-nigerosyl", + "TAK1", + "2-nitrocyclohexan-1-one", + "[E2 ubiquitin-conjugating enzyme]-L-cysteine", + "N-methylimidazolidine-2,4-dione", + "pro-bone morphogenetic protein-4", + "reduced electron-transferring flavoprotein", + "indolepyruvate", + "7-methylguanine", + "pCCollagen I", + "CH3Hg+", + "5-hydroxymethyl-dCMP", + "roundabout homolog 2", + "3-demethylubiquinol", + "Co2+", + "1D-myo-inositol 1,4,5,6-tetrakisphosphate", + "prepilin", + "phosphorylated myosin regulatory light chain", + "inositol 1-phosphate", + "puromycin", + "4-N-trimethylaminobutyrate", + "[PykA]-serine/threonine", + "gibberellin a20", + "protein S-carboxymethyl-L-cysteine", + "(7S,8S,9Z,12Z)-7,8-dihydroxyoctadeca-9,12-dienoate", + "NAKG", + "(5Z,13E)-(15S)-9alpha,11alpha-epidioxy-15-hydroxyprosta-5,13-dienoate", + "myristoyl-[acyl-carrier protein]", + "fucosyl-TSR4", + "L-xylulose 5-phosphate", + "cytochrome c L-lysine", + "21-hydroxyprogesterone-21-O-D-glucuronate", + "UDP-2-acetamido-4-keto-2,6-dideoxyhexose", + "alpha-D-glucose-6-phosphate", + "bergaptol", + "reduced 2,6-dichloroindophenol", + "cis-farnesyl diphosphate", + "oleanolate", + "N1,N8-bis(4-coumaroyl)-spermidine", + "O-acetyl serine", + "4-hydroxyprotoasukamycin", + "2-propanol", + "hex-2-enoyl-CoA", + "DL-glyceraldehyde 3-phosphate", + "a [histone H3]-N6,N6,N6-trimethyl-L-lysine9", + "indole-3-acetonitrile", + "cellobiose 6-phosphate", + "[molybdopterin synthase MoaE]-L-lysine", + "2'-O-methyluridine2479 in 23S rRNA", + "D-2-hydroxystearate", + "phenylethanolamine", + "cytidine32/guanosine34 in tRNAPhe", + "1-thiomethyl-D-ribulose 5-phosphate", + "complement component C5", + "3,3'-di-O-methyl-4alpha-mannobiose", + "DNA 6-methyladenine", + "4-O-(beta-L-arabinofuranosyl)-(2S,4S)-4-hydroxyproline", + "(-)-menthol", + "L-valyl-tRNAVal", + "D-ribitol 5-phosphate", + "oleuropein aglycone", + "(-)-abietadiene", + "ferrocytochrome c3", + "D-3-phenylpyruvate", + "olmesartan", + "ASA", + "7H-benz[DE]anthracen-7-one", + "N-3-oxo-hexanoyl-L-homoserine lactone", + "hemojuvelin", + "primary fluorescent chlorophyll catabolite", + "cyclin E", + "D-limonene", + "tissue inhibitor of metalloproteinase-1", + "(R)-nephthenol", + "(9E)-12-phosphonooxyoctadec-9-enoic acid", + "phosphorylated protein p100", + "beta-defensin", + "protein CREB", + "cytosine49 in tRNAThr(AGU)", + "[MapZ]-serine/threonine phosphate", + "n-haloalkanes", + "2 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine", + "PAF-C protein", + "valerate", + "(9Z,11E, 13R)-13-hydroperoxyoctadeca-9,11-dienoate", + "3-deoxy-alpha-D-manno-oct-2-ulopyranosyl-(2->6)-2-deoxy-2-[[(3R)-3 hydroxypentadecanoyl]amino]-3-O-[(3R)-3-hydroxytetradecanoyl]-4-O phosphono-beta-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3 hydroxytetradecanoyl]-2-[[(3R)-3-hydroxytetradecanoyl]amino]-1-O phosphono-alpha-D-glucopyranose", + "pyrazinamide", + "a phosphoglycerolipid", + "Glucose 6-phosphate", + "[protein]-L-asparagine-N-oligosaccharide", + "L-epi-2-inosose", + "N4-[N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl-(1->3)-[N acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl-(1->6)]-[beta-D xylosyl-(1->2)]-beta-D-mannosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1 >4)-N-acetyl-beta-D-glucosaminyl]asparagine", + "3-O-beta-D-galactosyl-N-acetyl-alpha-D-galactosamine", + "ferulate", + "[SDIRIP1 protein]-L-lysine", + "3alpha,7alpha-dihydroxy-12-oxo-5beta-cholanate", + "1D-myo-inositol-3,4,6-trisphosphate", + "peptide YY", + "amyloid -like PROTEIN 2", + "D-galatonolactone", + "L-proline-[collagen]", + "Ac-SNKTIDEANQRATKML-NH2", + "Protoaphin aglucone", + "nitrite/out", + "6-O-acetyl-alpha-D-glucopyranosyl-(1->4)-D-glucose", + "5-methoxypyridine-3-carboxamide", + "N6-methyladenine in MAT2A hairpin 1", + "2-bromoacetophenone", + "methyl (2E,6E)-(10R,11S)-10,11-epoxy-3,7,11-trimethyltrideca-2,6-dienoate", + "(S)-malate", + "a sulfoquinovosyl diacylglyceride", + "spectrin", + "bradykinin/out", + "3,7-dideoxy-D-threo-hepto-2,6-diulosonic acid", + "(2S,4S)-alpha-campholinic acid", + "1-(3-chlorophenyl)ethanol", + "2'-phospho-[ligated tRNA]", + "thyrotropin", + "ferricytochrome c", + "1F-beta-D-fructosylsucrose", + "phosphite", + "A-band polysaccharide/out", + "D-isoglutamine", + "oxidized adrenal ferredoxin", + "linoleate", + "glycyl-pp60c\u0002Src", + "Klotho protein", + "oleic aldehyde", + "5'-phosphoribosylformylglycinamide", + "[protein]-Nomega-methyl-L-arginine", + "[tubulin]-serine/threonine", + "capsanthin", + "L-Lysine", + "cholesteryl long-chain fatty acyl ester", + "UDP-N-acetylgalactosamine 4-sulfate", + "N2-(D-1-carboxyethyl)-L-ornithine", + "2,3-dihydroxyindole", + "beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-D-galactitol", + "unfolded polypeptide", + "4-chlorobenzoyl-CoA", + "5-methyl-2-(prop-1-en-2-yl)cyclohexan-1-one", + "3-iodothyronine", + "7-hydroxy-4-amino-4-deoxy-N10-methylpteroic acid", + "3 phosphate", + "short isoform of Mgm1", + "12-ethyl-8-isobutyl-3-vinylbacteriochlorophyllide c", + "alpha-(1-3)-mannobiose", + "3-deacetyl-3-vinylbacteriochlorophyllide a", + "2 HSO3-", + "phenazine methosulfate", + "5'-phosphyl-terminated DNA", + "Slk19", + "6-demethylsterigmatocystin", + "4-O-methyl-15-decarboxyaclacinomycin T", + "N6-([prokaryotic ubiquitin-like protein]-gamma-L-glutamyl)-[protein]-L-lysine", + "(S)-2-hydroxy-2-methyl-3-oxobutanoate", + "[C-phycocyanin beta-subunit]-Cys155-phycocyanobilin", + "chenodeoxycholate 3-sulfate", + "dTDP-4-amino-4,6-dideoxy-alpha-D-glucopyranose", + "holo-[mycocerosate synthase]", + "Tn antigen", + "hydroxyurea", + "(6R)-6beta-hydroxy-1,4,5,6-tetrahydronicotinamide-adenine dinucleotide phosphate", + "tissue growth factor beta1", + "3-acetylamino-4-hydroxybenzoic acid", + "Gal-beta-(1-3)-[Fuc-alpha-(1-2)]-GalNAcol", + "a PqqA peptide", + "[coiled-coil domain of p54nrb]-L-arginine", + "silaic acid acetylated at O-7 or O-9", + "hypoxanthine34 in tRNA", + "3 FMNH2", + "sAPP-alpha fragment", + "myosin IIB", + "dopamine", + "L-Arg-[alpha-1-antitrypsin]", + "4-aminobutyric acid", + "Z-Phe-Arg-7-amido-4-methylcoumarin", + "GlcNAc-beta-1,4-GlcNAc-beta-1,4-GlcNAc", + "5-methylcytosine38 in tRNA", + "[protein] L-cysteine", + "D-isocitrate", + "Tyr-Gly-Gly-Phe-L-methionine-(S)-S-oxide", + "collagen type I propeptide", + "cytosolic protein Apaf-1", + "N-acetyl-beta-D-galactosaminyl-(1,4)-N-acetyl-beta-D-glucosaminyl-R group", + "1-deoxycapsidiol", + "an alkyl-glycerone 3-phosphate", + "caldesmon phosphate", + "[Stat5B]-L-tyrosine phosphate", + "13-cis-retinoate", + "2 2-aminophenol", + "a demethylmenaquinol", + "octadecyldihydroxyacetone", + "N-stearoylsphinganine", + "C5a peptidase", + "phosphorylated G protein-coupled receptor kinase-2", + "propane-1,2,3-tricarboxylate", + "1,4-dichlorobenzene", + "m-tyrosine", + "(-)-pluviatolide", + "3-methylfumaryl-CoA", + "protein Keren", + "PDE5A protein", + "N-methylacetamide", + "phospho-Pah1", + "2-hydroxycyclohexa-1,5-diene-1-carbonyl-CoA", + "rRNA", + "(ADP-D-ribosyl)n+1-tyrosine kinase Tec", + "UDP-2,3-diacetamido-2,3-dideoxy-D-glucuronic acid", + "N-acetyl-beta-D-glucosaminyl-(1-4)-beta-D-glucuronosyl-(1-3)-[nascent hyaluronan]", + "C32-carboxyphthiodiolenone-[(phenol)carboxyphthiodiolenone synthase]", + "6,7-dehydrohyoscyamine", + "all-trans-retinol-[cellular retinol-binding protein]", + "phosphorylated protein ERK", + "reduced cytochrome c", + "phosphorylated connexin36 protein", + "(S)-1-phenylethanol", + "dicarboxylic acyl-CoA", + "propionyl-CoA", + "pelargonidin 3,5-di-O-beta-D-glucoside", + "pro-ADAMTS4", + "trichohyalin-L-arginine", + "tetramethyl-branched mycocerosoyl-CoA", + "4-(2-aminophenyl)-2,4-dioxobutanoate", + "5-methylcytosine48 in tRNALys(CUU)", + "glutamate/in", + "tRNA pseudouridine55", + "D-Glc-alpha-(1->2)-D-Glc-alpha-(1->3)-D-Glc-alpha-(1->3)-D-Man-alpha-(1 >2)-D-Man-alpha-(1->2)-D-Man-alpha-(1->3)-[D-Man-alpha-(1->2)-D-Man alpha-(1->3)-[D-Man-alpha-(1->2)-D-Man-alpha-(1->6)]-D-Man-alpha-(1 >6)]-D-Man-beta-(1->4)-D-GlcNAc-beta-(1->4)-D-GlcNAc-diphosphodolichol", + "1D-myo-inositol hexakisphosphate", + "(ADP-D-ribosyl)n-tyrosine kinase Src", + "3-sulfino-L-alanine", + "5-methylcytosine40 in tRNA", + "phosphorylated Tea1 protein", + "human glucocorticoid receptor", + "adenylyl-[glutamine synthase]", + "17alpha,21-dihydroxypregna-1,4-diene-3,11,20-trione", + "6 oxidized [2Fe-2S] ferredoxin", + "N-acetylmuramidase/lysin AtlS", + "(R)-2-phenylpropionate", + "fragments of spore protein C", + "methane", + "cis-4-hydroxy-D-proline", + "[HMG-CoA reductase]", + "beta2-adrenergic receptor phosphate", + "[E2F1]-L-lysine", + "sphingoglycolipid", + "aminopeptidase B", + "1-piperideine-2-carboxylate", + "8-ketodeoxycoformycin", + "[2-(trimethylamino)ethyl]phosphonate", + "H*", + "phenyl beta-D-galactopyranoside", + "L-homophenylalanine", + "mercaptopropionate", + "glutathione-4-hydroxy-trans-2-nonenal", + "ppp(5')RNA", + "L-alpha-aminoadipate-semialdehyde", + "fragments of DNA", + "LHR/CGR tyrosine", + "2-hexanone", + "N2-dimethylguanine10 in tRNA", + "N-acetyl-D-galactosaminyl-polypeptide", + "myristoyl-sn-glycerol3-phosphate", + "[acceptor protein]-N6-ubiquitinyl-L-lysine", + "butyryl-6-aminopenicillanic acid", + "phosphorylated histone deacetylase 8", + "fructose donor", + "N-acetylcysteamine", + "UDP-N-acetyl-6-(D-galactose-1-phospho)-D-glucosamine", + "fumigaclavine C", + "active caspase-9", + "10-deacetyl-10-propionylbaccatin III", + "Reelin", + "Factor Xa", + "1,4-dihydroxy-2-naphthoyl-CoA", + "N-undecanoyl-(S)-homoserine lactone", + "4-aminobutyrate", + "EMILIN1", + "Dihydromacarpine", + "(ADP-D-ribosyl)n-Ras", + "a 2-polyprenylphenol", + "C3b2SN", + "L-Arg-[contrapsin-like protease inhibitor-3]", + "amyloid beta-peptide", + "cathelicidin LL-37", + "dTDP-6-deoxy-alpha-D-allose", + "6-hydroxymethyl-7,8-dihydropterin", + "2-(4-methylaminophenyl)-1,3-benzothiazol-6-ol", + "beta-galactomannan", + "a 5'-(N7-methylguanosine 5'-triphospho)-[mRNA]", + "2-hydroxymuconate semialdehyde", + "glucoerucin", + "4-O-beta-D-galactopyranosyl-D-N-acetylglucosamine", + "glycyl-pp60c Src", + "copalyl diphosphate", + "NAD(P)H", + "interleukin-18 propeptide", + "aculeacin A", + "peptidyl alpha-hydroxyglycine", + "indole-3-glycerol phosphate", + "5-methylcytosine967 in 16S rRNA", + "prepilin PilA leader peptide", + "2'-O-methylcytidine4 in tRNAGly(GCC)", + "NFAT", + "beta-heptaprene", + "vimentin", + "N-butanoyl-[acyl-carrier protein]", + "an N-terminal-L-methionyl-L-tryptophyl-[protein]", + "(9Z,11E,13S,15Z)-13-hydroperoxy-9,11,15-octadecatrienoic acid", + "trypsin", + "cutin monomers", + "phosphoethanolamine/out", + "kanosamine 6-phosphate", + "Dot6", + "demethyldecarbamoyl novobiocin", + "D-glucosyl-D-mannose", + "3-(4-hydroxy-3-methoxyphenyl)propanoyl-CoA", + "amyloid beta 4-40 fragment", + "MUC2 mucin", + "isobutyramide", + "1,3-benzoxazol-6-ol", + "neoagarobiose", + "3 D-glucose", + "actin Ntau-methyl-L-histidine73", + "enzyme N6-(S-[2-methylpropanoyl]dihydrolipoyl)lysine", + "N-terminal-PPKRIA-[RCC1]", + "N-acetyl-beta-muramate 6-phosphate", + "Nomega-(ADP-D-ribosyl)-glucose-regulated protein of 78 kDa/immunoglobulin heavy-chainbinding protein-L-arginine", + "4-hydroxyphenylacetate", + "S-sulfanyl-acceptor", + "1,4-diaminobutane", + "cellular eukaryotic translation initiation factor eIF4GI", + "D-glucosaminate[side 1]", + "S-(hercyn-2-yl)-gamma-L-glutamyl-L-cysteine S-oxide", + "cutin", + "L-myo-inositol", + "2-oxo-4(E)-hexenedioate", + "3-O-deacyl lipid X", + "D-Fructose", + "[CmaA -protein-T-domain]-4'-phosphopantetheine", + "fragment Ba", + "propionyl-CoA carboxylase", + "carboxymethyl cellulose", + "N-acetyl-alpha L-aspartyl-L-glutamate", + "proopiomelanocortin peptide", + "3beta-hydroxy-7,12-dioxo-5beta-cholan-24-oic acid", + "erythronolide H", + "Hice1 subunit of Augmin complex", + "3-ketosteroid", + "L-cystathionine", + "cholest-5-en-3-beta-ol", + "molybdenum cofactor", + "2'-O-methylcytidine34 in tRNALeuUAA", + "desmoplakin glutamine", + "prostaglandin A2/in", + "2 4-methyl-1,2-benzoquinone", + "L-Ala-gamma-D-Glu-meso-diaminopimelyl", + "5-(hydroxymethyl)furfural", + "tRNA uridine39", + "Abf2", + "sulfoacetate", + "valacyclovir", + "human proinsulin", + "phospho-[beta2-adrenergic receptor]", + "CtpB", + "ergosta-5-ene-3beta-ol", + "supercoiled plasmid DNA pRK", + "methanesulfonate", + "6-hydroxy-N-methylmyosmine", + "2'-O-methylcytidine34 in tRNALeuCAA", + "4 glucose", + "a thiol", + "maltopentaose", + "a phosphatidylcholine", + "all-trans retinoate", + "chenodeoxycholic acid", + "[SoxYZ protein]-S-sulfanyl-L-cysteine", + "glutarate semialdehyde", + "phosphoribosyl diphosphate", + "synaptobrevin", + "4-O-beta-D-galactopyranosyl-D-mannose", + "2-oxopropanoic acid", + "N,N,N-trimethylglycine", + "Hot1p", + "(ADP-D-ribosyl)n+1-tyrosine kinase Lyn", + "linearized single-stranded DNA", + "5'-hydroxyaverantin", + "6-hydroxyprotopine", + "cyclomaltodextrin", + "pre-tRNAHis", + "[histone H3]-L-lysine 36", + "glutamate", + "Cdc42-cysteine", + "1-(3-C-ethynyl-beta-D-ribopentofuranosyl)cytosine", + "gamma-L-glutamyl-acceptor", + "phospholipids", + "insulin chain A", + "glycerone phosphate", + "homocystine", + "FHA-domain containing protein GarA", + "(S)-N-methylcanadine", + "n phosphate", + "2-heptyl-1-hydroxyquinolin-4(1H)-one", + "a menaquinol", + "4-hydroxy-2,4'-dichlorobiphenyl", + "fluoroacetate", + "D-2-hydroxyalkanoic acid", + "5-methylcytosine48 in tRNAGly(UCC)", + "(2Z,4Z)-2-hydroxyhexa-2,4-dienoic acid", + "1-aci-nitro-2-indolyl-ethane", + "alpha-L-rhamnopyranosyl-(1->3)-N-acetyl-alpha-D-glucosaminyl-diphospho trans,octacis-decaprenol", + "protein L-Arg", + "2-hydroxy-6-methyl-3,4-dioxoheptyl phosphate", + "an Nalpha-acyl-L-glutamine", + "Manalpha(1-2)Manalpha(1-2)Manalpha(1-3)Manbeta(1-4)GlcNAc", + "organic nitrate", + "C3aR tyrosine O-sulfate", + "10-gingerol", + "neuroligin 1", + "4-carboxy-2-hydroxy-cis,cis-muconate", + "L-thyroxine", + "phosphorylated ICAP-1alpha protein", + "[galactose-binding protein MglB][side 1]", + "carnosine", + "2-(methylsulfanyl)ethane-1-sulfonate", + "alkylglycerone 3-phosphate", + "phosphorylated branched-chain alpha-keto acid decarboxylase/dehydrogenase", + "hesperidin", + "cobyrinic acid a,c-diamide", + "D-tyrosine", + "ferulic aldehyde", + "4-pyridoxate", + "Myt1", + "Kunitz-type protease inhibitor 2", + "5-enolpyruvylshikimate 3-phosphate", + "2,5-diformylfuran", + "[histone H3]-N6,N6-dimethyl-L-lysine 36", + "alpha-D-galactosyl-(1->3)-beta-D-galactosyl-(1->4)-beta-N acetylglucosaminyl-R", + "an alkanesulfonate", + "D-glucose 1-phosphate", + "a phosphorylated G protein-coupled receptor", + "poliovirus polypeptide", + "2-succinylbenzoate", + "D-threose", + "6 ferricytochrome c", + "adenylylfluoride", + "parkin", + "phosphorylated MKK6", + "phospho-RNA binding family protein", + "alpha-casein", + "phospho-5'-[DNA]", + "iodoacetic acid", + "4-methoxybenzyl alcohol", + "Phosphatidylinositol-3,4,5-trisphosphate", + "CD109", + "an ultra-long-chain mono-unsaturated 3-oxo-fatty acyl-[acyl-carrier protein]", + "(9S,13S)-12-oxophytodienoic acid", + "N6-methyladenine in tRNA", + "neomycin 3'-phosphate", + "phospho-annexin 1", + "OTUD5 protein", + "2 glutathione", + "ribulose-1,5-bisphosphate carboxylase/oxygenase small subunit precursor", + "G(5')pppAACA-[mRNA]", + "P1-bis(5'-adenosyl) monophosphate", + "[pyruvate dehydrogenase A1 (acetyl-transferring)]", + "a [protein]-L-histidine", + "(S)-2-chloropropionate", + "Gurken", + "tau protein", + "isorenieratene", + "amyloid beta", + "trehalose 6-phosphate", + "3alpha-hydroxy-5beta-cholanate", + "4-O-beta-D-mannopyranosyl-D-glucopyranose", + "6-aminohexanoate", + "taurolithocholate", + "UDP-2,3-bis(3-hydroxytetradecanoyl)glucosamine", + "thymidine", + "gemcitabine", + "[CBP/p300]-L-arginine", + "N-2-hydroxystearoylsphingosine", + "cytosine32 in tRNAThr", + "1-amino-1-deoxy-scyllo-inositol 4-phosphate", + "L-histidinol", + "beta-amyloid peptide 42", + "vasopressin", + "mandelonitrile-beta-D-glucopyranoside", + "5-glutathionyl-2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid", + "2-dehydropyranose", + "2 superoxide", + "4-aminosalicylate", + "o-nitrophenol", + "FLT-3L", + "pentanamide", + "apo-[acetyl-CoA carboxylase 1]", + "hemopexin", + "ceftaxidime", + "4-coumaric alcohol", + "SIRPalpha", + "dihydrochalcone phloretin", + "phosphorylated Y527-phosphorylated Src", + "N6-dimethylallyladenine", + "3-sulfolactaldehyde", + "L-Ala-gamma-D-Glu-m-DAP-D-Ala-D-Ala", + "L-2-aminoadipate-semialdehyde", + "N-acetyl-D-galactosamine units", + "tuberous sclerosis complex 2 protein", + "18-hydroxylinoleic acid", + "laminaritetraose", + "(S)-2-bromopropanoate", + "4'-hydroxy-7-methoxyisoflavone", + "butyrylcholine", + "BcSak1", + "polyvinylketone", + "GDP-D-mannuronate", + "D-glucosyllipopolysaccharide", + "TDP", + "2'-deoxyGDP", + "FlhC subunit", + "alpha-D-maltotriose", + "neo-lambda-carratetraose", + "a long-chain fatty acid", + "rhodoquinol", + "doxorubicin/out", + "holo-[(phenol)carboxyphthiodiolenone synthase]", + "a cis-alkene", + "paramyosin", + "stearoyl-sn-glycerol-3-phosphate", + "[arabinose-binding protein MSMEG_1712][side 1]", + "S-(+)-abscisic acid", + "carboxyspermidine", + "ganglioside GM4", + "2'-O-methylcytidine 1402 in 16S rRNA", + "RNA-base", + "diphosphoinositol tetrakisphosphate", + "4-[hydroxy(2-oxocyclohexyl)methyl]benzonitrile", + "phosphorylated RhoA", + "(ADP-D-ribosyl)-histone H2A", + "taxa-4(20),11(12)-dien-5alpha-yl acetyl-10beta-ol", + "pro-enkephalin", + "chrysanthemyl diphosphate", + "(R)-mandelic acid", + "a 5'-end (5'-triphosphoguanosine)-adenylyl-adenylyl-cytidyl-adenosine in mRNA", + "miltiradiene", + "N-terminal N,N-dimethyl-L-alanine-[cypemycin]", + "2-sulfanylpyridine N-oxide", + "N-3-oxooctanoyl-L-homoserine", + "[acceptor protein]-3-O-ubiquitinyl-L-threonine", + "Vasoactive intestinal peptide", + "[CcmG protein] carrying a disulfide bond", + "phosphorylated ribosomal S6 protein", + "metorphamide", + "an L-2-amino acid", + "(+)-costunolide", + "N-terminal-[eEF1A]", + "glutathione-S-transferase", + "DNA-adenine", + "oxycodone", + "methyl beta-D-xylopyranoside 2,3,4-tri-O-acetate", + "Maleylpyruvate", + "3 S-adenosyl-L-homocysteine", + "amylopectin containing alpha-1,6-glucosidic linkages", + "9-[2-deoxy-beta-D-ribofuranosyl]-6-methylpurine", + "glycocholate 3-sulfate", + "uridine-diphospho-N-acetylglucosamine", + "3-hydroxy-2-oxopropanoate", + "phosphorylated protein kinase CK2beta", + "2',4,4',6'-tetrahydroxychalcone", + "(S)-2-hydroxyacid", + "a bacteriochlorophyllide c", + "2-methyl-2-phenylpropionitrile", + "beta-D-apiofuranosyl-(1->6)-D-glucose", + "1-alkyl-sn-glycerol 3-phosphate", + "dihydrochelirubine", + "2-[(L-alanin-3-ylcarbamoyl)methyl]-2-hydroxybutanedioate", + "formylglycinamide ribonucleotide", + "an N-terminal-amino acid-[protein]", + "1-O-hexadecyl-2-O-acetyl-sn-glycero-3-phosphocholine", + "CREBL2", + "7-O-acetylsalutaridinol", + "MyoD", + "inosine", + "gallic acid", + "phosphoramidate", + "1-(2-chlorophenyl)ethanone", + "dolichyl beta-D-glucosyl phosphate", + "uracil in RNA", + "C24:0-ceramide", + "3beta-chlorocholest-5-ene", + "adenosine 3',5'-cyclic phosphate", + "9-cis-zeaxanthin", + "23S rRNA uridine1911/uridine1915/uridine1917", + "alpha-defensin-1 propeptide", + "prostatin", + "(phosphate)n+1", + "9-cis-beta-carotene", + "a [methyl-Co(III) trimethylamine-specific corrinoid protein]", + "ADAMTS-like protein 1", + "longifolene", + "levoglucosan", + "3,3',5'-triiodothyronine", + "sn-1,2-diacylglycerol", + "(2,1-beta-D-fructosyl)n", + "[beta-GlcNAc-(1,4)-Mur2Ac(oyl-L-Ala-gamma-D-Glu-L-Lys-D-Ala-D-Ala)]n", + "[FAK]-L-tyrosine", + "stigmasterol", + "4-formylbenzenesulfonate", + "2,3-bis(3-hydroxytetradecanoyl)-beta-D-glucosaminyl 1-phosphate", + "[amino group carrier protein LysW]-gamma-alpha-aminoadipate phosphate", + "Smad2", + "5'-phosphoryltermini DNA", + "3,4-dihydroxy-5-all-trans-polyprenylbenzoate", + "CX3CR1 tyrosine", + "5-hydroxyisourate", + "[pyruvate dehydrogenase (acetyl-transferring)]", + "3'-blunt-ended double-strand DNA", + "[diguanylate cyclase TpbB]-tyrosine", + "protein-L-citrulline", + "4-(2-carboxyphenyl)-4-oxobutyrate", + "3-phosphoglycerate", + "a (4R,8E)-4-hydroxysphing-8-enine ceramide", + "Manalpha(1-2)Manalpha(1-2)Manalpha(1-3)[Manalpha(1-2)Manalpha(1 6)[Manalpha(1-3)]Manalpha(1-6)]Manbeta(1-4)GlcNAcbeta(1-4)GlcNAc", + "taxadiene", + "ribostamycin", + "phosphorylated-insulin receptor substrate-1", + "Lewis X", + "5-methylcytosine49 in tRNAThr(AGU)", + "N-acetyl-beta-D-galactosaminyl-(1->4)-beta-D-glucuronosyl-(1->3)-N acetyl-beta-D-galactosaminyl-proteoglycan", + "1-oleoyl-sn-glycero-3-phosphocholine", + "phosphorylated MEK1", + "2 UDP", + "macrolide YC-17", + "5-methylcytosine50 in tRNAGly(GCC)", + "cytosine50 in tRNAAspGTC", + "2,6-dimethylheptanoyl-CoA", + "L-pipecolic acid", + "phosphorylated cyclin G1", + "apo-[C-phycocyanin alpha-subunit]", + "[sulfur-carrier protein ThiS]", + "oligogalacturonates", + "alpha-melanocyte-stimulating hormone", + "avenacoside B", + "5-aminolevulinic acid synthase", + "phosphorhodopsin", + "p53", + "a long-chain acyl-CoA", + "N-formyl-D-kynurenine", + "epidermal growth factor receptor preprotein", + "foot-and-mouth disease virus protein 2A", + "an N-acetoxyarylamine", + "reduced accepto", + "phosphorylated PKB protein kinase", + "4-cyanopyridine", + "N-palmitoyl ethanolamine", + "[histone H3R2]-L-arginine", + "streptomycin 6-phosphate", + "NAD+", + "PGC-1alpha", + "7alpha-hydroxycholesterol", + "aclacinomycin A", + "40 phosphate", + "D-lactate", + "anti-sigma factor MucA", + "folyl-poly-gamma-glutamate", + "Spo0F N-phospho-L-histidine", + "protease-activated receptor-3", + "MurNAc-pentapeptide-diphosphoundecaprenol", + "UDP-N-acetyl-3-O-(1-carboxyvinyl)-alpha-D-glucosamine", + "single-stranded RNA", + "[Fas-activated serine/threonine protein]", + "gibberellin 8", + "phosphorylated Cbp1", + "adenosylcobinamide-GDP", + "2-hydroxy-6-oxo-octa-2,4-dien-7-ynoic acid", + "2'-dADP", + "2,4,6-tris(N-acetyl-beta-D-glucosaminyl)-alpha-D-mannosyl-R", + "Vitronectin", + "D-galacto-hexodialdose", + "L-arabinose[side2]", + "1-piperideine 2-carboxylate", + "adenine34 in tRNA", + "[E2 NEDD8-conjugating enzyme]-L-cysteine", + "phosducin", + "3-ethyldibenzothiophene", + "cholesterol/out", + "3-sulfinopropanoyl-CoA", + "alpha-keto-beta-methylvaleric acid", + "core 1 oligosaccharide", + "6-O-alpha-L-arabinofuranosyl-beta-D-glucopyranoside", + "(6-4) photoproduct (in DNA)", + "gentisoyl beta-D-glucoside", + "acetyl-CoA carboxylase 2", + "double-stranded bacteriophage lambda", + "alpha-haemolysin/in", + "Formate", + "acetyl-D-tryptophan", + "(13S,14R)-13-O-acetyl-1,8-dihydroxy-N-methylcanadine", + "p-hydroxybenzoate", + "N-substituted amino acid", + "phosphoinositide-dependent kinase", + "glycoprotein phospho-D-mannose", + "Maleate", + "delta-aminolevulinic acid[side 2]", + "pro-beta-defensin", + "dihydrophloroglucinol", + "N-acetyl-cis-4-hydroxy-L-proline", + "phosphoarrestin", + "adenosine 5'-phosphoramidate", + "tRNAAsp-queuosine", + "collapsin response mediator protein-1", + "(2R)-2-[(R)-[[(2Z)-2-(2-amino-1 3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino](carboxy)methyl]-5-[(1 methylpyrrolidinium-1-yl)methyl]-3,6-dihydro-2H-1 3-thiazine-4-carboxylate", + "Bi3+-glutathione[side 1]", + "4-(ethylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-ol", + "reduced acceptor", + "lyso-platelet activating factor", + "adenylyl-molybdopterin", + "GPKRIA", + "salivary gland mucin 81 N-acetyl-D-galactosamine", + "D-tagatose", + "N-acetyl-beta-D-glucosaminyl-(1-4)-beta-D-glucuronosyl-(1-3)-N-acetyl beta-D-glucosaminyl-(1-4)-[nascent hyaluronan]", + "protocadherin 21", + "flavin", + "kinesin-like protein 2", + "cytokeratin 8", + "S-adenosyl-L-methioninamine", + "S-geranylgeranyl-RAB GTPase", + "fenamiphos", + "5beta-dihydroprogesterone", + "(5R)-3-[[2-(carbonoimidoylamino)ethyl]sulfanyl]-5-[(1S 2R)-1-carboxy-2-hydroxypropyl]-4,5-dihydro-1H-pyrrole-2-carboxylic acid", + "palmitoyl-CoA[side 1]", + "3 NADH", + "cephalexin", + "trans-3-hexenoyl-CoA", + "fusicocca-2,10(14)-diene", + "palmitoyl-[glycerolipid]", + "cytidine2498 in 23S rRNA", + "protein 6-N,6-N-dimethyl-L-lysine", + "glutathione disulfide", + "[cystine-binding protein](side 1)", + "[(2-GlcNAc)-Rib-ol-P]n-[Gro-P]m-ManNAc-GlcNAc-PP-peptidoglycan", + "2-C-methyl-D-erythritol-4-phosphate", + "2-amino-4-methylbenzonitrile", + "pentalenolactone F", + "ferrocytochrome b5", + "[dihydrolipoyllysine-residue succinyltransferase] lipoyllysine", + "protein L-isoaspartate", + "D-Man-alpha-(1->3)-[D-Man-alpha-(1->6)]-D-Man-beta-(1->4)-D-GlcNAc-beta (1->4)-D-GlcNAc-diphosphodolichol", + "cytosine50 in tRNAHis", + "triricinolein", + "troponin complex", + "plexin domain containing 2", + "mandelonitrile", + "acetone", + "deoxyinosine", + "N1-methyladenine9 in tRNA", + "holo-[L-prolyl-carrier protein]", + "dUTP", + "3-methylcatechol", + "7,12-dimethylbenz[a]anthracene-3,4-diol-1,2-epoxide", + "N-acetyl-D-galactosaminyl-osteopontin", + "alpha-actin", + "1-stearoyl-2-arachidonoyl-sn-glycerol 3-phosphate", + "Na+[side 2]", + "cis-9-octadecenoic acid", + "undecaprenyl phosphate", + "RNA binding family protein", + "glucosyl alpha(1->3)-D-mannose", + "coelenterazine", + "an N-terminal Nalpha-acetyl-L-methionyl-L-glutamyl-[protein]", + "1-butanal", + "2-N,3-O-bis[(3R)-3-hydroxytetradecanoyl]-alpha-D-glucosaminyl 1-phosphate", + "tumor-associated antigen 90K", + "aldohexosides", + "[histone H2A]-N6-acetyl-L-lysine5", + "L-enduracididine", + "lauroyl ceramide-1-phosphate", + "N-phospho-D-lombricine", + "laurate", + "3beta-hydroxytibolone", + "9 CoA", + "4-Pyridoxolactone", + "n-butyl methyl sulfide", + "prion protein 135-233", + "poly(U)", + "clofarabine 5'-phosphate", + "abieta-7,13-diene", + "behenic acid", + "phosphorylated testis-specific serine-threonine kinase 3", + "2-acetyl-1-hexadecanoyl-sn-glycero-3-phosphocholine", + "N-tetradecanoyl-glycyl-pp60c-Src", + "enoyl esters of acyl-carrier protein", + "(R)-2-methylpyrrolidine", + "3-hydroxy-phenylalkanoic acid", + "(2E,6E,10E,14E)-geranylfarnesyl diphosphate", + "5-hydroxypentanoate", + "24-methylene-cholesta-5,7-dien-3beta-ol", + "2-Methylmaleate", + "deoxynucleoside triphosphate", + "1,3-diaminopropane", + "Fuc-alpha-(1-3)-Gal", + "3-oxolauroyl-[acyl-carrier protein]", + "claspin", + "[ComD]-serine/threonine", + "alpha-(1-2)-mannobiose", + "(ADP-D-ribosyl)-cyclophilin A", + "[oxidized NADH-hemoprotein reductase]", + "6 NADPH", + "3-O-phospho-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-[alpha-D-Man-(1->3) alpha-D-Man-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)]n-alpha-D-Man (1->3)-alpha-D-Man-(1->3)-alpha-D-Man-(1->3)-alpha-D-GlcNAc-diphospho ditrans,octacis-undecaprenol", + "eukaryotic elongation factor 2", + "3-methylspermidine", + "S-(2E,6E)-farnesyl protein", + "cholesterol[side 2]", + "phosphorylated epidermal growth factor receptor", + "5-all-trans-hexaprenyl-4-hydroxy-3-methoxybenzoate", + "5-all-trans-decaprenyl-4-hydroxy-3-methoxybenzoate", + "[histone H3]-N6-acetyl-L-lysine", + "beta-D-N,N',N''-triacetylchitotriose", + "an acetyl ester", + "ERGIC53 protein", + "phosphopantetheinylated EntB", + "alpha-phellandrene", + "pollen cell-wall protein", + "Man9GlcNAc2-Asn", + "D-Lyxose", + "leader peptide", + "D-asparaginate", + "tert-butyl alcohol", + "adenine37 in tRNA1(Val)", + "N,N'-diacetylchitobiose[side 1]", + "human CXCL10", + "3'-phosphoadenosine 5'-phosphosulfate", + "an amine", + "D-glucose 1,6-bisphosphate", + "dehydroepiandrosterone sulfate/in", + "heptadecanal", + "double-stranded DNA fragments with terminal 5'-phosphate", + "phosphorylated lamin A/C", + "2 peptides of 140 kDa and 176 kDa", + "homocysteine-thiolactone", + "guanine1405 in 16S rRNA", + "phosphorylated diacylglycerol kinase-zeta", + "trichohyalin", + "thiophosphorylated myelin basic protein", + "heparan sulfate proteoglycan", + "L-2-chloropropionate", + "N1-methyladenine58 in tRNA", + "scoparol", + "D-hamamelose", + "Oplophorus luciferin", + "potato starch", + "triacylglycerol", + "(1,4-beta-D-xylan)n", + "L-Arg/out", + "(R)-citramalate", + "oligopeptide[side 2]", + "4 D-glucose", + "Kir6.2 subunit of cardiac ATP-sensitive potassium channel", + "an alkyl sulfate", + "molybdate/in", + "3 NAD+", + "(ADP-D-ribosyl)n+1-RhoA protein", + "urocanate", + "3'-O-methylnorbelladine", + "cholest-7-en-3beta-ol", + "protein chitinase 1", + "caspase-6", + "4-(1-D-ribitylamino)-5-amino-2,6-dihydroxypyrimidine", + "[TruE2]-(L-amino acyl-L-threonine)", + "[Foxo1]-N6-acetyl-L-lysine", + "3alpha,7beta-dihydroxy-5beta-cholan-24-oic acid", + "2-hydroxymuconate", + "Akt tyrosine kinase", + "neogenin", + "[YezB]-serine/threonine phosphate", + "gamma-tocotrienol", + "R-CHO", + "(20S,22S,25S)-22,25-epoxyfurost-5-ene-3beta,26-diol 3-O-beta-D-glucoside", + "O-sinapoylglucarolactone", + "L-asparagine[side 2]", + "(S)-2-hydroxypropyl-1-phosphonate", + "(2R,3R)-epiafzelechin", + "Cbz-Gln-Gly", + "desulfoglucotropeolin", + "5-hydroxyuracil", + "pro-MMP-2", + "TDP-6-deoxy-D-xylo-4-hexosulose", + "7-dehydro-dehydroepiandrosterone", + "kynuramine", + "2-methyl-1-pentanol", + "(glucomannan)n+1", + "capsular polysaccharide/out", + "taurocholic acid", + "alpha(2-3)-sialyllactose", + "fructans", + "5'-phosphooligonucleotides", + "2 dithiothreitol", + "codeinone", + "(R)-3-hydroxyoctanoate", + "gonadotropin releasing hormone", + "small acid-soluble protein gamma", + "p-aminobenzoylpentaglutamate", + "4 Fe3+", + "Fragments of elastin", + "fibrinogen-L-arginine", + "39SrpL21 protein", + "beta-N-(gamma-L-glutamyl)-4-carboxyphenylhydrazine", + "TDP-3,4-didehydro-2,6-dideoxy-alpha-D-glucose", + "(+)-(1(10)E,4E,6S,7R)-germacradien-6-ol", + "11-cis-retinal-[retinol-binding-protein]", + "3-acetylpyridine-adenine dinucleotide", + "A-kinase anchor protein", + "inositol 1,4,5-trisphosphate", + "24-methylenecycloartanol", + "galactotriose", + "4-dimethylallyl-L-abrine", + "cyclohexa-1,3-diene-1-carbonyl-CoA", + "4,4-dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol", + "ICAD", + "acetylene", + "Ca2+/out", + "soluble potato starch", + "CaV1.2 protein", + "D-norleucine", + "lysophospholipid", + "1,3,7-trimethylxanthine", + "cyclopropylglycine", + "(4S)-tetracycline", + "an [amino group carrier protein]-C-terminal-N-(1-carboxy-5-oxopentan-1-yl)-L-glutamine", + "holo-citrate lyase", + "4-hydroxy-(S)-mandelonitrile", + "leucin-rich repeats and immunoglobulin-like domains protein 2", + "L-glutamine-[L-glutamine-binding protein][side 1]", + "[rhodopsin]-S-palmitoyl-L-cysteine", + "protocadherin gamma A8", + "agmatine L-arginine", + "N-(carboxymethyl)-D-alanine", + "3-(D-glyceryl)-diphospho-5'-guanosine", + "Immunoglobulin G3", + "heptanal", + "19-(4-hydroxyphenyl)-nonadecanoyl-[(phenol)carboxyphthiodiolenone synthase]", + "pseudouridinyl-tRNA", + "6 isopentenyl diphosphate", + "N6-methyladenine in DNA", + "D-Ornithine", + "vitamin D-binding protein", + "beta-D-fructose 2,6-bisphosphate", + "adenine58 in initiator tRNAMet", + "dodecanoyl-Kdo2-lipid IVA", + "single stranded DNA", + "N-[(2S)-2-amino-2-carboxyethyl]-L-glutamate", + "4-methylthiohexanaldoxime", + "3-O-[N-acetyl-beta-D-galactosaminyl-(1->3)-N-acetyl-beta-D-glucosaminyl (1->4)-6-O-phosphono-alpha-D-mannosyl]-L-seryl-[protein]", + "collapsin response mediator protein-5", + "PACSIN 1 protein", + "GDP-beta-L-colitose", + "DL-valine", + "interferon-gamma inducing factor", + "G-protein-coupled receptor", + "2-[(3S)-3-amino-carboxypropyl]-L-histidine-[translation elongation factor 2]", + "L-arabinose-[substrate-binding protein xacG][side 1]", + "phosphorylated light-harvesting complex II", + "lectin", + "RcsA", + "(6R)-tetrahydrobiopterin", + "a reduced electron acceptor", + "L-histidine715-[translation elongation factor 2]", + "phosphorylated phosphodiesterase 5", + "Arg", + "ADAM17", + "S-geranylgeranyl-Rac", + "Arabidopsis thaliana protein AT2G26530", + "CREb protein", + "[epidermal growth factor receptor]-tyrosine phosphate", + "4-(N,N-dimethylamino)cinnamoyl-CoA", + "protein tyrosine phosphate", + "oracin", + "(9R,10E,12Z)-9-hydroxy-octadeca-10,12-dienoic acid", + "L-histidine600-[translation elongation factor 2]", + "[L-Asp(4-L-Arg)]n+1", + "N-succinyl-L-glutamate 5-semialdehyde", + "viramidine", + "hornein glutamine", + "(2R)-4,7-dihydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl beta-D-glucopyranoside", + "daidzein 7-O-beta-D-glucoside", + "N-palmitoylsphingosine", + "amylase", + "5-O-beta-D-mycaminosyltylonolide", + "1-alkyl-2-acetyl-sn-glycero-3-phosphocholine", + "topoisomerase-1", + "N-octanoyl-L-homoserine", + "N-acetyl-beta-D-galactosaminyl chondroitin sulfate oligosaccharide", + "[glutamine synthetase]-L-tyrosine", + "[FYN kinase]-tyrosine phosphate", + "maltotriose", + "Co2+[side 1]", + "(2S)-eriodictyol", + "2 pyruvate", + "3beta-hydroxy-4beta,14alpha-dimethyl-9beta 19-cyclo-5alpha-ergost-24(241)-ene-4alpha-carboxylate", + "D-glucuronic acid", + "phosphorylated TPIalpha", + "[Runx1]-L-tyrosine phosphate", + "7-chlorotryptophan", + "bombesin", + "2-O-acetyl-alpha-L-Rha-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3) alpha-D-Gal-PP-undecaprenol", + "5-methylcytosine50 in tRNAPro(UGG)", + "6 oxidized flavodoxin", + "a [protein] carrying a disulfide bond", + "1,3,6,8-Tetrahydroxynaphthalene", + "12alpha-hydroxy-3-oxo-5beta-cholan-24-oic acid", + "Cbz-Glu-Gly", + "dIMP", + "tRNAAsn", + "CYLDp25", + "CREB1", + "[H Ras]-L-cysteine", + "protein-Nomega-(ADP-D-ribosyl)-L-arginine", + "(Z)-11-tetradecenoyl-CoA", + "butan-1-ol", + "ethyl-3-oxohexanoyl-[acyl-carrier-protein]", + "N-acetyl-D-glucosamine 1-phosphate", + "N5,N10-methylenetetrahydromethanopterin", + "24-methylidenecycloartanol", + "3-Carboxy-5-oxo-2,5-dihydrofuran-2-acetate", + "androstandiol", + "(3R)-3-hydroxyarachidonoyl-[acyl-carrier protein]", + "3-hydroxyvalerate", + "cyclohexanone", + "7-methylguanosine", + "DELTA4,8-sphingadienine", + "chondroitin 6'-sulfate E", + "angiotensin-I", + "N6,N6,N6-trimethyl-L-lysine", + "phosphorylated creatine kinase", + "Nomega-methyl-L-arginine", + "lipoic acid", + "an N-terminal-L-seryl-[histone H2A]", + "16-hydroxyhexadecanoic acid", + "9alpha-hydroxy-4-androstene-3,17-dione", + "10-(N,N-dimethylaminopentyl)-2-(trifluoromethyl)phenothiazine", + "oligoxyloglucan", + "a 1-acyl-2-lyso-phosphatidylserine", + "mesoporphyrin IX", + "3-methyltyrosine", + "relaxed DNA", + "formaldehyde", + "13-apo-beta-carotenone", + "3,8-divinyl protochlorophyllide a", + "MAPKAPK2", + "lactococcin/out", + "3-methylguanine", + "phosphoribosylsuccinyl-aminoimidazole carboxamide", + "cytosine48 in tRNAAsp precursor", + "poly[(R)-3-hydroxyalkanoate]n", + "glutamate receptor subunit GluR1", + "(Z)-gamma-bisabolene", + "germacrene", + "vitamin B12-[cobalamin-binding protein][side 1]", + "cytidine34 in mitochondrial tRNA", + "5-methylcytosine38 in tRNAAsp precursor", + "dTDP-beta-L-4-epi-vancosamine", + "[GalNAc-alpha-(1->4)]4-GalNAc-alpha-(1->3)-Bac2 4diNAc-diphospho-tritrans,heptacis-undecaprenol", + "phosphorylated alpha-casein", + "transforming growth factor alpha", + "interleukin 6", + "betulinic aldehyde", + "high-molecular-weight kininogen", + "acylglycerols", + "Geranyl diphosphate", + "isopyridoxal", + "gamma-glutathione", + "2-amino-5-amino-methyl-pyrrolo[2,3-d]pyrimidin-4-one", + "18-hydroxy-corticosterone", + "NDUFS4 subunit of complex I", + "3alpha,7beta,12alpha-trihydroxy-5beta-cholanoic acid", + "phosphocholine", + "hexan-1-ol", + "phosphomevalonate", + "Src protein phosphate", + "gentamicin C1 2''-phosphate", + "Na,K-ATPase", + "2-O-alpha-D-mannopyranosyl-D-mannopyranose", + "molybdopterin-synthase sulfur-carrier protein", + "galactoscerebroside", + "cidofovir", + "2-chloro-4-nitrophenol", + "2-(acetamidomethylene)succinate", + "5-aminopentanamide", + "microtubule-associated protein 1B", + "3,4-dihydroxyphenylacetate", + "(deoxyribonucleotide)20", + "2-O-beta-D-mannosyl-di-myo-inositol-1,3'-phosphate", + "2-heptyl-4-quinolone", + "2-acyl-sn-glycero-3-phosphocholine", + "mitogen-activated protein kinase", + "Met-Phe(Phe-tRNA2)", + "valosin-containing protein", + "nuclear immunophilin FKBP46", + "2-(4-hydroxyphenyl)-2-oxoacetate", + "3-(all-trans-octaprenyl)benzene-1,2-diol", + "7 alpha-D-glucose", + "AtlS", + "protein HDAC", + "galactosylceramide", + "a [protein]-(1S,4R)-2-(C-substituted-aminomethyl)-4-acyl-2-thiazoline", + "[50S ribosomal protein L16]-L-Arg81", + "2,7-dihydroxy-4'-methoxyisoflavanone", + "a dipeptide-[dipeptide-binding protein][side 1]", + "isepamycin 2''-phosphate", + "(+)-cis,trans-nepetalactol", + "4'-hydroxyalbendazole", + "enzyme N6-(S-succinyldihydrolipoyl)lysine", + "N1-methyladenine2142 in 25S rRNA", + "vasodilator stimulated phosphoprotein", + "L-piperazate", + "a reduced flavodoxin", + "tungstate/out", + "lacto-N-tetraose", + "L-Methionine", + "N-acetyl-L-phenylalanine", + "(20S,22S,25S)-22,25-epoxyfurost-5-ene-3beta,26-diol", + "phosphorylated axonal cytoskeleton protein", + "pp(5')RNA", + "neuromedin N", + "N-acylphosphatidylethanolamine", + "phosphinothricin", + "a (4R)-4-hydroxysphinganine ceramide", + "p23 RNA", + "galacturonic acid", + "O-phospho-L-serine-tRNACys", + "uracil20 in tRNA", + "a [histone H3]-L-lysine79", + "mofetil", + "phospho-Sec2p", + "procaspase-2", + "D-2-aminobutyrate", + "VTDsYYsYPDI", + "(2R)-2-[(R)-carboxy-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid", + "N-myristoylglycylpeptide", + "3-hydroxy-beta-apo-10'-carotenal" +] \ No newline at end of file diff --git a/datasets/metabolite_inchi_smiles_brenda_pubchem.tsv b/datasets/metabolite_inchi_smiles_brenda_pubchem.tsv new file mode 100644 index 0000000000000000000000000000000000000000..642a92e50221f5492de249f9f8f3175838ba9864 --- /dev/null +++ b/datasets/metabolite_inchi_smiles_brenda_pubchem.tsv @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2f97cc4b8b0a541a2d4e190f66e5bd1256c6ee1838506ffb1755d23c2bd52898 +size 36299579 diff --git a/datasets/processed/kcat_max_wt_singleSeqs_wpdbs.csv b/datasets/processed/kcat_max_wt_singleSeqs_wpdbs.csv new file mode 100644 index 0000000000000000000000000000000000000000..4b90a828edbe09cd1cd519af2fbdb806e042efdc --- /dev/null +++ b/datasets/processed/kcat_max_wt_singleSeqs_wpdbs.csv @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2ef3287a66b0c63b4632c19f99968d5bbcd39a1a73e8dadeefb73d3a9cddf831 +size 33962798 diff --git 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+57,1561,1589,MNTQQLAKLRSIVPEMRRVRHIHFVGIGGAGMGGIAEVLANEGYQISGSDLAPNPVTQQLMNLGATIYFNHRPENVRDASVVVVSSAISADNPEIVAAHEARIPVIRRAEMLAELMRFRHGIAIAGTHGKTTTTAMVSSIYAEAGLDPTFVNGGLVKAAGVHARLGHGRYLIAEADESDASFLHLQPMVAIVTNIEADHMDTYQGDFENLKQTFINFLHNLPFYGRAVMCVDDPVIRELLPRVGRQTTTYGFSEDADVRVEDYQQIGPQGHFTLLRQDKEPMRVTLNAPGRHNALNAAAAVAVATEEGIDDEAILRALESFQGTGRRFDFLGEFPLEPVNGKSGTAMLVDDYGHHPTEVDATIKAARAGWPDKNLVMLFQPHRFTRTRDLYDDFANVLTQVDTLLMLEVYPAGEAPIPGADSRSLCRTIRGRGKIDPILVPDPARVAEMLAPVLTGNDLILVQGAGNIGKIARSLAEIKLKPQTPEEEQHD,sabio,P17952,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)O.NC(CCl)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,11.1,42.74500962786769,37.0,,6.3.2.8,562.0,1.0453229787866574,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)O.NC(CCl)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,1.0453229787866574,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)O.NC(CCl)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MNTQQLAKLRSIVPEMRRVRHIHFVGIGGAGMGGIAEVLANEGYQISGSDLAPNPVTQQLMNLGATIYFNHRPENVRDASVVVVSSAISADNPEIVAAHEARIPVIRRAEMLAELMRFRHGIAIAGTHGKTTTTAMVSSIYAEAGLDPTFVNGGLVKAAGVHARLGHGRYLIAEADESDASFLHLQPMVAIVTNIEADHMDTYQGDFENLKQTFINFLHNLPFYGRAVMCVDDPVIRELLPRVGRQTTTYGFSEDADVRVEDYQQIGPQGHFTLLRQDKEPMRVTLNAPGRHNALNAAAAVAVATEEGIDDEAILRALESFQGTGRRFDFLGEFPLEPVNGKSGTAMLVDDYGHHPTEVDATIKAARAGWPDKNLVMLFQPHRFTRTRDLYDDFANVLTQVDTLLMLEVYPAGEAPIPGADSRSLCRTIRGRGKIDPILVPDPARVAEMLAPVLTGNDLILVQGAGNIGKIARSLAEIKLKPQTPEEEQHD,./data/raw/alphafold//AF-P17952-F1-model_v4.pdb,1404,912,711,1004 +58,2680,2715,MEITSSAMLKTTTTPPHPLAGEKVPLSAFDRAAFDVFVPLVFAYRAPAPSSEAVKEGLRVAVAAYPLVSGRIAVDGQGRRRRRRVLHVNNEGVLVLDATVEVDLDAVLAANVATDLYPALPEHSFGAALLQVQLTRFGCGGLVVGLIGHHHVFDGHSMSTFCATWARAVRDSEAFIVPSPSLDRAITGVPRSPPAPVFDHRSIEFKVGNKSSDSSGAAAAAAVEKIANIGVRFTAKFVAELKARVGGRCSTFECVLAHAWKKITAARGLKPEEFTRVRVAVNCRRRANPPAPADLFGNMVLWAFPRLQVRRLLSSSYRDVVGAIRAAVARVDAEYIQSFVDYVEVADARGEELAATAAEPGETLCPDLEVDSWLGFRFHEMDLGTGPPAAVLSPDLPIEGLMILVPVGGDGGGVDLFVALADDHAQAFEQICYSLEEHAMIHSHL,sabio,Q2R0K3,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)c1ccccc1.NCCc1c[nH]c2ccccc12>>CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS.O=C(NCCc1c[nH]c2ccccc12)c1ccccc1,2.68,0.0,37.0,7.4,2.3.1.-,4530.0,0.4281347940287888,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)c1ccccc1.NCCc1c[nH]c2ccccc12,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS.O=C(NCCc1c[nH]c2ccccc12)c1ccccc1,0.4281347940287888,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)c1ccccc1.NCCc1c[nH]c2ccccc12__MEITSSAMLKTTTTPPHPLAGEKVPLSAFDRAAFDVFVPLVFAYRAPAPSSEAVKEGLRVAVAAYPLVSGRIAVDGQGRRRRRRVLHVNNEGVLVLDATVEVDLDAVLAANVATDLYPALPEHSFGAALLQVQLTRFGCGGLVVGLIGHHHVFDGHSMSTFCATWARAVRDSEAFIVPSPSLDRAITGVPRSPPAPVFDHRSIEFKVGNKSSDSSGAAAAAAVEKIANIGVRFTAKFVAELKARVGGRCSTFECVLAHAWKKITAARGLKPEEFTRVRVAVNCRRRANPPAPADLFGNMVLWAFPRLQVRRLLSSSYRDVVGAIRAAVARVDAEYIQSFVDYVEVADARGEELAATAAEPGETLCPDLEVDSWLGFRFHEMDLGTGPPAAVLSPDLPIEGLMILVPVGGDGGGVDLFVALADDHAQAFEQICYSLEEHAMIHSHL,./data/raw/alphafold//AF-Q2R0K3-F1-model_v4.pdb,1633,1235,1714,1444 +59,505,522,MIILKLGGSVITRKDSEEPAIDRDNLERIASEIGNASPSSLMIVHGAGSFGHPFAGEYRIGSEIENEEDLRRRRFGFALTQNWVKKLNSHVCDALLAEGIPAVSMQPSAFIRAHAGRISHADISLIRSYLEEGMVPVVYGDVVLDSDRRLKFSVISGDQLINHFSLRLMPERVILGTDVDGVYTRNPKKHPDARLLDVIGSLDDLESLDGTLNTDVTGGMVGKIRELLLLAEKGVESEIINAAVPGNIERALLGEEVRGTRITGKH,brenda,O26153,C=C(C)CCOP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>C=C(C)CCOP(=O)(O)OP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,27.5,0.0,37.0,7.5,2.7.4.26,145262.0,1.4393326938302626,C=C(C)CCOP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,C=C(C)CCOP(=O)(O)OP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,1.4393326938302626,C=C(C)CCOP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MIILKLGGSVITRKDSEEPAIDRDNLERIASEIGNASPSSLMIVHGAGSFGHPFAGEYRIGSEIENEEDLRRRRFGFALTQNWVKKLNSHVCDALLAEGIPAVSMQPSAFIRAHAGRISHADISLIRSYLEEGMVPVVYGDVVLDSDRRLKFSVISGDQLINHFSLRLMPERVILGTDVDGVYTRNPKKHPDARLLDVIGSLDDLESLDGTLNTDVTGGMVGKIRELLLLAEKGVESEIINAAVPGNIERALLGEEVRGTRITGKH,./data/raw/alphafold//AF-O26153-F1-model_v4.pdb,1089,659,341,385 +60,21493,21817,MFADHVFHVVDTHTEGEPTRIVLSGVNVKGEDIIEKREYFKEHYDWIRTALLHEPRGHSDQFGAVLVPSDIADFGVIYMDTSGYLDMCGHATMGVATVLVELGIIEKKEPYTTVKLETPAGLVEAKAKVKGGVVKEVTVVDVPSFYVGEFVIEYPGRGKIKVDVAFGGNFYVIADARDLGLRVRREYIKELIPTALKLIKVANEQIKVQHPRKGVQNRINLAMLTDEPEREDSDGKNVVIWGEGSVDRSPCGTGSASRVATLYSKGILKEGDIFVHESILGTQFRIKIVGTTKIGEYTAIIPEITGSAYITKISQDIISKNDPLWKGFLLR,brenda,H3ZMH5,O=C(O)[C@@H]1C[C@@H](O)CN1>>O=C(O)[C@H]1C[C@@H](O)CN1,12.13,0.0,50.0,8.0,5.1.1.8,2265.0,1.083860800866573,O=C(O)[C@@H]1C[C@@H](O)CN1,O=C(O)[C@H]1C[C@@H](O)CN1,1.083860800866573,O=C(O)[C@@H]1C[C@@H](O)CN1__MFADHVFHVVDTHTEGEPTRIVLSGVNVKGEDIIEKREYFKEHYDWIRTALLHEPRGHSDQFGAVLVPSDIADFGVIYMDTSGYLDMCGHATMGVATVLVELGIIEKKEPYTTVKLETPAGLVEAKAKVKGGVVKEVTVVDVPSFYVGEFVIEYPGRGKIKVDVAFGGNFYVIADARDLGLRVRREYIKELIPTALKLIKVANEQIKVQHPRKGVQNRINLAMLTDEPEREDSDGKNVVIWGEGSVDRSPCGTGSASRVATLYSKGILKEGDIFVHESILGTQFRIKIVGTTKIGEYTAIIPEITGSAYITKISQDIISKNDPLWKGFLLR,./data/raw/alphafold//AF-H3ZMH5-F1-model_v4.pdb,664,45,5755,6657 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+434,17474,17711,MTPEQFRQYGHQLIDLIADYRQTVGERPVMAQVEPGYLKAALPATAPQQGEPFAAILDDVNNLVMPGLSHWQHPDFYGYFPSNGTLSSVLGDFLSTGLGVLGLSWQSSPALSELEETTLDWLRQLLGLSGQWSGVIQDTASTSTLVALISARERATDYALVRGGLQAEPKPLIVYVSAHAHSSVDKAALLAGFGRDNIRLIPTDERYALRPEALQAAIEQDLAAGNQPCAVVATTGTTTTTALDPLRPVGEIAQANGLWLHVDSAMAGSAMILPECRWMWDGIELADSVVVNAHKWLGVAFDCSIYYVRDPQHLIRVMSTNPSYLQSAVDGEVKNLRDWGIPLGRRFRALKLWFMLRSEGVDALQARLRRDLDNAQWLAGQVEAAAEWEVLAPVQLQTLCIRHRPAGLEGEALDAHTKGWAERLNASGAAYVTPATLDGRWMVRVSIGALPTERGDVQRLWARLQDVIKG,brenda,Q88JU5,N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O>>NCCc1ccc(O)c(O)c1.O=C=O,1.8,7.188454001316206e-15,25.0,7.5,4.1.1.28,303.0,0.255272505103306,N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O,NCCc1ccc(O)c(O)c1.O=C=O,0.255272505103306,N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O__MTPEQFRQYGHQLIDLIADYRQTVGERPVMAQVEPGYLKAALPATAPQQGEPFAAILDDVNNLVMPGLSHWQHPDFYGYFPSNGTLSSVLGDFLSTGLGVLGLSWQSSPALSELEETTLDWLRQLLGLSGQWSGVIQDTASTSTLVALISARERATDYALVRGGLQAEPKPLIVYVSAHAHSSVDKAALLAGFGRDNIRLIPTDERYALRPEALQAAIEQDLAAGNQPCAVVATTGTTTTTALDPLRPVGEIAQANGLWLHVDSAMAGSAMILPECRWMWDGIELADSVVVNAHKWLGVAFDCSIYYVRDPQHLIRVMSTNPSYLQSAVDGEVKNLRDWGIPLGRRFRALKLWFMLRSEGVDALQARLRRDLDNAQWLAGQVEAAAEWEVLAPVQLQTLCIRHRPAGLEGEALDAHTKGWAERLNASGAAYVTPATLDGRWMVRVSIGALPTERGDVQRLWARLQDVIKG,./data/raw/alphafold//AF-Q88JU5-F1-model_v4.pdb,2797,2368,2640,5468 +435,5039,5124,MKNRRLNFKLFFLIIFSLFSTLSWSKTITLYLDPASLPALNQLMDFTQNNEDKTHPRIFGLSRFKIPDNIITQYQNIHFVELKDNRPTEALFTILDQYPGNIELNIHLNIAHSVQLIRPILAYRFKHLDRVSIQQLNLYDDGSMEYVDLEKEENKDISAEIKQAEKQLSHYLLTGKIKFDNPTIARYVWQSAFPVKYHFLSTDYFEKAEFLQPLKEYLAENYQKMDWTAYQQLTPEQQAFYLTLVGFNDEVKQSLEVQQAKFIFTGTTTWEGNTDVREYYAQQQLNLLNHFTQAEGDLFIGDHYKIYFKGHPRGGEINDYILNNAKNITNIPANISFEVLMMTGLLPDKVGGVASSLYFSLPKEKISHIIFTSNKQVKSKEDALNNPYVKVMRRLGIIDESQVIFWDSLKQL,brenda,Q15KI8,CC(O)=N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O.CC(O)=N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=N)nc3O)[C@H](O)[C@@H]2O)(C(=O)O)C[C@@H]1O>>N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1,6.7,60.19209247986228,37.0,8.5,2.4.99.6,747.0,0.8260748027008264,CC(O)=N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O.CC(O)=N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=N)nc3O)[C@H](O)[C@@H]2O)(C(=O)O)C[C@@H]1O,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1,0.8260748027008264,CC(O)=N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O.CC(O)=N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=N)nc3O)[C@H](O)[C@@H]2O)(C(=O)O)C[C@@H]1O__MKNRRLNFKLFFLIIFSLFSTLSWSKTITLYLDPASLPALNQLMDFTQNNEDKTHPRIFGLSRFKIPDNIITQYQNIHFVELKDNRPTEALFTILDQYPGNIELNIHLNIAHSVQLIRPILAYRFKHLDRVSIQQLNLYDDGSMEYVDLEKEENKDISAEIKQAEKQLSHYLLTGKIKFDNPTIARYVWQSAFPVKYHFLSTDYFEKAEFLQPLKEYLAENYQKMDWTAYQQLTPEQQAFYLTLVGFNDEVKQSLEVQQAKFIFTGTTTWEGNTDVREYYAQQQLNLLNHFTQAEGDLFIGDHYKIYFKGHPRGGEINDYILNNAKNITNIPANISFEVLMMTGLLPDKVGGVASSLYFSLPKEKISHIIFTSNKQVKSKEDALNNPYVKVMRRLGIIDESQVIFWDSLKQL,./data/raw/alphafold//AF-Q15KI8-F1-model_v4.pdb,3077,1832,3459,2267 +436,21845,22171,MAHLLLLHGPNLNLLGTREPEIYGRITLPQIDAALAERATAAGHGLSSLQSNAEHVLIERIHATPEDGTAFILINPGAFTHTSVALRDALLAVALPFVEIHLSNPYTREPFRHHSYLADKALGVVCGFGVDSYRIALEGVIARLGSDV,brenda,Q9PH97,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O>>O.O=C(O)C1=CC(=O)[C@@H](O)[C@H](O)C1,7.15,7.453857947349876e-15,25.0,8.0,4.2.1.10,2371.0,0.8543060418010806,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O,O.O=C(O)C1=CC(=O)[C@@H](O)[C@H](O)C1,0.8543060418010806,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O__MAHLLLLHGPNLNLLGTREPEIYGRITLPQIDAALAERATAAGHGLSSLQSNAEHVLIERIHATPEDGTAFILINPGAFTHTSVALRDALLAVALPFVEIHLSNPYTREPFRHHSYLADKALGVVCGFGVDSYRIALEGVIARLGSDV,./data/raw/alphafold//AF-Q9PH97-F1-model_v4.pdb,721,113,5834,6743 +437,12885,13057,MKLTKGCAYKYIIFTVLILANILYDNKKRCMIKKNLRISSCGIISRLLKSNSNYNSFNKNYNFTSAISELQFSNFWNLDILQKDIFSNIHNNKNKPQSYIIHKRLMSEKGDNNNNNHQNNNGNDNKKRLGSVVNNEENTCSDKRMKPFEEGHGITQVDKMNNNSDHLQQNGVMNLNSNNVENNNNNNSVVVKKNEPKIHYRKDYKPSGFIINNVTLNINIHDNETIVRSVLDMDISKHNVGEDLVFDGVGLKINEISINNKKLVEGEEYTYDNEFLTIFSKFVPKSKFAFSSEVIIHPETNYALTGLYKSKNIIVSQCEATGFRRITFFIDRPDMMAKYDVTVTADKEKYPVLLSNGDKVNEFEIPGGRHGARFNDPHLKPCYLFAVVAGDLKHLSATYITKYTKKKVELYVFSEEKYVSKLQWALECLKKSMAFDEDYFGLEYDLSRLNLVAVSDFNVGAMENKGLNIFNANSLLASKKNSIDFSYARILTVVGHEYFHNYTGNRVTLRDWFQLTLKEGLTVHRENLFSEEMTKTVTTRLSHVDLLRSVQFLEDSSPLSHPIRPESYVSMENFYTTTVYDKGSEVMRMYLTILGEEYYKKGFDIYIKKNDGNTATCEDFNYAMEQAYKMKKADNSANLNQYLLWFSQSGTPHVSFKYNYDAEKKQYSIHVNQYTKPDENQKEKKPLFIPISVGLINPENGKEMISQTTLELTKESDTFVFNNIAVKPIPSLFRGFSAPVYIEDNLTDEERILLLKYDSDAFVRYNSCTNIYMKQILMNYNEFLKAKNEKLESFNLTPVNAQFIDAIKYLLEDPHADAGFKSYIVSLPQDRYIINFVSNLDTDVLADTKEYIYKQIGDKLNDVYYKMFKSLEAKADDLTYFNDESHVDFDQMNMRTLRNTLLSLLSKAQYPNILNEIIEHSKSPYPSNWLTSLSVSAYFDKYFELYDKTYKLSKDDELLLQEWLKTVSRSDRKDIYEILKKLENEVLKDSKNPNDIRAVYLPFTNNLRRFHDISGKGYKLIAEVITKTDKFNPMVATQLCEPFKLWNKLDTKRQELMLNEMNTMLQEPNISNNLKEYLLRLTNKL,brenda,Q8IEK1,N=C(N)NCCC[C@H](N)C(O)=Nc1ccc2ccccc2c1.O>>N=C(N)NCCC[C@H](N)C(=O)O.Nc1ccc2ccccc2c1,21.0,0.0,37.0,7.5,3.4.11.20,5833.0,1.3222192947339193,N=C(N)NCCC[C@H](N)C(O)=Nc1ccc2ccccc2c1.O,N=C(N)NCCC[C@H](N)C(=O)O.Nc1ccc2ccccc2c1,1.3222192947339193,N=C(N)NCCC[C@H](N)C(O)=Nc1ccc2ccccc2c1.O__MKLTKGCAYKYIIFTVLILANILYDNKKRCMIKKNLRISSCGIISRLLKSNSNYNSFNKNYNFTSAISELQFSNFWNLDILQKDIFSNIHNNKNKPQSYIIHKRLMSEKGDNNNNNHQNNNGNDNKKRLGSVVNNEENTCSDKRMKPFEEGHGITQVDKMNNNSDHLQQNGVMNLNSNNVENNNNNNSVVVKKNEPKIHYRKDYKPSGFIINNVTLNINIHDNETIVRSVLDMDISKHNVGEDLVFDGVGLKINEISINNKKLVEGEEYTYDNEFLTIFSKFVPKSKFAFSSEVIIHPETNYALTGLYKSKNIIVSQCEATGFRRITFFIDRPDMMAKYDVTVTADKEKYPVLLSNGDKVNEFEIPGGRHGARFNDPHLKPCYLFAVVAGDLKHLSATYITKYTKKKVELYVFSEEKYVSKLQWALECLKKSMAFDEDYFGLEYDLSRLNLVAVSDFNVGAMENKGLNIFNANSLLASKKNSIDFSYARILTVVGHEYFHNYTGNRVTLRDWFQLTLKEGLTVHRENLFSEEMTKTVTTRLSHVDLLRSVQFLEDSSPLSHPIRPESYVSMENFYTTTVYDKGSEVMRMYLTILGEEYYKKGFDIYIKKNDGNTATCEDFNYAMEQAYKMKKADNSANLNQYLLWFSQSGTPHVSFKYNYDAEKKQYSIHVNQYTKPDENQKEKKPLFIPISVGLINPENGKEMISQTTLELTKESDTFVFNNIAVKPIPSLFRGFSAPVYIEDNLTDEERILLLKYDSDAFVRYNSCTNIYMKQILMNYNEFLKAKNEKLESFNLTPVNAQFIDAIKYLLEDPHADAGFKSYIVSLPQDRYIINFVSNLDTDVLADTKEYIYKQIGDKLNDVYYKMFKSLEAKADDLTYFNDESHVDFDQMNMRTLRNTLLSLLSKAQYPNILNEIIEHSKSPYPSNWLTSLSVSAYFDKYFELYDKTYKLSKDDELLLQEWLKTVSRSDRKDIYEILKKLENEVLKDSKNPNDIRAVYLPFTNNLRRFHDISGKGYKLIAEVITKTDKFNPMVATQLCEPFKLWNKLDTKRQELMLNEMNTMLQEPNISNNLKEYLLRLTNKL,./data/raw/alphafold//AF-Q8IEK1-F1-model_v4.pdb,1845,1536,3117,1883 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+439,18969,19254,MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVEYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDRWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,sabio,Q6SJ61,O>>,285.0,94.74099395214304,30.0,7.0,3.5.2.6,562.0,2.45484486000851,O,,2.45484486000851,O__MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVEYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDRWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,./data/raw/alphafold//AF-Q6SJ61-F1-model_v4.pdb,1458,402,35,2356 +440,22728,23068,MSASDALNSCPHVALLLSSGMGHLTPCLRFAATLVQHHCRVTIITNYPTVSVAESRAISLLLSDFPQITEKQFHLLPFDPSTANTTDPFFLRWEAIRRSAHLLNPLLSSISPPLSALVIDSSLVSSFVPVAANLDLPSYVLFTSSTRMCSLEETFPAFVASKTNFDSIQLDDVIEIPGFSPVPVSSVPPVFLNLNHLFTTMLIQNGQSFRKANGILINTFEALEGGILPGINDKRAADGLPPYCSVGPLLPCKFEKTECSAPVKWLDDQPEGSVVYVSFGSRFALSSEQIKELGDGLIRSGCRFLWVVKCKKVDQEDEESLDELLGRDVLEKIKKYGFVIKNWVNQQEILDHRAVGGFVTHGGWNSSMEAVWHGVPMLVWPQFGDQKINAEVIERSGLGMWVKRWGWGTQQLVKGEEIGERIKDLMGNNPLRVRAKTLREEARKAIEVGGSSEKTLKELIENWKKTSRKT,sabio,A0A0M4KE44,O=c1c2cc(O)c(O)cc2oc2cc(O)cc(O)c12.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1>>O=c1c2cc(O)c(O)cc2oc2cc(O)c(C3OC(CO)C(O)C(O)C3O)c(O)c12.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,0.8,0.0,45.0,9.0,2.4.1.-,29780.0,-0.0969100130080563,O=c1c2cc(O)c(O)cc2oc2cc(O)cc(O)c12.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1,O=c1c2cc(O)c(O)cc2oc2cc(O)c(C3OC(CO)C(O)C(O)C3O)c(O)c12.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,-0.0969100130080563,O=c1c2cc(O)c(O)cc2oc2cc(O)cc(O)c12.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1__MSASDALNSCPHVALLLSSGMGHLTPCLRFAATLVQHHCRVTIITNYPTVSVAESRAISLLLSDFPQITEKQFHLLPFDPSTANTTDPFFLRWEAIRRSAHLLNPLLSSISPPLSALVIDSSLVSSFVPVAANLDLPSYVLFTSSTRMCSLEETFPAFVASKTNFDSIQLDDVIEIPGFSPVPVSSVPPVFLNLNHLFTTMLIQNGQSFRKANGILINTFEALEGGILPGINDKRAADGLPPYCSVGPLLPCKFEKTECSAPVKWLDDQPEGSVVYVSFGSRFALSSEQIKELGDGLIRSGCRFLWVVKCKKVDQEDEESLDELLGRDVLEKIKKYGFVIKNWVNQQEILDHRAVGGFVTHGGWNSSMEAVWHGVPMLVWPQFGDQKINAEVIERSGLGMWVKRWGWGTQQLVKGEEIGERIKDLMGNNPLRVRAKTLREEARKAIEVGGSSEKTLKELIENWKKTSRKT,./data/raw/alphafold//AF-A0A0M4KE44-F1-model_v4.pdb,546,104,5817,6724 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+442,15728,15955,MTAPSQVLKIRRPDDWHLHLRDGDMLKTVVPYTSEIYGRAIVMPNLAPPVTTVEAAVAYRQRILDAVPAGHDFTPLMTCYLTDSLDPNELERGFNEGVFTAAKLYPANATTNSSHGVTSIDAIMPVLERMEKIGMPLLVHGEVTHADIDIFDREARFIESVMEPLRQRLTALKVVFEHITTKDAADYVRDGNERLAATITPQHLMFNRNHMLVGGVRPHLYCLPILKRNIHQQALRELVASGFNRVFLGTDSAPHARHRKESSCGCAGCFNAPTALGSYATVFEEMNALQHFEAFCSVNGPQFYGLPVNDTFIELVREEQQVAESIALTDDTLVPFLAGETVRWSVKQ,sabio,P05020,NC(=O)NC(CC(=O)O)C(=O)O>>O.O=C1CC(C(=O)O)NC(=O)N1,25.0,0.0,,5.8,3.5.2.3,562.0,1.3979400086720375,NC(=O)NC(CC(=O)O)C(=O)O,O.O=C1CC(C(=O)O)NC(=O)N1,2.2579184503140586,NC(=O)NC(CC(=O)O)C(=O)O__MTAPSQVLKIRRPDDWHLHLRDGDMLKTVVPYTSEIYGRAIVMPNLAPPVTTVEAAVAYRQRILDAVPAGHDFTPLMTCYLTDSLDPNELERGFNEGVFTAAKLYPANATTNSSHGVTSIDAIMPVLERMEKIGMPLLVHGEVTHADIDIFDREARFIESVMEPLRQRLTALKVVFEHITTKDAADYVRDGNERLAATITPQHLMFNRNHMLVGGVRPHLYCLPILKRNIHQQALRELVASGFNRVFLGTDSAPHARHRKESSCGCAGCFNAPTALGSYATVFEEMNALQHFEAFCSVNGPQFYGLPVNDTFIELVREEQQVAESIALTDDTLVPFLAGETVRWSVKQ,./data/raw/alphafold//AF-P05020-F1-model_v4.pdb,2303,4640,4668,4497 +443,335,349,MAIGTVESVAVVAVPFPAQGHLNQLMHLSLLLASRGLDVHYAAPPAHLRQARLRLHGWDPDALRSIRFHDLDVPAYESPPPDPTAPPFPSHLMPMLESFAVAARVPLAALLERLSASYRRVVVVYDRLNSFAAAQAARLPNGEAFGLQCVAMSYNIGWLDPEHRLVREHGLQFHPVEACMTKEFVELISRAEQDEENAASSGILMNTSRALEAEFIDEIATHPMFKELKLFAAGPLNPLLDATARTPGQTRHECMDWLDKQPLASVLYVSFGTTSSLRGDQVAELAAALKGSKQRFIWVLRDADRANIFADSGESRHAELLSRFTAETEGVGLVITGWAPQLEILAHGATAAFMSHCGWNSTMESLSYGKPILAWPMHSDQPWDAELVCKYLKAGLLVRPWEKHSEVVPAEAIQEVIEEAMLPEKGMTIRRRAKELGEAVRASVADGGSSRKGLDDFVGYITR,brenda,Q7XU03,C/C(=C/CNc1nc[nH]c2ncnc1-2)CO.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O>>C/C(=C/CNc1nc[nH]c2ncnc1-2)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.53,7.231527111609697e-15,30.0,6.0,2.4.1.215,39947.0,-0.2757241303992109,C/C(=C/CNc1nc[nH]c2ncnc1-2)CO.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O,C/C(=C/CNc1nc[nH]c2ncnc1-2)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-0.2757241303992109,C/C(=C/CNc1nc[nH]c2ncnc1-2)CO.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O__MAIGTVESVAVVAVPFPAQGHLNQLMHLSLLLASRGLDVHYAAPPAHLRQARLRLHGWDPDALRSIRFHDLDVPAYESPPPDPTAPPFPSHLMPMLESFAVAARVPLAALLERLSASYRRVVVVYDRLNSFAAAQAARLPNGEAFGLQCVAMSYNIGWLDPEHRLVREHGLQFHPVEACMTKEFVELISRAEQDEENAASSGILMNTSRALEAEFIDEIATHPMFKELKLFAAGPLNPLLDATARTPGQTRHECMDWLDKQPLASVLYVSFGTTSSLRGDQVAELAAALKGSKQRFIWVLRDADRANIFADSGESRHAELLSRFTAETEGVGLVITGWAPQLEILAHGATAAFMSHCGWNSTMESLSYGKPILAWPMHSDQPWDAELVCKYLKAGLLVRPWEKHSEVVPAEAIQEVIEEAMLPEKGMTIRRRAKELGEAVRASVADGGSSRKGLDDFVGYITR,./data/raw/alphafold//AF-Q7XU03-F1-model_v4.pdb,1024,566,228,248 +444,2092,2123,MTLDLDAYFARIGWTGNPRPTLEVLRSLHRAHLIGIPFENLEPVLGSAPSLALDDLEAKLVHGGRGGYCYEHNTLFSAVLRQIGFSVTPLTARVVLGAAPGDIRPRTHMLMRVDVAGEPHPYLADVGFGAVGALLEPIELVEDAELSDAPRRHRLVHAPHHGPLPLWELQAGQGGSWEPQYDFTLDPYEKPDYEVINWFIATHPRSPFRQAVYAQRTRIGSHLALSGLDLVETADDGTIRERRLEDGDEALRVLTDDFGIRLPEGVRLPE,brenda,A2V7M5,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.Nc1cc(Cl)ccc1O>>CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.CC(O)=Nc1cc(Cl)ccc1O,0.27,0.0,30.0,7.0,2.3.1.5,1911.0,-0.5686362358410126,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.Nc1cc(Cl)ccc1O,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.CC(O)=Nc1cc(Cl)ccc1O,-0.5686362358410126,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.Nc1cc(Cl)ccc1O__MTLDLDAYFARIGWTGNPRPTLEVLRSLHRAHLIGIPFENLEPVLGSAPSLALDDLEAKLVHGGRGGYCYEHNTLFSAVLRQIGFSVTPLTARVVLGAAPGDIRPRTHMLMRVDVAGEPHPYLADVGFGAVGALLEPIELVEDAELSDAPRRHRLVHAPHHGPLPLWELQAGQGGSWEPQYDFTLDPYEKPDYEVINWFIATHPRSPFRQAVYAQRTRIGSHLALSGLDLVETADDGTIRERRLEDGDEALRVLTDDFGIRLPEGVRLPE,./data/raw/alphafold//AF-A2V7M5-F1-model_v4.pdb,1531,1086,914,1251 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+774,11803,11961,MIVFLWIFVTTVLITGKSVLALNLHDFLTPKAEPAGELHALLVAGSNGWWNYRHQADVAHAYHLLLSKGILPEHIIVMMYDDIANDASNPFRGKLFNRPNGTDVYKGLKIDYSGSSVNPKNFLNVLEGNSEAVKGGNGRVINSKATDRIFVYFSDHGGEGLICFPDDVLTKKDLNSALQRMHKSKKYDEFVFYLEACESGSMFKKTLEPSMNIYAVTASNPVESSWATYCDYMDLPCLGDEFSVNWMEDSEKHDIDAEQLDAQFEDVKKMTKLSHVMHYGNLKIAKESVGWFQGEHGKKLSVQTQYEDDYPKVSWDARDVELMYMKKLQKTTTISLHAQALEQRVTQINQDRRDIEALFMSLVDNLLPNTNDKKEIFDKRNDVEDLSCHDDVVKAFDTTCIDVNRFDYALKYIYVLNNLCVKFGDSKKIINAMHATCSTATKQFL,brenda,I6R478,Cc1cc(=O)oc2cc(N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(O)OCc3ccccc3)ccc12.O>>C[C@H](N=C(O)OCc1ccccc1)C(O)=N[C@@H](C)C(O)=N[C@@H](CC(=N)O)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,0.33,9.731829052797307e-15,39.0,5.5,3.4.22.34,29172.0,-0.4814860601221125,Cc1cc(=O)oc2cc(N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(O)OCc3ccccc3)ccc12.O,C[C@H](N=C(O)OCc1ccccc1)C(O)=N[C@@H](C)C(O)=N[C@@H](CC(=N)O)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,-0.4814860601221125,Cc1cc(=O)oc2cc(N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(O)OCc3ccccc3)ccc12.O__MIVFLWIFVTTVLITGKSVLALNLHDFLTPKAEPAGELHALLVAGSNGWWNYRHQADVAHAYHLLLSKGILPEHIIVMMYDDIANDASNPFRGKLFNRPNGTDVYKGLKIDYSGSSVNPKNFLNVLEGNSEAVKGGNGRVINSKATDRIFVYFSDHGGEGLICFPDDVLTKKDLNSALQRMHKSKKYDEFVFYLEACESGSMFKKTLEPSMNIYAVTASNPVESSWATYCDYMDLPCLGDEFSVNWMEDSEKHDIDAEQLDAQFEDVKKMTKLSHVMHYGNLKIAKESVGWFQGEHGKKLSVQTQYEDDYPKVSWDARDVELMYMKKLQKTTTISLHAQALEQRVTQINQDRRDIEALFMSLVDNLLPNTNDKKEIFDKRNDVEDLSCHDDVVKAFDTTCIDVNRFDYALKYIYVLNNLCVKFGDSKKIINAMHATCSTATKQFL,./data/raw/alphafold//AF-I6R478-F1-model_v4.pdb,229,4072,1926,3758 +775,14558,14763,MASGAPSFPFSRASGPEPPAEFAKLRATNPVSQVKLFDGSLAWLVTKHKDVCFVATSEKLSKVRTRQGFPELSASGKQAAKAKPTFVDMDPPEHMHQRSMVEPTFTPEAVKNLQPYIQRTVDDLLEQMKQKGCANGPVDLVKEFALPVPSYIIYTLLGVPFNDLEYLTQQNAIRTNGSSTAREASAANQELLDYLAILVEQRLVEPKDDIISKLCTEQVKPGNIDKSDAVQIAFLLLVAGNATMVNMIALGVATLAQHPDQLAQLKANPSLAPQFVEELCRYHTASALAIKRTAKEDVMIGDKLVRANEGIIASNQSANRDEEVFENPDEFNMNRKWPPQDPLGFGFGDHRCIAEHLAKAELTTVFSTLYQKFPDLKVAVPLGKINYTPLNRDVGIVDLPVIF,uniprot_search,P23295,N=O.[NH4+]>>[N-]=[N+]=O,1200.0,5.357940169668112,10.0,7.2,1.7.1.14,5507.0,3.0791812460476247,N=O.[NH4+],[N-]=[N+]=O,3.0791812460476247,N=O.[NH4+]__MASGAPSFPFSRASGPEPPAEFAKLRATNPVSQVKLFDGSLAWLVTKHKDVCFVATSEKLSKVRTRQGFPELSASGKQAAKAKPTFVDMDPPEHMHQRSMVEPTFTPEAVKNLQPYIQRTVDDLLEQMKQKGCANGPVDLVKEFALPVPSYIIYTLLGVPFNDLEYLTQQNAIRTNGSSTAREASAANQELLDYLAILVEQRLVEPKDDIISKLCTEQVKPGNIDKSDAVQIAFLLLVAGNATMVNMIALGVATLAQHPDQLAQLKANPSLAPQFVEELCRYHTASALAIKRTAKEDVMIGDKLVRANEGIIASNQSANRDEEVFENPDEFNMNRKWPPQDPLGFGFGDHRCIAEHLAKAELTTVFSTLYQKFPDLKVAVPLGKINYTPLNRDVGIVDLPVIF,./data/raw/alphafold//AF-P23295-F1-model_v4.pdb,2404,4804,4866,4714 +776,3413,3461,MAVVYYLLLAGLIACSHALAAGTPALGDDRGRPWPASLAALALDGKLRTDSNATAAASTDFGNITSALPAAVLYPSSTGDLVALLSAANSTPGWPYTIAFRGRGHSLMGQAFAPGGVVVNMASLGDAAAPPRINVSADGRYVDAGGEQVWIDVLRASLARGVAPRSWNDYLYLTVGGTLSNAGISGQAFRHGPQISNVLEMDVITGHGEMVTCSKQLNADLFDAVLGGLGQFGVITRARIAVEPAPARARWVRFVYTDFAAFSADQERLTAPRPGGGGASFGPMSYVEGSVFVNQSLATDLANTGFFTDADVARIVALAGERNATTVYSIEATLNYDNATAAAAAVDQELASVLGTLSYVEGFAFQRDVAYAAFLDRVHGEEVALNKLGLWRVPHPWLNMFVPRSRIADFDRGVFKGILQGTDIVGPLIVYPLNKSMWDDGMSAATPSEDVFYAVSLLFSSVAPNDLARLQEQNRRILRFCDLAGIQYKTYLARHTDRSDWVRHFGAAKWNRFVEMKNKYDPKRLLSPGQDIFN,brenda,Q9T0N8,CC(C)=CCNc1nc[nH]c2ncnc1-2.O=O>>CC(C)=CC=O.Nc1nc[nH]c2ncnc1-2.OO,0.1,3.680218341235806,22.0,7.2,1.5.99.12,4577.0,-1.0,CC(C)=CCNc1nc[nH]c2ncnc1-2.O=O,CC(C)=CC=O.Nc1nc[nH]c2ncnc1-2.OO,-0.2218487496163563,CC(C)=CCNc1nc[nH]c2ncnc1-2.O=O__MAVVYYLLLAGLIACSHALAAGTPALGDDRGRPWPASLAALALDGKLRTDSNATAAASTDFGNITSALPAAVLYPSSTGDLVALLSAANSTPGWPYTIAFRGRGHSLMGQAFAPGGVVVNMASLGDAAAPPRINVSADGRYVDAGGEQVWIDVLRASLARGVAPRSWNDYLYLTVGGTLSNAGISGQAFRHGPQISNVLEMDVITGHGEMVTCSKQLNADLFDAVLGGLGQFGVITRARIAVEPAPARARWVRFVYTDFAAFSADQERLTAPRPGGGGASFGPMSYVEGSVFVNQSLATDLANTGFFTDADVARIVALAGERNATTVYSIEATLNYDNATAAAAAVDQELASVLGTLSYVEGFAFQRDVAYAAFLDRVHGEEVALNKLGLWRVPHPWLNMFVPRSRIADFDRGVFKGILQGTDIVGPLIVYPLNKSMWDDGMSAATPSEDVFYAVSLLFSSVAPNDLARLQEQNRRILRFCDLAGIQYKTYLARHTDRSDWVRHFGAAKWNRFVEMKNKYDPKRLLSPGQDIFN,./data/raw/alphafold//AF-Q9T0N8-F1-model_v4.pdb,1034,580,242,262 +777,8867,9009,MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,uniprot_search,P08246,COC(=O)CCC(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C>>,10.0,99.80789734033868,25.0,7.4,3.4.21.37,9606.0,1.0,COC(=O)CCC(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C,,1.0,COC(=O)CCC(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C__MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,./data/raw/alphafold//AF-P08246-F1-model_v4.pdb,1869,1645,3250,2040 +778,88,94,MSRNPSNSDAAHAFWSTQPVPQTEDETEKIVFAGPMDEPKTVADIPEEPYPIASTFEWWTPNMEAADDIHAIYELLRDNYVEDDDSMFRFNYSEEFLQWALCPPNYIPDWHVAVRRKADKKLLAFIAGVPVTLRMGTPKYMKVKAQEKGEGEEAAKYDEPRHICEINFLCVHKQLREKRLAPILIKEATRRVNRTNVWQAVYTAGVLLPTPYASGQYFHRSLNPEKLVEIRFSGIPAQYQKFQNPMAMLKRNYQLPSAPKNSGLREMKPSDVPQVRRILMNYLDSFDVGPVFSDAEISHYLLPRDGVVFTYVVENDKKVTDFFSFYRIPSTVIGNSNYNLLNAAYVHYYAATSIPLHQLILDLLIVAHSRGFDVCNMVEILDNRSFVEQLKFGAGDGHLRYYFYNWAYPKIKPSQVALVML,sabio,Q4Q5S8,*C(NC(=O)CN)C(=O)O.CCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O>>*C(NC(=O)CNC(=O)CCCCCCCCCCCCC)C(=O)O.CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS,24.0,2.049310602428561e-14,30.0,7.4,2.3.1.97,5664.0,1.380211241711606,*C(NC(=O)CN)C(=O)O.CCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O,*C(NC(=O)CNC(=O)CCCCCCCCCCCCC)C(=O)O.CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS,1.380211241711606,*C(NC(=O)CN)C(=O)O.CCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O__MSRNPSNSDAAHAFWSTQPVPQTEDETEKIVFAGPMDEPKTVADIPEEPYPIASTFEWWTPNMEAADDIHAIYELLRDNYVEDDDSMFRFNYSEEFLQWALCPPNYIPDWHVAVRRKADKKLLAFIAGVPVTLRMGTPKYMKVKAQEKGEGEEAAKYDEPRHICEINFLCVHKQLREKRLAPILIKEATRRVNRTNVWQAVYTAGVLLPTPYASGQYFHRSLNPEKLVEIRFSGIPAQYQKFQNPMAMLKRNYQLPSAPKNSGLREMKPSDVPQVRRILMNYLDSFDVGPVFSDAEISHYLLPRDGVVFTYVVENDKKVTDFFSFYRIPSTVIGNSNYNLLNAAYVHYYAATSIPLHQLILDLLIVAHSRGFDVCNMVEILDNRSFVEQLKFGAGDGHLRYYFYNWAYPKIKPSQVALVML,./data/raw/alphafold//AF-Q4Q5S8-F1-model_v4.pdb,3310,1603,3198,1973 +779,11108,11263,MVRISIAGGNEIDPGSMGLTLFHEHLRLITEVVRWNWPHLYNEDEELKRAIDAVNAAKKYGVKTIIDLTVAGIGCDVRFNEKVAKATGVNIIMGTGFYTYTEIPFYFKNRGIDSLVDAFVHDITIGIQGTNTRAAFVKAVIDSSGLTKDVEMAIRAAAKAHIKTDVPIITHSFVGNKSSLDLIRIFKEEGVDLARTVIGHVGDTDDISFIEQILREGAFIGLDRFGLDIYLPLDKRVKTAIELIKRGWIDQLLLSHDYCPTIDWYPPEVVRSTVPDWTMTLIFEKVIPRMRSEGITEEQINRVLIDNPRRLFTGR,brenda,F0QXN6,C[C@H]1CCC(=O)O1.O>>CC(O)CCC(=O)O,2.68,0.0,60.0,8.3,3.1.1.25,985052.0,0.4281347940287888,C[C@H]1CCC(=O)O1.O,CC(O)CCC(=O)O,0.4281347940287888,C[C@H]1CCC(=O)O1.O__MVRISIAGGNEIDPGSMGLTLFHEHLRLITEVVRWNWPHLYNEDEELKRAIDAVNAAKKYGVKTIIDLTVAGIGCDVRFNEKVAKATGVNIIMGTGFYTYTEIPFYFKNRGIDSLVDAFVHDITIGIQGTNTRAAFVKAVIDSSGLTKDVEMAIRAAAKAHIKTDVPIITHSFVGNKSSLDLIRIFKEEGVDLARTVIGHVGDTDDISFIEQILREGAFIGLDRFGLDIYLPLDKRVKTAIELIKRGWIDQLLLSHDYCPTIDWYPPEVVRSTVPDWTMTLIFEKVIPRMRSEGITEEQINRVLIDNPRRLFTGR,./data/raw/alphafold//AF-F0QXN6-F1-model_v4.pdb,3234,1051,877,1209 +780,12190,12354,GSGSAATDKFKAERATADTSPERLAAIAKDALGALNDVILKHGVTYPEYRVFKQWLIDVGEGGEWPLFLDVFIEHSVEEVLARSRKGTMGSIEGPYYIENSPELPSKCTLPMREEDEKITPLVFSGQVTDLDGNGLAGAKVELWHADNDGYYSQFAPHLPEWNLRGTIIADEEGRYEITTIQPAPYQIPTDGPTGQFIEAQNGHPWRPAHLHLIVSAPGKESVTTQLYFKGGEWIDSDVASATKPELILDPKTGDDGKNYVTYNFVLDPA,brenda,P95607,Cc1cccc(O)c1O.O=O>>C/C(=C/C=C\C(=O)O)C(=O)O,10.62,9.072476308408618e-15,25.0,7.2,1.13.11.1,37919.0,1.0261245167454502,Cc1cccc(O)c1O.O=O,C/C(=C/C=C\C(=O)O)C(=O)O,1.0261245167454502,Cc1cccc(O)c1O.O=O__GSGSAATDKFKAERATADTSPERLAAIAKDALGALNDVILKHGVTYPEYRVFKQWLIDVGEGGEWPLFLDVFIEHSVEEVLARSRKGTMGSIEGPYYIENSPELPSKCTLPMREEDEKITPLVFSGQVTDLDGNGLAGAKVELWHADNDGYYSQFAPHLPEWNLRGTIIADEEGRYEITTIQPAPYQIPTDGPTGQFIEAQNGHPWRPAHLHLIVSAPGKESVTTQLYFKGGEWIDSDVASATKPELILDPKTGDDGKNYVTYNFVLDPA,./data/raw/alphafold//AF-P95607-F1-model_v4.pdb,1996,4152,4018,3861 +781,20038,20325,MPNNLFFNAHHSPVGAFSSFTLGFPGKSGGLDLELARPPRQNVFIGVESLHESGLYHVLPFWETSGEDESKRYDIENPDPNPQKPNILIPFAKEEIQREFHVATDTWKAGDLTFTIYSPVKAVPDPETADEEALKLALVPAVIVEMKIDNTNGTRARRAFFGFEGTDPYTSMRRIDETCPQLRGVGQGRIVGIVSKDEDVRSALHFSMEDILTAQLEENWTFGLGKVGALIVDVPAGEKKTYQFAVCFYRGGYVTAGMDTSYFYTRFFNNIEEVGLYALEKAEVLKEQSFRSNELIEKEWLSDDQKFMMAHAIRSFITAIHSCLSMKESRFGVNEGEYRMMNTFDLTVDQLFFELKMNPWTVKNVLDLYVERYSYEDGVRFPGEETEYPGGISFTHDMGVANTFLRPHHSSYELYGLSGCFSHMTHEQLVNWVLCAAVYIEQTKDWAWRDKRLAILEQCLESMVRRDHPDPEKRNGIMGLDSTRTMGGAEITTYDSLDVSLGQARNNLYLAGKCWAAYVALEKLFHDVGKEELAALAGEQAEKCAATIVSYVTDDGYIPAVMGEGNDSKIIPAIEGLVFPYFTNCHEALNKDGRFGEYIQALNAHLRYVLREGICLFPDGGWKISSTSNNSWLSKIYLCQFIARHLLGWEWDEQGKRADAAHVAWLTHPTLSIWSWSDQIIAGEIKASKYYPRGVTS,sabio,V5N4G7,O.O=[N+]([O-])c1ccc(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1>>O=[N+]([O-])c1ccc(O)cc1.OC1COC(O)C(O)C1O,262.0,9.809384078968736e-15,60.0,7.0,3.2.1.37,33940.0,2.4183012913197457,O.O=[N+]([O-])c1ccc(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1,O=[N+]([O-])c1ccc(O)cc1.OC1COC(O)C(O)C1O,2.4183012913197457,O.O=[N+]([O-])c1ccc(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1__MPNNLFFNAHHSPVGAFSSFTLGFPGKSGGLDLELARPPRQNVFIGVESLHESGLYHVLPFWETSGEDESKRYDIENPDPNPQKPNILIPFAKEEIQREFHVATDTWKAGDLTFTIYSPVKAVPDPETADEEALKLALVPAVIVEMKIDNTNGTRARRAFFGFEGTDPYTSMRRIDETCPQLRGVGQGRIVGIVSKDEDVRSALHFSMEDILTAQLEENWTFGLGKVGALIVDVPAGEKKTYQFAVCFYRGGYVTAGMDTSYFYTRFFNNIEEVGLYALEKAEVLKEQSFRSNELIEKEWLSDDQKFMMAHAIRSFITAIHSCLSMKESRFGVNEGEYRMMNTFDLTVDQLFFELKMNPWTVKNVLDLYVERYSYEDGVRFPGEETEYPGGISFTHDMGVANTFLRPHHSSYELYGLSGCFSHMTHEQLVNWVLCAAVYIEQTKDWAWRDKRLAILEQCLESMVRRDHPDPEKRNGIMGLDSTRTMGGAEITTYDSLDVSLGQARNNLYLAGKCWAAYVALEKLFHDVGKEELAALAGEQAEKCAATIVSYVTDDGYIPAVMGEGNDSKIIPAIEGLVFPYFTNCHEALNKDGRFGEYIQALNAHLRYVLREGICLFPDGGWKISSTSNNSWLSKIYLCQFIARHLLGWEWDEQGKRADAAHVAWLTHPTLSIWSWSDQIIAGEIKASKYYPRGVTS,./data/raw/alphafold//AF-V5N4G7-F1-model_v4.pdb,415,2988,5333,6212 +782,19921,20207,MIMNMKNIFYCLLPGLLLGACSNKVYEKTGDSVIVKVQHKETGGPRLVRLQVMGDKLIHVSATADSKFADPQSLIVVPQKKQTSFAVVQNGDTITVSTEEVKASVLASTGEVWFTDKNGELILQENKGGGKTFTPIEVEGTKGYTVCQVFESPEDEAFYGLGQHQADEFNYKGKNEELFQYNTKVSVPFVVSNKNYGILLDSYSFCRFGNPNDYSQLNRIFKLYDKTGQEGALTGTYVPKKGETLVRREDSIYFENLKTIENLPKKLPLMGAKVTYEGEIEPAQTGEFKFILYYAGYVKVYLNNEPVVPERWRTAWNPNSYKFAAHLEAGKRVPLKIEWQPDGGQSYCGLRALTPVNPEEQGKQSWWSEMTKQLDYYFMAGENMDDVISGYRSLTGKSPVMPKWAMGFWQSREKYNTQEEMLGALKGFRDRKIPLDNIVLDWNHWPENAWGSHEFDKARFPDPKAMVDSIHAMHARMMISVWPKFYVTTEHFKEFDENGWMYQQSVKDSLKDWVGPGYHYGFYDAYDPDARKLFWKQMYEHYYPLGIDAWWMDASEPNVRDCTDLEYRKALCGPTALGSSTEFFNAYALMNAEAIYDGQRGVDNNKRVFLLTRSGFAGLQRYSTATWSGDIGTRWEDMKAQISAGLNFAMSGIPYWTMDIGGFCVENRYVAGQKQWNATKTENADYKEWRELNTRWYQFGAFVPLYRAHGQYPFREIWEIAPEGHPAYQSVVYYTKLRYNMMPYIYSLAGMTWFDDYTIMRPLVMDFTADAEVNDIGDQFMFGPSFMVSPVYRYGDRSREIYFPQAEGWYDFYSGKFQAGGERKVIEAPYERIPLYVRAGAIIPFGDDIQYTDEKPAEHIRLYIYQGADGEFTLYEDEGVNYNYEQGMYAMIPMKYDEATKTLVIGERQGEFPGMLKERTFTVVTVNKEKAQPFDLNAKGVTVKYNGSEQTLKL,sabio,A7LXT0,O.O=[N+]([O-])c1ccc(OC2OCC(O)C(O)C2O)cc1>>O=[N+]([O-])c1ccc(O)cc1.OC1COC(O)C(O)C1O,1.6,9.809384078968736e-15,37.0,6.0,3.2.1.177,28116.0,0.2041199826559248,O.O=[N+]([O-])c1ccc(OC2OCC(O)C(O)C2O)cc1,O=[N+]([O-])c1ccc(O)cc1.OC1COC(O)C(O)C1O,0.2041199826559248,O.O=[N+]([O-])c1ccc(OC2OCC(O)C(O)C2O)cc1__MIMNMKNIFYCLLPGLLLGACSNKVYEKTGDSVIVKVQHKETGGPRLVRLQVMGDKLIHVSATADSKFADPQSLIVVPQKKQTSFAVVQNGDTITVSTEEVKASVLASTGEVWFTDKNGELILQENKGGGKTFTPIEVEGTKGYTVCQVFESPEDEAFYGLGQHQADEFNYKGKNEELFQYNTKVSVPFVVSNKNYGILLDSYSFCRFGNPNDYSQLNRIFKLYDKTGQEGALTGTYVPKKGETLVRREDSIYFENLKTIENLPKKLPLMGAKVTYEGEIEPAQTGEFKFILYYAGYVKVYLNNEPVVPERWRTAWNPNSYKFAAHLEAGKRVPLKIEWQPDGGQSYCGLRALTPVNPEEQGKQSWWSEMTKQLDYYFMAGENMDDVISGYRSLTGKSPVMPKWAMGFWQSREKYNTQEEMLGALKGFRDRKIPLDNIVLDWNHWPENAWGSHEFDKARFPDPKAMVDSIHAMHARMMISVWPKFYVTTEHFKEFDENGWMYQQSVKDSLKDWVGPGYHYGFYDAYDPDARKLFWKQMYEHYYPLGIDAWWMDASEPNVRDCTDLEYRKALCGPTALGSSTEFFNAYALMNAEAIYDGQRGVDNNKRVFLLTRSGFAGLQRYSTATWSGDIGTRWEDMKAQISAGLNFAMSGIPYWTMDIGGFCVENRYVAGQKQWNATKTENADYKEWRELNTRWYQFGAFVPLYRAHGQYPFREIWEIAPEGHPAYQSVVYYTKLRYNMMPYIYSLAGMTWFDDYTIMRPLVMDFTADAEVNDIGDQFMFGPSFMVSPVYRYGDRSREIYFPQAEGWYDFYSGKFQAGGERKVIEAPYERIPLYVRAGAIIPFGDDIQYTDEKPAEHIRLYIYQGADGEFTLYEDEGVNYNYEQGMYAMIPMKYDEATKTLVIGERQGEFPGMLKERTFTVVTVNKEKAQPFDLNAKGVTVKYNGSEQTLKL,./data/raw/alphafold//AF-A7LXT0-F1-model_v4.pdb,1075,643,320,357 +783,12163,12327,MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,uniprot_search,P08246,Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Oc2c[nH]c(-c3ccccc3)c2)cc1.O>>,110.0,99.7521513264861,22.0,7.975,3.4.21.37,9606.0,2.041392685158225,Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Oc2c[nH]c(-c3ccccc3)c2)cc1.O,,3.681241237375587,Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Oc2c[nH]c(-c3ccccc3)c2)cc1.O__MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,./data/raw/alphafold//AF-P08246-F1-model_v4.pdb,1869,1645,3250,2040 +784,12996,13168,MAQGTLIRVTPEQPTHAVCVLGTLTQLDICSSAPEDCTSFSINASPGVVVDIAHGPPAKKKSTGSSTWPLDPGVEVTLTMKVASGSTGDQKVQISYYGPKTPPVKALLYLTGVEISLCADITRTGKVKPTRAVKDQRTWTWGPCGQGAILLVNCDRDNLESSAMDCEDDEVLDSEDLQDMSLMTLSTKTPKDFFTNHTLVLHVARSEMDKVRVFQATRGKLSSKCSVVLGPKWPSHYLMVPGGKHNMDFYVEALAFPDTDFPGLITLTISLLDTSNLELPEAVVFQDSVVFRVAPWIMTPNTQPPQEVYACSIFENEDFLKSVTTLAMKAKCKLTICPEEENMDDQWMQDEMEIGYIQAPHKTLPVVFDSPRNRGLKEFPIKRVMGPDFGYVTRGPQTGGISGLDSFGNLEVSPPVTVRGKEYPLGRILFGDSCYPSNDSRQMHQALQDFLSAQQVQAPVKLYSDWLSVGHVDEFLSFVPAPDRKGFRLLLASPRSCYKLFQEQQNEGHGEALLFEGIKKKKQQKIKNILSNKTLREHNSFVERCIDWNRELLKRELGLAESDIIDIPQLFKLKEFSKAEAFFPNMVNMLVLGKHLGIPKPFGPVINGRCCLEEKVCSLLEPLGLQCTFINDFFTYHIRHGEVHCGTNVRRKPFSFKWWNMVP,brenda,Q9UM07,N=C(N)NCCC[C@H](N=C(O)c1ccccc1)C(=N)O.O>>N.N=C(O)NCCC[C@H](N=C(O)c1ccccc1)C(=N)O,2.76,0.0,37.0,7.6,3.5.3.15,9606.0,0.4409090820652177,N=C(N)NCCC[C@H](N=C(O)c1ccccc1)C(=N)O.O,N.N=C(O)NCCC[C@H](N=C(O)c1ccccc1)C(=N)O,0.4409090820652177,N=C(N)NCCC[C@H](N=C(O)c1ccccc1)C(=N)O.O__MAQGTLIRVTPEQPTHAVCVLGTLTQLDICSSAPEDCTSFSINASPGVVVDIAHGPPAKKKSTGSSTWPLDPGVEVTLTMKVASGSTGDQKVQISYYGPKTPPVKALLYLTGVEISLCADITRTGKVKPTRAVKDQRTWTWGPCGQGAILLVNCDRDNLESSAMDCEDDEVLDSEDLQDMSLMTLSTKTPKDFFTNHTLVLHVARSEMDKVRVFQATRGKLSSKCSVVLGPKWPSHYLMVPGGKHNMDFYVEALAFPDTDFPGLITLTISLLDTSNLELPEAVVFQDSVVFRVAPWIMTPNTQPPQEVYACSIFENEDFLKSVTTLAMKAKCKLTICPEEENMDDQWMQDEMEIGYIQAPHKTLPVVFDSPRNRGLKEFPIKRVMGPDFGYVTRGPQTGGISGLDSFGNLEVSPPVTVRGKEYPLGRILFGDSCYPSNDSRQMHQALQDFLSAQQVQAPVKLYSDWLSVGHVDEFLSFVPAPDRKGFRLLLASPRSCYKLFQEQQNEGHGEALLFEGIKKKKQQKIKNILSNKTLREHNSFVERCIDWNRELLKRELGLAESDIIDIPQLFKLKEFSKAEAFFPNMVNMLVLGKHLGIPKPFGPVINGRCCLEEKVCSLLEPLGLQCTFINDFFTYHIRHGEVHCGTNVRRKPFSFKWWNMVP,./data/raw/alphafold//AF-Q9UM07-F1-model_v4.pdb,3362,2229,3919,2793 +785,1560,1588,MNTQQLAKLRSIVPEMRRVRHIHFVGIGGAGMGGIAEVLANEGYQISGSDLAPNPVTQQLMNLGATIYFNHRPENVRDASVVVVSSAISADNPEIVAAHEARIPVIRRAEMLAELMRFRHGIAIAGTHGKTTTTAMVSSIYAEAGLDPTFVNGGLVKAAGVHARLGHGRYLIAEADESDASFLHLQPMVAIVTNIEADHMDTYQGDFENLKQTFINFLHNLPFYGRAVMCVDDPVIRELLPRVGRQTTTYGFSEDADVRVEDYQQIGPQGHFTLLRQDKEPMRVTLNAPGRHNALNAAAAVAVATEEGIDDEAILRALESFQGTGRRFDFLGEFPLEPVNGKSGTAMLVDDYGHHPTEVDATIKAARAGWPDKNLVMLFQPHRFTRTRDLYDDFANVLTQVDTLLMLEVYPAGEAPIPGADSRSLCRTIRGRGKIDPILVPDPARVAEMLAPVLTGNDLILVQGAGNIGKIARSLAEIKLKPQTPEEEQHD,sabio,P17952,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)O.CC(N)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)NC(C)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,6.85,0.0,37.0,,6.3.2.8,562.0,0.8356905714924255,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)O.CC(N)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)NC(C)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,0.8356905714924255,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)O.CC(N)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MNTQQLAKLRSIVPEMRRVRHIHFVGIGGAGMGGIAEVLANEGYQISGSDLAPNPVTQQLMNLGATIYFNHRPENVRDASVVVVSSAISADNPEIVAAHEARIPVIRRAEMLAELMRFRHGIAIAGTHGKTTTTAMVSSIYAEAGLDPTFVNGGLVKAAGVHARLGHGRYLIAEADESDASFLHLQPMVAIVTNIEADHMDTYQGDFENLKQTFINFLHNLPFYGRAVMCVDDPVIRELLPRVGRQTTTYGFSEDADVRVEDYQQIGPQGHFTLLRQDKEPMRVTLNAPGRHNALNAAAAVAVATEEGIDDEAILRALESFQGTGRRFDFLGEFPLEPVNGKSGTAMLVDDYGHHPTEVDATIKAARAGWPDKNLVMLFQPHRFTRTRDLYDDFANVLTQVDTLLMLEVYPAGEAPIPGADSRSLCRTIRGRGKIDPILVPDPARVAEMLAPVLTGNDLILVQGAGNIGKIARSLAEIKLKPQTPEEEQHD,./data/raw/alphafold//AF-P17952-F1-model_v4.pdb,1404,912,711,1004 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+949,12514,12684,MKKSLSATLISALLAFSAPGFSAADNVAAVVDSTIKPLMAQQDIPGMAVAVSVKGKPYYFNYGFADVQAKQPVTENTLFELGSVSKTFTGVLGAVSVAKKEMTLNDPAEKYQPELALPQWKGITLLDLATYTAGGLPLQVPDAVKSRADLLHFYQQWQPSRKPGDMRLYANSSIGLFGALTANAAGMPYDQLLTARILAPLGLSHTFITVPESAQSQYAYGYKNKKPVRVSPGQLDAESYGVKSASKDMLRWAEMNMEPSRAGNADLEMAMYLAQTRYYKTAAINQGLGWEMYDWPQQKDMIINGVTNEVALQPHPVTDNQVQPYNRASWVHKTGATTGFGAYVAFIPEKQVAIVILANKNYPNTERVKAAQAILSALE,brenda,Q704Z0,Cc1onc(-c2ccccc2)c1C(O)=N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O.O>>,0.022,99.76216468193093,30.0,7.0,3.5.2.6,180434.0,-1.6575773191777938,Cc1onc(-c2ccccc2)c1C(O)=N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O.O,,-1.6575773191777938,Cc1onc(-c2ccccc2)c1C(O)=N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O.O__MKKSLSATLISALLAFSAPGFSAADNVAAVVDSTIKPLMAQQDIPGMAVAVSVKGKPYYFNYGFADVQAKQPVTENTLFELGSVSKTFTGVLGAVSVAKKEMTLNDPAEKYQPELALPQWKGITLLDLATYTAGGLPLQVPDAVKSRADLLHFYQQWQPSRKPGDMRLYANSSIGLFGALTANAAGMPYDQLLTARILAPLGLSHTFITVPESAQSQYAYGYKNKKPVRVSPGQLDAESYGVKSASKDMLRWAEMNMEPSRAGNADLEMAMYLAQTRYYKTAAINQGLGWEMYDWPQQKDMIINGVTNEVALQPHPVTDNQVQPYNRASWVHKTGATTGFGAYVAFIPEKQVAIVILANKNYPNTERVKAAQAILSALE,./data/raw/alphafold//AF-Q704Z0-F1-model_v4.pdb,1456,986,797,1111 +950,10046,10197,MTHSQRRDKLKAQIAASGLDAMLISDLINVRYLSGFSGSNGALLVFADERDAVLATDGRYRTQAASQAPDLEVAIERAVGRYLAGRAGEAGVGKLGFESHVVTVDGLDALAGALEGKNTELVRASGTVESLREVKDAGELALLRLACEAADAALTDLVARGGLRPGRTERQVSRELEALMLDHGADAVSFETIVAAGANSAIPHHRPTDAVLQVGDFVKIDFGALVAGYHSDMTRTFVLGKAADWQLEIYQLVAEAQQAGRQALLPGAELRGVDAAARQLIADAGYGEHFGHGLGHGVGLQIHEAPGIGVTSAGTLLAGSVVTVEPGVYLPGRGGVRIEDTLVVAGGTPKMPETAGQTPELLTRFPKELAIL,brenda,I6YDN6,CSCC[C@H](N)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)O.O>>CSCC[C@H](N)C(=O)O.C[C@H](N)C(O)=N[C@@H](C)C(=O)O,5.0,9.171606977489936e-15,55.0,8.0,3.4.11.9,1773.0,0.6989700043360189,CSCC[C@H](N)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)O.O,CSCC[C@H](N)C(=O)O.C[C@H](N)C(O)=N[C@@H](C)C(=O)O,0.6989700043360189,CSCC[C@H](N)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)O.O__MTHSQRRDKLKAQIAASGLDAMLISDLINVRYLSGFSGSNGALLVFADERDAVLATDGRYRTQAASQAPDLEVAIERAVGRYLAGRAGEAGVGKLGFESHVVTVDGLDALAGALEGKNTELVRASGTVESLREVKDAGELALLRLACEAADAALTDLVARGGLRPGRTERQVSRELEALMLDHGADAVSFETIVAAGANSAIPHHRPTDAVLQVGDFVKIDFGALVAGYHSDMTRTFVLGKAADWQLEIYQLVAEAQQAGRQALLPGAELRGVDAAARQLIADAGYGEHFGHGLGHGVGLQIHEAPGIGVTSAGTLLAGSVVTVEPGVYLPGRGGVRIEDTLVVAGGTPKMPETAGQTPELLTRFPKELAIL,./data/raw/alphafold//AF-I6YDN6-F1-model_v4.pdb,3600,3570,1353,3311 +951,17245,17476,MKLYYKVGACSLAPHIILSEAGLPYELEAVDLKAKKTADGGDYFAVNPRGAVPALEVKPGTVITQNAAILQYIGDHSDVAAFKPAYGSIERARLQEALGFCSDLHAAFSGLFAPNLSEEARAGVIANINRRLGQLEAMLSDKNAYWLGDDFTQPDAYASVIIGWGVGQKLDLSAYPKALKLRERVLARPNVQKAFKEEGLN,brenda,P81065,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1>>Cl.N[C@@H](CCC(O)=N[C@@H](CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=NCC(=O)O)C(=O)O,2.35,2.7843620188059523e-14,30.0,8.0,2.5.1.18,529.0,0.3710678622717362,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1,Cl.N[C@@H](CCC(O)=N[C@@H](CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=NCC(=O)O)C(=O)O,0.3710678622717362,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1__MKLYYKVGACSLAPHIILSEAGLPYELEAVDLKAKKTADGGDYFAVNPRGAVPALEVKPGTVITQNAAILQYIGDHSDVAAFKPAYGSIERARLQEALGFCSDLHAAFSGLFAPNLSEEARAGVIANINRRLGQLEAMLSDKNAYWLGDDFTQPDAYASVIIGWGVGQKLDLSAYPKALKLRERVLARPNVQKAFKEEGLN,./data/raw/alphafold//AF-P81065-F1-model_v4.pdb,3472,3386,1120,3036 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+956,19087,19373,METSMACCSRSIVLPRVSPQHSSALVPSSINLKSLKSSSLFGESLRMTTKSSVRVNKAKNSSLVTKCELGDSLEEFLAKATTDKGLIRLMMCMGEALRTIGFKVRTASCGGTQCVNTFGDEQLAIDVLADKLLFEALNYSHFCKYACSEELPELQDMGGPVDGGFSVAFDPLDGSSIVDTNFSVGTIFGVWPGDKLTGVTGRDQVAAAMGIYGPRTTYVLALKDYPGTHEFLLLDEGKWQHVKETTEINEGKLFCPGNLRATSDNADYAKLIQYYIKEKYTLRYTGGMVPDVNQIIVKEKGIFTNVISPTAKAKLRLLFEVAPLGFLIEKAGGHSSEGTKSVLDIEVKNLDDRTQVAYGSLNEIIRFEKTLYGSSRLEEPVPVGAAA,sabio,O20252,O.O=C(COP(=O)(O)O)C(O)C(O)C(O)C(O)COP(=O)(O)O>>O=C(CO)C(O)C(O)C(O)C(O)COP(=O)(O)O.O=P(O)(O)O,81.0,1.4625675434719232e-14,30.0,8.2,3.1.3.37,3562.0,1.9084850188786493,O.O=C(COP(=O)(O)O)C(O)C(O)C(O)C(O)COP(=O)(O)O,O=C(CO)C(O)C(O)C(O)C(O)COP(=O)(O)O.O=P(O)(O)O,1.9084850188786493,O.O=C(COP(=O)(O)O)C(O)C(O)C(O)C(O)COP(=O)(O)O__METSMACCSRSIVLPRVSPQHSSALVPSSINLKSLKSSSLFGESLRMTTKSSVRVNKAKNSSLVTKCELGDSLEEFLAKATTDKGLIRLMMCMGEALRTIGFKVRTASCGGTQCVNTFGDEQLAIDVLADKLLFEALNYSHFCKYACSEELPELQDMGGPVDGGFSVAFDPLDGSSIVDTNFSVGTIFGVWPGDKLTGVTGRDQVAAAMGIYGPRTTYVLALKDYPGTHEFLLLDEGKWQHVKETTEINEGKLFCPGNLRATSDNADYAKLIQYYIKEKYTLRYTGGMVPDVNQIIVKEKGIFTNVISPTAKAKLRLLFEVAPLGFLIEKAGGHSSEGTKSVLDIEVKNLDDRTQVAYGSLNEIIRFEKTLYGSSRLEEPVPVGAAA,./data/raw/alphafold//AF-O20252-F1-model_v4.pdb,238,2759,5072,5932 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+986,15580,15804,MEPFVVLVLCLSFMLLFSLWRQSCRRRKLPPGPTPLPIIGNMLQIDVKDICKSFTNFSKVYGPVFTVYFGMNPIVVFHGYEAVKEALIDNGEEFSGRGNSPISQRITKGLGIISSNGKRWKEIRRFSLTTLRNFGMGKRSIEDRVQEEAHCLVEELRKTKASPCDPTFILGCAPCNVICSVVFQKRFDYKDQNFLTLMKRFNENFRILNSPWIQVCNNFPLLIDCFPGTHNKVLKNVALTRSYIREKVKEHQASLDVNNPRDFIDCFLIKMEQEKDNQKSEFNIENLVGTVADLFVAGTETTSTTLRYGLLLLLKHPEVTAKVQEEIDHVIGRHRSPCMQDRSHMPYTDAVVHEIQRYSDLVPTGVPHAVTTDTKFRNYLIPKGTTIMALLTSVLHDDKEFPNPNIFDPGHFLDKNGNFKKSDYFMPFSAGKRICAGEGLARMELFLFLTTILQNFNLKSVDDLKNLNTTAVTKGIVSLPPSYQICFIPV,sabio,P10632,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.O=O>>NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1.O,240.0,0.972901408633524,28.0,7.4,1.14.14.1,9606.0,2.380211241711606,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.O=O,NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1.O,2.380211241711606,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.O=O__MEPFVVLVLCLSFMLLFSLWRQSCRRRKLPPGPTPLPIIGNMLQIDVKDICKSFTNFSKVYGPVFTVYFGMNPIVVFHGYEAVKEALIDNGEEFSGRGNSPISQRITKGLGIISSNGKRWKEIRRFSLTTLRNFGMGKRSIEDRVQEEAHCLVEELRKTKASPCDPTFILGCAPCNVICSVVFQKRFDYKDQNFLTLMKRFNENFRILNSPWIQVCNNFPLLIDCFPGTHNKVLKNVALTRSYIREKVKEHQASLDVNNPRDFIDCFLIKMEQEKDNQKSEFNIENLVGTVADLFVAGTETTSTTLRYGLLLLLKHPEVTAKVQEEIDHVIGRHRSPCMQDRSHMPYTDAVVHEIQRYSDLVPTGVPHAVTTDTKFRNYLIPKGTTIMALLTSVLHDDKEFPNPNIFDPGHFLDKNGNFKKSDYFMPFSAGKRICAGEGLARMELFLFLTTILQNFNLKSVDDLKNLNTTAVTKGIVSLPPSYQICFIPV,./data/raw/alphafold//AF-P10632-F1-model_v4.pdb,1176,3892,3238,2024 +987,4707,4765,MNTVSPAKKKVIIIGAGIAGLKAASTLHQNGIQDCLVLEARDRVGGRLQTVTGYQGRKYDIGASWHHDTLTNPLFLEEAQLSLNDGRTRFVFDDDNFIYIDEERGRVDHDKELLLEIVDNEMSKFAELEFHQHLGVSDCSFFQLVMKYLLQRRQFLTNDQIRYLPQLCRYLELWHGLDWKLLSAKDTYFGHQGRNAFALNYDSVVQRIAQSFPQNWLKLSCEVKSITREPSKNVTVNCEDGTVYNADYVIITVPQSVLNLSVQPEKNLRGRIEFQPPLKPVIQDAFDKIHFGALGKVIFEFEECCWSNESSKIVTLANSTNEFVEIVRNAENLDELDSMLEREDSQKHTSVTCWSQPLFFVNLSKSTGVASFMMLMQAPLTNHIESIREDKERLFSFFQPVLNKIMKCLDSEDVIDGMRPIENIANANKPVLRNIIVSNWTRDPYSRGAYSACFPGDDPVDMVVAMSNGQDSRIRFAGEHTIMDGAGCAYGAWESGRREATRISDLLK,brenda,P50264,CC(O)=NCCCNCCCCNCCCN.O.O=O>>CC(O)=NCCC=O.NCCCCNCCCN.OO,15.1,1.9275751065056168e-14,25.0,9.0,1.5.3.17,4932.0,1.1789769472931697,CC(O)=NCCCNCCCCNCCCN.O.O=O,CC(O)=NCCC=O.NCCCCNCCCN.OO,1.1789769472931697,CC(O)=NCCCNCCCCNCCCN.O.O=O__MNTVSPAKKKVIIIGAGIAGLKAASTLHQNGIQDCLVLEARDRVGGRLQTVTGYQGRKYDIGASWHHDTLTNPLFLEEAQLSLNDGRTRFVFDDDNFIYIDEERGRVDHDKELLLEIVDNEMSKFAELEFHQHLGVSDCSFFQLVMKYLLQRRQFLTNDQIRYLPQLCRYLELWHGLDWKLLSAKDTYFGHQGRNAFALNYDSVVQRIAQSFPQNWLKLSCEVKSITREPSKNVTVNCEDGTVYNADYVIITVPQSVLNLSVQPEKNLRGRIEFQPPLKPVIQDAFDKIHFGALGKVIFEFEECCWSNESSKIVTLANSTNEFVEIVRNAENLDELDSMLEREDSQKHTSVTCWSQPLFFVNLSKSTGVASFMMLMQAPLTNHIESIREDKERLFSFFQPVLNKIMKCLDSEDVIDGMRPIENIANANKPVLRNIIVSNWTRDPYSRGAYSACFPGDDPVDMVVAMSNGQDSRIRFAGEHTIMDGAGCAYGAWESGRREATRISDLLK,./data/raw/alphafold//AF-P50264-F1-model_v4.pdb,2966,1708,3321,2124 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+1015,8747,8884,MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVKYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDHWEPELNEAIPNDERDTTTPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGASERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,brenda,Q8KQ59,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1ccco1.O>>,2.0,99.77447305629605,30.0,7.0,3.5.2.6,573.0,0.3010299956639812,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1ccco1.O,,0.3010299956639812,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1ccco1.O__MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVKYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDHWEPELNEAIPNDERDTTTPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGASERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,./data/raw/alphafold//AF-Q8KQ59-F1-model_v4.pdb,1458,402,35,1126 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+1017,18936,19220,MPIKKPCLKLNLDSLNVVRSEIPQMLSANERLKNNFNILYNQIRQYPAYYFKVASNVPTYSDICQSFSVMYQGFQIVNHSGDVFIHACRENPQSKGDFVGDKFHISIAREQVPLAFQILSGLLFSEDSPIDKWKITDMNRVSQQSRVGIGAQFTLYVKSDQECSQYSALLLHKIRQFIMCLESNLLRSKIAPGEYPASDVRPEDWKYVSYRNELRSDRDGSERQEQMLREEPFYRLMIE,sabio,Q8VSP9,O>>*C(N)C(=O)NC(*)C(=O)O.O=P(O)(O)O,0.7,85.01489203276248,30.0,7.4,4.2.3.-,623.0,-0.1549019599857432,O,*C(N)C(=O)NC(*)C(=O)O.O=P(O)(O)O,0.1072099696478683,O__MPIKKPCLKLNLDSLNVVRSEIPQMLSANERLKNNFNILYNQIRQYPAYYFKVASNVPTYSDICQSFSVMYQGFQIVNHSGDVFIHACRENPQSKGDFVGDKFHISIAREQVPLAFQILSGLLFSEDSPIDKWKITDMNRVSQQSRVGIGAQFTLYVKSDQECSQYSALLLHKIRQFIMCLESNLLRSKIAPGEYPASDVRPEDWKYVSYRNELRSDRDGSERQEQMLREEPFYRLMIE,./data/raw/alphafold//AF-Q8VSP9-F1-model_v4.pdb,210,2726,5037,5889 +1018,4507,4562,MGTKGKVIKCKAAIAWEAGKPLCIEEVEVAPPKAHEVRIQIIATSLCHTDATVIDSKFEGLAFPVIVGHEAAGIVESIGPGVTNVKPGDKVIPLYAPLCRKCKFCLSPLTNLCGKISNLKSPASDQQLMEDKTSRFTCKGKPVYHFFGTSTFSQYTVVSDINLAKIDDDANLERVCLLGCGFSTGYGAAINNAKVTPGSTCAVFGLGGVGLSAVMGCKAAGASRIIGIDINSEKFVKAKALGATDCLNPRDLHKPIQEVIIELTKGGVDFALDCAGGSETMKAALDCTTAGWGSCTFIGVAAGSKGLTIFPEELIIGRTINGTFFGGWKSVDSIPKLVTDYKNKKFNLDALVTHTLPFDKISEAFDLMNQGKSVRTILIF,sabio,P08319,CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CCO.NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1>>CC(C=CC=C(C)C=CC1=C(C)CCCC1(C)C)=CC=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,11400.0,0.0530028089385531,25.0,7.5,1.1.1.1,9606.0,4.056904851336473,CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CCO.NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,CC(C=CC=C(C)C=CC1=C(C)CCCC1(C)C)=CC=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,4.056904851336473,CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CCO.NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MGTKGKVIKCKAAIAWEAGKPLCIEEVEVAPPKAHEVRIQIIATSLCHTDATVIDSKFEGLAFPVIVGHEAAGIVESIGPGVTNVKPGDKVIPLYAPLCRKCKFCLSPLTNLCGKISNLKSPASDQQLMEDKTSRFTCKGKPVYHFFGTSTFSQYTVVSDINLAKIDDDANLERVCLLGCGFSTGYGAAINNAKVTPGSTCAVFGLGGVGLSAVMGCKAAGASRIIGIDINSEKFVKAKALGATDCLNPRDLHKPIQEVIIELTKGGVDFALDCAGGSETMKAALDCTTAGWGSCTFIGVAAGSKGLTIFPEELIIGRTINGTFFGGWKSVDSIPKLVTDYKNKKFNLDALVTHTLPFDKISEAFDLMNQGKSVRTILIF,./data/raw/alphafold//AF-P08319-F1-model_v4.pdb,1323,1999,3215,1992 +1019,9609,9755,MGILSYLCYSLFYLSIFFIIRLLFQSRKFKNLPPGPTSLPIIGNLHHLKRPLNRTFKALTEKYGNVISLWFGSRLVVVVSSLSEFQECFTKNDVVLANRPRFLSGKYIFYNYTTLGSTSYGEHWRNLRRITSLDVLSNHRINNFAPIRRDETQRLIKKLAEDSSTKFAEVELTFRFFDMTFNNIMRMISGKRYYGDDCDISEVQEASQFRDMVSELLQLSGANNKTDFMPLLKFLDFENLEKRVKRIGEKNDVFLSGLLQEQRSKKERTNTMIDHLLNMQESQPEYYTDTIIKGLCLAMLLAGTDSSAVTLEWTMSNILNYPEVLKKVRDEVDTHVGQDRLVDESDLPKLTYLRNVIYETLRLYTPAPLLLPHSTADECIMGGYKVPRDTIVLINAWAIHRDPETWSEATTFKPERFDKKGELEKMIAFGMGRRACPGEGLALRAISMTLALLVQCFDWKRINDEKIDMSERDGFTMTKLLPLKAMCKTRPVVNKVFK,brenda,Q6WNR0,COc1ccc(-c2coc3cc(O)ccc3c2=O)cc1.O=O>>COc1ccc(-c2coc3cc(O)ccc3c2=O)c(O)c1.O,0.015,10000000.0,24.0,8.0,1.14.14.90,3880.0,-1.8239087409443189,COc1ccc(-c2coc3cc(O)ccc3c2=O)cc1.O=O,COc1ccc(-c2coc3cc(O)ccc3c2=O)c(O)c1.O,-1.8239087409443189,COc1ccc(-c2coc3cc(O)ccc3c2=O)cc1.O=O__MGILSYLCYSLFYLSIFFIIRLLFQSRKFKNLPPGPTSLPIIGNLHHLKRPLNRTFKALTEKYGNVISLWFGSRLVVVVSSLSEFQECFTKNDVVLANRPRFLSGKYIFYNYTTLGSTSYGEHWRNLRRITSLDVLSNHRINNFAPIRRDETQRLIKKLAEDSSTKFAEVELTFRFFDMTFNNIMRMISGKRYYGDDCDISEVQEASQFRDMVSELLQLSGANNKTDFMPLLKFLDFENLEKRVKRIGEKNDVFLSGLLQEQRSKKERTNTMIDHLLNMQESQPEYYTDTIIKGLCLAMLLAGTDSSAVTLEWTMSNILNYPEVLKKVRDEVDTHVGQDRLVDESDLPKLTYLRNVIYETLRLYTPAPLLLPHSTADECIMGGYKVPRDTIVLINAWAIHRDPETWSEATTFKPERFDKKGELEKMIAFGMGRRACPGEGLALRAISMTLALLVQCFDWKRINDEKIDMSERDGFTMTKLLPLKAMCKTRPVVNKVFK,./data/raw/alphafold//AF-Q6WNR0-F1-model_v4.pdb,3555,3511,1283,3232 +1020,18215,18475,MPLELTQSRVQKIWVPVDHRPSLPRSCGPKLTNSPTVIVMVGLPARGKTYISKKLTRYLNWIGVPTKVFNVGEYRREAVKQYSSYNFFRPDNEEAMKVRKQCALAALRDVKSYLAKEGGQIAVFDATNTTRERRHMILHFAKENDFKAFFIESVCDDPTVVASNIMEVKISSPDYKDCNSAEAMDDFMKRISCYEASYQPLDPDKCDRDLSLIKVIDVGRRFLVNRVQDHIQSRIVYYLMNIHVQPRTIYLCRHGENEHNLQGRIGGDSGLSSRGKKFASALSKFVEEQNLKDLRVWTSQLKSTIQTAEALRLPYEQWKALNEIDAGVCEELTYEEIRDTYPEEYALREQDKYYYRYPTGESYQDLVQRLEPVIMELERQENVLVICHQAVLRCLLAYFLDKSAEEMPYLKCPLHTVLKLTPVAYGCRVESIYLNVESVCTHRERSEDAKKGPNPLMRRNSVTPLASPEPTKKPRINSFEEHVASTSAALPSCLPPEVPTQLPGQNMKGSRSSADSSRKH,sabio,Q16875,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)(CO)C(O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(CO)(OP(=O)(O)O)C(O)C1O,0.14,0.0,25.0,8.5,2.7.1.105,9606.0,-0.8538719643217619,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)(CO)C(O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(CO)(OP(=O)(O)O)C(O)C1O,-0.8538719643217619,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)(CO)C(O)C1O__MPLELTQSRVQKIWVPVDHRPSLPRSCGPKLTNSPTVIVMVGLPARGKTYISKKLTRYLNWIGVPTKVFNVGEYRREAVKQYSSYNFFRPDNEEAMKVRKQCALAALRDVKSYLAKEGGQIAVFDATNTTRERRHMILHFAKENDFKAFFIESVCDDPTVVASNIMEVKISSPDYKDCNSAEAMDDFMKRISCYEASYQPLDPDKCDRDLSLIKVIDVGRRFLVNRVQDHIQSRIVYYLMNIHVQPRTIYLCRHGENEHNLQGRIGGDSGLSSRGKKFASALSKFVEEQNLKDLRVWTSQLKSTIQTAEALRLPYEQWKALNEIDAGVCEELTYEEIRDTYPEEYALREQDKYYYRYPTGESYQDLVQRLEPVIMELERQENVLVICHQAVLRCLLAYFLDKSAEEMPYLKCPLHTVLKLTPVAYGCRVESIYLNVESVCTHRERSEDAKKGPNPLMRRNSVTPLASPEPTKKPRINSFEEHVASTSAALPSCLPPEVPTQLPGQNMKGSRSSADSSRKH,./data/raw/alphafold//AF-Q16875-F1-model_v4.pdb,51,2523,2815,5661 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+1238,12133,12296,GIASPYAPMGVATPVDGGYILNGRWSFSSGTDHCDWVMIGAAVGDKDGNRLNPPQSLHVLLPRSDYRIDHDSWNVVGLRGTGSKDLIVENAFLPEYRTLRAERVMGGVAWQDAGRDETLYKFPFSCIFPLGITSSLIGIAEGALNCYIESQRERVTVSGTAIKQDPYVLSNLGDAAAEIAASRAALLETVDRFWDLTERGIRGHLRATRDRTPDPGRRGHGGPCAPSNEIFFAGRRAGALQLSNPLQRFWRDAHAGLSHAIHVPGSIFHAATLTQLGEEPQGMNAGR,brenda,Q6QF57,Cc1ccc(O)c(O)c1.O=O>>CC(/C=C(\O)C(=O)O)=C\C=O,2.0,0.0,80.0,,1.13.11.39,103816.0,0.3010299956639812,Cc1ccc(O)c(O)c1.O=O,CC(/C=C(\O)C(=O)O)=C\C=O,0.3010299956639812,Cc1ccc(O)c(O)c1.O=O__GIASPYAPMGVATPVDGGYILNGRWSFSSGTDHCDWVMIGAAVGDKDGNRLNPPQSLHVLLPRSDYRIDHDSWNVVGLRGTGSKDLIVENAFLPEYRTLRAERVMGGVAWQDAGRDETLYKFPFSCIFPLGITSSLIGIAEGALNCYIESQRERVTVSGTAIKQDPYVLSNLGDAAAEIAASRAALLETVDRFWDLTERGIRGHLRATRDRTPDPGRRGHGGPCAPSNEIFFAGRRAGALQLSNPLQRFWRDAHAGLSHAIHVPGSIFHAATLTQLGEEPQGMNAGR,./data/raw/alphafold//AF-Q6QF57-F1-model_v4.pdb,1995,4151,4017,3860 +1239,16859,17089,MNIMKEKLAALETKLKAQEGKDGKKTNFQTEMNPHVVTWKLFAVSVLLLALYPSHAAAISLRDNLADCLEDRDYDKLLHIAEFGLPNINTSHHVVIAGAGMAGLTAAKLLKEAGHKVTILEASSRVGGRVETYRNEKEGWYAELGAMRIPSSHQIVRWYAKELGVKLNEFIMDDPNTFYLVNGVLEKTETVQKDPDVLKYHVEASEKGKSADELLQHALQKVQDEVEASGCRAALLKYDRYSVKDYLKEEGGLSSEAVRMLGDLLNQQSLMYTALSEMVYDQTDINDDVKYSEVTGGSDLLPKAFVDVLDELGVPILLNSTVKRISQSDKGVIVSYEKGQQSSLTDLTADVVLVTTTTKAALFMDFDPPLPIKKMEALRAAHYDSSTKILLTFSERFWEKDGIRGGKSITDGPSRYIYYPSHSFPTNKNIGVLLASYTWSDDSLLFLGASDEDLKELALRDLAKIHGEHVRSLCTGVLVKKWSMDPYSLGAFALFTPYQHLEFAKELFRSEGRVHFAGEHTAFPHAWIEASLKSAIRAATNINKESARSPHDEL,brenda,A1IGW6,NCCCC[C@H](N)C(=O)O.O.O=O>>N.NCCCCC(=O)C(=O)O.OO,20.4,7.224523629635546e-15,37.0,4.0,1.4.3.2,214486.0,1.3096301674258988,NCCCC[C@H](N)C(=O)O.O.O=O,N.NCCCCC(=O)C(=O)O.OO,1.3096301674258988,NCCCC[C@H](N)C(=O)O.O.O=O__MNIMKEKLAALETKLKAQEGKDGKKTNFQTEMNPHVVTWKLFAVSVLLLALYPSHAAAISLRDNLADCLEDRDYDKLLHIAEFGLPNINTSHHVVIAGAGMAGLTAAKLLKEAGHKVTILEASSRVGGRVETYRNEKEGWYAELGAMRIPSSHQIVRWYAKELGVKLNEFIMDDPNTFYLVNGVLEKTETVQKDPDVLKYHVEASEKGKSADELLQHALQKVQDEVEASGCRAALLKYDRYSVKDYLKEEGGLSSEAVRMLGDLLNQQSLMYTALSEMVYDQTDINDDVKYSEVTGGSDLLPKAFVDVLDELGVPILLNSTVKRISQSDKGVIVSYEKGQQSSLTDLTADVVLVTTTTKAALFMDFDPPLPIKKMEALRAAHYDSSTKILLTFSERFWEKDGIRGGKSITDGPSRYIYYPSHSFPTNKNIGVLLASYTWSDDSLLFLGASDEDLKELALRDLAKIHGEHVRSLCTGVLVKKWSMDPYSLGAFALFTPYQHLEFAKELFRSEGRVHFAGEHTAFPHAWIEASLKSAIRAATNINKESARSPHDEL,./data/raw/alphafold//AF-A1IGW6-F1-model_v4.pdb,1381,3828,2416,5325 +1240,21858,22184,MKTVTVRDLVVGEGAPKIIVSLMGKTITDVKSEALAYREADFDILEWRVDHFANVTTAESVLEAAGAIREIITDKPLLFTFRSAKEGGEQALTTGQYIDLNRAAVDSGLVDMIDLELFTGDDEVKATVGYAHQHNVAVIMSNHDFHKTPAAEEIVQRLRKMQELGADIPKIAVMPQTKADVLTLLTATVEMQERYADRPIITMSMSKTGVISRLAGEVFGSAATFGAVKKASAPGQISVADLRTVLTILHQA,brenda,P58687,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O>>O.O=C(O)C1=CC(=O)[C@@H](O)[C@H](O)C1,210.0,7.453857947349876e-15,37.0,7.5,4.2.1.10,28901.0,2.322219294733919,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O,O.O=C(O)C1=CC(=O)[C@@H](O)[C@H](O)C1,2.4913616938342726,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O__MKTVTVRDLVVGEGAPKIIVSLMGKTITDVKSEALAYREADFDILEWRVDHFANVTTAESVLEAAGAIREIITDKPLLFTFRSAKEGGEQALTTGQYIDLNRAAVDSGLVDMIDLELFTGDDEVKATVGYAHQHNVAVIMSNHDFHKTPAAEEIVQRLRKMQELGADIPKIAVMPQTKADVLTLLTATVEMQERYADRPIITMSMSKTGVISRLAGEVFGSAATFGAVKKASAPGQISVADLRTVLTILHQA,./data/raw/alphafold//AF-P58687-F1-model_v4.pdb,720,121,5845,6755 +1241,10297,10448,MTKFDFDTVINRYGTYSTQWDYVKDRFGEANLLPFTISDMDFKAPKGVSDVIIDAANRGVFGYTRWNNNEFKSAIVDWFLNRYQVRVDAEAIVYSPSVIFSLAKLIELFSKPHEKIVTFSPCYDAFINTVTANDRQLIQMDITNGLVIEKLEHVFKIEHPKILLLCNPQNPLGIVWSSELLQTIVRLCNAYNVAVISDEIHMDVVRKGVVVHTIAEYFSELTTQCAVITSASKSFNIPALGCSYALIPDELMRLKFLYELKQKNAVSSVPYLGMLATIECYNHQEDWLNQLNDYVDDNFKYLQTFLKEQLNLDYQIPDATYLAWIDIRPLGIPMTVLQEELIKCQKVAIMDGRLYGNGGSDHLRYNLGASRSKVEEGLNRLLKAVEAIQQR,brenda,A0A223K4L6,C[C@@H](N)C(=O)O>>C[C@H](N)C(=O)O,1830.0,0.0,45.0,10.0,5.1.1.10,1599.0,3.2624510897304293,C[C@@H](N)C(=O)O,C[C@H](N)C(=O)O,3.2624510897304293,C[C@@H](N)C(=O)O__MTKFDFDTVINRYGTYSTQWDYVKDRFGEANLLPFTISDMDFKAPKGVSDVIIDAANRGVFGYTRWNNNEFKSAIVDWFLNRYQVRVDAEAIVYSPSVIFSLAKLIELFSKPHEKIVTFSPCYDAFINTVTANDRQLIQMDITNGLVIEKLEHVFKIEHPKILLLCNPQNPLGIVWSSELLQTIVRLCNAYNVAVISDEIHMDVVRKGVVVHTIAEYFSELTTQCAVITSASKSFNIPALGCSYALIPDELMRLKFLYELKQKNAVSSVPYLGMLATIECYNHQEDWLNQLNDYVDDNFKYLQTFLKEQLNLDYQIPDATYLAWIDIRPLGIPMTVLQEELIKCQKVAIMDGRLYGNGGSDHLRYNLGASRSKVEEGLNRLLKAVEAIQQR,./data/raw/alphafold//AF-A0A223K4L6-F1-model_v4.pdb,3644,3630,1422,3384 +1242,19438,19724,MRFIHALLLAGIAHSAYASEKLTFKTDLEKLEREKAAQIGVAIVDPQGEIVAGHRMAQRFAMCSTFKFPLAALVFERIDSGTERGDRKLSYGPDMIVEWSPATERFLASGHMTVLEAAQAAVQLSDNGATNLLLREIGGPAAMTQYFRKIGDSVSRLDRKEPEMSDNTPGDLRDTTTPIAMARTVAKVLYGGALTSTSTHTIERWLIGNQTGDATLRAGFPKDWVVGEKTGTCANGGRNDIGFFKAQERDYAVAVYTTAPKLSAVERDELVASVGQVITQLILSTDK,brenda,Q09HD0,O.O=C([O-])C1=C(C[n+]2ccccc2)CS[C@@H]2[C@H](N=C(O)Cc3cccs3)C(=O)N12>>,190.0,99.76985622918636,30.0,7.0,3.5.2.6,573.0,2.278753600952829,O.O=C([O-])C1=C(C[n+]2ccccc2)CS[C@@H]2[C@H](N=C(O)Cc3cccs3)C(=O)N12,,2.278753600952829,O.O=C([O-])C1=C(C[n+]2ccccc2)CS[C@@H]2[C@H](N=C(O)Cc3cccs3)C(=O)N12__MRFIHALLLAGIAHSAYASEKLTFKTDLEKLEREKAAQIGVAIVDPQGEIVAGHRMAQRFAMCSTFKFPLAALVFERIDSGTERGDRKLSYGPDMIVEWSPATERFLASGHMTVLEAAQAAVQLSDNGATNLLLREIGGPAAMTQYFRKIGDSVSRLDRKEPEMSDNTPGDLRDTTTPIAMARTVAKVLYGGALTSTSTHTIERWLIGNQTGDATLRAGFPKDWVVGEKTGTCANGGRNDIGFFKAQERDYAVAVYTTAPKLSAVERDELVASVGQVITQLILSTDK,./data/raw/alphafold//AF-Q09HD0-F1-model_v4.pdb,1458,993,806,1121 +1243,19488,19774,MTNIAKAQPKLYVMDNGRMRMDKNWMIAMHNPATIANPNAPTEFIEFPIYTVLIDHPEGKILFDTSCNPDSMGAQGRWGEATQSMFPWTASEECYLHNRLEQLKVRPEDIKFVIASHLHLDHAGCLEMFTNATIIVHEDEFSGALQTYARNQTEGAYIWGDIDAWIKNNLNWRTIKRDEDNIVLAEGIKILNFGSGHAWGMLGLHVQLPEKGGIILASDAVYSAESYGPPIKPPGIIYDSLGFVRSVEKIKRIAKETNSEVWFGHDSEQFKRFRKSTEGYYE,brenda,T0BMH6,O.O=C1CCCCO1>>O=C(O)CCCCO,8.4,0.0,25.0,8.3,3.1.1.81,1450.0,0.9242792860618816,O.O=C1CCCCO1,O=C(O)CCCCO,0.9242792860618816,O.O=C1CCCCO1__MTNIAKAQPKLYVMDNGRMRMDKNWMIAMHNPATIANPNAPTEFIEFPIYTVLIDHPEGKILFDTSCNPDSMGAQGRWGEATQSMFPWTASEECYLHNRLEQLKVRPEDIKFVIASHLHLDHAGCLEMFTNATIIVHEDEFSGALQTYARNQTEGAYIWGDIDAWIKNNLNWRTIKRDEDNIVLAEGIKILNFGSGHAWGMLGLHVQLPEKGGIILASDAVYSAESYGPPIKPPGIIYDSLGFVRSVEKIKRIAKETNSEVWFGHDSEQFKRFRKSTEGYYE,./data/raw/alphafold//AF-T0BMH6-F1-model_v4.pdb,3255,2082,3740,2596 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+1403,18285,18545,MKGRRRRRREYCKFALLLVLYTLVLLLVPSVLDGGRDGDKGAEHCPGLQRSLGVWSLEAAAAGEREQGAEARAAEEGGANQSPRFPSNLSGAVGEAVSREKQHIYVHATWRTGSSFLGELFNQHPDVFYLYEPMWHLWQALYPGDAESLQGALRDMLRSLFRCDFSVLRLYAPPGDPAARAPDTANLTTAALFRWRTNKVICSPPLCPGAPRARAEVGLVEDTACERSCPPVAIRALEAECRKYPVVVIKDVRLLDLGVLVPLLRDPGLNLKVVQLFRDPRAVHNSRLKSRQGLLRESIQVLRTRQRGDRFHRVLLAHGVGARPGGQSRALPAAPRADFFLTGALEVICEAWLRDLLFARGAPAWLRRRYLRLRYEDLVRQPRAQLRRLLRFSGLRALAALDAFALNMTRGAAYGADRPFHLSARDAREAVHAWRERLSREQVRQVEAACAPAMRLLAYPRSGEEGDAEQPREGETPLEMDADGAT,sabio,Q9NS84,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(OP(=O)(O)O)C1O,0.6,8.558692421991093,22.0,7.0,2.8.2.-,9606.0,-0.2218487496163563,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(OP(=O)(O)O)C1O,-0.2218487496163563,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O__MKGRRRRRREYCKFALLLVLYTLVLLLVPSVLDGGRDGDKGAEHCPGLQRSLGVWSLEAAAAGEREQGAEARAAEEGGANQSPRFPSNLSGAVGEAVSREKQHIYVHATWRTGSSFLGELFNQHPDVFYLYEPMWHLWQALYPGDAESLQGALRDMLRSLFRCDFSVLRLYAPPGDPAARAPDTANLTTAALFRWRTNKVICSPPLCPGAPRARAEVGLVEDTACERSCPPVAIRALEAECRKYPVVVIKDVRLLDLGVLVPLLRDPGLNLKVVQLFRDPRAVHNSRLKSRQGLLRESIQVLRTRQRGDRFHRVLLAHGVGARPGGQSRALPAAPRADFFLTGALEVICEAWLRDLLFARGAPAWLRRRYLRLRYEDLVRQPRAQLRRLLRFSGLRALAALDAFALNMTRGAAYGADRPFHLSARDAREAVHAWRERLSREQVRQVEAACAPAMRLLAYPRSGEEGDAEQPREGETPLEMDADGAT,./data/raw/alphafold//AF-Q9NS84-F1-model_v4.pdb,73,2553,2847,5695 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+1477,16885,17115,MGSKRGISSRHHSLSSYEIMFAALFAILVVLCAGLIAVSCLTIKESQRGAALGQSHEARATFKITSGVTYNPNLQDKLSVDFKVLAFDLQQMIDEIFLSSNLKNEYKNSRVLQFENGSIIVVFDLFFAQWVSDENVKEELIQGLEANKSSQLVTFHIDLNSVDILDKLTTTSHLATPGNVSIECLPGSSPCTDALTCIKADLFCDGEVNCPDGSDEDNKMCATVCDGRFLLTGSSGSFQATHYPKPSETSVVCQWIIRVNQGLSIKLSFDDFNTYYTDILDIYEGVGSSKILRASIWETNPGTIRIFSNQVTATFLIESDESDYVGFNATYTAFNSSELNNYEKINCNFEDGFCFWVQDLNDDNEWERIQGSTFSPFTGPNFDHTFGNASGFYISTPTGPGGRQERVGLLSLPLDPTLEPACLSFWYHMYGENVHKLSINISNDQNMEKTVFQKEGNYGDNWNYGQVTLNETVKFKVAFNAFKNKILSDIALDDISLTYGICNGSLYPEPTLVPTPPPELPTDCGGPFELWEPNTTFSSTNFPNSYPNLAFCVWILNAQKGKNIQLHFQEFDLENINDVVEIRDGEEADSLLLAVYTGPGPVKDVFSTTNRMTVLLITNDVLARGGFKANFTTGYHLGIPEPCKADHFQCKNGECVPLVNLCDGHLHCEDGSDEADCVRFFNGTTNNNGLVRFRIQSIWHTACAENWTTQISNDVCQLLGLGSGNSSKPIFPTDGGPFVKLNTAPDGHLILTPSQQCLQDSLIRLQCNHKSCGKKLAAQDITPKIVGGSNAKEGAWPWVVGLYYGGRLLCGASLVSSDWLVSAAHCVYGRNLEPSKWTAILGLHMKSNLTSPQTVPRLIDEIVINPHYNRRRKDNDIAMMHLEFKVNYTDYIQPICLPEENQVFPPGRNCSIAGWGTVVYQGTTANILQEADVPLLSNERCQQQMPEYNITENMICAGYEEGGIDSCQGDSGGPLMCQENNRWFLAGVTSFGYKCALPNRPGVYARVSRFTEWIQSFLH,brenda,P98073,NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,45.0,7.085764361497845e-15,22.0,8.0,3.4.21.9,9606.0,1.6532125137753435,NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,2.130333768495006,NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MGSKRGISSRHHSLSSYEIMFAALFAILVVLCAGLIAVSCLTIKESQRGAALGQSHEARATFKITSGVTYNPNLQDKLSVDFKVLAFDLQQMIDEIFLSSNLKNEYKNSRVLQFENGSIIVVFDLFFAQWVSDENVKEELIQGLEANKSSQLVTFHIDLNSVDILDKLTTTSHLATPGNVSIECLPGSSPCTDALTCIKADLFCDGEVNCPDGSDEDNKMCATVCDGRFLLTGSSGSFQATHYPKPSETSVVCQWIIRVNQGLSIKLSFDDFNTYYTDILDIYEGVGSSKILRASIWETNPGTIRIFSNQVTATFLIESDESDYVGFNATYTAFNSSELNNYEKINCNFEDGFCFWVQDLNDDNEWERIQGSTFSPFTGPNFDHTFGNASGFYISTPTGPGGRQERVGLLSLPLDPTLEPACLSFWYHMYGENVHKLSINISNDQNMEKTVFQKEGNYGDNWNYGQVTLNETVKFKVAFNAFKNKILSDIALDDISLTYGICNGSLYPEPTLVPTPPPELPTDCGGPFELWEPNTTFSSTNFPNSYPNLAFCVWILNAQKGKNIQLHFQEFDLENINDVVEIRDGEEADSLLLAVYTGPGPVKDVFSTTNRMTVLLITNDVLARGGFKANFTTGYHLGIPEPCKADHFQCKNGECVPLVNLCDGHLHCEDGSDEADCVRFFNGTTNNNGLVRFRIQSIWHTACAENWTTQISNDVCQLLGLGSGNSSKPIFPTDGGPFVKLNTAPDGHLILTPSQQCLQDSLIRLQCNHKSCGKKLAAQDITPKIVGGSNAKEGAWPWVVGLYYGGRLLCGASLVSSDWLVSAAHCVYGRNLEPSKWTAILGLHMKSNLTSPQTVPRLIDEIVINPHYNRRRKDNDIAMMHLEFKVNYTDYIQPICLPEENQVFPPGRNCSIAGWGTVVYQGTTANILQEADVPLLSNERCQQQMPEYNITENMICAGYEEGGIDSCQGDSGGPLMCQENNRWFLAGVTSFGYKCALPNRPGVYARVSRFTEWIQSFLH,./data/raw/alphafold//AF-P98073-F1-model_v4.pdb,1919,5255,2511,5329 +1478,3415,3463,MAVVYYLLLAGLIACSHALAAGTPALGDDRGRPWPASLAALALDGKLRTDSNATAAASTDFGNITSALPAAVLYPSSTGDLVALLSAANSTPGWPYTIAFRGRGHSLMGQAFAPGGVVVNMASLGDAAAPPRINVSADGRYVDAGGEQVWIDVLRASLARGVAPRSWNDYLYLTVGGTLSNAGISGQAFRHGPQISNVLEMDVITGHGEMVTCSKQLNADLFDAVLGGLGQFGVITRARIAVEPAPARARWVRFVYTDFAAFSADQERLTAPRPGGGGASFGPMSYVEGSVFVNQSLATDLANTGFFTDADVARIVALAGERNATTVYSIEATLNYDNATAAAAAVDQELASVLGTLSYVEGFAFQRDVAYAAFLDRVHGEEVALNKLGLWRVPHPWLNMFVPRSRIADFDRGVFKGILQGTDIVGPLIVYPLNKSMWDDGMSAATPSEDVFYAVSLLFSSVAPNDLARLQEQNRRILRFCDLAGIQYKTYLARHTDRSDWVRHFGAAKWNRFVEMKNKYDPKRLLSPGQDIFN,brenda,Q9T0N8,CC(C)=CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O.COc1ccccc1O.O>>CC(C)=CC=O.COC1C=CCCC1=O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,62.0,0.0,30.0,7.4,1.5.99.12,4577.0,1.792391689498254,CC(C)=CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O.COc1ccccc1O.O,CC(C)=CC=O.COC1C=CCCC1=O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,2.1132746924643504,CC(C)=CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O.COc1ccccc1O.O__MAVVYYLLLAGLIACSHALAAGTPALGDDRGRPWPASLAALALDGKLRTDSNATAAASTDFGNITSALPAAVLYPSSTGDLVALLSAANSTPGWPYTIAFRGRGHSLMGQAFAPGGVVVNMASLGDAAAPPRINVSADGRYVDAGGEQVWIDVLRASLARGVAPRSWNDYLYLTVGGTLSNAGISGQAFRHGPQISNVLEMDVITGHGEMVTCSKQLNADLFDAVLGGLGQFGVITRARIAVEPAPARARWVRFVYTDFAAFSADQERLTAPRPGGGGASFGPMSYVEGSVFVNQSLATDLANTGFFTDADVARIVALAGERNATTVYSIEATLNYDNATAAAAAVDQELASVLGTLSYVEGFAFQRDVAYAAFLDRVHGEEVALNKLGLWRVPHPWLNMFVPRSRIADFDRGVFKGILQGTDIVGPLIVYPLNKSMWDDGMSAATPSEDVFYAVSLLFSSVAPNDLARLQEQNRRILRFCDLAGIQYKTYLARHTDRSDWVRHFGAAKWNRFVEMKNKYDPKRLLSPGQDIFN,./data/raw/alphafold//AF-Q9T0N8-F1-model_v4.pdb,1034,580,242,262 +1479,18996,19281,MTNVNAEIGRMVLAGGIETNLHDVGAGNPVVLVHGSGPGVTAWANWRTVMPELSRHRRVIAPDMVGFGFTQRPHGIHYGVESWVAHLAGILDALELDRVDLVGNSFGGALSLAFAIRFPHRVRRLVLMGAVGVSFELTDGLDAVWGYEPSVPNMRKVMDYFAYDRSLVSDELAELRYKASTRPGFQEAFASMFPAPRQRWVDALASSDQDIRDIRHETLILHGRDDRVIPLETSLRLNQLIEPSQLHVFGRCGHWVQIEQNRGFIRLVNDFLAAED,sabio,P23133,O>>C=CC=C(O)C(=O)O.CC(=O)O,35.0,80.83005896452293,24.9,7.5,3.1.1.-,303.0,1.5440680443502757,O,C=CC=C(O)C(=O)O.CC(=O)O,1.5440680443502757,O__MTNVNAEIGRMVLAGGIETNLHDVGAGNPVVLVHGSGPGVTAWANWRTVMPELSRHRRVIAPDMVGFGFTQRPHGIHYGVESWVAHLAGILDALELDRVDLVGNSFGGALSLAFAIRFPHRVRRLVLMGAVGVSFELTDGLDAVWGYEPSVPNMRKVMDYFAYDRSLVSDELAELRYKASTRPGFQEAFASMFPAPRQRWVDALASSDQDIRDIRHETLILHGRDDRVIPLETSLRLNQLIEPSQLHVFGRCGHWVQIEQNRGFIRLVNDFLAAED,./data/raw/alphafold//AF-P23133-F1-model_v4.pdb,222,2740,5052,5909 +1480,6828,6943,MSPSKESDELIFFVNGKKVTERNADPEVNLLFYLRKVIRLTGTKYGCGGGDCGACTVMISRYDPISKRISHFSATACLVPICSLHGAAVTTVEGIGSTKTRIHPVQERIAKGHGTQCGFCTPGMVMSIYTLLRNHPEPSTEQIMETLGGNLCRCTGYRPIVESAKSFCPSSTCCQMNGEGKCCLDEEKNEPERKNSVCTKLYEKKEFQPLDPTQELIFPPELMRMAEESQNTVLTFRGERTTWIAPGTLNDLLELKMKHPSAPLVIGNTYLGLHMKFTDVSYPIIISPARILELFVVTNTKQGLTLGAGLSLTQVKNVLSDVVSRLPKEKTQIYCALLKQLKTLAGQQIRNVASLGGHIISRLPTSDLNPILGIGNCILNVASTEGIQQIPLNDHFLAGVPDAILKPEQVLISVFVPRSSKWEFVSAFRQAPRQQNAFATVNAGMKVVFKEDTNTITDLGILYGGIGATVISADKSCRQLIGRCWDEEMLDDAGKMICEEVSLLMAAPGGMEEYRKTLAISFLFMFYLDVLKQLKTRDPHKYPDISQKLLHILEDFPLTMPYGMQSFQDVDFQQPLQDPIGRPIMHQSGIKHATGEAVFCDDMSVLPGELFLAVVTSSKSHAKIISLDASEALASLGVVDVVTARDVPGDNGREEESLYAQDEVICVGQIVCAVAADSYAHAQQAAKKVKIVYQDIEPMIVTVQDALQYESFIGPERKLEQGNVEEAFQCADQILEGEVHLGGQEHFYMETQSVRVVPKGEDKEMDIYVSSQDAAFTQEMVARTLGIPKNRINCHVKRVGGAFGGKASKPGLLASVAAVAAQKTGRPIRFILERRDDMLITGGRHPLLGKYKIGFMNNGKIKAADIQLYINGGCTPDDSELVIEYALLKLENAYKIPNLRVRGRVCKTNLPSNTAFRGFGFPQGAFVTETCMSAVAAKCRLPPEKVRELNMYRTIDRTIHNQEFDPTNLLQCWEACVENSSYYNRKKAVDEFNQQRFWKKRGIAIIPMKFSVGFPKTFYYQAAALVQIYTDGSVLVAHGGVELGQGINTKMIQVASRELKIPMSYIHLDEMSTVTVPNTVTTGASTGADVNGRAVQNACQILMKRLEPIIKQNPSGTWEEWVKEAFVQSISLSATGYFRGYQADMDWEKGEGDIFPYFVFGAACSEVEIDCLTGAHKNIRTDIVMDGSFSINPAVDIGQIEGAFVQGLGLYTLEELKYSPEGVLYTRGPHQYKIASVTDIPEEFHVSLLTPTPNPKAIYSSKGLGEAGTFLGCSVFFAIAAAVAAAREERGLSPIWAINSPATAEVIRMACEDQFTNLVPQTDSKCCKPWSIPVA,brenda,G3X982,CCCCC=O.O.O=O>>CCCCC(=O)O.OO,1.53,0.0,37.0,8.0,1.2.3.1,10090.0,0.1846914308175988,CCCCC=O.O.O=O,CCCCC(=O)O.OO,0.1846914308175988,CCCCC=O.O.O=O__MSPSKESDELIFFVNGKKVTERNADPEVNLLFYLRKVIRLTGTKYGCGGGDCGACTVMISRYDPISKRISHFSATACLVPICSLHGAAVTTVEGIGSTKTRIHPVQERIAKGHGTQCGFCTPGMVMSIYTLLRNHPEPSTEQIMETLGGNLCRCTGYRPIVESAKSFCPSSTCCQMNGEGKCCLDEEKNEPERKNSVCTKLYEKKEFQPLDPTQELIFPPELMRMAEESQNTVLTFRGERTTWIAPGTLNDLLELKMKHPSAPLVIGNTYLGLHMKFTDVSYPIIISPARILELFVVTNTKQGLTLGAGLSLTQVKNVLSDVVSRLPKEKTQIYCALLKQLKTLAGQQIRNVASLGGHIISRLPTSDLNPILGIGNCILNVASTEGIQQIPLNDHFLAGVPDAILKPEQVLISVFVPRSSKWEFVSAFRQAPRQQNAFATVNAGMKVVFKEDTNTITDLGILYGGIGATVISADKSCRQLIGRCWDEEMLDDAGKMICEEVSLLMAAPGGMEEYRKTLAISFLFMFYLDVLKQLKTRDPHKYPDISQKLLHILEDFPLTMPYGMQSFQDVDFQQPLQDPIGRPIMHQSGIKHATGEAVFCDDMSVLPGELFLAVVTSSKSHAKIISLDASEALASLGVVDVVTARDVPGDNGREEESLYAQDEVICVGQIVCAVAADSYAHAQQAAKKVKIVYQDIEPMIVTVQDALQYESFIGPERKLEQGNVEEAFQCADQILEGEVHLGGQEHFYMETQSVRVVPKGEDKEMDIYVSSQDAAFTQEMVARTLGIPKNRINCHVKRVGGAFGGKASKPGLLASVAAVAAQKTGRPIRFILERRDDMLITGGRHPLLGKYKIGFMNNGKIKAADIQLYINGGCTPDDSELVIEYALLKLENAYKIPNLRVRGRVCKTNLPSNTAFRGFGFPQGAFVTETCMSAVAAKCRLPPEKVRELNMYRTIDRTIHNQEFDPTNLLQCWEACVENSSYYNRKKAVDEFNQQRFWKKRGIAIIPMKFSVGFPKTFYYQAAALVQIYTDGSVLVAHGGVELGQGINTKMIQVASRELKIPMSYIHLDEMSTVTVPNTVTTGASTGADVNGRAVQNACQILMKRLEPIIKQNPSGTWEEWVKEAFVQSISLSATGYFRGYQADMDWEKGEGDIFPYFVFGAACSEVEIDCLTGAHKNIRTDIVMDGSFSINPAVDIGQIEGAFVQGLGLYTLEELKYSPEGVLYTRGPHQYKIASVTDIPEEFHVSLLTPTPNPKAIYSSKGLGEAGTFLGCSVFFAIAAAVAAAREERGLSPIWAINSPATAEVIRMACEDQFTNLVPQTDSKCCKPWSIPVA,./data/raw/alphafold//AF-G3X982-F1-model_v4.pdb,1051,609,279,306 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PEELWSDYGIRSLSKKDQFYGTAENYWRSPIWVNINYLVLKNLYNIAIVSGPHREQARELYSNLRKNLVENVFQEWKKTGFAWEQYNPETGIGRRTQHFTGWTSMVVKMMSMPDLPASEQKGHDEL,./data/raw/alphafold//AF-G1UJA9-F1-model_v4.pdb,2812,2386,2663,5502 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+1485,17760,18003,MSVQREDVDIKLIAIDMDGTLLNDEQLISDENRKAIREAEDKGVYVVISTGRTLMTCRELAESLKLSSFLITANGSEIWDSNFNLVERKLLHTDHIQMMWDLRNKHNTNFWASTVNKVWRGEFPENITDHEWLKFGFDIEDDDIRNEVLEELRKNKELEITNSSPTNIEVNALGINKAAALAKVTEKLGFTMENVMAMGDSLNDIAMIKEAGLGVAMGNAQDIVKETADYITDTNIEDGVAKAIRHWVL,sabio,P42962,Nc1c(NCC(O)C(O)C(O)COP(=O)(O)O)[nH]c(=O)[nH]c1=O.O>>Nc1c(NCC(O)C(O)C(O)CO)[nH]c(=O)[nH]c1=O.O=P(O)(O)O,20040.0,0.0,23.0,8.0,3.1.3.104,1423.0,4.301897717195208,Nc1c(NCC(O)C(O)C(O)COP(=O)(O)O)[nH]c(=O)[nH]c1=O.O,Nc1c(NCC(O)C(O)C(O)CO)[nH]c(=O)[nH]c1=O.O=P(O)(O)O,4.301897717195208,Nc1c(NCC(O)C(O)C(O)COP(=O)(O)O)[nH]c(=O)[nH]c1=O.O__MSVQREDVDIKLIAIDMDGTLLNDEQLISDENRKAIREAEDKGVYVVISTGRTLMTCRELAESLKLSSFLITANGSEIWDSNFNLVERKLLHTDHIQMMWDLRNKHNTNFWASTVNKVWRGEFPENITDHEWLKFGFDIEDDDIRNEVLEELRKNKELEITNSSPTNIEVNALGINKAAALAKVTEKLGFTMENVMAMGDSLNDIAMIKEAGLGVAMGNAQDIVKETADYITDTNIEDGVAKAIRHWVL,./data/raw/alphafold//AF-P42962-F1-model_v4.pdb,2835,2412,2690,5531 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+1488,1136,1163,MTKIFAYAIREDEKPFLKEWEDAHKDVEVEYTDKLLTPETVALAKGADGVVVYQQLDYTAETLQALADNGITKMSLRNVGVDNIDMAKAKELGFQITNVPVYSPNAIAEHAAIQAARILRQDKAMDEKVARHDLRWAPTIGREVRDQVVGVIGTGHIGQVFMQIMEGFGAKVIAYDIFRNPELEKKGYYVDSLDDLYKQADVISLHVPDVPANVHMINDESIAKMKQDVVIVNVSRGPLVDTDAVIRGLDSGKIFGYAMDVYEGEVGIFNEDWEGKEFPDARLADLIARPNVLVTPHTAFYTTHAVRNMVVKAFDNNLELVEGKEAETPVKVG,brenda,P26297,CC(=O)C(=O)O.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]>>C[C@@H](O)C(=O)O.N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,235.5,6.8076358374371095e-15,30.0,6.5,1.1.1.28,1585.0,2.371990911464915,CC(=O)C(=O)O.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],C[C@@H](O)C(=O)O.N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,2.371990911464915,CC(=O)C(=O)O.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]__MTKIFAYAIREDEKPFLKEWEDAHKDVEVEYTDKLLTPETVALAKGADGVVVYQQLDYTAETLQALADNGITKMSLRNVGVDNIDMAKAKELGFQITNVPVYSPNAIAEHAAIQAARILRQDKAMDEKVARHDLRWAPTIGREVRDQVVGVIGTGHIGQVFMQIMEGFGAKVIAYDIFRNPELEKKGYYVDSLDDLYKQADVISLHVPDVPANVHMINDESIAKMKQDVVIVNVSRGPLVDTDAVIRGLDSGKIFGYAMDVYEGEVGIFNEDWEGKEFPDARLADLIARPNVLVTPHTAFYTTHAVRNMVVKAFDNNLELVEGKEAETPVKVG,./data/raw/alphafold//AF-P26297-F1-model_v4.pdb,1277,5242,1630,766 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+1490,10995,11150,MSDLLSVFLHLLLLFKLVAPVTFRHHRYDDLVRTLYKVQNECPGITRVYSIGRSVEGRHLYVLEFSDHPGIHEPLEPEVKYVGNMHGNEALGRELMLQLSEFLCEEFRNRNQRIVQLIQDTRIHILPSMNPDGYEVAAAQGPNKPGYLVGRNNANGVDLNRNFPDLNTYIYYNEKYGGPNHHLPLPDNWKSQVEPETRAVIRWMHSFNFVLSANLHGGAVVANYPYDKSFEHRVRGVRRTASTPTPDDKLFQKLAKVYSYAHGWMFQGWNCGDYFPDGITNGASWYSLSKGMQDFNYLHTNCFEITLELSCDKFPPEEELQREWLGNREALIQFLEQVHQGIKGMVLDENYNNLANAVISVSGINHDVTSGDHGDYFRLLLPGIYTVSATAPGYDPETVTVTVGPAEPTLVNFHLKRSIPQVSPVRRAPSRRHGVRAKVQPQARKKEMEMRQLQRGPA,uniprot_search,P15169,C[C@H](N=C(O)c1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.O>>C[C@H](N=C(O)c1ccccc1)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O,139.0,7.725263907194777e-15,30.0,7.975,3.4.17.3,9606.0,2.143014800254095,C[C@H](N=C(O)c1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.O,C[C@H](N=C(O)c1ccccc1)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O,2.143014800254095,C[C@H](N=C(O)c1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.O__MSDLLSVFLHLLLLFKLVAPVTFRHHRYDDLVRTLYKVQNECPGITRVYSIGRSVEGRHLYVLEFSDHPGIHEPLEPEVKYVGNMHGNEALGRELMLQLSEFLCEEFRNRNQRIVQLIQDTRIHILPSMNPDGYEVAAAQGPNKPGYLVGRNNANGVDLNRNFPDLNTYIYYNEKYGGPNHHLPLPDNWKSQVEPETRAVIRWMHSFNFVLSANLHGGAVVANYPYDKSFEHRVRGVRRTASTPTPDDKLFQKLAKVYSYAHGWMFQGWNCGDYFPDGITNGASWYSLSKGMQDFNYLHTNCFEITLELSCDKFPPEEELQREWLGNREALIQFLEQVHQGIKGMVLDENYNNLANAVISVSGINHDVTSGDHGDYFRLLLPGIYTVSATAPGYDPETVTVTVGPAEPTLVNFHLKRSIPQVSPVRRAPSRRHGVRAKVQPQARKKEMEMRQLQRGPA,./data/raw/alphafold//AF-P15169-F1-model_v4.pdb,1855,1561,3146,1917 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+1581,5224,5310,MVTKRVQRMMFAAAACIPLLLGSAPLYAQTSAVQQKLAALEKSSGGRLGVALIDTADNTQVLYRGDERFPMCSTSKVMAAAAVLKQSETQKQLLNQPVEIKPADLVNYNPIAEKHVNGTMTLAELSAAALQYSDNTAMNKLIAQLGGPGGVTAFARAIGDETFRLDRTEPTLNTAIPGDPRDTTTPRAMAQTLRQLTLGHALGETQRAQLVTWLKGNTTGAASIRAGLPTSWTVGDKTGSGDYGTTNDIAVIWPQGRAPLVLVTYFTQPQQNAESRRDVLASAARIIAEGL,sabio,Q9L5C7,CC/C=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1csc(=N)[nH]1.O>>,110.0,99.78836740265427,30.0,7.0,3.5.2.6,562.0,2.041392685158225,CC/C=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1csc(=N)[nH]1.O,,2.041392685158225,CC/C=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1csc(=N)[nH]1.O__MVTKRVQRMMFAAAACIPLLLGSAPLYAQTSAVQQKLAALEKSSGGRLGVALIDTADNTQVLYRGDERFPMCSTSKVMAAAAVLKQSETQKQLLNQPVEIKPADLVNYNPIAEKHVNGTMTLAELSAAALQYSDNTAMNKLIAQLGGPGGVTAFARAIGDETFRLDRTEPTLNTAIPGDPRDTTTPRAMAQTLRQLTLGHALGETQRAQLVTWLKGNTTGAASIRAGLPTSWTVGDKTGSGDYGTTNDIAVIWPQGRAPLVLVTYFTQPQQNAESRRDVLASAARIIAEGL,./data/raw/alphafold//AF-Q9L5C7-F1-model_v4.pdb,1458,649,811,590 +1582,17537,17775,MKKLLTVMTMAVLTAGTLLLPAQSVTPAAHAVQISNSERELPFKAKHAYSTISQLSEAIGPRIAGTAAEKKSALLIASSMRKLKLDVKVQRFNIPDRLEGTLSSAGRDILLQAASGSAPTEEQGLTAPLYNAGLGYQKDFTADAKGKIALISRGDLTYYEKAKNAEAAGAKAVIIYNNKESLVPMTPNLSGNKVGIPVVGIKKEDGEALTQQKEATLKLKAFTNQTSQNIIGIKKPKNIKHPDIVYVTAHYDSVPFSPGANDNGSGTSVMLEMARVLKSVPSDKEIRFIAFGAEELGLLGSSHYVDHLSEKELKRSEVNFNLDMVGTSWEKASELYVNTLDGQSNYVWESSRTAAEKIGFDSLSLTQGGSSDHVPFHEAGIDSANFIWGDPETEEVEPWYHTPEDSIEHISKERLQQAGDLVTAAVYEAVKKEKKPKTIKKQMKAKASDIFEDIK,sabio,P25152,N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>NC(Cc1ccccc1)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,0.00028,0.0,30.0,8.0,3.4.11.10,1423.0,-3.552841968657781,N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,NC(Cc1ccccc1)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,-3.552841968657781,N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MKKLLTVMTMAVLTAGTLLLPAQSVTPAAHAVQISNSERELPFKAKHAYSTISQLSEAIGPRIAGTAAEKKSALLIASSMRKLKLDVKVQRFNIPDRLEGTLSSAGRDILLQAASGSAPTEEQGLTAPLYNAGLGYQKDFTADAKGKIALISRGDLTYYEKAKNAEAAGAKAVIIYNNKESLVPMTPNLSGNKVGIPVVGIKKEDGEALTQQKEATLKLKAFTNQTSQNIIGIKKPKNIKHPDIVYVTAHYDSVPFSPGANDNGSGTSVMLEMARVLKSVPSDKEIRFIAFGAEELGLLGSSHYVDHLSEKELKRSEVNFNLDMVGTSWEKASELYVNTLDGQSNYVWESSRTAAEKIGFDSLSLTQGGSSDHVPFHEAGIDSANFIWGDPETEEVEPWYHTPEDSIEHISKERLQQAGDLVTAAVYEAVKKEKKPKTIKKQMKAKASDIFEDIK,./data/raw/alphafold//AF-P25152-F1-model_v4.pdb,1812,1490,3062,1814 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+1627,19640,19926,MNVFFMFSLLFLAALGSCADDRNPLAECFQENDYEEFLEIARNGLKATSNPKHVVIVGAGMAGLSAAYVLAGAGHQVTVLEASERPGGRVRTYRNEEAGWYANLGPMRLPEKHRIVREYIRKFDLRLNEFSQENDNAWYFIKNIRKKVGEVKKDPGLLKYPVKPSEAGKSAGQLYEESLGKVVEELKRTNCSYILNKYDTYSTKEYLIKEGDLSPGAVDMIGDLLNEDSGYYVSFIESLKHDDIFAYEKRFDEIVDGMDKLPTAMYRDIQDKVHFNAQVIKIQQNDQKVTVVYETLSKETPSVTADYVIVCTTSRAVRLIKFNPPLLPKKAHALRSVHYRSGTKIFLTCTTKFWEDDGIHGGKSTTDLPSRFIYYPNHNFTNGVGVIIAYGIGDDANFFQALDFKDCADIVFNDLSLIHQLPKKDIQSFCYPSVIQKWSLDKYAMGGITTFTPYQFQHFSDPLTASQGRIYFAGEYTAQAHGWIDSTIKSGLRAARDVNLASENPSGIHLSNDNEL,sabio,P81382,O.O=O.O=O>>N.OO,0.82,23.09930178432894,25.0,8.5,1.4.3.2,8717.0,-0.0861861476162833,O.O=O.O=O,N.OO,-0.0861861476162833,O.O=O.O=O__MNVFFMFSLLFLAALGSCADDRNPLAECFQENDYEEFLEIARNGLKATSNPKHVVIVGAGMAGLSAAYVLAGAGHQVTVLEASERPGGRVRTYRNEEAGWYANLGPMRLPEKHRIVREYIRKFDLRLNEFSQENDNAWYFIKNIRKKVGEVKKDPGLLKYPVKPSEAGKSAGQLYEESLGKVVEELKRTNCSYILNKYDTYSTKEYLIKEGDLSPGAVDMIGDLLNEDSGYYVSFIESLKHDDIFAYEKRFDEIVDGMDKLPTAMYRDIQDKVHFNAQVIKIQQNDQKVTVVYETLSKETPSVTADYVIVCTTSRAVRLIKFNPPLLPKKAHALRSVHYRSGTKIFLTCTTKFWEDDGIHGGKSTTDLPSRFIYYPNHNFTNGVGVIIAYGIGDDANFFQALDFKDCADIVFNDLSLIHQLPKKDIQSFCYPSVIQKWSLDKYAMGGITTFTPYQFQHFSDPLTASQGRIYFAGEYTAQAHGWIDSTIKSGLRAARDVNLASENPSGIHLSNDNEL,./data/raw/alphafold//AF-P81382-F1-model_v4.pdb,1381,1496,3068,1821 +1628,22033,22365,MNNTSITGPQVLHRTKMRPLPVLEKYCISPHHGFLDDRLPLTRLSSKKYMKWEEIVADLPSLLQEDNKVRSVIDGLDVLDLDETILGDVRELRRAYSILGFMAHAYIWASGTPRDVLPECIARPLLETAHILGVPPLATYSSLVLWNFKVTDECKKTETGCLDLENITTINTFTGTVDESWFYLVSVRFEKIGSACLNHGLQILRAIRSGDKGDANVIDGLEGLAATIERLSKALMEMELKCEPNVFYFKIRPFLAGWTNMSHMGLPQGVRYGAEGQYRIFSGGSNAQSSLIQTLDILLGVKHTANAAHSSQGDSKINYLDEMKKYMPREHREFLYHLESVCNIREYVSRNASNRALQEAYGRCISMLKIFRDNHIQIVTKYIILPSNSKQHGSNKPNVLSPIEPNTKASGCLGHKVASSKTIGTGGTRLMPFLKQCRDETVATADIKNEDKN,sabio,P47125,O=O.O=O>>N[C@H](CC(=O)c1ccccc1N=CO)C(=O)O,6060.0,57.17724078174639,37.0,6.5,1.13.11.52,4932.0,3.782472624166286,O=O.O=O,N[C@H](CC(=O)c1ccccc1N=CO)C(=O)O,3.782472624166286,O=O.O=O__MNNTSITGPQVLHRTKMRPLPVLEKYCISPHHGFLDDRLPLTRLSSKKYMKWEEIVADLPSLLQEDNKVRSVIDGLDVLDLDETILGDVRELRRAYSILGFMAHAYIWASGTPRDVLPECIARPLLETAHILGVPPLATYSSLVLWNFKVTDECKKTETGCLDLENITTINTFTGTVDESWFYLVSVRFEKIGSACLNHGLQILRAIRSGDKGDANVIDGLEGLAATIERLSKALMEMELKCEPNVFYFKIRPFLAGWTNMSHMGLPQGVRYGAEGQYRIFSGGSNAQSSLIQTLDILLGVKHTANAAHSSQGDSKINYLDEMKKYMPREHREFLYHLESVCNIREYVSRNASNRALQEAYGRCISMLKIFRDNHIQIVTKYIILPSNSKQHGSNKPNVLSPIEPNTKASGCLGHKVASSKTIGTGGTRLMPFLKQCRDETVATADIKNEDKN,./data/raw/alphafold//AF-P47125-F1-model_v4.pdb,2818,5121,2247,5131 +1629,3020,3062,MSANFTDKNGRQSKGVLLLRTLAMPSDTNANGDIFGGWIMSQMDMGGAILAKEIAHGRVVTVAVESMNFIKPISVGDVVCCYGQCLKVGRSSIKIKVEVWVKKVASEPIGERYCVTDAVFTFVAVDNNGRSRTIPRENNQELEKALALISEQPL,brenda,P44886,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)Cc1ccccc1.O>>CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.O=C(O)Cc1ccccc1,130.0,6.286660546367751e-15,25.0,7.5,3.1.2.20,727.0,2.113943352306837,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)Cc1ccccc1.O,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.O=C(O)Cc1ccccc1,2.113943352306837,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)Cc1ccccc1.O__MSANFTDKNGRQSKGVLLLRTLAMPSDTNANGDIFGGWIMSQMDMGGAILAKEIAHGRVVTVAVESMNFIKPISVGDVVCCYGQCLKVGRSSIKIKVEVWVKKVASEPIGERYCVTDAVFTFVAVDNNGRSRTIPRENNQELEKALALISEQPL,./data/raw/alphafold//AF-P44886-F1-model_v4.pdb,1541,1097,253,274 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+1632,9847,9996,MSSCSRVALVTGANKGIGFAITRDLCRKFSGDVVLTARDEARGRAAVQQLQAEGLSPRFHQLDIDDPQSIRALRDFLRKEYGGLNVLVNNAGIAFRMDDPTPFDIQAEVTLKTNFFATRNVCTELLPIMKPHGRVVNISSLQGLKALENCREDLQEKFRCDTLTEVDLVDLMKKFVEDTKNEVHEREGWPDSAYGVSKLGVTVLTRILARQLDEKRKADRILLNACCPGWVKTDMARDQGSRTVEEGAETPVYLALLPPDATEPHGQLVRDKVVQTW,brenda,Q8K354,COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]>>COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)([C@@H](O)CO)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1.N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.0014,0.0,37.0,7.0,1.1.1.184,10090.0,-2.853871964321762,COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)([C@@H](O)CO)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1.N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,-2.853871964321762,COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]__MSSCSRVALVTGANKGIGFAITRDLCRKFSGDVVLTARDEARGRAAVQQLQAEGLSPRFHQLDIDDPQSIRALRDFLRKEYGGLNVLVNNAGIAFRMDDPTPFDIQAEVTLKTNFFATRNVCTELLPIMKPHGRVVNISSLQGLKALENCREDLQEKFRCDTLTEVDLVDLMKKFVEDTKNEVHEREGWPDSAYGVSKLGVTVLTRILARQLDEKRKADRILLNACCPGWVKTDMARDQGSRTVEEGAETPVYLALLPPDATEPHGQLVRDKVVQTW,./data/raw/alphafold//AF-Q8K354-F1-model_v4.pdb,1319,3880,4510,3275 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+1635,17636,17878,MPPSDPIIVLGAGVIGLTTAVRLLEAHLGANVHILADHWPSDALDAQYASTIAGAHHLSFADDGDARQRRWDMRTFDVLYDEWKAVGERTGLMALTQTEMWEGATSHLAVYEGNPDFRVLDPRTAPCSNITHMVSFTSLTIAPTVYLAALEARVRDLGAKLHRAHVPSLGALRTDPALLALYTRPPAAVFVCAGLGARHLVPAPEAAALFPTRGQVVVVRAPWMRAGFTRQVGSLGGGEGGTRTYIIPRCNGEVVLGGTMEQGDWTPYPRDETVTDILTRALQICPDIAPPYARSWPKDDQVAALRSIVVRDAVGFRPSRAGGARVALASAAGMRVVYNYGHGGAGWQSCWGCAEDAVALWAGGAGGARL,uniprot_search,Q75WF1,N[C@H](CC(=O)O)C(=O)O.O.O=O>>N.O=C(O)CC(=O)C(=O)O.OO,27.9,7.739442486058953e-15,35.0,7.5,1.4.3.1,5417.0,1.4456042032735976,N[C@H](CC(=O)O)C(=O)O.O.O=O,N.O=C(O)CC(=O)C(=O)O.OO,1.9169800473203824,N[C@H](CC(=O)O)C(=O)O.O.O=O__MPPSDPIIVLGAGVIGLTTAVRLLEAHLGANVHILADHWPSDALDAQYASTIAGAHHLSFADDGDARQRRWDMRTFDVLYDEWKAVGERTGLMALTQTEMWEGATSHLAVYEGNPDFRVLDPRTAPCSNITHMVSFTSLTIAPTVYLAALEARVRDLGAKLHRAHVPSLGALRTDPALLALYTRPPAAVFVCAGLGARHLVPAPEAAALFPTRGQVVVVRAPWMRAGFTRQVGSLGGGEGGTRTYIIPRCNGEVVLGGTMEQGDWTPYPRDETVTDILTRALQICPDIAPPYARSWPKDDQVAALRSIVVRDAVGFRPSRAGGARVALASAAGMRVVYNYGHGGAGWQSCWGCAEDAVALWAGGAGGARL,./data/raw/alphafold//AF-Q75WF1-F1-model_v4.pdb,3489,3405,1141,3059 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+1669,17438,17675,MENFKHLPEPFRIRVIEPVKRTTREYRDEAILKAGMNPFLLDSEDVFIDLLTDSGTGAITQEMQAAMFRGDEAYSGSRSYYALANAVKDIFGYELTIPTHQGRGAEQIYIPVLIKKREIEKGLDRTKMVALSNYFFDTTQGHTQVNCCVAKNVYTEDAFDTSVNADFKGNFDLVKLEEAILAADPVNVPYIVSTITCNSAGGQPVSIANLKAVYEIAQKYDIPVIMDSARYAENAYFIQQREDTYKDWTIEEITRESYKYADGLAMSAKKDAMVQMGGLLCFKDESMMDAYTECRTLCVIQEGFPTYGGLEGGAMERLAVGLYDGMRQEWLAYRIGQVQYLVDGLESIGVVCQQAGGHAAFVDAGKLLPHISTEQFPAHALACELYKVAGIRAVEIGSLLLGRDPATGKQHPCPAELLRLTIPRATYTQTHMDFVIEAFQKVKANAANVKGLDFTYEPAVLRHFTARLKEVEPVQAAVKTETKILEEA,brenda,Q6LP64,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O>>CC(=O)C(=O)O.N.c1ccc2[nH]ccc2c1,2.5,0.0,25.0,8.0,4.1.99.1,74109.0,0.3979400086720376,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O,CC(=O)C(=O)O.N.c1ccc2[nH]ccc2c1,0.3979400086720376,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O__MENFKHLPEPFRIRVIEPVKRTTREYRDEAILKAGMNPFLLDSEDVFIDLLTDSGTGAITQEMQAAMFRGDEAYSGSRSYYALANAVKDIFGYELTIPTHQGRGAEQIYIPVLIKKREIEKGLDRTKMVALSNYFFDTTQGHTQVNCCVAKNVYTEDAFDTSVNADFKGNFDLVKLEEAILAADPVNVPYIVSTITCNSAGGQPVSIANLKAVYEIAQKYDIPVIMDSARYAENAYFIQQREDTYKDWTIEEITRESYKYADGLAMSAKKDAMVQMGGLLCFKDESMMDAYTECRTLCVIQEGFPTYGGLEGGAMERLAVGLYDGMRQEWLAYRIGQVQYLVDGLESIGVVCQQAGGHAAFVDAGKLLPHISTEQFPAHALACELYKVAGIRAVEIGSLLLGRDPATGKQHPCPAELLRLTIPRATYTQTHMDFVIEAFQKVKANAANVKGLDFTYEPAVLRHFTARLKEVEPVQAAVKTETKILEEA,./data/raw/alphafold//AF-Q6LP64-F1-model_v4.pdb,1307,2244,3936,2813 +1670,18844,19124,MGLSRKEQVFLALLGASGVSGLTALILLLVEATSVLLPTDIKFGIVFDAGSSHTSLFLYQWLANKENGTGVVSQALACQVEGPGISSYTSNAAQAGESLQGCLEEALVLIPEAQHRKTPTFLGATAGMRLLSRKNSSQARDIFAAVTQVLGRSPVDFWGAELLAGQAEGAFGWITVNYGLGTLVKYSFTGEWIQPPEEMLVGALDMGGASTQITFVPGGPILDKSTQADFRLYGSDYSVYTHSYLCFGRDQMLSRLLVGLVQSRPAALLRHPCYLSGYQTTLALGPLYESPCVHATPPLSLPQNLTVEGTGNPGACVSAIRELFNFSSCQGQEDCAFDGVYQPPLRGQFYAFSNFYYTFHFLNLTSRQPLSTVNATIWEFCQRPWKLVEASYPGQDRWLRDYCASGLYILTLLHEGYGFSEETWPSLEFRKQAGGVDIGWTLGYMLNLTGMIPADAPAQWRAESYGVWVAKVVFMVLALVAVVGAALVQLFWLQD,sabio,Q5MY95,O>>O=P(O)(O)O,0.0387,68.35286174567767,37.0,7.4,3.6.1.5,9606.0,-1.4122890349810886,O,O=P(O)(O)O,-1.4122890349810886,O__MGLSRKEQVFLALLGASGVSGLTALILLLVEATSVLLPTDIKFGIVFDAGSSHTSLFLYQWLANKENGTGVVSQALACQVEGPGISSYTSNAAQAGESLQGCLEEALVLIPEAQHRKTPTFLGATAGMRLLSRKNSSQARDIFAAVTQVLGRSPVDFWGAELLAGQAEGAFGWITVNYGLGTLVKYSFTGEWIQPPEEMLVGALDMGGASTQITFVPGGPILDKSTQADFRLYGSDYSVYTHSYLCFGRDQMLSRLLVGLVQSRPAALLRHPCYLSGYQTTLALGPLYESPCVHATPPLSLPQNLTVEGTGNPGACVSAIRELFNFSSCQGQEDCAFDGVYQPPLRGQFYAFSNFYYTFHFLNLTSRQPLSTVNATIWEFCQRPWKLVEASYPGQDRWLRDYCASGLYILTLLHEGYGFSEETWPSLEFRKQAGGVDIGWTLGYMLNLTGMIPADAPAQWRAESYGVWVAKVVFMVLALVAVVGAALVQLFWLQD,./data/raw/alphafold//AF-Q5MY95-F1-model_v4.pdb,182,2695,5004,5854 +1671,8383,8514,MLARRSFLQAAAGSLVLGLARAQGPSFPEPKVVRSQGGLLSLKLSATPTPLALAGQRATLLTYGGSFPGPTLRVRPRDTVRLTLENRLPEPTNLHWHGLPISPKVDDPFLEIPPGESWTYEFTVPKELAGTFWYHPHLHGRVAPQLFAGLLGALVVESSLDAIPELREAEEHLLVLKDLALQGGRPAPHTPMDWMNGKEGDLVLVNGALRPTLVAQKATLRLRLLNASNARYYRLALQDHPLYLIAADGGFLEEPLEVSELLLAPGERAEVLVRLRKEGRFLLQALPYDRGAMGMMDMGGMAHAMPQGPSRPETLLYLIAPKNPKPLPLPKALSPFPTLPAPVVTRRLVLTEDMMAARFFINGQVFDHRRVDLKGQAQTVEVWEVENQGDMDHPFHLHVHPFQVLSVGGRPFPYRAWKDVVNLKAGEVARLLVPLREKGRTVFHCHIVEHEDRGMMGVLEVG,sabio,Q72HW2,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O>>CCn1/c(=N/N=C2/Sc3cc(S(=O)(=O)[O-])ccc3[N+]2CC)sc2cc(S(=O)(=O)[O-])ccc21.O,3.33,1.4837780463171737,55.0,6.0,1.10.3.2,274.0,0.5224442335063199,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O,CCn1/c(=N/N=C2/Sc3cc(S(=O)(=O)[O-])ccc3[N+]2CC)sc2cc(S(=O)(=O)[O-])ccc21.O,1.390935107103379,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O__MLARRSFLQAAAGSLVLGLARAQGPSFPEPKVVRSQGGLLSLKLSATPTPLALAGQRATLLTYGGSFPGPTLRVRPRDTVRLTLENRLPEPTNLHWHGLPISPKVDDPFLEIPPGESWTYEFTVPKELAGTFWYHPHLHGRVAPQLFAGLLGALVVESSLDAIPELREAEEHLLVLKDLALQGGRPAPHTPMDWMNGKEGDLVLVNGALRPTLVAQKATLRLRLLNASNARYYRLALQDHPLYLIAADGGFLEEPLEVSELLLAPGERAEVLVRLRKEGRFLLQALPYDRGAMGMMDMGGMAHAMPQGPSRPETLLYLIAPKNPKPLPLPKALSPFPTLPAPVVTRRLVLTEDMMAARFFINGQVFDHRRVDLKGQAQTVEVWEVENQGDMDHPFHLHVHPFQVLSVGGRPFPYRAWKDVVNLKAGEVARLLVPLREKGRTVFHCHIVEHEDRGMMGVLEVG,./data/raw/alphafold//AF-Q72HW2-F1-model_v4.pdb,3407,2292,3996,2887 +1672,21651,21976,MQQASTPTIGMIVPPAAGLVPADGARLYPDLPFIASGLGLGSVTPEGYDAVIESVVDHARRLQKQGAAVVSLMGTSLSFYRGAAFNAALTVAMREATGLPCTTMSTAVLNGLRALGVRRVALATAYIDDVNERLAAFLAEESLVPTGCRSLGITGVEAMARVDTATLVDLCVRAFEAAPDSDGILLSCGGLLTLDAIPEVERRLGVPVVSSSPAGFWDAVRLAGGGAKARPGYGRLFDES,uniprot_search,Q05115,O=C([O-])C(C(=O)[O-])c1ccc2ccccc2c1>>,1730.0,99.56370553614045,45.0,8.5,4.1.1.76,518.0,3.2380461031287955,O=C([O-])C(C(=O)[O-])c1ccc2ccccc2c1,,3.2380461031287955,O=C([O-])C(C(=O)[O-])c1ccc2ccccc2c1__MQQASTPTIGMIVPPAAGLVPADGARLYPDLPFIASGLGLGSVTPEGYDAVIESVVDHARRLQKQGAAVVSLMGTSLSFYRGAAFNAALTVAMREATGLPCTTMSTAVLNGLRALGVRRVALATAYIDDVNERLAAFLAEESLVPTGCRSLGITGVEAMARVDTATLVDLCVRAFEAAPDSDGILLSCGGLLTLDAIPEVERRLGVPVVSSSPAGFWDAVRLAGGGAKARPGYGRLFDES,./data/raw/alphafold//AF-Q05115-F1-model_v4.pdb,1049,605,272,296 +1673,8039,8167,MGKLDKASKLIDEENKYYARSARINYYNLVIDHAHGATLVDVDGNKYIDLLASASAINVGHTHEKVVKAIADQAQKLIHYTPAYFHHVPGMELSEKLAKIAPGNSPKMVSFGNSGSDANDAIIKFARAYTGRQYIVSYMGSYHGSTYGSQTLSGSSLNMTRKIGPMLPSVVHVPYPDSYRTYPGETEHDVSLRYFNEFKKPFESFLPADETACVLIEPIQGDGGIIKAPEEYMQLVYKFCHEHGILFAIDEVNQGLGRTGKMWAIQQFKDIEPDLMSVGKSLASGMPLSAVIGKKEVMQSLDAPAHLFTTAGNPVCSAASLATLDVIEYEGLVEKSATDGAYAKQRFLEMQQRHPMIGDVRMWGLNGGIELVKDPKTKEPDSDAATKVIYYAFAHGVVIITLAGNILRFQPPLVIPREQLDQALQVLDDAFTAVENGEVTIPKDTGKIGW,brenda,M1GRN3,CC[C@H](C)[C@H](N)C(=O)O>>CCC(C)[C@@H](N)C(=O)O,502.0,0.0,37.0,5.5,5.1.1.21,1581.0,2.7007037171450192,CC[C@H](C)[C@H](N)C(=O)O,CCC(C)[C@@H](N)C(=O)O,2.7007037171450192,CC[C@H](C)[C@H](N)C(=O)O__MGKLDKASKLIDEENKYYARSARINYYNLVIDHAHGATLVDVDGNKYIDLLASASAINVGHTHEKVVKAIADQAQKLIHYTPAYFHHVPGMELSEKLAKIAPGNSPKMVSFGNSGSDANDAIIKFARAYTGRQYIVSYMGSYHGSTYGSQTLSGSSLNMTRKIGPMLPSVVHVPYPDSYRTYPGETEHDVSLRYFNEFKKPFESFLPADETACVLIEPIQGDGGIIKAPEEYMQLVYKFCHEHGILFAIDEVNQGLGRTGKMWAIQQFKDIEPDLMSVGKSLASGMPLSAVIGKKEVMQSLDAPAHLFTTAGNPVCSAASLATLDVIEYEGLVEKSATDGAYAKQRFLEMQQRHPMIGDVRMWGLNGGIELVKDPKTKEPDSDAATKVIYYAFAHGVVIITLAGNILRFQPPLVIPREQLDQALQVLDDAFTAVENGEVTIPKDTGKIGW,./data/raw/alphafold//AF-M1GRN3-F1-model_v4.pdb,3371,2248,3940,2817 +1674,3665,3715,MGKSESQMDITDINTPKPKKKQRWTPLEISLSVLVLLLTIIAVTMIALYATYDDGICKSSDCIKSAARLIQNMDATTEPCTDFFKYACGGWLKRNVIPETSSRYGNFDILRDELEVVLKDVLQEPKTEDIVAVQKAKALYRSCINESAIDSRGGEPLLKLLPDIYGWPVATENWEQKYGASWTAEKAIAQLNSKYGKKVLINLFVGTDDKNSVNHVIHIDQPRLGLPSRDYYECTGIYKEACTAYVDFMISVARLIRQEERLPIDENQLALEMNKVMELEKEIANATAKPEDRNDPMLLYNKMTLAQIQNNFSLEINGKPFSWLNFTNEIMSTVNISITNEEDVVVYAPEYLTKLKPILTKYSARDLQNLMSWRFIMDLVSSLSRTYKESRNAFRKALYGTTSETATWRRCANYVNGNMENAVGRLYVEAAFAGESKHVVEDLIAQIREVFIQTLDDLTWMDAETKKRAEEKALAIKERIGYPDDIVSNDNKLNNEYLELNYKEDEYFENIIQNLKFSQSKQLKKLREKVDKDEWISGAAVVNAFYSSGRNQIVFPAGILQPPFFSAQQSNSLNYGGIGMVIGHEITHGFDDNGRNFNKDGDLVDWWTQQSASNFKEQSQCMVYQYGNFSWDLAGGQHLNGINTLGENIADNGGLGQAYRAYQNYIKKNGEEKLLPGLDLNHKQLFFLNFAQVWCGTYRPEYAVNSIKTDVHSPGNFRIIGTLQNSAEFSEAFHCRKNSYMNPEKKCRVW,brenda,P08473,CC(C)CC(N=C(O)C(CCCCN)N=C(O)C(CCCNC(=N)N)N=C(O)C(C)N=C(O)C(CO)N=C(O)C(CCCCN)N=C(O)C(CCCNC(=N)N)N=C(O)C(C)N=C(O)CN=C(O)C(N=C(O)C(Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)C(N)Cc1ccccc1)C(C)O)C(O)=NC(C)C(O)=NC(CC(=N)O)C(O)=NC(CCC(=N)O)C(=O)O.O>>,11.0,99.9452978885532,30.0,6.55,3.4.24.11,9606.0,1.0413926851582251,CC(C)CC(N=C(O)C(CCCCN)N=C(O)C(CCCNC(=N)N)N=C(O)C(C)N=C(O)C(CO)N=C(O)C(CCCCN)N=C(O)C(CCCNC(=N)N)N=C(O)C(C)N=C(O)CN=C(O)C(N=C(O)C(Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)C(N)Cc1ccccc1)C(C)O)C(O)=NC(C)C(O)=NC(CC(=N)O)C(O)=NC(CCC(=N)O)C(=O)O.O,,1.0413926851582251,CC(C)CC(N=C(O)C(CCCCN)N=C(O)C(CCCNC(=N)N)N=C(O)C(C)N=C(O)C(CO)N=C(O)C(CCCCN)N=C(O)C(CCCNC(=N)N)N=C(O)C(C)N=C(O)CN=C(O)C(N=C(O)C(Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)C(N)Cc1ccccc1)C(C)O)C(O)=NC(C)C(O)=NC(CC(=N)O)C(O)=NC(CCC(=N)O)C(=O)O.O__MGKSESQMDITDINTPKPKKKQRWTPLEISLSVLVLLLTIIAVTMIALYATYDDGICKSSDCIKSAARLIQNMDATTEPCTDFFKYACGGWLKRNVIPETSSRYGNFDILRDELEVVLKDVLQEPKTEDIVAVQKAKALYRSCINESAIDSRGGEPLLKLLPDIYGWPVATENWEQKYGASWTAEKAIAQLNSKYGKKVLINLFVGTDDKNSVNHVIHIDQPRLGLPSRDYYECTGIYKEACTAYVDFMISVARLIRQEERLPIDENQLALEMNKVMELEKEIANATAKPEDRNDPMLLYNKMTLAQIQNNFSLEINGKPFSWLNFTNEIMSTVNISITNEEDVVVYAPEYLTKLKPILTKYSARDLQNLMSWRFIMDLVSSLSRTYKESRNAFRKALYGTTSETATWRRCANYVNGNMENAVGRLYVEAAFAGESKHVVEDLIAQIREVFIQTLDDLTWMDAETKKRAEEKALAIKERIGYPDDIVSNDNKLNNEYLELNYKEDEYFENIIQNLKFSQSKQLKKLREKVDKDEWISGAAVVNAFYSSGRNQIVFPAGILQPPFFSAQQSNSLNYGGIGMVIGHEITHGFDDNGRNFNKDGDLVDWWTQQSASNFKEQSQCMVYQYGNFSWDLAGGQHLNGINTLGENIADNGGLGQAYRAYQNYIKKNGEEKLLPGLDLNHKQLFFLNFAQVWCGTYRPEYAVNSIKTDVHSPGNFRIIGTLQNSAEFSEAFHCRKNSYMNPEKKCRVW,./data/raw/alphafold//AF-P08473-F1-model_v4.pdb,2897,1609,3207,1825 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+1849,2777,2815,MISIASNSVETQKAADTATNLMPPLINSTSQQNLTKLQPPACTNNIIDSTTATATINHVFRSKLPDIAIPNHLPLHTYCFQNLPEFSDRPCLIVGSTGKSYSFSETHLISQKTGAGLSNLGIQKGDVIMILLQNCAEFVFAFMGASLIGAVTTTANPFYTTAEIFKQVKAANAKLIITQSQYVNKLREHPSSADGADQNNYPKLGEDFKVVTIDDPPENCLHFSVLSEANEKELPDVVIDAEDPVALPFSSGTTGLPKGVILTHKNLVTSVAQQVDGENPNLYLKEDDVVLCVLPLFHIFSFNSVLLCSLRAGAGVLLMHKFEIGTLLELIQRYRVSVAAVVPPLVIALAKNPMVAEFDLSSIRVVLSGAAPLGKELEEALKSRVPQAVLGQGYGMTEAGPVLSMCMAFAKEPMPTKSGSCGTVVRNAELKVLDPETGLSLGYNQPGEICIRGFQIMKGYLNDAAATATTIDTEGWLHTGDVGYVDDDDEVFIVDRVKELIKFKGFQVPPAELESLLISHPSIADAAVVPQRDDAAGEVPVAFVVRSDGLELTEEAVKEFIAKQVVFYKRLHKVHFVHAIPKSASGKILRKDLRAKLATATPPLP,brenda,D5LNB6,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.COc1cc(/C=C/C(=O)O)ccc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>COc1cc(/C=C/C(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2OP(=O)(O)O)ccc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.38,0.0,22.0,7.5,6.2.1.12,36599.0,-0.4202164033831898,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.COc1cc(/C=C/C(=O)O)ccc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,COc1cc(/C=C/C(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2OP(=O)(O)O)ccc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,-0.4202164033831898,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.COc1cc(/C=C/C(=O)O)ccc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MISIASNSVETQKAADTATNLMPPLINSTSQQNLTKLQPPACTNNIIDSTTATATINHVFRSKLPDIAIPNHLPLHTYCFQNLPEFSDRPCLIVGSTGKSYSFSETHLISQKTGAGLSNLGIQKGDVIMILLQNCAEFVFAFMGASLIGAVTTTANPFYTTAEIFKQVKAANAKLIITQSQYVNKLREHPSSADGADQNNYPKLGEDFKVVTIDDPPENCLHFSVLSEANEKELPDVVIDAEDPVALPFSSGTTGLPKGVILTHKNLVTSVAQQVDGENPNLYLKEDDVVLCVLPLFHIFSFNSVLLCSLRAGAGVLLMHKFEIGTLLELIQRYRVSVAAVVPPLVIALAKNPMVAEFDLSSIRVVLSGAAPLGKELEEALKSRVPQAVLGQGYGMTEAGPVLSMCMAFAKEPMPTKSGSCGTVVRNAELKVLDPETGLSLGYNQPGEICIRGFQIMKGYLNDAAATATTIDTEGWLHTGDVGYVDDDDEVFIVDRVKELIKFKGFQVPPAELESLLISHPSIADAAVVPQRDDAAGEVPVAFVVRSDGLELTEEAVKEFIAKQVVFYKRLHKVHFVHAIPKSASGKILRKDLRAKLATATPPLP,./data/raw/alphafold//AF-D5LNB6-F1-model_v4.pdb,1669,1278,4569,1526 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+1851,8681,8817,MNIVENEICIRTLIDDDFPLMLKWLTDERVLEFYGGRDKKYTLESLKKHYTEPWEDEVFRVIIEYNNVPIGYGQIYKMYDELYTDYHYPKTDEIVYGMDQFIGEPNYWSKGIGTRYIKLIFEFLKKERNANAVILDPHKNNPRAIRAYQKSGFRIIEDLPEHELHEGKKEDCYLMEYRYDDNATNVKAMKYLIEHYFDNFKVDSIEIIGSGYDSVAYLVNNEYIFKTKFSTNKKKGYAKEKAIYNFLNTNLETNVKIPNIEYSYISDELSILGYKEIKGTFLTPEIYSTMSEEEQNLLKRDIASFLRQMHGLDYTDISECTIDNKQNVLEEYILLRETIYNDLTDIEKDYIESFMERLNATTVFEGKKCLCHNDFSCNHLLLDGNNRLTGIIDFGDSGIIDEYCDFIYLLEDSEEEIGTNFGEDILRMYGNIDIEKAKEYQDIVEEYYPIETIVYGIKNIKQEFIENGRKEIYKRTYKD,sabio,P0A0C2,CN[C@@H]1[C@@H](O)[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3OC(CN)=CC[C@H]3N)[C@@H](N)C[C@H]2N)OC[C@]1(C)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,0.4,38.14485023696273,,8.0,2.7.1.-,1351.0,-0.3979400086720376,CN[C@@H]1[C@@H](O)[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3OC(CN)=CC[C@H]3N)[C@@H](N)C[C@H]2N)OC[C@]1(C)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,-0.3979400086720376,CN[C@@H]1[C@@H](O)[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3OC(CN)=CC[C@H]3N)[C@@H](N)C[C@H]2N)OC[C@]1(C)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MNIVENEICIRTLIDDDFPLMLKWLTDERVLEFYGGRDKKYTLESLKKHYTEPWEDEVFRVIIEYNNVPIGYGQIYKMYDELYTDYHYPKTDEIVYGMDQFIGEPNYWSKGIGTRYIKLIFEFLKKERNANAVILDPHKNNPRAIRAYQKSGFRIIEDLPEHELHEGKKEDCYLMEYRYDDNATNVKAMKYLIEHYFDNFKVDSIEIIGSGYDSVAYLVNNEYIFKTKFSTNKKKGYAKEKAIYNFLNTNLETNVKIPNIEYSYISDELSILGYKEIKGTFLTPEIYSTMSEEEQNLLKRDIASFLRQMHGLDYTDISECTIDNKQNVLEEYILLRETIYNDLTDIEKDYIESFMERLNATTVFEGKKCLCHNDFSCNHLLLDGNNRLTGIIDFGDSGIIDEYCDFIYLLEDSEEEIGTNFGEDILRMYGNIDIEKAKEYQDIVEEYYPIETIVYGIKNIKQEFIENGRKEIYKRTYKD,./data/raw/alphafold//AF-P0A0C2-F1-model_v4.pdb,964,490,131,139 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+1886,7869,7997,MRIRRRALVFATMSAVLCTAGFMPSAGEAAADNGAGEETKSYAETYRLTADDVANINALNESAPAASSAGPSFRAPDSDDRVTPPAEPLDRMPDPYRPSYGRAETVVNNYIRKWQQVYSHRDGRKQQMTEEQREWLSYGCVGVTWVNSGQYPTNRLAFASFDEDRFKNELKNGRPRSGETRAEFEGRVAKESFDEEKGFQRAREVASVMNRALENAHDESAYLDNLKKELANGNDALRNEDARSPFYSALRNTPSFKERNGGNHDPSRMKAVIYSKHFWSGQDRSSSADKRKYGDPDAFRPAPGTGLVDMSRDRNIPRSPTSPGEGFVNFDYGWFGAQTEADADKTVWTHGNHYHAPNGSLGAMHVYESKFRNWSEGYSDFDRGAYVITFIPKSWNTAPDKVKQGWP,brenda,P81453,CCOC(=O)CN.O=C(O)CC[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)O>>CCOC(=O)CN=C(O)CC[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)O.N,1.83,0.1114521627835834,37.0,6.0,2.3.2.13,35621.0,0.2624510897304295,CCOC(=O)CN.O=C(O)CC[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)O,CCOC(=O)CN=C(O)CC[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)O.N,0.2624510897304295,CCOC(=O)CN.O=C(O)CC[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)O__MRIRRRALVFATMSAVLCTAGFMPSAGEAAADNGAGEETKSYAETYRLTADDVANINALNESAPAASSAGPSFRAPDSDDRVTPPAEPLDRMPDPYRPSYGRAETVVNNYIRKWQQVYSHRDGRKQQMTEEQREWLSYGCVGVTWVNSGQYPTNRLAFASFDEDRFKNELKNGRPRSGETRAEFEGRVAKESFDEEKGFQRAREVASVMNRALENAHDESAYLDNLKKELANGNDALRNEDARSPFYSALRNTPSFKERNGGNHDPSRMKAVIYSKHFWSGQDRSSSADKRKYGDPDAFRPAPGTGLVDMSRDRNIPRSPTSPGEGFVNFDYGWFGAQTEADADKTVWTHGNHYHAPNGSLGAMHVYESKFRNWSEGYSDFDRGAYVITFIPKSWNTAPDKVKQGWP,./data/raw/alphafold//AF-P81453-F1-model_v4.pdb,1005,541,194,209 +1887,9997,10147,MTHSQRRDKLKAQIAASGLDAMLISDLINVRYLSGFSGSNGALLVFADERDAVLATDGRYRTQAASQAPDLEVAIERAVGRYLAGRAGEAGVGKLGFESHVVTVDGLDALAGALEGKNTELVRASGTVESLREVKDAGELALLRLACEAADAALTDLVARGGLRPGRTERQVSRELEALMLDHGADAVSFETIVAAGANSAIPHHRPTDAVLQVGDFVKIDFGALVAGYHSDMTRTFVLGKAADWQLEIYQLVAEAQQAGRQALLPGAELRGVDAAARQLIADAGYGEHFGHGLGHGVGLQIHEAPGIGVTSAGTLLAGSVVTVEPGVYLPGRGGVRIEDTLVVAGGTPKMPETAGQTPELLTRFPKELAIL,brenda,I6YDN6,CSCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)O.O>>CSCC[C@H](N)C(=O)O.O=C(O)[C@@H]1CCCN1,18.0,1.0731369217096672e-14,55.0,8.0,3.4.11.9,1773.0,1.255272505103306,CSCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)O.O,CSCC[C@H](N)C(=O)O.O=C(O)[C@@H]1CCCN1,1.255272505103306,CSCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)O.O__MTHSQRRDKLKAQIAASGLDAMLISDLINVRYLSGFSGSNGALLVFADERDAVLATDGRYRTQAASQAPDLEVAIERAVGRYLAGRAGEAGVGKLGFESHVVTVDGLDALAGALEGKNTELVRASGTVESLREVKDAGELALLRLACEAADAALTDLVARGGLRPGRTERQVSRELEALMLDHGADAVSFETIVAAGANSAIPHHRPTDAVLQVGDFVKIDFGALVAGYHSDMTRTFVLGKAADWQLEIYQLVAEAQQAGRQALLPGAELRGVDAAARQLIADAGYGEHFGHGLGHGVGLQIHEAPGIGVTSAGTLLAGSVVTVEPGVYLPGRGGVRIEDTLVVAGGTPKMPETAGQTPELLTRFPKELAIL,./data/raw/alphafold//AF-I6YDN6-F1-model_v4.pdb,3600,3570,1353,3311 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+2072,19902,20188,MNHSKPRAPVDRRRFLNLVGLAGAGAGAVAAGVRPAAAGATPDPDIVNIPGWTQSLGAGVNNHPYGIPSPFEKDVVRREVTWLTASSESSVSFTPLYALDGIITPNGLCFVRHHGGEAEIDPARHRFMIHGMVDKPLVFTMEDIKRMPGRTNRAYFLECAANSGMEWRGAQLNGCQYTHGMIHNVVYTGVPLRAFLEAAGVKPKGKWVLAEGADASAMTRSIPIEKAMDDCLVAWAMNGEALRPEQGYPLRLVVPGWEGNMWIKWLRRVEIGDQPWGQREETSKYTDLLADGRSRRFTFFMDAKSVVTNPSPQAPLRAKGPNVVSGIAWSGRGTITRVDVSLDGGKNWTTARIEGPALPRSMTRFYLDFDWNGQELLLQSRAMDDSGYLQPTKAELRAVRGENSIYHNNGIQTWLVRSNGEAENVEVS,uniprot_search,Q9LAH5,O.O=S(O)O.O=S(O)O>>O=S(=O)(O)O.[H],33.51,29.43648099992205,25.0,6.0,1.8.2.1,921.0,1.5251744278352717,O.O=S(O)O.O=S(O)O,O=S(=O)(O)O.[H],1.5251744278352717,O.O=S(O)O.O=S(O)O__MNHSKPRAPVDRRRFLNLVGLAGAGAGAVAAGVRPAAAGATPDPDIVNIPGWTQSLGAGVNNHPYGIPSPFEKDVVRREVTWLTASSESSVSFTPLYALDGIITPNGLCFVRHHGGEAEIDPARHRFMIHGMVDKPLVFTMEDIKRMPGRTNRAYFLECAANSGMEWRGAQLNGCQYTHGMIHNVVYTGVPLRAFLEAAGVKPKGKWVLAEGADASAMTRSIPIEKAMDDCLVAWAMNGEALRPEQGYPLRLVVPGWEGNMWIKWLRRVEIGDQPWGQREETSKYTDLLADGRSRRFTFFMDAKSVVTNPSPQAPLRAKGPNVVSGIAWSGRGTITRVDVSLDGGKNWTTARIEGPALPRSMTRFYLDFDWNGQELLLQSRAMDDSGYLQPTKAELRAVRGENSIYHNNGIQTWLVRSNGEAENVEVS,./data/raw/alphafold//AF-Q9LAH5-F1-model_v4.pdb,1203,3006,534,609 +2073,9214,9356,MASKLALISTLIAAIKAQQIGTLTTETHPPLTWQTCTSGGSCTTNNGKVVLDANWRWLHSTSGSTNCYTGNTWNTTLCPDDTTCAQNCALDGADYEGTYGITASGNSLRLNFVTNGSQKNVGSRTYLMKDDTHYQTFNLLNQEFTFDVDVSGLPCGLNGALYMVPMAADGGVSNEPNNKAGAQYGVGYCDSQCPRDLKFIAGSANVQGWEPASNSANSGLGGNGSCCAELDIWEANSISAALTPHSADTVTQTVCNGDDCGGTYSNDRYSGTTDPDGCDFNSYRQGDTSFYGPGKTVDTNSKFTVVTQFLTDSSGNLNEIKRFYVQNGVVIPNSQSTIAGISGNSITQDYCTAQKQVFGDTNTWEDHGGFQSMTNAFKAGMVLVMSLWDDYYADMLWLDSVAYPTDADPSTPGVARGTCSTTSGVPSDIESSAASAYVIYSNIKVGPINSTFSGTPSTGGSSSSSTTLHTTTTSKVSSTPSHTTTTTHTTTTSSNGATQTEWGQCGGQGWTGPTNCVSGTTCKVSNPYYSQCLPN,brenda,A0A088T0J9,CO[C@@H]1[C@@H](O)[C@@H](O)O[C@H](CO)[C@H]1O[C@@H]1O[C@H](COc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@H](O)[C@H]1O>>O=[N+]([O-])c1ccc(O)cc1.OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O,0.19,0.4154919745870485,37.0,5.0,3.2.1.176,1173061.0,-0.721246399047171,CO[C@@H]1[C@@H](O)[C@@H](O)O[C@H](CO)[C@H]1O[C@@H]1O[C@H](COc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@H](O)[C@H]1O,O=[N+]([O-])c1ccc(O)cc1.OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O,-0.721246399047171,CO[C@@H]1[C@@H](O)[C@@H](O)O[C@H](CO)[C@H]1O[C@@H]1O[C@H](COc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@H](O)[C@H]1O__MASKLALISTLIAAIKAQQIGTLTTETHPPLTWQTCTSGGSCTTNNGKVVLDANWRWLHSTSGSTNCYTGNTWNTTLCPDDTTCAQNCALDGADYEGTYGITASGNSLRLNFVTNGSQKNVGSRTYLMKDDTHYQTFNLLNQEFTFDVDVSGLPCGLNGALYMVPMAADGGVSNEPNNKAGAQYGVGYCDSQCPRDLKFIAGSANVQGWEPASNSANSGLGGNGSCCAELDIWEANSISAALTPHSADTVTQTVCNGDDCGGTYSNDRYSGTTDPDGCDFNSYRQGDTSFYGPGKTVDTNSKFTVVTQFLTDSSGNLNEIKRFYVQNGVVIPNSQSTIAGISGNSITQDYCTAQKQVFGDTNTWEDHGGFQSMTNAFKAGMVLVMSLWDDYYADMLWLDSVAYPTDADPSTPGVARGTCSTTSGVPSDIESSAASAYVIYSNIKVGPINSTFSGTPSTGGSSSSSTTLHTTTTSKVSSTPSHTTTTTHTTTTSSNGATQTEWGQCGGQGWTGPTNCVSGTTCKVSNPYYSQCLPN,./data/raw/alphafold//AF-A0A088T0J9-F1-model_v4.pdb,1951,3462,1207,3134 +2074,22129,22462,MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,brenda,O94219,O=O.OCc1ccccc1>>O=Cc1ccccc1.OO,23.4,0.0,18.5,7.0,1.1.3.7,5323.0,1.3692158574101427,O=O.OCc1ccccc1,O=Cc1ccccc1.OO,1.5365584425715302,O=O.OCc1ccccc1__MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,./data/raw/alphafold//AF-O94219-F1-model_v4.pdb,1050,3522,1297,300 +2075,19826,20112,MHQVVCATTNPAKIQAILQAFHEIFGEGSCHIASVAVESGVPEQPFGSEETRAGARNRVANARRLLPEADFWVAIEAGIDGDSTFSWVVIENASQRGEARSATLPLPAVILEKVREGEALGPVMSRYTGIDEIGRKEGAIGVFTAGKLTRASVYHQAVILALSPFHNAVY,brenda,P39411,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O>>O=P(O)(O)O.O=P([O-])(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c([O-])nc([O-])nc32)[C@H](O)[C@@H]1O,2625.0,0.2793956774975712,25.0,6.7,3.6.1.73,562.0,3.419129307741976,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O,O=P(O)(O)O.O=P([O-])(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c([O-])nc([O-])nc32)[C@H](O)[C@@H]1O,3.419129307741976,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O__MHQVVCATTNPAKIQAILQAFHEIFGEGSCHIASVAVESGVPEQPFGSEETRAGARNRVANARRLLPEADFWVAIEAGIDGDSTFSWVVIENASQRGEARSATLPLPAVILEKVREGEALGPVMSRYTGIDEIGRKEGAIGVFTAGKLTRASVYHQAVILALSPFHNAVY,./data/raw/alphafold//AF-P39411-F1-model_v4.pdb,2507,4940,2014,4868 +2076,5389,5475,MKKLFVLCIFLFLSITASGEVLPDLKIEKLEEGVYLHTSFEEVSGWGVVTKHGLVVLVNNDAYLIDTPFTNKDTEKLVAWFVGRGFTIKGSVSSHFHSDSTGGIEWLNSQSIPTYASELTNELLKKNGKVQATNSFSGVSYWLVKNKIEIFYPGPGHTQDNVVVWLPENKILFGGCFVKPDGLGNLDDANLKAWPKSAKILMSKYGKAKLVVSGHSEIGNASLLKLTWEQAVKGLKESKKPLLPSN,brenda,Q8GIW8,CC1(C)S[C@@H]2[C@H](N=C(O)C(C(=O)O)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O>>,3.7,99.74837766499506,30.0,7.2,3.5.2.6,303.0,0.568201724066995,CC1(C)S[C@@H]2[C@H](N=C(O)C(C(=O)O)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O,,0.568201724066995,CC1(C)S[C@@H]2[C@H](N=C(O)C(C(=O)O)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O__MKKLFVLCIFLFLSITASGEVLPDLKIEKLEEGVYLHTSFEEVSGWGVVTKHGLVVLVNNDAYLIDTPFTNKDTEKLVAWFVGRGFTIKGSVSSHFHSDSTGGIEWLNSQSIPTYASELTNELLKKNGKVQATNSFSGVSYWLVKNKIEIFYPGPGHTQDNVVVWLPENKILFGGCFVKPDGLGNLDDANLKAWPKSAKILMSKYGKAKLVVSGHSEIGNASLLKLTWEQAVKGLKESKKPLLPSN,./data/raw/alphafold//AF-Q8GIW8-F1-model_v4.pdb,1448,985,796,1107 +2077,17306,17537,MPIKRLDTVVVNTGSQNDQHSASVPPVYLSTTFKVDLNNEDAQNYDYSRSGNPTRSVLQHQIGKLYRVPQENVLAVSSGMTTLDVILRGLVLLNGTDNHTPTIIAGDDLYGGTQRLLNFFKQQSHAVSVHVDTSDFEKFKTVFQSLDKVDCVLLESPTNPLCKVVDIPRILRFVKCISPDTTVVVDNTMMSGLNCNPLQLNPGCDVVYESATKYLNGHHDLMGGVIISKTPEIASKLYFVINSTGAGLSPMDSWLLVRGLKTLGVRLYQQQRNAMILAHWLENSCGFKPTRTNKATKTRFVGLRSNPDFKLHKSFNNGPGAVLSFETGSFEHSKRLVSSKKLSIWAVTVSFGCVNSLLSMPCKMSHASIDPELRKERDFPEDLVRLCCGIENIVDLKKDLLAAMVDADIIEVRENGKYLFNKLNKNLAVNTTIDDLHKPLSIYEEFYNQDLIRKDSELNIKSSKL,brenda,E3VL26,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O.O>>CC(=O)C(=O)O.N.N[C@@H](CCS)C(=O)O,0.91,5.901983426932362e-15,37.0,8.5,4.4.1.13,4932.0,-0.0409586076789063,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O.O,CC(=O)C(=O)O.N.N[C@@H](CCS)C(=O)O,-0.0409586076789063,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O.O__MPIKRLDTVVVNTGSQNDQHSASVPPVYLSTTFKVDLNNEDAQNYDYSRSGNPTRSVLQHQIGKLYRVPQENVLAVSSGMTTLDVILRGLVLLNGTDNHTPTIIAGDDLYGGTQRLLNFFKQQSHAVSVHVDTSDFEKFKTVFQSLDKVDCVLLESPTNPLCKVVDIPRILRFVKCISPDTTVVVDNTMMSGLNCNPLQLNPGCDVVYESATKYLNGHHDLMGGVIISKTPEIASKLYFVINSTGAGLSPMDSWLLVRGLKTLGVRLYQQQRNAMILAHWLENSCGFKPTRTNKATKTRFVGLRSNPDFKLHKSFNNGPGAVLSFETGSFEHSKRLVSSKKLSIWAVTVSFGCVNSLLSMPCKMSHASIDPELRKERDFPEDLVRLCCGIENIVDLKKDLLAAMVDADIIEVRENGKYLFNKLNKNLAVNTTIDDLHKPLSIYEEFYNQDLIRKDSELNIKSSKL,./data/raw/alphafold//AF-E3VL26-F1-model_v4.pdb,2777,5337,2605,5430 +2078,11522,11679,MEPGPDGPAASGPAAIREGWFRETCSLWPGQALSLQVEQLLHHRRSRYQDILVFRSKTYGNVLVLDGVIQCTERDEFSYQEMIANLPLCSHPNPRKVLIIGGGDGGVLREVVKHPSVESVVQCEIDEDVIQVSKKFLPGMAIGYSSSKLTLHVGDGFEFMKQNQDAFDVIITDSSDPMGPAESLFKESYYQLMKTALKEDGVLCCQGECQWLHLDLIKEMRQFCQSLFPVVAYAYCTIPTYPSGQIGFMLCSKNPSTNFQEPVQPLTQQQVAQMQLKYYNSDVHRAAFVLPEFARKALNDVS,sabio,P19623,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCN>>CSCC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCNCCCN,1.9,0.1136174069081229,37.0,7.5,2.5.1.16,9606.0,0.2787536009528289,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCN,CSCC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCNCCCN,0.2787536009528289,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCN__MEPGPDGPAASGPAAIREGWFRETCSLWPGQALSLQVEQLLHHRRSRYQDILVFRSKTYGNVLVLDGVIQCTERDEFSYQEMIANLPLCSHPNPRKVLIIGGGDGGVLREVVKHPSVESVVQCEIDEDVIQVSKKFLPGMAIGYSSSKLTLHVGDGFEFMKQNQDAFDVIITDSSDPMGPAESLFKESYYQLMKTALKEDGVLCCQGECQWLHLDLIKEMRQFCQSLFPVVAYAYCTIPTYPSGQIGFMLCSKNPSTNFQEPVQPLTQQQVAQMQLKYYNSDVHRAAFVLPEFARKALNDVS,./data/raw/alphafold//AF-P19623-F1-model_v4.pdb,3870,3997,1842,3666 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+2311,21770,22095,MRRRTFLTLAVLVSLSASLGLLTALIRKGPSEEWKFKISEVASDLEVPWSIAPLGGGRYLVTERPGRLVLISPSGKKLVASFDVANVGEAGLLGLALHPEFPKKSWVYLYASYFAEGGHIRNRVIRGRLDGSTFKLKEVKTLIDGIPGAYIHNGGRIRFGPDGMLYITTGDAADPRLAQDLSSLAGKILRVDEEGRPPADNPFPNSPIWSYGHRNPQGIDWHRASGVMVATEHGPVGHDEVNIILKGGNYGWPLATGKAGRGEFVDPVIDTGSETWAPSGASFVHGDMFPGLRGWLLIACLRGSMLAAVNFGDNMEVRKISTFFKNVFGRLRDVVIDDDGGILISTSNRDGRGSLRAGDDKILKIVSEQHT,brenda,Q8ZUN8,O=C1C=CC(=Nc2cc(Cl)c(O)c(Cl)c2)C=C1.OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O>>O=C1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O.Oc1ccc(Nc2cc(Cl)c(O)c(Cl)c2)cc1,2.3,0.0,50.0,8.0,1.1.5.2,13773.0,0.3617278360175928,O=C1C=CC(=Nc2cc(Cl)c(O)c(Cl)c2)C=C1.OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O,O=C1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O.Oc1ccc(Nc2cc(Cl)c(O)c(Cl)c2)cc1,0.3617278360175928,O=C1C=CC(=Nc2cc(Cl)c(O)c(Cl)c2)C=C1.OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O__MRRRTFLTLAVLVSLSASLGLLTALIRKGPSEEWKFKISEVASDLEVPWSIAPLGGGRYLVTERPGRLVLISPSGKKLVASFDVANVGEAGLLGLALHPEFPKKSWVYLYASYFAEGGHIRNRVIRGRLDGSTFKLKEVKTLIDGIPGAYIHNGGRIRFGPDGMLYITTGDAADPRLAQDLSSLAGKILRVDEEGRPPADNPFPNSPIWSYGHRNPQGIDWHRASGVMVATEHGPVGHDEVNIILKGGNYGWPLATGKAGRGEFVDPVIDTGSETWAPSGASFVHGDMFPGLRGWLLIACLRGSMLAAVNFGDNMEVRKISTFFKNVFGRLRDVVIDDDGGILISTSNRDGRGSLRAGDDKILKIVSEQHT,./data/raw/alphafold//AF-Q8ZUN8-F1-model_v4.pdb,3352,3441,1180,3105 +2312,21957,22288,MVSAHFILIHTICHGAWLWYKLIPLLQSAGHNATAIDLVASGIDPRQLEQIGTWEQYSEPLFTLIESIPEGKKVILVGESGGGINIALAAEKYPEKVSALVFHNALMPDIDHSPAFVYKKFSEVFTDWKDSIFSNYTYGNDTVTAVELGDRTLAENIFSNSPIEDVELAKHLVRKGSFFEQDLDTLPNFTSEGYGSIRRVYVYGEEDQIFSRDFQLWQINNYKPDKVYCVPSADHKIQISKVNELAQILQEVANSASDLLAVA,sabio,D1MX73,O=Cc1c(Cl)cccc1Cl.[C-]#N>>,24.7,99.50502890631186,25.0,4.0,4.1.2.47,316758.0,1.3926969532596658,O=Cc1c(Cl)cccc1Cl.[C-]#N,,1.3926969532596658,O=Cc1c(Cl)cccc1Cl.[C-]#N__MVSAHFILIHTICHGAWLWYKLIPLLQSAGHNATAIDLVASGIDPRQLEQIGTWEQYSEPLFTLIESIPEGKKVILVGESGGGINIALAAEKYPEKVSALVFHNALMPDIDHSPAFVYKKFSEVFTDWKDSIFSNYTYGNDTVTAVELGDRTLAENIFSNSPIEDVELAKHLVRKGSFFEQDLDTLPNFTSEGYGSIRRVYVYGEEDQIFSRDFQLWQINNYKPDKVYCVPSADHKIQISKVNELAQILQEVANSASDLLAVA,./data/raw/alphafold//AF-D1MX73-F1-model_v4.pdb,1488,546,202,219 +2313,10876,11031,MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,uniprot_search,P23946,C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)SCc1ccccc1.O>>,12.6,99.84120632379936,37.0,7.4,3.4.21.39,9606.0,1.100370545117563,C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)SCc1ccccc1.O,,1.250420002308894,C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)SCc1ccccc1.O__MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,./data/raw/alphafold//AF-P23946-F1-model_v4.pdb,1858,1553,3136,1905 +2314,1569,1597,MKNKLPPFIEIYRALIATPSISATEEALDQSNADLITLLADWFKDLGFNVEVQPVPGTRNKFNMLASIGQGAGGLLLAGHTDTVPFDDGRWTRDPFTLTEHDGKLYGLGTADMKGFFAFILDALRDVDVTKLKKPLYILATADEETSMAGARYFAETTALRPDCAIIGEPTSLQPVRAHKGHISNAIRIQGQSGHSSDPARGVNAIELMHDAIGHILQLRDNLKERYHYEAFTVPYPTLNLGHIHGGDASNRICACCELHMDIRPLPGMTLNELNGLLNDALAPVSERWPGRLTVDELHPPIPGYECPPNHQLVEVVEKLLGAKTEVVNYCTEAPFIQTLCPTLVLGPGSINQAHQPDEYLETRFIKPTRELITQVIHHFCWH,sabio,P23908,CC(=O)N[C@@H](CCC(=O)N)C(=O)O.O>>CC(=O)O.NC(=O)CCC(N)C(=O)O,260.0,1.3750355315679887e-14,25.0,7.0,3.5.1.16,562.0,2.414973347970818,CC(=O)N[C@@H](CCC(=O)N)C(=O)O.O,CC(=O)O.NC(=O)CCC(N)C(=O)O,2.414973347970818,CC(=O)N[C@@H](CCC(=O)N)C(=O)O.O__MKNKLPPFIEIYRALIATPSISATEEALDQSNADLITLLADWFKDLGFNVEVQPVPGTRNKFNMLASIGQGAGGLLLAGHTDTVPFDDGRWTRDPFTLTEHDGKLYGLGTADMKGFFAFILDALRDVDVTKLKKPLYILATADEETSMAGARYFAETTALRPDCAIIGEPTSLQPVRAHKGHISNAIRIQGQSGHSSDPARGVNAIELMHDAIGHILQLRDNLKERYHYEAFTVPYPTLNLGHIHGGDASNRICACCELHMDIRPLPGMTLNELNGLLNDALAPVSERWPGRLTVDELHPPIPGYECPPNHQLVEVVEKLLGAKTEVVNYCTEAPFIQTLCPTLVLGPGSINQAHQPDEYLETRFIKPTRELITQVIHHFCWH,./data/raw/alphafold//AF-P23908-F1-model_v4.pdb,1378,883,680,969 +2315,2834,2874,MITVAAPEAQPQVAAAVDEAPPEAVTVFRSKLPDIDIPSHLPLHEYCFARAAELPDAPCLIAAATGRTYTFAETRLLCRRAAAALHRLGVGHGDRVMVLLQNCVEFAVAFFAASFLGAVTTAANPFCTPQEIHKQFKASGVKLILTQSVYVDKLRQHEAFPRIDACTVGDDTLTVITIDDDEATPEGCLPFWDLIADADEGSVPEVAISPDDPVALPFSSGTTGLPKGVVLTHRSVVSGVAQQVDGENPNLHMGAGDVALCVLPLFHIFSLNSVLLCAVRAGAAVALMPRFEMGAMLGAIERWRVTVAAVVPPLVLALAKNPFVERHDLSSIRIVLSGAAPLGKELEDALRARLPQAIFGQGYGMTEAGPVLSMCPAFAKEPTPAKSGSCGTVVRNAELKVVDPDTGFSLGRNLPGEICIRGPQIMKGYLNDPEATAATIDVEGWLHTGDIGYVDDDDEVFIVDRVKELIKFKGFQVPPAELESLLIAHPSIADAAVVPQKDDVAGEVPVAFVVRAADSDITEESIKEFISKQVVFYKRLHKVHFIHAIPKSASGKILRRELRAKLAAC,brenda,Q42982,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)/C=C/c1ccc(O)cc1>>CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)C(O)C(O)=NCCC(O)=NCCSC(=O)/C=C/c1ccc(O)cc1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.0395,0.0,30.0,7.5,6.2.1.12,4530.0,-1.40340290437354,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)/C=C/c1ccc(O)cc1,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)C(O)C(O)=NCCC(O)=NCCSC(=O)/C=C/c1ccc(O)cc1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,-1.40340290437354,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)/C=C/c1ccc(O)cc1__MITVAAPEAQPQVAAAVDEAPPEAVTVFRSKLPDIDIPSHLPLHEYCFARAAELPDAPCLIAAATGRTYTFAETRLLCRRAAAALHRLGVGHGDRVMVLLQNCVEFAVAFFAASFLGAVTTAANPFCTPQEIHKQFKASGVKLILTQSVYVDKLRQHEAFPRIDACTVGDDTLTVITIDDDEATPEGCLPFWDLIADADEGSVPEVAISPDDPVALPFSSGTTGLPKGVVLTHRSVVSGVAQQVDGENPNLHMGAGDVALCVLPLFHIFSLNSVLLCAVRAGAAVALMPRFEMGAMLGAIERWRVTVAAVVPPLVLALAKNPFVERHDLSSIRIVLSGAAPLGKELEDALRARLPQAIFGQGYGMTEAGPVLSMCPAFAKEPTPAKSGSCGTVVRNAELKVVDPDTGFSLGRNLPGEICIRGPQIMKGYLNDPEATAATIDVEGWLHTGDIGYVDDDDEVFIVDRVKELIKFKGFQVPPAELESLLIAHPSIADAAVVPQKDDVAGEVPVAFVVRAADSDITEESIKEFISKQVVFYKRLHKVHFIHAIPKSASGKILRRELRAKLAAC,./data/raw/alphafold//AF-Q42982-F1-model_v4.pdb,1669,1278,4570,1527 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+32,17417,17654,MAKRIVEPFRIKMVEKIRVPSREEREAALKEAGYNPFLLPSSAVYIDLLTDSGTNAMSDHQWAAMITGDEAYAGSRNYYDLKDKAKELFNYDYIIPAHQGRGAENILFPVLLKYKQKEGKAKNPVFISNFHFDTTAAHVELNGCKAINIVTEKAFDSETYDDWKGDFDIKKLKENIAQHGADNIVAIVSTVTCNSAGGQPVSMSNLKEVYEIAKQHGIFVVMDSARFCENAYFIKARDPKYKNATIKEVIFDMYKYADALTMSAKKDPLLNIGGLVAIRDNEEIFTLARQRCVPMEGFVTYGGLAGRDMAAMVQGLEEGTEEEYLHYRIGQVKYLGDRLREAGIPIQYPTGGHAVFVDCKKLVPQIPGDQFPAQAVINALYLESGVRAVEIGSFLLGRDPATGEQKHADMEFMRLTIARRVYTNDHMDYIADALIGLKEKFATLKGLEFEYEPPVLRHFTARLKPIE,sabio,P28796,N[C@@H](CSCc1ccccc1)C(=O)O.O>>CC(=O)C(=O)O.N.SCc1ccccc1,1.95,1.2367965948974992e-14,30.0,8.0,4.1.99.1,585.0,0.290034611362518,N[C@@H](CSCc1ccccc1)C(=O)O.O,CC(=O)C(=O)O.N.SCc1ccccc1,0.290034611362518,N[C@@H](CSCc1ccccc1)C(=O)O.O__MAKRIVEPFRIKMVEKIRVPSREEREAALKEAGYNPFLLPSSAVYIDLLTDSGTNAMSDHQWAAMITGDEAYAGSRNYYDLKDKAKELFNYDYIIPAHQGRGAENILFPVLLKYKQKEGKAKNPVFISNFHFDTTAAHVELNGCKAINIVTEKAFDSETYDDWKGDFDIKKLKENIAQHGADNIVAIVSTVTCNSAGGQPVSMSNLKEVYEIAKQHGIFVVMDSARFCENAYFIKARDPKYKNATIKEVIFDMYKYADALTMSAKKDPLLNIGGLVAIRDNEEIFTLARQRCVPMEGFVTYGGLAGRDMAAMVQGLEEGTEEEYLHYRIGQVKYLGDRLREAGIPIQYPTGGHAVFVDCKKLVPQIPGDQFPAQAVINALYLESGVRAVEIGSFLLGRDPATGEQKHADMEFMRLTIARRVYTNDHMDYIADALIGLKEKFATLKGLEFEYEPPVLRHFTARLKPIE,./data/raw/alphafold//AF-P28796-F1-model_v4.pdb,1307,3864,6180,832 +33,16760,16990,MALSAIGFEGYEKRLEVTFFEPSIFQDSKGLGLRALTKSQLDEILTPAACTIVSSLSNDQLDSYVLSESSFFVYPYKVIIKTCGTTKLLLSIPPLLKLAGELSLSVKSVKYTRGSFLCPGGQPFPHRSFSEEVSVLDGHFTQLGLNSVAYLMGNDDETKKWHVYAASAQDSSNCNNNVYTLEMCMTGLDREKAAVFYKDEADKTGSMTDNSGIRKILPKSEICDFEFEPCGYSMNSIEGDAISTIHVTPEDGFSYASFEAVGYDFNTLDLSQLVTRVLSCFEPKQFSVAVHSSVGANSYKPEITVDLEDYGCRERTFESLGEESGTVMYQTFEKLGKYCGSPRSTLKCEWSSNNSCSSEDEKDEGI,sabio,Q96286,NCCCCC(N)C(=O)O>>NCCCCCN.O=C=O,5880.0,0.0,37.0,7.0,4.1.1.50,3702.0,3.7693773260761385,NCCCCC(N)C(=O)O,NCCCCCN.O=C=O,3.7693773260761385,NCCCCC(N)C(=O)O__MALSAIGFEGYEKRLEVTFFEPSIFQDSKGLGLRALTKSQLDEILTPAACTIVSSLSNDQLDSYVLSESSFFVYPYKVIIKTCGTTKLLLSIPPLLKLAGELSLSVKSVKYTRGSFLCPGGQPFPHRSFSEEVSVLDGHFTQLGLNSVAYLMGNDDETKKWHVYAASAQDSSNCNNNVYTLEMCMTGLDREKAAVFYKDEADKTGSMTDNSGIRKILPKSEICDFEFEPCGYSMNSIEGDAISTIHVTPEDGFSYASFEAVGYDFNTLDLSQLVTRVLSCFEPKQFSVAVHSSVGANSYKPEITVDLEDYGCRERTFESLGEESGTVMYQTFEKLGKYCGSPRSTLKCEWSSNNSCSSEDEKDEGI,./data/raw/alphafold//AF-Q96286-F1-model_v4.pdb,3847,3971,1815,3629 +34,15440,15664,MEYTSIADTGIEASRIGLGTWAIGGTMWGGTDEKTSIETIRAALDQGITLIDTAPAYGFGQSEEIVGKAIKEYGKRDQVILATKTALDWKNNQLFRHANRARIVEEVENSLKRLQTDYIDLYQVHWPDPLVPIEETAEVMKELYDAGKIRAIGVSNFSIEQMDTFRAVAPLHTIQPPYNLFEREMEESVLPYAKDNKITTLLYGSLCRGLLTGKMTEEYTFEGDDLRNHDPKFQKPRFKEYLSAVNQLDKLAKTRYGKSVIHLAVRWILDQPGADIALWGARKPGQLEALSEITGWTLNSEDQKDINTILENTISDPVGPEFMAPPTREEI,sabio,P80874,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.O=CC(O)CO.[H]>>NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1.OCC(O)CO,1.37,0.0,25.0,7.0,1.1.1.-,1423.0,0.1367205671564068,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.O=CC(O)CO.[H],NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1.OCC(O)CO,0.3180633349627615,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.O=CC(O)CO.[H]__MEYTSIADTGIEASRIGLGTWAIGGTMWGGTDEKTSIETIRAALDQGITLIDTAPAYGFGQSEEIVGKAIKEYGKRDQVILATKTALDWKNNQLFRHANRARIVEEVENSLKRLQTDYIDLYQVHWPDPLVPIEETAEVMKELYDAGKIRAIGVSNFSIEQMDTFRAVAPLHTIQPPYNLFEREMEESVLPYAKDNKITTLLYGSLCRGLLTGKMTEEYTFEGDDLRNHDPKFQKPRFKEYLSAVNQLDKLAKTRYGKSVIHLAVRWILDQPGADIALWGARKPGQLEALSEITGWTLNSEDQKDINTILENTISDPVGPEFMAPPTREEI,./data/raw/alphafold//AF-P80874-F1-model_v4.pdb,1333,820,610,897 +35,2275,2308,MSSKQQFVALSDGHFIPALGFGTYKPNEVPKSKSVEATKLAIGVGYRHIDTAYVYHVEEEIGQAIQSKIKAGDVKREDMFITTKLWCTCFRPELVRPSLEKSLKNLQLDYVDLYIMHFPVPMKSGNNDFPADGQGKLLLDTVDFCATWEALETCKDAGLVKSIGVSNFNHRQLERILNKPGLKYKPVCNQVECHIYNNQSKLLDYCKSKDIVLVAFGALGTQRYKECVDQNSPVLLNDPVLCDVAKKNKRSPALIALRYLVQRGVVPLAQSFKENEMKENLQVFEFQLSSEDMKTLEGLNKNFRYLPVKCFADHPEYPYSEEY,brenda,A0A097ZMZ1,CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]>>N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.056,19.32209682615081,25.0,7.4,1.1.1.51,10036.0,-1.2518119729937995,CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,-1.2518119729937995,CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]__MSSKQQFVALSDGHFIPALGFGTYKPNEVPKSKSVEATKLAIGVGYRHIDTAYVYHVEEEIGQAIQSKIKAGDVKREDMFITTKLWCTCFRPELVRPSLEKSLKNLQLDYVDLYIMHFPVPMKSGNNDFPADGQGKLLLDTVDFCATWEALETCKDAGLVKSIGVSNFNHRQLERILNKPGLKYKPVCNQVECHIYNNQSKLLDYCKSKDIVLVAFGALGTQRYKECVDQNSPVLLNDPVLCDVAKKNKRSPALIALRYLVQRGVVPLAQSFKENEMKENLQVFEFQLSSEDMKTLEGLNKNFRYLPVKCFADHPEYPYSEEY,./data/raw/alphafold//AF-A0A097ZMZ1-F1-model_v4.pdb,1329,1150,6276,1338 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+186,2485,2520,MKGEALKIIEEVLAQGRTAMVEYEAKQVLKAYGLPVPEEKLAKTLDEALKYAEEIGYPVAMKLMSPQILHKSDAKVVMLNIKSPEELKKKWEEIHENARKYRPDAEIFGVLIAPMLKPGREVIIGVTEDPQFGHAIMFGLGGIFVEILKDVTFRIIPITEKDARKMITEIKAYPILAGARGEEPADIEAIVDMLLKVSKLVDDLKDYIKEMDLNPVFVYRKGEGAVVVDARIILKG,sabio,Q8TZY8,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS.CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,68.0,59.06521453897881,80.0,8.4,6.2.1.13,2261.0,1.8325089127062364,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS.CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,1.8325089127062364,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS.CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MKGEALKIIEEVLAQGRTAMVEYEAKQVLKAYGLPVPEEKLAKTLDEALKYAEEIGYPVAMKLMSPQILHKSDAKVVMLNIKSPEELKKKWEEIHENARKYRPDAEIFGVLIAPMLKPGREVIIGVTEDPQFGHAIMFGLGGIFVEILKDVTFRIIPITEKDARKMITEIKAYPILAGARGEEPADIEAIVDMLLKVSKLVDDLKDYIKEMDLNPVFVYRKGEGAVVVDARIILKG,./data/raw/alphafold//AF-Q8TZY8-F1-model_v4.pdb,1412,924,723,1017 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+188,17596,17836,MTELTLKPGTLTLAQLRAIHAAPVRLQLDASAAPAIDASVACVEQIIAEDRTAYGINTGFGLLASTRIASHDLENLQRSLVLSHAAGIGAPLDDDLVRLIMVLKINSLSRGFSGIRRKVIDALIALVNAEVYPHIPLKGSVGASGDLAPLAHMSLVLLGEGKARYKGQWLSATEALAVAGLEPLTLAAKEGLALLNGTQASTAYALRGLFYAEDLYAAAIACGGLSVEAVLGSRSPFDARIHEARGQRGQIDTAACFRDLLGDSSEVSLSHKNCDKVQDPYSLRCQPQVMGACLTQLRQAAEVLGIEANAVSDNPLVFAAEGDVISGGNFHAEPVAMAADNLALAIAEIGSLSERRISLMMDKHMSQLPPFLVENGGVNSGFMIAQVTAAALASENKALSHPHSVDSLPTSANQEDHVSMAPAAGKRLWEMAENTRGVLAIEWLGACQGLDLRKGLKTSAKLEKARQALRSEVAHYDRDRFFAPDIEKAVELLAKGSLTGLLPAGVLPSL,brenda,P21310,N[C@@H](Cc1cnc[nH]1)C(=O)O>>N.O=C(O)/C=C/c1cnc[nH]1,86.0,9.129595659174984e-15,25.0,9.3,4.3.1.3,303.0,1.934498451243568,N[C@@H](Cc1cnc[nH]1)C(=O)O,N.O=C(O)/C=C/c1cnc[nH]1,1.934498451243568,N[C@@H](Cc1cnc[nH]1)C(=O)O__MTELTLKPGTLTLAQLRAIHAAPVRLQLDASAAPAIDASVACVEQIIAEDRTAYGINTGFGLLASTRIASHDLENLQRSLVLSHAAGIGAPLDDDLVRLIMVLKINSLSRGFSGIRRKVIDALIALVNAEVYPHIPLKGSVGASGDLAPLAHMSLVLLGEGKARYKGQWLSATEALAVAGLEPLTLAAKEGLALLNGTQASTAYALRGLFYAEDLYAAAIACGGLSVEAVLGSRSPFDARIHEARGQRGQIDTAACFRDLLGDSSEVSLSHKNCDKVQDPYSLRCQPQVMGACLTQLRQAAEVLGIEANAVSDNPLVFAAEGDVISGGNFHAEPVAMAADNLALAIAEIGSLSERRISLMMDKHMSQLPPFLVENGGVNSGFMIAQVTAAALASENKALSHPHSVDSLPTSANQEDHVSMAPAAGKRLWEMAENTRGVLAIEWLGACQGLDLRKGLKTSAKLEKARQALRSEVAHYDRDRFFAPDIEKAVELLAKGSLTGLLPAGVLPSL,./data/raw/alphafold//AF-P21310-F1-model_v4.pdb,2808,2381,2657,5496 +189,13892,14073,MRIFLKLLILLFCLKGQVMAQNLPTIALLATGGTIAGSSASASLGSYKSGELGIKDILKAVPSLNKIARIQGEQISNIGSQDMNEEVWFKLAKRAQELLDDSRIQGVVITHGTDTLEESAYFLNLVLRSTKPVVLVGAMRNAASLSADGALNLYNALSVATNEKSANKGVLVVMDDNIFSAREVVKTHTTHTSTFKALNSGAIGSVYYGKARYYMQPLRKHTIESEFSILELNPPLPKVDIIYTHVGMTPDLFQASLNSHAKGVVIAGVGNGNVSAGLLKAMQEASQMGVVIVRSSRVGSGEITSGEIDDKAFITSDNLNPQKARVLLQLALTKTNDKAKIQEMFEEY,brenda,A0A2X5A091,N=C(O)C[C@H](N)C(=O)O.O>>N.N[C@@H](CC(=O)O)C(=O)O,19.2,9.434028649044713e-15,37.0,7.5,3.5.1.1,210.0,1.2833012287035497,N=C(O)C[C@H](N)C(=O)O.O,N.N[C@@H](CC(=O)O)C(=O)O,1.2833012287035497,N=C(O)C[C@H](N)C(=O)O.O__MRIFLKLLILLFCLKGQVMAQNLPTIALLATGGTIAGSSASASLGSYKSGELGIKDILKAVPSLNKIARIQGEQISNIGSQDMNEEVWFKLAKRAQELLDDSRIQGVVITHGTDTLEESAYFLNLVLRSTKPVVLVGAMRNAASLSADGALNLYNALSVATNEKSANKGVLVVMDDNIFSAREVVKTHTTHTSTFKALNSGAIGSVYYGKARYYMQPLRKHTIESEFSILELNPPLPKVDIIYTHVGMTPDLFQASLNSHAKGVVIAGVGNGNVSAGLLKAMQEASQMGVVIVRSSRVGSGEITSGEIDDKAFITSDNLNPQKARVLLQLALTKTNDKAKIQEMFEEY,./data/raw/alphafold//AF-A0A2X5A091-F1-model_v4.pdb,2974,4610,4636,4463 +190,19638,19924,MKYDLIIIGSGSVGAAAGYYATRAGLNVLMTDAHMPPHQHGSHHGDTRLIRHAYGEGEKYVPLVLRAQTLWDELSRHNEEDPIFVRSGVINLGPADSTFLANVAHSAEQWQLNVEKLDAQGIMARWPEIRVPDNYIGLFETDSGFLRSELAIKTWIQLAKEAGCAQLFNCPVTAIRHDDDGVTIETADGEYQAKKAIVCAGTWVKDLLPELPVQPVRKVFAWYQADGRYSVKNKFPAFTGELPNGDQYYGFPAENDALKIGKHNGGQVIHSADERVPFAEVASDGSEAFPFLRNVLPGIGCCLYGAACTYDNSPDEDFIIDTLPGHDNTLLITGLSGHGFKFASVLGEIAADFAQDKKSDFDLTPFRLSRFQ,sabio,P40874,O.O=O.O=O>>C=O.C=O.OO,71400.0,6.807772889759819,25.0,8.0,1.5.3.-,562.0,4.853698211776174,O.O=O.O=O,C=O.C=O.OO,4.853698211776174,O.O=O.O=O__MKYDLIIIGSGSVGAAAGYYATRAGLNVLMTDAHMPPHQHGSHHGDTRLIRHAYGEGEKYVPLVLRAQTLWDELSRHNEEDPIFVRSGVINLGPADSTFLANVAHSAEQWQLNVEKLDAQGIMARWPEIRVPDNYIGLFETDSGFLRSELAIKTWIQLAKEAGCAQLFNCPVTAIRHDDDGVTIETADGEYQAKKAIVCAGTWVKDLLPELPVQPVRKVFAWYQADGRYSVKNKFPAFTGELPNGDQYYGFPAENDALKIGKHNGGQVIHSADERVPFAEVASDGSEAFPFLRNVLPGIGCCLYGAACTYDNSPDEDFIIDTLPGHDNTLLITGLSGHGFKFASVLGEIAADFAQDKKSDFDLTPFRLSRFQ,./data/raw/alphafold//AF-P40874-F1-model_v4.pdb,3479,3395,1129,3046 +191,21271,21595,MTIHGFTCIEGHTEGMPVRMVIDGAPTLQGATMNARREDFVAHHDWVRRTLMLEPRGHAHMSGTIFYPPVSDNADFSLLFIETSGCLPMCGHATIGSIAFAIEERLVVPKRPGTVTVDVPAGQIVARYQTDGERVTSVRFTNVPSFLLKRDVEIAIPALGTLAVDIAYGGNFYPIVEVQPNFPGCEHFTPDELLAWGRDVQRAVGDALEVVHPDNPAIRGVRHCMWTGKPIADDAHGRAVVIAGDSLVDRSPCGTGSSARVAQRFARGWLKEGEAYCHESLIGSRFIGRVESTVRLESGVDAVLSSIEGRAWVTGRAQYRVDPSQPYALGFSLQEFVN,sabio,A9AQW9,O=C(O)C1CC(O)CN1>>O=C(O)C1CC(O)CN1,5.6,0.0,25.0,8.0,5.1.1.8,87883.0,0.7481880270062004,O=C(O)C1CC(O)CN1,O=C(O)C1CC(O)CN1,0.7481880270062004,O=C(O)C1CC(O)CN1__MTIHGFTCIEGHTEGMPVRMVIDGAPTLQGATMNARREDFVAHHDWVRRTLMLEPRGHAHMSGTIFYPPVSDNADFSLLFIETSGCLPMCGHATIGSIAFAIEERLVVPKRPGTVTVDVPAGQIVARYQTDGERVTSVRFTNVPSFLLKRDVEIAIPALGTLAVDIAYGGNFYPIVEVQPNFPGCEHFTPDELLAWGRDVQRAVGDALEVVHPDNPAIRGVRHCMWTGKPIADDAHGRAVVIAGDSLVDRSPCGTGSSARVAQRFARGWLKEGEAYCHESLIGSRFIGRVESTVRLESGVDAVLSSIEGRAWVTGRAQYRVDPSQPYALGFSLQEFVN,./data/raw/alphafold//AF-A9AQW9-F1-model_v4.pdb,616,3355,5683,6582 +192,17496,17733,MKITGSNLSIYDVADVCMKRATVELDPSQLERVAVAHERTQAWGEAQHPIYGVNTGFGELVPVMIPRQHKRELQENLIRSHAAGGGEPFADDVVRAIMLARLNCLMKGYSGASVETVKLLAEFINRGIHPVIPQQGSLGASGDLSPLSHIALALIGEGTVSFKGQVRKTGDVLREEGLKPLELGFKGGLTLINGTSAMTGAACVALGRAYHLFRLALLATADFVQCLGGSTGPFEERGHLPKNHSGQVIVAREIRKLLAGSQLTSDHQDLMKEMVARSGVGNDVVDTGVYLQDAYTLRAVPQILGPVLDTLDFARKLIEEELNSTNDNPLIFDVPEQTFHGANFHGQYVAMACDYLNIAVTEIGVLAERQLNRLVDPNINGKLPPFLASAHSGLLCGFEGGQYLATSIASENLDLAAPSSIKSLPSNGSNQDVVSMGTTSARKSLRLCENVGTIVSTLIAACNQAGHILGNERFSPPIRELHGELSRSVPLYQDDSPIFELFQTVRAFVGGDGFRAHLVTHLDLAATTASS,brenda,Q0VZ68,N[C@@H](Cc1ccc(O)cc1)C(=O)O>>NC(CC(=O)O)c1ccc(O)cc1,0.0005,0.0,31.0,,5.4.3.6,52.0,-3.3010299956639813,N[C@@H](Cc1ccc(O)cc1)C(=O)O,NC(CC(=O)O)c1ccc(O)cc1,-2.1426675035687315,N[C@@H](Cc1ccc(O)cc1)C(=O)O__MKITGSNLSIYDVADVCMKRATVELDPSQLERVAVAHERTQAWGEAQHPIYGVNTGFGELVPVMIPRQHKRELQENLIRSHAAGGGEPFADDVVRAIMLARLNCLMKGYSGASVETVKLLAEFINRGIHPVIPQQGSLGASGDLSPLSHIALALIGEGTVSFKGQVRKTGDVLREEGLKPLELGFKGGLTLINGTSAMTGAACVALGRAYHLFRLALLATADFVQCLGGSTGPFEERGHLPKNHSGQVIVAREIRKLLAGSQLTSDHQDLMKEMVARSGVGNDVVDTGVYLQDAYTLRAVPQILGPVLDTLDFARKLIEEELNSTNDNPLIFDVPEQTFHGANFHGQYVAMACDYLNIAVTEIGVLAERQLNRLVDPNINGKLPPFLASAHSGLLCGFEGGQYLATSIASENLDLAAPSSIKSLPSNGSNQDVVSMGTTSARKSLRLCENVGTIVSTLIAACNQAGHILGNERFSPPIRELHGELSRSVPLYQDDSPIFELFQTVRAFVGGDGFRAHLVTHLDLAATTASS,./data/raw/alphafold//AF-Q0VZ68-F1-model_v4.pdb,2682,3778,2351,5249 +193,16503,16731,MLTCNGSKSFQKFIKGVTNLMENGLFEEEIVCGIEKLLEELLEKKTWLPLDKQKANLTQYARHLLYEDPLKRFEVLALVWKDGQSTPLHDHDGTWGVEGVFSGRIMVKNFIQTKQLGNSLVYLTHTGNLYLGEGETDKVIPPADCHILEISKNESVITIHVYGKRLEKFKVYIPTEEKNVYMCETKYISYNS,sabio,Q81CX4,NC(CS)C(=O)O.O=O>>NC(C[SH](=O)=O)C(=O)O,2.0,9.248306129287583e-15,37.0,6.1,1.13.11.20,1396.0,0.3010299956639812,NC(CS)C(=O)O.O=O,NC(C[SH](=O)=O)C(=O)O,0.3010299956639812,NC(CS)C(=O)O.O=O__MLTCNGSKSFQKFIKGVTNLMENGLFEEEIVCGIEKLLEELLEKKTWLPLDKQKANLTQYARHLLYEDPLKRFEVLALVWKDGQSTPLHDHDGTWGVEGVFSGRIMVKNFIQTKQLGNSLVYLTHTGNLYLGEGETDKVIPPADCHILEISKNESVITIHVYGKRLEKFKVYIPTEEKNVYMCETKYISYNS,./data/raw/alphafold//AF-Q81CX4-F1-model_v4.pdb,2675,3768,2340,5236 +194,16675,16904,MTTIDFKAEVEKLKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFAGKNAGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEETAGKATVTLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,sabio,Q84BU9,NCC(O)=NC(Cc1cnc[nH]1)C(=O)O.O>>NCC(=O)O.N[C@@H](Cc1cnc[nH]1)C(=O)O,167.0,0.0,37.0,7.5,3.4.13.-,203404.0,2.222716471147584,NCC(O)=NC(Cc1cnc[nH]1)C(=O)O.O,NCC(=O)O.N[C@@H](Cc1cnc[nH]1)C(=O)O,2.222716471147584,NCC(O)=NC(Cc1cnc[nH]1)C(=O)O.O__MTTIDFKAEVEKLKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFAGKNAGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEETAGKATVTLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,./data/raw/alphafold//AF-Q84BU9-F1-model_v4.pdb,1801,1476,3046,1794 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+209,70,75,MDYAKRIGQVGALAVVLGVGAAVTTHAIGSAAPTDPSSSSTDSPVDACSPLGGSASSLAAIPGASVPQVGVRQVDPGSIPDDLLNALIDFLAAVRNGLVPIIENRTPVANPQQVSVPEGGTVGPVRFDACDPDGNRMTFAVRERGAPGGPQHGIVTVDQRTASFIYTADPGFVGTDTFSVNVSDDTSLHVHGLAGYLGPFHGHDDVATVTVFVGNTPTDTISGDFSMLTYNIAGLPFPLSSAILPRFFYTKEIGKRLNAYYVANVQEDFAYHQFLIKKSKMPSQTPPEPPTLLWPIGVPFSDGLNTLSEFKVQRLDRQTWYECTSDNCLTLKGFTYSQMRLPGGDTVDVYNLHTNTGGGPTTNANLAQVANYIQQNSAGRAVIVTGDFNARYSDDQSALLQFAQVNGLTDAWVQVEHGPTTPPFAPTCMVGNECELLDKIFYRSGQGVTLQAVSYGNEAPKFFNSKGEPLSDHSPAVVGFHYVADNVAVR,sabio,P9WKQ1,*C(=O)NC(COP(=O)(O)OCC[N+](C)(C)C)C(O)C=CCCCCCCCCCCCCC.O>>*C(=O)NC(CO)C(O)C=CCCCCCCCCCCCCC.C[N+](C)(C)CCOP(=O)(O)O,1800.0,4.448250825941194e-14,37.0,7.4,3.1.4.12,1773.0,3.255272505103306,*C(=O)NC(COP(=O)(O)OCC[N+](C)(C)C)C(O)C=CCCCCCCCCCCCCC.O,*C(=O)NC(CO)C(O)C=CCCCCCCCCCCCCC.C[N+](C)(C)CCOP(=O)(O)O,3.255272505103306,*C(=O)NC(COP(=O)(O)OCC[N+](C)(C)C)C(O)C=CCCCCCCCCCCCCC.O__MDYAKRIGQVGALAVVLGVGAAVTTHAIGSAAPTDPSSSSTDSPVDACSPLGGSASSLAAIPGASVPQVGVRQVDPGSIPDDLLNALIDFLAAVRNGLVPIIENRTPVANPQQVSVPEGGTVGPVRFDACDPDGNRMTFAVRERGAPGGPQHGIVTVDQRTASFIYTADPGFVGTDTFSVNVSDDTSLHVHGLAGYLGPFHGHDDVATVTVFVGNTPTDTISGDFSMLTYNIAGLPFPLSSAILPRFFYTKEIGKRLNAYYVANVQEDFAYHQFLIKKSKMPSQTPPEPPTLLWPIGVPFSDGLNTLSEFKVQRLDRQTWYECTSDNCLTLKGFTYSQMRLPGGDTVDVYNLHTNTGGGPTTNANLAQVANYIQQNSAGRAVIVTGDFNARYSDDQSALLQFAQVNGLTDAWVQVEHGPTTPPFAPTCMVGNECELLDKIFYRSGQGVTLQAVSYGNEAPKFFNSKGEPLSDHSPAVVGFHYVADNVAVR,./data/raw/alphafold//AF-P9WKQ1-F1-model_v4.pdb,914,420,59,62 +210,7108,7229,MAARLLLRSLRVLSARSATLPPPSARCSHSGAEARLETPSAKKLTDIGIRRIFSSEHDIFRESVRKFFQEEVIPYHEEWEKAGEVSRELWEKAGKQGLLGINIAEKHGGIGGDLLSTAVTWEEQAYSNCTGPGFSLHSDIVMPYIANYGTKEQIEQFIPQMTAGKCIGAIAMTEPGAGSDLQGVRTNAKRSGSDWILNGSKVFITNGWLSDLVIVVAVTNREARSPAHGISLFLVENGMKGFIKGKKLHKMGMKAQDTAELFFEDVRLPASALLGEENKGFYYLMQELPQERLLIADLAISACEFMFEETRNYVRQRKAFGKTVAHIQTVQHKLAELKTNICVTRAFVDSCLQLHETKRLDSASASMAKYWASELQNTVAYQCVQLHGGWGYMWEYPIAKAYVDARVQPIYGGTNEIMKELIARQIVSDS,sabio,P15650,CCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O.Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(CC(O)C(O)C(O)COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)c2cc1C>>CCCCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O.Cc1cc2c(cc1C)N(CC(O)C(O)C(O)COP(=O)(O)OP(=O)(O)OCC1OC(n3cnc4c(N)ncnc43)C(O)C1O)c1[nH]c(=O)[nH]c(=O)c1N2,2.4,0.0,32.0,8.0,1.3.8.8,10116.0,0.380211241711606,CCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O.Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(CC(O)C(O)C(O)COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)c2cc1C,CCCCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O.Cc1cc2c(cc1C)N(CC(O)C(O)C(O)COP(=O)(O)OP(=O)(O)OCC1OC(n3cnc4c(N)ncnc43)C(O)C1O)c1[nH]c(=O)[nH]c(=O)c1N2,0.380211241711606,CCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O.Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(CC(O)C(O)C(O)COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)c2cc1C__MAARLLLRSLRVLSARSATLPPPSARCSHSGAEARLETPSAKKLTDIGIRRIFSSEHDIFRESVRKFFQEEVIPYHEEWEKAGEVSRELWEKAGKQGLLGINIAEKHGGIGGDLLSTAVTWEEQAYSNCTGPGFSLHSDIVMPYIANYGTKEQIEQFIPQMTAGKCIGAIAMTEPGAGSDLQGVRTNAKRSGSDWILNGSKVFITNGWLSDLVIVVAVTNREARSPAHGISLFLVENGMKGFIKGKKLHKMGMKAQDTAELFFEDVRLPASALLGEENKGFYYLMQELPQERLLIADLAISACEFMFEETRNYVRQRKAFGKTVAHIQTVQHKLAELKTNICVTRAFVDSCLQLHETKRLDSASASMAKYWASELQNTVAYQCVQLHGGWGYMWEYPIAKAYVDARVQPIYGGTNEIMKELIARQIVSDS,./data/raw/alphafold//AF-P15650-F1-model_v4.pdb,3316,2165,3844,2663 +211,8866,9008,MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,uniprot_search,P08246,COC(=O)CCC(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](C)C(=O)SCc1ccccc1>>,46.0,99.79104982834744,25.0,7.4,3.4.21.37,9606.0,1.662757831681574,COC(=O)CCC(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](C)C(=O)SCc1ccccc1,,1.662757831681574,COC(=O)CCC(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](C)C(=O)SCc1ccccc1__MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,./data/raw/alphafold//AF-P08246-F1-model_v4.pdb,1869,1645,3250,2040 +212,22882,23224,MIPRVAKFNFRLLSLALLGIQVARSAITYQNPTDLPGDVDYDFIVAGGGTAGLVVASRLSENPEWNVLVIEAGPSNKDVFETRVPGLSSELRPRFDWNYTTIPQDALGGRSLNYSRAKLLGGCSSHNGMVYTRCSRDDWDNYAEITGNQAFSWDSILPVMKRAEKFSKDSSHKPVKGHIDPSVHGGDGKLSVVASYTNASFNDLLLETAKELSGEFPFKLDMNDGRPLGLTWTQYTIDQRGERSSSATAYLEGTGNNVHVLVNTLVTRIVSAENGTDFRSVEFATDADSPKIQLRAKKEVIVSGGVINSPQILMNSGIGGREVLGANGIDTLVDNPSVGKNLSDQAATIIMLDTTLPITDYDVDAALIEWKKSHTGPLAQGGRLNHLTWVRLPDDKLDGLDPSSGENSPHIEFQFGQISHQLPPSGLTRFSFYRHCSPIPPLINLYTVSRGSISLSNNDPFSHPLIDLNMFGEEIDPAILREGIRSARRMLSSQAFKGFVGETVFPPSDATSDEDLDTFLKTSTFSYVHGVGTLSMSPQSASWGVVNPDFRVKGTSGLRVVDASVIPFAPAGHTQEPVYAFAEHASVLIAKSYS,brenda,Q3L1D1,OC1OC[C@@H](O)[C@H](O)[C@H]1O.[Fe+2].c1cc[cH-]c1.c1cc[cH-]c1>>O=C1C(O)OC[C@@H](O)[C@@H]1O,111.1,38.751110186099126,30.0,4.0,1.1.99.29,5341.0,2.045714058940868,OC1OC[C@@H](O)[C@H](O)[C@H]1O.[Fe+2].c1cc[cH-]c1.c1cc[cH-]c1,O=C1C(O)OC[C@@H](O)[C@@H]1O,2.045714058940868,OC1OC[C@@H](O)[C@H](O)[C@H]1O.[Fe+2].c1cc[cH-]c1.c1cc[cH-]c1__MIPRVAKFNFRLLSLALLGIQVARSAITYQNPTDLPGDVDYDFIVAGGGTAGLVVASRLSENPEWNVLVIEAGPSNKDVFETRVPGLSSELRPRFDWNYTTIPQDALGGRSLNYSRAKLLGGCSSHNGMVYTRCSRDDWDNYAEITGNQAFSWDSILPVMKRAEKFSKDSSHKPVKGHIDPSVHGGDGKLSVVASYTNASFNDLLLETAKELSGEFPFKLDMNDGRPLGLTWTQYTIDQRGERSSSATAYLEGTGNNVHVLVNTLVTRIVSAENGTDFRSVEFATDADSPKIQLRAKKEVIVSGGVINSPQILMNSGIGGREVLGANGIDTLVDNPSVGKNLSDQAATIIMLDTTLPITDYDVDAALIEWKKSHTGPLAQGGRLNHLTWVRLPDDKLDGLDPSSGENSPHIEFQFGQISHQLPPSGLTRFSFYRHCSPIPPLINLYTVSRGSISLSNNDPFSHPLIDLNMFGEEIDPAILREGIRSARRMLSSQAFKGFVGETVFPPSDATSDEDLDTFLKTSTFSYVHGVGTLSMSPQSASWGVVNPDFRVKGTSGLRVVDASVIPFAPAGHTQEPVYAFAEHASVLIAKSYS,./data/raw/alphafold//AF-Q3L1D1-F1-model_v4.pdb,1062,627,1047,2948 +213,18005,18259,MGFTKKSLDQIDVKDKRVFMRVDFNVPMEKGKITNTKRIDATIPSIQYCLDHGCKAVVLASHLGRPDGHVVPELTLKPVAEKLEEILKHKVIFLNDCVGEEVIKACANPAPGSVILLENVRFHPEEEGSSIVDGKKVKADPEKVKEFREQLTKLGDVYVNDAFGTVHRAHSTMVGVNLSPKVSGFLVKKELGYFAKAFDHINRPYLGILGGAKVADKIPIINNFLEKVDQLIICGGMAYTFLAASKNMKIGKSLFDASKVEMCKELLAKAEAKKVEILLPFDFVACDKFGEDANTQICTLEEGIPEGWEGVDCGPKTSALWREKILAAKTIMWNGPCGVFEIDKFSAGTKALCEAVAAATQAGVLTIVGGGDTPTALKKFGLDKQVSHISTGGGASLELLQGLPLPGVANLDDAE,sabio,C4M192,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1.O=C(O)[C@H](O)COP(=O)(O)O>>Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1.O=C(OP(=O)(O)O)[C@H](O)COP(=O)(O)O,136.0,8.009082076995849e-15,37.0,7.0,2.7.2.3,5759.0,2.133538908370217,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1.O=C(O)[C@H](O)COP(=O)(O)O,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1.O=C(OP(=O)(O)O)[C@H](O)COP(=O)(O)O,2.133538908370217,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1.O=C(O)[C@H](O)COP(=O)(O)O__MGFTKKSLDQIDVKDKRVFMRVDFNVPMEKGKITNTKRIDATIPSIQYCLDHGCKAVVLASHLGRPDGHVVPELTLKPVAEKLEEILKHKVIFLNDCVGEEVIKACANPAPGSVILLENVRFHPEEEGSSIVDGKKVKADPEKVKEFREQLTKLGDVYVNDAFGTVHRAHSTMVGVNLSPKVSGFLVKKELGYFAKAFDHINRPYLGILGGAKVADKIPIINNFLEKVDQLIICGGMAYTFLAASKNMKIGKSLFDASKVEMCKELLAKAEAKKVEILLPFDFVACDKFGEDANTQICTLEEGIPEGWEGVDCGPKTSALWREKILAAKTIMWNGPCGVFEIDKFSAGTKALCEAVAAATQAGVLTIVGGGDTPTALKKFGLDKQVSHISTGGGASLELLQGLPLPGVANLDDAE,./data/raw/alphafold//AF-C4M192-F1-model_v4.pdb,46,2450,2729,5570 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+216,2941,2983,MEKERHIRIFDTTLRDGEQSPGVALSLDQKLEIAQALAQLNVDIIEAGFPVSGPMEFEAVRRIATEVKGPIIAALARTHTLDIDQAAKALEKAEKPRIHVFTSASKVHLQYMLRKTEEEVLEMADRMVRYARRYVDDVEFSAQDVMRADWEFVKRLYEVAIEAGATTINIPDTTGYGTPQEYGALIRRIRDEVVRGRDVIISTHTHDDLGMATANALAGVENGAGQIECTINGIGERAGNCALEEVVMALYVRRDWYKAYTRINTREIYRVSRLVERYTGMPVPPNKAIVGDNAFAHESGIHQDGVIKHRATYEIMDAELIGRRPAVLVLGKHSGRAAFKKALEDLGYKDLSEEEVKKLFARFKEIAEKKGPLSAEELQALVESEREPTSHFFQLEHVQFFSGSGLLPTATVKVKTPDGERVATHTGDGPVDAVYKAIQEAIGLRPELELYRVEAITGSTEALGQVTVRLRLGELQAVGVGVSPDIIEASALAFLDAAGKLASGRATRHPPSIEEVHRGV,brenda,Q72JC9,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)CC(=O)O.CC(C)C(=O)C(=O)O.O>>CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.CC(C)C(O)(C(=O)O)C(C(=O)O)C(=O)O,1.2,0.0,50.0,8.0,2.3.3.13,274.0,0.0791812460476248,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)CC(=O)O.CC(C)C(=O)C(=O)O.O,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.CC(C)C(O)(C(=O)O)C(C(=O)O)C(=O)O,0.0791812460476248,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)CC(=O)O.CC(C)C(=O)C(=O)O.O__MEKERHIRIFDTTLRDGEQSPGVALSLDQKLEIAQALAQLNVDIIEAGFPVSGPMEFEAVRRIATEVKGPIIAALARTHTLDIDQAAKALEKAEKPRIHVFTSASKVHLQYMLRKTEEEVLEMADRMVRYARRYVDDVEFSAQDVMRADWEFVKRLYEVAIEAGATTINIPDTTGYGTPQEYGALIRRIRDEVVRGRDVIISTHTHDDLGMATANALAGVENGAGQIECTINGIGERAGNCALEEVVMALYVRRDWYKAYTRINTREIYRVSRLVERYTGMPVPPNKAIVGDNAFAHESGIHQDGVIKHRATYEIMDAELIGRRPAVLVLGKHSGRAAFKKALEDLGYKDLSEEEVKKLFARFKEIAEKKGPLSAEELQALVESEREPTSHFFQLEHVQFFSGSGLLPTATVKVKTPDGERVATHTGDGPVDAVYKAIQEAIGLRPELELYRVEAITGSTEALGQVTVRLRLGELQAVGVGVSPDIIEASALAFLDAAGKLASGRATRHPPSIEEVHRGV,./data/raw/alphafold//AF-Q72JC9-F1-model_v4.pdb,1685,1302,4603,1567 +217,13629,13806,MGIKLPTLEDLREISKQFNLDLEDEELKSFLQLLKLQLESYERLDSLPDYTPRVKYQRTLGRPPMKEENPYGALVWITSIKGKEEGKLKGKRICIKDNVMIAGIPMLNGSKMLEGFVPHMDATVVSRILDEAGEIVAKTTCEDLCFSGGSHTSYPWPVLNPRNPEYMAGGSSSGSAVAVASGYCDMAVGGDQGGSIRIPSSWVGIYGLKPTHGLVPYTGAFSIEPTLDHLGPMANTVKDVALLLEVIAGRDELDSRQPDSLPPPPVKPYSKLIDGDVKDMKVGIVKEGFNWSNSEKDVDELVLDSAKKLEDYGIKVEDTSIPLHRMGLDIWTPIAIEGATATMILGSGVGWGRKGLFETQIADFFGNSLKSRARDLPNTVKGVLMLGYLMIKMYNNRYYAKARNLSIVLKEAYDSALRKYDALIMPTTPMKAMRYKSEPGFDEYFIMALGMINNTAPFDVTGHPAMNIPVGYSNGLPVGLMIIGRHFEEDKVLKLANVFERIKK,brenda,P95896,N=C(O)C1CCCCC1.O>>N.O=C(O)C1CCCCC1,16.3,9.7533696965052e-15,70.0,7.5,3.5.1.4,2287.0,1.212187604403958,N=C(O)C1CCCCC1.O,N.O=C(O)C1CCCCC1,1.212187604403958,N=C(O)C1CCCCC1.O__MGIKLPTLEDLREISKQFNLDLEDEELKSFLQLLKLQLESYERLDSLPDYTPRVKYQRTLGRPPMKEENPYGALVWITSIKGKEEGKLKGKRICIKDNVMIAGIPMLNGSKMLEGFVPHMDATVVSRILDEAGEIVAKTTCEDLCFSGGSHTSYPWPVLNPRNPEYMAGGSSSGSAVAVASGYCDMAVGGDQGGSIRIPSSWVGIYGLKPTHGLVPYTGAFSIEPTLDHLGPMANTVKDVALLLEVIAGRDELDSRQPDSLPPPPVKPYSKLIDGDVKDMKVGIVKEGFNWSNSEKDVDELVLDSAKKLEDYGIKVEDTSIPLHRMGLDIWTPIAIEGATATMILGSGVGWGRKGLFETQIADFFGNSLKSRARDLPNTVKGVLMLGYLMIKMYNNRYYAKARNLSIVLKEAYDSALRKYDALIMPTTPMKAMRYKSEPGFDEYFIMALGMINNTAPFDVTGHPAMNIPVGYSNGLPVGLMIIGRHFEEDKVLKLANVFERIKK,./data/raw/alphafold//AF-P95896-F1-model_v4.pdb,1085,655,336,378 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+306,1504,1532,MSRVAIVTGASSGNGLAIATRFLARGDRVAALDLSAETLEETARTHWHAYADKVLRVRADVADEGDVNAAIAATMEQFGAIDVLVNNAGITGNSEAGVLHTTPVEQFDKVMAVNVRGIFLGCRAVLPHMLLQGAGVIVNIASVASLVAFPGRSAYTTSKGAVLQLTKSVAVDYAGSGIRCNAVCPGMIETPMTQWRLDQPELRDQVLARIPQKEIGTAAQVADAVMFLAGEDATYVNGAALVMDGAYTAI,brenda,Q56840,CC(=O)CSCCS(=O)(=O)O.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]>>C[C@@H](O)CSCCS(=O)(=O)O.N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,29.0,0.0,30.0,7.5,1.1.1.268,280.0,1.462397997898956,CC(=O)CSCCS(=O)(=O)O.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],C[C@@H](O)CSCCS(=O)(=O)O.N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,1.462397997898956,CC(=O)CSCCS(=O)(=O)O.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]__MSRVAIVTGASSGNGLAIATRFLARGDRVAALDLSAETLEETARTHWHAYADKVLRVRADVADEGDVNAAIAATMEQFGAIDVLVNNAGITGNSEAGVLHTTPVEQFDKVMAVNVRGIFLGCRAVLPHMLLQGAGVIVNIASVASLVAFPGRSAYTTSKGAVLQLTKSVAVDYAGSGIRCNAVCPGMIETPMTQWRLDQPELRDQVLARIPQKEIGTAAQVADAVMFLAGEDATYVNGAALVMDGAYTAI,./data/raw/alphafold//AF-Q56840-F1-model_v4.pdb,1373,874,670,959 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+406,19583,19869,MIMNMKNIFYCLLPGLLLGACSNKVYEKTGDSVIVKVQHKETGGPRLVRLQVMGDKLIHVSATADSKFADPQSLIVVPQKKQTSFAVVQNGDTITVSTEEVKASVLASTGEVWFTDKNGELILQENKGGGKTFTPIEVEGTKGYTVCQVFESPEDEAFYGLGQHQADEFNYKGKNEELFQYNTKVSVPFVVSNKNYGILLDSYSFCRFGNPNDYSQLNRIFKLYDKTGQEGALTGTYVPKKGETLVRREDSIYFENLKTIENLPKKLPLMGAKVTYEGEIEPAQTGEFKFILYYAGYVKVYLNNEPVVPERWRTAWNPNSYKFAAHLEAGKRVPLKIEWQPDGGQSYCGLRALTPVNPEEQGKQSWWSEMTKQLDYYFMAGENMDDVISGYRSLTGKSPVMPKWAMGFWQSREKYNTQEEMLGALKGFRDRKIPLDNIVLDWNHWPENAWGSHEFDKARFPDPKAMVDSIHAMHARMMISVWPKFYVTTEHFKEFDENGWMYQQSVKDSLKDWVGPGYHYGFYDAYDPDARKLFWKQMYEHYYPLGIDAWWMDASEPNVRDCTDLEYRKALCGPTALGSSTEFFNAYALMNAEAIYDGQRGVDNNKRVFLLTRSGFAGLQRYSTATWSGDIGTRWEDMKAQISAGLNFAMSGIPYWTMDIGGFCVENRYVAGQKQWNATKTENADYKEWRELNTRWYQFGAFVPLYRAHGQYPFREIWEIAPEGHPAYQSVVYYTKLRYNMMPYIYSLAGMTWFDDYTIMRPLVMDFTADAEVNDIGDQFMFGPSFMVSPVYRYGDRSREIYFPQAEGWYDFYSGKFQAGGERKVIEAPYERIPLYVRAGAIIPFGDDIQYTDEKPAEHIRLYIYQGADGEFTLYEDEGVNYNYEQGMYAMIPMKYDEATKTLVIGERQGEFPGMLKERTFTVVTVNKEKAQPFDLNAKGVTVKYNGSEQTLKL,sabio,A7LXT0,O.O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO[C@H]1OC[C@@H](O)[C@H](O)[C@H]1O>>,1.78,99.69814601281068,37.0,7.6,3.2.1.177,28116.0,0.250420002308894,O.O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO[C@H]1OC[C@@H](O)[C@H](O)[C@H]1O,,0.250420002308894,O.O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO[C@H]1OC[C@@H](O)[C@H](O)[C@H]1O__MIMNMKNIFYCLLPGLLLGACSNKVYEKTGDSVIVKVQHKETGGPRLVRLQVMGDKLIHVSATADSKFADPQSLIVVPQKKQTSFAVVQNGDTITVSTEEVKASVLASTGEVWFTDKNGELILQENKGGGKTFTPIEVEGTKGYTVCQVFESPEDEAFYGLGQHQADEFNYKGKNEELFQYNTKVSVPFVVSNKNYGILLDSYSFCRFGNPNDYSQLNRIFKLYDKTGQEGALTGTYVPKKGETLVRREDSIYFENLKTIENLPKKLPLMGAKVTYEGEIEPAQTGEFKFILYYAGYVKVYLNNEPVVPERWRTAWNPNSYKFAAHLEAGKRVPLKIEWQPDGGQSYCGLRALTPVNPEEQGKQSWWSEMTKQLDYYFMAGENMDDVISGYRSLTGKSPVMPKWAMGFWQSREKYNTQEEMLGALKGFRDRKIPLDNIVLDWNHWPENAWGSHEFDKARFPDPKAMVDSIHAMHARMMISVWPKFYVTTEHFKEFDENGWMYQQSVKDSLKDWVGPGYHYGFYDAYDPDARKLFWKQMYEHYYPLGIDAWWMDASEPNVRDCTDLEYRKALCGPTALGSSTEFFNAYALMNAEAIYDGQRGVDNNKRVFLLTRSGFAGLQRYSTATWSGDIGTRWEDMKAQISAGLNFAMSGIPYWTMDIGGFCVENRYVAGQKQWNATKTENADYKEWRELNTRWYQFGAFVPLYRAHGQYPFREIWEIAPEGHPAYQSVVYYTKLRYNMMPYIYSLAGMTWFDDYTIMRPLVMDFTADAEVNDIGDQFMFGPSFMVSPVYRYGDRSREIYFPQAEGWYDFYSGKFQAGGERKVIEAPYERIPLYVRAGAIIPFGDDIQYTDEKPAEHIRLYIYQGADGEFTLYEDEGVNYNYEQGMYAMIPMKYDEATKTLVIGERQGEFPGMLKERTFTVVTVNKEKAQPFDLNAKGVTVKYNGSEQTLKL,./data/raw/alphafold//AF-A7LXT0-F1-model_v4.pdb,1075,643,320,357 +407,6509,6622,MKTSAQQLLSLLLLPLSAIAAPTGEIEARACSTVTVIFARGTTETPTLGTVIGPQFLAALKSSFGGSVTMNGVPYAADVPGFLKGGDPTGSKVMANMVSSALSSCPNTKLVISGYSQGGQLVHNAAKQLPAATTAKIAAAVIFGDPDNGSPVQGVPAAKTKIICHAGDNICQHGSMILMPHLTYGMDATAAAAFVKQVAGS,brenda,Q8TGB8,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,0.66,0.0,,,3.1.1.74,38448.0,-0.1804560644581313,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,-0.1804560644581313,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MKTSAQQLLSLLLLPLSAIAAPTGEIEARACSTVTVIFARGTTETPTLGTVIGPQFLAALKSSFGGSVTMNGVPYAADVPGFLKGGDPTGSKVMANMVSSALSSCPNTKLVISGYSQGGQLVHNAAKQLPAATTAKIAAAVIFGDPDNGSPVQGVPAAKTKIICHAGDNICQHGSMILMPHLTYGMDATAAAAFVKQVAGS,./data/raw/alphafold//AF-Q8TGB8-F1-model_v4.pdb,3240,2065,3720,2574 +408,20277,20572,MVLNFRDKSCIFLAILCCLSLSCIVKASVSYDRKAVIINGQRRILLSGSIHYPRSTPEMWPGLIQKAKEGGLDVIETYVFWNGHEPSPGQYYFGDRYDLVKFIKLVHQAGLYVNLRIGPYVCAEWNFGGFPVWLKFVPGMAFRTDNEPFKAAMKKFTEKIVWMMKAEKLFQTQGGPIILAQIENEYGPVEWEIGAPGKAYTKWVAQMALGLSTGVPWIMCKQEDAPGPIIDTCNGYYCEDFKPNSINKPKMWTENWTGWYTDFGGAVPYRPVEDIAYSVARFIQKGGSLVNYYMYHGGTNFDRTAGEFMASSYDYDAPLDEYGLPREPKYSHLKALHKAIKLSEPALLSADATVTSLGAKQEAYVFWSKSSCAAFLSNKDENSAARVLFRGFPYDLPPWSVSILPDCKTEVYNTAKVNAPSVHRNMVPTGTKFSWGSFNEATPTANEAGTFARNGLVEQISMTWDKSDYFWYITDITIGSGETFLKTGDSPLLTVMSAGHALHVFVNGQLSGTAYGGLDHPKLTFSQKIKLHAGVNKIALLSVAVGLPNVGTHFEQWNKGVLGPVTLKGVNSGTWDMSKWKWSYKIGVKGEALSLHTNTESSGVRWTQGSFVAKKQPLTWYKSTFATPAGNEPLALDMNTMGKGQVWINGRNIGRHWPAYKAQGSCGRCNYAGTFDAKKCLSNCGEASQRWYHVPRSWLKSQNLIVVFEELGGDPNGISLVKRT,sabio,Q9SCV8,O.O=[N+]([O-])c1ccccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O>>O=[N+]([O-])c1ccccc1O.OCC1OC(O)C(O)C(O)C1O,157.0,0.0,37.0,4.5,3.2.1.23,3702.0,2.1958996524092336,O.O=[N+]([O-])c1ccccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,O=[N+]([O-])c1ccccc1O.OCC1OC(O)C(O)C(O)C1O,2.3541084391474008,O.O=[N+]([O-])c1ccccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O__MVLNFRDKSCIFLAILCCLSLSCIVKASVSYDRKAVIINGQRRILLSGSIHYPRSTPEMWPGLIQKAKEGGLDVIETYVFWNGHEPSPGQYYFGDRYDLVKFIKLVHQAGLYVNLRIGPYVCAEWNFGGFPVWLKFVPGMAFRTDNEPFKAAMKKFTEKIVWMMKAEKLFQTQGGPIILAQIENEYGPVEWEIGAPGKAYTKWVAQMALGLSTGVPWIMCKQEDAPGPIIDTCNGYYCEDFKPNSINKPKMWTENWTGWYTDFGGAVPYRPVEDIAYSVARFIQKGGSLVNYYMYHGGTNFDRTAGEFMASSYDYDAPLDEYGLPREPKYSHLKALHKAIKLSEPALLSADATVTSLGAKQEAYVFWSKSSCAAFLSNKDENSAARVLFRGFPYDLPPWSVSILPDCKTEVYNTAKVNAPSVHRNMVPTGTKFSWGSFNEATPTANEAGTFARNGLVEQISMTWDKSDYFWYITDITIGSGETFLKTGDSPLLTVMSAGHALHVFVNGQLSGTAYGGLDHPKLTFSQKIKLHAGVNKIALLSVAVGLPNVGTHFEQWNKGVLGPVTLKGVNSGTWDMSKWKWSYKIGVKGEALSLHTNTESSGVRWTQGSFVAKKQPLTWYKSTFATPAGNEPLALDMNTMGKGQVWINGRNIGRHWPAYKAQGSCGRCNYAGTFDAKKCLSNCGEASQRWYHVPRSWLKSQNLIVVFEELGGDPNGISLVKRT,./data/raw/alphafold//AF-Q9SCV8-F1-model_v4.pdb,442,3106,5392,6273 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+463,12044,12207,MTSIQQRDAQSVLAAIDNLLPEIRDRAQATEDLRRLPDETVKALDDVGFFTLLQPQQWGGLQCDPALFFEATRRLASVCGSTGWVSSIVGVHNWHLALFDQRAQEEVWGEDPSTRISSSYAPMGAGVVVDGGYLVNGSWNWSSGCDHASWTFVGGPVIKDGRPVDFGSFLIPRSEYEIKDVWYVVGLRGTGSNTLVVKDVFVPRHRFLSYKAMNDHTAGGLATNSAPVYKMPWGTMHPTTISAPIVGMAYGAYAAHVEHQGKRVRAAFAGEKAKDDPFAKVRIAEAASDIDAAWRQLIGNVSDEYALLAAGKEIPFELRARARRDQVRATGRSIASIDRLFEASGATALSNEAPIQRFWRDAHAGRVHAANDPERAYVIFGNHEFGLPPGDTMV,brenda,P9WJA1,Cc1cc2c(cc1C)N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)O)C1N=C(O)N=C(O)C1=N2.O=O.Oc1cccc(-c2ccccc2)c1>>Cc1cc2nc3c(O)nc(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)O)c2cc1C.O.Oc1cccc(-c2ccccc2)c1O,0.11,0.0,25.0,7.4,1.14.14.12,1773.0,-0.958607314841775,Cc1cc2c(cc1C)N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)O)C1N=C(O)N=C(O)C1=N2.O=O.Oc1cccc(-c2ccccc2)c1,Cc1cc2nc3c(O)nc(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)O)c2cc1C.O.Oc1cccc(-c2ccccc2)c1O,-0.958607314841775,Cc1cc2c(cc1C)N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)O)C1N=C(O)N=C(O)C1=N2.O=O.Oc1cccc(-c2ccccc2)c1__MTSIQQRDAQSVLAAIDNLLPEIRDRAQATEDLRRLPDETVKALDDVGFFTLLQPQQWGGLQCDPALFFEATRRLASVCGSTGWVSSIVGVHNWHLALFDQRAQEEVWGEDPSTRISSSYAPMGAGVVVDGGYLVNGSWNWSSGCDHASWTFVGGPVIKDGRPVDFGSFLIPRSEYEIKDVWYVVGLRGTGSNTLVVKDVFVPRHRFLSYKAMNDHTAGGLATNSAPVYKMPWGTMHPTTISAPIVGMAYGAYAAHVEHQGKRVRAAFAGEKAKDDPFAKVRIAEAASDIDAAWRQLIGNVSDEYALLAAGKEIPFELRARARRDQVRATGRSIASIDRLFEASGATALSNEAPIQRFWRDAHAGRVHAANDPERAYVIFGNHEFGLPPGDTMV,./data/raw/alphafold//AF-P9WJA1-F1-model_v4.pdb,1965,4114,1976,3814 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+538,13323,13498,MWKLWRAEEGAAALGGALFLLLFALGVRQLLKQRRPMGFPPGPPGLPFIGNIYSLAASSELPHVYMRKQSQVYGEIFSLDLGGISTVVLNGYDVVKECLVHQSEIFADRPCLPLFMKMTKMGGLLNSRYGRGWVDHRRLAVNSFRYFGYGQKSFESKILEETKFFNDAIETYKGRPFDFKQLITNAVSNITNLIIFGERFTYEDTDFQHMIELFSENVELAASASVFLYNAFPWIGILPFGKHQQLFRNAAVVYDFLSRLIEKASVNRKPQLPQHFVDAYLDEMDQGKNDPSSTFSKENLIFSVGELIIAGTETTTNVLRWAILFMALYPNIQGQVQKEIDLIMGPNGKPSWDDKCKMPYTEAVLHEVLRFCNIVPLGIFHATSEDAVVRGYSIPKGTTVITNLYSVHFDEKYWRDPEVFHPERFLDSSGYFAKKEALVPFSLGRRHCLGEHLARMEMFLFFTALLQRFHLHFPHELVPDLKPRLGMTLQPQPYLICAERR,brenda,Q6VVX0,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O.O=O.[H+]>>C=C1/C(=C\C=C2/CCC[C@]3(C)[C@@H]([C@H](C)CCCC(C)(C)O)CC[C@@H]23)C[C@@H](O)C[C@@H]1O.N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O,0.0075,19.35883399341469,37.0,7.4,1.14.14.24,9606.0,-2.1249387366083,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O.O=O.[H+],C=C1/C(=C\C=C2/CCC[C@]3(C)[C@@H]([C@H](C)CCCC(C)(C)O)CC[C@@H]23)C[C@@H](O)C[C@@H]1O.N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O,-2.1249387366083,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O.O=O.[H+]__MWKLWRAEEGAAALGGALFLLLFALGVRQLLKQRRPMGFPPGPPGLPFIGNIYSLAASSELPHVYMRKQSQVYGEIFSLDLGGISTVVLNGYDVVKECLVHQSEIFADRPCLPLFMKMTKMGGLLNSRYGRGWVDHRRLAVNSFRYFGYGQKSFESKILEETKFFNDAIETYKGRPFDFKQLITNAVSNITNLIIFGERFTYEDTDFQHMIELFSENVELAASASVFLYNAFPWIGILPFGKHQQLFRNAAVVYDFLSRLIEKASVNRKPQLPQHFVDAYLDEMDQGKNDPSSTFSKENLIFSVGELIIAGTETTTNVLRWAILFMALYPNIQGQVQKEIDLIMGPNGKPSWDDKCKMPYTEAVLHEVLRFCNIVPLGIFHATSEDAVVRGYSIPKGTTVITNLYSVHFDEKYWRDPEVFHPERFLDSSGYFAKKEALVPFSLGRRHCLGEHLARMEMFLFFTALLQRFHLHFPHELVPDLKPRLGMTLQPQPYLICAERR,./data/raw/alphafold//AF-Q6VVX0-F1-model_v4.pdb,1176,783,484,552 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+554,4515,4570,MDIIFGRNRKEQLEPVRAKVTGKIPAWLQGTLLRNGPGMHTVGESRYNHWFDGLALLHSFTIRDGEVYYRSKYLRSDTYNTNIEANRIVVSEFGTMAYPDPCKNIFSKAFSYLSHTIPDFTDNCLINIMKCGEDFYATSETNYIRKINPQTLETLEKVDYRKYVAVNLATSHPHYDEAGNVLNMGTSIVEKGKTKYVIFKIPATVPEGKKQGKSPWKHTEVFCSIPSRSLLSPSYYHSFGVTENYVIFLEQPFRLDILKMATAYIRRMSWASCLAFHREEKTYIHIIDQRTRQPVQTKFYTDAMVVFHHVNAYEEDGCIVFDVIAYEDNSLYQLFYLANLNQDFKENSRLTSVPTLRRFAVPLHVDKNAEVGTNLIKVASTTATALKEEDGQVYCQPEFLYEGLELPRVNYAHNGKQYRYVFATGVQWSPIPTKIIKYDILTKSSLKWREDDCWPAEPLFVPAPGAKDEDDGVILSAIVSTDPQKLPFLLILDAKSFTELARASVDVDMHMDLHGLFITDMDWDTKKQAASEEQRDRASDCHGAPLT,sabio,Q9HAY6,CC(C=CC=C(C)C=CC1=C(C)CCCC1(C)C)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C.O=O>>CC(C=CC=C(C)C=CC1=C(C)CCCC1(C)C)=CC=O,39.6,33.29431635821801,,,1.13.11.63,9606.0,1.5976951859255124,CC(C=CC=C(C)C=CC1=C(C)CCCC1(C)C)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C.O=O,CC(C=CC=C(C)C=CC1=C(C)CCCC1(C)C)=CC=O,1.5976951859255124,CC(C=CC=C(C)C=CC1=C(C)CCCC1(C)C)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C.O=O__MDIIFGRNRKEQLEPVRAKVTGKIPAWLQGTLLRNGPGMHTVGESRYNHWFDGLALLHSFTIRDGEVYYRSKYLRSDTYNTNIEANRIVVSEFGTMAYPDPCKNIFSKAFSYLSHTIPDFTDNCLINIMKCGEDFYATSETNYIRKINPQTLETLEKVDYRKYVAVNLATSHPHYDEAGNVLNMGTSIVEKGKTKYVIFKIPATVPEGKKQGKSPWKHTEVFCSIPSRSLLSPSYYHSFGVTENYVIFLEQPFRLDILKMATAYIRRMSWASCLAFHREEKTYIHIIDQRTRQPVQTKFYTDAMVVFHHVNAYEEDGCIVFDVIAYEDNSLYQLFYLANLNQDFKENSRLTSVPTLRRFAVPLHVDKNAEVGTNLIKVASTTATALKEEDGQVYCQPEFLYEGLELPRVNYAHNGKQYRYVFATGVQWSPIPTKIIKYDILTKSSLKWREDDCWPAEPLFVPAPGAKDEDDGVILSAIVSTDPQKLPFLLILDAKSFTELARASVDVDMHMDLHGLFITDMDWDTKKQAASEEQRDRASDCHGAPLT,./data/raw/alphafold//AF-Q9HAY6-F1-model_v4.pdb,3139,1344,3268,2062 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+610,16861,17091,MNVFSIFSLVFLAAFGSCADDRRSALEECFREADYEEFLEIARNGLKKTSNPKHVVVVGAGMAGLSAAYVLAGAGHRVTLLEASDRVGGRVNTYRDEKEGWYVNMGPMRLPERHRIVRTYIAKFGLKLNEFFQENENAWYFIRNIRKRVWEVKKDPGVFKYPVKPSEEGKSASQLYRESLKKVIEELKRTNCSYILDKYDTYSTKEYLIKEGNLSRGAVDMIGDLLNEDSSYYLSFIESLKNDDLFSYEKRFDEISDGFDQLPKSMHQAIAEMVHLNAQVIKIQRDAEKVRVAYQTPAKTLSYVTADYVIVCATSRAVRRISFEPPLPPKKAHALRSIHYKSATKIFLTCTRKFWEADGIHGGKSTTDLPSRFIYYPNHNFTSGVGVIVAYVLADDSDFFQALDIKTSADIVINDLSLIHQLPKNEIQALCYPSLIKKWSLDKYTMGALTSFTPYQFQDYIETVAAPVGRIYFAGEYTATVHGWLDSTIKSGLTAARNVNRASQKPSRIHLINDNQL,uniprot_search,A8QL52,NCCCC[C@H](N)C(=O)O.O.O=O>>N.NCCCCC(=O)C(=O)O.OO,318.9,7.224523629635546e-15,25.0,8.5,1.4.3.2,8613.0,2.50365451924296,NCCCC[C@H](N)C(=O)O.O.O=O,N.NCCCCC(=O)C(=O)O.OO,2.50365451924296,NCCCC[C@H](N)C(=O)O.O.O=O__MNVFSIFSLVFLAAFGSCADDRRSALEECFREADYEEFLEIARNGLKKTSNPKHVVVVGAGMAGLSAAYVLAGAGHRVTLLEASDRVGGRVNTYRDEKEGWYVNMGPMRLPERHRIVRTYIAKFGLKLNEFFQENENAWYFIRNIRKRVWEVKKDPGVFKYPVKPSEEGKSASQLYRESLKKVIEELKRTNCSYILDKYDTYSTKEYLIKEGNLSRGAVDMIGDLLNEDSSYYLSFIESLKNDDLFSYEKRFDEISDGFDQLPKSMHQAIAEMVHLNAQVIKIQRDAEKVRVAYQTPAKTLSYVTADYVIVCATSRAVRRISFEPPLPPKKAHALRSIHYKSATKIFLTCTRKFWEADGIHGGKSTTDLPSRFIYYPNHNFTSGVGVIVAYVLADDSDFFQALDIKTSADIVINDLSLIHQLPKNEIQALCYPSLIKKWSLDKYTMGALTSFTPYQFQDYIETVAAPVGRIYFAGEYTATVHGWLDSTIKSGLTAARNVNRASQKPSRIHLINDNQL,./data/raw/alphafold//AF-A8QL52-F1-model_v4.pdb,1381,1496,3067,1822 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+715,19185,19471,MNVFFMFSLLFLAALGSCADDRNPLAECFQENDYEEFLEIARNGLKATSNPKHVVIVGAGMAGLSAAYVLAGAGHQVTVLEASERPGGRVRTYRNEEAGWYANLGPMRLPEKHRIVREYIRKFDLRLNEFSQENDNAWYFIKNIRKKVGEVKKDPGLLKYPVKPSEAGKSAGQLYEESLGKVVEELKRTNCSYILNKYDTYSTKEYLIKEGDLSPGAVDMIGDLLNEDSGYYVSFIESLKHDDIFAYEKRFDEIVDGMDKLPTAMYRDIQDKVHFNAQVIKIQQNDQKVTVVYETLSKETPSVTADYVIVCTTSRAVRLIKFNPPLLPKKAHALRSVHYRSGTKIFLTCTTKFWEDDGIHGGKSTTDLPSRFIYYPNHNFTNGVGVIIAYGIGDDANFFQALDFKDCADIVFNDLSLIHQLPKKDIQSFCYPSVIQKWSLDKYAMGGITTFTPYQFQHFSDPLTASQGRIYFAGEYTAQAHGWIDSTIKSGLRAARDVNLASENPSGIHLSNDNEL,sabio,P81382,O.O=C(O)C(=O)Cc1c[nH]c2ccccc12.O=O>>N.O=C(O)C(=O)Cc1c[nH]c2ccccc12.OO,0.88,0.2029690118241326,25.0,8.5,1.4.3.2,8717.0,-0.0555173278498313,O.O=C(O)C(=O)Cc1c[nH]c2ccccc12.O=O,N.O=C(O)C(=O)Cc1c[nH]c2ccccc12.OO,-0.0555173278498313,O.O=C(O)C(=O)Cc1c[nH]c2ccccc12.O=O__MNVFFMFSLLFLAALGSCADDRNPLAECFQENDYEEFLEIARNGLKATSNPKHVVIVGAGMAGLSAAYVLAGAGHQVTVLEASERPGGRVRTYRNEEAGWYANLGPMRLPEKHRIVREYIRKFDLRLNEFSQENDNAWYFIKNIRKKVGEVKKDPGLLKYPVKPSEAGKSAGQLYEESLGKVVEELKRTNCSYILNKYDTYSTKEYLIKEGDLSPGAVDMIGDLLNEDSGYYVSFIESLKHDDIFAYEKRFDEIVDGMDKLPTAMYRDIQDKVHFNAQVIKIQQNDQKVTVVYETLSKETPSVTADYVIVCTTSRAVRLIKFNPPLLPKKAHALRSVHYRSGTKIFLTCTTKFWEDDGIHGGKSTTDLPSRFIYYPNHNFTNGVGVIIAYGIGDDANFFQALDFKDCADIVFNDLSLIHQLPKKDIQSFCYPSVIQKWSLDKYAMGGITTFTPYQFQHFSDPLTASQGRIYFAGEYTAQAHGWIDSTIKSGLRAARDVNLASENPSGIHLSNDNEL,./data/raw/alphafold//AF-P81382-F1-model_v4.pdb,1381,1496,3068,1821 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+782,22483,22820,MPKRVALGCDHAVYAAHQEIIGMINACSAVSKVMYMGPSSDSSVDYPDYAAQVCEAILKGEADTGILVCGTGIGMSIAANKFRGIRAALCYDHVTARLSRQHNNAHILCIGVRTSGPEIIRDIIETFLTTEPLEEGRHGSRLDKITVIEEQQMEDKQRWCFSGCGGLKEEGK,brenda,G9JM00,O=P(O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H]1O>>O=C(CO)[C@H](O)[C@H](O)COP(=O)(O)O,29.0,1.2324631488972247e-14,22.0,7.5,5.3.1.6,5661.0,1.462397997898956,O=P(O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H]1O,O=C(CO)[C@H](O)[C@H](O)COP(=O)(O)O,1.462397997898956,O=P(O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H]1O__MPKRVALGCDHAVYAAHQEIIGMINACSAVSKVMYMGPSSDSSVDYPDYAAQVCEAILKGEADTGILVCGTGIGMSIAANKFRGIRAALCYDHVTARLSRQHNNAHILCIGVRTSGPEIIRDIIETFLTTEPLEEGRHGSRLDKITVIEEQQMEDKQRWCFSGCGGLKEEGK,./data/raw/alphafold//AF-G9JM00-F1-model_v4.pdb,575,244,5993,6921 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+784,9599,9745,MGINFEDQTTLFNFVVREGNGVKGMIDSGLSSVPRPFVQPLSERIPTQKALTCEATQPIDLSNLDGPQHKEVAKQIVEAAETLGFFQVVNHGVSVELLELLKSSAHEFFAQAPEEKSMYLKEVSPSKLVKYGTSFVPDKEKAIEWKDYVSMLYTNDSEALQHWPQPCREVALEFLNSSMEMVKNVVNILMENVGVTLEEEKMNGLMGTKMVNMNYYPTCPSPELTVGVGRHSDMGMLTVLLQDGIGGLYVKLDNGEWAEIPPVHGALVINIGDTLQILSNGKYKSAEHRVRTTNIGSRVSVPIFTAPNPSQKVGPLPEVVKRDGVARYKEFLFQDYMNNFFGQPHDGKKSLDFARAE,brenda,Q9LE86,COc1cc2ccc(=O)oc2cc1O.O=C(O)CCC(=O)C(=O)O.O=O>>COc1cc2ccc(=O)oc2c(O)c1O.O=C(O)CCC(=O)O.O=C=O,1.73,7.665673074231191e-15,31.5,8.0,1.14.11.60,3702.0,0.2380461031287954,COc1cc2ccc(=O)oc2cc1O.O=C(O)CCC(=O)C(=O)O.O=O,COc1cc2ccc(=O)oc2c(O)c1O.O=C(O)CCC(=O)O.O=C=O,0.2380461031287954,COc1cc2ccc(=O)oc2cc1O.O=C(O)CCC(=O)C(=O)O.O=O__MGINFEDQTTLFNFVVREGNGVKGMIDSGLSSVPRPFVQPLSERIPTQKALTCEATQPIDLSNLDGPQHKEVAKQIVEAAETLGFFQVVNHGVSVELLELLKSSAHEFFAQAPEEKSMYLKEVSPSKLVKYGTSFVPDKEKAIEWKDYVSMLYTNDSEALQHWPQPCREVALEFLNSSMEMVKNVVNILMENVGVTLEEEKMNGLMGTKMVNMNYYPTCPSPELTVGVGRHSDMGMLTVLLQDGIGGLYVKLDNGEWAEIPPVHGALVINIGDTLQILSNGKYKSAEHRVRTTNIGSRVSVPIFTAPNPSQKVGPLPEVVKRDGVARYKEFLFQDYMNNFFGQPHDGKKSLDFARAE,./data/raw/alphafold//AF-Q9LE86-F1-model_v4.pdb,3553,3509,1279,3228 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+843,1310,1338,MNSKQQTVRLSDGHFIPVLGFGTYAPREVPKSKALEATKIAIDAGFRHIDSAAVYQNEKEVGLAIRSKIADGTVKREDIFYTSKVWCTFNHPERVQVCLEQSLKQLQLEYVDLYLIHFPMALKPEEDLKAKDENEKLLFDVVDICDTWKAMEKCKDAGLAKSIGVSNFNRRQLEKILNKPGLKHRPVCNQVECHPYLNQRKLLDFCKSKDIVLVAYSALGSHRETRCVDKSLPVLLADPVLCAIAKKYNWTPALIALRYQLERGVVVLAKSFTEKRIKENMQVFEFQLTSEDMKVLDGLNKNIRYMSGSRFQGHPDFPFLDEY,sabio,Q3MHS3,CC(=O)C(C)=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.[H]>>CC(O)C(C)O.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,960.0,0.1208588169983997,25.0,7.4,1.1.1.62,10116.0,2.9822712330395684,CC(=O)C(C)=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.[H],CC(O)C(C)O.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,2.9822712330395684,CC(=O)C(C)=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.[H]__MNSKQQTVRLSDGHFIPVLGFGTYAPREVPKSKALEATKIAIDAGFRHIDSAAVYQNEKEVGLAIRSKIADGTVKREDIFYTSKVWCTFNHPERVQVCLEQSLKQLQLEYVDLYLIHFPMALKPEEDLKAKDENEKLLFDVVDICDTWKAMEKCKDAGLAKSIGVSNFNRRQLEKILNKPGLKHRPVCNQVECHPYLNQRKLLDFCKSKDIVLVAYSALGSHRETRCVDKSLPVLLADPVLCAIAKKYNWTPALIALRYQLERGVVVLAKSFTEKRIKENMQVFEFQLTSEDMKVLDGLNKNIRYMSGSRFQGHPDFPFLDEY,./data/raw/alphafold//AF-Q3MHS3-F1-model_v4.pdb,1329,1150,326,366 +844,18676,18949,MAMAMADAHLRSSTSCVPSHCPALVPALATLTSLRKCAFHKPSFPSLVFQSYCLGWASGRGKTAASAVPVTTSGSSIDIKKCNEQARDARLQHLEAQALETLQKTVENFEKPAFPCALIAGDVVILDLLHRIGAFSDNKVKIIFIDTFHLFPETYKFLSEVEERYGFKAHVFHAADVNNKEAYDAKFGSDLFITDIEEYDRICKVEPFSRALKTLEVDAMINGRRRDHGAERAHLEVFEEGKMVKVQPLAYWEFRDCWDYLTKYSLPYHPLHDQGFPSIGDVQSTIPVPREKWFEYAGERSGRFQGLTNPDGSAKTECGIHVGGRT,brenda,Q8L5D0,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OS(=O)(=O)O)[C@@H](O)[C@H]1O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=S([O-])[O-].O[C@@H]1CSSC[C@@H]1O,0.333,15.10593203521277,30.0,7.5,1.8.4.10,3218.0,-0.4775557664936801,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OS(=O)(=O)O)[C@@H](O)[C@H]1O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=S([O-])[O-].O[C@@H]1CSSC[C@@H]1O,-0.4775557664936801,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OS(=O)(=O)O)[C@@H](O)[C@H]1O__MAMAMADAHLRSSTSCVPSHCPALVPALATLTSLRKCAFHKPSFPSLVFQSYCLGWASGRGKTAASAVPVTTSGSSIDIKKCNEQARDARLQHLEAQALETLQKTVENFEKPAFPCALIAGDVVILDLLHRIGAFSDNKVKIIFIDTFHLFPETYKFLSEVEERYGFKAHVFHAADVNNKEAYDAKFGSDLFITDIEEYDRICKVEPFSRALKTLEVDAMINGRRRDHGAERAHLEVFEEGKMVKVQPLAYWEFRDCWDYLTKYSLPYHPLHDQGFPSIGDVQSTIPVPREKWFEYAGERSGRFQGLTNPDGSAKTECGIHVGGRT,./data/raw/alphafold//AF-Q8L5D0-F1-model_v4.pdb,160,2657,2958,5807 +845,17793,18036,MSLAPVQVIGVLNVTDNSFSDGGRYLDPDDAVQHGLAMVAEGAAIVDVGGESTRPGAIRTDPRVELSRIVPVVKELAAQGITVSIDTTRADVARAALQSGARIVNDVSGGRADPAMAPLVAEAGVAWVLMHWRLMSAERPYEAPNYRDVVAEVRADLLAGVDQAVAAGVDPGSLVIDPGLGFAKTGQHNWALLNALPELVATGVPILLGASRKRFLGRLLAGADGAVRPPDGRETATAVISALAALHGAWGVRVHDVRASVDALKVVGAWLHAGPQIEKVRCDG,sabio,P0C0X1,Nc1ccc(C(=O)O)cc1.Nc1nc(O)c2c(n1)NCC(COP(=O)(O)OP(=O)(O)O)=N2>>Nc1nc2c(c(=O)[nH]1)N=C(CNc1ccc(C(=O)O)cc1)CN2.O=P(O)(O)OP(=O)(O)O,636.0,0.0,37.0,8.3,2.5.1.15,1769.0,2.803457115648414,Nc1ccc(C(=O)O)cc1.Nc1nc(O)c2c(n1)NCC(COP(=O)(O)OP(=O)(O)O)=N2,Nc1nc2c(c(=O)[nH]1)N=C(CNc1ccc(C(=O)O)cc1)CN2.O=P(O)(O)OP(=O)(O)O,2.803457115648414,Nc1ccc(C(=O)O)cc1.Nc1nc(O)c2c(n1)NCC(COP(=O)(O)OP(=O)(O)O)=N2__MSLAPVQVIGVLNVTDNSFSDGGRYLDPDDAVQHGLAMVAEGAAIVDVGGESTRPGAIRTDPRVELSRIVPVVKELAAQGITVSIDTTRADVARAALQSGARIVNDVSGGRADPAMAPLVAEAGVAWVLMHWRLMSAERPYEAPNYRDVVAEVRADLLAGVDQAVAAGVDPGSLVIDPGLGFAKTGQHNWALLNALPELVATGVPILLGASRKRFLGRLLAGADGAVRPPDGRETATAVISALAALHGAWGVRVHDVRASVDALKVVGAWLHAGPQIEKVRCDG,./data/raw/alphafold//AF-P0C0X1-F1-model_v4.pdb,2843,2421,2699,5540 +846,9456,9598,MKLTRRNTIKLLGAGLGSALVGAHWPGLAQGTLAFPEPKLLPLRRLESGLVEASLAARESNLSIGGKPVTLLTYGGMPGPTLRLREGETVRLQFTNHLTQVTNLHLHGLHVSPEVDDPLAQIQPGQSRMYEFTVPKGSAGTYWYHPHIHGRVAEQLYAGLLGLIVVEGPVDAIPELREAEEHVLVLKDFAFSGSRIAPFTPMDWMNGKEGDLLTVNAVIRPTLRAQRGTLRLRILNASNARYYRLALENHPLYLIATDGGFVEKPVELRELLLAPGERAEVLIRLTQAGSFRLQALPYDRGAMMMHGGGMGMMNHQGMGGMSHGGEQSTLAMQGMMMGMGPSRLETLLTIVAPPNPKPLPLPTSLATVERLDLTKVAATRRFELGERMMQAEFFINGRMFDPGRVDVRARRGTLEVWELINKTDMDHPFHLHTYPFQVLSINGRPQPYRAWKDTVNLKKNDVVRIAIPFRDFIGTTVYHCHIVEHEDRGMMGVLQVEAE,sabio,D3PLX1,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O>>O,6360.0,90.9985682302694,40.0,7.5,1.10.3.2,277.0,3.803457115648414,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O,O,3.803457115648414,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O__MKLTRRNTIKLLGAGLGSALVGAHWPGLAQGTLAFPEPKLLPLRRLESGLVEASLAARESNLSIGGKPVTLLTYGGMPGPTLRLREGETVRLQFTNHLTQVTNLHLHGLHVSPEVDDPLAQIQPGQSRMYEFTVPKGSAGTYWYHPHIHGRVAEQLYAGLLGLIVVEGPVDAIPELREAEEHVLVLKDFAFSGSRIAPFTPMDWMNGKEGDLLTVNAVIRPTLRAQRGTLRLRILNASNARYYRLALENHPLYLIATDGGFVEKPVELRELLLAPGERAEVLIRLTQAGSFRLQALPYDRGAMMMHGGGMGMMNHQGMGGMSHGGEQSTLAMQGMMMGMGPSRLETLLTIVAPPNPKPLPLPTSLATVERLDLTKVAATRRFELGERMMQAEFFINGRMFDPGRVDVRARRGTLEVWELINKTDMDHPFHLHTYPFQVLSINGRPQPYRAWKDTVNLKKNDVVRIAIPFRDFIGTTVYHCHIVEHEDRGMMGVLQVEAE,./data/raw/alphafold//AF-D3PLX1-F1-model_v4.pdb,3407,2292,3994,2885 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+956,6527,6640,MRKAPLLRFTLASLALACSQALAGPSPYSTLIVFGDSLADAGQFPDLVGGTPGARFTNRDADGNFAPVSPMILGGRLGVAPGDLNPSTSVGIQPDGNNWAVGGYTTQQILDSITTTSETVIPPGNPNAGLVLRERPGYLANGLRADPNALYYLTGGGNDFLQGLVNSPADAVAAGARLAASAQALQQGGARYIMVWLLPDLGQTPNFSGTPQQNPLSLLSAAFNQSLISQLGQIDAQIIPLNIPLLLSEALASPSQFGLASDQNLVGTCYSGDSCVENPVYGINGTTPDPTKLLFNDSVHPTIAGQQLIADYAYSILAAPWELTLLPEMAHASLRAHQDELRNQWQTPWQAVGQWQAFVASGAQDLDFDGQHSAASGDGRGYNLTVGGSYRLNDAWRLGLAGGANRQKLEAGEQDSDYKLNSYMASAFAQYRQDRWWADAALTAGHLDYSDLKRTFALGVNDRSEKGDTDGEAWAMSGRLGYNLAADTSNWQLAPFISADYARVKVDGYDEKSGRSTALGFDDQERTSRRLGVGLLGSVQVLPSTRLFAEVAQEHEFEDDEQDVTMHLTSLPANDFTLTGYTPHSDLTRASLGVSHELVAGVHLRGNYNWRKSDELTQQGISVGVSVDF,sabio,Q88QS0,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,345.0,0.0,,,3.1.1.1,303.0,2.537819095073274,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,2.537819095073274,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MRKAPLLRFTLASLALACSQALAGPSPYSTLIVFGDSLADAGQFPDLVGGTPGARFTNRDADGNFAPVSPMILGGRLGVAPGDLNPSTSVGIQPDGNNWAVGGYTTQQILDSITTTSETVIPPGNPNAGLVLRERPGYLANGLRADPNALYYLTGGGNDFLQGLVNSPADAVAAGARLAASAQALQQGGARYIMVWLLPDLGQTPNFSGTPQQNPLSLLSAAFNQSLISQLGQIDAQIIPLNIPLLLSEALASPSQFGLASDQNLVGTCYSGDSCVENPVYGINGTTPDPTKLLFNDSVHPTIAGQQLIADYAYSILAAPWELTLLPEMAHASLRAHQDELRNQWQTPWQAVGQWQAFVASGAQDLDFDGQHSAASGDGRGYNLTVGGSYRLNDAWRLGLAGGANRQKLEAGEQDSDYKLNSYMASAFAQYRQDRWWADAALTAGHLDYSDLKRTFALGVNDRSEKGDTDGEAWAMSGRLGYNLAADTSNWQLAPFISADYARVKVDGYDEKSGRSTALGFDDQERTSRRLGVGLLGSVQVLPSTRLFAEVAQEHEFEDDEQDVTMHLTSLPANDFTLTGYTPHSDLTRASLGVSHELVAGVHLRGNYNWRKSDELTQQGISVGVSVDF,./data/raw/alphafold//AF-Q88QS0-F1-model_v4.pdb,3245,2070,3728,2582 +957,4110,4163,MKFTTAAVLSALVSAEIAFAAPGGNGFARRQARRQARAAGLKASPFRQVNAKEATVESNWGGAILIGSDFDTVSATANVPSASGGSSAAGTAWVGIDGDTCQTAILQTGFDWYGDGTYDAWYEWYPEVSDDFSGITISEGDSIQMSVTATSDTSGSATLENLTTGQKVSKSFSNESSGSLCRTNAEFIIEDFEECNSNGSDCEFVPFASFSPAVEFTDCSVTSDGESVSLDDAQITQVIINNQDVTDCSVSGTTVSCSYV,uniprot_search,P15369,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CO)C(O)=N[C@@H](CO)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CO)C(=O)O.N=C(O)CC[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](CO)N=C(O)[C@@H](N)CO)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],0.063,4.050461616243485e-14,37.0,4.5,3.4.23.32,5539.0,-1.2006594505464183,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CO)C(O)=N[C@@H](CO)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CO)C(=O)O.N=C(O)CC[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](CO)N=C(O)[C@@H](N)CO)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],-1.2006594505464183,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CO)C(O)=N[C@@H](CO)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MKFTTAAVLSALVSAEIAFAAPGGNGFARRQARRQARAAGLKASPFRQVNAKEATVESNWGGAILIGSDFDTVSATANVPSASGGSSAAGTAWVGIDGDTCQTAILQTGFDWYGDGTYDAWYEWYPEVSDDFSGITISEGDSIQMSVTATSDTSGSATLENLTTGQKVSKSFSNESSGSLCRTNAEFIIEDFEECNSNGSDCEFVPFASFSPAVEFTDCSVTSDGESVSLDDAQITQVIINNQDVTDCSVSGTTVSCSYV,./data/raw/alphafold//AF-P15369-F1-model_v4.pdb,2888,1595,3189,1962 +958,2061,2092,MSNAVPAEISVQLSLALNAIERHLESTLLAVHLYGSALDGGLKPYSDIDLLVTVAAQLDETVRQALVVDLLEISASPGQSEALRALEVTIVVHGDVVPWRYPARRELQFGEWQRKDILAGIFEPATTDVDLAILLTKVRQHSLALAGSAAEDFFNPVPEGDLFKALSDTLKLWNSQPDWEGDERNVVLTLSRIWYSAATGKIAPKDIVANWAIERLPDQHKPVLLEARQAYLGRGEDCLASRADQLAAFVHFVKHEATKLLGAMPVMSKTKLGITKYSIVTNSNDSVTLRLMTEHDLAMLYEWLNRSHIVEWWGGEEARPTLADVQEQYLPSVLAQESVTPYIAMLNGEPIGYAQSYVALGSGDGWWEEETDPGVRGIDQSLANASQLGKGLGTKLVRALVELLFNDPEVTKIQTDPSPSNLRAIRCYEKAGFERQGTVTTPDGPAVYMVQTRQAFERTRSDA,brenda,Q8VQN7,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.NC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)O[C@@H]2CO)[C@H](N)[C@@H](O)[C@@H]1O>>CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.CC(O)=NC[C@H]1O[C@H](O[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]4N)[C@H]3O)[C@@H](O)[C@H](N)C[C@@H]2N)[C@H](N)[C@@H](O)[C@@H]1O,11.1,1.5959093626519028e-14,25.0,7.5,2.3.1.82,615.0,1.0453229787866574,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.NC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)O[C@@H]2CO)[C@H](N)[C@@H](O)[C@@H]1O,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.CC(O)=NC[C@H]1O[C@H](O[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]4N)[C@H]3O)[C@@H](O)[C@H](N)C[C@@H]2N)[C@H](N)[C@@H](O)[C@@H]1O,1.0453229787866574,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.NC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)O[C@@H]2CO)[C@H](N)[C@@H](O)[C@@H]1O__MSNAVPAEISVQLSLALNAIERHLESTLLAVHLYGSALDGGLKPYSDIDLLVTVAAQLDETVRQALVVDLLEISASPGQSEALRALEVTIVVHGDVVPWRYPARRELQFGEWQRKDILAGIFEPATTDVDLAILLTKVRQHSLALAGSAAEDFFNPVPEGDLFKALSDTLKLWNSQPDWEGDERNVVLTLSRIWYSAATGKIAPKDIVANWAIERLPDQHKPVLLEARQAYLGRGEDCLASRADQLAAFVHFVKHEATKLLGAMPVMSKTKLGITKYSIVTNSNDSVTLRLMTEHDLAMLYEWLNRSHIVEWWGGEEARPTLADVQEQYLPSVLAQESVTPYIAMLNGEPIGYAQSYVALGSGDGWWEEETDPGVRGIDQSLANASQLGKGLGTKLVRALVELLFNDPEVTKIQTDPSPSNLRAIRCYEKAGFERQGTVTTPDGPAVYMVQTRQAFERTRSDA,./data/raw/alphafold//AF-Q8VQN7-F1-model_v4.pdb,1517,1070,898,1233 +959,16572,16801,MECENGQVASNGNGLCMATPRADPLNWGKAAEELMGSHLEEVKRMVAEYRQPVVKIEGASLRIAQVAAVAAGAGEAKVQLDDSARGRVKESSDWVMNSMMNGTDSYGVTTGFGATSHRRTKEGGALQRELIRFLNAGAFGTGSDGHVLAAEATRAAMLVRINTLLQGYSGIRFEILEAIAKLLNANVTPCLPLRGTITASGDLVPLSYIAGLVTGRENSVAVAPDGRKVNAAEAFKIAGIQGGFFELQPKEGLAMVNGTAVGSGLASTVLFEANILAILAEVLSAVFCEVMNGKPEYTDHLTHKLKHHPGQIEAAAIMEHILEGSSYMKLAKKLGELDPLMKPKQDRYALRTSPQWLGPQIEVIRAATKSIEREINSVNDNPLIDVSRGKALHGGNFQGTPIGVSMDNTRLAIAAVGKLMFAQFSELVNDFYNNGLPSNLSGGRNPSLDYGFKGAEIAMASYCSELQFLGNPVTNHVQSAEQHNQDVNSLGLISSRKTAEAIDILKIMSSTFLVALCQAIDLRHIEENVKSAVKSCVMTVAKKTLSTNSTGDLHVARFCEKDLLKEIDREAVFAYADDPCSPNYPLMKKMRNVLVERALANGMAEFNAETSVFAKVAQFEEELRATLPRAVEAARAAVENGTAATPNRITECRSYPLYRFVREELGTAYLTGEKTRSPGEELNKVLLAINQGKHIDPLLECLKEWNGEPLPIN,sabio,C0LL35,NC(Cc1ccccc1)C(=O)O>>N.O=C(O)C=Cc1ccccc1,16.04,1.7153338381095052e-14,37.0,8.5,4.3.1.24,58923.0,1.205204363948145,NC(Cc1ccccc1)C(=O)O,N.O=C(O)C=Cc1ccccc1,1.205204363948145,NC(Cc1ccccc1)C(=O)O__MECENGQVASNGNGLCMATPRADPLNWGKAAEELMGSHLEEVKRMVAEYRQPVVKIEGASLRIAQVAAVAAGAGEAKVQLDDSARGRVKESSDWVMNSMMNGTDSYGVTTGFGATSHRRTKEGGALQRELIRFLNAGAFGTGSDGHVLAAEATRAAMLVRINTLLQGYSGIRFEILEAIAKLLNANVTPCLPLRGTITASGDLVPLSYIAGLVTGRENSVAVAPDGRKVNAAEAFKIAGIQGGFFELQPKEGLAMVNGTAVGSGLASTVLFEANILAILAEVLSAVFCEVMNGKPEYTDHLTHKLKHHPGQIEAAAIMEHILEGSSYMKLAKKLGELDPLMKPKQDRYALRTSPQWLGPQIEVIRAATKSIEREINSVNDNPLIDVSRGKALHGGNFQGTPIGVSMDNTRLAIAAVGKLMFAQFSELVNDFYNNGLPSNLSGGRNPSLDYGFKGAEIAMASYCSELQFLGNPVTNHVQSAEQHNQDVNSLGLISSRKTAEAIDILKIMSSTFLVALCQAIDLRHIEENVKSAVKSCVMTVAKKTLSTNSTGDLHVARFCEKDLLKEIDREAVFAYADDPCSPNYPLMKKMRNVLVERALANGMAEFNAETSVFAKVAQFEEELRATLPRAVEAARAAVENGTAATPNRITECRSYPLYRFVREELGTAYLTGEKTRSPGEELNKVLLAINQGKHIDPLLECLKEWNGEPLPIN,./data/raw/alphafold//AF-C0LL35-F1-model_v4.pdb,2681,3777,2359,5256 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+969,17528,17766,MSIVNESGSQPVVSRDETLSQIERTSFHISSGKDISLEEIARAARDHQPVTLHDEVVNRVTRSRSILESMVSDERVIYGVNTSMGGFVNYIVPIAKASELQNNLINAVATNVGKYFDDTTVRATMLARIVSLSRGNSAISIVNFKKLIEIYNQGIVPCIPEKGSLGTSGDLGPLAAIALVCTGQWKARYQGEQMSGAMALEKAGISPMELSFKEGLALINGTSAMVGLGVLLYDEVKRLFDTYLTVTSLSIEGLHGKTKPFEPAVHRMKPHQGQLEVATTIWETLADSSLAVNEHEVEKLIAEEMDGLVKASNHQIEDAYSIRCTPQILGPVADTLKNIKQTLTNELNSSNDNPLIDQTTEEVFHNGHFHGQYVSMAMDHLNIALVTMMNLANRRIDRFMDKSNSNGLPPFLCAENAGLRLGLMGGQFMTASITAESRASCMPMSIQSLSTTGDFQDIVSFGLVAARRVREQLKNLKYVFSFELLCACQAVDIRGTAGLSKRTRALYDKTRTLVPYLEEDKTISDYIESIAQTVLTKNSDI,brenda,Q84FL5,N[C@@H](Cc1cccc(Br)c1)C(=O)O>>N[C@@H](CC(=O)O)c1cccc(Br)c1,0.42,0.0,31.0,8.0,5.4.3.11,549.0,-0.3767507096020995,N[C@@H](Cc1cccc(Br)c1)C(=O)O,N[C@@H](CC(=O)O)c1cccc(Br)c1,-0.3767507096020995,N[C@@H](Cc1cccc(Br)c1)C(=O)O__MSIVNESGSQPVVSRDETLSQIERTSFHISSGKDISLEEIARAARDHQPVTLHDEVVNRVTRSRSILESMVSDERVIYGVNTSMGGFVNYIVPIAKASELQNNLINAVATNVGKYFDDTTVRATMLARIVSLSRGNSAISIVNFKKLIEIYNQGIVPCIPEKGSLGTSGDLGPLAAIALVCTGQWKARYQGEQMSGAMALEKAGISPMELSFKEGLALINGTSAMVGLGVLLYDEVKRLFDTYLTVTSLSIEGLHGKTKPFEPAVHRMKPHQGQLEVATTIWETLADSSLAVNEHEVEKLIAEEMDGLVKASNHQIEDAYSIRCTPQILGPVADTLKNIKQTLTNELNSSNDNPLIDQTTEEVFHNGHFHGQYVSMAMDHLNIALVTMMNLANRRIDRFMDKSNSNGLPPFLCAENAGLRLGLMGGQFMTASITAESRASCMPMSIQSLSTTGDFQDIVSFGLVAARRVREQLKNLKYVFSFELLCACQAVDIRGTAGLSKRTRALYDKTRTLVPYLEEDKTISDYIESIAQTVLTKNSDI,./data/raw/alphafold//AF-Q84FL5-F1-model_v4.pdb,2803,2376,1300,3251 +970,4773,4833,MRLRRAAATVITTGALLAAGTLGATPATAVTKPTIAAVGGYAMNNGTGTTLYTKAADTRRSTGSTTKIMTAKVVLAQSNLNLDAKVTIQKAYSDYVVANKPSQAHLIVGDKVTVRQLLYGLMLPSGCDAAYALADKYGSGSQAAARVKSFIGKMNTAATNLGLHNTHFDSFDGIGNGANYSTPRHLTKIASSAMKNSTFRTVVKTKAYTAKTVTKTGSIRTMDTWKNTNGLLSSYSGAIGVKTGSGPEAKYCLVFAATRGGKTVIGTVLASTSIPARESDATKIMNYGFAL,brenda,P39042,CC(O)=N[C@@H](CCCCN)C(O)=N[C@H](C)C(O)=N[C@H](C)C(=O)O.O>>CC(O)=N[C@@H](CCCCN)C(O)=N[C@H](C)C(=O)O.C[C@@H](N)C(=O)O,0.45,8.146090407109206e-15,37.0,7.2,3.4.16.4,1931.0,-0.3467874862246563,CC(O)=N[C@@H](CCCCN)C(O)=N[C@H](C)C(O)=N[C@H](C)C(=O)O.O,CC(O)=N[C@@H](CCCCN)C(O)=N[C@H](C)C(=O)O.C[C@@H](N)C(=O)O,-0.3467874862246563,CC(O)=N[C@@H](CCCCN)C(O)=N[C@H](C)C(O)=N[C@H](C)C(=O)O.O__MRLRRAAATVITTGALLAAGTLGATPATAVTKPTIAAVGGYAMNNGTGTTLYTKAADTRRSTGSTTKIMTAKVVLAQSNLNLDAKVTIQKAYSDYVVANKPSQAHLIVGDKVTVRQLLYGLMLPSGCDAAYALADKYGSGSQAAARVKSFIGKMNTAATNLGLHNTHFDSFDGIGNGANYSTPRHLTKIASSAMKNSTFRTVVKTKAYTAKTVTKTGSIRTMDTWKNTNGLLSSYSGAIGVKTGSGPEAKYCLVFAATRGGKTVIGTVLASTSIPARESDATKIMNYGFAL,./data/raw/alphafold//AF-P39042-F1-model_v4.pdb,2961,1701,3313,2114 +971,5703,5789,MNSELDYYEKFEEVHGILMYKDFVKYWDNVEAFQARPDDLVIATYPKSGTTWVSEIVYMIYKEGDVEKCKEDVIFNRIPFLECRKENLMNGVKQLDEMNSPRIVKTHLPPELLPASFWEKDCKIIYLCRNAKDVAVSFYYFFLMVAGHPNPGSFPEFVEKFMQGQVPYGSWYKHVKSWWEKGKSPRVLFLFYEDLKEDIRKEVIKLIHFLERKPSEELVDRIIHHTSFQEMKNNPSTNYTTLPDEIMNQKLSPFMRKGITGDWKNHFTVALNEKFDKHYEQQMKESTLKFRTEI,sabio,P49888,CC12CCC3c4ccc(O)cc4CCC3C1CCC2O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O>>CC12CCC3c4ccc(OS(=O)(=O)O)cc4CCC3C1CCC2O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(OP(=O)(O)O)C1O,0.02,1.4572339819858368e-14,37.0,7.9,2.8.2.4,9606.0,-1.6989700043360187,CC12CCC3c4ccc(O)cc4CCC3C1CCC2O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O,CC12CCC3c4ccc(OS(=O)(=O)O)cc4CCC3C1CCC2O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(OP(=O)(O)O)C1O,-1.6989700043360187,CC12CCC3c4ccc(O)cc4CCC3C1CCC2O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O__MNSELDYYEKFEEVHGILMYKDFVKYWDNVEAFQARPDDLVIATYPKSGTTWVSEIVYMIYKEGDVEKCKEDVIFNRIPFLECRKENLMNGVKQLDEMNSPRIVKTHLPPELLPASFWEKDCKIIYLCRNAKDVAVSFYYFFLMVAGHPNPGSFPEFVEKFMQGQVPYGSWYKHVKSWWEKGKSPRVLFLFYEDLKEDIRKEVIKLIHFLERKPSEELVDRIIHHTSFQEMKNNPSTNYTTLPDEIMNQKLSPFMRKGITGDWKNHFTVALNEKFDKHYEQQMKESTLKFRTEI,./data/raw/alphafold//AF-P49888-F1-model_v4.pdb,2908,1624,3223,2000 +972,801,823,MEDAGWKNLNVKSSDPVMVKPAIPLPKTVLHLSVVDGLPVVRGNIFNSLIVYNASDKISADPAKVIREALCKVLVYYFPLAGRLRFNENGELEVDCNGEGAAFVEAMVDCNLSVLGDLDDLNPSYEDLLYALPLNTDIVNLYPLVVQVTRFACGGFVVGGSFHHSICDGPKALVNFCKALPDGRGKDKLSCEPIWNRELLKPEDPIHLQFYHLYSLCPSGPPIEKWVHASLVINPATIKCLKQSIMEECNEVCSSFEIMTALAWKARTKAFQIPQTQNVKLLFAVDMRKVFNPPFPKGYYGNAIGFACAMDNAHDLINGSLLHAVNIIRKAKAYLFEQCSKSSVAVNPSALDVNAGQESVVALTDWRRLGFNEVDFGWGDAVNVCPIQRMTNGLVMPNYFLFLRPSEDMPDGVKILMCMDSSMVKSFKFEVEDIINKYVTTV,brenda,Q5Y9C7,C=C1[C@H]2CC3C[C@H](O)C(C)=C([C@@H](O)[C@H](O)[C@]2(C)CC[C@@H]1O)C3(C)C.CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O>>C=C1[C@H]2CC3C[C@H](O)C(C)=C([C@@H](OC(C)=O)[C@H](O)[C@]2(C)CC[C@@H]1O)C3(C)C.CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS,11.91,9.915558651747944e-15,31.0,9.0,2.3.1.162,99806.0,1.0759117614827776,C=C1[C@H]2CC3C[C@H](O)C(C)=C([C@@H](O)[C@H](O)[C@]2(C)CC[C@@H]1O)C3(C)C.CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,C=C1[C@H]2CC3C[C@H](O)C(C)=C([C@@H](OC(C)=O)[C@H](O)[C@]2(C)CC[C@@H]1O)C3(C)C.CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS,1.0759117614827776,C=C1[C@H]2CC3C[C@H](O)C(C)=C([C@@H](O)[C@H](O)[C@]2(C)CC[C@@H]1O)C3(C)C.CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MEDAGWKNLNVKSSDPVMVKPAIPLPKTVLHLSVVDGLPVVRGNIFNSLIVYNASDKISADPAKVIREALCKVLVYYFPLAGRLRFNENGELEVDCNGEGAAFVEAMVDCNLSVLGDLDDLNPSYEDLLYALPLNTDIVNLYPLVVQVTRFACGGFVVGGSFHHSICDGPKALVNFCKALPDGRGKDKLSCEPIWNRELLKPEDPIHLQFYHLYSLCPSGPPIEKWVHASLVINPATIKCLKQSIMEECNEVCSSFEIMTALAWKARTKAFQIPQTQNVKLLFAVDMRKVFNPPFPKGYYGNAIGFACAMDNAHDLINGSLLHAVNIIRKAKAYLFEQCSKSSVAVNPSALDVNAGQESVVALTDWRRLGFNEVDFGWGDAVNVCPIQRMTNGLVMPNYFLFLRPSEDMPDGVKILMCMDSSMVKSFKFEVEDIINKYVTTV,./data/raw/alphafold//AF-Q5Y9C7-F1-model_v4.pdb,1474,791,494,564 +973,4700,4758,MGTALVYHEDMTATRLLWDDPECEIERPERLTAALDRLRQRGLEQRCLRLSAREASEEELGLVHSPEYVSLVRETQVLGKEELQALSGQFDAIYFHPSTFHCARLAAGAGLQLVDAVLTGAVQNGLALVRPPGHHGQRAAANGFCVFNNVAIAAAHAKQKHGLHRILVVDWDVHHGQGIQYLFEDDPSVLYFSWHRYEHGRFWPFLRESDADAVGRGQGLGFTVNLPWNQVGMGNADYVAAFLHLLLPLAFEFDPELVLVSAGFDSAIGDPEGQMQATPECFAHLTQLLQVLAGGRVCAVLEGGYHLESLAESVCMTVQTLLGDPAPPLSGPMAPCQSALESIQSARAAQAPHWKSLQQQDVTAVPMSPSSHSPEGRPPPLLPGGPVCKAAASAPSSLLDQPCLCPAPSVRTAVALTTPDITLVLPPDVIQQEASALREETEAWARPHESLAREEALTALGKLLYLLDGMLDGQVNSGIAATPASAAAATLDVAVRRGLSHGAQRLLCVALGQLDRPPDLAHDGRSLWLNIRGKEAAALSMFHVSTPLPVMTGGFLSCILGLVLPLAYGFQPDLVLVALGPGHGLQGPHAALLAAMLRGLAGGRVLALLEENSTPQLAGILARVLNGEAPPSLGPSSVASPEDVQALMYLRGQLEPQWKMLQCHPHLVA,brenda,Q969S8,CC(O)=NCCCNCCCCNCCCN.O>>CC(=O)O.NCCCNCCCCNCCCN,0.011,1.0810926454520014e-14,22.0,8.0,3.5.1.48,9606.0,-1.958607314841775,CC(O)=NCCCNCCCCNCCCN.O,CC(=O)O.NCCCNCCCCNCCCN,-1.958607314841775,CC(O)=NCCCNCCCCNCCCN.O__MGTALVYHEDMTATRLLWDDPECEIERPERLTAALDRLRQRGLEQRCLRLSAREASEEELGLVHSPEYVSLVRETQVLGKEELQALSGQFDAIYFHPSTFHCARLAAGAGLQLVDAVLTGAVQNGLALVRPPGHHGQRAAANGFCVFNNVAIAAAHAKQKHGLHRILVVDWDVHHGQGIQYLFEDDPSVLYFSWHRYEHGRFWPFLRESDADAVGRGQGLGFTVNLPWNQVGMGNADYVAAFLHLLLPLAFEFDPELVLVSAGFDSAIGDPEGQMQATPECFAHLTQLLQVLAGGRVCAVLEGGYHLESLAESVCMTVQTLLGDPAPPLSGPMAPCQSALESIQSARAAQAPHWKSLQQQDVTAVPMSPSSHSPEGRPPPLLPGGPVCKAAASAPSSLLDQPCLCPAPSVRTAVALTTPDITLVLPPDVIQQEASALREETEAWARPHESLAREEALTALGKLLYLLDGMLDGQVNSGIAATPASAAAATLDVAVRRGLSHGAQRLLCVALGQLDRPPDLAHDGRSLWLNIRGKEAAALSMFHVSTPLPVMTGGFLSCILGLVLPLAYGFQPDLVLVALGPGHGLQGPHAALLAAMLRGLAGGRVLALLEENSTPQLAGILARVLNGEAPPSLGPSSVASPEDVQALMYLRGQLEPQWKMLQCHPHLVA,./data/raw/alphafold//AF-Q969S8-F1-model_v4.pdb,2960,1700,3312,2113 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KGILADEDSSRPVWLKAINCATSGVVGLVNCLRREPGGNRLRCVLLSNLSSTSHVPEVDPGSAELQKVLQGDLVMNVYRDGAWGAFRHFLLEEDKPEEPTAHAFVSTLTRGDLSSIRWVCSSLRHAQPTCPGAQLCTVYYASLNFRDIMLATGKLSPDAIPGKWTSQDSLLGMEFSGRDASGKRVMGLVPAKGLATSVLLSPDFLWDVPSNWTLEEAASVPVVYSTAYYALVVRGRVRPGETLLIHSGSGGVGQAAIAIALSLGCRVFTTVGSAEKRAYLQARFPQLDSTSFANSRDTSFEQHVLWHTGGKGVDLVLNSLAEEKLQASVRCLATHGRFLEIGKFDLSQNHPLGMAIFLKNVTFHGVLLDAFFNESSADWREVWALVQAGIRDGVVRPLKCTVFHGAQVEDAFRYMAQGKHIGKVVVQVLAEEPEAVLKGAKPKLMSAISKTFCPAHKSYIIAGGLGGFGLELAQWLIQRGVQKLVLTSRSGIRTGYQAKQVRRWRRQGVQVQVSTSNISSLEGARGLIAEAAQLGPVGGVFNLAVVLRDGLLENQTPEFFQDVCKPKYSGTLNLDRVTREACPELDYFVVFSSVSCGRGNAGQSNYGFANSAMERICEKRRHEGLPGLAVQWGAIGDVGILVETMSTNDTIVSGTLPQRMASCLEVLDLFLNQPHMVLSSFVLAEKAAAYRDRDSQRDLVEAVAHILGIRDLAAVNLDSSLADLGLDSLMSVEVRQTLERELNLVLSVREVRQLTLRKLQELSSKADEASELACPTPKEDGLAQQQTQLNLRSLLVNPEGPTLMRLNSVQSSERPLFLVHPIEGSTTVFHSLASRLSIPTYGLQCTRAAPLDSIHSLAAYYIDCIRQVQPEGPYRVAGYSYGACVAFEMCSQLQAQQSPAPTHNSLFLFDGSPTYVLAYTQSYRAKLTPGCEAEAETEAICFFVQQFTDMEHNRVLEALLPLKGLEERVAAAVDLIIKSHQGLDRQELSFAARSFYYKLRAAEQYTPKAKYHGNVMLLRAKTGGAYGEDLGADYNLSQVCDGKVSVHVIEGDHRTLLEGSGLESIISIIHSSLAEPRVSVREG,./data/raw/alphafold//AF-P49327-F1-model_v4.pdb,1366,865,661,950 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+1087,17881,18129,MKIYLVGGAVRDALLGLPVKDRDWVVVGSTPQEMLDAGYQQVGRDFPVFLHPQTHEEYALARTERKSGSGYTGFTCYAAPDVTLEDDLKRRDLTINALAQDDNGEIIDPYNGLGDLQNRLLRHVSPAFGEDPLRVLRVARFAARYAHLGFRIADETLALMREMTHAGELEHLTPERVWKETESALTTRNPQVFFQVLRDCGALRVLFPEIDALFGVPAPAKWHPEIDTGIHTLMTLSMAAMLSPQVDVRFATLCHDLGKGLTPPELWPRHHGHGPAGVKLVEQLCQRLRVPNEIRDLARLVAEFHDLIHTFPMLNPKTIVKLFDSIDAWRKPQRVEQLALTSEADVRGRTGFESADYPQGRWLREAWEVAQSVPTKAVVEAGFKGVEIREELTRRRIAAVASWKEQRCPKPE,sabio,P06961,Nc1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)n1.O>>Nc1ccn(C2OC(COP(=O)(O)O)C(O)C2O)c(=O)n1.O=P(O)(O)O,4.83,6.739921419046132e-15,37.0,7.5,3.1.3.-,562.0,0.6839471307515121,Nc1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)n1.O,Nc1ccn(C2OC(COP(=O)(O)O)C(O)C2O)c(=O)n1.O=P(O)(O)O,0.6839471307515121,Nc1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)n1.O__MKIYLVGGAVRDALLGLPVKDRDWVVVGSTPQEMLDAGYQQVGRDFPVFLHPQTHEEYALARTERKSGSGYTGFTCYAAPDVTLEDDLKRRDLTINALAQDDNGEIIDPYNGLGDLQNRLLRHVSPAFGEDPLRVLRVARFAARYAHLGFRIADETLALMREMTHAGELEHLTPERVWKETESALTTRNPQVFFQVLRDCGALRVLFPEIDALFGVPAPAKWHPEIDTGIHTLMTLSMAAMLSPQVDVRFATLCHDLGKGLTPPELWPRHHGHGPAGVKLVEQLCQRLRVPNEIRDLARLVAEFHDLIHTFPMLNPKTIVKLFDSIDAWRKPQRVEQLALTSEADVRGRTGFESADYPQGRWLREAWEVAQSVPTKAVVEAGFKGVEIREELTRRRIAAVASWKEQRCPKPE,./data/raw/alphafold//AF-P06961-F1-model_v4.pdb,2369,4742,4791,4631 +1088,10239,10390,MDNLLRHLKISKEQITPVVLVVGDPGRVDKIKVVCDSYVDLAYNREYKSVECHYKGQKFLCVSHGVGSAGCAVCFEELCQNGAKVIIRAGSCGSLQPDLIKRGDICICNAAVREDRVSHLLIHGDFPAVGDFDVYDTLNKCAQELNVPVFNGISVSSDMYYPNKIIPSRLEDYSKANAAVVEMELATLMVIGTLRKVKTGGILIVDGCPFKWDEGDFDNNLVPHQLENMIKIALGACAKLATKYA,brenda,Q8T9Z7,CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.O=P(O)(O)O>>CSC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O)[C@@H]1O.Nc1nc[nH]c2ncnc1-2,2.6,0.0,25.0,7.5,2.4.2.1,5833.0,0.414973347970818,CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.O=P(O)(O)O,CSC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O)[C@@H]1O.Nc1nc[nH]c2ncnc1-2,0.414973347970818,CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.O=P(O)(O)O__MDNLLRHLKISKEQITPVVLVVGDPGRVDKIKVVCDSYVDLAYNREYKSVECHYKGQKFLCVSHGVGSAGCAVCFEELCQNGAKVIIRAGSCGSLQPDLIKRGDICICNAAVREDRVSHLLIHGDFPAVGDFDVYDTLNKCAQELNVPVFNGISVSSDMYYPNKIIPSRLEDYSKANAAVVEMELATLMVIGTLRKVKTGGILIVDGCPFKWDEGDFDNNLVPHQLENMIKIALGACAKLATKYA,./data/raw/alphafold//AF-Q8T9Z7-F1-model_v4.pdb,3630,3611,1396,3357 +1089,8131,8259,MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,uniprot_search,P08246,CC[C@H](C)[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)OC)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCSC)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>,6.8,99.8537577672906,37.0,7.4,3.4.21.37,9606.0,0.8325089127062363,CC[C@H](C)[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)OC)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCSC)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,,0.8325089127062363,CC[C@H](C)[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)OC)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCSC)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,./data/raw/alphafold//AF-P08246-F1-model_v4.pdb,1869,1645,3250,2040 +1090,16216,16443,MLKSEMNIAGFDADLWQAMQGEVERQEQHIELIASENYTSPRVMQAQGSQLTNKYAEGYPHKRYYGGCEFVDKVEDLAIERAKELFGAKYANVQPHSGSQANTAAFMAMMEAGDTFLGMSLAHGGHLTHGSGVNFSGKLYNAVSYGLDESTGEIDYAEVEKLALEYKPKVIVAGFSAYSGIVGWAKFREIADKVDAYLMVDMAHVAGLVAAGVYPNPVPYAHVVTTTTHKTLAGPRGGLIISGSDDEKLHKKLNSAVFPGNQGGPLCHVIAGKAVAFQEALQPEFKDYQKQVLVNANAMVETMQARGYKIVSNGTQNHLFLVDLIDKDITGKDADAALGNAFITVNKNAVPNDPRSPFVTSGLRLGTPAITRRGFREAEAEQVANWICDVLDDIADESKINEVREQVKALCAKFPVYG,uniprot_search,A0A1V0CMF9,NC(C(=O)O)C(O)c1ccccc1>>O=Cc1ccccc1,1.51,26.036453184884607,37.0,7.0,2.1.2.1,135577.0,0.1789769472931694,NC(C(=O)O)C(O)c1ccccc1,O=Cc1ccccc1,0.1789769472931694,NC(C(=O)O)C(O)c1ccccc1__MLKSEMNIAGFDADLWQAMQGEVERQEQHIELIASENYTSPRVMQAQGSQLTNKYAEGYPHKRYYGGCEFVDKVEDLAIERAKELFGAKYANVQPHSGSQANTAAFMAMMEAGDTFLGMSLAHGGHLTHGSGVNFSGKLYNAVSYGLDESTGEIDYAEVEKLALEYKPKVIVAGFSAYSGIVGWAKFREIADKVDAYLMVDMAHVAGLVAAGVYPNPVPYAHVVTTTTHKTLAGPRGGLIISGSDDEKLHKKLNSAVFPGNQGGPLCHVIAGKAVAFQEALQPEFKDYQKQVLVNANAMVETMQARGYKIVSNGTQNHLFLVDLIDKDITGKDADAALGNAFITVNKNAVPNDPRSPFVTSGLRLGTPAITRRGFREAEAEQVANWICDVLDDIADESKINEVREQVKALCAKFPVYG,./data/raw/alphafold//AF-A0A1V0CMF9-F1-model_v4.pdb,2621,1849,2221,5101 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+1118,20432,20737,MWWKEAVIYQVYPRSFQDTNGDGVGDLEGVRRRLPYLKSLGVDALWLSPFYKSPMKDFGYDVADYCDVDPVFGTLQDFDRLLEEAHALGLKVLVDLVPNHTSSEHPWFLESRASRNSPKRDWYIWKDPAPDGGPPNNWQSFFGGPAWTLDEATGQYYLHQFLPEQPDLNWRNPEVREAIYEVMRFWLRRGVDGFRVDVLWLLAEDLLFRDEPGNPDWRPGMWDRGRHLHIFTEDQPETYAYVREMRQVLDEFSEPGRERVMVGEIYLPYPQLVRYYQAGCHLPFNFHLIFRGLPDWRPENLARIVEEYESLLTRWDWPNWVLGNHDQPRLASRLGEAQARVAAMLLFTLRGTPTWYYGDEIGMKNGEIPPEKVQDPAALRQKDRLGEHNLPPGRDPERTPMQWDDTPFAGFSTVEPWLPVNPDYKTRNVAAQEQDPRSMLHLVRRLIALRKDPDLLYGAYRTYRAREGVYAYLRGEGWLVALNLTEKEKALELPRGGRVVLSTHLDREERVGERLFLRPDEGVAVRLD,sabio,Q72LF2,O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O>>OCC1OC(O)C(O)C(O)C1O,22.0,33.2717722930995,70.0,7.0,3.2.1.20,274.0,1.3424226808222062,O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O,OCC1OC(O)C(O)C(O)C1O,1.3424226808222062,O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O__MWWKEAVIYQVYPRSFQDTNGDGVGDLEGVRRRLPYLKSLGVDALWLSPFYKSPMKDFGYDVADYCDVDPVFGTLQDFDRLLEEAHALGLKVLVDLVPNHTSSEHPWFLESRASRNSPKRDWYIWKDPAPDGGPPNNWQSFFGGPAWTLDEATGQYYLHQFLPEQPDLNWRNPEVREAIYEVMRFWLRRGVDGFRVDVLWLLAEDLLFRDEPGNPDWRPGMWDRGRHLHIFTEDQPETYAYVREMRQVLDEFSEPGRERVMVGEIYLPYPQLVRYYQAGCHLPFNFHLIFRGLPDWRPENLARIVEEYESLLTRWDWPNWVLGNHDQPRLASRLGEAQARVAAMLLFTLRGTPTWYYGDEIGMKNGEIPPEKVQDPAALRQKDRLGEHNLPPGRDPERTPMQWDDTPFAGFSTVEPWLPVNPDYKTRNVAAQEQDPRSMLHLVRRLIALRKDPDLLYGAYRTYRAREGVYAYLRGEGWLVALNLTEKEKALELPRGGRVVLSTHLDREERVGERLFLRPDEGVAVRLD,./data/raw/alphafold//AF-Q72LF2-F1-model_v4.pdb,450,3155,5446,6329 +1119,4815,4876,MSRAGFDKYITVFSPEGSLYQVEYAFKAVTYAGLLTVAIRCKDAVLVFTQHSVPDKLMRPETITSLYNVNDNTGVCITGRAPDGKALVQKARNEASEYKYRYGMPMLVSVLAKPWQDMAQVRTQQAGMRLMGTIMTFVGMEQNDEDGAWIPQIYCVDPAGGAAVHACAVGKKQIEACAFLEKKQKNAPFHTLSQKEAAMIALAALQSALGESLRASGVEVGRCTADDHHFLRVSDREVKKWLTPLAKPGYRAAYVLVRHTFHVVNP,brenda,Q9GU37,CC(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@H](C(O)=N[C@@H](CCC(=N)O)C(O)=Nc1ccc2c(NC(=N)N)cc(=O)oc2c1)[C@@H](C)O.O>>,3.3,99.88343548270532,25.0,7.8,3.4.25.1,5691.0,0.5185139398778875,CC(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@H](C(O)=N[C@@H](CCC(=N)O)C(O)=Nc1ccc2c(NC(=N)N)cc(=O)oc2c1)[C@@H](C)O.O,,0.6693168805661122,CC(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@H](C(O)=N[C@@H](CCC(=N)O)C(O)=Nc1ccc2c(NC(=N)N)cc(=O)oc2c1)[C@@H](C)O.O__MSRAGFDKYITVFSPEGSLYQVEYAFKAVTYAGLLTVAIRCKDAVLVFTQHSVPDKLMRPETITSLYNVNDNTGVCITGRAPDGKALVQKARNEASEYKYRYGMPMLVSVLAKPWQDMAQVRTQQAGMRLMGTIMTFVGMEQNDEDGAWIPQIYCVDPAGGAAVHACAVGKKQIEACAFLEKKQKNAPFHTLSQKEAAMIALAALQSALGESLRASGVEVGRCTADDHHFLRVSDREVKKWLTPLAKPGYRAAYVLVRHTFHVVNP,./data/raw/alphafold//AF-Q9GU37-F1-model_v4.pdb,2980,1722,3338,2143 +1120,22537,22874,MVEDNGSIRTLSVDIGGSGVKALVLDITGNPVTERARVDTPQPATPEVVINAIMVLAAAQGEFHRVSVGFPGVVRAGVTETAVNLDSDWIGFDLETALSQRLHKPVRVINDADMQGFGAIKGKGVELVITLGTGFGSALFVDGKLVPNMEMGHHPFRKGETYEEQLGRATLDKIGQKKWNRRLEKAIASLQRLFNYDYLYIGGGEAVRVNFQLPLNVKLIPNISGLLGGIALWRDEKTL,brenda,Q8YX46,O=P(O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O>>O=P(O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.O=P(O)(O)OP(=O)(O)OP(=O)(O)O,48.2,0.0,28.0,7.5,2.7.1.63,1167.0,1.6830470382388496,O=P(O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,O=P(O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.O=P(O)(O)OP(=O)(O)OP(=O)(O)O,1.6830470382388496,O=P(O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O__MVEDNGSIRTLSVDIGGSGVKALVLDITGNPVTERARVDTPQPATPEVVINAIMVLAAAQGEFHRVSVGFPGVVRAGVTETAVNLDSDWIGFDLETALSQRLHKPVRVINDADMQGFGAIKGKGVELVITLGTGFGSALFVDGKLVPNMEMGHHPFRKGETYEEQLGRATLDKIGQKKWNRRLEKAIASLQRLFNYDYLYIGGGEAVRVNFQLPLNVKLIPNISGLLGGIALWRDEKTL,./data/raw/alphafold//AF-Q8YX46-F1-model_v4.pdb,148,2645,2945,5793 +1121,21830,22155,MPRSLANAPIMILNGPNLNLLGQRQPEIYGSDTLADVEALCVKAAAAHGGTVDFRQSNHEGELVDWIHEARLNHCGIVINPAAYSHTSVAILDALNTCDGLPVVEVHISNIHQREPFRHHSYVSQRADGVVAGCGVQGYVFGVERIAALAGAGSARA,sabio,P15474,O=C1CC(O)(C(=O)O)CC(O)C1O>>O.O=C(O)C1=CC(=O)C(O)C(O)C1,960.0,7.453857947349876e-15,25.0,8.0,4.2.1.10,1902.0,2.9822712330395684,O=C1CC(O)(C(=O)O)CC(O)C1O,O.O=C(O)C1=CC(=O)C(O)C(O)C1,2.9822712330395684,O=C1CC(O)(C(=O)O)CC(O)C1O__MPRSLANAPIMILNGPNLNLLGQRQPEIYGSDTLADVEALCVKAAAAHGGTVDFRQSNHEGELVDWIHEARLNHCGIVINPAAYSHTSVAILDALNTCDGLPVVEVHISNIHQREPFRHHSYVSQRADGVVAGCGVQGYVFGVERIAALAGAGSARA,./data/raw/alphafold//AF-P15474-F1-model_v4.pdb,721,123,5849,6734 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+1145,19995,20281,MTKALFFDIDGTLVSFETHRIPSSTIEALEAAHAKGLKIFIATGRPKAIINNLSELQDRNLIDGYITMNGAYCFVGEEVIYKSAIPQEEVKAMAAFCEKKGVPCIFVEEHNISVCQPNEMVKKIFYDFLHVNVIPTVSFEEASNKEVIQMTPFITEEEEKEVLPSIPTCEIGRWYPAFADVTAKGDTKQKGIDEIIRHFGIKLEETMSFGDGGNDISMLRHAAIGVAMGQAKEDVKAAADYVTAPIDEDGISKAMKHFGII,sabio,Q8A090,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1>>O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,0.083,0.0,37.0,7.0,-.-.-.-,818.0,-1.080921907623926,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,-1.080921907623926,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MTKALFFDIDGTLVSFETHRIPSSTIEALEAAHAKGLKIFIATGRPKAIINNLSELQDRNLIDGYITMNGAYCFVGEEVIYKSAIPQEEVKAMAAFCEKKGVPCIFVEEHNISVCQPNEMVKKIFYDFLHVNVIPTVSFEEASNKEVIQMTPFITEEEEKEVLPSIPTCEIGRWYPAFADVTAKGDTKQKGIDEIIRHFGIKLEETMSFGDGGNDISMLRHAAIGVAMGQAKEDVKAAADYVTAPIDEDGISKAMKHFGII,./data/raw/alphafold//AF-Q8A090-F1-model_v4.pdb,410,2982,5324,6201 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+1157,8790,8927,MKRSFFMLKTKITSSILVGACLLIGCSNGNEQPVSNEPEPEESVETGEAVFKALEEEYAARLGVFALDTGTGQTVSYRSDERFTYASAHKPLAVAVLLQQKSIEELEQLITYSADDLVNYNPITENHVETGMTLRELSDASIRYSDNTAANFIFDEIGGPEGFKEGLRAIGDTVTEPERIEPELNHVEPGEIQDTSTPEALAKSLQEFALGEALPADKQELLIDWLIGNTTGDALIRAGVPEGWEVGDKTGAGSYGTRNDIAILWPPEKEPIILAVLSSKDEKDAEYDDELIAKATEEVINLLAQTE,brenda,A8RR46,CO/N=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)[O-])=C(C[N+]3(C)CCCC3)CS[C@H]12)c1csc(=N)[nH]1.O>>,40.0,99.799834663432,30.0,6.4,3.5.2.6,79880.0,1.6020599913279625,CO/N=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)[O-])=C(C[N+]3(C)CCCC3)CS[C@H]12)c1csc(=N)[nH]1.O,,1.6020599913279625,CO/N=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)[O-])=C(C[N+]3(C)CCCC3)CS[C@H]12)c1csc(=N)[nH]1.O__MKRSFFMLKTKITSSILVGACLLIGCSNGNEQPVSNEPEPEESVETGEAVFKALEEEYAARLGVFALDTGTGQTVSYRSDERFTYASAHKPLAVAVLLQQKSIEELEQLITYSADDLVNYNPITENHVETGMTLRELSDASIRYSDNTAANFIFDEIGGPEGFKEGLRAIGDTVTEPERIEPELNHVEPGEIQDTSTPEALAKSLQEFALGEALPADKQELLIDWLIGNTTGDALIRAGVPEGWEVGDKTGAGSYGTRNDIAILWPPEKEPIILAVLSSKDEKDAEYDDELIAKATEEVINLLAQTE,./data/raw/alphafold//AF-A8RR46-F1-model_v4.pdb,1458,1898,800,1114 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+1179,22137,22470,MMFTCNWTALLCALLSILSVCVADIPQTNYDVIIIGGGPSGLSAASALSRVLRKSVLFDSGEYRNNPTRHMHDVIGNDHVVPAEFRKTAREQISFYNMTTFIDQKVTKLEKTGDNAFQATVGDQQYTARKVILGSGVKDDLPDVPGLQEGFGKGIFWCPWCDGFEHRNQSMGVLGDISEAYGAVRELHPTLNKDIRIYANGTNTTEQIAILDKNHPNWRKVFQAYNVTVNNKPILNITRIQDGAVVNDPAIRLEFDKFQIYFADNSSEVRGAFITNYGTSQRSDLPAQLGVEMLGSKINTLRKGLQTSVPGVWGVGDANSDNSTNVPHGMSSGKSAAVYCHVELAQEELDRDAGLEKRETEFDAESFHETTERQMGSEIQDLYKRLSRR,brenda,Q2U4P3,O=O.O[C@H](CS)[C@H](O)CS>>OO,337800.0,68.80344197986152,20.0,7.5,1.8.3.2,5062.0,5.52865964523499,O=O.O[C@H](CS)[C@H](O)CS,OO,5.52865964523499,O=O.O[C@H](CS)[C@H](O)CS__MMFTCNWTALLCALLSILSVCVADIPQTNYDVIIIGGGPSGLSAASALSRVLRKSVLFDSGEYRNNPTRHMHDVIGNDHVVPAEFRKTAREQISFYNMTTFIDQKVTKLEKTGDNAFQATVGDQQYTARKVILGSGVKDDLPDVPGLQEGFGKGIFWCPWCDGFEHRNQSMGVLGDISEAYGAVRELHPTLNKDIRIYANGTNTTEQIAILDKNHPNWRKVFQAYNVTVNNKPILNITRIQDGAVVNDPAIRLEFDKFQIYFADNSSEVRGAFITNYGTSQRSDLPAQLGVEMLGSKINTLRKGLQTSVPGVWGVGDANSDNSTNVPHGMSSGKSAAVYCHVELAQEELDRDAGLEKRETEFDAESFHETTERQMGSEIQDLYKRLSRR,./data/raw/alphafold//AF-Q2U4P3-F1-model_v4.pdb,2770,5321,2588,5413 +1180,9091,9233,MKNTLLKLGVCVSLLGITPFVSTISSVQAERTVEHKVIKNETGTISISQLNKNVWVHTELGYFSGEAVPSNGLVLNTSKGLVLVDSSWDDKLTKELIEMVEKKFKKRVTDVIITHAHADRIGGMKTLKERGIKAHSTALTAELAKKNGYEEPLGDLQSVTNLKFGNMKVETFYPGKGHTEDNIVVWLPQYQILAGGCLVKSASSKDLGNVADAYVNEWSTSIENVLKRYGNINLVVPGHGEVGDRGLLLHTLDLLK,sabio,P14488,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1.O>>,60.0,99.78924695830672,30.0,6.0,3.5.2.6,1396.0,1.7781512503836436,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1.O,,1.7781512503836436,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1.O__MKNTLLKLGVCVSLLGITPFVSTISSVQAERTVEHKVIKNETGTISISQLNKNVWVHTELGYFSGEAVPSNGLVLNTSKGLVLVDSSWDDKLTKELIEMVEKKFKKRVTDVIITHAHADRIGGMKTLKERGIKAHSTALTAELAKKNGYEEPLGDLQSVTNLKFGNMKVETFYPGKGHTEDNIVVWLPQYQILAGGCLVKSASSKDLGNVADAYVNEWSTSIENVLKRYGNINLVVPGHGEVGDRGLLLHTLDLLK,./data/raw/alphafold//AF-P14488-F1-model_v4.pdb,1462,998,813,1132 +1181,7931,8059,MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,brenda,A0A077JBW9,CCOP(=O)(OCC)Oc1ccc(Cl)cc1.O>>CCOP(=O)([O-])OCC.Oc1ccc(Cl)cc1,40.0,0.1783086154194565,30.0,9.5,3.1.8.1,453246.0,1.6020599913279625,CCOP(=O)(OCC)Oc1ccc(Cl)cc1.O,CCOP(=O)([O-])OCC.Oc1ccc(Cl)cc1,1.6020599913279625,CCOP(=O)(OCC)Oc1ccc(Cl)cc1.O__MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,./data/raw/alphafold//AF-A0A077JBW9-F1-model_v4.pdb,3110,1877,3509,2328 +1182,17453,17690,MALLMNPLSNLETYNISEDLGFILEDPLEELPDPYQPWIRLAKNLPSLIDDQQLRDEVKKLPELSICHLQGHKELRLAHLALGCITMGYVWEGGDKDVTQVLPRIIAVPFCEISKKLGLPPIMVYADCVLANWKKKDPSGPMTYDNMETLFAFPGGDCSKGFFLVSLLVERAAASAVKVIPDIFDAIINKNCNVLKEGLRTVSSSLREAEQTFHLVHEYVDPIDFFKILRIYLSGWKGNSLLPEGLKYEGVWNNPRKFSGGSAAQSSIIQCFDALLGIQHGSVHENSSAQFLQEMRDYMPPSHKAFLEAVASGPSVREFILSSKDADLKKIYDECVRALVDLRNYHLKVVAKYIIIPSSQLKNNANRKEVKEDEEKGTGGTDLMSFLKSVRDTTKKACL,brenda,B3Y9H8,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O=O>>N[C@@H](CC(=O)c1ccccc1N=CO)C(=O)O,19.0,0.0,,,1.13.11.52,13616.0,1.2787536009528289,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O=O,N[C@@H](CC(=O)c1ccccc1N=CO)C(=O)O,1.2787536009528289,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O=O__MALLMNPLSNLETYNISEDLGFILEDPLEELPDPYQPWIRLAKNLPSLIDDQQLRDEVKKLPELSICHLQGHKELRLAHLALGCITMGYVWEGGDKDVTQVLPRIIAVPFCEISKKLGLPPIMVYADCVLANWKKKDPSGPMTYDNMETLFAFPGGDCSKGFFLVSLLVERAAASAVKVIPDIFDAIINKNCNVLKEGLRTVSSSLREAEQTFHLVHEYVDPIDFFKILRIYLSGWKGNSLLPEGLKYEGVWNNPRKFSGGSAAQSSIIQCFDALLGIQHGSVHENSSAQFLQEMRDYMPPSHKAFLEAVASGPSVREFILSSKDADLKKIYDECVRALVDLRNYHLKVVAKYIIIPSSQLKNNANRKEVKEDEEKGTGGTDLMSFLKSVRDTTKKACL,./data/raw/alphafold//AF-B3Y9H8-F1-model_v4.pdb,2630,5366,2638,5465 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+1196,10950,11105,MLSFQYPDVYRDETAIQDYHGHKVCDPYAWLEDPDSEQTKAFVEAQNKITVPFLEQCPIRGLYKERMTELYDYPKYSCHFKKGKRYFYFYNTGLQNQRVLYVQDSLEGEARVFLDPNILSDDGTVALRGYAFSEDGEYFAYGLSASGSDWVTIKFMKVDGAKELPDVLERVKFSCMAWTHDGKGMFYNAYPQQDGKSDGTETSTNLHQKLYYHVLGTDQSEDILCAEFPDEPKWMGGAELSDDGRYVLLSIREGCDPVNRLWYCDLQQESNGITGILKWVKLIDNFEGEYDYVTNEGTVFTFKTNRHSPNYRLINIDFTDPEESKWKVLVPEHEKDVLEWVACVRSNFLVLCYLHDVKNTLQLHDLATGALLKIFPLEVGSVVGYSGQKKDTEIFYQFTSFLSPGIIYHCDLTKEELEPRVFREVTVKGIDASDYQTVQIFYPSKDGTKIPMFIVHKKGIKLDGSHPAFLYGYGGFNISITPNYSVSRLIFVRHMGGVLAVANIRGGGEYGETWHKGGILANKQNCFDDFQCAAEYLIKEGYTSPKRLTINGGSNGGLLVATCANQRPDLFGCVIAQVGVMDMLKFHKYTIGHAWTTDYGCSDSKQHFEWLIKYSPLHNVKLPEADDIQYPSMLLLTADHDDRVVPLHSLKFIATLQYIVGRSRKQNNPLLIHVDTKAGHGAGKPTAKVIEEVSDMFAFIARCLNIDWIP,brenda,P23687,C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccc([N+](=O)[O-])cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CO)N=C(O)[C@H](CCC(=O)O)N=C(O)CN=C(O)c1ccccc1N)C(=O)O.O>>C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)Cc1ccc([N+](=O)[O-])cc1)C(=O)O.Nc1ccccc1C(O)=NCC(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O,2.94,3.006134539212676e-14,33.5,7.666666666666667,3.4.21.26,9823.0,0.4683473304121572,C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccc([N+](=O)[O-])cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CO)N=C(O)[C@H](CCC(=O)O)N=C(O)CN=C(O)c1ccccc1N)C(=O)O.O,C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)Cc1ccc([N+](=O)[O-])cc1)C(=O)O.Nc1ccccc1C(O)=NCC(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O,0.4683473304121572,C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccc([N+](=O)[O-])cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CO)N=C(O)[C@H](CCC(=O)O)N=C(O)CN=C(O)c1ccccc1N)C(=O)O.O__MLSFQYPDVYRDETAIQDYHGHKVCDPYAWLEDPDSEQTKAFVEAQNKITVPFLEQCPIRGLYKERMTELYDYPKYSCHFKKGKRYFYFYNTGLQNQRVLYVQDSLEGEARVFLDPNILSDDGTVALRGYAFSEDGEYFAYGLSASGSDWVTIKFMKVDGAKELPDVLERVKFSCMAWTHDGKGMFYNAYPQQDGKSDGTETSTNLHQKLYYHVLGTDQSEDILCAEFPDEPKWMGGAELSDDGRYVLLSIREGCDPVNRLWYCDLQQESNGITGILKWVKLIDNFEGEYDYVTNEGTVFTFKTNRHSPNYRLINIDFTDPEESKWKVLVPEHEKDVLEWVACVRSNFLVLCYLHDVKNTLQLHDLATGALLKIFPLEVGSVVGYSGQKKDTEIFYQFTSFLSPGIIYHCDLTKEELEPRVFREVTVKGIDASDYQTVQIFYPSKDGTKIPMFIVHKKGIKLDGSHPAFLYGYGGFNISITPNYSVSRLIFVRHMGGVLAVANIRGGGEYGETWHKGGILANKQNCFDDFQCAAEYLIKEGYTSPKRLTINGGSNGGLLVATCANQRPDLFGCVIAQVGVMDMLKFHKYTIGHAWTTDYGCSDSKQHFEWLIKYSPLHNVKLPEADDIQYPSMLLLTADHDDRVVPLHSLKFIATLQYIVGRSRKQNNPLLIHVDTKAGHGAGKPTAKVIEEVSDMFAFIARCLNIDWIP,./data/raw/alphafold//AF-P23687-F1-model_v4.pdb,1927,3904,1738,3545 +1197,15764,15991,MKNVGFIGWRGMVGSVLMDRMSQENDFENLNPVFFTTSQAGQKAPVFGGKDAGDLKSAFDIEELKKLDIIVTCQGGDYTNEVYPKLKATGWDGYWVDAASALRMKDDAIIVLDPVNQHVISEGLKKGIKTFVGGNCTVSLMLMAIGGLFEKDLVEWISVATYQAASGAGAKNMRELLSQMGLLEQAVSSELKDPASSILDIERKVTAKMRADNFPTDNFGAALGGSLIPWIDKLLPETGQTKEEWKGYAETNKILGLSDNPIPVDGLCVRIGALRCHSQAFTIKLKKDLPLEEIEQIIASHNEWVKVIPNDKEITLRELTPAKVTGTLSVPVGRLRKLAMGPEYLAAFTVGDQLLWGAAEPVRRILKQLVA,sabio,P44801,NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1.NC(CC=O)C(=O)O.O=P(O)(O)O>>NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.NC(CC(=O)OP(=O)(O)O)C(=O)O.[H],330.0,5.921096947527695e-15,30.0,9.0,1.2.1.11,727.0,2.5185139398778875,NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1.NC(CC=O)C(=O)O.O=P(O)(O)O,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.NC(CC(=O)OP(=O)(O)O)C(=O)O.[H],2.5185139398778875,NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1.NC(CC=O)C(=O)O.O=P(O)(O)O__MKNVGFIGWRGMVGSVLMDRMSQENDFENLNPVFFTTSQAGQKAPVFGGKDAGDLKSAFDIEELKKLDIIVTCQGGDYTNEVYPKLKATGWDGYWVDAASALRMKDDAIIVLDPVNQHVISEGLKKGIKTFVGGNCTVSLMLMAIGGLFEKDLVEWISVATYQAASGAGAKNMRELLSQMGLLEQAVSSELKDPASSILDIERKVTAKMRADNFPTDNFGAALGGSLIPWIDKLLPETGQTKEEWKGYAETNKILGLSDNPIPVDGLCVRIGALRCHSQAFTIKLKKDLPLEEIEQIIASHNEWVKVIPNDKEITLRELTPAKVTGTLSVPVGRLRKLAMGPEYLAAFTVGDQLLWGAAEPVRRILKQLVA,./data/raw/alphafold//AF-P44801-F1-model_v4.pdb,2551,5002,4696,4527 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+1199,21148,21472,MTPQDLKDVMSSGLLSFPVTDFDAQGNFNAKGYAARLEWLAPYGASALFAAGGTGEYFSLYGEEYGQIIKTAVDTCRGKVPIIAGAGGPTRTAIAHAQEAERLGAHGILLLPHYLTEAGQEGLIAHVEQVCKSVKFGVIVYNRDRTRFTPESLAILAERCPNLVGFKDGMGNIETMSSIFMKMGDRFAYLGGLPTAEVYAAAYKALGTPVYSSAVFNFIPRTAMAFYEAVRTDDMATQHKLLKEFFMPYLKIRNRVEGYGVSIIKAGAKLVGHDAGPVRAPLTDLKPAEMEELKVLIDKLGPQ,brenda,B7WZA5,O=C(O)C(=O)C[C@H](O)[C@@H](O)C(=O)O>>O.O=C=O.O=CCCC(=O)C(=O)O,3.1,0.0,37.0,7.0,4.2.1.41,285.0,0.4913616938342727,O=C(O)C(=O)C[C@H](O)[C@@H](O)C(=O)O,O.O=C=O.O=CCCC(=O)C(=O)O,0.4913616938342727,O=C(O)C(=O)C[C@H](O)[C@@H](O)C(=O)O__MTPQDLKDVMSSGLLSFPVTDFDAQGNFNAKGYAARLEWLAPYGASALFAAGGTGEYFSLYGEEYGQIIKTAVDTCRGKVPIIAGAGGPTRTAIAHAQEAERLGAHGILLLPHYLTEAGQEGLIAHVEQVCKSVKFGVIVYNRDRTRFTPESLAILAERCPNLVGFKDGMGNIETMSSIFMKMGDRFAYLGGLPTAEVYAAAYKALGTPVYSSAVFNFIPRTAMAFYEAVRTDDMATQHKLLKEFFMPYLKIRNRVEGYGVSIIKAGAKLVGHDAGPVRAPLTDLKPAEMEELKVLIDKLGPQ,./data/raw/alphafold//AF-B7WZA5-F1-model_v4.pdb,595,3321,5634,6526 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+1235,19023,19308,MWLCALALASLAACTAWGHPSAPPVVDTVHGKVLGKFVSLEGFAQPVAVFLGVPFAKPPLGSLRFAPPQPAESWSHVKNTTSYPPMCSQDAVSGHMLSELFTNRKENIPLKFSEDCLYLNIYTPADLTKRGRLPVMVWIHGGGLMVGGASTYDGLALSAHENVVVVTIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALRWVQDNIANFGGDPGSVTIFGESAGGQSVSILLLSPLTKNLFHRAISESGVALLSSLFRKNTKSLAEKIAIEAGCKTTTSAVMVHCLRQKTEEELMEVTLKMKFMALDLVGDPKENTAFLTTVIDGVLLPKAPAEILAEKKYNMLPYMVGINQQEFGWIIPMQMLGYPLSEGKLDQKTATELLWKSYPIVNVSKELTPVATEKYLGGTDDPVKKKDLFLDMLADLLFGVPSVNVARHHRDAGAPTYMYEYRYRPSFSSDMRPKTVIGDHGDEIFSVLGAPFLKEGATEEEIKLSKMVMKYWANFARNGNPNGEGLPQWPAYDYKEGYLQIGATTQAAQKLKDKEVAFWTELWAKEAARPRETEHIEL,sabio,P12337,O>>OCc1cccc(Oc2ccccc2)c1,57.0,83.11075839673072,37.0,7.4,3.1.1.1,9986.0,1.7558748556724917,O,OCc1cccc(Oc2ccccc2)c1,2.2624510897304293,O__MWLCALALASLAACTAWGHPSAPPVVDTVHGKVLGKFVSLEGFAQPVAVFLGVPFAKPPLGSLRFAPPQPAESWSHVKNTTSYPPMCSQDAVSGHMLSELFTNRKENIPLKFSEDCLYLNIYTPADLTKRGRLPVMVWIHGGGLMVGGASTYDGLALSAHENVVVVTIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALRWVQDNIANFGGDPGSVTIFGESAGGQSVSILLLSPLTKNLFHRAISESGVALLSSLFRKNTKSLAEKIAIEAGCKTTTSAVMVHCLRQKTEEELMEVTLKMKFMALDLVGDPKENTAFLTTVIDGVLLPKAPAEILAEKKYNMLPYMVGINQQEFGWIIPMQMLGYPLSEGKLDQKTATELLWKSYPIVNVSKELTPVATEKYLGGTDDPVKKKDLFLDMLADLLFGVPSVNVARHHRDAGAPTYMYEYRYRPSFSSDMRPKTVIGDHGDEIFSVLGAPFLKEGATEEEIKLSKMVMKYWANFARNGNPNGEGLPQWPAYDYKEGYLQIGATTQAAQKLKDKEVAFWTELWAKEAARPRETEHIEL,./data/raw/alphafold//AF-P12337-F1-model_v4.pdb,1494,2159,6269,1618 +1236,22242,22575,MLRRDFLKYSVALGVASALPLWSRAAFAAERPALPIPDLLTADASNRMQLIVKAGQSTFAGKNATTWGYNGNLLGPAVQLHKGKSVTVDIHNQLAEDTTLHWHGLEIPGIVDGGPQGIIPAGGTRTVTFTPEQRAATCWIHPHKHGKTGRQVAMGLAGLVLIEDDEIRKLRLPKQWGIDDVPVIIQDKRFSADGQIDYQLDIMTAAVGWFGDTLLTNGAIYPQHSAPKGWLRLRLLNGCNARSLNIAASDNRPLYVIASDGGLLAEPVKVTELPLLMGERFEVLVDISDGKAFDLVTLPVSQMGMAIAPFDKPHPVMRIQPLRITASGTLPDTLTTMPALPSLEGLTVRNLKLSMDPRLDMMGMQMLMKKYGAQAMSGMDHDSMNAHMQGGNMGHGEMDHGNMDHSGMNHGAMGNMNHGGKFDFHNANFINGQVFDMNKPMFAAQKGRHERWVISGVGDMMLHPFHIHGTQFRILSENGKAPAAHRTGWKDTVRVEGGISEVLVKFDHDAPKEHAYMAHCHLLEHEDTGMMLGFTV,brenda,Q8ZRS2,O=O.[Fe+2].[H+]>>O.[Fe+3],16.12,9.156990061755163,30.0,7.5,1.16.3.4,90371.0,1.207365037469072,O=O.[Fe+2].[H+],O.[Fe+3],1.207365037469072,O=O.[Fe+2].[H+]__MLRRDFLKYSVALGVASALPLWSRAAFAAERPALPIPDLLTADASNRMQLIVKAGQSTFAGKNATTWGYNGNLLGPAVQLHKGKSVTVDIHNQLAEDTTLHWHGLEIPGIVDGGPQGIIPAGGTRTVTFTPEQRAATCWIHPHKHGKTGRQVAMGLAGLVLIEDDEIRKLRLPKQWGIDDVPVIIQDKRFSADGQIDYQLDIMTAAVGWFGDTLLTNGAIYPQHSAPKGWLRLRLLNGCNARSLNIAASDNRPLYVIASDGGLLAEPVKVTELPLLMGERFEVLVDISDGKAFDLVTLPVSQMGMAIAPFDKPHPVMRIQPLRITASGTLPDTLTTMPALPSLEGLTVRNLKLSMDPRLDMMGMQMLMKKYGAQAMSGMDHDSMNAHMQGGNMGHGEMDHGNMDHSGMNHGAMGNMNHGGKFDFHNANFINGQVFDMNKPMFAAQKGRHERWVISGVGDMMLHPFHIHGTQFRILSENGKAPAAHRTGWKDTVRVEGGISEVLVKFDHDAPKEHAYMAHCHLLEHEDTGMMLGFTV,./data/raw/alphafold//AF-Q8ZRS2-F1-model_v4.pdb,3416,2300,1007,6829 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+1364,18730,19003,MQQQTGGRRRQIRRVVVATSNAGKVRELQGALAPLGWQCEGLGAVTLPEETGSTYEENAALKACAAAMATGLPALADDSGIEVLALGGQPGVYSARFGNVNSDVERNVLLLEKMRRHTDRRAKFVSVLVLAYPDGKLEEYRGEVTGQLLEGPRGESGFGYDPLFLPDGSELSMGEMTLEQKQAISHRGQALAALLAAHGA,brenda,Q9RXX6,Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O1.O>>Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)O)O1.O=P(O)(O)O,0.52,6.6140220540409e-15,37.0,9.0,3.6.1.15,1299.0,-0.2839966563652008,Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O1.O,Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)O)O1.O=P(O)(O)O,-0.2839966563652008,Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O1.O__MQQQTGGRRRQIRRVVVATSNAGKVRELQGALAPLGWQCEGLGAVTLPEETGSTYEENAALKACAAAMATGLPALADDSGIEVLALGGQPGVYSARFGNVNSDVERNVLLLEKMRRHTDRRAKFVSVLVLAYPDGKLEEYRGEVTGQLLEGPRGESGFGYDPLFLPDGSELSMGEMTLEQKQAISHRGQALAALLAAHGA,./data/raw/alphafold//AF-Q9RXX6-F1-model_v4.pdb,2056,4226,4100,3949 +1365,14328,14526,MIDLNIMKVANYINGEFKEPSTGAFQVKTSPVDGSKIAEVPRSGREDAREAIDSAFEALKAWANIPAIRRAEYLYKMLEVFRQMKEDFMKILTVEGGGTYRKVWGEVVFTERLIQNAAELARHYQGRVLQSDSESTISVVFKRSKGVVGVITPWNYPLSISMKKIAHTLAVGNTVVYKPASDTPVTGWLIAQMVAKAGLPKGVFNLVIGPGPVVGEEIVTHKRVAHVTFTGESSTGREIAAKAAGTLKTVTLELGGSDPLIILDDVDVDYAARLAVFASLFHQGQICTSAKRIIVHKAVADKFIERYVHYVKMLRIDDPRKDEKVDLGPLINERQVALMKEFVDDAVSRGGRLLIGGRSWGNFFEPAIFVDVDRNFRIMREEVFGPVRPIVVVENDDQAVEVANDTDYGLSGAVLTNNVNRAFRIAEAVESGMFHINDVTFLEESHVPFGGIKASGVGREGGEWSFHETTYDRWVTVTLRTRRFPIPSALK,brenda,G7VCG0,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O.O=CC(O)CO>>N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=C(O)C(O)CO.[H+],1.2,6.663863127138954e-15,60.0,8.8,1.2.1.4,1104324.0,0.0791812460476248,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O.O=CC(O)CO,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=C(O)C(O)CO.[H+],0.0791812460476248,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O.O=CC(O)CO__MIDLNIMKVANYINGEFKEPSTGAFQVKTSPVDGSKIAEVPRSGREDAREAIDSAFEALKAWANIPAIRRAEYLYKMLEVFRQMKEDFMKILTVEGGGTYRKVWGEVVFTERLIQNAAELARHYQGRVLQSDSESTISVVFKRSKGVVGVITPWNYPLSISMKKIAHTLAVGNTVVYKPASDTPVTGWLIAQMVAKAGLPKGVFNLVIGPGPVVGEEIVTHKRVAHVTFTGESSTGREIAAKAAGTLKTVTLELGGSDPLIILDDVDVDYAARLAVFASLFHQGQICTSAKRIIVHKAVADKFIERYVHYVKMLRIDDPRKDEKVDLGPLINERQVALMKEFVDDAVSRGGRLLIGGRSWGNFFEPAIFVDVDRNFRIMREEVFGPVRPIVVVENDDQAVEVANDTDYGLSGAVLTNNVNRAFRIAEAVESGMFHINDVTFLEESHVPFGGIKASGVGREGGEWSFHETTYDRWVTVTLRTRRFPIPSALK,./data/raw/alphafold//AF-G7VCG0-F1-model_v4.pdb,1804,1480,3050,1800 +1366,20079,20367,MVYTAQYLAMAAAMLPNAVLAQNNQTYANYSSQSQPDLYPQTLATLNLSFPDCVNGPLKDNIVCDTSANYVDRAEGLIALFTLEELINNTQNSGPGVPRLGLPPYQVWSEGLHGLDRANFAKSGDEWTWATSFPMPILSMAALNRTLINQIAGIIATQARAFNNVGRYGLDAYAPNINGFRSPLWGRGQETPGEDANFLSSSYAYEYITGLQGGVDPDHLKIAATAKHFAGYDLENWGGNSRLGFDASITQQDLAEYYTPQFLAASRYAKARSFMCSYNSVNGVPSCSSSFLLQTLLRENWDFPEYGYVSSDCDAVYNVFNPHGYASNQSAAAADSLKAGTDIDCGQTYPWHLNQSFIEGSVTRGEIERSIIRLYSNLVKLGYFDGDKSEYRQLGWNDVVTTDAWNISYEAAVEGIVLLKNDGVLPLAKKVKSIALIGPWANATEQLQGNYFGTAPYLITPLQGASDAGYKVNYALGTNISGNTTEGFADAVKAAKNSDVVVYLGGIDNTIEAEGTDRLNVTWPGNQLDLIQKLSQTGKPLVVLQMGGGQVDSSSIKSNSKVNALVWGGYPGQSGGKAIFDILSGKRAPAGRLVSTQYPAEYATQFPATNMNLRPDGASNPGQTYKWYTGTPVYDFGYGLFYTTFKETAQKLGSSSFDISEIISSPRSPSYEYSELVPFVNVTATIKNTGKTASPYTAMLFANTTNAGPAPYPNKWLVGYDRLASIEPGKSVDLVIPVPIGAIARVDENGNRIVYPGDYQLALNVDRSVVWDIKLTGDAVTIENWPLDEQEIQPDPN,brenda,A0A0H3W535,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)cc1>>O=[N+]([O-])c1ccc(O)cc1.OC[C@@H]1O[C@@H](O)[C@H](O)[C@H]1O,143.0,9.809384078968736e-15,50.0,3.0,3.2.1.37,1196081.0,2.155336037465062,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)cc1,O=[N+]([O-])c1ccc(O)cc1.OC[C@@H]1O[C@@H](O)[C@H](O)[C@H]1O,2.155336037465062,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)cc1__MVYTAQYLAMAAAMLPNAVLAQNNQTYANYSSQSQPDLYPQTLATLNLSFPDCVNGPLKDNIVCDTSANYVDRAEGLIALFTLEELINNTQNSGPGVPRLGLPPYQVWSEGLHGLDRANFAKSGDEWTWATSFPMPILSMAALNRTLINQIAGIIATQARAFNNVGRYGLDAYAPNINGFRSPLWGRGQETPGEDANFLSSSYAYEYITGLQGGVDPDHLKIAATAKHFAGYDLENWGGNSRLGFDASITQQDLAEYYTPQFLAASRYAKARSFMCSYNSVNGVPSCSSSFLLQTLLRENWDFPEYGYVSSDCDAVYNVFNPHGYASNQSAAAADSLKAGTDIDCGQTYPWHLNQSFIEGSVTRGEIERSIIRLYSNLVKLGYFDGDKSEYRQLGWNDVVTTDAWNISYEAAVEGIVLLKNDGVLPLAKKVKSIALIGPWANATEQLQGNYFGTAPYLITPLQGASDAGYKVNYALGTNISGNTTEGFADAVKAAKNSDVVVYLGGIDNTIEAEGTDRLNVTWPGNQLDLIQKLSQTGKPLVVLQMGGGQVDSSSIKSNSKVNALVWGGYPGQSGGKAIFDILSGKRAPAGRLVSTQYPAEYATQFPATNMNLRPDGASNPGQTYKWYTGTPVYDFGYGLFYTTFKETAQKLGSSSFDISEIISSPRSPSYEYSELVPFVNVTATIKNTGKTASPYTAMLFANTTNAGPAPYPNKWLVGYDRLASIEPGKSVDLVIPVPIGAIARVDENGNRIVYPGDYQLALNVDRSVVWDIKLTGDAVTIENWPLDEQEIQPDPN,./data/raw/alphafold//AF-A0A0H3W535-F1-model_v4.pdb,1081,2991,5341,6220 +1367,18657,18930,MKCKPNQTRTYDPEGFKKRAACLCFRSEREDEVLLVSSSRYPDRWIVPGGGMEPEEEPGGAAVREVYEEAGVKGKLGRLLGVFEQNQDPKHRTYVYVLTVTELLEDWEDSVSIGRKREWFKVEDAIKVLQCHKPVHAEYLEKLKLGGSPTNGNSMAPSSPDSDP,brenda,Q8NFP7,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O.O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.8,6.080257877793313e-15,37.0,7.6,3.6.1.60,9606.0,-0.0969100130080563,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O.O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-0.0969100130080563,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O.O__MKCKPNQTRTYDPEGFKKRAACLCFRSEREDEVLLVSSSRYPDRWIVPGGGMEPEEEPGGAAVREVYEEAGVKGKLGRLLGVFEQNQDPKHRTYVYVLTVTELLEDWEDSVSIGRKREWFKVEDAIKVLQCHKPVHAEYLEKLKLGGSPTNGNSMAPSSPDSDP,./data/raw/alphafold//AF-Q8NFP7-F1-model_v4.pdb,2523,2549,5201,5691 +1368,6644,6757,MAEETPRYAVVTGANRGIGFEICRQLASEGIRVVLTSRDENRGLEAVETLKKELEISDQSLLFHQLDVADPASITSLAEFVKTQFGKLDILVNNAGIGGIITDAEALRAGAGKEGFKWDEIITETYELTEECIKINYYGPKRMCEAFIPLLKLSDSPRIVNVSSSMGQLKNVLNEWAKGILSDAENLTEERIDQVINQLLNDFKEGTVKEKNWAKFMSAYVVSKASLNGYTRVLAKKHPEFRVNAVCPGFVKTDMNFKTGVLSVEEGASSPVRLALLPHQETPSGCFFSRKQVSEF,sabio,Q9M2E2,CCCC=CC=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.[H]>>CCC/C=C/CO.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,0.4,6.726410918377711e-15,,7.0,1.1.1.-,3702.0,-0.3979400086720376,CCCC=CC=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.[H],CCC/C=C/CO.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,-0.3979400086720376,CCCC=CC=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.[H]__MAEETPRYAVVTGANRGIGFEICRQLASEGIRVVLTSRDENRGLEAVETLKKELEISDQSLLFHQLDVADPASITSLAEFVKTQFGKLDILVNNAGIGGIITDAEALRAGAGKEGFKWDEIITETYELTEECIKINYYGPKRMCEAFIPLLKLSDSPRIVNVSSSMGQLKNVLNEWAKGILSDAENLTEERIDQVINQLLNDFKEGTVKEKNWAKFMSAYVVSKASLNGYTRVLAKKHPEFRVNAVCPGFVKTDMNFKTGVLSVEEGASSPVRLALLPHQETPSGCFFSRKQVSEF,./data/raw/alphafold//AF-Q9M2E2-F1-model_v4.pdb,2911,1874,3506,2324 +1369,5443,5529,MTFRNRLRLFAVSGLALFTVSASLPPAAASGAPEARHPSGGGLSATVRYTEYGIPHIVAKDYANLGFGTGWAQAADQVCTLADGFVTVRGERSKFFGPDAAPDFSLSSAAKNLSSDLYFRGVRDSGTVEKLLKVPAPAGPSRDAKESMRGFAAGYNAWLRQNRDRITDPACRGASWVRPVTALDVAVRGFALAVLGGQGRGIDGITAAQPPTAAPPAAGVTPKEAAAAAQRLLSTQNADMGSNAVAFRGSTTANGRGLLLGNPHYPWDGGRRFWQSQQTIPGELNVAGGSLLGSTTVSIGHNADVAWSHTVATGVTLNLHQLTLDPADPTVYLVDGKPQRMTQRTVAVPVKGAAPVTRTQWWTRYGPVVTSLGAALPLPWTASTAYALNDPNAVNLRSADTSLGFSKARSTAGIERALHRSQGLPWVNTIAADRSGNSFFSQSQVLPRITDELAARCSTPLGQATYPSAGLAVLDGSTSACALGSDRDAVQPGIFGPGRMPTLKNAPYVENSNDSAWLTNADRPLTGYERVFGTTATQRSIRTRGAIEDVAAMAERGRLRVTDLERQQLANRAPTGDLVAADVAKWCAALPGGTAVGSSGTPVDVSAACPVLRRWDRSVDSDSRGALLFDRFWRKAAAVPAAELWKVPFDAADPVRTPRGLNTAAPGVGKALADTVTELKAAGIALNAPLGEHQFVVRNGKRIPVGGGTESLGIWNKIEPVWNPAAGGYTEVSAGSSYIQAVGWDNSRCPVARTLLTYSQSSNPNSPHYSDQTRLFSGERWVTSRFCEKDIARSPQLKVVRVHERR,brenda,Q539C0,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O.O>>CC1(C)S[C@@H]2[C@H](N)C(=O)N2[C@H]1C(=O)O.O=C(O)Cc1ccccc1,10.95,8.053483426577734e-15,40.0,8.0,3.5.1.11,58340.0,1.0394141191761372,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O.O,CC1(C)S[C@@H]2[C@H](N)C(=O)N2[C@H]1C(=O)O.O=C(O)Cc1ccccc1,1.0394141191761372,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O.O__MTFRNRLRLFAVSGLALFTVSASLPPAAASGAPEARHPSGGGLSATVRYTEYGIPHIVAKDYANLGFGTGWAQAADQVCTLADGFVTVRGERSKFFGPDAAPDFSLSSAAKNLSSDLYFRGVRDSGTVEKLLKVPAPAGPSRDAKESMRGFAAGYNAWLRQNRDRITDPACRGASWVRPVTALDVAVRGFALAVLGGQGRGIDGITAAQPPTAAPPAAGVTPKEAAAAAQRLLSTQNADMGSNAVAFRGSTTANGRGLLLGNPHYPWDGGRRFWQSQQTIPGELNVAGGSLLGSTTVSIGHNADVAWSHTVATGVTLNLHQLTLDPADPTVYLVDGKPQRMTQRTVAVPVKGAAPVTRTQWWTRYGPVVTSLGAALPLPWTASTAYALNDPNAVNLRSADTSLGFSKARSTAGIERALHRSQGLPWVNTIAADRSGNSFFSQSQVLPRITDELAARCSTPLGQATYPSAGLAVLDGSTSACALGSDRDAVQPGIFGPGRMPTLKNAPYVENSNDSAWLTNADRPLTGYERVFGTTATQRSIRTRGAIEDVAAMAERGRLRVTDLERQQLANRAPTGDLVAADVAKWCAALPGGTAVGSSGTPVDVSAACPVLRRWDRSVDSDSRGALLFDRFWRKAAAVPAAELWKVPFDAADPVRTPRGLNTAAPGVGKALADTVTELKAAGIALNAPLGEHQFVVRNGKRIPVGGGTESLGIWNKIEPVWNPAAGGYTEVSAGSSYIQAVGWDNSRCPVARTLLTYSQSSNPNSPHYSDQTRLFSGERWVTSRFCEKDIARSPQLKVVRVHERR,./data/raw/alphafold//AF-Q539C0-F1-model_v4.pdb,3109,1876,3508,2327 +1370,5367,5453,MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDKLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVEYSPVTEKHLTDGMTVRELCSAAITMGDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDRWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAE,sabio,Q9S534,CC1(C)SC2C(NC(=O)Cc3ccccc3)C(=O)N2C1C(=O)O.O>>,200.0,99.71704412979751,37.0,7.0,3.5.2.6,571.0,2.3010299956639813,CC1(C)SC2C(NC(=O)Cc3ccccc3)C(=O)N2C1C(=O)O.O,,2.3010299956639813,CC1(C)SC2C(NC(=O)Cc3ccccc3)C(=O)N2C1C(=O)O.O__MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDKLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVEYSPVTEKHLTDGMTVRELCSAAITMGDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDRWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAE,./data/raw/alphafold//AF-Q9S534-F1-model_v4.pdb,1458,402,35,2356 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+1379,9885,10035,MTLEKFVDALPIPDTLKPVQQSKEKTYYEVTMEECTHQLHRDLPPTRLWGYNGLFPGPTIEVKRNENVYVKWMNNLPSTHFLPIDHTIHHSDSQHEEPEVKTVVHLHGGVTPDDSDGYPEAWFSKDFEQTGPYFKREVYHYPNQQRGAILWYHDHAMALTRLNVYAGLVGAYIIHDPKEKRLKLPSDEYDVPLLITDRTINEDGSLFYPSAPENPSPSLPNPSIVPAFCGETILVNGKVWPYLEVEPRKYRFRVINASNTRTYNLSLDNGGDFIQIGSDGGLLPRSVKLNSFSLAPAERYDIIIDFTAYEGESIILANSAGCGGDVNPETDANIMQFRVTKPLAQKDESRKPKYLASYPSVQHERIQNIRTLKLAGTQDEYGRPVLLLNNKRWHDPVTETPKVGTTEIWSIINPTRGTHPIHLHLVSFRVLDRRPFDIARYQESGELSYTGPAVPPPPSEKGWKDTIQAHAGEVLRIAATFGPYSGRYVWHCHILEHEDYDMMRPMDITDPHK,uniprot_search,A0A164UCV6,COc1ccccc1O.O=O>>O,60.0,78.85836302183245,50.0,8.0,1.10.3.2,1423.0,1.7781512503836436,COc1ccccc1O.O=O,O,1.7781512503836436,COc1ccccc1O.O=O__MTLEKFVDALPIPDTLKPVQQSKEKTYYEVTMEECTHQLHRDLPPTRLWGYNGLFPGPTIEVKRNENVYVKWMNNLPSTHFLPIDHTIHHSDSQHEEPEVKTVVHLHGGVTPDDSDGYPEAWFSKDFEQTGPYFKREVYHYPNQQRGAILWYHDHAMALTRLNVYAGLVGAYIIHDPKEKRLKLPSDEYDVPLLITDRTINEDGSLFYPSAPENPSPSLPNPSIVPAFCGETILVNGKVWPYLEVEPRKYRFRVINASNTRTYNLSLDNGGDFIQIGSDGGLLPRSVKLNSFSLAPAERYDIIIDFTAYEGESIILANSAGCGGDVNPETDANIMQFRVTKPLAQKDESRKPKYLASYPSVQHERIQNIRTLKLAGTQDEYGRPVLLLNNKRWHDPVTETPKVGTTEIWSIINPTRGTHPIHLHLVSFRVLDRRPFDIARYQESGELSYTGPAVPPPPSEKGWKDTIQAHAGEVLRIAATFGPYSGRYVWHCHILEHEDYDMMRPMDITDPHK,./data/raw/alphafold//AF-A0A164UCV6-F1-model_v4.pdb,3403,2293,1019,2915 +1380,20254,20547,MLSNARIIAAGCIAAGSLVAAGPCDIYSSGGTPCVAAHSTTRALFSAYTGPLYQVKRGSDGATTAISPLSSGVANAAAQDAFCAGTTCLITIIYDQSGRGNHLREAPPGGFSGPESNGYDNLASAIGAPVTLNGQKAYGVFVSPGTGYRNNAASGTAKGDAAEGMYAVLDGTHYNGACCFDYGNAETNSRDTGNGHMEAIYFGDSTVWGTGSGKGPWIMADLENGLFSGSSPGNNAGDPSISYRFVTAAIKGQPNQWAIRGGNAASGSLSTFYSGARPQVSGYNPMSKEGAIILGIGGDNSNGGQGTFYEGVMTSGYPSDATENSVQANIVAARYAVAPLTSGPALTVGSSISLRATTACCTTRYIAHSGSTVNTQVVSSSSATALKQQASWTVRAGLANNACFSFESQDTSGSYIRHSNFGLVLNANDGSKLFAEDATFCTQAGINGQGSSIRSWSYPTRYFRHYNNTLYIASNGGVHVFDATAAFNDDVSFVVSGGFA,uniprot_search,P48792,O.O=[N+]([O-])c1cccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)c1>>O=[N+]([O-])c1cccc(O)c1.OC[C@@H]1O[C@@H](O)[C@H](O)[C@H]1O,2.02,9.809384078968736e-15,25.0,3.0,3.2.1.55,97093.0,0.3053513694466238,O.O=[N+]([O-])c1cccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)c1,O=[N+]([O-])c1cccc(O)c1.OC[C@@H]1O[C@@H](O)[C@H](O)[C@H]1O,0.3053513694466238,O.O=[N+]([O-])c1cccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)c1__MLSNARIIAAGCIAAGSLVAAGPCDIYSSGGTPCVAAHSTTRALFSAYTGPLYQVKRGSDGATTAISPLSSGVANAAAQDAFCAGTTCLITIIYDQSGRGNHLREAPPGGFSGPESNGYDNLASAIGAPVTLNGQKAYGVFVSPGTGYRNNAASGTAKGDAAEGMYAVLDGTHYNGACCFDYGNAETNSRDTGNGHMEAIYFGDSTVWGTGSGKGPWIMADLENGLFSGSSPGNNAGDPSISYRFVTAAIKGQPNQWAIRGGNAASGSLSTFYSGARPQVSGYNPMSKEGAIILGIGGDNSNGGQGTFYEGVMTSGYPSDATENSVQANIVAARYAVAPLTSGPALTVGSSISLRATTACCTTRYIAHSGSTVNTQVVSSSSATALKQQASWTVRAGLANNACFSFESQDTSGSYIRHSNFGLVLNANDGSKLFAEDATFCTQAGINGQGSSIRSWSYPTRYFRHYNNTLYIASNGGVHVFDATAAFNDDVSFVVSGGFA,./data/raw/alphafold//AF-P48792-F1-model_v4.pdb,2147,4351,4240,4104 +1381,9872,10022,MLAFDFFLQASAGSILPLQALAKADPLEVAEPVTAQILPEGEGTTAMLGFMGSTPGPELRARQGEQFDIDVQNRIEEGSAVHWHGARRDDNMDGVPVMTQDLIEPGDEKEYSFAAPDAATIWYHSHQGSAEQVARGTRGPLIVEMGPPDVDHGDLTVLPDWWIIHEDGVLSDEFTNMSGDAHRGYLGNFARASLSPVEEVAGDDRVRSRVINAATDRIFPLGRQGVDGTVVGLDGMTLVSPRQPSDLTLAPAQRADHIMDATSPDPVGFGLISRDGRYFLPAHDVFGSNTARWPFWIVPLLPNLADEPDAKGHVTLTMGTEDTPLHPLPQAGMMSANIWAFNFLEILPDAPFHSPKRGETHRIQLYNDTGFPHGIHLHGHHFAADGADGSLGFLRDTTLVPAGEQRDLNCVFDNPGRWLVHCHMLGMALGGMDTWVPDAPL,sabio,A0A0H4CVT8,COc1ccccc1O.O=O>>O,1.34,78.85836302183245,60.0,7.0,1.10.3.2,2725.0,0.1271047983648076,COc1ccccc1O.O=O,O,0.1271047983648076,COc1ccccc1O.O=O__MLAFDFFLQASAGSILPLQALAKADPLEVAEPVTAQILPEGEGTTAMLGFMGSTPGPELRARQGEQFDIDVQNRIEEGSAVHWHGARRDDNMDGVPVMTQDLIEPGDEKEYSFAAPDAATIWYHSHQGSAEQVARGTRGPLIVEMGPPDVDHGDLTVLPDWWIIHEDGVLSDEFTNMSGDAHRGYLGNFARASLSPVEEVAGDDRVRSRVINAATDRIFPLGRQGVDGTVVGLDGMTLVSPRQPSDLTLAPAQRADHIMDATSPDPVGFGLISRDGRYFLPAHDVFGSNTARWPFWIVPLLPNLADEPDAKGHVTLTMGTEDTPLHPLPQAGMMSANIWAFNFLEILPDAPFHSPKRGETHRIQLYNDTGFPHGIHLHGHHFAADGADGSLGFLRDTTLVPAGEQRDLNCVFDNPGRWLVHCHMLGMALGGMDTWVPDAPL,./data/raw/alphafold//AF-A0A0H4CVT8-F1-model_v4.pdb,3546,2291,3995,2886 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+1432,6995,7111,MESQVRGGTRWKRFAVVMVPSVAATAAIGVALAQGALAASFSVSGQSFKVTAQELNGTGFSQYGAIDQGYTLSGEKTAHPVAVSVFDTARIQKMCQSVVTPNIPLLGSVSLTLTAGDSADPEKQVNAKNLYIDVEDLGADAEFTNIDIGVAGKDISQGPGMKAGEVQKKQANPYGFAQQAEKAKLTDVKQTAWATTAGTFKLPGLKMKLQTGTHECY,sabio,Q2AAT6,CCCCCC=CCC=CCCCCCCCC(=O)OC1CCC2(C)C(=CCC3C2CCC2(C)C(C(C)CCCC(C)C)CCC32)C1.O>>CC(C)CCCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C.CCCCCC=CCC=CCCCCCCCC(=O)O,31.2,1.7028776680249735e-14,37.0,7.0,3.1.1.13,1931.0,1.4941545940184429,CCCCCC=CCC=CCCCCCCCC(=O)OC1CCC2(C)C(=CCC3C2CCC2(C)C(C(C)CCCC(C)C)CCC32)C1.O,CC(C)CCCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C.CCCCCC=CCC=CCCCCCCCC(=O)O,1.4941545940184429,CCCCCC=CCC=CCCCCCCCC(=O)OC1CCC2(C)C(=CCC3C2CCC2(C)C(C(C)CCCC(C)C)CCC32)C1.O__MESQVRGGTRWKRFAVVMVPSVAATAAIGVALAQGALAASFSVSGQSFKVTAQELNGTGFSQYGAIDQGYTLSGEKTAHPVAVSVFDTARIQKMCQSVVTPNIPLLGSVSLTLTAGDSADPEKQVNAKNLYIDVEDLGADAEFTNIDIGVAGKDISQGPGMKAGEVQKKQANPYGFAQQAEKAKLTDVKQTAWATTAGTFKLPGLKMKLQTGTHECY,./data/raw/alphafold//AF-Q2AAT6-F1-model_v4.pdb,3268,2100,839,1162 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+1538,17368,17601,MITPLTLATLSKNPILVDFFDPEDGRWNSHVDLGLWSDLYLIAPATANTIGKMAAGIADNLLLTSYLSARCPVFIAPAMDVDMLMHPATQRNLGILKSSGNHIIEPGSGELASGLTGKGRMAEPEEIVREVISFFSKKKITEKPLNGRRVFINAGPTIEPIDPVRFISNYSSGRMGIALADAAAAMGAEVTLVLGPVTLRPSSQDINVIDVRSAAEMKEASVEAFRECDIAILAAAVADFTPLTTSDKKIKRGSGEMVINLRPTEDIAAELGKMKKKNQLLVGFALETDDEITNASSKLKRKNLDMIVLNSLKDPGAGFGHETNRITIIDKSNNIDKFELKTKGEVAADIIRKILTLVH,brenda,A0A2I9,N[C@@H](CS(=O)O)C(=O)O>>NCCS(=O)O.O=C=O,0.763,0.0,35.0,7.0,4.1.1.29,2725.0,-0.1174754620451195,N[C@@H](CS(=O)O)C(=O)O,NCCS(=O)O.O=C=O,-0.1174754620451195,N[C@@H](CS(=O)O)C(=O)O__MITPLTLATLSKNPILVDFFDPEDGRWNSHVDLGLWSDLYLIAPATANTIGKMAAGIADNLLLTSYLSARCPVFIAPAMDVDMLMHPATQRNLGILKSSGNHIIEPGSGELASGLTGKGRMAEPEEIVREVISFFSKKKITEKPLNGRRVFINAGPTIEPIDPVRFISNYSSGRMGIALADAAAAMGAEVTLVLGPVTLRPSSQDINVIDVRSAAEMKEASVEAFRECDIAILAAAVADFTPLTTSDKKIKRGSGEMVINLRPTEDIAAELGKMKKKNQLLVGFALETDDEITNASSKLKRKNLDMIVLNSLKDPGAGFGHETNRITIIDKSNNIDKFELKTKGEVAADIIRKILTLVH,./data/raw/alphafold//AF-A0A2I9-F1-model_v4.pdb,2790,5355,2624,5451 +1539,9152,9294,MLKVISSLLVYMTASVMAVASPLAHSGEPSGEYPTVNEIPVGEVRLYQIADGVWSHIATQSFDGAVYPSNGLIVRDGDELLLIDTAWGAKNTAALLAEIEKQIGLPVTRAVSTHFHDDRVGGVDVLRAAGVATYASPSTRRLAEAEGNEIPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVHELSSTSAGNVADADLAEWPTSVERIQKHYPEAEVVIPGHGLPGGLDLLQHTANVVKAHKNRSVAE,sabio,Q9XAY4,CON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[N+]3(C)CCCC3)CSC12)c1csc(N)n1.O>>,119.0,99.799834663432,25.0,7.5,3.5.2.6,287.0,2.0755469613925306,CON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[N+]3(C)CCCC3)CSC12)c1csc(N)n1.O,,2.0755469613925306,CON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[N+]3(C)CCCC3)CSC12)c1csc(N)n1.O__MLKVISSLLVYMTASVMAVASPLAHSGEPSGEYPTVNEIPVGEVRLYQIADGVWSHIATQSFDGAVYPSNGLIVRDGDELLLIDTAWGAKNTAALLAEIEKQIGLPVTRAVSTHFHDDRVGGVDVLRAAGVATYASPSTRRLAEAEGNEIPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVHELSSTSAGNVADADLAEWPTSVERIQKHYPEAEVVIPGHGLPGGLDLLQHTANVVKAHKNRSVAE,./data/raw/alphafold//AF-Q9XAY4-F1-model_v4.pdb,1446,972,778,1115 +1540,4978,5050,MSETPRLLFVHAHPDDESLSNGATIAHYTSRGAQVHVVTCTLGEEGEVIGDRWAQLTADHADQLGGYRIGELTAALRALGVSAPIYLGGAGRWRDSGMAGTDQRSQRRFVDADPRQTVGALVAIIRELRPHVVVTYDPNGGYGHPDHVHTHTVTTAAVAAAGVGSGTADHPGDPWTVPKFYWTVLGLSALISGARALVPDDLRPEWVLPRADEIAFGYSDDGIDAVVEADEQARAAKVAALAAHATQVVVGPTGRAAALSNNLALPILADEHYVLAGGSAGARDERGWETDLLAGLGFTASGT,brenda,P9WJN3,CC(O)=N[C@H]1[C@@H](O[C@@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O.O>>CC(=O)O.N[C@H]1[C@@H](O[C@@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,0.49,0.0,37.0,7.5,3.5.1.103,1773.0,-0.3098039199714864,CC(O)=N[C@H]1[C@@H](O[C@@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O.O,CC(=O)O.N[C@H]1[C@@H](O[C@@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O,-0.3098039199714864,CC(O)=N[C@H]1[C@@H](O[C@@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O.O__MSETPRLLFVHAHPDDESLSNGATIAHYTSRGAQVHVVTCTLGEEGEVIGDRWAQLTADHADQLGGYRIGELTAALRALGVSAPIYLGGAGRWRDSGMAGTDQRSQRRFVDADPRQTVGALVAIIRELRPHVVVTYDPNGGYGHPDHVHTHTVTTAAVAAAGVGSGTADHPGDPWTVPKFYWTVLGLSALISGARALVPDDLRPEWVLPRADEIAFGYSDDGIDAVVEADEQARAAKVAALAAHATQVVVGPTGRAAALSNNLALPILADEHYVLAGGSAGARDERGWETDLLAGLGFTASGT,./data/raw/alphafold//AF-P9WJN3-F1-model_v4.pdb,3024,1774,3399,2206 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+1542,16768,16998,MRKEPYDFPLDDYISREEFNKIKKFSRDKETPFLIVDLQKIERSYDELVEHMPFAKIHYAVKANPLDKVVLALKRKGSNFDVATIYELDQLIRLGVEPERISYGNTIKKEKDIAYAYDNGVRLFVTDSESDLKKLARRAPGSRVFFRILTESDGADWPLSRKFGSHPDLIYKLILKAEKLGLEPYGLSFHVGSQQRDIGQWDNAIAKCKYLFEAVAEKGIHLKMINLGGGFPAKYQSQAHDLETYAHEIRRFLHEDFGEELPEILIEPGRSLVADAGIIVSEVIMIAKKARFNQYKWVYLDIGKFGGLIETLDECIKYPIFCDKKGCAEEVILAGPTCDSMDILYEHHKYSFPHTMRDGNRVYIFTTGAYTQSYSSICFNGFPPLKAYVI,sabio,Q8PS97,NCCCCC(N)C(=O)O>>NCCCCCN.O=C=O,0.24,0.0,37.0,8.0,4.1.1.18,2209.0,-0.619788758288394,NCCCCC(N)C(=O)O,NCCCCCN.O=C=O,-0.619788758288394,NCCCCC(N)C(=O)O__MRKEPYDFPLDDYISREEFNKIKKFSRDKETPFLIVDLQKIERSYDELVEHMPFAKIHYAVKANPLDKVVLALKRKGSNFDVATIYELDQLIRLGVEPERISYGNTIKKEKDIAYAYDNGVRLFVTDSESDLKKLARRAPGSRVFFRILTESDGADWPLSRKFGSHPDLIYKLILKAEKLGLEPYGLSFHVGSQQRDIGQWDNAIAKCKYLFEAVAEKGIHLKMINLGGGFPAKYQSQAHDLETYAHEIRRFLHEDFGEELPEILIEPGRSLVADAGIIVSEVIMIAKKARFNQYKWVYLDIGKFGGLIETLDECIKYPIFCDKKGCAEEVILAGPTCDSMDILYEHHKYSFPHTMRDGNRVYIFTTGAYTQSYSSICFNGFPPLKAYVI,./data/raw/alphafold//AF-Q8PS97-F1-model_v4.pdb,2706,3810,2391,5293 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+1622,15622,15846,MDLGLAGRRALVTGAGKGIGRSTVLALKAAGAQVVAVSRTREDLDDLVRECPGVEPVCVDLADWEATEQALSNVGPADLLVNNAAVALLQPFLEVTKEACVTSFNVNLRAVIQVSQIVAKGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALYMLTKMMALELGPHKIRVNAVNPTVVMTPMGRTNWSDPHKAKAMLDRIPLGKFAEVENVVDTILFLLSNRSGMTTGSTLPVDGGFLAT,sabio,Q920N9,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.OC1COC(O)C1O.[H]>>NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1.OCC(O)C(O)CO,28.0,0.0,25.0,7.0,1.1.1.10,10141.0,1.4471580313422192,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.OC1COC(O)C1O.[H],NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1.OCC(O)C(O)CO,1.505149978319906,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.OC1COC(O)C1O.[H]__MDLGLAGRRALVTGAGKGIGRSTVLALKAAGAQVVAVSRTREDLDDLVRECPGVEPVCVDLADWEATEQALSNVGPADLLVNNAAVALLQPFLEVTKEACVTSFNVNLRAVIQVSQIVAKGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALYMLTKMMALELGPHKIRVNAVNPTVVMTPMGRTNWSDPHKAKAMLDRIPLGKFAEVENVVDTILFLLSNRSGMTTGSTLPVDGGFLAT,./data/raw/alphafold//AF-Q920N9-F1-model_v4.pdb,1316,3874,6191,845 +1623,1135,1162,MSKLLMIGTGPVAIQLANICYLKSDYEIDMVGRASTSEKSKRLYQAYKKEKQFEVKIQNEAHQHLEGKFEINRLYKDVKNVKGEYETVVMACTADAYYDTLQQLSLETLQSVKHVILISPTFGSQMIVEQFMSKFSQDIEVISFSTYLGDTRIVDKEAPNHVLTTGVKKKLYMGSTHSNSTMCQRISALAEQLKIQLEVVESPLHAETRNSSLYVHPPLFMNDFSLKAIFEGTDVPVYVYKLFPEGPITMTLIREMRLMWKEMMAILQAFRVPSVNLLQFMVKENYPVRPETLDEGDIEHFEILPDILQEYLLYVRYTAILIDPFSQPDENGHYFDFSAVPFKQVYKNEQDVVQIPRMPSEDYYRTAMIQHIGKMLGIKTPMIDQFLTRYEASCQAYKDMHQDQQLSSQFNTNLFEGDKALVTKFLEINRTLS,brenda,A0A0H3JT80,CC(=O)C(=O)O.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]>>C[C@H](N[C@@H](CN[C@H](Cc1cnc[nH]1)C(=O)O)CC(=O)O)C(=O)O.N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O,0.26,13.303659126635557,22.0,8.0,1.5.1.52,1280.0,-0.585026652029182,CC(=O)C(=O)O.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],C[C@H](N[C@@H](CN[C@H](Cc1cnc[nH]1)C(=O)O)CC(=O)O)C(=O)O.N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O,-0.585026652029182,CC(=O)C(=O)O.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]__MSKLLMIGTGPVAIQLANICYLKSDYEIDMVGRASTSEKSKRLYQAYKKEKQFEVKIQNEAHQHLEGKFEINRLYKDVKNVKGEYETVVMACTADAYYDTLQQLSLETLQSVKHVILISPTFGSQMIVEQFMSKFSQDIEVISFSTYLGDTRIVDKEAPNHVLTTGVKKKLYMGSTHSNSTMCQRISALAEQLKIQLEVVESPLHAETRNSSLYVHPPLFMNDFSLKAIFEGTDVPVYVYKLFPEGPITMTLIREMRLMWKEMMAILQAFRVPSVNLLQFMVKENYPVRPETLDEGDIEHFEILPDILQEYLLYVRYTAILIDPFSQPDENGHYFDFSAVPFKQVYKNEQDVVQIPRMPSEDYYRTAMIQHIGKMLGIKTPMIDQFLTRYEASCQAYKDMHQDQQLSSQFNTNLFEGDKALVTKFLEINRTLS,./data/raw/alphafold//AF-A0A0H3JT80-F1-model_v4.pdb,1280,5241,1629,765 +1624,11839,11997,MGRPRPRAAKTWMFLLLLGGAWAGHSRAQEDKVLGGHECQPHSQPWQAALFQGQQLLCGGVLVGGNWVLTAAHCKKPKYTVRLGDHSLQNKDGPEQEIPVVQSIPHPCYNSSDVEDHNHDLMLLQLRDQASLGSKVKPISLADHCTQPGQKCTVSGWGTVTSPRENFPDTLNCAEVKIFPQKKCEDAYPGQITDGMVCAGSSKGADTCQGDSGGPLVCDGALQGITSWGSDPCGRSDKPGVYTNICRYLDWIKKIIGSKG,brenda,O60259,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N=C(O)[C@@H](N=C(O)OCc3ccccc3)C(C)C)C(C)C)ccc12.O>>CC(C)[C@H](N=C(O)OCc1ccccc1)C(O)=N[C@H](C(O)=N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C.Cc1cc(=O)oc2cc(N)ccc12,140.0,1.6662514634022145e-14,37.0,8.0,3.4.21.118,9606.0,2.146128035678238,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N=C(O)[C@@H](N=C(O)OCc3ccccc3)C(C)C)C(C)C)ccc12.O,CC(C)[C@H](N=C(O)OCc1ccccc1)C(O)=N[C@H](C(O)=N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C.Cc1cc(=O)oc2cc(N)ccc12,2.146128035678238,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N=C(O)[C@@H](N=C(O)OCc3ccccc3)C(C)C)C(C)C)ccc12.O__MGRPRPRAAKTWMFLLLLGGAWAGHSRAQEDKVLGGHECQPHSQPWQAALFQGQQLLCGGVLVGGNWVLTAAHCKKPKYTVRLGDHSLQNKDGPEQEIPVVQSIPHPCYNSSDVEDHNHDLMLLQLRDQASLGSKVKPISLADHCTQPGQKCTVSGWGTVTSPRENFPDTLNCAEVKIFPQKKCEDAYPGQITDGMVCAGSSKGADTCQGDSGGPLVCDGALQGITSWGSDPCGRSDKPGVYTNICRYLDWIKKIIGSKG,./data/raw/alphafold//AF-O60259-F1-model_v4.pdb,3744,4078,3615,2452 +1625,9760,9908,MSFSALRQLLLIACLALPSLAAANLPTADFDYIVVGAGNAGNVVAARLTEDPNVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSIEDFDRYAAVTGDDGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEREGAPTTTVCANKEVVLSAGSVGTPILLQLSGIGDQSDLSAVGIDTIVNNPSVGRNLSDHLLLPATFFVNNNQSFDNLFRDSSEFNADLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQSVPDPAAGPNSAHWETIFSNQWFHPALPRPDTGNFMSVTNALIAPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDARLSDPTNDAAIEWNIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGERGADLIKADQ,uniprot_search,Q9P928,COc1cccc(CO)c1.O=O>>COc1cccc(C=O)c1.OO,8.27,0.0,40.0,6.5,1.1.3.7,28995.0,0.9175055095525466,COc1cccc(CO)c1.O=O,COc1cccc(C=O)c1.OO,0.9175055095525466,COc1cccc(CO)c1.O=O__MSFSALRQLLLIACLALPSLAAANLPTADFDYIVVGAGNAGNVVAARLTEDPNVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSIEDFDRYAAVTGDDGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEREGAPTTTVCANKEVVLSAGSVGTPILLQLSGIGDQSDLSAVGIDTIVNNPSVGRNLSDHLLLPATFFVNNNQSFDNLFRDSSEFNADLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQSVPDPAAGPNSAHWETIFSNQWFHPALPRPDTGNFMSVTNALIAPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDARLSDPTNDAAIEWNIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGERGADLIKADQ,./data/raw/alphafold//AF-Q9P928-F1-model_v4.pdb,1050,3522,1297,3248 +1626,9576,9722,MEDIIKTLPQHTCSFLKHRFTLYKYKDAWNHQEFLEGRILSEQKFKAHPNDVFLASYPKSGTTWLKALAFAIITREKFDDSTSPLLTTMPHDCIPLLEKDLEKIQENQRNSLYTPISTHFHYKSLPESARTSNCKIVYIYRNMKDVIVSYYHFLRQIVKLSVEEAPFEEAFDEFCQGISSCGPYWEHIKGYWKASLEKPEIFLFLKYEDMKKDPVPSVKKLADFIGHPFTPKEEEAGVIEDIVKLCSFEKLSSLEVNKSGMHRPEEAHSIENRLYFRKGKDGDWKNYFTDEMTQKIDKLIDEKLGATGLVLK,sabio,P52836,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc2c1.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(OP(=O)(O)O)C1O,0.6,31.66237262679402,25.0,7.5,2.8.2.25,4228.0,-0.2218487496163563,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc2c1.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(OP(=O)(O)O)C1O,-0.2218487496163563,COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc2c1.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O__MEDIIKTLPQHTCSFLKHRFTLYKYKDAWNHQEFLEGRILSEQKFKAHPNDVFLASYPKSGTTWLKALAFAIITREKFDDSTSPLLTTMPHDCIPLLEKDLEKIQENQRNSLYTPISTHFHYKSLPESARTSNCKIVYIYRNMKDVIVSYYHFLRQIVKLSVEEAPFEEAFDEFCQGISSCGPYWEHIKGYWKASLEKPEIFLFLKYEDMKKDPVPSVKKLADFIGHPFTPKEEEAGVIEDIVKLCSFEKLSSLEVNKSGMHRPEEAHSIENRLYFRKGKDGDWKNYFTDEMTQKIDKLIDEKLGATGLVLK,./data/raw/alphafold//AF-P52836-F1-model_v4.pdb,3538,3479,1231,3159 +1627,16446,16674,MDGPVAEHAKQEPFHVVTPLLESWALSQVAGMPVFLKCENVQPSGSFKIRGIGHFCQEMAKKGCRHLVCSSGGNAGIAAAYAARKLGIPATIVLPESTSLQVVQRLQGEGAEVQLTGKVWDEANLRAQELAKRDGWENVPPFDHPLIWKGHASLVQELKAVLRTPPGALVLAVGGGGLLAGVVAGLLEVGWQHVPIIAMETHGAHCFNAAITAGKLVTLPDITSVAKSLGAKTVAARALECMQVCKIHSEVVEDTEAVSAVQQLLDDERMLVEPACGAALAAIYSGLLRRLQAEGCLPPSLTSVVVIVCGGNNINSRELQALKTHLGQV,sabio,Q96GA7,NC(CO)C(=O)O>>CC(=O)C(=O)O.N,10.0,0.0,,8.3,4.3.1.17,9606.0,1.0,NC(CO)C(=O)O,CC(=O)C(=O)O.N,1.0,NC(CO)C(=O)O__MDGPVAEHAKQEPFHVVTPLLESWALSQVAGMPVFLKCENVQPSGSFKIRGIGHFCQEMAKKGCRHLVCSSGGNAGIAAAYAARKLGIPATIVLPESTSLQVVQRLQGEGAEVQLTGKVWDEANLRAQELAKRDGWENVPPFDHPLIWKGHASLVQELKAVLRTPPGALVLAVGGGGLLAGVVAGLLEVGWQHVPIIAMETHGAHCFNAAITAGKLVTLPDITSVAKSLGAKTVAARALECMQVCKIHSEVVEDTEAVSAVQQLLDDERMLVEPACGAALAAIYSGLLRRLQAEGCLPPSLTSVVVIVCGGNNINSRELQALKTHLGQV,./data/raw/alphafold//AF-Q96GA7-F1-model_v4.pdb,3089,1850,3477,2288 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+1657,9957,10107,MNVFSIFSLVFLAAFGSCADDRRSALEECFREADYEEFLEIARNGLKKTSNPKHVVVVGAGMAGLSAAYVLAGAGHRVTLLEASDRVGGRVNTYRDEKEGWYVNMGPMRLPERHRIVRTYIAKFGLKLNEFFQENENAWYFIRNIRKRVWEVKKDPGVFKYPVKPSEEGKSASQLYRESLKKVIEELKRTNCSYILDKYDTYSTKEYLIKEGNLSRGAVDMIGDLLNEDSSYYLSFIESLKNDDLFSYEKRFDEISDGFDQLPKSMHQAIAEMVHLNAQVIKIQRDAEKVRVAYQTPAKTLSYVTADYVIVCATSRAVRRISFEPPLPPKKAHALRSIHYKSATKIFLTCTRKFWEADGIHGGKSTTDLPSRFIYYPNHNFTSGVGVIVAYVLADDSDFFQALDIKTSADIVINDLSLIHQLPKNEIQALCYPSLIKKWSLDKYTMGALTSFTPYQFQDYIETVAAPVGRIYFAGEYTATVHGWLDSTIKSGLTAARNVNRASQKPSRIHLINDNQL,sabio,A8QL52,CSCCC(N)C(=O)O.O.O=O>>CSCCC(=O)C(=O)O.N.OO,589.33,0.0,25.0,8.5,1.4.3.2,8613.0,2.770358549533692,CSCCC(N)C(=O)O.O.O=O,CSCCC(=O)C(=O)O.N.OO,2.770358549533692,CSCCC(N)C(=O)O.O.O=O__MNVFSIFSLVFLAAFGSCADDRRSALEECFREADYEEFLEIARNGLKKTSNPKHVVVVGAGMAGLSAAYVLAGAGHRVTLLEASDRVGGRVNTYRDEKEGWYVNMGPMRLPERHRIVRTYIAKFGLKLNEFFQENENAWYFIRNIRKRVWEVKKDPGVFKYPVKPSEEGKSASQLYRESLKKVIEELKRTNCSYILDKYDTYSTKEYLIKEGNLSRGAVDMIGDLLNEDSSYYLSFIESLKNDDLFSYEKRFDEISDGFDQLPKSMHQAIAEMVHLNAQVIKIQRDAEKVRVAYQTPAKTLSYVTADYVIVCATSRAVRRISFEPPLPPKKAHALRSIHYKSATKIFLTCTRKFWEADGIHGGKSTTDLPSRFIYYPNHNFTSGVGVIVAYVLADDSDFFQALDIKTSADIVINDLSLIHQLPKNEIQALCYPSLIKKWSLDKYTMGALTSFTPYQFQDYIETVAAPVGRIYFAGEYTATVHGWLDSTIKSGLTAARNVNRASQKPSRIHLINDNQL,./data/raw/alphafold//AF-A8QL52-F1-model_v4.pdb,1381,1496,3067,1822 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+1673,12464,12634,MARCERLRGAALRDVLGRAQGVLFDCDGVLWNGERAVPGAPELLERLARAGKAALFVSNNSRRARPELALRFARLGFGGLRAEQLFSSALCAARLLRQRLPGPPDAPGAVFVLGGEGLRAELRAAGLRLAGDPSAGDGAAPRVRAVLVGYDEHFSFAKLREACAHLRDPECLLVATDRDPWHPLSDGSRTPGTGSLAAAVETASGRQALVVGKPSPYMFECITENFSIDPARTLMVGDRLETDILFGHRCGMTTVLTLTGVSRLEEAQAYLAAGQHDLVPHYYVESIADLTEGLED,brenda,Q96GD0,Cc1ncc(COP(=O)(O)O)c(C=O)c1O.O>>Cc1ncc(CO)c(C=O)c1O.O=P(O)(O)O,1.52,1.0698608523140284e-14,37.0,7.4,3.1.3.74,9606.0,0.1818435879447725,Cc1ncc(COP(=O)(O)O)c(C=O)c1O.O,Cc1ncc(CO)c(C=O)c1O.O=P(O)(O)O,0.1818435879447725,Cc1ncc(COP(=O)(O)O)c(C=O)c1O.O__MARCERLRGAALRDVLGRAQGVLFDCDGVLWNGERAVPGAPELLERLARAGKAALFVSNNSRRARPELALRFARLGFGGLRAEQLFSSALCAARLLRQRLPGPPDAPGAVFVLGGEGLRAELRAAGLRLAGDPSAGDGAAPRVRAVLVGYDEHFSFAKLREACAHLRDPECLLVATDRDPWHPLSDGSRTPGTGSLAAAVETASGRQALVVGKPSPYMFECITENFSIDPARTLMVGDRLETDILFGHRCGMTTVLTLTGVSRLEEAQAYLAAGQHDLVPHYYVESIADLTEGLED,./data/raw/alphafold//AF-Q96GD0-F1-model_v4.pdb,2106,4299,4184,4041 +1674,19369,19655,MTDSSLLRGCVRLVKIISLVACASTIVEAQAGPPDITKHVEVRRTAYGVPHIRADNMEAAGYGLGYVQIEDYGARVAMGLLHARGEMGRWFGPDSIEGDFSARLNYETAVQGYPTLDSDTRAIYDGFAEGVNRYIELHPEEFPGGFTPRFTGYDVLAHEVSDASARQAARFLGRIDPAARRRRAADENVAIIAPIAGGQDPPDVGSNAWAFAPSRTKSGHSILLRNPHLNWNSGYYEAQLTVPGVMDFYGDFRVGSPFGVVGGFNRDLGWSTTNNAPLLSQIYSLDVDSTQTDHYLLDGASIPLQRQLTSVEFRNGNGLSSETRETWRTTLGPVIYRGNGKVYVLKAAGDGDVRGGEQFLRMMRSHSLAEWKDAMRMRARITSNFTYADRAGNILYVWNASIPKLPLPSGGDTAAVPITRTSEAWTSFVPFDSLPQLLNPKGGYVENSNDPPYFTNLQQPLDRSKYPAYFPELRLGLRQQLALDLINNERKLNLQDVLALKQSYRMLLADRVRDDLVKEVRASNPSPDVAKAIDMIARWDKTVAPASRGGVLFEMWWRKYIDHTRPDTMYAVQWTAKAPASTPTGIRFPDRSVDAFKWAVDETTRRFGAPDVAWGDVHRVRVGKVDVPVGGCNGDIGCFRVLWYKDDPDGKREATGGDGWILAVQFDNEPQAYSILAYGESSREDSPHHSDQAAMFARGEMKRVYWMDKDVDAQTVERYRPGEKR,brenda,D6R1Q1,O.O=C(O)c1cc(N=C(O)Cc2ccccc2)ccc1[N+](=O)[O-]>>Nc1ccc([N+](=O)[O-])c(C(=O)O)c1.O=C(O)Cc1ccccc1,58.3,8.915635751495215e-15,37.0,7.4,3.5.1.11,77133.0,1.765668554759014,O.O=C(O)c1cc(N=C(O)Cc2ccccc2)ccc1[N+](=O)[O-],Nc1ccc([N+](=O)[O-])c(C(=O)O)c1.O=C(O)Cc1ccccc1,1.765668554759014,O.O=C(O)c1cc(N=C(O)Cc2ccccc2)ccc1[N+](=O)[O-]__MTDSSLLRGCVRLVKIISLVACASTIVEAQAGPPDITKHVEVRRTAYGVPHIRADNMEAAGYGLGYVQIEDYGARVAMGLLHARGEMGRWFGPDSIEGDFSARLNYETAVQGYPTLDSDTRAIYDGFAEGVNRYIELHPEEFPGGFTPRFTGYDVLAHEVSDASARQAARFLGRIDPAARRRRAADENVAIIAPIAGGQDPPDVGSNAWAFAPSRTKSGHSILLRNPHLNWNSGYYEAQLTVPGVMDFYGDFRVGSPFGVVGGFNRDLGWSTTNNAPLLSQIYSLDVDSTQTDHYLLDGASIPLQRQLTSVEFRNGNGLSSETRETWRTTLGPVIYRGNGKVYVLKAAGDGDVRGGEQFLRMMRSHSLAEWKDAMRMRARITSNFTYADRAGNILYVWNASIPKLPLPSGGDTAAVPITRTSEAWTSFVPFDSLPQLLNPKGGYVENSNDPPYFTNLQQPLDRSKYPAYFPELRLGLRQQLALDLINNERKLNLQDVLALKQSYRMLLADRVRDDLVKEVRASNPSPDVAKAIDMIARWDKTVAPASRGGVLFEMWWRKYIDHTRPDTMYAVQWTAKAPASTPTGIRFPDRSVDAFKWAVDETTRRFGAPDVAWGDVHRVRVGKVDVPVGGCNGDIGCFRVLWYKDDPDGKREATGGDGWILAVQFDNEPQAYSILAYGESSREDSPHHSDQAAMFARGEMKRVYWMDKDVDAQTVERYRPGEKR,./data/raw/alphafold//AF-D6R1Q1-F1-model_v4.pdb,1460,996,809,1127 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+1711,16887,17117,MKRRLTNLEVLLTVTTSLFAVCCVCLIVVSCIGLKPEGAAQPVQLTGQMVITAGAAFSEELRNSSSHFFKSLAFDVQQLVSDAFGASELRLLYRSFRVLYFRPGSIAVTFDLEFNQQIDLNEVKQQLGEGLQQIEDGALVIDVDSIQITVKPSSTTPQPTPTTGHITTETMPITGHTTPAATPTAASCPPDHSLCWDRSTCVLTDVLCDGVSDCPDASDENSSRCATTCDGQFVLGGPNGTFRSSETETYRNNSNCRWIIRMDGGLSVQVNFHHFETEEYSDVLKLYEGVGPHKQLAAELSGPSPPGTVLLLNNQVTVEFTSDGVNDLSGFRASYAAVNTSSLSNQEKLSCSFDQGFCFWRQLQDSFDTWIRTNVPTFPPLTGPNFDHTFGNSSGFYIVTSLSPGQWLKSFVINSLPLAPSSHPTCLSFWYHMFGEDVYRLRVLLRPSQPELTEVVLFHKEGNFGDNWNYAQITLNLSTESTVVFEAQKEGGNQNDIALDDISLRSEGCGPAPPEPTNVPLPTTAAPIPPDCGGPFDLWEPNSTFTSPNYPQSYGDRAECLWTLHAEKGQNIQLHFLDFDVEATYDVVEVRDGAGLNSTLLAVLSGSDGPTHDLYSTDNQMTVWFYTDSGGFGRGFRANFTSGVNLGSQAPCANGQFQCQTGDCIHGDRQCDGVADCPDGYDEADCVALQVNGSHRLHFRLLHSLLTVCADTWDSELSDFTCQYLGYRSGEESLQPVLPQDAAFAVVTVSSNGTLETQVRETCSSGEVISLNCSNQPCGQRQVYNSKENNGVPRVVGGVNAEKGAWPWMVSLHWRGRHGCGASLIGRDWLLTAAHCVYGKNTHLQYWSAVLGLHAQSSMNSQEVQIRQVDRIIINKNYNRRTKEADIAMMHLQQPVNFTEWVLPVCLASEDQHFPAGRRCFIAGWGRDAEGGSLPDILQEAEVPLVDQDECQRLLPEYTFTSSMLCAGYPEGGVDSCQGDSGGPLMCLEDARWTLIGVTSFGVGCGRPERPGAYARVSAFTSWIAETRRSSFSDLD,brenda,A4UWM5,NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(O)=Nc1ccc2ccccc2c1.O>>NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(=O)O.Nc1ccc2ccccc2c1,27.9,7.041324896078328e-15,30.0,8.3,3.4.21.9,8090.0,1.4456042032735976,NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(O)=Nc1ccc2ccccc2c1.O,NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(=O)O.Nc1ccc2ccccc2c1,1.4456042032735976,NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(O)=Nc1ccc2ccccc2c1.O__MKRRLTNLEVLLTVTTSLFAVCCVCLIVVSCIGLKPEGAAQPVQLTGQMVITAGAAFSEELRNSSSHFFKSLAFDVQQLVSDAFGASELRLLYRSFRVLYFRPGSIAVTFDLEFNQQIDLNEVKQQLGEGLQQIEDGALVIDVDSIQITVKPSSTTPQPTPTTGHITTETMPITGHTTPAATPTAASCPPDHSLCWDRSTCVLTDVLCDGVSDCPDASDENSSRCATTCDGQFVLGGPNGTFRSSETETYRNNSNCRWIIRMDGGLSVQVNFHHFETEEYSDVLKLYEGVGPHKQLAAELSGPSPPGTVLLLNNQVTVEFTSDGVNDLSGFRASYAAVNTSSLSNQEKLSCSFDQGFCFWRQLQDSFDTWIRTNVPTFPPLTGPNFDHTFGNSSGFYIVTSLSPGQWLKSFVINSLPLAPSSHPTCLSFWYHMFGEDVYRLRVLLRPSQPELTEVVLFHKEGNFGDNWNYAQITLNLSTESTVVFEAQKEGGNQNDIALDDISLRSEGCGPAPPEPTNVPLPTTAAPIPPDCGGPFDLWEPNSTFTSPNYPQSYGDRAECLWTLHAEKGQNIQLHFLDFDVEATYDVVEVRDGAGLNSTLLAVLSGSDGPTHDLYSTDNQMTVWFYTDSGGFGRGFRANFTSGVNLGSQAPCANGQFQCQTGDCIHGDRQCDGVADCPDGYDEADCVALQVNGSHRLHFRLLHSLLTVCADTWDSELSDFTCQYLGYRSGEESLQPVLPQDAAFAVVTVSSNGTLETQVRETCSSGEVISLNCSNQPCGQRQVYNSKENNGVPRVVGGVNAEKGAWPWMVSLHWRGRHGCGASLIGRDWLLTAAHCVYGKNTHLQYWSAVLGLHAQSSMNSQEVQIRQVDRIIINKNYNRRTKEADIAMMHLQQPVNFTEWVLPVCLASEDQHFPAGRRCFIAGWGRDAEGGSLPDILQEAEVPLVDQDECQRLLPEYTFTSSMLCAGYPEGGVDSCQGDSGGPLMCLEDARWTLIGVTSFGVGCGRPERPGAYARVSAFTSWIAETRRSSFSDLD,./data/raw/alphafold//AF-A4UWM5-F1-model_v4.pdb,1919,4060,1914,3743 +1712,12202,12366,MTVKISHTAEVQDLIKEAAGFNSDQGSPRLKQLMHRLISDAFKIIEDLEVTEDEFWLAVDRLNKVGAHAEFGLLLPGLSMEHFMDLLQDAKDQQIGLAGGTPRTIEGPLYVANAPLSEGFARMDDGSEDDVGIPLFIKGTVLNTDGKPVAGAIVDLWHANTNGTYSYFDESQSAFNLRRRIKTDAEGRYTARSIIPSGYGVNPEGPTQECLSALGRHGQRPAHIHVFVSAPEHRHLTSQINLAGDKYLWDDFAYATREGLVGEARLLDNADASKAHGLDGRQFAELEFDFVLQPAVNADDEHRSQRPRAGQ,brenda,Q0VH42,Cc1cccc(O)c1O.O=O>>C/C(=C/C=C\C(=O)O)C(=O)O,2.3,9.072476308408618e-15,25.0,6.4,1.13.11.1,395598.0,0.3617278360175928,Cc1cccc(O)c1O.O=O,C/C(=C/C=C\C(=O)O)C(=O)O,0.3617278360175928,Cc1cccc(O)c1O.O=O__MTVKISHTAEVQDLIKEAAGFNSDQGSPRLKQLMHRLISDAFKIIEDLEVTEDEFWLAVDRLNKVGAHAEFGLLLPGLSMEHFMDLLQDAKDQQIGLAGGTPRTIEGPLYVANAPLSEGFARMDDGSEDDVGIPLFIKGTVLNTDGKPVAGAIVDLWHANTNGTYSYFDESQSAFNLRRRIKTDAEGRYTARSIIPSGYGVNPEGPTQECLSALGRHGQRPAHIHVFVSAPEHRHLTSQINLAGDKYLWDDFAYATREGLVGEARLLDNADASKAHGLDGRQFAELEFDFVLQPAVNADDEHRSQRPRAGQ,./data/raw/alphafold//AF-Q0VH42-F1-model_v4.pdb,2001,4155,4026,3871 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+1747,10226,10377,MILIKNVFVNGKRQDILIEGNKIKKIGEVKKEEIENAEIIDGKNKIAIPGLINTHTHIPMTLFRGVADDLPLMEWLNNYIWPMEAKLNEEIVYWGTLLGCIEMIRSGTTTFNDMYFFLEGIAKAVDESGMRAVLAYGMIDLFDEERRERELKNAEKYINYINSLNNSRIMPALGPHAPYTCSKELLMEVNNLAKKYNVPIHIHLNETLDEIKMVKEKTGMEPFIYLNSFGFFDDVRAIAAHCVHLTDEEIKIMKQKNINVSHNPISNLKLASGVAPIPKLLAEGINVTLGTDGCGSNNNLNLFEEIKVSAILHKGVNLNPTVVKAEEAFNFATKNGAKALNIKAGEIREGYLADIVLINLDKPYLYPKENIMSHLVYAFNGFVDDVIIDGNIVMRDGEILTVDEEKVYEKAEEMYEILRS,brenda,Q58936,CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.O>>CSC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O.N,160.0,0.0,60.0,9.0,3.5.4.31,2190.0,2.204119982655925,CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.O,CSC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O.N,2.204119982655925,CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.O__MILIKNVFVNGKRQDILIEGNKIKKIGEVKKEEIENAEIIDGKNKIAIPGLINTHTHIPMTLFRGVADDLPLMEWLNNYIWPMEAKLNEEIVYWGTLLGCIEMIRSGTTTFNDMYFFLEGIAKAVDESGMRAVLAYGMIDLFDEERRERELKNAEKYINYINSLNNSRIMPALGPHAPYTCSKELLMEVNNLAKKYNVPIHIHLNETLDEIKMVKEKTGMEPFIYLNSFGFFDDVRAIAAHCVHLTDEEIKIMKQKNINVSHNPISNLKLASGVAPIPKLLAEGINVTLGTDGCGSNNNLNLFEEIKVSAILHKGVNLNPTVVKAEEAFNFATKNGAKALNIKAGEIREGYLADIVLINLDKPYLYPKENIMSHLVYAFNGFVDDVIIDGNIVMRDGEILTVDEEKVYEKAEEMYEILRS,./data/raw/alphafold//AF-Q58936-F1-model_v4.pdb,3588,3597,1386,3347 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+1789,16599,16828,MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFVGKNDGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEESAGKATITLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,sabio,Q83U23,NC(Cc1ccccc1)C(O)=NCC(=O)O.O>>NC(Cc1ccccc1)C(=O)O.NCC(=O)O,394.0,0.0,37.0,7.5,3.4.13.-,44688.0,2.595496221825574,NC(Cc1ccccc1)C(O)=NCC(=O)O.O,NC(Cc1ccccc1)C(=O)O.NCC(=O)O,2.595496221825574,NC(Cc1ccccc1)C(O)=NCC(=O)O.O__MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFVGKNDGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEESAGKATITLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,./data/raw/alphafold//AF-Q83U23-F1-model_v4.pdb,1801,1476,3046,1796 +1790,21889,22218,MAKEIVKELLPLIRVYKDGSVERLLSSENVAASPEDPQTGVSSKDIVIADNPYVSARIFLPKSHHTNNKLPIFLYFHGGAFCVESAFSFFVHRYLNILASEANIIAISVDFRLLPHHPIPAAYEDGWTTLKWIASHANNTNTTNPEPWLLNHADFTKVYVGGETSGANIAHNLLLRAGNESLPGDLKILGGLLCCPFFWGSKPIGSEAVEGHEQSLAMKVWNFACPDAPGGIDNPWINPCVPGAPSLATLACSKLLVTITGKDEFRDRDILYHHTVEQSGWQGELQLFDAGDEEHAFQLFKPETHLAKAMIKRLASFLV,brenda,Q5NUF3,O=C1c2ccc(O)cc2OC(O)C1c1ccc(O)cc1>>O.O=c1c(-c2ccc(O)cc2)coc2cc(O)ccc12,5.3,0.0,30.0,7.5,4.2.1.105,3847.0,0.724275869600789,O=C1c2ccc(O)cc2OC(O)C1c1ccc(O)cc1,O.O=c1c(-c2ccc(O)cc2)coc2cc(O)ccc12,0.724275869600789,O=C1c2ccc(O)cc2OC(O)C1c1ccc(O)cc1__MAKEIVKELLPLIRVYKDGSVERLLSSENVAASPEDPQTGVSSKDIVIADNPYVSARIFLPKSHHTNNKLPIFLYFHGGAFCVESAFSFFVHRYLNILASEANIIAISVDFRLLPHHPIPAAYEDGWTTLKWIASHANNTNTTNPEPWLLNHADFTKVYVGGETSGANIAHNLLLRAGNESLPGDLKILGGLLCCPFFWGSKPIGSEAVEGHEQSLAMKVWNFACPDAPGGIDNPWINPCVPGAPSLATLACSKLLVTITGKDEFRDRDILYHHTVEQSGWQGELQLFDAGDEEHAFQLFKPETHLAKAMIKRLASFLV,./data/raw/alphafold//AF-Q5NUF3-F1-model_v4.pdb,3558,3516,1288,3237 +1791,12429,12599,MFTGIVQGTAKLVSIDEKPNFRTHVVELPDHMLDGLETGASVAHNGCCLTVTEINGNHVSFDLMKETLRITNLGDLKVGDWVNVERAAKFSDEIGGHLMSGHIMTTAEVAKILTSENNRQIWFKVQDSQLMKYILYKGFIGIDGISLTVGEVTPTRFCVHLIPETLERTTLGKKKLGARVNIEIDPQTQAVVDTVERVLAARENAMNQPGTEA,sabio,P0AFU8,Cc1nc2c(=O)[nH]c(=O)nc-2n(CC(O)C(O)C(O)CO)c1C>>Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(CC(O)C(O)C(O)CO)c2cc1C.Nc1c(NCC(O)C(O)C(O)CO)[nH]c(=O)[nH]c1=O,30.0,33.29931719403588,20.0,6.9,2.5.1.9,562.0,1.4771212547196624,Cc1nc2c(=O)[nH]c(=O)nc-2n(CC(O)C(O)C(O)CO)c1C,Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(CC(O)C(O)C(O)CO)c2cc1C.Nc1c(NCC(O)C(O)C(O)CO)[nH]c(=O)[nH]c1=O,1.4771212547196624,Cc1nc2c(=O)[nH]c(=O)nc-2n(CC(O)C(O)C(O)CO)c1C__MFTGIVQGTAKLVSIDEKPNFRTHVVELPDHMLDGLETGASVAHNGCCLTVTEINGNHVSFDLMKETLRITNLGDLKVGDWVNVERAAKFSDEIGGHLMSGHIMTTAEVAKILTSENNRQIWFKVQDSQLMKYILYKGFIGIDGISLTVGEVTPTRFCVHLIPETLERTTLGKKKLGARVNIEIDPQTQAVVDTVERVLAARENAMNQPGTEA,./data/raw/alphafold//AF-P0AFU8-F1-model_v4.pdb,2095,4286,4170,4026 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+1842,4004,4057,MKFLLILLLQATASGALPLNSSTSLEKNNVLFGERYLEKFYGLEINKLPVTKMKYSGNLMKEKIQEMQHFLGLKVTGQLDTSTLEMMHAPRCGVPDVHHFREMPGGPVWRKHYITYRINNYTPDMNREDVDYAIRKAFQVWSNVTPLKFSKINTGMADILVVFARGAHGDFHAFDGKGGILAHAFGPGSGIGGDAHFDEDEFWTTHSGGTNLFLTAVHEIGHSLGLGHSSDPKAVMFPTYKYVDINTFRLSADDIRGIQSLYGDPKENQRLPNPDNSEPALCDPNLSFDAVTTVGNKIFFFKDRFFWLKVSERPKTSVNLISSLWPTLPSGIEAAYEIEARNQVFLFKDDKYWLISNLRPEPNYPKSIHSFGFPNFVKKIDAAVFNPRFYRTYFFVDNQYWRYDERRQMMDPGYPKLITKNFQGIGPKIDAVFYSKNKYYYFFQGSNQFEYDFLLQRITKTLKSNSWFGC,brenda,P39900,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>CC(C)C[C@H](N)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N=C(O)c1ccccc1N)C(O)=N[C@@H](C)C(=O)O,2.8,3.1468815131586015e-14,30.0,7.5,3.4.24.65,9606.0,0.4471580313422192,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,CC(C)C[C@H](N)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N=C(O)c1ccccc1N)C(O)=N[C@@H](C)C(=O)O,0.4471580313422192,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MKFLLILLLQATASGALPLNSSTSLEKNNVLFGERYLEKFYGLEINKLPVTKMKYSGNLMKEKIQEMQHFLGLKVTGQLDTSTLEMMHAPRCGVPDVHHFREMPGGPVWRKHYITYRINNYTPDMNREDVDYAIRKAFQVWSNVTPLKFSKINTGMADILVVFARGAHGDFHAFDGKGGILAHAFGPGSGIGGDAHFDEDEFWTTHSGGTNLFLTAVHEIGHSLGLGHSSDPKAVMFPTYKYVDINTFRLSADDIRGIQSLYGDPKENQRLPNPDNSEPALCDPNLSFDAVTTVGNKIFFFKDRFFWLKVSERPKTSVNLISSLWPTLPSGIEAAYEIEARNQVFLFKDDKYWLISNLRPEPNYPKSIHSFGFPNFVKKIDAAVFNPRFYRTYFFVDNQYWRYDERRQMMDPGYPKLITKNFQGIGPKIDAVFYSKNKYYYFFQGSNQFEYDFLLQRITKTLKSNSWFGC,./data/raw/alphafold//AF-P39900-F1-model_v4.pdb,3567,1559,3144,1915 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+1886,9611,9757,MKLCSLAVLVPIVLFCEQHVFAFQSGQVLAALPRTSRQVQVLQNLTTTYEIVLWQPVTADLIVKKKQVHFFVNASDVDNVKAHLNVSGIPCSVLLADVEDLIQQQISNDTVSPRASASYYEQYHSLNEIYSWIEFITERHPDMLTKIHIGSSFEKYPLYVLKVSGKEQAAKNAIWIDCGIHAREWISPAFCLWFIGHITQFYGIIGQYTNLLRLVDFYVMPVVNVDGYDYSWKKNRMWRKNRSFYANNHCIGTDLNRNFASKHWCEEGASSSSCSETYCGLYPESEPEVKAVASFLRRNINQIKAYISMHSYSQHIVFPYSYTRSKSKDHEELSLVASEAVRAIEKISKNTRYTHGHGSETLYLAPGGGDDWIYDLGIKYSFTIELRDTGTYGFLLPERYIKPTCREAFAAVSKIAWHVIRNV,uniprot_search,Q96IY4,COc1ccc(/N=N/C(O)=N[C@@H](CCCCN)C(=O)O)cc1.O>>COc1ccc(/N=N/C(=O)O)cc1.NCCCC[C@H](N)C(=O)O,15.9,8.695563274745534e-15,22.75,7.808333333333333,3.4.17.20,9606.0,1.2013971243204515,COc1ccc(/N=N/C(O)=N[C@@H](CCCCN)C(=O)O)cc1.O,COc1ccc(/N=N/C(=O)O)cc1.NCCCC[C@H](N)C(=O)O,1.469822015978163,COc1ccc(/N=N/C(O)=N[C@@H](CCCCN)C(=O)O)cc1.O__MKLCSLAVLVPIVLFCEQHVFAFQSGQVLAALPRTSRQVQVLQNLTTTYEIVLWQPVTADLIVKKKQVHFFVNASDVDNVKAHLNVSGIPCSVLLADVEDLIQQQISNDTVSPRASASYYEQYHSLNEIYSWIEFITERHPDMLTKIHIGSSFEKYPLYVLKVSGKEQAAKNAIWIDCGIHAREWISPAFCLWFIGHITQFYGIIGQYTNLLRLVDFYVMPVVNVDGYDYSWKKNRMWRKNRSFYANNHCIGTDLNRNFASKHWCEEGASSSSCSETYCGLYPESEPEVKAVASFLRRNINQIKAYISMHSYSQHIVFPYSYTRSKSKDHEELSLVASEAVRAIEKISKNTRYTHGHGSETLYLAPGGGDDWIYDLGIKYSFTIELRDTGTYGFLLPERYIKPTCREAFAAVSKIAWHVIRNV,./data/raw/alphafold//AF-Q96IY4-F1-model_v4.pdb,3735,4437,3205,1980 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+1888,22088,22421,MGHPEEVDVIVCGGGPAGCVVAGRLAYADPTLKVMLIEGGANNRDDPWVYRPGIYVRNMQRNGINDKATFYTDTMASSYLRGRRSIVPCANILGGGSSINFQMYTRASASDWDDFKTEGWTCKDLLPLMKRLENYQKPCNNDTHGYDGPIAISNGGQIMPVAQDFLRAAHAIGVPYSDDIQDLTTAHGAEIWAKYINRHTGRRSDAATAYVHSVMDVQDNLFLRCNARVSRVLFDDNNKAVGVAYVPSRNRTHGGKLHETIVKARKMVVLSSGTLGTPQILERSGVGNGELLRQLGIKIVSDLPGVGEQYQDHYTTLSIYRVSNESITTDDFLRGVKDVQRELFTEWEVSPEKARLSSNAIDAGFKIRPTEEELKEMGPEFNELWNRYFKDKPDKPVMFGSIVAGAYADHTLLPPGKYITMFQYLEYPASRGKIHIKSQNPYVEPFFDSGFMNNKADFAPIRWSYKKTREVARRMDAFRGELTSHHPRFHPASPAACKDIDIETAKQIYPDGLTVGIHMGSWHQPSEPYKHDKVIEDIPYTEEDDKAIDDWVADHVETTWHSLGTCAMKPREQGGVVDKRLNVYGTQNLKCVDLSICPDNLGTNTYSSALLVGEKGADLIAEELGLKIKTPHAPVPHAPVPTGRPATQQVR,brenda,T2M2J4,O=O.OCCCCO>>O=C1CCCO1.OO,6.74,0.8288655724763967,23.0,7.5,1.1.3.13,2822231.0,0.8286598965353198,O=O.OCCCCO,O=C1CCCO1.OO,0.8286598965353198,O=O.OCCCCO__MGHPEEVDVIVCGGGPAGCVVAGRLAYADPTLKVMLIEGGANNRDDPWVYRPGIYVRNMQRNGINDKATFYTDTMASSYLRGRRSIVPCANILGGGSSINFQMYTRASASDWDDFKTEGWTCKDLLPLMKRLENYQKPCNNDTHGYDGPIAISNGGQIMPVAQDFLRAAHAIGVPYSDDIQDLTTAHGAEIWAKYINRHTGRRSDAATAYVHSVMDVQDNLFLRCNARVSRVLFDDNNKAVGVAYVPSRNRTHGGKLHETIVKARKMVVLSSGTLGTPQILERSGVGNGELLRQLGIKIVSDLPGVGEQYQDHYTTLSIYRVSNESITTDDFLRGVKDVQRELFTEWEVSPEKARLSSNAIDAGFKIRPTEEELKEMGPEFNELWNRYFKDKPDKPVMFGSIVAGAYADHTLLPPGKYITMFQYLEYPASRGKIHIKSQNPYVEPFFDSGFMNNKADFAPIRWSYKKTREVARRMDAFRGELTSHHPRFHPASPAACKDIDIETAKQIYPDGLTVGIHMGSWHQPSEPYKHDKVIEDIPYTEEDDKAIDDWVADHVETTWHSLGTCAMKPREQGGVVDKRLNVYGTQNLKCVDLSICPDNLGTNTYSSALLVGEKGADLIAEELGLKIKTPHAPVPHAPVPTGRPATQQVR,./data/raw/alphafold//AF-T2M2J4-F1-model_v4.pdb,3563,3417,1155,2310 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+1890,8414,8545,MTGITRRRLLSLGAGAAFLTAIRPFDSIAQDAHMGHGAASSATATAGRPLPLPPLIEPDASGVVELKVQTGRHSFEEGSEAASAGINGAYLGPLVRLKNGETVTLSVENGMDEETTLHWHGLFVPSALDGGPHNLIAAGAEWKPKVTVNQPASFNWFHPHLHGNTARQAHMGIAGLMVVTDGKDAERGLPEDYGVDDIPLVLQDRRVIEGDKVYQPDIMDLMHGFRGDKLIVNGVVSPEARVPASIVRLRILNGANARNFHIRLSDNRPLLVIASDGGFIGKPEAVERLTISPGERYEVLVDFSKGEAADLLTYGDDSGGDDLHLMRFVVDSTLRGKITAVPDRLDGPDAADEKLSVKRRSFFFDERMAENMKLMMAKPSADPHAGHNMGNMDMSSMSSAMDHDMHGARTSADAGPALEALTSGVEMAIAGKPFDMDRIDVEAKLGSWEIWDLTTKEMPHPFHIHGASFRILSLNGKAPPAHQSGWKDTALIDGKAEILVHFDREGAKSHPFMFHCHVLEHEDVGMMAQFVTV,sabio,E2GIP7,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O>>CCn1/c(=N/N=C2/Sc3cc(S(=O)(=O)[O-])ccc3[N+]2CC)sc2cc(S(=O)(=O)[O-])ccc21.O,2.95,1.4837780463171737,37.0,3.6,1.10.3.2,866894.0,0.469822015978163,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O,CCn1/c(=N/N=C2/Sc3cc(S(=O)(=O)[O-])ccc3[N+]2CC)sc2cc(S(=O)(=O)[O-])ccc21.O,0.469822015978163,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O__MTGITRRRLLSLGAGAAFLTAIRPFDSIAQDAHMGHGAASSATATAGRPLPLPPLIEPDASGVVELKVQTGRHSFEEGSEAASAGINGAYLGPLVRLKNGETVTLSVENGMDEETTLHWHGLFVPSALDGGPHNLIAAGAEWKPKVTVNQPASFNWFHPHLHGNTARQAHMGIAGLMVVTDGKDAERGLPEDYGVDDIPLVLQDRRVIEGDKVYQPDIMDLMHGFRGDKLIVNGVVSPEARVPASIVRLRILNGANARNFHIRLSDNRPLLVIASDGGFIGKPEAVERLTISPGERYEVLVDFSKGEAADLLTYGDDSGGDDLHLMRFVVDSTLRGKITAVPDRLDGPDAADEKLSVKRRSFFFDERMAENMKLMMAKPSADPHAGHNMGNMDMSSMSSAMDHDMHGARTSADAGPALEALTSGVEMAIAGKPFDMDRIDVEAKLGSWEIWDLTTKEMPHPFHIHGASFRILSLNGKAPPAHQSGWKDTALIDGKAEILVHFDREGAKSHPFMFHCHVLEHEDVGMMAQFVTV,./data/raw/alphafold//AF-E2GIP7-F1-model_v4.pdb,3416,2308,1018,2913 +1891,8555,8687,MDPIQLLFYVNGQKVVEKNVDPEMMLLPYLRKNLRLTGTKYGCGGGGCGACTVMISRYNPSTKAIRHHPVNACLTPICSLHGTAVTTVEGLGNTRTRLHPIQERIAKCHGTQCGFCTPGMVMSMYALLRNHPEPTLDQLTDALGGNLCRCTGYRPIIDACKTFCKASACCQSKENGVCCLDQEINGLAESQEEDKTSPELFSEEEFLPLDPTQELIFPPELMRIAEKQPPKTRVFYGERVTWISPVTLKELVEAKFKYPQAPIVMGYTSVGPEVKFKGVFHPIIISPDRIEELGVISQARDGLTLGAGLSLDQVKDILADIVQKLPEEKTQTYRALLKHLRTLAGSQIRNMASLGGHIVSRHLDSDLNPLLAVGNCTLNLLSKDGERRIPLSEEFLRKCPEADLKPQEVLVSVNIPWSRKWEFVSAFRQAQRQQNALAIVNSGMRVLFREGGGVIEELSILYGGVGSTIISAKNSCQRLIGRPWNEGMLDTRCRLVLDEVTLAASAPGGKVEFKRTLIISFLFKFYLEVSQGLKREDPGHSPSLAGNHESALDDLHSKHPWRTLTHQNVDPAQLPQDPIGRPIMHLSGIKHATGEAIYCDDMPAVDRELFLTFVTSSRAHAKIVSIDLSEALSLPGVVDIITADHLQEANTFGTETFLATDEVHCVGHLVCAVIADSETRAKQAAKQVKVVYQDLAPLILTIEEAIQHKSFFKSERKLECGNVDEAFKIVDQILEGEIHIGGQEHFYMETQSMLVVPKGEDGEIDIYVSTQFPKYIQDIVAATLKLSANKVMCHVRRVGGAFGGKVGKTSILAAITAFAASKHGRAVRCILERGEDMLITGGRHPYLGKYKAGFMNEGRILALDVEHYCNGGCSLDESLWVIEMGLLKLDNAYKFPNLRCRGWACRTNLPSNTALRGFGFPQAGLVTEACITEVAIKCGLSPEQVRTINMYKHVDTTHYKQEFSAKALSECWRECMAKCSYFERKAAIGKFNAENSWKKRGMAVIPLKFPVGIGSVAMGQAAALVHIYLDGSALVSHGGIEMGQGVHTKMIQVVSRELRMPMSSVHLRGTSTETVPNTNASGGSVVADLNGLAVKDACQTLLKRLEPIISKNPQGTWKDWAQTAFDQSISLSAVGYFRGYESNIDWEKGEGHPFEYFVFGAACSEVEINCLTGDHKNIRTNIVMDVGHSINPALDIGQVEGAFIQGMGLYTIEELSYSPQGTLYSRGPNQYKIPAICDIPTEMHISFLPPSEHSNTLYSSKGLGESGVFLGCSVFFAIHDAVKAARQERGISGPWKLNSPLTPEKIRMACEDKFTKMIPRDEPGSYVPCNIPV,brenda,O54754,CN(Cc1cnc2nc(=N)[nH]c(N)c2n1)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1.O.O=O>>CN(Cc1nc2c(N)[nH]c(=N)[nH]c-2nc1=O)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1.OO,84.0,1.1257014191383082e-14,37.0,7.5,1.2.3.1,9986.0,1.9242792860618816,CN(Cc1cnc2nc(=N)[nH]c(N)c2n1)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1.O.O=O,CN(Cc1nc2c(N)[nH]c(=N)[nH]c-2nc1=O)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1.OO,1.9242792860618816,CN(Cc1cnc2nc(=N)[nH]c(N)c2n1)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1.O.O=O__MDPIQLLFYVNGQKVVEKNVDPEMMLLPYLRKNLRLTGTKYGCGGGGCGACTVMISRYNPSTKAIRHHPVNACLTPICSLHGTAVTTVEGLGNTRTRLHPIQERIAKCHGTQCGFCTPGMVMSMYALLRNHPEPTLDQLTDALGGNLCRCTGYRPIIDACKTFCKASACCQSKENGVCCLDQEINGLAESQEEDKTSPELFSEEEFLPLDPTQELIFPPELMRIAEKQPPKTRVFYGERVTWISPVTLKELVEAKFKYPQAPIVMGYTSVGPEVKFKGVFHPIIISPDRIEELGVISQARDGLTLGAGLSLDQVKDILADIVQKLPEEKTQTYRALLKHLRTLAGSQIRNMASLGGHIVSRHLDSDLNPLLAVGNCTLNLLSKDGERRIPLSEEFLRKCPEADLKPQEVLVSVNIPWSRKWEFVSAFRQAQRQQNALAIVNSGMRVLFREGGGVIEELSILYGGVGSTIISAKNSCQRLIGRPWNEGMLDTRCRLVLDEVTLAASAPGGKVEFKRTLIISFLFKFYLEVSQGLKREDPGHSPSLAGNHESALDDLHSKHPWRTLTHQNVDPAQLPQDPIGRPIMHLSGIKHATGEAIYCDDMPAVDRELFLTFVTSSRAHAKIVSIDLSEALSLPGVVDIITADHLQEANTFGTETFLATDEVHCVGHLVCAVIADSETRAKQAAKQVKVVYQDLAPLILTIEEAIQHKSFFKSERKLECGNVDEAFKIVDQILEGEIHIGGQEHFYMETQSMLVVPKGEDGEIDIYVSTQFPKYIQDIVAATLKLSANKVMCHVRRVGGAFGGKVGKTSILAAITAFAASKHGRAVRCILERGEDMLITGGRHPYLGKYKAGFMNEGRILALDVEHYCNGGCSLDESLWVIEMGLLKLDNAYKFPNLRCRGWACRTNLPSNTALRGFGFPQAGLVTEACITEVAIKCGLSPEQVRTINMYKHVDTTHYKQEFSAKALSECWRECMAKCSYFERKAAIGKFNAENSWKKRGMAVIPLKFPVGIGSVAMGQAAALVHIYLDGSALVSHGGIEMGQGVHTKMIQVVSRELRMPMSSVHLRGTSTETVPNTNASGGSVVADLNGLAVKDACQTLLKRLEPIISKNPQGTWKDWAQTAFDQSISLSAVGYFRGYESNIDWEKGEGHPFEYFVFGAACSEVEINCLTGDHKNIRTNIVMDVGHSINPALDIGQVEGAFIQGMGLYTIEELSYSPQGTLYSRGPNQYKIPAICDIPTEMHISFLPPSEHSNTLYSSKGLGESGVFLGCSVFFAIHDAVKAARQERGISGPWKLNSPLTPEKIRMACEDKFTKMIPRDEPGSYVPCNIPV,./data/raw/alphafold//AF-O54754-F1-model_v4.pdb,1051,609,276,303 +1892,7561,7683,MTSSSSEHPQIPLPLKPIPGSYGFPIFGPIIDRYHYFYIQGRETFFRSRMAKYNSTVFRTNMPPGPFISSNSKVIVLLDALTFPILFDTTKVEKRNVLDGTYMPSLAFTGGIRTCAFLDPSETEHSVLKRHFLKFLASRHHQFIPLFRTSISEMFDKLEKELQNNNVANFNPISDYASFDFIFRLLSDRSPDKNFSSEGPGLVDRWLTMQLAPLATLGLPKIFSCFEDLIIHTFRLPFALVKSAYRKLYESFYESSGSFLDEAEKQGINREKACHNLVFLAGFNAYAGMKVLLPILLNWVGSAGEELHRKLVGEIRAAVKIDGGITFGALEKMSLLKSVVYEVLRIDPPVPYQYAKAKQDIVIESHDSAFEIKKGEMIFGYQPIATKDPKVFENAEEFVGERFVGEKGEKLLKYVYWSNGRETEEPTAENKQCPARDLVVLMCRVVLVELFLRYDTFTVEGTRSSLGWSVKVKSLTKA,brenda,A0A0A0K2U8,CCCCC[C@@H](/C=C/C=C\CCCCCCCC(=O)O)OO>>CCCCC[C@@H]1O/C1=C/C=C\CCCCCCCC(=O)O.O,752.4,0.0,23.0,7.0,4.2.1.92,3659.0,2.876448786878341,CCCCC[C@@H](/C=C/C=C\CCCCCCCC(=O)O)OO,CCCCC[C@@H]1O/C1=C/C=C\CCCCCCCC(=O)O.O,2.876448786878341,CCCCC[C@@H](/C=C/C=C\CCCCCCCC(=O)O)OO__MTSSSSEHPQIPLPLKPIPGSYGFPIFGPIIDRYHYFYIQGRETFFRSRMAKYNSTVFRTNMPPGPFISSNSKVIVLLDALTFPILFDTTKVEKRNVLDGTYMPSLAFTGGIRTCAFLDPSETEHSVLKRHFLKFLASRHHQFIPLFRTSISEMFDKLEKELQNNNVANFNPISDYASFDFIFRLLSDRSPDKNFSSEGPGLVDRWLTMQLAPLATLGLPKIFSCFEDLIIHTFRLPFALVKSAYRKLYESFYESSGSFLDEAEKQGINREKACHNLVFLAGFNAYAGMKVLLPILLNWVGSAGEELHRKLVGEIRAAVKIDGGITFGALEKMSLLKSVVYEVLRIDPPVPYQYAKAKQDIVIESHDSAFEIKKGEMIFGYQPIATKDPKVFENAEEFVGERFVGEKGEKLLKYVYWSNGRETEEPTAENKQCPARDLVVLMCRVVLVELFLRYDTFTVEGTRSSLGWSVKVKSLTKA,./data/raw/alphafold//AF-A0A0A0K2U8-F1-model_v4.pdb,3119,1891,3527,2346 +1893,14421,14624,MTKNIAQAAVKFEQWQPKIEQESYLTINSLECHTGGEPLRIITSGFPVLKGNTILAKANDCKQNYDQLRRALMFEPRGHADMYGAIITDAERDDSHFGAVFIHNEGYSSMCGHAVIALTKTAVESGVVARTGDVTQVVIDVPCGQIYAMAYSHNNVVKHVSFQCVPSFVYAKDQQVEVDGIGMVQFDIAYGGAFYAYVQASSLGLSLVPEQQEKLIAYGRKIKQAIIPQFEINHPTTAELSFLYGVIFIDDSPNQDVHSRNVCIFADGELDRSPTGSGVSGRIALHHAKQQIVLNETITIESILASSFSVRAIETVCFAGFDAVIPEVTGDAYVCGKGQWFINAEDPLKYGFLLR,brenda,Q485S0,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O=C(O)[C@@H]1CCCN1>>N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=C(O)C1=NCCC1.[H+],1.01,0.0,30.0,8.5,1.5.1.49,28229.0,0.0043213737826425,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O=C(O)[C@@H]1CCCN1,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=C(O)C1=NCCC1.[H+],0.0043213737826425,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O=C(O)[C@@H]1CCCN1__MTKNIAQAAVKFEQWQPKIEQESYLTINSLECHTGGEPLRIITSGFPVLKGNTILAKANDCKQNYDQLRRALMFEPRGHADMYGAIITDAERDDSHFGAVFIHNEGYSSMCGHAVIALTKTAVESGVVARTGDVTQVVIDVPCGQIYAMAYSHNNVVKHVSFQCVPSFVYAKDQQVEVDGIGMVQFDIAYGGAFYAYVQASSLGLSLVPEQQEKLIAYGRKIKQAIIPQFEINHPTTAELSFLYGVIFIDDSPNQDVHSRNVCIFADGELDRSPTGSGVSGRIALHHAKQQIVLNETITIESILASSFSVRAIETVCFAGFDAVIPEVTGDAYVCGKGQWFINAEDPLKYGFLLR,./data/raw/alphafold//AF-Q485S0-F1-model_v4.pdb,3770,4562,4492,4391 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+1905,4605,4661,MTILVVTGTGTGVGKTVVCAALASAARQAGIDVAVCKPVQTGTARGDDDLAEVGRLAGVTQLAGLARYPQPMAPAAAAEHAGMALPARDQIVRLIADLDRPGRLTLVEGAGGLLVELAEPGVTLRDVAVDVAAAALVVVTADLGTLNHTKLTLEALAAQQVSCAGLVIGSWPDPPGLVAASNRSALARIAMVRAALPAGAASLDAGDFAAMSAAAFDRNWVAGLVG,brenda,P9WPQ5,CC(N)C(N)CCCCCC(=O)O.N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.O=C=O>>C[C@@H]1N=C(O)N[C@@H]1CCCCCC(=O)O.N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.O=P(O)(O)O,11.1,7.519358652206666e-15,37.0,7.5,6.3.3.3,1773.0,1.0453229787866574,CC(N)C(N)CCCCCC(=O)O.N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.O=C=O,C[C@@H]1N=C(O)N[C@@H]1CCCCCC(=O)O.N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.O=P(O)(O)O,1.0453229787866574,CC(N)C(N)CCCCCC(=O)O.N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.O=C=O__MTILVVTGTGTGVGKTVVCAALASAARQAGIDVAVCKPVQTGTARGDDDLAEVGRLAGVTQLAGLARYPQPMAPAAAAEHAGMALPARDQIVRLIADLDRPGRLTLVEGAGGLLVELAEPGVTLRDVAVDVAAAALVVVTADLGTLNHTKLTLEALAAQQVSCAGLVIGSWPDPPGLVAASNRSALARIAMVRAALPAGAASLDAGDFAAMSAAAFDRNWVAGLVG,./data/raw/alphafold//AF-P9WPQ5-F1-model_v4.pdb,2946,1681,3291,2090 +1906,16907,17137,MNTVSPAKKKVIIIGAGIAGLKAASTLHQNGIQDCLVLEARDRVGGRLQTVTGYQGRKYDIGASWHHDTLTNPLFLEEAQLSLNDGRTRFVFDDDNFIYIDEERGRVDHDKELLLEIVDNEMSKFAELEFHQHLGVSDCSFFQLVMKYLLQRRQFLTNDQIRYLPQLCRYLELWHGLDWKLLSAKDTYFGHQGRNAFALNYDSVVQRIAQSFPQNWLKLSCEVKSITREPSKNVTVNCEDGTVYNADYVIITVPQSVLNLSVQPEKNLRGRIEFQPPLKPVIQDAFDKIHFGALGKVIFEFEECCWSNESSKIVTLANSTNEFVEIVRNAENLDELDSMLEREDSQKHTSVTCWSQPLFFVNLSKSTGVASFMMLMQAPLTNHIESIREDKERLFSFFQPVLNKIMKCLDSEDVIDGMRPIENIANANKPVLRNIIVSNWTRDPYSRGAYSACFPGDDPVDMVVAMSNGQDSRIRFAGEHTIMDGAGCAYGAWESGRREATRISDLLK,brenda,P50264,NCCCNCCCCNCCCN.O.O=O>>NCCC=O.NCCCCNCCCN.OO,39.0,1.6860212270714514e-14,25.0,9.3,1.5.3.17,4932.0,1.591064607026499,NCCCNCCCCNCCCN.O.O=O,NCCC=O.NCCCCNCCCN.OO,1.591064607026499,NCCCNCCCCNCCCN.O.O=O__MNTVSPAKKKVIIIGAGIAGLKAASTLHQNGIQDCLVLEARDRVGGRLQTVTGYQGRKYDIGASWHHDTLTNPLFLEEAQLSLNDGRTRFVFDDDNFIYIDEERGRVDHDKELLLEIVDNEMSKFAELEFHQHLGVSDCSFFQLVMKYLLQRRQFLTNDQIRYLPQLCRYLELWHGLDWKLLSAKDTYFGHQGRNAFALNYDSVVQRIAQSFPQNWLKLSCEVKSITREPSKNVTVNCEDGTVYNADYVIITVPQSVLNLSVQPEKNLRGRIEFQPPLKPVIQDAFDKIHFGALGKVIFEFEECCWSNESSKIVTLANSTNEFVEIVRNAENLDELDSMLEREDSQKHTSVTCWSQPLFFVNLSKSTGVASFMMLMQAPLTNHIESIREDKERLFSFFQPVLNKIMKCLDSEDVIDGMRPIENIANANKPVLRNIIVSNWTRDPYSRGAYSACFPGDDPVDMVVAMSNGQDSRIRFAGEHTIMDGAGCAYGAWESGRREATRISDLLK,./data/raw/alphafold//AF-P50264-F1-model_v4.pdb,2966,1708,3321,2124 +1907,7560,7682,MMAKMTGSPSVTPLSPPSPSPPSPSSLPLRAIPGGYGWPVVGPIIDRLNYFWFQGPPTFFKKRMEKYKSTVFRTNVPPTFPWFLGVNPNVIAVLDVKSFSHLFDMEIVEKANVLVGDFMPSVKYTGDFRVCAYLDTSEAKHTQIKNFSLDILKRSSTIWVPSLISSLDSMWDKIDADVANSGSASSFLPMQQFLFRFLTRCIVGADPSTSPEIASSGHIMLDKWLGIQILPTVNIGILQPLEELFLHSFSYPFWLVKGDYNKLVQFVEKEGKEVIQRAQTEFNLTEQEAIHNLLFILGFNAFGGFTIFFLALLSAIGDQKSTGLHEKLRDEVRQKSGSNSNTLSFESVKDMELVQSFVYETLRLNPPVPSQFARARKDFKLTSHDAVYEIKKGELLCGYQPLVMKDAKVFEESPATFLYDRFTREKGGTELLNYLYWSNGPQTGSATAANKQCAAKEIVPLTAALFVAYLFQRYDDITISSGSITAVEKSK,brenda,G8XQN2,CCCCC[C@@H](/C=C/C=C\CCCCCCCC(=O)O)OO>>CCCCC[C@@H]1O/C1=C/C=C\CCCCCCCC(=O)O.O,42.0,0.0,25.0,7.5,4.2.1.92,4146.0,1.6232492903979006,CCCCC[C@@H](/C=C/C=C\CCCCCCCC(=O)O)OO,CCCCC[C@@H]1O/C1=C/C=C\CCCCCCCC(=O)O.O,2.126780577012009,CCCCC[C@@H](/C=C/C=C\CCCCCCCC(=O)O)OO__MMAKMTGSPSVTPLSPPSPSPPSPSSLPLRAIPGGYGWPVVGPIIDRLNYFWFQGPPTFFKKRMEKYKSTVFRTNVPPTFPWFLGVNPNVIAVLDVKSFSHLFDMEIVEKANVLVGDFMPSVKYTGDFRVCAYLDTSEAKHTQIKNFSLDILKRSSTIWVPSLISSLDSMWDKIDADVANSGSASSFLPMQQFLFRFLTRCIVGADPSTSPEIASSGHIMLDKWLGIQILPTVNIGILQPLEELFLHSFSYPFWLVKGDYNKLVQFVEKEGKEVIQRAQTEFNLTEQEAIHNLLFILGFNAFGGFTIFFLALLSAIGDQKSTGLHEKLRDEVRQKSGSNSNTLSFESVKDMELVQSFVYETLRLNPPVPSQFARARKDFKLTSHDAVYEIKKGELLCGYQPLVMKDAKVFEESPATFLYDRFTREKGGTELLNYLYWSNGPQTGSATAANKQCAAKEIVPLTAALFVAYLFQRYDDITISSGSITAVEKSK,./data/raw/alphafold//AF-G8XQN2-F1-model_v4.pdb,3119,1889,3528,2347 +1908,21487,21811,MFADHVFHVVDTHTEGEPTRIVLSGVNVKGEDIIEKREYFKEHYDWIRTALLHEPRGHSDQFGAVLVPSDIADFGVIYMDTSGYLDMCGHATMGVATVLVELGIIEKKEPYTTVKLETPAGLVEAKAKVKGGVVKEVTVVDVPSFYVGEFVIEYPGRGKIKVDVAFGGNFYVIADARDLGLRVRREYIKELIPTALKLIKVANEQIKVQHPRKGVQNRINLAMLTDEPEREDSDGKNVVIWGEGSVDRSPCGTGSASRVATLYSKGILKEGDIFVHESILGTQFRIKIVGTTKIGEYTAIIPEITGSAYITKISQDIISKNDPLWKGFLLR,brenda,H3ZMH5,O=C(O)[C@@H]1CCCN1>>O=C(O)[C@H]1CCCN1,2.78,0.0,50.0,8.0,5.1.1.4,2265.0,0.4440447959180762,O=C(O)[C@@H]1CCCN1,O=C(O)[C@H]1CCCN1,0.4440447959180762,O=C(O)[C@@H]1CCCN1__MFADHVFHVVDTHTEGEPTRIVLSGVNVKGEDIIEKREYFKEHYDWIRTALLHEPRGHSDQFGAVLVPSDIADFGVIYMDTSGYLDMCGHATMGVATVLVELGIIEKKEPYTTVKLETPAGLVEAKAKVKGGVVKEVTVVDVPSFYVGEFVIEYPGRGKIKVDVAFGGNFYVIADARDLGLRVRREYIKELIPTALKLIKVANEQIKVQHPRKGVQNRINLAMLTDEPEREDSDGKNVVIWGEGSVDRSPCGTGSASRVATLYSKGILKEGDIFVHESILGTQFRIKIVGTTKIGEYTAIIPEITGSAYITKISQDIISKNDPLWKGFLLR,./data/raw/alphafold//AF-H3ZMH5-F1-model_v4.pdb,664,45,5755,6657 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+2046,16746,16976,MSVLTRASLVEYNLLPIGKGADISKVIVDAYAKSGREAVCVLNVSEIERHYNIWKTHLPEVQVRYAVKCNMHPLLLRSLHLLGAGFDCASPAEVRAALSAGCPPSKIIYANPQKPKRSIEEAFRLNCNTFTFDSEHELLSMLESTPPGKVGRFVLRLLPPDESSSICRFGVKFGASPSECYRLIRLCKHLGANLVGFSFHVGSGCGSVDSFRLAVQYMGEAAKFAKEQGFTLTVLNIGGGYMSKGAERHYDEPNRHAHITPPSFEEIASALREEINRIKVYFTNKSEDLEIMAEPGRFFAGDIMTLGTRIYGRRIIFDKIEDNSCLTEKEIMESGKASINEVKYYVGDGVYGYYNAILFDHVVPHLRFTDKHGNRKELSGAHAGSSLNTSSIFGPTCDSLDCILKERKLPLLDVGDWVITDAFGAYTYAAATEFNGIPHVSVVCCIEE,sabio,A8BFD3,NCCCC(N)C(=O)O>>NCCCCN.O=C=O,8.6,0.0,37.0,8.0,4.1.1.17,5741.0,0.9344984512435676,NCCCC(N)C(=O)O,NCCCCN.O=C=O,0.9344984512435676,NCCCC(N)C(=O)O__MSVLTRASLVEYNLLPIGKGADISKVIVDAYAKSGREAVCVLNVSEIERHYNIWKTHLPEVQVRYAVKCNMHPLLLRSLHLLGAGFDCASPAEVRAALSAGCPPSKIIYANPQKPKRSIEEAFRLNCNTFTFDSEHELLSMLESTPPGKVGRFVLRLLPPDESSSICRFGVKFGASPSECYRLIRLCKHLGANLVGFSFHVGSGCGSVDSFRLAVQYMGEAAKFAKEQGFTLTVLNIGGGYMSKGAERHYDEPNRHAHITPPSFEEIASALREEINRIKVYFTNKSEDLEIMAEPGRFFAGDIMTLGTRIYGRRIIFDKIEDNSCLTEKEIMESGKASINEVKYYVGDGVYGYYNAILFDHVVPHLRFTDKHGNRKELSGAHAGSSLNTSSIFGPTCDSLDCILKERKLPLLDVGDWVITDAFGAYTYAAATEFNGIPHVSVVCCIEE,./data/raw/alphafold//AF-A8BFD3-F1-model_v4.pdb,2707,3811,2393,5295 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+2048,7414,7536,MIRRCFQVAARLGHHRGLLEAPRILPRLNPASAFGSSTDSMFSRFLPEKTDLKDYALPNASWCSDMLSLYQEFLEKTKSSGWIKLPSFKSNRDHIRGLKLPSGLAVSSDKGDCRIFTRCIQVEGQGFEYVIFFQPTQKKSVCLFQPGSYLEGPPGFAHGGSLAAMMDETFSKTAFLAGEGLFTLSLNIRFKNLIPVDSLVVMDVELDKIEDQKLYMSCIAHSRDQQTVYAKSSGVFLQLQLEEESPQ,sabio,Q8N1Q8,CCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O.O>>CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS.CCCCCCCCCCCCCCCC(=O)O,16.6,2.2194252003544465e-14,37.0,7.5,3.1.2.2,9606.0,1.2201080880400552,CCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O.O,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS.CCCCCCCCCCCCCCCC(=O)O,1.2201080880400552,CCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O.O__MIRRCFQVAARLGHHRGLLEAPRILPRLNPASAFGSSTDSMFSRFLPEKTDLKDYALPNASWCSDMLSLYQEFLEKTKSSGWIKLPSFKSNRDHIRGLKLPSGLAVSSDKGDCRIFTRCIQVEGQGFEYVIFFQPTQKKSVCLFQPGSYLEGPPGFAHGGSLAAMMDETFSKTAFLAGEGLFTLSLNIRFKNLIPVDSLVVMDVELDKIEDQKLYMSCIAHSRDQQTVYAKSSGVFLQLQLEEESPQ,./data/raw/alphafold//AF-Q8N1Q8-F1-model_v4.pdb,3117,1886,3520,2339 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+2071,260,272,MTAFGVEPYGQPKYLEIAGKRMAYIDEGKGDAIVFQHGNPTSSYLWRNIMPHLEGLGRLVACDLIGMGASDKLSPSGPDRYSYGEQRDFLFALWDTLDLGDHVVLVLHDWGSALGFDWANQHRDRVQGIAFMEAIVTPMTWADWPPAVRGVFQGFRSPQGEPMALEHNIFVERVLPGAILRQLSDEEMNHYRRPFVNGGEDRRPTLSWPRNLPIDGEPAEVVALVNEYRSWLEETDMPKLFINAEPGAIITGRIRDYVRSWPNQTEITVPGVHFVQEDSPEEIGAAIAQFVRQLRSAAGV,brenda,Q9XB14,BrCCCBr.O>>OCCCBr.[Br-],9.2,0.2291950886766734,32.5,7.25,3.8.1.5,1765.0,0.9637878273455552,BrCCCBr.O,OCCCBr.[Br-],0.9637878273455552,BrCCCBr.O__MTAFGVEPYGQPKYLEIAGKRMAYIDEGKGDAIVFQHGNPTSSYLWRNIMPHLEGLGRLVACDLIGMGASDKLSPSGPDRYSYGEQRDFLFALWDTLDLGDHVVLVLHDWGSALGFDWANQHRDRVQGIAFMEAIVTPMTWADWPPAVRGVFQGFRSPQGEPMALEHNIFVERVLPGAILRQLSDEEMNHYRRPFVNGGEDRRPTLSWPRNLPIDGEPAEVVALVNEYRSWLEETDMPKLFINAEPGAIITGRIRDYVRSWPNQTEITVPGVHFVQEDSPEEIGAAIAQFVRQLRSAAGV,./data/raw/alphafold//AF-Q9XB14-F1-model_v4.pdb,2119,535,189,204 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+2175,18857,19137,MIDIHCHILPAMDDGAGDSADSIEMARAAVRQGIRTIIATPHHNNGVYKNEPAAVREAADQLNKRLIKEDIPLHVLPGQEIRIYGEVEQDLAKRQLLSLNDTKYILIEFPFDHVPRYAEQLFYDLQLKGYIPVIAHPERNREIRENPSLLYHLVEKGAASQITSGSLAGIFGKQLKAFSLRLVEANLIHFVASDAHNVKTRNFHTQEALYVLEKEFGSELPYMLTENAELLLRNQTIFRQPPQPVKRRKLFGFF,sabio,P96717,O>>*NC(=O)C(Cc1ccc(O)cc1)NC(*)=O.O=P(O)(O)O,0.028,88.5430525045636,30.0,8.0,3.1.3.48,1423.0,-1.5528419686577808,O,*NC(=O)C(Cc1ccc(O)cc1)NC(*)=O.O=P(O)(O)O,-1.5528419686577808,O__MIDIHCHILPAMDDGAGDSADSIEMARAAVRQGIRTIIATPHHNNGVYKNEPAAVREAADQLNKRLIKEDIPLHVLPGQEIRIYGEVEQDLAKRQLLSLNDTKYILIEFPFDHVPRYAEQLFYDLQLKGYIPVIAHPERNREIRENPSLLYHLVEKGAASQITSGSLAGIFGKQLKAFSLRLVEANLIHFVASDAHNVKTRNFHTQEALYVLEKEFGSELPYMLTENAELLLRNQTIFRQPPQPVKRRKLFGFF,./data/raw/alphafold//AF-P96717-F1-model_v4.pdb,1164,2248,3908,1251,5955 +2180,21610,21935,MNSSNTGAPEAAQAATLEAFDRRAAEQYLRGQWIAEEHLMRAIGGPRPAGIPYRWEWKSVEVALDEATIALGPVDTARRHLTFVNPGLMDRGSATTHTISAGFQLVKPGEVCWSHRHTMSAVRFVTKGHPDAFTAVDGERLPMEDFDLLITPRFSWHDHHNSGDADVVWLDGLDIGLLQSLGAVFYEPYGDDSQNVRPSSSEGIGTRSHWLRPTWERGRESRLPIRYPWKEVNARLDVYDLDAGTPYDGLALRYANPVTGGPTMATMDCWVQRLAPGFDGKSHRRSSSAITYVISGSGTMVTEDETITFNRGDVISLPNWTNFRWTNDSEIEPVLLFSMHDIPALEAFGLLYEEPEAILNATPAPINPTPSLNPIYRPGAFYDQDEL,brenda,O24721,O=C(O)c1ccc2ccccc2c1O.O=O>>O=C(O)C(=O)/C=C\c1ccccc1C(=O)O,114.0,0.0,25.0,7.5,1.13.11.38,35761.0,2.0569048513364727,O=C(O)c1ccc2ccccc2c1O.O=O,O=C(O)C(=O)/C=C\c1ccccc1C(=O)O,2.0569048513364727,O=C(O)c1ccc2ccccc2c1O.O=O__MNSSNTGAPEAAQAATLEAFDRRAAEQYLRGQWIAEEHLMRAIGGPRPAGIPYRWEWKSVEVALDEATIALGPVDTARRHLTFVNPGLMDRGSATTHTISAGFQLVKPGEVCWSHRHTMSAVRFVTKGHPDAFTAVDGERLPMEDFDLLITPRFSWHDHHNSGDADVVWLDGLDIGLLQSLGAVFYEPYGDDSQNVRPSSSEGIGTRSHWLRPTWERGRESRLPIRYPWKEVNARLDVYDLDAGTPYDGLALRYANPVTGGPTMATMDCWVQRLAPGFDGKSHRRSSSAITYVISGSGTMVTEDETITFNRGDVISLPNWTNFRWTNDSEIEPVLLFSMHDIPALEAFGLLYEEPEAILNATPAPINPTPSLNPIYRPGAFYDQDEL,./data/raw/alphafold//AF-O24721-F1-model_v4.pdb,1469,2693,1143,4040,6702 +2214,17737,17980,MLLSKKSEYKTLSTVEHPQYIVFCDFDETYFPHTIDEQKQQDIYELEDYLEQKSKDGELIIGWVTGSSIESILDKMGRGKFRYFPHFIASDLGTEITYFSEHNFGQQDNKWNSRINEGFSKEKVEKLVKQLHENHNILLNPQTQLGKSRYKHNFYYQEQDEINDKKNLLAIEKICEEYGVSVNINRCNPLAGDPEDSYDVDFIPIGTGKNEIVTFMLEKYNLNTERAIAFGDSGNDVRMLQTVGNGYLLKNATQEAKNLHNLITDSEYSKGITNTLKKLIGS,brenda,O07565,N[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)OC(O)[C@@H]1O.O>>N[C@H]1[C@H](O)[C@@H](CO)OC(O)[C@@H]1O.O=P(O)(O)O,32.0,0.0,37.0,7.5,3.1.3.92,1423.0,1.505149978319906,N[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)OC(O)[C@@H]1O.O,N[C@H]1[C@H](O)[C@@H](CO)OC(O)[C@@H]1O.O=P(O)(O)O,1.505149978319906,N[C@H]1[C@H](O)[C@@H](COP(=O)(O)O)OC(O)[C@@H]1O.O__MLLSKKSEYKTLSTVEHPQYIVFCDFDETYFPHTIDEQKQQDIYELEDYLEQKSKDGELIIGWVTGSSIESILDKMGRGKFRYFPHFIASDLGTEITYFSEHNFGQQDNKWNSRINEGFSKEKVEKLVKQLHENHNILLNPQTQLGKSRYKHNFYYQEQDEINDKKNLLAIEKICEEYGVSVNINRCNPLAGDPEDSYDVDFIPIGTGKNEIVTFMLEKYNLNTERAIAFGDSGNDVRMLQTVGNGYLLKNATQEAKNLHNLITDSEYSKGITNTLKKLIGS,./data/raw/alphafold//AF-O07565-F1-model_v4.pdb,971,2016,3617,5245,5624 +2231,19942,20228,MEPAAAATVQRLPELGREDRASAPAAAAAAAAAAAAAAAALAAAAGGGRSPEPALTPAAPSGGNGSGSGAREEAPGEAPPGPLPGRAGGAGRRRRRGAPQPIAGGAAPVPGAGGGANSLLLRRGRLKRNLSAAAAAASSSSSSSAAAASHSPGAAGLPASCSASASLCTRSLDRKTLLLKHRQTLQLQPSDRDWVRHQLQRGCVHVFDRHMASTYLRPVLCTLDTTAGEVAARLLQLGHKGGGVVKVLGQGPGAAAAREPAEPPPEAGPRLAPPEPRDSEVPPARSAPGAFGGPPRAPPADLPLPVGGPGGWSRRASPAPSDSSPGEPFVGGPVSSPRAPRPVVSDTESFSLSPSAESVSDRLDPYSSGGGSSSSSEELEADAASAPTGVPGQPRRPGHPAQPLPLPQTASSPQPQQKAPRAIDSPGGAVREGSCEEKAAAAVAPGGLQSTPGRSGVTAEKAPPPPPPPTLYVQLHGETTRRLEAEEKPLQIQNDYLFQLGFGELWRVQEEGMDSEIGCLIRFYAGKPHSTGSSERIQLSGMYNVRKGKMQLPVNRWTRRQVILCGTCLIVSSVKDSLTGKMHVLPLIGGKVEEVKKHQHCLAFSSSGPQSQTYYICFDTFTEYLRWLRQVSKVASQRISSVDLSCCSLEHLPANLFYSQDLTHLNLKQNFLRQNPSLPAARGLNELQRFTKLKSLNLSNNHLGDFPLAVCSIPTLAELNVSCNALRSVPAAVGVMHNLQTFLLDGNFLQSLPAELENMKQLSYLGLSFNEFTDIPEVLEKLTAVDKLCMSGNCVETLRLQALRKMPHIKHVDLRLNVIRKLIADEVDFLQHVTQLDLRDNKLGDLDAMIFNNIEVLHCERNQLVTLDICGYFLKALYASSNELVQLDVYPVPNYLSYMDVSRNRLENVPEWVCESRKLEVLDIGHNQICELPARLFCNSSLRKLLAGHNQLARLPERLERTSVEVLDVQHNQLLELPPNLLMKADSLRFLNASANKLESLPPATLSEETNSILQELYLTNNSLTDKCVPLLTGHPHLKILHMAYNRLQSFPASKMAKLEELEEIDLSGNKLKAIPTTIMNCRRMHTVIAHSNCIEVFPEVMQLPEIKCVDLSCNELSEVTLPENLPPKLQELDLTGNPRLVLDHKTLELLNNIRCFKIDQPSTGDASGAPAVWSHGYTEASGVKNKLCVAALSVNNFCDNREALYGVFDGDRNVEVPYLLQCTMSDILAEELQKTKNEEEYMVNTFIVMQRKLGTAGQKLGGAAVLCHIKHDPVDPGGSFTLTSANVGKCQTVLCRNGKPLPLSRSYIMSCEEELKRIKQHKAIITEDGKVNGVTESTRILGYTFLHPSVVPRPHVQSVLLTPQDEFFILGSKGLWDSLSVEEAVEAVRNVPDALAAAKKLCTLAQSYGCHDSISAVVVQLSVTEDSFCCCELSAGGAVPPPSPGIFPPSVNMVIKDRPSDGLGVPSSSSGMASEISSELSTSEMSSEVGSTASDEPPPGALSENSPAYPSEQRCMLHPICLSNSFQRQLSSATFSSAFSDNGLDSDDEEPIEGVFTNGSRVEVEVDIHCSRAKEKEKQQHLLQVPAEASDEGIVISANEDEPGLPRKADFSAVGTIGRRRANGSVAPQERSHNVIEVATDAPLRKPGGYFAAPAQPDPDDQFIIPPELEEEVKEIMKHHQEQQQQQQPPPPPQLQPQLPRHYQLDQLPDYYDTPL,sabio,O60346,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1>>O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,0.0018,0.0,25.0,7.5,3.1.3.16,9606.0,-2.744727494896694,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,-2.744727494896694,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MEPAAAATVQRLPELGREDRASAPAAAAAAAAAAAAAAAALAAAAGGGRSPEPALTPAAPSGGNGSGSGAREEAPGEAPPGPLPGRAGGAGRRRRRGAPQPIAGGAAPVPGAGGGANSLLLRRGRLKRNLSAAAAAASSSSSSSAAAASHSPGAAGLPASCSASASLCTRSLDRKTLLLKHRQTLQLQPSDRDWVRHQLQRGCVHVFDRHMASTYLRPVLCTLDTTAGEVAARLLQLGHKGGGVVKVLGQGPGAAAAREPAEPPPEAGPRLAPPEPRDSEVPPARSAPGAFGGPPRAPPADLPLPVGGPGGWSRRASPAPSDSSPGEPFVGGPVSSPRAPRPVVSDTESFSLSPSAESVSDRLDPYSSGGGSSSSSEELEADAASAPTGVPGQPRRPGHPAQPLPLPQTASSPQPQQKAPRAIDSPGGAVREGSCEEKAAAAVAPGGLQSTPGRSGVTAEKAPPPPPPPTLYVQLHGETTRRLEAEEKPLQIQNDYLFQLGFGELWRVQEEGMDSEIGCLIRFYAGKPHSTGSSERIQLSGMYNVRKGKMQLPVNRWTRRQVILCGTCLIVSSVKDSLTGKMHVLPLIGGKVEEVKKHQHCLAFSSSGPQSQTYYICFDTFTEYLRWLRQVSKVASQRISSVDLSCCSLEHLPANLFYSQDLTHLNLKQNFLRQNPSLPAARGLNELQRFTKLKSLNLSNNHLGDFPLAVCSIPTLAELNVSCNALRSVPAAVGVMHNLQTFLLDGNFLQSLPAELENMKQLSYLGLSFNEFTDIPEVLEKLTAVDKLCMSGNCVETLRLQALRKMPHIKHVDLRLNVIRKLIADEVDFLQHVTQLDLRDNKLGDLDAMIFNNIEVLHCERNQLVTLDICGYFLKALYASSNELVQLDVYPVPNYLSYMDVSRNRLENVPEWVCESRKLEVLDIGHNQICELPARLFCNSSLRKLLAGHNQLARLPERLERTSVEVLDVQHNQLLELPPNLLMKADSLRFLNASANKLESLPPATLSEETNSILQELYLTNNSLTDKCVPLLTGHPHLKILHMAYNRLQSFPASKMAKLEELEEIDLSGNKLKAIPTTIMNCRRMHTVIAHSNCIEVFPEVMQLPEIKCVDLSCNELSEVTLPENLPPKLQELDLTGNPRLVLDHKTLELLNNIRCFKIDQPSTGDASGAPAVWSHGYTEASGVKNKLCVAALSVNNFCDNREALYGVFDGDRNVEVPYLLQCTMSDILAEELQKTKNEEEYMVNTFIVMQRKLGTAGQKLGGAAVLCHIKHDPVDPGGSFTLTSANVGKCQTVLCRNGKPLPLSRSYIMSCEEELKRIKQHKAIITEDGKVNGVTESTRILGYTFLHPSVVPRPHVQSVLLTPQDEFFILGSKGLWDSLSVEEAVEAVRNVPDALAAAKKLCTLAQSYGCHDSISAVVVQLSVTEDSFCCCELSAGGAVPPPSPGIFPPSVNMVIKDRPSDGLGVPSSSSGMASEISSELSTSEMSSEVGSTASDEPPPGALSENSPAYPSEQRCMLHPICLSNSFQRQLSSATFSSAFSDNGLDSDDEEPIEGVFTNGSRVEVEVDIHCSRAKEKEKQQHLLQVPAEASDEGIVISANEDEPGLPRKADFSAVGTIGRRRANGSVAPQERSHNVIEVATDAPLRKPGGYFAAPAQPDPDDQFIIPPELEEEVKEIMKHHQEQQQQQQPPPPPQLQPQLPRHYQLDQLPDYYDTPL,./data/raw/alphafold//AF-O60346-F1-model_v4.pdb,187,1944,647,1543,5284 +2242,12234,12402,MRSKYIVIEGLEGAGKTTARNVVVETLEQLGIRDMVFTREPGGTQLAEKLRSLVLDIKSVGDEVITDKAEVLMFYAARVQLVETVIKPALANGTWVIGDRHDLSTQAYQGGGRGIDQHMLATLRDAVLGDFRPDLTLYLDVTPEVGLKRARARGELDRIEQESFDFFNRTRARYLELAAQDKSIHTIDATQPLEAVMDAIRTTVTHWVKELDA,sabio,P0A720,Cc1cn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,10.5,0.0,30.0,7.4,2.7.4.9,562.0,1.021189299069938,Cc1cn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,1.021189299069938,Cc1cn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MRSKYIVIEGLEGAGKTTARNVVVETLEQLGIRDMVFTREPGGTQLAEKLRSLVLDIKSVGDEVITDKAEVLMFYAARVQLVETVIKPALANGTWVIGDRHDLSTQAYQGGGRGIDQHMLATLRDAVLGDFRPDLTLYLDVTPEVGLKRARARGELDRIEQESFDFFNRTRARYLELAAQDKSIHTIDATQPLEAVMDAIRTTVTHWVKELDA,./data/raw/alphafold//AF-P0A720-F1-model_v4.pdb,376,3085,966,468,3801 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+2175,18857,19137,MIDIHCHILPAMDDGAGDSADSIEMARAAVRQGIRTIIATPHHNNGVYKNEPAAVREAADQLNKRLIKEDIPLHVLPGQEIRIYGEVEQDLAKRQLLSLNDTKYILIEFPFDHVPRYAEQLFYDLQLKGYIPVIAHPERNREIRENPSLLYHLVEKGAASQITSGSLAGIFGKQLKAFSLRLVEANLIHFVASDAHNVKTRNFHTQEALYVLEKEFGSELPYMLTENAELLLRNQTIFRQPPQPVKRRKLFGFF,sabio,P96717,O>>*NC(=O)C(Cc1ccc(O)cc1)NC(*)=O.O=P(O)(O)O,0.028,88.5430525045636,30.0,8.0,3.1.3.48,1423.0,-1.5528419686577808,O,*NC(=O)C(Cc1ccc(O)cc1)NC(*)=O.O=P(O)(O)O,-1.5528419686577808,O__MIDIHCHILPAMDDGAGDSADSIEMARAAVRQGIRTIIATPHHNNGVYKNEPAAVREAADQLNKRLIKEDIPLHVLPGQEIRIYGEVEQDLAKRQLLSLNDTKYILIEFPFDHVPRYAEQLFYDLQLKGYIPVIAHPERNREIRENPSLLYHLVEKGAASQITSGSLAGIFGKQLKAFSLRLVEANLIHFVASDAHNVKTRNFHTQEALYVLEKEFGSELPYMLTENAELLLRNQTIFRQPPQPVKRRKLFGFF,./data/raw/alphafold//AF-P96717-F1-model_v4.pdb,186,2697,5006,5856 +2180,21610,21935,MNSSNTGAPEAAQAATLEAFDRRAAEQYLRGQWIAEEHLMRAIGGPRPAGIPYRWEWKSVEVALDEATIALGPVDTARRHLTFVNPGLMDRGSATTHTISAGFQLVKPGEVCWSHRHTMSAVRFVTKGHPDAFTAVDGERLPMEDFDLLITPRFSWHDHHNSGDADVVWLDGLDIGLLQSLGAVFYEPYGDDSQNVRPSSSEGIGTRSHWLRPTWERGRESRLPIRYPWKEVNARLDVYDLDAGTPYDGLALRYANPVTGGPTMATMDCWVQRLAPGFDGKSHRRSSSAITYVISGSGTMVTEDETITFNRGDVISLPNWTNFRWTNDSEIEPVLLFSMHDIPALEAFGLLYEEPEAILNATPAPINPTPSLNPIYRPGAFYDQDEL,brenda,O24721,O=C(O)c1ccc2ccccc2c1O.O=O>>O=C(O)C(=O)/C=C\c1ccccc1C(=O)O,114.0,0.0,25.0,7.5,1.13.11.38,35761.0,2.0569048513364727,O=C(O)c1ccc2ccccc2c1O.O=O,O=C(O)C(=O)/C=C\c1ccccc1C(=O)O,2.0569048513364727,O=C(O)c1ccc2ccccc2c1O.O=O__MNSSNTGAPEAAQAATLEAFDRRAAEQYLRGQWIAEEHLMRAIGGPRPAGIPYRWEWKSVEVALDEATIALGPVDTARRHLTFVNPGLMDRGSATTHTISAGFQLVKPGEVCWSHRHTMSAVRFVTKGHPDAFTAVDGERLPMEDFDLLITPRFSWHDHHNSGDADVVWLDGLDIGLLQSLGAVFYEPYGDDSQNVRPSSSEGIGTRSHWLRPTWERGRESRLPIRYPWKEVNARLDVYDLDAGTPYDGLALRYANPVTGGPTMATMDCWVQRLAPGFDGKSHRRSSSAITYVISGSGTMVTEDETITFNRGDVISLPNWTNFRWTNDSEIEPVLLFSMHDIPALEAFGLLYEEPEAILNATPAPINPTPSLNPIYRPGAFYDQDEL,./data/raw/alphafold//AF-O24721-F1-model_v4.pdb,693,82,5795,6702 +2182,5036,5121,MRATLATLAVLALATAVQSDSRARIVCYFSNWAVYRPGVGRYGIEDIPVEKCTHIIYSFIGVTEGNSEVLIIDPELDVDKNGFRNFTSLRSSHPSVKFMVAVGGWAEGSSKYSHMVAQKSTRMSFIRSVVSFLKKYDFDGLDLDWEYPGAADRGGSFSDKDKFLYLVQELRRAFIRVGKGWELTAAVPLANFRLMEGYHVPELCQELDAIHVMSYDLRGNWAGFADVHSPLYKRPHDQWAYEKLNVNDGLHLWEEKGCPSNKLVVGIPFYGRSFTLSAGNNNYGLGTFINKEAGGGDPAPYTNATGFWAYYEICTEVDKDDSGWTKKWDEQGKCPYAYKGTQWVGYEDPRSVEIKMNWIKQKGYLGAMTWAIDMDDFQGLCGEKNPLIKILHKHMSSYTVPPPHTENTTPTPEWARPPSTPSDPSEGDPIPTTTTAKPASTTKTTVKTTTTTTAKPPQSVIDEENDINVRPEPKPEPQPEPEVEVPPTENEVDGSEICNSDQDYIPDKKHCDKYWRCVNGEAMQFSCQHGTVFNVELNVCDWPSNATRRECQQP,uniprot_search,P36362,CC(O)=N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3N=C(C)O)[C@H](O)[C@H]2N=C(C)O)[C@@H]1O.O>>CC(O)=N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3N=C(C)O)[C@H](O)[C@H]2N=C(C)O)[C@@H](CO)O[C@H]1O.Cc1cc(=O)oc2cc(O)ccc12,0.17,1.4135442131430816e-14,30.0,7.4,3.2.1.14,7130.0,-0.7695510786217261,CC(O)=N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3N=C(C)O)[C@H](O)[C@H]2N=C(C)O)[C@@H]1O.O,CC(O)=N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3N=C(C)O)[C@H](O)[C@H]2N=C(C)O)[C@@H](CO)O[C@H]1O.Cc1cc(=O)oc2cc(O)ccc12,-0.1191864077192086,CC(O)=N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3N=C(C)O)[C@H](O)[C@H]2N=C(C)O)[C@@H]1O.O__MRATLATLAVLALATAVQSDSRARIVCYFSNWAVYRPGVGRYGIEDIPVEKCTHIIYSFIGVTEGNSEVLIIDPELDVDKNGFRNFTSLRSSHPSVKFMVAVGGWAEGSSKYSHMVAQKSTRMSFIRSVVSFLKKYDFDGLDLDWEYPGAADRGGSFSDKDKFLYLVQELRRAFIRVGKGWELTAAVPLANFRLMEGYHVPELCQELDAIHVMSYDLRGNWAGFADVHSPLYKRPHDQWAYEKLNVNDGLHLWEEKGCPSNKLVVGIPFYGRSFTLSAGNNNYGLGTFINKEAGGGDPAPYTNATGFWAYYEICTEVDKDDSGWTKKWDEQGKCPYAYKGTQWVGYEDPRSVEIKMNWIKQKGYLGAMTWAIDMDDFQGLCGEKNPLIKILHKHMSSYTVPPPHTENTTPTPEWARPPSTPSDPSEGDPIPTTTTAKPASTTKTTVKTTTTTTAKPPQSVIDEENDINVRPEPKPEPQPEPEVEVPPTENEVDGSEICNSDQDYIPDKKHCDKYWRCVNGEAMQFSCQHGTVFNVELNVCDWPSNATRRECQQP,./data/raw/alphafold//AF-P36362-F1-model_v4.pdb,3074,1829,3456,2264 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diff --git a/datasets/splits/kcat-seq_test_sequence_80cluster.csv b/datasets/splits/kcat-seq_test_sequence_80cluster.csv new file mode 100644 index 0000000000000000000000000000000000000000..bde54c701cb569fadc88715ae0871c5a4e67d382 --- /dev/null +++ b/datasets/splits/kcat-seq_test_sequence_80cluster.csv @@ -0,0 +1,308 @@ +,Unnamed: 0,Unnamed: 0.1,sequence,sequence_source,uniprot,reaction_smiles,value,reaction_mw_diff_perc,temperature,ph,ec,taxonomy_id,log10_value,reactant_smiles,product_smiles,log10kcat_max,group,pdbpath,sequence_40cluster,sequence_60cluster,sequence_80cluster,sequence_99cluster 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+1239,16859,17089,MNIMKEKLAALETKLKAQEGKDGKKTNFQTEMNPHVVTWKLFAVSVLLLALYPSHAAAISLRDNLADCLEDRDYDKLLHIAEFGLPNINTSHHVVIAGAGMAGLTAAKLLKEAGHKVTILEASSRVGGRVETYRNEKEGWYAELGAMRIPSSHQIVRWYAKELGVKLNEFIMDDPNTFYLVNGVLEKTETVQKDPDVLKYHVEASEKGKSADELLQHALQKVQDEVEASGCRAALLKYDRYSVKDYLKEEGGLSSEAVRMLGDLLNQQSLMYTALSEMVYDQTDINDDVKYSEVTGGSDLLPKAFVDVLDELGVPILLNSTVKRISQSDKGVIVSYEKGQQSSLTDLTADVVLVTTTTKAALFMDFDPPLPIKKMEALRAAHYDSSTKILLTFSERFWEKDGIRGGKSITDGPSRYIYYPSHSFPTNKNIGVLLASYTWSDDSLLFLGASDEDLKELALRDLAKIHGEHVRSLCTGVLVKKWSMDPYSLGAFALFTPYQHLEFAKELFRSEGRVHFAGEHTAFPHAWIEASLKSAIRAATNINKESARSPHDEL,brenda,A1IGW6,NCCCC[C@H](N)C(=O)O.O.O=O>>N.NCCCCC(=O)C(=O)O.OO,20.4,7.224523629635546e-15,37.0,4.0,1.4.3.2,214486.0,1.3096301674258988,NCCCC[C@H](N)C(=O)O.O.O=O,N.NCCCCC(=O)C(=O)O.OO,1.3096301674258988,NCCCC[C@H](N)C(=O)O.O.O=O__MNIMKEKLAALETKLKAQEGKDGKKTNFQTEMNPHVVTWKLFAVSVLLLALYPSHAAAISLRDNLADCLEDRDYDKLLHIAEFGLPNINTSHHVVIAGAGMAGLTAAKLLKEAGHKVTILEASSRVGGRVETYRNEKEGWYAELGAMRIPSSHQIVRWYAKELGVKLNEFIMDDPNTFYLVNGVLEKTETVQKDPDVLKYHVEASEKGKSADELLQHALQKVQDEVEASGCRAALLKYDRYSVKDYLKEEGGLSSEAVRMLGDLLNQQSLMYTALSEMVYDQTDINDDVKYSEVTGGSDLLPKAFVDVLDELGVPILLNSTVKRISQSDKGVIVSYEKGQQSSLTDLTADVVLVTTTTKAALFMDFDPPLPIKKMEALRAAHYDSSTKILLTFSERFWEKDGIRGGKSITDGPSRYIYYPSHSFPTNKNIGVLLASYTWSDDSLLFLGASDEDLKELALRDLAKIHGEHVRSLCTGVLVKKWSMDPYSLGAFALFTPYQHLEFAKELFRSEGRVHFAGEHTAFPHAWIEASLKSAIRAATNINKESARSPHDEL,./data/raw/alphafold//AF-A1IGW6-F1-model_v4.pdb,1381,3828,2416,5325 +1244,7150,7271,MAPHRLRRLIPASVALTTVCAALPTSSAYAADTPPTPHLDSIERSLRETSPGLEGSVWQRTNGNRLDAPGDDPAGWLLQTPGCWGDPACKDRAGSRRLLDKMTRNIADAKRTVDISSLAPFPNGGFEDAIVAGLKASVAAGHSPRVRILVGAAPLYHLNVIPSRYRDELLGKLGSAAGKVTLNVASMTTSKTSFSWNHSKLLVVDGTTAVTGGINGWKDDYLDTTHPVSDVDMALTGPAARSAGKYLDTLWDWTCQNSSNPAKVWLATSNGASCMPSLEKEEDSTPAAPAGDVPVLAVGGLGVGIKESDPSSGYHPELPTAPDTKCTVGLHDNTNADRDYDTVNPEETALRSLIASARSHVEISQQDMNATCWPLPRYDIRTYDTLAAKLAAGVKVRIVVGDPANRGAVGSGGYSQIKSLDEISDTLRKRLVARTGDNEKASRAMCSNLQLASFRSSDSPTWADGKPYALHHKLVSVDDSAFYIGSKNLYPAWLQDFGYIVESPSAAKQLKTELLDPEWKYSQGAASTPAGCSGNGAG,brenda,A0A0E4B8Q4,CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC[N+](C)(C)C.O>>CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)O.C[N+](C)(C)CCO,4000.0,2.1873678074332173e-14,37.0,5.0,3.1.4.3,936074.0,3.6020599913279625,CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC[N+](C)(C)C.O,CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)O.C[N+](C)(C)CCO,3.6020599913279625,CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC[N+](C)(C)C.O__MAPHRLRRLIPASVALTTVCAALPTSSAYAADTPPTPHLDSIERSLRETSPGLEGSVWQRTNGNRLDAPGDDPAGWLLQTPGCWGDPACKDRAGSRRLLDKMTRNIADAKRTVDISSLAPFPNGGFEDAIVAGLKASVAAGHSPRVRILVGAAPLYHLNVIPSRYRDELLGKLGSAAGKVTLNVASMTTSKTSFSWNHSKLLVVDGTTAVTGGINGWKDDYLDTTHPVSDVDMALTGPAARSAGKYLDTLWDWTCQNSSNPAKVWLATSNGASCMPSLEKEEDSTPAAPAGDVPVLAVGGLGVGIKESDPSSGYHPELPTAPDTKCTVGLHDNTNADRDYDTVNPEETALRSLIASARSHVEISQQDMNATCWPLPRYDIRTYDTLAAKLAAGVKVRIVVGDPANRGAVGSGGYSQIKSLDEISDTLRKRLVARTGDNEKASRAMCSNLQLASFRSSDSPTWADGKPYALHHKLVSVDDSAFYIGSKNLYPAWLQDFGYIVESPSAAKQLKTELLDPEWKYSQGAASTPAGCSGNGAG,./data/raw/alphafold//AF-A0A0E4B8Q4-F1-model_v4.pdb,3295,2133,3806,2670 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diff --git a/datasets/splits/kcat-seq_test_sequence_99cluster.csv b/datasets/splits/kcat-seq_test_sequence_99cluster.csv new file mode 100644 index 0000000000000000000000000000000000000000..408ee628b2433f8ef1ccb35fc044b822043e105a --- /dev/null +++ b/datasets/splits/kcat-seq_test_sequence_99cluster.csv @@ -0,0 +1,350 @@ +,Unnamed: 0,Unnamed: 0.1,sequence,sequence_source,uniprot,reaction_smiles,value,reaction_mw_diff_perc,temperature,ph,ec,taxonomy_id,log10_value,reactant_smiles,product_smiles,log10kcat_max,group,pdbpath,sequence_40cluster,sequence_60cluster,sequence_80cluster,sequence_99cluster 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+61,5962,6065,MSEAEARPTNFIRQIIDEDLASGKHTTVHTRFPPEPNGYLHIGHAKSICLNFGIAQDYKGQCNLRFDDTNPVKEDIEYVESIKNDVEWLGFHWSGNVRYSSDYFDQLHAYAIELINKGLAYVDELTPEQIREYRGTLTQPGKNSPYRDRSVEENLALFEKMRAGGFEEGKACLRAKIDMASPFIVMRDPVLYRIKFAEHHQTGNKWCIYPMYDFTHCISDALEGITHSLCTLEFQDNRRLYDWVLDNITIPVHPRQYEFSRLNLEYTVMSKRKLNLLVTDKHVEGWDDPRMPTISGLRRRGYTAASIREFCKRIGVTKQDNTIEMASLESCIREDLNENAPRAMAVIDPVKLVIENYQGEGEMVTMPNHPNKPEMGSRQVPFSGEIWIDRADFREEANKQYKRLVLGKEVRLRNAYVIKAERVEKDAEGNITTIFCTYDADTLSKDPADGRKVKGVIHWVSAAHALPVEIRLYDRLFSVPNPGAADDFLSVINPESLVIKQGFAEPSLKDAVAGKAFQFEREGYFCLDSRHSTAEKPVFNRTVGLRDTWAKVGE,brenda,P00962,N=C(O)CC[C@H](N)C(O)=NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,0.0013,37.0,7.0,6.1.1.18,562.0,-2.886056647693163,-2.886056647693163,N=C(O)CC[C@H](N)C(O)=NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MSEAEARPTNFIRQIIDEDLASGKHTTVHTRFPPEPNGYLHIGHAKSICLNFGIAQDYKGQCNLRFDDTNPVKEDIEYVESIKNDVEWLGFHWSGNVRYSSDYFDQLHAYAIELINKGLAYVDELTPEQIREYRGTLTQPGKNSPYRDRSVEENLALFEKMRAGGFEEGKACLRAKIDMASPFIVMRDPVLYRIKFAEHHQTGNKWCIYPMYDFTHCISDALEGITHSLCTLEFQDNRRLYDWVLDNITIPVHPRQYEFSRLNLEYTVMSKRKLNLLVTDKHVEGWDDPRMPTISGLRRRGYTAASIREFCKRIGVTKQDNTIEMASLESCIREDLNENAPRAMAVIDPVKLVIENYQGEGEMVTMPNHPNKPEMGSRQVPFSGEIWIDRADFREEANKQYKRLVLGKEVRLRNAYVIKAERVEKDAEGNITTIFCTYDADTLSKDPADGRKVKGVIHWVSAAHALPVEIRLYDRLFSVPNPGAADDFLSVINPESLVIKQGFAEPSLKDAVAGKAFQFEREGYFCLDSRHSTAEKPVFNRTVGLRDTWAKVGE,./data/raw/alphafold//AF-P00962-F1-model_v4.pdb,695,2163,1584,168 +62,6030,6135,MNPTLILAAFCLGIASATLTFDHSLEAQWTKWKAMHNRLYGMNEEGWRRAVWEKNMKMIELHNQEYREGKHSFTMAMNAFGDMTSEEFRQVMNGFQNRKPRKGKVFQEPLFYEAPRSVDWREKGYVTPVKNQGQCGSCWAFSATGALEGQMFRKTGRLISLSEQNLVDCSGPQGNEGCNGGLMDYAFQYVQDNGGLDSEESYPYEATEESCKYNPKYSVANDTGFVDIPKQEKALMKAVATVGPISVAIDAGHESFLFYKEGIYFEPDCSSEDMDHGVLVVGYGFESTESDNNKYWLVKNSWGEEWGMGGYVKMAKDRRNHCGIASAASYPTV,uniprot_search,P07711,N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc1ccccc1)N=C(O)C1CCCCN1,0.0061,28.0,5.5,3.4.22.15,9606.0,-2.214670164989233,-2.214670164989233,N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc1ccccc1)N=C(O)C1CCCCN1__MNPTLILAAFCLGIASATLTFDHSLEAQWTKWKAMHNRLYGMNEEGWRRAVWEKNMKMIELHNQEYREGKHSFTMAMNAFGDMTSEEFRQVMNGFQNRKPRKGKVFQEPLFYEAPRSVDWREKGYVTPVKNQGQCGSCWAFSATGALEGQMFRKTGRLISLSEQNLVDCSGPQGNEGCNGGLMDYAFQYVQDNGGLDSEESYPYEATEESCKYNPKYSVANDTGFVDIPKQEKALMKAVATVGPISVAIDAGHESFLFYKEGIYFEPDCSSEDMDHGVLVVGYGFESTESDNNKYWLVKNSWGEEWGMGGYVKMAKDRRNHCGIASAASYPTV,./data/raw/alphafold//AF-P07711-F1-model_v4.pdb,372,1337,632,1962 +63,146,147,MSHLLVSPLGGGVQPRLEINNFVKNDRQFSLYVQALDRMYATPQNETASYFQVAGVHGYPLIPFDDAVGPTEFSPFDQWTGYCTHGSTLFPTWHRPYVLILEQILSGHAQQIADTYTVNKSEWKKAATEFRHPYWDWASNSVPPPEVISLPKVTITTPNGQKTSVANPLMRYTFNSVNDGGFYGPYNQWDTTLRQPDSTGVNAKDNVNRLKSVLKNAQASLTRATYDMFNRVTTWPHFSSHTPASGGSTSNSIEAIHDNIHVLVGGNGHMSDPSVAPFDPIFFLHHANVDRLIALWSAIRYDVWTSPGDAQFGTYTLRYKQSVDESTDLAPWWKTQNEYWKSNELRSTESLGYTYPEFVGLDMYNKDAVNKTISRKVAQLYGPQRGGQRSLVEDLSNSHARRSQRPAKRSRLGQLLKGLFSDWSAQIKFNRHEVGQSFSVCLFLGNVPEDPREWLVSPNLVGARHAFVRSVKTDHVAEEIGFIPINQWIAEHTGLPSFAVDLVKPLLAQGLQWRVLLADGTPAELDSLEVTILEVPSELTDDEPNPRSRPPRYHKDITHGKRGGCREA,sabio,Q00024,C(CCN)C[C@@H](C(=O)O)NC(=O)CN,33.34,20.0,6.5,1.14.18.1,5341.0,1.5229655954919863,1.5229655954919863,C(CCN)C[C@@H](C(=O)O)NC(=O)CN__MSHLLVSPLGGGVQPRLEINNFVKNDRQFSLYVQALDRMYATPQNETASYFQVAGVHGYPLIPFDDAVGPTEFSPFDQWTGYCTHGSTLFPTWHRPYVLILEQILSGHAQQIADTYTVNKSEWKKAATEFRHPYWDWASNSVPPPEVISLPKVTITTPNGQKTSVANPLMRYTFNSVNDGGFYGPYNQWDTTLRQPDSTGVNAKDNVNRLKSVLKNAQASLTRATYDMFNRVTTWPHFSSHTPASGGSTSNSIEAIHDNIHVLVGGNGHMSDPSVAPFDPIFFLHHANVDRLIALWSAIRYDVWTSPGDAQFGTYTLRYKQSVDESTDLAPWWKTQNEYWKSNELRSTESLGYTYPEFVGLDMYNKDAVNKTISRKVAQLYGPQRGGQRSLVEDLSNSHARRSQRPAKRSRLGQLLKGLFSDWSAQIKFNRHEVGQSFSVCLFLGNVPEDPREWLVSPNLVGARHAFVRSVKTDHVAEEIGFIPINQWIAEHTGLPSFAVDLVKPLLAQGLQWRVLLADGTPAELDSLEVTILEVPSELTDDEPNPRSRPPRYHKDITHGKRGGCREA,./data/raw/alphafold//AF-Q00024-F1-model_v4.pdb,62,1299,591,1912 +64,2543,2604,MKLSTKLCWCGIKGRLRPQKQQQLHNTNLQMTELKKQKTAEQKTRPQNVGIKGIQIYIPTQCVNQSELEKFDGVSQGKYTIGLGQTNMSFVNDREDIYSMSLTVLSKLIKSYNIDTNKIGRLEVGTETLIDKSKSVKSVLMQLFGENTDVEGIDTLNACYGGTNALFNSLNWIESNAWDGRDAIVVCGDIAIYDKGAARPTGGAGTVAMWIGPDAPIVFDSVRASYMEHAYDFYKPDFTSEYPYVDGHFSLTCYVKALDQVYKSYSKKAISKGLVSDPAGSDALNVLKYFDYNVFHVPTCKLVTKSYGRLLYNDFRANPQLFPEVDAELATRDYDESLTDKNIEKTFVNVAKPFHKERVAQSLIVPTNTGNMYTASVYAAFASLLNYVGSDDLQGKRVGLFSYGSGLAASLYSCKIVGDVQHIIKELDITNKLAKRITETPKDYEAAIELRENAHLKKNFKPQGSIEHLQSGVYYLTNIDDKFRRSYDVKK,uniprot_search,A0A6A5PRN9,CCCCCCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.0123,30.0,8.9,2.3.3.10,4932.0,-1.9100948885606024,-1.9100948885606024,CCCCCCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MKLSTKLCWCGIKGRLRPQKQQQLHNTNLQMTELKKQKTAEQKTRPQNVGIKGIQIYIPTQCVNQSELEKFDGVSQGKYTIGLGQTNMSFVNDREDIYSMSLTVLSKLIKSYNIDTNKIGRLEVGTETLIDKSKSVKSVLMQLFGENTDVEGIDTLNACYGGTNALFNSLNWIESNAWDGRDAIVVCGDIAIYDKGAARPTGGAGTVAMWIGPDAPIVFDSVRASYMEHAYDFYKPDFTSEYPYVDGHFSLTCYVKALDQVYKSYSKKAISKGLVSDPAGSDALNVLKYFDYNVFHVPTCKLVTKSYGRLLYNDFRANPQLFPEVDAELATRDYDESLTDKNIEKTFVNVAKPFHKERVAQSLIVPTNTGNMYTASVYAAFASLLNYVGSDDLQGKRVGLFSYGSGLAASLYSCKIVGDVQHIIKELDITNKLAKRITETPKDYEAAIELRENAHLKKNFKPQGSIEHLQSGVYYLTNIDDKFRRSYDVKK,./data/raw/alphafold//AF-A0A6A5PRN9-F1-model_v4.pdb,197,1547,876,2258 +65,6468,6578,MAPKVGINGFGRIGRIVFRNAIEAGTVDVVAVNDPFIETHYAAYMLKYDSQHGQFKGTIETYDEGLIVNGKKIRFHTERDPANIPWGQDGAEYIVESTGVFTTQEKASAHLKGGAKKVVISAPSADAPMFVMGVNNETYKKDIQVLSNASCTTNCLAPLAKVINDNFGIIEGLMTTVHSYTATQKVVDGPSAKDWRGGRTAATNIIPSSTGAAKAVGKVIPSLNGKLTGMAMRVPTSNVSVVDLTVRTEKAVTYDQIKDAVKKASENELKGILGYTEDDIVSTDLNGDTRSSIFDAKAGIALNSNFIKLVSWYDNEWGYSRRVVDLITYISKVDAQ,sabio,P20445,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,0.034,30.0,7.5,1.2.1.12,162425.0,-1.4685210829577449,-1.4685210829577449,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1__MAPKVGINGFGRIGRIVFRNAIEAGTVDVVAVNDPFIETHYAAYMLKYDSQHGQFKGTIETYDEGLIVNGKKIRFHTERDPANIPWGQDGAEYIVESTGVFTTQEKASAHLKGGAKKVVISAPSADAPMFVMGVNNETYKKDIQVLSNASCTTNCLAPLAKVINDNFGIIEGLMTTVHSYTATQKVVDGPSAKDWRGGRTAATNIIPSSTGAAKAVGKVIPSLNGKLTGMAMRVPTSNVSVVDLTVRTEKAVTYDQIKDAVKKASENELKGILGYTEDDIVSTDLNGDTRSSIFDAKAGIALNSNFIKLVSWYDNEWGYSRRVVDLITYISKVDAQ,./data/raw/alphafold//AF-P20445-F1-model_v4.pdb,1254,868,1912,631 +66,4687,4777,MAYSQGGGKKKVCYYYDGDIGNYYYGQGHPMKPHRIRMTHNLLLNYGLYRKMEIYRPHKATAEEMTKYHSDEYIKFLRSIRPDNMSEYSKQMQRFNVGEDCPVFDGLFEFCQLSTGGSVAGAVKLNRQQTDMAVNWAGGLHHAKKSEASGFCYVNDIVLAILELLKYHQRVLYIDIDIHHGDGVEEAFYTTDRVMTVSFHKYGEYFPGTGDLRDIGAGKGKYYAVNFPMRDGIDDESYGQIFKPIISKVMEMYQPSAVVLQCGADSLSGDRLGCFNLTVKGHAKCVEVVKTFNLPLLMLGGGGYTIRNVARCWTYETAVALDCEIPNELPYNDYFEYFGPDFKLHISPSNMTNQNTPEYMEKIKQRLFENLRMLPHAPGVQMQAIPEDAVHEDSGDEDGEDPDKRISIRASDKRIACDEEFSDSEDEGEGGRRNVADHKKGAKKARIEEDKKETEDKKTDVKEEDKSKDNSGEKTDTKGTKSEQLSNP,sabio,Q92769,C[C@H](/C=C(\C)/C=C/C(=O)NO)C(=O)C1=CC=C(C=C1)N(C)C,7.6e-07,22.0,7.4,3.5.1.-,9606.0,-6.119186407719209,-6.119186407719209,C[C@H](/C=C(\C)/C=C/C(=O)NO)C(=O)C1=CC=C(C=C1)N(C)C__MAYSQGGGKKKVCYYYDGDIGNYYYGQGHPMKPHRIRMTHNLLLNYGLYRKMEIYRPHKATAEEMTKYHSDEYIKFLRSIRPDNMSEYSKQMQRFNVGEDCPVFDGLFEFCQLSTGGSVAGAVKLNRQQTDMAVNWAGGLHHAKKSEASGFCYVNDIVLAILELLKYHQRVLYIDIDIHHGDGVEEAFYTTDRVMTVSFHKYGEYFPGTGDLRDIGAGKGKYYAVNFPMRDGIDDESYGQIFKPIISKVMEMYQPSAVVLQCGADSLSGDRLGCFNLTVKGHAKCVEVVKTFNLPLLMLGGGGYTIRNVARCWTYETAVALDCEIPNELPYNDYFEYFGPDFKLHISPSNMTNQNTPEYMEKIKQRLFENLRMLPHAPGVQMQAIPEDAVHEDSGDEDGEDPDKRISIRASDKRIACDEEFSDSEDEGEGGRRNVADHKKGAKKARIEEDKKETEDKKTDVKEEDKSKDNSGEKTDTKGTKSEQLSNP,./data/raw/alphafold//AF-Q92769-F1-model_v4.pdb,767,393,471,302 +67,2384,2444,MAFMKKYLLPILGLFMAYYYYSANEEFRPEMLQGKKVIVTGASKGIGREMAYHLAKMGAHVVVTARSKETLQKVVSHCLELGAASAHYIAGTMEDMTFAEQFVAQAGKLMGGLDMLILNHITNTSLNLFHDDIHHVRKSMEVNFLSYVVLTVAALPMLKQSNGSIVVVSSLAGKVAYPMVAAYSASKFALDGFFSSIRKEYSVSRVNVSITLCVLGLIDTETAMKAVSGIVHMQAAPKEECALEIIKGGALRQEEVYYDSSLWTTLLIRNPCRKILEFLYSTSYNMDRFINK,brenda,P28845,CCC1(C)SC(=NC2C3CCC2CC3)N=C1O,0.000372,24.0,7.966666666666666,1.1.1.146,9606.0,-3.4294570601181027,-3.4294570601181027,CCC1(C)SC(=NC2C3CCC2CC3)N=C1O__MAFMKKYLLPILGLFMAYYYYSANEEFRPEMLQGKKVIVTGASKGIGREMAYHLAKMGAHVVVTARSKETLQKVVSHCLELGAASAHYIAGTMEDMTFAEQFVAQAGKLMGGLDMLILNHITNTSLNLFHDDIHHVRKSMEVNFLSYVVLTVAALPMLKQSNGSIVVVSSLAGKVAYPMVAAYSASKFALDGFFSSIRKEYSVSRVNVSITLCVLGLIDTETAMKAVSGIVHMQAAPKEECALEIIKGGALRQEEVYYDSSLWTTLLIRNPCRKILEFLYSTSYNMDRFINK,./data/raw/alphafold//AF-P28845-F1-model_v4.pdb,306,1686,1163,2584 +68,2676,2739,MARKLSVLEVLLIIFCLIVVTIDILLLLLVLEETSDTSFTPECPEIPQSERIDCTPDQEVTEDICRWQYKCCWSPVADANVPRCFFPWNWGYEASNGHTNTSTGFTAQLKRLPSPSLFGNDVATTLFTAEYQTSNRFHFKITDFNNIRYEVSHENINLVDGIADASNLSYYVEVTDKPFSIKIMRTSNRRVLLDTSIGPLQFAQQYLQLSFRLPSANVYGLGEHVHQQYRHNMTWKTWPIFTRDATPTEGMINLYGAHTFFLCLEDARGSSFGVFLMNSNAMEVTLQPAPAITYRTIGGILDFYVFLGNTPEQVVQEYLELVGRPFFPPYWSLGFQLSRRDYGGINKLKEVVSRNRLAEIPYDVQYSDIDYMDGKKDFTVDEVAYSGLPDFVKELHDNGQKYLIIMNPGISKNSNYEPYNNGSLKRVWILGSNGFAVGEGYPGPTVFPDYTNPVCTEWWTDQVAKFHDHLEFDGVWIEMNEVSSLLQASNNQCESNNLNFPPFLPRVLDHLLFARTLCMDTEFHGGLHYDIHSLYGHSMARTTNLALETIFMNNRSFILSRSTFAGSGKFAAHWLGDNAATWDDLRWSIPTILEFNLFGIPMVGANICGYNNNVTEELCRRWMQLGAFYPLPRNHNGPGFRDQDPAAFGVDSLLLKSSRHYLNIRYTLLPYLYTLFYHAHTRGETVARPLVHEFYQDSATWDVHEQFLWGPGLLITPVLYEGVDEVKAYIPDATWYDYETGVAISWRKQLVNMLLPGDKIGLHLRGGYIFPTQKPNTTTEASRRNSLGLIIALDYKREAKGELYWDDGVSKDAVTEKKYILYDFSVTSNHLQAKIINNNYMDTDNLMFTDITILGMDKQPANFIVLLNNVATSSPSVVYNASTKVVTITDLQGLVLGQEFSIRWNLPVSDLEKFNCYPDDPTASEESCRQRGCLWEDTSTPGVPTCYYDTIPNYVASDIQYLNTSITADLSLPMAPESAAAAASDSLSAKISFLHLKVIYHTATMLQVKIYDPTNKRYEVPVPLNTPPQPVGDPENRLYDVRIQNNPFGIQIQRKNSSTVIWDSQLPGFIFNDMFLSISTRLPSQYIYGFGETEHTTFRRNMNWNTWGMFAHDEPPAYKKNSYGVHPYYMALEEDGSAHGVLLLNSNAMDVTLQPTPALTYRTTGGILDFYIVLGPTPELVTQQYTELIGRPAMIPYWALGFHLSRYGYQNDAEISSLYDAMVAAQIPYDVQHVDIDYMNRKLDFTLSANFQNLSLLIEQMKKNGMRFILILDPAISGNETQYLPFIRGQENNVFIKWPDTNDIVWGKVWPDLPNVIVDGSLDHETQVKLYRAYVAFPDFFRNSTAAWWKKEIEELYANPREPEKSLKFDGLWIDMNEPSNFVDGSVRGCSNEMLNNPPYMPYLESRDKGLSSKTLCMESQQILPDSSPVEHYNVHNLYGWSQTRPTYEAVQEVTGQRGVIITRSTFPSSGRWGGHRLGNNTAAWDQLGKSIIGMMEFSLFGIPYTGADICGFFGDAEYEMCVRWMQLGAFYPFSRNHNNIGTRRQDPVAWNSTFEMLSRKVLETRYTLLPYLYTLMHKAHVEGSTVVRPLLHEFTDDRTTWDIDRQFMLGPAILISPVLETSTFEISAYFPRARWYDYSTGTSSTSTGQRKILKAPLDHINLHVRGGYILPWQEPAMNTHSSRQNFMGLIVALDDNGTAEGQVFWDDGQSIDTYENGNYFLANFIAAQNILQIQTIHNKYLSDSNPLKVGYIRIWGVNTYVTQVSFTYDNRQFMETNFKSEPYNQILTIQLTDKTINLEKLTEVTWIDGGPVLPTPTKTSTIPMSSHPSPSTTNATSSETITSSASANTTTGTTDTVPITTTSFPSTTSVTTNTTVPDTTSPFPTSTTNASTNATVPITTTPFPTSTIGVTTNATVPNTTAPFPTNASTASTNATVPITTTCFATSTIGVTTNATVPDTTAPFPTNTTTASTNATIPITTTPFATSTISVTTSTTVPDTTAPFPTSTTSASTNATPVPITTTLFATSTIGVTTGTTVPDTTAPFPTSTTSTSTSATVPITTTPSPTNTADANTSNTVPNTTMPSPTSSTTVSTIATVPISVTPSLTSTADATISTTVLIATTSSLTGTTDVSTSTTINNISTPVQTNTTNASTSTNVANITATSHTSTDDTVPNNTVPVTAIPSLANTGVDTTSNSFSIMTTSFSESTNAMNTTVIMATTSPTSTDVASTNNDASMTNFLLATMSAGNITSNSISITTTSFGNSVPFVTTPSPSTDATTTSNNTNPGMTTYYQTSPTIPTHTLTSIPSSITSILSMFPTSNTFTTDKITNFTTPTNANTIIFNTLDTKSTMVIDATVTTTSTKDNTMSPDTTVTSIDKFTTHITQFATPHSATTTTLALSHTSLAPTNLSNLGTMDITDADNSSSVTGNTTHISVSNLTTASVTITATGLDSQTPHMVINSVATYLPITATSATTDTTNITKYALNTTTPDSTVHTSATAPTYIANAINATQVP,uniprot_search,Q2M2H8,CCCCCCCCCCCCCC[S@+]1C[C@@H](O)[C@H](O)[C@H]1CO.O=S(=O)([O-])C(F)(F)F,0.01,37.0,6.5,3.2.1.3,9606.0,-2.0,-2.0,CCCCCCCCCCCCCC[S@+]1C[C@@H](O)[C@H](O)[C@H]1CO.O=S(=O)([O-])C(F)(F)F__MARKLSVLEVLLIIFCLIVVTIDILLLLLVLEETSDTSFTPECPEIPQSERIDCTPDQEVTEDICRWQYKCCWSPVADANVPRCFFPWNWGYEASNGHTNTSTGFTAQLKRLPSPSLFGNDVATTLFTAEYQTSNRFHFKITDFNNIRYEVSHENINLVDGIADASNLSYYVEVTDKPFSIKIMRTSNRRVLLDTSIGPLQFAQQYLQLSFRLPSANVYGLGEHVHQQYRHNMTWKTWPIFTRDATPTEGMINLYGAHTFFLCLEDARGSSFGVFLMNSNAMEVTLQPAPAITYRTIGGILDFYVFLGNTPEQVVQEYLELVGRPFFPPYWSLGFQLSRRDYGGINKLKEVVSRNRLAEIPYDVQYSDIDYMDGKKDFTVDEVAYSGLPDFVKELHDNGQKYLIIMNPGISKNSNYEPYNNGSLKRVWILGSNGFAVGEGYPGPTVFPDYTNPVCTEWWTDQVAKFHDHLEFDGVWIEMNEVSSLLQASNNQCESNNLNFPPFLPRVLDHLLFARTLCMDTEFHGGLHYDIHSLYGHSMARTTNLALETIFMNNRSFILSRSTFAGSGKFAAHWLGDNAATWDDLRWSIPTILEFNLFGIPMVGANICGYNNNVTEELCRRWMQLGAFYPLPRNHNGPGFRDQDPAAFGVDSLLLKSSRHYLNIRYTLLPYLYTLFYHAHTRGETVARPLVHEFYQDSATWDVHEQFLWGPGLLITPVLYEGVDEVKAYIPDATWYDYETGVAISWRKQLVNMLLPGDKIGLHLRGGYIFPTQKPNTTTEASRRNSLGLIIALDYKREAKGELYWDDGVSKDAVTEKKYILYDFSVTSNHLQAKIINNNYMDTDNLMFTDITILGMDKQPANFIVLLNNVATSSPSVVYNASTKVVTITDLQGLVLGQEFSIRWNLPVSDLEKFNCYPDDPTASEESCRQRGCLWEDTSTPGVPTCYYDTIPNYVASDIQYLNTSITADLSLPMAPESAAAAASDSLSAKISFLHLKVIYHTATMLQVKIYDPTNKRYEVPVPLNTPPQPVGDPENRLYDVRIQNNPFGIQIQRKNSSTVIWDSQLPGFIFNDMFLSISTRLPSQYIYGFGETEHTTFRRNMNWNTWGMFAHDEPPAYKKNSYGVHPYYMALEEDGSAHGVLLLNSNAMDVTLQPTPALTYRTTGGILDFYIVLGPTPELVTQQYTELIGRPAMIPYWALGFHLSRYGYQNDAEISSLYDAMVAAQIPYDVQHVDIDYMNRKLDFTLSANFQNLSLLIEQMKKNGMRFILILDPAISGNETQYLPFIRGQENNVFIKWPDTNDIVWGKVWPDLPNVIVDGSLDHETQVKLYRAYVAFPDFFRNSTAAWWKKEIEELYANPREPEKSLKFDGLWIDMNEPSNFVDGSVRGCSNEMLNNPPYMPYLESRDKGLSSKTLCMESQQILPDSSPVEHYNVHNLYGWSQTRPTYEAVQEVTGQRGVIITRSTFPSSGRWGGHRLGNNTAAWDQLGKSIIGMMEFSLFGIPYTGADICGFFGDAEYEMCVRWMQLGAFYPFSRNHNNIGTRRQDPVAWNSTFEMLSRKVLETRYTLLPYLYTLMHKAHVEGSTVVRPLLHEFTDDRTTWDIDRQFMLGPAILISPVLETSTFEISAYFPRARWYDYSTGTSSTSTGQRKILKAPLDHINLHVRGGYILPWQEPAMNTHSSRQNFMGLIVALDDNGTAEGQVFWDDGQSIDTYENGNYFLANFIAAQNILQIQTIHNKYLSDSNPLKVGYIRIWGVNTYVTQVSFTYDNRQFMETNFKSEPYNQILTIQLTDKTINLEKLTEVTWIDGGPVLPTPTKTSTIPMSSHPSPSTTNATSSETITSSASANTTTGTTDTVPITTTSFPSTTSVTTNTTVPDTTSPFPTSTTNASTNATVPITTTPFPTSTIGVTTNATVPNTTAPFPTNASTASTNATVPITTTCFATSTIGVTTNATVPDTTAPFPTNTTTASTNATIPITTTPFATSTISVTTSTTVPDTTAPFPTSTTSASTNATPVPITTTLFATSTIGVTTGTTVPDTTAPFPTSTTSTSTSATVPITTTPSPTNTADANTSNTVPNTTMPSPTSSTTVSTIATVPISVTPSLTSTADATISTTVLIATTSSLTGTTDVSTSTTINNISTPVQTNTTNASTSTNVANITATSHTSTDDTVPNNTVPVTAIPSLANTGVDTTSNSFSIMTTSFSESTNAMNTTVIMATTSPTSTDVASTNNDASMTNFLLATMSAGNITSNSISITTTSFGNSVPFVTTPSPSTDATTTSNNTNPGMTTYYQTSPTIPTHTLTSIPSSITSILSMFPTSNTFTTDKITNFTTPTNANTIIFNTLDTKSTMVIDATVTTTSTKDNTMSPDTTVTSIDKFTTHITQFATPHSATTTTLALSHTSLAPTNLSNLGTMDITDADNSSSVTGNTTHISVSNLTTASVTITATGLDSQTPHMVINSVATYLPITATSATTDTTNITKYALNTTTPDSTVHTSATAPTYIANAINATQVP,./data/raw/alphafold//AF-Q2M2H8-F1-model_v4.pdb,541,1980,1378,30 +69,6563,6674,MAPKAKIVLVGSGMIGGVMATLIVQKNLGDVVLFDIVKNMPHGKALDTSHTNVMAYSNCKVSGSNTYDDLAGADVVIVTAGFTKAPGKSDKEWNRDDLLPLNNKIMIEIGGHIKKNCPNAFIIVVTNPVDVMVQLLHQHSGVPKNKIIGLGGVLDTSRLKYYISQKLNVCPRDVNAHIVGAHGNKMVLLKRYITVGGIPLQEFINNKLISDAELEAIFDRTVNTALEIVNLHASPYVAPAAAIIEMAESYLKDLKKVLICSTLLEGQYGHSDIFGGTPVVLGANGVEQVIELQLNSEEKAKFDEAIAETKRMKALA,sabio,Q27743,NC(=S)c1ccc[n+]([C@@H]2O[C@H](COP(=O)([O-])O[P@@](=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.047,25.0,9.2,1.1.1.27,5833.0,-1.3279021420642825,-1.3279021420642825,NC(=S)c1ccc[n+]([C@@H]2O[C@H](COP(=O)([O-])O[P@@](=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MAPKAKIVLVGSGMIGGVMATLIVQKNLGDVVLFDIVKNMPHGKALDTSHTNVMAYSNCKVSGSNTYDDLAGADVVIVTAGFTKAPGKSDKEWNRDDLLPLNNKIMIEIGGHIKKNCPNAFIIVVTNPVDVMVQLLHQHSGVPKNKIIGLGGVLDTSRLKYYISQKLNVCPRDVNAHIVGAHGNKMVLLKRYITVGGIPLQEFINNKLISDAELEAIFDRTVNTALEIVNLHASPYVAPAAAIIEMAESYLKDLKKVLICSTLLEGQYGHSDIFGGTPVVLGANGVEQVIELQLNSEEKAKFDEAIAETKRMKALA,./data/raw/alphafold//AF-Q27743-F1-model_v4.pdb,239,1600,940,2091 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+170,11640,11820,MELGAGGVVFNAKREVLLLRDRMGFWVFPKGHPEPGESLEEAAVREVWEETGVRAEVLLPLYPTRYVNPKGVEREVHWFLMRGEGAPRLEEGMTGAGWFSPEEARALLAFPEDLGLLEVALERLPL,brenda,Q75UV1,[F-],0.424,25.0,7.0,3.6.1.61,274.0,-0.3726341434072674,-0.3726341434072674,[F-]__MELGAGGVVFNAKREVLLLRDRMGFWVFPKGHPEPGESLEEAAVREVWEETGVRAEVLLPLYPTRYVNPKGVEREVHWFLMRGEGAPRLEEGMTGAGWFSPEEARALLAFPEDLGLLEVALERLPL,./data/raw/alphafold//AF-Q75UV1-F1-model_v4.pdb,1258,873,2178,1021 +171,6378,6487,MRPWTGSWRWIMLILFAWGTLLFYIGGHLVRDNDHPDHSSRELSKILAKLERLKQQNEDLRRMAESLRIPEGPIDQGPAIGRVRVLEEQLVKAKEQIENYKKQTRNGLGKDHEILRRRIENGAKELWFFLQSELKKLKNLEGNELQRHADEFLLDLGHHERSIMTDLYYLSQTDGAGDWREKEAKDLTELVQRRITYLQNPKDCSKAKKLVCNINKGCGYGCQLHHVVYCFMIAYGTQRTLILESQNWRYATGGWETVFRPVSETCTDRSGISTGHWSGEVKDKNVQVVELPIVDSLHPRPPYLPLAVPEDLADRLVRVHGDPAVWWVSQFVKYLIRPQPWLEKEIEEATKKLGFKHPVIGVHVRRTDKVGTEAAFHPIEEYMVHVEEHFQLLARRMQVDKKRVYLATDDPSLLKEAKTKYPNYEFISDNSISWSAGLHNRYTENSLRGVILDIHFLSQADFLVCTFSSQVCRVAYEIMQTLHPDASANFHSLDDIYYFGGQNAHNQIAIYAHQPRTADEIPMEPGDIIGVAGNHWDGYSKGVNRKLGRTGLYPSYKVREKIETVKYPTYPEAEK,brenda,Q9BYC5,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1,0.0036,30.0,7.133333333333333,2.4.1.68,9606.0,-2.4436974992327127,-2.4436974992327127,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1__MRPWTGSWRWIMLILFAWGTLLFYIGGHLVRDNDHPDHSSRELSKILAKLERLKQQNEDLRRMAESLRIPEGPIDQGPAIGRVRVLEEQLVKAKEQIENYKKQTRNGLGKDHEILRRRIENGAKELWFFLQSELKKLKNLEGNELQRHADEFLLDLGHHERSIMTDLYYLSQTDGAGDWREKEAKDLTELVQRRITYLQNPKDCSKAKKLVCNINKGCGYGCQLHHVVYCFMIAYGTQRTLILESQNWRYATGGWETVFRPVSETCTDRSGISTGHWSGEVKDKNVQVVELPIVDSLHPRPPYLPLAVPEDLADRLVRVHGDPAVWWVSQFVKYLIRPQPWLEKEIEEATKKLGFKHPVIGVHVRRTDKVGTEAAFHPIEEYMVHVEEHFQLLARRMQVDKKRVYLATDDPSLLKEAKTKYPNYEFISDNSISWSAGLHNRYTENSLRGVILDIHFLSQADFLVCTFSSQVCRVAYEIMQTLHPDASANFHSLDDIYYFGGQNAHNQIAIYAHQPRTADEIPMEPGDIIGVAGNHWDGYSKGVNRKLGRTGLYPSYKVREKIETVKYPTYPEAEK,./data/raw/alphafold//AF-Q9BYC5-F1-model_v4.pdb,976,516,1879,597 +172,11583,11761,MSTINGCLTSISPSRTQLKNTSTLRPTFIANSRVNPSSSVPPSLIRNQPVFAAPAPIITPTLKEDMAYEEAIAALKKLLSEKGELENEAASKVAQITSELADGGTPSASYPVQRIKEGFIKFKKEKYEKNPALYGELSKGQAPKFMVFACSDSRVCPSHVLDFQPGEAFMVRNIANMVPVFDKDKYAGVGAAIEYAVLHLKVENIVVIGHSACGGIKGLMSFPDAGPTTTDFIEDWVKICLPAKHKVLAEHGNATFAEQCTHCEKEAVNVSLGNLLTYPFVRDGLVKKTLALQGGYYDFVNGSFELWGLEYGLSPSQSV,sabio,P16016,[Cl-],33.0,25.0,7.0,4.2.1.1,3562.0,1.5185139398778875,1.5185139398778875,[Cl-]__MSTINGCLTSISPSRTQLKNTSTLRPTFIANSRVNPSSSVPPSLIRNQPVFAAPAPIITPTLKEDMAYEEAIAALKKLLSEKGELENEAASKVAQITSELADGGTPSASYPVQRIKEGFIKFKKEKYEKNPALYGELSKGQAPKFMVFACSDSRVCPSHVLDFQPGEAFMVRNIANMVPVFDKDKYAGVGAAIEYAVLHLKVENIVVIGHSACGGIKGLMSFPDAGPTTTDFIEDWVKICLPAKHKVLAEHGNATFAEQCTHCEKEAVNVSLGNLLTYPFVRDGLVKKTLALQGGYYDFVNGSFELWGLEYGLSPSQSV,./data/raw/alphafold//AF-P16016-F1-model_v4.pdb,213,1568,900,2285 +173,6342,6451,MATRSPGVVISDDEPGYDLDLFCIPNHYAEDLERVFIPHGLIMDRTERLARDVMKEMGGHHIVALCVLKGGYKFFADLLDYIKALNRNSDRSIPMTVDFIRLKSYCNDQSTGDIKVIGGDDLSTLTGKNVLIVEDIIDTGKTMQTLLSLVRQYNPKMVKVASLLVKRTPRSVGYKPDFVGFEIPDKFVVGYALDYNEYFRDLNHVCVISETGKAKYKA,brenda,P00492,N=c1nc(O)c2ncn(C[C@@H](CO)OCP(=O)(O)O)c2[nH]1,0.1768,25.0,8.5,2.4.2.8,9606.0,-0.7525177393229456,-0.7525177393229456,N=c1nc(O)c2ncn(C[C@@H](CO)OCP(=O)(O)O)c2[nH]1__MATRSPGVVISDDEPGYDLDLFCIPNHYAEDLERVFIPHGLIMDRTERLARDVMKEMGGHHIVALCVLKGGYKFFADLLDYIKALNRNSDRSIPMTVDFIRLKSYCNDQSTGDIKVIGGDDLSTLTGKNVLIVEDIIDTGKTMQTLLSLVRQYNPKMVKVASLLVKRTPRSVGYKPDFVGFEIPDKFVVGYALDYNEYFRDLNHVCVISETGKAKYKA,./data/raw/alphafold//AF-P00492-F1-model_v4.pdb,342,1737,1091,2503 +174,2658,2721,MRNPGAQDNVSVSQGMRAMFYMMKPSETAFQTVEEVPDYVKKATPFFIFLILLELVVSWILKGKPSGRLDDILTSMSAGVVSRLPNLFFRSLEVTSYIYIWENYRVCELPWDSPWTWYLTFLGVDFGYYWFHRMAHEINIIWAAHQAHHSSEDYNLSTALRQSVLQQYSSWVFYCPLALFVPPSVFAVHIQFNLLYQFWIHTEVIRTLGPLELVLNTPSHHRVHHGRNRYCIDKNYAGTLIIWDRIFGTFEAENEQVIYGLTHPIGTFEPFKVQFHHLLYIWTTFWATPGFCHKFSVLFKGPGWGPGKPRLGLSEEIPEVTGQEVPFTSSASQFLKIYAVLQFAVMLVFYEETFANTAVLSQVTILLRICFIILTLTSIGFLLDQRPKAAIVETLRCLLFLTLYRFGHLKPLIESLSFAFEIFFSVCIAFWGVRSITHLASGSWKKP,uniprot_search,A0JPQ8,CCCCCCCCCCCCCCCCCCO,0.77,37.0,8.733333333333333,1.14.16.5,10116.0,-0.1135092748275181,-0.1149239198369502,CCCCCCCCCCCCCCCCCCO__MRNPGAQDNVSVSQGMRAMFYMMKPSETAFQTVEEVPDYVKKATPFFIFLILLELVVSWILKGKPSGRLDDILTSMSAGVVSRLPNLFFRSLEVTSYIYIWENYRVCELPWDSPWTWYLTFLGVDFGYYWFHRMAHEINIIWAAHQAHHSSEDYNLSTALRQSVLQQYSSWVFYCPLALFVPPSVFAVHIQFNLLYQFWIHTEVIRTLGPLELVLNTPSHHRVHHGRNRYCIDKNYAGTLIIWDRIFGTFEAENEQVIYGLTHPIGTFEPFKVQFHHLLYIWTTFWATPGFCHKFSVLFKGPGWGPGKPRLGLSEEIPEVTGQEVPFTSSASQFLKIYAVLQFAVMLVFYEETFANTAVLSQVTILLRICFIILTLTSIGFLLDQRPKAAIVETLRCLLFLTLYRFGHLKPLIESLSFAFEIFFSVCIAFWGVRSITHLASGSWKKP,./data/raw/alphafold//AF-A0JPQ8-F1-model_v4.pdb,534,1971,1369,21 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+176,7770,7899,ILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLAIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHSLLGGVVDDQAGPGAWVRGVQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAG,uniprot_search,Q7M0F8,Nc1ccccc1O,1.04,37.0,8.0,2.3.2.13,10141.0,0.0170333392987803,0.0170333392987803,Nc1ccccc1O__ILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLAIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHSLLGGVVDDQAGPGAWVRGVQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAG,./data/raw/alphafold//AF-Q7M0F8-F1-model_v4.pdb,1754,1492,816,2190 +177,7280,7400,MLFSALLLEVIWILAADGGQHWTYEGPHGQDHWPASYPECGNNAQSPIDIQTDSVTFDPDLPALQPHGYDQPGTEPLDLHNNGHTVQLSLPSTLYLGGLPRKYVAAQLHLHWGQKGSPGGSEHQINSEATFAELHIVHYDSDSYDSLSEAAERPQGLAVLGILIEVGETKNIAYEHILSHLHEVRHKDQKTSVPPFNLRELLPKQLGQYFRYNGSLTTPPCYQSVLWTVFYRRSQISMEQLEKLQGTLFSTEEEPSKLLVQNYRALQPLNQRMVFASFIQAGSSYTTGEMLSLGVGILVGCLCLLLAVYFIARKIRKKRLENRKSVVFTSAQATTEA,brenda,Q9ULX7,NS(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1,0.001345,25.0,7.5,4.2.1.1,9606.0,-2.871277715661573,-2.871277715661573,NS(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1__MLFSALLLEVIWILAADGGQHWTYEGPHGQDHWPASYPECGNNAQSPIDIQTDSVTFDPDLPALQPHGYDQPGTEPLDLHNNGHTVQLSLPSTLYLGGLPRKYVAAQLHLHWGQKGSPGGSEHQINSEATFAELHIVHYDSDSYDSLSEAAERPQGLAVLGILIEVGETKNIAYEHILSHLHEVRHKDQKTSVPPFNLRELLPKQLGQYFRYNGSLTTPPCYQSVLWTVFYRRSQISMEQLEKLQGTLFSTEEEPSKLLVQNYRALQPLNQRMVFASFIQAGSSYTTGEMLSLGVGILVGCLCLLLAVYFIARKIRKKRLENRKSVVFTSAQATTEA,./data/raw/alphafold//AF-Q9ULX7-F1-model_v4.pdb,1724,1456,775,2145 +178,2607,2668,MQLDSPPTSKDLAASGNDEGALTAQGGGEGEPHGQSPDTRLGNTDKQLHTGAAVTSSSAGAASVAPCQREPRDLAMQPADCPRGLLPRPCRVLVLLNPRGGKGKALKLFQSRVRPLLEEAEVSFKLMLTERQNHARELVCAEELGHWDALAVMSGDGLMHEVVNGLMERPDWESAIQKPLCSLPGGSGNALAASLNYYAGHEQVTNEDLLINCTLLLCCRQLSPMNLLSLHTASGRQLYSVLSLSWGFVADVDLESEKYRSLGEIRFTVGTFFRLASLRIYQGQLAYLPVGKAASKIPASSLAQKGPANTYLVPLEEPVPPHWTVVPEQDFVLVLVLLHTHLSTEMFAAPMGRCEAGVMHLFYIRAGVSRAMLVRLFLAMQKGKHMDLDCPYLVHVPVVAFRLEPRNQRGVFSVDGELMVCEAVQGQVHPNYLWMVSGSSDSPSGRDSQRRPPPEEPI,brenda,Q1HGK5,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)N(C)C,0.0058,37.0,7.4,2.7.1.91,10116.0,-2.2365720064370627,-2.859029033279588,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)N(C)C__MQLDSPPTSKDLAASGNDEGALTAQGGGEGEPHGQSPDTRLGNTDKQLHTGAAVTSSSAGAASVAPCQREPRDLAMQPADCPRGLLPRPCRVLVLLNPRGGKGKALKLFQSRVRPLLEEAEVSFKLMLTERQNHARELVCAEELGHWDALAVMSGDGLMHEVVNGLMERPDWESAIQKPLCSLPGGSGNALAASLNYYAGHEQVTNEDLLINCTLLLCCRQLSPMNLLSLHTASGRQLYSVLSLSWGFVADVDLESEKYRSLGEIRFTVGTFFRLASLRIYQGQLAYLPVGKAASKIPASSLAQKGPANTYLVPLEEPVPPHWTVVPEQDFVLVLVLLHTHLSTEMFAAPMGRCEAGVMHLFYIRAGVSRAMLVRLFLAMQKGKHMDLDCPYLVHVPVVAFRLEPRNQRGVFSVDGELMVCEAVQGQVHPNYLWMVSGSSDSPSGRDSQRRPPPEEPI,./data/raw/alphafold//AF-Q1HGK5-F1-model_v4.pdb,531,1968,1366,16 +179,7364,7485,MWNAQQDSDSAEALGRRQRWFCAGTLVLAFTGTFIIGFLFGWFIKPSNDSTSSVSYPGMKKAFLQELKAENIKKFLYNFTRTPHLAGTQHNFELAKQIHAQWKEFGLDLVELSDYDVLLSYPNKTHPNYISIINEDGNEIFKTSLAELSPPGYENISDVVPPYSAFSPQGTPEGDLVYVNYARTEDFFKLERVMKINCSGKIVIARYGQVFRGNKVKNAQLAGAKGIILYSDPADYFVPGVKSYPDGWNLPGGGVQRGNVLNLNGAGDPLTPGYPANEYAYRHEFTEAVGLPSIPVHPIGYDDAQKLLEHMGGSAPPDSSWKGGLKVPYNVGPGFAGNFSKQKVKLHIHSYNKVTRIYNVIGTLKGAVEPDRYVILGGHRDAWVFGGIDPQSGAAVVHEIVRTFGTLKKKGWRPRRTILFASWDAEEFGLLGSTEWAEEHSRLLQERGVAYINADSSIEGNYTLRVDCTPLMHSLVYNLTKELPSPDEGFEGKSLYDSWKEKSPSTEFIGMPRISKLGSGNDFEVFFQRLGIASGRARYTKNWKNNKVSSYPLYHSVYETYELVEKFYDPTFKYHLTVAQVRGAMVFELANSIVLPFDCQSYAVALKKHAETIYNISMNHPQEMKAYMISFDSLFSAVNNFTDVASKFNQRLQDLDKSNPILLRILNDQLMYLERAFIDPLGLPGRPFYRHIIYAPSSHNKYAGESFPGIYDALFDINNKVDTSKAWREVKRQISIAAFTVQAAAETLREVD,uniprot_search,P70627,N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCC(=O)O)C(=O)O,0.00075,37.0,7.0,3.4.17.21,10116.0,-3.1249387366083,-3.1249387366083,N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCC(=O)O)C(=O)O__MWNAQQDSDSAEALGRRQRWFCAGTLVLAFTGTFIIGFLFGWFIKPSNDSTSSVSYPGMKKAFLQELKAENIKKFLYNFTRTPHLAGTQHNFELAKQIHAQWKEFGLDLVELSDYDVLLSYPNKTHPNYISIINEDGNEIFKTSLAELSPPGYENISDVVPPYSAFSPQGTPEGDLVYVNYARTEDFFKLERVMKINCSGKIVIARYGQVFRGNKVKNAQLAGAKGIILYSDPADYFVPGVKSYPDGWNLPGGGVQRGNVLNLNGAGDPLTPGYPANEYAYRHEFTEAVGLPSIPVHPIGYDDAQKLLEHMGGSAPPDSSWKGGLKVPYNVGPGFAGNFSKQKVKLHIHSYNKVTRIYNVIGTLKGAVEPDRYVILGGHRDAWVFGGIDPQSGAAVVHEIVRTFGTLKKKGWRPRRTILFASWDAEEFGLLGSTEWAEEHSRLLQERGVAYINADSSIEGNYTLRVDCTPLMHSLVYNLTKELPSPDEGFEGKSLYDSWKEKSPSTEFIGMPRISKLGSGNDFEVFFQRLGIASGRARYTKNWKNNKVSSYPLYHSVYETYELVEKFYDPTFKYHLTVAQVRGAMVFELANSIVLPFDCQSYAVALKKHAETIYNISMNHPQEMKAYMISFDSLFSAVNNFTDVASKFNQRLQDLDKSNPILLRILNDQLMYLERAFIDPLGLPGRPFYRHIIYAPSSHNKYAGESFPGIYDALFDINNKVDTSKAWREVKRQISIAAFTVQAAAETLREVD,./data/raw/alphafold//AF-P70627-F1-model_v4.pdb,373,1773,1134,2570 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+190,2712,2775,MNSKIQKMELNDGHSIPVLGFGTYATEENLRKKSMESTKIAIDVGFRHIDCSHLYQNEEEIGQAIVSKIEDGTVKREDIFYTSKLWSTSHRPELVRPSLENSLRKLNLDYVDLYLIHFPVSLKPGDELLPQDEHGNLILDTVDLCDTWEAMEKCKDAGLAKSIGVSNFNRRQLEKILNKPGLKHRPVCNQVECHLYLNQSKLLAYCKMNDIVLVAYGALGTQRYKYCINEDTPVLLDDPILCTMAKKYKRTPALIALRYQLERGIVTLVKSFNEERIRENLQVFDFQLASDDMEILDNLDRNLRYFPANMFKAHPNFPFSDEY,uniprot_search,P51652,CCCCCCCCCC[n+]1cccc(C(=N)[O-])c1.Cl,1.24,23.0,7.8,1.1.1.149,10116.0,0.093421685162235,0.093421685162235,CCCCCCCCCC[n+]1cccc(C(=N)[O-])c1.Cl__MNSKIQKMELNDGHSIPVLGFGTYATEENLRKKSMESTKIAIDVGFRHIDCSHLYQNEEEIGQAIVSKIEDGTVKREDIFYTSKLWSTSHRPELVRPSLENSLRKLNLDYVDLYLIHFPVSLKPGDELLPQDEHGNLILDTVDLCDTWEAMEKCKDAGLAKSIGVSNFNRRQLEKILNKPGLKHRPVCNQVECHLYLNQSKLLAYCKMNDIVLVAYGALGTQRYKYCINEDTPVLLDDPILCTMAKKYKRTPALIALRYQLERGIVTLVKSFNEERIRENLQVFDFQLASDDMEILDNLDRNLRYFPANMFKAHPNFPFSDEY,./data/raw/alphafold//AF-P51652-F1-model_v4.pdb,138,442,1392,45 +191,11587,11765,MTKYSESYCDVLIVGAGPAGLMAARVLSEYVRQKPDLKVRIIDKRSTKVYNGQADGLQCRTLESLKNLGLADKILSEANDMSTIALYNPDENGHIRRTDRIPDTLPGISRYHQVVLHQGRIERHILDSIAEISDTRIKVERPLIPEKMEIDSSKAEDPEAYPVTMTLRYMSDHESTPLQFGHKTENSLFHSNLQTQEEEDANYRLPEGKEAGEIETVHCKYVIGCDGGHSWVRRTLGFEMIGEQTDYIWGVLDAVPASNFPDIRSPCAIHSAESGSIMIIPRENNLVRFYVQLQARAEKGGRVDRTKFTPEVVIANAKKIFHPYTFDVQQLDWFTAYHIGQRVTEKFSKDERVFIAGDACHTHSPKAGQGMNTSMMDTYNLGWKLGLVLTGRAKRDILKTYEEERHAFAQALIDFDHQFSRLFSGRPAKDVADEMGVSMDVFKEAFVKGNEFASGTAINYDENLVTDKKSSKQELAKNCVVGTRFKSQPVVRHSEGLWMHFGDRLVTDGRFRIIVFAGKATDATQMSRIKKFSAYLDSENSVISLYTPKVSDRNSRIDVITIHSCHRDDIEMHDFPAPALHPKWQYDFIYADCDSWHHPHPKSYQAWGVDETKGAVVVVRPDGYTSLVTDLEGTAEIDRYFSGILVEPKEKSGAQTEADWTKSTA,uniprot_search,P15245,[Cl-],8.6,37.0,7.8,1.14.13.7,5554.0,0.9344984512435676,0.9344984512435676,[Cl-]__MTKYSESYCDVLIVGAGPAGLMAARVLSEYVRQKPDLKVRIIDKRSTKVYNGQADGLQCRTLESLKNLGLADKILSEANDMSTIALYNPDENGHIRRTDRIPDTLPGISRYHQVVLHQGRIERHILDSIAEISDTRIKVERPLIPEKMEIDSSKAEDPEAYPVTMTLRYMSDHESTPLQFGHKTENSLFHSNLQTQEEEDANYRLPEGKEAGEIETVHCKYVIGCDGGHSWVRRTLGFEMIGEQTDYIWGVLDAVPASNFPDIRSPCAIHSAESGSIMIIPRENNLVRFYVQLQARAEKGGRVDRTKFTPEVVIANAKKIFHPYTFDVQQLDWFTAYHIGQRVTEKFSKDERVFIAGDACHTHSPKAGQGMNTSMMDTYNLGWKLGLVLTGRAKRDILKTYEEERHAFAQALIDFDHQFSRLFSGRPAKDVADEMGVSMDVFKEAFVKGNEFASGTAINYDENLVTDKKSSKQELAKNCVVGTRFKSQPVVRHSEGLWMHFGDRLVTDGRFRIIVFAGKATDATQMSRIKKFSAYLDSENSVISLYTPKVSDRNSRIDVITIHSCHRDDIEMHDFPAPALHPKWQYDFIYADCDSWHHPHPKSYQAWGVDETKGAVVVVRPDGYTSLVTDLEGTAEIDRYFSGILVEPKEKSGAQTEADWTKSTA,./data/raw/alphafold//AF-P15245-F1-model_v4.pdb,1641,148,327,1618 +192,6886,7002,MAMLKNYGACLKDSTLQFPRPNCGDINKRRNAKWKSAQAAVIPNFHLPMRSFEVKNRTSVDDIKSLRLITAIKTPYLPDGRFDLEAYDALVNMQIVDGAEGVIVGGTTGEGQLMSWDEHIMLIGHTVNCFGGSIKVIGNTGSNSTREAIHATEQGFAVGMHAALHINPYYGKTSLEGLVSHFESVLPMGPTVIYNVPSRTGQDIPPGVIHTVAQSANLAGVKECVGNDRIKQYTDNRIVVWSGNDDQCHDAKWDYGATGVISVTSNLIPGLMRQLLFKGKNPSLNAKIMPLVNWLFEEPNPIGLNTALAQLGVVRPVFRLPYVPLPLAKRVEFVNIVKEIGRENFVGEKDVKVLDDDDFILVGRY,brenda,D7U7T8,NCCCC[C@H](N)C(=O)O,0.049,30.0,8.0,4.3.3.7,29760.0,-1.3098039199714864,-1.3098039199714864,NCCCC[C@H](N)C(=O)O__MAMLKNYGACLKDSTLQFPRPNCGDINKRRNAKWKSAQAAVIPNFHLPMRSFEVKNRTSVDDIKSLRLITAIKTPYLPDGRFDLEAYDALVNMQIVDGAEGVIVGGTTGEGQLMSWDEHIMLIGHTVNCFGGSIKVIGNTGSNSTREAIHATEQGFAVGMHAALHINPYYGKTSLEGLVSHFESVLPMGPTVIYNVPSRTGQDIPPGVIHTVAQSANLAGVKECVGNDRIKQYTDNRIVVWSGNDDQCHDAKWDYGATGVISVTSNLIPGLMRQLLFKGKNPSLNAKIMPLVNWLFEEPNPIGLNTALAQLGVVRPVFRLPYVPLPLAKRVEFVNIVKEIGRENFVGEKDVKVLDDDDFILVGRY,./data/raw/alphafold//AF-D7U7T8-F1-model_v4.pdb,1068,631,2008,736 +193,2330,2389,MNFAEEEPSKKYCIKGKHVAIICGVVVAVGLIVGLSVGLTRSCEQDTTPAPSQPPPEASTALPPQDQNVCPDSEDESGEWKNFRLPDFINPVHYDLEVKALMEEDRYTGIVTISVNLSKPTRDLWLHIRETKITKLPELRRPSGEQVPIRRCFEYKKQEYVVIQAAEDLAATSGDSVYRLTMEFKGWLNGSLVGFYKTTYMEDGQIRSIAATDHEPTDARKSFPCFDEPNKKSTYSISIIHPKEYSALSNMPEEKSEMVDDNWKKTTFVKSVPMSTYLVCFAVHRFTAIERKSRSGKPLKVYVQPNQKETAEYAANITQAVFDYFEDYFAMEYALPKLDKIAIPDFGTGAMENWGLVTYRETNLLYDPLLSASSNQQRVASVVAHELVHQWFGNTVTMDWWDDLWLNEGFASFFEFLGVNHAEKDWQMLSQVLLEDVFPVQEDDSLMSSHPVVVTVSTPAEITSVFDGISYSKGASILRMLQDWITPEKFQKGCQIYLKKFQFANAKTSDFWDSLQEASNLPVKEVMDTWTSQMGYPVVTVSGRQNITQKRFLLDSKADPSQPPSELGYTWNIPVRWADNDNSRITVYNRLDKGGITLNANLSGDAFLKINPDHIGFYRVNYEGGTWDWIAEALSSNHTRFSAADRSSFIDDAFALARAQLLNYKIALNLTMYLKSEEDFLPWERVISSVSYIISMFEDDRELYPMIETYFQGQVKPVADLLGWQDTGSHITKLLRASILGFACKMGDREALGNASQLFDSWLKGSASIPVNLRLLVYRYGMQNSGNEAAWNYTLEQYQKTSLAQEKEKLLYGLASVKDVKLLARYLEMLKDPNIIKTQDVFTVIRYISYNSYGKTMAWNWIQLNWDYLVSRFTINDRYLGRIVTIAEPFNTELQLWQMQSFFAKYPNAGAGAKPREQVLETVKNNIEWLNVNRQSIREWFASLP,brenda,P16406,CCC(C)[C@H](N=C(O)[C@H](S)[C@@H](N)CCS(=O)(=O)O)C(=O)O,4e-05,37.0,7.3,3.4.11.7,10090.0,-4.3979400086720375,-4.3979400086720375,CCC(C)[C@H](N=C(O)[C@H](S)[C@@H](N)CCS(=O)(=O)O)C(=O)O__MNFAEEEPSKKYCIKGKHVAIICGVVVAVGLIVGLSVGLTRSCEQDTTPAPSQPPPEASTALPPQDQNVCPDSEDESGEWKNFRLPDFINPVHYDLEVKALMEEDRYTGIVTISVNLSKPTRDLWLHIRETKITKLPELRRPSGEQVPIRRCFEYKKQEYVVIQAAEDLAATSGDSVYRLTMEFKGWLNGSLVGFYKTTYMEDGQIRSIAATDHEPTDARKSFPCFDEPNKKSTYSISIIHPKEYSALSNMPEEKSEMVDDNWKKTTFVKSVPMSTYLVCFAVHRFTAIERKSRSGKPLKVYVQPNQKETAEYAANITQAVFDYFEDYFAMEYALPKLDKIAIPDFGTGAMENWGLVTYRETNLLYDPLLSASSNQQRVASVVAHELVHQWFGNTVTMDWWDDLWLNEGFASFFEFLGVNHAEKDWQMLSQVLLEDVFPVQEDDSLMSSHPVVVTVSTPAEITSVFDGISYSKGASILRMLQDWITPEKFQKGCQIYLKKFQFANAKTSDFWDSLQEASNLPVKEVMDTWTSQMGYPVVTVSGRQNITQKRFLLDSKADPSQPPSELGYTWNIPVRWADNDNSRITVYNRLDKGGITLNANLSGDAFLKINPDHIGFYRVNYEGGTWDWIAEALSSNHTRFSAADRSSFIDDAFALARAQLLNYKIALNLTMYLKSEEDFLPWERVISSVSYIISMFEDDRELYPMIETYFQGQVKPVADLLGWQDTGSHITKLLRASILGFACKMGDREALGNASQLFDSWLKGSASIPVNLRLLVYRYGMQNSGNEAAWNYTLEQYQKTSLAQEKEKLLYGLASVKDVKLLARYLEMLKDPNIIKTQDVFTVIRYISYNSYGKTMAWNWIQLNWDYLVSRFTINDRYLGRIVTIAEPFNTELQLWQMQSFFAKYPNAGAGAKPREQVLETVKNNIEWLNVNRQSIREWFASLP,./data/raw/alphafold//AF-P16406-F1-model_v4.pdb,352,714,149,2476 +194,3501,3574,MKMKMKLASFGLAAGLAAQVFLPYNALASTEHVTWNQQFQTPQFISGDLLKVNGTSPEELVYQYVEKNENKFKFHENAKDTLQLKEKKNDNLGFTFMRFQQTYKGIPVFGAVVTSHVKDGTLTALSGTLIPNLDTKGSLKSGKKLSEKQARDIAEKDLVANVTKEVPEYEQGKDTEFVVYVNGDEASLAYVVNLNFLTPEPGNWLYIIDAVDGKILNKFNQLDAAKPGDVKSITGTSTVGVGRGVLGDQKNINTTYSTYYYLQDNTRGNGIFTYDAKYRTTLPGSLWADADNQFFASYDAPAVDAHYYAGVTYDYYKNVHNRLSYDGNNAAIRSSVHYSQGYNNAFWNGSQMVYGDGDGQTFIPLSGGIDVVAHELTHAVTDYTAGLIYQNESGAINEAISDIFGTLVEFYANKNPDWEIGEDVYTPGISGDSLRSMSDPAKYGDPDHYSKRYTGTQDNGGVHINSGIINKAAYLISQGGTHYGVSVVGIGRDKLGKIFYRALTQYLTPTSNFSQLRAAAVQSATDLYGSTSQEVASVKQAFDAVGVK,brenda,P00800,CCc1nc2ccccc2c(=O)n1O,0.315,25.0,7.5,3.4.24.27,1427.0,-0.5016894462103995,-0.5016894462103995,CCc1nc2ccccc2c(=O)n1O__MKMKMKLASFGLAAGLAAQVFLPYNALASTEHVTWNQQFQTPQFISGDLLKVNGTSPEELVYQYVEKNENKFKFHENAKDTLQLKEKKNDNLGFTFMRFQQTYKGIPVFGAVVTSHVKDGTLTALSGTLIPNLDTKGSLKSGKKLSEKQARDIAEKDLVANVTKEVPEYEQGKDTEFVVYVNGDEASLAYVVNLNFLTPEPGNWLYIIDAVDGKILNKFNQLDAAKPGDVKSITGTSTVGVGRGVLGDQKNINTTYSTYYYLQDNTRGNGIFTYDAKYRTTLPGSLWADADNQFFASYDAPAVDAHYYAGVTYDYYKNVHNRLSYDGNNAAIRSSVHYSQGYNNAFWNGSQMVYGDGDGQTFIPLSGGIDVVAHELTHAVTDYTAGLIYQNESGAINEAISDIFGTLVEFYANKNPDWEIGEDVYTPGISGDSLRSMSDPAKYGDPDHYSKRYTGTQDNGGVHINSGIINKAAYLISQGGTHYGVSVVGIGRDKLGKIFYRALTQYLTPTSNFSQLRAAAVQSATDLYGSTSQEVASVKQAFDAVGVK,./data/raw/alphafold//AF-P00800-F1-model_v4.pdb,240,1601,941,2330 +195,2515,2576,MVQKESQATLEERESELSSNPAASAGASLEPPAAPAPGEDNPAGAGGAAVAGAAGGARRFLCGVVEGFYGRPWVMEQRKELFRRLQKWELNTYLYAPKDDYKHRMFWREMYSVEEAEQLMTLISAAREYEIEFIYAISPGLDITFSNPKEVSTLKRKLDQVSQFGCRSFALLFDDIDHNMCAADKEVFSSFAHAQVSITNEIYQYLGEPETFLFCPTEYCGTFCYPNVSQSPYLRTVGEKLLPGIEVLWTGPKVVSKEIPVESIEEVSKIIKRAPVIWDNIHANDYDQKRLFLGPYKGRSTELIPRLKGVLTNPNCEFEANYVAIHTLATWYKSNMNGVRKDVVMTDSEDSTVSIQIKLENEGSDEDIETDVLYSPQMALKLALTEWLQEFGVPHQYSSRQVAHSGAKASVVDGTPLVAAPSLNATTVVTTVYQEPIMSQGAALSGEPTTLTKEEEKKQPDEEPMDMVVEKQEETDHKNDNQILSEIVEAKMAEELKPMDTDKESIAESKSPEMSMQEDCISDIAPMQTDEQTNKEQFVPGPNEKPLYTAEPVTLEDLQLLADLFYLPYEHGPKGAQMLREFQWLRANSSVVSVNCKGKDSEKIEEWRSRAAKFEEMCGLVMGMFTRLSNCANRTILYDMYSYVWDIKSIMSMVKSFVQWLGCRSHSSAQFLIGDQEPWAFRGGLAGEFQRLLPIDGANDLFFQPPPLTPTSKVYTIRPYFPKDEASVYKICREMYDDGVGLPFQSQPDLIGDKLVGGLLSLSLDYCFVLEDEDGICGYALGTVDVTPFIKKCKISWIPFMQEKYTKPNGDKELSEAEKIMLSFHEEQEVLPETFLANFPSLIKMDIHKKVTDPSVAKSMMACLLSSLKANGSRGAFCEVRPDDKRILEFYSKLGCFEIAKMEGFPKDVVILGRSL,uniprot_search,O60502,CCCCCC(O)=N[C@H]1/C(=N\OC(O)=Nc2ccccc2)O[C@H](CO)[C@@H](O)[C@@H]1O,0.21,30.0,6.95,3.2.1.169,9606.0,-0.6777807052660807,-0.6777807052660807,CCCCCC(O)=N[C@H]1/C(=N\OC(O)=Nc2ccccc2)O[C@H](CO)[C@@H](O)[C@@H]1O__MVQKESQATLEERESELSSNPAASAGASLEPPAAPAPGEDNPAGAGGAAVAGAAGGARRFLCGVVEGFYGRPWVMEQRKELFRRLQKWELNTYLYAPKDDYKHRMFWREMYSVEEAEQLMTLISAAREYEIEFIYAISPGLDITFSNPKEVSTLKRKLDQVSQFGCRSFALLFDDIDHNMCAADKEVFSSFAHAQVSITNEIYQYLGEPETFLFCPTEYCGTFCYPNVSQSPYLRTVGEKLLPGIEVLWTGPKVVSKEIPVESIEEVSKIIKRAPVIWDNIHANDYDQKRLFLGPYKGRSTELIPRLKGVLTNPNCEFEANYVAIHTLATWYKSNMNGVRKDVVMTDSEDSTVSIQIKLENEGSDEDIETDVLYSPQMALKLALTEWLQEFGVPHQYSSRQVAHSGAKASVVDGTPLVAAPSLNATTVVTTVYQEPIMSQGAALSGEPTTLTKEEEKKQPDEEPMDMVVEKQEETDHKNDNQILSEIVEAKMAEELKPMDTDKESIAESKSPEMSMQEDCISDIAPMQTDEQTNKEQFVPGPNEKPLYTAEPVTLEDLQLLADLFYLPYEHGPKGAQMLREFQWLRANSSVVSVNCKGKDSEKIEEWRSRAAKFEEMCGLVMGMFTRLSNCANRTILYDMYSYVWDIKSIMSMVKSFVQWLGCRSHSSAQFLIGDQEPWAFRGGLAGEFQRLLPIDGANDLFFQPPPLTPTSKVYTIRPYFPKDEASVYKICREMYDDGVGLPFQSQPDLIGDKLVGGLLSLSLDYCFVLEDEDGICGYALGTVDVTPFIKKCKISWIPFMQEKYTKPNGDKELSEAEKIMLSFHEEQEVLPETFLANFPSLIKMDIHKKVTDPSVAKSMMACLLSSLKANGSRGAFCEVRPDDKRILEFYSKLGCFEIAKMEGFPKDVVILGRSL,./data/raw/alphafold//AF-O60502-F1-model_v4.pdb,428,1839,1208,2177 +196,8376,8511,MVRAIITNAPNGGVKIENVNINEPEHYEVKLRPVYTGLCGTDRGEVLGNLSFAYNEPGYNYLVLGHEAICQVIEASENPYKIKPGDYVVPVVRRPGKCVNCRIGREDDCSDGDKHEAGITGLHGFMRDYFYDEAKNLVKINDKNMVKVAVLTEPTKNVMKAFEVFDTVSKRSIFQGDDSTNLTKNCLIIGTGSEAFLYAFMAREYRFNVFMTNRHPVGEEKLSIISRINADFYDYTREDPLKGIDLLIDTSGDPGTIFRFVRKMNYNGVVILFGTNGRAPATSIDGEDIDYIIERNISLVGSVDGAKRHYLRAVEYLEKWNYSEGSVINRLITGVFEPEDVSIFTKKPENEIKSVIKWS,brenda,Q6L047,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,5.9,55.0,6.5,1.1.1.360,46632.0,0.7708520116421442,0.7708520116421442,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MVRAIITNAPNGGVKIENVNINEPEHYEVKLRPVYTGLCGTDRGEVLGNLSFAYNEPGYNYLVLGHEAICQVIEASENPYKIKPGDYVVPVVRRPGKCVNCRIGREDDCSDGDKHEAGITGLHGFMRDYFYDEAKNLVKINDKNMVKVAVLTEPTKNVMKAFEVFDTVSKRSIFQGDDSTNLTKNCLIIGTGSEAFLYAFMAREYRFNVFMTNRHPVGEEKLSIISRINADFYDYTREDPLKGIDLLIDTSGDPGTIFRFVRKMNYNGVVILFGTNGRAPATSIDGEDIDYIIERNISLVGSVDGAKRHYLRAVEYLEKWNYSEGSVINRLITGVFEPEDVSIFTKKPENEIKSVIKWS,./data/raw/alphafold//AF-Q6L047-F1-model_v4.pdb,1271,889,2195,1038 +197,5013,5108,MEMEKEFEQIDKSGSWAAIYQDIRHEASDFPCRVAKLPKNKNRNRYRDVSPFDHSRIKLHQEDNDYINASLIKMEEAQRSYILTQGPLPNTCGHFWEMVWEQKSRGVVMLNRVMEKGSLKCAQYWPQKEEKEMIFEDTNLKLTLISEDIKSYYTVRQLELENLTTQETREILHFHYTTWPDFGVPESPASFLNFLFKVRESGSLSPEHGPVVVHCSAGIGRSGTFCLADTCLLLMDKRKDPSSVDIKKVLLEMRKFRMGLIQTADQLRFSYLAVIEGAKFIMGDSSVQDQWKELSHEDLEPPPEHIPPPPRPPKRILEPHNGKCREFFPNHQWVKEETQEDKDCPIKEEKGSPLNAAPYGIESMSQDTEVRSRVVGGSLRGAQAASPAKGEPSLPEKDEDHALSYWKPFLVNMCVATVLTAGAYLCYRFLFNSNT,brenda,P18031,Cc1[nH]ccc(=O)c1[O-].Cc1[nH]ccc(=O)c1[O-].[O].[V+2],0.0382,22.0,5.0,3.1.3.48,9606.0,-1.417936637088291,-1.417936637088291,Cc1[nH]ccc(=O)c1[O-].Cc1[nH]ccc(=O)c1[O-].[O].[V+2]__MEMEKEFEQIDKSGSWAAIYQDIRHEASDFPCRVAKLPKNKNRNRYRDVSPFDHSRIKLHQEDNDYINASLIKMEEAQRSYILTQGPLPNTCGHFWEMVWEQKSRGVVMLNRVMEKGSLKCAQYWPQKEEKEMIFEDTNLKLTLISEDIKSYYTVRQLELENLTTQETREILHFHYTTWPDFGVPESPASFLNFLFKVRESGSLSPEHGPVVVHCSAGIGRSGTFCLADTCLLLMDKRKDPSSVDIKKVLLEMRKFRMGLIQTADQLRFSYLAVIEGAKFIMGDSSVQDQWKELSHEDLEPPPEHIPPPPRPPKRILEPHNGKCREFFPNHQWVKEETQEDKDCPIKEEKGSPLNAAPYGIESMSQDTEVRSRVVGGSLRGAQAASPAKGEPSLPEKDEDHALSYWKPFLVNMCVATVLTAGAYLCYRFLFNSNT,./data/raw/alphafold//AF-P18031-F1-model_v4.pdb,393,1520,847,2226 +198,5083,5179,MIERRKIAVIGSGQIGGNIAYIVGKDNLADVVLFDIAEGIPQGKALDITHSMVMFGSTSKVIGTNDYADISGSDVVIITASIPGRPKDDRSELLFGNARILDSVAEGVKKYCPNAFVICITNPLDVMVSHFQKVSGLPHNKVCGMAGVLDSSRFRTFIAQHFGVNASDVSANVIGGHGDGMVPVTSSVSVGGVPLSSFIKQGLITQEQIDEIVCHTRIAWKEVADNLKTGTAYFAPAAAAVKMAEAYLKDRKAVVPCSAFCSNHYGVKGIYMGVPTIIGKNGVEDILELDLTPLKQKLLGESINEVNTISKVLDNAPAAGA,brenda,Q9GT92,Cc1cc2c(C(C)C)c(O)c(O)c(C=O)c2c(O)c1-c1c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c2c1O,0.0116,25.0,5.5,1.1.1.27,5807.0,-1.9355420107730816,-1.9355420107730816,Cc1cc2c(C(C)C)c(O)c(O)c(C=O)c2c(O)c1-c1c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c2c1O__MIERRKIAVIGSGQIGGNIAYIVGKDNLADVVLFDIAEGIPQGKALDITHSMVMFGSTSKVIGTNDYADISGSDVVIITASIPGRPKDDRSELLFGNARILDSVAEGVKKYCPNAFVICITNPLDVMVSHFQKVSGLPHNKVCGMAGVLDSSRFRTFIAQHFGVNASDVSANVIGGHGDGMVPVTSSVSVGGVPLSSFIKQGLITQEQIDEIVCHTRIAWKEVADNLKTGTAYFAPAAAAVKMAEAYLKDRKAVVPCSAFCSNHYGVKGIYMGVPTIIGKNGVEDILELDLTPLKQKLLGESINEVNTISKVLDNAPAAGA,./data/raw/alphafold//AF-Q9GT92-F1-model_v4.pdb,239,339,415,392 +199,5463,5562,MSDPLHVTFVCTGNICRSPMAEKMFAQQLRHRGLGDAVRVTSAGTGNWHVGSCADERAAGVLRAHGYPTDHRAAQVGTEHLAADLLVALDRNHARLLRQLGVEAARVRMLRSFDPRSGTHALDVEDPYYGDHSDFEEVFAVIESALPGLHDWVDERLARNGPS,brenda,P9WIA1,Cn1cc(-c2ccc(C(F)(F)P(=O)(O)O)cc2)cn1,0.1,37.0,6.2,3.1.3.48,1773.0,-1.0,-1.0,Cn1cc(-c2ccc(C(F)(F)P(=O)(O)O)cc2)cn1__MSDPLHVTFVCTGNICRSPMAEKMFAQQLRHRGLGDAVRVTSAGTGNWHVGSCADERAAGVLRAHGYPTDHRAAQVGTEHLAADLLVALDRNHARLLRQLGVEAARVRMLRSFDPRSGTHALDVEDPYYGDHSDFEEVFAVIESALPGLHDWVDERLARNGPS,./data/raw/alphafold//AF-P9WIA1-F1-model_v4.pdb,378,1781,1143,2561 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+242,6024,6129,MAKGFYISKSLGILGILLGVAAVCTIIALSVVYSQEKNKNANSSPVASTTPSASATTNPASATTLDQSKAWNRYRLPNTLKPDSYRVTLRPYLTPNDRGLYVFKGSSTVRFTCKEATDVIIIHSKKLNYTLSQGHRVVLRGVGGSQPPDIDKTELVEPTEYLVVHLKGSLVKDSQYEMDSEFEGELADDLAGFYRSEYMEGNVRKVVATTQMQAADARKSFPCFDEPAMKAEFNITLIHPKDLTALSNMLPKGPSTPLPEDPNWNVTEFHTTPKMSTYLLAFIVSEFDYVEKQASNGVLIRIWARPSAIAAGHGDYALNVTGPILNFFAGHYDTPYPLPKSDQIGLPDFNAGAMENWGLVTYRENSLLFDPLSSSSSNKERVVTVIAHELAHQWFGNLVTIEWWNDLWLNEGFASYVEYLGADYAEPTWNLKDLMVLNDVYRVMAVDALASSHPLSTPASEINTPAQISELFDAISYSKGASVLRMLSSFLSEDVFKQGLASYLHTFAYQNTIYLNLWDHLQEAVNNRSIQLPTTVRDIMNRWTLQMGFPVITVDTSTGTLSQEHFLLDPDSNVTRPSEFNYVWIVPITSIRDGRQQQDYWLIDVRAQNDLFSTSGNEWVLLNLNVTGYYRVNYDEENWRKIQTQLQRDHSAIPVINRAQIINDAFNLASAHKVPVTLALNNTLFLIEERQYMPWEAALSSLSYFKLMFDRSEVYGPMKNYLKKQVTPLFIHFRNNTNNWREIPENLMDQYSEVNAISTACSNGVPECEEMVSGLFKQWMENPNNNPIHPNLRSTVYCNAIAQGGEEEWDFAWEQFRNATLVNEADKLRAALACSKELWILNRYLSYTLNPDLIRKQDATSTIISITNNVIGQGLVWDFVQSNWKKLFNDYGGGSFSFSNLIQAVTRRFSTEYELQQLEQFKKDNEETGFGSGTRALEQALEKTKANIKWVKENKEVVLQWFTENSK,uniprot_search,P15144,N=C(O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N=C(O)C1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1,0.169,34.5,7.09375,3.4.11.2,9606.0,-0.7721132953863264,-0.7721132953863264,N=C(O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N=C(O)C1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1__MAKGFYISKSLGILGILLGVAAVCTIIALSVVYSQEKNKNANSSPVASTTPSASATTNPASATTLDQSKAWNRYRLPNTLKPDSYRVTLRPYLTPNDRGLYVFKGSSTVRFTCKEATDVIIIHSKKLNYTLSQGHRVVLRGVGGSQPPDIDKTELVEPTEYLVVHLKGSLVKDSQYEMDSEFEGELADDLAGFYRSEYMEGNVRKVVATTQMQAADARKSFPCFDEPAMKAEFNITLIHPKDLTALSNMLPKGPSTPLPEDPNWNVTEFHTTPKMSTYLLAFIVSEFDYVEKQASNGVLIRIWARPSAIAAGHGDYALNVTGPILNFFAGHYDTPYPLPKSDQIGLPDFNAGAMENWGLVTYRENSLLFDPLSSSSSNKERVVTVIAHELAHQWFGNLVTIEWWNDLWLNEGFASYVEYLGADYAEPTWNLKDLMVLNDVYRVMAVDALASSHPLSTPASEINTPAQISELFDAISYSKGASVLRMLSSFLSEDVFKQGLASYLHTFAYQNTIYLNLWDHLQEAVNNRSIQLPTTVRDIMNRWTLQMGFPVITVDTSTGTLSQEHFLLDPDSNVTRPSEFNYVWIVPITSIRDGRQQQDYWLIDVRAQNDLFSTSGNEWVLLNLNVTGYYRVNYDEENWRKIQTQLQRDHSAIPVINRAQIINDAFNLASAHKVPVTLALNNTLFLIEERQYMPWEAALSSLSYFKLMFDRSEVYGPMKNYLKKQVTPLFIHFRNNTNNWREIPENLMDQYSEVNAISTACSNGVPECEEMVSGLFKQWMENPNNNPIHPNLRSTVYCNAIAQGGEEEWDFAWEQFRNATLVNEADKLRAALACSKELWILNRYLSYTLNPDLIRKQDATSTIISITNNVIGQGLVWDFVQSNWKKLFNDYGGGSFSFSNLIQAVTRRFSTEYELQQLEQFKKDNEETGFGSGTRALEQALEKTKANIKWVKENKEVVLQWFTENSK,./data/raw/alphafold//AF-P15144-F1-model_v4.pdb,34,1264,550,1866 +243,8322,8456,MSVKGDIGVIGLAVMGQNLILNMNDHGFKVVAYNRTTSKVDEFLQGAAKGTNIIGAYSLEDLAAKLEKPRKVMLMVRAGDVVDQFIEALLPHLEEGDIIIDGGNSNYPDTNRRVKALAEKGIRFIGSGVSGGEEGARHGPSIMPGGNQEAWQYVKPIFQAISAKTEQGEPCCDWVGGEGAGHFVKMVHNGIEYGDMQLICEAYQFLKEGLGLSYEEMQAIFAEWKNTELDSYLIDITTDILGYKDASGEPLVEKILDTAGQKGTGKWTGINALDFGIPLTLITESVFARCVSSFKDQRVAANQLFGKTITPVEGDKKVWIEAVRKALLASKIISYAQGFMLIREASEQFGWDINYGATALLWREGCIIRSRFLGNIRDAYEANPNLVFLGSDSYFKGILENALSDWRKVVAKSIEVGIPMPCMASAITFLDGYTSARLPANLLQAQRDYFGAHTYERTDKPRGEFFHTNWTGRGGNTASTTYDV,sabio,P43774,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O,2.82,23.0,7.0,1.1.1.44,727.0,0.450249108319361,0.450249108319361,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O__MSVKGDIGVIGLAVMGQNLILNMNDHGFKVVAYNRTTSKVDEFLQGAAKGTNIIGAYSLEDLAAKLEKPRKVMLMVRAGDVVDQFIEALLPHLEEGDIIIDGGNSNYPDTNRRVKALAEKGIRFIGSGVSGGEEGARHGPSIMPGGNQEAWQYVKPIFQAISAKTEQGEPCCDWVGGEGAGHFVKMVHNGIEYGDMQLICEAYQFLKEGLGLSYEEMQAIFAEWKNTELDSYLIDITTDILGYKDASGEPLVEKILDTAGQKGTGKWTGINALDFGIPLTLITESVFARCVSSFKDQRVAANQLFGKTITPVEGDKKVWIEAVRKALLASKIISYAQGFMLIREASEQFGWDINYGATALLWREGCIIRSRFLGNIRDAYEANPNLVFLGSDSYFKGILENALSDWRKVVAKSIEVGIPMPCMASAITFLDGYTSARLPANLLQAQRDYFGAHTYERTDKPRGEFFHTNWTGRGGNTASTTYDV,./data/raw/alphafold//AF-P43774-F1-model_v4.pdb,125,1240,680,2025 +244,8632,8769,MRYLTAGESHGPGLTTIIEGLPAGMPLLAEDVNKELKRRQGGHGRGARMRIEKDQVQITAGIRHGKTLGAPVAMFVENKDWKHWETVMSIEPVPEKNEKSRRVSRPRPGHADLVGGMKYGHNDMRNVLERSSARETTVRVAAGAVAKKLLHELGIEVAGHVLEIGGTRANLTRDYAVSEIQETSEASPVRCLDGVAAEEMMQKIDDAKKNGDTIGGIVEVVVGGVPAGLGSYVQWDKKLDAKIARAIVSINAFKGAEFGVGFEAARKPGSEVMDEILWSKEDGYTRRTNNLGGFEGGMTNGMPIVVRGVMKPIPTLYKPLQSVDIDSKETFNASVERSDSCAVPAASVVAEAVVAWEVAVAVLEKFDGDRFDTLKKHVEEHRNLTKEF,brenda,Q71Y87,O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)c1ccc2ccccc2c1,8.32e-06,25.0,7.5,4.2.3.5,1639.0,-5.079876673709276,-5.079876673709276,O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)c1ccc2ccccc2c1__MRYLTAGESHGPGLTTIIEGLPAGMPLLAEDVNKELKRRQGGHGRGARMRIEKDQVQITAGIRHGKTLGAPVAMFVENKDWKHWETVMSIEPVPEKNEKSRRVSRPRPGHADLVGGMKYGHNDMRNVLERSSARETTVRVAAGAVAKKLLHELGIEVAGHVLEIGGTRANLTRDYAVSEIQETSEASPVRCLDGVAAEEMMQKIDDAKKNGDTIGGIVEVVVGGVPAGLGSYVQWDKKLDAKIARAIVSINAFKGAEFGVGFEAARKPGSEVMDEILWSKEDGYTRRTNNLGGFEGGMTNGMPIVVRGVMKPIPTLYKPLQSVDIDSKETFNASVERSDSCAVPAASVVAEAVVAWEVAVAVLEKFDGDRFDTLKKHVEEHRNLTKEF,./data/raw/alphafold//AF-Q71Y87-F1-model_v4.pdb,720,2198,1624,215 +245,11608,11786,MLEHLVQAVAVGHALVDLRLYVERIPGVDEEAVIKDETRSVGGSAANVAVVLRRLGVQSGIIGKIGLDDFGRIAVDNLMREGVDISGLRVSLRDRTGFSVVVRDKEGSITIYSFKGAAEKLEPGEIDADAIGRSKHVHVASLRPDTTLKTVEIAKKRSITVSWDPGRVLSKMGAERLANIISKVDIIFVNRNEAKNLTGYHDYRQAARHLKKLGPKIVVIKLGASGSYILYSDGEVFVPAIKPERVVDTTGAGDSYAAGFIAGLLRGYTIEKASLYATIVASIKVSRLGSNAAPSHEEVVEKARELGVEI,brenda,Q9YG89,[Cl-].[Na+],1.0,85.0,6.7,2.7.1.11,56636.0,0.0,0.0,[Cl-].[Na+]__MLEHLVQAVAVGHALVDLRLYVERIPGVDEEAVIKDETRSVGGSAANVAVVLRRLGVQSGIIGKIGLDDFGRIAVDNLMREGVDISGLRVSLRDRTGFSVVVRDKEGSITIYSFKGAAEKLEPGEIDADAIGRSKHVHVASLRPDTTLKTVEIAKKRSITVSWDPGRVLSKMGAERLANIISKVDIIFVNRNEAKNLTGYHDYRQAARHLKKLGPKIVVIKLGASGSYILYSDGEVFVPAIKPERVVDTTGAGDSYAAGFIAGLLRGYTIEKASLYATIVASIKVSRLGSNAAPSHEEVVEKARELGVEI,./data/raw/alphafold//AF-Q9YG89-F1-model_v4.pdb,885,408,491,474 +246,6196,6304,MGRPLHLVLLSASLAGLLLLGESLFIRREQANNILARVTRANSFLEEMKKGHLERECMEETCSYEEAREVFEDSDKTNEFWNKYKDGDQCETSPCQNQGKCKDGLGEYTCTCLEGFEGKNCELFTRKLCSLDNGDCDQFCHEEQNSVVCSCARGYTLADNGKACIPTGPYPCGKQTLERRKRSVAQATSSSGEAPDSITWKPYDAADLDPTENPFDLLDFNQTQPERGDNNLTRIVGGQECKDGECPWQALLINEENEGFCGGTILSEFYILTAAHCLYQAKRFKVRVGDRNTEQEEGGEAVHEVEVVIKHNRFTKETYDFDIAVLRLKTPITFRMNVAPACLPERDWAESTLMTQKTGIVSGFGRTHEKGRQSTRLKMLEVPYVDRNSCKLSSSFIITQNMFCAGYDTKQEDACQGDSGGPHVTRFKDTYFVTGIVSWGEGCARKGKYGIYTKVTAFLKWIDRSMKTRGLPKAKSHAPEVITSSPLK,brenda,P00742,N=c1[nH]ccc2ccc(CN3CC[C@H](NS(=O)(=O)c4cc5ncccc5s4)C3=O)cc12,0.004,23.0,6.8,3.4.21.6,9606.0,-2.397940008672037,-4.027758663924915,N=c1[nH]ccc2ccc(CN3CC[C@H](NS(=O)(=O)c4cc5ncccc5s4)C3=O)cc12__MGRPLHLVLLSASLAGLLLLGESLFIRREQANNILARVTRANSFLEEMKKGHLERECMEETCSYEEAREVFEDSDKTNEFWNKYKDGDQCETSPCQNQGKCKDGLGEYTCTCLEGFEGKNCELFTRKLCSLDNGDCDQFCHEEQNSVVCSCARGYTLADNGKACIPTGPYPCGKQTLERRKRSVAQATSSSGEAPDSITWKPYDAADLDPTENPFDLLDFNQTQPERGDNNLTRIVGGQECKDGECPWQALLINEENEGFCGGTILSEFYILTAAHCLYQAKRFKVRVGDRNTEQEEGGEAVHEVEVVIKHNRFTKETYDFDIAVLRLKTPITFRMNVAPACLPERDWAESTLMTQKTGIVSGFGRTHEKGRQSTRLKMLEVPYVDRNSCKLSSSFIITQNMFCAGYDTKQEDACQGDSGGPHVTRFKDTYFVTGIVSWGEGCARKGKYGIYTKVTAFLKWIDRSMKTRGLPKAKSHAPEVITSSPLK,./data/raw/alphafold//AF-P00742-F1-model_v4.pdb,347,2196,846,2225 +247,6878,6994,ILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLAIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHSLLGGVVDDQAGPGAWVRGVQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAG,uniprot_search,Q7M0F8,NCCCCO,0.28,37.0,8.0,2.3.2.13,10141.0,-0.5528419686577808,-0.5528419686577808,NCCCCO__ILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLAIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHSLLGGVVDDQAGPGAWVRGVQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAG,./data/raw/alphafold//AF-Q7M0F8-F1-model_v4.pdb,1754,1492,816,2190 +248,10138,10293,MAEEQFLAVAVDAAKSAGEIIRKSFYLTKNVEHKGQVDLVTETDKACEDLIFNHLRMLYPDHKFIGEETSAALGSTDDLTYDPTWIVDPLDGTTNFVHGFPFVCVSIGLTIGKIPTVGVVYNPIMNELFTAVRGKGAFLNGSPIRTSPQNELVKALMVTEVGTKRDKSTLDDTTNRINKLLFKIRSIRMCGSLALNMCGVACGRLDLCYEIGFGGPWDVAAGALILKEAGGFVFDPSGDEFDLMAQRMAGSNGHLKDQFIEALGDAS,brenda,B3DFH0,O=P(O)(O)OC1C(O)C(O)C(O)C(O)C1O,3.84,30.0,6.0,3.1.3.25,4513.0,0.5843312243675308,0.5843312243675308,O=P(O)(O)OC1C(O)C(O)C(O)C(O)C1O__MAEEQFLAVAVDAAKSAGEIIRKSFYLTKNVEHKGQVDLVTETDKACEDLIFNHLRMLYPDHKFIGEETSAALGSTDDLTYDPTWIVDPLDGTTNFVHGFPFVCVSIGLTIGKIPTVGVVYNPIMNELFTAVRGKGAFLNGSPIRTSPQNELVKALMVTEVGTKRDKSTLDDTTNRINKLLFKIRSIRMCGSLALNMCGVACGRLDLCYEIGFGGPWDVAAGALILKEAGGFVFDPSGDEFDLMAQRMAGSNGHLKDQFIEALGDAS,./data/raw/alphafold//AF-B3DFH0-F1-model_v4.pdb,1469,1151,2486,1354 +249,6969,7087,MRALVLLLSLFLLGGQAQHVSDWTYSEGALDEAHWPQHYPACGGQRQSPINLQRTKVRYNPSLKGLNMTGYETQAGEFPMVNNGHTVQISLPSTMRMTVADGTVYIAQQMHFHWGGASSEISGSEHTVDGIRHVIEIHIVHYNSKYKSYDIAQDAPDGLAVLAAFVEVKNYPENTYYSNFISHLANIKYPGQRTTLTGLDVQDMLPRNLQHYYTYHGSLTTPPCTENVHWFVLADFVKLSRTQVWKLENSLLDHRNKTIHNDYRRTQPLNHRVVESNFPNQEYTLGSEFQFYLHKIEEILDYLRRALN,brenda,P23280,NCCc1ccc(S(N)(=O)=O)cc1,0.000813,20.0,7.5,4.2.1.1,9606.0,-3.089909454405932,-3.089909454405932,NCCc1ccc(S(N)(=O)=O)cc1__MRALVLLLSLFLLGGQAQHVSDWTYSEGALDEAHWPQHYPACGGQRQSPINLQRTKVRYNPSLKGLNMTGYETQAGEFPMVNNGHTVQISLPSTMRMTVADGTVYIAQQMHFHWGGASSEISGSEHTVDGIRHVIEIHIVHYNSKYKSYDIAQDAPDGLAVLAAFVEVKNYPENTYYSNFISHLANIKYPGQRTTLTGLDVQDMLPRNLQHYYTYHGSLTTPPCTENVHWFVLADFVKLSRTQVWKLENSLLDHRNKTIHNDYRRTQPLNHRVVESNFPNQEYTLGSEFQFYLHKIEEILDYLRRALN,./data/raw/alphafold//AF-P23280-F1-model_v4.pdb,594,2044,1448,1727 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+285,5466,5565,MSGCPFLGNNFGYTFKKLPVEGSEEDKSQTGVNRASKGGLIYGNYLHLEKVLNAQELQSETKGNKIHDEHLFIITHQAYELWFKQILWELDSVREIFQNGHVRDERNMLKVVSRMHRVSVILKLLVQQFSILETMTALDFNDFREYLSPASGFQSLQFRLLENKIGVLQNMRVPYNRRHYRDNFKGEENELLLKSEQEKTLLELVEAWLERTPGLEPHGFNFWGKLEKNITRGLEEEFIRIQAKEESEEKEEQVAEFQKQKEVLLSLFDEKRHEHLLSKGERRLSYRALQGALMIYFYREEPRFQVPFQLLTSLMDIDSLMTKWRYNHVCMVHRMLGSKAGTGGSSGYHYLRSTVSDRYKVFVDLFNLSTYLIPRHWIPKMNPTIHKFLYTAEYCDSSYFSSDESD,brenda,P48775,Cn1cc(CC(N)C(=O)O)c2ccccc21,0.023,25.0,7.033333333333334,1.13.11.52,9606.0,-1.6382721639824072,-1.6382721639824072,Cn1cc(CC(N)C(=O)O)c2ccccc21__MSGCPFLGNNFGYTFKKLPVEGSEEDKSQTGVNRASKGGLIYGNYLHLEKVLNAQELQSETKGNKIHDEHLFIITHQAYELWFKQILWELDSVREIFQNGHVRDERNMLKVVSRMHRVSVILKLLVQQFSILETMTALDFNDFREYLSPASGFQSLQFRLLENKIGVLQNMRVPYNRRHYRDNFKGEENELLLKSEQEKTLLELVEAWLERTPGLEPHGFNFWGKLEKNITRGLEEEFIRIQAKEESEEKEEQVAEFQKQKEVLLSLFDEKRHEHLLSKGERRLSYRALQGALMIYFYREEPRFQVPFQLLTSLMDIDSLMTKWRYNHVCMVHRMLGSKAGTGGSSGYHYLRSTVSDRYKVFVDLFNLSTYLIPRHWIPKMNPTIHKFLYTAEYCDSSYFSSDESD,./data/raw/alphafold//AF-P48775-F1-model_v4.pdb,828,341,417,394 +286,4178,4260,MLQSNEYFSGKVKSIGFSSSSTGRASVGVMVEGEYTFSTAEPEEMTVISGALNVLLPDATDWQVYEAGSVFNVPGHSEFHLQVAEPTSYLCRYL,brenda,P0C037,COc1cc(O)c2c(=O)cc(-c3c(OC)ccc(O)c3O)oc2c1,0.1131,30.0,7.0,2.4.2.4,562.0,-0.9465373950745448,-0.9465373950745448,COc1cc(O)c2c(=O)cc(-c3c(OC)ccc(O)c3O)oc2c1__MLQSNEYFSGKVKSIGFSSSSTGRASVGVMVEGEYTFSTAEPEEMTVISGALNVLLPDATDWQVYEAGSVFNVPGHSEFHLQVAEPTSYLCRYL,./data/raw/alphafold//AF-P0C037-F1-model_v4.pdb,460,1881,1257,2687 +287,1379,1411,MESSGPSSCHSAARRPLHSAQAVDVASASSFRAFEILHLHLDLRAEFGPPGPGPGSRGLNGKATLELRCLLPEGASELRLDSHSCLEVMAATLLRGQPGDQQQLTEPVPFHTQPFSHYGQALCVVFPKPCCAAERFRLELTYRVGEGPGVCWLAPEQTAGKKKPFVYTQGQAVLNRAFFPCFDTPAVKCTYSALVEVPDGFTAVMSASTWERRGPNKFFFQMSQPIPSYLIALAIGDLASAEVGPRSRVWAEPCLIEAAKEEYNGVIEEFLATGEKLFGPYVWGRYDLLFMPPSFPFGGMENPCLTFVTPCLLAGDRSLADVIIHEISHSWFGNLVTNANWGEFWLNEGFTMYAQRRISTILFGAAYTCLEAATGRALLRQHMDVSGEENPLNKLRVKIEPGVDPDDTYNETPYEKGYCFVSYLAHLVGDQEQFDKFLKAYVDEFKFQSILAEDFLEFYLEYFPELKKKGVDSIPGFEFNRWLNTPGWPPYLPDLSPGDSLMKPAEELAELWAASEPDMQAIEAVAISTWKTYQLVYFLDKILQKSPLPPGNVKKLGETYPKISNAQNAELRLRWGQIILKNDHQEEFWKVKDFLQSQGKQKYTLPLYHAMMGGSEMARTLAKETFSATASQLHSNVVNYVQQILAPKGS,uniprot_search,O09175,CC(C)C[C@H](N)C(O)=NO,0.024,27.5,6.8,3.4.11.6,10116.0,-1.619788758288394,-1.619788758288394,CC(C)C[C@H](N)C(O)=NO__MESSGPSSCHSAARRPLHSAQAVDVASASSFRAFEILHLHLDLRAEFGPPGPGPGSRGLNGKATLELRCLLPEGASELRLDSHSCLEVMAATLLRGQPGDQQQLTEPVPFHTQPFSHYGQALCVVFPKPCCAAERFRLELTYRVGEGPGVCWLAPEQTAGKKKPFVYTQGQAVLNRAFFPCFDTPAVKCTYSALVEVPDGFTAVMSASTWERRGPNKFFFQMSQPIPSYLIALAIGDLASAEVGPRSRVWAEPCLIEAAKEEYNGVIEEFLATGEKLFGPYVWGRYDLLFMPPSFPFGGMENPCLTFVTPCLLAGDRSLADVIIHEISHSWFGNLVTNANWGEFWLNEGFTMYAQRRISTILFGAAYTCLEAATGRALLRQHMDVSGEENPLNKLRVKIEPGVDPDDTYNETPYEKGYCFVSYLAHLVGDQEQFDKFLKAYVDEFKFQSILAEDFLEFYLEYFPELKKKGVDSIPGFEFNRWLNTPGWPPYLPDLSPGDSLMKPAEELAELWAASEPDMQAIEAVAISTWKTYQLVYFLDKILQKSPLPPGNVKKLGETYPKISNAQNAELRLRWGQIILKNDHQEEFWKVKDFLQSQGKQKYTLPLYHAMMGGSEMARTLAKETFSATASQLHSNVVNYVQQILAPKGS,./data/raw/alphafold//AF-O09175-F1-model_v4.pdb,333,1725,1077,2486 +288,3613,3689,MRVCIIGAGVIGHSTAQSIYQHFHDRIAPLTIEVYADVFTPLTTSDGAAGLWQPYLYDKGNVQETKWNKETFQYLLSCLSSPDSVRMGIFLQSGYNLCTEPLPDPSFKDTVLGFRKLTQRELDMFPGYSFGWFNTALMVEGKTYLPWLMDWLRQRKVKFYQRKIGSFKELADIGADVIINCSGVRSGDLQPDPELQPGRGQIIKVDAPWLKHWILTHDSSSGVYNSPYIIPGSRLVTVGGVFQIGNWNLQNSSVDHKGIWEAACKLDPSLQHARIVEDWTGLRPARSKVRLERETIRSGPTSFEVIHNYGHGGFGLTIHRGCAEEAARLFGQILEQKGLLAHSKSRL,sabio,Q6TGN2,CN(CC(=O)O)C(=N)N,5.1,37.0,8.0,1.4.3.3,7962.0,0.7075701760979364,0.7075701760979364,CN(CC(=O)O)C(=N)N__MRVCIIGAGVIGHSTAQSIYQHFHDRIAPLTIEVYADVFTPLTTSDGAAGLWQPYLYDKGNVQETKWNKETFQYLLSCLSSPDSVRMGIFLQSGYNLCTEPLPDPSFKDTVLGFRKLTQRELDMFPGYSFGWFNTALMVEGKTYLPWLMDWLRQRKVKFYQRKIGSFKELADIGADVIINCSGVRSGDLQPDPELQPGRGQIIKVDAPWLKHWILTHDSSSGVYNSPYIIPGSRLVTVGGVFQIGNWNLQNSSVDHKGIWEAACKLDPSLQHARIVEDWTGLRPARSKVRLERETIRSGPTSFEVIHNYGHGGFGLTIHRGCAEEAARLFGQILEQKGLLAHSKSRL,./data/raw/alphafold//AF-Q6TGN2-F1-model_v4.pdb,1084,733,1525,104 +289,4018,4097,MAKNVVLDHDGNLDDFVAMVLLASNTEKVRLIGALCTDADCFVENGFNVTGKIMCLMHNNMNLPLFPIGKSAATAVNPFPKEWRCLAKNMDDMPILNIPENVELWDKIKAENEKYEGQQLLADLVMNSEEKVTICVTGPLSNVAWCIDKYGEKFTSKVEECVIMGGAVDVRGNVFLPSTDGTAEWNIYWDPASAKTVFGCPGLRRIMFSLDSTNTVPVRSPYVQRFGEQTNFLLSILVGTMWAMCTHCELLRDGDGYYAWDALTAAYVVDQKVANVDPVPIDVVVDKQPNEGATVRTDAEKYPLTFVARNPEAEFFLDMLLRSARAC,brenda,Q9GPQ4,COC1CCCC2C(CN3C[C@H](O)[C@H](O)[C@H]3CO)=CNC12,0.0023,35.0,7.0,3.2.2.1,5699.0,-2.638272163982407,-2.638272163982407,COC1CCCC2C(CN3C[C@H](O)[C@H](O)[C@H]3CO)=CNC12__MAKNVVLDHDGNLDDFVAMVLLASNTEKVRLIGALCTDADCFVENGFNVTGKIMCLMHNNMNLPLFPIGKSAATAVNPFPKEWRCLAKNMDDMPILNIPENVELWDKIKAENEKYEGQQLLADLVMNSEEKVTICVTGPLSNVAWCIDKYGEKFTSKVEECVIMGGAVDVRGNVFLPSTDGTAEWNIYWDPASAKTVFGCPGLRRIMFSLDSTNTVPVRSPYVQRFGEQTNFLLSILVGTMWAMCTHCELLRDGDGYYAWDALTAAYVVDQKVANVDPVPIDVVVDKQPNEGATVRTDAEKYPLTFVARNPEAEFFLDMLLRSARAC,./data/raw/alphafold//AF-Q9GPQ4-F1-model_v4.pdb,692,2159,1580,164 +290,1870,1916,MHVEQTRINMQSQGQSHQLPSAAHILLDQNPNSTGSNLVVKQNDIQSLSSVGLLELAHREYQAVDYESAEKHCMQLWRQDSTNTGVLLLLSSIHFQCRRLDKSAQFSTLAIKQNPVLAEAYSNLGNVFKERGQLQEALDNYRRAVRLKPDFIDGYINLAAALVAARDMESAVQAYITALQYNPDLYCVRSDLGNLLKALGRLEEAKACYLKAIETCPGFAVAWSNLGCVFNAQGEIWLAIHHFEKAVTLDPNFLDAYINLGNVLKEARIFDRAVAAYLRALNLSPNNAVVHGNLACVYYEQGLIDLAIDTYRRAIELQPNFPDAYCNLANALKEKGQVKEAEDCYNTALRLCSNHADSLNNLANIKREQGYIEEATRLYLKALEVFPDFAAAHSNLASVLQQQGKLKEALMHYKEAIRIQPTFADAYSNMGNTLKELQDVSGALQCYTRAIQINPAFADAHSNLASIHKDSGNIPEAIQSYRTALKLKPDFPDAYCNLAHCLQIVCDWTDYDIRMKKLVSIVTEQLEKNRLPSVHPHHSMLYPLTHDCRKAIAARHANLCLEKVHVLHKKPYNFLKKLPTKGRLRIGYLSSDFGNHPTSHLMQSVPGLHDRSKVEIFCYALSPDDGTTFRHKISRESENFVDLSQIPCNGKAADKIFNDGIHILVNMNGYTKGARNEIFALRPAPIQVMWLGYPGTSGASFMDYIITDSVTSPLELAYQYSEKLSYMPHTYFIGDHKQMFPHLKERIIVCDKQQSSVVDNVTVINATDLSPLVENTDVKEIKEVVNAQKPVEITHKVAELPNTTQIVSMIATGQVQTSLNGVVVQNGLATTQTNNKAATGEEVPQNIVITTRRQYMLPDDAVVYCNFNQLYKIDPQTLESWVEILKNVPKSVLWLLRFPAVGEQNIKKTVSDFGISPDRVIFSNVAAKEEHVRRGQLADICLDTPLCNGHTTSMDVLWTGTPVVTLPGETLASRVAASQLATLGCPELIARTREEYQNIAIRLGTKKEYLKALRAKVWKARVESPLFDCSQYAKGLEKLFLRMWEKYENGELPDHISAV,brenda,Q7KJA9,CC(O)=N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1SP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2ccc(O)nc2=O)[C@H](O)[C@@H]1O,0.0362,37.0,7.6,2.4.1.255,7227.0,-1.4412914294668342,-1.4412914294668342,CC(O)=N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1SP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2ccc(O)nc2=O)[C@H](O)[C@@H]1O__MHVEQTRINMQSQGQSHQLPSAAHILLDQNPNSTGSNLVVKQNDIQSLSSVGLLELAHREYQAVDYESAEKHCMQLWRQDSTNTGVLLLLSSIHFQCRRLDKSAQFSTLAIKQNPVLAEAYSNLGNVFKERGQLQEALDNYRRAVRLKPDFIDGYINLAAALVAARDMESAVQAYITALQYNPDLYCVRSDLGNLLKALGRLEEAKACYLKAIETCPGFAVAWSNLGCVFNAQGEIWLAIHHFEKAVTLDPNFLDAYINLGNVLKEARIFDRAVAAYLRALNLSPNNAVVHGNLACVYYEQGLIDLAIDTYRRAIELQPNFPDAYCNLANALKEKGQVKEAEDCYNTALRLCSNHADSLNNLANIKREQGYIEEATRLYLKALEVFPDFAAAHSNLASVLQQQGKLKEALMHYKEAIRIQPTFADAYSNMGNTLKELQDVSGALQCYTRAIQINPAFADAHSNLASIHKDSGNIPEAIQSYRTALKLKPDFPDAYCNLAHCLQIVCDWTDYDIRMKKLVSIVTEQLEKNRLPSVHPHHSMLYPLTHDCRKAIAARHANLCLEKVHVLHKKPYNFLKKLPTKGRLRIGYLSSDFGNHPTSHLMQSVPGLHDRSKVEIFCYALSPDDGTTFRHKISRESENFVDLSQIPCNGKAADKIFNDGIHILVNMNGYTKGARNEIFALRPAPIQVMWLGYPGTSGASFMDYIITDSVTSPLELAYQYSEKLSYMPHTYFIGDHKQMFPHLKERIIVCDKQQSSVVDNVTVINATDLSPLVENTDVKEIKEVVNAQKPVEITHKVAELPNTTQIVSMIATGQVQTSLNGVVVQNGLATTQTNNKAATGEEVPQNIVITTRRQYMLPDDAVVYCNFNQLYKIDPQTLESWVEILKNVPKSVLWLLRFPAVGEQNIKKTVSDFGISPDRVIFSNVAAKEEHVRRGQLADICLDTPLCNGHTTSMDVLWTGTPVVTLPGETLASRVAASQLATLGCPELIARTREEYQNIAIRLGTKKEYLKALRAKVWKARVESPLFDCSQYAKGLEKLFLRMWEKYENGELPDHISAV,./data/raw/alphafold//AF-Q7KJA9-F1-model_v4.pdb,427,1838,1207,2633 +291,752,763,MNPKILIIGACGQIGTELTQKLRKLYGTENVIASDIRKLNTDVVNSGPFEVVNALDFNQIEHLVEVHKITDIYLMAALLSATAEKNPAFAWDLNMNSLFHVLNLAKAKKIKKIFWPSSIAVFGPTTPKENTPQYTIMEPSTVYGISKQAGERWCEYYHNIYGVDVRSIRYPGLISWSTPPGGGTTDYAVDIFYKAIADKKYECFLSSETKMPMMYMDDAIDATINIMKAPVEKIKIHSSYNLAAMSFTPTEIANEIKKHIPEFTITYEPDFRQKIADSWPASIDDSQAREDWDWKHTFDLESMTKDMIEHLS,brenda,Q8KZM4,CC(=O)C(=O)O,23.2,30.0,9.0,1.1.1.103,29535.0,1.3654879848908996,1.535247972112118,CC(=O)C(=O)O__MNPKILIIGACGQIGTELTQKLRKLYGTENVIASDIRKLNTDVVNSGPFEVVNALDFNQIEHLVEVHKITDIYLMAALLSATAEKNPAFAWDLNMNSLFHVLNLAKAKKIKKIFWPSSIAVFGPTTPKENTPQYTIMEPSTVYGISKQAGERWCEYYHNIYGVDVRSIRYPGLISWSTPPGGGTTDYAVDIFYKAIADKKYECFLSSETKMPMMYMDDAIDATINIMKAPVEKIKIHSSYNLAAMSFTPTEIANEIKKHIPEFTITYEPDFRQKIADSWPASIDDSQAREDWDWKHTFDLESMTKDMIEHLS,./data/raw/alphafold//AF-Q8KZM4-F1-model_v4.pdb,186,1531,860,2242 +292,9995,10147,MAFAHFVLIHTICHGAWIWHKLKPLLEALGHKVTALDLAASGVDPRQIEEIGSFDEYSEPLLTFLEALPPGEKVILVGESCGGLNIAIAADKYCEKIAAAVFHNSVLPDTEHCPSYVVDKLMEVFPDWKDTTYFTYTKDGKEITGLKLGFTLLRENLYTLCGPEEYELAKMLTRKGSLFQNILAKRPFFTKEGYGSIKKIYVWTDQDEIFLPEFQLWQIENYKPDKVYKVEGGDHKLQLTKTKEIAEILQEVADTYN,uniprot_search,P52704,O=Cc1ccccc1,0.37,25.0,6.0,4.1.2.47,3981.0,-0.431798275933005,-0.1799581343134398,O=Cc1ccccc1__MAFAHFVLIHTICHGAWIWHKLKPLLEALGHKVTALDLAASGVDPRQIEEIGSFDEYSEPLLTFLEALPPGEKVILVGESCGGLNIAIAADKYCEKIAAAVFHNSVLPDTEHCPSYVVDKLMEVFPDWKDTTYFTYTKDGKEITGLKLGFTLLRENLYTLCGPEEYELAKMLTRKGSLFQNILAKRPFFTKEGYGSIKKIYVWTDQDEIFLPEFQLWQIENYKPDKVYKVEGGDHKLQLTKTKEIAEILQEVADTYN,./data/raw/alphafold//AF-P52704-F1-model_v4.pdb,1438,1112,2444,1308 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+348,10235,10390,MPIATSTGDNVLDFTVLGLNSGTSMDGIDCALCHFYQKTPDAPMEFELLEYGEVPLAQPIKQRVMRMILEDTTSPSELSEVNVILGEHFADAVRQFAAERNVDLSTIDAIASHGQTIWLLSMPEEGQVKSALTMAEGAILASRTGITSITDFRISDQAAGRQGAPLIAFFDALLLHHPTKLRACQNIGGIANVCFIPPDVDGRRTDEYYDFDTGPGNVFIDAVVRHFTNGEQEYDKDGAMGKRGKVDQELVDDFLKMPYFQLDPPKTTGREVFRDTLAHDLIRRAEAKGLSPDDIVATTTRITAQAIVDHYRRYAPSQEIDEIFMCGGGAYNPNIVEFIQQSYPNTKIMMLDEAGVPAGAKEAITFAWQGMEALVGRSIPVPTRVETRQHYVLGKVSPGLNYRSVMKKGMAFGGDAQQLPWVSEMIVKKKGKVITNNWA,brenda,B3VI55,O=P(O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,56.0,30.0,8.433333333333334,2.7.1.232,29829.0,1.7481880270062005,1.7481880270062005,O=P(O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O__MPIATSTGDNVLDFTVLGLNSGTSMDGIDCALCHFYQKTPDAPMEFELLEYGEVPLAQPIKQRVMRMILEDTTSPSELSEVNVILGEHFADAVRQFAAERNVDLSTIDAIASHGQTIWLLSMPEEGQVKSALTMAEGAILASRTGITSITDFRISDQAAGRQGAPLIAFFDALLLHHPTKLRACQNIGGIANVCFIPPDVDGRRTDEYYDFDTGPGNVFIDAVVRHFTNGEQEYDKDGAMGKRGKVDQELVDDFLKMPYFQLDPPKTTGREVFRDTLAHDLIRRAEAKGLSPDDIVATTTRITAQAIVDHYRRYAPSQEIDEIFMCGGGAYNPNIVEFIQQSYPNTKIMMLDEAGVPAGAKEAITFAWQGMEALVGRSIPVPTRVETRQHYVLGKVSPGLNYRSVMKKGMAFGGDAQQLPWVSEMIVKKKGKVITNNWA,./data/raw/alphafold//AF-B3VI55-F1-model_v4.pdb,1030,584,1957,681 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+355,5853,5952,MGRPLHLVLLSASLAGLLLLGESLFIRREQANNILARVTRANSFLEEMKKGHLERECMEETCSYEEAREVFEDSDKTNEFWNKYKDGDQCETSPCQNQGKCKDGLGEYTCTCLEGFEGKNCELFTRKLCSLDNGDCDQFCHEEQNSVVCSCARGYTLADNGKACIPTGPYPCGKQTLERRKRSVAQATSSSGEAPDSITWKPYDAADLDPTENPFDLLDFNQTQPERGDNNLTRIVGGQECKDGECPWQALLINEENEGFCGGTILSEFYILTAAHCLYQAKRFKVRVGDRNTEQEEGGEAVHEVEVVIKHNRFTKETYDFDIAVLRLKTPITFRMNVAPACLPERDWAESTLMTQKTGIVSGFGRTHEKGRQSTRLKMLEVPYVDRNSCKLSSSFIITQNMFCAGYDTKQEDACQGDSGGPHVTRFKDTYFVTGIVSWGEGCARKGKYGIYTKVTAFLKWIDRSMKTRGLPKAKSHAPEVITSSPLK,uniprot_search,P00742,N=C(N)c1ccc2[nH]c(-c3cc(Br)cc(Br)c3O)cc2c1,8.9e-05,22.0,7.4,3.4.21.6,9606.0,-4.050609993355088,-4.050609993355088,N=C(N)c1ccc2[nH]c(-c3cc(Br)cc(Br)c3O)cc2c1__MGRPLHLVLLSASLAGLLLLGESLFIRREQANNILARVTRANSFLEEMKKGHLERECMEETCSYEEAREVFEDSDKTNEFWNKYKDGDQCETSPCQNQGKCKDGLGEYTCTCLEGFEGKNCELFTRKLCSLDNGDCDQFCHEEQNSVVCSCARGYTLADNGKACIPTGPYPCGKQTLERRKRSVAQATSSSGEAPDSITWKPYDAADLDPTENPFDLLDFNQTQPERGDNNLTRIVGGQECKDGECPWQALLINEENEGFCGGTILSEFYILTAAHCLYQAKRFKVRVGDRNTEQEEGGEAVHEVEVVIKHNRFTKETYDFDIAVLRLKTPITFRMNVAPACLPERDWAESTLMTQKTGIVSGFGRTHEKGRQSTRLKMLEVPYVDRNSCKLSSSFIITQNMFCAGYDTKQEDACQGDSGGPHVTRFKDTYFVTGIVSWGEGCARKGKYGIYTKVTAFLKWIDRSMKTRGLPKAKSHAPEVITSSPLK,./data/raw/alphafold//AF-P00742-F1-model_v4.pdb,347,2196,846,2225 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+357,10204,10359,MAAPAKGENLSLVVHGPGDIRLENYPIPELGPNDVLLKMHSVGICGSDVHYWEHGRIGDFVVKKPMVLGHEAAGTVTKVGPMVKHLKPGDRVAIEPGVPREIDEFCKIGRYNLTPSIFFCATPPDDGNLCRFYKHSADFCYKLPDSVTFEEGALIEPLSVGIYACRRGSVSLGNKVLVCGAGPIGIVTLLVAKAMGASQVVVIDLSASRLAKAKEVGADFTIQVAKETPHDIAKKVESVLGSKPEVTIECTGAESSVQTGIYATHSGGTLVVVGMGPEMINLPLVHAAVREVDIKGVFRYCNTWPMAVSMLASKTLNVKPLVTHRFPLEKAVEAFETAKKGLGLKVMIKCDPNDQNP,sabio,P27867,O=P(O)(O)OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CO,19.0,25.0,8.6,1.1.1.14,10116.0,1.2787536009528289,1.2787536009528289,O=P(O)(O)OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CO__MAAPAKGENLSLVVHGPGDIRLENYPIPELGPNDVLLKMHSVGICGSDVHYWEHGRIGDFVVKKPMVLGHEAAGTVTKVGPMVKHLKPGDRVAIEPGVPREIDEFCKIGRYNLTPSIFFCATPPDDGNLCRFYKHSADFCYKLPDSVTFEEGALIEPLSVGIYACRRGSVSLGNKVLVCGAGPIGIVTLLVAKAMGASQVVVIDLSASRLAKAKEVGADFTIQVAKETPHDIAKKVESVLGSKPEVTIECTGAESSVQTGIYATHSGGTLVVVGMGPEMINLPLVHAAVREVDIKGVFRYCNTWPMAVSMLASKTLNVKPLVTHRFPLEKAVEAFETAKKGLGLKVMIKCDPNDQNP,./data/raw/alphafold//AF-P27867-F1-model_v4.pdb,1298,927,2236,1084 +358,7060,7180,MWALDFLLSFLLIQLAAQVDSSGTWCYDSQDPKCGPAHWKELAPACGGPTQSPINIDLRLVQRDYTLKPFIFQGYDSAPQDPWVLENDGHTVLLRVNSCQQNCPAIRGAGLPSPEYRLLQLHFHWGSPGHQGSEHSLDEKHGSMEMHMVHMNTKYQSMEDARSQPDGFAILAVLLVEEDRDNTNFSAIVSGLKNLSSPGVAVNLTSTFALASLLPSALRLLRYYRYSGSLTTPGCEPAVLWTVFENTVPIGHAQVVQFQAVLQTGPPGLHPRPLTSNFRPQQPLGGRRISASPEASVRSSVSTLPCLHLALVGLGVGLRLWQGP,brenda,Q99N23,NNc1ccc(S(N)(=O)=O)cc1,0.00954,20.0,7.5,4.2.1.1,10090.0,-2.020451625295905,-2.020451625295905,NNc1ccc(S(N)(=O)=O)cc1__MWALDFLLSFLLIQLAAQVDSSGTWCYDSQDPKCGPAHWKELAPACGGPTQSPINIDLRLVQRDYTLKPFIFQGYDSAPQDPWVLENDGHTVLLRVNSCQQNCPAIRGAGLPSPEYRLLQLHFHWGSPGHQGSEHSLDEKHGSMEMHMVHMNTKYQSMEDARSQPDGFAILAVLLVEEDRDNTNFSAIVSGLKNLSSPGVAVNLTSTFALASLLPSALRLLRYYRYSGSLTTPGCEPAVLWTVFENTVPIGHAQVVQFQAVLQTGPPGLHPRPLTSNFRPQQPLGGRRISASPEASVRSSVSTLPCLHLALVGLGVGLRLWQGP,./data/raw/alphafold//AF-Q99N23-F1-model_v4.pdb,214,1569,901,2286 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+402,9234,9381,MHCGPPDMVCETKIVAAEDHEALPGAKKDALLAAAGAMWPPLPAAPGPAAAPPAPPPAPVAQPHGGAGGAGPPGGRGVCIREFRAAEQEAARRIFYDGIMERIPNTAFRGLRQHPRAQLLYALLAALCFAVSRSLLLTCLVPAALLGLRYYYSRKVIRAYLECALHTDMADIEQYYMKPPGSCFWVAVLDGNVVGIVAARAHEEDNTVELLRMSVDSRFRGKGIAKALGRKVLEFAVVHNYSAVVLGTTAVKVAAHKLYESLGFRHMGASDHYVLPGMTLSLAERLFFQVRYHRYRLQLREE,brenda,Q8N9F0,O=C(O)C[C@H](N=C(O)OCc1ccccc1)C(=O)O,0.017,30.0,7.4,2.3.1.17,9606.0,-1.769551078621726,-1.769551078621726,O=C(O)C[C@H](N=C(O)OCc1ccccc1)C(=O)O__MHCGPPDMVCETKIVAAEDHEALPGAKKDALLAAAGAMWPPLPAAPGPAAAPPAPPPAPVAQPHGGAGGAGPPGGRGVCIREFRAAEQEAARRIFYDGIMERIPNTAFRGLRQHPRAQLLYALLAALCFAVSRSLLLTCLVPAALLGLRYYYSRKVIRAYLECALHTDMADIEQYYMKPPGSCFWVAVLDGNVVGIVAARAHEEDNTVELLRMSVDSRFRGKGIAKALGRKVLEFAVVHNYSAVVLGTTAVKVAAHKLYESLGFRHMGASDHYVLPGMTLSLAERLFFQVRYHRYRLQLREE,./data/raw/alphafold//AF-Q8N9F0-F1-model_v4.pdb,421,1832,1200,2373 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+404,10279,10435,MSDQSPFETDMITLNRYVMEKGRRVKGATGELTQLLNSTLTAIKAISSAVRKAGLAHMYGIAGSVNVTGDEQKKLDVLSNSLVINMLQSSYSTCVLVSEENKEALITPKEKRGKYVVCFDPLDGSSNIDCLASIGTIFAIYKKTTEDEPSEKDALQPGRNIVAAGYALYGSATLVALSTGQGVDSFMLDPGLGEFILVEKDVKIKKKGKIYSLNEGYAKYFDPAVTEYLHKKKFPEEGKSPYGARYVGSMVADVHRTLVYGGIFLYPANQKSPKGKLRLLYECNPIAFIIEQASGIATTGTEPVLDVKPESIHQRVPFVAGSPEDVQEYLAFVQKHQKSS,uniprot_search,Q9I9H7,O=P(O)(O)OC[C@H]1O[C@](CO)(OP(=O)(O)O)[C@@H](O)[C@@H]1O,7e-05,37.0,7.4,3.1.3.11,9825.0,-4.154901959985743,-3.938074179516457,O=P(O)(O)OC[C@H]1O[C@](CO)(OP(=O)(O)O)[C@@H](O)[C@@H]1O__MSDQSPFETDMITLNRYVMEKGRRVKGATGELTQLLNSTLTAIKAISSAVRKAGLAHMYGIAGSVNVTGDEQKKLDVLSNSLVINMLQSSYSTCVLVSEENKEALITPKEKRGKYVVCFDPLDGSSNIDCLASIGTIFAIYKKTTEDEPSEKDALQPGRNIVAAGYALYGSATLVALSTGQGVDSFMLDPGLGEFILVEKDVKIKKKGKIYSLNEGYAKYFDPAVTEYLHKKKFPEEGKSPYGARYVGSMVADVHRTLVYGGIFLYPANQKSPKGKLRLLYECNPIAFIIEQASGIATTGTEPVLDVKPESIHQRVPFVAGSPEDVQEYLAFVQKHQKSS,./data/raw/alphafold//AF-Q9I9H7-F1-model_v4.pdb,1173,837,617,978 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+473,5543,5642,MGRGTLALGWAGAALLLLQMLAAAERSPRTPGGKAGVFADLSAQELKAVHSFLWSQKELKLEPSGTLTMAKNSVFLIEMLLPKKQHVLKFLDKGHRRPVREARAVIFFGAQEQPNVTEFAVGPLPTPRYMRDLPPRPGHQVSWASRPISKAEYALLSHKLQEATQPLRQFFRRTTGSSFGDCHEQCLTFTDVAPRGLASGQRRTWFILQRQMPGYFLHPTGLELLVDHGSTNAQDWTVEQVWYNGKFYRSPEELAQKYNDGEVDVVILEDPLAKGKDGESLPEPALFSFYQPRGDFAVTMHGPHVVQPQGPRYSLEGNRVMYGGWSFAFRLRSSSGLQILDVHFGGERIAYEVSVQEAVALYGGHTPAGMQTKYIDVGWGLGSVTHELAPDIDCPETATFLDALHHYDADGPVLYPRALCLFEMPTGVPLRRHFNSNFSGGFNFYAGLKGQVLVLRTTSTVYNYDYIWDFIFYPNGVMEAKMHATGYVHATFYTPEGLRYGTRLHTHLIGNMHTHLVNYRVDLDVAGTTNSFQTLQMELENITNPWSPRHRLVQPTLKQTRYSRERQAAFRFGQPLPKYLLITSPKENPWGHTRSYRLQLHSMADQVLPPGWQEERAVTWARYPLAVTRYRESELSSSSIYNQNDPWDPPVVFEEFLRNNENIEDEDLVAWVTVGFLHIPHSEDIPNTATPGNSVGFLLRPFNFFPEDPALASRDLVVVWPLENGSTYAQRWIPEEDQSCLKPPPFSYNGSYRPV,uniprot_search,Q9TRC7,N,33.8,37.0,7.4,1.4.3.22,9823.0,1.5289167002776547,1.542609600522471,N__MGRGTLALGWAGAALLLLQMLAAAERSPRTPGGKAGVFADLSAQELKAVHSFLWSQKELKLEPSGTLTMAKNSVFLIEMLLPKKQHVLKFLDKGHRRPVREARAVIFFGAQEQPNVTEFAVGPLPTPRYMRDLPPRPGHQVSWASRPISKAEYALLSHKLQEATQPLRQFFRRTTGSSFGDCHEQCLTFTDVAPRGLASGQRRTWFILQRQMPGYFLHPTGLELLVDHGSTNAQDWTVEQVWYNGKFYRSPEELAQKYNDGEVDVVILEDPLAKGKDGESLPEPALFSFYQPRGDFAVTMHGPHVVQPQGPRYSLEGNRVMYGGWSFAFRLRSSSGLQILDVHFGGERIAYEVSVQEAVALYGGHTPAGMQTKYIDVGWGLGSVTHELAPDIDCPETATFLDALHHYDADGPVLYPRALCLFEMPTGVPLRRHFNSNFSGGFNFYAGLKGQVLVLRTTSTVYNYDYIWDFIFYPNGVMEAKMHATGYVHATFYTPEGLRYGTRLHTHLIGNMHTHLVNYRVDLDVAGTTNSFQTLQMELENITNPWSPRHRLVQPTLKQTRYSRERQAAFRFGQPLPKYLLITSPKENPWGHTRSYRLQLHSMADQVLPPGWQEERAVTWARYPLAVTRYRESELSSSSIYNQNDPWDPPVVFEEFLRNNENIEDEDLVAWVTVGFLHIPHSEDIPNTATPGNSVGFLLRPFNFFPEDPALASRDLVVVWPLENGSTYAQRWIPEEDQSCLKPPPFSYNGSYRPV,./data/raw/alphafold//AF-Q9TRC7-F1-model_v4.pdb,503,1936,2024,2768 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NNTNPGMTTYYQTSPTIPTHTLTSIPSSITSILSMFPTSNTFTTDKITNFTTPTNANTIIFNTLDTKSTMVIDATVTTTSTKDNTMSPDTTVTSIDKFTTHITQFATPHSATTTTLALSHTSLAPTNLSNLGTMDITDADNSSSVTGNTTHISVSNLTTASVTITATGLDSQTPHMVINSVATYLPITATSATTDTTNITKYALNTTTPDSTVHTSATAPTYIANAINATQVP,./data/raw/alphafold//AF-Q2M2H8-F1-model_v4.pdb,541,1980,1378,30 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+550,4100,4182,MDLLLIEKTLVALFAAIIGAILISKLRGKKFKLPPGPIPVPIFGNWLQVGDDLNHRNLTDLAKRFGEILLLRMGQRNLVVVSSPELAKEVLHTQGVEFGSRTRNVVFDIFTGKGQDMVFTVYGEHWRKMRRIMTVPFFTNKVVQQYRYGWEAEAAAVVDDVKKNPAAATEGIVIRRRLQLMMYNNMFRIMFDRRFESEDDPLFLKLKALNGERSRLAQSFEYNYGDFIPILRPFLRNYLKLCKEVKDKRIQLFKDYFVDERKKIGSTKKMDNNQLKCAIDHILEAKEKGEINEDNVLYIVENINVAAIETTLWSIEWGIAELVNHPEIQAKLRHELDTKLGPGVQITEPDVQNLPYLQAVVKETLRLRMAIPLLVPHMNLHDAKLGGFDIPAESKILVNAWWLANNPDQWKKPEEFRPERFLEEEAKVEANGNDFRYLPFGVGRRSCPGIILALPILGITIGRLVQNFELLPPPGQSKIDTDEKGGQFSLHILKHSTIVAKPRSF,brenda,Q04468,COc1c2occc2cc2ccc(=O)oc12,0.0048,30.0,7.199999999999999,1.14.14.91,4233.0,-2.318758762624413,-2.318758762624413,COc1c2occc2cc2ccc(=O)oc12__MDLLLIEKTLVALFAAIIGAILISKLRGKKFKLPPGPIPVPIFGNWLQVGDDLNHRNLTDLAKRFGEILLLRMGQRNLVVVSSPELAKEVLHTQGVEFGSRTRNVVFDIFTGKGQDMVFTVYGEHWRKMRRIMTVPFFTNKVVQQYRYGWEAEAAAVVDDVKKNPAAATEGIVIRRRLQLMMYNNMFRIMFDRRFESEDDPLFLKLKALNGERSRLAQSFEYNYGDFIPILRPFLRNYLKLCKEVKDKRIQLFKDYFVDERKKIGSTKKMDNNQLKCAIDHILEAKEKGEINEDNVLYIVENINVAAIETTLWSIEWGIAELVNHPEIQAKLRHELDTKLGPGVQITEPDVQNLPYLQAVVKETLRLRMAIPLLVPHMNLHDAKLGGFDIPAESKILVNAWWLANNPDQWKKPEEFRPERFLEEEAKVEANGNDFRYLPFGVGRRSCPGIILALPILGITIGRLVQNFELLPPPGQSKIDTDEKGGQFSLHILKHSTIVAKPRSF,./data/raw/alphafold//AF-Q04468-F1-model_v4.pdb,702,2175,1600,184 +551,4915,5009,MSSSKPSFSDYFGKLGGIPMYKKFIEQFHNVEEFEARPDDLVIVTYPKSGTTWLSEIICMIYNNGDVEKCKEDVIFNRVPYLECSTEHVMKGVKQLNEMASPRIVKSHLPVKLLPVSFWEKNCKIIYLSRNAKDVVVSYYFLILMVTAIPDPDSFQDFVEKFMDGEVPYGSWFEHTKSWWEKSKNPQVLFLFYEDMKENIRKEVMKLLEFLGRKASDELVDKIIKHTSFQEMKNNPSTNYTTLPDEVMNQKVSPFMRKGDVGDWKNHFTVALNEKFDMHYEQQMKGSTLKFRTKI,uniprot_search,P19217,C[C@]12CCC3c4cc([N+](=O)[O-])c(O)cc4CC[C@H]3C1CC[C@@H]2O,0.0024,37.0,8.1,2.8.2.4,9913.0,-2.619788758288394,-2.619788758288394,C[C@]12CCC3c4cc([N+](=O)[O-])c(O)cc4CC[C@H]3C1CC[C@@H]2O__MSSSKPSFSDYFGKLGGIPMYKKFIEQFHNVEEFEARPDDLVIVTYPKSGTTWLSEIICMIYNNGDVEKCKEDVIFNRVPYLECSTEHVMKGVKQLNEMASPRIVKSHLPVKLLPVSFWEKNCKIIYLSRNAKDVVVSYYFLILMVTAIPDPDSFQDFVEKFMDGEVPYGSWFEHTKSWWEKSKNPQVLFLFYEDMKENIRKEVMKLLEFLGRKASDELVDKIIKHTSFQEMKNNPSTNYTTLPDEVMNQKVSPFMRKGDVGDWKNHFTVALNEKFDMHYEQQMKGSTLKFRTKI,./data/raw/alphafold//AF-P19217-F1-model_v4.pdb,310,1690,942,2331 +552,8949,9089,MQTFQADLAIVGAGGAGLRAAIAAAQANPNAKIALISKVYPMRSHTVAAEGGSAAVAQDHDSFEYHFHDTVAGGDWLCEQDVVDYFVHHCPTEMTQLELWGCPWSRRPDGSVNVRRFGGMKIERTWFAADKTGFHMLHTLFQTSLQFPQIQRFDEHFVLDILVDDGHVRGLVAMNMMEGTLVQIRANAVVMATGGAGRVYRYNTNGGIVTGDGMGMALSHGVPLRDMEFVQYHPTGLPGSGILMTEGCRGEGGILVNKNGYRYLQDYGMGPETPLGEPKNKYMELGPRDKVSQAFWHEWRKGNTISTPRGDVVYLDLRHLGEKKLHERLPFICELAKAYVGVDPVKEPIPVRPTAHYTMGGIETDQNCETRIKGLFAVGECSSVGLHGANRLGSNSLAELVVFGRLAGEQATERAATAGNGNEAAIEAQAAGVEQRLKDLVNQDGGENWAKIRDEMGLAMEEGCGIYRTPELMQKTIDKLAELQERFKRVRITDTSSVFNTDLLYTIELGHGLNVAECMAHSAMARKESRGAHQRLDEGCTERDDVNFLKHTLAFRDADGTTRLEYSDVKITTLPPAKRVYGGEADAADKAEAANKKEKANG,brenda,P00363,O=C(O)CC(=O)C(=O)O,0.0003,30.0,7.0,1.3.5.4,562.0,-3.522878745280338,-3.522878745280338,O=C(O)CC(=O)C(=O)O__MQTFQADLAIVGAGGAGLRAAIAAAQANPNAKIALISKVYPMRSHTVAAEGGSAAVAQDHDSFEYHFHDTVAGGDWLCEQDVVDYFVHHCPTEMTQLELWGCPWSRRPDGSVNVRRFGGMKIERTWFAADKTGFHMLHTLFQTSLQFPQIQRFDEHFVLDILVDDGHVRGLVAMNMMEGTLVQIRANAVVMATGGAGRVYRYNTNGGIVTGDGMGMALSHGVPLRDMEFVQYHPTGLPGSGILMTEGCRGEGGILVNKNGYRYLQDYGMGPETPLGEPKNKYMELGPRDKVSQAFWHEWRKGNTISTPRGDVVYLDLRHLGEKKLHERLPFICELAKAYVGVDPVKEPIPVRPTAHYTMGGIETDQNCETRIKGLFAVGECSSVGLHGANRLGSNSLAELVVFGRLAGEQATERAATAGNGNEAAIEAQAAGVEQRLKDLVNQDGGENWAKIRDEMGLAMEEGCGIYRTPELMQKTIDKLAELQERFKRVRITDTSSVFNTDLLYTIELGHGLNVAECMAHSAMARKESRGAHQRLDEGCTERDDVNFLKHTLAFRDADGTTRLEYSDVKITTLPPAKRVYGGEADAADKAEAANKKEKANG,./data/raw/alphafold//AF-P00363-F1-model_v4.pdb,560,2002,1402,56 +553,8500,8637,MMRKSLCCALLLGISCSALATPVSEKQLAEVVANTITPLMKAQSVPGMAVAVIYQGKPHYYTFGKADIAANKPVTPQTLFELGSISKTFTGVLGGDAIARGEISLDDAVTRYWPQLTGKQWQGIRMLDLATYTAGGLPLQVPDEVTDNASLLRFYQNWQPQWKPGTTRLYANASIGLFGALAVKPSGMPYEQAMTTRVLKPLKLDHTWINVPKAEEAHYAWGYRDGKAVRVSPGMLDAQAYGVKTNVQDMANWVMANMAPENVADASLKQGIALAQSRYWRIGSMYQGLGWEMLNWPVEANTVVEGSDSKVALAPLPVAEVNPPAPPVKASWVHKTGSTGGFGSYVAFIPEKQIGIVMLANTSYPNPARVEAAYHILEALQ,brenda,P05364,O.O=C([O-])Cc1ccc([O-])c([O-])c1.[OH-].[O].[V+3],0.0042,25.0,7.0,3.5.2.6,550.0,-2.3767507096021,-2.3767507096021,O.O=C([O-])Cc1ccc([O-])c([O-])c1.[OH-].[O].[V+3]__MMRKSLCCALLLGISCSALATPVSEKQLAEVVANTITPLMKAQSVPGMAVAVIYQGKPHYYTFGKADIAANKPVTPQTLFELGSISKTFTGVLGGDAIARGEISLDDAVTRYWPQLTGKQWQGIRMLDLATYTAGGLPLQVPDEVTDNASLLRFYQNWQPQWKPGTTRLYANASIGLFGALAVKPSGMPYEQAMTTRVLKPLKLDHTWINVPKAEEAHYAWGYRDGKAVRVSPGMLDAQAYGVKTNVQDMANWVMANMAPENVADASLKQGIALAQSRYWRIGSMYQGLGWEMLNWPVEANTVVEGSDSKVALAPLPVAEVNPPAPPVKASWVHKTGSTGGFGSYVAFIPEKQIGIVMLANTSYPNPARVEAAYHILEALQ,./data/raw/alphafold//AF-P05364-F1-model_v4.pdb,616,2068,514,1816 +554,7383,7504,MNLRHIIKQNHLELLFQQGSFGLEKESQRVRHDGSVVTSAHPKAFGNRSFHPYIQTDFAESQLELITPPNKKLEDTFRWLQTIHEVVWRTLPEDEFIFPLSMPAGLPPEKDIKVAQLDNSVDVAYREHLVKSYGAYKQMVSGIHYNFQLDPALIEALFKAQSDCRSAVEFQNSLYLKMAKNFLRYQWILLYLLSATPTVDANYFREGTALKPNQYVRSLRSSQYGYVNAPEIVVSFDSIPQYVETLEHWVNSGKLIAEKEFYSNVRLRGAKKAREFLHTGIQYLEFRLFDLNPFEPYGMSLHDAQFIHYFILLMIWLDETADQAGVELGKARLLEVAFEDPRQETVYRDEGERILNALITMLKDLGTDENAVKSAQEKLSQFAYPERTLCARLVAAIEQAGGYQKLGAELAQRNKAQAFERFYALTAFDNMELSTQALMFDAIQKGLQMEILDENDQFLRLQFGEHFEYVKNGNMTSRDSYISPLIMENKVVTKKVLDKAGFNVPKSLEFTTLEQAVASYSLFEGRAVVIKPKSTNYGLGITIFQQGVHDRDDFAKAVEIAFREDKEVMVEDYLSGTEYRFFVLGDETLAVLLRVPANVVGDGVRTVAELVAAKNDHPLRGDGSRTPLKKITLGEIERLQLKEQGLTVDSVPAEGLLVQLRANSNISTGGDSIDMTDEMHPSYKALAVDITKAMGAAVCGVDLIIPDLNKPAENRLSSWGVIEANFNPMMMMHIFPYQGKSRRLTQNVIKMLFPELLNA,brenda,A6VQP8,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O,0.043,40.0,8.5,6.3.2.2,67854.0,-1.3665315444204136,-1.3665315444204136,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O__MNLRHIIKQNHLELLFQQGSFGLEKESQRVRHDGSVVTSAHPKAFGNRSFHPYIQTDFAESQLELITPPNKKLEDTFRWLQTIHEVVWRTLPEDEFIFPLSMPAGLPPEKDIKVAQLDNSVDVAYREHLVKSYGAYKQMVSGIHYNFQLDPALIEALFKAQSDCRSAVEFQNSLYLKMAKNFLRYQWILLYLLSATPTVDANYFREGTALKPNQYVRSLRSSQYGYVNAPEIVVSFDSIPQYVETLEHWVNSGKLIAEKEFYSNVRLRGAKKAREFLHTGIQYLEFRLFDLNPFEPYGMSLHDAQFIHYFILLMIWLDETADQAGVELGKARLLEVAFEDPRQETVYRDEGERILNALITMLKDLGTDENAVKSAQEKLSQFAYPERTLCARLVAAIEQAGGYQKLGAELAQRNKAQAFERFYALTAFDNMELSTQALMFDAIQKGLQMEILDENDQFLRLQFGEHFEYVKNGNMTSRDSYISPLIMENKVVTKKVLDKAGFNVPKSLEFTTLEQAVASYSLFEGRAVVIKPKSTNYGLGITIFQQGVHDRDDFAKAVEIAFREDKEVMVEDYLSGTEYRFFVLGDETLAVLLRVPANVVGDGVRTVAELVAAKNDHPLRGDGSRTPLKKITLGEIERLQLKEQGLTVDSVPAEGLLVQLRANSNISTGGDSIDMTDEMHPSYKALAVDITKAMGAAVCGVDLIIPDLNKPAENRLSSWGVIEANFNPMMMMHIFPYQGKSRRLTQNVIKMLFPELLNA,./data/raw/alphafold//AF-A6VQP8-F1-model_v4.pdb,1102,676,107,791 +555,5193,5289,CGVPAIQPVLSGLSRIVNGEEAVPGSWPWQVSLQDKTGFHFCGGSLINENWVVTAAHCGVTTSDVVVAGEFDQGSSSEKIQKLKIAKVFKNSKYNSLTINNDITLLKLSTAASFSQTVSAVCLPSASDDFAAGTTCVTTGWGLTRYTNANTPDRLQQASLPLLSNTNCKKYWGTKIKDAMICAGASGVSSCMGDSGGPLVCKKNGAWTLVGIVSWGSSTCSTSTPGVYARVTALVNWVQQTLAAN,brenda,P00766,Cc1cccc(-c2nc3ccccc3c(=O)o2)c1,0.0161,30.0,7.6,3.4.21.1,9913.0,-1.7931741239681502,-1.7931741239681502,Cc1cccc(-c2nc3ccccc3c(=O)o2)c1__CGVPAIQPVLSGLSRIVNGEEAVPGSWPWQVSLQDKTGFHFCGGSLINENWVVTAAHCGVTTSDVVVAGEFDQGSSSEKIQKLKIAKVFKNSKYNSLTINNDITLLKLSTAASFSQTVSAVCLPSASDDFAAGTTCVTTGWGLTRYTNANTPDRLQQASLPLLSNTNCKKYWGTKIKDAMICAGASGVSSCMGDSGGPLVCKKNGAWTLVGIVSWGSSTCSTSTPGVYARVTALVNWVQQTLAAN,./data/raw/alphafold//AF-P00766-F1-model_v4.pdb,638,1633,978,2374 +556,10914,11074,MSHHWGYGKHNGPEHWHKDFPIAKGERQSPVDIDTHTAKYDPSLKPLSVSYDQATSLRILNNGHAFNVEFDDSQDKAVLKGGPLDGTYRLIQFHFHWGSLDGQGSEHTVDKKKYAAELHLVHWNTKYGDFGKAVQQPDGLAVLGIFLKVGSAKPGLQKVVDVLDSIKTKGKSADFTNFDPRGLLPESLDYWTYPGSLTTPPLLECVTWIVLKEPISVSSEQVLKFRKLNFNGEGEPEELMVDNWRPAQPLKNRQIKASFK,brenda,P00918,OC(=N/N=C/c1ccccc1Cl)N/N=C/c1ccccc1Cl,0.00412,25.0,7.4,4.2.1.1,9606.0,-2.385102783966865,-2.385102783966865,OC(=N/N=C/c1ccccc1Cl)N/N=C/c1ccccc1Cl__MSHHWGYGKHNGPEHWHKDFPIAKGERQSPVDIDTHTAKYDPSLKPLSVSYDQATSLRILNNGHAFNVEFDDSQDKAVLKGGPLDGTYRLIQFHFHWGSLDGQGSEHTVDKKKYAAELHLVHWNTKYGDFGKAVQQPDGLAVLGIFLKVGSAKPGLQKVVDVLDSIKTKGKSADFTNFDPRGLLPESLDYWTYPGSLTTPPLLECVTWIVLKEPISVSSEQVLKFRKLNFNGEGEPEELMVDNWRPAQPLKNRQIKASFK,./data/raw/alphafold//AF-P00918-F1-model_v4.pdb,446,1854,892,2275 +557,5692,5791,MQTERGPIAAHRPHEVVFGKVEGLDRGANPMDPPRRRVDPLFWLRDDNRADPEVLAHLHLEKDYYEKRAVDIKDLAETIYQEHISHIEETDMSAPYVYDRFLYYTRDVKGLSYKLHCRVPAGKTPGEGEDEEIVLDENKLAEGKSFCVVGCVAPAPPEHALVAYSVDYCGDEVYSIRFVRDVVADKVEGTNGSVVWGPNAECFFYITKDASKRDNKVWRHIIGQPQSEDVCLYTDDDPLFSVGVGRSGDGKTLIICSMSSETSESHLLDLRKGVKHNTLEMVRPREKGVRYTVEMHGTDTLIVLTNKDKCVNGKVVLTKRSAPTDWGTVLIPHDDKVTIDDVVVFAKFAVLSGRRDGLTRVWTVRLGPDNLFSSATLKELHFDEPVFTAHVVCSQMKTYDASLLRLRYSSMTTPTVWYDEDVLSGERKVVKARKVGGGFESKNYVCRRELATAPDGTKVPISLVYDTSIDLKKPNPTMLYGYGSYGICIEPEFNSRFLPYVDRGMIYAIAHVRGGGEMGRTWYEVGGKYLTKRNTFMDFIACAEHLISSGLTTPAQLSCEGRSAGGLLVGAVLNMRPDLFHVALAGVPFVDVMTTMCDPSIPLTTGEWEEWGNPNEYKFFDYMNSYSPIDNARAQDYPHLMIQAGLHDPRVAYWEPAKWASKLRELKTDSNEVLLKMDLESGHFSASDRYKYLRENAIQQAFVLKHLNVRQLLRK,brenda,Q6QDP1,N=C(N)NCCCCN,0.207,37.0,8.0,3.4.21.83,5697.0,-0.6840296545430823,-0.7049359026397013,N=C(N)NCCCCN__MQTERGPIAAHRPHEVVFGKVEGLDRGANPMDPPRRRVDPLFWLRDDNRADPEVLAHLHLEKDYYEKRAVDIKDLAETIYQEHISHIEETDMSAPYVYDRFLYYTRDVKGLSYKLHCRVPAGKTPGEGEDEEIVLDENKLAEGKSFCVVGCVAPAPPEHALVAYSVDYCGDEVYSIRFVRDVVADKVEGTNGSVVWGPNAECFFYITKDASKRDNKVWRHIIGQPQSEDVCLYTDDDPLFSVGVGRSGDGKTLIICSMSSETSESHLLDLRKGVKHNTLEMVRPREKGVRYTVEMHGTDTLIVLTNKDKCVNGKVVLTKRSAPTDWGTVLIPHDDKVTIDDVVVFAKFAVLSGRRDGLTRVWTVRLGPDNLFSSATLKELHFDEPVFTAHVVCSQMKTYDASLLRLRYSSMTTPTVWYDEDVLSGERKVVKARKVGGGFESKNYVCRRELATAPDGTKVPISLVYDTSIDLKKPNPTMLYGYGSYGICIEPEFNSRFLPYVDRGMIYAIAHVRGGGEMGRTWYEVGGKYLTKRNTFMDFIACAEHLISSGLTTPAQLSCEGRSAGGLLVGAVLNMRPDLFHVALAGVPFVDVMTTMCDPSIPLTTGEWEEWGNPNEYKFFDYMNSYSPIDNARAQDYPHLMIQAGLHDPRVAYWEPAKWASKLRELKTDSNEVLLKMDLESGHFSASDRYKYLRENAIQQAFVLKHLNVRQLLRK,./data/raw/alphafold//AF-Q6QDP1-F1-model_v4.pdb,389,1793,1157,2578 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+636,9034,9175,MASITDKDHQKVILVGDGAVGSSYAYAMVLQGIAQEIGIVDIFKDKTKGDAIDLSNALPFTSPKKIYSAEYSDAKDADLVVITAGAPQKPGETRLDLVNKNLKILKSIVDPIVDSGFNGIFLVAANPVDILTYATWKLSGFPKNRVVGSGTSLDTARFRQSIAEMVNVDARSVHAYIMGEHGDTEFPVWSHANIGGVTIAEWVKAHPEIKEDKLVKMFEDVRDAAYEIIKLKGATFYGIATALARISKAILNDENAVLPLSVYMDGQYGLNDIYIGTPAVINRNGIQNILEIPLTDHEEESMQKSASQLKKVLTDAFAKNDIETRQ,sabio,P00343,O=C(O)CCC(=O)C(=O)O,4.5,,4.8,1.1.1.27,1582.0,0.6532125137753437,0.3266062568876718,O=C(O)CCC(=O)C(=O)O__MASITDKDHQKVILVGDGAVGSSYAYAMVLQGIAQEIGIVDIFKDKTKGDAIDLSNALPFTSPKKIYSAEYSDAKDADLVVITAGAPQKPGETRLDLVNKNLKILKSIVDPIVDSGFNGIFLVAANPVDILTYATWKLSGFPKNRVVGSGTSLDTARFRQSIAEMVNVDARSVHAYIMGEHGDTEFPVWSHANIGGVTIAEWVKAHPEIKEDKLVKMFEDVRDAAYEIIKLKGATFYGIATALARISKAILNDENAVLPLSVYMDGQYGLNDIYIGTPAVINRNGIQNILEIPLTDHEEESMQKSASQLKKVLTDAFAKNDIETRQ,./data/raw/alphafold//AF-P00343-F1-model_v4.pdb,1728,1462,782,2153 +637,5660,5759,MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,brenda,Q9Y5Y6,N=C(N)NCCC1CCN(C(=O)C(Cc2cccc(C(=N)N)c2)NS(=O)(=O)c2ccc3ccccc3c2)CC1,5e-05,25.0,7.6,3.4.21.109,9606.0,-4.301029995663981,-4.301029995663981,N=C(N)NCCC1CCN(C(=O)C(Cc2cccc(C(=N)N)c2)NS(=O)(=O)c2ccc3ccccc3c2)CC1__MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,./data/raw/alphafold//AF-Q9Y5Y6-F1-model_v4.pdb,489,1916,1302,2740 +638,11632,11811,MSTATASPAVKLNSGYEIPLVGFGCWKLTNDVASDQIYRAIKSGYRLFDGAEDYANEQEVGEGIKRAIKEGIVKREELFITSKLWNSFHDKKNVEVALMKTLSDLNLDYVDLFYIHFPIAQKPVPIEKKYPPGFYCGDGDKWSIEEVPLLDTWRALEKLVDQGLAKSIGISNFSAQLIYDLIRGCTIKPVALQIEHHPYLTQPKLVEYVQLHDIQITGYSSFGPQSFLEMDLKRALDTPVLLEEPTVKSIADKHGKSPAQVLLRYQTQRGIAVIPRSNSPDRMAQNLSVIDFELTQDDLQAIAELDCNLRFNEPWDFSNIPVFV,brenda,Q6Y0Z3,[Cu+2],0.034,45.0,5.5,1.1.1.307,5480.0,-1.4685210829577449,-1.4685210829577449,[Cu+2]__MSTATASPAVKLNSGYEIPLVGFGCWKLTNDVASDQIYRAIKSGYRLFDGAEDYANEQEVGEGIKRAIKEGIVKREELFITSKLWNSFHDKKNVEVALMKTLSDLNLDYVDLFYIHFPIAQKPVPIEKKYPPGFYCGDGDKWSIEEVPLLDTWRALEKLVDQGLAKSIGISNFSAQLIYDLIRGCTIKPVALQIEHHPYLTQPKLVEYVQLHDIQITGYSSFGPQSFLEMDLKRALDTPVLLEEPTVKSIADKHGKSPAQVLLRYQTQRGIAVIPRSNSPDRMAQNLSVIDFELTQDDLQAIAELDCNLRFNEPWDFSNIPVFV,./data/raw/alphafold//AF-Q6Y0Z3-F1-model_v4.pdb,138,435,1826,542 +639,8906,9045,MSQILESNIRYYPIKQLKDRGYDVDSLPYSLKILVENTFRNLDNVKITEEDLDAIASWKTGKEFSFLPTRVVLQDYTGIPLLVDLAAMRDEMSKRGEDPLKINPIVQSDLIIDHSVQVDYYGTASSLLLNKKKEFERNVERYKFLKWAQRSFKNLRVFPPGKGIIHQINLEYLSKVVDVKEFRGQLTAYPEIVIGTDSHTPMTNGLGVLSWGVGGLEAEAVMLGEPYTMAVPEVVGVRLVGEIKEGVTPTDIVLYITEKLRKKGVVGKFVEFFGPSLGNLTVPDRATIANMAPEYGATASYFPIDYQTLNYLAATAREYKLVEKYAKAQGIFYESQPKYSEVVTIDLSEVEPAIAGPKNPDERVPLKDLKKLFQEKKDKKKGSLVKDLDVVLTAITSCTNTSNPTVMIGAGILAKKAIQHGIRSKSYVKTSMAPGSPVVVEYLKESGLLPYLEALGFHVVGFGCTTCIGNAGPLPKKIEEDVKSNKLEVYGVISGNRNYEGRINPYLSGVFLASPVLVVAFSLAGRIDIDFFNEPIDYDPNGNPVYLRDIWPTTKEISEYIKLGMNPEFYKAVYSHILEGDENWNNLQVKESELYSWDEKSTYIRMPPWISLDLKLDDVKNARILLLLGDKITTDHISPAGPIDKDSVAGKYLSELGEQDLNTYGARRGDHEVMLRGGFANSKLKNLLVDVQGGFTKHFPDGKVMSVYEASQQYKKEGVPLVIVAGKQYGSGSSRDWAAKVTALLGVKAVLAESFERIHRSNLVAMGVVPIEIPDWKSLGIKGDEIVNVYLKDLKPKSKVKVEFIKQDGSKVEVQGLARVDTNVELEYIKQGGILKYVFNKLIHESQN,sabio,Q4J9H0,O=C(O)C=C(CC(=O)O)C(=O)O,0.28,75.0,8.4,4.2.1.3,2285.0,-0.5528419686577808,-0.5528419686577808,O=C(O)C=C(CC(=O)O)C(=O)O__MSQILESNIRYYPIKQLKDRGYDVDSLPYSLKILVENTFRNLDNVKITEEDLDAIASWKTGKEFSFLPTRVVLQDYTGIPLLVDLAAMRDEMSKRGEDPLKINPIVQSDLIIDHSVQVDYYGTASSLLLNKKKEFERNVERYKFLKWAQRSFKNLRVFPPGKGIIHQINLEYLSKVVDVKEFRGQLTAYPEIVIGTDSHTPMTNGLGVLSWGVGGLEAEAVMLGEPYTMAVPEVVGVRLVGEIKEGVTPTDIVLYITEKLRKKGVVGKFVEFFGPSLGNLTVPDRATIANMAPEYGATASYFPIDYQTLNYLAATAREYKLVEKYAKAQGIFYESQPKYSEVVTIDLSEVEPAIAGPKNPDERVPLKDLKKLFQEKKDKKKGSLVKDLDVVLTAITSCTNTSNPTVMIGAGILAKKAIQHGIRSKSYVKTSMAPGSPVVVEYLKESGLLPYLEALGFHVVGFGCTTCIGNAGPLPKKIEEDVKSNKLEVYGVISGNRNYEGRINPYLSGVFLASPVLVVAFSLAGRIDIDFFNEPIDYDPNGNPVYLRDIWPTTKEISEYIKLGMNPEFYKAVYSHILEGDENWNNLQVKESELYSWDEKSTYIRMPPWISLDLKLDDVKNARILLLLGDKITTDHISPAGPIDKDSVAGKYLSELGEQDLNTYGARRGDHEVMLRGGFANSKLKNLLVDVQGGFTKHFPDGKVMSVYEASQQYKKEGVPLVIVAGKQYGSGSSRDWAAKVTALLGVKAVLAESFERIHRSNLVAMGVVPIEIPDWKSLGIKGDEIVNVYLKDLKPKSKVKVEFIKQDGSKVEVQGLARVDTNVELEYIKQGGILKYVFNKLIHESQN,./data/raw/alphafold//AF-Q4J9H0-F1-model_v4.pdb,42,1275,563,1880 +640,8541,8678,MRLHRLRARLSAVACGLLLLLVRGQGQDSASPIRTTHTGQVLGSLVHVKGANAGVQTFLGIPFAKPPLGPLRFAPPEPPESWSGVRDGTTHPAMCLQDLTAVESEFLSQFNMTFPSDSMSEDCLYLSIYTPAHSHEGSNLPVMVWIHGGALVFGMASLYDGSMLAALENVVVVIIQYRLGVLGFFSTGDKHATGNWGYLDQVAALRWVQQNIAHFGGNPDRVTIFGESAGGTSVSSLVVSPISQGLFHGAIMESGVALLPGLIASSADVISTVVANLSACDQVDSEALVGCLRGKSKEEILAINKPFKMIPGVVDGVFLPRHPQELLASADFQPVPSIVGVNNNEFGWLIPKVMRIYDTQKEMDREASQAALQKMLTLLMLPPTFGDLLREEYIGDNGDPQTLQAQFQEMMADSMFVIPALQVAHFQCSRAPVYFYEFQHQPSWLKNIRPPHMKADHGDELPFVFRSFFGGNYIKFTEEEEQLSRKMMKYWANFARNGNPNGEGLPHWPLFDQEEQYLQLNLQPAVGRALKAHRLQFWKKALPQKIQELEEPEERHTEL,brenda,O00748,O=C(C(=O)c1cccc(F)c1F)c1cccc(F)c1F,4.98e-06,37.0,7.4,3.1.1.1,9606.0,-5.302770657240282,-5.302770657240282,O=C(C(=O)c1cccc(F)c1F)c1cccc(F)c1F__MRLHRLRARLSAVACGLLLLLVRGQGQDSASPIRTTHTGQVLGSLVHVKGANAGVQTFLGIPFAKPPLGPLRFAPPEPPESWSGVRDGTTHPAMCLQDLTAVESEFLSQFNMTFPSDSMSEDCLYLSIYTPAHSHEGSNLPVMVWIHGGALVFGMASLYDGSMLAALENVVVVIIQYRLGVLGFFSTGDKHATGNWGYLDQVAALRWVQQNIAHFGGNPDRVTIFGESAGGTSVSSLVVSPISQGLFHGAIMESGVALLPGLIASSADVISTVVANLSACDQVDSEALVGCLRGKSKEEILAINKPFKMIPGVVDGVFLPRHPQELLASADFQPVPSIVGVNNNEFGWLIPKVMRIYDTQKEMDREASQAALQKMLTLLMLPPTFGDLLREEYIGDNGDPQTLQAQFQEMMADSMFVIPALQVAHFQCSRAPVYFYEFQHQPSWLKNIRPPHMKADHGDELPFVFRSFFGGNYIKFTEEEEQLSRKMMKYWANFARNGNPNGEGLPHWPLFDQEEQYLQLNLQPAVGRALKAHRLQFWKKALPQKIQELEEPEERHTEL,./data/raw/alphafold//AF-O00748-F1-model_v4.pdb,522,1992,1390,43 +641,7367,7488,MAQEISNLVKKYNVTWQQTMLRIYDPKETVEFYEKNFGMINIHTYHFNEYNFSLYFLITPPYDEEERKKLPEPNTKESEKYLWNLNTVCLELTYNHNSQEKLSNGNNENDRGFGHIAFNCNDVIEQCDNLFKKNVKFHKLPHETKMKTIGFALDPNNYWIEIVKRSNQVKWKNYKNITNFSQTMIRVKNPEKSLYFYIHILGMKLIHVKHCSDFSLYFLKSNYACAENNKEMIEDQSNKNTNEIYDFNSLKNSYQTDEDYENFKQSWEPVLELTHNHGTEDDDNFSYHNGNTEPRGFGHIGFLVNDLENYCKELETLNVTFKKKVTEGLMKNIAFIYDPDNYVIELIQRDTSFIAK,uniprot_search,Q71KM3,N[C@@H](CCC(O)=NC(CSC(=O)N(O)c1ccc(Cl)cc1)C(O)=NCC(=O)O)C(=O)O,8e-05,30.0,7.0,4.4.1.5,5833.0,-4.096910013008056,-4.096910013008056,N[C@@H](CCC(O)=NC(CSC(=O)N(O)c1ccc(Cl)cc1)C(O)=NCC(=O)O)C(=O)O__MAQEISNLVKKYNVTWQQTMLRIYDPKETVEFYEKNFGMINIHTYHFNEYNFSLYFLITPPYDEEERKKLPEPNTKESEKYLWNLNTVCLELTYNHNSQEKLSNGNNENDRGFGHIAFNCNDVIEQCDNLFKKNVKFHKLPHETKMKTIGFALDPNNYWIEIVKRSNQVKWKNYKNITNFSQTMIRVKNPEKSLYFYIHILGMKLIHVKHCSDFSLYFLKSNYACAENNKEMIEDQSNKNTNEIYDFNSLKNSYQTDEDYENFKQSWEPVLELTHNHGTEDDDNFSYHNGNTEPRGFGHIGFLVNDLENYCKELETLNVTFKKKVTEGLMKNIAFIYDPDNYVIELIQRDTSFIAK,./data/raw/alphafold//AF-Q71KM3-F1-model_v4.pdb,120,1370,673,2016 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+772,8668,8805,MYYFYSPEMFAPYQWGLERDVSYAYMPYNSFYYGDYINSLPYAYIPQNYEVQMKADDRGSWTPFSWVEKYAYAFSGPYNKAEVALTFDDGPDLEFTPKILDKLKQHNVKATFFLLGENAEKFPNIVKRIANEGHVIGNHTYSHPNLAKVNEDEYRNQIIKTEEILNRLAGYAPKFIRPPYGEILENQLKWATEQNFMIVQWSVDTVDWKGVSADTITNNVLGNSFPGSVILQHSTPGGHLQGSVDALDKIIPQLKTKGARFVTLPSMFQTSKERK,brenda,Q81EK9,O=C(NO)c1ccc(-c2cccc3ccccc23)cc1,0.066,50.0,6.0,3.5.1.104,1396.0,-1.1804560644581312,-1.1804560644581312,O=C(NO)c1ccc(-c2cccc3ccccc23)cc1__MYYFYSPEMFAPYQWGLERDVSYAYMPYNSFYYGDYINSLPYAYIPQNYEVQMKADDRGSWTPFSWVEKYAYAFSGPYNKAEVALTFDDGPDLEFTPKILDKLKQHNVKATFFLLGENAEKFPNIVKRIANEGHVIGNHTYSHPNLAKVNEDEYRNQIIKTEEILNRLAGYAPKFIRPPYGEILENQLKWATEQNFMIVQWSVDTVDWKGVSADTITNNVLGNSFPGSVILQHSTPGGHLQGSVDALDKIIPQLKTKGARFVTLPSMFQTSKERK,./data/raw/alphafold//AF-Q81EK9-F1-model_v4.pdb,141,1398,708,2066 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+882,5847,5946,MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,brenda,Q9Y5Y6,N=C(N)c1ccc(Oc2cc(Oc3ccc(C(=N)N)cc3)cc(C(O)=NC3CCC(N)CC3)c2)cc1,1e-05,25.0,7.6,3.4.21.109,9606.0,-5.0,-5.0,N=C(N)c1ccc(Oc2cc(Oc3ccc(C(=N)N)cc3)cc(C(O)=NC3CCC(N)CC3)c2)cc1__MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,./data/raw/alphafold//AF-Q9Y5Y6-F1-model_v4.pdb,489,1916,1302,2740 +883,10849,11009,LKPKSTTFVKLGIKAIALQYKSNYYYKCEKSENKKKDDDKSNIVNTSFLLFPRSSISKTPLRLANSIGLIDAGYRGEIIAALDNTSDQEYHIKKNDKLV,uniprot_search,Q9NFG1,O=c1nc(O)ccn1[C@H]1C[C@H](O)[C@@H](CNC(c2ccccc2)(c2ccccc2)c2ccccc2)O1,0.0002,25.0,5.95,3.6.1.23,5833.0,-3.6989700043360174,-3.6989700043360174,O=c1nc(O)ccn1[C@H]1C[C@H](O)[C@@H](CNC(c2ccccc2)(c2ccccc2)c2ccccc2)O1__LKPKSTTFVKLGIKAIALQYKSNYYYKCEKSENKKKDDDKSNIVNTSFLLFPRSSISKTPLRLANSIGLIDAGYRGEIIAALDNTSDQEYHIKKNDKLV,./data/raw/alphafold//AF-Q9NFG1-F1-model_v4.pdb,233,1593,929,2316 +884,11396,11570,MNSELDYYEKFEEVHGILMYKDFVKYWDNVEAFQARPDDLVIATYPKSGTTWVSEIVYMIYKEGDVEKCKEDVIFNRIPFLECRKENLMNGVKQLDEMNSPRIVKTHLPPELLPASFWEKDCKIIYLCRNAKDVAVSFYYFFLMVAGHPNPGSFPEFVEKFMQGQVPYGSWYKHVKSWWEKGKSPRVLFLFYEDLKEDIRKEVIKLIHFLERKPSEELVDRIIHHTSFQEMKNNPSTNYTTLPDEIMNQKLSPFMRKGITGDWKNHFTVALNEKFDKHYEQQMKESTLKFRTEI,uniprot_search,P49888,Oc1ccc(/C=C/c2cc(O)cc(O)c2)cc1,0.0006,25.0,6.466666666666666,2.8.2.4,9606.0,-3.2218487496163566,-3.2080511878969484,Oc1ccc(/C=C/c2cc(O)cc(O)c2)cc1__MNSELDYYEKFEEVHGILMYKDFVKYWDNVEAFQARPDDLVIATYPKSGTTWVSEIVYMIYKEGDVEKCKEDVIFNRIPFLECRKENLMNGVKQLDEMNSPRIVKTHLPPELLPASFWEKDCKIIYLCRNAKDVAVSFYYFFLMVAGHPNPGSFPEFVEKFMQGQVPYGSWYKHVKSWWEKGKSPRVLFLFYEDLKEDIRKEVIKLIHFLERKPSEELVDRIIHHTSFQEMKNNPSTNYTTLPDEIMNQKLSPFMRKGITGDWKNHFTVALNEKFDKHYEQQMKESTLKFRTEI,./data/raw/alphafold//AF-P49888-F1-model_v4.pdb,310,1690,1037,2440 +885,8490,8627,MKMKMKLASFGLAAGLAAQVFLPYNALASTEHVTWNQQFQTPQFISGDLLKVNGTSPEELVYQYVEKNENKFKFHENAKDTLQLKEKKNDNLGFTFMRFQQTYKGIPVFGAVVTSHVKDGTLTALSGTLIPNLDTKGSLKSGKKLSEKQARDIAEKDLVANVTKEVPEYEQGKDTEFVVYVNGDEASLAYVVNLNFLTPEPGNWLYIIDAVDGKILNKFNQLDAAKPGDVKSITGTSTVGVGRGVLGDQKNINTTYSTYYYLQDNTRGNGIFTYDAKYRTTLPGSLWADADNQFFASYDAPAVDAHYYAGVTYDYYKNVHNRLSYDGNNAAIRSSVHYSQGYNNAFWNGSQMVYGDGDGQTFIPLSGGIDVVAHELTHAVTDYTAGLIYQNESGAINEAISDIFGTLVEFYANKNPDWEIGEDVYTPGISGDSLRSMSDPAKYGDPDHYSKRYTGTQDNGGVHINSGIINKAAYLISQGGTHYGVSVVGIGRDKLGKIFYRALTQYLTPTSNFSQLRAAAVQSATDLYGSTSQEVASVKQAFDAVGVK,uniprot_search,P00800,Nn1c(-c2ccc(Cl)cc2)nc2ccccc2c1=O,10000.0,25.0,7.0,3.4.24.27,1427.0,4.0,4.0,Nn1c(-c2ccc(Cl)cc2)nc2ccccc2c1=O__MKMKMKLASFGLAAGLAAQVFLPYNALASTEHVTWNQQFQTPQFISGDLLKVNGTSPEELVYQYVEKNENKFKFHENAKDTLQLKEKKNDNLGFTFMRFQQTYKGIPVFGAVVTSHVKDGTLTALSGTLIPNLDTKGSLKSGKKLSEKQARDIAEKDLVANVTKEVPEYEQGKDTEFVVYVNGDEASLAYVVNLNFLTPEPGNWLYIIDAVDGKILNKFNQLDAAKPGDVKSITGTSTVGVGRGVLGDQKNINTTYSTYYYLQDNTRGNGIFTYDAKYRTTLPGSLWADADNQFFASYDAPAVDAHYYAGVTYDYYKNVHNRLSYDGNNAAIRSSVHYSQGYNNAFWNGSQMVYGDGDGQTFIPLSGGIDVVAHELTHAVTDYTAGLIYQNESGAINEAISDIFGTLVEFYANKNPDWEIGEDVYTPGISGDSLRSMSDPAKYGDPDHYSKRYTGTQDNGGVHINSGIINKAAYLISQGGTHYGVSVVGIGRDKLGKIFYRALTQYLTPTSNFSQLRAAAVQSATDLYGSTSQEVASVKQAFDAVGVK,./data/raw/alphafold//AF-P00800-F1-model_v4.pdb,240,1601,941,2330 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+887,4911,5005,MDSKHQCVKLNDGHFMPVLGFGTYAPPEVPRSKALEVTKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWSTFHRPELVRPALENSLKKAQLDYVDLYLIHSPMSLKPGEELSPTDENGKVIFDIVDLCTTWEAMEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNRSKLLDFCKSKDIVLVAYSALGSQRDKRWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTAEDMKAIDGLDRNLHYFNSDSFASHPNYPYSDEY,sabio,P42330,C[C@]12CCC3C(C1CC[C@@]24CCC(C(=O)O4)(C)C)CCC5=C3C=CC(=C5)C(=O)N,6.900000000000001e-06,37.0,7.5,1.1.1.64,9606.0,-5.161150909262744,-5.161150909262744,C[C@]12CCC3C(C1CC[C@@]24CCC(C(=O)O4)(C)C)CCC5=C3C=CC(=C5)C(=O)N__MDSKHQCVKLNDGHFMPVLGFGTYAPPEVPRSKALEVTKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWSTFHRPELVRPALENSLKKAQLDYVDLYLIHSPMSLKPGEELSPTDENGKVIFDIVDLCTTWEAMEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNRSKLLDFCKSKDIVLVAYSALGSQRDKRWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTAEDMKAIDGLDRNLHYFNSDSFASHPNYPYSDEY,./data/raw/alphafold//AF-P42330-F1-model_v4.pdb,138,442,538,1988 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+951,1495,1531,MWVPVVFLTLSVTWIGAAPLILSRIVGGWECEKHSQPWQVLVASRGRAVCGGVLVHPQWVLTAAHCIRNKSVILLGRHSLFHPEDTGQVFQVSHSFPHPLYDMSLLKNRFLRPGDDSSHDLMLLRLSEPAELTDAVKVMDLPTQEPALGTTCYASGWGSIEPEEFLTPKKLQCVDLHVISNDVCAQVHPQKVTKFMLCAGRWTGGKSTCSGDSGGPLVCNGVLQGITSWGSEPCALPERPSLYTKVVHYRKWIKDTIVANP,uniprot_search,P07288,CC(C)C[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)OCc1ccccc1)C(=O)O,0.5,37.0,6.6000000000000005,3.4.21.77,9606.0,-0.3010299956639812,-0.3010299956639812,CC(C)C[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)OCc1ccccc1)C(=O)O__MWVPVVFLTLSVTWIGAAPLILSRIVGGWECEKHSQPWQVLVASRGRAVCGGVLVHPQWVLTAAHCIRNKSVILLGRHSLFHPEDTGQVFQVSHSFPHPLYDMSLLKNRFLRPGDDSSHDLMLLRLSEPAELTDAVKVMDLPTQEPALGTTCYASGWGSIEPEEFLTPKKLQCVDLHVISNDVCAQVHPQKVTKFMLCAGRWTGGKSTCSGDSGGPLVCNGVLQGITSWGSEPCALPERPSLYTKVVHYRKWIKDTIVANP,./data/raw/alphafold//AF-P07288-F1-model_v4.pdb,638,1747,1103,2516 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+995,8790,8928,MNTLIGKTGIVVRNIQRAELDSIDALGRLGVATVHEAQNRKGLLSSKMRPIQQGTSLAGSAVTVLVAPGDNWMFHVAVEQCRPGDVLVVSPSSPCTDGYFGDLLATSLQARGVRALIVDAGVRDTQTLRDMGFAVWARAINAQGTVKETLGSVNLPVICGGQLINPGDIVVADDDGVVVVRRDECESTLVAAAERAGLEEEKRLRLAAGELGLDIYKMRERLEAKGLRYVDNIEDLEG,sabio,A5W059,O=C(O)C(=O)O,0.0017,25.0,8.0,4.1.3.17,303.0,-2.7695510786217263,-2.5352905371428536,O=C(O)C(=O)O__MNTLIGKTGIVVRNIQRAELDSIDALGRLGVATVHEAQNRKGLLSSKMRPIQQGTSLAGSAVTVLVAPGDNWMFHVAVEQCRPGDVLVVSPSSPCTDGYFGDLLATSLQARGVRALIVDAGVRDTQTLRDMGFAVWARAINAQGTVKETLGSVNLPVICGGQLINPGDIVVADDDGVVVVRRDECESTLVAAAERAGLEEEKRLRLAAGELGLDIYKMRERLEAKGLRYVDNIEDLEG,./data/raw/alphafold//AF-A5W059-F1-model_v4.pdb,1315,951,2263,1114 +996,4628,4715,MSEVLITGLRTRAVNVPLAYPVHTAVGTVGTAPLVLIDLATSAGVVGHSYLFAYTPVALKSLKQLLDDMAAMIVNEPLAPVSLEAMLAKRFCLAGYTGLIRMAAAGIDMAAWDALGKVHETPLVKLLGANARPVQAYDSHSLDGVKLATERAVTAAELGFRAVKTKIGYPALDQDLAVVRSIRQAVGDDFGIMVDYNQSLDVPAAIKRSQALQQEGVTWIEEPTLQHDYEGHQRIQSKLNVPVQMGENWLGPEEMFKALSIGACRLAMPDAMKIGGVTGWIRASALAQQFGIPMSSHLFQEISAHLLAATPTAHWLERLDLAGSVIEPTLTFEGGNAVIPDLPGVGIIWREKEIGKYLV,brenda,P11444,C[C@@H](O)P(=O)(O)O,40.2,25.0,7.5,5.1.2.2,303.0,1.60422605308447,1.60422605308447,C[C@@H](O)P(=O)(O)O__MSEVLITGLRTRAVNVPLAYPVHTAVGTVGTAPLVLIDLATSAGVVGHSYLFAYTPVALKSLKQLLDDMAAMIVNEPLAPVSLEAMLAKRFCLAGYTGLIRMAAAGIDMAAWDALGKVHETPLVKLLGANARPVQAYDSHSLDGVKLATERAVTAAELGFRAVKTKIGYPALDQDLAVVRSIRQAVGDDFGIMVDYNQSLDVPAAIKRSQALQQEGVTWIEEPTLQHDYEGHQRIQSKLNVPVQMGENWLGPEEMFKALSIGACRLAMPDAMKIGGVTGWIRASALAQQFGIPMSSHLFQEISAHLLAATPTAHWLERLDLAGSVIEPTLTFEGGNAVIPDLPGVGIIWREKEIGKYLV,./data/raw/alphafold//AF-P11444-F1-model_v4.pdb,305,1685,1032,2433 +997,6631,6743,MAKGFYISKSLGILGILLGVAAVCTIIALSVVYSQEKNKNANSSPVASTTPSASATTNPASATTLDQSKAWNRYRLPNTLKPDSYRVTLRPYLTPNDRGLYVFKGSSTVRFTCKEATDVIIIHSKKLNYTLSQGHRVVLRGVGGSQPPDIDKTELVEPTEYLVVHLKGSLVKDSQYEMDSEFEGELADDLAGFYRSEYMEGNVRKVVATTQMQAADARKSFPCFDEPAMKAEFNITLIHPKDLTALSNMLPKGPSTPLPEDPNWNVTEFHTTPKMSTYLLAFIVSEFDYVEKQASNGVLIRIWARPSAIAAGHGDYALNVTGPILNFFAGHYDTPYPLPKSDQIGLPDFNAGAMENWGLVTYRENSLLFDPLSSSSSNKERVVTVIAHELAHQWFGNLVTIEWWNDLWLNEGFASYVEYLGADYAEPTWNLKDLMVLNDVYRVMAVDALASSHPLSTPASEINTPAQISELFDAISYSKGASVLRMLSSFLSEDVFKQGLASYLHTFAYQNTIYLNLWDHLQEAVNNRSIQLPTTVRDIMNRWTLQMGFPVITVDTSTGTLSQEHFLLDPDSNVTRPSEFNYVWIVPITSIRDGRQQQDYWLIDVRAQNDLFSTSGNEWVLLNLNVTGYYRVNYDEENWRKIQTQLQRDHSAIPVINRAQIINDAFNLASAHKVPVTLALNNTLFLIEERQYMPWEAALSSLSYFKLMFDRSEVYGPMKNYLKKQVTPLFIHFRNNTNNWREIPENLMDQYSEVNAISTACSNGVPECEEMVSGLFKQWMENPNNNPIHPNLRSTVYCNAIAQGGEEEWDFAWEQFRNATLVNEADKLRAALACSKELWILNRYLSYTLNPDLIRKQDATSTIISITNNVIGQGLVWDFVQSNWKKLFNDYGGGSFSFSNLIQAVTRRFSTEYELQQLEQFKKDNEETGFGSGTRALEQALEKTKANIKWVKENKEVVLQWFTENSK,uniprot_search,P15144,NC(CCc1ccc(O)cc1)P(=O)(O)O,0.0237,34.5,7.09375,3.4.11.2,9606.0,-1.6252516539898962,-1.6252516539898962,NC(CCc1ccc(O)cc1)P(=O)(O)O__MAKGFYISKSLGILGILLGVAAVCTIIALSVVYSQEKNKNANSSPVASTTPSASATTNPASATTLDQSKAWNRYRLPNTLKPDSYRVTLRPYLTPNDRGLYVFKGSSTVRFTCKEATDVIIIHSKKLNYTLSQGHRVVLRGVGGSQPPDIDKTELVEPTEYLVVHLKGSLVKDSQYEMDSEFEGELADDLAGFYRSEYMEGNVRKVVATTQMQAADARKSFPCFDEPAMKAEFNITLIHPKDLTALSNMLPKGPSTPLPEDPNWNVTEFHTTPKMSTYLLAFIVSEFDYVEKQASNGVLIRIWARPSAIAAGHGDYALNVTGPILNFFAGHYDTPYPLPKSDQIGLPDFNAGAMENWGLVTYRENSLLFDPLSSSSSNKERVVTVIAHELAHQWFGNLVTIEWWNDLWLNEGFASYVEYLGADYAEPTWNLKDLMVLNDVYRVMAVDALASSHPLSTPASEINTPAQISELFDAISYSKGASVLRMLSSFLSEDVFKQGLASYLHTFAYQNTIYLNLWDHLQEAVNNRSIQLPTTVRDIMNRWTLQMGFPVITVDTSTGTLSQEHFLLDPDSNVTRPSEFNYVWIVPITSIRDGRQQQDYWLIDVRAQNDLFSTSGNEWVLLNLNVTGYYRVNYDEENWRKIQTQLQRDHSAIPVINRAQIINDAFNLASAHKVPVTLALNNTLFLIEERQYMPWEAALSSLSYFKLMFDRSEVYGPMKNYLKKQVTPLFIHFRNNTNNWREIPENLMDQYSEVNAISTACSNGVPECEEMVSGLFKQWMENPNNNPIHPNLRSTVYCNAIAQGGEEEWDFAWEQFRNATLVNEADKLRAALACSKELWILNRYLSYTLNPDLIRKQDATSTIISITNNVIGQGLVWDFVQSNWKKLFNDYGGGSFSFSNLIQAVTRRFSTEYELQQLEQFKKDNEETGFGSGTRALEQALEKTKANIKWVKENKEVVLQWFTENSK,./data/raw/alphafold//AF-P15144-F1-model_v4.pdb,34,1264,550,1866 +998,5582,5681,MAGGRHRRVVGTLHLLLLVAALPWASRGVSPSASAWPEEKNYHQPAILNSSALRQIAEGTSISEMWQNDLQPLLIERYPGSPGSYAARQHIMQRIQRLQADWVLEIDTFLSQTPYGYRSFSNIISTLNPTAKRHLVLACHYDSKYFSHWNNRVFVGATDSAVPCAMMLELARALDKKLLSLKTVSDSKPDLSLQLIFFDGEEAFLHWSPQDSLYGSRHLAAKMASTPHPPGARGTSQLHGMDLLVLLDLIGAPNPTFPNFFPNSARWFERLQAIEHELHELGLLKDHSLEGRYFQNYSYGGVIQDDHIPFLRRGVPVLHLIPSPFPEVWHTMDDNEENLDESTIDNLNKILQVFVLEYLHL,brenda,Q16769,N#CNC(=NCCCn1ccnc1)NCC1CC1,1.37,30.666666666666668,7.0,2.3.2.5,9606.0,0.1367205671564068,0.1367205671564068,N#CNC(=NCCCn1ccnc1)NCC1CC1__MAGGRHRRVVGTLHLLLLVAALPWASRGVSPSASAWPEEKNYHQPAILNSSALRQIAEGTSISEMWQNDLQPLLIERYPGSPGSYAARQHIMQRIQRLQADWVLEIDTFLSQTPYGYRSFSNIISTLNPTAKRHLVLACHYDSKYFSHWNNRVFVGATDSAVPCAMMLELARALDKKLLSLKTVSDSKPDLSLQLIFFDGEEAFLHWSPQDSLYGSRHLAAKMASTPHPPGARGTSQLHGMDLLVLLDLIGAPNPTFPNFFPNSARWFERLQAIEHELHELGLLKDHSLEGRYFQNYSYGGVIQDDHIPFLRRGVPVLHLIPSPFPEVWHTMDDNEENLDESTIDNLNKILQVFVLEYLHL,./data/raw/alphafold//AF-Q16769-F1-model_v4.pdb,418,1513,839,2217 +999,1136,1159,MELYNGERPSVFRLLGKYMRKGLYSILTQGPIPTHIAFILDGNGRFAKKHKLPEGGGHKAGFLALLNVLTYCYELGVKYATIYAFSIDNFRRKPHEVQYVMNLMLEKIEGMIMEESIINAYDICVRFVGNLKLLDEPLKTAADKIMRATAKNSKFVLLLAVCYTSTDEIVHAVEESSKDKLKSDEICNDGNGDCVIKIEEMEPYSEIKLVELERNTYINPYPDVLIRTSGETRLSNYLLWQTTNCILYSPHALWPEIGLRHVVWAVINCQRHYSYLEKHKEYLK,uniprot_search,Q8W3U4,CC(C)=CCC/C(C)=C/CC/C(C)=C/C/C(C(=O)[O-])=C(\C)C(=O)[O-].[Li+].[Li+],0.14,25.0,7.5,2.5.1.20,3981.0,-0.8538719643217619,-0.8538719643217619,CC(C)=CCC/C(C)=C/CC/C(C)=C/C/C(C(=O)[O-])=C(\C)C(=O)[O-].[Li+].[Li+]__MELYNGERPSVFRLLGKYMRKGLYSILTQGPIPTHIAFILDGNGRFAKKHKLPEGGGHKAGFLALLNVLTYCYELGVKYATIYAFSIDNFRRKPHEVQYVMNLMLEKIEGMIMEESIINAYDICVRFVGNLKLLDEPLKTAADKIMRATAKNSKFVLLLAVCYTSTDEIVHAVEESSKDKLKSDEICNDGNGDCVIKIEEMEPYSEIKLVELERNTYINPYPDVLIRTSGETRLSNYLLWQTTNCILYSPHALWPEIGLRHVVWAVINCQRHYSYLEKHKEYLK,./data/raw/alphafold//AF-Q8W3U4-F1-model_v4.pdb,311,1692,1040,2443 +1000,3381,3454,MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,brenda,Q9Y5Y6,CC[C@H](C)[C@H](N=C(O)[C@H](CO)N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N=C(O)[C@H](CS)N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(O)=N[C@H](C(O)=N[C@@H](CS)C(O)=N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](C)C(=O)O)[C@@H](C)CC,0.0015,25.0,7.6,3.4.21.109,9606.0,-2.8239087409443187,-2.8239087409443187,CC[C@H](C)[C@H](N=C(O)[C@H](CO)N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N=C(O)[C@H](CS)N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(O)=N[C@H](C(O)=N[C@@H](CS)C(O)=N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](C)C(=O)O)[C@@H](C)CC__MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,./data/raw/alphafold//AF-Q9Y5Y6-F1-model_v4.pdb,489,1916,1302,2740 +1001,1238,1265,MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,uniprot_search,P08246,CC(C)C1C(=O)N(S(C)(=O)=O)[C@@H]2CCN(C(=O)c3cnc(CNC4CC4)cn3)C12,1.4e-08,30.0,7.4,3.4.21.37,9606.0,-7.853871964321762,-7.853871964321762,CC(C)C1C(=O)N(S(C)(=O)=O)[C@@H]2CCN(C(=O)c3cnc(CNC4CC4)cn3)C12__MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,./data/raw/alphafold//AF-P08246-F1-model_v4.pdb,626,1712,1064,2468 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+1014,226,230,MTDKIAVLLGGTSAEREVSLNSGAAVLAGLREGGIDAYPVDPKEVDVTQLKSMGFQKVFIALHGRGGEDGTLQGMLELMGLPYTGSGVMASALSMDKLRSKLLWQGAGLPVAPWVALTRAEFEKGLSDKQLAEISALGLPVIVKPSREGSSVGMSKVVAENALQDALRLAFQHDEEVLIEKWLSGPEFTVAILGEEILPSIRIQPSGTFYDYEAKYLSDETQYFCPAGLEASQEANLQALVLKAWTTLGCKGWGRIDVMLDSDGQFYLLEANTSPGMTSHSLVPMAARQAGMSFSQLVVRILELAD,brenda,P07862,C/C(O)=C(\C#N)C(O)=Nc1cc(Br)ccc1Br,0.185,37.0,7.5,6.3.2.4,562.0,-0.7328282715969863,-0.7328282715969863,C/C(O)=C(\C#N)C(O)=Nc1cc(Br)ccc1Br__MTDKIAVLLGGTSAEREVSLNSGAAVLAGLREGGIDAYPVDPKEVDVTQLKSMGFQKVFIALHGRGGEDGTLQGMLELMGLPYTGSGVMASALSMDKLRSKLLWQGAGLPVAPWVALTRAEFEKGLSDKQLAEISALGLPVIVKPSREGSSVGMSKVVAENALQDALRLAFQHDEEVLIEKWLSGPEFTVAILGEEILPSIRIQPSGTFYDYEAKYLSDETQYFCPAGLEASQEANLQALVLKAWTTLGCKGWGRIDVMLDSDGQFYLLEANTSPGMTSHSLVPMAARQAGMSFSQLVVRILELAD,./data/raw/alphafold//AF-P07862-F1-model_v4.pdb,97,1343,640,1970 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+1016,7575,7704,MSLHDAYHWPSRTPSRKGSNIKLNKTLQDHLDELEEQFTIPTELLHRVTDRFVSELYKGLTTNPGDVPMVPTWIIGTPDGNEHGSYLALDLGGTNLRVCAVEVQGNGKFDITQSKYRLPQELKVGTREALFDYIADCIKKFVEEVHPGKSQNLEIGFTFSYPCVQRSINDASLVAWTKGFDIDGVEGESVGPLLSAALKRVGCNNVRLNAILSDTTGTLVASNYASPGTEIGVIFGTGCNACYIEKFSEIPKLHKYDFPEDMNMIINCEWCDFDNQHVVLPRTKYDVAIDEESPRPGLQTYEKMIAGCYLGDILRRILLDLYEQGALFNGQDVTKIRDPLAMDTSVLSAIEVDPFENLDETQTLFEETYGLKTTEEERQFIRRACELIGTRSARLSACGVCALVRKMNKPSMIVGTDGSVYNLYPRFKDRLAQAFKDILGEEIGSKVVTIPAEDGSGVGAALVSALEAKGKALTSDILAEHLKN,brenda,Q09756,N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,11.0,30.0,8.1,2.7.1.1,4896.0,1.0413926851582251,1.0413926851582251,N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O__MSLHDAYHWPSRTPSRKGSNIKLNKTLQDHLDELEEQFTIPTELLHRVTDRFVSELYKGLTTNPGDVPMVPTWIIGTPDGNEHGSYLALDLGGTNLRVCAVEVQGNGKFDITQSKYRLPQELKVGTREALFDYIADCIKKFVEEVHPGKSQNLEIGFTFSYPCVQRSINDASLVAWTKGFDIDGVEGESVGPLLSAALKRVGCNNVRLNAILSDTTGTLVASNYASPGTEIGVIFGTGCNACYIEKFSEIPKLHKYDFPEDMNMIINCEWCDFDNQHVVLPRTKYDVAIDEESPRPGLQTYEKMIAGCYLGDILRRILLDLYEQGALFNGQDVTKIRDPLAMDTSVLSAIEVDPFENLDETQTLFEETYGLKTTEEERQFIRRACELIGTRSARLSACGVCALVRKMNKPSMIVGTDGSVYNLYPRFKDRLAQAFKDILGEEIGSKVVTIPAEDGSGVGAALVSALEAKGKALTSDILAEHLKN,./data/raw/alphafold//AF-Q09756-F1-model_v4.pdb,1129,709,144,831 +1017,3652,3728,MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,uniprot_search,P23946,CN(Cc1ccccc1)c1nc2ccccc2c(=O)o1,1.1e-05,25.0,8.0,3.4.21.39,9606.0,-4.958607314841775,-4.958607314841775,CN(Cc1ccccc1)c1nc2ccccc2c(=O)o1__MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,./data/raw/alphafold//AF-P23946-F1-model_v4.pdb,631,1222,504,1806 +1018,5329,5426,MAIGSVVFAAAGLLLLLLPPSHQQATAGNIGSQWRDDEVHFNRTLDSILVPRVVGSRGHQQVREYLVQSLNGLGFQTEVDEFKQRVPVFGELTFANVVGTINPQAQNFLALACHYDSKYFPNDPGFVGATDSAVPCAILLNTAKTLGAYLQKEFRNRSDVGLMLIFFDGEEAFKEWTDADSVYGSKHLAAKLASKRSGSQAQLAPRNIDRIEVLVLLDLIGARNPKFSSFYENTDGLHSSLVQIEKSLRTAGQLEGNNNMFLSRVSGGLVDDDHRPFLDENVPVLHLVATPFPDVWHTPRDNAANLHWPSIRNFNRVFRNFVYQYLKRHTSPVNLRFYRT,brenda,Q9VRQ9,Cc1cnc[nH]1,0.073,30.0,8.0,2.3.2.5,7227.0,-1.136677139879544,-1.136677139879544,Cc1cnc[nH]1__MAIGSVVFAAAGLLLLLLPPSHQQATAGNIGSQWRDDEVHFNRTLDSILVPRVVGSRGHQQVREYLVQSLNGLGFQTEVDEFKQRVPVFGELTFANVVGTINPQAQNFLALACHYDSKYFPNDPGFVGATDSAVPCAILLNTAKTLGAYLQKEFRNRSDVGLMLIFFDGEEAFKEWTDADSVYGSKHLAAKLASKRSGSQAQLAPRNIDRIEVLVLLDLIGARNPKFSSFYENTDGLHSSLVQIEKSLRTAGQLEGNNNMFLSRVSGGLVDDDHRPFLDENVPVLHLVATPFPDVWHTPRDNAANLHWPSIRNFNRVFRNFVYQYLKRHTSPVNLRFYRT,./data/raw/alphafold//AF-Q9VRQ9-F1-model_v4.pdb,418,1826,1193,2619 +1019,3657,3733,MLSLTRILRKKIPVHELAGKISRPPLRPFSVVVASDEKGGIGDGGTIPWEIPEDMQYFRRVTTNLRGKNVKPSPSKRNAVVMGRKTWDSLPPKFRPLSNRLNVVLSRSATKEQLLAGIPDPIKRAEAANDVVAVNGGLEDALRMLVSKEHTSSIETVFCIGGGTIYKQALCAPCVNVLQAIHRTVVRPASNSCSVFFDIPAAGTKTPEGLELVRESITDERVSTGAGGKKYQFEKLVPRNSEEEQYLNLVGRIIDEGCTKCDRTGVGTRSLFGAQMRFSLRNNRLPLLTTKRVFWRGVCEELLWFLRGETNAKLLSDKGIHIWDGNGSRAFLDSRGLTDYDEMDLGPVYGFQWRHFGADYISCKVDSEGKGVDQIANIVKSLIENPDDRRMICTAWNPAALPRMALPPCHMMAQFYVSNGELSCMLYQRSCDMGLGVPFNIASYALLTFLMAKASGLRPGELVHTLGDAHVYSNHVEPCRKQLKRVPRPFPFIVFKQDKEFLEDFQESDIEVIDYSPYPVISMEMAV,brenda,Q27783,CN(Cc1cnc2nc(=N)[nH]c(N)c2n1)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1,9.5e-08,25.0,7.4,1.5.1.3,5691.0,-7.022276394711152,-7.022276394711152,CN(Cc1cnc2nc(=N)[nH]c(N)c2n1)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1__MLSLTRILRKKIPVHELAGKISRPPLRPFSVVVASDEKGGIGDGGTIPWEIPEDMQYFRRVTTNLRGKNVKPSPSKRNAVVMGRKTWDSLPPKFRPLSNRLNVVLSRSATKEQLLAGIPDPIKRAEAANDVVAVNGGLEDALRMLVSKEHTSSIETVFCIGGGTIYKQALCAPCVNVLQAIHRTVVRPASNSCSVFFDIPAAGTKTPEGLELVRESITDERVSTGAGGKKYQFEKLVPRNSEEEQYLNLVGRIIDEGCTKCDRTGVGTRSLFGAQMRFSLRNNRLPLLTTKRVFWRGVCEELLWFLRGETNAKLLSDKGIHIWDGNGSRAFLDSRGLTDYDEMDLGPVYGFQWRHFGADYISCKVDSEGKGVDQIANIVKSLIENPDDRRMICTAWNPAALPRMALPPCHMMAQFYVSNGELSCMLYQRSCDMGLGVPFNIASYALLTFLMAKASGLRPGELVHTLGDAHVYSNHVEPCRKQLKRVPRPFPFIVFKQDKEFLEDFQESDIEVIDYSPYPVISMEMAV,./data/raw/alphafold//AF-Q27783-F1-model_v4.pdb,646,2100,1326,2769 +1020,5079,5175,MAPKAKIVLVGSGMIGGVMATLIVQKNLGDVVLFDIVKNMPHGKALDTSHTNVMAYSNCKVSGSNTYDDLAGADVVIVTAGFTKAPGKSDKEWNRDDLLPLNNKIMIEIGGHIKKNCPNAFIIVVTNPVDVMVQLLHQHSGVPKNKIIGLGGVLDTSRLKYYISQKLNVCPRDVNAHIVGAHGNKMVLLKRYITVGGIPLQEFINNKLISDAELEAIFDRTVNTALEIVNLHASPYVAPAAAIIEMAESYLKDLKKVLICSTLLEGQYGHSDIFGGTPVVLGANGVEQVIELQLNSEEKAKFDEAIAETKRMKALA,sabio,Q27743,Cc1cc2c(C(C)C)c(O)c(O)c(C(=O)O)c2cc1-c1cc2c(C(=O)O)c(O)c(O)c(C(C)C)c2cc1C,0.0012,25.0,7.5,1.1.1.27,5833.0,-2.920818753952376,-2.920818753952376,Cc1cc2c(C(C)C)c(O)c(O)c(C(=O)O)c2cc1-c1cc2c(C(=O)O)c(O)c(O)c(C(C)C)c2cc1C__MAPKAKIVLVGSGMIGGVMATLIVQKNLGDVVLFDIVKNMPHGKALDTSHTNVMAYSNCKVSGSNTYDDLAGADVVIVTAGFTKAPGKSDKEWNRDDLLPLNNKIMIEIGGHIKKNCPNAFIIVVTNPVDVMVQLLHQHSGVPKNKIIGLGGVLDTSRLKYYISQKLNVCPRDVNAHIVGAHGNKMVLLKRYITVGGIPLQEFINNKLISDAELEAIFDRTVNTALEIVNLHASPYVAPAAAIIEMAESYLKDLKKVLICSTLLEGQYGHSDIFGGTPVVLGANGVEQVIELQLNSEEKAKFDEAIAETKRMKALA,./data/raw/alphafold//AF-Q27743-F1-model_v4.pdb,239,1600,940,2091 +1021,230,234,MRCRSLSHFKDDDFAVVSEVVTHKQNHIPVIKGDFVSLPKHVQRFVAEKAELMKPSAIFICDGSQNEADELIARCVERGVLVPLKAYKNNYLCRTDPRDVARVESKTWMITPEKYDSVCHTPEGVKPMMGQWMSPDEFGKELDDRFPGCMAGRTMYVIPYSMGPVGGPLSKIGIELTDSDYVVLCMRIMTRMGEPVLKALAKNNGEFVRCVHSVGQPKPVATKVINHWPCNPEKTIIAHRPAEREIWSFGSGYGGNSLLGKKCFALRIAMNIGYDEGWMAEHMLIMGVTSPKGEERFVAAAFPSACGKTNLAMLEPTIPGWKVRVIGDDIAWMKFGADGRLYAINPEYGFFGVAPGTSHKTNPMAMASFQENTIFTNVAETADGEYFWEGLEHEVKNPKVDMINWLGEPWHIGDESKAAHPNSRFTAPAGQCPIIHPDWEKPEGVPIDAIIFGGRRPEGVPLVFESRSWVHGIFVGACVKSEATAAAEHTGKQVMHDPMAMRPFMGYNFGRYMRHWMKLGQPPHKVPKIFHVNWFRQSADHKFLWPGYGDNIRVIDWILRRCSGDATIAEETPIGFIPKKGTINLEGLPNVNWDELMSIPKSYWLEDMVETKTFFENQVGSDLPPEIAKELEAQTERIKALKE,sabio,Q05893,C/C=C(\OP(=O)(O)O)C(=O)O,0.108,25.0,7.4,4.1.1.32,6253.0,-0.9665762445130504,-0.9665762445130504,C/C=C(\OP(=O)(O)O)C(=O)O__MRCRSLSHFKDDDFAVVSEVVTHKQNHIPVIKGDFVSLPKHVQRFVAEKAELMKPSAIFICDGSQNEADELIARCVERGVLVPLKAYKNNYLCRTDPRDVARVESKTWMITPEKYDSVCHTPEGVKPMMGQWMSPDEFGKELDDRFPGCMAGRTMYVIPYSMGPVGGPLSKIGIELTDSDYVVLCMRIMTRMGEPVLKALAKNNGEFVRCVHSVGQPKPVATKVINHWPCNPEKTIIAHRPAEREIWSFGSGYGGNSLLGKKCFALRIAMNIGYDEGWMAEHMLIMGVTSPKGEERFVAAAFPSACGKTNLAMLEPTIPGWKVRVIGDDIAWMKFGADGRLYAINPEYGFFGVAPGTSHKTNPMAMASFQENTIFTNVAETADGEYFWEGLEHEVKNPKVDMINWLGEPWHIGDESKAAHPNSRFTAPAGQCPIIHPDWEKPEGVPIDAIIFGGRRPEGVPLVFESRSWVHGIFVGACVKSEATAAAEHTGKQVMHDPMAMRPFMGYNFGRYMRHWMKLGQPPHKVPKIFHVNWFRQSADHKFLWPGYGDNIRVIDWILRRCSGDATIAEETPIGFIPKKGTINLEGLPNVNWDELMSIPKSYWLEDMVETKTFFENQVGSDLPPEIAKELEAQTERIKALKE,./data/raw/alphafold//AF-Q05893-F1-model_v4.pdb,99,517,644,1974 +1022,6367,6476,MSRPIVISGPSGTGKSTLLKKLFAEYPDSFGFSVSSTTRTPRAGEVNGKDYNFVSVDEFKSMIKNNEFIEWAQFSGNYYGSTVASVKQVSKSGKTCILDIDMQGVKSVKAIPELNARFLFIAPPSVEDLKKRLEGRGTETEESINKRLSAAQAELAYAETGAHDKVIVNDDLDKAYKELKDFIFAEK,uniprot_search,A0A6A5Q2A7,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1,0.035,25.0,7.5,2.7.4.8,4932.0,-1.4559319556497243,-1.4559319556497243,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1__MSRPIVISGPSGTGKSTLLKKLFAEYPDSFGFSVSSTTRTPRAGEVNGKDYNFVSVDEFKSMIKNNEFIEWAQFSGNYYGSTVASVKQVSKSGKTCILDIDMQGVKSVKAIPELNARFLFIAPPSVEDLKKRLEGRGTETEESINKRLSAAQAELAYAETGAHDKVIVNDDLDKAYKELKDFIFAEK,./data/raw/alphafold//AF-A0A6A5Q2A7-F1-model_v4.pdb,977,518,1881,599 +1023,1643,1681,MTTNAGPLHPYWPQHLRLDNFVPNDRPTWHILAGLFSVTGVLVVTTWLLSGRAAVVPLGTWRRLSLCWFAVCGFIHLVIEGWFVLYYEDLLGDQAFLSQLWKEYAKGDSRYILGDNFTVCMETITACLWGPLSLWVVIAFLRQHPLRFILQLVVSVGQIYGDVLYFLTEHRDGFQHGELGHPLYFWFYFVFMNALWLVLPGVLVLDAVKHLTHAQSTLDAKATKAKSKKN,brenda,Q15125,CC(C)[C@](C#N)(CCCN(C)CCc1ccccc1)c1ccccc1,1.9e-05,40.0,7.5,5.3.3.5,9606.0,-4.721246399047171,-4.721246399047171,CC(C)[C@](C#N)(CCCN(C)CCc1ccccc1)c1ccccc1__MTTNAGPLHPYWPQHLRLDNFVPNDRPTWHILAGLFSVTGVLVVTTWLLSGRAAVVPLGTWRRLSLCWFAVCGFIHLVIEGWFVLYYEDLLGDQAFLSQLWKEYAKGDSRYILGDNFTVCMETITACLWGPLSLWVVIAFLRQHPLRFILQLVVSVGQIYGDVLYFLTEHRDGFQHGELGHPLYFWFYFVFMNALWLVLPGVLVLDAVKHLTHAQSTLDAKATKAKSKKN,./data/raw/alphafold//AF-Q15125-F1-model_v4.pdb,209,1562,1252,2277 +1024,3245,3315,MWALDFLLSFLLIQLAAQVDSSGTWCYDSQDPKCGPAHWKELAPACGGPTQSPINIDLRLVQRDYTLKPFIFQGYDSAPQDPWVLENDGHTVLLRVNSCQQNCPAIRGAGLPSPEYRLLQLHFHWGSPGHQGSEHSLDEKHGSMEMHMVHMNTKYQSMEDARSQPDGFAILAVLLVEEDRDNTNFSAIVSGLKNLSSPGVAVNLTSTFALASLLPSALRLLRYYRYSGSLTTPGCEPAVLWTVFENTVPIGHAQVVQFQAVLQTGPPGLHPRPLTSNFRPQQPLGGRRISASPEASVRSSVSTLPCLHLALVGLGVGLRLWQGP,brenda,Q99N23,CCOc1ccc2nc(S(N)(=O)=O)sc2c1,5.8e-05,20.0,7.5,4.2.1.1,10090.0,-4.236572006437063,-4.236572006437063,CCOc1ccc2nc(S(N)(=O)=O)sc2c1__MWALDFLLSFLLIQLAAQVDSSGTWCYDSQDPKCGPAHWKELAPACGGPTQSPINIDLRLVQRDYTLKPFIFQGYDSAPQDPWVLENDGHTVLLRVNSCQQNCPAIRGAGLPSPEYRLLQLHFHWGSPGHQGSEHSLDEKHGSMEMHMVHMNTKYQSMEDARSQPDGFAILAVLLVEEDRDNTNFSAIVSGLKNLSSPGVAVNLTSTFALASLLPSALRLLRYYRYSGSLTTPGCEPAVLWTVFENTVPIGHAQVVQFQAVLQTGPPGLHPRPLTSNFRPQQPLGGRRISASPEASVRSSVSTLPCLHLALVGLGVGLRLWQGP,./data/raw/alphafold//AF-Q99N23-F1-model_v4.pdb,214,1569,901,2286 +1025,8251,8383,MALWRGSAYAGFLALAVGCVFLLEPELPGSALRSLWSSLCLGPAPAPPGPVSPEGRLAAAWDALIVRPVRRWRRVAVGVNACVDVVLSGVKLLQALGLSPGNGKDHSILHSRNDLEEAFIHFMGKGAAAERFFSDKETFHDIAQVASEFPGAQHYVGGNAALIGQKFAANSDLKVLLCGPVGPKLHELLDDNVFVPPESLQEVDEFHLILEYQAGEEWGQLKAPHANRFIFSHDLSNGAMNMLEVFVSSLEEFQPDLVVLSGLHMMEGQSKELQRKRLLEVVTSISDIPTGIPVHLELASMTNRELMSSIVHQQVFPAVTSLGLNEQELLFLTQSASGPHSSLSSWNGVPDVGMVSDILFWILKEHGRSKSRASDLTRIHFHTLVYHILATVDGHWANQLAAVAAGARVAGTQACATETIDTSRVSLRAPQEFMTSHSEAGSRIVLNPNKPVVEWHREGISFHFTPVLVCKDPIRTVGLGDAISAEGLFYSEVHPHY,brenda,Q9BRR6,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,9.1,37.0,7.0,2.7.1.147,9606.0,0.9590413923210936,0.9590413923210936,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MALWRGSAYAGFLALAVGCVFLLEPELPGSALRSLWSSLCLGPAPAPPGPVSPEGRLAAAWDALIVRPVRRWRRVAVGVNACVDVVLSGVKLLQALGLSPGNGKDHSILHSRNDLEEAFIHFMGKGAAAERFFSDKETFHDIAQVASEFPGAQHYVGGNAALIGQKFAANSDLKVLLCGPVGPKLHELLDDNVFVPPESLQEVDEFHLILEYQAGEEWGQLKAPHANRFIFSHDLSNGAMNMLEVFVSSLEEFQPDLVVLSGLHMMEGQSKELQRKRLLEVVTSISDIPTGIPVHLELASMTNRELMSSIVHQQVFPAVTSLGLNEQELLFLTQSASGPHSSLSSWNGVPDVGMVSDILFWILKEHGRSKSRASDLTRIHFHTLVYHILATVDGHWANQLAAVAAGARVAGTQACATETIDTSRVSLRAPQEFMTSHSEAGSRIVLNPNKPVVEWHREGISFHFTPVLVCKDPIRTVGLGDAISAEGLFYSEVHPHY,./data/raw/alphafold//AF-Q9BRR6-F1-model_v4.pdb,1167,758,2056,886 +1026,1043,1063,MSIKEQTLMTPYLQFDRNQWAALRDSVPMTLSEDEIARLKGINEDLSLEEVAEIYLPLSRLLNFYISSNLRRQAVLEQFLGTNGQRIPYIISIAGSVAVGKSTTARVLQALLSRWPEHRRVELITTDGFLHPNQVLKERGLMKKKGFPESYDMHRLVKFVSDLKSGVPNVTAPVYSHLIYDVIPDGDKTVVQPDILILEGLNVLQSGMDYPHDPHHVFVSDFVDFSIYVDAPEDLLQTWYINRFLKFREGAFTDPDSYFHNYAKLTKEEAIKTAMTLWKEINWLNLKQNILPTRERASLILTKSANHAVEEVRLRK,sabio,P0A6I3,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS,0.0043,25.0,7.4,2.7.1.33,562.0,-2.3665315444204134,-2.3665315444204134,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS__MSIKEQTLMTPYLQFDRNQWAALRDSVPMTLSEDEIARLKGINEDLSLEEVAEIYLPLSRLLNFYISSNLRRQAVLEQFLGTNGQRIPYIISIAGSVAVGKSTTARVLQALLSRWPEHRRVELITTDGFLHPNQVLKERGLMKKKGFPESYDMHRLVKFVSDLKSGVPNVTAPVYSHLIYDVIPDGDKTVVQPDILILEGLNVLQSGMDYPHDPHHVFVSDFVDFSIYVDAPEDLLQTWYINRFLKFREGAFTDPDSYFHNYAKLTKEEAIKTAMTLWKEINWLNLKQNILPTRERASLILTKSANHAVEEVRLRK,./data/raw/alphafold//AF-P0A6I3-F1-model_v4.pdb,275,1656,1001,2397 +1027,1854,1899,MADKVLKEKRKLFIRSMGEGTINGLLDELLQTRVLNKEEMEKVKRENATVMDKTRALIDSVIPKGAQACQICITYICEEDSYLAGTLGLSADQTSGNYLNMQDSQGVLSSFPAPQAVQDNPAMPTSSGSEGNVKLCSLEEAQRIWKQKSAEIYPIMDKSSRTRLALIICNEEFDSIPRRTGAEVDITGMTMLLQNLGYSVDVKKNLTASDMTTELEAFAHRPEHKTSDSTFLVFMSHGIREGICGKKHSEQVPDILQLNAIFNMLNTKNCPSLKDKPKVIIIQACRGDSPGVVWFKDSVGVSGNLSLPTTEEFEDDAIKKAHIEKDFIAFCSSTPDNVSWRHPTMGSVFIGRLIEHMQEYACSCDVEEIFRKVRFSFEQPDGRAQMPTTERVTLTRCFYLFPGH,uniprot_search,P29466,CC(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@H](C(O)=N[C@@H](C)C(O)=N[C@@H](CC(=O)O)C(=O)CCCCCc1ccccc1)C(C)C,1.1e-05,33.5,7.633333333333333,3.4.22.36,9606.0,-4.958607314841775,-4.958607314841775,CC(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@H](C(O)=N[C@@H](C)C(O)=N[C@@H](CC(=O)O)C(=O)CCCCCc1ccccc1)C(C)C__MADKVLKEKRKLFIRSMGEGTINGLLDELLQTRVLNKEEMEKVKRENATVMDKTRALIDSVIPKGAQACQICITYICEEDSYLAGTLGLSADQTSGNYLNMQDSQGVLSSFPAPQAVQDNPAMPTSSGSEGNVKLCSLEEAQRIWKQKSAEIYPIMDKSSRTRLALIICNEEFDSIPRRTGAEVDITGMTMLLQNLGYSVDVKKNLTASDMTTELEAFAHRPEHKTSDSTFLVFMSHGIREGICGKKHSEQVPDILQLNAIFNMLNTKNCPSLKDKPKVIIIQACRGDSPGVVWFKDSVGVSGNLSLPTTEEFEDDAIKKAHIEKDFIAFCSSTPDNVSWRHPTMGSVFIGRLIEHMQEYACSCDVEEIFRKVRFSFEQPDGRAQMPTTERVTLTRCFYLFPGH,./data/raw/alphafold//AF-P29466-F1-model_v4.pdb,420,1638,983,2379 +1028,6967,7085,MPMKNDHSPDQRTLSELFEHNRQWAAEKQEKDPEYFSRLLSSQRPEFLWIGCSDSRVPANVVTGLQPGEVFVHRNVANLVHRADLNLLSVLEFAVGVLEIKHIIVCGHYGCGGVRAAMDGYGHGIIDNWLQPIRDIAQANQAELDTIENTQDRLDRLCELSVSSQVESLSRTPVLQSAWKDGKDIIVHGWMYNLKDGLLRDIGCDCTRNALQFACQPAE,brenda,A0A0H3GB68,NCCc1ccc(S(N)(=O)=O)cc1,0.00088,20.0,8.3,4.2.1.1,29461.0,-3.055517327849832,-2.561521781586339,NCCc1ccc(S(N)(=O)=O)cc1__MPMKNDHSPDQRTLSELFEHNRQWAAEKQEKDPEYFSRLLSSQRPEFLWIGCSDSRVPANVVTGLQPGEVFVHRNVANLVHRADLNLLSVLEFAVGVLEIKHIIVCGHYGCGGVRAAMDGYGHGIIDNWLQPIRDIAQANQAELDTIENTQDRLDRLCELSVSSQVESLSRTPVLQSAWKDGKDIIVHGWMYNLKDGLLRDIGCDCTRNALQFACQPAE,./data/raw/alphafold//AF-A0A0H3GB68-F1-model_v4.pdb,31,1860,1230,2659 +1029,11015,11180,MLDDRARMEATKKEKVEQILAEFQLQEEDLKKVMSRMQKEMDRGLRLETHEEASVKMLPTYVRSTPEGSEVGDFLSLDLGGTNFRVMLVKVGEGEAGQWSVKTKHQMYSIPEDAMTGTAEMLFDYISECISDFLDKHQMKHKKLPLGFTFSFPVRHEDLDKGILLNWTKGFKASGAEGNNIVGLLRDAIKRRGDFEMDVVAMVNDTVATMISCYYEDRQCEVGMIVGTGCNACYMEEMQNVELVEGDEGRMCVNTEWGAFGDSGELDEFLLEYDRMVDESSANPGQQLYEKIIGGKYMGELVRLVLLKLVDENLLFHGEASEQLRTRGAFETRFVSQVESDSGDRKQIHNILSTLGLRPSVTDCDIVRRACESVSTRAAHMCSAGLAGVINRMRESRSEDVMRITVGVDGSVYKLHPSFKERFHASVRRLTPNCEITFIESEEGSGRGAALVSAVACKKACMLAQ,sabio,P17712,OCC1OC(O)(CO)C(O)C1O,350.0,28.0,7.5,2.7.1.2,10116.0,2.544068044350276,2.544068044350276,OCC1OC(O)(CO)C(O)C1O__MLDDRARMEATKKEKVEQILAEFQLQEEDLKKVMSRMQKEMDRGLRLETHEEASVKMLPTYVRSTPEGSEVGDFLSLDLGGTNFRVMLVKVGEGEAGQWSVKTKHQMYSIPEDAMTGTAEMLFDYISECISDFLDKHQMKHKKLPLGFTFSFPVRHEDLDKGILLNWTKGFKASGAEGNNIVGLLRDAIKRRGDFEMDVVAMVNDTVATMISCYYEDRQCEVGMIVGTGCNACYMEEMQNVELVEGDEGRMCVNTEWGAFGDSGELDEFLLEYDRMVDESSANPGQQLYEKIIGGKYMGELVRLVLLKLVDENLLFHGEASEQLRTRGAFETRFVSQVESDSGDRKQIHNILSTLGLRPSVTDCDIVRRACESVSTRAAHMCSAGLAGVINRMRESRSEDVMRITVGVDGSVYKLHPSFKERFHASVRRLTPNCEITFIESEEGSGRGAALVSAVACKKACMLAQ,./data/raw/alphafold//AF-P17712-F1-model_v4.pdb,1704,1576,908,2294 +1030,9985,10137,MRSAAKWWGPAATWTLAALLVLLVGHGVVPEAARVSDAPLLHAMAGHAYLLNWAAGLMALIGWGDSLVLYRRTRRRAV,brenda,A0A0H3LLR0,O=Cc1ccc(O)nc1,2.98,25.0,7.5,1.14.13.114,518.0,0.4742162640762553,0.4742162640762553,O=Cc1ccc(O)nc1__MRSAAKWWGPAATWTLAALLVLLVGHGVVPEAARVSDAPLLHAMAGHAYLLNWAAGLMALIGWGDSLVLYRRTRRRAV,./data/raw/alphafold//AF-A0A0H3LLR0-F1-model_v4.pdb,1437,1111,2443,1307 +1031,4554,4640,MSVYAIIGGTGLTQLEGLTLSESLPIETPYGAPSAPLQRGRYAGREVLFLARHGHPHRFPPHQVNYRANLWALKQAGAEAVIAVNAVGGIHAAMGTGHLCVPHQLIDYTSGREHTYFAGDIEHVTHIDFSHPYDEPLRQRLIEALRALGLAHSSHGVYACTQGPRLETVAEIARLERDGNDIVGMTGMPEAALARELDLPYACLALVVNPAAGKSAGIITMAEIEQALHDGIGKVREVLARVLAG,brenda,Q9HZK1,CSC[C@H]1CN(Cc2c[nH]c3c(O)ncnc23)C[C@@H]1O,8e-07,25.0,7.4,2.4.2.44,287.0,-6.096910013008056,-6.2827155479829,CSC[C@H]1CN(Cc2c[nH]c3c(O)ncnc23)C[C@@H]1O__MSVYAIIGGTGLTQLEGLTLSESLPIETPYGAPSAPLQRGRYAGREVLFLARHGHPHRFPPHQVNYRANLWALKQAGAEAVIAVNAVGGIHAAMGTGHLCVPHQLIDYTSGREHTYFAGDIEHVTHIDFSHPYDEPLRQRLIEALRALGLAHSSHGVYACTQGPRLETVAEIARLERDGNDIVGMTGMPEAALARELDLPYACLALVVNPAAGKSAGIITMAEIEQALHDGIGKVREVLARVLAG,./data/raw/alphafold//AF-Q9HZK1-F1-model_v4.pdb,746,234,1664,264 +1032,6775,6890,MAKMRISPELKKLIEKYRCVKDTEGMSPAKVYKLVGENENLYLKMTDSRYKGTTYDVEREKDMMLWLEGKLPVPKVLHFERHDGWSNLLMSEADGVLCSEEYEDEQSPEKIIELYAECIRLFHSIDISDCPYTNSLDSRLAELDYLLNNDLADVDCENWEEDTPFKDPRELYDFLKTEKPEEELVFSHGDLGDSNIFVKDGKVSGFIDLGRSGRADKWYDIAFCVRSIREDIGEEQYVELFFDLLGIKPDWEKIKYYILLDELF,sabio,P0A3Y5,NCC1OC(OC2C(N)CC(N)C(OC3OC(CO)C(O)C(N)C3O)C2O)C(N)CC1O,0.002,37.0,7.5,2.7.1.95,1351.0,-2.6989700043360187,-2.6989700043360187,NCC1OC(OC2C(N)CC(N)C(OC3OC(CO)C(O)C(N)C3O)C2O)C(N)CC1O__MAKMRISPELKKLIEKYRCVKDTEGMSPAKVYKLVGENENLYLKMTDSRYKGTTYDVEREKDMMLWLEGKLPVPKVLHFERHDGWSNLLMSEADGVLCSEEYEDEQSPEKIIELYAECIRLFHSIDISDCPYTNSLDSRLAELDYLLNNDLADVDCENWEEDTPFKDPRELYDFLKTEKPEEELVFSHGDLGDSNIFVKDGKVSGFIDLGRSGRADKWYDIAFCVRSIREDIGEEQYVELFFDLLGIKPDWEKIKYYILLDELF,./data/raw/alphafold//AF-P0A3Y5-F1-model_v4.pdb,1054,611,1986,712 +1033,9536,9686,MPPRRYNPDTRRDELLERINLDIPGAVAQALREDLGGTVDANNDITAKLLPENSRSHATVITRENGVFCGKRWVEEVFIQLAGDDVTIIWHVDDGDVINANQSLFELEGPSRVLLTGERTALNFVQTLSGVASKVRHYVELLEGTNTQLLDTRKTLPGLRSALKYAVLCGGGANHRLGLSDAFLIKENHIIASGSVRQAVEKASWLHPDAPVEVEVENLEELDEALKAGADIIMLDNFETEQMREAVKRTNGKALLEVSGNVTDKTLREFAETGVDFISVGALTKHVQALDLSMRFR,sabio,P30011,O=C(O)c1ccccc1C(=O)O,0.0062,25.0,,2.4.2.19,562.0,-2.207608310501746,-1.9375849252930704,O=C(O)c1ccccc1C(=O)O__MPPRRYNPDTRRDELLERINLDIPGAVAQALREDLGGTVDANNDITAKLLPENSRSHATVITRENGVFCGKRWVEEVFIQLAGDDVTIIWHVDDGDVINANQSLFELEGPSRVLLTGERTALNFVQTLSGVASKVRHYVELLEGTNTQLLDTRKTLPGLRSALKYAVLCGGGANHRLGLSDAFLIKENHIIASGSVRQAVEKASWLHPDAPVEVEVENLEELDEALKAGADIIMLDNFETEQMREAVKRTNGKALLEVSGNVTDKTLREFAETGVDFISVGALTKHVQALDLSMRFR,./data/raw/alphafold//AF-P30011-F1-model_v4.pdb,1401,1057,2382,1245 +1034,2923,2987,MARKLSVLEVLLIIFCLIVVTIDILLLLLVLEETSDTSFTPECPEIPQSERIDCTPDQEVTEDICRWQYKCCWSPVADANVPRCFFPWNWGYEASNGHTNTSTGFTAQLKRLPSPSLFGNDVATTLFTAEYQTSNRFHFKITDFNNIRYEVSHENINLVDGIADASNLSYYVEVTDKPFSIKIMRTSNRRVLLDTSIGPLQFAQQYLQLSFRLPSANVYGLGEHVHQQYRHNMTWKTWPIFTRDATPTEGMINLYGAHTFFLCLEDARGSSFGVFLMNSNAMEVTLQPAPAITYRTIGGILDFYVFLGNTPEQVVQEYLELVGRPFFPPYWSLGFQLSRRDYGGINKLKEVVSRNRLAEIPYDVQYSDIDYMDGKKDFTVDEVAYSGLPDFVKELHDNGQKYLIIMNPGISKNSNYEPYNNGSLKRVWILGSNGFAVGEGYPGPTVFPDYTNPVCTEWWTDQVAKFHDHLEFDGVWIEMNEVSSLLQASNNQCESNNLNFPPFLPRVLDHLLFARTLCMDTEFHGGLHYDIHSLYGHSMARTTNLALETIFMNNRSFILSRSTFAGSGKFAAHWLGDNAATWDDLRWSIPTILEFNLFGIPMVGANICGYNNNVTEELCRRWMQLGAFYPLPRNHNGPGFRDQDPAAFGVDSLLLKSSRHYLNIRYTLLPYLYTLFYHAHTRGETVARPLVHEFYQDSATWDVHEQFLWGPGLLITPVLYEGVDEVKAYIPDATWYDYETGVAISWRKQLVNMLLPGDKIGLHLRGGYIFPTQKPNTTTEASRRNSLGLIIALDYKREAKGELYWDDGVSKDAVTEKKYILYDFSVTSNHLQAKIINNNYMDTDNLMFTDITILGMDKQPANFIVLLNNVATSSPSVVYNASTKVVTITDLQGLVLGQEFSIRWNLPVSDLEKFNCYPDDPTASEESCRQRGCLWEDTSTPGVPTCYYDTIPNYVASDIQYLNTSITADLSLPMAPESAAAAASDSLSAKISFLHLKVIYHTATMLQVKIYDPTNKRYEVPVPLNTPPQPVGDPENRLYDVRIQNNPFGIQIQRKNSSTVIWDSQLPGFIFNDMFLSISTRLPSQYIYGFGETEHTTFRRNMNWNTWGMFAHDEPPAYKKNSYGVHPYYMALEEDGSAHGVLLLNSNAMDVTLQPTPALTYRTTGGILDFYIVLGPTPELVTQQYTELIGRPAMIPYWALGFHLSRYGYQNDAEISSLYDAMVAAQIPYDVQHVDIDYMNRKLDFTLSANFQNLSLLIEQMKKNGMRFILILDPAISGNETQYLPFIRGQENNVFIKWPDTNDIVWGKVWPDLPNVIVDGSLDHETQVKLYRAYVAFPDFFRNSTAAWWKKEIEELYANPREPEKSLKFDGLWIDMNEPSNFVDGSVRGCSNEMLNNPPYMPYLESRDKGLSSKTLCMESQQILPDSSPVEHYNVHNLYGWSQTRPTYEAVQEVTGQRGVIITRSTFPSSGRWGGHRLGNNTAAWDQLGKSIIGMMEFSLFGIPYTGADICGFFGDAEYEMCVRWMQLGAFYPFSRNHNNIGTRRQDPVAWNSTFEMLSRKVLETRYTLLPYLYTLMHKAHVEGSTVVRPLLHEFTDDRTTWDIDRQFMLGPAILISPVLETSTFEISAYFPRARWYDYSTGTSSTSTGQRKILKAPLDHINLHVRGGYILPWQEPAMNTHSSRQNFMGLIVALDDNGTAEGQVFWDDGQSIDTYENGNYFLANFIAAQNILQIQTIHNKYLSDSNPLKVGYIRIWGVNTYVTQVSFTYDNRQFMETNFKSEPYNQILTIQLTDKTINLEKLTEVTWIDGGPVLPTPTKTSTIPMSSHPSPSTTNATSSETITSSASANTTTGTTDTVPITTTSFPSTTSVTTNTTVPDTTSPFPTSTTNASTNATVPITTTPFPTSTIGVTTNATVPNTTAPFPTNASTASTNATVPITTTCFATSTIGVTTNATVPDTTAPFPTNTTTASTNATIPITTTPFATSTISVTTSTTVPDTTAPFPTSTTSASTNATPVPITTTLFATSTIGVTTGTTVPDTTAPFPTSTTSTSTSATVPITTTPSPTNTADANTSNTVPNTTMPSPTSSTTVSTIATVPISVTPSLTSTADATISTTVLIATTSSLTGTTDVSTSTTINNISTPVQTNTTNASTSTNVANITATSHTSTDDTVPNNTVPVTAIPSLANTGVDTTSNSFSIMTTSFSESTNAMNTTVIMATTSPTSTDVASTNNDASMTNFLLATMSAGNITSNSISITTTSFGNSVPFVTTPSPSTDATTTSNNTNPGMTTYYQTSPTIPTHTLTSIPSSITSILSMFPTSNTFTTDKITNFTTPTNANTIIFNTLDTKSTMVIDATVTTTSTKDNTMSPDTTVTSIDKFTTHITQFATPHSATTTTLALSHTSLAPTNLSNLGTMDITDADNSSSVTGNTTHISVSNLTTASVTITATGLDSQTPHMVINSVATYLPITATSATTDTTNITKYALNTTTPDSTVHTSATAPTYIANAINATQVP,uniprot_search,Q2M2H8,CCCC[S@+]1C[C@@H](O)[C@H](O)[C@H]1CO.[Cl-],0.032,37.0,6.5,3.2.1.3,9606.0,-1.494850021680094,-1.494850021680094,CCCC[S@+]1C[C@@H](O)[C@H](O)[C@H]1CO.[Cl-]__MARKLSVLEVLLIIFCLIVVTIDILLLLLVLEETSDTSFTPECPEIPQSERIDCTPDQEVTEDICRWQYKCCWSPVADANVPRCFFPWNWGYEASNGHTNTSTGFTAQLKRLPSPSLFGNDVATTLFTAEYQTSNRFHFKITDFNNIRYEVSHENINLVDGIADASNLSYYVEVTDKPFSIKIMRTSNRRVLLDTSIGPLQFAQQYLQLSFRLPSANVYGLGEHVHQQYRHNMTWKTWPIFTRDATPTEGMINLYGAHTFFLCLEDARGSSFGVFLMNSNAMEVTLQPAPAITYRTIGGILDFYVFLGNTPEQVVQEYLELVGRPFFPPYWSLGFQLSRRDYGGINKLKEVVSRNRLAEIPYDVQYSDIDYMDGKKDFTVDEVAYSGLPDFVKELHDNGQKYLIIMNPGISKNSNYEPYNNGSLKRVWILGSNGFAVGEGYPGPTVFPDYTNPVCTEWWTDQVAKFHDHLEFDGVWIEMNEVSSLLQASNNQCESNNLNFPPFLPRVLDHLLFARTLCMDTEFHGGLHYDIHSLYGHSMARTTNLALETIFMNNRSFILSRSTFAGSGKFAAHWLGDNAATWDDLRWSIPTILEFNLFGIPMVGANICGYNNNVTEELCRRWMQLGAFYPLPRNHNGPGFRDQDPAAFGVDSLLLKSSRHYLNIRYTLLPYLYTLFYHAHTRGETVARPLVHEFYQDSATWDVHEQFLWGPGLLITPVLYEGVDEVKAYIPDATWYDYETGVAISWRKQLVNMLLPGDKIGLHLRGGYIFPTQKPNTTTEASRRNSLGLIIALDYKREAKGELYWDDGVSKDAVTEKKYILYDFSVTSNHLQAKIINNNYMDTDNLMFTDITILGMDKQPANFIVLLNNVATSSPSVVYNASTKVVTITDLQGLVLGQEFSIRWNLPVSDLEKFNCYPDDPTASEESCRQRGCLWEDTSTPGVPTCYYDTIPNYVASDIQYLNTSITADLSLPMAPESAAAAASDSLSAKISFLHLKVIYHTATMLQVKIYDPTNKRYEVPVPLNTPPQPVGDPENRLYDVRIQNNPFGIQIQRKNSSTVIWDSQLPGFIFNDMFLSISTRLPSQYIYGFGETEHTTFRRNMNWNTWGMFAHDEPPAYKKNSYGVHPYYMALEEDGSAHGVLLLNSNAMDVTLQPTPALTYRTTGGILDFYIVLGPTPELVTQQYTELIGRPAMIPYWALGFHLSRYGYQNDAEISSLYDAMVAAQIPYDVQHVDIDYMNRKLDFTLSANFQNLSLLIEQMKKNGMRFILILDPAISGNETQYLPFIRGQENNVFIKWPDTNDIVWGKVWPDLPNVIVDGSLDHETQVKLYRAYVAFPDFFRNSTAAWWKKEIEELYANPREPEKSLKFDGLWIDMNEPSNFVDGSVRGCSNEMLNNPPYMPYLESRDKGLSSKTLCMESQQILPDSSPVEHYNVHNLYGWSQTRPTYEAVQEVTGQRGVIITRSTFPSSGRWGGHRLGNNTAAWDQLGKSIIGMMEFSLFGIPYTGADICGFFGDAEYEMCVRWMQLGAFYPFSRNHNNIGTRRQDPVAWNSTFEMLSRKVLETRYTLLPYLYTLMHKAHVEGSTVVRPLLHEFTDDRTTWDIDRQFMLGPAILISPVLETSTFEISAYFPRARWYDYSTGTSSTSTGQRKILKAPLDHINLHVRGGYILPWQEPAMNTHSSRQNFMGLIVALDDNGTAEGQVFWDDGQSIDTYENGNYFLANFIAAQNILQIQTIHNKYLSDSNPLKVGYIRIWGVNTYVTQVSFTYDNRQFMETNFKSEPYNQILTIQLTDKTINLEKLTEVTWIDGGPVLPTPTKTSTIPMSSHPSPSTTNATSSETITSSASANTTTGTTDTVPITTTSFPSTTSVTTNTTVPDTTSPFPTSTTNASTNATVPITTTPFPTSTIGVTTNATVPNTTAPFPTNASTASTNATVPITTTCFATSTIGVTTNATVPDTTAPFPTNTTTASTNATIPITTTPFATSTISVTTSTTVPDTTAPFPTSTTSASTNATPVPITTTLFATSTIGVTTGTTVPDTTAPFPTSTTSTSTSATVPITTTPSPTNTADANTSNTVPNTTMPSPTSSTTVSTIATVPISVTPSLTSTADATISTTVLIATTSSLTGTTDVSTSTTINNISTPVQTNTTNASTSTNVANITATSHTSTDDTVPNNTVPVTAIPSLANTGVDTTSNSFSIMTTSFSESTNAMNTTVIMATTSPTSTDVASTNNDASMTNFLLATMSAGNITSNSISITTTSFGNSVPFVTTPSPSTDATTTSNNTNPGMTTYYQTSPTIPTHTLTSIPSSITSILSMFPTSNTFTTDKITNFTTPTNANTIIFNTLDTKSTMVIDATVTTTSTKDNTMSPDTTVTSIDKFTTHITQFATPHSATTTTLALSHTSLAPTNLSNLGTMDITDADNSSSVTGNTTHISVSNLTTASVTITATGLDSQTPHMVINSVATYLPITATSATTDTTNITKYALNTTTPDSTVHTSATAPTYIANAINATQVP,./data/raw/alphafold//AF-Q2M2H8-F1-model_v4.pdb,541,1980,1378,30 +1035,4948,5042,MKEVIAVKEITRFKTRTEEFSPYAWCKRMLENDPVSYHEGTDTWNVFKYEDVKRVLSDYKHFSSVRKRTTISVGTDSEEGSVPEKIQITESDPPDHRKRRSLLAAAFTPRSLQNWEPRIQEIADELIGQMDGGTEIDIVASLASPLPIIVMADLMGVPSKDRLLFKKWVDTLFLPFDREKQEEVDKLKQVAAKEYYQYLYPIVVQKRLNPADDIISDLLKSEVDGEMFTDDEVVRTTMLILGAGVETTSHLLANSFYSLLYDDKEVYQELHENLDLVPQAVEEMLRFRFNLIKLDRTVKEDNDLLGVELKEGDSVVVWMSAANMDEEMFEDPFTLNIHRPNNKKHLTFGNGPHFCLGAPLARLEAKIALTAFLKKFKHIEAVPSFQLEENLTDSATGQTLTSLPLKASRM,uniprot_search,Q06069,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CCC2=O,0.07,29.666666666666668,7.4,1.14.15.8,1404.0,-1.154901959985743,-1.154901959985743,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CCC2=O__MKEVIAVKEITRFKTRTEEFSPYAWCKRMLENDPVSYHEGTDTWNVFKYEDVKRVLSDYKHFSSVRKRTTISVGTDSEEGSVPEKIQITESDPPDHRKRRSLLAAAFTPRSLQNWEPRIQEIADELIGQMDGGTEIDIVASLASPLPIIVMADLMGVPSKDRLLFKKWVDTLFLPFDREKQEEVDKLKQVAAKEYYQYLYPIVVQKRLNPADDIISDLLKSEVDGEMFTDDEVVRTTMLILGAGVETTSHLLANSFYSLLYDDKEVYQELHENLDLVPQAVEEMLRFRFNLIKLDRTVKEDNDLLGVELKEGDSVVVWMSAANMDEEMFEDPFTLNIHRPNNKKHLTFGNGPHFCLGAPLARLEAKIALTAFLKKFKHIEAVPSFQLEENLTDSATGQTLTSLPLKASRM,./data/raw/alphafold//AF-Q06069-F1-model_v4.pdb,246,1610,952,2344 +1036,7074,7194,MDTARIAVVGAGVVGLSTAVCISKLVPRCSVTIISDKFTPDTTSDVAAGMLIPHTYPDTPIHTQKQWFRETFNHLFAIANSAEAGDAGVHLVSGWQIFQSTPTEEVPFWADVVLGFRKMTEAELKKFPQYVFGQAFTTLKCECPAYLPWLEKRIKGSGGWTLTRRIEDLWELHPSFDIVVNCSGLGSRQLAGDSKIFPVRGQVLQVQAPWVEHFIRDGSGLTYIYPGTSHVTLGGTRQKGDWNLSPDAENSREILSRCCALEPSLHGACNIREKVGLRPYRPGVRLQTELLARDGQRLPVVHHYGHGSGGISVHWGTALEAARLVSECVHALRTPIPKSNL,brenda,Q99489,NOCC(=O)[O-],1.492,37.0,8.3,1.4.3.1,9606.0,0.17376882313665,0.17376882313665,NOCC(=O)[O-]__MDTARIAVVGAGVVGLSTAVCISKLVPRCSVTIISDKFTPDTTSDVAAGMLIPHTYPDTPIHTQKQWFRETFNHLFAIANSAEAGDAGVHLVSGWQIFQSTPTEEVPFWADVVLGFRKMTEAELKKFPQYVFGQAFTTLKCECPAYLPWLEKRIKGSGGWTLTRRIEDLWELHPSFDIVVNCSGLGSRQLAGDSKIFPVRGQVLQVQAPWVEHFIRDGSGLTYIYPGTSHVTLGGTRQKGDWNLSPDAENSREILSRCCALEPSLHGACNIREKVGLRPYRPGVRLQTELLARDGQRLPVVHHYGHGSGGISVHWGTALEAARLVSECVHALRTPIPKSNL,./data/raw/alphafold//AF-Q99489-F1-model_v4.pdb,1084,655,2037,766 +1037,1597,1633,MRNGLVWLLHPALPGTLRSILGARPPPAKRLCGFPKQTYSTMSNPAIQRIEDQIVKSPEDKREYRGLELANGIKVLLISDPTTDKSSAALDVHIGSLSDPPNIPGLSHFCEHMLFLGTKKYPKENEYSQFLSEHAGSSNAFTSGEHTNYYFDVSHEHLEGALDRFAQFFLCPLLDASCKDREVNAVDSEHEKNVMNDAWRLFQLEKATGNPKHPFSKFGTGNKYTLETRPNQEGIDVREELLKFHSTYYSSNLMAICVLGRESLDDLTNLVVKLFSEVENKNVPLPEFPEHPFQEEHLRQLYKIVPIKDIRNLYVTFPIPDLQQYYKSNPGYYLGHLIGHEGPGSLLSELKSKGWVNTLVGGQKEGARGFMFFIINVDLTEEGLLHVEDIILHMFQYIQKLRAEGPQEWVFQECKDLNAVAFRFKDKERPRGYTSKIAGKLHYYPLNGVLTAEYLLEEFRPDLIDMVLDKLRPENVRVAIVSKSFEGKTDRTEQWYGTQYKQEAIPEDVIQKWQNADLNGKFKLPTKNEFIPTNFEILSLEKDATPYPALIKDTAMSKLWFKQDDKFFLPKACLNFEFFSPFAYVDPLHCNMAYLYLELLKDSLNEYAYAAELAGLSYDLQNTIYGMYLSVKRYNDKQPILLKKITEKMATFEIDKKRFEIIKEAYMRSLNNFRAEQPHQHAMYYLRLLMTEVAWTKDELKEALDDVTLPRLKAFIPQLLSRLHIEALLHGNITKQAALGVMQMVEDTLIEHAHTKPLLPSQLVRYREVQLPDRGWFVYQQRNEVHNNCGIEIYYQTDMQSTSENMFLELFCQIISEPCFNTLRTKEQLGYIVFSGPRRANGIQGLRFIIQSEKPPHYLESRVEAFLITMEKAIEDMTEEAFQKHIQALAIRRLDKPKKLSAECAKYWGEIISQQYNYDRDNIEVAYLKTLTKDDIIRFYQEMLAVDAPRRHKVSVHVLAREMDSCPVVGEFPSQNDINLSEAPPLPQPEVIHNMTEFKRGLPLFPLVKPHINFMAAKL,brenda,Q9JHR7,CC(C)[C@H](N)C(O)=N[C@@H](Cc1cnc[nH]1)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCC(=N)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CO)C(=O)O,0.0008,23.0,7.5,3.4.24.56,10090.0,-3.096910013008056,-3.096910013008056,CC(C)[C@H](N)C(O)=N[C@@H](Cc1cnc[nH]1)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCC(=N)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CO)C(=O)O__MRNGLVWLLHPALPGTLRSILGARPPPAKRLCGFPKQTYSTMSNPAIQRIEDQIVKSPEDKREYRGLELANGIKVLLISDPTTDKSSAALDVHIGSLSDPPNIPGLSHFCEHMLFLGTKKYPKENEYSQFLSEHAGSSNAFTSGEHTNYYFDVSHEHLEGALDRFAQFFLCPLLDASCKDREVNAVDSEHEKNVMNDAWRLFQLEKATGNPKHPFSKFGTGNKYTLETRPNQEGIDVREELLKFHSTYYSSNLMAICVLGRESLDDLTNLVVKLFSEVENKNVPLPEFPEHPFQEEHLRQLYKIVPIKDIRNLYVTFPIPDLQQYYKSNPGYYLGHLIGHEGPGSLLSELKSKGWVNTLVGGQKEGARGFMFFIINVDLTEEGLLHVEDIILHMFQYIQKLRAEGPQEWVFQECKDLNAVAFRFKDKERPRGYTSKIAGKLHYYPLNGVLTAEYLLEEFRPDLIDMVLDKLRPENVRVAIVSKSFEGKTDRTEQWYGTQYKQEAIPEDVIQKWQNADLNGKFKLPTKNEFIPTNFEILSLEKDATPYPALIKDTAMSKLWFKQDDKFFLPKACLNFEFFSPFAYVDPLHCNMAYLYLELLKDSLNEYAYAAELAGLSYDLQNTIYGMYLSVKRYNDKQPILLKKITEKMATFEIDKKRFEIIKEAYMRSLNNFRAEQPHQHAMYYLRLLMTEVAWTKDELKEALDDVTLPRLKAFIPQLLSRLHIEALLHGNITKQAALGVMQMVEDTLIEHAHTKPLLPSQLVRYREVQLPDRGWFVYQQRNEVHNNCGIEIYYQTDMQSTSENMFLELFCQIISEPCFNTLRTKEQLGYIVFSGPRRANGIQGLRFIIQSEKPPHYLESRVEAFLITMEKAIEDMTEEAFQKHIQALAIRRLDKPKKLSAECAKYWGEIISQQYNYDRDNIEVAYLKTLTKDDIIRFYQEMLAVDAPRRHKVSVHVLAREMDSCPVVGEFPSQNDINLSEAPPLPQPEVIHNMTEFKRGLPLFPLVKPHINFMAAKL,./data/raw/alphafold//AF-Q9JHR7-F1-model_v4.pdb,1268,886,2192,2548 +1038,1921,1972,MSGTDRSQAAGAVPDSDPGLAAVSSAYQRFEPRAYLRNNYAPPRGDLSCPDGVGPWKLRCLAQTFATGEVSGRTLIDIGSGPTIYQLLSACAHFEDITMTDFLEVNRQELRLWLREEPGAFDWSVYSQHVCLIEGKGESWQEKECQLRARVKRILPIDVHRPQPLGAGGLAPLPADALVSAFCLEAVSPDLASFQRALDHITTLLRPGGHLLLIGALEESWYLAGEARLAVVPVREEEVREALVRTATRCGICARTPMPAHLQTGVDDVKGIFFTRAQKKVGV,uniprot_search,P10938,CC(O)=Nc1ccc2c(c1)CNCC2,0.19,34.0,7.9,2.1.1.28,9913.0,-0.721246399047171,-0.721246399047171,CC(O)=Nc1ccc2c(c1)CNCC2__MSGTDRSQAAGAVPDSDPGLAAVSSAYQRFEPRAYLRNNYAPPRGDLSCPDGVGPWKLRCLAQTFATGEVSGRTLIDIGSGPTIYQLLSACAHFEDITMTDFLEVNRQELRLWLREEPGAFDWSVYSQHVCLIEGKGESWQEKECQLRARVKRILPIDVHRPQPLGAGGLAPLPADALVSAFCLEAVSPDLASFQRALDHITTLLRPGGHLLLIGALEESWYLAGEARLAVVPVREEEVREALVRTATRCGICARTPMPAHLQTGVDDVKGIFFTRAQKKVGV,./data/raw/alphafold//AF-P10938-F1-model_v4.pdb,17,1241,523,1830 +1039,11421,11595,MNSELDYYEKFEEVHGILMYKDFVKYWDNVEAFQARPDDLVIATYPKSGTTWVSEIVYMIYKEGDVEKCKEDVIFNRIPFLECRKENLMNGVKQLDEMNSPRIVKTHLPPELLPASFWEKDCKIIYLCRNAKDVAVSFYYFFLMVAGHPNPGSFPEFVEKFMQGQVPYGSWYKHVKSWWEKGKSPRVLFLFYEDLKEDIRKEVIKLIHFLERKPSEELVDRIIHHTSFQEMKNNPSTNYTTLPDEIMNQKLSPFMRKGITGDWKNHFTVALNEKFDKHYEQQMKESTLKFRTEI,uniprot_search,P49888,Oc1ccc2c(c1)oc1cc(Cl)c(Cl)cc12,2e-06,37.0,7.2,2.8.2.4,9606.0,-5.698970004336019,-5.698970004336019,Oc1ccc2c(c1)oc1cc(Cl)c(Cl)cc12__MNSELDYYEKFEEVHGILMYKDFVKYWDNVEAFQARPDDLVIATYPKSGTTWVSEIVYMIYKEGDVEKCKEDVIFNRIPFLECRKENLMNGVKQLDEMNSPRIVKTHLPPELLPASFWEKDCKIIYLCRNAKDVAVSFYYFFLMVAGHPNPGSFPEFVEKFMQGQVPYGSWYKHVKSWWEKGKSPRVLFLFYEDLKEDIRKEVIKLIHFLERKPSEELVDRIIHHTSFQEMKNNPSTNYTTLPDEIMNQKLSPFMRKGITGDWKNHFTVALNEKFDKHYEQQMKESTLKFRTEI,./data/raw/alphafold//AF-P49888-F1-model_v4.pdb,310,1690,1037,2440 +1040,5281,5377,MALKSLVLLSLLVLVLLLVRVQPSLGKETAAAKFERQHMDSSTSAASSSNYCNQMMKSRNLTKDRCKPVNTFVHESLADVQAVCSQKNVACKNGQTNCYQSYSTMSITDCRETGSSKYPNCAYKTTQANKHIIVACEGNPYVPVHFDASV,brenda,P61823,Cc1cn([C@H]2C=C[C@@H](CN3CCC(C(=O)O)CC3)O2)c(=O)nc1O,0.25,25.0,7.5,4.6.1.18,9913.0,-0.6020599913279624,-0.6020599913279624,Cc1cn([C@H]2C=C[C@@H](CN3CCC(C(=O)O)CC3)O2)c(=O)nc1O__MALKSLVLLSLLVLVLLLVRVQPSLGKETAAAKFERQHMDSSTSAASSSNYCNQMMKSRNLTKDRCKPVNTFVHESLADVQAVCSQKNVACKNGQTNCYQSYSTMSITDCRETGSSKYPNCAYKTTQANKHIIVACEGNPYVPVHFDASV,./data/raw/alphafold//AF-P61823-F1-model_v4.pdb,601,2053,1459,1738 +1041,9021,9161,MKKGYEVLRDPHLNKGMAFTLEERQQLNIHGLLPPCFLGQDAQVYSILKNFERLTSDLDRYILLMSLQDRNEKLFYKVLTSDIERFMPIVYTPTVGLACQHYGLAFRRPRGLFITIHDRGHIATMLQSWPESVIKAIVVTDGERILGLGDLGCYGMGIPVGKLALYTACGGVKPHQCLPVMLDVGTDNETLLKDPLYIGLRHKRIRGQAYDDLLDEFMEAVTSRYGMNCLIQFEDFANANAFRLLHKYRNKYCTFNDDIQGTASVAVAGLLAALRITKNRLSDHTVLFQGAGEAALGIANLIVMAMQKEGVSKEEAIKRIWMVDSKGLIVKGRASLTPEKEHFAHEHCEMKNLEDIVKDIKPTVLIGVAAIGGAFTQQILQDMAAFNKRPIIFALSNPTSKAECTAEQLYKYTEGRGIFASGSPFDPVTLPSGQTLYPGQGNNSYVFPGVALGVISCGLKHIGDDVFLTTAEVIAQEVSEENLQEGRLYPPLVTIQQVSLKIAVRIAKEAYRNNTASTYPQPEDLEAFIRSQVYSTDYNCFVADSYTWPEEAMKVKL,sabio,P40927,O=C(O)CC(O)C(=O)O,8.0,30.0,7.4,1.1.1.40,8932.0,0.9030899869919436,0.9030899869919436,O=C(O)CC(O)C(=O)O__MKKGYEVLRDPHLNKGMAFTLEERQQLNIHGLLPPCFLGQDAQVYSILKNFERLTSDLDRYILLMSLQDRNEKLFYKVLTSDIERFMPIVYTPTVGLACQHYGLAFRRPRGLFITIHDRGHIATMLQSWPESVIKAIVVTDGERILGLGDLGCYGMGIPVGKLALYTACGGVKPHQCLPVMLDVGTDNETLLKDPLYIGLRHKRIRGQAYDDLLDEFMEAVTSRYGMNCLIQFEDFANANAFRLLHKYRNKYCTFNDDIQGTASVAVAGLLAALRITKNRLSDHTVLFQGAGEAALGIANLIVMAMQKEGVSKEEAIKRIWMVDSKGLIVKGRASLTPEKEHFAHEHCEMKNLEDIVKDIKPTVLIGVAAIGGAFTQQILQDMAAFNKRPIIFALSNPTSKAECTAEQLYKYTEGRGIFASGSPFDPVTLPSGQTLYPGQGNNSYVFPGVALGVISCGLKHIGDDVFLTTAEVIAQEVSEENLQEGRLYPPLVTIQQVSLKIAVRIAKEAYRNNTASTYPQPEDLEAFIRSQVYSTDYNCFVADSYTWPEEAMKVKL,./data/raw/alphafold//AF-P40927-F1-model_v4.pdb,1347,989,2310,1167 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+1082,9272,9420,MRHPVDMPEKVGTDAKRLFAQPEHLWELTLTEASALVRHRRITSRQLVEAWLSRIADFSELNAFISVDAAAALKQADSYDHYLEAGGDPLPLGGVPIAVKDNIQVVGFANTAGTPALSKFFPTCNARVIEPLLKAGAIVVGKTNMHELAFGTSGYNTAYHIPGVIGVRNAFDHSCIAGGSSSGSGTAVGALLIPAALGTDTGGSVRQPGAVNGCVGFRPTVGRYPVDGITPISPTRDTPGPIARSVEDIVLLDSIITGALPAEVPAAESIRLGVVDQLWADLSEPVRKLTEDALRKLEQQGVQIVRVSMSEIFEMSHAVSMPLALHECRSALTEYLSANETGVSFDELVAGISSPDVRTIFEDYILPGRLGELEGQSVDLEQAYATAMKDARPKLIQSFEFLFKEHQLDAIIHPTTPDLAIKSNPAATSFEAFARMIRNADPASNAGMPGISLPAGLSQQEGLPVGIEIEGLPGSDARLLSIANFIESILGRGPTPTRSGVESKISM,brenda,Q84DC4,O=C(O)Nc1ccccc1,2.5e-05,25.0,7.8,3.5.1.86,303.0,-4.6020599913279625,-4.6020599913279625,O=C(O)Nc1ccccc1__MRHPVDMPEKVGTDAKRLFAQPEHLWELTLTEASALVRHRRITSRQLVEAWLSRIADFSELNAFISVDAAAALKQADSYDHYLEAGGDPLPLGGVPIAVKDNIQVVGFANTAGTPALSKFFPTCNARVIEPLLKAGAIVVGKTNMHELAFGTSGYNTAYHIPGVIGVRNAFDHSCIAGGSSSGSGTAVGALLIPAALGTDTGGSVRQPGAVNGCVGFRPTVGRYPVDGITPISPTRDTPGPIARSVEDIVLLDSIITGALPAEVPAAESIRLGVVDQLWADLSEPVRKLTEDALRKLEQQGVQIVRVSMSEIFEMSHAVSMPLALHECRSALTEYLSANETGVSFDELVAGISSPDVRTIFEDYILPGRLGELEGQSVDLEQAYATAMKDARPKLIQSFEFLFKEHQLDAIIHPTTPDLAIKSNPAATSFEAFARMIRNADPASNAGMPGISLPAGLSQQEGLPVGIEIEGLPGSDARLLSIANFIESILGRGPTPTRSGVESKISM,./data/raw/alphafold//AF-Q84DC4-F1-model_v4.pdb,924,456,1816,532 +1083,4281,4363,MAERFVVTGGNRLSGEVAVGGAKNSVLKLMAATLLAEGTSTITNCPDILDVPLMAEVLRGLGATVELDGDVARITAPDEPKYDADFAAVRQFRASVCVLGPLVGRCKRARVALPGGDAIGSRPLDMHQAGLRQLGAHCNIEHGCVVARAETLRGAEIQLEFPSVGATENILMAAVVAEGVTTIHNAAREPDVVDLCTMLNQMGAQVEGAGSPTMTITGVPRLHPTEHRVIGDRIVAATWGIAAAMTRGDISVAGVDPAHLQLVLHKLHDAGATVTQTDASFRVTQYERPKAVNVATLPFPGFPTDLQPMAIALASIADGTSMITENVFEARFRFVEEMIRLGADARTDGHHAVVRGLPQLSSAPVWCSDIRAGAGLVLAGLVADGDTEVHDVFHIDRGYPLFVENLVSLGAEIERVCC,brenda,P9WJM1,COc1ccc(CN2CCOc3ccc(CN4CCN(c5ncccn5)CC4)cc3C2)c2ccccc12,1.366e-05,37.0,8.0,2.5.1.7,1773.0,-4.864549300654486,-4.864549300654486,COc1ccc(CN2CCOc3ccc(CN4CCN(c5ncccn5)CC4)cc3C2)c2ccccc12__MAERFVVTGGNRLSGEVAVGGAKNSVLKLMAATLLAEGTSTITNCPDILDVPLMAEVLRGLGATVELDGDVARITAPDEPKYDADFAAVRQFRASVCVLGPLVGRCKRARVALPGGDAIGSRPLDMHQAGLRQLGAHCNIEHGCVVARAETLRGAEIQLEFPSVGATENILMAAVVAEGVTTIHNAAREPDVVDLCTMLNQMGAQVEGAGSPTMTITGVPRLHPTEHRVIGDRIVAATWGIAAAMTRGDISVAGVDPAHLQLVLHKLHDAGATVTQTDASFRVTQYERPKAVNVATLPFPGFPTDLQPMAIALASIADGTSMITENVFEARFRFVEEMIRLGADARTDGHHAVVRGLPQLSSAPVWCSDIRAGAGLVLAGLVADGDTEVHDVFHIDRGYPLFVENLVSLGAEIERVCC,./data/raw/alphafold//AF-P9WJM1-F1-model_v4.pdb,168,1507,832,2210 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+1085,8606,8743,MMKKSLCCALLLGISCSALATPVSEKQLAEVVANTVTPLMKAQSVPGMAVAVIYQGKPHYYTFGKADIAANKPVTPQTLFELGSISKTFTGVLGGDAIARGEISLDDPVTRYWPQLTGKQWQGIRMLDLATYTAGGLPLQVPDEVTDNASLLRFYQNWQPQWKPGTTRLYANASIGLFGALAVKPSGMPYEQAMTTRVLKPLKLDHTWINVPKAEEAHYAWGYRDGKAVRAVRVSPGMLDAQAYGVKTNVQDMANWVMANMAPENVADASLKQGIALAQSRYWRIGSMYQGLGWEMLNWPVEANTVVEGSDSKVALAPLPVAEVNPPAPPVKASWVHKTGSTGGFGSYVAFIPEKQIGIVMLANTSYPNPARVEAAYHILEALQ,brenda,Q59401,O=C(CP(=O)(O)OCc1ccccc1)c1ccc2nc([O-])oc2c1.[Na+],0.07,25.0,7.5,3.5.2.6,550.0,-1.154901959985743,-1.154901959985743,O=C(CP(=O)(O)OCc1ccccc1)c1ccc2nc([O-])oc2c1.[Na+]__MMKKSLCCALLLGISCSALATPVSEKQLAEVVANTVTPLMKAQSVPGMAVAVIYQGKPHYYTFGKADIAANKPVTPQTLFELGSISKTFTGVLGGDAIARGEISLDDPVTRYWPQLTGKQWQGIRMLDLATYTAGGLPLQVPDEVTDNASLLRFYQNWQPQWKPGTTRLYANASIGLFGALAVKPSGMPYEQAMTTRVLKPLKLDHTWINVPKAEEAHYAWGYRDGKAVRAVRVSPGMLDAQAYGVKTNVQDMANWVMANMAPENVADASLKQGIALAQSRYWRIGSMYQGLGWEMLNWPVEANTVVEGSDSKVALAPLPVAEVNPPAPPVKASWVHKTGSTGGFGSYVAFIPEKQIGIVMLANTSYPNPARVEAAYHILEALQ,./data/raw/alphafold//AF-Q59401-F1-model_v4.pdb,616,2068,514,1088 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+1087,10395,10552,MFHPYRKTLLSGTVALALGLFATGAIAAGFQPAQPAGKLGAIVVDPYGNAPLTALIELDSHTISDVKVTVHGKGEKGVPVSYSVGKQSLATYDGIPVFGLYQKHANKVTVEYTENGKAMKEDYVIQTSAIVNRYMDNRSISDLQKTKVIKVAPGFEDRLYLVNTHTFTPQGAEFHWHGEKDKNAGLLDAGPAAGALPFDIAPFTFVVDTEGEYRWWLDQDTFYDGHDMNINKRGYLMGIRETPRGTFTAVQGQHWYEFDMMGQVLADHKLPRGFLDATHESIETVNGTVLLRVGKRNYRKEDGLHVHTIRDQIIEVDKSGRVIDVWDLTKILDPLRDSLLGALDAGAVCVNVDLEHAGQQAKLEPDTPFGDALGVGAERNWAHVNPIAYDAKDDAIILSSRHQGIVKIGSDKKVKWILAPAKGWNKQLASKLLKPVDSKGNPLTCNENGKCENTDFDFSYTQHTAWLTDKGTLTVFDNGDGRWLEQPALPSMKYSRFVEYKIDEKNGTVQPLWQYGKERGYDFYSPITSVIEYQKDRDTIFGFSGSINLFEVGQPTIGKINEIDYKTKDVKVEIDVLSDKPNQTHYRALLVHPQQMFK,brenda,Q9XDP2,O=S(=O)(O)Oc1cccc2ccccc12,1.63,,,2.8.2.22,61646.0,0.2121876044039577,0.3201611992163733,O=S(=O)(O)Oc1cccc2ccccc12__MFHPYRKTLLSGTVALALGLFATGAIAAGFQPAQPAGKLGAIVVDPYGNAPLTALIELDSHTISDVKVTVHGKGEKGVPVSYSVGKQSLATYDGIPVFGLYQKHANKVTVEYTENGKAMKEDYVIQTSAIVNRYMDNRSISDLQKTKVIKVAPGFEDRLYLVNTHTFTPQGAEFHWHGEKDKNAGLLDAGPAAGALPFDIAPFTFVVDTEGEYRWWLDQDTFYDGHDMNINKRGYLMGIRETPRGTFTAVQGQHWYEFDMMGQVLADHKLPRGFLDATHESIETVNGTVLLRVGKRNYRKEDGLHVHTIRDQIIEVDKSGRVIDVWDLTKILDPLRDSLLGALDAGAVCVNVDLEHAGQQAKLEPDTPFGDALGVGAERNWAHVNPIAYDAKDDAIILSSRHQGIVKIGSDKKVKWILAPAKGWNKQLASKLLKPVDSKGNPLTCNENGKCENTDFDFSYTQHTAWLTDKGTLTVFDNGDGRWLEQPALPSMKYSRFVEYKIDEKNGTVQPLWQYGKERGYDFYSPITSVIEYQKDRDTIFGFSGSINLFEVGQPTIGKINEIDYKTKDVKVEIDVLSDKPNQTHYRALLVHPQQMFK,./data/raw/alphafold//AF-Q9XDP2-F1-model_v4.pdb,1507,1199,37,1408 +1088,5939,6040,MTRVERGRVLARAIERAVAHRASARRWTTTTRTPAWMVTGWMGGRGVDRSTAMTRFERCGSTASSKITAAPMVYVRGEEMTAYVMDLIRSRWIEPRVDVGGWETFDLRAKNRDDTEDRVLRDVIEAGKRIKAIFKEPTVTPTADQVKRLGLRKSWGSPNGAMRRGWNGITISRDTIHIDGVELGYKKPVLFERHAVGGEYSAGYKNVGKGKLTTTFTPSEGPDAGKTVVVDEREIVDEEAAVVTYHNPYDNVHDLARFFFGRCLEAKVTPYVVTKKTVFKWQEPFWQIMRTVFDEEFKAQFVAAGVMKEGEELVHLLSDAATMKLVQWRQGGFGMAAHNYDGDVLTDELAQVHKSPGFITSNLVGVHEDGTLIKEFEASHGTVADMDEARLRGEETSLNPLGMVEGLIGAMNHAADVHNIDRDRTHAFTTKMRTVIHQLFREGKGTRDLCGPSGLTTEQFIDAVAERLDA,uniprot_search,A0A096P8D3,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.14,,7.6,1.1.1.41,70448.0,-0.8538719643217619,-0.8538719643217619,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MTRVERGRVLARAIERAVAHRASARRWTTTTRTPAWMVTGWMGGRGVDRSTAMTRFERCGSTASSKITAAPMVYVRGEEMTAYVMDLIRSRWIEPRVDVGGWETFDLRAKNRDDTEDRVLRDVIEAGKRIKAIFKEPTVTPTADQVKRLGLRKSWGSPNGAMRRGWNGITISRDTIHIDGVELGYKKPVLFERHAVGGEYSAGYKNVGKGKLTTTFTPSEGPDAGKTVVVDEREIVDEEAAVVTYHNPYDNVHDLARFFFGRCLEAKVTPYVVTKKTVFKWQEPFWQIMRTVFDEEFKAQFVAAGVMKEGEELVHLLSDAATMKLVQWRQGGFGMAAHNYDGDVLTDELAQVHKSPGFITSNLVGVHEDGTLIKEFEASHGTVADMDEARLRGEETSLNPLGMVEGLIGAMNHAADVHNIDRDRTHAFTTKMRTVIHQLFREGKGTRDLCGPSGLTTEQFIDAVAERLDA,./data/raw/alphafold//AF-A0A096P8D3-F1-model_v4.pdb,910,439,1799,513 +1089,3844,3922,MENQEKASIAGHMFDVVVIGGGISGLSAAKLLTEYGVSVLVLEARDRVGGRTYTIRNEHVDYVDVGGAYVGPTQNRILRLSKELGIETYKVNVSERLVQYVKGKTYPFRGAFPPVWNPIAYLDYNNLWRTIDNMGKEIPTDAPWEAQHADKWDKMTMKELIDKICWTKTARRFAYLFVNINVTSEPHEVSALWFLWYVKQCGGTTRIFSVTNGGQERKFVGGSGQVSERIMDLLGDQVKLNHPVTHVDQSSDNIIIETLNHEHYECKYVINAIPPTLTAKIHFRPELPAERNQLIQRLPMGAVIKCMMYYKEAFWKKKDYCGCMIIEDEDAPISITLDDTKPDGSLPAIMGFILARKADRLAKLHKEIRKKKICELYAKVLGSQEALHPVHYEEKNWCEEQYSGGCYTAYFPPGIMTQYGRVIRQPVGRIFFAGTETATKWSGYMEGAVEAGERAAREVLNGLGKVTEKDIWVQEPESKDVPAVEITHTFWERNLPSVSGLLKIIGFSTSVTALGFVLYKYKLLPRS,brenda,P21397,CNCc1cc(=O)oc2cc(OCc3cccc(Cl)c3)ccc12,0.0157,25.0,7.5,1.4.3.4,9606.0,-1.8041003475907664,-1.8041003475907664,CNCc1cc(=O)oc2cc(OCc3cccc(Cl)c3)ccc12__MENQEKASIAGHMFDVVVIGGGISGLSAAKLLTEYGVSVLVLEARDRVGGRTYTIRNEHVDYVDVGGAYVGPTQNRILRLSKELGIETYKVNVSERLVQYVKGKTYPFRGAFPPVWNPIAYLDYNNLWRTIDNMGKEIPTDAPWEAQHADKWDKMTMKELIDKICWTKTARRFAYLFVNINVTSEPHEVSALWFLWYVKQCGGTTRIFSVTNGGQERKFVGGSGQVSERIMDLLGDQVKLNHPVTHVDQSSDNIIIETLNHEHYECKYVINAIPPTLTAKIHFRPELPAERNQLIQRLPMGAVIKCMMYYKEAFWKKKDYCGCMIIEDEDAPISITLDDTKPDGSLPAIMGFILARKADRLAKLHKEIRKKKICELYAKVLGSQEALHPVHYEEKNWCEEQYSGGCYTAYFPPGIMTQYGRVIRQPVGRIFFAGTETATKWSGYMEGAVEAGERAAREVLNGLGKVTEKDIWVQEPESKDVPAVEITHTFWERNLPSVSGLLKIIGFSTSVTALGFVLYKYKLLPRS,./data/raw/alphafold//AF-P21397-F1-model_v4.pdb,21,1247,535,1839 +1090,2535,2596,MDSISLRVALNDGNFIPVLGFGTTVPEKVAKDEVIKATKIAIDNGFRHFDSAYLYEVEEEVGQAIRSKIEDGTVKREDIFYTSKLWSTFHRPELVRTCLEKTLKSTQLDYVDLYIIHFPMALQPGDIFFPRDEHGKLLFETVDICDTWEAMEKCKDAGLAKSIGVSNFNCRQLERILNKPGLKYKPVCNQVECHLYLNQSKMLDYCKSKDIILVSYCTLGSSRDKTWVDQKSPVLLDDPVLCAIAKKYKQTPALVALRYQLQRGVVPLIRSFNAKRIKELTQVFEFQLASEDMKALDGLNRNFRYNNAKYFDDHPNHPFTDE,uniprot_search,P23457,CCCCCC=CCC=CCC=CCC=CCCCC(=O)O,0.006,25.0,7.0,1.1.1.50,10116.0,-2.2218487496163566,-2.2218487496163566,CCCCCC=CCC=CCC=CCC=CCCCC(=O)O__MDSISLRVALNDGNFIPVLGFGTTVPEKVAKDEVIKATKIAIDNGFRHFDSAYLYEVEEEVGQAIRSKIEDGTVKREDIFYTSKLWSTFHRPELVRTCLEKTLKSTQLDYVDLYIIHFPMALQPGDIFFPRDEHGKLLFETVDICDTWEAMEKCKDAGLAKSIGVSNFNCRQLERILNKPGLKYKPVCNQVECHLYLNQSKMLDYCKSKDIILVSYCTLGSSRDKTWVDQKSPVLLDDPVLCAIAKKYKQTPALVALRYQLQRGVVPLIRSFNAKRIKELTQVFEFQLASEDMKALDGLNRNFRYNNAKYFDDHPNHPFTDE,./data/raw/alphafold//AF-P23457-F1-model_v4.pdb,138,442,916,2302 +1091,3520,3593,MRVGLVGWRGMVGSVLMQRMVEERDFDLIEPVFFSTSQIGVPAPNFGKDAGMLHDAFDIESLKQLDAVITCQGGSYTEKVYPALRQAGWKGYWIDAASTLRMDKEAIITLDPVNLKQILHGIHHGTKTFVGGNCTVSLMLMALGGLYERGLVEWMSAMTYQAASGAGAQNMRELISQMGVINDAVSSELANPASSILDIDKKVAETMRSGSFPTDNFGVPLAGSLIPWIDVKRDNGQSKEEWKAGVEANKILGLQDSPVPIDGTCVRIGAMRCHSQALTIKLKQNIPLDEIEEMIATHNDWVKVIPNERDITARELTPAKVTGTLSVPVGRLRKMAMGDDFLNAFTVGDQLLWGAAEPLRRTLRIILAEK,brenda,Q9KQG2,CCn1c(=O)n(CC)c2c([N+](=O)[O-])cccc21,4.0,22.0,8.6,1.2.1.11,666.0,0.6020599913279624,0.6020599913279624,CCn1c(=O)n(CC)c2c([N+](=O)[O-])cccc21__MRVGLVGWRGMVGSVLMQRMVEERDFDLIEPVFFSTSQIGVPAPNFGKDAGMLHDAFDIESLKQLDAVITCQGGSYTEKVYPALRQAGWKGYWIDAASTLRMDKEAIITLDPVNLKQILHGIHHGTKTFVGGNCTVSLMLMALGGLYERGLVEWMSAMTYQAASGAGAQNMRELISQMGVINDAVSSELANPASSILDIDKKVAETMRSGSFPTDNFGVPLAGSLIPWIDVKRDNGQSKEEWKAGVEANKILGLQDSPVPIDGTCVRIGAMRCHSQALTIKLKQNIPLDEIEEMIATHNDWVKVIPNERDITARELTPAKVTGTLSVPVGRLRKMAMGDDFLNAFTVGDQLLWGAAEPLRRTLRIILAEK,./data/raw/alphafold//AF-Q9KQG2-F1-model_v4.pdb,1019,571,1447,1724 +1092,11115,11281,MATQSSAVIDSNDATRISRSDFPADFIMGTGSSAYQIEGGARDGGRGPSIWDTFTHRRPDMIRGGTNGDVAVDSYHLYKEDVNILKNLGLDAYRFSISWSRVLPGGRLSGGVNKEGINYYNNLIDGLLANGIKPFVTLFHWDVPQALEDEYGGFLSPRIVDDFCEYAELCFWEFGDRVKHWMTLNEPWTFSVHGYATGLYAPGRGRTSPEHVNHPTVQHRCSTVAPQCICSTGNPGTEPYWVTHHLLLAHAAAVELYKNKFQRGQEGQIGISHATQWMEPWDENSASDVEAAARALDFMLGWFMEPITSGDYPKSMKKFVGSRLPKFSPEQSKMLKGSYDFVGLNYYTASYVTNASTNSSGSNNFSYNTDIHVTYETDRNGVPIGPQSGSDWLLIYPEGIRKILVYTKKTYNVPLIYVTENGVDDVKNTNLTLSEARKDSMRLKYLQDHIFNVRQAMNDGVNVKGYFAWSLLDNFEWGEGYGVRFGIIHIDYNDNFARYPKDSAVWLMNSFHKNISKLPAVKRSIREDDEEQVSSKRLRK,brenda,Q9SPP9,OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1NCC1CCCCC1,0.00022,30.0,5.0,3.2.1.125,4060.0,-3.657577319177794,-3.657577319177794,OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1NCC1CCCCC1__MATQSSAVIDSNDATRISRSDFPADFIMGTGSSAYQIEGGARDGGRGPSIWDTFTHRRPDMIRGGTNGDVAVDSYHLYKEDVNILKNLGLDAYRFSISWSRVLPGGRLSGGVNKEGINYYNNLIDGLLANGIKPFVTLFHWDVPQALEDEYGGFLSPRIVDDFCEYAELCFWEFGDRVKHWMTLNEPWTFSVHGYATGLYAPGRGRTSPEHVNHPTVQHRCSTVAPQCICSTGNPGTEPYWVTHHLLLAHAAAVELYKNKFQRGQEGQIGISHATQWMEPWDENSASDVEAAARALDFMLGWFMEPITSGDYPKSMKKFVGSRLPKFSPEQSKMLKGSYDFVGLNYYTASYVTNASTNSSGSNNFSYNTDIHVTYETDRNGVPIGPQSGSDWLLIYPEGIRKILVYTKKTYNVPLIYVTENGVDDVKNTNLTLSEARKDSMRLKYLQDHIFNVRQAMNDGVNVKGYFAWSLLDNFEWGEGYGVRFGIIHIDYNDNFARYPKDSAVWLMNSFHKNISKLPAVKRSIREDDEEQVSSKRLRK,./data/raw/alphafold//AF-Q9SPP9-F1-model_v4.pdb,1519,84,249,1537 +1093,5126,5222,MLQSNEYFSGKVKSIGFSSSSTGRASVGVMVEGEYTFSTAEPEEMTVISGALNVLLPDATDWQVYEAGSVFNVPGHSEFHLQVAEPTSYLCRYL,brenda,P0C037,Cc1ccc(C(=O)OC[C@H]2O[C@H](n3cc(C)c(O)nc3=O)C[C@@H]2O)cc1,0.0125,30.0,7.0,2.4.2.4,562.0,-1.9030899869919435,-1.9030899869919435,Cc1ccc(C(=O)OC[C@H]2O[C@H](n3cc(C)c(O)nc3=O)C[C@@H]2O)cc1__MLQSNEYFSGKVKSIGFSSSSTGRASVGVMVEGEYTFSTAEPEEMTVISGALNVLLPDATDWQVYEAGSVFNVPGHSEFHLQVAEPTSYLCRYL,./data/raw/alphafold//AF-P0C037-F1-model_v4.pdb,460,1881,1257,2687 +1094,10168,10323,MTPNIYQQLGLKKVINACGKMTILGVSSVAPEVMQATARAASAFVEIDALVEKTGELVSRYTGAEDSYITSCASAGIAIAVAAAITHGDRARVALMPDSSGMANEVVMLRGHNVDYGAPVTSAIRLGGGRIVEVGSSNLATRWQLESAINEKTAALLYVKSHHCVQKGMLSIDDFVQVAQANHLPLIVDAAAEEDLRGWVASGADMVIYSGAKAFNAPTSGFITGRKTWIAACKAQHQGIARAMKIGKENMVGLVYALENYHQGQTTVTAAQLQPVAEAISAIHGLYADIEQDEAGRAIWRIRVRVNASELGLNAQDVEAQLRGGEIAIYARKYQLHQGVFSLDPRTVAEGEMALIVARLREIAEHAAD,brenda,D0ZLR3,O=P(O)(O)OCC(O)CO,32.0,30.0,8.0,4.3.1.29,90371.0,1.505149978319906,1.505149978319906,O=P(O)(O)OCC(O)CO__MTPNIYQQLGLKKVINACGKMTILGVSSVAPEVMQATARAASAFVEIDALVEKTGELVSRYTGAEDSYITSCASAGIAIAVAAAITHGDRARVALMPDSSGMANEVVMLRGHNVDYGAPVTSAIRLGGGRIVEVGSSNLATRWQLESAINEKTAALLYVKSHHCVQKGMLSIDDFVQVAQANHLPLIVDAAAEEDLRGWVASGADMVIYSGAKAFNAPTSGFITGRKTWIAACKAQHQGIARAMKIGKENMVGLVYALENYHQGQTTVTAAQLQPVAEAISAIHGLYADIEQDEAGRAIWRIRVRVNASELGLNAQDVEAQLRGGEIAIYARKYQLHQGVFSLDPRTVAEGEMALIVARLREIAEHAAD,./data/raw/alphafold//AF-D0ZLR3-F1-model_v4.pdb,1466,1147,2482,1350 +1095,4014,4093,MGLKALCLGLLCVLFVSHFYTPMPDNIEESWKIMALDAIAKTCTFTAMCFENMRIMRYEEFISMIFRLDYTQPLSDEYITVTDTTFVDIPVRLYLPKRKSETRRRAVIYFHGGGFCFGSSKQRAFDFLNRWTANTLDAVVVGVDYRLAPQHHFPAQFEDGLAAVKFFLLEKILTKYGVDPTRICIAGDSSGGNLATAVTQQVQNDAEIKHKIKMQVLLYPGLQITDSYLPSHRENEHGIVLTRDVAIKLVSLYFTKDEALPWAMRRNQHMPLESRHLFKFVNWSILLPEKYRKDYVYTEPILGGLSYSLPGLTDSRALPLLANDSQLQNLPLTYILTCQHDLLRDDGLMYVTRLRNVGVQVVHEHIEDGIHGALSFMTSPFYLRLGLRIRDMYVSWLDKNL,sabio,Q6P093,COC1C=COC2(C)Oc3c(C)c(O)c4c(O)c(c(C=NN5CCN(C)CC5)c(O)c4c3C2=O)NC(=O)C(C)=CC=CC(C)C(O)C(C)C(O)C(C)C(OC(C)=O)C1C,0.249,37.0,7.4,3.1.1.-,9606.0,-0.6038006529042637,-0.6038006529042637,COC1C=COC2(C)Oc3c(C)c(O)c4c(O)c(c(C=NN5CCN(C)CC5)c(O)c4c3C2=O)NC(=O)C(C)=CC=CC(C)C(O)C(C)C(O)C(C)C(OC(C)=O)C1C__MGLKALCLGLLCVLFVSHFYTPMPDNIEESWKIMALDAIAKTCTFTAMCFENMRIMRYEEFISMIFRLDYTQPLSDEYITVTDTTFVDIPVRLYLPKRKSETRRRAVIYFHGGGFCFGSSKQRAFDFLNRWTANTLDAVVVGVDYRLAPQHHFPAQFEDGLAAVKFFLLEKILTKYGVDPTRICIAGDSSGGNLATAVTQQVQNDAEIKHKIKMQVLLYPGLQITDSYLPSHRENEHGIVLTRDVAIKLVSLYFTKDEALPWAMRRNQHMPLESRHLFKFVNWSILLPEKYRKDYVYTEPILGGLSYSLPGLTDSRALPLLANDSQLQNLPLTYILTCQHDLLRDDGLMYVTRLRNVGVQVVHEHIEDGIHGALSFMTSPFYLRLGLRIRDMYVSWLDKNL,./data/raw/alphafold//AF-Q6P093-F1-model_v4.pdb,322,2157,1578,162 +1096,2917,2981,MWVPVVFLTLSVTWIGAAPLILSRIVGGWECEKHSQPWQVLVASRGRAVCGGVLVHPQWVLTAAHCIRNKSVILLGRHSLFHPEDTGQVFQVSHSFPHPLYDMSLLKNRFLRPGDDSSHDLMLLRLSEPAELTDAVKVMDLPTQEPALGTTCYASGWGSIEPEEFLTPKKLQCVDLHVISNDVCAQVHPQKVTKFMLCAGRWTGGKSTCSGDSGGPLVCNGVLQGITSWGSEPCALPERPSLYTKVVHYRKWIKDTIVANP,uniprot_search,P07288,CCCC[C@H](N=C(O)[C@H](CCCCN)N=C(O)OCc1ccccc1)C(=O)O,1.0,37.0,6.6000000000000005,3.4.21.77,9606.0,0.0,0.0,CCCC[C@H](N=C(O)[C@H](CCCCN)N=C(O)OCc1ccccc1)C(=O)O__MWVPVVFLTLSVTWIGAAPLILSRIVGGWECEKHSQPWQVLVASRGRAVCGGVLVHPQWVLTAAHCIRNKSVILLGRHSLFHPEDTGQVFQVSHSFPHPLYDMSLLKNRFLRPGDDSSHDLMLLRLSEPAELTDAVKVMDLPTQEPALGTTCYASGWGSIEPEEFLTPKKLQCVDLHVISNDVCAQVHPQKVTKFMLCAGRWTGGKSTCSGDSGGPLVCNGVLQGITSWGSEPCALPERPSLYTKVVHYRKWIKDTIVANP,./data/raw/alphafold//AF-P07288-F1-model_v4.pdb,638,1747,1103,2516 +1097,7889,8019,MASGTTTTAVKIGIIGGTGLDDPEILEGRTEKYVDTPFGKPSDALILGKIKNVDCVLLARHGRQHTIMPSKVNYQANIWALKEEGCTHVIVTTACGSLREEIQPGDIVIIDQFIDRTTMRPQSFYDGSHSCARGVCHIPMAEPFCPKTREVLIETAKKLGLRCHSKGTMVTIEGPRFSSRAESFMFRTWGADVINMTTVPEVVLAKEAGICYASIAMATDYDCWKEHEEAVSVDRVLKTLKENANKAKSLLLTTIPQIGSTEWSETLHNLKNMAQFSVLLPRH,sabio,Q13126,Nc1ncnc2[nH]ccc12,0.3,37.0,7.0,2.4.2.28,9606.0,-0.5228787452803376,-0.5228787452803376,Nc1ncnc2[nH]ccc12__MASGTTTTAVKIGIIGGTGLDDPEILEGRTEKYVDTPFGKPSDALILGKIKNVDCVLLARHGRQHTIMPSKVNYQANIWALKEEGCTHVIVTTACGSLREEIQPGDIVIIDQFIDRTTMRPQSFYDGSHSCARGVCHIPMAEPFCPKTREVLIETAKKLGLRCHSKGTMVTIEGPRFSSRAESFMFRTWGADVINMTTVPEVVLAKEAGICYASIAMATDYDCWKEHEEAVSVDRVLKTLKENANKAKSLLLTTIPQIGSTEWSETLHNLKNMAQFSVLLPRH,./data/raw/alphafold//AF-Q13126-F1-model_v4.pdb,1476,237,1668,268 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+1099,9513,9663,MNGKIVLEEHVSSELNNSVWDSAGETARNGKAYMDDVEWRLLDSDRRVEEMEQNGIDISIISLTSPGAQGILDTKKAVDFARQTNDYIRERFVDKHPSRLKAFATVALQSPADAADELERAVNDLGFVGALINGYTNIGNADSAQYLDESPVWEFWERVAALNVPVYLHPREPLPSQRRIYDGYPSLVGSAWGFAHETATHAIRLMLSGLFDKYPNLTIILGHLGEGLPLMLPRLQHRLNMQREGVGLGSAKQTVGHYLSNNFYLTTAGHFHTKGLLDSISEVGVDRMLFSADYPYESMKTASTWFDNALISDNDRIKIGRENALRLFAL,uniprot_search,A0A379IB69,O=C(O)c1cccc(C(=O)O)n1,0.0227,22.0,7.0,4.1.1.45,294.0,-1.6439741428068773,-1.6439741428068773,O=C(O)c1cccc(C(=O)O)n1__MNGKIVLEEHVSSELNNSVWDSAGETARNGKAYMDDVEWRLLDSDRRVEEMEQNGIDISIISLTSPGAQGILDTKKAVDFARQTNDYIRERFVDKHPSRLKAFATVALQSPADAADELERAVNDLGFVGALINGYTNIGNADSAQYLDESPVWEFWERVAALNVPVYLHPREPLPSQRRIYDGYPSLVGSAWGFAHETATHAIRLMLSGLFDKYPNLTIILGHLGEGLPLMLPRLQHRLNMQREGVGLGSAKQTVGHYLSNNFYLTTAGHFHTKGLLDSISEVGVDRMLFSADYPYESMKTASTWFDNALISDNDRIKIGRENALRLFAL,./data/raw/alphafold//AF-A0A379IB69-F1-model_v4.pdb,1403,1059,2385,1248 +1100,10031,10183,MSDPLHVTFVCTGNICRSPMAEKMFAQQLRHRGLGDAVRVTSAGTGNWHVGSCADERAAGVLRAHGYPTDHRAAQVGTEHLAADLLVALDRNHARLLRQLGVEAARVRMLRSFDPRSGTHALDVEDPYYGDHSDFEEVFAVIESALPGLHDWVDERLARNGPS,brenda,P9WIA1,O=P(O)(O)C(F)(F)c1ccc(COc2ccccc2)cc1,0.1,37.0,6.2,3.1.3.48,1773.0,-1.0,-1.0,O=P(O)(O)C(F)(F)c1ccc(COc2ccccc2)cc1__MSDPLHVTFVCTGNICRSPMAEKMFAQQLRHRGLGDAVRVTSAGTGNWHVGSCADERAAGVLRAHGYPTDHRAAQVGTEHLAADLLVALDRNHARLLRQLGVEAARVRMLRSFDPRSGTHALDVEDPYYGDHSDFEEVFAVIESALPGLHDWVDERLARNGPS,./data/raw/alphafold//AF-P9WIA1-F1-model_v4.pdb,378,1781,1143,2561 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+1161,1775,1815,MNIKKEFIKVISMSCLVTAITLSGPVFIPLVQGAGGHGDVGMHVKEKEKNKDENKRKDEERNKTQEEHLKEIMKHIVKIEVKGEEAVKKEAAEKLLEKVPSDVLEMYKAIGGKIYIVDGDITKHISLEALSEDKKKIKDIYGKDALLHEHYVYAKEGYEPVLVIQSSEDYVENTEKALNVYYEIGKILSRDILSKINQPYQKFLDVLNTIKNASDSDGQDLLFTNQLKEHPTDFSVEFLEQNSNEVQEVFAKAFAYYIEPQHRDVLQLYAPEAFNYMDKFNEQEINLSLEELKDQRMLARYEKWEKIKQHYQHWSDSLSEEGRGLLKKLQIPIEPKKDDIIHSLSQEEKELLKRIQIDSSDFLSTEEKEFLKKLQIDIRDSLSEEEKELLNRIQVDSSNPLSEKEKEFLKKLKLDIQPYDINQRLQDTGGLIDSPSINLDVRKQYKRDIQNIDALLHQSIGSTLYNKIYLYENMNINNLTATLGADLVDSTDNTKINRGIFNEFKKNFKYSISSNYMIVDINERPALDNERLKWRIQLSPDTRAGYLENGKLILQRNIGLEIKDVQIIKQSEKEYIRIDAKVVPKSKIDTKIQEAQLNINQEWNKALGLPKYTKLITFNVHNRYASNIVESAYLILNEWKNNIQSDLIKKVTNYLVDGNGRFVFTDITLPNIAEQYTHQDEIYEQVHSKGLYVPESRSILLHGPSKGVELRNDSEGFIHEFGHAVDDYAGYLLDKNQSDLVTNSKKFIDIFKEEGSNLTSYGRTNEAEFFAEAFRLMHSTDHAERLKVQKNAPKTFQFINDQIKFIINS,uniprot_search,P15917,CC(O)=NCC(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=NCCC(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@H](C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C,0.036,31.0,7.4,3.4.24.83,1392.0,-1.4436974992327127,-1.4436974992327127,CC(O)=NCC(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=NCCC(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@H](C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C__MNIKKEFIKVISMSCLVTAITLSGPVFIPLVQGAGGHGDVGMHVKEKEKNKDENKRKDEERNKTQEEHLKEIMKHIVKIEVKGEEAVKKEAAEKLLEKVPSDVLEMYKAIGGKIYIVDGDITKHISLEALSEDKKKIKDIYGKDALLHEHYVYAKEGYEPVLVIQSSEDYVENTEKALNVYYEIGKILSRDILSKINQPYQKFLDVLNTIKNASDSDGQDLLFTNQLKEHPTDFSVEFLEQNSNEVQEVFAKAFAYYIEPQHRDVLQLYAPEAFNYMDKFNEQEINLSLEELKDQRMLARYEKWEKIKQHYQHWSDSLSEEGRGLLKKLQIPIEPKKDDIIHSLSQEEKELLKRIQIDSSDFLSTEEKEFLKKLQIDIRDSLSEEEKELLNRIQVDSSNPLSEKEKEFLKKLKLDIQPYDINQRLQDTGGLIDSPSINLDVRKQYKRDIQNIDALLHQSIGSTLYNKIYLYENMNINNLTATLGADLVDSTDNTKINRGIFNEFKKNFKYSISSNYMIVDINERPALDNERLKWRIQLSPDTRAGYLENGKLILQRNIGLEIKDVQIIKQSEKEYIRIDAKVVPKSKIDTKIQEAQLNINQEWNKALGLPKYTKLITFNVHNRYASNIVESAYLILNEWKNNIQSDLIKKVTNYLVDGNGRFVFTDITLPNIAEQYTHQDEIYEQVHSKGLYVPESRSILLHGPSKGVELRNDSEGFIHEFGHAVDDYAGYLLDKNQSDLVTNSKKFIDIFKEEGSNLTSYGRTNEAEFFAEAFRLMHSTDHAERLKVQKNAPKTFQFINDQIKFIINS,./data/raw/alphafold//AF-P15917-F1-model_v4.pdb,363,1761,1120,2536 +1162,3379,3452,MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,brenda,Q9Y5Y6,CC[C@H](C)[C@H](N=C(O)[C@H](CO)N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N=C(O)[C@H](CS)N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CS)C(O)=N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CC(=O)O)C(=O)O,6.4e-06,25.0,7.6,3.4.21.109,9606.0,-5.1938200260161125,-5.1938200260161125,CC[C@H](C)[C@H](N=C(O)[C@H](CO)N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N=C(O)[C@H](CS)N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CS)C(O)=N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CC(=O)O)C(=O)O__MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,./data/raw/alphafold//AF-Q9Y5Y6-F1-model_v4.pdb,489,1916,1302,2740 +1163,9816,9968,MASKPIEDYGKGKGRIEPMYIPDNTFYNADDFLVPPHCKPYIDKILLPGGLVKDRVEKLAYDIHRTYFGEELHIICILKGSRGFFNLLIDYLATIQKYSGRESSVPPFFEHYVRLKSYQNDNSTGQLTVLSDDLSIFRDKHVLIVEDIVDTGFTLTEFGERLKAVGPKSMRIATLVEKRTDRSNSLKGDFVGFSIEDVWIVGCCYDFNEMFRDFDHVAVLSDAARKKFEK,uniprot_search,Q26997,O=C1N=CC2=NC=NC2=N1,0.57,37.0,8.016666666666667,2.4.2.22,5811.0,-0.2441251443275086,-0.2441251443275086,O=C1N=CC2=NC=NC2=N1__MASKPIEDYGKGKGRIEPMYIPDNTFYNADDFLVPPHCKPYIDKILLPGGLVKDRVEKLAYDIHRTYFGEELHIICILKGSRGFFNLLIDYLATIQKYSGRESSVPPFFEHYVRLKSYQNDNSTGQLTVLSDDLSIFRDKHVLIVEDIVDTGFTLTEFGERLKAVGPKSMRIATLVEKRTDRSNSLKGDFVGFSIEDVWIVGCCYDFNEMFRDFDHVAVLSDAARKKFEK,./data/raw/alphafold//AF-Q26997-F1-model_v4.pdb,342,1776,1137,2555 +1164,3759,3836,MLRGGRSPLPPPAGPPGGARGQAGAGAAQVAAGSLLALLILWTLFGNVLVCAAIVRYRHLRSKVTNIFIVSLAVSDLLVAVLVMPWKAVAEVAGYWPFGAFQNVWVAFDIMCSTASILNLCVISVDRYWAISSPFRYERKMTQRLALVMIGVAWALSVLISFIPVQLNWHRGGDAATAAAAGDIEDGFDTGWEAAGAFTTWAEDMSTTWVALAAMTPSEGTSGSNNTVPGPSESCDSSLNRTYAISSSLISFYIPVAIMIVTYTRIYRIAQVQIRRISSLERAAEHAQSCRCNHVDCHHHTSLKSSIRKETKVLKTLSIIMGVFVCCWLPFFILNCMVPFCESPPSDPRAGLPCVSETTFNIFVWFGWANSSLNPIIYAFNADFRKVFSNLLGCGQFCSSTPVETVNISNELISYHQDTFHKEIVTAYVNMIPNVVDCEENREDPFDRMSQISPDPEVATDSVCELDCEGEISLGKITPFTPNGLH,sabio,Q7LZ74,CN1CCN(C2=Nc3cc(Cl)ccc3Nc3ccccc32)CC1,0.000194,22.0,,-.-.-.-,9031.0,-3.712198270069774,-3.712198270069774,CN1CCN(C2=Nc3cc(Cl)ccc3Nc3ccccc32)CC1__MLRGGRSPLPPPAGPPGGARGQAGAGAAQVAAGSLLALLILWTLFGNVLVCAAIVRYRHLRSKVTNIFIVSLAVSDLLVAVLVMPWKAVAEVAGYWPFGAFQNVWVAFDIMCSTASILNLCVISVDRYWAISSPFRYERKMTQRLALVMIGVAWALSVLISFIPVQLNWHRGGDAATAAAAGDIEDGFDTGWEAAGAFTTWAEDMSTTWVALAAMTPSEGTSGSNNTVPGPSESCDSSLNRTYAISSSLISFYIPVAIMIVTYTRIYRIAQVQIRRISSLERAAEHAQSCRCNHVDCHHHTSLKSSIRKETKVLKTLSIIMGVFVCCWLPFFILNCMVPFCESPPSDPRAGLPCVSETTFNIFVWFGWANSSLNPIIYAFNADFRKVFSNLLGCGQFCSSTPVETVNISNELISYHQDTFHKEIVTAYVNMIPNVVDCEENREDPFDRMSQISPDPEVATDSVCELDCEGEISLGKITPFTPNGLH,./data/raw/alphafold//AF-Q7LZ74-F1-model_v4.pdb,159,1421,734,2096 +1165,10676,10834,LPYWNWDAPAGMRMPSIFTDPSSSLYNKLRDAKHQPPYLIDLDYNGQDPSYTEAQQIDHNLKIMYRQVIANGKTAQLFMGSPYRAGDQPNPGAGSLENAPHGPVHVWTGDRNQPNGEDMGTLYSAGRDPIFFSHHSNVDSMW,brenda,Q45NF5,O=c1cccccc1O,0.00655,30.0,6.0,1.14.18.1,157786.0,-2.183758700008217,-2.183758700008217,O=c1cccccc1O__LPYWNWDAPAGMRMPSIFTDPSSSLYNKLRDAKHQPPYLIDLDYNGQDPSYTEAQQIDHNLKIMYRQVIANGKTAQLFMGSPYRAGDQPNPGAGSLENAPHGPVHVWTGDRNQPNGEDMGTLYSAGRDPIFFSHHSNVDSMW,./data/raw/alphafold//AF-Q45NF5-F1-model_v4.pdb,1529,5,63,1437 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diff --git a/datasets/splits/ki-random_train.csv b/datasets/splits/ki-random_train.csv new file mode 100644 index 0000000000000000000000000000000000000000..fe32d97526ba5bcab7ec7e2614aa55c73605c627 --- /dev/null +++ b/datasets/splits/ki-random_train.csv @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:591adc1aba81aeec78e48f162c807d086db79987b81346cba18a5d5be99ea28a +size 11382785 diff --git a/datasets/splits/ki-random_trainval.csv b/datasets/splits/ki-random_trainval.csv new file mode 100644 index 0000000000000000000000000000000000000000..de8bbc00b080cce212e33143085faf8fbb1529da --- /dev/null +++ b/datasets/splits/ki-random_trainval.csv @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:cf1acf9daf52ef211722e0232caa60d72c98ae878d81926cf7c90ac1ff631f29 +size 12651119 diff --git a/datasets/splits/ki-random_trainvaltest.csv b/datasets/splits/ki-random_trainvaltest.csv new file mode 100644 index 0000000000000000000000000000000000000000..2290dca88275083e25a1900d78376c11d4ab402a --- /dev/null +++ b/datasets/splits/ki-random_trainvaltest.csv @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:ba3bbddc54743298214d643206d6bc0c5e068fb01656f3f0d6e7bcba16456180 +size 14055528 diff --git a/datasets/splits/ki-random_val.csv b/datasets/splits/ki-random_val.csv new file mode 100644 index 0000000000000000000000000000000000000000..5b85bd41ce0bad8da447c24f0c70136586fd47cc --- /dev/null +++ b/datasets/splits/ki-random_val.csv @@ -0,0 +1,1075 @@ +,Unnamed: 0,Unnamed: 0.1,sequence,sequence_source,uniprot,substrate_smiles,value,temperature,ph,ec,taxonomy_id,log10_value,log10ki_mean,group,pdbpath,sequence_40cluster,sequence_60cluster,sequence_80cluster,sequence_99cluster 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+9,1521,1557,MKMKMKLASFGLAAGLAAQVFLPYNALASTEHVTWNQQFQTPQFISGDLLKVNGTSPEELVYQYVEKNENKFKFHENAKDTLQLKEKKNDNLGFTFMRFQQTYKGIPVFGAVVTSHVKDGTLTALSGTLIPNLDTKGSLKSGKKLSEKQARDIAEKDLVANVTKEVPEYEQGKDTEFVVYVNGDEASLAYVVNLNFLTPEPGNWLYIIDAVDGKILNKFNQLDAAKPGDVKSITGTSTVGVGRGVLGDQKNINTTYSTYYYLQDNTRGNGIFTYDAKYRTTLPGSLWADADNQFFASYDAPAVDAHYYAGVTYDYYKNVHNRLSYDGNNAAIRSSVHYSQGYNNAFWNGSQMVYGDGDGQTFIPLSGGIDVVAHELTHAVTDYTAGLIYQNESGAINEAISDIFGTLVEFYANKNPDWEIGEDVYTPGISGDSLRSMSDPAKYGDPDHYSKRYTGTQDNGGVHINSGIINKAAYLISQGGTHYGVSVVGIGRDKLGKIFYRALTQYLTPTSNFSQLRAAAVQSATDLYGSTSQEVASVKQAFDAVGVK,brenda,P00800,CC(C)C[C@H](NC(CCc1ccccc1)C(=O)O)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,5e-05,25.0,7.5,3.4.24.27,1427.0,-4.301029995663981,-4.301029995663981,CC(C)C[C@H](NC(CCc1ccccc1)C(=O)O)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O__MKMKMKLASFGLAAGLAAQVFLPYNALASTEHVTWNQQFQTPQFISGDLLKVNGTSPEELVYQYVEKNENKFKFHENAKDTLQLKEKKNDNLGFTFMRFQQTYKGIPVFGAVVTSHVKDGTLTALSGTLIPNLDTKGSLKSGKKLSEKQARDIAEKDLVANVTKEVPEYEQGKDTEFVVYVNGDEASLAYVVNLNFLTPEPGNWLYIIDAVDGKILNKFNQLDAAKPGDVKSITGTSTVGVGRGVLGDQKNINTTYSTYYYLQDNTRGNGIFTYDAKYRTTLPGSLWADADNQFFASYDAPAVDAHYYAGVTYDYYKNVHNRLSYDGNNAAIRSSVHYSQGYNNAFWNGSQMVYGDGDGQTFIPLSGGIDVVAHELTHAVTDYTAGLIYQNESGAINEAISDIFGTLVEFYANKNPDWEIGEDVYTPGISGDSLRSMSDPAKYGDPDHYSKRYTGTQDNGGVHINSGIINKAAYLISQGGTHYGVSVVGIGRDKLGKIFYRALTQYLTPTSNFSQLRAAAVQSATDLYGSTSQEVASVKQAFDAVGVK,./data/raw/alphafold//AF-P00800-F1-model_v4.pdb,240,1601,941,2330 +10,1759,1799,MQTEHVILLNAQGVPTGTLEKYAAHTADTRLHLAFSSWLFNAKGQLLVTRRALSKKAWPGVWTNSVCGHPQLGESNEDAVIRRCRYELGVEITPPESIYPDFRYRATDPSGIVENEVCPVFAARTTSALQINDDEVMDYQWCDLADVLHGIDATPWAFSPWMVMQATNREARKRLSAFTQLK,sabio,Q46822,CC(O)(CBr)CCOP(=O)(O)OP(=O)(O)O,0.0014,37.0,7.5,5.3.3.2,562.0,-2.853871964321762,-2.853871964321762,CC(O)(CBr)CCOP(=O)(O)OP(=O)(O)O__MQTEHVILLNAQGVPTGTLEKYAAHTADTRLHLAFSSWLFNAKGQLLVTRRALSKKAWPGVWTNSVCGHPQLGESNEDAVIRRCRYELGVEITPPESIYPDFRYRATDPSGIVENEVCPVFAARTTSALQINDDEVMDYQWCDLADVLHGIDATPWAFSPWMVMQATNREARKRLSAFTQLK,./data/raw/alphafold//AF-Q46822-F1-model_v4.pdb,409,1816,1183,2607 +11,7541,7669,MEHVQQYKFYKEKKMSIVLAPFSGGQPHSGVELGPDYLLKQGLQQDMEKLGWDTRLERVFDGKVVEARKASDNGDRIGRVKRPRLTAECTEKIYKCVRRVAEQGRFPLTIGGDHSIALGTVAGVLSVHPDAGVIWVDAHADINTMSGTVSGNLHGCPLSILLGLDRENIPECFSWVPQVLKPNKIAYIGLRAVDDEEKKILHDLNIAAFSMHHVDRYGIDKVVSMAIEAVSPKGTEPVMVSYDVDTIDPLYVPATGTPVRGGLSFREALFLCERIAECGRLVALDVVECNPLLAATESHVNDTISVGCAIARCMMGETLLYTPHTSSKL,brenda,Q6TUJ5,N[C@@](CCCCB(O)O)(CCN1CCCCC1)C(=O)O,0.0014,21.0,8.0,3.5.3.1,5665.0,-2.853871964321762,-2.853871964321762,N[C@@](CCCCB(O)O)(CCN1CCCCC1)C(=O)O__MEHVQQYKFYKEKKMSIVLAPFSGGQPHSGVELGPDYLLKQGLQQDMEKLGWDTRLERVFDGKVVEARKASDNGDRIGRVKRPRLTAECTEKIYKCVRRVAEQGRFPLTIGGDHSIALGTVAGVLSVHPDAGVIWVDAHADINTMSGTVSGNLHGCPLSILLGLDRENIPECFSWVPQVLKPNKIAYIGLRAVDDEEKKILHDLNIAAFSMHHVDRYGIDKVVSMAIEAVSPKGTEPVMVSYDVDTIDPLYVPATGTPVRGGLSFREALFLCERIAECGRLVALDVVECNPLLAATESHVNDTISVGCAIARCMMGETLLYTPHTSSKL,./data/raw/alphafold//AF-Q6TUJ5-F1-model_v4.pdb,63,678,110,795 +12,4630,4717,MKYTKTLLAMVLSATFCQAYAEDKVWISIGADANQTVMKSGAESILPNSVASSGQVWVGQVDVAQLAELSHNMHEEHNRCGGYMVHPSAQSAMAASAMPTTLASFVMPPITQQATVTAWLPQVDASQITGTISSLESFTNRFYTTTSGAQASDWIASEWQALSASLPNASVKQVSHSGYNQKSVVMTITGSEAPDEWIVIGGHLDSTIGSHTNEQSVAPGADDDASGIAAVTEVIRVLSENNFQPKRSIAFMAYAAEEVGLRGSQDLANQYKSEGKNVVSALQLDMTNYKGSAQDVVFITDYTDSNFTQYLTQLMDEYLPSLTYGFDTCGYACSDHASWHNAGYPAAMPFESKFNDYNPRIHTTQDTLANSDPTGSHAKKFTQLGLAYAIEMGSATGDTPTPGNQLEDGVPVTDLSGSRGSNVWYTFELETQKNLQITTSGGYGDLDLYVKFGSKASKQNWDCRPYLSGNNEVCTFNNASPGTYSVMLTGYSNYSGASLKASTF,uniprot_search,Q01693,C[C@@H](O)[C@H](N)C(O)=NO,0.0022,15.65,8.5,3.4.11.10,671.0,-2.657577319177794,-2.657577319177794,C[C@@H](O)[C@H](N)C(O)=NO__MKYTKTLLAMVLSATFCQAYAEDKVWISIGADANQTVMKSGAESILPNSVASSGQVWVGQVDVAQLAELSHNMHEEHNRCGGYMVHPSAQSAMAASAMPTTLASFVMPPITQQATVTAWLPQVDASQITGTISSLESFTNRFYTTTSGAQASDWIASEWQALSASLPNASVKQVSHSGYNQKSVVMTITGSEAPDEWIVIGGHLDSTIGSHTNEQSVAPGADDDASGIAAVTEVIRVLSENNFQPKRSIAFMAYAAEEVGLRGSQDLANQYKSEGKNVVSALQLDMTNYKGSAQDVVFITDYTDSNFTQYLTQLMDEYLPSLTYGFDTCGYACSDHASWHNAGYPAAMPFESKFNDYNPRIHTTQDTLANSDPTGSHAKKFTQLGLAYAIEMGSATGDTPTPGNQLEDGVPVTDLSGSRGSNVWYTFELETQKNLQITTSGGYGDLDLYVKFGSKASKQNWDCRPYLSGNNEVCTFNNASPGTYSVMLTGYSNYSGASLKASTF,./data/raw/alphafold//AF-Q01693-F1-model_v4.pdb,260,1627,972,2367 +13,10008,10160,MSIKLNSGYEMPLVGFGCWKVDNATCADTVYNAIKVGYRLFDAAMDYGNCKEIGEGINRALDEGLVARDELFITSKLWNSYHDPKNVELALKKVLSDMKLDYIDLFLIHFPIAFKFVPFEEKYPPAFYCGDGDNFHYEDVPLLETWKAMEKLTKGGKAKSIGISNFSAALIYDLLRGAEIKPAVLQIEHHPYLQQPRLIEYVQSQGIAITAYSSFGPQSFLELKHSKALDTPTLFEHKTITSIADKYKKTPAQVLLRWASQRDIAIIPKSNNPDRLLQNLEVNDFNLSKEDFDEISKLDQDLRFNNPWDWDTKNRIPIFA,brenda,A0A0M4HL56,O=Cc1ccco1,54.0,45.0,7.0,1.1.1.307,27299.0,1.7323937598229686,1.7323937598229686,O=Cc1ccco1__MSIKLNSGYEMPLVGFGCWKVDNATCADTVYNAIKVGYRLFDAAMDYGNCKEIGEGINRALDEGLVARDELFITSKLWNSYHDPKNVELALKKVLSDMKLDYIDLFLIHFPIAFKFVPFEEKYPPAFYCGDGDNFHYEDVPLLETWKAMEKLTKGGKAKSIGISNFSAALIYDLLRGAEIKPAVLQIEHHPYLQQPRLIEYVQSQGIAITAYSSFGPQSFLELKHSKALDTPTLFEHKTITSIADKYKKTPAQVLLRWASQRDIAIIPKSNNPDRLLQNLEVNDFNLSKEDFDEISKLDQDLRFNNPWDWDTKNRIPIFA,./data/raw/alphafold//AF-A0A0M4HL56-F1-model_v4.pdb,138,435,925,2311 +14,6560,6671,MSFNESASIPTGLTYDDVLIIPQHSRVTSRKEVNTTTRLSRNVKLSIPIVASNMDTVCEQRMAVAMAREGGIGILHRFCSIEEQCAMLREVKRAQSFLIESPRIILPHETAREAWEGLNWKGRVGGVGCLLVVNCKNERKLLGIITRHDLKLADESTTVESLMTPVDKMVVSTNTSISLEEVTHLMRKGRTANVPIVGQNGQLLYLVTLSDVVKLRKNKQASLDSRGRLLVGAAVGVKKDDMNRAIRLVEAGADVLVVDIAHGHSDLCINMVKRLKGDPRTASVDIIAGNIASAEAAEALIDAGADGLKIGVGPGSICITRLVAGAGVPQLSAVLACTRVARRRGVPCIADGGLRTSGDISKAIGAGADTVMLGNMLAGTDEAPGRVLVKDGQKVKIIRGMAGFGANLSKAERERTQDEDVFSSLVPEGVEGSVACKGPVGPIVRQLVGGLRSGMSYSGAKSIEEMQRRTRFVRMTGAGLRESGSHGVAKL,brenda,Q57ZS7,NC(=O)c1ncn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)n1,0.00446,35.0,8.0,1.7.1.7,5702.0,-2.350665141287858,-2.350665141287858,NC(=O)c1ncn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)n1__MSFNESASIPTGLTYDDVLIIPQHSRVTSRKEVNTTTRLSRNVKLSIPIVASNMDTVCEQRMAVAMAREGGIGILHRFCSIEEQCAMLREVKRAQSFLIESPRIILPHETAREAWEGLNWKGRVGGVGCLLVVNCKNERKLLGIITRHDLKLADESTTVESLMTPVDKMVVSTNTSISLEEVTHLMRKGRTANVPIVGQNGQLLYLVTLSDVVKLRKNKQASLDSRGRLLVGAAVGVKKDDMNRAIRLVEAGADVLVVDIAHGHSDLCINMVKRLKGDPRTASVDIIAGNIASAEAAEALIDAGADGLKIGVGPGSICITRLVAGAGVPQLSAVLACTRVARRRGVPCIADGGLRTSGDISKAIGAGADTVMLGNMLAGTDEAPGRVLVKDGQKVKIIRGMAGFGANLSKAERERTQDEDVFSSLVPEGVEGSVACKGPVGPIVRQLVGGLRSGMSYSGAKSIEEMQRRTRFVRMTGAGLRESGSHGVAKL,./data/raw/alphafold//AF-Q57ZS7-F1-model_v4.pdb,946,1415,1936,659 +15,9877,10029,MAVRRALIVLAHAERTSFNYAMKEAAVEALKKKGWEVVESDLYAMNFNPLISRNDITGEPKDSENFQYPVESSLAYKEGRLSPDIVAEQKKLEAADLVIFQFPLYWFGVPAILKGWFERVLVAGFAYTYATMYDKGPFQNKKTLLSITTGGSGSMYSLQGVHGDMNVILWPIQSGILRFCGFQVLEPQLVYSIGHTPPDARVQVLEGWKKRLETVWEESPLYFAPSSLFDLNFQAGFLLKKEVQEEQKKNKFGLSVGHHLGKSIPADNQIKARK,uniprot_search,P05982,O=C1c2ccccc2C(=O)c2c(Nc3ccc(N=c4nc(Nc5ccc(S(=O)(=O)O)cc5)nc(Cl)[nH]4)c(S(=O)(=O)O)c3)cccc21,0.00054,25.0,8.5,1.6.5.2,10116.0,-3.2676062401770314,-4.081588543100168,O=C1c2ccccc2C(=O)c2c(Nc3ccc(N=c4nc(Nc5ccc(S(=O)(=O)O)cc5)nc(Cl)[nH]4)c(S(=O)(=O)O)c3)cccc21__MAVRRALIVLAHAERTSFNYAMKEAAVEALKKKGWEVVESDLYAMNFNPLISRNDITGEPKDSENFQYPVESSLAYKEGRLSPDIVAEQKKLEAADLVIFQFPLYWFGVPAILKGWFERVLVAGFAYTYATMYDKGPFQNKKTLLSITTGGSGSMYSLQGVHGDMNVILWPIQSGILRFCGFQVLEPQLVYSIGHTPPDARVQVLEGWKKRLETVWEESPLYFAPSSLFDLNFQAGFLLKKEVQEEQKKNKFGLSVGHHLGKSIPADNQIKARK,./data/raw/alphafold//AF-P05982-F1-model_v4.pdb,171,2168,1589,1744 +16,6802,6917,MKPISIIGVPMDLGQTRRGVDMGPSAMRYAGVIERLERLHYDIEDLGDIPIGKAERLHEQGDSRLRNLKAVAEANEKLAAAVDQVVQRGRFPLVLGGDHSIAIGTLAGVAKHYERLGVIWYDAHGDVNTAETSPSGNIHGMPLAASLGFGHPALTQIGGYSPKIKPEHVVLIGVRSLDEGEKKFIREKGIKIYTMHEVDRLGMTRVMEETIAYLKERTDGVHLSLDLDGLDPSDAPGVGTPVIGGLTYRESHLAMEMLAEAQIITSAEFVEVNPILDERNKTASVAVALMGSLFGEKLM,sabio,P53608,NCCCC(N)C(=O)O,0.55,60.0,9.0,3.5.3.1,33931.0,-0.2596373105057561,0.1919076829902156,NCCCC(N)C(=O)O__MKPISIIGVPMDLGQTRRGVDMGPSAMRYAGVIERLERLHYDIEDLGDIPIGKAERLHEQGDSRLRNLKAVAEANEKLAAAVDQVVQRGRFPLVLGGDHSIAIGTLAGVAKHYERLGVIWYDAHGDVNTAETSPSGNIHGMPLAASLGFGHPALTQIGGYSPKIKPEHVVLIGVRSLDEGEKKFIREKGIKIYTMHEVDRLGMTRVMEETIAYLKERTDGVHLSLDLDGLDPSDAPGVGTPVIGGLTYRESHLAMEMLAEAQIITSAEFVEVNPILDERNKTASVAVALMGSLFGEKLM,./data/raw/alphafold//AF-P53608-F1-model_v4.pdb,63,618,1992,719 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+137,4995,5089,MAAEATAVAGSGAVGGCLAKDGLQQSKCPDTTPKRRRASSLSRDAERRAYQWCREYLGGAWRRVQPEELRVYPVSGGLSNLLFRCSLPDHLPSVGEEPREVLLRLYGAILQGVDSLVLESVMFAILAERSLGPQLYGVFPEGRLEQYIPSRPLKTQELREPVLSAAIATKMAQFHGMEMPFTKEPHWLFGTMERYLKQIQDLPPTGLPEMNLLEMYSLKDEMGNLRKLLESTPSPVVFCHNDIQEGNILLLSEPENADSLMLVDFEYSSYNYRGFDIGNHFCEWVYDYTHEEWPFYKARPTDYPTQEQQLHFIRHYLAEAKKGETLSQEEQRKLEEDLLVEVSRYALASHFFWGLWSILQASMSTIEFGYLDYAQSRFQFYFQQKGQLTSVHSSS,brenda,Q9Y259,C[N+]1(C)CCOC(O)(c2ccc(-c3ccc(C4(O)C[N+](C)(C)CCO4)cc3)cc2)C1.[Br-].[Br-],0.116,37.0,8.049999999999999,2.7.1.32,9606.0,-0.9355420107730816,-0.9355420107730816,C[N+]1(C)CCOC(O)(c2ccc(-c3ccc(C4(O)C[N+](C)(C)CCO4)cc3)cc2)C1.[Br-].[Br-]__MAAEATAVAGSGAVGGCLAKDGLQQSKCPDTTPKRRRASSLSRDAERRAYQWCREYLGGAWRRVQPEELRVYPVSGGLSNLLFRCSLPDHLPSVGEEPREVLLRLYGAILQGVDSLVLESVMFAILAERSLGPQLYGVFPEGRLEQYIPSRPLKTQELREPVLSAAIATKMAQFHGMEMPFTKEPHWLFGTMERYLKQIQDLPPTGLPEMNLLEMYSLKDEMGNLRKLLESTPSPVVFCHNDIQEGNILLLSEPENADSLMLVDFEYSSYNYRGFDIGNHFCEWVYDYTHEEWPFYKARPTDYPTQEQQLHFIRHYLAEAKKGETLSQEEQRKLEEDLLVEVSRYALASHFFWGLWSILQASMSTIEFGYLDYAQSRFQFYFQQKGQLTSVHSSS,./data/raw/alphafold//AF-Q9Y259-F1-model_v4.pdb,808,317,1756,370 +138,4704,4794,MPDYTWFEGIPFHAFGISKETLQNVCNKFVVKDEDLILLAYPKSGTNWLIEIVCLIQTKGDPKWIQSVTIWDRSPWIETDLGYDMLIKKKGPRLITSHLPMHLFSKSLFSSKAKVIYLVRNPRDVLVSGYYFWGNSTLAKKPDSLGTYVEWFLKGNVLYGSWFEHIRAWLSMREWDNFLLLYYEDMKKDTMGTIKKICDFLGKKLEPDELDLVLKYSSFQVMKENDMSNYSLLMKKSIFTGIGLMRKGTVGDWKNHFTVSQAEAFDKVFQEKMAGFPPGMFPWE,uniprot_search,P15709,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,0.026,37.0,6.5,2.8.2.14,10116.0,-1.585026652029182,-1.585026652029182,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C__MPDYTWFEGIPFHAFGISKETLQNVCNKFVVKDEDLILLAYPKSGTNWLIEIVCLIQTKGDPKWIQSVTIWDRSPWIETDLGYDMLIKKKGPRLITSHLPMHLFSKSLFSSKAKVIYLVRNPRDVLVSGYYFWGNSTLAKKPDSLGTYVEWFLKGNVLYGSWFEHIRAWLSMREWDNFLLLYYEDMKKDTMGTIKKICDFLGKKLEPDELDLVLKYSSFQVMKENDMSNYSLLMKKSIFTGIGLMRKGTVGDWKNHFTVSQAEAFDKVFQEKMAGFPPGMFPWE,./data/raw/alphafold//AF-P15709-F1-model_v4.pdb,786,290,1726,307 +139,9498,9648,MAVRRALIVLAHAERTSFNYAMKEAAVEALKKKGWEVVESDLYAMNFNPLISRNDITGEPKDSENFQYPVESSLAYKEGRLSPDIVAEQKKLEAADLVIFQFPLYWFGVPAILKGWFERVLVAGFAYTYATMYDKGPFQNKKTLLSITTGGSGSMYSLQGVHGDMNVILWPIQSGILRFCGFQVLEPQLVYSIGHTPPDARVQVLEGWKKRLETVWEESPLYFAPSSLFDLNFQAGFLLKKEVQEEQKKNKFGLSVGHHLGKSIPADNQIKARK,uniprot_search,P05982,O=C(O)c1ccc2c(c1)C(=O)c1ccccc1C2=O,0.0013,25.0,8.5,1.6.5.2,10116.0,-2.886056647693163,-2.886056647693163,O=C(O)c1ccc2c(c1)C(=O)c1ccccc1C2=O__MAVRRALIVLAHAERTSFNYAMKEAAVEALKKKGWEVVESDLYAMNFNPLISRNDITGEPKDSENFQYPVESSLAYKEGRLSPDIVAEQKKLEAADLVIFQFPLYWFGVPAILKGWFERVLVAGFAYTYATMYDKGPFQNKKTLLSITTGGSGSMYSLQGVHGDMNVILWPIQSGILRFCGFQVLEPQLVYSIGHTPPDARVQVLEGWKKRLETVWEESPLYFAPSSLFDLNFQAGFLLKKEVQEEQKKNKFGLSVGHHLGKSIPADNQIKARK,./data/raw/alphafold//AF-P05982-F1-model_v4.pdb,171,2168,1589,1744 +140,5784,5883,MKTIVKLDLDKKPWEQDGQIHNRWHPDLPMIAMVKPGDEFRVECMDWTGGQIGNNDSANDVRDVDLTQVHYLSGPIGVEGAEPGDLMVVDILDVGTFDDSQWGFNGLFAKENGGGFLTDHFPEASKTIWDFHGVYTTSRHVPKVRYAGIMHPGLIGCLPSKELLDTWNKREGDLIATDPDRVPPLACPPTSQSAVMGRLSGDAAKKAAAEGARTVPPRDHGGNCDIKNLTKGSRVYFPVYVKDGGLSMGDLHFSQGDGEITFCGAIEMAGYLDIKVGLIKDGVKKYGIKNPVFQPSPITPTYRDYMIFEGISVDEAGKQHYLDVHIAYRQACLNAIEYLKKFGYSGEQAVSILGTAPVEGHISGIVDIPNACATLWIPTEIFEFDIRPNADGPKIMVPPGVDVSFTS,uniprot_search,Q50228,N=C(N)S,4.6,25.0,7.733333333333333,3.5.1.49,17.0,0.6627578316815741,0.6627578316815741,N=C(N)S__MKTIVKLDLDKKPWEQDGQIHNRWHPDLPMIAMVKPGDEFRVECMDWTGGQIGNNDSANDVRDVDLTQVHYLSGPIGVEGAEPGDLMVVDILDVGTFDDSQWGFNGLFAKENGGGFLTDHFPEASKTIWDFHGVYTTSRHVPKVRYAGIMHPGLIGCLPSKELLDTWNKREGDLIATDPDRVPPLACPPTSQSAVMGRLSGDAAKKAAAEGARTVPPRDHGGNCDIKNLTKGSRVYFPVYVKDGGLSMGDLHFSQGDGEITFCGAIEMAGYLDIKVGLIKDGVKKYGIKNPVFQPSPITPTYRDYMIFEGISVDEAGKQHYLDVHIAYRQACLNAIEYLKKFGYSGEQAVSILGTAPVEGHISGIVDIPNACATLWIPTEIFEFDIRPNADGPKIMVPPGVDVSFTS,./data/raw/alphafold//AF-Q50228-F1-model_v4.pdb,896,421,1779,490 +141,6391,6501,MTRYAAIDCGTNSIRLLITEVTPEGFKEITRENTIVRLGKGVDATGQLDPEAIERTRVALENYVELMETHGVEAVRMVATSATRDASNRDEFFSMTRQLLSKIRPGYQAEVISGEEEALLSFRGAIVDLPEDQGPFCVIDLGGGSTEFIVGTYDGEILGSHSTQMGCVRLTERIMRSDPPTETEVEIARDYVAERIQEVKAIVPISKAKTFVGCAGTFTTISAWVQGLESYDRDAIHLSALNFDALRVVTDEIISESSSQRASNPVVDPGRADVIGGGSVVVQAAIDLASKEAGVDYIIISEKDILDGLILGLVEADSLKK,brenda,Q8NRR8,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1,0.8,30.0,7.5,3.6.1.11,1718.0,-0.0969100130080563,-0.0969100130080563,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1__MTRYAAIDCGTNSIRLLITEVTPEGFKEITRENTIVRLGKGVDATGQLDPEAIERTRVALENYVELMETHGVEAVRMVATSATRDASNRDEFFSMTRQLLSKIRPGYQAEVISGEEEALLSFRGAIVDLPEDQGPFCVIDLGGGSTEFIVGTYDGEILGSHSTQMGCVRLTERIMRSDPPTETEVEIARDYVAERIQEVKAIVPISKAKTFVGCAGTFTTISAWVQGLESYDRDAIHLSALNFDALRVVTDEIISESSSQRASNPVVDPGRADVIGGGSVVVQAAIDLASKEAGVDYIIISEKDILDGLILGLVEADSLKK,./data/raw/alphafold//AF-Q8NRR8-F1-model_v4.pdb,986,529,1894,612 +142,8068,8199,MLSRLRVVSTTCTLACRHLHIKEKGKPLMLNPRTNKGMAFTLQERQMLGLQGLLPPKIETQDIQALRFHRNLKKMTSPLEKYIYIMGIQERNEKLFYRILQDDIESLMPIVYTPTVGLACSQYGHIFRRPKGLFISISDRGHVRSIVDNWPENHVKAVVVTDGERILGLGDLGVYGMGIPVGKLCLYTACAGIRPDRCLPVCIDVGTDNIALLKDPFYMGLYQKRDRTQQYDDLIDEFMKAITDRYGRNTLIQFEDFGNHNAFRFLRKYREKYCTFNDDIQGTAAVALAGLLAAQKVISKPISEHKILFLGAGEAALGIANLIVMSMVENGLSEQEAQKKIWMFDKYGLLVKGRKAKIDSYQEPFTHSAPESIPDTFEDAVNILKPSTIIGVAGAGRLFTPDVIRAMASINERPVIFALSNPTAQAECTAEEAYTLTEGRCLFASGSPFGPVKLTDGRVFTPGQGNNVYIFPGVALAVILCNTRHISDSVFLEAAKALTSQLTDEELAQGRLYPPLANIQEVSINIAIKVTEYLYANKMAFRYPEPEDKAKYVKERTWRSEYDSLLPDVYEWPESASSPPVITE,sabio,P23368,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,1.92,30.0,7.4,1.1.1.38,9606.0,0.2833012287035495,-0.2350709418491354,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MLSRLRVVSTTCTLACRHLHIKEKGKPLMLNPRTNKGMAFTLQERQMLGLQGLLPPKIETQDIQALRFHRNLKKMTSPLEKYIYIMGIQERNEKLFYRILQDDIESLMPIVYTPTVGLACSQYGHIFRRPKGLFISISDRGHVRSIVDNWPENHVKAVVVTDGERILGLGDLGVYGMGIPVGKLCLYTACAGIRPDRCLPVCIDVGTDNIALLKDPFYMGLYQKRDRTQQYDDLIDEFMKAITDRYGRNTLIQFEDFGNHNAFRFLRKYREKYCTFNDDIQGTAAVALAGLLAAQKVISKPISEHKILFLGAGEAALGIANLIVMSMVENGLSEQEAQKKIWMFDKYGLLVKGRKAKIDSYQEPFTHSAPESIPDTFEDAVNILKPSTIIGVAGAGRLFTPDVIRAMASINERPVIFALSNPTAQAECTAEEAYTLTEGRCLFASGSPFGPVKLTDGRVFTPGQGNNVYIFPGVALAVILCNTRHISDSVFLEAAKALTSQLTDEELAQGRLYPPLANIQEVSINIAIKVTEYLYANKMAFRYPEPEDKAKYVKERTWRSEYDSLLPDVYEWPESASSPPVITE,./data/raw/alphafold//AF-P23368-F1-model_v4.pdb,1347,796,2097,931 +143,2999,3066,MLAFLILVTVTLASAHHSGEHFEGEKVFRVNVEDENDISLLHELASTRQIDFWKPDSVTQIKPHSTVDFRVKAEDILAVEDFLEQNELQYEVLINNLRSVLEAQFDSRVRTTGHSYEKYNNWETIEAWTKQVTSENPDLISRTAIGTTFLGNNIYLLKVGKPGPNKPAIFMDCGFHAREWISHAFCQWFVREAVLTYGYESHMTEFLNKLDFYVLPVLNIDGYIYTWTKNRMWRKTRSTNAGTTCIGTDPNRNFDAGWCTTGASTDPCDETYCGSAAESEKETKALADFIRNNLSSIKAYLTIHSYSQMILYPYSYDYKLPENNAELNNLAKAAVKELATLYGTKYTYGPGATTIYPAAGGSDDWAYDQGIKYSFTFELRDKGRYGFILPESQIQATCEETMLAIKYVTNYVLGHL,brenda,P09955,CCCn1cnc(C[C@H](CCCN)C(=O)O)c1,0.000206,22.0,8.15,3.4.17.2,9823.0,-3.686132779630847,-3.686132779630847,CCCn1cnc(C[C@H](CCCN)C(=O)O)c1__MLAFLILVTVTLASAHHSGEHFEGEKVFRVNVEDENDISLLHELASTRQIDFWKPDSVTQIKPHSTVDFRVKAEDILAVEDFLEQNELQYEVLINNLRSVLEAQFDSRVRTTGHSYEKYNNWETIEAWTKQVTSENPDLISRTAIGTTFLGNNIYLLKVGKPGPNKPAIFMDCGFHAREWISHAFCQWFVREAVLTYGYESHMTEFLNKLDFYVLPVLNIDGYIYTWTKNRMWRKTRSTNAGTTCIGTDPNRNFDAGWCTTGASTDPCDETYCGSAAESEKETKALADFIRNNLSSIKAYLTIHSYSQMILYPYSYDYKLPENNAELNNLAKAAVKELATLYGTKYTYGPGATTIYPAAGGSDDWAYDQGIKYSFTFELRDKGRYGFILPESQIQATCEETMLAIKYVTNYVLGHL,./data/raw/alphafold//AF-P09955-F1-model_v4.pdb,584,2032,1435,1710 +144,3720,3797,MASMAGGPRALRALTGCLLGALVLGTLAGNALVCLAVLRFRHLRTKVTNWFVLSLAISDLCVAILVMPWKAVTEVAGGFWLFGSRFCDTWVAFDIMCSTASILHLCIISLDRYWAIASPFRYERRMTQRLACAMIAMAWALSILISFVPVQLHWHKAKDRRHPSSSCDVSLNRTYAITSSLISFYIPVAIMIVTYTRIYRIAQAQIRRISTLERAGGQWPAHSKEPASTLRSSLRKETKVLQTLSIIMGVFVCCWLPFFLLNCLLPFCQPESDSNGQSPCVGQTTFNVFVWFGWANSSVNPVIYAFNADFRRAFSNLLGCQSLCCSTPRAAVERVNLSNELVSYHQDTTCQKDGATAAIPPTTVTAWVQPEPHVVSPQQEDREELPTEERPVAAPTQAMPGSSPKCCHVTATSQLDCGADLSLETINAFTGFSRHEGHHPIPEG,sabio,Q7LZ73,CN1CC2=CC=CC=C2[C@H]3[C@H]1CC4=CNC5=CC=CC3=C45,2.4e-05,22.0,,-.-.-.-,9031.0,-4.619788758288394,-4.619788758288394,CN1CC2=CC=CC=C2[C@H]3[C@H]1CC4=CNC5=CC=CC3=C45__MASMAGGPRALRALTGCLLGALVLGTLAGNALVCLAVLRFRHLRTKVTNWFVLSLAISDLCVAILVMPWKAVTEVAGGFWLFGSRFCDTWVAFDIMCSTASILHLCIISLDRYWAIASPFRYERRMTQRLACAMIAMAWALSILISFVPVQLHWHKAKDRRHPSSSCDVSLNRTYAITSSLISFYIPVAIMIVTYTRIYRIAQAQIRRISTLERAGGQWPAHSKEPASTLRSSLRKETKVLQTLSIIMGVFVCCWLPFFLLNCLLPFCQPESDSNGQSPCVGQTTFNVFVWFGWANSSVNPVIYAFNADFRRAFSNLLGCQSLCCSTPRAAVERVNLSNELVSYHQDTTCQKDGATAAIPPTTVTAWVQPEPHVVSPQQEDREELPTEERPVAAPTQAMPGSSPKCCHVTATSQLDCGADLSLETINAFTGFSRHEGHHPIPEG,./data/raw/alphafold//AF-Q7LZ73-F1-model_v4.pdb,159,1420,733,2095 +145,3555,3629,MRPPWYPLHTPSLAFPLLFLLLSLLGGGARAEGREDPQLLVRVRGGQLRGIRLKAPGGPVSAFLGIPFAEPPVGSRRFMPPEPKRPWSGVLDATTFQNVCYQYVDTLYPGFEGTEMWNPNRELSEDCLYLNVWTPYPRPASPTPVLIWIYGGGFYSGAASLDVYDGRFLAQVEGAVLVSMNYRVGTFGFLALPGSREAPGNVGLLDQRLALQWVQENIAAFGGDPMSVTLFGESAGAASVGMHILSLPSRSLFHRAVLQSGTPNGPWATVSAGEARRRATLLARLVGCPPGGAGGNDTELIACLRTRPAQDLVDHEWHVLPQESIFRFSFVPVVDGDFLSDTPEALINTGDFQDLQVLVGVVKDEGSYFLVYGVPGFSKDNESLISRAQFLAGVRIGVPQASDLAAEAVVLHYTDWLHPEDPTHLRDAMSAVVGDHNVVCPVAQLAGRLAAQGARVYAYIFEHRASTLTWPLWMGVPHGYEIEFIFGLPLDPSLNYTTEERIFAQRLMKYWTNFARTGDPNDPRDSKSPQWPPYTTAAQQYVSLNLKPLEVRRGLRAQTCAFWNRFLPKLLSATDTLDEAERQWKAEFHRWSSYMVHWKNQFDHYSKQERCSDL,sabio,P21836,CN(C)CCCN1C2=CC=CC=C2SC3=CC=CC=C31,0.05,22.0,7.0,3.1.1.7,10090.0,-1.3010299956639813,-1.3010299956639813,CN(C)CCCN1C2=CC=CC=C2SC3=CC=CC=C31__MRPPWYPLHTPSLAFPLLFLLLSLLGGGARAEGREDPQLLVRVRGGQLRGIRLKAPGGPVSAFLGIPFAEPPVGSRRFMPPEPKRPWSGVLDATTFQNVCYQYVDTLYPGFEGTEMWNPNRELSEDCLYLNVWTPYPRPASPTPVLIWIYGGGFYSGAASLDVYDGRFLAQVEGAVLVSMNYRVGTFGFLALPGSREAPGNVGLLDQRLALQWVQENIAAFGGDPMSVTLFGESAGAASVGMHILSLPSRSLFHRAVLQSGTPNGPWATVSAGEARRRATLLARLVGCPPGGAGGNDTELIACLRTRPAQDLVDHEWHVLPQESIFRFSFVPVVDGDFLSDTPEALINTGDFQDLQVLVGVVKDEGSYFLVYGVPGFSKDNESLISRAQFLAGVRIGVPQASDLAAEAVVLHYTDWLHPEDPTHLRDAMSAVVGDHNVVCPVAQLAGRLAAQGARVYAYIFEHRASTLTWPLWMGVPHGYEIEFIFGLPLDPSLNYTTEERIFAQRLMKYWTNFARTGDPNDPRDSKSPQWPPYTTAAQQYVSLNLKPLEVRRGLRAQTCAFWNRFLPKLLSATDTLDEAERQWKAEFHRWSSYMVHWKNQFDHYSKQERCSDL,./data/raw/alphafold//AF-P21836-F1-model_v4.pdb,1716,1445,738,2056 +146,11855,12037,MCPRAARAPATLLLALGAVLWPAAGAWELTILHTNDVHSRLEQTSEDSSKCVNASRCMGGVARLFTKVQQIRRAEPNVLLLDAGDQYQGTIWFTVYKGAEVAHFMNALRYDAMALGNHEFDNGVEGLIEPLLKEAKFPILSANIKAKGPLASQISGLYLPYKVLPVGDEVVGIVGYTSKETPFLSNPGTNLVFEDEITALQPEVDKLKTLNVNKIIALGHSGFEMDKLIAQKVRGVDVVVGGHSNTFLYTGNPPSKEVPAGKYPFIVTSDDGRKVPVVQAYAFGKYLGYLKIEFDERGNVISSHGNPILLNSSIPEDPSIKADINKWRIKLDNYSTQELGKTIVYLDGSSQSCRFRECNMGNLICDAMINNNLRHTDEMFWNHVSMCILNGGGIRSPIDERNNGTITWENLAAVLPFGGTFDLVQLKGSTLKKAFEHSVHRYGQSTGEFLQVGGIHVVYDLSRKPGDRVVKLDVLCTKCRVPSYDPLKMDEVYKVILPNFLANGGDGFQMIKDELLRHDSGDQDINVVSTYISKMKVIYPAVEGRIKFSTGSHCHGSFSLIFLSLWAVIFVLYQ,brenda,P21589,c1ccc(-c2ccc(-c3nc(-c4c[nH]c5ccccc45)[nH]c3-c3ccc(-c4ccccc4)cc3)cc2)cc1,0.00053,37.0,7.0,3.1.3.5,9606.0,-3.275724130399211,-3.275724130399211,c1ccc(-c2ccc(-c3nc(-c4c[nH]c5ccccc45)[nH]c3-c3ccc(-c4ccccc4)cc3)cc2)cc1__MCPRAARAPATLLLALGAVLWPAAGAWELTILHTNDVHSRLEQTSEDSSKCVNASRCMGGVARLFTKVQQIRRAEPNVLLLDAGDQYQGTIWFTVYKGAEVAHFMNALRYDAMALGNHEFDNGVEGLIEPLLKEAKFPILSANIKAKGPLASQISGLYLPYKVLPVGDEVVGIVGYTSKETPFLSNPGTNLVFEDEITALQPEVDKLKTLNVNKIIALGHSGFEMDKLIAQKVRGVDVVVGGHSNTFLYTGNPPSKEVPAGKYPFIVTSDDGRKVPVVQAYAFGKYLGYLKIEFDERGNVISSHGNPILLNSSIPEDPSIKADINKWRIKLDNYSTQELGKTIVYLDGSSQSCRFRECNMGNLICDAMINNNLRHTDEMFWNHVSMCILNGGGIRSPIDERNNGTITWENLAAVLPFGGTFDLVQLKGSTLKKAFEHSVHRYGQSTGEFLQVGGIHVVYDLSRKPGDRVVKLDVLCTKCRVPSYDPLKMDEVYKVILPNFLANGGDGFQMIKDELLRHDSGDQDINVVSTYISKMKVIYPAVEGRIKFSTGSHCHGSFSLIFLSLWAVIFVLYQ,./data/raw/alphafold//AF-P21589-F1-model_v4.pdb,1239,850,2152,992 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+191,6284,6393,MQACCGGNSMASLQQPGRVQGSVFPPIMPPVTKFSQQLKFNISKPFRSSFLKRNLVSEMRASSVSLPNVEISSKEIPFEDYGLGEVDPEVRTIITKEKDRQFRSLELIASENFTSRAVMEAVGSCLTNKYSEGLPGKRYYGGNEYIDQLETLCQNRALAAFRLDSTKWGVNVQPLSGSPANFAVYTAILSPHDRIMGLDLPHGGHLSHGFMTAKRRVSGTSIYFESMPYRLDESTGIVDYDMLEKTATLFRPKLIIAGASAYSRDFDYPRMRKIADSVGAFLMMDMAHISGLVAASVVADPFEYCDIVTTTTHKSLRGPRGGMIFFRKDPINGVDLESAVNNAVFPGLQGGPHNHTIGGLAVCLKHAQSPEFKAYQKRVVSNCRALANRLVELGFKLVSGGSDNHLVLVDLRPMGMDGARVEKILDMASITLNKNSVPGDKSALVPGGIRIGSPAMTTRGLSEKDFVVVADFIKEGVEITMEAKKAAPGSKLQDFNKFVTSPEFPLKERVKSLKERVETFTSRFPIPGV,brenda,Q94JQ3,N=c1nc(O)c2c([nH]1)NC[C@H](CNc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1)N2,0.085,30.0,7.5,2.1.2.1,3702.0,-1.0705810742857071,-1.0705810742857071,N=c1nc(O)c2c([nH]1)NC[C@H](CNc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1)N2__MQACCGGNSMASLQQPGRVQGSVFPPIMPPVTKFSQQLKFNISKPFRSSFLKRNLVSEMRASSVSLPNVEISSKEIPFEDYGLGEVDPEVRTIITKEKDRQFRSLELIASENFTSRAVMEAVGSCLTNKYSEGLPGKRYYGGNEYIDQLETLCQNRALAAFRLDSTKWGVNVQPLSGSPANFAVYTAILSPHDRIMGLDLPHGGHLSHGFMTAKRRVSGTSIYFESMPYRLDESTGIVDYDMLEKTATLFRPKLIIAGASAYSRDFDYPRMRKIADSVGAFLMMDMAHISGLVAASVVADPFEYCDIVTTTTHKSLRGPRGGMIFFRKDPINGVDLESAVNNAVFPGLQGGPHNHTIGGLAVCLKHAQSPEFKAYQKRVVSNCRALANRLVELGFKLVSGGSDNHLVLVDLRPMGMDGARVEKILDMASITLNKNSVPGDKSALVPGGIRIGSPAMTTRGLSEKDFVVVADFIKEGVEITMEAKKAAPGSKLQDFNKFVTSPEFPLKERVKSLKERVETFTSRFPIPGV,./data/raw/alphafold//AF-Q94JQ3-F1-model_v4.pdb,963,501,1547,127 +192,11173,11341,MKESLKDRIRLWKRLYVNAFENALNAIPNVKGVLLAYNTNIDAIKYLDKDDLEKRVTEIGKEKVFEIIENPPEKISSIEELLGGILRSIKLGKAMEWFVESEEVRRYLREWGWDELRIGGQAGIMANLLGGVYRIPTIVHVPQNPKLQAELFVDGPIYVPVFEGNKLKLVHPKDAIAEEEELIHYIYEFPRGFQVFDVQAPRENRFIANADDYNARVYMRREFREGFEEITRNVELAIISGLQVLKEYYPDGTTYRDVLDRVESHLNILNRYNVKSHFEFAYTANRRVREALVELLPKFTSVGLNEVELASIMEIIGDEELAKEVLEGHIFSVIDAMNVLMDETGIERIHFHTYGYYLALTQYRGEEVRDALLFASLAAAAKAMKGNLERIEQIRDALSVPTNERAIVLEEELEKEFTEFENGLIDMVDRQLAFVPTKIVASPKSTVGIGDTISSSAFVSEFGMRKR,brenda,Q7M537,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,14.0,40.0,7.8,2.7.1.147,2265.0,1.146128035678238,1.146128035678238,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O__MKESLKDRIRLWKRLYVNAFENALNAIPNVKGVLLAYNTNIDAIKYLDKDDLEKRVTEIGKEKVFEIIENPPEKISSIEELLGGILRSIKLGKAMEWFVESEEVRRYLREWGWDELRIGGQAGIMANLLGGVYRIPTIVHVPQNPKLQAELFVDGPIYVPVFEGNKLKLVHPKDAIAEEEELIHYIYEFPRGFQVFDVQAPRENRFIANADDYNARVYMRREFREGFEEITRNVELAIISGLQVLKEYYPDGTTYRDVLDRVESHLNILNRYNVKSHFEFAYTANRRVREALVELLPKFTSVGLNEVELASIMEIIGDEELAKEVLEGHIFSVIDAMNVLMDETGIERIHFHTYGYYLALTQYRGEEVRDALLFASLAAAAKAMKGNLERIEQIRDALSVPTNERAIVLEEELEKEFTEFENGLIDMVDRQLAFVPTKIVASPKSTVGIGDTISSSAFVSEFGMRKR,./data/raw/alphafold//AF-Q7M537-F1-model_v4.pdb,1168,102,268,1558 +193,861,876,MDIISVALKRHSTKAFDASKKLTPEQAEQIKTLLQYSPSSTNSQPWHFIVASTEEGKARVAKSAAGNYVFNERKMLDASHVVVFCAKTAMDDVWLKLVVDQEDADGRFATPEAKAANDKGRKFFADMHRKDLHDDAEWMAKQVYLNVGNFLLGVAALGLDAVPIEGFDAAILDAEFGLKEKGYTSLVVVPVGHHSVEDFNATLPKSRLPQNITLTEV,sabio,P38489,CC(=O)O,7.0,25.0,,1.7.1.-,562.0,0.8450980400142568,0.8116246451989502,CC(=O)O__MDIISVALKRHSTKAFDASKKLTPEQAEQIKTLLQYSPSSTNSQPWHFIVASTEEGKARVAKSAAGNYVFNERKMLDASHVVVFCAKTAMDDVWLKLVVDQEDADGRFATPEAKAANDKGRKFFADMHRKDLHDDAEWMAKQVYLNVGNFLLGVAALGLDAVPIEGFDAAILDAEFGLKEKGYTSLVVVPVGHHSVEDFNATLPKSRLPQNITLTEV,./data/raw/alphafold//AF-P38489-F1-model_v4.pdb,992,1390,700,2053 +194,1799,1839,MAEDSGKKKRRKNFEAMFKGILQSGLDNFVINHMLKNNVAGQTSIQTLVPNTDQKSTSVKKDNHKKKTVKMLEYLGKDVLHGVFNYLAKHDVLTLKEEEKKKYYDTKIEDKALILVDSLRKNRVAHQMFTQTLLNMDQKITSVKPLLQIEAGPPESAESTNILKLCPREEFLRLCKKNHDEIYPIKKREDRRRLALIICNTKFDHLPARNGAHYDIVGMKRLLQGLGYTVVDEKNLTARDMESVLRAFAARPEHKSSDSTFLVLMSHGILEGICGTAHKKKKPDVLLYDTIFQIFNNRNCLSLKDKPKVIIVQACRGEKHGELWVRDSPASLALISSQSSENLEADSVCKIHEEKDFIAFCSSTPHNVSWRDRTRGSIFITELITCFQKYSCCCHLMEIFRKVQKSFEVPQAKAQMPTIERATLTRDFYLFPGN,uniprot_search,P51878,CC(O)=N[C@@H](C)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@H](C(O)=N[C@H](C=O)CC(=O)O)C(C)C,0.000438,25.0,7.5,3.4.22.58,9606.0,-3.3585258894959007,-3.3585258894959007,CC(O)=N[C@@H](C)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@H](C(O)=N[C@H](C=O)CC(=O)O)C(C)C__MAEDSGKKKRRKNFEAMFKGILQSGLDNFVINHMLKNNVAGQTSIQTLVPNTDQKSTSVKKDNHKKKTVKMLEYLGKDVLHGVFNYLAKHDVLTLKEEEKKKYYDTKIEDKALILVDSLRKNRVAHQMFTQTLLNMDQKITSVKPLLQIEAGPPESAESTNILKLCPREEFLRLCKKNHDEIYPIKKREDRRRLALIICNTKFDHLPARNGAHYDIVGMKRLLQGLGYTVVDEKNLTARDMESVLRAFAARPEHKSSDSTFLVLMSHGILEGICGTAHKKKKPDVLLYDTIFQIFNNRNCLSLKDKPKVIIVQACRGEKHGELWVRDSPASLALISSQSSENLEADSVCKIHEEKDFIAFCSSTPHNVSWRDRTRGSIFITELITCFQKYSCCCHLMEIFRKVQKSFEVPQAKAQMPTIERATLTRDFYLFPGN,./data/raw/alphafold//AF-P51878-F1-model_v4.pdb,420,1830,1197,2623 +195,4129,4211,MENGHHSNVFCVNENKDPLNWAAAAESLKGSHLDEVKRMVEEFRKPVVKLGGESLTIAQVAAIAARDNAVAVELAEAARDGVKASSDWVMESMNKGTDSYGVTTGFGATSHRRTKQGGALQKELIRFLNAGIFGNVTESSHTLPRSATRAAMLVRINTLLQGYSGIRFEILEAITKFLNHNITPRLPLRGTITASGDLVPLSYIAGLLTGRPNSRAVGPNGETLSANEAFKLASIDAGGFFELQPKEGLALVNGTAVGSGLAAIALYDANVLCLLSEVMSAVFAEVMNGKPEFTDHLTHKLKHHPGQIEAAAIMEHILDGSSYVKAAQKLHDMDPLQKPKQDRYALRTSPQWLGPQIEVIRTATKMIEREINSVNDNPLIDVSRNKALHGGNFQGTPIGVSMDNARLAIASIGKLMFAQFSELVNDFYNNGLPSNLSGGRDPSLDYGFKGAEIAMASYCSELQFLANPVTNHVQSAEQHNQDVNSLGLISSRKTVEALDILKLMSSTYLVALCQAVDLRHLEENLRLAVKNTVGQACKKTLTIGANGELHPSRFCEKDLLRVVDREYVFAYVDDPCSGTYPLMEKLRQVLVDHALENGESEKNEKTSIFQKIRAFEDELRALLPKEVESARIGVESGKPAIGNRIKECRSYPLYKFIREELGAEYLTGEGVISPGEECEKVFVALSKGLVVDPLLKCVEGWNGAPLPIC,brenda,D3Y5L6,COc1cc(/C=C/CO)ccc1O,0.032,55.0,8.5,4.3.1.24,161395.0,-1.494850021680094,-1.494850021680094,COc1cc(/C=C/CO)ccc1O__MENGHHSNVFCVNENKDPLNWAAAAESLKGSHLDEVKRMVEEFRKPVVKLGGESLTIAQVAAIAARDNAVAVELAEAARDGVKASSDWVMESMNKGTDSYGVTTGFGATSHRRTKQGGALQKELIRFLNAGIFGNVTESSHTLPRSATRAAMLVRINTLLQGYSGIRFEILEAITKFLNHNITPRLPLRGTITASGDLVPLSYIAGLLTGRPNSRAVGPNGETLSANEAFKLASIDAGGFFELQPKEGLALVNGTAVGSGLAAIALYDANVLCLLSEVMSAVFAEVMNGKPEFTDHLTHKLKHHPGQIEAAAIMEHILDGSSYVKAAQKLHDMDPLQKPKQDRYALRTSPQWLGPQIEVIRTATKMIEREINSVNDNPLIDVSRNKALHGGNFQGTPIGVSMDNARLAIASIGKLMFAQFSELVNDFYNNGLPSNLSGGRDPSLDYGFKGAEIAMASYCSELQFLANPVTNHVQSAEQHNQDVNSLGLISSRKTVEALDILKLMSSTYLVALCQAVDLRHLEENLRLAVKNTVGQACKKTLTIGANGELHPSRFCEKDLLRVVDREYVFAYVDDPCSGTYPLMEKLRQVLVDHALENGESEKNEKTSIFQKIRAFEDELRALLPKEVESARIGVESGKPAIGNRIKECRSYPLYKFIREELGAEYLTGEGVISPGEECEKVFVALSKGLVVDPLLKCVEGWNGAPLPIC,./data/raw/alphafold//AF-D3Y5L6-F1-model_v4.pdb,1335,599,2287,193 +196,6025,6130,MSAVEELRAQIDALASQISAVKKEQGASSEACKSLVAKMTELRKQLPQEKKEKKAEKAPEISYYDTRLAMVKEMGPLGAAYPHKFHRDYTLPAFRECFKPMLQEKGQRLDKVVTIAGRIVVKRSSSSKLHFLALQGDGEVLQVISMASDYVNDGFADIHSKIKRGDIIGVRGVPSFSNTGEFSMSAYEITLLSTCFHMLPDEHYGLSSVEQRFRQRYLDLIVNRENAKTFILRSKIISYIRSFFDQKDFLEVETPMLNQIAGGAAARPFITHHNELNQTMYLRIAPELYLKKLVVGGLDRVYEIGKQFRNEGIDLTHNPEFTSVESYWAYADYNDWMETTEELLYGMVMHLYGSPIVKYSPRDSEGRQLPEVTFNFNRPFKRLHIVPKLEEILGLKFPADFYSSEANSFFLDICKKNQVECNPPFTTTRLLDALVSHYLEPQCHDPTFLCDHPRIMSPLAKWHRKDLRLSERFELFINKKEICNSYTELNSPLVQREEFERQLRDREKGDDEAMDIDEGYVQALEYALPPTGGWGLGIDRLVMYLTSQNNIKEVLLFPAMKPEGTSSATFPPGTMLNGQGVPLL,brenda,Q580G3,N=C(O)[C@@H]1C[C@@H](OS(=O)(=O)N=C(O)C(N)CCCCN)CN1C(=O)Cn1cnc2c(N)ncnc21,0.02761,37.0,7.5,6.1.1.6,5691.0,-1.558933593360737,-1.558933593360737,N=C(O)[C@@H]1C[C@@H](OS(=O)(=O)N=C(O)C(N)CCCCN)CN1C(=O)Cn1cnc2c(N)ncnc21__MSAVEELRAQIDALASQISAVKKEQGASSEACKSLVAKMTELRKQLPQEKKEKKAEKAPEISYYDTRLAMVKEMGPLGAAYPHKFHRDYTLPAFRECFKPMLQEKGQRLDKVVTIAGRIVVKRSSSSKLHFLALQGDGEVLQVISMASDYVNDGFADIHSKIKRGDIIGVRGVPSFSNTGEFSMSAYEITLLSTCFHMLPDEHYGLSSVEQRFRQRYLDLIVNRENAKTFILRSKIISYIRSFFDQKDFLEVETPMLNQIAGGAAARPFITHHNELNQTMYLRIAPELYLKKLVVGGLDRVYEIGKQFRNEGIDLTHNPEFTSVESYWAYADYNDWMETTEELLYGMVMHLYGSPIVKYSPRDSEGRQLPEVTFNFNRPFKRLHIVPKLEEILGLKFPADFYSSEANSFFLDICKKNQVECNPPFTTTRLLDALVSHYLEPQCHDPTFLCDHPRIMSPLAKWHRKDLRLSERFELFINKKEICNSYTELNSPLVQREEFERQLRDREKGDDEAMDIDEGYVQALEYALPPTGGWGLGIDRLVMYLTSQNNIKEVLLFPAMKPEGTSSATFPPGTMLNGQGVPLL,./data/raw/alphafold//AF-Q580G3-F1-model_v4.pdb,926,458,1818,534 +197,6370,6479,QDWLTFQKKHITNTRDVDCDNIMSTNLFHCKDKNTFIYSRPEPVKAICKGIIASKNVLTTSEFYLSDCNVTSRPCKYKLKKSTNKFCVTCENQAPVHFVGVGSC,brenda,P22069,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1,6.7e-05,,7.25,4.6.1.18,8404.0,-4.173925197299174,-4.173925197299174,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1__QDWLTFQKKHITNTRDVDCDNIMSTNLFHCKDKNTFIYSRPEPVKAICKGIIASKNVLTTSEFYLSDCNVTSRPCKYKLKKSTNKFCVTCENQAPVHFVGVGSC,./data/raw/alphafold//AF-P22069-F1-model_v4.pdb,978,520,1883,601 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+200,2320,2379,MDLWNLSWFLFLDALLVISGLATPENFDVDGGMDQDIFDINEGLGLDLFEGDIRLDRAQIRNSIIGEKYRWPHTIPYVLEDSLEMNAKGVILNAFERYRLKTCIDFKPWAGETNYISVFKGSGCWSSVGNRRVGKQELSIGANCDRIATVQHEFLHALGFWHEQSRSDRDDYVRIMWDRILSGREHNFNTYSDDISDSLNVPYDYTSVMHYSKTAFQNGTEPTIVTRISDFEDVIGQRMDFSDSDLLKLNQLYNCSSSLSFMDSCSFELENVCGMIQSSGDNADWQRVSQVPRGPESDHSNMGQCQGSGFFMHFDSSSVNVGATAVLESRTLYPKRGFQCLQFYLYNSGSESDQLNIYIREYSADNVDGNLTLVEEIKEIPTGSWQLYHVTLKVTKKFRVVFEGRKGSGASLGGLSIDDINLSETRCPHHIWHIRNFTQFIGSPNGTLYSPPFYSSKGYAFQIYLNLAHVTNAGIYFHLISGANDDQLQWPCPWQQATMTLLDQNPDIRQRMSNQRSITTDPFMTTDNGNYFWDRPSKVGTVALFSNGTQFRRGGGYGTSAFITHERLKSRDFIKGDDVYILLTVEDISHLNSTQIQLTPAPSVQDLCSKTTCKNDGVCTVRDGKAECRCQSGEDWWYMGERCEKRGSTRDTIVIAVSSTVAVFALMLIITLVSVYCTRKKYRERMSSNRPNLTPQNQHAF,brenda,Q16820,CCC(C)[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCSC)N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)CN=C(O)[C@H](CCSC)N=C(O)c1ccccc1N)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=N[C@@H](CO)C(O)=NCC(=O)O,52.9,37.0,8.0,3.4.24.63,9606.0,1.7234556720351857,1.7234556720351857,CCC(C)[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCSC)N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)CN=C(O)[C@H](CCSC)N=C(O)c1ccccc1N)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=N[C@@H](CO)C(O)=NCC(=O)O__MDLWNLSWFLFLDALLVISGLATPENFDVDGGMDQDIFDINEGLGLDLFEGDIRLDRAQIRNSIIGEKYRWPHTIPYVLEDSLEMNAKGVILNAFERYRLKTCIDFKPWAGETNYISVFKGSGCWSSVGNRRVGKQELSIGANCDRIATVQHEFLHALGFWHEQSRSDRDDYVRIMWDRILSGREHNFNTYSDDISDSLNVPYDYTSVMHYSKTAFQNGTEPTIVTRISDFEDVIGQRMDFSDSDLLKLNQLYNCSSSLSFMDSCSFELENVCGMIQSSGDNADWQRVSQVPRGPESDHSNMGQCQGSGFFMHFDSSSVNVGATAVLESRTLYPKRGFQCLQFYLYNSGSESDQLNIYIREYSADNVDGNLTLVEEIKEIPTGSWQLYHVTLKVTKKFRVVFEGRKGSGASLGGLSIDDINLSETRCPHHIWHIRNFTQFIGSPNGTLYSPPFYSSKGYAFQIYLNLAHVTNAGIYFHLISGANDDQLQWPCPWQQATMTLLDQNPDIRQRMSNQRSITTDPFMTTDNGNYFWDRPSKVGTVALFSNGTQFRRGGGYGTSAFITHERLKSRDFIKGDDVYILLTVEDISHLNSTQIQLTPAPSVQDLCSKTTCKNDGVCTVRDGKAECRCQSGEDWWYMGERCEKRGSTRDTIVIAVSSTVAVFALMLIITLVSVYCTRKKYRERMSSNRPNLTPQNQHAF,./data/raw/alphafold//AF-Q16820-F1-model_v4.pdb,369,1768,1127,2543 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+281,6190,6298,MCAARMPPLAHIFRGTFVHSTWTCPMEVLRDHLLGVSDSGKIVFLEEASQQERLAKEWCFKPCEIRELSHHEFFMPGLVDTHIHAPQYFFAGSNVDLPLLEWLAKYTFPSEHKFRNIDFAEEVYTRVVRRTLKNGTTTACYFGTIHTDSSLLLAEITDKFGQRAFVGKVCMDLNDTVPEYKETTEESIKETERFVSEMFQRNYPRVKPIVTPRFSLSCSETLLVELGNIAKTHDLHIQSHISENRDEIEAVKNLYPSYKNYTDVYDKNKLLTNKTVMAHGCYLSAEELNTFSERGASISHCPNSNLSLSSGFLNVLEVLKHEVKIGLGTDIAGGYSSSMLDAIRRAVMVSNILLINKVNEKSLTLKEVFRLATLGGSQALGLDNEIGNFEVGKEFDALLINPKASDSPIDLFYGDFVGDISEAVIQKFLYLGDDRNIEEVYVGGKQVVPFSSSV,uniprot_search,G1T386,N=c1[nH]c2ncnc-2c(N)[nH]1,0.00188,25.0,7.4,3.5.4.3,9986.0,-2.72584215073632,-2.72584215073632,N=c1[nH]c2ncnc-2c(N)[nH]1__MCAARMPPLAHIFRGTFVHSTWTCPMEVLRDHLLGVSDSGKIVFLEEASQQERLAKEWCFKPCEIRELSHHEFFMPGLVDTHIHAPQYFFAGSNVDLPLLEWLAKYTFPSEHKFRNIDFAEEVYTRVVRRTLKNGTTTACYFGTIHTDSSLLLAEITDKFGQRAFVGKVCMDLNDTVPEYKETTEESIKETERFVSEMFQRNYPRVKPIVTPRFSLSCSETLLVELGNIAKTHDLHIQSHISENRDEIEAVKNLYPSYKNYTDVYDKNKLLTNKTVMAHGCYLSAEELNTFSERGASISHCPNSNLSLSSGFLNVLEVLKHEVKIGLGTDIAGGYSSSMLDAIRRAVMVSNILLINKVNEKSLTLKEVFRLATLGGSQALGLDNEIGNFEVGKEFDALLINPKASDSPIDLFYGDFVGDISEAVIQKFLYLGDDRNIEEVYVGGKQVVPFSSSV,./data/raw/alphafold//AF-G1T386-F1-model_v4.pdb,441,1853,1223,2650 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+297,4368,4452,MTDLEKPNLAGHMFDVGLIGGGISGLAAAKLLSEYKINVLVLEARDRVGGRTYTVRNEHVKWVDVGGAYVGPTQNRILRLSKELGIETYKVNVNERLVQYVKGKTYPFRGAFPPVWNPLAYLDYNNLWRTMDEMGKEIPVDAPWQARHAQEWDKMTMKDLIDKICWTKTAREFAYLFVNINVTSEPHEVSALWFLWYVRQCGGTARIFSVTNGGQERKFVGGSGQVSEQIMGLLGDKVKLSSPVTYIDQTDDNIIVETLNHEHYECKYVISAIPPILTAKIHFKPELPPERNQLIQRLPMGAVIKCMVYYKEAFWKKKDYCGCMIIEDEEAPIAITLDDTKPDGSLPAIMGFILARKADRQAKLHKDIRKRKICELYAKVLGSQEALYPVHYEEKNWCEEQYSGGCYTAYFPPGIMTQYGRVIRQPVGRIYFAGTETATQWSGYMEGAVEAGERAAREVLNALGKVAKKDIWVEEPESKDVPAIEITHTFLERNLPSVPGLLKITGVSTSVALLCFVLYKIKKLPC,brenda,P21396,COc1ccc2cc(CC(C)N)ccc2c1,0.00018,30.666666666666668,7.6,1.4.3.4,10116.0,-3.744727494896694,-3.744727494896694,COc1ccc2cc(CC(C)N)ccc2c1__MTDLEKPNLAGHMFDVGLIGGGISGLAAAKLLSEYKINVLVLEARDRVGGRTYTVRNEHVKWVDVGGAYVGPTQNRILRLSKELGIETYKVNVNERLVQYVKGKTYPFRGAFPPVWNPLAYLDYNNLWRTMDEMGKEIPVDAPWQARHAQEWDKMTMKDLIDKICWTKTAREFAYLFVNINVTSEPHEVSALWFLWYVRQCGGTARIFSVTNGGQERKFVGGSGQVSEQIMGLLGDKVKLSSPVTYIDQTDDNIIVETLNHEHYECKYVISAIPPILTAKIHFKPELPPERNQLIQRLPMGAVIKCMVYYKEAFWKKKDYCGCMIIEDEEAPIAITLDDTKPDGSLPAIMGFILARKADRQAKLHKDIRKRKICELYAKVLGSQEALYPVHYEEKNWCEEQYSGGCYTAYFPPGIMTQYGRVIRQPVGRIYFAGTETATQWSGYMEGAVEAGERAAREVLNALGKVAKKDIWVEEPESKDVPAIEITHTFLERNLPSVPGLLKITGVSTSVALLCFVLYKIKKLPC,./data/raw/alphafold//AF-P21396-F1-model_v4.pdb,21,1247,535,1847 +298,11836,12018,MALLLPLAVLLAACRPGHGFSGGCDTCGLRPVAYHYGGMRVVGGTEALHGSWPWIVSIQNPRFAGTGHMCGGSLITPQWVLSAAHCFGRPNYILQSRVVIGANDLTQLGQEVEVRSIRRAILHEYFNNKTMINDIALLELDRPVHCSYYIQLACVPDPSLRVSELTDCYVSGWGHMGMRSAAPTQTAEVLQEAKVHLLDLNLCNSSHWYDGVLHSHNLCAGYPQGGIDTCQGDSGGPLMCRDSSADYFWLVGVTSWGRGCGRAFRPGIYTSTQHFYNWILLQVRAAAHPTSRTWSHYMSTSSYHHGPNAVPTQPSVSDSCPFPAQKLREFFTGVQNLLQSLWGSKA,sabio,Q2UVH8,[Zn],0.408,25.0,8.0,3.4.21.10,9103.0,-0.3893398369101201,-0.3893398369101201,[Zn]__MALLLPLAVLLAACRPGHGFSGGCDTCGLRPVAYHYGGMRVVGGTEALHGSWPWIVSIQNPRFAGTGHMCGGSLITPQWVLSAAHCFGRPNYILQSRVVIGANDLTQLGQEVEVRSIRRAILHEYFNNKTMINDIALLELDRPVHCSYYIQLACVPDPSLRVSELTDCYVSGWGHMGMRSAAPTQTAEVLQEAKVHLLDLNLCNSSHWYDGVLHSHNLCAGYPQGGIDTCQGDSGGPLMCRDSSADYFWLVGVTSWGRGCGRAFRPGIYTSTQHFYNWILLQVRAAAHPTSRTWSHYMSTSSYHHGPNAVPTQPSVSDSCPFPAQKLREFFTGVQNLLQSLWGSKA,./data/raw/alphafold//AF-Q2UVH8-F1-model_v4.pdb,112,1362,665,2005 +299,9383,9532,MKIAIAGAGAMGGRFGSMLSTTENPVTFIDLWAQHVQAINAHGLLVHTDHGDERVHVPAYLPQDVHGSFDLIVLFTKAMGIAPMLTALKPVITPQTHILVLGNGIGNIETISRFVPKDQIIAGVTVWSAALNGPGEITMKGDGGVTLEALGSNEAPFFKQVVQVLQDAGLKPTASHDVLAAIWRKAALNSVLNTYCTILDCNIGEFGQLPDHDAMIDGVLSEFSQIAAKQHVHFDAADTKQLIVAQFPDGKNGLHYPSMHQDMAKGRKTEIDFLNGYIAKVGAREHIATPINAMLTALVHSKEKLNELQSSREKVATPV,brenda,A0A5P8Q188,O=C(O)[C@H](O)c1ccccc1,26.4,30.0,9.5,1.1.1.379,304207.0,1.421603926869831,1.421603926869831,O=C(O)[C@H](O)c1ccccc1__MKIAIAGAGAMGGRFGSMLSTTENPVTFIDLWAQHVQAINAHGLLVHTDHGDERVHVPAYLPQDVHGSFDLIVLFTKAMGIAPMLTALKPVITPQTHILVLGNGIGNIETISRFVPKDQIIAGVTVWSAALNGPGEITMKGDGGVTLEALGSNEAPFFKQVVQVLQDAGLKPTASHDVLAAIWRKAALNSVLNTYCTILDCNIGEFGQLPDHDAMIDGVLSEFSQIAAKQHVHFDAADTKQLIVAQFPDGKNGLHYPSMHQDMAKGRKTEIDFLNGYIAKVGAREHIATPINAMLTALVHSKEKLNELQSSREKVATPV,./data/raw/alphafold//AF-A0A5P8Q188-F1-model_v4.pdb,1387,1041,2366,1226 +300,10867,11027,MGFKVKLEKRRNAINTCLCIGLDPDEKDIENFMKNEKENNYNNIKKNLKEKYINNVSIKKDILLKAPDNIIREEKSEEFFYFFNHFCFYIINETNKYALTFKMNFAFYIPYGSVGIDVLKNVFDYLYELNIPTILDMKINDIGNTVKNYRKFIFEYLKSDSCTVNIYMGTNMLKDICYDEEKNKYYSAFVLVKTTNPDSAIFQKNLSLDNKQAYVIMAQEALNMSSYLNLEQNNEFIGFVVGANSYDEMNYIRTYFPNCYILSPGIGAQNGDLHKTLTNGYHKSYEKILINIGRAITKNPYPQKAAQMYYDQINAILKQNMES,uniprot_search,Q8T6J6,O=c1nc(O)cnn1[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O,0.14,37.0,7.5,4.1.1.23,5833.0,-0.8538719643217619,-2.907210570292232,O=c1nc(O)cnn1[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O__MGFKVKLEKRRNAINTCLCIGLDPDEKDIENFMKNEKENNYNNIKKNLKEKYINNVSIKKDILLKAPDNIIREEKSEEFFYFFNHFCFYIINETNKYALTFKMNFAFYIPYGSVGIDVLKNVFDYLYELNIPTILDMKINDIGNTVKNYRKFIFEYLKSDSCTVNIYMGTNMLKDICYDEEKNKYYSAFVLVKTTNPDSAIFQKNLSLDNKQAYVIMAQEALNMSSYLNLEQNNEFIGFVVGANSYDEMNYIRTYFPNCYILSPGIGAQNGDLHKTLTNGYHKSYEKILINIGRAITKNPYPQKAAQMYYDQINAILKQNMES,./data/raw/alphafold//AF-Q8T6J6-F1-model_v4.pdb,826,337,413,390 +301,7816,7946,MQACCGGNSMASLQQPGRVQGSVFPPIMPPVTKFSQQLKFNISKPFRSSFLKRNLVSEMRASSVSLPNVEISSKEIPFEDYGLGEVDPEVRTIITKEKDRQFRSLELIASENFTSRAVMEAVGSCLTNKYSEGLPGKRYYGGNEYIDQLETLCQNRALAAFRLDSTKWGVNVQPLSGSPANFAVYTAILSPHDRIMGLDLPHGGHLSHGFMTAKRRVSGTSIYFESMPYRLDESTGIVDYDMLEKTATLFRPKLIIAGASAYSRDFDYPRMRKIADSVGAFLMMDMAHISGLVAASVVADPFEYCDIVTTTTHKSLRGPRGGMIFFRKDPINGVDLESAVNNAVFPGLQGGPHNHTIGGLAVCLKHAQSPEFKAYQKRVVSNCRALANRLVELGFKLVSGGSDNHLVLVDLRPMGMDGARVEKILDMASITLNKNSVPGDKSALVPGGIRIGSPAMTTRGLSEKDFVVVADFIKEGVEITMEAKKAAPGSKLQDFNKFVTSPEFPLKERVKSLKERVETFTSRFPIPGV,sabio,Q94JQ3,Nc1nc2c(c(=O)[nH]1)N(C=O)[C@@H](CNc1ccc(C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)cc1)CN2,0.00496,30.0,8.5,2.1.2.1,3702.0,-2.3045183235098023,-2.3045183235098023,Nc1nc2c(c(=O)[nH]1)N(C=O)[C@@H](CNc1ccc(C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)cc1)CN2__MQACCGGNSMASLQQPGRVQGSVFPPIMPPVTKFSQQLKFNISKPFRSSFLKRNLVSEMRASSVSLPNVEISSKEIPFEDYGLGEVDPEVRTIITKEKDRQFRSLELIASENFTSRAVMEAVGSCLTNKYSEGLPGKRYYGGNEYIDQLETLCQNRALAAFRLDSTKWGVNVQPLSGSPANFAVYTAILSPHDRIMGLDLPHGGHLSHGFMTAKRRVSGTSIYFESMPYRLDESTGIVDYDMLEKTATLFRPKLIIAGASAYSRDFDYPRMRKIADSVGAFLMMDMAHISGLVAASVVADPFEYCDIVTTTTHKSLRGPRGGMIFFRKDPINGVDLESAVNNAVFPGLQGGPHNHTIGGLAVCLKHAQSPEFKAYQKRVVSNCRALANRLVELGFKLVSGGSDNHLVLVDLRPMGMDGARVEKILDMASITLNKNSVPGDKSALVPGGIRIGSPAMTTRGLSEKDFVVVADFIKEGVEITMEAKKAAPGSKLQDFNKFVTSPEFPLKERVKSLKERVETFTSRFPIPGV,./data/raw/alphafold//AF-Q94JQ3-F1-model_v4.pdb,963,501,1547,127 +302,367,374,MMRKSLCCALLLGISCSALATPVSEKQLAEVVANTITPLMKAQSVPGMAVAVIYQGKPHYYTFGKADIAANKPVTPQTLFELGSISKTFTGVLGGDAIARGEISLDDAVTRYWPQLTGKQWQGIRMLDLATYTAGGLPLQVPDEVTDNASLLRFYQNWQPQWKPGTTRLYANASIGLFGALAVKPSGMPYEQAMTTRVLKPLKLDHTWINVPKAEEAHYAWGYRDGKAVRVSPGMLDAQAYGVKTNVQDMANWVMANMAPENVADASLKQGIALAQSRYWRIGSMYQGLGWEMLNWPVEANTVVEGSDSKVALAPLPVAEVNPPAPPVKASWVHKTGSTGGFGSYVAFIPEKQIGIVMLANTSYPNPARVEAAYHILEALQ,sabio,P05364,C1=CC=C(C=C1)COP(=O)(CC(=O)C2=CC=CC=C2)[O-].[Na+],0.67,25.0,7.5,3.5.2.6,550.0,-0.1739251972991735,-0.1739251972991735,C1=CC=C(C=C1)COP(=O)(CC(=O)C2=CC=CC=C2)[O-].[Na+]__MMRKSLCCALLLGISCSALATPVSEKQLAEVVANTITPLMKAQSVPGMAVAVIYQGKPHYYTFGKADIAANKPVTPQTLFELGSISKTFTGVLGGDAIARGEISLDDAVTRYWPQLTGKQWQGIRMLDLATYTAGGLPLQVPDEVTDNASLLRFYQNWQPQWKPGTTRLYANASIGLFGALAVKPSGMPYEQAMTTRVLKPLKLDHTWINVPKAEEAHYAWGYRDGKAVRVSPGMLDAQAYGVKTNVQDMANWVMANMAPENVADASLKQGIALAQSRYWRIGSMYQGLGWEMLNWPVEANTVVEGSDSKVALAPLPVAEVNPPAPPVKASWVHKTGSTGGFGSYVAFIPEKQIGIVMLANTSYPNPARVEAAYHILEALQ,./data/raw/alphafold//AF-P05364-F1-model_v4.pdb,616,2068,514,1816 +303,9665,9815,MPKLVLVRHGQSEWNEKNLFTGWVDVKLSAKGQQEAARAGELLKEKKVYPDVLYTSKLSRAIQTANIALEKADRLWIPVNRSWRLNERHYGDLQGKDKAETLKKFGEEKFNTYRRSFDVPPPPIDASSPFSQKGDERYKYVDPNVLPETESLALVIDRLLPYWQDVIAKDLLSGKTVMIAAHGNSLRGLVKHLEGISDADIAKLNIPTGIPLVFELDENLKPSKPSYYLDPEAAAAGAAAVANQGKK,brenda,P00950,O=C([O-])c1cc(C(=O)[O-])cc(C(=O)[O-])c1,0.024,30.0,7.45,5.4.2.11,4932.0,-1.619788758288394,-1.619788758288394,O=C([O-])c1cc(C(=O)[O-])cc(C(=O)[O-])c1__MPKLVLVRHGQSEWNEKNLFTGWVDVKLSAKGQQEAARAGELLKEKKVYPDVLYTSKLSRAIQTANIALEKADRLWIPVNRSWRLNERHYGDLQGKDKAETLKKFGEEKFNTYRRSFDVPPPPIDASSPFSQKGDERYKYVDPNVLPETESLALVIDRLLPYWQDVIAKDLLSGKTVMIAAHGNSLRGLVKHLEGISDADIAKLNIPTGIPLVFELDENLKPSKPSYYLDPEAAAAGAAAVANQGKK,./data/raw/alphafold//AF-P00950-F1-model_v4.pdb,1411,1071,2398,1262 +304,5913,6012,MHLKIVCLSDEVREMYKNHKTHHEGDSGLDLFIVKDEVLKPKSTTFVKLGIKAIALQYKSNYYYKCEKSENKKKDDDKSNIVNTSFLLFPRSSISKTPLRLANSIGLIDAGYRGEIIAALDNTSDQEYHIKKNDKLVQLVSFTGEPLSFELVEELDETSRGEGGFGSTSNNKY,brenda,Q8II92,N=C(O)C(CCNC(c1ccccc1)(c1ccccc1)c1ccccc1)Cn1ccc(O)nc1=O,0.0055,25.0,5.95,3.6.1.23,5833.0,-2.2596373105057563,-2.2596373105057563,N=C(O)C(CCNC(c1ccccc1)(c1ccccc1)c1ccccc1)Cn1ccc(O)nc1=O__MHLKIVCLSDEVREMYKNHKTHHEGDSGLDLFIVKDEVLKPKSTTFVKLGIKAIALQYKSNYYYKCEKSENKKKDDDKSNIVNTSFLLFPRSSISKTPLRLANSIGLIDAGYRGEIIAALDNTSDQEYHIKKNDKLVQLVSFTGEPLSFELVEELDETSRGEGGFGSTSNNKY,./data/raw/alphafold//AF-Q8II92-F1-model_v4.pdb,268,1640,985,2381 +305,11742,11924,MEDRRESELKTFCSKNILVILGFSSIIAVIALLALGLTQNKPLPENVKFGIVLDAGSSHTSLYIYKWPAEKENDTGVVSQVEECKLKGPGISEFAKKLGEIDIYLEACMERARTVVPKSQHAETPVYLGATAGMRLLRMKNENLASKILSTVAESITRYPFDFQGARIITGQEEGAYGWITINYLLDKFIQKSGWFNLKPRKGDTQETYGALDLGGASTQITFVPQNQVLESPENTLHFRLYGKNYSVYTHSFLCYGKDQALLQKLTKDLKNTNGTIHEPCFHSGYQRRMNVSHLYEAPCTRRFLTSLPFPELEIQGTGDFQKCQQSIRPLFNTSYCPYSRCSFDGVFLPLPQGDFAAFSAFYYVMGFLNLTSEEGSFQSKVTSTLEAFCSRPWAELQMYFGDVKEKYLSEYCFSGTYILTLLLSGYHFTAETWKNIHFMGKVQSTSVGWTLGYMLNLTNMIPSEEPSSTRLSHSTYVFLMVLFSLILVIVVIIGLFVCHRPSYFWKDMV,sabio,Q9MYU4,[N-]=[N+]=[N-],12.0,37.0,7.6,3.6.1.5,9823.0,1.0791812460476249,1.1437879213863291,[N-]=[N+]=[N-]__MEDRRESELKTFCSKNILVILGFSSIIAVIALLALGLTQNKPLPENVKFGIVLDAGSSHTSLYIYKWPAEKENDTGVVSQVEECKLKGPGISEFAKKLGEIDIYLEACMERARTVVPKSQHAETPVYLGATAGMRLLRMKNENLASKILSTVAESITRYPFDFQGARIITGQEEGAYGWITINYLLDKFIQKSGWFNLKPRKGDTQETYGALDLGGASTQITFVPQNQVLESPENTLHFRLYGKNYSVYTHSFLCYGKDQALLQKLTKDLKNTNGTIHEPCFHSGYQRRMNVSHLYEAPCTRRFLTSLPFPELEIQGTGDFQKCQQSIRPLFNTSYCPYSRCSFDGVFLPLPQGDFAAFSAFYYVMGFLNLTSEEGSFQSKVTSTLEAFCSRPWAELQMYFGDVKEKYLSEYCFSGTYILTLLLSGYHFTAETWKNIHFMGKVQSTSVGWTLGYMLNLTNMIPSEEPSSTRLSHSTYVFLMVLFSLILVIVVIIGLFVCHRPSYFWKDMV,./data/raw/alphafold//AF-Q9MYU4-F1-model_v4.pdb,127,1394,683,2032 +306,8474,8610,MPSAQIIDGKAIAAAIRSELKDKVAALRELYGGRVPGLASIIVGQRMDSKKYVQLKHKAAAEVGMASFNVELPEDISQEVLEVNVEKLNNDPNCHGIIVQLPLPKHLNENRAIEKIHPHKDADALLPVNVGLLHYKGREPPFTPCTAKGVIVLLKRCGIEMAGKRAVVLGRSNIVGAPVAALLMKENATVTIVHSGTSTEDMIDYLRTADIVIAAMGQPGYVKGEWIKEGAAVVDVGTTPVPDPSRKDGYRLVGDVCFEEAAARAAWISPVPGGVGPMTIAMLLENTLEAFKAALGVS,brenda,Q4Q9F9,Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)CP(=O)(O)OP(=O)(O)CP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)C[C@@H]2O)O1,0.051,37.0,7.3,3.5.4.9,5664.0,-1.2924298239020635,-1.2924298239020635,Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)CP(=O)(O)OP(=O)(O)CP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)C[C@@H]2O)O1__MPSAQIIDGKAIAAAIRSELKDKVAALRELYGGRVPGLASIIVGQRMDSKKYVQLKHKAAAEVGMASFNVELPEDISQEVLEVNVEKLNNDPNCHGIIVQLPLPKHLNENRAIEKIHPHKDADALLPVNVGLLHYKGREPPFTPCTAKGVIVLLKRCGIEMAGKRAVVLGRSNIVGAPVAALLMKENATVTIVHSGTSTEDMIDYLRTADIVIAAMGQPGYVKGEWIKEGAAVVDVGTTPVPDPSRKDGYRLVGDVCFEEAAARAAWISPVPGGVGPMTIAMLLENTLEAFKAALGVS,./data/raw/alphafold//AF-Q4Q9F9-F1-model_v4.pdb,962,499,1862,580 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+370,10661,10818,MDLLLIEKTLVALFAAIIGAILISKLRGKKFKLPPGPIPVPIFGNWLQVGDDLNHRNLTDLAKRFGEILLLRMGQRNLVVVSSPELAKEVLHTQGVEFGSRTRNVVFDIFTGKGQDMVFTVYGEHWRKMRRIMTVPFFTNKVVQQYRYGWEAEAAAVVDDVKKNPAAATEGIVIRRRLQLMMYNNMFRIMFDRRFESEDDPLFLKLKALNGERSRLAQSFEYNYGDFIPILRPFLRNYLKLCKEVKDKRIQLFKDYFVDERKKIGSTKKMDNNQLKCAIDHILEAKEKGEINEDNVLYIVENINVAAIETTLWSIEWGIAELVNHPEIQAKLRHELDTKLGPGVQITEPDVQNLPYLQAVVKETLRLRMAIPLLVPHMNLHDAKLGGFDIPAESKILVNAWWLANNPDQWKKPEEFRPERFLEEEAKVEANGNDFRYLPFGVGRRSCPGIILALPILGITIGRLVQNFELLPPPGQSKIDTDEKGGQFSLHILKHSTIVAKPRSF,brenda,Q04468,O=c1ccc2cc3ccoc3cc2o1,0.0054,30.0,7.199999999999999,1.14.14.91,4233.0,-2.2676062401770314,-2.2676062401770314,O=c1ccc2cc3ccoc3cc2o1__MDLLLIEKTLVALFAAIIGAILISKLRGKKFKLPPGPIPVPIFGNWLQVGDDLNHRNLTDLAKRFGEILLLRMGQRNLVVVSSPELAKEVLHTQGVEFGSRTRNVVFDIFTGKGQDMVFTVYGEHWRKMRRIMTVPFFTNKVVQQYRYGWEAEAAAVVDDVKKNPAAATEGIVIRRRLQLMMYNNMFRIMFDRRFESEDDPLFLKLKALNGERSRLAQSFEYNYGDFIPILRPFLRNYLKLCKEVKDKRIQLFKDYFVDERKKIGSTKKMDNNQLKCAIDHILEAKEKGEINEDNVLYIVENINVAAIETTLWSIEWGIAELVNHPEIQAKLRHELDTKLGPGVQITEPDVQNLPYLQAVVKETLRLRMAIPLLVPHMNLHDAKLGGFDIPAESKILVNAWWLANNPDQWKKPEEFRPERFLEEEAKVEANGNDFRYLPFGVGRRSCPGIILALPILGITIGRLVQNFELLPPPGQSKIDTDEKGGQFSLHILKHSTIVAKPRSF,./data/raw/alphafold//AF-Q04468-F1-model_v4.pdb,702,2175,1600,184 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+372,6018,6122,MAQADIALIGLAVMGQNLILNMNDHGFVVCAFNRTVSKVDDFLANEAKGTKVLGAHSLEEMVSKLKKPRRIILLVKAGQAVDNFIEKLVPLLDIGDIIIDGGNSEYRDTMRRCRDLKDKGILFVGSGVSGGEDGARYGPSLMPGGNKEAWPHIKAIFQGIAAKVGTGEPCCDWVGDDGAGHFVKMVHNGIEYGDMQLICEAYHLMKDVLGLGHKEMAKAFEEWNKTELDSFLIEITASILKFQDADGKHLLPKIRDSAGQKGTGKWTAISALEYGVPVTLIGEAVFARCLSSLKDERIQASKKLKGPQNIPFEGDKKSFLEDIRKALYASKIISYAQGFMLLRQAATEFGWTLNYGGIALMWRGGCIIRSVFLGKIKDAFDRNPGLQNLLLDDFFKSAVENCQDSWRRAISTGVQAGIPMPCFTTALSFYDGYRHAMLPANLIQAQRDYFGAHTYELLAKPGQFIHTNWTGHGGSVSSSSYNA,brenda,P00349,N=C(O)[C@@H](O)[C@H](O)[C@H](O)COP(=O)(O)O,0.0803,20.0,8.0,1.1.1.44,9940.0,-1.0952844547213192,-1.0952844547213192,N=C(O)[C@@H](O)[C@H](O)[C@H](O)COP(=O)(O)O__MAQADIALIGLAVMGQNLILNMNDHGFVVCAFNRTVSKVDDFLANEAKGTKVLGAHSLEEMVSKLKKPRRIILLVKAGQAVDNFIEKLVPLLDIGDIIIDGGNSEYRDTMRRCRDLKDKGILFVGSGVSGGEDGARYGPSLMPGGNKEAWPHIKAIFQGIAAKVGTGEPCCDWVGDDGAGHFVKMVHNGIEYGDMQLICEAYHLMKDVLGLGHKEMAKAFEEWNKTELDSFLIEITASILKFQDADGKHLLPKIRDSAGQKGTGKWTAISALEYGVPVTLIGEAVFARCLSSLKDERIQASKKLKGPQNIPFEGDKKSFLEDIRKALYASKIISYAQGFMLLRQAATEFGWTLNYGGIALMWRGGCIIRSVFLGKIKDAFDRNPGLQNLLLDDFFKSAVENCQDSWRRAISTGVQAGIPMPCFTTALSFYDGYRHAMLPANLIQAQRDYFGAHTYELLAKPGQFIHTNWTGHGGSVSSSSYNA,./data/raw/alphafold//AF-P00349-F1-model_v4.pdb,125,1240,522,515 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PEGTVEIKFRKKDLIKSMRRIDPAYKKLMEQLGEPDLSDKDRKDLEGRLKAREDLLLPIYHQVAVQFADFHDTPGRMLEKGVISDILEWKTARTFLYWRLRRLLLEDQVKQEILQASGELSHVHIQSMLRRWFVETEGAVKAYLWDNNQVVVQWLEQHWQAGDGPRSTIRENITYLKHDSVLKTIRGLVEENPEVAVDCVIYLSQHISPAERAQVVHLLSTMDSPAST,./data/raw/alphafold//AF-O00763-F1-model_v4.pdb,283,1659,1004,2400 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+448,3433,3506,MNSKCHCVILNDGNFIPVLGFGTALPLECPKSKAKELTKIAIDAGFHHFDSASVYNTEDHVGEAIRSKIADGTVRREDIFYTSKVWCTSLHPELVRASLERSLQKLQFDYVDLYLIHYPMALKPGEENFPVDEHGKLIFDRVDLCATWEAMEKCKDAGLTKSIGVSNFNYRQLEMILNKPGLKYKPVCNQVECHPYLNQMKLLDFCKSKDIVLVAYGVLGTQRYGGWVDQNSPVLLDEPVLGSMAKKYNRTPALIALRYQLQRGIVVLNTSLKEERIKENMQVFEFQLSSEDMKVLDGLNRNMRYIPAAIFKGHPNWPFLDEY,sabio,Q91WR5,CC[C@H](C1=CC=C(C=C1)O)C(CC)C2=CC=C(C=C2)O,0.0009,25.0,10.0,1.1.1.64,10090.0,-3.0457574905606752,-3.071333751784365,CC[C@H](C1=CC=C(C=C1)O)C(CC)C2=CC=C(C=C2)O__MNSKCHCVILNDGNFIPVLGFGTALPLECPKSKAKELTKIAIDAGFHHFDSASVYNTEDHVGEAIRSKIADGTVRREDIFYTSKVWCTSLHPELVRASLERSLQKLQFDYVDLYLIHYPMALKPGEENFPVDEHGKLIFDRVDLCATWEAMEKCKDAGLTKSIGVSNFNYRQLEMILNKPGLKYKPVCNQVECHPYLNQMKLLDFCKSKDIVLVAYGVLGTQRYGGWVDQNSPVLLDEPVLGSMAKKYNRTPALIALRYQLQRGIVVLNTSLKEERIKENMQVFEFQLSSEDMKVLDGLNRNMRYIPAAIFKGHPNWPFLDEY,./data/raw/alphafold//AF-Q91WR5-F1-model_v4.pdb,138,442,1500,1785 +449,4158,4240,MENRDELQYLNQIREILQRGKQRTDRTNTGTLSIFGMQSRYSLRNGVLPLLTTKRVYWKAIVEELLWFIRGDTDSKRLSAKNVKIWDANGSREFLDSMGFTDRAVGDLGPVYGFQWRHFGAEYKGPDANYDGQGVDQLAEVIRLIRTTPDSRRIILSAWNPSDLNIMALPPCHTLCQFYVQDGELSCQLYQRSGDMGLGVPFNIASYSLLTHMIAHVCGLKAGDFVHTLGDAHVYINHIEALKTQLERAPTAFPTIEFGEGIREIDDFTSDKIFLRNYNPQDTIKMEMAV,uniprot_search,A0A0K0CT80,COc1cc(Cc2c[nH]c(=N)[nH]c2=N)cc(OC)c1OC,0.000833,37.0,5.0,2.1.1.45,6313.0,-3.0793549985932125,-2.069798717069298,COc1cc(Cc2c[nH]c(=N)[nH]c2=N)cc(OC)c1OC__MENRDELQYLNQIREILQRGKQRTDRTNTGTLSIFGMQSRYSLRNGVLPLLTTKRVYWKAIVEELLWFIRGDTDSKRLSAKNVKIWDANGSREFLDSMGFTDRAVGDLGPVYGFQWRHFGAEYKGPDANYDGQGVDQLAEVIRLIRTTPDSRRIILSAWNPSDLNIMALPPCHTLCQFYVQDGELSCQLYQRSGDMGLGVPFNIASYSLLTHMIAHVCGLKAGDFVHTLGDAHVYINHIEALKTQLERAPTAFPTIEFGEGIREIDDFTSDKIFLRNYNPQDTIKMEMAV,./data/raw/alphafold//AF-A0A0K0CT80-F1-model_v4.pdb,1541,1253,1529,109 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+451,3916,3994,MQRVNMIMAESPGLITICLLGYLLSAECTVFLDHENANKILNRPKRYNSGKLEEFVQGNLERECMEEKCSFEEAREVFENTERTTEFWKQYVDGDQCESNPCLNGGSCKDDINSYECWCPFGFEGKNCELDVTCNIKNGRCEQFCKNSADNKVVCSCTEGYRLAENQKSCEPAVPFPCGRVSVSQTSKLTRAETVFPDVDYVNSTEAETILDNITQSTQSFNDFTRVVGGEDAKPGQFPWQVVLNGKVDAFCGGSIVNEKWIVTAAHCVETGVKITVVAGEHNIEETEHTEQKRNVIRIIPHHNYNAAINKYNHDIALLELDEPLVLNSYVTPICIADKEYTNIFLKFGSGYVSGWGRVFHKGRSALVLQYLRVPLVDRATCLRSTKFTIYNNMFCAGFHEGGRDSCQGDSGGPHVTEVEGTSFLTGIISWGEECAMKGKYGIYTKVSRYVNWIKEKTKLT,uniprot_search,P00740,COC(=O)CCC(Oc1ccc2cc(C(=N)N)sc2c1)c1ccc(Cl)cc1,3.6e-05,22.0,7.4,3.4.21.22,9606.0,-4.443697499232713,-4.443697499232713,COC(=O)CCC(Oc1ccc2cc(C(=N)N)sc2c1)c1ccc(Cl)cc1__MQRVNMIMAESPGLITICLLGYLLSAECTVFLDHENANKILNRPKRYNSGKLEEFVQGNLERECMEEKCSFEEAREVFENTERTTEFWKQYVDGDQCESNPCLNGGSCKDDINSYECWCPFGFEGKNCELDVTCNIKNGRCEQFCKNSADNKVVCSCTEGYRLAENQKSCEPAVPFPCGRVSVSQTSKLTRAETVFPDVDYVNSTEAETILDNITQSTQSFNDFTRVVGGEDAKPGQFPWQVVLNGKVDAFCGGSIVNEKWIVTAAHCVETGVKITVVAGEHNIEETEHTEQKRNVIRIIPHHNYNAAINKYNHDIALLELDEPLVLNSYVTPICIADKEYTNIFLKFGSGYVSGWGRVFHKGRSALVLQYLRVPLVDRATCLRSTKFTIYNNMFCAGFHEGGRDSCQGDSGGPHVTEVEGTSFLTGIISWGEECAMKGKYGIYTKVSRYVNWIKEKTKLT,./data/raw/alphafold//AF-P00740-F1-model_v4.pdb,347,1742,1097,2510 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+453,718,729,MCNKNNTFEKNLDISHKPEPLILFNKDNNIWNSKYFRIPNIQLLNDGTILTFSDIRYNGPDDHAYIDIASARSTDFGKTWSYNIAMKNNRIDSTYSRVMDSTTVITNTGRIILIAGSWNTNGNWAMTTSTRRSDWSVQMIYSDDNGLTWSNKIDLTKDSSKVKNQPSNTIGWLGGVGSGIVMDDGTIVMPAQISLRENNENNYYSLIIYSKDNGETWTMGNKVPNSNTSENMVIELDGALIMSTRYDYSGYRAAYISHDLGTTWEIYEPLNGKILTGKGSGCQGSFIKATTSNGHRIGLISAPKNTKGEYIRDNIAVYMIDFDDLSKGVQEICIPYPEDGNKLGGGYSCLSFKNNHLGIVYEANGNIEYQDLTPYYSLINKQ,sabio,P10481,CC(=CCC1=CC2=C(C=C1O)OC[C@@H]3[C@H]2OC4=C3C=CC(=C4CC=C(C)C)O)C,0.00273,37.0,7.2,3.2.1.18,1502.0,-2.563837352959244,-2.563837352959244,CC(=CCC1=CC2=C(C=C1O)OC[C@@H]3[C@H]2OC4=C3C=CC(=C4CC=C(C)C)O)C__MCNKNNTFEKNLDISHKPEPLILFNKDNNIWNSKYFRIPNIQLLNDGTILTFSDIRYNGPDDHAYIDIASARSTDFGKTWSYNIAMKNNRIDSTYSRVMDSTTVITNTGRIILIAGSWNTNGNWAMTTSTRRSDWSVQMIYSDDNGLTWSNKIDLTKDSSKVKNQPSNTIGWLGGVGSGIVMDDGTIVMPAQISLRENNENNYYSLIIYSKDNGETWTMGNKVPNSNTSENMVIELDGALIMSTRYDYSGYRAAYISHDLGTTWEIYEPLNGKILTGKGSGCQGSFIKATTSNGHRIGLISAPKNTKGEYIRDNIAVYMIDFDDLSKGVQEICIPYPEDGNKLGGGYSCLSFKNNHLGIVYEANGNIEYQDLTPYYSLINKQ,./data/raw/alphafold//AF-P10481-F1-model_v4.pdb,1706,1433,749,2114 +454,1032,1051,MARNSDLSPYLDFDRDTWRGLRNSMPQVLTEAEVKKLAGIGENINLEEVADVYLPLSRLIHMQVAARQALTQATEQFLGNPPSHVPFVIGVAGSVAVGKSTTARLLQVLLERWDTHPKVDLVTTDGFLYPTRILQERGLMSRKGFPESYDRRSLMRFVTDVKSGKEVVRAPLYSHVSYDIVPNEYQTVNQPDILILEGLNVLQTGPTLMISDLFDFSVYVDARVETIEKWYINRFLDLRHTAFREPGAHFAAYADMNDEQAFNQAREIWQSINLPNLVENILPTRVRASLVLRKGADHTVEKVRMRKL,uniprot_search,A0A807MV04,CC(C)(COP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS,0.037,37.0,6.5,2.7.1.33,1697.0,-1.431798275933005,-1.431798275933005,CC(C)(COP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS__MARNSDLSPYLDFDRDTWRGLRNSMPQVLTEAEVKKLAGIGENINLEEVADVYLPLSRLIHMQVAARQALTQATEQFLGNPPSHVPFVIGVAGSVAVGKSTTARLLQVLLERWDTHPKVDLVTTDGFLYPTRILQERGLMSRKGFPESYDRRSLMRFVTDVKSGKEVVRAPLYSHVSYDIVPNEYQTVNQPDILILEGLNVLQTGPTLMISDLFDFSVYVDARVETIEKWYINRFLDLRHTAFREPGAHFAAYADMNDEQAFNQAREIWQSINLPNLVENILPTRVRASLVLRKGADHTVEKVRMRKL,./data/raw/alphafold//AF-A0A807MV04-F1-model_v4.pdb,275,1647,992,2388 +455,10259,10415,KYLTKVLVPNGVIKNRIEKLAYDIKKVYNNEEFHILCLLKGSRGFFTALLKHLSRIHNYSAVETSKPLFGDHYVRVKSYCNDQSTGTLEIVSEDLSCLKGKHVLIVEDIIDTGKTLVKFCEYLKKFEIKTVAIACLFIKRTPLWNGFKADFVGFSIPDHFVVGYSLDYNEIFRDLDHCCLVNDEGKKKYKATSL,uniprot_search,Q03925,O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O,0.0036,25.0,7.4,2.4.2.8,5833.0,-2.4436974992327127,-2.4436974992327127,O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O__KYLTKVLVPNGVIKNRIEKLAYDIKKVYNNEEFHILCLLKGSRGFFTALLKHLSRIHNYSAVETSKPLFGDHYVRVKSYCNDQSTGTLEIVSEDLSCLKGKHVLIVEDIIDTGKTLVKFCEYLKKFEIKTVAIACLFIKRTPLWNGFKADFVGFSIPDHFVVGYSLDYNEIFRDLDHCCLVNDEGKKKYKATSL,./data/raw/alphafold//AF-Q03925-F1-model_v4.pdb,342,1736,1090,2502 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+495,3384,3457,MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,brenda,Q9Y5Y6,CC[C@H](C)[C@H](N=C(O)[C@H](CO)N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N=C(O)[C@H](CS)N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN)[C@@H](C)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](C)C(O)=N[C@H](C(O)=N[C@@H](CS)C(O)=N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC,0.00037,25.0,7.6,3.4.21.109,9606.0,-3.431798275933005,-3.431798275933005,CC[C@H](C)[C@H](N=C(O)[C@H](CO)N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N=C(O)[C@H](CS)N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN)[C@@H](C)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](C)C(O)=N[C@H](C(O)=N[C@@H](CS)C(O)=N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC__MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,./data/raw/alphafold//AF-Q9Y5Y6-F1-model_v4.pdb,489,1916,1302,2740 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+500,1716,1755,MATSASSHLNKGIKQMYMNLPQGEKIQLMYIWVDGTGEGLRCKTRTLDCDPKCVEELPEWNFDGSSTFQSEGSNSDMYLHPVAMFRDPFRRDPNKLVFCEVFKYNRKPAETNLRHSCKRIMDMVSSQHPWFGMEQEYTLMGTDGHPFGWPSNGFPGPQGPYYCGVGADKAYGRDIVEAHYRACLYAGIKITGTNAEVMPAQWEFQIGPCEGIRMGDHLWVARFILHRVCEDFGVIATFDPKPIPGNWNGAGCHTNFSTKAMREENGLRCIEEAIDKLSKRHQYHIRAYDPKGGLDNARRLTGFHETSNINDFSAGVANRSASIRIPRIVGQEKKGYFEDRRPSANCDPYAVTEAIVRTCLLNETGDEPFQYKN,brenda,P09606,CC(N)(CCC(=O)O)P(=O)(O)O,16.0,37.0,6.2,6.3.1.2,10116.0,1.2041199826559248,1.2041199826559248,CC(N)(CCC(=O)O)P(=O)(O)O__MATSASSHLNKGIKQMYMNLPQGEKIQLMYIWVDGTGEGLRCKTRTLDCDPKCVEELPEWNFDGSSTFQSEGSNSDMYLHPVAMFRDPFRRDPNKLVFCEVFKYNRKPAETNLRHSCKRIMDMVSSQHPWFGMEQEYTLMGTDGHPFGWPSNGFPGPQGPYYCGVGADKAYGRDIVEAHYRACLYAGIKITGTNAEVMPAQWEFQIGPCEGIRMGDHLWVARFILHRVCEDFGVIATFDPKPIPGNWNGAGCHTNFSTKAMREENGLRCIEEAIDKLSKRHQYHIRAYDPKGGLDNARRLTGFHETSNINDFSAGVANRSASIRIPRIVGQEKKGYFEDRRPSANCDPYAVTEAIVRTCLLNETGDEPFQYKN,./data/raw/alphafold//AF-P09606-F1-model_v4.pdb,918,679,111,2598 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+533,5530,5629,MWELVALLLLTLAYLFWPKRRCPGAKYPKSLLSLPLVGSLPFLPRHGHMHNNFFKLQKKYGPIYSVRMGTKTTVIVGHHQLAKEVLIKKGKDFSGRPQMATLDIASNNRKGIAFADSGAHWQLHRRLAMATFALFKDGDQKLEKIICQEISTLCDMLATHNGQSIDISFPVFVAVTNVISLICFNTSYKNGDPELNVIQNYNEGIIDNLSKDSLVDLVPWLKIFPNKTLEKLKSHVKIRNDLLNKILENYKEKFRSDSITNMLDTLMQAKMNSDNGNAGPDQDSELLSDNHILTTIGDIFGAGVETTTSVVKWTLAFLLHNPQVKKKLYEEIDQNVGFSRTPTISDRNRLLLLEATIREVLRLRPVAPMLIPHKANVDSSIGEFAVDKGTEVIINLWALHHNEKEWHQPDQFMPERFLNPAGTQLISPSVSYLPFGAGPRSCIGEILARQELFLIMAWLLQRFDLEVPDDGQLPSLEGIPKVVFLIDSFKVKIKVRQAWREAQAEGST,uniprot_search,P05093,Fc1ccc(-c2ccc(C(CCCl)n3ccnc3)cc2)cc1,0.000756,37.0,8.1,1.14.14.19,9606.0,-3.1214782044987937,-3.1214782044987937,Fc1ccc(-c2ccc(C(CCCl)n3ccnc3)cc2)cc1__MWELVALLLLTLAYLFWPKRRCPGAKYPKSLLSLPLVGSLPFLPRHGHMHNNFFKLQKKYGPIYSVRMGTKTTVIVGHHQLAKEVLIKKGKDFSGRPQMATLDIASNNRKGIAFADSGAHWQLHRRLAMATFALFKDGDQKLEKIICQEISTLCDMLATHNGQSIDISFPVFVAVTNVISLICFNTSYKNGDPELNVIQNYNEGIIDNLSKDSLVDLVPWLKIFPNKTLEKLKSHVKIRNDLLNKILENYKEKFRSDSITNMLDTLMQAKMNSDNGNAGPDQDSELLSDNHILTTIGDIFGAGVETTTSVVKWTLAFLLHNPQVKKKLYEEIDQNVGFSRTPTISDRNRLLLLEATIREVLRLRPVAPMLIPHKANVDSSIGEFAVDKGTEVIINLWALHHNEKEWHQPDQFMPERFLNPAGTQLISPSVSYLPFGAGPRSCIGEILARQELFLIMAWLLQRFDLEVPDDGQLPSLEGIPKVVFLIDSFKVKIKVRQAWREAQAEGST,./data/raw/alphafold//AF-P05093-F1-model_v4.pdb,1757,1564,819,2193 +534,10824,10984,MAERVLTRVHSLRERVDATLAAHRNEILLFLSRIESHGKGILKPHELLAEFDAIRQDDKNKLNEHAFEELLKSTQEAIVLPPWVALAIRLRPGVWEYIRVNVNALVVEELSVPEYLQFKEELVDGASNGNFVLELDFEPFTASFPKPTLTKSIGNGVEFLNRHLSAKMFHDKESMTPLLEFLRAHHYKGKTMMLNDRIQNSNTLQNVLRKAEEYLIMLPPETPYFEFEHKFQEIGLEKGWGDTAERVLEMVCMLLDLLEAPDSCTLEKFLGRIPMVFNVVILSPHGYFAQENVLGYPDTGGQVVYILDQVPALEREMLKRIKEQGLDIIPRILIVTRLLPDAVGTTCGQRIEKVYGAEHSHILRVPFRTEKGIVRKWISRFEVWPYMETFIEDVAKEISAELQAKPDLIIGNYSEGNLAASLLAHKLGVTQCTIAHALEKTKYPDSDIYWKKFDEKYHFSSQFTADLIAMNHTDFIITSTFQEIAGSKDTVGQYESHMAFTMPGLYRVVHGINVFDPKFNIVSPGADINLYFSYSETEKRLTAFHPEIDELLYSDVENDEHLCVLKDRTKPILFTMARLDRVKNLTGLVEWYAKNPRLRGLVNLVVVGGDRRKESKDLEEQAEMKKMYELIETHNLNGQFRWISSQMNRVRNGELYRYIADTKGAFVQPAFYEAFGLTVVEAMTCGLPTFATNHGGPAEIIVHGKSGFHIDPYHGEQAADLLADFFEKCKKDPSHWETISMGGLKRIEEKYTWQIYSESLLTLAAVYGFWKHVSKLDRLEIRRYLEMFYALKYRKMAEAVPLAAE,sabio,P10691,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OC2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O,2.3,30.0,8.0,2.4.1.13,4113.0,0.3617278360175928,0.3617278360175928,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OC2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O__MAERVLTRVHSLRERVDATLAAHRNEILLFLSRIESHGKGILKPHELLAEFDAIRQDDKNKLNEHAFEELLKSTQEAIVLPPWVALAIRLRPGVWEYIRVNVNALVVEELSVPEYLQFKEELVDGASNGNFVLELDFEPFTASFPKPTLTKSIGNGVEFLNRHLSAKMFHDKESMTPLLEFLRAHHYKGKTMMLNDRIQNSNTLQNVLRKAEEYLIMLPPETPYFEFEHKFQEIGLEKGWGDTAERVLEMVCMLLDLLEAPDSCTLEKFLGRIPMVFNVVILSPHGYFAQENVLGYPDTGGQVVYILDQVPALEREMLKRIKEQGLDIIPRILIVTRLLPDAVGTTCGQRIEKVYGAEHSHILRVPFRTEKGIVRKWISRFEVWPYMETFIEDVAKEISAELQAKPDLIIGNYSEGNLAASLLAHKLGVTQCTIAHALEKTKYPDSDIYWKKFDEKYHFSSQFTADLIAMNHTDFIITSTFQEIAGSKDTVGQYESHMAFTMPGLYRVVHGINVFDPKFNIVSPGADINLYFSYSETEKRLTAFHPEIDELLYSDVENDEHLCVLKDRTKPILFTMARLDRVKNLTGLVEWYAKNPRLRGLVNLVVVGGDRRKESKDLEEQAEMKKMYELIETHNLNGQFRWISSQMNRVRNGELYRYIADTKGAFVQPAFYEAFGLTVVEAMTCGLPTFATNHGGPAEIIVHGKSGFHIDPYHGEQAADLLADFFEKCKKDPSHWETISMGGLKRIEEKYTWQIYSESLLTLAAVYGFWKHVSKLDRLEIRRYLEMFYALKYRKMAEAVPLAAE,./data/raw/alphafold//AF-P10691-F1-model_v4.pdb,983,93,2235,1081 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+536,1190,1216,MSSSPSFGLLAVAALLLALSLAQHGSLAATVGPRVIVVGAGMSGISAAKRLSEAGITDLLILEATDHIGGRMHKTNFAGINVELGANWVEGVNGGKMNPIWPIVNSTLKLRNFRSDFDYLAQNVYKEDGGVYDEDYVQKRIELADSVEEMGEKLSATLHASGRDDMSILAMQRLNEHQPNGPATPVDMVVDYYKFDYEFAEPPRVTSLQNTVPLATFSDFGDDVYFVADQRGYEAVVYYLAGQYLKTDDKSGKIVDPRLQLNKVVREIKYSPGGVTVKTEDNSVYSADYVMVSASLGVLQSDLIQFKPKLPTWKVRAIYQFDMAVYTKIFLKFPRKFWPEGKGREFFLYASSRRGYYGVWQEFEKQYPDANVLLVTVTDEESRRIEQQSDEQTKAEIMQVLRKMFPGKDVPDATDILVPRWWSDRFYKGTFSNWPVGVNRYEYDQLRAPVGRVYFTGEHTSEHYNGYVHGAYLSGIDSAEILINCAQKKMCKYHVQGKYD,brenda,O64411,CC(C)=CCNC(=N)NCCCNCCCN,0.00121,25.0,6.5,1.5.3.14,4577.0,-2.91721462968355,-2.91721462968355,CC(C)=CCNC(=N)NCCCNCCCN__MSSSPSFGLLAVAALLLALSLAQHGSLAATVGPRVIVVGAGMSGISAAKRLSEAGITDLLILEATDHIGGRMHKTNFAGINVELGANWVEGVNGGKMNPIWPIVNSTLKLRNFRSDFDYLAQNVYKEDGGVYDEDYVQKRIELADSVEEMGEKLSATLHASGRDDMSILAMQRLNEHQPNGPATPVDMVVDYYKFDYEFAEPPRVTSLQNTVPLATFSDFGDDVYFVADQRGYEAVVYYLAGQYLKTDDKSGKIVDPRLQLNKVVREIKYSPGGVTVKTEDNSVYSADYVMVSASLGVLQSDLIQFKPKLPTWKVRAIYQFDMAVYTKIFLKFPRKFWPEGKGREFFLYASSRRGYYGVWQEFEKQYPDANVLLVTVTDEESRRIEQQSDEQTKAEIMQVLRKMFPGKDVPDATDILVPRWWSDRFYKGTFSNWPVGVNRYEYDQLRAPVGRVYFTGEHTSEHYNGYVHGAYLSGIDSAEILINCAQKKMCKYHVQGKYD,./data/raw/alphafold//AF-O64411-F1-model_v4.pdb,1749,1246,529,1837 +537,10005,10157,MGASEAGSEKGGVTMSAKRALILVDVQNDFLPGGSLAVPDGDRIIPVLNRYIELFHRAGLPIYATRDWHPEQTRHFQAYGGLWPPHCVQGTRGAEFHPDLKLTPETIIISKGMDPNEDSYSGFQGRTADGVAFAEELKRRGIEHLYVGGVATDYCVRHTVLDARRLGFRVTVLEDAIRGVDLTPGDSERALREMMEAGASLARFEDVAREMSAPAEAAPR,brenda,H5SPS2,O=Cc1cccnc1,0.00018,37.0,7.3,3.5.1.19,171953.0,-3.744727494896694,-3.744727494896694,O=Cc1cccnc1__MGASEAGSEKGGVTMSAKRALILVDVQNDFLPGGSLAVPDGDRIIPVLNRYIELFHRAGLPIYATRDWHPEQTRHFQAYGGLWPPHCVQGTRGAEFHPDLKLTPETIIISKGMDPNEDSYSGFQGRTADGVAFAEELKRRGIEHLYVGGVATDYCVRHTVLDARRLGFRVTVLEDAIRGVDLTPGDSERALREMMEAGASLARFEDVAREMSAPAEAAPR,./data/raw/alphafold//AF-H5SPS2-F1-model_v4.pdb,1440,1115,2447,1311 +538,9175,9320,MDSPCQPQPLSQALPQLPGSSSEPLEPEPGRARMGVESYLPCPLLPSYHCPGVPSEASAGSGTPRATATSTTASPLRDGFGGQDGGELRPLQSEGAAALVTKGCQRLAAQGARPEAPKRKWAEDGGDAPSPSKRPWARQENQEAEREGGMSCSCSSGSGEASAGLMEEALPSAPERLALDYIVPCMRYYGICVKDSFLGAALGGRVLAEVEALKRGGRLRDGQLVSQRAIPPRSIRGDQIAWVEGHEPGCRSIGALMAHVDAVIRHCAGRLGSYVINGRTKAMVACYPGNGLGYVRHVDNPHGDGRCITCIYYLNQNWDVKVHGGLLQIFPEGRPVVANIEPLFDRLLIFWSDRRNPHEVKPAYATRYAITVWYFDAKERAAAKDKYQLASGQKGVQVPVSQPPTPT,brenda,Q96KS0,O=C(O)CNC(=O)C(=O)O,0.008,21.0,7.8,1.14.11.2,9606.0,-2.096910013008056,-2.096910013008056,O=C(O)CNC(=O)C(=O)O__MDSPCQPQPLSQALPQLPGSSSEPLEPEPGRARMGVESYLPCPLLPSYHCPGVPSEASAGSGTPRATATSTTASPLRDGFGGQDGGELRPLQSEGAAALVTKGCQRLAAQGARPEAPKRKWAEDGGDAPSPSKRPWARQENQEAEREGGMSCSCSSGSGEASAGLMEEALPSAPERLALDYIVPCMRYYGICVKDSFLGAALGGRVLAEVEALKRGGRLRDGQLVSQRAIPPRSIRGDQIAWVEGHEPGCRSIGALMAHVDAVIRHCAGRLGSYVINGRTKAMVACYPGNGLGYVRHVDNPHGDGRCITCIYYLNQNWDVKVHGGLLQIFPEGRPVVANIEPLFDRLLIFWSDRRNPHEVKPAYATRYAITVWYFDAKERAAAKDKYQLASGQKGVQVPVSQPPTPT,./data/raw/alphafold//AF-Q96KS0-F1-model_v4.pdb,1363,1007,2330,1187 +539,2208,2265,MHSKVTIICIRFLFWFLLLCMLIGKSHTEDDIIIATKNGKVRGMNLTVFGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSDIWNATKYANSCCQNIDQSFPGFHGSEMWNPNTDLSEDCLYLNVWIPAPKPKNATVLIWIYGGGFQTGTSSLHVYDGKFLARVERVIVVSMNYRVGALGFLALPGNPEAPGNMGLFDQQLALQWVQKNIAAFGGNPKSVTLFGESAGAASVSLHLLSPGSHSLFTRAILQSGSFNAPWAVTSLYEARNRTLNLAKLTGCSRENETEIIKCLRNKDPQEILLNEAFVVPYGTPLSVNFGPTVDGDFLTDMPDILLELGQFKKTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPGVSEFGKESILFHYTDWVDDQRPENYREALGDVVGDYNFICPALEFTKKFSEWGNNAFFYYFEHRSSKLPWPEWMGVMHGYEIEFVFGLPLERRDNYTKAEEILSRSIVKRWANFAKYGNPNETQNNSTSWPVFKSTEQKYLTLNTESTRIMTKLRAQQCRFWTSFFPKVLEMTGNIDEAEWEWKAGFHRWNNYMMDWKNQFNDYTSKKESCVGL,brenda,P06276,CC=C1C2C=C(C)CC1(N)c1ccc(O)nc1C2,0.0756,22.0,8.0,3.1.1.8,9606.0,-1.1214782044987934,-1.1214782044987934,CC=C1C2C=C(C)CC1(N)c1ccc(O)nc1C2__MHSKVTIICIRFLFWFLLLCMLIGKSHTEDDIIIATKNGKVRGMNLTVFGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSDIWNATKYANSCCQNIDQSFPGFHGSEMWNPNTDLSEDCLYLNVWIPAPKPKNATVLIWIYGGGFQTGTSSLHVYDGKFLARVERVIVVSMNYRVGALGFLALPGNPEAPGNMGLFDQQLALQWVQKNIAAFGGNPKSVTLFGESAGAASVSLHLLSPGSHSLFTRAILQSGSFNAPWAVTSLYEARNRTLNLAKLTGCSRENETEIIKCLRNKDPQEILLNEAFVVPYGTPLSVNFGPTVDGDFLTDMPDILLELGQFKKTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPGVSEFGKESILFHYTDWVDDQRPENYREALGDVVGDYNFICPALEFTKKFSEWGNNAFFYYFEHRSSKLPWPEWMGVMHGYEIEFVFGLPLERRDNYTKAEEILSRSIVKRWANFAKYGNPNETQNNSTSWPVFKSTEQKYLTLNTESTRIMTKLRAQQCRFWTSFFPKVLEMTGNIDEAEWEWKAGFHRWNNYMMDWKNQFNDYTSKKESCVGL,./data/raw/alphafold//AF-P06276-F1-model_v4.pdb,1716,1444,761,2205 +540,6917,7034,GSVLCVKCNNDEVVIKFLHGLNCNFDCASIGEISKVIKLLPNLSRDRIIFANTIKSINSLIYARKENINLCTFDNLDVLKKIYKYHPKCSLILRINVDFKNYKSYMSSKYGANEYEWEEMLLYAKKHNLNIVGVSFHVGSNTKNLFDFCLAIKLCRDVFDMSSNMGFNFYIINLGGGYPEELEYDNAKKHDKIHYCTLSLQEIKKDIQKFLNEETFLKTKYGYYSFEKISLAINMSIDHYFTHMKDNLRVICE,uniprot_search,O15869,NCCC[C@@H](C(=O)O)N(F)F,0.09,37.0,7.833333333333333,4.1.1.17,5833.0,-1.0457574905606752,-1.0457574905606752,NCCC[C@@H](C(=O)O)N(F)F__GSVLCVKCNNDEVVIKFLHGLNCNFDCASIGEISKVIKLLPNLSRDRIIFANTIKSINSLIYARKENINLCTFDNLDVLKKIYKYHPKCSLILRINVDFKNYKSYMSSKYGANEYEWEEMLLYAKKHNLNIVGVSFHVGSNTKNLFDFCLAIKLCRDVFDMSSNMGFNFYIINLGGGYPEELEYDNAKKHDKIHYCTLSLQEIKKDIQKFLNEETFLKTKYGYYSFEKISLAINMSIDHYFTHMKDNLRVICE,./data/raw/alphafold//AF-O15869-F1-model_v4.pdb,783,287,1722,326 +541,7471,7598,MIEDNKENKDHAPERGRTAIIFSLKNEVGGLVKALKLFQEKHVNLVHIESRKSKRRNSEFEIFVDCDSNREQLNEIFQLLKSHVSIVSMNPTEHFNVQEDGDMENIPWYPKKISDLDKCANRVLMYGSDLDADHPGFKDNVYRKRRKYFADLAMNYKHGDPIPEIEFTEEEIKTWGTVYRELNKLYPTHACREYLKNLPLLTKYCGYREDNIPQLEDVSRFLKERTGFTIRPVAGYLSPRDFLAGLAFRVFHCTQYVRHSSDPLYTPEPDTCHELLGHVPLLAEPSFAQFSQEIGLASLGASDEAVQKLATCYFFTVEFGLCKQEGQLRVYGAGLLSSISELKHSLSGSAKVKPFDPKVTCKQECLITTFQEVYFVSESFEEAKEKMREFAKTIKRPFGVKYNPYTQSVQILKDTKSIASVVNELRHELDIVSDALSKMGKQLEV,brenda,P70080,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,0.164,15.0,7.0,1.14.16.4,9031.0,-0.7851561519523022,-0.7851561519523022,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O__MIEDNKENKDHAPERGRTAIIFSLKNEVGGLVKALKLFQEKHVNLVHIESRKSKRRNSEFEIFVDCDSNREQLNEIFQLLKSHVSIVSMNPTEHFNVQEDGDMENIPWYPKKISDLDKCANRVLMYGSDLDADHPGFKDNVYRKRRKYFADLAMNYKHGDPIPEIEFTEEEIKTWGTVYRELNKLYPTHACREYLKNLPLLTKYCGYREDNIPQLEDVSRFLKERTGFTIRPVAGYLSPRDFLAGLAFRVFHCTQYVRHSSDPLYTPEPDTCHELLGHVPLLAEPSFAQFSQEIGLASLGASDEAVQKLATCYFFTVEFGLCKQEGQLRVYGAGLLSSISELKHSLSGSAKVKPFDPKVTCKQECLITTFQEVYFVSESFEEAKEKMREFAKTIKRPFGVKYNPYTQSVQILKDTKSIASVVNELRHELDIVSDALSKMGKQLEV,./data/raw/alphafold//AF-P70080-F1-model_v4.pdb,1043,600,1974,817 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+633,2180,2237,MMRKSLCCALLLGISCSALATPVSEKQLAEVVANTITPLMKAQSVPGMAVAVIYQGKPHYYTFGKADIAANKPVTPQTLFELGSISKTFTGVLGGDAIARGEISLDDAVTRYWPQLTGKQWQGIRMLDLATYTAGGLPLQVPDEVTDNASLLRFYQNWQPQWKPGTTRLYANASIGLFGALAVKPSGMPYEQAMTTRVLKPLKLDHTWINVPKAEEAHYAWGYRDGKAVRVSPGMLDAQAYGVKTNVQDMANWVMANMAPENVADASLKQGIALAQSRYWRIGSMYQGLGWEMLNWPVEANTVVEGSDSKVALAPLPVAEVNPPAPPVKASWVHKTGSTGGFGSYVAFIPEKQIGIVMLANTSYPNPARVEAAYHILEALQ,sabio,P05364,CC1C(NC(=O)C(=NOC(C)(C)C(=O)O)c2csc([N+])n2)C(=O)N1S(=O)(=O)[O-],5.2e-05,30.0,7.0,3.5.2.6,550.0,-4.2839966563652006,-4.2839966563652006,CC1C(NC(=O)C(=NOC(C)(C)C(=O)O)c2csc([N+])n2)C(=O)N1S(=O)(=O)[O-]__MMRKSLCCALLLGISCSALATPVSEKQLAEVVANTITPLMKAQSVPGMAVAVIYQGKPHYYTFGKADIAANKPVTPQTLFELGSISKTFTGVLGGDAIARGEISLDDAVTRYWPQLTGKQWQGIRMLDLATYTAGGLPLQVPDEVTDNASLLRFYQNWQPQWKPGTTRLYANASIGLFGALAVKPSGMPYEQAMTTRVLKPLKLDHTWINVPKAEEAHYAWGYRDGKAVRVSPGMLDAQAYGVKTNVQDMANWVMANMAPENVADASLKQGIALAQSRYWRIGSMYQGLGWEMLNWPVEANTVVEGSDSKVALAPLPVAEVNPPAPPVKASWVHKTGSTGGFGSYVAFIPEKQIGIVMLANTSYPNPARVEAAYHILEALQ,./data/raw/alphafold//AF-P05364-F1-model_v4.pdb,616,2068,514,1816 +634,5599,5698,MARLSWGYGEHNGPIHWNELFPIADGDQQSPIEIKTKEVKYDSSLRPLSIKYDPASAKIISNSGHSFNVDFDDTEDKSVLRGGPLTGNYRLRQFHLHWGSADDHGSEHVVDGVRYAAELHVVHWNSDKYPSFVEAAHESDGLAVLGVFLQIGEHNPQLQKITDILDSIKEKGKQTRFTNFDPLCLLPSSWDYWTYPGSLTVPPLLESVTWIVLKQPISISSQQLARFRSLLCTAEGESAAFLLSNHRPPQPLKGRRVRASFY,brenda,Q9D6N1,N#C[O-],0.031,25.0,7.5,4.2.1.1,10090.0,-1.5086383061657274,-2.5553491487468447,N#C[O-]__MARLSWGYGEHNGPIHWNELFPIADGDQQSPIEIKTKEVKYDSSLRPLSIKYDPASAKIISNSGHSFNVDFDDTEDKSVLRGGPLTGNYRLRQFHLHWGSADDHGSEHVVDGVRYAAELHVVHWNSDKYPSFVEAAHESDGLAVLGVFLQIGEHNPQLQKITDILDSIKEKGKQTRFTNFDPLCLLPSSWDYWTYPGSLTVPPLLESVTWIVLKQPISISSQQLARFRSLLCTAEGESAAFLLSNHRPPQPLKGRRVRASFY,./data/raw/alphafold//AF-Q9D6N1-F1-model_v4.pdb,446,1854,1224,2652 +635,5650,5749,MSKSVFVGELTWKEYEARVAAGDCVLMLPVGALEQHGHHMCMNVDVLLPTAVCKRVAERIGALVMPGLQYGYKSQQKSGGGNHFPGTTSLDGATLTGTVQDIIRELARHGARRLVLMNGHYENSMFIVEGIDLALRELRYAGIQDFKVVVLSYWDFVKDPAVIQQLYPEGFLGWDIEHGGVFETSLMLALYPDLVDLDRVVDHPPATFPPYDVFPVDPARTPAPGTLSSAKTASREKGELILEVCVQGIADAIREEFPPT,sabio,P83772,N=C(N)N,200.0,37.0,7.0,3.5.2.10,303.0,2.3010299956639813,2.3010299956639813,N=C(N)N__MSKSVFVGELTWKEYEARVAAGDCVLMLPVGALEQHGHHMCMNVDVLLPTAVCKRVAERIGALVMPGLQYGYKSQQKSGGGNHFPGTTSLDGATLTGTVQDIIRELARHGARRLVLMNGHYENSMFIVEGIDLALRELRYAGIQDFKVVVLSYWDFVKDPAVIQQLYPEGFLGWDIEHGGVFETSLMLALYPDLVDLDRVVDHPPATFPPYDVFPVDPARTPAPGTLSSAKTASREKGELILEVCVQGIADAIREEFPPT,./data/raw/alphafold//AF-P83772-F1-model_v4.pdb,158,1419,732,2094 +636,8291,8424,MPIATSTGDNVLDFTVLGLNSGTSMDGIDCALCHFYQKTPDAPMEFELLEYGEVPLAQPIKQRVMRMILEDTTSPSELSEVNVILGEHFADAVRQFAAERNVDLSTIDAIASHGQTIWLLSMPEEGQVKSALTMAEGAILASRTGITSITDFRISDQAAGRQGAPLIAFFDALLLHHPTKLRACQNIGGIANVCFIPPDVDGRRTDEYYDFDTGPGNVFIDAVVRHFTNGEQEYDKDGAMGKRGKVDQELVDDFLKMPYFQLDPPKTTGREVFRDTLAHDLIRRAEAKGLSPDDIVATTTRITAQAIVDHYRRYAPSQEIDEIFMCGGGAYNPNIVEFIQQSYPNTKIMMLDEAGVPAGAKEAITFAWQGMEALVGRSIPVPTRVETRQHYVLGKVSPGLNYRSVMKKGMAFGGDAQQLPWVSEMIVKKKGKVITNNWA,brenda,B3VI55,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.45,30.0,8.433333333333334,2.7.1.232,29829.0,-0.3467874862246563,-0.3467874862246563,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MPIATSTGDNVLDFTVLGLNSGTSMDGIDCALCHFYQKTPDAPMEFELLEYGEVPLAQPIKQRVMRMILEDTTSPSELSEVNVILGEHFADAVRQFAAERNVDLSTIDAIASHGQTIWLLSMPEEGQVKSALTMAEGAILASRTGITSITDFRISDQAAGRQGAPLIAFFDALLLHHPTKLRACQNIGGIANVCFIPPDVDGRRTDEYYDFDTGPGNVFIDAVVRHFTNGEQEYDKDGAMGKRGKVDQELVDDFLKMPYFQLDPPKTTGREVFRDTLAHDLIRRAEAKGLSPDDIVATTTRITAQAIVDHYRRYAPSQEIDEIFMCGGGAYNPNIVEFIQQSYPNTKIMMLDEAGVPAGAKEAITFAWQGMEALVGRSIPVPTRVETRQHYVLGKVSPGLNYRSVMKKGMAFGGDAQQLPWVSEMIVKKKGKVITNNWA,./data/raw/alphafold//AF-B3VI55-F1-model_v4.pdb,1030,584,1957,681 +637,10876,11036,CGVPAIQPVLSGLSRIVNGEEAVPGSWPWQVSLQDKTGFHFCGGSLINENWVVTAAHCGVTTSDVVVAGEFDQGSSSEKIQKLKIAKVFKNSKYNSLTINNDITLLKLSTAASFSQTVSAVCLPSASDDFAAGTTCVTTGWGLTRYTNANTPDRLQQASLPLLSNTNCKKYWGTKIKDAMICAGASGVSSCMGDSGGPLVCKKNGAWTLVGIVSWGSSTCSTSTPGVYARVTALVNWVQQTLAAN,brenda,P00766,O=c1oc(-c2cccc(Cl)c2)nc2ccccc12,0.0226,30.0,7.6,3.4.21.1,9913.0,-1.6458915608525992,-1.6458915608525992,O=c1oc(-c2cccc(Cl)c2)nc2ccccc12__CGVPAIQPVLSGLSRIVNGEEAVPGSWPWQVSLQDKTGFHFCGGSLINENWVVTAAHCGVTTSDVVVAGEFDQGSSSEKIQKLKIAKVFKNSKYNSLTINNDITLLKLSTAASFSQTVSAVCLPSASDDFAAGTTCVTTGWGLTRYTNANTPDRLQQASLPLLSNTNCKKYWGTKIKDAMICAGASGVSSCMGDSGGPLVCKKNGAWTLVGIVSWGSSTCSTSTPGVYARVTALVNWVQQTLAAN,./data/raw/alphafold//AF-P00766-F1-model_v4.pdb,638,1633,978,2374 +638,11660,11840,MASPKKKLQGLVAATITPMTEHGEINFSVIGRYVDYLVEEQGVKNVFVNGTTGEGLSLSISERCQVAEEWVTKGKNKLDQIVIHVGALSLKESQELAQHAAEIGADGIAVIAPFFLKPWNKDVLINFLKEVAAAAPALPFYYYHIPALTGVKIRAEELLDGIQDKIPSFQGLKFSDTDLLDFGQCVDQNRQRQFAFLFGVDEQLLSALVMGATGAVGSTYNYLGKKTKQMLEAFERKDFSSALNHQFCIQRFINFVVKLGFGVSQTKAIMTLVSGIPMGPPRLPLQKASREFTDNAEAKLKSLDFLSCTDLKDGNMEACS,uniprot_search,Q29RY9,[Fe+3],1.0,34.0,7.5,4.1.3.3,9913.0,0.0,0.0,[Fe+3]__MASPKKKLQGLVAATITPMTEHGEINFSVIGRYVDYLVEEQGVKNVFVNGTTGEGLSLSISERCQVAEEWVTKGKNKLDQIVIHVGALSLKESQELAQHAAEIGADGIAVIAPFFLKPWNKDVLINFLKEVAAAAPALPFYYYHIPALTGVKIRAEELLDGIQDKIPSFQGLKFSDTDLLDFGQCVDQNRQRQFAFLFGVDEQLLSALVMGATGAVGSTYNYLGKKTKQMLEAFERKDFSSALNHQFCIQRFINFVVKLGFGVSQTKAIMTLVSGIPMGPPRLPLQKASREFTDNAEAKLKSLDFLSCTDLKDGNMEACS,./data/raw/alphafold//AF-Q29RY9-F1-model_v4.pdb,1661,172,355,1648 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+692,11078,11243,MTMITDSLAVVLQRRDWENPGVTQLNRLAAHPPFASWRNSEEARTDRPSQQLRSLNGEWRFAWFPAPEAVPESWLECDLPEADTVVVPSNWQMHGYDAPIYTNVTYPITVNPPFVPTENPTGCYSLTFNVDESWLQEGQTRIIFDGVNSAFHLWCNGRWVGYGQDSRLPSEFDLSAFLRAGENRLAVMVLRWSDGSYLEDQDMWRMSGIFRDVSLLHKPTTQISDFHVATRFNDDFSRAVLEAEVQMCGELRDYLRVTVSLWQGETQVASGTAPFGGEIIDERGGYADRVTLRLNVENPKLWSAEIPNLYRAVVELHTADGTLIEAEACDVGFREVRIENGLLLLNGKPLLIRGVNRHEHHPLHGQVMDEQTMVQDILLMKQNNFNAVRCSHYPNHPLWYTLCDRYGLYVVDEANIETHGMVPMNRLTDDPRWLPAMSERVTRMVQRDRNHPSVIIWSLGNESGHGANHDALYRWIKSVDPSRPVQYEGGGADTTATDIICPMYARVDEDQPFPAVPKWSIKKWLSLPGETRPLILCEYAHAMGNSLGGFAKYWQAFRQYPRLQGGFVWDWVDQSLIKYDENGNPWSAYGGDFGDTPNDRQFCMNGLVFADRTPHPALTEAKHQQQFFQFRLSGQTIEVTSEYLFRHSDNELLHWMVALDGKPLASGEVPLDVAPQGKQLIELPELPQPESAGQLWLTVRVVQPNATAWSEAGHISAWQQWRLAENLSVTLPAASHAIPHLTTSEMDFCIELGNKRWQFNRQSGFLSQMWIGDKKQLLTPLRDQFTRAPLDNDIGVSEATRIDPNAWVERWKAAGHYQAEAALLQCTADTLADAVLITTAHAWQHQGKTLFISRKTYRIDGSGQMAITVDVEVASDTPHPARIGLNCQLAQVAERVNWLGLGPQENYPDRLTAACFDRWDLPLSDMYTPYVFPSENGLRCGTRELNYGPHQWRGDFQFNISRYSQQQLMETSHRHLLHAEEGTWLNIDGFHMGIGGDDSWSPSVSAEFQLSAGRYHYQLVWCQK,sabio,P00722,OC[C@@H](O)[C@H](O)CO,7.0,25.0,7.0,3.2.1.23,562.0,0.8450980400142568,0.8450980400142568,OC[C@@H](O)[C@H](O)CO__MTMITDSLAVVLQRRDWENPGVTQLNRLAAHPPFASWRNSEEARTDRPSQQLRSLNGEWRFAWFPAPEAVPESWLECDLPEADTVVVPSNWQMHGYDAPIYTNVTYPITVNPPFVPTENPTGCYSLTFNVDESWLQEGQTRIIFDGVNSAFHLWCNGRWVGYGQDSRLPSEFDLSAFLRAGENRLAVMVLRWSDGSYLEDQDMWRMSGIFRDVSLLHKPTTQISDFHVATRFNDDFSRAVLEAEVQMCGELRDYLRVTVSLWQGETQVASGTAPFGGEIIDERGGYADRVTLRLNVENPKLWSAEIPNLYRAVVELHTADGTLIEAEACDVGFREVRIENGLLLLNGKPLLIRGVNRHEHHPLHGQVMDEQTMVQDILLMKQNNFNAVRCSHYPNHPLWYTLCDRYGLYVVDEANIETHGMVPMNRLTDDPRWLPAMSERVTRMVQRDRNHPSVIIWSLGNESGHGANHDALYRWIKSVDPSRPVQYEGGGADTTATDIICPMYARVDEDQPFPAVPKWSIKKWLSLPGETRPLILCEYAHAMGNSLGGFAKYWQAFRQYPRLQGGFVWDWVDQSLIKYDENGNPWSAYGGDFGDTPNDRQFCMNGLVFADRTPHPALTEAKHQQQFFQFRLSGQTIEVTSEYLFRHSDNELLHWMVALDGKPLASGEVPLDVAPQGKQLIELPELPQPESAGQLWLTVRVVQPNATAWSEAGHISAWQQWRLAENLSVTLPAASHAIPHLTTSEMDFCIELGNKRWQFNRQSGFLSQMWIGDKKQLLTPLRDQFTRAPLDNDIGVSEATRIDPNAWVERWKAAGHYQAEAALLQCTADTLADAVLITTAHAWQHQGKTLFISRKTYRIDGSGQMAITVDVEVASDTPHPARIGLNCQLAQVAERVNWLGLGPQENYPDRLTAACFDRWDLPLSDMYTPYVFPSENGLRCGTRELNYGPHQWRGDFQFNISRYSQQQLMETSHRHLLHAEEGTWLNIDGFHMGIGGDDSWSPSVSAEFQLSAGRYHYQLVWCQK,./data/raw/alphafold//AF-P00722-F1-model_v4.pdb,78,1319,613,1936 +693,3339,3411,MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,brenda,Q9Y5Y6,CC[C@H](C)[C@H](N=C(O)[C@H](C)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CS)N=C(O)[C@@H](N=C(O)CN=C(O)CN)C(C)C)C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CS)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CO)C(O)=N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(O)=NCC(O)=N[C@@H](C)C(O)=N[C@@H](CS)C(O)=N[C@H](C(O)=N[C@@H](CS)C(O)=N[C@@H](CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](CC(=N)O)C(O)=NCC(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CS)C(O)=NCC(O)=N[C@@H](CO)C(O)=NCC(O)=N[C@@H](CO)C(O)=N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC,0.01,25.0,7.6,3.4.21.109,9606.0,-2.0,-2.0,CC[C@H](C)[C@H](N=C(O)[C@H](C)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CS)N=C(O)[C@@H](N=C(O)CN=C(O)CN)C(C)C)C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CS)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CO)C(O)=N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(O)=NCC(O)=N[C@@H](C)C(O)=N[C@@H](CS)C(O)=N[C@H](C(O)=N[C@@H](CS)C(O)=N[C@@H](CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](CC(=N)O)C(O)=NCC(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CS)C(O)=NCC(O)=N[C@@H](CO)C(O)=NCC(O)=N[C@@H](CO)C(O)=N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC__MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,./data/raw/alphafold//AF-Q9Y5Y6-F1-model_v4.pdb,489,1916,1302,2740 +694,3072,3140,MHLKIVCLSDEVREMYKNHKTHHEGDSGLDLFIVKDEVLKPKSTTFVKLGIKAIALQYKSNYYYKCEKSENKKKDDDKSNIVNTSFLLFPRSSISKTPLRLANSIGLIDAGYRGEIIAALDNTSDQEYHIKKNDKLVQLVSFTGEPLSFELVEELDETSRGEGGFGSTSNNKY,brenda,Q8II92,CCN=C(O)C(CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)Cn1ccc(O)nc1=O,0.0057,25.0,5.95,3.6.1.23,5833.0,-2.2441251443275085,-2.2441251443275085,CCN=C(O)C(CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)Cn1ccc(O)nc1=O__MHLKIVCLSDEVREMYKNHKTHHEGDSGLDLFIVKDEVLKPKSTTFVKLGIKAIALQYKSNYYYKCEKSENKKKDDDKSNIVNTSFLLFPRSSISKTPLRLANSIGLIDAGYRGEIIAALDNTSDQEYHIKKNDKLVQLVSFTGEPLSFELVEELDETSRGEGGFGSTSNNKY,./data/raw/alphafold//AF-Q8II92-F1-model_v4.pdb,268,1640,985,2381 +695,11710,11892,MSFKTLSALALALGAAVQFASAAVPLVQKRATCDDGRTTANAACCILFPILDDIQENLFDGAQCGEEVHESLRLTFHDAIGFSPTLGGGGADGSIIAFDTIETNFPANAGIDEIVSAQKPFVAKHNISAGDFIQFAGAVGVSNCPGGVRIPFFLGRPDAVAASPDHLVPEPFDSVDSILARMGDAGFSPVEVVWLLASHSIAAADKVDPSIPGTPFDSTPGVFDSQFFIETQLKGRLFPGTADNKGEAQSPLQGEIRLQSDHLLARDPQTACEWQSMVNNQPKIQNRFAATMSKMALLGQDKTKLIDCSDVIPTPPALVGAAHLPAGFSLSDVEQACAATPFPALTADPGPVTSVPPVPGS,sabio,O94753,[Mn+2],0.55,,3.5,1.11.1.16,5323.0,-0.2596373105057561,-0.2596373105057561,[Mn+2]__MSFKTLSALALALGAAVQFASAAVPLVQKRATCDDGRTTANAACCILFPILDDIQENLFDGAQCGEEVHESLRLTFHDAIGFSPTLGGGGADGSIIAFDTIETNFPANAGIDEIVSAQKPFVAKHNISAGDFIQFAGAVGVSNCPGGVRIPFFLGRPDAVAASPDHLVPEPFDSVDSILARMGDAGFSPVEVVWLLASHSIAAADKVDPSIPGTPFDSTPGVFDSQFFIETQLKGRLFPGTADNKGEAQSPLQGEIRLQSDHLLARDPQTACEWQSMVNNQPKIQNRFAATMSKMALLGQDKTKLIDCSDVIPTPPALVGAAHLPAGFSLSDVEQACAATPFPALTADPGPVTSVPPVPGS,./data/raw/alphafold//AF-O94753-F1-model_v4.pdb,1680,197,383,1676 +696,5341,5438,MTAPTVPVALVTGAAKRLGRSIAEGLHAEGYAVCLHYHRSAAEANALSATLNARRPNSAITVQADLSNVATAPVSGADGSAPVTLFTRCAELVAACYTHWGRCDVLVNNASSFYPTPLLRNDEDGHEPCVGDREAMETATADLFGSNAIAPYFLIKAFAHRFAGTPAKHRGTNYSIINMVDAMTNQPLLGYTIYTMAKGALEGLTRSAALELAPLQIRVNGVGPGLSVLVDDMPPAVWEGHRSKVPLYQRDSSAAEVSDVVIFLCSSKAKYITGTCVKVDGGYSLTRA,uniprot_search,Q01782,Cc1nc2c(N)[nH]c(=N)nc2nc1C(C)C,0.0012,30.0,5.816666666666666,1.5.1.33,5664.0,-2.920818753952376,-2.920818753952376,Cc1nc2c(N)[nH]c(=N)nc2nc1C(C)C__MTAPTVPVALVTGAAKRLGRSIAEGLHAEGYAVCLHYHRSAAEANALSATLNARRPNSAITVQADLSNVATAPVSGADGSAPVTLFTRCAELVAACYTHWGRCDVLVNNASSFYPTPLLRNDEDGHEPCVGDREAMETATADLFGSNAIAPYFLIKAFAHRFAGTPAKHRGTNYSIINMVDAMTNQPLLGYTIYTMAKGALEGLTRSAALELAPLQIRVNGVGPGLSVLVDDMPPAVWEGHRSKVPLYQRDSSAAEVSDVVIFLCSSKAKYITGTCVKVDGGYSLTRA,./data/raw/alphafold//AF-Q01782-F1-model_v4.pdb,128,2113,1530,2587 +697,3484,3557,MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG,brenda,P14902,CCc1c(C)cc2c(c1O)C(=O)C1=C(C2=O)C(C)(C)C(=O)C(C)(C(=O)OC)O1,0.00012,25.0,6.5,1.13.11.52,9606.0,-3.9208187539523753,-3.9208187539523753,CCc1c(C)cc2c(c1O)C(=O)C1=C(C2=O)C(C)(C)C(=O)C(C)(C(=O)OC)O1__MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG,./data/raw/alphafold//AF-P14902-F1-model_v4.pdb,872,2210,525,1832 +698,11709,11891,MQCLLREKPRSLALVNKDHALMFHSVPQNKNSLSVCVAEFTALSEKPLEGFRKISSHRIYGTLGLIELEGSNFLCVISGASEVARVRDKERVFRIMEVCFYSVNRSNWDHIRQENYSPDIPDGYDTDTQGYDSYKYAAEPFSSLRKLLTNGSFYFSLDFDITTRLQLRTSQTMTEPQYDSMHTQFMWNEFMLRQLIKFRSHLNGDEKSALDGCRFFTCAIRGFASTEQFKLGIQTIRLSLISRLSSLRAGTRFLSRGVDDDGNVANFVETETILDSSKYCVSYCQVRGSIPIFWEQEGVQMFGQKIDITRSLEATRAAFEKHFTSLIEEYGPVHIINLLGTGSGERSLSERLRQHIQLSPEKDLIHLTEFDYHSQIRSFEDANKIRPMIYSDAETFGFYFENNEGQSIVVQDGVFRTNCLDCLDRTNVIQNLVSRVFLEQVMIYTRQNAGYDFWQVHSTIWANNGDALARIYTGTGALKSSFTRKGKLSIAGALNDLSKSVGRMYINNFQDKGRQETIDLLLGRLIDQHPVILYDPIHEYVNHELRKRENEFSEHKNVKIFVASYNLNGCSATTKLENWLFPENTPLADIYVVGFQEIVQLTPQQVISADPAKRREWESCVKRLLNGKCTSGPGYVQLRSGQLVGTALMIFCKESCLPSIKNVEGTVKKTGLGGVSGNKGAVAIRFDYEDTGLCFITSHLAAGYTNYDERDHDYRTIASGLRFRRGRSIFNHDYVVWFGDFNYRISLTYEEVVPCIAQGKLSYLFEYDQLNKQMLTGKVFPFFSELPITFPPTYKFDIGTDIYDTSDKHRVPAWTDRILYRGELVPHSYQSVPLYYSDHRPIYATYEANIVKVDREKKKILFEELYNQRKQEVRDASQTSYTLIDIAGSVAGKPNLIPHLPANGVDKIKQPSSERSKWWFDDGLPAKSIAAPPGPEYRLNPSRPINPFEPTAEPDWISNTKQSFDKKSSLIDSIPALSPAPSSLARSSVSSQRSSTSIIPIKPNKPTKPDHLVAPRVKPLLPPRSGSSSSGVPAPNLTPVNVPPTPPPRKSSASQRSGDLLASSPEESSISWKPLV,sabio,O43001,[Mn+2],1.56,30.0,7.4,3.1.3.36,4896.0,0.1931245983544616,0.1931245983544616,[Mn+2]__MQCLLREKPRSLALVNKDHALMFHSVPQNKNSLSVCVAEFTALSEKPLEGFRKISSHRIYGTLGLIELEGSNFLCVISGASEVARVRDKERVFRIMEVCFYSVNRSNWDHIRQENYSPDIPDGYDTDTQGYDSYKYAAEPFSSLRKLLTNGSFYFSLDFDITTRLQLRTSQTMTEPQYDSMHTQFMWNEFMLRQLIKFRSHLNGDEKSALDGCRFFTCAIRGFASTEQFKLGIQTIRLSLISRLSSLRAGTRFLSRGVDDDGNVANFVETETILDSSKYCVSYCQVRGSIPIFWEQEGVQMFGQKIDITRSLEATRAAFEKHFTSLIEEYGPVHIINLLGTGSGERSLSERLRQHIQLSPEKDLIHLTEFDYHSQIRSFEDANKIRPMIYSDAETFGFYFENNEGQSIVVQDGVFRTNCLDCLDRTNVIQNLVSRVFLEQVMIYTRQNAGYDFWQVHSTIWANNGDALARIYTGTGALKSSFTRKGKLSIAGALNDLSKSVGRMYINNFQDKGRQETIDLLLGRLIDQHPVILYDPIHEYVNHELRKRENEFSEHKNVKIFVASYNLNGCSATTKLENWLFPENTPLADIYVVGFQEIVQLTPQQVISADPAKRREWESCVKRLLNGKCTSGPGYVQLRSGQLVGTALMIFCKESCLPSIKNVEGTVKKTGLGGVSGNKGAVAIRFDYEDTGLCFITSHLAAGYTNYDERDHDYRTIASGLRFRRGRSIFNHDYVVWFGDFNYRISLTYEEVVPCIAQGKLSYLFEYDQLNKQMLTGKVFPFFSELPITFPPTYKFDIGTDIYDTSDKHRVPAWTDRILYRGELVPHSYQSVPLYYSDHRPIYATYEANIVKVDREKKKILFEELYNQRKQEVRDASQTSYTLIDIAGSVAGKPNLIPHLPANGVDKIKQPSSERSKWWFDDGLPAKSIAAPPGPEYRLNPSRPINPFEPTAEPDWISNTKQSFDKKSSLIDSIPALSPAPSSLARSSVSSQRSSTSIIPIKPNKPTKPDHLVAPRVKPLLPPRSGSSSSGVPAPNLTPVNVPPTPPPRKSSASQRSGDLLASSPEESSISWKPLV,./data/raw/alphafold//AF-O43001-F1-model_v4.pdb,1470,1152,2487,1355 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+701,10383,10540,MSGADRSPNAGAAPDSAPGQAAVASAYQRFEPRAYLRNNYAPPRGDLCNPNGVGPWKLRCLAQTFATGEVSGRTLIDIGSGPTVYQLLSACSHFEDITMTDFLEVNRQELGRWLQEEPGAFNWSMYSQHACLIEGKGECWQDKERQLRARVKRVLPIDVHQPQPLGAGSPAPLPADALVSAFCLEAVSPDLASFQRALDHITTLLRPGGHLLLIGALEESWYLAGEARLTVVPVSEEEVREALVRSGYKVRDLRTYIMPAHLQTGVDDVKGVFFAWAQKVGL,uniprot_search,P11086,O=S(=O)(Nc1ccc(Cl)cc1)c1ccc2c(c1)CNCC2,0.00021,30.0,8.0,2.1.1.28,9606.0,-3.677780705266081,-3.677780705266081,O=S(=O)(Nc1ccc(Cl)cc1)c1ccc2c(c1)CNCC2__MSGADRSPNAGAAPDSAPGQAAVASAYQRFEPRAYLRNNYAPPRGDLCNPNGVGPWKLRCLAQTFATGEVSGRTLIDIGSGPTVYQLLSACSHFEDITMTDFLEVNRQELGRWLQEEPGAFNWSMYSQHACLIEGKGECWQDKERQLRARVKRVLPIDVHQPQPLGAGSPAPLPADALVSAFCLEAVSPDLASFQRALDHITTLLRPGGHLLLIGALEESWYLAGEARLTVVPVSEEEVREALVRSGYKVRDLRTYIMPAHLQTGVDDVKGVFFAWAQKVGL,./data/raw/alphafold//AF-P11086-F1-model_v4.pdb,17,1241,523,1828 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+753,3572,3646,MHSFPPLLLLLFWGVVSHSFPATLETQEQDVDLVQKYLEKYYNLKNDGRQVEKRRNSGPVVEKLKQMQEFFGLKVTGKPDAETLKVMKQPRCGVPDVAQFVLTEGNPRWEQTHLTYRIENYTPDLPRADVDHAIEKAFQLWSNVTPLTFTKVSEGQADIMISFVRGDHRDNSPFDGPGGNLAHAFQPGPGIGGDAHFDEDERWTNNFREYNLHRVAAHELGHSLGLSHSTDIGALMYPSYTFSGDVQLAQDDIDGIQAIYGRSQNPVQPIGPQTPKACDSKLTFDAITTIRGEVMFFKDRFYMRTNPFYPEVELNFISVFWPQLPNGLEAAYEFADRDEVRFFKGNKYWAVQGQNVLHGYPKDIYSSFGFPRTVKHIDAALSEENTGKTYFFVANKYWRYDEYKRSMDPGYPKMIAHDFPGIGHKVDAVFMKDGFFYFFHGTRQYKFDPKTKRILTLQKANSWFNCRKN,uniprot_search,P03956,CN(C)S(=O)(=O)N(CCC(O)=NO)Cc1ccc([N+](=O)[O-])cc1,3.8e-05,25.0,7.3125,3.4.24.7,9606.0,-4.42021640338319,-4.42021640338319,CN(C)S(=O)(=O)N(CCC(O)=NO)Cc1ccc([N+](=O)[O-])cc1__MHSFPPLLLLLFWGVVSHSFPATLETQEQDVDLVQKYLEKYYNLKNDGRQVEKRRNSGPVVEKLKQMQEFFGLKVTGKPDAETLKVMKQPRCGVPDVAQFVLTEGNPRWEQTHLTYRIENYTPDLPRADVDHAIEKAFQLWSNVTPLTFTKVSEGQADIMISFVRGDHRDNSPFDGPGGNLAHAFQPGPGIGGDAHFDEDERWTNNFREYNLHRVAAHELGHSLGLSHSTDIGALMYPSYTFSGDVQLAQDDIDGIQAIYGRSQNPVQPIGPQTPKACDSKLTFDAITTIRGEVMFFKDRFYMRTNPFYPEVELNFISVFWPQLPNGLEAAYEFADRDEVRFFKGNKYWAVQGQNVLHGYPKDIYSSFGFPRTVKHIDAALSEENTGKTYFFVANKYWRYDEYKRSMDPGYPKMIAHDFPGIGHKVDAVFMKDGFFYFFHGTRQYKFDPKTKRILTLQKANSWFNCRKN,./data/raw/alphafold//AF-P03956-F1-model_v4.pdb,403,1637,982,2378 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+755,3742,3819,MAPLCPSPWLPLLIPAPAPGLTVQLLLSLLLLVPVHPQRLPRMQEDSPLGGGSSGEDDPLGEEDLPSEEDSPREEDPPGEEDLPGEEDLPGEEDLPEVKPKSEEEGSLKLEDLPTVEAPGDPQEPQNNAHRDKEGDDQSHWRYGGDPPWPRVSPACAGRFQSPVDIRPQLAAFCPALRPLELLGFQLPPLPELRLRNNGHSVQLTLPPGLEMALGPGREYRALQLHLHWGAAGRPGSEHTVEGHRFPAEIHVVHLSTAFARVDEALGRPGGLAVLAAFLEEGPEENSAYEQLLSRLEEIAEEGSETQVPGLDISALLPSDFSRYFQYEGSLTTPPCAQGVIWTVFNQTVMLSAKQLHTLSDTLWGPGDSRLQLNFRATQPLNGRVIEASFPAGVDSSPRAAEPVQLNSCLAAGDILALVFGLLFAVTSVAFLVQMRRQHRRGTKGGVSYRPAEVAETGA,brenda,Q16790,CN1CCN(C(=O)c2ccc(S(N)(=O)=O)cc2)C[C@@H]1Cc1ccccc1,0.001716,40.0,9.0,4.2.1.1,9606.0,-2.765482716487313,-2.765482716487313,CN1CCN(C(=O)c2ccc(S(N)(=O)=O)cc2)C[C@@H]1Cc1ccccc1__MAPLCPSPWLPLLIPAPAPGLTVQLLLSLLLLVPVHPQRLPRMQEDSPLGGGSSGEDDPLGEEDLPSEEDSPREEDPPGEEDLPGEEDLPGEEDLPEVKPKSEEEGSLKLEDLPTVEAPGDPQEPQNNAHRDKEGDDQSHWRYGGDPPWPRVSPACAGRFQSPVDIRPQLAAFCPALRPLELLGFQLPPLPELRLRNNGHSVQLTLPPGLEMALGPGREYRALQLHLHWGAAGRPGSEHTVEGHRFPAEIHVVHLSTAFARVDEALGRPGGLAVLAAFLEEGPEENSAYEQLLSRLEEIAEEGSETQVPGLDISALLPSDFSRYFQYEGSLTTPPCAQGVIWTVFNQTVMLSAKQLHTLSDTLWGPGDSRLQLNFRATQPLNGRVIEASFPAGVDSSPRAAEPVQLNSCLAAGDILALVFGLLFAVTSVAFLVQMRRQHRRGTKGGVSYRPAEVAETGA,./data/raw/alphafold//AF-Q16790-F1-model_v4.pdb,1723,1455,774,2144 +756,3403,3476,MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,brenda,Q9Y5Y6,CC[C@H](C)[C@H](N=C(O)[C@H](CS)N=C(O)[C@H](C)N=C(O)CN=C(O)[C@@H]1CCCN1C(=O)[C@H](CS)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CO)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CS)N=C(O)[C@H](CCCCN)N=C(O)[C@H](CCCCN)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H](N=C(O)[C@H](CCCCN)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CS)N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)CN)[C@@H](C)CC)C(O)=N[C@@H](CS)C(O)=N[C@@H](CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](CC(=N)O)C(O)=NCC(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CS)C(O)=NCC(O)=N[C@@H](CO)C(O)=NCC(O)=N[C@@H](CO)C(O)=N[C@@H](CC(=O)O)C(=O)O,2.9e-07,25.0,7.6,3.4.21.109,9606.0,-6.537602002101044,-6.537602002101044,CC[C@H](C)[C@H](N=C(O)[C@H](CS)N=C(O)[C@H](C)N=C(O)CN=C(O)[C@@H]1CCCN1C(=O)[C@H](CS)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CO)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CS)N=C(O)[C@H](CCCCN)N=C(O)[C@H](CCCCN)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H](N=C(O)[C@H](CCCCN)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CS)N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)CN)[C@@H](C)CC)C(O)=N[C@@H](CS)C(O)=N[C@@H](CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](CC(=N)O)C(O)=NCC(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CS)C(O)=NCC(O)=N[C@@H](CO)C(O)=NCC(O)=N[C@@H](CO)C(O)=N[C@@H](CC(=O)O)C(=O)O__MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,./data/raw/alphafold//AF-Q9Y5Y6-F1-model_v4.pdb,489,1916,1302,2740 +757,1965,2016,MMTQSIRRSMLTVMATLPLLFSSATLHAQANSVQQQLEALEKSSGGRLGVALINTADNSQILYRADERFAMCSTSKVMAAAAVLKQSESDKHLLNQRVEIKKSDLVNYNPIAEKHVNGTMTLAELGAAALQYSDNTAMNKLIAHLGGPDKVTAFARSLGDETFRLDRTEPTLNTAIPGDPRDTTTPLAMAQTLKNLTLGKALAETQRAQLVTWLKGNTTGSASIQAGLPKSWVVGDKTGSGDYGTTNDIAIIWPENHAPLVLVTYFTQPDQKAESRRDVLAAAAKIVTHGF,sabio,Q8VKT5,CC(O)C1C(=O)N2C(C(=O)O)=C(SCCNC=N)CC12,0.0034,25.0,7.0,3.5.2.6,51288.0,-2.468521082957745,-2.468521082957745,CC(O)C1C(=O)N2C(C(=O)O)=C(SCCNC=N)CC12__MMTQSIRRSMLTVMATLPLLFSSATLHAQANSVQQQLEALEKSSGGRLGVALINTADNSQILYRADERFAMCSTSKVMAAAAVLKQSESDKHLLNQRVEIKKSDLVNYNPIAEKHVNGTMTLAELGAAALQYSDNTAMNKLIAHLGGPDKVTAFARSLGDETFRLDRTEPTLNTAIPGDPRDTTTPLAMAQTLKNLTLGKALAETQRAQLVTWLKGNTTGSASIQAGLPKSWVVGDKTGSGDYGTTNDIAIIWPENHAPLVLVTYFTQPDQKAESRRDVLAAAAKIVTHGF,./data/raw/alphafold//AF-Q8VKT5-F1-model_v4.pdb,173,1868,936,2671 +758,9441,9591,MASIPFFVEMKHFLGQSLLTSLLAAGAFGSSLAEVCTSSRIRTALPKDGAIAGISMDPDSITANPVYNASAGYSVFYPEGNFDYCNVTVSYCHIGKGDKVNLQYWLPSPDKFQNRYLATGGGGYAINSGTQSLPGGVMYGAVAGRTDGGFGGFDVQVSEAILYANGSLNYDSLYMFGYRAIGEQTMIGQELARGFYELGDEKKIYTYYQGCSEGGREGWSQIQKFPDLYDGVIPAAPAFRYGHQQVNHLFPGVIEQGMNYYPPPCEMARIVNATIEACDKLDGKIDGVVSRTDLCLLNFDFNSTIGLHYTCEAGSNPMTGDSTPAQNGTVSTKAAELARVLTEGLHDSQGNKAYVFYQITAGYDDADTKYNPATGQFELSVSSLGGEWVTKLLQLVDLDNLPNLDNVTVDTLVDWMQCGWQTYEDVLQTTRPDLSLYERAGGKILTFHGESDNSIPAGSSVHFYESVRNVMYPGISFNQSTDAMGEWYRLYLVPGAAHCSINALQPNGPFPQTTLEVMIDWVENGNTPTTLQATYLVGDNKGKPAEICPWPLRPTWTDEGSKLQCVYDHTSINTWMYDFNAFSLPVY,brenda,B7VFD0,O=C(O)c1cc(O)c(O)c(O)c1,0.45,30.0,5.85,3.1.1.20,409370.0,-0.3467874862246563,-0.3467874862246563,O=C(O)c1cc(O)c(O)c(O)c1__MASIPFFVEMKHFLGQSLLTSLLAAGAFGSSLAEVCTSSRIRTALPKDGAIAGISMDPDSITANPVYNASAGYSVFYPEGNFDYCNVTVSYCHIGKGDKVNLQYWLPSPDKFQNRYLATGGGGYAINSGTQSLPGGVMYGAVAGRTDGGFGGFDVQVSEAILYANGSLNYDSLYMFGYRAIGEQTMIGQELARGFYELGDEKKIYTYYQGCSEGGREGWSQIQKFPDLYDGVIPAAPAFRYGHQQVNHLFPGVIEQGMNYYPPPCEMARIVNATIEACDKLDGKIDGVVSRTDLCLLNFDFNSTIGLHYTCEAGSNPMTGDSTPAQNGTVSTKAAELARVLTEGLHDSQGNKAYVFYQITAGYDDADTKYNPATGQFELSVSSLGGEWVTKLLQLVDLDNLPNLDNVTVDTLVDWMQCGWQTYEDVLQTTRPDLSLYERAGGKILTFHGESDNSIPAGSSVHFYESVRNVMYPGISFNQSTDAMGEWYRLYLVPGAAHCSINALQPNGPFPQTTLEVMIDWVENGNTPTTLQATYLVGDNKGKPAEICPWPLRPTWTDEGSKLQCVYDHTSINTWMYDFNAFSLPVY,./data/raw/alphafold//AF-B7VFD0-F1-model_v4.pdb,1394,1050,2375,1235 +759,8783,8921,MISGILASPGIAFGKALLLKEDEIVIDRKKISADKVDQEVERFLSGRAKASAQLEAIKTKAGETFGEEKEAIFEGHIMLLEDEELEQEIIALIKDKHMTADAAAHEVIEGQATALEELDDEYLKERAADVRDIGKRLLRNILGLAIIDLSAIQEEVILVAADLTPSETAQLNLQKVLGFITDAGGRTSHTSIMARSLELPAIVGTGSVTAQVKNGDYLILDAVNNQVYVNPTNDVIEQLRAVQEQVATEKAELAKLKDLPAITLDGHQVEVCANIGTVRDVEGAERNGAEGVGLYRTEFLFMDRDALPTEEEQFAAYKAVAEACGSQAVIVRTMDIGGDKELPYMNFPKEENPFLGWRAVRIAMDRKEILRDQVRAILRASAFGKLRIMFPMIISVEEVRALRKEIEIYKQELRDEGKAFDESIEIGVMVETPAAATIARHLAKEVDFFSIGTNDLTQYTLAVDRGNDMISHLYQPMSPSVLNLIKQVIDASHAEGKWTGMCGELAGDERATLLLLGMGLDEFSMSAISIPRIKKIIRNTNFEDAKVLAEQALAQPTTDELMTLVNKFIEEKTIC,sabio,P0A249,O=C(O)C(=O)O,0.08,37.0,7.5,2.7.3.9,90371.0,-1.0969100130080565,-1.0969100130080565,O=C(O)C(=O)O__MISGILASPGIAFGKALLLKEDEIVIDRKKISADKVDQEVERFLSGRAKASAQLEAIKTKAGETFGEEKEAIFEGHIMLLEDEELEQEIIALIKDKHMTADAAAHEVIEGQATALEELDDEYLKERAADVRDIGKRLLRNILGLAIIDLSAIQEEVILVAADLTPSETAQLNLQKVLGFITDAGGRTSHTSIMARSLELPAIVGTGSVTAQVKNGDYLILDAVNNQVYVNPTNDVIEQLRAVQEQVATEKAELAKLKDLPAITLDGHQVEVCANIGTVRDVEGAERNGAEGVGLYRTEFLFMDRDALPTEEEQFAAYKAVAEACGSQAVIVRTMDIGGDKELPYMNFPKEENPFLGWRAVRIAMDRKEILRDQVRAILRASAFGKLRIMFPMIISVEEVRALRKEIEIYKQELRDEGKAFDESIEIGVMVETPAAATIARHLAKEVDFFSIGTNDLTQYTLAVDRGNDMISHLYQPMSPSVLNLIKQVIDASHAEGKWTGMCGELAGDERATLLLLGMGLDEFSMSAISIPRIKKIIRNTNFEDAKVLAEQALAQPTTDELMTLVNKFIEEKTIC,./data/raw/alphafold//AF-P0A249-F1-model_v4.pdb,1314,950,2260,1891 +760,6636,6748,MAKGFYISKSLGILGILLGVAAVCTIIALSVVYSQEKNKNANSSPVASTTPSASATTNPASATTLDQSKAWNRYRLPNTLKPDSYRVTLRPYLTPNDRGLYVFKGSSTVRFTCKEATDVIIIHSKKLNYTLSQGHRVVLRGVGGSQPPDIDKTELVEPTEYLVVHLKGSLVKDSQYEMDSEFEGELADDLAGFYRSEYMEGNVRKVVATTQMQAADARKSFPCFDEPAMKAEFNITLIHPKDLTALSNMLPKGPSTPLPEDPNWNVTEFHTTPKMSTYLLAFIVSEFDYVEKQASNGVLIRIWARPSAIAAGHGDYALNVTGPILNFFAGHYDTPYPLPKSDQIGLPDFNAGAMENWGLVTYRENSLLFDPLSSSSSNKERVVTVIAHELAHQWFGNLVTIEWWNDLWLNEGFASYVEYLGADYAEPTWNLKDLMVLNDVYRVMAVDALASSHPLSTPASEINTPAQISELFDAISYSKGASVLRMLSSFLSEDVFKQGLASYLHTFAYQNTIYLNLWDHLQEAVNNRSIQLPTTVRDIMNRWTLQMGFPVITVDTSTGTLSQEHFLLDPDSNVTRPSEFNYVWIVPITSIRDGRQQQDYWLIDVRAQNDLFSTSGNEWVLLNLNVTGYYRVNYDEENWRKIQTQLQRDHSAIPVINRAQIINDAFNLASAHKVPVTLALNNTLFLIEERQYMPWEAALSSLSYFKLMFDRSEVYGPMKNYLKKQVTPLFIHFRNNTNNWREIPENLMDQYSEVNAISTACSNGVPECEEMVSGLFKQWMENPNNNPIHPNLRSTVYCNAIAQGGEEEWDFAWEQFRNATLVNEADKLRAALACSKELWILNRYLSYTLNPDLIRKQDATSTIISITNNVIGQGLVWDFVQSNWKKLFNDYGGGSFSFSNLIQAVTRRFSTEYELQQLEQFKKDNEETGFGSGTRALEQALEKTKANIKWVKENKEVVLQWFTENSK,brenda,P15144,NC(CNC1CCCCC1)P(=O)(O)O,0.00069,25.0,7.09375,3.4.11.2,9606.0,-3.161150909262745,-3.161150909262745,NC(CNC1CCCCC1)P(=O)(O)O__MAKGFYISKSLGILGILLGVAAVCTIIALSVVYSQEKNKNANSSPVASTTPSASATTNPASATTLDQSKAWNRYRLPNTLKPDSYRVTLRPYLTPNDRGLYVFKGSSTVRFTCKEATDVIIIHSKKLNYTLSQGHRVVLRGVGGSQPPDIDKTELVEPTEYLVVHLKGSLVKDSQYEMDSEFEGELADDLAGFYRSEYMEGNVRKVVATTQMQAADARKSFPCFDEPAMKAEFNITLIHPKDLTALSNMLPKGPSTPLPEDPNWNVTEFHTTPKMSTYLLAFIVSEFDYVEKQASNGVLIRIWARPSAIAAGHGDYALNVTGPILNFFAGHYDTPYPLPKSDQIGLPDFNAGAMENWGLVTYRENSLLFDPLSSSSSNKERVVTVIAHELAHQWFGNLVTIEWWNDLWLNEGFASYVEYLGADYAEPTWNLKDLMVLNDVYRVMAVDALASSHPLSTPASEINTPAQISELFDAISYSKGASVLRMLSSFLSEDVFKQGLASYLHTFAYQNTIYLNLWDHLQEAVNNRSIQLPTTVRDIMNRWTLQMGFPVITVDTSTGTLSQEHFLLDPDSNVTRPSEFNYVWIVPITSIRDGRQQQDYWLIDVRAQNDLFSTSGNEWVLLNLNVTGYYRVNYDEENWRKIQTQLQRDHSAIPVINRAQIINDAFNLASAHKVPVTLALNNTLFLIEERQYMPWEAALSSLSYFKLMFDRSEVYGPMKNYLKKQVTPLFIHFRNNTNNWREIPENLMDQYSEVNAISTACSNGVPECEEMVSGLFKQWMENPNNNPIHPNLRSTVYCNAIAQGGEEEWDFAWEQFRNATLVNEADKLRAALACSKELWILNRYLSYTLNPDLIRKQDATSTIISITNNVIGQGLVWDFVQSNWKKLFNDYGGGSFSFSNLIQAVTRRFSTEYELQQLEQFKKDNEETGFGSGTRALEQALEKTKANIKWVKENKEVVLQWFTENSK,./data/raw/alphafold//AF-P15144-F1-model_v4.pdb,34,1264,550,1866 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+789,4372,4456,MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG,uniprot_search,P14902,COc1ccc2cc3[n+](cc2c1OC)CCc1cc2c(cc1-3)OCO2,0.008,25.0,7.033333333333334,1.13.11.52,9606.0,-2.096910013008056,-2.096910013008056,COc1ccc2cc3[n+](cc2c1OC)CCc1cc2c(cc1-3)OCO2__MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG,./data/raw/alphafold//AF-P14902-F1-model_v4.pdb,872,2210,525,1832 +790,3039,3107,MAGSEDKRVVGTLHLLLLQATVLSLTAGNLSLVSAAWTQEKNHHQPAHLNSSSLQQVAEGTSISEMWQNDLRPLLIERYPGSPGSYSARQHIMQRIQRLQAEWVVEVDTFLSRTPYGYRSFSNIISTLNPEAKRHLVLACHYDSKYFPRWDSRVFVGATDSAVPCAMMLELARALDKKLHSLKDVSGSKPDLSLRLIFFDGEEAFHHWSPQDSLYGSRHLAQKMASSPHPPGSRGTNQLDGMDLLVLLDLIGAANPTFPNFFPKTTRWFNRLQAIEKELYELGLLKDHSLERKYFQNFGYGNIIQDDHIPFLRKGVPVLHLIASPFPEVWHTMDDNEENLHASTIDNLNKIIQVFVLEYLHL,brenda,Q9CYK2,CCN(CC)CCS,0.0109,30.0,8.0,2.3.2.5,10090.0,-1.9625735020593764,-1.9625735020593764,CCN(CC)CCS__MAGSEDKRVVGTLHLLLLQATVLSLTAGNLSLVSAAWTQEKNHHQPAHLNSSSLQQVAEGTSISEMWQNDLRPLLIERYPGSPGSYSARQHIMQRIQRLQAEWVVEVDTFLSRTPYGYRSFSNIISTLNPEAKRHLVLACHYDSKYFPRWDSRVFVGATDSAVPCAMMLELARALDKKLHSLKDVSGSKPDLSLRLIFFDGEEAFHHWSPQDSLYGSRHLAQKMASSPHPPGSRGTNQLDGMDLLVLLDLIGAANPTFPNFFPKTTRWFNRLQAIEKELYELGLLKDHSLERKYFQNFGYGNIIQDDHIPFLRKGVPVLHLIASPFPEVWHTMDDNEENLHASTIDNLNKIIQVFVLEYLHL,./data/raw/alphafold//AF-Q9CYK2-F1-model_v4.pdb,418,1513,839,1718 +791,7673,7802,MGEDDAALRASGRGLSDPWADSVGVRPRTTERHIAVHKRLVLAFAVSIVALLAVTMLAVLLSLRFDECGASAAMPGTDGGLGGFPERGGNSSYPGSARRNHHAGEESSQREIGEVGTAGTPSAHPPSEEEQEQWQPWTQLRLSGHLKPLHYNLMLTAFMENFTFSGEVNVEIACQNATRYVVLHASRVAVEKVQVAEDRAFGAVPVAGFFLYPQTQVLVVVLNRTLDAQRHYNLKIIYNALIENELLGFFRSSYVIHGERRFLGVTQFSPTHARKAFPCFDEPIYKATFKISIKHQATYLSLSNMPVETSVFEEDGWVTDHFSQTPLMSTYYLAWAICNFTYRETTTKSGVVVRLYARPDAIRRGSGDYALHITKRLIEFYEDYFKVPYSLPKLDLLAVPKHPYAAMENWGLSIFVEQRILLDPSVSSISYLLDVTMVIVHEICHQWFGDLVTPVWWEDVWLKEGFAHYFEFVGTDYLYPSWNMEKQRFLTDVLHEVMLLDGLASSHPVSQEVLRATDIDKVFDWIAYKKGAALIRMLANFMGHSVFQRGLQDYLTIHKYGNAARNDLWNTLSEALKRNGKYVNIQEVMDQWTLQMGYPVITILGNMTAENRILITQQHFIYDIGAKTKALQLQNSSYLWQIPLTIVVGNRSHVSSEAIIWVSNKSEHHRITYLDKGSWILGNINQTGYFRVNYDLRNWRLLIDQLIRNHEVLSVSNRAGLIDDAFSLARAGYLPQNIPLEIIRYLSEEKDFLPWHAASRALYPLDKLLDRMENYNIFNEYILKQVATTYSKLGWPKNNFNGSVVQASYQHEELRREVIMLACSFGNKHCHQQASTLISDWISSNRNRIPLNVRDIVYCTGVSLLDEDVWEFIWMKFHSTTAVSEKKILLEALTCSDDRNLLSRLLNLSLNSEVVLDQDAIDVIIHVARNPHGRDLAWKFFRDKWKILNTRYGEALFMNSKLISGVTEFLNTEGELKELKNFMKSYDGVASASFSRAVETVEANVRWKRLYQDELFQWLGKAMRH,uniprot_search,Q10836,Nc1ccc(C(F)(F)F)cc1,0.00097,37.0,7.5,3.4.19.6,10116.0,-3.0132282657337552,-3.0132282657337552,Nc1ccc(C(F)(F)F)cc1__MGEDDAALRASGRGLSDPWADSVGVRPRTTERHIAVHKRLVLAFAVSIVALLAVTMLAVLLSLRFDECGASAAMPGTDGGLGGFPERGGNSSYPGSARRNHHAGEESSQREIGEVGTAGTPSAHPPSEEEQEQWQPWTQLRLSGHLKPLHYNLMLTAFMENFTFSGEVNVEIACQNATRYVVLHASRVAVEKVQVAEDRAFGAVPVAGFFLYPQTQVLVVVLNRTLDAQRHYNLKIIYNALIENELLGFFRSSYVIHGERRFLGVTQFSPTHARKAFPCFDEPIYKATFKISIKHQATYLSLSNMPVETSVFEEDGWVTDHFSQTPLMSTYYLAWAICNFTYRETTTKSGVVVRLYARPDAIRRGSGDYALHITKRLIEFYEDYFKVPYSLPKLDLLAVPKHPYAAMENWGLSIFVEQRILLDPSVSSISYLLDVTMVIVHEICHQWFGDLVTPVWWEDVWLKEGFAHYFEFVGTDYLYPSWNMEKQRFLTDVLHEVMLLDGLASSHPVSQEVLRATDIDKVFDWIAYKKGAALIRMLANFMGHSVFQRGLQDYLTIHKYGNAARNDLWNTLSEALKRNGKYVNIQEVMDQWTLQMGYPVITILGNMTAENRILITQQHFIYDIGAKTKALQLQNSSYLWQIPLTIVVGNRSHVSSEAIIWVSNKSEHHRITYLDKGSWILGNINQTGYFRVNYDLRNWRLLIDQLIRNHEVLSVSNRAGLIDDAFSLARAGYLPQNIPLEIIRYLSEEKDFLPWHAASRALYPLDKLLDRMENYNIFNEYILKQVATTYSKLGWPKNNFNGSVVQASYQHEELRREVIMLACSFGNKHCHQQASTLISDWISSNRNRIPLNVRDIVYCTGVSLLDEDVWEFIWMKFHSTTAVSEKKILLEALTCSDDRNLLSRLLNLSLNSEVVLDQDAIDVIIHVARNPHGRDLAWKFFRDKWKILNTRYGEALFMNSKLISGVTEFLNTEGELKELKNFMKSYDGVASASFSRAVETVEANVRWKRLYQDELFQWLGKAMRH,./data/raw/alphafold//AF-Q10836-F1-model_v4.pdb,617,2069,1475,1759 +792,7586,7715,MAKYTREDIEKLVKEENVKYIRLQFTDILGTIKNVEIPVSQLGKALDNKVMFDGSSIEGFVRIEESDMYLYPDLNTFVIFPWTAEKGKVARFICDIYNPDGTPFEGDPRNNLKRILKEMEDLGFSDFNLGPEPEFFLFKLDEKGEPTLELNDKGGYFDLAPTDLGENCRRDIVLELEEMGFEIEASHHEVAPGQHEIDFKYAGAVRSCDDIQTFKLVVKTIARKHGLHATFMPKPLFGVNGSGMHCNLSLFKNGVNAFFDENADLQLSETAKHFIAGIVKHATSFTAVTNPTVNSYKRLVPGYEAPCYVAWSAQNRSPLIRIPASRGISTRVEVRSVDPAANPYLALSVLLAAGLDGIKNKLEAPAPIDRNIYVMSKEERMENGIVDLPATLAEALEEFKSNEVMVKALGEHLFEHFIEAKEIEWDMFRTQVHPWEREQYMSQY,brenda,P12425,N[C@H]1CO[C@H]1C(=O)O,1.2,25.0,7.0,6.3.1.2,1423.0,0.0791812460476248,0.0791812460476248,N[C@H]1CO[C@H]1C(=O)O__MAKYTREDIEKLVKEENVKYIRLQFTDILGTIKNVEIPVSQLGKALDNKVMFDGSSIEGFVRIEESDMYLYPDLNTFVIFPWTAEKGKVARFICDIYNPDGTPFEGDPRNNLKRILKEMEDLGFSDFNLGPEPEFFLFKLDEKGEPTLELNDKGGYFDLAPTDLGENCRRDIVLELEEMGFEIEASHHEVAPGQHEIDFKYAGAVRSCDDIQTFKLVVKTIARKHGLHATFMPKPLFGVNGSGMHCNLSLFKNGVNAFFDENADLQLSETAKHFIAGIVKHATSFTAVTNPTVNSYKRLVPGYEAPCYVAWSAQNRSPLIRIPASRGISTRVEVRSVDPAANPYLALSVLLAAGLDGIKNKLEAPAPIDRNIYVMSKEERMENGIVDLPATLAEALEEFKSNEVMVKALGEHLFEHFIEAKEIEWDMFRTQVHPWEREQYMSQY,./data/raw/alphafold//AF-P12425-F1-model_v4.pdb,1049,221,1650,248 +793,11887,12069,MTTNAGPLHPYWPQHLRLDNFVPNDRPTWHILAGLFSVTGVLVVTTWLLSGRAAVVPLGTWRRLSLCWFAVCGFIHLVIEGWFVLYYEDLLGDQAFLSQLWKEYAKGDSRYILGDNFTVCMETITACLWGPLSLWVVIAFLRQHPLRFILQLVVSVGQIYGDVLYFLTEHRDGFQHGELGHPLYFWFYFVFMNALWLVLPGVLVLDAVKHLTHAQSTLDAKATKAKSKKN,uniprot_search,Q15125,c1ccc([C@H]2CC[C@H](N3CCN(C4CCCCC4)CC3)CC2)cc1,1.42e-05,40.0,7.5,5.3.3.5,9606.0,-4.847711655616943,-4.847711655616943,c1ccc([C@H]2CC[C@H](N3CCN(C4CCCCC4)CC3)CC2)cc1__MTTNAGPLHPYWPQHLRLDNFVPNDRPTWHILAGLFSVTGVLVVTTWLLSGRAAVVPLGTWRRLSLCWFAVCGFIHLVIEGWFVLYYEDLLGDQAFLSQLWKEYAKGDSRYILGDNFTVCMETITACLWGPLSLWVVIAFLRQHPLRFILQLVVSVGQIYGDVLYFLTEHRDGFQHGELGHPLYFWFYFVFMNALWLVLPGVLVLDAVKHLTHAQSTLDAKATKAKSKKN,./data/raw/alphafold//AF-Q15125-F1-model_v4.pdb,209,1562,1252,2277 +794,8262,8394,MEKTLAVNAGSSSLKWQLYEMPEETVIAKGIFERIGLSGSISTTKFNNEEHVRKQEIVDHRQAVLLLMDELIHFQLIHEFREITGIGHRVVAGGEFFKDSTIITPEVLAEIKNLSTLAPLHNPANVLGIEAFQRLLPDALAVAVFDTAFHSTLPEKAYRYPIPTKYYEDYSIRKYGAHGTSHMYVAQEAAKVLGKPLEELKIITAHIGNGASITAIEGGKSVDTSMGFTPLAGVMMGTRAGEMDASVIPYMLESDPSLRNAQDVIDILNKESGVLGVSELSSDMRDLSEAVAKGNPKAILAYEMYVDRLKKFIAQYFGVLNGADALIFTAGVGENDTAVRTDVVNGLSWFGMEIDESKNVRGAFGIISKPESKVKVLVVPTNEELVIARDVEAAK,brenda,A2RNG4,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,3.9,30.0,7.5,2.7.2.1,1358.0,0.5910646070264992,0.5910646070264992,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MEKTLAVNAGSSSLKWQLYEMPEETVIAKGIFERIGLSGSISTTKFNNEEHVRKQEIVDHRQAVLLLMDELIHFQLIHEFREITGIGHRVVAGGEFFKDSTIITPEVLAEIKNLSTLAPLHNPANVLGIEAFQRLLPDALAVAVFDTAFHSTLPEKAYRYPIPTKYYEDYSIRKYGAHGTSHMYVAQEAAKVLGKPLEELKIITAHIGNGASITAIEGGKSVDTSMGFTPLAGVMMGTRAGEMDASVIPYMLESDPSLRNAQDVIDILNKESGVLGVSELSSDMRDLSEAVAKGNPKAILAYEMYVDRLKKFIAQYFGVLNGADALIFTAGVGENDTAVRTDVVNGLSWFGMEIDESKNVRGAFGIISKPESKVKVLVVPTNEELVIARDVEAAK,./data/raw/alphafold//AF-A2RNG4-F1-model_v4.pdb,1730,1464,784,2155 +795,5457,5556,MASKPIEDYGKGKGRIEPMYIPDNTFYNADDFLVPPHCKPYIDKILLPGGLVKDRVEKLAYDIHRTYFGEELHIICILKGSRGFFNLLIDYLATIQKYSGRESSVPPFFEHYVRLKSYQNDNSTGQLTVLSDDLSIFRDKHVLIVEDIVDTGFTLTEFGERLKAVGPKSMRIATLVEKRTDRSNSLKGDFVGFSIEDVWIVGCCYDFNEMFRDFDHVAVLSDAARKKFEK,uniprot_search,Q26997,Cn1c(O)nc2ncnc-2c1O,1.4,37.0,8.016666666666667,2.4.2.22,5811.0,0.1461280356782379,0.1461280356782379,Cn1c(O)nc2ncnc-2c1O__MASKPIEDYGKGKGRIEPMYIPDNTFYNADDFLVPPHCKPYIDKILLPGGLVKDRVEKLAYDIHRTYFGEELHIICILKGSRGFFNLLIDYLATIQKYSGRESSVPPFFEHYVRLKSYQNDNSTGQLTVLSDDLSIFRDKHVLIVEDIVDTGFTLTEFGERLKAVGPKSMRIATLVEKRTDRSNSLKGDFVGFSIEDVWIVGCCYDFNEMFRDFDHVAVLSDAARKKFEK,./data/raw/alphafold//AF-Q26997-F1-model_v4.pdb,342,1776,1137,2555 +796,8182,8313,MDSLDQFIPPALQPLVGHLRTQAPLLGVTLLSLAAAYLGYLYVLGRKEAAVSFNVPIPPEIRANWKGEKWDSLQGEGRKVLEGQVRGIYPTPILSRSASNFLSPTQQWNDNLIMSYCPADGRVLGNGIKPATPDDVDRAVLAAKSAQLEWANTSFAERRKVLRTLLKYVLDHQDELVTACCLDSGKTKVDAAFGEILVTAEKLKWTLDHGEKALAPESRPTNFLMMYKKNMVTYEPLGVVSACVSWNYPFHNFISPVISAIFAGNGVVVKPSEQTAWSSAFFLEIIRGALSSCGHSRDLVQSIVCLPNVADHLTSHPDISQLTFIGSKPVAHKVCESAAKSLTPVTVELGGKDPALVLDDSRTVSEIPAIASILMRGVFQSAGQNCIGVERIIALPNAYDKLVETVSTRIARLRLGSILLDSQTSAGTPDVGAMISPASFDRLESLIADAVKQGARLICGGKRFQHPEHPLGHYFTPTLLVDVTPTMKIAQQELFAPVFLVMRASSVPHAISIANSTDYGLGASVFGYNQTDIAKCVANIKSGMVSVNDFGSYYAVQLPFGGVKGSGYGRFAGEEGLRGVSNIKAVCVDRFPKVMATRIPPRVDYPIRKGDGARQDGTGAWEMCKGVVETGYQITLGGRVSGILRLLSNM,brenda,A2R4V5,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O,22.95,37.0,9.0,1.2.1.24,5061.0,1.36078268987328,1.4313315918141694,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O__MDSLDQFIPPALQPLVGHLRTQAPLLGVTLLSLAAAYLGYLYVLGRKEAAVSFNVPIPPEIRANWKGEKWDSLQGEGRKVLEGQVRGIYPTPILSRSASNFLSPTQQWNDNLIMSYCPADGRVLGNGIKPATPDDVDRAVLAAKSAQLEWANTSFAERRKVLRTLLKYVLDHQDELVTACCLDSGKTKVDAAFGEILVTAEKLKWTLDHGEKALAPESRPTNFLMMYKKNMVTYEPLGVVSACVSWNYPFHNFISPVISAIFAGNGVVVKPSEQTAWSSAFFLEIIRGALSSCGHSRDLVQSIVCLPNVADHLTSHPDISQLTFIGSKPVAHKVCESAAKSLTPVTVELGGKDPALVLDDSRTVSEIPAIASILMRGVFQSAGQNCIGVERIIALPNAYDKLVETVSTRIARLRLGSILLDSQTSAGTPDVGAMISPASFDRLESLIADAVKQGARLICGGKRFQHPEHPLGHYFTPTLLVDVTPTMKIAQQELFAPVFLVMRASSVPHAISIANSTDYGLGASVFGYNQTDIAKCVANIKSGMVSVNDFGSYYAVQLPFGGVKGSGYGRFAGEEGLRGVSNIKAVCVDRFPKVMATRIPPRVDYPIRKGDGARQDGTGAWEMCKGVVETGYQITLGGRVSGILRLLSNM,./data/raw/alphafold//AF-A2R4V5-F1-model_v4.pdb,903,428,1788,502 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+800,11554,11731,MQCLLREKPRSLALVNKDHALMFHSVPQNKNSLSVCVAEFTALSEKPLEGFRKISSHRIYGTLGLIELEGSNFLCVISGASEVARVRDKERVFRIMEVCFYSVNRSNWDHIRQENYSPDIPDGYDTDTQGYDSYKYAAEPFSSLRKLLTNGSFYFSLDFDITTRLQLRTSQTMTEPQYDSMHTQFMWNEFMLRQLIKFRSHLNGDEKSALDGCRFFTCAIRGFASTEQFKLGIQTIRLSLISRLSSLRAGTRFLSRGVDDDGNVANFVETETILDSSKYCVSYCQVRGSIPIFWEQEGVQMFGQKIDITRSLEATRAAFEKHFTSLIEEYGPVHIINLLGTGSGERSLSERLRQHIQLSPEKDLIHLTEFDYHSQIRSFEDANKIRPMIYSDAETFGFYFENNEGQSIVVQDGVFRTNCLDCLDRTNVIQNLVSRVFLEQVMIYTRQNAGYDFWQVHSTIWANNGDALARIYTGTGALKSSFTRKGKLSIAGALNDLSKSVGRMYINNFQDKGRQETIDLLLGRLIDQHPVILYDPIHEYVNHELRKRENEFSEHKNVKIFVASYNLNGCSATTKLENWLFPENTPLADIYVVGFQEIVQLTPQQVISADPAKRREWESCVKRLLNGKCTSGPGYVQLRSGQLVGTALMIFCKESCLPSIKNVEGTVKKTGLGGVSGNKGAVAIRFDYEDTGLCFITSHLAAGYTNYDERDHDYRTIASGLRFRRGRSIFNHDYVVWFGDFNYRISLTYEEVVPCIAQGKLSYLFEYDQLNKQMLTGKVFPFFSELPITFPPTYKFDIGTDIYDTSDKHRVPAWTDRILYRGELVPHSYQSVPLYYSDHRPIYATYEANIVKVDREKKKILFEELYNQRKQEVRDASQTSYTLIDIAGSVAGKPNLIPHLPANGVDKIKQPSSERSKWWFDDGLPAKSIAAPPGPEYRLNPSRPINPFEPTAEPDWISNTKQSFDKKSSLIDSIPALSPAPSSLARSSVSSQRSSTSIIPIKPNKPTKPDHLVAPRVKPLLPPRSGSSSSGVPAPNLTPVNVPPTPPPRKSSASQRSGDLLASSPEESSISWKPLV,sabio,O43001,[Ca+2],0.668,30.0,7.4,3.1.3.36,4896.0,-0.1752235375244543,-0.1752235375244543,[Ca+2]__MQCLLREKPRSLALVNKDHALMFHSVPQNKNSLSVCVAEFTALSEKPLEGFRKISSHRIYGTLGLIELEGSNFLCVISGASEVARVRDKERVFRIMEVCFYSVNRSNWDHIRQENYSPDIPDGYDTDTQGYDSYKYAAEPFSSLRKLLTNGSFYFSLDFDITTRLQLRTSQTMTEPQYDSMHTQFMWNEFMLRQLIKFRSHLNGDEKSALDGCRFFTCAIRGFASTEQFKLGIQTIRLSLISRLSSLRAGTRFLSRGVDDDGNVANFVETETILDSSKYCVSYCQVRGSIPIFWEQEGVQMFGQKIDITRSLEATRAAFEKHFTSLIEEYGPVHIINLLGTGSGERSLSERLRQHIQLSPEKDLIHLTEFDYHSQIRSFEDANKIRPMIYSDAETFGFYFENNEGQSIVVQDGVFRTNCLDCLDRTNVIQNLVSRVFLEQVMIYTRQNAGYDFWQVHSTIWANNGDALARIYTGTGALKSSFTRKGKLSIAGALNDLSKSVGRMYINNFQDKGRQETIDLLLGRLIDQHPVILYDPIHEYVNHELRKRENEFSEHKNVKIFVASYNLNGCSATTKLENWLFPENTPLADIYVVGFQEIVQLTPQQVISADPAKRREWESCVKRLLNGKCTSGPGYVQLRSGQLVGTALMIFCKESCLPSIKNVEGTVKKTGLGGVSGNKGAVAIRFDYEDTGLCFITSHLAAGYTNYDERDHDYRTIASGLRFRRGRSIFNHDYVVWFGDFNYRISLTYEEVVPCIAQGKLSYLFEYDQLNKQMLTGKVFPFFSELPITFPPTYKFDIGTDIYDTSDKHRVPAWTDRILYRGELVPHSYQSVPLYYSDHRPIYATYEANIVKVDREKKKILFEELYNQRKQEVRDASQTSYTLIDIAGSVAGKPNLIPHLPANGVDKIKQPSSERSKWWFDDGLPAKSIAAPPGPEYRLNPSRPINPFEPTAEPDWISNTKQSFDKKSSLIDSIPALSPAPSSLARSSVSSQRSSTSIIPIKPNKPTKPDHLVAPRVKPLLPPRSGSSSSGVPAPNLTPVNVPPTPPPRKSSASQRSGDLLASSPEESSISWKPLV,./data/raw/alphafold//AF-O43001-F1-model_v4.pdb,1470,1152,2487,1355 +801,3886,3964,MAGLLHLVLLSTALGGLLRPAGSVFLPRDQAHRVLQRARRANSFLEEVKQGNLERECLEEACSLEEAREVFEDAEQTDEFWSKYKDGDQCEGHPCLNQGHCKDGIGDYTCTCAEGFEGKNCEFSTREICSLDNGGCDQFCREERSEVRCSCAHGYVLGDDSKSCVSTERFPCGKFTQGRSRRWAIHTSEDALDASELEHYDPADLSPTESSLDLLGLNRTEPSAGEDGSQVVRIVGGRDCAEGECPWQALLVNEENEGFCGGTILNEFYVLTAAHCLHQAKRFTVRVGDRNTEQEEGNEMAHEVEMTVKHSRFVKETYDFDIAVLRLKTPIRFRRNVAPACLPEKDWAEATLMTQKTGIVSGFGRTHEKGRLSSTLKMLEVPYVDRSTCKLSSSFTITPNMFCAGYDTQPEDACQGDSGGPHVTRFKDTYFVTGIVSWGEGCARKGKFGVYTKVSNFLKWIDKIMKARAGAAGSRGHSEAPATWTVPPPLPL,uniprot_search,P00743,COC(=O)C(Cc1cccc(C(=N)N)c1)N=C(O)NC12CC3CC(CC(C3)C1)C2,0.0009,25.0,8.0,3.4.21.6,9913.0,-3.0457574905606752,-3.0457574905606752,COC(=O)C(Cc1cccc(C(=N)N)c1)N=C(O)NC12CC3CC(CC(C3)C1)C2__MAGLLHLVLLSTALGGLLRPAGSVFLPRDQAHRVLQRARRANSFLEEVKQGNLERECLEEACSLEEAREVFEDAEQTDEFWSKYKDGDQCEGHPCLNQGHCKDGIGDYTCTCAEGFEGKNCEFSTREICSLDNGGCDQFCREERSEVRCSCAHGYVLGDDSKSCVSTERFPCGKFTQGRSRRWAIHTSEDALDASELEHYDPADLSPTESSLDLLGLNRTEPSAGEDGSQVVRIVGGRDCAEGECPWQALLVNEENEGFCGGTILNEFYVLTAAHCLHQAKRFTVRVGDRNTEQEEGNEMAHEVEMTVKHSRFVKETYDFDIAVLRLKTPIRFRRNVAPACLPEKDWAEATLMTQKTGIVSGFGRTHEKGRLSSTLKMLEVPYVDRSTCKLSSSFTITPNMFCAGYDTQPEDACQGDSGGPHVTRFKDTYFVTGIVSWGEGCARKGKFGVYTKVSNFLKWIDKIMKARAGAAGSRGHSEAPATWTVPPPLPL,./data/raw/alphafold//AF-P00743-F1-model_v4.pdb,347,2196,1457,1736 +802,4576,4662,MSGTDRSQAAGAVPDSDPGLAAVSSAYQRFEPRAYLRNNYAPPRGDLSCPDGVGPWKLRCLAQTFATGEVSGRTLIDIGSGPTIYQLLSACAHFEDITMTDFLEVNRQELRLWLREEPGAFDWSVYSQHVCLIEGKGESWQEKECQLRARVKRILPIDVHRPQPLGAGGLAPLPADALVSAFCLEAVSPDLASFQRALDHITTLLRPGGHLLLIGALEESWYLAGEARLAVVPVREEEVREALVRTATRCGICARTPMPAHLQTGVDDVKGIFFTRAQKKVGV,uniprot_search,P10938,CSc1ccc2c(c1)CNCC2,0.00061,34.0,7.9,2.1.1.28,9913.0,-3.214670164989233,-3.214670164989233,CSc1ccc2c(c1)CNCC2__MSGTDRSQAAGAVPDSDPGLAAVSSAYQRFEPRAYLRNNYAPPRGDLSCPDGVGPWKLRCLAQTFATGEVSGRTLIDIGSGPTIYQLLSACAHFEDITMTDFLEVNRQELRLWLREEPGAFDWSVYSQHVCLIEGKGESWQEKECQLRARVKRILPIDVHRPQPLGAGGLAPLPADALVSAFCLEAVSPDLASFQRALDHITTLLRPGGHLLLIGALEESWYLAGEARLAVVPVREEEVREALVRTATRCGICARTPMPAHLQTGVDDVKGIFFTRAQKKVGV,./data/raw/alphafold//AF-P10938-F1-model_v4.pdb,17,1241,523,1830 +803,756,768,MTGTVSRRKKIAMIGSGMIGGTMGYLCVLRELADVVLFDVVTGMPEGKALDDSQATSIADTNVSVTSANQYEKIAGSDVVIITAGLTKVPGKSDKEWSRNDLLPFNAKIIREVAQGVKKYCPLAFVIVVTNPLDCMVKCFHEASGLPKNMVCGMANVLDSARFRRFIADQLEISPRDIQATVIGTHGDHMLPLARYVTVSGFPLREFIKKGKMTEAKLAEIVERTKKAGGEIVRLLGQGSAYYAPALSAITMAQAFLKDEKRVLPCSVYCQGEYGLHDMFIGLPAVIGGGGIEQVIELELTHEEQECFRKSVDDVVELNKSLAALG,sabio,Q27797,CC(=O)C(=O)O,31.0,25.0,7.5,1.1.1.27,5811.0,1.4913616938342726,1.4446508512531553,CC(=O)C(=O)O__MTGTVSRRKKIAMIGSGMIGGTMGYLCVLRELADVVLFDVVTGMPEGKALDDSQATSIADTNVSVTSANQYEKIAGSDVVIITAGLTKVPGKSDKEWSRNDLLPFNAKIIREVAQGVKKYCPLAFVIVVTNPLDCMVKCFHEASGLPKNMVCGMANVLDSARFRRFIADQLEISPRDIQATVIGTHGDHMLPLARYVTVSGFPLREFIKKGKMTEAKLAEIVERTKKAGGEIVRLLGQGSAYYAPALSAITMAQAFLKDEKRVLPCSVYCQGEYGLHDMFIGLPAVIGGGGIEQVIELELTHEEQECFRKSVDDVVELNKSLAALG,./data/raw/alphafold//AF-Q27797-F1-model_v4.pdb,239,1535,864,2246 +804,11226,11394,MYRKLAVISAFLATARAQSACTLQSETHPPLTWQKCSSGGTCTQQTGSVVIDANWRWTHATNSSTNCYDGNTWSSTLCPDNETCAKNCCLDGAAYASTYGVTTSGNSLSIGFVTQSAQKNVGARLYLMASDTTYQEFTLLGNEFSFDVDVSQLPCGLNGALYFVSMDADGGVSKYPTNTAGAKYGTGYCDSQCPRDLKFINGQANVEGWEPSSNNANTGIGGHGSCCSEMDIWEANSISEALTPHPCTTVGQEICEGDGCGGTYSDNRYGGTCDPDGCDWNPYRLGNTSFYGPGSSFTLDTTKKLTVVTQFETSGAINRYYVQNGVTFQQPNAELGSYSGNELNDDYCTAEEAEFGGSSFSDKGGLTQFKKATSGGMVLVMSLWDDYYANMLWLDSTYPTNETSSTPGAVRGSCSTSSGVPAQVESQSPNAKVTFSNIKFGPIGSTGNPSGGNPPGGNRGTTTTRRPATTTGSSPGPTQSHYGQCGGIGYSGPTVCASGTTCQVLNPYYSQCL,brenda,P62694,OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O,24.0,44.0,5.75,3.2.1.91,51453.0,1.380211241711606,1.380211241711606,OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O__MYRKLAVISAFLATARAQSACTLQSETHPPLTWQKCSSGGTCTQQTGSVVIDANWRWTHATNSSTNCYDGNTWSSTLCPDNETCAKNCCLDGAAYASTYGVTTSGNSLSIGFVTQSAQKNVGARLYLMASDTTYQEFTLLGNEFSFDVDVSQLPCGLNGALYFVSMDADGGVSKYPTNTAGAKYGTGYCDSQCPRDLKFINGQANVEGWEPSSNNANTGIGGHGSCCSEMDIWEANSISEALTPHPCTTVGQEICEGDGCGGTYSDNRYGGTCDPDGCDWNPYRLGNTSFYGPGSSFTLDTTKKLTVVTQFETSGAINRYYVQNGVTFQQPNAELGSYSGNELNDDYCTAEEAEFGGSSFSDKGGLTQFKKATSGGMVLVMSLWDDYYANMLWLDSTYPTNETSSTPGAVRGSCSTSSGVPAQVESQSPNAKVTFSNIKFGPIGSTGNPSGGNPPGGNRGTTTTRRPATTTGSSPGPTQSHYGQCGGIGYSGPTVCASGTTCQVLNPYYSQCL,./data/raw/alphafold//AF-P62694-F1-model_v4.pdb,1618,118,294,1584 +805,2303,2362,MKPLFVLLLLLLLLDLAQAQGVLHRVPLRRHQSLRKKLRAQGQLSDFWRSHNLDMIEFSESCNVDKGINEPLINYLDMEYFGTVSIGSPSQNFTVIFDTGSSNLWVPSVYCTSPACKAHPVFHPSQSSTYMEVGNHFSIQYGTGSLTGIIGADQVSVEGLTVEGQQFGESVKEPGQTFVNAEFDGILGLGYPSLAVGGVTPVFDNMMAQNLVALPMFSVYLSSDPQGGSGSELTFGGYDPSHFSGSLNWIPVTKQGYWQIALDGIQVGDTVMFCSEGCQAIVDTGTSLITGPPKKIKQLQEAIGATPMDGEYAVDCATLNMMPNVTFLINGVSYTLSPTAYILPDLVDGMQFCGSGFQGLDIQPPAGPLWILGDVFIRKFYSVFDRGNNQVGLAPAVP,brenda,P16228,CCC(C)[C@H](N=C(O)CN=C(O)CN=C(O)[C@H](CS)N=C(O)[C@@H](N)CO)C(O)=N[C@H](C(O)=N[C@H](C(O)=N[C@H](C(O)=N[C@@H](CO)C(O)=N[C@@H](CS)C(O)=N[C@H](C(O)=N[C@@H](C)C(=O)O)C(C)CC)C(C)CC)C(C)CC)C(C)CC,5e-06,40.0,4.0,3.4.23.34,10116.0,-5.301029995663981,-5.301029995663981,CCC(C)[C@H](N=C(O)CN=C(O)CN=C(O)[C@H](CS)N=C(O)[C@@H](N)CO)C(O)=N[C@H](C(O)=N[C@H](C(O)=N[C@H](C(O)=N[C@@H](CO)C(O)=N[C@@H](CS)C(O)=N[C@H](C(O)=N[C@@H](C)C(=O)O)C(C)CC)C(C)CC)C(C)CC)C(C)CC__MKPLFVLLLLLLLLDLAQAQGVLHRVPLRRHQSLRKKLRAQGQLSDFWRSHNLDMIEFSESCNVDKGINEPLINYLDMEYFGTVSIGSPSQNFTVIFDTGSSNLWVPSVYCTSPACKAHPVFHPSQSSTYMEVGNHFSIQYGTGSLTGIIGADQVSVEGLTVEGQQFGESVKEPGQTFVNAEFDGILGLGYPSLAVGGVTPVFDNMMAQNLVALPMFSVYLSSDPQGGSGSELTFGGYDPSHFSGSLNWIPVTKQGYWQIALDGIQVGDTVMFCSEGCQAIVDTGTSLITGPPKKIKQLQEAIGATPMDGEYAVDCATLNMMPNVTFLINGVSYTLSPTAYILPDLVDGMQFCGSGFQGLDIQPPAGPLWILGDVFIRKFYSVFDRGNNQVGLAPAVP,./data/raw/alphafold//AF-P16228-F1-model_v4.pdb,550,1733,1086,2497 +806,2299,2358,MDFSRNLYDIGEQLDSEDLASLKFLSLDYIPQRKQEPIKDALMLFQRLQEKRMLEESNLSFLKELLFRINRLDLLITYLNTRKEEMERELQTPGRAQISAYRVMLYQISEEVSRSELRSFKFLLQEEISKCKLDDDMNLLDIFIEMEKRVILGEGKLDILKRVCAQINKSLLKIINDYEEFSKERSSSLEGSPDEFSNGEELCGVMTISDSPREQDSESQTLDKVYQMKSKPRGYCLIINNHNFAKAREKVPKLHSIRDRNGTHLDAGALTTTFEELHFEIKPHDDCTVEQIYEILKIYQLMDHSNMDCFICCILSHGDKGIIYGTDGQEAPIYELTSQFTGLKCPSLAGKPKVFFIQACQGDNYQKGIPVETDSEEQPYLEMDLSSPQTRYIPDEADFLLGMATVNNCVSYRNPAEGTWYIQSLCQSLRERCPRGDDILTILTEVNYEVSNKDDKKNMGKQMPQPTFTLRKKLVFPSD,uniprot_search,Q14790,CCC(C)[C@H](N=C(C)O)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@H](C(O)=N[C@H](C=O)CC(=O)O)C(C)O,1.05e-06,25.0,7.5,3.4.22.61,9606.0,-5.978810700930062,-5.978810700930062,CCC(C)[C@H](N=C(C)O)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@H](C(O)=N[C@H](C=O)CC(=O)O)C(C)O__MDFSRNLYDIGEQLDSEDLASLKFLSLDYIPQRKQEPIKDALMLFQRLQEKRMLEESNLSFLKELLFRINRLDLLITYLNTRKEEMERELQTPGRAQISAYRVMLYQISEEVSRSELRSFKFLLQEEISKCKLDDDMNLLDIFIEMEKRVILGEGKLDILKRVCAQINKSLLKIINDYEEFSKERSSSLEGSPDEFSNGEELCGVMTISDSPREQDSESQTLDKVYQMKSKPRGYCLIINNHNFAKAREKVPKLHSIRDRNGTHLDAGALTTTFEELHFEIKPHDDCTVEQIYEILKIYQLMDHSNMDCFICCILSHGDKGIIYGTDGQEAPIYELTSQFTGLKCPSLAGKPKVFFIQACQGDNYQKGIPVETDSEEQPYLEMDLSSPQTRYIPDEADFLLGMATVNNCVSYRNPAEGTWYIQSLCQSLRERCPRGDDILTILTEVNYEVSNKDDKKNMGKQMPQPTFTLRKKLVFPSD,./data/raw/alphafold//AF-Q14790-F1-model_v4.pdb,387,1791,1154,2574 +807,11848,12030,MAGSEDKRVVGTLHLLLLQATVLSLTAGNLSLVSAAWTQEKNHHQPAHLNSSSLQQVAEGTSISEMWQNDLRPLLIERYPGSPGSYSARQHIMQRIQRLQAEWVVEVDTFLSRTPYGYRSFSNIISTLNPEAKRHLVLACHYDSKYFPRWDSRVFVGATDSAVPCAMMLELARALDKKLHSLKDVSGSKPDLSLRLIFFDGEEAFHHWSPQDSLYGSRHLAQKMASSPHPPGSRGTNQLDGMDLLVLLDLIGAANPTFPNFFPKTTRWFNRLQAIEKELYELGLLKDHSLERKYFQNFGYGNIIQDDHIPFLRKGVPVLHLIASPFPEVWHTMDDNEENLHASTIDNLNKIIQVFVLEYLHL,brenda,Q9CYK2,c1c[nH]cn1,0.16,30.0,8.0,2.3.2.5,10090.0,-0.7958800173440752,-0.7958800173440752,c1c[nH]cn1__MAGSEDKRVVGTLHLLLLQATVLSLTAGNLSLVSAAWTQEKNHHQPAHLNSSSLQQVAEGTSISEMWQNDLRPLLIERYPGSPGSYSARQHIMQRIQRLQAEWVVEVDTFLSRTPYGYRSFSNIISTLNPEAKRHLVLACHYDSKYFPRWDSRVFVGATDSAVPCAMMLELARALDKKLHSLKDVSGSKPDLSLRLIFFDGEEAFHHWSPQDSLYGSRHLAQKMASSPHPPGSRGTNQLDGMDLLVLLDLIGAANPTFPNFFPKTTRWFNRLQAIEKELYELGLLKDHSLERKYFQNFGYGNIIQDDHIPFLRKGVPVLHLIASPFPEVWHTMDDNEENLHASTIDNLNKIIQVFVLEYLHL,./data/raw/alphafold//AF-Q9CYK2-F1-model_v4.pdb,418,1513,839,1718 +808,7952,8082,MDHSADAQRTDLMTITRFVLNEQSKQPEARGDFTILLSHIVLGCKFVCSAVNKAGLAKLIGLAGETNVQGEEQKKLDVLSNDVFVKALVSSGRTCILVSEEDEEATFVEPSKRGKYIVVFDPLDGSSNIDCGVSIGTIFGIYLVKENREPTIEDVLQPGKNMLAAGYCMYGSSCTFVLSTGSGVNGFTLDPSLGEFILTHPDIKVPKKGKIYSVNEGNAKNWDGPTTKYVENCKFPKDGSSPKSLRYVGSMVADVHRTFLYGGIFLYPADKKSPNGKLRVLYEVFPMSFLMEQAGGQAFTGKQRALDLVPTKLHERSPIFLGSYEDVEEIKALYAADQKLE,sabio,A0A5B9GD00,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O,0.11109,22.0,7.5,3.1.3.11,157791.0,-0.954325033230895,-0.954325033230895,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O__MDHSADAQRTDLMTITRFVLNEQSKQPEARGDFTILLSHIVLGCKFVCSAVNKAGLAKLIGLAGETNVQGEEQKKLDVLSNDVFVKALVSSGRTCILVSEEDEEATFVEPSKRGKYIVVFDPLDGSSNIDCGVSIGTIFGIYLVKENREPTIEDVLQPGKNMLAAGYCMYGSSCTFVLSTGSGVNGFTLDPSLGEFILTHPDIKVPKKGKIYSVNEGNAKNWDGPTTKYVENCKFPKDGSSPKSLRYVGSMVADVHRTFLYGGIFLYPADKKSPNGKLRVLYEVFPMSFLMEQAGGQAFTGKQRALDLVPTKLHERSPIFLGSYEDVEEIKALYAADQKLE,./data/raw/alphafold//AF-A0A5B9GD00-F1-model_v4.pdb,1173,764,2061,891 +809,9278,9426,MAKMRISPELKKLIEKYRCVKDTEGMSPAKVYKLVGENENLYLKMTDSRYKGTTYDVEREKDMMLWLEGKLPVPKVLHFERHDGWSNLLMSEADGVLCSEEYEDEQSPEKIIELYAECIRLFHSIDISDCPYTNSLDSRLAELDYLLNNDLADVDCENWEEDTPFKDPRELYDFLKTEKPEEELVFSHGDLGDSNIFVKDGKVSGFIDLGRSGRADKWYDIAFCVRSIREDIGEEQYVELFFDLLGIKPDWEKIKYYILLDELF,brenda,P0A3Y5,O=C(O)[C@@H](Cc1c[nH]c2ccccc12)NC(O)=NCC(O)=N[C@H]1CCOc2ccccc21,0.076,25.0,7.5,2.7.1.95,1351.0,-1.1191864077192086,-1.1220625721637545,O=C(O)[C@@H](Cc1c[nH]c2ccccc12)NC(O)=NCC(O)=N[C@H]1CCOc2ccccc21__MAKMRISPELKKLIEKYRCVKDTEGMSPAKVYKLVGENENLYLKMTDSRYKGTTYDVEREKDMMLWLEGKLPVPKVLHFERHDGWSNLLMSEADGVLCSEEYEDEQSPEKIIELYAECIRLFHSIDISDCPYTNSLDSRLAELDYLLNNDLADVDCENWEEDTPFKDPRELYDFLKTEKPEEELVFSHGDLGDSNIFVKDGKVSGFIDLGRSGRADKWYDIAFCVRSIREDIGEEQYVELFFDLLGIKPDWEKIKYYILLDELF,./data/raw/alphafold//AF-P0A3Y5-F1-model_v4.pdb,1054,611,1986,712 +810,5016,5111,MAWRQLKKRAQDAMVILGGGGLLFASYLTATGDEHFYAELLMPSLQRLLDPETAHRLAVRFTSLGLLPRTTFQDSDMLEVRVLGHKFRNPVGIAAGFDKHGEAVDGLYKMGFGFVEIGSVTPEPQEGNPRPRVFRLPEDQAIINRYGFNSHGLSVVEHRLRARQQTQARLTEDGLPLGINLGKNKTSVDAASDYAEGVRVLGPLADYLVVNVSSPNTAGLRSLQGKAELRRLLTKVLQERDALKVAHKPAVLVKIAPDLTAQDKEDIASVVRELGIDGLIVTNSTVSRPASLQGALRSEPGGLSGKPLRDLSTQTIREMYALTQGRVPIVGVGGVSSGQDALEKIRAGASLVQLYTALTYRGPPVVGGVKRELEALLKEQGFARVTDAIGADHRR,sabio,Q5E9W3,Cc1c(C(=O)O)[nH]c(=O)[nH]c1=O,0.0096,37.0,8.0,1.3.5.2,9913.0,-2.017728766960432,-2.017728766960432,Cc1c(C(=O)O)[nH]c(=O)[nH]c1=O__MAWRQLKKRAQDAMVILGGGGLLFASYLTATGDEHFYAELLMPSLQRLLDPETAHRLAVRFTSLGLLPRTTFQDSDMLEVRVLGHKFRNPVGIAAGFDKHGEAVDGLYKMGFGFVEIGSVTPEPQEGNPRPRVFRLPEDQAIINRYGFNSHGLSVVEHRLRARQQTQARLTEDGLPLGINLGKNKTSVDAASDYAEGVRVLGPLADYLVVNVSSPNTAGLRSLQGKAELRRLLTKVLQERDALKVAHKPAVLVKIAPDLTAQDKEDIASVVRELGIDGLIVTNSTVSRPASLQGALRSEPGGLSGKPLRDLSTQTIREMYALTQGRVPIVGVGGVSSGQDALEKIRAGASLVQLYTALTYRGPPVVGGVKRELEALLKEQGFARVTDAIGADHRR,./data/raw/alphafold//AF-Q5E9W3-F1-model_v4.pdb,816,326,1766,377 +811,10809,10968,MALKSLVLLSLLVLVLLLVRVQPSLGKETAAAKFERQHMDSSTSAASSSNYCNQMMKSRNLTKDRCKPVNTFVHESLADVQAVCSQKNVACKNGQTNCYQSYSTMSITDCRETGSSKYPNCAYKTTQANKHIIVACEGNPYVPVHFDASV,brenda,P61823,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.65,25.0,5.5,4.6.1.18,9913.0,-0.1870866433571444,-0.1870866433571444,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MALKSLVLLSLLVLVLLLVRVQPSLGKETAAAKFERQHMDSSTSAASSSNYCNQMMKSRNLTKDRCKPVNTFVHESLADVQAVCSQKNVACKNGQTNCYQSYSTMSITDCRETGSSKYPNCAYKTTQANKHIIVACEGNPYVPVHFDASV,./data/raw/alphafold//AF-P61823-F1-model_v4.pdb,601,2053,1459,1738 +812,1186,1212,MSSSPSFGLLAVAALLLALSLAQHGSLAATVGPRVIVVGAGMSGISAAKRLSEAGITDLLILEATDHIGGRMHKTNFAGINVELGANWVEGVNGGKMNPIWPIVNSTLKLRNFRSDFDYLAQNVYKEDGGVYDEDYVQKRIELADSVEEMGEKLSATLHASGRDDMSILAMQRLNEHQPNGPATPVDMVVDYYKFDYEFAEPPRVTSLQNTVPLATFSDFGDDVYFVADQRGYEAVVYYLAGQYLKTDDKSGKIVDPRLQLNKVVREIKYSPGGVTVKTEDNSVYSADYVMVSASLGVLQSDLIQFKPKLPTWKVRAIYQFDMAVYTKIFLKFPRKFWPEGKGREFFLYASSRRGYYGVWQEFEKQYPDANVLLVTVTDEESRRIEQQSDEQTKAEIMQVLRKMFPGKDVPDATDILVPRWWSDRFYKGTFSNWPVGVNRYEYDQLRAPVGRVYFTGEHTSEHYNGYVHGAYLSGIDSAEILINCAQKKMCKYHVQGKYD,brenda,O64411,CC(C)=CCNC(=N)NCCCCN,1.5e-05,25.0,6.5,1.5.3.14,4577.0,-4.823908740944319,-4.823908740944319,CC(C)=CCNC(=N)NCCCCN__MSSSPSFGLLAVAALLLALSLAQHGSLAATVGPRVIVVGAGMSGISAAKRLSEAGITDLLILEATDHIGGRMHKTNFAGINVELGANWVEGVNGGKMNPIWPIVNSTLKLRNFRSDFDYLAQNVYKEDGGVYDEDYVQKRIELADSVEEMGEKLSATLHASGRDDMSILAMQRLNEHQPNGPATPVDMVVDYYKFDYEFAEPPRVTSLQNTVPLATFSDFGDDVYFVADQRGYEAVVYYLAGQYLKTDDKSGKIVDPRLQLNKVVREIKYSPGGVTVKTEDNSVYSADYVMVSASLGVLQSDLIQFKPKLPTWKVRAIYQFDMAVYTKIFLKFPRKFWPEGKGREFFLYASSRRGYYGVWQEFEKQYPDANVLLVTVTDEESRRIEQQSDEQTKAEIMQVLRKMFPGKDVPDATDILVPRWWSDRFYKGTFSNWPVGVNRYEYDQLRAPVGRVYFTGEHTSEHYNGYVHGAYLSGIDSAEILINCAQKKMCKYHVQGKYD,./data/raw/alphafold//AF-O64411-F1-model_v4.pdb,1749,1246,529,1837 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+911,7323,7443,MWALDFLLSFLLIQLAAQVDSSGTWCYDSQDPKCGPAHWKELAPACGGPTQSPINIDLRLVQRDYTLKPFIFQGYDSAPQDPWVLENDGHTVLLRVNSCQQNCPAIRGAGLPSPEYRLLQLHFHWGSPGHQGSEHSLDEKHGSMEMHMVHMNTKYQSMEDARSQPDGFAILAVLLVEEDRDNTNFSAIVSGLKNLSSPGVAVNLTSTFALASLLPSALRLLRYYRYSGSLTTPGCEPAVLWTVFENTVPIGHAQVVQFQAVLQTGPPGLHPRPLTSNFRPQQPLGGRRISASPEASVRSSVSTLPCLHLALVGLGVGLRLWQGP,brenda,Q99N23,NS(=O)(=O)c1nnc(NS(=O)(=O)c2ccccc2)s1,7e-05,20.0,7.5,4.2.1.1,10090.0,-4.154901959985743,-4.154901959985743,NS(=O)(=O)c1nnc(NS(=O)(=O)c2ccccc2)s1__MWALDFLLSFLLIQLAAQVDSSGTWCYDSQDPKCGPAHWKELAPACGGPTQSPINIDLRLVQRDYTLKPFIFQGYDSAPQDPWVLENDGHTVLLRVNSCQQNCPAIRGAGLPSPEYRLLQLHFHWGSPGHQGSEHSLDEKHGSMEMHMVHMNTKYQSMEDARSQPDGFAILAVLLVEEDRDNTNFSAIVSGLKNLSSPGVAVNLTSTFALASLLPSALRLLRYYRYSGSLTTPGCEPAVLWTVFENTVPIGHAQVVQFQAVLQTGPPGLHPRPLTSNFRPQQPLGGRRISASPEASVRSSVSTLPCLHLALVGLGVGLRLWQGP,./data/raw/alphafold//AF-Q99N23-F1-model_v4.pdb,214,1569,901,2286 +912,11688,11870,MALYGFAQGLIQEAGIRIKQLMEQNLTIETKSNPNDLVTNVDKATEDFIFDTILETYPNHQVLGEEGHGHDIDTSKGTVWVVDPIDGTLNFVHQQENFAISIGIYIDGKPYAGFVYDVMADVLYHAKVGEGAYRGSQPLKPLNDSNLRQSIIGINPNWLTKPILGEIFKEIVNDSRSARAYGSAALEIVSVATGNLEAYMTPRLQPWDFAGGLVILYEVNGQASNLLGEPLTISGPNSILVGNRGLHQEISNDYLEPHHDALIQLHEQRFKRKSK,brenda,A0A1I9GET0,[Mg+2],88.0,30.0,7.5,3.1.3.25,1280.0,1.944482672150169,1.944482672150169,[Mg+2]__MALYGFAQGLIQEAGIRIKQLMEQNLTIETKSNPNDLVTNVDKATEDFIFDTILETYPNHQVLGEEGHGHDIDTSKGTVWVVDPIDGTLNFVHQQENFAISIGIYIDGKPYAGFVYDVMADVLYHAKVGEGAYRGSQPLKPLNDSNLRQSIIGINPNWLTKPILGEIFKEIVNDSRSARAYGSAALEIVSVATGNLEAYMTPRLQPWDFAGGLVILYEVNGQASNLLGEPLTISGPNSILVGNRGLHQEISNDYLEPHHDALIQLHEQRFKRKSK,./data/raw/alphafold//AF-A0A1I9GET0-F1-model_v4.pdb,1674,188,372,1665 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+915,11904,12087,MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG,brenda,P14902,c1ccc2c(c1)[nH]c1cnccc12,0.03,25.0,7.0,1.13.11.52,9606.0,-1.5228787452803376,-1.0227437154426735,c1ccc2c(c1)[nH]c1cnccc12__MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG,./data/raw/alphafold//AF-P14902-F1-model_v4.pdb,872,2210,525,1832 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+924,3456,3529,MAVQKEATLVRQIIRAAGGHAADVRELVAEHGPEAVTAVLVDEIVSRAPHPVNDVPVLVELAVRSGDALVPRRLAVAQGAPVRRAAPDDDGFVAMRVEYELDELVRELFGPCRERAAGTRGTTLFPYATSGTGHIDTYFLAAQQATATVLAGCTSAKPDLNELTSRYLTPKWGSLHWFTPHYDRHFREYRNEEVRVLEIGIGGYQHPEWGGGSLRMWKHFFHRGLIYGLDIEDKSHAEEQRITTVVGDQNDPGCLTELAARYGPFDIVIDDGSHINEHVRTSFHALFPHVRPGGLYVIEDLWTAYWPGFGGDSDPGKSDLTSLGLVKSLVDSLQHQELPEDSGRSPGYADRHVVGLHVYHNLAFIEKGVNSEGGIPGWIPRDFDALVAASSGGAA,uniprot_search,Q9ZHQ4,CC[C@H]1OC(=O)C[C@@H](O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](O)[C@H](C)O3)[C@H](N(C)C)[C@H]2O)[C@@H](CC=O)C[C@@H](C)C(=O)/C=C/C(C)=C/[C@@H]1CO[C@@H]1O[C@H](C)[C@@H](O)[C@@H](O)[C@H]1OC,0.067,42.0,8.15,2.1.1.102,1906.0,-1.1739251972991736,-1.3028617366160893,CC[C@H]1OC(=O)C[C@@H](O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](O)[C@H](C)O3)[C@H](N(C)C)[C@H]2O)[C@@H](CC=O)C[C@@H](C)C(=O)/C=C/C(C)=C/[C@@H]1CO[C@@H]1O[C@H](C)[C@@H](O)[C@@H](O)[C@H]1OC__MAVQKEATLVRQIIRAAGGHAADVRELVAEHGPEAVTAVLVDEIVSRAPHPVNDVPVLVELAVRSGDALVPRRLAVAQGAPVRRAAPDDDGFVAMRVEYELDELVRELFGPCRERAAGTRGTTLFPYATSGTGHIDTYFLAAQQATATVLAGCTSAKPDLNELTSRYLTPKWGSLHWFTPHYDRHFREYRNEEVRVLEIGIGGYQHPEWGGGSLRMWKHFFHRGLIYGLDIEDKSHAEEQRITTVVGDQNDPGCLTELAARYGPFDIVIDDGSHINEHVRTSFHALFPHVRPGGLYVIEDLWTAYWPGFGGDSDPGKSDLTSLGLVKSLVDSLQHQELPEDSGRSPGYADRHVVGLHVYHNLAFIEKGVNSEGGIPGWIPRDFDALVAASSGGAA,./data/raw/alphafold//AF-Q9ZHQ4-F1-model_v4.pdb,641,2094,1504,1789 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+930,2252,2309,MAAATTTTTTSSSISFSTKPSPSSSKSPLPISRFSLPFSLNPNKSSSSSRRRGIKSSSPSSISAVLNTTTNVTTTPSPTKPTKPETFISRFAPDQPRKGADILVEALERQGVETVFAYPGGASMEIHQALTRSSSIRNVLPRHEQGGVFAAEGYARSSGKPGICIATSGPGATNLVSGLADALLDSVPLVAITGQVPRRMIGTDAFQETPIVEVTRSITKHNYLVMDVEDIPRIIEEAFFLATSGRPGPVLVDVPKDIQQQLAIPNWEQAMRLPGYMSRMPKPPEDSHLEQIVRLISESKKPVLYVGGGCLNSSDELGRFVELTGIPVASTLMGLGSYPCDDELSLHMLGMHGTVYANYAVEHSDLLLAFGVRFDDRVTGKLEAFASRAKIVHIDIDSAEIGKNKTPHVSVCGDVKLALQGMNKVLENRAEELKLDFGVWRNELNVQKQKFPLSFKTFGEAIPPQYAIKVLDELTDGKAIISTGVGQHQMWAAQFYNYKKPRQWLSSGGLGAMGFGLPAAIGASVANPDAIVVDIDGDGSFIMNVQELATIRVENLPVKVLLLNNQHLGMVMQWEDRFYKANRAHTFLGDPAQEDEIFPNMLLFAAACGIPAARVTKKADLREAIQTMLDTPGPYLLDVICPHQEHVLPMIPSGGTFNDVITEGDGRIKY,sabio,P17597,CCC(C)C(N)C(=O)O,1.25,30.0,7.5,2.2.1.6,3702.0,0.0969100130080564,0.0969100130080564,CCC(C)C(N)C(=O)O__MAAATTTTTTSSSISFSTKPSPSSSKSPLPISRFSLPFSLNPNKSSSSSRRRGIKSSSPSSISAVLNTTTNVTTTPSPTKPTKPETFISRFAPDQPRKGADILVEALERQGVETVFAYPGGASMEIHQALTRSSSIRNVLPRHEQGGVFAAEGYARSSGKPGICIATSGPGATNLVSGLADALLDSVPLVAITGQVPRRMIGTDAFQETPIVEVTRSITKHNYLVMDVEDIPRIIEEAFFLATSGRPGPVLVDVPKDIQQQLAIPNWEQAMRLPGYMSRMPKPPEDSHLEQIVRLISESKKPVLYVGGGCLNSSDELGRFVELTGIPVASTLMGLGSYPCDDELSLHMLGMHGTVYANYAVEHSDLLLAFGVRFDDRVTGKLEAFASRAKIVHIDIDSAEIGKNKTPHVSVCGDVKLALQGMNKVLENRAEELKLDFGVWRNELNVQKQKFPLSFKTFGEAIPPQYAIKVLDELTDGKAIISTGVGQHQMWAAQFYNYKKPRQWLSSGGLGAMGFGLPAAIGASVANPDAIVVDIDGDGSFIMNVQELATIRVENLPVKVLLLNNQHLGMVMQWEDRFYKANRAHTFLGDPAQEDEIFPNMLLFAAACGIPAARVTKKADLREAIQTMLDTPGPYLLDVICPHQEHVLPMIPSGGTFNDVITEGDGRIKY,./data/raw/alphafold//AF-P17597-F1-model_v4.pdb,714,1708,1060,2464 +931,9614,9764,MYDHFNSPSIDILYDYGPFLKKCEMTGGIGSYSAGTPTPRVAIVGAGISGLVAATELLRAGVKDVVLYESRDRIGGRVWSQVFDQTRPRYIAEMGAMRFPPSATGLFHYLKKFGISTSTTFPDPGVVDTELHYRGKRYHWPAGKKPPELFRRVYEGWQSLLSEGYLLEGGSLVAPLDITAMLKSGRLEEAAIAWQGWLNVFRDCSFYNAIVCIFTGRHPPGGDRWARPEDFELFGSLGIGSGGFLPVFQAGFTEILRMVINGYQSDQRLIPDGISSLAARLADQSFDGKALRDRVCFSRVGRISREAEKIIIQTEAGEQRVFDRVIVTSSNRAMQMIHCLTDSESFLSRDVARAVRETHLTGSSKLFILTRTKFWIKNKLPTTIQSDGLVRGVYCLDYQPDEPEGHGVVLLSYTWEDDAQKMLAMPDKKTRCQVLVDDLAAIHPTFASYLLPVDGDYERYVLHHDWLTDPHSAGAFKLNYPGEDVYSQRLFFQPMTANSPNKDTGLYLAGCSCSFAGGWIEGAVQTALNSACAVLRSTGGQLSKGNPLDCINASYRY,uniprot_search,P06617,O=C([O-])C(=O)Cc1c[nH]c2ccccc12,40.0,25.0,8.3,1.13.12.3,29438.0,1.6020599913279625,1.6020599913279625,O=C([O-])C(=O)Cc1c[nH]c2ccccc12__MYDHFNSPSIDILYDYGPFLKKCEMTGGIGSYSAGTPTPRVAIVGAGISGLVAATELLRAGVKDVVLYESRDRIGGRVWSQVFDQTRPRYIAEMGAMRFPPSATGLFHYLKKFGISTSTTFPDPGVVDTELHYRGKRYHWPAGKKPPELFRRVYEGWQSLLSEGYLLEGGSLVAPLDITAMLKSGRLEEAAIAWQGWLNVFRDCSFYNAIVCIFTGRHPPGGDRWARPEDFELFGSLGIGSGGFLPVFQAGFTEILRMVINGYQSDQRLIPDGISSLAARLADQSFDGKALRDRVCFSRVGRISREAEKIIIQTEAGEQRVFDRVIVTSSNRAMQMIHCLTDSESFLSRDVARAVRETHLTGSSKLFILTRTKFWIKNKLPTTIQSDGLVRGVYCLDYQPDEPEGHGVVLLSYTWEDDAQKMLAMPDKKTRCQVLVDDLAAIHPTFASYLLPVDGDYERYVLHHDWLTDPHSAGAFKLNYPGEDVYSQRLFFQPMTANSPNKDTGLYLAGCSCSFAGGWIEGAVQTALNSACAVLRSTGGQLSKGNPLDCINASYRY,./data/raw/alphafold//AF-P06617-F1-model_v4.pdb,921,453,1813,529 +932,11323,11492,MKKVSTLDLLFVAIMGVSPAAFAADLIDVSKLPSKAAQGAPGPVTLQAAVGAGGADELKAIRSTTLPNGKQVTRYEQFHNGVRVVGEAITEVKGPGKSVAAQRSGHFVANIAADLPGSTTAAVSAEQVLAQAKSLKAQGRKTENDKVELVIRLGENNIAQLVYNVSYLIPGEGLSRPHFVIDAKTGEVLDQWEGLAHAEAGGPGGNQKIGKYTYGSDYGPLIVNDRCEMDDGNVITVDMNSSTDDSKTTPFRFACPTNTYKQVNGAYSPLNDAHFFGGVVFKLYRDWFGTSPLTHKLYMKVHYGRSVENAYWDGTAMLFGDGATMFYPLVSLDVAAHEVSHGFTEQNSGLIYRGQSGGMNEAFSDMAGEAAEFYMRGKNDFLIGYDIKKGSGALRYMDQPSRDGRSIDNASQYYNGIDVHHSSGVYNRAFYLLANSPGWDTRKAFEVFVDANRYYWTATSNYNSGACGVIRSAQNRNYSAADVTRAFSTVGVTCPSAL,brenda,P14756,ON=C(O)[C@H](Cc1ccccc1)N=C(O)OCc1ccccc1,0.021,25.0,7.5,3.4.24.26,287.0,-1.6777807052660807,-1.6777807052660807,ON=C(O)[C@H](Cc1ccccc1)N=C(O)OCc1ccccc1__MKKVSTLDLLFVAIMGVSPAAFAADLIDVSKLPSKAAQGAPGPVTLQAAVGAGGADELKAIRSTTLPNGKQVTRYEQFHNGVRVVGEAITEVKGPGKSVAAQRSGHFVANIAADLPGSTTAAVSAEQVLAQAKSLKAQGRKTENDKVELVIRLGENNIAQLVYNVSYLIPGEGLSRPHFVIDAKTGEVLDQWEGLAHAEAGGPGGNQKIGKYTYGSDYGPLIVNDRCEMDDGNVITVDMNSSTDDSKTTPFRFACPTNTYKQVNGAYSPLNDAHFFGGVVFKLYRDWFGTSPLTHKLYMKVHYGRSVENAYWDGTAMLFGDGATMFYPLVSLDVAAHEVSHGFTEQNSGLIYRGQSGGMNEAFSDMAGEAAEFYMRGKNDFLIGYDIKKGSGALRYMDQPSRDGRSIDNASQYYNGIDVHHSSGVYNRAFYLLANSPGWDTRKAFEVFVDANRYYWTATSNYNSGACGVIRSAQNRNYSAADVTRAFSTVGVTCPSAL,./data/raw/alphafold//AF-P14756-F1-model_v4.pdb,358,1756,1114,2528 +933,3062,3130,MRALVLLLSLFLLGGQAQHVSDWTYSEGALDEAHWPQHYPACGGQRQSPINLQRTKVRYNPSLKGLNMTGYETQAGEFPMVNNGHTVQISLPSTMRMTVADGTVYIAQQMHFHWGGASSEISGSEHTVDGIRHVIEIHIVHYNSKYKSYDIAQDAPDGLAVLAAFVEVKNYPENTYYSNFISHLANIKYPGQRTTLTGLDVQDMLPRNLQHYYTYHGSLTTPPCTENVHWFVLADFVKLSRTQVWKLENSLLDHRNKTIHNDYRRTQPLNHRVVESNFPNQEYTLGSEFQFYLHKIEEILDYLRRALN,brenda,P23280,CCN1CCCC1CN=C(O)c1cc(S(N)(=O)=O)ccc1OC,8e-07,20.0,7.5,4.2.1.1,9606.0,-6.096910013008056,-6.096910013008056,CCN1CCCC1CN=C(O)c1cc(S(N)(=O)=O)ccc1OC__MRALVLLLSLFLLGGQAQHVSDWTYSEGALDEAHWPQHYPACGGQRQSPINLQRTKVRYNPSLKGLNMTGYETQAGEFPMVNNGHTVQISLPSTMRMTVADGTVYIAQQMHFHWGGASSEISGSEHTVDGIRHVIEIHIVHYNSKYKSYDIAQDAPDGLAVLAAFVEVKNYPENTYYSNFISHLANIKYPGQRTTLTGLDVQDMLPRNLQHYYTYHGSLTTPPCTENVHWFVLADFVKLSRTQVWKLENSLLDHRNKTIHNDYRRTQPLNHRVVESNFPNQEYTLGSEFQFYLHKIEEILDYLRRALN,./data/raw/alphafold//AF-P23280-F1-model_v4.pdb,594,2044,1448,1727 +934,8007,8137,MKKAVHFGAGNIGRGFIGQILFENGFAIDFVDVNDKIINALNERHSYDIEIAEDGKRHITVSNVAGINNKENPQAVIDAVAETELITTAIGPNILPFIAQLIAKGIEKRRESQNQTPLDIIACENMIGGSAFLWQEVQKYLSADGLAFAKDYIGFPNAAVDRIVPAQVHEDPLFVVVEPFSEWVVETAAMKNPDLKLSSVHYEENLEPFIERKLFSVNSGHATTAYTGAYFGAKTVLEALKDQQVKEQVKAVLGEIRQLLMAKWQFKENDLKVYHDIIISRFENPYIVDDVTRVARTPIRKLGYDERFIRPIRELKDRGLSYEYLLQTVAYVFHYKDSNDEQSVQLKMLLQEKSLKAVVKEVTGLTDAALIEEIVTSVESLD,uniprot_search,A0A2J9QDZ8,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,2.0,25.0,6.2,1.1.1.17,1309.0,0.3010299956639812,0.3010299956639812,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O__MKKAVHFGAGNIGRGFIGQILFENGFAIDFVDVNDKIINALNERHSYDIEIAEDGKRHITVSNVAGINNKENPQAVIDAVAETELITTAIGPNILPFIAQLIAKGIEKRRESQNQTPLDIIACENMIGGSAFLWQEVQKYLSADGLAFAKDYIGFPNAAVDRIVPAQVHEDPLFVVVEPFSEWVVETAAMKNPDLKLSSVHYEENLEPFIERKLFSVNSGHATTAYTGAYFGAKTVLEALKDQQVKEQVKAVLGEIRQLLMAKWQFKENDLKVYHDIIISRFENPYIVDDVTRVARTPIRKLGYDERFIRPIRELKDRGLSYEYLLQTVAYVFHYKDSNDEQSVQLKMLLQEKSLKAVVKEVTGLTDAALIEEIVTSVESLD,./data/raw/alphafold//AF-A0A2J9QDZ8-F1-model_v4.pdb,819,785,2082,914 +935,106,106,MESLTLQPIARVDGTINLPGSKSVSNRALLLAALAHGKTVLTNLLDSDDVRHMLNALTALGVSYTLSADRTRCEIIGNGGPLHAEGALELFLGNAGTAMRPLAAALCLGSNDIVLTGEPRMKERPIGHLVDALRLGGAKITYLEQENYPPLRLQGGFTGGNVDVDGSVSSQFLTALLMTAPLAPEDTVIRIKGDLVSKPYIDITLNLMKTFGVEIENQHYQQFVVKGGQSYQSPGTYLVEGDASSASYFLAAAAIKGGTVKVTGIGRNSMQGDIRFADVLEKMGATICWGDDYISCTRGELNAIDMDMNHIPDAAMTIATAALFAKGTTTLRNIYNWRVKETDRLFAMATELRKVGAEVEEGHDYIRITPPEKLNFAEIATYNDHRMAMCFSLVALSDTPVTILDPKCTAKTFPDYFEQLARISQAA,sabio,P0A6D3,C(C(=O)O)NCP(=O)(O)O,0.00013,25.0,7.0,2.5.1.19,562.0,-3.886056647693164,-3.3106047127512794,C(C(=O)O)NCP(=O)(O)O__MESLTLQPIARVDGTINLPGSKSVSNRALLLAALAHGKTVLTNLLDSDDVRHMLNALTALGVSYTLSADRTRCEIIGNGGPLHAEGALELFLGNAGTAMRPLAAALCLGSNDIVLTGEPRMKERPIGHLVDALRLGGAKITYLEQENYPPLRLQGGFTGGNVDVDGSVSSQFLTALLMTAPLAPEDTVIRIKGDLVSKPYIDITLNLMKTFGVEIENQHYQQFVVKGGQSYQSPGTYLVEGDASSASYFLAAAAIKGGTVKVTGIGRNSMQGDIRFADVLEKMGATICWGDDYISCTRGELNAIDMDMNHIPDAAMTIATAALFAKGTTTLRNIYNWRVKETDRLFAMATELRKVGAEVEEGHDYIRITPPEKLNFAEIATYNDHRMAMCFSLVALSDTPVTILDPKCTAKTFPDYFEQLARISQAA,./data/raw/alphafold//AF-P0A6D3-F1-model_v4.pdb,1366,1011,2334,1876 +936,1717,1756,MATSASSHLNKGIKQMYMNLPQGEKIQLMYIWVDGTGEGLRCKTRTLDCDPKCVEELPEWNFDGSSTFQSEGSNSDMYLHPVAMFRDPFRRDPNKLVFCEVFKYNRKPAETNLRHSCKRIMDMVSSQHPWFGMEQEYTLMGTDGHPFGWPSNGFPGPQGPYYCGVGADKAYGRDIVEAHYRACLYAGIKITGTNAEVMPAQWEFQIGPCEGIRMGDHLWVARFILHRVCEDFGVIATFDPKPIPGNWNGAGCHTNFSTKAMREENGLRCIEEAIDKLSKRHQYHIRAYDPKGGLDNARRLTGFHETSNINDFSAGVANRSASIRIPRIVGQEKKGYFEDRRPSANCDPYAVTEAIVRTCLLNETGDEPFQYKN,brenda,P09606,CC(N)(CCC(=O)O)P(C)(=O)O,9.5,37.0,6.2,6.3.1.2,10116.0,0.9777236052888478,0.9777236052888478,CC(N)(CCC(=O)O)P(C)(=O)O__MATSASSHLNKGIKQMYMNLPQGEKIQLMYIWVDGTGEGLRCKTRTLDCDPKCVEELPEWNFDGSSTFQSEGSNSDMYLHPVAMFRDPFRRDPNKLVFCEVFKYNRKPAETNLRHSCKRIMDMVSSQHPWFGMEQEYTLMGTDGHPFGWPSNGFPGPQGPYYCGVGADKAYGRDIVEAHYRACLYAGIKITGTNAEVMPAQWEFQIGPCEGIRMGDHLWVARFILHRVCEDFGVIATFDPKPIPGNWNGAGCHTNFSTKAMREENGLRCIEEAIDKLSKRHQYHIRAYDPKGGLDNARRLTGFHETSNINDFSAGVANRSASIRIPRIVGQEKKGYFEDRRPSANCDPYAVTEAIVRTCLLNETGDEPFQYKN,./data/raw/alphafold//AF-P09606-F1-model_v4.pdb,918,679,111,2598 +937,6695,6808,MPKPDSEAGTAFIQTQQLHAAMADTFLEHMCRLDIDSAPITARNTGIICTIGPASRSVEMLKEMIKSGMNVARLNFSHGTHEYHAETIKNVRAATESFASDPILYRPVAVALDTKGPEIRTGLIKGSGTAEVELKKGATLKITLDNAYMEKCDENILWLDYKNICKVVEVGSKIYVDDGLISLQVKEKGADYLVTEVENGGSLGSKKGVNLPGAAVDLPAVSEKDIQDLKFGVEQDVDMVFASFIRKAADVHEVRKVLGEKGKNIKIISKIENHEGVRRFDEILEASDGIMVARGDLGIEIPAEKVFLAQKMMIGRCNRAGKPVICATQMLESMIKKPRPTRAEGSDVANAVLDGADCIMLSGETAKGDYPLEAVRMQHLIAREAEAAVFHRLLFEELARASSQSTDPLEAMAMGSVEASYKCLAAALIVLTESGRSAHQVARYRPRAPIIAVTRNPQTARQAHLYRGIFPVLCKDAVLDAWAEDVDLRVNLAMNVGKARGFFKKGDVVIVLTGWRPGSGFTNTMRVVPVP,sabio,P11980,NC(Cc1ccccc1)C(=O)O,0.11,25.0,7.4,2.7.1.40,10116.0,-0.958607314841775,-0.4793036574208875,NC(Cc1ccccc1)C(=O)O__MPKPDSEAGTAFIQTQQLHAAMADTFLEHMCRLDIDSAPITARNTGIICTIGPASRSVEMLKEMIKSGMNVARLNFSHGTHEYHAETIKNVRAATESFASDPILYRPVAVALDTKGPEIRTGLIKGSGTAEVELKKGATLKITLDNAYMEKCDENILWLDYKNICKVVEVGSKIYVDDGLISLQVKEKGADYLVTEVENGGSLGSKKGVNLPGAAVDLPAVSEKDIQDLKFGVEQDVDMVFASFIRKAADVHEVRKVLGEKGKNIKIISKIENHEGVRRFDEILEASDGIMVARGDLGIEIPAEKVFLAQKMMIGRCNRAGKPVICATQMLESMIKKPRPTRAEGSDVANAVLDGADCIMLSGETAKGDYPLEAVRMQHLIAREAEAAVFHRLLFEELARASSQSTDPLEAMAMGSVEASYKCLAAALIVLTESGRSAHQVARYRPRAPIIAVTRNPQTARQAHLYRGIFPVLCKDAVLDAWAEDVDLRVNLAMNVGKARGFFKKGDVVIVLTGWRPGSGFTNTMRVVPVP,./data/raw/alphafold//AF-P11980-F1-model_v4.pdb,1162,1813,1976,700 +938,9656,9806,MAKEWGYASHNGPDHWHELFPNAKGENQSPVELHTKDIRHDPSLQPWSVSYDGGSAKTILNNGKTCRVVFDDTYDRSMLRGGPLPGPYRLRQFHLHWGSSDDHGSEHTVDGVKYAAELHLVHWNPKYNTFKEALKQRDGIAVIGIFLKIGHENGEFQIFLDALDKIKTKGKEAPFTKFDPSCLFPACRDYWTYQGSFTTPPCEECIVWLLLKEPMTVSSDQMAKLRSLLSSAENEPPVPLVSNWRPPQPINNRVVRASFK,brenda,P07451,O=C([O-])[O-],0.01,20.0,8.3,4.2.1.1,5476.0,-2.0,-2.0,O=C([O-])[O-]__MAKEWGYASHNGPDHWHELFPNAKGENQSPVELHTKDIRHDPSLQPWSVSYDGGSAKTILNNGKTCRVVFDDTYDRSMLRGGPLPGPYRLRQFHLHWGSSDDHGSEHTVDGVKYAAELHLVHWNPKYNTFKEALKQRDGIAVIGIFLKIGHENGEFQIFLDALDKIKTKGKEAPFTKFDPSCLFPACRDYWTYQGSFTTPPCEECIVWLLLKEPMTVSSDQMAKLRSLLSSAENEPPVPLVSNWRPPQPINNRVVRASFK,./data/raw/alphafold//AF-P07451-F1-model_v4.pdb,446,1565,896,2280 +939,9933,10085,MKKYIYIYFFFITITINDLVINNTSKCVSIERRKNNAYINYGIGYNGPDNKITKSRRCKRIKLCKKDLIDIGAIKKPINVAIFGSTGSIGTNALNIIRECNKIENVFNVKALYVNKSVNELYEQAREFLPEYLCIHDKSVYEELKELVKNIKDYKPIILCGDEGMKEICSSNSIDKIVIGIDSFQGLYSTMYAIMNNKIVALANKESIVSAGFFLKKLLNIHKNAKIIPVDSEHSAIFQCLDNNKVLKTKCLQDNFSKINNINKIFLCSSGGPFQNLTMDELKNVTSENALKHPKWKMGKKITIDSATMMNKGLEVIETHFLFDVDYNDIEVIVHKECIIHSCVEFIDKSVISQMYYPDMQIPILYSLTWPDRIKTNLKPLDLAQVSTLTFHKPSLEHFPCIKLAYQAGIKGNFYPTVLNASNEIANNLFLNNKIKYFDISSIISQVLESFNSQKVSENSEDLMKQILQIHSWAKDKATDIYNKHNSS,brenda,O96693,O=CN(O)CCC(c1cccnc1)P(=O)(O)O,1.3e-05,22.0,7.5,1.1.1.267,5833.0,-4.886056647693163,-4.886056647693163,O=CN(O)CCC(c1cccnc1)P(=O)(O)O__MKKYIYIYFFFITITINDLVINNTSKCVSIERRKNNAYINYGIGYNGPDNKITKSRRCKRIKLCKKDLIDIGAIKKPINVAIFGSTGSIGTNALNIIRECNKIENVFNVKALYVNKSVNELYEQAREFLPEYLCIHDKSVYEELKELVKNIKDYKPIILCGDEGMKEICSSNSIDKIVIGIDSFQGLYSTMYAIMNNKIVALANKESIVSAGFFLKKLLNIHKNAKIIPVDSEHSAIFQCLDNNKVLKTKCLQDNFSKINNINKIFLCSSGGPFQNLTMDELKNVTSENALKHPKWKMGKKITIDSATMMNKGLEVIETHFLFDVDYNDIEVIVHKECIIHSCVEFIDKSVISQMYYPDMQIPILYSLTWPDRIKTNLKPLDLAQVSTLTFHKPSLEHFPCIKLAYQAGIKGNFYPTVLNASNEIANNLFLNNKIKYFDISSIISQVLESFNSQKVSENSEDLMKQILQIHSWAKDKATDIYNKHNSS,./data/raw/alphafold//AF-O96693-F1-model_v4.pdb,1429,1559,888,2271 +940,11256,11424,MKKTFKLILVLMLSLTLVFGLTAPIQAASDTAVSNVVNYSTDVIYQIVTDRFVDGNTSNNPTGDLYDPTHTSLKKYFGGDWQGIINKINDGYLTGMGVTAIWISQPVENIYAVLPDSTFGGSTSYHGYWARDFKRTNPYFGSFTDFQNLINTAHAHNIKVIIDFAPNHTSPASETDPTYAENGRLYDNGTLLGGYTNDTNGYFHHYGGTDFSSYEDGIYRNLFDLADLNQQNSTIDSYLKSAIKVWLDMGIDGIRLDAVKHMPFGWQKNFMDSILSYRPVFTFGEWFLGTNEIDVNNTYFANESGMSLLDFRFSQKVRQVFRDNTDTMYGLDSMIQSTASDYNFINDMVTFIDNHDMDRFYNGGSTRPVEQALAFTLTSRGVPAIYYGTEQYMTGNGDPYNRAMMTSFNTSTTAYNVIKKLAPLRKSNPAIAYGTTQQRWINNDVYIYERKFGNNVALVAINRNLSTSYNITGLYTALPAGTYTDVLGGLLNGNSISVASDGSVTPFTLSAGEVAVWQYVSSSNSPLIGHVGPTMTKAGQTITIDGRGFGTTSGQVLFGSTAGTIVSWDDTEVKVKVPSVTPGKYNISLKTSSGATSNTYNNINILTGNQICVRFVVNNASTVYGENVYLTGNVAELGNWDTSKAIGPMFNQVVYQYPTWYYDVSVPAGTTIQFKFIKKNGNTITWEGGSNHTYTVPSSSTGTVIVNWQQ,sabio,P26827,OC[C@H]1O[C@@H]2O[C@H]3[C@H](O)[C@@H](O)[C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@@H](O[C@H]6[C@H](O)[C@@H](O)[C@@H](O[C@H]7[C@H](O)[C@@H](O)[C@@H](O[C@H]8[C@H](O)[C@@H](O)[C@@H](O[C@H]9[C@H](O)[C@@H](O)[C@@H](O[C@H]1[C@H](O)[C@H]2O)O[C@@H]9CO)O[C@@H]8CO)O[C@@H]7CO)O[C@@H]6CO)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO,1.0,60.0,6.0,2.4.1.19,33950.0,0.0,0.0,OC[C@H]1O[C@@H]2O[C@H]3[C@H](O)[C@@H](O)[C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@@H](O[C@H]6[C@H](O)[C@@H](O)[C@@H](O[C@H]7[C@H](O)[C@@H](O)[C@@H](O[C@H]8[C@H](O)[C@@H](O)[C@@H](O[C@H]9[C@H](O)[C@@H](O)[C@@H](O[C@H]1[C@H](O)[C@H]2O)O[C@@H]9CO)O[C@@H]8CO)O[C@@H]7CO)O[C@@H]6CO)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO__MKKTFKLILVLMLSLTLVFGLTAPIQAASDTAVSNVVNYSTDVIYQIVTDRFVDGNTSNNPTGDLYDPTHTSLKKYFGGDWQGIINKINDGYLTGMGVTAIWISQPVENIYAVLPDSTFGGSTSYHGYWARDFKRTNPYFGSFTDFQNLINTAHAHNIKVIIDFAPNHTSPASETDPTYAENGRLYDNGTLLGGYTNDTNGYFHHYGGTDFSSYEDGIYRNLFDLADLNQQNSTIDSYLKSAIKVWLDMGIDGIRLDAVKHMPFGWQKNFMDSILSYRPVFTFGEWFLGTNEIDVNNTYFANESGMSLLDFRFSQKVRQVFRDNTDTMYGLDSMIQSTASDYNFINDMVTFIDNHDMDRFYNGGSTRPVEQALAFTLTSRGVPAIYYGTEQYMTGNGDPYNRAMMTSFNTSTTAYNVIKKLAPLRKSNPAIAYGTTQQRWINNDVYIYERKFGNNVALVAINRNLSTSYNITGLYTALPAGTYTDVLGGLLNGNSISVASDGSVTPFTLSAGEVAVWQYVSSSNSPLIGHVGPTMTKAGQTITIDGRGFGTTSGQVLFGSTAGTIVSWDDTEVKVKVPSVTPGKYNISLKTSSGATSNTYNNINILTGNQICVRFVVNNASTVYGENVYLTGNVAELGNWDTSKAIGPMFNQVVYQYPTWYYDVSVPAGTTIQFKFIKKNGNTITWEGGSNHTYTVPSSSTGTVIVNWQQ,./data/raw/alphafold//AF-P26827-F1-model_v4.pdb,1623,126,300,1590 +941,7754,7883,ILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLAIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHSLLGGVVDDQAGPGAWVRGVQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAG,uniprot_search,Q7M0F8,Nc1cccc(O)c1,1.91,37.0,8.0,2.3.2.13,10141.0,0.2810333672477275,0.2810333672477275,Nc1cccc(O)c1__ILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLAIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHSLLGGVVDDQAGPGAWVRGVQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAG,./data/raw/alphafold//AF-Q7M0F8-F1-model_v4.pdb,1754,1492,816,2190 +942,3288,3360,MIFLYQVVHFILFTSVSGECVTQLLKDTCFEGGDITTVFTPSAKYCQVVCTYHPRCLLFTFTAESPSEDPTRWFTCVLKDSVTETLPRVNRTAAISGYSFKQCSHQISACNKDIYVDLDMKGINYNSSVAKSAQECQERCTDDVHCHFFTYATRQFPSLEHRNICLLKHTQTGTPTRITKLDKVVSGFSLKSCALSNLACIRDIFPNTVFADSNIDSVMAPDAFVCGRICTHHPGCLFFTFFSQEWPKESQRNLCLLKTSESGLPSTRIKKSKALSGFSLQSCRHSIPVFCHSSFYHDTDFLGEELDIVAAKSHEACQKLCTNAVRCQFFTYTPAQASCNEGKGKCYLKLSSNGSPTKILHGRGGISGYTLRLCKMDNECTTKIKPRIVGGTASVRGEWPWQVTLHTTSPTQRHLCGGSIIGNQWILTAAHCFYGVESPKILRVYSGILNQSEIKEDTSFFGVQEIIIHDQYKMAESGYDIALLKLETTVNYTDSQRPICLPSKGDRNVIYTDCWVTGWGYRKLRDKIQNTLQKAKIPLVTNEECQKRYRGHKITHKMICAGYREGGKDACKGDSGGPLSCKHNEVWHLVGITSWGEGCAQRERPGVYTNVVEYVDWILEKTQAV,brenda,P03951,CC[C@H](C)[C@@H]1N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](C)N=C(O)[C@H](CCCCN)N=C(O)[C@@H]2CSSC[C@@H]3N=C(O)CN=C(O)CN=C(O)[C@H](Cc4ccc(O)cc4)N=C(O)[C@H](C(C)C)N=C(O)[C@H](Cc4ccccc4)N=C(O)[C@H]([C@@H](C)O)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CSSC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](C)N=C(O)[C@H](CO)N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc4ccccc4)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCCN)N=C(O)[C@H](C)N=C(O)[C@H](CCCNC(=N)N)N=C3O)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H]([C@@H](C)O)C(O)=N[C@H](C(O)=NCC(O)=NCC(O)=N[C@@H](C)C(=O)O)CSSC[C@H](N=C(O)[C@H](Cc3ccccc3)N=C(O)[C@H](CC(=O)O)N=C(O)[C@@H]3CCCN3C(=O)[C@@H](N)CCCNC(=N)N)C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCC(=O)O)C(=O)N3CCC[C@H]3C(=O)N3CCC[C@H]3C(O)=N[C@@H](Cc3ccc(O)cc3)C(O)=N[C@@H]([C@@H](C)O)C(O)=NCC(=O)N3CCC[C@H]3C(O)=N2)N=C(O)[C@H](CC(C)C)N=C(O)CN=C(O)[C@H](C)N=C(O)[C@H](CCCCN)N=C(O)[C@H](C)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](Cc2ccc(O)cc2)N=C(O)[C@H](Cc2ccccc2)N=C(O)[C@H](Cc2ccc(O)cc2)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H]([C@@H](C)CC)N=C1O,0.000627,37.0,7.5,3.4.21.27,9606.0,-3.202732459169284,-3.202732459169284,CC[C@H](C)[C@@H]1N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](C)N=C(O)[C@H](CCCCN)N=C(O)[C@@H]2CSSC[C@@H]3N=C(O)CN=C(O)CN=C(O)[C@H](Cc4ccc(O)cc4)N=C(O)[C@H](C(C)C)N=C(O)[C@H](Cc4ccccc4)N=C(O)[C@H]([C@@H](C)O)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CSSC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](C)N=C(O)[C@H](CO)N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc4ccccc4)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCCN)N=C(O)[C@H](C)N=C(O)[C@H](CCCNC(=N)N)N=C3O)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H]([C@@H](C)O)C(O)=N[C@H](C(O)=NCC(O)=NCC(O)=N[C@@H](C)C(=O)O)CSSC[C@H](N=C(O)[C@H](Cc3ccccc3)N=C(O)[C@H](CC(=O)O)N=C(O)[C@@H]3CCCN3C(=O)[C@@H](N)CCCNC(=N)N)C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCC(=O)O)C(=O)N3CCC[C@H]3C(=O)N3CCC[C@H]3C(O)=N[C@@H](Cc3ccc(O)cc3)C(O)=N[C@@H]([C@@H](C)O)C(O)=NCC(=O)N3CCC[C@H]3C(O)=N2)N=C(O)[C@H](CC(C)C)N=C(O)CN=C(O)[C@H](C)N=C(O)[C@H](CCCCN)N=C(O)[C@H](C)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](Cc2ccc(O)cc2)N=C(O)[C@H](Cc2ccccc2)N=C(O)[C@H](Cc2ccc(O)cc2)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H]([C@@H](C)CC)N=C1O__MIFLYQVVHFILFTSVSGECVTQLLKDTCFEGGDITTVFTPSAKYCQVVCTYHPRCLLFTFTAESPSEDPTRWFTCVLKDSVTETLPRVNRTAAISGYSFKQCSHQISACNKDIYVDLDMKGINYNSSVAKSAQECQERCTDDVHCHFFTYATRQFPSLEHRNICLLKHTQTGTPTRITKLDKVVSGFSLKSCALSNLACIRDIFPNTVFADSNIDSVMAPDAFVCGRICTHHPGCLFFTFFSQEWPKESQRNLCLLKTSESGLPSTRIKKSKALSGFSLQSCRHSIPVFCHSSFYHDTDFLGEELDIVAAKSHEACQKLCTNAVRCQFFTYTPAQASCNEGKGKCYLKLSSNGSPTKILHGRGGISGYTLRLCKMDNECTTKIKPRIVGGTASVRGEWPWQVTLHTTSPTQRHLCGGSIIGNQWILTAAHCFYGVESPKILRVYSGILNQSEIKEDTSFFGVQEIIIHDQYKMAESGYDIALLKLETTVNYTDSQRPICLPSKGDRNVIYTDCWVTGWGYRKLRDKIQNTLQKAKIPLVTNEECQKRYRGHKITHKMICAGYREGGKDACKGDSGGPLSCKHNEVWHLVGITSWGEGCAQRERPGVYTNVVEYVDWILEKTQAV,./data/raw/alphafold//AF-P03951-F1-model_v4.pdb,423,1834,1202,2628 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+958,10848,11008,LKPKSTTFVKLGIKAIALQYKSNYYYKCEKSENKKKDDDKSNIVNTSFLLFPRSSISKTPLRLANSIGLIDAGYRGEIIAALDNTSDQEYHIKKNDKLV,uniprot_search,Q9NFG1,O=c1nc(O)ccn1[C@H]1C[C@H](F)[C@@H](CO[Si](c2ccccc2)(c2ccccc2)c2ccccc2)O1,0.975,25.0,5.95,3.6.1.23,5833.0,-0.0109953843014631,-0.0109953843014631,O=c1nc(O)ccn1[C@H]1C[C@H](F)[C@@H](CO[Si](c2ccccc2)(c2ccccc2)c2ccccc2)O1__LKPKSTTFVKLGIKAIALQYKSNYYYKCEKSENKKKDDDKSNIVNTSFLLFPRSSISKTPLRLANSIGLIDAGYRGEIIAALDNTSDQEYHIKKNDKLV,./data/raw/alphafold//AF-Q9NFG1-F1-model_v4.pdb,233,1593,929,2316 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+1029,6588,6699,MAGYLRAVSSLCRASGSTRTWAPAALNVPSWPEQPRRHYAEKRIKVEKPVVEMDGDEMTRIIWQFIKEKLILPHVDVQLKYFDLGLPNRDQTNDQVTIDSALATQKYSVAVKCATITPDEARVEEFKLKKMWKSPNGTIRNILGGTVFREPIICKNIPRLVPGWTKPITIGRHAHGDQYKATDFVVDRAGMFKLVFTPKDGSGAKEWEVYNFPAGGVGMGMYNTDESISGFAHSCFQYSIQKKWPLYLSTKNTIMKAYDGRFKDIFQEIFDKHYKTDFDKNKIWYEHRLIDDMVAQVLKSSGGFVWACKNYDGDVQSDILAQGFGSLGLMTSVLVCPDGKTIEAEAAHGTVTRHYREHQKGRPTSTNPIASIFAWTRGLEHRGKLDGNQDLIRFAQTLEKVCVQTVESGAMTKDLAGCIHGLSNVKLNEHFLNTTDFLDTIKSNLDRALGKQ,sabio,P56574,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O,15.5,37.0,,1.1.1.42,10116.0,1.1903316981702914,1.3038495213961865,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O__MAGYLRAVSSLCRASGSTRTWAPAALNVPSWPEQPRRHYAEKRIKVEKPVVEMDGDEMTRIIWQFIKEKLILPHVDVQLKYFDLGLPNRDQTNDQVTIDSALATQKYSVAVKCATITPDEARVEEFKLKKMWKSPNGTIRNILGGTVFREPIICKNIPRLVPGWTKPITIGRHAHGDQYKATDFVVDRAGMFKLVFTPKDGSGAKEWEVYNFPAGGVGMGMYNTDESISGFAHSCFQYSIQKKWPLYLSTKNTIMKAYDGRFKDIFQEIFDKHYKTDFDKNKIWYEHRLIDDMVAQVLKSSGGFVWACKNYDGDVQSDILAQGFGSLGLMTSVLVCPDGKTIEAEAAHGTVTRHYREHQKGRPTSTNPIASIFAWTRGLEHRGKLDGNQDLIRFAQTLEKVCVQTVESGAMTKDLAGCIHGLSNVKLNEHFLNTTDFLDTIKSNLDRALGKQ,./data/raw/alphafold//AF-P56574-F1-model_v4.pdb,998,545,1933,642 +1030,8780,8918,MGEITNVMEYQAIAKQKLPKMIYDYYASGAEDEWTLKENREAFSRILFRPRILIDVSKIDMSATVLGFKISMPIMIAPSAMQKMAHPDGEYATARAASAAGTIMTLSSWATSSVEEVASTGPGIRFFQLYVYKDRNVVEQLVRRAERAGFKAIALTVDTPRLGRREADIKNRFVLPPYLTLKNFEGLDLAEMDKSNDSGLASYVAGQIDRTLSWKDVKWLQSITSLPILVKGVITAEDARLAVHSGAAGIIVSNHGARQLDYVPATISALEEVVTAAAGRIPVYLDGGVRRGTDVFKALALGAAGVFIGRPVVFALAAEGEAGVRNVLRMMREEFELTMALSGCTSLADITRAHIYTDADRLARPFPRL,sabio,Q10CE4,O=C(O)C(=O)O,2.09,30.0,8.0,1.1.3.15,4530.0,0.320146286111054,0.2634818923551659,O=C(O)C(=O)O__MGEITNVMEYQAIAKQKLPKMIYDYYASGAEDEWTLKENREAFSRILFRPRILIDVSKIDMSATVLGFKISMPIMIAPSAMQKMAHPDGEYATARAASAAGTIMTLSSWATSSVEEVASTGPGIRFFQLYVYKDRNVVEQLVRRAERAGFKAIALTVDTPRLGRREADIKNRFVLPPYLTLKNFEGLDLAEMDKSNDSGLASYVAGQIDRTLSWKDVKWLQSITSLPILVKGVITAEDARLAVHSGAAGIIVSNHGARQLDYVPATISALEEVVTAAAGRIPVYLDGGVRRGTDVFKALALGAAGVFIGRPVVFALAAEGEAGVRNVLRMMREEFELTMALSGCTSLADITRAHIYTDADRLARPFPRL,./data/raw/alphafold//AF-Q10CE4-F1-model_v4.pdb,1322,949,2259,1109 +1031,5167,5263,MPMKNDHSPDQRTLSELFEHNRQWAAEKQEKDPEYFSRLLSSQRPEFLWIGCSDSRVPANVVTGLQPGEVFVHRNVANLVHRADLNLLSVLEFAVGVLEIKHIIVCGHYGCGGVRAAMDGYGHGIIDNWLQPIRDIAQANQAELDTIENTQDRLDRLCELSVSSQVESLSRTPVLQSAWKDGKDIIVHGWMYNLKDGLLRDIGCDCTRNALQFACQPAE,brenda,A0A0H3GB68,Cc1ccc(S(N)(=O)=O)cc1,0.00158,20.0,8.3,4.2.1.1,29461.0,-2.8013429130455774,-2.52813406073176,Cc1ccc(S(N)(=O)=O)cc1__MPMKNDHSPDQRTLSELFEHNRQWAAEKQEKDPEYFSRLLSSQRPEFLWIGCSDSRVPANVVTGLQPGEVFVHRNVANLVHRADLNLLSVLEFAVGVLEIKHIIVCGHYGCGGVRAAMDGYGHGIIDNWLQPIRDIAQANQAELDTIENTQDRLDRLCELSVSSQVESLSRTPVLQSAWKDGKDIIVHGWMYNLKDGLLRDIGCDCTRNALQFACQPAE,./data/raw/alphafold//AF-A0A0H3GB68-F1-model_v4.pdb,31,1860,1230,2659 +1032,11637,11817,MALRACGLIIFRRCLIPKVDNNAIEFLLLQASDGIHHWTPPKGHVEPGEDDLETALRETQEEAGIEAGQLTIIEGFKRELNYVARNKPKTVIYWLAEVKDYDVEIRLSHEHQAYRWLGLEEACQLAQFKEMKAALQEGHQFLCSIEA,uniprot_search,P50583,[F-],0.02,30.0,7.4,3.6.1.17,9606.0,-1.6989700043360187,-1.6989700043360187,[F-]__MALRACGLIIFRRCLIPKVDNNAIEFLLLQASDGIHHWTPPKGHVEPGEDDLETALRETQEEAGIEAGQLTIIEGFKRELNYVARNKPKTVIYWLAEVKDYDVEIRLSHEHQAYRWLGLEEACQLAQFKEMKAALQEGHQFLCSIEA,./data/raw/alphafold//AF-P50583-F1-model_v4.pdb,1208,531,1896,614 +1033,5392,5490,MSGTDRSQAAGAVPDSDPGLAAVSSAYQRFEPRAYLRNNYAPPRGDLSCPDGVGPWKLRCLAQTFATGEVSGRTLIDIGSGPTIYQLLSACAHFEDITMTDFLEVNRQELRLWLREEPGAFDWSVYSQHVCLIEGKGESWQEKECQLRARVKRILPIDVHRPQPLGAGGLAPLPADALVSAFCLEAVSPDLASFQRALDHITTLLRPGGHLLLIGALEESWYLAGEARLAVVPVREEEVREALVRTATRCGICARTPMPAHLQTGVDDVKGIFFTRAQKKVGV,uniprot_search,P10938,Cl.Cl.NCc1ccc2c(c1)CNCC2,1.9,34.0,7.9,2.1.1.28,9913.0,0.2787536009528289,0.2787536009528289,Cl.Cl.NCc1ccc2c(c1)CNCC2__MSGTDRSQAAGAVPDSDPGLAAVSSAYQRFEPRAYLRNNYAPPRGDLSCPDGVGPWKLRCLAQTFATGEVSGRTLIDIGSGPTIYQLLSACAHFEDITMTDFLEVNRQELRLWLREEPGAFDWSVYSQHVCLIEGKGESWQEKECQLRARVKRILPIDVHRPQPLGAGGLAPLPADALVSAFCLEAVSPDLASFQRALDHITTLLRPGGHLLLIGALEESWYLAGEARLAVVPVREEEVREALVRTATRCGICARTPMPAHLQTGVDDVKGIFFTRAQKKVGV,./data/raw/alphafold//AF-P10938-F1-model_v4.pdb,17,1241,523,1830 +1034,5924,6023,MELRKGLEDIAIKETSITYIDGELGRLYYRGYSIFDLASFSNFEEVAYLLWYGKLPTRHELDDFKSRLAEERSISEDISTFVKRTAKFGNPMDILRTTVSMMGLEDRSEGDLIGKAIKMTAKIPTIISLIQRTRRNQEFVEPDPSLSHSENFLYMIRGERPSPSDTRVLDVSLMLHMDHEMNASTMACLVVASTLSDIYSSVVAGISALKGPLHGGANSEALKQFMEIETPDNVEKYVMNKLSSGQRLMGFGHRIYKTMDPRAKILKEYANQLSKNEEIKRLFEIANRVEEIGIKILGKRGIYPNVDFYSGLVFYAMGFDPDLFPTIFASARVIGWTAHVDEYLKDNKLIRPKAIYVGDLGKRYVPIEER,brenda,A4YGX6,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,4.41,25.0,8.0,2.3.3.16,43687.0,0.6444385894678386,0.7726758286027537,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MELRKGLEDIAIKETSITYIDGELGRLYYRGYSIFDLASFSNFEEVAYLLWYGKLPTRHELDDFKSRLAEERSISEDISTFVKRTAKFGNPMDILRTTVSMMGLEDRSEGDLIGKAIKMTAKIPTIISLIQRTRRNQEFVEPDPSLSHSENFLYMIRGERPSPSDTRVLDVSLMLHMDHEMNASTMACLVVASTLSDIYSSVVAGISALKGPLHGGANSEALKQFMEIETPDNVEKYVMNKLSSGQRLMGFGHRIYKTMDPRAKILKEYANQLSKNEEIKRLFEIANRVEEIGIKILGKRGIYPNVDFYSGLVFYAMGFDPDLFPTIFASARVIGWTAHVDEYLKDNKLIRPKAIYVGDLGKRYVPIEER,./data/raw/alphafold//AF-A4YGX6-F1-model_v4.pdb,904,429,1789,503 +1035,6491,6601,MAQADIALIGLAVMGQNLILNMNDHGFVVCAFNRTVSKVDDFLANEAKGTKVLGAHSLEEMVSKLKKPRRIILLVKAGQAVDNFIEKLVPLLDIGDIIIDGGNSEYRDTMRRCRDLKDKGILFVGSGVSGGEDGARYGPSLMPGGNKEAWPHIKAIFQGIAAKVGTGEPCCDWVGDDGAGHFVKMVHNGIEYGDMQLICEAYHLMKDVLGLGHKEMAKAFEEWNKTELDSFLIEITASILKFQDADGKHLLPKIRDSAGQKGTGKWTAISALEYGVPVTLIGEAVFARCLSSLKDERIQASKKLKGPQNIPFEGDKKSFLEDIRKALYASKIISYAQGFMLLRQAATEFGWTLNYGGIALMWRGGCIIRSVFLGKIKDAFDRNPGLQNLLLDDFFKSAVENCQDSWRRAISTGVQAGIPMPCFTTALSFYDGYRHAMLPANLIQAQRDYFGAHTYELLAKPGQFIHTNWTGHGGSVSSSSYNA,sabio,P00349,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1,0.0008,,7.0,1.1.1.44,9940.0,-3.096910013008056,-3.096910013008056,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1__MAQADIALIGLAVMGQNLILNMNDHGFVVCAFNRTVSKVDDFLANEAKGTKVLGAHSLEEMVSKLKKPRRIILLVKAGQAVDNFIEKLVPLLDIGDIIIDGGNSEYRDTMRRCRDLKDKGILFVGSGVSGGEDGARYGPSLMPGGNKEAWPHIKAIFQGIAAKVGTGEPCCDWVGDDGAGHFVKMVHNGIEYGDMQLICEAYHLMKDVLGLGHKEMAKAFEEWNKTELDSFLIEITASILKFQDADGKHLLPKIRDSAGQKGTGKWTAISALEYGVPVTLIGEAVFARCLSSLKDERIQASKKLKGPQNIPFEGDKKSFLEDIRKALYASKIISYAQGFMLLRQAATEFGWTLNYGGIALMWRGGCIIRSVFLGKIKDAFDRNPGLQNLLLDDFFKSAVENCQDSWRRAISTGVQAGIPMPCFTTALSFYDGYRHAMLPANLIQAQRDYFGAHTYELLAKPGQFIHTNWTGHGGSVSSSSYNA,./data/raw/alphafold//AF-P00349-F1-model_v4.pdb,125,1240,522,515 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+1037,3854,3932,MNLLVTSSLGVLLHLVVLCQADDHSELLVNTKSGKVMGTRVPVLSSHISAFLGIPFAEPPVGNMRFRRPEPKKPWSGVWNASTYPNNCQQYVDEQFPGFSGSEMWNPNREMSEDCLYLNIWVPSPRPKSTTVMVWIYGGGFYSGSSTLDVYNGKYLAYTEEVVLVSLSYRVGAFGFLALHGSQEAPGNVGLLDQRMALQWVHDNIQFFGGDPKTVTIFGESAGGASVGMHILSPGSRDLFRRAILQSGSPNCPWASVSVAEGRRRAVELGRNLNCNLNSDEELIHCLREKKPQELIDVEWNVLPFDSIFRFSFVPVIDGEFFPTSLESMLNSGNFKKTQILLGVNKDEGSFFLLYGAPGFSKDSESKISREDFMSGVKLSVPHANDLGLDAVTLQYTDWMDDNNGIKNRDGLDDIVGDHNVICPLMHFVNKYTKFGNGTYLYFFNHRASNLVWPEWMGVIHGYEIEFVFGLPLVKELNYTAEEEALSRRIMHYWATFAKTGNPNEPHSQESKWPLFTTKEQKFIDLNTEPMKVHQRLRVQMCVFWNQFLPKLLNATACDGELSSSGTSSSKGIIFYVLFSILYLIF,uniprot_search,P04058,CN[C@@H]1CCC2=CC3=CC[C@@]4(C)[C@H](C(C)(C)N(C)C)CCCC4(C)[C@H]3CCC2C1(C)C,0.11,23.0,7.5,3.1.1.7,7787.0,-0.958607314841775,-0.958607314841775,CN[C@@H]1CCC2=CC3=CC[C@@]4(C)[C@H](C(C)(C)N(C)C)CCCC4(C)[C@H]3CCC2C1(C)C__MNLLVTSSLGVLLHLVVLCQADDHSELLVNTKSGKVMGTRVPVLSSHISAFLGIPFAEPPVGNMRFRRPEPKKPWSGVWNASTYPNNCQQYVDEQFPGFSGSEMWNPNREMSEDCLYLNIWVPSPRPKSTTVMVWIYGGGFYSGSSTLDVYNGKYLAYTEEVVLVSLSYRVGAFGFLALHGSQEAPGNVGLLDQRMALQWVHDNIQFFGGDPKTVTIFGESAGGASVGMHILSPGSRDLFRRAILQSGSPNCPWASVSVAEGRRRAVELGRNLNCNLNSDEELIHCLREKKPQELIDVEWNVLPFDSIFRFSFVPVIDGEFFPTSLESMLNSGNFKKTQILLGVNKDEGSFFLLYGAPGFSKDSESKISREDFMSGVKLSVPHANDLGLDAVTLQYTDWMDDNNGIKNRDGLDDIVGDHNVICPLMHFVNKYTKFGNGTYLYFFNHRASNLVWPEWMGVIHGYEIEFVFGLPLVKELNYTAEEEALSRRIMHYWATFAKTGNPNEPHSQESKWPLFTTKEQKFIDLNTEPMKVHQRLRVQMCVFWNQFLPKLLNATACDGELSSSGTSSSKGIIFYVLFSILYLIF,./data/raw/alphafold//AF-P04058-F1-model_v4.pdb,1716,1445,647,1979 +1038,3551,3625,MQTQHTKVTQTHFLLWILLLCMPFGKSHTEEDFIITTKTGRVRGLSMPVLGGTVTAFLGIPYAQPPLGSLRFKKPQPLNKWPDIHNATQYANSCYQNIDQAFPGFQGSEMWNPNTNLSEDCLYLNVWIPVPKPKNATVMVWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLAFPGNPDAPGNMGLFDQQLALQWVQRNIAAFGGNPKSITIFGESAGAASVSLHLLCPQSYPLFTRAILESGSSNAPWAVKHPEEARNRTLTLAKFTGCSKENEMEMIKCLRSKDPQEILRNERFVLPSDSILSINFGPTVDGDFLTDMPHTLLQLGKVKKAQILVGVNKDEGTAFLVYGAPGFSKDNDSLITRKEFQEGLNMYFPGVSRLGKEAVLFYYVDWLGEQSPEVYRDALDDVIGDYNIICPALEFTKKFAELENNAFFYFFEHRSSKLPWPEWMGVMHGYEIEFVFGLPLGRRVNYTRAEEIFSRSIMKTWANFAKYGHPNGTQGNSTMWPVFTSTEQKYLTLNTEKSKIYSKLRAPQCQFWRLFFPKVLEMTGDIDETEQEWKAGFHRWSNYMMDWQNQFNDYTSKKESCTAL,sabio,Q03311,CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl,0.0021,22.0,7.0,3.1.1.8,10090.0,-2.677780705266081,-2.677780705266081,CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl__MQTQHTKVTQTHFLLWILLLCMPFGKSHTEEDFIITTKTGRVRGLSMPVLGGTVTAFLGIPYAQPPLGSLRFKKPQPLNKWPDIHNATQYANSCYQNIDQAFPGFQGSEMWNPNTNLSEDCLYLNVWIPVPKPKNATVMVWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLAFPGNPDAPGNMGLFDQQLALQWVQRNIAAFGGNPKSITIFGESAGAASVSLHLLCPQSYPLFTRAILESGSSNAPWAVKHPEEARNRTLTLAKFTGCSKENEMEMIKCLRSKDPQEILRNERFVLPSDSILSINFGPTVDGDFLTDMPHTLLQLGKVKKAQILVGVNKDEGTAFLVYGAPGFSKDNDSLITRKEFQEGLNMYFPGVSRLGKEAVLFYYVDWLGEQSPEVYRDALDDVIGDYNIICPALEFTKKFAELENNAFFYFFEHRSSKLPWPEWMGVMHGYEIEFVFGLPLGRRVNYTRAEEIFSRSIMKTWANFAKYGHPNGTQGNSTMWPVFTSTEQKYLTLNTEKSKIYSKLRAPQCQFWRLFFPKVLEMTGDIDETEQEWKAGFHRWSNYMMDWQNQFNDYTSKKESCTAL,./data/raw/alphafold//AF-Q03311-F1-model_v4.pdb,1716,1444,761,2055 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+1040,5934,6035,MSASIPDIKLSSGHLMPSIGFGCWKLANATAGEQVYQAIKAGYRLFDGAEDYGNEKEVGDGVKRAIDEGLVKREEIFLTSKLWNNYHDPKNVETALNKTLADLKVDYVDLFLIHFPIAFKFVPIEEKYPPGFYCGDGNNFVYEDVPILETWKALEKLVAAGKIKSIGVSNFPGALLLDLLRGATIKPAVLQVEHHPYLQQPKLIEFAQKAGVTITAYSSFGPQSFVEMNQGRALNTPTLFAHDTIKAIAAKYNKTPAEVLLRWAAQRGIAVIPKSNLPERLVQNRSFNTFDLTKEDFEEIAKLDIGLRFNDPWDWDNIPIFV,uniprot_search,O74237,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.016,25.0,7.0,1.1.1.307,2315449.0,-1.7958800173440752,-2.258563208195623,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MSASIPDIKLSSGHLMPSIGFGCWKLANATAGEQVYQAIKAGYRLFDGAEDYGNEKEVGDGVKRAIDEGLVKREEIFLTSKLWNNYHDPKNVETALNKTLADLKVDYVDLFLIHFPIAFKFVPIEEKYPPGFYCGDGNNFVYEDVPILETWKALEKLVAAGKIKSIGVSNFPGALLLDLLRGATIKPAVLQVEHHPYLQQPKLIEFAQKAGVTITAYSSFGPQSFVEMNQGRALNTPTLFAHDTIKAIAAKYNKTPAEVLLRWAAQRGIAVIPKSNLPERLVQNRSFNTFDLTKEDFEEIAKLDIGLRFNDPWDWDNIPIFV,./data/raw/alphafold//AF-O74237-F1-model_v4.pdb,138,435,1795,509 +1041,7680,7809,ILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLAIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHSLLGGVVDDQAGPGAWVRGVQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAG,uniprot_search,Q7M0F8,Nc1ccc(O)cc1,1.09,37.0,8.0,2.3.2.13,10141.0,0.0374264979406236,0.0374264979406236,Nc1ccc(O)cc1__ILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLAIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHSLLGGVVDDQAGPGAWVRGVQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAG,./data/raw/alphafold//AF-Q7M0F8-F1-model_v4.pdb,1754,1492,816,2190 +1042,1855,1900,MADDQGCIEEQGVEDSANEDSVDAKPDRSSFVPSLFSKKKKNVTMRSIKTTRDRVPTYQYNMNFEKLGKCIIINNKNFDKVTGMGVRNGTDKDAEALFKCFRSLGFDVIVYNDCSCAKMQDLLKKASEEDHTNAACFACILLSHGEENVIYGKDGVTPIKDLTAHFRGDRCKTLLEKPKLFFIQACRGTELDDGIQADSGPINDTDANPRYKIPVEADFLFAYSTVPGYYSWRSPGRGSWFVQALCSILEEHGKDLEIMQILTRVNDRVARHFESQSDDPHFHEKKQIPCVVSMLTKELYFSQ,uniprot_search,P55210,CC(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@H](C(O)=N[C@@H](C)C(O)=N[C@H](C=O)CC(=O)O)C(C)C,0.0124,33.5,7.233333333333333,3.4.22.60,9606.0,-1.9065783148377649,-1.9065783148377649,CC(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@H](C(O)=N[C@@H](C)C(O)=N[C@H](C=O)CC(=O)O)C(C)C__MADDQGCIEEQGVEDSANEDSVDAKPDRSSFVPSLFSKKKKNVTMRSIKTTRDRVPTYQYNMNFEKLGKCIIINNKNFDKVTGMGVRNGTDKDAEALFKCFRSLGFDVIVYNDCSCAKMQDLLKKASEEDHTNAACFACILLSHGEENVIYGKDGVTPIKDLTAHFRGDRCKTLLEKPKLFFIQACRGTELDDGIQADSGPINDTDANPRYKIPVEADFLFAYSTVPGYYSWRSPGRGSWFVQALCSILEEHGKDLEIMQILTRVNDRVARHFESQSDDPHFHEKKQIPCVVSMLTKELYFSQ,./data/raw/alphafold//AF-P55210-F1-model_v4.pdb,251,1615,960,2353 +1043,5639,5738,MLEHLVQAVAVGHALVDLRLYVERIPGVDEEAVIKDETRSVGGSAANVAVVLRRLGVQSGIIGKIGLDDFGRIAVDNLMREGVDISGLRVSLRDRTGFSVVVRDKEGSITIYSFKGAAEKLEPGEIDADAIGRSKHVHVASLRPDTTLKTVEIAKKRSITVSWDPGRVLSKMGAERLANIISKVDIIFVNRNEAKNLTGYHDYRQAARHLKKLGPKIVVIKLGASGSYILYSDGEVFVPAIKPERVVDTTGAGDSYAAGFIAGLLRGYTIEKASLYATIVASIKVSRLGSNAAPSHEEVVEKARELGVEI,brenda,Q9YG89,N.N.O=S(=O)(O)O,0.05,85.0,6.7,2.7.1.11,56636.0,-1.3010299956639813,-1.3010299956639813,N.N.O=S(=O)(O)O__MLEHLVQAVAVGHALVDLRLYVERIPGVDEEAVIKDETRSVGGSAANVAVVLRRLGVQSGIIGKIGLDDFGRIAVDNLMREGVDISGLRVSLRDRTGFSVVVRDKEGSITIYSFKGAAEKLEPGEIDADAIGRSKHVHVASLRPDTTLKTVEIAKKRSITVSWDPGRVLSKMGAERLANIISKVDIIFVNRNEAKNLTGYHDYRQAARHLKKLGPKIVVIKLGASGSYILYSDGEVFVPAIKPERVVDTTGAGDSYAAGFIAGLLRGYTIEKASLYATIVASIKVSRLGSNAAPSHEEVVEKARELGVEI,./data/raw/alphafold//AF-Q9YG89-F1-model_v4.pdb,885,408,491,474 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+1047,7184,7304,MASPDWGYDDKNGPEQWSKLYPIANGNNQSPVDIKTSETKHDTSLKPISVSYNPATAKEIINVGHSFHVNFEDNDNRSVLKGGPFSDSYRLFQFHFHWGSTNEHGSEHTVDGVKYSAELHVAHWNSAKYSSLAEAASKADGLAVIGVLMKVGEANPKLQKVLDALQAIKTKGKRAPFTNFDPSTLLPSSLDFWTYPGSLTHPPLYESVTWIICKESISVSSEQLAQFRSLLSNVEGDNAVPMQHNNRPTQPLKGRTVRASF,brenda,P00915,NS(=O)(=O)c1ccc(C(=O)N2CCN(C(=O)c3ccccc3)C[C@@H]2Cc2ccccc2)cc1,8.28e-05,40.0,9.0,4.2.1.1,9606.0,-4.08196966321512,-4.08196966321512,NS(=O)(=O)c1ccc(C(=O)N2CCN(C(=O)c3ccccc3)C[C@@H]2Cc2ccccc2)cc1__MASPDWGYDDKNGPEQWSKLYPIANGNNQSPVDIKTSETKHDTSLKPISVSYNPATAKEIINVGHSFHVNFEDNDNRSVLKGGPFSDSYRLFQFHFHWGSTNEHGSEHTVDGVKYSAELHVAHWNSAKYSSLAEAASKADGLAVIGVLMKVGEANPKLQKVLDALQAIKTKGKRAPFTNFDPSTLLPSSLDFWTYPGSLTHPPLYESVTWIICKESISVSSEQLAQFRSLLSNVEGDNAVPMQHNNRPTQPLKGRTVRASF,./data/raw/alphafold//AF-P00915-F1-model_v4.pdb,446,1854,769,2138 +1048,6661,6773,MNRLEVIRKSISYVGLDPAMFKPYPFNVSSSALSELMDCMSYIVFPEFSEPPMNPVTVPEQRLGGSALLQWTLTRMADIINSQIYSALMLQGHTKCSKDEAGIPHSLNAESGSNDDGFTPQNETHAFGEVRSFHLEAKKRAEEITEAFLTRKLRSIRWLLRTDAESILNNDIASNSLSEVVLCYPGLRCMKHQRTAHALHELGAPSIFTRLLTEMAHSTTGIDIHPATSIGHHFFIDHGTGIVIGSTAIIGNYVSIYHGVTLGTRSFPVVAKTGEKVRNLARHPIIEDRVTIYANAMVLGRIRIGKDSVIGSHCLVLKDLPPKSMIRRTSNAKLPTPYITLQKGGSDI,sabio,Q9BKB1,NC(CS)C(=O)O,0.012,25.0,8.0,2.3.1.30,5693.0,-1.9208187539523751,-2.887345359137069,NC(CS)C(=O)O__MNRLEVIRKSISYVGLDPAMFKPYPFNVSSSALSELMDCMSYIVFPEFSEPPMNPVTVPEQRLGGSALLQWTLTRMADIINSQIYSALMLQGHTKCSKDEAGIPHSLNAESGSNDDGFTPQNETHAFGEVRSFHLEAKKRAEEITEAFLTRKLRSIRWLLRTDAESILNNDIASNSLSEVVLCYPGLRCMKHQRTAHALHELGAPSIFTRLLTEMAHSTTGIDIHPATSIGHHFFIDHGTGIVIGSTAIIGNYVSIYHGVTLGTRSFPVVAKTGEKVRNLARHPIIEDRVTIYANAMVLGRIRIGKDSVIGSHCLVLKDLPPKSMIRRTSNAKLPTPYITLQKGGSDI,./data/raw/alphafold//AF-Q9BKB1-F1-model_v4.pdb,1035,589,1962,686 +1049,8817,8955,MTTNYIFVTGGVVSSLGKGIAAASLAAILEARGLNVTIMKLDPYINVDPGTMSPIQHGEVFVTEDGAETDLDLGHYERFIRTKMSRRNNFTTGRIYSDVLRKERRGDYLGATVQVIPHITNAIKERVLEGGEGHDVVLVEIGGTVGDIESLPFLEAIRQMAVEIGREHTLFMHLTLVPYMAASGEVKTKPTQHSVKELLSIGIQPDILICRSDRAVPANERAKIALFCNVPEKAVISLKDVDSIYKIPGLLKSQGLDDYICKRFSLNCPEANLSEWEQVIFEEANPVSEVTIGMVGKYIELPDAYKSVIEALKHGGLKNRVSVNIKLIDSQDVETRGVEILKGLDAILVPGGFGYRGVEGMITTARFARENNIPYLGICLGMQVALIDYARHVANMENANSTEFVPDCKYPVVALITEWRDENGNVEVRSEKSDLGGTMRLGAQQCQLVDDSLVRQLYNAPTIVERHRHRYEVNNMLLKQIEDAGLRVAGRSGDDQLVEIIEVPNHPWFVACQFHPEFTSTPRDGHPLFAGFVKAASEFQKRQAK,brenda,P0A7E5,O=C(O)C(CS)N=NO,0.027,37.0,7.3,6.3.4.2,562.0,-1.5686362358410126,-1.5686362358410126,O=C(O)C(CS)N=NO__MTTNYIFVTGGVVSSLGKGIAAASLAAILEARGLNVTIMKLDPYINVDPGTMSPIQHGEVFVTEDGAETDLDLGHYERFIRTKMSRRNNFTTGRIYSDVLRKERRGDYLGATVQVIPHITNAIKERVLEGGEGHDVVLVEIGGTVGDIESLPFLEAIRQMAVEIGREHTLFMHLTLVPYMAASGEVKTKPTQHSVKELLSIGIQPDILICRSDRAVPANERAKIALFCNVPEKAVISLKDVDSIYKIPGLLKSQGLDDYICKRFSLNCPEANLSEWEQVIFEEANPVSEVTIGMVGKYIELPDAYKSVIEALKHGGLKNRVSVNIKLIDSQDVETRGVEILKGLDAILVPGGFGYRGVEGMITTARFARENNIPYLGICLGMQVALIDYARHVANMENANSTEFVPDCKYPVVALITEWRDENGNVEVRSEKSDLGGTMRLGAQQCQLVDDSLVRQLYNAPTIVERHRHRYEVNNMLLKQIEDAGLRVAGRSGDDQLVEIIEVPNHPWFVACQFHPEFTSTPRDGHPLFAGFVKAASEFQKRQAK,./data/raw/alphafold//AF-P0A7E5-F1-model_v4.pdb,877,218,1645,242 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+1175,6647,6759,MQKIGILGAMREEITPILELFGVDFEEIPLGGNVFHKGVYHNKEIIVAYSKIGKVHSTLTTTSMILAFGVQKVLFSGVAGSLVKDLKINDLLVATQLVQHDVDLSAFDHPLGFIPESAIFIETSGSLNALAKKIANEQHIALKEGVIASGDQFVHSKERKEFLVSEFKASAVEMEGASVAFVCQKFGVPCCVLRSISDNADEKAGMSFDEFLEKSAHTSAKFLKSMVDEL,brenda,Q9ZMY2,NC(CO)(CO)CO,25.24,37.0,7.5,3.2.2.9,210.0,1.4020893505720966,1.4020893505720966,NC(CO)(CO)CO__MQKIGILGAMREEITPILELFGVDFEEIPLGGNVFHKGVYHNKEIIVAYSKIGKVHSTLTTTSMILAFGVQKVLFSGVAGSLVKDLKINDLLVATQLVQHDVDLSAFDHPLGFIPESAIFIETSGSLNALAKKIANEQHIALKEGVIASGDQFVHSKERKEFLVSEFKASAVEMEGASVAFVCQKFGVPCCVLRSISDNADEKAGMSFDEFLEKSAHTSAKFLKSMVDEL,./data/raw/alphafold//AF-Q9ZMY2-F1-model_v4.pdb,1031,585,1958,682 diff --git a/datasets/splits/ki-seq_test_sequence_60cluster.csv b/datasets/splits/ki-seq_test_sequence_60cluster.csv new file mode 100644 index 0000000000000000000000000000000000000000..3c5b34c71eaa350bf470bf5a26afb3150fa871b7 --- /dev/null +++ b/datasets/splits/ki-seq_test_sequence_60cluster.csv @@ -0,0 +1,102 @@ +,Unnamed: 0,Unnamed: 0.1,sequence,sequence_source,uniprot,substrate_smiles,value,temperature,ph,ec,taxonomy_id,log10_value,log10ki_mean,group,pdbpath,sequence_40cluster,sequence_60cluster,sequence_80cluster,sequence_99cluster 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+200,7095,7215,MTATPESLFPTGDELDSSQLQMESDEVDTLKEGEDPADRMHPFLAIYELQSLKVHPLVFAPGVPVTAQVVGTERYTSGSKVGTCTLYSVRLTHGDFSWTTKKKYRHFQELHRDLLRHKVLMSLLPLARFAVAYSPARDAGNREMPSLPRAGPEGSTRHAASKQKYLENYLNRLLTMSFYRNYHAMTEFLEVSQLSFIPDLGRKGLEGMIRKRSGGHRVPGLTCCGRDQVCYRWSKRWLVVKDSFLLYMCLETGAISFVQLFDPGFEVQVGKRSTEARHGVRIDTSHRSLILKCSSYRQARWWAQEITELAQGPGRDFLQLHRHDSYAPPRPGTLARWFVNGAGYFAAVADAILRAQEEIFITDWWLSPEVYLKRPAHSDDWRLDIMLKRKAEEGVRVSILLFKEVELALGINSGYSKRALMLLHPNIKVMRHPDQVTLWAHHEKLLVVDQVVAFLGGLDLAYGRWDDLHYRLTDLGDSSESAASQPPTPRPDSPATPDLSHNQFFWLGKDYSNLITKDWVQLDRPFEDFIDRETTPRMPWRDVGVVVHGLPARDLARHFIQRWNFTKTTKAKYKTPTYPYLLPKSTSTANQLPFTLPGGQCTTVQVLRSVDRWSAGTLENSILNAYLHTIRESQHFLYIENQFFISCSDGRTVLNKVGDEIVDRILKAHKQGWCYRVYVLLPLLPGFEGDISTGGGNSIQAILHFTYRTLCRGEYSILHRLKAAMGTAWRDYISICGLRTHGELGGHPVSELIYIHSKVLIADDRTVIIGSANINDRSLLGKRDSELAVLIEDTETEPSLMNGAEYQAGRFALSLRKHCFGVILGANTRPDLDLRDPICDDFFQLWQDMAESNANIYEQIFRCLPSNATRSLRTLREYVAVEPLATVSPPLARSELTQVQGHLVHFPLKFLEDESLLPPLGSKEGMIPLEVWT,brenda,O14939,NS(=O)(=O)Cc1noc2ccccc12,0.011,22.0,7.5,4.2.1.1,9606.0,-1.958607314841775,-1.958607314841775,NS(=O)(=O)Cc1noc2ccccc12__MTATPESLFPTGDELDSSQLQMESDEVDTLKEGEDPADRMHPFLAIYELQSLKVHPLVFAPGVPVTAQVVGTERYTSGSKVGTCTLYSVRLTHGDFSWTTKKKYRHFQELHRDLLRHKVLMSLLPLARFAVAYSPARDAGNREMPSLPRAGPEGSTRHAASKQKYLENYLNRLLTMSFYRNYHAMTEFLEVSQLSFIPDLGRKGLEGMIRKRSGGHRVPGLTCCGRDQVCYRWSKRWLVVKDSFLLYMCLETGAISFVQLFDPGFEVQVGKRSTEARHGVRIDTSHRSLILKCSSYRQARWWAQEITELAQGPGRDFLQLHRHDSYAPPRPGTLARWFVNGAGYFAAVADAILRAQEEIFITDWWLSPEVYLKRPAHSDDWRLDIMLKRKAEEGVRVSILLFKEVELALGINSGYSKRALMLLHPNIKVMRHPDQVTLWAHHEKLLVVDQVVAFLGGLDLAYGRWDDLHYRLTDLGDSSESAASQPPTPRPDSPATPDLSHNQFFWLGKDYSNLITKDWVQLDRPFEDFIDRETTPRMPWRDVGVVVHGLPARDLARHFIQRWNFTKTTKAKYKTPTYPYLLPKSTSTANQLPFTLPGGQCTTVQVLRSVDRWSAGTLENSILNAYLHTIRESQHFLYIENQFFISCSDGRTVLNKVGDEIVDRILKAHKQGWCYRVYVLLPLLPGFEGDISTGGGNSIQAILHFTYRTLCRGEYSILHRLKAAMGTAWRDYISICGLRTHGELGGHPVSELIYIHSKVLIADDRTVIIGSANINDRSLLGKRDSELAVLIEDTETEPSLMNGAEYQAGRFALSLRKHCFGVILGANTRPDLDLRDPICDDFFQLWQDMAESNANIYEQIFRCLPSNATRSLRTLREYVAVEPLATVSPPLARSELTQVQGHLVHFPLKFLEDESLLPPLGSKEGMIPLEVWT,./data/raw/alphafold//AF-O14939-F1-model_v4.pdb,1090,661,2043,774 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+706,4647,4734,MESYKPMWLKGAIILAINLMERGYKPVAVGLGERDFYIDIKSDTSITLDEVKKAISKNVLANVPIENNQVVYKGNKVSIVEDKVSIPTNLNPKYFEILNISTHHPNPNEQYVRIRGVAFETEEQLKDYLTWLEKAEETDHRLIGEKLDLFSFHEEAGSGLVLFHPKGQTLRNELITFMREINDSMGYQEVYTSHVLKTDIWKISGHYTLYRDKLIVFNMEGDEYGVKPMNCPAHILIYKSKPRTYRDLPIRFSEFGHVYRWEKKGELYGLLRVRGFVQDDGHIFLKEDQLKEEIKMLISKTVEVWHKFGFKDDDIKPYLSTRPDESIGSDELWEKATNALISALQESGLKFGIKEKEGAFYGPKIDFEIRDSLGRWWQLSTIQVDFNLPERFKLEYIDKDGTKKRPVMVHRAIYGSIDRFVAILLEHFKGKLPTWLSPVQVKVLPITDEVNEYAEKVLNDMRKRRIRAEIDYAGETLSRRIKNAYDQGVPYILIVGKKEASQGTVTVRARGNIEVRNVKFEKFLDLMITEITQRDVEQTTAKALK,uniprot_search,A0A0E3JZT2,C[C@@H]1C[C@H](C)C[C@H](C)[C@@H](O)CC(=O)O[C@H]([C@@H]2CCC[C@H]2C(=O)O)C/C=C/C=C(/C#N)[C@H](O)[C@@H](C)C1,4.5e-06,55.0,7.5,6.1.1.3,2287.0,-5.346787486224656,-5.346787486224656,C[C@@H]1C[C@H](C)C[C@H](C)[C@@H](O)CC(=O)O[C@H]([C@@H]2CCC[C@H]2C(=O)O)C/C=C/C=C(/C#N)[C@H](O)[C@@H](C)C1__MESYKPMWLKGAIILAINLMERGYKPVAVGLGERDFYIDIKSDTSITLDEVKKAISKNVLANVPIENNQVVYKGNKVSIVEDKVSIPTNLNPKYFEILNISTHHPNPNEQYVRIRGVAFETEEQLKDYLTWLEKAEETDHRLIGEKLDLFSFHEEAGSGLVLFHPKGQTLRNELITFMREINDSMGYQEVYTSHVLKTDIWKISGHYTLYRDKLIVFNMEGDEYGVKPMNCPAHILIYKSKPRTYRDLPIRFSEFGHVYRWEKKGELYGLLRVRGFVQDDGHIFLKEDQLKEEIKMLISKTVEVWHKFGFKDDDIKPYLSTRPDESIGSDELWEKATNALISALQESGLKFGIKEKEGAFYGPKIDFEIRDSLGRWWQLSTIQVDFNLPERFKLEYIDKDGTKKRPVMVHRAIYGSIDRFVAILLEHFKGKLPTWLSPVQVKVLPITDEVNEYAEKVLNDMRKRRIRAEIDYAGETLSRRIKNAYDQGVPYILIVGKKEASQGTVTVRARGNIEVRNVKFEKFLDLMITEITQRDVEQTTAKALK,./data/raw/alphafold//AF-A0A0E3JZT2-F1-model_v4.pdb,756,250,1682,284 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+706,4647,4734,MESYKPMWLKGAIILAINLMERGYKPVAVGLGERDFYIDIKSDTSITLDEVKKAISKNVLANVPIENNQVVYKGNKVSIVEDKVSIPTNLNPKYFEILNISTHHPNPNEQYVRIRGVAFETEEQLKDYLTWLEKAEETDHRLIGEKLDLFSFHEEAGSGLVLFHPKGQTLRNELITFMREINDSMGYQEVYTSHVLKTDIWKISGHYTLYRDKLIVFNMEGDEYGVKPMNCPAHILIYKSKPRTYRDLPIRFSEFGHVYRWEKKGELYGLLRVRGFVQDDGHIFLKEDQLKEEIKMLISKTVEVWHKFGFKDDDIKPYLSTRPDESIGSDELWEKATNALISALQESGLKFGIKEKEGAFYGPKIDFEIRDSLGRWWQLSTIQVDFNLPERFKLEYIDKDGTKKRPVMVHRAIYGSIDRFVAILLEHFKGKLPTWLSPVQVKVLPITDEVNEYAEKVLNDMRKRRIRAEIDYAGETLSRRIKNAYDQGVPYILIVGKKEASQGTVTVRARGNIEVRNVKFEKFLDLMITEITQRDVEQTTAKALK,uniprot_search,A0A0E3JZT2,C[C@@H]1C[C@H](C)C[C@H](C)[C@@H](O)CC(=O)O[C@H]([C@@H]2CCC[C@H]2C(=O)O)C/C=C/C=C(/C#N)[C@H](O)[C@@H](C)C1,4.5e-06,55.0,7.5,6.1.1.3,2287.0,-5.346787486224656,-5.346787486224656,C[C@@H]1C[C@H](C)C[C@H](C)[C@@H](O)CC(=O)O[C@H]([C@@H]2CCC[C@H]2C(=O)O)C/C=C/C=C(/C#N)[C@H](O)[C@@H](C)C1__MESYKPMWLKGAIILAINLMERGYKPVAVGLGERDFYIDIKSDTSITLDEVKKAISKNVLANVPIENNQVVYKGNKVSIVEDKVSIPTNLNPKYFEILNISTHHPNPNEQYVRIRGVAFETEEQLKDYLTWLEKAEETDHRLIGEKLDLFSFHEEAGSGLVLFHPKGQTLRNELITFMREINDSMGYQEVYTSHVLKTDIWKISGHYTLYRDKLIVFNMEGDEYGVKPMNCPAHILIYKSKPRTYRDLPIRFSEFGHVYRWEKKGELYGLLRVRGFVQDDGHIFLKEDQLKEEIKMLISKTVEVWHKFGFKDDDIKPYLSTRPDESIGSDELWEKATNALISALQESGLKFGIKEKEGAFYGPKIDFEIRDSLGRWWQLSTIQVDFNLPERFKLEYIDKDGTKKRPVMVHRAIYGSIDRFVAILLEHFKGKLPTWLSPVQVKVLPITDEVNEYAEKVLNDMRKRRIRAEIDYAGETLSRRIKNAYDQGVPYILIVGKKEASQGTVTVRARGNIEVRNVKFEKFLDLMITEITQRDVEQTTAKALK,./data/raw/alphafold//AF-A0A0E3JZT2-F1-model_v4.pdb,756,250,1682,284 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+12,18897,19170,MSHPINVFSEIGKLRTVMLHRPGKELENLMPDYLERLLFDDIPFLEKAQAEHDAFAELLRSKDIEVVYLEDLAAEALINEEVRRQFIDQFLEEANIRSESAKEKVRELMLEIDDNEELIQKAIAGIQKQELPKYEQEFLTDMVEADYPFIIDPMPNLYFTRDNFATMGHGISLNHMYSVTRQRETIFGQYIFDYHPRFAGKEVPRVYDRSESTRIEGGDELILSKEVVAIGISQRTDAASIEKIARNIFEQKLGFKNILAFDIGEHRKFMHLDTVFTMIDYDKFTIHPEIEGGLVVYSITEKADGDIQITKEKDTLDNILCKYLHLDNVQLIRCGAGNLTAAAREQWNDGSNTLAIAPGEVVVYDRNTITNKALEEAGVKLNYIPGSELVRGRGGPRCMSMPLYREDL,brenda,A0A3G2YMH7,N=C(N)NCCC[C@H](N)C(=O)O,10.1,45.0,6.0,3.5.3.6,1351.0,1.0043213737826426,1.0043213737826426,N=C(N)NCCC[C@H](N)C(=O)O__MSHPINVFSEIGKLRTVMLHRPGKELENLMPDYLERLLFDDIPFLEKAQAEHDAFAELLRSKDIEVVYLEDLAAEALINEEVRRQFIDQFLEEANIRSESAKEKVRELMLEIDDNEELIQKAIAGIQKQELPKYEQEFLTDMVEADYPFIIDPMPNLYFTRDNFATMGHGISLNHMYSVTRQRETIFGQYIFDYHPRFAGKEVPRVYDRSESTRIEGGDELILSKEVVAIGISQRTDAASIEKIARNIFEQKLGFKNILAFDIGEHRKFMHLDTVFTMIDYDKFTIHPEIEGGLVVYSITEKADGDIQITKEKDTLDNILCKYLHLDNVQLIRCGAGNLTAAAREQWNDGSNTLAIAPGEVVVYDRNTITNKALEEAGVKLNYIPGSELVRGRGGPRCMSMPLYREDL,./data/raw/alphafold//AF-A0A3G2YMH7-F1-model_v4.pdb,3999,4778,6600,6547 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+113,35452,36072,MEDIKDSKVKRFCSKNILIILGFSSVLAVIALIAVGLTHNKPLPENVKYGIVLDAGSSHTNLYIYKWPAEKENDTGVVQLLEECQVKGPGISKYAQKTDEIAAYLAECMKMSTERIPASKQHQTPVYLGATAGMRLLRMESKQSADEVLAAVSRSLKSYPFDFQGAKIITGQEEGAYGWITINYLLGRFTQEQSWLNFISDSQKQATFGALDLGGSSTQVTFVPLNQTLEAPETSLQFRLYGTDYTVYTHSFLCYGKDQALWQKLAQDIQVSSGGILKDPCFYPGYKKVVNVSELYGTPCTKRFEKKLPFNQFQVQGTGDYEQCHQSILKFFNNSHCPYSQCAFNGVFLPPLQGSFGAFSAFYFVMDFFKKMANDSVSSQEKMTEITKNFCSKPWEEVKASYPTVKEKYLSEYCFSGTYILSLLLQGYNFTGTSWDQIHFMGKIKDSNAGWTLGYMLNLTNMIPAEQPLSPPLPHSTYISLMVLFSLVLVAMVITGLFIFSKPSYFWKEAV,brenda,P97687,O=P(O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O,0.0105,25.0,7.4,3.6.1.5,10116.0,-1.978810700930062,-1.978810700930062,O=P(O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O__MEDIKDSKVKRFCSKNILIILGFSSVLAVIALIAVGLTHNKPLPENVKYGIVLDAGSSHTNLYIYKWPAEKENDTGVVQLLEECQVKGPGISKYAQKTDEIAAYLAECMKMSTERIPASKQHQTPVYLGATAGMRLLRMESKQSADEVLAAVSRSLKSYPFDFQGAKIITGQEEGAYGWITINYLLGRFTQEQSWLNFISDSQKQATFGALDLGGSSTQVTFVPLNQTLEAPETSLQFRLYGTDYTVYTHSFLCYGKDQALWQKLAQDIQVSSGGILKDPCFYPGYKKVVNVSELYGTPCTKRFEKKLPFNQFQVQGTGDYEQCHQSILKFFNNSHCPYSQCAFNGVFLPPLQGSFGAFSAFYFVMDFFKKMANDSVSSQEKMTEITKNFCSKPWEEVKASYPTVKEKYLSEYCFSGTYILSLLLQGYNFTGTSWDQIHFMGKIKDSNAGWTLGYMLNLTNMIPAEQPLSPPLPHSTYISLMVLFSLVLVAMVITGLFIFSKPSYFWKEAV,./data/raw/alphafold//AF-P97687-F1-model_v4.pdb,1282,6502,8379,3247 +114,8175,8313,MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,brenda,O94219,CC=CC=CCO,0.095,18.5,7.0,1.1.3.7,5323.0,-1.0222763947111522,-1.0021148051154234,CC=CC=CCO__MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,./data/raw/alphafold//AF-O94219-F1-model_v4.pdb,3060,3592,4910,387 +115,13486,13681,MEDIIKTLPQHTCSFLKHRFTLYKYKDAWNHQEFLEGRILSEQKFKAHPNDVFLASYPKSGTTWLKALAFAIITREKFDDSTSPLLTTMPHDCIPLLEKDLEKIQENQRNSLYTPISTHFHYKSLPESARTSNCKIVYIYRNMKDVIVSYYHFLRQIVKLSVEEAPFEEAFDEFCQGISSCGPYWEHIKGYWKASLEKPEIFLFLKYEDMKKDPVPSVKKLADFIGHPFTPKEEEAGVIEDIVKLCSFEKLSSLEVNKSGMHRPEEAHSIENRLYFRKGKDGDWKNYFTDEMTQKIDKLIDEKLGATGLVLK,sabio,P52836,COc1c(O)cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c2c1O,0.00025,30.0,6.0,2.8.2.25,4228.0,-3.6020599913279625,-3.6020599913279625,COc1c(O)cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c2c1O__MEDIIKTLPQHTCSFLKHRFTLYKYKDAWNHQEFLEGRILSEQKFKAHPNDVFLASYPKSGTTWLKALAFAIITREKFDDSTSPLLTTMPHDCIPLLEKDLEKIQENQRNSLYTPISTHFHYKSLPESARTSNCKIVYIYRNMKDVIVSYYHFLRQIVKLSVEEAPFEEAFDEFCQGISSCGPYWEHIKGYWKASLEKPEIFLFLKYEDMKKDPVPSVKKLADFIGHPFTPKEEEAGVIEDIVKLCSFEKLSSLEVNKSGMHRPEEAHSIENRLYFRKGKDGDWKNYFTDEMTQKIDKLIDEKLGATGLVLK,./data/raw/alphafold//AF-P52836-F1-model_v4.pdb,344,3513,4780,5043 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+130,38313,38991,MGHPEEVDVIVCGGGPAGCVVAGRLAYADPTLKVMLIEGGANNRDDPWVYRPGIYVRNMQRNGINDKATFYTDTMASSYLRGRRSIVPCANILGGGSSINFQMYTRASASDWDDFKTEGWTCKDLLPLMKRLENYQKPCNNDTHGYDGPIAISNGGQIMPVAQDFLRAAHAIGVPYSDDIQDLTTAHGAEIWAKYINRHTGRRSDAATAYVHSVMDVQDNLFLRCNARVSRVLFDDNNKAVGVAYVPSRNRTHGGKLHETIVKARKMVVLSSGTLGTPQILERSGVGNGELLRQLGIKIVSDLPGVGEQYQDHYTTLSIYRVSNESITTDDFLRGVKDVQRELFTEWEVSPEKARLSSNAIDAGFKIRPTEEELKEMGPEFNELWNRYFKDKPDKPVMFGSIVAGAYADHTLLPPGKYITMFQYLEYPASRGKIHIKSQNPYVEPFFDSGFMNNKADFAPIRWSYKKTREVARRMDAFRGELTSHHPRFHPASPAACKDIDIETAKQIYPDGLTVGIHMGSWHQPSEPYKHDKVIEDIPYTEEDDKAIDDWVADHVETTWHSLGTCAMKPREQGGVVDKRLNVYGTQNLKCVDLSICPDNLGTNTYSSALLVGEKGADLIAEELGLKIKTPHAPVPHAPVPTGRPATQQVR,brenda,T2M2J4,OCCCCCCO,12.9,23.0,7.5,1.1.3.13,2822231.0,1.110589710299249,1.110589710299249,OCCCCCCO__MGHPEEVDVIVCGGGPAGCVVAGRLAYADPTLKVMLIEGGANNRDDPWVYRPGIYVRNMQRNGINDKATFYTDTMASSYLRGRRSIVPCANILGGGSSINFQMYTRASASDWDDFKTEGWTCKDLLPLMKRLENYQKPCNNDTHGYDGPIAISNGGQIMPVAQDFLRAAHAIGVPYSDDIQDLTTAHGAEIWAKYINRHTGRRSDAATAYVHSVMDVQDNLFLRCNARVSRVLFDDNNKAVGVAYVPSRNRTHGGKLHETIVKARKMVVLSSGTLGTPQILERSGVGNGELLRQLGIKIVSDLPGVGEQYQDHYTTLSIYRVSNESITTDDFLRGVKDVQRELFTEWEVSPEKARLSSNAIDAGFKIRPTEEELKEMGPEFNELWNRYFKDKPDKPVMFGSIVAGAYADHTLLPPGKYITMFQYLEYPASRGKIHIKSQNPYVEPFFDSGFMNNKADFAPIRWSYKKTREVARRMDAFRGELTSHHPRFHPASPAACKDIDIETAKQIYPDGLTVGIHMGSWHQPSEPYKHDKVIEDIPYTEEDDKAIDDWVADHVETTWHSLGTCAMKPREQGGVVDKRLNVYGTQNLKCVDLSICPDNLGTNTYSSALLVGEKGADLIAEELGLKIKTPHAPVPHAPVPTGRPATQQVR,./data/raw/alphafold//AF-T2M2J4-F1-model_v4.pdb,383,3427,4683,3804 +131,3076,3129,MSIIVISGCATGIGAATRKVLEAAGHQIVGIDIRDAEVIADLSTAEGRKQAIADVLAKCSKGMDGLVLCAGLGPQTKVLGNVVSVNYFGATELMDAFLPALKKGHQPAAVVISSVASAHLAFDKNPLALALEAGEEAKARAIVEHAGEQGGNLAYAGSKNALTVAVRKRAAAWGEAGVRLNTIAPGATETPLLQAGLQDPRYGESIAKFVPPMGRRAEPSEMASVIAFLMSPAASYVHGAQIVIDGGIDAVMRPTQF,sabio,P80702,CC(C(O)CCC(C)(C)O)C1CCC2(O)C3=CC(=O)C4CC(=O)C(O)CC4(C)C3CCC12C,0.035,,7.0,1.1.1.50,285.0,-1.4559319556497243,-1.5289959734888434,CC(C(O)CCC(C)(C)O)C1CCC2(O)C3=CC(=O)C4CC(=O)C(O)CC4(C)C3CCC12C__MSIIVISGCATGIGAATRKVLEAAGHQIVGIDIRDAEVIADLSTAEGRKQAIADVLAKCSKGMDGLVLCAGLGPQTKVLGNVVSVNYFGATELMDAFLPALKKGHQPAAVVISSVASAHLAFDKNPLALALEAGEEAKARAIVEHAGEQGGNLAYAGSKNALTVAVRKRAAAWGEAGVRLNTIAPGATETPLLQAGLQDPRYGESIAKFVPPMGRRAEPSEMASVIAFLMSPAASYVHGAQIVIDGGIDAVMRPTQF,./data/raw/alphafold//AF-P80702-F1-model_v4.pdb,5541,200,220,246 +132,9028,9176,MEEVVIAGMSGKLPESENLQEFWANLIGGVDMVTDDDRRWKAGLYGLPKRSGKLKDLSKFDASFFGVHPKQAHTMDPQLRLLLEVSYEAIVDGGINPASLRGTNTGVWVGVSGSEASEALSRDPETLLGYSMVGCQRAMMANRLSFFFDFKGPSIALDTACSSSLLALQNAYQAIRSGECPAALVGGINLLLKPNTSVQFMKLGMLSPDGTCRSFDDSGSGYCRSEAVVAVLLTKKSLARRVYATILNAGTNTDGSKEQGVTFPSGEVQEQLICSLYQPAGLAPESLEYIEAHGTGTKVGDPQELNGITRSLCAFRQAPLLIGSTKSNMGHPEPASGLAALTKVLLSLEHGVWAPNLHFHNPNPEIPALLDGRLQVVDRPLPVRGGNVGINSFGFGGSNVHVILQPNTRQAPAPTAHAALPHLLHASGRTLEAVQDLLEQGRQHSQDLAFVSMLNDIAATPTAAMPFRGYTVLGVEGRVQEVQQVSTNKRPLWFICSGMGTQWRGMGLSLMRLDSFRESILRSDEAVKPLGVKVSDLLLSTDERTFDDIVHAFVSLTAIQIALIDLLTSVGLKPDGIIGHSLGEVACGYADGCLSQREAVLAAYWRGQCIKDAHLPPGSMAAVGLSWEECKQRCPAGVVPACHNSEDTVTISGPQAAVNEFVEQLKQEGVFAKEVRTGGLAFHSYFMEGIAPTLLQALKKVIREPRPRSARWLSTSIPEAQWQSSLARTSSAEYNVNNLVSPVLFQEALWHIPEHAVVLEIAPHALLQAVLKRGVKSSCTIIPLMKRDHKDNLEFFLTNLGKVHLTGINVNPNALFPPVEFPAPRGTPLISPHIKWDHSQTWDVPVAEDFPNGSSSSSATVYSIDASPESPDHYLVDHCIDGRVIFPGTGYLCLVWKTLARSLGLSLEETPVVFENVSFHQATILPKTGTVALEVRLLEASHAFEVSDTGNLIVSGKVYLWEDPNSKLFDHPEVPTPPESASVSRLTQGEVYKELRLRGYDYGPQFQGICEATLEGEQGKLLWKDNWVTFMDTMLQVSILGSSQQSLQLPTRVTAIYIDPATHRQKVYRLKEDTQVADVTTSRCLGITVSGGIHISRLQTTATSRRQQEQLVPTLEKFVFTPHMEAECLSESTALQKELQLCKGLARALQTKATQQGLKAAMLGQEDPPQHGLPRLLAAACQLQLNGNLQLELGEALAQERLLLPEDPLISGLLNSQALKACVDTALENLSTLKMKVAEVLAGEGHLYSRIPALLNTQPMLQLEYTATDRHPQALKDVQTKLQQHDVAQGQWNPSDPAPSSLGALDLLVCNCALATLGDPALALDNMVAALKEGGFLLVHTVLKGHALGETLACLPSEVQPAPSLLSQEEWESLFSRKALHLVGLKRSFYGTALFLCRRAIPQEKPIFLSVEDTSFQWVDSLKSTLATSSSQPVWLTAMDCPTSGVVGLVNCLRKEPGGHRIRCILLSNLSNTSHAPKLDPGSPELQQVLKHDLVMNVYRDGAWGAFRHFQLEQDKPKEQTAHAFVNVLTRGDLASIRWVSSPLKHTQPSSSGAQLCTVYYASLNFRDIMLATGKLSPDAIPGKWASRDCMLGMEFSGRDRCGRRVMGLVPAEGLATSVLLSSDFLWDVPSSWTLEEAASVPVVYTTAYYSLVVRGRIQRGETVLIHSGSGGVGQAAISIALSLGCRVFTTVGSAEKRAYLQARFPQLDDTSFANSRDTSFEQHVLLHTGGKGVDLVLNSLAEEKLQASVRCLAQHGRFLEIGKFDLSNNHPLGMAIFLKNVTFHGILLDALFEEANDSWREVAALLKAGIRDGVVKPLKCTVFPKAQVEDAFRYMAQGKHIGKVLVQVREEEPEAVLPGAQPTLISAISKTFCPAHKSYIITGGLGGFGLELARWLVLRGAQRLVLTSRSGIRTGYQAKHIREWRRQGIQVLVSTSNVSSLEGARALIAEATKLGPVGGVFNLAMVLRDAMLENQTPELFQDVNKPKYNGTLNLDRATREACPELDYFVAFSSVSCGRGNAGQTNYGFANSTMERICEQRRHDGLPGLAVQWGAIGDVGIVLEAMGTNDTVIGGTLPQRISSCMEVLDLFLNQPHAVLSSFVLAEKKAVAHGDGDTQRDLVKAVAHILGIRDLAGINLDSTLADLGLDSLMGVEVRQILEREHDLVLPMREVRQLTLRKLQEMSSKTDSATDTTAPKSRSDTSLKQNQLNLSTLLVNPEGPTLTQLNSVQSSERPLFLVHPIEGSTTVFHSLAAKLSVPTYGLQCTQAAPLDSIPNLAAYYIDCIKQVQPEGPYRIAGYSFGACVAFEMCSQLQAQQGPAPTHNNLFLFDGSHTYVLAYTQSYRAKMTPGCEAEAEAEALCFFIKQFLDVEHSKVLEALLPLKSLEDRVAASVDLITKSHHSLDRRELSFAAVSFYHKLRAADQYKPKAKYHGNVTLLRAKTGGTYGEDLGADYNLSQVCDGKVSVHIIEGDHRTLLEGSGLESIINIIHSSLAEPRVSVREG,brenda,P19096,CCCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.00164,37.0,7.5,2.3.1.85,10090.0,-2.785156151952302,-2.785156151952302,CCCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MEEVVIAGMSGKLPESENLQEFWANLIGGVDMVTDDDRRWKAGLYGLPKRSGKLKDLSKFDASFFGVHPKQAHTMDPQLRLLLEVSYEAIVDGGINPASLRGTNTGVWVGVSGSEASEALSRDPETLLGYSMVGCQRAMMANRLSFFFDFKGPSIALDTACSSSLLALQNAYQAIRSGECPAALVGGINLLLKPNTSVQFMKLGMLSPDGTCRSFDDSGSGYCRSEAVVAVLLTKKSLARRVYATILNAGTNTDGSKEQGVTFPSGEVQEQLICSLYQPAGLAPESLEYIEAHGTGTKVGDPQELNGITRSLCAFRQAPLLIGSTKSNMGHPEPASGLAALTKVLLSLEHGVWAPNLHFHNPNPEIPALLDGRLQVVDRPLPVRGGNVGINSFGFGGSNVHVILQPNTRQAPAPTAHAALPHLLHASGRTLEAVQDLLEQGRQHSQDLAFVSMLNDIAATPTAAMPFRGYTVLGVEGRVQEVQQVSTNKRPLWFICSGMGTQWRGMGLSLMRLDSFRESILRSDEAVKPLGVKVSDLLLSTDERTFDDIVHAFVSLTAIQIALIDLLTSVGLKPDGIIGHSLGEVACGYADGCLSQREAVLAAYWRGQCIKDAHLPPGSMAAVGLSWEECKQRCPAGVVPACHNSEDTVTISGPQAAVNEFVEQLKQEGVFAKEVRTGGLAFHSYFMEGIAPTLLQALKKVIREPRPRSARWLSTSIPEAQWQSSLARTSSAEYNVNNLVSPVLFQEALWHIPEHAVVLEIAPHALLQAVLKRGVKSSCTIIPLMKRDHKDNLEFFLTNLGKVHLTGINVNPNALFPPVEFPAPRGTPLISPHIKWDHSQTWDVPVAEDFPNGSSSSSATVYSIDASPESPDHYLVDHCIDGRVIFPGTGYLCLVWKTLARSLGLSLEETPVVFENVSFHQATILPKTGTVALEVRLLEASHAFEVSDTGNLIVSGKVYLWEDPNSKLFDHPEVPTPPESASVSRLTQGEVYKELRLRGYDYGPQFQGICEATLEGEQGKLLWKDNWVTFMDTMLQVSILGSSQQSLQLPTRVTAIYIDPATHRQKVYRLKEDTQVADVTTSRCLGITVSGGIHISRLQTTATSRRQQEQLVPTLEKFVFTPHMEAECLSESTALQKELQLCKGLARALQTKATQQGLKAAMLGQEDPPQHGLPRLLAAACQLQLNGNLQLELGEALAQERLLLPEDPLISGLLNSQALKACVDTALENLSTLKMKVAEVLAGEGHLYSRIPALLNTQPMLQLEYTATDRHPQALKDVQTKLQQHDVAQGQWNPSDPAPSSLGALDLLVCNCALATLGDPALALDNMVAALKEGGFLLVHTVLKGHALGETLACLPSEVQPAPSLLSQEEWESLFSRKALHLVGLKRSFYGTALFLCRRAIPQEKPIFLSVEDTSFQWVDSLKSTLATSSSQPVWLTAMDCPTSGVVGLVNCLRKEPGGHRIRCILLSNLSNTSHAPKLDPGSPELQQVLKHDLVMNVYRDGAWGAFRHFQLEQDKPKEQTAHAFVNVLTRGDLASIRWVSSPLKHTQPSSSGAQLCTVYYASLNFRDIMLATGKLSPDAIPGKWASRDCMLGMEFSGRDRCGRRVMGLVPAEGLATSVLLSSDFLWDVPSSWTLEEAASVPVVYTTAYYSLVVRGRIQRGETVLIHSGSGGVGQAAISIALSLGCRVFTTVGSAEKRAYLQARFPQLDDTSFANSRDTSFEQHVLLHTGGKGVDLVLNSLAEEKLQASVRCLAQHGRFLEIGKFDLSNNHPLGMAIFLKNVTFHGILLDALFEEANDSWREVAALLKAGIRDGVVKPLKCTVFPKAQVEDAFRYMAQGKHIGKVLVQVREEEPEAVLPGAQPTLISAISKTFCPAHKSYIITGGLGGFGLELARWLVLRGAQRLVLTSRSGIRTGYQAKHIREWRRQGIQVLVSTSNVSSLEGARALIAEATKLGPVGGVFNLAMVLRDAMLENQTPELFQDVNKPKYNGTLNLDRATREACPELDYFVAFSSVSCGRGNAGQTNYGFANSTMERICEQRRHDGLPGLAVQWGAIGDVGIVLEAMGTNDTVIGGTLPQRISSCMEVLDLFLNQPHAVLSSFVLAEKKAVAHGDGDTQRDLVKAVAHILGIRDLAGINLDSTLADLGLDSLMGVEVRQILEREHDLVLPMREVRQLTLRKLQEMSSKTDSATDTTAPKSRSDTSLKQNQLNLSTLLVNPEGPTLTQLNSVQSSERPLFLVHPIEGSTTVFHSLAAKLSVPTYGLQCTQAAPLDSIPNLAAYYIDCIKQVQPEGPYRIAGYSFGACVAFEMCSQLQAQQGPAPTHNNLFLFDGSHTYVLAYTQSYRAKMTPGCEAEAEAEALCFFIKQFLDVEHSKVLEALLPLKSLEDRVAASVDLITKSHHSLDRRELSFAAVSFYHKLRAADQYKPKAKYHGNVTLLRAKTGGTYGEDLGADYNLSQVCDGKVSVHIIEGDHRTLLEGSGLESIINIIHSSLAEPRVSVREG,./data/raw/alphafold//AF-P19096-F1-model_v4.pdb,3460,274,1142,359 +133,13052,13245,AVPQSIDWRDYGAVTSVKNQNPCGACWAFAAIATVESIYKIKKGILEPLSEQQVLDCAKGYGCKGGWEFRAFEFIISNKGVASGAIYPYKAAKGTCKTDGVPNSAYITGYARVPRNNESSMMYAVSKQPITVAVDANANFQYYKSGVFNGPCGTSLNHAVTAIGYGQDSIIYPKKWGAKWGEAGYIRMARDVSSSSGICGIAIDPLYPTLEE,uniprot_search,P14518,COC(=O)[C@@](N)(CCCNC(=N)N)C(=O)c1ccccc1,32.0,49.083333333333336,6.358333333333334,3.4.22.32,4615.0,1.505149978319906,1.505149978319906,COC(=O)[C@@](N)(CCCNC(=N)N)C(=O)c1ccccc1__AVPQSIDWRDYGAVTSVKNQNPCGACWAFAAIATVESIYKIKKGILEPLSEQQVLDCAKGYGCKGGWEFRAFEFIISNKGVASGAIYPYKAAKGTCKTDGVPNSAYITGYARVPRNNESSMMYAVSKQPITVAVDANANFQYYKSGVFNGPCGTSLNHAVTAIGYGQDSIIYPKKWGAKWGEAGYIRMARDVSSSSGICGIAIDPLYPTLEE,./data/raw/alphafold//AF-P14518-F1-model_v4.pdb,4199,2080,1346,3111 +134,34628,35235,MFSVTRRRAAGAAAAMATATGTLYWMTSQGDRPLVHNDPSYMVQFPTAAPPQVSRRDLLDRLAKTHQFDVLIIGGGATGTGCALDAATRGLNVALVEKGDFASGTSSKSTKMIHGGVRYLEKAFWEFSKAQLDLVIEALNERKHLINTAPHLCTVLPILIPIYSTWQVPYIYMGCKFYDFFAGSQNLKKSYLLSKSATVEKAPMLTTDNLKASLVYHDGSFNDSRLNATLAITAVENGATVLNYVEVQKLIKDPTSGKVIGAEARDVETNELVRINAKCVVNATGPYSDAILQMDRNPSGLPDSPLNDNSKIKSTFNQIAVMDPKMVIPSIGVHIVLPSFYCPKDMGLLDVRTSDGRVMFFLPWQGKVLAGTTDIPLKQVPENPMPTEADIQDILKELQHYIEFPVKREDVLSAWAGVRPLVRDPRTIPADGKKGSATQGVVRSHFLFTSDNGLITIAGGKWTTYRQMAEETVDKVVEVGGFHNLKPCHTRDIKLAGAEEWTQNYVALLAQNYHLSSKMSNYLVQNYGTRSSIICEFFKESMENKLPLSLADKENNVIYSSEENNLVNFDTFRYPFTIGELKYSMQYEYCRTPLDFLLRRTRFAFLDAKEALNAVHATVKVMGDEFNWSEKKRQWELEKTVNFIKTFGV,sabio,P32191,O=P(O)(O)OCC(O)CO,23.0,,6.8,1.1.5.3,4932.0,1.3617278360175928,1.446603376529924,O=P(O)(O)OCC(O)CO__MFSVTRRRAAGAAAAMATATGTLYWMTSQGDRPLVHNDPSYMVQFPTAAPPQVSRRDLLDRLAKTHQFDVLIIGGGATGTGCALDAATRGLNVALVEKGDFASGTSSKSTKMIHGGVRYLEKAFWEFSKAQLDLVIEALNERKHLINTAPHLCTVLPILIPIYSTWQVPYIYMGCKFYDFFAGSQNLKKSYLLSKSATVEKAPMLTTDNLKASLVYHDGSFNDSRLNATLAITAVENGATVLNYVEVQKLIKDPTSGKVIGAEARDVETNELVRINAKCVVNATGPYSDAILQMDRNPSGLPDSPLNDNSKIKSTFNQIAVMDPKMVIPSIGVHIVLPSFYCPKDMGLLDVRTSDGRVMFFLPWQGKVLAGTTDIPLKQVPENPMPTEADIQDILKELQHYIEFPVKREDVLSAWAGVRPLVRDPRTIPADGKKGSATQGVVRSHFLFTSDNGLITIAGGKWTTYRQMAEETVDKVVEVGGFHNLKPCHTRDIKLAGAEEWTQNYVALLAQNYHLSSKMSNYLVQNYGTRSSIICEFFKESMENKLPLSLADKENNVIYSSEENNLVNFDTFRYPFTIGELKYSMQYEYCRTPLDFLLRRTRFAFLDAKEALNAVHATVKVMGDEFNWSEKKRQWELEKTVNFIKTFGV,./data/raw/alphafold//AF-P32191-F1-model_v4.pdb,2193,7675,9450,10566 +135,19909,20203,MSYTVITGANGFIAQHIIKILLSNGHKVIGTVRTQEKADTIANLFDNENLILEIVPDLNAVEAFDPLFKKYNTQIKYVLHTASPVDSTLTDLQNDFINTAITGTLSVFNAIKKYAADSVESVVYTSSSVAGANFKTFLDPTAVINEESWNPDDREDVVDILSAYSVSKKLAEKAAWNFKEENKDVIKFRLSTVNPFFVTGPQAFDETAKGKLNTTASYFEQILASKPDGNLAPFIGSPAVDVRDLAKAHYLALTEPRFDGQRIFLDGENYTTQQWYDVIHEKFPELNGKIAKGQPGTNKFQEGSMAKMDFSKSKKLLGFDQIPLKQTITDGMRQLLRVRGIPQN,brenda,A0A0E4AX59,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.028,25.0,6.0,1.1.1.184,4911.0,-1.5528419686577808,-1.5528419686577808,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MSYTVITGANGFIAQHIIKILLSNGHKVIGTVRTQEKADTIANLFDNENLILEIVPDLNAVEAFDPLFKKYNTQIKYVLHTASPVDSTLTDLQNDFINTAITGTLSVFNAIKKYAADSVESVVYTSSSVAGANFKTFLDPTAVINEESWNPDDREDVVDILSAYSVSKKLAEKAAWNFKEENKDVIKFRLSTVNPFFVTGPQAFDETAKGKLNTTASYFEQILASKPDGNLAPFIGSPAVDVRDLAKAHYLALTEPRFDGQRIFLDGENYTTQQWYDVIHEKFPELNGKIAKGQPGTNKFQEGSMAKMDFSKSKKLLGFDQIPLKQTITDGMRQLLRVRGIPQN,./data/raw/alphafold//AF-A0A0E4AX59-F1-model_v4.pdb,3436,908,1094,1348 +136,4786,4861,MKKYLLPVLVLCLGYYYSTNEEFRPEMLQGKKVIVTGASKGIGREMAYHLSKMGAHVVLTARSEEGLQKVVSRCLELGAASAHYIAGTMEDMAFAERFVVEAGKLLGGLDMLILNHITQTTMSLFHDDIHSVRRSMEVNFLSYVVLSTAALPMLKQSNGSIAIISSMAGKMTQPLIASYSASKFALDGFFSTIRKEHLMTKVNVSITLCVLGFIDTETALKETSGIILSQAAPKEECALEIIKGTVLRKDEVYYDKSSWTPLLLGNPGRRIMEFLSLRSYNRDLFVSN,uniprot_search,P16232,CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,0.00075,37.0,7.4,1.1.1.146,10116.0,-3.1249387366083,-3.121501145218384,CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C__MKKYLLPVLVLCLGYYYSTNEEFRPEMLQGKKVIVTGASKGIGREMAYHLSKMGAHVVLTARSEEGLQKVVSRCLELGAASAHYIAGTMEDMAFAERFVVEAGKLLGGLDMLILNHITQTTMSLFHDDIHSVRRSMEVNFLSYVVLSTAALPMLKQSNGSIAIISSMAGKMTQPLIASYSASKFALDGFFSTIRKEHLMTKVNVSITLCVLGFIDTETALKETSGIILSQAAPKEECALEIIKGTVLRKDEVYYDKSSWTPLLLGNPGRRIMEFLSLRSYNRDLFVSN,./data/raw/alphafold//AF-P16232-F1-model_v4.pdb,5105,1962,1588,2931 +137,25023,25414,MEKAAEIQMLKDFSNANATSGFENEFVDLFTKTVKDYADLEVDGMLNVYASKKQNTGKRPVIQLDAHSDAVGFLTQAIRPNGLIKFVTLGGWNNVVLPALKVKVRNRDGEYIPGVVALKPPHFMSEAERKSVPQVADLSIDVGSSSREETINDYKIDTGCPIFVDVDCEYNEKTGLFFGKDFDDRFGAAAMADILENLKDEEVNFDLVAALSSQEEVGLRGAYVTARKIKPDLCLVLESCPADDTFEPDWLSQTGLKRGPMLRDMDVTFLPNPKFQQYACDLADKNGIPYTRSVRTGGGQDGAAIYYENGAPTIVIGIPVRYEHSPYCFSSYKDYKAAVDLALAIIRDIDKEKLESFKSFN,brenda,F0HXE4,N[C@@H](CCC(=O)O)C(=O)Nc1ccc([N+](=O)[O-])cc1,25.2,60.0,6.0,3.4.11.21,29397.0,1.4014005407815442,1.4014005407815442,N[C@@H](CCC(=O)O)C(=O)Nc1ccc([N+](=O)[O-])cc1__MEKAAEIQMLKDFSNANATSGFENEFVDLFTKTVKDYADLEVDGMLNVYASKKQNTGKRPVIQLDAHSDAVGFLTQAIRPNGLIKFVTLGGWNNVVLPALKVKVRNRDGEYIPGVVALKPPHFMSEAERKSVPQVADLSIDVGSSSREETINDYKIDTGCPIFVDVDCEYNEKTGLFFGKDFDDRFGAAAMADILENLKDEEVNFDLVAALSSQEEVGLRGAYVTARKIKPDLCLVLESCPADDTFEPDWLSQTGLKRGPMLRDMDVTFLPNPKFQQYACDLADKNGIPYTRSVRTGGGQDGAAIYYENGAPTIVIGIPVRYEHSPYCFSSYKDYKAAVDLALAIIRDIDKEKLESFKSFN,./data/raw/alphafold//AF-F0HXE4-F1-model_v4.pdb,4843,6080,7863,10415 +138,26894,27357,MNIVVLISGNGSNLQAIIDACKTNKIKGTVRAVFSNKADAFGLERARQAGIATHTLIASAFDSREAYDRELIHEIDMYAPDVVVLAGFMRILSPAFVSHYAGRLLNIHPSLLPKYPGLHTHRQALENGDEEHGTSVHFVTDELDGGPVILQAKVPVFAGDSEDDITARVQTQEHAIYPLVISWFADGRLKMHENAAWLDGQRLPPQGYAADE,sabio,P08179,Nc1nc2ncc(CN(C=O)c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1,0.6,26.0,,2.1.2.2,562.0,-0.2218487496163563,-0.2218487496163563,Nc1nc2ncc(CN(C=O)c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1__MNIVVLISGNGSNLQAIIDACKTNKIKGTVRAVFSNKADAFGLERARQAGIATHTLIASAFDSREAYDRELIHEIDMYAPDVVVLAGFMRILSPAFVSHYAGRLLNIHPSLLPKYPGLHTHRQALENGDEEHGTSVHFVTDELDGGPVILQAKVPVFAGDSEDDITARVQTQEHAIYPLVISWFADGRLKMHENAAWLDGQRLPPQGYAADE,./data/raw/alphafold//AF-P08179-F1-model_v4.pdb,1261,6468,8338,10349 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+141,29571,30098,MGSMAAAAEAAQEEETVVFRSKLPDIEIPSHLTLQAYCFEKLPEVAARPCLIDGQTGAVYSYGEVEELSRRAAAGLRRLGVGKGDVVMSLLRNCPEFAFTFLGAARLGAATTTANPFYTPHEIHRQASAAGARVIVTEACAVEKVRGFAADRGIPVVAVDGDFDGCVGFGEAMLDASIEPLDADEEVHPDDVVALPYSSGTTGLPKGVMLTHRSLVTSVAQQVDGENPNLYFRREDVVLCLLPLFHIYSLNSVLLAGLRAGSAIVIMRKFDLGALVDLTRRHGVTVAPFVPPIVVEIAKSPRVTADDLASIRMVMSGAAPMGKDLQDAFMAKIPNAVLGQGYGMTEAGPVLAMCLAFAKEPFEVKSGSCGTVVRNAELKIVDPDTGATLGRNQSGEICIRGEQIMKGYLNDPESTKNTIDKGGWLHTGDIGYVDDDDEIFIVDRLKEIIKYKGFQVPPAELEALLITHPDIKDAAVVPMIDEIAGEVPVAFIVRIEGSAISENEIKQFVAKEVVFYKRLNKVFFADSIPKSPSGKILRKDLRAKLAAGIPTNDNTQLKS,brenda,Q67W82,O=C(O)/C=C/c1ccccc1,0.0157,30.0,7.5,6.2.1.12,4530.0,-1.8041003475907664,-1.8041003475907664,O=C(O)/C=C/c1ccccc1__MGSMAAAAEAAQEEETVVFRSKLPDIEIPSHLTLQAYCFEKLPEVAARPCLIDGQTGAVYSYGEVEELSRRAAAGLRRLGVGKGDVVMSLLRNCPEFAFTFLGAARLGAATTTANPFYTPHEIHRQASAAGARVIVTEACAVEKVRGFAADRGIPVVAVDGDFDGCVGFGEAMLDASIEPLDADEEVHPDDVVALPYSSGTTGLPKGVMLTHRSLVTSVAQQVDGENPNLYFRREDVVLCLLPLFHIYSLNSVLLAGLRAGSAIVIMRKFDLGALVDLTRRHGVTVAPFVPPIVVEIAKSPRVTADDLASIRMVMSGAAPMGKDLQDAFMAKIPNAVLGQGYGMTEAGPVLAMCLAFAKEPFEVKSGSCGTVVRNAELKIVDPDTGATLGRNQSGEICIRGEQIMKGYLNDPESTKNTIDKGGWLHTGDIGYVDDDDEIFIVDRLKEIIKYKGFQVPPAELEALLITHPDIKDAAVVPMIDEIAGEVPVAFIVRIEGSAISENEIKQFVAKEVVFYKRLNKVFFADSIPKSPSGKILRKDLRAKLAAGIPTNDNTQLKS,./data/raw/alphafold//AF-Q67W82-F1-model_v4.pdb,151,3518,4795,5063 +142,39363,40062,MKTAEPLSDLEDASNRTPLLDHPAPPPAAVKKQSFVRVLSSITLVSLFFVLAFVLIVLNQQDSTNATANLALPEKSSAQHYQSDRLTWERTAYHFQPAKNFIYDPNGPLFHMGWYHLFYQYNPYAPIWGNMSWGHAVSKDMINWFELPVALTPTEWYDIEGVLSGSTTALPNGQIFALYTGNANDFSQLQCKAVPLNTSDPLLLEWVKYENNPILFTPPGIGLKDYRDPSTVWTGPDGKHRMIMGTKINRTGLVLVYHTTDFTNYVMLEEPLHSVPDTDMWECVDLYPVSTINDSALDIAAYGPDMKHVIKESWEGHGMDWYSIGTYDVINDKWTPDNPELDVGIGLRVDYGRFFASKSLYDPLKKRRVTWGYVAESDSADQDLNRGWATIYNVARTIVLDRKTGTHLLHWPAEEIESLRYDGREFKEIELAPGSIMPLDIGPATQLDIVATFEVEQETFMRTSDTNGEYGCTTSAGATERGSLGPFGIAVLADGTLSELTPVYFYISKKTDGSVATHFCTDKLRSSLDYDGERVVYGSTVPVLDGEELTMRLLVDHSVVEGFAMGGRTVMTSRVYPTKAIYEGAKIFLFNNATHTSVKASLKIWQIASVRIQPYPF,uniprot_search,Q9ZR96,OC[C@H]1O[C@@](CO)(OC[C@@]2(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O,119.0,32.5,6.0,2.4.1.100,13427.0,2.0755469613925306,2.0755469613925306,OC[C@H]1O[C@@](CO)(OC[C@@]2(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O__MKTAEPLSDLEDASNRTPLLDHPAPPPAAVKKQSFVRVLSSITLVSLFFVLAFVLIVLNQQDSTNATANLALPEKSSAQHYQSDRLTWERTAYHFQPAKNFIYDPNGPLFHMGWYHLFYQYNPYAPIWGNMSWGHAVSKDMINWFELPVALTPTEWYDIEGVLSGSTTALPNGQIFALYTGNANDFSQLQCKAVPLNTSDPLLLEWVKYENNPILFTPPGIGLKDYRDPSTVWTGPDGKHRMIMGTKINRTGLVLVYHTTDFTNYVMLEEPLHSVPDTDMWECVDLYPVSTINDSALDIAAYGPDMKHVIKESWEGHGMDWYSIGTYDVINDKWTPDNPELDVGIGLRVDYGRFFASKSLYDPLKKRRVTWGYVAESDSADQDLNRGWATIYNVARTIVLDRKTGTHLLHWPAEEIESLRYDGREFKEIELAPGSIMPLDIGPATQLDIVATFEVEQETFMRTSDTNGEYGCTTSAGATERGSLGPFGIAVLADGTLSELTPVYFYISKKTDGSVATHFCTDKLRSSLDYDGERVVYGSTVPVLDGEELTMRLLVDHSVVEGFAMGGRTVMTSRVYPTKAIYEGAKIFLFNNATHTSVKASLKIWQIASVRIQPYPF,./data/raw/alphafold//AF-Q9ZR96-F1-model_v4.pdb,2708,8461,10267,11485 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+186,24011,24395,MAITVPRRQLFIGGQWTEPVLRKTLPVVNPATEDIIGYIPAATSEDVELAVEAARKAFTRNNGKDWARATGAVRAKYLRAIAAKVIERKSELANLEAIDCGKPLDEAAWDMDDVAGCFEYYADLAEGLDAKQKTPLSLPMDTFKGYILKEPIGVVGMITPWNYPLLMAVWKVAPSLAAGCTAILKPSELASLTCLELADICREVGLPPGVLNILTGLGTEAGAPLASHPHVDKIVFTGSTTTGSSIMTSAAKLVKPVSLELGGKSPIIVFDDVDIDKAVEWTMFGCFWTNGQICSATSRLLVHERIADEFLDKLVKWTKNIKISDPFEEGCRLGPVVSKGQYERVLKFVSNARNEGATVLCGGVRPEHLKKGYFVEPAIVSNVTTSMEIWREEVFGPALCVKTFSTEDEAIQLANDSQYGLAGAVLSNDLERCDRVSKAFQAGIVWVNCSQPCFCQAPWGGTKRSGFGRELGEWGLENYLSVKQVTQYISDEPWGWYKPPSKL,brenda,Q9STS1,NCCC=O,0.46,22.0,9.5,1.2.1.19,3702.0,-0.3372421683184259,0.1154797778742845,NCCC=O__MAITVPRRQLFIGGQWTEPVLRKTLPVVNPATEDIIGYIPAATSEDVELAVEAARKAFTRNNGKDWARATGAVRAKYLRAIAAKVIERKSELANLEAIDCGKPLDEAAWDMDDVAGCFEYYADLAEGLDAKQKTPLSLPMDTFKGYILKEPIGVVGMITPWNYPLLMAVWKVAPSLAAGCTAILKPSELASLTCLELADICREVGLPPGVLNILTGLGTEAGAPLASHPHVDKIVFTGSTTTGSSIMTSAAKLVKPVSLELGGKSPIIVFDDVDIDKAVEWTMFGCFWTNGQICSATSRLLVHERIADEFLDKLVKWTKNIKISDPFEEGCRLGPVVSKGQYERVLKFVSNARNEGATVLCGGVRPEHLKKGYFVEPAIVSNVTTSMEIWREEVFGPALCVKTFSTEDEAIQLANDSQYGLAGAVLSNDLERCDRVSKAFQAGIVWVNCSQPCFCQAPWGGTKRSGFGRELGEWGLENYLSVKQVTQYISDEPWGWYKPPSKL,./data/raw/alphafold//AF-Q9STS1-F1-model_v4.pdb,5311,5980,7099,5798 +187,39230,39929,MKQEKVQELVSQMTLDEKIAQCLQLSPFLFKGTNKNAELTGPLLQEMKLTDAHTENAGSVLGSSSALDMIGIQEAYLKTNRLGIPLVFMADVIHGYKTVFPIPLALGCSFDRETVRVMAEVSALEATADGHHVTFSPMLDLVRDPRWGRVMESTGEDPFLNSELGKAMVDGYQGDASKLNENLEQMAACVKHFAAYGAAEAGLEYNTVNMSTRELYQNYLPAYNAAIQAGAKLVMTAFNVVDGIPATMNKWLNRDVLRGEMEFDGVLISDWGAVAEVINHGTARNPKEAAQFSMEAGVDLEMMTTCYIHELKGLIEEGKLSENLLDEAVLRMLNLKNDLGLFEDPYRGLKNNDRTKDILTDESRGKARAAGVESAVLLENKSRLLPLAKEAKIALVGPLATSPDILGGWNVYGEEKDGINVETGLREVFETVEVVSTEYTELSEEDKVAVKAAVQNMDVVVLALGEKNEWGGEAGSLATIRLPEAQYQLAKFVQTLGKPVVITLFNGRPLEVKELAESSDALLELWFPGTEAGRVTADLLSGASNPSGKLSMSFPQTTGQIPVYYNHLRTGRPQTPENKGERYVSHYLDIPNEPFYPFGYGKSYSEFELKTSSLPKELNLGESLHVEVTIKNISDIAGKEVIQVYLQDVTASISRPVKELKAFEKVALQAGEEKTVTFELTSEAFSFYNHQLEKVQEPGLHRVFVGTSSEDVDVFEVEVGGYV,brenda,Q92AS9,OC[C@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3C(O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,15.0,20.0,6.0,3.2.1.21,272626.0,1.1760912590556811,1.1760912590556811,OC[C@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3C(O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O__MKQEKVQELVSQMTLDEKIAQCLQLSPFLFKGTNKNAELTGPLLQEMKLTDAHTENAGSVLGSSSALDMIGIQEAYLKTNRLGIPLVFMADVIHGYKTVFPIPLALGCSFDRETVRVMAEVSALEATADGHHVTFSPMLDLVRDPRWGRVMESTGEDPFLNSELGKAMVDGYQGDASKLNENLEQMAACVKHFAAYGAAEAGLEYNTVNMSTRELYQNYLPAYNAAIQAGAKLVMTAFNVVDGIPATMNKWLNRDVLRGEMEFDGVLISDWGAVAEVINHGTARNPKEAAQFSMEAGVDLEMMTTCYIHELKGLIEEGKLSENLLDEAVLRMLNLKNDLGLFEDPYRGLKNNDRTKDILTDESRGKARAAGVESAVLLENKSRLLPLAKEAKIALVGPLATSPDILGGWNVYGEEKDGINVETGLREVFETVEVVSTEYTELSEEDKVAVKAAVQNMDVVVLALGEKNEWGGEAGSLATIRLPEAQYQLAKFVQTLGKPVVITLFNGRPLEVKELAESSDALLELWFPGTEAGRVTADLLSGASNPSGKLSMSFPQTTGQIPVYYNHLRTGRPQTPENKGERYVSHYLDIPNEPFYPFGYGKSYSEFELKTSSLPKELNLGESLHVEVTIKNISDIAGKEVIQVYLQDVTASISRPVKELKAFEKVALQAGEEKTVTFELTSEAFSFYNHQLEKVQEPGLHRVFVGTSSEDVDVFEVEVGGYV,./data/raw/alphafold//AF-Q92AS9-F1-model_v4.pdb,2457,8066,9923,11101 +188,36688,37328,MIAAQLLAYYFTELKDDQVKKIDKYLYAMRLSDETLIDIMTRFRKEMKNGLSRDFNPTATVKMLPTFVRSIPDGSEKGDFIALDLGGSSFRILRVQVNHEKNQNVHMESEVYDTPENIVHGSGSQLFDHVAECLGDFMEKRKIKDKKLPVGFTFSFPCQQSKIDEAILITWTKRFKASGVEGADVVKLLNKAIKKRGDYDANIVAVVNDTVGTMMTCGYDDQHCEVGLIIGTGTNACYMEELRHIDLVEGDEGRMCINTEWGAFGDDGSLEDIRTEFDREIDRGSLNPGKQLFEKMVSGMYLGELVRLILVKMAKEGLLFEGRITPELLTRGKFNTSDVSAIEKNKEGLHNAKEILTRLGVEPSDDDCVSVQHVCTIVSFRSANLVAATLGAILNRLRDNKGTPRLRTTVGVDGSLYKTHPQYSRRFHKTLRRLVPDSDVRFLLSESGSGKGAAMVTAVAYRLAEQHRQIEETLAHFHLTKDMLLEVKKRMRAEMELGLRKQTHNNAVVKMLPSFVRRTPDGTENGDFLALDLGGTNFRVLLVKIRSGKKRTVEMHNKIYAIPIEIMQGTGEELFDHIVSCISDFLDYMGIKGPRMPLGFTFSFPCQQTSLDAGILITWTKGFKATDCVGHDVVTLLRDAIKRREEFDLDVVAVVNDTVGTMMTCAYEEPTCEVGLIVGTGSNACYMEEMKNVEMVEGDQGQMCINMEWGAFGDNGCLDDIRTHYDRLVDEYSLNAGKQRYEKMISGMYLGEIVRNILIDFTKKGFLFRGQISETLKTRGIFETKFLSQIESDRLALLQVRAILQQLGLNSTCDDSILVKTVCGVVSRRAAQLCGAGMAAVVDKIRENRGLDRLNVTVGVDGTLYKLHPHFSRIMHQTVKELSPKCNVSFLLSEDGSGKGAALITAVGVRLRTEASS,sabio,P19367,O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,8.0,37.0,8.1,2.7.1.1,9606.0,0.9030899869919436,0.8673533304426542,O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MIAAQLLAYYFTELKDDQVKKIDKYLYAMRLSDETLIDIMTRFRKEMKNGLSRDFNPTATVKMLPTFVRSIPDGSEKGDFIALDLGGSSFRILRVQVNHEKNQNVHMESEVYDTPENIVHGSGSQLFDHVAECLGDFMEKRKIKDKKLPVGFTFSFPCQQSKIDEAILITWTKRFKASGVEGADVVKLLNKAIKKRGDYDANIVAVVNDTVGTMMTCGYDDQHCEVGLIIGTGTNACYMEELRHIDLVEGDEGRMCINTEWGAFGDDGSLEDIRTEFDREIDRGSLNPGKQLFEKMVSGMYLGELVRLILVKMAKEGLLFEGRITPELLTRGKFNTSDVSAIEKNKEGLHNAKEILTRLGVEPSDDDCVSVQHVCTIVSFRSANLVAATLGAILNRLRDNKGTPRLRTTVGVDGSLYKTHPQYSRRFHKTLRRLVPDSDVRFLLSESGSGKGAAMVTAVAYRLAEQHRQIEETLAHFHLTKDMLLEVKKRMRAEMELGLRKQTHNNAVVKMLPSFVRRTPDGTENGDFLALDLGGTNFRVLLVKIRSGKKRTVEMHNKIYAIPIEIMQGTGEELFDHIVSCISDFLDYMGIKGPRMPLGFTFSFPCQQTSLDAGILITWTKGFKATDCVGHDVVTLLRDAIKRREEFDLDVVAVVNDTVGTMMTCAYEEPTCEVGLIVGTGSNACYMEEMKNVEMVEGDQGQMCINMEWGAFGDNGCLDDIRTHYDRLVDEYSLNAGKQRYEKMISGMYLGEIVRNILIDFTKKGFLFRGQISETLKTRGIFETKFLSQIESDRLALLQVRAILQQLGLNSTCDDSILVKTVCGVVSRRAAQLCGAGMAAVVDKIRENRGLDRLNVTVGVDGTLYKLHPHFSRIMHQTVKELSPKCNVSFLLSEDGSGKGAALITAVGVRLRTEASS,./data/raw/alphafold//AF-P19367-F1-model_v4.pdb,1308,6555,2810,8669 +189,23121,23476,MSTSWSDRLQNAADMPANMDKHALKKYRREAYHRVFVNRSLAMEKIKCFGFDMDYTLAVYKSPEYESLGFELTVERLVSIGYPQELLSFAYDSTFPTRGLVFDTLYGNLLKVDAYGNLLVCAHGFNFIRGPETREQYPNKFIQRDDTERFYILNTLFNLPETYLLACLVDFFTNCPRYTSCETGFKDGDLFMSYRSMFQDVRDAVDWVHYKGSLKEKTVENLEKYVVKDGKLPLLLSRMKEVGKVFLATNSDYKYTDKIMTYLFDFPHGPKPGSSHRPWQSYFDLILVDARKPLFFGEGTVLRQVDTKTGKLKIGTYTGPLQHGIVYSGGSSDTICDLLGAKGKDILYIGDHIFGDILKSKKRQGWRTFLVIPELAQELHVWTDKSSLFEELQSLDIFLAELYKHLDSSSNERPDISSIQRRIKKVTHDMDMCYGMMGSLFRSGSRQTLFASQVMRYADLYAASFINLLYYPFSYLFRAAHVLMPHESTVEHTHVDINEMESPLATRNRTSVDFKDTDYKRHQLTRSISEIKPPNLFPLAPQEITHCHDEDDDEEEEEEEE,brenda,P49902,NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)n1,0.095,37.0,7.5,3.1.3.5,9606.0,-1.0222763947111522,-1.256371155728415,NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)n1__MSTSWSDRLQNAADMPANMDKHALKKYRREAYHRVFVNRSLAMEKIKCFGFDMDYTLAVYKSPEYESLGFELTVERLVSIGYPQELLSFAYDSTFPTRGLVFDTLYGNLLKVDAYGNLLVCAHGFNFIRGPETREQYPNKFIQRDDTERFYILNTLFNLPETYLLACLVDFFTNCPRYTSCETGFKDGDLFMSYRSMFQDVRDAVDWVHYKGSLKEKTVENLEKYVVKDGKLPLLLSRMKEVGKVFLATNSDYKYTDKIMTYLFDFPHGPKPGSSHRPWQSYFDLILVDARKPLFFGEGTVLRQVDTKTGKLKIGTYTGPLQHGIVYSGGSSDTICDLLGAKGKDILYIGDHIFGDILKSKKRQGWRTFLVIPELAQELHVWTDKSSLFEELQSLDIFLAELYKHLDSSSNERPDISSIQRRIKKVTHDMDMCYGMMGSLFRSGSRQTLFASQVMRYADLYAASFINLLYYPFSYLFRAAHVLMPHESTVEHTHVDINEMESPLATRNRTSVDFKDTDYKRHQLTRSISEIKPPNLFPLAPQEITHCHDEDDDEEEEEEEE,./data/raw/alphafold//AF-P49902-F1-model_v4.pdb,4646,5777,7473,8408 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+191,794,817,MLYIRKKMTSMIVKTTPELFKGNGVFRTDHLGENRMVSRSNRLGDGSNRFPRTGTIHCQRLSIAKTGLHRETKARAILSPVSDPAASIAQKRVFTFGKGRSEGNKGMKSLLGGKGANLAEMASIGLSVPPGLTISTEACQQYQIAGKKLPEGLWEEILEGLSFIERDIGASLADPSKPLLLSVRSGAAISMPGMMDTVLNLGLNDQVVVGLAAKSGERFAYDSFRRFLDMFGDVVMGIPHAKFEEKLERMKERKGVKNDTDLSAADLKELVEQYKSVYLEAKGQEFPSDPKKQLELAIEAVFDSWDSPRANKYRSINQITGLKGTAVNIQCMVFGNMGDTSGTGVLFTRNPSTGEKKLYGEFLVNAQGEDVVAGIRTPEDLDTMKRFMPEAYAELVENCNILERHYKDMMDIEFTVQEERLWMLQCRAGKRTGKGAVKIAVDMVGEGLVEKSSAIKMVEPQHLDQLLHPQFHDPSGYREKVVAKGLPASPGAAVGQVVFTAEEAEAWHSQGKTVILVRTETSPDDVGGMHAAEGILTARGGMTSHAAVVARGWGKCCIAGCSEIRVDENHKVLLIGDLTINEGEWISMNGSTGEVILGKQALAPPALSPDLETFMSWADAIRRLKVMANADTPEDAIAARKNGAQGIGLCRTEHMFFGADRIKAVRKMIMAVTTEQRKASLDILLPYQRSDFEGIFRAMDGLPVTIRLLDPPLHEFLPEGDLDNIVHELAEETGVKEDEVLSRIEKLSEVNPMLGFRGCRLGISYPELTEMQARAIFEAAASMQDQGVTVIPEIMVPLVGTPQELGHQVDVIRKVAKKVFAEKGHTVSYKVGTMIEIPRAALIADEIAKEAEFFSFGTNDLTQMTFGYSRDDVGKFLPIYLAKGILQHDPFEVLDQQGVGQLIKMATEKGRAARPSLKVGICGEHGGDPSSVGFFAEAGLDYVSCSPFRVPIARLAAAQVVVA,sabio,O23404,C=C(OP(=O)(O)O)C(=O)O,0.292,30.0,,2.7.9.1,3702.0,-0.5346171485515817,-0.5346171485515817,C=C(OP(=O)(O)O)C(=O)O__MLYIRKKMTSMIVKTTPELFKGNGVFRTDHLGENRMVSRSNRLGDGSNRFPRTGTIHCQRLSIAKTGLHRETKARAILSPVSDPAASIAQKRVFTFGKGRSEGNKGMKSLLGGKGANLAEMASIGLSVPPGLTISTEACQQYQIAGKKLPEGLWEEILEGLSFIERDIGASLADPSKPLLLSVRSGAAISMPGMMDTVLNLGLNDQVVVGLAAKSGERFAYDSFRRFLDMFGDVVMGIPHAKFEEKLERMKERKGVKNDTDLSAADLKELVEQYKSVYLEAKGQEFPSDPKKQLELAIEAVFDSWDSPRANKYRSINQITGLKGTAVNIQCMVFGNMGDTSGTGVLFTRNPSTGEKKLYGEFLVNAQGEDVVAGIRTPEDLDTMKRFMPEAYAELVENCNILERHYKDMMDIEFTVQEERLWMLQCRAGKRTGKGAVKIAVDMVGEGLVEKSSAIKMVEPQHLDQLLHPQFHDPSGYREKVVAKGLPASPGAAVGQVVFTAEEAEAWHSQGKTVILVRTETSPDDVGGMHAAEGILTARGGMTSHAAVVARGWGKCCIAGCSEIRVDENHKVLLIGDLTINEGEWISMNGSTGEVILGKQALAPPALSPDLETFMSWADAIRRLKVMANADTPEDAIAARKNGAQGIGLCRTEHMFFGADRIKAVRKMIMAVTTEQRKASLDILLPYQRSDFEGIFRAMDGLPVTIRLLDPPLHEFLPEGDLDNIVHELAEETGVKEDEVLSRIEKLSEVNPMLGFRGCRLGISYPELTEMQARAIFEAAASMQDQGVTVIPEIMVPLVGTPQELGHQVDVIRKVAKKVFAEKGHTVSYKVGTMIEIPRAALIADEIAKEAEFFSFGTNDLTQMTFGYSRDDVGKFLPIYLAKGILQHDPFEVLDQQGVGQLIKMATEKGRAARPSLKVGICGEHGGDPSSVGFFAEAGLDYVSCSPFRVPIARLAAAQVVVA,./data/raw/alphafold//AF-O23404-F1-model_v4.pdb,3155,807,544,657 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+209,20532,20841,MAFANLRKILISDSLDPCCRKILQDGGLQVVEKQNLSKEELIAELQDCEGLIVRSATKVTADVINAAEKLQVVGRAGTGVDNVDLEAATRKGVLVMNTPNGNSLSAAELTCGMLMCLARQIPQATASMKDGKWDRKKFMGTELNGKTLGILGLGRIGREVAARMQAFGMKTVGYDPIISPEVAASFGVQQLPLEEIWPLCDFITVHTPLLPSTTGLLNDSTFAQCKKGVRVVNCARGGIVDEGALLRALQSGQCAGAALDVFTEEPPRDRALVDHENVISCPHLGASTKEAQSRCGEEIAVQFVDMVKGKSLTGVVNAQALTSAFSPHTKPWIGLAEALGTLMHAWAGSPKGTIQVVTQGTSLKNAGTCLSPAVIVGLLREASKQADVNLVNAKLLVKEAGLNVTTSHSPGVPGEQGIGECLLTVALAGAPYQAVGLVQGTTPMLQMLNGAVFRPEVPLRRGQPLLLFRAQPSDPVMLPTMIGLLAEAGVQLLSYQTSKVSDGDTWHVMGLSSLLPSLDAWKQHVSEAFQFCF,brenda,O08651,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.027,37.0,7.4,1.1.1.95,10116.0,-1.5686362358410126,-1.5686362358410126,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MAFANLRKILISDSLDPCCRKILQDGGLQVVEKQNLSKEELIAELQDCEGLIVRSATKVTADVINAAEKLQVVGRAGTGVDNVDLEAATRKGVLVMNTPNGNSLSAAELTCGMLMCLARQIPQATASMKDGKWDRKKFMGTELNGKTLGILGLGRIGREVAARMQAFGMKTVGYDPIISPEVAASFGVQQLPLEEIWPLCDFITVHTPLLPSTTGLLNDSTFAQCKKGVRVVNCARGGIVDEGALLRALQSGQCAGAALDVFTEEPPRDRALVDHENVISCPHLGASTKEAQSRCGEEIAVQFVDMVKGKSLTGVVNAQALTSAFSPHTKPWIGLAEALGTLMHAWAGSPKGTIQVVTQGTSLKNAGTCLSPAVIVGLLREASKQADVNLVNAKLLVKEAGLNVTTSHSPGVPGEQGIGECLLTVALAGAPYQAVGLVQGTTPMLQMLNGAVFRPEVPLRRGQPLLLFRAQPSDPVMLPTMIGLLAEAGVQLLSYQTSKVSDGDTWHVMGLSSLLPSLDAWKQHVSEAFQFCF,./data/raw/alphafold//AF-O08651-F1-model_v4.pdb,4018,4813,6649,6606 +210,15494,15714,MIILAFDIFGTVLDTSTVIQEFRNKQLEYTWLLTIMGKYVEFEEITKITLRYILKVRGEESKFDEELNKWKNLKAYEDTKYLKEISEIAEVYALSNGSINEVKQHLERNGLLRYFKGIFSAESVKEYKPSPKVYKYFLDSIGAKEAFLVSSNAFDVIGAKNAGMRSIFVNRKNTIVDPIGGKPDVIVNDFKELYEWILRYK,brenda,Q96XE7,C[C@H](Cl)C(=O)[O-],1.7,70.0,9.5,3.8.1.2,111955.0,0.2304489213782739,0.2304489213782739,C[C@H](Cl)C(=O)[O-]__MIILAFDIFGTVLDTSTVIQEFRNKQLEYTWLLTIMGKYVEFEEITKITLRYILKVRGEESKFDEELNKWKNLKAYEDTKYLKEISEIAEVYALSNGSINEVKQHLERNGLLRYFKGIFSAESVKEYKPSPKVYKYFLDSIGAKEAFLVSSNAFDVIGAKNAGMRSIFVNRKNTIVDPIGGKPDVIVNDFKELYEWILRYK,./data/raw/alphafold//AF-Q96XE7-F1-model_v4.pdb,5421,3205,3952,4606 +211,10626,10782,MSSQVEHPAGGYKKLFETVEELSSPLTAHVTGRIPLWLTGSLLRCGPGLFEVGSEPFYHLFDGQALLHKFDFKEGHVTYHRRFIRTDAYVRAMTEKRIVITEFGTCAFPDPCKNIFSRFFSYFRGVEVTDNALVNIYPVGEDYYACTETNFITKVNPETLETIKQVDLCNYVSVNGATAHPHIENDGTVYNIGNCFGKNFSIAYNIVKIPPLQADKEDPISKSEIVVQFPCSDRFKPSYVHSFGLTPNYIVFVETPVKINLFKFLSSWSLWGANYMDCFESNETMGVWLHIADKKRKKYINNKYRTSPFNLFHHINTYEDHEFLIVDLCCWKGFEFVYNYLYLANLRENWEEVKKNARKAPQPEVRRYVLPLNIDKADTGKNLVTLPNTTATAILCSDETIWLEPEVLFSGPRQAFEFPQINYQKYGGKPYTYAYGLGLNHFVPDRLCKLNVKTKETWVWQEPDSYPSEPIFVSHPDALEEDDGVVLSVVVSPGAGQKPAYLLILNAKDLSEVARAEVEINIPVTFHGLFKKS,uniprot_search,Q28175,CCCCCCCCCCCCCCCC(=O)OC/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C,0.027,37.0,8.0,3.1.1.64,9913.0,-1.5686362358410126,-1.5686362358410126,CCCCCCCCCCCCCCCC(=O)OC/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C__MSSQVEHPAGGYKKLFETVEELSSPLTAHVTGRIPLWLTGSLLRCGPGLFEVGSEPFYHLFDGQALLHKFDFKEGHVTYHRRFIRTDAYVRAMTEKRIVITEFGTCAFPDPCKNIFSRFFSYFRGVEVTDNALVNIYPVGEDYYACTETNFITKVNPETLETIKQVDLCNYVSVNGATAHPHIENDGTVYNIGNCFGKNFSIAYNIVKIPPLQADKEDPISKSEIVVQFPCSDRFKPSYVHSFGLTPNYIVFVETPVKINLFKFLSSWSLWGANYMDCFESNETMGVWLHIADKKRKKYINNKYRTSPFNLFHHINTYEDHEFLIVDLCCWKGFEFVYNYLYLANLRENWEEVKKNARKAPQPEVRRYVLPLNIDKADTGKNLVTLPNTTATAILCSDETIWLEPEVLFSGPRQAFEFPQINYQKYGGKPYTYAYGLGLNHFVPDRLCKLNVKTKETWVWQEPDSYPSEPIFVSHPDALEEDDGVVLSVVVSPGAGQKPAYLLILNAKDLSEVARAEVEINIPVTFHGLFKKS,./data/raw/alphafold//AF-Q28175-F1-model_v4.pdb,4921,3125,3862,4492 +212,22675,23027,MKHLTTMSELSTEEIKDLLQTAQELKSGKTDNQLTGKFAANLFFEPSTRTRFSFEVAEKKLGMNVLNLDGTSTSVQKGETLYDTIRTLESIGVDVCVIRHSEDEYYEELVSQVNIPILNAGDGCGQHPTQSLLDLMTIYEEFNTFKGLTVSIHGDIKHSRVARSNAEVLTRLGARVLFSGPSEWQDEENTFGTYVSMDEAVESSDVVMLLRIQNERHQSAVSQEGYLNKYGLTVERAERMKRHAIIMHPAPVNRGVEIDDSLVESEKSRIFKQMKNGVFIRMAVIQRALQTNVKRGEAAYVISH,sabio,P05654,NC(=O)OP(=O)(O)O,0.095,25.0,8.3,2.1.3.2,1423.0,-1.0222763947111522,-1.0222763947111522,NC(=O)OP(=O)(O)O__MKHLTTMSELSTEEIKDLLQTAQELKSGKTDNQLTGKFAANLFFEPSTRTRFSFEVAEKKLGMNVLNLDGTSTSVQKGETLYDTIRTLESIGVDVCVIRHSEDEYYEELVSQVNIPILNAGDGCGQHPTQSLLDLMTIYEEFNTFKGLTVSIHGDIKHSRVARSNAEVLTRLGARVLFSGPSEWQDEENTFGTYVSMDEAVESSDVVMLLRIQNERHQSAVSQEGYLNKYGLTVERAERMKRHAIIMHPAPVNRGVEIDDSLVESEKSRIFKQMKNGVFIRMAVIQRALQTNVKRGEAAYVISH,./data/raw/alphafold//AF-P05654-F1-model_v4.pdb,4614,5722,7398,8306 +213,34320,34921,MTSIQQRDAQSVLAAIDNLLPEIRDRAQATEDLRRLPDETVKALDDVGFFTLLQPQQWGGLQCDPALFFEATRRLASVCGSTGWVSSIVGVHNWHLALFDQRAQEEVWGEDPSTRISSSYAPMGAGVVVDGGYLVNGSWNWSSGCDHASWTFVGGPVIKDGRPVDFGSFLIPRSEYEIKDVWYVVGLRGTGSNTLVVKDVFVPRHRFLSYKAMNDHTAGGLATNSAPVYKMPWGTMHPTTISAPIVGMAYGAYAAHVEHQGKRVRAAFAGEKAKDDPFAKVRIAEAASDIDAAWRQLIGNVSDEYALLAAGKEIPFELRARARRDQVRATGRSIASIDRLFEASGATALSNEAPIQRFWRDAHAGRVHAANDPERAYVIFGNHEFGLPPGDTMV,brenda,P9WJA1,O=O,0.1,25.0,7.4,1.14.14.12,1773.0,-1.0,-1.0,O=O__MTSIQQRDAQSVLAAIDNLLPEIRDRAQATEDLRRLPDETVKALDDVGFFTLLQPQQWGGLQCDPALFFEATRRLASVCGSTGWVSSIVGVHNWHLALFDQRAQEEVWGEDPSTRISSSYAPMGAGVVVDGGYLVNGSWNWSSGCDHASWTFVGGPVIKDGRPVDFGSFLIPRSEYEIKDVWYVVGLRGTGSNTLVVKDVFVPRHRFLSYKAMNDHTAGGLATNSAPVYKMPWGTMHPTTISAPIVGMAYGAYAAHVEHQGKRVRAAFAGEKAKDDPFAKVRIAEAASDIDAAWRQLIGNVSDEYALLAAGKEIPFELRARARRDQVRATGRSIASIDRLFEASGATALSNEAPIQRFWRDAHAGRVHAANDPERAYVIFGNHEFGLPPGDTMV,./data/raw/alphafold//AF-P9WJA1-F1-model_v4.pdb,918,4345,5796,6211 +214,12798,12984,MKNTIHINFAIFLIIANIIYSSASASTDISTVASPLFEGTEGCFLLYDVSTNAEIAQFNKAKCATQMAPDSTFKIALSLMAFDAEIIDQKTIFKWDKTPKGMEIWNSNHTPKTWMQFSVVWVSQEITQKIGLNKIKNYLKDFDYGNQDFSGDKERNNGLTEAWLESSLKISPEEQIQFLRKIINHNLPVKNSAIENTIENMYLQDLENSTKLYGKTGAGFTANRTLQNGWFEGFIISKSGHKYVFVSALTGNLGSNLTSSIKAKKNAITILNTLNL,brenda,E7BCS7,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1ccco1,0.009,25.0,7.2,3.5.2.6,944673.0,-2.0457574905606752,-2.0457574905606752,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1ccco1__MKNTIHINFAIFLIIANIIYSSASASTDISTVASPLFEGTEGCFLLYDVSTNAEIAQFNKAKCATQMAPDSTFKIALSLMAFDAEIIDQKTIFKWDKTPKGMEIWNSNHTPKTWMQFSVVWVSQEITQKIGLNKIKNYLKDFDYGNQDFSGDKERNNGLTEAWLESSLKISPEEQIQFLRKIINHNLPVKNSAIENTIENMYLQDLENSTKLYGKTGAGFTANRTLQNGWFEGFIISKSGHKYVFVSALTGNLGSNLTSSIKAKKNAITILNTLNL,./data/raw/alphafold//AF-E7BCS7-F1-model_v4.pdb,12,2699,3366,3891 +215,35456,36076,MRFLIMAAIRWVVLAYIVVIGCATIARGDEQPLSRIAIERATVAAVDSASVKAQPTVLGLKGQSSDWVVVEFSHPKPSNDDWIGVFSPSGFSSEICQPEYYGDLPPYLCTSPIKFQYANFNNADYNRSGKGLLRLQLINQREDFSFALFSGGLSAPKLIAISNKVSFQNPKAPVYPRLAQGKSWNEMTVTWTSGYSIKEAIPFVEWGHKGGNQMLSPAGTLTFSRNSMCGSPARTVGWRDPGYIHTSFLKELWPDSLYTYRLGHRLLDGTHIWSKSYSFRASPYPGQDSVQRVVIFGDMGKAEIDGSDEYGNYEQASLYTTNQLIKELDSIDMVIHIGDLSYANGYLSQWDQFTQQIEPIASTVPYMIGSGNHERDWPGSGSFYGHNDSGGECGVPTQTMFYVPAENRAKLWYSTDYGMFRFCIADTEQDWRPGTEQYKFIEQCLSSVDRSKQPWLIFLAHRVLGYSSASWYEIMMGSYGEPMGRDGLEELWQKYKVDLAVFGHIHSYERTCPIYQNRCVQDGSNLYTGQFNATTHVIVGGGGAMLSPFRATVPYWSFFRDYDFGFSKLTALNHSTLLFEYKKSRDGKVYDHFTISRDYRDIMACSIDNCPRTTLAV,brenda,I4DHV7,O=P(O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O,2.2,37.0,4.5,3.6.1.9,4530.0,0.3424226808222063,0.3424226808222063,O=P(O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O__MRFLIMAAIRWVVLAYIVVIGCATIARGDEQPLSRIAIERATVAAVDSASVKAQPTVLGLKGQSSDWVVVEFSHPKPSNDDWIGVFSPSGFSSEICQPEYYGDLPPYLCTSPIKFQYANFNNADYNRSGKGLLRLQLINQREDFSFALFSGGLSAPKLIAISNKVSFQNPKAPVYPRLAQGKSWNEMTVTWTSGYSIKEAIPFVEWGHKGGNQMLSPAGTLTFSRNSMCGSPARTVGWRDPGYIHTSFLKELWPDSLYTYRLGHRLLDGTHIWSKSYSFRASPYPGQDSVQRVVIFGDMGKAEIDGSDEYGNYEQASLYTTNQLIKELDSIDMVIHIGDLSYANGYLSQWDQFTQQIEPIASTVPYMIGSGNHERDWPGSGSFYGHNDSGGECGVPTQTMFYVPAENRAKLWYSTDYGMFRFCIADTEQDWRPGTEQYKFIEQCLSSVDRSKQPWLIFLAHRVLGYSSASWYEIMMGSYGEPMGRDGLEELWQKYKVDLAVFGHIHSYERTCPIYQNRCVQDGSNLYTGQFNATTHVIVGGGGAMLSPFRATVPYWSFFRDYDFGFSKLTALNHSTLLFEYKKSRDGKVYDHFTISRDYRDIMACSIDNCPRTTLAV,./data/raw/alphafold//AF-I4DHV7-F1-model_v4.pdb,978,4422,5882,3250 +216,954,981,MALTTTGTEQHDLFSGTFWQNPHPAYAALRAEDPVRKLALPDGPVWLLTRYADVREAFVDPRLSKDWRHTLPEDQRADMPATPTPMMILMDPPDHTRLRKLVGRSFTVRRMNELEPRITEIADGLLAGLPTDGPVDLMREYAFQIPVQVICELLGVPAEDRDDFSAWSSVLVDDSPADDKNAAMGKLHGYLSDLLERKRTEPDDALLSSLLAVSDEDGDRLSQEELVAMAMLLLIAGHETTVNLIGNGVLALLTHPDQRKLLAEDPSLISSAVEEFLRFDSPVSQAPIRFTAEDVTYSGVTIPAGEMVMLGLAAANRDADWMPEPDRLDITRDASGGVFFGHGIHFCLGAQLARLEGRVAIGRLFADRPELALAVGLDELVYRESTLVRGLSRMPVTMGPRSA,brenda,C4B644,C=C1CC[C@H](O)C/C1=C/C=C1\CCC[C@]2(C)[C@@H]([C@H](C)CCCC(C)C)CC[C@@H]12,0.0135,30.0,7.75,1.14.14.24,2074.0,-1.869666231504994,-1.869666231504994,C=C1CC[C@H](O)C/C1=C/C=C1\CCC[C@]2(C)[C@@H]([C@H](C)CCCC(C)C)CC[C@@H]12__MALTTTGTEQHDLFSGTFWQNPHPAYAALRAEDPVRKLALPDGPVWLLTRYADVREAFVDPRLSKDWRHTLPEDQRADMPATPTPMMILMDPPDHTRLRKLVGRSFTVRRMNELEPRITEIADGLLAGLPTDGPVDLMREYAFQIPVQVICELLGVPAEDRDDFSAWSSVLVDDSPADDKNAAMGKLHGYLSDLLERKRTEPDDALLSSLLAVSDEDGDRLSQEELVAMAMLLLIAGHETTVNLIGNGVLALLTHPDQRKLLAEDPSLISSAVEEFLRFDSPVSQAPIRFTAEDVTYSGVTIPAGEMVMLGLAAANRDADWMPEPDRLDITRDASGGVFFGHGIHFCLGAQLARLEGRVAIGRLFADRPELALAVGLDELVYRESTLVRGLSRMPVTMGPRSA,./data/raw/alphafold//AF-C4B644-F1-model_v4.pdb,677,544,634,762 +217,22439,22788,MGSWTKCQSCLAPGLLQNRAAIVTGGGTGIGKAIAKELLHLGCNVVIASRKFDRLRAAAEELKATLPPSNKAEVTPIQCNIRKEEEVNNLMKSTLALYGKIDFLVNNGGGQFWSSPEHISSKGWHAVIETNLTGTFYMCKAAYNSWMKEHGGAIVNIIILLNGQPFVAHSGAARGGVYNLTKSLALGWARSGIRINCVAPGTVYSQTAMDNYGDMGKTLFADAFQKIPAKRLGVPEEVSSLVCFLLSPAASFITGQLVNVDGGQSLYCQNHDIPDHDNWPEGVGDLSTVKKMKESFKQKAKL,sabio,Q9JIF5,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1,0.053,37.0,7.4,1.3.1.38,10141.0,-1.275724130399211,-1.3479702668912004,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1__MGSWTKCQSCLAPGLLQNRAAIVTGGGTGIGKAIAKELLHLGCNVVIASRKFDRLRAAAEELKATLPPSNKAEVTPIQCNIRKEEEVNNLMKSTLALYGKIDFLVNNGGGQFWSSPEHISSKGWHAVIETNLTGTFYMCKAAYNSWMKEHGGAIVNIIILLNGQPFVAHSGAARGGVYNLTKSLALGWARSGIRINCVAPGTVYSQTAMDNYGDMGKTLFADAFQKIPAKRLGVPEEVSSLVCFLLSPAASFITGQLVNVDGGQSLYCQNHDIPDHDNWPEGVGDLSTVKKMKESFKQKAKL,./data/raw/alphafold//AF-Q9JIF5-F1-model_v4.pdb,5497,3031,3755,4365 +218,26923,27386,MASAGGEDCESPAPEADRPHQRPFLIGVSGGTASGKSTVCEKIMELLGQNEVEQRQRKVVILSQDRFYKVLTAEQKAKALKGQYNFDHPDAFDNDLMHRTLKNIVEGKTVEVPTYDFVTHSRLPETTVVYPADVVLFEGILVFYSQEIRDMFHLRLFVDTDSDVRLSRRVLRDVRRGRDLEQILTQYTTFVKPAFEEFCLPTKKYADVIIPRGVDNMVAINLIVQHIQDILNGDICKWHRGGSNGRSYKRTFSEPGDHPGMLTSGKRSHLESSSRPH,sabio,Q9HA47,Nc1ncn(C2OC(CO)C(O)C2O)c(=O)n1,11.0,37.0,8.0,2.7.1.48,9606.0,1.0413926851582251,1.122756333907075,Nc1ncn(C2OC(CO)C(O)C2O)c(=O)n1__MASAGGEDCESPAPEADRPHQRPFLIGVSGGTASGKSTVCEKIMELLGQNEVEQRQRKVVILSQDRFYKVLTAEQKAKALKGQYNFDHPDAFDNDLMHRTLKNIVEGKTVEVPTYDFVTHSRLPETTVVYPADVVLFEGILVFYSQEIRDMFHLRLFVDTDSDVRLSRRVLRDVRRGRDLEQILTQYTTFVKPAFEEFCLPTKKYADVIIPRGVDNMVAINLIVQHIQDILNGDICKWHRGGSNGRSYKRTFSEPGDHPGMLTSGKRSHLESSSRPH,./data/raw/alphafold//AF-Q9HA47-F1-model_v4.pdb,2553,5400,6098,7437 +219,26898,27361,MTAFLWAQDRDGLIGKDGHLPWHLPDDLHYFRAQTVGKIMVVGRRTYESFPKRPLPERTNVVLTHQEDYQAQGAVVVHDVAAVFAYAKQHPDQELVIAGGAQIFTAFKDDVDTLLVTRLAGSFEGDTKMIPLNWDDFTKVSSRTVEDTNPALTHTYEVWQKKA,sabio,P00381,Nc1nc2ncc(CNc3ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1,0.029,25.0,7.5,1.5.1.3,1582.0,-1.537602002101044,-2.3797253758587003,Nc1nc2ncc(CNc3ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1__MTAFLWAQDRDGLIGKDGHLPWHLPDDLHYFRAQTVGKIMVVGRRTYESFPKRPLPERTNVVLTHQEDYQAQGAVVVHDVAAVFAYAKQHPDQELVIAGGAQIFTAFKDDVDTLLVTRLAGSFEGDTKMIPLNWDDFTKVSSRTVEDTNPALTHTYEVWQKKA,./data/raw/alphafold//AF-P00381-F1-model_v4.pdb,4600,5702,7374,8274 +220,25339,25743,MALLARTLIASAGHCWLRVARAFPSSAPPPARAARAFSRAMACKQEPQPPCPPLSAGAEISYDYLVIGGGSGGLASARRAAELGARAAVVERHKLGGTCVNVGCVPKKVMWNTAVHSEFMHDHVDYGFQSCESKFNWRIIKEKRDAYVSRLNTIYQNNLTKSHIDIIHGHAAFTCDPQPTVEVNGKKYTAPHILIATGGVPSVPQESQIPGASLGITSDGFFQLEELPRRSVIVGAGYIAVEIAGILSALGSKTSIMIRHDKVLRTFDSIISSNCTEELENAGIEVLKYSQVREVKKTSSGLELRMVTSIPGREPTFTTIADVDCLLWAIGRDPNSWGLNLNKLGIQTDDKGHIIVDEFQNTNVKGVYAVGDVCGKALLTPVAIAAGRKLAHRLFECKEDSKLDYDNIPTVVFSHPPIGTVGLTEDEAIYKYGKENVKTYSTTFTPMYHAVTKRKTKCVMKMVCANKEEKVVGIHMQGIGCDEMLQGFAVAVKMGATKSDFDNTVAIHPTSSEELVTLR,uniprot_search,E1BKZ1,N[C@@H](CCC(O)=N[C@@H](CSSC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=O)O)C(O)=NCC(=O)O)C(=O)O,0.154,37.0,7.4,1.8.1.7,9913.0,-0.8124792791635369,-1.098296139352519,N[C@@H](CCC(O)=N[C@@H](CSSC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=O)O)C(O)=NCC(=O)O)C(=O)O__MALLARTLIASAGHCWLRVARAFPSSAPPPARAARAFSRAMACKQEPQPPCPPLSAGAEISYDYLVIGGGSGGLASARRAAELGARAAVVERHKLGGTCVNVGCVPKKVMWNTAVHSEFMHDHVDYGFQSCESKFNWRIIKEKRDAYVSRLNTIYQNNLTKSHIDIIHGHAAFTCDPQPTVEVNGKKYTAPHILIATGGVPSVPQESQIPGASLGITSDGFFQLEELPRRSVIVGAGYIAVEIAGILSALGSKTSIMIRHDKVLRTFDSIISSNCTEELENAGIEVLKYSQVREVKKTSSGLELRMVTSIPGREPTFTTIADVDCLLWAIGRDPNSWGLNLNKLGIQTDDKGHIIVDEFQNTNVKGVYAVGDVCGKALLTPVAIAAGRKLAHRLFECKEDSKLDYDNIPTVVFSHPPIGTVGLTEDEAIYKYGKENVKTYSTTFTPMYHAVTKRKTKCVMKMVCANKEEKVVGIHMQGIGCDEMLQGFAVAVKMGATKSDFDNTVAIHPTSSEELVTLR,./data/raw/alphafold//AF-E1BKZ1-F1-model_v4.pdb,4118,5835,7555,6820 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+224,27462,27938,MSEGITDIEESQIQTNYDKVVYKFDDMELDENLLRGVFGYGFEEPSAIQQRAIMPIIEGHDVLAQAQSGTGKTGTFSIAALQRIDTSVKAPQALMLAPTRELALQIQKVVMALAFHMDIKVHACIGGTSFVEDAEGLRDAQIVVGTPGRVFDNIQRRRFRTDKIKMFILDEADEMLSSGFKEQIYQIFTLLPPTTQVVLLSATMPNDVLEVTTKFMRNPVRILVKKDELTLEGIKQFYVNVEEEEYKYECLTDLYDSISVTQAVIFCNTRRKVEELTTKLRNDKFTVSAIYSDLPQQERDTIMKEFRSGSSRILISTDLLARGIDVQQVSLVINYDLPANKENYIHRIGRGGRFGRKGVAINFVTNEDVGAMRELEKFYSTQIEELPSDIATLLN,sabio,P10081,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,0.47,37.0,7.5,3.6.1.-,4932.0,-0.3279021420642826,-0.3279021420642826,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MSEGITDIEESQIQTNYDKVVYKFDDMELDENLLRGVFGYGFEEPSAIQQRAIMPIIEGHDVLAQAQSGTGKTGTFSIAALQRIDTSVKAPQALMLAPTRELALQIQKVVMALAFHMDIKVHACIGGTSFVEDAEGLRDAQIVVGTPGRVFDNIQRRRFRTDKIKMFILDEADEMLSSGFKEQIYQIFTLLPPTTQVVLLSATMPNDVLEVTTKFMRNPVRILVKKDELTLEGIKQFYVNVEEEEYKYECLTDLYDSISVTQAVIFCNTRRKVEELTTKLRNDKFTVSAIYSDLPQQERDTIMKEFRSGSSRILISTDLLARGIDVQQVSLVINYDLPANKENYIHRIGRGGRFGRKGVAINFVTNEDVGAMRELEKFYSTQIEELPSDIATLLN,./data/raw/alphafold//AF-P10081-F1-model_v4.pdb,1359,6602,2865,8001 +225,30980,31534,MEIVAIDIGGTHARFSIAEVSNGRVLSLGEETTFKTAEHASLQLAWERFGEKLGRPLPRAAAIAWAGPVHGEVLKLTNNPWVLRPATLNEKLGIDTHVLINDFGAVAHAVAHMDASYLDHICGPDAPLPSDGVITILGPGTGLGVAHLLRTEGRYFVIETEGGHIDFAPLDRLEDKILARLRERFRRVSIERIISGPGLGNIYEALAAIEGVPFSLLDDIKLWQMALEGKDNLAEAALDRFCLSLGAIAGDLALAQGATSVVIGGGVGLRIASHLPESGFRQRFVSKGRFERVMSKIPVKLITYPQPGLLGAAAAYANKYSEVE,uniprot_search,A0A542VZV9,O=C(O)CCC(O)=Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.38,27.5,7.6,2.7.1.2,542.0,-0.4202164033831898,-0.4202164033831898,O=C(O)CCC(O)=Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MEIVAIDIGGTHARFSIAEVSNGRVLSLGEETTFKTAEHASLQLAWERFGEKLGRPLPRAAAIAWAGPVHGEVLKLTNNPWVLRPATLNEKLGIDTHVLINDFGAVAHAVAHMDASYLDHICGPDAPLPSDGVITILGPGTGLGVAHLLRTEGRYFVIETEGGHIDFAPLDRLEDKILARLRERFRRVSIERIISGPGLGNIYEALAAIEGVPFSLLDDIKLWQMALEGKDNLAEAALDRFCLSLGAIAGDLALAQGATSVVIGGGVGLRIASHLPESGFRQRFVSKGRFERVMSKIPVKLITYPQPGLLGAAAAYANKYSEVE,./data/raw/alphafold//AF-A0A542VZV9-F1-model_v4.pdb,4406,5426,6125,7466 +226,10760,10916,MRTADREARPGLPSLLLLLLAGAGLSAASPPAAPRFNVSLDSVPELRWLPVLRHYDLDLVRAAMAQVIGDRVPKWVHVLIGKVVLELERFLPQPFTGEIRGMCDFMNLSLADCLLVNLAYESSVFCTSIVAQDSRGHIYHGRNLDYPFGNVLRKLTVDVQFLKNGQIAFTGTTFIGYVGLWTGQSPHKFTVSGDERDKGWWWENAIAALFRRHIPVSWLIRATLSESENFEAAVGKLAKTPLIADVYYIVGGTSPREGVVITRNRDGPADIWPLDPLNGAWFRVETNYDHWKPAPKEDDRRTSAIKALNATGQANLSLEALFQILSVVPVYNNFTIYTTVMSAGSPDKYMTRIRNPSRK,brenda,Q02083,CCCCCCCCCCCCCCCC(O)=Nc1ccc2c(C)cc(=O)oc2c1,0.0062,37.0,4.5,3.5.1.60,9606.0,-2.207608310501746,-2.207608310501746,CCCCCCCCCCCCCCCC(O)=Nc1ccc2c(C)cc(=O)oc2c1__MRTADREARPGLPSLLLLLLAGAGLSAASPPAAPRFNVSLDSVPELRWLPVLRHYDLDLVRAAMAQVIGDRVPKWVHVLIGKVVLELERFLPQPFTGEIRGMCDFMNLSLADCLLVNLAYESSVFCTSIVAQDSRGHIYHGRNLDYPFGNVLRKLTVDVQFLKNGQIAFTGTTFIGYVGLWTGQSPHKFTVSGDERDKGWWWENAIAALFRRHIPVSWLIRATLSESENFEAAVGKLAKTPLIADVYYIVGGTSPREGVVITRNRDGPADIWPLDPLNGAWFRVETNYDHWKPAPKEDDRRTSAIKALNATGQANLSLEALFQILSVVPVYNNFTIYTTVMSAGSPDKYMTRIRNPSRK,./data/raw/alphafold//AF-Q02083-F1-model_v4.pdb,5376,3149,3888,4530 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+277,11752,11916,MVETLSANLARAAVTAQGAIAEAALRQADRPAALSPDPFHVAPALNEVMTRLAAQPDRLMRAQADLFGQYMELWQNAARRAAGEAVTPVVAPSAGDKRFNDPDWASNPMFDLMKQSYLLSSNWLNGLIAEVDGVDPATKRRVEFFTRMLTDAFSPSNFLISNPAALREVVQTQGQSLVRGMENFAADLERGGGQLAISQTDLAKFKVGENVATAPGKVVYQNDILQLLQFDPTTDTVCEIPLLIFPPWINKFYIMDLRPENSMIRWLTGQGFTVFVASWVNPDQTLAAKTFEDYMFEGIYDATQQVMTQCGVDRVNTVGYCIGGTLLSVALAHMAARGDKRINSATFFAAQQDFAEAGDLLLFTNEEWLQSIEQQMDQAGGFLPSQSMADTFNALRGNDLIWSFFVSNYLMGKEPRPFDLLFWNADQTRMPKALHLFYLRNFYKDNALTTGKLSLGGEHLDLSTVKTPIYVQSSKDDHIAPYRSVYRGAKAFGGPVTFTMAGSGHIAGVINHPDAKKYQHWTNDELPADVSQWIAGAQEQPGSWWPHWSAWLKSRSGEQVPARDPAKGKLKPLEDAPGSFVLVKSQP,brenda,A0A290N3S7,CC[C@@H](O)CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,2.07,30.0,7.8,2.3.1.304,155892.0,0.3159703454569177,0.3159703454569177,CC[C@@H](O)CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MVETLSANLARAAVTAQGAIAEAALRQADRPAALSPDPFHVAPALNEVMTRLAAQPDRLMRAQADLFGQYMELWQNAARRAAGEAVTPVVAPSAGDKRFNDPDWASNPMFDLMKQSYLLSSNWLNGLIAEVDGVDPATKRRVEFFTRMLTDAFSPSNFLISNPAALREVVQTQGQSLVRGMENFAADLERGGGQLAISQTDLAKFKVGENVATAPGKVVYQNDILQLLQFDPTTDTVCEIPLLIFPPWINKFYIMDLRPENSMIRWLTGQGFTVFVASWVNPDQTLAAKTFEDYMFEGIYDATQQVMTQCGVDRVNTVGYCIGGTLLSVALAHMAARGDKRINSATFFAAQQDFAEAGDLLLFTNEEWLQSIEQQMDQAGGFLPSQSMADTFNALRGNDLIWSFFVSNYLMGKEPRPFDLLFWNADQTRMPKALHLFYLRNFYKDNALTTGKLSLGGEHLDLSTVKTPIYVQSSKDDHIAPYRSVYRGAKAFGGPVTFTMAGSGHIAGVINHPDAKKYQHWTNDELPADVSQWIAGAQEQPGSWWPHWSAWLKSRSGEQVPARDPAKGKLKPLEDAPGSFVLVKSQP,./data/raw/alphafold//AF-A0A290N3S7-F1-model_v4.pdb,2993,198,218,242 +278,12787,12973,MTHLNIANRVDSFFIPCVTLFGPGCARETGARARSLGARKALIVTDAGLHKMGLSEVVAGHIREAGLQAVIFPGAEPNPTDVNVHDGVKLFEREECDFIVSLGGGSSHDCAKGIGLVTAGGGHIRDYEGIDKSTVPMTPLISINTTAGTAAEMTRFCIITNSSNHVKMAIVDWRCTPLIAIDDPSLMVAMPPALTAATGMDALTHAIEAYVSTAATPITDACAEKAIVLIAEWLPKAVANGDSMEARAAMCYAQYLAGMAFNNASLGYVHAMAHQLGGFYNLPHGVCNAILLPHVSEFNLIAAPERYARIAELLGENIGGLSAHDAAKAAVSAIRTLSTSIGIPAGLAGLGVKADDHEVMASNAQKDACMLTNPRKATLAQVMAIFAAAM,brenda,F8GNE5,CO,0.132,30.0,9.5,1.1.1.244,106590.0,-0.8794260687941501,-0.8794260687941501,CO__MTHLNIANRVDSFFIPCVTLFGPGCARETGARARSLGARKALIVTDAGLHKMGLSEVVAGHIREAGLQAVIFPGAEPNPTDVNVHDGVKLFEREECDFIVSLGGGSSHDCAKGIGLVTAGGGHIRDYEGIDKSTVPMTPLISINTTAGTAAEMTRFCIITNSSNHVKMAIVDWRCTPLIAIDDPSLMVAMPPALTAATGMDALTHAIEAYVSTAATPITDACAEKAIVLIAEWLPKAVANGDSMEARAAMCYAQYLAGMAFNNASLGYVHAMAHQLGGFYNLPHGVCNAILLPHVSEFNLIAAPERYARIAELLGENIGGLSAHDAAKAAVSAIRTLSTSIGIPAGLAGLGVKADDHEVMASNAQKDACMLTNPRKATLAQVMAIFAAAM,./data/raw/alphafold//AF-F8GNE5-F1-model_v4.pdb,283,3425,3948,4602 +279,9859,10010,MSGCGLFLRTTAAARACRGLVVSTANRRLLRTSPPVRAFAKELFLGKIKKKEVFPFPEVSQDELNEINQFLGPVEKFFTEEVDSRKIDQEGKIPDETLEKLKSLGLFGLQVPEEYGGLGFSNTMYSRLGEIISMDGSITVTLAAHQAIGLKGIILAGTEEQKAKYLPKLASGEHIAAFCLTEPASGSDAASIRSRATLSEDKKHYILNGSKVWITNGGLANIFTVFAKTEVVDSDGSVKDKITAFIVERDFGGVTNGKPEDKLGIRGSNTCEVHFENTKIPVENILGEVGDGFKVAMNILNSGRFSMGSVVAGLLKRLIEMTAEYACTRKQFNKRLSEFGLIQEKFALMAQKAYVMESMTYLTAGMLDQPGFPDCSIEAAMVKVFSSEAAWQCVSEALQILGGLGYTRDYPYERILRDTRILLIFEGTNEILRMYIALTGLQHAGRILTTRIHELKQAKVSTVMDTVGRRLRDSLGRTVDLGLTGNHGVVHPSLADSANKFEENTYCFGRTVETLLLRFGKTIMEEQLVLKRVANILINLYGMTAVLSRASRSIRIGLRNHDHEVLLANTFCVEAYLQNLFSLSQLDKYAPENLDEQIKKVSQQILEKRAYICAHPLDRTC,sabio,Q9H845,CCCCCC=CCC=CCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O,0.0021,32.0,,1.3.99.-,9606.0,-2.677780705266081,-2.677780705266081,CCCCCC=CCC=CCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O__MSGCGLFLRTTAAARACRGLVVSTANRRLLRTSPPVRAFAKELFLGKIKKKEVFPFPEVSQDELNEINQFLGPVEKFFTEEVDSRKIDQEGKIPDETLEKLKSLGLFGLQVPEEYGGLGFSNTMYSRLGEIISMDGSITVTLAAHQAIGLKGIILAGTEEQKAKYLPKLASGEHIAAFCLTEPASGSDAASIRSRATLSEDKKHYILNGSKVWITNGGLANIFTVFAKTEVVDSDGSVKDKITAFIVERDFGGVTNGKPEDKLGIRGSNTCEVHFENTKIPVENILGEVGDGFKVAMNILNSGRFSMGSVVAGLLKRLIEMTAEYACTRKQFNKRLSEFGLIQEKFALMAQKAYVMESMTYLTAGMLDQPGFPDCSIEAAMVKVFSSEAAWQCVSEALQILGGLGYTRDYPYERILRDTRILLIFEGTNEILRMYIALTGLQHAGRILTTRIHELKQAKVSTVMDTVGRRLRDSLGRTVDLGLTGNHGVVHPSLADSANKFEENTYCFGRTVETLLLRFGKTIMEEQLVLKRVANILINLYGMTAVLSRASRSIRIGLRNHDHEVLLANTFCVEAYLQNLFSLSQLDKYAPENLDEQIKKVSQQILEKRAYICAHPLDRTC,./data/raw/alphafold//AF-Q9H845-F1-model_v4.pdb,5484,3016,3737,4345 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+285,31140,31696,MAGRARSGLLLLLLGLLALQSSCLAFRSPLSVFKRFKETTRSFSNECLGTIGPVTPLDASDFALDIRMPGVTPKESDTYFCMSMRLPVDEEAFVIDFKPRASMDTVHHMLLFGCNMPSSTGSYWFCDEGTCTDKANILYAWARNAPPTRLPKGVGFRVGGETGSKYFVLQVHYGDISAFRDNHKDCSGVSVHLTRVPQPLIAGMYLMMSVDTVIPPGEKVVNADISCQYKMYPMHVFAYRVHTHHLGKVVSGYRVRNGQWTLIGRQNPQLPQAFYPVEHPVDVTFGDILAARCVFTGEGRTEATHIGGTSSDEMCNLYIMYYMEAKYALSFMTCTKNVAPDMFRTIPAEANIPIPVKPDMVMMHGHHKEAENKEKSALMQQPKQGEEEVLEQGDFYSLLSKLLGEREDVHVHKYNPTEKTESGSDLVAEIANVVQKKDLGRSDAREGAEHEEWGNAILVRDRIHRFHQLESTLRPAESRAFSFQQPGEGPWEPEPSGDFHVEEELDWPGVYLLPGQVSGVALDSKNNLVIFHRGDHVWDGNSFDSKFVYQQRGLGPIEEDTILVIDPNNAEILQSSGKNLFYLPHGLSIDTDGNYWVTDVALHQVFKLDPHSKEGPLLILGRSMQPGSDQNHFCQPTDVAVEPSTGAVFVSDGYCNSRIVQFSPSGKFVTQWGEESSGSSPRPGQFSVPHSLALVPHLDQLCVADRENGRIQCFKTDTKEFVREIKHASFGRNVFAISYIPGFLFAVNGKPYFGDQEPVQGFVMNFSSGEIIDVFKPVRKHFDMPHDIVASEDGTVYIGDAHTNTVWKFTLTEKMEHRSVKKAGIEVQEIKEAEAVVEPKVENKPTSSELQKMQEKQKLSTEPGSGVSVVLITTLLVIPVLVLLAIVMFIRWKKSRAFGDHDRKLESSSGRVLGRFRGKGSGGLNLGNFFASRKGYSRKGFDRVSTEGSDQEKDEDDGTESEEEYSAPLPKPAPSS,brenda,P14925,O=C(O)CN=C(O)C1CC1c1ccccc1,0.9,37.0,6.0,1.14.17.3,10116.0,-0.0457574905606751,-0.0457574905606751,O=C(O)CN=C(O)C1CC1c1ccccc1__MAGRARSGLLLLLLGLLALQSSCLAFRSPLSVFKRFKETTRSFSNECLGTIGPVTPLDASDFALDIRMPGVTPKESDTYFCMSMRLPVDEEAFVIDFKPRASMDTVHHMLLFGCNMPSSTGSYWFCDEGTCTDKANILYAWARNAPPTRLPKGVGFRVGGETGSKYFVLQVHYGDISAFRDNHKDCSGVSVHLTRVPQPLIAGMYLMMSVDTVIPPGEKVVNADISCQYKMYPMHVFAYRVHTHHLGKVVSGYRVRNGQWTLIGRQNPQLPQAFYPVEHPVDVTFGDILAARCVFTGEGRTEATHIGGTSSDEMCNLYIMYYMEAKYALSFMTCTKNVAPDMFRTIPAEANIPIPVKPDMVMMHGHHKEAENKEKSALMQQPKQGEEEVLEQGDFYSLLSKLLGEREDVHVHKYNPTEKTESGSDLVAEIANVVQKKDLGRSDAREGAEHEEWGNAILVRDRIHRFHQLESTLRPAESRAFSFQQPGEGPWEPEPSGDFHVEEELDWPGVYLLPGQVSGVALDSKNNLVIFHRGDHVWDGNSFDSKFVYQQRGLGPIEEDTILVIDPNNAEILQSSGKNLFYLPHGLSIDTDGNYWVTDVALHQVFKLDPHSKEGPLLILGRSMQPGSDQNHFCQPTDVAVEPSTGAVFVSDGYCNSRIVQFSPSGKFVTQWGEESSGSSPRPGQFSVPHSLALVPHLDQLCVADRENGRIQCFKTDTKEFVREIKHASFGRNVFAISYIPGFLFAVNGKPYFGDQEPVQGFVMNFSSGEIIDVFKPVRKHFDMPHDIVASEDGTVYIGDAHTNTVWKFTLTEKMEHRSVKKAGIEVQEIKEAEAVVEPKVENKPTSSELQKMQEKQKLSTEPGSGVSVVLITTLLVIPVLVLLAIVMFIRWKKSRAFGDHDRKLESSSGRVLGRFRGKGSGGLNLGNFFASRKGYSRKGFDRVSTEGSDQEKDEDDGTESEEEYSAPLPKPAPSS,./data/raw/alphafold//AF-P14925-F1-model_v4.pdb,3776,2118,1397,2214 +286,27064,27528,MANLERTFIAIKPDGVQRGLVGEIIKRFEQKGFRLVAMKFLRASEEHLKQHYIDLKDRPFFPGLVKYMNSGPVVAMVWEGLNVVKTGRVMLGETNPADSKPGTIRGDFCIQVGRNIIHGSDSVESAEKEIGLWFKPEELIDYKSCAHDWVYE,sabio,P19804,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,0.073,37.0,7.4,2.7.4.6,10116.0,-1.136677139879544,-1.1585666021688377,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O__MANLERTFIAIKPDGVQRGLVGEIIKRFEQKGFRLVAMKFLRASEEHLKQHYIDLKDRPFFPGLVKYMNSGPVVAMVWEGLNVVKTGRVMLGETNPADSKPGTIRGDFCIQVGRNIIHGSDSVESAEKEIGLWFKPEELIDYKSCAHDWVYE,./data/raw/alphafold//AF-P19804-F1-model_v4.pdb,1214,6408,8270,10272 +287,17073,17321,MNLISLFSGAGGLDLGFQKAGFRIICANEYDKSIWKTYESNHSAKLIKGDISKISSDEFPKCDGIIGGPPCQSWSEGGSLRGIDDPRGKLFYEYIRILKQKKPIFFLAENVKGMMAQRHNKAVQEFIQEFDNAGYDVHIILLNANDYGVAQDRKRVFYIGFRKELNINYLPPIPHLIKPTFKDVIWDLKDNPIPALDKNKTNGNKCIYPNHEYFIGSYSTIFMSRNRVRQWNEPAFTVQASGRQCQLHPQAPVMLKVSKNLNKFVEGKEHLYRRLTVRECARVQGFPDDFIFHYESLNDGYKMIGNAVPVNLAYEIAKTIKSALEICKGN,brenda,P20589,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,0.00028,37.0,8.5,2.1.1.37,197575.0,-3.552841968657781,-3.552841968657781,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MNLISLFSGAGGLDLGFQKAGFRIICANEYDKSIWKTYESNHSAKLIKGDISKISSDEFPKCDGIIGGPPCQSWSEGGSLRGIDDPRGKLFYEYIRILKQKKPIFFLAENVKGMMAQRHNKAVQEFIQEFDNAGYDVHIILLNANDYGVAQDRKRVFYIGFRKELNINYLPPIPHLIKPTFKDVIWDLKDNPIPALDKNKTNGNKCIYPNHEYFIGSYSTIFMSRNRVRQWNEPAFTVQASGRQCQLHPQAPVMLKVSKNLNKFVEGKEHLYRRLTVRECARVQGFPDDFIFHYESLNDGYKMIGNAVPVNLAYEIAKTIKSALEICKGN,./data/raw/alphafold//AF-P20589-F1-model_v4.pdb,772,4147,5569,5959 +288,10932,11088,MTVLIQGAGIAGLALAREFTKAGIDWLLVERASEIRPIGTGITLASNALTALSSTLDLDRLFRRGMPLAGINVYAHDGSMLMSMPSSLGGNSRGGLALQRHELHAALLEGLDESRIRVGVSIVQILDGLDHERVTLSDGTVHDCSLVVGADGIRSSVRRYVWPEATLRHSGETCWRLVVPHRLEDAELAGEVWGHGKRLGFIQISPREMYVYATLKVRREEPEDEEGFVTPQRLAAHYADFDGIGASIARLIPSATTLVHNDLEELAGASWCRGRVVLIGDAAHAMTPNLGQGAAMALEDAFLLARLWCLAPRAETLILFQQQREARIEFIRKQSWIVGRLGQWESPWSVWLRNTLVRLVPNASRRRLHQRLFTGVGEMAAQ,brenda,Q9I0Q0,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1,0.00013,25.0,8.0,1.14.13.182,287.0,-3.886056647693164,-3.886056647693164,CCCCCCCCCc1cc(=O)c2ccccc2[nH]1__MTVLIQGAGIAGLALAREFTKAGIDWLLVERASEIRPIGTGITLASNALTALSSTLDLDRLFRRGMPLAGINVYAHDGSMLMSMPSSLGGNSRGGLALQRHELHAALLEGLDESRIRVGVSIVQILDGLDHERVTLSDGTVHDCSLVVGADGIRSSVRRYVWPEATLRHSGETCWRLVVPHRLEDAELAGEVWGHGKRLGFIQISPREMYVYATLKVRREEPEDEEGFVTPQRLAAHYADFDGIGASIARLIPSATTLVHNDLEELAGASWCRGRVVLIGDAAHAMTPNLGQGAAMALEDAFLLARLWCLAPRAETLILFQQQREARIEFIRKQSWIVGRLGQWESPWSVWLRNTLVRLVPNASRRRLHQRLFTGVGEMAAQ,./data/raw/alphafold//AF-Q9I0Q0-F1-model_v4.pdb,5402,3180,3921,4565 +289,22401,22749,MDLGLAGRRALVTGAGKGIGRSTVLALKAAGAQVVAVSRTREDLDDLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVALLQPFLEVTKEACDTSFNVNLRAVIQVSQIVAKGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKMMALELGPHKIRVNAVNPTVVMTPMGRTNWSDPHKAKAMLDRIPLGKFAEVENVVDTILFLLSNRSGMTTGSTLPVDGGFLAT,sabio,Q91X52,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1,0.005,25.0,7.0,1.1.1.10,10090.0,-2.3010299956639813,-2.3010299956639813,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1__MDLGLAGRRALVTGAGKGIGRSTVLALKAAGAQVVAVSRTREDLDDLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVALLQPFLEVTKEACDTSFNVNLRAVIQVSQIVAKGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKMMALELGPHKIRVNAVNPTVVMTPMGRTNWSDPHKAKAMLDRIPLGKFAEVENVVDTILFLLSNRSGMTTGSTLPVDGGFLAT,./data/raw/alphafold//AF-Q91X52-F1-model_v4.pdb,3403,841,1006,1234 +290,6755,6886,MKNRRLNFKLFFLIIFSLFSTLSWSKTITLYLDPASLPALNQLMDFTQNNEDKTHPRIFGLSRFKIPDNIITQYQNIHFVELKDNRPTEALFTILDQYPGNIELNIHLNIAHSVQLIRPILAYRFKHLDRVSIQQLNLYDDGSMEYVDLEKEENKDISAEIKQAEKQLSHYLLTGKIKFDNPTIARYVWQSAFPVKYHFLSTDYFEKAEFLQPLKEYLAENYQKMDWTAYQQLTPEQQAFYLTLVGFNDEVKQSLEVQQAKFIFTGTTTWEGNTDVREYYAQQQLNLLNHFTQAEGDLFIGDHYKIYFKGHPRGGEINDYILNNAKNITNIPANISFEVLMMTGLLPDKVGGVASSLYFSLPKEKISHIIFTSNKQVKSKEDALNNPYVKVMRRLGIIDESQVIFWDSLKQL,brenda,Q15KI8,CC(O)=N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=N)nc3O)[C@H](O)[C@@H]2O)(C(=O)O)C[C@@H]1O,1.5,37.0,8.5,2.4.99.6,747.0,0.1760912590556812,-0.1964638191438773,CC(O)=N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=N)nc3O)[C@H](O)[C@@H]2O)(C(=O)O)C[C@@H]1O__MKNRRLNFKLFFLIIFSLFSTLSWSKTITLYLDPASLPALNQLMDFTQNNEDKTHPRIFGLSRFKIPDNIITQYQNIHFVELKDNRPTEALFTILDQYPGNIELNIHLNIAHSVQLIRPILAYRFKHLDRVSIQQLNLYDDGSMEYVDLEKEENKDISAEIKQAEKQLSHYLLTGKIKFDNPTIARYVWQSAFPVKYHFLSTDYFEKAEFLQPLKEYLAENYQKMDWTAYQQLTPEQQAFYLTLVGFNDEVKQSLEVQQAKFIFTGTTTWEGNTDVREYYAQQQLNLLNHFTQAEGDLFIGDHYKIYFKGHPRGGEINDYILNNAKNITNIPANISFEVLMMTGLLPDKVGGVASSLYFSLPKEKISHIIFTSNKQVKSKEDALNNPYVKVMRRLGIIDESQVIFWDSLKQL,./data/raw/alphafold//AF-Q15KI8-F1-model_v4.pdb,5780,2580,3226,3715 +291,33515,34109,MSSISDTVKRAREAFNSGKTRSLQFRIQQLEALQRMINENLKSISGALASDLGKNEWTSYYEEVAHVLEELDTTIKELPDWAEDEPVAKTRQTQQDDLYIHSEPLGVVLVIGAWNYPFNLTIQPMVGAVAAGNAVILKPSEVSGHMADLLATLIPQYMDQNLYLVVKGGVPETTELLKERFDHIMYTGSTAVGKIVMAAAAKHLTPVTLELGGKSPCYVDKDCDLDVACRRIAWGKFMNSGQTCVAPDYILCDPSIQNQIVEKLKKSLKDFYGEDAKQSRDYGRIINDRHFQRVKGLIDNQKVAHGGTWDQSSRYIAPTILVDVDPQSPVMQEEIFGPVMPIVCVRSLEEAIQFINQREKPLALYVFSNNEKVIKKMIAETSSGGVTANDVIVHITVPTLPFGGVGNSGMGAYHGKKSFETFSHRRSCLVKSLLNEEAHKARYPPSPAKMPRH,sabio,P11883,O=CCc1c[nH]c2ccccc12,0.147,25.0,9.6,1.2.1.5,10116.0,-0.8326826652518239,-0.8326826652518239,O=CCc1c[nH]c2ccccc12__MSSISDTVKRAREAFNSGKTRSLQFRIQQLEALQRMINENLKSISGALASDLGKNEWTSYYEEVAHVLEELDTTIKELPDWAEDEPVAKTRQTQQDDLYIHSEPLGVVLVIGAWNYPFNLTIQPMVGAVAAGNAVILKPSEVSGHMADLLATLIPQYMDQNLYLVVKGGVPETTELLKERFDHIMYTGSTAVGKIVMAAAAKHLTPVTLELGGKSPCYVDKDCDLDVACRRIAWGKFMNSGQTCVAPDYILCDPSIQNQIVEKLKKSLKDFYGEDAKQSRDYGRIINDRHFQRVKGLIDNQKVAHGGTWDQSSRYIAPTILVDVDPQSPVMQEEIFGPVMPIVCVRSLEEAIQFINQREKPLALYVFSNNEKVIKKMIAETSSGGVTANDVIVHITVPTLPFGGVGNSGMGAYHGKKSFETFSHRRSCLVKSLLNEEAHKARYPPSPAKMPRH,./data/raw/alphafold//AF-P11883-F1-model_v4.pdb,3753,1447,2239,2165 +292,1694,1731,MWELVALLLLTLAYLFWPKRRCPGAKYPKSLLSLPLVGSLPFLPRHGHMHNNFFKLQKKYGPIYSVRMGTKTTVIVGHHQLAKEVLIKKGKDFSGRPQMATLDIASNNRKGIAFADSGAHWQLHRRLAMATFALFKDGDQKLEKIICQEISTLCDMLATHNGQSIDISFPVFVAVTNVISLICFNTSYKNGDPELNVIQNYNEGIIDNLSKDSLVDLVPWLKIFPNKTLEKLKSHVKIRNDLLNKILENYKEKFRSDSITNMLDTLMQAKMNSDNGNAGPDQDSELLSDNHILTTIGDIFGAGVETTTSVVKWTLAFLLHNPQVKKKLYEEIDQNVGFSRTPTISDRNRLLLLEATIREVLRLRPVAPMLIPHKANVDSSIGEFAVDKGTEVIINLWALHHNEKEWHQPDQFMPERFLNPAGTQLISPSVSYLPFGAGPRSCIGEILARQELFLIMAWLLQRFDLEVPDDGQLPSLEGIPKVVFLIDSFKVKIKVRQAWREAQAEGST,sabio,P05093,CC(=O)C1(O)CCC2C3CCC4=CC(=O)CCC4(C)C3CCC21C,0.000441,22.0,7.4,1.14.14.19,9606.0,-3.3555614105321614,-3.333603289793888,CC(=O)C1(O)CCC2C3CCC4=CC(=O)CCC4(C)C3CCC21C__MWELVALLLLTLAYLFWPKRRCPGAKYPKSLLSLPLVGSLPFLPRHGHMHNNFFKLQKKYGPIYSVRMGTKTTVIVGHHQLAKEVLIKKGKDFSGRPQMATLDIASNNRKGIAFADSGAHWQLHRRLAMATFALFKDGDQKLEKIICQEISTLCDMLATHNGQSIDISFPVFVAVTNVISLICFNTSYKNGDPELNVIQNYNEGIIDNLSKDSLVDLVPWLKIFPNKTLEKLKSHVKIRNDLLNKILENYKEKFRSDSITNMLDTLMQAKMNSDNGNAGPDQDSELLSDNHILTTIGDIFGAGVETTTSVVKWTLAFLLHNPQVKKKLYEEIDQNVGFSRTPTISDRNRLLLLEATIREVLRLRPVAPMLIPHKANVDSSIGEFAVDKGTEVIINLWALHHNEKEWHQPDQFMPERFLNPAGTQLISPSVSYLPFGAGPRSCIGEILARQELFLIMAWLLQRFDLEVPDDGQLPSLEGIPKVVFLIDSFKVKIKVRQAWREAQAEGST,./data/raw/alphafold//AF-P05093-F1-model_v4.pdb,3741,1423,1047,1285 +293,6333,6432,MSSLPGSREPLLRVAVTGGTHGNEMCGVYLARYWLQNPGELQRPSFSAMPVLANPAATAACCRYLDRDLNRSCTLTFLGSTATPDDPYEVKRARELNQLLGPKGTGQAFDFTLDLHNTTANTGVCLISESNISFNLHLCHYLQRQNPGMPCRLFLYEPAGTETFSVESISKNGICLEMGPQPQGVLRADLFSRMRALVASILDFIELFNQGMDLPAFEMDIYRNLGSVDFPRTADGDLAGTVHPQLQDHDFEPLRPGEPIFKLFSGEDVLYEGDSIVYPVFINEAAYYEKHVAFLKSEKIRVTVPALLRLTPRSTQTP,brenda,Q91XE4,CC(O)=N[C@@H](Cc1cnc[nH]1)C(=O)O,1.8,37.0,7.5,3.5.1.114,10090.0,0.255272505103306,0.255272505103306,CC(O)=N[C@@H](Cc1cnc[nH]1)C(=O)O__MSSLPGSREPLLRVAVTGGTHGNEMCGVYLARYWLQNPGELQRPSFSAMPVLANPAATAACCRYLDRDLNRSCTLTFLGSTATPDDPYEVKRARELNQLLGPKGTGQAFDFTLDLHNTTANTGVCLISESNISFNLHLCHYLQRQNPGMPCRLFLYEPAGTETFSVESISKNGICLEMGPQPQGVLRADLFSRMRALVASILDFIELFNQGMDLPAFEMDIYRNLGSVDFPRTADGDLAGTVHPQLQDHDFEPLRPGEPIFKLFSGEDVLYEGDSIVYPVFINEAAYYEKHVAFLKSEKIRVTVPALLRLTPRSTQTP,./data/raw/alphafold//AF-Q91XE4-F1-model_v4.pdb,5626,2358,2980,3445 +294,21341,21664,METYDIAIIGTGSGNSILDERYASKRAAICEQGTFGGTCLNVGCIPTKMFVYAAEVAKTIRGASRYGIDAHIDRVRWDDVVSRVFGRIDPIALSGEDYRRCAPNIDVYRTHTRFGPVQADGRYLLRTDAGEEFTAEQVVIAAGSRPVIPPAILASGVDYHTSDTVMRIAELPEHIVIVGSGFIAAEFAHVFSALGVRVTLVIRGSCLLRHCDDTICERFTRIASTKWELRTHRNVVDGQQRGSGVALRLDDGCTINADLLLVATGRVSNADLLDAEQAGVDVEDGRVIVDEYQRTSARGVFALGDVSSPYLLKHVANHEARVVQHNLLCDWEDTQSMIVTDHRYVPAAVFTDPQIAAVGLTENQAVAKGLDISVKIQDYGDVAYGWAMEDTSGIVKLITERGSGRLLGAHIMGYQASSLIQPLIQAMSFGLTAAEMARGQYWIHPALPEVVENALLGLR,brenda,P9WHH3,N=C([O-])C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(O)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.2,30.0,7.6,1.8.1.15,1773.0,-0.6989700043360187,-0.6989700043360187,N=C([O-])C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(O)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__METYDIAIIGTGSGNSILDERYASKRAAICEQGTFGGTCLNVGCIPTKMFVYAAEVAKTIRGASRYGIDAHIDRVRWDDVVSRVFGRIDPIALSGEDYRRCAPNIDVYRTHTRFGPVQADGRYLLRTDAGEEFTAEQVVIAAGSRPVIPPAILASGVDYHTSDTVMRIAELPEHIVIVGSGFIAAEFAHVFSALGVRVTLVIRGSCLLRHCDDTICERFTRIASTKWELRTHRNVVDGQQRGSGVALRLDDGCTINADLLLVATGRVSNADLLDAEQAGVDVEDGRVIVDEYQRTSARGVFALGDVSSPYLLKHVANHEARVVQHNLLCDWEDTQSMIVTDHRYVPAAVFTDPQIAAVGLTENQAVAKGLDISVKIQDYGDVAYGWAMEDTSGIVKLITERGSGRLLGAHIMGYQASSLIQPLIQAMSFGLTAAEMARGQYWIHPALPEVVENALLGLR,./data/raw/alphafold//AF-P9WHH3-F1-model_v4.pdb,5644,2429,3057,3532 +295,36903,37552,MNPGAARTPALRILALGALLWPAARPWELTILHTNDVHSRLEQTSEDSSKCVNASRCVGGVARLATKVHQIRRAEPHVLLLDAGDQYQGTIWFTVYKGTEVAHFMNALGYDAMALGNHEFDNGVEGLIDPLLKEVNFPILSANIKAKGPLASKISGLYSPYKILTVGDEVVGIVGYTSKETPFLSNPGTNLVFEDEITALQPEVDKLKTLNVNKIIALGHSGFEVDKLIAQKVKGVDVVVGGHSNTFLYTGNPPSKEVPAGQYPFIVTSDDGRKVPVVQAYAFGKYLGYLKVEFDEKGNVVTSHGNPILLNSSIPEDPNIKADINKWRVKLDNYSTQELGKTIVYLDGTAQSCRFRECNMGNLICDAMINNNLRHPDEMSWNHVSMCILNGGGIRSPIDERNNGTITWENLAAVLPFGGTFDLVQLKGSTLKKAFEHSVHRYGQATGEFLQVGGIHVVYDISRNPGDRVVKLEVLCTQCRVPSYEPLRMDKVYKVILPSFLVSGGDGFQMIKDEKIKHDSGDQDINVVSGYISKMKVLYPAVEGRIQFSAGSHCCGSFSLIFLSVLAVIIILYQ,sabio,Q05927,O=c1ccn(C2OC(COP(=O)(O)O)C(O)C2O)c(=O)[nH]1,0.0917999999999999,37.0,7.4,3.1.3.5,9913.0,-1.0371573187987582,-1.0825005230252327,O=c1ccn(C2OC(COP(=O)(O)O)C(O)C2O)c(=O)[nH]1__MNPGAARTPALRILALGALLWPAARPWELTILHTNDVHSRLEQTSEDSSKCVNASRCVGGVARLATKVHQIRRAEPHVLLLDAGDQYQGTIWFTVYKGTEVAHFMNALGYDAMALGNHEFDNGVEGLIDPLLKEVNFPILSANIKAKGPLASKISGLYSPYKILTVGDEVVGIVGYTSKETPFLSNPGTNLVFEDEITALQPEVDKLKTLNVNKIIALGHSGFEVDKLIAQKVKGVDVVVGGHSNTFLYTGNPPSKEVPAGQYPFIVTSDDGRKVPVVQAYAFGKYLGYLKVEFDEKGNVVTSHGNPILLNSSIPEDPNIKADINKWRVKLDNYSTQELGKTIVYLDGTAQSCRFRECNMGNLICDAMINNNLRHPDEMSWNHVSMCILNGGGIRSPIDERNNGTITWENLAAVLPFGGTFDLVQLKGSTLKKAFEHSVHRYGQATGEFLQVGGIHVVYDISRNPGDRVVKLEVLCTQCRVPSYEPLRMDKVYKVILPSFLVSGGDGFQMIKDEKIKHDSGDQDINVVSGYISKMKVLYPAVEGRIQFSAGSHCCGSFSLIFLSVLAVIIILYQ,./data/raw/alphafold//AF-Q05927-F1-model_v4.pdb,1213,6407,8269,10271 +296,34914,35526,MASAIKAASTSSRWSSSPAAVHSSPLSKRLPAAVAMPGRRRSVATVRAVAAVAPAAPAAPAKLTAGAGGRCLPVSQTMSRLRAQGKTAFIPYITAGDPDLATTAEALRLLDACGADVIELGVPFSDPYADGPVIQASAARALASGTTPDGVLAMLKEVTPELSCPVVLFSYFNPIVRWGLADFAAAVKEAGVHGLIVPDLPYGNSCALTLRTEAIKNSLELVLLTTPSTPADRMEEITRASRGFVYLATVNGVTGPRANVNTRVQSLIQEVKQVTDIPVAVGFGISKPEHVKQIAEWGADGVIIGSAMVRQLGEAASPKEGLKRLEKYARSMKNALPCQ,brenda,Q9FQ77,O=P(O)(O)OC[C@@H](O)[C@@H](O)c1c[nH]c2ccccc12,0.1,30.0,8.2,4.1.2.8,4577.0,-1.0,-1.0,O=P(O)(O)OC[C@@H](O)[C@@H](O)c1c[nH]c2ccccc12__MASAIKAASTSSRWSSSPAAVHSSPLSKRLPAAVAMPGRRRSVATVRAVAAVAPAAPAAPAKLTAGAGGRCLPVSQTMSRLRAQGKTAFIPYITAGDPDLATTAEALRLLDACGADVIELGVPFSDPYADGPVIQASAARALASGTTPDGVLAMLKEVTPELSCPVVLFSYFNPIVRWGLADFAAAVKEAGVHGLIVPDLPYGNSCALTLRTEAIKNSLELVLLTTPSTPADRMEEITRASRGFVYLATVNGVTGPRANVNTRVQSLIQEVKQVTDIPVAVGFGISKPEHVKQIAEWGADGVIIGSAMVRQLGEAASPKEGLKRLEKYARSMKNALPCQ,./data/raw/alphafold//AF-Q9FQ77-F1-model_v4.pdb,2236,7747,9538,10676 +297,30725,31271,MSLSPFEHPFLSGLFGDSEIIELFSAKADIDAMIRFETALAQAEAEASIFADDEAEAIVSGLSEFAADMSALRHGVAKDGVVVPELIRQMRAAVAGQGADKVHFGATSQDVIDTSLMLRLKMAAEIIATRLGHLIDTLGDLASRDGHKPLTGYTRMQAAIGITVADRAAGWIAPLERHLLRLETFAQNGFALQFGGAAGTLEKLGDNAGAVRADLAKRLGLADRPQWHNQRDGIPEFANLLSLVTGTLGKFGQDIALMAEIGSEIRLSGGGGSSAMPHKQNPVNAETLVTLARFNAVQISALHQSLVQEQERSGAGWMLEWLTLPQMVTATGTSLLVAERLAAQIDRLGADES,brenda,Q2HNZ1,O=C(O)CC1(C(=O)O)C=CC(=O)O1,0.32,30.0,8.0,5.5.1.2,358.0,-0.494850021680094,-0.494850021680094,O=C(O)CC1(C(=O)O)C=CC(=O)O1__MSLSPFEHPFLSGLFGDSEIIELFSAKADIDAMIRFETALAQAEAEASIFADDEAEAIVSGLSEFAADMSALRHGVAKDGVVVPELIRQMRAAVAGQGADKVHFGATSQDVIDTSLMLRLKMAAEIIATRLGHLIDTLGDLASRDGHKPLTGYTRMQAAIGITVADRAAGWIAPLERHLLRLETFAQNGFALQFGGAAGTLEKLGDNAGAVRADLAKRLGLADRPQWHNQRDGIPEFANLLSLVTGTLGKFGQDIALMAEIGSEIRLSGGGGSSAMPHKQNPVNAETLVTLARFNAVQISALHQSLVQEQERSGAGWMLEWLTLPQMVTATGTSLLVAERLAAQIDRLGADES,./data/raw/alphafold//AF-Q2HNZ1-F1-model_v4.pdb,1699,7081,8955,9219 +298,35385,36004,MLGIVLAGGEGKRLMPLTADRAKPAVTFGGTYRLVDFVLSNLVNGDILRICVLTQYKSHSLDRHITTTWRMSSLLGNYVTPVPAQQRLGPRWFLGSADAILQSLNLVHDEQPEYVAVFGADHVYRMDPRQMLAQHIESGAGVTVAGIRVPRAESPSFGVITPGSDGQTVTGFLEKPADPPGLADDPGCVFASMGNYVFTTKALVEALHRDAEDPDSVHDMGGSILPQLTDRGEAALYDFSANHVPGETTRDQGYWRDVGTLDAYYDAHMDLIAERPAFNLYNRDWPVYTHSTQLSPARFNAGGIASESIISAGCLIRGQVTRSVLSPGVVVDPGAVVQGSVLHDNVHIGRGAVVRGAVLDKNVQVPPGATIGVNPQRDGELYTVSKGGVIALGKGQRVP,brenda,P72394,O=P(O)(O)OP(=O)(O)O,0.35,37.0,8.0,2.7.7.27,1902.0,-0.4559319556497244,-0.4559319556497244,O=P(O)(O)OP(=O)(O)O__MLGIVLAGGEGKRLMPLTADRAKPAVTFGGTYRLVDFVLSNLVNGDILRICVLTQYKSHSLDRHITTTWRMSSLLGNYVTPVPAQQRLGPRWFLGSADAILQSLNLVHDEQPEYVAVFGADHVYRMDPRQMLAQHIESGAGVTVAGIRVPRAESPSFGVITPGSDGQTVTGFLEKPADPPGLADDPGCVFASMGNYVFTTKALVEALHRDAEDPDSVHDMGGSILPQLTDRGEAALYDFSANHVPGETTRDQGYWRDVGTLDAYYDAHMDLIAERPAFNLYNRDWPVYTHSTQLSPARFNAGGIASESIISAGCLIRGQVTRSVLSPGVVVDPGAVVQGSVLHDNVHIGRGAVVRGAVLDKNVQVPPGATIGVNPQRDGELYTVSKGGVIALGKGQRVP,./data/raw/alphafold//AF-P72394-F1-model_v4.pdb,1597,6947,8795,9034 +299,4976,5055,MAMRLILFFGALFGHIYCLETFVGDQVLEIVPSNEEQIKNLLQLEAQEHLQLDFWKSPTTPGETAHVRVPFVNVQAVKVFLESQGIAYSIMIEDVQVLLDKENEEMLFNRRRERSGNFNFGAYHTLEEISQEMDNLVAEHPGLVSKVNIGSSFENRPMNVLKFSTGGDKPAIWLDAGIHAREWVTQATALWTANKIVSDYGKDPSITSILDALDIFLLPVTNPDGYVFSQTKNRMWRKTRSKVSGSLCVGVDPNRNWDAGFGGPGASSNPCSDSYHGPSANSEVEVKSIVDFIKSHGKVKAFITLHSYSQLLMFPYGYKCTKLDDFDELSEVAQKAAQSLRSLHGTKYKVGPICSVIYQASGGSIDWSYDYGIKYSFAFELRDTGRYGFLLPARQILPTAEETWLGLKAIMEHVRDHPY,uniprot_search,P48052,CC(C)C[C@H](N=C(O)CN=C(O)CN=C(O)OCc1ccccc1)C(=O)O,5.3,25.0,7.5,3.4.17.15,9606.0,0.724275869600789,0.724275869600789,CC(C)C[C@H](N=C(O)CN=C(O)CN=C(O)OCc1ccccc1)C(=O)O__MAMRLILFFGALFGHIYCLETFVGDQVLEIVPSNEEQIKNLLQLEAQEHLQLDFWKSPTTPGETAHVRVPFVNVQAVKVFLESQGIAYSIMIEDVQVLLDKENEEMLFNRRRERSGNFNFGAYHTLEEISQEMDNLVAEHPGLVSKVNIGSSFENRPMNVLKFSTGGDKPAIWLDAGIHAREWVTQATALWTANKIVSDYGKDPSITSILDALDIFLLPVTNPDGYVFSQTKNRMWRKTRSKVSGSLCVGVDPNRNWDAGFGGPGASSNPCSDSYHGPSANSEVEVKSIVDFIKSHGKVKAFITLHSYSQLLMFPYGYKCTKLDDFDELSEVAQKAAQSLRSLHGTKYKVGPICSVIYQASGGSIDWSYDYGIKYSFAFELRDTGRYGFLLPARQILPTAEETWLGLKAIMEHVRDHPY,./data/raw/alphafold//AF-P48052-F1-model_v4.pdb,5587,2027,1514,3028 +300,34209,34808,MNTVSPAKKKVIIIGAGIAGLKAASTLHQNGIQDCLVLEARDRVGGRLQTVTGYQGRKYDIGASWHHDTLTNPLFLEEAQLSLNDGRTRFVFDDDNFIYIDEERGRVDHDKELLLEIVDNEMSKFAELEFHQHLGVSDCSFFQLVMKYLLQRRQFLTNDQIRYLPQLCRYLELWHGLDWKLLSAKDTYFGHQGRNAFALNYDSVVQRIAQSFPQNWLKLSCEVKSITREPSKNVTVNCEDGTVYNADYVIITVPQSVLNLSVQPEKNLRGRIEFQPPLKPVIQDAFDKIHFGALGKVIFEFEECCWSNESSKIVTLANSTNEFVEIVRNAENLDELDSMLEREDSQKHTSVTCWSQPLFFVNLSKSTGVASFMMLMQAPLTNHIESIREDKERLFSFFQPVLNKIMKCLDSEDVIDGMRPIENIANANKPVLRNIIVSNWTRDPYSRGAYSACFPGDDPVDMVVAMSNGQDSRIRFAGEHTIMDGAGCAYGAWESGRREATRISDLLK,brenda,P50264,O=O,0.091,25.0,9.0,1.5.3.17,4932.0,-1.0409586076789064,-1.20073605920516,O=O__MNTVSPAKKKVIIIGAGIAGLKAASTLHQNGIQDCLVLEARDRVGGRLQTVTGYQGRKYDIGASWHHDTLTNPLFLEEAQLSLNDGRTRFVFDDDNFIYIDEERGRVDHDKELLLEIVDNEMSKFAELEFHQHLGVSDCSFFQLVMKYLLQRRQFLTNDQIRYLPQLCRYLELWHGLDWKLLSAKDTYFGHQGRNAFALNYDSVVQRIAQSFPQNWLKLSCEVKSITREPSKNVTVNCEDGTVYNADYVIITVPQSVLNLSVQPEKNLRGRIEFQPPLKPVIQDAFDKIHFGALGKVIFEFEECCWSNESSKIVTLANSTNEFVEIVRNAENLDELDSMLEREDSQKHTSVTCWSQPLFFVNLSKSTGVASFMMLMQAPLTNHIESIREDKERLFSFFQPVLNKIMKCLDSEDVIDGMRPIENIANANKPVLRNIIVSNWTRDPYSRGAYSACFPGDDPVDMVVAMSNGQDSRIRFAGEHTIMDGAGCAYGAWESGRREATRISDLLK,./data/raw/alphafold//AF-P50264-F1-model_v4.pdb,5615,2390,3013,3482 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+302,13462,13657,MVSQTVVSSLLVVLGAAGVRAQQRQSLWGQCGGSGWSGPTLCVDGAWCNPQNQWYHQCIPGSGPTTAQPQVPTTTARPTTTLVTSVVSSTTSPSGPVVTNPPVNPGTCPNTPSGLGTPVANQLNDPFTFHNGNKVTSKADWACRQREISELLQRYELGTLPPKPSSVTASFSGSTLSISVSEGGKSISFTVSINNRPSGAGPHPAIINFGTFGASLPVPAGVATINFNNDDIAQQQGGSSRGRGKFYDLYGSSHSAGALTAWAWGVSRIVDALELTQAQTGIDPTRLGVTGCSRNGKGAIVAGALEPRIALTLPQESGAGGSGCWRIATWQKNNGQNVQDSTQIVQENVWFSPNFNSYVNNVNQLPFDHHLLAGLIAPRALYVMENVDMEWLGKISTYGCMGIARKQWEALGALDNFGYSQVGGNSHCSFPSSQQGSELNAFIEKFLLKRSGGNTNIFRSTQTHSSFNLNNWSPWAVPSLN,brenda,B2ABS0,CO[C@H]1[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]1C(=O)OCCCc1ccc(O)cc1,1.34,50.0,6.0,3.1.1.117,2587412.0,0.1271047983648076,0.1271047983648076,CO[C@H]1[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]1C(=O)OCCCc1ccc(O)cc1__MVSQTVVSSLLVVLGAAGVRAQQRQSLWGQCGGSGWSGPTLCVDGAWCNPQNQWYHQCIPGSGPTTAQPQVPTTTARPTTTLVTSVVSSTTSPSGPVVTNPPVNPGTCPNTPSGLGTPVANQLNDPFTFHNGNKVTSKADWACRQREISELLQRYELGTLPPKPSSVTASFSGSTLSISVSEGGKSISFTVSINNRPSGAGPHPAIINFGTFGASLPVPAGVATINFNNDDIAQQQGGSSRGRGKFYDLYGSSHSAGALTAWAWGVSRIVDALELTQAQTGIDPTRLGVTGCSRNGKGAIVAGALEPRIALTLPQESGAGGSGCWRIATWQKNNGQNVQDSTQIVQENVWFSPNFNSYVNNVNQLPFDHHLLAGLIAPRALYVMENVDMEWLGKISTYGCMGIARKQWEALGALDNFGYSQVGGNSHCSFPSSQQGSELNAFIEKFLLKRSGGNTNIFRSTQTHSSFNLNNWSPWAVPSLN,./data/raw/alphafold//AF-B2ABS0-F1-model_v4.pdb,336,3505,4772,5035 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+379,826,849,MSIQENISSLQLRSWVSKSQRDLAKSILIGAPGGPAGYLRRASVAQLTQELGTAFFQQQQLPAAMADTFLEHLCLLDIDSEPVAARSTSIIATIGPASRSVERLKEMIKAGMNIARLNFSHGSHEYHAESIANVREAVESFAGSPLSYRPVAIALDTKGPEIRTGILQGGPESEVELVKGSQVLVTVDPAFRTRGNANTVWVDYPNIVRVVPVGGRIYIDDGLISLVVQKIGPEGLVTQVENGGVLGSRKGVNLPGAQVDLPGLSEQDVRDLRFGVEHGVDIVFASFVRKASDVAAVRAALGPEGHGIKIISKIENHEGVKRFDEILEVSDGIMVARGDLGIEIPAEKVFLAQKMMIGRCNLAGKPVVCATQMLESMITKPRPTRAETSDVANAVLDGADCIMLSGETAKGNFPVEAVKMQHAIAREAEAAVYHRQLFEELRRAAPLSRDPTEVTAIGAVEAAFKCCAAAIIVLTTTGRSAQLLSRYRPRAAVIAVTRSAQAARQVHLCRGVFPLLYREPPEAIWADDVDRRVQFGIESGKLRGFLRVGDLVIVVTGWRPGSGYTNIMRVLSIS,sabio,P30613,C=C(OP(=O)(O)O)C(=O)O,0.15,23.0,8.0,2.7.1.40,9606.0,-0.8239087409443188,-0.3223476377856822,C=C(OP(=O)(O)O)C(=O)O__MSIQENISSLQLRSWVSKSQRDLAKSILIGAPGGPAGYLRRASVAQLTQELGTAFFQQQQLPAAMADTFLEHLCLLDIDSEPVAARSTSIIATIGPASRSVERLKEMIKAGMNIARLNFSHGSHEYHAESIANVREAVESFAGSPLSYRPVAIALDTKGPEIRTGILQGGPESEVELVKGSQVLVTVDPAFRTRGNANTVWVDYPNIVRVVPVGGRIYIDDGLISLVVQKIGPEGLVTQVENGGVLGSRKGVNLPGAQVDLPGLSEQDVRDLRFGVEHGVDIVFASFVRKASDVAAVRAALGPEGHGIKIISKIENHEGVKRFDEILEVSDGIMVARGDLGIEIPAEKVFLAQKMMIGRCNLAGKPVVCATQMLESMITKPRPTRAETSDVANAVLDGADCIMLSGETAKGNFPVEAVKMQHAIAREAEAAVYHRQLFEELRRAAPLSRDPTEVTAIGAVEAAFKCCAAAIIVLTTTGRSAQLLSRYRPRAAVIAVTRSAQAARQVHLCRGVFPLLYREPPEAIWADDVDRRVQFGIESGKLRGFLRVGDLVIVVTGWRPGSGYTNIMRVLSIS,./data/raw/alphafold//AF-P30613-F1-model_v4.pdb,3167,490,8382,689 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+388,2794,2846,MSEYITVKDGTRISYDVHGEGSPILLIHGVTDCKETYDTDLPFLTKNHRVYRYDLRGHGASDHPKHPFTLENHIEDALAVISKLNLHNFVLYGGSLGSYIAEAVATKIPQDLSGLILNVSAAHNPASALADTAKNDNIPLDKVERRDYWIRHLTIDKGNIKQLTDSGFQKNSLSPEDEDRALRSITAFDFRNELPKITCPTLITSGLYDPVNGPSKGIEIQKYIPNACFVVFKSGHLQRLEMPTAYHHVVDDFIETVAR,brenda,Q8KT44,CC(=O)Sc1ccccc1,0.42,30.0,7.5,3.1.1.1,1582.0,-0.3767507096020995,-0.3767507096020995,CC(=O)Sc1ccccc1__MSEYITVKDGTRISYDVHGEGSPILLIHGVTDCKETYDTDLPFLTKNHRVYRYDLRGHGASDHPKHPFTLENHIEDALAVISKLNLHNFVLYGGSLGSYIAEAVATKIPQDLSGLILNVSAAHNPASALADTAKNDNIPLDKVERRDYWIRHLTIDKGNIKQLTDSGFQKNSLSPEDEDRALRSITAFDFRNELPKITCPTLITSGLYDPVNGPSKGIEIQKYIPNACFVVFKSGHLQRLEMPTAYHHVVDDFIETVAR,./data/raw/alphafold//AF-Q8KT44-F1-model_v4.pdb,3608,1241,1973,1856 +389,38113,38787,MTKEVCSNIGLWLLLTLLIGNYVVNLEASHHVYKRLTQSTNTKSPSVNQPYRTGFHFQPPKNWMNDPNGPMIYKGIYHLFYQWNPKGAVWGNIVWAHSTSTDLINWDPHPPAIFPSAPFDINGCWSGSATILPNGKPVILYTGIDPKNQQVQNIAEPKNLSDPYLREWKKSPLNPLMAPDAVNGINASSFRDPTTAWLGQDKKWRVIIGSKIHRRGLAITYTSKDFLKWEKSPEPLHYDDGSGMWECPDFFPVTRFGSNGVETSSFGEPNEILKHVLKISLDDTKHDYYTIGTYDRVKDKFVPDNGFKMDGTAPRYDYGKYYASKTFFDSAKNRRILWGWTNESSSVEDDVEKGWSGIQTIPRKIWLDRSGKQLIQWPVREVERLRTKQVKNLRNKVLKSGSRLEVYGVTAAQADVEVLFKVRDLEKADVIEPSWTDPQLICSKMNVSVKSGLGPFGLMVLASKNLEEYTSVYFRIFKARQNSNKYVVLMCSDQSRSSLKEDNDKTTYGAFVDINPHQPLSLRALIDHSVVESFGGKGRACITSRVYPKLAIGKSSHLFAFNYGYQSVDVLNLNAWSMNSAQIS,sabio,Q43866,OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O,0.35,30.0,5.0,3.2.1.26,3702.0,-0.4559319556497244,-0.4559319556497244,OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O__MTKEVCSNIGLWLLLTLLIGNYVVNLEASHHVYKRLTQSTNTKSPSVNQPYRTGFHFQPPKNWMNDPNGPMIYKGIYHLFYQWNPKGAVWGNIVWAHSTSTDLINWDPHPPAIFPSAPFDINGCWSGSATILPNGKPVILYTGIDPKNQQVQNIAEPKNLSDPYLREWKKSPLNPLMAPDAVNGINASSFRDPTTAWLGQDKKWRVIIGSKIHRRGLAITYTSKDFLKWEKSPEPLHYDDGSGMWECPDFFPVTRFGSNGVETSSFGEPNEILKHVLKISLDDTKHDYYTIGTYDRVKDKFVPDNGFKMDGTAPRYDYGKYYASKTFFDSAKNRRILWGWTNESSSVEDDVEKGWSGIQTIPRKIWLDRSGKQLIQWPVREVERLRTKQVKNLRNKVLKSGSRLEVYGVTAAQADVEVLFKVRDLEKADVIEPSWTDPQLICSKMNVSVKSGLGPFGLMVLASKNLEEYTSVYFRIFKARQNSNKYVVLMCSDQSRSSLKEDNDKTTYGAFVDINPHQPLSLRALIDHSVVESFGGKGRACITSRVYPKLAIGKSSHLFAFNYGYQSVDVLNLNAWSMNSAQIS,./data/raw/alphafold//AF-Q43866-F1-model_v4.pdb,2708,8300,10215,11428 +390,40195,40927,MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEATKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEEVIPKDENGKILFDTVDLCATWEAVEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRNVRYLTLDIFAGPPNYPFSDEY,sabio,Q04828,O[C@H]1CCc2ccccc21,0.038,25.0,7.4,1.1.1.112,9606.0,-1.42021640338319,-1.3606231995235856,O[C@H]1CCc2ccccc21__MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEATKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEEVIPKDENGKILFDTVDLCATWEAVEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRNVRYLTLDIFAGPPNYPFSDEY,./data/raw/alphafold//AF-Q04828-F1-model_v4.pdb,2022,202,1057,249 +391,24411,24798,MSTASVIIIGAGISGISAAKVLVENGVEDVLILEATDRIGGRIHKQNFGDVPVELGAGWIAGVGGKESNPVWELASRFNLRTCFSDYTNARFNIYDRSGKIFPTGIASDSYKKAVDSAILKLKSLEAQCSGQVAEEAPSSPKTPIELAIDFILHDFEMAEVEPISTYVDFGEREFLVADERGYECLLYKMAEEFLVTSHGNILDYRLKLNQVVREVQQSRNGVVVKTEDGSVYEANYVIVSASIGVLQSDLLSFQPLLPRWKTEAIQKCDVMVYTKIFLKFPQCFWPCGPGQEFFIYAHEQRGYFTFWQHMENAYPGSNILVVTLTNEQSKRVEAQSDQETMKEAMSVLRDMFGATIPYATDILVPRWWNNRFQRGSYSNYPMISDNQLLQNIKAPVGRIFFTGEHTSEKFSGYVHGGYLAGIDTSKSLLEEMKQSLLLQPLLAFTESLTLTHQKPNNSQIYTNVKFISGTS,brenda,Q9FNA2,NCCCNCCCNCCCN,0.09,25.0,8.0,1.5.3.16,3702.0,-1.0457574905606752,-0.5457574905606751,NCCCNCCCNCCCN__MSTASVIIIGAGISGISAAKVLVENGVEDVLILEATDRIGGRIHKQNFGDVPVELGAGWIAGVGGKESNPVWELASRFNLRTCFSDYTNARFNIYDRSGKIFPTGIASDSYKKAVDSAILKLKSLEAQCSGQVAEEAPSSPKTPIELAIDFILHDFEMAEVEPISTYVDFGEREFLVADERGYECLLYKMAEEFLVTSHGNILDYRLKLNQVVREVQQSRNGVVVKTEDGSVYEANYVIVSASIGVLQSDLLSFQPLLPRWKTEAIQKCDVMVYTKIFLKFPQCFWPCGPGQEFFIYAHEQRGYFTFWQHMENAYPGSNILVVTLTNEQSKRVEAQSDQETMKEAMSVLRDMFGATIPYATDILVPRWWNNRFQRGSYSNYPMISDNQLLQNIKAPVGRIFFTGEHTSEKFSGYVHGGYLAGIDTSKSLLEEMKQSLLLQPLLAFTESLTLTHQKPNNSQIYTNVKFISGTS,./data/raw/alphafold//AF-Q9FNA2-F1-model_v4.pdb,5616,2391,3014,3483 +392,16324,16565,AVKVAINGFGR,uniprot_search,Q7M1A0,C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO,0.022,37.0,7.125,1.1.1.149,29347.0,-1.6575773191777938,-1.6575773191777938,C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO__AVKVAINGFGR,./data/raw/esmfold//ESMFold-Q7M1A0-v1.pdb,674,4017,5411,5757 +393,39948,40668,MKIKAAVVDKVNDPFVIKDDIELAEMKATDLQIKMVATGICHSDEAIRRGDASLGYPVILGHEGSGIVEKVGSEVTNFEVGDHVILSFYADGTCDNCLKGMPTKCRNYADYNLSGTRPDGSDHFQENGHHISDMFDQSSFTTHTVVDQRNAVKVPKELDLRRLGPLGCGYVTGSGTVLNSLQPRPGQTIAVFGTGAVGLAAMMAGKISGCTEVIAVDIVDSRLELAKELGATHAINSKEEDPVEAIKKLTHGYGVDFAVDTTGVEPVMVSAIHALAQGGTAALIAVTAKNITISSWNDLCVDDKKVIGVNMGDAIPGVDIPRLIDFYQHGMFPFEKTEKFYKFEDINQANADSGSGKTIKPVLIIDEDYQPGK,sabio,F9USH4,OCc1ccccc1,0.23,30.0,5.0,1.1.1.90,1590.0,-0.6382721639824072,-0.6382721639824072,OCc1ccccc1__MKIKAAVVDKVNDPFVIKDDIELAEMKATDLQIKMVATGICHSDEAIRRGDASLGYPVILGHEGSGIVEKVGSEVTNFEVGDHVILSFYADGTCDNCLKGMPTKCRNYADYNLSGTRPDGSDHFQENGHHISDMFDQSSFTTHTVVDQRNAVKVPKELDLRRLGPLGCGYVTGSGTVLNSLQPRPGQTIAVFGTGAVGLAAMMAGKISGCTEVIAVDIVDSRLELAKELGATHAINSKEEDPVEAIKKLTHGYGVDFAVDTTGVEPVMVSAIHALAQGGTAALIAVTAKNITISSWNDLCVDDKKVIGVNMGDAIPGVDIPRLIDFYQHGMFPFEKTEKFYKFEDINQANADSGSGKTIKPVLIIDEDYQPGK,./data/raw/alphafold//AF-F9USH4-F1-model_v4.pdb,2761,8530,4583,11747 +394,19421,19705,MSEPIRVLVTGAAGQIAYSLLFSIAKGDVFGKDQPITLLLLDITPMLPVLEGVVMELQDCALPLLREIVPTDKEDVAFKDLDAAILVGSMPRKEGMERKDLLKANVAIFKGQGAALEKYAKKTVKVLVVGNPANTNCLIAAKSAPSIPKANFSCLTRLDHNRARSQVAMACGVPATHVRNMIIWGNHSSTQYPDVHHCLVRMSGSELACFDAVKDDVWLKGDFIATVQQRGAAVIKARKLSSAMSAAKAICDHMRDLWSGTAEGEFTSMGVYSSGNPYGVPEDLIYSFPVQIKDKTWKIVEGLTINDFSKSKMDATAAELIEERDTAVSFLGV,brenda,Q90YZ8,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.0207,20.0,7.5,1.1.1.37,55126.0,-1.6840296545430822,-1.7097803141225885,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MSEPIRVLVTGAAGQIAYSLLFSIAKGDVFGKDQPITLLLLDITPMLPVLEGVVMELQDCALPLLREIVPTDKEDVAFKDLDAAILVGSMPRKEGMERKDLLKANVAIFKGQGAALEKYAKKTVKVLVVGNPANTNCLIAAKSAPSIPKANFSCLTRLDHNRARSQVAMACGVPATHVRNMIIWGNHSSTQYPDVHHCLVRMSGSELACFDAVKDDVWLKGDFIATVQQRGAAVIKARKLSSAMSAAKAICDHMRDLWSGTAEGEFTSMGVYSSGNPYGVPEDLIYSFPVQIKDKTWKIVEGLTINDFSKSKMDATAAELIEERDTAVSFLGV,./data/raw/alphafold//AF-Q90YZ8-F1-model_v4.pdb,4082,4908,4259,6742 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+462,30398,30937,MSIYVASRRLSGGTTVTALRYATSLRSYSTSFREERDTFGPIQVPSDKLWGAQTQRSLQNFEIGGERERMPEPIVRAFGVLKKCAAKVNMEYGLDPTIGKAIMQAAQEVAEGKLNDHFPLVVWQTGSGTQSNMNANEVIANRAAEILGRKRGEKCVHPNDHVNRSQSSNDTFPTVMHIAAATEINSRLIPSLKTLHSTLESKSFEFKDIVKIGRTHTQDATPLTLGQEFGGYATQVKYGLNRVTCTLPRLYQLAQGGTAVGTGLNTKKGFDVKIAAAVAEETNLPFVTAENKFEALAAHDACVETSGSLNTIATSLMKIANDIRFLGSGPRCGLGELVLPENEPGSSIMPGKVNPTQCEALTMVCAQVMGNHVAVTVGGSNGHFELNVFKPVIASALLHSVRLIADASASFEKNCVRGIEANRERISKLLHESLMLVTSLNPKIGYDNAAAVAKKAHKEGCTLKEAALNLGVLTAEEFDTLVVPEKMIGPSD,sabio,P93033,O=C(O)C=CC(=O)O,0.7,30.0,,4.2.1.2,3702.0,-0.1549019599857432,-0.1032679733238288,O=C(O)C=CC(=O)O__MSIYVASRRLSGGTTVTALRYATSLRSYSTSFREERDTFGPIQVPSDKLWGAQTQRSLQNFEIGGERERMPEPIVRAFGVLKKCAAKVNMEYGLDPTIGKAIMQAAQEVAEGKLNDHFPLVVWQTGSGTQSNMNANEVIANRAAEILGRKRGEKCVHPNDHVNRSQSSNDTFPTVMHIAAATEINSRLIPSLKTLHSTLESKSFEFKDIVKIGRTHTQDATPLTLGQEFGGYATQVKYGLNRVTCTLPRLYQLAQGGTAVGTGLNTKKGFDVKIAAAVAEETNLPFVTAENKFEALAAHDACVETSGSLNTIATSLMKIANDIRFLGSGPRCGLGELVLPENEPGSSIMPGKVNPTQCEALTMVCAQVMGNHVAVTVGGSNGHFELNVFKPVIASALLHSVRLIADASASFEKNCVRGIEANRERISKLLHESLMLVTSLNPKIGYDNAAAVAKKAHKEGCTLKEAALNLGVLTAEEFDTLVVPEKMIGPSD,./data/raw/alphafold//AF-P93033-F1-model_v4.pdb,1009,7264,9280,9239 +463,937,964,MALTTTGTEQHDLFSGTFWQNPHPAYAALRAEDPVRKLALPDGPVWLLTRYADVREAFVDPRLSKDWRHTLPEDQRADMPATPTPMMILMDPPDHTRLRKLVGRSFTVRRMNELEPRITEIADGLLAGLPTDGPVDLMREYAFQIPVQVICELLGVPAEDRDDFSAWSSVLVDDSPADDKNAAMGKLHGYLSDLLERKRTEPDDALLSSLLAVSDEDGDRLSQEELVAMAMLLLIAGHETTVNLIGNGVLALLTHPDQRKLLAEDPSLISSAVEEFLRFDSPVSQAPIRFTAEDVTYSGVTIPAGEMVMLGLAAANRDADWMPEPDRLDITRDASGGVFFGHGIHFCLGAQLARLEGRVAIGRLFADRPELALAVGLDELVYRESTLVRGLSRMPVTMGPRSA,sabio,C4B644,C=C1CCC(O)CC1=CC=C1CCCC2(C)C1CCC2C(C)CCCC(C)C,0.0135,30.0,7.5,1.14.15.15,2074.0,-1.869666231504994,-1.8778614395990787,C=C1CCC(O)CC1=CC=C1CCCC2(C)C1CCC2C(C)CCCC(C)C__MALTTTGTEQHDLFSGTFWQNPHPAYAALRAEDPVRKLALPDGPVWLLTRYADVREAFVDPRLSKDWRHTLPEDQRADMPATPTPMMILMDPPDHTRLRKLVGRSFTVRRMNELEPRITEIADGLLAGLPTDGPVDLMREYAFQIPVQVICELLGVPAEDRDDFSAWSSVLVDDSPADDKNAAMGKLHGYLSDLLERKRTEPDDALLSSLLAVSDEDGDRLSQEELVAMAMLLLIAGHETTVNLIGNGVLALLTHPDQRKLLAEDPSLISSAVEEFLRFDSPVSQAPIRFTAEDVTYSGVTIPAGEMVMLGLAAANRDADWMPEPDRLDITRDASGGVFFGHGIHFCLGAQLARLEGRVAIGRLFADRPELALAVGLDELVYRESTLVRGLSRMPVTMGPRSA,./data/raw/alphafold//AF-C4B644-F1-model_v4.pdb,677,544,634,762 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+465,24434,24821,MDNLKIASTEEAQQHFSTKREIVSAYNTDFVDVAAVVVMDSDIDPINKVSDTKFGVPVFVISDDSSRIQADLMEKIYHIIDLNNQYDEQLYDREIESAAAKYEDGVLPPFFKSLKAYVERGNIQFDCPGHQGGQYFRKHPAGRQLYDFYGENVFRSDICNADVDLGDLLIHEGPAMDAEKHAAKVFNADKTYFVMNGTSTSNNVAVAAAVAPGDLVLFDRNNHKSIYNAALVKDGGRPVYLETSRDPYGFIGGIYARDFDEDYIRKQAAKVDPVKAKQKRPFRLAIIQLGTYDGTIYNAKQVVEKIGHLCDYILFDSAWVGYEQFIPMMRDSSPLLLDLGPEDPGILVTQSTHKQQAGFSQASQIHKKDSHIKGQKRYIDHKRFNNAYNQYASTSPFYPLFATLDVNAKMQEGEAGKKLWHDALVTSVNARKNLLKNATMIKPFVPPVVHGKNWEDADTEKIVDDIDYWRFEKGAKWHGFDGYEDNQYFVDPNKFLLTTPGINVQTGEYEDFGIPATILANYLREHGIIPEKNDLNSILFLMTPAETPAKMNNLVSQIVKFESLVKADAPLEDVLPRLYAQNKDRYNGYTIKQLCQELHNFYKGNNAKEYQKEMFLADYFPEQKMTPFDANVELLHNNAKLVKLSDIGGETALEGALPYPPGIFCVAPGEKWTKVAQTYFMILEEGINRFPGFAPEIQGVYFEQEDGKTVAYGYVYDPDKK,brenda,H8ZI01,NCCC[C@H](N)C(=O)O,1.0,30.0,5.5,4.1.1.17,1247.0,0.0,0.0,NCCC[C@H](N)C(=O)O__MDNLKIASTEEAQQHFSTKREIVSAYNTDFVDVAAVVVMDSDIDPINKVSDTKFGVPVFVISDDSSRIQADLMEKIYHIIDLNNQYDEQLYDREIESAAAKYEDGVLPPFFKSLKAYVERGNIQFDCPGHQGGQYFRKHPAGRQLYDFYGENVFRSDICNADVDLGDLLIHEGPAMDAEKHAAKVFNADKTYFVMNGTSTSNNVAVAAAVAPGDLVLFDRNNHKSIYNAALVKDGGRPVYLETSRDPYGFIGGIYARDFDEDYIRKQAAKVDPVKAKQKRPFRLAIIQLGTYDGTIYNAKQVVEKIGHLCDYILFDSAWVGYEQFIPMMRDSSPLLLDLGPEDPGILVTQSTHKQQAGFSQASQIHKKDSHIKGQKRYIDHKRFNNAYNQYASTSPFYPLFATLDVNAKMQEGEAGKKLWHDALVTSVNARKNLLKNATMIKPFVPPVVHGKNWEDADTEKIVDDIDYWRFEKGAKWHGFDGYEDNQYFVDPNKFLLTTPGINVQTGEYEDFGIPATILANYLREHGIIPEKNDLNSILFLMTPAETPAKMNNLVSQIVKFESLVKADAPLEDVLPRLYAQNKDRYNGYTIKQLCQELHNFYKGNNAKEYQKEMFLADYFPEQKMTPFDANVELLHNNAKLVKLSDIGGETALEGALPYPPGIFCVAPGEKWTKVAQTYFMILEEGINRFPGFAPEIQGVYFEQEDGKTVAYGYVYDPDKK,./data/raw/alphafold//AF-H8ZI01-F1-model_v4.pdb,4806,6020,7784,8180 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+467,13635,13832,MEVTPNHTQTVSGWAAMDESGKIVPFVFKRRENGVDDVTIKVKYCGMCHTDLHFIHNDWGITMYPVVPGHEITGVVTKVGTNVAGFKVGDRVGVGCIAASCLDCEHCRRSEENYCDKVALTYNGIFWDGSITYGGYSGMLVAHKRFVVRIPDTLPLDAAAPLLCAGITVYSPMKQHGMLQADAAGRRLGVVGLGGLGHVAVKFGKAFGLHVTVISTSPAKEREARENLKADNFVVSTDQKQMQAMTRSLDYIIDTVAATHSLGPILELLKVNGKLVLVGAPEKPVELPSFPLIFGKRTVSGSMTGGMKETQEMMDICGEHNITCDIEIVSTDRINDALARLARNDVRYRFVINVGGDSKL,brenda,Q7XWU3,COc1cc(/C=C/C=O)ccc1O,0.01618,30.0,6.3,1.1.1.195,39947.0,-1.7910214827237465,-1.7910214827237465,COc1cc(/C=C/C=O)ccc1O__MEVTPNHTQTVSGWAAMDESGKIVPFVFKRRENGVDDVTIKVKYCGMCHTDLHFIHNDWGITMYPVVPGHEITGVVTKVGTNVAGFKVGDRVGVGCIAASCLDCEHCRRSEENYCDKVALTYNGIFWDGSITYGGYSGMLVAHKRFVVRIPDTLPLDAAAPLLCAGITVYSPMKQHGMLQADAAGRRLGVVGLGGLGHVAVKFGKAFGLHVTVISTSPAKEREARENLKADNFVVSTDQKQMQAMTRSLDYIIDTVAATHSLGPILELLKVNGKLVLVGAPEKPVELPSFPLIFGKRTVSGSMTGGMKETQEMMDICGEHNITCDIEIVSTDRINDALARLARNDVRYRFVINVGGDSKL,./data/raw/alphafold//AF-Q7XWU3-F1-model_v4.pdb,143,3527,4815,5091 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MGVEVRQILEREHDLVLPMREVRQLTLRKLQEMSSKTDSATDTTAPKSRSDTSLKQNQLNLSTLLVNPEGPTLTQLNSVQSSERPLFLVHPIEGSTTVFHSLAAKLSVPTYGLQCTQAAPLDSIPNLAAYYIDCIKQVQPEGPYRIAGYSFGACVAFEMCSQLQAQQGPAPTHNNLFLFDGSHTYVLAYTQSYRAKMTPGCEAEAEAEALCFFIKQFLDVEHSKVLEALLPLKSLEDRVAASVDLITKSHHSLDRRELSFAAVSFYHKLRAADQYKPKAKYHGNVTLLRAKTGGTYGEDLGADYNLSQVCDGKVSVHIIEGDHRTLLEGSGLESIINIIHSSLAEPRVSVREG,./data/raw/alphafold//AF-P19096-F1-model_v4.pdb,3460,274,1142,359 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+687,18242,18506,MSWSPSLTTQTCGAWEMKERLGTGGFGNVIRWHNQETGEQIAIKQCRQELSPRNRERWCLEIQIMRRLTHPNVVAARDVPEGMQNLAPNDLPLLAMEYCQGGDLRKYLNQFENCCGLREGAILTLLSDIASALRYLHENRIIHRDLKPENIVLQQGEQRLIHKIIDLGYAKELDQGSLCTSFVGTLQYLAPELLEQQKYTVTVDYWSFGTLAFECITGFRPFLPNWQPVQWHSKVRQKSEVDIVVSEDLNGTVKFSSSLPYPNNLNSVLAERLEKWLQLMLMWHPRQRGTDPTYGPNGCFKALDDILNLKLVHILNMVTGTIHTYPVTEDESLQSLKARIQQDTGIPEEDQELLQEAGLALIPDKPATQCISDGKLNEGHTLDMDLVFLFDNSKITYETQISPRPQPESVSCILQEPKRNLAFFQLRKVWGQVWHSIQTLKEDCNRLQQGQRAAMMNLLRNNSCLSKMKNSMASMSQQLKAKLDFFKTSIQIDLEKYSEQTEFGITSDKLLLAWREMEQAVELCGRENEVKLLVERMMALQTDIVDLQRSPMGRKQGGTLDDLEEQARELYRRLREKPRDQRTEGDSQEMVRLLLQAIQSFEKKVRVIYTQLSKTVVCKQKALELLPKVEEVVSLMNEDEKTVVRLQEKRQKELWNLLKIACSKVRGPVSGSPDSMNASRLSQPGQLMSQPSTASNSLPEPAKKSEELVAEAHNLCTLLENAIQDTVREQDQSFTALDWSWLQTEEEEHSCLEQAS,sabio,O14920,Cc1nc(N)nc(N)c1OCCCOc1cc(Cl)c(Cl)cc1Cl,0.00075,25.0,7.6,2.7.11.10,9606.0,-3.1249387366083,-3.1249387366083,Cc1nc(N)nc(N)c1OCCCOc1cc(Cl)c(Cl)cc1Cl__MSWSPSLTTQTCGAWEMKERLGTGGFGNVIRWHNQETGEQIAIKQCRQELSPRNRERWCLEIQIMRRLTHPNVVAARDVPEGMQNLAPNDLPLLAMEYCQGGDLRKYLNQFENCCGLREGAILTLLSDIASALRYLHENRIIHRDLKPENIVLQQGEQRLIHKIIDLGYAKELDQGSLCTSFVGTLQYLAPELLEQQKYTVTVDYWSFGTLAFECITGFRPFLPNWQPVQWHSKVRQKSEVDIVVSEDLNGTVKFSSSLPYPNNLNSVLAERLEKWLQLMLMWHPRQRGTDPTYGPNGCFKALDDILNLKLVHILNMVTGTIHTYPVTEDESLQSLKARIQQDTGIPEEDQELLQEAGLALIPDKPATQCISDGKLNEGHTLDMDLVFLFDNSKITYETQISPRPQPESVSCILQEPKRNLAFFQLRKVWGQVWHSIQTLKEDCNRLQQGQRAAMMNLLRNNSCLSKMKNSMASMSQQLKAKLDFFKTSIQIDLEKYSEQTEFGITSDKLLLAWREMEQAVELCGRENEVKLLVERMMALQTDIVDLQRSPMGRKQGGTLDDLEEQARELYRRLREKPRDQRTEGDSQEMVRLLLQAIQSFEKKVRVIYTQLSKTVVCKQKALELLPKVEEVVSLMNEDEKTVVRLQEKRQKELWNLLKIACSKVRGPVSGSPDSMNASRLSQPGQLMSQPSTASNSLPEPAKKSEELVAEAHNLCTLLENAIQDTVREQDQSFTALDWSWLQTEEEEHSCLEQAS,./data/raw/alphafold//AF-O14920-F1-model_v4.pdb,3859,4467,5935,3308 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+690,21392,21718,MKPLVVFVLGGPGAGKGTQCARIVEKYGYTHLSAGELLRDERKNPDSQYGELIEKYIKEGKIVPVEITISLLKREMDQTMAANAQKNKFLIDGFPRNQDNLQGWNKTMDGKADVSFVLFFDCNNEICIERCLERGKSSGRSDDNRESLEKRIQTYLQSTKPIIDLYEEMGKVKKIDASKSVDEVFDEVVQIFDKEG,sabio,P30085,N=c1ccn([C@@H]2CO[C@H](COP(=O)(O)O)O2)c(O)n1,1.037,37.0,7.5,2.7.4.14,9606.0,0.0157787563890409,0.0157787563890409,N=c1ccn([C@@H]2CO[C@H](COP(=O)(O)O)O2)c(O)n1__MKPLVVFVLGGPGAGKGTQCARIVEKYGYTHLSAGELLRDERKNPDSQYGELIEKYIKEGKIVPVEITISLLKREMDQTMAANAQKNKFLIDGFPRNQDNLQGWNKTMDGKADVSFVLFFDCNNEICIERCLERGKSSGRSDDNRESLEKRIQTYLQSTKPIIDLYEEMGKVKKIDASKSVDEVFDEVVQIFDKEG,./data/raw/alphafold//AF-P30085-F1-model_v4.pdb,1268,184,201,223 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+694,35608,36231,MKAQPPLRLTAQAMAFVLAGGRGSRLKELTDRRAKPAVYFGGKARIIDFALSNAMNSGIRKMAIATQYKAHSLIRHIQRGWNFFREERNEYLDILPASQRVDENRWYLGTADAVTQNIDIVDSYDIKYVIILAGDHVYKMDYEIMLRQHCETGADVTIGCLTVPRAEATAFGVMHVDANLRITDFLEKPADPPGIPGDEANALASMGIYVFDWAFLRDLLIRDAEDPNSSHDFGHDLIPAIVKNGKAMAHRFSDSCVMTGLETEPYWRDVGTIDAFWQANIDLTDFTPKLDLYDREWPIWTYSQIVPPAKFIHDSENRRGTAISSLVSGDCIVSGSEIRSSLLFTGCRTHSYSSMSHVVALPHVTVNRKADLTNCVLDRGVVVPEGLVIGQDAEEDARWFRRSEGGIVLVTQDMLDARARALN,brenda,Q9RNH7,O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,0.021,37.0,8.0,2.7.7.27,1063.0,-1.6777807052660807,-1.46479633912994,O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O__MKAQPPLRLTAQAMAFVLAGGRGSRLKELTDRRAKPAVYFGGKARIIDFALSNAMNSGIRKMAIATQYKAHSLIRHIQRGWNFFREERNEYLDILPASQRVDENRWYLGTADAVTQNIDIVDSYDIKYVIILAGDHVYKMDYEIMLRQHCETGADVTIGCLTVPRAEATAFGVMHVDANLRITDFLEKPADPPGIPGDEANALASMGIYVFDWAFLRDLLIRDAEDPNSSHDFGHDLIPAIVKNGKAMAHRFSDSCVMTGLETEPYWRDVGTIDAFWQANIDLTDFTPKLDLYDREWPIWTYSQIVPPAKFIHDSENRRGTAISSLVSGDCIVSGSEIRSSLLFTGCRTHSYSSMSHVVALPHVTVNRKADLTNCVLDRGVVVPEGLVIGQDAEEDARWFRRSEGGIVLVTQDMLDARARALN,./data/raw/alphafold//AF-Q9RNH7-F1-model_v4.pdb,1597,6826,8664,8889 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+699,32009,32572,MNAAAVTPPPEKFNFAEHLLQTNRVRPDKTAFVDDVSSLSFAQLEVKARQLASALRAIGVKREERVLLLMLDGTDWPVSFLGAIYAGIVPVAVNTLLTADDYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVVVSRPAAPLEPGEVDFAAFVGAQAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYWSPELYGRHTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATSLLMGERPTPDAVFKRWLGGVGGVKSTVFYGAPTGYAGMLAAPNLPSRDQVALRLAASAGEALPAEIGQRFQRHFGIDIVDGIGSTEMLHIFLSNLPDRVRYGTTGWPVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGGWTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLEAAVVGVADEHGLTKPKAYVVARPGQTLSETELKTFIKDRLAPYKYPRSAVFVAELPKTATGKIQRFKLREGVLG,brenda,Q3LB11,O=C(O)c1cccc(O)c1,0.229,31.0,8.0,6.2.1.25,1076.0,-0.640164517660112,-0.640164517660112,O=C(O)c1cccc(O)c1__MNAAAVTPPPEKFNFAEHLLQTNRVRPDKTAFVDDVSSLSFAQLEVKARQLASALRAIGVKREERVLLLMLDGTDWPVSFLGAIYAGIVPVAVNTLLTADDYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVVVSRPAAPLEPGEVDFAAFVGAQAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYWSPELYGRHTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATSLLMGERPTPDAVFKRWLGGVGGVKSTVFYGAPTGYAGMLAAPNLPSRDQVALRLAASAGEALPAEIGQRFQRHFGIDIVDGIGSTEMLHIFLSNLPDRVRYGTTGWPVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGGWTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLEAAVVGVADEHGLTKPKAYVVARPGQTLSETELKTFIKDRLAPYKYPRSAVFVAELPKTATGKIQRFKLREGVLG,./data/raw/alphafold//AF-Q3LB11-F1-model_v4.pdb,4863,3617,4941,5252 +700,32592,33172,MAWRHLKKRAQDAVIILGGGGLLFASYLMATGDERFYAEHLMPTLQGLLDPESAHRLAVRFTSLGLLPRARFQDSDMLEVRVLGHKFRNPVGIAAGFDKHGEAVDGLYKMGFGFVEIGSVTPKPQEGNPRPRVFRLPEDQAVINRYGFNSHGLSVVEHRLRARQQKQAKLTEDGLPLGVNLGKNKTSVDAAEDYAEGVRVLGPLADYLVVNVSSPNTAGLRSLQGKAELRRLLTKVLQERDGLRRVHRPAVLVKIAPDLTSQDKEDIASVVKELGIDGLIVTNTTVSRPAGLQGALRSETGGLSGKPLRDLSTQTIREMYALTQGRVPIIGVGGVSSGQDALEKIRAGASLVQLYTALTFWGPPVVGKVKRELEALLKEQGFGGVTDAIGADHRR,sabio,Q02127,O=C1CC(C(=O)O)NC(=O)N1,0.0094,30.0,8.0,1.3.5.2,9606.0,-2.026872146400301,-2.212406077536169,O=C1CC(C(=O)O)NC(=O)N1__MAWRHLKKRAQDAVIILGGGGLLFASYLMATGDERFYAEHLMPTLQGLLDPESAHRLAVRFTSLGLLPRARFQDSDMLEVRVLGHKFRNPVGIAAGFDKHGEAVDGLYKMGFGFVEIGSVTPKPQEGNPRPRVFRLPEDQAVINRYGFNSHGLSVVEHRLRARQQKQAKLTEDGLPLGVNLGKNKTSVDAAEDYAEGVRVLGPLADYLVVNVSSPNTAGLRSLQGKAELRRLLTKVLQERDGLRRVHRPAVLVKIAPDLTSQDKEDIASVVKELGIDGLIVTNTTVSRPAGLQGALRSETGGLSGKPLRDLSTQTIREMYALTQGRVPIIGVGGVSSGQDALEKIRAGASLVQLYTALTFWGPPVVGKVKRELEALLKEQGFGGVTDAIGADHRR,./data/raw/alphafold//AF-Q02127-F1-model_v4.pdb,5433,3086,3815,4432 +701,23057,23411,MTCYRGFLLGSCCRVAGGRAAALRGPGAGGPAARPRLGGDGGGRRHLGQGQPRELAGCGSRADGGFRPSRVVVVAKTTRYEFEQQRYRYAELSEEDLKQLLALKGSSYSGLLERHHIHTKNVEHIIDSLRNEGIEVRLVKRREYDEETVRWADAVIAAGGDGTMLLAASKVLDRLKPVIGVNTDPERSEGHLCLPVRYTHSFPEALQKFYRGEFRWLWRQRIRLYLEGTGINPVPVDLHEQQLSLNQHNRALNIERAHDERSEASGPQLLPVRALNEVFIGESLSSRASYYEISVDDGPWEKQKSSGLNLCTGTGSKAWSFNINRVATQAVEDVLNIAKRQGNLSLPLNRELVEKVTNEYNESLLYSPEEPKILFSIREPIANRVFSSSRQRCFSSKVCVRSRCWDACMVVDGGTSFEFNDGAIASMMINKEDELRTVLLEQ,sabio,Q4G0N4,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.022,37.0,8.0,2.7.1.23,9606.0,-1.6575773191777938,-1.6575773191777938,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MTCYRGFLLGSCCRVAGGRAAALRGPGAGGPAARPRLGGDGGGRRHLGQGQPRELAGCGSRADGGFRPSRVVVVAKTTRYEFEQQRYRYAELSEEDLKQLLALKGSSYSGLLERHHIHTKNVEHIIDSLRNEGIEVRLVKRREYDEETVRWADAVIAAGGDGTMLLAASKVLDRLKPVIGVNTDPERSEGHLCLPVRYTHSFPEALQKFYRGEFRWLWRQRIRLYLEGTGINPVPVDLHEQQLSLNQHNRALNIERAHDERSEASGPQLLPVRALNEVFIGESLSSRASYYEISVDDGPWEKQKSSGLNLCTGTGSKAWSFNINRVATQAVEDVLNIAKRQGNLSLPLNRELVEKVTNEYNESLLYSPEEPKILFSIREPIANRVFSSSRQRCFSSKVCVRSRCWDACMVVDGGTSFEFNDGAIASMMINKEDELRTVLLEQ,./data/raw/alphafold//AF-Q4G0N4-F1-model_v4.pdb,4330,5299,4298,7287 +702,7697,7830,MQSYKYQQKKNLEKSYTREDWQGGYKSLRQEFDYWIDDVEGEIPTELQGTLFRNGPGLLDIKGQSIHHPFDGDGMISRISFVNGRAHYRNSFVKTEGYLAEKNAGKILHRGVFGTQKPGGWLANIFDFKLKNIANTNVIYWGEKLLALWEAAEPHRLDPKTLDTLGKEYFHGVLSAGEAFGAHPRFDPSCEQDNGAPCLVNFSIKPGLSTTITIFELNVAGEVVRKHAHHVPGFCFIHDFVITPNHCIFFQNPVSFNPIPFALGLRGAGECIQVQPNQPTRIIVIPRFPQSGQKEIKTLEVGSGFIFHHVNAFVVGEEILVDSLCYDSLPEVEPESDFRQVDFEAIAPGQLWRFYLNLKDGTVQKKLIESRCCEFPAIHPRNVGRSYRYLYMSAAHAATGNAPLQALLKIDLESGEKQIWSVAPRGFTGEPIFVPRPGSEKEDDGWVLALVYDAAHHRSDVVILDASDFTKGAIARLHLQHHVPYGLHGNFTPQVFV,brenda,Q8YPB4,CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(\C)C=O)C(C)(C)C[C@H](O)C1,0.0021,20.0,6.8,1.13.11.75,103690.0,-2.677780705266081,-2.677780705266081,CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(\C)C=O)C(C)(C)C[C@H](O)C1__MQSYKYQQKKNLEKSYTREDWQGGYKSLRQEFDYWIDDVEGEIPTELQGTLFRNGPGLLDIKGQSIHHPFDGDGMISRISFVNGRAHYRNSFVKTEGYLAEKNAGKILHRGVFGTQKPGGWLANIFDFKLKNIANTNVIYWGEKLLALWEAAEPHRLDPKTLDTLGKEYFHGVLSAGEAFGAHPRFDPSCEQDNGAPCLVNFSIKPGLSTTITIFELNVAGEVVRKHAHHVPGFCFIHDFVITPNHCIFFQNPVSFNPIPFALGLRGAGECIQVQPNQPTRIIVIPRFPQSGQKEIKTLEVGSGFIFHHVNAFVVGEEILVDSLCYDSLPEVEPESDFRQVDFEAIAPGQLWRFYLNLKDGTVQKKLIESRCCEFPAIHPRNVGRSYRYLYMSAAHAATGNAPLQALLKIDLESGEKQIWSVAPRGFTGEPIFVPRPGSEKEDDGWVLALVYDAAHHRSDVVILDASDFTKGAIARLHLQHHVPYGLHGNFTPQVFV,./data/raw/alphafold//AF-Q8YPB4-F1-model_v4.pdb,5235,2725,3397,3929 +703,25358,25765,MLLPAPALRRALLSRPWTGAGLRWKHTSSLKVANEPVLAFTQGSPERDALQKALKDLKGRMEAIPCVVGDEEVWTSDVQYQVSPFNHGHKVAKFCYADKSLLNKAIEAALAARKEWDLKPIADRAQIFLKAADMLSGPRRAEILAKTMVGQGKTVIQAEIDAAAELIDFFRFNAKYAVELEGQQPISVPPSTNSTVYRGLEGFVAAISPFNFTAIGGNLAGAPALMGNVVLWKPSDTAMLASYAVYRILREAGLPPNIIQFVPADGPLFGDTVTSSEHLCGINFTGSVPTFKHLWKQVAQNLDRFHTFPRLAGECGGKNFHFVHRSADVESVVSGTLRSAFEYGGQKCSACSRLYVPHSLWPQIKGRLLEEHSRIKVGDPAEDFGTFFSAVIDAKSFARIKKWLEHARSSPSLTILAGGKCDDSVGYFVEPCIVESKDPQEPIMKEEIFGPVLSVYVYPDDKYKETLQLVDSTTSYGLTGAVFSQDKDVVQEATKVLRNAAGNFYINDKSTGSIVGQQPFGGARASGTNDKPGGPHYILRWTSPQVIKETHKPLGDWSYAYMQ,sabio,P30038,N[C@@H](CCC=O)C(=O)O,0.1,25.0,7.0,1.2.1.88,9606.0,-1.0,-0.8847755393108631,N[C@@H](CCC=O)C(=O)O__MLLPAPALRRALLSRPWTGAGLRWKHTSSLKVANEPVLAFTQGSPERDALQKALKDLKGRMEAIPCVVGDEEVWTSDVQYQVSPFNHGHKVAKFCYADKSLLNKAIEAALAARKEWDLKPIADRAQIFLKAADMLSGPRRAEILAKTMVGQGKTVIQAEIDAAAELIDFFRFNAKYAVELEGQQPISVPPSTNSTVYRGLEGFVAAISPFNFTAIGGNLAGAPALMGNVVLWKPSDTAMLASYAVYRILREAGLPPNIIQFVPADGPLFGDTVTSSEHLCGINFTGSVPTFKHLWKQVAQNLDRFHTFPRLAGECGGKNFHFVHRSADVESVVSGTLRSAFEYGGQKCSACSRLYVPHSLWPQIKGRLLEEHSRIKVGDPAEDFGTFFSAVIDAKSFARIKKWLEHARSSPSLTILAGGKCDDSVGYFVEPCIVESKDPQEPIMKEEIFGPVLSVYVYPDDKYKETLQLVDSTTSYGLTGAVFSQDKDVVQEATKVLRNAAGNFYINDKSTGSIVGQQPFGGARASGTNDKPGGPHYILRWTSPQVIKETHKPLGDWSYAYMQ,./data/raw/alphafold//AF-P30038-F1-model_v4.pdb,4303,5853,7577,1842 +704,21773,22111,MCAARMPPLAHIFRGTFVHSTWTCPMEVLRDHLLGVSDSGKIVFLEEASQQERLAKEWCFKPCEIRELSHHEFFMPGLVDTHIHAPQYFFAGSNVDLPLLEWLAKYTFPSEHKFRNIDFAEEVYTRVVRRTLKNGTTTACYFGTIHTDSSLLLAEITDKFGQRAFVGKVCMDLNDTVPEYKETTEESIKETERFVSEMFQRNYPRVKPIVTPRFSLSCSETLLVELGNIAKTHDLHIQSHISENRDEIEAVKNLYPSYKNYTDVYDKNKLLTNKTVMAHGCYLSAEELNTFSERGASISHCPNSNLSLSSGFLNVLEVLKHEVKIGLGTDIAGGYSSSMLDAIRRAVMVSNILLINKVNEKSLTLKEVFRLATLGGSQALGLDNEIGNFEVGKEFDALLINPKASDSPIDLFYGDFVGDISEAVIQKFLYLGDDRNIEEVYVGGKQVVPFSSSV,uniprot_search,G1T386,N=c1nc(O)c2nc[nH]c2[nH]1,0.0125,25.0,7.45,3.5.4.3,9986.0,-1.9030899869919435,-2.166207912922076,N=c1nc(O)c2nc[nH]c2[nH]1__MCAARMPPLAHIFRGTFVHSTWTCPMEVLRDHLLGVSDSGKIVFLEEASQQERLAKEWCFKPCEIRELSHHEFFMPGLVDTHIHAPQYFFAGSNVDLPLLEWLAKYTFPSEHKFRNIDFAEEVYTRVVRRTLKNGTTTACYFGTIHTDSSLLLAEITDKFGQRAFVGKVCMDLNDTVPEYKETTEESIKETERFVSEMFQRNYPRVKPIVTPRFSLSCSETLLVELGNIAKTHDLHIQSHISENRDEIEAVKNLYPSYKNYTDVYDKNKLLTNKTVMAHGCYLSAEELNTFSERGASISHCPNSNLSLSSGFLNVLEVLKHEVKIGLGTDIAGGYSSSMLDAIRRAVMVSNILLINKVNEKSLTLKEVFRLATLGGSQALGLDNEIGNFEVGKEFDALLINPKASDSPIDLFYGDFVGDISEAVIQKFLYLGDDRNIEEVYVGGKQVVPFSSSV,./data/raw/alphafold//AF-G1T386-F1-model_v4.pdb,4429,5510,1676,7579 +705,25945,26384,MFQKVDAYAGDPILSLMERFKEDPRSDKVNLSIGLYYNEDGIIPQLQAVADAEARLNAQPHGASLYLPMEGLNSYRHAIAPLLFGADHPVLKQKPRSVNSNPGWLRRAEGWRRFP,uniprot_search,A0A447LEQ3,N[C@@H](Cc1ccccc1)C(=O)O,0.08,37.0,7.6,2.6.1.57,548.0,-1.0969100130080565,-1.0969100130080565,N[C@@H](Cc1ccccc1)C(=O)O__MFQKVDAYAGDPILSLMERFKEDPRSDKVNLSIGLYYNEDGIIPQLQAVADAEARLNAQPHGASLYLPMEGLNSYRHAIAPLLFGADHPVLKQKPRSVNSNPGWLRRAEGWRRFP,./data/raw/alphafold//AF-A0A447LEQ3-F1-model_v4.pdb,1118,6286,8126,12082 +706,24581,24970,MTQQVSGSPFFKPFFLKTPVSLLRQRRHTLPASEFRNLTPQDAISVFEIEREAFVSVSGECPLTLDEVLNFLGQCPELSLGWFEEGQLVAFIIGSGWGKERLSQEAMTQHVPDSPAVHIHVLSVHRHCRQQGKGSILLWRFLQYLRCIPGLRRALLICEEYLVPFYQKAGFKEKGPSAISISNMQFQEMEYTIGGQAYTRRNSGC,brenda,Q68SL6,NCCc1c[nH]c2ccc(O)cc12,2.05,27.0,6.8,2.3.1.87,8175.0,0.3117538610557542,0.3117538610557542,NCCc1c[nH]c2ccc(O)cc12__MTQQVSGSPFFKPFFLKTPVSLLRQRRHTLPASEFRNLTPQDAISVFEIEREAFVSVSGECPLTLDEVLNFLGQCPELSLGWFEEGQLVAFIIGSGWGKERLSQEAMTQHVPDSPAVHIHVLSVHRHCRQQGKGSILLWRFLQYLRCIPGLRRALLICEEYLVPFYQKAGFKEKGPSAISISNMQFQEMEYTIGGQAYTRRNSGC,./data/raw/alphafold//AF-Q68SL6-F1-model_v4.pdb,3696,1363,2123,2027 +707,39348,40047,MISLRIALAINALSYICALVELAVADDYRPTFHFCPAENWMNEPNGLIKIDSTWHLFYQADPTANVWGNECWGHATSSDLLHWDHLPVAIPVENGIESFTGTSYYDANNTSSLGTSTNPPYLAFFTGYTSSNGTQDQRLAYSTDLGTTWLKFSGNPIISAALEAPHDVTGGLESRDPKVFFHEPSGKWVMVLAHGGQDKLTFWTSLDAKSWTWMSDLLASQIEGFPSSVTGWEVPDMFQLPIQGTNETTWVIIFTPAQGSPAGGNGVVALTGSFDGETFLANPVDSSTLWLDYGRDFDGAMSWENVPASDGRLIIAAVMNSYGSNPPTNTWKGMLSFPRTLTLEKIGSKQYFLQQPIAELSTVDNALASIQNQTIAPKQTLLSSIHGSSLDVRIAFSVDSGATLSLAVRKGGSEQTVIRYSQSNSTLSVDRTASGDISYDPAAGGIHSAQLARDNTELVYLRVLVDTCSVEVFGGQGEAVISDLIFPSNSSDGLSLEVIGGTATLQSVEVFSVSL,brenda,O00056,OC[C@H]1O[C@@](CO)(OC[C@@]2(OC[C@@]3(OC[C@@]4(OC[C@@]5(O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)O[C@H](CO)[C@@H](O)[C@@H]5O)O[C@H](CO)[C@@H](O)[C@@H]4O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O,0.78,55.0,5.4,3.2.1.7,1266744.0,-0.1079053973095195,-0.3928430512878001,OC[C@H]1O[C@@](CO)(OC[C@@]2(OC[C@@]3(OC[C@@]4(OC[C@@]5(O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)O[C@H](CO)[C@@H](O)[C@@H]5O)O[C@H](CO)[C@@H](O)[C@@H]4O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O__MISLRIALAINALSYICALVELAVADDYRPTFHFCPAENWMNEPNGLIKIDSTWHLFYQADPTANVWGNECWGHATSSDLLHWDHLPVAIPVENGIESFTGTSYYDANNTSSLGTSTNPPYLAFFTGYTSSNGTQDQRLAYSTDLGTTWLKFSGNPIISAALEAPHDVTGGLESRDPKVFFHEPSGKWVMVLAHGGQDKLTFWTSLDAKSWTWMSDLLASQIEGFPSSVTGWEVPDMFQLPIQGTNETTWVIIFTPAQGSPAGGNGVVALTGSFDGETFLANPVDSSTLWLDYGRDFDGAMSWENVPASDGRLIIAAVMNSYGSNPPTNTWKGMLSFPRTLTLEKIGSKQYFLQQPIAELSTVDNALASIQNQTIAPKQTLLSSIHGSSLDVRIAFSVDSGATLSLAVRKGGSEQTVIRYSQSNSTLSVDRTASGDISYDPAAGGIHSAQLARDNTELVYLRVLVDTCSVEVFGGQGEAVISDLIFPSNSSDGLSLEVIGGTATLQSVEVFSVSL,./data/raw/alphafold//AF-O00056-F1-model_v4.pdb,2701,8438,8483,11608 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+778,39771,40482,MKSLVVVVLLLAVGLGAGQNNKGWWKNAVFYQIYPRSFMDSNNDGIGDLQGIKDKLSHFTESGITAIWLSPIYRSPMVDFGYDISDFKDIDPIFGTTEDLQDLTAEAKKRNLKVILDLVPNHTSDEHNWFQLSVNKTGKYKDYYVWVDPKNGTDPFEKRYPNNWLSVFNGTGWTFNEIRQQFYFHQFYKKQPDLNYRNPEVRKEMKSVMEFWLNNGIDGFRIDAIPHIYEVENISLNEPPIGQNLNLSLHASLNHIYTKDQPETYDLVREWRNFVDEYAKNNNRDEIVLLTEAYTSLNNTLRYYQYGANVPFNFKFITDANSSSTPEQFKTIIDNWVQGTPQNDVPNWVKGNHDRVRVSTRYPGRADHMIMLEMILPGVAVTYYGEEIGMEDNTTIYKYDVRDGCRTPFQWDNSINAGFSKVNESTLEKEWLPVHSSYKNGLNLEQEKKDNISHYHLYTNLTALRKRDVLKEGKLVTEILNKNVLAIVRQNEKEAVSLLINFSKNNTVVNISKLVDEGNNKIYTSSINSKLTANELVNPMAIDIPGDSSVIITSGATIVNYSIMTFLFVVFISFFQR,brenda,A1IHL0,OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O,0.4,37.0,5.0,3.2.1.20,292787.0,-0.3979400086720376,-0.3979400086720376,OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O__MKSLVVVVLLLAVGLGAGQNNKGWWKNAVFYQIYPRSFMDSNNDGIGDLQGIKDKLSHFTESGITAIWLSPIYRSPMVDFGYDISDFKDIDPIFGTTEDLQDLTAEAKKRNLKVILDLVPNHTSDEHNWFQLSVNKTGKYKDYYVWVDPKNGTDPFEKRYPNNWLSVFNGTGWTFNEIRQQFYFHQFYKKQPDLNYRNPEVRKEMKSVMEFWLNNGIDGFRIDAIPHIYEVENISLNEPPIGQNLNLSLHASLNHIYTKDQPETYDLVREWRNFVDEYAKNNNRDEIVLLTEAYTSLNNTLRYYQYGANVPFNFKFITDANSSSTPEQFKTIIDNWVQGTPQNDVPNWVKGNHDRVRVSTRYPGRADHMIMLEMILPGVAVTYYGEEIGMEDNTTIYKYDVRDGCRTPFQWDNSINAGFSKVNESTLEKEWLPVHSSYKNGLNLEQEKKDNISHYHLYTNLTALRKRDVLKEGKLVTEILNKNVLAIVRQNEKEAVSLLINFSKNNTVVNISKLVDEGNNKIYTSSINSKLTANELVNPMAIDIPGDSSVIITSGATIVNYSIMTFLFVVFISFFQR,./data/raw/alphafold//AF-A1IHL0-F1-model_v4.pdb,2490,8113,9984,11167 +779,32506,33084,MARFNARLFSIAILGFQVARSAITYQHPDDLPGDVDYDFIVAGGGTAGLVVASRLGENSKWNVLVIEAGPSNKDVFATRVPGLAETLPTSHIDWNYTTVPQQALGGRSLNYSRAMILGGCSTHNGMVYTRGSKDDWNKWADVTGNRDLSWDSILPIMKKVEKFSEDFSDQSVEGHIDPSVHGNDGKLSVVASYTNVSFNDLLLETTKELVDEFPFKLDMNDGNPVGLTWNQYTIDHNAERSSSATAYLESTGDNVHVLLNTRVTRIVPTGKTNFRTVEFAVDAGGPRKQLTAKKEVILSGGFIASPQILMNSGIGDQEALKAVGVDTLVNNPSVGKNVSDQAATLVLFDTTLPNTDFDVDAAIVEWNNSHAGPLATGAPLNHLIWVRLSDDKLSGSDPSSGKDSPHIEFQFSKISHRIPPANVPNQVALPSQDSIGVVIQFSVVNLNSISRGSVSLNDNNPFSHPLIDLNMLGEEQDIAILREGVHSARRMLSSEAFKPFVNGSVHPPANITSDEDLDAFLHTTTKSYLHGVGTLSMSPQNASWGVVDPDFRVKGTTGLRVVDASVIPSVPAGHTQTPVYAFAEYASIVIAKSYN,brenda,V5NDL4,O=C1C=CC(=Nc2cc(Cl)c(O)c(Cl)c2)C=C1,0.11,30.0,4.0,1.1.99.29,56157.0,-0.958607314841775,-0.958607314841775,O=C1C=CC(=Nc2cc(Cl)c(O)c(Cl)c2)C=C1__MARFNARLFSIAILGFQVARSAITYQHPDDLPGDVDYDFIVAGGGTAGLVVASRLGENSKWNVLVIEAGPSNKDVFATRVPGLAETLPTSHIDWNYTTVPQQALGGRSLNYSRAMILGGCSTHNGMVYTRGSKDDWNKWADVTGNRDLSWDSILPIMKKVEKFSEDFSDQSVEGHIDPSVHGNDGKLSVVASYTNVSFNDLLLETTKELVDEFPFKLDMNDGNPVGLTWNQYTIDHNAERSSSATAYLESTGDNVHVLLNTRVTRIVPTGKTNFRTVEFAVDAGGPRKQLTAKKEVILSGGFIASPQILMNSGIGDQEALKAVGVDTLVNNPSVGKNVSDQAATLVLFDTTLPNTDFDVDAAIVEWNNSHAGPLATGAPLNHLIWVRLSDDKLSGSDPSSGKDSPHIEFQFSKISHRIPPANVPNQVALPSQDSIGVVIQFSVVNLNSISRGSVSLNDNNPFSHPLIDLNMLGEEQDIAILREGVHSARRMLSSEAFKPFVNGSVHPPANITSDEDLDAFLHTTTKSYLHGVGTLSMSPQNASWGVVDPDFRVKGTTGLRVVDASVIPSVPAGHTQTPVYAFAEYASIVIAKSYN,./data/raw/alphafold//AF-V5NDL4-F1-model_v4.pdb,3077,323,1782,9859 +780,35156,35772,MCPRAARAPATLLLALGAVLWPAAGAWELTILHTNDVHSRLEQTSEDSSKCVNASRCMGGVARLFTKVQQIRRAEPNVLLLDAGDQYQGTIWFTVYKGAEVAHFMNALRYDAMALGNHEFDNGVEGLIEPLLKEAKFPILSANIKAKGPLASQISGLYLPYKVLPVGDEVVGIVGYTSKETPFLSNPGTNLVFEDEITALQPEVDKLKTLNVNKIIALGHSGFEMDKLIAQKVRGVDVVVGGHSNTFLYTGNPPSKEVPAGKYPFIVTSDDGRKVPVVQAYAFGKYLGYLKIEFDERGNVISSHGNPILLNSSIPEDPSIKADINKWRIKLDNYSTQELGKTIVYLDGSSQSCRFRECNMGNLICDAMINNNLRHADETFWNHVSMCILNGGGIRSPIDERNNGTITWENLAAVLPFGGTFDLVQLKGSTLKKAFEHSVHRYGQSTGEFLQVGGIHVVYDLSRKPGDRVVKLDVLCTKCRVPSYDPLKMDEVYKVILPNFLANGGDGFQMIKDELLRHDSGDQDINVVSTYISKMKVIYPAVEGRIKFSTGSHCHGSFSLIFLSLWAVIFVLYQ,brenda,Q6NZX3,O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O,0.0071,37.0,7.5,3.1.3.5,9606.0,-2.1487416512809245,-2.1487416512809245,O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O__MCPRAARAPATLLLALGAVLWPAAGAWELTILHTNDVHSRLEQTSEDSSKCVNASRCMGGVARLFTKVQQIRRAEPNVLLLDAGDQYQGTIWFTVYKGAEVAHFMNALRYDAMALGNHEFDNGVEGLIEPLLKEAKFPILSANIKAKGPLASQISGLYLPYKVLPVGDEVVGIVGYTSKETPFLSNPGTNLVFEDEITALQPEVDKLKTLNVNKIIALGHSGFEMDKLIAQKVRGVDVVVGGHSNTFLYTGNPPSKEVPAGKYPFIVTSDDGRKVPVVQAYAFGKYLGYLKIEFDERGNVISSHGNPILLNSSIPEDPSIKADINKWRIKLDNYSTQELGKTIVYLDGSSQSCRFRECNMGNLICDAMINNNLRHADETFWNHVSMCILNGGGIRSPIDERNNGTITWENLAAVLPFGGTFDLVQLKGSTLKKAFEHSVHRYGQSTGEFLQVGGIHVVYDLSRKPGDRVVKLDVLCTKCRVPSYDPLKMDEVYKVILPNFLANGGDGFQMIKDELLRHDSGDQDINVVSTYISKMKVIYPAVEGRIKFSTGSHCHGSFSLIFLSLWAVIFVLYQ,./data/raw/alphafold//AF-Q6NZX3-F1-model_v4.pdb,1213,6407,8269,3238 +781,37114,37767,MAERVLTRVHSLRERVDATLAAHRNEILLFLSRIESHGKGILKPHELLAEFDAIRQDDKNKLNEHAFEELLKSTQEAIVLPPWVALAIRLRPGVWEYIRVNVNALVVEELSVPEYLQFKEELVDGASNGNFVLELDFEPFTASFPKPTLTKSIGNGVEFLNRHLSAKMFHDKESMTPLLEFLRAHHYKGKTMMLNDRIQNSNTLQNVLRKAEEYLIMLPPETPYFEFEHKFQEIGLEKGWGDTAERVLEMVCMLLDLLEAPDSCTLEKFLGRIPMVFNVVILSPHGYFAQENVLGYPDTGGQVVYILDQVPALEREMLKRIKEQGLDIIPRILIVTRLLPDAVGTTCGQRIEKVYGAEHSHILRVPFRTEKGIVRKWISRFEVWPYMETFIEDVAKEISAELQAKPDLIIGNYSEGNLAASLLAHKLGVTQCTIAHALEKTKYPDSDIYWKKFDEKYHFSSQFTADLIAMNHTDFIITSTFQEIAGSKDTVGQYESHMAFTMPGLYRVVHGINVFDPKFNIVSPGADINLYFSYSETEKRLTAFHPEIDELLYSDVENDEHLCVLKDRTKPILFTMARLDRVKNLTGLVEWYAKNPRLRGLVNLVVVGGDRRKESKDLEEQAEMKKMYELIETHNLNGQFRWISSQMNRVRNGELYRYIADTKGAFVQPAFYEAFGLTVVEAMTCGLPTFATNHGGPAEIIVHGKSGFHIDPYHGEQAADLLADFFEKCKKDPSHWETISMGGLKRIEEKYTWQIYSESLLTLAAVYGFWKHVSKLDRLEIRRYLEMFYALKYRKMAEAVPLAAE,brenda,P10691,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.2,30.0,7.5,2.4.1.13,4113.0,-0.6989700043360187,-0.6989700043360187,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MAERVLTRVHSLRERVDATLAAHRNEILLFLSRIESHGKGILKPHELLAEFDAIRQDDKNKLNEHAFEELLKSTQEAIVLPPWVALAIRLRPGVWEYIRVNVNALVVEELSVPEYLQFKEELVDGASNGNFVLELDFEPFTASFPKPTLTKSIGNGVEFLNRHLSAKMFHDKESMTPLLEFLRAHHYKGKTMMLNDRIQNSNTLQNVLRKAEEYLIMLPPETPYFEFEHKFQEIGLEKGWGDTAERVLEMVCMLLDLLEAPDSCTLEKFLGRIPMVFNVVILSPHGYFAQENVLGYPDTGGQVVYILDQVPALEREMLKRIKEQGLDIIPRILIVTRLLPDAVGTTCGQRIEKVYGAEHSHILRVPFRTEKGIVRKWISRFEVWPYMETFIEDVAKEISAELQAKPDLIIGNYSEGNLAASLLAHKLGVTQCTIAHALEKTKYPDSDIYWKKFDEKYHFSSQFTADLIAMNHTDFIITSTFQEIAGSKDTVGQYESHMAFTMPGLYRVVHGINVFDPKFNIVSPGADINLYFSYSETEKRLTAFHPEIDELLYSDVENDEHLCVLKDRTKPILFTMARLDRVKNLTGLVEWYAKNPRLRGLVNLVVVGGDRRKESKDLEEQAEMKKMYELIETHNLNGQFRWISSQMNRVRNGELYRYIADTKGAFVQPAFYEAFGLTVVEAMTCGLPTFATNHGGPAEIIVHGKSGFHIDPYHGEQAADLLADFFEKCKKDPSHWETISMGGLKRIEEKYTWQIYSESLLTLAAVYGFWKHVSKLDRLEIRRYLEMFYALKYRKMAEAVPLAAE,./data/raw/alphafold//AF-P10691-F1-model_v4.pdb,2543,6505,10092,7855 +782,9575,9726,MAVINIEYYSEVLGMNRKVNVIYPESSKVEDFSNTEIPVLYLLHGMSGNENSWMIRSGIERLIRHTNLAIVMPSTDLGFYVNTTYGMNYFDAIALELPKVIHNFFPNLSTKKEKNFIAGLSMGGYGAYRLALGTDHFSYAASLSGVLTFDGMEENFKENPAYWGGIFGNWETFKGSDNEILALADRKNEERPKLYAWCGKQDFLFPGNEYAIAELKKKGFDVTYESSDGVHEWYYWTKKIESVLQWLPINYKQEERLS,sabio,A2RMI9,CCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1,0.12,30.0,7.5,3.1.1.1,1359.0,-0.9208187539523752,-0.9208187539523752,CCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1__MAVINIEYYSEVLGMNRKVNVIYPESSKVEDFSNTEIPVLYLLHGMSGNENSWMIRSGIERLIRHTNLAIVMPSTDLGFYVNTTYGMNYFDAIALELPKVIHNFFPNLSTKKEKNFIAGLSMGGYGAYRLALGTDHFSYAASLSGVLTFDGMEENFKENPAYWGGIFGNWETFKGSDNEILALADRKNEERPKLYAWCGKQDFLFPGNEYAIAELKKKGFDVTYESSDGVHEWYYWTKKIESVLQWLPINYKQEERLS,./data/raw/alphafold//AF-A2RMI9-F1-model_v4.pdb,3587,1214,1945,1824 +783,35889,36517,MENQVKVLNLWASPFGLRVLVGLEEKGVKYEYQEENLPSKSELLLKMNPIHKKIPVLIHNDKPVLESLIIVEYIDEAWPNTNPFMPSSAYERARARFWADFVDKKIYDNGSALIMKCKGEAQEEAKRNMLEYLGLLEGALDELSGGIKPYFGGEKFGYMDIAFIPFASWFQAWEVMGNWKIPLETQFPRLHEWVNACMERESVKKVLPHPEKVAEFAMQIRQRFVGSD,brenda,Q6DNI8,O=[N+](O)c1c(Cl)cccc1N([O-])O,0.47,30.0,8.75,2.5.1.18,88731.0,-0.3279021420642826,-0.3279021420642826,O=[N+](O)c1c(Cl)cccc1N([O-])O__MENQVKVLNLWASPFGLRVLVGLEEKGVKYEYQEENLPSKSELLLKMNPIHKKIPVLIHNDKPVLESLIIVEYIDEAWPNTNPFMPSSAYERARARFWADFVDKKIYDNGSALIMKCKGEAQEEAKRNMLEYLGLLEGALDELSGGIKPYFGGEKFGYMDIAFIPFASWFQAWEVMGNWKIPLETQFPRLHEWVNACMERESVKKVLPHPEKVAEFAMQIRQRFVGSD,./data/raw/alphafold//AF-Q6DNI8-F1-model_v4.pdb,1043,6183,7999,8116 +784,5338,5419,PKPKKKQRWTPLEISLEVLVLVLVXI,uniprot_search,P19621,CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)[C@@H](N)Cc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O,0.111,37.0,7.25,3.4.24.11,9823.0,-0.9546770212133424,-0.9546770212133424,CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)[C@@H](N)Cc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O__PKPKKKQRWTPLEISLEVLVLVLVXI,./data/raw/esmfold//ESMFold-P19621-v1.pdb,5151,2035,1284,3041 +785,13904,14105,GTSTVALIAVIISSILYLLFGGSGHKNLPPGPKPWPIVGNLLQLGEKPHAQFAELAQTYGDIFTLKMGTETVVVASTSSAASEILKTHDRILSARYVFQSFRVKGHVENSIVWSDCTETWKNLRKVCRTELFTQKMIESQAHVREKKCEEMVEYLMKKQGEEVKIVEVIFGTLVNIFGNLIFSQNIFELGDPNSGSSEFKEYLWRMLELGNSTNPADYFPMLGKFDLFGQRKEVAECLKGIYAIWGAMLQERKLAKKVDGYKSKNDFVDVCLDSGLNDYQINALLMELFGAGTETSASTIEWAMTELTKNPKITAKIRSEIQTVVGERSVKESDFPNLPYLEATVKETLRLHPPTPLLLPRRALETCTILNYTIPKDCQIMVNAWGIGRDPKTWTDPLTFSPERFLNSSVDFRGNDFSLIPFGAGRRICPGLPIANQFIALLVATFVQNLDWCLPNGMSVDHLIVEEKFGLTLQKEPPLFIVPKSRV,sabio,O64899,COc1cc2c(cc1O)C(Cc1ccc(O)cc1)N(C)CC2,0.015,37.0,8.0,1.14.14.102,3467.0,-1.8239087409443189,-1.8239087409443189,COc1cc2c(cc1O)C(Cc1ccc(O)cc1)N(C)CC2__GTSTVALIAVIISSILYLLFGGSGHKNLPPGPKPWPIVGNLLQLGEKPHAQFAELAQTYGDIFTLKMGTETVVVASTSSAASEILKTHDRILSARYVFQSFRVKGHVENSIVWSDCTETWKNLRKVCRTELFTQKMIESQAHVREKKCEEMVEYLMKKQGEEVKIVEVIFGTLVNIFGNLIFSQNIFELGDPNSGSSEFKEYLWRMLELGNSTNPADYFPMLGKFDLFGQRKEVAECLKGIYAIWGAMLQERKLAKKVDGYKSKNDFVDVCLDSGLNDYQINALLMELFGAGTETSASTIEWAMTELTKNPKITAKIRSEIQTVVGERSVKESDFPNLPYLEATVKETLRLHPPTPLLLPRRALETCTILNYTIPKDCQIMVNAWGIGRDPKTWTDPLTFSPERFLNSSVDFRGNDFSLIPFGAGRRICPGLPIANQFIALLVATFVQNLDWCLPNGMSVDHLIVEEKFGLTLQKEPPLFIVPKSRV,./data/raw/alphafold//AF-O64899-F1-model_v4.pdb,368,3561,4866,5164 +786,1136,1166,MSYKNNHSILSKPNDPVEVIRDALSKALQFYYPLAGRLREGPNKKLMVDCTGEGILFVEANAEVTLDELGDAILPPCPFLDGFLFNVPGSDGILGSPLCLIQVTRLSCGGFIFALRLNHTICDALGLVQFLNAVGEIAQGKYAPSITPVWERELLSARDPPRISCTHEEFDDSIDHSYPNYGATVQQCYCFGPKEIKSLREHLPPHLSTCSSTFELITACVWKCRTISLDMDPEQIVRLSCVVTALGKHNNVCLPLGYYGNTFTYPAVVSTAERLCNSPLGYAVELVKKSKAKMSEEYLRSAIDFVEVRGRPPFALEGMSDFLVSDNTRTGLGEIDFGFGKPVYAGVAKSTDLISFYVRSTNKEEREILVPVCLPILSMEIFQQELKKMIG,brenda,G1EFQ3,C=CCc1ccc(O)c(OC)c1,3.78,30.0,7.5,2.3.1.84,3747.0,0.5774917998372253,0.5774917998372253,C=CCc1ccc(O)c(OC)c1__MSYKNNHSILSKPNDPVEVIRDALSKALQFYYPLAGRLREGPNKKLMVDCTGEGILFVEANAEVTLDELGDAILPPCPFLDGFLFNVPGSDGILGSPLCLIQVTRLSCGGFIFALRLNHTICDALGLVQFLNAVGEIAQGKYAPSITPVWERELLSARDPPRISCTHEEFDDSIDHSYPNYGATVQQCYCFGPKEIKSLREHLPPHLSTCSSTFELITACVWKCRTISLDMDPEQIVRLSCVVTALGKHNNVCLPLGYYGNTFTYPAVVSTAERLCNSPLGYAVELVKKSKAKMSEEYLRSAIDFVEVRGRPPFALEGMSDFLVSDNTRTGLGEIDFGFGKPVYAGVAKSTDLISFYVRSTNKEEREILVPVCLPILSMEIFQQELKKMIG,./data/raw/alphafold//AF-G1EFQ3-F1-model_v4.pdb,3275,630,736,893 +787,39528,40233,MAVPGKGLGKKLWSAAEMAALLGPGILLLAVRYARERDRWTPRDPLPPWQGVGRVQGLEAIPGGVRVRFAEAELEAVFLGEDLLRLTWSPGEALPPYALAEEASPLEPERLRGPDGVLLLRTRRLALALGEEGLEVRDGEGRLLRQEAYPERAGRAWRHRVRLAPGERVLGLGERAYPLDRRGGAFRLWNRDPGGSYGPGEDPLYLSVPVWLSLLPQGGYLAFYENPAEGFADLRGEEAWVGFLGGAFRYYLIPGPLEAALSRYVRLTGLPPMPPRWALGFHYARWGLRTREEVEERVAGFLERGLPLRAVHLDIDYMRGYRVFTVDEGRYPDLPGLVRGFQEKGVRTVLILDPGVKAEKGFPPYEEGLREGLFCRLPSGEVVRGPVWPGLAAFPDFTDPKARAWWGEKLKGFLEMGVAGLWLDMNEPALFAAWGEPTLPASARHALEGQGGDHRLAHNLYGLLMARASWEGFRKHAPERRPFLLTRSGHAGVQRYAWAWTGDVESTWEGLRTTLRALLGLSLSGVYFVGSDIGGFSGNPSPELYLRWFQMAALTPFFRLHAARWTKRREPWRFGEEVLEGVRRAMALRESLLPYLYTLAHRASREGKPLLRPLFLEGGPYTEEAFLLGEALLVAPVLEEGARAKEVPLPKGGWYPWGEDRALQGPTWARLPAPLDRIPLLVRAGTVLPLLEEGGLALHLYPGAEGAEGRLYWDEGEGEGPYRLDRFRLLPAEGGFRLLWQGKGELPWPWARVRLRLFGKRLLRAHVEGEAHAAEEGGVLLPPFREALLEVEG,brenda,Q745T6,OC[C@H]1O[C@H](OC[C@H]2O[C@H](O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,8.7,90.0,6.2,3.2.1.20,262724.0,0.9395192526186184,0.8277612981267088,OC[C@H]1O[C@H](OC[C@H]2O[C@H](O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O__MAVPGKGLGKKLWSAAEMAALLGPGILLLAVRYARERDRWTPRDPLPPWQGVGRVQGLEAIPGGVRVRFAEAELEAVFLGEDLLRLTWSPGEALPPYALAEEASPLEPERLRGPDGVLLLRTRRLALALGEEGLEVRDGEGRLLRQEAYPERAGRAWRHRVRLAPGERVLGLGERAYPLDRRGGAFRLWNRDPGGSYGPGEDPLYLSVPVWLSLLPQGGYLAFYENPAEGFADLRGEEAWVGFLGGAFRYYLIPGPLEAALSRYVRLTGLPPMPPRWALGFHYARWGLRTREEVEERVAGFLERGLPLRAVHLDIDYMRGYRVFTVDEGRYPDLPGLVRGFQEKGVRTVLILDPGVKAEKGFPPYEEGLREGLFCRLPSGEVVRGPVWPGLAAFPDFTDPKARAWWGEKLKGFLEMGVAGLWLDMNEPALFAAWGEPTLPASARHALEGQGGDHRLAHNLYGLLMARASWEGFRKHAPERRPFLLTRSGHAGVQRYAWAWTGDVESTWEGLRTTLRALLGLSLSGVYFVGSDIGGFSGNPSPELYLRWFQMAALTPFFRLHAARWTKRREPWRFGEEVLEGVRRAMALRESLLPYLYTLAHRASREGKPLLRPLFLEGGPYTEEAFLLGEALLVAPVLEEGARAKEVPLPKGGWYPWGEDRALQGPTWARLPAPLDRIPLLVRAGTVLPLLEEGGLALHLYPGAEGAEGRLYWDEGEGEGPYRLDRFRLLPAEGGFRLLWQGKGELPWPWARVRLRLFGKRLLRAHVEGEAHAAEEGGVLLPPFREALLEVEG,./data/raw/alphafold//AF-Q745T6-F1-model_v4.pdb,2730,8478,4527,11685 +788,29470,29994,MTCLKLNLLDHVFANPFMNAAGVLCSTEEDLRCMTASSSGALVSKSCTSAPRDGNPEPRYMAVPLGSINSMGLPNLGFDFYLKYASDLHDYSKKPLFVSISGLSVEENVAMVRRLAPVAQEKGVLLELNLSCPNVPGKPQVAYDFEAMRTYLQQVSLAYGLPFGVKMPPYFDIAHFDTAAAVLNEFPLVKFVTCVNSVGNGLVIDAESESVVIKPKQGFGGLGGKYILPTALANVNAFYRRCPDKLVFGCGGVYSGEDAFLHILAGASMVQVGTALQEEGPGIFRRLEDELLEIMARKGYKTLEEFRGRVKTIE,brenda,Q4DGV2,O=C(O)/C=C/C(=O)O,0.067,37.0,7.0,1.3.98.1,5693.0,-1.1739251972991736,-1.1739251972991736,O=C(O)/C=C/C(=O)O__MTCLKLNLLDHVFANPFMNAAGVLCSTEEDLRCMTASSSGALVSKSCTSAPRDGNPEPRYMAVPLGSINSMGLPNLGFDFYLKYASDLHDYSKKPLFVSISGLSVEENVAMVRRLAPVAQEKGVLLELNLSCPNVPGKPQVAYDFEAMRTYLQQVSLAYGLPFGVKMPPYFDIAHFDTAAAVLNEFPLVKFVTCVNSVGNGLVIDAESESVVIKPKQGFGGLGGKYILPTALANVNAFYRRCPDKLVFGCGGVYSGEDAFLHILAGASMVQVGTALQEEGPGIFRRLEDELLEIMARKGYKTLEEFRGRVKTIE,./data/raw/alphafold//AF-Q4DGV2-F1-model_v4.pdb,314,7091,8967,9241 +789,11455,11617,MKAALVYEPLGNENLRIEDVDDPKVLDGQVLIEVRKAGLNPVDYNTINGKIVYKLNPLPHIPGTEVYGVVAQDSGNFKKGDRVVVYNRVFDGTCDQCISGNEHLCTAGGIWGVVSNGGYAQKVAVPEKNVFRLPKNVSDEMAASIGVAALTSFRALRLAGCAPGKSVLIFGASGNTGMFSVQMASMMGCDVYAVSRKDWIEEFGATEVFEADEIPDSMKFDIVVNPLGTLFWKESLKHLGIRGSLVTFGIFTGREGSIDIADLYTGERRILGSTGGTRSDLRDLLEFMKMHDLRVKISREFKLTEMQDALKFYNEDHDGRILISMRVS,brenda,Q9HIM3,CCO,5.7,20.0,9.0,1.1.1.1,4932.0,0.7558748556724915,0.7558748556724915,CCO__MKAALVYEPLGNENLRIEDVDDPKVLDGQVLIEVRKAGLNPVDYNTINGKIVYKLNPLPHIPGTEVYGVVAQDSGNFKKGDRVVVYNRVFDGTCDQCISGNEHLCTAGGIWGVVSNGGYAQKVAVPEKNVFRLPKNVSDEMAASIGVAALTSFRALRLAGCAPGKSVLIFGASGNTGMFSVQMASMMGCDVYAVSRKDWIEEFGATEVFEADEIPDSMKFDIVVNPLGTLFWKESLKHLGIRGSLVTFGIFTGREGSIDIADLYTGERRILGSTGGTRSDLRDLLEFMKMHDLRVKISREFKLTEMQDALKFYNEDHDGRILISMRVS,./data/raw/alphafold//AF-Q9HIM3-F1-model_v4.pdb,5330,3238,3989,4646 +790,10195,10350,MKAARLHEYNKPLRIEDVDYPRLEGRFDVIVRIAGAGVCHTDLHLVQGMWHELLQPKLPYTLGHENVGYIEEVAEGVEGLEKGDPVILHPAVTDGTCLACRAGEDMHCENLEFPGLNIDGGFAEFMRTSHRSVIKLPKDISREKLVEMAPLADAGITAYRAVKKAARTLYPGAYVAIVGVGGLGHIAVQLLKVMTPATVIALDVKEEKLKLAERLGADHVVDARRDPVKQVMELTRGRGVNVAMDFVGSQATVDYTPYLLGRMGRLIIVGYGGELRFPTIRVISSEVSFEGSLVGNYVELHELVTLALQGKVRVEVDIHKLDEINDVLERLEKGEVLGRAVLIP,brenda,Q9Y9P9,CCCCCCCCC(C)=O,0.147,60.0,8.0,1.1.1.1,56636.0,-0.8326826652518239,-0.8326826652518239,CCCCCCCCC(C)=O__MKAARLHEYNKPLRIEDVDYPRLEGRFDVIVRIAGAGVCHTDLHLVQGMWHELLQPKLPYTLGHENVGYIEEVAEGVEGLEKGDPVILHPAVTDGTCLACRAGEDMHCENLEFPGLNIDGGFAEFMRTSHRSVIKLPKDISREKLVEMAPLADAGITAYRAVKKAARTLYPGAYVAIVGVGGLGHIAVQLLKVMTPATVIALDVKEEKLKLAERLGADHVVDARRDPVKQVMELTRGRGVNVAMDFVGSQATVDYTPYLLGRMGRLIIVGYGGELRFPTIRVISSEVSFEGSLVGNYVELHELVTLALQGKVRVEVDIHKLDEINDVLERLEKGEVLGRAVLIP,./data/raw/alphafold//AF-Q9Y9P9-F1-model_v4.pdb,3444,919,1109,1366 +791,31659,32217,MPGGRTPSGHCKDIEMSSLAENSHHQLVAAVIGMGSMGLGMARSMKRDGLDVVGYDISAAAVDRFVSEGGRGAASPAAAARDADIVVSVVVNGAQTRDVLFGAGNVANTMKRGAVFISSATMDPAVVRDLAERCTALGLHYLDAPISGGAVKAANGELTIMASGTKTAFEAARPALDAMAGKVYELGDDAGTGAAFKMINQLLAGVHIAAACEAITFAAKQGLDLDKVYEVITASAGNSWMFENRVPHVLEGDYSPRSAIEIFVKDLGIVQDMARTERYPTPLAAAALQMYLAASGAGMGRDDDASLARLYAQLSGTVLPNT,brenda,B9JKN9,O=C(O)[C@H](O)[C@@H](O)CO,1.19,25.0,8.0,1.1.1.411,358.0,0.0755469613925307,0.0755469613925307,O=C(O)[C@H](O)[C@@H](O)CO__MPGGRTPSGHCKDIEMSSLAENSHHQLVAAVIGMGSMGLGMARSMKRDGLDVVGYDISAAAVDRFVSEGGRGAASPAAAARDADIVVSVVVNGAQTRDVLFGAGNVANTMKRGAVFISSATMDPAVVRDLAERCTALGLHYLDAPISGGAVKAANGELTIMASGTKTAFEAARPALDAMAGKVYELGDDAGTGAAFKMINQLLAGVHIAAACEAITFAAKQGLDLDKVYEVITASAGNSWMFENRVPHVLEGDYSPRSAIEIFVKDLGIVQDMARTERYPTPLAAAALQMYLAASGAGMGRDDDASLARLYAQLSGTVLPNT,./data/raw/alphafold//AF-B9JKN9-F1-model_v4.pdb,1918,7402,9368,9707 +792,32584,33164,MLAVHFDKPGGPENLYVKEVAKPSPGEGEVLLKVAASALNRADLMQRQGQYDPPPGASNILGLEASGHVAELGPGCQGHWKIGDTAMALLPGGGQAQYVTVPEGLLMPIPEGLTLTQAAAIPEAWLTAFQLLHLVGNVQAGDYVLIHAGLSGVGTAAIQLTRMAGAIPLVTAGSQKKLQMAEKLGAAAGFNYKKEDFSEATLKFTKGAGVNLILDCIGGSYWEKNVNCLALDGRWVLYGLMGGGDINGPLFSKLLFKRGSLITSLLRSRDNKYKQMLVNAFTEQILPHFSTEGPQRLLPVLDRIYPVTEIQEAHKYMEANKNIGKIVLELPQ,sabio,Q53FA7,O=C1C=Cc2ccccc2C1=O,0.215,25.0,,1.6.5.5,9606.0,-0.6675615400843947,-0.6675615400843947,O=C1C=Cc2ccccc2C1=O__MLAVHFDKPGGPENLYVKEVAKPSPGEGEVLLKVAASALNRADLMQRQGQYDPPPGASNILGLEASGHVAELGPGCQGHWKIGDTAMALLPGGGQAQYVTVPEGLLMPIPEGLTLTQAAAIPEAWLTAFQLLHLVGNVQAGDYVLIHAGLSGVGTAAIQLTRMAGAIPLVTAGSQKKLQMAEKLGAAAGFNYKKEDFSEATLKFTKGAGVNLILDCIGGSYWEKNVNCLALDGRWVLYGLMGGGDINGPLFSKLLFKRGSLITSLLRSRDNKYKQMLVNAFTEQILPHFSTEGPQRLLPVLDRIYPVTEIQEAHKYMEANKNIGKIVLELPQ,./data/raw/alphafold//AF-Q53FA7-F1-model_v4.pdb,2014,7531,1792,9870 +793,9441,9590,MEDAKNIKKGPAPFYPLEDGTAGEQLHKAMKRYALVPGTIAFTDAHIEVNITYAEYFEMSVRLAEAMKRYGLNTNHRIVVCSENSLQFFMPVLGALFIGVAVAPANDIYNERELLNSMNISQPTVVFVSKKGLQKILNVQKKLPIIQKIIIMDSKTDYQGFQSMYTFVTSHLPPGFNEYDFVPESFDRDKTIALIMNSSGSTGLPKGVALPHRTACVRFSHARDPIFGNQIIPDTAILSVVPFHHGFGMFTTLGYLICGFRVVLMYRFEEELFLRSLQDYKIQSALLVPTLFSFFAKSTLIDKYDLSNLHEIASGGAPLSKEVGEAVAKRFHLPGIRQGYGLTETTSAILITPEGDDKPGAVGKVVPFFEAKVVDLDTGKTLGVNQRGELCVRGPMIMSGYVNNPEATNALIDKDGWLHSGDIAYWDEDEHFFIVDRLKSLIKYKGYQVAPAELESILLQHPNIFDAGVAGLPDDDAGELPAAVVVLEHGKTMTEKEIVDYVASQVTTAKKLRGGVVFVDEVPKGLTGKLDARKIREILIKAKKGGKSKL,brenda,P08659,CCCCC/C=C\C/C=C\CCCCCCCC(=O)O,0.0136,29.8,7.172222222222222,1.13.12.7,7054.0,-1.8664610916297824,-1.8664610916297824,CCCCC/C=C\C/C=C\CCCCCCCC(=O)O__MEDAKNIKKGPAPFYPLEDGTAGEQLHKAMKRYALVPGTIAFTDAHIEVNITYAEYFEMSVRLAEAMKRYGLNTNHRIVVCSENSLQFFMPVLGALFIGVAVAPANDIYNERELLNSMNISQPTVVFVSKKGLQKILNVQKKLPIIQKIIIMDSKTDYQGFQSMYTFVTSHLPPGFNEYDFVPESFDRDKTIALIMNSSGSTGLPKGVALPHRTACVRFSHARDPIFGNQIIPDTAILSVVPFHHGFGMFTTLGYLICGFRVVLMYRFEEELFLRSLQDYKIQSALLVPTLFSFFAKSTLIDKYDLSNLHEIASGGAPLSKEVGEAVAKRFHLPGIRQGYGLTETTSAILITPEGDDKPGAVGKVVPFFEAKVVDLDTGKTLGVNQRGELCVRGPMIMSGYVNNPEATNALIDKDGWLHSGDIAYWDEDEHFFIVDRLKSLIKYKGYQVAPAELESILLQHPNIFDAGVAGLPDDDAGELPAAVVVLEHGKTMTEKEIVDYVASQVTTAKKLRGGVVFVDEVPKGLTGKLDARKIREILIKAKKGGKSKL,./data/raw/alphafold//AF-P08659-F1-model_v4.pdb,209,6797,3692,8840 +794,30114,30643,MVKKSLRQFTLMATATVTLLLGSVPLYAQTADVQQKLAELERQSGGRLGVALINTADNSQILYRADERFPMCSTSKVMAAAAVLKQSETQKQLLNQPVEIKPADLVNYNPIAEKHVNGTMTLAELSAAALQYSDNTAMNKLIAQLGGPGGVTAFARAIGDETFRLDRTEPTLNTAIPGDPRDTTTPRAMAQTLRQLTLGHALGETQRAQLVTWLKGNTTGAASIRAGLPASWVVGDKTGSGGYGTTNDIAVIWPKDRAPLILVTYFTQPQPKAESRRDVLASAAKIVTDGL,brenda,A5LH21,O=C(O)C1=C(/C=C/c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CS[C@@H]2[C@H](N=C(O)Cc3cccs3)C(=O)N12,0.0148,37.0,7.0,3.5.2.6,624.0,-1.8297382846050425,-1.8297382846050425,O=C(O)C1=C(/C=C/c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CS[C@@H]2[C@H](N=C(O)Cc3cccs3)C(=O)N12__MVKKSLRQFTLMATATVTLLLGSVPLYAQTADVQQKLAELERQSGGRLGVALINTADNSQILYRADERFPMCSTSKVMAAAAVLKQSETQKQLLNQPVEIKPADLVNYNPIAEKHVNGTMTLAELSAAALQYSDNTAMNKLIAQLGGPGGVTAFARAIGDETFRLDRTEPTLNTAIPGDPRDTTTPRAMAQTLRQLTLGHALGETQRAQLVTWLKGNTTGAASIRAGLPASWVVGDKTGSGGYGTTNDIAVIWPKDRAPLILVTYFTQPQPKAESRRDVLASAAKIVTDGL,./data/raw/alphafold//AF-A5LH21-F1-model_v4.pdb,3555,343,1890,1755 +795,16313,16554,MQDWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRFGGTSAYSGASIWLPGTQVQERAGLPDSTENARTYLRALLGDAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADIGDLAGKVRPELDQDRTGQDHAPGPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDGRVVGAEVESGGETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALLDQAWFCPGVEQPDGSAAFMVGVRGGLVVDSAGERYLNESLPYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTAPAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFCPPNGGANAALTAIENGPFYAARIVLSDLGTKGGLVTDVNGRVLRADGSAIDGLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK,brenda,Q9RA02,C[C@]12CCC(=O)C=C1CC[C@@H]1C2=CC[C@]2(C)C(=O)CC[C@@H]12,0.014,30.0,8.0,1.3.99.4,1833.0,-1.853871964321762,-1.853871964321762,C[C@]12CCC(=O)C=C1CC[C@@H]1C2=CC[C@]2(C)C(=O)CC[C@@H]12__MQDWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRFGGTSAYSGASIWLPGTQVQERAGLPDSTENARTYLRALLGDAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADIGDLAGKVRPELDQDRTGQDHAPGPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDGRVVGAEVESGGETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALLDQAWFCPGVEQPDGSAAFMVGVRGGLVVDSAGERYLNESLPYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTAPAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFCPPNGGANAALTAIENGPFYAARIVLSDLGTKGGLVTDVNGRVLRADGSAIDGLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK,./data/raw/alphafold//AF-Q9RA02-F1-model_v4.pdb,3745,882,1061,1305 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+821,38729,39413,MLMKRLFAASLMLAFSSVSSVRAEEAVKPGAPWWKSAVFYQVYPRSFKDTNGDGIGDFKGLTEKLDYLKGLGIDAIWINPHYASPNTDNGYDISDYREVMKEYGTMEDFDRLMAELKKRGMRLMVDVVINHSSDQHEWFKSSRASKDNPYRDYYFWRDGKDGHEPNNYPSFFGGSAWEKDPVTGQYYLHYFGRQQPDLNWDTPKLREELYAMLRFWLDKGVSGMRFDTVATYSKTPGFPDLTPEQMKNFAEAYTQGPNLHRYLQEMHEKVFDHYDAVTAGEIFGAPLNQVPLFIDSRRKELDMAFTFDLIRYDRALDRWHTIPRTLADFRQTIDKVDAIAGEYGWNTFFLGNHDNPRAVSHFGDDRPQWREASAKALATVTLTQRGTPFIFQGDELGMTNYPFKTLQDFDDIEVKGFFQDYVETGKATAEELLTNVALTSRDNARTPFQWDDSANAGFTTGKPWLKVNPNYTEINAAREIGDPKSVYSFYRNLISIRHETPALSTGSYRDIDPSNADVYAYTRSQDGETYLVVVNFKAEPRSFTLPDGMHIAETLIESSSPAAPAAGAASLELQPWQSGIYKVK,brenda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data/raw/alphafold//AF-Q2PS28-F1-model_v4.pdb,1684,7060,8926,9182 +822,18168,18432,MRVLLTSFALDAHFNGSVPLAWALRAAGHEVRVASQPALTASITAAGLTAVPVGADPRLDEMVKGVGDAVLSHHADQSLDADTPGQLTPAFLQGWDTMMTATFYTLINDDPMVDDLVAFARGWEPDLILWEPFTFAGAVAAKVTGAAHARLLSFPDLFMSMRRAYLAQLGAAPAGPAGGNGTTHPDDSLGQWLEWTLGRYGVPFDEEAVTGQWSVDQVPRSFRPPSDRPVVGMRYVPYNGPGPAVVPDWLRVPPTRPRVCVTLGMTARTSEFPNAVPVDLVLKAVEGLDIEVVATLDAEERALLTHVPDNVRLVDHVPLHALLPTCAAIVHHGGAGTWSTALVEGVPQIAMGWIWDAIDRAQRQQALGAGLHLPSHEVTVEGLRGRLVRLLDEPSFTAAAARLRAEAESEPTPAQVVPVLERLTAQHRAREPRRPGGTSPCVS,uniprot_search,Q9L4U6,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3C[C@H](O)[C@@H](N)[C@H](C)O3)O2)c(=O)nc1O,0.4072,25.0,7.5,2.4.1.326,33899.0,-0.3901922306712976,-0.3901922306712976,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3C[C@H](O)[C@@H](N)[C@H](C)O3)O2)c(=O)nc1O__MRVLLTSFALDAHFNGSVPLAWALRAAGHEVRVASQPALTASITAAGLTAVPVGADPRLDEMVKGVGDAVLSHHADQSLDADTPGQLTPAFLQGWDTMMTATFYTLINDDPMVDDLVAFARGWEPDLILWEPFTFAGAVAAKVTGAAHARLLSFPDLFMSMRRAYLAQLGAAPAGPAGGNGTTHPDDSLGQWLEWTLGRYGVPFDEEAVTGQWSVDQVPRSFRPPSDRPVVGMRYVPYNGPGPAVVPDWLRVPPTRPRVCVTLGMTARTSEFPNAVPVDLVLKAVEGLDIEVVATLDAEERALLTHVPDNVRLVDHVPLHALLPTCAAIVHHGGAGTWSTALVEGVPQIAMGWIWDAIDRAQRQQALGAGLHLPSHEVTVEGLRGRLVRLLDEPSFTAAAARLRAEAESEPTPAQVVPVLERLTAQHRAREPRRPGGTSPCVS,./data/raw/alphafold//AF-Q9L4U6-F1-model_v4.pdb,146,2896,3590,4165 +823,10440,10595,MLELLYTALLYLIQPLIWIRLWVRGRKAPAYRKRWGERYGFYRHPLKPGGIMLHSVSVGETLAAIPLVRALRHRYPDLPITVTTMTPTGSERVQSAFGKDVQHVYLPYDLPDALNRFLNKVDPKLVLIMETELWPNLIAALHKRKIPLVIANARLSARSAAGYAKLGKFVRRLLRRITLIAAQNEEDGARFVALGAKNNQVTVTGSLKFDISVTPQLAAKAVTLRRQWAPHRPVWIATSTHEGEESVVIAAHQALLQQFPNLLLILVPRHPERFPDAINLVRQAGLSYITRSSGEVPSTSTQVVVGDTMGELMLLYGIADLAFVGGSLVERGGHNPLEAAAHAIPVLMGPHTFNFKDICARLEQASGLITVTDATTLAKEVSSLLTDADYRSFYGRHAVEVLYQNQGALQRLLQLLEPYLPPKTH,sabio,P0AC75,CCCCCCCCCCCC(O)CC(=O)NC1C(OCC2OC(OP(=O)(O)O)C(NC(=O)CC(O)CCCCCCCCCCC)C(OC(=O)CC(O)CCCCCCCCCCC)C2O)OC(COP(=O)(O)O)C(O)C1OC(=O)CC(O)CCCCCCCCCCC,0.052,30.0,8.0,2.4.99.12;2.4.99.13,562.0,-1.2839966563652008,-1.2839966563652008,CCCCCCCCCCCC(O)CC(=O)NC1C(OCC2OC(OP(=O)(O)O)C(NC(=O)CC(O)CCCCCCCCCCC)C(OC(=O)CC(O)CCCCCCCCCCC)C2O)OC(COP(=O)(O)O)C(O)C1OC(=O)CC(O)CCCCCCCCCCC__MLELLYTALLYLIQPLIWIRLWVRGRKAPAYRKRWGERYGFYRHPLKPGGIMLHSVSVGETLAAIPLVRALRHRYPDLPITVTTMTPTGSERVQSAFGKDVQHVYLPYDLPDALNRFLNKVDPKLVLIMETELWPNLIAALHKRKIPLVIANARLSARSAAGYAKLGKFVRRLLRRITLIAAQNEEDGARFVALGAKNNQVTVTGSLKFDISVTPQLAAKAVTLRRQWAPHRPVWIATSTHEGEESVVIAAHQALLQQFPNLLLILVPRHPERFPDAINLVRQAGLSYITRSSGEVPSTSTQVVVGDTMGELMLLYGIADLAFVGGSLVERGGHNPLEAAAHAIPVLMGPHTFNFKDICARLEQASGLITVTDATTLAKEVSSLLTDADYRSFYGRHAVEVLYQNQGALQRLLQLLEPYLPPKTH,./data/raw/alphafold//AF-P0AC75-F1-model_v4.pdb,5439,3097,3828,4447 +824,3230,3285,MKGPIKFNALSLQGRSVMSNQSNDTTITQRRDTMNELTEEQKLLMEMVRNLAVREIAPRAIEIDENHSFPVHARDLFADLGLLSPLVPVEYGGTGMDITTFAMVLEEIGKVCASTALMLLAQADGMLSIILDGSPALKEKYLPRFGEKSTLMTAFAATEPGAGSDLLAMKTRAVKKGDKYVINGQKCFITNGSVADILTVWAYTDPSKGAKGMSTFVVERGTPGLIYGHNEKKMGMRGCPNSELFFEDLEVPAENLVGEEGKGFAYLMGALSINRVFCASQAVGIAQGALERAMQHTREREQFGKPIAHLTPIQFMIADMATEVEAARLLVRKATTLLDAKDKRGPLIGGMAKTFASDTAMKVTTDAVQVMGGSGYMQEYQVERMMREAKLTQIYTGTNQITRMVTGRSLLFPS,sabio,Q2LQN9,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)C1=CCCCC1,0.0025,30.0,7.0,1.3.8.10,316277.0,-2.6020599913279625,-2.6020599913279625,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)C1=CCCCC1__MKGPIKFNALSLQGRSVMSNQSNDTTITQRRDTMNELTEEQKLLMEMVRNLAVREIAPRAIEIDENHSFPVHARDLFADLGLLSPLVPVEYGGTGMDITTFAMVLEEIGKVCASTALMLLAQADGMLSIILDGSPALKEKYLPRFGEKSTLMTAFAATEPGAGSDLLAMKTRAVKKGDKYVINGQKCFITNGSVADILTVWAYTDPSKGAKGMSTFVVERGTPGLIYGHNEKKMGMRGCPNSELFFEDLEVPAENLVGEEGKGFAYLMGALSINRVFCASQAVGIAQGALERAMQHTREREQFGKPIAHLTPIQFMIADMATEVEAARLLVRKATTLLDAKDKRGPLIGGMAKTFASDTAMKVTTDAVQVMGGSGYMQEYQVERMMREAKLTQIYTGTNQITRMVTGRSLLFPS,./data/raw/alphafold//AF-Q2LQN9-F1-model_v4.pdb,4870,1599,2342,2284 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+882,16223,16463,MITMAPHQNQFLLFIGVSLVLLSSYATANNSFNRSAFPDDFIFGASAAAYQYEGEANKSGRGPSVWDIFTHEYPEKITDRSNGDEAIDFYHRYKEDIQRMKNMNLDAFRFSISWTRIIPNGQISAGVNQEGIDFYNDLIDELISNGLEPFVTIFHWDSPQGLEDKYTGFLSRSIVKDFQDFAELCYKTFGDRVKYWTTFNEPRAYATRGYDSGLGAPGRCSEWVDRSCEAGNSATEPYIVSHHIILAHAAAVQVYRQKYQASQNGKIGITLNAYWYVPYSNNTVDEEAAQVAFDFFTGWHLDPITYGHYPRTMQALVGDRLPKFTEEEFMVIKGSYDFLGLNYYGAYYAYFNDHPDPNPLHKRYTTDSHVNTTGKRDGKPMGPQGTTSMFNIYPEGIRYLLNYTKDAYRNPTMYITENGYNQDDNGTVPMSILLNDTRRIIYYETHLENVLRSIKEYNVDVKGFIAWSFEDNFEWSSGYTQRFGLYYIDYKNHLERHAKNSTEWFTNFLQKNQSSTISEGSGSRWIRPFGYSIRSAAA,brenda,A0A023MIF8,C[C@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@@H](O)[C@H]1O,0.46,37.0,4.6,3.2.1.21,28504.0,-0.3372421683184259,-0.3148359961102447,C[C@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@@H](O)[C@H]1O__MITMAPHQNQFLLFIGVSLVLLSSYATANNSFNRSAFPDDFIFGASAAAYQYEGEANKSGRGPSVWDIFTHEYPEKITDRSNGDEAIDFYHRYKEDIQRMKNMNLDAFRFSISWTRIIPNGQISAGVNQEGIDFYNDLIDELISNGLEPFVTIFHWDSPQGLEDKYTGFLSRSIVKDFQDFAELCYKTFGDRVKYWTTFNEPRAYATRGYDSGLGAPGRCSEWVDRSCEAGNSATEPYIVSHHIILAHAAAVQVYRQKYQASQNGKIGITLNAYWYVPYSNNTVDEEAAQVAFDFFTGWHLDPITYGHYPRTMQALVGDRLPKFTEEEFMVIKGSYDFLGLNYYGAYYAYFNDHPDPNPLHKRYTTDSHVNTTGKRDGKPMGPQGTTSMFNIYPEGIRYLLNYTKDAYRNPTMYITENGYNQDDNGTVPMSILLNDTRRIIYYETHLENVLRSIKEYNVDVKGFIAWSFEDNFEWSSGYTQRFGLYYIDYKNHLERHAKNSTEWFTNFLQKNQSSTISEGSGSRWIRPFGYSIRSAAA,./data/raw/alphafold//AF-A0A023MIF8-F1-model_v4.pdb,2627,3989,5378,5722 +883,2616,2661,MPCSTLPIPTFPPPESESDESWVWNQIKAEAHRDAESEPALASYLYSTIISHPSLARSLSFHLANKLCSSTLLSTSLYDLFLNTLSTFPTVLSASVADLIAARHRDPACVGFSHCLLNFKGFLAVQTQRIAHVLWSQSRRPLALALHSRVADVLSVDIHPAARIGKGILLDHATGVVIGETAVIGNNVSILHHVTLGGTGKAGGDRHPKIGDGVLIGAGATILGNIRIGAGAKVGAGSVVLIDVPPRTTAVGNPARLIGGKEKPSVHEDVPGESMDHTSFISEWSDYII,uniprot_search,Q9SDP2,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.092,25.0,8.0,2.3.1.30,4679.0,-1.0362121726544449,-1.0362121726544449,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MPCSTLPIPTFPPPESESDESWVWNQIKAEAHRDAESEPALASYLYSTIISHPSLARSLSFHLANKLCSSTLLSTSLYDLFLNTLSTFPTVLSASVADLIAARHRDPACVGFSHCLLNFKGFLAVQTQRIAHVLWSQSRRPLALALHSRVADVLSVDIHPAARIGKGILLDHATGVVIGETAVIGNNVSILHHVTLGGTGKAGGDRHPKIGDGVLIGAGATILGNIRIGAGAKVGAGSVVLIDVPPRTTAVGNPARLIGGKEKPSVHEDVPGESMDHTSFISEWSDYII,./data/raw/alphafold//AF-Q9SDP2-F1-model_v4.pdb,3707,1328,2078,1980 +884,16335,16576,MQDWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRFGGTSAYSGASIWLPGTQVQERAGLPDSTENARTYLRALLGDAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADIGDLAGKVRPELDQDRTGQDHAPGPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDGRVVGAEVESGGETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALLDQAWFCPGVEQPDGSAAFMVGVRGGLVVDSAGERYLNESLPYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTAPAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFCPPNGGANAALTAIENGPFYAARIVLSDLGTKGGLVTDVNGRVLRADGSAIDGLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK,brenda,Q9RA02,C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO,0.0123,30.0,8.0,1.3.99.4,1833.0,-1.9100948885606024,-1.9100948885606024,C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO__MQDWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRFGGTSAYSGASIWLPGTQVQERAGLPDSTENARTYLRALLGDAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADIGDLAGKVRPELDQDRTGQDHAPGPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDGRVVGAEVESGGETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALLDQAWFCPGVEQPDGSAAFMVGVRGGLVVDSAGERYLNESLPYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTAPAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFCPPNGGANAALTAIENGPFYAARIVLSDLGTKGGLVTDVNGRVLRADGSAIDGLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK,./data/raw/alphafold//AF-Q9RA02-F1-model_v4.pdb,3745,882,1061,1305 +885,4390,4459,MEKERHIRIFDTTLRDGEQSPGVALSLDQKLEIAQALAQLNVDIIEAGFPVSGPMEFEAVRRIATEVKGPIIAALARTHTLDIDQAAKALEKAEKPRIHVFTSASKVHLQYMLRKTEEEVLEMADRMVRYARRYVDDVEFSAQDVMRADWEFVKRLYEVAIEAGATTINIPDTTGYGTPQEYGALIRRIRDEVVRGRDVIISTHTHDDLGMATANALAGVENGAGQIECTINGIGERAGNCALEEVVMALYVRRDWYKAYTRINTREIYRVSRLVERYTGMPVPPNKAIVGDNAFAHESGIHQDGVIKHRATYEIMDAELIGRRPAVLVLGKHSGRAAFKKALEDLGYKDLSEEEVKKLFARFKEIAEKKGPLSAEELQALVESEREPTSHFFQLEHVQFFSGSGLLPTATVKVKTPDGERVATHTGDGPVDAVYKAIQEAIGLRPELELYRVEAITGSTEALGQVTVRLRLGELQAVGVGVSPDIIEASALAFLDAAGKLASGRATRHPPSIEEVHRGV,brenda,Q72JC9,CC(C)C(=O)C(=O)O,0.054,50.0,8.0,2.3.3.13,274.0,-1.2676062401770316,-1.2676062401770316,CC(C)C(=O)C(=O)O__MEKERHIRIFDTTLRDGEQSPGVALSLDQKLEIAQALAQLNVDIIEAGFPVSGPMEFEAVRRIATEVKGPIIAALARTHTLDIDQAAKALEKAEKPRIHVFTSASKVHLQYMLRKTEEEVLEMADRMVRYARRYVDDVEFSAQDVMRADWEFVKRLYEVAIEAGATTINIPDTTGYGTPQEYGALIRRIRDEVVRGRDVIISTHTHDDLGMATANALAGVENGAGQIECTINGIGERAGNCALEEVVMALYVRRDWYKAYTRINTREIYRVSRLVERYTGMPVPPNKAIVGDNAFAHESGIHQDGVIKHRATYEIMDAELIGRRPAVLVLGKHSGRAAFKKALEDLGYKDLSEEEVKKLFARFKEIAEKKGPLSAEELQALVESEREPTSHFFQLEHVQFFSGSGLLPTATVKVKTPDGERVATHTGDGPVDAVYKAIQEAIGLRPELELYRVEAITGSTEALGQVTVRLRLGELQAVGVGVSPDIIEASALAFLDAAGKLASGRATRHPPSIEEVHRGV,./data/raw/alphafold//AF-Q72JC9-F1-model_v4.pdb,3648,1296,2039,1939 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+898,35938,36566,MANLILYGTESSPPVRAVLLTLRALQLDHEFHTLDMQAGDHLKPDMLRKNPQHTVPMLEDGESCIWDSHAIIGYLVNKYAQSDELYPKDPLKRAVVDQRLHFETGVLFHGIFKQLQRALFKENATEVPKDRLAELKDAYALLEQFLAENPYVAGPQLTIADFSIVATVSTLHLSYCPVDATKYPKLSAWLARISALPFYEEDNLRGARLLADKIRSKLPKQFDKLWQKAFEDIKSGAGKQ,sabio,Q4V6J1,O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1,2.44,25.0,6.5,2.5.1.18,7227.0,0.3873898263387294,0.3873898263387294,O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1__MANLILYGTESSPPVRAVLLTLRALQLDHEFHTLDMQAGDHLKPDMLRKNPQHTVPMLEDGESCIWDSHAIIGYLVNKYAQSDELYPKDPLKRAVVDQRLHFETGVLFHGIFKQLQRALFKENATEVPKDRLAELKDAYALLEQFLAENPYVAGPQLTIADFSIVATVSTLHLSYCPVDATKYPKLSAWLARISALPFYEEDNLRGARLLADKIRSKLPKQFDKLWQKAFEDIKSGAGKQ,./data/raw/alphafold//AF-Q4V6J1-F1-model_v4.pdb,4680,5811,7518,8462 +899,36445,37078,MMIGKLKYLMLGGCLILGSCLALGGCLMLLGACSSSSLVSPRERSDFNADWRFHLGDGLQAAQPGFADNDWRVLDLPHDWAIEGDFSQENPSGTGGGALPGGVGWYRKTFSVDKADAGKIFRIEFDGVYMNSEVFINGVSLGVRPYGYISFSYDLTPYLKWDEPNVLAVRVDNAEQPNSRWYSGCGIYRNVWLSKTGPIHVGGWGTYVTTSSVDEKQAVLNLATTLVNESDTNENVTVCSSLQDAEGREVAETRSSGEAEAGKEVVFTQQLTVKQPQLWDIDTPYLYTLVTKVMRNEECMDRYTTPVGIRTFSLDARKGFTLNGRQTKINGVCMHHDLGCLGAAVNTRAIERHLQILKEMGCNGIRCSHNPPAPELLDLCDRMGFIVMDEAFDMWRKKKTAHDYARYFNEWHERDLNDFILRDRNHPSVFMWSIGNEVLEQWSDAKADTLSLEEANLILNFGHSSEMLAKEGEESVNSLLTKKLVSFVKGLDPTRPVTAGCNEPNSGNHLFRSGVLDVIGYNYHNKDIPNVPANFPDKPFIITESNSALMTRGYYRMPSDRMFIWPKRWDKSFADSTFACSSYENCHVPWGNTHEESLKLVRDNDFISGQYVWTGFDYIGEPTPYGWPARSSYFGIVDLAGFPKDVYYLYQSEWTDKQVLHLFPHWNWTPGQEIDMWCYYNQADEVELFVNGKSQGVKRKDLDNLHVAWRVKFEPGTVKVIARESGKVVAEKEICTAGKPAEIRLTPDRSILTADGKDLCFVTVEVLDEKGNLCPDADNLVNFTVQGNGFIAGVDNGNPVSMERFKDEKRKAFYGKCLVVIQNDGKPGKAKLTATSEGLRQAVLKISAEEL,sabio,A7LXS9,O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1,0.087,37.0,6.0,3.2.1.23,28116.0,-1.0604807473813815,-1.0604807473813815,O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1__MMIGKLKYLMLGGCLILGSCLALGGCLMLLGACSSSSLVSPRERSDFNADWRFHLGDGLQAAQPGFADNDWRVLDLPHDWAIEGDFSQENPSGTGGGALPGGVGWYRKTFSVDKADAGKIFRIEFDGVYMNSEVFINGVSLGVRPYGYISFSYDLTPYLKWDEPNVLAVRVDNAEQPNSRWYSGCGIYRNVWLSKTGPIHVGGWGTYVTTSSVDEKQAVLNLATTLVNESDTNENVTVCSSLQDAEGREVAETRSSGEAEAGKEVVFTQQLTVKQPQLWDIDTPYLYTLVTKVMRNEECMDRYTTPVGIRTFSLDARKGFTLNGRQTKINGVCMHHDLGCLGAAVNTRAIERHLQILKEMGCNGIRCSHNPPAPELLDLCDRMGFIVMDEAFDMWRKKKTAHDYARYFNEWHERDLNDFILRDRNHPSVFMWSIGNEVLEQWSDAKADTLSLEEANLILNFGHSSEMLAKEGEESVNSLLTKKLVSFVKGLDPTRPVTAGCNEPNSGNHLFRSGVLDVIGYNYHNKDIPNVPANFPDKPFIITESNSALMTRGYYRMPSDRMFIWPKRWDKSFADSTFACSSYENCHVPWGNTHEESLKLVRDNDFISGQYVWTGFDYIGEPTPYGWPARSSYFGIVDLAGFPKDVYYLYQSEWTDKQVLHLFPHWNWTPGQEIDMWCYYNQADEVELFVNGKSQGVKRKDLDNLHVAWRVKFEPGTVKVIARESGKVVAEKEICTAGKPAEIRLTPDRSILTADGKDLCFVTVEVLDEKGNLCPDADNLVNFTVQGNGFIAGVDNGNPVSMERFKDEKRKAFYGKCLVVIQNDGKPGKAKLTATSEGLRQAVLKISAEEL,./data/raw/alphafold//AF-A7LXS9-F1-model_v4.pdb,2474,8090,9960,11141 +900,22214,22561,MGAQLSTLGHVVLSPVWFLYSLIMKLFQRSTPAITLENPDIKYPLRLIDKEVISHDTRRFRFALPSPEHILGLPVGQHIYLSARIDGNLVIRPYTPVSSDDDKGFVDLVIKVYFKDTHPKFPAGGKMSQYLESMKIGDTIEFRGPNGLLVYQGKGKFAIRPDKKSDPVIKTVKSVGMIAGGTGITPMLQVIRAIMKDPDDHTVCHLLFANQTEKDILLRPELEELRNEHSARFKLWYTVDKAPEAWDYSQGFVNEEMIRDHLPPPEEEPLVLMCGPPPMIQYACLPNLDRVGHPKERCFAF,sabio,P07514,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,0.00086,25.0,7.0,1.6.2.2,9913.0,-3.065501548756432,-3.036941653945929,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1__MGAQLSTLGHVVLSPVWFLYSLIMKLFQRSTPAITLENPDIKYPLRLIDKEVISHDTRRFRFALPSPEHILGLPVGQHIYLSARIDGNLVIRPYTPVSSDDDKGFVDLVIKVYFKDTHPKFPAGGKMSQYLESMKIGDTIEFRGPNGLLVYQGKGKFAIRPDKKSDPVIKTVKSVGMIAGGTGITPMLQVIRAIMKDPDDHTVCHLLFANQTEKDILLRPELEELRNEHSARFKLWYTVDKAPEAWDYSQGFVNEEMIRDHLPPPEEEPLVLMCGPPPMIQYACLPNLDRVGHPKERCFAF,./data/raw/alphafold//AF-P07514-F1-model_v4.pdb,3283,646,760,7761 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+902,24478,24865,MAADGTGVVGGGAVGGPLSKDGLLDAKCPEPIPNRRRSSSLSRDAQRRAYQWCREYLGGAWRRARPEELSVCPVSGGLSNLLFRCSLPNHVPSMGGEPREVLLRLYGAILQGVDSLVLESVMFAILAERSLGPQLYGVFPEGRLEQYLPSRPLKTQELRDPVLSGAIATKMARFHGMEMPFTKEPRWLFGTMERYLKQIQDLPSTSLPQMNLVEMYSLKDEMNHLRTLLDATPSPVVFCHNDIQEGNILLLSEPDSDDNLMLVDFEYSSYNYRGFDIGNHFCEWVYDYTYEEWPFYKARPADYPTREQQLLFIRHYLAEVQKGEVLSEEEQKKQEEDLLIEISRYALASHFFWGLWSTLQASMSTIEFGYLEYAQSRFQFYFQQKGQLTSFLSP,sabio,O54783,NCCO,0.1,37.0,8.5,2.7.1.82,10116.0,-1.0,-1.0,NCCO__MAADGTGVVGGGAVGGPLSKDGLLDAKCPEPIPNRRRSSSLSRDAQRRAYQWCREYLGGAWRRARPEELSVCPVSGGLSNLLFRCSLPNHVPSMGGEPREVLLRLYGAILQGVDSLVLESVMFAILAERSLGPQLYGVFPEGRLEQYLPSRPLKTQELRDPVLSGAIATKMARFHGMEMPFTKEPRWLFGTMERYLKQIQDLPSTSLPQMNLVEMYSLKDEMNHLRTLLDATPSPVVFCHNDIQEGNILLLSEPDSDDNLMLVDFEYSSYNYRGFDIGNHFCEWVYDYTYEEWPFYKARPADYPTREQQLLFIRHYLAEVQKGEVLSEEEQKKQEEDLLIEISRYALASHFFWGLWSTLQASMSTIEFGYLEYAQSRFQFYFQQKGQLTSFLSP,./data/raw/alphafold//AF-O54783-F1-model_v4.pdb,4819,6044,7817,8217 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+904,40284,41017,MNRQQIDALVKQMNVDTAKGPVDERIQQVVVRLLGDLFQAIEDLDIQPSEVWKGLEYLTDAGQANELGLLAAGLGLEHYLDLRADEADAKAGITGGTPRTIEGPLYVAGAPESVGFARMDDGSESDKVDTLIIEGTVTDTEGNIIEGAKVEVWHANSLGNYSFFDKSQSDFNLRRTILTDVNGKYVALTTMPVGYGCPPEGTTQALLNKLGRHGNRPSHVHYFVSAPGYRKLTTQFNIEGDEYLWDDFAFATRDGLVATATDVTDEAEIARRELDKPFKHITFNVELVKEAEAAPSSEVERRRASA,brenda,Q9F103,Oc1ccc(Cl)cc1O,0.00198,36.3,8.51,1.13.11.1,40216.0,-2.703334809738469,-2.703334809738469,Oc1ccc(Cl)cc1O__MNRQQIDALVKQMNVDTAKGPVDERIQQVVVRLLGDLFQAIEDLDIQPSEVWKGLEYLTDAGQANELGLLAAGLGLEHYLDLRADEADAKAGITGGTPRTIEGPLYVAGAPESVGFARMDDGSESDKVDTLIIEGTVTDTEGNIIEGAKVEVWHANSLGNYSFFDKSQSDFNLRRTILTDVNGKYVALTTMPVGYGCPPEGTTQALLNKLGRHGNRPSHVHYFVSAPGYRKLTTQFNIEGDEYLWDDFAFATRDGLVATATDVTDEAEIARRELDKPFKHITFNVELVKEAEAAPSSEVERRRASA,./data/raw/alphafold//AF-Q9F103-F1-model_v4.pdb,915,4338,5785,6200 +905,40318,41051,MACTGWTSPLPLCVCLLLTCGFAEAGKLLVVPMDGSHWFTMRSVVEKLILRGHEVVVVMPEVSWQLGRSLNCTVKTYSTSYTLEDLDREFKAFAHAQWKAQVRSIYSLLMGSYNDIFDLFFSNCRSLFKDKKLVEYLKESSFDAVFLDPFDNCGLIVAKYFSLPSVVFARGILCHYLEEGAQCPAPLSYVPRILLGFSDAMTFKERVRNHIMHLEEHLLCHRFFKNALEIASEILQTPVTEYDLYSHTSIWLLRTDFVLDYPKPVMPNMIFIGGINCHQGKPLPMEFEAYINASGEHGIVVFSLGSMVSEIPEKKAMAIADALGKIPQTVLWRYTGTRPSNLANNTILVKWLPQNDLLGHPMTRAFITHAGSHGVYESICNGVPMVMMPLFGDQMDNAKRMETKGAGVTLNVLEMTSEDLENALKAVINDKSYKENIMRLSSLHKDRPVEPLDLAVFWVEFVMRHKGAPHLRPAAHDLTWYQYHSLDVIGFLLAVVLTVAFITFKCCAYGYRKCLGKKGRVKKAHKSKTH,brenda,O60656,Oc1ccc2cc3ccc4cccc5ccc(c2c1)c3c45,0.125,37.0,7.5,2.4.1.17,9606.0,-0.9030899869919436,-0.9030899869919436,Oc1ccc2cc3ccc4cccc5ccc(c2c1)c3c45__MACTGWTSPLPLCVCLLLTCGFAEAGKLLVVPMDGSHWFTMRSVVEKLILRGHEVVVVMPEVSWQLGRSLNCTVKTYSTSYTLEDLDREFKAFAHAQWKAQVRSIYSLLMGSYNDIFDLFFSNCRSLFKDKKLVEYLKESSFDAVFLDPFDNCGLIVAKYFSLPSVVFARGILCHYLEEGAQCPAPLSYVPRILLGFSDAMTFKERVRNHIMHLEEHLLCHRFFKNALEIASEILQTPVTEYDLYSHTSIWLLRTDFVLDYPKPVMPNMIFIGGINCHQGKPLPMEFEAYINASGEHGIVVFSLGSMVSEIPEKKAMAIADALGKIPQTVLWRYTGTRPSNLANNTILVKWLPQNDLLGHPMTRAFITHAGSHGVYESICNGVPMVMMPLFGDQMDNAKRMETKGAGVTLNVLEMTSEDLENALKAVINDKSYKENIMRLSSLHKDRPVEPLDLAVFWVEFVMRHKGAPHLRPAAHDLTWYQYHSLDVIGFLLAVVLTVAFITFKCCAYGYRKCLGKKGRVKKAHKSKTH,./data/raw/alphafold//AF-O60656-F1-model_v4.pdb,681,535,1055,1298 +906,7164,7295,MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMLSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVKYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDHWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,sabio,Q6GWS9,CC1(C)SC2C(NC(=O)C(N)c3ccc(O)cc3)C(=O)N2C1C(=O)O,0.015,,,3.5.2.6,562.0,-1.8239087409443189,-1.8239087409443189,CC1(C)SC2C(NC(=O)C(N)c3ccc(O)cc3)C(=O)N2C1C(=O)O__MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMLSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVKYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDHWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,./data/raw/alphafold//AF-Q6GWS9-F1-model_v4.pdb,5,1145,1851,1715 +907,29688,30215,MGFADQRFNVNLSILFTELPLLERPAAAAAAGFTAVELWWPWIDSPTPEQSELDALKSAIEDAGVQLTGLNFYAGQLPGPDRGALSIPGEESERFRANIDVAADFARSLGCTALNALYGNRVEGVDPAEQDRLALENLVLAARAADRIGAVLLVEALNKPESPRYPLVSAPAAIAVVDRVNEATGLGNAKFLMDLYHLSMNGEDLPQVIDAYAAKTGHVQIADNPGRGAPGTGSLPLEDLLDRLAKAGYDGWVGLEYKPGDDPSAQSFSWLPAGARAAR,brenda,Q9Z596,O=C(O)C(=O)CO,55.0,30.0,7.0,5.3.1.22,1902.0,1.740362689494244,1.740362689494244,O=C(O)C(=O)CO__MGFADQRFNVNLSILFTELPLLERPAAAAAAGFTAVELWWPWIDSPTPEQSELDALKSAIEDAGVQLTGLNFYAGQLPGPDRGALSIPGEESERFRANIDVAADFARSLGCTALNALYGNRVEGVDPAEQDRLALENLVLAARAADRIGAVLLVEALNKPESPRYPLVSAPAAIAVVDRVNEATGLGNAKFLMDLYHLSMNGEDLPQVIDAYAAKTGHVQIADNPGRGAPGTGSLPLEDLLDRLAKAGYDGWVGLEYKPGDDPSAQSFSWLPAGARAAR,./data/raw/alphafold//AF-Q9Z596-F1-model_v4.pdb,1729,7121,9005,9281 +908,40405,41138,MACLLRSFQRISAGVFFLALWGMVVGDKLLVVPQDGSHWLSMKDIVEVLSDRGHEIVVVVPEVNLLLKESKYYTRKIYPVPYDQEELKNRYQSFGNNHFAERSFLTAPQTEYRNNMIVIGLYFINCQSLLQDRDTLNFFKESKFDALFTDPALPCGVILAEYLGLPSVYLFRGFPCSLEHTFSRSPDPVSYIPRCYTKFSDHMTFSQRVANFLVNLLEPYLFYCLFSKYEELASAVLKRDVDIITLYQKVSVWLLRYDFVLEYPRPVMPNMVFIGGINCKKRKDLSQEFEAYINASGEHGIVVFSLGSMVSEIPEKKAMAIADALGKIPQTVLWRYTGTRPSNLANNTILVKWLPQNDLLGHPMTRAFITHAGSHGVYESICNGVPMVMMPLFGDQMDNAKRMETKGAGVTLNVLEMTSEDLENALKAVINDKSYKENIMRLSSLHKDRPVEPLDLAVFWVEFVMRHKGAPHLRPAAHDLTWYQYHSLDVIGFLLAVVLTVAFITFKCCAYGYRKCLGKKGRVKKAHKSKTH,sabio,P19224,Oc1cccc2ccccc12,0.0027,37.0,7.4,2.4.1.17,9606.0,-2.5686362358410126,-2.5686362358410126,Oc1cccc2ccccc12__MACLLRSFQRISAGVFFLALWGMVVGDKLLVVPQDGSHWLSMKDIVEVLSDRGHEIVVVVPEVNLLLKESKYYTRKIYPVPYDQEELKNRYQSFGNNHFAERSFLTAPQTEYRNNMIVIGLYFINCQSLLQDRDTLNFFKESKFDALFTDPALPCGVILAEYLGLPSVYLFRGFPCSLEHTFSRSPDPVSYIPRCYTKFSDHMTFSQRVANFLVNLLEPYLFYCLFSKYEELASAVLKRDVDIITLYQKVSVWLLRYDFVLEYPRPVMPNMVFIGGINCKKRKDLSQEFEAYINASGEHGIVVFSLGSMVSEIPEKKAMAIADALGKIPQTVLWRYTGTRPSNLANNTILVKWLPQNDLLGHPMTRAFITHAGSHGVYESICNGVPMVMMPLFGDQMDNAKRMETKGAGVTLNVLEMTSEDLENALKAVINDKSYKENIMRLSSLHKDRPVEPLDLAVFWVEFVMRHKGAPHLRPAAHDLTWYQYHSLDVIGFLLAVVLTVAFITFKCCAYGYRKCLGKKGRVKKAHKSKTH,./data/raw/alphafold//AF-P19224-F1-model_v4.pdb,681,535,2897,3344 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+910,696,715,MLREQLPYPKHEKVIHGKRLAYVDEGEGDPIVFLHGNPTSSFLWRNVMPELAGQGRLIAPDLIGQGDSEKLPAGEGANAYGFDTAYHYLEGLLEALGCHHQVTLVVHDWGSALGFHWARCHPDAVKGIAYMEAIVMPVTWEDWPESARGIFKGFRSDKGEDLILNRNLFVEAVLPGSVIRDLSEAEMAEYRRPFQKAEDRQPTLNWPRDIPIDGEPAEMVRVVRDYADWLAASPLPKLFVNADPGSILIGRQREFCRTWPNQTEVTVRGNHFLQEDSPVEIGQAVARWLEALSNS,brenda,K0CAI2,C=C(Cl)CCl,15.06,37.0,8.6,3.8.1.5,285091.0,1.1778249718646818,1.1778249718646818,C=C(Cl)CCl__MLREQLPYPKHEKVIHGKRLAYVDEGEGDPIVFLHGNPTSSFLWRNVMPELAGQGRLIAPDLIGQGDSEKLPAGEGANAYGFDTAYHYLEGLLEALGCHHQVTLVVHDWGSALGFHWARCHPDAVKGIAYMEAIVMPVTWEDWPESARGIFKGFRSDKGEDLILNRNLFVEAVLPGSVIRDLSEAEMAEYRRPFQKAEDRQPTLNWPRDIPIDGEPAEMVRVVRDYADWLAASPLPKLFVNADPGSILIGRQREFCRTWPNQTEVTVRGNHFLQEDSPVEIGQAVARWLEALSNS,./data/raw/alphafold//AF-K0CAI2-F1-model_v4.pdb,3892,190,208,230 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+998,10915,11071,MATLFIADLHLCVEEPAITAGFLRFLAGEARKADALYILGDLFEAWIGDDDPNPLHRKMAAAIKAVSDSGVPCYFIHGNRDFLLGKRFARESGMTLLPEEKVLELYGRRVLIMHGDTLCTDDAGYQAFRAKVHKPWLQTLFLALPLFVRKRIAARMRANSKEANSSKSLAIMDVNQNAVVSAMEKHQVQWLIHGHTHRPAVHELIANQQPAFRVVLGAWHTEGSMVKVTADDVELIHFPF,brenda,P43341,CCCCCCCCCCC[C@@H](O)CC(=O)O[C@H]1[C@H](O)[C@@H](CO)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)[C@@H]1N=C(O)C[C@H](O)CCCCCCCCCCC,0.0617,30.0,8.0,3.6.1.54,562.0,-1.2097148359667584,-1.2097148359667584,CCCCCCCCCCC[C@@H](O)CC(=O)O[C@H]1[C@H](O)[C@@H](CO)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)[C@@H]1N=C(O)C[C@H](O)CCCCCCCCCCC__MATLFIADLHLCVEEPAITAGFLRFLAGEARKADALYILGDLFEAWIGDDDPNPLHRKMAAAIKAVSDSGVPCYFIHGNRDFLLGKRFARESGMTLLPEEKVLELYGRRVLIMHGDTLCTDDAGYQAFRAKVHKPWLQTLFLALPLFVRKRIAARMRANSKEANSSKSLAIMDVNQNAVVSAMEKHQVQWLIHGHTHRPAVHELIANQQPAFRVVLGAWHTEGSMVKVTADDVELIHFPF,./data/raw/alphafold//AF-P43341-F1-model_v4.pdb,5397,3175,3916,4560 +999,13638,13835,MGSLASERTVVGWAARDAAGHLSPYTYTVRNTGPEDVVVKVLYCGICHTDIHQAKNHLGASKYPMVPGHEVVGEVVEVGPEVSKHRVGDVVGVGVIVGCCRECRPCKANVEQYCNKRIWSYNDVYTDGRPTQGGFASTMVVDQKFVVPIPAGLAPEQAAPLLCAGVTVYSPLKHFGLTAPGLRGGILGLGGVGHMGVKVAKALGHHVTVISSSSRKRAEAMDDLGADAYLVSSDAGAMAAAADSLDYIIDTVPVHHPLEPYLALLRLDGKHVLLGVVGEPLSFVSPMVMLGRKSVTGSFIGSVDETAELLRFCVDKGLTSQIEVVKMGYVNEALERLERNDVRYRFVVDVAGSNIEEQAAAAGAPAN,brenda,E2DIF4,COc1cc(/C=C/C=O)ccc1O,0.0109,30.0,7.5,1.1.1.195,38727.0,-1.9625735020593764,-1.9625735020593764,COc1cc(/C=C/C=O)ccc1O__MGSLASERTVVGWAARDAAGHLSPYTYTVRNTGPEDVVVKVLYCGICHTDIHQAKNHLGASKYPMVPGHEVVGEVVEVGPEVSKHRVGDVVGVGVIVGCCRECRPCKANVEQYCNKRIWSYNDVYTDGRPTQGGFASTMVVDQKFVVPIPAGLAPEQAAPLLCAGVTVYSPLKHFGLTAPGLRGGILGLGGVGHMGVKVAKALGHHVTVISSSSRKRAEAMDDLGADAYLVSSDAGAMAAAADSLDYIIDTVPVHHPLEPYLALLRLDGKHVLLGVVGEPLSFVSPMVMLGRKSVTGSFIGSVDETAELLRFCVDKGLTSQIEVVKMGYVNEALERLERNDVRYRFVVDVAGSNIEEQAAAAGAPAN,./data/raw/alphafold//AF-E2DIF4-F1-model_v4.pdb,143,3528,4816,5094 +1000,28896,29415,MQQQTGGRRRQIRRVVVATSNAGKVRELQGALAPLGWQCEGLGAVTLPEETGSTYEENAALKACAAAMATGLPALADDSGIEVLALGGQPGVYSARFGNVNSDVERNVLLLEKMRRHTDRRAKFVSVLVLAYPDGKLEEYRGEVTGQLLEGPRGESGFGYDPLFLPDGSELSMGEMTLEQKQAISHRGQALAALLAAHGA,brenda,Q9RXX6,Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O1,0.062,37.0,9.0,3.6.1.15,1299.0,-1.207608310501746,-1.207608310501746,Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O1__MQQQTGGRRRQIRRVVVATSNAGKVRELQGALAPLGWQCEGLGAVTLPEETGSTYEENAALKACAAAMATGLPALADDSGIEVLALGGQPGVYSARFGNVNSDVERNVLLLEKMRRHTDRRAKFVSVLVLAYPDGKLEEYRGEVTGQLLEGPRGESGFGYDPLFLPDGSELSMGEMTLEQKQAISHRGQALAALLAAHGA,./data/raw/alphafold//AF-Q9RXX6-F1-model_v4.pdb,977,4421,5881,3249 +1001,21375,21701,MLTQKTKDIVKATAPVLAEHGYDIIKCFYQRMFEAHPELKNVFNMAHQEQGQQQQALARAVYAYAENIEDPNSLMAVLKNIANKHASLGVKPEQYPIVGEHLLAAIKEVLGNAATDDIISAWAQAYGNLADVLMGMESELYERSAEQPGGWKGWRTFVIREKRPESDVITSFILEPADGGPVVNFEPGQYTSVAIDVPALGLQQIRQYSLSDMPNGRSYRISVKREGGGPQPPGYVSNLLHDHVNVGDQVKLAAPYGSFHIDVDAKTPIVLISGGVGLTPMVSMLKVALQAPPRQVVFVHGARNSAVHAMRDRLREAAKTYENLDLFVFYDQPLPEDVQGRDYDYPGLVDVKQIEKSILLPDADYYICGPIPFMRMQHDALKNLGIHEARIHYEVFGPDLFAE,sabio,P39662,N=O,0.0001,37.0,7.8,1.14.12.17,106590.0,-4.0,-4.0,N=O__MLTQKTKDIVKATAPVLAEHGYDIIKCFYQRMFEAHPELKNVFNMAHQEQGQQQQALARAVYAYAENIEDPNSLMAVLKNIANKHASLGVKPEQYPIVGEHLLAAIKEVLGNAATDDIISAWAQAYGNLADVLMGMESELYERSAEQPGGWKGWRTFVIREKRPESDVITSFILEPADGGPVVNFEPGQYTSVAIDVPALGLQQIRQYSLSDMPNGRSYRISVKREGGGPQPPGYVSNLLHDHVNVGDQVKLAAPYGSFHIDVDAKTPIVLISGGVGLTPMVSMLKVALQAPPRQVVFVHGARNSAVHAMRDRLREAAKTYENLDLFVFYDQPLPEDVQGRDYDYPGLVDVKQIEKSILLPDADYYICGPIPFMRMQHDALKNLGIHEARIHYEVFGPDLFAE,./data/raw/alphafold//AF-P39662-F1-model_v4.pdb,3784,5394,6091,7430 +1002,16980,17225,MAAVTGLYGSIDEFLNHCSQSGDSAYSALRSLLERLEKPDTRTEARIFLAHLQKKLDNDGASQRCLETYHFQIQDIYLDRNEGTGYQNRKKFTMMVIPSIFMPEDWSFTFYEGINRHPDSIFKDKTVAELGCGNGWISIAIAEKWLPLKVYGLDINPRAVKISWINLYLNAFDEDGQPVYDSESKTLLDRVEFYESDLLSYCRDNHIELERIVGCIPQILNPNPDAMSKLVTENASEEFLHSLSNYCALQGFVEDQFGLGLIARAVEEGIDVIKPMGIMIFNMGGRPGQGVCKRLFERRGLSVNKLWQTKILQASDTDISALVEIEKNNPHRFEFFMGLVGDRPICARTAWAFGKACGRISHALSVYSCQLRHPNEVKKIFEFLKNGFHDISNSLDLSFEDDSVADEKIPFLAYLAGVLKDGSRFPYEPPTGNKRFRDLIASFMKTYHHVPLSTDNVAIFPSRATAIENSLRLFTPRLAIVEEHLTCNLPRQWLTSLEIEQTRDSKTPIDGITVIEAPRQSDLMIELIKKLKPQVVVTGIAQFEAVTSSAFEHLLRVTREIGSRLFIDISDQFELSSLPSSIGVLKYLARTPLPSHAAIICGLLRNRVYTDLEVAFVISEEQTIFDALTRTVELLQGNTALISQYYYGCLFHELLSFQIPDRRQTAEREAENVEASDIDMIGFSSSAISVLSQSELSVRVTEKSSLLHMDVDQIFLPTPTPVKAAIFESFARQNVTETECDVTPILRQFILNTWNFSVEHSAEFIYADFPLALFNKLVLCCIEEGGSLCMPAGSNGNYAAAAKFLNANIMSIPTEAEVGFKLTAKQLSSVLETVHKPWVYISGPTINPTGLLYSNEEMKSLLTVCARYGARTIIDTSFSGIKFNSQDWDGWNLDASLAGLTGNPSFSVCLLGGLFFKIPTGGLSYGFLVLKSGFLADSFRSSFSGLNKPHNTVRYTAKKLLELGEQKGNLTGAAQGQEKLLATRLKRLKETLENCGWEVIEARGGVSVIAKPSAYLGKNIKLEKDGSTWVTKLDGTNIREAMLRATGLCINGPSWTGIPDYCRFTFALEDGDFDRALDCIVKFNQLVK,uniprot_search,Q9SWR3,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,0.034,,7.2,2.1.1.12,101473.0,-1.4685210829577449,-1.4685210829577449,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MAAVTGLYGSIDEFLNHCSQSGDSAYSALRSLLERLEKPDTRTEARIFLAHLQKKLDNDGASQRCLETYHFQIQDIYLDRNEGTGYQNRKKFTMMVIPSIFMPEDWSFTFYEGINRHPDSIFKDKTVAELGCGNGWISIAIAEKWLPLKVYGLDINPRAVKISWINLYLNAFDEDGQPVYDSESKTLLDRVEFYESDLLSYCRDNHIELERIVGCIPQILNPNPDAMSKLVTENASEEFLHSLSNYCALQGFVEDQFGLGLIARAVEEGIDVIKPMGIMIFNMGGRPGQGVCKRLFERRGLSVNKLWQTKILQASDTDISALVEIEKNNPHRFEFFMGLVGDRPICARTAWAFGKACGRISHALSVYSCQLRHPNEVKKIFEFLKNGFHDISNSLDLSFEDDSVADEKIPFLAYLAGVLKDGSRFPYEPPTGNKRFRDLIASFMKTYHHVPLSTDNVAIFPSRATAIENSLRLFTPRLAIVEEHLTCNLPRQWLTSLEIEQTRDSKTPIDGITVIEAPRQSDLMIELIKKLKPQVVVTGIAQFEAVTSSAFEHLLRVTREIGSRLFIDISDQFELSSLPSSIGVLKYLARTPLPSHAAIICGLLRNRVYTDLEVAFVISEEQTIFDALTRTVELLQGNTALISQYYYGCLFHELLSFQIPDRRQTAEREAENVEASDIDMIGFSSSAISVLSQSELSVRVTEKSSLLHMDVDQIFLPTPTPVKAAIFESFARQNVTETECDVTPILRQFILNTWNFSVEHSAEFIYADFPLALFNKLVLCCIEEGGSLCMPAGSNGNYAAAAKFLNANIMSIPTEAEVGFKLTAKQLSSVLETVHKPWVYISGPTINPTGLLYSNEEMKSLLTVCARYGARTIIDTSFSGIKFNSQDWDGWNLDASLAGLTGNPSFSVCLLGGLFFKIPTGGLSYGFLVLKSGFLADSFRSSFSGLNKPHNTVRYTAKKLLELGEQKGNLTGAAQGQEKLLATRLKRLKETLENCGWEVIEARGGVSVIAKPSAYLGKNIKLEKDGSTWVTKLDGTNIREAMLRATGLCINGPSWTGIPDYCRFTFALEDGDFDRALDCIVKFNQLVK,./data/raw/alphafold//AF-Q9SWR3-F1-model_v4.pdb,424,3646,4977,5289 +1003,37006,37658,MKRIGVLTSGGDSPGMNAAIRSVVRKAIYHGVEVYGVYHGYAGLIAGNIKKLEVGDVGDIIHRGGTILYTARCPEFKTEEGQKKGIEQLKKHGIEGLVVIGGDGSYQGAKKLTEHGFPCVGVPGTIDNDIPGTDFTIGFDTALNTVIDAIDKIRDTATSHERTYVIEVMGRHAGDIALWSGLAGGAETILIPEADYDMNDVIARLKRGHERGKKHSIIIVAEGVGSGVDFGRQIQEATGFETRVTVLGHVQRGGSPTAFDRVLASRLGARAVELLLEGKGGRCVGIQNNQLVDHDIAEALANKHTIDQRMYALSKELSI,sabio,P00512,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,2.8,30.0,8.2,2.7.1.11,1422.0,0.4471580313422192,0.4471580313422192,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1__MKRIGVLTSGGDSPGMNAAIRSVVRKAIYHGVEVYGVYHGYAGLIAGNIKKLEVGDVGDIIHRGGTILYTARCPEFKTEEGQKKGIEQLKKHGIEGLVVIGGDGSYQGAKKLTEHGFPCVGVPGTIDNDIPGTDFTIGFDTALNTVIDAIDKIRDTATSHERTYVIEVMGRHAGDIALWSGLAGGAETILIPEADYDMNDVIARLKRGHERGKKHSIIIVAEGVGSGVDFGRQIQEATGFETRVTVLGHVQRGGSPTAFDRVLASRLGARAVELLLEGKGGRCVGIQNNQLVDHDIAEALANKHTIDQRMYALSKELSI,./data/raw/alphafold//AF-P00512-F1-model_v4.pdb,1327,6563,8279,10282 +1004,20349,20656,MLPVKNLFVLYTGGTIGMLETPRGLAPAGGFETRMRDHLRTLGDAPDLRWRFAELQPPLDSANMSQGNWLAMRDAIVAALDAGHDGVLLLHGTDTLAYSAAALSFLLLDLPVPVLLTGSMLPAGAPGSDAWDNLVGALRVLQAGHARGVQVYFNDALLHGARVSKLRSDAFDAFAELPRPRQAEHAPVPATLGYRQPRREVNLAVLPLYPGLRAAHLRGLLDSGVEALLLECYGSGTGPSDDEELLAALREAHARGVLLAAVSQCAYGAVEFGVYAAGSRLRDAGLVSAGGMTREAALGKLFGLLGAGLGRDDAQRWFALDLCGENAD,brenda,A0A0U3U5E8,N=C(O)C[C@H](N)C(=O)O,63.3,37.0,7.5,3.5.1.1,287.0,1.801403710017355,1.801403710017355,N=C(O)C[C@H](N)C(=O)O__MLPVKNLFVLYTGGTIGMLETPRGLAPAGGFETRMRDHLRTLGDAPDLRWRFAELQPPLDSANMSQGNWLAMRDAIVAALDAGHDGVLLLHGTDTLAYSAAALSFLLLDLPVPVLLTGSMLPAGAPGSDAWDNLVGALRVLQAGHARGVQVYFNDALLHGARVSKLRSDAFDAFAELPRPRQAEHAPVPATLGYRQPRREVNLAVLPLYPGLRAAHLRGLLDSGVEALLLECYGSGTGPSDDEELLAALREAHARGVLLAAVSQCAYGAVEFGVYAAGSRLRDAGLVSAGGMTREAALGKLFGLLGAGLGRDDAQRWFALDLCGENAD,./data/raw/alphafold//AF-A0A0U3U5E8-F1-model_v4.pdb,4209,5107,7013,7018 +1005,1831,1869,EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF,uniprot_search,P81908,CC(=O)CC(=O)OCC[N+](C)(C)C,0.29,38.5,8.45,3.1.1.8,9796.0,-0.5376020021010439,-0.5376020021010439,CC(=O)CC(=O)OCC[N+](C)(C)C__EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF,./data/raw/alphafold//AF-P81908-F1-model_v4.pdb,3726,2948,1110,1367 +1006,13132,13325,MERQVPRVLLNSGHEMPVIGFGTAIDPLPEPEQLVSAILHAIEVGYRHFDTASAYMTEEPVGRAISEAMKRGLIKGREELFVTSKLWCADAHRDLIIPALKETLKRLGLDYLDLYLIHFPVRLKKEAVSLEHEIDDFRFEDHELLPFDIKGTWEAMEECSRLGLTKSIGVSNYGTVKISQLLQHATIPPAVNQVEMNVAWQQKKLREFCSKKGIHVTAWSPLAGIGAFWGSTVVIESKTLKEIAAAKGKSVAQVALRWIQDQGASCIVKSMNKDRMKQNLEIFGWKLSDEDGRKIEQIKQSRLYPAKLFINENSPYPSLEALWDGDL,brenda,E7C196,COC(=O)[C@H]1C(=O)C[C@@H]2CC[C@H]1N2C,0.069,22.0,8.3,1.1.1.334,289672.0,-1.1611509092627446,-1.1611509092627446,COC(=O)[C@H]1C(=O)C[C@@H]2CC[C@H]1N2C__MERQVPRVLLNSGHEMPVIGFGTAIDPLPEPEQLVSAILHAIEVGYRHFDTASAYMTEEPVGRAISEAMKRGLIKGREELFVTSKLWCADAHRDLIIPALKETLKRLGLDYLDLYLIHFPVRLKKEAVSLEHEIDDFRFEDHELLPFDIKGTWEAMEECSRLGLTKSIGVSNYGTVKISQLLQHATIPPAVNQVEMNVAWQQKKLREFCSKKGIHVTAWSPLAGIGAFWGSTVVIESKTLKEIAAAKGKSVAQVALRWIQDQGASCIVKSMNKDRMKQNLEIFGWKLSDEDGRKIEQIKQSRLYPAKLFINENSPYPSLEALWDGDL,./data/raw/alphafold//AF-E7C196-F1-model_v4.pdb,400,3448,4707,4960 +1007,12763,12948,MANIDLHFHSRTSDGALTPTEVIDRAAARAPALLALTDHDCTGGLAEAAAAAARRGIPFLNGVEVSVSWGRHTVHIVGLGIDPAEPALAAGLKSIREGRLERARQMGASLEAAGIAGCFDGAMRWCDNPEMISRTHFARHLVDSGAVKDMRTVFRKYLTPGKPGYVSHQWASLEDAVGWIVGAGGMAVIAHPGRYDMGRTLIERLILDFQAAGGQGIEVASGSHSLDDMHKFALHADRHGLYASSGSDFHAPGEGGRDVGHTEDLPPICRPIWRELEARILRPAD,brenda,Q7NXD4,CNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@H]1O,0.0054,30.0,7.5,3.1.3.7,536.0,-2.2676062401770314,-2.2676062401770314,CNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@H]1O__MANIDLHFHSRTSDGALTPTEVIDRAAARAPALLALTDHDCTGGLAEAAAAAARRGIPFLNGVEVSVSWGRHTVHIVGLGIDPAEPALAAGLKSIREGRLERARQMGASLEAAGIAGCFDGAMRWCDNPEMISRTHFARHLVDSGAVKDMRTVFRKYLTPGKPGYVSHQWASLEDAVGWIVGAGGMAVIAHPGRYDMGRTLIERLILDFQAAGGQGIEVASGSHSLDDMHKFALHADRHGLYASSGSDFHAPGEGGRDVGHTEDLPPICRPIWRELEARILRPAD,./data/raw/alphafold//AF-Q7NXD4-F1-model_v4.pdb,3091,344,391,467 +1008,34891,35503,MPISIPLNATLQYSSPSSSSSSSSLVPSSPLFSPIPSTTVSLTGIRQRCLRMVTSCVSNAQKSVLNGATDSVSVVGREQIRLGLPSKGRMAADSLDLLKDCQLFVKQVNPRQYVAQIPQLPNTEVWFQRPKDIVRKLLSGDLDLGIVGLDIVGEFGQGNEDLIIVHEALNFGDCHLSLAIPNYGIFENIKSLKELAQMPQWTEERPLRVATGFTYLGPKFMKDNGIKHVTFSTADGALEAAPAMGIADAILDLVSSGTTLKENNLKEIEGGVVLESQAALVASRRALTERKGALETVHEILERLEAHLKANGQFTVVANMRGTDAEEVAERVKTQPSLSGLQGPTISPVYCKRDGKVTIEYYAIVICVPKKALYESVQQLRAVGGSGVLVSPVTYIFHEETPRWSQLLSNLGL,sabio,Q8GSJ1,O=P(O)(O)OCC1OC(OP(=O)(O)OP(=O)(O)O)C(O)C1O,0.57,30.0,,2.4.2.17,3702.0,-0.2441251443275086,-0.2441251443275086,O=P(O)(O)OCC1OC(OP(=O)(O)OP(=O)(O)O)C(O)C1O__MPISIPLNATLQYSSPSSSSSSSSLVPSSPLFSPIPSTTVSLTGIRQRCLRMVTSCVSNAQKSVLNGATDSVSVVGREQIRLGLPSKGRMAADSLDLLKDCQLFVKQVNPRQYVAQIPQLPNTEVWFQRPKDIVRKLLSGDLDLGIVGLDIVGEFGQGNEDLIIVHEALNFGDCHLSLAIPNYGIFENIKSLKELAQMPQWTEERPLRVATGFTYLGPKFMKDNGIKHVTFSTADGALEAAPAMGIADAILDLVSSGTTLKENNLKEIEGGVVLESQAALVASRRALTERKGALETVHEILERLEAHLKANGQFTVVANMRGTDAEEVAERVKTQPSLSGLQGPTISPVYCKRDGKVTIEYYAIVICVPKKALYESVQQLRAVGGSGVLVSPVTYIFHEETPRWSQLLSNLGL,./data/raw/alphafold//AF-Q8GSJ1-F1-model_v4.pdb,1537,6841,8682,7975 +1009,36264,36895,MNVASRVVVNADRVKGTINRNIYGHFSEHLGRCIYEGLWVGEDSPIPNTNGIRNDVLEALKQMKIPVLRWPGGCFADEYHWKDGVGPREKRKRMVNTHWGGVIENNHFGTHEFMMLCELLGCEPYISGNVGSGTVQEMSEWVEYITFDGESPMANWRRENGREKPWRIKYWGVGNENWGCGGNMRAEYYADLYRQFQTYLRNYGDNKLHKIACGANTADYHWTEVLMKQAAPFMHGLSLHYYTVPGPWEKKGPATGFTTDEWWVTLKKALFMDRLVTKHSAIMDVYDPDKRIDLIVDEWGTWYDVEPGTNPGFLYQQNSIRDALVAGATLHIFHRHCDRVRMANIAQLVNVLQSVILTEGERMLLTPTYHVFNMFKVHQDAELLDTWESVERTGPEGELPKVSVSASRAADGKIHISLCNLDFETGASVDIELRGLNGGVSATGTTLTSGRIDGHNTFDEPERVKPAPFRDFKLEGGHLNASLPPMSVTVLELTAG,uniprot_search,O69262,O=[N+]([O-])c1ccc(O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)cc1,0.5,75.0,5.966666666666668,3.2.1.55,76633.0,-0.3010299956639812,-0.2218487496163563,O=[N+]([O-])c1ccc(O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)cc1__MNVASRVVVNADRVKGTINRNIYGHFSEHLGRCIYEGLWVGEDSPIPNTNGIRNDVLEALKQMKIPVLRWPGGCFADEYHWKDGVGPREKRKRMVNTHWGGVIENNHFGTHEFMMLCELLGCEPYISGNVGSGTVQEMSEWVEYITFDGESPMANWRRENGREKPWRIKYWGVGNENWGCGGNMRAEYYADLYRQFQTYLRNYGDNKLHKIACGANTADYHWTEVLMKQAAPFMHGLSLHYYTVPGPWEKKGPATGFTTDEWWVTLKKALFMDRLVTKHSAIMDVYDPDKRIDLIVDEWGTWYDVEPGTNPGFLYQQNSIRDALVAGATLHIFHRHCDRVRMANIAQLVNVLQSVILTEGERMLLTPTYHVFNMFKVHQDAELLDTWESVERTGPEGELPKVSVSASRAADGKIHISLCNLDFETGASVDIELRGLNGGVSATGTTLTSGRIDGHNTFDEPERVKPAPFRDFKLEGGHLNASLPPMSVTVLELTAG,./data/raw/alphafold//AF-O69262-F1-model_v4.pdb,2443,8040,9887,11064 +1010,26962,27425,MTSQEKTEEYPFADIFDEDETERNFLLSKPVCFVVFGKPGVGKTTLARYITQAWKCIRVEALPILEEQIAAETESGVMLQSMLISGQSIPDELVIKLMLEKLNSPEVCHFGYIITEIPSLSQDAMTTLQQIELIKNLNLKPDVIINIKCPDYDLCQRISGQRQHNNTGYIYSRDQWDPEVIENHRKKKKEAQKDGKGEEEEEEEEQEEEEAFIAEMQMVAEILHHLVQRPEDYLENVENIVKLYKETILQTLEEVMAEHNPQYLIELNGNKPAEELFMIVMDRLKYLNLKRAAILTKLQGAEEEINDTMENDELFRTLASYKLIAPRYRWQRSKWGRTCPVNLKDGNIYSGLPDYSVSFLGKIYCLSSEEALKPFLLNPRPYLLPPMPGPPCKVFILGPQYSGKTTLCNMLAENYKGKVVDYAQLVQPRFDKARETLVENTIAEATAAAIKVVKEKLLRELQARKQAETALREFQRQYEKMEFGVFPMEATHSSIDEEGYIQGSQRDRGSSLVDTEEAKTKSENVLHDQAAKVDKDDGKETGETFTFKRHSQDASQDVKLYSDTAPTEDLIEEVTADHPEVVTMIEETIKMSQDINFEQPYEKHAEILQEVLGEVMEENKDRFPGAPKYGGWIVDNCPIVKELWMALIKKGIIPDLVIYLSDTENNGKCLFNRIYLQKKSEIDSKILERLLEELQKKKKEEEEARKATEEELRLEEENRRLLELMKVKAKEAEETDNEDEEEIEGDELEVHEEPEASHDTRGSWLPEEFEASEVPETEPEAVSEPIEETTVETEIPKGSKEGLEIEKLSETVVLPEFPEDSYPDVPEMEPFKEKIGSFIILWKQLEATISEAYIKILNLEIADRTPQELLQKVVETMEKPFQYTAWELTGEDYEEETEDYQTEAEVDEELEEEEEEEGEDKMKERKRHLGDTKHFCPVVLKENFILQPGNTEEAAKYREKIYYFSSAEAKEKFLEHPEDYVAHEEPLKAPPLRICLVGPQGSGKTMCGRQLAEKLNIFHIQFEEVLQEKLLLKTEKKVGPEFEEDSENEQAAKQELEELAIQANVKVEEENTKKQLPEVQLTEEEEVIKSSLMENEPLPPEILEVILSEWWLKEPIRSTGFILDGFPRYPEEAQFLGDRGFFPDAAVFIQVDDQDIFDRLLPAQIEKWKLKQKKKLERKKLIKDMKAKIRVDTIAKRRAELILERDKKRRENVVRDDEEISEEELEEDNDDIENILEDEFPKDEEEMSGEEDEEQETDAIERLRGELGEKFEADTHNLQIIQDELERYLIPIISINGARRNHIVQYTLNMKLKPLVENRASIFEKCHPIPAPLAQKMLTFTYKYISSFGYWDPVKLSEGETIKPVENAENPIYPVIHRQYIYFLSSKETKEKFMKNPIKYIRQPKPKPTVPIRIIIVGPPKSGKTTVAKKITSEYGLKHLSIGGALRYVLNNHPETELALMLNWHLHKGMTAPDELAIQALELSLMESVCNTAGVVIDGYPVTKHQMNLLEARSIIPMVIFELSVPSKEIFKRLLLEKENEQRLPYPLHNSAQIVAVNNVKYRKNIGEIRQYYQEQHQNWYVIDGFHSKWWVWNEVIKNVQMVNKYMQTYLERIKAGKAACIDKLCITPQELLSRLGEFEQFCPVSLAESQELFDCSATDSLEFAAEFRGHYYKMSSQEKLNKFLENPELYVPPLAPHPLPSADMIPKRLTLSELKSRFPKCAELQGYCPVTYKDGNQRYEALVPGSINYALEYHNRIYICENKEKLQKFLRSPLKYWEQKLPHKLPPLREPILLTSLPLPGYLEQGIATSLIKAMNAAGCLKPKFPFLSIRRSALLYIALHLKAFNPKGSEYTRKKYKKKMEQFMESCELITYLGAKMTRKYKEPQFRAIDFDHKLKTFLSLRNIDPING,sabio,Q5TCS8,Nc1ncnc2c1ncn2C1CC(O)C(COP(=O)(O)O)O1,3.6,37.0,7.6,2.7.4.4,9606.0,0.5563025007672873,0.5563025007672873,Nc1ncnc2c1ncn2C1CC(O)C(COP(=O)(O)O)O1__MTSQEKTEEYPFADIFDEDETERNFLLSKPVCFVVFGKPGVGKTTLARYITQAWKCIRVEALPILEEQIAAETESGVMLQSMLISGQSIPDELVIKLMLEKLNSPEVCHFGYIITEIPSLSQDAMTTLQQIELIKNLNLKPDVIINIKCPDYDLCQRISGQRQHNNTGYIYSRDQWDPEVIENHRKKKKEAQKDGKGEEEEEEEEQEEEEAFIAEMQMVAEILHHLVQRPEDYLENVENIVKLYKETILQTLEEVMAEHNPQYLIELNGNKPAEELFMIVMDRLKYLNLKRAAILTKLQGAEEEINDTMENDELFRTLASYKLIAPRYRWQRSKWGRTCPVNLKDGNIYSGLPDYSVSFLGKIYCLSSEEALKPFLLNPRPYLLPPMPGPPCKVFILGPQYSGKTTLCNMLAENYKGKVVDYAQLVQPRFDKARETLVENTIAEATAAAIKVVKEKLLRELQARKQAETALREFQRQYEKMEFGVFPMEATHSSIDEEGYIQGSQRDRGSSLVDTEEAKTKSENVLHDQAAKVDKDDGKETGETFTFKRHSQDASQDVKLYSDTAPTEDLIEEVTADHPEVVTMIEETIKMSQDINFEQPYEKHAEILQEVLGEVMEENKDRFPGAPKYGGWIVDNCPIVKELWMALIKKGIIPDLVIYLSDTENNGKCLFNRIYLQKKSEIDSKILERLLEELQKKKKEEEEARKATEEELRLEEENRRLLELMKVKAKEAEETDNEDEEEIEGDELEVHEEPEASHDTRGSWLPEEFEASEVPETEPEAVSEPIEETTVETEIPKGSKEGLEIEKLSETVVLPEFPEDSYPDVPEMEPFKEKIGSFIILWKQLEATISEAYIKILNLEIADRTPQELLQKVVETMEKPFQYTAWELTGEDYEEETEDYQTEAEVDEELEEEEEEEGEDKMKERKRHLGDTKHFCPVVLKENFILQPGNTEEAAKYREKIYYFSSAEAKEKFLEHPEDYVAHEEPLKAPPLRICLVGPQGSGKTMCGRQLAEKLNIFHIQFEEVLQEKLLLKTEKKVGPEFEEDSENEQAAKQELEELAIQANVKVEEENTKKQLPEVQLTEEEEVIKSSLMENEPLPPEILEVILSEWWLKEPIRSTGFILDGFPRYPEEAQFLGDRGFFPDAAVFIQVDDQDIFDRLLPAQIEKWKLKQKKKLERKKLIKDMKAKIRVDTIAKRRAELILERDKKRRENVVRDDEEISEEELEEDNDDIENILEDEFPKDEEEMSGEEDEEQETDAIERLRGELGEKFEADTHNLQIIQDELERYLIPIISINGARRNHIVQYTLNMKLKPLVENRASIFEKCHPIPAPLAQKMLTFTYKYISSFGYWDPVKLSEGETIKPVENAENPIYPVIHRQYIYFLSSKETKEKFMKNPIKYIRQPKPKPTVPIRIIIVGPPKSGKTTVAKKITSEYGLKHLSIGGALRYVLNNHPETELALMLNWHLHKGMTAPDELAIQALELSLMESVCNTAGVVIDGYPVTKHQMNLLEARSIIPMVIFELSVPSKEIFKRLLLEKENEQRLPYPLHNSAQIVAVNNVKYRKNIGEIRQYYQEQHQNWYVIDGFHSKWWVWNEVIKNVQMVNKYMQTYLERIKAGKAACIDKLCITPQELLSRLGEFEQFCPVSLAESQELFDCSATDSLEFAAEFRGHYYKMSSQEKLNKFLENPELYVPPLAPHPLPSADMIPKRLTLSELKSRFPKCAELQGYCPVTYKDGNQRYEALVPGSINYALEYHNRIYICENKEKLQKFLRSPLKYWEQKLPHKLPPLREPILLTSLPLPGYLEQGIATSLIKAMNAAGCLKPKFPFLSIRRSALLYIALHLKAFNPKGSEYTRKKYKKKMEQFMESCELITYLGAKMTRKYKEPQFRAIDFDHKLKTFLSLRNIDPING,./data/raw/alphafold//AF-Q5TCS8-F1-model_v4.pdb,975,4419,5878,3245 +1011,40481,41215,MSIRSLGYMGFAVSDVAAWRSFLTQKLGLMEAGTTDNGDLFRIDSRAWRIAVQQGEVDDLAFAGYEVADAAGLAQMADKLKQAGIAVTTGDASLARRRGVTGLITFADPFGLPLEIYYGASEVFEKPFLPGAAVSGFLTGEQGLGHFVRCVPDSDKALAFYTDVLGFQLSDVIDMKMGPDVTVPAYFLHCNERHHTLAIAAFPLPKRIHHFMLEVASLDDVGFAFDRVDADGLITSTLGRHTNDHMVSFYASTPSGVEVEYGWSARTVDRSWVVVRHDSPSMWGHKSVRDKAAARNKA,brenda,B3VTK1,Oc1ccccc1O,0.01672,30.0,7.5,1.13.11.39,134375.0,-1.7767637268970025,-1.022184983537017,Oc1ccccc1O__MSIRSLGYMGFAVSDVAAWRSFLTQKLGLMEAGTTDNGDLFRIDSRAWRIAVQQGEVDDLAFAGYEVADAAGLAQMADKLKQAGIAVTTGDASLARRRGVTGLITFADPFGLPLEIYYGASEVFEKPFLPGAAVSGFLTGEQGLGHFVRCVPDSDKALAFYTDVLGFQLSDVIDMKMGPDVTVPAYFLHCNERHHTLAIAAFPLPKRIHHFMLEVASLDDVGFAFDRVDADGLITSTLGRHTNDHMVSFYASTPSGVEVEYGWSARTVDRSWVVVRHDSPSMWGHKSVRDKAAARNKA,./data/raw/alphafold//AF-B3VTK1-F1-model_v4.pdb,913,4354,5788,6203 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+1060,32591,33171,MAALVLEDGSVLRGQPFGAAVSTAGEVVFQTGMVGYPEALTDPSYKAQILVLTYPLIGNYGIPPDEMDEFGLCKWFESSGIHVAALVVGECCPTPSHWSATRTLHEWLQQHGIPGLQGVDTRELTKKLREQGSLLGKLVQNGTEPSSLPFLDPNARPLVPEVSIKTPRVFNTGGAPRILALDCGLKYNQIRCLCQRGAEVTVVPWDHALDSQEYEGLFLSNGPGDPASYPSVVSTLSRVLSEPNPRPVFGICLGHQLLALAIGAKTYKMRYGNRGHNQPCLLVGSGRCFLTSQNHGFAVETDSLPADWAPLFTNANDGSNEGIVHNSLPFFSVQFHPEHQAGPSDMELLFDIFLETVKEATAGNPGGQTVRERLTERLCPPGIPTPGSGLPPPRKVLILGSGGLSIGQAGEFDYSGSQAIKALKEENIQTLLINPNIATVQTSQGLADKVYFLPITPHYVTQVIRNERPDGVLLTFGGQTALNCGVELTKAGVLARYGVRVLGTPVETIELTEDRRAFAARMAEIGEHVAPSEAANSLEQAQAAAERLGYPVLVRAAFALGGLGSGFASNREELSALVAPAFAHTSQVLVDKSLKGWKEIEYEVVRDAYGNCVTVCNMENLDPLGIHTGESIVVAPSQTLNDREYQLLRQTAIKVTQHLGIVGECNVQYALNPESEQYYIIEVNARLSRSSALASKATGYPLAYVAAKLALGIPLPELRNSVTGGTAAFEPSVDYCVVKIPRWDLSKFLRVSTKIGSCMKSVGEVMGIGRSFEEAFQKALRMVDENCVGFDHTVKPVSDMELETPTDKRIFVVAAALWAGYSVDRLYELTRIDRWFLHRMKRIIAHAQLLEQHRGQPLPPDLLQQAKCLGFSDKQIALAVLSTELAVRKLRQELGICPAVKQIDTVAAEWPAQTNYLYLTYWGTTHDLTFRTPHVLVLGSGVYRIGSSVEFDWCAVGCIQQLRKMGYKTIMVNYNPETVSTDYDMCDRLYFDEISFEVVMDIYELENPEGVILSMGGQLPNNMAMALHRQQCRVLGTSPEAIDSAENRFKFSRLLDTIGISQPQWRELSDLESARQFCQTVGYPCVVRPSYVLSGAAMNVAYTDGDLERFLSSAAAVSKEHPVVISKFIQEAKEIDVDAVASDGVVAAIAISEHVENAGVHSGDATLVTPPQDITAKTLERIKAIVHAVGQELQVTGPFNLQLIAKDDQLKVIECNVRVSRSFPFVSKTLGVDLVALATRVIMGEEVEPVGLMTGSGVVGVKVPQFSFSRLAGADVVLGVEMTSTGEVAGFGESRCEAYLKAMLSTGFKIPKKNILLTIGSYKNKSELLPTVRLLESLGYSLYASLGTADFYTEHGVKVTAVDWHFEEAVDGECPPQRSILEQLAEKNFELVINLSMRGAGGRRLSSFVTKGYRTRRLAADFSVPLIIDIKCTKLFVEALGQIGPAPPLKVHVDCMTSQKLVRLPGLIDVHVHLREPGGTHKEDFASGTAAALAGGITMVCAMPNTRPPIIDAPALALAQKLAEAGARCDFALFLGASSENAGTLGTVAGSAAGLKLYLNETFSELRLDSVVQWMEHFETWPSHLPIVAHAEQQTVAAVLMVAQLTQRSVHICHVARKEEILLIKAAKARGLPVTCEVAPHHLFLSHDDLERLGPGKGEVRPELGSRQDVEALWENMAVIDCFASDHAPHTLEEKCGSRPPPGFPGLETMLPLLLTAVSEGRLSLDDLLQRLHHNPRRIFHLPPQEDTYVEVDLEHEWTIPSHMPFSKAHWTPFEGQKVKGTVRRVVLRGEVAYIDGQVLVPPGYGQDVRKWPQGAVPQLPPSAPATSEMTTTPERPRRGIPGLPDGRFHLPPRIHRASDPGLPAEEPKEKSSRKVAEPELMGTPDGTCYPPPPVPRQASPQNLGTPGLLHPQTSPLLHSLVGQHILSVQQFTKDQMSHLFNVAHTLRMMVQKERSLDILKGKVMASMFYEVSTRTSSSFAAAMARLGGAVLSFSEATSSVQKGESLADSVQTMSCYADVVVLRHPQPGAVELAAKHCRRPVINAGDGVGEHPTQALLDIFTIREELGTVNGMTITMVGDLKHGRTVHSLACLLTQYRVSLRYVAPPSLRMPPTVRAFVASRGTKQEEFESIEEALPDTDVLYMTRIQKERFGSTQEYEACFGQFILTPHIMTRAKKKMVVMHPMPRVNEISVEVDSDPRAAYFRQAENGMYIRMALLATVLGRF,sabio,P27708,O=C1CC(C(=O)O)NC(=O)N1,0.0278,25.0,8.0,3.5.2.3,9606.0,-1.5559552040819238,-1.5559552040819238,O=C1CC(C(=O)O)NC(=O)N1__MAALVLEDGSVLRGQPFGAAVSTAGEVVFQTGMVGYPEALTDPSYKAQILVLTYPLIGNYGIPPDEMDEFGLCKWFESSGIHVAALVVGECCPTPSHWSATRTLHEWLQQHGIPGLQGVDTRELTKKLREQGSLLGKLVQNGTEPSSLPFLDPNARPLVPEVSIKTPRVFNTGGAPRILALDCGLKYNQIRCLCQRGAEVTVVPWDHALDSQEYEGLFLSNGPGDPASYPSVVSTLSRVLSEPNPRPVFGICLGHQLLALAIGAKTYKMRYGNRGHNQPCLLVGSGRCFLTSQNHGFAVETDSLPADWAPLFTNANDGSNEGIVHNSLPFFSVQFHPEHQAGPSDMELLFDIFLETVKEATAGNPGGQTVRERLTERLCPPGIPTPGSGLPPPRKVLILGSGGLSIGQAGEFDYSGSQAIKALKEENIQTLLINPNIATVQTSQGLADKVYFLPITPHYVTQVIRNERPDGVLLTFGGQTALNCGVELTKAGVLARYGVRVLGTPVETIELTEDRRAFAARMAEIGEHVAPSEAANSLEQAQAAAERLGYPVLVRAAFALGGLGSGFASNREELSALVAPAFAHTSQVLVDKSLKGWKEIEYEVVRDAYGNCVTVCNMENLDPLGIHTGESIVVAPSQTLNDREYQLLRQTAIKVTQHLGIVGECNVQYALNPESEQYYIIEVNARLSRSSALASKATGYPLAYVAAKLALGIPLPELRNSVTGGTAAFEPSVDYCVVKIPRWDLSKFLRVSTKIGSCMKSVGEVMGIGRSFEEAFQKALRMVDENCVGFDHTVKPVSDMELETPTDKRIFVVAAALWAGYSVDRLYELTRIDRWFLHRMKRIIAHAQLLEQHRGQPLPPDLLQQAKCLGFSDKQIALAVLSTELAVRKLRQELGICPAVKQIDTVAAEWPAQTNYLYLTYWGTTHDLTFRTPHVLVLGSGVYRIGSSVEFDWCAVGCIQQLRKMGYKTIMVNYNPETVSTDYDMCDRLYFDEISFEVVMDIYELENPEGVILSMGGQLPNNMAMALHRQQCRVLGTSPEAIDSAENRFKFSRLLDTIGISQPQWRELSDLESARQFCQTVGYPCVVRPSYVLSGAAMNVAYTDGDLERFLSSAAAVSKEHPVVISKFIQEAKEIDVDAVASDGVVAAIAISEHVENAGVHSGDATLVTPPQDITAKTLERIKAIVHAVGQELQVTGPFNLQLIAKDDQLKVIECNVRVSRSFPFVSKTLGVDLVALATRVIMGEEVEPVGLMTGSGVVGVKVPQFSFSRLAGADVVLGVEMTSTGEVAGFGESRCEAYLKAMLSTGFKIPKKNILLTIGSYKNKSELLPTVRLLESLGYSLYASLGTADFYTEHGVKVTAVDWHFEEAVDGECPPQRSILEQLAEKNFELVINLSMRGAGGRRLSSFVTKGYRTRRLAADFSVPLIIDIKCTKLFVEALGQIGPAPPLKVHVDCMTSQKLVRLPGLIDVHVHLREPGGTHKEDFASGTAAALAGGITMVCAMPNTRPPIIDAPALALAQKLAEAGARCDFALFLGASSENAGTLGTVAGSAAGLKLYLNETFSELRLDSVVQWMEHFETWPSHLPIVAHAEQQTVAAVLMVAQLTQRSVHICHVARKEEILLIKAAKARGLPVTCEVAPHHLFLSHDDLERLGPGKGEVRPELGSRQDVEALWENMAVIDCFASDHAPHTLEEKCGSRPPPGFPGLETMLPLLLTAVSEGRLSLDDLLQRLHHNPRRIFHLPPQEDTYVEVDLEHEWTIPSHMPFSKAHWTPFEGQKVKGTVRRVVLRGEVAYIDGQVLVPPGYGQDVRKWPQGAVPQLPPSAPATSEMTTTPERPRRGIPGLPDGRFHLPPRIHRASDPGLPAEEPKEKSSRKVAEPELMGTPDGTCYPPPPVPRQASPQNLGTPGLLHPQTSPLLHSLVGQHILSVQQFTKDQMSHLFNVAHTLRMMVQKERSLDILKGKVMASMFYEVSTRTSSSFAAAMARLGGAVLSFSEATSSVQKGESLADSVQTMSCYADVVVLRHPQPGAVELAAKHCRRPVINAGDGVGEHPTQALLDIFTIREELGTVNGMTITMVGDLKHGRTVHSLACLLTQYRVSLRYVAPPSLRMPPTVRAFVASRGTKQEEFESIEEALPDTDVLYMTRIQKERFGSTQEYEACFGQFILTPHIMTRAKKKMVVMHPMPRVNEISVEVDSDPRAAYFRQAENGMYIRMALLATVLGRF,./data/raw/alphafold//AF-P27708-F1-model_v4.pdb,4181,5715,7388,8293 +1061,28686,29201,MVVFLKTCLPKAKVICTLGRMTETGFGIDIGGSGIKGARVNLKTGEFIDDRIKIATPKPATPEAVAEVVAEIISQADWDGPVGITLPSVVREQIALSAANIDKSWIGTDVHELFDRHLGGREITVLNDADAAGIAEATFGDPVAREGASILLTLGTGIGSAFLIDGQLFPNTELGHMIVDGEEAEHLASAAVKENNDLSWKKWSKRLNKVLKEYEKLFSPSVFIIGGGISRKHEKWLPLLDIETAVVPAQLRNRAGIVGAAMAVNKHLAP,brenda,A0A160PRJ4,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,6.0,30.0,7.4,2.7.1.63,1718.0,0.7781512503836436,0.7781512503836436,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MVVFLKTCLPKAKVICTLGRMTETGFGIDIGGSGIKGARVNLKTGEFIDDRIKIATPKPATPEAVAEVVAEIISQADWDGPVGITLPSVVREQIALSAANIDKSWIGTDVHELFDRHLGGREITVLNDADAAGIAEATFGDPVAREGASILLTLGTGIGSAFLIDGQLFPNTELGHMIVDGEEAEHLASAAVKENNDLSWKKWSKRLNKVLKEYEKLFSPSVFIIGGGISRKHEKWLPLLDIETAVVPAQLRNRAGIVGAAMAVNKHLAP,./data/raw/alphafold//AF-A0A160PRJ4-F1-model_v4.pdb,2309,5443,1596,7488 +1062,40813,41551,MTDKTSLSYKDAGVDIDAGNALVGRIKGVVKKTRRPEVMGGLGGFGALCALPQKYREPVLVSGTDGVGTKLRLAMDLKRHDTIGIDLVAMCVNDLVVQGAEPLFFLDYYATGKLDVDTASAVISGIAEGCLQSGCSLVGGETAEMPGMYHGEDYDVAGFCVGVVEKSEIIDGSKVSDGDVLIALGSSGPHSNGYSLVRKILEVSGCDPQTTELDGKPLADHLLAPTRIYVKSVLELIEKVDVHAIAHLTGGGFWENIPRVLPDNTQAVIDESSWQWPEVFNWLQTAGNVEHHEMYRTFNCGVGMIIALPAPEVDKALALLNANGENAWKIGIIKASDSEQRVVIE,sabio,P08178,[K+],96.0,37.0,,6.3.3.1,562.0,1.9822712330395684,1.9822712330395684,[K+]__MTDKTSLSYKDAGVDIDAGNALVGRIKGVVKKTRRPEVMGGLGGFGALCALPQKYREPVLVSGTDGVGTKLRLAMDLKRHDTIGIDLVAMCVNDLVVQGAEPLFFLDYYATGKLDVDTASAVISGIAEGCLQSGCSLVGGETAEMPGMYHGEDYDVAGFCVGVVEKSEIIDGSKVSDGDVLIALGSSGPHSNGYSLVRKILEVSGCDPQTTELDGKPLADHLLAPTRIYVKSVLELIEKVDVHAIAHLTGGGFWENIPRVLPDNTQAVIDESSWQWPEVFNWLQTAGNVEHHEMYRTFNCGVGMIIALPAPEVDKALALLNANGENAWKIGIIKASDSEQRVVIE,./data/raw/alphafold//AF-P08178-F1-model_v4.pdb,1391,6642,6163,11882 +1063,9945,10098,MDRLNQLSGQLKPNAKQSILQKNPDDVVIVAAYRTAIGKGFKGSFRSVRSEFILTEFLKEFIKKTNIDPSLIEDVAIGNVLNQAAGATEHRGACLAAGIPYTAAFIAVNRFCSSGLMAISDIANKIKTGEIECGLAGGAESMSTNYRDPRVAPRIDPHLADDAQMEKCLIPMGITNENVANQFNISRERQDEFAAKSYNKAAKAVAAGAFKSEILPIRSIIRNSDGTEKEIIVDTDEGPREGVTAESLGKLRPAFDGTTTAGNASQVSDGAAAVLLMKRSLAEAKGYPIIGKYVLCSTAGVPPEIMGVGPAYAIPEVLKRTGLTVDDIDVFEINEAFAAQCLYSAEQVNVPEEKLNINGGAIALGHPLGETGARQYATIIPLLKPGQIGLTSMCIGSGMGSASILVRE,sabio,P33290,CCCCCCCC(=O)CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.01,30.0,8.3,2.3.1.16,5482.0,-2.0,-2.0,CCCCCCCC(=O)CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MDRLNQLSGQLKPNAKQSILQKNPDDVVIVAAYRTAIGKGFKGSFRSVRSEFILTEFLKEFIKKTNIDPSLIEDVAIGNVLNQAAGATEHRGACLAAGIPYTAAFIAVNRFCSSGLMAISDIANKIKTGEIECGLAGGAESMSTNYRDPRVAPRIDPHLADDAQMEKCLIPMGITNENVANQFNISRERQDEFAAKSYNKAAKAVAAGAFKSEILPIRSIIRNSDGTEKEIIVDTDEGPREGVTAESLGKLRPAFDGTTTAGNASQVSDGAAAVLLMKRSLAEAKGYPIIGKYVLCSTAGVPPEIMGVGPAYAIPEVLKRTGLTVDDIDVFEINEAFAAQCLYSAEQVNVPEEKLNINGGAIALGHPLGETGARQYATIIPLLKPGQIGLTSMCIGSGMGSASILVRE,./data/raw/alphafold//AF-P33290-F1-model_v4.pdb,3461,949,1141,1404 +1064,18099,18361,MSGKLTVITGPMYSGKTTELLSFVEIYKLGKKKVAVFKPKIDSRYHSTMIVSHSGNGVEAHVIERPEEMRKYIEEDTRGVFIDEVQFFNPSLFEVVKDLLDRGIDVFCAGLDLTHKQNPFETTALLLSLADTVIKKKAVCHRCGEYNATLTLKVAGGEEEIDVGGQEKYIAVCRDCYNTLKKRV,brenda,Q9WYN2,Cc1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)nc1O,0.001,37.0,4.5,2.7.1.21,5791.0,-3.0,-3.0,Cc1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)nc1O__MSGKLTVITGPMYSGKTTELLSFVEIYKLGKKKVAVFKPKIDSRYHSTMIVSHSGNGVEAHVIERPEEMRKYIEEDTRGVFIDEVQFFNPSLFEVVKDLLDRGIDVFCAGLDLTHKQNPFETTALLLSLADTVIKKKAVCHRCGEYNATLTLKVAGGEEEIDVGGQEKYIAVCRDCYNTLKKRV,./data/raw/alphafold//AF-Q9WYN2-F1-model_v4.pdb,932,4364,5816,6236 +1065,36529,37166,MEIFKRPFREGSFVLKEKDYTVEFEVEKIHLGWKISGRVKGNPGRLEIFRTNAPKKLLVNNWQSWGPCRVVDLPSFTPPEIDPNWQYTASVVPDVIKNRLQSDYFVAEEGRVYGFLSSKIAHPFFAAENGELVAYLEYFDVKFDDFVPIEPFVVLEDPNTSLLLEKYAELVGKENSARIPERTPVGWCSWYHYFLDLTWEETLKNLELAGEFPFEVFQIDDAYEKDIGDWLVTKKDFPSVDEMARTIQEKGFVPGIWTAPFSVSETSDVFNSYPDWVVKENGMPKMAYRNWNRKIYALDLSNKEVLDWLFDLFSSLKKMGYRYFKIDFLFAGAIPGERKENITPVQAFRKGMEVIRKAVGDLFILGCGSPLLPAVGYVDGMRIGPDTTPFWGDQIEDNGAPAARWALRNAITRYFMHDRLWLNDPDCLILREEKTELTPKERELYSYTCGILDNMIIESDDLSLVKEHGRKVLRETLDLLGGKPRVLNIMTEDLKYEIVSSGTISGNTRLVVDLKNREYHLEKEGKSSLRKKVVKREDGRNFYFYEEGERE,uniprot_search,Q9R7H1,O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1,0.74,100.75,5.8,3.2.1.22,2337.0,-0.1307682802690238,-0.1307682802690238,O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1__MEIFKRPFREGSFVLKEKDYTVEFEVEKIHLGWKISGRVKGNPGRLEIFRTNAPKKLLVNNWQSWGPCRVVDLPSFTPPEIDPNWQYTASVVPDVIKNRLQSDYFVAEEGRVYGFLSSKIAHPFFAAENGELVAYLEYFDVKFDDFVPIEPFVVLEDPNTSLLLEKYAELVGKENSARIPERTPVGWCSWYHYFLDLTWEETLKNLELAGEFPFEVFQIDDAYEKDIGDWLVTKKDFPSVDEMARTIQEKGFVPGIWTAPFSVSETSDVFNSYPDWVVKENGMPKMAYRNWNRKIYALDLSNKEVLDWLFDLFSSLKKMGYRYFKIDFLFAGAIPGERKENITPVQAFRKGMEVIRKAVGDLFILGCGSPLLPAVGYVDGMRIGPDTTPFWGDQIEDNGAPAARWALRNAITRYFMHDRLWLNDPDCLILREEKTELTPKERELYSYTCGILDNMIIESDDLSLVKEHGRKVLRETLDLLGGKPRVLNIMTEDLKYEIVSSGTISGNTRLVVDLKNREYHLEKEGKSSLRKKVVKREDGRNFYFYEEGERE,./data/raw/alphafold//AF-Q9R7H1-F1-model_v4.pdb,2502,8128,10000,11185 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+1191,15135,15349,MKFKMKGLFCVILSSLAFSGCVYDSKLQRPVISERETEIPLLFDQAQTQAVFVTYDGIHLKSYGNDLSRAKTEYIPASTFKMLNALIGLQNAKATNTEVFHWNGEKRAFSAWEKDMTLAEAMQASAVPVYQELARRIGLELMREEVKRVGFGNAEIGQQVDNFWLVGPLKISPEQEVQFAYQLAMKQLPFDSNVQQQVKDMLYIERRGDSKLYAKSGWGMDVEPQVGWYTGWVEQPNGKVTAFALNMNMQAGDDPTERKQLTLSILDKLGLFFYLR,brenda,I6S7G0,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(S[C@@H]3CN[C@H](C(=O)N(C)C)C3)[C@H](C)[C@H]12,3e-05,30.0,7.0,3.5.2.6,106648.0,-4.522878745280337,-4.522878745280337,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(S[C@@H]3CN[C@H](C(=O)N(C)C)C3)[C@H](C)[C@H]12__MKFKMKGLFCVILSSLAFSGCVYDSKLQRPVISERETEIPLLFDQAQTQAVFVTYDGIHLKSYGNDLSRAKTEYIPASTFKMLNALIGLQNAKATNTEVFHWNGEKRAFSAWEKDMTLAEAMQASAVPVYQELARRIGLELMREEVKRVGFGNAEIGQQVDNFWLVGPLKISPEQEVQFAYQLAMKQLPFDSNVQQQVKDMLYIERRGDSKLYAKSGWGMDVEPQVGWYTGWVEQPNGKVTAFALNMNMQAGDDPTERKQLTLSILDKLGLFFYLR,./data/raw/alphafold//AF-I6S7G0-F1-model_v4.pdb,3564,2745,1877,1734 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+1194,13473,13668,MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,brenda,A0A077JBW9,CO[P@](=O)(Oc1ccc([N+](=O)[O-])cc1)OC(C)C,0.036,30.0,8.5,3.1.8.1,453246.0,-1.4436974992327127,-1.4436974992327127,CO[P@](=O)(Oc1ccc([N+](=O)[O-])cc1)OC(C)C__MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,./data/raw/alphafold//AF-A0A077JBW9-F1-model_v4.pdb,5831,2656,3312,3827 +1195,27476,27952,MSKDTSVLLEEKRVFKPHYTVVEEAHIKNWEAELEKGKDHENYWAEKAERFEWFRKWDRVLDESNRPFYRWFVNGKINMTYNAVDRWLDTDKRNQVAILYVNERGDERKLTYYELYREVNRTANALKSLGIKKGDAVALYLPMCPELVISMLACAKIGAVHSVIYSGLSVGALVERLNDARAKIIITADGTYRRGGVIKLKPIVDEAILQCPTIETTVVVKHTDIDIEMSDISGREMLFDKLIEGEGDRCDAEEMDAEDPLFILYTSGSTGKPKGVLHTTGGYMVGVASTLEMTFDIHNGDLWWCTADIGWITGHSYVVYGPLLLGTTTLLYEGAPDYPDPGVWWSIVEKYGVTKFYTAPTAIRHLMRFGDKHPKRYNLESLKILGTVGEPINPEAWMWYYRNIGREKCPIIDTWWQTETGMHLIAPLPVTPLKPGSVTKPLPGIEADVVDENGDPVPLGKGGFLVIRKPWPAMFRTLFNDEQRYIDVYWKQIPGGVYTAGDMARKDEDGYFWIQGRSDDVLNIAGHRIGTAEVESVFVAHPAVAEAAVIGKADPIKGEVIKAFLILKKGHKLNAALIEELKRHLRHELGPVAVVGEMVQVDSLPKTRSGKIMRRILRAREEGEDLGDTSTLEE,uniprot_search,A0A7J4MTU7,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,3.3,65.0,7.5,6.2.1.1,145262.0,0.5185139398778875,0.5185139398778875,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MSKDTSVLLEEKRVFKPHYTVVEEAHIKNWEAELEKGKDHENYWAEKAERFEWFRKWDRVLDESNRPFYRWFVNGKINMTYNAVDRWLDTDKRNQVAILYVNERGDERKLTYYELYREVNRTANALKSLGIKKGDAVALYLPMCPELVISMLACAKIGAVHSVIYSGLSVGALVERLNDARAKIIITADGTYRRGGVIKLKPIVDEAILQCPTIETTVVVKHTDIDIEMSDISGREMLFDKLIEGEGDRCDAEEMDAEDPLFILYTSGSTGKPKGVLHTTGGYMVGVASTLEMTFDIHNGDLWWCTADIGWITGHSYVVYGPLLLGTTTLLYEGAPDYPDPGVWWSIVEKYGVTKFYTAPTAIRHLMRFGDKHPKRYNLESLKILGTVGEPINPEAWMWYYRNIGREKCPIIDTWWQTETGMHLIAPLPVTPLKPGSVTKPLPGIEADVVDENGDPVPLGKGGFLVIRKPWPAMFRTLFNDEQRYIDVYWKQIPGGVYTAGDMARKDEDGYFWIQGRSDDVLNIAGHRIGTAEVESVFVAHPAVAEAAVIGKADPIKGEVIKAFLILKKGHKLNAALIEELKRHLRHELGPVAVVGEMVQVDSLPKTRSGKIMRRILRAREEGEDLGDTSTLEE,./data/raw/alphafold//AF-A0A7J4MTU7-F1-model_v4.pdb,3531,2871,3560,4129 +1196,5653,5739,MAHRPPSPALASVLLALLLSGAARAAEIVGGHEAQPHSRPYMASLQMRGNPGSHFCGGTLIHPSFVLTAAHCLRDIPQRLVNVVLGAHNVRTQEPTQQHFSVAQVFLNNYDAENKLNDVLLIQLSSPANLSASVATVQLPQQDQPVPHGTQCLAMGWGRVGAHDPPAQVLQELNVTVVTFFCRPHNICTFVPRRKAGICFGDSGGPLICDGIIQGIDSFVIWGCATRLFPDFFTRVALYVDWIRSTLRRVEAKGRP,uniprot_search,P24158,CC(C)[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)Nc1ccc([N+](=O)[O-])cc1,0.97,25.0,7.4,3.4.21.76,9606.0,-0.0132282657337551,-0.0132282657337551,CC(C)[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)Nc1ccc([N+](=O)[O-])cc1__MAHRPPSPALASVLLALLLSGAARAAEIVGGHEAQPHSRPYMASLQMRGNPGSHFCGGTLIHPSFVLTAAHCLRDIPQRLVNVVLGAHNVRTQEPTQQHFSVAQVFLNNYDAENKLNDVLLIQLSSPANLSASVATVQLPQQDQPVPHGTQCLAMGWGRVGAHDPPAQVLQELNVTVVTFFCRPHNICTFVPRRKAGICFGDSGGPLICDGIIQGIDSFVIWGCATRLFPDFFTRVALYVDWIRSTLRRVEAKGRP,./data/raw/alphafold//AF-P24158-F1-model_v4.pdb,5158,2046,1511,3024 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+1240,11360,11521,MWLRAFILATLSASAAWGHPSSPPVVDTVHGKVLGKFVSLEGFAQPVAIFLGIPFAKPPLGPLRFTPPQPAEPWSFVKNATSYPPMCTQDPKAGQLLSELFTNRKENIPLKLSEDCLYLNIYTPADLTKKNRLPVMVWIHGGGLMVGAASTYDGLALAAHENVVVVTIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALRWVQDNIASFGGNPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTSVLVKKGDVKPLAEQIAITAGCKTTTSAVMVHCLRQKTEEELLETTLKMKFLSLDLQGDPRESQPLLGTVIDGMLLLKTPEELQAERNFHTVPYMVGINKQEFGWLIPMQLMSYPLSEGQLDQKTAMSLLWKSYPLVCIAKELIPEATEKYLGGTDDTVKKKDLFLDLIADVMFGVPSVIVARNHRDAGAPTYMYEFQYRPSFSSDMKPKTVIGDHGDELFSVFGAPFLKEGASEEEIRLSKMVMKFWANFARNGNPNGEGLPHWPEYNQKEGYLQIGANTQAAQKLKDKEVAFWTNLFAKKAVEKPPQTEHIEL,brenda,P23141,CCN(CC)CC#CCOC(=O)C(O)(c1ccccc1)C1CCCCC1,0.094,37.0,7.4,3.1.1.1,9606.0,-1.0268721464003014,-0.9684835174804518,CCN(CC)CC#CCOC(=O)C(O)(c1ccccc1)C1CCCCC1__MWLRAFILATLSASAAWGHPSSPPVVDTVHGKVLGKFVSLEGFAQPVAIFLGIPFAKPPLGPLRFTPPQPAEPWSFVKNATSYPPMCTQDPKAGQLLSELFTNRKENIPLKLSEDCLYLNIYTPADLTKKNRLPVMVWIHGGGLMVGAASTYDGLALAAHENVVVVTIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALRWVQDNIASFGGNPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTSVLVKKGDVKPLAEQIAITAGCKTTTSAVMVHCLRQKTEEELLETTLKMKFLSLDLQGDPRESQPLLGTVIDGMLLLKTPEELQAERNFHTVPYMVGINKQEFGWLIPMQLMSYPLSEGQLDQKTAMSLLWKSYPLVCIAKELIPEATEKYLGGTDDTVKKKDLFLDLIADVMFGVPSVIVARNHRDAGAPTYMYEFQYRPSFSSDMKPKTVIGDHGDELFSVFGAPFLKEGASEEEIRLSKMVMKFWANFARNGNPNGEGLPHWPEYNQKEGYLQIGANTQAAQKLKDKEVAFWTNLFAKKAVEKPPQTEHIEL,./data/raw/alphafold//AF-P23141-F1-model_v4.pdb,2994,3237,2517,245 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+1243,17736,17995,MRHLPYFCRGQVVRGFGRGSKQLGIPTANFPEQVVDNLPADISTGIYYGWASVGSGDVHKMVVSIGWNPYYKNTKKSMETHIMHTFKEDFYGEILNVAIVGYLRPEKNFDSLESLISAIQGDIEEAKKRLELPEHLKIKEDNFFQVSKSKIMNGH,brenda,Q969G6,Cc1cc2nc3c(O)nc(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)CO)c2cc1C,0.0025,25.0,7.0,2.7.1.26,9606.0,-2.6020599913279625,-2.6020599913279625,Cc1cc2nc3c(O)nc(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)CO)c2cc1C__MRHLPYFCRGQVVRGFGRGSKQLGIPTANFPEQVVDNLPADISTGIYYGWASVGSGDVHKMVVSIGWNPYYKNTKKSMETHIMHTFKEDFYGEILNVAIVGYLRPEKNFDSLESLISAIQGDIEEAKKRLELPEHLKIKEDNFFQVSKSKIMNGH,./data/raw/alphafold//AF-Q969G6-F1-model_v4.pdb,888,4311,5757,6168 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+1247,24301,24687,MGAHVMKCEIYVVSVLLFTMSQSQTAALSFRAHLSDCLEDKDYQTLLQTVENGLPPIHTPPRHVVVVGAGMAGLTAAKLLQDAGHKVTILEASGRVGGRVETYRNEQGWYVELGAMRIPSTHKIVLFFVELLKLKLNEFIMTDPNTFYLVNGIKKRTFEVNAHPDILGYNLEGNEKGKSADQLLQQALKKVNVYVEEHGCSEALKKYDHYTVKEYLKTEGGLSSEAVRMIGDLLNEESLMYTALTEMIYDQTDISDNDVYFEITGGSDLLPNALHKQLKAPALLNSRVKRISRSETGVFISYQKDKQSSLTDLEADAVLVTTTTKAALFIDFDPPLPIKKMEALRVVHYDSSTKIILTFSEKFWERDGIKGGKSITDRPSRFIYYSSHSFQIKDIGVLLASYTWSDDSLLFLGATDEDLKELVLGDLAAIHGEYVRSLCTGVVVKKWSLDPYSLGAFALFTPYQHLEYSKELFKSEGRLHFAGEHTGFPHAWIETAMKTGIRAATSIYSNLLDVSTQTRDEF,brenda,D2KWB6,NCCCC[C@H](N)C(=O)O,13.0,,,1.4.3.2,195632.0,1.1139433523068367,1.4722660104959906,NCCCC[C@H](N)C(=O)O__MGAHVMKCEIYVVSVLLFTMSQSQTAALSFRAHLSDCLEDKDYQTLLQTVENGLPPIHTPPRHVVVVGAGMAGLTAAKLLQDAGHKVTILEASGRVGGRVETYRNEQGWYVELGAMRIPSTHKIVLFFVELLKLKLNEFIMTDPNTFYLVNGIKKRTFEVNAHPDILGYNLEGNEKGKSADQLLQQALKKVNVYVEEHGCSEALKKYDHYTVKEYLKTEGGLSSEAVRMIGDLLNEESLMYTALTEMIYDQTDISDNDVYFEITGGSDLLPNALHKQLKAPALLNSRVKRISRSETGVFISYQKDKQSSLTDLEADAVLVTTTTKAALFIDFDPPLPIKKMEALRVVHYDSSTKIILTFSEKFWERDGIKGGKSITDRPSRFIYYSSHSFQIKDIGVLLASYTWSDDSLLFLGATDEDLKELVLGDLAAIHGEYVRSLCTGVVVKKWSLDPYSLGAFALFTPYQHLEYSKELFKSEGRLHFAGEHTGFPHAWIETAMKTGIRAATSIYSNLLDVSTQTRDEF,./data/raw/alphafold//AF-D2KWB6-F1-model_v4.pdb,5084,6022,7787,8184 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+1416,39958,40678,MNVTMQSKKLLKPSIPTPTHLQKLNLSLLDQIQIPFYVGLIFHYETLSDNSHITLSKLESSLSETLTLYYHVAGRYNGTDCVIECNDQGIGYVETAFDVELHQFLLGEESNNLELLVGLSGFLSETETPPLAAIQLNMFKCGGLVIGAQFNHIIGDMFTMSTFMNSWAKACRVGIKEVAHPTFGLAPLMPSAKVLNIPPPPSLEGVKFVSKRFVFNENAITRLRKEATEEDGDVQKKKKRPSRVDLVTAFLSKTLIEMDCAKKEQTKSRPSLMVHMMNLRKRTKLPLENDVSVNFFTVVNVESKITVAPKITDLTESLGSARGEIISEVAKVDDAEVVSSMVLNSVREFYYEWGKGEKNVLVYTSWCRFPLYEVDFGWGIPSLVDTTAVPFRLIVLMDQGPTGDGIAVRACLSEHDMIQFQQHHQLLSYVS,sabio,Q9SQ01,OCc1ccccc1,0.34,30.0,7.5,2.3.1.224,49040.0,-0.4685210829577448,-0.4685210829577448,OCc1ccccc1__MNVTMQSKKLLKPSIPTPTHLQKLNLSLLDQIQIPFYVGLIFHYETLSDNSHITLSKLESSLSETLTLYYHVAGRYNGTDCVIECNDQGIGYVETAFDVELHQFLLGEESNNLELLVGLSGFLSETETPPLAAIQLNMFKCGGLVIGAQFNHIIGDMFTMSTFMNSWAKACRVGIKEVAHPTFGLAPLMPSAKVLNIPPPPSLEGVKFVSKRFVFNENAITRLRKEATEEDGDVQKKKKRPSRVDLVTAFLSKTLIEMDCAKKEQTKSRPSLMVHMMNLRKRTKLPLENDVSVNFFTVVNVESKITVAPKITDLTESLGSARGEIISEVAKVDDAEVVSSMVLNSVREFYYEWGKGEKNVLVYTSWCRFPLYEVDFGWGIPSLVDTTAVPFRLIVLMDQGPTGDGIAVRACLSEHDMIQFQQHHQLLSYVS,./data/raw/alphafold//AF-Q9SQ01-F1-model_v4.pdb,2762,8531,4584,11750 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+1418,10013,10166,MAARLLRGSLRVLGGHRAPRQLPAARCSHSGGEERLETPSAKKLTDIGIRRIFSPEHDIFRKSVRKFFQEEVIPHHSEWEKAGEVSREVWEKAGKQGLLGVNIAEHLGGIGGDLYSAAIVWEEQAYSNCSGPGFSIHSGIVMSYITNHGSEEQIKHFIPQMTAGKCIGAIAMTEPGAGSDLQGIKTNAKKDGSDWILNGSKVFISNGSLSDVVIVVAVTNHEAPSPAHGISLFLVENGMKGFIKGRKLHKMGLKAQDTAELFFEDIRLPASALLGEENKGFYYIMKELPQERLLIADVAISASEFMFEETRNYVKQRKAFGKTVAHLQTVQHKLAELKTHICVTRAFVDNCLQLHEAKRLDSATACMAKYWASELQNSVAYDCVQLHGGWGYMWEYPIAKAYVDARVQPIYGGTNEIMKELIAREIVFDK,sabio,P28330,CCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O,0.008,25.0,7.6,1.3.8.8,9606.0,-2.096910013008056,-2.096910013008056,CCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O__MAARLLRGSLRVLGGHRAPRQLPAARCSHSGGEERLETPSAKKLTDIGIRRIFSPEHDIFRKSVRKFFQEEVIPHHSEWEKAGEVSREVWEKAGKQGLLGVNIAEHLGGIGGDLYSAAIVWEEQAYSNCSGPGFSIHSGIVMSYITNHGSEEQIKHFIPQMTAGKCIGAIAMTEPGAGSDLQGIKTNAKKDGSDWILNGSKVFISNGSLSDVVIVVAVTNHEAPSPAHGISLFLVENGMKGFIKGRKLHKMGLKAQDTAELFFEDIRLPASALLGEENKGFYYIMKELPQERLLIADVAISASEFMFEETRNYVKQRKAFGKTVAHLQTVQHKLAELKTHICVTRAFVDNCLQLHEAKRLDSATACMAKYWASELQNSVAYDCVQLHGGWGYMWEYPIAKAYVDARVQPIYGGTNEIMKELIAREIVFDK,./data/raw/alphafold//AF-P28330-F1-model_v4.pdb,5503,3038,3764,4312 +1419,9466,9615,MARQGCLGSFQVISLFTFAISVNICLGFTASRIKRAEWDEGPPTVLSDSPWTNTSGSCKGRCFELQEVGPPDCRCDNLCKSYSSCCHDFDELCLKTARGWECTKDRCGEVRNEENACHCSEDCLSRGDCCTNYQVVCKGESHWVDDDCEEIKVPECPAGFVRPPLIIFSVDGFRASYMKKGSKVMPNIEKLRSCGTHAPYMRPVYPTKTFPNLYTLATGLYPESHGIVGNSMYDPVFDASFHLRGREKFNHRWWGGQPLWITATKQGVRAGTFFWSVSIPHERRILTILQWLSLPDNERPSVYAFYSEQPDFSGHKYGPFGPEMTNPLREIDKTVGQLMDGLKQLRLHRCVNVIFVGDHGMEDVTCDRTEFLSNYLTNVDDITLVPGTLGRIRAKSINNSKYDPKTIIANLTCKKPDQHFKPYMKQHLPKRLHYANNRRIEDIHLLVDRRWHVARKPLDVYKKPSGKCFFQGDHGFDNKVNSMQTVFVGYGPTFKYRTKVPPFENIELYNVMCDLLGLKPAPNNGTHGSLNHLLRTNTFRPTMPDEVSRPNYPGIMYLQSEFDLGCTCDDKVEPKNKLEELNKRLHTKGSTEAETGKFRGSKHENKKNLNGSVEPRKERHLLYGRPAVLYRTSYDILYHTDFESGYSEIFLMPLWTSYTISKQAEVSSIPEHLTNCVRPDVRVSPGFSQNCLAYKNDKQMSYGFLFPPYLSSSPEAKYDAFLVTNMVPMYPAFKRVWAYFQRVLVKKYASERNGVNVISGPIFDYNYDGLRDTEDEIKQYVEGSSIPVPTHYYSIITSCLDFTQPADKCDGPLSVSSFILPHRPDNDESCNSSEDESKWVEELMKMHTARVRDIEHLTGLDFYRKTSRSYSEILTLKTYLHTYESEI,uniprot_search,Q64610,CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)OCC[N+](C)(C)C,0.0083,37.0,7.1875,3.1.4.39,10116.0,-2.0809219076239263,-2.0809219076239263,CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)OCC[N+](C)(C)C__MARQGCLGSFQVISLFTFAISVNICLGFTASRIKRAEWDEGPPTVLSDSPWTNTSGSCKGRCFELQEVGPPDCRCDNLCKSYSSCCHDFDELCLKTARGWECTKDRCGEVRNEENACHCSEDCLSRGDCCTNYQVVCKGESHWVDDDCEEIKVPECPAGFVRPPLIIFSVDGFRASYMKKGSKVMPNIEKLRSCGTHAPYMRPVYPTKTFPNLYTLATGLYPESHGIVGNSMYDPVFDASFHLRGREKFNHRWWGGQPLWITATKQGVRAGTFFWSVSIPHERRILTILQWLSLPDNERPSVYAFYSEQPDFSGHKYGPFGPEMTNPLREIDKTVGQLMDGLKQLRLHRCVNVIFVGDHGMEDVTCDRTEFLSNYLTNVDDITLVPGTLGRIRAKSINNSKYDPKTIIANLTCKKPDQHFKPYMKQHLPKRLHYANNRRIEDIHLLVDRRWHVARKPLDVYKKPSGKCFFQGDHGFDNKVNSMQTVFVGYGPTFKYRTKVPPFENIELYNVMCDLLGLKPAPNNGTHGSLNHLLRTNTFRPTMPDEVSRPNYPGIMYLQSEFDLGCTCDDKVEPKNKLEELNKRLHTKGSTEAETGKFRGSKHENKKNLNGSVEPRKERHLLYGRPAVLYRTSYDILYHTDFESGYSEIFLMPLWTSYTISKQAEVSSIPEHLTNCVRPDVRVSPGFSQNCLAYKNDKQMSYGFLFPPYLSSSPEAKYDAFLVTNMVPMYPAFKRVWAYFQRVLVKKYASERNGVNVISGPIFDYNYDGLRDTEDEIKQYVEGSSIPVPTHYYSIITSCLDFTQPADKCDGPLSVSSFILPHRPDNDESCNSSEDESKWVEELMKMHTARVRDIEHLTGLDFYRKTSRSYSEILTLKTYLHTYESEI,./data/raw/alphafold//AF-Q64610-F1-model_v4.pdb,2418,51,56,67 +1420,4065,4132,MNHHLIITPIFHLQIMLPVATLKRPPPPAATCSIYSFSRGTPSLVSKARLSTAAVGGMKNEPSPNHYSDISSSDLNLTRRSGNYGPTMWDFEYIQSIHNDYTEKKYMNRLNKLKEEMKKMIMAEGSQELEKLELIDNLQRLGVSYHFKHEIMQILSSIKQHSTPADSLYATALKFRLFREYGFHISQEIFGGLSETHTEDTKGMLYLYEASFLATEGESELEKARNWTEKHLREYLENKNDDQNVAELVHHALELPLHWRMLRIEARWFINFYKKKQDMIPLLLELAILDFNIVQAAHIEDLKYVARWWKETCLAENLPFARDRLVENFFWTIGVNFLPQYGYFRRIETKVNALVTTIDDVYDVFGTMDELQCFTHAFQRWNIDELDNLPDNMKMCYFALDNFINEVAGDAFEEHRVPILSYLRNAWTDLCKAYLREAKWYFSKYIPTMEEYMDNAWISISAPVILVHAYFLVANPVNKEVLHYLENYHDIIRWSALILRLANDLGTSSEELKRGDVPKSIQCYMNEKKVSEEEARQHIRLLISETWKKLNEAHNVAAHPFPKMFVKCAMNLARMAQCMYQHGDGHGHGDLNSETTNHIMALLFESIPPA,brenda,A5Y5L5,CC(C)=CCC/C(C)=C/COP(=O)(O)OP(=O)(O)O,0.00019,35.0,,4.2.3.108,200320.0,-3.721246399047171,-3.721246399047171,CC(C)=CCC/C(C)=C/COP(=O)(O)OP(=O)(O)O__MNHHLIITPIFHLQIMLPVATLKRPPPPAATCSIYSFSRGTPSLVSKARLSTAAVGGMKNEPSPNHYSDISSSDLNLTRRSGNYGPTMWDFEYIQSIHNDYTEKKYMNRLNKLKEEMKKMIMAEGSQELEKLELIDNLQRLGVSYHFKHEIMQILSSIKQHSTPADSLYATALKFRLFREYGFHISQEIFGGLSETHTEDTKGMLYLYEASFLATEGESELEKARNWTEKHLREYLENKNDDQNVAELVHHALELPLHWRMLRIEARWFINFYKKKQDMIPLLLELAILDFNIVQAAHIEDLKYVARWWKETCLAENLPFARDRLVENFFWTIGVNFLPQYGYFRRIETKVNALVTTIDDVYDVFGTMDELQCFTHAFQRWNIDELDNLPDNMKMCYFALDNFINEVAGDAFEEHRVPILSYLRNAWTDLCKAYLREAKWYFSKYIPTMEEYMDNAWISISAPVILVHAYFLVANPVNKEVLHYLENYHDIIRWSALILRLANDLGTSSEELKRGDVPKSIQCYMNEKKVSEEEARQHIRLLISETWKKLNEAHNVAAHPFPKMFVKCAMNLARMAQCMYQHGDGHGHGDLNSETTNHIMALLFESIPPA,./data/raw/alphafold//AF-A5Y5L5-F1-model_v4.pdb,4963,1780,2653,2655 +1421,32772,33356,MTQQIKLLVLNGPNLNLLGQREPEVYGSKTLDDIIKALTDEAALQNVALSHLQSNREYELIEKIHDAFEKIDFIIINPAAFTHTSVALRDALLGVNIPFIEVHLSNVHARESFRHHSYLSDIAQGVICGLGAKGYSFALQSAIGKLRNI,brenda,A1SZA3,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O,0.2026,20.0,7.2,4.2.1.10,357794.0,-0.6933605589757383,-0.6933605589757383,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O__MTQQIKLLVLNGPNLNLLGQREPEVYGSKTLDDIIKALTDEAALQNVALSHLQSNREYELIEKIHDAFEKIDFIIINPAAFTHTSVALRDALLGVNIPFIEVHLSNVHARESFRHHSYLSDIAQGVICGLGAKGYSFALQSAIGKLRNI,./data/raw/alphafold//AF-A1SZA3-F1-model_v4.pdb,2032,7558,6256,9937 +1422,11746,11910,MPLGHIMRLDLEKIALEYIVPCLHEVGFCYLDNFLGEVVGDCVLERVKQLHCTGALRDGQLAGPRAGVSKRHLRGDQITWIGGNEEGCEAISFLLSLIDRLVLYCGSRLGKYYVKERSKAMVACYPGNGTGYVRHVDNPNGDGRCITCIYYLNKNWDAKLHGGILRIFPEGKSFIADVEPIFDRLLFFWSDRRNPHEVQPSYATRYAMTVWYFDAEERAEAKKKFRNLTRKTESALTED,brenda,Q9H6Z9,CC[C@@H](C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](CCSC)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](C)N=C(O)[C@@H](N)CC(=O)O)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CC(C)C)C(=O)O,0.006,37.0,7.8,1.14.11.29,9606.0,-2.2218487496163566,-2.2218487496163566,CC[C@@H](C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](CCSC)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](C)N=C(O)[C@@H](N)CC(=O)O)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CC(C)C)C(=O)O__MPLGHIMRLDLEKIALEYIVPCLHEVGFCYLDNFLGEVVGDCVLERVKQLHCTGALRDGQLAGPRAGVSKRHLRGDQITWIGGNEEGCEAISFLLSLIDRLVLYCGSRLGKYYVKERSKAMVACYPGNGTGYVRHVDNPNGDGRCITCIYYLNKNWDAKLHGGILRIFPEGKSFIADVEPIFDRLLFFWSDRRNPHEVQPSYATRYAMTVWYFDAEERAEAKKKFRNLTRKTESALTED,./data/raw/alphafold//AF-Q9H6Z9-F1-model_v4.pdb,132,2877,3567,4139 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+1455,12085,12252,MAAPRAGRGAGWSLRAWRALGGIRWGRRPRLTPDLRALLTSGTSDPRARVTYGTPSLWARLSVGVTEPRACLTSGTPGPRAQLTAVTPDTRTREASENSGTRSRAWLAVALGAGGAVLLLLWGGGRGPPAVLAAVPSPPPASPRSQYNFIADVVEKTAPAVVYIEILDRHPFLGREVPISNGSGFVVAADGLIVTNAHVVADRRRVRVRLLSGDTYEAVVTAVDPVADIATLRIQTKEPLPTLPLGRSADVRQGEFVVAMGSPFALQNTITSGIVSSAQRPARDLGLPQTNVEYIQTDAAIDFGNSGGPLVNLDGEVIGVNTMKVTAGISFAIPSDRLREFLHRGEKKNSSSGISGSQRRYIGVMMLTLSPSILAELQLREPSFPDVQHGVLIHKVILGSPAHRAGLRPGDVILAIGEQMVQNAEDVYEAVRTQSQLAVQIRRGRETLTLYVTPEVTE,brenda,O43464,CC[C@H](C)[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCSC)C(O)=N[C@H](C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=N)O)[C@@H](C)O,0.354,37.0,8.0,3.4.21.108,9606.0,-0.4509967379742122,-0.4509967379742122,CC[C@H](C)[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCSC)C(O)=N[C@H](C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=N)O)[C@@H](C)O__MAAPRAGRGAGWSLRAWRALGGIRWGRRPRLTPDLRALLTSGTSDPRARVTYGTPSLWARLSVGVTEPRACLTSGTPGPRAQLTAVTPDTRTREASENSGTRSRAWLAVALGAGGAVLLLLWGGGRGPPAVLAAVPSPPPASPRSQYNFIADVVEKTAPAVVYIEILDRHPFLGREVPISNGSGFVVAADGLIVTNAHVVADRRRVRVRLLSGDTYEAVVTAVDPVADIATLRIQTKEPLPTLPLGRSADVRQGEFVVAMGSPFALQNTITSGIVSSAQRPARDLGLPQTNVEYIQTDAAIDFGNSGGPLVNLDGEVIGVNTMKVTAGISFAIPSDRLREFLHRGEKKNSSSGISGSQRRYIGVMMLTLSPSILAELQLREPSFPDVQHGVLIHKVILGSPAHRAGLRPGDVILAIGEQMVQNAEDVYEAVRTQSQLAVQIRRGRETLTLYVTPEVTE,./data/raw/alphafold//AF-O43464-F1-model_v4.pdb,5369,3295,4052,4719 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+1509,31058,31612,MLDKIVIANRGEIALRILRACKELGIKTVAVHSSADRDLKHVLLADETVCIGPAPSVKSYLNIPAIISAAEITGAVAIHPGYGFLSENANFAEQVERSGFIFIGPKAETIRLMGDKVSAIAAMKKAGVPCVPGSDGPLGDDMDKNRAIAKRIGYPVIIKASGGGGGRGMRVVRGDAELAQSISMTRAEAKAAFSNDMVYMEKYLENPRHVEIQVLADGQGNAIYLAERDCSMQRRHQKVVEEAPAPGITPELRRYIGERCAKACVDIGYRGAGTFEFLFENGEFYFIEMNTRIQVEHPVTEMITGVDLIKEQLRIAAGQPLSIKQEEVHVRGHAVECRINAEDPNTFLPSPGKITRFHAPGGFGVRWESHIYAGYTVPPYYDSMIGKLICYGENRDVAIARMKNALQELIIDGIKTNVDLQIRIMNDENFQHGGTNIHYLEKKLGLQEK,brenda,P24182,O=C(O)CCCC[C@@H]1SC[C@@H]2N=C(O)N[C@@H]21,35.1,30.666666666666668,7.266666666666667,6.3.4.14,562.0,1.545307116465824,1.545307116465824,O=C(O)CCCC[C@@H]1SC[C@@H]2N=C(O)N[C@@H]21__MLDKIVIANRGEIALRILRACKELGIKTVAVHSSADRDLKHVLLADETVCIGPAPSVKSYLNIPAIISAAEITGAVAIHPGYGFLSENANFAEQVERSGFIFIGPKAETIRLMGDKVSAIAAMKKAGVPCVPGSDGPLGDDMDKNRAIAKRIGYPVIIKASGGGGGRGMRVVRGDAELAQSISMTRAEAKAAFSNDMVYMEKYLENPRHVEIQVLADGQGNAIYLAERDCSMQRRHQKVVEEAPAPGITPELRRYIGERCAKACVDIGYRGAGTFEFLFENGEFYFIEMNTRIQVEHPVTEMITGVDLIKEQLRIAAGQPLSIKQEEVHVRGHAVECRINAEDPNTFLPSPGKITRFHAPGGFGVRWESHIYAGYTVPPYYDSMIGKLICYGENRDVAIARMKNALQELIIDGIKTNVDLQIRIMNDENFQHGGTNIHYLEKKLGLQEK,./data/raw/alphafold//AF-P24182-F1-model_v4.pdb,2938,123,134,149 +1510,13999,14200,MAVEGKQVAPKKAIIVELLKKLELGLVPDDEIKKLIRIQLGRRLQWGCKSTYEEQIAQLVNLTHSLRQMKIATEVETLDDQMYEVPIDFLKIMNGSNLKGSCCYFKNDSTTLDEAEIAMLELYCERAQIKDGHSVLDLGCGQGALTLYVAQKYKNSRVTAVTNSVSQKEFIEEESRKRNLSNVEVLLADITTHKMPDTYDRILVVELFEHMKNYELLLRKIKEWMAKDGLLFVEHICHKTFAYHYEPIDEDDWFTEYVFPAGTMIIPSASFFLYFQDDVSVVNHWTLSGKHFSRTNEEWLKRLDANVELIKPMFVTITGQCRQEAMKLINYWRGFCLSGMEMFGYNNGEEWMASHVLFKKK,sabio,Q5C9L6,COc1ccc(CC2NCCc3cc(OC)c(O)cc32)cc1O,0.041,37.0,7.5,2.1.1.115,150094.0,-1.3872161432802643,-1.3872161432802643,COc1ccc(CC2NCCc3cc(OC)c(O)cc32)cc1O__MAVEGKQVAPKKAIIVELLKKLELGLVPDDEIKKLIRIQLGRRLQWGCKSTYEEQIAQLVNLTHSLRQMKIATEVETLDDQMYEVPIDFLKIMNGSNLKGSCCYFKNDSTTLDEAEIAMLELYCERAQIKDGHSVLDLGCGQGALTLYVAQKYKNSRVTAVTNSVSQKEFIEEESRKRNLSNVEVLLADITTHKMPDTYDRILVVELFEHMKNYELLLRKIKEWMAKDGLLFVEHICHKTFAYHYEPIDEDDWFTEYVFPAGTMIIPSASFFLYFQDDVSVVNHWTLSGKHFSRTNEEWLKRLDANVELIKPMFVTITGQCRQEAMKLINYWRGFCLSGMEMFGYNNGEEWMASHVLFKKK,./data/raw/alphafold//AF-Q5C9L6-F1-model_v4.pdb,397,3562,4867,5200 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+1533,38031,38704,MVHLGPKKPQARKGSMADVPKELMDEIHQLEDMFTVDSETLRKVVKHFIDELNKGLTKKGGNIPMIPGWVMEFPTGKESGNYLAIDLGGTNLRVVLVKLSGNHTFDTTQSKYKLPHDMRTTKHQEELWSFIADSLKDFMVEQELLNTKDTLPLGFTFSYPASQNKINEGILQRWTKGFDIPNVEGHDVVPLLQNEISKRELPIEIVALINDTVGTLIASYYTDPETKMGVIFGTGVNGAFYDVVSDIEKLEGKLADDIPSNSPMAINCEYGSFDNEHLVLPRTKYDVAVDEQSPRPGQQAFEKMTSGYYLGELLRLVLLELNEKGLMLKDQDLSKLKQPYIMDTSYPARIEDDPFENLEDTDDIFQKDFGVKTTLPERKLIRRLCELIGTRAARLAVCGIAAICQKRGYKTGHIAADGSVYNKYPGFKEAAAKGLRDIYGWTGDASKDPITIVPAEDGSGAGAAVIAALSEKRIAEGKSLGIIGA,sabio,P04806,OCC1OC(O)C(O)C(O)C1O,0.15,30.0,6.5,2.7.1.1,4932.0,-0.8239087409443188,-0.6488770955603286,OCC1OC(O)C(O)C(O)C1O__MVHLGPKKPQARKGSMADVPKELMDEIHQLEDMFTVDSETLRKVVKHFIDELNKGLTKKGGNIPMIPGWVMEFPTGKESGNYLAIDLGGTNLRVVLVKLSGNHTFDTTQSKYKLPHDMRTTKHQEELWSFIADSLKDFMVEQELLNTKDTLPLGFTFSYPASQNKINEGILQRWTKGFDIPNVEGHDVVPLLQNEISKRELPIEIVALINDTVGTLIASYYTDPETKMGVIFGTGVNGAFYDVVSDIEKLEGKLADDIPSNSPMAINCEYGSFDNEHLVLPRTKYDVAVDEQSPRPGQQAFEKMTSGYYLGELLRLVLLELNEKGLMLKDQDLSKLKQPYIMDTSYPARIEDDPFENLEDTDDIFQKDFGVKTTLPERKLIRRLCELIGTRAARLAVCGIAAICQKRGYKTGHIAADGSVYNKYPGFKEAAAKGLRDIYGWTGDASKDPITIVPAEDGSGAGAAVIAALSEKRIAEGKSLGIIGA,./data/raw/alphafold//AF-P04806-F1-model_v4.pdb,2617,8344,6149,11868 +1534,27195,27661,MALLGNFLCCLLVAWLCGPGLGVPLAPADRAPAVGQFWHVTDLHLDPTYHITDDRTKVCASSKGANASNPGPFGDVLCDSPYQLILSAFDFIKNSGQEASFMIWTGDSPPHVPVPELSTGTVIKVITNMTMTVQNLFPNLQVFPALGNHDYWPQDQLPIVTSKVYSAVADLWKPWLGEEAISTLKKGGFYSQKVASNPGLRIISLNTNLYYGPNIMTLNKTDPANQFEWLENTLNSSLWNKEKVYIIAHVPVGYLPYATDTPAIRQYYNEKLLDIFRRYSSVIAGQFYGHTHRDSLMVLSDKNGNPLNSVFVAPAVTPVKGVLQKETNNPGVRLFQYKPGDYTLLDMVQYYLNLTEANLKGESNWTLEYVLTQAYSVADLQPKSLYALVQQFATKDSKQFLKYYHYYFVSYDSSATCDQHCKTLQVCAIMNLDSMSYDDCLKQHL,sabio,P70158,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,0.33,37.0,7.5,3.1.4.-,10090.0,-0.4814860601221125,-0.7260511412184514,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MALLGNFLCCLLVAWLCGPGLGVPLAPADRAPAVGQFWHVTDLHLDPTYHITDDRTKVCASSKGANASNPGPFGDVLCDSPYQLILSAFDFIKNSGQEASFMIWTGDSPPHVPVPELSTGTVIKVITNMTMTVQNLFPNLQVFPALGNHDYWPQDQLPIVTSKVYSAVADLWKPWLGEEAISTLKKGGFYSQKVASNPGLRIISLNTNLYYGPNIMTLNKTDPANQFEWLENTLNSSLWNKEKVYIIAHVPVGYLPYATDTPAIRQYYNEKLLDIFRRYSSVIAGQFYGHTHRDSLMVLSDKNGNPLNSVFVAPAVTPVKGVLQKETNNPGVRLFQYKPGDYTLLDMVQYYLNLTEANLKGESNWTLEYVLTQAYSVADLQPKSLYALVQQFATKDSKQFLKYYHYYFVSYDSSATCDQHCKTLQVCAIMNLDSMSYDDCLKQHL,./data/raw/alphafold//AF-P70158-F1-model_v4.pdb,1301,6530,8415,7906 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+1536,4481,4552,MNEQWIFLNGEFVPKDEAKVSVYDHGYLYGDGVFEGIRVYSGNVFRLREHLVRLYESAKSILLEIPYSLDEVTNIVVETIRHNKLSNGYIRLVVSRGAGNLGLDPDSCRKPNVVVIAVPISLFPQEYYEIDIPVVTVATRRNRPDVLSPQVKSLNYLNNILVRIVAKLAGVQEALMLNDQGYVAEGSGDNVFIVKGNKLITPPSSAGALEGITRNAILEIGEKLGYDVREELFTRHDVYVADEVFLTGTAAEVIAVTTVDGRTIGLGQTGPHTNRLLEEFRKLVVEDGEKIYEENKVG,sabio,Q84CY6,CC(C)C(N)C(=O)O,0.91,37.0,7.4,2.6.1.42,1396.0,-0.0409586076789063,0.2244999358729641,CC(C)C(N)C(=O)O__MNEQWIFLNGEFVPKDEAKVSVYDHGYLYGDGVFEGIRVYSGNVFRLREHLVRLYESAKSILLEIPYSLDEVTNIVVETIRHNKLSNGYIRLVVSRGAGNLGLDPDSCRKPNVVVIAVPISLFPQEYYEIDIPVVTVATRRNRPDVLSPQVKSLNYLNNILVRIVAKLAGVQEALMLNDQGYVAEGSGDNVFIVKGNKLITPPSSAGALEGITRNAILEIGEKLGYDVREELFTRHDVYVADEVFLTGTAAEVIAVTTVDGRTIGLGQTGPHTNRLLEEFRKLVVEDGEKIYEENKVG,./data/raw/alphafold//AF-Q84CY6-F1-model_v4.pdb,5056,1889,2790,2812 +1537,17070,17318,MLSNKDPLSLMAMWGSVKGYDPNQGASFEGPEKRLEVIMRIIDETHSEGLHALGDEVWKGVVGSLNAQIVSKESNEYIRSYVLTESSLFVMRDRIILITCGTTTLLNAVPFVLDAVSDVRGEVEWVSFMHKNYSFPWEQKGPHLSMAEEFNTLRTYFPSGKPFIFGPVDSDHYFLFVYDDVIRPCETENDTQLSMTMYGLDRTQTKHWFSDRFISTGTETAAIRKATKLDKVADDSWKLHDLQFEPCGYSINTIRGAEYQTIHITPEDHCSFASYETNTPAVNYSERINTVLGVFAPIRFSVIVFIDPDSDVGRLYQKGQNVGVEAEYYPKYELQNRTVNEFAPGYVVMKMNYARRAEVTEKDSTDSVEE,brenda,O76240,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,0.05,37.0,7.5,4.1.1.50,10116.0,-1.3010299956639813,-1.3010299956639813,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MLSNKDPLSLMAMWGSVKGYDPNQGASFEGPEKRLEVIMRIIDETHSEGLHALGDEVWKGVVGSLNAQIVSKESNEYIRSYVLTESSLFVMRDRIILITCGTTTLLNAVPFVLDAVSDVRGEVEWVSFMHKNYSFPWEQKGPHLSMAEEFNTLRTYFPSGKPFIFGPVDSDHYFLFVYDDVIRPCETENDTQLSMTMYGLDRTQTKHWFSDRFISTGTETAAIRKATKLDKVADDSWKLHDLQFEPCGYSINTIRGAEYQTIHITPEDHCSFASYETNTPAVNYSERINTVLGVFAPIRFSVIVFIDPDSDVGRLYQKGQNVGVEAEYYPKYELQNRTVNEFAPGYVVMKMNYARRAEVTEKDSTDSVEE,./data/raw/alphafold//AF-O76240-F1-model_v4.pdb,782,4159,5566,5956 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+1653,3403,3458,MSESLHLTRNGSILEITLDRPKANAIDAKTSFEMGEVFLNFRDDPQLRVAIITGAGEKFFSAGWDLKAAAEGEAPDADFGPGGFAGLTEIFNLDKPVIAAVNGYAFGGGFELALAADFIVCADNASFALPEAKLGIVPDSGGVLRLPKILPPAIVNEMVMTGRRMGAEEALRWGIVNRVVSQAELMDNARELAQQLVNSAPLAIAALKEIYRTTSEMPVEEAYRYIRSGVLKHYPSVLHSEDAIEGPLAFAEKRDPVWKGR,sabio,P31551,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)/C=C/C[N+](C)(C)C,0.012,37.0,7.5,4.2.1.149,562.0,-1.9208187539523751,-1.9208187539523751,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)/C=C/C[N+](C)(C)C__MSESLHLTRNGSILEITLDRPKANAIDAKTSFEMGEVFLNFRDDPQLRVAIITGAGEKFFSAGWDLKAAAEGEAPDADFGPGGFAGLTEIFNLDKPVIAAVNGYAFGGGFELALAADFIVCADNASFALPEAKLGIVPDSGGVLRLPKILPPAIVNEMVMTGRRMGAEEALRWGIVNRVVSQAELMDNARELAQQLVNSAPLAIAALKEIYRTTSEMPVEEAYRYIRSGVLKHYPSVLHSEDAIEGPLAFAEKRDPVWKGR,./data/raw/alphafold//AF-P31551-F1-model_v4.pdb,3053,283,322,373 +1654,37942,38612,MAASCVLLHTGQKMPLIGLGTWKSEPGQVKAAVKYALSVGYRHIDCAAIYGNEPEIGEALKEDVGPGKAVPREELFVTSKLWNTKHHPEDVEPALRKTLADLQLEYLDLYLMHWPYAFERGDNPFPKNADGTICYDSTHYKETWKALEALVAKGLVQALGLSNFNSRQIDDILSVASVRPAVLQVECHPYLAQNELIAHCQARGLEVTAYSPLGSSDRAWRDPDEPVLLEEPVVLALAEKYGRSPAQILLRWQVQRKVICIPKSITPSRILQNIKVFDFTFSPEEMKQLNALNKNWRYIVPMLTVDGKRVPRDAGHPLYPFNDPY,sabio,P14550,OCC1OC(O)C(O)C(O)C1O,215.0,37.0,5.3,1.1.1.2,9606.0,2.3324384599156054,2.533619144752226,OCC1OC(O)C(O)C(O)C1O__MAASCVLLHTGQKMPLIGLGTWKSEPGQVKAAVKYALSVGYRHIDCAAIYGNEPEIGEALKEDVGPGKAVPREELFVTSKLWNTKHHPEDVEPALRKTLADLQLEYLDLYLMHWPYAFERGDNPFPKNADGTICYDSTHYKETWKALEALVAKGLVQALGLSNFNSRQIDDILSVASVRPAVLQVECHPYLAQNELIAHCQARGLEVTAYSPLGSSDRAWRDPDEPVLLEEPVVLALAEKYGRSPAQILLRWQVQRKVICIPKSITPSRILQNIKVFDFTFSPEEMKQLNALNKNWRYIVPMLTVDGKRVPRDAGHPLYPFNDPY,./data/raw/alphafold//AF-P14550-F1-model_v4.pdb,2022,889,1072,1318 +1655,6313,6411,MDEFIIKRAKELQGYIVEKRRDFHMYPELKYEEERTSKIVEEELKKLGYEVVRTAKTGVIGILKGKEDGKTVALRADMDALPIQEENDVPYKSRVPGKMHACGHDAHTAMLLGAAKILAEMKDELQGTVKLIFQPAEEGGLGAKKIVEEGHLDDVDAIFGIHVWAELPSGIIGIKSGPLLASADAFRVLIKGKGGHGAAPHLSIDPIALAVDLVNAYQKIISREVDPLQPAVLSVTSIKAGTTFNVIPESAEILGTIRTFDEEVRDYIVRRMKEITENFANGMRCEGKFELTIEHIPPTINNEKLANFARDVLKVLGEIREPKPTMGAEDFAFYTTKAPGLFIFLGIRNEEKGIIYPHHHPKFNVDEDILWMGAAIHSLLTYHYLSL,brenda,O58754,CC(O)=N[C@@H](Cc1ccccc1)C(=O)O,5.2,85.0,7.5,3.5.1.14,53953.0,0.7160033436347992,0.7160033436347992,CC(O)=N[C@@H](Cc1ccccc1)C(=O)O__MDEFIIKRAKELQGYIVEKRRDFHMYPELKYEEERTSKIVEEELKKLGYEVVRTAKTGVIGILKGKEDGKTVALRADMDALPIQEENDVPYKSRVPGKMHACGHDAHTAMLLGAAKILAEMKDELQGTVKLIFQPAEEGGLGAKKIVEEGHLDDVDAIFGIHVWAELPSGIIGIKSGPLLASADAFRVLIKGKGGHGAAPHLSIDPIALAVDLVNAYQKIISREVDPLQPAVLSVTSIKAGTTFNVIPESAEILGTIRTFDEEVRDYIVRRMKEITENFANGMRCEGKFELTIEHIPPTINNEKLANFARDVLKVLGEIREPKPTMGAEDFAFYTTKAPGLFIFLGIRNEEKGIIYPHHHPKFNVDEDILWMGAAIHSLLTYHYLSL,./data/raw/alphafold//AF-O58754-F1-model_v4.pdb,3470,2430,3059,3534 +1656,40513,41247,RTMFYGKGDVYVFRTYANPLKGLKQIPESNFTEKHNTIFGMNAKVALKGEQLLTSFTEGDNSLVVATDSMKNFIQRHAASYEGATLEGFLQYVCEAFLAKYSHLDAVRLEAKEYAFDDIQVGTDKGVVTSDLVFRKSRNEYATATVEVARTASGTEVVEQASGIADIQLIKVSGSSFYGYIIDEYTTLAEATDRPLYIFLNIGWAYENQDDAKGDNPANYVAAEQVRDIAASVFHTLDNKSIQHLIYHIGLTILDRFPQLTEVNFGTNNRTWDTVVEGTDGFKGAVFTEPRPPFGFQGFSVHQEDLAREKASANSEYVAL,uniprot_search,C5HDG5,Oc1nc(O)c2nc(O)[nH]c2n1,0.042,32.5,9.75,1.7.3.3,1458.0,-1.3767507096020994,-0.7947397714027931,Oc1nc(O)c2nc(O)[nH]c2n1__RTMFYGKGDVYVFRTYANPLKGLKQIPESNFTEKHNTIFGMNAKVALKGEQLLTSFTEGDNSLVVATDSMKNFIQRHAASYEGATLEGFLQYVCEAFLAKYSHLDAVRLEAKEYAFDDIQVGTDKGVVTSDLVFRKSRNEYATATVEVARTASGTEVVEQASGIADIQLIKVSGSSFYGYIIDEYTTLAEATDRPLYIFLNIGWAYENQDDAKGDNPANYVAAEQVRDIAASVFHTLDNKSIQHLIYHIGLTILDRFPQLTEVNFGTNNRTWDTVVEGTDGFKGAVFTEPRPPFGFQGFSVHQEDLAREKASANSEYVAL,./data/raw/alphafold//AF-C5HDG5-F1-model_v4.pdb,2803,4580,6369,11831 +1657,12497,12674,MQMPKTLRIRNGDKVRSTFSAQEYANRQARLRAHLAAENIDAAIFTSYHNINYYSDFLYCSFGRPYALVVTEDDVISISANIDGGQPWRRTVGTDNIVYTDWQRDNYFAAIQQALPKARRIGIEHDHLNLQNRDKLAARYPDAELVDVAAACMRMRMIKSAEEHVMIRHGARIADIGGAAVVEALGDQVPEYEVALHATQAMVRAIADTFEDVELMDTWTWFQSGINTDGAHNPVTTRKVNKGDILSLNCFPMIAGYYTALERTLFLDHCSDDHLRLWQVNVEVHEAGLKLIKPGARCSDIARELNEIFLKHDVLQYRTFGYGHSFGTLSHYYGREAGLELREDIDTVLEPGMVVSMEPMIMLPEGLPGAGGYREHDILIVNENGAENITKFPYGPEKNIIRK,brenda,P38488,CN(CC(=O)O)C(=N)N,7.0,50.0,7.7,3.5.3.3,303.0,0.8450980400142568,0.9248730468817868,CN(CC(=O)O)C(=N)N__MQMPKTLRIRNGDKVRSTFSAQEYANRQARLRAHLAAENIDAAIFTSYHNINYYSDFLYCSFGRPYALVVTEDDVISISANIDGGQPWRRTVGTDNIVYTDWQRDNYFAAIQQALPKARRIGIEHDHLNLQNRDKLAARYPDAELVDVAAACMRMRMIKSAEEHVMIRHGARIADIGGAAVVEALGDQVPEYEVALHATQAMVRAIADTFEDVELMDTWTWFQSGINTDGAHNPVTTRKVNKGDILSLNCFPMIAGYYTALERTLFLDHCSDDHLRLWQVNVEVHEAGLKLIKPGARCSDIARELNEIFLKHDVLQYRTFGYGHSFGTLSHYYGREAGLELREDIDTVLEPGMVVSMEPMIMLPEGLPGAGGYREHDILIVNENGAENITKFPYGPEKNIIRK,./data/raw/alphafold//AF-P38488-F1-model_v4.pdb,233,3362,4607,4830 +1658,38253,38930,MSTALTQTSTNSQQSPIRRAWWKEAVVYQIYPRSFMDSNGDGIGDLRGILSKLDYLKLLGVDVLWLNPIYDSPNDDMGYDIRDYYKIMEEFGTMEDFEELLREVHARGMKLVMDLVANHTSDEHPWFIESRSSRDNPYRDWYIWRDPKDGREPNNWLSYFSGSAWEYDERTGQYYLHLFSRRQPDLNWENPKVREAIFEMMRFWLDKGIDGFRMDVINAIAKAEGLPDAPARPGERYAWGGQYFLNQPKVHEYLREMYDKVLSHYDIMTVGETGGVTTKDALLFAGEDRRELNMVFQFEHMDIDATDGDKWRPRPWRLTELKTIMTRWQNDLYGKAWNSLYWTNHDQPRAVSRFGNDGPYRVESAKMLATVLHMMQGTPYIYQGEEIGMTNCPFDSIDEYRDVEIHNLWRHRVMEGGQDPAEVLRVIQLKGRDNARTPMQWDDSPNAGFTTGTPWIKVNPNYREINVKQALADPNSIFHYYRRLIQLRKQHPIVVYGKYDLILPDHEEIWAYTRTLGDERWLIVANFFGGTPEFELPPEVRCEGAELVIANYPVDDSEAGGPAAAGAPHRFRLRPYECRVYRLLGWH,sabio,Q45517,OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1O,2.4,55.0,6.0,3.2.1.20,1409.0,0.380211241711606,0.380211241711606,OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1O__MSTALTQTSTNSQQSPIRRAWWKEAVVYQIYPRSFMDSNGDGIGDLRGILSKLDYLKLLGVDVLWLNPIYDSPNDDMGYDIRDYYKIMEEFGTMEDFEELLREVHARGMKLVMDLVANHTSDEHPWFIESRSSRDNPYRDWYIWRDPKDGREPNNWLSYFSGSAWEYDERTGQYYLHLFSRRQPDLNWENPKVREAIFEMMRFWLDKGIDGFRMDVINAIAKAEGLPDAPARPGERYAWGGQYFLNQPKVHEYLREMYDKVLSHYDIMTVGETGGVTTKDALLFAGEDRRELNMVFQFEHMDIDATDGDKWRPRPWRLTELKTIMTRWQNDLYGKAWNSLYWTNHDQPRAVSRFGNDGPYRVESAKMLATVLHMMQGTPYIYQGEEIGMTNCPFDSIDEYRDVEIHNLWRHRVMEGGQDPAEVLRVIQLKGRDNARTPMQWDDSPNAGFTTGTPWIKVNPNYREINVKQALADPNSIFHYYRRLIQLRKQHPIVVYGKYDLILPDHEEIWAYTRTLGDERWLIVANFFGGTPEFELPPEVRCEGAELVIANYPVDDSEAGGPAAAGAPHRFRLRPYECRVYRLLGWH,./data/raw/alphafold//AF-Q45517-F1-model_v4.pdb,1684,7960,8903,9157 +1659,12255,12426,MFPGARILATLTLALHLLHGTHAAIGPIADMYIVNEDVSPDGFARSAVVARSVLATDPTPASVSVPGVLVQGNKGDNFQLNVRNQLSDSTMLKTTSIRWHGFFQSGSTWADGPAFVNQCPIAPGNSFLYDFNVPDQAGTFWYHSHLSTQYCDGLRGPFVVYDPSDPHLSLYDVDNADTVITLEDWYHVAAPQGAVLPTPDSTLINGKGRFAGGPTSPLAIINVESNKRYRFRLISMSCDPNFTFSIDGHSLQVIEADAVNIVPIVVDSIQIFAGQRYSFVLNANQAVDNYWIRANPNLGSTGFEGGINSAILRYAGATENDPATTSSTSTPLLETNLVPLENPGAPGPAVPGGADININLAMGFDFTNFEMTINGSPFKAPTAPVLLQILSGATPAASLLPSGSIYALEANKVVEISIPALAVGGPHPFHLHGHTFDVIRSAGSTTYNFDTPVRRDVVNTGIDANDNVTIRFVTDNPGPWFLHCGLAVVFAEDVASIKAPPAAWDDLCPIYDALSDSDRGGIA,uniprot_search,S4VMI6,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21,0.104,30.0,3.0,1.10.3.2,228216.0,-0.9829666607012196,-0.6794946628503503,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21__MFPGARILATLTLALHLLHGTHAAIGPIADMYIVNEDVSPDGFARSAVVARSVLATDPTPASVSVPGVLVQGNKGDNFQLNVRNQLSDSTMLKTTSIRWHGFFQSGSTWADGPAFVNQCPIAPGNSFLYDFNVPDQAGTFWYHSHLSTQYCDGLRGPFVVYDPSDPHLSLYDVDNADTVITLEDWYHVAAPQGAVLPTPDSTLINGKGRFAGGPTSPLAIINVESNKRYRFRLISMSCDPNFTFSIDGHSLQVIEADAVNIVPIVVDSIQIFAGQRYSFVLNANQAVDNYWIRANPNLGSTGFEGGINSAILRYAGATENDPATTSSTSTPLLETNLVPLENPGAPGPAVPGGADININLAMGFDFTNFEMTINGSPFKAPTAPVLLQILSGATPAASLLPSGSIYALEANKVVEISIPALAVGGPHPFHLHGHTFDVIRSAGSTTYNFDTPVRRDVVNTGIDANDNVTIRFVTDNPGPWFLHCGLAVVFAEDVASIKAPPAAWDDLCPIYDALSDSDRGGIA,./data/raw/alphafold//AF-S4VMI6-F1-model_v4.pdb,5296,3332,4102,4782 +1660,22181,22528,MAVKVGINGFGRIGRNVFRAALKNPDIEVVAVNDLTDANTLAHLLKYDSVHGRLDAEVSVNGNNLVVNGKEIIVKAERDPENLAWGEIGVDIVVESTGRFTKREDAAKHLEAGAKKVIISAPAKNEDITIVMGVNQDKYDPKAHHVISNASCTTNCLAPFAKVLHEQFGIVRGMMTTVHSYTNDQRILDLPHKDLRRARAAAESIIPTTTGAAKAVALVLPELKGKLNGMAMRVPTPNVSVVDLVAELEKEVTVEEVNAALKAAAEGELKGILAYSEEPLVSRDYNGSTVSSTIDALSTMVIDGKMVKVVSWYDNETGYSHRVVDLAAYIASKGL,sabio,P00362,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,0.011,25.0,7.0,1.2.1.12,1422.0,-1.958607314841775,-1.958607314841775,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1__MAVKVGINGFGRIGRNVFRAALKNPDIEVVAVNDLTDANTLAHLLKYDSVHGRLDAEVSVNGNNLVVNGKEIIVKAERDPENLAWGEIGVDIVVESTGRFTKREDAAKHLEAGAKKVIISAPAKNEDITIVMGVNQDKYDPKAHHVISNASCTTNCLAPFAKVLHEQFGIVRGMMTTVHSYTNDQRILDLPHKDLRRARAAAESIIPTTTGAAKAVALVLPELKGKLNGMAMRVPTPNVSVVDLVAELEKEVTVEEVNAALKAAAEGELKGILAYSEEPLVSRDYNGSTVSSTIDALSTMVIDGKMVKVVSWYDNETGYSHRVVDLAAYIASKGL,./data/raw/alphafold//AF-P00362-F1-model_v4.pdb,4331,5749,7114,7140 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+1662,6492,6609,MATESPATRRVQVAEHPRLLKLKEMFNSKFGSIPKFYVRAPGRVNIIGEHIDYCGYSVLPMAVEQDVLIAVEPVKTYALQLANTNPLYPDFSTSANNIQIDKTKPLWHNYFLCGLKGIQEHFGLSNLTGMNCLVDGNIPPSSGLSSSSALVCCAGLVTLTVLGRNLSKVELAEICAKSERYIGTEGGGMDQSISFLAEEGTAKLIEFSPLRATDVKLPSGAVFVIANSCVEMNKAATSHFNIRVMECRLAAKLLAKYKSLQWDKVLRLEEVQAKLGISLEEMLLVTEDALHPEPYNPEEICRCLGISLEELRTQILSPNTQDVLIFKLYQRAKHVYSEAARVLQFKKICEEAPENMVQLLGELMNQSHMSCRDMYECSCPELDQLVDICRKFGAQGSRLTGAGWGGCTVSMVPADKLPSFLANVHKAYYQRSDGSLAPEKQSLFATKPGGGALVLLEA,uniprot_search,Q01415,CC(O)=N[C@H]1C(O)O[C@H](CO)[C@H](O)[C@@H]1O,0.04,25.0,7.0,2.7.1.157,9606.0,-1.3979400086720375,-1.1593793813122064,CC(O)=N[C@H]1C(O)O[C@H](CO)[C@H](O)[C@@H]1O__MATESPATRRVQVAEHPRLLKLKEMFNSKFGSIPKFYVRAPGRVNIIGEHIDYCGYSVLPMAVEQDVLIAVEPVKTYALQLANTNPLYPDFSTSANNIQIDKTKPLWHNYFLCGLKGIQEHFGLSNLTGMNCLVDGNIPPSSGLSSSSALVCCAGLVTLTVLGRNLSKVELAEICAKSERYIGTEGGGMDQSISFLAEEGTAKLIEFSPLRATDVKLPSGAVFVIANSCVEMNKAATSHFNIRVMECRLAAKLLAKYKSLQWDKVLRLEEVQAKLGISLEEMLLVTEDALHPEPYNPEEICRCLGISLEELRTQILSPNTQDVLIFKLYQRAKHVYSEAARVLQFKKICEEAPENMVQLLGELMNQSHMSCRDMYECSCPELDQLVDICRKFGAQGSRLTGAGWGGCTVSMVPADKLPSFLANVHKAYYQRSDGSLAPEKQSLFATKPGGGALVLLEA,./data/raw/alphafold//AF-Q01415-F1-model_v4.pdb,5655,2443,3072,3549 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+1750,18923,19197,MKLTKGCAYKYIIFTVLILANILYDNKKRCMIKKNLRISSCGIISRLLKSNSNYNSFNKNYNFTSAISELQFSNFWNLDILQKDIFSNIHNNKNKPQSYIIHKRLMSEKGDNNNNNHQNNNGNDNKKRLGSVVNNEENTCSDKRMKPFEEGHGITQVDKMNNNSDHLQQNGVMNLNSNNVENNNNNNSVVVKKNEPKIHYRKDYKPSGFIINNVTLNINIHDNETIVRSVLDMDISKHNVGEDLVFDGVGLKINEISINNKKLVEGEEYTYDNEFLTIFSKFVPKSKFAFSSEVIIHPETNYALTGLYKSKNIIVSQCEATGFRRITFFIDRPDMMAKYDVTVTADKEKYPVLLSNGDKVNEFEIPGGRHGARFNDPHLKPCYLFAVVAGDLKHLSATYITKYTKKKVELYVFSEEKYVSKLQWALECLKKSMAFDEDYFGLEYDLSRLNLVAVSDFNVGAMENKGLNIFNANSLLASKKNSIDFSYARILTVVGHEYFHNYTGNRVTLRDWFQLTLKEGLTVHRENLFSEEMTKTVTTRLSHVDLLRSVQFLEDSSPLSHPIRPESYVSMENFYTTTVYDKGSEVMRMYLTILGEEYYKKGFDIYIKKNDGNTATCEDFNYAMEQAYKMKKADNSANLNQYLLWFSQSGTPHVSFKYNYDAEKKQYSIHVNQYTKPDENQKEKKPLFIPISVGLINPENGKEMISQTTLELTKESDTFVFNNIAVKPIPSLFRGFSAPVYIEDNLTDEERILLLKYDSDAFVRYNSCTNIYMKQILMNYNEFLKAKNEKLESFNLTPVNAQFIDAIKYLLEDPHADAGFKSYIVSLPQDRYIINFVSNLDTDVLADTKEYIYKQIGDKLNDVYYKMFKSLEAKADDLTYFNDESHVDFDQMNMRTLRNTLLSLLSKAQYPNILNEIIEHSKSPYPSNWLTSLSVSAYFDKYFELYDKTYKLSKDDELLLQEWLKTVSRSDRKDIYEILKKLENEVLKDSKNPNDIRAVYLPFTNNLRRFHDISGKGYKLIAEVITKTDKFNPMVATQLCEPFKLWNKLDTKRQELMLNEMNTMLQEPNISNNLKEYLLRLTNKL,brenda,Q8IEK1,N=C(N)NCCC[C@H](N)C(O)=Nc1ccc2ccccc2c1,0.17,37.0,7.5,3.4.11.20,5833.0,-0.7695510786217261,-0.688066814265427,N=C(N)NCCC[C@H](N)C(O)=Nc1ccc2ccccc2c1__MKLTKGCAYKYIIFTVLILANILYDNKKRCMIKKNLRISSCGIISRLLKSNSNYNSFNKNYNFTSAISELQFSNFWNLDILQKDIFSNIHNNKNKPQSYIIHKRLMSEKGDNNNNNHQNNNGNDNKKRLGSVVNNEENTCSDKRMKPFEEGHGITQVDKMNNNSDHLQQNGVMNLNSNNVENNNNNNSVVVKKNEPKIHYRKDYKPSGFIINNVTLNINIHDNETIVRSVLDMDISKHNVGEDLVFDGVGLKINEISINNKKLVEGEEYTYDNEFLTIFSKFVPKSKFAFSSEVIIHPETNYALTGLYKSKNIIVSQCEATGFRRITFFIDRPDMMAKYDVTVTADKEKYPVLLSNGDKVNEFEIPGGRHGARFNDPHLKPCYLFAVVAGDLKHLSATYITKYTKKKVELYVFSEEKYVSKLQWALECLKKSMAFDEDYFGLEYDLSRLNLVAVSDFNVGAMENKGLNIFNANSLLASKKNSIDFSYARILTVVGHEYFHNYTGNRVTLRDWFQLTLKEGLTVHRENLFSEEMTKTVTTRLSHVDLLRSVQFLEDSSPLSHPIRPESYVSMENFYTTTVYDKGSEVMRMYLTILGEEYYKKGFDIYIKKNDGNTATCEDFNYAMEQAYKMKKADNSANLNQYLLWFSQSGTPHVSFKYNYDAEKKQYSIHVNQYTKPDENQKEKKPLFIPISVGLINPENGKEMISQTTLELTKESDTFVFNNIAVKPIPSLFRGFSAPVYIEDNLTDEERILLLKYDSDAFVRYNSCTNIYMKQILMNYNEFLKAKNEKLESFNLTPVNAQFIDAIKYLLEDPHADAGFKSYIVSLPQDRYIINFVSNLDTDVLADTKEYIYKQIGDKLNDVYYKMFKSLEAKADDLTYFNDESHVDFDQMNMRTLRNTLLSLLSKAQYPNILNEIIEHSKSPYPSNWLTSLSVSAYFDKYFELYDKTYKLSKDDELLLQEWLKTVSRSDRKDIYEILKKLENEVLKDSKNPNDIRAVYLPFTNNLRRFHDISGKGYKLIAEVITKTDKFNPMVATQLCEPFKLWNKLDTKRQELMLNEMNTMLQEPNISNNLKEYLLRLTNKL,./data/raw/alphafold//AF-Q8IEK1-F1-model_v4.pdb,5153,2040,1291,3049 +1751,13841,14042,MVSAHFILIHTICHGAWLWYKLIPLLQSAGHNATAIDLVASGIDPRQLEQIGTWEQYSEPLFTLIESIPEGKKVILVGESGGGINIALAAEKYPEKVSALVFHNALMPDIDHSPAFVYKKFSEVFTDWKDSIFSNYTYGNDTVTAVELGDRTLAENIFSNSPIEDVELAKHLVRKGSFFEQDLDTLPNFTSEGYGSIRRVYVYGEEDQIFSRDFQLWQINNYKPDKVYCVPSADHKIQISKVNELAQILQEVANSASDLLAVA,sabio,D1MX73,COc1cc(C=O)cc(OC)c1,11.1,25.0,4.0,4.1.2.47,316758.0,1.0453229787866574,1.0453229787866574,COc1cc(C=O)cc(OC)c1__MVSAHFILIHTICHGAWLWYKLIPLLQSAGHNATAIDLVASGIDPRQLEQIGTWEQYSEPLFTLIESIPEGKKVILVGESGGGINIALAAEKYPEKVSALVFHNALMPDIDHSPAFVYKKFSEVFTDWKDSIFSNYTYGNDTVTAVELGDRTLAENIFSNSPIEDVELAKHLVRKGSFFEQDLDTLPNFTSEGYGSIRRVYVYGEEDQIFSRDFQLWQINNYKPDKVYCVPSADHKIQISKVNELAQILQEVANSASDLLAVA,./data/raw/alphafold//AF-D1MX73-F1-model_v4.pdb,3920,959,1152,1419 +1752,16094,16330,MKAIIQTGPRSVETQEREVPTPGADELLIKVHTAGLCGSDAHAYKYDGGYEWIPIPRIMGHEYSGTVTEVGANVETFEVGDKVVEEPIHDCGHCFQCRNGQPNVCQNFSITGMHRDGAYTEYVTVTPEHVHAVPEGVPLRHAAITEPTSIATRAVLDQSVTTPGDNVLVEGPGPIGVLVAAVTDSLGANVVVSGLSQDAAYRLPLLEDLGIDTVNLEEEGGLDGRVESQTDGIGFDVVFDATGHHSGVVSGNDVVRKGGQIVVVGIPNSASELSLTSTVRGEVDINTSYGSTWTNFEQALRLMERGEIAVEKILDTSYSVDDPAAAFEAFLGSETCKPVFQFDG,brenda,D4GPB2,C[C@H](O)[C@H](O)CC(=O)C(=O)O,0.66,42.0,8.0,1.1.1.401,2246.0,-0.1804560644581313,-0.1804560644581313,C[C@H](O)[C@H](O)CC(=O)C(=O)O__MKAIIQTGPRSVETQEREVPTPGADELLIKVHTAGLCGSDAHAYKYDGGYEWIPIPRIMGHEYSGTVTEVGANVETFEVGDKVVEEPIHDCGHCFQCRNGQPNVCQNFSITGMHRDGAYTEYVTVTPEHVHAVPEGVPLRHAAITEPTSIATRAVLDQSVTTPGDNVLVEGPGPIGVLVAAVTDSLGANVVVSGLSQDAAYRLPLLEDLGIDTVNLEEEGGLDGRVESQTDGIGFDVVFDATGHHSGVVSGNDVVRKGGQIVVVGIPNSASELSLTSTVRGEVDINTSYGSTWTNFEQALRLMERGEIAVEKILDTSYSVDDPAAAFEAFLGSETCKPVFQFDG,./data/raw/alphafold//AF-D4GPB2-F1-model_v4.pdb,632,3961,5348,5688 +1753,10763,10919,MVVQKKLRAILTDEGVLIKSQSHHMFNKHGQLRSGDSLSLLSCLSCLDDGTLSSDGGSFDEDDSLELLPLNTTIPFNRILNAKYVNVGQKGFNNGKISSNPFQTENLSSSSENDDVENHSLSNDKAPVSESQSFPKKDKWDTKTNTVKVSPDDSQDNSPSLGIKDNQQLIELTFAVPKGHDVIPQKLTLLIDHVSRKSRANTGEENISSGTVEEILEKSYENSKRNRSILVIINPHGGKGTAKNLFLTKARPILVESGCKIEIAYTKYARHAIDIAKDLDISKYDTIACASGDGIPYEVINGLYRRPDRVDAFNKLAVTQLPCGSGNAMSISCHWTNNPSYAALCLVKSIETRIDLMCCSQPSYMNEWPRLSFLSQTYGVIAESDINTEFIRWMGPVRFNLGVAFNIIQGKKYPCEVFVKYAAKSKKELKVHFLENKDKNKGCLTFEPNPSPNSSPDLLSKNNINNSTKDELSPNFLNEDNFKLKYPMTEPVPRDWEKMDSELTDNLTIFYTGKMPYIAKDTKFFPAALPADGTIDLVITDARIPVTRMTPILLSLDKGSHVLEPEVIHSKILAYKIIPKVESGLFSVDGEKFPLEPLQVEIMPMLCKTLLRNGRYIDTEFESM,sabio,Q12246,CCCCCCCCCCCCCCCC(O)C(N)CO,0.0077,30.0,8.1,2.7.1.91,4932.0,-2.113509274827518,-2.113509274827518,CCCCCCCCCCCCCCCC(O)C(N)CO__MVVQKKLRAILTDEGVLIKSQSHHMFNKHGQLRSGDSLSLLSCLSCLDDGTLSSDGGSFDEDDSLELLPLNTTIPFNRILNAKYVNVGQKGFNNGKISSNPFQTENLSSSSENDDVENHSLSNDKAPVSESQSFPKKDKWDTKTNTVKVSPDDSQDNSPSLGIKDNQQLIELTFAVPKGHDVIPQKLTLLIDHVSRKSRANTGEENISSGTVEEILEKSYENSKRNRSILVIINPHGGKGTAKNLFLTKARPILVESGCKIEIAYTKYARHAIDIAKDLDISKYDTIACASGDGIPYEVINGLYRRPDRVDAFNKLAVTQLPCGSGNAMSISCHWTNNPSYAALCLVKSIETRIDLMCCSQPSYMNEWPRLSFLSQTYGVIAESDINTEFIRWMGPVRFNLGVAFNIIQGKKYPCEVFVKYAAKSKKELKVHFLENKDKNKGCLTFEPNPSPNSSPDLLSKNNINNSTKDELSPNFLNEDNFKLKYPMTEPVPRDWEKMDSELTDNLTIFYTGKMPYIAKDTKFFPAALPADGTIDLVITDARIPVTRMTPILLSLDKGSHVLEPEVIHSKILAYKIIPKVESGLFSVDGEKFPLEPLQVEIMPMLCKTLLRNGRYIDTEFESM,./data/raw/alphafold//AF-Q12246-F1-model_v4.pdb,5377,3151,3890,4532 +1754,39655,40364,MVLQQTEPTDGADRKASDGPLTVTAPVPYAAGPTLRNPFPPIADYGFLSDCETTCLISSAGSVEWLCVPRPDSPSVFGAILDRGAGHFRLGPYGVSVPAARRYLPGSLILETTWQTHTGWLIVRDALVMGPWHDIDTRSRTHRRTPMDWDAEHILLRTVRCVSGTVELVMSCEPAFDYHRVSATWEYSGPAYGEAIARASRNPDSHPTLRLTTNLRIGIEGREARARTRLTEGDNVFVALSWSKHPAPQTYEEAADKMWKTSEAWRQWINVGDFPDHPWRAYLQRSALTLKGLTYSPTGALLAAPTTSLPETPQGERNWDYRYSWIRDSTFALWGLYTLGLDREADDFFSFIADVSGANNGERHPLQVMYGVGGERSLVEEELHHLSGYDNSRPVRIGNGAYNQRQHDIWGTMLDSVYLHAKSREQIPDALWPVLKNQVEEAIKHWKEPDRGIWEVRGEPQHFTSSKIMCWVALDRGSKLAELQGEKSYAQQWRAIAEEIKADVLARGVDKRGVLTQRYGDDALDASLLLAVLTRFLPADDPRIRATVLAIADELTEDGLVLRYRVEETDDGLAGEEGTFTICSFWLVSALVEIGEISRAKHLCERLLSFASPLHLYAEEIEPRTGRHLGNFPQAFTHLALINAVVHVIRAEEEADSSGVFVPANAPM,uniprot_search,A0A8B4R2H5,OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,20.0,30.0,7.1,3.2.1.28,1772.0,1.3010299956639813,1.3010299956639813,OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O__MVLQQTEPTDGADRKASDGPLTVTAPVPYAAGPTLRNPFPPIADYGFLSDCETTCLISSAGSVEWLCVPRPDSPSVFGAILDRGAGHFRLGPYGVSVPAARRYLPGSLILETTWQTHTGWLIVRDALVMGPWHDIDTRSRTHRRTPMDWDAEHILLRTVRCVSGTVELVMSCEPAFDYHRVSATWEYSGPAYGEAIARASRNPDSHPTLRLTTNLRIGIEGREARARTRLTEGDNVFVALSWSKHPAPQTYEEAADKMWKTSEAWRQWINVGDFPDHPWRAYLQRSALTLKGLTYSPTGALLAAPTTSLPETPQGERNWDYRYSWIRDSTFALWGLYTLGLDREADDFFSFIADVSGANNGERHPLQVMYGVGGERSLVEEELHHLSGYDNSRPVRIGNGAYNQRQHDIWGTMLDSVYLHAKSREQIPDALWPVLKNQVEEAIKHWKEPDRGIWEVRGEPQHFTSSKIMCWVALDRGSKLAELQGEKSYAQQWRAIAEEIKADVLARGVDKRGVLTQRYGDDALDASLLLAVLTRFLPADDPRIRATVLAIADELTEDGLVLRYRVEETDDGLAGEEGTFTICSFWLVSALVEIGEISRAKHLCERLLSFASPLHLYAEEIEPRTGRHLGNFPQAFTHLALINAVVHVIRAEEEADSSGVFVPANAPM,./data/raw/alphafold//AF-A0A8B4R2H5-F1-model_v4.pdb,2740,8496,4546,11705 +1755,7465,7596,MDPKHQRVTLNDGHSIPVLGFGTYAPDEVPKSEAGEAAKIAIDVGFRHIDTAHAYQNEEEVGLAIRSKIADGTVKREDVFCTTKLWCTFFRPELVRKGLEQSLRKLQLDYVDLYLMHYPIAMKPGEEMFPTDEHGKTISDTVDICATWEAMEKCKDAGLAKSIGVSNFNHKQLEKILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAYSALGSSRDPKWVDQSSPVLLEDPVIGALAKKHKQSPALIALRYQLQRGVVVLAKSFIEREIKENIKVFGFQLSSEDMKALDGLNQNLRYCPAHFYIGHPHYPFSDEY,brenda,J7M9D0,CC1(C)[C@H]2CC[C@]1(C)C(=O)C2=O,0.0029,25.0,7.4,1.1.1.239,9986.0,-2.537602002101044,-2.537602002101044,CC1(C)[C@H]2CC[C@]1(C)C(=O)C2=O__MDPKHQRVTLNDGHSIPVLGFGTYAPDEVPKSEAGEAAKIAIDVGFRHIDTAHAYQNEEEVGLAIRSKIADGTVKREDVFCTTKLWCTFFRPELVRKGLEQSLRKLQLDYVDLYLMHYPIAMKPGEEMFPTDEHGKTISDTVDICATWEAMEKCKDAGLAKSIGVSNFNHKQLEKILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAYSALGSSRDPKWVDQSSPVLLEDPVIGALAKKHKQSPALIALRYQLQRGVVVLAKSFIEREIKENIKVFGFQLSSEDMKALDGLNQNLRYCPAHFYIGHPHYPFSDEY,./data/raw/esmfold//ESMFold-J7M9D0-v1.pdb,2022,202,1007,1239 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+1806,18750,19022,MKILKTLTLRGPNYWSIRRKKLIVMRLDLEDLAERPSNSIPGFYEGLIRVLPSLVEHFCSPGHRGGFLARVREGTYMGHIVEHVALELQELVGMTAGFGRTRETSTPGIYNVVYEYVDEQAGRYAGRAAVRLCRSLVDTGDYSLTELEKDLEDLRDLGANSALGPSTETIVTEADARKIPWMLLSARAMVQLGYGVHQQRIQATLSSHSGILGVELACDKEGTKTILQDAGIPVPRGTTIQYFDDLEEAINDVGGYPVVIKPLDGNHGRGITINVRHWEEAIAAYDLAAEESKSRSIIVERYYEGSDHRVLVVNGKLVAVAERIPAHVTGDGTSTITELIDKTNQDPNRGDGHANILTKIVVNKTAIDVMERQGYNLDSVLPKDEVVYLRATANLSTGGIAIDRTDDIHPENIWLMERVAKVIGLDIAGIDVVTSDISKPLRETNGVIVEVNAAPGFRMHVAPSQGLPRNVAAPVLDMLFPSGTPSRIPILAVTGTNGKTTTTRLLAHIYRQTGKTVGYTSTDAIYINEYCVEKGDNTGPQSAAVILRDPTVEVAVLETARGGILRAGLAFDTCDVGVVLNVAADHLGLGDIDTIEQMAKVKSVIAEVVDPSGYAVLNADDPLVAAMADKVKAKVAYFSMNPDNPVIQNHIRRNGIAAVYESGYVSILEGSWTLRVEEATLIPMTMGGMAPFMIANALAACLAAFVNGLDVEVIRQGVRTFTTSAEQTPGRMNLFNLGRYHALVDYAHNPAGYRAVGDFVKNWHGQRFGVVGGPGDRRDSDLIELGQIAAQVFDRIIVKEDDDKRGRSGGETADLIVKGILQENPGAAYEVILDETVALNKALDQVEEKGLVVVFPESVSKAIELIKARKPIG,sabio,P73833,N=C(N)NCCCC(N)C(=O)O,0.049,28.0,8.2,6.3.2.30,1143.0,-1.3098039199714864,-1.3098039199714864,N=C(N)NCCCC(N)C(=O)O__MKILKTLTLRGPNYWSIRRKKLIVMRLDLEDLAERPSNSIPGFYEGLIRVLPSLVEHFCSPGHRGGFLARVREGTYMGHIVEHVALELQELVGMTAGFGRTRETSTPGIYNVVYEYVDEQAGRYAGRAAVRLCRSLVDTGDYSLTELEKDLEDLRDLGANSALGPSTETIVTEADARKIPWMLLSARAMVQLGYGVHQQRIQATLSSHSGILGVELACDKEGTKTILQDAGIPVPRGTTIQYFDDLEEAINDVGGYPVVIKPLDGNHGRGITINVRHWEEAIAAYDLAAEESKSRSIIVERYYEGSDHRVLVVNGKLVAVAERIPAHVTGDGTSTITELIDKTNQDPNRGDGHANILTKIVVNKTAIDVMERQGYNLDSVLPKDEVVYLRATANLSTGGIAIDRTDDIHPENIWLMERVAKVIGLDIAGIDVVTSDISKPLRETNGVIVEVNAAPGFRMHVAPSQGLPRNVAAPVLDMLFPSGTPSRIPILAVTGTNGKTTTTRLLAHIYRQTGKTVGYTSTDAIYINEYCVEKGDNTGPQSAAVILRDPTVEVAVLETARGGILRAGLAFDTCDVGVVLNVAADHLGLGDIDTIEQMAKVKSVIAEVVDPSGYAVLNADDPLVAAMADKVKAKVAYFSMNPDNPVIQNHIRRNGIAAVYESGYVSILEGSWTLRVEEATLIPMTMGGMAPFMIANALAACLAAFVNGLDVEVIRQGVRTFTTSAEQTPGRMNLFNLGRYHALVDYAHNPAGYRAVGDFVKNWHGQRFGVVGGPGDRRDSDLIELGQIAAQVFDRIIVKEDDDKRGRSGGETADLIVKGILQENPGAAYEVILDETVALNKALDQVEEKGLVVVFPESVSKAIELIKARKPIG,./data/raw/alphafold//AF-P73833-F1-model_v4.pdb,3005,213,235,270 +1807,22242,22589,MKKIPLGTTDITLSRMGLGTWAIGGGPAWNGDLDRQICIDTILEAHRCGINLIDTAPGYNFGNSEVIVGQALKKLPREQVVVETKCGIVWERKGSLFNKVGDRQLYKNLSPESIREEVAASLQRLGIDYIDIYMTHWQSVPPFFTPIAETVAVLNELKSEGKIRAIGAANVDADHIREYLQYGELDIIQAKYSILDRAMENELLPLCRDNGIVVQVYSPLEQGLLTGTITRDYVPGGARANKVWFQRENMLKVIDMLEQWQPLCARYQCTIPTLALAWILKQSDLISILSGATAPEQVRENVAALNINLSDADATLMREMAEALER,sabio,P77256,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,0.052,25.0,7.0,1.1.1.-,562.0,-1.2839966563652008,-1.2839966563652008,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1__MKKIPLGTTDITLSRMGLGTWAIGGGPAWNGDLDRQICIDTILEAHRCGINLIDTAPGYNFGNSEVIVGQALKKLPREQVVVETKCGIVWERKGSLFNKVGDRQLYKNLSPESIREEVAASLQRLGIDYIDIYMTHWQSVPPFFTPIAETVAVLNELKSEGKIRAIGAANVDADHIREYLQYGELDIIQAKYSILDRAMENELLPLCRDNGIVVQVYSPLEQGLLTGTITRDYVPGGARANKVWFQRENMLKVIDMLEQWQPLCARYQCTIPTLALAWILKQSDLISILSGATAPEQVRENVAALNINLSDADATLMREMAEALER,./data/raw/alphafold//AF-P77256-F1-model_v4.pdb,3428,899,1084,1336 +1808,28524,29027,MSERAKLQKKKKVTEDLLDSLLLLPPWRNFAISQSHQSIIESSSQRLPEKMRIDENEGVSASSKHLVFAYYVTGHGFGHATRVVEVVRHLIAAGHDVHVVTGAPDFVFTSEIQSPRLKIRKVLLDCGAVQADALTVDRLASLEKYVETAVVPRAEILETEVEWLHSIKADFVVSDVVPVACRAAADAGIRSVCVTNFSWDFIYAEYVMAAGYHHRSIVWQIAEDYSHCEFLIRLPGYCPMPAFRDVIDVPLVVRRLHKSRKEVRKELGIAEDVNVVILNFGGQPSGWNLKETSLPTGWLCLVCGASETLELPPNFIKLAKDAYTPDIIAASDCMLGKIGYGTVSEALSYKVPFVFVRRDYFNEEPFLRNMLEFYQCGVEMIRRDLLMGQWTPYLERAVSLKPCYEGGINGGEIAAHILQETAIGRHCASDKLSGARRLRDAIILGYQLQRVPGRDIAIPEWYSRAENELGQSAGSSPTVQANENNSLVESCIDDFDILQGDVQGLSDTCTFLKSLAMLDAIHDSEKSTEKKTVRERKAAGGLFNWEEEIFVARAPGRLDVMGGIADYSGSLVLQMPIREACHVAVQRNLPGKHRLWKHAQARQQAKGQVPTPVLQIVSYGSEISNRAPTFDMDLSDFMDGDEPISYEKARKFFAQDPAQKWAAYVAGTILVLMIELGVRFEDSISLLVSSAVPEGKGVSSSAAVEVASMSAIAAAHGLSIDPRDLAILCQKVENHIVGAPCGVMDQMTSSCGEANKLLAMICQPAEVVGLVEIPNHVRFWGIDSGIRHSVGGADYRSVRVGAYMGRKMIKSMASSILSPSASSANGGNPEELEDEGIDLLEAEASLDYLCNLSPHRYEARYADKLPDIMLGQTFIEEYADHDDPVTVIDQKRSYSVKAPARHPIYENFRVKTFKALLTSATSDEQLTALGGLLYQCHYSYSACGLGSDGTNRLVQLVQGMQHNKSNSEDGTLYGAKITGGGSGGTVCVVGRNSLRSSQQILEIQQRYKAATGYLPLIFEGSSPGAGKFGYLRIRRRISL,brenda,O23461,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.005,30.0,8.0,2.7.1.46,3702.0,-2.3010299956639813,-2.3010299956639813,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MSERAKLQKKKKVTEDLLDSLLLLPPWRNFAISQSHQSIIESSSQRLPEKMRIDENEGVSASSKHLVFAYYVTGHGFGHATRVVEVVRHLIAAGHDVHVVTGAPDFVFTSEIQSPRLKIRKVLLDCGAVQADALTVDRLASLEKYVETAVVPRAEILETEVEWLHSIKADFVVSDVVPVACRAAADAGIRSVCVTNFSWDFIYAEYVMAAGYHHRSIVWQIAEDYSHCEFLIRLPGYCPMPAFRDVIDVPLVVRRLHKSRKEVRKELGIAEDVNVVILNFGGQPSGWNLKETSLPTGWLCLVCGASETLELPPNFIKLAKDAYTPDIIAASDCMLGKIGYGTVSEALSYKVPFVFVRRDYFNEEPFLRNMLEFYQCGVEMIRRDLLMGQWTPYLERAVSLKPCYEGGINGGEIAAHILQETAIGRHCASDKLSGARRLRDAIILGYQLQRVPGRDIAIPEWYSRAENELGQSAGSSPTVQANENNSLVESCIDDFDILQGDVQGLSDTCTFLKSLAMLDAIHDSEKSTEKKTVRERKAAGGLFNWEEEIFVARAPGRLDVMGGIADYSGSLVLQMPIREACHVAVQRNLPGKHRLWKHAQARQQAKGQVPTPVLQIVSYGSEISNRAPTFDMDLSDFMDGDEPISYEKARKFFAQDPAQKWAAYVAGTILVLMIELGVRFEDSISLLVSSAVPEGKGVSSSAAVEVASMSAIAAAHGLSIDPRDLAILCQKVENHIVGAPCGVMDQMTSSCGEANKLLAMICQPAEVVGLVEIPNHVRFWGIDSGIRHSVGGADYRSVRVGAYMGRKMIKSMASSILSPSASSANGGNPEELEDEGIDLLEAEASLDYLCNLSPHRYEARYADKLPDIMLGQTFIEEYADHDDPVTVIDQKRSYSVKAPARHPIYENFRVKTFKALLTSATSDEQLTALGGLLYQCHYSYSACGLGSDGTNRLVQLVQGMQHNKSNSEDGTLYGAKITGGGSGGTVCVVGRNSLRSSQQILEIQQRYKAATGYLPLIFEGSSPGAGKFGYLRIRRRISL,./data/raw/alphafold//AF-O23461-F1-model_v4.pdb,1556,6865,8730,8958 +1809,14083,14286,MDLVMLLVLTLTCLILLSIWRQSSGRGKLPPGPIPLPIIGNIFQLNVKNITQSLTSFSKVYGPVFTLYFGTKPTVILHGYEAVKEALIDHGEEFAERGSFPVAEKINKDLGIVFSHGNRWKEIRRFTLTTLRNLGMGKRNIEDRVQEEARCLVEELRKTNGSPCDPTFILGCAPCNVICSIIFQNRFDYKDQDFLNLMEKLNENMKILSSPWTQFCSFFPVLIDYCPGSHTTLAKNVYHIRNYLLKKIKEHQESLDVTNPRDFIDYYLIKWKQENHNPHSEFTLENLSITVTDLFGAGTETTSTTLRYALLLLLKCPEVTAKVQEEIDRVVGKHRSPCMQDRSRMPYTDAHDHEVQRFIDLIPTNLPHAVTCDIKFRNYLIPKGTTIITSLSSVLHDSKEFPDPEIFDPGHFLDGNGKFKKSDYFMPFSAGKRMCAGEGLARMELFLFLTTILQNFKLKSVLHPKDIDTTPVFNGFASLPPFYELCFIPL,sabio,P05178,COc1ccc2[nH]cc(CCN(C(C)C)C(C)C)c2c1,0.161,37.0,7.4,1.14.14.1,10116.0,-0.7931741239681502,-0.8498762194029577,COc1ccc2[nH]cc(CCN(C(C)C)C(C)C)c2c1__MDLVMLLVLTLTCLILLSIWRQSSGRGKLPPGPIPLPIIGNIFQLNVKNITQSLTSFSKVYGPVFTLYFGTKPTVILHGYEAVKEALIDHGEEFAERGSFPVAEKINKDLGIVFSHGNRWKEIRRFTLTTLRNLGMGKRNIEDRVQEEARCLVEELRKTNGSPCDPTFILGCAPCNVICSIIFQNRFDYKDQDFLNLMEKLNENMKILSSPWTQFCSFFPVLIDYCPGSHTTLAKNVYHIRNYLLKKIKEHQESLDVTNPRDFIDYYLIKWKQENHNPHSEFTLENLSITVTDLFGAGTETTSTTLRYALLLLLKCPEVTAKVQEEIDRVVGKHRSPCMQDRSRMPYTDAHDHEVQRFIDLIPTNLPHAVTCDIKFRNYLIPKGTTIITSLSSVLHDSKEFPDPEIFDPGHFLDGNGKFKKSDYFMPFSAGKRMCAGEGLARMELFLFLTTILQNFKLKSVLHPKDIDTTPVFNGFASLPPFYELCFIPL,./data/raw/alphafold//AF-P05178-F1-model_v4.pdb,3222,878,4886,3159 +1810,39163,39861,MYSFPNSFRFGWSQAGFQSEMGTPGSEDPNTDWYKWVHDPENMAAGLVSGDLPENGPGYWGNYKTFHDNAQKMGLKIARLNVEWSRIFPNPLPRPQNFDESKQDVTEVEINENELKRLDEYANKDALNHYREIFKDLKSRGLYFILNMYHWPLPLWLHDPIRVRRGDFTGPSGWLSTRTVYEFARFSAYIAWKFDDLVDEYSTMNEPNVVGGLGYVGVKSGFPPGYLSFELSRRAMYNIIQAHARAYDGIKSVSKKPVGIIYANSSFQPLTDKDMEAVEMAENDNRWWFFDAIIRGEITRGNEKIVRDDLKGRLDWIGVNYYTRTVVKRTEKGYVSLGGYGHGCERNSVSLAGLPTSDFGWEFFPEGLYDVLTKYWNRYHLYMYVTENGIADDADYQRPYYLVSHVYQVHRAINSGADVRGYLHWSLADNYEWASGFSMRFGLLKVDYNTKRLYWRPSALVYREIATNGAITDEIEHLNSVPPVKPLRH,brenda,P22498,OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O,14.2,30.0,6.5,3.2.1.23,47770.0,1.1522883443830565,1.1522883443830565,OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O__MYSFPNSFRFGWSQAGFQSEMGTPGSEDPNTDWYKWVHDPENMAAGLVSGDLPENGPGYWGNYKTFHDNAQKMGLKIARLNVEWSRIFPNPLPRPQNFDESKQDVTEVEINENELKRLDEYANKDALNHYREIFKDLKSRGLYFILNMYHWPLPLWLHDPIRVRRGDFTGPSGWLSTRTVYEFARFSAYIAWKFDDLVDEYSTMNEPNVVGGLGYVGVKSGFPPGYLSFELSRRAMYNIIQAHARAYDGIKSVSKKPVGIIYANSSFQPLTDKDMEAVEMAENDNRWWFFDAIIRGEITRGNEKIVRDDLKGRLDWIGVNYYTRTVVKRTEKGYVSLGGYGHGCERNSVSLAGLPTSDFGWEFFPEGLYDVLTKYWNRYHLYMYVTENGIADDADYQRPYYLVSHVYQVHRAINSGADVRGYLHWSLADNYEWASGFSMRFGLLKVDYNTKRLYWRPSALVYREIATNGAITDEIEHLNSVPPVKPLRH,./data/raw/alphafold//AF-P22498-F1-model_v4.pdb,2516,3481,4744,5003 +1811,19120,19396,MSTNEGSLWGGRFAGGPSDALAALSKSTHFDWVLAPYDLTASRAHTMVLFRAGLLTEEQRDGLLAGLDSLAQDVADGSFGPLVTDEDVHAALERGLIDRVGPDLGGRLRAGRSRNDQVAALFRMWLRDAVRRVATGVLDVVGALAEQAAAHPSAIMPGKTHLQSAQPILLAHHLLAHAHPLLRDLDRIVDFDKRAAVSPYGSGALAGSSLGLDPDAIAADLGFSAAADNSVDATAARDFAAEAAFVFAMIAVDLSRLAEDIIVWSSTEFGYVTLHDSWSTGSSIMPQKKNPDIAELARGKSGRLIGNLAGLLATLKAQPLAYNRDLQEDKEPVFDSVAQLELLLPAMAGLVASLTFNVQRMAELAPAGYTLATDLAEWLVRQGVPFRSAHEAAGAAVRAAEQRGVGLQELTDDELAAISPELTPQVREVLTIEGSVSARDCRGGTAPGRVAEQLNAIGEAAERLRRQLVR,brenda,P9WPY7,N=C(NCCC[C@H](N)C(=O)O)N[C@@H](CC(=O)O)C(=O)O,0.112,25.0,7.4,4.3.2.1,1773.0,-0.9507819773298184,-0.9507819773298184,N=C(NCCC[C@H](N)C(=O)O)N[C@@H](CC(=O)O)C(=O)O__MSTNEGSLWGGRFAGGPSDALAALSKSTHFDWVLAPYDLTASRAHTMVLFRAGLLTEEQRDGLLAGLDSLAQDVADGSFGPLVTDEDVHAALERGLIDRVGPDLGGRLRAGRSRNDQVAALFRMWLRDAVRRVATGVLDVVGALAEQAAAHPSAIMPGKTHLQSAQPILLAHHLLAHAHPLLRDLDRIVDFDKRAAVSPYGSGALAGSSLGLDPDAIAADLGFSAAADNSVDATAARDFAAEAAFVFAMIAVDLSRLAEDIIVWSSTEFGYVTLHDSWSTGSSIMPQKKNPDIAELARGKSGRLIGNLAGLLATLKAQPLAYNRDLQEDKEPVFDSVAQLELLLPAMAGLVASLTFNVQRMAELAPAGYTLATDLAEWLVRQGVPFRSAHEAAGAAVRAAEQRGVGLQELTDDELAAISPELTPQVREVLTIEGSVSARDCRGGTAPGRVAEQLNAIGEAAERLRRQLVR,./data/raw/alphafold//AF-P9WPY7-F1-model_v4.pdb,1696,4809,6643,6598 +1812,33817,34416,MSSPAQPAVPAPLANLKIQHTKIFINNEWHNSLNGKKFPVINPATEEVICHVEEGDKADVDKAVKAARQAFQIGSPWRTMDASERGCLLNKLADLMERDRVLLATMESMNAGKIFTHAYLLDTEVSIKALKYFAGWADKIHGQTIPSDGDVFTYTRREPIGVCGQIIPWNGPLILFIWKIGAALSCGNTVIVKPAEQTPLTALYMASLIKEAGFPPGVVNVVPGYGSTAGAAISSHMDIDKVSFTGSTEVGKLIKEAAGKSNLKRVTLELGGKSPCIVFADADLDSAVEFAHQGVFFHQGQICVAASRLFVEESIYDEFVRRSVERAKKYVLGNPLDSGISQGPQIDKEQHAKILDLIESGKKEGAKLECGGGRWGNKGFFVQPTVFSNVTDEMRIAKEEIFGPVQQIMKFKSIDEVIKRANNTPYGLAAGVFTKDLDRAITVSSALQAGTVWVNCYLTLSVQCPFGGFKMSGNGREMGEQGVYEYTELKTVAMKISQKNS,sabio,P13601,O=Cc1ccc(C(=O)O)cc1,0.0058,25.0,9.6,1.2.1.3,10116.0,-2.2365720064370627,-2.2365720064370627,O=Cc1ccc(C(=O)O)cc1__MSSPAQPAVPAPLANLKIQHTKIFINNEWHNSLNGKKFPVINPATEEVICHVEEGDKADVDKAVKAARQAFQIGSPWRTMDASERGCLLNKLADLMERDRVLLATMESMNAGKIFTHAYLLDTEVSIKALKYFAGWADKIHGQTIPSDGDVFTYTRREPIGVCGQIIPWNGPLILFIWKIGAALSCGNTVIVKPAEQTPLTALYMASLIKEAGFPPGVVNVVPGYGSTAGAAISSHMDIDKVSFTGSTEVGKLIKEAAGKSNLKRVTLELGGKSPCIVFADADLDSAVEFAHQGVFFHQGQICVAASRLFVEESIYDEFVRRSVERAKKYVLGNPLDSGISQGPQIDKEQHAKILDLIESGKKEGAKLECGGGRWGNKGFFVQPTVFSNVTDEMRIAKEEIFGPVQQIMKFKSIDEVIKRANNTPYGLAAGVFTKDLDRAITVSSALQAGTVWVNCYLTLSVQCPFGGFKMSGNGREMGEQGVYEYTELKTVAMKISQKNS,./data/raw/alphafold//AF-P13601-F1-model_v4.pdb,3125,2840,805,2166 +1813,13391,13585,MLRRALLLSSSAILAVKAQQAGTATAENHPPLTWQECTAPGSCTTQNGAVVLDANWRWVHDVNGYTNCYTGNTWDPTYCPDDETCAQNCALDGADYEGTYGVTSSGSSLKLNFVTGSNVGSRLYLLQDDSTYQIFKLLNREFSFDVDVSNLPCGLNGALYFVAMDADGGVSKYPNNKAGAKYGTGYCDSQCPRDLKFIDGEANVEGWQPSSNNANTGIGDHGSCCAEMDVWEANSISNAVTPHPCDTPGQTMCSGDDCGGTYSNDRYAGTCDPDGCDFNPYRMGNTSFYGPGKIIDTTKPFTVVTQFLTDDGTDTGTLSEIKRFYIQNSNVIPQPNSDISGVTGNSITTEFCTAQKQAFGDTDDFSQHGGLAKMGAAMQQGMVLVMSLWDDYAAQMLWLDSDYPTDADPTTPGIARGTCPTDSGVPSDVESQSPNSYVTYSNIKFGPINSTFTAS,brenda,Q8TFL9,CO[C@@H]1[C@@H](O)[C@@H](O)O[C@H](CO)[C@H]1O[C@@H]1O[C@H](COc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@H](O)[C@H]1O,10.7,78.0,3.6,3.2.1.176,68825.0,1.0293837776852095,1.0293837776852095,CO[C@@H]1[C@@H](O)[C@@H](O)O[C@H](CO)[C@H]1O[C@@H]1O[C@H](COc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@H](O)[C@H]1O__MLRRALLLSSSAILAVKAQQAGTATAENHPPLTWQECTAPGSCTTQNGAVVLDANWRWVHDVNGYTNCYTGNTWDPTYCPDDETCAQNCALDGADYEGTYGVTSSGSSLKLNFVTGSNVGSRLYLLQDDSTYQIFKLLNREFSFDVDVSNLPCGLNGALYFVAMDADGGVSKYPNNKAGAKYGTGYCDSQCPRDLKFIDGEANVEGWQPSSNNANTGIGDHGSCCAEMDVWEANSISNAVTPHPCDTPGQTMCSGDDCGGTYSNDRYAGTCDPDGCDFNPYRMGNTSFYGPGKIIDTTKPFTVVTQFLTDDGTDTGTLSEIKRFYIQNSNVIPQPNSDISGVTGNSITTEFCTAQKQAFGDTDDFSQHGGLAKMGAAMQQGMVLVMSLWDDYAAQMLWLDSDYPTDADPTTPGIARGTCPTDSGVPSDVESQSPNSYVTYSNIKFGPINSTFTAS,./data/raw/alphafold//AF-Q8TFL9-F1-model_v4.pdb,327,3495,4760,5022 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+1815,30611,31151,KCGHMAGKVLVAVSEHVNRLVAARLQFDVMGVETVLVARTDAVAATLIQTNVDARDHQFIVGATNPGLRGQSLAAVLSAGMSAGKSGRELQGIEDEWLAAAQLKTFSECVRDAIAGLGVAAQEKQRRLQEWDRATGGYDRCVSNDQARDIAASLGVTSVFWDWD,uniprot_search,O24588,O=C(O)CC(C(=O)O)C(O)C(=O)O,0.06,30.0,7.4,4.1.3.1,4577.0,-1.2218487496163564,-0.8079513875375061,O=C(O)CC(C(=O)O)C(O)C(=O)O__KCGHMAGKVLVAVSEHVNRLVAARLQFDVMGVETVLVARTDAVAATLIQTNVDARDHQFIVGATNPGLRGQSLAAVLSAGMSAGKSGRELQGIEDEWLAAAQLKTFSECVRDAIAGLGVAAQEKQRRLQEWDRATGGYDRCVSNDQARDIAASLGVTSVFWDWD,./data/raw/alphafold//AF-O24588-F1-model_v4.pdb,1808,7253,9194,9518 +1816,28301,28794,MKIGIVTGIPGVGKSTVLAKVKEILDNQGINNKIINYGDFMLATALKLGYAKDRDEMRKLSVEKQKKLQIDAAKGIAEEARAGGEGYLFIDTHAVIRTPSGYLPGLPSYVITEINPSVIFLLEADPKIILSRQKRDTTRNRNDYSDESVILETINFARYAATASAVLAGSTVKVIVNVEGDPSIAANEIIRSMK,brenda,P35028,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,1.1,90.0,5.65,2.7.4.3,2285.0,0.041392685158225,0.041392685158225,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MKIGIVTGIPGVGKSTVLAKVKEILDNQGINNKIINYGDFMLATALKLGYAKDRDEMRKLSVEKQKKLQIDAAKGIAEEARAGGEGYLFIDTHAVIRTPSGYLPGLPSYVITEINPSVIFLLEADPKIILSRQKRDTTRNRNDYSDESVILETINFARYAATASAVLAGSTVKVIVNVEGDPSIAANEIIRSMK,./data/raw/alphafold//AF-P35028-F1-model_v4.pdb,1436,6691,6218,11944 +1817,33761,34360,MSNSLEALKATGTVIVTDTGEFESIAKYKPQDATTNPSLILAVSKKPEYAALVDAAAKAATGANAKEKASNALDILLVEFGTKILEIVPGRVSTEVDARLSFDKDATIKKALHIIELYKQKGISKDRVLIKIASTWEGIQAAAELEAKHGIHCNLTLLFSFVQAVTAAEAKATLISPFVGRILDWYKKSTGKTYESSEDPGVHSVKSIYNYYKKFGYDTIVMGASFRNTGEIKELAGVDYLTVSPALLEELVNSTEAVPKKLEKSQATSLDLEKVSYINDEAKFRFELNEDQMATEKLSEGIRKFAADAVTMLEELEKRVA,brenda,Q0E4W0,O=C[C@H](O)[C@H](O)COP(=O)(O)O,0.013,20.0,6.0,2.2.1.2,409370.0,-1.8860566476931635,-1.8860566476931635,O=C[C@H](O)[C@H](O)COP(=O)(O)O__MSNSLEALKATGTVIVTDTGEFESIAKYKPQDATTNPSLILAVSKKPEYAALVDAAAKAATGANAKEKASNALDILLVEFGTKILEIVPGRVSTEVDARLSFDKDATIKKALHIIELYKQKGISKDRVLIKIASTWEGIQAAAELEAKHGIHCNLTLLFSFVQAVTAAEAKATLISPFVGRILDWYKKSTGKTYESSEDPGVHSVKSIYNYYKKFGYDTIVMGASFRNTGEIKELAGVDYLTVSPALLEELVNSTEAVPKKLEKSQATSLDLEKVSYINDEAKFRFELNEDQMATEKLSEGIRKFAADAVTMLEELEKRVA,./data/raw/alphafold//AF-Q0E4W0-F1-model_v4.pdb,2114,5627,4411,10124 +1818,6662,6788,MWSRRIPLFIFGVLVLILSVAAEDVVWRWSCDNGKCVKLKNDPRSSEPALSLEACKMFCNEYGLLWPRPTGEADLGNFLSKINLNSIEVKILKKGATDDLMEAAAKRFKEQVSLAIPRGSTPKLTGKAVDVYLVNENPNEKAFSLEMDESYGLRVSPSGADRVNATITANSFFGMRHGLETLSQLFVFDDIRDHLLMVRDVNISDKPVYPYRGILLDTARNYYSIESIKRTIEAMAAVKLNTFHWHITDSQSFPFVTTKRPNLYKFGALSPQKVYTKAAIREVVRFGLERGVRVLPEFDAPAHVGEGWQDTDLTVCFKAEPWKSYCVEPPCGQLNPTKDELYQYLEDIYSDMAEVFDTTDIFHMGGDEVSEACWNSSDSIQNFMMQNRWDLDKESFLKLWNYFQQKAQDKAYKAFGKKLPLILWTSTLTNYKHIDDYLNKDDYIIQVWTTGVDPQIKGLLEKGYRLIMSNYDALYFDCGYGAWVGAGNNWCSPYIGWQKVYDNSPAVIALEHRDQVLGGEAALWSEQSDTSTLDGRLWPRAAALAERLWAEPATSWQDAEYRMLHIRERLVRMGIQAESLQPEWCYQNEGYCYS,brenda,Q06GJ0,CC(O)=N[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](N=C(C)O)C(O)O[C@@H]2CO)O[C@H](CO)[C@@H](O)[C@@H]1O,0.3,25.0,7.0,3.2.1.52,93504.0,-0.5228787452803376,-0.5228787452803376,CC(O)=N[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](N=C(C)O)C(O)O[C@@H]2CO)O[C@H](CO)[C@@H](O)[C@@H]1O__MWSRRIPLFIFGVLVLILSVAAEDVVWRWSCDNGKCVKLKNDPRSSEPALSLEACKMFCNEYGLLWPRPTGEADLGNFLSKINLNSIEVKILKKGATDDLMEAAAKRFKEQVSLAIPRGSTPKLTGKAVDVYLVNENPNEKAFSLEMDESYGLRVSPSGADRVNATITANSFFGMRHGLETLSQLFVFDDIRDHLLMVRDVNISDKPVYPYRGILLDTARNYYSIESIKRTIEAMAAVKLNTFHWHITDSQSFPFVTTKRPNLYKFGALSPQKVYTKAAIREVVRFGLERGVRVLPEFDAPAHVGEGWQDTDLTVCFKAEPWKSYCVEPPCGQLNPTKDELYQYLEDIYSDMAEVFDTTDIFHMGGDEVSEACWNSSDSIQNFMMQNRWDLDKESFLKLWNYFQQKAQDKAYKAFGKKLPLILWTSTLTNYKHIDDYLNKDDYIIQVWTTGVDPQIKGLLEKGYRLIMSNYDALYFDCGYGAWVGAGNNWCSPYIGWQKVYDNSPAVIALEHRDQVLGGEAALWSEQSDTSTLDGRLWPRAAALAERLWAEPATSWQDAEYRMLHIRERLVRMGIQAESLQPEWCYQNEGYCYS,./data/raw/alphafold//AF-Q06GJ0-F1-model_v4.pdb,5750,2547,3190,3677 +1819,14079,14282,MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG,uniprot_search,P14902,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1,0.113,37.0,6.5,1.13.11.52,9606.0,-0.9469215565165804,-1.1724307825943088,COc1ccc2[nH]cc(CC(N)C(=O)O)c2c1__MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG,./data/raw/alphafold//AF-P14902-F1-model_v4.pdb,1117,6276,4917,5221 +1820,40828,41566,MAMQKIFAREILDSRGNPTVEVDLHTAKGRFRAAVPSGASTGIYEALELRDGDKSRYLGKGVLKAVEHINKTLGPALLEKKLSVVDQEKVDKFMIELDGTENKSKFGANAILGVSLAVCKAGAAEKGVPLYRHIADLAGNHDLVLPVPAFNVINGGSHAGNKLAMQEFMILPVGASSFREAMRIGAEVYHHLKGVIKAKYGKDATNVGDEGGFAPNILENNEALELLKTAIQAAGYPDKVVIGMDVAASEFHRNGKYDLDFKSPDDPARHITGQKLGELYKSFIKNYPVVSIEDPFDQDDWATWTSFLSGVDIQIVGDDLTVTNPKRIAQAVEKKACNCLLLKVNQIGSVTESIQACKLAQSNGWGVMVSHRSGETEDTFIADLVVGLCTGQIKTGAPCRSERLAKYNQLMRIEEALGDKAVFAGRKFRNPKAK,sabio,P25704,[Mg+2],0.054,25.0,7.1,4.2.1.11,9986.0,-1.2676062401770316,-1.207525725151963,[Mg+2]__MAMQKIFAREILDSRGNPTVEVDLHTAKGRFRAAVPSGASTGIYEALELRDGDKSRYLGKGVLKAVEHINKTLGPALLEKKLSVVDQEKVDKFMIELDGTENKSKFGANAILGVSLAVCKAGAAEKGVPLYRHIADLAGNHDLVLPVPAFNVINGGSHAGNKLAMQEFMILPVGASSFREAMRIGAEVYHHLKGVIKAKYGKDATNVGDEGGFAPNILENNEALELLKTAIQAAGYPDKVVIGMDVAASEFHRNGKYDLDFKSPDDPARHITGQKLGELYKSFIKNYPVVSIEDPFDQDDWATWTSFLSGVDIQIVGDDLTVTNPKRIAQAVEKKACNCLLLKVNQIGSVTESIQACKLAQSNGWGVMVSHRSGETEDTFIADLVVGLCTGQIKTGAPCRSERLAKYNQLMRIEEALGDKAVFAGRKFRNPKAK,./data/raw/alphafold//AF-P25704-F1-model_v4.pdb,3162,440,508,607 +1821,20089,20394,MQSVSSSSSISTFKSGSLSPVMETLAFFSETERLPFSSPCSVQLQSYFFRQLACCSLHLLVLSSPLLDKCSAVSPPSFVDHSAKFKVAAKHGNLIPLYRPIFSDHLTPVLAYRCLVKEDDREAPSFLFESVEPGLKVSNVGRYSVIGAQPTMEIVAKENMVTVMDHRQGRRVEQYEEDPMVVPRRIMEKWKPQRTEELPEAFCGGWVGYFSYDTVRYVEKKKLPFSNAPVDDRDLPDIHLGLYDDVIVFDHVEKKAYVIHWVRLDQFSSVEEAYKDGMKRLESLVSRVHDIVPPKLSAGSINLHTSLFGPKLKNSTMTSEEYEKAVLQAKEHILAGDIFQLVLSQRFERRTFADPFEVYRALRIVNPSPYMTYLQARGCILVASSPEILTRVKQGTITNRPLAGTTRRGKTPKEDYMLEQQLLNDEKQCAEHIMLVDLGRNDVGKVSKPGSEKVEKLMNIEPYSHVMHISSTVTGELLDNLTSWDVLRAALPVGTVSGAPKVKAMELIDELEVTRRGPYSGGFGGISFSGDMDVALALRTIVFSIGTRYDTMYSYKTRFKRREWIAHLQAGAGIVADSDPADEQRECENKSAALARAIDLAESSFVDK,uniprot_search,Q9AW95,N=C(O)CC[C@H](N)C(=O)O,0.37,30.0,7.9,4.1.3.27,4058.0,-0.431798275933005,-0.431798275933005,N=C(O)CC[C@H](N)C(=O)O__MQSVSSSSSISTFKSGSLSPVMETLAFFSETERLPFSSPCSVQLQSYFFRQLACCSLHLLVLSSPLLDKCSAVSPPSFVDHSAKFKVAAKHGNLIPLYRPIFSDHLTPVLAYRCLVKEDDREAPSFLFESVEPGLKVSNVGRYSVIGAQPTMEIVAKENMVTVMDHRQGRRVEQYEEDPMVVPRRIMEKWKPQRTEELPEAFCGGWVGYFSYDTVRYVEKKKLPFSNAPVDDRDLPDIHLGLYDDVIVFDHVEKKAYVIHWVRLDQFSSVEEAYKDGMKRLESLVSRVHDIVPPKLSAGSINLHTSLFGPKLKNSTMTSEEYEKAVLQAKEHILAGDIFQLVLSQRFERRTFADPFEVYRALRIVNPSPYMTYLQARGCILVASSPEILTRVKQGTITNRPLAGTTRRGKTPKEDYMLEQQLLNDEKQCAEHIMLVDLGRNDVGKVSKPGSEKVEKLMNIEPYSHVMHISSTVTGELLDNLTSWDVLRAALPVGTVSGAPKVKAMELIDELEVTRRGPYSGGFGGISFSGDMDVALALRTIVFSIGTRYDTMYSYKTRFKRREWIAHLQAGAGIVADSDPADEQRECENKSAALARAIDLAESSFVDK,./data/raw/alphafold//AF-Q9AW95-F1-model_v4.pdb,3143,426,487,582 +1822,11611,11775,MKWLLLLSLVVLSECLVKVPLVRKKSLRQNLIKNGKLKDFLKTHKHNPASKYFPEAAALIGDEPLENYLDTEYFGTIGIGTPAQDFTVIFDTGSSNLWVPSVYCSSLACSDHNQFNPDDSSTFEATSQELSITYGTGSMTGILGYDTVQVGGISDTNQIFGLSETEPGSFLYYAPFDGILGLAYPSISASGATPVFDNLWDQGLVSQDLFSVYLSSNDDSGSVVLLGGIDSSYYTGSLNWVPVSVEGYWQITLDSITMDGETIACSGGCQAIVDTGTSLLTGPTSAIANIQSDIGASENSDGEMVISCSSIDSLPDIVFTINGVQYPLSPSAYILQDDDSCTSGFEGMDVPTSSGELWILGDVFIRQYYTVFDRANNKVGLAPVA,uniprot_search,P00791,CCOC(=O)[C@H](Cc1ccccc1)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)OCc1ccccc1,0.18,49.5,2.1375,3.4.23.1,9823.0,-0.744727494896694,-0.744727494896694,CCOC(=O)[C@H](Cc1ccccc1)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)OCc1ccccc1__MKWLLLLSLVVLSECLVKVPLVRKKSLRQNLIKNGKLKDFLKTHKHNPASKYFPEAAALIGDEPLENYLDTEYFGTIGIGTPAQDFTVIFDTGSSNLWVPSVYCSSLACSDHNQFNPDDSSTFEATSQELSITYGTGSMTGILGYDTVQVGGISDTNQIFGLSETEPGSFLYYAPFDGILGLAYPSISASGATPVFDNLWDQGLVSQDLFSVYLSSNDDSGSVVLLGGIDSSYYTGSLNWVPVSVEGYWQITLDSITMDGETIACSGGCQAIVDTGTSLLTGPTSAIANIQSDIGASENSDGEMVISCSSIDSLPDIVFTINGVQYPLSPSAYILQDDDSCTSGFEGMDVPTSSGELWILGDVFIRQYYTVFDRANNKVGLAPVA,./data/raw/alphafold//AF-P00791-F1-model_v4.pdb,5177,54,59,71 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+1842,25245,25644,MDERKYNMAEEVKVFSTWSSPFALRVIWALKLKGVEFDTIHEDLSSKSPLLLQYNPIHKMVPVLVHNGKVICESLVILEYIDETWKQSPLLPEDPHQKANARFWAKFGDDKVSSIWSDVLMKEGKEQEEGVSASMENLKYLEEEIRGKKFFGGETIGLADIALGWLAYHLVIFEETLGLKLIDQEKFPSLAAWEQEFANAPIIRENWPDRDKLANLFGVLREANLGKGTPK,brenda,A0A4Y5QZX0,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O,0.893,25.0,6.5,2.5.1.18,75706.0,-0.0491485411114535,-0.0491485411114535,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O__MDERKYNMAEEVKVFSTWSSPFALRVIWALKLKGVEFDTIHEDLSSKSPLLLQYNPIHKMVPVLVHNGKVICESLVILEYIDETWKQSPLLPEDPHQKANARFWAKFGDDKVSSIWSDVLMKEGKEQEEGVSASMENLKYLEEEIRGKKFFGGETIGLADIALGWLAYHLVIFEETLGLKLIDQEKFPSLAAWEQEFANAPIIRENWPDRDKLANLFGVLREANLGKGTPK,./data/raw/alphafold//AF-A0A4Y5QZX0-F1-model_v4.pdb,1050,6182,7997,8114 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+1880,18682,18953,MSKIVRVGAVQSEPVWLDLEGSVDKTISLIEKAAADGVNVLGFPEVWIPGYPWSMWTSAVINNSHIIHDYMNNSMRKDSPQMKRIQAAVKEAGMVVVLGYSERDGASLYMAQSFIDPSGEIVHHRRKIKPTHIERTIWGEGQAESLTCVIDSPFGKVGGLNCWEHLQPLLRYYEYSQGVQIHIASWPAEFEMPDPKKIAWLYHETGEASYRASQFFAIEGQAFVLVASQILTEANVERNNLTGNPVTKTPGGGFSMIFGPDGKPLCEPVDAGAEAILTADIDLRDIDKPKAFIDVVGHYARPDLLSLLVNPTVDKHVTTMKK,brenda,B6Q5I3,N#Cc1ccccc1,7.9,30.0,8.0,3.5.5.1,37727.0,0.8976270912904415,0.8976270912904415,N#Cc1ccccc1__MSKIVRVGAVQSEPVWLDLEGSVDKTISLIEKAAADGVNVLGFPEVWIPGYPWSMWTSAVINNSHIIHDYMNNSMRKDSPQMKRIQAAVKEAGMVVVLGYSERDGASLYMAQSFIDPSGEIVHHRRKIKPTHIERTIWGEGQAESLTCVIDSPFGKVGGLNCWEHLQPLLRYYEYSQGVQIHIASWPAEFEMPDPKKIAWLYHETGEASYRASQFFAIEGQAFVLVASQILTEANVERNNLTGNPVTKTPGGGFSMIFGPDGKPLCEPVDAGAEAILTADIDLRDIDKPKAFIDVVGHYARPDLLSLLVNPTVDKHVTTMKK,./data/raw/alphafold//AF-B6Q5I3-F1-model_v4.pdb,3919,4681,6486,6411 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NLRSLLVNPEGPTLMRLNSVQSSERPLFLVHPIEGSTTVFHSLASRLSIPTYGLQCTRAAPLDSIHSLAAYYIDCIRQVQPEGPYRVAGYSYGACVAFEMCSQLQAQQSPAPTHNSLFLFDGSPTYVLAYTQSYRAKLTPGCEAEAETEAICFFVQQFTDMEHNRVLEALLPLKGLEERVAAAVDLIIKSHQGLDRQELSFAARSFYYKLRAAEQYTPKAKYHGNVMLLRAKTGGAYGEDLGADYNLSQVCDGKVSVHVIEGDHRTLLEGSGLESIISIIHSSLAEPRVSVREG,./data/raw/alphafold//AF-P49327-F1-model_v4.pdb,3460,274,1142,1405 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+1914,13133,13326,MFLYPVLLSLISSGALAATCPSLPSSPQLQSITTLPDPFSWYPLQKTGRVSTLSDWQCRQSHISSLLQQLELGTKPPAPSSVTSTFSQNKLTITATNAGNTISFTATITYPSSGEGPYPAMIAYGGLSIPLPPGVAAITFDNSQIAQQNDQSSRGQGLFYTLYGANHSAGALMAWAWATSLIIDRLEATPAARINTSRIGVTGCSRNGKGALVAGAFDSRIALTVPQESGTGGSGCWRLAAASEGAPQNVQTAGEIVQENVWFSTAFNAYANDEDRLPFDHHMLAGLIAPRGLLSIDNAGYQWLGPWSSLGCMGTARLVWQAMGVPDRMGYSMSTNHPHCSFPDQQREDLFAFINRFLLGMEVNTTVQKNYAGIAFDSKPWVNWQVPNLT,brenda,Q4WL89,COC(=O)[C@H]1O[C@H](OCCCc2ccc(OC)cc2)[C@H](O)[C@@H](O)[C@@H]1OC,15.8,30.0,5.0,3.1.1.117,746128.0,1.1986570869544226,1.1986570869544226,COC(=O)[C@H]1O[C@H](OCCCc2ccc(OC)cc2)[C@H](O)[C@@H](O)[C@@H]1OC__MFLYPVLLSLISSGALAATCPSLPSSPQLQSITTLPDPFSWYPLQKTGRVSTLSDWQCRQSHISSLLQQLELGTKPPAPSSVTSTFSQNKLTITATNAGNTISFTATITYPSSGEGPYPAMIAYGGLSIPLPPGVAAITFDNSQIAQQNDQSSRGQGLFYTLYGANHSAGALMAWAWATSLIIDRLEATPAARINTSRIGVTGCSRNGKGALVAGAFDSRIALTVPQESGTGGSGCWRLAAASEGAPQNVQTAGEIVQENVWFSTAFNAYANDEDRLPFDHHMLAGLIAPRGLLSIDNAGYQWLGPWSSLGCMGTARLVWQAMGVPDRMGYSMSTNHPHCSFPDQQREDLFAFINRFLLGMEVNTTVQKNYAGIAFDSKPWVNWQVPNLT,./data/raw/alphafold//AF-Q4WL89-F1-model_v4.pdb,1935,3458,4719,4976 +1915,4429,4498,MGRKSLYLLIVGILIAYYIYTPLPDNVEEPWRMMWINAHLKTIQNLATFVELLGLHHFMDSFKVVGSFDEVPPTSDENVTVTETKFNNILVRVYVPKRKSEALRRGLFYIHGGGWCVGSAALSGYDLLSRWTADRLDAVVVSTNYRLAPKYHFPIQFEDVYNALRWFLRKKVLAKYGVNPERIGISGDSAGGNLAAAVTQQLLDDPDVKIKLKIQSLIYPALQPLDVDLPSYQENSNFLFLSKSLMVRFWSEYFTTDRSLEKAMLSRQHVPVESSHLFKFVNWSSLLPERFIKGHVYNNPNYGSSELAKKYPGFLDVRAAPLLADDNKLRGLPLTYVITCQYDLLRDDGLMYVTRLRNTGVQVTHNHVEDGFHGAFSFLGLKISHRLINQYIEWLKENL,sabio,P22760,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1,0.794,37.0,7.4,3.1.1.3,9606.0,-0.1001794975729037,-0.052545852259205,CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1__MGRKSLYLLIVGILIAYYIYTPLPDNVEEPWRMMWINAHLKTIQNLATFVELLGLHHFMDSFKVVGSFDEVPPTSDENVTVTETKFNNILVRVYVPKRKSEALRRGLFYIHGGGWCVGSAALSGYDLLSRWTADRLDAVVVSTNYRLAPKYHFPIQFEDVYNALRWFLRKKVLAKYGVNPERIGISGDSAGGNLAAAVTQQLLDDPDVKIKLKIQSLIYPALQPLDVDLPSYQENSNFLFLSKSLMVRFWSEYFTTDRSLEKAMLSRQHVPVESSHLFKFVNWSSLLPERFIKGHVYNNPNYGSSELAKKYPGFLDVRAAPLLADDNKLRGLPLTYVITCQYDLLRDDGLMYVTRLRNTGVQVTHNHVEDGFHGAFSFLGLKISHRLINQYIEWLKENL,./data/raw/alphafold//AF-P22760-F1-model_v4.pdb,5045,1872,1243,1529 +1916,9759,9910,MTLRAAVFDLDGVLALPAVFGVLGRTEEALALPRGLLNDAFQKGGPEGATTRLMKGEITLSQWIPLMEENCRKCSETAKVCLPKNFSIKEIFDKAISARKINRPMLQAALMLRKKGFTTAILTNTWLDDRAERDGLAQLMCELKMHFDFLIESCQVGMVKPEPQIYKFLLDTLKASPSEVVFLDDIGANLKPARDLGMVTILVQDTDTALKELEKVTGIQLLNTPAPLPTSCNPSDMSHGYVTVKPRVRLHFVELGSGPAVCLCHGFPESWYSWRYQIPALAQAGYRVLAMDMKGYGESSAPPEIEEYCMEVLCKEMVTFLDKLGLSQAVFIGHDWGGMLVWYMALFYPERVRAVASLNTPFIPANPNMSPLESIKANPVFDYQLYFQEPGVAEAELEQNLSRTFKSLFRASDESVLSMHKVCEAGGLFVNSPEEPSLSRMVTEEEIQFYVQQFKKSGFRGPLNWYRNMERNWKWACKSLGRKILIPALMVTAEKDFVLVPQMSQHMEDWIPHLKRGHIEDCGHWTQMDKPTEVNQILIKWLDSDARNPPVVSKM,brenda,P34913,CCCCCC1OC1C/C=C/C/C=C/C/C=C/CCCC(=O)O,0.007,30.0,7.4,3.3.2.10,9606.0,-2.154901959985743,-2.154901959985743,CCCCCC1OC1C/C=C/C/C=C/C/C=C/CCCC(=O)O__MTLRAAVFDLDGVLALPAVFGVLGRTEEALALPRGLLNDAFQKGGPEGATTRLMKGEITLSQWIPLMEENCRKCSETAKVCLPKNFSIKEIFDKAISARKINRPMLQAALMLRKKGFTTAILTNTWLDDRAERDGLAQLMCELKMHFDFLIESCQVGMVKPEPQIYKFLLDTLKASPSEVVFLDDIGANLKPARDLGMVTILVQDTDTALKELEKVTGIQLLNTPAPLPTSCNPSDMSHGYVTVKPRVRLHFVELGSGPAVCLCHGFPESWYSWRYQIPALAQAGYRVLAMDMKGYGESSAPPEIEEYCMEVLCKEMVTFLDKLGLSQAVFIGHDWGGMLVWYMALFYPERVRAVASLNTPFIPANPNMSPLESIKANPVFDYQLYFQEPGVAEAELEQNLSRTFKSLFRASDESVLSMHKVCEAGGLFVNSPEEPSLSRMVTEEEIQFYVQQFKKSGFRGPLNWYRNMERNWKWACKSLGRKILIPALMVTAEKDFVLVPQMSQHMEDWIPHLKRGHIEDCGHWTQMDKPTEVNQILIKWLDSDARNPPVVSKM,./data/raw/alphafold//AF-P34913-F1-model_v4.pdb,205,2975,2532,2519 +1917,13497,13692,MAYKYDLIVIGAGPGGSAAALEAAKSGMKTAVIEKDKLGGTCLNRGCIPMKALLHLAGIYQEIKESKKFGIQVEKAVLNVPALLQYKQEVINKLSSGMKMLLQKNKVDVFYASGKIVNAHQVAVSENGEKKIIEAERIIIASGSSAAIPPIPGIQLKNVVTSYELLNKEDLFHHLVIIGGGVIGMEFASLYSAFGCRVTVIEAMNRVLPDMDREIGTNLKQILKKQEVDIHTSASVEKLEQTQEGKILCTYREKEKLQHIEIDGVLVAIGRKPSTEGLFDENFAVKTEKGKISVDKYYKTSCPSIYAIGDVIGGIQLAHAASSEALCAVRHIMGKEESLDVKVIPGCVYTNPEIAVVGITANKAKEAGIDVIAKKYPMMANGKSVLTMQERGFMKVIAEKETEKIIGAQLMCARATDIISQFTLAIVNGMTLSQMAHVIHPHPTFSEGVGELVRE,uniprot_search,A0A1L5F878,COc1cc(-c2ccc(-[n+]3nc(-c4ccccc4)nn3-c3ccc([N+](=O)[O-])cc3)c(OC)c2)ccc1-[n+]1nc(-c2ccccc2)nn1-c1ccc([N+](=O)[O-])cc1.[Cl-].[Cl-],0.5,40.0,7.7,1.8.1.4,1534.0,-0.3010299956639812,-0.3010299956639812,COc1cc(-c2ccc(-[n+]3nc(-c4ccccc4)nn3-c3ccc([N+](=O)[O-])cc3)c(OC)c2)ccc1-[n+]1nc(-c2ccccc2)nn1-c1ccc([N+](=O)[O-])cc1.[Cl-].[Cl-]__MAYKYDLIVIGAGPGGSAAALEAAKSGMKTAVIEKDKLGGTCLNRGCIPMKALLHLAGIYQEIKESKKFGIQVEKAVLNVPALLQYKQEVINKLSSGMKMLLQKNKVDVFYASGKIVNAHQVAVSENGEKKIIEAERIIIASGSSAAIPPIPGIQLKNVVTSYELLNKEDLFHHLVIIGGGVIGMEFASLYSAFGCRVTVIEAMNRVLPDMDREIGTNLKQILKKQEVDIHTSASVEKLEQTQEGKILCTYREKEKLQHIEIDGVLVAIGRKPSTEGLFDENFAVKTEKGKISVDKYYKTSCPSIYAIGDVIGGIQLAHAASSEALCAVRHIMGKEESLDVKVIPGCVYTNPEIAVVGITANKAKEAGIDVIAKKYPMMANGKSVLTMQERGFMKVIAEKETEKIIGAQLMCARATDIISQFTLAIVNGMTLSQMAHVIHPHPTFSEGVGELVRE,./data/raw/alphafold//AF-A0A1L5F878-F1-model_v4.pdb,4034,4834,6679,5048 +1918,9284,9433,MDLGLAGRRALVTGAGKGIGRSTVLALQAAGAQVVAVSRTREDLDSLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVATLQPFLEVTKEACDTSFNVNFRAVVQVSQIVARGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTPMGRANWSDPHKAKVMLDRIPLGKFAEVENVVDTILFLLSNRSSMTTGSALPVDGGFLAT,sabio,Q920P0,CCCCC(=O)C(C)=O,0.12,25.0,7.0,1.1.1.10,10116.0,-0.9208187539523752,-0.9208187539523752,CCCCC(=O)C(C)=O__MDLGLAGRRALVTGAGKGIGRSTVLALQAAGAQVVAVSRTREDLDSLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVATLQPFLEVTKEACDTSFNVNFRAVVQVSQIVARGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTPMGRANWSDPHKAKVMLDRIPLGKFAEVENVVDTILFLLSNRSSMTTGSALPVDGGFLAT,./data/raw/alphafold//AF-Q920P0-F1-model_v4.pdb,3403,841,1006,1236 +1919,30273,30810,MNAAAVTPPPEKFNFAEHLLQTNRVRPDKTAFVDDVSSLSFAQLEVKARQLASALRAIGVKREERVLLLMLDGTDWPVSFLGAIYAGIVPVAVNTLLTADDYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVVVSRPAAPLEPGEVDFAAFVGAQAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYWSPELYGRHTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATSLLMGERPTPDAVFKRWLGGVGGVKSTVFYGAPTGYAGMLAAPNLPSRDQVALRLAASAGEALPAEIGQRFQRHFGIDIVDGIGSTEMLHIFLSNLPDRVRYGTTGWPVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGGWTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLEAAVVGVADEHGLTKPKAYVVARPGQTLSETELKTFIKDRLAPYKYPRSAVFVAELPKTATGKIQRFKLREGVLG,brenda,Q3LB11,O=C(O)C1CC=CCC1,0.056,31.0,8.0,6.2.1.25,1076.0,-1.2518119729937995,-1.2518119729937995,O=C(O)C1CC=CCC1__MNAAAVTPPPEKFNFAEHLLQTNRVRPDKTAFVDDVSSLSFAQLEVKARQLASALRAIGVKREERVLLLMLDGTDWPVSFLGAIYAGIVPVAVNTLLTADDYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVVVSRPAAPLEPGEVDFAAFVGAQAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYWSPELYGRHTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATSLLMGERPTPDAVFKRWLGGVGGVKSTVFYGAPTGYAGMLAAPNLPSRDQVALRLAASAGEALPAEIGQRFQRHFGIDIVDGIGSTEMLHIFLSNLPDRVRYGTTGWPVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGGWTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLEAAVVGVADEHGLTKPKAYVVARPGQTLSETELKTFIKDRLAPYKYPRSAVFVAELPKTATGKIQRFKLREGVLG,./data/raw/alphafold//AF-Q3LB11-F1-model_v4.pdb,4863,3617,4941,5252 +1920,12962,13153,MASKMVEIVSKMFIKPSSPTPQSLRRYNLSSIDQTIDSEVTSLAFFYTYNPSHESSKIGDLLKNSLSKTLVSYYQFAGRLIENDYIDCNDEGVEFVEVRIHGRMNDILKRGKSFATDLVLPTRIIALHEDSLLIVQLSHFDCGGIAIGFGASHKVSDGVSNVMFMKDWASSTSLSTFHKPTPLLTADSIFPPEDNKLLSNKSIVSFQQCLGKRFVFSTEAIEKLKSKAIEYGIQKPSRVEVVTAFLCQCAANCDLPRKKPYAIISAVNLRPYLALPQNSIGNIFSFYFCINDEGMDNQFSALISKLRNGKQKLLENIISKEKLTYESQMQELTKCLDQLNISSLDTYFCSSWCRFPVYDIDFGWGKPILVSPFQPHVKDLILLMDSPEGDGIEALITMEEKKMAAFEKNEELRSFAYLDSPEPEALIIPEEDKSFE,sabio,A0A2K8FQU5,COC(=O)C1=C2Nc3ccccc3C23CCN2CCCC(C(C)O)(C1)C23,0.009,30.0,,2.3.1.-,4058.0,-2.0457574905606752,-2.0457574905606752,COC(=O)C1=C2Nc3ccccc3C23CCN2CCCC(C(C)O)(C1)C23__MASKMVEIVSKMFIKPSSPTPQSLRRYNLSSIDQTIDSEVTSLAFFYTYNPSHESSKIGDLLKNSLSKTLVSYYQFAGRLIENDYIDCNDEGVEFVEVRIHGRMNDILKRGKSFATDLVLPTRIIALHEDSLLIVQLSHFDCGGIAIGFGASHKVSDGVSNVMFMKDWASSTSLSTFHKPTPLLTADSIFPPEDNKLLSNKSIVSFQQCLGKRFVFSTEAIEKLKSKAIEYGIQKPSRVEVVTAFLCQCAANCDLPRKKPYAIISAVNLRPYLALPQNSIGNIFSFYFCINDEGMDNQFSALISKLRNGKQKLLENIISKEKLTYESQMQELTKCLDQLNISSLDTYFCSSWCRFPVYDIDFGWGKPILVSPFQPHVKDLILLMDSPEGDGIEALITMEEKKMAAFEKNEELRSFAYLDSPEPEALIIPEEDKSFE,./data/raw/alphafold//AF-A0A2K8FQU5-F1-model_v4.pdb,3706,1374,2136,2041 +1921,25391,25799,MTDSPVLALAKELISRQSVTPADAGCQDLMIERLKALGFEIESMVFEDTTNFWARRGTQSPLFVFAGHTDVVPAGPLSQWHTPPFEPTVIDGFLHGRGAADMKGSLACMIVAVERFIAEHPDHQGSIGFLITSDEEGPFINGTVRVVETLMARNELIDMCIVGEPSSTLAVGDVVKNGRRGSITGDLKVKGTQGHVAYPHLANNPVHKALPALAELAATQWDEGNAYFPPTSFQIPNLQAGTGASNVIPGEFDVQFNFRFSTELTDEEIKRRVHSVLDAHGLDYDVKWTLSGQPFLTDTGELLAAVVAAVEEVNHQAPALLTTGGTSDGRFIAQMGAQVVELGPVNATIHKVNECVRIADLEKLTDMYQKTLNHLLG,brenda,Q9KQ52,N[C@@H](CCC[C@H](N=C(O)CCC(=O)O)C(=O)O)C(=O)O,1.2,25.0,7.5,3.5.1.18,666.0,0.0791812460476248,0.0791812460476248,N[C@@H](CCC[C@H](N=C(O)CCC(=O)O)C(=O)O)C(=O)O__MTDSPVLALAKELISRQSVTPADAGCQDLMIERLKALGFEIESMVFEDTTNFWARRGTQSPLFVFAGHTDVVPAGPLSQWHTPPFEPTVIDGFLHGRGAADMKGSLACMIVAVERFIAEHPDHQGSIGFLITSDEEGPFINGTVRVVETLMARNELIDMCIVGEPSSTLAVGDVVKNGRRGSITGDLKVKGTQGHVAYPHLANNPVHKALPALAELAATQWDEGNAYFPPTSFQIPNLQAGTGASNVIPGEFDVQFNFRFSTELTDEEIKRRVHSVLDAHGLDYDVKWTLSGQPFLTDTGELLAAVVAAVEEVNHQAPALLTTGGTSDGRFIAQMGAQVVELGPVNATIHKVNECVRIADLEKLTDMYQKTLNHLLG,./data/raw/alphafold//AF-Q9KQ52-F1-model_v4.pdb,4651,5859,8036,11980 +1922,24941,25331,MSSSPQEYIDLQTRILRVKTIFAEELASALNLIQVECPMLACVGDGTQDNLSGVEKAVQVHVKEIPGANYEVVHSLAKWKRMTLGNHRFPVGRGIFTNMRALRVEETLDNIHSVYVDQWDWERVIAPADRCLEYLQATVRSLYEVLRETESRLCTEFPDIAPILPDSIKFVHTEQLLKRYPELDPKSREREAVKKLGAVFLIGIGCKLSHGDHHDVRAPDYDDWSSPVSVDSSKIGFPTADDEKPSVNTIMSLQGLNGDILVYNPVLDDVLELSSMGIRVDQEALRRQLEITGTSDRLQCRWHQCVLNGDLPQTIGGGIGQSRTVMFMLRKRHIGEVQCSVWPHEVTAQYSLL,brenda,A4I213,N[C@@H](CC(=O)O)C(=O)O,6.21,37.0,7.6,6.3.5.4,5671.0,0.7930916001765802,0.7930916001765802,N[C@@H](CC(=O)O)C(=O)O__MSSSPQEYIDLQTRILRVKTIFAEELASALNLIQVECPMLACVGDGTQDNLSGVEKAVQVHVKEIPGANYEVVHSLAKWKRMTLGNHRFPVGRGIFTNMRALRVEETLDNIHSVYVDQWDWERVIAPADRCLEYLQATVRSLYEVLRETESRLCTEFPDIAPILPDSIKFVHTEQLLKRYPELDPKSREREAVKKLGAVFLIGIGCKLSHGDHHDVRAPDYDDWSSPVSVDSSKIGFPTADDEKPSVNTIMSLQGLNGDILVYNPVLDDVLELSSMGIRVDQEALRRQLEITGTSDRLQCRWHQCVLNGDLPQTIGGGIGQSRTVMFMLRKRHIGEVQCSVWPHEVTAQYSLL,./data/raw/alphafold//AF-A4I213-F1-model_v4.pdb,3914,4658,6458,6377 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+1997,30312,30849,MRVCIIGAGVIGHSTAQSIYQHFHDRIAPLTIEVYADVFTPLTTSDGAAGLWQPYLYDKGNVQETKWNKETFQYLLSCLSSPDSVRMGIFLQSGYNLCTEPLPDPSFKDTVLGFRKLTQRELDMFPGYSFGWFNTALMVEGKTYLPWLMDWLRQRKVKFYQRKIGSFKELADIGADVIINCSGVRSGDLQPDPELQPGRGQIIKVDAPWLKHWILTHDSSSGVYNSPYIIPGSRLVTVGGVFQIGNWNLQNSSVDHKGIWEAACKLDPSLQHARIVEDWTGLRPARSKVRLERETIRSGPTSFEVIHNYGHGGFGLTIHRGCAEEAARLFGQILEQKGLLAHSKSRL,sabio,Q6TGN2,O=C(O)C1CCCN1,1.13,37.0,8.0,1.4.3.3,7962.0,0.0530784434834196,0.0530784434834196,O=C(O)C1CCCN1__MRVCIIGAGVIGHSTAQSIYQHFHDRIAPLTIEVYADVFTPLTTSDGAAGLWQPYLYDKGNVQETKWNKETFQYLLSCLSSPDSVRMGIFLQSGYNLCTEPLPDPSFKDTVLGFRKLTQRELDMFPGYSFGWFNTALMVEGKTYLPWLMDWLRQRKVKFYQRKIGSFKELADIGADVIINCSGVRSGDLQPDPELQPGRGQIIKVDAPWLKHWILTHDSSSGVYNSPYIIPGSRLVTVGGVFQIGNWNLQNSSVDHKGIWEAACKLDPSLQHARIVEDWTGLRPARSKVRLERETIRSGPTSFEVIHNYGHGGFGLTIHRGCAEEAARLFGQILEQKGLLAHSKSRL,./data/raw/alphafold//AF-Q6TGN2-F1-model_v4.pdb,2126,3749,2794,2818 +1998,28277,28768,MILFFEYAIASGFEDEGILEEGKMMFNTLLNQFLEIDNVTSLIHKDFADDYKDFENLKIVEIEDDKDIEIKLNDILKNEKIDYALTIAPEDENILYNLTKIIEKYPVKNLGCSSNAIKVAGDKYLTYLTIKDYVKTPKTFKPKKYVIKKIDGCGGKFNLFDENFLIQEFVEGESLSVSLIVGKKIYPLSLNRQYIDERGFVGGEVNIKHRLKDEIFNEAIKAVKCIDGLNGYVGVDVIVNDEIYIIEINPRITTTIYGLKTEPSLAELLIKNANNEELTFKVEGKEFTINK,brenda,C7P8V7,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,1.5,70.0,6.7,6.3.4.24,83171.0,0.1760912590556812,0.1760912590556812,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MILFFEYAIASGFEDEGILEEGKMMFNTLLNQFLEIDNVTSLIHKDFADDYKDFENLKIVEIEDDKDIEIKLNDILKNEKIDYALTIAPEDENILYNLTKIIEKYPVKNLGCSSNAIKVAGDKYLTYLTIKDYVKTPKTFKPKKYVIKKIDGCGGKFNLFDENFLIQEFVEGESLSVSLIVGKKIYPLSLNRQYIDERGFVGGEVNIKHRLKDEIFNEAIKAVKCIDGLNGYVGVDVIVNDEIYIIEINPRITTTIYGLKTEPSLAELLIKNANNEELTFKVEGKEFTINK,./data/raw/alphafold//AF-C7P8V7-F1-model_v4.pdb,1030,6144,7938,8053 +1999,14680,14891,MILFKQATYFISLFATVSCGCLTQLYENAFFRGGDVASMYTPNAQYCQMRCTFHPRCLLFSFLPASSINDMEKRFGCFLKDSVTGTLPKVHRTGAVSGHSLKQCGHQISACHRDIYKGVDMRGVNFNVSKVSSVEECQKRCTNNIRCQFFSYATQTFHKAEYRNNCLLKYSPGGTPTAIKVLSNVESGFSLKPCALSEIGCHMNIFQHLAFSDVDVARVLTPDAFVCRTICTYHPNCLFFTFYTNVWKIESQRNVCLLKTSESGTPSSSTPQENTISGYSLLTCKRTLPEPCHSKIYPGVDFGGEELNVTFVKGVNVCQETCTKMIRCQFFTYSLLPEDCKEEKCKCFLRLSMDGSPTRIAYGTQGSSGYSLRLCNTGDNSVCTTKTSTRIVGGTNSSWGEWPWQVSLQVKLTAQRHLCGGSLIGHQWVLTAAHCFDGLPLQDVWRIYSGILNLSDITKDTPFSQIKEIIIHQNYKVSEGNHDIALIKLQAPLNYTEFQKPICLPSKGDTSTIYTNCWVTGWGFSKEKGEIQNILQKVNIPLVTNEECQKRYQDYKITQRMVCAGYKEGGKDACKGDSGGPLVCKHNGMWRLVGITSWGEGCARREQPGVYTKVAEYMDWILEKTQSSDGKAQMQSPA,uniprot_search,P03952,CSCC[C@H](N=C(O)CN=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CC(C)C)C(O)=N[C@H](C(O)=N[C@@H](CC(C)C)C(O)=NCC(O)=N[C@@H](CC(=N)O)C(O)=N[C@H](C(O)=N[C@H](C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)O)[C@@H](C)O)C(C)O,0.005,37.0,8.0,3.4.21.34,9606.0,-2.3010299956639813,-2.3010299956639813,CSCC[C@H](N=C(O)CN=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CC(C)C)C(O)=N[C@H](C(O)=N[C@@H](CC(C)C)C(O)=NCC(O)=N[C@@H](CC(=N)O)C(O)=N[C@H](C(O)=N[C@H](C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)O)[C@@H](C)O)C(C)O__MILFKQATYFISLFATVSCGCLTQLYENAFFRGGDVASMYTPNAQYCQMRCTFHPRCLLFSFLPASSINDMEKRFGCFLKDSVTGTLPKVHRTGAVSGHSLKQCGHQISACHRDIYKGVDMRGVNFNVSKVSSVEECQKRCTNNIRCQFFSYATQTFHKAEYRNNCLLKYSPGGTPTAIKVLSNVESGFSLKPCALSEIGCHMNIFQHLAFSDVDVARVLTPDAFVCRTICTYHPNCLFFTFYTNVWKIESQRNVCLLKTSESGTPSSSTPQENTISGYSLLTCKRTLPEPCHSKIYPGVDFGGEELNVTFVKGVNVCQETCTKMIRCQFFTYSLLPEDCKEEKCKCFLRLSMDGSPTRIAYGTQGSSGYSLRLCNTGDNSVCTTKTSTRIVGGTNSSWGEWPWQVSLQVKLTAQRHLCGGSLIGHQWVLTAAHCFDGLPLQDVWRIYSGILNLSDITKDTPFSQIKEIIIHQNYKVSEGNHDIALIKLQAPLNYTEFQKPICLPSKGDTSTIYTNCWVTGWGFSKEKGEIQNILQKVNIPLVTNEECQKRYQDYKITQRMVCAGYKEGGKDACKGDSGGPLVCKHNGMWRLVGITSWGEGCARREQPGVYTKVAEYMDWILEKTQSSDGKAQMQSPA,./data/raw/alphafold//AF-P03952-F1-model_v4.pdb,5359,3258,1327,3088 +2000,9214,9362,MNKDTLIPTTKDLKVKTNGENINLKNYKDNSSCFGVFENVENAISSAVHAQKILSLHYTKEQREKIITEIRKAALQNKEVLATMILEETHMGRYEDKILKHELVAKYTPGTEDLTTTAWSGDNGLTVVEMSPYGVIGAITPSTNPTETVICNSIGMIAAGNAVVFNGHPCAKKCVAFAVEMINKAIISCGGPENLVTTIKNPTMESLDAIIKHPSIKLLCGTGGPGMVKTLLNSGKKAIGAGAGNPPVIVDDTADIEKAGRSIIEGCSFDNNLPCIAEKEVFVFENVADDLISNMLKNNAVIINEDQVSKLIDLVLQKNNETQEYFINKKWVGKDAKLFLDEIDVESPSNVKCIICEVNANHPFVMTELMMPILPIVRVKDIDEAIKYAKIAEQNRKHSAYIYSKNIDNLNRFEREIDTTIFVKNAKSFAGVGYEAEGFTTFTIAGSTGEGITSARNFTRQRRCVLAG,sabio,Q716S8,CCCC=O,3.7,,9.0,1.2.1.10,1520.0,0.568201724066995,0.6335858642015069,CCCC=O__MNKDTLIPTTKDLKVKTNGENINLKNYKDNSSCFGVFENVENAISSAVHAQKILSLHYTKEQREKIITEIRKAALQNKEVLATMILEETHMGRYEDKILKHELVAKYTPGTEDLTTTAWSGDNGLTVVEMSPYGVIGAITPSTNPTETVICNSIGMIAAGNAVVFNGHPCAKKCVAFAVEMINKAIISCGGPENLVTTIKNPTMESLDAIIKHPSIKLLCGTGGPGMVKTLLNSGKKAIGAGAGNPPVIVDDTADIEKAGRSIIEGCSFDNNLPCIAEKEVFVFENVADDLISNMLKNNAVIINEDQVSKLIDLVLQKNNETQEYFINKKWVGKDAKLFLDEIDVESPSNVKCIICEVNANHPFVMTELMMPILPIVRVKDIDEAIKYAKIAEQNRKHSAYIYSKNIDNLNRFEREIDTTIFVKNAKSFAGVGYEAEGFTTFTIAGSTGEGITSARNFTRQRRCVLAG,./data/raw/alphafold//AF-Q716S8-F1-model_v4.pdb,3654,1526,2333,2275 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+2002,22144,22491,MAATGVLAEIIDGDVYKYYADGEWKKSTSGKSVAIINPTTRKPQYKVQACSQEEVNKVMDSAKSAQKSWAKTPLWKRAELLHKAAAILKEHKAAIAECLVKEIAKPAKDAVTEVVRSGDLVSYCAEEGVRILGEGKFLVSDSFPGNERTKYCLTSKIPLGVILAIPPFNYPVNLAVSKIAPALIAGNSIVLKPPTQGAVAALHMVHCFHLAGFPKGLISCVTGKGSEIGDFLTMHPGVNCISFTGGDTGIAISKKSGMIPLQMELGGKDACIVLEDADLDLVAANIIKGGFSYSGQRCTAVKVVLVMESVADALVEKVKVKVAKLSVGPPEDDSDITPVVSESSANFIEGLVNDAKEKGATFCQEYKREGNLIWPLLLDNVRPDMRIAWEEPFGPVLPVIRINSVEEGIHHCNASNFGLQGCVFTKDINKAIMISDAMESGTVQINSAPARGPDHFPFQGIKDSGIGSQGITNSINMMTKVKTTVINLPSPSYTMG,sabio,P81406,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,0.0032,25.0,8.5,1.2.1.9,3888.0,-2.494850021680094,-2.295880017344075,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1__MAATGVLAEIIDGDVYKYYADGEWKKSTSGKSVAIINPTTRKPQYKVQACSQEEVNKVMDSAKSAQKSWAKTPLWKRAELLHKAAAILKEHKAAIAECLVKEIAKPAKDAVTEVVRSGDLVSYCAEEGVRILGEGKFLVSDSFPGNERTKYCLTSKIPLGVILAIPPFNYPVNLAVSKIAPALIAGNSIVLKPPTQGAVAALHMVHCFHLAGFPKGLISCVTGKGSEIGDFLTMHPGVNCISFTGGDTGIAISKKSGMIPLQMELGGKDACIVLEDADLDLVAANIIKGGFSYSGQRCTAVKVVLVMESVADALVEKVKVKVAKLSVGPPEDDSDITPVVSESSANFIEGLVNDAKEKGATFCQEYKREGNLIWPLLLDNVRPDMRIAWEEPFGPVLPVIRINSVEEGIHHCNASNFGLQGCVFTKDINKAIMISDAMESGTVQINSAPARGPDHFPFQGIKDSGIGSQGITNSINMMTKVKTTVINLPSPSYTMG,./data/raw/alphafold//AF-P81406-F1-model_v4.pdb,2088,5331,4338,7327 +2003,37430,38092,MSRAAAKFKIPMPVTKADFAFPSLRAFSIVVAADQQHGIGDGETIPWTVPETLAFFKDQTTLLRNKKPPTEKKRNAVVMGRKTWEVPLKFRPLKGRLNVVLSCRRPVDDLLAQLPEEKRAAAAADVVINGGLKEALHLLARPPYCSSIETAYCIGGARVYTEAMQSPCVEKLKEVYLTRVHTAPTCNRFYEFVRRRRARAAVDLESTSGVKVSDAAAHLSYEIMKYVPHNAEERQYLELIDRIMKTGLVKEDRTGVGTISLFGAQMFSLRDNQLPLLTTKRVFWRGVCEELIWFLRGETNAHVLADKDIHIWDGNGSREFLDSRGLTENKEMDLGPVYGFQWRHFGADYKGFDANYDEGVDQIKTIVETLKTNDRRLLVTAWNPCALHKMAVRPCHLLGQFYVNTQTKELSCMLYQRCCDMGLGVPFNIASYALLTILIAKATGLRPGELVHTLGTAHVYSNHVEALKEQLQRVPVAFPVLVFKKEREFLEDYESTDMEVVDYVPYPPIKMEMAV,uniprot_search,Q23695,O=c1nc(O)ccn1[C@H]1C[C@H](O)[C@@H](COP(=O)(O)O)O1,0.0033,25.0,7.65,2.1.1.45,5656.0,-2.4814860601221125,-2.4814860601221125,O=c1nc(O)ccn1[C@H]1C[C@H](O)[C@@H](COP(=O)(O)O)O1__MSRAAAKFKIPMPVTKADFAFPSLRAFSIVVAADQQHGIGDGETIPWTVPETLAFFKDQTTLLRNKKPPTEKKRNAVVMGRKTWEVPLKFRPLKGRLNVVLSCRRPVDDLLAQLPEEKRAAAAADVVINGGLKEALHLLARPPYCSSIETAYCIGGARVYTEAMQSPCVEKLKEVYLTRVHTAPTCNRFYEFVRRRRARAAVDLESTSGVKVSDAAAHLSYEIMKYVPHNAEERQYLELIDRIMKTGLVKEDRTGVGTISLFGAQMFSLRDNQLPLLTTKRVFWRGVCEELIWFLRGETNAHVLADKDIHIWDGNGSREFLDSRGLTENKEMDLGPVYGFQWRHFGADYKGFDANYDEGVDQIKTIVETLKTNDRRLLVTAWNPCALHKMAVRPCHLLGQFYVNTQTKELSCMLYQRCCDMGLGVPFNIASYALLTILIAKATGLRPGELVHTLGTAHVYSNHVEALKEQLQRVPVAFPVLVFKKEREFLEDYESTDMEVVDYVPYPPIKMEMAV,./data/raw/alphafold//AF-Q23695-F1-model_v4.pdb,4153,5023,6917,6907 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+2005,11101,11257,MSTVDLARVGACVLKHAVTGEAVELRSLWQEQACVVAGLRRFGCMVCRWIARDLSSLKGLLDQHGVRLVGVGPEALGLQEFLDGGYFAGDLYLDESKQFYKELGFKRYSSLSILPAALGKPVRDVAAKAKAAGIQGNLSGDLLQSGGLLVVAKGGDKVLLHFVQKSPGDYAPQESILQALCISAEAACTHQPPQCDEEACSR,brenda,A9CQL8,CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)[C@@H]2C[C@H]1OO2,0.007,37.0,7.4,1.1.1.188,9823.0,-2.154901959985743,-2.154901959985743,CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)[C@@H]2C[C@H]1OO2__MSTVDLARVGACVLKHAVTGEAVELRSLWQEQACVVAGLRRFGCMVCRWIARDLSSLKGLLDQHGVRLVGVGPEALGLQEFLDGGYFAGDLYLDESKQFYKELGFKRYSSLSILPAALGKPVRDVAAKAKAAGIQGNLSGDLLQSGGLLVVAKGGDKVLLHFVQKSPGDYAPQESILQALCISAEAACTHQPPQCDEEACSR,./data/raw/alphafold//AF-A9CQL8-F1-model_v4.pdb,3789,1489,2294,4337 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+2009,27076,27540,MEGPAGYLRRASVAQLTQELGTAFFQQQQLPAAMADTFLEHLCLLDIDSQPVAARSTSIIATIGPASRSVDRLKEMIKAGMNIARLNFSHGSHEYHAESIANIREATESFATSPLSYRPVAIALDTKGPEIRTGVLQGGPESEVEIVKGSQVLVTVDPKFQTRGDAKTVWVDYHNITRVVAVGGRIYIDDGLISLVVQKIGPEGLVTEVEHGGILGSRKGVNLPNTEVDLPGLSEQDLLDLRFGVQHNVDIIFASFVRKASDVLAVRDALGPEGQNIKIISKIENHEGVKKFDEILEVSDGIMVARGDLGIEIPAEKVFLAQKMMIGRCNLAGKPVVCATQMLESMITKARPTRAETSDVANAVLDGADCIMLSGETAKGSFPVEAVMMQHAIAREAEAAVYHRQLFEELRRAAPLSRDPTEVTAIGAVEASFKCCAAAIIVLTKTGRSAQLLSQYRPRAAVIAVTRSAQAARQVHLSRGVFPLLYREPPEAIWADDVDRRVQFGIESGKLRGFLRVGDLVIVVTGWRPGSGYTNIMRVLSVS,sabio,B1WBN9,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,0.25,37.0,6.5,2.7.1.40,10116.0,-0.6020599913279624,-0.6020599913279624,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O__MEGPAGYLRRASVAQLTQELGTAFFQQQQLPAAMADTFLEHLCLLDIDSQPVAARSTSIIATIGPASRSVDRLKEMIKAGMNIARLNFSHGSHEYHAESIANIREATESFATSPLSYRPVAIALDTKGPEIRTGVLQGGPESEVEIVKGSQVLVTVDPKFQTRGDAKTVWVDYHNITRVVAVGGRIYIDDGLISLVVQKIGPEGLVTEVEHGGILGSRKGVNLPNTEVDLPGLSEQDLLDLRFGVQHNVDIIFASFVRKASDVLAVRDALGPEGQNIKIISKIENHEGVKKFDEILEVSDGIMVARGDLGIEIPAEKVFLAQKMMIGRCNLAGKPVVCATQMLESMITKARPTRAETSDVANAVLDGADCIMLSGETAKGSFPVEAVMMQHAIAREAEAAVYHRQLFEELRRAAPLSRDPTEVTAIGAVEASFKCCAAAIIVLTKTGRSAQLLSQYRPRAAVIAVTRSAQAARQVHLSRGVFPLLYREPPEAIWADDVDRRVQFGIESGKLRGFLRVGDLVIVVTGWRPGSGYTNIMRVLSVS,./data/raw/alphafold//AF-B1WBN9-F1-model_v4.pdb,3167,490,8382,7861 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+2063,21970,22314,MSGTRASNDRPPGTGGVKRGRLQQEAAATGSRVTVVLGAQWGDEGKGKVVDLLATDADIVSRCQGGNNAGHTVVVDGKEYDFHLLPSGIINTKAVSFIGNGVVIHLPGLFEEAEKNEKKGLKDWEKRLIISDRAHLVFDFHQAVDGLQEVQRQAQEGKNIGTTKKGIGPTYSSKAARTGLRICDLLSDFDEFSARFKNLAHQHQSMFPTLEIDVEGQLKRLKGFAERIRPMVRDGVYFMYEALHGPPKKVLVEGANAALLDIDFGTYPFVTSSNCTVGGVCTGLGIPPQNIGDVYGVVKAYTTRVGIGAFPTEQINEIGDLLQNRGHEWGVTTGRKRRCGWLDLMILRYAHMVNGFTALALTKLDILDVLSEIKVGISYKLNGKRIPYFPANQEILQKVEVEYETLPGWKADTTGARKWEDLPPQAQSYVRFVENHMGVAVKWVGVGKSRESMIQLF,brenda,P28650,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1,0.015,22.0,6.7,6.3.4.4,10090.0,-1.8239087409443189,-1.8239087409443189,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1__MSGTRASNDRPPGTGGVKRGRLQQEAAATGSRVTVVLGAQWGDEGKGKVVDLLATDADIVSRCQGGNNAGHTVVVDGKEYDFHLLPSGIINTKAVSFIGNGVVIHLPGLFEEAEKNEKKGLKDWEKRLIISDRAHLVFDFHQAVDGLQEVQRQAQEGKNIGTTKKGIGPTYSSKAARTGLRICDLLSDFDEFSARFKNLAHQHQSMFPTLEIDVEGQLKRLKGFAERIRPMVRDGVYFMYEALHGPPKKVLVEGANAALLDIDFGTYPFVTSSNCTVGGVCTGLGIPPQNIGDVYGVVKAYTTRVGIGAFPTEQINEIGDLLQNRGHEWGVTTGRKRRCGWLDLMILRYAHMVNGFTALALTKLDILDVLSEIKVGISYKLNGKRIPYFPANQEILQKVEVEYETLPGWKADTTGARKWEDLPPQAQSYVRFVENHMGVAVKWVGVGKSRESMIQLF,./data/raw/alphafold//AF-P28650-F1-model_v4.pdb,4516,2161,4208,7685 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+2085,13468,13663,MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,brenda,A0A077JBW9,CO[P@@](=O)(Oc1ccc([N+](=O)[O-])cc1)OC(C)C,2.3,30.0,8.5,3.1.8.1,453246.0,0.3617278360175928,0.3617278360175928,CO[P@@](=O)(Oc1ccc([N+](=O)[O-])cc1)OC(C)C__MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,./data/raw/alphafold//AF-A0A077JBW9-F1-model_v4.pdb,5831,2656,3312,3827 +2086,20684,20995,MITTTIFPGRYVQGAGAINILEEELSRFGERAFVVIDDFVDKNVLGENFFSSFTKVRVNKQIFGGECSDEEIERLSGLVEEETDVVVGIGGGKTLDTAKAVAYKLKKPVVIVPTIASTDAPCSALSVIYTPNGEFKRYLFLPRNPDVVLVDTEIVAKAPARFLVAGMGDALATWFEAESCKQKYAPNMTGRLGSMTAYALARLCYETLLEYGVLAKRSVEEKSVTPALEKIVEANTLLSGLGFESGGLAAAHAIHNGLTVLENTHKYLHGEKVAIGVLASLFLTDKPRKMIEEVYSFCEEVGLPTTLAEIGLDGVSDEDLMKVAEKACDKNETIHNEPQPVTSKDVFFALKAADRYGRMRKNLT,brenda,Q9WYQ4,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.024,50.0,7.4,1.1.1.6,2336.0,-1.619788758288394,-1.456109291095229,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MITTTIFPGRYVQGAGAINILEEELSRFGERAFVVIDDFVDKNVLGENFFSSFTKVRVNKQIFGGECSDEEIERLSGLVEEETDVVVGIGGGKTLDTAKAVAYKLKKPVVIVPTIASTDAPCSALSVIYTPNGEFKRYLFLPRNPDVVLVDTEIVAKAPARFLVAGMGDALATWFEAESCKQKYAPNMTGRLGSMTAYALARLCYETLLEYGVLAKRSVEEKSVTPALEKIVEANTLLSGLGFESGGLAAAHAIHNGLTVLENTHKYLHGEKVAIGVLASLFLTDKPRKMIEEVYSFCEEVGLPTTLAEIGLDGVSDEDLMKVAEKACDKNETIHNEPQPVTSKDVFFALKAADRYGRMRKNLT,./data/raw/alphafold//AF-Q9WYQ4-F1-model_v4.pdb,5196,4849,6702,6670 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+2294,4318,4386,MGSMLLASFPGASSITTGGSCLRSKRYAKNYYASSYVTTLWHKKGKIQKEHRAVIFSKHNLKQHYKVNEGGSTSNTSKTCEKKYVVNAISEQSFEYEPQARDPESIWGSVNDALDTFYKFCRPYAMFNVVLGATFKSLVAVEKLSDLSLAFFIGWLQVVVAVICSHIFGVGLNQLCDIEIDKINKPDLPLASGKLSFRNVVIITASSLILGLGFAWIVDSWPLFWTVFISCMVASAYNVDLPLLRWKKYPVLTAINFIADVAVTRSLGFFLHMQTCVFKRPTTFPRPLIFCTAIVSIYAIVIALFKDIPDMEGDEKFGIQSLSLRLGPKRVFWICVSLLEMTYGVTILVGATSPILWSKIITVLGHAVLASVLWYHAKSVDLTSNVVLQSFYMFIWKLHTAEYFLIPLFR,brenda,F8WPJ0,CC(C)=CCOP(=O)(O)OP(=O)(O)O,0.025,30.0,9.0,2.5.1.70,49840.0,-1.6020599913279625,-1.6020599913279625,CC(C)=CCOP(=O)(O)OP(=O)(O)O__MGSMLLASFPGASSITTGGSCLRSKRYAKNYYASSYVTTLWHKKGKIQKEHRAVIFSKHNLKQHYKVNEGGSTSNTSKTCEKKYVVNAISEQSFEYEPQARDPESIWGSVNDALDTFYKFCRPYAMFNVVLGATFKSLVAVEKLSDLSLAFFIGWLQVVVAVICSHIFGVGLNQLCDIEIDKINKPDLPLASGKLSFRNVVIITASSLILGLGFAWIVDSWPLFWTVFISCMVASAYNVDLPLLRWKKYPVLTAINFIADVAVTRSLGFFLHMQTCVFKRPTTFPRPLIFCTAIVSIYAIVIALFKDIPDMEGDEKFGIQSLSLRLGPKRVFWICVSLLEMTYGVTILVGATSPILWSKIITVLGHAVLASVLWYHAKSVDLTSNVVLQSFYMFIWKLHTAEYFLIPLFR,./data/raw/alphafold//AF-F8WPJ0-F1-model_v4.pdb,3320,1839,2728,2742 +2295,8222,8361,MQNFTFRNPTKLIFGRGQIEQLKEEVPKYGKKVLLVYGGGSIKRNGLYDEVMSLLTDIGAEVVELPGVEPNPRLSTVKKGVDICRREGIEFLLAVGGGSVIDCTKAIAAGAKFDGDPWEFITKKATVTEALPFGTVLTLAATGSEMNAGSVITNWETKEKYGWGSPVTFPQFSILDPTYTMTVPKDHTVYGIVDMMSHVFEQYFHHTPNTPLQDRMCEAVLKTVIEAAPKLVDDLENYELRETIMYSGTIALNGFLQMGVRGDWATHDIEHAVSAVYDIPHAGGLAILFPNWMKHVLDENVSRFAQLAVRVFDVDPTGKTERDVALEGIERLRAFWSSLGAPSRLADYGIGEENLELMADKAMAFGEFGRFKTLNRDDVLAILRASL,brenda,A4ISB9,CC=O,2.25,60.0,7.8,1.1.1.2,33940.0,0.3521825181113625,0.3521825181113625,CC=O__MQNFTFRNPTKLIFGRGQIEQLKEEVPKYGKKVLLVYGGGSIKRNGLYDEVMSLLTDIGAEVVELPGVEPNPRLSTVKKGVDICRREGIEFLLAVGGGSVIDCTKAIAAGAKFDGDPWEFITKKATVTEALPFGTVLTLAATGSEMNAGSVITNWETKEKYGWGSPVTFPQFSILDPTYTMTVPKDHTVYGIVDMMSHVFEQYFHHTPNTPLQDRMCEAVLKTVIEAAPKLVDDLENYELRETIMYSGTIALNGFLQMGVRGDWATHDIEHAVSAVYDIPHAGGLAILFPNWMKHVLDENVSRFAQLAVRVFDVDPTGKTERDVALEGIERLRAFWSSLGAPSRLADYGIGEENLELMADKAMAFGEFGRFKTLNRDDVLAILRASL,./data/raw/alphafold//AF-A4ISB9-F1-model_v4.pdb,114,2843,3526,4091 +2296,39641,40350,MLQRVNPGHKALADYRSIIRRELYGELQELAGRLRGARVLHINATSFGGGVAEILYTLVPLARDAGLEVEWAIMFGAEPFFNVTKRFHNALQGADYELTIEDRAIYEEYNRRTAQALAESGEEWDIVFVHDPQPALVREFSGGLGEGTRWIWRCHIDTSTPNRQVLDYLWPYIADYDAQVYTMREYTPPGVEMPGLTLIPPAIDPLSPKNMALSRDDASYIVSQFGVDVERPFLLQVSRFDPWKDPLGVIDVYRMVKEEVGEVQLVLVGSMAHDDPEGWDYWYKTVNYAGGDPDIFLFSNLTNVGAIEVNAFQSLADVVIQKSIREGFGLVVSEALWKARPVVASRVGGIPMQITAGGGILIDTIPEAAAACAKLLSDPEFAREMGRRGKEHVRANFLTPRLLRDDLRLFAKLLGV,brenda,Q1ARU5,OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,82.0,60.0,9.0,2.4.1.245,49319.0,1.9138138523837167,1.9138138523837167,OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O__MLQRVNPGHKALADYRSIIRRELYGELQELAGRLRGARVLHINATSFGGGVAEILYTLVPLARDAGLEVEWAIMFGAEPFFNVTKRFHNALQGADYELTIEDRAIYEEYNRRTAQALAESGEEWDIVFVHDPQPALVREFSGGLGEGTRWIWRCHIDTSTPNRQVLDYLWPYIADYDAQVYTMREYTPPGVEMPGLTLIPPAIDPLSPKNMALSRDDASYIVSQFGVDVERPFLLQVSRFDPWKDPLGVIDVYRMVKEEVGEVQLVLVGSMAHDDPEGWDYWYKTVNYAGGDPDIFLFSNLTNVGAIEVNAFQSLADVVIQKSIREGFGLVVSEALWKARPVVASRVGGIPMQITAGGGILIDTIPEAAAACAKLLSDPEFAREMGRRGKEHVRANFLTPRLLRDDLRLFAKLLGV,./data/raw/alphafold//AF-Q1ARU5-F1-model_v4.pdb,2654,6722,8549,8757 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+2298,14952,15165,MAKIVVIGAGVAGLTTALQLLRKGHEVTIVSEFTPGDLSIGYTSPWAGANWLTFYDGGKLADYDAVSYPILRELARSSPEAGIRLISQRSHVLKRDLPKLEVAMSAICQRNPWFKNTVDSFEIIEDRSRIVHDDVAYLVEFRSVCIHTGVYLNWLMSQCLSLGATVVKRRVNHIKDANLLHSSGSRPDVIVNCSGLFARFLGGVEDKKMYPIRGQVVLVRNSLPFMASFSSTPEKENEDEALYIMTRFDGTSIIGGCFQPNNWSSEPDPSLTHRILSRALDRFPELTKDGPLDIVRECVGHRPGREGGPRVELEKIPGVGFVVHNYGAAGAGYQSSYGMADEAVSYVERALTRPNL,uniprot_search,Q99042,C[C@@H](N)C(=O)O,7.0,25.0,8.5,1.4.3.3,34364.0,0.8450980400142568,0.943495036001318,C[C@@H](N)C(=O)O__MAKIVVIGAGVAGLTTALQLLRKGHEVTIVSEFTPGDLSIGYTSPWAGANWLTFYDGGKLADYDAVSYPILRELARSSPEAGIRLISQRSHVLKRDLPKLEVAMSAICQRNPWFKNTVDSFEIIEDRSRIVHDDVAYLVEFRSVCIHTGVYLNWLMSQCLSLGATVVKRRVNHIKDANLLHSSGSRPDVIVNCSGLFARFLGGVEDKKMYPIRGQVVLVRNSLPFMASFSSTPEKENEDEALYIMTRFDGTSIIGGCFQPNNWSSEPDPSLTHRILSRALDRFPELTKDGPLDIVRECVGHRPGREGGPRVELEKIPGVGFVVHNYGAAGAGYQSSYGMADEAVSYVERALTRPNL,./data/raw/alphafold//AF-Q99042-F1-model_v4.pdb,3558,1160,1872,1728 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+2300,21150,21469,MLESNENRIQIMSTIAKIYRAMSRELNRRLGELNLSYLDFLVLRATSDGPKTMAYLANRYFVTQSAITASVDKLEEMGLVVRVRDREDRRKILIEITEKGLETFNKGIEIYKKLANEVTGDLSEDEVILVLDKISKILKRIEEISQ,brenda,Q96ZY1,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.118,80.0,9.0,1.1.1.119,111955.0,-0.9281179926938746,-0.9281179926938746,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MLESNENRIQIMSTIAKIYRAMSRELNRRLGELNLSYLDFLVLRATSDGPKTMAYLANRYFVTQSAITASVDKLEEMGLVVRVRDREDRRKILIEITEKGLETFNKGIEIYKKLANEVTGDLSEDEVILVLDKISKILKRIEEISQ,./data/raw/alphafold//AF-Q96ZY1-F1-model_v4.pdb,4362,5354,4370,7374 +2301,7698,7831,MVTSPPTSSPSQRSYSPQDWLRGYQSQPQEWDYWVEDVEGSIPPDLQGTLYRNGPGLLEIGDRPLKHPFDGDGMVTAFKFPGDGRVHFQSKFVRTQGYVEEQKAGKMIYRGVFGSQPAGGWLKTIFDLRLKNIANTNITYWGDRLLALWEGGQPHRLEPSNLATIGLDDLGGILAEGQPLSAHPRIDPASTFDGGQPCYVTFSIKSSLSSTLTLLELDPQGKLLRQKTETFPGFAFIHDFAITPHYAIFLQNNVTLNGLPYLFGLRGAGECVQFHPDKPAQIILVPRDGGEIKRIPVQAGFVFHHANAFEENGKIILDSICYNSLPQVDTDGDFRSTNFDNLDPGQLWRFTIDPAAATVEKQLMVSRCCEFPVVHPQQVGRPYRYVYMGAAHHSTGNAPLQAILKVDLESGTETLRSFAPHGFAGEPIFVPRPGGVAEDDGWLLCLIYKADLHRSELVILDAQDITAPAIATLKLKHHIPYPLHGSWAQT,brenda,P74334,CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(\C)C=O)C(C)(C)C[C@H](O)C1,0.0014,27.0,7.0,1.13.11.75,1148.0,-2.853871964321762,-2.853871964321762,CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(\C)C=O)C(C)(C)C[C@H](O)C1__MVTSPPTSSPSQRSYSPQDWLRGYQSQPQEWDYWVEDVEGSIPPDLQGTLYRNGPGLLEIGDRPLKHPFDGDGMVTAFKFPGDGRVHFQSKFVRTQGYVEEQKAGKMIYRGVFGSQPAGGWLKTIFDLRLKNIANTNITYWGDRLLALWEGGQPHRLEPSNLATIGLDDLGGILAEGQPLSAHPRIDPASTFDGGQPCYVTFSIKSSLSSTLTLLELDPQGKLLRQKTETFPGFAFIHDFAITPHYAIFLQNNVTLNGLPYLFGLRGAGECVQFHPDKPAQIILVPRDGGEIKRIPVQAGFVFHHANAFEENGKIILDSICYNSLPQVDTDGDFRSTNFDNLDPGQLWRFTIDPAAATVEKQLMVSRCCEFPVVHPQQVGRPYRYVYMGAAHHSTGNAPLQAILKVDLESGTETLRSFAPHGFAGEPIFVPRPGGVAEDDGWLLCLIYKADLHRSELVILDAQDITAPAIATLKLKHHIPYPLHGSWAQT,./data/raw/alphafold//AF-P74334-F1-model_v4.pdb,5235,2154,1438,3228 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+2303,35968,36596,MPKLILYGLEASPPVRAVKLTLAALEVPYEFVEVNTRAKENFSEEFLKKNPQHTVPTLEDDGHYIWDSHAIIAYLVSKYGKTDSLYPKDLLQRAVVDQRLHFESGVIFANALRSITKPLFAGKQTMIPKERYDAIIEVYDFLEKFLAGNDYVAGNQLTIADFSIISTVSSLEVFVKVDTTKYPRIAAWFKRLQKLPYYEEANGNGARTFESFIREYNFTFASN,sabio,A1ZB72,O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1,0.2,25.0,6.5,2.5.1.18,7227.0,-0.6989700043360187,-0.6989700043360187,O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1__MPKLILYGLEASPPVRAVKLTLAALEVPYEFVEVNTRAKENFSEEFLKKNPQHTVPTLEDDGHYIWDSHAIIAYLVSKYGKTDSLYPKDLLQRAVVDQRLHFESGVIFANALRSITKPLFAGKQTMIPKERYDAIIEVYDFLEKFLAGNDYVAGNQLTIADFSIISTVSSLEVFVKVDTTKYPRIAAWFKRLQKLPYYEEANGNGARTFESFIREYNFTFASN,./data/raw/alphafold//AF-A1ZB72-F1-model_v4.pdb,4680,5815,7537,8482 +2304,10369,10524,MGKYQVMKRASEVDLSTVKYKAETMKAPHLTGLSFKLFVNLLEAPLIGSLIVDYLKKDNGMTKIFRNTVIPEEPMFRPEFPSQEPEHDVVIVGEDESPIDRLETALKCLPQYDPSRSLHADPVSSFRYWKIRDYAYAYRSKLTTPLQVAKRIISIIEEFGYDKPPTPFLIRFDANEVIKQAEASTRRFEQGNPISVLDGIFVTIKDDIDCLPHPTNGGTTWLHEDRSVEKDSAVVSKLRSCGAILLGKANMHELGMGTTGNNSNYGTTRNPHDPKRYTGGSSSGSAAIVAAGLCSAALGTDGGGSVRIPSALCGITGLKTTYGRTDMTGSLCEGGTVEIIGPLASSLEDAFLVYAAILGSSSADRYNLKPSPPCFPKLLSHNGSNAIGSLRLGKYTKWFNDVSSSDISDKCEDILKLLSNNHGCKVVEIVVPELEEMRAAHVISIGSPTLSSLTPYCEAGKNSKLSYDTRTSFAIFRSFSASDYIAAQCLRRRLMEYHLNIFKDVDVIVTPTTGMTAPVIPPDALKNGETNIQVTTDLMRFVLAANLLGFPAISVPVGYDKEGLPIGLQIMGRPWAEATVLGLAAAVEELAPVTKKPAIFYDILNTN,sabio,Q7XJJ7,CCCCCCCCCCCC(=O)NCCO,0.0176,30.0,9.0,3.5.1.99,3702.0,-1.75448733218585,-1.75448733218585,CCCCCCCCCCCC(=O)NCCO__MGKYQVMKRASEVDLSTVKYKAETMKAPHLTGLSFKLFVNLLEAPLIGSLIVDYLKKDNGMTKIFRNTVIPEEPMFRPEFPSQEPEHDVVIVGEDESPIDRLETALKCLPQYDPSRSLHADPVSSFRYWKIRDYAYAYRSKLTTPLQVAKRIISIIEEFGYDKPPTPFLIRFDANEVIKQAEASTRRFEQGNPISVLDGIFVTIKDDIDCLPHPTNGGTTWLHEDRSVEKDSAVVSKLRSCGAILLGKANMHELGMGTTGNNSNYGTTRNPHDPKRYTGGSSSGSAAIVAAGLCSAALGTDGGGSVRIPSALCGITGLKTTYGRTDMTGSLCEGGTVEIIGPLASSLEDAFLVYAAILGSSSADRYNLKPSPPCFPKLLSHNGSNAIGSLRLGKYTKWFNDVSSSDISDKCEDILKLLSNNHGCKVVEIVVPELEEMRAAHVISIGSPTLSSLTPYCEAGKNSKLSYDTRTSFAIFRSFSASDYIAAQCLRRRLMEYHLNIFKDVDVIVTPTTGMTAPVIPPDALKNGETNIQVTTDLMRFVLAANLLGFPAISVPVGYDKEGLPIGLQIMGRPWAEATVLGLAAAVEELAPVTKKPAIFYDILNTN,./data/raw/alphafold//AF-Q7XJJ7-F1-model_v4.pdb,207,2978,3691,4289 +2305,13873,14074,MSGWARALLLAAVLVVMACLVPAATASLHAEETLTSQFAEFKQKHGRVYESAAEEAFRLSVFRENLFLARLHAAANPHATFGVTPFSDLTREEFRSRYHNGAAHFAAAQERARVPVKVEVVGAPAAVDWRARGAVTAVKDQGQCGSCWAFSAIGNVECQWFLAGHPLTNLSEQMLVSCDKTDSGCSGGLMNNAFEWIVQENNGAVYTEDSYPYASGEGISPPCTTSGHTVGATITGHVELPQDEAQIAAWLAVNGPVAVAVDASSWMTYTGGVMTSCVSEQLDHGVLLVGYNDSAAVPYWIIKNSWTTQWGEEGYIRIAKGSNQCLVKEEASSAVVGGPGPTPEPTTTTTTSAPGPSPSYFVQMSCTDAACIVGCENVTLPTGQCLLTTSGVSAIVTCGAETLTEEVFLTSTHCSGPSVRSSVPLNKCNRLLRGSVEFFCGSSSSGRLADVDRQRRHQPYHSRHRRL,brenda,Q598P5,COc1cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCNC(=N)N)N=C(O)OCc2ccccc2)cc2ccccc12,0.011,37.0,7.08,3.4.22.51,5693.0,-1.958607314841775,-1.958607314841775,COc1cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCNC(=N)N)N=C(O)OCc2ccccc2)cc2ccccc12__MSGWARALLLAAVLVVMACLVPAATASLHAEETLTSQFAEFKQKHGRVYESAAEEAFRLSVFRENLFLARLHAAANPHATFGVTPFSDLTREEFRSRYHNGAAHFAAAQERARVPVKVEVVGAPAAVDWRARGAVTAVKDQGQCGSCWAFSAIGNVECQWFLAGHPLTNLSEQMLVSCDKTDSGCSGGLMNNAFEWIVQENNGAVYTEDSYPYASGEGISPPCTTSGHTVGATITGHVELPQDEAQIAAWLAVNGPVAVAVDASSWMTYTGGVMTSCVSEQLDHGVLLVGYNDSAAVPYWIIKNSWTTQWGEEGYIRIAKGSNQCLVKEEASSAVVGGPGPTPEPTTTTTTSAPGPSPSYFVQMSCTDAACIVGCENVTLPTGQCLLTTSGVSAIVTCGAETLTEEVFLTSTHCSGPSVRSSVPLNKCNRLLRGSVEFFCGSSSSGRLADVDRQRRHQPYHSRHRRL,./data/raw/alphafold//AF-Q598P5-F1-model_v4.pdb,3740,1424,2201,2118 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ELKPSQVLKTGPGEPPKLDLNNLLVNPEGPTITRLNEVQSTERPLFLVHPIEGSIAVFYTLASKLHMPCYGLQCTKAAPLDSIQSLASYYIDCMKQIQPEGPYRIAGYSFGACVAFEMCSQLQAQQNASHALNSLFLFDGSHSFVAAYTQSYRAKLTQGNEAALETEALCAFVQQFTGIEYNKLLEILLPLEDLEARVNAAADLITQIHKNINREALSFAAASFYHKLKAADKYIPESKYHGNVTLMRAKTHNEYEEGLGGDYRLSEVCDGKVSVHIIEGDHRTLLEGDGVESIIGIIHGSLAEPRVSVREG,./data/raw/alphafold//AF-P12276-F1-model_v4.pdb,3460,274,2139,2044 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+2334,14989,15202,MTPISQTPGLLAEAMVDLGAIEHNVRVLREHAGHAQLMAVVKADGYGHGATRVAQTALGAGAAELGVATVDEALALRADGITAPVLAWLHPPGIDFGPALLADVQVAVSSLRQLDELLHAVRRTGRTATVTVKVDTGLNRNGVGPAQFPAMLTALRQAMAEDAVRLRGLMSHMVYADKPDDSINDVQAQRFTAFLAQAREQGVRFEVAHLSNSSATMARPDLTFDLVRPGIAVYGLSPVPALGDMGLVPAMTVKCAVALVKSIRAGEGVSYGHTWIAPRDTNLALLPIGYADGVFRSLGGRLEVLINGRRCPGVGRICMDQFMVDLGPGPLDVAEGDEAILFGPGIRGEPTAQDWADLVGTIHYEVVTSPRGRITRTYREAENR,brenda,P9WQA9,C[C@@H](N)C(=O)O,1.1,37.0,7.6,5.1.1.1,1773.0,0.041392685158225,0.041392685158225,C[C@@H](N)C(=O)O__MTPISQTPGLLAEAMVDLGAIEHNVRVLREHAGHAQLMAVVKADGYGHGATRVAQTALGAGAAELGVATVDEALALRADGITAPVLAWLHPPGIDFGPALLADVQVAVSSLRQLDELLHAVRRTGRTATVTVKVDTGLNRNGVGPAQFPAMLTALRQAMAEDAVRLRGLMSHMVYADKPDDSINDVQAQRFTAFLAQAREQGVRFEVAHLSNSSATMARPDLTFDLVRPGIAVYGLSPVPALGDMGLVPAMTVKCAVALVKSIRAGEGVSYGHTWIAPRDTNLALLPIGYADGVFRSLGGRLEVLINGRRCPGVGRICMDQFMVDLGPGPLDVAEGDEAILFGPGIRGEPTAQDWADLVGTIHYEVVTSPRGRITRTYREAENR,./data/raw/alphafold//AF-P9WQA9-F1-model_v4.pdb,485,2327,2943,3401 +2335,39975,40695,STAGKVIKCKAAVLWEANKPFSLEEVEVAPPKAHEVRIKIVATGICRSDDHVVTGALAMPFPVILGHEAAGVVESVGEKVTLLKPGDAVIPLFVPQCGECRSCLSTKGNLCIKNDLSSSPTGLMADGTTRFTCKGKAIHHFIGTSTFTEYTVVHETAAAKIDSAAPLEKVCLIGCGFSTGYGAVLQTAKVEPGSTCAVFGLGGVGLSVVMGCKAAGASRIIAIDINKDKFAKAKELGATECVNPKDFKKPIHEVLTEMTGKGVDYSFEVIGRIETMTEALASCHYNYGVSVIVGVPPAAQKISFDPMLIFSGRTWKGSVFGGWKSKDAVPKLVADYMKKKFVLDPLITHTLPFTKINEGFDLLRTGKSIRTVLVL,sabio,P19631,OCc1ccccc1,0.013,25.0,10.0,1.1.1.1,93934.0,-1.8860566476931635,-1.8860566476931635,OCc1ccccc1__STAGKVIKCKAAVLWEANKPFSLEEVEVAPPKAHEVRIKIVATGICRSDDHVVTGALAMPFPVILGHEAAGVVESVGEKVTLLKPGDAVIPLFVPQCGECRSCLSTKGNLCIKNDLSSSPTGLMADGTTRFTCKGKAIHHFIGTSTFTEYTVVHETAAAKIDSAAPLEKVCLIGCGFSTGYGAVLQTAKVEPGSTCAVFGLGGVGLSVVMGCKAAGASRIIAIDINKDKFAKAKELGATECVNPKDFKKPIHEVLTEMTGKGVDYSFEVIGRIETMTEALASCHYNYGVSVIVGVPPAAQKISFDPMLIFSGRTWKGSVFGGWKSKDAVPKLVADYMKKKFVLDPLITHTLPFTKINEGFDLLRTGKSIRTVLVL,./data/raw/alphafold//AF-P19631-F1-model_v4.pdb,5403,3181,3796,4412 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+2362,23247,23603,MGLELYLDLLSQPCRAVYIFAKKNDIPFELRIVDLIKGQHLSDAFAQVNPLKKVPALKDGDFTLTESVAILLYLTRKYKVPDYWYPQDLQARARVDEYLAWQHTTLRRSCLRALWHKVMFPVFLGEPVSPQTLAATLAELDVTLQLLEDKFLQNKAFLTGPHISLADLVAITELMHPVGAGCQVFEGRPKLATWRQRVEAAVGEDLFQEAHEVILKAKDFPPADPTIKQKLMPWVLAMIR,sabio,P30711,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O,0.14,23.0,7.6,2.5.1.18,9606.0,-0.8538719643217619,-0.8538719643217619,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O__MGLELYLDLLSQPCRAVYIFAKKNDIPFELRIVDLIKGQHLSDAFAQVNPLKKVPALKDGDFTLTESVAILLYLTRKYKVPDYWYPQDLQARARVDEYLAWQHTTLRRSCLRALWHKVMFPVFLGEPVSPQTLAATLAELDVTLQLLEDKFLQNKAFLTGPHISLADLVAITELMHPVGAGCQVFEGRPKLATWRQRVEAAVGEDLFQEAHEVILKAKDFPPADPTIKQKLMPWVLAMIR,./data/raw/alphafold//AF-P30711-F1-model_v4.pdb,4684,5832,7552,4580 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+2364,20122,20429,MFRKRSKDLSLSPTIILVISEIISFFLLFCTVILVCSVASHAATPSIPIYDYQIVHSYPHDTKAFTEGFFYRNGYFYESTGLNGRSSIRKVDIESGKTLQQIELGKRYFGEGISDWKDKIVGLTWKNGLGFVWNIRNLRQVRSFNYDGEGWGLTHNDQYLIMSDGTPVLRFLDPESLTPVRTITVTAHGEELPELNELEWVDGEIFANVWQTNKIVRIDPETGKVTGIIDLNGILAEAGPLPSPIDVLNGIAWDKEHHRLFVTGKLWPKVFEITLTQRVGGHK,brenda,Q5NLA9,N=C(O)CC[C@H](N)C(O)=NCC(O)=NCC(O)=NCC(=O)O,5.6,35.0,6.0,2.3.2.5,542.0,0.7481880270062004,0.7481880270062004,N=C(O)CC[C@H](N)C(O)=NCC(O)=NCC(O)=NCC(=O)O__MFRKRSKDLSLSPTIILVISEIISFFLLFCTVILVCSVASHAATPSIPIYDYQIVHSYPHDTKAFTEGFFYRNGYFYESTGLNGRSSIRKVDIESGKTLQQIELGKRYFGEGISDWKDKIVGLTWKNGLGFVWNIRNLRQVRSFNYDGEGWGLTHNDQYLIMSDGTPVLRFLDPESLTPVRTITVTAHGEELPELNELEWVDGEIFANVWQTNKIVRIDPETGKVTGIIDLNGILAEAGPLPSPIDVLNGIAWDKEHHRLFVTGKLWPKVFEITLTQRVGGHK,./data/raw/alphafold//AF-Q5NLA9-F1-model_v4.pdb,3771,1474,2277,2209 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+2366,675,694,MQKKKKNRNEVVLCSAEGTGGCSRLAAMDLASNLGGKIDKAEVLSAVQKYEKYHVCYGGQEEERKANYTDMVNKYYDLVTSFYEFGWGESFHFAPRWKGESLRESIKRHEHFLPLQLGLKPGQKVLDVGCGIGGPLREISRFSSTSITGLNNNEYQITRGKELNRIAGVDKTCNFVKADFMKMPFPDNSFDAVYAIEATCHAPDAYGCYKEIFRVLKPGQYFAAYEWCMTDSFDPQNPEHQKIKAEIEIGDGLPDIRLTAKCLEALKQAGFEVIWEKDLAVDSPLPWYLPLDKSHFSLSSFRLTAVGRLFTKNMVKVLEYVGLAPKGSLRVQDFLEKAAEGLVEGGKREIFTPMYFFLARKPDLDRN,sabio,Q43445,C=C(CCC(C)C1CCC2(C)C3CCC4C(C)(C)C(O)CCC45CC35CCC12C)C(C)C,0.022,35.0,7.5,2.1.1.143,3847.0,-1.6575773191777938,-1.6575773191777938,C=C(CCC(C)C1CCC2(C)C3CCC4C(C)(C)C(O)CCC45CC35CCC12C)C(C)C__MQKKKKNRNEVVLCSAEGTGGCSRLAAMDLASNLGGKIDKAEVLSAVQKYEKYHVCYGGQEEERKANYTDMVNKYYDLVTSFYEFGWGESFHFAPRWKGESLRESIKRHEHFLPLQLGLKPGQKVLDVGCGIGGPLREISRFSSTSITGLNNNEYQITRGKELNRIAGVDKTCNFVKADFMKMPFPDNSFDAVYAIEATCHAPDAYGCYKEIFRVLKPGQYFAAYEWCMTDSFDPQNPEHQKIKAEIEIGDGLPDIRLTAKCLEALKQAGFEVIWEKDLAVDSPLPWYLPLDKSHFSLSSFRLTAVGRLFTKNMVKVLEYVGLAPKGSLRVQDFLEKAAEGLVEGGKREIFTPMYFFLARKPDLDRN,./data/raw/alphafold//AF-Q43445-F1-model_v4.pdb,5003,403,463,555 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+2408,19051,19325,MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,uniprot_search,P24155,N=C(N)NCCC[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],0.00069,37.0,7.4,3.4.24.15,10116.0,-3.161150909262745,-3.161150909262745,N=C(N)NCCC[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]__MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,./data/raw/alphafold//AF-P24155-F1-model_v4.pdb,5089,1942,1509,2898 +2409,11371,11532,MKKSLSATLISALLAFSAPGFSAADNVAAVVDSTIKPLMAQQDIPGMAVAVSVKGKPYYFNYGFADVQAKQPVTENTLFELGSVSKTFTGVLGAVSVAKKEMTLNDPAEKYQPELALPQWKGITLLDLATYTAGGLPLQVPDAVKSRADLLHFYQQWQPSRKPGDMRLYANSSIGLFGALTANAAGMPYDQLLTARILAPLGLSHTFITVPESAQSQYAYGYKNKKPVRVSPGQLDAESYGVKSASKDMLRWAEMNMEPSRAGNADLEMAMYLAQTRYYKTAAINQGLGWEMYDWPQQKDMIINGVTNEVALQPHPVTDNQVQPYNRASWVHKTGATTGFGAYVAFIPEKQVAIVILANKNYPNTERVKAAQAILSALE,sabio,Q704Z0,CCN1CCN(C(=O)NC(C(=O)NC2C(=O)N3C2SC(C)(C)C3C(=O)O)c2ccccc2)C(=O)C1=O,0.00017,30.0,7.0,3.5.2.6,582.0,-3.769551078621726,-3.769551078621726,CCN1CCN(C(=O)NC(C(=O)NC2C(=O)N3C2SC(C)(C)C3C(=O)O)c2ccccc2)C(=O)C1=O__MKKSLSATLISALLAFSAPGFSAADNVAAVVDSTIKPLMAQQDIPGMAVAVSVKGKPYYFNYGFADVQAKQPVTENTLFELGSVSKTFTGVLGAVSVAKKEMTLNDPAEKYQPELALPQWKGITLLDLATYTAGGLPLQVPDAVKSRADLLHFYQQWQPSRKPGDMRLYANSSIGLFGALTANAAGMPYDQLLTARILAPLGLSHTFITVPESAQSQYAYGYKNKKPVRVSPGQLDAESYGVKSASKDMLRWAEMNMEPSRAGNADLEMAMYLAQTRYYKTAAINQGLGWEMYDWPQQKDMIINGVTNEVALQPHPVTDNQVQPYNRASWVHKTGATTGFGAYVAFIPEKQVAIVILANKNYPNTERVKAAQAILSALE,./data/raw/alphafold//AF-Q704Z0-F1-model_v4.pdb,4913,2698,3365,3890 +2410,18845,19118,MKKILLRLMFLAMLVALLPVHVAQACSAFIVGKDLTADGSTLFGRTEDYPYAPDGGRHNQNYVVVPAKTYKDGDKIEDESNGFTYPHLANEMKYTAVYDSDRDNGSNG,brenda,Q938E9,N=C(N)NCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1,0.051,37.0,7.8,3.4.11.6,1302.0,-1.2924298239020635,-1.2924298239020635,N=C(N)NCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1__MKKILLRLMFLAMLVALLPVHVAQACSAFIVGKDLTADGSTLFGRTEDYPYAPDGGRHNQNYVVVPAKTYKDGDKIEDESNGFTYPHLANEMKYTAVYDSDRDNGSNG,./data/raw/alphafold//AF-Q938E9-F1-model_v4.pdb,3953,4713,6522,6453 +2411,27294,27766,MGVVKGLLALALVLNVVVVSNGGKSSNFVRKTNKNRDMPLDSDVFRVPPGYNAPQQVHITQGDLVGRAMIISWVTMDEPGSSAVRYWSEKNGRKRIAKGKMSTYRFFNYSSGFIHHTTIRKLKYNTKYYYEVGLRNTTRRFSFITPPQTGLDVPYTFGLIGDLGQSFDSNTTLSHYELSPKKGQTVLFVGDLSYADRYPNHDNVRWDTWGRFTERSVAYQPWIWTAGNHEIEFAPEINETEPFKPFSYRYHVPYEASQSTSPFWYSIKRASAHIIVLSSYSAYGRGTPQYTWLKKELRKVKRSETPWLIVLMHSPLYNSYNHHFMEGEAMRTKFEAWFVKYKVDVVFAGHVHAYERSERVSNIAYKITNGLCTPVKDQSAPVYITIGDAGNYGVIDSNMIQPQPEYSAFREASFGHGMFDIKNRTHAHFSWNRNQDGVAVEADSVWFFNRHWYPVDDST,sabio,P80366,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,0.43,30.0,,3.1.3.2,3885.0,-0.3665315444204134,-1.484295767874188,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MGVVKGLLALALVLNVVVVSNGGKSSNFVRKTNKNRDMPLDSDVFRVPPGYNAPQQVHITQGDLVGRAMIISWVTMDEPGSSAVRYWSEKNGRKRIAKGKMSTYRFFNYSSGFIHHTTIRKLKYNTKYYYEVGLRNTTRRFSFITPPQTGLDVPYTFGLIGDLGQSFDSNTTLSHYELSPKKGQTVLFVGDLSYADRYPNHDNVRWDTWGRFTERSVAYQPWIWTAGNHEIEFAPEINETEPFKPFSYRYHVPYEASQSTSPFWYSIKRASAHIIVLSSYSAYGRGTPQYTWLKKELRKVKRSETPWLIVLMHSPLYNSYNHHFMEGEAMRTKFEAWFVKYKVDVVFAGHVHAYERSERVSNIAYKITNGLCTPVKDQSAPVYITIGDAGNYGVIDSNMIQPQPEYSAFREASFGHGMFDIKNRTHAHFSWNRNQDGVAVEADSVWFFNRHWYPVDDST,./data/raw/alphafold//AF-P80366-F1-model_v4.pdb,2387,6508,8388,7870 +2412,455,471,MRLIILNLLSLGITPSVVGHSGPHRQETQNLNNFLESNAINPAAINGETRHTGGVHLACAILEASNQTAVVFPSDGELYTQIDKAHASATAPKNPACIYTPNDVKGVSLGVKVATFVQAKFAIRSGGHSPMEYFANIDGGVLISLAGIKTLEYNADTQTQRSGFGNLWQDVYRHVNAQGRTVVGGRTGSVGLALTLGGGLSHFSNAYGWAAQNVLSYEMVLADGSIVIASEEENSDLYFAVKAGANNFGIVTHIVQRTYPLGKIWGGSMIFPGNASAQFMAALADYQAKGQLDKKSAILPYVGLIADAVVAQFSYLEPVERPEAFEAFYDIPVIQDLTQVWDTFAAMVTAPIPYNMTRFSYATTDLLYDKEAYLEIERICHKYIPRMRKLEGGDIMLMPQPISVSMVGEARARGSDPMGVADQPQLWFVVSSGWNLAQDDAEAESIMLDALAEVEEYTKSRALHLPFYFLNDAFSTQMPLQSYGAVTYGKLQAASRKYDPTRVFQELVPGGFKLV,uniprot_search,D7UQ40,C/C=C/C=C/CCCC/C=C/c1cc(OC)c(CO)c(=O)o1,0.016,30.0,7.0,1.1.3.42,48100.0,-1.7958800173440752,-1.7958800173440752,C/C=C/C=C/CCCC/C=C/c1cc(OC)c(CO)c(=O)o1__MRLIILNLLSLGITPSVVGHSGPHRQETQNLNNFLESNAINPAAINGETRHTGGVHLACAILEASNQTAVVFPSDGELYTQIDKAHASATAPKNPACIYTPNDVKGVSLGVKVATFVQAKFAIRSGGHSPMEYFANIDGGVLISLAGIKTLEYNADTQTQRSGFGNLWQDVYRHVNAQGRTVVGGRTGSVGLALTLGGGLSHFSNAYGWAAQNVLSYEMVLADGSIVIASEEENSDLYFAVKAGANNFGIVTHIVQRTYPLGKIWGGSMIFPGNASAQFMAALADYQAKGQLDKKSAILPYVGLIADAVVAQFSYLEPVERPEAFEAFYDIPVIQDLTQVWDTFAAMVTAPIPYNMTRFSYATTDLLYDKEAYLEIERICHKYIPRMRKLEGGDIMLMPQPISVSMVGEARARGSDPMGVADQPQLWFVVSSGWNLAQDDAEAESIMLDALAEVEEYTKSRALHLPFYFLNDAFSTQMPLQSYGAVTYGKLQAASRKYDPTRVFQELVPGGFKLV,./data/raw/alphafold//AF-D7UQ40-F1-model_v4.pdb,3059,291,331,385 +2413,37667,38333,MSSRQPFVRLNDGHCIPALGFGTYKPIEVPKSKSLEAANLAIGVGYRHIDTAYAYQIEEEIGQAIQSNIKAGIVKREDMFITTKLWCTCFQPELVRPSLEKSLKKLQLEHVDLFIMHYPVPMKAGDNDFPLDEQGKLLLDTVDFCATWEALEKCKDAGLVKSIGVSNFNHRQLERILNKPGLKYKPVCNQVECHVYNNQSKLLDYCKSKDIVLVAFGALGTQRYKEWVDQDSPVLLNDPVLCGVAKKNKRSPALIALRYLVQRGVVPLAQSFYESEMKENLQVFEFQLSPEDMKILDGLNKNFRYLPAQFFADHPEYPFSEEY,brenda,A0A097ZMY7,OC1Cc2cccc3cccc1c23,0.148,25.0,7.4,1.1.1.239,10036.0,-0.8297382846050426,-0.8297382846050426,OC1Cc2cccc3cccc1c23__MSSRQPFVRLNDGHCIPALGFGTYKPIEVPKSKSLEAANLAIGVGYRHIDTAYAYQIEEEIGQAIQSNIKAGIVKREDMFITTKLWCTCFQPELVRPSLEKSLKKLQLEHVDLFIMHYPVPMKAGDNDFPLDEQGKLLLDTVDFCATWEALEKCKDAGLVKSIGVSNFNHRQLERILNKPGLKYKPVCNQVECHVYNNQSKLLDYCKSKDIVLVAFGALGTQRYKEWVDQDSPVLLNDPVLCGVAKKNKRSPALIALRYLVQRGVVPLAQSFYESEMKENLQVFEFQLSPEDMKILDGLNKNFRYLPAQFFADHPEYPFSEEY,./data/raw/alphafold//AF-A0A097ZMY7-F1-model_v4.pdb,2022,202,2530,2517 +2414,30216,30753,MTQFDIIPFDAGDALLDWIGLTDALAEGHNLPRAEIADTFLYRGKDTLLNRAAWIDGLGLAVKSATIFPDNPAKGAPMVNGGVSLYADDHGALEALVDFHLVTKWKTAGDSLLAARRLARPDSRKILIVGAGTQGRGLHAAYRAAFPDAEFTVWNRSAPNAQAMARDIDGLRIADDLEAAVRDADIITSATMSTEPLIKGAWLQPGQHLDLIGAYRPDMREVDDTALTRARVFVDSLDTTVEHIGELKIPMAQGVLSASDIVADYYDLGAFTRQSEDDITLFKNGGGAHLDLMTSRYILDRWRAHR,sabio,A3SU01,O=C(O)C1=NCCC1,73.0,25.0,7.6,1.5.1.49,1903071.0,1.863322860120456,0.9712520530840404,O=C(O)C1=NCCC1__MTQFDIIPFDAGDALLDWIGLTDALAEGHNLPRAEIADTFLYRGKDTLLNRAAWIDGLGLAVKSATIFPDNPAKGAPMVNGGVSLYADDHGALEALVDFHLVTKWKTAGDSLLAARRLARPDSRKILIVGAGTQGRGLHAAYRAAFPDAEFTVWNRSAPNAQAMARDIDGLRIADDLEAAVRDADIITSATMSTEPLIKGAWLQPGQHLDLIGAYRPDMREVDDTALTRARVFVDSLDTTVEHIGELKIPMAQGVLSASDIVADYYDLGAFTRQSEDDITLFKNGGGAHLDLMTSRYILDRWRAHR,./data/raw/alphafold//AF-A3SU01-F1-model_v4.pdb,1775,7198,9121,9431 +2415,1276,1309,MALTQMALDSLDFDATVALAEKVAPHVDILEIGTPCIKHNGIKLLETLRAKFPNNKILVDLKTMDAGFYEAEPFYKAGADITTVLGVADLGTIKGVIDAANKYGKKAQIDLINVGDKAARTKEVAKLGAHIIGVHTGLDQQAAGQTPFADLATVTGLNLGLEVSVAGGVKPATVAQVKDAGATIIVAGAAIYGAADPAAAAAEITGLAK,brenda,Q48907,C=O,0.29,45.0,8.0,4.1.2.43,46896.0,-0.5376020021010439,-0.5376020021010439,C=O__MALTQMALDSLDFDATVALAEKVAPHVDILEIGTPCIKHNGIKLLETLRAKFPNNKILVDLKTMDAGFYEAEPFYKAGADITTVLGVADLGTIKGVIDAANKYGKKAQIDLINVGDKAARTKEVAKLGAHIIGVHTGLDQQAAGQTPFADLATVTGLNLGLEVSVAGGVKPATVAQVKDAGATIIVAGAAIYGAADPAAAAAEITGLAK,./data/raw/alphafold//AF-Q48907-F1-model_v4.pdb,3310,672,790,961 +2416,16230,16470,MVSTAKMVRGKKMEIVSLLVLVMMTAAATAASVTYDHRALVIDGKRKILISGSIHYPRSTPEMWPDLIQKSKDGGLDVIETYVFWNGHEPEKNKYNFEGRYDLVKFVKLAAKAGLYVHLRIGPYACAEWNYGGFPVWLHFVPGIKFRTDNEPFKAEMQRFTAKIVDLMKQEKLYASQGGPIILSQIENEYGNIDSSYGAAGKSYMKWSASMALSLDTGVPWNMCQQGDAPDPIINTCNGFYCDQFTPNSNNKPKMWTENWSGWFLGFGEPSPYRPVEDLAFAVARFFQRGGTFQNYYMYHGGTNFERTSGGPLISTSYDYDAPIDEYGLLRQPKWGHLRDLHKAIKLCEDALIATDPKITSLGSNLEAAVYKTSTGSCAAFLANIGTKSDATVTFNGKSYRLPAWSVSILPDCKNVAFNTAKINSATESTAFARQSLKPNADSSAELGSQWSYIKEPVGISKADAFVKPGLLEQINTTADKSDYLWYSLRMDIKGDETFLDEGSKAVLHVQSIGQLVYAFINGKLAGSGNGKQKISLDIPINLVTGKNTIDLLSVTVGLANYGPFFDLTGAGITGPVSLKSAKTGSSTDLSSQQWTYQVGLKGEDKGLGSGDSSEWVSNSPLPTSQPLIWYKTTFDAPSGSDPVAIDFTGTGKGIAWVNGQSIGRYWPTSIARTDGCVGSCDYRGSYRSNKCLKNCGKPSQTLYHVPRSWIKPSGNTLVLLEEMGGDPTKISFATKQTGSNLCLTVSQSHPAPVDTWISDSKFSNRTSPVLSLKCPVSTQVISSIRFASFGTPTGTCGSFSYGHCSSARSLSVVQKACVGSRSCKVEVSTRVFGEPCRGVVKSLAVEASCA,sabio,Q6L619,C[C@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@@H](O)[C@H]1O,10.2,37.0,4.0,3.2.1.23,3726.0,1.0086001717619175,1.0086001717619175,C[C@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@@H](O)[C@H]1O__MVSTAKMVRGKKMEIVSLLVLVMMTAAATAASVTYDHRALVIDGKRKILISGSIHYPRSTPEMWPDLIQKSKDGGLDVIETYVFWNGHEPEKNKYNFEGRYDLVKFVKLAAKAGLYVHLRIGPYACAEWNYGGFPVWLHFVPGIKFRTDNEPFKAEMQRFTAKIVDLMKQEKLYASQGGPIILSQIENEYGNIDSSYGAAGKSYMKWSASMALSLDTGVPWNMCQQGDAPDPIINTCNGFYCDQFTPNSNNKPKMWTENWSGWFLGFGEPSPYRPVEDLAFAVARFFQRGGTFQNYYMYHGGTNFERTSGGPLISTSYDYDAPIDEYGLLRQPKWGHLRDLHKAIKLCEDALIATDPKITSLGSNLEAAVYKTSTGSCAAFLANIGTKSDATVTFNGKSYRLPAWSVSILPDCKNVAFNTAKINSATESTAFARQSLKPNADSSAELGSQWSYIKEPVGISKADAFVKPGLLEQINTTADKSDYLWYSLRMDIKGDETFLDEGSKAVLHVQSIGQLVYAFINGKLAGSGNGKQKISLDIPINLVTGKNTIDLLSVTVGLANYGPFFDLTGAGITGPVSLKSAKTGSSTDLSSQQWTYQVGLKGEDKGLGSGDSSEWVSNSPLPTSQPLIWYKTTFDAPSGSDPVAIDFTGTGKGIAWVNGQSIGRYWPTSIARTDGCVGSCDYRGSYRSNKCLKNCGKPSQTLYHVPRSWIKPSGNTLVLLEEMGGDPTKISFATKQTGSNLCLTVSQSHPAPVDTWISDSKFSNRTSPVLSLKCPVSTQVISSIRFASFGTPTGTCGSFSYGHCSSARSLSVVQKACVGSRSCKVEVSTRVFGEPCRGVVKSLAVEASCA,./data/raw/alphafold//AF-Q6L619-F1-model_v4.pdb,62,2771,3447,3986 +2417,32941,33528,MDVVPLPLLLGSLAVSAAVWYLVYFLRGGSGGDAARKRRPLPPGPRGWPVLGNLPQLGDKPHHTMCALARQYGPLFRLRFGCAEVVVAASAPVAAQFLRGHDANFSNRPPNSGAEHVAYNYQDLVFAPYGARWRALRKLCALHLFSAKALDDLRAVREGEVALMVRNLARQQAASVALGQEANVCATNTLARATIGHRVFAVDGGEGAREFKEMVVELMQLAGVFNVGDFVPALRWLDPQGVVAKMKRLHRRYDNMMNGFINERKAGAQPDGVAAGEHGNDLLSVLLARMQEEQKLDGDGEKITETDIKALLLNLFTAGTDTTSSTVEWALAELIRHPDVLKEAQHELDTVVGRGRLVSESDLPRLPYLTAVIKETFRLHPSTPLSLPREAAEECEVDGYRIPKGATLLVNVWAIARDPTQWPDPLQYQPSRFLPGRMHADVDVKGADFGLIPFGAGRRICAGLSWGLRMVTLMTATLVHGFDWTLANGATPDKLNMEEAYGLTLQRAVPLMVQPVPRLLPSAYGV,brenda,Q7G602,O=C1c2c(O)cc(O)cc2OC(c2ccc(O)cc2)C1O,0.00103,30.0,7.5,1.14.14.82,39947.0,-2.987162775294828,-2.795133163076152,O=C1c2c(O)cc(O)cc2OC(c2ccc(O)cc2)C1O__MDVVPLPLLLGSLAVSAAVWYLVYFLRGGSGGDAARKRRPLPPGPRGWPVLGNLPQLGDKPHHTMCALARQYGPLFRLRFGCAEVVVAASAPVAAQFLRGHDANFSNRPPNSGAEHVAYNYQDLVFAPYGARWRALRKLCALHLFSAKALDDLRAVREGEVALMVRNLARQQAASVALGQEANVCATNTLARATIGHRVFAVDGGEGAREFKEMVVELMQLAGVFNVGDFVPALRWLDPQGVVAKMKRLHRRYDNMMNGFINERKAGAQPDGVAAGEHGNDLLSVLLARMQEEQKLDGDGEKITETDIKALLLNLFTAGTDTTSSTVEWALAELIRHPDVLKEAQHELDTVVGRGRLVSESDLPRLPYLTAVIKETFRLHPSTPLSLPREAAEECEVDGYRIPKGATLLVNVWAIARDPTQWPDPLQYQPSRFLPGRMHADVDVKGADFGLIPFGAGRRICAGLSWGLRMVTLMTATLVHGFDWTLANGATPDKLNMEEAYGLTLQRAVPLMVQPVPRLLPSAYGV,./data/raw/alphafold//AF-Q7G602-F1-model_v4.pdb,2028,7554,1822,9904 +2418,9187,9335,MATGQKLMRAVRVFEFGGPEVLKLRSDIAVPIPKDHQVLIKVHACGVNPVETYIRSGTYSRKPLLPYTPGSDVAGVIEAVGDNASAFKKGDRVFTSSTISGGYAEYALAADHTVYKLPEKLDFKQGAAIGIPYFTAYRALIHSACVKAGESVLVHGASGGVGLAACQIARAYGLKILGTAGTEEGQKIVLQNGAHEVFNHREVNYIDKIKKYVGEKGIDIIIEMLANVNLSKDLSLLSHGGRVIVVGSRGTIEINPRDTMAKESSIIGVTLFSSTKEEFQQYAAALQAGMEIGWLKPVIGSQYPLEKVAEAHENIIHGSGATGKMILLL,brenda,Q08257,CCCC=CC=O,5.45,25.0,7.5,1.6.5.5,9606.0,0.7363965022766424,0.7363965022766424,CCCC=CC=O__MATGQKLMRAVRVFEFGGPEVLKLRSDIAVPIPKDHQVLIKVHACGVNPVETYIRSGTYSRKPLLPYTPGSDVAGVIEAVGDNASAFKKGDRVFTSSTISGGYAEYALAADHTVYKLPEKLDFKQGAAIGIPYFTAYRALIHSACVKAGESVLVHGASGGVGLAACQIARAYGLKILGTAGTEEGQKIVLQNGAHEVFNHREVNYIDKIKKYVGEKGIDIIIEMLANVNLSKDLSLLSHGGRVIVVGSRGTIEINPRDTMAKESSIIGVTLFSSTKEEFQQYAAALQAGMEIGWLKPVIGSQYPLEKVAEAHENIIHGSGATGKMILLL,./data/raw/alphafold//AF-Q08257-F1-model_v4.pdb,2007,7520,1774,381 +2419,21182,21501,MQNFTFRNPTKLIFGRGQIEQLKEEVPKYGKKVLLVYGGGSIKRNGLYDEVMSLLTDIGAEVVELPGVEPNPRLSTVKKGVDICRREGIEFLLAVGGGSVIDCTKAIAAGAKFDGDPWEFITKKATVTEALPFGTVLTLAATGSEMNAGSVITNWETKEKYGWGSPVTFPQFSILDPTYTMTVPKDHTVYGIVDMMSHVFEQYFHHTPNTPLQDRMCEAVLKTVIEAAPKLVDDLENYELRETIMYSGTIALNGFLQMGVRGDWATHDIEHAVSAVYDIPHAGGLAILFPNWMKHVLDENVSRFAQLAVRVFDVDPTGKTERDVALEGIERLRAFWSSLGAPSRLADYGIGEENLELMADKAMAFGEFGRFKTLNRDDVLAILRASL,brenda,A4ISB9,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,2.4,60.0,8.0,1.1.1.192,33940.0,0.380211241711606,0.380211241711606,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MQNFTFRNPTKLIFGRGQIEQLKEEVPKYGKKVLLVYGGGSIKRNGLYDEVMSLLTDIGAEVVELPGVEPNPRLSTVKKGVDICRREGIEFLLAVGGGSVIDCTKAIAAGAKFDGDPWEFITKKATVTEALPFGTVLTLAATGSEMNAGSVITNWETKEKYGWGSPVTFPQFSILDPTYTMTVPKDHTVYGIVDMMSHVFEQYFHHTPNTPLQDRMCEAVLKTVIEAAPKLVDDLENYELRETIMYSGTIALNGFLQMGVRGDWATHDIEHAVSAVYDIPHAGGLAILFPNWMKHVLDENVSRFAQLAVRVFDVDPTGKTERDVALEGIERLRAFWSSLGAPSRLADYGIGEENLELMADKAMAFGEFGRFKTLNRDDVLAILRASL,./data/raw/alphafold//AF-A4ISB9-F1-model_v4.pdb,114,2843,3526,4091 +2420,29311,29834,MDQSSRYVNLALKEEDLIAGGEHVLCAYIMKPKAGYGYVATAAHFAAESSTGTNVEVCTTDDFTRGVDALVYEVDEARELTKIAYPVALFHRNITDGKAMIASFLTLTMGNNQGMGDVEYAKMHDFYVPEAYRALFDGPSVNISALWKVLGRPEVDGGLVVGTIIKPKLGLRPKPFAEACHAFWLGGDFIKNDEPQGNQPFAPLRDTIALVADAMRRAQDETGEAKLFSANITADDPFEIIARGEYVLETFGENASHVALLVDGYVAGAAAITTARRRFPDNFLHYHRAGHGAVTSPQSKRGYTAFVHCKMARLQGASGIHTGTMGFGKMEGESSDRAIAYMLTQDEAQGPFYRQSWGGMKACTPIISGGMNALRMPGFFENLGNANVILTAGGGAFGHIDGPVAGARSLRQAWQAWRDGVPVLDYAREHKELARAFESFPGDADQIYPGWRKALGVEDTRSALPA,brenda,P04718,O=C(COP(=O)(O)O)[C@H](O)[C@H](O)COP(=O)(O)O,0.0128,25.0,8.0,4.1.1.39,1085.0,-1.892790030352132,-1.892790030352132,O=C(COP(=O)(O)O)[C@H](O)[C@H](O)COP(=O)(O)O__MDQSSRYVNLALKEEDLIAGGEHVLCAYIMKPKAGYGYVATAAHFAAESSTGTNVEVCTTDDFTRGVDALVYEVDEARELTKIAYPVALFHRNITDGKAMIASFLTLTMGNNQGMGDVEYAKMHDFYVPEAYRALFDGPSVNISALWKVLGRPEVDGGLVVGTIIKPKLGLRPKPFAEACHAFWLGGDFIKNDEPQGNQPFAPLRDTIALVADAMRRAQDETGEAKLFSANITADDPFEIIARGEYVLETFGENASHVALLVDGYVAGAAAITTARRRFPDNFLHYHRAGHGAVTSPQSKRGYTAFVHCKMARLQGASGIHTGTMGFGKMEGESSDRAIAYMLTQDEAQGPFYRQSWGGMKACTPIISGGMNALRMPGFFENLGNANVILTAGGGAFGHIDGPVAGARSLRQAWQAWRDGVPVLDYAREHKELARAFESFPGDADQIYPGWRKALGVEDTRSALPA,./data/raw/alphafold//AF-P04718-F1-model_v4.pdb,1689,7069,8939,9198 +2421,380,394,MALNDKSIPHETKVVVLLIPFPAQGHLNQFLHLSRLIVAQNIPVHYVGTVTHIRQATLRYNNPTSNIHFHAFQVPPFVSPPPNPEDDFPSHLIPSFEASAHLREPVGKLLQSLSSQAKRVVVINDSLMASVAQDAANISNVENYTFHSFSAFNTSGDFWEEMGKPPVGDFHFPEFPSLEGCIAAQFKGFRTAQYEFRKFNNGDIYNTSRVIEGPYVELLELFNGGKKVWALGPFNPLAVEKKDSIGFRHPCMEWLDKQEPSSVIYISFGTTTALRDEQIQQIATGLEQSKQKFIWVLREADKGDIFAGSEAKRYELPKGFEERVEGMGLVVRDWAPQLEILSHSSTGGFMSHCGWNSCLESITMGVPIATWPMHSDQPRNAVLVTEVLKVGLVVKDWAQRNSLVSASVVENGVRRLMETKEGDEMRQRAVRLKNAIHRSMDEGGVSHMEMGSFIAHISK,brenda,Q9ZSK5,C/C(=C\CNc1nc[nH]c2ncnc1-2)CO,0.05,27.0,8.0,2.4.1.203,3884.0,-1.3010299956639813,-1.426935982160881,C/C(=C\CNc1nc[nH]c2ncnc1-2)CO__MALNDKSIPHETKVVVLLIPFPAQGHLNQFLHLSRLIVAQNIPVHYVGTVTHIRQATLRYNNPTSNIHFHAFQVPPFVSPPPNPEDDFPSHLIPSFEASAHLREPVGKLLQSLSSQAKRVVVINDSLMASVAQDAANISNVENYTFHSFSAFNTSGDFWEEMGKPPVGDFHFPEFPSLEGCIAAQFKGFRTAQYEFRKFNNGDIYNTSRVIEGPYVELLELFNGGKKVWALGPFNPLAVEKKDSIGFRHPCMEWLDKQEPSSVIYISFGTTTALRDEQIQQIATGLEQSKQKFIWVLREADKGDIFAGSEAKRYELPKGFEERVEGMGLVVRDWAPQLEILSHSSTGGFMSHCGWNSCLESITMGVPIATWPMHSDQPRNAVLVTEVLKVGLVVKDWAQRNSLVSASVVENGVRRLMETKEGDEMRQRAVRLKNAIHRSMDEGGVSHMEMGSFIAHISK,./data/raw/alphafold//AF-Q9ZSK5-F1-model_v4.pdb,3032,245,275,299 +2422,4855,4930,MQRVNMIMAESPGLITICLLGYLLSAECTVFLDHENANKILNRPKRYNSGKLEEFVQGNLERECMEEKCSFEEAREVFENTERTTEFWKQYVDGDQCESNPCLNGGSCKDDINSYECWCPFGFEGKNCELDVTCNIKNGRCEQFCKNSADNKVVCSCTEGYRLAENQKSCEPAVPFPCGRVSVSQTSKLTRAETVFPDVDYVNSTEAETILDNITQSTQSFNDFTRVVGGEDAKPGQFPWQVVLNGKVDAFCGGSIVNEKWIVTAAHCVETGVKITVVAGEHNIEETEHTEQKRNVIRIIPHHNYNAAINKYNHDIALLELDEPLVLNSYVTPICIADKEYTNIFLKFGSGYVSGWGRVFHKGRSALVLQYLRVPLVDRATCLRSTKFTIYNNMFCAGFHEGGRDSCQGDSGGPHVTEVEGTSFLTGIISWGEECAMKGKYGIYTKVSRYVNWIKEKTKLT,uniprot_search,P00740,CC(C)C[C@@H](NS(C)(=O)=O)C(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1,1.7,22.0,7.5,3.4.21.22,9606.0,0.2304489213782739,0.3746591804709313,CC(C)C[C@@H](NS(C)(=O)=O)C(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1__MQRVNMIMAESPGLITICLLGYLLSAECTVFLDHENANKILNRPKRYNSGKLEEFVQGNLERECMEEKCSFEEAREVFENTERTTEFWKQYVDGDQCESNPCLNGGSCKDDINSYECWCPFGFEGKNCELDVTCNIKNGRCEQFCKNSADNKVVCSCTEGYRLAENQKSCEPAVPFPCGRVSVSQTSKLTRAETVFPDVDYVNSTEAETILDNITQSTQSFNDFTRVVGGEDAKPGQFPWQVVLNGKVDAFCGGSIVNEKWIVTAAHCVETGVKITVVAGEHNIEETEHTEQKRNVIRIIPHHNYNAAINKYNHDIALLELDEPLVLNSYVTPICIADKEYTNIFLKFGSGYVSGWGRVFHKGRSALVLQYLRVPLVDRATCLRSTKFTIYNNMFCAGFHEGGRDSCQGDSGGPHVTEVEGTSFLTGIISWGEECAMKGKYGIYTKVSRYVNWIKEKTKLT,./data/raw/alphafold//AF-P00740-F1-model_v4.pdb,5120,1986,1464,2968 +2423,15659,15883,MFNRFRLVHKQLRLYKNFGLLGQKASVGLTLPIISLSRPYMAYMGTERSVVMITAPATKEFAESSERSNSSKKTTNKEQSDKSAESRMATSGIVESFPTGALVPKAETGVLNFLQKYPEYDGRDVTIAIFDSGVDPRATGLETLCDGKTVKVIERYDCSGCGDVDMKKKVTPDENGNIKGLSGNSLKLSPELMALNTDPEKAVRVGLKSFSDLLPSKVRNNIVAQAKLKHWDKPHKTATANASRKIVEFESQNPGEASKLPWDKKILKENLDFELEMLNSYEKVYGDIKTSYDCILFPTADGWLTIVDTTEQGDLDQALRIGEYSRTHETRNVDDFLSISVNVHDEGNVLEVVGMSSPHGTHVSSIASGNHSSRDVDGVAPNAKIVSMTIGDGRLGSMETGTALVRAMTKVMELCRDGRRIDVINMSYGEHANWSNSGRIGELMNEVVNKYGVVWVASAGNHGPALCTVGTPPDISQPSLIGVGAYVSPQMMEAEYAMREKLPGNVYTWTSRDPCIDGGQGVTVCAPGGAIASVPQFTMSKSQLMNGTSMAAPHVAGAVALLISGLKQQNIEYSPYSIKRAISVTATKLGYVDPFAQGHGLLNVEKAFEHLTEHRQSKDNMLRFSVRVGNNADKGIHLRQGVQRNSIDYNVYIEPIFYNDKEADPKDKFNFNVRLNLIASQPWVQCGAFLDLSYGTRSIAVRVDPTGLQPGVHSAVIRAYDTDCVQKGSLFEIPVTVVQPHVLESDQNTPVFEPASSKGDNSVEFQPNTIQRDFILVPERATWAELRMRITDPNRGEDIGKFFVHTNQLLPKQSCRKLETMKIVSVGSENESIMAFKVKSGRILELCIAKYWSNYGQSHLKYSLRFRGVEAHNPNAYVMHAGRGIHKLEIEALVAEDVQPQLQLKNAEVVLKPTEAKISPLSATRDVIPDGRQVYQNLLAFNLNVAKAADVSIYAPIFNDLLYEAEFESQMWMLFDANKALVATGDAHSHTSFTKLDKGEYTIRLQVRHEKRDLLEKISEANLVASFKLTSPLTLDFYENYNQCIVGGRKYVSSPLRLSTRVLYIAPITQERLTKANLPAQCAWLSGNLVFPQDEVGRRVAQHPFTYILNPAEKKSHTNGSSNGSSAAGSTATAAAVTTANGAKPKAPATPQAATSVTNPAAGDGISVQNDPPVDSSGSPASPKKGKANADDYAESFRDFQCSQIVKCELEMAEKIYNDVVAAHPKHLQANLLLIQNIESNQLKSQLPLTFVNAQKTSPPEAGESADKQKEDQKKVRSALERIVKLADKVIQETDSEALLSYYGLKNDTRADAAKIKTNMDKQKNTLIEALSKKGIAVAKLAVLDDCIKDSLAEINELYTEIIKFVDANDSKAIQFALWHAYAHGHYGRMYKYVVKLIEEKRTRDHFVELAAINGALGHEHIRTVINRMMITAFPSSFRLF,brenda,Q9V6K1,C[C@H](N)C(O)=N[C@H](C)C(O)=N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1,0.03,37.0,8.3,3.4.14.10,7227.0,-1.5228787452803376,-1.669135408287633,C[C@H](N)C(O)=N[C@H](C)C(O)=N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1__MFNRFRLVHKQLRLYKNFGLLGQKASVGLTLPIISLSRPYMAYMGTERSVVMITAPATKEFAESSERSNSSKKTTNKEQSDKSAESRMATSGIVESFPTGALVPKAETGVLNFLQKYPEYDGRDVTIAIFDSGVDPRATGLETLCDGKTVKVIERYDCSGCGDVDMKKKVTPDENGNIKGLSGNSLKLSPELMALNTDPEKAVRVGLKSFSDLLPSKVRNNIVAQAKLKHWDKPHKTATANASRKIVEFESQNPGEASKLPWDKKILKENLDFELEMLNSYEKVYGDIKTSYDCILFPTADGWLTIVDTTEQGDLDQALRIGEYSRTHETRNVDDFLSISVNVHDEGNVLEVVGMSSPHGTHVSSIASGNHSSRDVDGVAPNAKIVSMTIGDGRLGSMETGTALVRAMTKVMELCRDGRRIDVINMSYGEHANWSNSGRIGELMNEVVNKYGVVWVASAGNHGPALCTVGTPPDISQPSLIGVGAYVSPQMMEAEYAMREKLPGNVYTWTSRDPCIDGGQGVTVCAPGGAIASVPQFTMSKSQLMNGTSMAAPHVAGAVALLISGLKQQNIEYSPYSIKRAISVTATKLGYVDPFAQGHGLLNVEKAFEHLTEHRQSKDNMLRFSVRVGNNADKGIHLRQGVQRNSIDYNVYIEPIFYNDKEADPKDKFNFNVRLNLIASQPWVQCGAFLDLSYGTRSIAVRVDPTGLQPGVHSAVIRAYDTDCVQKGSLFEIPVTVVQPHVLESDQNTPVFEPASSKGDNSVEFQPNTIQRDFILVPERATWAELRMRITDPNRGEDIGKFFVHTNQLLPKQSCRKLETMKIVSVGSENESIMAFKVKSGRILELCIAKYWSNYGQSHLKYSLRFRGVEAHNPNAYVMHAGRGIHKLEIEALVAEDVQPQLQLKNAEVVLKPTEAKISPLSATRDVIPDGRQVYQNLLAFNLNVAKAADVSIYAPIFNDLLYEAEFESQMWMLFDANKALVATGDAHSHTSFTKLDKGEYTIRLQVRHEKRDLLEKISEANLVASFKLTSPLTLDFYENYNQCIVGGRKYVSSPLRLSTRVLYIAPITQERLTKANLPAQCAWLSGNLVFPQDEVGRRVAQHPFTYILNPAEKKSHTNGSSNGSSAAGSTATAAAVTTANGAKPKAPATPQAATSVTNPAAGDGISVQNDPPVDSSGSPASPKKGKANADDYAESFRDFQCSQIVKCELEMAEKIYNDVVAAHPKHLQANLLLIQNIESNQLKSQLPLTFVNAQKTSPPEAGESADKQKEDQKKVRSALERIVKLADKVIQETDSEALLSYYGLKNDTRADAAKIKTNMDKQKNTLIEALSKKGIAVAKLAVLDDCIKDSLAEINELYTEIIKFVDANDSKAIQFALWHAYAHGHYGRMYKYVVKLIEEKRTRDHFVELAAINGALGHEHIRTVINRMMITAFPSSFRLF,./data/raw/alphafold//AF-Q9V6K1-F1-model_v4.pdb,597,3913,5292,5624 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+2437,11627,11791,MAAERVFISPAKYVQGKNVITKIANYLEGIGNKTVVIADEIVWKIAGHTIVNELKKGNIAAEEVVFSGEASRNEVERIANIARKAEAAIVIGVGGGKTLDTAKAVADELDAYIVIVPTAASTDAPTSALSVIYSDDGVFESYRFYKKNPDLVLVDTKIIANAPPRLLASGIADALATWVEARSVIKSGGKTMAGGIPTIAAEAIAEKCEQTLFKYGKLAYESVKAKVVTPALEAVVEANTLLSGLGFESGGLAAAHAIHNGFTALEGEIHHLTHGEKVAFGTLVQLALEEHSQQEIERYIELYLSLDLPVTLEDIKLKDASREDILKVAKAATAEGETIHNAFNVTADDVADAIFAADQYAKAYKEKHRK,brenda,P32816,CCOCC(O)CO,13.4,30.0,7.0,1.1.1.6,1422.0,1.1271047983648077,1.1271047983648077,CCOCC(O)CO__MAAERVFISPAKYVQGKNVITKIANYLEGIGNKTVVIADEIVWKIAGHTIVNELKKGNIAAEEVVFSGEASRNEVERIANIARKAEAAIVIGVGGGKTLDTAKAVADELDAYIVIVPTAASTDAPTSALSVIYSDDGVFESYRFYKKNPDLVLVDTKIIANAPPRLLASGIADALATWVEARSVIKSGGKTMAGGIPTIAAEAIAEKCEQTLFKYGKLAYESVKAKVVTPALEAVVEANTLLSGLGFESGGLAAAHAIHNGFTALEGEIHHLTHGEKVAFGTLVQLALEEHSQQEIERYIELYLSLDLPVTLEDIKLKDASREDILKVAKAATAEGETIHNAFNVTADDVADAIFAADQYAKAYKEKHRK,./data/raw/alphafold//AF-P32816-F1-model_v4.pdb,5196,2094,1363,3131 +2438,24844,25233,MTTNYIFVTGGVVSSLGKGIAAASLAAILEARGLNVTIMKLDPYINVDPGTMSPIQHGEVFVTEDGAETDLDLGHYERFIRTKMSRRNNFTTGRIYSDVLRKERRGDYLGATVQVIPHITNAIKERVLEGGEGHDVVLVEIGGTVGDIESLPFLEAIRQMAVEIGREHTLFMHLTLVPYMAASGEVKTKPTQHSVKELLSIGIQPDILICRSDRAVPANERAKIALFCNVPEKAVISLKDVDSIYKIPGLLKSQGLDDYICKRFSLNCPEANLSEWEQVIFEEANPVSEVTIGMVGKYIELPDAYKSVIEALKHGGLKNRVSVNIKLIDSQDVETRGVEILKGLDAILVPGGFGYRGVEGMITTARFARENNIPYLGICLGMQVALIDYARHVANMENANSTEFVPDCKYPVVALITEWRDENGNVEVRSEKSDLGGTMRLGAQQCQLVDDSLVRQLYNAPTIVERHRHRYEVNNMLLKQIEDAGLRVAGRSGDDQLVEIIEVPNHPWFVACQFHPEFTSTPRDGHPLFAGFVKAASEFQKRQAK,brenda,P0A7E5,NO,82.8,37.0,8.0,6.3.4.2,562.0,1.91803033678488,1.91803033678488,NO__MTTNYIFVTGGVVSSLGKGIAAASLAAILEARGLNVTIMKLDPYINVDPGTMSPIQHGEVFVTEDGAETDLDLGHYERFIRTKMSRRNNFTTGRIYSDVLRKERRGDYLGATVQVIPHITNAIKERVLEGGEGHDVVLVEIGGTVGDIESLPFLEAIRQMAVEIGREHTLFMHLTLVPYMAASGEVKTKPTQHSVKELLSIGIQPDILICRSDRAVPANERAKIALFCNVPEKAVISLKDVDSIYKIPGLLKSQGLDDYICKRFSLNCPEANLSEWEQVIFEEANPVSEVTIGMVGKYIELPDAYKSVIEALKHGGLKNRVSVNIKLIDSQDVETRGVEILKGLDAILVPGGFGYRGVEGMITTARFARENNIPYLGICLGMQVALIDYARHVANMENANSTEFVPDCKYPVVALITEWRDENGNVEVRSEKSDLGGTMRLGAQQCQLVDDSLVRQLYNAPTIVERHRHRYEVNNMLLKQIEDAGLRVAGRSGDDQLVEIIEVPNHPWFVACQFHPEFTSTPRDGHPLFAGFVKAASEFQKRQAK,./data/raw/alphafold//AF-P0A7E5-F1-model_v4.pdb,4195,5087,6992,6995 +2439,778,801,MIYAPIAKTQLEWYASLNPLEHGVDNKFFRKTSIIATIGPKTNNVEMLGALRQAGMNIVRLNASHGSHEYFKSVVDNARAVVAKTPGRPLAIALDTKGPEMRTGVMVNGEDVKISMGHEFYVTTDDAYAEKCSLDYLYIDYKNLAQKVEVGRTIFIDDGILSLQVLAIESDKLVKVRAVNNGVLSSKKGVNLPMTEVDLPAISDKDRKDIEFAVEQDLDMIFASFIRRGSDVRTIREILGEKGAHIKIISKVENHQGVQNFDEILKESDGIMVARGDLGIEIPAPQVFMAQKMMISKCNIAGKPVICATQMLESMIVNNRPTRAEVSDVANAVLDGADCVMLSGETAKGAYPIEAVKMMAETAYLAEQSVSYVPLFNEMRTLTSIPTDTNETIAMAAVAASLEQHAGAILLMSTSGTTARLVSKYRPSCPILTITRNSHTARDVHLYRGCYPFLYPHARPEDNSKWQEDVDNRIKYGLAEALALGIIEKGDVVITLQGWRAQSGSTNTIRILSVPESARDFKLEGTQV,sabio,A0A0D1E735,C=C(OP(=O)(O)O)C(=O)O,0.33,28.0,6.4,2.7.1.40,5270.0,-0.4814860601221125,-0.7011524070372439,C=C(OP(=O)(O)O)C(=O)O__MIYAPIAKTQLEWYASLNPLEHGVDNKFFRKTSIIATIGPKTNNVEMLGALRQAGMNIVRLNASHGSHEYFKSVVDNARAVVAKTPGRPLAIALDTKGPEMRTGVMVNGEDVKISMGHEFYVTTDDAYAEKCSLDYLYIDYKNLAQKVEVGRTIFIDDGILSLQVLAIESDKLVKVRAVNNGVLSSKKGVNLPMTEVDLPAISDKDRKDIEFAVEQDLDMIFASFIRRGSDVRTIREILGEKGAHIKIISKVENHQGVQNFDEILKESDGIMVARGDLGIEIPAPQVFMAQKMMISKCNIAGKPVICATQMLESMIVNNRPTRAEVSDVANAVLDGADCVMLSGETAKGAYPIEAVKMMAETAYLAEQSVSYVPLFNEMRTLTSIPTDTNETIAMAAVAASLEQHAGAILLMSTSGTTARLVSKYRPSCPILTITRNSHTARDVHLYRGCYPFLYPHARPEDNSKWQEDVDNRIKYGLAEALALGIIEKGDVVITLQGWRAQSGSTNTIRILSVPESARDFKLEGTQV,./data/raw/alphafold//AF-A0A0D1E735-F1-model_v4.pdb,3167,461,530,642 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+2453,40735,41472,MNRRNFLKFNALTLASMGVAYANPMHDMHSMHKNHSINHDLDTSFINFAPKNLKLLDPKQFPQGEILKALPLLKNESKEKNIFRATIEIKENHIELIKGKKTLFYTYNGLVPAPKIEVFEGDKLEILVKNKLKEATTIHWHGVPVPPDQDGSPHDPILAGEERIYRFEIPQDSAGTYWYHPHPHYTTSKQVFMGLAGAFVIKAKKDALSHLKERDLMISDLRLDENAQIPNNNLNDWLNGREGEFVLINGQFKPKIKLATNERIRIYNATAARYLNLRIQGAKFILVGTDGGLIEKAIYKEEFFLSPASRVEVLIDAPKDGEFRLESAYYDRDKMMVKEEPNTLFLANINLKKENVELPKNLKIFKPSEEPKEFKEIIMSEDHMQMHGMMGKSESELKIALASMFLINGKSYDLKRIDLSSKLGVVEDWIVINKSHMDHPFHIHGTQFELISSKLNGKVQKAEFRALRDTINVRPNEELRLRMKQDFKGLRMYHCHILEHEDLGMMGNLEVKE,sabio,A0A0H3PBA4,[Cu+],0.128,37.0,5.0,1.10.3.2,197.0,-0.8927900303521317,-0.8927900303521317,[Cu+]__MNRRNFLKFNALTLASMGVAYANPMHDMHSMHKNHSINHDLDTSFINFAPKNLKLLDPKQFPQGEILKALPLLKNESKEKNIFRATIEIKENHIELIKGKKTLFYTYNGLVPAPKIEVFEGDKLEILVKNKLKEATTIHWHGVPVPPDQDGSPHDPILAGEERIYRFEIPQDSAGTYWYHPHPHYTTSKQVFMGLAGAFVIKAKKDALSHLKERDLMISDLRLDENAQIPNNNLNDWLNGREGEFVLINGQFKPKIKLATNERIRIYNATAARYLNLRIQGAKFILVGTDGGLIEKAIYKEEFFLSPASRVEVLIDAPKDGEFRLESAYYDRDKMMVKEEPNTLFLANINLKKENVELPKNLKIFKPSEEPKEFKEIIMSEDHMQMHGMMGKSESELKIALASMFLINGKSYDLKRIDLSSKLGVVEDWIVINKSHMDHPFHIHGTQFELISSKLNGKVQKAEFRALRDTINVRPNEELRLRMKQDFKGLRMYHCHILEHEDLGMMGNLEVKE,./data/raw/alphafold//AF-A0A0H3PBA4-F1-model_v4.pdb,5274,3344,4117,4800 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+2455,39337,40036,MYKLVSFRDSEIFGRVAEVEFSLIREGSYAYLLGDFNAFNEGSFRMEQEGKNWKIKIALPEGVWHYAFSIDGKFVLDPDNPERRVYTRKGYKFHREVNVARIVKSDDLVFHTPSLLYLYEIFGRVHVLLRTQKGVIKGATFLGEKHVPMRKKASDELFDYFEVIVEGGDKRLNYSFEVLTMEGAKFEYGQFKARPFSIEFPTWVIDRVFYQIMPDKFARSRKIQGIAYPKDKYWGGDLIGIKEKIDHLVNLGINAIYLTPIFSSLTYHGYDIVDYFHVARRLGGDRAFVDLLSELKRFDIKVILDGVFHHTSFFHPYFQDVVRKGENSSFKNFYRIIKFPVVSKEFLQILHSKSSWEEKYKKIKSLGWNYESFFSVWIMPRLNHDNPKVREFIKNVILFWTNKGVDGFRMDVAHGVPPEVWKEVREALPKEKYLIGEVMDDARLWLFDKFHGVMNYRLYDAILRFFGYEEITAEEFLNELELLSSYYGPAEYLMYNFLDNHDVERFLDIVGDKRKYVCALVFLMTYKGIPSLFYGDEIGLRGINLQGMESSRAPMLWNEEEWDQRILEITKTLVKIRKNNKALLFGNFVPVKFKRKFMVYKREHMGERTIVAINYSNSRVKELGITIPEYSGVIINEDKVKLIKY,brenda,Q8TZP8,OC[C@H]1O[C@@H]2O[C@H]3[C@H](O)[C@@H](O)[C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@@H](O[C@H]6[C@H](O)[C@@H](O)[C@@H](O[C@H]7[C@H](O)[C@@H](O)[C@@H](O[C@H]8[C@H](O)[C@@H](O)[C@@H](O[C@H]1[C@H](O)[C@H]2O)O[C@@H]8CO)O[C@@H]7CO)O[C@@H]6CO)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO,8.78,85.0,4.5,3.2.1.54,2261.0,0.9434945159061026,0.9434945159061026,OC[C@H]1O[C@@H]2O[C@H]3[C@H](O)[C@@H](O)[C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@@H](O[C@H]6[C@H](O)[C@@H](O)[C@@H](O[C@H]7[C@H](O)[C@@H](O)[C@@H](O[C@H]8[C@H](O)[C@@H](O)[C@@H](O[C@H]1[C@H](O)[C@H]2O)O[C@@H]8CO)O[C@@H]7CO)O[C@@H]6CO)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO__MYKLVSFRDSEIFGRVAEVEFSLIREGSYAYLLGDFNAFNEGSFRMEQEGKNWKIKIALPEGVWHYAFSIDGKFVLDPDNPERRVYTRKGYKFHREVNVARIVKSDDLVFHTPSLLYLYEIFGRVHVLLRTQKGVIKGATFLGEKHVPMRKKASDELFDYFEVIVEGGDKRLNYSFEVLTMEGAKFEYGQFKARPFSIEFPTWVIDRVFYQIMPDKFARSRKIQGIAYPKDKYWGGDLIGIKEKIDHLVNLGINAIYLTPIFSSLTYHGYDIVDYFHVARRLGGDRAFVDLLSELKRFDIKVILDGVFHHTSFFHPYFQDVVRKGENSSFKNFYRIIKFPVVSKEFLQILHSKSSWEEKYKKIKSLGWNYESFFSVWIMPRLNHDNPKVREFIKNVILFWTNKGVDGFRMDVAHGVPPEVWKEVREALPKEKYLIGEVMDDARLWLFDKFHGVMNYRLYDAILRFFGYEEITAEEFLNELELLSSYYGPAEYLMYNFLDNHDVERFLDIVGDKRKYVCALVFLMTYKGIPSLFYGDEIGLRGINLQGMESSRAPMLWNEEEWDQRILEITKTLVKIRKNNKALLFGNFVPVKFKRKFMVYKREHMGERTIVAINYSNSRVKELGITIPEYSGVIINEDKVKLIKY,./data/raw/alphafold//AF-Q8TZP8-F1-model_v4.pdb,2698,8435,8480,11605 +2456,19373,19654,MPAHSFRIAAIPGDGIGLEVLPEGIRVLEAAALKHGLALEFDTFEWASCDYYLQHGKMMPDDWAEQLKQYDAIYFGAVDWPDKVPDHISLWGSLLKFRREFDQYVNIRPVRLFPGVPCALANRKVGDIDFVVVRENTEGEYSSLGGIMFENTENEIVIQESIFTRRGVDRILKYAFDLAEKRERKHVTSATKSNGMAISMPYWDKRTEAMAAHYPHVSWDKQHIDILCARFVLQPERFDVVVVASNLFGDILSDLGPACAGTIGIAPSANLNPERNFPSLFEPVHGSAPDIFGKNIANPIAMIWSGALMLEFLGQGDERYQRAHDDMLNAIERVIADGSVTPDMGGTLSTQQVGAAISDTLARLD,uniprot_search,Q51945,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,1.4,25.0,7.833333333333333,1.1.1.93,303.0,0.1461280356782379,0.1461280356782379,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MPAHSFRIAAIPGDGIGLEVLPEGIRVLEAAALKHGLALEFDTFEWASCDYYLQHGKMMPDDWAEQLKQYDAIYFGAVDWPDKVPDHISLWGSLLKFRREFDQYVNIRPVRLFPGVPCALANRKVGDIDFVVVRENTEGEYSSLGGIMFENTENEIVIQESIFTRRGVDRILKYAFDLAEKRERKHVTSATKSNGMAISMPYWDKRTEAMAAHYPHVSWDKQHIDILCARFVLQPERFDVVVVASNLFGDILSDLGPACAGTIGIAPSANLNPERNFPSLFEPVHGSAPDIFGKNIANPIAMIWSGALMLEFLGQGDERYQRAHDDMLNAIERVIADGSVTPDMGGTLSTQQVGAAISDTLARLD,./data/raw/alphafold//AF-Q51945-F1-model_v4.pdb,4306,1881,2780,2801 +2457,20397,20705,MSSKGSVVLAYSGGLDTSCILVWLKEQGYDVIAYLANIGQKEDFEEARKKALKLGAKKVFIEDVSKEFVEEFIWPAVQSSALYEDRYLLGTSLARPCIARRQVEIAQREGAKYVSHGATGKGNDQVRFELTCYSLAPQIKVIAPWRMPEFYNRFKGRNDLMEYAKQHGIPIPVTPKSPWSMDENLMHISYEAGILENPKNQAPPGLYTKTQDPAKAPNSPDVLEIEFKKGVPVKVTNIKDGTTRTTSLELFMYLNEVAGKHGVGRIDIVENRFIGMKSRGIYETPAGTILYHAHLDIEAFTMDREVRKIKQGLGLKFAELVYTGFWHSPECEFVRHCIQKSQERVEGKVQVSVFKGQVYILGRESPLSLYNEELVSMNVQGDYEPIDATGFININSLRLKEYHRLQSKVTAK,brenda,P16460,N=C(O)NCCCC(N)C(=O)O,0.18,37.0,7.8,6.3.4.5,10090.0,-0.744727494896694,-0.5753423320768168,N=C(O)NCCCC(N)C(=O)O__MSSKGSVVLAYSGGLDTSCILVWLKEQGYDVIAYLANIGQKEDFEEARKKALKLGAKKVFIEDVSKEFVEEFIWPAVQSSALYEDRYLLGTSLARPCIARRQVEIAQREGAKYVSHGATGKGNDQVRFELTCYSLAPQIKVIAPWRMPEFYNRFKGRNDLMEYAKQHGIPIPVTPKSPWSMDENLMHISYEAGILENPKNQAPPGLYTKTQDPAKAPNSPDVLEIEFKKGVPVKVTNIKDGTTRTTSLELFMYLNEVAGKHGVGRIDIVENRFIGMKSRGIYETPAGTILYHAHLDIEAFTMDREVRKIKQGLGLKFAELVYTGFWHSPECEFVRHCIQKSQERVEGKVQVSVFKGQVYILGRESPLSLYNEELVSMNVQGDYEPIDATGFININSLRLKEYHRLQSKVTAK,./data/raw/alphafold//AF-P16460-F1-model_v4.pdb,4661,5799,7501,7035 +2458,20762,21074,MLNIVMIGCGAIGAGVLELLENDPQLRVDAVIVPRDSETQVRHRLASLRRPPRVLSALPAGERPDLLVECAGHRAIEQHVLPALAQGIPCLVVSVGALSEPGLVERLEAAAQAGGSRIELLPGAIGAIDALSAARVGGLESVRYTGRKPASAWLGTPGETVCDLQRLEKARVIFDGSAREAARLYPKNANVAATLSLAGLGLDRTQVRLIADPESCENVHQVEASGAFGGFELTLRGKPLAANPKTSALTVYSVVRALGNHAHAISI,brenda,Q9HYA4,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.47,37.0,9.8,1.4.1.21,287.0,-0.3279021420642826,-0.3279021420642826,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MLNIVMIGCGAIGAGVLELLENDPQLRVDAVIVPRDSETQVRHRLASLRRPPRVLSALPAGERPDLLVECAGHRAIEQHVLPALAQGIPCLVVSVGALSEPGLVERLEAAAQAGGSRIELLPGAIGAIDALSAARVGGLESVRYTGRKPASAWLGTPGETVCDLQRLEKARVIFDGSAREAARLYPKNANVAATLSLAGLGLDRTQVRLIADPESCENVHQVEASGAFGGFELTLRGKPLAANPKTSALTVYSVVRALGNHAHAISI,./data/raw/alphafold//AF-Q9HYA4-F1-model_v4.pdb,3908,4649,6446,6359 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+2530,15240,15454,MKVAILGAGCYRTHAACGITNFARAAEVAKKVGIPEITMTHSTITMGAELLHLVDEIDEVVVSDPCFAEEPGLVIIDEFDPKEVMEAHLAGEPEKVMPAIRDAVKAKAKEVPKPPKGCIHFVHPEKVGLKVTSDDVEAVKDADIIITWLPKGGSQPAIIKKFVDAIKEGAIVTHACTIPTPKFAKIFKDLGRDDLNIISYHPGAVPEMKGQVFISEGYASEEAVEKMYCIAKEARGTAYKMPANLISPVCDMGSAVTAPVYAAVLAYRDAVTKILGAPADFAQMMADEAITQILELMRKEGINNMEKTLDPKALTGTADSMCFGPLSDILPPALKVLEKHAAEEESCCCELKK,uniprot_search,Q50759,C[C@@H]1Nc2[nH]c(=N)nc(O)c2N2CN(c3ccc(C[C@H](O)[C@H](O)[C@H](O)CO[C@H]4O[C@H](COP(=O)(O)O[C@@H](CCC(=O)O)C(=O)O)[C@@H](O)[C@H]4O)cc3)[C@H](C)[C@@H]12,0.06,80.0,,1.12.98.2,2186.0,-1.2218487496163564,-1.2218487496163564,C[C@@H]1Nc2[nH]c(=N)nc(O)c2N2CN(c3ccc(C[C@H](O)[C@H](O)[C@H](O)CO[C@H]4O[C@H](COP(=O)(O)O[C@@H](CCC(=O)O)C(=O)O)[C@@H](O)[C@H]4O)cc3)[C@H](C)[C@@H]12__MKVAILGAGCYRTHAACGITNFARAAEVAKKVGIPEITMTHSTITMGAELLHLVDEIDEVVVSDPCFAEEPGLVIIDEFDPKEVMEAHLAGEPEKVMPAIRDAVKAKAKEVPKPPKGCIHFVHPEKVGLKVTSDDVEAVKDADIIITWLPKGGSQPAIIKKFVDAIKEGAIVTHACTIPTPKFAKIFKDLGRDDLNIISYHPGAVPEMKGQVFISEGYASEEAVEKMYCIAKEARGTAYKMPANLISPVCDMGSAVTAPVYAAVLAYRDAVTKILGAPADFAQMMADEAITQILELMRKEGINNMEKTLDPKALTGTADSMCFGPLSDILPPALKVLEKHAAEEESCCCELKK,./data/raw/alphafold//AF-Q50759-F1-model_v4.pdb,522,3802,5160,5481 +2531,3015,3067,MRTYNTTLASLECDDETLRAHLQGADIPTLLLTVAHLTGDLNVLKPAWKPVVAMGVAHSGMTPEVEAEVREDCLQKLLAFRDSGLPVPARPSSEQLHALGTWLMGPVIEPYLPLVAEELVTAEEDPRAPRWHKDHVAAGREFKVVIIGAGVSGMIAALRFKQAGVPFVVYEKGTDVGGTWRENTYPGCRIDINSFFYSFSFARSTWDDCFAPGPQVFSYMQAVARDKGLYDHIQFNTEVTDAHWDEDRQRWQLLCRDSAGQTRVDSNVVVFAVGQLNRPMIPAIPGKETFQGPAFHSAQWDHNVDWSGKRVAVIGTGASAAQFIPQLAKTAADLKVFARTTNWLLPTPDLHEKISDSCKWLLANLPNYSLWYRATKVMPQSVGFLEDVVVDVDYPPTEVAVSARNDQLRRDICAWMEPQFADRPDLRNVLIPDSPVGSKRIIRDNGTWISTLKRDNVSMIRQPIEAIRPTGICCIDGTVHEFDLIVYGTGFHASKFLMPINITGRDGLALREVWKDDDARAYMGMTVPGFPNMFCMYGPNTGLVVYSTIIQFSEFTATYIVDAVRLLLEGGHQSMEIKAQVFESYNQRVDQANGLRAWGFSRVNSWYKNSKGRVTQNFPFNAVEFWHRTHEVQATDYCLS,brenda,B7T912,CC(=O)c1ccc[nH]1,0.103,30.0,8.0,1.14.13.84,303.0,-0.9871627752948278,-0.9871627752948278,CC(=O)c1ccc[nH]1__MRTYNTTLASLECDDETLRAHLQGADIPTLLLTVAHLTGDLNVLKPAWKPVVAMGVAHSGMTPEVEAEVREDCLQKLLAFRDSGLPVPARPSSEQLHALGTWLMGPVIEPYLPLVAEELVTAEEDPRAPRWHKDHVAAGREFKVVIIGAGVSGMIAALRFKQAGVPFVVYEKGTDVGGTWRENTYPGCRIDINSFFYSFSFARSTWDDCFAPGPQVFSYMQAVARDKGLYDHIQFNTEVTDAHWDEDRQRWQLLCRDSAGQTRVDSNVVVFAVGQLNRPMIPAIPGKETFQGPAFHSAQWDHNVDWSGKRVAVIGTGASAAQFIPQLAKTAADLKVFARTTNWLLPTPDLHEKISDSCKWLLANLPNYSLWYRATKVMPQSVGFLEDVVVDVDYPPTEVAVSARNDQLRRDICAWMEPQFADRPDLRNVLIPDSPVGSKRIIRDNGTWISTLKRDNVSMIRQPIEAIRPTGICCIDGTVHEFDLIVYGTGFHASKFLMPINITGRDGLALREVWKDDDARAYMGMTVPGFPNMFCMYGPNTGLVVYSTIIQFSEFTATYIVDAVRLLLEGGHQSMEIKAQVFESYNQRVDQANGLRAWGFSRVNSWYKNSKGRVTQNFPFNAVEFWHRTHEVQATDYCLS,./data/raw/alphafold//AF-B7T912-F1-model_v4.pdb,3464,958,1151,1418 +2532,40657,41393,MSEVINFDQIFEGAIEPGKEPKRLFKEVYEGAITATSYAEILLSRAIEKYGPDHPVGYPDTAYFLPVIRAFSGEEVRTLKDMVPILNRMRAQIKSELTFENARLAGEATWYAAEIIEALRYLKHTPENPIVVPPWTGFIGDPVVRQYGIKMVDWTIPGEAIIIGRAKDSKAAKKIVDDLMGKGLMLFLCDEIIEQLLEENVKLGVDYIAYPLGNFTQVVHAANYALRAGLMFGGIAPGLRDAHRDYQRRRVLAFVLYLGEHDMVKTAAAMGAIFTGFPVITDQPLPEDKQIKDWFISEPDYDKIVQTALEVRGIKITSIDIDLPINFGPAFEGESIRKGDMHVEFGGGKTPSFELVRMVGPDEIEDGKVEVIGPDIDSVEPGGRLPIGIVVDIYGRKMQEDFEPVLERRIHYFTNYGEGFWHTAQRDLTWVRISKEAFAKGARLKHLGQLLYAKFKQEFPSIVDRVQVTIYTDEQKVLELREIARKKYAERDARLRELSDEAVDTYYSCLLCQSFAPTHVCIVSPERVGLCGAISWLDAKAAYEINPNGPNQPIPKEGLIDPVKGQWESFNEYIYKNSQRTIERMNLYTIMEYPMTSCGCFEAIMAYLPELNGFMIVNREHSGMTPIGMTFSTLAGMVGGGTQTPGFMGIGKSYIGSRKFVKADGGLARVVWMPKDLKEQLRSIIEERAEEEGLGRDFIDKIADETVGTTVDEVLPFLEEKGHPALSMEPLL,uniprot_search,P83789,[C-]#[O+],0.36,25.0,7.2,2.3.1.169,129958.0,-0.4436974992327127,-0.4436974992327127,[C-]#[O+]__MSEVINFDQIFEGAIEPGKEPKRLFKEVYEGAITATSYAEILLSRAIEKYGPDHPVGYPDTAYFLPVIRAFSGEEVRTLKDMVPILNRMRAQIKSELTFENARLAGEATWYAAEIIEALRYLKHTPENPIVVPPWTGFIGDPVVRQYGIKMVDWTIPGEAIIIGRAKDSKAAKKIVDDLMGKGLMLFLCDEIIEQLLEENVKLGVDYIAYPLGNFTQVVHAANYALRAGLMFGGIAPGLRDAHRDYQRRRVLAFVLYLGEHDMVKTAAAMGAIFTGFPVITDQPLPEDKQIKDWFISEPDYDKIVQTALEVRGIKITSIDIDLPINFGPAFEGESIRKGDMHVEFGGGKTPSFELVRMVGPDEIEDGKVEVIGPDIDSVEPGGRLPIGIVVDIYGRKMQEDFEPVLERRIHYFTNYGEGFWHTAQRDLTWVRISKEAFAKGARLKHLGQLLYAKFKQEFPSIVDRVQVTIYTDEQKVLELREIARKKYAERDARLRELSDEAVDTYYSCLLCQSFAPTHVCIVSPERVGLCGAISWLDAKAAYEINPNGPNQPIPKEGLIDPVKGQWESFNEYIYKNSQRTIERMNLYTIMEYPMTSCGCFEAIMAYLPELNGFMIVNREHSGMTPIGMTFSTLAGMVGGGTQTPGFMGIGKSYIGSRKFVKADGGLARVVWMPKDLKEQLRSIIEERAEEEGLGRDFIDKIADETVGTTVDEVLPFLEEKGHPALSMEPLL,./data/raw/alphafold//AF-P83789-F1-model_v4.pdb,3683,1343,2097,1999 +2533,1737,1775,MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEAVKLAIEAGFHHIDSAHVYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWSNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEEVIPKDENGKILFDTVDLCATWEAMEKCKDAGLAKSIGVSNFNHRLLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRNVRYLTLDIFAGPPNYPFSDEY,sabio,P52895,CC(=O)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C,0.0028,25.0,7.0,1.1.1.357,9606.0,-2.552841968657781,-2.2402774324264865,CC(=O)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C__MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEAVKLAIEAGFHHIDSAHVYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWSNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEEVIPKDENGKILFDTVDLCATWEAMEKCKDAGLAKSIGVSNFNHRLLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRNVRYLTLDIFAGPPNYPFSDEY,./data/raw/alphafold//AF-P52895-F1-model_v4.pdb,2022,202,1057,250 +2534,7710,7843,MSLFAFLKSRTAFWLSFTGTTTGLAFFVKDLMQGGQFTKETNETGKVFIVTGANTGIGKETVREIAKRGGTVYMACRNLKKCEEAREEIVLETKNKYVYCRQCDLASQESIRHFVAAFKREQEHLHVLINNAGVMRCPRSLTSDGIELQLGVNHMGHFLLTNLLLDLLKKSSPSRIVNVSSLAHTRGEINTGDLNSDKSYDEGKAYSQSKLANVLFTRELAKRLEGTNVTANALHPGVVDTEIIRHMGFFNNFFAGLFVKPLFWPFVKTPRNGAQTSLYVALDPELEKVTGQYFSDCKLKEMAPAATDTQTAKWLWAVSEKWTKPTMIKIQ,brenda,Q7JUS1,CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=O)C(C)(C)CC(O)C1,0.0032,37.0,7.6,1.1.1.300,7227.0,-2.494850021680094,-2.494850021680094,CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=O)C(C)(C)CC(O)C1__MSLFAFLKSRTAFWLSFTGTTTGLAFFVKDLMQGGQFTKETNETGKVFIVTGANTGIGKETVREIAKRGGTVYMACRNLKKCEEAREEIVLETKNKYVYCRQCDLASQESIRHFVAAFKREQEHLHVLINNAGVMRCPRSLTSDGIELQLGVNHMGHFLLTNLLLDLLKKSSPSRIVNVSSLAHTRGEINTGDLNSDKSYDEGKAYSQSKLANVLFTRELAKRLEGTNVTANALHPGVVDTEIIRHMGFFNNFFAGLFVKPLFWPFVKTPRNGAQTSLYVALDPELEKVTGQYFSDCKLKEMAPAATDTQTAKWLWAVSEKWTKPTMIKIQ,./data/raw/alphafold//AF-Q7JUS1-F1-model_v4.pdb,5233,2726,3400,3932 +2535,7110,7241,MEVMRVLHMNKGNGETSYAKNSTAQSNIISLGRRVMDEALKKLMMSNSEISSIGIADLGCSSGPNSLLSISNIVDTIHNLCPDLDRPVPELRVSLNDLPSNDFNYICASLPEFYDRVNNNKEGLGFGRGGGESCFVSAVPGSFYGRLFPRRSLHFVHSSSSLHWLSQVPCREAEKEDRTITADLENMGKIYISKTSPKSAHKAYALQFQTDFWVFLRSRSEELVPGGRMVLSFLGRRSLDPTTEESCYQWELLAQALMSMAKEGIIEEEKIDAFNAPYYAASSEELKMVIEKEGSFSIDRLEISPIDWEGGSISEESYDLVIRSKPEALASGRRVSNTIRAVVEPMLEPTFGENVMDELFERYAKIVGEYFYVSSPRYAIVILSLVRAG,brenda,Q9AR07,CC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)O,0.0385,20.0,7.5,2.1.1.141,3702.0,-1.4145392704914994,-1.4145392704914994,CC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)O__MEVMRVLHMNKGNGETSYAKNSTAQSNIISLGRRVMDEALKKLMMSNSEISSIGIADLGCSSGPNSLLSISNIVDTIHNLCPDLDRPVPELRVSLNDLPSNDFNYICASLPEFYDRVNNNKEGLGFGRGGGESCFVSAVPGSFYGRLFPRRSLHFVHSSSSLHWLSQVPCREAEKEDRTITADLENMGKIYISKTSPKSAHKAYALQFQTDFWVFLRSRSEELVPGGRMVLSFLGRRSLDPTTEESCYQWELLAQALMSMAKEGIIEEEKIDAFNAPYYAASSEELKMVIEKEGSFSIDRLEISPIDWEGGSISEESYDLVIRSKPEALASGRRVSNTIRAVVEPMLEPTFGENVMDELFERYAKIVGEYFYVSSPRYAIVILSLVRAG,./data/raw/alphafold//AF-Q9AR07-F1-model_v4.pdb,5847,2676,3338,3855 +2536,30002,30530,MQQASTPTIGMIVPPAAGLVPADGARLYPDLPFIASGLGLGSVTPEGYDAVIESVVDHARRLQKQGAAVVSLMGTSLSFYRGAAFNAALTVAMREATGLPCTTMSTAVLNGLRALGVRRVALATAYIDDVNERLAAFLAEESLVPTGCRSLGITGVEAMARVDTATLVDLCVRAFEAAPDSDGILLSCGGLLTLDAIPEVERRLGVPVVSSSPAGFWDAVRLAGGGAKARPGYGRLFDES,uniprot_search,Q05115,O=C(O)C(O)(C(=O)O)c1ccco1,8.6,45.0,8.5,4.1.1.76,518.0,0.9344984512435676,0.9344984512435676,O=C(O)C(O)(C(=O)O)c1ccco1__MQQASTPTIGMIVPPAAGLVPADGARLYPDLPFIASGLGLGSVTPEGYDAVIESVVDHARRLQKQGAAVVSLMGTSLSFYRGAAFNAALTVAMREATGLPCTTMSTAVLNGLRALGVRRVALATAYIDDVNERLAAFLAEESLVPTGCRSLGITGVEAMARVDTATLVDLCVRAFEAAPDSDGILLSCGGLLTLDAIPEVERRLGVPVVSSSPAGFWDAVRLAGGGAKARPGYGRLFDES,./data/raw/alphafold//AF-Q05115-F1-model_v4.pdb,3057,289,328,380 +2537,28115,28599,MAVVASAPGKVLMTGGYLILERPNAGIVLSTNARFYAIVKPIYEELKPESWAWAWTDVKLTSPQMSRETMYKMSLKYLTLQCVSSSDSRNPFVEHAIRYVVAAAYAKFDNDRKDSLRKLLLQGLDITILGCNEFYSYRNQIEAQRLPLTPESLALLPPFSSITFNAEESSGQKPEVAKTGLGSSAAMTTAVVAALLHYLGVVDLSSNKEAVNLDVVHMIAQTAHCIAQGKVGSGFDVSSAVYGSQRYVRFSPEVISSAQSAVNGLPLEDVIADVLKAKWDHERTKFSLPPLMTLLLGEPGTGGSSTPSMVGAVKKWQKSDPQNSLETWRKLSDANSALELHFNTLSRLADEDSGVYGTVINNCSMLTYDKWVGGENEMSQAILKALLGARDAMLEIRYHMRKMGEAAGIPIEPESQTQLLDSTMNMEGVLLAGVPGAGGFDAVFAITLGSSSENVIKAWTSSNVLALLIREDPNGVSIEQNDPQATGITSGVSSIKIE,uniprot_search,F6K7K0,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.22,30.0,7.5,2.7.4.2,4058.0,-0.6575773191777937,-0.6575773191777937,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MAVVASAPGKVLMTGGYLILERPNAGIVLSTNARFYAIVKPIYEELKPESWAWAWTDVKLTSPQMSRETMYKMSLKYLTLQCVSSSDSRNPFVEHAIRYVVAAAYAKFDNDRKDSLRKLLLQGLDITILGCNEFYSYRNQIEAQRLPLTPESLALLPPFSSITFNAEESSGQKPEVAKTGLGSSAAMTTAVVAALLHYLGVVDLSSNKEAVNLDVVHMIAQTAHCIAQGKVGSGFDVSSAVYGSQRYVRFSPEVISSAQSAVNGLPLEDVIADVLKAKWDHERTKFSLPPLMTLLLGEPGTGGSSTPSMVGAVKKWQKSDPQNSLETWRKLSDANSALELHFNTLSRLADEDSGVYGTVINNCSMLTYDKWVGGENEMSQAILKALLGARDAMLEIRYHMRKMGEAAGIPIEPESQTQLLDSTMNMEGVLLAGVPGAGGFDAVFAITLGSSSENVIKAWTSSNVLALLIREDPNGVSIEQNDPQATGITSGVSSIKIE,./data/raw/alphafold//AF-F6K7K0-F1-model_v4.pdb,5583,2348,2969,3433 +2538,7441,7572,MTTETIQSNANLAPLPPHVPEHLVFDFDMYNPSNLSAGVQEAWAVLQESNVPDLVWTRCNGGHWIATRGQLIREAYEDYRHFSSECPFIPREAGEAYDFIPTSMDPPEQRQFRALANQVVGMPVVDKLENRIQELACSLIESLRPQGQCNFTEDYAEPFPIRIFMLLAGLPEEDIPHLKYLTDQMTRPDGSMTFAEAKEALYDYLIPIIEQRRQKPGTDAISIVANGQVNGRPITSDEAKRMCGLLLVGGLDTVVNFLSFSMEFLAKSPEHRQELIERPERIPAACEELLRRFSLVADGRILTSDYEFHGVQLKKGDQILLPQMLSGLDERENACPMHVDFSRQKVSHTTFGHGSHLCLGQHLARREIIVTLKEWLTRIPDFSIAPGAQIQHKSGIVSGVQALPLVWDPATTKAV,brenda,P00183,CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2,0.03,25.0,7.2,1.14.15.1,303.0,-1.5228787452803376,-2.2044676964867502,CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2__MTTETIQSNANLAPLPPHVPEHLVFDFDMYNPSNLSAGVQEAWAVLQESNVPDLVWTRCNGGHWIATRGQLIREAYEDYRHFSSECPFIPREAGEAYDFIPTSMDPPEQRQFRALANQVVGMPVVDKLENRIQELACSLIESLRPQGQCNFTEDYAEPFPIRIFMLLAGLPEEDIPHLKYLTDQMTRPDGSMTFAEAKEALYDYLIPIIEQRRQKPGTDAISIVANGQVNGRPITSDEAKRMCGLLLVGGLDTVVNFLSFSMEFLAKSPEHRQELIERPERIPAACEELLRRFSLVADGRILTSDYEFHGVQLKKGDQILLPQMLSGLDERENACPMHVDFSRQKVSHTTFGHGSHLCLGQHLARREIIVTLKEWLTRIPDFSIAPGAQIQHKSGIVSGVQALPLVWDPATTKAV,./data/raw/alphafold//AF-P00183-F1-model_v4.pdb,15,2705,3372,3897 +2539,36705,37345,MTRYEVVFIAIPTLGNLVPQVEFANLLTKHDPRFSATILTVSMPQRPLMNTYVQARASSAANIKLLQLPIVDPPAPEQYQTLVGFLSLHMQNHKHHVKHALLNLMKTTESNSSNSVRLAAIFVDMFSTTLIDVAAELAVPCYLFFASPASCLGFTLDLPRFDLAESKSEFTVPCFKNLLPRSVFPNLVLDAKDGTFWLSYHARRYKETKGIVINTLQELETHALQSLHNDSQLQRVYPIGPILDLVGSAQWDPNPAQYKRIMEWLDQQPLSSVVLLCFGSMGSLEANQVEEIAIGLERAGVRFLWALRESPKAQLEYPRDYENHKDVLPDGFLERTNNIGLVCGWVPQAVVLAHKAVGGFVSHCGWNSILESLWHGVPVATWPLYSEQQMNAFQMVRDLGLAVEISVDYRVGADLVRAEEVENGLRSLMKGGDEIRRKVKEMSDTCRGALLENGSSYSNLVSLIQELTS,sabio,A0A172J2G3,O=c1c(-c2ccc(O)cc2)coc2cc(O)ccc12,0.0327999999999999,30.0,,2.4.1.-,3893.0,-1.4841261562883223,-1.4841261562883223,O=c1c(-c2ccc(O)cc2)coc2cc(O)ccc12__MTRYEVVFIAIPTLGNLVPQVEFANLLTKHDPRFSATILTVSMPQRPLMNTYVQARASSAANIKLLQLPIVDPPAPEQYQTLVGFLSLHMQNHKHHVKHALLNLMKTTESNSSNSVRLAAIFVDMFSTTLIDVAAELAVPCYLFFASPASCLGFTLDLPRFDLAESKSEFTVPCFKNLLPRSVFPNLVLDAKDGTFWLSYHARRYKETKGIVINTLQELETHALQSLHNDSQLQRVYPIGPILDLVGSAQWDPNPAQYKRIMEWLDQQPLSSVVLLCFGSMGSLEANQVEEIAIGLERAGVRFLWALRESPKAQLEYPRDYENHKDVLPDGFLERTNNIGLVCGWVPQAVVLAHKAVGGFVSHCGWNSILESLWHGVPVATWPLYSEQQMNAFQMVRDLGLAVEISVDYRVGADLVRAEEVENGLRSLMKGGDEIRRKVKEMSDTCRGALLENGSSYSNLVSLIQELTS,./data/raw/alphafold//AF-A0A172J2G3-F1-model_v4.pdb,2527,8166,10042,11227 +2540,31467,32024,MKNYFYIPIADDMHCHLRQGDMLDFTVNSIRRGGCNRVLVMPNTHPIISTCSDAQKYLYQLKSRDDDIEYLMTLYLNKNTDENDILSNYYKCNLQGVKIYPSNVTTNSSDGITSLEPYYKVFHALEKLNKSIHIHCEEPNINPLYAEEKYLPHIHDLAIKFPGLNIVLEHISSSESINVIKEFRNVAGSITPHHLYLTIDDVVNMDIYDHAIDNTYIEKYIKNTYHYCKPLPKLLEDKIALQDVIKDDFPRVFLGSDSAPHYKVMKRKPYYKPGIYTQPFLINYVAHILNKFDALDKMENFTSKNASLFLNLAEKKKLAKYYICVEKHPFKLPREYNGVVPFLAGKTLDYDIHYVSKF,uniprot_search,A9CSR1,O=C(O)[C@@H]1CC(O)=NC(O)=N1,0.012,37.0,7.4,3.5.2.3,5833.0,-1.9208187539523751,-1.9208187539523751,O=C(O)[C@@H]1CC(O)=NC(O)=N1__MKNYFYIPIADDMHCHLRQGDMLDFTVNSIRRGGCNRVLVMPNTHPIISTCSDAQKYLYQLKSRDDDIEYLMTLYLNKNTDENDILSNYYKCNLQGVKIYPSNVTTNSSDGITSLEPYYKVFHALEKLNKSIHIHCEEPNINPLYAEEKYLPHIHDLAIKFPGLNIVLEHISSSESINVIKEFRNVAGSITPHHLYLTIDDVVNMDIYDHAIDNTYIEKYIKNTYHYCKPLPKLLEDKIALQDVIKDDFPRVFLGSDSAPHYKVMKRKPYYKPGIYTQPFLINYVAHILNKFDALDKMENFTSKNASLFLNLAEKKKLAKYYICVEKHPFKLPREYNGVVPFLAGKTLDYDIHYVSKF,./data/raw/alphafold//AF-A9CSR1-F1-model_v4.pdb,4225,5130,7037,7044 +2541,24476,24863,MAKFVIRPATAADCSDILRLIKELAKYEYMEEQVILTEKDLLEDGFGEHPFYHCLVAEVPKEHWTPEGHSIVGFAMYYFTYDPWIGKLLYLEDFFVMSDYRGFGIGSEILKNLSQVAMRCRCSSMHFLVAEWNEPSINFYKRRGASDLSSEEGWRLFKIDKEYLLKMATEE,brenda,P21673,NCCNCCN,0.194,30.0,7.2,2.3.1.57,9606.0,-0.712198270069774,-0.712198270069774,NCCNCCN__MAKFVIRPATAADCSDILRLIKELAKYEYMEEQVILTEKDLLEDGFGEHPFYHCLVAEVPKEHWTPEGHSIVGFAMYYFTYDPWIGKLLYLEDFFVMSDYRGFGIGSEILKNLSQVAMRCRCSSMHFLVAEWNEPSINFYKRRGASDLSSEEGWRLFKIDKEYLLKMATEE,./data/raw/alphafold//AF-P21673-F1-model_v4.pdb,3632,1273,7767,1897 +2542,7246,7377,MKTVFILISMLFPVAVMAQKSVKISDDISITQLSDKVYTYVSLAEIEGWGMVPSNGMIVINNHQAALLDTPINDAQTEMLVNWVTDSLHAKVTTFIPNHWHGDCIGGLGYLQRKGVQSYANQMTIDLAKEKGLPVPEHGFTDSLTVSLDGMPLQCYYLGGGHATDNIVVWLPTENILFGGCMLKDNQATSIGNISDADVTAWPKTLDKVKAKFPSARYVVPGHGDYGGTELIEHTKQIVNQYIESTSKP,sabio,P25910,CC1(C)S[C@@H]2[C@H](N=C(O)C(C(=O)O)c3ccccc3)C(=O)N2[C@H]1C(=O)O,0.24,25.0,7.2,3.5.2.6,817.0,-0.619788758288394,-0.7529227029907786,CC1(C)S[C@@H]2[C@H](N=C(O)C(C(=O)O)c3ccccc3)C(=O)N2[C@H]1C(=O)O__MKTVFILISMLFPVAVMAQKSVKISDDISITQLSDKVYTYVSLAEIEGWGMVPSNGMIVINNHQAALLDTPINDAQTEMLVNWVTDSLHAKVTTFIPNHWHGDCIGGLGYLQRKGVQSYANQMTIDLAKEKGLPVPEHGFTDSLTVSLDGMPLQCYYLGGGHATDNIVVWLPTENILFGGCMLKDNQATSIGNISDADVTAWPKTLDKVKAKFPSARYVVPGHGDYGGTELIEHTKQIVNQYIESTSKP,./data/raw/alphafold//AF-P25910-F1-model_v4.pdb,3244,589,684,819 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+2544,33634,34230,MARKFFVGGNWKCNGTAEEVKKIVNTLNEAQVPSQDVVEVVVSPPYVFLPLVKSTLRSDFFVAAQNCWVKKGGAFTGEVSAEMLVNLDIPWVILGHSERRAILNESSEFVGDKVAYALAQGLKVIACVGETLEEREAGSTMDVVAAQTKAIADRVTNWSNVVIAYEPVWAIGTGKVASPAQAQEVHDELRKWLAKNVSADVAATTRIIYGGSVNGGNCKELGGQADVDGFLVGGASLKPEFIDIIKAAEVKKSA,brenda,P48491,O=C[C@H](O)COP(=O)(O)O,1.32,30.0,7.8,5.3.1.1,3702.0,0.1205739312058498,0.1205739312058498,O=C[C@H](O)COP(=O)(O)O__MARKFFVGGNWKCNGTAEEVKKIVNTLNEAQVPSQDVVEVVVSPPYVFLPLVKSTLRSDFFVAAQNCWVKKGGAFTGEVSAEMLVNLDIPWVILGHSERRAILNESSEFVGDKVAYALAQGLKVIACVGETLEEREAGSTMDVVAAQTKAIADRVTNWSNVVIAYEPVWAIGTGKVASPAQAQEVHDELRKWLAKNVSADVAATTRIIYGGSVNGGNCKELGGQADVDGFLVGGASLKPEFIDIIKAAEVKKSA,./data/raw/alphafold//AF-P48491-F1-model_v4.pdb,2085,7001,1713,10096 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+2565,40761,41498,MLSASANMAAALRAAGALLREPLVHGSSRACQPWRCQSGAAVAATTEKVHHAKTTKPQAQPERRKPKTGILMLNMGGPETLGEVQDFLQRLFLDRDLMTLPIQNKLAPFIAKRRTPKIQEQYRRIGGGSPIKMWTSKQGEGMVKLLDELSPATAPHKYYIGFRYVHPLTEEAIEEMERDGLERAIAFTQYPQYSCSTTGSSLNAIYRYYNEVGQKPTMKWSTIDRWPTHPLLIQCFADHILKELNHFPEEKRSEVVILFSAHSLPMSVVNRGDPYPQEVGATVHKVMEKLGYPNPYRLVWQSKVGPVPWLGPQTDEAIKGLCERGRKNILLVPIAFTSDHIETLYELDIEYSQVLAQKCGAENIRRAESLNGNPLFSKALADLVHSHIQSNKLCSTQLSLNCPLCVNPVCRKTKSFFTSQQL,brenda,P22315,[Fe+2],0.0019,30.0,8.1,4.98.1.1,10090.0,-2.721246399047171,-2.721246399047171,[Fe+2]__MLSASANMAAALRAAGALLREPLVHGSSRACQPWRCQSGAAVAATTEKVHHAKTTKPQAQPERRKPKTGILMLNMGGPETLGEVQDFLQRLFLDRDLMTLPIQNKLAPFIAKRRTPKIQEQYRRIGGGSPIKMWTSKQGEGMVKLLDELSPATAPHKYYIGFRYVHPLTEEAIEEMERDGLERAIAFTQYPQYSCSTTGSSLNAIYRYYNEVGQKPTMKWSTIDRWPTHPLLIQCFADHILKELNHFPEEKRSEVVILFSAHSLPMSVVNRGDPYPQEVGATVHKVMEKLGYPNPYRLVWQSKVGPVPWLGPQTDEAIKGLCERGRKNILLVPIAFTSDHIETLYELDIEYSQVLAQKCGAENIRRAESLNGNPLFSKALADLVHSHIQSNKLCSTQLSLNCPLCVNPVCRKTKSFFTSQQL,./data/raw/alphafold//AF-P22315-F1-model_v4.pdb,3251,327,697,841 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+2569,7721,7855,MSAPTDYLFCPLAYGSALSAIGIYLLRQYMQGGQFTTKTNETGRVAIVTGCNQGIGKETVLELARRGATVYMACRDMKKCENARREIIKATNNQNIFARQLDLCSMKSIRNFAAGFKREQNKLHILINNAGIMDCPKMLTEDGFEMQIGVNHMGHFLLTLLLLDVLKSSAPSRVVVLSSIAHRFGRIKRDDLNSEKSYDRKMAYCQSKLANVLFTRELAKRLSGTGVTVNALHPGVVNTELFRNTPFLGSWFGKLLIAPIIWIFIKTARNGAQTTLYAALDPSLEKVSGRYFSDCKQKHVGSAAQYDDDAQFLWAESEKWTGINI,brenda,Q8MZG9,CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=O)C(C)(C)CCC1,0.0004,37.0,7.4,1.1.1.300,9606.0,-3.397940008672037,-3.397940008672037,CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=O)C(C)(C)CCC1__MSAPTDYLFCPLAYGSALSAIGIYLLRQYMQGGQFTTKTNETGRVAIVTGCNQGIGKETVLELARRGATVYMACRDMKKCENARREIIKATNNQNIFARQLDLCSMKSIRNFAAGFKREQNKLHILINNAGIMDCPKMLTEDGFEMQIGVNHMGHFLLTLLLLDVLKSSAPSRVVVLSSIAHRFGRIKRDDLNSEKSYDRKMAYCQSKLANVLFTRELAKRLSGTGVTVNALHPGVVNTELFRNTPFLGSWFGKLLIAPIIWIFIKTARNGAQTTLYAALDPSLEKVSGRYFSDCKQKHVGSAAQYDDDAQFLWAESEKWTGINI,./data/raw/alphafold//AF-Q8MZG9-F1-model_v4.pdb,5233,2726,3406,3938 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+2576,24375,24762,MKRDYVTTETYTKEEMHYLVDLSLKIKEAIKNGYYPQLLKNKSLGMIFQQSSTRTRVSFETAMEQLGGHGEYLAPGQIQLGGHETIEDTSRVLSRLVDILMARVERHHSIVDLANCATIPVINGMSDYNHPTQELGDLCTMVEHLPEGKKLEDCKVVFVGDATQVCFSLGLITTKMGMNFVHFGPEGFQLNEEHQAKLAKNCEVSGGSFLVTDDASSVEGADFLYTDVWYGLYEAELSEEERMKVFYPKYQVNQEMMDRAGANCKFMHCLPATRGEEVTDEVIDGKNSICFDEAENRLTSIRGLLVYLMNDYEAKNPYDLIKQAEAKKELEVFLDTQSI,sabio,Q837U7,NCCCN,2.9,37.0,7.0,2.1.3.6,1351.0,0.4623979978989561,0.4623979978989561,NCCCN__MKRDYVTTETYTKEEMHYLVDLSLKIKEAIKNGYYPQLLKNKSLGMIFQQSSTRTRVSFETAMEQLGGHGEYLAPGQIQLGGHETIEDTSRVLSRLVDILMARVERHHSIVDLANCATIPVINGMSDYNHPTQELGDLCTMVEHLPEGKKLEDCKVVFVGDATQVCFSLGLITTKMGMNFVHFGPEGFQLNEEHQAKLAKNCEVSGGSFLVTDDASSVEGADFLYTDVWYGLYEAELSEEERMKVFYPKYQVNQEMMDRAGANCKFMHCLPATRGEEVTDEVIDGKNSICFDEAENRLTSIRGLLVYLMNDYEAKNPYDLIKQAEAKKELEVFLDTQSI,./data/raw/alphafold//AF-Q837U7-F1-model_v4.pdb,4234,5144,7052,7060 +2577,32183,32754,MASPAAGDVLIVGSGLVGRSWAMLFASGGFRVKLYDIEPRQITGALENIRKEMKSLQQSGSLKGSLSAEEQLSLISSCTNLAEAVEGVVHIQECVPENLDLKRKIFAQLDSIVDDRVVLSSSSSCLLPSKLFTGLAHVKQCIVAHPVNPPYYIPLVELVPHPETSPATVDRTHALMRKIGQSPVRVLKEIDGFVLNRLQYAIISEAWRLVEEGIVSPSDLDLVMSDGLGMRYAFIGPLETMHLNAEGMLSYCDRYSEGMKRVLKSFGSIPEFSGATVEKVNQAMCKKVPADPEHLAARREWRDECLKRLAKLKRQMQPQ,sabio,P14755,O=C([O-])C(=O)C(=O)[C@H](O)[C@@H](O)CO,6.1,25.0,7.0,1.1.1.45,9986.0,0.785329835010767,0.785329835010767,O=C([O-])C(=O)C(=O)[C@H](O)[C@@H](O)CO__MASPAAGDVLIVGSGLVGRSWAMLFASGGFRVKLYDIEPRQITGALENIRKEMKSLQQSGSLKGSLSAEEQLSLISSCTNLAEAVEGVVHIQECVPENLDLKRKIFAQLDSIVDDRVVLSSSSSCLLPSKLFTGLAHVKQCIVAHPVNPPYYIPLVELVPHPETSPATVDRTHALMRKIGQSPVRVLKEIDGFVLNRLQYAIISEAWRLVEEGIVSPSDLDLVMSDGLGMRYAFIGPLETMHLNAEGMLSYCDRYSEGMKRVLKSFGSIPEFSGATVEKVNQAMCKKVPADPEHLAARREWRDECLKRLAKLKRQMQPQ,./data/raw/alphafold//AF-P14755-F1-model_v4.pdb,631,913,1100,1356 +2578,32248,32819,MTYTLAILGCGVMGQALLSAIYNAPKAADETAAAFYPSKIITCNHDEPSAQQVTDLVETFDESPNGIKVESTYGHNVSAVEEASVVLLGTKPFLAEEVLNGVKSVIGGKLLISLAAGWTIDQLSQYTSTVCRVMTNTPAKYGYGCAVVSYSADVSKEQKPLVNELISQVGKYVELPEKNMDAATALVGSGPAFVLLMLESLMESGLKLGIPLQESKECAMKVLEGTVKMVEKSGAHPSVLKHQVCTPGGTTIAGLCVMEEKGVKSGIINGVEEAARVASQLGQKKK,uniprot_search,A0A6L0Z574,O=C([O-])C1CCC=N1,0.08,30.0,6.25,1.5.1.2,4932.0,-1.0969100130080565,-1.0969100130080565,O=C([O-])C1CCC=N1__MTYTLAILGCGVMGQALLSAIYNAPKAADETAAAFYPSKIITCNHDEPSAQQVTDLVETFDESPNGIKVESTYGHNVSAVEEASVVLLGTKPFLAEEVLNGVKSVIGGKLLISLAAGWTIDQLSQYTSTVCRVMTNTPAKYGYGCAVVSYSADVSKEQKPLVNELISQVGKYVELPEKNMDAATALVGSGPAFVLLMLESLMESGLKLGIPLQESKECAMKVLEGTVKMVEKSGAHPSVLKHQVCTPGGTTIAGLCVMEEKGVKSGIINGVEEAARVASQLGQKKK,./data/raw/alphafold//AF-A0A6L0Z574-F1-model_v4.pdb,4104,4944,6813,6794 +2579,16742,16983,MQHKLLINGELVSGEGEKQPVYNPATGDVLLEIAEASAEQVDAAVRAADAAFAEWGQTTPKVRAECLLKLADVIEENGQVFAELESRNCGKPLHSAFNDEIPAIVDVFRFFAGAARCLNGLAAGEYLEGHTSMIRRDPLGVVASIAPWNYPLMMAAWKLAPALAAGNCVVLKPSEITPLTALKLAELAKDIFPAGVINILFGRGKTVGDPLTGHPKVRMVSLTGSIATGEHIISHTASSIKRTHMELGGKAPVIVFDDADIEAVVEGVRTFGYYNAGQDCTAACRIYAQKGIYDTLVEKLGAAVATLKSGAPDDESTELGPLSSLAHLERVGKAVEEAKATGHIKVITGGEKRKGNGYYYAPTLLAGALQDDAIVQKEVFGPVVSVTPFDNEEQVVNWANDSQYGLASSVWTKDVGRAHRVSARLQYGCTWVNTHFMLVSEMPHGGQKLSGYGKDMSLYGLEDYTVVRHVMVKH,sabio,P77674,C[N+](C)(C)CC=O,1.8,22.0,7.7,1.2.1.19,562.0,0.255272505103306,0.6699574611143634,C[N+](C)(C)CC=O__MQHKLLINGELVSGEGEKQPVYNPATGDVLLEIAEASAEQVDAAVRAADAAFAEWGQTTPKVRAECLLKLADVIEENGQVFAELESRNCGKPLHSAFNDEIPAIVDVFRFFAGAARCLNGLAAGEYLEGHTSMIRRDPLGVVASIAPWNYPLMMAAWKLAPALAAGNCVVLKPSEITPLTALKLAELAKDIFPAGVINILFGRGKTVGDPLTGHPKVRMVSLTGSIATGEHIISHTASSIKRTHMELGGKAPVIVFDDADIEAVVEGVRTFGYYNAGQDCTAACRIYAQKGIYDTLVEKLGAAVATLKSGAPDDESTELGPLSSLAHLERVGKAVEEAKATGHIKVITGGEKRKGNGYYYAPTLLAGALQDDAIVQKEVFGPVVSVTPFDNEEQVVNWANDSQYGLASSVWTKDVGRAHRVSARLQYGCTWVNTHFMLVSEMPHGGQKLSGYGKDMSLYGLEDYTVVRHVMVKH,./data/raw/alphafold//AF-P77674-F1-model_v4.pdb,3125,681,803,975 +2580,40352,41085,MELIQDTSRPPLEYVKGVPLIKYFAEALGPLQSFQARPDDLLISTYPKSGTTWVSQILDMIYQGGDLEKCHRAPIFMRVPFLEFKAPGIPSGMETLKDTPAPRLLKTHLPLALLPQTLLDQKVKVVYVARNAKDVAVSYYHFYHMAKVHPEPGTWDSFLEKFMVGEVSYGSWYQHVQEWWELSRTHPVLYLFYEDMKENPKREIQKILEFVGRSLPEETVDFVVQHTSFKEMKKNPMTNYTTVPQEFMDHSISPFMRKGMAGDWKTTFTVAQNERFDADYAEKMAGCSLSFRSEL,brenda,P50225,Oc1ccc2ccc3cccc4ccc1c2c34,2.2e-05,25.0,7.5,2.8.2.1,9606.0,-4.657577319177793,-4.657577319177793,Oc1ccc2ccc3cccc4ccc1c2c34__MELIQDTSRPPLEYVKGVPLIKYFAEALGPLQSFQARPDDLLISTYPKSGTTWVSQILDMIYQGGDLEKCHRAPIFMRVPFLEFKAPGIPSGMETLKDTPAPRLLKTHLPLALLPQTLLDQKVKVVYVARNAKDVAVSYYHFYHMAKVHPEPGTWDSFLEKFMVGEVSYGSWYQHVQEWWELSRTHPVLYLFYEDMKENPKREIQKILEFVGRSLPEETVDFVVQHTSFKEMKKNPMTNYTTVPQEFMDHSISPFMRKGMAGDWKTTFTVAQNERFDADYAEKMAGCSLSFRSEL,./data/raw/alphafold//AF-P50225-F1-model_v4.pdb,4829,3217,3965,4621 +2581,3881,3942,MWKLKIAEGGNDEYLYSTNNYVGRQTWVFDPQPPTPQELAQVQQARLNFYNNRYHVKPSSDLLWRFQFLREKNFKQTIPQAKINEGEDITYEKATTALRRAVHFFSALQASDGHWPAENAGPLFFLPPLVMCLYITGHLDTVFPAPHRLEILRYIYCHQNEDGGWGLHIEGHSTMFCTVLSYICMRLLGEGPNGGQDNACSRARKWIIDHGGATYIPSWGKTWLSILGVYEWSGSNPMPPEFWILPTFLPMHPAKMWCYCRMVYMPMSYLYGKRFVGPITPLILQLRQELHTQPYHHINWTKTRHLCAHEDVYYPHPLIQDLMWDSLYIFTEPLLTRWPFNKIIRKKALEVTMKHIHYEDENSRYITIGCVEKVLCMLACWAEDPNGVPFKKHLARIPDYMWVAEDGMKMQSFGSQQWDTGFAIQALLASNLTEEIGQVLKKGHDFIKKSQVKENPSGDFKSMHRHISKGSWTFSDQDHGWQVSDCTAEGLKCCLLFSMMPPEIVGEKMDAQHLYNAVNILISLQSKNGGLAAWEPAGAQQWLEMLNPTEFFADIVIEHEYVECTASAIHALIMFKKLYPGHRKKEIENFITNAVKYLEDVQTADGGWYGNWGVCFTYGTWFAVGGLAAAGKNYNNCAAMRKAVDFLLRTQKQDGGWGESYLSCPHKKYVPLEDNRSNLVHTSWALMGLISAGQMDRDPTPLHRAAKLLINSQLEDGDFPQQEITGVFMKNCMLHYAAYRNIYPLWALAEYRNRVPLPSTTL,brenda,Q401R6,CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C=C(\C)CC/C=C(\C)CC[C@@H]1OC1(C)C,0.0338,30.0,7.0,5.4.99.39,142860.0,-1.4710832997223453,-1.4710832997223453,CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C=C(\C)CC/C=C(\C)CC[C@@H]1OC1(C)C__MWKLKIAEGGNDEYLYSTNNYVGRQTWVFDPQPPTPQELAQVQQARLNFYNNRYHVKPSSDLLWRFQFLREKNFKQTIPQAKINEGEDITYEKATTALRRAVHFFSALQASDGHWPAENAGPLFFLPPLVMCLYITGHLDTVFPAPHRLEILRYIYCHQNEDGGWGLHIEGHSTMFCTVLSYICMRLLGEGPNGGQDNACSRARKWIIDHGGATYIPSWGKTWLSILGVYEWSGSNPMPPEFWILPTFLPMHPAKMWCYCRMVYMPMSYLYGKRFVGPITPLILQLRQELHTQPYHHINWTKTRHLCAHEDVYYPHPLIQDLMWDSLYIFTEPLLTRWPFNKIIRKKALEVTMKHIHYEDENSRYITIGCVEKVLCMLACWAEDPNGVPFKKHLARIPDYMWVAEDGMKMQSFGSQQWDTGFAIQALLASNLTEEIGQVLKKGHDFIKKSQVKENPSGDFKSMHRHISKGSWTFSDQDHGWQVSDCTAEGLKCCLLFSMMPPEIVGEKMDAQHLYNAVNILISLQSKNGGLAAWEPAGAQQWLEMLNPTEFFADIVIEHEYVECTASAIHALIMFKKLYPGHRKKEIENFITNAVKYLEDVQTADGGWYGNWGVCFTYGTWFAVGGLAAAGKNYNNCAAMRKAVDFLLRTQKQDGGWGESYLSCPHKKYVPLEDNRSNLVHTSWALMGLISAGQMDRDPTPLHRAAKLLINSQLEDGDFPQQEITGVFMKNCMLHYAAYRNIYPLWALAEYRNRVPLPSTTL,./data/raw/alphafold//AF-Q401R6-F1-model_v4.pdb,4947,1701,2558,2546 +2582,11103,11259,MHVNGKVALVTGAAQGIGRAFAEALLLKGAKVALVDWNLEAGVQCKAALDEQFEPQKTLFIQCDVADQQQLRDTFRKVVDHFGRLDILVNNAGVNNEKNWEKTLQINLVSVISGTYLGLDYMSKQNGGEGGIIINMSSLAGLMPVAQQPVYCASKHGIVGFTRSAALAANLMNSGVRLNAICPGFVNTAILESIEKEENMGQYIEYKDHIKDMIKYYGILDPPLIANGLITLIEDDALNGAIMKITTSKGIHFQDYDTTPFQAKTQ,uniprot_search,P15428,CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](CC(=O)CCCCC(=O)O)[C@@H](O)C[C@H]1O,0.063,31.0,8.025,1.1.1.141,9606.0,-1.2006594505464183,-1.2006594505464183,CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](CC(=O)CCCCC(=O)O)[C@@H](O)C[C@H]1O__MHVNGKVALVTGAAQGIGRAFAEALLLKGAKVALVDWNLEAGVQCKAALDEQFEPQKTLFIQCDVADQQQLRDTFRKVVDHFGRLDILVNNAGVNNEKNWEKTLQINLVSVISGTYLGLDYMSKQNGGEGGIIINMSSLAGLMPVAQQPVYCASKHGIVGFTRSAALAANLMNSGVRLNAICPGFVNTAILESIEKEENMGQYIEYKDHIKDMIKYYGILDPPLIANGLITLIEDDALNGAIMKITTSKGIHFQDYDTTPFQAKTQ,./data/raw/alphafold//AF-P15428-F1-model_v4.pdb,5475,3005,3721,4300 +2583,33110,33702,MILKPENEKKLIIDVLKKFGVPEEDAKITADVFVDADLKGFTSHGIGRFPQYITALKLGNINPKPDIKIVKESPATAVIDGDLGLGQVVGKKAMELAIKKAKNVGVGVVATRNANHFGIAGYYSELAMNQDMIGITITNTEPAMAPFGGKEKILGTNPIAIAFKGNKYKFSLDMATASIARGKILEALRKKIKIPEGCAVDKDGKPTTDPAKALEGCILPFGGPKGYGLALAIEMLSAIGGAEVGTKVKGTANPEERCTKGDLFIAINPEFFMGKEEFKRKVDELLDEIKNSEPAEGFEILIPGEIEERNKMKRKDGFEIDKNLYNQLKEICNELGLNIEDYIE,brenda,Q58820,O=CC(=O)O,46.0,70.0,8.0,1.1.1.337,2190.0,1.662757831681574,1.662757831681574,O=CC(=O)O__MILKPENEKKLIIDVLKKFGVPEEDAKITADVFVDADLKGFTSHGIGRFPQYITALKLGNINPKPDIKIVKESPATAVIDGDLGLGQVVGKKAMELAIKKAKNVGVGVVATRNANHFGIAGYYSELAMNQDMIGITITNTEPAMAPFGGKEKILGTNPIAIAFKGNKYKFSLDMATASIARGKILEALRKKIKIPEGCAVDKDGKPTTDPAKALEGCILPFGGPKGYGLALAIEMLSAIGGAEVGTKVKGTANPEERCTKGDLFIAINPEFFMGKEEFKRKVDELLDEIKNSEPAEGFEILIPGEIEERNKMKRKDGFEIDKNLYNQLKEICNELGLNIEDYIE,./data/raw/alphafold//AF-Q58820-F1-model_v4.pdb,1735,2222,4281,7766 +2584,18347,18611,MFKKRGRQTVLIAAVLAFFTASSPLLARTQGEPTQVQQKLAALEKQSGGRLGVALINTADRSQILYRGDERFAMCSTSKTMVAAAVLKQSETQHDILQQKMVIKKADLTNWNPVTEKYVDKEMTLAELSAATLQYSDNTAMNKLLEHLGGTSNVTAFARSIGDTTFRLDRKEPELNTAIPGDERDTTCPLAMAKSLHKLTLGDALAGAQRAQLVEWLKGNTTGGQSIRAGLPEGWVVGDKTGAGDYGTTNDIAVIWPEDRAPLILVTYFTQPQQDAKGRKDILAAAAKIVTEGL,sabio,P22390,Cc1nnc(SCC2=C(C(=O)O)N3C(=O)[C@@H](N=C(O)Cn4cnnn4)[C@H]3SC2)s1,0.02,30.0,7.2,3.5.2.6,545.0,-1.6989700043360187,-1.6338031200885157,Cc1nnc(SCC2=C(C(=O)O)N3C(=O)[C@@H](N=C(O)Cn4cnnn4)[C@H]3SC2)s1__MFKKRGRQTVLIAAVLAFFTASSPLLARTQGEPTQVQQKLAALEKQSGGRLGVALINTADRSQILYRGDERFAMCSTSKTMVAAAVLKQSETQHDILQQKMVIKKADLTNWNPVTEKYVDKEMTLAELSAATLQYSDNTAMNKLLEHLGGTSNVTAFARSIGDTTFRLDRKEPELNTAIPGDERDTTCPLAMAKSLHKLTLGDALAGAQRAQLVEWLKGNTTGGQSIRAGLPEGWVVGDKTGAGDYGTTNDIAVIWPEDRAPLILVTYFTQPQQDAKGRKDILAAAAKIVTEGL,./data/raw/alphafold//AF-P22390-F1-model_v4.pdb,3555,343,1848,1692 +2585,33885,34484,MEYTSIADTGIEASRIGLGTWAIGGTMWGGTDEKTSIETIRAALDQGITLIDTAPAYGFGQSEEIVGKAIKEYGKRDQVILATKTALDWKNNQLFRHANRARIVEEVENSLKRLQTDYIDLYQVHWPDPLVPIEETAEVMKELYDAGKIRAIGVSNFSIEQMDTFRAVAPLHTIQPPYNLFEREMEESVLPYAKDNKITTLLYGSLCRGLLTGKMTEEYTFEGDDLRNHDPKFQKPRFKEYLSAVNQLDKLAKTRYGKSVIHLAVRWILDQPGADIALWGARKPGQLEALSEITGWTLNSEDQKDINTILENTISDPVGPEFMAPPTREEI,sabio,P80874,O=Cc1ccc([N+](=O)[O-])cc1,0.67,25.0,7.0,1.1.1.-,1423.0,-0.1739251972991735,-0.1739251972991735,O=Cc1ccc([N+](=O)[O-])cc1__MEYTSIADTGIEASRIGLGTWAIGGTMWGGTDEKTSIETIRAALDQGITLIDTAPAYGFGQSEEIVGKAIKEYGKRDQVILATKTALDWKNNQLFRHANRARIVEEVENSLKRLQTDYIDLYQVHWPDPLVPIEETAEVMKELYDAGKIRAIGVSNFSIEQMDTFRAVAPLHTIQPPYNLFEREMEESVLPYAKDNKITTLLYGSLCRGLLTGKMTEEYTFEGDDLRNHDPKFQKPRFKEYLSAVNQLDKLAKTRYGKSVIHLAVRWILDQPGADIALWGARKPGQLEALSEITGWTLNSEDQKDINTILENTISDPVGPEFMAPPTREEI,./data/raw/alphafold//AF-P80874-F1-model_v4.pdb,3427,898,1083,1334 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+2626,19504,19789,MTRTPVNVTVTGAAGQIGYALLFRIASGQLLGADVPVKLRLLEITPALKAAEGTAMELDDCAFPLLQGIEITDDPNVAFDGANVALLVGARPRTKGMERGDLLEANGGIFKPQGKAINDHAADDIKVLVVGNPANTNALIAQAAAPDVPAERFTAMTRLDHNRALTQLAKKTGSTVADIKRLTIWGNHSATQYPDIFHATVAGKNAAETVNDEKWLADEFIPTVAKRGAAIIEARGASSAASAANAAIDHVYTWVNGTAEGDWTSMGIPSDGSYGVPEGIISSFPVTTKDGSYEIVQGLDINEFSRARIDASVKELSEEREAVRGLGLI,brenda,Q9K3J3,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.83,30.0,8.5,1.1.1.37,1902.0,-0.0809219076239261,-0.0809219076239261,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MTRTPVNVTVTGAAGQIGYALLFRIASGQLLGADVPVKLRLLEITPALKAAEGTAMELDDCAFPLLQGIEITDDPNVAFDGANVALLVGARPRTKGMERGDLLEANGGIFKPQGKAINDHAADDIKVLVVGNPANTNALIAQAAAPDVPAERFTAMTRLDHNRALTQLAKKTGSTVADIKRLTIWGNHSATQYPDIFHATVAGKNAAETVNDEKWLADEFIPTVAKRGAAIIEARGASSAASAANAAIDHVYTWVNGTAEGDWTSMGIPSDGSYGVPEGIISSFPVTTKDGSYEIVQGLDINEFSRARIDASVKELSEEREAVRGLGLI,./data/raw/alphafold//AF-Q9K3J3-F1-model_v4.pdb,4082,4852,6807,6788 +2627,18465,18729,MGKKVAIIGAGVSGLASIRSCLEEGLEPTCFEKSNDIGGLWKFSDHAEEGRASIYKSVFSNSSKEMMCFPDFPFPDDFPNFMHNSKIQEYIIAFAKEKNLLKYIQFKTFVSSVNKHPDFATTGQWDVTTERDGKKESAVFDAVMVCSGHHVYPNLPKESFPGLNHFKGKCFHSRDYKEPGVFNGKRVLVVGLGNSGCDIATELSRTAEQVMISSRSGSWVMSRVWDNGYPWDMLLVTRFGTFLKNNLPTAISDWLYVKQMNARFKHENYGLMPLNGVLRKEPVFNDELPASILCGIVSVKPNVKEFTETSAIFEDGTIFEGIDCVIFATGYSFAYPFLDESIIKSRNNEIILFKGVFPPLLEKSTIAVIGFVQSLGAAIPTVDLQSRWAAQVIKGTCTLPSMEDMMNDINEKMEKKRKWFGKSETIQTDYIVYMDELSSFIGAKPNIPWLFLTDPKLAMEVYFGPCSPYQFRLVGPGQWPGARNAILTQWDRSLKPMQTRVVGRLQKPCFFFHWLKLFAIPILLIAVFLVLT,sabio,P31513,Cn1ccnc1S,0.0718,,8.5,1.14.13.8,9606.0,-1.1438755557576996,-1.1438755557576996,Cn1ccnc1S__MGKKVAIIGAGVSGLASIRSCLEEGLEPTCFEKSNDIGGLWKFSDHAEEGRASIYKSVFSNSSKEMMCFPDFPFPDDFPNFMHNSKIQEYIIAFAKEKNLLKYIQFKTFVSSVNKHPDFATTGQWDVTTERDGKKESAVFDAVMVCSGHHVYPNLPKESFPGLNHFKGKCFHSRDYKEPGVFNGKRVLVVGLGNSGCDIATELSRTAEQVMISSRSGSWVMSRVWDNGYPWDMLLVTRFGTFLKNNLPTAISDWLYVKQMNARFKHENYGLMPLNGVLRKEPVFNDELPASILCGIVSVKPNVKEFTETSAIFEDGTIFEGIDCVIFATGYSFAYPFLDESIIKSRNNEIILFKGVFPPLLEKSTIAVIGFVQSLGAAIPTVDLQSRWAAQVIKGTCTLPSMEDMMNDINEKMEKKRKWFGKSETIQTDYIVYMDELSSFIGAKPNIPWLFLTDPKLAMEVYFGPCSPYQFRLVGPGQWPGARNAILTQWDRSLKPMQTRVVGRLQKPCFFFHWLKLFAIPILLIAVFLVLT,./data/raw/alphafold//AF-P31513-F1-model_v4.pdb,3898,4634,6430,3952 +2628,4447,4516,MAAALVLRTWSRAAGQLICVRYFQTCGNVHVLKPKYVCFFGYPPFKYSHPYQWLKTTAALQGQIVQFKLSDIGEGIREVTVKEWYVKEGDTVSQFDSICEVQSDKASVTITSRYDGVIKKLYYNLDDTAYVGKPLVDIETEALKDSEEDVVETPAVSHDEHTHQEIKGQKTLATPAVRRLAMENNIKLSEVIGSGKDGRILKEDILNYLEKQTGAILPPSPKAEIMPPPPKPKDRTIPIPISKPPVFIGKDRTEPVKGFHKAMVKTMSAALKIPHFGYCDEVDLTELVKLREELKPIAFARGIKLSFMPFFLKAASLGLLQFPILNASVDENCQNITYKASHNIGIAMDTEQGLIVPNVKNVQIRSIFEIATELNRLQKLGSAGQLSTNDLIGGTFTLSNIGSIGGTYAKPVILPPEVAIGALGTIKALPRFNEKGEVCKAQIMNVSWSADHRIIDGATVSRFSNLWKSYLENPAFMLLDLK,sabio,P11181,CC(C)C(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O,0.1,37.0,7.4,2.3.1.168,9913.0,-1.0,-1.0,CC(C)C(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O__MAAALVLRTWSRAAGQLICVRYFQTCGNVHVLKPKYVCFFGYPPFKYSHPYQWLKTTAALQGQIVQFKLSDIGEGIREVTVKEWYVKEGDTVSQFDSICEVQSDKASVTITSRYDGVIKKLYYNLDDTAYVGKPLVDIETEALKDSEEDVVETPAVSHDEHTHQEIKGQKTLATPAVRRLAMENNIKLSEVIGSGKDGRILKEDILNYLEKQTGAILPPSPKAEIMPPPPKPKDRTIPIPISKPPVFIGKDRTEPVKGFHKAMVKTMSAALKIPHFGYCDEVDLTELVKLREELKPIAFARGIKLSFMPFFLKAASLGLLQFPILNASVDENCQNITYKASHNIGIAMDTEQGLIVPNVKNVQIRSIFEIATELNRLQKLGSAGQLSTNDLIGGTFTLSNIGSIGGTYAKPVILPPEVAIGALGTIKALPRFNEKGEVCKAQIMNVSWSADHRIIDGATVSRFSNLWKSYLENPAFMLLDLK,./data/raw/alphafold//AF-P11181-F1-model_v4.pdb,3625,1262,1996,1886 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+2738,27363,27837,MLLCLSPAWLMKVPAPGQPGEAALLVSKAVSFHPGGLTFLDDFVPPRRATYFLAGLGLGPGRGREAAELARDLTCPTGASAELARLLEDRLLTRQLLAQQGGVAVPATLAFTYKPPGLLRGGDASLGLRLVELSGKEGQETLVKEEVEAFLRSEALGDILQVAVKLSGWRWRGRQAWRLHPRAELGAVVDTVLALLEKLEEEESVLVEAVYPPAQLPCSDGPSPGPGLAVRICAVVCRTQGDRPLLSKVVCGVGRGDRPLRHHNSLPRTLEVALAQCGLGEEAQVAAVRQRVKAAAEAALAAVLALEAGLSAEQRGGRRAHTDFLGVDFALTAAGGVLTPVALELNGGLCLEACGALEGLWAAPRLGPAADEAVAAPLVETMLRRSARCLMEGKQLLVVGAGGVSKKFVWEAARDYGLQLHLVESDPNHFASQLVQTFIHFDMTEHRRDEENARLLAELVRARGLKLDGCFSYWDDCLVLTALLCQELGLPCSSPAAMRLAKQKSLTQLHLLHHHGPPWPAPSLHAVPCCPLESEADVERAVHQVPLPGVMKLEFGAGAVGVRLVEDAPQCHEHFSRITRDLQGEADHPGIGLGWGNAMLLMEFVEGTEHDVDLVLFGGRLLAAFVSDNGPTRLPGFTETAACMPTGLAPEQEAQMVQAAFRCCLGCGLLDGVFNVELKLTGAGPRLIEINPRMGGFYLRDWILELYGVDLLLAAVMVACGLRPALPTRPRARGHLVGVMCLVSQHLQALSSTASRETLQALHDRGLLRLNLLEEALVPGEYEEPYCSVACAGPSPTEARLRLLGLCQGLGIDGPSYPVAHFLSHFK,sabio,A5YM72,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,0.42,37.0,,6.3.2.11,9606.0,-0.3767507096020995,-0.3767507096020995,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MLLCLSPAWLMKVPAPGQPGEAALLVSKAVSFHPGGLTFLDDFVPPRRATYFLAGLGLGPGRGREAAELARDLTCPTGASAELARLLEDRLLTRQLLAQQGGVAVPATLAFTYKPPGLLRGGDASLGLRLVELSGKEGQETLVKEEVEAFLRSEALGDILQVAVKLSGWRWRGRQAWRLHPRAELGAVVDTVLALLEKLEEEESVLVEAVYPPAQLPCSDGPSPGPGLAVRICAVVCRTQGDRPLLSKVVCGVGRGDRPLRHHNSLPRTLEVALAQCGLGEEAQVAAVRQRVKAAAEAALAAVLALEAGLSAEQRGGRRAHTDFLGVDFALTAAGGVLTPVALELNGGLCLEACGALEGLWAAPRLGPAADEAVAAPLVETMLRRSARCLMEGKQLLVVGAGGVSKKFVWEAARDYGLQLHLVESDPNHFASQLVQTFIHFDMTEHRRDEENARLLAELVRARGLKLDGCFSYWDDCLVLTALLCQELGLPCSSPAAMRLAKQKSLTQLHLLHHHGPPWPAPSLHAVPCCPLESEADVERAVHQVPLPGVMKLEFGAGAVGVRLVEDAPQCHEHFSRITRDLQGEADHPGIGLGWGNAMLLMEFVEGTEHDVDLVLFGGRLLAAFVSDNGPTRLPGFTETAACMPTGLAPEQEAQMVQAAFRCCLGCGLLDGVFNVELKLTGAGPRLIEINPRMGGFYLRDWILELYGVDLLLAAVMVACGLRPALPTRPRARGHLVGVMCLVSQHLQALSSTASRETLQALHDRGLLRLNLLEEALVPGEYEEPYCSVACAGPSPTEARLRLLGLCQGLGIDGPSYPVAHFLSHFK,./data/raw/alphafold//AF-A5YM72-F1-model_v4.pdb,3900,4637,6433,6342 +2739,11356,11517,MQVLACVLGIVCLYLRTAPASPSGAGSLFLVASGAQTEPAVDDSAVQQGSTAETSVAPTHLRGSDGALRTQTPQARPLAEMSAQQTEATAGAAAKDPSMPGHHGDPHLNDDVAKVQSFIGCCVKGWENLPESSLRVTVLSGGLSNRLFAVDALPPPEARTGSNPMGHALEAPERSSSGKRHTHCPCGNSRQEPPETAASNSPSVTRDETQPPQRVLVRLYGHGQEHTFFDAAEERRVFKLLGDMGLAPKCLAEFPGGRVETWIVGQALKRTELQNEAVQRQVVDLLADFHQTILPPSGSNYSADPAWCRWVQQLPQAFSGHRTSEDCNSEQEDPFVRPRCDFAFCRLDAWAEDAKKGSASRLQVGTQIPPLHASISRGVSTDAAEANGVVTPEVTGPSSLLSPAEKRHLDRVGLLQYYTEEAKKLEEVLLARVKYELDPERVREVYGSPEAWRLLSGASIVFSHNDVQENNVMQHDDGVLQMIDFEYSGRNFRSYDMGNLFREMTIDYADVQMYPFFSVHLTDYPSLPVRRRFITHYLNRLLTVYGSTSGVLAVIPRGTISKAMVDNFEVMVEFSGLISDLLWAFWSLAQMPDAEPSDEFSHMQYVLSRLTLYELKKSELIRRGLFPARK,uniprot_search,B8Y892,CCN(C)C,0.94,37.0,8.5,2.7.1.32,5811.0,-0.0268721464003013,-0.0268721464003013,CCN(C)C__MQVLACVLGIVCLYLRTAPASPSGAGSLFLVASGAQTEPAVDDSAVQQGSTAETSVAPTHLRGSDGALRTQTPQARPLAEMSAQQTEATAGAAAKDPSMPGHHGDPHLNDDVAKVQSFIGCCVKGWENLPESSLRVTVLSGGLSNRLFAVDALPPPEARTGSNPMGHALEAPERSSSGKRHTHCPCGNSRQEPPETAASNSPSVTRDETQPPQRVLVRLYGHGQEHTFFDAAEERRVFKLLGDMGLAPKCLAEFPGGRVETWIVGQALKRTELQNEAVQRQVVDLLADFHQTILPPSGSNYSADPAWCRWVQQLPQAFSGHRTSEDCNSEQEDPFVRPRCDFAFCRLDAWAEDAKKGSASRLQVGTQIPPLHASISRGVSTDAAEANGVVTPEVTGPSSLLSPAEKRHLDRVGLLQYYTEEAKKLEEVLLARVKYELDPERVREVYGSPEAWRLLSGASIVFSHNDVQENNVMQHDDGVLQMIDFEYSGRNFRSYDMGNLFREMTIDYADVQMYPFFSVHLTDYPSLPVRRRFITHYLNRLLTVYGSTSGVLAVIPRGTISKAMVDNFEVMVEFSGLISDLLWAFWSLAQMPDAEPSDEFSHMQYVLSRLTLYELKKSELIRRGLFPARK,./data/raw/alphafold//AF-B8Y892-F1-model_v4.pdb,5323,3227,3976,4632 +2740,32765,33349,MPRTLANAPIMILNGPNLNLLGQRQPEIYGSDTLADVEALCVKAAATHGGTVDFRQSNHEGELVDWIHEARMDHCGIVINPGAYSHTSVAILDALNTCDGLPVIEVHISNIHKREAFRHHSYVSLRADGVIAGCGVQGYVFGVERVAALAGEGTARA,brenda,A0A124C1Y7,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O,0.1415,,,4.2.1.10,42234.0,-0.849243560139691,-0.849243560139691,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O__MPRTLANAPIMILNGPNLNLLGQRQPEIYGSDTLADVEALCVKAAATHGGTVDFRQSNHEGELVDWIHEARMDHCGIVINPGAYSHTSVAILDALNTCDGLPVIEVHISNIHKREAFRHHSYVSLRADGVIAGCGVQGYVFGVERVAALAGEGTARA,./data/raw/alphafold//AF-A0A124C1Y7-F1-model_v4.pdb,2032,7569,6249,9930 +2741,27633,28112,MSSSSSVPDYLRDEKLTQETRDLISSLPSEKGWLVSQIYQFQGRWHTEALLQGILTCQKHFKAKDSDIILVTNPKSGTTWLKSLVFALINRHKFPVSSGDHPLLVTNPHLLVPFMEGVYYESPDFDFSLLPFPRLMNTHISHLSLPESVKSSSCQIVYCCRNPKDMFVSLWHFGKKLAPQETADYPLEKAVEAFCQGKFIAGPFWDHVLEYWYASLENPNKVLFVTYEELKKQTEVEVKRIAEFIGCGFTAEEEVSEIVKLCSFESLSRLEVNRQGKLPNGIETNAFFRKGEIGGWRDTLSESLADAIDRTTEEKFGGSGLKFSC,sabio,O82410,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O,0.001,25.0,7.5,2.8.2.-,3708.0,-3.0,-3.0,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O__MSSSSSVPDYLRDEKLTQETRDLISSLPSEKGWLVSQIYQFQGRWHTEALLQGILTCQKHFKAKDSDIILVTNPKSGTTWLKSLVFALINRHKFPVSSGDHPLLVTNPHLLVPFMEGVYYESPDFDFSLLPFPRLMNTHISHLSLPESVKSSSCQIVYCCRNPKDMFVSLWHFGKKLAPQETADYPLEKAVEAFCQGKFIAGPFWDHVLEYWYASLENPNKVLFVTYEELKKQTEVEVKRIAEFIGCGFTAEEEVSEIVKLCSFESLSRLEVNRQGKLPNGIETNAFFRKGEIGGWRDTLSESLADAIDRTTEEKFGGSGLKFSC,./data/raw/alphafold//AF-O82410-F1-model_v4.pdb,3743,1430,2208,3135 +2742,7493,7624,MAFLKKYLLTILMVFLAYYYYSANEKFRPEMLQGKKVIVTGASKGIGREIAYHLAKMGAHVVVTARSKEALQKVVARCLELGAASAHYIAGSMEDMTFAEEFVAEAGNLMGGLDMLILNHVLYNRLTFFHGEIDNVRKSMEVNFHSFVVLSVAAMPMLMQSQGSIAVVSSVAGKITYPLIAPYSASKFALDGFFSTLRSEFLVNKVNVSITLCILGLIDTETAIKATSGIYLGPASPKEECALEIIKGTALRQDEMYYVGSRWVPYLLGNPGRKIMEFLSAAEYNWDNVLSNEKLYGRWA,sabio,Q6QLL4,CC12CCC(=O)C=C1CCC1C2C(O)CC2(C)C1CCC2(O)C(=O)CO,0.0031,37.0,9.2,1.1.1.146,10141.0,-2.508638306165728,-2.508638306165728,CC12CCC(=O)C=C1CCC1C2C(O)CC2(C)C1CCC2(O)C(=O)CO__MAFLKKYLLTILMVFLAYYYYSANEKFRPEMLQGKKVIVTGASKGIGREIAYHLAKMGAHVVVTARSKEALQKVVARCLELGAASAHYIAGSMEDMTFAEEFVAEAGNLMGGLDMLILNHVLYNRLTFFHGEIDNVRKSMEVNFHSFVVLSVAAMPMLMQSQGSIAVVSSVAGKITYPLIAPYSASKFALDGFFSTLRSEFLVNKVNVSITLCILGLIDTETAIKATSGIYLGPASPKEECALEIIKGTALRQDEMYYVGSRWVPYLLGNPGRKIMEFLSAAEYNWDNVLSNEKLYGRWA,./data/raw/alphafold//AF-Q6QLL4-F1-model_v4.pdb,5105,1962,2222,2144 +2743,33270,33863,MSQFFFNQRTHLVSDVIDGAIIASPWNNLARLESDPAIRIVVRRDLNKNNVAVISGGGSGHEPAHVGFIGKGMLTAAVCGDVFASPSVDAVLTAIQAVTGEAGCLLIVKNYTGDRLNFGLAAEKARRLGYNVEMLIVGDDISLPDNKHPRGIAGTILVHKIAGYFAERGYNLATVLREAQYAASNTFSLGVALSSCHLPQETDAAPRHHPGHAELGMGIHGEPGASVIDTQNSAQVVNLMVDKLLAALPETGRLAVMINNLGGVSVAEMAIITRELASSPLHSRIDWLIGPASLVTALDMKGFSLTAIVLEESIEKALLTEVETSNWPTPVPPREITCVVSSHASARVEFQPSANALVAGIVELVTATLSDLETHLNALDAKVGDGDTGSTFAAAAREIASLLHRQQLPLNNLATLFALIGERLTVVMGGSSGVLMSIFFTAAGQKLEQGANVVEALNTGLAQMKFYGGADEGDRTMIDALQPALTSLLAQPKNLQAAFDAAQAGAERTCLSSKANAGRASYLSSESLLGNMDPGAQRLAMVFKALAESELG,sabio,P45510,O=CC(O)CO,0.13,30.0,7.5,2.7.1.29,546.0,-0.8860566476931633,-0.8826033993680736,O=CC(O)CO__MSQFFFNQRTHLVSDVIDGAIIASPWNNLARLESDPAIRIVVRRDLNKNNVAVISGGGSGHEPAHVGFIGKGMLTAAVCGDVFASPSVDAVLTAIQAVTGEAGCLLIVKNYTGDRLNFGLAAEKARRLGYNVEMLIVGDDISLPDNKHPRGIAGTILVHKIAGYFAERGYNLATVLREAQYAASNTFSLGVALSSCHLPQETDAAPRHHPGHAELGMGIHGEPGASVIDTQNSAQVVNLMVDKLLAALPETGRLAVMINNLGGVSVAEMAIITRELASSPLHSRIDWLIGPASLVTALDMKGFSLTAIVLEESIEKALLTEVETSNWPTPVPPREITCVVSSHASARVEFQPSANALVAGIVELVTATLSDLETHLNALDAKVGDGDTGSTFAAAAREIASLLHRQQLPLNNLATLFALIGERLTVVMGGSSGVLMSIFFTAAGQKLEQGANVVEALNTGLAQMKFYGGADEGDRTMIDALQPALTSLLAQPKNLQAAFDAAQAGAERTCLSSKANAGRASYLSSESLLGNMDPGAQRLAMVFKALAESELG,./data/raw/alphafold//AF-P45510-F1-model_v4.pdb,1575,6897,8744,8018 +2744,13746,13943,MGSEALVHVLLVSFPGQGHVNPLLRLGKRLASKGLLVTFTTPESIGKAMRKASNIGEELSPVGDGFIRFEFFEDGWDEDETRRQDLDQYLPQLEKVGKVLIPEMIRRNAEQGRPISCLINNPFIPWVSDVADSLGLPSAMLWVQSCACFTSYYYYYHGLVPFPSETAMEIDVQLPCMPLLKHDEVPSFLYPTTPYPFLRRAIMGQYKNLDKPFCILMDTFQELEHEIIEYMSKISPIKTVGPLFKNPKAPNATVKGDFMKADDCVGWLDSKPASSIVYVSFGSVVYLKQDQWDEIAYGLLNSGVNFLWVMKPPHKDSGYEVLKMPEGFLEKAGDRGKVVQWSPQEQVLAHPSVACFVTHCGWNSTMEALTSGMPVVAFPQWGDQVTDAKYLVDVFKVGVRMCRGEAENKLITRDVVEQCLREATSGPKAEEMKQNAMKWSAAAEAAVAEGGSSDRNIQAFVDEVKRRSLEVLAVSGKSTANGVAELGEPKVNGELKVVS,brenda,A0A2Z5VC92,COc1cc(C(=O)O)ccc1O,0.103,30.0,6.0,2.4.1.136,34316.0,-0.9871627752948278,-0.9871627752948278,COc1cc(C(=O)O)ccc1O__MGSEALVHVLLVSFPGQGHVNPLLRLGKRLASKGLLVTFTTPESIGKAMRKASNIGEELSPVGDGFIRFEFFEDGWDEDETRRQDLDQYLPQLEKVGKVLIPEMIRRNAEQGRPISCLINNPFIPWVSDVADSLGLPSAMLWVQSCACFTSYYYYYHGLVPFPSETAMEIDVQLPCMPLLKHDEVPSFLYPTTPYPFLRRAIMGQYKNLDKPFCILMDTFQELEHEIIEYMSKISPIKTVGPLFKNPKAPNATVKGDFMKADDCVGWLDSKPASSIVYVSFGSVVYLKQDQWDEIAYGLLNSGVNFLWVMKPPHKDSGYEVLKMPEGFLEKAGDRGKVVQWSPQEQVLAHPSVACFVTHCGWNSTMEALTSGMPVVAFPQWGDQVTDAKYLVDVFKVGVRMCRGEAENKLITRDVVEQCLREATSGPKAEEMKQNAMKWSAAAEAAVAEGGSSDRNIQAFVDEVKRRSLEVLAVSGKSTANGVAELGEPKVNGELKVVS,./data/raw/alphafold//AF-A0A2Z5VC92-F1-model_v4.pdb,356,3517,4833,5121 +2745,36709,37350,MHAMTFKAILLLGLLALVSTSASIAFAKEVRATITEVPPFNRNSFPSDFIFGTAASSYQYEGEGRVPSIWDNFTHQYPEKIADGSNGDVAVDQFHHYKEDVAIMKYMNLDAYRLSISWPRILPTGRASGGINSTGVDYYNRLINELLANDITPFVTIFHWDLPQALEDEYGGFLNHTIVNDFRDYADLCFNLFGDRVKHWITVNEPSIFTMNGYAYGIFAPGRCSPSYNPTCTGGDAGTEPDLVAHNLILSHAATVQVYKKKYQEHQNGIIGISLQIIWAVPLSNSTSDQKAAQRYLDFTGGWFLDPLTAGQYPESMQYLVGDRLPKFTTDEAKLVKGSFDFVGINYYTSSYLTSSDASTCCPPSYLTDSQVTFSSQRNGVFIGPVTPSGWMCIYPKGLRDLLLYIKEKYNNPLVYITENGMDELDDPSQSLEESLIDTYRIDSYYRHLFYVRSAIGSGANVKGFFAWSLLDNFEWNEGFTSRFGLNFVNYTTLTRYHKLSATWFKYFLARDQEIAKLDISAPKARWSSSTMIKEEKRKPKWAIQAF,sabio,A3RF67,O=c1c(-c2ccc(O)cc2)coc2cc(OC3OC(CO)C(O)C(O)C3O)ccc12,0.11,30.0,5.0,3.2.1.161,298683.0,-0.958607314841775,-0.958607314841775,O=c1c(-c2ccc(O)cc2)coc2cc(OC3OC(CO)C(O)C(O)C3O)ccc12__MHAMTFKAILLLGLLALVSTSASIAFAKEVRATITEVPPFNRNSFPSDFIFGTAASSYQYEGEGRVPSIWDNFTHQYPEKIADGSNGDVAVDQFHHYKEDVAIMKYMNLDAYRLSISWPRILPTGRASGGINSTGVDYYNRLINELLANDITPFVTIFHWDLPQALEDEYGGFLNHTIVNDFRDYADLCFNLFGDRVKHWITVNEPSIFTMNGYAYGIFAPGRCSPSYNPTCTGGDAGTEPDLVAHNLILSHAATVQVYKKKYQEHQNGIIGISLQIIWAVPLSNSTSDQKAAQRYLDFTGGWFLDPLTAGQYPESMQYLVGDRLPKFTTDEAKLVKGSFDFVGINYYTSSYLTSSDASTCCPPSYLTDSQVTFSSQRNGVFIGPVTPSGWMCIYPKGLRDLLLYIKEKYNNPLVYITENGMDELDDPSQSLEESLIDTYRIDSYYRHLFYVRSAIGSGANVKGFFAWSLLDNFEWNEGFTSRFGLNFVNYTTLTRYHKLSATWFKYFLARDQEIAKLDISAPKARWSSSTMIKEEKRKPKWAIQAF,./data/raw/alphafold//AF-A3RF67-F1-model_v4.pdb,2627,255,4862,5159 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+2765,1641,1678,MTTVSTNDFDQQHLWHPYASLPPTYPNIVIDRAEGIYIVTEDGTRLIDGMSSWWASVHGYNHPKLNAAMIEQLGKMAHVMFGGLTHQPAIDLGKKLLSIVPAGLDAIFYADSGSIAVEVALKMALQYQIAAKRPSKCQFASTHSGYYGDTWHAMSVCDPINGMHSLYGKQLPMQHFVAAPPMGFERDLTQSEREALTEFFVKNSDKLAGFIIEPIIQGAGGMRFYSPQYLQLLRKLCDEYDVLLIADEIATGFGRSGKLFACEHAAISPDIMTIGKALTGGYMTFAATLSTREIADTISQSDYPALMHGPTFMGNPLACAVACASIDLIVSYDIEARTENMQAIMNEQLAPAVSLEGVKEVRCLGAVAVIELNEAVDMPIFQTLLINNGIWVRPFGKLVYIMPPYVITDDELTTLCQALLKVVSSYLTRKD,brenda,Q1QDV8,CC(=O)C(C)=O,0.22,35.0,8.0,2.6.1.62,330922.0,-0.6575773191777937,-0.6575773191777937,CC(=O)C(C)=O__MTTVSTNDFDQQHLWHPYASLPPTYPNIVIDRAEGIYIVTEDGTRLIDGMSSWWASVHGYNHPKLNAAMIEQLGKMAHVMFGGLTHQPAIDLGKKLLSIVPAGLDAIFYADSGSIAVEVALKMALQYQIAAKRPSKCQFASTHSGYYGDTWHAMSVCDPINGMHSLYGKQLPMQHFVAAPPMGFERDLTQSEREALTEFFVKNSDKLAGFIIEPIIQGAGGMRFYSPQYLQLLRKLCDEYDVLLIADEIATGFGRSGKLFACEHAAISPDIMTIGKALTGGYMTFAATLSTREIADTISQSDYPALMHGPTFMGNPLACAVACASIDLIVSYDIEARTENMQAIMNEQLAPAVSLEGVKEVRCLGAVAVIELNEAVDMPIFQTLLINNGIWVRPFGKLVYIMPPYVITDDELTTLCQALLKVVSSYLTRKD,./data/raw/alphafold//AF-Q1QDV8-F1-model_v4.pdb,5555,855,1027,1261 +2766,11088,11244,MNSKQQTVRLSDGHFIPVLGFGTYAPREVPKSKALEATKIAIDAGFRHIDSAAVYQNEKEVGLAIRSKIADGTVKREDIFYTSKVWCTFNHPERVQVCLEQSLKQLQLEYVDLYLIHFPMALKPEEDLKAKDENEKLLFDVVDICDTWKAMEKCKDAGLAKSIGVSNFNRRQLEKILNKPGLKHRPVCNQVECHPYLNQRKLLDFCKSKDIVLVAYSALGSHRETRCVDKSLPVLLADPVLCAIAKKYNWTPALIALRYQLERGVVVLAKSFTEKRIKENMQVFEFQLTSEDMKVLDGLNKNIRYMSGSRFQGHPDFPFLDEY,sabio,Q3MHS3,CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)[C@@H](O)C[C@@H]1O,0.161,25.0,7.4,1.1.1.62,10116.0,-0.7931741239681502,-0.7931741239681502,CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)[C@@H](O)C[C@@H]1O__MNSKQQTVRLSDGHFIPVLGFGTYAPREVPKSKALEATKIAIDAGFRHIDSAAVYQNEKEVGLAIRSKIADGTVKREDIFYTSKVWCTFNHPERVQVCLEQSLKQLQLEYVDLYLIHFPMALKPEEDLKAKDENEKLLFDVVDICDTWKAMEKCKDAGLAKSIGVSNFNRRQLEKILNKPGLKHRPVCNQVECHPYLNQRKLLDFCKSKDIVLVAYSALGSHRETRCVDKSLPVLLADPVLCAIAKKYNWTPALIALRYQLERGVVVLAKSFTEKRIKENMQVFEFQLTSEDMKVLDGLNKNIRYMSGSRFQGHPDFPFLDEY,./data/raw/alphafold//AF-Q3MHS3-F1-model_v4.pdb,2022,202,1021,1255 +2767,31138,31694,MAGRARSGLLLLLLGLLALQSSCLAFRSPLSVFKRFKETTRSFSNECLGTIGPVTPLDASDFALDIRMPGVTPKESDTYFCMSMRLPVDEEAFVIDFKPRASMDTVHHMLLFGCNMPSSTGSYWFCDEGTCTDKANILYAWARNAPPTRLPKGVGFRVGGETGSKYFVLQVHYGDISAFRDNHKDCSGVSVHLTRVPQPLIAGMYLMMSVDTVIPPGEKVVNADISCQYKMYPMHVFAYRVHTHHLGKVVSGYRVRNGQWTLIGRQNPQLPQAFYPVEHPVDVTFGDILAARCVFTGEGRTEATHIGGTSSDEMCNLYIMYYMEAKYALSFMTCTKNVAPDMFRTIPAEANIPIPVKPDMVMMHGHHKEAENKEKSALMQQPKQGEEEVLEQGDFYSLLSKLLGEREDVHVHKYNPTEKTESGSDLVAEIANVVQKKDLGRSDAREGAEHEEWGNAILVRDRIHRFHQLESTLRPAESRAFSFQQPGEGPWEPEPSGDFHVEEELDWPGVYLLPGQVSGVALDSKNNLVIFHRGDHVWDGNSFDSKFVYQQRGLGPIEEDTILVIDPNNAEILQSSGKNLFYLPHGLSIDTDGNYWVTDVALHQVFKLDPHSKEGPLLILGRSMQPGSDQNHFCQPTDVAVEPSTGAVFVSDGYCNSRIVQFSPSGKFVTQWGEESSGSSPRPGQFSVPHSLALVPHLDQLCVADRENGRIQCFKTDTKEFVREIKHASFGRNVFAISYIPGFLFAVNGKPYFGDQEPVQGFVMNFSSGEIIDVFKPVRKHFDMPHDIVASEDGTVYIGDAHTNTVWKFTLTEKMEHRSVKKAGIEVQEIKEAEAVVEPKVENKPTSSELQKMQEKQKLSTEPGSGVSVVLITTLLVIPVLVLLAIVMFIRWKKSRAFGDHDRKLESSSGRVLGRFRGKGSGGLNLGNFFASRKGYSRKGFDRVSTEGSDQEKDEDDGTESEEEYSAPLPKPAPSS,brenda,P14925,O=C(O)CN=C(O)/C=C/c1ccccc1,0.23,37.0,6.0,1.14.17.3,10116.0,-0.6382721639824072,-0.6382721639824072,O=C(O)CN=C(O)/C=C/c1ccccc1__MAGRARSGLLLLLLGLLALQSSCLAFRSPLSVFKRFKETTRSFSNECLGTIGPVTPLDASDFALDIRMPGVTPKESDTYFCMSMRLPVDEEAFVIDFKPRASMDTVHHMLLFGCNMPSSTGSYWFCDEGTCTDKANILYAWARNAPPTRLPKGVGFRVGGETGSKYFVLQVHYGDISAFRDNHKDCSGVSVHLTRVPQPLIAGMYLMMSVDTVIPPGEKVVNADISCQYKMYPMHVFAYRVHTHHLGKVVSGYRVRNGQWTLIGRQNPQLPQAFYPVEHPVDVTFGDILAARCVFTGEGRTEATHIGGTSSDEMCNLYIMYYMEAKYALSFMTCTKNVAPDMFRTIPAEANIPIPVKPDMVMMHGHHKEAENKEKSALMQQPKQGEEEVLEQGDFYSLLSKLLGEREDVHVHKYNPTEKTESGSDLVAEIANVVQKKDLGRSDAREGAEHEEWGNAILVRDRIHRFHQLESTLRPAESRAFSFQQPGEGPWEPEPSGDFHVEEELDWPGVYLLPGQVSGVALDSKNNLVIFHRGDHVWDGNSFDSKFVYQQRGLGPIEEDTILVIDPNNAEILQSSGKNLFYLPHGLSIDTDGNYWVTDVALHQVFKLDPHSKEGPLLILGRSMQPGSDQNHFCQPTDVAVEPSTGAVFVSDGYCNSRIVQFSPSGKFVTQWGEESSGSSPRPGQFSVPHSLALVPHLDQLCVADRENGRIQCFKTDTKEFVREIKHASFGRNVFAISYIPGFLFAVNGKPYFGDQEPVQGFVMNFSSGEIIDVFKPVRKHFDMPHDIVASEDGTVYIGDAHTNTVWKFTLTEKMEHRSVKKAGIEVQEIKEAEAVVEPKVENKPTSSELQKMQEKQKLSTEPGSGVSVVLITTLLVIPVLVLLAIVMFIRWKKSRAFGDHDRKLESSSGRVLGRFRGKGSGGLNLGNFFASRKGYSRKGFDRVSTEGSDQEKDEDDGTESEEEYSAPLPKPAPSS,./data/raw/alphafold//AF-P14925-F1-model_v4.pdb,3776,2118,1397,2214 +2768,14395,14602,MTRVAIIGAGPSGLAQLRAFQSAGKKGAAIPELVCFEKQSDWGGLWNYTWRTGVDEFGEPVHGSMYRYLWSNGPKECLEFADYSFEEHFGRPIPSYPPRAVLHDYIMGRVEKSDVRKFVRFSTVVRWIDFDEKTQLFTVTVKDLKKDELYSETFDYVVVASGHFSTPNVPHFPGIEVFPGRVLHAHDFRDANEFVGKNLLVVGSSYSAEDIASQCYKYGAKSITFSYRSKPLNFDWPECFTVKPLLTKLTGKTAHFKDGSEAVVDAVLLCTGYLHHFPFLADNLRLRTNNRLYPAGLYKGIFWQDNPKLIYLGMQDQYFTFNMFDAQAWYARDVILGRIKLPPAAERQADIDHWRAIEEKLETAFDGIDFQTEYMRDLIPATDYPMFDLDKVAALFKEWEEDKVKSIMGYRDNSYVSIMTGNKAPPHHTKWMEALDDSFDAFQNRPEAAAE,uniprot_search,A0A2J7TLL2,CSC,0.0103,22.0,7.6,1.14.13.148,199596.0,-1.987162775294828,-1.987162775294828,CSC__MTRVAIIGAGPSGLAQLRAFQSAGKKGAAIPELVCFEKQSDWGGLWNYTWRTGVDEFGEPVHGSMYRYLWSNGPKECLEFADYSFEEHFGRPIPSYPPRAVLHDYIMGRVEKSDVRKFVRFSTVVRWIDFDEKTQLFTVTVKDLKKDELYSETFDYVVVASGHFSTPNVPHFPGIEVFPGRVLHAHDFRDANEFVGKNLLVVGSSYSAEDIASQCYKYGAKSITFSYRSKPLNFDWPECFTVKPLLTKLTGKTAHFKDGSEAVVDAVLLCTGYLHHFPFLADNLRLRTNNRLYPAGLYKGIFWQDNPKLIYLGMQDQYFTFNMFDAQAWYARDVILGRIKLPPAAERQADIDHWRAIEEKLETAFDGIDFQTEYMRDLIPATDYPMFDLDKVAALFKEWEEDKVKSIMGYRDNSYVSIMTGNKAPPHHTKWMEALDDSFDAFQNRPEAAAE,./data/raw/alphafold//AF-A0A2J7TLL2-F1-model_v4.pdb,5303,1111,4183,1639 +2769,8122,8259,MEYGKCRGIERGMGRRDFLKAATLLGATAAGAGMLAGCAPKSASEAQAQTAPAATGGLDPADVDWKYETDVVIVGSGSGGTCAAIEAAEAGADVVVFEKDKAMYGGNSALCGGYMLAAGWSTQEEITGYAGDTGEAFANQMLRWSQGLGNQDMIREACLRSGEAVDWMMDTGRTYEGASPLPPVWSCGDTEADVVPRSVYNHNAYGATEGHMATLKKRAESLSNIEIEMGCEVAHILKNAEGSVIGVQLADGSFAKARKGVVMACASVDNNLEMSKDLGLMQNVWGLTLEGAGLLAPGNPDMDSNTGDGVRMLREIGAELCMQQAVCMNDSIYVGGISDWGMSEILGKDVNIHDSSNIDAILVDKTGRRFCQDDAEWGYVMHECAQAAWKQGFTPDDPTTGYIFYVYDATGAPFFEMKGHTPDTCDTTFSADSVDGLAEFIGCDPTALASEVERWNSFCEAGLDADFGRRANMAPIATPPFYCDVVRPGPMGTFAGAKSNVEAEIIGLDGNPIPRLYGAGCIIGGNVSGAFYFGCGWSITNTVVWGREAGRNVAALEPWE,sabio,C8WLM1,CC1OC(OC2C(O)CC(OC3C(O)CC(OC4CCC5(C)C(CCC6C5CC(O)C5(C)C(C7=CC(=O)OC7)CCC65O)C4)OC3C)OC2C)CC(O)C1O,0.0945999999999999,25.0,,1.3.2.-,84112.0,-1.0241088635982076,-1.0241088635982076,CC1OC(OC2C(O)CC(OC3C(O)CC(OC4CCC5(C)C(CCC6C5CC(O)C5(C)C(C7=CC(=O)OC7)CCC65O)C4)OC3C)OC2C)CC(O)C1O__MEYGKCRGIERGMGRRDFLKAATLLGATAAGAGMLAGCAPKSASEAQAQTAPAATGGLDPADVDWKYETDVVIVGSGSGGTCAAIEAAEAGADVVVFEKDKAMYGGNSALCGGYMLAAGWSTQEEITGYAGDTGEAFANQMLRWSQGLGNQDMIREACLRSGEAVDWMMDTGRTYEGASPLPPVWSCGDTEADVVPRSVYNHNAYGATEGHMATLKKRAESLSNIEIEMGCEVAHILKNAEGSVIGVQLADGSFAKARKGVVMACASVDNNLEMSKDLGLMQNVWGLTLEGAGLLAPGNPDMDSNTGDGVRMLREIGAELCMQQAVCMNDSIYVGGISDWGMSEILGKDVNIHDSSNIDAILVDKTGRRFCQDDAEWGYVMHECAQAAWKQGFTPDDPTTGYIFYVYDATGAPFFEMKGHTPDTCDTTFSADSVDGLAEFIGCDPTALASEVERWNSFCEAGLDADFGRRANMAPIATPPFYCDVVRPGPMGTFAGAKSNVEAEIIGLDGNPIPRLYGAGCIIGGNVSGAFYFGCGWSITNTVVWGREAGRNVAALEPWE,./data/raw/alphafold//AF-C8WLM1-F1-model_v4.pdb,91,2812,3491,4049 +2770,29287,29810,MLMKRLFAASLMLAFSSVSSVRAEEAVKPGAPWWKSAVFYQVYPRSFKDTNGDGIGDFKGLTEKLDYLKGLGIDAIWINPHYASPNTDNGYDISDYREVMKEYGTMEDFDRLMAELKKRGMRLMVDVVINHSSDQHEWFKSSRASKDNPYRDYYFWRDGKDGHEPNNYPSFFGGSAWEKDPVTGQYYLHYFGRQQPDLNWDTPKLREELYAMLRFWLDKGVSGMRFDTVATYSKTPGFPDLTPEQMKNFAEAYTQGPNLHRYLQEMHEKVFDHYDAVTAGEIFGAPLNQVPLFIDSRRKELDMAFTFDLIRYDRALDRWHTIPRTLADFRQTIDKVDAIAGEYGWNTFFLGNHDNPRAVSHFGDDRPQWREASAKALATVTLTQRGTPFIFQGDELGMTNYPFKTLQDFDDIEVKGFFQDYVETGKATAEELLTNVALTSRDNARTPFQWDDSANAGFTTGKPWLKVNPNYTEINAAREIGDPKSVYSFYRNLISIRHETPALSTGSYRDIDPSNADVYAYTRSQDGETYLVVVNFKAEPRSFTLPDGMHIAETLIESSSPAAPAAGAASLELQPWQSGIYKVK,brenda,Q2PS28,O=C(COC1OC(CO)C(O)C(O)C1O)C(O)C(O)C(O)CO,30.0,20.0,5.8,5.4.99.11,1912599.0,1.4771212547196624,1.4771212547196624,O=C(COC1OC(CO)C(O)C(O)C1O)C(O)C(O)C(O)CO__MLMKRLFAASLMLAFSSVSSVRAEEAVKPGAPWWKSAVFYQVYPRSFKDTNGDGIGDFKGLTEKLDYLKGLGIDAIWINPHYASPNTDNGYDISDYREVMKEYGTMEDFDRLMAELKKRGMRLMVDVVINHSSDQHEWFKSSRASKDNPYRDYYFWRDGKDGHEPNNYPSFFGGSAWEKDPVTGQYYLHYFGRQQPDLNWDTPKLREELYAMLRFWLDKGVSGMRFDTVATYSKTPGFPDLTPEQMKNFAEAYTQGPNLHRYLQEMHEKVFDHYDAVTAGEIFGAPLNQVPLFIDSRRKELDMAFTFDLIRYDRALDRWHTIPRTLADFRQTIDKVDAIAGEYGWNTFFLGNHDNPRAVSHFGDDRPQWREASAKALATVTLTQRGTPFIFQGDELGMTNYPFKTLQDFDDIEVKGFFQDYVETGKATAEELLTNVALTSRDNARTPFQWDDSANAGFTTGKPWLKVNPNYTEINAAREIGDPKSVYSFYRNLISIRHETPALSTGSYRDIDPSNADVYAYTRSQDGETYLVVVNFKAEPRSFTLPDGMHIAETLIESSSPAAPAAGAASLELQPWQSGIYKVK,./data/raw/alphafold//AF-Q2PS28-F1-model_v4.pdb,1684,7060,8926,9182 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+2937,29767,30295,MDALEKGAVTSGPAPRGRPSRGRPPKLQRSRGAGRGLEKPPHLAALVLARGGSKGIPLKNIKRLAGVPLIGWVLRAALDAGVFQSVWVSTDHDEIENVAKQFGAQVHRRSSETSKDSSTSLDAIVEFLNYHNEVDIVGNIQATSPCLHPTDLQKVAEMIREEGYDSVFSVVRRHQFRWSEIQKGVREVTEPLNLNPAKRPRRQDWDGELYENGSFYFAKRHLIEMGYLQGGKMAYYEMRAEHSVDIDVDIDWPIAEQRVLRFGYFGKEKLKEIKLLVCNIDGCLTNGHIYVSGDQKEIISYDVKDAIGISLLKKSGIEVRLISERACSKQTLSALKLDCKTEVSVSDKLATVDEWRKEMGLCWKEVAYLGNEVSDEECLKRVGLSAVPADACSGAQKAVGYICKCSGGRGAIREFAEHIFLLIEKVNNSCQK,brenda,Q99KK2,O=C(O)C(=O)C[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,0.56,37.0,9.0,2.7.7.43,10090.0,-0.2518119729937995,-0.2518119729937995,O=C(O)C(=O)C[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO__MDALEKGAVTSGPAPRGRPSRGRPPKLQRSRGAGRGLEKPPHLAALVLARGGSKGIPLKNIKRLAGVPLIGWVLRAALDAGVFQSVWVSTDHDEIENVAKQFGAQVHRRSSETSKDSSTSLDAIVEFLNYHNEVDIVGNIQATSPCLHPTDLQKVAEMIREEGYDSVFSVVRRHQFRWSEIQKGVREVTEPLNLNPAKRPRRQDWDGELYENGSFYFAKRHLIEMGYLQGGKMAYYEMRAEHSVDIDVDIDWPIAEQRVLRFGYFGKEKLKEIKLLVCNIDGCLTNGHIYVSGDQKEIISYDVKDAIGISLLKKSGIEVRLISERACSKQTLSALKLDCKTEVSVSDKLATVDEWRKEMGLCWKEVAYLGNEVSDEECLKRVGLSAVPADACSGAQKAVGYICKCSGGRGAIREFAEHIFLLIEKVNNSCQK,./data/raw/alphafold//AF-Q99KK2-F1-model_v4.pdb,5784,2584,3230,3719 +2938,21176,21495,MQIGIIGLGRMGGNIAVRLSRHGHDVVLFDRDAATVSKVSERIEGGRGVAATSLPDLVAKLTAKRKIVWVMLPCGEITENAVQELYGLLGKDDIVIDGGNTYYKDDIRRAAQLADKGIHYVDVGTSGGVWGLERGYCMMYGGTKDSTDHIDPILDALAPGKGDVAPTPDRGKPGLDPRAEKGYLHCGPAGSGHFVKMVHNGIEYGMMQAFAEGFDIMKSKNSPKLPEDQRFDLNMADIAEVWRRGSVVSSWLLDLTAEALAKNASLSEFTGEVADSGEGRWTLEAAIEEAVPAPVITASLFTRFRSRTGNNYAEKVLSAMRFGFGGHVEKKD,brenda,A9H324,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.869,25.0,5.0,1.1.1.343,33996.0,-0.0609802235513335,0.1589812375310519,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MQIGIIGLGRMGGNIAVRLSRHGHDVVLFDRDAATVSKVSERIEGGRGVAATSLPDLVAKLTAKRKIVWVMLPCGEITENAVQELYGLLGKDDIVIDGGNTYYKDDIRRAAQLADKGIHYVDVGTSGGVWGLERGYCMMYGGTKDSTDHIDPILDALAPGKGDVAPTPDRGKPGLDPRAEKGYLHCGPAGSGHFVKMVHNGIEYGMMQAFAEGFDIMKSKNSPKLPEDQRFDLNMADIAEVWRRGSVVSSWLLDLTAEALAKNASLSEFTGEVADSGEGRWTLEAAIEEAVPAPVITASLFTRFRSRTGNNYAEKVLSAMRFGFGGHVEKKD,./data/raw/alphafold//AF-A9H324-F1-model_v4.pdb,4309,5274,7201,7235 +2939,3578,3636,MVAAAMLLRSCPVLSQGPTGLLGKVAKTYQFLFSIGRCPILATQGPTCSQIHLKATKAGGDSPSWAKSHCPFMLSELQDRKSKIVQRAAPEVQEDVKTFKTDLLSTMDSTTRSHSFPSFQEPEQTEGAVPHLIQNNMTGSQAFGYDQFFRDKIMEKKQDHTYRVFKTVNRWANAYPFAQHFSEASMASKDVSVWCSNDYLGISRHPRVLQAIEETLKNHGAGAGGTRNISGTSKFHVELEQELAELHQKDSALLFSSCFVANDSTLFTLAKLLPGCEIYSDAGNHASMIQGIRNSGAAKFVFRHNDPGHLKKLLEKSDPKTPKIVAFETVHSMDGAICPLEELCDVAHQYGALTFVDEVHAVGLYGARGAGIGERDGIMHKLDIISGTLGKAFGCVGGYIASTRDLVDMVRSYAAGFIFTTSLPPMVLSGALESVRLLKGEEGQALRRAHQRNVKHMRQLLMDRGFPVIPCPSHIIPIRVGNAALNSKICDLLLSKHSIYVQAINYPTVPRGEELLRLAPSPHHSPQMMENFVEKLLLAWTEVGLPLQDVSVAACNFCHRPVHFELMSEWERSYFGNMGPQYVTTYA,brenda,P08680,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)CCC(=O)O,0.001,37.0,7.5,2.3.1.37,10090.0,-3.0,-1.8794240546608023,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)CCC(=O)O__MVAAAMLLRSCPVLSQGPTGLLGKVAKTYQFLFSIGRCPILATQGPTCSQIHLKATKAGGDSPSWAKSHCPFMLSELQDRKSKIVQRAAPEVQEDVKTFKTDLLSTMDSTTRSHSFPSFQEPEQTEGAVPHLIQNNMTGSQAFGYDQFFRDKIMEKKQDHTYRVFKTVNRWANAYPFAQHFSEASMASKDVSVWCSNDYLGISRHPRVLQAIEETLKNHGAGAGGTRNISGTSKFHVELEQELAELHQKDSALLFSSCFVANDSTLFTLAKLLPGCEIYSDAGNHASMIQGIRNSGAAKFVFRHNDPGHLKKLLEKSDPKTPKIVAFETVHSMDGAICPLEELCDVAHQYGALTFVDEVHAVGLYGARGAGIGERDGIMHKLDIISGTLGKAFGCVGGYIASTRDLVDMVRSYAAGFIFTTSLPPMVLSGALESVRLLKGEEGQALRRAHQRNVKHMRQLLMDRGFPVIPCPSHIIPIRVGNAALNSKICDLLLSKHSIYVQAINYPTVPRGEELLRLAPSPHHSPQMMENFVEKLLLAWTEVGLPLQDVSVAACNFCHRPVHFELMSEWERSYFGNMGPQYVTTYA,./data/raw/alphafold//AF-P08680-F1-model_v4.pdb,4889,1625,2470,2450 +2940,11247,11405,MKRLVCVLLVCSSAVAQLHKDPTLDHHWHLWKKTYGKQYKEKNEEAVRRLIWEKNLKFVMLHNLEHSMGMHSYDLGMNHLGDMTSEEVMSLMSSLRVPSQWQRNITYKSNPNRILPDSVDWREKGCVTEVKYQGSCGACWAFSAVGALEAQLKLKTGKLVSLSAQNLVDCSTEKYGNKGCNGGFMTTAFQYIIDNKGIDSDASYPYKAMDQKCQYDSKYRAATCSKYTELPYGREDVLKEAVANKGPVSVGVDARHPSFFLYRSGVYYEPSCTQNVNHGVLVVGYGDLNGKEYWLVKNSWGHNFGEEGYIRMARNKGNHCGIASFPSYPEI,uniprot_search,P25774,CCCC[C@H](N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN)C(O)=N[C@H](C(O)=NCC(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=N[C@H](CCCNC(=N)N)C(=N)O)C(C)C,0.0016,37.0,5.5,3.4.22.27,9606.0,-2.7958800173440754,-2.7958800173440754,CCCC[C@H](N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN)C(O)=N[C@H](C(O)=NCC(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=N[C@H](CCCNC(=N)N)C(=N)O)C(C)C__MKRLVCVLLVCSSAVAQLHKDPTLDHHWHLWKKTYGKQYKEKNEEAVRRLIWEKNLKFVMLHNLEHSMGMHSYDLGMNHLGDMTSEEVMSLMSSLRVPSQWQRNITYKSNPNRILPDSVDWREKGCVTEVKYQGSCGACWAFSAVGALEAQLKLKTGKLVSLSAQNLVDCSTEKYGNKGCNGGFMTTAFQYIIDNKGIDSDASYPYKAMDQKCQYDSKYRAATCSKYTELPYGREDVLKEAVANKGPVSVGVDARHPSFFLYRSGVYYEPSCTQNVNHGVLVVGYGDLNGKEYWLVKNSWGHNFGEEGYIRMARNKGNHCGIASFPSYPEI,./data/raw/alphafold//AF-P25774-F1-model_v4.pdb,847,4216,5647,3021 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+2942,21456,21783,MTTIDTLATCTQQNRDAVYTLLRRYFTANRTLLLQSDLREGLLQTEQDCGQSDMLRAFVFRLQEGIFSSPWAYLALRPEIAKWEFMRIHQEHLIPEKLTISEFLKFKETVVKGEATESVLEVDFGPFNRGFPRLKESRSIGQGVIFLNRKLSSEMFSRIEAGHTSLLHFLGVHAIEGQQLMFSNNSHDIHAVRNQLRQALEMLETLDGTTPWIELAPKMNQLGFAPGWGHNANRVAETMNMLMDILEAPSPSALEEFLACIPMISRLLILSPHGYFGQDNVLGLPDTGGQVVYILDQVRALEKEMHDRLQLQGVQVEPKILIVTRLIPDAGDTTCNQRLEKVSGCTNTWILRVPFRKHNGEIIPHWISRFEIWPHLEIFAGDVEREALAELGGHPDLIIGNYSDGNLVATLLSRRLGVTQCNIAHALEKTKYLHSDIYWQENEDKYHFSCQYTADLLAMNSADFIVTSTYQEIAGTREAEGQYESYQAFSMPDLYRVIHGIDLFDPKFNIVSPGANADIYFPYSDPNRRLHSLIPEIESLIFDDATNLPARGYLQDPDKPLIFTMARLDRIKNITGLVELYAASPRLRSLANLVIVGGKIDPQHSSDHEEQEQIHRMHQLMDEHELDQQVRWLGMRLDKNLAGELYRYIADKRGIFVQPALFEAFGLTIIEAMASGLPTFATRYGGPLEIIQNNRSGFHIDPNQGAATADLIADFFEKNLENPQEWERISQGALDRVASRYTWKLYAERMMTLSRIYGFWKFVSGLEREETDRYLNMFYHLQFRPLANRLAHEI,brenda,Q820M5,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1,1.28,60.0,7.0,2.4.1.13,915.0,0.1072099696478683,0.1072099696478683,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1__MTTIDTLATCTQQNRDAVYTLLRRYFTANRTLLLQSDLREGLLQTEQDCGQSDMLRAFVFRLQEGIFSSPWAYLALRPEIAKWEFMRIHQEHLIPEKLTISEFLKFKETVVKGEATESVLEVDFGPFNRGFPRLKESRSIGQGVIFLNRKLSSEMFSRIEAGHTSLLHFLGVHAIEGQQLMFSNNSHDIHAVRNQLRQALEMLETLDGTTPWIELAPKMNQLGFAPGWGHNANRVAETMNMLMDILEAPSPSALEEFLACIPMISRLLILSPHGYFGQDNVLGLPDTGGQVVYILDQVRALEKEMHDRLQLQGVQVEPKILIVTRLIPDAGDTTCNQRLEKVSGCTNTWILRVPFRKHNGEIIPHWISRFEIWPHLEIFAGDVEREALAELGGHPDLIIGNYSDGNLVATLLSRRLGVTQCNIAHALEKTKYLHSDIYWQENEDKYHFSCQYTADLLAMNSADFIVTSTYQEIAGTREAEGQYESYQAFSMPDLYRVIHGIDLFDPKFNIVSPGANADIYFPYSDPNRRLHSLIPEIESLIFDDATNLPARGYLQDPDKPLIFTMARLDRIKNITGLVELYAASPRLRSLANLVIVGGKIDPQHSSDHEEQEQIHRMHQLMDEHELDQQVRWLGMRLDKNLAGELYRYIADKRGIFVQPALFEAFGLTIIEAMASGLPTFATRYGGPLEIIQNNRSGFHIDPNQGAATADLIADFFEKNLENPQEWERISQGALDRVASRYTWKLYAERMMTLSRIYGFWKFVSGLEREETDRYLNMFYHLQFRPLANRLAHEI,./data/raw/alphafold//AF-Q820M5-F1-model_v4.pdb,2543,6953,8801,7460 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+2955,37019,37671,MSSQTERTFIAVKPDGVQRGLVSQILSRFEKKGYKLVAIKLVKADDKLLEQHYAEHVGKPFFPKMVSFMKSGPILATVWEGKDVVRQGRTILGATNPLGSAPGTIRGDFGIDLGRNVCHGSDSVDSAEREINLWFKKEELVDWESNQAKWIYE,sabio,P36010,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,0.14,,7.5,2.7.4.6,4932.0,-0.8538719643217619,-0.8538719643217619,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1__MSSQTERTFIAVKPDGVQRGLVSQILSRFEKKGYKLVAIKLVKADDKLLEQHYAEHVGKPFFPKMVSFMKSGPILATVWEGKDVVRQGRTILGATNPLGSAPGTIRGDFGIDLGRNVCHGSDSVDSAEREINLWFKKEELVDWESNQAKWIYE,./data/raw/alphafold//AF-P36010-F1-model_v4.pdb,1214,6408,5827,6249 +2956,23233,23589,MANLPILLDYWPSMFGMRARVALREKGVEFEYREEDFSNKSPLLLQSNPIHKKIPVLVHNGKPVCESLNVVQYVDEAWPEKNPFFPSDPYGRAQARFWADFVDKKFTDAQFKVWGKKGEEQEAGKKEFIEAVKILESELGDKPYFGGDSFGYVDISLITFSSWFQAYEKFGNFSIESESPKLIAWAKRCMEKESVSKSLPDSEKIVAYAAEYRKNNL,sabio,Q8L7C9,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O,0.467,,6.5,2.5.1.18,3702.0,-0.3306831194338878,-0.1834476460441662,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O__MANLPILLDYWPSMFGMRARVALREKGVEFEYREEDFSNKSPLLLQSNPIHKKIPVLVHNGKPVCESLNVVQYVDEAWPEKNPFFPSDPYGRAQARFWADFVDKKFTDAQFKVWGKKGEEQEAGKKEFIEAVKILESELGDKPYFGGDSFGYVDISLITFSSWFQAYEKFGNFSIESESPKLIAWAKRCMEKESVSKSLPDSEKIVAYAAEYRKNNL,./data/raw/alphafold//AF-Q8L7C9-F1-model_v4.pdb,1043,1492,7519,8463 +2957,4172,4240,MHAFPHGTTATPTAIAVPPSLRLPVIEAAFPRQLHPYWPKLQETTRTWLLEKRLMPADKVEEYADGLCYTDLMAGYYLGAPDEVLQAIADYSAWFFVWDDRHDRDIVHGRAGAWRRLRGLLHTALDSPGDHLHHEDTLVAGFADSVRRLYAFLPATWNARFARHFHTVIEAYDREFHNRTRGIVPGVEEYLELRRLTFAHWIWTDLLEPSSGCELPDAVRKHPAYRRAALLSQEFAAWYNDLCSLPKEIAGDEVHNLGISLITHHSLTLEEAIGEVRRRVEECITEFLAVERDALRFADELADGTVRGKELSGAVRANVGNMRNWFSSVYWFHHESGRYMVDSWDDRSTPPYVNNEAAGEK,sabio,Q9K499,CC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)O,0.000147,30.0,6.5,4.2.3.37,1902.0,-3.832682665251824,-3.832682665251824,CC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)O__MHAFPHGTTATPTAIAVPPSLRLPVIEAAFPRQLHPYWPKLQETTRTWLLEKRLMPADKVEEYADGLCYTDLMAGYYLGAPDEVLQAIADYSAWFFVWDDRHDRDIVHGRAGAWRRLRGLLHTALDSPGDHLHHEDTLVAGFADSVRRLYAFLPATWNARFARHFHTVIEAYDREFHNRTRGIVPGVEEYLELRRLTFAHWIWTDLLEPSSGCELPDAVRKHPAYRRAALLSQEFAAWYNDLCSLPKEIAGDEVHNLGISLITHHSLTLEEAIGEVRRRVEECITEFLAVERDALRFADELADGTVRGKELSGAVRANVGNMRNWFSSVYWFHHESGRYMVDSWDDRSTPPYVNNEAAGEK,./data/raw/alphafold//AF-Q9K499-F1-model_v4.pdb,4961,1740,2601,2599 +2958,28913,29432,MEDAKNIKKGPAPFYPLEDGTAGEQLHKAMKRYALVPGTIAFTDAHIEVNITYAEYFEMSVRLAEAMKRYGLNTNHRIVVCSENSLQFFMPVLGALFIGVAVAPANDIYNERELLNSMNISQPTVVFVSKKGLQKILNVQKKLPIIQKIIIMDSKTDYQGFQSMYTFVTSHLPPGFNEYDFVPESFDRDKTIALIMNSSGSTGLPKGVALPHRTACVRFSHARDPIFGNQIIPDTAILSVVPFHHGFGMFTTLGYLICGFRVVLMYRFEEELFLRSLQDYKIQSALLVPTLFSFFAKSTLIDKYDLSNLHEIASGGAPLSKEVGEAVAKRFHLPGIRQGYGLTETTSAILITPEGDDKPGAVGKVVPFFEAKVVDLDTGKTLGVNQRGELCVRGPMIMSGYVNNPEATNALIDKDGWLHSGDIAYWDEDEHFFIVDRLKSLIKYKGYQVAPAELESILLQHPNIFDAGVAGLPDDDAGELPAAVVVLEHGKTMTEKEIVDYVASQVTTAKKLRGGVVFVDEVPKGLTGKLDARKIREILIKAKKGGKSKL,brenda,P08659,Nc1ncnc2c1ncn2[C@H]1O[C@H](COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])[C@@H](O)[C@H]1O.[Mg+2],0.16,29.8,7.172222222222222,1.13.12.7,7054.0,-0.7958800173440752,-0.7958800173440752,Nc1ncnc2c1ncn2[C@H]1O[C@H](COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])[C@@H](O)[C@H]1O.[Mg+2]__MEDAKNIKKGPAPFYPLEDGTAGEQLHKAMKRYALVPGTIAFTDAHIEVNITYAEYFEMSVRLAEAMKRYGLNTNHRIVVCSENSLQFFMPVLGALFIGVAVAPANDIYNERELLNSMNISQPTVVFVSKKGLQKILNVQKKLPIIQKIIIMDSKTDYQGFQSMYTFVTSHLPPGFNEYDFVPESFDRDKTIALIMNSSGSTGLPKGVALPHRTACVRFSHARDPIFGNQIIPDTAILSVVPFHHGFGMFTTLGYLICGFRVVLMYRFEEELFLRSLQDYKIQSALLVPTLFSFFAKSTLIDKYDLSNLHEIASGGAPLSKEVGEAVAKRFHLPGIRQGYGLTETTSAILITPEGDDKPGAVGKVVPFFEAKVVDLDTGKTLGVNQRGELCVRGPMIMSGYVNNPEATNALIDKDGWLHSGDIAYWDEDEHFFIVDRLKSLIKYKGYQVAPAELESILLQHPNIFDAGVAGLPDDDAGELPAAVVVLEHGKTMTEKEIVDYVASQVTTAKKLRGGVVFVDEVPKGLTGKLDARKIREILIKAKKGGKSKL,./data/raw/alphafold//AF-P08659-F1-model_v4.pdb,209,6797,3692,8840 +2959,2675,2723,MTQTNRVIIFDTTLRDGEQSPGAAMTKEEKIRVARQLEKLGVDIIEAGFAAASPGDFEAVNAIAKTITKSTVCSLSRAIERDIRQAGEAVAPAPKKRIHTFIATSPIHMEYKLKMKPKQVIEAAVKAVKIAREYTDDVEFSCEDALRSEIDFLAEICGAVIEAGATTINIPDTVGYSIPYKTEEFFRELIAKTPNGGKVVWSAHCHNDLGLAVANSLAALKGGARQVECTVNGLGERAGNASVEEIVMALKVRHDLFGLETGIDTTQIVPSSKLVSTITGYPVQPNKAIVGANAFSHESGIHQDGVLKHRETYEIMSAESVGWATNRLSLGKLSGRNAFKTKLADLGIELESEEALNAAFARFKELADKKREIFDEDLHALVSDEMGSMNAESYKFISQKISTETGEEPRADIVFSIKGEEKRASATGSGPVDAIFKAIESVAQSGAALQIYSVNAVTQGTESQGETSVRLARGNRVVNGQGADTDVLVATAKAYLSALSKLEFSAAKPKAQGSGTI,brenda,Q9JZG1,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.035,25.0,6.6,2.3.3.13,5141.0,-1.4559319556497243,-1.4559319556497243,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MTQTNRVIIFDTTLRDGEQSPGAAMTKEEKIRVARQLEKLGVDIIEAGFAAASPGDFEAVNAIAKTITKSTVCSLSRAIERDIRQAGEAVAPAPKKRIHTFIATSPIHMEYKLKMKPKQVIEAAVKAVKIAREYTDDVEFSCEDALRSEIDFLAEICGAVIEAGATTINIPDTVGYSIPYKTEEFFRELIAKTPNGGKVVWSAHCHNDLGLAVANSLAALKGGARQVECTVNGLGERAGNASVEEIVMALKVRHDLFGLETGIDTTQIVPSSKLVSTITGYPVQPNKAIVGANAFSHESGIHQDGVLKHRETYEIMSAESVGWATNRLSLGKLSGRNAFKTKLADLGIELESEEALNAAFARFKELADKKREIFDEDLHALVSDEMGSMNAESYKFISQKISTETGEEPRADIVFSIKGEEKRASATGSGPVDAIFKAIESVAQSGAALQIYSVNAVTQGTESQGETSVRLARGNRVVNGQGADTDVLVATAKAYLSALSKLEFSAAKPKAQGSGTI,./data/raw/alphafold//AF-Q9JZG1-F1-model_v4.pdb,3648,824,986,1206 +2960,10071,10225,MSQQPHTEQFPKNQPPLAERLASARQLVTKAISAVPPHPEPLPSPNSDQGEPSNLIQDVKKLGFEDFDTLVNFFSSAVEGQINDNELLLEHLIQLFAKLPQNSVKGKRLENGLINQLWNGIDHPPMTTLGEDHKYRAADGSGNAIHDPKMGAAGQPYARSTPAKSYQNPNQPEPEMIFDMLFARGGEFKPHPNKISSFMFYLATIITHDIFQTKNGTSPINQTSSYLDLAPLYGRNQAEQDLMRTKKNGLLKPDTFSSKRVLGFPPGVGTLLIMFNRYHNYIATNLATINEGGRFQKPTGDDPEKAAKYDNDLFQTARLITCRLYVSIILRDYVRTILGMNRTASSWALDPRTNEGKSILSQQTPEGTGNQVSVEFNLIYRWHNTISPKDEQWTKDVMKKVLGKDPTEMSLMEFGHAMRDWEQEIPDDPAQRGFMDLPRNADGTLNEADLAKIFKESVDDVAGSYGANRIPEVMRPIELMGIMASRSWNCATLNEFREHFGLTRHPTFEDINPDKEVAAKLRFLYGSPDAVELYPGLMAEKAKPPMAPGSGLCGNFTMTRAILSDAVALVRGDRFYTIDYTPKNLTNWGFNQASYDLNVDQSHVLYKLVFRAFPNSFQNNSIYAHFPFVIPSENKKILESIDKAYLYTWDEPKTKTPLIPILSHKAVSEVLYNQQDFKVITGDAINHLVAQPNKPHYGKDFCLSGDGKEHAKNRTLVRKSLISGPWETEIWKWYTHMTPKILNLNSFPIPGNKREIDLVRDVINVTNTRFNAALFCMPIKNEESPWGVYTDQELYSVLGALFQAVFMDADIGNSFKLRTIARELAQDLGKVVMLIAQTIKKAGLITDIVAKIREGEASLPTYGNHLIERMLSDGKDVEEVVWGTIMPVITANVANQSQVTSLCVDYYLDKEGKKHLPELYRLAHENTPEADETLMKYMLEGCRLRGPVAVYREATSTQVITDYSPCLPSDSDPTGRDPITNPDIEGTKREVKIPKGYRVVCNFATAGRDPAIFEDPNEVRLDRPLDSYVHFGLGPHWCAGKEMSRVGQTSLFKQIVGLKNLRRAPGGRGEMKNFPASPWNGQVGLPVEGQNGSAAHQQPWLGLRAFMTVDQSSLWPIPTTMRVQWDE,brenda,A0A0S2SWE4,CCCCCCCC/C=C\CCCCCCCC(=O)O,0.0293,40.0,6.5,1.13.11.60,474922.0,-1.5331323796458909,-1.4960813042110834,CCCCCCCC/C=C\CCCCCCCC(=O)O__MSQQPHTEQFPKNQPPLAERLASARQLVTKAISAVPPHPEPLPSPNSDQGEPSNLIQDVKKLGFEDFDTLVNFFSSAVEGQINDNELLLEHLIQLFAKLPQNSVKGKRLENGLINQLWNGIDHPPMTTLGEDHKYRAADGSGNAIHDPKMGAAGQPYARSTPAKSYQNPNQPEPEMIFDMLFARGGEFKPHPNKISSFMFYLATIITHDIFQTKNGTSPINQTSSYLDLAPLYGRNQAEQDLMRTKKNGLLKPDTFSSKRVLGFPPGVGTLLIMFNRYHNYIATNLATINEGGRFQKPTGDDPEKAAKYDNDLFQTARLITCRLYVSIILRDYVRTILGMNRTASSWALDPRTNEGKSILSQQTPEGTGNQVSVEFNLIYRWHNTISPKDEQWTKDVMKKVLGKDPTEMSLMEFGHAMRDWEQEIPDDPAQRGFMDLPRNADGTLNEADLAKIFKESVDDVAGSYGANRIPEVMRPIELMGIMASRSWNCATLNEFREHFGLTRHPTFEDINPDKEVAAKLRFLYGSPDAVELYPGLMAEKAKPPMAPGSGLCGNFTMTRAILSDAVALVRGDRFYTIDYTPKNLTNWGFNQASYDLNVDQSHVLYKLVFRAFPNSFQNNSIYAHFPFVIPSENKKILESIDKAYLYTWDEPKTKTPLIPILSHKAVSEVLYNQQDFKVITGDAINHLVAQPNKPHYGKDFCLSGDGKEHAKNRTLVRKSLISGPWETEIWKWYTHMTPKILNLNSFPIPGNKREIDLVRDVINVTNTRFNAALFCMPIKNEESPWGVYTDQELYSVLGALFQAVFMDADIGNSFKLRTIARELAQDLGKVVMLIAQTIKKAGLITDIVAKIREGEASLPTYGNHLIERMLSDGKDVEEVVWGTIMPVITANVANQSQVTSLCVDYYLDKEGKKHLPELYRLAHENTPEADETLMKYMLEGCRLRGPVAVYREATSTQVITDYSPCLPSDSDPTGRDPITNPDIEGTKREVKIPKGYRVVCNFATAGRDPAIFEDPNEVRLDRPLDSYVHFGLGPHWCAGKEMSRVGQTSLFKQIVGLKNLRRAPGGRGEMKNFPASPWNGQVGLPVEGQNGSAAHQQPWLGLRAFMTVDQSSLWPIPTTMRVQWDE,./data/raw/alphafold//AF-A0A0S2SWE4-F1-model_v4.pdb,210,2667,3328,3844 +2961,31415,31972,MITILGAGKVGMATAVMLMMRGYDDLLLIARTPGKPQGEALDLAHAAAELGVDIRISGSNSYEDMRGSDIVLVTAGIGRKPGMTREQLLEANANTMADLAEKIKAYAKDAIVVITTNPVDAMTYVMYKKTGFPRERVIGFSGILDSARMAYYISQKLGVSFKSVNAIVLGMHGQKMFPVPRLSSVGGVPLEHLMSKEEIEEVVSETVNAGAKITELRGYSSNYGPAAGLVLTVEAIKRDSKRIYPYSLYLQGEYGYNDIVAEVPAVIGKSGIERIIELPLTEDEKRKFDEAVQAVKKLVETLPPQLRE,brenda,Q9YEA1,O=C(O)[C@@H](O)[C@@H](O)C(=O)O,0.2,95.0,11.0,1.1.1.82,56636.0,-0.6989700043360187,0.0322289946134592,O=C(O)[C@@H](O)[C@@H](O)C(=O)O__MITILGAGKVGMATAVMLMMRGYDDLLLIARTPGKPQGEALDLAHAAAELGVDIRISGSNSYEDMRGSDIVLVTAGIGRKPGMTREQLLEANANTMADLAEKIKAYAKDAIVVITTNPVDAMTYVMYKKTGFPRERVIGFSGILDSARMAYYISQKLGVSFKSVNAIVLGMHGQKMFPVPRLSSVGGVPLEHLMSKEEIEEVVSETVNAGAKITELRGYSSNYGPAAGLVLTVEAIKRDSKRIYPYSLYLQGEYGYNDIVAEVPAVIGKSGIERIIELPLTEDEKRKFDEAVQAVKKLVETLPPQLRE,./data/raw/alphafold//AF-Q9YEA1-F1-model_v4.pdb,1866,7329,9283,9615 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+2984,13932,14133,MGINFEDQTTLFNFVVREGNGVKGMIDSGLSSVPRPFVQPLSERIPTQKALTCEATQPIDLSNLDGPQHKEVAKQIVEAAETLGFFQVVNHGVSVELLELLKSSAHEFFAQAPEEKSMYLKEVSPSKLVKYGTSFVPDKEKAIEWKDYVSMLYTNDSEALQHWPQPCREVALEFLNSSMEMVKNVVNILMENVGVTLEEEKMNGLMGTKMVNMNYYPTCPSPELTVGVGRHSDMGMLTVLLQDGIGGLYVKLDNGEWAEIPPVHGALVINIGDTLQILSNGKYKSAEHRVRTTNIGSRVSVPIFTAPNPSQKVGPLPEVVKRDGVARYKEFLFQDYMNNFFGQPHDGKKSLDFARAE,brenda,Q9LE86,COc1cc2ccc(=O)oc2cc1O,0.011,31.5,8.0,1.14.11.60,3702.0,-1.958607314841775,-1.958607314841775,COc1cc2ccc(=O)oc2cc1O__MGINFEDQTTLFNFVVREGNGVKGMIDSGLSSVPRPFVQPLSERIPTQKALTCEATQPIDLSNLDGPQHKEVAKQIVEAAETLGFFQVVNHGVSVELLELLKSSAHEFFAQAPEEKSMYLKEVSPSKLVKYGTSFVPDKEKAIEWKDYVSMLYTNDSEALQHWPQPCREVALEFLNSSMEMVKNVVNILMENVGVTLEEEKMNGLMGTKMVNMNYYPTCPSPELTVGVGRHSDMGMLTVLLQDGIGGLYVKLDNGEWAEIPPVHGALVINIGDTLQILSNGKYKSAEHRVRTTNIGSRVSVPIFTAPNPSQKVGPLPEVVKRDGVARYKEFLFQDYMNNFFGQPHDGKKSLDFARAE,./data/raw/alphafold//AF-Q9LE86-F1-model_v4.pdb,371,3573,4883,5181 +2985,2103,2144,MSNVLIFNVGSSSLTYKVFCSDNIVCSGKSNRVNVTGTEKPFIEHHLNGQIIKIETPILNHPQAAKLIIQFLKENHISIAFVGHRFVHGGSYFKKSAVIDEVVLKELKECLPLAPIHNPSSFGVIEISMKELPTTRQYVAIDTAFHSTISQAERTYAIPQPYQSQYLKFGFHGLSYEYVINSLKNVIDVSHSKIIACHLGTGGSSCCGIVNGKSFDTSMGNSTLAGLVMSTRCGDIDPTIPIDMIQQVGIEKVVDILNKKSGLLGVSELSSDMRDILHEIETRGPKAKTCQLAFDVYIKQLAKTIGGLMVEIGGLDLLVFTDQMGLEVWQVRKAICDKMKFLGIELDDSLNEKSMGKKIEFLTMPSSKVQVCVAPNDEELVILQKGKELFQF,brenda,C4M1C3,CC(=O)O,166.0,37.333333333333336,6.75,2.7.2.12,5759.0,2.220108088040055,2.220108088040055,CC(=O)O__MSNVLIFNVGSSSLTYKVFCSDNIVCSGKSNRVNVTGTEKPFIEHHLNGQIIKIETPILNHPQAAKLIIQFLKENHISIAFVGHRFVHGGSYFKKSAVIDEVVLKELKECLPLAPIHNPSSFGVIEISMKELPTTRQYVAIDTAFHSTISQAERTYAIPQPYQSQYLKFGFHGLSYEYVINSLKNVIDVSHSKIIACHLGTGGSSCCGIVNGKSFDTSMGNSTLAGLVMSTRCGDIDPTIPIDMIQQVGIEKVVDILNKKSGLLGVSELSSDMRDILHEIETRGPKAKTCQLAFDVYIKQLAKTIGGLMVEIGGLDLLVFTDQMGLEVWQVRKAICDKMKFLGIELDDSLNEKSMGKKIEFLTMPSSKVQVCVAPNDEELVILQKGKELFQF,./data/raw/alphafold//AF-C4M1C3-F1-model_v4.pdb,3530,1055,1260,1547 +2986,38671,39353,MAKKLLGIDLGGTSIKFGILTLDGQVQEKWAIETNILEDGKHIVPDIVSSIKHRLGLYNLTKEDFVGIGMGSPGAVDRNLKTVTGAFNLNWAATQEVGTIIEAELGIPFAIDNDANVAALGERWVGAGNNNPDVVFVTLGTGVGGGIIADGNLIHGVAGAGGEIGHIIVEPDTGFECTCGNKGCLETVASATGVVRVARHLAEEYEGISSIKAGIDNGDDVSSKDIFVAAQAGDKFANSVVEKVTFYLGLATANISNILNPNTVVVGGGVSAAGEFLRSHIESYFKLYAFPQVKQSTKIKIAELGNDAGIIGAASLAHQFLES,uniprot_search,A0A2J9QFK1,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,0.61,22.0,7.5,2.7.1.2,1309.0,-0.2146701649892329,-0.2146701649892329,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O__MAKKLLGIDLGGTSIKFGILTLDGQVQEKWAIETNILEDGKHIVPDIVSSIKHRLGLYNLTKEDFVGIGMGSPGAVDRNLKTVTGAFNLNWAATQEVGTIIEAELGIPFAIDNDANVAALGERWVGAGNNNPDVVFVTLGTGVGGGIIADGNLIHGVAGAGGEIGHIIVEPDTGFECTCGNKGCLETVASATGVVRVARHLAEEYEGISSIKAGIDNGDDVSSKDIFVAAQAGDKFANSVVEKVTFYLGLATANISNILNPNTVVVGGGVSAAGEFLRSHIESYFKLYAFPQVKQSTKIKIAELGNDAGIIGAASLAHQFLES,./data/raw/alphafold//AF-A0A2J9QFK1-F1-model_v4.pdb,2618,8295,8412,7903 +2987,9493,9642,MRIPLVGKDSIESKDIGFTLIHEHLRVFSEAVRQQWPHLYNEDEEFRNAVNEVKRAMQFGVKTIVDPTVMGLGRDIRFMEKVVKATGINLVAGTGIYIYIDLPFYFLNRSIDEIADLFIHDIKEGIQGTLNKAGFVKIAADEPGITKDVEKVIRAAAIANKETKVPIITHSNAHNNTGLEQQRILTEEGVDPGKILIGHLGDTDNIDYIKKIADKGSFIGLDRYGLDLFLPVDKRNETTLRLIKDGYSDKIMISHDYCCTIDWGTAKPEYKPKLAPRWSITLIFEDTIPFLKRNGVNEEVIATIFKENPKKFFS,brenda,Q97VT7,CCCCC1CCCC(=O)O1,0.359,25.0,8.3,3.1.1.25,2287.0,-0.4449055514216808,-0.4449055514216808,CCCCC1CCCC(=O)O1__MRIPLVGKDSIESKDIGFTLIHEHLRVFSEAVRQQWPHLYNEDEEFRNAVNEVKRAMQFGVKTIVDPTVMGLGRDIRFMEKVVKATGINLVAGTGIYIYIDLPFYFLNRSIDEIADLFIHDIKEGIQGTLNKAGFVKIAADEPGITKDVEKVIRAAAIANKETKVPIITHSNAHNNTGLEQQRILTEEGVDPGKILIGHLGDTDNIDYIKKIADKGSFIGLDRYGLDLFLPVDKRNETTLRLIKDGYSDKIMISHDYCCTIDWGTAKPEYKPKLAPRWSITLIFEDTIPFLKRNGVNEEVIATIFKENPKKFFS,./data/raw/alphafold//AF-Q97VT7-F1-model_v4.pdb,158,2916,3616,4197 +2988,241,253,MTVFSAIPPISCWFTGRTPASWDKTMDMQTSFLDRLFEEGLLIETGVDGLYGRSGQFEDVIAAFERLIDRTGGADGAEAIRFPPGINRAYFEKSGYMKSFPQLAGTVHSFCGCELDHVSLLKSMDEGGDWTKDQKATDIVLTPAACYPLYPTIAKRGALPAGGGLYDIQSYCFRHEPSKDPARQQLFRMREYVCMGTESDVTEFRQTWMDRGVEMMKAVGLDVTIDIANDPFFGRAGKMLANNQRDQNLKFELLIPVTSATNPTACMSFNYHQDAFGQKWGLNLENGDVAHTACVGFGLERIALALFAHHGLDVKKWPAKVVETLWG,sabio,Q7CWR3,*S,0.0047,30.0,7.5,6.2.1.n2,358.0,-2.3279021420642825,-2.3279021420642825,*S__MTVFSAIPPISCWFTGRTPASWDKTMDMQTSFLDRLFEEGLLIETGVDGLYGRSGQFEDVIAAFERLIDRTGGADGAEAIRFPPGINRAYFEKSGYMKSFPQLAGTVHSFCGCELDHVSLLKSMDEGGDWTKDQKATDIVLTPAACYPLYPTIAKRGALPAGGGLYDIQSYCFRHEPSKDPARQQLFRMREYVCMGTESDVTEFRQTWMDRGVEMMKAVGLDVTIDIANDPFFGRAGKMLANNQRDQNLKFELLIPVTSATNPTACMSFNYHQDAFGQKWGLNLENGDVAHTACVGFGLERIALALFAHHGLDVKKWPAKVVETLWG,./data/raw/alphafold//AF-Q7CWR3-F1-model_v4.pdb,2975,171,184,202 +2989,579,596,MGIKLPTLEDLREISKQFNLDLEDEELKSFLQLLKLQLESYERLDSLPDYTPRVKYQRTLGRPPMKEENPYGALVWITSIKGKEEGKLKGKRICIKDNVMIAGIPMLNGSKMLEGFVPHMDATVVSRILDEAGEIVAKTTCEDLCFSGGSHTSYPWPVLNPRNPEYMAGGSSSGSAVAVASGYCDMAVGGDQGGSIRIPSSWVGIYGLKPTHGLVPYTGAFSIEPTLDHLGPMANTVKDVALLLEVIAGRDELDSRQPDSLPPPPVKPYSKLIDGDVKDMKVGIVKEGFNWSNSEKDVDELVLDSAKKLEDYGIKVEDTSIPLHRMGLDIWTPIAIEGATATMILGSGVGWGRKGLFETQIADFFGNSLKSRARDLPNTVKGVLMLGYLMIKMYNNRYYAKARNLSIVLKEAYDSALRKYDALIMPTTPMKAMRYKSEPGFDEYFIMALGMINNTAPFDVTGHPAMNIPVGYSNGLPVGLMIIGRHFEEDKVLKLANVFERIKK,brenda,P95896,C=C(C)C(=N)O,0.3,70.0,5.0,3.5.1.4,2287.0,-0.5228787452803376,-0.2218487496163564,C=C(C)C(=N)O__MGIKLPTLEDLREISKQFNLDLEDEELKSFLQLLKLQLESYERLDSLPDYTPRVKYQRTLGRPPMKEENPYGALVWITSIKGKEEGKLKGKRICIKDNVMIAGIPMLNGSKMLEGFVPHMDATVVSRILDEAGEIVAKTTCEDLCFSGGSHTSYPWPVLNPRNPEYMAGGSSSGSAVAVASGYCDMAVGGDQGGSIRIPSSWVGIYGLKPTHGLVPYTGAFSIEPTLDHLGPMANTVKDVALLLEVIAGRDELDSRQPDSLPPPPVKPYSKLIDGDVKDMKVGIVKEGFNWSNSEKDVDELVLDSAKKLEDYGIKVEDTSIPLHRMGLDIWTPIAIEGATATMILGSGVGWGRKGLFETQIADFFGNSLKSRARDLPNTVKGVLMLGYLMIKMYNNRYYAKARNLSIVLKEAYDSALRKYDALIMPTTPMKAMRYKSEPGFDEYFIMALGMINNTAPFDVTGHPAMNIPVGYSNGLPVGLMIIGRHFEEDKVLKLANVFERIKK,./data/raw/alphafold//AF-P95896-F1-model_v4.pdb,3096,351,401,481 +2990,4413,4482,MTNIRVAIVGYGNLGRSVEKLIAKQPDMDLVGIFSRRATLDTKTPVFDVADVDKHADDVDVLFLCMGSATDIPEQAPKFAQFACTVDTYDNHRDIPRHRQVMNEAATAAGNVALVSTGWDPGMFSINRVYAAAVLAEHQQHTFWGPGLSQGHSDALRRIPGVQKAVQYTLPSEDALEKARRGEAGDLTGKQTHKRQCFVVADAADHERIENDIRTMPDYFVGYEVEVNFIDEATFDSEHTGMPHGGHVITTGDTGGFNHTVEYILKLDRNPDFTASSQIAFGRAAHRMKQQGQSGAFTVLEVAPYLLSPENLDDLIARDV,brenda,P04964,CC(C)C(=O)C(=O)O,97.88,30.0,8.45,1.4.1.16,1718.0,1.990693960679752,1.990693960679752,CC(C)C(=O)C(=O)O__MTNIRVAIVGYGNLGRSVEKLIAKQPDMDLVGIFSRRATLDTKTPVFDVADVDKHADDVDVLFLCMGSATDIPEQAPKFAQFACTVDTYDNHRDIPRHRQVMNEAATAAGNVALVSTGWDPGMFSINRVYAAAVLAEHQQHTFWGPGLSQGHSDALRRIPGVQKAVQYTLPSEDALEKARRGEAGDLTGKQTHKRQCFVVADAADHERIENDIRTMPDYFVGYEVEVNFIDEATFDSEHTGMPHGGHVITTGDTGGFNHTVEYILKLDRNPDFTASSQIAFGRAAHRMKQQGQSGAFTVLEVAPYLLSPENLDDLIARDV,./data/raw/alphafold//AF-P04964-F1-model_v4.pdb,3384,821,983,1203 +2991,24596,24985,MLPHPLAILSEEETNIARNVILAQHPNTVIDFREIYLSEPPKAQLLEFLALEHSGRLSPTSPRPPRLALCQYDVIGNDRIPSFEESVVDVGTRQRVQHRVVGKEHHASLTLSEFDTLVERCFASPLFQKALADFDLPEGFEVVIEPWPYGGLDYVEEKRRYFQGLCFATDKRKNNPDANFYSYPLPLIPVMDALTQEIIRVDRPATGGKGEGLTEQTFKRDIIGHCKDSDYVPELNPGGTRKDLKPLNVVQPEGPSFRITEESLVEWQKWRFRVAFNPREGATIHDVWYDGRSVLYRLSVSEMTVPYADPRPPFHRKQAFDFGDGGGGNMANNLSIGCDCLGVIKYFDAVMTGADGSAKKMPNAICLHEQDNGIGWKHSNWRTGRAVVTRHRELVVQFIITLANYEYIFAYKFDQSGGITVESRATGILNVVNIDAGKVSEYGNVVSGGVLAQNHQHIFCVRIDPAIDGPNNSVQVEESHPVPMNAVTNPNGNFYKVNTETMERAGFFDAAPELNRTVKMVNPHKKNPISQKPVGYKFIPLATQRLLADPNSIQARRAQFAQHHVWVTKYRDGELYAGGRYTLQSQEEIEGVSDAVKRGDSVVDTDVVVWSTFGITHNPRVEDWPVMPVEIFQLMIRPADFFTANPSLDVPSDKNISSRVVGNDCCRNAHI,brenda,Q12556,NCCc1c[nH]c2ccccc12,0.1,37.0,5.5,1.4.3.22,5061.0,-1.0,-1.0,NCCc1c[nH]c2ccccc12__MLPHPLAILSEEETNIARNVILAQHPNTVIDFREIYLSEPPKAQLLEFLALEHSGRLSPTSPRPPRLALCQYDVIGNDRIPSFEESVVDVGTRQRVQHRVVGKEHHASLTLSEFDTLVERCFASPLFQKALADFDLPEGFEVVIEPWPYGGLDYVEEKRRYFQGLCFATDKRKNNPDANFYSYPLPLIPVMDALTQEIIRVDRPATGGKGEGLTEQTFKRDIIGHCKDSDYVPELNPGGTRKDLKPLNVVQPEGPSFRITEESLVEWQKWRFRVAFNPREGATIHDVWYDGRSVLYRLSVSEMTVPYADPRPPFHRKQAFDFGDGGGGNMANNLSIGCDCLGVIKYFDAVMTGADGSAKKMPNAICLHEQDNGIGWKHSNWRTGRAVVTRHRELVVQFIITLANYEYIFAYKFDQSGGITVESRATGILNVVNIDAGKVSEYGNVVSGGVLAQNHQHIFCVRIDPAIDGPNNSVQVEESHPVPMNAVTNPNGNFYKVNTETMERAGFFDAAPELNRTVKMVNPHKKNPISQKPVGYKFIPLATQRLLADPNSIQARRAQFAQHHVWVTKYRDGELYAGGRYTLQSQEEIEGVSDAVKRGDSVVDTDVVVWSTFGITHNPRVEDWPVMPVEIFQLMIRPADFFTANPSLDVPSDKNISSRVVGNDCCRNAHI,./data/raw/alphafold//AF-Q12556-F1-model_v4.pdb,5409,3191,3934,4581 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+3008,26247,26693,MKPDETPMFDPSLLKEVDWSQNTATFSPAISPTHPGEGLVLRPLCTADLNRGFFKVLGQLTETGVVSPEQFMKSFEHMKKSGDYYVTVVEDVTLGQIVATATLIIEHKFIHSCAKRGRVEDVVVSDECRGKQLGKLLLSTLTLLSKKLNCYKITLECLPQNVGFYKKFGYTVSEENYMCRRFLK,brenda,Q96EK6,N[C@H]1C(O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O,0.2,37.0,8.0,2.3.1.4,9606.0,-0.6989700043360187,-0.856099135034887,N[C@H]1C(O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O__MKPDETPMFDPSLLKEVDWSQNTATFSPAISPTHPGEGLVLRPLCTADLNRGFFKVLGQLTETGVVSPEQFMKSFEHMKKSGDYYVTVVEDVTLGQIVATATLIIEHKFIHSCAKRGRVEDVVVSDECRGKQLGKLLLSTLTLLSKKLNCYKITLECLPQNVGFYKKFGYTVSEENYMCRRFLK,./data/raw/alphafold//AF-Q96EK6-F1-model_v4.pdb,1177,1319,2065,1967 +3009,26701,27158,MQACCGGNSMASLQQPGRVQGSVFPPIMPPVTKFSQQLKFNISKPFRSSFLKRNLVSEMRASSVSLPNVEISSKEIPFEDYGLGEVDPEVRTIITKEKDRQFRSLELIASENFTSRAVMEAVGSCLTNKYSEGLPGKRYYGGNEYIDQLETLCQNRALAAFRLDSTKWGVNVQPLSGSPANFAVYTAILSPHDRIMGLDLPHGGHLSHGFMTAKRRVSGTSIYFESMPYRLDESTGIVDYDMLEKTATLFRPKLIIAGASAYSRDFDYPRMRKIADSVGAFLMMDMAHISGLVAASVVADPFEYCDIVTTTTHKSLRGPRGGMIFFRKDPINGVDLESAVNNAVFPGLQGGPHNHTIGGLAVCLKHAQSPEFKAYQKRVVSNCRALANRLVELGFKLVSGGSDNHLVLVDLRPMGMDGARVEKILDMASITLNKNSVPGDKSALVPGGIRIGSPAMTTRGLSEKDFVVVADFIKEGVEITMEAKKAAPGSKLQDFNKFVTSPEFPLKERVKSLKERVETFTSRFPIPGV,sabio,Q94JQ3,Nc1nc2c(c(=O)[nH]1)N[C@@H](CNc1ccc(C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)cc1)CN2,0.00069,30.0,8.5,2.1.2.1,3702.0,-3.161150909262745,-3.161150909262745,Nc1nc2c(c(=O)[nH]1)N[C@@H](CNc1ccc(C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)cc1)CN2__MQACCGGNSMASLQQPGRVQGSVFPPIMPPVTKFSQQLKFNISKPFRSSFLKRNLVSEMRASSVSLPNVEISSKEIPFEDYGLGEVDPEVRTIITKEKDRQFRSLELIASENFTSRAVMEAVGSCLTNKYSEGLPGKRYYGGNEYIDQLETLCQNRALAAFRLDSTKWGVNVQPLSGSPANFAVYTAILSPHDRIMGLDLPHGGHLSHGFMTAKRRVSGTSIYFESMPYRLDESTGIVDYDMLEKTATLFRPKLIIAGASAYSRDFDYPRMRKIADSVGAFLMMDMAHISGLVAASVVADPFEYCDIVTTTTHKSLRGPRGGMIFFRKDPINGVDLESAVNNAVFPGLQGGPHNHTIGGLAVCLKHAQSPEFKAYQKRVVSNCRALANRLVELGFKLVSGGSDNHLVLVDLRPMGMDGARVEKILDMASITLNKNSVPGDKSALVPGGIRIGSPAMTTRGLSEKDFVVVADFIKEGVEITMEAKKAAPGSKLQDFNKFVTSPEFPLKERVKSLKERVETFTSRFPIPGV,./data/raw/alphafold//AF-Q94JQ3-F1-model_v4.pdb,4447,5484,1655,7553 +3010,16394,16635,MDSISLRVALNDGNFIPVLGFGTTVPEKVAKDEVIKATKIAIDNGFRHFDSAYLYEVEEEVGQAIRSKIEDGTVKREDIFYTSKLWSTFHRPELVRTCLEKTLKSTQLDYVDLYIIHFPMALQPGDIFFPRDEHGKLLFETVDICDTWEAMEKCKDAGLAKSIGVSNFNCRQLERILNKPGLKYKPVCNQVECHLYLNQSKMLDYCKSKDIILVSYCTLGSSRDKTWVDQKSPVLLDDPVLCAIAKKYKQTPALVALRYQLQRGVVPLIRSFNAKRIKELTQVFEFQLASEDMKALDGLNRNFRYNNAKYFDDHPNHPFTDE,sabio,P23457,C[C@]12CCC(=O)CC1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO,0.01,,7.4,1.1.1.213,10116.0,-2.0,-2.0,C[C@]12CCC(=O)CC1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO__MDSISLRVALNDGNFIPVLGFGTTVPEKVAKDEVIKATKIAIDNGFRHFDSAYLYEVEEEVGQAIRSKIEDGTVKREDIFYTSKLWSTFHRPELVRTCLEKTLKSTQLDYVDLYIIHFPMALQPGDIFFPRDEHGKLLFETVDICDTWEAMEKCKDAGLAKSIGVSNFNCRQLERILNKPGLKYKPVCNQVECHLYLNQSKMLDYCKSKDIILVSYCTLGSSRDKTWVDQKSPVLLDDPVLCAIAKKYKQTPALVALRYQLQRGVVPLIRSFNAKRIKELTQVFEFQLASEDMKALDGLNRNFRYNNAKYFDDHPNHPFTDE,./data/raw/alphafold//AF-P23457-F1-model_v4.pdb,2022,202,1065,1310 +3011,17467,17721,MWGLKVLLLPVVSFALYPEEILDTHWELWKKTHRKQYNNKVDEISRRLIWEKNLKYISIHNLEASLGVHTYELAMNHLGDMTSEEVVQKMTGLKVPLSHSRSNDTLYIPEWEGRAPDSVDYRKKGYVTPVKNQGQCGSCWAFSSVGALEGQLKKKTGKLLNLSPQNLVDCVSENDGCGGGYMTNAFQYVQKNRGIDSEDAYPYVGQEESCMYNPTGKAAKCRGYREIPEGNEKALKRAVARVGPVSVAIDASLTSFQFYSKGVYYDESCNSDNLNHAVLAVGYGIQKGNKHWIIKNSWGENWGNKGYILMARNKNNACGIANLASFPKM,uniprot_search,P43235,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCNC(=N)N)N=C(O)OCc3ccccc3)ccc12,0.023,26.0,5.53,3.4.22.38,9606.0,-1.6382721639824072,-1.6382721639824072,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCNC(=N)N)N=C(O)OCc3ccccc3)ccc12__MWGLKVLLLPVVSFALYPEEILDTHWELWKKTHRKQYNNKVDEISRRLIWEKNLKYISIHNLEASLGVHTYELAMNHLGDMTSEEVVQKMTGLKVPLSHSRSNDTLYIPEWEGRAPDSVDYRKKGYVTPVKNQGQCGSCWAFSSVGALEGQLKKKTGKLLNLSPQNLVDCVSENDGCGGGYMTNAFQYVQKNRGIDSEDAYPYVGQEESCMYNPTGKAAKCRGYREIPEGNEKALKRAVARVGPVSVAIDASLTSFQFYSKGVYYDESCNSDNLNHAVLAVGYGIQKGNKHWIIKNSWGENWGNKGYILMARNKNNACGIANLASFPKM,./data/raw/alphafold//AF-P43235-F1-model_v4.pdb,847,4242,5677,3535 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+3013,27003,27467,MRILLSNDDGVHAPGIQTLAKALREFADVQVVAPDRNRSGASNSLTLESSLRTFTFENGDIAVQMGTPTDCVYLGVNALMRPRPDIVVSGINAGPNLGDDVIYSGTVAAAMEGRHLGFPALAVSLDGHKHYDTAAAVTCSILRALCKEPLRTGRILNINVPDLPLDQIKGIRVTRCGTRHPADQVIPQQDPRGNTLYWIGPPGGKCDAGPGTDFAAVDEGYVSITPLHVDLTAHSAQDVVSDWLNSVGVGTQW,sabio,P0A840,Nc1ncnc2c1ncn2C1OC(CO)C(OP(=O)(O)O)C1O,0.1,37.0,7.0,3.1.3.6,562.0,-1.0,-1.0,Nc1ncnc2c1ncn2C1OC(CO)C(OP(=O)(O)O)C1O__MRILLSNDDGVHAPGIQTLAKALREFADVQVVAPDRNRSGASNSLTLESSLRTFTFENGDIAVQMGTPTDCVYLGVNALMRPRPDIVVSGINAGPNLGDDVIYSGTVAAAMEGRHLGFPALAVSLDGHKHYDTAAAVTCSILRALCKEPLRTGRILNINVPDLPLDQIKGIRVTRCGTRHPADQVIPQQDPRGNTLYWIGPPGGKCDAGPGTDFAAVDEGYVSITPLHVDLTAHSAQDVVSDWLNSVGVGTQW,./data/raw/alphafold//AF-P0A840-F1-model_v4.pdb,973,4417,5876,3242 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+3043,37636,38301,MSSGRTVTLNTGYKIPQIGYGTWQAAPGEVGAGVFEALKVGYRHLDLAKVYGNQKEVGEGIKKALAEVPGLKREDIFITSKLWNNSHKPEDVEPALDDTLAELGLDYLDLYLIHWPVAFAPGADLFPKSEDGSEVQLNQNVSIVQTWKAMTELPKSKVRSVGVSNFTIEHLDAVIEATGVVPAVNQIERHPRLPNQPLIDYCAKKGIIITAYSAFGNNTKGLPLLVSSDEVKAVADNLSKKQGKTVTPAQVILAWSQIGGHTVIPKSVTKARIAENFQEVELDDEAIAALNKLGEKPQRFNIPYTYKPRWNINLFNTEEEKAAAHTAVIKL,sabio,Q0GYU5,OC1COC(O)C(O)C1O,334.0,30.0,7.0,1.1.1.72,51453.0,2.523746466811565,2.523746466811565,OC1COC(O)C(O)C1O__MSSGRTVTLNTGYKIPQIGYGTWQAAPGEVGAGVFEALKVGYRHLDLAKVYGNQKEVGEGIKKALAEVPGLKREDIFITSKLWNNSHKPEDVEPALDDTLAELGLDYLDLYLIHWPVAFAPGADLFPKSEDGSEVQLNQNVSIVQTWKAMTELPKSKVRSVGVSNFTIEHLDAVIEATGVVPAVNQIERHPRLPNQPLIDYCAKKGIIITAYSAFGNNTKGLPLLVSSDEVKAVADNLSKKQGKTVTPAQVILAWSQIGGHTVIPKSVTKARIAENFQEVELDDEAIAALNKLGEKPQRFNIPYTYKPRWNINLFNTEEEKAAAHTAVIKL,./data/raw/alphafold//AF-Q0GYU5-F1-model_v4.pdb,2022,852,1024,1258 +3044,13260,13454,MFKTTLCALLITASCSTFAAPQQINDIVHRTITPLIEQQKIPGMAVAVIYQGKPYYFTWGYADIAKKQPVTQQTLFELGSVSKTFTGVLGGDAIARGEIKLSDPTTKYWPELTAKQWNGITLLHLATYTAGGLPLQVPDEVKSSSDLLRFYQNWQPAWAPGTQRLYANSSIGLFGALAVKPSGLSFEQAMQTRVFQPLKLNHTWINVPPAEEKNYAWGYREGKAVHVSPGALDAEAYGVKSTIEDMARWVQSNLKPLDINEKTLQQGIQLAQSRYWQTGDMYQGLGWEMLDWPVNPDSIINGSDNKIALAARPVKAITPPTPAVRASWVHKTGATGGFGSYVAFIPEKELGIVMLANKNYPNPARVDAAWQILNALQ,sabio,P00811,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1,0.0017,,8.2,3.5.2.6,562.0,-2.7695510786217263,-2.915015913001554,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1__MFKTTLCALLITASCSTFAAPQQINDIVHRTITPLIEQQKIPGMAVAVIYQGKPYYFTWGYADIAKKQPVTQQTLFELGSVSKTFTGVLGGDAIARGEIKLSDPTTKYWPELTAKQWNGITLLHLATYTAGGLPLQVPDEVKSSSDLLRFYQNWQPAWAPGTQRLYANSSIGLFGALAVKPSGLSFEQAMQTRVFQPLKLNHTWINVPPAEEKNYAWGYREGKAVHVSPGALDAEAYGVKSTIEDMARWVQSNLKPLDINEKTLQQGIQLAQSRYWQTGDMYQGLGWEMLDWPVNPDSIINGSDNKIALAARPVKAITPPTPAVRASWVHKTGATGGFGSYVAFIPEKELGIVMLANKNYPNPARVDAAWQILNALQ,./data/raw/alphafold//AF-P00811-F1-model_v4.pdb,4913,1658,2507,1693 +3045,14009,14210,MKAARLHEYNKPLRIEDVDYPRLEGRFDVIVRIAGAGVCHTDLHLVQGMWHELLQPKLPYTLGHENVGYIEEVAEGVEGLEKGDPVILHPAVTDGTCLACRAGEDMHCENLEFPGLNIDGGFAEFMRTSHRSVIKLPKDISREKLVEMAPLADAGITAYRAVKKAARTLYPGAYVAIVGVGGLGHIAVQLLKVMTPATVIALDVKEEKLKLAERLGADHVVDARRDPVKQVMELTRGRGVNVAMDFVGSQATVDYTPYLLGRMGRLIIVGYGGELRFPTIRVISSEVSFEGSLVGNYVELHELVTLALQGKVRVEVDIHKLDEINDVLERLEKGEVLGRAVLIP,brenda,Q9Y9P9,COc1ccc(CO)cc1,1.13,60.0,8.0,1.1.1.1,56636.0,0.0530784434834196,0.0530784434834196,COc1ccc(CO)cc1__MKAARLHEYNKPLRIEDVDYPRLEGRFDVIVRIAGAGVCHTDLHLVQGMWHELLQPKLPYTLGHENVGYIEEVAEGVEGLEKGDPVILHPAVTDGTCLACRAGEDMHCENLEFPGLNIDGGFAEFMRTSHRSVIKLPKDISREKLVEMAPLADAGITAYRAVKKAARTLYPGAYVAIVGVGGLGHIAVQLLKVMTPATVIALDVKEEKLKLAERLGADHVVDARRDPVKQVMELTRGRGVNVAMDFVGSQATVDYTPYLLGRMGRLIIVGYGGELRFPTIRVISSEVSFEGSLVGNYVELHELVTLALQGKVRVEVDIHKLDEINDVLERLEKGEVLGRAVLIP,./data/raw/alphafold//AF-Q9Y9P9-F1-model_v4.pdb,3444,919,1109,1366 +3046,27120,27584,MSLSNKLTLDKLDVKGKRVVMRVDFNVPMKNNQITNNQRIKAAVPSIKFCLDNGAKSVVLMSHLGRPDGVPMPDKYSLEPVAAELKSLLGKDVLFLKDCVGSEVENACANPAAGTVILLENLRFHVEEEGKGKDASGNKVKAEPAKIDAFRASLSKLGDVYVNDAFGTAHRAHSSMVGVNLPQKAGGFLMKKELNYFAKALESPERPFLAILGGAKVADKIQLINNMLDKVNEMIIGGGMAFTFLKVLNNMEIGTSLYDEEGAKIVKDLMAKAEKNGVKITLPVDFVTADKFDENAKTGQATVASGIPAGWMGLDCGTESSKKYAEAVARAKQIVWNGPVGVFEWEAFARGTKSLMDEVVKATSRGCITIIGGGDTATCCAKWNTEDKVSHVSTGGGASLELLEGKVLPGVDALSNV,sabio,P16617,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,0.008,38.0,7.2,2.7.2.3,10116.0,-2.096910013008056,-0.5276922057461443,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O__MSLSNKLTLDKLDVKGKRVVMRVDFNVPMKNNQITNNQRIKAAVPSIKFCLDNGAKSVVLMSHLGRPDGVPMPDKYSLEPVAAELKSLLGKDVLFLKDCVGSEVENACANPAAGTVILLENLRFHVEEEGKGKDASGNKVKAEPAKIDAFRASLSKLGDVYVNDAFGTAHRAHSSMVGVNLPQKAGGFLMKKELNYFAKALESPERPFLAILGGAKVADKIQLINNMLDKVNEMIIGGGMAFTFLKVLNNMEIGTSLYDEEGAKIVKDLMAKAEKNGVKITLPVDFVTADKFDENAKTGQATVASGIPAGWMGLDCGTESSKKYAEAVARAKQIVWNGPVGVFEWEAFARGTKSLMDEVVKATSRGCITIIGGGDTATCCAKWNTEDKVSHVSTGGGASLELLEGKVLPGVDALSNV,./data/raw/alphafold//AF-P16617-F1-model_v4.pdb,1334,6443,2815,7879 +3047,36283,36914,MNGTVKVNEVIGRISKHIYGHFQEHLGRGIYDGIWVGKDSEIDHVEGIRTDVLKALQALHIPVLRWPGGCFADEYHWANGVGDLSERKPMVNTHWGGTVESNAFGTHEFMRLCELLECEPYICGNVGSGSVQELAEWIEYITFPKGTPMSDWRIQNGKQEPWELTYVGVGNESWGCGGNMTPEYYADLYKRYQTYVREFAGQRIYKIACGANSNDVNWTKVLMERAAPWMDGLSLHYYTVPGTWEKKGSATDFDEDEWFTTLKKASEMERLVVDHGEIMDRYDPDKRIGMIIDEWGTWYDPEPGTNPGFLYQQNTLRDALVCALHFHIFHRHCLRIHMANIAQTVNVLQAMVLTQDEKMLLTPTYHVFHMFQVHQEEEALEVELNAPSYERRGEKIPQVSVSASRSSDKMHISLCHVNPHEKADVSLAIEGIDAKTKVTGRVLTADRMNAHNTFDDPHSVQPEDFRQFAVKHGELTIDLPPMSVVMLTVDLA,brenda,Q2MJP5,O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)cc1,1.05,37.0,6.4,3.2.1.55,1408.0,0.021189299069938,0.021189299069938,O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)cc1__MNGTVKVNEVIGRISKHIYGHFQEHLGRGIYDGIWVGKDSEIDHVEGIRTDVLKALQALHIPVLRWPGGCFADEYHWANGVGDLSERKPMVNTHWGGTVESNAFGTHEFMRLCELLECEPYICGNVGSGSVQELAEWIEYITFPKGTPMSDWRIQNGKQEPWELTYVGVGNESWGCGGNMTPEYYADLYKRYQTYVREFAGQRIYKIACGANSNDVNWTKVLMERAAPWMDGLSLHYYTVPGTWEKKGSATDFDEDEWFTTLKKASEMERLVVDHGEIMDRYDPDKRIGMIIDEWGTWYDPEPGTNPGFLYQQNTLRDALVCALHFHIFHRHCLRIHMANIAQTVNVLQAMVLTQDEKMLLTPTYHVFHMFQVHQEEEALEVELNAPSYERRGEKIPQVSVSASRSSDKMHISLCHVNPHEKADVSLAIEGIDAKTKVTGRVLTADRMNAHNTFDDPHSVQPEDFRQFAVKHGELTIDLPPMSVVMLTVDLA,./data/raw/alphafold//AF-Q2MJP5-F1-model_v4.pdb,2443,8040,9893,11071 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+3049,9158,9306,MLRSRFPASHHFTVSVFGCQYHSEAPSVEKTELIGRFDKLIDSAAIHVEHLEQNDVPSKIWMSYWESPQKFKQWWEKDDTASFWASLPDDAGFWRETFSLPATRAMYEGTGKDAYGFGHCGSLIPLTTKTGYWGAYRSRMTPDFEGDTFSSPIPTYADQSVPADKIRPGRVRITDFPDNLCMVVEGQHYADMGEREREYWNENFDGLTKQWVTNVVTAGHEQGMVIARACHGFAGEKKLGATNGPVNGIFPGLDYVHQAQILIWQDISKMEHIGRYDQTHVKLRRDFMKAYGPGGEMEGGDLLLWVDLGILKKDEIDAEYVGCYESTGFLKLDKGQFFKVESTAGSKLPSFFDEPIESKPIEW,brenda,Q2WG72,CCCC/C=N/O,10.1,25.0,5.5,4.8.1.4,5518.0,1.0043213737826426,1.0043213737826426,CCCC/C=N/O__MLRSRFPASHHFTVSVFGCQYHSEAPSVEKTELIGRFDKLIDSAAIHVEHLEQNDVPSKIWMSYWESPQKFKQWWEKDDTASFWASLPDDAGFWRETFSLPATRAMYEGTGKDAYGFGHCGSLIPLTTKTGYWGAYRSRMTPDFEGDTFSSPIPTYADQSVPADKIRPGRVRITDFPDNLCMVVEGQHYADMGEREREYWNENFDGLTKQWVTNVVTAGHEQGMVIARACHGFAGEKKLGATNGPVNGIFPGLDYVHQAQILIWQDISKMEHIGRYDQTHVKLRRDFMKAYGPGGEMEGGDLLLWVDLGILKKDEIDAEYVGCYESTGFLKLDKGQFFKVESTAGSKLPSFFDEPIESKPIEW,./data/raw/alphafold//AF-Q2WG72-F1-model_v4.pdb,3318,695,822,996 +3050,901,928,MSSPISKSRSLAAFLQQLRSPRQPPRLVTSTAYTSPQPREVPVCPLTAGGETQNAAALPGPTSWPLLGSLLQILWKGGLKKQHDTLVEYHKKYGKIFRMKLGSFESVHLGSPCLLEALYRTESAYPQRLEIKPWKAYRDYRKEGYGLLILEGEDWQRVRSAFQKKLMKPGEVMKLDNKINEVLADFMGRIDELCDERGHVEDLYSELNKWSFESICLVLYEKRFGLLQKNAGDEAVNFIMAIKTMMSTFGRMMVTPVELHKSLNTKVWQDHTLAWDTIFKSVKACIDNRLEKYSQQPSADFLCDIYHQNRLSKKELYAAVTELQLAAVETTANSLMWILYNLSRNPQVQQKLLKEIQSVLPENQVPRAEDLRNMPYLKACLKESMRLTPSVPFTTRTLDKATVLGEYALPKGTVLMLNTQVLGSSEDNFEDSSQFRPERWLQEKEKINPFAHLPFGVGKRMCIGRRLAELQLHLALCWIVRKYDIQATDNEPVEMLHSGTLVPSRELPIAFCQR,uniprot_search,Q07973,C=C1/C(=C\C=C2/CCC[C@@]3(C)C2CC[C@@H]3[C@H](C)CCCC(C)(C)O)C[C@@H](O)C[C@@H]1O,6e-05,37.0,7.5,1.14.15.16,9606.0,-4.221848749616356,-4.221848749616356,C=C1/C(=C\C=C2/CCC[C@@]3(C)C2CC[C@@H]3[C@H](C)CCCC(C)(C)O)C[C@@H](O)C[C@@H]1O__MSSPISKSRSLAAFLQQLRSPRQPPRLVTSTAYTSPQPREVPVCPLTAGGETQNAAALPGPTSWPLLGSLLQILWKGGLKKQHDTLVEYHKKYGKIFRMKLGSFESVHLGSPCLLEALYRTESAYPQRLEIKPWKAYRDYRKEGYGLLILEGEDWQRVRSAFQKKLMKPGEVMKLDNKINEVLADFMGRIDELCDERGHVEDLYSELNKWSFESICLVLYEKRFGLLQKNAGDEAVNFIMAIKTMMSTFGRMMVTPVELHKSLNTKVWQDHTLAWDTIFKSVKACIDNRLEKYSQQPSADFLCDIYHQNRLSKKELYAAVTELQLAAVETTANSLMWILYNLSRNPQVQQKLLKEIQSVLPENQVPRAEDLRNMPYLKACLKESMRLTPSVPFTTRTLDKATVLGEYALPKGTVLMLNTQVLGSSEDNFEDSSQFRPERWLQEKEKINPFAHLPFGVGKRMCIGRRLAELQLHLALCWIVRKYDIQATDNEPVEMLHSGTLVPSRELPIAFCQR,./data/raw/alphafold//AF-Q07973-F1-model_v4.pdb,3219,545,635,748 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+3248,35490,36112,MARHVFLTGPPGVGKTTLIQKATEVLKSSGMPVDGFYTEEVRQGGRRIGFDVVTLSGIRGPLSRIGSEPLPGKRECRVGQYVVDLTSFEQLALPVLRNAGASGRPGQSICVIDEVGKMELFSQPFIQAVRQVLSIPGTVVLGTIPVPKGKPLALVEEIRTRKDVKVFSVTKENRNHLLPEIVTHMQSSRK,uniprot_search,Q1LZ78,O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O,0.025,34.0,7.5,3.6.1.15,9913.0,-1.6020599913279625,-1.6020599913279625,O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O__MARHVFLTGPPGVGKTTLIQKATEVLKSSGMPVDGFYTEEVRQGGRRIGFDVVTLSGIRGPLSRIGSEPLPGKRECRVGQYVVDLTSFEQLALPVLRNAGASGRPGQSICVIDEVGKMELFSQPFIQAVRQVLSIPGTVVLGTIPVPKGKPLALVEEIRTRKDVKVFSVTKENRNHLLPEIVTHMQSSRK,./data/raw/alphafold//AF-Q1LZ78-F1-model_v4.pdb,4399,5417,6116,7455 +3249,37828,38498,MSPSAVDDAPKATGAAISVKPNIGVFTNPKHDLWISEAEPSADAVKSGADLKPGEVTIAVRSTGICGSDVHFWHAGCIGPMIVEGDHILGHESAGEVIAVHPTVSSLQIGDRVAIEPNIICNACEPCLTGRYNGCEKVEFLSTPPVPGLLRRYVNHPAVWCHKIGNMSWENGALLEPLSVALAGMQRAKVQLGDPVLVCGAGPIGLVSMLCAAAAGACPLVITDISESRLAFAKEICPRVTTHRIEIGKSAEETAKSIVSSFGGVEPAVTLECTGVESSIAAAIWASKFGGKVFVIGVGKNEISIPFMRASVREVDIQLQYRYSNTWPRAIRLIESGVIDLSKFVTHRFPLEDAVKAFETSADPKSGAIKVMIQSLD,sabio,Q96V44,OCC1(O)OCC(O)C(O)C1O,19.0,25.0,7.0,1.1.1.12,51453.0,1.2787536009528289,1.74931215339503,OCC1(O)OCC(O)C(O)C1O__MSPSAVDDAPKATGAAISVKPNIGVFTNPKHDLWISEAEPSADAVKSGADLKPGEVTIAVRSTGICGSDVHFWHAGCIGPMIVEGDHILGHESAGEVIAVHPTVSSLQIGDRVAIEPNIICNACEPCLTGRYNGCEKVEFLSTPPVPGLLRRYVNHPAVWCHKIGNMSWENGALLEPLSVALAGMQRAKVQLGDPVLVCGAGPIGLVSMLCAAAAGACPLVITDISESRLAFAKEICPRVTTHRIEIGKSAEETAKSIVSSFGGVEPAVTLECTGVESSIAAAIWASKFGGKVFVIGVGKNEISIPFMRASVREVDIQLQYRYSNTWPRAIRLIESGVIDLSKFVTHRFPLEDAVKAFETSADPKSGAIKVMIQSLD,./data/raw/alphafold//AF-Q96V44-F1-model_v4.pdb,3001,5191,7109,7274 +3250,34609,35216,MASTVDSNFFSSVPALHSNLGLLSPDQIELAKILLENGQSHLFQQWPELGVDDKEKLAFFDQIARLNSSYPGGLAAYIKTAKELLADSKVGKNPYDGFSPSVPSGENLTFGTDNFIEMEKRGVVEARNAAFVLVAGGLGERLGYNGIKVALPRETTTGTCFLQHYIESILALQEASNKIDSDGSERDIPFIIMTSDDTHSRTLDLLELNSYFGMKPTQVHLLKQEKVACLDDNDARLALDPHNKYSIQTKPHGHGDVHSLLYSSGLLHKWLEAGLKWVLFFQDTNGLLFNAIPASLGVSATKQYHVNSLAVPRKAKEAIGGISKLTHVDGRSMVINVEYNQLDPLLRASGFPDGDVNCETGFSPFPGNINQLILELGPYKDELQKTGGAIKEFVNPKYKDSTKTAFKSSTRLECMMQDYPKTLPPTARVGFTVMDIWLAYAPVKNNPEDAAKVPKGNPYHSATSGEMAIYRANSLILQKAGVKVEEPVKQVLNGQEVEVWSRITWKPKWGMIFSDIKKKVSGNCEVSQRSTMAIKGRNVFIKDLSLDGALIVDSIDDAEVKLGGLIKNNGWTMESVDYKDTSVPEEIRIRGFRFNKVEQLEKKLTQPGKFSVED,brenda,Q9C5I1,O=P(O)(O)OC1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,0.27,35.0,8.0,2.7.7.64,3702.0,-0.5686362358410126,-0.5686362358410126,O=P(O)(O)OC1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O__MASTVDSNFFSSVPALHSNLGLLSPDQIELAKILLENGQSHLFQQWPELGVDDKEKLAFFDQIARLNSSYPGGLAAYIKTAKELLADSKVGKNPYDGFSPSVPSGENLTFGTDNFIEMEKRGVVEARNAAFVLVAGGLGERLGYNGIKVALPRETTTGTCFLQHYIESILALQEASNKIDSDGSERDIPFIIMTSDDTHSRTLDLLELNSYFGMKPTQVHLLKQEKVACLDDNDARLALDPHNKYSIQTKPHGHGDVHSLLYSSGLLHKWLEAGLKWVLFFQDTNGLLFNAIPASLGVSATKQYHVNSLAVPRKAKEAIGGISKLTHVDGRSMVINVEYNQLDPLLRASGFPDGDVNCETGFSPFPGNINQLILELGPYKDELQKTGGAIKEFVNPKYKDSTKTAFKSSTRLECMMQDYPKTLPPTARVGFTVMDIWLAYAPVKNNPEDAAKVPKGNPYHSATSGEMAIYRANSLILQKAGVKVEEPVKQVLNGQEVEVWSRITWKPKWGMIFSDIKKKVSGNCEVSQRSTMAIKGRNVFIKDLSLDGALIVDSIDDAEVKLGGLIKNNGWTMESVDYKDTSVPEEIRIRGFRFNKVEQLEKKLTQPGKFSVED,./data/raw/alphafold//AF-Q9C5I1-F1-model_v4.pdb,2182,7425,5888,3256 +3251,19128,19404,MGIKLPTLEDLREISKQFNLDLEDEELKSFLQLLKLQLESYERLDSLPDYTPRVKYQRTLGRPPMKEENPYGALVWITSIKGKEEGKLKGKRICIKDNVMIAGIPMLNGSKMLEGFVPHMDATVVSRILDEAGEIVAKTTCEDLCFSGGSHTSYPWPVLNPRNPEYMAGGSSSGSAVAVASGYCDMAVGGDQGGSIRIPSSWVGIYGLKPTHGLVPYTGAFSIEPTLDHLGPMANTVKDVALLLEVIAGRDELDSRQPDSLPPPPVKPYSKLIDGDVKDMKVGIVKEGFNWSNSEKDVDELVLDSAKKLEDYGIKVEDTSIPLHRMGLDIWTPIAIEGATATMILGSGVGWGRKGLFETQIADFFGNSLKSRARDLPNTVKGVLMLGYLMIKMYNNRYYAKARNLSIVLKEAYDSALRKYDALIMPTTPMKAMRYKSEPGFDEYFIMALGMINNTAPFDVTGHPAMNIPVGYSNGLPVGLMIIGRHFEEDKVLKLANVFERIKK,brenda,P95896,N=C(O)/C=C/c1ccccc1,0.000434,95.0,5.0,3.5.1.4,2287.0,-3.362510270487489,-3.362510270487489,N=C(O)/C=C/c1ccccc1__MGIKLPTLEDLREISKQFNLDLEDEELKSFLQLLKLQLESYERLDSLPDYTPRVKYQRTLGRPPMKEENPYGALVWITSIKGKEEGKLKGKRICIKDNVMIAGIPMLNGSKMLEGFVPHMDATVVSRILDEAGEIVAKTTCEDLCFSGGSHTSYPWPVLNPRNPEYMAGGSSSGSAVAVASGYCDMAVGGDQGGSIRIPSSWVGIYGLKPTHGLVPYTGAFSIEPTLDHLGPMANTVKDVALLLEVIAGRDELDSRQPDSLPPPPVKPYSKLIDGDVKDMKVGIVKEGFNWSNSEKDVDELVLDSAKKLEDYGIKVEDTSIPLHRMGLDIWTPIAIEGATATMILGSGVGWGRKGLFETQIADFFGNSLKSRARDLPNTVKGVLMLGYLMIKMYNNRYYAKARNLSIVLKEAYDSALRKYDALIMPTTPMKAMRYKSEPGFDEYFIMALGMINNTAPFDVTGHPAMNIPVGYSNGLPVGLMIIGRHFEEDKVLKLANVFERIKK,./data/raw/alphafold//AF-P95896-F1-model_v4.pdb,3096,351,401,481 +3252,20679,20990,MINMRNRVAIVTGGAMGMGNGCARKLAEAGAKVYLIDRSNLVAAAAQDMREAGLNANHVQVDITDQESLTSAYDGIAAESGRLDVLVNAAGVGDSRMFLDVDDAHYKKVIDVNVRGTWNSCRAAVPHMLSNKHGRIINFGSISGPIVADPGWTVYALSKGAIFGFTKALASEFAGQNILVNAILPGSMDTPMMRAAAADTNPADPQSVIDEIAAAVPLKRLGTIDDAGNLALFLASDLASYLTGQAIVLDGAFTLAEYQSGGLEAPAETPALVN,brenda,A0A545BBS8,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,3.4,25.0,7.8,1.1.1.422,2510797.0,0.5314789170422551,0.5314789170422551,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MINMRNRVAIVTGGAMGMGNGCARKLAEAGAKVYLIDRSNLVAAAAQDMREAGLNANHVQVDITDQESLTSAYDGIAAESGRLDVLVNAAGVGDSRMFLDVDDAHYKKVIDVNVRGTWNSCRAAVPHMLSNKHGRIINFGSISGPIVADPGWTVYALSKGAIFGFTKALASEFAGQNILVNAILPGSMDTPMMRAAAADTNPADPQSVIDEIAAAVPLKRLGTIDDAGNLALFLASDLASYLTGQAIVLDGAFTLAEYQSGGLEAPAETPALVN,./data/raw/alphafold//AF-A0A545BBS8-F1-model_v4.pdb,5550,2301,2910,3362 +3253,7311,7442,MKKLFVLCVCFFCSITAAGAALPDLKIEKLEEGVFVHTSFEEVNGWGVVTKHGLVVLVNTDAYLIDTPFTATDTEKLVNWFVERGYEIKGTISSHFHSDSTGGIEWLNSQSIPTYASELTNELLKKSGKVQAKYSFSEVSYWLVKNKIEVFYPGPGHTQDNLVVWLPESKILFGGCFIKPHGLGNLGDANLEAWPKSAKILMSKYGKAKLVVSSHSEKGDASLMKRTWEQALKGLKESKKTSSPSN,brenda,Q7WYA8,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](C(=O)O)c3ccsc3)C(=O)N2[C@H]1C(=O)O,0.13,37.0,7.5,3.5.2.6,287.0,-0.8860566476931633,-0.8860566476931633,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](C(=O)O)c3ccsc3)C(=O)N2[C@H]1C(=O)O__MKKLFVLCVCFFCSITAAGAALPDLKIEKLEEGVFVHTSFEEVNGWGVVTKHGLVVLVNTDAYLIDTPFTATDTEKLVNWFVERGYEIKGTISSHFHSDSTGGIEWLNSQSIPTYASELTNELLKKSGKVQAKYSFSEVSYWLVKNKIEVFYPGPGHTQDNLVVWLPESKILFGGCFIKPHGLGNLGDANLEAWPKSAKILMSKYGKAKLVVSSHSEKGDASLMKRTWEQALKGLKESKKTSSPSN,./data/raw/alphafold//AF-Q7WYA8-F1-model_v4.pdb,3550,1166,1879,1737 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+3255,20552,20861,MAITVPRRQLFIGGQWTEPVLRKTLPVVNPATEDIIGYIPAATSEDVELAVEAARKAFTRNNGKDWARATGAVRAKYLRAIAAKVIERKSELANLEAIDCGKPLDEAAWDMDDVAGCFEYYADLAEGLDAKQKTPLSLPMDTFKGYILKEPIGVVGMITPWNYPLLMAVWKVAPSLAAGCTAILKPSELASLTCLELADICREVGLPPGVLNILTGLGTEAGAPLASHPHVDKIVFTGSTTTGSSIMTSAAKLVKPVSLELGGKSPIIVFDDVDIDKAVEWTMFGCFWTNGQICSATSRLLVHERIADEFLDKLVKWTKNIKISDPFEEGCRLGPVVSKGQYERVLKFVSNARNEGATVLCGGVRPEHLKKGYFVEPAIVSNVTTSMEIWREEVFGPALCVKTFSTEDEAIQLANDSQYGLAGAVLSNDLERCDRVSKAFQAGIVWVNCSQPCFCQAPWGGTKRSGFGRELGEWGLENYLSVKQVTQYISDEPWGWYKPPSKL,brenda,Q9STS1,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.0736,22.0,9.5,1.2.1.19,3702.0,-1.1331221856625011,-1.1331221856625011,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MAITVPRRQLFIGGQWTEPVLRKTLPVVNPATEDIIGYIPAATSEDVELAVEAARKAFTRNNGKDWARATGAVRAKYLRAIAAKVIERKSELANLEAIDCGKPLDEAAWDMDDVAGCFEYYADLAEGLDAKQKTPLSLPMDTFKGYILKEPIGVVGMITPWNYPLLMAVWKVAPSLAAGCTAILKPSELASLTCLELADICREVGLPPGVLNILTGLGTEAGAPLASHPHVDKIVFTGSTTTGSSIMTSAAKLVKPVSLELGGKSPIIVFDDVDIDKAVEWTMFGCFWTNGQICSATSRLLVHERIADEFLDKLVKWTKNIKISDPFEEGCRLGPVVSKGQYERVLKFVSNARNEGATVLCGGVRPEHLKKGYFVEPAIVSNVTTSMEIWREEVFGPALCVKTFSTEDEAIQLANDSQYGLAGAVLSNDLERCDRVSKAFQAGIVWVNCSQPCFCQAPWGGTKRSGFGRELGEWGLENYLSVKQVTQYISDEPWGWYKPPSKL,./data/raw/alphafold//AF-Q9STS1-F1-model_v4.pdb,5311,5980,7099,5798 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+3344,9154,9302,MEATLNLEPSGRSCWDEPLSIAVRGLAPEQPVTLRSVLRDEKGALFRAHARYRADSHGELDLARTPALGGSFSGLEPMGLLWAMEPDRPFWRLVKRDVQTPFVVELEVLDGHEPDGGQRLAHAVHERHFLAPGVRRVPVREGRVRATLFLPPEPGPFPGIIDLFGVGGGLLEYRASLLAGKGFAVMALAYYNYDDLPKNMETMHMEYFEEAVNYLRSHPEVKGPGIGLLGISKGGELGLAMASFLKGITAAVVINGSVAAVGNTISYKDETIPPVTILRNQVKMTKDGLKDVVDALQSPLVDKKSFIPVERSDTTFLFLVGQDDHNWKSEFYADEISKRLQAHGKEKPQIICYPAAGHYIEPPYFPLCSAGMHLLVGANITFGGEPKPHAMAQLDAWQQLQTFFHKQLGSECLHVSPKI,sabio,O55137,CCCC/C=C\CCCCCCCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.0015,,,3.1.2.2,10090.0,-2.8239087409443187,-2.8239087409443187,CCCC/C=C\CCCCCCCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MEATLNLEPSGRSCWDEPLSIAVRGLAPEQPVTLRSVLRDEKGALFRAHARYRADSHGELDLARTPALGGSFSGLEPMGLLWAMEPDRPFWRLVKRDVQTPFVVELEVLDGHEPDGGQRLAHAVHERHFLAPGVRRVPVREGRVRATLFLPPEPGPFPGIIDLFGVGGGLLEYRASLLAGKGFAVMALAYYNYDDLPKNMETMHMEYFEEAVNYLRSHPEVKGPGIGLLGISKGGELGLAMASFLKGITAAVVINGSVAAVGNTISYKDETIPPVTILRNQVKMTKDGLKDVVDALQSPLVDKKSFIPVERSDTTFLFLVGQDDHNWKSEFYADEISKRLQAHGKEKPQIICYPAAGHYIEPPYFPLCSAGMHLLVGANITFGGEPKPHAMAQLDAWQQLQTFFHKQLGSECLHVSPKI,./data/raw/alphafold//AF-O55137-F1-model_v4.pdb,5371,3117,3663,4246 +3345,4640,4713,MNVFFMFSLLFLATLGSCADDKNPLEECFREDDYEEFLEIAKNGLKKTSNPKHIVIVGAGMSGLSAAYVLAGAGHKVTVLEASERPGGRVRTHRNVKEGWYANLGPMRVPEKHRIIREYIRKFGLKLNEFVQETENGWYFIKNIRKRVGEVKKDPGLLKYPVKPSEAGKSAGQLYQESLGKAVEELKRTNCSYILNKYDTYSTKEYLIKEGNLSPGAVDMIGDLLNEDSGYYVSFIESLKHDDIFAYEKRFDEIVGGMDQLPTSMYRAIEESVHFKARVIKIQQNAEKVTVTYQTTQKNLLLETADYVIVCTTSRAARRITFKPPLPPKKAHALRSVHYRSGTKIFLTCTKKFWEDDGIQGGKSTTDLPSRFIYYPNHNFTTGVGVIIAYGIGDDANFFQALNLNECADIVFNDLSSIHQLPKKDLQTFCYPSIIQKWSLDKYAMGAITTFTPYQFQHFSEALTAPVGRIFFAGEYTANAHGWIDSTIKSGLTAARDVNRASEL,sabio,G8XQX1,CC(C)CC(N)C(=O)O,0.49,25.0,7.5,1.4.3.2,8707.0,-0.3098039199714864,-0.3098039199714864,CC(C)CC(N)C(=O)O__MNVFFMFSLLFLATLGSCADDKNPLEECFREDDYEEFLEIAKNGLKKTSNPKHIVIVGAGMSGLSAAYVLAGAGHKVTVLEASERPGGRVRTHRNVKEGWYANLGPMRVPEKHRIIREYIRKFGLKLNEFVQETENGWYFIKNIRKRVGEVKKDPGLLKYPVKPSEAGKSAGQLYQESLGKAVEELKRTNCSYILNKYDTYSTKEYLIKEGNLSPGAVDMIGDLLNEDSGYYVSFIESLKHDDIFAYEKRFDEIVGGMDQLPTSMYRAIEESVHFKARVIKIQQNAEKVTVTYQTTQKNLLLETADYVIVCTTSRAARRITFKPPLPPKKAHALRSVHYRSGTKIFLTCTKKFWEDDGIQGGKSTTDLPSRFIYYPNHNFTTGVGVIIAYGIGDDANFFQALNLNECADIVFNDLSSIHQLPKKDLQTFCYPSIIQKWSLDKYAMGAITTFTPYQFQHFSEALTAPVGRIFFAGEYTANAHGWIDSTIKSGLTAARDVNRASEL,./data/raw/alphafold//AF-G8XQX1-F1-model_v4.pdb,5084,1891,1553,2815 +3346,7093,7224,MLRSCAARLRTLGALCLPPVGRRLPGSEPRPELRSFSSEEVILKDCSVPNPSWNKDLRLLFDQFMKKCEDGSWKRLPSYKRTPTEWIQDFKTHFLDPKLMKEEQMSQAQLFTRSFDDGLGFEYVMFYNDIEKRMVCLFQGGPYLEGPPGFIHGGAIATMIDATVGMCAMMAGGIVMTANLNINYKRPIPLCSVVMINSQLDKVEGRKFFVSCNVQSVDEKTLYSEATSLFIKLNPAKSLT,brenda,Q5T1C6,CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.0154,37.0,7.5,3.1.2.20,9606.0,-1.812479279163537,-1.812479279163537,CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MLRSCAARLRTLGALCLPPVGRRLPGSEPRPELRSFSSEEVILKDCSVPNPSWNKDLRLLFDQFMKKCEDGSWKRLPSYKRTPTEWIQDFKTHFLDPKLMKEEQMSQAQLFTRSFDDGLGFEYVMFYNDIEKRMVCLFQGGPYLEGPPGFIHGGAIATMIDATVGMCAMMAGGIVMTANLNINYKRPIPLCSVVMINSQLDKVEGRKFFVSCNVQSVDEKTLYSEATSLFIKLNPAKSLT,./data/raw/alphafold//AF-Q5T1C6-F1-model_v4.pdb,3836,1554,2371,2320 +3347,16202,16440,MATIKLNSGYEMPQVGFGCWKVNNDTCADQIYNAIKVGYRLFDGAEDYGNEKEVGDGIKRAIDEGLVARDELFVVSKLWNNFHHPDNVEKALDRTLSDLKVDYLDLFLIHFPIAFKFVPFDEKYPPGFYCGDGDKFIYEDVPLLSTWKKLEEMVKKGKVRSIGISNFCGGLIQDLLRGAEIPPAVLQIEHHPYLQQPRLVKWVQSKGIAITAYSSFGPQSFVELDHPKVDNCVTLFKHEDIVSIAENHKKSTAQVLLRWATQRGLAVIPKSNQTERLVANLTVNDFDLTNEEIETISKLDVGLRFNDPWDWDEIPTFV,uniprot_search,A0A1L0DQY1,C[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O,0.01,25.0,7.0,1.1.1.307,45354.0,-2.0,-2.0774509799928715,C[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O__MATIKLNSGYEMPQVGFGCWKVNNDTCADQIYNAIKVGYRLFDGAEDYGNEKEVGDGIKRAIDEGLVARDELFVVSKLWNNFHHPDNVEKALDRTLSDLKVDYLDLFLIHFPIAFKFVPFDEKYPPGFYCGDGDKFIYEDVPLLSTWKKLEEMVKKGKVRSIGISNFCGGLIQDLLRGAEIPPAVLQIEHHPYLQQPRLVKWVQSKGIAITAYSSFGPQSFVELDHPKVDNCVTLFKHEDIVSIAENHKKSTAQVLLRWATQRGLAVIPKSNQTERLVANLTVNDFDLTNEEIETISKLDVGLRFNDPWDWDEIPTFV,./data/raw/alphafold//AF-A0A1L0DQY1-F1-model_v4.pdb,4567,4832,3608,4189 +3348,30427,30966,MDPSRHTHVMLVSFPGQGHVNPLLRLGKLIASKGLLVTFVTTEKPWGKKMRQANKIQDGVLKPVGLGFIRFEFFSDGFADDDEKRFDFDAFRPHLEAVGKQEIKNLVKRYNKEPVTCLINNAFVPWVCDVAEELHIPSAVLWVQSCACLTAYYYYHHRLVKFPTKTEPDISVEIPCLPLLKHDEIPSFLHPSSPYTAFGDIILDQLKRFENHKSFYLFIDTFRELEKDIMDHMSQLCPQAIISPVGPLFKMAQTLSSDVKGDISEPASDCMEWLDSREPSSVVYISFGTIANLKQEQMEEIAHGVLSSGLSVLWVVRPPMEGTFVEPHVLPRELEEKGKIVEWCPQERVLAHPAIACFLSHCGWNSTMEALTAGVPVVCFPQWGDQVTDAVYLADVFKTGVRLGRGAAEEMIVSREVVAEKLLEATVGEKAVELRENARRWKAEAEAAVADGGSSDMNFKEFVDKLVTKHVTREDNGEH,sabio,O23401,O=C(O)C=Cc1ccc(O)cc1,0.18,20.0,6.0,2.4.1.126,3702.0,-0.744727494896694,-0.744727494896694,O=C(O)C=Cc1ccc(O)cc1__MDPSRHTHVMLVSFPGQGHVNPLLRLGKLIASKGLLVTFVTTEKPWGKKMRQANKIQDGVLKPVGLGFIRFEFFSDGFADDDEKRFDFDAFRPHLEAVGKQEIKNLVKRYNKEPVTCLINNAFVPWVCDVAEELHIPSAVLWVQSCACLTAYYYYHHRLVKFPTKTEPDISVEIPCLPLLKHDEIPSFLHPSSPYTAFGDIILDQLKRFENHKSFYLFIDTFRELEKDIMDHMSQLCPQAIISPVGPLFKMAQTLSSDVKGDISEPASDCMEWLDSREPSSVVYISFGTIANLKQEQMEEIAHGVLSSGLSVLWVVRPPMEGTFVEPHVLPRELEEKGKIVEWCPQERVLAHPAIACFLSHCGWNSTMEALTAGVPVVCFPQWGDQVTDAVYLADVFKTGVRLGRGAAEEMIVSREVVAEKLLEATVGEKAVELRENARRWKAEAEAAVADGGSSDMNFKEFVDKLVTKHVTREDNGEH,./data/raw/alphafold//AF-O23401-F1-model_v4.pdb,356,3541,4837,5128 +3349,24720,25109,MGIIRTCRLGPDQVKSMRAALDLFGREFGDVATYSQHQPDSDYLGNLLRSKTFIALAAFDQEAVVGALAAYVLPKFEQPRSEIYIYDLAVSGEHRRQGIATALINLLKHEANALGAYVIYVQADYGDDPAVALYTKLGIREEVMHFDIDPSTAT,uniprot_search,D3VY99,NC[C@@H]1CC[C@@H](N)[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](N)C[C@@H]2N)O1,0.0011,25.0,7.8,2.3.1.60,562.0,-2.958607314841775,-2.958607314841775,NC[C@@H]1CC[C@@H](N)[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](N)C[C@@H]2N)O1__MGIIRTCRLGPDQVKSMRAALDLFGREFGDVATYSQHQPDSDYLGNLLRSKTFIALAAFDQEAVVGALAAYVLPKFEQPRSEIYIYDLAVSGEHRRQGIATALINLLKHEANALGAYVIYVQADYGDDPAVALYTKLGIREEVMHFDIDPSTAT,./data/raw/alphafold//AF-D3VY99-F1-model_v4.pdb,3710,1377,2142,2048 +3350,4761,4835,MSIEKLKAALPEYAKDIKLNLSSITRSSVLDQEQLWGTLLASAAATRNPQVLADIGAEATDHLSAAARHAALGAAAIMGMNNVFYRGRGFLEGRYDDLRPGLRMNIIANPGIPKANFELWSFAVSAINGCSHCLVAHEHTLRTVGVDREAIFEALKAAAIVSGVAQALATIEALSPS,brenda,P9WQB5,CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C(OO)=CC4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,0.132,25.0,7.0,1.11.1.28,1773.0,-0.8794260687941501,-0.8794260687941501,CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C(OO)=CC4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C__MSIEKLKAALPEYAKDIKLNLSSITRSSVLDQEQLWGTLLASAAATRNPQVLADIGAEATDHLSAAARHAALGAAAIMGMNNVFYRGRGFLEGRYDDLRPGLRMNIIANPGIPKANFELWSFAVSAINGCSHCLVAHEHTLRTVGVDREAIFEALKAAAIVSGVAQALATIEALSPS,./data/raw/alphafold//AF-P9WQB5-F1-model_v4.pdb,3227,562,655,785 +3351,5543,5628,MSTFSASDFNSERYSSSRPSYPSDFYKMIDEYHDGERKLLVDVGCGPGTATLQMAQELKPFEQIIGSDLSATMIKTAEVIKEGSPDTYKNVSFKISSSDDFKFLGADSVDKQKIDMITAVECAHWFDFEKFQRSAYANLRKDGTIAIWGYADPIFPDYPEFDDLMIEVPYGKQGLGPYWEQPGRSRLRNMLKDSHLDPELFHDIQVSYFCAEDVRDKVKLHQHTKKPLLIRKQVTLVEFADYVRTWSAYHQWKQDPKNKDKEDVADWFIKESLRRRPELSTNTKIEVVWNTFYKLGKRV,sabio,P32643,CC(C)[C@H](C(=O)[O-])[C@@H](O)C(=O)[O-],0.127,30.0,7.0,2.1.1.145,4932.0,-0.8961962790440431,-0.8961962790440431,CC(C)[C@H](C(=O)[O-])[C@@H](O)C(=O)[O-]__MSTFSASDFNSERYSSSRPSYPSDFYKMIDEYHDGERKLLVDVGCGPGTATLQMAQELKPFEQIIGSDLSATMIKTAEVIKEGSPDTYKNVSFKISSSDDFKFLGADSVDKQKIDMITAVECAHWFDFEKFQRSAYANLRKDGTIAIWGYADPIFPDYPEFDDLMIEVPYGKQGLGPYWEQPGRSRLRNMLKDSHLDPELFHDIQVSYFCAEDVRDKVKLHQHTKKPLLIRKQVTLVEFADYVRTWSAYHQWKQDPKNKDKEDVADWFIKESLRRRPELSTNTKIEVVWNTFYKLGKRV,./data/raw/alphafold//AF-P32643-F1-model_v4.pdb,3126,400,459,549 +3352,11220,11377,MGSAPWAPVLLLALGLRGLQAGARRAPDPGFQERFFQQRLDHFNFERFGNKTFPQRFLVSDRFWVRGEGPIFFYTGNEGDVWAFANNSAFVAELAAERGALLVFAEHRYYGKSLPFGAQSTQRGHTELLTVEQALADFAELLRALRRDLGAQDAPAIAFGGSYGGMLSAYLRMKYPHLVAGALAASAPVLAVAGLGDSNQFFRDVTADFEGQSPKCTQGVREAFRQIKDLFLQGAYDTVRWEFGTCQPLSDEKDLTQLFMFARNAFTVLAMMDYPYPTDFLGPLPANPVKVGCDRLLSEAQRITGLRALAGLVYNASGSEHCYDIYRLYHSCADPTGCGTGPDARAWDYQACTEINLTFASNNVTDMFPDLPFTDELRQRYCLDTWGVWPRPDWLLTSFWGGDLRAASNIIFSNGNLDPWAGGGIRRNLSASVIAVTIQGGAHHLDLRASHPEDPASVVEARKLEATIIGEWVKAARREQQPALRGGPRLSL,brenda,Q9UHL4,CCCC[C@H](N)C(=O)N1CCC[C@H]1C(O)=Nc1ccc2c(c1)OCC=C2C,0.003,37.0,7.5,3.4.14.2,9606.0,-2.5228787452803374,-2.5228787452803374,CCCC[C@H](N)C(=O)N1CCC[C@H]1C(O)=Nc1ccc2c(c1)OCC=C2C__MGSAPWAPVLLLALGLRGLQAGARRAPDPGFQERFFQQRLDHFNFERFGNKTFPQRFLVSDRFWVRGEGPIFFYTGNEGDVWAFANNSAFVAELAAERGALLVFAEHRYYGKSLPFGAQSTQRGHTELLTVEQALADFAELLRALRRDLGAQDAPAIAFGGSYGGMLSAYLRMKYPHLVAGALAASAPVLAVAGLGDSNQFFRDVTADFEGQSPKCTQGVREAFRQIKDLFLQGAYDTVRWEFGTCQPLSDEKDLTQLFMFARNAFTVLAMMDYPYPTDFLGPLPANPVKVGCDRLLSEAQRITGLRALAGLVYNASGSEHCYDIYRLYHSCADPTGCGTGPDARAWDYQACTEINLTFASNNVTDMFPDLPFTDELRQRYCLDTWGVWPRPDWLLTSFWGGDLRAASNIIFSNGNLDPWAGGGIRRNLSASVIAVTIQGGAHHLDLRASHPEDPASVVEARKLEATIIGEWVKAARREQQPALRGGPRLSL,./data/raw/alphafold//AF-Q9UHL4-F1-model_v4.pdb,131,3206,3953,4607 +3353,32428,33006,MATGQKLMRAVRVFEFGGPEVLKLRSDIAVPIPKDHQVLIKVHACGVNPVETYIRSGTYSRKPLLPYTPGSDVAGVIEAVGDNASAFKKGDRVFTSSTISGGYAEYALAADHTVYKLPEKLDFKQGAAIGIPYFTAYRALIHSACVKAGESVLVHGASGGVGLAACQIARAYGLKILGTAGTEEGQKIVLQNGAHEVFNHREVNYIDKIKKYVGEKGIDIIIEMLANVNLSKDLSLLSHGGRVIVVGSRGTIEINPRDTMAKESSIIGVTLFSSTKEEFQQYAAALQAGMEIGWLKPVIGSQYPLEKVAEAHENIIHGSGATGKMILLL,sabio,Q08257,O=C1C(=O)c2ccccc2-c2ccccc21,0.0019,25.0,,1.6.5.5,9606.0,-2.721246399047171,-2.721246399047171,O=C1C(=O)c2ccccc2-c2ccccc21__MATGQKLMRAVRVFEFGGPEVLKLRSDIAVPIPKDHQVLIKVHACGVNPVETYIRSGTYSRKPLLPYTPGSDVAGVIEAVGDNASAFKKGDRVFTSSTISGGYAEYALAADHTVYKLPEKLDFKQGAAIGIPYFTAYRALIHSACVKAGESVLVHGASGGVGLAACQIARAYGLKILGTAGTEEGQKIVLQNGAHEVFNHREVNYIDKIKKYVGEKGIDIIIEMLANVNLSKDLSLLSHGGRVIVVGSRGTIEINPRDTMAKESSIIGVTLFSSTKEEFQQYAAALQAGMEIGWLKPVIGSQYPLEKVAEAHENIIHGSGATGKMILLL,./data/raw/alphafold//AF-Q08257-F1-model_v4.pdb,2007,7520,1774,381 +3354,16765,17006,MWYHRLSHLHSRLQDLLKGGVIYPALPQPNFKSLLPLAVHWHHTASKSLTCAWQQHEDHFELKYANTVMRFDYVWLRDHCRSASCYNSKTHQRSLDTASVDLCIKPKTIRLDETTLFFTWPDGHVTKYDLNWLVKNSYEGQKQKVIQPRILWNAEIYQQAQVPSVDCQSFLETNEGLKKFLQNFLLYGIAFVENVPPTQEHTEKLAERISLIRETIYGRMWYFTSDFSRGDTAYTKLALDRHTDTTYFQEPCGIQVFHCLKHEGTGGRTLLVDGFYAAEQVLQKAPEEFELLSKVPLKHEYIEDVGECHNHMIGIGPVLNIYPWNKELYLIRYNNYDRAVINTVPYDVVHRWYTAHRTLTIELRRPENEFWVKLKPGRVLFIDNWRVLHGRECFTGYRQLCGCYLTRDDVLNTARLLGLQA,brenda,Q9NVH6,C[N+](C)(C)CCCC[C@H](N)C(=O)O,0.636,37.0,7.0,1.14.11.8,9606.0,-0.1965428843515861,-0.176966822370512,C[N+](C)(C)CCCC[C@H](N)C(=O)O__MWYHRLSHLHSRLQDLLKGGVIYPALPQPNFKSLLPLAVHWHHTASKSLTCAWQQHEDHFELKYANTVMRFDYVWLRDHCRSASCYNSKTHQRSLDTASVDLCIKPKTIRLDETTLFFTWPDGHVTKYDLNWLVKNSYEGQKQKVIQPRILWNAEIYQQAQVPSVDCQSFLETNEGLKKFLQNFLLYGIAFVENVPPTQEHTEKLAERISLIRETIYGRMWYFTSDFSRGDTAYTKLALDRHTDTTYFQEPCGIQVFHCLKHEGTGGRTLLVDGFYAAEQVLQKAPEEFELLSKVPLKHEYIEDVGECHNHMIGIGPVLNIYPWNKELYLIRYNNYDRAVINTVPYDVVHRWYTAHRTLTIELRRPENEFWVKLKPGRVLFIDNWRVLHGRECFTGYRQLCGCYLTRDDVLNTARLLGLQA,./data/raw/alphafold//AF-Q9NVH6-F1-model_v4.pdb,700,4046,5450,5810 +3355,18184,18448,MNKVLIIGSGFSGATIARLLAEENIKVKIIDDRKHIGGNCYDERDEKTGINVHVYGPHIFHTDNEDVWNFVNKYGTFQPYTTRLKANAKGQIYSLPVNLHTINQYYKTALSPTEARKLIASKGDQTINDPQSFEEQALKFVGEDLYKTFFYGYPKKQWGMEPKEIPASVLKRLPVRFNYDDNYFFHKFQGIPRDGYTPLFQNLLNHPNIEFELGKKVNRATVEELITSEQYGHVFFSGAIDHFYDYEFGMLQYRTLDFEKFYSEDDDYQGCVVMSYCDEDVPYTRVTEHKYFTPWEEHKGSVLYKEFSRSCDKEDIPYYPVRLVSGNSIWNKYEQKAKEETNITFIGRLATYRYLDMDVCIKEAIECAQLYIKNNKE,brenda,Q6E7F1,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](C)[C@H](O)[C@H](O)[C@H]3O)O2)c(=O)nc1O,3.43,37.0,7.4,5.4.99.59,562.0,0.5352941200427705,0.5352941200427705,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](C)[C@H](O)[C@H](O)[C@H]3O)O2)c(=O)nc1O__MNKVLIIGSGFSGATIARLLAEENIKVKIIDDRKHIGGNCYDERDEKTGINVHVYGPHIFHTDNEDVWNFVNKYGTFQPYTTRLKANAKGQIYSLPVNLHTINQYYKTALSPTEARKLIASKGDQTINDPQSFEEQALKFVGEDLYKTFFYGYPKKQWGMEPKEIPASVLKRLPVRFNYDDNYFFHKFQGIPRDGYTPLFQNLLNHPNIEFELGKKVNRATVEELITSEQYGHVFFSGAIDHFYDYEFGMLQYRTLDFEKFYSEDDDYQGCVVMSYCDEDVPYTRVTEHKYFTPWEEHKGSVLYKEFSRSCDKEDIPYYPVRLVSGNSIWNKYEQKAKEETNITFIGRLATYRYLDMDVCIKEAIECAQLYIKNNKE,./data/raw/alphafold//AF-Q6E7F1-F1-model_v4.pdb,3848,4448,5914,3284 +3356,39296,39995,MKIIIDTDPGIDDSVAILMAFQMPGVQVLGLTTIFGNCTTEHATRNALILCEKASHLEVPVAEGSHEPLKGGKPHVADFVHGPDGLGNVDLPDPTIKKVEESATDFLVDKVSRFPGEVSVLALGPLTNIALAIKKDPSFVKNVKKIVVLGGAFFAAGNATPSAEANIHSDPEAADMVFTSGADIYVVGLNITTQVSFTDKDLLELRNSQGKYAQFLCDVCKFYLDWHTESYGAPVIFLHDPVSFAALVRPELFTFKKGVVRVETQGICVGHTSMDMLLKKWNSENPWTGYSPISVAWTVDVPKVVAFVKELVTKP,brenda,B6T563,OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O,0.201,30.0,7.5,3.2.2.1,4577.0,-0.6968039425795112,-0.6968039425795112,OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O__MKIIIDTDPGIDDSVAILMAFQMPGVQVLGLTTIFGNCTTEHATRNALILCEKASHLEVPVAEGSHEPLKGGKPHVADFVHGPDGLGNVDLPDPTIKKVEESATDFLVDKVSRFPGEVSVLALGPLTNIALAIKKDPSFVKNVKKIVVLGGAFFAAGNATPSAEANIHSDPEAADMVFTSGADIYVVGLNITTQVSFTDKDLLELRNSQGKYAQFLCDVCKFYLDWHTESYGAPVIFLHDPVSFAALVRPELFTFKKGVVRVETQGICVGHTSMDMLLKKWNSENPWTGYSPISVAWTVDVPKVVAFVKELVTKP,./data/raw/alphafold//AF-B6T563-F1-model_v4.pdb,2687,8420,8465,11590 +3357,18762,19035,MNVFSIFSLVFLAAFGSCADDRRSALEECFREADYEEFLEIARNGLKKTSNPKHVVVVGAGMAGLSAAYVLAGAGHRVTLLEASDRVGGRVNTYRDEKEGWYVNMGPMRLPERHRIVRTYIAKFGLKLNEFFQENENAWYFIRNIRKRVWEVKKDPGVFKYPVKPSEEGKSASQLYRESLKKVIEELKRTNCSYILDKYDTYSTKEYLIKEGNLSRGAVDMIGDLLNEDSSYYLSFIESLKNDDLFSYEKRFDEISDGFDQLPKSMHQAIAEMVHLNAQVIKIQRDAEKVRVAYQTPAKTLSYVTADYVIVCATSRAVRRISFEPPLPPKKAHALRSIHYKSATKIFLTCTRKFWEADGIHGGKSTTDLPSRFIYYPNHNFTSGVGVIVAYVLADDSDFFQALDIKTSADIVINDLSLIHQLPKNEIQALCYPSLIKKWSLDKYTMGALTSFTPYQFQDYIETVAAPVGRIYFAGEYTATVHGWLDSTIKSGLTAARNVNRASQKPSRIHLINDNQL,sabio,A8QL52,N=C(N)NCCCC(N)C(=O)O,18.75,25.0,8.5,1.4.3.2,8613.0,1.2730012720637376,1.2730012720637376,N=C(N)NCCCC(N)C(=O)O__MNVFSIFSLVFLAAFGSCADDRRSALEECFREADYEEFLEIARNGLKKTSNPKHVVVVGAGMAGLSAAYVLAGAGHRVTLLEASDRVGGRVNTYRDEKEGWYVNMGPMRLPERHRIVRTYIAKFGLKLNEFFQENENAWYFIRNIRKRVWEVKKDPGVFKYPVKPSEEGKSASQLYRESLKKVIEELKRTNCSYILDKYDTYSTKEYLIKEGNLSRGAVDMIGDLLNEDSSYYLSFIESLKNDDLFSYEKRFDEISDGFDQLPKSMHQAIAEMVHLNAQVIKIQRDAEKVRVAYQTPAKTLSYVTADYVIVCATSRAVRRISFEPPLPPKKAHALRSIHYKSATKIFLTCTRKFWEADGIHGGKSTTDLPSRFIYYPNHNFTSGVGVIVAYVLADDSDFFQALDIKTSADIVINDLSLIHQLPKNEIQALCYPSLIKKWSLDKYTMGALTSFTPYQFQDYIETVAAPVGRIYFAGEYTATVHGWLDSTIKSGLTAARNVNRASQKPSRIHLINDNQL,./data/raw/alphafold//AF-A8QL52-F1-model_v4.pdb,5084,1891,1547,2877 +3358,22432,22781,MGDSHEDTSATMPEAVAEEVSLFSTTDMVLFSLIVGVLTYWFIFRKKKEEIPEFSKIQTTAPPVKESSFVEKMKKTGRNIIVFYGSQTGTAEEFANRLSKDAHRYGMRGMSADPEEYDLADLSSLPEIDKSLVVFCMATYGEGDPTDNAQDFYDWLQETDVDLTGVKFAVFGLGNKTYEHFNAMGKYVDQRLEQLGAQRIFELGLGDDDGNLEEDFITWREQFWPAVCEFFGVEATGEESSIRQYELVVHEDMDVAKVYTGEMGRLKSYENQKPPFDAKNPFLAAVTANRKLNQGTERHLMHLELDISDSKIRYESGDHVAVYPANDSALVNQIGEILGADLDVIMSLNNLDEESNKKHPFPCPTTYRTALTYYLDITNPPRTNVLYELAQYASEPSEQEHLHKMASSSGEGKELYLSWVVEARRHILAILQDYPSLRPPIDHLCELLPRLQARYYSIASSSKVHPNSVHICAVAVEYEAKSGRVNKGVATSWLRAKEPAGENGGRALVPMFVRKSQFRLPFKSTTPVIMVGPGTGIAPFMGFIQERAWLREQGKEVGETLLYYGCRRSDEDYLYREELARFHKDGALTQLNVAFSREQAHKVYVQHLLKRDREHLWKLIHEGGAHIYVCGDARNMAKDVQNTFYDIVAEFGPMEHTQAVDYVKKLMTKGRYSLDVWS,sabio,P00388,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1,0.014,45.0,7.5,1.16.1.5,10116.0,-1.853871964321762,-1.853871964321762,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1__MGDSHEDTSATMPEAVAEEVSLFSTTDMVLFSLIVGVLTYWFIFRKKKEEIPEFSKIQTTAPPVKESSFVEKMKKTGRNIIVFYGSQTGTAEEFANRLSKDAHRYGMRGMSADPEEYDLADLSSLPEIDKSLVVFCMATYGEGDPTDNAQDFYDWLQETDVDLTGVKFAVFGLGNKTYEHFNAMGKYVDQRLEQLGAQRIFELGLGDDDGNLEEDFITWREQFWPAVCEFFGVEATGEESSIRQYELVVHEDMDVAKVYTGEMGRLKSYENQKPPFDAKNPFLAAVTANRKLNQGTERHLMHLELDISDSKIRYESGDHVAVYPANDSALVNQIGEILGADLDVIMSLNNLDEESNKKHPFPCPTTYRTALTYYLDITNPPRTNVLYELAQYASEPSEQEHLHKMASSSGEGKELYLSWVVEARRHILAILQDYPSLRPPIDHLCELLPRLQARYYSIASSSKVHPNSVHICAVAVEYEAKSGRVNKGVATSWLRAKEPAGENGGRALVPMFVRKSQFRLPFKSTTPVIMVGPGTGIAPFMGFIQERAWLREQGKEVGETLLYYGCRRSDEDYLYREELARFHKDGALTQLNVAFSREQAHKVYVQHLLKRDREHLWKLIHEGGAHIYVCGDARNMAKDVQNTFYDIVAEFGPMEHTQAVDYVKKLMTKGRYSLDVWS,./data/raw/alphafold//AF-P00388-F1-model_v4.pdb,4128,4978,6857,3968 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+3405,40965,41704,MSQKIQGGSVVEMQGDEMTRIIWELIKEKLIFPYVELDLHSYDLGIENRDATNDQVTKDAAEAIKKYNVGVKCATITPDEKRVEEFKLKQMWKSPNGTIRNILGGTVFREAIICKNIPRLVSGWVKPIIIGRHAYGDQYRATDFVVPGPGKVEISYTPSDGSPKTVYLVHNFTESGGVAMGMYNQDKSIEDFAHSSFQMALSKNWPLYLSTKNTILKKYDGRFKDIFQEIYDKQYKSEFEAQNIWYEHRLIDDMVAQAMKSEGGFIWACKNYDGDVQSDSVAQGYGSLGMMTSVLVCPDGKTVEAEAAHGTVTRHYRMYQKGQETLTNPIASIFAWTRGLAHRAKLDNNKELSFFAKALEEVCIETIEAGFMTKDLAACIKGLPNVQRSDYLNTFEFMDKLGENLQLKLAQAKL,sabio,Q9XSG3,[Mn+2],0.0064,25.0,7.4,1.1.1.42,9913.0,-2.193820026016113,-2.193820026016113,[Mn+2]__MSQKIQGGSVVEMQGDEMTRIIWELIKEKLIFPYVELDLHSYDLGIENRDATNDQVTKDAAEAIKKYNVGVKCATITPDEKRVEEFKLKQMWKSPNGTIRNILGGTVFREAIICKNIPRLVSGWVKPIIIGRHAYGDQYRATDFVVPGPGKVEISYTPSDGSPKTVYLVHNFTESGGVAMGMYNQDKSIEDFAHSSFQMALSKNWPLYLSTKNTILKKYDGRFKDIFQEIYDKQYKSEFEAQNIWYEHRLIDDMVAQAMKSEGGFIWACKNYDGDVQSDSVAQGYGSLGMMTSVLVCPDGKTVEAEAAHGTVTRHYRMYQKGQETLTNPIASIFAWTRGLAHRAKLDNNKELSFFAKALEEVCIETIEAGFMTKDLAACIKGLPNVQRSDYLNTFEFMDKLGENLQLKLAQAKL,./data/raw/alphafold//AF-Q9XSG3-F1-model_v4.pdb,4354,5366,244,8344 +3406,15225,15439,MTQAATRPTNDAGQDGGNNSDILVVARQQVLQRGEGLNQDQVLAVLQLPDDRLEELLALAHEVRMRWCGPEVEVEGIISLKTGGCPEDCHFCSQSGLFASPVRSAWLDIPSLVEAAKQTAKSGATEFCIVAAVRGPDERLMAQVAAGIEAIRNEVEINIACSLGMLTAEQVDQLAARGVHRYNHNLETARSFFANVVTTHTWEERWQTLSMVRDAGMEVCCGGILGMGETLQQRAEFAAELAELGPDEVPLNFLNPRPGTPFADLEVMPVGDALKAVAAFRLALPRTMLRFAGGREITLGDLGAKRGILGGINAVIVGNYLTTLGRPAEADLELLDELQMPLKALNASL,brenda,P9WPQ7,C[C@@H]1N=C(O)N[C@@H]1CCCCCC(=O)O,0.00281,37.0,8.0,2.8.1.6,1773.0,-2.55129368009492,-2.55129368009492,C[C@@H]1N=C(O)N[C@@H]1CCCCCC(=O)O__MTQAATRPTNDAGQDGGNNSDILVVARQQVLQRGEGLNQDQVLAVLQLPDDRLEELLALAHEVRMRWCGPEVEVEGIISLKTGGCPEDCHFCSQSGLFASPVRSAWLDIPSLVEAAKQTAKSGATEFCIVAAVRGPDERLMAQVAAGIEAIRNEVEINIACSLGMLTAEQVDQLAARGVHRYNHNLETARSFFANVVTTHTWEERWQTLSMVRDAGMEVCCGGILGMGETLQQRAEFAAELAELGPDEVPLNFLNPRPGTPFADLEVMPVGDALKAVAAFRLALPRTMLRFAGGREITLGDLGAKRGILGGINAVIVGNYLTTLGRPAEADLELLDELQMPLKALNASL,./data/raw/alphafold//AF-P9WPQ7-F1-model_v4.pdb,519,3799,5156,5477 +3407,23893,24275,MSQTHKHAIPANIADRCLINPEQYETKYKQSINDPDTFWGEQGKILDWITPYQKVKNTSFAPGNVSIKWYEDGTLNLAANCLDRHLQENGDRTAIIWEGDDTSQSKHISYRELHRDVCRFANTLLDLGIKKGDVVAIYMPMVPEAAVAMLACARIGAVHSVIFGGFSPEAVAGRIIDSSSRLVITADEGVRAGRSIPLKKNVDDALKNPNVTSVEHVIVLKRTGSDIDWQEGRDLWWRDLIEKASPEHQPEAMNAEDPLFILYTSGSTGKPKGVLHTTGGYLVYAATTFKYVFDYHPGDIYWCTADVGWVTGHSYLLYGPLACGATTLMFEGVPNWPTPARMCQVVDKHQVNILYTAPTAIRALMAEGDKAIEGTDRSSLRILGSVGEPINPEAWEWYWKKIGKEKCPVVDTWWQTETGGFMITPLPGAIELKAGSATRPFFGVQPALVDNEGHPQEGATEGNLVITDSWPGQARTLFGDHERFEQTYFSTFKNMYFSGDGARRDEDGYYWITGRVDDVLNVSGHRLGTAEIESALVAHPKIAEAAVVGIPHAIKGQAIYAYVTLNHGEEPSPELYAEVRNWVRKEIGPLATPDVLHWTDSLPKTRSGKIMRRILRKIAAGDTSNLGDTSTLADPGVVEKLLEEKQAIAMPS,sabio,Q8ZKF6,NCC(=O)O,9.45,37.0,,6.2.1.1,28901.0,0.9754318085092628,0.9754318085092628,NCC(=O)O__MSQTHKHAIPANIADRCLINPEQYETKYKQSINDPDTFWGEQGKILDWITPYQKVKNTSFAPGNVSIKWYEDGTLNLAANCLDRHLQENGDRTAIIWEGDDTSQSKHISYRELHRDVCRFANTLLDLGIKKGDVVAIYMPMVPEAAVAMLACARIGAVHSVIFGGFSPEAVAGRIIDSSSRLVITADEGVRAGRSIPLKKNVDDALKNPNVTSVEHVIVLKRTGSDIDWQEGRDLWWRDLIEKASPEHQPEAMNAEDPLFILYTSGSTGKPKGVLHTTGGYLVYAATTFKYVFDYHPGDIYWCTADVGWVTGHSYLLYGPLACGATTLMFEGVPNWPTPARMCQVVDKHQVNILYTAPTAIRALMAEGDKAIEGTDRSSLRILGSVGEPINPEAWEWYWKKIGKEKCPVVDTWWQTETGGFMITPLPGAIELKAGSATRPFFGVQPALVDNEGHPQEGATEGNLVITDSWPGQARTLFGDHERFEQTYFSTFKNMYFSGDGARRDEDGYYWITGRVDDVLNVSGHRLGTAEIESALVAHPKIAEAAVVGIPHAIKGQAIYAYVTLNHGEEPSPELYAEVRNWVRKEIGPLATPDVLHWTDSLPKTRSGKIMRRILRKIAAGDTSNLGDTSTLADPGVVEKLLEEKQAIAMPS,./data/raw/alphafold//AF-Q8ZKF6-F1-model_v4.pdb,3531,1057,1262,1550 +3408,21144,21463,MKVAVITGASRGIGEAIARALARDGYALALGARSVDRLEKIAHELMQEQGVEVFYHHLDVSKAESVEEFSKKVLERFGDVDVVVANAGLGYFKRLEELSEEEFHEMIEVNLLGVWRTLKAFLDSLKRTGGLALVTTSDVSARLIPYGGGYVSTKWAARALVRTFQIENPDVRFFELRPGAVDTYFGGSKPGKPKEKGYLKPDEIAEAVRCLLKLPKDVRVEELMLRSVYQRPEY,brenda,C6A190,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.022,60.0,9.0,1.1.1.2,172049.0,-1.6575773191777938,-1.6713748808972022,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MKVAVITGASRGIGEAIARALARDGYALALGARSVDRLEKIAHELMQEQGVEVFYHHLDVSKAESVEEFSKKVLERFGDVDVVVANAGLGYFKRLEELSEEEFHEMIEVNLLGVWRTLKAFLDSLKRTGGLALVTTSDVSARLIPYGGGYVSTKWAARALVRTFQIENPDVRFFELRPGAVDTYFGGSKPGKPKEKGYLKPDEIAEAVRCLLKLPKDVRVEELMLRSVYQRPEY,./data/raw/alphafold//AF-C6A190-F1-model_v4.pdb,3430,901,1086,1339 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SELACPTPKEDGLAQQQTQLNLRSLLVNPEGPTLMRLNSVQSSERPLFLVHPIEGSTTVFHSLASRLSIPTYGLQCTRAAPLDSIHSLAAYYIDCIRQVQPEGPYRVAGYSYGACVAFEMCSQLQAQQSPAPTHNSLFLFDGSPTYVLAYTQSYRAKLTPGCEAEAETEAICFFVQQFTDMEHNRVLEALLPLKGLEERVAAAVDLIIKSHQGLDRQELSFAARSFYYKLRAAEQYTPKAKYHGNVMLLRAKTGGAYGEDLGADYNLSQVCDGKVSVHVIEGDHRTLLEGSGLESIISIIHSSLAEPRVSVREG,./data/raw/alphafold//AF-P49327-F1-model_v4.pdb,3460,274,1142,1405 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+3424,18095,18357,MPKKTIYFGAGWFTDRQNKAYKEAMEALKENPTIDLENSYVPLDNQYKGIRVDEHPEYLHDKVWATATYNNDLNGIKTNDIMLGVYIPDEEDVGLGMELGYALSQGKYVLLVIPDEDYGKPINLMSWGVSDNVIKMSQLKDFNFNKPRFDFYEGAVY,uniprot_search,Q9R5V5,Cc1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)nc1O,0.05,50.0,6.0,2.4.2.6,28039.0,-1.3010299956639813,-0.5980397567041544,Cc1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)nc1O__MPKKTIYFGAGWFTDRQNKAYKEAMEALKENPTIDLENSYVPLDNQYKGIRVDEHPEYLHDKVWATATYNNDLNGIKTNDIMLGVYIPDEEDVGLGMELGYALSQGKYVLLVIPDEDYGKPINLMSWGVSDNVIKMSQLKDFNFNKPRFDFYEGAVY,./data/raw/alphafold//AF-Q9R5V5-F1-model_v4.pdb,969,4411,5870,6298 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+3449,882,906,MTDAGRQGRVEALSISVTAPYCRFEKTGSPDLEGDETVLGLIEHGTGHTDVSLVDGAPRTAVHTTTRDDEAFTEVWHAQRPVESGMDNGIAWARTDAYLFGVVRTGESGRYADATAALYTNVFQLTRSLGYPLLARTWNYVSGINTTNADGLEVYRDFCVGRAQALDEGGIDPATMPAATGIGAHGGGITCVFLAARGGVRINIENPAVLTAHHYPTTYGPRPPVFARATWLGPPEGGRLFISATAGILGHRTVHHGDVTGQCEVALDNMARVIGAENLRRHGVQRGHVLADVDHLKVYVRRREDLDTVRRVCAARLSSTAAVALLHTDIAREDLLVEIEGMVA,brenda,Q9KID9,C=C(O[C@@H]1C=C(C(=O)O)C=C[C@H]1O)C(=O)O,0.15,25.0,7.0,3.3.2.13,132248.0,-0.8239087409443188,-0.8239087409443188,C=C(O[C@@H]1C=C(C(=O)O)C=C[C@H]1O)C(=O)O__MTDAGRQGRVEALSISVTAPYCRFEKTGSPDLEGDETVLGLIEHGTGHTDVSLVDGAPRTAVHTTTRDDEAFTEVWHAQRPVESGMDNGIAWARTDAYLFGVVRTGESGRYADATAALYTNVFQLTRSLGYPLLARTWNYVSGINTTNADGLEVYRDFCVGRAQALDEGGIDPATMPAATGIGAHGGGITCVFLAARGGVRINIENPAVLTAHHYPTTYGPRPPVFARATWLGPPEGGRLFISATAGILGHRTVHHGDVTGQCEVALDNMARVIGAENLRRHGVQRGHVLADVDHLKVYVRRREDLDTVRRVCAARLSSTAAVALLHTDIAREDLLVEIEGMVA,./data/raw/alphafold//AF-Q9KID9-F1-model_v4.pdb,3196,521,609,733 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+3451,22701,23053,MAAIAESPSTELQGEASGYSNRDEWHCGFSEELCLTIVVAGASGDLARKKTYPALQFLFQHGFLPSNVAIIGYARTDMNDDKLREKLKPKLVGSDDDIDKFLKRCTYVAGSYDGAEGWQGLAKVLDKRESKCSKNPAGRLYYLALPPSVYPQVCAGLKEHCDNLRSVEGSWIRVIVEKPFGHDLQSSEQLADQLGKLYPEHQLYRIDHYLGKEMAQNLFVMRHANMFLAPVWNRTCISNVQITFKEDFGTEGRGGYFDTFGILRDVLQNHLAQMLAMVAMEKPLSVHPDDLRDEKVKVLRCIKPVEPHNVVLGQYTAANGQPGYTDDPTVPDDSKTPTFAAVTLYIDNDRWAGVPFVLKAGKALNERKAEIRVQLRATPHFVFNGEPESMRNELVVRLQPDEAIYLKMIVKKPGLEFDAAISELDLDYSRQYPEVDIPDAYPRLILDSIRGDQQHFVRRDELRAAWGIFTPLLHKIDAGEVEVHPYPYGSRGPAEADELLARADFVKNVAYNWKDPGSCKL,sabio,Q8LNZ7,NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,0.0124,25.0,7.8,1.1.1.49,3077.0,-1.9065783148377649,-1.9065783148377649,NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1__MAAIAESPSTELQGEASGYSNRDEWHCGFSEELCLTIVVAGASGDLARKKTYPALQFLFQHGFLPSNVAIIGYARTDMNDDKLREKLKPKLVGSDDDIDKFLKRCTYVAGSYDGAEGWQGLAKVLDKRESKCSKNPAGRLYYLALPPSVYPQVCAGLKEHCDNLRSVEGSWIRVIVEKPFGHDLQSSEQLADQLGKLYPEHQLYRIDHYLGKEMAQNLFVMRHANMFLAPVWNRTCISNVQITFKEDFGTEGRGGYFDTFGILRDVLQNHLAQMLAMVAMEKPLSVHPDDLRDEKVKVLRCIKPVEPHNVVLGQYTAANGQPGYTDDPTVPDDSKTPTFAAVTLYIDNDRWAGVPFVLKAGKALNERKAEIRVQLRATPHFVFNGEPESMRNELVVRLQPDEAIYLKMIVKKPGLEFDAAISELDLDYSRQYPEVDIPDAYPRLILDSIRGDQQHFVRRDELRAAWGIFTPLLHKIDAGEVEVHPYPYGSRGPAEADELLARADFVKNVAYNWKDPGSCKL,./data/raw/alphafold//AF-Q8LNZ7-F1-model_v4.pdb,4369,5724,7401,8313 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+3457,36638,37278,MALCNGDSKPENAGGDLKDGCHHYEGAVVILDAGAQYGKVIDRRVRELFVQSEIFPLETPAFAIKEQGFRAIIISGGPNSVYAEDAPWFDPAIFTIGKPVLGICYGMQMMNKVFGGTVHKKSVREDGVFNISMDNTCSLFRGLQKEEIVLLTHGDSVDKVADGFKVVARSGNIVAGIANESKKLYGVQFHPEVGLTENGKVILKNFLYDIAGCSGNFTVQNRELECIREIKEKVGTSKVLVLLSGGVDSTVCTALLNRALNQDQVIAVHIDNGFMRKRESQSVEEALKKLGIQVKVINAAHSFYNGTTTLPISDEDRTPRKRISKTLNMTTSPEEKRKIIGDTFVKIANEVIGEMSLKPEEVFLAQGTLRPDLIESASLVASGKAELIKTHHNDTELIRKLREEGKVIEPLKDFHKDEVRILGRELDLPEELVSRHPFPGPGLAIRVICAEEPYICKDFPETNNILKIVADFSASVKKPHTLLQRVKACTTEEDQEKLMEITSQHSLNAFLLPIKTVGVQGDCRSYSYVCGISSKDEPDWESLIFLARLIPRMCHNINRVVYIFGPPVKEPPTDVTPTFLTTGVLSTLRQADFEAHNILRESGYAGKISQMPVILTPLHFDRDPLQKQPSCQRSVVIRTFITSDFMTGVPATPGNEIPVEVVLKMVTEIKKIPGISRIMYDLTSKPPGTTEWE,sabio,Q4V7C6,O=c1[nH]c(=O)c2ncn(C3OC(COP(=O)(O)O)C(O)C3O)c2[nH]1,0.0044,37.0,7.6,6.3.5.2,10116.0,-2.356547323513813,-2.34689474591612,O=c1[nH]c(=O)c2ncn(C3OC(COP(=O)(O)O)C(O)C3O)c2[nH]1__MALCNGDSKPENAGGDLKDGCHHYEGAVVILDAGAQYGKVIDRRVRELFVQSEIFPLETPAFAIKEQGFRAIIISGGPNSVYAEDAPWFDPAIFTIGKPVLGICYGMQMMNKVFGGTVHKKSVREDGVFNISMDNTCSLFRGLQKEEIVLLTHGDSVDKVADGFKVVARSGNIVAGIANESKKLYGVQFHPEVGLTENGKVILKNFLYDIAGCSGNFTVQNRELECIREIKEKVGTSKVLVLLSGGVDSTVCTALLNRALNQDQVIAVHIDNGFMRKRESQSVEEALKKLGIQVKVINAAHSFYNGTTTLPISDEDRTPRKRISKTLNMTTSPEEKRKIIGDTFVKIANEVIGEMSLKPEEVFLAQGTLRPDLIESASLVASGKAELIKTHHNDTELIRKLREEGKVIEPLKDFHKDEVRILGRELDLPEELVSRHPFPGPGLAIRVICAEEPYICKDFPETNNILKIVADFSASVKKPHTLLQRVKACTTEEDQEKLMEITSQHSLNAFLLPIKTVGVQGDCRSYSYVCGISSKDEPDWESLIFLARLIPRMCHNINRVVYIFGPPVKEPPTDVTPTFLTTGVLSTLRQADFEAHNILRESGYAGKISQMPVILTPLHFDRDPLQKQPSCQRSVVIRTFITSDFMTGVPATPGNEIPVEVVLKMVTEIKKIPGISRIMYDLTSKPPGTTEWE,./data/raw/alphafold//AF-Q4V7C6-F1-model_v4.pdb,3902,4640,6437,6347 +3458,31329,31886,MTTPLPLEPIETASRDELTALQLERLKWSLRHAYDHSPVYRRKFDEAGVHPDDLKTLADLSRFPFTTKGDLRDSYPFGMFAVPQDRISRIHASSGTTGKPTVVGYTAADIDTWANLVARSIRAAGARRGDKVHVSYGYGLFTGGLGAHYGAERAGLTVIPFGGGQTEKQVQLIQDFRPDIIMVTPSYMLSIADEIERQGLDPVQSSLRIGIFGAEPWTNDMRVAIEQRMGIDAVDIYGLSEVMGPGVASECVETKDGPTIWEDHFYPEIIDPETGEVLPDGELGELVFTSLTKEALPIIRYRTRDLTRLLPGTARTMRRMEKITGRSDDMMIVRGVNVFPTQIEEQLLKQRALAPHYQIVLTKEGPLDVLTLNVEPCPETAPDTAAIQVAKQALAYDIKSLIGVTAVINVLPVNGIERSVGKARRVVDKRKG,brenda,B4E7B5,O=C(O)Cc1ccc(O)cc1,0.54,30.0,7.0,6.2.1.30,95486.0,-0.2676062401770315,-0.2676062401770315,O=C(O)Cc1ccc(O)cc1__MTTPLPLEPIETASRDELTALQLERLKWSLRHAYDHSPVYRRKFDEAGVHPDDLKTLADLSRFPFTTKGDLRDSYPFGMFAVPQDRISRIHASSGTTGKPTVVGYTAADIDTWANLVARSIRAAGARRGDKVHVSYGYGLFTGGLGAHYGAERAGLTVIPFGGGQTEKQVQLIQDFRPDIIMVTPSYMLSIADEIERQGLDPVQSSLRIGIFGAEPWTNDMRVAIEQRMGIDAVDIYGLSEVMGPGVASECVETKDGPTIWEDHFYPEIIDPETGEVLPDGELGELVFTSLTKEALPIIRYRTRDLTRLLPGTARTMRRMEKITGRSDDMMIVRGVNVFPTQIEEQLLKQRALAPHYQIVLTKEGPLDVLTLNVEPCPETAPDTAAIQVAKQALAYDIKSLIGVTAVINVLPVNGIERSVGKARRVVDKRKG,./data/raw/alphafold//AF-B4E7B5-F1-model_v4.pdb,1874,7342,9297,9631 +3459,21740,22078,MWNLLHETDSAVATARRPRWLCAGALVLAGGFFLLGFLFGWFIKSSNEATNITPKHNMKAFLDELKAENIKKFLYNFTQIPHLAGTEQNFQLAKQIQSQWKEFGLDSVELAHYDVLLSYPNKTHPNYISIINEDGNEIFNTSLFEPPPPGYENVSDIVPPFSAFSPQGMPEGDLVYVNYARTEDFFKLERDMKINCSGKIVIARYGKVFRGNKVKNAQLAGAKGVILYSDPADYFAPGVKSYPDGWNLPGGGVQRGNILNLNGAGDPLTPGYPANEYAYRRGIAEAVGLPSIPVHPIGYYDAQKLLEKMGGSAPPDSSWRGSLKVPYNVGPGFTGNFSTQKVKMHIHSTNEVTRIYNVIGTLRGAVEPDRYVILGGHRDSWVFGGIDPQSGAAVVHEIVRSFGTLKKEGWRPRRTILFASWDAEEFGLLGSTEWAEENSRLLQERGVAYINADSSIEGNYTLRVDCTPLMYSLVHNLTKELKSPDEGFEGKSLYESWTKKSPSPEFSGMPRISKLGSGNDFEVFFQRLGIASGRARYTKNWETNKFSGYPLYHSVYETYELVEKFYDPMFKYHLTVAQVRGGMVFELANSIVLPFDCRDYAVVLRKYADKIYSISMKHPQEMKTYSVSFDSLFSAVKNFTEIASKFSERLQDFDKSNPIVLRMMNDQLMFLERAFIDPLGLPDRPFYRHVIYAPSSHNKYAGESFPGIYDALFDIESKVDPSKAWGEVKRQIYVAAFTVQAAAETLSEVA,brenda,Q04609,N=c1nc(O)c2nc(CNc3ccc(C(=O)N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCC(=O)O)C(=O)O)cc3)cnc2[nH]1,3.9e-05,37.0,7.4,3.4.17.21,9606.0,-4.4089353929735005,-4.4089353929735005,N=c1nc(O)c2nc(CNc3ccc(C(=O)N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCC(=O)O)C(=O)O)cc3)cnc2[nH]1__MWNLLHETDSAVATARRPRWLCAGALVLAGGFFLLGFLFGWFIKSSNEATNITPKHNMKAFLDELKAENIKKFLYNFTQIPHLAGTEQNFQLAKQIQSQWKEFGLDSVELAHYDVLLSYPNKTHPNYISIINEDGNEIFNTSLFEPPPPGYENVSDIVPPFSAFSPQGMPEGDLVYVNYARTEDFFKLERDMKINCSGKIVIARYGKVFRGNKVKNAQLAGAKGVILYSDPADYFAPGVKSYPDGWNLPGGGVQRGNILNLNGAGDPLTPGYPANEYAYRRGIAEAVGLPSIPVHPIGYYDAQKLLEKMGGSAPPDSSWRGSLKVPYNVGPGFTGNFSTQKVKMHIHSTNEVTRIYNVIGTLRGAVEPDRYVILGGHRDSWVFGGIDPQSGAAVVHEIVRSFGTLKKEGWRPRRTILFASWDAEEFGLLGSTEWAEENSRLLQERGVAYINADSSIEGNYTLRVDCTPLMYSLVHNLTKELKSPDEGFEGKSLYESWTKKSPSPEFSGMPRISKLGSGNDFEVFFQRLGIASGRARYTKNWETNKFSGYPLYHSVYETYELVEKFYDPMFKYHLTVAQVRGGMVFELANSIVLPFDCRDYAVVLRKYADKIYSISMKHPQEMKTYSVSFDSLFSAVKNFTEIASKFSERLQDFDKSNPIVLRMMNDQLMFLERAFIDPLGLPDRPFYRHVIYAPSSHNKYAGESFPGIYDALFDIESKVDPSKAWGEVKRQIYVAAFTVQAAAETLSEVA,./data/raw/alphafold//AF-Q04609-F1-model_v4.pdb,5628,2408,3034,3506 +3460,9638,9789,MNVSAESGAPRRAGQRHEVGLAQLPPAPPTTVAVIEGLATGTPRRVVNQSDAADRVAELFLDPGQRERIPRVYQKSRITTRRMAVDPLDAKFDVFRREPATIRDRMHLFYEHAVPLAVDVSKRALAGLPYRAAEIGLLVLATSTGFIAPGVDVAIVKELGLSPSISRVVVNFMGCAAAMNALGTATNYVRAHPAMKALVVCIELCSVNAVFADDINDVVIHSLFGDGCAALVIGASQVQEKLEPGKVVVRSSFSQLLDNTEDGIVLGVNHNGITCELSENLPGYIFSGVAPVVTEMLWDNGLQISDIDLWAIHPGGPKIIEQSVRSLGISAELAAQSWDVLARFGNMLSVSLIFVLETMVQQAESAKAISTGVAFAFGPGVTVEGMLFDIIRR,sabio,P9WPF1,CCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O,0.0192,30.0,7.5,2.3.1.-,1773.0,-1.7166987712964503,-1.7166987712964503,CCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O__MNVSAESGAPRRAGQRHEVGLAQLPPAPPTTVAVIEGLATGTPRRVVNQSDAADRVAELFLDPGQRERIPRVYQKSRITTRRMAVDPLDAKFDVFRREPATIRDRMHLFYEHAVPLAVDVSKRALAGLPYRAAEIGLLVLATSTGFIAPGVDVAIVKELGLSPSISRVVVNFMGCAAAMNALGTATNYVRAHPAMKALVVCIELCSVNAVFADDINDVVIHSLFGDGCAALVIGASQVQEKLEPGKVVVRSSFSQLLDNTEDGIVLGVNHNGITCELSENLPGYIFSGVAPVVTEMLWDNGLQISDIDLWAIHPGGPKIIEQSVRSLGISAELAAQSWDVLARFGNMLSVSLIFVLETMVQQAESAKAISTGVAFAFGPGVTVEGMLFDIIRR,./data/raw/alphafold//AF-P9WPF1-F1-model_v4.pdb,3717,1385,2150,2056 +3461,23456,23816,MPLLDSFTVDHTRMEAPAVRVAKTMNTPHGDAITVFDLRFCVPNKEVMPERGIHTLEHLFAGFMRNHLNGNGVEIIDISPMGCRTGFYMSLIGTPDEQRVADAWKAAMEDVLKVQDQNQIPELNVYQCGTYQMHSLQEAQDIARSILERDVRINSNEELALPKEKLQELHI,sabio,P45578,NC(CCSCC1OC(O)C(O)C1O)C(=O)O,0.016,22.0,7.0,4.4.1.21,562.0,-1.7958800173440752,-1.7827155479829009,NC(CCSCC1OC(O)C(O)C1O)C(=O)O__MPLLDSFTVDHTRMEAPAVRVAKTMNTPHGDAITVFDLRFCVPNKEVMPERGIHTLEHLFAGFMRNHLNGNGVEIIDISPMGCRTGFYMSLIGTPDEQRVADAWKAAMEDVLKVQDQNQIPELNVYQCGTYQMHSLQEAQDIARSILERDVRINSNEELALPKEKLQELHI,./data/raw/alphafold//AF-P45578-F1-model_v4.pdb,4706,5875,7604,8558 +3462,36508,37143,MNYRYPPRYGPEWGSGGIYGLRFHNGTLYFTLAFEGEAHFITEDSHKIYEFELVGPRPTSGGDTYNAVEVVDEYIYFGGWVHAPAKYRGKGEGKATIDFSNKYSHVHEYDTENQEVRLVWKESIHHPSEWAGEVSDIIYNPYTDELLLAREDGHTNLGVYSLSRNGRIRLLNDKPSAKGCQMHDLAFFGIGKNYRKGLEEIHALDMITERWEVFPLGESLDGGKYIQPHLGGNGVSVNNRVFAFVRGGVFVGNPHNDEQFAFVRLFDFYTFYAPFRVNALPIGGGILVGFNAHHDAYYRPRTQEEMIYHRFTNTIPGPSVLVYFAPPMVKIVGVFGARITSIEKVDGKILVATNTTPNVGALDATPFDTGNKDIFVLPEKILQEKPPAVSFSVPLAFPSEGKRMGAGVFGGIPLDGYDNARLIIKASRDNRLKVYEYDLALPLRDADVEEFDIKKGRNVIDLRTFSGIVSFELESEDFSGVARIELW,brenda,Q8U4F6,O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,0.051,37.0,6.5,3.2.1.48,2261.0,-1.2924298239020635,-1.2924298239020635,O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1__MNYRYPPRYGPEWGSGGIYGLRFHNGTLYFTLAFEGEAHFITEDSHKIYEFELVGPRPTSGGDTYNAVEVVDEYIYFGGWVHAPAKYRGKGEGKATIDFSNKYSHVHEYDTENQEVRLVWKESIHHPSEWAGEVSDIIYNPYTDELLLAREDGHTNLGVYSLSRNGRIRLLNDKPSAKGCQMHDLAFFGIGKNYRKGLEEIHALDMITERWEVFPLGESLDGGKYIQPHLGGNGVSVNNRVFAFVRGGVFVGNPHNDEQFAFVRLFDFYTFYAPFRVNALPIGGGILVGFNAHHDAYYRPRTQEEMIYHRFTNTIPGPSVLVYFAPPMVKIVGVFGARITSIEKVDGKILVATNTTPNVGALDATPFDTGNKDIFVLPEKILQEKPPAVSFSVPLAFPSEGKRMGAGVFGGIPLDGYDNARLIIKASRDNRLKVYEYDLALPLRDADVEEFDIKKGRNVIDLRTFSGIVSFELESEDFSGVARIELW,./data/raw/alphafold//AF-Q8U4F6-F1-model_v4.pdb,2495,8118,9989,11172 +3463,22282,22630,MNSFLFSGGNMYDLIIIGGGPAGLAAGIYAVRFGLDTLVLEKSEISGQISMSDIVENYPGFPSISGLELMEKYRTHAQEVGVKTKITEVLSVRTEGAKKIVSTDSGDLEAKTLIIATGANPKHLGVPGEKEFISKGVSYCAICDGPFFKNKTVVVVGGGNSAVTDALLLSKVAQNVYLIHRRDRLKAAKVLQDRALATPNIEFILNTLVQEIAGSREGVKKVEKVILQDLNSKESRELSTNGVFIYVGIQPNTEFVNVEKNNEGFIITNRWMETSEKGIYAAGDCRDTPIWQLVAAVRDGAIAATAANEYIESLK,sabio,Q8TR16,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,0.736,,,1.8.1.9,2214.0,-0.1331221856625011,-0.1331221856625011,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1__MNSFLFSGGNMYDLIIIGGGPAGLAAGIYAVRFGLDTLVLEKSEISGQISMSDIVENYPGFPSISGLELMEKYRTHAQEVGVKTKITEVLSVRTEGAKKIVSTDSGDLEAKTLIIATGANPKHLGVPGEKEFISKGVSYCAICDGPFFKNKTVVVVGGGNSAVTDALLLSKVAQNVYLIHRRDRLKAAKVLQDRALATPNIEFILNTLVQEIAGSREGVKKVEKVILQDLNSKESRELSTNGVFIYVGIQPNTEFVNVEKNNEGFIITNRWMETSEKGIYAAGDCRDTPIWQLVAAVRDGAIAATAANEYIESLK,./data/raw/alphafold//AF-Q8TR16-F1-model_v4.pdb,4108,4948,6818,6800 +3464,10443,10598,MTEQRPLTIALVAGETSGDILGAGLIRALKEHVPNARFVGVAGPRMQAEGCEAWYEMEELAVMGIVEVLGRLRRLLHIRADLTKRFGELKPDVFVGIDAPDFNITLEGNLKKQGIKTIHYVSPSVWAWRQKRVFKIGRATDLVLAFLPFEKAFYDKYNVPCRFIGHTMADAMPLDPDKNAARDVLGIPHDAHCLALLPGSRGAEVEMLSADFLKTAQLLRQTYPDLEIVVPLVNAKRREQFERIKAEVAPDLSVHLLDGMGREAMVASDAALLASGTAALECMLAKCPMVVGYRMKPFTFWLAKRLVKTDYVSLPNLLAGRELVKELLQEECEPQKLAAALLPLLANGKTSHAMHDTFRELHQQIRCNADEQAAQAVLELAQ,sabio,P10441,CCCCCCCCCCCC(O)CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(=O)CC(O)CCCCCCCCCCC,0.287,30.0,8.0,2.4.1.182,562.0,-0.5421181032660077,-0.5421181032660077,CCCCCCCCCCCC(O)CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(=O)CC(O)CCCCCCCCCCC__MTEQRPLTIALVAGETSGDILGAGLIRALKEHVPNARFVGVAGPRMQAEGCEAWYEMEELAVMGIVEVLGRLRRLLHIRADLTKRFGELKPDVFVGIDAPDFNITLEGNLKKQGIKTIHYVSPSVWAWRQKRVFKIGRATDLVLAFLPFEKAFYDKYNVPCRFIGHTMADAMPLDPDKNAARDVLGIPHDAHCLALLPGSRGAEVEMLSADFLKTAQLLRQTYPDLEIVVPLVNAKRREQFERIKAEVAPDLSVHLLDGMGREAMVASDAALLASGTAALECMLAKCPMVVGYRMKPFTFWLAKRLVKTDYVSLPNLLAGRELVKELLQEECEPQKLAAALLPLLANGKTSHAMHDTFRELHQQIRCNADEQAAQAVLELAQ,./data/raw/alphafold//AF-P10441-F1-model_v4.pdb,5440,3098,3829,4448 +3465,16531,16772,MSVKWTSVILLIQLSFCFSSGNCGKVLVWAAEYSHWMNIKTILDELIQRGHEVTVLASSASILFDPNNSSALKIEIYPTSLTKTELENFIMQQIKRWSDLPKDTFWLYFSQVQEIMSIFGDITRKFCKDVVSNKKFMKKVQESRFDVIFADAIFPCSELLAELFNIPFVYSLSFSPGYTFEKHSGGFIFPPSYVPVVMSELTDQMTFMERVKNMIYVLYFDFWFEIFDMKKWDQFYSEVLGRPTTLSETMGKADVWLIRNSWNFQFPYPLLPNVDFVGGLHCKPAKPLPKEMEDFVQSSGENGVVVFSLGSMVSNMTEERANVIASALAQIPQKVLWRFDGNKPDTLGLNTRLYKWIPQNDLLGHPKTRAFITHGGANGIYEAIYHGIPMVGIPLFADQPDNIAHMKARGAAVRVDFNTMSSTDLLNALKRVINDPSYKENVMKLSRIQHDQPVKPLDRAVFWIEFVMRHKGAKHLRVAAHDLTWFQYHSLDVIGFLLVCVATVIFIVTKCCLFCFWKFARKAKKGKND,sabio,P16662,C[C@]12CC[C@@H]3c4cc(O)c(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2O,0.014,37.0,7.4,2.4.1.17,9606.0,-1.853871964321762,-1.8873453591370688,C[C@]12CC[C@@H]3c4cc(O)c(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2O__MSVKWTSVILLIQLSFCFSSGNCGKVLVWAAEYSHWMNIKTILDELIQRGHEVTVLASSASILFDPNNSSALKIEIYPTSLTKTELENFIMQQIKRWSDLPKDTFWLYFSQVQEIMSIFGDITRKFCKDVVSNKKFMKKVQESRFDVIFADAIFPCSELLAELFNIPFVYSLSFSPGYTFEKHSGGFIFPPSYVPVVMSELTDQMTFMERVKNMIYVLYFDFWFEIFDMKKWDQFYSEVLGRPTTLSETMGKADVWLIRNSWNFQFPYPLLPNVDFVGGLHCKPAKPLPKEMEDFVQSSGENGVVVFSLGSMVSNMTEERANVIASALAQIPQKVLWRFDGNKPDTLGLNTRLYKWIPQNDLLGHPKTRAFITHGGANGIYEAIYHGIPMVGIPLFADQPDNIAHMKARGAAVRVDFNTMSSTDLLNALKRVINDPSYKENVMKLSRIQHDQPVKPLDRAVFWIEFVMRHKGAKHLRVAAHDLTWFQYHSLDVIGFLLVCVATVIFIVTKCCLFCFWKFARKAKKGKND,./data/raw/alphafold//AF-P16662-F1-model_v4.pdb,681,3375,3379,1290 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+3477,6722,6852,MKNRRLNFKLFFLIIFSLFSTLSWSKTITLYLDPASLPALNQLMDFTQNNEDKTHPRIFGLSRFKIPDNIITQYQNIHFVELKDNRPTEALFTILDQYPGNIELNIHLNIAHSVQLIRPILAYRFKHLDRVSIQQLNLYDDGSMEYVDLEKEENKDISAEIKQAEKQLSHYLLTGKIKFDNPTIARYVWQSAFPVKYHFLSTDYFEKAEFLQPLKEYLAENYQKMDWTAYQQLTPEQQAFYLTLVGFNDEVKQSLEVQQAKFIFTGTTTWEGNTDVREYYAQQQLNLLNHFTQAEGDLFIGDHYKIYFKGHPRGGEINDYILNNAKNITNIPANISFEVLMMTGLLPDKVGGVASSLYFSLPKEKISHIIFTSNKQVKSKEDALNNPYVKVMRRLGIIDESQVIFWDSLKQL,brenda,Q15KI8,CC(O)=N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O,17.0,37.0,8.5,2.4.99.6,747.0,1.230448921378274,1.230448921378274,CC(O)=N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O__MKNRRLNFKLFFLIIFSLFSTLSWSKTITLYLDPASLPALNQLMDFTQNNEDKTHPRIFGLSRFKIPDNIITQYQNIHFVELKDNRPTEALFTILDQYPGNIELNIHLNIAHSVQLIRPILAYRFKHLDRVSIQQLNLYDDGSMEYVDLEKEENKDISAEIKQAEKQLSHYLLTGKIKFDNPTIARYVWQSAFPVKYHFLSTDYFEKAEFLQPLKEYLAENYQKMDWTAYQQLTPEQQAFYLTLVGFNDEVKQSLEVQQAKFIFTGTTTWEGNTDVREYYAQQQLNLLNHFTQAEGDLFIGDHYKIYFKGHPRGGEINDYILNNAKNITNIPANISFEVLMMTGLLPDKVGGVASSLYFSLPKEKISHIIFTSNKQVKSKEDALNNPYVKVMRRLGIIDESQVIFWDSLKQL,./data/raw/alphafold//AF-Q15KI8-F1-model_v4.pdb,5780,2580,3226,3715 +3478,10998,11154,MTEKSPHSAFGDGAKAYDVPAFGLQIHTVEHGSGAPIVFLHGNPTSSYLWRHIFRRLHGHGRLLAVDLIGYGQSSKPDIEYTLENQQRYVDAWFDALDLRNVTLVLQDYGAAFGLNWASRNPDRVRAVAFFEPVLRNIDSVDLSPEFVTRRAKLRQPGEGEIFVQQENRFLTELFPWFFLTPLAPEDLRQYQTPFPTPHSRKAILAGPRNLPVDGEPASTVAFLEQAVNWLNTSDTPKLLLTFKPGFLLTDAILKWSQVTIRNLEIEAAGAGIHFVQEEQPETIARLLDAWLTRIAGN,brenda,E2RV69,CCCCCCCl,0.07,37.0,8.6,3.8.1.5,358.0,-1.154901959985743,-1.154901959985743,CCCCCCCl__MTEKSPHSAFGDGAKAYDVPAFGLQIHTVEHGSGAPIVFLHGNPTSSYLWRHIFRRLHGHGRLLAVDLIGYGQSSKPDIEYTLENQQRYVDAWFDALDLRNVTLVLQDYGAAFGLNWASRNPDRVRAVAFFEPVLRNIDSVDLSPEFVTRRAKLRQPGEGEIFVQQENRFLTELFPWFFLTPLAPEDLRQYQTPFPTPHSRKAILAGPRNLPVDGEPASTVAFLEQAVNWLNTSDTPKLLLTFKPGFLLTDAILKWSQVTIRNLEIEAAGAGIHFVQEEQPETIARLLDAWLTRIAGN,./data/raw/alphafold//AF-E2RV69-F1-model_v4.pdb,2988,193,212,234 +3479,4725,4798,MLAKGLPPRSVLVKGCQTFLSAPREGLGRLRVPTGEGAGISTRSPRPFNEIPSPGDNGWLNLYHFWRETGTHKVHLHHVQNFQKYGPIYREKLGNVESVYVIDPEDVALLFKSEGPNPERFLIPPWVAYHQYYQRPIGVLLKKSAAWKKDRVALNQEVMAPEATKNFLPLLDAVSRDFVSVLHRRIKKAGSGNYSGDISDDLFRFAFESITNVIFGERQGMLEEVVNPEAQRFIDAIYQMFHTSVPMLNLPPDLFRLFRTKTWKDHVAAWDVIFSKADIYTQNFYWELRQKGSVHHDYRGILYRLLGDSKMSFEDIKANVTEMLAGGVDTTSMTLQWHLYEMARNLKVQDMLRAEVLAARHQAQGDMATMLQLVPLLKASIKETLRLHPISVTLQRYLVNDLVLRDYMIPAKTLVQVAIYALGREPTFFFDPENFDPTRWLSKDKNITYFRNLGFGWGVRQCLGRRIAELEMTIFLINMLENFRVEIQHLSDVGTTFNLILMPEKPISFTFWPFNQEATQQ,sabio,P05108,CC(C)CCCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C,0.164,37.0,7.4,1.14.15.6,9606.0,-0.7851561519523022,-0.7851561519523022,CC(C)CCCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C__MLAKGLPPRSVLVKGCQTFLSAPREGLGRLRVPTGEGAGISTRSPRPFNEIPSPGDNGWLNLYHFWRETGTHKVHLHHVQNFQKYGPIYREKLGNVESVYVIDPEDVALLFKSEGPNPERFLIPPWVAYHQYYQRPIGVLLKKSAAWKKDRVALNQEVMAPEATKNFLPLLDAVSRDFVSVLHRRIKKAGSGNYSGDISDDLFRFAFESITNVIFGERQGMLEEVVNPEAQRFIDAIYQMFHTSVPMLNLPPDLFRLFRTKTWKDHVAAWDVIFSKADIYTQNFYWELRQKGSVHHDYRGILYRLLGDSKMSFEDIKANVTEMLAGGVDTTSMTLQWHLYEMARNLKVQDMLRAEVLAARHQAQGDMATMLQLVPLLKASIKETLRLHPISVTLQRYLVNDLVLRDYMIPAKTLVQVAIYALGREPTFFFDPENFDPTRWLSKDKNITYFRNLGFGWGVRQCLGRRIAELEMTIFLINMLENFRVEIQHLSDVGTTFNLILMPEKPISFTFWPFNQEATQQ,./data/raw/alphafold//AF-P05108-F1-model_v4.pdb,5094,1948,1565,2905 +3480,38623,39305,MAKSSEIEHPVKAFGWAARDTTGLLSPFKFSRRATGEKDVRLKVLFCGVCHSDHHMIHNNWGFTTYPIVPGHEIVGVVTEVGSKVEKVKVGDNVGIGCLVGSCRSCESCCDNRESHCENTIDTYGSIYFDGTMTHGGYSDTMVADEHFILRWPKNLPLDSGAPLLCAGITTYSPLKYYGLDKPGTKIGVVGLGGLGHVAVKMAKAFGAQVTVIDISESKRKEALEKLGADSFLLNSDQEQMKGARSSLDGIIDTVPVNHPLAPLFDLLKPNGKLVMVGAPEKPFELPVFSLLKGRKLLGGTINGGIKETQEMLDFAAKHNITADVEVIPMDYVNTAMERLVKSDVRYRFVIDIANTMRTEESLGA,uniprot_search,Q38707,OC[C@H]1OC(O)[C@@H](O)[C@@H](O)[C@@H]1O,745.0,25.0,8.0,1.1.1.255,4045.0,2.8721562727482928,2.8721562727482928,OC[C@H]1OC(O)[C@@H](O)[C@@H](O)[C@@H]1O__MAKSSEIEHPVKAFGWAARDTTGLLSPFKFSRRATGEKDVRLKVLFCGVCHSDHHMIHNNWGFTTYPIVPGHEIVGVVTEVGSKVEKVKVGDNVGIGCLVGSCRSCESCCDNRESHCENTIDTYGSIYFDGTMTHGGYSDTMVADEHFILRWPKNLPLDSGAPLLCAGITTYSPLKYYGLDKPGTKIGVVGLGGLGHVAVKMAKAFGAQVTVIDISESKRKEALEKLGADSFLLNSDQEQMKGARSSLDGIIDTVPVNHPLAPLFDLLKPNGKLVMVGAPEKPFELPVFSLLKGRKLLGGTINGGIKETQEMLDFAAKHNITADVEVIPMDYVNTAMERLVKSDVRYRFVIDIANTMRTEESLGA,./data/raw/alphafold//AF-Q38707-F1-model_v4.pdb,143,2893,6655,6614 +3481,17427,17677,MGRPRPRAAKTWMFLLLLGGAWAGHSRAQEDKVLGGHECQPHSQPWQAALFQGQQLLCGGVLVGGNWVLTAAHCKKPKYTVRLGDHSLQNKDGPEQEIPVVQSIPHPCYNSSDVEDHNHDLMLLQLRDQASLGSKVKPISLADHCTQPGQKCTVSGWGTVTSPRENFPDTLNCAEVKIFPQKKCEDAYPGQITDGMVCAGSSKGADTCQGDSGGPLVCDGALQGITSWGSDPCGRSDKPGVYTNICRYLDWIKKIIGSKG,uniprot_search,O60259,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](C)N=C(O)[C@H](CCC(=N)O)N=C(O)OC(C)(C)C)ccc12,0.1844,37.0,8.5,3.4.21.118,9606.0,-0.7342390832823895,-0.7342390832823895,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](C)N=C(O)[C@H](CCC(=N)O)N=C(O)OC(C)(C)C)ccc12__MGRPRPRAAKTWMFLLLLGGAWAGHSRAQEDKVLGGHECQPHSQPWQAALFQGQQLLCGGVLVGGNWVLTAAHCKKPKYTVRLGDHSLQNKDGPEQEIPVVQSIPHPCYNSSDVEDHNHDLMLLQLRDQASLGSKVKPISLADHCTQPGQKCTVSGWGTVTSPRENFPDTLNCAEVKIFPQKKCEDAYPGQITDGMVCAGSSKGADTCQGDSGGPLVCDGALQGITSWGSDPCGRSDKPGVYTNICRYLDWIKKIIGSKG,./data/raw/alphafold//AF-O60259-F1-model_v4.pdb,5239,2784,3461,4008 +3482,14943,15156,MNLPDNSIHLQLPRPVCEAIIRPVPEHRADQELSEIYRDLKATFGVPWVGVITQAVAYYRPFFAEAWRRFAPSAKTHFFERASDDIRIRSWELMGQSFVIEGQTDRLREMGYSVREIGQIRAVLDIFDYGNPKYLIFATAIKEGLLSGRTFGGAAGDARCHFPRSPICQIDPIPVMVEEHHAGGTLSQVYADIKQTLQLPFINSDYKAMARWPSYLEQAWGALKPCIDTPAYQAGRFDINARALAALDALPTAYRMSRDDALQAGLSEAQTDELIQVISLFQWMLSGLVLNVTHFKQQALK,brenda,Q52086,C[C@@H](Cl)C(=O)O,0.94,50.0,9.5,3.8.1.9,303.0,-0.0268721464003013,-0.0268721464003013,C[C@@H](Cl)C(=O)O__MNLPDNSIHLQLPRPVCEAIIRPVPEHRADQELSEIYRDLKATFGVPWVGVITQAVAYYRPFFAEAWRRFAPSAKTHFFERASDDIRIRSWELMGQSFVIEGQTDRLREMGYSVREIGQIRAVLDIFDYGNPKYLIFATAIKEGLLSGRTFGGAAGDARCHFPRSPICQIDPIPVMVEEHHAGGTLSQVYADIKQTLQLPFINSDYKAMARWPSYLEQAWGALKPCIDTPAYQAGRFDINARALAALDALPTAYRMSRDDALQAGLSEAQTDELIQVISLFQWMLSGLVLNVTHFKQQALK,./data/raw/alphafold//AF-Q52086-F1-model_v4.pdb,3759,1454,2247,2178 +3483,18181,18445,MYEVDHADVYDLFYLGRGKDYAAEASDIADLVRSRTPEASSLLDVACGTGTHLEHFTKEFGDTAGLELSEDMLTHARKRLPDATLHQGDMRDFRLGRKFSAVVSMFSSVGYLKTTEELGAAVASFAEHLEPGGVVVVEPWWFPETFADGWVSADVVRRDGRTVARVSHSVREGNATRMEVHFTVADPGKGVRHFSDVHLITLFHQAEYEAAFTAAGLRVEYLEGGPSGRGLFVGVPA,brenda,Q9ZGH6,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](C)[C@@H](O)[C@H](N)[C@H]3O)O2)c(=O)nc1O,0.2766,24.0,7.5,2.1.1.234,54571.0,-0.5581478242267082,-0.5581478242267082,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](C)[C@@H](O)[C@H](N)[C@H]3O)O2)c(=O)nc1O__MYEVDHADVYDLFYLGRGKDYAAEASDIADLVRSRTPEASSLLDVACGTGTHLEHFTKEFGDTAGLELSEDMLTHARKRLPDATLHQGDMRDFRLGRKFSAVVSMFSSVGYLKTTEELGAAVASFAEHLEPGGVVVVEPWWFPETFADGWVSADVVRRDGRTVARVSHSVREGNATRMEVHFTVADPGKGVRHFSDVHLITLFHQAEYEAAFTAAGLRVEYLEGGPSGRGLFVGVPA,./data/raw/alphafold//AF-Q9ZGH6-F1-model_v4.pdb,999,4447,5913,3283 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+3528,1977,2015,MSGLHILAFGAHADDVEIGMAGTIAKYTKQGYEVGICDLTEADLSSNGTIELRKEEAKAAARIMGVKTRLNLAMPDRGLYMKEEYIREIVKVIRTYKPKLVFAPYYEDRHPDHANCAKLVEEAIFSAGIRKYMPEVPPHRVESFYHYMINGFHKPNFCIDISEYVSQKVEALEAYESQFSTGSDGVKTPLTEGYVETVVAREKMFGKEVGVLYAEGFMSKKPVLLHADLIGGCK,sabio,Q81ST8,CC(=O)NC1C(O)OC(CO)C(O)C1O,57.1,37.0,7.4,3.5.1.-,1392.0,1.756636108245848,1.756636108245848,CC(=O)NC1C(O)OC(CO)C(O)C1O__MSGLHILAFGAHADDVEIGMAGTIAKYTKQGYEVGICDLTEADLSSNGTIELRKEEAKAAARIMGVKTRLNLAMPDRGLYMKEEYIREIVKVIRTYKPKLVFAPYYEDRHPDHANCAKLVEEAIFSAGIRKYMPEVPPHRVESFYHYMINGFHKPNFCIDISEYVSQKVEALEAYESQFSTGSDGVKTPLTEGYVETVVAREKMFGKEVGVLYAEGFMSKKPVLLHADLIGGCK,./data/raw/alphafold//AF-Q81ST8-F1-model_v4.pdb,3490,999,1196,1472 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+3532,27646,28125,MAASRLDFGEVETFLDRHPELFEDYLMRKGKQEMVEKWLQRHSQGQGALGPRPSLAGTSSLAHSTCRGGSSVGGGTGPNGSAHSQPLPGGGDCGGVPLSPSWAGGSRGDGNLQRRASQKELRKSFARSKAIHVNRTYDEQVTSRAQEPLSSVRRRALLRKASSLPPTTAHILSALLESRVNLPRYPPTAIDYKCHLKKHNERQFFLELVKDISNDLDLTSLSYKILIFVCLMVDADRCSLFLVEGAAAGKKTLVSKFFDVHAGTPLLPCSSTENSNEVQVPWGKGIIGYVGEHGETVNIPDAYQDRRFNDEIDKLTGYKTKSLLCMPIRSSDGEIIGVAQAINKIPEGAPFTEDDEKVMQMYLPFCGIAISNAQLFAASRKEYERSRALLEVVNDLFEEQTDLEKIVKKIMHRAQTLLKCERCSVLLLEDIESPVVKFTKSFELMSPKCSADAENSFKESMEKSSYSDWLINNSIAELVASTGLPVNISDAYQDPRFDAEADQISGFHIRSVLCVPIWNSNHQIIGVAQVLNRLDGKPFDDADQRLFEAFVIFCGLGINNTIMYDQVKKSWAKQSVALDVLSYHATCSKAEVDKFKAANIPLVSELAIDDIHFDDFSLDVDAMITAALRMFMELGMVQKFKIDYETLCRWLLTVRKNYRMVLYHNWRHAFNVCQLMFAMLTTAGFQDILTEVEILAVIVGCLCHDLDHRGTNNAFQAKSGSALAQLYGTSATLEHHHFNHAVMILQSEGHNIFANLSSKEYSDLMQLLKQSILATDLTLYFERRTEFFELVSKGEYDWNIKNHRDIFRSMLMTACDLGAVTKPWEISRQVAELVTSEFFEQGDRERLELKLTPSAIFDRNRKDELPRLQLEWIDSICMPLYQALVKVNVKLKPMLDSVATNRSKWEELHQKRLLASTASSSPASVMVAKEDRN,sabio,Q9HCR9,Nc1ncnc2c1ncn2C1OC2COP(=O)(O)OC2C1O,0.002,37.0,8.0,3.1.4.53,9606.0,-2.6989700043360187,-2.501824368597847,Nc1ncnc2c1ncn2C1OC2COP(=O)(O)OC2C1O__MAASRLDFGEVETFLDRHPELFEDYLMRKGKQEMVEKWLQRHSQGQGALGPRPSLAGTSSLAHSTCRGGSSVGGGTGPNGSAHSQPLPGGGDCGGVPLSPSWAGGSRGDGNLQRRASQKELRKSFARSKAIHVNRTYDEQVTSRAQEPLSSVRRRALLRKASSLPPTTAHILSALLESRVNLPRYPPTAIDYKCHLKKHNERQFFLELVKDISNDLDLTSLSYKILIFVCLMVDADRCSLFLVEGAAAGKKTLVSKFFDVHAGTPLLPCSSTENSNEVQVPWGKGIIGYVGEHGETVNIPDAYQDRRFNDEIDKLTGYKTKSLLCMPIRSSDGEIIGVAQAINKIPEGAPFTEDDEKVMQMYLPFCGIAISNAQLFAASRKEYERSRALLEVVNDLFEEQTDLEKIVKKIMHRAQTLLKCERCSVLLLEDIESPVVKFTKSFELMSPKCSADAENSFKESMEKSSYSDWLINNSIAELVASTGLPVNISDAYQDPRFDAEADQISGFHIRSVLCVPIWNSNHQIIGVAQVLNRLDGKPFDDADQRLFEAFVIFCGLGINNTIMYDQVKKSWAKQSVALDVLSYHATCSKAEVDKFKAANIPLVSELAIDDIHFDDFSLDVDAMITAALRMFMELGMVQKFKIDYETLCRWLLTVRKNYRMVLYHNWRHAFNVCQLMFAMLTTAGFQDILTEVEILAVIVGCLCHDLDHRGTNNAFQAKSGSALAQLYGTSATLEHHHFNHAVMILQSEGHNIFANLSSKEYSDLMQLLKQSILATDLTLYFERRTEFFELVSKGEYDWNIKNHRDIFRSMLMTACDLGAVTKPWEISRQVAELVTSEFFEQGDRERLELKLTPSAIFDRNRKDELPRLQLEWIDSICMPLYQALVKVNVKLKPMLDSVATNRSKWEELHQKRLLASTASSSPASVMVAKEDRN,./data/raw/alphafold//AF-Q9HCR9-F1-model_v4.pdb,1253,5524,5967,7594 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+3619,9406,9555,MIPYAAGVIVPLALTLLVRNAKKDKKRGVVVDDVGGEPGHTVRNHRFKDPVSSHWEDISTLPELFEISCKSHSDRFFLGTRRLIAREVETSEDGKVFEKLHLGDYEWKTFGETLEAVCSFASGLVQIGHKSEERVAIFADTREEWFIALQGCFRRNVTVVTIYSSLGEEALCHSLNETEVTTVICGNKELKKLMDISQQLETVKRVICMDDEFPSEASSTWTTTSLADVQKLGRESPVDPSFPLSADVAVIMYTSGSTGLPKGVMMTHGNVLATVSAVMTIVPDLGKRDTYMAYLPLAHILELAAESVMATIGSAIGYGSPLTLTDTSNKIKKGTKGDVTALKPTIMTAVPAILDRVRDGVRKKVDAKGGAAKKLFDFAYARRLSAINGSWFGAWGLEKLLWDVLVFGKIRAVLGGQLRYLLSGGAPLSGDTQRFINICVGAPIGQGYGLTETCAGGTFSEFDDTSVGRVGAPLPCSFVKLIDWPEGGYLISDKPMPRGEIVIGGSNITLGYFKNEEKTKEVYKVDEKGMRWFYTGDIGQFHPDGCLEIIDRKKDIVKLQHGEYVSLGKVEAALSISPYVENIMVHADPFYSYCVALVVAAQQTLEGWASKQGIEFTNFEELCAKEQPVKEVYASLVKAAKQSRLEKFEIPAKIKVLAAPWTPESGLVTAALKLKRDVIRKEFSEDLTKLYAS,brenda,Q9FNT6,CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)[O-],0.017,30.0,8.5,6.2.1.3,3708.0,-1.769551078621726,-1.769551078621726,CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)[O-]__MIPYAAGVIVPLALTLLVRNAKKDKKRGVVVDDVGGEPGHTVRNHRFKDPVSSHWEDISTLPELFEISCKSHSDRFFLGTRRLIAREVETSEDGKVFEKLHLGDYEWKTFGETLEAVCSFASGLVQIGHKSEERVAIFADTREEWFIALQGCFRRNVTVVTIYSSLGEEALCHSLNETEVTTVICGNKELKKLMDISQQLETVKRVICMDDEFPSEASSTWTTTSLADVQKLGRESPVDPSFPLSADVAVIMYTSGSTGLPKGVMMTHGNVLATVSAVMTIVPDLGKRDTYMAYLPLAHILELAAESVMATIGSAIGYGSPLTLTDTSNKIKKGTKGDVTALKPTIMTAVPAILDRVRDGVRKKVDAKGGAAKKLFDFAYARRLSAINGSWFGAWGLEKLLWDVLVFGKIRAVLGGQLRYLLSGGAPLSGDTQRFINICVGAPIGQGYGLTETCAGGTFSEFDDTSVGRVGAPLPCSFVKLIDWPEGGYLISDKPMPRGEIVIGGSNITLGYFKNEEKTKEVYKVDEKGMRWFYTGDIGQFHPDGCLEIIDRKKDIVKLQHGEYVSLGKVEAALSISPYVENIMVHADPFYSYCVALVVAAQQTLEGWASKQGIEFTNFEELCAKEQPVKEVYASLVKAAKQSRLEKFEIPAKIKVLAAPWTPESGLVTAALKLKRDVIRKEFSEDLTKLYAS,./data/raw/alphafold//AF-Q9FNT6-F1-model_v4.pdb,5834,2660,3318,3834 +3620,10290,10445,MAKRLLRGTLRLWGGRAAPCLPPASRCSHSGGEERLETSSAKKLTDIGTRRIFSLEHDIFRESVRKFFQEEVIPYHAEWEKAGEVSRELWEKAGKQGLLGISIADHHGGIGGDLYSSAIVWEEQAYSNCTGPGFGLHSDIVMPYITNYGSEEQIKRFIPEMVAGKCIGAIAMTEPGAGSDLQGIRTNAKKDGSDWILNGSKVFVTNGWLCDIVIIVAITNREAHSPAHGISLFLVENGMKGFIKGRKLDKIGLKAQDTAEFFFEDVRLPAGALLGEENKGYYYLMQELPQERLLISEIAVSASEFMFEETRDYVKQRKAFGKTVADLQTVKHKLAELKTSICVTRAFVDSCLQLHRVKRLDVATAAMAKYWASDLQNRVAYDCLQLHGGWGYMFECPIAKAYVDARVQTIYGGTNEIMKELIAREIIHDQ,uniprot_search,Q08D92,CCCCCCCCCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.13,34.0,7.5,1.3.8.8,9913.0,-0.8860566476931633,-0.8860566476931633,CCCCCCCCCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MAKRLLRGTLRLWGGRAAPCLPPASRCSHSGGEERLETSSAKKLTDIGTRRIFSLEHDIFRESVRKFFQEEVIPYHAEWEKAGEVSRELWEKAGKQGLLGISIADHHGGIGGDLYSSAIVWEEQAYSNCTGPGFGLHSDIVMPYITNYGSEEQIKRFIPEMVAGKCIGAIAMTEPGAGSDLQGIRTNAKKDGSDWILNGSKVFVTNGWLCDIVIIVAITNREAHSPAHGISLFLVENGMKGFIKGRKLDKIGLKAQDTAEFFFEDVRLPAGALLGEENKGYYYLMQELPQERLLISEIAVSASEFMFEETRDYVKQRKAFGKTVADLQTVKHKLAELKTSICVTRAFVDSCLQLHRVKRLDVATAAMAKYWASDLQNRVAYDCLQLHGGWGYMFECPIAKAYVDARVQTIYGGTNEIMKELIAREIIHDQ,./data/raw/alphafold//AF-Q08D92-F1-model_v4.pdb,5503,3038,3764,414 +3621,10146,10300,MGEDKETNILAGLGNTISQVENVVAASLRPLPTATGDGTYVAESTQTGLAKDLSHVDLKDVRTLAEVVKSAATGEPVDDKQYIMERVIQLAAGLPSTSRNAAELTKSFLNMLWNDLEHPPVSYLGADSMHRKADGSGNNRFWPQLGAAGSAYARSVRPKTMQSPSLPDPETIFDCLLRRKEYREHPNKISSVLFYLASIIIHDLFQTDPKDNSVSKTSSYLDLSPLYGNNQDEQNLVRTFKDGKLKPDCFATKRVLGFPPGVGVLLIMFNRFHNYVVDQLAAINECGRFTKPDESNVDEYAKYDNNLFQTGRLVTCGLYANIILKDYVRTILNINRTDSTWSLDPRMEMKDGLLGEAAAMATGNQVSAEFNVVYRWHACISKRDEKWTEDFHREIMPGVDPSTLSMQDFVAGLGRWQAGLPQEPLERPFSGLQRKPDGAFNDDDLVNLFEKSVEDCAGAFGASHVPAIFKSVEALGIMQARRWNLGTLNEFRQYFNLAPHKTFEDINSDPYIADQLKRLYDHPDLVEIYPGVVVEEAKDSMVPGSGLCTNFTISRAILSDAVALVRGDRFYTVDYTPKHLTNWAYNEIQPNNAVDQGQVFYKLVLRAFPNHFDGNSIYAHFPLVVPSENEKILKSLGVAEKYSWEKPSRISHPIFISSHAACMSILENQETFKVTWGRKIEFLMQRDKHQYGKDFMLSGDRPPNAASRKMMGSALYRDEWEAEVKNFYEQTTLKLLHKNSYKLAGVNQVDIVRDVANLAQVHFCSSVFSLPLKTDSNPRGIFAESELYKIMAAVFTAIFYDADIGKSFELNQAARTVTQQLGQLTMANVEIIAKTGLIANLVNRLHRRDVLSEYGIHMIQRLLDSGLPATEIVWTHILPTAGGMVANQAQLFSQCLDYYLSEEGSGHLPEINRLAKENTPEADELLTRYFMEGARLRSSVALPRVAAQPTVVEDNGEKLTIKAGQVVMCNLVSACMDPTAFPDPEKVKLDRDMNLYAHFGFGPHKCLGLDLCKTGLSTMLKVLGRLDNLRRAPGAQGQLKKLSGPGGIAKYMNEDQSGFTPFPSTMKIQWDGELPQLKEDF,brenda,Q6RET3,CCCCCCCC/C=C\CCCCCCCCCC(=O)O,0.0226,24.0,7.2,1.13.11.60,162425.0,-1.6458915608525992,-1.6458915608525992,CCCCCCCC/C=C\CCCCCCCCCC(=O)O__MGEDKETNILAGLGNTISQVENVVAASLRPLPTATGDGTYVAESTQTGLAKDLSHVDLKDVRTLAEVVKSAATGEPVDDKQYIMERVIQLAAGLPSTSRNAAELTKSFLNMLWNDLEHPPVSYLGADSMHRKADGSGNNRFWPQLGAAGSAYARSVRPKTMQSPSLPDPETIFDCLLRRKEYREHPNKISSVLFYLASIIIHDLFQTDPKDNSVSKTSSYLDLSPLYGNNQDEQNLVRTFKDGKLKPDCFATKRVLGFPPGVGVLLIMFNRFHNYVVDQLAAINECGRFTKPDESNVDEYAKYDNNLFQTGRLVTCGLYANIILKDYVRTILNINRTDSTWSLDPRMEMKDGLLGEAAAMATGNQVSAEFNVVYRWHACISKRDEKWTEDFHREIMPGVDPSTLSMQDFVAGLGRWQAGLPQEPLERPFSGLQRKPDGAFNDDDLVNLFEKSVEDCAGAFGASHVPAIFKSVEALGIMQARRWNLGTLNEFRQYFNLAPHKTFEDINSDPYIADQLKRLYDHPDLVEIYPGVVVEEAKDSMVPGSGLCTNFTISRAILSDAVALVRGDRFYTVDYTPKHLTNWAYNEIQPNNAVDQGQVFYKLVLRAFPNHFDGNSIYAHFPLVVPSENEKILKSLGVAEKYSWEKPSRISHPIFISSHAACMSILENQETFKVTWGRKIEFLMQRDKHQYGKDFMLSGDRPPNAASRKMMGSALYRDEWEAEVKNFYEQTTLKLLHKNSYKLAGVNQVDIVRDVANLAQVHFCSSVFSLPLKTDSNPRGIFAESELYKIMAAVFTAIFYDADIGKSFELNQAARTVTQQLGQLTMANVEIIAKTGLIANLVNRLHRRDVLSEYGIHMIQRLLDSGLPATEIVWTHILPTAGGMVANQAQLFSQCLDYYLSEEGSGHLPEINRLAKENTPEADELLTRYFMEGARLRSSVALPRVAAQPTVVEDNGEKLTIKAGQVVMCNLVSACMDPTAFPDPEKVKLDRDMNLYAHFGFGPHKCLGLDLCKTGLSTMLKVLGRLDNLRRAPGAQGQLKKLSGPGGIAKYMNEDQSGFTPFPSTMKIQWDGELPQLKEDF,./data/raw/alphafold//AF-Q6RET3-F1-model_v4.pdb,210,2979,3693,4290 +3622,169,177,MPCCDPYPWIGLNVGRLSSFPLLKYPQVRRWLAPFIVACSLYFLLWIPEDQPSWVSALVKCQPILCLVLFLWAVAPGGSYTWLLQGALTCSAVGDACLIWPEAFFYGMAVFSVAHLLYLWAFGLSPLQPGLLLCTTLASLTYYSFLLLHLEPNMVLPVAAYGLILNTMLWRGLVLGRSAGWGAVLFIFSDGVLAWDTFVYTLPFARLVTMSTYYAAQLLLTLSALRSPGLKTH,sabio,B0BNF0,*C=COCC(O)COP(=O)(O)OCC[N+](C)(C)C,0.0055,37.0,6.9,3.3.2.2,10116.0,-2.2596373105057563,-1.0145941945637411,*C=COCC(O)COP(=O)(O)OCC[N+](C)(C)C__MPCCDPYPWIGLNVGRLSSFPLLKYPQVRRWLAPFIVACSLYFLLWIPEDQPSWVSALVKCQPILCLVLFLWAVAPGGSYTWLLQGALTCSAVGDACLIWPEAFFYGMAVFSVAHLLYLWAFGLSPLQPGLLLCTTLASLTYYSFLLLHLEPNMVLPVAAYGLILNTMLWRGLVLGRSAGWGAVLFIFSDGVLAWDTFVYTLPFARLVTMSTYYAAQLLLTLSALRSPGLKTH,./data/raw/alphafold//AF-B0BNF0-F1-model_v4.pdb,2933,116,125,139 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RDLAGINLDSTLADLGLDSLMGVEVRQILEREHDLVLPMREVRQLTLRKLQEMSSKTDSATDTTAPKSRSDTSLKQNQLNLSTLLVNPEGPTLTQLNSVQSSERPLFLVHPIEGSTTVFHSLAAKLSVPTYGLQCTQAAPLDSIPNLAAYYIDCIKQVQPEGPYRIAGYSFGACVAFEMCSQLQAQQGPAPTHNNLFLFDGSHTYVLAYTQSYRAKMTPGCEAEAEAEALCFFIKQFLDVEHSKVLEALLPLKSLEDRVAASVDLITKSHHSLDRRELSFAAVSFYHKLRAADQYKPKAKYHGNVTLLRAKTGGTYGEDLGADYNLSQVCDGKVSVHIIEGDHRTLLEGSGLESIINIIHSSLAEPRVSVREG,./data/raw/alphafold//AF-P19096-F1-model_v4.pdb,3460,274,1142,359 +3726,19199,19476,MASFSAAVAQFSRVSPTLTLLHSHSHDRLFHSQCRPFFLSRPSHSLRKGLTLPRGREAPSTTVRASFTDVSPSVSLEEKQLPKGETWSVHKFGGTCVGTSQRIKNVADIILKDDSERKLVVVSAMSKVTDMMYDLIHKAQSRDESYIAALDAVSEKHSATAHDILDGDNLASFLSKLHHDISNLKAMLRAIYIAGHATESFTDFVVGHGELWSAQMLSLVITKNGADCKWMDTRDVLIVNPTGSNQVDPDYLESEQRLEKWYSLNPCKVIIATGFIASTPQNIPTTLKRDGSDFSAAIMGALFKARQVTIWTDVDGVYSADPRKVSEAVILKTLSYQEAWEMSYFGANVLHPRTIIPVMRYGIPIMIRNIFNLSAPGTKICHPSVNDHEDRQNLQNFVKGFATIDNLALVNVEGTGMAGVPGTASAIFGAVKDVGANVIMISQASSEHSVCFAVPEKEVKAVAEALQSRFRQALDNGRLSQVAVIPNCSILAAVGQKMASTPGVSASLFNALAKANINVRAIAQGCSEYNITVVVKREDCIKALRAVHSRFYLSRTTIAMGIIGPGLIGSTLLDQLRDQASTLKEEFNIDLRVMGILGSKSMLLSDVGIDLARWRELREERGEVANVEKFVQHVHGNHFIPNTALVDCTADSAIAGYYYDWLRKGIHVVTPNKKANSGPLDQYLKLRALQRQSYTHYFYEATVGAGLPIVSTLRGLLETGDKILQIEGIFSGTLSYIFNNFKDGRAFSEVVSEAKEAGYTEPDPRDDLSGTDVARKVIILARESGLKLELSNIPVESLVPEPLRACASAQEFMQEPPKFDQEFTKKQEDAENAGEVLRYVGVVDVTNEKGVVELRRYKKDHPFAQLSGSDNIIAFTTRRYKDQPLIVRGPGAGAQVTAGGIFSDILRLA,brenda,O65027,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.213,25.0,8.0,1.1.1.3,3847.0,-0.6716203965612623,-0.6716203965612623,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MASFSAAVAQFSRVSPTLTLLHSHSHDRLFHSQCRPFFLSRPSHSLRKGLTLPRGREAPSTTVRASFTDVSPSVSLEEKQLPKGETWSVHKFGGTCVGTSQRIKNVADIILKDDSERKLVVVSAMSKVTDMMYDLIHKAQSRDESYIAALDAVSEKHSATAHDILDGDNLASFLSKLHHDISNLKAMLRAIYIAGHATESFTDFVVGHGELWSAQMLSLVITKNGADCKWMDTRDVLIVNPTGSNQVDPDYLESEQRLEKWYSLNPCKVIIATGFIASTPQNIPTTLKRDGSDFSAAIMGALFKARQVTIWTDVDGVYSADPRKVSEAVILKTLSYQEAWEMSYFGANVLHPRTIIPVMRYGIPIMIRNIFNLSAPGTKICHPSVNDHEDRQNLQNFVKGFATIDNLALVNVEGTGMAGVPGTASAIFGAVKDVGANVIMISQASSEHSVCFAVPEKEVKAVAEALQSRFRQALDNGRLSQVAVIPNCSILAAVGQKMASTPGVSASLFNALAKANINVRAIAQGCSEYNITVVVKREDCIKALRAVHSRFYLSRTTIAMGIIGPGLIGSTLLDQLRDQASTLKEEFNIDLRVMGILGSKSMLLSDVGIDLARWRELREERGEVANVEKFVQHVHGNHFIPNTALVDCTADSAIAGYYYDWLRKGIHVVTPNKKANSGPLDQYLKLRALQRQSYTHYFYEATVGAGLPIVSTLRGLLETGDKILQIEGIFSGTLSYIFNNFKDGRAFSEVVSEAKEAGYTEPDPRDDLSGTDVARKVIILARESGLKLELSNIPVESLVPEPLRACASAQEFMQEPPKFDQEFTKKQEDAENAGEVLRYVGVVDVTNEKGVVELRRYKKDHPFAQLSGSDNIIAFTTRRYKDQPLIVRGPGAGAQVTAGGIFSDILRLA,./data/raw/alphafold//AF-O65027-F1-model_v4.pdb,4028,1893,6668,6629 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+3736,37180,37837,MGKVAVAATVVCAAAVTAAAVVVVRHRMKNSGKWAKAMEILKEFEDKCGTPVSKLRQVADAMTVEMHAGLASDGGSKLKMLISYVDNLPTGDETGIFYALDLGGTNFRVLRVKLGGVGNVKKEFKEVSIPPNLMIGKSEDLFDFIAGELAKFVATEDEDMQIPPGTQRELGFTFSFPVKQSSIAGGTLVRWTKGFNIEDAVGADVVEELTKAMERAGLDMRVSALVNDTVGTLAGGRYGNSDVIAAVILGTGTNAAYVERANAIPKWQGLLPKSGEMVINMEWGNFRSSHLPLTEYDEGLDGDSLNPGEQIYEKLISGMYLGEVVRRVLLKMAEEAEFFGDIVPSKLQKPFILRTPDMSAMHHDSTPDLKVVATKLKDILEISNTSLKMRKVIVEVCDLVATRGARLSAAGILGILKKIGKDTCKEGEENQKSVIAMDGGLFEHYTKFRKTMQDTMNELLGEEISKNIIVELSNDGSGLGAALLAASHSQYLEYIEST,brenda,B8K2W7,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,1.791,22.0,8.2,2.7.1.1,4232.0,0.2530955858490315,0.173959496293772,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MGKVAVAATVVCAAAVTAAAVVVVRHRMKNSGKWAKAMEILKEFEDKCGTPVSKLRQVADAMTVEMHAGLASDGGSKLKMLISYVDNLPTGDETGIFYALDLGGTNFRVLRVKLGGVGNVKKEFKEVSIPPNLMIGKSEDLFDFIAGELAKFVATEDEDMQIPPGTQRELGFTFSFPVKQSSIAGGTLVRWTKGFNIEDAVGADVVEELTKAMERAGLDMRVSALVNDTVGTLAGGRYGNSDVIAAVILGTGTNAAYVERANAIPKWQGLLPKSGEMVINMEWGNFRSSHLPLTEYDEGLDGDSLNPGEQIYEKLISGMYLGEVVRRVLLKMAEEAEFFGDIVPSKLQKPFILRTPDMSAMHHDSTPDLKVVATKLKDILEISNTSLKMRKVIVEVCDLVATRGARLSAAGILGILKKIGKDTCKEGEENQKSVIAMDGGLFEHYTKFRKTMQDTMNELLGEEISKNIIVELSNDGSGLGAALLAASHSQYLEYIEST,./data/raw/alphafold//AF-B8K2W7-F1-model_v4.pdb,951,4388,6126,7467 +3737,26658,27115,MVPFSLLRTTRPLQRCGQLVCMAARAQHSEVAQKQAGEAAGGWTGQESLSDSDPEIWELLQREKDRQCRGLELIASENFCSRAALEALGSCLNNKYSEGYPGKRYYGGAEVVDEIELLCQRRALEAFDLDPAQWGVNVQPYSGSPANLAAYTALLQPHDRIMGLDLPDGGHLTHGYMSDVKRISATSIFFESMPYKLNPQTGLIDYDQLALTARLFRPRLIIAGTSAYARLIDYARMREVCDEVKAHLLADMAHISGLVAAKVIPSPFKYADIVTTTTHKTLRGARSGLIFYRKGVRTVDPKTGQEIPYTFEDRINFAVFPSLQGGPHNHAIAAVAVALKQACTPMFREYSLQVLRNAQAMADALLKRGYSLVSGGTDTHLVLVDLRPKGLDGARAERVLELVSITANKNTCPGDRSAITPGGLRLGAPALTSRQFREDDFRRVVDFIDEGVNIGLEVKRKTAKLQDFKSFLLKDPETSQRLANLRQQVEQFARGFPMPGFDER,sabio,Q5U3Z7,Nc1nc2c(c(=O)[nH]1)N1CN(c3ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc3)CC1CN2,0.13,37.0,7.3,2.1.2.1,10116.0,-0.8860566476931633,-0.8860566476931633,Nc1nc2c(c(=O)[nH]1)N1CN(c3ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc3)CC1CN2__MVPFSLLRTTRPLQRCGQLVCMAARAQHSEVAQKQAGEAAGGWTGQESLSDSDPEIWELLQREKDRQCRGLELIASENFCSRAALEALGSCLNNKYSEGYPGKRYYGGAEVVDEIELLCQRRALEAFDLDPAQWGVNVQPYSGSPANLAAYTALLQPHDRIMGLDLPDGGHLTHGYMSDVKRISATSIFFESMPYKLNPQTGLIDYDQLALTARLFRPRLIIAGTSAYARLIDYARMREVCDEVKAHLLADMAHISGLVAAKVIPSPFKYADIVTTTTHKTLRGARSGLIFYRKGVRTVDPKTGQEIPYTFEDRINFAVFPSLQGGPHNHAIAAVAVALKQACTPMFREYSLQVLRNAQAMADALLKRGYSLVSGGTDTHLVLVDLRPKGLDGARAERVLELVSITANKNTCPGDRSAITPGGLRLGAPALTSRQFREDDFRRVVDFIDEGVNIGLEVKRKTAKLQDFKSFLLKDPETSQRLANLRQQVEQFARGFPMPGFDER,./data/raw/alphafold//AF-Q5U3Z7-F1-model_v4.pdb,4447,5484,1641,3771 +3738,17862,18122,MDSLVVLVLCLSCLLLLSLWRQSSGRGKLPPGPTPLPVIGNILQIGIKDISKSLTNLSKVYGPVFTLYFGLKPIVVLHGYEAVKEALIDLGEEFSGRGIFPLAERANRGFGIVFSNGKKWKEIRRFSLMTLRNFGMGKRSIEDRVQEEARCLVEELRKTKASPCDPTFILGCAPCNVICSIIFHKRFDYKDQQFLNLMEKLNENIKILSSPWIQICNNFSPIIDYFPGTHNKLLKNVAFMKSYILEKVKEHQESMDMNNPQDFIDCFLMKMEKEKHNQPSEFTIESLENTAVDLFGAGTETTSTTLRYALLLLLKHPEVTAKVQEEIERVIGRNRSPCMQDRSHMPYTDAVVHEVQRYIDLLPTSLPHAVTCDIKFRNYLIPKGTTILISLTSVLHDNKEFPNPEMFDPHHFLDEGGNFKKSKYFMPFSAGKRICVGEALAGMELFLFLTSILQNFNLKSLVDPKNLDTTPVVNGFASVPPFYQLCFIPV,sabio,P11712,Cc1ccc(S(=O)(=O)NC(O)=NN2CC3CCCC3C2)cc1,0.00518,37.0,,1.14.14.1,9606.0,-2.285670240254767,-2.260191969826784,Cc1ccc(S(=O)(=O)NC(O)=NN2CC3CCCC3C2)cc1__MDSLVVLVLCLSCLLLLSLWRQSSGRGKLPPGPTPLPVIGNILQIGIKDISKSLTNLSKVYGPVFTLYFGLKPIVVLHGYEAVKEALIDLGEEFSGRGIFPLAERANRGFGIVFSNGKKWKEIRRFSLMTLRNFGMGKRSIEDRVQEEARCLVEELRKTKASPCDPTFILGCAPCNVICSIIFHKRFDYKDQQFLNLMEKLNENIKILSSPWIQICNNFSPIIDYFPGTHNKLLKNVAFMKSYILEKVKEHQESMDMNNPQDFIDCFLMKMEKEKHNQPSEFTIESLENTAVDLFGAGTETTSTTLRYALLLLLKHPEVTAKVQEEIERVIGRNRSPCMQDRSHMPYTDAVVHEVQRYIDLLPTSLPHAVTCDIKFRNYLIPKGTTILISLTSVLHDNKEFPNPEMFDPHHFLDEGGNFKKSKYFMPFSAGKRICVGEALAGMELFLFLTSILQNFNLKSLVDPKNLDTTPVVNGFASVPPFYQLCFIPV,./data/raw/alphafold//AF-P11712-F1-model_v4.pdb,3222,878,1384,3161 +3739,6218,6313,MTTKDPESEHPSVTLFRQYLRICTVQPNPDYGGAITFLEERARQLGLSCQKIEVVPGFVITVLTWPGTNPSLPSILLNSHTDVVPVFKEHWHHDPFEAFKDSEGYIYARGSQDMKSVSIQYLEAVRRLKSEGHRFPRTIHMTFVPDEEVGGHKGMELFVKRPEFQALRAGFALDEGLANPTDAFTVFYSERSPWWVRVTSTGKPGHASRFIEDTAAEKLHKVISSILAFREKERQRLQANPHLKEGAVTSVNLTKLEGGVAYNVVPATMSASFDFRVAPDVDMKAFEKQLQRWCQEAGEGVTFEFAQKFTEPRMTPTDDSDPWWAAFSGACKAMNLTLEPEIFPAATDSRYIRAVGIPALGFSPMNRTPVLLHDHNERLHEDIFLRGVDIYTGLLSALASVPTLPGES,brenda,Q99JW2,CC(O)=N[C@@H](CCCCN)C(=O)O,1.3,37.0,7.5,3.5.1.14,10090.0,0.1139433523068367,0.1139433523068367,CC(O)=N[C@@H](CCCCN)C(=O)O__MTTKDPESEHPSVTLFRQYLRICTVQPNPDYGGAITFLEERARQLGLSCQKIEVVPGFVITVLTWPGTNPSLPSILLNSHTDVVPVFKEHWHHDPFEAFKDSEGYIYARGSQDMKSVSIQYLEAVRRLKSEGHRFPRTIHMTFVPDEEVGGHKGMELFVKRPEFQALRAGFALDEGLANPTDAFTVFYSERSPWWVRVTSTGKPGHASRFIEDTAAEKLHKVISSILAFREKERQRLQANPHLKEGAVTSVNLTKLEGGVAYNVVPATMSASFDFRVAPDVDMKAFEKQLQRWCQEAGEGVTFEFAQKFTEPRMTPTDDSDPWWAAFSGACKAMNLTLEPEIFPAATDSRYIRAVGIPALGFSPMNRTPVLLHDHNERLHEDIFLRGVDIYTGLLSALASVPTLPGES,./data/raw/alphafold//AF-Q99JW2-F1-model_v4.pdb,5589,2357,2979,3446 +3740,34050,34649,MKTQLIINNKFVDSESTNTFERYNQTLGEVVTSAAAASVADANNAAEVAQEAFKSWSKTGPTERRNVLLKAADILESKTAEFIDVMAKEVGSSGLWAGFNVMLAANVFREAASLATQIQGETIPTDKPGTLSMTIREPVGVILSIAPWNGPIVLAARAIAYPIVCGNSVVFKASEVSPKTHSLVVEAVIEAGLPAGVLNLLSNKPEDGESIVNALIEHKAVRRINFTGSTHVGRIIAQKAGYHLKRCLLELGGKSPQVILDDANLKEAAKAATFGSFLYQGQICMTTGRIIVDESVADEFGEIFAKLASKLPVGNPCDNNDCIVGPVVTQSSAERLNGYIDDALSKGAKLITGGKANGTVMKPTILDHVTSDMEIYHEESFGPLICMVRVKNADEALHTANDTPYGLSAAVFGKDVNRALQMAKDINAGHCHVNGTTVQNDAQAPYGGTKDSGWGRFDGRAVIDEFTELKWITIEPIVQDYPF,brenda,F5Z5S7,O=Cc1ccccc1O,0.0038,35.0,7.5,1.2.1.65,715451.0,-2.42021640338319,-2.42021640338319,O=Cc1ccccc1O__MKTQLIINNKFVDSESTNTFERYNQTLGEVVTSAAAASVADANNAAEVAQEAFKSWSKTGPTERRNVLLKAADILESKTAEFIDVMAKEVGSSGLWAGFNVMLAANVFREAASLATQIQGETIPTDKPGTLSMTIREPVGVILSIAPWNGPIVLAARAIAYPIVCGNSVVFKASEVSPKTHSLVVEAVIEAGLPAGVLNLLSNKPEDGESIVNALIEHKAVRRINFTGSTHVGRIIAQKAGYHLKRCLLELGGKSPQVILDDANLKEAAKAATFGSFLYQGQICMTTGRIIVDESVADEFGEIFAKLASKLPVGNPCDNNDCIVGPVVTQSSAERLNGYIDDALSKGAKLITGGKANGTVMKPTILDHVTSDMEIYHEESFGPLICMVRVKNADEALHTANDTPYGLSAAVFGKDVNRALQMAKDINAGHCHVNGTTVQNDAQAPYGGTKDSGWGRFDGRAVIDEFTELKWITIEPIVQDYPF,./data/raw/alphafold//AF-F5Z5S7-F1-model_v4.pdb,361,5242,7176,7206 +3741,39625,40334,MRFQQLLPWAAALTGCVVAQSQAGVDPLDRPGNDLYVKDLSNCTGYKVTKHWKTRSGFYADLALAGPACNVYGIDLPKLKLEVEYQTDERLHVKILDTNNTVYQVPDSVFPRPGFGQWCSPKNSKLKFDFKPDPFSFTVSRTDTGEVLFDTTGTKLVFENQYLYLKTHLPQNPHLYGLGEHSDSFMLNTTNYTRTIYTRDAYGTPQGQNLYGAHPIYFDHRQDGTHGVFLLNSNGMDIYIDNEGGQFLEYNIIGGVFDFYFIAGPSPQDVARQYAEIVQPPLMVPYWGLGFHQCRYGYQDVYEVAAVTANYSVHDIPLETIWTDIDYMDRRRIFTLDPERFPPELVKDLVDTLHARDQHYIVMVDPAVYYSEPNPALDAGLKYDAFMKELNGTHYQGVVWAGPSYFPDWFHPNAQEYWTEQFLNFFDGVNGPDIDALWIDMNEPANFYNRPYPGNNTTPEEFAEANDNPPEPPAVRDGPDAPIPGFPDSLQPNFASGQTNEKRAVVTVERRARSQSHRQLGAGRWRSAVRHWPRDPKAGWQHGRKSGSGCGPHECRGLPNRELIRPPYMIQNGAGPTLADNTADTDIVQSGGYVQYDTHSLYGAMMSTHSHNAMRARRPDDRALVITRSTFAGSGKDVSHWLGDNISDWLSYRLSISQILQFASLYQIPVVGPDVCGFGGNVTETLCARWATLGSFYTFFRNHAEIFANPQEFYRWPIVAEAARNGIAIRYQLLDYIYTAIYKQTQTGTPSLNPLFFNYPFDQNTYGIDLQFFYGPGILVSPVTEENSTSVSYYLPDDIFYEWGTGKPVRGHGEYVSAEVDVTHITVHYKGGLVYPQRIESANTTTALRQKGFNIVIAPGLDGSAHGELYLDDGLSQVQDKVSEIDFSYVDGVFEMKGSFEYDPGVGIERITILGVGAKPEVAAEDAEVEYDEENQKLVLHVDVPLTRKSSIKIA,brenda,Q9C1S7,OC[C@H]1O[C@H](O[C@H]2C(O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,1.9,45.0,5.5,3.2.1.20,162425.0,0.2787536009528289,0.2787536009528289,OC[C@H]1O[C@H](O[C@H]2C(O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O__MRFQQLLPWAAALTGCVVAQSQAGVDPLDRPGNDLYVKDLSNCTGYKVTKHWKTRSGFYADLALAGPACNVYGIDLPKLKLEVEYQTDERLHVKILDTNNTVYQVPDSVFPRPGFGQWCSPKNSKLKFDFKPDPFSFTVSRTDTGEVLFDTTGTKLVFENQYLYLKTHLPQNPHLYGLGEHSDSFMLNTTNYTRTIYTRDAYGTPQGQNLYGAHPIYFDHRQDGTHGVFLLNSNGMDIYIDNEGGQFLEYNIIGGVFDFYFIAGPSPQDVARQYAEIVQPPLMVPYWGLGFHQCRYGYQDVYEVAAVTANYSVHDIPLETIWTDIDYMDRRRIFTLDPERFPPELVKDLVDTLHARDQHYIVMVDPAVYYSEPNPALDAGLKYDAFMKELNGTHYQGVVWAGPSYFPDWFHPNAQEYWTEQFLNFFDGVNGPDIDALWIDMNEPANFYNRPYPGNNTTPEEFAEANDNPPEPPAVRDGPDAPIPGFPDSLQPNFASGQTNEKRAVVTVERRARSQSHRQLGAGRWRSAVRHWPRDPKAGWQHGRKSGSGCGPHECRGLPNRELIRPPYMIQNGAGPTLADNTADTDIVQSGGYVQYDTHSLYGAMMSTHSHNAMRARRPDDRALVITRSTFAGSGKDVSHWLGDNISDWLSYRLSISQILQFASLYQIPVVGPDVCGFGGNVTETLCARWATLGSFYTFFRNHAEIFANPQEFYRWPIVAEAARNGIAIRYQLLDYIYTAIYKQTQTGTPSLNPLFFNYPFDQNTYGIDLQFFYGPGILVSPVTEENSTSVSYYLPDDIFYEWGTGKPVRGHGEYVSAEVDVTHITVHYKGGLVYPQRIESANTTTALRQKGFNIVIAPGLDGSAHGELYLDDGLSQVQDKVSEIDFSYVDGVFEMKGSFEYDPGVGIERITILGVGAKPEVAAEDAEVEYDEENQKLVLHVDVPLTRKSSIKIA,./data/raw/alphafold//AF-Q9C1S7-F1-model_v4.pdb,2108,5619,4402,10115 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+3762,12445,12618,MPCPAQISDDLEFFVNGRKVTEKNVDPEVTLLAFLRKNLCLTGTKDACGTGGCGACTVMVSQHDPVCKKTRHFSVMACLVPLCSLHGAAVTTVEGVGSIKTRLHPVQERIAKSHGTQCGFCTPGMVMSIYTLLRNHPQPSEEQLMEALGGNLCRCTGYRPILESGRTFCMEPDGCPQKGTGQCCLDQKESDSSGSKSDICTKLFVKDEFQPLDPTQELIFPPELLRMAENPEKQTLTFYGERITWIAPGTLQELLVLKAKYPEAPLISGNTALGPAMKSQGHFYPVLLSPARIPDLRMVTKTSGGLTIGACCSLAQVKDILAESISELPQEKTQTYRALLKHLRSLAGQQIRNMASLGGHVISRHCYSDLNPILSVGNTTLNLLSEEGPRQIPLSGHFLAGLASADLKPEEILGSVYIPHSQKREFVSAFRQAQCHQNALPDVNAGMRVLFREGTDVIEELSIAYGGVGPTTVSAQRSCQQLLGRRWNALMLDEACRLLLDEVSLPGSALGGKVEFRRTLIVSLFFKFYLEVLQELKADQKLPPESTDSQRYPEIADRFLSSLGDFQVTLPRGVQTYQRVDSHQPLQDPVGRPIMHLSGLKHATGEAVFCDDIPRVDKELFMALVTSTRAHARIISIDSSEVLDLPGVVDVITAEDIPGNNGEEDDKLLAVDKVLCVGQVICAVVAETDVQAKRATEKIKITYEDLKPVIFTIEDAIKHNSFLCPEKKLEQGNIEEAFENVDQVAEGTVHVGGQEHFYMETQRVLVIPKTEDKELDMYVSTQDPAHVQKTVSSTLNIPISRITCHVKRVGGGFGGKVGRPAVFGAIAAVGAVKTGHPIRLVLDREDDMLITGGRHPLFAKYKVGFMNSGRIKALDIECYINGGCTLDDSELVTEFLVLKLENAYKIRNLRLRGRACMTNLPSNTAFRGFGFPQGALVTESCITAVAAKCGLPPEKIREKNMYKTVDKTIYKQAFNPDPLIRCWNECLDKSSFHIRRTRVDEFNKKSYWKKRGIAIVPMKFSVGFAATSYHQAAALVHIYTDGSVLVAHGGNELGQGIHTKMLQVASRELKIPLSYLHICETSTTTVPNTIATAASVGADVNGRAVQNACQILLKRLEPVIKKNPEGTWRDWIEAAFEKRISLSATGYFRGYKAFMDWEKGEGDPFPYYVYGAACSEVEIDCLTGAHKKIRTDIVMDACCSLNPAIDIGQIEGAFIQGMGLYTTEELLYSPEGVLYSRSPDKYKIPTVTDVPEQFNVSLLPSSQTPLTLYSSKGLGESGMFLGSSVFFAIVDAVAAARRQRDIAEDFTVKSPATPEWVRMACADRFTDMIPRDDPKTFKPWSIPIA,brenda,Q5SGK3,CN(C)c1ccc(/C=C/C=O)cc1,0.0004,37.0,8.0,1.2.3.1,10090.0,-3.397940008672037,-3.397940008672037,CN(C)c1ccc(/C=C/C=O)cc1__MPCPAQISDDLEFFVNGRKVTEKNVDPEVTLLAFLRKNLCLTGTKDACGTGGCGACTVMVSQHDPVCKKTRHFSVMACLVPLCSLHGAAVTTVEGVGSIKTRLHPVQERIAKSHGTQCGFCTPGMVMSIYTLLRNHPQPSEEQLMEALGGNLCRCTGYRPILESGRTFCMEPDGCPQKGTGQCCLDQKESDSSGSKSDICTKLFVKDEFQPLDPTQELIFPPELLRMAENPEKQTLTFYGERITWIAPGTLQELLVLKAKYPEAPLISGNTALGPAMKSQGHFYPVLLSPARIPDLRMVTKTSGGLTIGACCSLAQVKDILAESISELPQEKTQTYRALLKHLRSLAGQQIRNMASLGGHVISRHCYSDLNPILSVGNTTLNLLSEEGPRQIPLSGHFLAGLASADLKPEEILGSVYIPHSQKREFVSAFRQAQCHQNALPDVNAGMRVLFREGTDVIEELSIAYGGVGPTTVSAQRSCQQLLGRRWNALMLDEACRLLLDEVSLPGSALGGKVEFRRTLIVSLFFKFYLEVLQELKADQKLPPESTDSQRYPEIADRFLSSLGDFQVTLPRGVQTYQRVDSHQPLQDPVGRPIMHLSGLKHATGEAVFCDDIPRVDKELFMALVTSTRAHARIISIDSSEVLDLPGVVDVITAEDIPGNNGEEDDKLLAVDKVLCVGQVICAVVAETDVQAKRATEKIKITYEDLKPVIFTIEDAIKHNSFLCPEKKLEQGNIEEAFENVDQVAEGTVHVGGQEHFYMETQRVLVIPKTEDKELDMYVSTQDPAHVQKTVSSTLNIPISRITCHVKRVGGGFGGKVGRPAVFGAIAAVGAVKTGHPIRLVLDREDDMLITGGRHPLFAKYKVGFMNSGRIKALDIECYINGGCTLDDSELVTEFLVLKLENAYKIRNLRLRGRACMTNLPSNTAFRGFGFPQGALVTESCITAVAAKCGLPPEKIREKNMYKTVDKTIYKQAFNPDPLIRCWNECLDKSSFHIRRTRVDEFNKKSYWKKRGIAIVPMKFSVGFAATSYHQAAALVHIYTDGSVLVAHGGNELGQGIHTKMLQVASRELKIPLSYLHICETSTTTVPNTIATAASVGADVNGRAVQNACQILLKRLEPVIKKNPEGTWRDWIEAAFEKRISLSATGYFRGYKAFMDWEKGEGDPFPYYVYGAACSEVEIDCLTGAHKKIRTDIVMDACCSLNPAIDIGQIEGAFIQGMGLYTTEELLYSPEGVLYSRSPDKYKIPTVTDVPEQFNVSLLPSSQTPLTLYSSKGLGESGMFLGSSVFFAIVDAVAAARRQRDIAEDFTVKSPATPEWVRMACADRFTDMIPRDDPKTFKPWSIPIA,./data/raw/alphafold//AF-Q5SGK3-F1-model_v4.pdb,3061,294,334,390 +3763,38227,38904,MAARRANCALVLVLALALLAARDAGAAAVPKPNWLGGLSRAAFPKRFVFGTATSAYQVEGMAASGGRGPSIWDAFAHTPGNVAGNQNGDVATDQYHRYKEDVNLMKSLNFDAYRFSISWSRIFPDGEGRVNQEGVAYYNNLINYLLQKGITPYVNLYHYDLPLALEKKYGGWLNAKMADLFTEYADFCFKTFGNRVKHWFTFNEPRIVALLGYDQGTNPPKRCTKCAAGGNSATEPYIVAHNFLLSHAAAVARYRTKYQAAQQGKVGIVLDFNWYEALSNSTEDQAAAQRARDFHIGWYLDPLINGHYPQIMQDLVKDRLPKFTPEQARLVKGSADYIGINQYTASYMKGQQLMQQTPTSYSADWQVTYVFAKNGKPIGPQANSNWLYIVPWGMYGCVNYIKQKYGNPTVVITENGMDQPANLSRDQYLRDTTRVHFYRSYLTQLKKAIDEGANVAGYFAWSLLDNFEWLSGYTSKFGIVYVDFNTLERHPKASAYWFRDMLKH,sabio,Q75I93,OCC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1O,13.89,30.0,5.0,3.2.1.21,4530.0,1.1427022457376157,1.1427022457376157,OCC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1O__MAARRANCALVLVLALALLAARDAGAAAVPKPNWLGGLSRAAFPKRFVFGTATSAYQVEGMAASGGRGPSIWDAFAHTPGNVAGNQNGDVATDQYHRYKEDVNLMKSLNFDAYRFSISWSRIFPDGEGRVNQEGVAYYNNLINYLLQKGITPYVNLYHYDLPLALEKKYGGWLNAKMADLFTEYADFCFKTFGNRVKHWFTFNEPRIVALLGYDQGTNPPKRCTKCAAGGNSATEPYIVAHNFLLSHAAAVARYRTKYQAAQQGKVGIVLDFNWYEALSNSTEDQAAAQRARDFHIGWYLDPLINGHYPQIMQDLVKDRLPKFTPEQARLVKGSADYIGINQYTASYMKGQQLMQQTPTSYSADWQVTYVFAKNGKPIGPQANSNWLYIVPWGMYGCVNYIKQKYGNPTVVITENGMDQPANLSRDQYLRDTTRVHFYRSYLTQLKKAIDEGANVAGYFAWSLLDNFEWLSGYTSKFGIVYVDFNTLERHPKASAYWFRDMLKH,./data/raw/alphafold//AF-Q75I93-F1-model_v4.pdb,2627,318,361,422 +3764,30708,31252,MLSARAAATAAAAAASPLWKRGEGGSSGSGSGCTSCREVRRRAAAVRVRAAAPRRVEAVAMESAAETEKKEEVAAAGGGVEDMATEEVPVTPWAFSVASGYTLLRDPHHNKGLAFSEKERDAHYLRGLLPPAVVSQDLQVKKIMHNLRQYSVPLQRYMAMMDLQERNERLFYKLLIDNVEELLPVVYTPTVGEACQKYGSIFRQPQGLYVSLKDKGKVLDVLRNWPERNIQVIVVTDGERILGLGDLGCQGMGIPVGKLSLYTALGGVRPSACLPITIDVGTNNEQLLNDEFYIGLRQRRATGKEYHELMEEFMSAVKQIYGEKVLIQFEDFANHNAFDLLAKYSKSHLVFNDDIQGTASVVLAGLLSSLKVVGGTLAEHTYLFLGAGEAGTGIAELIALEISKQTKAPIEECRKKVWLLDSKGLIVNSRKESLQAFKKPWAHEHEPVTTLLDAVQSIKPTVLIGTSGVGKTFTKEVIEAMASFNERPVIFSLSNPTSHSECTAEEAYNWSQGRAVFASGSPFDPVEYNGKIHVPGQSNNAYIFPGFGLGVVISGAVRVHEDMLLAASETLADQATQENFEKGSIFPPFTNIRKISARIAASVAAKAYELGLATRLPQPRDLEKYAESCMYTPVYRSYR,sabio,P43279,O=C(O)CC(O)C(=O)O,0.86,30.0,7.4,1.1.1.40,4530.0,-0.0655015487564322,-0.0655015487564322,O=C(O)CC(O)C(=O)O__MLSARAAATAAAAAASPLWKRGEGGSSGSGSGCTSCREVRRRAAAVRVRAAAPRRVEAVAMESAAETEKKEEVAAAGGGVEDMATEEVPVTPWAFSVASGYTLLRDPHHNKGLAFSEKERDAHYLRGLLPPAVVSQDLQVKKIMHNLRQYSVPLQRYMAMMDLQERNERLFYKLLIDNVEELLPVVYTPTVGEACQKYGSIFRQPQGLYVSLKDKGKVLDVLRNWPERNIQVIVVTDGERILGLGDLGCQGMGIPVGKLSLYTALGGVRPSACLPITIDVGTNNEQLLNDEFYIGLRQRRATGKEYHELMEEFMSAVKQIYGEKVLIQFEDFANHNAFDLLAKYSKSHLVFNDDIQGTASVVLAGLLSSLKVVGGTLAEHTYLFLGAGEAGTGIAELIALEISKQTKAPIEECRKKVWLLDSKGLIVNSRKESLQAFKKPWAHEHEPVTTLLDAVQSIKPTVLIGTSGVGKTFTKEVIEAMASFNERPVIFSLSNPTSHSECTAEEAYNWSQGRAVFASGSPFDPVEYNGKIHVPGQSNNAYIFPGFGLGVVISGAVRVHEDMLLAASETLADQATQENFEKGSIFPPFTNIRKISARIAASVAAKAYELGLATRLPQPRDLEKYAESCMYTPVYRSYR,./data/raw/alphafold//AF-P43279-F1-model_v4.pdb,1867,754,4337,9537 +3765,37791,38458,MDRIIQSPGKYIQGAGAIKRLGDYLKPLAERWLVVGDKFVLGFAEEMLRKSLADAGLAAEIAPFGGECSHNEINRLRDIAGNAKCTAVLGIGGGKTLDTAKALAHFMNVPVAIAPTIASTDAPCSALSVIYTDEGEFDSYLMLPRNPNMVIVDTQIVAGAPARLLAAGIGDALATWFEARACSRSGATTMAGGKCTQAALALAELCYNTLLEEGEKAMLAAEQHVVTPALERVVEANTYLSGVGFESGGLAAAHAIHNGMTAIPDAHHYYHGEKVAFGTLTQLVLENAPVDEIETVAALCHSVGLPITLAQLDIKGDIPTKMRLVAEAACAEGETIHNMPGGVDSDQVYAALLVADQYGQRFLQEWE,brenda,B2ZPN8,OCC(O)CO,26.0,20.5,10.75,1.1.1.6,573.0,1.414973347970818,1.3457429430173249,OCC(O)CO__MDRIIQSPGKYIQGAGAIKRLGDYLKPLAERWLVVGDKFVLGFAEEMLRKSLADAGLAAEIAPFGGECSHNEINRLRDIAGNAKCTAVLGIGGGKTLDTAKALAHFMNVPVAIAPTIASTDAPCSALSVIYTDEGEFDSYLMLPRNPNMVIVDTQIVAGAPARLLAAGIGDALATWFEARACSRSGATTMAGGKCTQAALALAELCYNTLLEEGEKAMLAAEQHVVTPALERVVEANTYLSGVGFESGGLAAAHAIHNGMTAIPDAHHYYHGEKVAFGTLTQLVLENAPVDEIETVAALCHSVGLPITLAQLDIKGDIPTKMRLVAEAACAEGETIHNMPGGVDSDQVYAALLVADQYGQRFLQEWE,./data/raw/alphafold//AF-B2ZPN8-F1-model_v4.pdb,5196,4836,6683,6647 +3766,39557,40262,MKKKKTWKRFLHFSSAALAAGLIFTSAAPAEAAFWGASNELLHDPTMIKEGSSWYALGTGLTEERGLRVLKSSDAKNWTVQKSIFTTPLSWWSNYVPNYGQNQWAPDIQYYNGKYWLYYSVSSFGSNTSAIGLASSTSISSGGWKDEGLVIRSTSSNNYNAIDPELTFDKDGNPWLAFGSFWSGIKLTKLDKSTMKPTGSLYSIAARPNNGGALEAPTLTYQNGYYYLMVSFDKCCDGVNSTYKIAYGRSKSITGPYLDKSGKSMLEGGGTILDSGNDQWKGPGGQDIVNGNILVRHAYDANDNGIPKLLINDLNWSSGWPSY,sabio,P94522,OC[C@H]1O[C@H](OC[C@H]2O[C@H](OC[C@H]3O[C@H](OC[C@H]4OC(O)[C@@H](O)[C@@H]4O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O,3.5,27.0,7.0,3.2.1.99,1423.0,0.5440680443502757,0.5440680443502757,OC[C@H]1O[C@H](OC[C@H]2O[C@H](OC[C@H]3O[C@H](OC[C@H]4OC(O)[C@@H](O)[C@@H]4O)[C@@H](O)[C@@H]3O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O__MKKKKTWKRFLHFSSAALAAGLIFTSAAPAEAAFWGASNELLHDPTMIKEGSSWYALGTGLTEERGLRVLKSSDAKNWTVQKSIFTTPLSWWSNYVPNYGQNQWAPDIQYYNGKYWLYYSVSSFGSNTSAIGLASSTSISSGGWKDEGLVIRSTSSNNYNAIDPELTFDKDGNPWLAFGSFWSGIKLTKLDKSTMKPTGSLYSIAARPNNGGALEAPTLTYQNGYYYLMVSFDKCCDGVNSTYKIAYGRSKSITGPYLDKSGKSMLEGGGTILDSGNDQWKGPGGQDIVNGNILVRHAYDANDNGIPKLLINDLNWSSGWPSY,./data/raw/alphafold//AF-P94522-F1-model_v4.pdb,2936,120,129,143 +3767,16069,16305,MSRVAIVTGASSGNGLAIATRFLARGDRVAALDLSAETLEETARTHWHAYADKVLRVRADVADEGDVNAAIAATMEQFGAIDVLVNNAGITGNSEAGVLHTTPVEQFDKVMAVNVRGIFLGCRAVLPHMLLQGAGVIVNIASVASLVAFPGRSAYTTSKGAVLQLTKSVAVDYAGSGIRCNAVCPGMIETPMTQWRLDQPELRDQVLARIPQKEIGTAAQVADAVMFLAGEDATYVNGAALVMDGAYTAI,brenda,Q56840,C[C@H](O)CSCCS(=O)(=O)O,0.1,30.0,7.5,1.1.1.268,280.0,-1.0,-0.8287886595888969,C[C@H](O)CSCCS(=O)(=O)O__MSRVAIVTGASSGNGLAIATRFLARGDRVAALDLSAETLEETARTHWHAYADKVLRVRADVADEGDVNAAIAATMEQFGAIDVLVNNAGITGNSEAGVLHTTPVEQFDKVMAVNVRGIFLGCRAVLPHMLLQGAGVIVNIASVASLVAFPGRSAYTTSKGAVLQLTKSVAVDYAGSGIRCNAVCPGMIETPMTQWRLDQPELRDQVLARIPQKEIGTAAQVADAVMFLAGEDATYVNGAALVMDGAYTAI,./data/raw/alphafold//AF-Q56840-F1-model_v4.pdb,3455,964,1158,1425 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+3787,27636,28115,MYIDTSASSRMTDNKGSVITINGGESAGNSPPSQRKSSTSESPPELRILCFDLTYYNRTTQFLLSCAGVFFLYILYGYLQELIFTVEGFKPYGWFLTLVQFGYYIGFGLVERRLEGYRISGGSFWNIEPEPRCIPMRTYLILAALTLGTMGLSNSSLGYLNYPTQVIFKCCKLIPVLVGSILIQGKRYGLLDFAAATCMCIGLAWFTLADSQMTPNFNLLGVAMISGALLCDAAIGNVQEKAMREFKAPSSEVVFYSYGLGFVYLFVIMLVTGNFFSGFAFCLEHPVETFGYGFLFSLSGYLGIQFVLALVRSSGAPIAATVTTARKAVTIAFSFVLFSKPFTLQYLWSGLIVVLGIYLNVYSKRNKLTLADVRQRIKQFGAKVARSPSRKFLIEV,sabio,Q9VVD9,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O,0.0023,30.0,7.5,-.-.-.-,7227.0,-2.638272163982407,-2.638272163982407,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O__MYIDTSASSRMTDNKGSVITINGGESAGNSPPSQRKSSTSESPPELRILCFDLTYYNRTTQFLLSCAGVFFLYILYGYLQELIFTVEGFKPYGWFLTLVQFGYYIGFGLVERRLEGYRISGGSFWNIEPEPRCIPMRTYLILAALTLGTMGLSNSSLGYLNYPTQVIFKCCKLIPVLVGSILIQGKRYGLLDFAAATCMCIGLAWFTLADSQMTPNFNLLGVAMISGALLCDAAIGNVQEKAMREFKAPSSEVVFYSYGLGFVYLFVIMLVTGNFFSGFAFCLEHPVETFGYGFLFSLSGYLGIQFVLALVRSSGAPIAATVTTARKAVTIAFSFVLFSKPFTLQYLWSGLIVVLGIYLNVYSKRNKLTLADVRQRIKQFGAKVARSPSRKFLIEV,./data/raw/alphafold//AF-Q9VVD9-F1-model_v4.pdb,1404,6659,6180,11900 +3788,5603,5689,MRRRSRMLLCFAFLWVLGIAYYMYSGGGSALAGGAGGGAGRKEDWNEIDPIKKKDLHHSNGEEKAQSMETLPPGKVRWPDFNQEAYVGGTMVRSGQDPYARNKFNQVESDKLRMDRAIPDTRHDQCQRKQWRVDLPATSVVITFHNEARSALLRTVVSVLKKSPPHLIKEIILVDDYSNDPEDGALLGKIEKVRVLRNDRREGLMRSRVRGADAAQAKVLTFLDSHCECNEHWLEPLLERVAEDRTRVVSPIIDVINMDNFQYVGASADLKGGFDWNLVFKWDYMTPEQRRSRQGNPVAPIKTPMIAGGLFVMDKFYFEELGKYDMMMDVWGGENLEISFRVWQCGGSLEIIPCSRVGHVFRKQHPYTFPGGSGTVFARNTRRAAEVWMDEYKNFYYAAVPSARNVPYGNIQSRLELRKKLSCKPFKWYLENVYPELRVPDHQDIAFGALQQGTNCLDTLGHFADGVVGVYECHNAGGNQEWALTKEKSVKHMDLCLTVVDRAPGSLIKLQGCRENDSRQKWEQIEGNSKLRHVGSNLCLDSRTAKSGGLSVEVCGPALSQQWKFTLNLQQ,brenda,Q10471,CC(C)[C@H](N=C(O)CN=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](C)N)C(O)=N[C@H](C(O)=N[C@H](C(O)=N[C@@H](CO)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CC(=O)O)C(O)=N[C@H](C(O)=N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@H](C)O)C(C)C,0.45,37.0,7.4,2.4.1.41,9606.0,-0.3467874862246563,-0.3467874862246563,CC(C)[C@H](N=C(O)CN=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](C)N)C(O)=N[C@H](C(O)=N[C@H](C(O)=N[C@@H](CO)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CC(=O)O)C(O)=N[C@H](C(O)=N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@H](C)O)C(C)C__MRRRSRMLLCFAFLWVLGIAYYMYSGGGSALAGGAGGGAGRKEDWNEIDPIKKKDLHHSNGEEKAQSMETLPPGKVRWPDFNQEAYVGGTMVRSGQDPYARNKFNQVESDKLRMDRAIPDTRHDQCQRKQWRVDLPATSVVITFHNEARSALLRTVVSVLKKSPPHLIKEIILVDDYSNDPEDGALLGKIEKVRVLRNDRREGLMRSRVRGADAAQAKVLTFLDSHCECNEHWLEPLLERVAEDRTRVVSPIIDVINMDNFQYVGASADLKGGFDWNLVFKWDYMTPEQRRSRQGNPVAPIKTPMIAGGLFVMDKFYFEELGKYDMMMDVWGGENLEISFRVWQCGGSLEIIPCSRVGHVFRKQHPYTFPGGSGTVFARNTRRAAEVWMDEYKNFYYAAVPSARNVPYGNIQSRLELRKKLSCKPFKWYLENVYPELRVPDHQDIAFGALQQGTNCLDTLGHFADGVVGVYECHNAGGNQEWALTKEKSVKHMDLCLTVVDRAPGSLIKLQGCRENDSRQKWEQIEGNSKLRHVGSNLCLDSRTAKSGGLSVEVCGPALSQQWKFTLNLQQ,./data/raw/alphafold//AF-Q10471-F1-model_v4.pdb,2888,2116,1395,3175 +3789,6517,6634,MDPLGAAKPQWPWRRCLAALLFQLLVAVCFFSYLRVSRDDATGSPRAPSGSSRQDTTPTRPTLLILLWTWPFHIPVALSRCSEMVPGTADCHITADRKVYPQADTVIVHHWDIMSNPKSRLPPSPRPQGQRWIWFNLEPPPNCQHLEALDRYFNLTMSYRSDSDIFTPYGWLEPWSGQPAHPPLNLSAKTELVAWAVSNWKPDSARVRYYQSLQAHLKVDVYGRSHKPLPKGTMMETLSRYKFYLAFENSLHPDYITEKLWRNALEAWAVPVVLGPSRSNYERFLPPDAFIHVDDFQSPKDLARYLQELDKDHARYLSYFRWRETLRPRSFSWALDFCKACWKLQQESRYQTVRSIAAWFT,brenda,P21217,CC(O)=N[C@H]1[C@@H](OCCCN=C(O)CCCCCNOC(=O)CCCC[C@@H]2SC[C@@H]3N=C(O)N[C@@H]32)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O[C@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1O,0.2,37.0,6.279999999999999,2.4.1.65,9606.0,-0.6989700043360187,-0.6989700043360187,CC(O)=N[C@H]1[C@@H](OCCCN=C(O)CCCCCNOC(=O)CCCC[C@@H]2SC[C@@H]3N=C(O)N[C@@H]32)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O[C@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1O__MDPLGAAKPQWPWRRCLAALLFQLLVAVCFFSYLRVSRDDATGSPRAPSGSSRQDTTPTRPTLLILLWTWPFHIPVALSRCSEMVPGTADCHITADRKVYPQADTVIVHHWDIMSNPKSRLPPSPRPQGQRWIWFNLEPPPNCQHLEALDRYFNLTMSYRSDSDIFTPYGWLEPWSGQPAHPPLNLSAKTELVAWAVSNWKPDSARVRYYQSLQAHLKVDVYGRSHKPLPKGTMMETLSRYKFYLAFENSLHPDYITEKLWRNALEAWAVPVVLGPSRSNYERFLPPDAFIHVDDFQSPKDLARYLQELDKDHARYLSYFRWRETLRPRSFSWALDFCKACWKLQQESRYQTVRSIAAWFT,./data/raw/alphafold//AF-P21217-F1-model_v4.pdb,5705,2495,3135,3617 +3790,17022,17269,MDVRQVLHMKGGAGENSYAMNSFIQRQVISITKPITEAAITALYSGDTVTTRLAIADLGCSSGPNALFAVTELIKTVEELRKKMGRENSPEYQIFLNDLPGNDFNAIFRSLPIENDVDGVCFINGVPGSFYGRLFPRNTLHFIHSSYSLMWLSQVPIGIESNKGNIYMANTCPQSVLNAYYKQFQEDHALFLRCRAQEVVPGGRMVLTILGRRSEDRASTECCLIWQLLAMALNQMVSEGLIEEEKMDKFNIPQYTPSPTEVEAEILKEGSFLIDHIEASEIYWSSCTKDGDGGGSVEEEGYNVARCMRAVAEPLLLDHFGEAIIEDVFHRYKLLIIERMSKEKTKFINVIVSLIRKSD,brenda,Q9SPV4,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,0.009,20.0,7.5,2.1.1.274,36903.0,-2.0457574905606752,-2.0457574905606752,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MDVRQVLHMKGGAGENSYAMNSFIQRQVISITKPITEAAITALYSGDTVTTRLAIADLGCSSGPNALFAVTELIKTVEELRKKMGRENSPEYQIFLNDLPGNDFNAIFRSLPIENDVDGVCFINGVPGSFYGRLFPRNTLHFIHSSYSLMWLSQVPIGIESNKGNIYMANTCPQSVLNAYYKQFQEDHALFLRCRAQEVVPGGRMVLTILGRRSEDRASTECCLIWQLLAMALNQMVSEGLIEEEKMDKFNIPQYTPSPTEVEAEILKEGSFLIDHIEASEIYWSSCTKDGDGGGSVEEEGYNVARCMRAVAEPLLLDHFGEAIIEDVFHRYKLLIIERMSKEKTKFINVIVSLIRKSD,./data/raw/alphafold//AF-Q9SPV4-F1-model_v4.pdb,5847,4124,5545,5930 +3791,32045,32610,MNAAAVTPPPEKFNFAEHLLQTNRVRPDKTAFVDDVSSLSFAQLEVKARQLASALRAIGVKREERVLLLMLDGTDWPVSFLGAIYAGIVPVAVNTLLTADDYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVVVSRPAAPLEPGEVDFAAFVGAQAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYWSPELYGRHTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATSLLMGERPTPDAVFKRWLGGVGGVKSTVFYGAPTGYAGMLAAPNLPSRDQVALRLAASAGEALPAEIGQRFQRHFGIDIVDGIGSTEMLHIFLSNLPDRVRYGTTGWPVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGGWTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLEAAVVGVADEHGLTKPKAYVVARPGQTLSETELKTFIKDRLAPYKYPRSAVFVAELPKTATGKIQRFKLREGVLG,brenda,Q3LB11,O=C(O)c1ccccc1,0.0044,31.0,8.0,6.2.1.25,1076.0,-2.356547323513813,-2.356547323513813,O=C(O)c1ccccc1__MNAAAVTPPPEKFNFAEHLLQTNRVRPDKTAFVDDVSSLSFAQLEVKARQLASALRAIGVKREERVLLLMLDGTDWPVSFLGAIYAGIVPVAVNTLLTADDYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVVVSRPAAPLEPGEVDFAAFVGAQAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYWSPELYGRHTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATSLLMGERPTPDAVFKRWLGGVGGVKSTVFYGAPTGYAGMLAAPNLPSRDQVALRLAASAGEALPAEIGQRFQRHFGIDIVDGIGSTEMLHIFLSNLPDRVRYGTTGWPVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGGWTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLEAAVVGVADEHGLTKPKAYVVARPGQTLSETELKTFIKDRLAPYKYPRSAVFVAELPKTATGKIQRFKLREGVLG,./data/raw/alphafold//AF-Q3LB11-F1-model_v4.pdb,4863,3617,4941,5252 +3792,38155,38831,MLRGAGVLLHITSLPGGCFVGDLGPEAYKFADSLAYAEQTYWQTLPINHTVPEYENSPYSAVSSYAGDPVLISLELMKRDGLIDSVPQCPPAERADYIKAWEVKRKALEKALKRAGRLSDYRHFKDVTPWLDDYAYYMAMRERFGPWPVWPKEEPPPASLELYKFAQFVFWTQWERFKEYVNSLGIFLIGDLPFYPSLDSVDVWRNKKYFKVGEDGRPLYVAGVPPDYFSATGQLWGNPVYNWEALERDGFKWWVNRLKHAVTVFDYVRLDHFRGYVAYWEVPGGETTAVRGRWAPSPGRRLFEAAAAAVDLGRLIAEDLGYITPEVEALREELGLPGMRVLQFAWDGNPANPHKPHNHVKNAVVYTGTHDNNTAVGWYKEEATARARREFKKYSNCAGEVHWCFIKLAHMSVANVAIVPVQDLLGLGSEARMNRPGTVGGNWKWRLGAQPEPRVWKRLRDVTRTYGR,sabio,Q8ZXM0,OCC1OC(OC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,3.7,80.0,6.7,2.4.1.25,13773.0,0.568201724066995,0.568201724066995,OCC1OC(OC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O__MLRGAGVLLHITSLPGGCFVGDLGPEAYKFADSLAYAEQTYWQTLPINHTVPEYENSPYSAVSSYAGDPVLISLELMKRDGLIDSVPQCPPAERADYIKAWEVKRKALEKALKRAGRLSDYRHFKDVTPWLDDYAYYMAMRERFGPWPVWPKEEPPPASLELYKFAQFVFWTQWERFKEYVNSLGIFLIGDLPFYPSLDSVDVWRNKKYFKVGEDGRPLYVAGVPPDYFSATGQLWGNPVYNWEALERDGFKWWVNRLKHAVTVFDYVRLDHFRGYVAYWEVPGGETTAVRGRWAPSPGRRLFEAAAAAVDLGRLIAEDLGYITPEVEALREELGLPGMRVLQFAWDGNPANPHKPHNHVKNAVVYTGTHDNNTAVGWYKEEATARARREFKKYSNCAGEVHWCFIKLAHMSVANVAIVPVQDLLGLGSEARMNRPGTVGGNWKWRLGAQPEPRVWKRLRDVTRTYGR,./data/raw/alphafold//AF-Q8ZXM0-F1-model_v4.pdb,2107,5618,4401,10114 +3793,30896,31449,MSSTHQLVSSMISSSSSTFLAPSNFNLRTRNACLPMAKRVNTCKCVATPQEKIEYKTKVSRNSNMSKLQAGYLFPEIARRRSAHLLKYPDAQVISLGIGDTTEPIPEVITSAMAKKAHELSTIEGYSGYGAEQGAKPLRAAIAKTFYGGLGIGDDDVFVSDGAKCDISRLQVMFGSNVTIAVQDPSYPAYVDSSVIMGQTGQFNTDVQKYGNIEYMRCTPENGFFPDLSTVGRTDIIFFCSPNNPTGAAATREQLTQLVEFAKKNGSIIVYDSAYAMYMSDDNPRSIFEIPGAEEVAMETASFSKYAGFTGVRLGWTVIPKKLLYSDGFPVAKDFNRIICTCFNGASNISQAGALACLTPEGLEAMHKVIGFYKENTNIIIDTFTSLGYDVYGGKNAPYVWVHFPNQSSWDVFAEILEKTHVVTTPGSGFGPGGEGFVRVSAFGHRENILEACRRFKQLYK,brenda,Q93ZN9,O=C(O)CCC(=O)C(=O)O,8.7,30.0,7.5,2.6.1.83,3702.0,0.9395192526186184,0.5997953203018467,O=C(O)CCC(=O)C(=O)O__MSSTHQLVSSMISSSSSTFLAPSNFNLRTRNACLPMAKRVNTCKCVATPQEKIEYKTKVSRNSNMSKLQAGYLFPEIARRRSAHLLKYPDAQVISLGIGDTTEPIPEVITSAMAKKAHELSTIEGYSGYGAEQGAKPLRAAIAKTFYGGLGIGDDDVFVSDGAKCDISRLQVMFGSNVTIAVQDPSYPAYVDSSVIMGQTGQFNTDVQKYGNIEYMRCTPENGFFPDLSTVGRTDIIFFCSPNNPTGAAATREQLTQLVEFAKKNGSIIVYDSAYAMYMSDDNPRSIFEIPGAEEVAMETASFSKYAGFTGVRLGWTVIPKKLLYSDGFPVAKDFNRIICTCFNGASNISQAGALACLTPEGLEAMHKVIGFYKENTNIIIDTFTSLGYDVYGGKNAPYVWVHFPNQSSWDVFAEILEKTHVVTTPGSGFGPGGEGFVRVSAFGHRENILEACRRFKQLYK,./data/raw/alphafold//AF-Q93ZN9-F1-model_v4.pdb,4694,2329,2939,3397 +3794,23137,23492,MQRRHFLQKTLLALPIIFSGNLLTGCKTNLSDDYLPDDKITNNPNLLQNKLKEILPIWENKFNAKIGMTIIADNGELSSHRGNEYFPVNSTIKAFIASHILLLVDKEKLDLNEKIIIKESDLIEYSPVCKKYFDENKPISISELCEATITLSDNGSANILLDKIGGLTAFNQFLKEIGADMVLANNEPLLNRSHYGETSDTAKPIPYTKSLKALIVGNILSNQSKEQLITWLINDKVADNLLRKYLPKNWRIGDKTGTGSESKNIIAVIWNENNKPYFISLFITQPHDGKSLDFKNQKDEIMAQIGKEIYPFL,sabio,Q59514,NC(C(=O)NC1C(=O)N2C(C(=O)O)=C(Cl)CSC12)c1ccccc1,0.034,30.0,7.0,3.5.2.6,480.0,-1.4685210829577449,-1.4685210829577449,NC(C(=O)NC1C(=O)N2C(C(=O)O)=C(Cl)CSC12)c1ccccc1__MQRRHFLQKTLLALPIIFSGNLLTGCKTNLSDDYLPDDKITNNPNLLQNKLKEILPIWENKFNAKIGMTIIADNGELSSHRGNEYFPVNSTIKAFIASHILLLVDKEKLDLNEKIIIKESDLIEYSPVCKKYFDENKPISISELCEATITLSDNGSANILLDKIGGLTAFNQFLKEIGADMVLANNEPLLNRSHYGETSDTAKPIPYTKSLKALIVGNILSNQSKEQLITWLINDKVADNLLRKYLPKNWRIGDKTGTGSESKNIIAVIWNENNKPYFISLFITQPHDGKSLDFKNQKDEIMAQIGKEIYPFL,./data/raw/alphafold//AF-Q59514-F1-model_v4.pdb,3547,1144,1850,1695 +3795,2300,2342,MYNKETICVQGNYKPGNGEPRVLPLYQSTTFKYSSIDQLAELFDLKVDGHIYSRISNPTIQAFEEKISLLEGGVSSVAVSSGQSANMLAVLNICKSGDSILCSSKVYGGTFNLLGPSLKKFGIDLISFDLDSSEDEIVELAKENTKVVFAETLANPTLEVIDFEKIANVAKRINVPFIVDNSLASPVLCNPLKYGANIVTHSTTKYLDGHASSVGGIIVDGGNFNWDNGKFPELVEPDPTYHGISYTQKFGNAAYATKARVQLLRDYGNCLSPFNAYLTNLNVETLHLRMERHSENALKIARFLEKHENVDWINYPGLEDNKYYENAKKYLSRGCSGVLSFGVRGGLENAKKFVEKLQIASLVTHVSDVRTCVIHPASTTHRQLTEEQLIASGVLPSLIRLSVGIENVEDLIADLNQALNF,brenda,Q187D4,CC(=O)OCC[C@H](N)C(=O)O,0.6,25.0,7.5,2.5.1.49,1496.0,-0.2218487496163563,-0.2218487496163563,CC(=O)OCC[C@H](N)C(=O)O__MYNKETICVQGNYKPGNGEPRVLPLYQSTTFKYSSIDQLAELFDLKVDGHIYSRISNPTIQAFEEKISLLEGGVSSVAVSSGQSANMLAVLNICKSGDSILCSSKVYGGTFNLLGPSLKKFGIDLISFDLDSSEDEIVELAKENTKVVFAETLANPTLEVIDFEKIANVAKRINVPFIVDNSLASPVLCNPLKYGANIVTHSTTKYLDGHASSVGGIIVDGGNFNWDNGKFPELVEPDPTYHGISYTQKFGNAAYATKARVQLLRDYGNCLSPFNAYLTNLNVETLHLRMERHSENALKIARFLEKHENVDWINYPGLEDNKYYENAKKYLSRGCSGVLSFGVRGGLENAKKFVEKLQIASLVTHVSDVRTCVIHPASTTHRQLTEEQLIASGVLPSLIRLSVGIENVEDLIADLNQALNF,./data/raw/alphafold//AF-Q187D4-F1-model_v4.pdb,3574,1180,1896,1762 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+3817,15488,15708,MLRTSIRAFSTQPRLSTNYGFIGLGLMGQHMARHVYNQLEPSDKLYVYDVDPKHTTQFLTEVTSQTPQNAPLLTPLNSLKDFTTEVDSQLDFIVTMVPEGKHVKSVVSELVGHYKSTGNYDPSIKTTFLDSSTIDIPTSRDVHQLVKSSIPEFDFIDTPVSGGVAGARKGTLSFMLSRETHDDIDPSLTALLSKMGINIFPCGATHGTGLAAKLANNYLLAITNIAAADSFQLAESFGLNLQNYAKLVAVSTGKSWASVDNCPIPGVYPDNNLPSDVNYEGGFITKLTRKDVVLATESAKFNNRFLMLGDIGRHWYDKACEREDIANRDLSVLFEWLGDLKQNEKGDVIDVKRK,brenda,A0A1D8PQ07,C[C@H](CO)C(=O)O,0.58,22.0,9.5,1.1.1.59,5476.0,-0.2365720064370627,-0.2365720064370627,C[C@H](CO)C(=O)O__MLRTSIRAFSTQPRLSTNYGFIGLGLMGQHMARHVYNQLEPSDKLYVYDVDPKHTTQFLTEVTSQTPQNAPLLTPLNSLKDFTTEVDSQLDFIVTMVPEGKHVKSVVSELVGHYKSTGNYDPSIKTTFLDSSTIDIPTSRDVHQLVKSSIPEFDFIDTPVSGGVAGARKGTLSFMLSRETHDDIDPSLTALLSKMGINIFPCGATHGTGLAAKLANNYLLAITNIAAADSFQLAESFGLNLQNYAKLVAVSTGKSWASVDNCPIPGVYPDNNLPSDVNYEGGFITKLTRKDVVLATESAKFNNRFLMLGDIGRHWYDKACEREDIANRDLSVLFEWLGDLKQNEKGDVIDVKRK,./data/raw/alphafold//AF-A0A1D8PQ07-F1-model_v4.pdb,476,3728,5080,5399 +3818,19548,19833,MAAAAGEARRVLVYGGRGALGSRCVQAFRARNWWVASIDVQENEEASANVVVKMTDSFTEQADQVTAEVGKLLGTEKVDAILCVAGGWAGGNAKSKSLFKNCDLMWKQSVWTSTISSHLATKHLKEGGLLTLAGARAALDGTPGMIGYGMAKAAVHQLCQSLAGKSSGLPPGAAAVALLPVTLDTPVNRKSMPEADFSSWTPLEFLVETFHDWITEKNRPSSGSLIQVVTTEGKTELTAASP,uniprot_search,Q3T0Z7,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.095,34.0,7.5,1.5.1.34,9913.0,-1.0222763947111522,-1.944116929480916,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MAAAAGEARRVLVYGGRGALGSRCVQAFRARNWWVASIDVQENEEASANVVVKMTDSFTEQADQVTAEVGKLLGTEKVDAILCVAGGWAGGNAKSKSLFKNCDLMWKQSVWTSTISSHLATKHLKEGGLLTLAGARAALDGTPGMIGYGMAKAAVHQLCQSLAGKSSGLPPGAAAVALLPVTLDTPVNRKSMPEADFSSWTPLEFLVETFHDWITEKNRPSSGSLIQVVTTEGKTELTAASP,./data/raw/alphafold//AF-Q3T0Z7-F1-model_v4.pdb,4084,2800,3478,3859 +3819,4927,5005,MTSYHSHPPKAYRRFESVCTQAPNAIAVVHEGKPVTYQQLQTQVLERSEALIRQGLADHPYMPLMANRCLEYLITMLACCKLGITYVSIEPSTPSKRLIAVLEQLGCNHLLLLGQPTDLRPDPTLTCFRLDDCGTLCSDGPALRQPIRRRLDDASVITVMFTSGTTGVPKGVRISQDGLLNLVDNVQQQVQGKPRSYVHHSSIGFDAALFEVWVPLLTGACVTLQPSEFNIDALDHCVRAASCDVLLLTTSLFHLVAQHRLSMLEAVRVLYVGGEVLKPVHARALLLANPRITLVNGYGPTENTVFSTWYSLNKPEDAERDVIPIGQFLHQVHGKIVDAKLQEVEVGTPGELLLTGANLALGYLDEALTPTRFLQLPEGTYYRTGDYVIQDEHGMLFYQGRIDEQVKIKGFRVEIAEVEHALTQLPGVAQAVVQAHVMNDLENSLHAFIVFRHGSPTIEESKLMSLLGDRLPHYMVPRRIHYLAELPLTANGKVDKRSLQPPEKAAVVSPQAGSAVLEIWSGILGTRNLQLEHSIYGYGASSLSVVMAHSRINEILGRTTPFDEVARLSTFQEWVQYYATHADPVTSLRSQHGNH,brenda,Q6TNA5,CC(C)C[C@H](N)C(=O)O,1.5,25.0,7.5,6.2.1.46,317.0,0.1760912590556812,0.1760912590556812,CC(C)C[C@H](N)C(=O)O__MTSYHSHPPKAYRRFESVCTQAPNAIAVVHEGKPVTYQQLQTQVLERSEALIRQGLADHPYMPLMANRCLEYLITMLACCKLGITYVSIEPSTPSKRLIAVLEQLGCNHLLLLGQPTDLRPDPTLTCFRLDDCGTLCSDGPALRQPIRRRLDDASVITVMFTSGTTGVPKGVRISQDGLLNLVDNVQQQVQGKPRSYVHHSSIGFDAALFEVWVPLLTGACVTLQPSEFNIDALDHCVRAASCDVLLLTTSLFHLVAQHRLSMLEAVRVLYVGGEVLKPVHARALLLANPRITLVNGYGPTENTVFSTWYSLNKPEDAERDVIPIGQFLHQVHGKIVDAKLQEVEVGTPGELLLTGANLALGYLDEALTPTRFLQLPEGTYYRTGDYVIQDEHGMLFYQGRIDEQVKIKGFRVEIAEVEHALTQLPGVAQAVVQAHVMNDLENSLHAFIVFRHGSPTIEESKLMSLLGDRLPHYMVPRRIHYLAELPLTANGKVDKRSLQPPEKAAVVSPQAGSAVLEIWSGILGTRNLQLEHSIYGYGASSLSVVMAHSRINEILGRTTPFDEVARLSTFQEWVQYYATHADPVTSLRSQHGNH,./data/raw/alphafold//AF-Q6TNA5-F1-model_v4.pdb,5141,2018,1502,3009 +3820,10457,10612,MGATGAAEPLQSVLWVKQQRCAVSLEPARALLRWWRSPGPGAGAPGADACSVPVSEIIAVEETDVHGKHQGSGKWQKMEKPYAFTVHCVKRARRHRWKWAQVTFWCPEEQLCHLWLQTLREMLEKLTSRPKHLLVFINPFGGKGQGKRIYERKVAPLFTLASITTDIIVTEHANQAKETLYEINIDKYDGIVCVGGDGMFSEVLHGLIGRTQRSAGVDQNHPRAVLVPSSLRIGIIPAGSTDCVCYSTVGTSDAETSALHIVVGDSLAMDVSSVHHNSTLLRYSVSLLGYGFYGDIIKDSEKKRWLGLARYDFSGLKTFLSHHCYEGTVSFLPAQHTVGSPRDRKPCRAGCFVCRQSKQQLEEEQKKALYGLEAAEDVEEWQVVCGKFLAINATNMSCACRRSPRGLSPAAHLGDGSSDLILIRKCSRFNFLRFLIRHTNQQDQFDFTFVEVYRVKKFQFTSKHMEDEDSDLKEGGKKRFGHICSSHPSCCCTVSNSSWNCDGEVLHSPAIEVRVHCQLVRLFARGIEENPKPDSHS,brenda,Q8TCT0,CCCCCCCCCCCCC/C=C/C(O)C(CO)N=C(O)CCCCC,0.03,30.0,7.025,2.7.1.138,9606.0,-1.5228787452803376,-1.5228787452803376,CCCCCCCCCCCCC/C=C/C(O)C(CO)N=C(O)CCCCC__MGATGAAEPLQSVLWVKQQRCAVSLEPARALLRWWRSPGPGAGAPGADACSVPVSEIIAVEETDVHGKHQGSGKWQKMEKPYAFTVHCVKRARRHRWKWAQVTFWCPEEQLCHLWLQTLREMLEKLTSRPKHLLVFINPFGGKGQGKRIYERKVAPLFTLASITTDIIVTEHANQAKETLYEINIDKYDGIVCVGGDGMFSEVLHGLIGRTQRSAGVDQNHPRAVLVPSSLRIGIIPAGSTDCVCYSTVGTSDAETSALHIVVGDSLAMDVSSVHHNSTLLRYSVSLLGYGFYGDIIKDSEKKRWLGLARYDFSGLKTFLSHHCYEGTVSFLPAQHTVGSPRDRKPCRAGCFVCRQSKQQLEEEQKKALYGLEAAEDVEEWQVVCGKFLAINATNMSCACRRSPRGLSPAAHLGDGSSDLILIRKCSRFNFLRFLIRHTNQQDQFDFTFVEVYRVKKFQFTSKHMEDEDSDLKEGGKKRFGHICSSHPSCCCTVSNSSWNCDGEVLHSPAIEVRVHCQLVRLFARGIEENPKPDSHS,./data/raw/alphafold//AF-Q8TCT0-F1-model_v4.pdb,5444,3102,3834,4454 +3821,9584,9735,MKPENKLPVLDLISAEMKTVVNTLQPDLPPWPATGTIAEQRQYYTLERRFWNAGAPEMATRAYMVPTKYGQVETRLFCPQPDSPATLFYLHGGGFILGNLDTHDRIMRLLASYSQCTVIGIDYTLSPEARFPQAIEEIVAACCYFHQQAEDYQINMSRIGFAGDSAGAMLALASALWLRDKQIDCGKVAGVLLWYGLYGLRDSVTRRLLGGVWDGLTQQDLQMYEEAYLSNDADRESPYYCLFNNDLTREVPPCFIAGAEFDPLLDDSRLLYQTLAAHQQPCEFKLYPGTLHAFLHYSRMMKTADEALRDGAQFFTAQL,sabio,P23872,CCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1,0.22,25.0,7.1,3.1.1.-,562.0,-0.6575773191777937,-0.6575773191777937,CCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1__MKPENKLPVLDLISAEMKTVVNTLQPDLPPWPATGTIAEQRQYYTLERRFWNAGAPEMATRAYMVPTKYGQVETRLFCPQPDSPATLFYLHGGGFILGNLDTHDRIMRLLASYSQCTVIGIDYTLSPEARFPQAIEEIVAACCYFHQQAEDYQINMSRIGFAGDSAGAMLALASALWLRDKQIDCGKVAGVLLWYGLYGLRDSVTRRLLGGVWDGLTQQDLQMYEEAYLSNDADRESPYYCLFNNDLTREVPPCFIAGAEFDPLLDDSRLLYQTLAAHQQPCEFKLYPGTLHAFLHYSRMMKTADEALRDGAQFFTAQL,./data/raw/alphafold//AF-P23872-F1-model_v4.pdb,3596,1226,1958,1837 +3822,30700,31244,MHKICVIEGDGIGKEVVPATIQVLEATGLPFEFVYAEAGDEVYKRTGKALPEETIETALDCDAVLFGAAGETAADVIVKLRHILDTYANIRPVKAYKGVKCLRPDIDYVIVRENTEGLYKGIEAEIDEGITIATRVITEKACERIFRFAFNLARERKKMGKEGKVTCAHKANVLKLTDGLFKKIFYKVAEEYDDIKAEDYYIDAMNMYIITKPQVFDVVVTSNLFGDILSDGAAGTVGGLGLAPSANIGDEHGLFEPVHGSAPDIAGKKIANPTATILSAVLMLRYLGEYEAADKVEKALEEVLALGLTTPDLGGNLNTFEMAEEVAKRVREE,sabio,Q58130,O=C(O)CC(O)C(=O)O,0.41,60.0,8.5,1.1.1.83,2190.0,-0.3872161432802645,-0.3872161432802645,O=C(O)CC(O)C(=O)O__MHKICVIEGDGIGKEVVPATIQVLEATGLPFEFVYAEAGDEVYKRTGKALPEETIETALDCDAVLFGAAGETAADVIVKLRHILDTYANIRPVKAYKGVKCLRPDIDYVIVRENTEGLYKGIEAEIDEGITIATRVITEKACERIFRFAFNLARERKKMGKEGKVTCAHKANVLKLTDGLFKKIFYKVAEEYDDIKAEDYYIDAMNMYIITKPQVFDVVVTSNLFGDILSDGAAGTVGGLGLAPSANIGDEHGLFEPVHGSAPDIAGKKIANPTATILSAVLMLRYLGEYEAADKVEKALEEVLALGLTTPDLGGNLNTFEMAEEVAKRVREE,./data/raw/alphafold//AF-Q58130-F1-model_v4.pdb,4306,1880,2779,2800 +3823,27006,27470,MNLLSLLLILLGIILGVVGGYVVARNLLLQKQSQARQTAEDIVNQAHKEADNIKKEKLLEAKEENQILREQTEAELRERRSELQRQETRLLQKEENLERKSDLLDKKDEILEQKESKIEEKQQQVDAKESSVQTLIMKHEQELERISGLTQEEAINEQLQRVEEELSQDIAVLVKEKEKEAKEKVDKTAKELLATAVQRLAADHTSESTVSVVNLPNDEMKGRIIGREGRNIRTLETLTGIDLIIDDTPEAVILSGFDPIRREIARTALVNLVSDGRIHPGRIEDMVEKARKEVDDIIREAGEQATFEVNAHNMHPDLVKIVGRLNYRTSYGQNVLKHSIEVAHLASMLAAELGEDETLAKRAGLLHDVGKAIDHEVEGSHVEIGVELAKKYGENETVINAIHSHHGDVEPTSIISILVAAADALSAARPGARKETLENYIRRLERLETLSESYDGVEKAFAIQAGREIRVIVSPEEIDDLKSYRLARDIKNQIEDELQYPGHIKVTVVRETRAVEYAK,sabio,Q2FZ08,Nc1ncnc2c1ncn2C1OC(CO)C2OP(=O)(O)OC21,17.0,37.0,9.0,3.1.4.16,1280.0,1.230448921378274,1.230448921378274,Nc1ncnc2c1ncn2C1OC(CO)C2OP(=O)(O)OC21__MNLLSLLLILLGIILGVVGGYVVARNLLLQKQSQARQTAEDIVNQAHKEADNIKKEKLLEAKEENQILREQTEAELRERRSELQRQETRLLQKEENLERKSDLLDKKDEILEQKESKIEEKQQQVDAKESSVQTLIMKHEQELERISGLTQEEAINEQLQRVEEELSQDIAVLVKEKEKEAKEKVDKTAKELLATAVQRLAADHTSESTVSVVNLPNDEMKGRIIGREGRNIRTLETLTGIDLIIDDTPEAVILSGFDPIRREIARTALVNLVSDGRIHPGRIEDMVEKARKEVDDIIREAGEQATFEVNAHNMHPDLVKIVGRLNYRTSYGQNVLKHSIEVAHLASMLAAELGEDETLAKRAGLLHDVGKAIDHEVEGSHVEIGVELAKKYGENETVINAIHSHHGDVEPTSIISILVAAADALSAARPGARKETLENYIRRLERLETLSESYDGVEKAFAIQAGREIRVIVSPEEIDDLKSYRLARDIKNQIEDELQYPGHIKVTVVRETRAVEYAK,./data/raw/alphafold//AF-Q2FZ08-F1-model_v4.pdb,2907,79,86,99 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+3826,1721,1759,MQDWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRFGGTSAYSGASIWLPGTQVQERAGLPDSTENARTYLRALLGDAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADIGDLAGKVRPELDQDRTGQDHAPGPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDGRVVGAEVESGGETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALLDQAWFCPGVEQPDGSAAFMVGVRGGLVVDSAGERYLNESLPYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTAPAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFCPPNGGANAALTAIENGPFYAARIVLSDLGTKGGLVTDVNGRVLRADGSAIDGLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK,sabio,Q9RA02,CC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C,0.018,30.0,7.4,1.3.99.4,1833.0,-1.744727494896694,-1.744727494896694,CC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C__MQDWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRFGGTSAYSGASIWLPGTQVQERAGLPDSTENARTYLRALLGDAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADIGDLAGKVRPELDQDRTGQDHAPGPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDGRVVGAEVESGGETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALLDQAWFCPGVEQPDGSAAFMVGVRGGLVVDSAGERYLNESLPYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTAPAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFCPPNGGANAALTAIENGPFYAARIVLSDLGTKGGLVTDVNGRVLRADGSAIDGLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK,./data/raw/alphafold//AF-Q9RA02-F1-model_v4.pdb,3745,882,1061,1305 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+3882,32905,33491,MRSLLLLASLAWLLLAQAKDDAKLEDNLLVLTVATKETEGFRRFKRSAQFFNYKIQSLGLGEDWSAAGGPSAAGGGQKVRLLKKALKKYADKEDLVILFVDSYDVVFASGPRELLKKFQQAKSRVVFSAEELIYPDRRLEAKYPTVPDGKRFLGSGGFIGYAPSLSKLVAEWEGQDNDSDQLFYTKIFLDPEKREQINISLDHRCRIFQNLDGALDEVVLKFEMGHVRARNLAYDTLPVVIHGNGPTKLQVNYLGNYIPRFWTFETGCTVCDEGLRSLKGIGDEALPTVLVGVFIEQPTPFLSLFFRRLLHLRYPQKQMRLFIHNQEQHHKLQVEQFLAEHGGEYQSVKLVGPEVRMANADARNMGADLCRQDQTCTYYFSVDADVALTEPNSLRLLIEQNKNVIAPLMTRHGRLWSNFWGALSADGYYARSEDYVDIVQGRRVGVWNVPYISNIYLIKGSALRAELRHVDLFHYSKLDPDMSFCANVRQQEVFMFLTNRHTFGHLLSLDNYQTTHLHNDLWEVFSNPQDWKEKYIHENYTKALAGKLVETPCPDVYWFPIFTEVACDELVEEMEHYGQWSLGDNKDNRIQGGYENVPTIDIHMNQITFEREWHKFLVEYIAPLTEKLYPGYYTKAQFDLAFVVRYKPDEQPSLMPHHDASTFTINIALNRVGEDYEGGGCRFLRYNCSVRAPRKGWALMHPGRLTHYHEGLPTTKGTRYIAVSFVDP,brenda,Q63321,O=C1O[C@H]([C@@H](O)CO)C(O)=C1O,0.122,37.0,7.4,1.14.11.4,10116.0,-0.9136401693252518,-0.9136401693252518,O=C1O[C@H]([C@@H](O)CO)C(O)=C1O__MRSLLLLASLAWLLLAQAKDDAKLEDNLLVLTVATKETEGFRRFKRSAQFFNYKIQSLGLGEDWSAAGGPSAAGGGQKVRLLKKALKKYADKEDLVILFVDSYDVVFASGPRELLKKFQQAKSRVVFSAEELIYPDRRLEAKYPTVPDGKRFLGSGGFIGYAPSLSKLVAEWEGQDNDSDQLFYTKIFLDPEKREQINISLDHRCRIFQNLDGALDEVVLKFEMGHVRARNLAYDTLPVVIHGNGPTKLQVNYLGNYIPRFWTFETGCTVCDEGLRSLKGIGDEALPTVLVGVFIEQPTPFLSLFFRRLLHLRYPQKQMRLFIHNQEQHHKLQVEQFLAEHGGEYQSVKLVGPEVRMANADARNMGADLCRQDQTCTYYFSVDADVALTEPNSLRLLIEQNKNVIAPLMTRHGRLWSNFWGALSADGYYARSEDYVDIVQGRRVGVWNVPYISNIYLIKGSALRAELRHVDLFHYSKLDPDMSFCANVRQQEVFMFLTNRHTFGHLLSLDNYQTTHLHNDLWEVFSNPQDWKEKYIHENYTKALAGKLVETPCPDVYWFPIFTEVACDELVEEMEHYGQWSLGDNKDNRIQGGYENVPTIDIHMNQITFEREWHKFLVEYIAPLTEKLYPGYYTKAQFDLAFVVRYKPDEQPSLMPHHDASTFTINIALNRVGEDYEGGGCRFLRYNCSVRAPRKGWALMHPGRLTHYHEGLPTTKGTRYIAVSFVDP,./data/raw/alphafold//AF-Q63321-F1-model_v4.pdb,1829,7283,9231,9560 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+3885,15499,15719,MKIIRIETSRIAVPLTKPFKTALRTVYTAESVIVRITYDSGAVGWGEAPPTLVITGDSMDSIESAIHHVLKPALLGKSLAGYEAILHDIQHLLTGNMSAKAAVEMALYDGWAQMCGLPLYQMLGGYRDTLETDYTVSVNSPEEMAADAENYLKQGFQTLKIKVGKDDIATDIARIQEIRKRVGSAVKLRLDANQGWRPKEAVTAIRKMEDAGLGIELVEQPVHKDDLAGLKKVTDATDTPIMADESVFTPRQAFEVLQTRSADLINIKLMKAGGISGAEKINAMAEACGVECMVGSMIETKLGITAAAHFAASKRNITRFDFDAPLMLKTDVFNGGITYSGSTISMPGKPGLGIIGAALLKGEKEQ,brenda,O34508,C[C@H](N)C(=O)CN[C@H](CC(=O)O)C(=O)O,0.028,37.0,8.5,5.1.1.20,1423.0,-1.5528419686577808,-1.5528419686577808,C[C@H](N)C(=O)CN[C@H](CC(=O)O)C(=O)O__MKIIRIETSRIAVPLTKPFKTALRTVYTAESVIVRITYDSGAVGWGEAPPTLVITGDSMDSIESAIHHVLKPALLGKSLAGYEAILHDIQHLLTGNMSAKAAVEMALYDGWAQMCGLPLYQMLGGYRDTLETDYTVSVNSPEEMAADAENYLKQGFQTLKIKVGKDDIATDIARIQEIRKRVGSAVKLRLDANQGWRPKEAVTAIRKMEDAGLGIELVEQPVHKDDLAGLKKVTDATDTPIMADESVFTPRQAFEVLQTRSADLINIKLMKAGGISGAEKINAMAEACGVECMVGSMIETKLGITAAAHFAASKRNITRFDFDAPLMLKTDVFNGGITYSGSTISMPGKPGLGIIGAALLKGEKEQ,./data/raw/alphafold//AF-O34508-F1-model_v4.pdb,430,3661,4995,5310 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+3889,22655,23007,MSSATASNTFFLHSCFLLFCLLSAPSCVSMFSGIETGDLEKRDDLFPQILRDEAVARLYELGKVSDASGYLERTFLSPASMRAINLIRKWMEDAGLRTWVDQMGNVHGRVDGANANAEALLIGSHMDTVVDAGMFDGSLGIVSAISALKAMHVNGKLQKLKRPVEVIAFSDEEGVRFQTTFLGSGAIAGILPGTTLEISDKREVMIKDFLKENSIDITEESLLKLKYDPKSVWGYVEVHIEQGPVLEQVGFPLGVVKGIAGQTRLKVTVRGSQGHAGTVPMSMRQDPMAAAAEQIVVLESLCKHPEEYLSYDGHCSDSTVKSLSTSLVCTVGEISTWPSASNVIPGQVTYTVDIRAIDDLGREAVIYDLSKQIYQICDKRSVSCIIEHKHDAGAVICDSDLSSQLKSAAYSALKKMEGDIQDEVPTLMSGAGHDAMAISHLTKVGMLFVRCRGGISHSPQEHVLDNDVWAASLATLSFLENLS,sabio,I1L153,NC(=O)NC(NC(N)=O)C(=O)O,0.102,30.0,8.0,3.5.3.9,3847.0,-0.9913998282380824,-0.9913998282380824,NC(=O)NC(NC(N)=O)C(=O)O__MSSATASNTFFLHSCFLLFCLLSAPSCVSMFSGIETGDLEKRDDLFPQILRDEAVARLYELGKVSDASGYLERTFLSPASMRAINLIRKWMEDAGLRTWVDQMGNVHGRVDGANANAEALLIGSHMDTVVDAGMFDGSLGIVSAISALKAMHVNGKLQKLKRPVEVIAFSDEEGVRFQTTFLGSGAIAGILPGTTLEISDKREVMIKDFLKENSIDITEESLLKLKYDPKSVWGYVEVHIEQGPVLEQVGFPLGVVKGIAGQTRLKVTVRGSQGHAGTVPMSMRQDPMAAAAEQIVVLESLCKHPEEYLSYDGHCSDSTVKSLSTSLVCTVGEISTWPSASNVIPGQVTYTVDIRAIDDLGREAVIYDLSKQIYQICDKRSVSCIIEHKHDAGAVICDSDLSSQLKSAAYSALKKMEGDIQDEVPTLMSGAGHDAMAISHLTKVGMLFVRCRGGISHSPQEHVLDNDVWAASLATLSFLENLS,./data/raw/alphafold//AF-I1L153-F1-model_v4.pdb,4611,5717,7391,8296 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+3913,12194,12363,MVLVKDVFSEGPLPVQILAIPQANSSPCSKLADKNGTATTPSPCRPPKPLLIALPSQHGDYPLILFFHGYVLLNSFYSQLLRHVASHGYIAIAPQMYSVIGPNTTPEIADAAAITDWLRDGLSDNLPQALNNHVRPNFEKFVLAGHSRGGKVAFALALGRVSQPSLKYSALVGLDPVDGMGKDQQTSHPILSYREHSFDLGMPTLVVGSGLGPCKRNPLFPPCAPQGVNHHDFFYECVAPAYHFVASDYGHLDFLDDDTKGIRGKATYCLCKNGEAREPMRKFSGGIVVAFLQAFLGDNRGALNDIMVYPSHAPVKIEPPESLVTEDVKSPEVELLRRAVCR,brenda,Q7Y0K5,CCc1c(C)/c2[n-]/c1=C\C1=C(C)C3=C([NH2+]1)/C(=C1\[N-]/C(=C\C4=C(C)C(C(C)=O)=C(/C=2)[NH2+]4)[C@@H](C)[C@@H]1CCC(=O)OC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C(C(=O)OC)C3=O.[H].[H].[Mg+2],0.0334,25.0,7.5,3.1.1.14,3311.0,-1.4762535331884354,-1.4762535331884354,CCc1c(C)/c2[n-]/c1=C\C1=C(C)C3=C([NH2+]1)/C(=C1\[N-]/C(=C\C4=C(C)C(C(C)=O)=C(/C=2)[NH2+]4)[C@@H](C)[C@@H]1CCC(=O)OC/C=C(\C)CCCC(C)CCCC(C)CCCC(C)C)C(C(=O)OC)C3=O.[H].[H].[Mg+2]__MVLVKDVFSEGPLPVQILAIPQANSSPCSKLADKNGTATTPSPCRPPKPLLIALPSQHGDYPLILFFHGYVLLNSFYSQLLRHVASHGYIAIAPQMYSVIGPNTTPEIADAAAITDWLRDGLSDNLPQALNNHVRPNFEKFVLAGHSRGGKVAFALALGRVSQPSLKYSALVGLDPVDGMGKDQQTSHPILSYREHSFDLGMPTLVVGSGLGPCKRNPLFPPCAPQGVNHHDFFYECVAPAYHFVASDYGHLDFLDDDTKGIRGKATYCLCKNGEAREPMRKFSGGIVVAFLQAFLGDNRGALNDIMVYPSHAPVKIEPPESLVTEDVKSPEVELLRRAVCR,./data/raw/alphafold//AF-Q7Y0K5-F1-model_v4.pdb,3279,641,755,916 +3914,2642,2689,MSFRLQPAPPARPNRCQLFGPGSRPALFEKMAASAADVINLDLEDSVAPDDKAQARANIIEAINGLDWGRKYLSVRINGLDTPFWYRDVVDLLEQAGDRLDQIMIPKVGCAADVYAVDALVTAIERAKGRTKPLSFEVIIESAAGIAHVEEIAASSPRLQAMSLGAADFAASMGMQTTGIGGTQENYYMLHDGQKHWSDPWHWAQAAIVAACRTHGILPVDGPFGDFSDDEGFRAQARRSATLGMVGKWAIHPKQVALANEVFTPSETAVTEAREILAAMDAAKARGEGATVYKGRLVDIASIKQAEVIVRQAEMISA,brenda,Q3J5L6,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.1,35.0,7.833333333333333,4.1.3.24,1063.0,-1.0,-1.0,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MSFRLQPAPPARPNRCQLFGPGSRPALFEKMAASAADVINLDLEDSVAPDDKAQARANIIEAINGLDWGRKYLSVRINGLDTPFWYRDVVDLLEQAGDRLDQIMIPKVGCAADVYAVDALVTAIERAKGRTKPLSFEVIIESAAGIAHVEEIAASSPRLQAMSLGAADFAASMGMQTTGIGGTQENYYMLHDGQKHWSDPWHWAQAAIVAACRTHGILPVDGPFGDFSDDEGFRAQARRSATLGMVGKWAIHPKQVALANEVFTPSETAVTEAREILAAMDAAKARGEGATVYKGRLVDIASIKQAEVIVRQAEMISA,./data/raw/alphafold//AF-Q3J5L6-F1-model_v4.pdb,3684,1344,2098,2000 +3915,12414,12586,MAKKRIAVIGAGASGLTCIKCCLEEGLEPVCFERSGDIGGLWRFQEAPEEGRASIYQSVVINTSKEMMCFSDYPIPDHYPNYMHNSQVLEYFRMYAKEFDLLKYIQFKTTVCSVKKQPDFSTSGQWQVVTECEGKQQVDVFDGVLVCTGHHTDAHLPLESFPGIEKFKGKYFHSRDYKNPVEFTGKRVIVIGIGNSGGDLAVEISHTAKQVFLSTRRGAWILNRVGKHGYPIDLLLSSRIMYYLSRICGPSLKNNYMEKQMNQRFDHEMFGLKPKHRALSQHPTVNDDLPNRIIAGLVKVKGNVKEFTETAAVFEDGSREDGIDVVIFATGYSFAFPFLEDSVKVVKNKVSLYKKVFPPNLEKPTLAIIGLIQPLGAIMPISELQGRWATQVFKGLKKLPSQSEMMAEINKAREEMAKRYVDSQRHTIQGDYIDTMEEIADLVGVRPNILPLVFTDPRLALRLLLGPCTPVQYRLQGPGKWAGARKTILTTEDRVRKPLMTRVVERDSSGGSLVTVRVLMLAVAFFAVILAYF,brenda,P97872,CN(C)CCCCCCCCN1c2ccccc2Sc2ccc(C(F)(F)F)cc21,0.117,37.0,8.4,1.14.13.8,10090.0,-0.9318141382538384,-0.9318141382538384,CN(C)CCCCCCCCN1c2ccccc2Sc2ccc(C(F)(F)F)cc21__MAKKRIAVIGAGASGLTCIKCCLEEGLEPVCFERSGDIGGLWRFQEAPEEGRASIYQSVVINTSKEMMCFSDYPIPDHYPNYMHNSQVLEYFRMYAKEFDLLKYIQFKTTVCSVKKQPDFSTSGQWQVVTECEGKQQVDVFDGVLVCTGHHTDAHLPLESFPGIEKFKGKYFHSRDYKNPVEFTGKRVIVIGIGNSGGDLAVEISHTAKQVFLSTRRGAWILNRVGKHGYPIDLLLSSRIMYYLSRICGPSLKNNYMEKQMNQRFDHEMFGLKPKHRALSQHPTVNDDLPNRIIAGLVKVKGNVKEFTETAAVFEDGSREDGIDVVIFATGYSFAFPFLEDSVKVVKNKVSLYKKVFPPNLEKPTLAIIGLIQPLGAIMPISELQGRWATQVFKGLKKLPSQSEMMAEINKAREEMAKRYVDSQRHTIQGDYIDTMEEIADLVGVRPNILPLVFTDPRLALRLLLGPCTPVQYRLQGPGKWAGARKTILTTEDRVRKPLMTRVVERDSSGGSLVTVRVLMLAVAFFAVILAYF,./data/raw/alphafold//AF-P97872-F1-model_v4.pdb,3898,3485,4750,1656 +3916,14921,15134,MVDWAEECDVLVVGSGAGGCCGAYTAAREGLSVVLVEASEYFGGTTAYSGGGGVWFPTNAVLRRAGDDDTIDDALTYYHAVVGDRTPRDLQDAYVRGGAPLIDYLEADEDIEFTAYPWPDYFGKAPKASAKGRHIAPTPRSVADDPELNESVRGPLGRERNGDPLPDKLIGGRALIGRFLVAMRKYPNVQLHRNTPLEELVVEDGAVVGAIVSHGEQRRAVRARKGVVLAAGGFDHNDEMRARYGVPGAARDSMGPWSNLGKAHQAAIAIGADVDLMSEAWWSPGLTHPDGRSAFALCFTGGIFVDQDGNRFTNEYAPYDRLGRDIIARMDKGEMTLPFWMIYDDRSGVVPPIAATNVPLVETEKYEAAGLWKTADTLAELAGQIGVSAEALEATVARFNRLAAGGVDEDFGRGDEPYDVAFTGGGSALVPIEKGPFHAAQFGISDLGTKGGLRTDTVGRVLDGAGTPIPGLYAAGNTMAAPSGTVYPGGGNPIGTSALFAHLAVRHMAGA,brenda,I0B6J0,C[C@@H](C(=O)O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,0.0761,30.0,7.0,1.3.99.4,1830.0,-1.1186153432294272,-1.1186153432294272,C[C@@H](C(=O)O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C__MVDWAEECDVLVVGSGAGGCCGAYTAAREGLSVVLVEASEYFGGTTAYSGGGGVWFPTNAVLRRAGDDDTIDDALTYYHAVVGDRTPRDLQDAYVRGGAPLIDYLEADEDIEFTAYPWPDYFGKAPKASAKGRHIAPTPRSVADDPELNESVRGPLGRERNGDPLPDKLIGGRALIGRFLVAMRKYPNVQLHRNTPLEELVVEDGAVVGAIVSHGEQRRAVRARKGVVLAAGGFDHNDEMRARYGVPGAARDSMGPWSNLGKAHQAAIAIGADVDLMSEAWWSPGLTHPDGRSAFALCFTGGIFVDQDGNRFTNEYAPYDRLGRDIIARMDKGEMTLPFWMIYDDRSGVVPPIAATNVPLVETEKYEAAGLWKTADTLAELAGQIGVSAEALEATVARFNRLAAGGVDEDFGRGDEPYDVAFTGGGSALVPIEKGPFHAAQFGISDLGTKGGLRTDTVGRVLDGAGTPIPGLYAAGNTMAAPSGTVYPGGGNPIGTSALFAHLAVRHMAGA,./data/raw/alphafold//AF-I0B6J0-F1-model_v4.pdb,3745,1434,2220,2142 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+3918,2838,2890,MSGWARALLLAAVLVVMACLVPAATASLHAEETLTSQFAEFKQKHGRVYESAAEEAFRLSVFRENLFLARLHAAANPHATFGVTPFSDLTREEFRSRYHNGAAHFAAAQERARVPVKVEVVGAPAAVDWRARGAVTAVKDQGQCGSCWAFSAIGNVECQWFLAGHPLTNLSEQMLVSCDKTDSGCSGGLMNNAFEWIVQENNGAVYTEDSYPYASGEGISPPCTTSGHTVGATITGHVELPQDEAQIAAWLAVNGPVAVAVDASSWMTYTGGVMTSCVSEQLDHGVLLVGYNDSAAVPYWIIKNSWTTQWGEEGYIRIAKGSNQCLVKEEASSAVVGGPGPTPEPTTTTTTSAPGPSPSYFVQMSCTDAACIVGCENVTLPTGQCLLTTSGVSAIVTCGAETLTEEVFLTSTHCSGPSVRSSVPLNKCNRLLRGSVEFFCGSSSSGRLADVDRQRRHQPYHSRHRRL,uniprot_search,P25779,CC(=O)[C@H](CCC(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N=C(O)[C@H](CCCCN)N=C(O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)c1ccccc1N,0.0021,26.666666666666668,6.125,3.4.22.51,5693.0,-2.677780705266081,-2.677780705266081,CC(=O)[C@H](CCC(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N=C(O)[C@H](CCCCN)N=C(O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)c1ccccc1N__MSGWARALLLAAVLVVMACLVPAATASLHAEETLTSQFAEFKQKHGRVYESAAEEAFRLSVFRENLFLARLHAAANPHATFGVTPFSDLTREEFRSRYHNGAAHFAAAQERARVPVKVEVVGAPAAVDWRARGAVTAVKDQGQCGSCWAFSAIGNVECQWFLAGHPLTNLSEQMLVSCDKTDSGCSGGLMNNAFEWIVQENNGAVYTEDSYPYASGEGISPPCTTSGHTVGATITGHVELPQDEAQIAAWLAVNGPVAVAVDASSWMTYTGGVMTSCVSEQLDHGVLLVGYNDSAAVPYWIIKNSWTTQWGEEGYIRIAKGSNQCLVKEEASSAVVGGPGPTPEPTTTTTTSAPGPSPSYFVQMSCTDAACIVGCENVTLPTGQCLLTTSGVSAIVTCGAETLTEEVFLTSTHCSGPSVRSSVPLNKCNRLLRGSVEFFCGSSSSGRLADVDRQRRHQPYHSRHRRL,./data/raw/alphafold//AF-P25779-F1-model_v4.pdb,3740,1424,2201,2118 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+3963,15027,15240,MKIFAYGIRDDEKPSLEEWKAANPEIEVDYTQELLTPETAKLAEGSDSAVVYQQLDYTRETLTALANVGVTNLSLRNVGTDNIDFDAAREFNFNISNVPVYSPNAIAEHSMLQLSRLLRRTKALDAKIAKRDLRWAPTTGREMRMQTVGVIGTGHIGRVAINILKGFGAKVIAYDKYPNAELQAEGLYVDTLDELYAQADAISLYVPGVPENHHLINADAIAKMKDGVVIMNAARGNLMDIDAIIDGLNSGKISDFGMDVYENEVACSMKIGLVKNSPDAKIADLIARENVMITPHTAFYTTKAVLEMVHQSFDAAVAFAKGEKPAIAVEY,brenda,P51011,C[C@@H](O)C(=O)O,19.0,,,1.1.1.28,33965.0,1.2787536009528289,1.2787536009528289,C[C@@H](O)C(=O)O__MKIFAYGIRDDEKPSLEEWKAANPEIEVDYTQELLTPETAKLAEGSDSAVVYQQLDYTRETLTALANVGVTNLSLRNVGTDNIDFDAAREFNFNISNVPVYSPNAIAEHSMLQLSRLLRRTKALDAKIAKRDLRWAPTTGREMRMQTVGVIGTGHIGRVAINILKGFGAKVIAYDKYPNAELQAEGLYVDTLDELYAQADAISLYVPGVPENHHLINADAIAKMKDGVVIMNAARGNLMDIDAIIDGLNSGKISDFGMDVYENEVACSMKIGLVKNSPDAKIADLIARENVMITPHTAFYTTKAVLEMVHQSFDAAVAFAKGEKPAIAVEY,./data/raw/alphafold//AF-P51011-F1-model_v4.pdb,493,3761,5114,5433 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+3980,9665,9816,MEVLGFLSPELNGPMVTMALAVVLLALLKWYSTSAFSRLEKLGIRHPKPSPFIGNLTFFRQGFWESHMELRKQYGPLSGYYLGRRMIVVISDPDMIKQVLAEKFSNFTNRMATGLESKPVADSILFLRDKRWEEVRSVLTSAFSPKKLNKLTPLISQACDLLLAHLERYAESGDAFDIQRCYCCYTTDVVASVAFGTQVNSSEEPEHPFVKHCRRFFAFSVPRLILVLILSFPSIMVPLARILPNKKRDEVNGFFNKLIRNVIALRDQQAAEERRQDFLQMVLDLRHSAPSVGVENFDIVRQAFSSAKGCPADPSQPHLPRPLSKPLTVDEVVGQAFLFLIAGYEIITNTLSFVTYLLATNPDCQEKLLREVDDFSKKHPSPEHCSLQQGLPYLDMVLSETLRMYPPAFRFTREAARDCEVLGQRIPAGTVLEVAVGALHHDPKHWPHPETFDPERFTAEAQRLQQPFTYLPFGAGPRSCLGVQLGLLEIKLTLLHILRKFRFEACPETQVPLQLESKSALSPKNGVYIRIVPR,uniprot_search,P47787,CCCCCC(O)/C=C/[C@@H]1[C@@H](C/C=C/CCCC(=O)O)[C@@H]2C[C@H]1OO2,0.012,30.0,7.5,5.3.99.5,9823.0,-1.9208187539523751,-1.9208187539523751,CCCCCC(O)/C=C/[C@@H]1[C@@H](C/C=C/CCCC(=O)O)[C@@H]2C[C@H]1OO2__MEVLGFLSPELNGPMVTMALAVVLLALLKWYSTSAFSRLEKLGIRHPKPSPFIGNLTFFRQGFWESHMELRKQYGPLSGYYLGRRMIVVISDPDMIKQVLAEKFSNFTNRMATGLESKPVADSILFLRDKRWEEVRSVLTSAFSPKKLNKLTPLISQACDLLLAHLERYAESGDAFDIQRCYCCYTTDVVASVAFGTQVNSSEEPEHPFVKHCRRFFAFSVPRLILVLILSFPSIMVPLARILPNKKRDEVNGFFNKLIRNVIALRDQQAAEERRQDFLQMVLDLRHSAPSVGVENFDIVRQAFSSAKGCPADPSQPHLPRPLSKPLTVDEVVGQAFLFLIAGYEIITNTLSFVTYLLATNPDCQEKLLREVDDFSKKHPSPEHCSLQQGLPYLDMVLSETLRMYPPAFRFTREAARDCEVLGQRIPAGTVLEVAVGALHHDPKHWPHPETFDPERFTAEAQRLQQPFTYLPFGAGPRSCLGVQLGLLEIKLTLLHILRKFRFEACPETQVPLQLESKSALSPKNGVYIRIVPR,./data/raw/alphafold//AF-P47787-F1-model_v4.pdb,5415,3198,3944,4322 +3981,15543,15764,MEIGVPKETKDQEYRVGLSPSSVRSLCERKHPVFVETQAGVGAGFSDQDYEAAGATVVPDPKSAWNRELVVKVKEPLPDEYTYLQKNQVLFTYLHLAANRRLTEALIDSGISAIAYETVELPNGKLPLLNPMSIIAGRLSVQFGARYLEKQQGGRGVLLGGFPGVRSGRVVILGGGVVGTEAARMAVGIGAQVQILDVNVERLAELENLFGSRVELLYSNSSQIEAVVPEADLLIGAVLTTGKRAPKLVTRELVKQMRAGSVIVDVAVDQGGCVETLQVTSHSHPTYTEEGVVHFGVPNMPGAVPWTATQALNNSTLPYVIQLADQGLTALESNPILGKGLNVQKQQLIHPAVKEVFPDL,brenda,A0A3G4YK61,C[C@H](N)C(=O)O,0.72,37.0,8.8,1.4.1.1,72020.0,-0.1426675035687315,-0.1426675035687315,C[C@H](N)C(=O)O__MEIGVPKETKDQEYRVGLSPSSVRSLCERKHPVFVETQAGVGAGFSDQDYEAAGATVVPDPKSAWNRELVVKVKEPLPDEYTYLQKNQVLFTYLHLAANRRLTEALIDSGISAIAYETVELPNGKLPLLNPMSIIAGRLSVQFGARYLEKQQGGRGVLLGGFPGVRSGRVVILGGGVVGTEAARMAVGIGAQVQILDVNVERLAELENLFGSRVELLYSNSSQIEAVVPEADLLIGAVLTTGKRAPKLVTRELVKQMRAGSVIVDVAVDQGGCVETLQVTSHSHPTYTEEGVVHFGVPNMPGAVPWTATQALNNSTLPYVIQLADQGLTALESNPILGKGLNVQKQQLIHPAVKEVFPDL,./data/raw/alphafold//AF-A0A3G4YK61-F1-model_v4.pdb,3346,730,872,1069 +3982,209,220,MQCSWKAVLLLALASIAIQYTAIRTFTAKSFHTCPGLAEAGLAERLCEESPTFAYNLSRKTHILILATTRSGSSFVGQLFNQHLDVFYLFEPLYHVQNTLIPRFTQGKSPADRRVMLGASRDLLRSLYDCDLYFLENYIKPPPVNHTTDRIFRRGASRVLCSRPVCDPPGPADLVLEEGDCVRKCGLLNLTVAAEACRERSHVAIKTVRVPEVNDLRALVEDPRLNLKVIQLVRDPRGILASRSETFRDTYRLWRLWYGTGRKPYNLDVTQLTTVCEDFSNSVSTGLMRPPWLKGKYMLVRYEDLARNPMKKTEEIYGFLGIPLDSHVARWIQNNTRGDPTLGKHKYGTVRNSAATAEKWRFRLSYDIVAFAQNACQQVLAQLGYKIAASEEELKNPSVSLVEERDFRPFS,sabio,O43916,*OC1C(O)C(COS(=O)(=O)O)OC(OC2C(COS(=O)(=O)O)OC(OC3C(O)C(CO)OC(OC4C(COS(=O)(=O)O)OC(*)C(NC(C)=O)C4O)C3O)C(NC(C)=O)C2O)C1O,0.38,37.0,6.4,2.8.2.21,9606.0,-0.4202164033831898,-0.4202164033831898,*OC1C(O)C(COS(=O)(=O)O)OC(OC2C(COS(=O)(=O)O)OC(OC3C(O)C(CO)OC(OC4C(COS(=O)(=O)O)OC(*)C(NC(C)=O)C4O)C3O)C(NC(C)=O)C2O)C1O__MQCSWKAVLLLALASIAIQYTAIRTFTAKSFHTCPGLAEAGLAERLCEESPTFAYNLSRKTHILILATTRSGSSFVGQLFNQHLDVFYLFEPLYHVQNTLIPRFTQGKSPADRRVMLGASRDLLRSLYDCDLYFLENYIKPPPVNHTTDRIFRRGASRVLCSRPVCDPPGPADLVLEEGDCVRKCGLLNLTVAAEACRERSHVAIKTVRVPEVNDLRALVEDPRLNLKVIQLVRDPRGILASRSETFRDTYRLWRLWYGTGRKPYNLDVTQLTTVCEDFSNSVSTGLMRPPWLKGKYMLVRYEDLARNPMKKTEEIYGFLGIPLDSHVARWIQNNTRGDPTLGKHKYGTVRNSAATAEKWRFRLSYDIVAFAQNACQQVLAQLGYKIAASEEELKNPSVSLVEERDFRPFS,./data/raw/alphafold//AF-O43916-F1-model_v4.pdb,2959,150,162,178 +3983,19083,19358,MAQKEGGRTVPCCSRPKVAALTAGTLLLLTAIGAASWAIVAVLLRSDQEPLYPVQVSSADARLMVFDKTEGTWRLLCSSRSNARVAGLSCEEMGFLRALTHSELDVRTAGANGTSGFFCVDEGRLPHTQRLLEVISVCDCPRGRFLAAICQDCGRRKLPVDRIVGGRDTSLGRWPWQVSLRYDGAHLCGGSLLSGDWVLTAAHCFPERNRVLSRWRVFAGAVAQASPHGLQLGVQAVVYHGGYLPFRDPNSEENSNDIALVHLSSPLPLTEYIQPVCLPAAGQALVDGKICTVTGWGNTQYYGQQAGVLQEARVPIISNDVCNGADFYGNQIKPKMFCAGYPEGGIDACQGDSGGPFVCEDSISRTPRWRLCGIVSWGTGCALAQKPGVYTKVSDFREWIFQAIKTHSEASGMVTQL,uniprot_search,P05981,N=C(N)NCCC[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](CO)C(O)=N[C@@H](CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O,0.189,37.0,7.833333333333333,3.4.21.106,9606.0,-0.7235381958267558,-0.7235381958267558,N=C(N)NCCC[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](CO)C(O)=N[C@@H](CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O__MAQKEGGRTVPCCSRPKVAALTAGTLLLLTAIGAASWAIVAVLLRSDQEPLYPVQVSSADARLMVFDKTEGTWRLLCSSRSNARVAGLSCEEMGFLRALTHSELDVRTAGANGTSGFFCVDEGRLPHTQRLLEVISVCDCPRGRFLAAICQDCGRRKLPVDRIVGGRDTSLGRWPWQVSLRYDGAHLCGGSLLSGDWVLTAAHCFPERNRVLSRWRVFAGAVAQASPHGLQLGVQAVVYHGGYLPFRDPNSEENSNDIALVHLSSPLPLTEYIQPVCLPAAGQALVDGKICTVTGWGNTQYYGQQAGVLQEARVPIISNDVCNGADFYGNQIKPKMFCAGYPEGGIDACQGDSGGPFVCEDSISRTPRWRLCGIVSWGTGCALAQKPGVYTKVSDFREWIFQAIKTHSEASGMVTQL,./data/raw/alphafold//AF-P05981-F1-model_v4.pdb,5167,2055,1310,3071 +3984,28152,28638,MEDTKESNVKTFCSKNILAILGFSSIIAVIALLAVGLTQNKALPENVKYGIVLDAGSSHTSLYIYKWPAEKENDTGVVHQVEECRVKGPGISKFVQKVNEIGIYLTDCMERAREVIPRSQHQETPVYLGATAGMRLLRMESEELADRVLDVVERSLSNYPFDFQGARIITGQEEGAYGWITINYLLGKFSQKTRWFSIVPYETNNQETFGALDLGGASTQVTFVPQNQTIESPDNALQFRLYGKDYNVYTHSFLCYGKDQALWQKLAKDIQVASNEILRDPCFHPGYKKVVNVSDLYKTPCTKRFEMTLPFQQFEIQGIGNYQQCHQSILELFNTSYCPYSQCAFNGIFLPPLQGDFGAFSAFYFVMKFLNLTSEKVSQEKVTEMMKKFCAQPWEEIKTSYAGVKEKYLSEYCFSGTYILSLLLQGYHFTADSWEHIHFIGKIQGSDAGWTLGYMLNLTNMIPAEQPLSTPLSHSTYVFLMVLFSLVLFTVAIIGLLIFHKPSYFWKDMV,brenda,P49961,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.017,37.0,7.5,3.6.1.5,9606.0,-1.769551078621726,-1.769551078621726,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MEDTKESNVKTFCSKNILAILGFSSIIAVIALLAVGLTQNKALPENVKYGIVLDAGSSHTSLYIYKWPAEKENDTGVVHQVEECRVKGPGISKFVQKVNEIGIYLTDCMERAREVIPRSQHQETPVYLGATAGMRLLRMESEELADRVLDVVERSLSNYPFDFQGARIITGQEEGAYGWITINYLLGKFSQKTRWFSIVPYETNNQETFGALDLGGASTQVTFVPQNQTIESPDNALQFRLYGKDYNVYTHSFLCYGKDQALWQKLAKDIQVASNEILRDPCFHPGYKKVVNVSDLYKTPCTKRFEMTLPFQQFEIQGIGNYQQCHQSILELFNTSYCPYSQCAFNGIFLPPLQGDFGAFSAFYFVMKFLNLTSEKVSQEKVTEMMKKFCAQPWEEIKTSYAGVKEKYLSEYCFSGTYILSLLLQGYHFTADSWEHIHFIGKIQGSDAGWTLGYMLNLTNMIPAEQPLSTPLSHSTYVFLMVLFSLVLFTVAIIGLLIFHKPSYFWKDMV,./data/raw/alphafold//AF-P49961-F1-model_v4.pdb,1282,6502,8381,7860 +3985,40785,41522,MKVAILGAGCYRTHAACGITNFARAAEVAKKVGIPEITMTHSTITMGAELLHLVDEIDEVVVSDPCFAEEPGLVIIDEFDPKEVMEAHLAGEPEKVMPAIRDAVKAKAKEVPKPPKGCIHFVHPEKVGLKVTSDDVEAVKDADIIITWLPKGGSQPAIIKKFVDAIKEGAIVTHACTIPTPKFAKIFKDLGRDDLNIISYHPGAVPEMKGQVFISEGYASEEAVEKMYCIAKEARGTAYKMPANLISPVCDMGSAVTAPVYAAVLAYRDAVTKILGAPADFAQMMADEAITQILELMRKEGINNMEKTLDPKALTGTADSMCFGPLSDILPPALKVLEKHAAEEESCCCELKK,uniprot_search,Q50759,[HH],0.15,80.0,,1.12.98.2,2186.0,-0.8239087409443188,-0.8239087409443188,[HH]__MKVAILGAGCYRTHAACGITNFARAAEVAKKVGIPEITMTHSTITMGAELLHLVDEIDEVVVSDPCFAEEPGLVIIDEFDPKEVMEAHLAGEPEKVMPAIRDAVKAKAKEVPKPPKGCIHFVHPEKVGLKVTSDDVEAVKDADIIITWLPKGGSQPAIIKKFVDAIKEGAIVTHACTIPTPKFAKIFKDLGRDDLNIISYHPGAVPEMKGQVFISEGYASEEAVEKMYCIAKEARGTAYKMPANLISPVCDMGSAVTAPVYAAVLAYRDAVTKILGAPADFAQMMADEAITQILELMRKEGINNMEKTLDPKALTGTADSMCFGPLSDILPPALKVLEKHAAEEESCCCELKK,./data/raw/alphafold//AF-Q50759-F1-model_v4.pdb,522,3802,5160,5481 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+4021,13503,13698,IELGLLEILVAAGGKSLTPTEVAAKLPSAANPEAPDMVDRILRLLASYDVVTCLVEEGKDGRLSRSYGAAPVCKFLTPNEDGVSMAALALMNQDKVLMESWYYLKDAVLDGGIPFNKAYGMSAFEYHGTDPRFNRVFNEGMKNHSIIITKKLLELYHGFEGLGSLVDVGGGVGATVAAIAAHYPTIKGVNFDLPHVISEAPQFPGVTHVGGDMFKEVPSGDAILMKWILHDWSDQHCATLLKNCYDALPAHGKVVLVKCILPVNPEANPSSQGVFHVDMIMLAHNPGGNQRY,uniprot_search,Q70CS6,COc1cc(/C=C/C(=O)O)cc(O)c1O,0.0109,30.0,7.5,2.1.1.68,4606.0,-1.9625735020593764,-1.9625735020593764,COc1cc(/C=C/C(=O)O)cc(O)c1O__IELGLLEILVAAGGKSLTPTEVAAKLPSAANPEAPDMVDRILRLLASYDVVTCLVEEGKDGRLSRSYGAAPVCKFLTPNEDGVSMAALALMNQDKVLMESWYYLKDAVLDGGIPFNKAYGMSAFEYHGTDPRFNRVFNEGMKNHSIIITKKLLELYHGFEGLGSLVDVGGGVGATVAAIAAHYPTIKGVNFDLPHVISEAPQFPGVTHVGGDMFKEVPSGDAILMKWILHDWSDQHCATLLKNCYDALPAHGKVVLVKCILPVNPEANPSSQGVFHVDMIMLAHNPGGNQRY,./data/raw/alphafold//AF-Q70CS6-F1-model_v4.pdb,1707,2396,4786,5051 +4022,240,252,MNLAIVEAPADSTPPPADPLDHLADALFHEMGSPGVYGRTALYEDVVERIAAVISRNREPNTEVMRFPPVMNRAQLERSGYLKSFPNLLGCVCGLHGIESEIDAAISRFDAGGDWTESLSPADLVLSPAACYPLYPIAASRGPVPAAGWSFDVAADCFRREPSRHLDRLQSFRMREFVCIGSADHVSAFRERWIIRAQKIARDLGLTFRIDHANDPFFGRVGQMMAVSQKQLSLKFELLVPLRSEERPTACMSFNYHRDHFGTTWGIVDAAGEPAHTACVAFGMDRLAVAMFHTHGKDVALWPIAVRDLLGLAQTDRGAPSAFEEYRCAKEAGS,sabio,Q89GR3,*S,0.0039,30.0,7.5,6.2.1.n2,375.0,-2.408935392973501,-2.408935392973501,*S__MNLAIVEAPADSTPPPADPLDHLADALFHEMGSPGVYGRTALYEDVVERIAAVISRNREPNTEVMRFPPVMNRAQLERSGYLKSFPNLLGCVCGLHGIESEIDAAISRFDAGGDWTESLSPADLVLSPAACYPLYPIAASRGPVPAAGWSFDVAADCFRREPSRHLDRLQSFRMREFVCIGSADHVSAFRERWIIRAQKIARDLGLTFRIDHANDPFFGRVGQMMAVSQKQLSLKFELLVPLRSEERPTACMSFNYHRDHFGTTWGIVDAAGEPAHTACVAFGMDRLAVAMFHTHGKDVALWPIAVRDLLGLAQTDRGAPSAFEEYRCAKEAGS,./data/raw/alphafold//AF-Q89GR3-F1-model_v4.pdb,2975,170,183,201 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+110,18662,18933,MELIQDTSRPPLEYVKGVPLIKYFAEALGPLQSFQARPDDLLISTYPKSGTTWVSQILDMIYQGGDLEKCHRAPIFMRVPFLEFKAPGIPSGMETLKDTPAPRLLKTHLPLALLPQTLLDQKVKVVYVARNAKDVAVSYYHFYHMAKVHPEPGTWDSFLEKFMVGEVSYGSWYQHVQEWWELSRTHPVLYLFYEDMKENPKREIQKILEFVGRSLPEETVDFVVQHTSFKEMKKNPMTNYTTVPQEFMDHSISPFMRKGMAGDWKTTFTVAQNERFDADYAEKMAGCSLSFRSEL,brenda,P50225,N#Cc1cc2ccc(O)cc2oc1=O,0.02,22.0,7.5,2.8.2.1,9606.0,-1.6989700043360187,-1.6989700043360187,N#Cc1cc2ccc(O)cc2oc1=O__MELIQDTSRPPLEYVKGVPLIKYFAEALGPLQSFQARPDDLLISTYPKSGTTWVSQILDMIYQGGDLEKCHRAPIFMRVPFLEFKAPGIPSGMETLKDTPAPRLLKTHLPLALLPQTLLDQKVKVVYVARNAKDVAVSYYHFYHMAKVHPEPGTWDSFLEKFMVGEVSYGSWYQHVQEWWELSRTHPVLYLFYEDMKENPKREIQKILEFVGRSLPEETVDFVVQHTSFKEMKKNPMTNYTTVPQEFMDHSISPFMRKGMAGDWKTTFTVAQNERFDADYAEKMAGCSLSFRSEL,./data/raw/alphafold//AF-P50225-F1-model_v4.pdb,4829,3217,3965,4621 +111,33017,33607,MSPQTETKASVGFKAGVKDYKLTYYTPDYQTKDTDILAAFRVTPQPGVPPEEAGAAVAAESSTGTWTTVWTDGLTSLDRYKGRCYGLEPVPGEENQYIAYVAYPLDLFEEGSVTNMFTSIVGNVFGFKALRALRLEDLRVPPAYSKTFQGPPHGIQVERDKLNKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENVNSQPFMRWRDRFLFCAEAIYKAQAETGEIKGHYLNATAGTCEEMIKRAVCARELGVPIVMHDYLTGGFTANTSLAHYCRDNGLLLHIHRAMHAVIDRQKNHGMHFRVLAKALRLSGGDHIHAGTVVGKLEGERDITLGFVDLLRDDFIEKDRSRGIYFTQDWVSLPGVLPVASGGIHVWHMPALTEIFGDDSVLQFGGGTLGHPWGNAPGAVANRVALEACVQARNEGRDLAREGNDIIREASKWSPELAAACEVWK,brenda,A0A1C3HPQ9,O=C=O,0.0232,37.0,6.125,4.1.1.39,3983.0,-1.6345120151091004,-1.810837395201964,O=C=O__MSPQTETKASVGFKAGVKDYKLTYYTPDYQTKDTDILAAFRVTPQPGVPPEEAGAAVAAESSTGTWTTVWTDGLTSLDRYKGRCYGLEPVPGEENQYIAYVAYPLDLFEEGSVTNMFTSIVGNVFGFKALRALRLEDLRVPPAYSKTFQGPPHGIQVERDKLNKYGRPLLGCTIKPKLGLSAKNYGRAVYECLRGGLDFTKDDENVNSQPFMRWRDRFLFCAEAIYKAQAETGEIKGHYLNATAGTCEEMIKRAVCARELGVPIVMHDYLTGGFTANTSLAHYCRDNGLLLHIHRAMHAVIDRQKNHGMHFRVLAKALRLSGGDHIHAGTVVGKLEGERDITLGFVDLLRDDFIEKDRSRGIYFTQDWVSLPGVLPVASGGIHVWHMPALTEIFGDDSVLQFGGGTLGHPWGNAPGAVANRVALEACVQARNEGRDLAREGNDIIREASKWSPELAAACEVWK,./data/raw/alphafold//AF-A0A1C3HPQ9-F1-model_v4.pdb,2060,7070,8940,10005 +112,15205,15419,MANLPPRKVTSASKSKQDVSPLQILLQMGFRRQRALKALAATGNRSVQLASDWLLTHVSDSNIDADDPREYIFYASPTGPLLSQLLEFWDKSKSTCGWNGAHNFLPHITLVSFFKAPDDTSLNLAKAVRQVVENVGDPPKCTLKLEPYVSHNFMGLFISEEHAEYLKKIAVQYVKQVSSVSSINLEAHVKSLHITLAYHFEESSYEDLKTLVEEMQPVEHSSWELRLYSRDPRFANHQVYKVTQGYSPQASDELELVLGDYIYIEEKEFDISPDGWVHGTSWLTGLNGYLPAVYTRRTAETDAWTLLKAVSLGNNCSDCKSESGSNTDSEMAGTYPHEDAADLAYKKSEETYQEWDKYWSEVMNSRSDSILTITQGLPMNWELSKAAEEMKNNITNGTSKSRRWVFALRHGERVDLTYGPWVPHCFENDTYVRKDLNLPLKLAHRAGGKGGYVKDTPLTRLGWFQAQLVGEGMRMAGVSIKHVYASPALRCVETAQGFLDGLRADPSVKIKVEPGLFEFKNWHMPKGIDFMTPIELCKAGLNVDMTYKPYVEMDASAETMDEFFKRGEVAMQAAVNDTEKDGGNVIFIGHAITLDQMVGALHRLRDDMEDVQPYEIGRNLLKVPYCALGAMRGKPWDVVSPPCPPSINSSSGRFDWRILIK,sabio,Q7YTB0,C[C@@H]([C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)[C@@H](CCC(C)(C)O)OP(=O)(O)O,0.01493,37.0,7.5,3.1.3.-,7091.0,-1.8259401922749745,-1.8259401922749745,C[C@@H]([C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)[C@@H](CCC(C)(C)O)OP(=O)(O)O__MANLPPRKVTSASKSKQDVSPLQILLQMGFRRQRALKALAATGNRSVQLASDWLLTHVSDSNIDADDPREYIFYASPTGPLLSQLLEFWDKSKSTCGWNGAHNFLPHITLVSFFKAPDDTSLNLAKAVRQVVENVGDPPKCTLKLEPYVSHNFMGLFISEEHAEYLKKIAVQYVKQVSSVSSINLEAHVKSLHITLAYHFEESSYEDLKTLVEEMQPVEHSSWELRLYSRDPRFANHQVYKVTQGYSPQASDELELVLGDYIYIEEKEFDISPDGWVHGTSWLTGLNGYLPAVYTRRTAETDAWTLLKAVSLGNNCSDCKSESGSNTDSEMAGTYPHEDAADLAYKKSEETYQEWDKYWSEVMNSRSDSILTITQGLPMNWELSKAAEEMKNNITNGTSKSRRWVFALRHGERVDLTYGPWVPHCFENDTYVRKDLNLPLKLAHRAGGKGGYVKDTPLTRLGWFQAQLVGEGMRMAGVSIKHVYASPALRCVETAQGFLDGLRADPSVKIKVEPGLFEFKNWHMPKGIDFMTPIELCKAGLNVDMTYKPYVEMDASAETMDEFFKRGEVAMQAAVNDTEKDGGNVIFIGHAITLDQMVGALHRLRDDMEDVQPYEIGRNLLKVPYCALGAMRGKPWDVVSPPCPPSINSSSGRFDWRILIK,./data/raw/alphafold//AF-Q7YTB0-F1-model_v4.pdb,4912,1656,2505,2488 +113,27679,28158,MEPPAAPSERSLSLSLPGPREGQATLKPPPQHLWRQPRTPIRIQQRGYSDSAERSEPERSPHRPIERADAVDTGDRPGLRTTRMSWPSSFHGTGTGGGSSRRLEAENGPTPSPGRSPLDSQASPGLMLHAGAATSQRRESFLYRSDSDYDMSPKTMSRNSSVASEAHGEDLIVTPFAQVLASLRNVRSNFSLLTNVPIPSNKRSPLGGPPSVCKATLSEETCQQLARETLEELDWCLEQLETMQTYRSVSEMASHKFKRMLNRELTHLSEMSRSGNQVSEYISNTFLDKQHEVEIPSPTPRQRPFQQPPPAAVQQAQPMSQITGLKKLVHTGSLNINVPRFGVKTDQEDLLAQELENLSKWGLNIFCVSEYAGGRSLSCIMYTIFQERDLLKKFHIPVDTMMTYMLTLEDHYHADVAYHNSLHAADVLQSTHVLLATPALDAVFTDLEILAALFAAAIHDVDHPGVSNQFLINTNSELALMYNDESVLENHHLAVGFKLLQEENCDIFQNLSKRQRQSLRKMVIDMVLATDMSKHMTLLADLKTMVETKKVTSSGVLLLDNYSDRIQVLRNMVHCADLSNPTKPLELYRQWTDRIMAEFFQQGDRERERGMEISPMCDKHTASVEKSQVGFIDYIVHPLWETWADLVHPDAQDILDTLEDNRDWYHSAIRQSPSPTLEEEPGVLSDPALPDKFQFELTLEEEDEEDSLEVPGLPCTEETLLAPHDTRAQAMEQSKVKGQSPAVVEVAESLKQETASAHGAPEESAEAVGHSFSLETSILPDLRTLSPSEEAQGLLGLPSMAAEVEAPRDHLAAMRACSACSGTSGDNSAVISAPGRWGSGGDPA,brenda,O89084,Nc1ncnc2c1ncn2[C@@H]1O[C@@H]2COP(=O)(O)O[C@H]2[C@H]1O,0.0092,30.0,8.0,3.1.4.53,10090.0,-2.036212172654445,-2.036212172654445,Nc1ncnc2c1ncn2[C@@H]1O[C@@H]2COP(=O)(O)O[C@H]2[C@H]1O__MEPPAAPSERSLSLSLPGPREGQATLKPPPQHLWRQPRTPIRIQQRGYSDSAERSEPERSPHRPIERADAVDTGDRPGLRTTRMSWPSSFHGTGTGGGSSRRLEAENGPTPSPGRSPLDSQASPGLMLHAGAATSQRRESFLYRSDSDYDMSPKTMSRNSSVASEAHGEDLIVTPFAQVLASLRNVRSNFSLLTNVPIPSNKRSPLGGPPSVCKATLSEETCQQLARETLEELDWCLEQLETMQTYRSVSEMASHKFKRMLNRELTHLSEMSRSGNQVSEYISNTFLDKQHEVEIPSPTPRQRPFQQPPPAAVQQAQPMSQITGLKKLVHTGSLNINVPRFGVKTDQEDLLAQELENLSKWGLNIFCVSEYAGGRSLSCIMYTIFQERDLLKKFHIPVDTMMTYMLTLEDHYHADVAYHNSLHAADVLQSTHVLLATPALDAVFTDLEILAALFAAAIHDVDHPGVSNQFLINTNSELALMYNDESVLENHHLAVGFKLLQEENCDIFQNLSKRQRQSLRKMVIDMVLATDMSKHMTLLADLKTMVETKKVTSSGVLLLDNYSDRIQVLRNMVHCADLSNPTKPLELYRQWTDRIMAEFFQQGDRERERGMEISPMCDKHTASVEKSQVGFIDYIVHPLWETWADLVHPDAQDILDTLEDNRDWYHSAIRQSPSPTLEEEPGVLSDPALPDKFQFELTLEEEDEEDSLEVPGLPCTEETLLAPHDTRAQAMEQSKVKGQSPAVVEVAESLKQETASAHGAPEESAEAVGHSFSLETSILPDLRTLSPSEEAQGLLGLPSMAAEVEAPRDHLAAMRACSACSGTSGDNSAVISAPGRWGSGGDPA,./data/raw/alphafold//AF-O89084-F1-model_v4.pdb,1408,6663,6192,11916 +114,6103,6192,MSNRKKVAYFHDPDIGSYYYGAGHPMKPQRIRMTHSLIVSYNLYKYMEVYRPHKSDVNELTLFHDYEYIDFLSSISLENYREFTYQLKRFNVGEATDCPVFDGLFQFQQSCAGASIDGASKLNHHCADICVNWSGGLHHAKMSEASGFCYINDIVLGILELLKYHARVMYIDIDVHHGDGVEEAFYVTHRVMTVSFHKFGDYFPGTGDITDVGVNHGKYYSVNVPLNDGMTDDAFVDLFKVVIDKCVQTYRPGAIIIQCGADSLTGDRLGRFNLTIKGHARCVEHVRSYNIPLLVLGGGGYTIRNVSRCWAYETGVVLNKHHEMPDQISLNDYYDYYAPDFQLHLQPSNIPNYNSPEHLSRIKMKIAENLRHIEHAPGVQFSYVPPDFFNSDIDDESDKNQYELKDDSGGGRAPGTRAKEHSTTHHLRRKNYDDDFFDLSDRDQSIVPY,brenda,Q7K6A1,CC(O)=NCCCC[C@H](N=C(O)CN=C(O)[C@H](CC(C)C)N=C(C)O)C(O)=Nc1ccc2c(C)cc(=O)oc2c1,0.03,37.0,7.4,3.5.1.98,5833.0,-1.5228787452803376,-1.5228787452803376,CC(O)=NCCCC[C@H](N=C(O)CN=C(O)[C@H](CC(C)C)N=C(C)O)C(O)=Nc1ccc2c(C)cc(=O)oc2c1__MSNRKKVAYFHDPDIGSYYYGAGHPMKPQRIRMTHSLIVSYNLYKYMEVYRPHKSDVNELTLFHDYEYIDFLSSISLENYREFTYQLKRFNVGEATDCPVFDGLFQFQQSCAGASIDGASKLNHHCADICVNWSGGLHHAKMSEASGFCYINDIVLGILELLKYHARVMYIDIDVHHGDGVEEAFYVTHRVMTVSFHKFGDYFPGTGDITDVGVNHGKYYSVNVPLNDGMTDDAFVDLFKVVIDKCVQTYRPGAIIIQCGADSLTGDRLGRFNLTIKGHARCVEHVRSYNIPLLVLGGGGYTIRNVSRCWAYETGVVLNKHHEMPDQISLNDYYDYYAPDFQLHLQPSNIPNYNSPEHLSRIKMKIAENLRHIEHAPGVQFSYVPPDFFNSDIDDESDKNQYELKDDSGGGRAPGTRAKEHSTTHHLRRKNYDDDFFDLSDRDQSIVPY,./data/raw/alphafold//AF-Q7K6A1-F1-model_v4.pdb,5611,2385,3008,3476 +115,38927,39618,MNVDQLKSYREEIRQHLTSELLPFWENRAVDRENGGFITHFDNAGNDSGEDEKSLIAQTRTVYTFSSAHRAGYGEGRYADIARHGVDFLINKMWDNEYGGFYWLMDRKGNVNIDEKIVYGHSFAIYSLAEYTLATGDPRGLEYAEKVFDLLQKHGADTYYGGYFEMFHRNWDLKGPGAAGGDRKTLDAHMHLMEAFTTLYEASGKQVHRRKLVEIIRLLINKIMHPQYRTGIPQFWEDWSVAPQIKFDIIWGWDRFTEDGVKSSAEDNTSYGHNVEFAWLLMHALDIAGIPYDEYHDQLKASYDHAVEYGIDWEFGGVYVEGSHAGEVYDREKEFWQQAEVIIGMLDAYRVYGDEKYLKAYDATHRFVFDKMIHHSVGEWLPLLTRQGEPIWKHMSHSWKVNYHSVRSMVQGIVRLNKLIGNK,brenda,C6VWU2,OC[C@H]1O[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1O,73.5,50.0,8.0,5.1.3.44,106.0,1.866287339084195,1.8442277092261063,OC[C@H]1O[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1O__MNVDQLKSYREEIRQHLTSELLPFWENRAVDRENGGFITHFDNAGNDSGEDEKSLIAQTRTVYTFSSAHRAGYGEGRYADIARHGVDFLINKMWDNEYGGFYWLMDRKGNVNIDEKIVYGHSFAIYSLAEYTLATGDPRGLEYAEKVFDLLQKHGADTYYGGYFEMFHRNWDLKGPGAAGGDRKTLDAHMHLMEAFTTLYEASGKQVHRRKLVEIIRLLINKIMHPQYRTGIPQFWEDWSVAPQIKFDIIWGWDRFTEDGVKSSAEDNTSYGHNVEFAWLLMHALDIAGIPYDEYHDQLKASYDHAVEYGIDWEFGGVYVEGSHAGEVYDREKEFWQQAEVIIGMLDAYRVYGDEKYLKAYDATHRFVFDKMIHHSVGEWLPLLTRQGEPIWKHMSHSWKVNYHSVRSMVQGIVRLNKLIGNK,./data/raw/alphafold//AF-C6VWU2-F1-model_v4.pdb,2657,8361,10298,11519 +116,32977,33565,MAKVLCVLYDDPVDGYPKTYARDDLPKIDHYPGGQTLPTPKAIDFTPGQLLGSVSGELGLRKYLESNGHTLVVTSDKDGPDSVFERELVDADVVISQPFWPAYLTPERIAKAKNLKLALTAGIGSDHVDLQSAIDRNVTVAEVTYCNSISVAEHVVMMILSLVRNYLPSHEWARKGGWNIADCVSHAYDLEAMHVGTVAAGRIGLAVLRRLAPFDVHLHYTDRHRLPESVEKELNLTWHATREDMYPVCDVVTLNCPLHPETEHMINDETLKLFKRGAYIVNTARGKLCDRDAVARALESGRLAGYAGDVWFPQPAPKDHPWRTMPYNGMTPHISGTTLTAQARYAAGTREILECFFEGRPIRDEYLIVQGGALAGTGAHSYSKGNATGGSEEAAKFKKAV,brenda,P33160,O=C=O,6.5,25.0,7.0,1.17.1.9,33067.0,0.8129133566428556,0.8129133566428556,O=C=O__MAKVLCVLYDDPVDGYPKTYARDDLPKIDHYPGGQTLPTPKAIDFTPGQLLGSVSGELGLRKYLESNGHTLVVTSDKDGPDSVFERELVDADVVISQPFWPAYLTPERIAKAKNLKLALTAGIGSDHVDLQSAIDRNVTVAEVTYCNSISVAEHVVMMILSLVRNYLPSHEWARKGGWNIADCVSHAYDLEAMHVGTVAAGRIGLAVLRRLAPFDVHLHYTDRHRLPESVEKELNLTWHATREDMYPVCDVVTLNCPLHPETEHMINDETLKLFKRGAYIVNTARGKLCDRDAVARALESGRLAGYAGDVWFPQPAPKDHPWRTMPYNGMTPHISGTTLTAQARYAAGTREILECFFEGRPIRDEYLIVQGGALAGTGAHSYSKGNATGGSEEAAKFKKAV,./data/raw/alphafold//AF-P33160-F1-model_v4.pdb,4298,5183,7100,7122 +117,10074,10228,MTGTALAQPRAITPHEQQLLAKLKSYRDIQSLSQIWGRAASQFGSMPALVAPHAKPAITLSYQELAIQIQAFAAGLLALGVPTSTADDFPPRLAQFADNSPRWLIADQGTLLAGAANAVRGAQAEVSELLYVLEDSGSIGLIVEDAALLKKLQPGLASLSLQFVIVLSDEVVEIDSLRVVGFSDVLEMGRSLPAPEPILQLDRLATLIYTSGTTGPPKGVMLSHGNLLHQVTTLGVVVQPQPGDTVLSILPTWHSYERACEYFLLSQGCTQVYTTLRNVKQDIRQYRPQFMVSVLRLWESIYEGVQKQFREQPAKKRRLIDTFFGLSQRYVLARRRWQGLDLLALNQSPAQRLAEGVRMLALAPLHKLGDRLVYGKVREATGGRIRQVISGGGSLALHLDTFFEIVGVDLLVGYGLTETSPVLTGRRPWHNLRGSAGQPIPGTAIRIVDPETKENRPSGDRGLVLAKGPQIMQGYFNKPEATAKAIDAEGWFDTGDLGYIVGEGNLVLTGRAKDTIVLTNGENIEPQPIEDACLRSSYISQIMLVGQDRKSLGALIVPNQEAIALWASEQGISQTDLQGVVQKLIREELNREVRDRPGYRIDDRIGPFRLIEEPFSMENGQLTQTLKIRRNVVAEHYAAMIDGMFESAS,brenda,Q31PS1,CCCCCCCC/C=C\CCCCCCCC(=O)O,0.01,37.0,8.0,6.2.1.20,32046.0,-2.0,-2.0,CCCCCCCC/C=C\CCCCCCCC(=O)O__MTGTALAQPRAITPHEQQLLAKLKSYRDIQSLSQIWGRAASQFGSMPALVAPHAKPAITLSYQELAIQIQAFAAGLLALGVPTSTADDFPPRLAQFADNSPRWLIADQGTLLAGAANAVRGAQAEVSELLYVLEDSGSIGLIVEDAALLKKLQPGLASLSLQFVIVLSDEVVEIDSLRVVGFSDVLEMGRSLPAPEPILQLDRLATLIYTSGTTGPPKGVMLSHGNLLHQVTTLGVVVQPQPGDTVLSILPTWHSYERACEYFLLSQGCTQVYTTLRNVKQDIRQYRPQFMVSVLRLWESIYEGVQKQFREQPAKKRRLIDTFFGLSQRYVLARRRWQGLDLLALNQSPAQRLAEGVRMLALAPLHKLGDRLVYGKVREATGGRIRQVISGGGSLALHLDTFFEIVGVDLLVGYGLTETSPVLTGRRPWHNLRGSAGQPIPGTAIRIVDPETKENRPSGDRGLVLAKGPQIMQGYFNKPEATAKAIDAEGWFDTGDLGYIVGEGNLVLTGRAKDTIVLTNGENIEPQPIEDACLRSSYISQIMLVGQDRKSLGALIVPNQEAIALWASEQGISQTDLQGVVQKLIREELNREVRDRPGYRIDDRIGPFRLIEEPFSMENGQLTQTLKIRRNVVAEHYAAMIDGMFESAS,./data/raw/alphafold//AF-Q31PS1-F1-model_v4.pdb,5508,3044,3770,4382 +118,14141,14346,MESNGVPMITLSSGIRMPALGMGTAETMVKGTEREKLAFLKAIEVGYRHFDTAAAYQSEECLGEAIAEALQLGLIKSRDELFITSKLWCADAHADLVLPALQNSLRNLKLDYLDLYLIHHPVSLKPGKFVNEIPKDHILPMDYKSVWAAMEECQTLGFTRAIGVCNFSCKKLQELMAAAKIPPVVNQVEMSPTLHQKNLREYCKANNIMITAHSVLGAICAPWGSNAVMDSKVLHQIAVARGKSVAQVSMRWVYQQGASLVVKSFNEGRMKENLKIFDWELTAENMEKISEIPQSRTSSADFLLSPTGPFKTEEEFWDEKD,brenda,Q9SQ68,COc1ccc2c3c1O[C@H]1C(=O)C=C[C@H]4[C@@H](C2)N(C)CC[C@]314,0.0183,30.0,6.8,1.1.1.247,3469.0,-1.7375489102695705,-1.7375489102695705,COc1ccc2c3c1O[C@H]1C(=O)C=C[C@H]4[C@@H](C2)N(C)CC[C@]314__MESNGVPMITLSSGIRMPALGMGTAETMVKGTEREKLAFLKAIEVGYRHFDTAAAYQSEECLGEAIAEALQLGLIKSRDELFITSKLWCADAHADLVLPALQNSLRNLKLDYLDLYLIHHPVSLKPGKFVNEIPKDHILPMDYKSVWAAMEECQTLGFTRAIGVCNFSCKKLQELMAAAKIPPVVNQVEMSPTLHQKNLREYCKANNIMITAHSVLGAICAPWGSNAVMDSKVLHQIAVARGKSVAQVSMRWVYQQGASLVVKSFNEGRMKENLKIFDWELTAENMEKISEIPQSRTSSADFLLSPTGPFKTEEEFWDEKD,./data/raw/alphafold//AF-Q9SQ68-F1-model_v4.pdb,400,3612,4936,5244 +119,9485,9634,MAKRLLRGTLRLWGGRAAPCLPPASRCSHSGGEERLETSSAKKLTDIGTRRIFSLEHDIFRESVRKFFQEEVIPYHAEWEKAGEVSRELWEKAGKQGLLGISIADHHGGIGGDLYSSAIVWEEQAYSNCTGPGFGLHSDIVMPYITNYGSEEQIKRFIPEMVAGKCIGAIAMTEPGAGSDLQGIRTNAKKDGSDWILNGSKVFVTNGWLCDIVIIVAITNREAHSPAHGISLFLVENGMKGFIKGRKLDKIGLKAQDTAEFFFEDVRLPAGALLGEENKGYYYLMQELPQERLLISEIAVSASEFMFEETRDYVKQRKAFGKTVADLQTVKHKLAELKTSICVTRAFVDSCLQLHRVKRLDVATAAMAKYWASDLQNRVAYDCLQLHGGWGYMFECPIAKAYVDARVQTIYGGTNEIMKELIAREIIHDQ,uniprot_search,Q08D92,CCCCC/C=C\CCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.25,34.0,7.5,1.3.8.8,9913.0,-0.6020599913279624,-0.6020599913279624,CCCCC/C=C\CCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MAKRLLRGTLRLWGGRAAPCLPPASRCSHSGGEERLETSSAKKLTDIGTRRIFSLEHDIFRESVRKFFQEEVIPYHAEWEKAGEVSRELWEKAGKQGLLGISIADHHGGIGGDLYSSAIVWEEQAYSNCTGPGFGLHSDIVMPYITNYGSEEQIKRFIPEMVAGKCIGAIAMTEPGAGSDLQGIRTNAKKDGSDWILNGSKVFVTNGWLCDIVIIVAITNREAHSPAHGISLFLVENGMKGFIKGRKLDKIGLKAQDTAEFFFEDVRLPAGALLGEENKGYYYLMQELPQERLLISEIAVSASEFMFEETRDYVKQRKAFGKTVADLQTVKHKLAELKTSICVTRAFVDSCLQLHRVKRLDVATAAMAKYWASDLQNRVAYDCLQLHGGWGYMFECPIAKAYVDARVQTIYGGTNEIMKELIAREIIHDQ,./data/raw/alphafold//AF-Q08D92-F1-model_v4.pdb,5503,3038,3764,414 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+130,2041,2079,MAACEGRRSGALGSSQSDFLTPPVGGAPWAVATTVVMYPPPPPPPHRDFISVTLSFGENYDNSKSWRRRSCWRKWKQLSRLQRNMILFLLAFLLFCGLLFYINLADHWKALAFRLEEEQKMRPEIAGLKPANPPVLPAPQKADTDPENLPEISSQKTQRHIQRGPPHLQIRPPSQDLKDGTQEEATKRQEAPVDPRPEGDPQRTVISWRGAVIEPEQGTELPSRRAEVPTKPPLPPARTQGTPVHLNYRQKGVIDVFLHAWKGYRKFAWGHDELKPVSRSFSEWFGLGLTLIDALDTMWILGLRKEFEEARKWVSKKLHFEKDVDVNLFESTIRILGGLLSAYHLSGDSLFLRKAEDFGNRLMPAFRTPSKIPYSDVNIGTGVAHPPRWTSDSTVAEVTSIQLEFRELSRLTGDKKFQEAVEKVTQHIHGLSGKKDGLVPMFINTHSGLFTHLGVFTLGARADSYYEYLLKQWIQGGKQETQLLEDYVEAIEGVRTHLLRHSEPSKLTFVGELAHGRFSAKMDHLVCFLPGTLALGVYHGLPASHMELAQELMETCYQMNRQMETGLSPEIVHFNLYPQPGRRDVEVKPADRHNLLRPETVESLFYLYRVTGDRKYQDWGWEILQSFSRFTRVPSGGYSSINNVQDPQKPEPRDKMESFFLGETLKYLFLLFSDDPNLLSLDAYVFNTEAHPLPIWTPA,sabio,Q9UKM7,CC(=O)N[C@@H](C=O)[C@@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)[C@@H](CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O,0.4,37.0,6.5,3.2.1.113,9606.0,-0.3979400086720376,-0.3979400086720376,CC(=O)N[C@@H](C=O)[C@@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)[C@@H](CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O__MAACEGRRSGALGSSQSDFLTPPVGGAPWAVATTVVMYPPPPPPPHRDFISVTLSFGENYDNSKSWRRRSCWRKWKQLSRLQRNMILFLLAFLLFCGLLFYINLADHWKALAFRLEEEQKMRPEIAGLKPANPPVLPAPQKADTDPENLPEISSQKTQRHIQRGPPHLQIRPPSQDLKDGTQEEATKRQEAPVDPRPEGDPQRTVISWRGAVIEPEQGTELPSRRAEVPTKPPLPPARTQGTPVHLNYRQKGVIDVFLHAWKGYRKFAWGHDELKPVSRSFSEWFGLGLTLIDALDTMWILGLRKEFEEARKWVSKKLHFEKDVDVNLFESTIRILGGLLSAYHLSGDSLFLRKAEDFGNRLMPAFRTPSKIPYSDVNIGTGVAHPPRWTSDSTVAEVTSIQLEFRELSRLTGDKKFQEAVEKVTQHIHGLSGKKDGLVPMFINTHSGLFTHLGVFTLGARADSYYEYLLKQWIQGGKQETQLLEDYVEAIEGVRTHLLRHSEPSKLTFVGELAHGRFSAKMDHLVCFLPGTLALGVYHGLPASHMELAQELMETCYQMNRQMETGLSPEIVHFNLYPQPGRRDVEVKPADRHNLLRPETVESLFYLYRVTGDRKYQDWGWEILQSFSRFTRVPSGGYSSINNVQDPQKPEPRDKMESFFLGETLKYLFLLFSDDPNLLSLDAYVFNTEAHPLPIWTPA,./data/raw/alphafold//AF-Q9UKM7-F1-model_v4.pdb,5676,2465,1232,1514 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+169,13520,13715,MEAVNDQAQEFIFRSKLPDIHIPNHLPLHTYCFENLSRFKDNPCLINGPTGEIHTYAEVELTSRKVASGLSKLGIKQGDVILLLLQNSPEFVFAFLGASIIGAISTTANPFYTPAEVAKQATASKAKLIITQAVYAEKVQQFVKENDHVKIVTVDSPPENYLHFSELTNSDEDDIPAVEINPDDVVALPYSSGTTGLPKGVMLTHKGLVTSVAQQVDGENPNLYFHEKDVILCVLPLFHIYSLNSVLLCGLRVGSAILLMQKFEIVTLMELVQKYKVTIAPFVPPVVLAVAKCPVVDKYDLSSIRTVMSGAAPMGKELEDTVRAKLPNAKLGQGYGMTEAGPVLSMCLAFAREPFEIKSGACGTVVRNAEMKIVDPDTGRSLPRNQAGEICIRGSQIMKGYLNDPEATERTIDNDGWLHTGDIGYIDDDDELFIVDRLKELIKYKGFQVAPAELEAMLIAHPDISDCAVVPMKDEAAGEVPVAFVVRANGSKITEDEIKQYISKQVVFYKRISRVFFTESIPKAPSGKILRKDLRARLATGDLPH,brenda,H9AZ24,COc1cc(/C=C/C(=O)O)ccc1O,0.03516,37.0,6.0,6.2.1.12,118781.0,-1.4539511335982658,-1.4539511335982658,COc1cc(/C=C/C(=O)O)ccc1O__MEAVNDQAQEFIFRSKLPDIHIPNHLPLHTYCFENLSRFKDNPCLINGPTGEIHTYAEVELTSRKVASGLSKLGIKQGDVILLLLQNSPEFVFAFLGASIIGAISTTANPFYTPAEVAKQATASKAKLIITQAVYAEKVQQFVKENDHVKIVTVDSPPENYLHFSELTNSDEDDIPAVEINPDDVVALPYSSGTTGLPKGVMLTHKGLVTSVAQQVDGENPNLYFHEKDVILCVLPLFHIYSLNSVLLCGLRVGSAILLMQKFEIVTLMELVQKYKVTIAPFVPPVVLAVAKCPVVDKYDLSSIRTVMSGAAPMGKELEDTVRAKLPNAKLGQGYGMTEAGPVLSMCLAFAREPFEIKSGACGTVVRNAEMKIVDPDTGRSLPRNQAGEICIRGSQIMKGYLNDPEATERTIDNDGWLHTGDIGYIDDDDELFIVDRLKELIKYKGFQVAPAELEAMLIAHPDISDCAVVPMKDEAAGEVPVAFVVRANGSKITEDEIKQYISKQVVFYKRISRVFFTESIPKAPSGKILRKDLRARLATGDLPH,./data/raw/alphafold//AF-H9AZ24-F1-model_v4.pdb,151,3518,4793,5062 +170,253,265,MSNCLQNFLKITSTRLLCSRLCQQLRSKRKFFGTVPISRLHRRVVITGIGLVTPLGVGTHLVWDRLIGGESGIVSLVGEEYKSIPCSVAAYVPRGSDEGQFNEQNFVSKSDIKSMSSPTIMAIGAAELAMKDSGWHPQSEADQVATGVAIGMGMIPLEVVSETALNFQTKGYNKVSPFFVPKILVNMAAGQVSIRYKLKGPNHAVSTACTTGAHAVGDSFRFIAHGDADVMVAGGTDSCISPLSLAGFSRARALSTNSDPKLACRPFHPKRDGFVMGEGAAVLVLEEYEHAVQRRARIYAEVLGYGLSGDAGHITAPDPEGEGALRCMAAALKDAGVQPEEISYINAHATSTPLGDAAENKAIKHLFKDHAYALAVSSTKGATGHLLGAAGAVEAAFTTLACYYQKLPPTLNLDCSEPEFDLNYVPLKAQEWKTEKRFIGLTNSFGFGGTNATLCIAGL,sabio,Q9NWU1,*SC(=O)CCC,0.0039,37.0,6.8,2.3.1.41,9606.0,-2.408935392973501,-2.408935392973501,*SC(=O)CCC__MSNCLQNFLKITSTRLLCSRLCQQLRSKRKFFGTVPISRLHRRVVITGIGLVTPLGVGTHLVWDRLIGGESGIVSLVGEEYKSIPCSVAAYVPRGSDEGQFNEQNFVSKSDIKSMSSPTIMAIGAAELAMKDSGWHPQSEADQVATGVAIGMGMIPLEVVSETALNFQTKGYNKVSPFFVPKILVNMAAGQVSIRYKLKGPNHAVSTACTTGAHAVGDSFRFIAHGDADVMVAGGTDSCISPLSLAGFSRARALSTNSDPKLACRPFHPKRDGFVMGEGAAVLVLEEYEHAVQRRARIYAEVLGYGLSGDAGHITAPDPEGEGALRCMAAALKDAGVQPEEISYINAHATSTPLGDAAENKAIKHLFKDHAYALAVSSTKGATGHLLGAAGAVEAAFTTLACYYQKLPPTLNLDCSEPEFDLNYVPLKAQEWKTEKRFIGLTNSFGFGGTNATLCIAGL,./data/raw/alphafold//AF-Q9NWU1-F1-model_v4.pdb,3624,176,192,213 +171,148,154,MAKNIQAIRGMNDYLPGETAIWQRIEGTLKNVLGSYGYSEIRLPIVEQTPLFKRAIGEVTDVVEKEMYTFEDRNGDSLTLRPEGTAGCVRAGIEHGLLYNQEQRLWYIGPMFRHERPQKGRYRQFHQLGCEVFGLQGPDIDAELIMLTARWWRALGISEHVTLELNSIGSLEARANYRDALVAFLEQHKEKLDEDCKRRMYTNPLRVLDSKNPEVQALLNDAPALGDYLDEESREHFAGLCKLLESAGIAYTVNQRLVRGLDYYNRTVFEWVTNSLGSQGTVCAGGRYDGLVEQLGGRATPAVGFAMGLERLVLLVQAVNPEFKADPVVDIYLVASGADTQSAAMALAERLRDELPGVKLMTNHGGGNFKKQFARADKWGARVAVVLGESEVANGTAVVKDLRSGEQTAVAQDSVAAHLRTLLG,sabio,P60906,*C1OC(COP(=O)(O)OC2C(COP(=O)(O)OC3C(CO)OC(*)C3O)OC(*)C2O)C(O)C1O,0.013,37.0,7.5,6.1.1.21,562.0,-1.8860566476931635,-2.4890062581855474,*C1OC(COP(=O)(O)OC2C(COP(=O)(O)OC3C(CO)OC(*)C3O)OC(*)C2O)C(O)C1O__MAKNIQAIRGMNDYLPGETAIWQRIEGTLKNVLGSYGYSEIRLPIVEQTPLFKRAIGEVTDVVEKEMYTFEDRNGDSLTLRPEGTAGCVRAGIEHGLLYNQEQRLWYIGPMFRHERPQKGRYRQFHQLGCEVFGLQGPDIDAELIMLTARWWRALGISEHVTLELNSIGSLEARANYRDALVAFLEQHKEKLDEDCKRRMYTNPLRVLDSKNPEVQALLNDAPALGDYLDEESREHFAGLCKLLESAGIAYTVNQRLVRGLDYYNRTVFEWVTNSLGSQGTVCAGGRYDGLVEQLGGRATPAVGFAMGLERLVLLVQAVNPEFKADPVVDIYLVASGADTQSAAMALAERLRDELPGVKLMTNHGGGNFKKQFARADKWGARVAVVLGESEVANGTAVVKDLRSGEQTAVAQDSVAAHLRTLLG,./data/raw/alphafold//AF-P60906-F1-model_v4.pdb,2920,100,108,122 +172,18847,19120,MKLTKGCAYKYIIFTVLILANILYDNKKRCMIKKNLRISSCGIISRLLKSNSNYNSFNKNYNFTSAISELQFSNFWNLDILQKDIFSNIHNNKNKPQSYIIHKRLMSEKGDNNNNNHQNNNGNDNKKRLGSVVNNEENTCSDKRMKPFEEGHGITQVDKMNNNSDHLQQNGVMNLNSNNVENNNNNNSVVVKKNEPKIHYRKDYKPSGFIINNVTLNINIHDNETIVRSVLDMDISKHNVGEDLVFDGVGLKINEISINNKKLVEGEEYTYDNEFLTIFSKFVPKSKFAFSSEVIIHPETNYALTGLYKSKNIIVSQCEATGFRRITFFIDRPDMMAKYDVTVTADKEKYPVLLSNGDKVNEFEIPGGRHGARFNDPHLKPCYLFAVVAGDLKHLSATYITKYTKKKVELYVFSEEKYVSKLQWALECLKKSMAFDEDYFGLEYDLSRLNLVAVSDFNVGAMENKGLNIFNANSLLASKKNSIDFSYARILTVVGHEYFHNYTGNRVTLRDWFQLTLKEGLTVHRENLFSEEMTKTVTTRLSHVDLLRSVQFLEDSSPLSHPIRPESYVSMENFYTTTVYDKGSEVMRMYLTILGEEYYKKGFDIYIKKNDGNTATCEDFNYAMEQAYKMKKADNSANLNQYLLWFSQSGTPHVSFKYNYDAEKKQYSIHVNQYTKPDENQKEKKPLFIPISVGLINPENGKEMISQTTLELTKESDTFVFNNIAVKPIPSLFRGFSAPVYIEDNLTDEERILLLKYDSDAFVRYNSCTNIYMKQILMNYNEFLKAKNEKLESFNLTPVNAQFIDAIKYLLEDPHADAGFKSYIVSLPQDRYIINFVSNLDTDVLADTKEYIYKQIGDKLNDVYYKMFKSLEAKADDLTYFNDESHVDFDQMNMRTLRNTLLSLLSKAQYPNILNEIIEHSKSPYPSNWLTSLSVSAYFDKYFELYDKTYKLSKDDELLLQEWLKTVSRSDRKDIYEILKKLENEVLKDSKNPNDIRAVYLPFTNNLRRFHDISGKGYKLIAEVITKTDKFNPMVATQLCEPFKLWNKLDTKRQELMLNEMNTMLQEPNISNNLKEYLLRLTNKL,brenda,Q8IEK1,N=C(N)NCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1,0.27,37.0,7.2,3.4.11.20,5833.0,-0.5686362358410126,-0.5686362358410126,N=C(N)NCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1__MKLTKGCAYKYIIFTVLILANILYDNKKRCMIKKNLRISSCGIISRLLKSNSNYNSFNKNYNFTSAISELQFSNFWNLDILQKDIFSNIHNNKNKPQSYIIHKRLMSEKGDNNNNNHQNNNGNDNKKRLGSVVNNEENTCSDKRMKPFEEGHGITQVDKMNNNSDHLQQNGVMNLNSNNVENNNNNNSVVVKKNEPKIHYRKDYKPSGFIINNVTLNINIHDNETIVRSVLDMDISKHNVGEDLVFDGVGLKINEISINNKKLVEGEEYTYDNEFLTIFSKFVPKSKFAFSSEVIIHPETNYALTGLYKSKNIIVSQCEATGFRRITFFIDRPDMMAKYDVTVTADKEKYPVLLSNGDKVNEFEIPGGRHGARFNDPHLKPCYLFAVVAGDLKHLSATYITKYTKKKVELYVFSEEKYVSKLQWALECLKKSMAFDEDYFGLEYDLSRLNLVAVSDFNVGAMENKGLNIFNANSLLASKKNSIDFSYARILTVVGHEYFHNYTGNRVTLRDWFQLTLKEGLTVHRENLFSEEMTKTVTTRLSHVDLLRSVQFLEDSSPLSHPIRPESYVSMENFYTTTVYDKGSEVMRMYLTILGEEYYKKGFDIYIKKNDGNTATCEDFNYAMEQAYKMKKADNSANLNQYLLWFSQSGTPHVSFKYNYDAEKKQYSIHVNQYTKPDENQKEKKPLFIPISVGLINPENGKEMISQTTLELTKESDTFVFNNIAVKPIPSLFRGFSAPVYIEDNLTDEERILLLKYDSDAFVRYNSCTNIYMKQILMNYNEFLKAKNEKLESFNLTPVNAQFIDAIKYLLEDPHADAGFKSYIVSLPQDRYIINFVSNLDTDVLADTKEYIYKQIGDKLNDVYYKMFKSLEAKADDLTYFNDESHVDFDQMNMRTLRNTLLSLLSKAQYPNILNEIIEHSKSPYPSNWLTSLSVSAYFDKYFELYDKTYKLSKDDELLLQEWLKTVSRSDRKDIYEILKKLENEVLKDSKNPNDIRAVYLPFTNNLRRFHDISGKGYKLIAEVITKTDKFNPMVATQLCEPFKLWNKLDTKRQELMLNEMNTMLQEPNISNNLKEYLLRLTNKL,./data/raw/alphafold//AF-Q8IEK1-F1-model_v4.pdb,5153,2040,1291,3049 +173,24687,25076,MSVVSAVSFMRPLHMRSPGPRGRRHTLPASEFRSLSPEDAISVFEIEREAFISVSGECPLHLDEVRHFLTLCPELSLGWFEEGRLVAFIIGSLWDQERLTTDALTLHKPHGTTVHIHVLAVHRTFRQQGKGSILMWRYLQYLRCLPYIRRAVLMCEDFLVPFYQKSGFKVQGPSDITVGPLTFIEMLYPVRGHAFMRRNSGC,brenda,Q68SL7,NCCc1ccccc1,0.34,36.0,6.8,2.3.1.87,8175.0,-0.4685210829577448,-0.4685210829577448,NCCc1ccccc1__MSVVSAVSFMRPLHMRSPGPRGRRHTLPASEFRSLSPEDAISVFEIEREAFISVSGECPLHLDEVRHFLTLCPELSLGWFEEGRLVAFIIGSLWDQERLTTDALTLHKPHGTTVHIHVLAVHRTFRQQGKGSILMWRYLQYLRCLPYIRRAVLMCEDFLVPFYQKSGFKVQGPSDITVGPLTFIEMLYPVRGHAFMRRNSGC,./data/raw/alphafold//AF-Q68SL7-F1-model_v4.pdb,3696,1363,2113,2017 +174,33711,34310,MKISDGNWLIQPGLNLIHPLQVFEVEQQDNEMVVYAAPRDVRERTWQLDTPLFTLRFFSPQEGIVGVRIEHFQGALNNGPHYPLNILQDVKVTIENTERYAEFKSGNLSARVSKGEFWSLDFLRNGERITGSQVKNNGYVQDTNNQRNYMFERLDLGVGETVYGLGERFTALVRNGQTVETWNRDGGTSTEQAYKNIPFYMTNRGYGVLVNHPQCVSFEVGSEKVSKVQFSVESEYLEYFVIDGPTPKAVLDRYTRFTGRPALPPAWSFGLWLTTSFTTNYDEATVNSFIDGMAERNLPLHVFHFDCFWMKAFQWCDFEWDPLTFPDPEGMIRRLKAKGLKICVWINPYIGQKSPVFKELQEKGYLLKRPDGSLWQWDKWQPGLAIYDFTNPDACKWYADKLKGLVAMGVDCFKTDFGERIPTDVQWFDGSDPQKMHNHYAYIYNELVWNVLKDTVGEEEAVLFARSASVGAQKFPVHWGGDCYANYESMAESLRGGLSIGLSGFGFWSHDIGGFENTAPAHVYKRWCAFGLLSSHSRLHGSKSYRVPWAYDDESCDVVRFFTQLKCRMMPYLYREAARANARGTPMMRAMMMEFPDDPACDYLDRQYMLGDNVMVAPVFTEAGDVQFYLPEGRWTHLWHNDELDGSRWHKQQHGFLSLPVYVRDNTLLALGNNDQRPDYVWHEGTAFHLFNLQDGHEAVCEVPAADGSVIFTLKAARTGNTITVTGAGEAKNWTLCLRNVVKVNGLQDGSQAESEQGLVVKPQGNALTITL,brenda,P31434,O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO[C@H]1OC[C@@H](O)[C@H](O)[C@H]1O,0.55,37.0,7.0,3.2.1.177,562.0,-0.2596373105057561,-0.2596373105057561,O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO[C@H]1OC[C@@H](O)[C@H](O)[C@H]1O__MKISDGNWLIQPGLNLIHPLQVFEVEQQDNEMVVYAAPRDVRERTWQLDTPLFTLRFFSPQEGIVGVRIEHFQGALNNGPHYPLNILQDVKVTIENTERYAEFKSGNLSARVSKGEFWSLDFLRNGERITGSQVKNNGYVQDTNNQRNYMFERLDLGVGETVYGLGERFTALVRNGQTVETWNRDGGTSTEQAYKNIPFYMTNRGYGVLVNHPQCVSFEVGSEKVSKVQFSVESEYLEYFVIDGPTPKAVLDRYTRFTGRPALPPAWSFGLWLTTSFTTNYDEATVNSFIDGMAERNLPLHVFHFDCFWMKAFQWCDFEWDPLTFPDPEGMIRRLKAKGLKICVWINPYIGQKSPVFKELQEKGYLLKRPDGSLWQWDKWQPGLAIYDFTNPDACKWYADKLKGLVAMGVDCFKTDFGERIPTDVQWFDGSDPQKMHNHYAYIYNELVWNVLKDTVGEEEAVLFARSASVGAQKFPVHWGGDCYANYESMAESLRGGLSIGLSGFGFWSHDIGGFENTAPAHVYKRWCAFGLLSSHSRLHGSKSYRVPWAYDDESCDVVRFFTQLKCRMMPYLYREAARANARGTPMMRAMMMEFPDDPACDYLDRQYMLGDNVMVAPVFTEAGDVQFYLPEGRWTHLWHNDELDGSRWHKQQHGFLSLPVYVRDNTLLALGNNDQRPDYVWHEGTAFHLFNLQDGHEAVCEVPAADGSVIFTLKAARTGNTITVTGAGEAKNWTLCLRNVVKVNGLQDGSQAESEQGLVVKPQGNALTITL,./data/raw/alphafold//AF-P31434-F1-model_v4.pdb,2104,5614,4397,10109 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+236,38529,39210,MLSNARIIAAGCIAAGSLVAAGPCDIYSSGGTPCVAAHSTTRALFSAYTGPLYQVKRGSDGATTAISPLSSGVANAAAQDAFCAGTTCLITIIYDQSGRGNHLREAPPGGFSGPESNGYDNLASAIGAPVTLNGQKAYGVFVSPGTGYRNNAASGTAKGDAAEGMYAVLDGTHYNGACCFDYGNAETNSRDTGNGHMEAIYFGDSTVWGTGSGKGPWIMADLENGLFSGSSPGNNAGDPSISYRFVTAAIKGQPNQWAIRGGNAASGSLSTFYSGARPQVSGYNPMSKEGAIILGIGGDNSNGGQGTFYEGVMTSGYPSDATENSVQANIVAARYAVAPLTSGPALTVGSSISLRATTACCTTRYIAHSGSTVNTQVVSSSSATALKQQASWTVRAGLANNACFSFESQDTSGSYIRHSNFGLVLNANDGSKLFAEDATFCTQAGINGQGSSIRSWSYPTRYFRHYNNTLYIASNGGVHVFDATAAFNDDVSFVVSGGFA,uniprot_search,P48792,OC[C@@H]1O[C@@H](Oc2ccccc2)[C@H](O)[C@H]1O,0.28,25.0,3.0,3.2.1.55,97093.0,-0.5528419686577808,-0.5528419686577808,OC[C@@H]1O[C@@H](Oc2ccccc2)[C@H](O)[C@H]1O__MLSNARIIAAGCIAAGSLVAAGPCDIYSSGGTPCVAAHSTTRALFSAYTGPLYQVKRGSDGATTAISPLSSGVANAAAQDAFCAGTTCLITIIYDQSGRGNHLREAPPGGFSGPESNGYDNLASAIGAPVTLNGQKAYGVFVSPGTGYRNNAASGTAKGDAAEGMYAVLDGTHYNGACCFDYGNAETNSRDTGNGHMEAIYFGDSTVWGTGSGKGPWIMADLENGLFSGSSPGNNAGDPSISYRFVTAAIKGQPNQWAIRGGNAASGSLSTFYSGARPQVSGYNPMSKEGAIILGIGGDNSNGGQGTFYEGVMTSGYPSDATENSVQANIVAARYAVAPLTSGPALTVGSSISLRATTACCTTRYIAHSGSTVNTQVVSSSSATALKQQASWTVRAGLANNACFSFESQDTSGSYIRHSNFGLVLNANDGSKLFAEDATFCTQAGINGQGSSIRSWSYPTRYFRHYNNTLYIASNGGVHVFDATAAFNDDVSFVVSGGFA,./data/raw/alphafold//AF-P48792-F1-model_v4.pdb,2445,8043,6503,6432 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+239,20162,20469,MAGSEDKRVVGTLHLLLLQATVLSLTAGNLSLVSAAWTQEKNHHQPAHLNSSSLQQVAEGTSISEMWQNDLRPLLIERYPGSPGSYSARQHIMQRIQRLQAEWVVEVDTFLSRTPYGYRSFSNIISTLNPEAKRHLVLACHYDSKYFPRWDSRVFVGATDSAVPCAMMLELARALDKKLHSLKDVSGSKPDLSLRLIFFDGEEAFHHWSPQDSLYGSRHLAQKMASSPHPPGSRGTNQLDGMDLLVLLDLIGAANPTFPNFFPKTTRWFNRLQAIEKELYELGLLKDHSLERKYFQNFGYGNIIQDDHIPFLRKGVPVLHLIASPFPEVWHTMDDNEENLHASTIDNLNKIIQVFVLEYLHL,brenda,Q9CYK2,N=C(O)CC[C@H](N=C(O)[C@@H](N)CCC(=N)O)C(=O)O,0.15,30.0,8.0,2.3.2.5,10090.0,-0.8239087409443188,-0.8239087409443188,N=C(O)CC[C@H](N=C(O)[C@@H](N)CCC(=N)O)C(=O)O__MAGSEDKRVVGTLHLLLLQATVLSLTAGNLSLVSAAWTQEKNHHQPAHLNSSSLQQVAEGTSISEMWQNDLRPLLIERYPGSPGSYSARQHIMQRIQRLQAEWVVEVDTFLSRTPYGYRSFSNIISTLNPEAKRHLVLACHYDSKYFPRWDSRVFVGATDSAVPCAMMLELARALDKKLHSLKDVSGSKPDLSLRLIFFDGEEAFHHWSPQDSLYGSRHLAQKMASSPHPPGSRGTNQLDGMDLLVLLDLIGAANPTFPNFFPKTTRWFNRLQAIEKELYELGLLKDHSLERKYFQNFGYGNIIQDDHIPFLRKGVPVLHLIASPFPEVWHTMDDNEENLHASTIDNLNKIIQVFVLEYLHL,./data/raw/alphafold//AF-Q9CYK2-F1-model_v4.pdb,5172,5094,6999,4710 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+241,17878,18138,MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG,brenda,P14902,Cc1ccc2[nH]cc(CC(N)C(=O)O)c2c1,0.098,25.0,6.5,1.13.11.52,9606.0,-1.0087739243075051,-1.024355058821614,Cc1ccc2[nH]cc(CC(N)C(=O)O)c2c1__MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG,./data/raw/alphafold//AF-P14902-F1-model_v4.pdb,1117,6276,4917,5221 +242,405,420,MSGLLIAAPASGSGKTTVTLGLMRALKRRGVAIAPGKAGPDYIDPAFHAAATGEPCFNYDPWAMRPELLLANASHVASGGRTLIVEAMMGLHDGAADGSGTPADLAATLNLAVILVVDCARMSQSVAALVRGYADHRDDIRVVGVILNKVGSDRHEMMLRDALGKVRMPVFGVLRQDSALQLPERHLGLVQAGEHSALEGFIEAAAARVEAACDLDAIRLIATIFPQVPAAADAERLRPLGQRIAVARDIAFAFCYEHLLYGWRQGGAEISFFSPLADEGPDAAADAVYLPGGYPELHAGQLSAAARFRSGMHSAAERGARIFGECGGYMVLGEGLVAADGTRYDMLGLLPLVTSFAERRRHLGYRRVVPVDNAFFDGPMTAHEFHYATIVAEGAADRLFAVSDAAGEDLGQAGLRRGPVAGSFMHLIDVAGAA,brenda,P21632,C/C1=C2/NC([C@H](CC(=O)O)[C@@]2(C)CCC(=O)O)[C@]2(C)N=C(/C(C)=C3\N=C(/C=C4\N=C1[C@@H](CCC(=O)O)C4(C)C)[C@@H](CCC(=O)O)[C@]3(C)CC(=O)O)[C@@H](CCC(=O)O)[C@]2(C)CC(=O)O,0.00041,30.0,7.6,6.3.5.9,43306.0,-3.3872161432802645,-3.3872161432802645,C/C1=C2/NC([C@H](CC(=O)O)[C@@]2(C)CCC(=O)O)[C@]2(C)N=C(/C(C)=C3\N=C(/C=C4\N=C1[C@@H](CCC(=O)O)C4(C)C)[C@@H](CCC(=O)O)[C@]3(C)CC(=O)O)[C@@H](CCC(=O)O)[C@]2(C)CC(=O)O__MSGLLIAAPASGSGKTTVTLGLMRALKRRGVAIAPGKAGPDYIDPAFHAAATGEPCFNYDPWAMRPELLLANASHVASGGRTLIVEAMMGLHDGAADGSGTPADLAATLNLAVILVVDCARMSQSVAALVRGYADHRDDIRVVGVILNKVGSDRHEMMLRDALGKVRMPVFGVLRQDSALQLPERHLGLVQAGEHSALEGFIEAAAARVEAACDLDAIRLIATIFPQVPAAADAERLRPLGQRIAVARDIAFAFCYEHLLYGWRQGGAEISFFSPLADEGPDAAADAVYLPGGYPELHAGQLSAAARFRSGMHSAAERGARIFGECGGYMVLGEGLVAADGTRYDMLGLLPLVTSFAERRRHLGYRRVVPVDNAFFDGPMTAHEFHYATIVAEGAADRLFAVSDAAGEDLGQAGLRRGPVAGSFMHLIDVAGAA,./data/raw/alphafold//AF-P21632-F1-model_v4.pdb,3043,261,295,339 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RDRDSQRDLVEAVAHILGIRDLAAVNLDSSLADLGLDSLMSVEVRQTLERELNLVLSVREVRQLTLRKLQELSSKADEASELACPTPKEDGLAQQQTQLNLRSLLVNPEGPTLMRLNSVQSSERPLFLVHPIEGSTTVFHSLASRLSIPTYGLQCTRAAPLDSIHSLAAYYIDCIRQVQPEGPYRVAGYSYGACVAFEMCSQLQAQQSPAPTHNSLFLFDGSPTYVLAYTQSYRAKLTPGCEAEAETEAICFFVQQFTDMEHNRVLEALLPLKGLEERVAAAVDLIIKSHQGLDRQELSFAARSFYYKLRAAEQYTPKAKYHGNVMLLRAKTGGAYGEDLGADYNLSQVCDGKVSVHVIEGDHRTLLEGSGLESIISIIHSSLAEPRVSVREG,./data/raw/alphafold//AF-P49327-F1-model_v4.pdb,3460,274,1142,1405 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+363,25605,26021,MIPDVSQALAWLEKHPQALKGIQRGLERETLRVNADGTLATTGHPEALGSALTHKWITTDFAEALLEFITPVDGDIEHMLTFMRDLHRYTARNMGDERMWPLSMPCYIAEGQDIELAQYGTSNTGRFKTLYREGLKNRYGALMQTISGVHYNFSLPMAFWQAKCGDISGADAKEKISAGYFRVIRNYYRFGWVIPYLFGASPAICSSFLQGKPTSLPFEKTECGMYYLPYATSLRLSDLGYTNKSQSNLGITFNDLYEYVAGLKQAIKTPSEEYAKIGIEKDGKRLQINSNVLQIENELYAPIRPKRVTRSGESPSDALLRGGIEYIEVRSLDINPFSPIGVDEQQVRFLDLFMVWCALADAPEMSSSELACTRVNWNRVILEGRKPGLTLGIGCETAQFPLPQVGKDLFRDLKRVAQTLDSINGGEAYQKVCDELVACFDNPDLTFSARILRSMIDTGIGGTGKAFAEAYRNLLREEPLEILREEDFVAEREASERRQQEMEAADTEPFAVWLEKHA,brenda,P0A6W9,N[C@@H](CS)C(=O)O,0.1,37.0,8.2,6.3.2.2,9606.0,-1.0,-0.9149091649655646,N[C@@H](CS)C(=O)O__MIPDVSQALAWLEKHPQALKGIQRGLERETLRVNADGTLATTGHPEALGSALTHKWITTDFAEALLEFITPVDGDIEHMLTFMRDLHRYTARNMGDERMWPLSMPCYIAEGQDIELAQYGTSNTGRFKTLYREGLKNRYGALMQTISGVHYNFSLPMAFWQAKCGDISGADAKEKISAGYFRVIRNYYRFGWVIPYLFGASPAICSSFLQGKPTSLPFEKTECGMYYLPYATSLRLSDLGYTNKSQSNLGITFNDLYEYVAGLKQAIKTPSEEYAKIGIEKDGKRLQINSNVLQIENELYAPIRPKRVTRSGESPSDALLRGGIEYIEVRSLDINPFSPIGVDEQQVRFLDLFMVWCALADAPEMSSSELACTRVNWNRVILEGRKPGLTLGIGCETAQFPLPQVGKDLFRDLKRVAQTLDSINGGEAYQKVCDELVACFDNPDLTFSARILRSMIDTGIGGTGKAFAEAYRNLLREEPLEILREEDFVAEREASERRQQEMEAADTEPFAVWLEKHA,./data/raw/alphafold//AF-P0A6W9-F1-model_v4.pdb,5253,3313,4074,4744 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+429,22994,23348,MLVGLIGYGAIGKFLAEWLERNGFEIAAILDVRGEHEKMVRGIDEFLQREMDVAVEAASQQAVKDYAEKILKAGIDLIVLSTGAFADRDFLSRVREVCRKTGRRVYIASGAIGGLDAIFSASELIEEIVLTTRKNWRQFGRKGVIFEGSASEAAQKFPKNLNVAATLSIASGKDVKVRLVADEVEENIHEILVRGEFGEMEIRVRNRPMRENPKTSYLAALSVTRILRNLKEGLVV,sabio,O28440,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.11,,11.3,1.4.1.21,2234.0,-0.958607314841775,-0.958607314841775,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MLVGLIGYGAIGKFLAEWLERNGFEIAAILDVRGEHEKMVRGIDEFLQREMDVAVEAASQQAVKDYAEKILKAGIDLIVLSTGAFADRDFLSRVREVCRKTGRRVYIASGAIGGLDAIFSASELIEEIVLTTRKNWRQFGRKGVIFEGSASEAAQKFPKNLNVAATLSIASGKDVKVRLVADEVEENIHEILVRGEFGEMEIRVRNRPMRENPKTSYLAALSVTRILRNLKEGLVV,./data/raw/alphafold//AF-O28440-F1-model_v4.pdb,3909,4650,6447,6360 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+436,1631,1668,MKAARFHGQKDIRIEEIPEPELRPGTVKLKVAWCGICGTDLHEYLEGPIFISAPGHPHPLSHENAPVTMGHEFSGTVEEVGEGVTDVEVGENVVVEPYFVCNECAPCKAGNYHLCTKMGFIGLAGGGGGLSEKVVVDRRWIHKIGNIPLDEAALIEPLSVAHHAVVRSGAESGNVAIVGGAGPIGLLVAAVLKGLGVTTIVTELSEARKAKALSSGVADYVIDPTTEDVKARVLELSGGIGADIGFECAGVNAVLDTMLDTVRPAGVVVNVSIWGKPATIDMQKLVLKEIDLRGTIAYVRDHEAVIKMVQDGVVDLAPFITGRIQLEELISEGFTTLIEHNDTAVKILVRS,brenda,A0A0E4A9D6,CC(=O)C(C)=O,0.1,50.0,8.25,1.1.1.4,1833.0,-1.0,-1.0,CC(=O)C(C)=O__MKAARFHGQKDIRIEEIPEPELRPGTVKLKVAWCGICGTDLHEYLEGPIFISAPGHPHPLSHENAPVTMGHEFSGTVEEVGEGVTDVEVGENVVVEPYFVCNECAPCKAGNYHLCTKMGFIGLAGGGGGLSEKVVVDRRWIHKIGNIPLDEAALIEPLSVAHHAVVRSGAESGNVAIVGGAGPIGLLVAAVLKGLGVTTIVTELSEARKAKALSSGVADYVIDPTTEDVKARVLELSGGIGADIGFECAGVNAVLDTMLDTVRPAGVVVNVSIWGKPATIDMQKLVLKEIDLRGTIAYVRDHEAVIKMVQDGVVDLAPFITGRIQLEELISEGFTTLIEHNDTAVKILVRS,./data/raw/alphafold//AF-A0A0E4A9D6-F1-model_v4.pdb,1683,850,1019,1252 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+448,17822,18081,MTPILNHYFARINWSGAAAVNIDTLRALHLKHNCTIPFENLDVLLPREIQLDNQSPEEKLVIARRGGYCFEQNGVFERVLRELGFNVRSLLGRVVLSNPPALPPRTHRLLLVELEEEKWIADVGFGGQTLTAPIRLVSDLVQTTPHGEYRLLQEGDDWVLQFNHHQHWQSMYRFDLCEQQQSDYVMGNFWSAHWPQSHFRHHLLMCRHLPDGGKLTLTNFHFTHYENGHAVEQRNLPDVASLYAVMQEQFGLGVDDAKHGFTVDELALVMAAFDTHPEAGK,sabio,P77567,Cc1ccc(N)cc1,0.63,37.0,7.4,2.3.1.118,562.0,-0.2006594505464183,-0.2006594505464183,Cc1ccc(N)cc1__MTPILNHYFARINWSGAAAVNIDTLRALHLKHNCTIPFENLDVLLPREIQLDNQSPEEKLVIARRGGYCFEQNGVFERVLRELGFNVRSLLGRVVLSNPPALPPRTHRLLLVELEEEKWIADVGFGGQTLTAPIRLVSDLVQTTPHGEYRLLQEGDDWVLQFNHHQHWQSMYRFDLCEQQQSDYVMGNFWSAHWPQSHFRHHLLMCRHLPDGGKLTLTNFHFTHYENGHAVEQRNLPDVASLYAVMQEQFGLGVDDAKHGFTVDELALVMAAFDTHPEAGK,./data/raw/alphafold//AF-P77567-F1-model_v4.pdb,5347,3266,4019,4682 +449,33293,33886,MAPKVGINGFGRIGRIVFRNAIEAGTVDVVAVNDPFIETHYAAYMLKYDSQHGQFKGTIETYDEGLIVNGKKIRFHTERDPANIPWGQDGAEYIVESTGVFTTQEKASAHLKGGAKKVVISAPSADAPMFVMGVNNETYKKDIQVLSNASCTTNCLAPLAKVINDNFGIIEGLMTTVHSYTATQKVVDGPSAKDWRGGRTAATNIIPSSTGAAKAVGKVIPSLNGKLTGMAMRVPTSNVSVVDLTVRTEKAVTYDQIKDAVKKASENELKGILGYTEDDIVSTDLNGDTRSSIFDAKAGIALNSNFIKLVSWYDNEWGYSRRVVDLITYISKVDAQ,sabio,P20445,O=CC(O)COP(=O)(O)O,0.16,30.0,7.5,1.2.1.12,162425.0,-0.7958800173440752,-0.7958800173440752,O=CC(O)COP(=O)(O)O__MAPKVGINGFGRIGRIVFRNAIEAGTVDVVAVNDPFIETHYAAYMLKYDSQHGQFKGTIETYDEGLIVNGKKIRFHTERDPANIPWGQDGAEYIVESTGVFTTQEKASAHLKGGAKKVVISAPSADAPMFVMGVNNETYKKDIQVLSNASCTTNCLAPLAKVINDNFGIIEGLMTTVHSYTATQKVVDGPSAKDWRGGRTAATNIIPSSTGAAKAVGKVIPSLNGKLTGMAMRVPTSNVSVVDLTVRTEKAVTYDQIKDAVKKASENELKGILGYTEDDIVSTDLNGDTRSSIFDAKAGIALNSNFIKLVSWYDNEWGYSRRVVDLITYISKVDAQ,./data/raw/alphafold//AF-P20445-F1-model_v4.pdb,4331,5285,7438,8361 +450,453,469,MAQPPPDVEGDDCLPAYRHLFCPDLLRDKVAFITGGGSGIGFRIAEIFMRHGCHTVIASRSLPRVLTAARKLAGATGRRCLPLSMDVRAPPAVMAAVDQALKEFGRIDILINCAAGNFLCPAGALSFNAFKTVMDIDTSGTFNVSRVLYEKFFRDHGGVIVNITATLGNRGQALQVHAGSAKAAVDAMTRHLAVEWGPQNIRVNSLAPGPISGTEGLRRLGGPQASLSTKVTASPLQRLGNKTEIAHSVLYLASPLASYVTGAVLVADGGAWLTFPNGVKGLPDFASFSAKL,brenda,Q9NUI1,C/C=C/C=C/C(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.059,30.0,7.4,1.3.1.124,9606.0,-1.2291479883578558,-1.2011276514692852,C/C=C/C=C/C(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MAQPPPDVEGDDCLPAYRHLFCPDLLRDKVAFITGGGSGIGFRIAEIFMRHGCHTVIASRSLPRVLTAARKLAGATGRRCLPLSMDVRAPPAVMAAVDQALKEFGRIDILINCAAGNFLCPAGALSFNAFKTVMDIDTSGTFNVSRVLYEKFFRDHGGVIVNITATLGNRGQALQVHAGSAKAAVDAMTRHLAVEWGPQNIRVNSLAPGPISGTEGLRRLGGPQASLSTKVTASPLQRLGNKTEIAHSVLYLASPLASYVTGAVLVADGGAWLTFPNGVKGLPDFASFSAKL,./data/raw/alphafold//AF-Q9NUI1-F1-model_v4.pdb,142,2891,3585,383 +451,15918,16153,MLSFQYPDVYRDETAIQDYHGHKVCDPYAWLEDPDSEQTKAFVEAQNKITVPFLEQCPIRGLYKERMTELYDYPKYSCHFKKGKRYFYFYNTGLQNQRVLYVQDSLEGEARVFLDPNILSDDGTVALRGYAFSEDGEYFAYGLSASGSDWVTIKFMKVDGAKELPDVLERVKFSCMAWTHDGKGMFYNAYPQQDGKSDGTETSTNLHQKLYYHVLGTDQSEDILCAEFPDEPKWMGGAELSDDGRYVLLSIREGCDPVNRLWYCDLQQESNGITGILKWVKLIDNFEGEYDYVTNEGTVFTFKTNRHSPNYRLINIDFTDPEESKWKVLVPEHEKDVLEWVACVRSNFLVLCYLHDVKNTLQLHDLATGALLKIFPLEVGSVVGYSGQKKDTEIFYQFTSFLSPGIIYHCDLTKEELEPRVFREVTVKGIDASDYQTVQIFYPSKDGTKIPMFIVHKKGIKLDGSHPAFLYGYGGFNISITPNYSVSRLIFVRHMGGVLAVANIRGGGEYGETWHKGGILANKQNCFDDFQCAAEYLIKEGYTSPKRLTINGGSNGGLLVATCANQRPDLFGCVIAQVGVMDMLKFHKYTIGHAWTTDYGCSDSKQHFEWLIKYSPLHNVKLPEADDIQYPSMLLLTADHDDRVVPLHSLKFIATLQYIVGRSRKQNNPLLIHVDTKAGHGAGKPTAKVIEEVSDMFAFIARCLNIDWIP,brenda,P23687,C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccc([N+](=O)[O-])cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCC(=O)O)N=C(O)c1ccccc1N)C(=O)O,1.32,33.5,7.666666666666667,3.4.21.26,9823.0,0.1205739312058498,0.1205739312058498,C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccc([N+](=O)[O-])cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCC(=O)O)N=C(O)c1ccccc1N)C(=O)O__MLSFQYPDVYRDETAIQDYHGHKVCDPYAWLEDPDSEQTKAFVEAQNKITVPFLEQCPIRGLYKERMTELYDYPKYSCHFKKGKRYFYFYNTGLQNQRVLYVQDSLEGEARVFLDPNILSDDGTVALRGYAFSEDGEYFAYGLSASGSDWVTIKFMKVDGAKELPDVLERVKFSCMAWTHDGKGMFYNAYPQQDGKSDGTETSTNLHQKLYYHVLGTDQSEDILCAEFPDEPKWMGGAELSDDGRYVLLSIREGCDPVNRLWYCDLQQESNGITGILKWVKLIDNFEGEYDYVTNEGTVFTFKTNRHSPNYRLINIDFTDPEESKWKVLVPEHEKDVLEWVACVRSNFLVLCYLHDVKNTLQLHDLATGALLKIFPLEVGSVVGYSGQKKDTEIFYQFTSFLSPGIIYHCDLTKEELEPRVFREVTVKGIDASDYQTVQIFYPSKDGTKIPMFIVHKKGIKLDGSHPAFLYGYGGFNISITPNYSVSRLIFVRHMGGVLAVANIRGGGEYGETWHKGGILANKQNCFDDFQCAAEYLIKEGYTSPKRLTINGGSNGGLLVATCANQRPDLFGCVIAQVGVMDMLKFHKYTIGHAWTTDYGCSDSKQHFEWLIKYSPLHNVKLPEADDIQYPSMLLLTADHDDRVVPLHSLKFIATLQYIVGRSRKQNNPLLIHVDTKAGHGAGKPTAKVIEEVSDMFAFIARCLNIDWIP,./data/raw/alphafold//AF-P23687-F1-model_v4.pdb,829,3937,5317,5652 +452,11056,11212,MRAVRLVEIGKPLSLQEIGVPKPKGPQVLIKVEAAGVCHSDVHMRQGRFGNLRIVEDLGVKLPVTLGHEIAGKIEEVGDEVVGYSKGDLVAVNPWQGEGNCYYCRIGEEHLCDSPRWLGINFDGAYAEYVIVPHYKYMYKLRRLNAVEAAPLTCSGITTYRAVRKASLDPTKTLLVVGAGGGLGTMAVQIAKAVSGATIIGVDVREEAVEAAKRAGADYVINASMQDPLAEIRRITESKGVDAVIDLNNSEKTLSVYPKALAKQGKYVMVGLFGADLHYHAPLITLSEIQFVGSLVGNQSDFLGIMRLAEAGKVKPMITKTMKLEEANEAIDNLENFKAIGRQVLIP,brenda,P39462,CCCCCO,0.027,65.0,8.0,1.1.1.1,2287.0,-1.5686362358410126,-1.5686362358410126,CCCCCO__MRAVRLVEIGKPLSLQEIGVPKPKGPQVLIKVEAAGVCHSDVHMRQGRFGNLRIVEDLGVKLPVTLGHEIAGKIEEVGDEVVGYSKGDLVAVNPWQGEGNCYYCRIGEEHLCDSPRWLGINFDGAYAEYVIVPHYKYMYKLRRLNAVEAAPLTCSGITTYRAVRKASLDPTKTLLVVGAGGGLGTMAVQIAKAVSGATIIGVDVREEAVEAAKRAGADYVINASMQDPLAEIRRITESKGVDAVIDLNNSEKTLSVYPKALAKQGKYVMVGLFGADLHYHAPLITLSEIQFVGSLVGNQSDFLGIMRLAEAGKVKPMITKTMKLEEANEAIDNLENFKAIGRQVLIP,./data/raw/alphafold//AF-P39462-F1-model_v4.pdb,3444,3241,3992,1263 +453,37541,38204,MDPKHQRVTLNDGHSIPVLGFGTYAPDEVPKSEAGEAAKIAIDVGFRHIDTAHAYQNEEEVGLAIRSKIADGTVKREDVFCTTKLWCTFFRPELVRKGLEQSLRKLQLDYVDLYLMHYPIAMKPGEEMFPTDEHGKTISDTVDICATWEAMEKCKDAGLAKSIGVSNFNHKQLEKILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAYSALGSSRDPKWVDQSSPVLLEDPVIGALAKKHKQSPALIALRYQLQRGVVVLAKSFIEREIKENIKVFGFQLSSEDMKALDGLNQNLRYCPAHFYIGHPHYPFSDEY,brenda,J7M9D0,OC1C=CCCC1,0.035,25.0,7.4,1.1.1.239,9986.0,-1.4559319556497243,-1.4559319556497243,OC1C=CCCC1__MDPKHQRVTLNDGHSIPVLGFGTYAPDEVPKSEAGEAAKIAIDVGFRHIDTAHAYQNEEEVGLAIRSKIADGTVKREDVFCTTKLWCTFFRPELVRKGLEQSLRKLQLDYVDLYLMHYPIAMKPGEEMFPTDEHGKTISDTVDICATWEAMEKCKDAGLAKSIGVSNFNHKQLEKILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAYSALGSSRDPKWVDQSSPVLLEDPVIGALAKKHKQSPALIALRYQLQRGVVVLAKSFIEREIKENIKVFGFQLSSEDMKALDGLNQNLRYCPAHFYIGHPHYPFSDEY,./data/raw/esmfold//ESMFold-J7M9D0-v1.pdb,2022,202,1007,1239 +454,5754,5840,MDSFPLLAALFFIAATITFLSFRRRRNLPPGPFPYPIVGNMLQLGANPHQVFAKLSKRYGPLMSIHLGSLYTVIVSSPEMAKEILHRHGQVFSGRTIAQAVHACDHDKISMGFLPVASEWRDMRKICKEQMFSNQSMEASQGLRRQKLQQLLDHVQKCSDSGRAVDIREAAFITTLNLMSATLFSSQATEFDSKATMEFKEIIEGVATIVGVPNFADYFPILRPFDPQGVKRRADVFFGKLLAKIEGYLNERLESKRANPNAPKKDDFLEIVVDIIQANEFKLKTHHFTHLMLDLFVGGSDTNTTSIEWAMSELVMNPDKMARLKAELKSVAGDEKIVDESAMPKLPYLQAVIKEVMRIHPPGPLLLPRKAESDQEVNGYLIPKGTQILINAYAIGRDPSIWTDPETFDPERFLDNKIDFKGQDYELLPFGSGRRVCPGMPLATRILHMATATLVHNFDWKLEDDSTAAADHAGELFGVAVRRAVPLRIIPIVKS,brenda,S4UX02,CC(C)c1ccc2c(c1)CC[C@H]1C(C)(C)CCC[C@]21C,0.013,28.0,7.5,1.14.14.175,226208.0,-1.8860566476931635,-1.8860566476931635,CC(C)c1ccc2c(c1)CC[C@H]1C(C)(C)CCC[C@]21C__MDSFPLLAALFFIAATITFLSFRRRRNLPPGPFPYPIVGNMLQLGANPHQVFAKLSKRYGPLMSIHLGSLYTVIVSSPEMAKEILHRHGQVFSGRTIAQAVHACDHDKISMGFLPVASEWRDMRKICKEQMFSNQSMEASQGLRRQKLQQLLDHVQKCSDSGRAVDIREAAFITTLNLMSATLFSSQATEFDSKATMEFKEIIEGVATIVGVPNFADYFPILRPFDPQGVKRRADVFFGKLLAKIEGYLNERLESKRANPNAPKKDDFLEIVVDIIQANEFKLKTHHFTHLMLDLFVGGSDTNTTSIEWAMSELVMNPDKMARLKAELKSVAGDEKIVDESAMPKLPYLQAVIKEVMRIHPPGPLLLPRKAESDQEVNGYLIPKGTQILINAYAIGRDPSIWTDPETFDPERFLDNKIDFKGQDYELLPFGSGRRVCPGMPLATRILHMATATLVHNFDWKLEDDSTAAADHAGELFGVAVRRAVPLRIIPIVKS,./data/raw/alphafold//AF-S4UX02-F1-model_v4.pdb,4986,2145,1426,3210 +455,37067,37719,MAGDSEQTLQNHQQPNGGEPFLIGVSGGTASGKSSVCAKIVQLLGQNEVDYRQKQVVILSQDSFYRVLTSEQKAKALKGQFNFDHPDAFDNELILKTLKEITEGKTVQIPVYDFVSHSRKEETVTVYPADVVLFEGILAFYSQEVRDLFQMKLFVDTDADTRLSRRVLRDISERGRDLEQILSQYITFVKPAFEEFCLPTKKYADVIIPRGADNLVAINLIVQHIQDILNGGPSKRQTNGCLNGYTPSRKRQASESSSRPH,brenda,Q9BZX2,O=c1nc(O)ccn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,0.13,37.0,7.6,2.7.1.48,9606.0,-0.8860566476931633,-1.1124329397064865,O=c1nc(O)ccn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O__MAGDSEQTLQNHQQPNGGEPFLIGVSGGTASGKSSVCAKIVQLLGQNEVDYRQKQVVILSQDSFYRVLTSEQKAKALKGQFNFDHPDAFDNELILKTLKEITEGKTVQIPVYDFVSHSRKEETVTVYPADVVLFEGILAFYSQEVRDLFQMKLFVDTDADTRLSRRVLRDISERGRDLEQILSQYITFVKPAFEEFCLPTKKYADVIIPRGADNLVAINLIVQHIQDILNGGPSKRQTNGCLNGYTPSRKRQASESSSRPH,./data/raw/alphafold//AF-Q9BZX2-F1-model_v4.pdb,2553,5400,6097,7436 +456,37070,37722,MASAGGEDCESPAPEADRPHQRPFLIGVSGGTASGKSTVCEKIMELLGQNEVEQRQRKVVILSQDRFYKVLTAEQKAKALKGQYNFDHPDAFDNDLMHRTLKNIVEGKTVEVPTYDFVTHSRLPETTVVYPADVVLFEGILVFYSQEIRDMFHLRLFVDTDSDVRLSRRVLRDVRRGRDLEQILTQYTTFVKPAFEEFCLPTKKYADVIIPRGVDNMVAINLIVQHIQDILNGDICKWHRGGSNGRSYKRTFSEPGDHPGMLTSGKRSHLESSSRPH,brenda,Q9HA47,O=c1nc(O)ccn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,0.05,37.0,7.6,2.7.1.48,9606.0,-1.3010299956639813,-0.3721128549487941,O=c1nc(O)ccn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O__MASAGGEDCESPAPEADRPHQRPFLIGVSGGTASGKSTVCEKIMELLGQNEVEQRQRKVVILSQDRFYKVLTAEQKAKALKGQYNFDHPDAFDNDLMHRTLKNIVEGKTVEVPTYDFVTHSRLPETTVVYPADVVLFEGILVFYSQEIRDMFHLRLFVDTDSDVRLSRRVLRDVRRGRDLEQILTQYTTFVKPAFEEFCLPTKKYADVIIPRGVDNMVAINLIVQHIQDILNGDICKWHRGGSNGRSYKRTFSEPGDHPGMLTSGKRSHLESSSRPH,./data/raw/alphafold//AF-Q9HA47-F1-model_v4.pdb,2553,5400,6098,7437 +457,25826,26257,MAPSLDSISHSFANGVASAKQAVNGASTNLAVAGSHLPTTQVTQVDIVEKMLAAPTDSTLELDGYSLNLGDVVSAARKGRPVRVKDSDEIRSKIDKSVEFLRSQLSMSVYGVTTGFGGSADTRTEDAISLQKALLEHQLCGVLPSSFDSFRLGRGLENSLPLEVVRGAMTIRVNSLTRGHSAVRLVVLEALTNFLNHGITPIVPLRGTISASGDLSPLSYIAAAISGHPDSKVHVVHEGKEKILYAREAMALFNLEPVVLGPKEGLGLVNGTAVSASMATLALHDAHMLSLLSQSLTAMTVEAMVGHAGSFHPFLHDVTRPHPTQIEVAGNIRKLLEGSRFAVHHEEEVKVKDDEGILRQDRYPLRTSPQWLGPLVSDLIHAHAVLTIEAGQSTTDNPLIDVENKTSHHGGNFQAAAVANTMEKTRLGLAQIGKLNFTQLTEMLNAGMNRGLPSCLAAEDPSLSYHCKGLDIAAAAYTSELGHLANPVTTHVQPAEMANQAVNSLALISARRTTESNDVLSLLLATHLYCVLQAIDLRAIEFEFKKQFGPAIVSLIDQHFGSAMTGSNLRDELVEKVNKTLAKRLEQTNSYDLVPRWHDAFSFAAGTVVEVLSSTSLSLAAVNAWKVAAAESAISLTRQVRETFWSAASTSSPALSYLSPRTQILYAFVREELGVKARRGDVFLGKQEVTIGSNVSKIYEAIKSGRINNVLLKMLA,brenda,P11544,N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.21,30.0,8.8,4.3.1.25,5286.0,-0.6777807052660807,-0.6777807052660807,N[C@@H](Cc1ccc(O)cc1)C(=O)O__MAPSLDSISHSFANGVASAKQAVNGASTNLAVAGSHLPTTQVTQVDIVEKMLAAPTDSTLELDGYSLNLGDVVSAARKGRPVRVKDSDEIRSKIDKSVEFLRSQLSMSVYGVTTGFGGSADTRTEDAISLQKALLEHQLCGVLPSSFDSFRLGRGLENSLPLEVVRGAMTIRVNSLTRGHSAVRLVVLEALTNFLNHGITPIVPLRGTISASGDLSPLSYIAAAISGHPDSKVHVVHEGKEKILYAREAMALFNLEPVVLGPKEGLGLVNGTAVSASMATLALHDAHMLSLLSQSLTAMTVEAMVGHAGSFHPFLHDVTRPHPTQIEVAGNIRKLLEGSRFAVHHEEEVKVKDDEGILRQDRYPLRTSPQWLGPLVSDLIHAHAVLTIEAGQSTTDNPLIDVENKTSHHGGNFQAAAVANTMEKTRLGLAQIGKLNFTQLTEMLNAGMNRGLPSCLAAEDPSLSYHCKGLDIAAAAYTSELGHLANPVTTHVQPAEMANQAVNSLALISARRTTESNDVLSLLLATHLYCVLQAIDLRAIEFEFKKQFGPAIVSLIDQHFGSAMTGSNLRDELVEKVNKTLAKRLEQTNSYDLVPRWHDAFSFAAGTVVEVLSSTSLSLAAVNAWKVAAAESAISLTRQVRETFWSAASTSSPALSYLSPRTQILYAFVREELGVKARRGDVFLGKQEVTIGSNVSKIYEAIKSGRINNVLLKMLA,./data/raw/alphafold//AF-P11544-F1-model_v4.pdb,1134,6312,8158,12122 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+473,28433,28932,MPKKKPTPIQLNPAPDGSAVNGTSSAETNLEALQKKLEELELDEQQRKRLEAFLTQKQKVGELKDDDFEKISELGAGNGGVVFKVSHKPSGLVMARKLIHLEIKPAIRNQIIRELQVLHECNSPYIVGFYGAFYSDGEISICMEHMDGGSLDQVLKKAGRIPEQILGKVSIAVIKGLTYLREKHKIMHRDVKPSNILVNSRGEIKLCDFGVSGQLIDSMANSFVGTRSYMSPERLQGTHYSVQSDIWSMGLSLVEMAVGRYPIPPPDAKELELMFGCQVEGDAAETPPRPRTPGRPLSSYGMDSRPPMAIFELLDYIVNEPPPKLPSGVFSLEFQDFVNKCLIKNPAERADLKQLMVHAFIKRSDAEEVDFAGWLCSTIGLNQPSTPTHAAGV,brenda,Q02750,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.0533,25.0,7.0,2.7.12.2,9606.0,-1.2732727909734278,-1.2732727909734278,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MPKKKPTPIQLNPAPDGSAVNGTSSAETNLEALQKKLEELELDEQQRKRLEAFLTQKQKVGELKDDDFEKISELGAGNGGVVFKVSHKPSGLVMARKLIHLEIKPAIRNQIIRELQVLHECNSPYIVGFYGAFYSDGEISICMEHMDGGSLDQVLKKAGRIPEQILGKVSIAVIKGLTYLREKHKIMHRDVKPSNILVNSRGEIKLCDFGVSGQLIDSMANSFVGTRSYMSPERLQGTHYSVQSDIWSMGLSLVEMAVGRYPIPPPDAKELELMFGCQVEGDAAETPPRPRTPGRPLSSYGMDSRPPMAIFELLDYIVNEPPPKLPSGVFSLEFQDFVNKCLIKNPAERADLKQLMVHAFIKRSDAEEVDFAGWLCSTIGLNQPSTPTHAAGV,./data/raw/alphafold//AF-Q02750-F1-model_v4.pdb,1552,6861,8703,8928 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+630,27145,27610,MAFANLRKVLISDSLDPCCRKILQDGGLQVVEKQNLSKEELIAELQDCEGLIVRSATKVTADVINAAEKLQVVGRAGTGVDNVDLEAATRKGILVMNTPNGNSLSAAELTCGMIMCLARQIPQATASMKDGKWERKKFMGTELNGKTLGILGLGRIGREVATRMQSFGMKTIGYDPIISPEVSASFGVQQLPLEEIWPLCDFITVHTPLLPSTTGLLNDNTFAQCKKGVRVVNCARGGIVDEGALLRALQSGQCAGAALDVFTEEPPRDRALVDHENVISCPHLGASTKEAQSRCGEEIAVQFVDMVKGKSLTGVVNAQALTSAFSPHTKPWIGLAEALGTLMRAWAGSPKGTIQVITQGTSLKNAGNCLSPAVIVGLLKEASKQADVNLVNAKLLVKEAGLNVTTSHSPAAPGEQGFGECLLAVALAGAPYQAVGLVQGTTPVLQGLNGAVFRPEVPLRRDLPLLLFRTQTSDPAMLPTMIGLLAEAGVRLLSYQTSLVSDGETWHVMGISSLLPSLEAWKQHVTEAFQFHF,brenda,O43175,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC([n+]3cccc(C=O)c3)C(O)C2O)C(O)C1O,0.1477,22.0,7.1,1.1.1.95,9606.0,-0.8306195046880505,-0.8306195046880505,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC([n+]3cccc(C=O)c3)C(O)C2O)C(O)C1O__MAFANLRKVLISDSLDPCCRKILQDGGLQVVEKQNLSKEELIAELQDCEGLIVRSATKVTADVINAAEKLQVVGRAGTGVDNVDLEAATRKGILVMNTPNGNSLSAAELTCGMIMCLARQIPQATASMKDGKWERKKFMGTELNGKTLGILGLGRIGREVATRMQSFGMKTIGYDPIISPEVSASFGVQQLPLEEIWPLCDFITVHTPLLPSTTGLLNDNTFAQCKKGVRVVNCARGGIVDEGALLRALQSGQCAGAALDVFTEEPPRDRALVDHENVISCPHLGASTKEAQSRCGEEIAVQFVDMVKGKSLTGVVNAQALTSAFSPHTKPWIGLAEALGTLMRAWAGSPKGTIQVITQGTSLKNAGNCLSPAVIVGLLKEASKQADVNLVNAKLLVKEAGLNVTTSHSPAAPGEQGFGECLLAVALAGAPYQAVGLVQGTTPVLQGLNGAVFRPEVPLRRDLPLLLFRTQTSDPAMLPTMIGLLAEAGVRLLSYQTSLVSDGETWHVMGISSLLPSLEAWKQHVTEAFQFHF,./data/raw/alphafold//AF-O43175-F1-model_v4.pdb,4018,4813,6649,2176 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+632,7930,8065,MAGWSCLVTGGGGFLGQRIVHLLLEEKDLQEIRVLDKVFKPEVREEFSKLQSKIKLTMLEGDILDEQCLKGACQGASVVIHTASIIDVVNAVGRETVMKVNVKGTQLLLEACVQASVPVFIHTSSIEVAGPNSYREVIQNACEEDRLETAWSAPYPLSKKLAEKAVLEANGWALQNGGTLHTCALRPMYIYGEGSPFIFAHMNKALENNGVLTHNSKFSRVNPVYVGNVAWAHILALRALRDPRKALSVQGQFYYVADDTPPQSYDDLNYTLGKEWGFCLDSRRSLPPSLRYWLAFLLEIVSFLLSPIYNYQPPFNRHFVTLCNSVFTVSYKKAQRDLGYEPLFTWEEAKQKTKAWVGSLVKQHKEALKTKTH,uniprot_search,Q9N119,CC1=CC(=O)c2ccccc2C1=O,0.693,37.0,7.4,1.1.1.145,9823.0,-0.1592667653881933,-0.1592667653881933,CC1=CC(=O)c2ccccc2C1=O__MAGWSCLVTGGGGFLGQRIVHLLLEEKDLQEIRVLDKVFKPEVREEFSKLQSKIKLTMLEGDILDEQCLKGACQGASVVIHTASIIDVVNAVGRETVMKVNVKGTQLLLEACVQASVPVFIHTSSIEVAGPNSYREVIQNACEEDRLETAWSAPYPLSKKLAEKAVLEANGWALQNGGTLHTCALRPMYIYGEGSPFIFAHMNKALENNGVLTHNSKFSRVNPVYVGNVAWAHILALRALRDPRKALSVQGQFYYVADDTPPQSYDDLNYTLGKEWGFCLDSRRSLPPSLRYWLAFLLEIVSFLLSPIYNYQPPFNRHFVTLCNSVFTVSYKKAQRDLGYEPLFTWEEAKQKTKAWVGSLVKQHKEALKTKTH,./data/raw/alphafold//AF-Q9N119-F1-model_v4.pdb,3414,874,1074,1322 +633,32386,32964,MAGTEVTNRQILFKNFVVGWPQESDMEFVTTKKKLELREGQKDVIVRVLYLSCDPCQRGRMRNSTDSYIPPYTPGKPIEGYGLGKVILSSDPAFNEGDIVSGLMGWEDYSYGFRLVKIDDLALPISYYLGALGMAGFTAYVGFFRICEPKKGDTIYVSAASGAVGQMVGQFAKLFGCRVVGSAGSQQKVDLLTSKFGYDEAFNYKEEPDLDAALKRCCPDGIDIYFENVGGKMLDAVLVNMKVFGRIAVCGMVSQYNKEVQDPIYNLNYTVKRRLKIHGFLQSDHMDVQPEFFKNVIQWFKEGKLVYVEDIADGLEKGPAALIGLLAGKNVGKQSVKVADP,brenda,S5TMG0,O=C/C=C/c1ccc(O)cc1,0.1719,30.0,6.5,1.3.1.102,157224.0,-0.7647241233129476,-0.7647241233129476,O=C/C=C/c1ccc(O)cc1__MAGTEVTNRQILFKNFVVGWPQESDMEFVTTKKKLELREGQKDVIVRVLYLSCDPCQRGRMRNSTDSYIPPYTPGKPIEGYGLGKVILSSDPAFNEGDIVSGLMGWEDYSYGFRLVKIDDLALPISYYLGALGMAGFTAYVGFFRICEPKKGDTIYVSAASGAVGQMVGQFAKLFGCRVVGSAGSQQKVDLLTSKFGYDEAFNYKEEPDLDAALKRCCPDGIDIYFENVGGKMLDAVLVNMKVFGRIAVCGMVSQYNKEVQDPIYNLNYTVKRRLKIHGFLQSDHMDVQPEFFKNVIQWFKEGKLVYVEDIADGLEKGPAALIGLLAGKNVGKQSVKVADP,./data/raw/alphafold//AF-S5TMG0-F1-model_v4.pdb,2006,7519,1772,9849 +634,19922,20216,MTKKIVAIWAQDEEGVIGKENRLPWHLPAELQHFKETTLNHAILMGRVTFDGMGRRLLPKRETLILTRNPEEKIDGVATFQDVQSVLDWYQAQEKNLYIIGGKQIFQAFEPYLDEVIVTHIHARVEGDTYFPEELDLSLFETVSSKFYAKDEKNPYDFTIQYRKRKEV,brenda,Q54801,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.0157,25.0,7.0,1.5.1.3,1313.0,-1.8041003475907664,-1.8041003475907664,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MTKKIVAIWAQDEEGVIGKENRLPWHLPAELQHFKETTLNHAILMGRVTFDGMGRRLLPKRETLILTRNPEEKIDGVATFQDVQSVLDWYQAQEKNLYIIGGKQIFQAFEPYLDEVIVTHIHARVEGDTYFPEELDLSLFETVSSKFYAKDEKNPYDFTIQYRKRKEV,./data/raw/alphafold//AF-Q54801-F1-model_v4.pdb,4162,5036,6930,6923 +635,17687,17946,MCTLSFMYPNSLLDGTCKTVALGDSKPRYNKQRSSCFDPLIIGNCTDQQQLCGLSWGVDKAKGRRGGTVSNLKAVVDVDKRVESYGSSDVEGNESGSYDAIVIGSGIGGLVAATQLAVKGAKVLVLEKYVIPGGSSGFYERDGYKFDVGSSVMFGFSDKGNLNLITQALAAVGRKLEVIPDPTTVHFHLPNDLSVRIHREYDDFIEELVSKFPHEKEGIIKFYSECWKIFNSLNSLELKSLEEPIYLFGQFFKKPLECLTLAYYLPQNAGSIARKYIRDPGLLSFIDAECFIVSTVNALQTPMINASMVLCDRHFGGINYPVGGVGEIAKSLAKGLDDHGSQILYRANVTSIILDNGKAVGVKLSDGRKFYAKTIVSNATRWDTFGKLLKAENLPKEEENFQKAYVKAPSFLSIHMGVKADVLPPDTDCHHFVLEDDWTNLEKPYGSIFLSIPTVLDSSLAPEGHHILHIFTTSSIEDWEGLSPKDYEAKKEVVAERIISRLEKTLFPGLKSSILFKEVGTPKTHRRYLARDSGTYGPMPRGTPKGLLGMPFNTTAIDGLYCVGDSCFPGQGVIAVAFSGVMCAHRVAADLGFEKKSDVLDSALLRLLGWLRTLA,sabio,Q8S4R4,Cc1cc2c(cc1C)N(CC(O)C(O)C(O)COP(=O)(O)OP(=O)(O)OCC1OC(n3cnc4c(N)ncnc43)C(O)C1O)c1[nH]c(=O)[nH]c(=O)c1N2,0.00055,37.0,,5.2.1.13,4081.0,-3.2596373105057563,-3.2596373105057563,Cc1cc2c(cc1C)N(CC(O)C(O)C(O)COP(=O)(O)OP(=O)(O)OCC1OC(n3cnc4c(N)ncnc43)C(O)C1O)c1[nH]c(=O)[nH]c(=O)c1N2__MCTLSFMYPNSLLDGTCKTVALGDSKPRYNKQRSSCFDPLIIGNCTDQQQLCGLSWGVDKAKGRRGGTVSNLKAVVDVDKRVESYGSSDVEGNESGSYDAIVIGSGIGGLVAATQLAVKGAKVLVLEKYVIPGGSSGFYERDGYKFDVGSSVMFGFSDKGNLNLITQALAAVGRKLEVIPDPTTVHFHLPNDLSVRIHREYDDFIEELVSKFPHEKEGIIKFYSECWKIFNSLNSLELKSLEEPIYLFGQFFKKPLECLTLAYYLPQNAGSIARKYIRDPGLLSFIDAECFIVSTVNALQTPMINASMVLCDRHFGGINYPVGGVGEIAKSLAKGLDDHGSQILYRANVTSIILDNGKAVGVKLSDGRKFYAKTIVSNATRWDTFGKLLKAENLPKEEENFQKAYVKAPSFLSIHMGVKADVLPPDTDCHHFVLEDDWTNLEKPYGSIFLSIPTVLDSSLAPEGHHILHIFTTSSIEDWEGLSPKDYEAKKEVVAERIISRLEKTLFPGLKSSILFKEVGTPKTHRRYLARDSGTYGPMPRGTPKGLLGMPFNTTAIDGLYCVGDSCFPGQGVIAVAFSGVMCAHRVAADLGFEKKSDVLDSALLRLLGWLRTLA,./data/raw/alphafold//AF-Q8S4R4-F1-model_v4.pdb,869,4289,5735,6146 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+660,832,855,MSNNGSSPLVLWYNQLGMNDVDRVGGKNASLGEMITNLSGMGVSVPNGFATTADAFNQFLDQSGVNQRIYELLDKTDIDDVTQLAKAGAQIRQWIIDTPFQPELENAIREAYAQLSADDENASFAVRSSATAEDMPDASFAGQQETFLNVQGFDAVLVAVKHVFASLFNDRAISYRVHQGYDHRGVALSAGVQRMVRSDLASSGVMFSIDTESGFDQVVFITSAWGLGEMVVQGAVNPDEFYVHKPTLAANRPAIVRRTMGSKKIRMVYAPTQEHGKQVKIEDVPQEQRDIFSLTNEEVQELAKQAVQIEKHYGRPMDIEWAKDGHTGKLFIVQARPETVRSRGQVMERYTLHSQGKIIAEGRAIGHRIGAGPVKVIHDISEMNRIEPGDVLVTDMTDPDWEPIMKKASAIVTNRGGRTCHAAIIARELGIPAVVGCGDATERMKDGENVTVSCAEGDTGYVYAELLEFSVKSSSVETMPDLPLKVMMNVGNPDRAFDFACLPNEGVGLARLEFIINRMIGVHPRALLEFDDQEPQLQNEIREMMKGFDSPREFYVGRLTEGIATLGAAFYPKRVIVRLSDFKSNEYANLVGGERYEPDEENPMLGFRGAGRYVSDSFRDCFALECEAVKRVRNDMGLTNVEIMIPFVRTVDQAKAVVEELARQGLKRGENGLKIIMMCEIPSNALLAEQFLEYFDGFSIGSNDMTQLALGLDRDSGVVSELFDERNDAVKALLSMAIRAAKKQGKYVGICGQGPSDHEDFAAWLMEEGIDSLSLNPDTVVQTWLSLAELKK,sabio,P23538,C=C(OP(=O)(O)O)C(=O)O,0.0179,25.0,6.5,2.7.9.2,562.0,-1.747146969020107,-1.747146969020107,C=C(OP(=O)(O)O)C(=O)O__MSNNGSSPLVLWYNQLGMNDVDRVGGKNASLGEMITNLSGMGVSVPNGFATTADAFNQFLDQSGVNQRIYELLDKTDIDDVTQLAKAGAQIRQWIIDTPFQPELENAIREAYAQLSADDENASFAVRSSATAEDMPDASFAGQQETFLNVQGFDAVLVAVKHVFASLFNDRAISYRVHQGYDHRGVALSAGVQRMVRSDLASSGVMFSIDTESGFDQVVFITSAWGLGEMVVQGAVNPDEFYVHKPTLAANRPAIVRRTMGSKKIRMVYAPTQEHGKQVKIEDVPQEQRDIFSLTNEEVQELAKQAVQIEKHYGRPMDIEWAKDGHTGKLFIVQARPETVRSRGQVMERYTLHSQGKIIAEGRAIGHRIGAGPVKVIHDISEMNRIEPGDVLVTDMTDPDWEPIMKKASAIVTNRGGRTCHAAIIARELGIPAVVGCGDATERMKDGENVTVSCAEGDTGYVYAELLEFSVKSSSVETMPDLPLKVMMNVGNPDRAFDFACLPNEGVGLARLEFIINRMIGVHPRALLEFDDQEPQLQNEIREMMKGFDSPREFYVGRLTEGIATLGAAFYPKRVIVRLSDFKSNEYANLVGGERYEPDEENPMLGFRGAGRYVSDSFRDCFALECEAVKRVRNDMGLTNVEIMIPFVRTVDQAKAVVEELARQGLKRGENGLKIIMMCEIPSNALLAEQFLEYFDGFSIGSNDMTQLALGLDRDSGVVSELFDERNDAVKALLSMAIRAAKKQGKYVGICGQGPSDHEDFAAWLMEEGIDSLSLNPDTVVQTWLSLAELKK,./data/raw/alphafold//AF-P23538-F1-model_v4.pdb,3344,492,574,694 +661,24222,24608,MAWSVTGSPGLFRREAGAFVSARPDRHTMLLSALDSLERAPLAGAGTAARLGWWREASDAPVTAAFVGTPHLTVATALPPDAVRGLARSLLTHAHPYAGLMSDEASVRAFEAAWEKETGAAPGAGPRLRLHRLDRLVPPVGAPPGAARVATEDDRPLLRAWCDRFVAEAGSLGADLDRFVDERIAEGGWRIWSVDDEPVATAARTTVVAATARITPVYVPPPHRGRGYGAAVTAAVSRAARDAGAEHVLLFTDLSNPVSNRLYARIGYRPVADYRIVTP,brenda,D2CFQ9,NCCCCNCCCN,0.065,30.0,8.0,2.3.1.57,1931.0,-1.1870866433571443,-1.1870866433571443,NCCCCNCCCN__MAWSVTGSPGLFRREAGAFVSARPDRHTMLLSALDSLERAPLAGAGTAARLGWWREASDAPVTAAFVGTPHLTVATALPPDAVRGLARSLLTHAHPYAGLMSDEASVRAFEAAWEKETGAAPGAGPRLRLHRLDRLVPPVGAPPGAARVATEDDRPLLRAWCDRFVAEAGSLGADLDRFVDERIAEGGWRIWSVDDEPVATAARTTVVAATARITPVYVPPPHRGRGYGAAVTAAVSRAARDAGAEHVLLFTDLSNPVSNRLYARIGYRPVADYRIVTP,./data/raw/alphafold//AF-D2CFQ9-F1-model_v4.pdb,3641,1286,2027,1925 +662,22903,23257,MATKIVLVGAGSAQFGYGTLGDIFQSRALYGSEIILHDINPVALAVTEKTAKDFLAKEDLPFIVSATTDRRTALRGAEFVIISIEVGDRFALWDLDWQIPQQYGIQQVYGENGGPGGLFHSLRIIPPILDICADVADICPDAWIFNYSNPMSRICTTVHRRFPELNFVGMCHEIASLERYLPEMLNTSFDNLSLRAGGLNHFSVLLDARYKDSGKDAYADVRAKAPDYFASLPGYSDILAYTRQHGKLVDTEGSTERHALGGKDSSYPWADRTLFKEILEKFHCMPITVDSHFGEYISWAGEVSDHRGILDFYTFYRNYLGGVQPKIELKLKERVVSIMEGILTDSGYEEAAVNIPNRGFIKQLPEFIAVEVPAIIDRKGVHGIQVDIPPGIGGLLSNQIAIHDLTAEAIIAGSRDLVIQALLVDSVNNQCRAIPELVDVMISRQQPWLNYLK,sabio,Q9AI65,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.104,25.0,7.5,3.2.1.20,55212.0,-0.9829666607012196,-0.9829666607012196,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MATKIVLVGAGSAQFGYGTLGDIFQSRALYGSEIILHDINPVALAVTEKTAKDFLAKEDLPFIVSATTDRRTALRGAEFVIISIEVGDRFALWDLDWQIPQQYGIQQVYGENGGPGGLFHSLRIIPPILDICADVADICPDAWIFNYSNPMSRICTTVHRRFPELNFVGMCHEIASLERYLPEMLNTSFDNLSLRAGGLNHFSVLLDARYKDSGKDAYADVRAKAPDYFASLPGYSDILAYTRQHGKLVDTEGSTERHALGGKDSSYPWADRTLFKEILEKFHCMPITVDSHFGEYISWAGEVSDHRGILDFYTFYRNYLGGVQPKIELKLKERVVSIMEGILTDSGYEEAAVNIPNRGFIKQLPEFIAVEVPAIIDRKGVHGIQVDIPPGIGGLLSNQIAIHDLTAEAIIAGSRDLVIQALLVDSVNNQCRAIPELVDVMISRQQPWLNYLK,./data/raw/alphafold//AF-Q9AI65-F1-model_v4.pdb,4627,5750,7440,8363 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+703,24732,25121,MSNAVPAEISVQLSLALNAIERHLESTLLAVHLYGSALDGGLKPYSDIDLLVTVAAQLDETVRQALVVDLLEISASPGQSEALRALEVTIVVHGDVVPWRYPARRELQFGEWQRKDILAGIFEPATTDVDLAILLTKVRQHSLALAGSAAEDFFNPVPEGDLFKALSDTLKLWNSQPDWEGDERNVVLTLSRIWYSAATGKIAPKDIVANWAIERLPDQHKPVLLEARQAYLGRGEDCLASRADQLAAFVHFVKHEATKLLGAMPVMSKTKLGITKYSIVTNSNDSVTLRLMTEHDLAMLYEWLNRSHIVEWWGGEEARPTLADVQEQYLPSVLAQESVTPYIAMLNGEPIGYAQSYVALGSGDGWWEEETDPGVRGIDQSLANASQLGKGLGTKLVRALVELLFNDPEVTKIQTDPSPSNLRAIRCYEKAGFERQGTVTTPDGPAVYMVQTRQAFERTRSDA,brenda,Q8VQN7,NC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)O[C@@H]2CO)[C@H](N)[C@@H](O)[C@@H]1O,0.023,25.0,7.5,2.3.1.82,615.0,-1.6382721639824072,-1.5658835657887675,NC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)O[C@@H]2CO)[C@H](N)[C@@H](O)[C@@H]1O__MSNAVPAEISVQLSLALNAIERHLESTLLAVHLYGSALDGGLKPYSDIDLLVTVAAQLDETVRQALVVDLLEISASPGQSEALRALEVTIVVHGDVVPWRYPARRELQFGEWQRKDILAGIFEPATTDVDLAILLTKVRQHSLALAGSAAEDFFNPVPEGDLFKALSDTLKLWNSQPDWEGDERNVVLTLSRIWYSAATGKIAPKDIVANWAIERLPDQHKPVLLEARQAYLGRGEDCLASRADQLAAFVHFVKHEATKLLGAMPVMSKTKLGITKYSIVTNSNDSVTLRLMTEHDLAMLYEWLNRSHIVEWWGGEEARPTLADVQEQYLPSVLAQESVTPYIAMLNGEPIGYAQSYVALGSGDGWWEEETDPGVRGIDQSLANASQLGKGLGTKLVRALVELLFNDPEVTKIQTDPSPSNLRAIRCYEKAGFERQGTVTTPDGPAVYMVQTRQAFERTRSDA,./data/raw/alphafold//AF-Q8VQN7-F1-model_v4.pdb,3688,1349,2105,2008 +704,20157,20464,ILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLAIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHSLLGGVVDDQAGPGAWVRGVQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAG,uniprot_search,Q7M0F8,N=C(O)CC[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)O,66.0,25.0,8.0,2.3.2.13,10141.0,1.8195439355418688,1.0374082203225874,N=C(O)CC[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)O__ILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLAIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHSLLGGVVDDQAGPGAWVRGVQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAG,./data/raw/alphafold//AF-Q7M0F8-F1-model_v4.pdb,5300,1107,4179,1635 +705,16677,16918,MPTVCHQGPVLAGSATLATIGALTLYLGKPTSYGKHSQSVSSGPLLPARVAWFLQELPSFVVPVGMLAWQSRSLFGQPGNVLLGLFSAHYFHRTFIYSLLTRGRPFPVMLFLRAIAFCIGNGFLQAYYLIYCAEYPKEWYTDVRFSVGVFLFILGMGINIHSDYLLRQLRKPGEIIYKIPRGGLFKYVSGANFLGEITEWMGYALASWSIPAFAFAFSSLCFLGVQAFYHHHRFYLKMFKDYPKSRRALIPFIF,brenda,C7T2J8,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O,0.0019,25.0,5.5,1.3.99.5,10036.0,-2.721246399047171,-2.721246399047171,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O__MPTVCHQGPVLAGSATLATIGALTLYLGKPTSYGKHSQSVSSGPLLPARVAWFLQELPSFVVPVGMLAWQSRSLFGQPGNVLLGLFSAHYFHRTFIYSLLTRGRPFPVMLFLRAIAFCIGNGFLQAYYLIYCAEYPKEWYTDVRFSVGVFLFILGMGINIHSDYLLRQLRKPGEIIYKIPRGGLFKYVSGANFLGEITEWMGYALASWSIPAFAFAFSSLCFLGVQAFYHHHRFYLKMFKDYPKSRRALIPFIF,./data/raw/alphafold//AF-C7T2J8-F1-model_v4.pdb,19,883,5429,5777 +706,35400,36019,MRFLIMAAIRWVVLAYIVVIGCATIARGDEQPLSRIAIERATVAAVDSASVKAQPTVLGLKGQSSDWVVVEFSHPKPSNDDWIGVFSPSGFSSEICQPEYYGDLPPYLCTSPIKFQYANFNNADYNRSGKGLLRLQLINQREDFSFALFSGGLSAPKLIAISNKVSFQNPKAPVYPRLAQGKSWNEMTVTWTSGYSIKEAIPFVEWGHKGGNQMLSPAGTLTFSRNSMCGSPARTVGWRDPGYIHTSFLKELWPDSLYTYRLGHRLLDGTHIWSKSYSFRASPYPGQDSVQRVVIFGDMGKAEIDGSDEYGNYEQASLYTTNQLIKELDSIDMVIHIGDLSYANGYLSQWDQFTQQIEPIASTVPYMIGSGNHERDWPGSGSFYGHNDSGGECGVPTQTMFYVPAENRAKLWYSTDYGMFRFCIADTEQDWRPGTEQYKFIEQCLSSVDRSKQPWLIFLAHRVLGYSSASWYEIMMGSYGEPMGRDGLEELWQKYKVDLAVFGHIHSYERTCPIYQNRCVQDGSNLYTGQFNATTHVIVGGGGAMLSPFRATVPYWSFFRDYDFGFSKLTALNHSTLLFEYKKSRDGKVYDHFTISRDYRDIMACSIDNCPRTTLAV,brenda,I4DHV7,O=P(O)(O)OP(=O)(O)O,2.2,37.0,4.5,3.6.1.9,4530.0,0.3424226808222063,0.3424226808222063,O=P(O)(O)OP(=O)(O)O__MRFLIMAAIRWVVLAYIVVIGCATIARGDEQPLSRIAIERATVAAVDSASVKAQPTVLGLKGQSSDWVVVEFSHPKPSNDDWIGVFSPSGFSSEICQPEYYGDLPPYLCTSPIKFQYANFNNADYNRSGKGLLRLQLINQREDFSFALFSGGLSAPKLIAISNKVSFQNPKAPVYPRLAQGKSWNEMTVTWTSGYSIKEAIPFVEWGHKGGNQMLSPAGTLTFSRNSMCGSPARTVGWRDPGYIHTSFLKELWPDSLYTYRLGHRLLDGTHIWSKSYSFRASPYPGQDSVQRVVIFGDMGKAEIDGSDEYGNYEQASLYTTNQLIKELDSIDMVIHIGDLSYANGYLSQWDQFTQQIEPIASTVPYMIGSGNHERDWPGSGSFYGHNDSGGECGVPTQTMFYVPAENRAKLWYSTDYGMFRFCIADTEQDWRPGTEQYKFIEQCLSSVDRSKQPWLIFLAHRVLGYSSASWYEIMMGSYGEPMGRDGLEELWQKYKVDLAVFGHIHSYERTCPIYQNRCVQDGSNLYTGQFNATTHVIVGGGGAMLSPFRATVPYWSFFRDYDFGFSKLTALNHSTLLFEYKKSRDGKVYDHFTISRDYRDIMACSIDNCPRTTLAV,./data/raw/alphafold//AF-I4DHV7-F1-model_v4.pdb,978,4422,5882,3250 +707,8898,9046,MKPVWLVLNIGSSTVKFGLFDVADARPLVRGLIEGIGLQPRLKASLPDGTLELRAPADARDAKELTLWLLGLLEGRLGPLDLHAAGHRVVHGGPDYNAPVLLTPEVIERLESFSPLAPSHQPFNLAGVRAVEARWPGVPQIACFDTAFHHDRPRLARLYALPRAMAEEGILRYGFHGLSYDYIAGRLPEVLGETGRGKVIVAHLGSGASLCAMENLRSLDTTMGFSALDGLMMGTRCGQLDPGVILHFLRQGLTGPEIETILGRQSGLAGVSGISPDMRDLLASDRPEAAEAVDLFVRFILRQIGALSAGMGGLDALVFTAGIGQHAPEIRARVMEGLGWLGLEMDAAANGAGQGVISAPGSRVTAAVIATDEEAVILRALHCGEVAHYSAGVALA,brenda,Q3IYF1,CCCC(=O)O,24.5,37.0,5.7,2.7.2.18,1063.0,1.3891660843645326,1.3891660843645326,CCCC(=O)O__MKPVWLVLNIGSSTVKFGLFDVADARPLVRGLIEGIGLQPRLKASLPDGTLELRAPADARDAKELTLWLLGLLEGRLGPLDLHAAGHRVVHGGPDYNAPVLLTPEVIERLESFSPLAPSHQPFNLAGVRAVEARWPGVPQIACFDTAFHHDRPRLARLYALPRAMAEEGILRYGFHGLSYDYIAGRLPEVLGETGRGKVIVAHLGSGASLCAMENLRSLDTTMGFSALDGLMMGTRCGQLDPGVILHFLRQGLTGPEIETILGRQSGLAGVSGISPDMRDLLASDRPEAAEAVDLFVRFILRQIGALSAGMGGLDALVFTAGIGQHAPEIRARVMEGLGWLGLEMDAAANGAGQGVISAPGSRVTAAVIATDEEAVILRALHCGEVAHYSAGVALA,./data/raw/alphafold//AF-Q3IYF1-F1-model_v4.pdb,3527,1048,1252,1538 +708,17924,18184,MNKGIMRPGHVQLRVLDMSKALEHYVELLGLIEMDRDDQGRVYLKAWTEVDKFSVVLREADEPGMDFMGFKVVDEDALRQLERDLTAYGCAVEQLPAGELNSCGRRVRFQAPSGHHFELYADKEYTGKWGVNEVNPEAWPRDLKGMAAVRFDHCLLYGDELPATYDLFTKVLGFYLAEQVLDENGTRVAQFLSLSTKAHDVAFIHHPEKGRLHHVSFYLETWEDVLRAADLISMTDTSIDIGPTRHGLTHGKTIYFFDPSGNRSEVFCGGNYSYPDHKPVTWLAKDLGKAIFYHDRVLNERFMTVLT,brenda,Q83U22,Cc1cccc(O)c1O,0.0015,25.0,7.5,1.13.11.2,306.0,-2.8239087409443187,-2.659379381312206,Cc1cccc(O)c1O__MNKGIMRPGHVQLRVLDMSKALEHYVELLGLIEMDRDDQGRVYLKAWTEVDKFSVVLREADEPGMDFMGFKVVDEDALRQLERDLTAYGCAVEQLPAGELNSCGRRVRFQAPSGHHFELYADKEYTGKWGVNEVNPEAWPRDLKGMAAVRFDHCLLYGDELPATYDLFTKVLGFYLAEQVLDENGTRVAQFLSLSTKAHDVAFIHHPEKGRLHHVSFYLETWEDVLRAADLISMTDTSIDIGPTRHGLTHGKTIYFFDPSGNRSEVFCGGNYSYPDHKPVTWLAKDLGKAIFYHDRVLNERFMTVLT,./data/raw/alphafold//AF-Q83U22-F1-model_v4.pdb,911,4337,5784,6199 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+732,35312,35931,MRVGVLTGGGDCPGLNAVIRAVVRKGIEAHGWEIVGFRSGWRGPLTGDSRPLGLDDVEEILIRGGTILGSSRTNPYKEEGGVEKIRAVLADQGVDALIAIGGEDTLGVAKKLTDDGIGVVGVPKTIDNDLAATDYTFGFDTAVHIATEAIDRLRTTAESHYRAMVVEVMGRHAGWIALHAGLAGGANVILVPERPFSVEQVVEWVERRFEKMYAPIIVVAEGAVPEGGAEVLRTGEKDAFGHVQLGGVGTWLADEIAERTGKESRAVVLGHTQRGGTPTAYDRVLATRFGLHAVDAVADGDFGTMVALRGTDIVRVKLAEATAELKTVPPERYEEAEVFFG,sabio,Q59126,O=P(O)(O)OC[C@H]1O[C@](O)(COP(=O)(O)O)[C@@H](O)[C@@H]1O,0.025,37.0,7.5,2.7.1.90,1814.0,-1.6020599913279625,-1.6020599913279625,O=P(O)(O)OC[C@H]1O[C@](O)(COP(=O)(O)O)[C@@H](O)[C@@H]1O__MRVGVLTGGGDCPGLNAVIRAVVRKGIEAHGWEIVGFRSGWRGPLTGDSRPLGLDDVEEILIRGGTILGSSRTNPYKEEGGVEKIRAVLADQGVDALIAIGGEDTLGVAKKLTDDGIGVVGVPKTIDNDLAATDYTFGFDTAVHIATEAIDRLRTTAESHYRAMVVEVMGRHAGWIALHAGLAGGANVILVPERPFSVEQVVEWVERRFEKMYAPIIVVAEGAVPEGGAEVLRTGEKDAFGHVQLGGVGTWLADEIAERTGKESRAVVLGHTQRGGTPTAYDRVLATRFGLHAVDAVADGDFGTMVALRGTDIVRVKLAEATAELKTVPPERYEEAEVFFG,./data/raw/alphafold//AF-Q59126-F1-model_v4.pdb,2151,7033,8895,9149 +733,14303,14509,MAKSSENEHPIKAFGWATRHTSGVLSPFNFSRRVTGEKHVQFKVMYCGICHSDLHQLKNEWGNTKYPMVPGHEVVGVVIEVGSKVEKFKVGDKVGVGCMVGSCRKCENCTVDLENYCPRQIPTYNGYSLDGTLTFGGYSDMMVSDEHFVVRWPENLSMDAAPLLCAGITTYSPLKYFGLDKPGMHIGVVGLGGLGHMAVKFAKAFGTKVTVISTSANKKQEAIERLGADSFLISRDPEQMKAAMNTLDGIIDTVSAVHPILPLLMLMKSHGKLVMVGAPEKPVELPVFPLLMGRKLVAGSCIGGMKETQEMLDFAAKHNITPDIEVVPMDYVNTALERLLKSDVKYRFVLDIGNTLNKK,brenda,Q8H0L8,COc1ccccc1C=O,4.8,30.0,6.5,1.1.1.71,4113.0,0.6812412373755872,0.6812412373755872,COc1ccccc1C=O__MAKSSENEHPIKAFGWATRHTSGVLSPFNFSRRVTGEKHVQFKVMYCGICHSDLHQLKNEWGNTKYPMVPGHEVVGVVIEVGSKVEKFKVGDKVGVGCMVGSCRKCENCTVDLENYCPRQIPTYNGYSLDGTLTFGGYSDMMVSDEHFVVRWPENLSMDAAPLLCAGITTYSPLKYFGLDKPGMHIGVVGLGGLGHMAVKFAKAFGTKVTVISTSANKKQEAIERLGADSFLISRDPEQMKAAMNTLDGIIDTVSAVHPILPLLMLMKSHGKLVMVGAPEKPVELPVFPLLMGRKLVAGSCIGGMKETQEMLDFAAKHNITPDIEVVPMDYVNTALERLLKSDVKYRFVLDIGNTLNKK,./data/raw/alphafold//AF-Q8H0L8-F1-model_v4.pdb,143,2893,3587,4162 +734,30555,31095,MRGLSRRVQAMKPSATVAVNAKALELRRQGVDLVALTAGEPDFDTPEHVKEAARRALAQGKTKYAPPAGIPELREALAEKFRRENGLSVTPEETIVTVGGKQALFNLFQAILDPGDEVIVLSPYWVSYPEMVRFAGGVVVEVETLPEEGFVPDPERVRRAITPRTKALVVNSPNNPTGAVYPKEVLEALARLAVEHDFYLVSDEIYEHLLYEGEHFSPGRVAPEHTLTVNGAAKAFAMTGWRIGYACGPKEVIKAMASVSSQSTTSPDTIAQWATLEALTNQEASRAFVEMAREAYRRRRDLLLEGLTALGLKAVRPSGAFYVLMDTSPIAPDEVRAAERLLEAGVAVVPGTDFAAFGHVRLSYATSEENLRKALERFARVLGRA,brenda,Q56232,O=C(O)CC(=O)C(=O)O,0.0253,30.0,8.0,2.6.1.78,274.0,-1.596879478824182,-1.596879478824182,O=C(O)CC(=O)C(=O)O__MRGLSRRVQAMKPSATVAVNAKALELRRQGVDLVALTAGEPDFDTPEHVKEAARRALAQGKTKYAPPAGIPELREALAEKFRRENGLSVTPEETIVTVGGKQALFNLFQAILDPGDEVIVLSPYWVSYPEMVRFAGGVVVEVETLPEEGFVPDPERVRRAITPRTKALVVNSPNNPTGAVYPKEVLEALARLAVEHDFYLVSDEIYEHLLYEGEHFSPGRVAPEHTLTVNGAAKAFAMTGWRIGYACGPKEVIKAMASVSSQSTTSPDTIAQWATLEALTNQEASRAFVEMAREAYRRRRDLLLEGLTALGLKAVRPSGAFYVLMDTSPIAPDEVRAAERLLEAGVAVVPGTDFAAFGHVRLSYATSEENLRKALERFARVLGRA,./data/raw/alphafold//AF-Q56232-F1-model_v4.pdb,1005,6099,7886,10441 +735,16581,16822,MSSSKPSFSDYFGKLGGIPMYKKFIEQFHNVEEFEARPDDLVIVTYPKSGTTWLSEIICMIYNNGDVEKCKEDVIFNRVPYLECSTEHVMKGVKQLNEMASPRIVKSHLPVKLLPVSFWEKNCKIIYLSRNAKDVVVSYYFLILMVTAIPDPDSFQDFVEKFMDGEVPYGSWFEHTKSWWEKSKNPQVLFLFYEDMKENIRKEVMKLLEFLGRKASDELVDKIIKHTSFQEMKNNPSTNYTTLPDEVMNQKVSPFMRKGDVGDWKNHFTVALNEKFDMHYEQQMKGSTLKFRTKI,uniprot_search,P19217,C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1C[C@@H](O)[C@H]2O,0.008,37.0,8.6,2.8.2.4,9913.0,-2.096910013008056,-2.096910013008056,C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1C[C@@H](O)[C@H]2O__MSSSKPSFSDYFGKLGGIPMYKKFIEQFHNVEEFEARPDDLVIVTYPKSGTTWLSEIICMIYNNGDVEKCKEDVIFNRVPYLECSTEHVMKGVKQLNEMASPRIVKSHLPVKLLPVSFWEKNCKIIYLSRNAKDVVVSYYFLILMVTAIPDPDSFQDFVEKFMDGEVPYGSWFEHTKSWWEKSKNPQVLFLFYEDMKENIRKEVMKLLEFLGRKASDELVDKIIKHTSFQEMKNNPSTNYTTLPDEVMNQKVSPFMRKGDVGDWKNHFTVALNEKFDMHYEQQMKGSTLKFRTKI,./data/raw/alphafold//AF-P19217-F1-model_v4.pdb,4829,2101,5226,5551 +736,27208,27675,MASEKPLAAVTCTAPVNIAVIKYWGKRDEELVLPINSSLSVTLHQDQLKTTTTAVISKDFTEDRIWLNGREEDVGQPRLQACLREIRCLARKRRNSRDGDPLPSSLSCKVHVASVNNFPTAAGLASSAAGYACLAYTLARVYGVESDLSEVARRGSGSACRSLYGGFVEWQMGEQADGKDSIARQVAPESHWPELRVLILVVSAEKKLTGSTVGMRASVETSPLLRFRAESVVPARMAEMARCIRERDFPSFAQLTMKDSNQFHATCLDTFPPISYLNAISWRIIHLVHRFNAHHGDTKVAYTFDAGPNAVIFTLDDTVAEFVAAVWHGFPPGSNGDTFLKGLQVRPAPLSAELQAALAMEPTPGGVKYIIVTQVGPGPQILDDPCAHLLGPDGLPKPAA,sabio,P53602,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,0.32,25.0,7.0,4.1.1.33,9606.0,-0.494850021680094,-0.494850021680094,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MASEKPLAAVTCTAPVNIAVIKYWGKRDEELVLPINSSLSVTLHQDQLKTTTTAVISKDFTEDRIWLNGREEDVGQPRLQACLREIRCLARKRRNSRDGDPLPSSLSCKVHVASVNNFPTAAGLASSAAGYACLAYTLARVYGVESDLSEVARRGSGSACRSLYGGFVEWQMGEQADGKDSIARQVAPESHWPELRVLILVVSAEKKLTGSTVGMRASVETSPLLRFRAESVVPARMAEMARCIRERDFPSFAQLTMKDSNQFHATCLDTFPPISYLNAISWRIIHLVHRFNAHHGDTKVAYTFDAGPNAVIFTLDDTVAEFVAAVWHGFPPGSNGDTFLKGLQVRPAPLSAELQAALAMEPTPGGVKYIIVTQVGPGPQILDDPCAHLLGPDGLPKPAA,./data/raw/alphafold//AF-P53602-F1-model_v4.pdb,564,2351,2972,3436 +737,7390,7521,MLKVISSLLVYMTASVMAVASPLAHSGEPSGEYPTVNEIPVGEVRLYQIADGVWSHIATQSFDGAVYPSNGLIVRDGDELLLIDTAWGAKNTAALLAEIEKQIGLPVTRAVSTHFHDDRVGGVDVLRAAGVATYASPSTRRLAEAEGNEIPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVHELSSTSAGNVADADLAEWPTSVERIQKHYPEAEVVIPGHGLPGGLDLLQHTANVVKAHKNRSVAE,brenda,Q9XAY4,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O,1.737,37.0,7.0,3.5.2.6,287.0,0.2397998184470986,0.2397998184470986,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O__MLKVISSLLVYMTASVMAVASPLAHSGEPSGEYPTVNEIPVGEVRLYQIADGVWSHIATQSFDGAVYPSNGLIVRDGDELLLIDTAWGAKNTAALLAEIEKQIGLPVTRAVSTHFHDDRVGGVDVLRAAGVATYASPSTRRLAEAEGNEIPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVHELSSTSAGNVADADLAEWPTSVERIQKHYPEAEVVIPGHGLPGGLDLLQHTANVVKAHKNRSVAE,./data/raw/alphafold//AF-Q9XAY4-F1-model_v4.pdb,3553,1151,1857,1742 +738,13813,14012,MGSLAAEKTVTGWAARDASGHLTPYNYTLRKTGPEDVVVKVLYCGICHTDIHQAKNHLGASKYPMVPGHEVVGEVVEVGPEVTKYSAGDVVGVGVIVGCCRECHPCKANVEQYCNKRIWSYNDVYTDGRPTQGGFASAMVVDQKFVVKIPAGLAPEQAAPLLCAGLTVYSPLKHFGLMSPGLRGGVLGLGGVGHMGVKVAKSMGHHVTVISSSARKRGEAMDDLGADAYLVSSDAAAMAAAGDSLDYIIDTVPVHHPLEPYLALLKLDGKLILMGVINQPLSFISPMVMLGRKAITGSFIGSMAETEEVLNFCVDKGLTSQIEVVKMDYVNQALERLERNDVRYRFVVDVAGSNIDDADAPPA,sabio,Q6ZHS4,COc1cc(C=CC=O)cc(OC)c1O,0.0208,30.0,8.8,1.1.1.195,4530.0,-1.6819366650372385,-1.6819366650372385,COc1cc(C=CC=O)cc(OC)c1O__MGSLAAEKTVTGWAARDASGHLTPYNYTLRKTGPEDVVVKVLYCGICHTDIHQAKNHLGASKYPMVPGHEVVGEVVEVGPEVTKYSAGDVVGVGVIVGCCRECHPCKANVEQYCNKRIWSYNDVYTDGRPTQGGFASAMVVDQKFVVKIPAGLAPEQAAPLLCAGLTVYSPLKHFGLMSPGLRGGVLGLGGVGHMGVKVAKSMGHHVTVISSSARKRGEAMDDLGADAYLVSSDAAAMAAAGDSLDYIIDTVPVHHPLEPYLALLKLDGKLILMGVINQPLSFISPMVMLGRKAITGSFIGSMAETEEVLNFCVDKGLTSQIEVVKMDYVNQALERLERNDVRYRFVVDVAGSNIDDADAPPA,./data/raw/alphafold//AF-Q6ZHS4-F1-model_v4.pdb,143,3528,4816,5092 +739,25930,26369,MATIIGNGHQNGSLEGLCITRDPLSWGVAAESMKGSHLDEVKKMVSEYRKPLVKLGGETLTVAQVAAIASHDAGVKVELAESARAGVKASSDWVMDSMNKGTDSYGVTTGFGATSHRRTKQGAALQRELIRFLNAGIFGNGTETCHTLPHSATRAAMLVRINTLLQGYSGIRFEILEAITKLLNHNITPCLPLRGTITASGDLVPLSYIAGLLTGRPNSKAIGPSGESLDAVEAFRLADIDSGFFELQPKEGLALVNGTAVGSGLASMVLFEANVLAVLSEILSAIFAEVMNGKPEFTDHLTHKLKHHPGQIEAAAIMEHILDGSSYIKAAKQLHEIDPLQKPKQDRYALRTSPQWLGPQIEVIRFSTKSIEREINSVNDNPLIDVSRNKALHGGNFQGTPIGVSMDNARLAIASIGKLMFAQFSELVNDFYNNGLPSNLSGGRNPSLDYGFKGAEIAMASYCSELQFLANPVTSHVQSAEQHNQDVNSLGLISSRKTQEAIDILKLMSSTFLVALCQAIDLRHLEENLKHAVKNTVTQVAKRVLTTGANGELHPSRFCGKDLLKVVDREQVFAYIDDPCSATYPLMQKLRQVLVEHALANGENEKNASTSVFQKIGAFEEELKTLLPKEVESAREAYESGSAAIGNKIKECRSYPLYKFVREELGSGLLTGEKVRSPGEEFDKVFTAMCEGKIIDPMMECLKEWNGAPLPIC,brenda,Q0GA81,N[C@@H](Cc1ccccc1)C(=O)O,0.125,37.0,8.7,4.3.1.24,180498.0,-0.9030899869919436,-0.9030899869919436,N[C@@H](Cc1ccccc1)C(=O)O__MATIIGNGHQNGSLEGLCITRDPLSWGVAAESMKGSHLDEVKKMVSEYRKPLVKLGGETLTVAQVAAIASHDAGVKVELAESARAGVKASSDWVMDSMNKGTDSYGVTTGFGATSHRRTKQGAALQRELIRFLNAGIFGNGTETCHTLPHSATRAAMLVRINTLLQGYSGIRFEILEAITKLLNHNITPCLPLRGTITASGDLVPLSYIAGLLTGRPNSKAIGPSGESLDAVEAFRLADIDSGFFELQPKEGLALVNGTAVGSGLASMVLFEANVLAVLSEILSAIFAEVMNGKPEFTDHLTHKLKHHPGQIEAAAIMEHILDGSSYIKAAKQLHEIDPLQKPKQDRYALRTSPQWLGPQIEVIRFSTKSIEREINSVNDNPLIDVSRNKALHGGNFQGTPIGVSMDNARLAIASIGKLMFAQFSELVNDFYNNGLPSNLSGGRNPSLDYGFKGAEIAMASYCSELQFLANPVTSHVQSAEQHNQDVNSLGLISSRKTQEAIDILKLMSSTFLVALCQAIDLRHLEENLKHAVKNTVTQVAKRVLTTGANGELHPSRFCGKDLLKVVDREQVFAYIDDPCSATYPLMQKLRQVLVEHALANGENEKNASTSVFQKIGAFEEELKTLLPKEVESAREAYESGSAAIGNKIKECRSYPLYKFVREELGSGLLTGEKVRSPGEEFDKVFTAMCEGKIIDPMMECLKEWNGAPLPIC,./data/raw/alphafold//AF-Q0GA81-F1-model_v4.pdb,4737,5922,8159,12124 +740,30249,30786,MTAPSQVLKIRRPDDWHLHLRDGDMLKTVVPYTSEIYGRAIVMPNLAPPVTTVEAAVAYRQRILDAVPAGHDFTPLMTCYLTDSLDPNELERGFNEGVFTAAKLYPANATTNSSHGVTSIDAIMPVLERMEKIGMPLLVHGEVTHADIDIFDREARFIESVMEPLRQRLTALKVVFEHITTKDAADYVRDGNERLAATITPQHLMFNRNHMLVGGVRPHLYCLPILKRNIHQQALRELVASGFNRVFLGTDSAPHARHRKESSCGCAGCFNAPTALGSYATVFEEMNALQHFEAFCSVNGPQFYGLPVNDTFIELVREEQQVAESIALTDDTLVPFLAGETVRWSVKQ,brenda,P05020,O=C(O)C1CC(O)=NC(O)=N1,0.23,30.0,7.5,3.5.2.3,562.0,-0.6382721639824072,-0.6300280456587356,O=C(O)C1CC(O)=NC(O)=N1__MTAPSQVLKIRRPDDWHLHLRDGDMLKTVVPYTSEIYGRAIVMPNLAPPVTTVEAAVAYRQRILDAVPAGHDFTPLMTCYLTDSLDPNELERGFNEGVFTAAKLYPANATTNSSHGVTSIDAIMPVLERMEKIGMPLLVHGEVTHADIDIFDREARFIESVMEPLRQRLTALKVVFEHITTKDAADYVRDGNERLAATITPQHLMFNRNHMLVGGVRPHLYCLPILKRNIHQQALRELVASGFNRVFLGTDSAPHARHRKESSCGCAGCFNAPTALGSYATVFEEMNALQHFEAFCSVNGPQFYGLPVNDTFIELVREEQQVAESIALTDDTLVPFLAGETVRWSVKQ,./data/raw/alphafold//AF-P05020-F1-model_v4.pdb,1897,7371,9332,7048 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+771,26953,27416,MAEEVSSLMKATVLMRQPGRVQEIVSALRRGGGDRLQVISDFDMTLSRFAYNGQRCPSSHNILDNSKIISEDCRKELTELFHHYYPIEIDPHRTIKEKLPHMVQWWSKAHSLLCQQRIQKFQIAQVVGESTAMLREGYKMFFDTLYHNNIPLFIFSAGIGDILEEIIRQMKVFHPNIHIVSNYMDFSEDGFLKGFKGQLIHTYNKNSSVCENSSYFQQLRNKTNIILLGDSIGDLTMADGVPGVQNILKIGFLNDKVEERRERYMDSYDIVLEKDETLDVVNGLLQHILRQGDCVELQGS,sabio,Q6AYP7,Nc1ncnc2c1ncn2C1CC(O)C(COP(=O)(O)O)O1,35.0,37.0,6.5,3.1.3.5,10116.0,1.5440680443502757,1.5440680443502757,Nc1ncnc2c1ncn2C1CC(O)C(COP(=O)(O)O)O1__MAEEVSSLMKATVLMRQPGRVQEIVSALRRGGGDRLQVISDFDMTLSRFAYNGQRCPSSHNILDNSKIISEDCRKELTELFHHYYPIEIDPHRTIKEKLPHMVQWWSKAHSLLCQQRIQKFQIAQVVGESTAMLREGYKMFFDTLYHNNIPLFIFSAGIGDILEEIIRQMKVFHPNIHIVSNYMDFSEDGFLKGFKGQLIHTYNKNSSVCENSSYFQQLRNKTNIILLGDSIGDLTMADGVPGVQNILKIGFLNDKVEERRERYMDSYDIVLEKDETLDVVNGLLQHILRQGDCVELQGS,./data/raw/alphafold//AF-Q6AYP7-F1-model_v4.pdb,804,4367,5819,6239 +772,8563,8703,MCTAGKDITCKAAVAWEPHKPLSLETITVAPPKAHEVRIKILASGICGSDSSVLKEIIPSKFPVILGHEAVGVVESIGAGVTCVKPGDKVIPLFVPQCGSCRACKSSNSNFCEKNDMGAKTGLMADMTSRFTCRGKPIYNLVGTSTFTEYTVVADIAVAKIDPKAPLESCLIGCGFATGYGAAVNTAKVTPGSTCAVFGLGGVGFSAIVGCKAAGASRIIGVGTHKDKFPKAIELGATECLNPKDYDKPIYEVICEKTNGGVDYAVECAGRIETMMNALQSTYCGSGVTVVLGLASPNERLPLDPLLLLTGRSLKGSVFGGFKGEEVSRLVDDYMKKKINVNFLVSTKLTLDQINKAFELLSSGQGVRSIMIY,uniprot_search,O57380,CCC(C)O,170.0,20.0,7.4,1.1.1.2,8403.0,2.230448921378274,2.230448921378274,CCC(C)O__MCTAGKDITCKAAVAWEPHKPLSLETITVAPPKAHEVRIKILASGICGSDSSVLKEIIPSKFPVILGHEAVGVVESIGAGVTCVKPGDKVIPLFVPQCGSCRACKSSNSNFCEKNDMGAKTGLMADMTSRFTCRGKPIYNLVGTSTFTEYTVVADIAVAKIDPKAPLESCLIGCGFATGYGAAVNTAKVTPGSTCAVFGLGGVGFSAIVGCKAAGASRIIGVGTHKDKFPKAIELGATECLNPKDYDKPIYEVICEKTNGGVDYAVECAGRIETMMNALQSTYCGSGVTVVLGLASPNERLPLDPLLLLTGRSLKGSVFGGFKGEEVSRLVDDYMKKKINVNFLVSTKLTLDQINKAFELLSSGQGVRSIMIY,./data/raw/alphafold//AF-O57380-F1-model_v4.pdb,5403,2730,3403,3935 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+774,24872,25261,MDPKLGRMAASLLAVLLLLLERGMFSSPSPPPALLEKVFQYIDLHQDEFVQTLKEWVAIESDSVQPVPRFRQELFRMMAVAADTLQRLGARVASVDMGPQQLPDGQSLPIPPVILAELGSDPTKGTVCFYGHLDVQPADRGDGWLTDPYVLTEVDGKLYGRGATDNKGPVLAWINAVSAFRALEQDLPVNIKFIIEGMEEAGSVALEELVEKEKDRFFSGVDYIVISDNLWISQRKPAITYGTRGNSYFMVEVKCRDQDFHSGTFGGILHEPMADLVALLGSLVDSSGHILVPGIYDEVVPLTEEEINTYKAIHLDLEEYRNSSRVEKFLFDTKEEILMHLWRYPSLSIHGIEGAFDEPGTKTVIPGRVIGKFSIRLVPHMNVSAVEKQVTRHLEDVFSKRNSSNKMVVSMTLGLHPWIANIDDTQYLAAKRAIRTVFGTEPDMIRDGSTIPIAKMFQEIVHKSVVLIPLGAVDDGEHSQNEKINRWNYIEGTKLFAAFFLEMAQLH,uniprot_search,Q96KN2,N[C@@H](CC(=O)O)C(=O)Nc1ccc([N+](=O)[O-])cc1,4.3,30.0,7.15,3.4.13.21,90371.0,0.6334684555795865,0.6166757638266371,N[C@@H](CC(=O)O)C(=O)Nc1ccc([N+](=O)[O-])cc1__MDPKLGRMAASLLAVLLLLLERGMFSSPSPPPALLEKVFQYIDLHQDEFVQTLKEWVAIESDSVQPVPRFRQELFRMMAVAADTLQRLGARVASVDMGPQQLPDGQSLPIPPVILAELGSDPTKGTVCFYGHLDVQPADRGDGWLTDPYVLTEVDGKLYGRGATDNKGPVLAWINAVSAFRALEQDLPVNIKFIIEGMEEAGSVALEELVEKEKDRFFSGVDYIVISDNLWISQRKPAITYGTRGNSYFMVEVKCRDQDFHSGTFGGILHEPMADLVALLGSLVDSSGHILVPGIYDEVVPLTEEEINTYKAIHLDLEEYRNSSRVEKFLFDTKEEILMHLWRYPSLSIHGIEGAFDEPGTKTVIPGRVIGKFSIRLVPHMNVSAVEKQVTRHLEDVFSKRNSSNKMVVSMTLGLHPWIANIDDTQYLAAKRAIRTVFGTEPDMIRDGSTIPIAKMFQEIVHKSVVLIPLGAVDDGEHSQNEKINRWNYIEGTKLFAAFFLEMAQLH,./data/raw/alphafold//AF-Q96KN2-F1-model_v4.pdb,4717,5978,7731,8715 +775,26109,26551,MTNEKVWIEKLDNPTLSVLPHDFLRPQQEPYTKQATYSLQLPQLDVPHDSFSNKYAVALSVWAALIYRVTGDDDIVLYIANNKILRFNIQPTWSFNELYSTINNELNKLNSIEANFSFDELAEKIQSCQDLERTPQLFRLAFLENQDFKLDEFKHHLVDFALNLDTSNNAHVLNLIYNSLLYSNERVTIVADQFTQYLTAALSDPSNCITKISLITASSKDSLPDPTKNLGWCDFVGCIHDIFQDNAEAFPERTCVVETPTLNSDKSRSFTYRDINRTSNIVAHYLIKTGIKRGDVVMIYSSRGVDLMVCVMGVLKAGATFSVIDPAYPPARQTIYLGVAKPRGLIVIRAAGQLDQLVEDYINDELEIVSRINSIAIQENGTIEGGKLDNGEDVLAPYDHYKDTRTGVVVGPDSNPTLSFTSGSEGIPKGVLGRHFSLAYYFNWMSKRFNLTENDKFTMLSGIAHDPIQRDMFTPLFLGAQLYVPTQDDIGTPGRLAEWMSKYGCTVTHLTPAMGQLLTAQATTPFPKLHHAFFVGDILTKRDCLRLQTLAENCRIVNMYGTTETQRAVSYFEVKSKNDDPNFLKKLKDVMPAGKGMLNVQLLVVNRNDRTQICGIGEIGEIYVRAGGLAEGYRGLPELNKEKFVNNWFVEKDHWNYLDKDNGEPWRQFWLGPRDRLYRTGDLGRYLPNGDCECCGRADDQVKIRGFRIELGEIDTHISQHPLVRENITLVRKNADNEPTLITFMVPRFDKPDDLSKFQSDVPKEVETDPIVKGLIGYHLLSKDIRTFLKKRLASYAMPSLIVVMDKLPLNPNGKVDKPKLQFPTPKQLNLVAENTVSETDDSQFTNVEREVRDLWLSILPTKPASVSPDDSFFDLGGHSILATKMIFTLKKKLQVDLPLGTIFKYPTIKAFAAEIDRIKSSGGSSQGEVVENVTANYAEDAKKLVETLPSSYPSREYFVEPNSAEGKTTINVFVTGVTGFLGSYILADLLGRSPKNYSFKVFAHVRAKDEEAAFARLQKAGITYGTWNEKFASNIKVVLGDLSKSQFGLSDEKWMDLANTVDIIIHNGALVHWVYPYAKLRDPNVISTINVMSLAAVGKPKFFDFVSSTSTLDTEYYFNLSDKLVSEGKPGILESDDLMNSASGLTGGYGQSKWAAEYIIRRAGERGLRGCIVRPGYVTGASANGSSNTDDFLLRFLKGSVQLGKIPDIENSVNMVPVDHVARVVVATSLNPPKENELAVAQVTGHPRILFKDYLYTLHDYGYDVEIESYSKWKKSLEASVIDRNEENALYPLLHMVLDNLPESTKAPELDDRNAVASLKKDTAWTGVDWSNGIGVTPEEVGIYIAFLNKVGFLPPPTHNDKLPLPSIELTQAQISLVASGAGARGSSAAA,brenda,P07702,N[C@H](CCCC(=O)O)C(=O)O,2.7,37.0,8.8,1.2.1.95,4932.0,0.4313637641589873,0.4313637641589873,N[C@H](CCCC(=O)O)C(=O)O__MTNEKVWIEKLDNPTLSVLPHDFLRPQQEPYTKQATYSLQLPQLDVPHDSFSNKYAVALSVWAALIYRVTGDDDIVLYIANNKILRFNIQPTWSFNELYSTINNELNKLNSIEANFSFDELAEKIQSCQDLERTPQLFRLAFLENQDFKLDEFKHHLVDFALNLDTSNNAHVLNLIYNSLLYSNERVTIVADQFTQYLTAALSDPSNCITKISLITASSKDSLPDPTKNLGWCDFVGCIHDIFQDNAEAFPERTCVVETPTLNSDKSRSFTYRDINRTSNIVAHYLIKTGIKRGDVVMIYSSRGVDLMVCVMGVLKAGATFSVIDPAYPPARQTIYLGVAKPRGLIVIRAAGQLDQLVEDYINDELEIVSRINSIAIQENGTIEGGKLDNGEDVLAPYDHYKDTRTGVVVGPDSNPTLSFTSGSEGIPKGVLGRHFSLAYYFNWMSKRFNLTENDKFTMLSGIAHDPIQRDMFTPLFLGAQLYVPTQDDIGTPGRLAEWMSKYGCTVTHLTPAMGQLLTAQATTPFPKLHHAFFVGDILTKRDCLRLQTLAENCRIVNMYGTTETQRAVSYFEVKSKNDDPNFLKKLKDVMPAGKGMLNVQLLVVNRNDRTQICGIGEIGEIYVRAGGLAEGYRGLPELNKEKFVNNWFVEKDHWNYLDKDNGEPWRQFWLGPRDRLYRTGDLGRYLPNGDCECCGRADDQVKIRGFRIELGEIDTHISQHPLVRENITLVRKNADNEPTLITFMVPRFDKPDDLSKFQSDVPKEVETDPIVKGLIGYHLLSKDIRTFLKKRLASYAMPSLIVVMDKLPLNPNGKVDKPKLQFPTPKQLNLVAENTVSETDDSQFTNVEREVRDLWLSILPTKPASVSPDDSFFDLGGHSILATKMIFTLKKKLQVDLPLGTIFKYPTIKAFAAEIDRIKSSGGSSQGEVVENVTANYAEDAKKLVETLPSSYPSREYFVEPNSAEGKTTINVFVTGVTGFLGSYILADLLGRSPKNYSFKVFAHVRAKDEEAAFARLQKAGITYGTWNEKFASNIKVVLGDLSKSQFGLSDEKWMDLANTVDIIIHNGALVHWVYPYAKLRDPNVISTINVMSLAAVGKPKFFDFVSSTSTLDTEYYFNLSDKLVSEGKPGILESDDLMNSASGLTGGYGQSKWAAEYIIRRAGERGLRGCIVRPGYVTGASANGSSNTDDFLLRFLKGSVQLGKIPDIENSVNMVPVDHVARVVVATSLNPPKENELAVAQVTGHPRILFKDYLYTLHDYGYDVEIESYSKWKKSLEASVIDRNEENALYPLLHMVLDNLPESTKAPELDDRNAVASLKKDTAWTGVDWSNGIGVTPEEVGIYIAFLNKVGFLPPPTHNDKLPLPSIELTQAQISLVASGAGARGSSAAA,./data/raw/alphafold//AF-P07702-F1-model_v4.pdb,3006,214,236,271 +776,35471,36093,MSKMRIGVLTGGGDCPGLNPAIRGIVMRALDYGDEVIGLKYGWAGLLKADTMPLSLEMVEDILEIGGTILGSSRTNPFKKEEDVQKCVENFKKLNLDALIAIGGEDTLGVASKFSKLGLPMIGVPKTIDKDLEETDYTLGFDTAVEVVVDAIKRLRDTARSHARVIVVEIMGRHAGWLALYGGLAGGADYILIPEVEPNLEDLYNHIRKLYARGRNHAVVAIAEGVQLPGFTYQKGQEGMVDAFGHIRLGGVGNVLAEEIQKNLGIETRAVILSHLQRGGSPSIRDRIMGLLLGKKAVDLVHEGKSGLFVAVKGNELVPVDITLIEGKTKNVDPAFYESVKTFFNK,sabio,Q9KH71,O=P(O)(O)OP(=O)(O)OP(=O)(O)O,0.22,50.0,6.0,2.7.1.90,14.0,-0.6575773191777937,-0.6575773191777937,O=P(O)(O)OP(=O)(O)OP(=O)(O)O__MSKMRIGVLTGGGDCPGLNPAIRGIVMRALDYGDEVIGLKYGWAGLLKADTMPLSLEMVEDILEIGGTILGSSRTNPFKKEEDVQKCVENFKKLNLDALIAIGGEDTLGVASKFSKLGLPMIGVPKTIDKDLEETDYTLGFDTAVEVVVDAIKRLRDTARSHARVIVVEIMGRHAGWLALYGGLAGGADYILIPEVEPNLEDLYNHIRKLYARGRNHAVVAIAEGVQLPGFTYQKGQEGMVDAFGHIRLGGVGNVLAEEIQKNLGIETRAVILSHLQRGGSPSIRDRIMGLLLGKKAVDLVHEGKSGLFVAVKGNELVPVDITLIEGKTKNVDPAFYESVKTFFNK,./data/raw/alphafold//AF-Q9KH71-F1-model_v4.pdb,2151,7615,9380,10485 +777,4353,4422,MELARNDQTEAALRGEANVWKSINGIADFMVMKCALELRIPDIVHSHSAPITLAQIASSVPDSPSLNLSYLSRIMRLLVRRKIFSQHKSLDGEEVLYGPTHSSRLLLSKTTLPDQVTLAPFVAFMTHPYLSAPWSCLARCVKEGGNGFEMVHGGRQLWDLSPGNPEFNKVFNDGMASTARITTMAILSEYRDVFCGICSLVDVGGEFGGSISAIVKSHPHIKGINYDLPHVVATAPTYTGLVSHVGGNMFEWIPTAVAVFMKWILHDWADEDCVKILKNCRRAMPEKGGKIIIVDIVLEPEGNGLFDDAAVMLDIALMALTRGKERTEKEWKRVLEEGGFPRYQILKIPALTSVIEAYPQ,brenda,B0ZB56,CC(C)=CCc1c(O)cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c1O,0.023,30.0,7.5,2.1.1.339,3486.0,-1.6382721639824072,-1.6382721639824072,CC(C)=CCc1c(O)cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c1O__MELARNDQTEAALRGEANVWKSINGIADFMVMKCALELRIPDIVHSHSAPITLAQIASSVPDSPSLNLSYLSRIMRLLVRRKIFSQHKSLDGEEVLYGPTHSSRLLLSKTTLPDQVTLAPFVAFMTHPYLSAPWSCLARCVKEGGNGFEMVHGGRQLWDLSPGNPEFNKVFNDGMASTARITTMAILSEYRDVFCGICSLVDVGGEFGGSISAIVKSHPHIKGINYDLPHVVATAPTYTGLVSHVGGNMFEWIPTAVAVFMKWILHDWADEDCVKILKNCRRAMPEKGGKIIIVDIVLEPEGNGLFDDAAVMLDIALMALTRGKERTEKEWKRVLEEGGFPRYQILKIPALTSVIEAYPQ,./data/raw/alphafold//AF-B0ZB56-F1-model_v4.pdb,5031,1852,2743,2759 +778,38916,39605,MMIIVGVDAGGTKTKAVAYDCEGNFIGEGSSGPGNYHNVGLTRAIENIKEAVKIAAKGEADVVGMGVAGLDSKFDWENFTPLASLIAPKVIIQHDGVIALFAETLGEPGVVVIAGTGSVVEGYNGKEFLRVGGRGWLLSDDGSAYWVGRKALRKVLKMMDGLENKTILYNKVLKTINVKDLDELVMWSYTSSCQIDLVASIAKAVDEAANEGDTVAMDILKQGAELLASQAVYLARKIGTNKVYLKGGMFRSNIYHKFFTLYLEKEGIISDLGKRSPEIGAVILAYKEVGCDIKKLISD,brenda,Q96Y14,OC[C@H]1O[C@@H](O)C[C@@H](O)[C@@H]1O,0.44,50.0,7.5,2.7.1.1,111955.0,-0.3565473235138126,-0.3565473235138126,OC[C@H]1O[C@@H](O)C[C@@H](O)[C@@H]1O__MMIIVGVDAGGTKTKAVAYDCEGNFIGEGSSGPGNYHNVGLTRAIENIKEAVKIAAKGEADVVGMGVAGLDSKFDWENFTPLASLIAPKVIIQHDGVIALFAETLGEPGVVVIAGTGSVVEGYNGKEFLRVGGRGWLLSDDGSAYWVGRKALRKVLKMMDGLENKTILYNKVLKTINVKDLDELVMWSYTSSCQIDLVASIAKAVDEAANEGDTVAMDILKQGAELLASQAVYLARKIGTNKVYLKGGMFRSNIYHKFFTLYLEKEGIISDLGKRSPEIGAVILAYKEVGCDIKKLISD,./data/raw/alphafold//AF-Q96Y14-F1-model_v4.pdb,3488,997,1194,1470 +779,4694,4767,MSLLIRGATVITYDERYRADVLCAGGLIRAIGTGLDVPAGTEVLDGSGQYLMPGGIDPHTHMQLPFMGTVASEDFFSGTAAGLAGGTTSIIDFVIPNPQQSLMEAFHQWRGWAEKSASDYGFHVAITWWSEQVREEMAELVSHHGINSFKHFMAYKNAIMAADDTLVASFERCLELGAVPTVHAENGELVYHLQRKLMAQGITGPEAHPLSRPSQVEGEAASRAIRIAETIGTPLYLVHVSTKEALDEITYARGKGQPVYGEVLAGHLLLDDSVYQHPDWHTAAGYVMSPPFRPRGHQEALWHGLQSGNLHTTATDHCCFCAEQKAAGRDDFSKIPNGTAGIEDRMALLWHEGVNTGRLSMQEFVALTSTNTAKIFNLYPRKGAIRVGADADLVLWDPEGTRTISAKTHHQKVDFNIFEGKTVRGVPSHTISQGKLVWADGDLRAERGAGRYVERPAYPSVFEQLSKRAEHSRPTAVKR,brenda,S5MPT0,CC(C)CC1N=C(O)N=C1O,4.42,45.0,9.0,3.5.2.2,294.0,0.6454222693490919,0.6454222693490919,CC(C)CC1N=C(O)N=C1O__MSLLIRGATVITYDERYRADVLCAGGLIRAIGTGLDVPAGTEVLDGSGQYLMPGGIDPHTHMQLPFMGTVASEDFFSGTAAGLAGGTTSIIDFVIPNPQQSLMEAFHQWRGWAEKSASDYGFHVAITWWSEQVREEMAELVSHHGINSFKHFMAYKNAIMAADDTLVASFERCLELGAVPTVHAENGELVYHLQRKLMAQGITGPEAHPLSRPSQVEGEAASRAIRIAETIGTPLYLVHVSTKEALDEITYARGKGQPVYGEVLAGHLLLDDSVYQHPDWHTAAGYVMSPPFRPRGHQEALWHGLQSGNLHTTATDHCCFCAEQKAAGRDDFSKIPNGTAGIEDRMALLWHEGVNTGRLSMQEFVALTSTNTAKIFNLYPRKGAIRVGADADLVLWDPEGTRTISAKTHHQKVDFNIFEGKTVRGVPSHTISQGKLVWADGDLRAERGAGRYVERPAYPSVFEQLSKRAEHSRPTAVKR,./data/raw/alphafold//AF-S5MPT0-F1-model_v4.pdb,2596,2956,3666,2829 +780,22886,23239,MAIATIDPTTGITLKTFDAHTPEEVENRIARAEAAFRSLQNTSFEERARWMHKAADILESEADEVARLIATEMGKTLTTAKYEALKSATGMRHFADHAQRYLSPETPVPASEVNASNLHVQFDPLGVVLAVMPWNYPLWQAVRFAAPALMAGNTGLLKHASNVPQCALYLGDLFARGGFPEGAFQTLLVEGKDVIPLVDDARIRAVTLTGSVAAGSAIAEAAGRNIKRSVLELGGMDVFIVMPSADIEKAAAQAVIARLQNSGQSCIAAKRFYVHEDVYDRFEHLFVTGMAEAVAGDPLDESTSFGPLATERGRQDVHELVRDAREKGAAVQCGGEIPEGEGWYYPATVLTGVTEDMRIYREECFGPVACLYKVSSLQEAIALSNDSDFGLSSSVWTNDETEATEAARSIEAGGVFINGLTASFPAVPFGGLKDSGYGRELSAYGIREFVNIKTVWTS,sabio,Q8GAK7,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,1.26,28.0,8.4,1.2.1.3,29320.0,0.1003705451175629,0.1003705451175629,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MAIATIDPTTGITLKTFDAHTPEEVENRIARAEAAFRSLQNTSFEERARWMHKAADILESEADEVARLIATEMGKTLTTAKYEALKSATGMRHFADHAQRYLSPETPVPASEVNASNLHVQFDPLGVVLAVMPWNYPLWQAVRFAAPALMAGNTGLLKHASNVPQCALYLGDLFARGGFPEGAFQTLLVEGKDVIPLVDDARIRAVTLTGSVAAGSAIAEAAGRNIKRSVLELGGMDVFIVMPSADIEKAAAQAVIARLQNSGQSCIAAKRFYVHEDVYDRFEHLFVTGMAEAVAGDPLDESTSFGPLATERGRQDVHELVRDAREKGAAVQCGGEIPEGEGWYYPATVLTGVTEDMRIYREECFGPVACLYKVSSLQEAIALSNDSDFGLSSSVWTNDETEATEAARSIEAGGVFINGLTASFPAVPFGGLKDSGYGRELSAYGIREFVNIKTVWTS,./data/raw/alphafold//AF-Q8GAK7-F1-model_v4.pdb,4347,668,786,957 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+783,33100,33692,MELITNVSEYEQLAKQKLPKMIYDYYASGAEDQWTLKENREAFSRILFRPRILIDVSRINMATNVLGFNISMPIMIAPSAMQKMAHPEGELATARAASAAGTIMTLSSWSTSSVEEVNSAAPGIRFFQLYVYKDRNIVRQLVRRAELAGFKAIALTVDTPRLGRREADIKNRFNLPPHLVLKNFEALDLGKMDKTNDSGLASYVASQVDRSLSWTDVKWLQTITSLPILVKGVMTAEDTRLAVESGAAGIIVSNHGARQLDYVPATISCLEEVVREAKGRLPVFLDGGVRRGTDVFKALALGASGVFIGRPVLFSLAVDGEAGVRKVLQMLRDELELTMALSGCTSLAEITRNHVITDSDRIRRSRL,brenda,Q7FAS1,O=CC(=O)O,1.78,30.0,7.8,1.1.3.15,39947.0,0.250420002308894,0.250420002308894,O=CC(=O)O__MELITNVSEYEQLAKQKLPKMIYDYYASGAEDQWTLKENREAFSRILFRPRILIDVSRINMATNVLGFNISMPIMIAPSAMQKMAHPEGELATARAASAAGTIMTLSSWSTSSVEEVNSAAPGIRFFQLYVYKDRNIVRQLVRRAELAGFKAIALTVDTPRLGRREADIKNRFNLPPHLVLKNFEALDLGKMDKTNDSGLASYVASQVDRSLSWTDVKWLQTITSLPILVKGVMTAEDTRLAVESGAAGIIVSNHGARQLDYVPATISCLEEVVREAKGRLPVFLDGGVRRGTDVFKALALGASGVFIGRPVLFSLAVDGEAGVRKVLQMLRDELELTMALSGCTSLAEITRNHVITDSDRIRRSRL,./data/raw/alphafold//AF-Q7FAS1-F1-model_v4.pdb,1895,3953,5338,5677 +784,34866,35478,MKKFSVVIAGGGSTFTPGIVLMLLANQDRFPLRSLKFYDNDGARQETIAEACKVILKEQAPEIEFSYTTDPQAAFTDVDFVMAHIRVGKYPMREQDEKIPLRHGVLGQETCGPGGIAYGMRSIGGVLELVDYMEKYSPNAWMLNYSNPAAIVAEATRRLRPNAKILNICDMPIGIEGRMAQIVGLKDRKQMRVRYYGLNHFGWWTSIEDLDGNDLMPKLREYVAKYGYVPPSNDPHTEASWNDTFAKAKDVQALDPQTMPNTYLKYYLFPDYVVAHSNPERTRANEVMDHREKNVFSACRAIIAAGKSTAGDLEIDEHASYIVDLATAIAFNTQERMLLIVPNNGAIHNFDADAMVEIPCLVGHNGPEPLTVGDIPHFQKGLMSQQVAVEKLVVDAWEQRSYHKLWQAITLSKTVPSASVAKAILDDLIAANKDYWPELH,sabio,Q9AGA6,O=P(O)(O)OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O,3.08,,7.5,3.2.1.122,573.0,0.4885507165004443,0.4885507165004443,O=P(O)(O)OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O__MKKFSVVIAGGGSTFTPGIVLMLLANQDRFPLRSLKFYDNDGARQETIAEACKVILKEQAPEIEFSYTTDPQAAFTDVDFVMAHIRVGKYPMREQDEKIPLRHGVLGQETCGPGGIAYGMRSIGGVLELVDYMEKYSPNAWMLNYSNPAAIVAEATRRLRPNAKILNICDMPIGIEGRMAQIVGLKDRKQMRVRYYGLNHFGWWTSIEDLDGNDLMPKLREYVAKYGYVPPSNDPHTEASWNDTFAKAKDVQALDPQTMPNTYLKYYLFPDYVVAHSNPERTRANEVMDHREKNVFSACRAIIAAGKSTAGDLEIDEHASYIVDLATAIAFNTQERMLLIVPNNGAIHNFDADAMVEIPCLVGHNGPEPLTVGDIPHFQKGLMSQQVAVEKLVVDAWEQRSYHKLWQAITLSKTVPSASVAKAILDDLIAANKDYWPELH,./data/raw/alphafold//AF-Q9AGA6-F1-model_v4.pdb,2231,7737,9526,10663 +785,34292,34893,MSPQTETKASVGFQAGVKDYKLTYYTPEYETKDTDILAAFRVTPQPGVPPEEAGAAVAAESSTGTWTTVWTDGLTSLDRYKGRCYHIEPVAGEDNQWICYVAYPLDLFEEGSVTNMFTSIVGNVFGFKALRALRLEDLRIPVAYAKTFQGPPHGIQVERDKLNKYGRPLLGCTIKPKLGLSAKNYGRACYECLRGGLDFTKDDENVNSQPFMRWRDRFVFCAEAIYKAQAETGEIKGHYLNATAGTCEEMMKRAIFARELGVPIVMHDYITGGFTANTSLAHYCRDNGLLLHIHRAMHAVIDRQKNHGMHFRVLAKALRMSGGDHIHAGTVVGKLEGEREMTLGFVDLLRDDFIEKDRARGIFFTQDWVSMPGVIPVASGGIHVWHMPALTEIFGDDSVLQFGGGTLGHPWGNAPGAAANRVALEACVQARNEGRDLAREGNEIIRAACKWSPELAAACEVWK,brenda,A0A1C3HPT1,O=O,0.672,,,4.1.1.39,269377.0,-0.1726307269461747,-0.1726307269461747,O=O__MSPQTETKASVGFQAGVKDYKLTYYTPEYETKDTDILAAFRVTPQPGVPPEEAGAAVAAESSTGTWTTVWTDGLTSLDRYKGRCYHIEPVAGEDNQWICYVAYPLDLFEEGSVTNMFTSIVGNVFGFKALRALRLEDLRIPVAYAKTFQGPPHGIQVERDKLNKYGRPLLGCTIKPKLGLSAKNYGRACYECLRGGLDFTKDDENVNSQPFMRWRDRFVFCAEAIYKAQAETGEIKGHYLNATAGTCEEMMKRAIFARELGVPIVMHDYITGGFTANTSLAHYCRDNGLLLHIHRAMHAVIDRQKNHGMHFRVLAKALRMSGGDHIHAGTVVGKLEGEREMTLGFVDLLRDDFIEKDRARGIFFTQDWVSMPGVIPVASGGIHVWHMPALTEIFGDDSVLQFGGGTLGHPWGNAPGAAANRVALEACVQARNEGRDLAREGNEIIRAACKWSPELAAACEVWK,./data/raw/alphafold//AF-A0A1C3HPT1-F1-model_v4.pdb,2060,7070,8940,10157 +786,12104,12271,MPLGHIMRLDLEKIALEYIVPCLHEVGFCYLDNFLGEVVGDCVLERVKQLHCTGALRDGQLAGPRAGVSKRHLRGDQITWIGGNEEGCEAISFLLSLIDRLVLYCGSRLGKYYVKERSKAMVACYPGNGTGYVRHVDNPNGDGRCITCIYYLNKNWDAKLHGGILRIFPEGKSFIADVEPIFDRLLFFWSDRRNPHEVQPSYATRYAMTVWYFDAEERAEAKKKFRNLTRKTESALTED,brenda,Q9H6Z9,CC[C@H](C)[C@H](NOC(=O)[C@@H]1CCCN1OC(=O)[C@H](CCSC)NOC(=O)[C@@H](N)CC(O)=NOC(=O)[C@@H](N)CC(O)=NOC(=O)[C@@H](N)CC(O)=NOC(=O)[C@H](Cc1ccccc1)NOC(=O)[C@@H](N)CCC(O)=NOC(=O)[C@H](CC(C)C)NOC(=O)[C@@H](N)CCCNC(=N)NOC(=O)[C@H](CO)NOC(=O)[C@H](Cc1ccccc1)NOC(=O)[C@@H](N)CC(O)=NOC(=O)[C@@H](N)CCC(=N)O)C(=O)ON[C@@H](C)C(=O)ON1CCC[C@H]1C(=O)ON[C@@H](C)C(=O)ON[C@@H](CC(C)C)C(=O)ON[C@@H](CCSC)C(=O)ON=C(O)CC[C@H](N)C(=O)ON[C@@H](CC(C)C)C(=O)ON=C(O)C[C@H](N)C(=O)ON[C@@H](CC(C)C)C(=O)ON=C(O)C[C@H](N)C(=O)O,0.05,21.0,7.8,1.14.11.2,9606.0,-1.3010299956639813,-1.3010299956639813,CC[C@H](C)[C@H](NOC(=O)[C@@H]1CCCN1OC(=O)[C@H](CCSC)NOC(=O)[C@@H](N)CC(O)=NOC(=O)[C@@H](N)CC(O)=NOC(=O)[C@@H](N)CC(O)=NOC(=O)[C@H](Cc1ccccc1)NOC(=O)[C@@H](N)CCC(O)=NOC(=O)[C@H](CC(C)C)NOC(=O)[C@@H](N)CCCNC(=N)NOC(=O)[C@H](CO)NOC(=O)[C@H](Cc1ccccc1)NOC(=O)[C@@H](N)CC(O)=NOC(=O)[C@@H](N)CCC(=N)O)C(=O)ON[C@@H](C)C(=O)ON1CCC[C@H]1C(=O)ON[C@@H](C)C(=O)ON[C@@H](CC(C)C)C(=O)ON[C@@H](CCSC)C(=O)ON=C(O)CC[C@H](N)C(=O)ON[C@@H](CC(C)C)C(=O)ON=C(O)C[C@H](N)C(=O)ON[C@@H](CC(C)C)C(=O)ON=C(O)C[C@H](N)C(=O)O__MPLGHIMRLDLEKIALEYIVPCLHEVGFCYLDNFLGEVVGDCVLERVKQLHCTGALRDGQLAGPRAGVSKRHLRGDQITWIGGNEEGCEAISFLLSLIDRLVLYCGSRLGKYYVKERSKAMVACYPGNGTGYVRHVDNPNGDGRCITCIYYLNKNWDAKLHGGILRIFPEGKSFIADVEPIFDRLLFFWSDRRNPHEVQPSYATRYAMTVWYFDAEERAEAKKKFRNLTRKTESALTED,./data/raw/alphafold//AF-Q9H6Z9-F1-model_v4.pdb,132,2877,3567,4139 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+842,34019,34618,MSLVFAINGQRFELELSSVDPSTTLLEFLRYQTSFKSVKLSCGEGGCGACVVLLSKFDPVLQKVEDFTVSSCLTLLCSVNHCNITTSEGLGNSRDGFHPIHKRLSGFHASQCGFCTPGMSVSLFSALLDADKSQYSDLTVVEAEKAVSGNLCRCTGYRPIVDACKSFASDVDIEDLGLNSFCRKGDKDSSSLTRFDSEKRICTFPEFLKDEIKSVDSGMYRWCSPASVEELSSLLEACKANSNTVSMKLVAGNTSMGYYKDEREQNYDKYIDITRIPHLKEIRENQNGVEIGSVVTISKVIAALKEIRVSPGVEKIFGKLATHMEMIAARFIRNFGSIGGNLVMAQRKQFPSDMATILLAAGAFVNIMSSSRGLEKLTLEEFLERSPLEAHDLVLSIEIPFWHSETNSELFFETYRAAPRPHGSALAYLNAAFLAEVKDTMVVNCRLAFGAYGTKHAIRCKEIEEFLSGKVITDKVLYEAITLLGNVVVPEDGTSNPAYRSSLAPGFLFKFLHTLMTHPTTDKPSNGYHLDPPKPLPMLSSSQNVPINNEYNPVGQPVTKVGASLQASGEAVYVDDIPSPTNCLYGAFIYSKKPFARIKGIHFKDDLVPTGVVAVISRKDVPKGGKNIGMKIGLGSDQLFAEDFTTSVGECIAFVVADTQRHADAAVNLAVVEYETEDLEPPILSVEDAVKKSSLFDIIPFLYPQQVGDTSKGMAEADHQILSSEIRLGSQYVFYMETQTALAVGDEDNCIVVYSSTQTPQYVQSSVAACLGIPENNIRVITRRVGGGFGGKSVKSMPVATACALAAKKLQRPVRTYVNRKTDMIMTGGRHPMKITYSVGFKSTGKITALELEILIDAGASYGFSMFIPSNLIGSLKKYNWGALSFDIKLCKTNLLSRAIMRSPGDVQGTYIAEAIIENIASSLSLEVDTIRKINLHTHESLALFYKDGAGEPHEYTLSSMWDKVGVSSKFEERVSVVREFNESNMWRKRGISRVPIIYEVLLFATPGRVSVLSDGTIVVEIGGIELGQGLWTKVKQMTSYALGMLQCDGTEELLEKIRVIQSDSLSMVQGNFTGGSTTSEGSCAAVRLCCETLVERLKPLMERSDGPITWNELISQAYAQSVNLSASDLYTPKDTPMQYLNYGTAVSEVEVDLVTGQTTVLQTDILYDCGKSLNPAVDLGQIEGSFVQGLGFFMLEEYIEDPEGLLLTDSTWTYKIPTVDTIPKQFNVEILNGGCHEKRVLSSKASGEPPLLLAASVHCATRQAVKEARKQLCMWKGENGSSGSAFQLPVPATMPVVKELCGLDIIESYLEWKLHDNSNL,sabio,Q7G192,O=Cc1ccccc1,0.0077,60.0,7.4,1.2.3.1,3702.0,-2.113509274827518,-2.113509274827518,O=Cc1ccccc1__MSLVFAINGQRFELELSSVDPSTTLLEFLRYQTSFKSVKLSCGEGGCGACVVLLSKFDPVLQKVEDFTVSSCLTLLCSVNHCNITTSEGLGNSRDGFHPIHKRLSGFHASQCGFCTPGMSVSLFSALLDADKSQYSDLTVVEAEKAVSGNLCRCTGYRPIVDACKSFASDVDIEDLGLNSFCRKGDKDSSSLTRFDSEKRICTFPEFLKDEIKSVDSGMYRWCSPASVEELSSLLEACKANSNTVSMKLVAGNTSMGYYKDEREQNYDKYIDITRIPHLKEIRENQNGVEIGSVVTISKVIAALKEIRVSPGVEKIFGKLATHMEMIAARFIRNFGSIGGNLVMAQRKQFPSDMATILLAAGAFVNIMSSSRGLEKLTLEEFLERSPLEAHDLVLSIEIPFWHSETNSELFFETYRAAPRPHGSALAYLNAAFLAEVKDTMVVNCRLAFGAYGTKHAIRCKEIEEFLSGKVITDKVLYEAITLLGNVVVPEDGTSNPAYRSSLAPGFLFKFLHTLMTHPTTDKPSNGYHLDPPKPLPMLSSSQNVPINNEYNPVGQPVTKVGASLQASGEAVYVDDIPSPTNCLYGAFIYSKKPFARIKGIHFKDDLVPTGVVAVISRKDVPKGGKNIGMKIGLGSDQLFAEDFTTSVGECIAFVVADTQRHADAAVNLAVVEYETEDLEPPILSVEDAVKKSSLFDIIPFLYPQQVGDTSKGMAEADHQILSSEIRLGSQYVFYMETQTALAVGDEDNCIVVYSSTQTPQYVQSSVAACLGIPENNIRVITRRVGGGFGGKSVKSMPVATACALAAKKLQRPVRTYVNRKTDMIMTGGRHPMKITYSVGFKSTGKITALELEILIDAGASYGFSMFIPSNLIGSLKKYNWGALSFDIKLCKTNLLSRAIMRSPGDVQGTYIAEAIIENIASSLSLEVDTIRKINLHTHESLALFYKDGAGEPHEYTLSSMWDKVGVSSKFEERVSVVREFNESNMWRKRGISRVPIIYEVLLFATPGRVSVLSDGTIVVEIGGIELGQGLWTKVKQMTSYALGMLQCDGTEELLEKIRVIQSDSLSMVQGNFTGGSTTSEGSCAAVRLCCETLVERLKPLMERSDGPITWNELISQAYAQSVNLSASDLYTPKDTPMQYLNYGTAVSEVEVDLVTGQTTVLQTDILYDCGKSLNPAVDLGQIEGSFVQGLGFFMLEEYIEDPEGLLLTDSTWTYKIPTVDTIPKQFNVEILNGGCHEKRVLSSKASGEPPLLLAASVHCATRQAVKEARKQLCMWKGENGSSGSAFQLPVPATMPVVKELCGLDIIESYLEWKLHDNSNL,./data/raw/alphafold//AF-Q7G192-F1-model_v4.pdb,5229,3032,3756,4366 +843,18769,19042,MRVVVIGAGVIGLSTALCIHERYHSVLQPLDIKVYADRFTPLTTTDVAAGLWQPYLSDPNNPQEADWSQQTFDYLLSHVHSPNAENLGLFLISGYNLFHEAIPDPSWKDTVLGFRKLTPRELDMFPDYGYGWFHTSLILEGKNYLQWLTERLTERGVKFFQRKVESFEEVAREGADVIVNCTGVWAGALQRDPLLQPGRGQIMKVDAPWMKHFILTHDPERGIYNSPYIIPGTQTVTLGGIFQLGNWSELNNIQDHNTIWEGCCRLEPTLKNARIIGERTGFRPVRPQIRLEREQLRTGPSNTEVIHNYGHGGYGLTIHWGCALEAAKLFGRILEEKKLSRMPPSHL,sabio,P14920,N=C(N)NCCCC(N)C(=O)O,5.17,37.0,8.3,1.4.3.3,9606.0,0.7134905430939426,0.7134905430939426,N=C(N)NCCCC(N)C(=O)O__MRVVVIGAGVIGLSTALCIHERYHSVLQPLDIKVYADRFTPLTTTDVAAGLWQPYLSDPNNPQEADWSQQTFDYLLSHVHSPNAENLGLFLISGYNLFHEAIPDPSWKDTVLGFRKLTPRELDMFPDYGYGWFHTSLILEGKNYLQWLTERLTERGVKFFQRKVESFEEVAREGADVIVNCTGVWAGALQRDPLLQPGRGQIMKVDAPWMKHFILTHDPERGIYNSPYIIPGTQTVTLGGIFQLGNWSELNNIQDHNTIWEGCCRLEPTLKNARIIGERTGFRPVRPQIRLEREQLRTGPSNTEVIHNYGHGGYGLTIHWGCALEAAKLFGRILEEKKLSRMPPSHL,./data/raw/alphafold//AF-P14920-F1-model_v4.pdb,2126,3749,5101,3394 +844,18072,18334,MAAPGTPPPSASGGGGGEPRQLPELIRLKRDGGHLREADIRNFVHAVIDGRAQDTQIGAMLMAIRLQGMNLEETSVLTRALAESGQQLEWPKAWHQQLVDKHSTGGVGDKVSLVLAPALAACGCKVPMISGRSLGHTGGTLDKLESIPGFGVTQSPEQMLHILEEVGCCIVGQSAKLVPADGILYAARDVTATVDSVPLITASILSKKAVEGLSTLVVDVKFGGAAVFPDQEKARELAKMLVRVGVSLGLKVAAALTAMDNPLGRSVGHTLEVEEALLCLDGAGPPDLRDLVIRLGGAILWISGQAETQDQGAARVAAALDDGSARRRFQLMLSAQGVDPGLAKALCSGSPTQRRQLLPHAREQEELLAPADGIVECVRALPLARVLHDLGAGRSRAGQPIRPGVGAEVLVDVGQCLSRGTPWLRVHLDGPALSSQQRRTLQGALVLSDRAPFKVPSPFAELVLPPTIAQP,uniprot_search,Q99N42,Cc1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)nc1O,0.945,37.0,7.5,2.4.2.4,10090.0,-0.024568191490737,-0.024568191490737,Cc1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)nc1O__MAAPGTPPPSASGGGGGEPRQLPELIRLKRDGGHLREADIRNFVHAVIDGRAQDTQIGAMLMAIRLQGMNLEETSVLTRALAESGQQLEWPKAWHQQLVDKHSTGGVGDKVSLVLAPALAACGCKVPMISGRSLGHTGGTLDKLESIPGFGVTQSPEQMLHILEEVGCCIVGQSAKLVPADGILYAARDVTATVDSVPLITASILSKKAVEGLSTLVVDVKFGGAAVFPDQEKARELAKMLVRVGVSLGLKVAAALTAMDNPLGRSVGHTLEVEEALLCLDGAGPPDLRDLVIRLGGAILWISGQAETQDQGAARVAAALDDGSARRRFQLMLSAQGVDPGLAKALCSGSPTQRRQLLPHAREQEELLAPADGIVECVRALPLARVLHDLGAGRSRAGQPIRPGVGAEVLVDVGQCLSRGTPWLRVHLDGPALSSQQRRTLQGALVLSDRAPFKVPSPFAELVLPPTIAQP,./data/raw/alphafold//AF-Q99N42-F1-model_v4.pdb,968,3995,5386,5730 +845,16887,17131,MAEEQQNSSYSIGGNILPTPEEAATFQPQVVAEGGWDKCWEDGVTPWDQGRATPLILHLLDSSALPLGRTLVPGCGGGHDVVAMASPERFVVGLDISDKALNKANETYGSSPKAEYFSFVKEDVFTWRPNELFDLIFDYVFFCAIEPEMRPAWGKSMHELLKPDGELITLMYPMTDHEGGAPYKVALSSYEDVLVPVGFKAVSVEENPDSIPTRKGKEKLARWKKIN,sabio,O80562,C[S+](CCC(N)C(=O)O)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O,0.049,25.0,,2.1.1.165,3702.0,-1.3098039199714864,-1.3098039199714864,C[S+](CCC(N)C(=O)O)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O__MAEEQQNSSYSIGGNILPTPEEAATFQPQVVAEGGWDKCWEDGVTPWDQGRATPLILHLLDSSALPLGRTLVPGCGGGHDVVAMASPERFVVGLDISDKALNKANETYGSSPKAEYFSFVKEDVFTWRPNELFDLIFDYVFFCAIEPEMRPAWGKSMHELLKPDGELITLMYPMTDHEGGAPYKVALSSYEDVLVPVGFKAVSVEENPDSIPTRKGKEKLARWKKIN,./data/raw/alphafold//AF-O80562-F1-model_v4.pdb,734,4088,5489,5861 +846,29410,29933,MKKFQYPEARRDETIKETFFGIEVADPYRWLEDPDSEETKNFVDAQNSISEPYLKGCPARDKIKARLTQMLDYPKYSPPEKEGNHYFYFKNTGLQNHSVLYMQDSLDGPSKVFLDPNTFSSDGTVALTSTSFSEDGSIMGYTVSKSGSDWCTIHFRRVDTGEDYPEELKFVKFGHAAWTHDNLGVFYTRFPEVEGKSDGSETSQNRNQKIYYHKVGTPQSEDILVVELDDPEYIYTVCVSDCGRGVVILPSKFCHNNLVYFSDLSTLKDGIKGKLDVTCIVDKFEADYEFVANTGSKFVFRTNKNAHNYKLVVIDFENHSEENWVTLVPEHPTDVLEQAVSVAQDKLVLCYIRDVKNTLDIHSLVDGSLIRKIPVPIGTVSSISGSKKHSEVFYTFISFTSPGTIYRCDLSQSPIPDPEVFRQITIPGYDPSMFEEKQVFYLSKDGTRIPMFLVHKKVLEQNGKNPCLVYGYGGFNISLLPMFSTIRLVFVQYFNAVFASANIRGGGEYGEKWHDGGRLLNKQNSFDDFIAAGEYLIAEKYTNKSCLAIQGASNGGLLIGASVKPPYWLLEDPEYIYTVCVSDCGRWAVILPSKFCYNNLVYFSVLFQEEHFKNVLKYSPLHNIRVPEDQYPALLLLTASHDDRVVPLHSLKYIAQLQHVMRDNPKQENPLLIQVETKAGHGAGKPTNKRIEEQVDILCFLMNSMNLKFIE,uniprot_search,E1U339,O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN1C(=O)CN=C(O)OCc1ccccc1,0.06528,20.0,8.5,3.4.21.26,555972.0,-1.1852198542541952,-1.1852198542541952,O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN1C(=O)CN=C(O)OCc1ccccc1__MKKFQYPEARRDETIKETFFGIEVADPYRWLEDPDSEETKNFVDAQNSISEPYLKGCPARDKIKARLTQMLDYPKYSPPEKEGNHYFYFKNTGLQNHSVLYMQDSLDGPSKVFLDPNTFSSDGTVALTSTSFSEDGSIMGYTVSKSGSDWCTIHFRRVDTGEDYPEELKFVKFGHAAWTHDNLGVFYTRFPEVEGKSDGSETSQNRNQKIYYHKVGTPQSEDILVVELDDPEYIYTVCVSDCGRGVVILPSKFCHNNLVYFSDLSTLKDGIKGKLDVTCIVDKFEADYEFVANTGSKFVFRTNKNAHNYKLVVIDFENHSEENWVTLVPEHPTDVLEQAVSVAQDKLVLCYIRDVKNTLDIHSLVDGSLIRKIPVPIGTVSSISGSKKHSEVFYTFISFTSPGTIYRCDLSQSPIPDPEVFRQITIPGYDPSMFEEKQVFYLSKDGTRIPMFLVHKKVLEQNGKNPCLVYGYGGFNISLLPMFSTIRLVFVQYFNAVFASANIRGGGEYGEKWHDGGRLLNKQNSFDDFIAAGEYLIAEKYTNKSCLAIQGASNGGLLIGASVKPPYWLLEDPEYIYTVCVSDCGRWAVILPSKFCYNNLVYFSVLFQEEHFKNVLKYSPLHNIRVPEDQYPALLLLTASHDDRVVPLHSLKYIAQLQHVMRDNPKQENPLLIQVETKAGHGAGKPTNKRIEEQVDILCFLMNSMNLKFIE,./data/raw/alphafold//AF-E1U339-F1-model_v4.pdb,829,7075,8950,9210 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+946,39096,39792,MAHNEAVDVVLVGAGIMSATLAVLLKELDPGIKLEVVEQMDSGAAESSNPWNNAGTGHAGLCELNYTPQAADGSIDIKKAVHINAQFEVSKQFWAYLAQQGTFGSCKSFISPVPHLSYVQGEKGVSFLKKRFEVLSKHHAFSDMEYTEDKAKMAEWMPLMMPGRPADEVISATRVMHGTDVNFGALTQQLLKHLASAPDTQIKYSKKVTGLKRNGSGWTVSIKDTNSGNTRHIDAKFVFLGAGGAALPLLQASGIEESKGYGGFPVSGQWLRCDNPEVVKLHQAKVYSQAAVGSPPMSVPHLDTRVVDGKKSLLFGPYAGFTTKFLKHGSFMDLPMSIRLGNIGPMLAVARDNMDLTKYLVSEVRQSMEQRLDSLRRFYPQAKAEDWRLEIAGQRVQIIKKDPKKGGVLQFGTELVAAKDGSLAALLGASPGASVTVSIMLDLIERCFPQKAAGEWATKLKEIFPAREKTLETDAELYREISTRNSELLELVEPNTSIA,brenda,A0A0J6JSQ8,OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O,0.71,30.0,5.5,1.1.5.4,47884.0,-0.1487416512809247,-0.1487416512809247,OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O__MAHNEAVDVVLVGAGIMSATLAVLLKELDPGIKLEVVEQMDSGAAESSNPWNNAGTGHAGLCELNYTPQAADGSIDIKKAVHINAQFEVSKQFWAYLAQQGTFGSCKSFISPVPHLSYVQGEKGVSFLKKRFEVLSKHHAFSDMEYTEDKAKMAEWMPLMMPGRPADEVISATRVMHGTDVNFGALTQQLLKHLASAPDTQIKYSKKVTGLKRNGSGWTVSIKDTNSGNTRHIDAKFVFLGAGGAALPLLQASGIEESKGYGGFPVSGQWLRCDNPEVVKLHQAKVYSQAAVGSPPMSVPHLDTRVVDGKKSLLFGPYAGFTTKFLKHGSFMDLPMSIRLGNIGPMLAVARDNMDLTKYLVSEVRQSMEQRLDSLRRFYPQAKAEDWRLEIAGQRVQIIKKDPKKGGVLQFGTELVAAKDGSLAALLGASPGASVTVSIMLDLIERCFPQKAAGEWATKLKEIFPAREKTLETDAELYREISTRNSELLELVEPNTSIA,./data/raw/alphafold//AF-A0A0J6JSQ8-F1-model_v4.pdb,1864,7327,9279,9611 +947,37396,38058,MTKAQHPGATPVDLSFTRYVHSVNAFSPLFSCRRSICDATVLRRCCFLLYFRNNCNFKLLASSPVAFDWQREGIKQTQCMKILFGVQGTGNGHISRSRELVRKLKEDGHEVQVIISGRKEEELREIEVFAPYKVLKGFTLVTRRGKMSYMETMFQLDFVSLWTDVLSLDTSCVDLVITDFEPVTSMAARFKGIVSVGFGHQYAFPFHIPIARGNLFEKYTLLNFAPARYNAGLHWDHFNQPIFPPVIPQTLYDAVRPEEDPQKILVYLPFEEVEDIDAFLRPFDAYRFFIYGKVKEDRDDGHLCFRGYSREGFLRDLMECSGVVCNAGFELPGEALHLGKKMLLRPLDGQIEQESNALAMVQLGYGMSMHTLDGEVLKEWFAMPPGKPLNYSRTVDYIAEWIASGRWNDLRVFTDAAWKDHCREESKS,brenda,Q8KFI2,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O,0.0183,30.0,7.8,2.4.1.46,1097.0,-1.7375489102695705,-1.7375489102695705,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O__MTKAQHPGATPVDLSFTRYVHSVNAFSPLFSCRRSICDATVLRRCCFLLYFRNNCNFKLLASSPVAFDWQREGIKQTQCMKILFGVQGTGNGHISRSRELVRKLKEDGHEVQVIISGRKEEELREIEVFAPYKVLKGFTLVTRRGKMSYMETMFQLDFVSLWTDVLSLDTSCVDLVITDFEPVTSMAARFKGIVSVGFGHQYAFPFHIPIARGNLFEKYTLLNFAPARYNAGLHWDHFNQPIFPPVIPQTLYDAVRPEEDPQKILVYLPFEEVEDIDAFLRPFDAYRFFIYGKVKEDRDDGHLCFRGYSREGFLRDLMECSGVVCNAGFELPGEALHLGKKMLLRPLDGQIEQESNALAMVQLGYGMSMHTLDGEVLKEWFAMPPGKPLNYSRTVDYIAEWIASGRWNDLRVFTDAAWKDHCREESKS,./data/raw/alphafold//AF-Q8KFI2-F1-model_v4.pdb,2586,8247,10135,11330 +948,8798,8944,MNFHHLAYWQDKALSLAIENRLFINGEYTAAAENETFETVDPVTQAPLAKIARGKSVDIDRAMSAARGVFERGDWSLSSPAKRKAVLNKLADLMEAHAEELALLETLDTGKPIRHSLRDDIPGAARAIRWYAEAIDKVYGEVATTSSHELAMIVREPVGVIAAIVPWNFPLLLTCWKLGPALAAGNSVILKPSEKSPLSAIRLAGLAKEAGLPDGVLNVVTGFGHEAGQALSRHNDIDAIAFTGSTRTGKQLLKDAGDSNMKRVWLEAGGKSANIVFADCPDLQQAASATAAGIFYNQGQVCIAGTRLLLEESIADEFLALLKQQAQNWQPGHPLDPATTMGTLIDCAHADSVHSFIREGESKGQLLLDGRNAGLAAAIGPTIFVDVDPNASLSREEIFGPVLVVTRFTSEEQALQLANDSQYGLGAAVWTRDLSRAHRMSRRLKAGSVFVNNYNDGDMTVPFGGYKQSGNGRDKSLHALEKFTELKTIWISLEA,brenda,P23883,CCC=O,1.21,37.0,8.0,1.2.1.99,562.0,0.08278537031645,0.08278537031645,CCC=O__MNFHHLAYWQDKALSLAIENRLFINGEYTAAAENETFETVDPVTQAPLAKIARGKSVDIDRAMSAARGVFERGDWSLSSPAKRKAVLNKLADLMEAHAEELALLETLDTGKPIRHSLRDDIPGAARAIRWYAEAIDKVYGEVATTSSHELAMIVREPVGVIAAIVPWNFPLLLTCWKLGPALAAGNSVILKPSEKSPLSAIRLAGLAKEAGLPDGVLNVVTGFGHEAGQALSRHNDIDAIAFTGSTRTGKQLLKDAGDSNMKRVWLEAGGKSANIVFADCPDLQQAASATAAGIFYNQGQVCIAGTRLLLEESIADEFLALLKQQAQNWQPGHPLDPATTMGTLIDCAHADSVHSFIREGESKGQLLLDGRNAGLAAAIGPTIFVDVDPNASLSREEIFGPVLVVTRFTSEEQALQLANDSQYGLGAAVWTRDLSRAHRMSRRLKAGSVFVNNYNDGDMTVPFGGYKQSGNGRDKSLHALEKFTELKTIWISLEA,./data/raw/alphafold//AF-P23883-F1-model_v4.pdb,3125,1946,1563,2902 +949,13329,13523,MKTVFILISMLFPVAVMAQKSVKISDDISITQLSDKVYTYVSLAEIEGWGMVPSNGMIVINNHQAALLDTPINDAQTEMLVNWVTDSLHAKVTTFIPNHWHGDCIGGLGYLQRKGVQSYANQMTIDLAKEKGLPVPEHGFTDSLTVSLDGMPLQCYYLGGGHATDNIVVWLPTENILFGGCMLKDNQATSIGNISDADVTAWPKTLDKVKAKFPSARYVVPGHGDYGGTELIEHTKQIVNQYIESTSKP,sabio,P25910,CON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[N+]3(C)CCCC3)CSC12)c1csc(N)n1,0.027,25.0,7.2,3.5.2.6,817.0,-1.5686362358410126,-1.5686362358410126,CON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[N+]3(C)CCCC3)CSC12)c1csc(N)n1__MKTVFILISMLFPVAVMAQKSVKISDDISITQLSDKVYTYVSLAEIEGWGMVPSNGMIVINNHQAALLDTPINDAQTEMLVNWVTDSLHAKVTTFIPNHWHGDCIGGLGYLQRKGVQSYANQMTIDLAKEKGLPVPEHGFTDSLTVSLDGMPLQCYYLGGGHATDNIVVWLPTENILFGGCMLKDNQATSIGNISDADVTAWPKTLDKVKAKFPSARYVVPGHGDYGGTELIEHTKQIVNQYIESTSKP,./data/raw/alphafold//AF-P25910-F1-model_v4.pdb,3244,589,684,819 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+954,8252,8392,MTKIANKYEVIDNVEKLEKALKRLREAQSVYATYTQEQVDKIFFEAAMAANKMRIPLAKMAVEETGMGVVEDKVIKNHYASEYIYNAYKNTKTCGVIEEDPAFGIKKIAEPLGVIAAVIPTTNPTSTAIFKTLIALKTRNAIIISPHPRAKNSTIEAAKIVLEAAVKAGAPEGIIGWIDVPSLELTNLVMREADVILATGGPGLVKAAYSSGKPAIGVGAGNTPAIIDDSADIVLAVNSIIHSKTFDNGMICASEQSVIVLDGVYKEVKKEFEKRGCYFLNEDETEKVRKTIIINGALNAKIVGQKAHTIANLAGFEVPETTKILIGEVTSVDISEEFAHEKLCPVLAMYRAKDFDDALDKAERLVADGGFGHTSSLYIDTVTQKEKLQKFSERMKTCRILVNTPSSQGGIGDLYNFKLAPSLTLGCGSWGGNSVSDNVGVKHLLNIKTVAERRENMLWFRTPEKIYIKRGCLPVALDELKNVMGKKKAFIVTDNFLYNNGYTKPITDKLDEMGIVHKTFFDVSPDPSLASAKAGAAEMLAFQPDTIIAVGGGSAMDAAKIMWVMYEHPEVDFMDMAMRFMDIRKRVYTFPKMGQKAYFIAIPTSAGTGSEVTPFAVITDEKTGIKYPLADYELLPDMAIVDADMMMNAPKGLTAASGIDALTHALEAYVSMLATDYTDSLALRAIKMIFEYLPRAYENGASDPVAREKMANAATIAGMAFANAFLGVCHSMAHKLGAFYHLPHGVANALMINEVIRFNSSEAPTKMGTFPQYDHPRTLERYAEIADYIGLKGKNNEEKVENLIKAIDELKEKVGIRKTIKDYDIDEKEFLDRLDEMVEQAFDDQCTGTNPRYPLMNEIRQMYLNAYYGGAKK,brenda,A0A0H3W5U9,CC=O,1.4,55.0,7.0,1.1.1.71,1515.0,0.1461280356782379,0.1751240091670813,CC=O__MTKIANKYEVIDNVEKLEKALKRLREAQSVYATYTQEQVDKIFFEAAMAANKMRIPLAKMAVEETGMGVVEDKVIKNHYASEYIYNAYKNTKTCGVIEEDPAFGIKKIAEPLGVIAAVIPTTNPTSTAIFKTLIALKTRNAIIISPHPRAKNSTIEAAKIVLEAAVKAGAPEGIIGWIDVPSLELTNLVMREADVILATGGPGLVKAAYSSGKPAIGVGAGNTPAIIDDSADIVLAVNSIIHSKTFDNGMICASEQSVIVLDGVYKEVKKEFEKRGCYFLNEDETEKVRKTIIINGALNAKIVGQKAHTIANLAGFEVPETTKILIGEVTSVDISEEFAHEKLCPVLAMYRAKDFDDALDKAERLVADGGFGHTSSLYIDTVTQKEKLQKFSERMKTCRILVNTPSSQGGIGDLYNFKLAPSLTLGCGSWGGNSVSDNVGVKHLLNIKTVAERRENMLWFRTPEKIYIKRGCLPVALDELKNVMGKKKAFIVTDNFLYNNGYTKPITDKLDEMGIVHKTFFDVSPDPSLASAKAGAAEMLAFQPDTIIAVGGGSAMDAAKIMWVMYEHPEVDFMDMAMRFMDIRKRVYTFPKMGQKAYFIAIPTSAGTGSEVTPFAVITDEKTGIKYPLADYELLPDMAIVDADMMMNAPKGLTAASGIDALTHALEAYVSMLATDYTDSLALRAIKMIFEYLPRAYENGASDPVAREKMANAATIAGMAFANAFLGVCHSMAHKLGAFYHLPHGVANALMINEVIRFNSSEAPTKMGTFPQYDHPRTLERYAEIADYIGLKGKNNEEKVENLIKAIDELKEKVGIRKTIKDYDIDEKEFLDRLDEMVEQAFDDQCTGTNPRYPLMNEIRQMYLNAYYGGAKK,./data/raw/alphafold//AF-A0A0H3W5U9-F1-model_v4.pdb,119,2853,3538,4105 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+1015,12524,12701,MDRASELLFYVNGRKVIEKNVDPETMLLPYLRKKLRLTGTKYGCGGGGCGACTVMISRYNPITKRIRHHPANACLIPICSLYGAAVTTVEGIGSTHTRIHPVQERIAKCHGTQCGFCTPGMVMSIYTLLRNHPEPTLDQLTDALGGNLCRCTGYRPIIDACKTFCKTSGCCQSKENGVCCLDQGINGLPEFEEGSKTSPKLFAEEEFLPLDPTQELIFPPELMIMAEKQSQRTRVFGSERMMWFSPVTLKELLEFKFKYPQAPVIMGNTSVGPEVKFKGVFHPVIISPDRIEELSVVNHAYNGLTLGAGLSLAQVKDILADVVQKLPEEKTQMYHALLKHLGTLAGSQIRNMASLGGHIISRHPDSDLNPILAVGNCTLNLLSKEGKRQIPLNEQFLSKCPNADLKPQEILVSVNIPYSRKWEFVSAFRQAQRQENALAIVNSGMRVFFGEGDGIIRELCISYGGVGPATICAKNSCQKLIGRHWNEQMLDIACRLILNEVSLLGSAPGGKVEFKRTLIISFLFKFYLEVSQILKKMDPVHYPSLADKYESALEDLHSKHHCSTLKYQNIGPKQHPEDPIGHPIMHLSGVKHATGEAIYCDDMPLVDQELFLTFVTSSRAHAKIVSIDLSEALSMPGVVDIMTAEHLSDVNSFCFFTEAEKFLATDKVFCVGQLVCAVLADSEVQAKRAAKRVKIVYQDLEPLILTIEESIQHNSSFKPERKLEYGNVDEAFKVVDQILEGEIHMGGQEHFYMETQSMLVVPKGEDQEMDVYVSTQFPKYIQDIVASTLKLPANKVMCHVRRVGGAFGGKVLKTGIIAAVTAFAANKHGRAVRCVLERGEDMLITGGRHPYLGKYKAGFMNDGRILALDMEHYSNAGASLDESLFVIEMGLLKMDNAYKFPNLRCRGWACRTNLPSNTAFRGFGFPQAALITESCITEVAAKCGLSPEKVRIINMYKEIDQTPYKQEINAKNLIQCWRECMAMSSYSLRKVAVEKFNAENYWKKKGLAMVPLKFPVGLGSRAAGQAAALVHIYLDGSVLVTHGGIEMGQGVHTKMIQVVSRELRMPMSNVHLRGTSTETVPNANISGGSVVADLNGLAVKDACQTLLKRLEPIISKNPKGTWKDWAQTAFDESINLSAVGYFRGYESDMNWEKGEGQPFEYFVYGAACSEVEIDCLTGDHKNIRTDIVMDVGCSINPAIDIGQIEGAFIQGMGLYTIEELNYSPQGILHTRGPDQYKIPAICDMPTELHIALLPPSQNSNTLYSSKGLGESGVFLGCSVFFAIHDAVSAARQERGLHGPLTLNSPLTPEKIRMACEDKFTKMIPRDEPGSYVPWNVPI,brenda,Q06278,CN1C(=O)CN=C(c2ccccc2)c2cc([N+](=O)[O-])ccc21,0.0185,37.0,7.4,1.2.3.1,9606.0,-1.7328282715969865,-1.7328282715969865,CN1C(=O)CN=C(c2ccccc2)c2cc([N+](=O)[O-])ccc21__MDRASELLFYVNGRKVIEKNVDPETMLLPYLRKKLRLTGTKYGCGGGGCGACTVMISRYNPITKRIRHHPANACLIPICSLYGAAVTTVEGIGSTHTRIHPVQERIAKCHGTQCGFCTPGMVMSIYTLLRNHPEPTLDQLTDALGGNLCRCTGYRPIIDACKTFCKTSGCCQSKENGVCCLDQGINGLPEFEEGSKTSPKLFAEEEFLPLDPTQELIFPPELMIMAEKQSQRTRVFGSERMMWFSPVTLKELLEFKFKYPQAPVIMGNTSVGPEVKFKGVFHPVIISPDRIEELSVVNHAYNGLTLGAGLSLAQVKDILADVVQKLPEEKTQMYHALLKHLGTLAGSQIRNMASLGGHIISRHPDSDLNPILAVGNCTLNLLSKEGKRQIPLNEQFLSKCPNADLKPQEILVSVNIPYSRKWEFVSAFRQAQRQENALAIVNSGMRVFFGEGDGIIRELCISYGGVGPATICAKNSCQKLIGRHWNEQMLDIACRLILNEVSLLGSAPGGKVEFKRTLIISFLFKFYLEVSQILKKMDPVHYPSLADKYESALEDLHSKHHCSTLKYQNIGPKQHPEDPIGHPIMHLSGVKHATGEAIYCDDMPLVDQELFLTFVTSSRAHAKIVSIDLSEALSMPGVVDIMTAEHLSDVNSFCFFTEAEKFLATDKVFCVGQLVCAVLADSEVQAKRAAKRVKIVYQDLEPLILTIEESIQHNSSFKPERKLEYGNVDEAFKVVDQILEGEIHMGGQEHFYMETQSMLVVPKGEDQEMDVYVSTQFPKYIQDIVASTLKLPANKVMCHVRRVGGAFGGKVLKTGIIAAVTAFAANKHGRAVRCVLERGEDMLITGGRHPYLGKYKAGFMNDGRILALDMEHYSNAGASLDESLFVIEMGLLKMDNAYKFPNLRCRGWACRTNLPSNTAFRGFGFPQAALITESCITEVAAKCGLSPEKVRIINMYKEIDQTPYKQEINAKNLIQCWRECMAMSSYSLRKVAVEKFNAENYWKKKGLAMVPLKFPVGLGSRAAGQAAALVHIYLDGSVLVTHGGIEMGQGVHTKMIQVVSRELRMPMSNVHLRGTSTETVPNANISGGSVVADLNGLAVKDACQTLLKRLEPIISKNPKGTWKDWAQTAFDESINLSAVGYFRGYESDMNWEKGEGQPFEYFVYGAACSEVEIDCLTGDHKNIRTDIVMDVGCSINPAIDIGQIEGAFIQGMGLYTIEELNYSPQGILHTRGPDQYKIPAICDMPTELHIALLPPSQNSNTLYSSKGLGESGVFLGCSVFFAIHDAVSAARQERGLHGPLTLNSPLTPEKIRMACEDKFTKMIPRDEPGSYVPWNVPI,./data/raw/alphafold//AF-Q06278-F1-model_v4.pdb,3061,294,333,1677 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+1017,18681,18952,MPKSVVAALQIGALPEGKAATLEQILSYEAAIIEAGAQLVVMPEALLGGYPKGEGFGTQLGYRLPEGREAFARYFANAIEVPGVETDALAALSARTGANLVLGVIERSGSTLYCTALYFDPQQGLSGKHRKLMPTGTERLIWGKGDGSTLPVLDTQVGRVGAVICWENMMPLLRTAMYAQGIEVWCAPTVDEREMWQVSMRHIAHEGRCFVVSACQVQASPEELGLEIANWPAQRPLIAGGSVIVGPMGDVLAGPLVGRAGLISAQIDTADLVRARYDYDVVGHYARPDVFELTVDQRPRPGVRFT,brenda,Q4KCL8,N#Cc1ccccc1,23.8,30.0,7.0,3.5.5.7,294.0,1.376576957056512,1.376576957056512,N#Cc1ccccc1__MPKSVVAALQIGALPEGKAATLEQILSYEAAIIEAGAQLVVMPEALLGGYPKGEGFGTQLGYRLPEGREAFARYFANAIEVPGVETDALAALSARTGANLVLGVIERSGSTLYCTALYFDPQQGLSGKHRKLMPTGTERLIWGKGDGSTLPVLDTQVGRVGAVICWENMMPLLRTAMYAQGIEVWCAPTVDEREMWQVSMRHIAHEGRCFVVSACQVQASPEELGLEIANWPAQRPLIAGGSVIVGPMGDVLAGPLVGRAGLISAQIDTADLVRARYDYDVVGHYARPDVFELTVDQRPRPGVRFT,./data/raw/alphafold//AF-Q4KCL8-F1-model_v4.pdb,3925,565,658,788 +1018,24781,25170,MTANAYDVIVIGGGISGLSAAKLLVDSGLNPVVLEARSRVGGRTYTVQNKETKWVDLGGAYIGPTQNRILRIAKQYGVKTYKVNEEESLVHYVKGKSYPFKGPFPPMWNPFAYMDYNNLWRTMDKMGMEIPKEAPWRAPHAEEWDKMTMQQLFDKICWTRSARRFATLFVNVNVTSEPHEVSALWFLWYVKQCGGTMRIFSTTNGGQERKFAGGANQISEGMARELGDRVKLSRAVCSIDQTGDLVEVRTVNEEVYKAKYVILAIPPGLNLKIHFNPELPPLRNQLIHRVPMGSVIKCMVYYKENFWRKKGYCGSMVIEEEDAPIGLTLDDTKPDGSVPAIMGFILARKSRKLANLTRDERKRRICEIYARVLGSEEALYPVHYEEKNWCEEEYSGGCYTAYFPPGIMTQFGRVLREPVGRLYFAGTETATEWSGYMEGAVQAGERASREVMCAMGKLHASQIWQSEPESMDVPARPFVTTFWERNLPSVGGFLKFMGVSSFLAAATAAGLVACKKGLLPRC,uniprot_search,Q6NSN2,NCc1ccc(Cl)cc1,0.094,25.0,7.4,1.4.3.4,7955.0,-1.0268721464003014,-1.0268721464003014,NCc1ccc(Cl)cc1__MTANAYDVIVIGGGISGLSAAKLLVDSGLNPVVLEARSRVGGRTYTVQNKETKWVDLGGAYIGPTQNRILRIAKQYGVKTYKVNEEESLVHYVKGKSYPFKGPFPPMWNPFAYMDYNNLWRTMDKMGMEIPKEAPWRAPHAEEWDKMTMQQLFDKICWTRSARRFATLFVNVNVTSEPHEVSALWFLWYVKQCGGTMRIFSTTNGGQERKFAGGANQISEGMARELGDRVKLSRAVCSIDQTGDLVEVRTVNEEVYKAKYVILAIPPGLNLKIHFNPELPPLRNQLIHRVPMGSVIKCMVYYKENFWRKKGYCGSMVIEEEDAPIGLTLDDTKPDGSVPAIMGFILARKSRKLANLTRDERKRRICEIYARVLGSEEALYPVHYEEKNWCEEEYSGGCYTAYFPPGIMTQFGRVLREPVGRLYFAGTETATEWSGYMEGAVQAGERASREVMCAMGKLHASQIWQSEPESMDVPARPFVTTFWERNLPSVGGFLKFMGVSSFLAAATAAGLVACKKGLLPRC,./data/raw/alphafold//AF-Q6NSN2-F1-model_v4.pdb,235,3364,4901,5202 +1019,29584,30111,MRKLNPALEFRDFIQVLKDEDDLIEITEEIDPNLEVGAIMRKAYESHLPAPLFKNLKGASKDLFSILGCPAGLRSKEKGDHGRIAHHLGLDPKTTIKEIIDYLLECKEKEPLPPITVPVSSAPCKTHILSEEKIHLQSLPTPYLHVSDGGKYLQTYGMWILQTPDKKWTNWSIARGMVVDDKHITGLVIKPQHIRQIADSWAAIGKANEIPFALCFGVPPAAILVSSMPIPEGVSESDYVGAILGESVPVVKCETNDLMVPATSEMVFEGTLSLTDTHLEGPFGEMHGYVFKSQGHPCPLYTVKAMSYRDNAILPVSNPGLCTDETHTLIGSLVATEAKELAIESGLPILDAFMPYEAQALWLILKVDLKGLQALKTTPEEFCKKVGDIYFRTKVGFIVHEIILVADDIDIFNFKEVIWAYVTRHTPVADQMAFDDVTSFPLAPFVSQSSRSKTMKGGKCVTNCIFRQQYERSFDYITCNFEKGYPKGLVDKVNENWKRYGYK,brenda,Q03034,O=C(O)/C=C/c1ccccc1,0.18,25.0,7.0,4.1.1.102,4932.0,-0.744727494896694,-0.744727494896694,O=C(O)/C=C/c1ccccc1__MRKLNPALEFRDFIQVLKDEDDLIEITEEIDPNLEVGAIMRKAYESHLPAPLFKNLKGASKDLFSILGCPAGLRSKEKGDHGRIAHHLGLDPKTTIKEIIDYLLECKEKEPLPPITVPVSSAPCKTHILSEEKIHLQSLPTPYLHVSDGGKYLQTYGMWILQTPDKKWTNWSIARGMVVDDKHITGLVIKPQHIRQIADSWAAIGKANEIPFALCFGVPPAAILVSSMPIPEGVSESDYVGAILGESVPVVKCETNDLMVPATSEMVFEGTLSLTDTHLEGPFGEMHGYVFKSQGHPCPLYTVKAMSYRDNAILPVSNPGLCTDETHTLIGSLVATEAKELAIESGLPILDAFMPYEAQALWLILKVDLKGLQALKTTPEEFCKKVGDIYFRTKVGFIVHEIILVADDIDIFNFKEVIWAYVTRHTPVADQMAFDDVTSFPLAPFVSQSSRSKTMKGGKCVTNCIFRQQYERSFDYITCNFEKGYPKGLVDKVNENWKRYGYK,./data/raw/alphafold//AF-Q03034-F1-model_v4.pdb,347,3520,4802,5072 +1020,36479,37112,MIWIEDENGNKYQCDSNGNCENLAIVKVNTKEYNNDGKIYSIEGKSFVKLSKFPITLKLNLKADQILSLTTQQIYSEVYGKAFTYYNQLAIDMEPVTEPPKELKYDIKSLDHEKYIRTYPCWLYPVFNNIPDYTVFALVKSGNSYEAFFTLSNNYVTAYLFGDSVRLYTGFNTDEIKRSYFLSIGTSDNPYKAIENAINIASKETFTFKLRKEKGFPDKVMNGLGWCSWNAFLTKDLNEENLIKVVKGIIERGLRLNWVIIDDGWQDQNNDRAIRSLNPDNKKFPNGFKNTVRAIKSLGVKYVGLWHAINAHWGGMSQELMKSLNVNGYFTNFLNSYVPSPNLEDAIGFYKAFDGNILRDFDLVKVDNQWVIHAIYDSFPIGLASRNIQIALQYSVGKDVINCMSMNPENYCNYFYSNVMRNSIDYVPFWKDGTKLHIMFNAYNSLLTSHIVYPDYDMFMSYDPYAKVHLVARVFSGGPIYITDRHPERTNIELLRMAVLPNGEVIRVDEPALITEDLLFKDPLRERVLLKLKGKVKGYNAIAFFNLNSGEVEEEYNNNEDYYYYKVFSGEFGVGKFNVKLRELDAEVVITFPKSNRVIGLREYILPPFTVIVSDNVVIPKADGTLLYVKDTELNEVKAREGIPVTIE,brenda,Q97U94,O=[N+]([O-])c1ccc(O[C@H]2OC[C@H](O)[C@H](O)[C@H]2O)cc1,37.4,80.0,5.0,3.2.1.22,2287.0,1.5728716022004805,1.5728716022004805,O=[N+]([O-])c1ccc(O[C@H]2OC[C@H](O)[C@H](O)[C@H]2O)cc1__MIWIEDENGNKYQCDSNGNCENLAIVKVNTKEYNNDGKIYSIEGKSFVKLSKFPITLKLNLKADQILSLTTQQIYSEVYGKAFTYYNQLAIDMEPVTEPPKELKYDIKSLDHEKYIRTYPCWLYPVFNNIPDYTVFALVKSGNSYEAFFTLSNNYVTAYLFGDSVRLYTGFNTDEIKRSYFLSIGTSDNPYKAIENAINIASKETFTFKLRKEKGFPDKVMNGLGWCSWNAFLTKDLNEENLIKVVKGIIERGLRLNWVIIDDGWQDQNNDRAIRSLNPDNKKFPNGFKNTVRAIKSLGVKYVGLWHAINAHWGGMSQELMKSLNVNGYFTNFLNSYVPSPNLEDAIGFYKAFDGNILRDFDLVKVDNQWVIHAIYDSFPIGLASRNIQIALQYSVGKDVINCMSMNPENYCNYFYSNVMRNSIDYVPFWKDGTKLHIMFNAYNSLLTSHIVYPDYDMFMSYDPYAKVHLVARVFSGGPIYITDRHPERTNIELLRMAVLPNGEVIRVDEPALITEDLLFKDPLRERVLLKLKGKVKGYNAIAFFNLNSGEVEEEYNNNEDYYYYKVFSGEFGVGKFNVKLRELDAEVVITFPKSNRVIGLREYILPPFTVIVSDNVVIPKADGTLLYVKDTELNEVKAREGIPVTIE,./data/raw/alphafold//AF-Q97U94-F1-model_v4.pdb,2482,8100,9970,11152 +1021,25147,25543,MSLLSDLVNLNLTDATGKIIAEYIWIGGSGMDIRSKARTLPGPVTDPSKLPKWNYDGSSTGQAAGEDSEVILYPQAIFKDPFRKGNNILVMCDAYTPAGDPIPTNKRHNAAKIFSHPDVAKEEPWYGIEQEYTLMQKDVNWPIGWPVGGYPGPQGPYYCGVGADKAIGRDIVDAHYKACLYAGIGISGINGEVMPGQWEFQVGPVEGISSGDQVWVARYLLERITEISGVIVSFDPKPVPGDWNGAGAHCNYSTKTMRNDGGLEVIKKAIGKLQLKHKEHIAAYGEGNERRLTGKHETADINTFSWGVANRGASVRVGRDTEKEGKGYFEDRRPASNMDPYVVTSMIAETTILG,brenda,Q9LVI8,N[C@@H](CCC(=O)O)C(=O)O,3.9,30.0,7.8,6.3.1.2,3702.0,0.5910646070264992,0.6056003310001283,N[C@@H](CCC(=O)O)C(=O)O__MSLLSDLVNLNLTDATGKIIAEYIWIGGSGMDIRSKARTLPGPVTDPSKLPKWNYDGSSTGQAAGEDSEVILYPQAIFKDPFRKGNNILVMCDAYTPAGDPIPTNKRHNAAKIFSHPDVAKEEPWYGIEQEYTLMQKDVNWPIGWPVGGYPGPQGPYYCGVGADKAIGRDIVDAHYKACLYAGIGISGINGEVMPGQWEFQVGPVEGISSGDQVWVARYLLERITEISGVIVSFDPKPVPGDWNGAGAHCNYSTKTMRNDGGLEVIKKAIGKLQLKHKEHIAAYGEGNERRLTGKHETADINTFSWGVANRGASVRVGRDTEKEGKGYFEDRRPASNMDPYVVTSMIAETTILG,./data/raw/alphafold//AF-Q9LVI8-F1-model_v4.pdb,4608,4641,6438,6371 +1022,34633,35240,MKYVGSIDQGTTSTRFIIFDERQRPVAVHQVPHTQHTPHPGWLEHDAMEIFRSACKCIAGAIAKLKKKDPSFSRIEAIGITNQRETTVAWDRVTKQPLCFAPVWNDLRTYDITKRVTAECGGGDPMFASKMTGLPVSTYFSAFKMKWMMENVPAVAEACRRGTLCFGTIDTWLMYKLSNGKAFVTDVTNASRTFLMDLRTRRWSPELCEKLQIPVECLPEIRSNSELFAHVETNECGVATALGRLTPIMGSIGDQQAALFGNMCFQKGEAKNTYGTGCFLLMNVGDNVRFSKHGLLSTVGFQVGRDGPCHYALEGSIACAGATVEWMRRNMNLFGRISECEKLARSVPGTQGVVFVPAFSGLLAPYWDPSARGTIVGMTLKTTRAHIIRAALQAIALQLNDVVGSMKRDAGLSLTSLRVDGGLTKNGLLMEIQSNLLGVDILVPSMHETTALGAALCAGLAAGVWSSLDEVKAVSLRENSWRTVSPTGSPKERAEMIAEWKEALKRTKWAKL,brenda,Q75T26,O=P(O)(O)OCC(O)CO,1.09,35.0,7.2,2.7.1.30,5692.0,0.0374264979406236,0.0374264979406236,O=P(O)(O)OCC(O)CO__MKYVGSIDQGTTSTRFIIFDERQRPVAVHQVPHTQHTPHPGWLEHDAMEIFRSACKCIAGAIAKLKKKDPSFSRIEAIGITNQRETTVAWDRVTKQPLCFAPVWNDLRTYDITKRVTAECGGGDPMFASKMTGLPVSTYFSAFKMKWMMENVPAVAEACRRGTLCFGTIDTWLMYKLSNGKAFVTDVTNASRTFLMDLRTRRWSPELCEKLQIPVECLPEIRSNSELFAHVETNECGVATALGRLTPIMGSIGDQQAALFGNMCFQKGEAKNTYGTGCFLLMNVGDNVRFSKHGLLSTVGFQVGRDGPCHYALEGSIACAGATVEWMRRNMNLFGRISECEKLARSVPGTQGVVFVPAFSGLLAPYWDPSARGTIVGMTLKTTRAHIIRAALQAIALQLNDVVGSMKRDAGLSLTSLRVDGGLTKNGLLMEIQSNLLGVDILVPSMHETTALGAALCAGLAAGVWSSLDEVKAVSLRENSWRTVSPTGSPKERAEMIAEWKEALKRTKWAKL,./data/raw/alphafold//AF-Q75T26-F1-model_v4.pdb,4403,6721,8548,8755 +1023,15102,15315,MLMTAEQYIESLRKLNTRVYMFGEKIENWVDHPMIRPSINCVAMTYELAQDPQYADLMTTKSNLIGKTINRFANLHQSTDDLRKKVKMQRLLGQKTASCFQRCVGMDAFNAVFSTTYEIDQKYGTNYHKNFTEYLKYIQENDLIVDGAMTDPKGDRGLAPSAQKDPDLFLRIVEKREDGIVVRGAKAHQTGSINSHEHIIMPTIAMTEADKDYAVSFACPSDADGLFMIYGRQSCDTRKMEEGADIDLGNKQFGGQEALVVFDNVFIPNDRIFLCQEYDFAGMMVERFAGYHRQSYGGCKVGVGDVVIGAAALAADYNGAQKASHVKDKLIEMTHLNETLYCCGIACSAEGYPTAAGNYQIDLLLANVCKQNITRFPYEIVRLAEDIAGGLMVTMPSEADFKSETVVGRDGETIGDFCNKFFAAAPTCTTEERMRVLRFLENICLGASAVGYRTESMHGAGSPQAQRIMIARQGNINAKKELAKAIAGIK,uniprot_search,P55792,C[C@@H](O)[C@H](N)C(=O)O,210.0,37.0,7.8,4.2.1.122,90371.0,2.322219294733919,2.322219294733919,C[C@@H](O)[C@H](N)C(=O)O__MLMTAEQYIESLRKLNTRVYMFGEKIENWVDHPMIRPSINCVAMTYELAQDPQYADLMTTKSNLIGKTINRFANLHQSTDDLRKKVKMQRLLGQKTASCFQRCVGMDAFNAVFSTTYEIDQKYGTNYHKNFTEYLKYIQENDLIVDGAMTDPKGDRGLAPSAQKDPDLFLRIVEKREDGIVVRGAKAHQTGSINSHEHIIMPTIAMTEADKDYAVSFACPSDADGLFMIYGRQSCDTRKMEEGADIDLGNKQFGGQEALVVFDNVFIPNDRIFLCQEYDFAGMMVERFAGYHRQSYGGCKVGVGDVVIGAAALAADYNGAQKASHVKDKLIEMTHLNETLYCCGIACSAEGYPTAAGNYQIDLLLANVCKQNITRFPYEIVRLAEDIAGGLMVTMPSEADFKSETVVGRDGETIGDFCNKFFAAAPTCTTEERMRVLRFLENICLGASAVGYRTESMHGAGSPQAQRIMIARQGNINAKKELAKAIAGIK,./data/raw/alphafold//AF-P55792-F1-model_v4.pdb,4895,1633,2478,2459 +1024,12678,12862,MLLAAVSLGLLLLAFLLLLRHLGWGLVAIGWFEFVQQPVHNLLMGGTKEQRILRHVQQHAKPGDPQSVLEAIDTYCSEKEWAMNVGDAKGQIMDAVIREYRPSLVLELGAYCGYSAVRMARLLPPGARLLTMEINPDYAAITQQMLDFAGLQDKVSILIGASQDLIPQLKKKYDVDTLDMVFLDHWKDRYLPDTLLLEECGLLRKGTVLLADNVIVPGTPDFLAYVRGSSSFECTHYSSYLEYMKVVDGLEKAVYQGPGSSPVKS,sabio,O88587,CNCC(O)c1ccc(O)c(O)c1,0.0050999999999999,,7.2,2.1.1.6,10090.0,-2.292429823902072,-2.292429823902072,CNCC(O)c1ccc(O)c(O)c1__MLLAAVSLGLLLLAFLLLLRHLGWGLVAIGWFEFVQQPVHNLLMGGTKEQRILRHVQQHAKPGDPQSVLEAIDTYCSEKEWAMNVGDAKGQIMDAVIREYRPSLVLELGAYCGYSAVRMARLLPPGARLLTMEINPDYAAITQQMLDFAGLQDKVSILIGASQDLIPQLKKKYDVDTLDMVFLDHWKDRYLPDTLLLEECGLLRKGTVLLADNVIVPGTPDFLAYVRGSSSFECTHYSSYLEYMKVVDGLEKAVYQGPGSSPVKS,./data/raw/alphafold//AF-O88587-F1-model_v4.pdb,261,3398,4649,4892 +1025,37746,38413,MHEIGEHLTTNTGWDIIKNRYEAAQAITEGSNFMIGNGFMGYRGTFAEDGKDAYAACIVTDTWDKADGKWEELSTVPNALLTLLHVDGEPFIMSEEAASFERTLDLSQGVTSRKVSQRMKNGATITIHEEKFASYRKKHAVLMKYTVESDQDTDAVLDTGIDYDVWSINGDHLQGHHYFSHPTGDGVTAKTVSYEDTVTVVETCSLDADASEEDYQNPDGSGRTFSLSLEAGKPVTLEKAMIIYSSNDVDNPQDEALLEAKHMQSYEEEKAANRLEWDNLWSHYDVTIQNNIIDQVALRFNIYHAIIATPVHKSLPIGARGLSCQAYQGAAFWDQEIYNMPMYLYSNPEIARNILKYRHRTLDGARRKAKRLGYEGAYYAWISGKTGDELCPDFFFKDVLSGRDIRNHFNDWQIHISPDIAYAVKKYHQVTGDDAFIRDYGAEMIFEIARFLASHAVYKPMRGRYEFMRVQGPDEYHENVDNNAFTNHQAMFTLQAADELLQTLDEKTLSAVKEKIGLSDDEISLWRDMLANTYVPKPDKHGIIEQFDGYYDLETIIPAKKVTERLIKEDEYYGYPNGVTVRTQCIKQADVIQLFVLHPHLYDRKTVELNYEFYEPRTLHFSSLSPSSYAIVAAQIDKVEEAYRNFRKSVMIDLLNTNEAVSGGTFIGGIHTAANGASWQMVVNGFGGLSVHGDDIHLSPRLPDAWDGYTFKAIVKGQTLEVDVTKEQITITNKSEDRKPLTLHIFGEKSVLDSERITKSR,brenda,D6XZ22,OCC(CO)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,1.1,30.0,8.0,2.4.1.332,85683.0,0.041392685158225,0.041392685158225,OCC(CO)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O__MHEIGEHLTTNTGWDIIKNRYEAAQAITEGSNFMIGNGFMGYRGTFAEDGKDAYAACIVTDTWDKADGKWEELSTVPNALLTLLHVDGEPFIMSEEAASFERTLDLSQGVTSRKVSQRMKNGATITIHEEKFASYRKKHAVLMKYTVESDQDTDAVLDTGIDYDVWSINGDHLQGHHYFSHPTGDGVTAKTVSYEDTVTVVETCSLDADASEEDYQNPDGSGRTFSLSLEAGKPVTLEKAMIIYSSNDVDNPQDEALLEAKHMQSYEEEKAANRLEWDNLWSHYDVTIQNNIIDQVALRFNIYHAIIATPVHKSLPIGARGLSCQAYQGAAFWDQEIYNMPMYLYSNPEIARNILKYRHRTLDGARRKAKRLGYEGAYYAWISGKTGDELCPDFFFKDVLSGRDIRNHFNDWQIHISPDIAYAVKKYHQVTGDDAFIRDYGAEMIFEIARFLASHAVYKPMRGRYEFMRVQGPDEYHENVDNNAFTNHQAMFTLQAADELLQTLDEKTLSAVKEKIGLSDDEISLWRDMLANTYVPKPDKHGIIEQFDGYYDLETIIPAKKVTERLIKEDEYYGYPNGVTVRTQCIKQADVIQLFVLHPHLYDRKTVELNYEFYEPRTLHFSSLSPSSYAIVAAQIDKVEEAYRNFRKSVMIDLLNTNEAVSGGTFIGGIHTAANGASWQMVVNGFGGLSVHGDDIHLSPRLPDAWDGYTFKAIVKGQTLEVDVTKEQITITNKSEDRKPLTLHIFGEKSVLDSERITKSR,./data/raw/alphafold//AF-D6XZ22-F1-model_v4.pdb,2141,5662,4449,10172 +1026,24598,24987,MSNKCDVIVVGGGISGMAAAKLLHDCGLSVVVLEARDRVGGRTYTIRNKNVKYVDLGGSYVGPTQNRILRLAKELGLETYKVNEVERLIHFVKGKSYAFRGPFPPVWNPITYLDYNNLWRTMDEMGQEIPSDAPWKAPLAEEWDYMTMKELLDKICWTNSTKQIATLFVNLCVTAETHEVSALWFLWYVKQCGGTTRIISTTNGGQERKFIGGSGQVSERIKDILGDRVKLERPVIHIDQTGENVVVKTLNHEIYEAKYVISAIPPVLGMKIHHSPPLPILRNQLITRVPLGSVIKCMVYYKEPFWRKKDFCGTMVIEGEEAPIAYTLDDTKPDGSCAAIMGFILAHKARKLVRLTKEERLRKLCELYAKVLNSQEALQPVHYEEKNWCEEQYSGGCYTAYFPPGILTQYGRVLRQPVGKIFFAGTETASHWSGYMEGAVEAGERAAREILHAIGKIPEDEIWQPEPESVDVPARPITNTFLERHLPSVPGLLKLLGLTTILSATALGFLAHKKGLFVRF,sabio,P19643,NCCc1c[nH]c2ccccc12,0.067,37.0,7.4,1.4.3.4,10116.0,-1.1739251972991736,-1.1739251972991736,NCCc1c[nH]c2ccccc12__MSNKCDVIVVGGGISGMAAAKLLHDCGLSVVVLEARDRVGGRTYTIRNKNVKYVDLGGSYVGPTQNRILRLAKELGLETYKVNEVERLIHFVKGKSYAFRGPFPPVWNPITYLDYNNLWRTMDEMGQEIPSDAPWKAPLAEEWDYMTMKELLDKICWTNSTKQIATLFVNLCVTAETHEVSALWFLWYVKQCGGTTRIISTTNGGQERKFIGGSGQVSERIKDILGDRVKLERPVIHIDQTGENVVVKTLNHEIYEAKYVISAIPPVLGMKIHHSPPLPILRNQLITRVPLGSVIKCMVYYKEPFWRKKDFCGTMVIEGEEAPIAYTLDDTKPDGSCAAIMGFILAHKARKLVRLTKEERLRKLCELYAKVLNSQEALQPVHYEEKNWCEEQYSGGCYTAYFPPGILTQYGRVLRQPVGKIFFAGTETASHWSGYMEGAVEAGERAAREILHAIGKIPEDEIWQPEPESVDVPARPITNTFLERHLPSVPGLLKLLGLTTILSATALGFLAHKKGLFVRF,./data/raw/alphafold//AF-P19643-F1-model_v4.pdb,235,3364,7835,10382 +1027,6875,7006,MPIRVPDELPAVNFLREENVFVMTTSRASGQEIRPLKVLILNLMPKKIETENQFLRLLSNSPLQVDIQLLRIDSRESRNTPAEHLNNFYCNFEDIQDQNFDGLIVTGAPLGLVEFNDVAYWPQIKQVLEWSKDHVTSTLFVCWAVQAALNILYGIPKQTRTEKLSGVYEHHILHPHALLTRGFDDSFLAPHSRYADFPAALIRDYTDLEILAETEEGDAYLFASKDKRIAFVTGHPEYDAQTLAQEFFRDVEAGLDPDVPYNYFPHNDPQNTPRASWRSHGNLLFTNWLNYYVYQITPYDLRHMNPTLD,sabio,P07623,CC(O)C(N)C(=O)O,31.0,25.0,7.5,2.3.1.46,562.0,1.4913616938342726,1.4913616938342726,CC(O)C(N)C(=O)O__MPIRVPDELPAVNFLREENVFVMTTSRASGQEIRPLKVLILNLMPKKIETENQFLRLLSNSPLQVDIQLLRIDSRESRNTPAEHLNNFYCNFEDIQDQNFDGLIVTGAPLGLVEFNDVAYWPQIKQVLEWSKDHVTSTLFVCWAVQAALNILYGIPKQTRTEKLSGVYEHHILHPHALLTRGFDDSFLAPHSRYADFPAALIRDYTDLEILAETEEGDAYLFASKDKRIAFVTGHPEYDAQTLAQEFFRDVEAGLDPDVPYNYFPHNDPQNTPRASWRSHGNLLFTNWLNYYVYQITPYDLRHMNPTLD,./data/raw/alphafold//AF-P07623-F1-model_v4.pdb,3831,1547,2363,2311 +1028,2275,2316,MMTKSLSCALLLSVASAAFAAPMFEKQLAEVVERTVTPLMNAQAIPGMAVAVIYQGQPHYFTFGKADVAANKPVTPQTLFELGSISKTFTGVLGGDAIARGEIALGDPVAKYWPELTGKQWQGIRMLDLATYTAGGLPLQVPDEVTDTASLLRFYQNWQPQWKPGTTRLYANASIGLFGALAVKPSGMSYEQAMTTRVFKPLKLDHTWINVPKAEEAHYAWGYREGKAVHVSPGMLDAEAYGVKTNVKDMASWLIANMKPDSLHAPSLKQGIALAQSRYWRVGAMYQGLGWEMLNWPVDAKTVVGGSDNKVALAPLPVAEVNPPAPPVKASWVHKTGSTGGFGSYVAFIPEKQLGIVMLANKSYPNPARVEAAYRILDALQ,brenda,A3RIY0,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)Cc3cccs3)[C@H]2SC1,0.062,30.0,7.0,3.5.2.6,562.0,-1.207608310501746,-1.207608310501746,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)Cc3cccs3)[C@H]2SC1__MMTKSLSCALLLSVASAAFAAPMFEKQLAEVVERTVTPLMNAQAIPGMAVAVIYQGQPHYFTFGKADVAANKPVTPQTLFELGSISKTFTGVLGGDAIARGEIALGDPVAKYWPELTGKQWQGIRMLDLATYTAGGLPLQVPDEVTDTASLLRFYQNWQPQWKPGTTRLYANASIGLFGALAVKPSGMSYEQAMTTRVFKPLKLDHTWINVPKAEEAHYAWGYREGKAVHVSPGMLDAEAYGVKTNVKDMASWLIANMKPDSLHAPSLKQGIALAQSRYWRVGAMYQGLGWEMLNWPVDAKTVVGGSDNKVALAPLPVAEVNPPAPPVKASWVHKTGSTGGFGSYVAFIPEKQLGIVMLANKSYPNPARVEAAYRILDALQ,./data/raw/alphafold//AF-A3RIY0-F1-model_v4.pdb,4913,1658,1869,1747 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+1064,7601,7733,MQDWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRFGGTSAYSGASIWLPGTQVQERAGLPDSTENARTYLRALLGDAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADIGDLAGKVRPELDQDRTGQDHAPGPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDGRVVGAEVESGGETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALLDQAWFCPGVEQPDGSAAFMVGVRGGLVVDSAGERYLNESLPYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTAPAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFCPPNGGANAALTAIENGPFYAARIVLSDLGTKGGLVTDVNGRVLRADGSAIDGLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK,sabio,Q9RA02,CC12CCC3C(CCC4CC(=O)CCC43C)C1CCC2O,0.036,30.0,7.4,1.3.99.4,1833.0,-1.4436974992327127,-1.4436974992327127,CC12CCC3C(CCC4CC(=O)CCC43C)C1CCC2O__MQDWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRFGGTSAYSGASIWLPGTQVQERAGLPDSTENARTYLRALLGDAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADIGDLAGKVRPELDQDRTGQDHAPGPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDGRVVGAEVESGGETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALLDQAWFCPGVEQPDGSAAFMVGVRGGLVVDSAGERYLNESLPYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTAPAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFCPPNGGANAALTAIENGPFYAARIVLSDLGTKGGLVTDVNGRVLRADGSAIDGLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK,./data/raw/alphafold//AF-Q9RA02-F1-model_v4.pdb,3745,882,1061,1305 +1065,37209,37866,MSRPEVLTPFTAIVPAAGLGTRFLPATKTVPKELLPVVDTPGIELVAAEAAAAGAERLVIVTSEGKDGVVAHFVEDLVLEGTLEARGKIAMLAKVRRAPALIKVESVVQAEPLGLGHAIGCVEPTLSPDEDAVAVLLPDDLVLPTGVLETMSKVRASRGGTVLCAIEVAREEISAYGVFDVEPVPDGDYTDDPNVLKVRGMVEKPKAETAPSRYAAAGRYVLDRAIFDALRRIDQGAGGEVQLTDAIALLIAEGHPVHVVVHQGSRHDLGNPGGYLKAAVDFALDRDDYGPDLRRWLVARLGLTEQ,brenda,O05576,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.01187,25.0,7.5,2.7.7.9,1773.0,-1.925549281045409,-1.925549281045409,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MSRPEVLTPFTAIVPAAGLGTRFLPATKTVPKELLPVVDTPGIELVAAEAAAAGAERLVIVTSEGKDGVVAHFVEDLVLEGTLEARGKIAMLAKVRRAPALIKVESVVQAEPLGLGHAIGCVEPTLSPDEDAVAVLLPDDLVLPTGVLETMSKVRASRGGTVLCAIEVAREEISAYGVFDVEPVPDGDYTDDPNVLKVRGMVEKPKAETAPSRYAAAGRYVLDRAIFDALRRIDQGAGGEVQLTDAIALLIAEGHPVHVVVHQGSRHDLGNPGGYLKAAVDFALDRDDYGPDLRRWLVARLGLTEQ,./data/raw/alphafold//AF-O05576-F1-model_v4.pdb,989,7886,9706,10863 +1066,1091,1121,MTPQQREEAAQSLYQAMQSGKPIAPLRDTFPDMNVDDAYAIQSINTQRRISLGRRVVGRKIGLTSVVVQQQLGVDEPDFGALFDDMSFGDAETIPLSILHQPKVEAEIGFVLGRDLDTEQPTHQEVLQAVDYVVPALEIVGSRIADWNIKFVDTVADNASSGVYVLGSTPISPRGLDLSLVGMCLSRRGEPVSTGAGAACLGTPLNAVVWLARTMSRLGKPLRAGELILSGALGPMVAVKPGDVFECHINGVGSVRTEFESNQMNGVAA,sabio,Q13VU0,C=CC=C(O)C(=O)O,0.0317,25.0,6.0,4.2.1.80,266265.0,-1.4989407377822486,-1.4561767165552468,C=CC=C(O)C(=O)O__MTPQQREEAAQSLYQAMQSGKPIAPLRDTFPDMNVDDAYAIQSINTQRRISLGRRVVGRKIGLTSVVVQQQLGVDEPDFGALFDDMSFGDAETIPLSILHQPKVEAEIGFVLGRDLDTEQPTHQEVLQAVDYVVPALEIVGSRIADWNIKFVDTVADNASSGVYVLGSTPISPRGLDLSLVGMCLSRRGEPVSTGAGAACLGTPLNAVVWLARTMSRLGKPLRAGELILSGALGPMVAVKPGDVFECHINGVGSVRTEFESNQMNGVAA,./data/raw/alphafold//AF-Q13VU0-F1-model_v4.pdb,3265,615,719,864 +1067,3960,4024,MMLSATQPLSEKLPAHGCRHVAIIMDGNGRWAKKQGKIRAFGHKAGAKSVRRAVSFAANNGIEALTLYAFSSENWNRPAQEVSALMELFVWALDSEVKSLHRHNVRLRIIGDTSRFNSRLQERIRKSEALTAGNTGLTLNIAANYGGRWDIVQGVRQLAEKVQQGNLQPDQIDEEMLNQHVCMHELAPVDLVIRTGGEHRISNFLLWQIAYAELYFTDVLWPDFDEQDFEGALNAFANRERRFGGTEPGDETA,brenda,P60472,CC(C)=CCC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O,0.00044,25.0,7.5,2.5.1.31,562.0,-3.356547323513813,-3.1974819823458613,CC(C)=CCC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O__MMLSATQPLSEKLPAHGCRHVAIIMDGNGRWAKKQGKIRAFGHKAGAKSVRRAVSFAANNGIEALTLYAFSSENWNRPAQEVSALMELFVWALDSEVKSLHRHNVRLRIIGDTSRFNSRLQERIRKSEALTAGNTGLTLNIAANYGGRWDIVQGVRQLAEKVQQGNLQPDQIDEEMLNQHVCMHELAPVDLVIRTGGEHRISNFLLWQIAYAELYFTDVLWPDFDEQDFEGALNAFANRERRFGGTEPGDETA,./data/raw/alphafold//AF-P60472-F1-model_v4.pdb,3110,374,427,512 +1068,2851,2903,MSSSSSSYLRDEDLTQETRDLISSLPSEKGWLVSQMYQFQGRWHTQALLQGLLQYQKHFEAKDSDIILVTNPKSGTTWLKALVFSLINRHKFPVSSGDHPLLVTNPHLLIPFLEGVYYESPNFDFTELPSPRLMNTHISLLSLPESVKSSSCKIVYCCRNPKDMFVSLWHFGKKLASQETADYPIEKAVEAFCQGKFIGGPFWDHVLEYWYASLENPNKVLFVTYEELKKQTGDTIKRIAEFLGCGFIEEEEVGGIVKLCSFESLSSLEANREGKLPNGVETKAFFRKGEVGGWRDTLSESLAEEIDRTMEEKFQGSGLKFSC,brenda,Q6T261,CC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,0.014,25.0,7.5,2.8.2.15,3708.0,-1.853871964321762,-1.853871964321762,CC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C__MSSSSSSYLRDEDLTQETRDLISSLPSEKGWLVSQMYQFQGRWHTQALLQGLLQYQKHFEAKDSDIILVTNPKSGTTWLKALVFSLINRHKFPVSSGDHPLLVTNPHLLIPFLEGVYYESPNFDFTELPSPRLMNTHISLLSLPESVKSSSCKIVYCCRNPKDMFVSLWHFGKKLASQETADYPIEKAVEAFCQGKFIGGPFWDHVLEYWYASLENPNKVLFVTYEELKKQTGDTIKRIAEFLGCGFIEEEEVGGIVKLCSFESLSSLEANREGKLPNGVETKAFFRKGEVGGWRDTLSESLAEEIDRTMEEKFQGSGLKFSC,./data/raw/alphafold//AF-Q6T261-F1-model_v4.pdb,3743,1430,2208,2126 +1069,40117,40840,MDPKHQRVTLNDGHSIPVLGFGTYAPDEVPKSEAGEAAKIAIDVGFRHIDTAHAYQNEEEVGLAIRSKIADGTVKREDVFCTTKLWCTFFRPELVRKGLEQSLRKLQLDYVDLYLMHYPIAMKPGEEMFPTDEHGKTISDTVDICATWEAMEKCKDAGLAKSIGVSNFNHKQLEKILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAYSALGSSRDPKWVDQSSPVLLEDPVIGALAKKHKQSPALIALRYQLQRGVVVLAKSFIEREIKENIKVFGFQLSSEDMKALDGLNQNLRYCPAHFYIGHPHYPFSDEY,brenda,J7M9D0,O[C@@H]1C=Cc2ccccc2[C@H]1O,0.027,25.0,7.4,1.1.1.218,9986.0,-1.5686362358410126,-1.5686362358410126,O[C@@H]1C=Cc2ccccc2[C@H]1O__MDPKHQRVTLNDGHSIPVLGFGTYAPDEVPKSEAGEAAKIAIDVGFRHIDTAHAYQNEEEVGLAIRSKIADGTVKREDVFCTTKLWCTFFRPELVRKGLEQSLRKLQLDYVDLYLMHYPIAMKPGEEMFPTDEHGKTISDTVDICATWEAMEKCKDAGLAKSIGVSNFNHKQLEKILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAYSALGSSRDPKWVDQSSPVLLEDPVIGALAKKHKQSPALIALRYQLQRGVVVLAKSFIEREIKENIKVFGFQLSSEDMKALDGLNQNLRYCPAHFYIGHPHYPFSDEY,./data/raw/esmfold//ESMFold-J7M9D0-v1.pdb,2022,202,1007,1239 +1070,22894,23247,MANVTYTDTQLLIDGEWVDAASGKTIDVVNPATGKPIGRVAHAGIADLDRALAAAQSGFEAWRKVPAHERAATMRKAAALVRERADAIAQLMTQEQGKPLTEARVEVLSAADIIEWFADEGRRVYGRIVPPRNLGAQQTVVKEPVGPVAAFTPWNFPVNQVVRKLSAALATGCSFLVKAPEETPASPAALLRAFVDAGVPAGVIGLVYGDPAEISSYLIPHPVIRKVTFTGSTPVGKQLASLAGLHMKRATMELGGHAPVIVAEDADVALAVKAAGGAKFRNAGQVCISPTRFLVHNSIRDEFTRALVKHAEGLKVGNGLEEGTTLGALANPRRLTAMASVIDNARKVGASIETGGERIGSEGNFFAPTVIANVPLDADVFNNEPFGPVAAIRGFDKLEEAIAEANRLPFGLAGYAFTRSFANVHLLTQRLEVGMLWINQPATPWPEMPFGGVKDSGYGSEGGPEALEPYLVTKSVTVMAV,sabio,Q1JUP4,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.2599,25.0,7.2,1.2.1.26,192.0,-0.5851937204989873,-0.5851937204989873,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MANVTYTDTQLLIDGEWVDAASGKTIDVVNPATGKPIGRVAHAGIADLDRALAAAQSGFEAWRKVPAHERAATMRKAAALVRERADAIAQLMTQEQGKPLTEARVEVLSAADIIEWFADEGRRVYGRIVPPRNLGAQQTVVKEPVGPVAAFTPWNFPVNQVVRKLSAALATGCSFLVKAPEETPASPAALLRAFVDAGVPAGVIGLVYGDPAEISSYLIPHPVIRKVTFTGSTPVGKQLASLAGLHMKRATMELGGHAPVIVAEDADVALAVKAAGGAKFRNAGQVCISPTRFLVHNSIRDEFTRALVKHAEGLKVGNGLEEGTTLGALANPRRLTAMASVIDNARKVGASIETGGERIGSEGNFFAPTVIANVPLDADVFNNEPFGPVAAIRGFDKLEEAIAEANRLPFGLAGYAFTRSFANVHLLTQRLEVGMLWINQPATPWPEMPFGGVKDSGYGSEGGPEALEPYLVTKSVTVMAV,./data/raw/alphafold//AF-Q1JUP4-F1-model_v4.pdb,213,5186,7104,7127 +1071,34679,35287,MAAVDLEKLRASGAGKAIGVLTSGGDAQGMNAAVRAVTRMGIYVGAKVFLIYEGYEGLVEGGENIKQANWLSVSNIIQLGGTIIGSARCKAFTTREGRRAAAYNLVQHGITNLCVIGGDGSLTGANIFRSEWGSLLEELVAEGKISETTARTYSHLNIAGLVGSIDNDFCGTDMTIGTDSALHRIMEVIDAITTTAQSHQRTFVLEVMGRHCGYLALVSALASGADWLFIPEAPPEDGWENFMCERLGETRSRGSRLNIIIIAEGAIDRNGKPISSSYVKDLVVQRLGFDTRVTVLGHVQRGGTPSAFDRILSSKMGMEAVMALLEATPDTPACVVTLSGNQSVRLPLMECVQMTKEVQKAMDDKRFDEATQLRGGSFENNWNIYKLLAHQKPPKEKSNFSLAILNVGAPAAGMNAAVRSAVRTGISHGHTVYVVHDGFEGLAKGQVQEVGWHDVAGWLGRGGSMLGTKRTLPKGQLESIVENIRIYGIHALLVVGGFEAYEGVLQLVEARGRYEELCIVMCVIPATISNNVPGTDFSLGSDTAVNAAMESCDRIKQSASGTKRRVFIVETMGGYCGYLATVTGIAVGADAAYVFEDPFNIHDLKVNVEHMTEKMKTDIQRGLVLRNEKCHDYYTTEFLYNLYSSEGKGVFDCRTNVLGHLQQGGAPTPFDRNYGTKLGVKAMLWLSEKLREVYRKGRVFANAPDSACVIGLKKKAVAFSPVTELKKDTDFEHRMPREQWWLSLRLMLKMLAQYRISMAAYVSGELEHVTRRTLSMDKGF,sabio,P17858,O=P(O)(O)OCC1OC(O)(CO)C(O)C1O,0.07,25.0,7.1,2.7.1.11,9606.0,-1.154901959985743,-0.4380741795164571,O=P(O)(O)OCC1OC(O)(CO)C(O)C1O__MAAVDLEKLRASGAGKAIGVLTSGGDAQGMNAAVRAVTRMGIYVGAKVFLIYEGYEGLVEGGENIKQANWLSVSNIIQLGGTIIGSARCKAFTTREGRRAAAYNLVQHGITNLCVIGGDGSLTGANIFRSEWGSLLEELVAEGKISETTARTYSHLNIAGLVGSIDNDFCGTDMTIGTDSALHRIMEVIDAITTTAQSHQRTFVLEVMGRHCGYLALVSALASGADWLFIPEAPPEDGWENFMCERLGETRSRGSRLNIIIIAEGAIDRNGKPISSSYVKDLVVQRLGFDTRVTVLGHVQRGGTPSAFDRILSSKMGMEAVMALLEATPDTPACVVTLSGNQSVRLPLMECVQMTKEVQKAMDDKRFDEATQLRGGSFENNWNIYKLLAHQKPPKEKSNFSLAILNVGAPAAGMNAAVRSAVRTGISHGHTVYVVHDGFEGLAKGQVQEVGWHDVAGWLGRGGSMLGTKRTLPKGQLESIVENIRIYGIHALLVVGGFEAYEGVLQLVEARGRYEELCIVMCVIPATISNNVPGTDFSLGSDTAVNAAMESCDRIKQSASGTKRRVFIVETMGGYCGYLATVTGIAVGADAAYVFEDPFNIHDLKVNVEHMTEKMKTDIQRGLVLRNEKCHDYYTTEFLYNLYSSEGKGVFDCRTNVLGHLQQGGAPTPFDRNYGTKLGVKAMLWLSEKLREVYRKGRVFANAPDSACVIGLKKKAVAFSPVTELKKDTDFEHRMPREQWWLSLRLMLKMLAQYRISMAAYVSGELEHVTRRTLSMDKGF,./data/raw/alphafold//AF-P17858-F1-model_v4.pdb,2610,6619,8422,7895 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+1154,21922,22265,MGNNVVVLGTQWGDEGKGKIVDLLTERAKYVVRYQGGHNAGHTLVINGEKTVLHLIPSGILRENVTSIIGNGVVLSPAALMKEMKELEDRGIPVRERLLLSEACPLILDYHVALDNAREKARGAKAIGTTGRGIGPAYEDKVARRGLRVGDLFDKETFAEKLKEVMEYHNFQLVNYYKAEAVDYQKVLDDTMAVADILTSMVVDVSDLLDQARQRGDFVMFEGAQGTLLDIDHGTYPYVTSSNTTAGGVATGSGLGPRYVDYVLGILKAYSTRVGAGPFPTELFDETGEFLCKQGNEFGATTGRRRRTGWLDTVAVRRAVQLNSLSGFCLTKLDVLDGLKEVKLCVAYRMPDGREVTTTPLAADDWKGVEPIYETMPGWSESTFGVKDRSGLPQAALNYIKRIEELTGVPIDIISTGPDRTETMILRDPFDA,brenda,P0A7D4,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1,0.19,25.0,7.7,6.3.4.4,562.0,-0.721246399047171,-1.1531365255381765,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1__MGNNVVVLGTQWGDEGKGKIVDLLTERAKYVVRYQGGHNAGHTLVINGEKTVLHLIPSGILRENVTSIIGNGVVLSPAALMKEMKELEDRGIPVRERLLLSEACPLILDYHVALDNAREKARGAKAIGTTGRGIGPAYEDKVARRGLRVGDLFDKETFAEKLKEVMEYHNFQLVNYYKAEAVDYQKVLDDTMAVADILTSMVVDVSDLLDQARQRGDFVMFEGAQGTLLDIDHGTYPYVTSSNTTAGGVATGSGLGPRYVDYVLGILKAYSTRVGAGPFPTELFDETGEFLCKQGNEFGATTGRRRRTGWLDTVAVRRAVQLNSLSGFCLTKLDVLDGLKEVKLCVAYRMPDGREVTTTPLAADDWKGVEPIYETMPGWSESTFGVKDRSGLPQAALNYIKRIEELTGVPIDIISTGPDRTETMILRDPFDA,./data/raw/alphafold//AF-P0A7D4-F1-model_v4.pdb,4516,5578,6026,7657 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+1157,10509,10664,MRGLVVCVWACILLQRLPTCRGEEVKDVSTNVVNPCCYYPCQNWALCVRFGIDRYECDCTRTGFYGQNCTIPEFWTRIHQQLKPSPDVVHYILTHFHWLWNLINRTFMRDWLMRMVLTVRSNLIPSPPTFNSKYGYLSWESYSNVSYYTRILPPVPEDCPTPMGTKGKSVLPDPKLVVEKFLLRRQFRPDPKGTNLMFAFFAQHFTHQFFKTRNSMGLGFTSALGHGVDAGNVYGDNLVRQLNLRLLKDGKMKYQVVKGEVYPPTVAEAPVNMRYPQGTPVGQRMAIGQEVFGLLPGLTMYATLWLREHNRVCDILKAEHPTWGDEQLFQTARLIVIGETIRIVIEEYVQHLSGYLLDLKFDPVLLFKSTFQYRNRIAVEFNQLYHWHPLMPDSFHIDGDVVSYSQFIFNTSIVTHYGVEKLVDAFSRQYAGQIGGGRNIHPVVTKVAEGVIEESRTLRLQPFNEYRKRFNLKPYTSFSDFTGEEEMARELEELYGDIDALEFYPALMLEKTRPNAIFGESMVEMGAPFSLKGLLGNPICSPEYWKPSTFGGQTGFDIVNSASLERLVCLNTNWCPYVAFNVPPAGQEPPPRKQSTEL,sabio,Q9PTN3,CCCCCCCCCCCCC/C=C\C=C/C=C\C=C/C(=O)O,0.061,25.0,7.2,1.14.99.1,8038.0,-1.214670164989233,-1.214670164989233,CCCCCCCCCCCCC/C=C\C=C/C=C\C=C/C(=O)O__MRGLVVCVWACILLQRLPTCRGEEVKDVSTNVVNPCCYYPCQNWALCVRFGIDRYECDCTRTGFYGQNCTIPEFWTRIHQQLKPSPDVVHYILTHFHWLWNLINRTFMRDWLMRMVLTVRSNLIPSPPTFNSKYGYLSWESYSNVSYYTRILPPVPEDCPTPMGTKGKSVLPDPKLVVEKFLLRRQFRPDPKGTNLMFAFFAQHFTHQFFKTRNSMGLGFTSALGHGVDAGNVYGDNLVRQLNLRLLKDGKMKYQVVKGEVYPPTVAEAPVNMRYPQGTPVGQRMAIGQEVFGLLPGLTMYATLWLREHNRVCDILKAEHPTWGDEQLFQTARLIVIGETIRIVIEEYVQHLSGYLLDLKFDPVLLFKSTFQYRNRIAVEFNQLYHWHPLMPDSFHIDGDVVSYSQFIFNTSIVTHYGVEKLVDAFSRQYAGQIGGGRNIHPVVTKVAEGVIEESRTLRLQPFNEYRKRFNLKPYTSFSDFTGEEEMARELEELYGDIDALEFYPALMLEKTRPNAIFGESMVEMGAPFSLKGLLGNPICSPEYWKPSTFGGQTGFDIVNSASLERLVCLNTNWCPYVAFNVPPAGQEPPPRKQSTEL,./data/raw/alphafold//AF-Q9PTN3-F1-model_v4.pdb,3790,2657,3314,3829 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+1159,35646,36270,MSRPEVLTPFTAIVPAAGLGTRFLPATKTVPKELLPVVDTPGIELVAAEAAAAGAERLVIVTSEGKDGVVAHFVEDLVLEGTLEARGKIAMLAKVRRAPALIKVESVVQAEPLGLGHAIGCVEPTLSPDEDAVAVLLPDDLVLPTGVLETMSKVRASRGGTVLCAIEVAREEISAYGVFDVEPVPDGDYTDDPNVLKVRGMVEKPKAETAPSRYAAAGRYVLDRAIFDALRRIDQGAGGEVQLTDAIALLIAEGHPVHVVVHQGSRHDLGNPGGYLKAAVDFALDRDDYGPDLRRWLVARLGLTEQ,brenda,O05576,O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,0.04455,25.0,7.5,2.7.7.9,1773.0,-1.3511522916271064,-1.3511522916271064,O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O__MSRPEVLTPFTAIVPAAGLGTRFLPATKTVPKELLPVVDTPGIELVAAEAAAAGAERLVIVTSEGKDGVVAHFVEDLVLEGTLEARGKIAMLAKVRRAPALIKVESVVQAEPLGLGHAIGCVEPTLSPDEDAVAVLLPDDLVLPTGVLETMSKVRASRGGTVLCAIEVAREEISAYGVFDVEPVPDGDYTDDPNVLKVRGMVEKPKAETAPSRYAAAGRYVLDRAIFDALRRIDQGAGGEVQLTDAIALLIAEGHPVHVVVHQGSRHDLGNPGGYLKAAVDFALDRDDYGPDLRRWLVARLGLTEQ,./data/raw/alphafold//AF-O05576-F1-model_v4.pdb,989,7886,9706,10863 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+1162,19871,20162,MSQQERTRVAIVGAGIVGLTLAIALNAFDKERKLAIDIYENASELAEIGAGINVWPRTLAIFKQIGVEDALIPLLDHIPDLEPRIIFGIRKGDEKNGYQVYDTMNNGGALRVHRAHLQNTLIQHLPLPGSKVTEINSICGFHLGHNLIDYSHHSSSGQGPLTLHFSDGKPSRTCDILVGADGIKSTLRHLFLPRLPNPEKYLNCYEPKWKGLLAYRGLVPKEKLEAVSPGHRALTHPGLMYSGKSAYAVVYPVSNGKFINVVAIVHDNPTNSTVWPGPWRMDVTQSEFFEVYKGWDEEVLDLIRCVDKPTKWALHALDHLDVYAKGRVFLMGDAAHAMLPHLGAGAHVGMEDAYILASLITHSSTPIWPSTQHVSEIANIYNTMRIPRAVSMSNSTDEAGYLCNLENPGLEEFKVGDHIPKELLIQTARTMEKKWAWTTTYADEDRIKAISLLEGPRAVL,uniprot_search,Q92402,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.133,40.0,6.916666666666667,1.14.13.27,5341.0,-0.8761483590329142,-0.8761483590329142,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MSQQERTRVAIVGAGIVGLTLAIALNAFDKERKLAIDIYENASELAEIGAGINVWPRTLAIFKQIGVEDALIPLLDHIPDLEPRIIFGIRKGDEKNGYQVYDTMNNGGALRVHRAHLQNTLIQHLPLPGSKVTEINSICGFHLGHNLIDYSHHSSSGQGPLTLHFSDGKPSRTCDILVGADGIKSTLRHLFLPRLPNPEKYLNCYEPKWKGLLAYRGLVPKEKLEAVSPGHRALTHPGLMYSGKSAYAVVYPVSNGKFINVVAIVHDNPTNSTVWPGPWRMDVTQSEFFEVYKGWDEEVLDLIRCVDKPTKWALHALDHLDVYAKGRVFLMGDAAHAMLPHLGAGAHVGMEDAYILASLITHSSTPIWPSTQHVSEIANIYNTMRIPRAVSMSNSTDEAGYLCNLENPGLEEFKVGDHIPKELLIQTARTMEKKWAWTTTYADEDRIKAISLLEGPRAVL,./data/raw/alphafold//AF-Q92402-F1-model_v4.pdb,4090,4923,6786,6760 +1163,32683,33263,MAGVLSRDAPDIESILALNPRIQAHATLRSTMAKKLDKKHWKRNTDKNCFICEKLENNFDDIKHTTLGERGALREAVRCLKCADAPCQKSCPTSLDIKSFITSIANKNYYGAAKLIFSDNPLGLTCGMVCPTSDLCVGGCNLHATEEGPINIGGLQQFATEVFKAMNIPQIRSPLLPPPEHMPEAYSAKIALFGAGPASISCASFLARLGYSDITIFEKQEYVGGLSTSEIPQFRLPYDVVNFEIELMKDLGVKIICGKSISTDEMTLSTLKENGYKAAFIGIGLPEPKKDHIFQGLTQVQGFYTSKDFLPLVAKGSKPGMCACHSPLPSVRGAVIVLGAGDTAFDCATSALRCGARRVFIVFRKGFANIRAVPEEMELAKEEKCEFLPFLSPRKVIVKDGKIVGMQFVRTEQDETGNWVEDEEQIVRLKADVVISPFGSVLDDPKVIEALSPIKFNRWGLPEVNPETMQTSEPWVFAGGDVVGMANTTVESVNDGKQASWYIHEYIQAQYGALVPSQPTLPLFYTPVDLVDISVEMAGLRFPNPFGLASATPATSTPMIRRAFEAGWGFALTKTFSLDKDIVTNVSPRIIRGTTSGPLYGPGQSSFLNIELISEKTAAYWCHSVTELKADFPDNILIASIMCSYNKNDWMELSKMAEASGADALELNLSCPHGMGERGMGLACGQDPELVRNICRWVRQSVRVPFFAKLTPNVTDIVSIARAAKEGGADGVTATNTVSGLMGLKADGSPWPSVGSGKRTTYGGVSGTTIRPIALRAVTAIARALPGFPILATGGIDSAESGLQFLHSGASVLQVCSAIQNQDFTVIEDYCTGLKALLYLKSIEELSDWDGQSPPTMSHQKGKPVPHIAELMGQKLPSFGPYLERRKKILAASKIRENDQNRACSPLQRKHFNSQKPIPAIKDVIGKSLQYLGTFGELNIMEQVVALIDEEMCINCGKCYMTCNDSGYQAIQFDPETHLPTVSDTCTGCTLCLSVCPIMDCIRMVSRATPYEPKRGLPLAVKPVC,sabio,O89000,O=C1CCNC(=O)N1,0.193,37.0,7.4,1.3.1.2,10116.0,-0.7144426909922262,-0.7144426909922262,O=C1CCNC(=O)N1__MAGVLSRDAPDIESILALNPRIQAHATLRSTMAKKLDKKHWKRNTDKNCFICEKLENNFDDIKHTTLGERGALREAVRCLKCADAPCQKSCPTSLDIKSFITSIANKNYYGAAKLIFSDNPLGLTCGMVCPTSDLCVGGCNLHATEEGPINIGGLQQFATEVFKAMNIPQIRSPLLPPPEHMPEAYSAKIALFGAGPASISCASFLARLGYSDITIFEKQEYVGGLSTSEIPQFRLPYDVVNFEIELMKDLGVKIICGKSISTDEMTLSTLKENGYKAAFIGIGLPEPKKDHIFQGLTQVQGFYTSKDFLPLVAKGSKPGMCACHSPLPSVRGAVIVLGAGDTAFDCATSALRCGARRVFIVFRKGFANIRAVPEEMELAKEEKCEFLPFLSPRKVIVKDGKIVGMQFVRTEQDETGNWVEDEEQIVRLKADVVISPFGSVLDDPKVIEALSPIKFNRWGLPEVNPETMQTSEPWVFAGGDVVGMANTTVESVNDGKQASWYIHEYIQAQYGALVPSQPTLPLFYTPVDLVDISVEMAGLRFPNPFGLASATPATSTPMIRRAFEAGWGFALTKTFSLDKDIVTNVSPRIIRGTTSGPLYGPGQSSFLNIELISEKTAAYWCHSVTELKADFPDNILIASIMCSYNKNDWMELSKMAEASGADALELNLSCPHGMGERGMGLACGQDPELVRNICRWVRQSVRVPFFAKLTPNVTDIVSIARAAKEGGADGVTATNTVSGLMGLKADGSPWPSVGSGKRTTYGGVSGTTIRPIALRAVTAIARALPGFPILATGGIDSAESGLQFLHSGASVLQVCSAIQNQDFTVIEDYCTGLKALLYLKSIEELSDWDGQSPPTMSHQKGKPVPHIAELMGQKLPSFGPYLERRKKILAASKIRENDQNRACSPLQRKHFNSQKPIPAIKDVIGKSLQYLGTFGELNIMEQVVALIDEEMCINCGKCYMTCNDSGYQAIQFDPETHLPTVSDTCTGCTLCLSVCPIMDCIRMVSRATPYEPKRGLPLAVKPVC,./data/raw/alphafold//AF-O89000-F1-model_v4.pdb,3856,4460,5928,4038 +1164,32447,33025,MNSKQQTVRLSDGHFIPVLGFGTYAPREVPKSKALEATKIAIDAGFRHIDSAAVYQNEKEVGLAIRSKIADGTVKREDIFYTSKVWCTFNHPERVQVCLEQSLKQLQLEYVDLYLIHFPMALKPEEDLKAKDENEKLLFDVVDICDTWKAMEKCKDAGLAKSIGVSNFNRRQLEKILNKPGLKHRPVCNQVECHPYLNQRKLLDFCKSKDIVLVAYSALGSHRETRCVDKSLPVLLADPVLCAIAKKYNWTPALIALRYQLERGVVVLAKSFTEKRIKENMQVFEFQLTSEDMKVLDGLNKNIRYMSGSRFQGHPDFPFLDEY,sabio,Q3MHS3,O=C1C(=O)c2ccccc2-c2ccccc21,0.0005,25.0,7.4,1.1.1.62,10116.0,-3.3010299956639813,-3.3010299956639813,O=C1C(=O)c2ccccc2-c2ccccc21__MNSKQQTVRLSDGHFIPVLGFGTYAPREVPKSKALEATKIAIDAGFRHIDSAAVYQNEKEVGLAIRSKIADGTVKREDIFYTSKVWCTFNHPERVQVCLEQSLKQLQLEYVDLYLIHFPMALKPEEDLKAKDENEKLLFDVVDICDTWKAMEKCKDAGLAKSIGVSNFNRRQLEKILNKPGLKHRPVCNQVECHPYLNQRKLLDFCKSKDIVLVAYSALGSHRETRCVDKSLPVLLADPVLCAIAKKYNWTPALIALRYQLERGVVVLAKSFTEKRIKENMQVFEFQLTSEDMKVLDGLNKNIRYMSGSRFQGHPDFPFLDEY,./data/raw/alphafold//AF-Q3MHS3-F1-model_v4.pdb,2022,202,1021,1255 +1165,17923,18183,MKKGVMRPGHIQLRVLNLESALAHYRDLLGLIEVDRDDFGRAYLKAWTEVDKFSLVLREADEPGMDFMGFKVVDEDALRQLERDLTAYGCAVEQLPAGELNSCGRRVRFQAPSGHHFELYADKEYTGKWGVNEVNPEAWPRDLKGMAAVRFDHALMYGDELPATYDLFTKVLGFYLAEQVLDENGTRVAQFLSLSTKAHDVAFIHHPEKGRLHHVSFHLETWEDLLRAADLISMTDTSIDIGPTRHGLTHGKTIYFFDPSGNRNEVFCGGDYNYPDHKPVTWTTDQLGKAIFYHDRILNERFMTVLT,brenda,T1T1S4,Cc1cccc(O)c1O,0.03,,,1.13.11.2,497782.0,-1.5228787452803376,-1.5228787452803376,Cc1cccc(O)c1O__MKKGVMRPGHIQLRVLNLESALAHYRDLLGLIEVDRDDFGRAYLKAWTEVDKFSLVLREADEPGMDFMGFKVVDEDALRQLERDLTAYGCAVEQLPAGELNSCGRRVRFQAPSGHHFELYADKEYTGKWGVNEVNPEAWPRDLKGMAAVRFDHALMYGDELPATYDLFTKVLGFYLAEQVLDENGTRVAQFLSLSTKAHDVAFIHHPEKGRLHHVSFHLETWEDLLRAADLISMTDTSIDIGPTRHGLTHGKTIYFFDPSGNRNEVFCGGDYNYPDHKPVTWTTDQLGKAIFYHDRILNERFMTVLT,./data/raw/alphafold//AF-T1T1S4-F1-model_v4.pdb,911,4337,5784,6221 +1166,40684,41420,MNTLTSQIEQLQSLAHELLYLGVDGAPIYTDHFRQLNKEVLEQSDALYPQRGATPEEEANICLALLMGYNATIYNQGDKEEKKQVVLNRCWDVLDQLPATLLKCQLLTYCYGEVFEEELAKEAHTIIESWSNRELLKAEKEIAESLNNLEANPYPYSELHE,brenda,Q9F768,[Ca+2],0.078,25.0,7.3,4.1.1.82,817.0,-1.1079053973095196,-1.1079053973095196,[Ca+2]__MNTLTSQIEQLQSLAHELLYLGVDGAPIYTDHFRQLNKEVLEQSDALYPQRGATPEEEANICLALLMGYNATIYNQGDKEEKKQVVLNRCWDVLDQLPATLLKCQLLTYCYGEVFEEELAKEAHTIIESWSNRELLKAEKEIAESLNNLEANPYPYSELHE,./data/raw/alphafold//AF-Q9F768-F1-model_v4.pdb,3887,4620,6412,6315 +1167,17816,18075,MSTQSTHPLKPEAPRLPPGIPESPSCQRRHTLPASEFRCLTPEDAVSAFEIEREAFISVLGVCPLYLDEIRHFLTLCPELSLGWFEEGCLVAFIIGSLWDKERLMQESLTLHRSGGHIAHLHVLAVHRAFRQQGRGPILLWRYLHHLGSQPAVRRAALMCEDALVPFYERFSFHAVGPCAITVGSLTFMELHCSLRGHPFLRRNSGC,brenda,Q16613,Cc1ccc(CCN)cc1,1.17,37.0,6.8,2.3.1.87,9606.0,0.0681858617461616,0.0681858617461616,Cc1ccc(CCN)cc1__MSTQSTHPLKPEAPRLPPGIPESPSCQRRHTLPASEFRCLTPEDAVSAFEIEREAFISVLGVCPLYLDEIRHFLTLCPELSLGWFEEGCLVAFIIGSLWDKERLMQESLTLHRSGGHIAHLHVLAVHRAFRQQGRGPILLWRYLHHLGSQPAVRRAALMCEDALVPFYERFSFHAVGPCAITVGSLTFMELHCSLRGHPFLRRNSGC,./data/raw/alphafold//AF-Q16613-F1-model_v4.pdb,3696,1363,366,2014 +1168,5712,5798,MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,uniprot_search,P23946,CC(C)[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CC(=O)O)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1,0.071,45.66666666666666,8.375,3.4.21.39,9606.0,-1.1487416512809248,-1.1487416512809248,CC(C)[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CC(=O)O)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1__MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,./data/raw/alphafold//AF-P23946-F1-model_v4.pdb,5183,2024,1510,3023 +1169,39485,40189,MMIIVGVDAGGTKTKAVAYDCEGNFIGEGSSGPGNYHNVGLTRAIENIKEAVKIAAKGEADVVGMGVAGLDSKFDWENFTPLASLIAPKVIIQHDGVIALFAETLGEPGVVVIAGTGSVVEGYNGKEFLRVGGRGWLLSDDGSAYWVGRKALRKVLKMMDGLENKTILYNKVLKTINVKDLDELVMWSYTSSCQIDLVASIAKAVDEAANEGDTVAMDILKQGAELLASQAVYLARKIGTNKVYLKGGMFRSNIYHKFFTLYLEKEGIISDLGKRSPEIGAVILAYKEVGCDIKKLISD,sabio,Q96Y14,OC[C@H]1O[C@H](O)C[C@@H](O)[C@@H]1O,0.44,50.0,7.5,2.7.1.1,111955.0,-0.3565473235138126,-0.3565473235138126,OC[C@H]1O[C@H](O)C[C@@H](O)[C@@H]1O__MMIIVGVDAGGTKTKAVAYDCEGNFIGEGSSGPGNYHNVGLTRAIENIKEAVKIAAKGEADVVGMGVAGLDSKFDWENFTPLASLIAPKVIIQHDGVIALFAETLGEPGVVVIAGTGSVVEGYNGKEFLRVGGRGWLLSDDGSAYWVGRKALRKVLKMMDGLENKTILYNKVLKTINVKDLDELVMWSYTSSCQIDLVASIAKAVDEAANEGDTVAMDILKQGAELLASQAVYLARKIGTNKVYLKGGMFRSNIYHKFFTLYLEKEGIISDLGKRSPEIGAVILAYKEVGCDIKKLISD,./data/raw/alphafold//AF-Q96Y14-F1-model_v4.pdb,3488,997,1194,1470 +1170,26700,27157,MQACCGGNSMASLQQPGRVQGSVFPPIMPPVTKFSQQLKFNISKPFRSSFLKRNLVSEMRASSVSLPNVEISSKEIPFEDYGLGEVDPEVRTIITKEKDRQFRSLELIASENFTSRAVMEAVGSCLTNKYSEGLPGKRYYGGNEYIDQLETLCQNRALAAFRLDSTKWGVNVQPLSGSPANFAVYTAILSPHDRIMGLDLPHGGHLSHGFMTAKRRVSGTSIYFESMPYRLDESTGIVDYDMLEKTATLFRPKLIIAGASAYSRDFDYPRMRKIADSVGAFLMMDMAHISGLVAASVVADPFEYCDIVTTTTHKSLRGPRGGMIFFRKDPINGVDLESAVNNAVFPGLQGGPHNHTIGGLAVCLKHAQSPEFKAYQKRVVSNCRALANRLVELGFKLVSGGSDNHLVLVDLRPMGMDGARVEKILDMASITLNKNSVPGDKSALVPGGIRIGSPAMTTRGLSEKDFVVVADFIKEGVEITMEAKKAAPGSKLQDFNKFVTSPEFPLKERVKSLKERVETFTSRFPIPGV,sabio,Q94JQ3,Nc1nc2c(c(=O)[nH]1)N[C@@H](CNc1ccc(C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)cc1)CN2,0.00067,30.0,8.5,2.1.2.1,3702.0,-3.1739251972991736,-3.1739251972991736,Nc1nc2c(c(=O)[nH]1)N[C@@H](CNc1ccc(C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)cc1)CN2__MQACCGGNSMASLQQPGRVQGSVFPPIMPPVTKFSQQLKFNISKPFRSSFLKRNLVSEMRASSVSLPNVEISSKEIPFEDYGLGEVDPEVRTIITKEKDRQFRSLELIASENFTSRAVMEAVGSCLTNKYSEGLPGKRYYGGNEYIDQLETLCQNRALAAFRLDSTKWGVNVQPLSGSPANFAVYTAILSPHDRIMGLDLPHGGHLSHGFMTAKRRVSGTSIYFESMPYRLDESTGIVDYDMLEKTATLFRPKLIIAGASAYSRDFDYPRMRKIADSVGAFLMMDMAHISGLVAASVVADPFEYCDIVTTTTHKSLRGPRGGMIFFRKDPINGVDLESAVNNAVFPGLQGGPHNHTIGGLAVCLKHAQSPEFKAYQKRVVSNCRALANRLVELGFKLVSGGSDNHLVLVDLRPMGMDGARVEKILDMASITLNKNSVPGDKSALVPGGIRIGSPAMTTRGLSEKDFVVVADFIKEGVEITMEAKKAAPGSKLQDFNKFVTSPEFPLKERVKSLKERVETFTSRFPIPGV,./data/raw/alphafold//AF-Q94JQ3-F1-model_v4.pdb,4447,5484,1655,7553 +1171,6941,7072,MDSKHQCVKLNDGHFMPVLGFGTYAPPEVPRSKALEVTKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWSTFHRPELVRPALENSLKKAQLDYVDLYLIHSPMSLKPGEELSPTDENGKVIFDIVDLCTTWEAMEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNRSKLLDFCKSKDIVLVAYSALGSQRDKRWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTAEDMKAIDGLDRNLHYFNSDSFASHPNYPYSDEY,sabio,P42330,CC(O)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C,0.027,25.0,7.0,1.1.1.357,9606.0,-1.5686362358410126,-1.5686362358410126,CC(O)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C__MDSKHQCVKLNDGHFMPVLGFGTYAPPEVPRSKALEVTKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWSTFHRPELVRPALENSLKKAQLDYVDLYLIHSPMSLKPGEELSPTDENGKVIFDIVDLCTTWEAMEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNRSKLLDFCKSKDIVLVAYSALGSQRDKRWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTAEDMKAIDGLDRNLHYFNSDSFASHPNYPYSDEY,./data/raw/alphafold//AF-P42330-F1-model_v4.pdb,2022,202,1057,3793 +1172,18984,19258,MIFLYQVVHFILFTSVSGECVTQLLKDTCFEGGDITTVFTPSAKYCQVVCTYHPRCLLFTFTAESPSEDPTRWFTCVLKDSVTETLPRVNRTAAISGYSFKQCSHQISACNKDIYVDLDMKGINYNSSVAKSAQECQERCTDDVHCHFFTYATRQFPSLEHRNICLLKHTQTGTPTRITKLDKVVSGFSLKSCALSNLACIRDIFPNTVFADSNIDSVMAPDAFVCGRICTHHPGCLFFTFFSQEWPKESQRNLCLLKTSESGLPSTRIKKSKALSGFSLQSCRHSIPVFCHSSFYHDTDFLGEELDIVAAKSHEACQKLCTNAVRCQFFTYTPAQASCNEGKGKCYLKLSSNGSPTKILHGRGGISGYTLRLCKMDNECTTKIKPRIVGGTASVRGEWPWQVTLHTTSPTQRHLCGGSIIGNQWILTAAHCFYGVESPKILRVYSGILNQSEIKEDTSFFGVQEIIIHDQYKMAESGYDIALLKLETTVNYTDSQRPICLPSKGDRNVIYTDCWVTGWGYRKLRDKIQNTLQKAKIPLVTNEECQKRYRGHKITHKMICAGYREGGKDACKGDSGGPLSCKHNEVWHLVGITSWGEGCAQRERPGVYTNVVEYVDWILEKTQAV,brenda,P03951,N=C(N)NCCC[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@@H]1CCC(O)=N1)C(=O)Nc1ccc([N+](=O)[O-])cc1,0.26,37.0,7.5,3.4.21.27,9606.0,-0.585026652029182,0.1427125406182847,N=C(N)NCCC[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@@H]1CCC(O)=N1)C(=O)Nc1ccc([N+](=O)[O-])cc1__MIFLYQVVHFILFTSVSGECVTQLLKDTCFEGGDITTVFTPSAKYCQVVCTYHPRCLLFTFTAESPSEDPTRWFTCVLKDSVTETLPRVNRTAAISGYSFKQCSHQISACNKDIYVDLDMKGINYNSSVAKSAQECQERCTDDVHCHFFTYATRQFPSLEHRNICLLKHTQTGTPTRITKLDKVVSGFSLKSCALSNLACIRDIFPNTVFADSNIDSVMAPDAFVCGRICTHHPGCLFFTFFSQEWPKESQRNLCLLKTSESGLPSTRIKKSKALSGFSLQSCRHSIPVFCHSSFYHDTDFLGEELDIVAAKSHEACQKLCTNAVRCQFFTYTPAQASCNEGKGKCYLKLSSNGSPTKILHGRGGISGYTLRLCKMDNECTTKIKPRIVGGTASVRGEWPWQVTLHTTSPTQRHLCGGSIIGNQWILTAAHCFYGVESPKILRVYSGILNQSEIKEDTSFFGVQEIIIHDQYKMAESGYDIALLKLETTVNYTDSQRPICLPSKGDRNVIYTDCWVTGWGYRKLRDKIQNTLQKAKIPLVTNEECQKRYRGHKITHKMICAGYREGGKDACKGDSGGPLSCKHNEVWHLVGITSWGEGCAQRERPGVYTNVVEYVDWILEKTQAV,./data/raw/alphafold//AF-P03951-F1-model_v4.pdb,5359,3282,4038,4704 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+1182,17850,18109,MSKTQEFRPLTLPPKLSLSDFNEFIQDIIRIVGSENVEVISSKDQIVDGSYMKPTHTHDPHHVMDQDYFLASAIVAPRNVADVQSIVGLANKFSFPLWPISIGRNSGYGGAAPRVSGSVVLDMGKNMNRVLEVNVEGAYCVVEPGVTYHDLHNYLEANNLRDKLWLDVPDLGGGSVLGNAVERGVGYTPYGDHWMMHSGMEVVLANGELLRTGMGALPDPKRPETMGLKPEDQPWSKIAHLFPYGFGPYIDGLFSQSNMGIVTKIGIWLMPNPRGYQSYLITLPKDGDLKQAVDIIRPLRLGMALQNVPTIRHILLDAAVLGDKRSYSSRTEPLSDEELDKIAKQLNLGRWNFYGALYGPEPIRRVLWETIKDAFSAIPGVKFYFPEDTPENSVLRVRDKTMQGIPTYDELKWIDWLPNGAHLFFSPIAKVSGEDAMMQYAVTKKRCQEAGLDFIGTFTVGMREMHHIVCIVFNKKDLIQKRKVQWLMRTLIDDCAANGWGEYRTHLAFMDQIMETYNWNNSSFLRFNEVLKNAVDPNGIIAPGKSGVWPSQYSHVTWKL,uniprot_search,P56216,Cc1ccc(O)cc1,0.05,25.0,7.4,1.1.3.38,69488.0,-1.3010299956639813,-1.5051829836994362,Cc1ccc(O)cc1__MSKTQEFRPLTLPPKLSLSDFNEFIQDIIRIVGSENVEVISSKDQIVDGSYMKPTHTHDPHHVMDQDYFLASAIVAPRNVADVQSIVGLANKFSFPLWPISIGRNSGYGGAAPRVSGSVVLDMGKNMNRVLEVNVEGAYCVVEPGVTYHDLHNYLEANNLRDKLWLDVPDLGGGSVLGNAVERGVGYTPYGDHWMMHSGMEVVLANGELLRTGMGALPDPKRPETMGLKPEDQPWSKIAHLFPYGFGPYIDGLFSQSNMGIVTKIGIWLMPNPRGYQSYLITLPKDGDLKQAVDIIRPLRLGMALQNVPTIRHILLDAAVLGDKRSYSSRTEPLSDEELDKIAKQLNLGRWNFYGALYGPEPIRRVLWETIKDAFSAIPGVKFYFPEDTPENSVLRVRDKTMQGIPTYDELKWIDWLPNGAHLFFSPIAKVSGEDAMMQYAVTKKRCQEAGLDFIGTFTVGMREMHHIVCIVFNKKDLIQKRKVQWLMRTLIDDCAANGWGEYRTHLAFMDQIMETYNWNNSSFLRFNEVLKNAVDPNGIIAPGKSGVWPSQYSHVTWKL,./data/raw/alphafold//AF-P56216-F1-model_v4.pdb,5260,629,735,891 +1183,31783,32342,MPQAFPSPSASCSTPSTVAGFNNSALPNPFIFNEGTPVQTVEDWSCRRAQISALIQGYEAGELPGPPDSFSGSFSLSGTRGTLSITARNGGNSISFSSTITYPSGTAPAAGWPLVIAYEGGSIPIPSGFAVLSYSNSNMAEQNDASSRGQGLFYELYGTNATASAMTAWVWGVSRIIDVLETTPAAKINIDAIAVTGCSRDGKGALMAGAFEPRIALTIPQESGSGGDACWRLSLWEQDNGSVVQTATEIVTENVWFSSNFANYVDNLSVLPIDHHLLAAMVAPRALVSFENTDFAWLSPLSSFGCMTAAHTVFQALGIPQNHGFEQIGGHEHCAWPANLTASLDAFFDRFILNETSTSTNFFSTNDVFYGVPWNQSQWINW,brenda,A0A386GY48,O=C(O)[C@H]1OC(OCc2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O,55.8,30.0,6.2,3.1.1.117,42742.0,1.7466341989375789,1.7466341989375789,O=C(O)[C@H]1OC(OCc2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O__MPQAFPSPSASCSTPSTVAGFNNSALPNPFIFNEGTPVQTVEDWSCRRAQISALIQGYEAGELPGPPDSFSGSFSLSGTRGTLSITARNGGNSISFSSTITYPSGTAPAAGWPLVIAYEGGSIPIPSGFAVLSYSNSNMAEQNDASSRGQGLFYELYGTNATASAMTAWVWGVSRIIDVLETTPAAKINIDAIAVTGCSRDGKGALMAGAFEPRIALTIPQESGSGGDACWRLSLWEQDNGSVVQTATEIVTENVWFSSNFANYVDNLSVLPIDHHLLAAMVAPRALVSFENTDFAWLSPLSSFGCMTAAHTVFQALGIPQNHGFEQIGGHEHCAWPANLTASLDAFFDRFILNETSTSTNFFSTNDVFYGVPWNQSQWINW,./data/raw/alphafold//AF-A0A386GY48-F1-model_v4.pdb,1935,7424,7266,9735 +1184,30291,30828,MNAAAVTPPPEKFNFAEHLLQTNRVRPDKTAFVDDVSSLSFAQLEVKARQLASALRAIGVKREERVLLLMLDGTDWPVSFLGAIYAGIVPVAVNTLLTADDYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVVVSRPAAPLEPGEVDFAAFVGAQAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYWSPELYGRHTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATSLLMGERPTPDAVFKRWLGGVGGVKSTVFYGAPTGYAGMLAAPNLPSRDQVALRLAASAGEALPAEIGQRFQRHFGIDIVDGIGSTEMLHIFLSNLPDRVRYGTTGWPVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGGWTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLEAAVVGVADEHGLTKPKAYVVARPGQTLSETELKTFIKDRLAPYKYPRSAVFVAELPKTATGKIQRFKLREGVLG,brenda,Q3LB11,O=C(O)C1CCCCC1,1.47,31.0,8.0,6.2.1.25,1076.0,0.1673173347481761,0.1673173347481761,O=C(O)C1CCCCC1__MNAAAVTPPPEKFNFAEHLLQTNRVRPDKTAFVDDVSSLSFAQLEVKARQLASALRAIGVKREERVLLLMLDGTDWPVSFLGAIYAGIVPVAVNTLLTADDYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVVVSRPAAPLEPGEVDFAAFVGAQAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYWSPELYGRHTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATSLLMGERPTPDAVFKRWLGGVGGVKSTVFYGAPTGYAGMLAAPNLPSRDQVALRLAASAGEALPAEIGQRFQRHFGIDIVDGIGSTEMLHIFLSNLPDRVRYGTTGWPVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGGWTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLEAAVVGVADEHGLTKPKAYVVARPGQTLSETELKTFIKDRLAPYKYPRSAVFVAELPKTATGKIQRFKLREGVLG,./data/raw/alphafold//AF-Q3LB11-F1-model_v4.pdb,4863,3617,4941,5252 +1185,4046,4112,MATAAGPIATNNSPQNSNAYRTPIAPSVPITHKWSIAEDLTCISNPSKHNNPQTGYRSFSDELYVKYEEKLEDVRKALREVEENPLEGLVMIDALQRLGIDYHFRGEIGAFLQKQQIISSTPDGYPEHGLYEVSTLFRFLRQEGHNVTADVFNNFKDKEGRFRSELSTDIRGLMSLYEASQLRIEGEDILDQAADFSSQLLGRWTKDPNHHEARLVSNTLTHPYHKSLATFMGQKLSYMNCKGPNWDGVDNLQELAKMDLTIVQSIHQKEVFQVSQWWKDTGLANELKLARNQPLKWYMWPMAALTDPRFSEERVELTKPISFIYIIDDIFDVYGTIEELTLFTDAVNRWELSAVEQLPDYMKVCFKALYDVTNEIAYKIYKKHGQNPIDSLQKTWASLCNAFLVEAKWFASGHLPNAEEYLKNGIISSGVHVVLAHMFFLLGDGITQESVDLVDDYPGISTSIATILRLSDDLGSAKDEDQDGYDGSYIECYMKEHKGSSVDSAREEVIRMISEAWKCLNKECLSPNPFSESFRIGSLNMARMIPMMYSYDDNHNLPILEEHMKAMIYNTSL,brenda,H9M5U5,CC(C)=CCC/C(C)=C/COP(=O)(O)OP(=O)(O)O,0.0019,22.0,7.5,4.2.3.48,3625.0,-2.721246399047171,-2.721246399047171,CC(C)=CCC/C(C)=C/COP(=O)(O)OP(=O)(O)O__MATAAGPIATNNSPQNSNAYRTPIAPSVPITHKWSIAEDLTCISNPSKHNNPQTGYRSFSDELYVKYEEKLEDVRKALREVEENPLEGLVMIDALQRLGIDYHFRGEIGAFLQKQQIISSTPDGYPEHGLYEVSTLFRFLRQEGHNVTADVFNNFKDKEGRFRSELSTDIRGLMSLYEASQLRIEGEDILDQAADFSSQLLGRWTKDPNHHEARLVSNTLTHPYHKSLATFMGQKLSYMNCKGPNWDGVDNLQELAKMDLTIVQSIHQKEVFQVSQWWKDTGLANELKLARNQPLKWYMWPMAALTDPRFSEERVELTKPISFIYIIDDIFDVYGTIEELTLFTDAVNRWELSAVEQLPDYMKVCFKALYDVTNEIAYKIYKKHGQNPIDSLQKTWASLCNAFLVEAKWFASGHLPNAEEYLKNGIISSGVHVVLAHMFFLLGDGITQESVDLVDDYPGISTSIATILRLSDDLGSAKDEDQDGYDGSYIECYMKEHKGSSVDSAREEVIRMISEAWKCLNKECLSPNPFSESFRIGSLNMARMIPMMYSYDDNHNLPILEEHMKAMIYNTSL,./data/raw/alphafold//AF-H9M5U5-F1-model_v4.pdb,4950,1773,2575,2569 +1186,14505,14714,MASSLLTSSVMIPTTGSTVVGRSVLPFQSSLHSLRLTHSYKNPALFISCCSSVSKNAATSSTDLKPVVERWPEYIPNKLPDGNYVRVFDTTLRDGEQSPGGSLTPPQKLEIARQLAKLRVDIMEVGFPGSSEEELETIKTIAKTVGNEVDEETGYVPVICAIARCKHRDIEATWEALKYAKRPRILVFTSTSDIHMKYKLKKTQEEVIEMAVSSIRFAKSLGFNDIQFGCEDGGRSDKDFLCKILGEAIKAGVTVVTIGDTVGINMPHEYGELVTYLKANTPGIDDVVVAVHCHNDLGLATANSIAGIRAGARQVEVTINGIGERSGNASLEEVVMALKCRGAYVINGVYTKIDTRQIMATSKMVQEYTGLYVQAHKPIVGANCFVHESGIHQDGILKNRSTYEILSPEDIGIVKSQNSGLVLGKLSGRHAVKDRLKELGYELDDEKLNAVFSLFRDLTKNKKRITDADLKALVTSSDEISLEKLNGANGLKSNGYIPVPQVSSNV,brenda,Q9FG67,CSCCCC(=O)C(=O)O,0.64,32.0,8.5,2.3.3.17,3702.0,-0.1938200260161128,-0.1938200260161128,CSCCCC(=O)C(=O)O__MASSLLTSSVMIPTTGSTVVGRSVLPFQSSLHSLRLTHSYKNPALFISCCSSVSKNAATSSTDLKPVVERWPEYIPNKLPDGNYVRVFDTTLRDGEQSPGGSLTPPQKLEIARQLAKLRVDIMEVGFPGSSEEELETIKTIAKTVGNEVDEETGYVPVICAIARCKHRDIEATWEALKYAKRPRILVFTSTSDIHMKYKLKKTQEEVIEMAVSSIRFAKSLGFNDIQFGCEDGGRSDKDFLCKILGEAIKAGVTVVTIGDTVGINMPHEYGELVTYLKANTPGIDDVVVAVHCHNDLGLATANSIAGIRAGARQVEVTINGIGERSGNASLEEVVMALKCRGAYVINGVYTKIDTRQIMATSKMVQEYTGLYVQAHKPIVGANCFVHESGIHQDGILKNRSTYEILSPEDIGIVKSQNSGLVLGKLSGRHAVKDRLKELGYELDDEKLNAVFSLFRDLTKNKKRITDADLKALVTSSDEISLEKLNGANGLKSNGYIPVPQVSSNV,./data/raw/alphafold//AF-Q9FG67-F1-model_v4.pdb,3337,722,2017,1912 +1187,19322,19603,MKTPVKIAVTGAAGQISYSLLFRLASGELLGPDQPMIFHLLETPQALALGALNGVVMELNDCAYPLLHKIVTTDDPDVAFKDVDYAFLIGASPRKPGMERKDLLAINAQIFSVQGQALSKVASRDVKVLVTGNPANTNALIAISNAPDLRPENFSAMMMLDHKRATFQLADKCGVLSNDIKNIIIWGNHSAGQYPDLHHAKVKGQDALSLVEWDWFVDKFIPTVQQRGAVVIQAVGRSSAASAANAALNLMRNWVFGTDEGNWISMAVPSDGSYGIEKDLVYSFPVEIKNGEISIVQGLEISDFSREKMRKSEAELKEEREAVKHLL,brenda,G4T3S9,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.0252,62.5,9.5,1.1.1.37,271065.0,-1.5985994592184558,-1.5985994592184558,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MKTPVKIAVTGAAGQISYSLLFRLASGELLGPDQPMIFHLLETPQALALGALNGVVMELNDCAYPLLHKIVTTDDPDVAFKDVDYAFLIGASPRKPGMERKDLLAINAQIFSVQGQALSKVASRDVKVLVTGNPANTNALIAISNAPDLRPENFSAMMMLDHKRATFQLADKCGVLSNDIKNIIIWGNHSAGQYPDLHHAKVKGQDALSLVEWDWFVDKFIPTVQQRGAVVIQAVGRSSAASAANAALNLMRNWVFGTDEGNWISMAVPSDGSYGIEKDLVYSFPVEIKNGEISIVQGLEISDFSREKMRKSEAELKEEREAVKHLL,./data/raw/alphafold//AF-G4T3S9-F1-model_v4.pdb,4082,4852,6723,6691 +1188,25570,25984,MAKWEHDVTAQQHQTGLPAPTRMLTLSGGDPQQKRLQILSDFSKTWELYESLFDCLTDERAWYTKAISLRHPLIFYYGHTATFYINKLMAGGLIDARVDDRIEATMAIGVDEMSWDDLDNSHYSWPSLAELRDYRGKVRHLVEQFIQQMPLTLPIGWDSPAWVILMGIEHERIHLETSSVLIRQLPLAWVSAQPHWPACPDARHDRMAVPANSLVQVAGRRVTQGKTDDTYGWDNEYGSLVTEVKPFQASRMLVSHAEFFAFVAAGGYQNQRWWDDEGWGWREFSAAEMPTFWRGSPQQPEELRLRLLAEEVAMPWDWPAEVNQLEAAAFCRWKAEETGLSIQLPAESEWMSLREQVEGDQPDWNDAPGNINLACWASSCPIDRFAQGEFFDLVGNVWQWTTTPINGFPGFRVHPLYDDFSTPTFDGKHTLIKGGSWISTGNEALKSARYAFRRHFFQHAGFRYVVSQHQESLHSNPYETDSMVSQYLDFQYGPEYFAVENYAKALAKIACGISQHHQRALDIGCATGRASFELARHFEQVVGMDYSARFIDVALQLTRGEDFRYVTQEEGDLVEYRQVHLPDFDLGPEQASRIRFVQGDACNLKPQQEAWDLVLAANLIDRLRQPARFLADIAPMIRPGGVLMLSSPYTWLEEFTPKENWLGGIRENGEALSTYQALQRLLAADFEELAPPQDVPFVIRETARKYQHSVAQLTLWRKR,brenda,B2VFD8,N[C@@H](CS)C(=O)O,0.35,26.0,8.0,1.14.99.52,338565.0,-0.4559319556497244,-0.4559319556497244,N[C@@H](CS)C(=O)O__MAKWEHDVTAQQHQTGLPAPTRMLTLSGGDPQQKRLQILSDFSKTWELYESLFDCLTDERAWYTKAISLRHPLIFYYGHTATFYINKLMAGGLIDARVDDRIEATMAIGVDEMSWDDLDNSHYSWPSLAELRDYRGKVRHLVEQFIQQMPLTLPIGWDSPAWVILMGIEHERIHLETSSVLIRQLPLAWVSAQPHWPACPDARHDRMAVPANSLVQVAGRRVTQGKTDDTYGWDNEYGSLVTEVKPFQASRMLVSHAEFFAFVAAGGYQNQRWWDDEGWGWREFSAAEMPTFWRGSPQQPEELRLRLLAEEVAMPWDWPAEVNQLEAAAFCRWKAEETGLSIQLPAESEWMSLREQVEGDQPDWNDAPGNINLACWASSCPIDRFAQGEFFDLVGNVWQWTTTPINGFPGFRVHPLYDDFSTPTFDGKHTLIKGGSWISTGNEALKSARYAFRRHFFQHAGFRYVVSQHQESLHSNPYETDSMVSQYLDFQYGPEYFAVENYAKALAKIACGISQHHQRALDIGCATGRASFELARHFEQVVGMDYSARFIDVALQLTRGEDFRYVTQEEGDLVEYRQVHLPDFDLGPEQASRIRFVQGDACNLKPQQEAWDLVLAANLIDRLRQPARFLADIAPMIRPGGVLMLSSPYTWLEEFTPKENWLGGIRENGEALSTYQALQRLLAADFEELAPPQDVPFVIRETARKYQHSVAQLTLWRKR,./data/raw/alphafold//AF-B2VFD8-F1-model_v4.pdb,4237,5151,7062,7071 +1189,35044,35659,MDYENFVKSAEEINNLHNVNYLETKDLNDFNWKAAYYICKEIYDKQQINKDGYVVIGLSGGRTPIDVYKNMCLIKDIKIDKSKLIFFIIDERYKSDDHKFSNYNNIKFLFHNLNINEKEQLYKPDTTKSIVDCILDYNDKIKIMIEKYKKVDIAILGMGSDFHIASLFPNIFYNIYMNNYQNNYIYNEKTLDFINNDQDNDNLKYLKEYVYFTTTNQFDVRKRITVSLNLLANASSKIFLLNSKDKLDLWKNMLIKSYIEVNYNLYPATYLIDTSCTNENVNINNNNNNNNKNKNNYCYSNTTVISCGYENYTKSIEEIYDSKYALSLYSNSLNKEELLTIIIFGCSGDLAKKKIYPALFKLFCNNSLPKDLLIIGFARTVQDFDTFFDKIVIYLKRCLLCYEDWSISKKKDLLNGFKNRCRYFVGNYSSSESFENFNKYLTTIEEEEAKKKYYATCYKMNGSDYNISNNVAEDNISIDDENKTNEYFQMCTPKNCPDNVFSSNYNFPYVINRMLYLALPPHIFVSTLKNYKKNCLNSKGTDKILLEKPFGNDLDSFKMLSKQILENFNEQQIYRIDHYLGKDMVSGLLKLKFTNTFLLSLMNRHFIKCIKITLKETKGVYGRGQYFDPYGIIRDVMQNHMLQLLTLITMEDPIDLNDESVKNEKIKILKSIPSIKLEDTIIGQYEKAENFKEDENNDDESKKNHSYHDDPHIDKNSITPTFCTCILYINSINWYGVPIIFKSGKGLNKDICEIRIQFHNIMGSSDENMNNNEFVIILQPVEAIYLKMMIKKTGCEEMEEVQLNLTVNEKNKKINVPEAYETLLLECFKGHKKKFISDEELYESWRIFTPLLKELQEKQVKPLKYSFGSSGPKEVFGLVKKYYNYGKNYTHRPEFVRKSSFYEDDLLDIN,uniprot_search,Q27741,O=P(O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,0.0145,25.0,7.875,1.1.1.49,5833.0,-1.8386319977650247,-1.8386319977650247,O=P(O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O__MDYENFVKSAEEINNLHNVNYLETKDLNDFNWKAAYYICKEIYDKQQINKDGYVVIGLSGGRTPIDVYKNMCLIKDIKIDKSKLIFFIIDERYKSDDHKFSNYNNIKFLFHNLNINEKEQLYKPDTTKSIVDCILDYNDKIKIMIEKYKKVDIAILGMGSDFHIASLFPNIFYNIYMNNYQNNYIYNEKTLDFINNDQDNDNLKYLKEYVYFTTTNQFDVRKRITVSLNLLANASSKIFLLNSKDKLDLWKNMLIKSYIEVNYNLYPATYLIDTSCTNENVNINNNNNNNNKNKNNYCYSNTTVISCGYENYTKSIEEIYDSKYALSLYSNSLNKEELLTIIIFGCSGDLAKKKIYPALFKLFCNNSLPKDLLIIGFARTVQDFDTFFDKIVIYLKRCLLCYEDWSISKKKDLLNGFKNRCRYFVGNYSSSESFENFNKYLTTIEEEEAKKKYYATCYKMNGSDYNISNNVAEDNISIDDENKTNEYFQMCTPKNCPDNVFSSNYNFPYVINRMLYLALPPHIFVSTLKNYKKNCLNSKGTDKILLEKPFGNDLDSFKMLSKQILENFNEQQIYRIDHYLGKDMVSGLLKLKFTNTFLLSLMNRHFIKCIKITLKETKGVYGRGQYFDPYGIIRDVMQNHMLQLLTLITMEDPIDLNDESVKNEKIKILKSIPSIKLEDTIIGQYEKAENFKEDENNDDESKKNHSYHDDPHIDKNSITPTFCTCILYINSINWYGVPIIFKSGKGLNKDICEIRIQFHNIMGSSDENMNNNEFVIILQPVEAIYLKMMIKKTGCEEMEEVQLNLTVNEKNKKINVPEAYETLLLECFKGHKKKFISDEELYESWRIFTPLLKELQEKQVKPLKYSFGSSGPKEVFGLVKKYYNYGKNYTHRPEFVRKSSFYEDDLLDIN,./data/raw/alphafold//AF-Q27741-F1-model_v4.pdb,4353,5342,4352,7351 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+1197,10800,10956,MAARLLLRSLRVLSARSATLPPPSARCSHSGAEARLETPSAKKLTDIGIRRIFSSEHDIFRESVRKFFQEEVIPYHEEWEKAGEVSRELWEKAGKQGLLGINIAEKHGGIGGDLLSTAVTWEEQAYSNCTGPGFSLHSDIVMPYIANYGTKEQIEQFIPQMTAGKCIGAIAMTEPGAGSDLQGVRTNAKRSGSDWILNGSKVFITNGWLSDLVIVVAVTNREARSPAHGISLFLVENGMKGFIKGKKLHKMGMKAQDTAELFFEDVRLPASALLGEENKGFYYLMQELPQERLLIADLAISACEFMFEETRNYVRQRKAFGKTVAHIQTVQHKLAELKTNICVTRAFVDSCLQLHETKRLDSASASMAKYWASELQNTVAYQCVQLHGGWGYMWEYPIAKAYVDARVQPIYGGTNEIMKELIARQIVSDS,sabio,P15650,CCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O,0.0054,32.0,8.0,1.3.8.8,10116.0,-2.2676062401770314,-2.2676062401770314,CCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O__MAARLLLRSLRVLSARSATLPPPSARCSHSGAEARLETPSAKKLTDIGIRRIFSSEHDIFRESVRKFFQEEVIPYHEEWEKAGEVSRELWEKAGKQGLLGINIAEKHGGIGGDLLSTAVTWEEQAYSNCTGPGFSLHSDIVMPYIANYGTKEQIEQFIPQMTAGKCIGAIAMTEPGAGSDLQGVRTNAKRSGSDWILNGSKVFITNGWLSDLVIVVAVTNREARSPAHGISLFLVENGMKGFIKGKKLHKMGMKAQDTAELFFEDVRLPASALLGEENKGFYYLMQELPQERLLIADLAISACEFMFEETRNYVRQRKAFGKTVAHIQTVQHKLAELKTNICVTRAFVDSCLQLHETKRLDSASASMAKYWASELQNTVAYQCVQLHGGWGYMWEYPIAKAYVDARVQPIYGGTNEIMKELIARQIVSDS,./data/raw/alphafold//AF-P15650-F1-model_v4.pdb,5503,3038,3764,4375 +1198,15209,15423,MKKNIITSITSLALVAGLSLTAFAATTATVPAPPAKQESKPAVAANPAPKNVLFQYSTINALMLGQFEGDLTLKDLKLRGDMGLGTINDLDGEMIQMGTKFYQIDSTGKLSELPESVKTPFAVTTHFEPKEKTTLTNVQDYNQLTKMLEEKFENKNVFYAVKLTGTFKMVKARTVPKQTRPYPQLTEVTKKQSEFEFKNVKGTLIGFYTPNYAAALNVPGFHLHFITEDKTSGGHVLNLQFDNANLEISPIHEFDVQLPHTDDFAHSDLTQVTTSQVHQAESERK,brenda,P23616,C[C@@H]([O-])[C@](C)(O)C(=O)[O-].[Zn+2],0.56,13.0,4.0,4.1.1.5,1393.0,-0.2518119729937995,-0.2518119729937995,C[C@@H]([O-])[C@](C)(O)C(=O)[O-].[Zn+2]__MKKNIITSITSLALVAGLSLTAFAATTATVPAPPAKQESKPAVAANPAPKNVLFQYSTINALMLGQFEGDLTLKDLKLRGDMGLGTINDLDGEMIQMGTKFYQIDSTGKLSELPESVKTPFAVTTHFEPKEKTTLTNVQDYNQLTKMLEEKFENKNVFYAVKLTGTFKMVKARTVPKQTRPYPQLTEVTKKQSEFEFKNVKGTLIGFYTPNYAAALNVPGFHLHFITEDKTSGGHVLNLQFDNANLEISPIHEFDVQLPHTDDFAHSDLTQVTTSQVHQAESERK,./data/raw/alphafold//AF-P23616-F1-model_v4.pdb,3402,847,1015,1248 +1199,10330,10485,MAAVTWSRARCWCPSLLQVLRLPVTKLHLGRPAMRATQQDFENAMNQVKLLKKDPGNEVKLRLYALYKQATEGPCTMPKPGVFDFVNKAKWDAWNALGSLPKETARQNYVDLVSSLSSSSEASSQGKGGADGKAQESKGILVTSEGGITKITFNRPSKKNAITFQMYQDIILALKNASTDDTVITVFTGAGDYYSSGNDLTNFTSASGGMEEAANKGAIVLREFVNTFIDFPKPLVAVVNGPAVGISVTLLGLFDAVYASDRATFHTPFSHLGQSPEACSSYTFPKMMGSAKAAEMLLFGKKLTAREAWAQGLVTEVFPESTFETEVWTRLKTYAKLPPNSMRISKELIRKNEKEKLHAVNEEECTTLRARWLSEECINAIMSFVTRKPKL,sabio,Q5XIC0,CCCCCCCCCC/C=C/CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.029,25.0,8.0,5.3.3.8,10116.0,-1.537602002101044,-1.537602002101044,CCCCCCCCCC/C=C/CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MAAVTWSRARCWCPSLLQVLRLPVTKLHLGRPAMRATQQDFENAMNQVKLLKKDPGNEVKLRLYALYKQATEGPCTMPKPGVFDFVNKAKWDAWNALGSLPKETARQNYVDLVSSLSSSSEASSQGKGGADGKAQESKGILVTSEGGITKITFNRPSKKNAITFQMYQDIILALKNASTDDTVITVFTGAGDYYSSGNDLTNFTSASGGMEEAANKGAIVLREFVNTFIDFPKPLVAVVNGPAVGISVTLLGLFDAVYASDRATFHTPFSHLGQSPEACSSYTFPKMMGSAKAAEMLLFGKKLTAREAWAQGLVTEVFPESTFETEVWTRLKTYAKLPPNSMRISKELIRKNEKEKLHAVNEEECTTLRARWLSEECINAIMSFVTRKPKL,./data/raw/alphafold//AF-Q5XIC0-F1-model_v4.pdb,5827,2652,3307,3822 +1200,36927,37576,MSELMQAILDSEEKHDLRGFISELRQQDKNYLLRNDILNVYAEYCSKCQKPETSYKFSNLSKLIYYTQEIIPEDSNFCFIIRPKIAAQEVYRLTADLDVEPMTVQELLDLRDRLVNKFHPYEGDILELDFGPFYDYTPTIRDPKNIGKGVQYLNRYLSSKLFQDSQQWLESLFNFLRLHNYNGIQLLINHQIQSQQQLSQQVKNALNFVSDRPNDEPYEQFRLQLQTMGFEPGWGNTASRVRDTLNILDELIDSPDPQTLEAFISRIPMIFRIVLVSAHGWFGQEGVLGRPDTGGQVVYVLDQAKNLEKQLQEDAILAGLEVLNVQPKVIILTRLIPNSDGTLCNQRLEKVYGTENAWILRVPLREFNPKMTQNWISRFEFWPYLETFAIDSERELLAEFQGRPDLIVGNYTDGNLVAFLLTRRMKVTQCNIAHALEKSKYLFSNLYWQDLEEKYHFSLQFTADLIAMNAANFVISSTYQEIVGTPDSIGQYESYKCFTMPELYHVVNGIELFSPKFNVVPPGVNENSYFPYTQTQNRIESDRDRLEEMLFTLEDSSQIFGKLDDPNKRPIFSMARLDRIKNLTGLAECFGQSQELQERCNLILVAGKLRIEESEDNEEKDEIVKLYRIIDEYNLHGKIRWLGVRLSKNDSGEIYRVICDRQGIFVQPALFEAFGLTILESMISGLPTFATQFGGPLEIIQDKINGFYINPTHLEETATKILDFVTKCEQNPNYWNIISEKAIDRVYSTYTWKIHTTKLLTLARIYGFWNFTSKEKREDLLRYLESLFYLIYKPRAQQLLEQHKYR,sabio,Q9ZEV2,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,1.25,30.0,6.5,2.4.1.13,1167.0,0.0969100130080564,0.0969100130080564,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1__MSELMQAILDSEEKHDLRGFISELRQQDKNYLLRNDILNVYAEYCSKCQKPETSYKFSNLSKLIYYTQEIIPEDSNFCFIIRPKIAAQEVYRLTADLDVEPMTVQELLDLRDRLVNKFHPYEGDILELDFGPFYDYTPTIRDPKNIGKGVQYLNRYLSSKLFQDSQQWLESLFNFLRLHNYNGIQLLINHQIQSQQQLSQQVKNALNFVSDRPNDEPYEQFRLQLQTMGFEPGWGNTASRVRDTLNILDELIDSPDPQTLEAFISRIPMIFRIVLVSAHGWFGQEGVLGRPDTGGQVVYVLDQAKNLEKQLQEDAILAGLEVLNVQPKVIILTRLIPNSDGTLCNQRLEKVYGTENAWILRVPLREFNPKMTQNWISRFEFWPYLETFAIDSERELLAEFQGRPDLIVGNYTDGNLVAFLLTRRMKVTQCNIAHALEKSKYLFSNLYWQDLEEKYHFSLQFTADLIAMNAANFVISSTYQEIVGTPDSIGQYESYKCFTMPELYHVVNGIELFSPKFNVVPPGVNENSYFPYTQTQNRIESDRDRLEEMLFTLEDSSQIFGKLDDPNKRPIFSMARLDRIKNLTGLAECFGQSQELQERCNLILVAGKLRIEESEDNEEKDEIVKLYRIIDEYNLHGKIRWLGVRLSKNDSGEIYRVICDRQGIFVQPALFEAFGLTILESMISGLPTFATQFGGPLEIIQDKINGFYINPTHLEETATKILDFVTKCEQNPNYWNIISEKAIDRVYSTYTWKIHTTKLLTLARIYGFWNFTSKEKREDLLRYLESLFYLIYKPRAQQLLEQHKYR,./data/raw/alphafold//AF-Q9ZEV2-F1-model_v4.pdb,2543,6410,8272,10275 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+1241,35379,35998,MKLASFDVWNTLLDINIMLDAMAVELSKLMGACIIDVVEGMMFTRERIKRMRAETAGDPTQALEESQKMLAELLGTEIEVVRRAAARAVLKVSDEIVLPGAREALESVKRKGLKVTVTGNVMFWPGSYTRLLLERFGLMEFVDRTFFADEVFAYKPMPEMFEKPLKAFGVEPGEAIHIGDTYAEDFEGALKMGMWAVWINPEAEEVKRIHERGFEVPSVEGILEVLGELEG,brenda,B6YSF3,O=P(O)(O)OP(=O)(O)O,0.49,80.0,6.5,3.6.1.1,342948.0,-0.3098039199714864,-0.3614982127485412,O=P(O)(O)OP(=O)(O)O__MKLASFDVWNTLLDINIMLDAMAVELSKLMGACIIDVVEGMMFTRERIKRMRAETAGDPTQALEESQKMLAELLGTEIEVVRRAAARAVLKVSDEIVLPGAREALESVKRKGLKVTVTGNVMFWPGSYTRLLLERFGLMEFVDRTFFADEVFAYKPMPEMFEKPLKAFGVEPGEAIHIGDTYAEDFEGALKMGMWAVWINPEAEEVKRIHERGFEVPSVEGILEVLGELEG,./data/raw/alphafold//AF-B6YSF3-F1-model_v4.pdb,2292,7839,9651,10798 +1242,38947,39638,MKAIIVKPPNAGVQVKDVDEKKLDSYGKIKIRTIYNGICGTDREIVNGKLTLSTLPKGKDFLVLGHEAIGVVEESYHGFSQGDLVMPVNRRGCGICRNCLVGRPDFCETGEFGEAGIHKMDGFMREWWYDDPKYLVKIPKSIEDIGILAQPLADIEKSIEEILEVQKRVPVWTCDDGTLNCRKVLVVGTGPIGVLFTLLFRTYGLEVWMANRREPTEVEQTVIEETKTNYYNSSNGYDKLKDSVGKFDVIIDATGADVNILGNVIPLLGRNGVLGLFGFSTSGSVPLDYKTLQEIVHTNKTIIGLVNGQKPHFQQAVVHLASWKTLYPKAAKMLITKTVSINDEKELLKVLREKEHGEIKIRILWE,brenda,O93715,OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O,0.44,70.0,6.5,1.1.1.47,2287.0,-0.3565473235138126,-0.3003362339206606,OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O__MKAIIVKPPNAGVQVKDVDEKKLDSYGKIKIRTIYNGICGTDREIVNGKLTLSTLPKGKDFLVLGHEAIGVVEESYHGFSQGDLVMPVNRRGCGICRNCLVGRPDFCETGEFGEAGIHKMDGFMREWWYDDPKYLVKIPKSIEDIGILAQPLADIEKSIEEILEVQKRVPVWTCDDGTLNCRKVLVVGTGPIGVLFTLLFRTYGLEVWMANRREPTEVEQTVIEETKTNYYNSSNGYDKLKDSVGKFDVIIDATGADVNILGNVIPLLGRNGVLGLFGFSTSGSVPLDYKTLQEIVHTNKTIIGLVNGQKPHFQQAVVHLASWKTLYPKAAKMLITKTVSINDEKELLKVLREKEHGEIKIRILWE,./data/raw/alphafold//AF-O93715-F1-model_v4.pdb,4358,4624,6418,6323 +1243,4422,4491,MYTVGDYLLDRLHELGIEEIFGVPGDYNLQFLDQIISRKDMKWVGNANELNASYMADGYARTKKAAAFLTTFGVGELSAVNGLAGSYAENLPVVEIVGSPTSKVQNEGKFVHHTLADGDFKHFMKMHEPVTAARTLLTAENATVEIDRVLSALLKERKPVYINLPVDVAAAKAEKPSLPLKKENPTSNTSDQEILNKIQESLKNAKKPIVITGHEIISFGLEKTVTQFISKTKLPITTLNFGKSSVDETLPSFLGIYNGKLSEPNLKEFVESADFILMLGVKLTDSSTGAFTHHLNENKMISLNINEGKIFNERIQNFDFESLISSLLDLSGIEYKGKYIDKKQEDFVPSNALLSQDRLWQAVENLTQSNETIVAEQGTSFFGASSIFLKPKSHFIGQPLWGSIGYTFPAALGSQIADKESRHLLFIGDGSLQLTVQERKLQVQVSQPSSSHMNSYS,uniprot_search,A0A2X0Q412,CC(C)C(=O)C(=O)O,5.02,50.0,6.5,4.1.1.72,1358.0,0.7007037171450193,0.7007037171450193,CC(C)C(=O)C(=O)O__MYTVGDYLLDRLHELGIEEIFGVPGDYNLQFLDQIISRKDMKWVGNANELNASYMADGYARTKKAAAFLTTFGVGELSAVNGLAGSYAENLPVVEIVGSPTSKVQNEGKFVHHTLADGDFKHFMKMHEPVTAARTLLTAENATVEIDRVLSALLKERKPVYINLPVDVAAAKAEKPSLPLKKENPTSNTSDQEILNKIQESLKNAKKPIVITGHEIISFGLEKTVTQFISKTKLPITTLNFGKSSVDETLPSFLGIYNGKLSEPNLKEFVESADFILMLGVKLTDSSTGAFTHHLNENKMISLNINEGKIFNERIQNFDFESLISSLLDLSGIEYKGKYIDKKQEDFVPSNALLSQDRLWQAVENLTQSNETIVAEQGTSFFGASSIFLKPKSHFIGQPLWGSIGYTFPAALGSQIADKESRHLLFIGDGSLQLTVQERKLQVQVSQPSSSHMNSYS,./data/raw/alphafold//AF-A0A2X0Q412-F1-model_v4.pdb,3371,1869,2767,1223 +1244,25369,25777,MWRLPRALCVHAAKTSKLSGPWSRPAAFMSTLLINQPQYAWLKELGLREENEGVYNGSWGGRGEVITTYCPANNEPIARVRQASVADYEETVKKAREAWKIWADIPAPKRGEIVRQIGDALREKIQVLGSLVSLEMGKILVEGVGEVQEYVDICDYAVGLSRMIGGPILPSERSGHALIEQWNPVGLVGIITAFNFPVAVYGWNNAIAMICGNVCLWKGAPTTSLISVAVTKIIAKVLEDNKLPGAICSLTCGGADIGTAMAKDERVNLLSFTGSTQVGKQVGLMVQERFGRSLLELGGNNAIIAFEDADLSLVVPSALFAAVGTAGQRCTTARRLFIHESIHDEVVNRLKKAYAQIRVGNPWDPNVLYGPLHTKQAVSMFLGAVEEAKKEGGTVVYGGKVMDRPGNYVEPTIVTGLGHDASIAHTETFAPILYVFKFKNEEEVFAWNNEVKQGLSSSIFTKDLGRIFRWLGPKGSDCGIVNVNIPTSGAEIGGAFGGEKHTGGGRESGSDAWKQYMRRSTCTINYSKDLPLAQGIKFQ,uniprot_search,P49419,N[C@@H](CCCC=O)C(=O)O,0.181,30.0,7.416666666666667,1.2.1.31,9606.0,-0.7423214251308154,-0.7522520485493192,N[C@@H](CCCC=O)C(=O)O__MWRLPRALCVHAAKTSKLSGPWSRPAAFMSTLLINQPQYAWLKELGLREENEGVYNGSWGGRGEVITTYCPANNEPIARVRQASVADYEETVKKAREAWKIWADIPAPKRGEIVRQIGDALREKIQVLGSLVSLEMGKILVEGVGEVQEYVDICDYAVGLSRMIGGPILPSERSGHALIEQWNPVGLVGIITAFNFPVAVYGWNNAIAMICGNVCLWKGAPTTSLISVAVTKIIAKVLEDNKLPGAICSLTCGGADIGTAMAKDERVNLLSFTGSTQVGKQVGLMVQERFGRSLLELGGNNAIIAFEDADLSLVVPSALFAAVGTAGQRCTTARRLFIHESIHDEVVNRLKKAYAQIRVGNPWDPNVLYGPLHTKQAVSMFLGAVEEAKKEGGTVVYGGKVMDRPGNYVEPTIVTGLGHDASIAHTETFAPILYVFKFKNEEEVFAWNNEVKQGLSSSIFTKDLGRIFRWLGPKGSDCGIVNVNIPTSGAEIGGAFGGEKHTGGGRESGSDAWKQYMRRSTCTINYSKDLPLAQGIKFQ,./data/raw/alphafold//AF-P49419-F1-model_v4.pdb,5814,2631,3286,4112 +1245,10130,10284,METLDSGGVTMPTENGGADLDTLRHRKPRSDSSNGLLPDSVTVSDADVRDRVDSAVEDTQGKANLAGENEIRESGGGGGEAGGNVDVRYTYRPSVPAHRRVRESPLSSDAIFKQSHAGLFNLCVVVLVAVNSRLIIENLMKYGWLIRTDFWFSSTSLRDWPLFMCCLSLSIFPLAAFTVEKLVLQKCISEPVVIFLHVIITMTEVLYPVYVTLRCDSAFLSGVTLMLLTCIVWLKLVSYAHTNYDIRTLANSSDKANPEVSYYVSLKSLAYFMLAPTLCYQPSYPRSPCIRKGWVARQFAKLIIFTGFMGFIIEQYINPIVRNSKHPLKGDLLYGIERVLKLSVPNLYVWLCMFYCFFHLWLNILAELLCFGDREFYKDWWNAKSVGDYWRMWNMPVHKWMVRHVYFPCLRRNIPKVPAIILAFLVSAVFHELCIAVPCRLFKLWAFLGIMFQVPLVFITNYLQERFGSMVGNMIFWFTFCIFGQPMCVLLYYHDLMNRKGKMS,brenda,K9LL63,CCCCCCCC/C=C\CCCCCCCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.00061,30.0,7.4,2.3.1.20,3708.0,-3.214670164989233,-3.214670164989233,CCCCCCCC/C=C\CCCCCCCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__METLDSGGVTMPTENGGADLDTLRHRKPRSDSSNGLLPDSVTVSDADVRDRVDSAVEDTQGKANLAGENEIRESGGGGGEAGGNVDVRYTYRPSVPAHRRVRESPLSSDAIFKQSHAGLFNLCVVVLVAVNSRLIIENLMKYGWLIRTDFWFSSTSLRDWPLFMCCLSLSIFPLAAFTVEKLVLQKCISEPVVIFLHVIITMTEVLYPVYVTLRCDSAFLSGVTLMLLTCIVWLKLVSYAHTNYDIRTLANSSDKANPEVSYYVSLKSLAYFMLAPTLCYQPSYPRSPCIRKGWVARQFAKLIIFTGFMGFIIEQYINPIVRNSKHPLKGDLLYGIERVLKLSVPNLYVWLCMFYCFFHLWLNILAELLCFGDREFYKDWWNAKSVGDYWRMWNMPVHKWMVRHVYFPCLRRNIPKVPAIILAFLVSAVFHELCIAVPCRLFKLWAFLGIMFQVPLVFITNYLQERFGSMVGNMIFWFTFCIFGQPMCVLLYYHDLMNRKGKMS,./data/raw/alphafold//AF-K9LL63-F1-model_v4.pdb,5527,3067,3793,4409 +1246,22890,23243,MANCEFSPVSGDKPCCRLSRRAQLCLGVSILVLILVVVLAVVVPRWRQQWSGPGTTKRFPETVLARCVKYTEIHPEMRHVDCQSVWDAFKGAFISKHPCNITEEDYQPLMKLGTQTVPCNKILLWSRIKDLAHQFTQVQRDMFTLEDTLLGYLADDLTWCGEFNTSKINYQSCPDWRKDCSNNPVSVFWKTVSRRFAEAACDVVHVMLNGSRSKIFDKNSTFGSVEVHNLQPEKVQTLEAWVIHGGREDSRDLCQDPTIKELESIISKRNIQFSCKNIYRPDKFLQCVKNPEDSSCTSEI,sabio,P28907,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.048,21.0,7.8,3.2.2.5,9606.0,-1.3187587626244128,-1.3187587626244128,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MANCEFSPVSGDKPCCRLSRRAQLCLGVSILVLILVVVLAVVVPRWRQQWSGPGTTKRFPETVLARCVKYTEIHPEMRHVDCQSVWDAFKGAFISKHPCNITEEDYQPLMKLGTQTVPCNKILLWSRIKDLAHQFTQVQRDMFTLEDTLLGYLADDLTWCGEFNTSKINYQSCPDWRKDCSNNPVSVFWKTVSRRFAEAACDVVHVMLNGSRSKIFDKNSTFGSVEVHNLQPEKVQTLEAWVIHGGREDSRDLCQDPTIKELESIISKRNIQFSCKNIYRPDKFLQCVKNPEDSSCTSEI,./data/raw/alphafold//AF-P28907-F1-model_v4.pdb,4259,5398,6095,7434 +1247,29097,29619,MELFLAGRRVLVTGAGKGIGRGTVQALHATGARVVAVSRTQADLDSLVRECPGIEPVCVDLGDWEATERALGSVGPVDLLVNNAAVALLQPFLEVTKEAFDRSFEVNLRAVIQVSQIVARGLIARGVPGAIVNVSSQCSQRAVTNHSVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTSMGQATWSDPHKAKTMLNRIPLGKFAEVEHVVNAILFLLSDRSGMTTGSTLPVEGGFWAC,brenda,Q7Z4W1,O=C(CO)CO,1.6,25.0,7.0,1.1.1.10,9606.0,0.2041199826559248,0.2041199826559248,O=C(CO)CO__MELFLAGRRVLVTGAGKGIGRGTVQALHATGARVVAVSRTQADLDSLVRECPGIEPVCVDLGDWEATERALGSVGPVDLLVNNAAVALLQPFLEVTKEAFDRSFEVNLRAVIQVSQIVARGLIARGVPGAIVNVSSQCSQRAVTNHSVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTSMGQATWSDPHKAKTMLNRIPLGKFAEVEHVVNAILFLLSDRSGMTTGSTLPVEGGFWAC,./data/raw/alphafold//AF-Q7Z4W1-F1-model_v4.pdb,3403,841,1006,1241 +1248,17237,17487,MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,brenda,Q9Y5Y6,Cc1cc(=O)oc2cc(C(O)=NC(=O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)[C@H](CCCCN)N=C(O)OC(C)(C)C)ccc12,0.0136,25.0,7.6,3.4.21.109,9606.0,-1.8664610916297824,-1.8664610916297824,Cc1cc(=O)oc2cc(C(O)=NC(=O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)[C@H](CCCCN)N=C(O)OC(C)(C)C)ccc12__MGSDRARKGGGGPKDFGAGLKYNSRHEKVNGLEEGVEFLPVNNVKKVEKHGPGRWVVLAAVLIGLLLVLLGIGFLVWHLQYRDVRVQKVFNGYMRITNENFVDAYENSNSTEFVSLASKVKDALKLLYSGVPFLGPYHKESAVTAFSEGSVIAYYWSEFSIPQHLVEEAERVMAEERVVMLPPRARSLKSFVVTSVVAFPTDSKTVQRTQDNSCSFGLHARGVELMRFTTPGFPDSPYPAHARCQWALRGDADSVLSLTFRSFDLASCDERGSDLVTVYNTLSPMEPHALVQLCGTYPPSYNLTFHSSQNVLLITLITNTERRHPGFEATFFQLPRMSSCGGRLRKAQGTFNSPYYPGHYPPNIDCTWNIEVPNNQHVKVRFKFFYLLEPGVPAGTCPKDYVEINGEKYCGERSQFVVTSNSNKITVRFHSDQSYTDTGFLAEYLSYDSSDPCPGQFTCRTGRCIRKELRCDGWADCTDHSDELNCSCDAGHQFTCKNKFCKPLFWVCDSVNDCGDNSDEQGCSCPAQTFRCSNGKCLSKSQQCNGKDDCGDGSDEASCPKVNVVTCTKHTYRCLNGLCLSKGNPECDGKEDCSDGSDEKDCDCGLRSFTRQARVVGGTDADEGEWPWQVSLHALGQGHICGASLISPNWLVSAAHCYIDDRGFRYSDPTQWTAFLGLHDQSQRSAPGVQERRLKRIISHPFFNDFTFDYDIALLELEKPAEYSSMVRPICLPDASHVFPAGKAIWVTGWGHTQYGGTGALILQKGEIRVINQTTCENLLPQQITPRMMCVGFLSGGVDSCQGDSGGPLSSVEADGRIFQAGVVSWGDGCAQRNKPGVYTRLPLFRDWIKENTGV,./data/raw/alphafold//AF-Q9Y5Y6-F1-model_v4.pdb,133,2878,3569,4141 +1249,9699,9850,MPAHSLVMSSPALPAFLLCSTLLVIKMYVVAIITGQVRLRKKAFANPEDALRHGGPQYCRSDPDVERCLRAHRNDMETIYPFLFLGFVYSFLGPNPFVAWMHFLVFLVGRVAHTVAYLGKLRAPIRSVTYTLAQLPCASMALQILWEAARHL,sabio,O14684,CCCCCC(O)C=CC1C2CC(OO2)C1CC=CCCCC(=O)O,0.0024,20.0,7.0,5.3.99.3,9606.0,-2.619788758288394,-1.023403960021961,CCCCCC(O)C=CC1C2CC(OO2)C1CC=CCCCC(=O)O__MPAHSLVMSSPALPAFLLCSTLLVIKMYVVAIITGQVRLRKKAFANPEDALRHGGPQYCRSDPDVERCLRAHRNDMETIYPFLFLGFVYSFLGPNPFVAWMHFLVFLVGRVAHTVAYLGKLRAPIRSVTYTLAQLPCASMALQILWEAARHL,./data/raw/alphafold//AF-O14684-F1-model_v4.pdb,224,3000,3714,4314 +1250,29216,29739,MIKKIGVLTSGGDAPGMNAAIRGVVRSALTEGLEVMGIYDGYLGLYEDRMVQLDRYSVSDMINRGGTFLGSARFPEFRDENIRAVAIENLKKRGIDALVVIGGDGSYMGAMRLTEMGFPCIGLPGTIDNDIKGTDYTIGFFTALSTVVEAIDRLRDTSSSHQRISVVEVMGRYCGDLTLAAAIAGGCEFVVVPEVEFSREDLVNEIKAGIAKGKKHAIVAITEHMCDVDELAHFIEKETGRETRATVLGHIQRGGSPVPYDRILASRMGAYAIDLLLAGYGGRCVGIQNEQLVHHDIIDAIENMKRPFKGDWLDCAKKLY,brenda,P0A796,O=C(CO)[C@@H](O)[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)O,2.5,55.0,7.0,2.7.1.11,562.0,0.3979400086720376,0.3979400086720376,O=C(CO)[C@@H](O)[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)O__MIKKIGVLTSGGDAPGMNAAIRGVVRSALTEGLEVMGIYDGYLGLYEDRMVQLDRYSVSDMINRGGTFLGSARFPEFRDENIRAVAIENLKKRGIDALVVIGGDGSYMGAMRLTEMGFPCIGLPGTIDNDIKGTDYTIGFFTALSTVVEAIDRLRDTSSSHQRISVVEVMGRYCGDLTLAAAIAGGCEFVVVPEVEFSREDLVNEIKAGIAKGKKHAIVAITEHMCDVDELAHFIEKETGRETRATVLGHIQRGGSPVPYDRILASRMGAYAIDLLLAGYGGRCVGIQNEQLVHHDIIDAIENMKRPFKGDWLDCAKKLY,./data/raw/alphafold//AF-P0A796-F1-model_v4.pdb,1327,6816,6130,7471 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+1262,15096,15309,MKALSKLKAEEGIWMTDVPVPELGHNDLLIKIRKTAICGTDVHIYNWDEWSQKTIPVPMVVGHEYVGEVVGIGQEVKGFKIGDRVSGEGHITCGHCRNCRGGRTHLCRNTIGVGVNRPGCFAEYLVIPAFNAFKIPDNISDDLAAIFDPFGNAVHTALSFDLVGEDVLVSGAGPIGIMAAAVAKHVGARNVVITDVNEYRLELARKMGITRAVNVAKENLNDVMAELGMTEGFDVGLEMSGAPPAFRTMLDTMNHGGRIAMLGIPPSDMSIDWTKVIFKGLFIKGIYGREMFETWYKMAALIQSGLDLSPIITHRFSIDDFQKGFDAMRSGQSGKVILSWD,brenda,P07913,C[C@@H](O)[C@H](N)C(=O)O,0.01129,37.0,8.8,1.1.1.103,562.0,-1.947306058075032,-1.947306058075032,C[C@@H](O)[C@H](N)C(=O)O__MKALSKLKAEEGIWMTDVPVPELGHNDLLIKIRKTAICGTDVHIYNWDEWSQKTIPVPMVVGHEYVGEVVGIGQEVKGFKIGDRVSGEGHITCGHCRNCRGGRTHLCRNTIGVGVNRPGCFAEYLVIPAFNAFKIPDNISDDLAAIFDPFGNAVHTALSFDLVGEDVLVSGAGPIGIMAAAVAKHVGARNVVITDVNEYRLELARKMGITRAVNVAKENLNDVMAELGMTEGFDVGLEMSGAPPAFRTMLDTMNHGGRIAMLGIPPSDMSIDWTKVIFKGLFIKGIYGREMFETWYKMAALIQSGLDLSPIITHRFSIDDFQKGFDAMRSGQSGKVILSWD,./data/raw/alphafold//AF-P07913-F1-model_v4.pdb,5802,2611,3262,3759 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+1264,26050,26492,MSQEVIRGIALPPPAQPGDPLARVDTPSLVLDLAPFEANLRAMQAWADRHDVALRPHAKAHKCPEIALRQLALGARGICCQKVSEALPFVAAGIQDIHISNEVVGPAKLALLGQLARVAKISVCVDNAHNLSQVSQAMVQAGAQIDVLVEVDVGQGRCGVSDDALVLALAQQARDLPGVNFAGLQAYHGSVQHYRTREERAEVCRQAARIAASYAQLLRESGIACDTITGGGTGSAEFDAASGVYTELQAGSYAFMDGDYGANEWDGPLAFENSLFVLATVMSKPAPDRVILDAGLKSTTAECGPPAIFGEPGLTYTAINDEHGVVRVEPGAQAPDLGAVLRLVPSHVDPTFNLHDGLVVVRDGVVEDIWEISARGFSR,brenda,O82872,N[C@H](C(=O)O)C(O)c1ccc2c(c1)OCO2,2.0,30.0,8.0,4.1.2.42,1667.0,0.3010299956639812,0.3494850021680094,N[C@H](C(=O)O)C(O)c1ccc2c(c1)OCO2__MSQEVIRGIALPPPAQPGDPLARVDTPSLVLDLAPFEANLRAMQAWADRHDVALRPHAKAHKCPEIALRQLALGARGICCQKVSEALPFVAAGIQDIHISNEVVGPAKLALLGQLARVAKISVCVDNAHNLSQVSQAMVQAGAQIDVLVEVDVGQGRCGVSDDALVLALAQQARDLPGVNFAGLQAYHGSVQHYRTREERAEVCRQAARIAASYAQLLRESGIACDTITGGGTGSAEFDAASGVYTELQAGSYAFMDGDYGANEWDGPLAFENSLFVLATVMSKPAPDRVILDAGLKSTTAECGPPAIFGEPGLTYTAINDEHGVVRVEPGAQAPDLGAVLRLVPSHVDPTFNLHDGLVVVRDGVVEDIWEISARGFSR,./data/raw/alphafold//AF-O82872-F1-model_v4.pdb,5823,2645,3300,3814 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+1267,10303,10458,MAAGFGRCCRVLRSISRFHWRSQHTKANRQREPGLGFSFEFTEQQKEFQATARKFAREEIIPVAAEYDKTGEYPVPLIRRAWELGLMNTHIPENCGGLGLGTFDACLISEELAYGCTGVQTAIEGNSLGQMPIIIAGNDQQKKKYLGRMTEEPLMCAYCVTEPGAGSDVAGIKTKAEKKGDEYIINGQKMWITNGGKANWYFLLARSDPDPKAPANKAFTGFIVEADTPGIQIGRKELNMGQRCSDTRGIVFEDVKVPKENVLIGDGAGFKVAMGAFDKTRPVVAAGAVGLAQRALDEATKYALERKTFGKLLVEHQAISFMLAEMAMKVELARMSYQRAAWEVDSGRRNTYYASIAKAFAGDIANQLATDAVQILGGNGFNTEYPVEKLMRDAKIYQIYEGTSQIQRLIVAREHIDKYKN,sabio,P11310,CCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O,0.0029,25.0,7.6,1.3.8.7,9606.0,-2.537602002101044,-2.3935402003693045,CCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O__MAAGFGRCCRVLRSISRFHWRSQHTKANRQREPGLGFSFEFTEQQKEFQATARKFAREEIIPVAAEYDKTGEYPVPLIRRAWELGLMNTHIPENCGGLGLGTFDACLISEELAYGCTGVQTAIEGNSLGQMPIIIAGNDQQKKKYLGRMTEEPLMCAYCVTEPGAGSDVAGIKTKAEKKGDEYIINGQKMWITNGGKANWYFLLARSDPDPKAPANKAFTGFIVEADTPGIQIGRKELNMGQRCSDTRGIVFEDVKVPKENVLIGDGAGFKVAMGAFDKTRPVVAAGAVGLAQRALDEATKYALERKTFGKLLVEHQAISFMLAEMAMKVELARMSYQRAAWEVDSGRRNTYYASIAKAFAGDIANQLATDAVQILGGNGFNTEYPVEKLMRDAKIYQIYEGTSQIQRLIVAREHIDKYKN,./data/raw/alphafold//AF-P11310-F1-model_v4.pdb,4870,2873,2367,2315 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+1269,3176,3230,MRIYVLGAGSIGSLFGALLARAGNDVTLIGRREQVDAINKNGLHVFGAEEFTVKPKATIYAPEEPPDLLILAVKSYSTKTALECARQCIGRNTWVLSIQNGLGNEELALKYTPNVMGGVTTNGAMLVEWGKVLWAGKGITVIGRYPTGRDDFVDEVASVFNEAGIDTSVTENAIGWKWAKAIVNSVINGLGTVLEVKNGHLKDDPHLEGISVDIAREGCMVAQQLGIEFEIHPLELLWDTIERTRENYNSTLQDIWRGRETEVDYIHGKIVEYARSVGMEAPRNELLWVLVKAKERINRGKTRNISEGC,brenda,Q5JGC2,CC(C)(CO)[C@@H](O)C(=O)O,0.13,70.0,6.4,1.1.1.169,311400.0,-0.8860566476931633,-0.2882132401336322,CC(C)(CO)[C@@H](O)C(=O)O__MRIYVLGAGSIGSLFGALLARAGNDVTLIGRREQVDAINKNGLHVFGAEEFTVKPKATIYAPEEPPDLLILAVKSYSTKTALECARQCIGRNTWVLSIQNGLGNEELALKYTPNVMGGVTTNGAMLVEWGKVLWAGKGITVIGRYPTGRDDFVDEVASVFNEAGIDTSVTENAIGWKWAKAIVNSVINGLGTVLEVKNGHLKDDPHLEGISVDIAREGCMVAQQLGIEFEIHPLELLWDTIERTRENYNSTLQDIWRGRETEVDYIHGKIVEYARSVGMEAPRNELLWVLVKAKERINRGKTRNISEGC,./data/raw/alphafold//AF-Q5JGC2-F1-model_v4.pdb,3796,1499,2305,2244 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+1302,27537,28014,MTHEEHHAARTLGVGKAIAVLTSGGDAQGMNAAVRAVVRVGIFTGARVFFVHEGYQGLVDGGDHIREATWESVSMMLQLGGTVIGSARCKDFREREGRLRAAHNLVKRGITNLCVIGGDGSLTGADTFRSEWSDLLSDLQKAGKITAEEATRSSYLNIVGLVGSIDNDFCGTDMTIGTDSALHRITEIVDAITTTAQSHQRTFVLEVMGRHCGYLALVTSLSCGADWVFIPECPPDDNWEDHLCRRLSETRTRGSRLNIIIVAEGAIDRNGKPITSEGVKDLVVRRLGYDTRVTVLGHVQRGGTPSAFDRILGSRMGVEAVMALLEGTPDTPACVVSLSGNQAVRLPLMECVQVTKDVTKAMDEKRFDEAMKLRGRSFMNNWEVYKLLAHIRPPAPKSGSYTVAVMNVGAPAAGMNAAVRSTVRIGLIQGNRVLVVHDGFEGPAKGQIEEAGWSYVGGWTGQGGSKLGSKRTLPKKSFEQISANITKFNIQGLVIIGGFEAYTGGLELMEGRKQFDELCIPFVVIPATVSNNVPGSDFSVGADTALNTICTTCDRIKQSAAGTKRRVFIIETMGGYCGYLATMAGLAAGADAAYIFEEPFTIRDLQANVEHLVQKMKTTVKRGLVLRNEKCNENYTTDFIFNLYSEEGKGIFDSRKNVLGHMQQGGSPTPFDRNFATKMGAKAMNWMAGKIKESYRNGRIFANTPDSGCVLGMRKRALVFQPVTELQNQTDFEHRIPKEQWWLKLRPILKILAKYEIDLDTSEHAHLEHISRKRSGEATV,sabio,P00511,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,0.023,22.0,8.0,2.7.1.11,9986.0,-1.6382721639824072,-1.644681480641206,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MTHEEHHAARTLGVGKAIAVLTSGGDAQGMNAAVRAVVRVGIFTGARVFFVHEGYQGLVDGGDHIREATWESVSMMLQLGGTVIGSARCKDFREREGRLRAAHNLVKRGITNLCVIGGDGSLTGADTFRSEWSDLLSDLQKAGKITAEEATRSSYLNIVGLVGSIDNDFCGTDMTIGTDSALHRITEIVDAITTTAQSHQRTFVLEVMGRHCGYLALVTSLSCGADWVFIPECPPDDNWEDHLCRRLSETRTRGSRLNIIIVAEGAIDRNGKPITSEGVKDLVVRRLGYDTRVTVLGHVQRGGTPSAFDRILGSRMGVEAVMALLEGTPDTPACVVSLSGNQAVRLPLMECVQVTKDVTKAMDEKRFDEAMKLRGRSFMNNWEVYKLLAHIRPPAPKSGSYTVAVMNVGAPAAGMNAAVRSTVRIGLIQGNRVLVVHDGFEGPAKGQIEEAGWSYVGGWTGQGGSKLGSKRTLPKKSFEQISANITKFNIQGLVIIGGFEAYTGGLELMEGRKQFDELCIPFVVIPATVSNNVPGSDFSVGADTALNTICTTCDRIKQSAAGTKRRVFIIETMGGYCGYLATMAGLAAGADAAYIFEEPFTIRDLQANVEHLVQKMKTTVKRGLVLRNEKCNENYTTDFIFNLYSEEGKGIFDSRKNVLGHMQQGGSPTPFDRNFATKMGAKAMNWMAGKIKESYRNGRIFANTPDSGCVLGMRKRALVFQPVTELQNQTDFEHRIPKEQWWLKLRPILKILAKYEIDLDTSEHAHLEHISRKRSGEATV,./data/raw/alphafold//AF-P00511-F1-model_v4.pdb,2610,6619,2885,8030 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+1304,14672,14883,MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,uniprot_search,P23946,CSCC[C@H](N=C(O)CC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1,0.44,45.66666666666666,8.375,3.4.21.39,9606.0,-0.3565473235138126,-0.3565473235138126,CSCC[C@H](N=C(O)CC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1__MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,./data/raw/alphafold//AF-P23946-F1-model_v4.pdb,5183,2024,1510,3023 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+1307,25884,26317,MYTFVVRDENSSVYAEVSRLLLATGHWKRLRRDNPRFNLMLGERNRLPFGRLGHEPGLMQLVNYYRGADKLCRKASLVKLIKTSPELAESCTWFPESYVIYPTNLKTPVAPAQNGIHPPIHSSRTDEREFFLTSYNKKKEDGEGNVWIAKSSAGAKGEGILISSEATELLDFIDNQGQVHVIQKYLERPLLLEPGHRKFDIRSWVLVDHQYNIYLYREGVLRTASEPYHTDNFQDKTCHLTNHCIQKEYSKNYGKYEEGNEMFFEEFNQYLTSALNITLESSILLQIKHIIRSCLLSVEPAISTRHLPYQSFQLFGFDFMVDEDLKVWLIEVNGAPACAQKLYAELCQGIVDIAIASVFPPPDAEQQQQQPPPAAFIKL,uniprot_search,P38160,N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.0068,37.0,8.0,6.3.2.25,9823.0,-2.167491087293764,-1.8813286853369129,N[C@@H](Cc1ccc(O)cc1)C(=O)O__MYTFVVRDENSSVYAEVSRLLLATGHWKRLRRDNPRFNLMLGERNRLPFGRLGHEPGLMQLVNYYRGADKLCRKASLVKLIKTSPELAESCTWFPESYVIYPTNLKTPVAPAQNGIHPPIHSSRTDEREFFLTSYNKKKEDGEGNVWIAKSSAGAKGEGILISSEATELLDFIDNQGQVHVIQKYLERPLLLEPGHRKFDIRSWVLVDHQYNIYLYREGVLRTASEPYHTDNFQDKTCHLTNHCIQKEYSKNYGKYEEGNEMFFEEFNQYLTSALNITLESSILLQIKHIIRSCLLSVEPAISTRHLPYQSFQLFGFDFMVDEDLKVWLIEVNGAPACAQKLYAELCQGIVDIAIASVFPPPDAEQQQQQPPPAAFIKL,./data/raw/alphafold//AF-P38160-F1-model_v4.pdb,4831,6062,7841,12120 +1308,17600,17857,MRPQELPRLAFPLLLLLLLLLPPPPCPAHSATRFDPTWESLDARQLPAWFDQAKFGIFIHWGVFSVPSFGSEWFWWYWQKEKIPKYVEFMKDNYPPSFKYEDFGPLFTAKFFNANQWADIFQASGAKYIVLTSKHHEGFTLWGSEYSWNWNAIDEGPKRDIVKELEVAIRNRTDLRFGLYYSLFEWFHPLFLEDESSSFHKRQFPVSKTLPELYELVNNYQPEVLWSDGDGGAPDQYWNSTGFLAWLYNESPVRGTVVTNDRWGAGSICKHGGFYTCSDRYNPGHLLPHKWENCMTIDKLSWGYRREAGISDYLTIEELVKQLVETVSCGGNLLMNIGPTLDGTISVVFEERLRQMGSWLKVNGEAIYETHTWRSQNDTVTPDVWYTSKPKEKLVYAIFLKWPTSGQLFLGHPKAILGATEVKLLGHGQPLNWISLEQNGIMVELPQLTIHQMPCKWGWALALTNVI,sabio,Q9BTY2,Cc1cc(=O)oc2cc(O[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12,1.0,37.0,6.0,3.2.1.51,9606.0,0.0,-0.1879457843197479,Cc1cc(=O)oc2cc(O[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12__MRPQELPRLAFPLLLLLLLLLPPPPCPAHSATRFDPTWESLDARQLPAWFDQAKFGIFIHWGVFSVPSFGSEWFWWYWQKEKIPKYVEFMKDNYPPSFKYEDFGPLFTAKFFNANQWADIFQASGAKYIVLTSKHHEGFTLWGSEYSWNWNAIDEGPKRDIVKELEVAIRNRTDLRFGLYYSLFEWFHPLFLEDESSSFHKRQFPVSKTLPELYELVNNYQPEVLWSDGDGGAPDQYWNSTGFLAWLYNESPVRGTVVTNDRWGAGSICKHGGFYTCSDRYNPGHLLPHKWENCMTIDKLSWGYRREAGISDYLTIEELVKQLVETVSCGGNLLMNIGPTLDGTISVVFEERLRQMGSWLKVNGEAIYETHTWRSQNDTVTPDVWYTSKPKEKLVYAIFLKWPTSGQLFLGHPKAILGATEVKLLGHGQPLNWISLEQNGIMVELPQLTIHQMPCKWGWALALTNVI,./data/raw/alphafold//AF-Q9BTY2-F1-model_v4.pdb,852,4262,5703,6111 +1309,9752,9903,MRGKVSLEEAFELPKFAAQTKEKAELYIAPNNRDRYFEEILNPCGNRLELSNKHGIGYTIYSIYSPGPQGWTERAECEEYARECNDYISGEIANHKDRMGAFAALSMHDPKQASEELTRCVKELGFLGALVNDVQHAGPEGETHIFYDQPEWDIFWQTCVDLDVPFYLHPEPPFGSYLRNQYEGRKYLIGPPVSFANGVSLHVLGMIVNGVFDRFPKLKVILGHLGEHIPGDFWRIEHWFEHCSRPLAKSRGDVFAEKPLLHYFRNNIWLTTSGNFSTETLKFCVEHVGAERILFSVDSPYEHIDVGCGWYDDNAKAIMEAVGGEKAYKDIGRDNAKKLFKLGKFYDSEA,brenda,P0CT50,CCCCCC/C=C\CCCCCCCc1cccc(O)c1C(=O)O,0.046,35.0,5.5,4.1.1.91,1895941.0,-1.337242168318426,-1.337242168318426,CCCCCC/C=C\CCCCCCCc1cccc(O)c1C(=O)O__MRGKVSLEEAFELPKFAAQTKEKAELYIAPNNRDRYFEEILNPCGNRLELSNKHGIGYTIYSIYSPGPQGWTERAECEEYARECNDYISGEIANHKDRMGAFAALSMHDPKQASEELTRCVKELGFLGALVNDVQHAGPEGETHIFYDQPEWDIFWQTCVDLDVPFYLHPEPPFGSYLRNQYEGRKYLIGPPVSFANGVSLHVLGMIVNGVFDRFPKLKVILGHLGEHIPGDFWRIEHWFEHCSRPLAKSRGDVFAEKPLLHYFRNNIWLTTSGNFSTETLKFCVEHVGAERILFSVDSPYEHIDVGCGWYDDNAKAIMEAVGGEKAYKDIGRDNAKKLFKLGKFYDSEA,./data/raw/alphafold//AF-P0CT50-F1-model_v4.pdb,5485,3017,3738,4347 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+1387,4925,5003,MSSGLVLENTARRDALIAIEKKYQKIWAEEHQFEIDAPSIEDEPITMDSEELHRTYPKFMSSMAYPYMNGVMHAGHCFTLSKVEFSIGFERMNGKRALFPLGFHCTGMPILACADKLKREAELFGKNFDNVPAEEEEIKEETPAEKDHEDVTKFKAKKSKAAAKKGRGKYQFEIMLQLGIPREEIIKFADAKYWLTYFPPLCESDCTSLGARIDWRRSFVTTDANPYYDAFIRWQMNKLKAAGKIKFGERYTIYSEKDGQACMDHDRQSGEGVTPQEYIGVKIEALEFADDAAKIIDSSSDLDKSKKFYFVAATLRPETMYGQTCCFVSPTIEYGIFDAGDSYFITTERAFKNMSYQKLTPKRGFYKPIVTVPGKAFIGTKIHAPQSVYPELRILPMETVIATKGTGVVTCVPSNSPDDYITTKDLLHKPEYYGIKPEWIDHEIVPIMHTEKYGDLTAKAIVEEKKIQSPKDKNLLAEAKKIAYKEDYYTGTMIYGPYKGEKVEQAKNKVKADMIAAGEAFVYNEPESQVMSRSGDDCIVSLEDQWYVDYGEESWKKQAIECLEGMQLFAPEVKNAFEGVLDWLKNWAVCRTYGLGTRLPWDEKYLVESLSDSTIYQSFYTIAHLLFKDYYGNEIGPLGISADQMTDEVFDYIFQHQDDVKNTNIPLPALQKLRREFEYFYPLDVSISGKDLIPNHLTFFIYTHVALFPKKFWPKGIRANGHLMLNNSKMSKSTGNFMTLEQTVEKFGADAARIAFADAGDTVEDANFDESNANAAILRLFNLKEWAEEITKESNLRTGEITDFFDIAFEHEMNALIEKTYEQYALTNYKNALKYGLFDFQAARDYYREASGVMHKDLIARYIETQALLLAPIAPHFAEYIYREVLGNQTSVQNAKFPRASKPVDKGVLAALDYLRNLQRSIREGEGQALKKKKGKSAEIDASKPVKLTLLISESFPEWQSQCVEIVRKLFSEQTLDDNKKVREHIEPKEMKRAMPFISLLKQRLANEKPEDVFERELQFSEIDTVKAAARNVKKAAQALKIAEFSAISFPYGAKTGKDIFTGEEVEIPPVTKIVENAVPGNPGVVFQNI,brenda,P26637,CC(C)C[C@H](N)C(=O)O,0.0041,36.0,7.8,6.1.1.4,4932.0,-2.3872161432802645,-2.3872161432802645,CC(C)C[C@H](N)C(=O)O__MSSGLVLENTARRDALIAIEKKYQKIWAEEHQFEIDAPSIEDEPITMDSEELHRTYPKFMSSMAYPYMNGVMHAGHCFTLSKVEFSIGFERMNGKRALFPLGFHCTGMPILACADKLKREAELFGKNFDNVPAEEEEIKEETPAEKDHEDVTKFKAKKSKAAAKKGRGKYQFEIMLQLGIPREEIIKFADAKYWLTYFPPLCESDCTSLGARIDWRRSFVTTDANPYYDAFIRWQMNKLKAAGKIKFGERYTIYSEKDGQACMDHDRQSGEGVTPQEYIGVKIEALEFADDAAKIIDSSSDLDKSKKFYFVAATLRPETMYGQTCCFVSPTIEYGIFDAGDSYFITTERAFKNMSYQKLTPKRGFYKPIVTVPGKAFIGTKIHAPQSVYPELRILPMETVIATKGTGVVTCVPSNSPDDYITTKDLLHKPEYYGIKPEWIDHEIVPIMHTEKYGDLTAKAIVEEKKIQSPKDKNLLAEAKKIAYKEDYYTGTMIYGPYKGEKVEQAKNKVKADMIAAGEAFVYNEPESQVMSRSGDDCIVSLEDQWYVDYGEESWKKQAIECLEGMQLFAPEVKNAFEGVLDWLKNWAVCRTYGLGTRLPWDEKYLVESLSDSTIYQSFYTIAHLLFKDYYGNEIGPLGISADQMTDEVFDYIFQHQDDVKNTNIPLPALQKLRREFEYFYPLDVSISGKDLIPNHLTFFIYTHVALFPKKFWPKGIRANGHLMLNNSKMSKSTGNFMTLEQTVEKFGADAARIAFADAGDTVEDANFDESNANAAILRLFNLKEWAEEITKESNLRTGEITDFFDIAFEHEMNALIEKTYEQYALTNYKNALKYGLFDFQAARDYYREASGVMHKDLIARYIETQALLLAPIAPHFAEYIYREVLGNQTSVQNAKFPRASKPVDKGVLAALDYLRNLQRSIREGEGQALKKKKGKSAEIDASKPVKLTLLISESFPEWQSQCVEIVRKLFSEQTLDDNKKVREHIEPKEMKRAMPFISLLKQRLANEKPEDVFERELQFSEIDTVKAAARNVKKAAQALKIAEFSAISFPYGAKTGKDIFTGEEVEIPPVTKIVENAVPGNPGVVFQNI,./data/raw/alphafold//AF-P26637-F1-model_v4.pdb,2909,2016,1500,3007 +1388,22609,22960,MGRKVTVATCALNQWALDFEGNLQRILKSIEIAKNRGARYRLGPELEICGYGCWDHYYESDTLLHSFQVLAALVESPVTQDIICDVGMPVMHRNVRYNCRVIFLNRKILLIRPKMALANEGNYRELRWFTPWSRSRHTEEYFLPRMIQDLTKQETVPFGDAVLVTWDTCIGSEICEELWTPHSPHIDMGLDGVEIITNASGSHQVLRKANTRVDLVTMVTSKNGGIYLLANQKGCDGDRLYYDGCAMIAMNGSVFAQGSQFSLDDVEVLTATLDLEDVRSYRAEISSRNLAASRASPYPRVKVDFALSCHEDLLAPISEPIEWKYHSPEEEISLGPACWLWDFLRRSQQAGFLLPLSGGVDSAATACLIYSMCCQVCEAVRSGNEEVLADVRTIVNQISYTPQDPRDLCGRILTTCYMASKNSSQETCTRARELAQQIGSHHISLNIDPAVKAVMGIFSLVTGKSPLFAAHGGSSRENLALQNVQARIRMVLAYLFAQLSLWSRGVHGGLLVLGSANVDESLLGYLTKYDCSSADINPIGGISKTDLRAFVQFCIQRFQLPALQSILLAPATAELEPLADGQVSQTDEEDMGMTYAELSVYGKLRKVAKMGPYSMFCKLLGMWRHICTPRQVADKVKRFFSKYSMNRHKMTTLTPAYHAENYSPEDNRFDLRPFLYNTSWPWQFRCIENQVLQLERAEPQSLDGVD,sabio,Q6IA69,NC(=O)CCC(N)C(=O)O,1.44,37.0,,6.3.5.1,9606.0,0.1583624920952496,1.085599858400211,NC(=O)CCC(N)C(=O)O__MGRKVTVATCALNQWALDFEGNLQRILKSIEIAKNRGARYRLGPELEICGYGCWDHYYESDTLLHSFQVLAALVESPVTQDIICDVGMPVMHRNVRYNCRVIFLNRKILLIRPKMALANEGNYRELRWFTPWSRSRHTEEYFLPRMIQDLTKQETVPFGDAVLVTWDTCIGSEICEELWTPHSPHIDMGLDGVEIITNASGSHQVLRKANTRVDLVTMVTSKNGGIYLLANQKGCDGDRLYYDGCAMIAMNGSVFAQGSQFSLDDVEVLTATLDLEDVRSYRAEISSRNLAASRASPYPRVKVDFALSCHEDLLAPISEPIEWKYHSPEEEISLGPACWLWDFLRRSQQAGFLLPLSGGVDSAATACLIYSMCCQVCEAVRSGNEEVLADVRTIVNQISYTPQDPRDLCGRILTTCYMASKNSSQETCTRARELAQQIGSHHISLNIDPAVKAVMGIFSLVTGKSPLFAAHGGSSRENLALQNVQARIRMVLAYLFAQLSLWSRGVHGGLLVLGSANVDESLLGYLTKYDCSSADINPIGGISKTDLRAFVQFCIQRFQLPALQSILLAPATAELEPLADGQVSQTDEEDMGMTYAELSVYGKLRKVAKMGPYSMFCKLLGMWRHICTPRQVADKVKRFFSKYSMNRHKMTTLTPAYHAENYSPEDNRFDLRPFLYNTSWPWQFRCIENQVLQLERAEPQSLDGVD,./data/raw/alphafold//AF-Q6IA69-F1-model_v4.pdb,3905,4644,6441,6354 +1389,12254,12425,MFPGARILATLTLALHLLHGAHAAIGPAGNMYIVNEDVSPDGFARSAVVARSVPATDPTPATASIPGVLVQGNKGDNFQLNVVNQLSDTTMLKTTSIHWHGFFQAGSSWADGPAFVTQCPVASGDSFLYNFNVPDQAGTFWYHSHLSTQYCDGLRGPFVVYDPSDPHLSLYDIDNADTVITLEDWYHIVAPQNAAIPTPDSTLINGKGRYAGGPTSPLAIINVESNKRYRFRLVSMSCDPNFTFSIDGHSLLVIEADAVNIVPITVDSIQIFAGQRYSFVLTANQAVDNYWIRANPNLGSTGFVGGINSAILRYAGATEDDPTTTSSTSTPLLETNLVPLENPGAPGPPVPGGADININLAMAFDFTTFELTINGVPFLPPTAPVLLQILSGASTAASLLPSGSIYELEANKVVEISMPALAVGGPHPFHLHGHTFDVIRSAGSTTYNFDTPARRDVVNTGTGANDNVTIRFVTDNPGPWFLHCHIDWHLEIGLAVVFAEDVTSISAPPAAWDDLCPIYNALSDNDKGGIVPS,sabio,Q12739,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21,0.28,25.0,3.0,1.10.3.2,5322.0,-0.5528419686577808,-0.5528419686577808,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21__MFPGARILATLTLALHLLHGAHAAIGPAGNMYIVNEDVSPDGFARSAVVARSVPATDPTPATASIPGVLVQGNKGDNFQLNVVNQLSDTTMLKTTSIHWHGFFQAGSSWADGPAFVTQCPVASGDSFLYNFNVPDQAGTFWYHSHLSTQYCDGLRGPFVVYDPSDPHLSLYDIDNADTVITLEDWYHIVAPQNAAIPTPDSTLINGKGRYAGGPTSPLAIINVESNKRYRFRLVSMSCDPNFTFSIDGHSLLVIEADAVNIVPITVDSIQIFAGQRYSFVLTANQAVDNYWIRANPNLGSTGFVGGINSAILRYAGATEDDPTTTSSTSTPLLETNLVPLENPGAPGPPVPGGADININLAMAFDFTTFELTINGVPFLPPTAPVLLQILSGASTAASLLPSGSIYELEANKVVEISMPALAVGGPHPFHLHGHTFDVIRSAGSTTYNFDTPARRDVVNTGTGANDNVTIRFVTDNPGPWFLHCHIDWHLEIGLAVVFAEDVTSISAPPAAWDDLCPIYNALSDNDKGGIVPS,./data/raw/alphafold//AF-Q12739-F1-model_v4.pdb,5296,3332,4102,4781 +1390,32599,33179,MLKTTFANAEFANPFMNASGVHCMTTEDLEELKASQAGAYITKSSTLEKREGNPLPRYVDLELGSINSMGLPNLGFDYYLDYVLKNQKEKAQEAPIFFSIAGMSAAENIAMLKKIQESNFSGITELNLSCPNVPGKPQLAYDFEATEKLLKEVFTFFTKPLGVKLPPYFDLVHFDIMAEILNQFPLTYVNSVNSIGNGLFIDSEAESVVIKPKDGFGGIGGAYIKPTALANVRAFYTRLKPEIKIIGTGGIETGQDAFEHLLCGATMLQIGTALHKEGPAIFDRIIKELEEIMDKKGYQSIADFHGKLKSL,sabio,Q9CFC9,O=C1CC(C(=O)O)NC(=O)N1,0.018,25.0,8.0,1.3.98.1,1360.0,-1.744727494896694,-1.6003297252732092,O=C1CC(C(=O)O)NC(=O)N1__MLKTTFANAEFANPFMNASGVHCMTTEDLEELKASQAGAYITKSSTLEKREGNPLPRYVDLELGSINSMGLPNLGFDYYLDYVLKNQKEKAQEAPIFFSIAGMSAAENIAMLKKIQESNFSGITELNLSCPNVPGKPQLAYDFEATEKLLKEVFTFFTKPLGVKLPPYFDLVHFDIMAEILNQFPLTYVNSVNSIGNGLFIDSEAESVVIKPKDGFGGIGGAYIKPTALANVRAFYTRLKPEIKIIGTGGIETGQDAFEHLLCGATMLQIGTALHKEGPAIFDRIIKELEEIMDKKGYQSIADFHGKLKSL,./data/raw/alphafold//AF-Q9CFC9-F1-model_v4.pdb,314,3470,4732,4990 +1391,12082,12249,MLLLFHSKRMPVAEAPQVAGGQGDGGDGEEAEPEGMFKACEDSKRKARGYLRLVPLFVLLALLVLASAGVLLWYFLGYKAEVMVSQVYSGSLRVLNRHFSQDLTRRESSAFRSETAKAQKMLKELITSTRLGTYYNSSSVYSFGEGPLTCFFWFILQIPEHRRLMLSPEVVQALLVEELLSTVNSSAAVPYRAEYEVDPEGLVILEASVKDIAALNSTLGCYRYSYVGQGQVLRLKGPDHLASSCLWHLQGPKDLMLKLRLEWTLAECRDRLAMYDVAGPLEKRLITSVYGCSRQEPVVEVLASGAIMAVVWKKGLHSYYDPFVLSVQPVVFQACEVNLTLDNRLDSQGVLSTPYFPSYYSPQTHCSWHLTVPSLDYGLALWFDAYALRRQKYDLPCTQGQWTIQNRRLCGLRILQPYAERIPVVATAGITINFTSQISLTGPGVRVHYGLYNQSDPCPGEFLCSVNGLCVPACDGVKDCPNGLDERNCVCRATFQCKEDSTCISLPKVCDGQPDCLNGSDEEQCQEGVPCGTFTFQCEDRSCVKKPNPQCDGRPDCRDGSDEEHCDCGLQGPSSRIVGGAVSSEGEWPWQASLQVRGRHICGGALIADRWVITAAHCFQEDSMASTVLWTVFLGKVWQNSRWPGEVSFKVSRLLLHPYHEEDSHDYDVALLQLDHPVVRSAAVRPVCLPARSHFFEPGLHCWITGWGALREGGPISNALQKVDVQLIPQDLCSEVYRYQVTPRMLCAGYRKGKKDACQGDSGGPLVCKALSGRWFLAGLVSWGLGCGRPNYFGVYTRITGVISWIQQVVT,brenda,Q8IU80,CC[C@H](C)[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CO)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=N)O,35.5,25.0,7.4,3.4.21.109,9606.0,1.5502283530550942,1.5502283530550942,CC[C@H](C)[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CO)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=N)O__MLLLFHSKRMPVAEAPQVAGGQGDGGDGEEAEPEGMFKACEDSKRKARGYLRLVPLFVLLALLVLASAGVLLWYFLGYKAEVMVSQVYSGSLRVLNRHFSQDLTRRESSAFRSETAKAQKMLKELITSTRLGTYYNSSSVYSFGEGPLTCFFWFILQIPEHRRLMLSPEVVQALLVEELLSTVNSSAAVPYRAEYEVDPEGLVILEASVKDIAALNSTLGCYRYSYVGQGQVLRLKGPDHLASSCLWHLQGPKDLMLKLRLEWTLAECRDRLAMYDVAGPLEKRLITSVYGCSRQEPVVEVLASGAIMAVVWKKGLHSYYDPFVLSVQPVVFQACEVNLTLDNRLDSQGVLSTPYFPSYYSPQTHCSWHLTVPSLDYGLALWFDAYALRRQKYDLPCTQGQWTIQNRRLCGLRILQPYAERIPVVATAGITINFTSQISLTGPGVRVHYGLYNQSDPCPGEFLCSVNGLCVPACDGVKDCPNGLDERNCVCRATFQCKEDSTCISLPKVCDGQPDCLNGSDEEQCQEGVPCGTFTFQCEDRSCVKKPNPQCDGRPDCRDGSDEEHCDCGLQGPSSRIVGGAVSSEGEWPWQASLQVRGRHICGGALIADRWVITAAHCFQEDSMASTVLWTVFLGKVWQNSRWPGEVSFKVSRLLLHPYHEEDSHDYDVALLQLDHPVVRSAAVRPVCLPARSHFFEPGLHCWITGWGALREGGPISNALQKVDVQLIPQDLCSEVYRYQVTPRMLCAGYRKGKKDACQGDSGGPLVCKALSGRWFLAGLVSWGLGCGRPNYFGVYTRITGVISWIQQVVT,./data/raw/alphafold//AF-Q8IU80-F1-model_v4.pdb,5245,3305,4065,4733 +1392,8807,8953,MSSISDTVKRAREAFNSGKTRSLQFRIQQLEALQRMINENLKSISGALASDLGKNEWTSYYEEVAHVLEELDTTIKELPDWAEDEPVAKTRQTQQDDLYIHSEPLGVVLVIGAWNYPFNLTIQPMVGAVAAGNAVILKPSEVSGHMADLLATLIPQYMDQNLYLVVKGGVPETTELLKERFDHIMYTGSTAVGKIVMAAAAKHLTPVTLELGGKSPCYVDKDCDLDVACRRIAWGKFMNSGQTCVAPDYILCDPSIQNQIVEKLKKSLKDFYGEDAKQSRDYGRIINDRHFQRVKGLIDNQKVAHGGTWDQSSRYIAPTILVDVDPQSPVMQEEIFGPVMPIVCVRSLEEAIQFINQREKPLALYVFSNNEKVIKKMIAETSSGGVTANDVIVHITVPTLPFGGVGNSGMGAYHGKKSFETFSHRRSCLVKSLLNEEAHKARYPPSPAKMPRH,sabio,P11883,CCC=O,9.5,25.0,8.5,1.2.1.3,10116.0,0.9777236052888478,0.8579348470004539,CCC=O__MSSISDTVKRAREAFNSGKTRSLQFRIQQLEALQRMINENLKSISGALASDLGKNEWTSYYEEVAHVLEELDTTIKELPDWAEDEPVAKTRQTQQDDLYIHSEPLGVVLVIGAWNYPFNLTIQPMVGAVAAGNAVILKPSEVSGHMADLLATLIPQYMDQNLYLVVKGGVPETTELLKERFDHIMYTGSTAVGKIVMAAAAKHLTPVTLELGGKSPCYVDKDCDLDVACRRIAWGKFMNSGQTCVAPDYILCDPSIQNQIVEKLKKSLKDFYGEDAKQSRDYGRIINDRHFQRVKGLIDNQKVAHGGTWDQSSRYIAPTILVDVDPQSPVMQEEIFGPVMPIVCVRSLEEAIQFINQREKPLALYVFSNNEKVIKKMIAETSSGGVTANDVIVHITVPTLPFGGVGNSGMGAYHGKKSFETFSHRRSCLVKSLLNEEAHKARYPPSPAKMPRH,./data/raw/alphafold//AF-P11883-F1-model_v4.pdb,3753,1447,2239,2165 +1393,34169,34768,MDTARIAVVGAGVVGLSTAVCISKLVPRCSVTIISDKFTPDTTSDVAAGMLIPHTYPDTPIHTQKQWFRETFNHLFAIANSAEAGDAGVHLVSGWQIFQSTPTEEVPFWADVVLGFRKMTEAELKKFPQYVFGQAFTTLKCECPAYLPWLEKRIKGSGGWTLTRRIEDLWELHPSFDIVVNCSGLGSRQLAGDSKIFPVRGQVLQVQAPWVEHFIRDGSGLTYIYPGTSHVTLGGTRQKGDWNLSPDAENSREILSRCCALEPSLHGACNIREKVGLRPYRPGVRLQTELLARDGQRLPVVHHYGHGSGGISVHWGTALEAARLVSECVHALRTPIPKSNL,brenda,Q99489,O=O,0.34,25.0,8.3,1.4.3.1,9606.0,-0.4685210829577448,-0.4685210829577448,O=O__MDTARIAVVGAGVVGLSTAVCISKLVPRCSVTIISDKFTPDTTSDVAAGMLIPHTYPDTPIHTQKQWFRETFNHLFAIANSAEAGDAGVHLVSGWQIFQSTPTEEVPFWADVVLGFRKMTEAELKKFPQYVFGQAFTTLKCECPAYLPWLEKRIKGSGGWTLTRRIEDLWELHPSFDIVVNCSGLGSRQLAGDSKIFPVRGQVLQVQAPWVEHFIRDGSGLTYIYPGTSHVTLGGTRQKGDWNLSPDAENSREILSRCCALEPSLHGACNIREKVGLRPYRPGVRLQTELLARDGQRLPVVHHYGHGSGGISVHWGTALEAARLVSECVHALRTPIPKSNL,./data/raw/alphafold//AF-Q99489-F1-model_v4.pdb,2126,5644,4637,4880 +1394,8674,8818,MKAVVVPGKQKGYRIEEVSDPIPGKDEVVIRVNRAALCYRDLLQLQGFYPRMKYPVILGHEVVGTIEQIGENAKGFKEGDKVISLLYAPDGTCHYCQMGEEAYCHSRVGYSEELDGFFAEKAKVKVTSIVKVGTNVPDEGAVLVPCVTGMVYRSLRRAKLQKGETVLVTGASGGVGIHAIQVAKALGAKVIGVTTSEEKAAFIRKFADHVIVGSKFSEEAKKIGDVNVVIDTVGTPTIDESLKSLWMGGRLVQIGNVDPTQIYQLRLGYVILKDIAIIGHASATKRDAEETLKLTGEGKINPVIAATVGLDEIDKGYEILKDKHKIGKVLVKP,uniprot_search,Q9UXF1,CCC(O)CC,0.225,65.0,8.0,1.1.1.1,2287.0,-0.6478174818886375,-0.6478174818886375,CCC(O)CC__MKAVVVPGKQKGYRIEEVSDPIPGKDEVVIRVNRAALCYRDLLQLQGFYPRMKYPVILGHEVVGTIEQIGENAKGFKEGDKVISLLYAPDGTCHYCQMGEEAYCHSRVGYSEELDGFFAEKAKVKVTSIVKVGTNVPDEGAVLVPCVTGMVYRSLRRAKLQKGETVLVTGASGGVGIHAIQVAKALGAKVIGVTTSEEKAAFIRKFADHVIVGSKFSEEAKKIGDVNVVIDTVGTPTIDESLKSLWMGGRLVQIGNVDPTQIYQLRLGYVILKDIAIIGHASATKRDAEETLKLTGEGKINPVIAATVGLDEIDKGYEILKDKHKIGKVLVKP,./data/raw/alphafold//AF-Q9UXF1-F1-model_v4.pdb,3406,856,1028,1262 +1395,34919,35531,MADKTGTPHPLTEPGVWIERIGGRVFPPHLPALFLDRDGTINVDTDYPSDPAEIVLRPQMLPAIATANRAGIPVVVVTNQSGIARGYFGWSAFAAVNGRVLELLREEGVFVDMVLACAYHEAGVGPLAIPDHPMRKPNPGMLVEAGKRLALDLQRSLIVGDKLADMQAGKRAGLAQGWLVDGEAAVQPGFAIRPLRDSSELGDLLAAIETLGRDNRS,brenda,Q98I56,O=P(O)(O)OC[C@@H](O)[C@H]1O[C@H](OP(=O)(O)O)[C@@H](O)[C@@H](O)[C@@H]1O,0.58,25.0,7.5,3.1.3.82,381.0,-0.2365720064370627,-0.2365720064370627,O=P(O)(O)OC[C@@H](O)[C@H]1O[C@H](OP(=O)(O)O)[C@@H](O)[C@@H](O)[C@@H]1O__MADKTGTPHPLTEPGVWIERIGGRVFPPHLPALFLDRDGTINVDTDYPSDPAEIVLRPQMLPAIATANRAGIPVVVVTNQSGIARGYFGWSAFAAVNGRVLELLREEGVFVDMVLACAYHEAGVGPLAIPDHPMRKPNPGMLVEAGKRLALDLQRSLIVGDKLADMQAGKRAGLAQGWLVDGEAAVQPGFAIRPLRDSSELGDLLAAIETLGRDNRS,./data/raw/alphafold//AF-Q98I56-F1-model_v4.pdb,2238,7749,9541,10679 +1396,8581,8721,MWLLPLVLTSLASSATWAGQPASPPVVDTAQGRVLGKYVSLEGLAQPVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTSYPPMCCQDPVVEQMTSDLFTNGKERLTLEFSEDCLYLNIYTPADLTKRGRLPVMVWIHGGGLVLGGAPMYDGVVLAAHENVVVVAIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQENIANFGGDPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTVALVRKDMKAAAKQIAVLAGCKTTTSAVFVHCLRQKSEDELLDLTLKMKFLTLDFHGDQRESHPFLPTVVDGVLLPKMPEEILAEKDFNTVPYIVGINKQEFGWLLPTMMGFPLSEGKLDQKTATSLLWKSYPIANIPEELTPVATDKYLGGTDDPVKKKDLFLDLMGDVVFGVPSVTVARQHRDAGAPTYMYEFQYRPSFSSDKKPKTVIGDHGDEIFSVFGFPLLKGDAPEEEVSLSKTVMKFWANFARSGNPNGEGLPHWPMYDQEEGYLQIGVNTQAAKRLKGEEVAFWNDLLSKEAAKKPPKIKHAEL,uniprot_search,Q29550,CCC(C)[C@H](N)C(=O)OC[C@H]1O[C@@H](n2ccc(=N)nc2O)C(F)(F)[C@@H]1O,0.85,37.0,7.4,3.1.1.1,9823.0,-0.0705810742857072,-0.0705810742857072,CCC(C)[C@H](N)C(=O)OC[C@H]1O[C@@H](n2ccc(=N)nc2O)C(F)(F)[C@@H]1O__MWLLPLVLTSLASSATWAGQPASPPVVDTAQGRVLGKYVSLEGLAQPVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTSYPPMCCQDPVVEQMTSDLFTNGKERLTLEFSEDCLYLNIYTPADLTKRGRLPVMVWIHGGGLVLGGAPMYDGVVLAAHENVVVVAIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQENIANFGGDPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTVALVRKDMKAAAKQIAVLAGCKTTTSAVFVHCLRQKSEDELLDLTLKMKFLTLDFHGDQRESHPFLPTVVDGVLLPKMPEEILAEKDFNTVPYIVGINKQEFGWLLPTMMGFPLSEGKLDQKTATSLLWKSYPIANIPEELTPVATDKYLGGTDDPVKKKDLFLDLMGDVVFGVPSVTVARQHRDAGAPTYMYEFQYRPSFSSDKKPKTVIGDHGDEIFSVFGFPLLKGDAPEEEVSLSKTVMKFWANFARSGNPNGEGLPHWPMYDQEEGYLQIGVNTQAAKRLKGEEVAFWNDLLSKEAAKKPPKIKHAEL,./data/raw/alphafold//AF-Q29550-F1-model_v4.pdb,2994,3237,729,881 +1397,33258,33851,MIDLNIMKVANYINGEFKEPSTGAFQVKTSPVDGSKIAEVPRSGREDAREAIDSAFEALKAWANIPAIRRAEYLYKMLEVFRQMKEDFMKILTVEGGGTYRKVWGEVVFTERLIQNAAELARHYQGRVLQSDSESTISVVFKRSKGVVGVITPWNYPLSISMKKIAHTLAVGNTVVYKPASDTPVTGWLIAQMVAKAGLPKGVFNLVIGPGPVVGEEIVTHKRVAHVTFTGESSTGREIAAKAAGTLKTVTLELGGSDPLIILDDVDVDYAARLAVFASLFHQGQICTSAKRIIVHKAVADKFIERYVHYVKMLRIDDPRKDEKVDLGPLINERQVALMKEFVDDAVSRGGRLLIGGRSWGNFFEPAIFVDVDRNFRIMREEVFGPVRPIVVVENDDQAVEVANDTDYGLSGAVLTNNVNRAFRIAEAVESGMFHINDVTFLEESHVPFGGIKASGVGREGGEWSFHETTYDRWVTVTLRTRRFPIPSALK,brenda,G7VCG0,O=CC(O)CO,15.0,60.0,8.8,1.2.1.4,1104324.0,1.1760912590556811,1.1760912590556811,O=CC(O)CO__MIDLNIMKVANYINGEFKEPSTGAFQVKTSPVDGSKIAEVPRSGREDAREAIDSAFEALKAWANIPAIRRAEYLYKMLEVFRQMKEDFMKILTVEGGGTYRKVWGEVVFTERLIQNAAELARHYQGRVLQSDSESTISVVFKRSKGVVGVITPWNYPLSISMKKIAHTLAVGNTVVYKPASDTPVTGWLIAQMVAKAGLPKGVFNLVIGPGPVVGEEIVTHKRVAHVTFTGESSTGREIAAKAAGTLKTVTLELGGSDPLIILDDVDVDYAARLAVFASLFHQGQICTSAKRIIVHKAVADKFIERYVHYVKMLRIDDPRKDEKVDLGPLINERQVALMKEFVDDAVSRGGRLLIGGRSWGNFFEPAIFVDVDRNFRIMREEVFGPVRPIVVVENDDQAVEVANDTDYGLSGAVLTNNVNRAFRIAEAVESGMFHINDVTFLEESHVPFGGIKASGVGREGGEWSFHETTYDRWVTVTLRTRRFPIPSALK,./data/raw/alphafold//AF-G7VCG0-F1-model_v4.pdb,5061,1901,2803,2832 +1398,21749,22087,MAANAEPRRRPGVGVGVVVLSCEHPRCVLLGKRKGSFGAGSFQLPGGHLEFGETWEECAQRETWEEAGLHLKNVCFASVVNSFVEKENYHYVTILMKGEVDMTHDSEPRNMEPEKNESWEWVPWEEFPPLDQLFWALRCLKEQGYDPFKEDLNHLEGYRGEHLERTTKTP,brenda,Q8BG93,N=c1nc(O)c2nc(O)n([C@H]3C[C@@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O3)c2[nH]1,0.032,22.0,8.0,3.6.1.56,10090.0,-1.494850021680094,-1.494850021680094,N=c1nc(O)c2nc(O)n([C@H]3C[C@@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O3)c2[nH]1__MAANAEPRRRPGVGVGVVVLSCEHPRCVLLGKRKGSFGAGSFQLPGGHLEFGETWEECAQRETWEEAGLHLKNVCFASVVNSFVEKENYHYVTILMKGEVDMTHDSEPRNMEPEKNESWEWVPWEEFPPLDQLFWALRCLKEQGYDPFKEDLNHLEGYRGEHLERTTKTP,./data/raw/alphafold//AF-Q8BG93-F1-model_v4.pdb,4461,5505,1671,7568 +1399,37289,37947,MFQIKKICCIGAGYVGGPTCSVIAQMCPDIKVTVVDVNQARINAWNSDTLPIYEPGLKEVVESCRGKNLFYSTDIDGAIQEADLVFISVNTPTKTYGMGKGRAADLKYIEACARRIVQNSNGYKIVTEKSTVPVRAAESIRRIFDANTKPDLNLQVLSNPEFLAEGTAIKDLKNPDRVLIGGDETPEGQKAVRALCDVYEHWVPSEKIITTNTWSSELSKLAANAFLAQRISSINSISALCEATGADVEEVARAIGMDQRIGNKFLKASVGFGGSCFQKDVLNLVYLCEVLNLHEVAKYWQQVIDMNDYQRRRFTTRIIDCLFNTVTDKKIALLGFAFKKDTGDTRESSSIYISKYLMDEGAKLHIYDPKVPREQIITDLSQPGVAADDRVSQLVHISTDLYEACENAHAMVICTEWDMFKELDFNRIHRMMLKPAFIFDGRRVLDELHGELQNIGFQVETIGKKVASKRIPFTPTADIPKFGLQDLPHKKQRV,brenda,Q56R95,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O,0.9,37.0,7.5,1.1.1.22,8355.0,-0.0457574905606751,-0.0457574905606751,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O__MFQIKKICCIGAGYVGGPTCSVIAQMCPDIKVTVVDVNQARINAWNSDTLPIYEPGLKEVVESCRGKNLFYSTDIDGAIQEADLVFISVNTPTKTYGMGKGRAADLKYIEACARRIVQNSNGYKIVTEKSTVPVRAAESIRRIFDANTKPDLNLQVLSNPEFLAEGTAIKDLKNPDRVLIGGDETPEGQKAVRALCDVYEHWVPSEKIITTNTWSSELSKLAANAFLAQRISSINSISALCEATGADVEEVARAIGMDQRIGNKFLKASVGFGGSCFQKDVLNLVYLCEVLNLHEVAKYWQQVIDMNDYQRRRFTTRIIDCLFNTVTDKKIALLGFAFKKDTGDTRESSSIYISKYLMDEGAKLHIYDPKVPREQIITDLSQPGVAADDRVSQLVHISTDLYEACENAHAMVICTEWDMFKELDFNRIHRMMLKPAFIFDGRRVLDELHGELQNIGFQVETIGKKVASKRIPFTPTADIPKFGLQDLPHKKQRV,./data/raw/alphafold//AF-Q56R95-F1-model_v4.pdb,4640,5212,7136,7163 +1400,33645,34242,MIILEIDVERRAVSRREIDASGPVEAALAIHKERETWRLDPLSPQVPVVFGMGPFVGGRLYGVHRLIFIFKSPQTGTLHVSALGGAAYKAMGMGAQAVSIVGRAPTPTAIFISQGYVKFAEVKPGDAYETINSLYREFKNFFLENDARALVVGPAAYTTYNGAVVSVDVDVRKGEFKLGAEDFAARGGPGTALAQGHNVAAIVVGGPKRPHFEKVTDAEAINQIFNKSFGRPYLDVLNEKTVKYRFDQKLRTGGTFGVNYPHYRDLLPLFGYKSIYMSREERVKHADLILQLFWKPFQEEVFEKGRSWYNCGEPCPVVCKKVWRGKKVDYESFHAMGPFIGNYLFQEAVPLVDKVDKLGLDAIEMGHLVAWLFDAVHAGLLKPEELGLDDTPAFDPARFDPHGDSKKNARLAGHLLDNFVNNSTEVLALVARQGIRKAARELEKRFSDRVKAAGVRFRDLAVYAAFGTEGYMTPNFYWAPGLIAPMYIQGRYWTNYNPTFMLPEDFAKSSYDRAVAEAYIDNAGICRFHRGWAEPVLAELYALVGVKPPTSQLYRDLAYYAKLAGAEPMPWESKRARDLVSTLARELGAKDWKFEDYDDYYEWWVRFFSTVNRLIFATPTTV,brenda,Q8ZXY6,O=C[C@H](O)COP(=O)(O)O,0.043,50.0,7.8,1.2.7.6,13773.0,-1.3665315444204136,-1.3665315444204136,O=C[C@H](O)COP(=O)(O)O__MIILEIDVERRAVSRREIDASGPVEAALAIHKERETWRLDPLSPQVPVVFGMGPFVGGRLYGVHRLIFIFKSPQTGTLHVSALGGAAYKAMGMGAQAVSIVGRAPTPTAIFISQGYVKFAEVKPGDAYETINSLYREFKNFFLENDARALVVGPAAYTTYNGAVVSVDVDVRKGEFKLGAEDFAARGGPGTALAQGHNVAAIVVGGPKRPHFEKVTDAEAINQIFNKSFGRPYLDVLNEKTVKYRFDQKLRTGGTFGVNYPHYRDLLPLFGYKSIYMSREERVKHADLILQLFWKPFQEEVFEKGRSWYNCGEPCPVVCKKVWRGKKVDYESFHAMGPFIGNYLFQEAVPLVDKVDKLGLDAIEMGHLVAWLFDAVHAGLLKPEELGLDDTPAFDPARFDPHGDSKKNARLAGHLLDNFVNNSTEVLALVARQGIRKAARELEKRFSDRVKAAGVRFRDLAVYAAFGTEGYMTPNFYWAPGLIAPMYIQGRYWTNYNPTFMLPEDFAKSSYDRAVAEAYIDNAGICRFHRGWAEPVLAELYALVGVKPPTSQLYRDLAYYAKLAGAEPMPWESKRARDLVSTLARELGAKDWKFEDYDDYYEWWVRFFSTVNRLIFATPTTV,./data/raw/alphafold//AF-Q8ZXY6-F1-model_v4.pdb,2099,5605,4387,10099 +1401,6025,6112,MAPLGGAPRLVLLFSGKRKSGKDFVTEALQSRLGADVCAVLRLSGPLKEQYAQEHGLNFQRLLDTSTYKEAFRKDMIRWGEEKRQADPGFFCRKIVEGISQPIWLVSDTRRVSDIQWFREAYGAVTQTVRVVALEQSRQQRGWVFTPGVDDAESECGLDNFGDFDWVIENHGVEQRLEEQLENLIEFIRSRL,sabio,Q15126,CC(O)(CCOP(=O)(O)OP(=O)(O)O)CC(=O)O,0.041,30.0,7.0,2.7.4.2,9606.0,-1.3872161432802643,-1.3872161432802643,CC(O)(CCOP(=O)(O)OP(=O)(O)O)CC(=O)O__MAPLGGAPRLVLLFSGKRKSGKDFVTEALQSRLGADVCAVLRLSGPLKEQYAQEHGLNFQRLLDTSTYKEAFRKDMIRWGEEKRQADPGFFCRKIVEGISQPIWLVSDTRRVSDIQWFREAYGAVTQTVRVVALEQSRQQRGWVFTPGVDDAESECGLDNFGDFDWVIENHGVEQRLEEQLENLIEFIRSRL,./data/raw/alphafold//AF-Q15126-F1-model_v4.pdb,5580,2345,2966,3430 +1402,10476,10631,MLPPQKKPWESMAKGLVLGALFTSFLLLVYSYAVPPLHAGLASTTPEAAASCSPPALEPEAVIRANGSAGECQPRRNIVFLKTHKTASSTLLNILFRFGQKHRLKFAFPNGRNDFDYPTFFARSLVQDYRPGACFNIICNHMRFHYDEVRGLVPTNAIFITVLRDPARLFESSFHYFGPVVPLTWKLSAGDKLTEFLQDPDRYYDPNGFNAHYLRNLLFFDLGYDNSLDPSSPQVQEHILEVERRFHLVLLQEYFDESLVLLKDLLCWELEDVLYFKLNARRDSPVPRLSGELYGRATAWNMLDSHLYRHFNASFWRKVEAFGRERMAREVAALRHANERMRTICIDGGHAVDAAAIQDEAMQPWQPLGTKSILGYNLKKSIGQRHAQLCRRMLTPEIQYLMDLGANLWVTKLWKFIRDFLRW,uniprot_search,Q99999,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O,0.103,37.0,7.1,2.8.2.11,9606.0,-0.9871627752948278,-0.9871627752948278,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O__MLPPQKKPWESMAKGLVLGALFTSFLLLVYSYAVPPLHAGLASTTPEAAASCSPPALEPEAVIRANGSAGECQPRRNIVFLKTHKTASSTLLNILFRFGQKHRLKFAFPNGRNDFDYPTFFARSLVQDYRPGACFNIICNHMRFHYDEVRGLVPTNAIFITVLRDPARLFESSFHYFGPVVPLTWKLSAGDKLTEFLQDPDRYYDPNGFNAHYLRNLLFFDLGYDNSLDPSSPQVQEHILEVERRFHLVLLQEYFDESLVLLKDLLCWELEDVLYFKLNARRDSPVPRLSGELYGRATAWNMLDSHLYRHFNASFWRKVEAFGRERMAREVAALRHANERMRTICIDGGHAVDAAAIQDEAMQPWQPLGTKSILGYNLKKSIGQRHAQLCRRMLTPEIQYLMDLGANLWVTKLWKFIRDFLRW,./data/raw/alphafold//AF-Q99999-F1-model_v4.pdb,1624,6962,8814,4466 +1403,36853,37502,MKPLVVFVLGGPGAGKGTQCARIVEKYGYTHLSAGELLRDERKNPDSQYGELIEKYIKEGKIVPVEITISLLKREMDQTMAANAQKNKFLIDGFPRNQDNLQGWNKTMDGKADVSFVLFFDCNNEICIERCLERGKSSGRSDDNRESLEKRIQTYLQSTKPIIDLYEEMGKVKKIDASKSVDEVFDEVVQIFDKEG,sabio,P30085,O=c1ccn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]1,5.9,37.0,7.0,2.7.4.14,9606.0,0.7708520116421442,0.7708520116421442,O=c1ccn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]1__MKPLVVFVLGGPGAGKGTQCARIVEKYGYTHLSAGELLRDERKNPDSQYGELIEKYIKEGKIVPVEITISLLKREMDQTMAANAQKNKFLIDGFPRNQDNLQGWNKTMDGKADVSFVLFFDCNNEICIERCLERGKSSGRSDDNRESLEKRIQTYLQSTKPIIDLYEEMGKVKKIDASKSVDEVFDEVVQIFDKEG,./data/raw/alphafold//AF-P30085-F1-model_v4.pdb,1268,184,201,223 +1404,17006,17251,MATPYKEERDIQKSYWMEHSSDLTVEAMMLDSKASDLDKEERPEVLSLIPPYEGKSVLELGAGIGRFTGELAQKAGEVIALDFIESAIQKNESVNGHYKNIKFMCADVTSPDLKIKDGSIDLIFSNWLLMYLSDKEVELMAERMIGWVKPGGYIFFRESCFHQSGDSKRKSNPTHYREPRFYTKVFQECQTRDASGNSFELSMVGCKCIGAYVKNKKNQNQICWIWQKVSVENDKDFQRFLDNVQYKSSGILRYERVFGEGYVSTGGFETTKEFVAKMDLKPGQKVLDVGCGIGGGDFYMAENFDVHVVGIDLSVNMISFALERAIGLKCSVEFEVADCTTKTYPDNSFDVIYSRDTILHIQDKPALFRTFFKWLKPGGKVLITDYCRSAETPSPEFAEYIKQRGYDLHDVQAYGQMLKDAGFDDVIAEDRTDQFVQVLRRELEKVEKEKEEFISDFSEEDYNDIVGGWSAKLERTASGEQKWGLFIADKK,brenda,Q944H0,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,0.308,30.0,7.5,2.1.1.103,3702.0,-0.5114492834995558,-0.5925567112854022,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MATPYKEERDIQKSYWMEHSSDLTVEAMMLDSKASDLDKEERPEVLSLIPPYEGKSVLELGAGIGRFTGELAQKAGEVIALDFIESAIQKNESVNGHYKNIKFMCADVTSPDLKIKDGSIDLIFSNWLLMYLSDKEVELMAERMIGWVKPGGYIFFRESCFHQSGDSKRKSNPTHYREPRFYTKVFQECQTRDASGNSFELSMVGCKCIGAYVKNKKNQNQICWIWQKVSVENDKDFQRFLDNVQYKSSGILRYERVFGEGYVSTGGFETTKEFVAKMDLKPGQKVLDVGCGIGGGDFYMAENFDVHVVGIDLSVNMISFALERAIGLKCSVEFEVADCTTKTYPDNSFDVIYSRDTILHIQDKPALFRTFFKWLKPGGKVLITDYCRSAETPSPEFAEYIKQRGYDLHDVQAYGQMLKDAGFDDVIAEDRTDQFVQVLRRELEKVEKEKEEFISDFSEEDYNDIVGGWSAKLERTASGEQKWGLFIADKK,./data/raw/alphafold//AF-Q944H0-F1-model_v4.pdb,5312,1123,4198,1660 +1405,29807,30335,MTVQNPQEPEYFPEVFPQDAFPQYAWDEGMRPITLPHEVWLSETTHRDGQQGGLPLSLDTSRRIYDILCEITGDSTAIRHAEFFPYRDSDRNALIYALERHRDGAPIEPTTWIRARREDVELIKRIGVIETGLLSSSSDYHTFHKFGSGGRTQAASMYLDAVTMALDHGIRPRVHLEDTTRSSPDFVRALVEEVLKTAERYPAELQPRFRVCDTLGIGLPYDDVSLPRSIPRWIRLLRGFGLSPSQIELHPHNDTWLVVANCLAAIREGCGVISGTTLGTGERTGNAPLEAVMVHLLGMGYWSGARVNLPAVNKLVELYEGIGAGPSQKYPFFGRDAYVTRAGIHADGLNKFWWMYAPFNAPLLTGRELDVALTKDSGQAGLLFVLNKRLGLQLEKGDPRVAEVLAWMDRQWDAGRVSAVEWSELEPVVEKAFATEEGVG,brenda,Q9LCB4,O=C(O)C(=O)C[PH](=O)O,0.36,30.0,8.0,2.3.3.18,1912.0,-0.4436974992327127,-0.429118384862106,O=C(O)C(=O)C[PH](=O)O__MTVQNPQEPEYFPEVFPQDAFPQYAWDEGMRPITLPHEVWLSETTHRDGQQGGLPLSLDTSRRIYDILCEITGDSTAIRHAEFFPYRDSDRNALIYALERHRDGAPIEPTTWIRARREDVELIKRIGVIETGLLSSSSDYHTFHKFGSGGRTQAASMYLDAVTMALDHGIRPRVHLEDTTRSSPDFVRALVEEVLKTAERYPAELQPRFRVCDTLGIGLPYDDVSLPRSIPRWIRLLRGFGLSPSQIELHPHNDTWLVVANCLAAIREGCGVISGTTLGTGERTGNAPLEAVMVHLLGMGYWSGARVNLPAVNKLVELYEGIGAGPSQKYPFFGRDAYVTRAGIHADGLNKFWWMYAPFNAPLLTGRELDVALTKDSGQAGLLFVLNKRLGLQLEKGDPRVAEVLAWMDRQWDAGRVSAVEWSELEPVVEKAFATEEGVG,./data/raw/alphafold//AF-Q9LCB4-F1-model_v4.pdb,3700,1367,2128,2032 +1406,21674,22010,MAATSLMSALAARLLQPAHSCSLRLRPFHLAAVRNEAVVISGRKLAQQIKQEVRQEVEEWVASGNKRPHLSVILVGENPASHSYVLNKTRAAAVVGINSETIMKPASISEEELLNLINKLNNDDNVDGLLVQLPLPEHIDERRICNAVSPDKDVDGFHVINVGRMCLDQYSMLPATPWGVWEIIKRTGIPTLGKNVVVAGRSKNVGMPIAMLLHTDGAHERPGGDATVTISHRYTPKEQLKKHTILADIVISAAGIPNLITADMIKEGAAVIDVGINRVHDPVTAKPKLVGDVDFEGVRQKAGYITPVPGGVGPMTVAMLMKNTIIAAKKVLRLEEREVLKSKELGVATN,brenda,P13995,N=c1nc(O)c2c([nH]1)NC[C@@H]1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)CN21,0.133,30.0,8.0,1.5.1.15,9606.0,-0.8761483590329142,-0.8931216237967581,N=c1nc(O)c2c([nH]1)NC[C@@H]1CN(c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)CN21__MAATSLMSALAARLLQPAHSCSLRLRPFHLAAVRNEAVVISGRKLAQQIKQEVRQEVEEWVASGNKRPHLSVILVGENPASHSYVLNKTRAAAVVGINSETIMKPASISEEELLNLINKLNNDDNVDGLLVQLPLPEHIDERRICNAVSPDKDVDGFHVINVGRMCLDQYSMLPATPWGVWEIIKRTGIPTLGKNVVVAGRSKNVGMPIAMLLHTDGAHERPGGDATVTISHRYTPKEQLKKHTILADIVISAAGIPNLITADMIKEGAAVIDVGINRVHDPVTAKPKLVGDVDFEGVRQKAGYITPVPGGVGPMTVAMLMKNTIIAAKKVLRLEEREVLKSKELGVATN,./data/raw/alphafold//AF-P13995-F1-model_v4.pdb,4302,5192,7089,7103 +1407,32685,33265,MPIYDLIIKNGIICTASDIYAAEIAVNNGKVQLIAASIDPSLGSEVIDAEGAFITPGGIDAHVHVDEPLKLLGDVVDTMEHATRSAVAGGTTTVVAFSTQDVSKKGPSALAESVKLDVDEYSEQTLYCDYGLHLILFQIEKPSVEARELLDVQLQAAYNDYGVSSVKMFMTYPGLQISDYDIMSAMYATRKNGFTTMLHAENGDMVKWMIEALEEQGLTDAYYHGVSRPSIVEGEATNRAITLATTMDTPILFVHVSSPQAAEVIKQAQTKGLKVYAETCPQYALLSDAITRCHHHGEVESYGVGIDLSSISESPFTNPDDRFIGSKYICSPPIRPEGTQKSIWKGMNNGTFTIVGSDHCSYNYYEKTSTASKHRAFDPENNKNGEFRYIPNGLPGVCTRMPLLYDYGYLRGNLTSMMKLVEIQCTNPAKVYGMYPQKGSILPGVSDADLVIWYPDDSKKEYNSKPKLITNKLMEHNCDYTPFEGIEIKNWPRYTIVKGKIVYKEGEILKENADGKYLKRGKSFMCTPKNEWVTEWRPKYES,sabio,Q9P903,O=C1CCNC(=O)N1,0.6,30.0,8.0,3.5.2.2,4934.0,-0.2218487496163563,-0.2218487496163563,O=C1CCNC(=O)N1__MPIYDLIIKNGIICTASDIYAAEIAVNNGKVQLIAASIDPSLGSEVIDAEGAFITPGGIDAHVHVDEPLKLLGDVVDTMEHATRSAVAGGTTTVVAFSTQDVSKKGPSALAESVKLDVDEYSEQTLYCDYGLHLILFQIEKPSVEARELLDVQLQAAYNDYGVSSVKMFMTYPGLQISDYDIMSAMYATRKNGFTTMLHAENGDMVKWMIEALEEQGLTDAYYHGVSRPSIVEGEATNRAITLATTMDTPILFVHVSSPQAAEVIKQAQTKGLKVYAETCPQYALLSDAITRCHHHGEVESYGVGIDLSSISESPFTNPDDRFIGSKYICSPPIRPEGTQKSIWKGMNNGTFTIVGSDHCSYNYYEKTSTASKHRAFDPENNKNGEFRYIPNGLPGVCTRMPLLYDYGYLRGNLTSMMKLVEIQCTNPAKVYGMYPQKGSILPGVSDADLVIWYPDDSKKEYNSKPKLITNKLMEHNCDYTPFEGIEIKNWPRYTIVKGKIVYKEGEILKENADGKYLKRGKSFMCTPKNEWVTEWRPKYES,./data/raw/alphafold//AF-Q9P903-F1-model_v4.pdb,84,2804,3484,4039 +1408,22637,22989,MQSWSRVYCSLAKRGHFNRISHGLQGLSAVPLRTYADQPIDADVTVIGSGPGGYVAAIKAAQLGFKTVCIEKNETLGGTCLNVGCIPSKALLNNSHYYHMAHGKDFASRGIEMSEVRLNLDKMMEQKSTAVKALTGGIAHLFKQNKVVHVNGYGKITGKNQVTATKADGGTQVIDTKNILIATGSEVTPFPGITIDEDTIVSSTGALSLKKVPEKMVVIGAGVIGVELGSVWQRLGADVTAVEFLGHVGGVGIDMEISKNFQRILQKQGFKFKLNTKVTGATKKSDGKIDVSIEAASGGKAEVITCDVLLVCIGRRPFTKNLGLEELGIELDPRGRIPVNTRFQTKIPNIYAIGDVVAGPMLAHKAEDEGIICVEGMAGGAVHIDYNCVPSVIYTHPEVAWVGKSEEQLKEEGIEYKVGKFPFAANSRAKTNADTDGMVKILGQKSTDRVLGAHILGPGAGEMVNEAALALEYGASCEDIARVCHAHPTLSEAFREANLAASFGKSINF,sabio,P09622,NC(=O)CCCCC(S)CCS,0.26,25.0,8.5,1.8.1.4,9606.0,-0.585026652029182,-0.585026652029182,NC(=O)CCCCC(S)CCS__MQSWSRVYCSLAKRGHFNRISHGLQGLSAVPLRTYADQPIDADVTVIGSGPGGYVAAIKAAQLGFKTVCIEKNETLGGTCLNVGCIPSKALLNNSHYYHMAHGKDFASRGIEMSEVRLNLDKMMEQKSTAVKALTGGIAHLFKQNKVVHVNGYGKITGKNQVTATKADGGTQVIDTKNILIATGSEVTPFPGITIDEDTIVSSTGALSLKKVPEKMVVIGAGVIGVELGSVWQRLGADVTAVEFLGHVGGVGIDMEISKNFQRILQKQGFKFKLNTKVTGATKKSDGKIDVSIEAASGGKAEVITCDVLLVCIGRRPFTKNLGLEELGIELDPRGRIPVNTRFQTKIPNIYAIGDVVAGPMLAHKAEDEGIICVEGMAGGAVHIDYNCVPSVIYTHPEVAWVGKSEEQLKEEGIEYKVGKFPFAANSRAKTNADTDGMVKILGQKSTDRVLGAHILGPGAGEMVNEAALALEYGASCEDIARVCHAHPTLSEAFREANLAASFGKSINF,./data/raw/alphafold//AF-P09622-F1-model_v4.pdb,3281,666,783,6728 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+1410,22469,22819,MLIAAMGPKIPVPAYGVGTALFKKEKGEINRTIVDSVKNALAAGFIHIDCAEVYGNEEEVGVALKEANVPRSKLFITSKVMHNVDNIPEALNESLRKLGTDYLDLYLLHSPIPFYEKKIPISEGWKAMETALGTGLVHSVGVSNFRIPDLEELLKTSTITPRVNQIEFHPQVYKAAKPLVEFCQSKGIIVEGYGPLSPLVRDAQGPVAEFTKSLESKYHVSDTQILLKWAYSKGVIPITTTSKIERMKECLNFDSFTLDKADIDELGTLGVQHHKRTFMKHMDE,sabio,O13848,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1,0.034,25.0,7.0,1.1.1.-,4896.0,-1.4685210829577449,-1.4685210829577449,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1__MLIAAMGPKIPVPAYGVGTALFKKEKGEINRTIVDSVKNALAAGFIHIDCAEVYGNEEEVGVALKEANVPRSKLFITSKVMHNVDNIPEALNESLRKLGTDYLDLYLLHSPIPFYEKKIPISEGWKAMETALGTGLVHSVGVSNFRIPDLEELLKTSTITPRVNQIEFHPQVYKAAKPLVEFCQSKGIIVEGYGPLSPLVRDAQGPVAEFTKSLESKYHVSDTQILLKWAYSKGVIPITTTSKIERMKECLNFDSFTLDKADIDELGTLGVQHHKRTFMKHMDE,./data/raw/alphafold//AF-O13848-F1-model_v4.pdb,4576,2229,4289,7774 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+1426,23055,23409,MTADELVFFVNGKKVVEKNADPETTLLAYLRRKLGLRGTKLGCGEGGCGACTVMLSKYDRLQDKIIHFSANACLAPICTLHHVAVTTVEGIGSTKTRLHPVQERIAKSHGSQCGFCTPGIVMSMYTLLRNQPEPTVEEIEDAFQGNLCRCTGYRPILQGFRTFAKNGGCCGGNGNNPNCCMNQKKDHTVTLSPSLFNPEEFMPLDPTQEPIFPPELLRLKDVPPKQLRFEGERVTWIQASTLKELLDLKAQHPEAKLVVGNTEIGIEMKFKNQLFPMIICPAWIPELNAVEHGPEGISFGAACALSSVEKTLLEAVAKLPTQKTEVFRGVLEQLRWFAGKQVKSVASLGGNIITASPISDLNPVFMASGTKLTIVSRGTRRTVPMDHTFFPSYRKTLLGPEEILLSIEIPYSREDEFFSAFKQASRREDDIAKVTCGMRVLFQPGSMQVKELALCYGGMADRTISALKTTQKQLSKFWNEKLLQDVCAGLAEELSLSPDAPGGMIEFRRTLTLSFFFKFYLTVLKKLGKDSKDKCGKLDPTYTSATLLFQKDPPANIQLFQEVPNGQSKEDTVGRPLPHLAAAMQASGEAVYCDDIPRYENELFLRLVTSTRAHAKIKSIDVSEAQKVPGFVCFLSADDIPGSNETGLFNDETVFAKDTVTCVGHIIGAVVADTPEHAERAAHVVKVTYEDLPAIITIEDAIKNNSFYGSELKIEKGDLKKGFSEADNVVSGELYIGGQDHFYLETHCTIAIPKGEEGEMELFVSTQNAMKTQSFVAKMLGVPVNRILVRVKRMGGGFGGKETRSTLVSVAVALAAYKTGHPVRCMLDRNEDMLITGGRHPFLARYKVGFMKTGTIVALEVDHYSNAGNSRDLSHSIMERALFHMDNCYKIPNIRGTGRLCKTNLSSNTAFRGFGGPQALFIAENWMSEVAVTCGLPAEEVRWKNMYKEGDLTHFNQRLEGFSVPRCWDECLKSSQYYARKSEVDKFNKENCWKKRGLCIIPTKFGISFTVPFLNQAGALIHVYTDGSVLVSHGGTEMGQGLHTKMVQVASKALKIPISKIYISETSTNTVPNSSPTAASVSTDIYGQAVYEACQTILKRLEPFKKKNPDGSWEDWVMAAYQDRVSLSTTGFYRTPNLGYSFETNSGNAFHYFTYGVACSEVEIDCLTGDHKNLRTDIVMDVGSSLNPAIDIGQVEGAFVQGLGLFTLEELHYSPEGSLHTRGPSTYKIPAFGSIPTEFRVSLLRDCPNKKAIYASKAVGEPPLFLGASVFFAIKDAIRAARAQHTNNNTKELFRLDSPATPEKIRNACVDKFTTLCVTGAPGNCKPWSLRV,sabio,P80457,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,133.4,25.0,8.1,1.17.1.4,9913.0,2.1251558295805304,1.6129213202252617,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MTADELVFFVNGKKVVEKNADPETTLLAYLRRKLGLRGTKLGCGEGGCGACTVMLSKYDRLQDKIIHFSANACLAPICTLHHVAVTTVEGIGSTKTRLHPVQERIAKSHGSQCGFCTPGIVMSMYTLLRNQPEPTVEEIEDAFQGNLCRCTGYRPILQGFRTFAKNGGCCGGNGNNPNCCMNQKKDHTVTLSPSLFNPEEFMPLDPTQEPIFPPELLRLKDVPPKQLRFEGERVTWIQASTLKELLDLKAQHPEAKLVVGNTEIGIEMKFKNQLFPMIICPAWIPELNAVEHGPEGISFGAACALSSVEKTLLEAVAKLPTQKTEVFRGVLEQLRWFAGKQVKSVASLGGNIITASPISDLNPVFMASGTKLTIVSRGTRRTVPMDHTFFPSYRKTLLGPEEILLSIEIPYSREDEFFSAFKQASRREDDIAKVTCGMRVLFQPGSMQVKELALCYGGMADRTISALKTTQKQLSKFWNEKLLQDVCAGLAEELSLSPDAPGGMIEFRRTLTLSFFFKFYLTVLKKLGKDSKDKCGKLDPTYTSATLLFQKDPPANIQLFQEVPNGQSKEDTVGRPLPHLAAAMQASGEAVYCDDIPRYENELFLRLVTSTRAHAKIKSIDVSEAQKVPGFVCFLSADDIPGSNETGLFNDETVFAKDTVTCVGHIIGAVVADTPEHAERAAHVVKVTYEDLPAIITIEDAIKNNSFYGSELKIEKGDLKKGFSEADNVVSGELYIGGQDHFYLETHCTIAIPKGEEGEMELFVSTQNAMKTQSFVAKMLGVPVNRILVRVKRMGGGFGGKETRSTLVSVAVALAAYKTGHPVRCMLDRNEDMLITGGRHPFLARYKVGFMKTGTIVALEVDHYSNAGNSRDLSHSIMERALFHMDNCYKIPNIRGTGRLCKTNLSSNTAFRGFGGPQALFIAENWMSEVAVTCGLPAEEVRWKNMYKEGDLTHFNQRLEGFSVPRCWDECLKSSQYYARKSEVDKFNKENCWKKRGLCIIPTKFGISFTVPFLNQAGALIHVYTDGSVLVSHGGTEMGQGLHTKMVQVASKALKIPISKIYISETSTNTVPNSSPTAASVSTDIYGQAVYEACQTILKRLEPFKKKNPDGSWEDWVMAAYQDRVSLSTTGFYRTPNLGYSFETNSGNAFHYFTYGVACSEVEIDCLTGDHKNLRTDIVMDVGSSLNPAIDIGQVEGAFVQGLGLFTLEELHYSPEGSLHTRGPSTYKIPAFGSIPTEFRVSLLRDCPNKKAIYASKAVGEPPLFLGASVFFAIKDAIRAARAQHTNNNTKELFRLDSPATPEKIRNACVDKFTTLCVTGAPGNCKPWSLRV,./data/raw/alphafold//AF-P80457-F1-model_v4.pdb,3061,2155,4674,4922 +1427,35247,35866,MNLLTINTHSWLEEEPLKKLEEIAKVILSSESEIIALQEVNQKVASKKVPLEQLTTFCPIATQTPIHEDNFAYLIVQYLAEKGQHYYWSWEMSHIGYAIYEEGNALLSKCPLTSEALLISESQEPTNYRTRKILVAETESSKGTLTVVSGHFSWWETPCTGFAYEWLQLEKYLAMGQQPLVILGDLNNPAGTTGYQLVENSYLPIQDAFVVAEETSGEATVEKKIDGWEENEAALRIDYAFVPKQWHVRKYEVIFDGRKTPIVSDHFGLLIQLK,brenda,E6ENP9,O=P(O)(O)OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O,4.1,30.0,7.1,3.1.3.90,1351.0,0.6127838567197355,0.6127838567197355,O=P(O)(O)OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O__MNLLTINTHSWLEEEPLKKLEEIAKVILSSESEIIALQEVNQKVASKKVPLEQLTTFCPIATQTPIHEDNFAYLIVQYLAEKGQHYYWSWEMSHIGYAIYEEGNALLSKCPLTSEALLISESQEPTNYRTRKILVAETESSKGTLTVVSGHFSWWETPCTGFAYEWLQLEKYLAMGQQPLVILGDLNNPAGTTGYQLVENSYLPIQDAFVVAEETSGEATVEKKIDGWEENEAALRIDYAFVPKQWHVRKYEVIFDGRKTPIVSDHFGLLIQLK,./data/raw/alphafold//AF-E6ENP9-F1-model_v4.pdb,2277,7810,9612,10755 +1428,15094,15307,MILVTGALGQIGTELVLALQEKYGNDKIIASDLKEPENYHCKFEKCDIRDIETYERINNENKIEIVYHLAAILSAAGEKNPELCHDVNYNGLENVLKTAKKYNQKLFCPSSIAVFGPDVPKEMTPQNVELNPKTVYGITKVKGEELCDTYFKEHGIDVRGIRYPGLISWKHKPSGGTTDYAVEMYFDAVESGKYECFVNRNTRLPMMFMDDAIRATLELMDAPLDSLNYHSNYNLSSMSFSAEELEKEISAHVDFNCLYKPDYRQDIADTWPISINDDDARKDWGWEPKFDISKMTEEMITNLRRLNE,brenda,D6PBM7,C[C@@H](O)[C@H](N)C(=O)O,25.3,15.0,6.0,1.1.1.103,115547.0,1.403120521175818,1.403120521175818,C[C@@H](O)[C@H](N)C(=O)O__MILVTGALGQIGTELVLALQEKYGNDKIIASDLKEPENYHCKFEKCDIRDIETYERINNENKIEIVYHLAAILSAAGEKNPELCHDVNYNGLENVLKTAKKYNQKLFCPSSIAVFGPDVPKEMTPQNVELNPKTVYGITKVKGEELCDTYFKEHGIDVRGIRYPGLISWKHKPSGGTTDYAVEMYFDAVESGKYECFVNRNTRLPMMFMDDAIRATLELMDAPLDSLNYHSNYNLSSMSFSAEELEKEISAHVDFNCLYKPDYRQDIADTWPISINDDDARKDWGWEPKFDISKMTEEMITNLRRLNE,./data/raw/alphafold//AF-D6PBM7-F1-model_v4.pdb,505,3778,5134,5454 +1429,38559,39240,MANTPLIVSFGEMLIDFVPDTSGVSLAESTGFLKAPGGAPANVACAITKLGGKSAFIGKFGDDEFGHMLVNILKKNGVNSEGVCFDTNARTALAFVTLKKDGEREFMFYRNPSADMLLKESELNKDLIKKAKIFHYGSISLISEPCRTAHMAAMKTAKDAGVLLSYDPNVRLPLWPSTEAAIEGIKSIWNEADIIKVSDDEVTFLTRGDAEKDDVVLSLMHDKLKLLIVTDGEKGCRYYTKKFKGRVPGYAVKAVDTTGAGDSFVGAFLVSLGKDGSILDDEGKLKEALAFANACGAVCTTQKGAIPALPTPADAQKLMKSKSK,brenda,O82616,OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,0.23,30.0,7.5,2.7.1.4,3702.0,-0.6382721639824072,-0.6382721639824072,OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O__MANTPLIVSFGEMLIDFVPDTSGVSLAESTGFLKAPGGAPANVACAITKLGGKSAFIGKFGDDEFGHMLVNILKKNGVNSEGVCFDTNARTALAFVTLKKDGEREFMFYRNPSADMLLKESELNKDLIKKAKIFHYGSISLISEPCRTAHMAAMKTAKDAGVLLSYDPNVRLPLWPSTEAAIEGIKSIWNEADIIKVSDDEVTFLTRGDAEKDDVVLSLMHDKLKLLIVTDGEKGCRYYTKKFKGRVPGYAVKAVDTTGAGDSFVGAFLVSLGKDGSILDDEGKLKEALAFANACGAVCTTQKGAIPALPTPADAQKLMKSKSK,./data/raw/alphafold//AF-O82616-F1-model_v4.pdb,1487,6414,8596,8810 +1430,6598,6715,MIEPSMERENGALTAATTTTTAVTSPPPMASSPRQALVERLKDYGQEDIFSLWDELSPDEKDFLVRDIENLDLPRIDRIIRCSLHSQGLPVAAIEPVPENWVSTVDGRTMEDREKWWKMGLKTIYEGKLGVVLLSGGQGTRLGSSDPKGCFNIGLPSGKSLFQIQAERILCVQRLAAQVVSEGPIRPVTIHWYIMTSPFTDEATRKYFSSHKYFGLEPDQISFFQQGTLPCVTKDGKFIMETPFSLAKAPDGNGGVYAALKCSRLLEDMASRGIKYVDCYGVDNVLVRVADPTFLGYFIDKGAASAAKVVRKAYPQEQVGVFVRRGKGGPLTVVEYSELDQSMASAINQRTGRLQYCWSNVCLHMFTLDFLNQVATGLEKDSVYHLAEKKIPSMNGYTMGLKLEQFIFDSFPYAPSTALFEVLREEEFAPVKNVNGSNFDTPESARLLVLRLHTRWVIAAGGFLTHSVPLYATGVEVSPLCSYAGENLEAICRGRTFHAPCEISL,brenda,Q940S3,CC(O)=N[C@H]1[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)O[C@H](CO)[C@H](O)[C@@H]1O,2.768,37.0,7.6,2.7.7.23,3702.0,0.4421660857847201,0.4421660857847201,CC(O)=N[C@H]1[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)O[C@H](CO)[C@H](O)[C@@H]1O__MIEPSMERENGALTAATTTTTAVTSPPPMASSPRQALVERLKDYGQEDIFSLWDELSPDEKDFLVRDIENLDLPRIDRIIRCSLHSQGLPVAAIEPVPENWVSTVDGRTMEDREKWWKMGLKTIYEGKLGVVLLSGGQGTRLGSSDPKGCFNIGLPSGKSLFQIQAERILCVQRLAAQVVSEGPIRPVTIHWYIMTSPFTDEATRKYFSSHKYFGLEPDQISFFQQGTLPCVTKDGKFIMETPFSLAKAPDGNGGVYAALKCSRLLEDMASRGIKYVDCYGVDNVLVRVADPTFLGYFIDKGAASAAKVVRKAYPQEQVGVFVRRGKGGPLTVVEYSELDQSMASAINQRTGRLQYCWSNVCLHMFTLDFLNQVATGLEKDSVYHLAEKKIPSMNGYTMGLKLEQFIFDSFPYAPSTALFEVLREEEFAPVKNVNGSNFDTPESARLLVLRLHTRWVIAAGGFLTHSVPLYATGVEVSPLCSYAGENLEAICRGRTFHAPCEISL,./data/raw/alphafold//AF-Q940S3-F1-model_v4.pdb,5710,1010,1208,1486 +1431,1797,1835,MSEQIPKTQKAVVFDTNGGQLVYKDYPVPTPKPNELLIHVKYSGVCHTDLHAWKGDWPLATKLPLVGGHEGAGVVVGMGENVKGWKIGDFAGIKWLNGSCMSCEFCQQGAEPNCGEADLSGYTHDGSFEQYATADAVQAAKIPAGTDLANVAPILCAGVTVYKALKTADLAAGQWVAISGAGGGLGSLAVQYARAMGLRVVAIDGGDEKGEFVKSLGAEAYVDFTKDKDIVEAVKKATDGGPHGAINVSVSEKAIDQSVEYVRPLGKVVLVGLPAHAKVTAPVFDAVVKSIEIKGSYVGNRKDTAEAIDFFSRGLIKCPIKIVGLSDLPEVFKLMEEGKILGRYVLDTSK,brenda,A0A1D8PP43,CC(=O)C=O,0.97,30.0,7.5,1.2.1.23,5476.0,-0.0132282657337551,-0.0132282657337551,CC(=O)C=O__MSEQIPKTQKAVVFDTNGGQLVYKDYPVPTPKPNELLIHVKYSGVCHTDLHAWKGDWPLATKLPLVGGHEGAGVVVGMGENVKGWKIGDFAGIKWLNGSCMSCEFCQQGAEPNCGEADLSGYTHDGSFEQYATADAVQAAKIPAGTDLANVAPILCAGVTVYKALKTADLAAGQWVAISGAGGGLGSLAVQYARAMGLRVVAIDGGDEKGEFVKSLGAEAYVDFTKDKDIVEAVKKATDGGPHGAINVSVSEKAIDQSVEYVRPLGKVVLVGLPAHAKVTAPVFDAVVKSIEIKGSYVGNRKDTAEAIDFFSRGLIKCPIKIVGLSDLPEVFKLMEEGKILGRYVLDTSK,./data/raw/alphafold//AF-A0A1D8PP43-F1-model_v4.pdb,3774,2850,954,1169 +1432,17196,17446,MSSSGLNSEKVAALIQKLNSDPQFVLAQNVGTTHDLLDICLKRATVQRAQHVFQHAVPQEGKPITNQKSSGRCWIFSCLNVMRLPFMKKLNIEEFEFSQSYLFFWDKVERCYFFLSAFVDTAQRKEPEDGRLVQFLLMNPANDGGQWDMLVNIVEKYGVIPKKCFPESYTTEATRRMNDILNHKMREFCIRLRNLVHSGATKGEISATQDVMMEEIFRVVCICLGNPPETFTWEYRDKDKNYQKIGPITPLEFYREHVKPLFNMEDKICLVNDPRPQHKYNKLYTVEYLSNMVGGRKTLYNNQPIDFLKKMVAASIKDGEAVWFGCDVGKHFNSKLGLSDMNLYDHELVFGVSLKNMNKAERLTFGESLMTHAMTFTAVSEKDDQDGAFTKWRVENSWGEDHGHKGYLCMTDEWFSEYVYEVVVDRKHVPEEVLAVLEQEPIILPAWDPMGALAE,brenda,Q13867,Cc1c(C(O)=N[C@H](C(O)=N[C@H](C)[C@@H](O)[C@H](C)C(O)=N[C@H](C(O)=NCCc2nc(-c3nc(C(O)=NCCC(=N)N)cs3)cs2)[C@@H](C)O)C(O[C@@H]2O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](OC(=N)O)[C@@H]2O)c2cnc[nH]2)nc([C@H](CC(=N)O)NC[C@H](N)C(=N)O)[nH]c1=N,0.942,30.0,7.5,3.4.22.40,9606.0,-0.0259490972071226,-0.0259490972071226,Cc1c(C(O)=N[C@H](C(O)=N[C@H](C)[C@@H](O)[C@H](C)C(O)=N[C@H](C(O)=NCCc2nc(-c3nc(C(O)=NCCC(=N)N)cs3)cs2)[C@@H](C)O)C(O[C@@H]2O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](OC(=N)O)[C@@H]2O)c2cnc[nH]2)nc([C@H](CC(=N)O)NC[C@H](N)C(=N)O)[nH]c1=N__MSSSGLNSEKVAALIQKLNSDPQFVLAQNVGTTHDLLDICLKRATVQRAQHVFQHAVPQEGKPITNQKSSGRCWIFSCLNVMRLPFMKKLNIEEFEFSQSYLFFWDKVERCYFFLSAFVDTAQRKEPEDGRLVQFLLMNPANDGGQWDMLVNIVEKYGVIPKKCFPESYTTEATRRMNDILNHKMREFCIRLRNLVHSGATKGEISATQDVMMEEIFRVVCICLGNPPETFTWEYRDKDKNYQKIGPITPLEFYREHVKPLFNMEDKICLVNDPRPQHKYNKLYTVEYLSNMVGGRKTLYNNQPIDFLKKMVAASIKDGEAVWFGCDVGKHFNSKLGLSDMNLYDHELVFGVSLKNMNKAERLTFGESLMTHAMTFTAVSEKDDQDGAFTKWRVENSWGEDHGHKGYLCMTDEWFSEYVYEVVVDRKHVPEEVLAVLEQEPIILPAWDPMGALAE,./data/raw/alphafold//AF-Q13867-F1-model_v4.pdb,3954,4198,5628,6022 +1433,36141,36769,MRRSVYLDNTIEFLRGRVYLGAYDYTPEDTDELVFFTVEDAIFYNSFHLDFGPMNIGHLYRFAVIFHEILNDPENANKAVVFYSSASTRQRANAACMLCCYMILVQAWTPHQVLQPLAQVDPPFMPFRDAGYSNADFEITIQDVVYGVWRAKEKGLIDLHSFNLESYEKYEHVEFGDFNVLTPDFIAFASPQEDHPKGYLATKSSHLNQPFKSVLNFFANNNVQLVVRLNSHLYNKKHFEDIGIQHLDLIFEDGTCPDLSIVKNFVGAAETIIKRGGKIAVHCKAGLGRTGCLIGAHLIYTYGFTANECIGFLRFIRPGMVVGPQQHWLYLHQNDFREWKYTTRISLKPSEAIGGLYPLISLEEYRLQKKKLKDDKRVAQNNIEGELRDLTMTPPSNGHGALSARNSSQPSTANNGSNSFKSSAVPQTSPGQPRKGQNGSNTIEDINNNRNPTSHANRKVVIESNNSDDESMQDTNGTSNHYPKVSRKKNDISSASSSRMEDNEPSATNINNAADDTILRQLLPKNRRVTSGRRTTSAAGGIRKISGSIKK,sabio,Q00684,O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,10.6,30.0,7.0,3.1.3.48,4932.0,1.0253058652647702,1.0253058652647702,O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MRRSVYLDNTIEFLRGRVYLGAYDYTPEDTDELVFFTVEDAIFYNSFHLDFGPMNIGHLYRFAVIFHEILNDPENANKAVVFYSSASTRQRANAACMLCCYMILVQAWTPHQVLQPLAQVDPPFMPFRDAGYSNADFEITIQDVVYGVWRAKEKGLIDLHSFNLESYEKYEHVEFGDFNVLTPDFIAFASPQEDHPKGYLATKSSHLNQPFKSVLNFFANNNVQLVVRLNSHLYNKKHFEDIGIQHLDLIFEDGTCPDLSIVKNFVGAAETIIKRGGKIAVHCKAGLGRTGCLIGAHLIYTYGFTANECIGFLRFIRPGMVVGPQQHWLYLHQNDFREWKYTTRISLKPSEAIGGLYPLISLEEYRLQKKKLKDDKRVAQNNIEGELRDLTMTPPSNGHGALSARNSSQPSTANNGSNSFKSSAVPQTSPGQPRKGQNGSNTIEDINNNRNPTSHANRKVVIESNNSDDESMQDTNGTSNHYPKVSRKKNDISSASSSRMEDNEPSATNINNAADDTILRQLLPKNRRVTSGRRTTSAAGGIRKISGSIKK,./data/raw/alphafold//AF-Q00684-F1-model_v4.pdb,59,2768,3444,3983 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+1482,1919,1957,MTEHLDVVIVGAGISGVSAAWHLQDRCPTKSYAILEKRESMGGTWDLFRYPGIRSDSDMYTLGFRFRPWTGRQAIADGKPILEYVKSTAAMYGIDRHIRFHHKVISADWSTAENRWTVHIQSHGTLSALTCEFLFLCSGYYNYDEGYSPRFAGSEDFVGPIIHPQHWPEDLDYDAKNIVVIGSGATAVTLVPALADSGAKHVTMLQRSPTYIVSQPDRDGIAEKLNRWLPETMAYTAVRWKNVLRQAAVYSACQKWPRRMRKMFLSLIQRQLPEGYDVRKHFGPHYNPWDQRLCLVPNGDLFRAIRHGKVEVVTDTIERFTATGIRLNSGRELPADIIITATGLNLQLFGGATATIDGQQVDITTTMAYKGMMLSGIPNMAYTVGYTNASWTLKADLVSEFVCRLLNYMDDNGFDTVVVERPGSDVEERPFMEFTPGYVLRSLDELPKQGSRTPWRLNQNYLRDIRLIRRGKIDDEGLRFAKRPAPVGV,sabio,P9WNF9,CC(=O)Cc1ccccc1,0.061,25.0,8.5,1.14.13.92,1773.0,-1.214670164989233,-0.8837560668235069,CC(=O)Cc1ccccc1__MTEHLDVVIVGAGISGVSAAWHLQDRCPTKSYAILEKRESMGGTWDLFRYPGIRSDSDMYTLGFRFRPWTGRQAIADGKPILEYVKSTAAMYGIDRHIRFHHKVISADWSTAENRWTVHIQSHGTLSALTCEFLFLCSGYYNYDEGYSPRFAGSEDFVGPIIHPQHWPEDLDYDAKNIVVIGSGATAVTLVPALADSGAKHVTMLQRSPTYIVSQPDRDGIAEKLNRWLPETMAYTAVRWKNVLRQAAVYSACQKWPRRMRKMFLSLIQRQLPEGYDVRKHFGPHYNPWDQRLCLVPNGDLFRAIRHGKVEVVTDTIERFTATGIRLNSGRELPADIIITATGLNLQLFGGATATIDGQQVDITTTMAYKGMMLSGIPNMAYTVGYTNASWTLKADLVSEFVCRLLNYMDDNGFDTVVVERPGSDVEERPFMEFTPGYVLRSLDELPKQGSRTPWRLNQNYLRDIRLIRRGKIDDEGLRFAKRPAPVGV,./data/raw/alphafold//AF-P9WNF9-F1-model_v4.pdb,3466,961,1154,1421 +1483,36775,37420,MDRRGFNRRVLLGGAAAATSLSIAPEVAGAAPAAKGITARTAPAGGEVRHLKMYAEKLADGQMGYGFEKGKASVPGPLIEVNEGDTLHIEFTNTMDVRASLHVHGLDYEISSDGTAMNKSDVEPGGTRTYTWRTHKPGRRDDGTWRPGSAGYWHYHDHVVGTEHGTGGIRNGLYGPVIVRRKGDVLPDATHTIVFNDMTINNRKPHTGPDFEATVGDRVEIVMITHGEYYHTFHMHGHRWADNRTGILTGPDDPSRVIDNKITGPADSFGFQIIAGEGVGAGAWMYHCHVQSHSDMGMVGLFLVKKPDGTIPGYEPHEHGGATAKSGESGEPTGGAAAHEHEH,sabio,Q9XAL8,O=c1c(O)c(-c2ccc(O)cc2O)oc2cc(O)cc(O)c12,1.5,60.0,7.0,1.10.3.2,1902.0,0.1760912590556812,0.1760912590556812,O=c1c(O)c(-c2ccc(O)cc2O)oc2cc(O)cc(O)c12__MDRRGFNRRVLLGGAAAATSLSIAPEVAGAAPAAKGITARTAPAGGEVRHLKMYAEKLADGQMGYGFEKGKASVPGPLIEVNEGDTLHIEFTNTMDVRASLHVHGLDYEISSDGTAMNKSDVEPGGTRTYTWRTHKPGRRDDGTWRPGSAGYWHYHDHVVGTEHGTGGIRNGLYGPVIVRRKGDVLPDATHTIVFNDMTINNRKPHTGPDFEATVGDRVEIVMITHGEYYHTFHMHGHRWADNRTGILTGPDDPSRVIDNKITGPADSFGFQIIAGEGVGAGAWMYHCHVQSHSDMGMVGLFLVKKPDGTIPGYEPHEHGGATAKSGESGEPTGGAAAHEHEH,./data/raw/alphafold//AF-Q9XAL8-F1-model_v4.pdb,408,3622,4948,4775 +1484,14152,14357,MWLRAFILATLSASAAWGHPSSPPVVDTVHGKVLGKFVSLEGFAQPVAIFLGIPFAKPPLGPLRFTPPQPAEPWSFVKNATSYPPMCTQDPKAGQLLSELFTNRKENIPLKLSEDCLYLNIYTPADLTKKNRLPVMVWIHGGGLMVGAASTYDGLALAAHENVVVVTIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALRWVQDNIASFGGNPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTSVLVKKGDVKPLAEQIAITAGCKTTTSAVMVHCLRQKTEEELLETTLKMKFLSLDLQGDPRESQPLLGTVIDGMLLLKTPEELQAERNFHTVPYMVGINKQEFGWLIPMQLMSYPLSEGQLDQKTAMSLLWKSYPLVCIAKELIPEATEKYLGGTDDTVKKKDLFLDLIADVMFGVPSVIVARNHRDAGAPTYMYEFQYRPSFSSDMKPKTVIGDHGDELFSVFGAPFLKEGASEEEIRLSKMVMKFWANFARNGNPNGEGLPHWPEYNQKEGYLQIGANTQAAQKLKDKEVAFWTNLFAKKAVEKPPQTEHIEL,brenda,P23141,COc1ccc2cc(C(C#N)OC(=O)C3C(C=C(C)C)C3(C)C)ccc2c1,0.0018,37.0,8.0,3.1.1.1,9606.0,-2.744727494896694,-2.7112541000813875,COc1ccc2cc(C(C#N)OC(=O)C3C(C=C(C)C)C3(C)C)ccc2c1__MWLRAFILATLSASAAWGHPSSPPVVDTVHGKVLGKFVSLEGFAQPVAIFLGIPFAKPPLGPLRFTPPQPAEPWSFVKNATSYPPMCTQDPKAGQLLSELFTNRKENIPLKLSEDCLYLNIYTPADLTKKNRLPVMVWIHGGGLMVGAASTYDGLALAAHENVVVVTIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALRWVQDNIASFGGNPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTSVLVKKGDVKPLAEQIAITAGCKTTTSAVMVHCLRQKTEEELLETTLKMKFLSLDLQGDPRESQPLLGTVIDGMLLLKTPEELQAERNFHTVPYMVGINKQEFGWLIPMQLMSYPLSEGQLDQKTAMSLLWKSYPLVCIAKELIPEATEKYLGGTDDTVKKKDLFLDLIADVMFGVPSVIVARNHRDAGAPTYMYEFQYRPSFSSDMKPKTVIGDHGDELFSVFGAPFLKEGASEEEIRLSKMVMKFWANFARNGNPNGEGLPHWPEYNQKEGYLQIGANTQAAQKLKDKEVAFWTNLFAKKAVEKPPQTEHIEL,./data/raw/alphafold//AF-P23141-F1-model_v4.pdb,2994,3237,2517,245 +1485,7020,7151,MTQRLKDKLAVITGGANGIGRAIAERFAVEGADIAIADLVPAPEAEAAIRNLGRRVLTVKCDVSQPGDVEAFGKQVISTFGRCDILVNNAGIYPLIPFDELTFEQWKKTFEINVDSGFLMAKAFVPGMKRNGWGRIINLTSTTYWLKIEAYTHYISTKAANIGFTRALASDLGKDGITVNAIAPSLVRTATTEASALSAMFDVLPNMLQAIPRLQVPLDLTGAAAFLASDDASFITGQTLAVDGGMVRH,sabio,Q5P5I4,CC(O)c1ccccc1,0.0016,30.0,8.0,1.1.1.311,76114.0,-2.7958800173440754,-2.7958800173440754,CC(O)c1ccccc1__MTQRLKDKLAVITGGANGIGRAIAERFAVEGADIAIADLVPAPEAEAAIRNLGRRVLTVKCDVSQPGDVEAFGKQVISTFGRCDILVNNAGIYPLIPFDELTFEQWKKTFEINVDSGFLMAKAFVPGMKRNGWGRIINLTSTTYWLKIEAYTHYISTKAANIGFTRALASDLGKDGITVNAIAPSLVRTATTEASALSAMFDVLPNMLQAIPRLQVPLDLTGAAAFLASDDASFITGQTLAVDGGMVRH,./data/raw/alphafold//AF-Q5P5I4-F1-model_v4.pdb,3758,1453,2246,2175 +1486,20949,21264,MTTPRKFDEYRWNVLVDGVPLNVESRYPISDPSTGRYLTQVPDCAEADVDRAVQASRQAQAEWGALPPRARAAKLRELITLLREHREEFAMLDAIDGGFPISMMRNDVDAALELMDIFADMALDLGGKTIPVSTNLHFTTHEPFGVVARIGAFNHPFFFAASKVAAPLMAGNSVILKAPDQTPLSSLRLAEVAAEVLPQNLLITISGRGRVAGRAIVRHPQIKRIGFIGSTDTGRSIQRDAAEVAVKHISLELGGKNAQIVFADADLEQAALGAVNGMNFTWTAGQSCGSTSRLLVHESVADQVIARVVELVSAIAVGPPLDENAQMGPLVSQAQYDKSVHAIGEGIREGAKVVAGGGRPEGVGEGGWYLAPTVLADVRPGSFIEQNEIFGPVLSVIIFATDDEAVAIANGVEYGLTASVWTSDITRAHLIARRVEAGYVLVNGGSRHYWGLPFGGVKSSGVGSEESMEELISYTETKTTTVVLG,brenda,Q79EM7,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.083,25.0,9.4,1.2.1.78,35761.0,-1.080921907623926,-1.080921907623926,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MTTPRKFDEYRWNVLVDGVPLNVESRYPISDPSTGRYLTQVPDCAEADVDRAVQASRQAQAEWGALPPRARAAKLRELITLLREHREEFAMLDAIDGGFPISMMRNDVDAALELMDIFADMALDLGGKTIPVSTNLHFTTHEPFGVVARIGAFNHPFFFAASKVAAPLMAGNSVILKAPDQTPLSSLRLAEVAAEVLPQNLLITISGRGRVAGRAIVRHPQIKRIGFIGSTDTGRSIQRDAAEVAVKHISLELGGKNAQIVFADADLEQAALGAVNGMNFTWTAGQSCGSTSRLLVHESVADQVIARVVELVSAIAVGPPLDENAQMGPLVSQAQYDKSVHAIGEGIREGAKVVAGGGRPEGVGEGGWYLAPTVLADVRPGSFIEQNEIFGPVLSVIIFATDDEAVAIANGVEYGLTASVWTSDITRAHLIARRVEAGYVLVNGGSRHYWGLPFGGVKSSGVGSEESMEELISYTETKTTTVVLG,./data/raw/alphafold//AF-Q79EM7-F1-model_v4.pdb,4336,5312,4314,7305 +1487,6601,6718,MKILVTGAAGFIGSHLCEELLKDKKHNVIGIDDFIGPTPFSLKLKNLKNLLSEKRFTFIKENLLTADLAPLLEGVDVIFHLAAIPGVRSSWGNHFHPYAAHNIQALQRLLEACREHSIQTFIFASTSSVYGEKQGKVSENTSLSPLSPYGVTKLTGEKLCHVYQQSFGIPIVILRFFTVYGPRQRPDMAFHRLIKQHLHQKPLTIFGDGQQSRDFTYIGDCVKGITAVLGKPHLIGETVNIGGAERASVLKVVSLIEDISGRKATLHFSDKIAGEPSNTWADITKAKQLLHYDPATSLKNGLTNEIAYLSSLYQGE,uniprot_search,A0A9Q3TI89,CC(O)=N[C@H]1[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)O[C@H](CO)[C@H](O)[C@@H]1O,0.0114,45.0,7.0,5.1.3.7,5741.0,-1.9430951486635275,-1.9430951486635275,CC(O)=N[C@H]1[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)O[C@H](CO)[C@H](O)[C@@H]1O__MKILVTGAAGFIGSHLCEELLKDKKHNVIGIDDFIGPTPFSLKLKNLKNLLSEKRFTFIKENLLTADLAPLLEGVDVIFHLAAIPGVRSSWGNHFHPYAAHNIQALQRLLEACREHSIQTFIFASTSSVYGEKQGKVSENTSLSPLSPYGVTKLTGEKLCHVYQQSFGIPIVILRFFTVYGPRQRPDMAFHRLIKQHLHQKPLTIFGDGQQSRDFTYIGDCVKGITAVLGKPHLIGETVNIGGAERASVLKVVSLIEDISGRKATLHFSDKIAGEPSNTWADITKAKQLLHYDPATSLKNGLTNEIAYLSSLYQGE,./data/raw/esmfold//ESMFold-A0A9Q3TI89-v1.pdb,5718,2509,3150,3634 +1488,35344,35963,MALAIRSSLRAAAMGRKAFRQAVPVRVAPAQRVRSVTTASAEITAYSVEEKGPKDSLEYRMFFKQGAKEVSCWHEIPLYAGDGHLHYICEIPKETSAKMEVATDEPRTPIKQDVKKGKLRFYPYNINWNYGMLPQTWEDPGHTDATLGAAGDNDPVDVVEIGAAAAKRGGVYKVKPVGVLAMIDDGELDWKVIAISADDPKAALCNDVEDVEKHFPGEIQKVLEWFRDYKIPDGKPANKFGYDNKCMNKEFTLNVIKETHEAYVKLKSGARANSEELSLI,sabio,Q93Y52,O=P(O)(O)OP(=O)(O)O,0.0105,22.0,7.5,3.6.1.1,3055.0,-1.978810700930062,-1.978810700930062,O=P(O)(O)OP(=O)(O)O__MALAIRSSLRAAAMGRKAFRQAVPVRVAPAQRVRSVTTASAEITAYSVEEKGPKDSLEYRMFFKQGAKEVSCWHEIPLYAGDGHLHYICEIPKETSAKMEVATDEPRTPIKQDVKKGKLRFYPYNINWNYGMLPQTWEDPGHTDATLGAAGDNDPVDVVEIGAAAAKRGGVYKVKPVGVLAMIDDGELDWKVIAISADDPKAALCNDVEDVEKHFPGEIQKVLEWFRDYKIPDGKPANKFGYDNKCMNKEFTLNVIKETHEAYVKLKSGARANSEELSLI,./data/raw/alphafold//AF-Q93Y52-F1-model_v4.pdb,2294,7832,9642,10788 +1489,17506,17760,MWQLWASLCCLLVLANARSRPSFHPLSDELVNYVNKRNTTWQAGHNFYNVDMSYLKRLCGTFLGGPKPPQRVMFTEDLKLPASFDAREQWPQCPTIKEIRDQGSCGSCWAFGAVEAISDRICIHTNAHVSVEVSAEDLLTCCGSMCGDGCNGGYPAEAWNFWTRKGLVSGGLYESHVGCRPYSIPPCEHHVNGSRPPCTGEGDTPKCSKICEPGYSPTYKQDKHYGYNSYSVSNSEKDIMAEIYKNGPVEGAFSVYSDFLLYKSGVYQHVTGEMMGGHAIRILGWGVENGTPYWLVANSWNTDWGDNGFFKILRGQDHCGIESEVVAGIPRTDQYWEKI,brenda,P07858,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc3ccccc3)N=C(O)c3ccccc3)ccc12,0.075,37.0,6.0,3.4.22.1,9606.0,-1.1249387366083,-1.1249387366083,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc3ccccc3)N=C(O)c3ccccc3)ccc12__MWQLWASLCCLLVLANARSRPSFHPLSDELVNYVNKRNTTWQAGHNFYNVDMSYLKRLCGTFLGGPKPPQRVMFTEDLKLPASFDAREQWPQCPTIKEIRDQGSCGSCWAFGAVEAISDRICIHTNAHVSVEVSAEDLLTCCGSMCGDGCNGGYPAEAWNFWTRKGLVSGGLYESHVGCRPYSIPPCEHHVNGSRPPCTGEGDTPKCSKICEPGYSPTYKQDKHYGYNSYSVSNSEKDIMAEIYKNGPVEGAFSVYSDFLLYKSGVYQHVTGEMMGGHAIRILGWGVENGTPYWLVANSWNTDWGDNGFFKILRGQDHCGIESEVVAGIPRTDQYWEKI,./data/raw/alphafold//AF-P07858-F1-model_v4.pdb,839,4247,3951,2212 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+1539,34028,34627,MTASSVLLHTGQKMPLIGLGTWKSEPGQVKAAIKHALSAGYRHIDCASVYGNETEIGEALKESVGSGKAVPREELFVTSKLWNTKHHPEDVEPALRKTLADLQLEYLDLYLMHWPYAFERGDNPFPKNADGTVRYDSTHYKETWKALEVLVAKGLVKALGLSNFNSRQIDDVLSVASVRPAVLQVECHPYLAQNELIAHCHARGLEVTAYSPLGSSDRAWRHPDEPVLLEEPVVLALAEKHGRSPAQILLRWQVQRKVICIPKSINPSRILQNIQVFDFTFSPEEMKQLDALNKNWRYIVPMITVDGKRVPRDAGHPLYPFNDPY,sabio,Q9JII6,O=Cc1ccccc1,0.336,25.0,5.4,1.1.1.2,10090.0,-0.4736607226101559,-0.4736607226101559,O=Cc1ccccc1__MTASSVLLHTGQKMPLIGLGTWKSEPGQVKAAIKHALSAGYRHIDCASVYGNETEIGEALKESVGSGKAVPREELFVTSKLWNTKHHPEDVEPALRKTLADLQLEYLDLYLMHWPYAFERGDNPFPKNADGTVRYDSTHYKETWKALEVLVAKGLVKALGLSNFNSRQIDDVLSVASVRPAVLQVECHPYLAQNELIAHCHARGLEVTAYSPLGSSDRAWRHPDEPVLLEEPVVLALAEKHGRSPAQILLRWQVQRKVICIPKSINPSRILQNIQVFDFTFSPEEMKQLDALNKNWRYIVPMITVDGKRVPRDAGHPLYPFNDPY,./data/raw/alphafold//AF-Q9JII6-F1-model_v4.pdb,2022,889,1072,4254 +1540,18560,18826,MVLPHEPEFQQAYNELVSALEDSTLFTEKPEYKKVIPVVSVPERIIQFRVAWENDNGDVEVNNGYRVQFNSALGPFKGGLRFHPSVNLSILKFLGFEQIFKNALTGLSMGGGKGGCDFNPKGRTDSEIRRFCVAFMRQLARYIGSDTDVPAGDIGVGSREVGYMFGAYKQMQNNWSGILTGKGLSWGGSLIRPEATGYGVVYFVEKMIEKATGGKESFKGKRVAISGSGNVAQYAALKVIELGSTVVSLSDSKGCIISQTGITPDQIKAIAAAKIHFKTLEEITKESASLFSGSNEVQYIAGVRPWTHCGQVDVALPSATQNEVSGEEAKALVEAGCKFVAEGSNMGSTKEAIDVFEANRSKAVWYAPGKAANCGGVAVSGLEMAQNSQRVTWAAEEVDEKLKNIMYTCFDNCYATAA,uniprot_search,B4F4L8,N,16.0,25.0,8.0,1.4.1.4,4959.0,1.2041199826559248,1.2041199826559248,N__MVLPHEPEFQQAYNELVSALEDSTLFTEKPEYKKVIPVVSVPERIIQFRVAWENDNGDVEVNNGYRVQFNSALGPFKGGLRFHPSVNLSILKFLGFEQIFKNALTGLSMGGGKGGCDFNPKGRTDSEIRRFCVAFMRQLARYIGSDTDVPAGDIGVGSREVGYMFGAYKQMQNNWSGILTGKGLSWGGSLIRPEATGYGVVYFVEKMIEKATGGKESFKGKRVAISGSGNVAQYAALKVIELGSTVVSLSDSKGCIISQTGITPDQIKAIAAAKIHFKTLEEITKESASLFSGSNEVQYIAGVRPWTHCGQVDVALPSATQNEVSGEEAKALVEAGCKFVAEGSNMGSTKEAIDVFEANRSKAVWYAPGKAANCGGVAVSGLEMAQNSQRVTWAAEEVDEKLKNIMYTCFDNCYATAA,./data/raw/alphafold//AF-B4F4L8-F1-model_v4.pdb,4351,4664,6464,6387 +1541,4737,4811,MKKLIISLLQDILPMTIFDKFDSIFTQVEQLWHRLPTPLALIKLLTFRNELREKNLHDTSQLPDKHLLPQPTPDPQGHHLTARTADGSFNDLEHPEMGMAGTRFGRNIPLTAIQPETPQQLMTPNPRVVSRTLMTREDFKPATILNLLAAAWIQFENHDWFSHGDNKPEDKLEIPLEANDPWPEEYRPLEVGKTLPDTSRPEGAKPPTFINTVTHWWDGSQIYGSNPETVDQLRSHEDGKLIIGENGLLPVDPETGVDITGFNDNWWIGLGMLHTLFTREHNLICDHLKQEYSQWSDDDLFDHARLINAALMAKIHTVDWTPAILPLPATDIALNVNWNGFLGEDIKQVLGTVGEGEIADLLTGIIGSDKNHHTAPYYLTEEFVSVYRMHPLIPDELEFRSLEGDKFLQEVNFFEMSGKRTRALLESISLPDLFYSFGITHPGAITLHNYPRFLQQLVRDNGEVFDLAAVDILRDRERGVPRYNRFREIMGRGRVKCFEEISSNKQWVEEMRRVYNDNIDQVDLMVGLFAEDTPEGFGFSDTAFRVFILMASRRLKSDRFFTTDYRAEIYTQFGLDWIANNNMVSVLQRHFPQLSPVLYGVDNAFKPWRRVPS,brenda,B1WSS6,CC(C)CCCCCCCCCCCC(=O)O,0.0162,25.0,7.5,1.13.11.92,2546360.0,-1.790484985457369,-1.790484985457369,CC(C)CCCCCCCCCCCC(=O)O__MKKLIISLLQDILPMTIFDKFDSIFTQVEQLWHRLPTPLALIKLLTFRNELREKNLHDTSQLPDKHLLPQPTPDPQGHHLTARTADGSFNDLEHPEMGMAGTRFGRNIPLTAIQPETPQQLMTPNPRVVSRTLMTREDFKPATILNLLAAAWIQFENHDWFSHGDNKPEDKLEIPLEANDPWPEEYRPLEVGKTLPDTSRPEGAKPPTFINTVTHWWDGSQIYGSNPETVDQLRSHEDGKLIIGENGLLPVDPETGVDITGFNDNWWIGLGMLHTLFTREHNLICDHLKQEYSQWSDDDLFDHARLINAALMAKIHTVDWTPAILPLPATDIALNVNWNGFLGEDIKQVLGTVGEGEIADLLTGIIGSDKNHHTAPYYLTEEFVSVYRMHPLIPDELEFRSLEGDKFLQEVNFFEMSGKRTRALLESISLPDLFYSFGITHPGAITLHNYPRFLQQLVRDNGEVFDLAAVDILRDRERGVPRYNRFREIMGRGRVKCFEEISSNKQWVEEMRRVYNDNIDQVDLMVGLFAEDTPEGFGFSDTAFRVFILMASRRLKSDRFFTTDYRAEIYTQFGLDWIANNNMVSVLQRHFPQLSPVLYGVDNAFKPWRRVPS,./data/raw/alphafold//AF-B1WSS6-F1-model_v4.pdb,5099,1955,1578,2919 +1542,39354,40053,MTNRTAETTDPGRRRLLGAGAVATLAGALTLGTTSSAQAADKAPDANIYDVTSWKIKGRPAVTAQVDIGAVINDIIADIKKRQASADSRPGAVITIPPGDYDLRTQVVVDISYLTIAGFGHGFFSRNIKDNVDTSGWLDLQPGGSHIRVLTAPTAPQAFLVRRDGSPRLSGVVFRDFCLDGVEFPPDGNSYRNGRTGIEVASDNDSFHITGMGFVYLEHALIVRGADALRVHDNMIAECGNCVELTGAGQATIVSDNLMGAGPDGVTLLAENHEGLLVTGNNLFPRGRSLVEMSGCNRCSVTSNRFQGFFPGMMRLVNNCKENLVTGNHFRRGMEGFPPFLGKSNGLDDLYGVVHIAGDNNLFSSNLIAYDVAPDRIVPAGARPTMVLIAGGDSNVVATNHVVSNVEGQNVVLDASTVRSKVLDSGPASRITSYSADTAIRPTP,brenda,B8HEC1,OC[C@H]1O[C@@](CO)(OC[C@@]2(OC[C@@]3(OC[C@@]4(OC[C@@]5(O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)O[C@H](CO)[C@@H](O)[C@@H]5O)O[C@H](CO)[C@@H](O)[C@@H]4O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O,12.93,65.0,5.5,4.2.2.18,85085.0,1.111598524880394,1.111598524880394,OC[C@H]1O[C@@](CO)(OC[C@@]2(OC[C@@]3(OC[C@@]4(OC[C@@]5(O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)O[C@H](CO)[C@@H](O)[C@@H]5O)O[C@H](CO)[C@@H](O)[C@@H]4O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O__MTNRTAETTDPGRRRLLGAGAVATLAGALTLGTTSSAQAADKAPDANIYDVTSWKIKGRPAVTAQVDIGAVINDIIADIKKRQASADSRPGAVITIPPGDYDLRTQVVVDISYLTIAGFGHGFFSRNIKDNVDTSGWLDLQPGGSHIRVLTAPTAPQAFLVRRDGSPRLSGVVFRDFCLDGVEFPPDGNSYRNGRTGIEVASDNDSFHITGMGFVYLEHALIVRGADALRVHDNMIAECGNCVELTGAGQATIVSDNLMGAGPDGVTLLAENHEGLLVTGNNLFPRGRSLVEMSGCNRCSVTSNRFQGFFPGMMRLVNNCKENLVTGNHFRRGMEGFPPFLGKSNGLDDLYGVVHIAGDNNLFSSNLIAYDVAPDRIVPAGARPTMVLIAGGDSNVVATNHVVSNVEGQNVVLDASTVRSKVLDSGPASRITSYSADTAIRPTP,./data/raw/alphafold//AF-B8HEC1-F1-model_v4.pdb,2702,8439,8486,11613 +1543,3112,3165,MFRKRSKDLSLSPTIILVISEIISFFLLFCTVILVCSVASHAATPSIPIYDYQIVHSYPHDTKAFTEGFFYRNGYFYESTGLNGRSSIRKVDIESGKTLQQIELGKRYFGEGISDWKDKIVGLTWKNGLGFVWNIRNLRQVRSFNYDGEGWGLTHNDQYLIMSDGTPVLRFLDPESLTPVRTITVTAHGEELPELNELEWVDGEIFANVWQTNKIVRIDPETGKVTGIIDLNGILAEAGPLPSPIDVLNGIAWDKEHHRLFVTGKLWPKVFEITLTQRVGGHK,brenda,Q5NLA9,CC(C)(C)OC(=O)[C@@H](N)CCC(=N)O,8.2,35.0,6.0,2.3.2.5,542.0,0.9138138523837168,0.9138138523837168,CC(C)(C)OC(=O)[C@@H](N)CCC(=N)O__MFRKRSKDLSLSPTIILVISEIISFFLLFCTVILVCSVASHAATPSIPIYDYQIVHSYPHDTKAFTEGFFYRNGYFYESTGLNGRSSIRKVDIESGKTLQQIELGKRYFGEGISDWKDKIVGLTWKNGLGFVWNIRNLRQVRSFNYDGEGWGLTHNDQYLIMSDGTPVLRFLDPESLTPVRTITVTAHGEELPELNELEWVDGEIFANVWQTNKIVRIDPETGKVTGIIDLNGILAEAGPLPSPIDVLNGIAWDKEHHRLFVTGKLWPKVFEITLTQRVGGHK,./data/raw/alphafold//AF-Q5NLA9-F1-model_v4.pdb,3771,1474,2277,2209 +1544,2485,2528,MVSPRPVGLMLLLIIARVSRGAGIGFRFASYIDNYMVLQKEPSGAVIWGFGTAGATVTVTLCQGQETIMKKVTSVKGPSNTWMVVLDPMKPGGPFEVMAQQTLETTNLTLRVHDVLFGDVWLCSGQSNMQMTVLQIFNASKELSDTAAYQSVRIFSVSLTQAEEELADLDGVDLSWSKPTAGNLGHGNFTYMSAVCWLFGRYLYDTLQYPIGLVSSSWGGTPIEVWSSRRALKACGVPNTRDERVLQPEIKPMRNGCESKESSCPFRRFVPCDPVAGPATHSVLWNAMIHPLQNMTLKGVVWYQGENNANYNRDLYACMFPALIAGWRQTFHSGCQGQTERFFPFGFVQLSSYLLMNSSDYGFPEIRWHQTADFGSVPNPKMPNTFMAVAMDLCDRDSPFGSIHPRDKQTVAYRLHLGARAVAYGEKNLTFQGPLPKKIELLARNELLNLTYDQEIQVQRKDNKTFEISCCSDHQCKWLPAPVNTFSTQTLILDLSACLGTVDAVRYAWTTWPCEYKQCAVYHTSSVLPAPPFTARITHRGI,uniprot_search,P82450,CC(=O)Oc1cccc2ccccc12,1.71,37.0,7.5,3.1.1.53,10116.0,0.2329961103921538,0.2329961103921538,CC(=O)Oc1cccc2ccccc12__MVSPRPVGLMLLLIIARVSRGAGIGFRFASYIDNYMVLQKEPSGAVIWGFGTAGATVTVTLCQGQETIMKKVTSVKGPSNTWMVVLDPMKPGGPFEVMAQQTLETTNLTLRVHDVLFGDVWLCSGQSNMQMTVLQIFNASKELSDTAAYQSVRIFSVSLTQAEEELADLDGVDLSWSKPTAGNLGHGNFTYMSAVCWLFGRYLYDTLQYPIGLVSSSWGGTPIEVWSSRRALKACGVPNTRDERVLQPEIKPMRNGCESKESSCPFRRFVPCDPVAGPATHSVLWNAMIHPLQNMTLKGVVWYQGENNANYNRDLYACMFPALIAGWRQTFHSGCQGQTERFFPFGFVQLSSYLLMNSSDYGFPEIRWHQTADFGSVPNPKMPNTFMAVAMDLCDRDSPFGSIHPRDKQTVAYRLHLGARAVAYGEKNLTFQGPLPKKIELLARNELLNLTYDQEIQVQRKDNKTFEISCCSDHQCKWLPAPVNTFSTQTLILDLSACLGTVDAVRYAWTTWPCEYKQCAVYHTSSVLPAPPFTARITHRGI,./data/raw/alphafold//AF-P82450-F1-model_v4.pdb,3599,1183,1900,1768 +1545,11106,11262,MSSNTRVALVTGANKGIGFAIVRDLCRQFAGDVVLTARDVARGQAAVKQLQAEGLSPRFHQLDIIDLQSIRALCDFLRKEYGGLDVLVNNAAIAFQLDNPTPFHIQAELTMKTNFMGTRNVCTELLPLIKPQGRVVNVSSTEGVRALNECSPELQQKFKSETITEEELVGLMNKFVEDTKNGVHRKEGWSDSTYGVTKIGVSVLSRIYARKLREQRAGDKILLNACCPGWVRTDMGGPKAPKSPEVGAETPVYLALLPSDAEGPHGQFVTDKKVVEWGVPPESYPWVNA,uniprot_search,Q28960,CCCCC[C@H](O)/C=C/[C@H]1C(=O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O,0.07,24.0,9.416666666666666,1.1.1.196,9823.0,-1.154901959985743,-1.2194493081754718,CCCCC[C@H](O)/C=C/[C@H]1C(=O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O__MSSNTRVALVTGANKGIGFAIVRDLCRQFAGDVVLTARDVARGQAAVKQLQAEGLSPRFHQLDIIDLQSIRALCDFLRKEYGGLDVLVNNAAIAFQLDNPTPFHIQAELTMKTNFMGTRNVCTELLPLIKPQGRVVNVSSTEGVRALNECSPELQQKFKSETITEEELVGLMNKFVEDTKNGVHRKEGWSDSTYGVTKIGVSVLSRIYARKLREQRAGDKILLNACCPGWVRTDMGGPKAPKSPEVGAETPVYLALLPSDAEGPHGQFVTDKKVVEWGVPPESYPWVNA,./data/raw/alphafold//AF-Q28960-F1-model_v4.pdb,3404,851,1023,2154 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+1606,19966,20262,MYQLKIEGQAPGTCGSGKSLLVSALANGIGFPYECASGGCGVCKFELLEGNVQSMWPDAPGLSSRDREKGNRHLACQCVALSDLRIKVAVQDKYVPTIPISRMEAEVVEVRALTHDLLSVRLRTDGPANFLPGQFCLVEAEQLPGVVRAYSMANLKNPEGIWEFYIKRVPTGRFSPWLFENRKEGARLFLTGPMGTSFFRPGTGRKSLCIGGGAGLSYAAAIARASMRETDKPVKLFYGSRTPRDAVRWIDIDIDEDKLEVVQAVTEDTDSLWQGPTGFIHQVVDAALLETLPEYEIYLAGPPPMVDATVRMLLGKGVPRDQIHFDAFF,brenda,Q8GI14,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.182,30.0,7.5,1.14.12.22,53412.0,-0.7399286120149252,-0.7399286120149252,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MYQLKIEGQAPGTCGSGKSLLVSALANGIGFPYECASGGCGVCKFELLEGNVQSMWPDAPGLSSRDREKGNRHLACQCVALSDLRIKVAVQDKYVPTIPISRMEAEVVEVRALTHDLLSVRLRTDGPANFLPGQFCLVEAEQLPGVVRAYSMANLKNPEGIWEFYIKRVPTGRFSPWLFENRKEGARLFLTGPMGTSFFRPGTGRKSLCIGGGAGLSYAAAIARASMRETDKPVKLFYGSRTPRDAVRWIDIDIDEDKLEVVQAVTEDTDSLWQGPTGFIHQVVDAALLETLPEYEIYLAGPPPMVDATVRMLLGKGVPRDQIHFDAFF,./data/raw/alphafold//AF-Q8GI14-F1-model_v4.pdb,4109,4950,6820,6802 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+1610,13549,13745,MKQFSAKYALILLATAGQALAASTQGISEDLYNRLVEMATISQAAYADLCNIPSTIIKGEKIYNAQTDINGWILRDDTSKEIITVFRGTGSDTNLQLDTNYTLTPFDTLPQCNDCEVHGGYYIGWISVQDQVESLVKQQASQYPDYALTVTGHSLGASMAALTAAQLSATYDNVRLYTFGEPRSGNQAFASYMNDAFQVSSPETTQYFRVTHSNDGIPNLPPADEGYAHGGVEYWSVDPYSAQNTFVCTGDEVQCCEAQGGQGVNDAHTTYFGMTSGACTW,brenda,O42807,COc1cc(/C=C/C(=O)OC[C@@H]2O[C@@H](Oc3ccc([N+](=O)[O-])cc3)[C@H](O)[C@H]2O)ccc1O,0.073,40.0,6.4,3.1.1.73,5061.0,-1.136677139879544,-1.136677139879544,COc1cc(/C=C/C(=O)OC[C@@H]2O[C@@H](Oc3ccc([N+](=O)[O-])cc3)[C@H](O)[C@H]2O)ccc1O__MKQFSAKYALILLATAGQALAASTQGISEDLYNRLVEMATISQAAYADLCNIPSTIIKGEKIYNAQTDINGWILRDDTSKEIITVFRGTGSDTNLQLDTNYTLTPFDTLPQCNDCEVHGGYYIGWISVQDQVESLVKQQASQYPDYALTVTGHSLGASMAALTAAQLSATYDNVRLYTFGEPRSGNQAFASYMNDAFQVSSPETTQYFRVTHSNDGIPNLPPADEGYAHGGVEYWSVDPYSAQNTFVCTGDEVQCCEAQGGQGVNDAHTTYFGMTSGACTW,./data/raw/alphafold//AF-O42807-F1-model_v4.pdb,3571,1184,1901,1769 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+1620,33927,34526,MEKSMVFHVLLVLQLCVHLQSEVQSLATPSEHDFSYSKSVVNATDLPQEEVYDYIVVGGGTAGCPLAATLSLNYSVLVLERGSFPTSYPNVLTQDGFIYNLQQEDDGETPVQRVMSEDGIPTVRGRILGGTSIINAGVYARASISFFSQSGVEWDMDLVNATYEWIEDTIVYKPNAFAWQTVTQQAFLEAGVLPDNGFSLDHVLGTRITGSTFDNNGTRHAADELLNKGDLDNLRVAVHANVEKILISSTFESNLSARGVIFKDSNGTSHRAYVRNQGEVILSAGTMGTPQLLLLSGVGPESYLSSLGIPVVIDHPYVGHFLYDNPRNFINILPPNPVEGSIVTALGIRNNFWQCSISGGPLTVPPYSFFPSQSYPLPNSTFVHIPNKVPGPLSHGFLTLNSSNDVTVGPNVIFNYYSNATDLAHCVSGMKQFGDLLRTDAFEPYKTQDLPGVEGFTFLGVPFPNNQTYDALETFCNDSLASYWHYHGGCIVGKVVDGGLRVRGIDALRVVDSSTFPVTPASHPTGFYLMLGRYMGLQILQERSPWAGISSA,brenda,B7VF77,O=Cc1ccc2ccccc2c1,1.1,40.0,5.5,4.1.2.10,2843217.0,0.041392685158225,0.041392685158225,O=Cc1ccc2ccccc2c1__MEKSMVFHVLLVLQLCVHLQSEVQSLATPSEHDFSYSKSVVNATDLPQEEVYDYIVVGGGTAGCPLAATLSLNYSVLVLERGSFPTSYPNVLTQDGFIYNLQQEDDGETPVQRVMSEDGIPTVRGRILGGTSIINAGVYARASISFFSQSGVEWDMDLVNATYEWIEDTIVYKPNAFAWQTVTQQAFLEAGVLPDNGFSLDHVLGTRITGSTFDNNGTRHAADELLNKGDLDNLRVAVHANVEKILISSTFESNLSARGVIFKDSNGTSHRAYVRNQGEVILSAGTMGTPQLLLLSGVGPESYLSSLGIPVVIDHPYVGHFLYDNPRNFINILPPNPVEGSIVTALGIRNNFWQCSISGGPLTVPPYSFFPSQSYPLPNSTFVHIPNKVPGPLSHGFLTLNSSNDVTVGPNVIFNYYSNATDLAHCVSGMKQFGDLLRTDAFEPYKTQDLPGVEGFTFLGVPFPNNQTYDALETFCNDSLASYWHYHGGCIVGKVVDGGLRVRGIDALRVVDSSTFPVTPASHPTGFYLMLGRYMGLQILQERSPWAGISSA,./data/raw/alphafold//AF-B7VF77-F1-model_v4.pdb,3773,1470,2271,2203 +1621,26128,26571,MGILALVTDAVSLPIDYDMPPLLEACRTVGITAEVCDWEDGTVDWSRFEAVVFRSPWTWAERQAEFLAFCERVSHVTRLITPMPLVRWALDKRYLADLAAHGVPVIPTTVVAPGSDALAAVRDFLAARPEAREFVVKPTDGCYSKDVQRYQRSLAEPASRHVARLLANGSHVILQPYVESVDRHGETDLTFFDGVYSHAIHKGAMLMPDGTVHVPTLDFRQARDADEDQRAVAAAALAASVAHLGLDLPLVCGRVDLVRGADGSPMVLEMELCEPSLNLTFSEDGALRFAQALAERLKP,brenda,D2Z030,N[C@H](CCS)C(=O)O,19.0,30.0,8.0,6.3.3.5,1914.0,1.2787536009528289,1.2787536009528289,N[C@H](CCS)C(=O)O__MGILALVTDAVSLPIDYDMPPLLEACRTVGITAEVCDWEDGTVDWSRFEAVVFRSPWTWAERQAEFLAFCERVSHVTRLITPMPLVRWALDKRYLADLAAHGVPVIPTTVVAPGSDALAAVRDFLAARPEAREFVVKPTDGCYSKDVQRYQRSLAEPASRHVARLLANGSHVILQPYVESVDRHGETDLTFFDGVYSHAIHKGAMLMPDGTVHVPTLDFRQARDADEDQRAVAAAALAASVAHLGLDLPLVCGRVDLVRGADGSPMVLEMELCEPSLNLTFSEDGALRFAQALAERLKP,./data/raw/alphafold//AF-D2Z030-F1-model_v4.pdb,4221,5125,7032,7039 +1622,21861,22200,MTTKNKRVLQKCAYREEFKGDMERSTAATSKLPLEVELSRNSKGLIIILSSPSGTGKSSLAKALLKIDNNLRLSISATTRKPRLGEVEGINYYFKTGLEFEELVKQNKFLEYAKIYDNYYGTPKEYVEMLLNQGLDVLFDIDWQGARSIKKNATNVVTIFVLPPNIEVLEQRLRNRATDNEEAIKLRMQLAQNEISHANEYDYVVTNDDFDRTLKKIHAIIVAARDKAF,brenda,Q92GC9,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1,0.0051,,,2.7.4.8,781.0,-2.292429823902064,-2.292429823902064,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1__MTTKNKRVLQKCAYREEFKGDMERSTAATSKLPLEVELSRNSKGLIIILSSPSGTGKSSLAKALLKIDNNLRLSISATTRKPRLGEVEGINYYFKTGLEFEELVKQNKFLEYAKIYDNYYGTPKEYVEMLLNQGLDVLFDIDWQGARSIKKNATNVVTIFVLPPNIEVLEQRLRNRATDNEEAIKLRMQLAQNEISHANEYDYVVTNDDFDRTLKKIHAIIVAARDKAF,./data/raw/alphafold//AF-Q92GC9-F1-model_v4.pdb,4490,5558,6003,7632 +1623,34306,34907,MSQQERTRVAIVGAGIVGLTLAIALNAFDKERKLAIDIYENASELAEIGAGINVWPRTLAIFKQIGVEDALIPLLDHIPDLEPRIIFGIRKGDEKNGYQVYDTMNNGGALRVHRAHLQNTLIQHLPLPGSKVTEINSICGFHLGHNLIDYSHHSSSGQGPLTLHFSDGKPSRTCDILVGADGIKSTLRHLFLPRLPNPEKYLNCYEPKWKGLLAYRGLVPKEKLEAVSPGHRALTHPGLMYSGKSAYAVVYPVSNGKFINVVAIVHDNPTNSTVWPGPWRMDVTQSEFFEVYKGWDEEVLDLIRCVDKPTKWALHALDHLDVYAKGRVFLMGDAAHAMLPHLGAGAHVGMEDAYILASLITHSSTPIWPSTQHVSEIANIYNTMRIPRAVSMSNSTDEAGYLCNLENPGLEEFKVGDHIPKELLIQTARTMEKKWAWTTTYADEDRIKAISLLEGPRAVL,uniprot_search,Q92402,O=O,0.2,40.0,6.916666666666667,1.14.13.27,5341.0,-0.6989700043360187,-0.6989700043360187,O=O__MSQQERTRVAIVGAGIVGLTLAIALNAFDKERKLAIDIYENASELAEIGAGINVWPRTLAIFKQIGVEDALIPLLDHIPDLEPRIIFGIRKGDEKNGYQVYDTMNNGGALRVHRAHLQNTLIQHLPLPGSKVTEINSICGFHLGHNLIDYSHHSSSGQGPLTLHFSDGKPSRTCDILVGADGIKSTLRHLFLPRLPNPEKYLNCYEPKWKGLLAYRGLVPKEKLEAVSPGHRALTHPGLMYSGKSAYAVVYPVSNGKFINVVAIVHDNPTNSTVWPGPWRMDVTQSEFFEVYKGWDEEVLDLIRCVDKPTKWALHALDHLDVYAKGRVFLMGDAAHAMLPHLGAGAHVGMEDAYILASLITHSSTPIWPSTQHVSEIANIYNTMRIPRAVSMSNSTDEAGYLCNLENPGLEEFKVGDHIPKELLIQTARTMEKKWAWTTTYADEDRIKAISLLEGPRAVL,./data/raw/alphafold//AF-Q92402-F1-model_v4.pdb,4090,4923,6786,6760 +1624,7491,7622,MQIVCHQVPVLAGSATLATMGTLILCLGKPASYGKHTESVSSGVPFLPARIAWFLQELPSFVVSVGMLAWQPRSLFGPPGNVLLALFSAHYFHRTFIYSLLTRGRPFPAVLFLRATAFCIGNGLLQAYYLVYCAEYPEEWYTDVRFSFGVFLFILGMGINIHSDYTLRQLRKPGEVIYRIPRGGLFTYVSGANFLGEIIEWIGYALATWSVPAFAFAFFTLCFLGMQAFYHHRFYLKMFKDYPKSRKALIPFIF,sabio,P31214,CC12CCC(=O)C=C1CCC1C2C(O)CC2(C)C(C(=O)CO)CCC12,0.000376,37.0,5.0,1.3.1.22,10116.0,-3.424812155072339,-3.424812155072339,CC12CCC(=O)C=C1CCC1C2C(O)CC2(C)C(C(=O)CO)CCC12__MQIVCHQVPVLAGSATLATMGTLILCLGKPASYGKHTESVSSGVPFLPARIAWFLQELPSFVVSVGMLAWQPRSLFGPPGNVLLALFSAHYFHRTFIYSLLTRGRPFPAVLFLRATAFCIGNGLLQAYYLVYCAEYPEEWYTDVRFSFGVFLFILGMGINIHSDYTLRQLRKPGEVIYRIPRGGLFTYVSGANFLGEIIEWIGYALATWSVPAFAFAFFTLCFLGMQAFYHHRFYLKMFKDYPKSRKALIPFIF,./data/raw/alphafold//AF-P31214-F1-model_v4.pdb,19,883,5429,1306 +1625,16834,17078,MIRNSLTDVFFAKDDVENLHEGVLRVLSKVGVKIENDEALGIFEQHGARVENGTVYIGEVLLNKALQTVPANFELQGFDRTVQVGLDHDPVVIPTNGTPMVLNFDGSYSDTNTDDLVNFYKLIDTSDVMQVTSEIAVDVPGLDKTKDSLLAQTALLMKYSHKPIYNILGATIHNYKKGSVAQGVRENIQFAKKYYGYDDKYVIYSGTCVISPLGVGWEAMDHFMGFIKENQPISITACSMTNLTAPGSLYGSVVEDAAAILSIVVLSQLMNPGLPVLYTSLSSMSDMRYVQLCMGAPEFALITLGHIALANFYKIPVRVGGALGDAFKADYQAGVESFVGLMAPMLSQSAMIPHGCGTMGSFNLTSYEKFIMDEETIRYLMRLRRGFEVSDKRKEKALKDITKVGPRGNFLGGRTPKEYREDNYLASEVFNRKGCKENTREEQGDIRDRARKVYDARMEAYELPDTTLEQKKLLNTELPEQYKFDI,brenda,A0A317RMF0,C[N+](C)(C)C[C@H](O)CC(=O)O,0.4,37.0,7.2,2.1.1.383,1736.0,-0.3979400086720376,-0.3979400086720376,C[N+](C)(C)C[C@H](O)CC(=O)O__MIRNSLTDVFFAKDDVENLHEGVLRVLSKVGVKIENDEALGIFEQHGARVENGTVYIGEVLLNKALQTVPANFELQGFDRTVQVGLDHDPVVIPTNGTPMVLNFDGSYSDTNTDDLVNFYKLIDTSDVMQVTSEIAVDVPGLDKTKDSLLAQTALLMKYSHKPIYNILGATIHNYKKGSVAQGVRENIQFAKKYYGYDDKYVIYSGTCVISPLGVGWEAMDHFMGFIKENQPISITACSMTNLTAPGSLYGSVVEDAAAILSIVVLSQLMNPGLPVLYTSLSSMSDMRYVQLCMGAPEFALITLGHIALANFYKIPVRVGGALGDAFKADYQAGVESFVGLMAPMLSQSAMIPHGCGTMGSFNLTSYEKFIMDEETIRYLMRLRRGFEVSDKRKEKALKDITKVGPRGNFLGGRTPKEYREDNYLASEVFNRKGCKENTREEQGDIRDRARKVYDARMEAYELPDTTLEQKKLLNTELPEQYKFDI,./data/raw/alphafold//AF-A0A317RMF0-F1-model_v4.pdb,42,2747,3422,3960 +1626,15487,15707,MGAPVLPAAFGFLASARTGGGRAPGPVFATRGSHTDIDTPQGERSLAATLVHAPSVAPDRAVARSLTGAPTTAVLAGEIYNRDELLSVLPAGPAPEGDAELVLRLLERYDLHAFRLVNGRFATVVRTGDRVLLATDHAGSVPLYTCVAPGEVRASTEAKALAAHRDPKGFPLADARRVAGLTGVYQVPAGAVMDIDLGSGTAVTHRTWTPGLSRRILPEGEAVAAVRAALEKAVAQRVTPGDTPLVVLSGGIDSSGVAACAHRAAGELDTVSMGTDTSNEFREARAVVDHLRTRHREITIPTTELLAQLPYAVWASESVDPDIIEYLLPLTALYRALDGPERRILTGYGADIPLGGMHREDRLPALDTVLAHDMATFDGLNEMSPVLSTLAGHWTTHPYWDREVLDLLVSLEAGLKRRHGRDKWVLRAAMADALPAETVNRPKLGVHEGSGTTSSFSRLLLDHGVAEDRVHEAKRQVVRELFDLTVGGGRHPSEVDTDDVVRSVADRTARGAA,brenda,P0DJQ7,C[C@H](CN[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O,0.04,30.0,7.1,6.3.3.4,1901.0,-1.3979400086720375,-1.3979400086720375,C[C@H](CN[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O__MGAPVLPAAFGFLASARTGGGRAPGPVFATRGSHTDIDTPQGERSLAATLVHAPSVAPDRAVARSLTGAPTTAVLAGEIYNRDELLSVLPAGPAPEGDAELVLRLLERYDLHAFRLVNGRFATVVRTGDRVLLATDHAGSVPLYTCVAPGEVRASTEAKALAAHRDPKGFPLADARRVAGLTGVYQVPAGAVMDIDLGSGTAVTHRTWTPGLSRRILPEGEAVAAVRAALEKAVAQRVTPGDTPLVVLSGGIDSSGVAACAHRAAGELDTVSMGTDTSNEFREARAVVDHLRTRHREITIPTTELLAQLPYAVWASESVDPDIIEYLLPLTALYRALDGPERRILTGYGADIPLGGMHREDRLPALDTVLAHDMATFDGLNEMSPVLSTLAGHWTTHPYWDREVLDLLVSLEAGLKRRHGRDKWVLRAAMADALPAETVNRPKLGVHEGSGTTSSFSRLLLDHGVAEDRVHEAKRQVVRELFDLTVGGGRHPSEVDTDDVVRSVADRTARGAA,./data/raw/alphafold//AF-P0DJQ7-F1-model_v4.pdb,5352,3273,4029,4695 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+1628,30384,30921,MAALTMQFEGEKKNVSEVADVTLKQEDEQQERRSYSTPFREERDTFGPIQVPSDKLWGAQTQRSLQNFEIGGDRERMPEPIVRAFGVLKKCAAKVNMEYGLDPMIGEAIMEAAQEVAEGKLNDHFPLVVWQTGSGTQSNMNANEVIANRAAEILGHKRGEKIVHPNDHVNRSQSSNDTFPTVMHIAAATEITSRLIPSLKNLHSSLESKSFEFKDIVKIGRTHTQDATPLTLGQEFGGYATQVEYGLNRVACTLPRIYQLAQGGTAVGTGLNTKKGFDVKIAAAVAEETNLPFVTAENKFEALAAHDACVETSGSLNTIATSLMKIANDIRFLGSGPRCGLGELSLPENEPGSSIMPGKVNPTQCEALTMVCAQVMGNHVAVTIGGSNGHFELNVFKPVIASALLHSIRLIADASASFEKNCVRGIEANRERISKLLHESLMLVTSLNPKIGYDNAAAVAKRAHKEGCTLKHAAMKLGVLTSEEFDTLVVPEKMIGPSD,sabio,Q9FI53,O=C(O)C=CC(=O)O,0.5,30.0,,4.2.1.2,3702.0,-0.3010299956639812,-0.284623988107254,O=C(O)C=CC(=O)O__MAALTMQFEGEKKNVSEVADVTLKQEDEQQERRSYSTPFREERDTFGPIQVPSDKLWGAQTQRSLQNFEIGGDRERMPEPIVRAFGVLKKCAAKVNMEYGLDPMIGEAIMEAAQEVAEGKLNDHFPLVVWQTGSGTQSNMNANEVIANRAAEILGHKRGEKIVHPNDHVNRSQSSNDTFPTVMHIAAATEITSRLIPSLKNLHSSLESKSFEFKDIVKIGRTHTQDATPLTLGQEFGGYATQVEYGLNRVACTLPRIYQLAQGGTAVGTGLNTKKGFDVKIAAAVAEETNLPFVTAENKFEALAAHDACVETSGSLNTIATSLMKIANDIRFLGSGPRCGLGELSLPENEPGSSIMPGKVNPTQCEALTMVCAQVMGNHVAVTIGGSNGHFELNVFKPVIASALLHSIRLIADASASFEKNCVRGIEANRERISKLLHESLMLVTSLNPKIGYDNAAAVAKRAHKEGCTLKHAAMKLGVLTSEEFDTLVVPEKMIGPSD,./data/raw/alphafold//AF-Q9FI53-F1-model_v4.pdb,1009,7264,9280,9229 +1629,5715,5801,MWCIVLFSLLAWVYAEPTMYGEILSPNYPQAYPSEVEKSWDIEVPEGYGIHLYFTHLDIELSENCAYDSVQIISGDTEEGRLCGQRSSNNPHSPIVEEFQVPYNKLQVIFKSDFSNEERFTGFAAYYVATDINECTDFVDVPCSHFCNNFIGGYFCSCPPEYFLHDDMKNCGVNCSGDVFTALIGEIASPNYPKPYPENSRCEYQIRLEKGFQVVVTLRREDFDVEAADSAGNCLDSLVFVAGDRQFGPYCGHGFPGPLNIETKSNALDIIFQTDLTGQKKGWKLRYHGDPMPCPKEDTPNSVWEPAKAKYVFRDVVQITCLDGFEVVEGRVGATSFYSTCQSNGKWSNSKLKCQPVDCGIPESIENGKVEDPESTLFGSVIRYTCEEPYYYMENGGGGEYHCAGNGSWVNEVLGPELPKCVPVCGVPREPFEEKQRIIGGSDADIKNFPWQVFFDNPWAGGALINEYWVLTAAHVVEGNREPTMYVGSTSVQTSRLAKSKMLTPEHVFIHPGWKLLEVPEGRTNFDNDIALVRLKDPVKMGPTVSPICLPGTSSDYNLMDGDLGLISGWGRTEKRDRAVRLKAARLPVAPLRKCKEVKVEKPTADAEAYVFTPNMICAGGEKGMDSCKGDSGGAFAVQDPNDKTKFYAAGLVSWGPQCGTYGLYTRVKNYVDWIMKTMQENSTPRED,uniprot_search,P09871,CC(C)[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)c1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1,0.36,37.0,7.649999999999999,3.4.21.42,9606.0,-0.4436974992327127,-0.4436974992327127,CC(C)[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)c1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1__MWCIVLFSLLAWVYAEPTMYGEILSPNYPQAYPSEVEKSWDIEVPEGYGIHLYFTHLDIELSENCAYDSVQIISGDTEEGRLCGQRSSNNPHSPIVEEFQVPYNKLQVIFKSDFSNEERFTGFAAYYVATDINECTDFVDVPCSHFCNNFIGGYFCSCPPEYFLHDDMKNCGVNCSGDVFTALIGEIASPNYPKPYPENSRCEYQIRLEKGFQVVVTLRREDFDVEAADSAGNCLDSLVFVAGDRQFGPYCGHGFPGPLNIETKSNALDIIFQTDLTGQKKGWKLRYHGDPMPCPKEDTPNSVWEPAKAKYVFRDVVQITCLDGFEVVEGRVGATSFYSTCQSNGKWSNSKLKCQPVDCGIPESIENGKVEDPESTLFGSVIRYTCEEPYYYMENGGGGEYHCAGNGSWVNEVLGPELPKCVPVCGVPREPFEEKQRIIGGSDADIKNFPWQVFFDNPWAGGALINEYWVLTAAHVVEGNREPTMYVGSTSVQTSRLAKSKMLTPEHVFIHPGWKLLEVPEGRTNFDNDIALVRLKDPVKMGPTVSPICLPGTSSDYNLMDGDLGLISGWGRTEKRDRAVRLKAARLPVAPLRKCKEVKVEKPTADAEAYVFTPNMICAGGEKGMDSCKGDSGGAFAVQDPNDKTKFYAAGLVSWGPQCGTYGLYTRVKNYVDWIMKTMQENSTPRED,./data/raw/alphafold//AF-P09871-F1-model_v4.pdb,3535,1064,1271,1560 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+1674,23203,23559,SLSSAISPSSYAAIAAAYSARTPIFNKKKTAAVLSPLSLFHQSPSLSKTGIFLHRGRKESSSKFYIAASVTTAVPSLDDSVEKVHLPRGAMWSIHKFGGTCVGSSERIRNVAEIVVEDDSERKLVVVSAMSKVTDMMYDLIYKAQSRDDSYESALDAVMEKHKLTAFDLLDEDDLARFLTRLQHDVITLKAMLRAIYIAGHATESFSDFVVGHGELWSAQLLSFVIRKNGGDCNWMDTRDVLVVNPAGSNQVDPDYLESEKRLEKWFSSNQCQTIVATGFIASTPQNIPTTLKRDGSDFSAAIMGALLRAGQVTIWTDVNGVYSADPRKVSEAVVLKTLSYQEAWEMSYFGANVLHPRTINPVMRYDIPIVIRNIFNLSAPGTMICRESVGETEDGLKLESHVKGFATIDNLALINVEGTGMAGVPGTATAIFGAVKDVGANVIMISQASSEHSICFAVPESEVKAVAKALEARFRQALDAGRLSQVANNPNCSILATVGQKMASTPGVSATLFNALAKANINVRAIAQGCTEYNITVVLSREDCVRALKAVHSRFYLSRTTIAVGIVGPGLIGATLLDQLRDQAAILKENSKIDLRVMGITGSRTMLLSETGIDLSRWREVQKEKGQTAGLEKFVQHVRGNHFIPSTVIVDCTADSEVASHYHDWLCRGIHVITPNKKANSGPLDQYLKLRALQRRSYTHYFYEATVVAGLPIITTLQGLLETGDKILRIEGIFSGTLSYIFNNFKSTTPFSEVVSEAKAAGYTEPDPRDDLAGTDVARKVIILARGSGLKLELSDIPVQSLVPEPLRGIASAEEFLLQLPQFDSDMTRKREDAENAGEVLRYVGVVDAVNQKGVVELKRYKKEHPFAQLSGSDNINAFTTERYNKQPPIIRGPGAGAEVTAGGVFSDILRLASYLGAPS,sabio,P37142,NC(CC(=O)O)C(=O)O,1.0,37.0,8.0,2.7.2.4,4039.0,0.0,0.4771212547196624,NC(CC(=O)O)C(=O)O__SLSSAISPSSYAAIAAAYSARTPIFNKKKTAAVLSPLSLFHQSPSLSKTGIFLHRGRKESSSKFYIAASVTTAVPSLDDSVEKVHLPRGAMWSIHKFGGTCVGSSERIRNVAEIVVEDDSERKLVVVSAMSKVTDMMYDLIYKAQSRDDSYESALDAVMEKHKLTAFDLLDEDDLARFLTRLQHDVITLKAMLRAIYIAGHATESFSDFVVGHGELWSAQLLSFVIRKNGGDCNWMDTRDVLVVNPAGSNQVDPDYLESEKRLEKWFSSNQCQTIVATGFIASTPQNIPTTLKRDGSDFSAAIMGALLRAGQVTIWTDVNGVYSADPRKVSEAVVLKTLSYQEAWEMSYFGANVLHPRTINPVMRYDIPIVIRNIFNLSAPGTMICRESVGETEDGLKLESHVKGFATIDNLALINVEGTGMAGVPGTATAIFGAVKDVGANVIMISQASSEHSICFAVPESEVKAVAKALEARFRQALDAGRLSQVANNPNCSILATVGQKMASTPGVSATLFNALAKANINVRAIAQGCTEYNITVVLSREDCVRALKAVHSRFYLSRTTIAVGIVGPGLIGATLLDQLRDQAAILKENSKIDLRVMGITGSRTMLLSETGIDLSRWREVQKEKGQTAGLEKFVQHVRGNHFIPSTVIVDCTADSEVASHYHDWLCRGIHVITPNKKANSGPLDQYLKLRALQRRSYTHYFYEATVVAGLPIITTLQGLLETGDKILRIEGIFSGTLSYIFNNFKSTTPFSEVVSEAKAAGYTEPDPRDDLAGTDVARKVIILARGSGLKLELSDIPVQSLVPEPLRGIASAEEFLLQLPQFDSDMTRKREDAENAGEVLRYVGVVDAVNQKGVVELKRYKKEHPFAQLSGSDNINAFTTERYNKQPPIIRGPGAGAEVTAGGVFSDILRLASYLGAPS,./data/raw/alphafold//AF-P37142-F1-model_v4.pdb,4028,1893,7503,8445 +1675,9577,9728,MEMLEEHRCFEGWQQRWRHDSSTLNCPMTFSIFLPPPRDHTPPPVLYWLSGLTCNDENFTTKAGAQRVAAELGIVLVMPDTSPRGEKVANDDGYDLGQGAGFYLNATQPPWATHYRMYDYLRDELPALVQSQFNVSDRCAISGHSMGGHGALIMALKNPGKYTSVSAFAPIVNPCSVPWGIKAFSSYLGEDKNAWLEWDSCALMYASNAQDAIPTLIDQGDNDQFLADQLQPAVLAEAARQKAWPMTLRIQPGYDHSYYFIASFIEDHLRFHAQYLLK,sabio,P33018,CCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1,0.95,37.0,8.0,3.1.2.12,562.0,-0.0222763947111522,-0.0222763947111522,CCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1__MEMLEEHRCFEGWQQRWRHDSSTLNCPMTFSIFLPPPRDHTPPPVLYWLSGLTCNDENFTTKAGAQRVAAELGIVLVMPDTSPRGEKVANDDGYDLGQGAGFYLNATQPPWATHYRMYDYLRDELPALVQSQFNVSDRCAISGHSMGGHGALIMALKNPGKYTSVSAFAPIVNPCSVPWGIKAFSSYLGEDKNAWLEWDSCALMYASNAQDAIPTLIDQGDNDQFLADQLQPAVLAEAARQKAWPMTLRIQPGYDHSYYFIASFIEDHLRFHAQYLLK,./data/raw/alphafold//AF-P33018-F1-model_v4.pdb,3590,1218,1949,1828 +1676,37958,38628,MAYFNDIAPIKYEGTKTKNMFAFRHYNPEEVVAGKTMEEQLHFALAFWHTITMDGSDPFGGATMERPWDLEGGSELDRAHRRVDAFFEIAEKLGVKYYCFHDIDIAPTGNSLKEFYANLDEITDHLLEKQKATGIKLLWNTANMFSNPRYMNGVSTSNRAEVFAYGAAQVKKGLELSKKLGGENYVFWGGREGYESLLNTDRGLEMDHMAKFFHLAIDYAKSINHLPIFLIEPKPKEPMTHQYDFDAATALAFLQKYDLDKYFKLNLETNHAWLVGHTFEHELNTARTFNALGSIDANQGNYLLGWDTDEFPTLVIDITLAMHQILLNGGLGKGGINFDAKVRRTSFKAEDLILAHIAGMDTYARALKGAAAIIEDKFLSDIVDERYTSYKNTEVGQSIENGTATFESLAAFALEHGDDIELDSNHLEYIKSVLNDYLV,sabio,Q9CFG7,OCC1OC(O)C(O)C(O)C1O,493.0,35.0,7.5,5.3.1.5,1360.0,2.69284691927723,2.610060902636941,OCC1OC(O)C(O)C(O)C1O__MAYFNDIAPIKYEGTKTKNMFAFRHYNPEEVVAGKTMEEQLHFALAFWHTITMDGSDPFGGATMERPWDLEGGSELDRAHRRVDAFFEIAEKLGVKYYCFHDIDIAPTGNSLKEFYANLDEITDHLLEKQKATGIKLLWNTANMFSNPRYMNGVSTSNRAEVFAYGAAQVKKGLELSKKLGGENYVFWGGREGYESLLNTDRGLEMDHMAKFFHLAIDYAKSINHLPIFLIEPKPKEPMTHQYDFDAATALAFLQKYDLDKYFKLNLETNHAWLVGHTFEHELNTARTFNALGSIDANQGNYLLGWDTDEFPTLVIDITLAMHQILLNGGLGKGGINFDAKVRRTSFKAEDLILAHIAGMDTYARALKGAAAIIEDKFLSDIVDERYTSYKNTEVGQSIENGTATFESLAAFALEHGDDIELDSNHLEYIKSVLNDYLV,./data/raw/alphafold//AF-Q9CFG7-F1-model_v4.pdb,2602,7019,8878,9130 +1677,28104,28587,MATPPKRSCPSFSASSEGTRIKKISIEGNIAAGKSTFVNILKQLCEDWEVVPEPVARWCNVQSTQDEFEELTMSQKNGGNVLQMMYEKPERWSFTFQTYACLSRIRAQLASLNGKLKDAEKPVLFFERSVYSDRYIFASNLYESECMNETEWTIYQDWHDWMNNQFGQSLELDGIIYLQATPETCLHRIYLRGRNEEQGIPLEYLEKLHYKHESWLLHRTLKTNFDYLQEVPILTLDVNEDFKDKYESLVEKVKEFLSTL,brenda,P27707,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.0035,37.0,7.5,2.7.1.74,9606.0,-2.4559319556497243,-1.7616451372714348,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MATPPKRSCPSFSASSEGTRIKKISIEGNIAAGKSTFVNILKQLCEDWEVVPEPVARWCNVQSTQDEFEELTMSQKNGGNVLQMMYEKPERWSFTFQTYACLSRIRAQLASLNGKLKDAEKPVLFFERSVYSDRYIFASNLYESECMNETEWTIYQDWHDWMNNQFGQSLELDGIIYLQATPETCLHRIYLRGRNEEQGIPLEYLEKLHYKHESWLLHRTLKTNFDYLQEVPILTLDVNEDFKDKYESLVEKVKEFLSTL,./data/raw/alphafold//AF-P27707-F1-model_v4.pdb,981,4426,5889,6288 +1678,17892,18152,MGTKGKVIKCKAAIAWEAGKPLCIEEVEVAPPKAHEVRIQIIATSLCHTDATVIDSKFEGLAFPVIVGHEAAGIVESIGPGVTNVKPGDKVIPLYAPLCRKCKFCLSPLTNLCGKISNLKSPASDQQLMEDKTSRFTCKGKPVYHFFGTSTFSQYTVVSDINLAKIDDDANLERVCLLGCGFSTGYGAAINNAKVTPGSTCAVFGLGGVGLSAVMGCKAAGASRIIGIDINSEKFVKAKALGATDCLNPRDLHKPIQEVIIELTKGGVDFALDCAGGSETMKAALDCTTAGWGSCTFIGVAAGSKGLTIFPEELIIGRTINGTFFGGWKSVDSIPKLVTDYKNKKFNLDALVTHTLPFDKISEAFDLMNQGKSVRTILIF,brenda,P08319,Cc1ccc2ccc3c(CO)ccc4ccc1c2c43,0.00028,33.5,8.09375,1.1.1.1,9606.0,-3.552841968657781,-3.552841968657781,Cc1ccc2ccc3c(CO)ccc4ccc1c2c43__MGTKGKVIKCKAAIAWEAGKPLCIEEVEVAPPKAHEVRIQIIATSLCHTDATVIDSKFEGLAFPVIVGHEAAGIVESIGPGVTNVKPGDKVIPLYAPLCRKCKFCLSPLTNLCGKISNLKSPASDQQLMEDKTSRFTCKGKPVYHFFGTSTFSQYTVVSDINLAKIDDDANLERVCLLGCGFSTGYGAAINNAKVTPGSTCAVFGLGGVGLSAVMGCKAAGASRIIGIDINSEKFVKAKALGATDCLNPRDLHKPIQEVIIELTKGGVDFALDCAGGSETMKAALDCTTAGWGSCTFIGVAAGSKGLTIFPEELIIGRTINGTFFGGWKSVDSIPKLVTDYKNKKFNLDALVTHTLPFDKISEAFDLMNQGKSVRTILIF,./data/raw/alphafold//AF-P08319-F1-model_v4.pdb,5403,3181,1361,3127 +1679,12365,12536,MSRFQSLFFFVLVSLTAVANAAIGPVADLTLTNAQVSPDGFAREAVVVNGITPAPLITGNKGDRFQLNVIDQLTNHTMLKTSSIHWHGFFQQGTNWADGPAFVNQCPIASGHSFLYDFQVPDQAGTFWYHSHLSTQYCDGLRGPFVVYDPNDPHASLYDIDNDDTVITLADWYHVAAKLGPRFPFGSDSTLINGLGRTTGIAPSDLAVIKVTQGKRYRFRLVSLSCDPNHTFSIDNHTMTIIEADSINTQPLEVDSIQIFAAQRYSFVLDASQPVDNYWIRANPAFGNTGFAGGINSAILRYDGAPEIEPTSVQTTPTKPLNEVDLHPLSPMPVPGSPEPGGVDKPLNLVFNFNGTNFFINDHTFVPPSVPVLLQILSGAQAAQDLVPEGSVFVLPSNSSIEISFPATANAPGFPHPFHLHGHAFAVVRSAGSSVYNYDNPIFRDVVSTGQPGDNVTIRFETNNPGPWFLHCHIDFHLDAGFAVVMAEDTPDTKAANPVPQAWSDLCPIYDALDPSDL,brenda,Q9UVQ2,CCn1/c(=N/N=c2\sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21,0.028,65.0,4.5,1.10.3.2,5643.0,-1.5528419686577808,-1.4653300225292565,CCn1/c(=N/N=c2\sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21__MSRFQSLFFFVLVSLTAVANAAIGPVADLTLTNAQVSPDGFAREAVVVNGITPAPLITGNKGDRFQLNVIDQLTNHTMLKTSSIHWHGFFQQGTNWADGPAFVNQCPIASGHSFLYDFQVPDQAGTFWYHSHLSTQYCDGLRGPFVVYDPNDPHASLYDIDNDDTVITLADWYHVAAKLGPRFPFGSDSTLINGLGRTTGIAPSDLAVIKVTQGKRYRFRLVSLSCDPNHTFSIDNHTMTIIEADSINTQPLEVDSIQIFAAQRYSFVLDASQPVDNYWIRANPAFGNTGFAGGINSAILRYDGAPEIEPTSVQTTPTKPLNEVDLHPLSPMPVPGSPEPGGVDKPLNLVFNFNGTNFFINDHTFVPPSVPVLLQILSGAQAAQDLVPEGSVFVLPSNSSIEISFPATANAPGFPHPFHLHGHAFAVVRSAGSSVYNYDNPIFRDVVSTGQPGDNVTIRFETNNPGPWFLHCHIDFHLDAGFAVVMAEDTPDTKAANPVPQAWSDLCPIYDALDPSDL,./data/raw/alphafold//AF-Q9UVQ2-F1-model_v4.pdb,5296,1096,4171,1625 +1680,12240,12410,MAKFQSLLTFITLSLVASVYASIGPVADLTISNGAVSPDGFSRQAILVNDVFPSPLITGNKGDRFQLNVIDNMTNHTMLKSTSIHWHGFFQHGTNWADGPAFVNQCPISTGHAFLYDFQVPDQAGTFWYHSHLSTQYCDGLRGPIVVYDPQDPHKSLYDVDDDSTVITLADWYHLAAKVGPAVPTADATLINGLGRSINTLNADLAVITVTKGKRYRFRLVSLSCDPNHTFSIDGHSLTVIEADSVNLKPQTVDSIQIFAAQRYSFVLNADQDVDNYWIRALPNSGTRNFDGGVNSAILRYDGAAPVEPTTTQTPSTQPLVESALTTLEGTAAPGNPTPGGVDLALNMAFGFAGGRFTINGASFTPPTVPVLLQILSGAQSAQDLLPSGSVYSLPANADIEISLPATSAAPGFPHPFHLHGHTFAVVRSAGSSTYNYANPVYRDVVSTGSPGDNVTIRFRTDNPGPWFLHCHIDFHLEAGFAVVMAEDIPDVAATNPVPQAWSDLCPTYDALSPDDQ,sabio,Q12571,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21,0.009,25.0,5.0,1.10.3.2,63133.0,-2.0457574905606752,-2.0457574905606752,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21__MAKFQSLLTFITLSLVASVYASIGPVADLTISNGAVSPDGFSRQAILVNDVFPSPLITGNKGDRFQLNVIDNMTNHTMLKSTSIHWHGFFQHGTNWADGPAFVNQCPISTGHAFLYDFQVPDQAGTFWYHSHLSTQYCDGLRGPIVVYDPQDPHKSLYDVDDDSTVITLADWYHLAAKVGPAVPTADATLINGLGRSINTLNADLAVITVTKGKRYRFRLVSLSCDPNHTFSIDGHSLTVIEADSVNLKPQTVDSIQIFAAQRYSFVLNADQDVDNYWIRALPNSGTRNFDGGVNSAILRYDGAAPVEPTTTQTPSTQPLVESALTTLEGTAAPGNPTPGGVDLALNMAFGFAGGRFTINGASFTPPTVPVLLQILSGAQSAQDLLPSGSVYSLPANADIEISLPATSAAPGFPHPFHLHGHTFAVVRSAGSSTYNYANPVYRDVVSTGSPGDNVTIRFRTDNPGPWFLHCHIDFHLEAGFAVVMAEDIPDVAATNPVPQAWSDLCPTYDALSPDDQ,./data/raw/alphafold//AF-Q12571-F1-model_v4.pdb,5296,1096,4097,4770 +1681,17623,17880,MAPSVTLPLTTAILAIARLVAAQQPGTSTPEVHPKLTTYKCTKSGGCVAQDTSVVLDWNYRWMHDANYNSCTVNGGVNTTLCPDEATCGKNCFIEGVDYAASGVTTSGSSLTMNQYMPSSSGGYSSVSPRLYLLDSDGEYVMLKLNGQELSFDVDLSALPCGENGSLYLSQMDENGGANQYNTAGANYGSGYCDAQCPVQTWRNGTLNTSHQGFCCNEMDILEGNSRANALTPHSCTATACDSAGCGFNPYGSGYKSYYGPGDTVDTSKTFTIITQFNTDNGSPSGNLVSITRKYQQNGVDIPSAQPGGDTISSCPSASAYGGLATMGKALSSGMVLVFSIWNDNSQYMNWLDSGNAGPCSSTEGNPSNILANNPNTHVVFSNIRWGDIGSTTNSTAPPPPPASSTTFSTTRRSSTTSSSPSCTQTHWGQCGGIGYSGCKTCTSGTTCQYSNDYYSQCL,brenda,P07981,Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)ccc12,0.125,45.0,5.0,3.2.1.4,51453.0,-0.9030899869919436,-0.9030899869919436,Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)ccc12__MAPSVTLPLTTAILAIARLVAAQQPGTSTPEVHPKLTTYKCTKSGGCVAQDTSVVLDWNYRWMHDANYNSCTVNGGVNTTLCPDEATCGKNCFIEGVDYAASGVTTSGSSLTMNQYMPSSSGGYSSVSPRLYLLDSDGEYVMLKLNGQELSFDVDLSALPCGENGSLYLSQMDENGGANQYNTAGANYGSGYCDAQCPVQTWRNGTLNTSHQGFCCNEMDILEGNSRANALTPHSCTATACDSAGCGFNPYGSGYKSYYGPGDTVDTSKTFTIITQFNTDNGSPSGNLVSITRKYQQNGVDIPSAQPGGDTISSCPSASAYGGLATMGKALSSGMVLVFSIWNDNSQYMNWLDSGNAGPCSSTEGNPSNILANNPNTHVVFSNIRWGDIGSTTNSTAPPPPPASSTTFSTTRRSSTTSSSPSCTQTHWGQCGGIGYSGCKTCTSGTTCQYSNDYYSQCL,./data/raw/alphafold//AF-P07981-F1-model_v4.pdb,327,4272,5714,6122 +1682,14353,14560,MDRRGFNRRVLLGGAAAATSLSIAPEVAGAAPAAKGITARTAPAGGEVRHLKMYAEKLADGQMGYGFEKGKASVPGPLIEVNEGDTLHIEFTNTMDVRASLHVHGLDYEISSDGTAMNKSDVEPGGTRTYTWRTHKPGRRDDGTWRPGSAGYWHYHDHVVGTEHGTGGIRNGLYGPVIVRRKGDVLPDATHTIVFNDMTINNRKPHTGPDFEATVGDRVEIVMITHGEYYHTFHMHGHRWADNRTGILTGPDDPSRVIDNKITGPADSFGFQIIAGEGVGAGAWMYHCHVQSHSDMGMVGLFLVKKPDGTIPGYEPHEHGGATAKSGESGEPTGGAAAHEHEH,sabio,Q9XAL8,COc1ccccc1OC(CO)C(O)c1ccc(O)c(O)c1,102.0,25.0,8.0,1.10.3.2,1902.0,2.008600171761917,2.043890708904771,COc1ccccc1OC(CO)C(O)c1ccc(O)c(O)c1__MDRRGFNRRVLLGGAAAATSLSIAPEVAGAAPAAKGITARTAPAGGEVRHLKMYAEKLADGQMGYGFEKGKASVPGPLIEVNEGDTLHIEFTNTMDVRASLHVHGLDYEISSDGTAMNKSDVEPGGTRTYTWRTHKPGRRDDGTWRPGSAGYWHYHDHVVGTEHGTGGIRNGLYGPVIVRRKGDVLPDATHTIVFNDMTINNRKPHTGPDFEATVGDRVEIVMITHGEYYHTFHMHGHRWADNRTGILTGPDDPSRVIDNKITGPADSFGFQIIAGEGVGAGAWMYHCHVQSHSDMGMVGLFLVKKPDGTIPGYEPHEHGGATAKSGESGEPTGGAAAHEHEH,./data/raw/alphafold//AF-Q9XAL8-F1-model_v4.pdb,408,3622,4948,4775 +1683,31682,32240,MPAKLNSPSRYHGIYNAPHRAFLRSVGLTDEEIGKPLVAIATAWSEAGPCNFHTLALARVAKEGTKEAGLSPLAFPTMVVNDNIGMGSEGMRYSLVSRDLIADMVEAQFNAHAFDGLVGIGGCDKTTPGILMAMARLNVPSIYIYGGSAEPGYFMGKRLTIEDVHEAIGAYLAKRITENELYEIEKRAHPTLGTCSGLFTANTMGSMSEALGMALPGSASPTATSSRRVMYVKETGKALGSLIENGIKSREILTFEAFENAITTLMAMGGSTNAVLHLLAIAYEAGVKLTLDDFNRISKRTPYIASMKPGGDYVMADLDEVGGVPVVLKKLLDAGLLHGDVLTVTGKTMKQNLEQYKYPNVPHSHIVRDVKNPIKPRGGIVILKGSLAPEGAVIKVAATNVVKFEGKAKVYNSEDDAFKGVQSGEVSEGEVVIIRYEGPKGAPGMPEMLRVTAAIMGAGLNNVALVTDGRFSGATRGPMVGHVAPEAMVGGPIAIVEDGDTIVIDVESERLDLKLSEEEIKNRLKRWSPPSPRYKSGLLAKYASLVSQASMGAVTRPA,brenda,Q97UB2,O=C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,7.8,78.5,7.1,4.2.1.9,2287.0,0.8920946026904804,0.6379549843354558,O=C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO__MPAKLNSPSRYHGIYNAPHRAFLRSVGLTDEEIGKPLVAIATAWSEAGPCNFHTLALARVAKEGTKEAGLSPLAFPTMVVNDNIGMGSEGMRYSLVSRDLIADMVEAQFNAHAFDGLVGIGGCDKTTPGILMAMARLNVPSIYIYGGSAEPGYFMGKRLTIEDVHEAIGAYLAKRITENELYEIEKRAHPTLGTCSGLFTANTMGSMSEALGMALPGSASPTATSSRRVMYVKETGKALGSLIENGIKSREILTFEAFENAITTLMAMGGSTNAVLHLLAIAYEAGVKLTLDDFNRISKRTPYIASMKPGGDYVMADLDEVGGVPVVLKKLLDAGLLHGDVLTVTGKTMKQNLEQYKYPNVPHSHIVRDVKNPIKPRGGIVILKGSLAPEGAVIKVAATNVVKFEGKAKVYNSEDDAFKGVQSGEVSEGEVVIIRYEGPKGAPGMPEMLRVTAAIMGAGLNNVALVTDGRFSGATRGPMVGHVAPEAMVGGPIAIVEDGDTIVIDVESERLDLKLSEEEIKNRLKRWSPPSPRYKSGLLAKYASLVSQASMGAVTRPA,./data/raw/alphafold//AF-Q97UB2-F1-model_v4.pdb,4911,1655,2503,2484 +1684,32017,32581,GSGSAATDKFKAERATADTSPERLAAIAKDALGALNDVILKHGVTYPEYRVFKQWLIDVGEGGEWPLFLDVFIEHSVEEVLARSRKGTMGSIEGPYYIENSPELPSKCTLPMREEDEKITPLVFSGQVTDLDGNGLAGAKVELWHADNDGYYSQFAPHLPEWNLRGTIIADEEGRYEITTIQPAPYQIPTDGPTGQFIEAQNGHPWRPAHLHLIVSAPGKESVTTQLYFKGGEWIDSDVASATKPELILDPKTGDDGKNYVTYNFVLDPA,brenda,P95607,O=C(O)c1cccc(O)c1O,0.7,25.0,7.2,1.13.11.1,37919.0,-0.1549019599857432,-0.1549019599857432,O=C(O)c1cccc(O)c1O__GSGSAATDKFKAERATADTSPERLAAIAKDALGALNDVILKHGVTYPEYRVFKQWLIDVGEGGEWPLFLDVFIEHSVEEVLARSRKGTMGSIEGPYYIENSPELPSKCTLPMREEDEKITPLVFSGQVTDLDGNGLAGAKVELWHADNDGYYSQFAPHLPEWNLRGTIIADEEGRYEITTIQPAPYQIPTDGPTGQFIEAQNGHPWRPAHLHLIVSAPGKESVTTQLYFKGGEWIDSDVASATKPELILDPKTGDDGKNYVTYNFVLDPA,./data/raw/alphafold//AF-P95607-F1-model_v4.pdb,910,4334,5781,6195 +1685,12884,13071,MKQFSAKFALALSAAAGQALAASTQGISEDLYNRLVEMATISQAAYANMCNIPSTITVGEKIYNAQTDINGWVLRDDSTKEIITVFRGTGSDTNLQLDTNYTLTPFSTFSECSGCEVHGGYFIGWSSVQDQVMSLVKEQADQYPDYTLTVTGHSLGASMATLAAAQLSGTYDNITLYTFGEPRSGNEAFASYMNDKFTATSADTTKYFRVTHSNDGIPNLPPAEQGYVHGGVEYWSVDPYSAQNTYVCTGDEVQCCEAQGGQGVNDAHTTYFGMTSGACTW,brenda,A0A068FNL1,COC(=O)/C=C/c1cc(OC)c(O)c(OC)c1,0.29,40.0,5.0,3.1.1.73,33178.0,-0.5376020021010439,-0.5376020021010439,COC(=O)/C=C/c1cc(OC)c(O)c(OC)c1__MKQFSAKFALALSAAAGQALAASTQGISEDLYNRLVEMATISQAAYANMCNIPSTITVGEKIYNAQTDINGWVLRDDSTKEIITVFRGTGSDTNLQLDTNYTLTPFSTFSECSGCEVHGGYFIGWSSVQDQVMSLVKEQADQYPDYTLTVTGHSLGASMATLAAAQLSGTYDNITLYTFGEPRSGNEAFASYMNDKFTATSADTTKYFRVTHSNDGIPNLPPAEQGYVHGGVEYWSVDPYSAQNTYVCTGDEVQCCEAQGGQGVNDAHTTYFGMTSGACTW,./data/raw/alphafold//AF-A0A068FNL1-F1-model_v4.pdb,3571,1184,1901,4941 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+1744,16827,17071,MAEAHQAVAFQFTVTPDGIDLRMSHEALRQIYLSGLHSWKKKFIRFKNGIITGVYPASPSSWLIVVVGVMSTMYAKIDPSLGIIAKINRTLDTTGCMSSQTKKVVSGVIFGTGLWAALIVTMRYSLKVLLSYHGWMFTQHGSLSRTTKIWMFMVKIFSGRKPMLYSFQTSLPRLPVPAVQDTVNRYLESVKPLMKEGDFTRMTALAQDFAVNLGPRLQWYLKLKSWWATNYVSDWWEEYIYLRGRGPLMVNSNYFAMDLLYIKPTHIQAARAGNGIHAILLYRRKLDREEIKPILLLGSTIPLCSAQWERMFNTSRIPGEETDTIQHLRDSKHIVVFHRGRYFKVWLYHDGRLLRPREIEQQVQRILEDPSEPQPGEAKLAALTAADRVPWARCRQAYFGHGKNKQSLDAIEKAAFFVTLDETEQGYREEDPETSMDSYAKSLLHGRCFDRWFDKSFTFIIFKNGKIGINAEHSWADAPIMGHLWEYVMATDSFQLGYTEDGHCKGDTNPNIPYPTRLQWDIPEECQEVIETSLSSANLLANDVDFHSFPFRTFGKGLIKKCKTSPDAFVQLSLQLAHYKDMGKFSLTYEASMTRLFREGRTETVRSCTTESCNFVLAMMDPTQTAEQKLKLFKIASEKHQLLYRLAMTGAGIDRHLFCLYVVSKYLAVDSPFLKEVLSEPWRLSTSQTPPQQVELFNLDRNPDYVSSGGGFGPVADDGYGVSYILVGEDLINFHISSKFSCPETDSHRFGKNLREAMTDIISLFGFSPNSRK,brenda,Q7YQR7,C[N+](C)(C)C[C@H](O)CC(=O)O,0.56,37.0,7.816666666666666,2.3.1.21,9940.0,-0.2518119729937995,-0.1784711581242735,C[N+](C)(C)C[C@H](O)CC(=O)O__MAEAHQAVAFQFTVTPDGIDLRMSHEALRQIYLSGLHSWKKKFIRFKNGIITGVYPASPSSWLIVVVGVMSTMYAKIDPSLGIIAKINRTLDTTGCMSSQTKKVVSGVIFGTGLWAALIVTMRYSLKVLLSYHGWMFTQHGSLSRTTKIWMFMVKIFSGRKPMLYSFQTSLPRLPVPAVQDTVNRYLESVKPLMKEGDFTRMTALAQDFAVNLGPRLQWYLKLKSWWATNYVSDWWEEYIYLRGRGPLMVNSNYFAMDLLYIKPTHIQAARAGNGIHAILLYRRKLDREEIKPILLLGSTIPLCSAQWERMFNTSRIPGEETDTIQHLRDSKHIVVFHRGRYFKVWLYHDGRLLRPREIEQQVQRILEDPSEPQPGEAKLAALTAADRVPWARCRQAYFGHGKNKQSLDAIEKAAFFVTLDETEQGYREEDPETSMDSYAKSLLHGRCFDRWFDKSFTFIIFKNGKIGINAEHSWADAPIMGHLWEYVMATDSFQLGYTEDGHCKGDTNPNIPYPTRLQWDIPEECQEVIETSLSSANLLANDVDFHSFPFRTFGKGLIKKCKTSPDAFVQLSLQLAHYKDMGKFSLTYEASMTRLFREGRTETVRSCTTESCNFVLAMMDPTQTAEQKLKLFKIASEKHQLLYRLAMTGAGIDRHLFCLYVVSKYLAVDSPFLKEVLSEPWRLSTSQTPPQQVELFNLDRNPDYVSSGGGFGPVADDGYGVSYILVGEDLINFHISSKFSCPETDSHRFGKNLREAMTDIISLFGFSPNSRK,./data/raw/alphafold//AF-Q7YQR7-F1-model_v4.pdb,5469,4072,5477,4506 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+1767,35249,35868,MERLTSPPRLMIVSDLDHTMVDHHDPENLSLLRFNSLWEHAYRHDSLLVFSTGRSPTLYKELRKEKPLLTPDITIMSVGTEITYGNSMVPDHGWVEALNNKWDLGIVKQEASNFPELKLQAETEQRPHKVSFYVEKSKAQEVTKELSQRFLKRGLDVKIIYSGGMDLDILPQGAGKGQALAYLLKKLKTEGKLPVNTLACGDSGNDAELFSIPDVYGVMVSNAQEELLKWHAENAKDNPKVIHAKERCAGGIIQAIGHFKLGPNLSPRDVSDFLEIKVENVNPGHEVVKFFLFYERWRRGEVENSEAYTASLKASVHPGGVFVHPSGTEKSLRDTIDELRKYHGDKQGKKFRVWADQVLATDTTPGTWIVKLDKWEQDGDERRCCTTTVKFTSKEGEGLVWEHVQQTWSKETMVKDDSSWII,brenda,Q9SJ66,O=P(O)(O)OC[C@H]1O[C@H](O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,0.73,37.0,7.0,3.1.3.24,3702.0,-0.1366771398795441,-0.1366771398795441,O=P(O)(O)OC[C@H]1O[C@H](O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O__MERLTSPPRLMIVSDLDHTMVDHHDPENLSLLRFNSLWEHAYRHDSLLVFSTGRSPTLYKELRKEKPLLTPDITIMSVGTEITYGNSMVPDHGWVEALNNKWDLGIVKQEASNFPELKLQAETEQRPHKVSFYVEKSKAQEVTKELSQRFLKRGLDVKIIYSGGMDLDILPQGAGKGQALAYLLKKLKTEGKLPVNTLACGDSGNDAELFSIPDVYGVMVSNAQEELLKWHAENAKDNPKVIHAKERCAGGIIQAIGHFKLGPNLSPRDVSDFLEIKVENVNPGHEVVKFFLFYERWRRGEVENSEAYTASLKASVHPGGVFVHPSGTEKSLRDTIDELRKYHGDKQGKKFRVWADQVLATDTTPGTWIVKLDKWEQDGDERRCCTTTVKFTSKEGEGLVWEHVQQTWSKETMVKDDSSWII,./data/raw/alphafold//AF-Q9SJ66-F1-model_v4.pdb,2278,7811,9614,10757 +1768,33846,34445,MSSKLHCVKLNDGHFIPALGFGTYKPKEVPKSKSLEAAHLAIDVGYRHIDTASAYQVEEEIGQAIQSKIKAGVVKREDMFITTKLWCSCFRTEMVRPALEKSLKNLQLDYVDLFLIHYPVPIKSSVDESPLDEKGKFLLDTVDFCDTWEMLEKCKDAGLVKSIGVSNFNHKQLERLLNKPGLKYKPVCNQVECHLYLNQSKLLDYCKSKDIVLVAYGALGTQRYKEWVDQNSPVLLDDPILCDVAKKNKRSPALIALRYLFQRGVVPLAQSFKENEMRENLQVFEFQLSPEDMKTLDGLNKNFRYLSAEFLADHPEYPFSEEY,sabio,Q2MHD9,O=Cc1ccc(Cl)cc1,0.107,30.0,6.0,1.1.1.51,10116.0,-0.9706162223147904,-1.1007210649416803,O=Cc1ccc(Cl)cc1__MSSKLHCVKLNDGHFIPALGFGTYKPKEVPKSKSLEAAHLAIDVGYRHIDTASAYQVEEEIGQAIQSKIKAGVVKREDMFITTKLWCSCFRTEMVRPALEKSLKNLQLDYVDLFLIHYPVPIKSSVDESPLDEKGKFLLDTVDFCDTWEMLEKCKDAGLVKSIGVSNFNHKQLERLLNKPGLKYKPVCNQVECHLYLNQSKLLDYCKSKDIVLVAYGALGTQRYKEWVDQNSPVLLDDPILCDVAKKNKRSPALIALRYLFQRGVVPLAQSFKENEMRENLQVFEFQLSPEDMKTLDGLNKNFRYLSAEFLADHPEYPFSEEY,./data/raw/alphafold//AF-Q2MHD9-F1-model_v4.pdb,2022,202,2530,464 +1769,30514,31053,MHRASHHELRAMFRALLDSSRCYHTASVFDPMSARIAADLGFECGILGGSVASLQVLAAPDFALITLSEFVEQATRIGRVARLPVIADADHGYGNALNVMRTVVELERAGIAALTIEDTLLPAQFGRKSTDLICVEEGVGKIRAALEARVDPALTIIARTNAELIDVDAVIQRTLAYQEAGADGICLVGVRDFAHLEAIAEHLHIPLMLVTYGNPQLRDDARLARLGVRVVVNGHAAYFAAIKATYDCLREERGAVASDLTASELSKKYTFPEEYQAWARDYMEVKE,brenda,Q9HUU1,O=C(O)CC(=O)C(=O)O,2.2,25.0,7.5,4.1.1.112,287.0,0.3424226808222063,0.3424226808222063,O=C(O)CC(=O)C(=O)O__MHRASHHELRAMFRALLDSSRCYHTASVFDPMSARIAADLGFECGILGGSVASLQVLAAPDFALITLSEFVEQATRIGRVARLPVIADADHGYGNALNVMRTVVELERAGIAALTIEDTLLPAQFGRKSTDLICVEEGVGKIRAALEARVDPALTIIARTNAELIDVDAVIQRTLAYQEAGADGICLVGVRDFAHLEAIAEHLHIPLMLVTYGNPQLRDDARLARLGVRVVVNGHAAYFAAIKATYDCLREERGAVASDLTASELSKKYTFPEEYQAWARDYMEVKE,./data/raw/alphafold//AF-Q9HUU1-F1-model_v4.pdb,567,3861,5227,5552 +1770,2661,2709,MSVVSAVSFMRPLHMRSPGPRGRRHTLPASEFRSLSPEDAISVFEIEREAFISVSGECPLHLDEVRHFLTLCPELSLGWFEEGRLVAFIIGSLWDQERLTTDALTLHKPHGTTVHIHVLAVHRTFRQQGKGSILMWRYLQYLRCLPYIRRAVLMCEDFLVPFYQKSGFKVQGPSDITVGPLTFIEMLYPVRGHAFMRRNSGC,brenda,Q68SL7,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.62,36.0,6.8,2.3.1.87,8175.0,-0.2076083105017461,-0.2076083105017461,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MSVVSAVSFMRPLHMRSPGPRGRRHTLPASEFRSLSPEDAISVFEIEREAFISVSGECPLHLDEVRHFLTLCPELSLGWFEEGRLVAFIIGSLWDQERLTTDALTLHKPHGTTVHIHVLAVHRTFRQQGKGSILMWRYLQYLRCLPYIRRAVLMCEDFLVPFYQKSGFKVQGPSDITVGPLTFIEMLYPVRGHAFMRRNSGC,./data/raw/alphafold//AF-Q68SL7-F1-model_v4.pdb,3696,1363,2113,2017 +1771,21647,21983,MTTSPTAPVALVTGAAKRLGSSIAEALHAEGYTVCLHYHRSAADASTLAATLNARRPNSAITVQADLSNVATASFSETDGSVPVTLFSRCSALVDACYMHWGRCDVLVNNASSFYPTPLLRKDAGEGGSSVGDKESLEVAAADLFGSNAIAPYFLIKAFAQRVADTRAEQRGTSYSIVNMVDAMTSQPLLGYTMYTMAKEALEGLTRSAALELASLQIRVNGVSPGLSVLPDDMPFSVQEDYRRKVPLYQRNSSAEEVSDVVIFLCSPKAKYITGTCIKVDGGYSLTRA,uniprot_search,P42556,N=c1nc(O)c2c([nH]1)NCC(CNc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1)=N2,0.0067,,6.0,1.5.1.33,5689.0,-2.1739251972991736,-2.1739251972991736,N=c1nc(O)c2c([nH]1)NCC(CNc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1)=N2__MTTSPTAPVALVTGAAKRLGSSIAEALHAEGYTVCLHYHRSAADASTLAATLNARRPNSAITVQADLSNVATASFSETDGSVPVTLFSRCSALVDACYMHWGRCDVLVNNASSFYPTPLLRKDAGEGGSSVGDKESLEVAAADLFGSNAIAPYFLIKAFAQRVADTRAEQRGTSYSIVNMVDAMTSQPLLGYTMYTMAKEALEGLTRSAALELASLQIRVNGVSPGLSVLPDDMPFSVQEDYRRKVPLYQRNSSAEEVSDVVIFLCSPKAKYITGTCIKVDGGYSLTRA,./data/raw/alphafold//AF-P42556-F1-model_v4.pdb,5809,2628,3281,3778 +1772,39875,40590,MIEVEERNGIYRIRVNNPIPPVEFNFQGERVDKIPEGLKIIEGENSVVVEKKLELEEHIVGLGEKATELDRKRFRYVMYNVDAGAYKRFQDPLYANIPFFISIYKGKATGYFVNSASKVIIDVGFTHYSKVIITIPHKDVEIYVFEGPTPEKVIEKYTDVTGKPYLPPKWAFGYLISRFSYFPQDEIVKLLDLMKEFKVTGIFLDIDYMDSYKLFTWDKEKFPDVKKFIEEVHGRGVKIITIVDHSIKADQNYDVFLSGLGKYCETDKGELFVGKLWPGNSVYPDFFREETRKWWSELISKWLSQGIDGIWLDMNEPTDFSQYKEGGDRLLLAFPKNVIHYHKGKKVYHELVRNAYPYYEAMATYEGFKNKEEVFILTRGGYAGIQKFAGIWTGDNTPSWDDLKLQLQLILGLSISGIAYIGIDIGGFQGRGFEKIDNSLELLVKYFEIAMFFPMFRTHKGKDGIDTEPTFLPDYYKERVKRVIETRYNFLSYIYSLAIEAHETGHPIIRPLFYEFPDDENTYRIDDEYLVGKHVLYAPIIEKSDKRIVYLPRKSKWMEFWNQEISEGWVNSKSNLPIYIREGSLIQLDDGDIVSFGDGEIKGKAARKEKKITFNSPTYVRNIISEFGIVKVDKVITQISL,brenda,F9VPH0,OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O[C@H]4[C@H](O)[C@@H](O)[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O,2.33,80.0,4.0,3.2.1.20,111955.0,0.367355921026019,0.367355921026019,OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O[C@H]4[C@H](O)[C@@H](O)[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O__MIEVEERNGIYRIRVNNPIPPVEFNFQGERVDKIPEGLKIIEGENSVVVEKKLELEEHIVGLGEKATELDRKRFRYVMYNVDAGAYKRFQDPLYANIPFFISIYKGKATGYFVNSASKVIIDVGFTHYSKVIITIPHKDVEIYVFEGPTPEKVIEKYTDVTGKPYLPPKWAFGYLISRFSYFPQDEIVKLLDLMKEFKVTGIFLDIDYMDSYKLFTWDKEKFPDVKKFIEEVHGRGVKIITIVDHSIKADQNYDVFLSGLGKYCETDKGELFVGKLWPGNSVYPDFFREETRKWWSELISKWLSQGIDGIWLDMNEPTDFSQYKEGGDRLLLAFPKNVIHYHKGKKVYHELVRNAYPYYEAMATYEGFKNKEEVFILTRGGYAGIQKFAGIWTGDNTPSWDDLKLQLQLILGLSISGIAYIGIDIGGFQGRGFEKIDNSLELLVKYFEIAMFFPMFRTHKGKDGIDTEPTFLPDYYKERVKRVIETRYNFLSYIYSLAIEAHETGHPIIRPLFYEFPDDENTYRIDDEYLVGKHVLYAPIIEKSDKRIVYLPRKSKWMEFWNQEISEGWVNSKSNLPIYIREGSLIQLDDGDIVSFGDGEIKGKAARKEKKITFNSPTYVRNIISEFGIVKVDKVITQISL,./data/raw/alphafold//AF-F9VPH0-F1-model_v4.pdb,2488,8111,9982,11165 +1773,12013,12179,MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,uniprot_search,P23946,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)CC(=O)O)C(C)C)C(O)=N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](Cc1cnc[nH]1)C(O)=N[C@@H](CC(C)C)C(=O)O,0.06,45.66666666666666,8.375,3.4.21.39,9606.0,-1.2218487496163564,-1.2218487496163564,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)CC(=O)O)C(C)C)C(O)=N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](Cc1cnc[nH]1)C(O)=N[C@@H](CC(C)C)C(=O)O__MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,./data/raw/alphafold//AF-P23946-F1-model_v4.pdb,5183,2024,1510,3023 +1774,20682,20993,MISVKILIYGVGNMGKLFRDIFYGKGYYVRGYDIDQMKRDTNSISGFDVIFVCTPMYALEEALEHIKREAKKEALLVDVSSVKKVSVPLFEESGFDFLSIHPMLGGDSEISLSNVIVVRESGREEEKVILEELRKCGAVLSRLDVEEHDRKMAEIQGIAHFALVSMADFLRYGKEELKYASPIFTVLYKLASRIINQNWEMYFQIQKNAEDVREEYLRRAMELHEKMKDRESFREIFESLRKIYTDYESSTIILESYKATKKAESIEELRGLIKSIDSLILRLIERRIDAARQIARIKMERGEPIELKDVEEEKLWEVMSKTTLNPVKLKEIFEGIMSLAKEEEYKVAGVKYTIAVLGPQGSFSEEMALKLVGSRVPLRYCSTTDEIIKLVESGEVDYGLVPIENSVNGTVLPVIDALLNHDVEVFGEAKLEVNHCLVAKRKIELKEIKTIYSHPQAVAQCMGFINNYLPSVAIRYTTSTSDAARMLDDYSAAIMSENAARFYRLHVLRKGIQDLKGRNITRFYLIRRRSGRSEGKITSLFFGVEDKPGALKDVLEVFHKKGFNLRKLESRPAGTGLGDYVFFVEVEAPLREEDLLDLKQVTTFYKVVGVFDEVKRMSTL,brenda,O30012,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.047,87.0,6.5,1.3.1.12,2234.0,-1.3279021420642825,-1.3279021420642825,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MISVKILIYGVGNMGKLFRDIFYGKGYYVRGYDIDQMKRDTNSISGFDVIFVCTPMYALEEALEHIKREAKKEALLVDVSSVKKVSVPLFEESGFDFLSIHPMLGGDSEISLSNVIVVRESGREEEKVILEELRKCGAVLSRLDVEEHDRKMAEIQGIAHFALVSMADFLRYGKEELKYASPIFTVLYKLASRIINQNWEMYFQIQKNAEDVREEYLRRAMELHEKMKDRESFREIFESLRKIYTDYESSTIILESYKATKKAESIEELRGLIKSIDSLILRLIERRIDAARQIARIKMERGEPIELKDVEEEKLWEVMSKTTLNPVKLKEIFEGIMSLAKEEEYKVAGVKYTIAVLGPQGSFSEEMALKLVGSRVPLRYCSTTDEIIKLVESGEVDYGLVPIENSVNGTVLPVIDALLNHDVEVFGEAKLEVNHCLVAKRKIELKEIKTIYSHPQAVAQCMGFINNYLPSVAIRYTTSTSDAARMLDDYSAAIMSENAARFYRLHVLRKGIQDLKGRNITRFYLIRRRSGRSEGKITSLFFGVEDKPGALKDVLEVFHKKGFNLRKLESRPAGTGLGDYVFFVEVEAPLREEDLLDLKQVTTFYKVVGVFDEVKRMSTL,./data/raw/alphafold//AF-O30012-F1-model_v4.pdb,4281,5220,7148,7177 +1775,20404,20712,MIRMRTPSTLPFTKMHGAGNDFVVLDLRDGPDPSPELCRALADRHKGVGCDLVLGIREPRSARAVAAFDIWTADGSRSAQCGNGARCVAAWAVRAGLARGPRFALDSPSGTHEVDVLDADTFRVALAVPRFAPESIPLFGHDGEQDLYEADLGDGTRVRFAAVSMGNPHAVIEVDDTATAPVARVGRAVQASGLFLPTVNVGFARVESRDRVHLRVHEYGAGETLACGSGACAAAAVLMRRGRVDRNVSVVLPGGELRISWPDDAADVLMTGPAAFVYEGTFLHASV,brenda,D2Z026,N=C(O)NOC[C@@H](N)C(=O)O,17.0,30.0,7.9,5.1.1.19,58340.0,1.230448921378274,1.230448921378274,N=C(O)NOC[C@@H](N)C(=O)O__MIRMRTPSTLPFTKMHGAGNDFVVLDLRDGPDPSPELCRALADRHKGVGCDLVLGIREPRSARAVAAFDIWTADGSRSAQCGNGARCVAAWAVRAGLARGPRFALDSPSGTHEVDVLDADTFRVALAVPRFAPESIPLFGHDGEQDLYEADLGDGTRVRFAAVSMGNPHAVIEVDDTATAPVARVGRAVQASGLFLPTVNVGFARVESRDRVHLRVHEYGAGETLACGSGACAAAAVLMRRGRVDRNVSVVLPGGELRISWPDDAADVLMTGPAAFVYEGTFLHASV,./data/raw/alphafold//AF-D2Z026-F1-model_v4.pdb,4697,5126,7033,7040 +1776,26226,26671,MDTVCIAVVGAGVIGLSTAACISQLVPGCTVTVISDRFTPDTTSNVAAGMLIPHTYADTPVPTQKRWFRETFEHLSEIAKSAEAADAGVHLVSGWQIFHSVPAEEVPFWADVVLGFRKMTEAELKRFPQYVFGQAFTTLKCETSAYLPWLERRIKGSGGLLLTWRIEDLWELQPSFDIVVNCSGLGSRRLVGDPMISPVRGQVLQARAPWVKHFIRDGGGLTYVYPGMSYVTLGGTRQKGDWNRSPDAELSREIFSRCCTLEPSLHRAYDIKEKVGLRPSRPGVRLQKEILVRGQQTLPVVHNYGHGSGGISVHWGSALEATRLVMECIHTLRTPASLSKL,brenda,Q0E9Q7,N[C@H](Cc1cnc[nH]1)C(=O)O,8.8,25.0,8.3,1.4.3.1,10090.0,0.9444826721501688,0.9444826721501688,N[C@H](Cc1cnc[nH]1)C(=O)O__MDTVCIAVVGAGVIGLSTAACISQLVPGCTVTVISDRFTPDTTSNVAAGMLIPHTYADTPVPTQKRWFRETFEHLSEIAKSAEAADAGVHLVSGWQIFHSVPAEEVPFWADVVLGFRKMTEAELKRFPQYVFGQAFTTLKCETSAYLPWLERRIKGSGGLLLTWRIEDLWELQPSFDIVVNCSGLGSRRLVGDPMISPVRGQVLQARAPWVKHFIRDGGGLTYVYPGMSYVTLGGTRQKGDWNRSPDAELSREIFSRCCTLEPSLHRAYDIKEKVGLRPSRPGVRLQKEILVRGQQTLPVVHNYGHGSGGISVHWGSALEATRLVMECIHTLRTPASLSKL,./data/raw/alphafold//AF-Q0E9Q7-F1-model_v4.pdb,2126,5644,4637,4912 +1777,10132,10286,MGLLAFLKTQFVLHLLVGFVFVVSGLVINFVQLCTLALWPVSKQLYRRLNCRLAYSLWSQLVMLLEWWSCTECTLFTDQATVERFGKEHAVIILNHNFEIDFLCGWTMCERFGVLGSSKVLAKKELLYVPLIGWTWYFLEIVFCKRKWEEDRDTVVEGLRRLSDYPEYMWFLLYCEGTRFTETKHRVSMEVAAAKGLPVLKYHLLPRTKGFTTAVKCLRGTVAAVYDVTLNFRGNKNPSLLGILYGKKYEADMCVRRFPLEDIPLDEKEAAQWLHKLYQEKDALQEIYNQKGMFPGEQFKPARRPWTLLNFLSWATILLSPLFSFVLGVFASGSPLLILTFLGFVGAASFGVRRLIGVTEIEKGSSYGNQEFKKKE,brenda,Q9NRZ7,CCCCCCCC/C=C\CCCCCCCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.0215,30.0,7.4,2.3.1.51,9606.0,-1.6675615400843946,-1.6675615400843946,CCCCCCCC/C=C\CCCCCCCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MGLLAFLKTQFVLHLLVGFVFVVSGLVINFVQLCTLALWPVSKQLYRRLNCRLAYSLWSQLVMLLEWWSCTECTLFTDQATVERFGKEHAVIILNHNFEIDFLCGWTMCERFGVLGSSKVLAKKELLYVPLIGWTWYFLEIVFCKRKWEEDRDTVVEGLRRLSDYPEYMWFLLYCEGTRFTETKHRVSMEVAAAKGLPVLKYHLLPRTKGFTTAVKCLRGTVAAVYDVTLNFRGNKNPSLLGILYGKKYEADMCVRRFPLEDIPLDEKEAAQWLHKLYQEKDALQEIYNQKGMFPGEQFKPARRPWTLLNFLSWATILLSPLFSFVLGVFASGSPLLILTFLGFVGAASFGVRRLIGVTEIEKGSSYGNQEFKKKE,./data/raw/alphafold//AF-Q9NRZ7-F1-model_v4.pdb,5518,3056,3782,4394 +1778,17535,17789,MAAGQPKAGGRALRAAQVDDVASASNFRAFELLHLHLDLRAEFGPPGPGPGSRGLSGSAVLDLRCRAPGGATELRLDSHPCVDVTAAALRRGRPEPGRPEPEPEPLPVCTQPFSHYGQALCLRFSQPCAAGECLQVRITYRVGEGPGVCWLAPEQTAGRKKPFVYTQGQAVLNRAFFPCFDTPAVKCRYSALLEVPDGFTAVMSADAGQERGPNKFFLRMSQPIPSYLIALAIGDLVSAEVGPRSRVWAEPCLIDAAKEEYDGVIEEFLATGEKLFGPYVWGRYDVLFMPPSFPFGGMENPCLTFVTPCLLAGDRSLADVIIHEIAHSWFGNLVTNANWGEFWLNEGFTMYAQRRISSVLFGPAYTCLEAATGRALLRQHMDVTGEDHPLNKLRVRIEPGVDPDDTYNETPYEKGFCFVSYLAHLVGDQGQFDDFLKAYVDEFKFQSILADDFLDFFLDSFPELKKQRVDSIPGLEFDRWLDTPGWPPYLPDLSPGDSLMRPAEELAQLWAAEELDPRAINAMPTSAWKTYQLVYFLDKILQKSPLPPGNVKKLGETYPKISNAQNAELRLRWGQIVLKNDHQEDFWKVKEFLHSQGKQKYTLPLYHAMMAGSKAAQTLAKETFAATAPQLHSNVVHYVQQIVEPLGR,brenda,A2T1U6,Cc1cc(=O)oc2cc(N=C(O)[C@H](N)CCCNC(=N)N)ccc12,0.091,34.0,7.5,3.4.11.6,9913.0,-1.0409586076789064,-1.0409586076789064,Cc1cc(=O)oc2cc(N=C(O)[C@H](N)CCCNC(=N)N)ccc12__MAAGQPKAGGRALRAAQVDDVASASNFRAFELLHLHLDLRAEFGPPGPGPGSRGLSGSAVLDLRCRAPGGATELRLDSHPCVDVTAAALRRGRPEPGRPEPEPEPLPVCTQPFSHYGQALCLRFSQPCAAGECLQVRITYRVGEGPGVCWLAPEQTAGRKKPFVYTQGQAVLNRAFFPCFDTPAVKCRYSALLEVPDGFTAVMSADAGQERGPNKFFLRMSQPIPSYLIALAIGDLVSAEVGPRSRVWAEPCLIDAAKEEYDGVIEEFLATGEKLFGPYVWGRYDVLFMPPSFPFGGMENPCLTFVTPCLLAGDRSLADVIIHEIAHSWFGNLVTNANWGEFWLNEGFTMYAQRRISSVLFGPAYTCLEAATGRALLRQHMDVTGEDHPLNKLRVRIEPGVDPDDTYNETPYEKGFCFVSYLAHLVGDQGQFDDFLKAYVDEFKFQSILADDFLDFFLDSFPELKKQRVDSIPGLEFDRWLDTPGWPPYLPDLSPGDSLMRPAEELAQLWAAEELDPRAINAMPTSAWKTYQLVYFLDKILQKSPLPPGNVKKLGETYPKISNAQNAELRLRWGQIVLKNDHQEDFWKVKEFLHSQGKQKYTLPLYHAMMAGSKAAQTLAKETFAATAPQLHSNVVHYVQQIVEPLGR,./data/raw/alphafold//AF-A2T1U6-F1-model_v4.pdb,843,4250,5687,6089 +1779,26963,27426,MENGNKALSIEQMYQKKSQLEHILLRPDSYIGSVEFTKELMWVYDNSQNRMVQKEISFVPGLYKIFDEILVNAADNKQRDKSMNTIKIDIDPERNMVSVWNNGQGIPVTMHKEQKMYVPTMIFGHLLTSSNYNDDEKKVTGGRNGYGAKLCNIFSTSFTVETATREYKKSFKQTWGNNMGKASDVQIKDFNGTDYTRITFSPDLAKFKMDRLDEDIVALMSRRAYDVAASSKGVSVFLNGNKLGVRNFKDYIDLHIKNTDDDSGPPIKIVHEVANERWEVACCPSDRGFQQVSFVNSIATYKGGRHVDHVVDNLIKQLLEVLKKKNKGGINIKPFQVRNHLWVFVNCLIENPTFDSQTKENMTLQQKGFGSKCTLSEKFINNMSKSGIVESVLAWAKFKAQNDIAKTGGRKSSKIKGIPKLEDANEAGGKNSIKCTLILTEGDSAKSLAVSGLGVIGRDLYGVFPLRGKLLNVREANFKQLSENAEINNLCKIIGLQYKKKYLTEDDLKTLRYGKVMIMTDQDQDGSHIKGLLINFIHTNWPELLRLPFLEEFITPIVKATKKNEELSFYSLPEFEEWKNDTANHHTYNIKYYKGLGTSTSKEAKEYFQDMDRHRILFKYDGSVDDESIVMAFSKKHIESRKVWLTNHMDEVKRRKELGLPERYLYTKGTKSITYADFINLELVLFSNADNERSIPSLVDGLKPGQRKVMFTCFKRNDKREVKVAQLSGSVAEMSAYHHGEVSLQMTIVNLAQNFVGANNINLLEPRGQFGTRLSGGKDCASARYIFTIMSPLTRLIYHPLDDPLLDYQVDDGQKIEPLWYLPIIPMVLVNGAEGIGTGWSTKISNYNPREIMKNLRKMINGQEPSVMHPWYKNFLGRMEYVSDGRYIQTGNIQILSGNRLEISELPVGVWTQNYKENVLEPLSNGTEKVKGIISEYREYHTDTTVRFVISFAPGEFERIHAEEGGFYRVFKLTTTLSTNQMHAFDQNNCLRRFPTAIDILKEYYKLRREYYARRRDFLVGQLTAQADRLSDQARFILEKCEKKLVVENKQRKAMCDELLKRGYRPDPVKEWQRRIKMEDAEQADEEDEEEEEAAPSVSSKAKKEKEVDPEKAFKKLTDVKKFDYLLGMSMWMLTEEKKNELLKQRDTKLSELESLRKKTPEMLWLDDLDALESKLNEVEEKERAEEQGINLKTAKALKGQKSASAKGRKVKSMGGGAGAGDVFPDPDGEPVEFKITEEIIKKMAAAAKVAQAAKEPKKPKEPKEPKVKKEPKGKQIKAEPDASGDEVDEFDAMVEGGSKTSPKAKKAVVKKEPGEKKPRQKKENGGGLKQSKIDFSKAKAKKSDDDVEEVTPRAERPGRRQASKKIDYSSLFSDEEEDGGNVGSDDDGNASDDDSPKRPAKRGREDESSGGAKKKAPPKKRRAVIESDDDDIEIDEDDDDDSDFNC,sabio,P15348,Nc1ncnc2c1ncn2C1CC(O)C(COP(=O)(O)OP(=O)(O)O)O1,0.63,30.0,7.9,5.6.2.2,7227.0,-0.2006594505464183,-0.2006594505464183,Nc1ncnc2c1ncn2C1CC(O)C(COP(=O)(O)OP(=O)(O)O)O1__MENGNKALSIEQMYQKKSQLEHILLRPDSYIGSVEFTKELMWVYDNSQNRMVQKEISFVPGLYKIFDEILVNAADNKQRDKSMNTIKIDIDPERNMVSVWNNGQGIPVTMHKEQKMYVPTMIFGHLLTSSNYNDDEKKVTGGRNGYGAKLCNIFSTSFTVETATREYKKSFKQTWGNNMGKASDVQIKDFNGTDYTRITFSPDLAKFKMDRLDEDIVALMSRRAYDVAASSKGVSVFLNGNKLGVRNFKDYIDLHIKNTDDDSGPPIKIVHEVANERWEVACCPSDRGFQQVSFVNSIATYKGGRHVDHVVDNLIKQLLEVLKKKNKGGINIKPFQVRNHLWVFVNCLIENPTFDSQTKENMTLQQKGFGSKCTLSEKFINNMSKSGIVESVLAWAKFKAQNDIAKTGGRKSSKIKGIPKLEDANEAGGKNSIKCTLILTEGDSAKSLAVSGLGVIGRDLYGVFPLRGKLLNVREANFKQLSENAEINNLCKIIGLQYKKKYLTEDDLKTLRYGKVMIMTDQDQDGSHIKGLLINFIHTNWPELLRLPFLEEFITPIVKATKKNEELSFYSLPEFEEWKNDTANHHTYNIKYYKGLGTSTSKEAKEYFQDMDRHRILFKYDGSVDDESIVMAFSKKHIESRKVWLTNHMDEVKRRKELGLPERYLYTKGTKSITYADFINLELVLFSNADNERSIPSLVDGLKPGQRKVMFTCFKRNDKREVKVAQLSGSVAEMSAYHHGEVSLQMTIVNLAQNFVGANNINLLEPRGQFGTRLSGGKDCASARYIFTIMSPLTRLIYHPLDDPLLDYQVDDGQKIEPLWYLPIIPMVLVNGAEGIGTGWSTKISNYNPREIMKNLRKMINGQEPSVMHPWYKNFLGRMEYVSDGRYIQTGNIQILSGNRLEISELPVGVWTQNYKENVLEPLSNGTEKVKGIISEYREYHTDTTVRFVISFAPGEFERIHAEEGGFYRVFKLTTTLSTNQMHAFDQNNCLRRFPTAIDILKEYYKLRREYYARRRDFLVGQLTAQADRLSDQARFILEKCEKKLVVENKQRKAMCDELLKRGYRPDPVKEWQRRIKMEDAEQADEEDEEEEEAAPSVSSKAKKEKEVDPEKAFKKLTDVKKFDYLLGMSMWMLTEEKKNELLKQRDTKLSELESLRKKTPEMLWLDDLDALESKLNEVEEKERAEEQGINLKTAKALKGQKSASAKGRKVKSMGGGAGAGDVFPDPDGEPVEFKITEEIIKKMAAAAKVAQAAKEPKKPKEPKEPKVKKEPKGKQIKAEPDASGDEVDEFDAMVEGGSKTSPKAKKAVVKKEPGEKKPRQKKENGGGLKQSKIDFSKAKAKKSDDDVEEVTPRAERPGRRQASKKIDYSSLFSDEEEDGGNVGSDDDGNASDDDSPKRPAKRGREDESSGGAKKKAPPKKRRAVIESDDDDIEIDEDDDDDSDFNC,./data/raw/alphafold//AF-P15348-F1-model_v4.pdb,1269,6481,8353,10367 +1780,24050,24434,MATEQTAITRATFDEVILPVYAPADFIPVKGKGSRVWDQQGKEYIDFAGGIAVTALGHCHPALVEALKSQGETLWHTSNVFTNEPALRLGRKLIDATFAERVLFMNSGTEANETAFKLARHYACVRHSPFKTKIIAFHNAFHGRSLFTVSVGGQPKYSDGFGPKPADIIHVPFNDLHAVKAVMDDHTCAVVVEPIQGEGGVQAATPEFLKGLRDLCDEHQALLVFDEVQCGMGRTGDLFAYMHYGVTPDILTSAKALGGGFPVSAMLTTQEIASAFHVGSHGSTYGGNPLACAVAGAAFDIINTPEVLQGIHTKRQQFVQHLQAIDEQFDIFSDIRGMGLLIGAELKPKYKGRARDFLYAGAEAGVMVLNAGADVMRFAPSLVVEEADIHEGMQRFAQAVGKVVA,sabio,P40732,NCCCC(N)C(=O)O,0.64,25.0,9.5,2.6.1.11,90371.0,-0.1938200260161128,-0.1938200260161128,NCCCC(N)C(=O)O__MATEQTAITRATFDEVILPVYAPADFIPVKGKGSRVWDQQGKEYIDFAGGIAVTALGHCHPALVEALKSQGETLWHTSNVFTNEPALRLGRKLIDATFAERVLFMNSGTEANETAFKLARHYACVRHSPFKTKIIAFHNAFHGRSLFTVSVGGQPKYSDGFGPKPADIIHVPFNDLHAVKAVMDDHTCAVVVEPIQGEGGVQAATPEFLKGLRDLCDEHQALLVFDEVQCGMGRTGDLFAYMHYGVTPDILTSAKALGGGFPVSAMLTTQEIASAFHVGSHGSTYGGNPLACAVAGAAFDIINTPEVLQGIHTKRQQFVQHLQAIDEQFDIFSDIRGMGLLIGAELKPKYKGRARDFLYAGAEAGVMVLNAGADVMRFAPSLVVEEADIHEGMQRFAQAVGKVVA,./data/raw/alphafold//AF-P40732-F1-model_v4.pdb,5634,982,1179,1450 +1781,28503,29004,MSDEQITKKVREICEELILSQENLKEVCDVLHEELNKGLGKDTNPEATIKCFPTYVRELPNGKEKGRFLALDLGGTNFRVLLIQLGEKCSMDSRIYAVPQPIMVGPGDGLFDHIAECLASFIKERELGDELLPLGFTFSFPCKQEGLTKARLARWTKGFKCAGVEGRDVVELLKAAIARRGDVKIKICAILNDTTGTLMSCAWKNHNCRIGLIVGTVTNASYMEKLEKVELWDGDLDEPHQVIINTEWGAFGDNGCLDFIRTEYDNNIDCESINPGRQLYEKMISGMYMGEIARQVIIRLVAEGLLFNGNSSEILEEKGSFFTKYISEIESDKPGDYNNCRVILEELGLNSATDTDCANVRHVCECVSRRAAYLAAAGVAVLLSRIGEESVTVAVDGSVYRFHPHFHNLMTEQISHLIKPGMKFGLMLSEDGSGRGAALVAAVASRNSR,brenda,A0A220NLA7,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.88,30.0,8.0,2.7.1.1,159736.0,-0.0555173278498313,-0.0555173278498313,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MSDEQITKKVREICEELILSQENLKEVCDVLHEELNKGLGKDTNPEATIKCFPTYVRELPNGKEKGRFLALDLGGTNFRVLLIQLGEKCSMDSRIYAVPQPIMVGPGDGLFDHIAECLASFIKERELGDELLPLGFTFSFPCKQEGLTKARLARWTKGFKCAGVEGRDVVELLKAAIARRGDVKIKICAILNDTTGTLMSCAWKNHNCRIGLIVGTVTNASYMEKLEKVELWDGDLDEPHQVIINTEWGAFGDNGCLDFIRTEYDNNIDCESINPGRQLYEKMISGMYMGEIARQVIIRLVAEGLLFNGNSSEILEEKGSFFTKYISEIESDKPGDYNNCRVILEELGLNSATDTDCANVRHVCECVSRRAAYLAAAGVAVLLSRIGEESVTVAVDGSVYRFHPHFHNLMTEQISHLIKPGMKFGLMLSEDGSGRGAALVAAVASRNSR,./data/raw/alphafold//AF-A0A220NLA7-F1-model_v4.pdb,1380,6877,8720,8948 +1782,24215,24601,MAKFVIRPATAADCSDILRLIKELAKYEYMEEQVILTEKDLLEDGFGEHPFYHCLVAEVPKEHWTPEGHSIVGFAMYYFTYDPWIGKLLYLEDFFVMSDYRGFGIGSEILKNLSQVAMRCRCSSMHFLVAEWNEPSINFYKRRGASDLSSEEGWRLFKIDKEYLLKMATEE,brenda,P21673,NCCCCNCCCN,0.022,30.0,7.2,2.3.1.57,9606.0,-1.6575773191777938,-1.6575773191777938,NCCCCNCCCN__MAKFVIRPATAADCSDILRLIKELAKYEYMEEQVILTEKDLLEDGFGEHPFYHCLVAEVPKEHWTPEGHSIVGFAMYYFTYDPWIGKLLYLEDFFVMSDYRGFGIGSEILKNLSQVAMRCRCSSMHFLVAEWNEPSINFYKRRGASDLSSEEGWRLFKIDKEYLLKMATEE,./data/raw/alphafold//AF-P21673-F1-model_v4.pdb,3632,1273,7767,1897 +1783,33334,33927,MVKVGVNGFGRIGRLVTRAAFNSGKVDIVAINDPFIDLNYMVYMFKYDSTHGKFKVDIVAINDPFIDLNYMVYMFKYDSTHGKFKGTVKAENGKLVINGHAITIFQERDPSKIKWGDAGAEYVVESTGVFTTMEKAGAHLKGGAKRVIISAPSRDAPMFVMGVNHEKYDKSLKIVSNASCTTNCLAPLAKVIHDNFGIVEGLMTTVHAITATQKTVDGPSAKLWRDGAGAAQNIIPASTGAAKAVGKVIPELNGKLTGMAFRVPTANVSVVDLTCRLEKPAKYDDIKRVVKQACDGPLKGMLGYTEHQVVSSDFNGDSHSSTFDAGAGIALNDHFVKLVSWYDNEFGYSNRVVDLMVHMASKE,sabio,P80534,O=CC(O)COP(=O)(O)O,0.16,25.0,8.9,1.2.1.12,48868.0,-0.7958800173440752,-0.7323515327539478,O=CC(O)COP(=O)(O)O__MVKVGVNGFGRIGRLVTRAAFNSGKVDIVAINDPFIDLNYMVYMFKYDSTHGKFKVDIVAINDPFIDLNYMVYMFKYDSTHGKFKGTVKAENGKLVINGHAITIFQERDPSKIKWGDAGAEYVVESTGVFTTMEKAGAHLKGGAKRVIISAPSRDAPMFVMGVNHEKYDKSLKIVSNASCTTNCLAPLAKVIHDNFGIVEGLMTTVHAITATQKTVDGPSAKLWRDGAGAAQNIIPASTGAAKAVGKVIPELNGKLTGMAFRVPTANVSVVDLTCRLEKPAKYDDIKRVVKQACDGPLKGMLGYTEHQVVSSDFNGDSHSSTFDAGAGIALNDHFVKLVSWYDNEFGYSNRVVDLMVHMASKE,./data/raw/alphafold//AF-P80534-F1-model_v4.pdb,4331,5285,1723,8398 +1784,18393,18657,MQRRHFLQKTLLALPIIFSGNLLTGCKTNLSDDYLPDDKITNNPNLLQNKLKEILPIWENKFNAKIGMTIIADNGELSSHRGNEYFPVNSTIKAFIASHILLLVDKEKLDLNEKIIIKESDLIEYSPVCKKYFDENKPISISELCEATITLSDNGSANILLDKIGGLTAFNQFLKEIGADMVLANNEPLLNRSHYGETSDTAKPIPYTKSLKALIVGNILSNQSKEQLITWLINDKVADNLLRKYLPKNWRIGDKTGTGSESKNIIAVIWNENNKPYFISLFITQPHDGKSLDFKNQKDEIMAQIGKEIYPFL,sabio,Q59514,Cc1onc(-c2ccccc2Cl)c1C(O)=N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O,0.0014,30.0,7.0,3.5.2.6,480.0,-2.853871964321762,-2.853871964321762,Cc1onc(-c2ccccc2Cl)c1C(O)=N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O__MQRRHFLQKTLLALPIIFSGNLLTGCKTNLSDDYLPDDKITNNPNLLQNKLKEILPIWENKFNAKIGMTIIADNGELSSHRGNEYFPVNSTIKAFIASHILLLVDKEKLDLNEKIIIKESDLIEYSPVCKKYFDENKPISISELCEATITLSDNGSANILLDKIGGLTAFNQFLKEIGADMVLANNEPLLNRSHYGETSDTAKPIPYTKSLKALIVGNILSNQSKEQLITWLINDKVADNLLRKYLPKNWRIGDKTGTGSESKNIIAVIWNENNKPYFISLFITQPHDGKSLDFKNQKDEIMAQIGKEIYPFL,./data/raw/alphafold//AF-Q59514-F1-model_v4.pdb,3547,1144,1850,1695 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+1820,23727,24105,MIEDNKENKDHSLERGRATLIFSLKNEVGGLIKALKIFQEKHVNLLHIESRKSKRRNSEFEIFVDCDTNREQLNDIFHLLKSHTNVLSVTPPDNFTMKEEGMESVPWFPKKISDLDHCANRVLMYGSELDADHPGFKDNVYRKRRKYFADLAMSYKYGDPIPKVEFTEEEIKTWGTVFRELNKLYPTHACREYLKNLPLLSKYCGYREDNIPQLEDISNFLKERTGFSIRPVAGYLSPRDFLSGLAFRVFHCTQYVRHSSDPFYTPEPDTCHELLGHVPLLAEPSFAQFSQEIGLASLGASEEAVQKLATCYFFTVEFGLCKQDGQLRVFGAGLLSSISELKHVLSGHAKVKPFDPKITYKQECLITTFQDVYFVSESFEDAKEKMREFTKTIKRPFGVKYNPYTRSIQILKDAKSITNAMNELRHDLDVVSDALGKVSRQLSV,sabio,P17290,NC(Cc1ccccc1)C(=O)O,0.286,37.0,7.5,1.14.16.4,9986.0,-0.543633966870957,-0.543633966870957,NC(Cc1ccccc1)C(=O)O__MIEDNKENKDHSLERGRATLIFSLKNEVGGLIKALKIFQEKHVNLLHIESRKSKRRNSEFEIFVDCDTNREQLNDIFHLLKSHTNVLSVTPPDNFTMKEEGMESVPWFPKKISDLDHCANRVLMYGSELDADHPGFKDNVYRKRRKYFADLAMSYKYGDPIPKVEFTEEEIKTWGTVFRELNKLYPTHACREYLKNLPLLSKYCGYREDNIPQLEDISNFLKERTGFSIRPVAGYLSPRDFLSGLAFRVFHCTQYVRHSSDPFYTPEPDTCHELLGHVPLLAEPSFAQFSQEIGLASLGASEEAVQKLATCYFFTVEFGLCKQDGQLRVFGAGLLSSISELKHVLSGHAKVKPFDPKITYKQECLITTFQDVYFVSESFEDAKEKMREFTKTIKRPFGVKYNPYTRSIQILKDAKSITNAMNELRHDLDVVSDALGKVSRQLSV,./data/raw/alphafold//AF-P17290-F1-model_v4.pdb,5811,2808,7673,8646 +1821,7269,7400,MGVILRLRHSLRALAVGGLVLLTGAGALPAVAASDAARGERPSADGLSAVIRYTEYGVPHILADDYADLGFGDGWAQAADAVCTLADGFVTVRGERARYFGPDAAPDRSFSEASTNLSSDLFFRGVRDARTVEKLLDRPAPEGPSRQAKELMRGWAAGYNAWLRQHKVTDPACRGKGWVRPVTATDVARRGYALTVLGGQGALADAITEARPPAARTVGGGKAVADPAAAARAYFAARHDTGMGSNAVAFSGAATANRRGLLLGNPHYPWHGNRRFWQSQQTIPGELNVSGASLLGSPTVQIGHNASMAWSHTVATGVPMNLYELKPAPGDPRSYLVDGRPERMTERKVTVAVRGADGRLANVTRSQWWTRYGPVVTGLGDDLPLPWTPGSAYALADPNAAQFRFFDSSLGLSKARDVRGVREALRRTQGLPWVNTVAADSAGHSLYTQSQVLPRVTDEVQRSCATALGRRTYPESGLAVLDGSRGACALGRDRDALQPGVFGPSAMPTLVDAPYAENSNDSAWLANADRPLTGYPRIFGDIGTERSFRTRGGVEDVAAMAKRGRLTVADLERQQFAGRAPTGDLAAADAAAACAKLPGGRATGPDGRPVDVSGACGVLARWDRRLTTGSRGALLFDRFVRALVREVPADRLWRVPFDPAKPVTTPNTLNTAEPGVARALAAAVHDLRSAGIALDAPLGEHQFVVRKGKRIPVPGGTEALGAWNKVESRWDGSRGGYPEVSMGTSYVQAVGFDGGPCPVTARTLLTYSQSDDPASAHSSDQTELFSKGRMTRGRFCERDILASPGLRVVRVAQR,brenda,Q0R3W5,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O,12.0,37.0,6.25,3.5.1.11,35621.0,1.0791812460476249,1.0791812460476249,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O__MGVILRLRHSLRALAVGGLVLLTGAGALPAVAASDAARGERPSADGLSAVIRYTEYGVPHILADDYADLGFGDGWAQAADAVCTLADGFVTVRGERARYFGPDAAPDRSFSEASTNLSSDLFFRGVRDARTVEKLLDRPAPEGPSRQAKELMRGWAAGYNAWLRQHKVTDPACRGKGWVRPVTATDVARRGYALTVLGGQGALADAITEARPPAARTVGGGKAVADPAAAARAYFAARHDTGMGSNAVAFSGAATANRRGLLLGNPHYPWHGNRRFWQSQQTIPGELNVSGASLLGSPTVQIGHNASMAWSHTVATGVPMNLYELKPAPGDPRSYLVDGRPERMTERKVTVAVRGADGRLANVTRSQWWTRYGPVVTGLGDDLPLPWTPGSAYALADPNAAQFRFFDSSLGLSKARDVRGVREALRRTQGLPWVNTVAADSAGHSLYTQSQVLPRVTDEVQRSCATALGRRTYPESGLAVLDGSRGACALGRDRDALQPGVFGPSAMPTLVDAPYAENSNDSAWLANADRPLTGYPRIFGDIGTERSFRTRGGVEDVAAMAKRGRLTVADLERQQFAGRAPTGDLAAADAAAACAKLPGGRATGPDGRPVDVSGACGVLARWDRRLTTGSRGALLFDRFVRALVREVPADRLWRVPFDPAKPVTTPNTLNTAEPGVARALAAAVHDLRSAGIALDAPLGEHQFVVRKGKRIPVPGGTEALGAWNKVESRWDGSRGGYPEVSMGTSYVQAVGFDGGPCPVTARTLLTYSQSDDPASAHSSDQTELFSKGRMTRGRFCERDILASPGLRVVRVAQR,./data/raw/alphafold//AF-Q0R3W5-F1-model_v4.pdb,5830,2655,3357,3877 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+1825,27460,27936,MSDYKSTLNLPETGFPMRGDLAKREPGMLARWTDDDLYGIIRAAKKGKKTFILHDGPPYANGSIHIGHSVNKILKDIIVKSKGLSGYDSPYVPGWDCHGLPIELKVEQEYGKPGEKFTAAEFRAKCREYAATQVDGQRKDFIRLGVLGDWSHPYLTMDFKTEANIIRALGKIIGNGHLHKGAKPVHWCVDCRSALAEAEVEYYDKTSPSIDVAFQAVDQDALKAKFAVSNVNGPISLVIWTTTPWTLPANRAISIAPDFDYALVQIDGQAVILAKDLVESVMQRIGVTDYTILGTVKGAELELLRFTHPFMGFDVPAILGDHVTLDAGTGAVHTAPGHGPDDYVIGQKYGLETANPVGPDGTYLPGTYPTLDGVNVFKANDIVVALLQEKGALLHVEKMQHSYPCCWRHKTPIIFRATPQWFVSMDQKGLRAQSLKEIKGVQWIPDWGQARIESMVANRPDWCISRQRTWGVPMSLFVHKDTEELHPRTLELMEEVAKRVEVDGIQAWWDLDAKEILGDEADQYVKVPDTLDVWFDSGSTHSSVVDVRPEFAGHAADMYLEGSDQHRGWFMSSLMISTAMKGKAPYRQVLTHGFTVDGQGRKMSKSIGNTVSPQDVMNKLGADILRLWVASTDYTGEMAVSDEILKRAADSYRRIRNTARFLLANLNGFDPAKDMVKPEEMVVLDRWAVGCAKAAQEDILKAYEAYDFHEVVQRLMRFCSVEMGSFYLDIIKDRQYTAKADSVARRSCQTALYHIAEALVRWMAPILSFTADEVWGYLPGEREKYVFTGEWYEGLFGLADSEAMNDAFWDELLKVRGEVNKVIEQARADKKVGGSLEAAVTLYAEPELSAKLTALGDELRFVLLTSGATVADYNDAPADAQQSEVLKGLKVALSKAEGEKCPRCWHYTQDVGKVAEHAEICGRCVSNVAGDGEKRKFA,sabio,P00956,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,0.4,37.0,7.5,6.1.1.5,562.0,-0.3979400086720376,-0.3979400086720376,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MSDYKSTLNLPETGFPMRGDLAKREPGMLARWTDDDLYGIIRAAKKGKKTFILHDGPPYANGSIHIGHSVNKILKDIIVKSKGLSGYDSPYVPGWDCHGLPIELKVEQEYGKPGEKFTAAEFRAKCREYAATQVDGQRKDFIRLGVLGDWSHPYLTMDFKTEANIIRALGKIIGNGHLHKGAKPVHWCVDCRSALAEAEVEYYDKTSPSIDVAFQAVDQDALKAKFAVSNVNGPISLVIWTTTPWTLPANRAISIAPDFDYALVQIDGQAVILAKDLVESVMQRIGVTDYTILGTVKGAELELLRFTHPFMGFDVPAILGDHVTLDAGTGAVHTAPGHGPDDYVIGQKYGLETANPVGPDGTYLPGTYPTLDGVNVFKANDIVVALLQEKGALLHVEKMQHSYPCCWRHKTPIIFRATPQWFVSMDQKGLRAQSLKEIKGVQWIPDWGQARIESMVANRPDWCISRQRTWGVPMSLFVHKDTEELHPRTLELMEEVAKRVEVDGIQAWWDLDAKEILGDEADQYVKVPDTLDVWFDSGSTHSSVVDVRPEFAGHAADMYLEGSDQHRGWFMSSLMISTAMKGKAPYRQVLTHGFTVDGQGRKMSKSIGNTVSPQDVMNKLGADILRLWVASTDYTGEMAVSDEILKRAADSYRRIRNTARFLLANLNGFDPAKDMVKPEEMVVLDRWAVGCAKAAQEDILKAYEAYDFHEVVQRLMRFCSVEMGSFYLDIIKDRQYTAKADSVARRSCQTALYHIAEALVRWMAPILSFTADEVWGYLPGEREKYVFTGEWYEGLFGLADSEAMNDAFWDELLKVRGEVNKVIEQARADKKVGGSLEAAVTLYAEPELSAKLTALGDELRFVLLTSGATVADYNDAPADAQQSEVLKGLKVALSKAEGEKCPRCWHYTQDVGKVAEHAEICGRCVSNVAGDGEKRKFA,./data/raw/alphafold//AF-P00956-F1-model_v4.pdb,130,91,99,113 +1826,8064,8200,MAKAGENSRDKSRWSLEGMTALVTGGSKGLGEAVVEELAMLGARVHTCARDETQLQERLREWQAKGFEVTTSVCDVSSREQREKLMETVSSVFQGKLNILVNNAGTGIIKPSTEYTAEDYSFLMATNLESAFHLSQIAHPLLKASGSGSIVFMSSVAGLVHTGASIYGASKGAMNQLGRSLACEWASDNIRVNSVCPWVITTPLTSFIFSDEKLRKAVEDKTPMGRVGEANEVSSLVAFLCFPAASYITGQTICVDGGASVNGFSFKP,sabio,Q9ZW03,CC1CCC(O)CC1,0.3785,30.0,9.5,1.1.1.-,3702.0,-0.4219341161639084,-0.4219341161639084,CC1CCC(O)CC1__MAKAGENSRDKSRWSLEGMTALVTGGSKGLGEAVVEELAMLGARVHTCARDETQLQERLREWQAKGFEVTTSVCDVSSREQREKLMETVSSVFQGKLNILVNNAGTGIIKPSTEYTAEDYSFLMATNLESAFHLSQIAHPLLKASGSGSIVFMSSVAGLVHTGASIYGASKGAMNQLGRSLACEWASDNIRVNSVCPWVITTPLTSFIFSDEKLRKAVEDKTPMGRVGEANEVSSLVAFLCFPAASYITGQTICVDGGASVNGFSFKP,./data/raw/alphafold//AF-Q9ZW03-F1-model_v4.pdb,83,352,402,483 +1827,2686,2734,MVLLLCLSCLIFSCLTFSWLKIWGKMTDSKPITKSKSEANLIPSQEPFPASDNSGETPQRNGEGHTLPKTPSQAEPASHKGPKDAGRRRNSLPPSHQKPPRNPLSSSDAAPSPELQANGTGTQGLEATDTNGLSSSARPQGQQAGSPSKEDKKQANIKRQLMTNFILGSFDDYSSDEDSVAGSSRESTRKGSRASLGALSLEAYLTTGEAETRVPTMRPSMSGLHLVKRGREHKKLDLHRDFTVASPAEFVTRFGGDRVIEKVLIANNGIAAVKCMRSIRRWAYEMFRNERAIRFVVMVTPEDLKANAEYIKMADHYVPVPGGPNNNNYANVELIVDIAKRIPVQAVWAGWGHASENPKLPELLCKNGVAFLGPPSEAMWALGDKIASTVVAQTLQVPTLPWSGSGLTVEWTEDDLQQGKRISVPEDVYDKGCVKDVDEGLEAAERIGFPLMIKASEGGGGKGIRKAESAEDFPILFRQVQSEIPGSPIFLMKLAQHARHLEVQILADQYGNAVSLFGRDCSIQRRHQKIVEEAPATIAPLAIFEFMEQCAIRLAKTVGYVSAGTVEYLYSQDGSFHFLELNPRLQVEHPCTEMIADVNLPAAQLQIAMGVPLHRLKDIRLLYGESPWGVTPISFETPSNPPLARGHVIAARITSENPDEGFKPSSGTVQELNFRSSKNVWGYFSVAATGGLHEFADSQFGHCFSWGENREEAISNMVVALKELSIRGDFRTTVEYLINLLETESFQNNDIDTGWLDYLIAEKVQAEKPDIMLGVVCGALNVADAMFRTCMTDFLHSLERGQVLPADSLLNLVDVELIYGGVKYILKVARQSLTMFVLIMNGCHIEIDAHRLNDGGLLLSYNGNSYTTYMKEEVDSYRITIGNKTCVFEKENDPTVLRSPSAGKLTQYTVEDGGHVEAGSSYAEMEVMKMIMTLNVQERGRVKYIKRPGAVLEAGCVVARLELDDPSKVHPAEPFTGELPAQQTLPILGEKLHQVFHSVLENLTNVMSGFCLPEPVFSIKLKEWVQKLMMTLRHPSLPLLELQEIMTSVAGRIPAPVEKSVRRVMAQYASNITSVLCQFPSQQIATILDCHAATLQRKADREVFFINTQSIVQLVQRYRSGIRGYMKTVVLDLLRRYLRVEHHFQQAHYDKCVINLREQFKPDMSQVLDCIFSHAQVAKKNQLVIMLIDELCGPDPSLSDELISILNELTQLSKSEHCKVALRARQILIASHLPSYELRHNQVESIFLSAIDMYGHQFCPENLKKLILSETTIFDVLPTFFYHANKVVCMASLEVYVRRGYIAYELNSLQHRQLPDGTCVVEFQFMLPSSHPNRMTVPISITNPDLLRHSTELFMDSGFSPLCQRMGAMVAFRRFEDFTRNFDEVISCFANVPKDTPLFSEARTSLYSEDDCKSLREEPIHILNVSIQCADHLEDEALVPILRTFVQSKKNILVDYGLRRITFLIAQEKEFPKFFTFRARDEFAEDRIYRHLEPALAFQLELNRMRNFDLTAVPCANHKMHLYLGAAKVKEGVEVTDHRFFIRAIIRHSDLITKEASFEYLQNEGERLLLEAMDELEVAFNNTSVRTDCNHIFLNFVPTVIMDPFKIEESVRYMVMRYGSRLWKLRVLQAEVKINIRQTTTGSAVPIRLFITNESGYYLDISLYKEVTDSRSGNIMFHSFGNKQGPQHGMLINTPYVTKDLLQAKRFQAQTLGTTYIYDFPEMFRQALFKLWGSPDKYPKDILTYTELVLDSQGQLVEMNRLPGGNEVGMVAFKMRFKTQEYPEGRDVIVIGNDITFRIGSFGPGEDLLYLRASEMARAEGIPKIYVAANSGARIGMAEEIKHMFHVAWVDPEDPHKGFKYLYLTPQDYTRISSLNSVHCKHIEEGGESRYMITDIIGKDDGLGVENLRGSGMIAGESSLAYEEIVTISLVTCRAIGIGAYLVRLGQRVIQVENSHIILTGASALNKVLGREVYTSNNQLGGVQIMHYNGVSHITVPDDFEGVYTILEWLSYMPKDNHSPVPIITPTDPIDREIEFLPSRAPYDPRWMLAGRPHPTLKGTWQSGFFDHGSFKEIMAPWAQTVVTGRARLGGIPVGVIAVETRTVEVAVPADPANLDSEAKIIQQAGQVWFPDSAYKTAQAVKDFNREKLPLMIFANWRGFSGGMKDMYDQVLKFGAYIVDGLRQYKQPILIYIPPYAELRGGSWVVIDATINPLCIEMYADKESRGGVLEPEGTVEIKFRKKDLIKSMRRIDPAYKKLMEQLGEPDLSDKDRKDLEGRLKAREDLLLPIYHQVAVQFADFHDTPGRMLEKGVISDILEWKTARTFLYWRLRRLLLEDQVKQEILQASGELSHVHIQSMLRRWFVETEGAVKAYLWDNNQVVVQWLEQHWQAGDGPRSTIRENITYLKHDSVLKTIRGLVEENPEVAVDCVIYLSQHISPAERAQVVHLLSTMDSPAST,brenda,O00763,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.0002,25.0,7.5,6.4.1.2,9606.0,-3.6989700043360174,-2.467771005386541,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MVLLLCLSCLIFSCLTFSWLKIWGKMTDSKPITKSKSEANLIPSQEPFPASDNSGETPQRNGEGHTLPKTPSQAEPASHKGPKDAGRRRNSLPPSHQKPPRNPLSSSDAAPSPELQANGTGTQGLEATDTNGLSSSARPQGQQAGSPSKEDKKQANIKRQLMTNFILGSFDDYSSDEDSVAGSSRESTRKGSRASLGALSLEAYLTTGEAETRVPTMRPSMSGLHLVKRGREHKKLDLHRDFTVASPAEFVTRFGGDRVIEKVLIANNGIAAVKCMRSIRRWAYEMFRNERAIRFVVMVTPEDLKANAEYIKMADHYVPVPGGPNNNNYANVELIVDIAKRIPVQAVWAGWGHASENPKLPELLCKNGVAFLGPPSEAMWALGDKIASTVVAQTLQVPTLPWSGSGLTVEWTEDDLQQGKRISVPEDVYDKGCVKDVDEGLEAAERIGFPLMIKASEGGGGKGIRKAESAEDFPILFRQVQSEIPGSPIFLMKLAQHARHLEVQILADQYGNAVSLFGRDCSIQRRHQKIVEEAPATIAPLAIFEFMEQCAIRLAKTVGYVSAGTVEYLYSQDGSFHFLELNPRLQVEHPCTEMIADVNLPAAQLQIAMGVPLHRLKDIRLLYGESPWGVTPISFETPSNPPLARGHVIAARITSENPDEGFKPSSGTVQELNFRSSKNVWGYFSVAATGGLHEFADSQFGHCFSWGENREEAISNMVVALKELSIRGDFRTTVEYLINLLETESFQNNDIDTGWLDYLIAEKVQAEKPDIMLGVVCGALNVADAMFRTCMTDFLHSLERGQVLPADSLLNLVDVELIYGGVKYILKVARQSLTMFVLIMNGCHIEIDAHRLNDGGLLLSYNGNSYTTYMKEEVDSYRITIGNKTCVFEKENDPTVLRSPSAGKLTQYTVEDGGHVEAGSSYAEMEVMKMIMTLNVQERGRVKYIKRPGAVLEAGCVVARLELDDPSKVHPAEPFTGELPAQQTLPILGEKLHQVFHSVLENLTNVMSGFCLPEPVFSIKLKEWVQKLMMTLRHPSLPLLELQEIMTSVAGRIPAPVEKSVRRVMAQYASNITSVLCQFPSQQIATILDCHAATLQRKADREVFFINTQSIVQLVQRYRSGIRGYMKTVVLDLLRRYLRVEHHFQQAHYDKCVINLREQFKPDMSQVLDCIFSHAQVAKKNQLVIMLIDELCGPDPSLSDELISILNELTQLSKSEHCKVALRARQILIASHLPSYELRHNQVESIFLSAIDMYGHQFCPENLKKLILSETTIFDVLPTFFYHANKVVCMASLEVYVRRGYIAYELNSLQHRQLPDGTCVVEFQFMLPSSHPNRMTVPISITNPDLLRHSTELFMDSGFSPLCQRMGAMVAFRRFEDFTRNFDEVISCFANVPKDTPLFSEARTSLYSEDDCKSLREEPIHILNVSIQCADHLEDEALVPILRTFVQSKKNILVDYGLRRITFLIAQEKEFPKFFTFRARDEFAEDRIYRHLEPALAFQLELNRMRNFDLTAVPCANHKMHLYLGAAKVKEGVEVTDHRFFIRAIIRHSDLITKEASFEYLQNEGERLLLEAMDELEVAFNNTSVRTDCNHIFLNFVPTVIMDPFKIEESVRYMVMRYGSRLWKLRVLQAEVKINIRQTTTGSAVPIRLFITNESGYYLDISLYKEVTDSRSGNIMFHSFGNKQGPQHGMLINTPYVTKDLLQAKRFQAQTLGTTYIYDFPEMFRQALFKLWGSPDKYPKDILTYTELVLDSQGQLVEMNRLPGGNEVGMVAFKMRFKTQEYPEGRDVIVIGNDITFRIGSFGPGEDLLYLRASEMARAEGIPKIYVAANSGARIGMAEEIKHMFHVAWVDPEDPHKGFKYLYLTPQDYTRISSLNSVHCKHIEEGGESRYMITDIIGKDDGLGVENLRGSGMIAGESSLAYEEIVTISLVTCRAIGIGAYLVRLGQRVIQVENSHIILTGASALNKVLGREVYTSNNQLGGVQIMHYNGVSHITVPDDFEGVYTILEWLSYMPKDNHSPVPIITPTDPIDREIEFLPSRAPYDPRWMLAGRPHPTLKGTWQSGFFDHGSFKEIMAPWAQTVVTGRARLGGIPVGVIAVETRTVEVAVPADPANLDSEAKIIQQAGQVWFPDSAYKTAQAVKDFNREKLPLMIFANWRGFSGGMKDMYDQVLKFGAYIVDGLRQYKQPILIYIPPYAELRGGSWVVIDATINPLCIEMYADKESRGGVLEPEGTVEIKFRKKDLIKSMRRIDPAYKKLMEQLGEPDLSDKDRKDLEGRLKAREDLLLPIYHQVAVQFADFHDTPGRMLEKGVISDILEWKTARTFLYWRLRRLLLEDQVKQEILQASGELSHVHIQSMLRRWFVETEGAVKAYLWDNNQVVVQWLEQHWQAGDGPRSTIRENITYLKHDSVLKTIRGLVEENPEVAVDCVIYLSQHISPAERAQVVHLLSTMDSPAST,./data/raw/alphafold//AF-O00763-F1-model_v4.pdb,4882,1289,2132,2036 +1828,12739,12923,MPPSDPIIVLGAGVIGLTTAVRLLEAHLGANVHILADHWPSDALDAQYASTIAGAHHLSFADDGDARQRRWDMRTFDVLYDEWKAVGERTGLMALTQTEMWEGATSHLAVYEGNPDFRVLDPRTAPCSNITHMVSFTSLTIAPTVYLAALEARVRDLGAKLHRAHVPSLGALRTDPALLALYTRPPAAVFVCAGLGARHLVPAPEAAALFPTRGQVVVVRAPWMRAGFTRQVGSLGGGEGGTRTYIIPRCNGEVVLGGTMEQGDWTPYPRDETVTDILTRALQICPDIAPPYARSWPKDDQVAALRSIVVRDAVGFRPSRAGGARVALASAAGMRVVYNYGHGGAGWQSCWGCAEDAVALWAGGAGGARL,uniprot_search,Q75WF1,CN[C@H](CC(=O)O)C(=O)O,28.0,35.0,7.5,1.4.3.1,5417.0,1.4471580313422192,1.5049027295481434,CN[C@H](CC(=O)O)C(=O)O__MPPSDPIIVLGAGVIGLTTAVRLLEAHLGANVHILADHWPSDALDAQYASTIAGAHHLSFADDGDARQRRWDMRTFDVLYDEWKAVGERTGLMALTQTEMWEGATSHLAVYEGNPDFRVLDPRTAPCSNITHMVSFTSLTIAPTVYLAALEARVRDLGAKLHRAHVPSLGALRTDPALLALYTRPPAAVFVCAGLGARHLVPAPEAAALFPTRGQVVVVRAPWMRAGFTRQVGSLGGGEGGTRTYIIPRCNGEVVLGGTMEQGDWTPYPRDETVTDILTRALQICPDIAPPYARSWPKDDQVAALRSIVVRDAVGFRPSRAGGARVALASAAGMRVVYNYGHGGAGWQSCWGCAEDAVALWAGGAGGARL,./data/raw/alphafold//AF-Q75WF1-F1-model_v4.pdb,275,3413,4666,4914 +1829,12864,13050,MPTPQKHSTQSTNFEINLKHHGGKLGVTGSCHELCINSNGNKHGILIDCGLFQGKDAKDKHGNDKKLDIEFPISHLKALILTHTHIDHIGRLPWLLTKGFKQPIYCTPATAELVPLMLDDGLKLQLGLNKGQRERVLELIRKQIKPIPYNQWHRIKLTSTMVPSHSKSSCSSLKAKRPESLNLLLRFQPAGHILGSAYVEIKLPNDEIVVFSGDLGPSNTPLLPDPISPKRADLLVIESTYGNKLHDSVETRAKRLQEIIERSLQDGGAIIIPAFSVGRTQELLFDIEHLIHHNKIDSKIPIILDSPLANKVTKQYRRFKKLWSKEAKTKLNNQRHPLNFEQCITIESHKEHMQIVNRLKSTAKPCIIVAASGMCAGGRVMNYLEALLPDKRTDIILAGYQAHGTLGRDLQNQRSTVWIDNQPVDVNAQIHTMSGYSAHADQADLIKFVDGIEEGRKEVVVVHGEDNVREEFERVLEARNYTLR,brenda,B6EPH0,CO/N=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)[O-])=C(C[N+]3(C)CCCC3)CS[C@H]12)c1csc(=N)[nH]1,0.177,37.0,7.2,3.5.2.6,40269.0,-0.7520267336381934,-0.7520267336381934,CO/N=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)[O-])=C(C[N+]3(C)CCCC3)CS[C@H]12)c1csc(=N)[nH]1__MPTPQKHSTQSTNFEINLKHHGGKLGVTGSCHELCINSNGNKHGILIDCGLFQGKDAKDKHGNDKKLDIEFPISHLKALILTHTHIDHIGRLPWLLTKGFKQPIYCTPATAELVPLMLDDGLKLQLGLNKGQRERVLELIRKQIKPIPYNQWHRIKLTSTMVPSHSKSSCSSLKAKRPESLNLLLRFQPAGHILGSAYVEIKLPNDEIVVFSGDLGPSNTPLLPDPISPKRADLLVIESTYGNKLHDSVETRAKRLQEIIERSLQDGGAIIIPAFSVGRTQELLFDIEHLIHHNKIDSKIPIILDSPLANKVTKQYRRFKKLWSKEAKTKLNNQRHPLNFEQCITIESHKEHMQIVNRLKSTAKPCIIVAASGMCAGGRVMNYLEALLPDKRTDIILAGYQAHGTLGRDLQNQRSTVWIDNQPVDVNAQIHTMSGYSAHADQADLIKFVDGIEEGRKEVVVVHGEDNVREEFERVLEARNYTLR,./data/raw/alphafold//AF-B6EPH0-F1-model_v4.pdb,4914,1661,2511,2495 +1830,2683,2731,MTVTLCSPTEDDWPGMFLLAAASFTDFIGPESATAWRTLVPTDGAVVVRDGAGPGSEVVGMALYMDLRLTVPGEVVLPTAGLSFVAVAPTHRRRGLLRAMCAELHRRIADSGYPVAALHASEGGIYGRFGYGPATTLHELTVDRRFARFHADAPGGGLGGSSVRLVRPTEHRGEFEAIYERWRQQVPGGLLRPQVLWDELLAECKAAPGGDRESFALLHPDGYALYRVDRTDLKLARVSELRAVTADAHCALWRALIGLDSMERISIITHPQDPLPHLLTDTRLARTTWRQDGLWLRIMNVPAALEARGYAHEVGEFSTVLEVSDGGRFALKIGDGRARCTPTDAAAEIEMDRDVLGSLYLGAHRASTLAAANRLRTKDSQLLRRLDAAFASDVPVQTAFEF,brenda,P9WFK7,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,0.12,25.0,7.0,2.3.1.87,1773.0,-0.9208187539523752,-0.9208187539523752,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O__MTVTLCSPTEDDWPGMFLLAAASFTDFIGPESATAWRTLVPTDGAVVVRDGAGPGSEVVGMALYMDLRLTVPGEVVLPTAGLSFVAVAPTHRRRGLLRAMCAELHRRIADSGYPVAALHASEGGIYGRFGYGPATTLHELTVDRRFARFHADAPGGGLGGSSVRLVRPTEHRGEFEAIYERWRQQVPGGLLRPQVLWDELLAECKAAPGGDRESFALLHPDGYALYRVDRTDLKLARVSELRAVTADAHCALWRALIGLDSMERISIITHPQDPLPHLLTDTRLARTTWRQDGLWLRIMNVPAALEARGYAHEVGEFSTVLEVSDGGRFALKIGDGRARCTPTDAAAEIEMDRDVLGSLYLGAHRASTLAAANRLRTKDSQLLRRLDAAFASDVPVQTAFEF,./data/raw/alphafold//AF-P9WFK7-F1-model_v4.pdb,3701,1368,2129,2033 +1831,6625,6742,MPPPRTGRGLLWLGLVLSSVCVALGSETQANSTTDALNVLLIIVDDLRPSLGCYGDKLVRSPNIDQLASHSLLFQNAFAQQAVCAPSRVSFLTGRRPDTTRLYDFNSYWRVHAGNFSTIPQYFKENGYVTMSVGKVFHPGISSNHTDDSPYSWSFPPYHPSSEKYENTKTCRGPDGELHANLLCPVDVLDVPEGTLPDKQSTEQAIQLLEKMKTSASPFFLAVGYHKPHIPFRYPKEFQKLYPLENITLAPDPEVPDGLPPVAYNPWMDIRQREDVQALNISVPYGPIPVDFQRKIRQSYFASVSYLDTQVGRLLSALDDLQLANSTIIAFTSDHGWALGEHGEWAKYSNFDVATHVPLIFYVPGRTASLPEAGEKLFPYLDPFDSASQLMEPGRQSMDLVELVSLFPTLAGLAGLQVPPRCPVPSFHVELCREGKNLLKHFRFRDLEEDPYLPGNPRELIAYSQYPRPSDIPQWNSDKPSLKDIKIMGYSIRTIDYRYTVWVGFNPDEFLANFSDIHAGELYFVDSDPLQDHNMYNDSQGGDLFQLLMP,uniprot_search,P22304,CC(O)=N[C@H]1[C@@H](O[C@H]2[C@H](O)[C@@H](OS(=O)(=O)O)[C@H](O[C@H]3[C@H](O)[C@@H](C=O)O[C@@H]3COS(=O)(=O)O)O[C@H]2C(=O)O)O[C@H](COS(=O)(=O)O)[C@@H](O[C@@H]2O[C@@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2OS(=O)(=O)O)[C@@H]1O,0.0031,37.0,4.65,3.1.6.13,9606.0,-2.508638306165728,-2.508638306165728,CC(O)=N[C@H]1[C@@H](O[C@H]2[C@H](O)[C@@H](OS(=O)(=O)O)[C@H](O[C@H]3[C@H](O)[C@@H](C=O)O[C@@H]3COS(=O)(=O)O)O[C@H]2C(=O)O)O[C@H](COS(=O)(=O)O)[C@@H](O[C@@H]2O[C@@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2OS(=O)(=O)O)[C@@H]1O__MPPPRTGRGLLWLGLVLSSVCVALGSETQANSTTDALNVLLIIVDDLRPSLGCYGDKLVRSPNIDQLASHSLLFQNAFAQQAVCAPSRVSFLTGRRPDTTRLYDFNSYWRVHAGNFSTIPQYFKENGYVTMSVGKVFHPGISSNHTDDSPYSWSFPPYHPSSEKYENTKTCRGPDGELHANLLCPVDVLDVPEGTLPDKQSTEQAIQLLEKMKTSASPFFLAVGYHKPHIPFRYPKEFQKLYPLENITLAPDPEVPDGLPPVAYNPWMDIRQREDVQALNISVPYGPIPVDFQRKIRQSYFASVSYLDTQVGRLLSALDDLQLANSTIIAFTSDHGWALGEHGEWAKYSNFDVATHVPLIFYVPGRTASLPEAGEKLFPYLDPFDSASQLMEPGRQSMDLVELVSLFPTLAGLAGLQVPPRCPVPSFHVELCREGKNLLKHFRFRDLEEDPYLPGNPRELIAYSQYPRPSDIPQWNSDKPSLKDIKIMGYSIRTIDYRYTVWVGFNPDEFLANFSDIHAGELYFVDSDPLQDHNMYNDSQGGDLFQLLMP,./data/raw/alphafold//AF-P22304-F1-model_v4.pdb,5702,2492,3132,3614 +1832,34680,35288,MAKSALHLARMSYQPKMPASLQGAVKIIEGKATEAVSDKEEIAAIFPRTYGLPLISFAPGGERTEYPPTNVGVILSGGQAPGGHNVIAGLFDEMKLLNPDSRLFGFLMGPDGLIEHKYRELTAEVIDEYRNTGGFDMIGSGRTKLDKPEQFEAGLEILRELDIKALVIIGGDDSNTNACILAEYYASIDAGIQVIGCPKTIDGDLKNKQIETSFGFDTAAKVYSELIGNIQRDCNSARKYWHFIKLMGRSASHITLECALQTHPNICIVSEEVEANNYYLDDVVTYIAETVVRRSEAGMNFGTVLIPEGLIEFLPAMKRLIKELNEFLSQNDAEFKLIKRSAQRQYIKNKLSPENSRLYDSLPVDVARQLIADRDPHGNVQVSLIATEKLLADMTAQKLAEWAEEGRFQGRFSTLTHFFGYEGRCAMPSNFDANYCYCLGRAASILIAAGKTGYMAAIKNTADPVSEWEAGGVPMTMMMNMERRSGKMKPVIRKALVDMDGEPYRALREMRREWALSTEYVYPGPIQFFGPEHVCDSPTMTLRLEKNDR,sabio,Q9FAF8,O=P(O)(O)OCC1OC(O)(CO)C(O)C1O,2.2,37.0,7.5,2.7.1.90,837.0,0.3424226808222063,0.3424226808222063,O=P(O)(O)OCC1OC(O)(CO)C(O)C1O__MAKSALHLARMSYQPKMPASLQGAVKIIEGKATEAVSDKEEIAAIFPRTYGLPLISFAPGGERTEYPPTNVGVILSGGQAPGGHNVIAGLFDEMKLLNPDSRLFGFLMGPDGLIEHKYRELTAEVIDEYRNTGGFDMIGSGRTKLDKPEQFEAGLEILRELDIKALVIIGGDDSNTNACILAEYYASIDAGIQVIGCPKTIDGDLKNKQIETSFGFDTAAKVYSELIGNIQRDCNSARKYWHFIKLMGRSASHITLECALQTHPNICIVSEEVEANNYYLDDVVTYIAETVVRRSEAGMNFGTVLIPEGLIEFLPAMKRLIKELNEFLSQNDAEFKLIKRSAQRQYIKNKLSPENSRLYDSLPVDVARQLIADRDPHGNVQVSLIATEKLLADMTAQKLAEWAEEGRFQGRFSTLTHFFGYEGRCAMPSNFDANYCYCLGRAASILIAAGKTGYMAAIKNTADPVSEWEAGGVPMTMMMNMERRSGKMKPVIRKALVDMDGEPYRALREMRREWALSTEYVYPGPIQFFGPEHVCDSPTMTLRLEKNDR,./data/raw/alphafold//AF-Q9FAF8-F1-model_v4.pdb,2154,7688,9467,10591 +1833,14539,14748,MKIIRIETSRIAVPLTKPFKTALRTVYTAESVIVRITYDSGAVGWGEAPPTLVITGDSMDSIESAIHHVLKPALLGKSLAGYEAILHDIQHLLTGNMSAKAAVEMALYDGWAQMCGLPLYQMLGGYRDTLETDYTVSVNSPEEMAADAENYLKQGFQTLKIKVGKDDIATDIARIQEIRKRVGSAVKLRLDANQGWRPKEAVTAIRKMEDAGLGIELVEQPVHKDDLAGLKKVTDATDTPIMADESVFTPRQAFEVLQTRSADLINIKLMKAGGISGAEKINAMAEACGVECMVGSMIETKLGITAAAHFAASKRNITRFDFDAPLMLKTDVFNGGITYSGSTISMPGKPGLGIIGAALLKGEKEQ,brenda,O34508,CSCC[C@@H](N=C(O)[C@H](C)N)C(=O)O,0.51,37.0,8.5,5.1.1.20,1423.0,-0.2924298239020636,-0.2924298239020636,CSCC[C@@H](N=C(O)[C@H](C)N)C(=O)O__MKIIRIETSRIAVPLTKPFKTALRTVYTAESVIVRITYDSGAVGWGEAPPTLVITGDSMDSIESAIHHVLKPALLGKSLAGYEAILHDIQHLLTGNMSAKAAVEMALYDGWAQMCGLPLYQMLGGYRDTLETDYTVSVNSPEEMAADAENYLKQGFQTLKIKVGKDDIATDIARIQEIRKRVGSAVKLRLDANQGWRPKEAVTAIRKMEDAGLGIELVEQPVHKDDLAGLKKVTDATDTPIMADESVFTPRQAFEVLQTRSADLINIKLMKAGGISGAEKINAMAEACGVECMVGSMIETKLGITAAAHFAASKRNITRFDFDAPLMLKTDVFNGGITYSGSTISMPGKPGLGIIGAALLKGEKEQ,./data/raw/alphafold//AF-O34508-F1-model_v4.pdb,430,3661,4995,5310 +1834,37663,38328,MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEATKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEEVIPKDENGKILFDTVDLCATWEAVEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRNVRYLTLDIFAGPPNYPFSDEY,sabio,Q04828,OC1Cc2cccc3cccc1c23,0.022,25.0,7.4,1.3.1.20,9606.0,-1.6575773191777938,-1.6575773191777938,OC1Cc2cccc3cccc1c23__MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEATKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEEVIPKDENGKILFDTVDLCATWEAVEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRNVRYLTLDIFAGPPNYPFSDEY,./data/raw/alphafold//AF-Q04828-F1-model_v4.pdb,2022,202,1057,249 +1835,30069,30598,MSLSNKLTLDKLDVKGKRVVMRVDFNVPMKNNQITNNQRIKAAVPSIKFCLDNGAKSVVLMSHLGRPDGVPMPDKYSLEPVAVELKSLLGKDVLFLKDCVGPEVEKACANPAAGSVILLENLRFHVEEEGKGKDASGNKVKAEPAKIEAFRASLSKLGDVYVNDAFGTAHRAHSSMVGVNLPQKAGGFLMKKELNYFAKALESPERPFLAILGGAKVADKIQLINNMLDKVNEMIIGGGMAFTFLKVLNNMEIGTSLFDEEGAKIVKDLMSKAEKNGVKITLPVDFVTADKFDENAKTGQATVASGIPAGWMGLDCGPESSKKYAEAVTRAKQIVWNGPVGVFEWEAFARGTKALMDEVVKATSRGCITIIGGGDTATCCAKWNTEDKVSHVSTGGGASLELLEGKVLPGVDALSNI,sabio,P00558,O=C(O)C(O)COP(=O)(O)O,1.1,25.0,7.5,2.7.2.3,9606.0,0.041392685158225,-0.1983317783165435,O=C(O)C(O)COP(=O)(O)O__MSLSNKLTLDKLDVKGKRVVMRVDFNVPMKNNQITNNQRIKAAVPSIKFCLDNGAKSVVLMSHLGRPDGVPMPDKYSLEPVAVELKSLLGKDVLFLKDCVGPEVEKACANPAAGSVILLENLRFHVEEEGKGKDASGNKVKAEPAKIEAFRASLSKLGDVYVNDAFGTAHRAHSSMVGVNLPQKAGGFLMKKELNYFAKALESPERPFLAILGGAKVADKIQLINNMLDKVNEMIIGGGMAFTFLKVLNNMEIGTSLFDEEGAKIVKDLMSKAEKNGVKITLPVDFVTADKFDENAKTGQATVASGIPAGWMGLDCGPESSKKYAEAVTRAKQIVWNGPVGVFEWEAFARGTKALMDEVVKATSRGCITIIGGGDTATCCAKWNTEDKVSHVSTGGGASLELLEGKVLPGVDALSNI,./data/raw/alphafold//AF-P00558-F1-model_v4.pdb,1334,6443,2815,7880 +1836,31195,31752,MCKKYDVAIIGGGVIGSSVAHFLAERGHKVAIVEKQSIASEASKAAAGLLGVQAEWDAYDPLFELARESRAIFPQLAAVLREKTGVDIGYEEKGIYRIAQNEDEKERILHIMDWQQKTGEDSYFLTGDHVREKEPYLSESIIGAVYYPKDGHVIAPELTKAFAHSAAISGADIYEQTEVFDIRIENNKVTGVITSEGIVTCEKVVIAGGSWSTKLLSYFHRDWGTYPVKGEVVAVRSRKQLLKAPIFQERFYITPKRGGRYVIGATMKPHTFNKTVQPESITSILERAYTILPALKEAEWESTWAGLRPQSNHEAPYMGEHEEIKGLYTCTGHYRNGILLSPISGQYMADLIEGKQENHLLDSLLSRRV,brenda,L7T8Y9,O=C(O)CNCP(=O)(O)O,84.79,60.0,7.5,1.4.3.19,1396.0,1.928344635264862,1.928344635264862,O=C(O)CNCP(=O)(O)O__MCKKYDVAIIGGGVIGSSVAHFLAERGHKVAIVEKQSIASEASKAAAGLLGVQAEWDAYDPLFELARESRAIFPQLAAVLREKTGVDIGYEEKGIYRIAQNEDEKERILHIMDWQQKTGEDSYFLTGDHVREKEPYLSESIIGAVYYPKDGHVIAPELTKAFAHSAAISGADIYEQTEVFDIRIENNKVTGVITSEGIVTCEKVVIAGGSWSTKLLSYFHRDWGTYPVKGEVVAVRSRKQLLKAPIFQERFYITPKRGGRYVIGATMKPHTFNKTVQPESITSILERAYTILPALKEAEWESTWAGLRPQSNHEAPYMGEHEEIKGLYTCTGHYRNGILLSPISGQYMADLIEGKQENHLLDSLLSRRV,./data/raw/alphafold//AF-L7T8Y9-F1-model_v4.pdb,257,3393,4643,4886 +1837,37511,38174,MALGAAYHHYLQLAGDHGTATHALLLGVLIFLVIRLVSARRTGTTSANKRKQQQRLPLPPWPPGKLPIIGHLHLIGAETHISIRDLDAKHGRNGLLLLRIGAVPTLFVSSPSAADAVLRTQDHIFASRPPWMAAEIIRYGPSDVAFVPYGEYGRQGRKLLTTHMLSTKKVQSFRHGRQEEVRLVMDKIRAAATAAPPAAVDLSDLLSGYTNDVVSRAVLGASHRNQGRNRLFSELTEINVSLLAGFNLEDYFPPNMAMADVLLRLVSVKARRLNQRWNDVFDELIQEHVQSRPSGESEESEADFIHVLLSIQQEYGLTTDNLKAILVDMFEAGIETSYLTLEYGMAELINNRHVMEKLQTEVRTTMGSPDGKKLDMLAEEDLGSMPYLKATIKETLRLHPPAPFLLPHYSTADSEIDGYFVPAGTRVLVHAWALGRDRTTWEKPEEFMPERFVQEPGAVDVHMKGKDLRFIPFGSGRRICPGMNFGFATMEVMLANLMYHFDWEVPGSGAGVSMEESFGLTLRRKEKLLLVPRIAS,uniprot_search,Q43255,OC1=Nc2ccccc2OC1,0.018,25.0,7.5,1.14.14.157,4577.0,-1.744727494896694,-1.8516674048692343,OC1=Nc2ccccc2OC1__MALGAAYHHYLQLAGDHGTATHALLLGVLIFLVIRLVSARRTGTTSANKRKQQQRLPLPPWPPGKLPIIGHLHLIGAETHISIRDLDAKHGRNGLLLLRIGAVPTLFVSSPSAADAVLRTQDHIFASRPPWMAAEIIRYGPSDVAFVPYGEYGRQGRKLLTTHMLSTKKVQSFRHGRQEEVRLVMDKIRAAATAAPPAAVDLSDLLSGYTNDVVSRAVLGASHRNQGRNRLFSELTEINVSLLAGFNLEDYFPPNMAMADVLLRLVSVKARRLNQRWNDVFDELIQEHVQSRPSGESEESEADFIHVLLSIQQEYGLTTDNLKAILVDMFEAGIETSYLTLEYGMAELINNRHVMEKLQTEVRTTMGSPDGKKLDMLAEEDLGSMPYLKATIKETLRLHPPAPFLLPHYSTADSEIDGYFVPAGTRVLVHAWALGRDRTTWEKPEEFMPERFVQEPGAVDVHMKGKDLRFIPFGSGRRICPGMNFGFATMEVMLANLMYHFDWEVPGSGAGVSMEESFGLTLRRKEKLLLVPRIAS,./data/raw/alphafold//AF-Q43255-F1-model_v4.pdb,2598,8259,10148,11344 +1838,5779,5865,MGTKGKVIKCKAAIAWEAGKPLCIEEVEVAPPKAHEVRIQIIATSLCHTDATVIDSKFEGLAFPVIVGHEAAGIVESIGPGVTNVKPGDKVIPLYAPLCRKCKFCLSPLTNLCGKISNLKSPASDQQLMEDKTSRFTCKGKPVYHFFGTSTFSQYTVVSDINLAKIDDDANLERVCLLGCGFSTGYGAAINNAKVTPGSTCAVFGLGGVGLSAVMGCKAAGASRIIGIDINSEKFVKAKALGATDCLNPRDLHKPIQEVIIELTKGGVDFALDCAGGSETMKAALDCTTAGWGSCTFIGVAAGSKGLTIFPEELIIGRTINGTFFGGWKSVDSIPKLVTDYKNKKFNLDALVTHTLPFDKISEAFDLMNQGKSVRTILIF,sabio,P08319,CC(C=CC=C(C)C=CC1=C(C)C=CCC1(C)C)=CC=O,0.026,25.0,7.5,1.1.1.1,9606.0,-1.585026652029182,-1.585026652029182,CC(C=CC=C(C)C=CC1=C(C)C=CCC1(C)C)=CC=O__MGTKGKVIKCKAAIAWEAGKPLCIEEVEVAPPKAHEVRIQIIATSLCHTDATVIDSKFEGLAFPVIVGHEAAGIVESIGPGVTNVKPGDKVIPLYAPLCRKCKFCLSPLTNLCGKISNLKSPASDQQLMEDKTSRFTCKGKPVYHFFGTSTFSQYTVVSDINLAKIDDDANLERVCLLGCGFSTGYGAAINNAKVTPGSTCAVFGLGGVGLSAVMGCKAAGASRIIGIDINSEKFVKAKALGATDCLNPRDLHKPIQEVIIELTKGGVDFALDCAGGSETMKAALDCTTAGWGSCTFIGVAAGSKGLTIFPEELIIGRTINGTFFGGWKSVDSIPKLVTDYKNKKFNLDALVTHTLPFDKISEAFDLMNQGKSVRTILIF,./data/raw/alphafold//AF-P08319-F1-model_v4.pdb,5403,3181,1361,3127 +1839,9080,9228,MSLGIMKNMNYYLITSFILLNNGLSFKTNTIDNVNNIHLQSSIENTMINNNNSNLVHTDLHNDKTITCLSDNPIVHTSVGIYCGLREIVHWPNGPASMVDVYYGIRYAQSPTGSLRFKKPVEPIPEPKKIFMADKLPSTCPQPKDTMFQNSAAARMWVPNTPMSEDCLFLNIWVPLKESNSSHSNSKEKLAVMLWIYGGSFYMGTATLSVYDARFLAARQNVIVASMNYRLGSFGFLYMNTEEAPGNMGLWDQRLAMKWIKNHIENFGGDPHRITLFGESAGAVSVSTHVVSPWSHSYYNNAIMQSGSIFSNWGLATSEVSLNQTQRLAKILGCGYRSSMDQIKCLRSKSITEILDAHDTMYDPASYFSVPFPPVLDNNFFPYENSQSFRQLKYLKPSGALMFGINKNEGSYFLLYAFVSNSKWMKNLTDLPITNRMDYLRCLRQVLDLDDDDRPEFTEPLIRYTDFEYQTYQQLPTLESWTERLEEISSDRSFKCPTINMATAVTNDYRIPGRRRAHTLPVYFYEFQHRTLSLPMPKWTGTMHGYEIEYVFGIPFSPQFQASFYRFTDEERQLSDIMMTYWANFARTGDPNILPDGRHVTDNVNPEDPDEITGGELEDSLNHKQGRKNPFIGWPEFRNSTKAYIVFRSAPANLLVSTRPRHRQCLFWRRWYPALLQQVERNRQHCLGV,brenda,Q86GL8,CCCC(=O)SCC[N+](C)(C)C,0.399,,,3.1.1.7,6185.0,-0.3990271043132517,-0.3990271043132517,CCCC(=O)SCC[N+](C)(C)C__MSLGIMKNMNYYLITSFILLNNGLSFKTNTIDNVNNIHLQSSIENTMINNNNSNLVHTDLHNDKTITCLSDNPIVHTSVGIYCGLREIVHWPNGPASMVDVYYGIRYAQSPTGSLRFKKPVEPIPEPKKIFMADKLPSTCPQPKDTMFQNSAAARMWVPNTPMSEDCLFLNIWVPLKESNSSHSNSKEKLAVMLWIYGGSFYMGTATLSVYDARFLAARQNVIVASMNYRLGSFGFLYMNTEEAPGNMGLWDQRLAMKWIKNHIENFGGDPHRITLFGESAGAVSVSTHVVSPWSHSYYNNAIMQSGSIFSNWGLATSEVSLNQTQRLAKILGCGYRSSMDQIKCLRSKSITEILDAHDTMYDPASYFSVPFPPVLDNNFFPYENSQSFRQLKYLKPSGALMFGINKNEGSYFLLYAFVSNSKWMKNLTDLPITNRMDYLRCLRQVLDLDDDDRPEFTEPLIRYTDFEYQTYQQLPTLESWTERLEEISSDRSFKCPTINMATAVTNDYRIPGRRRAHTLPVYFYEFQHRTLSLPMPKWTGTMHGYEIEYVFGIPFSPQFQASFYRFTDEERQLSDIMMTYWANFARTGDPNILPDGRHVTDNVNPEDPDEITGGELEDSLNHKQGRKNPFIGWPEFRNSTKAYIVFRSAPANLLVSTRPRHRQCLFWRRWYPALLQQVERNRQHCLGV,./data/raw/alphafold//AF-Q86GL8-F1-model_v4.pdb,3727,1404,2174,2084 +1840,36703,37343,MEIPDLSSMKLLSRPELFDFEGVSMVHYFTDNWEKVKNFQARPDDILIATYPKAGTTWVSYILDLLYFGKDAPERQTSQPIYMRVPFLESCFQVIQSGTELADNLSTSPRLIKTHLPVQLVPKSFWEQNSRIVYVARNAKDNAVSYFHFDRMNMGEPEPGDWNTFLQKFMEGKNVFGPWFDHVSGWWEKKQTYSNLLYLFYEDLVEDTGREVEHLCSFLGLSTSVEEREKITKGVQFDAMKQNKMTNYSTLPVMDFKISPFMRKGKVGDWKGHFTVAQNEQFDEVYKQKMKNTTVKFRTEI,brenda,A0FIP8,O=c1c(-c2ccc(O)cc2)coc2cc(O)ccc12,0.0044,20.0,7.0,2.8.2.1,8284.0,-2.356547323513813,-2.356547323513813,O=c1c(-c2ccc(O)cc2)coc2cc(O)ccc12__MEIPDLSSMKLLSRPELFDFEGVSMVHYFTDNWEKVKNFQARPDDILIATYPKAGTTWVSYILDLLYFGKDAPERQTSQPIYMRVPFLESCFQVIQSGTELADNLSTSPRLIKTHLPVQLVPKSFWEQNSRIVYVARNAKDNAVSYFHFDRMNMGEPEPGDWNTFLQKFMEGKNVFGPWFDHVSGWWEKKQTYSNLLYLFYEDLVEDTGREVEHLCSFLGLSTSVEEREKITKGVQFDAMKQNKMTNYSTLPVMDFKISPFMRKGKVGDWKGHFTVAQNEQFDEVYKQKMKNTTVKFRTEI,./data/raw/alphafold//AF-A0FIP8-F1-model_v4.pdb,4829,8163,10039,11224 +1841,3535,3592,MEVKILSKKLIKPSSPTPSHLRHLTLTPVDRLAPPIKASNIFYYPAKGSNPAVDVERRNRLETSLSEILTRFYPLAGRYVRESHSVDCNDEGVEYLEAEVEGKLSRLLSRRNEVIEQVIQLAGGEFTNSLASVQVTVFACGGVTIGVRIRHSVVDGFTAAHFSSAWATASRESMDKVIWPSFDLASFLPVKDLPMVKPRPPPKIFGADKVMTRRFIFDGANISSLKAAACDPSFKREPSRVEAVTALIWRALMVVSRAKHGRLRTSLASHAMNLREKIVPPLPGICCGNLYTEVPATFMADSGKTELPNLKDLVGLLREVKFKESVSREDVLLTVIKSTNELHEALGKEDIDVYNFTSWCRFPFYGNDFGWGNPAWMTRCHTPVEMISLQDTECGDGIEAWVTLEKKDMLQFQQDGDIVSFSSNGAP,brenda,D7TU67,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)CC(=O)O,0.588,30.0,6.5,2.3.1.215,29760.0,-0.2306226739238615,-0.2306226739238615,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)CC(=O)O__MEVKILSKKLIKPSSPTPSHLRHLTLTPVDRLAPPIKASNIFYYPAKGSNPAVDVERRNRLETSLSEILTRFYPLAGRYVRESHSVDCNDEGVEYLEAEVEGKLSRLLSRRNEVIEQVIQLAGGEFTNSLASVQVTVFACGGVTIGVRIRHSVVDGFTAAHFSSAWATASRESMDKVIWPSFDLASFLPVKDLPMVKPRPPPKIFGADKVMTRRFIFDGANISSLKAAACDPSFKREPSRVEAVTALIWRALMVVSRAKHGRLRTSLASHAMNLREKIVPPLPGICCGNLYTEVPATFMADSGKTELPNLKDLVGLLREVKFKESVSREDVLLTVIKSTNELHEALGKEDIDVYNFTSWCRFPFYGNDFGWGNPAWMTRCHTPVEMISLQDTECGDGIEAWVTLEKKDMLQFQQDGDIVSFSSNGAP,./data/raw/alphafold//AF-D7TU67-F1-model_v4.pdb,3655,1304,2049,1949 +1842,32990,33579,MMFNKQIFTILILSLSLALAGSGCISEGAEDNVAQEITVDEFSNIRENPVTPWNPEPSAPVIDPTAYIDPQASVIGEVTIGANVMVSPMASIRSDEGMPIFVGDRSNVQDGVVLHALETINEEGEPIEDNIVEVDGKEYAVYIGNNVSLAHQSQVHGPAAVGDDTFIGMQAFVFKSKVGNNCVLEPRSAAIGVTIPDGRYIPAGMVVTSQAEADKLPEVTDDYAYSHTNEAVVYVNVHLAEGYKETS,brenda,P40881,O=C=O,16.7,37.0,7.5,4.2.1.1,2210.0,1.2227164711475833,1.2805864823760942,O=C=O__MMFNKQIFTILILSLSLALAGSGCISEGAEDNVAQEITVDEFSNIRENPVTPWNPEPSAPVIDPTAYIDPQASVIGEVTIGANVMVSPMASIRSDEGMPIFVGDRSNVQDGVVLHALETINEEGEPIEDNIVEVDGKEYAVYIGNNVSLAHQSQVHGPAAVGDDTFIGMQAFVFKSKVGNNCVLEPRSAAIGVTIPDGRYIPAGMVVTSQAEADKLPEVTDDYAYSHTNEAVVYVNVHLAEGYKETS,./data/raw/alphafold//AF-P40881-F1-model_v4.pdb,2066,7611,6301,9993 +1843,32547,33125,MIPRVAKFNFRLLSLALLGIQVARSAITYQNPTDLPGDVDYDFIVAGGGTAGLVVASRLSENPEWNVLVIEAGPSNKDVFETRVPGLSSELRPRFDWNYTTIPQDALGGRSLNYSRAKLLGGCSSHNGMVYTRCSRDDWDNYAEITGNQAFSWDSILPVMKRAEKFSKDSSHKPVKGHIDPSVHGGDGKLSVVASYTNASFNDLLLETAKELSGEFPFKLDMNDGRPLGLTWTQYTIDQRGERSSSATAYLEGTGNNVHVLVNTLVTRIVSAENGTDFRSVEFATDADSPKIQLRAKKEVIVSGGVINSPQILMNSGIGGREVLGANGIDTLVDNPSVGKNLSDQAATIIMLDTTLPITDYDVDAALIEWKKSHTGPLAQGGRLNHLTWVRLPDDKLDGLDPSSGENSPHIEFQFGQISHQLPPSGLTRFSFYRHCSPIPPLINLYTVSRGSISLSNNDPFSHPLIDLNMFGEEIDPAILREGIRSARRMLSSQAFKGFVGETVFPPSDATSDEDLDTFLKTSTFSYVHGVGTLSMSPQSASWGVVNPDFRVKGTSGLRVVDASVIPFAPAGHTQEPVYAFAEHASVLIAKSYS,brenda,Q3L1D1,O=C1C=CC(=O)C=C1,0.566,30.0,4.0,1.1.99.29,5341.0,-0.2471835688117286,-0.2471835688117286,O=C1C=CC(=O)C=C1__MIPRVAKFNFRLLSLALLGIQVARSAITYQNPTDLPGDVDYDFIVAGGGTAGLVVASRLSENPEWNVLVIEAGPSNKDVFETRVPGLSSELRPRFDWNYTTIPQDALGGRSLNYSRAKLLGGCSSHNGMVYTRCSRDDWDNYAEITGNQAFSWDSILPVMKRAEKFSKDSSHKPVKGHIDPSVHGGDGKLSVVASYTNASFNDLLLETAKELSGEFPFKLDMNDGRPLGLTWTQYTIDQRGERSSSATAYLEGTGNNVHVLVNTLVTRIVSAENGTDFRSVEFATDADSPKIQLRAKKEVIVSGGVINSPQILMNSGIGGREVLGANGIDTLVDNPSVGKNLSDQAATIIMLDTTLPITDYDVDAALIEWKKSHTGPLAQGGRLNHLTWVRLPDDKLDGLDPSSGENSPHIEFQFGQISHQLPPSGLTRFSFYRHCSPIPPLINLYTVSRGSISLSNNDPFSHPLIDLNMFGEEIDPAILREGIRSARRMLSSQAFKGFVGETVFPPSDATSDEDLDTFLKTSTFSYVHGVGTLSMSPQSASWGVVNPDFRVKGTSGLRVVDASVIPFAPAGHTQEPVYAFAEHASVLIAKSYS,./data/raw/alphafold//AF-Q3L1D1-F1-model_v4.pdb,3077,323,4160,1612 +1844,19997,20294,MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,uniprot_search,P24155,N=C(O)CCC(N=C(O)[C@@H]1CCCN1C(=O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],0.0043,37.0,7.4,3.4.24.15,10116.0,-2.3665315444204134,-2.3665315444204134,N=C(O)CCC(N=C(O)[C@@H]1CCCN1C(=O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]__MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,./data/raw/alphafold//AF-P24155-F1-model_v4.pdb,5089,1942,1509,2898 +1845,39635,40344,MDPLWYKDAVIYQLHVRSFFDANNDGYGDFEGLRRKLPYLEELGVNTLWLMPFFQSPLRDDGYDISDYYQILPVHGTLEDFKRFLDEAHGRGMKVIIELVLNHTSIDHPWFQEARKPNSPMRDWYVWSDTPEKYKGVRVIFKDFETSNWTFDPVAKAYYWHRFYWHQPDLNWDNPEVEKAIHQVMFFWADLGVDGFRLDAIPYLYEREGTSCENLPETIEAVKRLRKALEERYGPGKILLAEANMWPEETLPYFGDGDGVHMAYNFPLMPRIFMALRREDRGPIETMLKETEGIPETAQWALFLRNHDELTLEKVTEEEREFMYEAYAPDPKFRINLGIRRRLMPLLGGDRRRYELLTALLLTLKGTPIVYYGDEIGMGDNPFLGDRNGVRTPMQWSQDRNAGFSRAPYHALFLPPVSEGPYSYHFVNVEAQRENPHSLLSFNRRFLALRNQHAKIFGRGSLTLLPVENRRVLAYLREHEGERVLVVANLSRYTQAFDLPLEAYQGLVPVELFSQQPFPPVEGRYRLTLGPHGFALFALKPVEAVLHLPSPDWAEEPAPEEADLPRVHMPGGPEVLLVDTLVHERGREELLNALAQTLKEKSWLALKPQKVALLDALRFQKDPPLYLTLLQLENHRTLQVFLPLLWSPQRREGPGLFARTHGQPGHFYELSLDPGFYRLLLARLKEGFEGRSLRAYYRGRHPGPVPEAVDLLRPGLAAGEGVWVQLGLVQDGGLDRTERVLPRLDLPWVLRPEGGLFWERGASRRVLALTGSLPPGRPQDLFAALEVRLLESLPRLRGHAPGTPGLLPGALHETEALVRLLGVRLALLHRALGEVEGVEGGHPLLGRGLGAFLELEGEVYLVALGAEKRGTVEEDLARLAYDVERAVHLALEALEAELWAFAEEVADYLHAAFLQAYRSALPEEALEEAGWTRHMAEVAAEHLHREERPARKRIHERWQAKAGKA,brenda,Q5SL15,OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,82.2,30.0,6.5,5.4.99.16,274.0,1.9148718175400503,1.9148718175400503,OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O__MDPLWYKDAVIYQLHVRSFFDANNDGYGDFEGLRRKLPYLEELGVNTLWLMPFFQSPLRDDGYDISDYYQILPVHGTLEDFKRFLDEAHGRGMKVIIELVLNHTSIDHPWFQEARKPNSPMRDWYVWSDTPEKYKGVRVIFKDFETSNWTFDPVAKAYYWHRFYWHQPDLNWDNPEVEKAIHQVMFFWADLGVDGFRLDAIPYLYEREGTSCENLPETIEAVKRLRKALEERYGPGKILLAEANMWPEETLPYFGDGDGVHMAYNFPLMPRIFMALRREDRGPIETMLKETEGIPETAQWALFLRNHDELTLEKVTEEEREFMYEAYAPDPKFRINLGIRRRLMPLLGGDRRRYELLTALLLTLKGTPIVYYGDEIGMGDNPFLGDRNGVRTPMQWSQDRNAGFSRAPYHALFLPPVSEGPYSYHFVNVEAQRENPHSLLSFNRRFLALRNQHAKIFGRGSLTLLPVENRRVLAYLREHEGERVLVVANLSRYTQAFDLPLEAYQGLVPVELFSQQPFPPVEGRYRLTLGPHGFALFALKPVEAVLHLPSPDWAEEPAPEEADLPRVHMPGGPEVLLVDTLVHERGREELLNALAQTLKEKSWLALKPQKVALLDALRFQKDPPLYLTLLQLENHRTLQVFLPLLWSPQRREGPGLFARTHGQPGHFYELSLDPGFYRLLLARLKEGFEGRSLRAYYRGRHPGPVPEAVDLLRPGLAAGEGVWVQLGLVQDGGLDRTERVLPRLDLPWVLRPEGGLFWERGASRRVLALTGSLPPGRPQDLFAALEVRLLESLPRLRGHAPGTPGLLPGALHETEALVRLLGVRLALLHRALGEVEGVEGGHPLLGRGLGAFLELEGEVYLVALGAEKRGTVEEDLARLAYDVERAVHLALEALEAELWAFAEEVADYLHAAFLQAYRSALPEEALEEAGWTRHMAEVAAEHLHREERPARKRIHERWQAKAGKA,./data/raw/alphafold//AF-Q5SL15-F1-model_v4.pdb,2735,8489,4537,11695 +1846,22148,22495,MAEYLRLPHSLAMIRLCNPPVNAVSPTVIREVRNGLQKAGSDHTVKAIVICGANGNFCAGADIHGFSAFTPGLALGSLVDEIQRYQKPVLAAIQGVALGGGLELALGCHYRIANAKARVGLPEVTLGILPGARGTQLLPRVVGVPVALDLITSGKYLSADEALRLGILDAVVKSDPVEEAIKFAQKIIDKPIEPRRIFNKPVPSLPNMDSVFAEAIAKVRKQYPGVLAPETCVRSIQASVKHPYEVGIKEEEKLFMYLRASGQAKALQYAFFAEKSANKWSTPSGASWKTASAQPVSSVGVLGLGTMGRGIAISFARVGISVVAVESDPKQLDAAKKIITFTLEKEASRAHQNGQASAKPKLRFSSSTKELSTVDLVVEAVFEDMNLKKKVFAELSALCKPGAFLCTNTSALNVDDIASSTDRPQLVIGTHFFSPAHVMRLLEVIPSRYSSPTTIATVMSLSKKIGKIGVVVGNCYGFVGNRMLAPYYNQGFFLLEEGSKPEDVDGVLEEFGFKMGPFRVSDLAGLDVGWKIRKGQGLTGPSLPPGTPVRKRGNSRYSPLGDMLCEAGRFGQKTGKGWYQYDKPLGRIHKPDPWLSTFLSQYREVHHIEQRTISKEEILERCLYSLINEAFRILEEGMAARPEHIDVIYLHGYGWPRHKGGPMFYAASVGLPTVLEKLQKYYRQNPDIPQLEPSDYLRRLVAQGSPPLKEWQSLAGPHGSKL,sabio,P07896,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,0.0011,30.0,10.2,1.1.1.35,10116.0,-2.958607314841775,-2.958607314841775,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1__MAEYLRLPHSLAMIRLCNPPVNAVSPTVIREVRNGLQKAGSDHTVKAIVICGANGNFCAGADIHGFSAFTPGLALGSLVDEIQRYQKPVLAAIQGVALGGGLELALGCHYRIANAKARVGLPEVTLGILPGARGTQLLPRVVGVPVALDLITSGKYLSADEALRLGILDAVVKSDPVEEAIKFAQKIIDKPIEPRRIFNKPVPSLPNMDSVFAEAIAKVRKQYPGVLAPETCVRSIQASVKHPYEVGIKEEEKLFMYLRASGQAKALQYAFFAEKSANKWSTPSGASWKTASAQPVSSVGVLGLGTMGRGIAISFARVGISVVAVESDPKQLDAAKKIITFTLEKEASRAHQNGQASAKPKLRFSSSTKELSTVDLVVEAVFEDMNLKKKVFAELSALCKPGAFLCTNTSALNVDDIASSTDRPQLVIGTHFFSPAHVMRLLEVIPSRYSSPTTIATVMSLSKKIGKIGVVVGNCYGFVGNRMLAPYYNQGFFLLEEGSKPEDVDGVLEEFGFKMGPFRVSDLAGLDVGWKIRKGQGLTGPSLPPGTPVRKRGNSRYSPLGDMLCEAGRFGQKTGKGWYQYDKPLGRIHKPDPWLSTFLSQYREVHHIEQRTISKEEILERCLYSLINEAFRILEEGMAARPEHIDVIYLHGYGWPRHKGGPMFYAASVGLPTVLEKLQKYYRQNPDIPQLEPSDYLRRLVAQGSPPLKEWQSLAGPHGSKL,./data/raw/alphafold//AF-P07896-F1-model_v4.pdb,3459,946,1138,1399 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+1882,1780,1818,MEYTSIADTGIEASRIGLGTWAIGGTMWGGTDEKTSIETIRAALDQGITLIDTAPAYGFGQSEEIVGKAIKEYGKRDQVILATKTALDWKNNQLFRHANRARIVEEVENSLKRLQTDYIDLYQVHWPDPLVPIEETAEVMKELYDAGKIRAIGVSNFSIEQMDTFRAVAPLHTIQPPYNLFEREMEESVLPYAKDNKITTLLYGSLCRGLLTGKMTEEYTFEGDDLRNHDPKFQKPRFKEYLSAVNQLDKLAKTRYGKSVIHLAVRWILDQPGADIALWGARKPGQLEALSEITGWTLNSEDQKDINTILENTISDPVGPEFMAPPTREEI,sabio,P80874,CC(=O)C=O,0.74,25.0,7.0,1.1.1.-,1423.0,-0.1307682802690238,-0.1307682802690238,CC(=O)C=O__MEYTSIADTGIEASRIGLGTWAIGGTMWGGTDEKTSIETIRAALDQGITLIDTAPAYGFGQSEEIVGKAIKEYGKRDQVILATKTALDWKNNQLFRHANRARIVEEVENSLKRLQTDYIDLYQVHWPDPLVPIEETAEVMKELYDAGKIRAIGVSNFSIEQMDTFRAVAPLHTIQPPYNLFEREMEESVLPYAKDNKITTLLYGSLCRGLLTGKMTEEYTFEGDDLRNHDPKFQKPRFKEYLSAVNQLDKLAKTRYGKSVIHLAVRWILDQPGADIALWGARKPGQLEALSEITGWTLNSEDQKDINTILENTISDPVGPEFMAPPTREEI,./data/raw/alphafold//AF-P80874-F1-model_v4.pdb,3427,898,1083,1334 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+1884,5040,5119,MRKFAYCKVVLATSLIWVLLDMFLLLYFSECNKCDEKKERGLPAGDVLEPVQKPHEGPGEMGKPVVIPKEDQDKMKEMFKINQFNLMASEMIALNRSLPDVRLEGCKTKVYPDNLPTTSVVIVFHNEAWSTLLRTVHSVINRSPRHMLEEIVLVDDASERDFLKRPLESYVKKLKVPVHVIRMEQRSGLIRARLKGAAVSKGQVITFLDAHCECTVGWLEPLLARIKHDRKTVVCPIIDVISDDTFEYMAGSDMTYGGFNWKLNFRWYPVPQREMDRRKGDRTLPVRTPTMAGGLFSIDRDYFQEIGTYDAGMDIWGGENLEISFRIWQCGGTLEIVTCSHVGHVFRKATPYTFPGGTGQIINKNNRRLAEVWMDEFKTFFYIISPGVTKVDYGDISSRLGLRHKLQCRPFSWYLENIYPDSQIPRHYSSLGEIRNVETNQCLDNMARKENEKVGIFNCHGMGGNQVFSYTANKEIRTDDLCLDVSKLNGPVTMLKCHHLKGNQLWEYDPVKLTLQHVNSNQCLDKATEEDSQVPSIRDCSGSRSQQWLLRNVTLPEIF,uniprot_search,Q29121,CC(C)C[C@H](N=C(O)[C@@H](N)C(C)C)C(O)=NCC(O)=N[C@H](C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(O)=N[C@H](C(=O)O)C(C)C)[C@@H](C)O,8.3,37.0,7.3625,2.4.1.41,9823.0,0.919078092376074,0.919078092376074,CC(C)C[C@H](N=C(O)[C@@H](N)C(C)C)C(O)=NCC(O)=N[C@H](C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(O)=N[C@H](C(=O)O)C(C)C)[C@@H](C)O__MRKFAYCKVVLATSLIWVLLDMFLLLYFSECNKCDEKKERGLPAGDVLEPVQKPHEGPGEMGKPVVIPKEDQDKMKEMFKINQFNLMASEMIALNRSLPDVRLEGCKTKVYPDNLPTTSVVIVFHNEAWSTLLRTVHSVINRSPRHMLEEIVLVDDASERDFLKRPLESYVKKLKVPVHVIRMEQRSGLIRARLKGAAVSKGQVITFLDAHCECTVGWLEPLLARIKHDRKTVVCPIIDVISDDTFEYMAGSDMTYGGFNWKLNFRWYPVPQREMDRRKGDRTLPVRTPTMAGGLFSIDRDYFQEIGTYDAGMDIWGGENLEISFRIWQCGGTLEIVTCSHVGHVFRKATPYTFPGGTGQIINKNNRRLAEVWMDEFKTFFYIISPGVTKVDYGDISSRLGLRHKLQCRPFSWYLENIYPDSQIPRHYSSLGEIRNVETNQCLDNMARKENEKVGIFNCHGMGGNQVFSYTANKEIRTDDLCLDVSKLNGPVTMLKCHHLKGNQLWEYDPVKLTLQHVNSNQCLDKATEEDSQVPSIRDCSGSRSQQWLLRNVTLPEIF,./data/raw/alphafold//AF-Q29121-F1-model_v4.pdb,2888,2532,3173,3047 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+1895,13031,13224,KSFFRSLVAASLVIVSYSADTTSVPFDAESRDQIFQHHARSVISGYTNTLGEKNISVPSSPPGGERVGILGAGIGGLYSALILQSLDVPFEIIEASNRVGGRLFTHKFPNGGKYDYYDVGAMRYPLPKSDDKGNYQPGVMQRVGQLFTYLGMHKQLIPYYFKSNKSPGFQYFNGVRARIGEGSSFDAPALGINSSLIDIGVTKIVNDAVGPFAQALFDDLQKHTTTGWDDMMKNDAYSTRSYFSFKYLPSPSFGLPSEHFSTRVINWLETFDKSTGWYDRGLTETVLEAIAFGEVGDGEVDWRCIDGGSHVLPDTIAAFLHKKGGNAFVMNASVTAIGLENPNKEDSPMVVVAGGQKRKYSHVISTLPLPVLRTVDLKNSKLDIVQSNALRKLQYGPSIKIGILFKEPWWTTGQDKNGEKFDLVGGQSYTDLPIRTVVYPSYGVNTNAPSNTLIASYCWTNDAERMGSLIGTGKKTYEEQLEHLVLSNLAAVHNTDYQYLKDRLVDVHSWDWNHNPLTMGAFAFFGPGDFQDLYTSLNRPAANGKLHFAGEALSVRHAWVVGALDSAWRAVYNYLYVTDPAKLPKFFELWGKNAEWFEQPGDGKEPNSDNSLLEKFVRRTHGTVSV,brenda,S4S6Z0,COC(=O)[C@@H](N)CC(C)C,0.67,,7.5,1.4.3.2,76867.0,-0.1739251972991735,0.1743433539189498,COC(=O)[C@@H](N)CC(C)C__KSFFRSLVAASLVIVSYSADTTSVPFDAESRDQIFQHHARSVISGYTNTLGEKNISVPSSPPGGERVGILGAGIGGLYSALILQSLDVPFEIIEASNRVGGRLFTHKFPNGGKYDYYDVGAMRYPLPKSDDKGNYQPGVMQRVGQLFTYLGMHKQLIPYYFKSNKSPGFQYFNGVRARIGEGSSFDAPALGINSSLIDIGVTKIVNDAVGPFAQALFDDLQKHTTTGWDDMMKNDAYSTRSYFSFKYLPSPSFGLPSEHFSTRVINWLETFDKSTGWYDRGLTETVLEAIAFGEVGDGEVDWRCIDGGSHVLPDTIAAFLHKKGGNAFVMNASVTAIGLENPNKEDSPMVVVAGGQKRKYSHVISTLPLPVLRTVDLKNSKLDIVQSNALRKLQYGPSIKIGILFKEPWWTTGQDKNGEKFDLVGGQSYTDLPIRTVVYPSYGVNTNAPSNTLIASYCWTNDAERMGSLIGTGKKTYEEQLEHLVLSNLAAVHNTDYQYLKDRLVDVHSWDWNHNPLTMGAFAFFGPGDFQDLYTSLNRPAANGKLHFAGEALSVRHAWVVGALDSAWRAVYNYLYVTDPAKLPKFFELWGKNAEWFEQPGDGKEPNSDNSLLEKFVRRTHGTVSV,./data/raw/alphafold//AF-S4S6Z0-F1-model_v4.pdb,5136,2008,1491,2995 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+1908,22934,23288,MFATRQAFNLFQKRAFSASARQSSKVAILGAAGGIGQPLSLLMKLNPRVTELALYDIRGGPGVAADLSHINTNSTVTGYQPTPEGLRDALKGSEIVLIPAGVPRKRGMTRDDLFNTNASIVRDLAKAAADACPNANILVISNPVNSTVPIVAEVFKSKGVYNPKRLFGVTTLDVVRASRFISEVKNTDPANEEVTVVGGHSGVTIVPLISQSNHPDIEGETRDKLVNRIQFGGDEGVKAKDGAGSAALSMAFAGARSPSLCSSGQGVKGVVEPSFVDSPLYKDQGIDFFASRVELGPNGAEKVLPVGKVSPYEEKLLEAAFADLKKNIQKGIDFVKNNP,sabio,Q8TG27,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.13,30.0,7.4,1.1.1.37,68825.0,-0.8860566476931633,-0.8860566476931633,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MFATRQAFNLFQKRAFSASARQSSKVAILGAAGGIGQPLSLLMKLNPRVTELALYDIRGGPGVAADLSHINTNSTVTGYQPTPEGLRDALKGSEIVLIPAGVPRKRGMTRDDLFNTNASIVRDLAKAAADACPNANILVISNPVNSTVPIVAEVFKSKGVYNPKRLFGVTTLDVVRASRFISEVKNTDPANEEVTVVGGHSGVTIVPLISQSNHPDIEGETRDKLVNRIQFGGDEGVKAKDGAGSAALSMAFAGARSPSLCSSGQGVKGVVEPSFVDSPLYKDQGIDFFASRVELGPNGAEKVLPVGKVSPYEEKLLEAAFADLKKNIQKGIDFVKNNP,./data/raw/alphafold//AF-Q8TG27-F1-model_v4.pdb,4077,2218,4274,7758 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+1912,25850,26281,MLLAQRRLISLGCRSKPIKTIYSSSKVLGLCTSAKMALKFKNAKRIEGLDSNVWVEFTKLAADPSVVNLGQGFPDISPPSYVKEELSKAAFIDNMNQYTRGFGHPALVKALSCLYGKIYQRQIDPNEEILVAVGAYGSLFNSIQGLVDPGDEVIIMVPFYDCYEPMVRMAGAVPVFIPLRSKPTDGMKWTSSDWTFDPRELESKFSSKTKAIILNTPHNPLGKVYTRQELQVIADLCVKHDTLCISDEVYEWLVYTGHTHVKIATLPGMWERTITIGSAGKTFSVTGWKLGWSIGPAHLIKHLQTVQQNSFYTCATPLQAALAEAFWIDIKRMDDPECYFNSLPKELEVKRDRMVRLLNSVGLKPIVPDGGYFIIADVSSLGADLSDMNSDEPYDYKFVKWMTKHKKLTAIPVSAFCDSKSKPHFEKLVRFCFIKKDSTLDAAEEIFRAWNSQKS,brenda,Q71RI9,N[C@@H](Cc1ccc(O)cc1)C(=O)O,2.7,45.0,9.0,2.6.1.7,10090.0,0.4313637641589873,0.4313637641589873,N[C@@H](Cc1ccc(O)cc1)C(=O)O__MLLAQRRLISLGCRSKPIKTIYSSSKVLGLCTSAKMALKFKNAKRIEGLDSNVWVEFTKLAADPSVVNLGQGFPDISPPSYVKEELSKAAFIDNMNQYTRGFGHPALVKALSCLYGKIYQRQIDPNEEILVAVGAYGSLFNSIQGLVDPGDEVIIMVPFYDCYEPMVRMAGAVPVFIPLRSKPTDGMKWTSSDWTFDPRELESKFSSKTKAIILNTPHNPLGKVYTRQELQVIADLCVKHDTLCISDEVYEWLVYTGHTHVKIATLPGMWERTITIGSAGKTFSVTGWKLGWSIGPAHLIKHLQTVQQNSFYTCATPLQAALAEAFWIDIKRMDDPECYFNSLPKELEVKRDRMVRLLNSVGLKPIVPDGGYFIIADVSSLGADLSDMNSDEPYDYKFVKWMTKHKKLTAIPVSAFCDSKSKPHFEKLVRFCFIKKDSTLDAAEEIFRAWNSQKS,./data/raw/alphafold//AF-Q71RI9-F1-model_v4.pdb,3383,773,922,1129 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+1915,9250,9399,MATQTSNPQSVYDFTVKDAKGKDVDLSIYKGKVLIIVNVASQCGLTNSNYTDMTELYKKYKDQGLEILAFPCNQFGGQEPGNIEDIQQMVCTRFKAEYPIFDKVDVNGDNAAPLYRFLKSSKGGFFGDGIKWNFSKFLIDKEGHVVDRYSPTTSPASMEKDIKKLLGVA,uniprot_search,O24031,CCCCC(/C=C\C/C=C\CCCCCCCC(=O)O)OO,0.0827,30.0,7.8,1.11.1.12,4081.0,-1.0824944904474534,-1.2440509700360134,CCCCC(/C=C\C/C=C\CCCCCCCC(=O)O)OO__MATQTSNPQSVYDFTVKDAKGKDVDLSIYKGKVLIIVNVASQCGLTNSNYTDMTELYKKYKDQGLEILAFPCNQFGGQEPGNIEDIQQMVCTRFKAEYPIFDKVDVNGDNAAPLYRFLKSSKGGFFGDGIKWNFSKFLIDKEGHVVDRYSPTTSPASMEKDIKKLLGVA,./data/raw/alphafold//AF-O24031-F1-model_v4.pdb,3780,1479,2285,2220 +1916,1681,1718,MASGSEAEKSPEVVLEWPKKDKKRLLHAVYRVGDLDRTIKCYTECFGMKLLRKRDVPEEKYTNAFLGFGPEDTNFALELTYNYGVDKYDIGAGFGHFAIATEDVYKLAEKIKSSCCCKITREPGPVKGGSTVIAFAQDPDGYMFELIQRGPTPEPLCQVMLRVGDLDRSIKFYEKALGMKLLRKKDVPDYKYTIAMLGYADEDKTTVIELTYNYGVTEYTKGNAYAQVAIGTEDVYKSAEAVELVTKELGGKILRQPGPLPGLNTKIASFLDPDGWKVVLVDNADFLKELQ,brenda,Q948T6,CC(=O)C(O)SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=O)O,11.0,25.0,7.0,4.4.1.5,39947.0,1.0413926851582251,0.9611031387195084,CC(=O)C(O)SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=O)O__MASGSEAEKSPEVVLEWPKKDKKRLLHAVYRVGDLDRTIKCYTECFGMKLLRKRDVPEEKYTNAFLGFGPEDTNFALELTYNYGVDKYDIGAGFGHFAIATEDVYKLAEKIKSSCCCKITREPGPVKGGSTVIAFAQDPDGYMFELIQRGPTPEPLCQVMLRVGDLDRSIKFYEKALGMKLLRKKDVPDYKYTIAMLGYADEDKTTVIELTYNYGVTEYTKGNAYAQVAIGTEDVYKSAEAVELVTKELGGKILRQPGPLPGLNTKIASFLDPDGWKVVLVDNADFLKELQ,./data/raw/alphafold//AF-Q948T6-F1-model_v4.pdb,3411,867,1042,1280 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+1931,18818,19091,MEFLYTYETLKLEFPLVEPEKARFILLGVPFDGTTSYKAGARFGPTLIRQATLNLESYILDYDLDIAELPIADIGDIAVVAGDPRKTADRVRETLEELKKANPKAIPILLGGEHSQTLGAVEALKPASYVVFDAHLDLRNSYEDNPYNHACVARRISELGVKEAIFGIRSGTKEEVDFARERDIPWVHARDYSFDAFVDLVEALPEPVYLSIDIDVFDLSMVPSTGTPEAGGLRFWEVVEAIEWLVEKKEIAGFDIMEVAGEKLGDPTALTAAKLLFYSIGAMAKFGR,brenda,Q5JI38,N=C(N)NCCCCNCCCN,0.00642,70.0,7.5,3.5.3.24,311400.0,-2.192464971931147,-2.192464971931147,N=C(N)NCCCCNCCCN__MEFLYTYETLKLEFPLVEPEKARFILLGVPFDGTTSYKAGARFGPTLIRQATLNLESYILDYDLDIAELPIADIGDIAVVAGDPRKTADRVRETLEELKKANPKAIPILLGGEHSQTLGAVEALKPASYVVFDAHLDLRNSYEDNPYNHACVARRISELGVKEAIFGIRSGTKEEVDFARERDIPWVHARDYSFDAFVDLVEALPEPVYLSIDIDVFDLSMVPSTGTPEAGGLRFWEVVEAIEWLVEKKEIAGFDIMEVAGEKLGDPTALTAAKLLFYSIGAMAKFGR,./data/raw/alphafold//AF-Q5JI38-F1-model_v4.pdb,3979,4748,6562,6502 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+1967,23383,23742,MSKAFDLVIIGAGSGGLEAGWNAATLYKKRVAVVDVQTVHGPPFFAALGGTCVNVGCVPKKLMVTGAQYMDQLRESAGFGWEFDASTIKANWKTLIAAKNAAVLDINKSYEDMFKDTEGLEFFLGWGALEQKNVVTVREGADPKSKVKERLQAEHIIIATGSWPQMLKIPGIEHCISSNEAFYLEEPPRRVLTVGGGFISVEFAGIFNAYKPVGGKVTLCYRNNPILRGFDYTLRQELTKQLVANGIDIMTNENPSKIELNPDGSKHVTFESGKTLDVDVVMMAIGRLPRTGYLQLQTVGVNLTDKGAIQVDEFSRTNVPNIYAIGDVTGRIMLTPVAINEGASVVDTIFGSKPRKTDHTRVASAVFSIPPIGTCGLTEEEAAKSFEKVAVYLSCFTPLMHNISGSKYKKFVAKIITDHGDGTVVGVHLLGDSSPEIIQAVGICMKLNAKISDFYNTIGVHPTSAEELCSMRTPSHYYIKGEKMETLPDSSL,uniprot_search,P13110,NC(CCC(O)=NC1CSSCC(N=C(O)CCC(N)C(=O)O)C(O)=NCC(O)=NCCCCCCCCN=C(O)CN=C1O)C(=O)O,0.12,35.0,7.2,1.8.1.12,5692.0,-0.9208187539523752,-0.9208187539523752,NC(CCC(O)=NC1CSSCC(N=C(O)CCC(N)C(=O)O)C(O)=NCC(O)=NCCCCCCCCN=C(O)CN=C1O)C(=O)O__MSKAFDLVIIGAGSGGLEAGWNAATLYKKRVAVVDVQTVHGPPFFAALGGTCVNVGCVPKKLMVTGAQYMDQLRESAGFGWEFDASTIKANWKTLIAAKNAAVLDINKSYEDMFKDTEGLEFFLGWGALEQKNVVTVREGADPKSKVKERLQAEHIIIATGSWPQMLKIPGIEHCISSNEAFYLEEPPRRVLTVGGGFISVEFAGIFNAYKPVGGKVTLCYRNNPILRGFDYTLRQELTKQLVANGIDIMTNENPSKIELNPDGSKHVTFESGKTLDVDVVMMAIGRLPRTGYLQLQTVGVNLTDKGAIQVDEFSRTNVPNIYAIGDVTGRIMLTPVAINEGASVVDTIFGSKPRKTDHTRVASAVFSIPPIGTCGLTEEEAAKSFEKVAVYLSCFTPLMHNISGSKYKKFVAKIITDHGDGTVVGVHLLGDSSPEIIQAVGICMKLNAKISDFYNTIGVHPTSAEELCSMRTPSHYYIKGEKMETLPDSSL,./data/raw/alphafold//AF-P13110-F1-model_v4.pdb,4154,1448,6907,2168 +1968,19686,19972,MHIERLAVDESVGRAMPPQRFIEALSDLGVPVEFAGEDEQFGPGDAVASFGHRDAFLDADWVHCIRAGYDEFPVGVYEEAGTYLTNSTGIHGTTVGETVAGYMLTFARRLHAYRDAQHDHAWDLPRYEEPFTLAGERVCVVGLGTLGRGVVDRAAALGMEVVGVRRSGDPVDNVSTVYTPDRLHEAIADARFVVLATPLTDETEGMVAAPEFETMREDASLVNVARGPVVVESDLVAALDSGDIAGAALDVFSEEPLPEDSPLWDFEDVLITPHVSAATSKYHEDVAALIRENIEKIATGDELTNRVV,brenda,Q2VEQ7,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.046,40.0,8.5,1.1.1.272,2252.0,-1.337242168318426,-1.3711622382203952,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MHIERLAVDESVGRAMPPQRFIEALSDLGVPVEFAGEDEQFGPGDAVASFGHRDAFLDADWVHCIRAGYDEFPVGVYEEAGTYLTNSTGIHGTTVGETVAGYMLTFARRLHAYRDAQHDHAWDLPRYEEPFTLAGERVCVVGLGTLGRGVVDRAAALGMEVVGVRRSGDPVDNVSTVYTPDRLHEAIADARFVVLATPLTDETEGMVAAPEFETMREDASLVNVARGPVVVESDLVAALDSGDIAGAALDVFSEEPLPEDSPLWDFEDVLITPHVSAATSKYHEDVAALIRENIEKIATGDELTNRVV,./data/raw/alphafold//AF-Q2VEQ7-F1-model_v4.pdb,3345,744,888,1093 +1969,22063,22408,MSKFSYLQNGKASTNGVPHANGHHQQHQNGHSNGVARNGGTATDTLPVAYQQKAATSGPFHMPRTEHVGYTYDTLQEIATYLLERTELRPKVGIICGSGLGTLAEQLTDVDSFDYETIPHFPVSTVAGHVGRLVFGYLAGVPVMCMQGRFHHYEGYPLAKCAMPVRVMHLIGCTHLIATNAAGGANPKYRVGDIMLIKDHINLMGFAGNNPLQGPNDERFGPRFFGMANTYDPKLNQQAKVIARQIGIENELREGVYTCLGGPNFETVAEVKMLSMLGVDAIGMSTVHEIITARHCGMTCFAFSLITNMCTMSYEEEEEHCHDSIVGVGKNREKTLGEFVSRIVKHIHYEAKK,brenda,A4Q998,N=c1nc(O)c2ncn([C@H]3C[C@H](O)[C@@H](CO)O3)c2[nH]1,0.05,27.0,7.4,2.4.2.1,7165.0,-1.3010299956639813,-1.3010299956639813,N=c1nc(O)c2ncn([C@H]3C[C@H](O)[C@@H](CO)O3)c2[nH]1__MSKFSYLQNGKASTNGVPHANGHHQQHQNGHSNGVARNGGTATDTLPVAYQQKAATSGPFHMPRTEHVGYTYDTLQEIATYLLERTELRPKVGIICGSGLGTLAEQLTDVDSFDYETIPHFPVSTVAGHVGRLVFGYLAGVPVMCMQGRFHHYEGYPLAKCAMPVRVMHLIGCTHLIATNAAGGANPKYRVGDIMLIKDHINLMGFAGNNPLQGPNDERFGPRFFGMANTYDPKLNQQAKVIARQIGIENELREGVYTCLGGPNFETVAEVKMLSMLGVDAIGMSTVHEIITARHCGMTCFAFSLITNMCTMSYEEEEEHCHDSIVGVGKNREKTLGEFVSRIVKHIHYEAKK,./data/raw/alphafold//AF-A4Q998-F1-model_v4.pdb,4487,5542,5987,7615 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+1971,33984,34583,MAMITGGELVVRTLIKAGVEHLFGLHGAHIDTIFQACLDHDVPIIDTRHEAAAGHAAEGYARAGAKLGVAGHGGRGIYQCGHAHCQRLAGSQGRCIPHPGSGALRDDETNTLQAGIDQVAMAAPITKWAHRVMATEHIPRLVMQAIRAALSAPRGPVLLDLPWDILMNQIDEDSVIIPDLVLSAHGARPDPADLDQALALLRKAERPVIVLGSEASRTARKTALSAFVAATGVPVFADYEGLSMLSGLPDAMRGGLVQNLYSFAKADAAPDLVLMLGARFGLNTGHGSGQLIPHSAQVIQVDPDACELGRLQGIALGIVADVGGTIEALAQATAQDAAWPDRGDWCAKVTDLAQERYASIAAKSSSEHALHPFHASQVIAKHVDAGVTVVADGALTYLWLSEVMSRVKPGGFLCHGYLGSMGVGFGTALGAQVADLEAGRRTILVTGDGSVGYSIGEFDTLVRKQLPLIVIIMNNQSWGATLHFQQLAVGPNRVTGTRLENGSYHGVAAAFGADGYHVDSVESFSAALAQALAHNRPACINVAVALDPIPPEELILIGMDPFA,uniprot_search,P51853,O=Cc1ccccc1,2.2,29.25,8.25,4.1.2.38,294.0,0.3424226808222063,0.6712113404111031,O=Cc1ccccc1__MAMITGGELVVRTLIKAGVEHLFGLHGAHIDTIFQACLDHDVPIIDTRHEAAAGHAAEGYARAGAKLGVAGHGGRGIYQCGHAHCQRLAGSQGRCIPHPGSGALRDDETNTLQAGIDQVAMAAPITKWAHRVMATEHIPRLVMQAIRAALSAPRGPVLLDLPWDILMNQIDEDSVIIPDLVLSAHGARPDPADLDQALALLRKAERPVIVLGSEASRTARKTALSAFVAATGVPVFADYEGLSMLSGLPDAMRGGLVQNLYSFAKADAAPDLVLMLGARFGLNTGHGSGQLIPHSAQVIQVDPDACELGRLQGIALGIVADVGGTIEALAQATAQDAAWPDRGDWCAKVTDLAQERYASIAAKSSSEHALHPFHASQVIAKHVDAGVTVVADGALTYLWLSEVMSRVKPGGFLCHGYLGSMGVGFGTALGAQVADLEAGRRTILVTGDGSVGYSIGEFDTLVRKQLPLIVIIMNNQSWGATLHFQQLAVGPNRVTGTRLENGSYHGVAAAFGADGYHVDSVESFSAALAQALAHNRPACINVAVALDPIPPEELILIGMDPFA,./data/raw/alphafold//AF-P51853-F1-model_v4.pdb,5799,2608,3258,3749 +1972,40726,41463,MSQTIDLTLDGLSCGHCVKRVKESLEQRPDVEQADVSITEAHVTGTASAEQLIETIKQAGYDASVSHPKAKPLAESSIPSEALTAVSEALPAATADDDDSQQLLLSGMSCASCVTRVQNALQSVPGVTQARVNLAERTALVMGSASPQDLVQAVEKAGYGAEAIEDDAKRRERQQETAVATMKRFRWQAIVALAVGIPVMVWGMIGDNMMVTADNRSLWLVIGLITLAVMVFAGGHFYRSAWKSLLNGAATMDTLVALGTGVAWLYSMSVNLWPQWFPMEARHLYYEASAMIIGLINLGHMLEARARQRSSKALEKLLDLTPPTARLVTDEGEKSVPLAEVQPGMLLRLTTGDRVPVDGEITQGEAWLDEAMLTGEPIPQQKGEGDSVHAGTVVQDGSVLFRASAVGSHTTLSRIIRMVRQAQSSKPEIGQLADKISAVFVPVVVVIALVSAAIWYFFGPAPQIVYTLVIATTVLIIACPCALGLATPMSIISGVGRAAEFGVLVRDADALQRASTLDTVVFDKTGTLTEGKPQVVAVKTFADVDEAQALRLAAALEQGSSHPLARAILDKAGDMQLPQVNGFRTLRGLGVSGEAEGHALLLGNQALLNEQQVGTKAIEAEITAQASQGATPVLLAVDGKAVALLAVRDPLRSDSVAALQRLHKAGYRLVMLTGDNPTTANAIAKEAGIDEVIAGVLPDGKAEAIKHLQSEGRQVAMVGDGINDAPALAQADVGIAMGGGSDVAIETAAITLMRHSLMGVADALAISRATLHNMKQNLLGAFIYNSIGIPVAAGILWPFTGTLLNPVVAGAAMALSSITVVSNANRLLRFKPKE,sabio,Q59385,[Cu+2],0.0015,22.0,6.8,7.2.2.8,562.0,-2.8239087409443187,-2.8239087409443187,[Cu+2]__MSQTIDLTLDGLSCGHCVKRVKESLEQRPDVEQADVSITEAHVTGTASAEQLIETIKQAGYDASVSHPKAKPLAESSIPSEALTAVSEALPAATADDDDSQQLLLSGMSCASCVTRVQNALQSVPGVTQARVNLAERTALVMGSASPQDLVQAVEKAGYGAEAIEDDAKRRERQQETAVATMKRFRWQAIVALAVGIPVMVWGMIGDNMMVTADNRSLWLVIGLITLAVMVFAGGHFYRSAWKSLLNGAATMDTLVALGTGVAWLYSMSVNLWPQWFPMEARHLYYEASAMIIGLINLGHMLEARARQRSSKALEKLLDLTPPTARLVTDEGEKSVPLAEVQPGMLLRLTTGDRVPVDGEITQGEAWLDEAMLTGEPIPQQKGEGDSVHAGTVVQDGSVLFRASAVGSHTTLSRIIRMVRQAQSSKPEIGQLADKISAVFVPVVVVIALVSAAIWYFFGPAPQIVYTLVIATTVLIIACPCALGLATPMSIISGVGRAAEFGVLVRDADALQRASTLDTVVFDKTGTLTEGKPQVVAVKTFADVDEAQALRLAAALEQGSSHPLARAILDKAGDMQLPQVNGFRTLRGLGVSGEAEGHALLLGNQALLNEQQVGTKAIEAEITAQASQGATPVLLAVDGKAVALLAVRDPLRSDSVAALQRLHKAGYRLVMLTGDNPTTANAIAKEAGIDEVIAGVLPDGKAEAIKHLQSEGRQVAMVGDGINDAPALAQADVGIAMGGGSDVAIETAAITLMRHSLMGVADALAISRATLHNMKQNLLGAFIYNSIGIPVAAGILWPFTGTLLNPVVAGAAMALSSITVVSNANRLLRFKPKE,./data/raw/alphafold//AF-Q59385-F1-model_v4.pdb,1366,6611,2876,8020 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+2148,12520,12697,MTRKRTYWVPNSSGGLVNRGIDIGDDMVSGLIYKTYTLQDGPWSQQERNPEAPGRAAVPPWGKYDAALRTMIPFRPKPRFPAPQPLDNAGLFSYLTVSWLTPLMIQSLRSRLDENTIPPLSVHDASDKNVQRLHRLWEEEVSRRGIEKASVLLVMLRFQRTRLIFDALLGICFCIASVLGPILIIPKILEYSEEQLGNVVHGVGLCFALFLSECVKSLSFSSSWIINQRTAIRFRAAVSSFAFEKLIQFKSVIHITSGEAISFFTGDVNYLFEGVCYGPLVLITCASLVICSISSYFIIGYTAFIAILCYLLVFPLAVFMTRMAVKAQHHTSEVSDQRIRVTSEVLTCIKLIKMYTWEKPFAKIIEDLRRKERKLLEKCGLVQSLTSITLFIIPTVATAVWVLIHTSLKLKLTASMAFSMLASLNLLRLSVFFVPIAVKGLTNSKSAVMRFKKFFLQESPVFYVQTLQDPSKALVFEEATLSWQQTCPGIVNGALELERNGHASEGMTRPRDALGPEEEGNSLGPELHKINLVVSKGMMLGVCGNTGSGKSSLLSAILEEMHLLEGSVGVQGSLAYVPQQAWIVSGNIRENILMGGAYDKARYLQVLHCCSLNRDLELLPFGDMTEIGERGLNLSGGQKQRISLARAVYSDRQIYLLDDPLSAVDAHVGKHIFEECIKKTLRGKTVVLVTHQLQYLEFCGQIILLENGKICENGTHSELMQKKGKYAQLIQKMHKEATSDMLQDTAKIAEKPKVESQALATSLEESLNGNAVPEHQLTQEEEMEEGSLSWRVYHHYIQAAGGYMVSCIIFFFVVLIVFLTIFSFWWLSYWLEQGSGTNSSRESNGTMADLGNIADNPQLSFYQLVYGLNALLLICVGVCSSGIFTKVTRKASTALHNKLFNKVFRCPMSFFDTIPIGRLLNCFAGDLEQLDQLLPIFSEQFLVLSLMVIAVLLIVSVLSPYILLMGAIIMVICFIYYMMFKKAIGVFKRLENYSRSPLFSHILNSLQGLSSIHVYGKTEDFISQFKRLTDAQNNYLLLFLSSTRWMALRLEIMTNLVTLAVALFVAFGISSTPYSFKVMAVNIVLQLASSFQATARIGLETEAQFTAVERILQYMKMCVSEAPLHMEGTSCPQGWPQHGEIIFQDYHMKYRDNTPTVLHGINLTIRGHEVVGIVGRTGSGKSSLGMALFRLVEPMAGRILIDGVDICSIGLEDLRSKLSVIPQDPVLLSGTIRFNLDPFDRHTDQQIWDALERTFLTKAISKFPKKLHTDVVENGGNFSVGERQLLCIARAVLRNSKIILIDEATASIDMETDTLIQRTIREAFQGCTVLVIAHRVTTVLNCDHILVMGNGKVVEFDRPEVLRKKPGSLFAALMATATSSLR,sabio,Q96J66,CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1,0.957,37.0,7.4,-.-.-.-,9606.0,-0.0190880622231564,-0.0190880622231564,CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1__MTRKRTYWVPNSSGGLVNRGIDIGDDMVSGLIYKTYTLQDGPWSQQERNPEAPGRAAVPPWGKYDAALRTMIPFRPKPRFPAPQPLDNAGLFSYLTVSWLTPLMIQSLRSRLDENTIPPLSVHDASDKNVQRLHRLWEEEVSRRGIEKASVLLVMLRFQRTRLIFDALLGICFCIASVLGPILIIPKILEYSEEQLGNVVHGVGLCFALFLSECVKSLSFSSSWIINQRTAIRFRAAVSSFAFEKLIQFKSVIHITSGEAISFFTGDVNYLFEGVCYGPLVLITCASLVICSISSYFIIGYTAFIAILCYLLVFPLAVFMTRMAVKAQHHTSEVSDQRIRVTSEVLTCIKLIKMYTWEKPFAKIIEDLRRKERKLLEKCGLVQSLTSITLFIIPTVATAVWVLIHTSLKLKLTASMAFSMLASLNLLRLSVFFVPIAVKGLTNSKSAVMRFKKFFLQESPVFYVQTLQDPSKALVFEEATLSWQQTCPGIVNGALELERNGHASEGMTRPRDALGPEEEGNSLGPELHKINLVVSKGMMLGVCGNTGSGKSSLLSAILEEMHLLEGSVGVQGSLAYVPQQAWIVSGNIRENILMGGAYDKARYLQVLHCCSLNRDLELLPFGDMTEIGERGLNLSGGQKQRISLARAVYSDRQIYLLDDPLSAVDAHVGKHIFEECIKKTLRGKTVVLVTHQLQYLEFCGQIILLENGKICENGTHSELMQKKGKYAQLIQKMHKEATSDMLQDTAKIAEKPKVESQALATSLEESLNGNAVPEHQLTQEEEMEEGSLSWRVYHHYIQAAGGYMVSCIIFFFVVLIVFLTIFSFWWLSYWLEQGSGTNSSRESNGTMADLGNIADNPQLSFYQLVYGLNALLLICVGVCSSGIFTKVTRKASTALHNKLFNKVFRCPMSFFDTIPIGRLLNCFAGDLEQLDQLLPIFSEQFLVLSLMVIAVLLIVSVLSPYILLMGAIIMVICFIYYMMFKKAIGVFKRLENYSRSPLFSHILNSLQGLSSIHVYGKTEDFISQFKRLTDAQNNYLLLFLSSTRWMALRLEIMTNLVTLAVALFVAFGISSTPYSFKVMAVNIVLQLASSFQATARIGLETEAQFTAVERILQYMKMCVSEAPLHMEGTSCPQGWPQHGEIIFQDYHMKYRDNTPTVLHGINLTIRGHEVVGIVGRTGSGKSSLGMALFRLVEPMAGRILIDGVDICSIGLEDLRSKLSVIPQDPVLLSGTIRFNLDPFDRHTDQQIWDALERTFLTKAISKFPKKLHTDVVENGGNFSVGERQLLCIARAVLRNSKIILIDEATASIDMETDTLIQRTIREAFQGCTVLVIAHRVTTVLNCDHILVMGNGKVVEFDRPEVLRKKPGSLFAALMATATSSLR,./data/raw/alphafold//AF-Q96J66-F1-model_v4.pdb,23,2715,3385,3913 +2149,23155,23510,MSCPVIELTQQLIRRPSLSPDDAGCQALMIERLRKIGFTIEHMDFGDTQNFWAWRGRGETLAFAGHTDVVPAGDVDRWINPPFEPTIRDGMLFGRGAADMKGSLAAMVVAAERFVAQHPHHRGRLAFLITSDEEASAKNGTVKVVEALMARNERLDYCLVGEPSSTEIVGDVVKNGRRGSLTCNLTIHGVQGHVAYPHLADNPVHRAAPFLNELVAIEWDRGNDFFPATSMQVANIQAGTGSNNVIPGELFVQFNFRFSTELTDEMIKERVHALLEKHQLRYTVDWWLSGQPFLTARGKLVDAVVNAIEHYNEIKPQLLTTGGTSDGRFIARMGAQVVELGPVNATIHKINECVNAADLQLLARMYQRIMEQLVA,sabio,Q8ZN75,NC(CC(=O)O)C(=O)NC(CO)C(=O)O,0.66,37.0,8.0,3.5.1.18,90371.0,-0.1804560644581313,-0.1804560644581313,NC(CC(=O)O)C(=O)NC(CO)C(=O)O__MSCPVIELTQQLIRRPSLSPDDAGCQALMIERLRKIGFTIEHMDFGDTQNFWAWRGRGETLAFAGHTDVVPAGDVDRWINPPFEPTIRDGMLFGRGAADMKGSLAAMVVAAERFVAQHPHHRGRLAFLITSDEEASAKNGTVKVVEALMARNERLDYCLVGEPSSTEIVGDVVKNGRRGSLTCNLTIHGVQGHVAYPHLADNPVHRAAPFLNELVAIEWDRGNDFFPATSMQVANIQAGTGSNNVIPGELFVQFNFRFSTELTDEMIKERVHALLEKHQLRYTVDWWLSGQPFLTARGKLVDAVVNAIEHYNEIKPQLLTTGGTSDGRFIARMGAQVVELGPVNATIHKINECVNAADLQLLARMYQRIMEQLVA,./data/raw/alphafold//AF-Q8ZN75-F1-model_v4.pdb,4651,5859,7584,8417 +2150,15160,15374,MVTVFGILNLTEDSFF,brenda,Q704U4,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(S[C@@H]3CN[C@H](C(=O)N(C)C)C3)[C@H](C)[C@H]12,0.025,25.0,7.0,3.5.2.6,287.0,-1.6020599913279625,-1.6020599913279625,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(S[C@@H]3CN[C@H](C(=O)N(C)C)C3)[C@H](C)[C@H]12__MVTVFGILNLTEDSFF,./data/raw/alphafold//AF-Q704U4-F1-model_v4.pdb,3567,1176,1891,1756 +2151,11506,11669,MILIDHQTVSGIPFLHIVKEENRDRPAPLVFFVHGFTSAKEHNLHFAYLLAEKGFRAVLPEALYHGERAEQLSAEELAVHFWDIVLNEIEELDVLKKDFEARGLIEDGRIGLAGTSMGGITTFGAMAAYDWVKAGVSLMGSPNYTAFFQQQIDHIQKQDIDIDVTKEQVDELFARLKPFDLSLEPEKLRSRPLLFWHGVQDKVVPYAPTRGFYETIKPHYSSRPDHLQFLKDERADHKVPRYAVLETVAWFDKHL,brenda,A0A1B1WA13,CCOC(=O)/C=C(\C)c1ccc(O)c(OC)c1,2.15,30.0,8.0,3.1.1.73,1390.0,0.3324384599156053,0.3324384599156053,CCOC(=O)/C=C(\C)c1ccc(O)c(OC)c1__MILIDHQTVSGIPFLHIVKEENRDRPAPLVFFVHGFTSAKEHNLHFAYLLAEKGFRAVLPEALYHGERAEQLSAEELAVHFWDIVLNEIEELDVLKKDFEARGLIEDGRIGLAGTSMGGITTFGAMAAYDWVKAGVSLMGSPNYTAFFQQQIDHIQKQDIDIDVTKEQVDELFARLKPFDLSLEPEKLRSRPLLFWHGVQDKVVPYAPTRGFYETIKPHYSSRPDHLQFLKDERADHKVPRYAVLETVAWFDKHL,./data/raw/alphafold//AF-A0A1B1WA13-F1-model_v4.pdb,5333,3245,3996,4657 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+2173,27085,27549,MGFTKKSLDQIDVKDKRVFMRVDFNVPMEKGKITNTKRIDATIPSIQYCLDHGCKAVVLASHLGRPDGHVVPELTLKPVAEKLEEILKHKVIFLNDCVGEEVIKACANPAPGSVILLENVRFHPEEEGSSIVDGKKVKADPEKVKEFREQLTKLGDVYVNDAFGTVHRAHSTMVGVNLSPKVSGFLVKKELGYFAKAFDHINRPYLGILGGAKVADKIPIINNFLEKVDQLIICGGMAYTFLAASKNMKIGKSLFDASKVEMCKELLAKAEAKKVEILLPFDFVACDKFGEDANTQICTLEEGIPEGWEGVDCGPKTSALWREKILAAKTIMWNGPCGVFEIDKFSAGTKALCEAVAAATQAGVLTIVGGGDTPTALKKFGLDKQVSHISTGGGASLELLQGLPLPGVANLDDAE,sabio,C4M192,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,0.6,37.0,6.0,2.7.2.3,5759.0,-0.2218487496163563,0.1548150837129494,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O__MGFTKKSLDQIDVKDKRVFMRVDFNVPMEKGKITNTKRIDATIPSIQYCLDHGCKAVVLASHLGRPDGHVVPELTLKPVAEKLEEILKHKVIFLNDCVGEEVIKACANPAPGSVILLENVRFHPEEEGSSIVDGKKVKADPEKVKEFREQLTKLGDVYVNDAFGTVHRAHSTMVGVNLSPKVSGFLVKKELGYFAKAFDHINRPYLGILGGAKVADKIPIINNFLEKVDQLIICGGMAYTFLAASKNMKIGKSLFDASKVEMCKELLAKAEAKKVEILLPFDFVACDKFGEDANTQICTLEEGIPEGWEGVDCGPKTSALWREKILAAKTIMWNGPCGVFEIDKFSAGTKALCEAVAAATQAGVLTIVGGGDTPTALKKFGLDKQVSHISTGGGASLELLQGLPLPGVANLDDAE,./data/raw/alphafold//AF-C4M192-F1-model_v4.pdb,1334,6441,8309,10314 +2174,16421,16662,MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEAVKLAIEAGFHHIDSAHVYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWSNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEEVIPKDENGKILFDTVDLCATWEAMEKCKDAGLAKSIGVSNFNHRLLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRNVRYLTLDIFAGPPNYPFSDEY,brenda,P52895,C[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)CC[C@@H]12,0.0057,25.0,7.5,1.1.1.213,9606.0,-2.2441251443275085,-2.39677236146895,C[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)CC[C@@H]12__MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEAVKLAIEAGFHHIDSAHVYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWSNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEEVIPKDENGKILFDTVDLCATWEAMEKCKDAGLAKSIGVSNFNHRLLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRNVRYLTLDIFAGPPNYPFSDEY,./data/raw/alphafold//AF-P52895-F1-model_v4.pdb,2022,202,1057,250 +2175,31510,32067,MFADHVFHVVDTHTEGEPTRIVLSGVNVKGEDIIEKREYFKEHYDWIRTALLHEPRGHSDQFGAVLVPSDIADFGVIYMDTSGYLDMCGHATMGVATVLVELGIIEKKEPYTTVKLETPAGLVEAKAKVKGGVVKEVTVVDVPSFYVGEFVIEYPGRGKIKVDVAFGGNFYVIADARDLGLRVRREYIKELIPTALKLIKVANEQIKVQHPRKGVQNRINLAMLTDEPEREDSDGKNVVIWGEGSVDRSPCGTGSASRVATLYSKGILKEGDIFVHESILGTQFRIKIVGTTKIGEYTAIIPEITGSAYITKISQDIISKNDPLWKGFLLR,brenda,H3ZMH5,O=C(O)[C@@H]1C[C@@H](O)CN1,6.08,50.0,8.0,5.1.1.8,2265.0,0.7839035792727349,0.7839035792727349,O=C(O)[C@@H]1C[C@@H](O)CN1__MFADHVFHVVDTHTEGEPTRIVLSGVNVKGEDIIEKREYFKEHYDWIRTALLHEPRGHSDQFGAVLVPSDIADFGVIYMDTSGYLDMCGHATMGVATVLVELGIIEKKEPYTTVKLETPAGLVEAKAKVKGGVVKEVTVVDVPSFYVGEFVIEYPGRGKIKVDVAFGGNFYVIADARDLGLRVRREYIKELIPTALKLIKVANEQIKVQHPRKGVQNRINLAMLTDEPEREDSDGKNVVIWGEGSVDRSPCGTGSASRVATLYSKGILKEGDIFVHESILGTQFRIKIVGTTKIGEYTAIIPEITGSAYITKISQDIISKNDPLWKGFLLR,./data/raw/alphafold//AF-H3ZMH5-F1-model_v4.pdb,1899,7373,9334,9671 +2176,32769,33353,MSELIVNVINGPNLGRLGRREPAVYGGTTHDELVALIEREAAELGLKAVVRQSDSEAQLLDWIHQAADAAEPVILNAGGLTHTSVALRDACAELSAPLIEVHISNVHAREEFRRHSYLSPIATGVIVGLGIQGYLLALRYLAEHVGT,brenda,P9WPX7,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O,0.015,25.0,7.2,4.2.1.10,562.0,-1.8239087409443189,-1.8239087409443189,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O__MSELIVNVINGPNLGRLGRREPAVYGGTTHDELVALIEREAAELGLKAVVRQSDSEAQLLDWIHQAADAAEPVILNAGGLTHTSVALRDACAELSAPLIEVHISNVHAREEFRRHSYLSPIATGVIVGLGIQGYLLALRYLAEHVGT,./data/raw/alphafold//AF-P9WPX7-F1-model_v4.pdb,2032,7568,6253,9934 +2177,28204,28692,MFIELDCPASVKKQLAKLFEVSLRATVPDEPDVAPLVDACAAKSGVKFADYQCNNAMSLWAKIKGKQTGFRGPPALGQAIVANLPQSEMIESCSIAGPGFVNIVLSKKWIAQRLEMMLIDGIDTWAPRLPVKVVMVDFSSPNIAKEMHVGHLRSTIIGDTLARMLEFACVETLIRRNHLGDWGTQFGMLIAHLFDMYPNPEDVNETAIGDLQAFYKASKVRFDNDPEFKLRAQQSVVLLQSGDKKYRKAWERICDVSKAEFEKVYKRLGVRVEAMGESFFNDLIPPTLEKLDKLGLIEDSDGARVIFVEGVNIPIIAVKRDGGYNYFSSDLASLWYRLNVEKLEWNIYVTDVGQWQHFDMLFKAFRRAGWLPKDENDFPKCTHIGFGLVLGEDGKRFRSRSSETVRLVDLLDEAKRRCKSALLERDAAKDWSEEEIEKTSEAIGYGAVKYADLKINRLTNYTFNFDQMLNDKGNTAVYLLYAHARICSIIRKSGKDIEELKKNGNIVLNHEDERALGLHLIQFPEVFVESLANLLPNVLCEYLYNLTEIFTKKFYTNCQVIGSPEQTSRLLLCEATATVMRKCFYLLGIDPVYKL,brenda,B2G3G6,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.186,30.0,7.5,6.1.1.19,3823.0,-0.7304870557820837,-0.7072583551625831,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MFIELDCPASVKKQLAKLFEVSLRATVPDEPDVAPLVDACAAKSGVKFADYQCNNAMSLWAKIKGKQTGFRGPPALGQAIVANLPQSEMIESCSIAGPGFVNIVLSKKWIAQRLEMMLIDGIDTWAPRLPVKVVMVDFSSPNIAKEMHVGHLRSTIIGDTLARMLEFACVETLIRRNHLGDWGTQFGMLIAHLFDMYPNPEDVNETAIGDLQAFYKASKVRFDNDPEFKLRAQQSVVLLQSGDKKYRKAWERICDVSKAEFEKVYKRLGVRVEAMGESFFNDLIPPTLEKLDKLGLIEDSDGARVIFVEGVNIPIIAVKRDGGYNYFSSDLASLWYRLNVEKLEWNIYVTDVGQWQHFDMLFKAFRRAGWLPKDENDFPKCTHIGFGLVLGEDGKRFRSRSSETVRLVDLLDEAKRRCKSALLERDAAKDWSEEEIEKTSEAIGYGAVKYADLKINRLTNYTFNFDQMLNDKGNTAVYLLYAHARICSIIRKSGKDIEELKKNGNIVLNHEDERALGLHLIQFPEVFVESLANLLPNVLCEYLYNLTEIFTKKFYTNCQVIGSPEQTSRLLLCEATATVMRKCFYLLGIDPVYKL,./data/raw/alphafold//AF-B2G3G6-F1-model_v4.pdb,3991,4765,6587,6532 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+2179,23884,24266,MQSCARAWGLRLGRGVGGGRRLAGGSGPCWAPRSRDSSSGGGDSAAAGASRLLERLLPRHDDFARRHIGPGDKDQREMLQTLGLASIDELIEKTVPANIRLKRPLKMEDPVCENEILATLHAISSKNQIWRSYIGMGYYNCSVPQTILRNLLENSGWITQYTPYQPEVSQGRLESLLNYQTMVCDITGLDMANASLLDEGTAAAEALQLCYRHNKRRKFLVDPRCHPQTIAVVQTRAKYTGVLTELKLPCEMDFSGKDVSGVLFQYPDTEGKVEDFTELVERAHQSGSLACCATDLLALCILRPPGEFGVDIALGSSQRFGVPLGYGGPHAAFFAVRESLVRMMPGRMVGVTRDATGKEVYRLALQTREQHIRRDKATSNICTAQALLANMAAMFAIYHGSHGLEHIARRVHNATLILSEGLKRAGHQLQHDLFFDTLKIQCGCSVKEVLGRAAQRQINFRLFEDGTLGISLDETVNEKDLDDLLWIFGCESSAELVAESMGEECRGIPGSVFKRTSPFLTHQVFNSYHSETNIVRYMKKLENKDISLVHSMIPLGSCTMKLNSSSELAPITWKEFANIHPFVPLDQAQGYQQLFRELEKDLCELTGYDQVCFQPNSGAQGEYAGLATIRAYLNQKGEGHRTVCLIPKSAHGTNPASAHMAGMKIQPVEVDKYGNIDAVHLKAMVDKHKENLAAIMITYPSTNGVFEENISDVCDLIHQHGGQVYLDGANMNAQVGICRPGDFGSDVSHLNLHKTFCIPHGGGGPGMGPIGVKKHLAPFLPNHPVISLKRNEDACPVGTVSAAPWGSSSILPISWAYIKMMGGKGLKQATETAILNANYMAKRLETHYRILFRGARGYVGHEFILDTRPFKKSANIEAVDVAKRLQDYGFHAPTMSWPVAGTLMVEPTESEDKAELDRFCDAMISIRQEIADIEEGRIDPRVNPLKMSPHSLTCVTSSHWDRPYSREVAAFPLPFVKPENKFWPTIARIDDIYGDQHLVCTCPPMEVYESPFSEQKRASS,brenda,P23378,NCC(=O)O,1.3,25.0,7.0,1.4.4.2,9606.0,0.1139433523068367,-2.0054305360676628,NCC(=O)O__MQSCARAWGLRLGRGVGGGRRLAGGSGPCWAPRSRDSSSGGGDSAAAGASRLLERLLPRHDDFARRHIGPGDKDQREMLQTLGLASIDELIEKTVPANIRLKRPLKMEDPVCENEILATLHAISSKNQIWRSYIGMGYYNCSVPQTILRNLLENSGWITQYTPYQPEVSQGRLESLLNYQTMVCDITGLDMANASLLDEGTAAAEALQLCYRHNKRRKFLVDPRCHPQTIAVVQTRAKYTGVLTELKLPCEMDFSGKDVSGVLFQYPDTEGKVEDFTELVERAHQSGSLACCATDLLALCILRPPGEFGVDIALGSSQRFGVPLGYGGPHAAFFAVRESLVRMMPGRMVGVTRDATGKEVYRLALQTREQHIRRDKATSNICTAQALLANMAAMFAIYHGSHGLEHIARRVHNATLILSEGLKRAGHQLQHDLFFDTLKIQCGCSVKEVLGRAAQRQINFRLFEDGTLGISLDETVNEKDLDDLLWIFGCESSAELVAESMGEECRGIPGSVFKRTSPFLTHQVFNSYHSETNIVRYMKKLENKDISLVHSMIPLGSCTMKLNSSSELAPITWKEFANIHPFVPLDQAQGYQQLFRELEKDLCELTGYDQVCFQPNSGAQGEYAGLATIRAYLNQKGEGHRTVCLIPKSAHGTNPASAHMAGMKIQPVEVDKYGNIDAVHLKAMVDKHKENLAAIMITYPSTNGVFEENISDVCDLIHQHGGQVYLDGANMNAQVGICRPGDFGSDVSHLNLHKTFCIPHGGGGPGMGPIGVKKHLAPFLPNHPVISLKRNEDACPVGTVSAAPWGSSSILPISWAYIKMMGGKGLKQATETAILNANYMAKRLETHYRILFRGARGYVGHEFILDTRPFKKSANIEAVDVAKRLQDYGFHAPTMSWPVAGTLMVEPTESEDKAELDRFCDAMISIRQEIADIEEGRIDPRVNPLKMSPHSLTCVTSSHWDRPYSREVAAFPLPFVKPENKFWPTIARIDDIYGDQHLVCTCPPMEVYESPFSEQKRASS,./data/raw/alphafold//AF-P23378-F1-model_v4.pdb,4453,5965,1656,8694 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+2269,32264,32835,MQSWSRVYCSLAKRGHFNRISHGLQGLSAVPLRTYADQPIDADVTVIGSGPGGYVAAIKAAQLGFKTVCIEKNETLGGTCLNVGCIPSKALLNNSHYYHMAHGKDFASRGIEMSEVRLNLDKMMEQKSTAVKALTGGIAHLFKQNKVVHVNGYGKITGKNQVTATKADGGTQVIDTKNILIATGSEVTPFPGITIDEDTIVSSTGALSLKKVPEKMVVIGAGVIGVELGSVWQRLGADVTAVEFLGHVGGVGIDMEISKNFQRILQKQGFKFKLNTKVTGATKKSDGKIDVSIEAASGGKAEVITCDVLLVCIGRRPFTKNLGLEELGIELDPRGRIPVNTRFQTKIPNIYAIGDVVAGPMLAHKAEDEGIICVEGMAGGAVHIDYNCVPSVIYTHPEVAWVGKSEEQLKEEGIEYKVGKFPFAANSRAKTNADTDGMVKILGQKSTDRVLGAHILGPGAGEMVNEAALALEYGASCEDIARVCHAHPTLSEAFREANLAASFGKSINF,sabio,P09622,O=C([O-])CCCC[C@@H]1CCSS1,0.53,37.0,6.3,1.8.1.4,9606.0,-0.2757241303992109,0.4897741873520475,O=C([O-])CCCC[C@@H]1CCSS1__MQSWSRVYCSLAKRGHFNRISHGLQGLSAVPLRTYADQPIDADVTVIGSGPGGYVAAIKAAQLGFKTVCIEKNETLGGTCLNVGCIPSKALLNNSHYYHMAHGKDFASRGIEMSEVRLNLDKMMEQKSTAVKALTGGIAHLFKQNKVVHVNGYGKITGKNQVTATKADGGTQVIDTKNILIATGSEVTPFPGITIDEDTIVSSTGALSLKKVPEKMVVIGAGVIGVELGSVWQRLGADVTAVEFLGHVGGVGIDMEISKNFQRILQKQGFKFKLNTKVTGATKKSDGKIDVSIEAASGGKAEVITCDVLLVCIGRRPFTKNLGLEELGIELDPRGRIPVNTRFQTKIPNIYAIGDVVAGPMLAHKAEDEGIICVEGMAGGAVHIDYNCVPSVIYTHPEVAWVGKSEEQLKEEGIEYKVGKFPFAANSRAKTNADTDGMVKILGQKSTDRVLGAHILGPGAGEMVNEAALALEYGASCEDIARVCHAHPTLSEAFREANLAASFGKSINF,./data/raw/alphafold//AF-P09622-F1-model_v4.pdb,3281,666,783,6728 +2270,10737,10893,MKLLARALRLCEFGRQASSRRLVAGQGCVGPRRGCCAPVQVVGPRADLPPCGACITGRIMRPDDANVAGNVHGGTILKMIEEAGAIISTRHCNSQNGERCVAALARVERTDFLSPMCIGEVAHVSAEITYTSKHSVEVQVNVMSENILTGAKKLTNKATLWYVPLSLKNVDKVLEVPPVVYSRQEQEEEGRKRYEAQKLERMETKWRNGDIVQPVLNPEPNTVSYSQSSLIHLVGPSDCTLHGFVHGGVTMKLMDEVAGIVAARHCKTNIVTASVDAINFHDKIRKGCVITISGRMTFTSNKSMEIEVLVDADPVVDSSQKRYRAASAFFTYVSLSQEGRSLPVPQLVPETEDEKKRFEEGKGRYLQMKAKRQGHAEPQP,sabio,O00154,CCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O,0.0064,30.0,7.4,3.1.2.2,9606.0,-2.193820026016113,-2.193820026016113,CCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O__MKLLARALRLCEFGRQASSRRLVAGQGCVGPRRGCCAPVQVVGPRADLPPCGACITGRIMRPDDANVAGNVHGGTILKMIEEAGAIISTRHCNSQNGERCVAALARVERTDFLSPMCIGEVAHVSAEITYTSKHSVEVQVNVMSENILTGAKKLTNKATLWYVPLSLKNVDKVLEVPPVVYSRQEQEEEGRKRYEAQKLERMETKWRNGDIVQPVLNPEPNTVSYSQSSLIHLVGPSDCTLHGFVHGGVTMKLMDEVAGIVAARHCKTNIVTASVDAINFHDKIRKGCVITISGRMTFTSNKSMEIEVLVDADPVVDSSQKRYRAASAFFTYVSLSQEGRSLPVPQLVPETEDEKKRFEEGKGRYLQMKAKRQGHAEPQP,./data/raw/alphafold//AF-O00154-F1-model_v4.pdb,204,2974,3687,4279 +2271,10884,11040,MPSTDLLKLKDFEPYLEILEAYSTKAKNYVNGYCTKYEPWQLIAGSVLCTLLVVWVYELIFQPESLWSRFKNKLFRLIRKMPFIGRKIQQQLTKAKKDLVKNMPFLKLDKDYVKTLPAQGLSTAEVLERLKEYSSMDVFWQEGKASGAVYSGEPKLTELLVQAYGEFTWSNPLHPDIFPGLRKLEAEIVRMTCSLFNGGPDSCGCVTSGGTESILMACKAYRDLALEKGIKTPEIVAPESAHAAFDKAAHYFGMKIVRVAQKKNMEVDVRAMKRAISRNTAMLVCSAPQFPHGVIDPIPEVAKLAVKYKIPFHVDACLGGFLIVFMEKAGYPLEKPFDFRVKGVTSISADTHKYGYAPKGSSVVMYSNEKYRKYQFFVDADWQGGIYASPSIAGSRPGGIIAACWAALMHFGENGYVEATKQIIKTARFLKSELENIKNIFILGDPQLSVIALGSNDFDIYRLSNMMSAKGWNFNYLQFPRSIHFCITLVHTRKRVAIQFLKDIRESVTQIMKNPKAKTTGMGAIYGMAQATIDRKMVAEISSVFLDSLYSTDPVTQGNQMNGSPKPR,uniprot_search,Q8CHN6,CCCCCCCCCCCCCCC[C@@H](O)[C@@H](N)COP(=O)(O)O,0.016,37.0,7.5,4.1.2.27,10116.0,-1.7958800173440752,-1.7958800173440752,CCCCCCCCCCCCCCC[C@@H](O)[C@@H](N)COP(=O)(O)O__MPSTDLLKLKDFEPYLEILEAYSTKAKNYVNGYCTKYEPWQLIAGSVLCTLLVVWVYELIFQPESLWSRFKNKLFRLIRKMPFIGRKIQQQLTKAKKDLVKNMPFLKLDKDYVKTLPAQGLSTAEVLERLKEYSSMDVFWQEGKASGAVYSGEPKLTELLVQAYGEFTWSNPLHPDIFPGLRKLEAEIVRMTCSLFNGGPDSCGCVTSGGTESILMACKAYRDLALEKGIKTPEIVAPESAHAAFDKAAHYFGMKIVRVAQKKNMEVDVRAMKRAISRNTAMLVCSAPQFPHGVIDPIPEVAKLAVKYKIPFHVDACLGGFLIVFMEKAGYPLEKPFDFRVKGVTSISADTHKYGYAPKGSSVVMYSNEKYRKYQFFVDADWQGGIYASPSIAGSRPGGIIAACWAALMHFGENGYVEATKQIIKTARFLKSELENIKNIFILGDPQLSVIALGSNDFDIYRLSNMMSAKGWNFNYLQFPRSIHFCITLVHTRKRVAIQFLKDIRESVTQIMKNPKAKTTGMGAIYGMAQATIDRKMVAEISSVFLDSLYSTDPVTQGNQMNGSPKPR,./data/raw/alphafold//AF-Q8CHN6-F1-model_v4.pdb,5388,3163,3902,4545 +2272,1713,1751,MANAITFFKLNTGAKFPSVGLGTWQASPGLVGDAVAAAVKIGYRHIDCAQIYGNEKEIGAVLKKLFEDRVVKREDLFITSKLWCTDHDPQDVPEALNRTLKDLQLEYVDLYLIHWPARIKKGSVGIKPENLLPVDIPSTWKAMEALYDSGKARAIGVSNFSTKKLADLLELARVPPAVNQVECHPSWRQTKLQEFCKSKGVHLSAYSPLGSPGTTWLKSDVLKNPILNMVAEKLGKSPAQVALRWGLQMGHSVLPKSTNEGRIKENFNVFDWSIPDYMFAKFAEIEQARLVTGSFLVHETLSPYKSIEELWDGEI,sabio,Q0PGJ6,CC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C,0.0085,25.0,7.0,1.1.1.-,3702.0,-2.070581074285707,-2.070581074285707,CC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C__MANAITFFKLNTGAKFPSVGLGTWQASPGLVGDAVAAAVKIGYRHIDCAQIYGNEKEIGAVLKKLFEDRVVKREDLFITSKLWCTDHDPQDVPEALNRTLKDLQLEYVDLYLIHWPARIKKGSVGIKPENLLPVDIPSTWKAMEALYDSGKARAIGVSNFSTKKLADLLELARVPPAVNQVECHPSWRQTKLQEFCKSKGVHLSAYSPLGSPGTTWLKSDVLKNPILNMVAEKLGKSPAQVALRWGLQMGHSVLPKSTNEGRIKENFNVFDWSIPDYMFAKFAEIEQARLVTGSFLVHETLSPYKSIEELWDGEI,./data/raw/alphafold//AF-Q0PGJ6-F1-model_v4.pdb,2022,2258,252,290 +2273,41099,41842,MSCPVIELTQQLIRRPSLSPDDAGCQALLIERLQAIGFTVERMDFADTQNFWAWRGQGETLAFAGHTDVVPPGDADRWINPPFEPTIRDGMLFGRGAADMKGSLAAMVVAAERFVAQHPNHTGRLAFLITSDEEASAHNGTVKVVEALMARNERLDYCLVGEPSSIEVVGDVVKNGRRGSLTCNLTIHGVQGHVAYPHLADNPVHRAAPFLNELVAIEWDQGNEFFPATSMQIANIQAGTGSNNVIPGELFVQFNFRFSTELTDEMIKAQVLALLEKHQLRYTVDWWLSGQPFLTARGKLVDAVVNAVEHYNEIKPQLLTTGGTSDGRFIARMGAQVVELGPVNATIHKINECVNAADLQLLARMYQRIMEQLVA,sabio,P0AED7,[Zn],0.0012,37.0,7.0,3.5.1.18,562.0,-2.920818753952376,-2.920818753952376,[Zn]__MSCPVIELTQQLIRRPSLSPDDAGCQALLIERLQAIGFTVERMDFADTQNFWAWRGQGETLAFAGHTDVVPPGDADRWINPPFEPTIRDGMLFGRGAADMKGSLAAMVVAAERFVAQHPNHTGRLAFLITSDEEASAHNGTVKVVEALMARNERLDYCLVGEPSSIEVVGDVVKNGRRGSLTCNLTIHGVQGHVAYPHLADNPVHRAAPFLNELVAIEWDQGNEFFPATSMQIANIQAGTGSNNVIPGELFVQFNFRFSTELTDEMIKAQVLALLEKHQLRYTVDWWLSGQPFLTARGKLVDAVVNAVEHYNEIKPQLLTTGGTSDGRFIARMGAQVVELGPVNATIHKINECVNAADLQLLARMYQRIMEQLVA,./data/raw/alphafold//AF-P0AED7-F1-model_v4.pdb,4651,5859,7584,8534 +2274,3024,3076,MRTYNTTLASLECDDETLRAHLQGADIPTLLLTVAHLTGDLNVLKPAWKPVVAMGVAHSGMTPEVEAEVREDCLQKLLAFRDSGLPVPARPSSEQLHALGTWLMGPVIEPYLPLVAEELVTAEEDPRAPRWHKDHVAAGREFKVVIIGAGVSGMIAALRFKQAGVPFVVYEKGTDVGGTWRENTYPGCRIDINSFFYSFSFARSTWDDCFAPGPQVFSYMQAVARDKGLYDHIQFNTEVTDAHWDEDRQRWQLLCRDSAGQTRVDSNVVVFAVGQLNRPMIPAIPGKETFQGPAFHSAQWDHNVDWSGKRVAVIGTGASAAQFIPQLAKTAADLKVFARTTNWLLPTPDLHEKISDSCKWLLANLPNYSLWYRATKVMPQSVGFLEDVVVDVDYPPTEVAVSARNDQLRRDICAWMEPQFADRPDLRNVLIPDSPVGSKRIIRDNGTWISTLKRDNVSMIRQPIEAIRPTGICCIDGTVHEFDLIVYGTGFHASKFLMPINITGRDGLALREVWKDDDARAYMGMTVPGFPNMFCMYGPNTGLVVYSTIIQFSEFTATYIVDAVRLLLEGGHQSMEIKAQVFESYNQRVDQANGLRAWGFSRVNSWYKNSKGRVTQNFPFNAVEFWHRTHEVQATDYCLS,brenda,B7T912,CC(=O)c1ccccc1,0.393,30.0,8.0,1.14.13.84,303.0,-0.4056074496245733,-0.4056074496245733,CC(=O)c1ccccc1__MRTYNTTLASLECDDETLRAHLQGADIPTLLLTVAHLTGDLNVLKPAWKPVVAMGVAHSGMTPEVEAEVREDCLQKLLAFRDSGLPVPARPSSEQLHALGTWLMGPVIEPYLPLVAEELVTAEEDPRAPRWHKDHVAAGREFKVVIIGAGVSGMIAALRFKQAGVPFVVYEKGTDVGGTWRENTYPGCRIDINSFFYSFSFARSTWDDCFAPGPQVFSYMQAVARDKGLYDHIQFNTEVTDAHWDEDRQRWQLLCRDSAGQTRVDSNVVVFAVGQLNRPMIPAIPGKETFQGPAFHSAQWDHNVDWSGKRVAVIGTGASAAQFIPQLAKTAADLKVFARTTNWLLPTPDLHEKISDSCKWLLANLPNYSLWYRATKVMPQSVGFLEDVVVDVDYPPTEVAVSARNDQLRRDICAWMEPQFADRPDLRNVLIPDSPVGSKRIIRDNGTWISTLKRDNVSMIRQPIEAIRPTGICCIDGTVHEFDLIVYGTGFHASKFLMPINITGRDGLALREVWKDDDARAYMGMTVPGFPNMFCMYGPNTGLVVYSTIIQFSEFTATYIVDAVRLLLEGGHQSMEIKAQVFESYNQRVDQANGLRAWGFSRVNSWYKNSKGRVTQNFPFNAVEFWHRTHEVQATDYCLS,./data/raw/alphafold//AF-B7T912-F1-model_v4.pdb,3464,958,1151,1418 +2275,23171,23526,MDAYNNPSAVESGDAAVKSVDDDGREKRTGTFWTASAHIITAVIGSGVLSLAWAIAQLGWVAGTTVLVAFAIITYYTSTLLADCYRSPDSITGTRNYNYMGVVRSYLGGKKVQLCGVAQYVNLVGVTIGYTITASISLVAIGKSNCYHDKGHKAKCSVSNYPYMAAFGIVQIILSQLPNFHKLSFLSIIAAVMSFSYASIGIGLAIATVASGKIGKTELTGTVIGVDVTASEKVWKLFQAIGDIAFSYAFTTILIEIQDTLRSSPPENKVMKRASLVGVSTTTVFYILCGCIGYAAFGNQAPGDFLTDFGFYEPYWLIDFANACIALHLIGAYQVYAQPFFQFVEENCNKKWPQSNFINKEYSSKVPLLGKCRVNLFRLVWRTCYVVLTTFVAMIFPFFNAILGLLGAFAFWPLTVYFPVAMHIAQAKVKKYSRRWLALNLLVLVCLIVSALAAVGSIIGLINSVKSYKPFKNLD,sabio,O80592,NC(CC(=O)O)C(=O)O,0.444,30.0,4.5,7.4.2.1,3702.0,-0.3526170298853802,-0.3526170298853802,NC(CC(=O)O)C(=O)O__MDAYNNPSAVESGDAAVKSVDDDGREKRTGTFWTASAHIITAVIGSGVLSLAWAIAQLGWVAGTTVLVAFAIITYYTSTLLADCYRSPDSITGTRNYNYMGVVRSYLGGKKVQLCGVAQYVNLVGVTIGYTITASISLVAIGKSNCYHDKGHKAKCSVSNYPYMAAFGIVQIILSQLPNFHKLSFLSIIAAVMSFSYASIGIGLAIATVASGKIGKTELTGTVIGVDVTASEKVWKLFQAIGDIAFSYAFTTILIEIQDTLRSSPPENKVMKRASLVGVSTTTVFYILCGCIGYAAFGNQAPGDFLTDFGFYEPYWLIDFANACIALHLIGAYQVYAQPFFQFVEENCNKKWPQSNFINKEYSSKVPLLGKCRVNLFRLVWRTCYVVLTTFVAMIFPFFNAILGLLGAFAFWPLTVYFPVAMHIAQAKVKKYSRRWLALNLLVLVCLIVSALAAVGSIIGLINSVKSYKPFKNLD,./data/raw/alphafold//AF-O80592-F1-model_v4.pdb,4653,5789,7489,8429 +2276,38,42,MWLRSHRQLCLAFLLVCVLSVIFFLHIHQDSFPHGLGLSILCPDRRLVTPPVAIFCLPGTAMGPNASSSCPQHPASLSGTWTVYPNGRFGNQMGQYATLLALAQLNGRRAFILPAMHAALAPVFRITLPVLAPEVDSRTPWRELQLHDWMSEEYADLRDPFLKLSGFPCSWTFFHHLREQIRREFTLHDHLREEAQSVLGQLRLGRTGDRPRTFVGVHVRRGDYLQVMPQRWKGVVGDSAYLRQAMDWFRARHEAPVFVVTSNGMEWCKENIDTSQGDVTFAGDGQEATPWKDFALLTQCNHTIMTIGTFGFWAAYLAGGDTVYLANFTLPDSEFLKIFKPEAAFLPEWVGINADLSPLWTLAKP,sabio,P19526,*C(=O)NC(COC1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3NC(C)=O)C(OC3(C(=O)O)CC(O)C(NC(C)=O)C(C(O)C(O)CO)O3)C2O)C(O)C1O)C(O)C=CCCCCCCCCCCCCC,0.082,37.0,6.5,2.4.1.344,9606.0,-1.0861861476162833,-1.0861861476162833,*C(=O)NC(COC1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3NC(C)=O)C(OC3(C(=O)O)CC(O)C(NC(C)=O)C(C(O)C(O)CO)O3)C2O)C(O)C1O)C(O)C=CCCCCCCCCCCCCC__MWLRSHRQLCLAFLLVCVLSVIFFLHIHQDSFPHGLGLSILCPDRRLVTPPVAIFCLPGTAMGPNASSSCPQHPASLSGTWTVYPNGRFGNQMGQYATLLALAQLNGRRAFILPAMHAALAPVFRITLPVLAPEVDSRTPWRELQLHDWMSEEYADLRDPFLKLSGFPCSWTFFHHLREQIRREFTLHDHLREEAQSVLGQLRLGRTGDRPRTFVGVHVRRGDYLQVMPQRWKGVVGDSAYLRQAMDWFRARHEAPVFVVTSNGMEWCKENIDTSQGDVTFAGDGQEATPWKDFALLTQCNHTIMTIGTFGFWAAYLAGGDTVYLANFTLPDSEFLKIFKPEAAFLPEWVGINADLSPLWTLAKP,./data/raw/alphafold//AF-P19526-F1-model_v4.pdb,3495,1005,17,19 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+2315,39491,40195,MLNETPALAPDGQPYRLLTLRNNAGMVVTLMDWGATLLSARIPLSDGSVREALLGCASPECYQDQAAFLGASIGRYANRIANSRYTFDGETVTLSPSQGVNQLHGGPEGFDKRRWQIVNQNDRQVLFALSSDDGDQGFPGNLGATVQYRLTDDNRISITYRATVDKPCPVNMTNHVYFNLDGEQSDVRNHKLQILADEYLPVDEGGIPHDGLKSVAGTSFDFRSAKIIASEFLADDDQRKVKGYDHAFLLQAKGDGKKVAAHVWSADEKLQLKVYTTAPALQFYSGNFLGGTPSRGTEPYADWQGLALESEFLPDSPNHPEWPQPDCFLRPGEEYSSLTEYQFIAE,brenda,P0A9C3,OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O,38.0,25.0,7.0,5.1.3.3,562.0,1.57978359661681,1.57978359661681,OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O__MLNETPALAPDGQPYRLLTLRNNAGMVVTLMDWGATLLSARIPLSDGSVREALLGCASPECYQDQAAFLGASIGRYANRIANSRYTFDGETVTLSPSQGVNQLHGGPEGFDKRRWQIVNQNDRQVLFALSSDDGDQGFPGNLGATVQYRLTDDNRISITYRATVDKPCPVNMTNHVYFNLDGEQSDVRNHKLQILADEYLPVDEGGIPHDGLKSVAGTSFDFRSAKIIASEFLADDDQRKVKGYDHAFLLQAKGDGKKVAAHVWSADEKLQLKVYTTAPALQFYSGNFLGGTPSRGTEPYADWQGLALESEFLPDSPNHPEWPQPDCFLRPGEEYSSLTEYQFIAE,./data/raw/alphafold//AF-P0A9C3-F1-model_v4.pdb,2613,8289,10189,11398 +2316,20015,20313,MANDASTVFDLVILGGGSGGYAAALRGAQLGLDVALIEKDKVGGTCLHKGCIPTKALLHAGEIADQARESEQFGVKATFEGIDVPAVQKYKDDVISGLYKGLQGLIASRKVTYIEGEGRLSSPTSVDVNGQRIEGRHVLLATGSVPKSLPGLQIDGDRIISSDHALVLDRVPKSAIILGGGVIGVEFASAWKSFGADVTVIEGLKHLVPVEDENSSKLLERAFRKRGIKFSLGTFFEKAEYTQDGVKVTLADGKEFEAEVLLVAVGRGPVSQNLGYEEQGVNIDRGYVLVDEYMRTNVPTISAVGDLVPTLQLAHVGFAEGILVAERLAGLKTVPIDYDGVPRVTYCHPEVASVGITEAKAKEIYGADKVVALKYSLAGNGKSKILKTAGEIKLVQVKDGAVVGVHMVGDRMGEQVGEAQLIYNWEALPAEVAQLIHAHPTQNEALGEAHLALAGKPLHAHD,uniprot_search,Q9Z6I5,N=C(O)CCCCC1CCSS1,0.37,,,1.8.1.4,73044.0,-0.431798275933005,-0.431798275933005,N=C(O)CCCCC1CCSS1__MANDASTVFDLVILGGGSGGYAAALRGAQLGLDVALIEKDKVGGTCLHKGCIPTKALLHAGEIADQARESEQFGVKATFEGIDVPAVQKYKDDVISGLYKGLQGLIASRKVTYIEGEGRLSSPTSVDVNGQRIEGRHVLLATGSVPKSLPGLQIDGDRIISSDHALVLDRVPKSAIILGGGVIGVEFASAWKSFGADVTVIEGLKHLVPVEDENSSKLLERAFRKRGIKFSLGTFFEKAEYTQDGVKVTLADGKEFEAEVLLVAVGRGPVSQNLGYEEQGVNIDRGYVLVDEYMRTNVPTISAVGDLVPTLQLAHVGFAEGILVAERLAGLKTVPIDYDGVPRVTYCHPEVASVGITEAKAKEIYGADKVVALKYSLAGNGKSKILKTAGEIKLVQVKDGAVVGVHMVGDRMGEQVGEAQLIYNWEALPAEVAQLIHAHPTQNEALGEAHLALAGKPLHAHD,./data/raw/alphafold//AF-Q9Z6I5-F1-model_v4.pdb,3281,5054,6952,6949 +2317,20319,20626,MDTVCIAVVGAGVIGLSTAACISQLVPGCTVTVISDRFTPDTTSNVAAGMLIPHTYADTPVPTQKRWFRETFEHLSEIAKSAEAADAGVHLVSGWQIFHSVPAEEVPFWADVVLGFRKMTEAELKRFPQYVFGQAFTTLKCETSAYLPWLERRIKGSGGLLLTWRIEDLWELQPSFDIVVNCSGLGSRRLVGDPMISPVRGQVLQARAPWVKHFIRDGGGLTYVYPGMSYVTLGGTRQKGDWNRSPDAELSREIFSRCCTLEPSLHRAYDIKEKVGLRPSRPGVRLQKEILVRGQQTLPVVHNYGHGSGGISVHWGSALEATRLVMECIHTLRTPASLSKL,brenda,Q0E9Q7,N=C(O)C[C@@H](N)C(=O)O,101.4,25.0,8.3,1.4.3.1,10090.0,2.0060379549973173,2.0060379549973173,N=C(O)C[C@@H](N)C(=O)O__MDTVCIAVVGAGVIGLSTAACISQLVPGCTVTVISDRFTPDTTSNVAAGMLIPHTYADTPVPTQKRWFRETFEHLSEIAKSAEAADAGVHLVSGWQIFHSVPAEEVPFWADVVLGFRKMTEAELKRFPQYVFGQAFTTLKCETSAYLPWLERRIKGSGGLLLTWRIEDLWELQPSFDIVVNCSGLGSRRLVGDPMISPVRGQVLQARAPWVKHFIRDGGGLTYVYPGMSYVTLGGTRQKGDWNRSPDAELSREIFSRCCTLEPSLHRAYDIKEKVGLRPSRPGVRLQKEILVRGQQTLPVVHNYGHGSGGISVHWGSALEATRLVMECIHTLRTPASLSKL,./data/raw/alphafold//AF-Q0E9Q7-F1-model_v4.pdb,2126,5644,4637,4912 +2318,15476,15696,MANEVIKCKAAVAWEAGKPLSIEEIEVAPPKAHEVRIKIIATAVCHTDAYTLSGADPEGCFPVILGHEGAGIVESVGEGVTKLKAGDTVIPLYIPQCGECKFCLNPKTNLCQKIRVTQGKGLMPDGTSRFTCKGKTILHYMGTSTFSEYTVVADISVAKIDPLAPLDKVCLLGCGISTGYGAAVNTAKLEPGSVCAVFGLGGVGLAVIMGCKVAGASRIIGVDINKDKFARAKEFGATECINPQDFSKPIQEVLIEMTDGGVDYSFECIGNVKVMRAALEACHKGWGVSVVVGVAASGEEIATRPFQLVTGRTWKGTAFGGWKSVESVPKLVSEYMSKKIKVDEFVTHNLSFDEINKAFELMHSGKSIRTVVKI,sabio,P11766,C[C@H](CCCO)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C,0.2,25.0,10.0,1.1.1.1,9606.0,-0.6989700043360187,-0.6989700043360187,C[C@H](CCCO)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C__MANEVIKCKAAVAWEAGKPLSIEEIEVAPPKAHEVRIKIIATAVCHTDAYTLSGADPEGCFPVILGHEGAGIVESVGEGVTKLKAGDTVIPLYIPQCGECKFCLNPKTNLCQKIRVTQGKGLMPDGTSRFTCKGKTILHYMGTSTFSEYTVVADISVAKIDPLAPLDKVCLLGCGISTGYGAAVNTAKLEPGSVCAVFGLGGVGLAVIMGCKVAGASRIIGVDINKDKFARAKEFGATECINPQDFSKPIQEVLIEMTDGGVDYSFECIGNVKVMRAALEACHKGWGVSVVVGVAASGEEIATRPFQLVTGRTWKGTAFGGWKSVESVPKLVSEYMSKKIKVDEFVTHNLSFDEINKAFELMHSGKSIRTVVKI,./data/raw/alphafold//AF-P11766-F1-model_v4.pdb,5403,3181,791,962 +2319,13370,13564,MATAVRLLGRRVSSWRLRPLPSPLAVPQRAHSMLPVDDDINGLNEEQKQLRHTISKFVQENLAPKAQEIDQSNDFKNLREFWKQLGSLGVLGITAPVQYGGSGLGYLEHVLVMEEISRASAAVGLSYGAHSNLCINQIVRNGNEAQKEKYLPKLISGEFIGALAMSEPNAGSDVVSMRLKAEKKGDHYVLNGNKFWITNGPDADVLVVYAKTDLTAVPASRGITAFIVEKDMPGFSTSKKLDKLGMRGSNTCELVFEDCKVPAANILSQESKGVYVLMSGLDLERLVLAGGPLGIMQAVLDHTIPYLHVREAFGQKIGQFQLMQGKMADMYTRLMACRQYVYNVARACDEGHITAKDCAGVILYTAECATQVALDGIQCLGGNGYINDFPMGRFLRDAKLYEIGGGTSEVRRLVIGRAFNADFR,sabio,P12007,COS(=O)(=O)[O-].C[n+]1c2ccccc2nc2ccccc21,0.51,32.0,8.0,1.3.8.4,10116.0,-0.2924298239020636,-0.2924298239020636,COS(=O)(=O)[O-].C[n+]1c2ccccc2nc2ccccc21__MATAVRLLGRRVSSWRLRPLPSPLAVPQRAHSMLPVDDDINGLNEEQKQLRHTISKFVQENLAPKAQEIDQSNDFKNLREFWKQLGSLGVLGITAPVQYGGSGLGYLEHVLVMEEISRASAAVGLSYGAHSNLCINQIVRNGNEAQKEKYLPKLISGEFIGALAMSEPNAGSDVVSMRLKAEKKGDHYVLNGNKFWITNGPDADVLVVYAKTDLTAVPASRGITAFIVEKDMPGFSTSKKLDKLGMRGSNTCELVFEDCKVPAANILSQESKGVYVLMSGLDLERLVLAGGPLGIMQAVLDHTIPYLHVREAFGQKIGQFQLMQGKMADMYTRLMACRQYVYNVARACDEGHITAKDCAGVILYTAECATQVALDGIQCLGGNGYINDFPMGRFLRDAKLYEIGGGTSEVRRLVIGRAFNADFR,./data/raw/alphafold//AF-P12007-F1-model_v4.pdb,5051,1878,1522,2844 +2320,8273,8413,MATIRPDDKAIDAAARHYGITLDKTARLEWPALIDGALGSYDVVDQLYADEATPPTTSREHAVPSASENPLSAWYVTTSIPPTSDGVLTGRRVAIKDNVTVAGVPMMNGSRTVEGFTPSRDATVVTRLLAAGATVAGKAVCEDLCFSGSSFTPASGPVRNPWDRQREAGGSSGGSAALVANGDVDFAIGGDQGGSIRIPAAFCGVVGHKPTFGLVPYTGAFPIERTIDHLGPITRTVHDAALMLSVIAGRDGNDPRQADSVEAGDYLSTLDSDVDGLRIGIVREGFGHAVSQPEVDDAVRAAAHSLTEIGCTVEEVNIPWHLHAFHIWNVIATDGGAYQMLDGNGYGMNAEGLYDPELMAHFASRRIQHADALSETVKLVALTGHHGITTLGGASYGKARNLVPLARAAYDTALRQFDVLVMPTLPYVASELPAKDVDRATFITKALGMIANTAPFDVTGHPSLSVPAGLVNGLPVGMMITGRHFDDATVLRVGRAFEKLRGAFPTPAERASNSAPQLSPA,brenda,Q7DKE4,CCC(=N)O,34.2,55.0,5.9,3.5.1.4,1833.0,1.534026106056135,1.534026106056135,CCC(=N)O__MATIRPDDKAIDAAARHYGITLDKTARLEWPALIDGALGSYDVVDQLYADEATPPTTSREHAVPSASENPLSAWYVTTSIPPTSDGVLTGRRVAIKDNVTVAGVPMMNGSRTVEGFTPSRDATVVTRLLAAGATVAGKAVCEDLCFSGSSFTPASGPVRNPWDRQREAGGSSGGSAALVANGDVDFAIGGDQGGSIRIPAAFCGVVGHKPTFGLVPYTGAFPIERTIDHLGPITRTVHDAALMLSVIAGRDGNDPRQADSVEAGDYLSTLDSDVDGLRIGIVREGFGHAVSQPEVDDAVRAAAHSLTEIGCTVEEVNIPWHLHAFHIWNVIATDGGAYQMLDGNGYGMNAEGLYDPELMAHFASRRIQHADALSETVKLVALTGHHGITTLGGASYGKARNLVPLARAAYDTALRQFDVLVMPTLPYVASELPAKDVDRATFITKALGMIANTAPFDVTGHPSLSVPAGLVNGLPVGMMITGRHFDDATVLRVGRAFEKLRGAFPTPAERASNSAPQLSPA,./data/raw/alphafold//AF-Q7DKE4-F1-model_v4.pdb,3096,568,661,791 +2321,10049,10202,MAIYRSLRKLVEINHRKTRPFFTAATASGGTVSLTPPQFSPLFPHFSHRLSPLSKWFVPLNGPLFLSSPPWKLLQSATPLHWRGNGSVLKKVEALNLRLDRIRSRTRFPRQLGLQSVVPNILTVDRNDSKEEDGGKLVKSFVNVPNMISMARLVSGPVLWWMISNEMYSSAFLGLAVSGASDWLDGYVARRMKINSVVGSYLDPLADKVLIGCVAVAMVQKDLLHPGLVGIVLLRDVALVGGAVYLRALNLDWKWKTWSDFFNLDGSSPQKVEPLFISKVNTVFQLTLVAGAILQPEFGNPDTQTWITYLSWLVASTTMASTAAYGVQYWKKRPISMIKRS,brenda,Q93YW7,CCCCCCCC/C=C/CCCCCCCC(=O)OCC(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2ccc(=N)nc2O)[C@H](O)[C@@H]1O)OC(=O)CCCCCCC/C=C/CCCCCCCC,0.0014,30.0,8.8,2.7.8.41,3702.0,-2.853871964321762,-2.853871964321762,CCCCCCCC/C=C/CCCCCCCC(=O)OCC(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2ccc(=N)nc2O)[C@H](O)[C@@H]1O)OC(=O)CCCCCCC/C=C/CCCCCCCC__MAIYRSLRKLVEINHRKTRPFFTAATASGGTVSLTPPQFSPLFPHFSHRLSPLSKWFVPLNGPLFLSSPPWKLLQSATPLHWRGNGSVLKKVEALNLRLDRIRSRTRFPRQLGLQSVVPNILTVDRNDSKEEDGGKLVKSFVNVPNMISMARLVSGPVLWWMISNEMYSSAFLGLAVSGASDWLDGYVARRMKINSVVGSYLDPLADKVLIGCVAVAMVQKDLLHPGLVGIVLLRDVALVGGAVYLRALNLDWKWKTWSDFFNLDGSSPQKVEPLFISKVNTVFQLTLVAGAILQPEFGNPDTQTWITYLSWLVASTTMASTAAYGVQYWKKRPISMIKRS,./data/raw/alphafold//AF-Q93YW7-F1-model_v4.pdb,5505,3040,3766,4377 +2322,7300,7431,MRFIRLCIISLLATLPLAVHASPQPLEQIKLSESQLSGRVGMIEMDLASGRTLTAWRADERFPMMSTFKVVLCGAVLARVDAGDEQLERKIHYRQQDLVDYSPVSEKHLADGMTVGELCAAAITMSDNSAANLLLATVGGPAGLTAFLRQIGDNVTRLDRWETELNEALPGDARDTTTPASMAATLRKLLTSQRLSARSQRQLLQWMVDDRVAGPLIRSVLPAGWFIADKTGASKRGARGIVALLGPNNKAERIVVIYLRDTPASMAERNQQIAGIGAALIEHWQR,brenda,Q4TVR4,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O,0.005,30.0,7.0,3.5.2.6,573.0,-2.3010299956639813,-2.3010299956639813,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O__MRFIRLCIISLLATLPLAVHASPQPLEQIKLSESQLSGRVGMIEMDLASGRTLTAWRADERFPMMSTFKVVLCGAVLARVDAGDEQLERKIHYRQQDLVDYSPVSEKHLADGMTVGELCAAAITMSDNSAANLLLATVGGPAGLTAFLRQIGDNVTRLDRWETELNEALPGDARDTTTPASMAATLRKLLTSQRLSARSQRQLLQWMVDDRVAGPLIRSVLPAGWFIADKTGASKRGARGIVALLGPNNKAERIVVIYLRDTPASMAERNQQIAGIGAALIEHWQR,./data/raw/alphafold//AF-Q4TVR4-F1-model_v4.pdb,5,1145,1863,3887 +2323,16680,16921,MSDSDLEFDVIVAGSGGGLAGAYTAARENLSVLLVEATDLFGGTTSFSGGGGMWFPCNPVLQRAGTDDTIDKALTYFHAVVGERTPRELQDAYVRGGAKLIEYLEQDPAFEFTALPWPDYYGTAPEARTDGYRHTIPLPVPDAALGKYAGLVRGPLDTERLGAEAPDLLVGGRALVGRFLAALDKLPTVTCWLNAPLVDLITENGRVVGAVIERDGAPVRVTTRRGVLLASGGFEQNAEMRAEYGVPGHATDSMGGPGSTGRAHRAAIAVGADVDLMDQAWWSPGMTHPDGRSAFALWFTGGIFVNQQGRRFVNESAPYDRIGRDIIDQMQNGSTRLPFWMIYDNRDGDIPPVKATNVSMVEPEKYRTAGLWHSADTLAELAGAIGVPAAELEATVARYNELAATGIDDDFGRGGEAYDRAFSGGESPMVPLDTPPYHAAVFGLSDLGTKGGLRTDTHARVLDADGAAIPGLYAAGNTMAAVSGTTYPGGGNPIGASMLFSHLAALDMATQSSAE,brenda,W0NUN5,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O,0.085,30.0,7.0,1.3.99.4,1795.0,-1.0705810742857071,-1.0705810742857071,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O__MSDSDLEFDVIVAGSGGGLAGAYTAARENLSVLLVEATDLFGGTTSFSGGGGMWFPCNPVLQRAGTDDTIDKALTYFHAVVGERTPRELQDAYVRGGAKLIEYLEQDPAFEFTALPWPDYYGTAPEARTDGYRHTIPLPVPDAALGKYAGLVRGPLDTERLGAEAPDLLVGGRALVGRFLAALDKLPTVTCWLNAPLVDLITENGRVVGAVIERDGAPVRVTTRRGVLLASGGFEQNAEMRAEYGVPGHATDSMGGPGSTGRAHRAAIAVGADVDLMDQAWWSPGMTHPDGRSAFALWFTGGIFVNQQGRRFVNESAPYDRIGRDIIDQMQNGSTRLPFWMIYDNRDGDIPPVKATNVSMVEPEKYRTAGLWHSADTLAELAGAIGVPAAELEATVARYNELAATGIDDDFGRGGEAYDRAFSGGESPMVPLDTPPYHAAVFGLSDLGTKGGLRTDTHARVLDADGAAIPGLYAAGNTMAAVSGTTYPGGGNPIGASMLFSHLAALDMATQSSAE,./data/raw/alphafold//AF-W0NUN5-F1-model_v4.pdb,3745,1434,2218,2137 +2324,8129,8267,MDTKHQDKPSILMLPWLAHGHIAPHLELAKKLSQKNFHIYFCSTPNNLQSFGRNVEKNFSSSIQLIELQLPNTFPELPSQNQTTKNLPPHLIYTLVGAFEDAKPAFCNILETLKPTLVMYDLFQPWAAEAAYQYDIAAILFLPLSAVACSFLLHNIVNPSLKYPFFESDYQDRESKNINYFLHLTANGTLNKDRFLKAFELSCKFVFIKTSREIESKYLDYFPSLMGNEIIPVGPLIQEPTFKEDDTKIMDWLSQKEPRSVVYASFGSEYFPSKDEIHEIASGLLLSEVNFIWAFRLHPDEKMTIEEALPQGFAEEIERNNKGMIVQGWVPQAKILRHGSIGGFLSHCGWGSVVEGMVFGVPIIGVPMAYEQPSNAKVVVDNGMGMVVPRDKINQRLGGEEVARVIKHVVLQEEAKQIRRKANEISESMKKIGDAEMSVVVEKLLQLVKKSE,sabio,Q8GVE3,CC1OC(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)C(O)C(O)C1O,0.0013,37.0,7.5,2.4.1.236,37334.0,-2.886056647693163,-2.922331981267469,CC1OC(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)C(O)C(O)C1O__MDTKHQDKPSILMLPWLAHGHIAPHLELAKKLSQKNFHIYFCSTPNNLQSFGRNVEKNFSSSIQLIELQLPNTFPELPSQNQTTKNLPPHLIYTLVGAFEDAKPAFCNILETLKPTLVMYDLFQPWAAEAAYQYDIAAILFLPLSAVACSFLLHNIVNPSLKYPFFESDYQDRESKNINYFLHLTANGTLNKDRFLKAFELSCKFVFIKTSREIESKYLDYFPSLMGNEIIPVGPLIQEPTFKEDDTKIMDWLSQKEPRSVVYASFGSEYFPSKDEIHEIASGLLLSEVNFIWAFRLHPDEKMTIEEALPQGFAEEIERNNKGMIVQGWVPQAKILRHGSIGGFLSHCGWGSVVEGMVFGVPIIGVPMAYEQPSNAKVVVDNGMGMVVPRDKINQRLGGEEVARVIKHVVLQEEAKQIRRKANEISESMKKIGDAEMSVVVEKLLQLVKKSE,./data/raw/alphafold//AF-Q8GVE3-F1-model_v4.pdb,1806,2818,3497,4055 +2325,11482,11645,MSTAGKVIKCKAAVLWELHKPFTIEDIEVAPPKAHEVRIKMVATGVCRSDDHVVSGTLVTPLPAVLGHEGAGIVESVGEGVTCVKPGDKVIPLFSPQCGECRICKHPESNFCSRSDLLMPRGTLREGTSRFSCKGKQIHNFISTSTFSQYTVVDDIAVAKIDGASPLDKVCLIGCGFSTGYGSAVKVAKVTPGSTCAVFGLGGVGLSVIIGCKAAGAARIIAVDINKDKFAKAKELGATECINPQDYSKPIQEVLQEMTDGGVDFSFEVIGRLDTMTSALLSCHAACGVSVVVGVPPNAQNLSMNPMLLLLGRTWKGAIFGGFKSKDSVPKLVADFMAKKFPLDPLITHVLPFEKINEAFDLLRSGKSIRTVLTF,sabio,P00329,CCO,0.48,25.0,7.5,1.1.1.1,10090.0,-0.3187587626244128,-0.1998403351241695,CCO__MSTAGKVIKCKAAVLWELHKPFTIEDIEVAPPKAHEVRIKMVATGVCRSDDHVVSGTLVTPLPAVLGHEGAGIVESVGEGVTCVKPGDKVIPLFSPQCGECRICKHPESNFCSRSDLLMPRGTLREGTSRFSCKGKQIHNFISTSTFSQYTVVDDIAVAKIDGASPLDKVCLIGCGFSTGYGSAVKVAKVTPGSTCAVFGLGGVGLSVIIGCKAAGAARIIAVDINKDKFAKAKELGATECINPQDYSKPIQEVLQEMTDGGVDFSFEVIGRLDTMTSALLSCHAACGVSVVVGVPPNAQNLSMNPMLLLLGRTWKGAIFGGFKSKDSVPKLVADFMAKKFPLDPLITHVLPFEKINEAFDLLRSGKSIRTVLTF,./data/raw/alphafold//AF-P00329-F1-model_v4.pdb,5403,3181,1064,3221 +2326,8106,8243,MACTGWTSPLPLCVCLLLTCGFAEAGKLLVVPMDGSHWFTMRSVVEKLILRGHEVVVVMPEVSWQLGRSLNCTVKTYSTSYTLEDLDREFKAFAHAQWKAQVRSIYSLLMGSYNDIFDLFFSNCRSLFKDKKLVEYLKESSFDAVFLDPFDNCGLIVAKYFSLPSVVFARGILCHYLEEGAQCPAPLSYVPRILLGFSDAMTFKERVRNHIMHLEEHLLCHRFFKNALEIASEILQTPVTEYDLYSHTSIWLLRTDFVLDYPKPVMPNMIFIGGINCHQGKPLPMEFEAYINASGEHGIVVFSLGSMVSEIPEKKAMAIADALGKIPQTVLWRYTGTRPSNLANNTILVKWLPQNDLLGHPMTRAFITHAGSHGVYESICNGVPMVMMPLFGDQMDNAKRMETKGAGVTLNVLEMTSEDLENALKAVINDKSYKENIMRLSSLHKDRPVEPLDLAVFWVEFVMRHKGAPHLRPAAHDLTWYQYHSLDVIGFLLAVVLTVAFITFKCCAYGYRKCLGKKGRVKKAHKSKTH,sabio,O60656,CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23,2.6,37.0,7.4,2.4.1.17,9606.0,0.414973347970818,0.414973347970818,CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23__MACTGWTSPLPLCVCLLLTCGFAEAGKLLVVPMDGSHWFTMRSVVEKLILRGHEVVVVMPEVSWQLGRSLNCTVKTYSTSYTLEDLDREFKAFAHAQWKAQVRSIYSLLMGSYNDIFDLFFSNCRSLFKDKKLVEYLKESSFDAVFLDPFDNCGLIVAKYFSLPSVVFARGILCHYLEEGAQCPAPLSYVPRILLGFSDAMTFKERVRNHIMHLEEHLLCHRFFKNALEIASEILQTPVTEYDLYSHTSIWLLRTDFVLDYPKPVMPNMIFIGGINCHQGKPLPMEFEAYINASGEHGIVVFSLGSMVSEIPEKKAMAIADALGKIPQTVLWRYTGTRPSNLANNTILVKWLPQNDLLGHPMTRAFITHAGSHGVYESICNGVPMVMMPLFGDQMDNAKRMETKGAGVTLNVLEMTSEDLENALKAVINDKSYKENIMRLSSLHKDRPVEPLDLAVFWVEFVMRHKGAPHLRPAAHDLTWYQYHSLDVIGFLLAVVLTVAFITFKCCAYGYRKCLGKKGRVKKAHKSKTH,./data/raw/alphafold//AF-O60656-F1-model_v4.pdb,681,535,1055,1298 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+2349,15050,15263,MVLGRGSLCLRSLSVLGAACARRGLGQALLGLSLCHTDFRKNLTVQQDMMKIELLPALTDNYMYLIIDEDTQEAAVVDPVQPQKVIETVKKHRVKLTTVLTTHHHWDHAGGNEKLVKLEPGLKVYGGDDRIGALTHKVTHLSTLEVGSLSVKCLSTPCHTSGHICYFVSKPGSSEPSAVFTGDTLFVAGCGKFYEGTADEMYKALLEVLGRLPPDTKVICGHEYTVNNLKFARHVEPGNTAVQEKLAWAKEKNAIGEPTVPSTLAEEFTYNPFMRVKEKTVQQHAGETDPVTTMRAIRREKDQFKVPRD,uniprot_search,O35952,C[C@@H](O)C(=O)SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=O)O,0.44,37.0,7.25,3.1.2.6,10116.0,-0.3565473235138126,0.1792490972597601,C[C@@H](O)C(=O)SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=O)O__MVLGRGSLCLRSLSVLGAACARRGLGQALLGLSLCHTDFRKNLTVQQDMMKIELLPALTDNYMYLIIDEDTQEAAVVDPVQPQKVIETVKKHRVKLTTVLTTHHHWDHAGGNEKLVKLEPGLKVYGGDDRIGALTHKVTHLSTLEVGSLSVKCLSTPCHTSGHICYFVSKPGSSEPSAVFTGDTLFVAGCGKFYEGTADEMYKALLEVLGRLPPDTKVICGHEYTVNNLKFARHVEPGNTAVQEKLAWAKEKNAIGEPTVPSTLAEEFTYNPFMRVKEKTVQQHAGETDPVTTMRAIRREKDQFKVPRD,./data/raw/alphafold//AF-O35952-F1-model_v4.pdb,5797,957,3256,1416 +2350,35390,36009,MNLEKLEVSHDADSLCVVIEISKHSNIKYELDKESGALMVDRVLYGAQNYPANYGFVPNTLGSDGDPVDALVLSDVAFQAGSVVKARLVGVLNMEDESGMDEKLIALPIDKIDPTHSYVKDIDDLSKHTLDKIKHFFETYKDLEPNKWVKVKGFENKESAIKVLEKAIKAYQG,brenda,P56153,O=P(O)(O)OP(=O)(O)O,0.083,37.0,8.0,3.6.1.1,210.0,-1.080921907623926,-0.8752540671373676,O=P(O)(O)OP(=O)(O)O__MNLEKLEVSHDADSLCVVIEISKHSNIKYELDKESGALMVDRVLYGAQNYPANYGFVPNTLGSDGDPVDALVLSDVAFQAGSVVKARLVGVLNMEDESGMDEKLIALPIDKIDPTHSYVKDIDDLSKHTLDKIKHFFETYKDLEPNKWVKVKGFENKESAIKVLEKAIKAYQG,./data/raw/alphafold//AF-P56153-F1-model_v4.pdb,2290,7844,9656,10803 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+2352,30791,31339,MENGATTTSTITIKGILSLLMESITTEEDEGGKRVISLGMGDPTLYSCFRTTQVSLQAVSDSLLSNKFHGYSPTVGLPQARRAIAEYLSRDLPYKLSQDDVFITSGCTQAIDVALSMLARPRANILLPRPGFPIYELCAKFRHLEVRYVDLLPENGWEIDLDAVEALADENTVALVVINPGNPCGNVYSYQHLMKIAESAKKLGFLVIADEVYGHLAFGSKPFVPMGVFGSIVPVLTLGSLSKRWIVPGWRLGWFVTTDPSGSFKDPKIIERFKKYFDILGGPATFIQAAVPTILEQTDESFFKKTLNSLKNSSDICCDWIKEIPCIDSSHRPEGSMAMMVKLNLSLLEDVSDDIDFCFKLAREESVILLPGTAVGLKNWLRITFAADATSIEEAFKRIKCFYLRHAKTQYPTI,brenda,Q9FN30,O=C(O)CCC(=O)C(=O)O,7.62,30.0,8.5,2.6.1.5,3702.0,0.8819549713396005,0.8819549713396005,O=C(O)CCC(=O)C(=O)O__MENGATTTSTITIKGILSLLMESITTEEDEGGKRVISLGMGDPTLYSCFRTTQVSLQAVSDSLLSNKFHGYSPTVGLPQARRAIAEYLSRDLPYKLSQDDVFITSGCTQAIDVALSMLARPRANILLPRPGFPIYELCAKFRHLEVRYVDLLPENGWEIDLDAVEALADENTVALVVINPGNPCGNVYSYQHLMKIAESAKKLGFLVIADEVYGHLAFGSKPFVPMGVFGSIVPVLTLGSLSKRWIVPGWRLGWFVTTDPSGSFKDPKIIERFKKYFDILGGPATFIQAAVPTILEQTDESFFKKTLNSLKNSSDICCDWIKEIPCIDSSHRPEGSMAMMVKLNLSLLEDVSDDIDFCFKLAREESVILLPGTAVGLKNWLRITFAADATSIEEAFKRIKCFYLRHAKTQYPTI,./data/raw/alphafold//AF-Q9FN30-F1-model_v4.pdb,422,3642,4973,5285 +2353,14865,15078,MASGTTTTAVKIGIIGGTGLDDPEILEGRTEKYVDTPFGKPSDALILGKIKNVDCVLLARHGRQHTIMPSKVNYQANIWALKEEGCTHVIVTTACGSLREEIQPGDIVIIDQFIDRTTMRPQSFYDGSHSCARGVCHIPMAEPFCPKTREVLIETAKKLGLRCHSKGTMVTIEGPRFSSRAESFMFRTWGADVINMTTVPEVVLAKEAGICYASIAMATDYDCWKEHEEAVSVDRVLKTLKENANKAKSLLLTTIPQIGSTEWSETLHNLKNMAQFSVLLPRH,brenda,Q13126,CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,0.005,25.0,7.0,2.4.2.28,9606.0,-2.3010299956639813,-2.3010299956639813,CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MASGTTTTAVKIGIIGGTGLDDPEILEGRTEKYVDTPFGKPSDALILGKIKNVDCVLLARHGRQHTIMPSKVNYQANIWALKEEGCTHVIVTTACGSLREEIQPGDIVIIDQFIDRTTMRPQSFYDGSHSCARGVCHIPMAEPFCPKTREVLIETAKKLGLRCHSKGTMVTIEGPRFSSRAESFMFRTWGADVINMTTVPEVVLAKEAGICYASIAMATDYDCWKEHEEAVSVDRVLKTLKENANKAKSLLLTTIPQIGSTEWSETLHNLKNMAQFSVLLPRH,./data/raw/alphafold//AF-Q13126-F1-model_v4.pdb,420,2820,3499,4057 +2354,39164,39862,QCCDHMHATAAVGTTHQALLWGSKWALRNKTTPKDGEVWWSNPQPGWKEVYDDEWEEWFMEQEGPTGVNGVRGEWYRRMTDGYILVGGPKLNSPDMNSTGTTMRTVHSYRIPSIVEVGGVLMCVGDARYITSTDYFFTDTVAAYSTDGGRTWKREVIIPNGRVDAHYSRVVDPTVVAKGNNIYVLVGRYNVTRGYWHNKNNRAGVADWEPFVYKGTVNVGTKDNATDVSISWERTALKSLYNFPVSGSPGTQFLGGAGGGVVTSNGTIVLPVQARNKANRVVSMILYSADDGKSWHFGKGEAGVGTSEAALTEWDGKLLISARSDGGQGYRMIFESSDLGATWKEMLNSISRVIGNSPGRSGPGSSSGFITVTVEGVPVMLLTHPKNFKGSYYRDRLQMWMTDGNRMWHVGQVSEGDDNSAYSSLLYTPDGVLYCLHEQNIDEVYSLHLVRLVDELKSIKSTALVWKAQDELLLGNCLPGDKYDPGCDGIPTAGLAGLLVGPLTEKTWPDAYRCVNAATSGAVSTAEGVRLDVGGGGHVVWPVSEQGQDQRYYFTNSEFTLAVTVRFDEMPHGELPLLGFVNRKDQVKKILKVSLSGVEWLLAYGNEYNSTAAEPLNVNESHQVVLTLHDGIVSLHVDGGNMTATVSVRVASPAELLNIHHLFVGTPVDGGAKEHANITVSNVLVYNRPLRGVELLGLFANR,sabio,G0WJG7,OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O,0.727,37.0,7.4,3.2.1.18,5692.0,-0.1384655891409622,-0.1384655891409622,OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O__QCCDHMHATAAVGTTHQALLWGSKWALRNKTTPKDGEVWWSNPQPGWKEVYDDEWEEWFMEQEGPTGVNGVRGEWYRRMTDGYILVGGPKLNSPDMNSTGTTMRTVHSYRIPSIVEVGGVLMCVGDARYITSTDYFFTDTVAAYSTDGGRTWKREVIIPNGRVDAHYSRVVDPTVVAKGNNIYVLVGRYNVTRGYWHNKNNRAGVADWEPFVYKGTVNVGTKDNATDVSISWERTALKSLYNFPVSGSPGTQFLGGAGGGVVTSNGTIVLPVQARNKANRVVSMILYSADDGKSWHFGKGEAGVGTSEAALTEWDGKLLISARSDGGQGYRMIFESSDLGATWKEMLNSISRVIGNSPGRSGPGSSSGFITVTVEGVPVMLLTHPKNFKGSYYRDRLQMWMTDGNRMWHVGQVSEGDDNSAYSSLLYTPDGVLYCLHEQNIDEVYSLHLVRLVDELKSIKSTALVWKAQDELLLGNCLPGDKYDPGCDGIPTAGLAGLLVGPLTEKTWPDAYRCVNAATSGAVSTAEGVRLDVGGGGHVVWPVSEQGQDQRYYFTNSEFTLAVTVRFDEMPHGELPLLGFVNRKDQVKKILKVSLSGVEWLLAYGNEYNSTAAEPLNVNESHQVVLTLHDGIVSLHVDGGNMTATVSVRVASPAELLNIHHLFVGTPVDGGAKEHANITVSNVLVYNRPLRGVELLGLFANR,./data/raw/alphafold//AF-G0WJG7-F1-model_v4.pdb,3496,2772,3448,3987 +2355,18416,18680,MSPNPTNIHTGKTLRLLYHPASQPCRSAHQFMYEIDVPFEEEVVDISTDITERQEFRDKYNPTGQVPILVDGEFTVWESVAIARYVNEKFDGAGNWFGRGTQERAQINQFLQWYAYTLRLGGGAFHWNIFGCLIYGEKPYSPKFTAEQNKGRTLLYEAMGTLENYWLRDREYVCGDEVSYADLAAFHEFVSHEAGKIIPDRVWQGFPKIAAWFKKLSERPHAKTVSEWQYTNVGKIIRGELTASMFKRKTAVLKGTEVFSGHNHGIPYLNEKAEDYFKRVEKEGAAVA,brenda,P21161,ClCCl,0.02,37.0,7.0,4.5.1.3,408.0,-1.6989700043360187,-1.872363747448347,ClCCl__MSPNPTNIHTGKTLRLLYHPASQPCRSAHQFMYEIDVPFEEEVVDISTDITERQEFRDKYNPTGQVPILVDGEFTVWESVAIARYVNEKFDGAGNWFGRGTQERAQINQFLQWYAYTLRLGGGAFHWNIFGCLIYGEKPYSPKFTAEQNKGRTLLYEAMGTLENYWLRDREYVCGDEVSYADLAAFHEFVSHEAGKIIPDRVWQGFPKIAAWFKKLSERPHAKTVSEWQYTNVGKIIRGELTASMFKRKTAVLKGTEVFSGHNHGIPYLNEKAEDYFKRVEKEGAAVA,./data/raw/alphafold//AF-P21161-F1-model_v4.pdb,2986,4626,6421,6326 +2356,5120,5200,MLCVGRLGGLGARAAALPPRRAGRGSLEAGIRARRVSTSWSPVGAAFNVKPQGSRLDLFGERRGLFGVPELSAPEGFHIAQEKALRKTELLVDRACSTPPGPQTVLIFDELSDSLCRVADLADFVKIAHPEPAFREAAEEACRSIGTMVEKLNTNVDLYQSLQKLLADKKLVDSLDPETRRVAELFMFDFEISGIHLDKEKRKRAVDLNVKILDLSSTFLMGTNFPNKIEKHLLPEHIRRNFTSAGDHIIIDGLHAESPDDLVREAAYKIFLYPNAGQLKCLEELLSSRDLLAKLVGYSTFSHRALQGTIAKNPETVMQFLEKLSDKLSERTLKDFEMIRGMKMKLNPQNSEVMPWDPPYYSGVIRAERYNIEPSLYCPFFSLGACMEGLNILLNRLLGISLYAEQPAKGEVWSEDVRKLAVVHESEGLLGYIYCDFFQRADKPHQDCHFTIRGGRLKEDGDYQLPVVVLMLNLPRSSRSSPTLLTPSMMENLFHEMGHAMHSMLGRTRYQHVTGTRCPTDFAEVPSILMEYFANDYRVVNQFARHYQTGQPLPKNMVSRLCESKKVCAAADMQLQVFYATLDQIYHGKHPLRNSTTDILKETQEKFYGLPYVPNTAWQLRFSHLVGYGARYYSYLMSRAVASMVWKECFLQDPFNRAAGERYRREMLAHGGGREPMLMVEGMLQKCPSVDDFVSALVSDLDLDFETFLMDSE,uniprot_search,Q99797,CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCC(=N)O)N=C(O)c1ccccc1N)C(O)=N[C@@H](C)C(O)=N[C@@H](CC(=N)O)C(O)=N[C@@H](CCCCN)C(O)=N[C@H](C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)C,0.0051,25.0,8.0,3.4.24.59,9606.0,-2.292429823902064,-2.292429823902064,CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCC(=N)O)N=C(O)c1ccccc1N)C(O)=N[C@@H](C)C(O)=N[C@@H](CC(=N)O)C(O)=N[C@@H](CCCCN)C(O)=N[C@H](C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)C__MLCVGRLGGLGARAAALPPRRAGRGSLEAGIRARRVSTSWSPVGAAFNVKPQGSRLDLFGERRGLFGVPELSAPEGFHIAQEKALRKTELLVDRACSTPPGPQTVLIFDELSDSLCRVADLADFVKIAHPEPAFREAAEEACRSIGTMVEKLNTNVDLYQSLQKLLADKKLVDSLDPETRRVAELFMFDFEISGIHLDKEKRKRAVDLNVKILDLSSTFLMGTNFPNKIEKHLLPEHIRRNFTSAGDHIIIDGLHAESPDDLVREAAYKIFLYPNAGQLKCLEELLSSRDLLAKLVGYSTFSHRALQGTIAKNPETVMQFLEKLSDKLSERTLKDFEMIRGMKMKLNPQNSEVMPWDPPYYSGVIRAERYNIEPSLYCPFFSLGACMEGLNILLNRLLGISLYAEQPAKGEVWSEDVRKLAVVHESEGLLGYIYCDFFQRADKPHQDCHFTIRGGRLKEDGDYQLPVVVLMLNLPRSSRSSPTLLTPSMMENLFHEMGHAMHSMLGRTRYQHVTGTRCPTDFAEVPSILMEYFANDYRVVNQFARHYQTGQPLPKNMVSRLCESKKVCAAADMQLQVFYATLDQIYHGKHPLRNSTTDILKETQEKFYGLPYVPNTAWQLRFSHLVGYGARYYSYLMSRAVASMVWKECFLQDPFNRAAGERYRREMLAHGGGREPMLMVEGMLQKCPSVDDFVSALVSDLDLDFETFLMDSE,./data/raw/alphafold//AF-Q99797-F1-model_v4.pdb,5161,2049,1304,3065 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+2358,17093,17341,MSENQKTAVDKAQEYYNSDDADNFYFTIWGGEDIHVGLYNSEDEPIFDASRRTIERMASKISNLDKDSKILDIGAGYGGAARYLAKKYGCQVVALNLSEVENERDRKMNEDQGLDHLITVVDGSFEEIPYPDFSFDVVWSQDAILHSGNREQVIKEVARVLKSGGDFVFTDPMQTDDCPEGVLQPILDRIHLETLGSPGFYRESAKKYGMKEIEFEKHASQLPTHYGRVLKETESQEDELSKVVSQNYINNMKQGLNHWVNGGNNGYLTWGIFHLRKK,brenda,F6KV62,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,0.5,37.0,7.3,2.1.1.157,39664.0,-0.3010299956639812,-0.2017014521867698,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MSENQKTAVDKAQEYYNSDDADNFYFTIWGGEDIHVGLYNSEDEPIFDASRRTIERMASKISNLDKDSKILDIGAGYGGAARYLAKKYGCQVVALNLSEVENERDRKMNEDQGLDHLITVVDGSFEEIPYPDFSFDVVWSQDAILHSGNREQVIKEVARVLKSGGDFVFTDPMQTDDCPEGVLQPILDRIHLETLGSPGFYRESAKKYGMKEIEFEKHASQLPTHYGRVLKETESQEDELSKVVSQNYINNMKQGLNHWVNGGNNGYLTWGIFHLRKK,./data/raw/alphafold//AF-F6KV62-F1-model_v4.pdb,5308,1119,4193,1652 +2359,23931,24314,MRRLAFLVVAFCLAVGCFFSPVSKAEGVMSGGDGDKVAVGKDGMVATAHPLASKIGAEVLKKGGNAIDAAIAIQYALNVTEPMMSGIGGGGFMMVYDGETKETSIINSRERAPEGAKPDMFLDEDGKVIPFSERSRHGNAVGVPGTLKGLEAAHKKWGTKKMEDLISPSIKLTEEGFPIDSVLADAIKDHQDKLSKTAAKDIFLPDGEPLKEGDILVQKDMAKTFKLIRKEGSKAFYDGEIGRAIADVVQDFGGSMTPDDLSRYEVTTDKPIWGEYHGYDIASMPPPSSGGVFMLQMLKLIDDFHLSQYDPKSFEKYHLLAETMHLSYADRAAYAGDPEFVDVPLRGLLDPDYIKERQKLISLDSMNRDVKEGDPWKYEEGEPNYEIVPQPEDKTIGETTHFTVTDQWGNVVSYTTTIEQLFGTGILVPGYGLFLNNELTDFDAIPGGANEVQPNKRPLSSMTPTIVFKDEKPVLTVGSPGGTTIIASVFQTILNYFEYGMSLQDAIEEPRIYTNSLTSYRYESGMPEDVRRKLNDFGHKFGSNPVDIGNVQSIFIDRENKTFMGVADSSGNGTAVGVNNKTSAE,brenda,A9YTT0,NCC(O)=NCC(=O)O,0.94,60.0,9.0,2.3.2.2,1402.0,-0.0268721464003013,-0.0268721464003013,NCC(O)=NCC(=O)O__MRRLAFLVVAFCLAVGCFFSPVSKAEGVMSGGDGDKVAVGKDGMVATAHPLASKIGAEVLKKGGNAIDAAIAIQYALNVTEPMMSGIGGGGFMMVYDGETKETSIINSRERAPEGAKPDMFLDEDGKVIPFSERSRHGNAVGVPGTLKGLEAAHKKWGTKKMEDLISPSIKLTEEGFPIDSVLADAIKDHQDKLSKTAAKDIFLPDGEPLKEGDILVQKDMAKTFKLIRKEGSKAFYDGEIGRAIADVVQDFGGSMTPDDLSRYEVTTDKPIWGEYHGYDIASMPPPSSGGVFMLQMLKLIDDFHLSQYDPKSFEKYHLLAETMHLSYADRAAYAGDPEFVDVPLRGLLDPDYIKERQKLISLDSMNRDVKEGDPWKYEEGEPNYEIVPQPEDKTIGETTHFTVTDQWGNVVSYTTTIEQLFGTGILVPGYGLFLNNELTDFDAIPGGANEVQPNKRPLSSMTPTIVFKDEKPVLTVGSPGGTTIIASVFQTILNYFEYGMSLQDAIEEPRIYTNSLTSYRYESGMPEDVRRKLNDFGHKFGSNPVDIGNVQSIFIDRENKTFMGVADSSGNGTAVGVNNKTSAE,./data/raw/alphafold//AF-A9YTT0-F1-model_v4.pdb,4192,6125,7917,10474 +2360,28357,28851,MLIVNREEYSKSDFDLRLQAYEEMEQFQEAAGNRFALCLKDPFDIITLVFFLKEKKSSVLLIHEDTPKETAIEMAKRANCIGILYGENSDFTKLEAVNYLAEEPSLLQYSSGTTGEPKLIRRAWTEVDTEIKVYNEALNCDIDEVPIVMAPVSHSYGLICGTLSAITRGSKPIIITNKNPKFALNIVRNTEKHIVYAVPLMLHIMGSFPQGTFQFHKIMTSGAPLPEALFYKLKETTTYMMQQYGCSEAGCISICHDMKSHLDLGNPLPHASISIGSDENAPEEIIVKMNDKEIFTKDLGYKSERGLHFMGRMDDVINVSGLKVFPIEVEETMLRLEGVQEAIVYRGKHPVMGEIVKAKVISHIDPVQIREWCMQHLPSYKVPHEIESVTEIPKNKTGKVSRKLLEMGEVTT,uniprot_search,Q81RQ7,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.216,25.0,7.4,6.2.1.62,1392.0,-0.6655462488490691,-0.6655462488490691,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MLIVNREEYSKSDFDLRLQAYEEMEQFQEAAGNRFALCLKDPFDIITLVFFLKEKKSSVLLIHEDTPKETAIEMAKRANCIGILYGENSDFTKLEAVNYLAEEPSLLQYSSGTTGEPKLIRRAWTEVDTEIKVYNEALNCDIDEVPIVMAPVSHSYGLICGTLSAITRGSKPIIITNKNPKFALNIVRNTEKHIVYAVPLMLHIMGSFPQGTFQFHKIMTSGAPLPEALFYKLKETTTYMMQQYGCSEAGCISICHDMKSHLDLGNPLPHASISIGSDENAPEEIIVKMNDKEIFTKDLGYKSERGLHFMGRMDDVINVSGLKVFPIEVEETMLRLEGVQEAIVYRGKHPVMGEIVKAKVISHIDPVQIREWCMQHLPSYKVPHEIESVTEIPKNKTGKVSRKLLEMGEVTT,./data/raw/alphafold//AF-Q81RQ7-F1-model_v4.pdb,1534,6838,8678,8903 +2361,6010,6097,MTRLCRTFQTAPAAIPNDNSAKFLVSGLTSKGFQAPDWLVPDIEDGTAPSMKDEAVDNIIEHIPDHADDFAGDILPRVEWAYDDANARERGIEQVTRLAEAVGEELDGFVFPKVGRLDDVRDAAGVIADAERDAGLPEGTLEMAIILETAPGRSDLREICQYATDSRLSGLVFGPVDYTAELGGRTLDGERPRWDGLLEALSNETSAADIVAIGGPFDQLFHERAGVTYYNAEGYADQVAYEATIGIDGSWSLHPKQTEQANRIHMPTVEEMERDLHKIESFNEAKREGTGAVVVDGQMVDEATYKNFANTVKTVRAIDETHPAQTEAYYDDDLLARARDVELIFG,sabio,Q5V463,CC(O)(CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(=O)O,1.0,37.0,7.8,4.1.3.24,2238.0,0.0,0.0,CC(O)(CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(=O)O__MTRLCRTFQTAPAAIPNDNSAKFLVSGLTSKGFQAPDWLVPDIEDGTAPSMKDEAVDNIIEHIPDHADDFAGDILPRVEWAYDDANARERGIEQVTRLAEAVGEELDGFVFPKVGRLDDVRDAAGVIADAERDAGLPEGTLEMAIILETAPGRSDLREICQYATDSRLSGLVFGPVDYTAELGGRTLDGERPRWDGLLEALSNETSAADIVAIGGPFDQLFHERAGVTYYNAEGYADQVAYEATIGIDGSWSLHPKQTEQANRIHMPTVEEMERDLHKIESFNEAKREGTGAVVVDGQMVDEATYKNFANTVKTVRAIDETHPAQTEAYYDDDLLARARDVELIFG,./data/raw/alphafold//AF-Q5V463-F1-model_v4.pdb,3768,1463,2260,2192 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+2363,22565,22916,YITNTLFLYRQTMILSVKNSKIKGIYRSVSNFCNLNKIKNVNYINKKREKVVILGSGWGGIHFLLNIDFQKYDVTLISPRNYFTFTPLLPCLCSGTLNVDACSENIETLLKKNKISGKYLKLECTDIVYKDKYIKCKDNVNNNEIKINYDYLVISVGAKTNSFNIKGVDKYAFYIKDIIDALKIRTKFISNLEACIKGIKAGAVTNTITNDSSSSISDSSSSIGDSSSSIGDSSSSISDDLAKKMLHIVVVGGGPTGVEVAAELADFVNKDIKNKYKEIYKYISISIIEGGNNLLPTFTQNISKFTEKIFKNKLNINVYTNYHVIEIDENNFYIKSSINKNEEHKKIPYGIIIWASGLAQTPLINNFIKKIPEQENNKNLKVNQYLQIIGIKPNNIYAIGDCKQISPINSHEHVNEIINCLGNSKITSDVLKQKSKELSNIFPQLSDTKWDYNKNKKSEMSIKELQEYLFMIDKNYKSPPPTAQNAKQEAFYLSNIFNNYLYNSNSNGNTIPPFIEKWKGSLAYVGNHQVVAHLPFYEIKGGPFSFTFWKIVYMQMLLTWKSRINFIFSFLRTKIYGRPFI,sabio,Q7RJ45,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1,0.157,25.0,8.0,1.6.5.11,73239.0,-0.8041003475907662,-0.8041003475907662,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1__YITNTLFLYRQTMILSVKNSKIKGIYRSVSNFCNLNKIKNVNYINKKREKVVILGSGWGGIHFLLNIDFQKYDVTLISPRNYFTFTPLLPCLCSGTLNVDACSENIETLLKKNKISGKYLKLECTDIVYKDKYIKCKDNVNNNEIKINYDYLVISVGAKTNSFNIKGVDKYAFYIKDIIDALKIRTKFISNLEACIKGIKAGAVTNTITNDSSSSISDSSSSIGDSSSSIGDSSSSISDDLAKKMLHIVVVGGGPTGVEVAAELADFVNKDIKNKYKEIYKYISISIIEGGNNLLPTFTQNISKFTEKIFKNKLNINVYTNYHVIEIDENNFYIKSSINKNEEHKKIPYGIIIWASGLAQTPLINNFIKKIPEQENNKNLKVNQYLQIIGIKPNNIYAIGDCKQISPINSHEHVNEIINCLGNSKITSDVLKQKSKELSNIFPQLSDTKWDYNKNKKSEMSIKELQEYLFMIDKNYKSPPPTAQNAKQEAFYLSNIFNNYLYNSNSNGNTIPPFIEKWKGSLAYVGNHQVVAHLPFYEIKGGPFSFTFWKIVYMQMLLTWKSRINFIFSFLRTKIYGRPFI,./data/raw/alphafold//AF-Q7RJ45-F1-model_v4.pdb,317,3477,4739,4997 +2364,17568,17823,MAGEGAVERGSLAAEECSHVRVLRCVTRPHRPQKVTITTDASHVPVSSDLILERCDLQLEVNGRDHRTADLCRERLVLRRGQPFWLTLHFEGRGYEAGVDTLTFNAVTGPDPSEEAGTMARFSLSSAVEGGTWSASAVDQQDSTVSLLLSTPADAPIGLYRLSLEASTGYQGSSFVLGHFILLYNPWCPADAVYMDSDQERQEYVLTQQGFIYQGSAKFINGIPWNFGQFEDGILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLGIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHCWVESWMTRPDLEPGYEGWQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAGLTKDQKSVEVPDPVEAGEQAKVRVDLLPTEVGLHKLVVNFECDKLKAVKGYRNVIIGPA,brenda,H0VXN6,Cc1cc(=O)oc2cc(OC(=O)CCCN=C(O)[C@H](Cc3ccccc3)N=C(O)OCc3ccccc3)ccc12,0.00114,30.0,8.0,2.3.2.13,10141.0,-2.943095148663528,-2.943095148663528,Cc1cc(=O)oc2cc(OC(=O)CCCN=C(O)[C@H](Cc3ccccc3)N=C(O)OCc3ccccc3)ccc12__MAGEGAVERGSLAAEECSHVRVLRCVTRPHRPQKVTITTDASHVPVSSDLILERCDLQLEVNGRDHRTADLCRERLVLRRGQPFWLTLHFEGRGYEAGVDTLTFNAVTGPDPSEEAGTMARFSLSSAVEGGTWSASAVDQQDSTVSLLLSTPADAPIGLYRLSLEASTGYQGSSFVLGHFILLYNPWCPADAVYMDSDQERQEYVLTQQGFIYQGSAKFINGIPWNFGQFEDGILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLGIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHCWVESWMTRPDLEPGYEGWQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAGLTKDQKSVEVPDPVEAGEQAKVRVDLLPTEVGLHKLVVNFECDKLKAVKGYRNVIIGPA,./data/raw/alphafold//AF-H0VXN6-F1-model_v4.pdb,3471,970,1166,6097 +2365,38569,39250,MEALVLTGTKKLEVKDIDRPKVLPNEVLIHTAFAGICGTDHALYAGLPGSADAVPPIVLGHENSGVVAEIGSAVTNVKVGDRVTVDPNIYCGQCKYCRTARPELCENLSAVGVTRDGGFEEFFTAPASVVYPIPDNVSLKSAAVVEPISCAVHGIQLLKVTPYQKALVIGDGFMGELFVQILQAYGIHQVDLAGIVDEKLAMNKEKFGVKNTYNTMKGDKIPEGEYDVIIEAVGLPQTQEAAIEASARGAQVLMFGVGGPDAKFQMNTYEVFQKQLTIQGSFINPNAFEDSLALLSSGKLNVEALMSHELDYKTVDDFVNGKLGVVSKAVVKVGGEEA,brenda,Q8KQG6,OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,71.0,25.0,7.6,1.1.1.67,1245.0,1.8512583487190752,1.8512583487190752,OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O__MEALVLTGTKKLEVKDIDRPKVLPNEVLIHTAFAGICGTDHALYAGLPGSADAVPPIVLGHENSGVVAEIGSAVTNVKVGDRVTVDPNIYCGQCKYCRTARPELCENLSAVGVTRDGGFEEFFTAPASVVYPIPDNVSLKSAAVVEPISCAVHGIQLLKVTPYQKALVIGDGFMGELFVQILQAYGIHQVDLAGIVDEKLAMNKEKFGVKNTYNTMKGDKIPEGEYDVIIEAVGLPQTQEAAIEASARGAQVLMFGVGGPDAKFQMNTYEVFQKQLTIQGSFINPNAFEDSLALLSSGKLNVEALMSHELDYKTVDDFVNGKLGVVSKAVVKVGGEEA,./data/raw/alphafold//AF-Q8KQG6-F1-model_v4.pdb,2636,8323,10240,11456 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+2367,27185,27651,MAKKLLGIDLGGTSIKFGILTLDGQVQEKWAIETNILEDGKHIVPDIVSSIKHRLGLYNLTKEDFVGIGMGSPGAVDRNLKTVTGAFNLNWAATQEVGTIIEAELGIPFAIDNDANVAALGERWVGAGNNNPDVVFVTLGTGVGGGIIADGNLIHGVAGAGGEIGHIIVEPDTGFECTCGNKGCLETVASATGVVRVARHLAEEYEGISSIKAGIDNGDDVSSKDIFVAAQAGDKFANSVVEKVTFYLGLATANISNILNPNTVVVGGGVSAAGEFLRSHIESYFKLYAFPQVKQSTKIKIAELGNDAGIIGAASLAHQFLES,uniprot_search,A0A2J9QFK1,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,0.21,22.0,7.5,2.7.1.2,1309.0,-0.6777807052660807,-0.6777807052660807,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MAKKLLGIDLGGTSIKFGILTLDGQVQEKWAIETNILEDGKHIVPDIVSSIKHRLGLYNLTKEDFVGIGMGSPGAVDRNLKTVTGAFNLNWAATQEVGTIIEAELGIPFAIDNDANVAALGERWVGAGNNNPDVVFVTLGTGVGGGIIADGNLIHGVAGAGGEIGHIIVEPDTGFECTCGNKGCLETVASATGVVRVARHLAEEYEGISSIKAGIDNGDDVSSKDIFVAAQAGDKFANSVVEKVTFYLGLATANISNILNPNTVVVGGGVSAAGEFLRSHIESYFKLYAFPQVKQSTKIKIAELGNDAGIIGAASLAHQFLES,./data/raw/alphafold//AF-A0A2J9QFK1-F1-model_v4.pdb,2618,8295,8412,7903 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+2485,593,610,MAQLSVEQFLNEQKQAVETALSRYIERLEGPAKLKKAMAYSLEAGGKRIRPLLLLSTVRALGKDPAVGLPVACAIEMIHTYSLIHDDLPSMDNDDLRRGKPTNHKVFGEAMAILAGDGLLTYAFQLITEIDDERIPPSVRLRLIERLAKAAGPEGMVAGQAADMEGEGKTLTLSELEYIHRHKTGKMLQYSVHAGALIGGADARQTRELDEFAAHLGLAFQIRDDILDIEGAEEKIGKPVGSDQSNNKATYPALLSLAGAKEKLAFHIEAAQRHLRNADVDGAALAYICELVAARDH,sabio,Q08291,C=C(C)CCOP(=O)(O)OP(=O)(O)O,0.0106,55.0,8.5,2.5.1.10,1422.0,-1.9746941347352296,-1.9532541364945344,C=C(C)CCOP(=O)(O)OP(=O)(O)O__MAQLSVEQFLNEQKQAVETALSRYIERLEGPAKLKKAMAYSLEAGGKRIRPLLLLSTVRALGKDPAVGLPVACAIEMIHTYSLIHDDLPSMDNDDLRRGKPTNHKVFGEAMAILAGDGLLTYAFQLITEIDDERIPPSVRLRLIERLAKAAGPEGMVAGQAADMEGEGKTLTLSELEYIHRHKTGKMLQYSVHAGALIGGADARQTRELDEFAAHLGLAFQIRDDILDIEGAEEKIGKPVGSDQSNNKATYPALLSLAGAKEKLAFHIEAAQRHLRNADVDGAALAYICELVAARDH,./data/raw/alphafold//AF-Q08291-F1-model_v4.pdb,3105,360,410,493 +2486,6047,6135,MSRLLFVALLAISLGYVASSSSNHLPAGLAMDLGPGVNLNERFFDQVRALIKRRLQEKGLAKPEQPELAMPLTDDDAVALQNQRSYDNVPLPAASVPTPVLVENWPTEQHSFGQVTAVAVDPQGSPVVFHRAERYWDVNTFNESNIYYLIEYGPIKENTIYVLDAKTGAIKSGWGSNMFYMPHGLTIDLHGNYWITDVAMHQAFKFKPFSNKPLLTIGKRFRPGSSVKHLCKPTSIAVATTGEFFIADGYCNSRILKFNAAGKLLRTIPQPPEFLSLQVPHAITLLEHLDLLCIADRENMRVVCPKAGLISSHGEGEPAATIQEPDLGRVFGVASFGDIVFAVNGPTSMLPVRGFTIDPRSETIIGHWGEFKNPHSMAVSVNGSALYVTEIGTNHQTNRVWKYVLA,brenda,Q9W1L5,CC(O)=NC(Cc1ccc(O)cc1)C(O)=NC(C(O)=NC(O)C(=O)O)C(C)C,0.238,37.0,7.5,4.3.2.5,7227.0,-0.623423042943488,-0.623423042943488,CC(O)=NC(Cc1ccc(O)cc1)C(O)=NC(C(O)=NC(O)C(=O)O)C(C)C__MSRLLFVALLAISLGYVASSSSNHLPAGLAMDLGPGVNLNERFFDQVRALIKRRLQEKGLAKPEQPELAMPLTDDDAVALQNQRSYDNVPLPAASVPTPVLVENWPTEQHSFGQVTAVAVDPQGSPVVFHRAERYWDVNTFNESNIYYLIEYGPIKENTIYVLDAKTGAIKSGWGSNMFYMPHGLTIDLHGNYWITDVAMHQAFKFKPFSNKPLLTIGKRFRPGSSVKHLCKPTSIAVATTGEFFIADGYCNSRILKFNAAGKLLRTIPQPPEFLSLQVPHAITLLEHLDLLCIADRENMRVVCPKAGLISSHGEGEPAATIQEPDLGRVFGVASFGDIVFAVNGPTSMLPVRGFTIDPRSETIIGHWGEFKNPHSMAVSVNGSALYVTEIGTNHQTNRVWKYVLA,./data/raw/alphafold//AF-Q9W1L5-F1-model_v4.pdb,5591,2360,2982,3448 +2487,39146,39844,MRPSSRFVGALAAAASFLPSALAQNNAAVTFTDPDTGIVFNSWGLANGAPQTQGGFTFGVALPSDALTTDATEFIGYLECASADNQGWCGVSMGGPMTNSLLITAWPHEDNVYTSLRFATGYAMPDVYSGDATITQISSSINATHFKLIFRCQNCLQWTHDGASGGASTSAGVLVLGWVQAFPSPGNPTCPDQITLEQHNNGMGIWGAVMDSNVANPSYTEWAAQATKTVEAECDGPSETDIVGVPVPTGTTFDYIVVGGGAGGIPTADKLSEAGKSVLLIEKGIASTAEHGGTLGPEWLEGNDLTRFDVPGLCNQIWVDSKGIACEDTDQMAGCVLGGGTAVNAGLWFKPYSLDWDYLFPSGWKYRDIQAAIGRVFSRIPGTDAPSTDGKRYYQQGFDVLAGGLSAGGWNKVTANSSPDKKNRTFSNAPFMFSGGERGGPLATYLTSAKKRSNFNLWLNTSVKRVIREGGHVTGVEVEPFRTGGYQGIVNVTAVSGRVVLSAGTFGSAKILLRGGIGPADQLEVVKASKIDGPTMISNASWIPLPVGYNLDDHLNTDTVITHPDVAFYDFYEAWNTPIEADKNSYLSSRTGILAQAAPNIGPMMWEEIKGADGIVRQLQWTARVEGSFDTPNGQAMTISQYLGRGATSRGRMTITPSLTTVVSDVPYLKDPNDKEAVIQGIVNLQNALKNVAGLTWTYPNSSITPREYVDNMVVSPSNRRANHWMGTAKIGTDDGRLAGGSAVVDLNTKVYGTDNLFVVDASIFPGTPTTNPSAYIVTAAEHASQRILGLAAPKPVGKWGQCGGRQWTGSFQCVSGTKCEVVNEWYSQCL,uniprot_search,E7D6C0,OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O,0.018,30.0,5.0,1.1.99.18,1934350.0,-1.744727494896694,-1.2041338805240822,OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O__MRPSSRFVGALAAAASFLPSALAQNNAAVTFTDPDTGIVFNSWGLANGAPQTQGGFTFGVALPSDALTTDATEFIGYLECASADNQGWCGVSMGGPMTNSLLITAWPHEDNVYTSLRFATGYAMPDVYSGDATITQISSSINATHFKLIFRCQNCLQWTHDGASGGASTSAGVLVLGWVQAFPSPGNPTCPDQITLEQHNNGMGIWGAVMDSNVANPSYTEWAAQATKTVEAECDGPSETDIVGVPVPTGTTFDYIVVGGGAGGIPTADKLSEAGKSVLLIEKGIASTAEHGGTLGPEWLEGNDLTRFDVPGLCNQIWVDSKGIACEDTDQMAGCVLGGGTAVNAGLWFKPYSLDWDYLFPSGWKYRDIQAAIGRVFSRIPGTDAPSTDGKRYYQQGFDVLAGGLSAGGWNKVTANSSPDKKNRTFSNAPFMFSGGERGGPLATYLTSAKKRSNFNLWLNTSVKRVIREGGHVTGVEVEPFRTGGYQGIVNVTAVSGRVVLSAGTFGSAKILLRGGIGPADQLEVVKASKIDGPTMISNASWIPLPVGYNLDDHLNTDTVITHPDVAFYDFYEAWNTPIEADKNSYLSSRTGILAQAAPNIGPMMWEEIKGADGIVRQLQWTARVEGSFDTPNGQAMTISQYLGRGATSRGRMTITPSLTTVVSDVPYLKDPNDKEAVIQGIVNLQNALKNVAGLTWTYPNSSITPREYVDNMVVSPSNRRANHWMGTAKIGTDDGRLAGGSAVVDLNTKVYGTDNLFVVDASIFPGTPTTNPSAYIVTAAEHASQRILGLAAPKPVGKWGQCGGRQWTGSFQCVSGTKCEVVNEWYSQCL,./data/raw/alphafold//AF-E7D6C0-F1-model_v4.pdb,2011,7526,1788,9864 +2488,20050,20350,MATVQPHVLLIDSYDSFAFNLAALVKKAIPDCTLHVIKNDSHTIQELLPSLSKFSAIVVGPGPGSPDIPTDIGVVCDIWKVANENLVPTFGVCLGQQSLGVENGATIHRLGTVKHGQVSVVKHTGTEIFAGLPDLKVVRYHSLHIRPKAGGEIEELAWSEDEDNGTIVMGVRHLSKPFWAVQYHPESILTDEGGLGIFRNFWKLASDWNTINRPHFRPQATLELSKSHVWPRVSKPYSANAANKTLGKVTFSTMEVPGLSVLRLCEFLGVNDESKRFVFLDSAAHPGQFSMIGCLNDDTAQFTHFVHENHIEESNAHSKVRHELGNKDVWTFFDEYREARKVVGGDRTVPFWGGFAGYLTYEAGFPPLGAGLKREDGHTAINHPDFNMVWVDRSIIVDIQNDKMWIQSLLPNDDAWIQETAQQISELPKGEIPVPTVAQGSSSVSFPDPEQYKTDVKRCQEFLFSGDSYELCLTGQTHITVPKEKTVPTWERYKILRGVNAAPHAGYLRLQPTTFLSCSPERFLSYSRSPGAVCELRPIKGTVRKMPHITREIAEEMLAGSRKEIAENLMIVDLIRHDLHNAVGENVVCSKFCGVEEYETLWQLVSVIEGSLPKDTPEDVDDSLGWEVLRRGLPPGSMTGAPKKRSVEILYNLEGFERGPYSGVFGYWCAGGGGDWSVTIRSVFLHDSEKNGDERWYVGAGGAITALSEPESELEETRVKLNGVLLGFGASS,brenda,A0A060IGN1,N=C(O)CC[C@H](N)C(=O)O,2.4,25.0,8.0,2.6.1.85,5341.0,0.380211241711606,0.380211241711606,N=C(O)CC[C@H](N)C(=O)O__MATVQPHVLLIDSYDSFAFNLAALVKKAIPDCTLHVIKNDSHTIQELLPSLSKFSAIVVGPGPGSPDIPTDIGVVCDIWKVANENLVPTFGVCLGQQSLGVENGATIHRLGTVKHGQVSVVKHTGTEIFAGLPDLKVVRYHSLHIRPKAGGEIEELAWSEDEDNGTIVMGVRHLSKPFWAVQYHPESILTDEGGLGIFRNFWKLASDWNTINRPHFRPQATLELSKSHVWPRVSKPYSANAANKTLGKVTFSTMEVPGLSVLRLCEFLGVNDESKRFVFLDSAAHPGQFSMIGCLNDDTAQFTHFVHENHIEESNAHSKVRHELGNKDVWTFFDEYREARKVVGGDRTVPFWGGFAGYLTYEAGFPPLGAGLKREDGHTAINHPDFNMVWVDRSIIVDIQNDKMWIQSLLPNDDAWIQETAQQISELPKGEIPVPTVAQGSSSVSFPDPEQYKTDVKRCQEFLFSGDSYELCLTGQTHITVPKEKTVPTWERYKILRGVNAAPHAGYLRLQPTTFLSCSPERFLSYSRSPGAVCELRPIKGTVRKMPHITREIAEEMLAGSRKEIAENLMIVDLIRHDLHNAVGENVVCSKFCGVEEYETLWQLVSVIEGSLPKDTPEDVDDSLGWEVLRRGLPPGSMTGAPKKRSVEILYNLEGFERGPYSGVFGYWCAGGGGDWSVTIRSVFLHDSEKNGDERWYVGAGGAITALSEPESELEETRVKLNGVLLGFGASS,./data/raw/alphafold//AF-A0A060IGN1-F1-model_v4.pdb,3193,508,593,717 +2489,23053,23407,MSVPVQHPMYIDGQFVTWRGDAWIDVVNPATEAVISRIPDGQAEDARKAIDAAERAQPEWEALPAIERASWLRKISAGIRERASEISALIVEEGGKIQQLAEVEVAFTADYIDYMAEWARRYEGEIIQSDRPGENILLFKRALGVTTGILPWNFPFFLIARKMAPALLTGNTIVIKPSEFTPNNAIAFAKIVDEIGLPRGVFNLVLGRGETVGQELAGNPKVAMVSMTGSVSAGEKIMATAAKNITKVCLELGGKAPAIVMDDADLELAVKAIVDSRVINSGQVCNCAERVYVQKGIYDQFVNRLGEAMQAVQFGNPAERNDIAMGPLINAAALERVEQKVARAVEEGARVAFGGKAVEGKGYYYPPTLLLDVRQEMSIMHEETFGPVLPVVAFDTLEDAISMANDSDYGLTSSIYTQNLNVAMKAIKGLKFGETYINRENFEAMQGFHAGWRKSGIGGADGKHGLHEYLQTQVVYLQS,sabio,P25553,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.12,25.0,9.5,1.2.1.22,562.0,-0.9208187539523752,-0.8245535742033855,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MSVPVQHPMYIDGQFVTWRGDAWIDVVNPATEAVISRIPDGQAEDARKAIDAAERAQPEWEALPAIERASWLRKISAGIRERASEISALIVEEGGKIQQLAEVEVAFTADYIDYMAEWARRYEGEIIQSDRPGENILLFKRALGVTTGILPWNFPFFLIARKMAPALLTGNTIVIKPSEFTPNNAIAFAKIVDEIGLPRGVFNLVLGRGETVGQELAGNPKVAMVSMTGSVSAGEKIMATAAKNITKVCLELGGKAPAIVMDDADLELAVKAIVDSRVINSGQVCNCAERVYVQKGIYDQFVNRLGEAMQAVQFGNPAERNDIAMGPLINAAALERVEQKVARAVEEGARVAFGGKAVEGKGYYYPPTLLLDVRQEMSIMHEETFGPVLPVVAFDTLEDAISMANDSDYGLTSSIYTQNLNVAMKAIKGLKFGETYINRENFEAMQGFHAGWRKSGIGGADGKHGLHEYLQTQVVYLQS,./data/raw/alphafold//AF-P25553-F1-model_v4.pdb,4157,5030,6924,6917 +2490,36072,36700,MEMEKEFEQIDKSGSWAAIYQDIRHEASDFPCRVAKLPKNKNRNRYRDVSPFDHSRIKLHQEDNDYINASLIKMEEAQRSYILTQGPLPNTCGHFWEMVWEQKSRGVVMLNRVMEKGSLKCAQYWPQKEEKEMIFEDTNLKLTLISEDIKSYYTVRQLELENLTTQETREILHFHYTTWPDFGVPESPASFLNFLFKVRESGSLSPEHGPVVVHCSAGIGRSGTFCLADTCLLLMDKRKDPSSVDIKKVLLEMRKFRMGLIQTADQLRFSYLAVIEGAKFIMGDSSVQDQWKELSHEDLEPPPEHIPPPPRPPKRILEPHNGKCREFFPNHQWVKEETQEDKDCPIKEEKGSPLNAAPYGIESMSQDTEVRSRVVGGSLRGAQAASPAKGEPSLPEKDEDHALSYWKPFLVNMCVATVLTAGAYLCYRFLFNSNT,brenda,P18031,O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,0.58,25.0,5.5,3.1.3.48,50422.0,-0.2365720064370627,0.1509966888660444,O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MEMEKEFEQIDKSGSWAAIYQDIRHEASDFPCRVAKLPKNKNRNRYRDVSPFDHSRIKLHQEDNDYINASLIKMEEAQRSYILTQGPLPNTCGHFWEMVWEQKSRGVVMLNRVMEKGSLKCAQYWPQKEEKEMIFEDTNLKLTLISEDIKSYYTVRQLELENLTTQETREILHFHYTTWPDFGVPESPASFLNFLFKVRESGSLSPEHGPVVVHCSAGIGRSGTFCLADTCLLLMDKRKDPSSVDIKKVLLEMRKFRMGLIQTADQLRFSYLAVIEGAKFIMGDSSVQDQWKELSHEDLEPPPEHIPPPPRPPKRILEPHNGKCREFFPNHQWVKEETQEDKDCPIKEEKGSPLNAAPYGIESMSQDTEVRSRVVGGSLRGAQAASPAKGEPSLPEKDEDHALSYWKPFLVNMCVATVLTAGAYLCYRFLFNSNT,./data/raw/alphafold//AF-P18031-F1-model_v4.pdb,5627,2407,3033,3503 +2491,39360,40059,MDAQDIESRHPLIGARPRRRALRSLSILLAAALLLGLVLFYANGTGSGTAVDPVRVDNEFPWTNDMLAWQRCGFHFRTVRNYMNDPSGPMYYKGWYHLFYQHNKDFAYWGNITWGHAVSRDLINWQHLPVAVGPDHWYDISGVWTGSIIVVSEDRVVMLFTGGTKSFDQSINLAEAADPSDPLLLKWIKYDNNPILWPPPGIVRDDFRDPNPIWYNASESTYHIVVGSKNDSLQHTGIALVYLTKDFKKFDLLPTVLHSVDKVGMWECVEVYPVATTGPLLHKAIDNFDVDRVLDRSTVKHVLKASMNDEWHDYYAIGTFDPIGNKWTPDDETVDVGIGLRYDWGKFYASRTFFDPLKQRRIIWGYIGEVDSQKADIAKGWASLQGIPRSVLYDVKTGTNVLTWPIEEMEGLRMARKDFSGIKIKKGSTVELSDFGDAFQIDIEAEFTISKEALEATIEADVGYNCSSSGGAAIRGTLGPFGLLVLANQDLTENTATYFYVSKGIDGSLITHFCQDETRSSKANDIVKRVVGGTVPVLDGETFAVRILVDHSVIESFAMGGRTSATSRAYPTEAINSAARVFLFNNATGVDVIAESVKIWQMNSTYNDFYHF,uniprot_search,P92916,OC[C@H]1O[C@@](CO)(OC[C@@]2(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O,18.0,30.0,5.5,2.4.1.100,4679.0,1.255272505103306,1.5998775886267371,OC[C@H]1O[C@@](CO)(OC[C@@]2(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O__MDAQDIESRHPLIGARPRRRALRSLSILLAAALLLGLVLFYANGTGSGTAVDPVRVDNEFPWTNDMLAWQRCGFHFRTVRNYMNDPSGPMYYKGWYHLFYQHNKDFAYWGNITWGHAVSRDLINWQHLPVAVGPDHWYDISGVWTGSIIVVSEDRVVMLFTGGTKSFDQSINLAEAADPSDPLLLKWIKYDNNPILWPPPGIVRDDFRDPNPIWYNASESTYHIVVGSKNDSLQHTGIALVYLTKDFKKFDLLPTVLHSVDKVGMWECVEVYPVATTGPLLHKAIDNFDVDRVLDRSTVKHVLKASMNDEWHDYYAIGTFDPIGNKWTPDDETVDVGIGLRYDWGKFYASRTFFDPLKQRRIIWGYIGEVDSQKADIAKGWASLQGIPRSVLYDVKTGTNVLTWPIEEMEGLRMARKDFSGIKIKKGSTVELSDFGDAFQIDIEAEFTISKEALEATIEADVGYNCSSSGGAAIRGTLGPFGLLVLANQDLTENTATYFYVSKGIDGSLITHFCQDETRSSKANDIVKRVVGGTVPVLDGETFAVRILVDHSVIESFAMGGRTSATSRAYPTEAINSAARVFLFNNATGVDVIAESVKIWQMNSTYNDFYHF,./data/raw/alphafold//AF-P92916-F1-model_v4.pdb,2722,8466,8490,11616 +2492,4134,4202,MKIAVIGAGVTGLAAAARIASQGHEVTIFEKNNNVGGRMNQLKKDGFTFDMGPTIVMMPDVYKDVFTACGKNYEDYIELRQLRYIYDVYFDHDDRITVPTDLAELQQMLESIEPGSTHGFMSFLTDVYKKYEIARRYFLERTYRKPSDFYNMTSLVQGAKLKTLNHADQLIEHYIDNEKIQKLLAFQTLYIGIDPKRGPSLYSIIPMIEMMFGVHFIKGGMYGMAQGLAQLNKDLGVNIELNAEIEQIIIDPKFKRADAIKVNGDIRKFDKILCTADFPSVAESLMPDFAPIKKYPPHKIADLDYSCSAFLMYIGIDIDVTDQVRLHNVIFSDDFRGNIEEIFEGRLSYDPSIYVYVPAVADKSLAPEGKTGIYVLMPTPELKTGSGIDWSDEALTQQIKEIIYRKLATIEVFEDIKSHIVSETIFTPNDFEQTYHAKFGSAFGLMPTLAQSNYYRPQNVSRDYKDLYFAGASTHPGAGVPIVLTSAKITVDEMIKDIERGV,sabio,O07855,CC(C)=CCCC(C)=CCCC(C)=CC=CC=C(C)CCC=C(C)CCC=C(C)C,0.049,,,1.3.8.2,1280.0,-1.3098039199714864,-1.3098039199714864,CC(C)=CCCC(C)=CCCC(C)=CC=CC=C(C)CCC=C(C)CCC=C(C)C__MKIAVIGAGVTGLAAAARIASQGHEVTIFEKNNNVGGRMNQLKKDGFTFDMGPTIVMMPDVYKDVFTACGKNYEDYIELRQLRYIYDVYFDHDDRITVPTDLAELQQMLESIEPGSTHGFMSFLTDVYKKYEIARRYFLERTYRKPSDFYNMTSLVQGAKLKTLNHADQLIEHYIDNEKIQKLLAFQTLYIGIDPKRGPSLYSIIPMIEMMFGVHFIKGGMYGMAQGLAQLNKDLGVNIELNAEIEQIIIDPKFKRADAIKVNGDIRKFDKILCTADFPSVAESLMPDFAPIKKYPPHKIADLDYSCSAFLMYIGIDIDVTDQVRLHNVIFSDDFRGNIEEIFEGRLSYDPSIYVYVPAVADKSLAPEGKTGIYVLMPTPELKTGSGIDWSDEALTQQIKEIIYRKLATIEVFEDIKSHIVSETIFTPNDFEQTYHAKFGSAFGLMPTLAQSNYYRPQNVSRDYKDLYFAGASTHPGAGVPIVLTSAKITVDEMIKDIERGV,./data/raw/alphafold//AF-O07855-F1-model_v4.pdb,4926,1675,2527,2514 +2493,29230,29753,MTYLLNSPDDFADEAVRGLVAANPDLLTEVPGGVVRSTETPKGQPALVIGGGSGHYPAFAGWVGPGMGHGAPCGNIFSSPSASEVYSVVRNAENGGGVILGFGNYAGDVLHFGLAAEKLRHEGIDVRIVTVSDDIASNSPENHRDRRGVAGDLPVFKIAGAAIEAGADLDEAERVAWKANDATRSFGLAFEGCTLPGATEPLFHVEKGWMGVGLGIHGEPGVRDNRLGTAAEVADMLFDEVTAEEPPRGENGYDGRVAVILNGLGTVKYEELFVVYGRIAERLAQQGFTVVRPEVGEFVTSLDMAGVSLTMVFLDDELERLWTAPVETPAYRRGAMPAVDRTPRTTTWDAAETTIPEASEGSRECARNIVAVLETFQQVCADNEAELGRIDAVAGDGDHGQGMSFGSRGAAQAARDAVDRNAGARTTLLLAGQAWADAAGGTSGALWGAALTSAGGVFSDTDGADEQAAVDAICAGIDAILRLGGAQPGDKTMVDAAVPFRDALVKAFDTQAGPAITSAARVAREAAEKTADITARRGRARVLGEKSVGTPDPGALSFAMLMKALGEHLTR,brenda,A0R758,O=C(CO)[C@H](O)CO,0.0106,30.0,7.5,2.7.1.209,1772.0,-1.9746941347352296,-1.9746941347352296,O=C(CO)[C@H](O)CO__MTYLLNSPDDFADEAVRGLVAANPDLLTEVPGGVVRSTETPKGQPALVIGGGSGHYPAFAGWVGPGMGHGAPCGNIFSSPSASEVYSVVRNAENGGGVILGFGNYAGDVLHFGLAAEKLRHEGIDVRIVTVSDDIASNSPENHRDRRGVAGDLPVFKIAGAAIEAGADLDEAERVAWKANDATRSFGLAFEGCTLPGATEPLFHVEKGWMGVGLGIHGEPGVRDNRLGTAAEVADMLFDEVTAEEPPRGENGYDGRVAVILNGLGTVKYEELFVVYGRIAERLAQQGFTVVRPEVGEFVTSLDMAGVSLTMVFLDDELERLWTAPVETPAYRRGAMPAVDRTPRTTTWDAAETTIPEASEGSRECARNIVAVLETFQQVCADNEAELGRIDAVAGDGDHGQGMSFGSRGAAQAARDAVDRNAGARTTLLLAGQAWADAAGGTSGALWGAALTSAGGVFSDTDGADEQAAVDAICAGIDAILRLGGAQPGDKTMVDAAVPFRDALVKAFDTQAGPAITSAARVAREAAEKTADITARRGRARVLGEKSVGTPDPGALSFAMLMKALGEHLTR,./data/raw/alphafold//AF-A0R758-F1-model_v4.pdb,1649,6999,8853,9100 +2494,18667,18938,MSKIVRVGAVQSEPVWLDLEGSVDKTISLIEKAAADGVNVLGFPEVWIPGYPWSMWTSAVINNSHIIHDYMNNSMRKDSPQMKRIQAAVKEAGMVVVLGYSERDGASLYMAQSFIDPSGEIVHHRRKIKPTHIERTIWGEGQAESLTCVIDSPFGKVGGLNCWEHLQPLLRYYEYSQGVQIHIASWPAEFEMPDPKKIAWLYHETGEASYRASQFFAIEGQAFVLVASQILTEANVERNNLTGNPVTKTPGGGFSMIFGPDGKPLCEPVDAGAEAILTADIDLRDIDKPKAFIDVVGHYARPDLLSLLVNPTVDKHVTTMKK,brenda,B6Q5I3,N#Cc1ccc(Cl)cc1,2.6,30.0,8.0,3.5.5.1,37727.0,0.414973347970818,0.414973347970818,N#Cc1ccc(Cl)cc1__MSKIVRVGAVQSEPVWLDLEGSVDKTISLIEKAAADGVNVLGFPEVWIPGYPWSMWTSAVINNSHIIHDYMNNSMRKDSPQMKRIQAAVKEAGMVVVLGYSERDGASLYMAQSFIDPSGEIVHHRRKIKPTHIERTIWGEGQAESLTCVIDSPFGKVGGLNCWEHLQPLLRYYEYSQGVQIHIASWPAEFEMPDPKKIAWLYHETGEASYRASQFFAIEGQAFVLVASQILTEANVERNNLTGNPVTKTPGGGFSMIFGPDGKPLCEPVDAGAEAILTADIDLRDIDKPKAFIDVVGHYARPDLLSLLVNPTVDKHVTTMKK,./data/raw/alphafold//AF-B6Q5I3-F1-model_v4.pdb,3919,4681,6486,6411 +2495,16492,16733,MNSKCHCVILNDGNFIPVLGFGTALPLECPKSKAKELTKIAIDAGFHHFDSASVYNTEDHVGEAIRSKIADGTVRREDIFYTSKVWCTSLHPELVRASLERSLQKLQFDYVDLYLIHYPMALKPGEENFPVDEHGKLIFDRVDLCATWEAMEKCKDAGLTKSIGVSNFNYRQLEMILNKPGLKYKPVCNQVECHPYLNQMKLLDFCKSKDIVLVAYGVLGTQRYGGWVDQNSPVLLDEPVLGSMAKKYNRTPALIALRYQLQRGIVVLNTSLKEERIKENMQVFEFQLSSEDMKVLDGLNRNMRYIPAAIFKGHPNWPFLDEY,brenda,Q91WR5,C[C@]12CC[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12,0.0006,25.0,7.0,1.1.1.209,10090.0,-3.2218487496163566,-3.2218487496163566,C[C@]12CC[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12__MNSKCHCVILNDGNFIPVLGFGTALPLECPKSKAKELTKIAIDAGFHHFDSASVYNTEDHVGEAIRSKIADGTVRREDIFYTSKVWCTSLHPELVRASLERSLQKLQFDYVDLYLIHYPMALKPGEENFPVDEHGKLIFDRVDLCATWEAMEKCKDAGLTKSIGVSNFNYRQLEMILNKPGLKYKPVCNQVECHPYLNQMKLLDFCKSKDIVLVAYGVLGTQRYGGWVDQNSPVLLDEPVLGSMAKKYNRTPALIALRYQLQRGIVVLNTSLKEERIKENMQVFEFQLSSEDMKVLDGLNRNMRYIPAAIFKGHPNWPFLDEY,./data/raw/alphafold//AF-Q91WR5-F1-model_v4.pdb,2022,202,1020,1254 +2496,21841,22180,MAVENEGVLLVLSSPSGAGKTTILERLLERSTNLVRSVSMTTRKPRPGEINGKDYFFVTKKEFHELCEAGQMLEYARVFENFYGIPKSFIEQNLSSGISVLLSIDWQGAFHLFELMREKVISVFILPPSMEELRLRLQKRNSDSASEIEHRLAEAQKEMSKRDKYDYVVINDDIDKSVEEISSILDKERLKRSGV,brenda,Q5GS56,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1,0.03,25.0,7.5,2.7.4.8,6279.0,-1.5228787452803376,-1.5228787452803376,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1__MAVENEGVLLVLSSPSGAGKTTILERLLERSTNLVRSVSMTTRKPRPGEINGKDYFFVTKKEFHELCEAGQMLEYARVFENFYGIPKSFIEQNLSSGISVLLSIDWQGAFHLFELMREKVISVFILPPSMEELRLRLQKRNSDSASEIEHRLAEAQKEMSKRDKYDYVVINDDIDKSVEEISSILDKERLKRSGV,./data/raw/alphafold//AF-Q5GS56-F1-model_v4.pdb,4490,5547,5992,7621 +2497,22720,23072,MALRWGIVSVGLISSDFTAVLQTLPRSEHQVVAVAARDLSRAKEFAQKHDIPKAYGSYEELAKDPNVEVAYVGTQHPQHKAAVMLCLAAGKAVLCEKPMGVNAAEVREMVTEARSRGLFLMEAIWTRFFPASEALRSVLAQGTLGDLRVARAEFGKNLTHVPRAVDWAQAGGALLDLGIYCVQFISMVFGGQKPEKISVMGRRHETGVDDTVTVLLQYPGEVHGSFTCSITAQLSNTASVSGTKGMAQLLNPCWCPTELVVKGEHKEFLLPPVPKNCNFDNGAGMSYEAKHVRECLRKGLKESPVIPLVESELLADILEEVRRAIGVTFPQDKH,sabio,Q7JK39,NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,0.00055,25.0,7.5,1.1.1.179,9542.0,-3.2596373105057563,-2.968709007885918,NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1__MALRWGIVSVGLISSDFTAVLQTLPRSEHQVVAVAARDLSRAKEFAQKHDIPKAYGSYEELAKDPNVEVAYVGTQHPQHKAAVMLCLAAGKAVLCEKPMGVNAAEVREMVTEARSRGLFLMEAIWTRFFPASEALRSVLAQGTLGDLRVARAEFGKNLTHVPRAVDWAQAGGALLDLGIYCVQFISMVFGGQKPEKISVMGRRHETGVDDTVTVLLQYPGEVHGSFTCSITAQLSNTASVSGTKGMAQLLNPCWCPTELVVKGEHKEFLLPPVPKNCNFDNGAGMSYEAKHVRECLRKGLKESPVIPLVESELLADILEEVRRAIGVTFPQDKH,./data/raw/alphafold//AF-Q7JK39-F1-model_v4.pdb,3396,839,3387,1325 +2498,4245,4313,MIGELLLLLAAGLALYGWYFCKSFNTTRPTDPPVVHGTTPFVGHIIQFGKDPLGFMLKAKKKYGGIFTMNICGNRITVVGDVHQHSKFFTPRNEILSPREVYSFMVPVFGEGVAYAAPYPRMREQLNFLAEELTVAKFQNFAPSIQHEVRKFMKANWNKDEGEINILDDCSAMIINTACQCLFGEDLRKRLDARQFAQLLAKMESCLIPAAVFLPWILKLPLPQSYRCRDARAELQDILSEIIIAREKEEAQKDTNTSDLLAGLLGAVYRDGTRMSQHEVCGMIVAAMFAGQHTSTITTTWSLLHLMDPRNKRHLAKLHQEIDEFPAQLNYDNVMEEMPFAEQCARESIRRDPPLVMLMRKVLKPVQVGKYVVPEGDIIACSPLLSHQDEEAFPNPREWNPERNMKLVDGAFCGFGAGVHKCIGEKFGLLQVKTVLATVLRDYDFELLGPLPEPNYHTMVVGPTASQCRVKYIKKKKAAA,brenda,A2TEF2,CC(C)=CCC[C@@H](C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C[C@@H]1CC3,0.00911,37.0,7.4,1.14.14.154,5671.0,-2.0404816230270018,-2.0404816230270018,CC(C)=CCC[C@@H](C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C[C@@H]1CC3__MIGELLLLLAAGLALYGWYFCKSFNTTRPTDPPVVHGTTPFVGHIIQFGKDPLGFMLKAKKKYGGIFTMNICGNRITVVGDVHQHSKFFTPRNEILSPREVYSFMVPVFGEGVAYAAPYPRMREQLNFLAEELTVAKFQNFAPSIQHEVRKFMKANWNKDEGEINILDDCSAMIINTACQCLFGEDLRKRLDARQFAQLLAKMESCLIPAAVFLPWILKLPLPQSYRCRDARAELQDILSEIIIAREKEEAQKDTNTSDLLAGLLGAVYRDGTRMSQHEVCGMIVAAMFAGQHTSTITTTWSLLHLMDPRNKRHLAKLHQEIDEFPAQLNYDNVMEEMPFAEQCARESIRRDPPLVMLMRKVLKPVQVGKYVVPEGDIIACSPLLSHQDEEAFPNPREWNPERNMKLVDGAFCGFGAGVHKCIGEKFGLLQVKTVLATVLRDYDFELLGPLPEPNYHTMVVGPTASQCRVKYIKKKKAAA,./data/raw/alphafold//AF-A2TEF2-F1-model_v4.pdb,3129,406,466,558 +2499,34928,35540,MPHSHPALTPEQKKELSDIAHRIVAPGKGILAADESTGSIAKRLQSIGTENTEENRRFYRQLLLTADDRVNPCIGGVILFHETLYQKADDGRPFPQVIKSKGGVVGIKVDKGVVPLAGTNGETTTQGLDGLSERCAQYKKDGADFAKWRCVLKIGEHTPSALAIMENANVLARYASICQQNGIVPIVEPEILPDGDHDLKRCQYVTEKVLAAVYKALSDHHIYLEGTLLKPNMVTPGHACTQKYSHEEIAMATVTALRRTVPPAVTGVTFLSGGQSEEEASINLNAINKCPLLKPWALTFSYGRALQASALKAWGGKKENLKAAQEEYVKRALANSLACQGKYTPSGQAGAAASESLFISNHAY,brenda,P00883,O=P(O)(O)OC[C@@]1(O)O[C@H](CO)[C@@H](O)[C@@H]1O,40.0,22.0,7.75,4.1.2.13,9986.0,1.6020599913279625,1.0203604535653936,O=P(O)(O)OC[C@@]1(O)O[C@H](CO)[C@@H](O)[C@@H]1O__MPHSHPALTPEQKKELSDIAHRIVAPGKGILAADESTGSIAKRLQSIGTENTEENRRFYRQLLLTADDRVNPCIGGVILFHETLYQKADDGRPFPQVIKSKGGVVGIKVDKGVVPLAGTNGETTTQGLDGLSERCAQYKKDGADFAKWRCVLKIGEHTPSALAIMENANVLARYASICQQNGIVPIVEPEILPDGDHDLKRCQYVTEKVLAAVYKALSDHHIYLEGTLLKPNMVTPGHACTQKYSHEEIAMATVTALRRTVPPAVTGVTFLSGGQSEEEASINLNAINKCPLLKPWALTFSYGRALQASALKAWGGKKENLKAAQEEYVKRALANSLACQGKYTPSGQAGAAASESLFISNHAY,./data/raw/alphafold//AF-P00883-F1-model_v4.pdb,2212,7682,8865,9117 +2500,24709,25098,MTLQTTPLAATTQAPLGQHPLEQLSAHEIHQARRILADAGLVAETTRFAYLGLIEPPKAVFQADAADAPRLVRAMLWDAAQSRSLDVRLSLATGLVLDQRELNPEIDGQLPVLLEEFGIIEDILAVDPQWNAALASRGLTPAQVRVAPLSAGVFEYGNEEGKRLLRGLGFRQDHPADHPWAHPIDGLVAFVDIENRRVNHLIDDGPVPVPEVNGNYTDPTIHGELRTDLKPIEITQPEGPSFTLEGNHLSWAGWDLRVGFDAREGLVLHQLHHSHQGRRRPVVHRASISEMVVPYGDPSPYRSWQNYFDSGEYLVGRDANSLKLGCDCLGDITYMSPVVADDFGNPRVIENGICIHEEDAGILWKHTDEWAGSNEVRRNRRLVVSFFTTVGNYDYGFYWYLYLDGTIEFEAKATGIVFTAALPDKDYAYASEIAPGLGAPYHQHLFSARLDMMVDGGTNRVEELDLVRLPKGPGNPHGNAFTQKRTVLTRESEAVRDADGTKGRVWHISNPDSLNHLGHPVGYTLYPEGNPTLAMADDSSIASRAAFAKHHLWVTQHAEDELYAAGDFVNQHPGGAGLPSYVAQDRDIDGQDLVVWHSFGLTHFPRPEDWPIMPVDTTGFTLKPHGFFDQNPTLNVPSSSTGHCAPAEQNTGTCGH,brenda,A1R2C3,NCCc1cnc[nH]1,0.41,37.0,7.0,1.4.3.21,43663.0,-0.3872161432802645,-0.3872161432802645,NCCc1cnc[nH]1__MTLQTTPLAATTQAPLGQHPLEQLSAHEIHQARRILADAGLVAETTRFAYLGLIEPPKAVFQADAADAPRLVRAMLWDAAQSRSLDVRLSLATGLVLDQRELNPEIDGQLPVLLEEFGIIEDILAVDPQWNAALASRGLTPAQVRVAPLSAGVFEYGNEEGKRLLRGLGFRQDHPADHPWAHPIDGLVAFVDIENRRVNHLIDDGPVPVPEVNGNYTDPTIHGELRTDLKPIEITQPEGPSFTLEGNHLSWAGWDLRVGFDAREGLVLHQLHHSHQGRRRPVVHRASISEMVVPYGDPSPYRSWQNYFDSGEYLVGRDANSLKLGCDCLGDITYMSPVVADDFGNPRVIENGICIHEEDAGILWKHTDEWAGSNEVRRNRRLVVSFFTTVGNYDYGFYWYLYLDGTIEFEAKATGIVFTAALPDKDYAYASEIAPGLGAPYHQHLFSARLDMMVDGGTNRVEELDLVRLPKGPGNPHGNAFTQKRTVLTRESEAVRDADGTKGRVWHISNPDSLNHLGHPVGYTLYPEGNPTLAMADDSSIASRAAFAKHHLWVTQHAEDELYAAGDFVNQHPGGAGLPSYVAQDRDIDGQDLVVWHSFGLTHFPRPEDWPIMPVDTTGFTLKPHGFFDQNPTLNVPSSSTGHCAPAEQNTGTCGH,./data/raw/alphafold//AF-A1R2C3-F1-model_v4.pdb,4830,6061,7758,8151 +2501,18341,18605,MTSVPLPPLPAALAQYRPSAAATLGFRTPSSAPGVSASSSTRARRFSVIASAREMPWPHVLTVAGSDSSAGAGIQADIKACAALGAYCSSAITAVTAQNTVGVQGIHAVPEKFVGEQLRSVLSDMSVDVVKTGMLPSAGVVKVLCESLRKFPVKALVVDPVMVSTSGDTLSGPSTLATYRDELFSMADIVTPNVKEASKLLGDVSLHTISDMRNAAESIYKLGPKYVLVKGGDMPDSSDAIDVLFDGKEFTELRGLRIKTRNTHGTGCTLASCIAAELAKGATMLHAVQAAKKFVESALYHSKDLVIGNGPQGPFDHLFELKSPSYKMGSLQKFNPDDLFLYAVTDSGMNKKWGRSIKDAVKAAIEGGATIVQLREKDAETREFLEAAKACVEICKSLGVPLLINDRVDVALACDAGGVHVGQSDIPAWEVRGLLGPGKIIGVSCKTLAQAEQAWKDGADYIGCGGVFPTTTKANNPTLGFEGLRTVCLASKLPVVAIGGINAGNAGSVMELGLPNLKGVAVVSALFDRERVAAETRNLRSILMKNAHSRS,brenda,Q2UVH9,Cc1ncsc1CCOP(=O)(O)O,0.0085,37.0,8.0,2.5.1.3,4577.0,-2.070581074285707,-2.236839357885982,Cc1ncsc1CCOP(=O)(O)O__MTSVPLPPLPAALAQYRPSAAATLGFRTPSSAPGVSASSSTRARRFSVIASAREMPWPHVLTVAGSDSSAGAGIQADIKACAALGAYCSSAITAVTAQNTVGVQGIHAVPEKFVGEQLRSVLSDMSVDVVKTGMLPSAGVVKVLCESLRKFPVKALVVDPVMVSTSGDTLSGPSTLATYRDELFSMADIVTPNVKEASKLLGDVSLHTISDMRNAAESIYKLGPKYVLVKGGDMPDSSDAIDVLFDGKEFTELRGLRIKTRNTHGTGCTLASCIAAELAKGATMLHAVQAAKKFVESALYHSKDLVIGNGPQGPFDHLFELKSPSYKMGSLQKFNPDDLFLYAVTDSGMNKKWGRSIKDAVKAAIEGGATIVQLREKDAETREFLEAAKACVEICKSLGVPLLINDRVDVALACDAGGVHVGQSDIPAWEVRGLLGPGKIIGVSCKTLAQAEQAWKDGADYIGCGGVFPTTTKANNPTLGFEGLRTVCLASKLPVVAIGGINAGNAGSVMELGLPNLKGVAVVSALFDRERVAAETRNLRSILMKNAHSRS,./data/raw/alphafold//AF-Q2UVH9-F1-model_v4.pdb,3869,4481,5950,3325 +2502,22425,22774,MERQVPRVLLNSGHEMPVIGFGTAIDPLPEPEQLVSAILHAIEVGYRHFDTASAYMTEEPVGRAISEAMKRGLIKGREELFVTSKLWCADAHRDLIIPALKETLKRLGLDYLDLYLIHFPVRLKKEAVSLEHEIDDFRFEDHELLPFDIKGTWEAMEECSRLGLTKSIGVSNYGTVKISQLLQHATIPPAVNQVEMNVAWQQKKLREFCSKKGIHVTAWSPLAGIGAFWGSTVVIESKTLKEIAAAKGKSVAQVALRWIQDQGASCIVKSMNKDRMKQNLEIFGWKLSDEDGRKIEQIKQSRLYPAKLFINENSPYPSLEALWDGDL,sabio,E7C196,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1,0.0050999999999999,,6.8,1.1.1.334,289672.0,-2.292429823902072,-2.292429823902072,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1__MERQVPRVLLNSGHEMPVIGFGTAIDPLPEPEQLVSAILHAIEVGYRHFDTASAYMTEEPVGRAISEAMKRGLIKGREELFVTSKLWCADAHRDLIIPALKETLKRLGLDYLDLYLIHFPVRLKKEAVSLEHEIDDFRFEDHELLPFDIKGTWEAMEECSRLGLTKSIGVSNYGTVKISQLLQHATIPPAVNQVEMNVAWQQKKLREFCSKKGIHVTAWSPLAGIGAFWGSTVVIESKTLKEIAAAKGKSVAQVALRWIQDQGASCIVKSMNKDRMKQNLEIFGWKLSDEDGRKIEQIKQSRLYPAKLFINENSPYPSLEALWDGDL,./data/raw/alphafold//AF-E7C196-F1-model_v4.pdb,400,3448,4707,4960 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+2526,4533,4604,MAVLSSAKRVLPCASAGGVSGGLRALLGTDGGGRSLLPSRWKSSLPQLDPVDRSDEESGGDIDWDNLGFGLTPTDYMYVMRCSREEGGFSRGELARYGNIELSPSSGVLNYGQGLFEGLKAYRRSDGAGYMLFRPEENARRMQHGAGRMCMPSPSVEQFVHAVKQTVLANRRWVPPQGKGALYIRPLLIGSGAILGLAPAPEYTFMIYAAPVGTYFKEGMAAINLLVEEEIHRAMPGGTGGVKTISNYAPVLKPQMDAKSKGFADVLYLDAVHKRYVEEASSCNLFVVKGGAVATPATTAGTILPGVTRRSIIELARDDGYQVEERLVSIDDLVGADEVFCTGTAVGVTPVSTITYQGTRHEFRTGEDTLSRKLYTTLTSIQMGLAEDKKGWTVAID,uniprot_search,Q70KX9,CC(C)CC(=O)C(=O)O,0.1,30.0,8.4,2.6.1.42,4513.0,-1.0,-1.0,CC(C)CC(=O)C(=O)O__MAVLSSAKRVLPCASAGGVSGGLRALLGTDGGGRSLLPSRWKSSLPQLDPVDRSDEESGGDIDWDNLGFGLTPTDYMYVMRCSREEGGFSRGELARYGNIELSPSSGVLNYGQGLFEGLKAYRRSDGAGYMLFRPEENARRMQHGAGRMCMPSPSVEQFVHAVKQTVLANRRWVPPQGKGALYIRPLLIGSGAILGLAPAPEYTFMIYAAPVGTYFKEGMAAINLLVEEEIHRAMPGGTGGVKTISNYAPVLKPQMDAKSKGFADVLYLDAVHKRYVEEASSCNLFVVKGGAVATPATTAGTILPGVTRRSIIELARDDGYQVEERLVSIDDLVGADEVFCTGTAVGVTPVSTITYQGTRHEFRTGEDTLSRKLYTTLTSIQMGLAEDKKGWTVAID,./data/raw/alphafold//AF-Q70KX9-F1-model_v4.pdb,5081,1928,2759,2775 +2527,13330,13524,MLKVISSLLFYMTASLMAVASPLAHSGESRGEYPTVSEIPVGEVRLYQIDDGVWSHIATHTFDGVVYPSNGLIVRDGDELLLIDTAWGTKNTVALLAEIEKQIGLPVTRSVSTHFHDDRVGGVDALRAAGVATYASPSTRRLAEAEGNEVPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVLELSRTSAGNVADADLAEWPGSVERIQQHYPEAEVVIPGHGLPGGLDLLQHTANVVKAHTNRSVAE,sabio,Q2HY42,CON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[N+]3(C)CCCC3)CSC12)c1csc(N)n1,1.87,25.0,7.5,3.5.2.6,287.0,0.2718416065364989,0.2718416065364989,CON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[N+]3(C)CCCC3)CSC12)c1csc(N)n1__MLKVISSLLFYMTASLMAVASPLAHSGESRGEYPTVSEIPVGEVRLYQIDDGVWSHIATHTFDGVVYPSNGLIVRDGDELLLIDTAWGTKNTVALLAEIEKQIGLPVTRSVSTHFHDDRVGGVDALRAAGVATYASPSTRRLAEAEGNEVPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVLELSRTSAGNVADADLAEWPGSVERIQQHYPEAEVVIPGHGLPGGLDLLQHTANVVKAHTNRSVAE,./data/raw/alphafold//AF-Q2HY42-F1-model_v4.pdb,3553,1151,1857,1704 +2528,4900,4977,MASVWQRLGFYASLLKRQLNGGPDVIKWERRVIPGCTRSIYSATGKWTKEYTLQTRKDVEKWWHQRIKEQASKISEADKSKPKFYVLSMFPYPSGKLHMGHVRVYTISDTIARFQKMRGMQVINPMGWDAFGLPAENAAVERNLHPQSWTQSNIKHMRKQLDRLGLCFSWDREITTCLPDYYKWTQYLFIKLYEAGLAYQKEALVNWDPVDQTVLANEQVDEHGCSWRSGAKVEQKYLRQWFIKTTAYAKAMQDALADLPEWYGIKGMQAHWIGDCVGCHLDFTLKVHGQATGEKLTAYTATPEAIYGTSHVAISPSHRLLHGHSSLKEALRMALVPGKDCLTPVMAVNMLTQQEVPVVILAKADLEGSLDSKIGIPSTSSEDTILAQTLGLAYSEVIETLPDGTERLSSSAEFTGMTRQDAFLALTQKARGKRVGGDVTSDKLKDWLISRQRYWGTPIPIVHCPVCGPTPVPLEDLPVTLPNIASFTGKGGPPLAMASEWVNCSCPRCKGAAKRETDTMDTFVDSAWYYFRYTDPHNPHSPFNTAVADYWMPVDLYIGGKEHAVMHLFYARFFSHFCHDQKMVKHREPFHKLLAQGLIKGQTFRLPSGQYLQREEVDLTGSVPVHAKTKEKLEVTWEKMSKSKHNGVDPEEVVEQYGIDTIRLYILFAAPPEKDILWDVKTDALPGVLRWQQRLWTLTTRFIEARASGKSPQPQLLSNKEKAEARKLWEYKNSVISQVTTHFTEDFSLNSAISQLMGLSNALSQASQSVILHSPEFEDALCALMVMAAPLAPHVTSEIWAGLALVPRKLCAHYTWDASVLLQAWPAVDPEFLQQPEVVQMAVLINNKACGKIPVPQQVARDQDKVHEFVLQSELGVRLLQGRSIKKSFLSPRTALINFLVQD,brenda,Q15031,CC(C)C[C@H](N)C(=O)O,0.045,37.0,7.6,6.1.1.4,9606.0,-1.3467874862246565,-1.3467874862246565,CC(C)C[C@H](N)C(=O)O__MASVWQRLGFYASLLKRQLNGGPDVIKWERRVIPGCTRSIYSATGKWTKEYTLQTRKDVEKWWHQRIKEQASKISEADKSKPKFYVLSMFPYPSGKLHMGHVRVYTISDTIARFQKMRGMQVINPMGWDAFGLPAENAAVERNLHPQSWTQSNIKHMRKQLDRLGLCFSWDREITTCLPDYYKWTQYLFIKLYEAGLAYQKEALVNWDPVDQTVLANEQVDEHGCSWRSGAKVEQKYLRQWFIKTTAYAKAMQDALADLPEWYGIKGMQAHWIGDCVGCHLDFTLKVHGQATGEKLTAYTATPEAIYGTSHVAISPSHRLLHGHSSLKEALRMALVPGKDCLTPVMAVNMLTQQEVPVVILAKADLEGSLDSKIGIPSTSSEDTILAQTLGLAYSEVIETLPDGTERLSSSAEFTGMTRQDAFLALTQKARGKRVGGDVTSDKLKDWLISRQRYWGTPIPIVHCPVCGPTPVPLEDLPVTLPNIASFTGKGGPPLAMASEWVNCSCPRCKGAAKRETDTMDTFVDSAWYYFRYTDPHNPHSPFNTAVADYWMPVDLYIGGKEHAVMHLFYARFFSHFCHDQKMVKHREPFHKLLAQGLIKGQTFRLPSGQYLQREEVDLTGSVPVHAKTKEKLEVTWEKMSKSKHNGVDPEEVVEQYGIDTIRLYILFAAPPEKDILWDVKTDALPGVLRWQQRLWTLTTRFIEARASGKSPQPQLLSNKEKAEARKLWEYKNSVISQVTTHFTEDFSLNSAISQLMGLSNALSQASQSVILHSPEFEDALCALMVMAAPLAPHVTSEIWAGLALVPRKLCAHYTWDASVLLQAWPAVDPEFLQQPEVVQMAVLINNKACGKIPVPQQVARDQDKVHEFVLQSELGVRLLQGRSIKKSFLSPRTALINFLVQD,./data/raw/alphafold//AF-Q15031-F1-model_v4.pdb,2910,82,89,102 +2529,19089,19364,MQVESLKLLQEKIKNDEKNNSLTKKYLTEKIVEQYVGKRTSFGGTLAQCVNNNANNPGAILPRACDLNAYETFKDFFDPLIKDYHKVRGPEISHPASNFGDLANLKFKDLNDGSDMVVSTRVRLGRTVEGYGFGPTLTKEARLELESKIATALKNLTGEYKGTYHPLTGMKEEERVKLVEQHFLFRNDDSVLRDAGGYIDWPNGRGIFINDAQNFLVWINEEDHIRVISMQKGGDLIAIYKRLAGAINELSKTLKFAFNNRFGFITFCPSNLGTTLRASVHARVPFLSSLPNFNQICEKYAIQARGTHGEHTASVGGVYDLSNKRRLGLTEIDAVTEMYNGVRALLDLEKQLVSYNKDAPADVMPVEPLAYLSKLLETADPQKCLTRKHLTAEIIRKYDGVRTKHGATLAHMVRNCAYNPRAICPRTGEAECYSTFVDYLDAVICDYHDVKDPAFKHPAPTFGDLEHLPFGNVDPTGKFVISTRVRVGRSVQGFLFPTIIGKEDRLKLESTIANALTSLTGEHAGTYYPLSNMKEETRKQLVDDHFLFKNDDPVLRDAGGYRDWPTGRGIFHNNNKTFLVWVCEEDHMRVISMQQGGDLAAVFKRLIQGLKAIETKLKFEHSDKYGYVTCCPSNLGTTMRASVLVKIPKLSAQKDKLDEVCAKYRLQARGLHGEHTESPDGIHDISNKRRLGLTELDAAKEMAEGVAHIIAIEQSL,brenda,C7BCG0,N=C(N)NCCS(=O)(=O)O,0.57,,,2.7.3.4,34504.0,-0.2441251443275086,0.6400705622197351,N=C(N)NCCS(=O)(=O)O__MQVESLKLLQEKIKNDEKNNSLTKKYLTEKIVEQYVGKRTSFGGTLAQCVNNNANNPGAILPRACDLNAYETFKDFFDPLIKDYHKVRGPEISHPASNFGDLANLKFKDLNDGSDMVVSTRVRLGRTVEGYGFGPTLTKEARLELESKIATALKNLTGEYKGTYHPLTGMKEEERVKLVEQHFLFRNDDSVLRDAGGYIDWPNGRGIFINDAQNFLVWINEEDHIRVISMQKGGDLIAIYKRLAGAINELSKTLKFAFNNRFGFITFCPSNLGTTLRASVHARVPFLSSLPNFNQICEKYAIQARGTHGEHTASVGGVYDLSNKRRLGLTEIDAVTEMYNGVRALLDLEKQLVSYNKDAPADVMPVEPLAYLSKLLETADPQKCLTRKHLTAEIIRKYDGVRTKHGATLAHMVRNCAYNPRAICPRTGEAECYSTFVDYLDAVICDYHDVKDPAFKHPAPTFGDLEHLPFGNVDPTGKFVISTRVRVGRSVQGFLFPTIIGKEDRLKLESTIANALTSLTGEHAGTYYPLSNMKEETRKQLVDDHFLFKNDDPVLRDAGGYRDWPTGRGIFHNNNKTFLVWVCEEDHMRVISMQQGGDLAAVFKRLIQGLKAIETKLKFEHSDKYGYVTCCPSNLGTTMRASVLVKIPKLSAQKDKLDEVCAKYRLQARGLHGEHTESPDGIHDISNKRRLGLTELDAAKEMAEGVAHIIAIEQSL,./data/raw/alphafold//AF-C7BCG0-F1-model_v4.pdb,4014,4802,6632,6585 +2530,37841,38511,MDLGLAGRRALVTGAGKGIGRSTVLALQAAGAQVVAVSRTREDLDSLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVATLQPFLEVTKEACDTSFNVNFRAVVQVSQIVARGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTPMGRANWSDPHKAKVMLDRIPLGKFAEVENVVDTILFLLSNRSSMTTGSALPVDGGFLAT,sabio,Q920P0,OCC1(O)OCC(O)C1O,0.14,25.0,7.0,1.1.1.10,10116.0,-0.8538719643217619,-0.0792276777178112,OCC1(O)OCC(O)C1O__MDLGLAGRRALVTGAGKGIGRSTVLALQAAGAQVVAVSRTREDLDSLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVATLQPFLEVTKEACDTSFNVNFRAVVQVSQIVARGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTPMGRANWSDPHKAKVMLDRIPLGKFAEVENVVDTILFLLSNRSSMTTGSALPVDGGFLAT,./data/raw/alphafold//AF-Q920P0-F1-model_v4.pdb,3403,841,1006,1236 +2531,21395,21721,MAEAASCARKGTKYAEGTQPFTVLIEGNIGSGKTTYLNHFEKYKNDICLLTEPVEKWRNVNGVNLLELMYKDPKKWAMPFQSYVTLTMLQSHTAPTNKKLKIMERSIFSARYCFVENMRRNGSLEQGMYNTLEEWYKFIEESIHVQADLIIYLRTSPEVAYERIRQRARSEESCVPLKYLQELHELHEDWLIHQRRPQSCKVLVLDADLNLENIGTEYQRSESSIFDAISSNQQPSPVLVSPSKRQRVAR,brenda,Q9XZT6,N=c1ccn([C@@H]2O[C@H](CO)[C@@H](O)C2(F)F)c(O)n1,0.0207,37.0,8.0,2.7.1.145,7227.0,-1.6840296545430822,-1.6840296545430822,N=c1ccn([C@@H]2O[C@H](CO)[C@@H](O)C2(F)F)c(O)n1__MAEAASCARKGTKYAEGTQPFTVLIEGNIGSGKTTYLNHFEKYKNDICLLTEPVEKWRNVNGVNLLELMYKDPKKWAMPFQSYVTLTMLQSHTAPTNKKLKIMERSIFSARYCFVENMRRNGSLEQGMYNTLEEWYKFIEESIHVQADLIIYLRTSPEVAYERIRQRARSEESCVPLKYLQELHELHEDWLIHQRRPQSCKVLVLDADLNLENIGTEYQRSESSIFDAISSNQQPSPVLVSPSKRQRVAR,./data/raw/alphafold//AF-Q9XZT6-F1-model_v4.pdb,928,4412,5811,6230 +2532,40482,41216,MSIRSLGYMGFAVSDVAAWRSFLTQKLGLMEAGTTDNGDLFRIDSRAWRIAVQQGEVDDLAFAGYEVADAAGLAQMADKLKQAGIAVTTGDASLARRRGVTGLITFADPFGLPLEIYYGASEVFEKPFLPGAAVSGFMTGEQGLGHFVRCVPDSDKALAFYTDVLGFQLSDVIDMKMGPDVTVPVYFLHCNERHHTLAIAAFPLPKRIHHFMLQVASLDDVGFAFDRVDADGLITSTLGRHTNDHMVSFYASTPSGVEVEYGWSARTVDRSWVVVRHDSPSMWGHKSVRDKAAARNKA,brenda,F2X5L9,Oc1ccccc1O,0.606,40.0,9.0,1.13.11.39,77133.0,-0.2175273758337138,-0.2175273758337138,Oc1ccccc1O__MSIRSLGYMGFAVSDVAAWRSFLTQKLGLMEAGTTDNGDLFRIDSRAWRIAVQQGEVDDLAFAGYEVADAAGLAQMADKLKQAGIAVTTGDASLARRRGVTGLITFADPFGLPLEIYYGASEVFEKPFLPGAAVSGFMTGEQGLGHFVRCVPDSDKALAFYTDVLGFQLSDVIDMKMGPDVTVPVYFLHCNERHHTLAIAAFPLPKRIHHFMLQVASLDDVGFAFDRVDADGLITSTLGRHTNDHMVSFYASTPSGVEVEYGWSARTVDRSWVVVRHDSPSMWGHKSVRDKAAARNKA,./data/raw/alphafold//AF-F2X5L9-F1-model_v4.pdb,913,4354,5788,6224 +2533,31959,32521,MGSTGETQITPTHISDEEANLFAMQLASASVLPMILKSALELDLLEIIAKAGPGAQISPIEIASQLPTTNPDAPVMLDRMLRLLACYIILTCSVRTQQDGKVQRLYGLATVAKYLVKNEDGVSISALNLMNQDKVLMESWYHLKDAVLDGGIPFNKAYGMTAFEYHGTDPRFNKVFNKGMSDHSTITMKKILETYTGFEGLKSLVDVGGGTGAVINTIVSKYPTIKGINFDLPHVIEDAPSYPGVEHVGGDMFVSIPKADAVFMKWICHDWSDEHCLKFLKNCYEALPDNGKVIVAECILPVAPDSSLATKGVVHIDVIMLAHNPGGKERTQKEFEDLAKGAGFQGFKVHCNAFNTYIMEFLKKV,uniprot_search,P28002,O=C(O)c1ccc(O)c(O)c1,0.515,25.0,7.1,2.1.1.68,3879.0,-0.2881927709588089,-0.2881927709588089,O=C(O)c1ccc(O)c(O)c1__MGSTGETQITPTHISDEEANLFAMQLASASVLPMILKSALELDLLEIIAKAGPGAQISPIEIASQLPTTNPDAPVMLDRMLRLLACYIILTCSVRTQQDGKVQRLYGLATVAKYLVKNEDGVSISALNLMNQDKVLMESWYHLKDAVLDGGIPFNKAYGMTAFEYHGTDPRFNKVFNKGMSDHSTITMKKILETYTGFEGLKSLVDVGGGTGAVINTIVSKYPTIKGINFDLPHVIEDAPSYPGVEHVGGDMFVSIPKADAVFMKWICHDWSDEHCLKFLKNCYEALPDNGKVIVAECILPVAPDSSLATKGVVHIDVIMLAHNPGGKERTQKEFEDLAKGAGFQGFKVHCNAFNTYIMEFLKKV,./data/raw/alphafold//AF-P28002-F1-model_v4.pdb,1707,2396,8976,5052 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AEAGASLQAYQQRLLQQQMGSPVQPNPMSPQQHMLPNQAQSPHLQGQQIPNSLSNQVRSPQPVPSPRPQSQPPHSSPSPRMQPQPSPHHVSPQTSSPHPGLVAAQANPMEQGHFASPDQNSMLSQLASNPGMANLHGASATDLGLSTDNSDLNSNLSQSTLDIH,./data/raw/alphafold//AF-Q09472-F1-model_v4.pdb,2991,196,216,240 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+2682,34424,35029,MSLFNDKVAKLLAGHEALLMRKNEPVEEGNGVITRYRYPVLTAAHTPVFWRYDLNEETNPFLMERIGMNATLNAGAIKWDGKYLMLVRVEGADRKSFFAVAESPNGIDNFRFWEYPVTLPEDVVPATNVYDMRLTAHEDGWIYGIFCAERHDDNAPIGDLSSATATAGIARTKDLKNWERLPDLKTKSQQRNVVLHPEFVDGKYALYTRPQDGFIDTGSGGGIGWALIDDITHAEVGEEKIIDKRYYHTIKEVKNGEGPHPIKTPQGWLHLAHGVRNCAAGLRYVLYMYMTSLDDPTRLIASPAGYFMAPVGEERIGDVSNVLFSNGWIADDDGKVFIYYASSDTRMHVATSTIERLVDYCLHTPQDGFSSSASVEILKNLIERNLRLMK,brenda,Q5LH68,O=P(O)(O)O,2.0,30.0,7.5,2.4.1.281,817.0,0.3010299956639812,0.3010299956639812,O=P(O)(O)O__MSLFNDKVAKLLAGHEALLMRKNEPVEEGNGVITRYRYPVLTAAHTPVFWRYDLNEETNPFLMERIGMNATLNAGAIKWDGKYLMLVRVEGADRKSFFAVAESPNGIDNFRFWEYPVTLPEDVVPATNVYDMRLTAHEDGWIYGIFCAERHDDNAPIGDLSSATATAGIARTKDLKNWERLPDLKTKSQQRNVVLHPEFVDGKYALYTRPQDGFIDTGSGGGIGWALIDDITHAEVGEEKIIDKRYYHTIKEVKNGEGPHPIKTPQGWLHLAHGVRNCAAGLRYVLYMYMTSLDDPTRLIASPAGYFMAPVGEERIGDVSNVLFSNGWIADDDGKVFIYYASSDTRMHVATSTIERLVDYCLHTPQDGFSSSASVEILKNLIERNLRLMK,./data/raw/alphafold//AF-Q5LH68-F1-model_v4.pdb,653,7616,9381,10486 +2683,5129,5209,MKKVSTLDLLFVAIMGVSPAAFAADLIDVSKLPSKAAQGAPGPVTLQAAVGAGGADELKAIRSTTLPNGKQVTRYEQFHNGVRVVGEAITEVKGPGKSVAAQRSGHFVANIAADLPGSTTAAVSAEQVLAQAKSLKAQGRKTENDKVELVIRLGENNIAQLVYNVSYLIPGEGLSRPHFVIDAKTGEVLDQWEGLAHAEAGGPGGNQKIGKYTYGSDYGPLIVNDRCEMDDGNVITVDMNSSTDDSKTTPFRFACPTNTYKQVNGAYSPLNDAHFFGGVVFKLYRDWFGTSPLTHKLYMKVHYGRSVENAYWDGTAMLFGDGATMFYPLVSLDVAAHEVSHGFTEQNSGLIYRGQSGGMNEAFSDMAGEAAEFYMRGKNDFLIGYDIKKGSGALRYMDQPSRDGRSIDNASQYYNGIDVHHSSGVYNRAFYLLANSPGWDTRKAFEVFVDANRYYWTATSNYNSGACGVIRSAQNRNYSAADVTRAFSTVGVTCPSAL,brenda,P14756,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)/C=C/c1ccco1)C(O)=NCC(=O)O,0.18,55.0,6.659999999999999,3.4.24.26,287.0,-0.744727494896694,-0.744727494896694,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)/C=C/c1ccco1)C(O)=NCC(=O)O__MKKVSTLDLLFVAIMGVSPAAFAADLIDVSKLPSKAAQGAPGPVTLQAAVGAGGADELKAIRSTTLPNGKQVTRYEQFHNGVRVVGEAITEVKGPGKSVAAQRSGHFVANIAADLPGSTTAAVSAEQVLAQAKSLKAQGRKTENDKVELVIRLGENNIAQLVYNVSYLIPGEGLSRPHFVIDAKTGEVLDQWEGLAHAEAGGPGGNQKIGKYTYGSDYGPLIVNDRCEMDDGNVITVDMNSSTDDSKTTPFRFACPTNTYKQVNGAYSPLNDAHFFGGVVFKLYRDWFGTSPLTHKLYMKVHYGRSVENAYWDGTAMLFGDGATMFYPLVSLDVAAHEVSHGFTEQNSGLIYRGQSGGMNEAFSDMAGEAAEFYMRGKNDFLIGYDIKKGSGALRYMDQPSRDGRSIDNASQYYNGIDVHHSSGVYNRAFYLLANSPGWDTRKAFEVFVDANRYYWTATSNYNSGACGVIRSAQNRNYSAADVTRAFSTVGVTCPSAL,./data/raw/alphafold//AF-P14756-F1-model_v4.pdb,5145,2025,1512,3026 +2684,23453,23813,MSKHNWTLETQLVHNPFKTDGGTGAVSVPIQHASTFHQSSFEEFGAYDYSRSGTPTRTALEETIAALEGGTRGFAFSSGMAAISTAFLLLSQGDHVLVTEDVYGGTFRMVTEVLTRFGIEHTFVDMTDRNEVARSIKPNTKVIYMETPSNPTLGITDIKAVVQLAKENGCLTFLDNTFMTPALQRPLDLGVDIVLHSATKFLSGHSDVLSGLAAVKDEELGKQLYKLQNAFGAVLGVQDCWLVLRGLKTLQVRLEKASQTAQRLAEFFQKHPAVKRVYYPGLADHPGAETHKSQSTGAGAVLSFELESKEAVKKLVENVSLPVFAVSLGAVESILSYPATMSHAAMPKEEREKRGITDGLLRLSVGVEHADDLEHDFEQALKEIAPVSVR,sabio,O31632,NC(CCSCC(N)C(=O)O)C(=O)O,0.64,30.0,9.0,4.4.1.3,1423.0,-0.1938200260161128,-0.1938200260161128,NC(CCSCC(N)C(=O)O)C(=O)O__MSKHNWTLETQLVHNPFKTDGGTGAVSVPIQHASTFHQSSFEEFGAYDYSRSGTPTRTALEETIAALEGGTRGFAFSSGMAAISTAFLLLSQGDHVLVTEDVYGGTFRMVTEVLTRFGIEHTFVDMTDRNEVARSIKPNTKVIYMETPSNPTLGITDIKAVVQLAKENGCLTFLDNTFMTPALQRPLDLGVDIVLHSATKFLSGHSDVLSGLAAVKDEELGKQLYKLQNAFGAVLGVQDCWLVLRGLKTLQVRLEKASQTAQRLAEFFQKHPAVKRVYYPGLADHPGAETHKSQSTGAGAVLSFELESKEAVKKLVENVSLPVFAVSLGAVESILSYPATMSHAAMPKEEREKRGITDGLLRLSVGVEHADDLEHDFEQALKEIAPVSVR,./data/raw/alphafold//AF-O31632-F1-model_v4.pdb,4699,5873,7601,8555 +2685,35423,36042,MSTEHTNTPRADSPQSAAEAVRGARQHAPAATPAESDPILELAEAMEGPLRIPAHTPEAVRDTVASLEKRLIGGQREFRRREVASEAGVSLHSARKLWRAIGFPELSDDEVFFTEADKKALGTMVGMVREGALTEETAISLMRSVGQMTDRMVVWQIEALVEDMIANQNLSDRQARRQLFSLLPEIIPAIEDLLLYSWRRQLNSAVHRMALRVETGVAAYNQDRGEDDGGTPLPLARAVGFADLVSYTSLSRRMNERTLAQLVQRFEAKCAEIISVGGGRLVKTIGDEVLYVAETPQAGAQIALSLSRELAKDELFPQTRGAVVWGRLLSRLGDIYGPTVNMAARLTSLAEPGTVLTDAITANTLRNDARFVLTAQEITAVRGFGDIQPYELSAGEGAGLVID,uniprot_search,P27580,O=P(O)(O)OP(=O)(O)O,1.9,30.0,7.1,4.6.1.1,37929.0,0.2787536009528289,0.2787536009528289,O=P(O)(O)OP(=O)(O)O__MSTEHTNTPRADSPQSAAEAVRGARQHAPAATPAESDPILELAEAMEGPLRIPAHTPEAVRDTVASLEKRLIGGQREFRRREVASEAGVSLHSARKLWRAIGFPELSDDEVFFTEADKKALGTMVGMVREGALTEETAISLMRSVGQMTDRMVVWQIEALVEDMIANQNLSDRQARRQLFSLLPEIIPAIEDLLLYSWRRQLNSAVHRMALRVETGVAAYNQDRGEDDGGTPLPLARAVGFADLVSYTSLSRRMNERTLAQLVQRFEAKCAEIISVGGGRLVKTIGDEVLYVAETPQAGAQIALSLSRELAKDELFPQTRGAVVWGRLLSRLGDIYGPTVNMAARLTSLAEPGTVLTDAITANTLRNDARFVLTAQEITAVRGFGDIQPYELSAGEGAGLVID,./data/raw/alphafold//AF-P27580-F1-model_v4.pdb,1419,6677,6201,11927 +2686,29684,30211,MDIIFYHPTFDTQWWIEALRKAIPQARVRAWKSGDNDSADYALVWHPPVEMLAGRDLKAVFALGAGVDSILSKLQAHPEMLNPSVPLFRLEDTGMGEQMQEYAVSQVLHWFRRFDDYRIQQNSSHWQPLPEYHREDFTIGILGAGVLGSKVAQSLQTWRFPLRCWSRTRKSWPGVQSFAGREELSAFLSQCRVLINLLPNTPETVGIINQQLLEKLPDGAYLLNLARGVHVVEDDLLAALDSGKVKGAMLDVFNREPLPPESPLWQHPRVTITPHVAAITRPAEAVEYISRTIAQLEKGERVCGQVDRARGY,sabio,P75913,O=C(O)C(=O)CO,1.0,25.0,7.0,1.1.1.81,562.0,0.0,0.0,O=C(O)C(=O)CO__MDIIFYHPTFDTQWWIEALRKAIPQARVRAWKSGDNDSADYALVWHPPVEMLAGRDLKAVFALGAGVDSILSKLQAHPEMLNPSVPLFRLEDTGMGEQMQEYAVSQVLHWFRRFDDYRIQQNSSHWQPLPEYHREDFTIGILGAGVLGSKVAQSLQTWRFPLRCWSRTRKSWPGVQSFAGREELSAFLSQCRVLINLLPNTPETVGIINQQLLEKLPDGAYLLNLARGVHVVEDDLLAALDSGKVKGAMLDVFNREPLPPESPLWQHPRVTITPHVAAITRPAEAVEYISRTIAQLEKGERVCGQVDRARGY,./data/raw/alphafold//AF-P75913-F1-model_v4.pdb,1726,7118,9002,9278 +2687,28014,28496,MAASGEPQRQWQEEVAAVVVVGSCMTDLVSLTSRLPKTGETIHGHKFFIGFGGKGANQCVQAARLGAMTSMVCKVGKDSFGNDYIENLKQNDISTEFTYQTKDAATGTASIIVNNEGQNIIVIVAGANLLLNTEDLRAAANVISRAKVMVCQLEITPATSLEALTMARRSGVKTLFNPAPAIADLDPQFYTLSDVFCCNESEAEILTGLTVGSAADAGEAALVLLKRGCQVVIITLGAEGCVVLSQTEPEPKHIPTEKVKAVDTTGAGDSFVGALAFYLAYYPNLSLEDMLNRSNFIAAVSVQAAGTQSSYPYKKDLPLTLF,brenda,Q9H477,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.16,37.0,7.2,2.7.1.15,9606.0,-0.7958800173440752,-1.1667410097225597,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MAASGEPQRQWQEEVAAVVVVGSCMTDLVSLTSRLPKTGETIHGHKFFIGFGGKGANQCVQAARLGAMTSMVCKVGKDSFGNDYIENLKQNDISTEFTYQTKDAATGTASIIVNNEGQNIIVIVAGANLLLNTEDLRAAANVISRAKVMVCQLEITPATSLEALTMARRSGVKTLFNPAPAIADLDPQFYTLSDVFCCNESEAEILTGLTVGSAADAGEAALVLLKRGCQVVIITLGAEGCVVLSQTEPEPKHIPTEKVKAVDTTGAGDSFVGALAFYLAYYPNLSLEDMLNRSNFIAAVSVQAAGTQSSYPYKKDLPLTLF,./data/raw/alphafold//AF-Q9H477-F1-model_v4.pdb,1294,6521,8405,7894 +2688,4719,4792,MAVLSRMRLRWALLDTRVMGHGLCPQGARAKAAIPAALRDHESTEGPGTGQDRPRLRSLAELPGPGTLRFLFQLFLRGYVLHLHELQALNKAKYGPMWTTTFGTRTNVNLASAPLLEQVMRQEGKYPIRDSMEQWKEHRDHKGLSYGIFITQGQQWYHLRHSLNQRMLKPAEAALYTDALNEVISDFIARLDQVRTESASGDQVPDVAHLLYHLALEAICYILFEKRVGCLEPSIPEDTATFIRSVGLMFKNSVYVTFLPKWSRPLLPFWKRYMNNWDNIFSFGEKMIHQKVQEIEAQLQAAGPDGVQVSGYLHFLLTKELLSPQETVGTFPELILAGVDTTSNTLTWALYHLSKNPEIQEALHKEVTGVVPFGKVPQNKDFAHMPLLKAVIKETLRLYPVVPTNSRIITEKETEINGFLFPKNTQFVLCHYVVSRDPSVFPEPESFQPHRWLRKREDDNSGIQHPFGSVPFGYGVRSCLGRRIAELEMQLLLSRLIQKYEVVLSPGMGEVKSVSRIVLVPSKKVSLRFLQRQ,sabio,P17178,CC(C)CCCC(C)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CC(O)C12C,0.0045,30.0,7.7,1.14.15.15,10116.0,-2.3467874862246565,-2.3467874862246565,CC(C)CCCC(C)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CC(O)C12C__MAVLSRMRLRWALLDTRVMGHGLCPQGARAKAAIPAALRDHESTEGPGTGQDRPRLRSLAELPGPGTLRFLFQLFLRGYVLHLHELQALNKAKYGPMWTTTFGTRTNVNLASAPLLEQVMRQEGKYPIRDSMEQWKEHRDHKGLSYGIFITQGQQWYHLRHSLNQRMLKPAEAALYTDALNEVISDFIARLDQVRTESASGDQVPDVAHLLYHLALEAICYILFEKRVGCLEPSIPEDTATFIRSVGLMFKNSVYVTFLPKWSRPLLPFWKRYMNNWDNIFSFGEKMIHQKVQEIEAQLQAAGPDGVQVSGYLHFLLTKELLSPQETVGTFPELILAGVDTTSNTLTWALYHLSKNPEIQEALHKEVTGVVPFGKVPQNKDFAHMPLLKAVIKETLRLYPVVPTNSRIITEKETEINGFLFPKNTQFVLCHYVVSRDPSVFPEPESFQPHRWLRKREDDNSGIQHPFGSVPFGYGVRSCLGRRIAELEMQLLLSRLIQKYEVVLSPGMGEVKSVSRIVLVPSKKVSLRFLQRQ,./data/raw/alphafold//AF-P17178-F1-model_v4.pdb,3220,1959,1572,2912 +2689,28259,28749,MHTGGETSACKPSSVRLAPSFSFHAAGLQMAGQMPHSHQYSDRRQPNISDQQVSALSYSDQIQQPLTNQVMPDIVMLQRRMPQTFRDPATAPLRKLSVDLIKTYKHINEVYYAKKKRRHQQGQGDDSSHKKERKVYNDGYDDDNYDYIVKNGEKWMDRYEIDSLIGKGSFGQVVKAYDRVEQEWVAIKIIKNKKAFLNQAQIEVRLLELMNKHDTEMKYYIVHLKRHFMFRNHLCLVFEMLSYNLYDLLRNTNFRGVSLNLTRKFAQQMCTALLFLATPELSIIHCDLKPENILLCNPKRSAIKIVDFGSSCQLGQRIYQYIQSRFYRSPEVLLGMPYDLAIDMWSLGCILVEMHTGEPLFSGANEVDQMNKIVEVLGIPPAHILDQAPKARKFFEKLPDGTWNLKKTKDGKREYKPPGTRKLHNILGVETGGPGGRRAGESGHTVADYLKFKDLILRMLDYDPKTRIQPYYALQHSFFKKTADEGTNTSNSVSTSPAMEQSQSSGTTSSTSSSSGGSSGTSNSGRARSDPTHQHRHSGGHFTAAVQAMDCETHSPQVRQQFPAPLGWSGTEAPTQVTVETHPVQETTFHVAPQQNALHHHHGNSSHHHHHHHHHHHHHGQQALGNRTRPRVYNSPTNSSSTQDSMEVGHSHHSMTSLSSSTTSSSTSSSSTGNQGNQAYQNRPVAANTLDFGQNGAMDVNLTVYSNPRQETGIAGHPTYQFSANTGPAHYMTEGHLTMRQGADREESPMTGVCVQQSPVASS,brenda,Q13627,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.1185,22.0,6.8,2.7.12.1,9606.0,-0.9262816496538774,-0.9262816496538774,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MHTGGETSACKPSSVRLAPSFSFHAAGLQMAGQMPHSHQYSDRRQPNISDQQVSALSYSDQIQQPLTNQVMPDIVMLQRRMPQTFRDPATAPLRKLSVDLIKTYKHINEVYYAKKKRRHQQGQGDDSSHKKERKVYNDGYDDDNYDYIVKNGEKWMDRYEIDSLIGKGSFGQVVKAYDRVEQEWVAIKIIKNKKAFLNQAQIEVRLLELMNKHDTEMKYYIVHLKRHFMFRNHLCLVFEMLSYNLYDLLRNTNFRGVSLNLTRKFAQQMCTALLFLATPELSIIHCDLKPENILLCNPKRSAIKIVDFGSSCQLGQRIYQYIQSRFYRSPEVLLGMPYDLAIDMWSLGCILVEMHTGEPLFSGANEVDQMNKIVEVLGIPPAHILDQAPKARKFFEKLPDGTWNLKKTKDGKREYKPPGTRKLHNILGVETGGPGGRRAGESGHTVADYLKFKDLILRMLDYDPKTRIQPYYALQHSFFKKTADEGTNTSNSVSTSPAMEQSQSSGTTSSTSSSSGGSSGTSNSGRARSDPTHQHRHSGGHFTAAVQAMDCETHSPQVRQQFPAPLGWSGTEAPTQVTVETHPVQETTFHVAPQQNALHHHHGNSSHHHHHHHHHHHHHGQQALGNRTRPRVYNSPTNSSSTQDSMEVGHSHHSMTSLSSSTTSSSTSSSSTGNQGNQAYQNRPVAANTLDFGQNGAMDVNLTVYSNPRQETGIAGHPTYQFSANTGPAHYMTEGHLTMRQGADREESPMTGVCVQQSPVASS,./data/raw/alphafold//AF-Q13627-F1-model_v4.pdb,1494,6813,8650,8873 +2690,30520,31059,MKKCSYDYKLNNVNDPNFYKDIFPYEEVPKIVFNNIQLPMDLPDNIYITDTTFRDGQQSMPPYTSREIVRIFDYLHELDNNSGIIKQTEFFLYTKKDRKAAEVCMERGYEFPEVTSWIRADKEDLKLVKDMGIKETGMLMSCSDYHIFKKLKMTRKETMDMYLDLAREALNNGIRPRCHLEDITRADFYGFVVPFVNELMKMSKEANIPIKIRACDTLGLGVPYNGVEIPRSVQGIIHGLRNICEVPSESIEWHGHNDFYGVVTNSSTAWLYGASSINTSFLGIGERTGNCPLEAMIFEYAQIKGNTKNMKLHVITELAQYFEKEIKYSVPVRTPFVGTDFNVTRAGIHADGILKDEEIYNIFDTDKILGRPVVVAVSQYSGRAGIAAWVNTYYRLKDEDKVNKNDSRIDQIKMWVDEQYRAGRTSVIGNNELELLVSKVMPEVIEKTEERAS,sabio,A5N6T4,O=C(O)CC(=O)C(=O)O,0.04,25.0,8.0,2.3.3.3,1534.0,-1.3979400086720375,-1.3979400086720375,O=C(O)CC(=O)C(=O)O__MKKCSYDYKLNNVNDPNFYKDIFPYEEVPKIVFNNIQLPMDLPDNIYITDTTFRDGQQSMPPYTSREIVRIFDYLHELDNNSGIIKQTEFFLYTKKDRKAAEVCMERGYEFPEVTSWIRADKEDLKLVKDMGIKETGMLMSCSDYHIFKKLKMTRKETMDMYLDLAREALNNGIRPRCHLEDITRADFYGFVVPFVNELMKMSKEANIPIKIRACDTLGLGVPYNGVEIPRSVQGIIHGLRNICEVPSESIEWHGHNDFYGVVTNSSTAWLYGASSINTSFLGIGERTGNCPLEAMIFEYAQIKGNTKNMKLHVITELAQYFEKEIKYSVPVRTPFVGTDFNVTRAGIHADGILKDEEIYNIFDTDKILGRPVVVAVSQYSGRAGIAAWVNTYYRLKDEDKVNKNDSRIDQIKMWVDEQYRAGRTSVIGNNELELLVSKVMPEVIEKTEERAS,./data/raw/alphafold//AF-A5N6T4-F1-model_v4.pdb,3714,1382,2147,2053 +2691,11834,11998,MWLAAAAPSLARRLLFLGPPPPPLLLLVFSRSSRRRLHSLGLAAMPEKRPFERLPADVSPINYSLCLKPDLLDFTFEGKLEAAAQVRQATNQIVMNCADIDIITASYAPEGDEEIHATGFNYQNEDEKVTLSFPSTLQTGTGTLKIDFVGELNDKMKGFYRSKYTTPSGEVRYAAVTQFEATDARRAFPCWDEPAIKATFDISLVVPKDRVALSNMNVIDRKPYPDDENLVEVKFARTPVMSTYLVAFVVGEYDFVETRSKDGVCVRVYTPVGKAEQGKFALEVAAKTLPFYKDYFNVPYPLPKIDLIAIADFAAGAMENWGLVTYRETALLIDPKNSCSSSRQWVALVVGHELAHQWFGNLVTMEWWTHLWLNEGFASWIEYLCVDHCFPEYDIWTQFVSADYTRAQELDALDNSHPIEVSVGHPSEVDEIFDAISYSKGASVIRMLHDYIGDKDFKKGMNMYLTKFQQKNAATEDLWESLENASGKPIAAVMNTWTKQMGFPLIYVEAEQVEDDRLLRLSQKKFCAGGSYVGEDCPQWMVPITISTSEDPNQAKLKILMDKPEMNVVLKNVKPDQWVKLNLGTVGFYRTQYSSAMLESLLPGIRDLSLPPVDRLGLQNDLFSLARAGIISTVEVLKVMEAFVNEPNYTVWSDLSCNLGILSTLLSHTDFYEEIQEFVKDVFSPIGERLGWDPKPGEGHLDALLRGLVLGKLGKAGHKATLEEARRRFKDHVEGKQILSADLRSPVYLTVLKHGDGTTLDIMLKLHKQADMQEEKNRIERVLGATLLPDLIQKVLTFALSEEVRPQDTVSVIGGVAGGSKHGRKAAWKFIKDNWEELYNRYQGGFLISRLIKLSVEGFAVDKMAGEVKAFFESHPAPSAERTIQQCCENILLNAAWLKRDAESIHQYLLQRKASPPTV,uniprot_search,P55786,CC[C@H](C)[C@H](N)C(O)=Nc1ccc2ccccc2c1,0.048,37.0,6.8,3.4.11.14,9606.0,-1.3187587626244128,-1.3187587626244128,CC[C@H](C)[C@H](N)C(O)=Nc1ccc2ccccc2c1__MWLAAAAPSLARRLLFLGPPPPPLLLLVFSRSSRRRLHSLGLAAMPEKRPFERLPADVSPINYSLCLKPDLLDFTFEGKLEAAAQVRQATNQIVMNCADIDIITASYAPEGDEEIHATGFNYQNEDEKVTLSFPSTLQTGTGTLKIDFVGELNDKMKGFYRSKYTTPSGEVRYAAVTQFEATDARRAFPCWDEPAIKATFDISLVVPKDRVALSNMNVIDRKPYPDDENLVEVKFARTPVMSTYLVAFVVGEYDFVETRSKDGVCVRVYTPVGKAEQGKFALEVAAKTLPFYKDYFNVPYPLPKIDLIAIADFAAGAMENWGLVTYRETALLIDPKNSCSSSRQWVALVVGHELAHQWFGNLVTMEWWTHLWLNEGFASWIEYLCVDHCFPEYDIWTQFVSADYTRAQELDALDNSHPIEVSVGHPSEVDEIFDAISYSKGASVIRMLHDYIGDKDFKKGMNMYLTKFQQKNAATEDLWESLENASGKPIAAVMNTWTKQMGFPLIYVEAEQVEDDRLLRLSQKKFCAGGSYVGEDCPQWMVPITISTSEDPNQAKLKILMDKPEMNVVLKNVKPDQWVKLNLGTVGFYRTQYSSAMLESLLPGIRDLSLPPVDRLGLQNDLFSLARAGIISTVEVLKVMEAFVNEPNYTVWSDLSCNLGILSTLLSHTDFYEEIQEFVKDVFSPIGERLGWDPKPGEGHLDALLRGLVLGKLGKAGHKATLEEARRRFKDHVEGKQILSADLRSPVYLTVLKHGDGTTLDIMLKLHKQADMQEEKNRIERVLGATLLPDLIQKVLTFALSEEVRPQDTVSVIGGVAGGSKHGRKAAWKFIKDNWEELYNRYQGGFLISRLIKLSVEGFAVDKMAGEVKAFFESHPAPSAERTIQQCCENILLNAAWLKRDAESIHQYLLQRKASPPTV,./data/raw/alphafold//AF-P55786-F1-model_v4.pdb,5134,2006,1488,2992 +2692,38082,38755,MAAKLTRLHSLRERLGATFSSHPNELIALFSRYVHQGKGMLQRHQLLAEFDALFESDKEKYAPFEDILRAAQEAIVLPPWVALAIRPRTGVWDYIRVNVSELAVEELTVSEYLAFKEQLVDEHASRKFVLELDFEPFNASFPRPSMSKSYGKGVQFLNRHLSSKLFQDKESLYPLLNFLKAHNYKGTTMILNDRIQSLRGLQSALRKAEEYLVSIPEDTPSSEFNHRFQELGLEKGWGDTAKRVHDTIHLLLDLLEAPDPASLEKFLGTIPMMFNVVILSPHGYFAQSNVLGYPDTGGQVVYILDQVRALENEMLLRIKQQGLDITPKILIVTRLLPDAVGTTCGQRLEKVIGTEHTDILRVPFRTENGIRKWISRFDVWPYLETYTEDVANELMREMQTKPDLIIGNYSDGNLVATLLAHKLGVTQCTIAHALEKTKYPNSDIYLDKFDSQYHFSCQFTADLIAMNHTDFIITSTFQEIAGSKDSVGQYESHIAFTLPDLYRVVHGIDVFDPKFNIVSPGADMTVYFPYTETDKRLTAFHSEIEELLYSDVENDEHKFVLKDRNKPIIFSMARLDRVKNMTGLVEMYGKNAHLKDLANLVIVAGDHGKESKDREEQAEFKRMYSLIEEYKLKGHIRWISAQMNRVRNGELYRYICDTKGAFVQPAFYEAFGLTVIEAMTCGLPTIATCHGGPAEIIVDGVSGLHIDPYHSDKAADILVNFFEKSTADPSYWDKISQGGLKRIYEKYTWKLYSERLMTLTGVYGFWKYVSNLERRETRRYLEMFYALKYRSLAAAVPLAVDGESSGN,sabio,P31922,OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O,30.0,25.0,,2.4.1.13,4513.0,1.4771212547196624,1.4771212547196624,OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O__MAAKLTRLHSLRERLGATFSSHPNELIALFSRYVHQGKGMLQRHQLLAEFDALFESDKEKYAPFEDILRAAQEAIVLPPWVALAIRPRTGVWDYIRVNVSELAVEELTVSEYLAFKEQLVDEHASRKFVLELDFEPFNASFPRPSMSKSYGKGVQFLNRHLSSKLFQDKESLYPLLNFLKAHNYKGTTMILNDRIQSLRGLQSALRKAEEYLVSIPEDTPSSEFNHRFQELGLEKGWGDTAKRVHDTIHLLLDLLEAPDPASLEKFLGTIPMMFNVVILSPHGYFAQSNVLGYPDTGGQVVYILDQVRALENEMLLRIKQQGLDITPKILIVTRLLPDAVGTTCGQRLEKVIGTEHTDILRVPFRTENGIRKWISRFDVWPYLETYTEDVANELMREMQTKPDLIIGNYSDGNLVATLLAHKLGVTQCTIAHALEKTKYPNSDIYLDKFDSQYHFSCQFTADLIAMNHTDFIITSTFQEIAGSKDSVGQYESHIAFTLPDLYRVVHGIDVFDPKFNIVSPGADMTVYFPYTETDKRLTAFHSEIEELLYSDVENDEHKFVLKDRNKPIIFSMARLDRVKNMTGLVEMYGKNAHLKDLANLVIVAGDHGKESKDREEQAEFKRMYSLIEEYKLKGHIRWISAQMNRVRNGELYRYICDTKGAFVQPAFYEAFGLTVIEAMTCGLPTIATCHGGPAEIIVDGVSGLHIDPYHSDKAADILVNFFEKSTADPSYWDKISQGGLKRIYEKYTWKLYSERLMTLTGVYGFWKYVSNLERRETRRYLEMFYALKYRSLAAAVPLAVDGESSGN,./data/raw/alphafold//AF-P31922-F1-model_v4.pdb,2543,6505,10069,11256 +2693,5455,5540,MKAAVVEQFKEPLKIKEVEKPTISYGEVLVRIKACGVCHTDLHAAHGDWPVKPKLPLIPGHEGVGIVEEVGPGVTHLKVGDRVGIPWLYSACGHCDYCLSGQETLCEHQKNAGYSVDGGYAEYCRAAADYVVKIPDNLSFEEAAPIFCAGVTTYKALKVTGAKPGEWVAIYGIGGLGHVAVQYAKAMGLNVVAVDIGDEKLELAKELGADLVVNPLKEDAAKFMKEKVGGVHAAVVTAVSKPAFQSAYNSIRRGGACVLVGLPPEEMPIPIFDTVLNGIKIIGSIVGTRKDLQEALQFAAEGKVKTIIEVQPLEKINEVFDRMLKGQINGRVVLTLEDK,brenda,P42328,CC(C)O,1.26,23.0,7.5,1.1.1.1,1422.0,0.1003705451175629,0.1003705451175629,CC(C)O__MKAAVVEQFKEPLKIKEVEKPTISYGEVLVRIKACGVCHTDLHAAHGDWPVKPKLPLIPGHEGVGIVEEVGPGVTHLKVGDRVGIPWLYSACGHCDYCLSGQETLCEHQKNAGYSVDGGYAEYCRAAADYVVKIPDNLSFEEAAPIFCAGVTTYKALKVTGAKPGEWVAIYGIGGLGHVAVQYAKAMGLNVVAVDIGDEKLELAKELGADLVVNPLKEDAAKFMKEKVGGVHAAVVTAVSKPAFQSAYNSIRRGGACVLVGLPPEEMPIPIFDTVLNGIKIIGSIVGTRKDLQEALQFAAEGKVKTIIEVQPLEKINEVFDRMLKGQINGRVVLTLEDK,./data/raw/alphafold//AF-P42328-F1-model_v4.pdb,3774,3239,2275,2207 +2694,13728,13925,MTGITRRRLLSLGAGAAFLTAIRPFDSIAQDAHMGHGAASSATATAGRPLPLPPLIEPDASGVVKLKVQTGRHSFEEGSEAASAGINGAYLGPLVRLKNGETVTLSVENGMDEETTLHWHGLFVPSVLDGGPHNLIEAGAEWKPKVTVNQPASFNWFHPHLHGNTARQAHMGIAGLMVVTDGKDAERGLPEDYGVDDIPLVLQDRRVIEGDKVYQPDIMDLMHGFRGDKLIVNGVVSPEARVPVSIVRLRILNGANARNFHVRLSDNRPLLVIASDGGFIGKPEAVERLTISPGERYEVLVDFSKGEAADLLTYGDDSGGDDLHLMRFVVDSTLRGKITAVPDRLDGPDAADEKLSVKRRSFFFDERMAENMKLMMAKPPVDPHAGHNMGNMDMSSMSGAMDHDMHGARTSADAGPALEALTSGVEMAIAGKPFDMDRIDVEAKLGSWEIWDLTTKEMPHPFHIHGASFRILSLNGKAPPAHQSGWKDTALINGKAEILVHFDREGAKSHPFMFHCHVLEHEDVGMMAQFVTV,sabio,A6X5N0,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O,0.004,,7.0,1.10.3.2,42190.0,-2.397940008672037,-2.397940008672037,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O__MTGITRRRLLSLGAGAAFLTAIRPFDSIAQDAHMGHGAASSATATAGRPLPLPPLIEPDASGVVKLKVQTGRHSFEEGSEAASAGINGAYLGPLVRLKNGETVTLSVENGMDEETTLHWHGLFVPSVLDGGPHNLIEAGAEWKPKVTVNQPASFNWFHPHLHGNTARQAHMGIAGLMVVTDGKDAERGLPEDYGVDDIPLVLQDRRVIEGDKVYQPDIMDLMHGFRGDKLIVNGVVSPEARVPVSIVRLRILNGANARNFHVRLSDNRPLLVIASDGGFIGKPEAVERLTISPGERYEVLVDFSKGEAADLLTYGDDSGGDDLHLMRFVVDSTLRGKITAVPDRLDGPDAADEKLSVKRRSFFFDERMAENMKLMMAKPPVDPHAGHNMGNMDMSSMSGAMDHDMHGARTSADAGPALEALTSGVEMAIAGKPFDMDRIDVEAKLGSWEIWDLTTKEMPHPFHIHGASFRILSLNGKAPPAHQSGWKDTALINGKAEILVHFDREGAKSHPFMFHCHVLEHEDVGMMAQFVTV,./data/raw/alphafold//AF-A6X5N0-F1-model_v4.pdb,5286,1079,4139,1587 +2695,11616,11780,MRSALNILAGAATLTVAQAASLSDVCTNSHVKSALPSIDLINGLVIDPSSITTNAVYNASTPGGDYFPAASAYDFCNVTLTYAHPGRNDRVHLKLWMPAPDQFQNRWLSTGGGGFAINHDEQQLPGGVQYGAAAGITDGGFGSFYTQFDQVFLLANGTINYEALYMFGYQAHHELSVIGKALTKNFYGTGDAKLYAYWQGCSEGGREGFSQVQRFQEFDGAVIGAPALRYGQQQANHLYGNLVEHTLKYYPPPCELEKIVNLTITACDRLDGRSDGVVSRTDLCKLHFNINSTIGAPYSCPASTTTTGTTPAQNGTVSALGAAAARKMLDGLRTLDSRRAYIFYQPSATFDDAQTKYNPETKQFELEVSAYAAEWIPRFLQLQNYTLSSLENVTYDTLKDWMELGWQRYEDVLQTTWPDLTPFQSAGGKVLHYHGESDPSIPAGSSVHYHESVRKTMYPNMSFNESNQALNEWNRLFLVPGAAHCASSTDQPNGPFPQATLKTLIEWVENSIVPETLNGTVLDGDHKGEQQQICAWPLRPLWTENGTVMNCVYDQASLDTWDYEFDAYRIPLY,brenda,Q2UII1,CCOC(=O)c1ccc(O)c(O)c1,0.92,30.0,6.0,3.1.1.20,5062.0,-0.0362121726544447,-0.0362121726544447,CCOC(=O)c1ccc(O)c(O)c1__MRSALNILAGAATLTVAQAASLSDVCTNSHVKSALPSIDLINGLVIDPSSITTNAVYNASTPGGDYFPAASAYDFCNVTLTYAHPGRNDRVHLKLWMPAPDQFQNRWLSTGGGGFAINHDEQQLPGGVQYGAAAGITDGGFGSFYTQFDQVFLLANGTINYEALYMFGYQAHHELSVIGKALTKNFYGTGDAKLYAYWQGCSEGGREGFSQVQRFQEFDGAVIGAPALRYGQQQANHLYGNLVEHTLKYYPPPCELEKIVNLTITACDRLDGRSDGVVSRTDLCKLHFNINSTIGAPYSCPASTTTTGTTPAQNGTVSALGAAAARKMLDGLRTLDSRRAYIFYQPSATFDDAQTKYNPETKQFELEVSAYAAEWIPRFLQLQNYTLSSLENVTYDTLKDWMELGWQRYEDVLQTTWPDLTPFQSAGGKVLHYHGESDPSIPAGSSVHYHESVRKTMYPNMSFNESNQALNEWNRLFLVPGAAHCASSTDQPNGPFPQATLKTLIEWVENSIVPETLNGTVLDGDHKGEQQQICAWPLRPLWTENGTVMNCVYDQASLDTWDYEFDAYRIPLY,./data/raw/alphafold//AF-Q2UII1-F1-model_v4.pdb,308,3262,4015,4678 +2696,23738,24117,MPKIAVLGAGINGIASALAIQERLPNCEVTIIAEKFSPNTTSDVAAGLIEPFLCDDDVDRIINWTSATISRIHEYQADGNPGAEEQSGYWLQSVKSEPKWLKLMKNVHILTDAEMKQVARRPEHKFGIFYTTWYLEPTPYIKWCTDKFLKNGGKFKKQKIENIDDVARSYDVTVNCTGLGSRALIGDKEVYPTRGQILKVSCPRVKHFFIDDKYYALLNDSTITLGGTFEAHQWDLTINSELSQKILKENIHNIPSLRTAQILSSHVDMRPSRGTVRLQAELGRSLVHNYGHGGSGITLHWGCALECAEIVENVLKMKKSKL,sabio,Q95XG9,NC(Cc1ccccc1)C(=O)O,2.72,37.0,8.3,1.4.3.3,6239.0,0.4345689040341987,0.4345689040341987,NC(Cc1ccccc1)C(=O)O__MPKIAVLGAGINGIASALAIQERLPNCEVTIIAEKFSPNTTSDVAAGLIEPFLCDDDVDRIINWTSATISRIHEYQADGNPGAEEQSGYWLQSVKSEPKWLKLMKNVHILTDAEMKQVARRPEHKFGIFYTTWYLEPTPYIKWCTDKFLKNGGKFKKQKIENIDDVARSYDVTVNCTGLGSRALIGDKEVYPTRGQILKVSCPRVKHFFIDDKYYALLNDSTITLGGTFEAHQWDLTINSELSQKILKENIHNIPSLRTAQILSSHVDMRPSRGTVRLQAELGRSLVHNYGHGGSGITLHWGCALECAEIVENVLKMKKSKL,./data/raw/alphafold//AF-Q95XG9-F1-model_v4.pdb,5564,2318,2932,3388 +2697,40229,40962,VVSAGLIAGDFVTVLQALPRSEHQVVAVAARDLRRAEEFARTHGIPKAYGSYEELAKDPDVEVAYIGTQHPQHKAAVLLFLAAGKAVLCEKPLGVNAAEVREMVAEARSRGLFLMEAIWTRCFPAVDALKSLLAQGALGDLRVARAEFGENLTQVLRSVDWAQAGGGLLDLGIYCVQFISMVFGGQKPEKISAVGRRYETGVDDTVTVLLQYPGGVHGSFTCSISSKLSNTCSVSGTKGIAQLLEPCWCPTELVVNKERKEFPLAPEENKKFNYRNGMGMSYEAQHVRDCLRKGLKESPVIPLAESQLLADILEEVRKAIGVTFPQDKH,uniprot_search,Q9TV70,Oc1c(O)c2ccccc2c2ccccc12,0.05,37.0,7.4,1.3.1.20,9986.0,-1.3010299956639813,-1.3010299956639813,Oc1c(O)c2ccccc2c2ccccc12__VVSAGLIAGDFVTVLQALPRSEHQVVAVAARDLRRAEEFARTHGIPKAYGSYEELAKDPDVEVAYIGTQHPQHKAAVLLFLAAGKAVLCEKPLGVNAAEVREMVAEARSRGLFLMEAIWTRCFPAVDALKSLLAQGALGDLRVARAEFGENLTQVLRSVDWAQAGGGLLDLGIYCVQFISMVFGGQKPEKISAVGRRYETGVDDTVTVLLQYPGGVHGSFTCSISSKLSNTCSVSGTKGIAQLLEPCWCPTELVVNKERKEFPLAPEENKKFNYRNGMGMSYEAQHVRDCLRKGLKESPVIPLAESQLLADILEEVRKAIGVTFPQDKH,./data/raw/alphafold//AF-Q9TV70-F1-model_v4.pdb,3396,839,3387,3915 +2698,286,298,MASKKHVVCQSCDINCVVEAEVKADGKIQTKSISEPHPTTPPNSICMKSVNADTIRTHKDRVLYPLKNVGSKRGEQRWERISWDQALDEIAEKLKKIIAKYGPESLGVSQTEINQQSEYGTLRRFMNLLGSPNWTSAMYMCIGNTAGVHRVTHGSYSFASFADSNCLLFIGKNLSNHNWVSQFNDLKAALKRGCKLIVLDPRRTKVAEMADIWLPLRYGTDAALFLGMINVIINEQLYDKEFVENWCVGFEELKERVQEYPLDKVAEITGCDAGEIRKAAVMFATESPASIPWAVSTDMQKNSCSAIRAQCILRAIVGSFVNGAEILGAPHSDLVPISKIQMHEALPEEKKKLQLGTETYPFLTYTGMSALEEPSERVYGVKYFHNMGAFMANPTALFTAMATEKPYPVKAFFALASNALMGYANQQNALKGLMNQDLVVCYDQFMTPTAQLADYVLPGDHWLERPVVQPNWEGIPFGNTSQQVVEPAGEAKDEYYFIRELAVRMGLEEHFPWKDRLELINYRISPTGMEWEEYQKQYTYMSKLPDYFGPEGVGVATPSGKVELYSSVFEKLGYDPLPYYHEPLQTEISDPELAKEYPLILFAGLREDSNFQSCYHQPGILRDAEPDPVALLHPKTAQSLGLPSGEWIWVETTHGRLKLLLKHDGAQPEGTIRIPHGRWCPEQEGGPETGFSGAMLHNDAMVLSDDDWNLDPEQGLPNLRGGILAKAYKC,uniprot_search,Q71EW5,C#C,0.014,30.0,7.5,4.2.1.112,29542.0,-1.853871964321762,-1.853871964321762,C#C__MASKKHVVCQSCDINCVVEAEVKADGKIQTKSISEPHPTTPPNSICMKSVNADTIRTHKDRVLYPLKNVGSKRGEQRWERISWDQALDEIAEKLKKIIAKYGPESLGVSQTEINQQSEYGTLRRFMNLLGSPNWTSAMYMCIGNTAGVHRVTHGSYSFASFADSNCLLFIGKNLSNHNWVSQFNDLKAALKRGCKLIVLDPRRTKVAEMADIWLPLRYGTDAALFLGMINVIINEQLYDKEFVENWCVGFEELKERVQEYPLDKVAEITGCDAGEIRKAAVMFATESPASIPWAVSTDMQKNSCSAIRAQCILRAIVGSFVNGAEILGAPHSDLVPISKIQMHEALPEEKKKLQLGTETYPFLTYTGMSALEEPSERVYGVKYFHNMGAFMANPTALFTAMATEKPYPVKAFFALASNALMGYANQQNALKGLMNQDLVVCYDQFMTPTAQLADYVLPGDHWLERPVVQPNWEGIPFGNTSQQVVEPAGEAKDEYYFIRELAVRMGLEEHFPWKDRLELINYRISPTGMEWEEYQKQYTYMSKLPDYFGPEGVGVATPSGKVELYSSVFEKLGYDPLPYYHEPLQTEISDPELAKEYPLILFAGLREDSNFQSCYHQPGILRDAEPDPVALLHPKTAQSLGLPSGEWIWVETTHGRLKLLLKHDGAQPEGTIRIPHGRWCPEQEGGPETGFSGAMLHNDAMVLSDDDWNLDPEQGLPNLRGGILAKAYKC,./data/raw/alphafold//AF-Q71EW5-F1-model_v4.pdb,2989,194,213,235 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+2710,36578,37216,MLSNARIIAAGCIAAGSLVAAGPCDIYSSGGTPCVAAHSTTRALFSAYTGPLYQVKRGSDGATTAISPLSSGVANAAAQDAFCAGTTCLITIIYDQSGRGNHLREAPPGGFSGPESNGYDNLASAIGAPVTLNGQKAYGVFVSPGTGYRNNAASGTAKGDAAEGMYAVLDGTHYNGACCFDYGNAETNSRDTGNGHMEAIYFGDSTVWGTGSGKGPWIMADLENGLFSGSSPGNNAGDPSISYRFVTAAIKGQPNQWAIRGGNAASGSLSTFYSGARPQVSGYNPMSKEGAIILGIGGDNSNGGQGTFYEGVMTSGYPSDATENSVQANIVAARYAVAPLTSGPALTVGSSISLRATTACCTTRYIAHSGSTVNTQVVSSSSATALKQQASWTVRAGLANNACFSFESQDTSGSYIRHSNFGLVLNANDGSKLFAEDATFCTQAGINGQGSSIRSWSYPTRYFRHYNNTLYIASNGGVHVFDATAAFNDDVSFVVSGGFA,uniprot_search,P48792,O=[N+]([O-])c1cccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)c1,0.54,25.0,3.0,3.2.1.55,97093.0,-0.2676062401770315,-0.2676062401770315,O=[N+]([O-])c1cccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)c1__MLSNARIIAAGCIAAGSLVAAGPCDIYSSGGTPCVAAHSTTRALFSAYTGPLYQVKRGSDGATTAISPLSSGVANAAAQDAFCAGTTCLITIIYDQSGRGNHLREAPPGGFSGPESNGYDNLASAIGAPVTLNGQKAYGVFVSPGTGYRNNAASGTAKGDAAEGMYAVLDGTHYNGACCFDYGNAETNSRDTGNGHMEAIYFGDSTVWGTGSGKGPWIMADLENGLFSGSSPGNNAGDPSISYRFVTAAIKGQPNQWAIRGGNAASGSLSTFYSGARPQVSGYNPMSKEGAIILGIGGDNSNGGQGTFYEGVMTSGYPSDATENSVQANIVAARYAVAPLTSGPALTVGSSISLRATTACCTTRYIAHSGSTVNTQVVSSSSATALKQQASWTVRAGLANNACFSFESQDTSGSYIRHSNFGLVLNANDGSKLFAEDATFCTQAGINGQGSSIRSWSYPTRYFRHYNNTLYIASNGGVHVFDATAAFNDDVSFVVSGGFA,./data/raw/alphafold//AF-P48792-F1-model_v4.pdb,2445,8043,6503,6432 +2711,31046,31600,MGTKGKVIKCKAAIAWEAGKPLCIEEVEVAPPKAHEVRIQIIATSLCHTDATVIDSKFEGLAFPVIVGHEAAGIVESIGPGVTNVKPGDKVIPLYAPLCRKCKFCLSPLTNLCGKISNLKSPASDQQLMEDKTSRFTCKGKPVYHFFGTSTFSQYTVVSDINLAKIDDDANLERVCLLGCGFSTGYGAAINNAKVTPGSTCAVFGLGGVGLSAVMGCKAAGASRIIGIDINSEKFVKAKALGATDCLNPRDLHKPIQEVIIELTKGGVDFALDCAGGSETMKAALDCTTAGWGSCTFIGVAAGSKGLTIFPEELIIGRTINGTFFGGWKSVDSIPKLVTDYKNKKFNLDALVTHTLPFDKISEAFDLMNQGKSVRTILIF,sabio,P08319,O=C(O)CCCCCCCCCCCO,0.23,25.0,10.0,1.1.1.1,9606.0,-0.6382721639824072,-0.6382721639824072,O=C(O)CCCCCCCCCCCO__MGTKGKVIKCKAAIAWEAGKPLCIEEVEVAPPKAHEVRIQIIATSLCHTDATVIDSKFEGLAFPVIVGHEAAGIVESIGPGVTNVKPGDKVIPLYAPLCRKCKFCLSPLTNLCGKISNLKSPASDQQLMEDKTSRFTCKGKPVYHFFGTSTFSQYTVVSDINLAKIDDDANLERVCLLGCGFSTGYGAAINNAKVTPGSTCAVFGLGGVGLSAVMGCKAAGASRIIGIDINSEKFVKAKALGATDCLNPRDLHKPIQEVIIELTKGGVDFALDCAGGSETMKAALDCTTAGWGSCTFIGVAAGSKGLTIFPEELIIGRTINGTFFGGWKSVDSIPKLVTDYKNKKFNLDALVTHTLPFDKISEAFDLMNQGKSVRTILIF,./data/raw/alphafold//AF-P08319-F1-model_v4.pdb,5403,3181,1361,3127 +2712,485,501,MVPAAQQTATAPDAALTFPEGFLWGSATASYQIEGAAAEDGRTPSIWDTYARTPGRVRNGDTGDVATDHYHRWREDVALMAELGLGAYRFSLAWPRIQPTGRGPALQKGLDFYRRLADELLAKGIQPVATLYHWDLPQELENPGGWPERPTAERFAEYAAIAADALGDRVKTWTTLNEPWCSAFLGYGSGVHAPGRTDPVAALRAAHHLNLGHGLAVQALRDRLPADAQCSVTLNIHHVRPLTDSEADADAVRRIDALANRVFTGPMLQGAYPEDLVKDTAGLTDWSFVRDGDLRLAHQKLDFLGVNYYSPTLVSEADGSGTHNSDGHGRSAHSPWPGADRVAFHQPPGETTAMGWAVDPSGLYELLRRLSSDFPALPLVITENGAAFHDYADPEGNVNDPERIAYVRDHLAAVHRAIKDGSDVRGYFLWSLLDNFEWAHGYSKRFGAVYVDYPTGTRIPKASARWYAEVARTGVLPTA,brenda,Q59976,C/C=C1/[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)OCCc1ccc(O)c(O)c1,1.86,35.0,7.2,3.2.1.206,1931.0,0.2695129442179163,0.2695129442179163,C/C=C1/[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)OCCc1ccc(O)c(O)c1__MVPAAQQTATAPDAALTFPEGFLWGSATASYQIEGAAAEDGRTPSIWDTYARTPGRVRNGDTGDVATDHYHRWREDVALMAELGLGAYRFSLAWPRIQPTGRGPALQKGLDFYRRLADELLAKGIQPVATLYHWDLPQELENPGGWPERPTAERFAEYAAIAADALGDRVKTWTTLNEPWCSAFLGYGSGVHAPGRTDPVAALRAAHHLNLGHGLAVQALRDRLPADAQCSVTLNIHHVRPLTDSEADADAVRRIDALANRVFTGPMLQGAYPEDLVKDTAGLTDWSFVRDGDLRLAHQKLDFLGVNYYSPTLVSEADGSGTHNSDGHGRSAHSPWPGADRVAFHQPPGETTAMGWAVDPSGLYELLRRLSSDFPALPLVITENGAAFHDYADPEGNVNDPERIAYVRDHLAAVHRAIKDGSDVRGYFLWSLLDNFEWAHGYSKRFGAVYVDYPTGTRIPKASARWYAEVARTGVLPTA,./data/raw/alphafold//AF-Q59976-F1-model_v4.pdb,2674,305,348,407 +2713,33831,34430,MKSFYNLALCLGALFNAATAIPPEQQGQQPGKFAAAPPVGSNPIDRKGWTVKCSSQASNYPCGRAIDGDKNTFWQTPYGTTNTPPPHTITIDMKQTQYVSGLQITPRQDGNTRNWIGRHEVYLSSDGTNWGKPVAFGTYWGDKYPWITNFEIQPARYLRFVALSNVNPDYPWIAIADFVVYNALKYSPPAKGLGKWGPTLDFPVIPVAGAVEPVSGKVVIWSAYRYDAFQGTTPRGGFTLTSIWDPKTNVISNRNVSNNHHDMFCPGISMDGEGQIVVTGGNDAKKTTILMPDGNWVPGPDMQIARGYQSSATCSDGRVFTIGGSWSGPRGGKNGEIYDPKAKTWTSLPKCLVGPMLTKDKEGVYKADNHAWLFGWKKNSVFQAGPSTAMNWYYTTRGTQGDTKAAGTRRKNGRIDPDSMNGNVAMFDALNGKILTFGGATSYQQAPATANAHVLTIDEPGAIAQTALVGNNGAGIHARVFATSVILPDGNVFITGGQSYSDPFTDTNAQLEPEMFISSSNTFTKQQTNTIPRTYHSMSLLLPDATVFNGGGGLCGGCKTNHFDAQIFTPQYLLDGNGNLATRPKITAVSATTAKVGSTITVTANSAIKSASLIRYGTATHVVNTDQRRIPLALTGAGTNKYSFKIPNDSGIALPGYWMLFVLNNAGVPSVASTIKVTI,brenda,E6PBN4,O=Cc1ccc(CO)o1,17.0,25.0,7.5,1.1.3.47,59765.0,1.230448921378274,1.230448921378274,O=Cc1ccc(CO)o1__MKSFYNLALCLGALFNAATAIPPEQQGQQPGKFAAAPPVGSNPIDRKGWTVKCSSQASNYPCGRAIDGDKNTFWQTPYGTTNTPPPHTITIDMKQTQYVSGLQITPRQDGNTRNWIGRHEVYLSSDGTNWGKPVAFGTYWGDKYPWITNFEIQPARYLRFVALSNVNPDYPWIAIADFVVYNALKYSPPAKGLGKWGPTLDFPVIPVAGAVEPVSGKVVIWSAYRYDAFQGTTPRGGFTLTSIWDPKTNVISNRNVSNNHHDMFCPGISMDGEGQIVVTGGNDAKKTTILMPDGNWVPGPDMQIARGYQSSATCSDGRVFTIGGSWSGPRGGKNGEIYDPKAKTWTSLPKCLVGPMLTKDKEGVYKADNHAWLFGWKKNSVFQAGPSTAMNWYYTTRGTQGDTKAAGTRRKNGRIDPDSMNGNVAMFDALNGKILTFGGATSYQQAPATANAHVLTIDEPGAIAQTALVGNNGAGIHARVFATSVILPDGNVFITGGQSYSDPFTDTNAQLEPEMFISSSNTFTKQQTNTIPRTYHSMSLLLPDATVFNGGGGLCGGCKTNHFDAQIFTPQYLLDGNGNLATRPKITAVSATTAKVGSTITVTANSAIKSASLIRYGTATHVVNTDQRRIPLALTGAGTNKYSFKIPNDSGIALPGYWMLFVLNNAGVPSVASTIKVTI,./data/raw/alphafold//AF-E6PBN4-F1-model_v4.pdb,382,3588,4903,5204 +2714,28389,28886,MNAALSQWKDAHAARLRDYSAVRVSGRVSAVRGILLECKIPAAKVGDLCEVSKADGSFLLAEIVGFTQECTLLSALGAPDGIQVGAPIRPLGIAHRIGVDDSLLGCVLDGFGRPLLGDCLGAFAGPDDRRETLPVIADALPPTQRPRITNALPTGVRAIDSAILLGEGQRVGLFAGAGCGKTTLMAELARNMGCDVIVFGLIGERGRELREFLDHELDETLRRRSVLVCATSDRSSMERARAAFTATAIAEAFRARGQKVLLLLDSLTRFARAQREIGIASGEPLGRGGLPPSVYTLLPRLVERAGMSENGSITALYTVLIEQDSMNDPVADEVRSLLDGHIVLSRKLAERGHYPAIDVSASISRILSNVTGREHQRANNRLRQLLAAYKQVEMLLRLGEYQAGADPVTDCAVQLNDDINEFLRQDLREPVPLQETLDGLLRLTSRLPE,brenda,Q8RK01,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.114,30.0,8.0,7.4.2.8,623.0,-0.9430951486635274,-0.4145758981783453,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MNAALSQWKDAHAARLRDYSAVRVSGRVSAVRGILLECKIPAAKVGDLCEVSKADGSFLLAEIVGFTQECTLLSALGAPDGIQVGAPIRPLGIAHRIGVDDSLLGCVLDGFGRPLLGDCLGAFAGPDDRRETLPVIADALPPTQRPRITNALPTGVRAIDSAILLGEGQRVGLFAGAGCGKTTLMAELARNMGCDVIVFGLIGERGRELREFLDHELDETLRRRSVLVCATSDRSSMERARAAFTATAIAEAFRARGQKVLLLLDSLTRFARAQREIGIASGEPLGRGGLPPSVYTLLPRLVERAGMSENGSITALYTVLIEQDSMNDPVADEVRSLLDGHIVLSRKLAERGHYPAIDVSASISRILSNVTGREHQRANNRLRQLLAAYKQVEMLLRLGEYQAGADPVTDCAVQLNDDINEFLRQDLREPVPLQETLDGLLRLTSRLPE,./data/raw/alphafold//AF-Q8RK01-F1-model_v4.pdb,1529,6845,8686,8911 +2715,3107,3160,MSMKQTSVFLLIQLICYFRPGACGKVLVWPTEYSHWINIKIILNELAQRGHEVTVLVSSASILIEPTKESSINFEIYSVPLSKSDLEYSFAKWIDEWTRDFETLSIWTYYSKMQKVFNEYSDVVENLCKALIWNKSLMKKLQGSQFDVILADAVGPCGELLAELLKTPLVYSLRFCPGYRCEKFSGGLPLPPSYVPVVLSELSDRMTFVERVKNMLQMLYFDFWFQPFKEKSWSQFYSDVLGRPTTLTEMMGKADIWLIRTFWDLEFPHPFLPNFDFVGGLHCKPAKPLPREMEEFVQSSGEHGVVVFSLGSMVKNLTEEKANVVASALAQIPQKVVWRFDGKKPDTLGSNTRLYKWIPQNDLLGHPKTKAFVAHGGTNGIYEAIYHGIPIVGIPLFADQPDNINHMVAKGAAVRVDFSILSTTGLLTALKIVMNDPSYKENAMRLSRIHHDQPVKPLDRAVFWIEYVMRHKGAKHLRSTLHDLSWFQYHSLDVIGFLLLCVVGVVFIITKFCLFCCRKTANMGKKKKE,sabio,P09875,CC(C)(C)CC(C)(C)c1ccc(O)cc1,0.017,37.0,7.4,2.4.1.17,10116.0,-1.769551078621726,-1.160124711217477,CC(C)(C)CC(C)(C)c1ccc(O)cc1__MSMKQTSVFLLIQLICYFRPGACGKVLVWPTEYSHWINIKIILNELAQRGHEVTVLVSSASILIEPTKESSINFEIYSVPLSKSDLEYSFAKWIDEWTRDFETLSIWTYYSKMQKVFNEYSDVVENLCKALIWNKSLMKKLQGSQFDVILADAVGPCGELLAELLKTPLVYSLRFCPGYRCEKFSGGLPLPPSYVPVVLSELSDRMTFVERVKNMLQMLYFDFWFQPFKEKSWSQFYSDVLGRPTTLTEMMGKADIWLIRTFWDLEFPHPFLPNFDFVGGLHCKPAKPLPREMEEFVQSSGEHGVVVFSLGSMVKNLTEEKANVVASALAQIPQKVVWRFDGKKPDTLGSNTRLYKWIPQNDLLGHPKTKAFVAHGGTNGIYEAIYHGIPIVGIPLFADQPDNINHMVAKGAAVRVDFSILSTTGLLTALKIVMNDPSYKENAMRLSRIHHDQPVKPLDRAVFWIEYVMRHKGAKHLRSTLHDLSWFQYHSLDVIGFLLLCVVGVVFIITKFCLFCCRKTANMGKKKKE,./data/raw/alphafold//AF-P09875-F1-model_v4.pdb,681,3375,2273,2205 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+2717,17333,17583,MDLWNLSWFLFLDALLVISGLATPENFDVDGGMDQDIFDINEGLGLDLFEGDIRLDRAQIRNSIIGEKYRWPHTIPYVLEDSLEMNAKGVILNAFERYRLKTCIDFKPWAGETNYISVFKGSGCWSSVGNRRVGKQELSIGANCDRIATVQHEFLHALGFWHEQSRSDRDDYVRIMWDRILSGREHNFNTYSDDISDSLNVPYDYTSVMHYSKTAFQNGTEPTIVTRISDFEDVIGQRMDFSDSDLLKLNQLYNCSSSLSFMDSCSFELENVCGMIQSSGDNADWQRVSQVPRGPESDHSNMGQCQGSGFFMHFDSSSVNVGATAVLESRTLYPKRGFQCLQFYLYNSGSESDQLNIYIREYSADNVDGNLTLVEEIKEIPTGSWQLYHVTLKVTKKFRVVFEGRKGSGASLGGLSIDDINLSETRCPHHIWHIRNFTQFIGSPNGTLYSPPFYSSKGYAFQIYLNLAHVTNAGIYFHLISGANDDQLQWPCPWQQATMTLLDQNPDIRQRMSNQRSITTDPFMTTDNGNYFWDRPSKVGTVALFSNGTQFRRGGGYGTSAFITHERLKSRDFIKGDDVYILLTVEDISHLNSTQIQLTPAPSVQDLCSKTTCKNDGVCTVRDGKAECRCQSGEDWWYMGERCEKRGSTRDTIVIAVSSTVAVFALMLIITLVSVYCTRKKYRERMSSNRPNLTPQNQHAF,brenda,Q16820,Cc1cc(=O)oc2cc(N=C(O)[C@@H]3CCCN3C(=O)[C@H](C)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](C)N=C(O)[C@@H](N=C(O)[C@H](Cc3ccc(O)cc3)N=C(O)CN=C(O)[C@H](CCCCN)N=C(O)[C@@H](N)CCCCN)C(C)C)ccc12,0.074,30.0,7.5,3.4.24.63,9606.0,-1.1307682802690238,-1.1307682802690238,Cc1cc(=O)oc2cc(N=C(O)[C@@H]3CCCN3C(=O)[C@H](C)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](C)N=C(O)[C@@H](N=C(O)[C@H](Cc3ccc(O)cc3)N=C(O)CN=C(O)[C@H](CCCCN)N=C(O)[C@@H](N)CCCCN)C(C)C)ccc12__MDLWNLSWFLFLDALLVISGLATPENFDVDGGMDQDIFDINEGLGLDLFEGDIRLDRAQIRNSIIGEKYRWPHTIPYVLEDSLEMNAKGVILNAFERYRLKTCIDFKPWAGETNYISVFKGSGCWSSVGNRRVGKQELSIGANCDRIATVQHEFLHALGFWHEQSRSDRDDYVRIMWDRILSGREHNFNTYSDDISDSLNVPYDYTSVMHYSKTAFQNGTEPTIVTRISDFEDVIGQRMDFSDSDLLKLNQLYNCSSSLSFMDSCSFELENVCGMIQSSGDNADWQRVSQVPRGPESDHSNMGQCQGSGFFMHFDSSSVNVGATAVLESRTLYPKRGFQCLQFYLYNSGSESDQLNIYIREYSADNVDGNLTLVEEIKEIPTGSWQLYHVTLKVTKKFRVVFEGRKGSGASLGGLSIDDINLSETRCPHHIWHIRNFTQFIGSPNGTLYSPPFYSSKGYAFQIYLNLAHVTNAGIYFHLISGANDDQLQWPCPWQQATMTLLDQNPDIRQRMSNQRSITTDPFMTTDNGNYFWDRPSKVGTVALFSNGTQFRRGGGYGTSAFITHERLKSRDFIKGDDVYILLTVEDISHLNSTQIQLTPAPSVQDLCSKTTCKNDGVCTVRDGKAECRCQSGEDWWYMGERCEKRGSTRDTIVIAVSSTVAVFALMLIITLVSVYCTRKKYRERMSSNRPNLTPQNQHAF,./data/raw/alphafold//AF-Q16820-F1-model_v4.pdb,5216,2126,1316,3077 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+2726,25401,25809,MKTIGLLGGMSWESTIPYYRLINEGIKQRLGGLHSAQVLLHSVDFHEIEECQRRGEWDKTGDILAEAALGLQRAGAEGIVLCTNTMHKVADAIESRCTLPFLHIADATGRAITGAGMTRVALLGTRYTMEQDFYRGRLTEQFSINCLIPEADERAKINQIIFEELCLGQFTEASRAYCAQVIARLAEQGAQGVIFGCTEIGLLVPEERSVLPVFDTAAIHAEDAVAFMLS,brenda,P03813,N[C@@H](CCO)C(=O)O,171.0,37.0,8.5,5.1.1.10,562.0,2.232996110392154,2.232996110392154,N[C@@H](CCO)C(=O)O__MKTIGLLGGMSWESTIPYYRLINEGIKQRLGGLHSAQVLLHSVDFHEIEECQRRGEWDKTGDILAEAALGLQRAGAEGIVLCTNTMHKVADAIESRCTLPFLHIADATGRAITGAGMTRVALLGTRYTMEQDFYRGRLTEQFSINCLIPEADERAKINQIIFEELCLGQFTEASRAYCAQVIARLAEQGAQGVIFGCTEIGLLVPEERSVLPVFDTAAIHAEDAVAFMLS,./data/raw/alphafold//AF-P03813-F1-model_v4.pdb,1074,6215,8039,11983 +2727,20151,20458,MVASARVQKLVRRYKLAIATALAILLLQGLVVWSFSGLEEDEAGEKGRQRKPRPLDPGEGSKDTDSSAGRRGSTGRRHGRWRGRAESPGVPVAKVVRAVTSRQRASRRVPPAPPPEAPGRQNLSGAAAGEALVGAAGFPPHGDTGSVEGAPQPTDNGFTPKCEIVGKDALSALARASTKQCQQEIANVVCLHQAGSLMPKAVPRHCQLTGKMSPGIQWDESQAQQPMDGPPVRIAYMLVVHGRAIRQLKRLLKAVYHEQHFFYIHVDKRSDYLHREVVELAQGYDNVRVTPWRMVTIWGGASLLRMYLRSMRDLLEVPGWAWDFFINLSATDYPTRTNEELVAFLSKNRDKNFLKSHGRDNSRFIKKQGLDRLFHECDSHMWRLGERQIPAGIVVDGGSDWFVLTRSFVEYVVYTDDPLVAQLRQFYTYTLLPAESFFHTVLENSLACETLVDNNLRVTNWNRKLGCKCQYKHIVDWCGCSPNDFKPQDFLRLQQVSRPTFFARKFESTVNQEVLEILDFHLYGSYPPGTPALKAYWENTYDAADGPSGLSDVMLTAYTAFARLSLHHAATAAPPMGTPLCRFEPRGLPSSVHLYFYDDHFQGYLVTQAVQPSAQGPAETLEMWLMPQGSLKLLGRSDQASRLQSLEVGTDWDPKERLFRNFGGLLGPLDEPVAVQRWARGPNLTATVVWIDPTYVVATSYDITVDTETEVTQYKPPLSRPLRPGPWTVRLLQFWEPLGETRFLVLPLTFNRKLPLRKDDASWLHAGPPHNEYMEQSFQGLSSILNLPQPELAEEAAQRHTQLTGPALEAWTDRELSSFWSVAGLCAIGPSPCPSLEPCRLTSWSSLSPDPKSELGPVKADGRLR,brenda,Q9H1B5,N=C(O)CC[C@H](N=C(O)CN=C(O)CN=C(O)CN=C(O)[C@H](CO)N=C(O)CN=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCC(=N)O)N=C(O)CCCCC1SCC2N=C(O)NC21)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](Cc1ccccc1)C(=O)O,0.0019,30.0,7.75,2.4.2.26,9606.0,-2.721246399047171,-2.721246399047171,N=C(O)CC[C@H](N=C(O)CN=C(O)CN=C(O)CN=C(O)[C@H](CO)N=C(O)CN=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCC(=N)O)N=C(O)CCCCC1SCC2N=C(O)NC21)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](Cc1ccccc1)C(=O)O__MVASARVQKLVRRYKLAIATALAILLLQGLVVWSFSGLEEDEAGEKGRQRKPRPLDPGEGSKDTDSSAGRRGSTGRRHGRWRGRAESPGVPVAKVVRAVTSRQRASRRVPPAPPPEAPGRQNLSGAAAGEALVGAAGFPPHGDTGSVEGAPQPTDNGFTPKCEIVGKDALSALARASTKQCQQEIANVVCLHQAGSLMPKAVPRHCQLTGKMSPGIQWDESQAQQPMDGPPVRIAYMLVVHGRAIRQLKRLLKAVYHEQHFFYIHVDKRSDYLHREVVELAQGYDNVRVTPWRMVTIWGGASLLRMYLRSMRDLLEVPGWAWDFFINLSATDYPTRTNEELVAFLSKNRDKNFLKSHGRDNSRFIKKQGLDRLFHECDSHMWRLGERQIPAGIVVDGGSDWFVLTRSFVEYVVYTDDPLVAQLRQFYTYTLLPAESFFHTVLENSLACETLVDNNLRVTNWNRKLGCKCQYKHIVDWCGCSPNDFKPQDFLRLQQVSRPTFFARKFESTVNQEVLEILDFHLYGSYPPGTPALKAYWENTYDAADGPSGLSDVMLTAYTAFARLSLHHAATAAPPMGTPLCRFEPRGLPSSVHLYFYDDHFQGYLVTQAVQPSAQGPAETLEMWLMPQGSLKLLGRSDQASRLQSLEVGTDWDPKERLFRNFGGLLGPLDEPVAVQRWARGPNLTATVVWIDPTYVVATSYDITVDTETEVTQYKPPLSRPLRPGPWTVRLLQFWEPLGETRFLVLPLTFNRKLPLRKDDASWLHAGPPHNEYMEQSFQGLSSILNLPQPELAEEAAQRHTQLTGPALEAWTDRELSSFWSVAGLCAIGPSPCPSLEPCRLTSWSSLSPDPKSELGPVKADGRLR,./data/raw/alphafold//AF-Q9H1B5-F1-model_v4.pdb,4198,5092,6997,7000 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+2731,9002,9150,MTVTDIILIHGALNRGACYDAVVPLLEARGYRVHAPDLTGHTPGDGGHLSVVDMEHYTRPVADILARAEGQSILLGHSLGGASISWLAQHHPDKVAGLIYLTAVLTAPGITPETFVLPGEPNRGTPHALDLIQPVDEGRGLQADFSRLERLREVFMGDYPGEGMPPAEQFIQTQSTVPFGTPNPMEGRALEIPRLYIEALDDVVIPIAVQRQMQKEFPGPVAVVSLPASHAPYYSMPERLAEAIADFADAPAEYRQTATKAGPDRPAGADGGRADRADLP,sabio,C0LA90,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1,0.176,37.0,7.5,3.1.1.88,595605.0,-0.7544873321858502,-0.7544873321858502,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1__MTVTDIILIHGALNRGACYDAVVPLLEARGYRVHAPDLTGHTPGDGGHLSVVDMEHYTRPVADILARAEGQSILLGHSLGGASISWLAQHHPDKVAGLIYLTAVLTAPGITPETFVLPGEPNRGTPHALDLIQPVDEGRGLQADFSRLERLREVFMGDYPGEGMPPAEQFIQTQSTVPFGTPNPMEGRALEIPRLYIEALDDVVIPIAVQRQMQKEFPGPVAVVSLPASHAPYYSMPERLAEAIADFADAPAEYRQTATKAGPDRPAGADGGRADRADLP,./data/raw/alphafold//AF-C0LA90-F1-model_v4.pdb,3615,1249,1982,1868 +2732,8571,8711,MKEIVQQMKAELWEIFDHLHRHPEISWEEWQTTEFLRRELEREGYRARTFADCPGVVAEIGTGPLMVGVRSDMDALWQEVDGVWQPNHACGHDAHMTIVLGVAKLLRRIGYEPPGTLRFLFQPAEEKGTGALKMIEKGAADGLTFLYGVHLRPIQEVKGGYASPAIIHGAAQCIEGRIRGVAAHAARPHLGVNVIEVGSAIVQELGKIHIDPQVPASIKMTKFHAGEKDANTIPDYAEFALDLRAQTNEAMERLVEGLRHVINGVAAIYGADIELVERTRIVAADPDPDAVRLMEEAIITTLGTEKCVPPVVTSGGEDFHFYSFKKPELKTTMLGLGCDLRPGLHHPNMTFRRDDLLSGVEILARVVMNTFATFAPQGENERASVAANH,sabio,Q5L1H1,CCC(C)[C@@H](C(=O)O)N1C(=O)CCC1=O,90.0,25.0,7.4,3.5.1.-,1462.0,1.954242509439325,1.954242509439325,CCC(C)[C@@H](C(=O)O)N1C(=O)CCC1=O__MKEIVQQMKAELWEIFDHLHRHPEISWEEWQTTEFLRRELEREGYRARTFADCPGVVAEIGTGPLMVGVRSDMDALWQEVDGVWQPNHACGHDAHMTIVLGVAKLLRRIGYEPPGTLRFLFQPAEEKGTGALKMIEKGAADGLTFLYGVHLRPIQEVKGGYASPAIIHGAAQCIEGRIRGVAAHAARPHLGVNVIEVGSAIVQELGKIHIDPQVPASIKMTKFHAGEKDANTIPDYAEFALDLRAQTNEAMERLVEGLRHVINGVAAIYGADIELVERTRIVAADPDPDAVRLMEEAIITTLGTEKCVPPVVTSGGEDFHFYSFKKPELKTTMLGLGCDLRPGLHHPNMTFRRDDLLSGVEILARVVMNTFATFAPQGENERASVAANH,./data/raw/alphafold//AF-Q5L1H1-F1-model_v4.pdb,3084,336,383,455 +2733,24467,24854,MVVSLKGRDLLCLQDYTPEEIWTILETAKMLKIWQKIGKPHRLLEGKTLAMIFQKPSTRTRVSFEVAMAHLGGHALYLNAQDLQLRRGETIADTARVLSRYVDAIMARVYDHKDVEDLAKYASVPVINGLSDFSHPCQALADYMTIWEKKGTIKGVKVVYVGDGNNVAHSLMIAGTKLGADVVVATPEGYEPDEKVIKWAEQNAAESGGSFELLHDPVKAVKDADVIYTDVWASMGQEAEAEERRKIFRPFQVNKDLVKHAKPDYMFMHCLPAHRGEEVTDDVIDSPNSVVWDEAENRLHAQKAVLALLLGGVKTGF,brenda,O93656,NCCC[C@H](N)C(=O)O,0.0285,37.0,8.0,2.1.3.3,29292.0,-1.5451551399914898,-1.5451551399914898,NCCC[C@H](N)C(=O)O__MVVSLKGRDLLCLQDYTPEEIWTILETAKMLKIWQKIGKPHRLLEGKTLAMIFQKPSTRTRVSFEVAMAHLGGHALYLNAQDLQLRRGETIADTARVLSRYVDAIMARVYDHKDVEDLAKYASVPVINGLSDFSHPCQALADYMTIWEKKGTIKGVKVVYVGDGNNVAHSLMIAGTKLGADVVVATPEGYEPDEKVIKWAEQNAAESGGSFELLHDPVKAVKDADVIYTDVWASMGQEAEAEERRKIFRPFQVNKDLVKHAKPDYMFMHCLPAHRGEEVTDDVIDSPNSVVWDEAENRLHAQKAVLALLLGGVKTGF,./data/raw/alphafold//AF-O93656-F1-model_v4.pdb,4232,5149,7059,7067 +2734,18518,18782,MKVGIPREVKNNEFRVAITPAGVHELVRHGHQVVIEKDAGVGSSITDQEFVAAGAQILPTADEVWAAADLLLKVKEPVAEEYHRLRKDQTLFTYLHLAASRECTDALLASGTTAIAYETVETANRALPLLAPMSEVAGRLAPQVGAYHLMRSVGGRGVLPGGVPGTAAGKAVVIGGGVSGWNATQIAVGLGFHVTLLDRDINKLREADRIFGTKVQTVVSNAFELEKAVVEADLVIGAVLIPGAKAPKLVTNELVAKMKPGSVLVDIAIDQGGCFEDSRPTTHAEPTFQVHESVFYCVANMPGAVPHTSTYALTNATLPYIVELANRGWADALRRDAALAKGLNTHEGQVVYREVAEAHGLPHVELTALLG,brenda,A0A6G3T2F2,N,32.82,40.0,8.5,1.4.1.1,1892.0,1.5161385767170743,1.5161385767170743,N__MKVGIPREVKNNEFRVAITPAGVHELVRHGHQVVIEKDAGVGSSITDQEFVAAGAQILPTADEVWAAADLLLKVKEPVAEEYHRLRKDQTLFTYLHLAASRECTDALLASGTTAIAYETVETANRALPLLAPMSEVAGRLAPQVGAYHLMRSVGGRGVLPGGVPGTAAGKAVVIGGGVSGWNATQIAVGLGFHVTLLDRDINKLREADRIFGTKVQTVVSNAFELEKAVVEADLVIGAVLIPGAKAPKLVTNELVAKMKPGSVLVDIAIDQGGCFEDSRPTTHAEPTFQVHESVFYCVANMPGAVPHTSTYALTNATLPYIVELANRGWADALRRDAALAKGLNTHEGQVVYREVAEAHGLPHVELTALLG,./data/raw/alphafold//AF-A0A6G3T2F2-F1-model_v4.pdb,3346,734,917,1123 +2735,19472,19757,MSTTYIVSDFLINTLLTIKRGVELAGLPPEFYEALEKPKRILVVNIPVKMDDGKIKYFEGYRVQHNDALGPFKGGIRFHPEVTLADDIALAMLMTLKNSLAGLPYGGAKGAVRVDPRRLSRRELEELARGYARAVAPLIGEQLDIPAPDVGTDSQVMAWMVDEYSRLVGRNAPAVFTSKPPELWGNPVREYSTGFGVAVAAREVAKRLWGGIVGKTAAVQGLGNVGRWAAYWLEKMGAKVVAVSDVNGVVYRERGLDVDLIRETKAKGPQLLEMISQKNGVEIVKNPDQIFSLDVDILVPAAIENVVREDNVDGVRARLVVEGANGPTTPGAERRLYERGVVVVPDILANAGGVIMSYLEWVENLQWLFWDEEETRRRLEAIMSNNVARVYARWEKEKSWTMRDAAVVTALERIYNAMKTRGWI,brenda,A3MUY9,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.01,50.0,9.5,1.4.1.2,181486.0,-2.0,-2.0,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MSTTYIVSDFLINTLLTIKRGVELAGLPPEFYEALEKPKRILVVNIPVKMDDGKIKYFEGYRVQHNDALGPFKGGIRFHPEVTLADDIALAMLMTLKNSLAGLPYGGAKGAVRVDPRRLSRRELEELARGYARAVAPLIGEQLDIPAPDVGTDSQVMAWMVDEYSRLVGRNAPAVFTSKPPELWGNPVREYSTGFGVAVAAREVAKRLWGGIVGKTAAVQGLGNVGRWAAYWLEKMGAKVVAVSDVNGVVYRERGLDVDLIRETKAKGPQLLEMISQKNGVEIVKNPDQIFSLDVDILVPAAIENVVREDNVDGVRARLVVEGANGPTTPGAERRLYERGVVVVPDILANAGGVIMSYLEWVENLQWLFWDEEETRRRLEAIMSNNVARVYARWEKEKSWTMRDAAVVTALERIYNAMKTRGWI,./data/raw/alphafold//AF-A3MUY9-F1-model_v4.pdb,3913,5691,6457,6379 +2736,22477,22827,MLSLTRILRKKIPVHELAGKISRPPLRPFSVVVASDEKGGIGDGGTIPWEIPEDMQYFRRVTTNLRGKNVKPSPSKRNAVVMGRKTWDSLPPKFRPLSNRLNVVLSRSATKEQLLAGIPDPIKRAEAANDVVAVNGGLEDALRMLVSKEHTSSIETVFCIGGGTIYKQALCAPCVNVLQAIHRTVVRPASNSCSVFFDIPAAGTKTPEGLELVRESITDERVSTGAGGKKYQFEKLVPRNSEEEQYLNLVGRIIDEGCTKCDRTGVGTRSLFGAQMRFSLRNNRLPLLTTKRVFWRGVCEELLWFLRGETNAKLLSDKGIHIWDGNGSRAFLDSRGLTDYDEMDLGPVYGFQWRHFGADYISCKVDSEGKGVDQIANIVKSLIENPDDRRMICTAWNPAALPRMALPPCHMMAQFYVSNGELSCMLYQRSCDMGLGVPFNIASYALLTFLMAKASGLRPGELVHTLGDAHVYSNHVEPCRKQLKRVPRPFPFIVFKQDKEFLEDFQESDIEVIDYSPYPVISMEMAV,sabio,Q27783,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1,0.0009,25.0,7.0,1.5.1.3,5702.0,-3.0457574905606752,-3.0457574905606752,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1__MLSLTRILRKKIPVHELAGKISRPPLRPFSVVVASDEKGGIGDGGTIPWEIPEDMQYFRRVTTNLRGKNVKPSPSKRNAVVMGRKTWDSLPPKFRPLSNRLNVVLSRSATKEQLLAGIPDPIKRAEAANDVVAVNGGLEDALRMLVSKEHTSSIETVFCIGGGTIYKQALCAPCVNVLQAIHRTVVRPASNSCSVFFDIPAAGTKTPEGLELVRESITDERVSTGAGGKKYQFEKLVPRNSEEEQYLNLVGRIIDEGCTKCDRTGVGTRSLFGAQMRFSLRNNRLPLLTTKRVFWRGVCEELLWFLRGETNAKLLSDKGIHIWDGNGSRAFLDSRGLTDYDEMDLGPVYGFQWRHFGADYISCKVDSEGKGVDQIANIVKSLIENPDDRRMICTAWNPAALPRMALPPCHMMAQFYVSNGELSCMLYQRSCDMGLGVPFNIASYALLTFLMAKASGLRPGELVHTLGDAHVYSNHVEPCRKQLKRVPRPFPFIVFKQDKEFLEDFQESDIEVIDYSPYPVISMEMAV,./data/raw/alphafold//AF-Q27783-F1-model_v4.pdb,4153,5697,7368,8268 +2737,7342,7473,MKNRNRMIVNCVTASLMYYWSLPALAEQSSSEIKIVRDEYGMPHIYANDTWHLFYGYGYVVAQDRLFQMEMARRSTQGTVAEVLGKDFVKFDKDIRRNYWPDAIRAQIAALSPEDMSILQGYADGMNAWIDKVNTNPETLLPKQFNTFGFTPKRWEPFDVAMIFVGTMANRFSDSTSEIDNLALLTALKDKYGVSQGMAVFNQLKWLVNPSAPTTIAVQESNYPLKFNQQNSQTAALLPRYDLPAPMLDRPAKGADGALLALTAGKNRETIAAQFAQGGANGLAGYPTTSNMWVIGKSKAQDAKAIMVNGPQFGWYAPAYTYGIGLHGAGYDVTGNTPFAYPGLVFGHNGVISWGSTAGFGDDVDIFAERLSAEKPGYYLHNGKWVKMLSREETITVKNGQAETFTVWRTVHGNILQTDQTTQTAYAKSRAWDGKEVASLLAWTHQMKAKNWQEWTQQAAKQALTINWYYADVNGNIGYVHTGAYPDRQSGHDPRLPVPGTGKWDWKGLLPFEMNPKVYNPQSGYIANWNNSPQKDYPASDLFAFLWGGADRVTEIDRLLEQKPRLTADQAWDVIRQTSRQDLNLRLFLPTLQAATSGLTQSDPRRQLVETLTRWDGINLLNDDGKTWQQPGSAILNVWLTSMLKRTVVAAVPMPFDKWYSASGYETTQDGPTGSLNISVGAKILYEAVQGDKSPIPQAVDLFAGKPQQEVVLAALEDTWETLSKRYGNNVSNWKTPAMALTFRANNFFGVPQAAAEETRHQAEYQNRGTENDMIVFSPTTSDRPVLAWDVVAPGQSGFIAPDGTVDKHYEDQLKMYENFGRKSLWLTKQDVEAHKESQEVLHVQR,brenda,P06875,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](N)c3ccc(O)cc3)C(=O)N2[C@H]1C(=O)O,1.07,30.0,7.0,3.5.1.11,562.0,0.0293837776852096,0.0293837776852096,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](N)c3ccc(O)cc3)C(=O)N2[C@H]1C(=O)O__MKNRNRMIVNCVTASLMYYWSLPALAEQSSSEIKIVRDEYGMPHIYANDTWHLFYGYGYVVAQDRLFQMEMARRSTQGTVAEVLGKDFVKFDKDIRRNYWPDAIRAQIAALSPEDMSILQGYADGMNAWIDKVNTNPETLLPKQFNTFGFTPKRWEPFDVAMIFVGTMANRFSDSTSEIDNLALLTALKDKYGVSQGMAVFNQLKWLVNPSAPTTIAVQESNYPLKFNQQNSQTAALLPRYDLPAPMLDRPAKGADGALLALTAGKNRETIAAQFAQGGANGLAGYPTTSNMWVIGKSKAQDAKAIMVNGPQFGWYAPAYTYGIGLHGAGYDVTGNTPFAYPGLVFGHNGVISWGSTAGFGDDVDIFAERLSAEKPGYYLHNGKWVKMLSREETITVKNGQAETFTVWRTVHGNILQTDQTTQTAYAKSRAWDGKEVASLLAWTHQMKAKNWQEWTQQAAKQALTINWYYADVNGNIGYVHTGAYPDRQSGHDPRLPVPGTGKWDWKGLLPFEMNPKVYNPQSGYIANWNNSPQKDYPASDLFAFLWGGADRVTEIDRLLEQKPRLTADQAWDVIRQTSRQDLNLRLFLPTLQAATSGLTQSDPRRQLVETLTRWDGINLLNDDGKTWQQPGSAILNVWLTSMLKRTVVAAVPMPFDKWYSASGYETTQDGPTGSLNISVGAKILYEAVQGDKSPIPQAVDLFAGKPQQEVVLAALEDTWETLSKRYGNNVSNWKTPAMALTFRANNFFGVPQAAAEETRHQAEYQNRGTENDMIVFSPTTSDRPVLAWDVVAPGQSGFIAPDGTVDKHYEDQLKMYENFGRKSLWLTKQDVEAHKESQEVLHVQR,./data/raw/alphafold//AF-P06875-F1-model_v4.pdb,6,322,3349,434 +2738,38813,39500,MIDLKQYEFWFLVGSQYLYGLETLKKVEQQASRIVEALNNDPIFPSKIVLKPVLKNSAEIREIFEKANAEPKCAGVIVWMHTFSPSKMWIRGLSINKKPLLHLHTQYNREIPWDTIDMDYMNLNQSAHGDREHGFIHARMRLPRKVVVGHWEDREVREKIAKWMRVACAIQDGRTGQIVRFGDNMREVASTEDDKVEAQIKLGWSINTWGVGELAEGVKAVPENEVEELLKEYKERYIMPEDEYSLKAIREQAKMEIALREFLKEKNAIAFTTTFEDLHDLPQLPGLAVQRLMEEGYGFGAEGDWKAAGLVRALKVMGAGLPGGTSFMEDYTYHLTPGNELVLGAHMLEVCPTIAKEKPRIEVHPLSIGGKADPARLVFDGQEGPAVNASIVDMGNRFRLVVNRVLSVPIERKMPKLPTARVLWKPLPDFKRATTAWILAGGSHHTAFSTAVDVEYLIDWAEALEIEYLVIDENLDLENFKKELRWNELYWGLLKR,uniprot_search,Q8RMB9,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O,250.0,85.0,7.0,5.3.1.4,2337.0,2.397940008672037,2.397940008672037,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O__MIDLKQYEFWFLVGSQYLYGLETLKKVEQQASRIVEALNNDPIFPSKIVLKPVLKNSAEIREIFEKANAEPKCAGVIVWMHTFSPSKMWIRGLSINKKPLLHLHTQYNREIPWDTIDMDYMNLNQSAHGDREHGFIHARMRLPRKVVVGHWEDREVREKIAKWMRVACAIQDGRTGQIVRFGDNMREVASTEDDKVEAQIKLGWSINTWGVGELAEGVKAVPENEVEELLKEYKERYIMPEDEYSLKAIREQAKMEIALREFLKEKNAIAFTTTFEDLHDLPQLPGLAVQRLMEEGYGFGAEGDWKAAGLVRALKVMGAGLPGGTSFMEDYTYHLTPGNELVLGAHMLEVCPTIAKEKPRIEVHPLSIGGKADPARLVFDGQEGPAVNASIVDMGNRFRLVVNRVLSVPIERKMPKLPTARVLWKPLPDFKRATTAWILAGGSHHTAFSTAVDVEYLIDWAEALEIEYLVIDENLDLENFKKELRWNELYWGLLKR,./data/raw/alphafold//AF-Q8RMB9-F1-model_v4.pdb,2640,8263,10154,11354 +2739,36538,37175,MLHRATTTAAAAAAAALLLCPVQALVRPDGVGKLPALGWNSWNAFGCDIDEEKILTAANQIVNLGLKDLGYEYVNIDDCWSVKSGRNATTGRIMPDLTKFPDGISGLAEKIHNLGLKIGIYSSAGWTTCAGYPASLGNETIDAETFAEWGIDYLKYDNCGVPPDWQDQYSYCVPDSGDPATNPNGTCPNLQNPAPAVYDWRTSKTAERYRRMRDALLGVQDKRTILFSLCDWGQADVNEWGAETGNSWRMSGDISPNWPRISTIANLNSFELNSVDFWGHNDPDMLEVGNGNLTLAENRAHFALWAAMKSPLIIGTALDKIDQDHLSILSNKYLLTFHQDPQIGRPAYPYKWGYNPDWTFDPGHPAEYWSGPTSSGDVLVLMLNTESGPANRTAVWSEVPELKGRNNNNNSSSTGFQVTDAWTGSSLGCVQGGYSVELESHDVAVLVVSGEC,uniprot_search,A7XZT2,O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1,0.29,50.0,4.5,3.2.1.22,68825.0,-0.5376020021010439,-0.5376020021010439,O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1__MLHRATTTAAAAAAAALLLCPVQALVRPDGVGKLPALGWNSWNAFGCDIDEEKILTAANQIVNLGLKDLGYEYVNIDDCWSVKSGRNATTGRIMPDLTKFPDGISGLAEKIHNLGLKIGIYSSAGWTTCAGYPASLGNETIDAETFAEWGIDYLKYDNCGVPPDWQDQYSYCVPDSGDPATNPNGTCPNLQNPAPAVYDWRTSKTAERYRRMRDALLGVQDKRTILFSLCDWGQADVNEWGAETGNSWRMSGDISPNWPRISTIANLNSFELNSVDFWGHNDPDMLEVGNGNLTLAENRAHFALWAAMKSPLIIGTALDKIDQDHLSILSNKYLLTFHQDPQIGRPAYPYKWGYNPDWTFDPGHPAEYWSGPTSSGDVLVLMLNTESGPANRTAVWSEVPELKGRNNNNNSSSTGFQVTDAWTGSSLGCVQGGYSVELESHDVAVLVVSGEC,./data/raw/alphafold//AF-A7XZT2-F1-model_v4.pdb,2507,8136,10008,11193 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+2784,34334,34937,MAALMTPGTGAPPAPGDFSGEGSQGLPDPSPEPKQLPELIRMKRDGGRLSEADIRGFVAAVVNGSAQGAQIGAMLMAIRLRGMDLEETSVLTQALAQSGQQLEWPEAWRQQLVDKHSTGGVGDKVSLVLAPALAACGCKVPMISGRGLGHTGGTLDKLESIPGFNVIQSPEQMQVLLDQAGCCIVGQSEQLVPADGILYAARDVTATVDSLPLITASILSKKLVEGLSALVVDVKFGGAAVFPNQEQARELAKTLVGVGASLGLRVAAALTAMDKPLGRCVGHALEVEEALLCMDGAGPPDLRDLVTTLGGALLWLSGHAGTQAQGAARVAAALDDGSALGRFERMLAAQGVDPGLARALCSGSPAERRQLLPRAREQEELLAPADGTVELVRALPLALVLHELGAGRSRAGEPLRLGVGAELLVDVGQRLRRGTPWLRVHRDGPALSGPQSRALQEALVLSDRAPFAAPSPFAELVLPPQQ,brenda,P19971,O=P(O)(O)O,0.0058,37.0,7.5,2.4.2.4,9606.0,-2.2365720064370627,-1.6035941143759265,O=P(O)(O)O__MAALMTPGTGAPPAPGDFSGEGSQGLPDPSPEPKQLPELIRMKRDGGRLSEADIRGFVAAVVNGSAQGAQIGAMLMAIRLRGMDLEETSVLTQALAQSGQQLEWPEAWRQQLVDKHSTGGVGDKVSLVLAPALAACGCKVPMISGRGLGHTGGTLDKLESIPGFNVIQSPEQMQVLLDQAGCCIVGQSEQLVPADGILYAARDVTATVDSLPLITASILSKKLVEGLSALVVDVKFGGAAVFPNQEQARELAKTLVGVGASLGLRVAAALTAMDKPLGRCVGHALEVEEALLCMDGAGPPDLRDLVTTLGGALLWLSGHAGTQAQGAARVAAALDDGSALGRFERMLAAQGVDPGLARALCSGSPAERRQLLPRAREQEELLAPADGTVELVRALPLALVLHELGAGRSRAGEPLRLGVGAELLVDVGQRLRRGTPWLRVHRDGPALSGPQSRALQEALVLSDRAPFAAPSPFAELVLPPQQ,./data/raw/alphafold//AF-P19971-F1-model_v4.pdb,968,3995,5385,5729 +2785,33401,33995,MAAIAFIGLGQMGSPMASNLLQQGHQLRVFDVNAEAVRHLVDKGATPAANPAQAAKDAEFIITMLPNGDLVRNVLFGENGVCEGLSTDALVIDMSTIHPLQTDKLIADMQAKGFSMMDVPVGRTSANAITGTLLLLAGGTAEQVERATPILMAMGSELINAGGPGMGIRVKLINNYMSIALNALSAEAAVLCEALNLPFDVAVKVMSGTAAGKGHFTTSWPNKVLSGDLSPAFMIDLAHKDLGIALDVANQLHVPMPLGAASREVYSQARAAGRGRQDWSAILEQVRVSAGMTAKVKM,brenda,P0A9V8,O=CCCC(=O)O,4.3,37.0,7.2,1.1.1.61,562.0,0.6334684555795865,0.6334684555795865,O=CCCC(=O)O__MAAIAFIGLGQMGSPMASNLLQQGHQLRVFDVNAEAVRHLVDKGATPAANPAQAAKDAEFIITMLPNGDLVRNVLFGENGVCEGLSTDALVIDMSTIHPLQTDKLIADMQAKGFSMMDVPVGRTSANAITGTLLLLAGGTAEQVERATPILMAMGSELINAGGPGMGIRVKLINNYMSIALNALSAEAAVLCEALNLPFDVAVKVMSGTAAGKGHFTTSWPNKVLSGDLSPAFMIDLAHKDLGIALDVANQLHVPMPLGAASREVYSQARAAGRGRQDWSAILEQVRVSAGMTAKVKM,./data/raw/alphafold//AF-P0A9V8-F1-model_v4.pdb,3420,888,1070,1316 +2786,11571,11735,MPSRRMLHTMIRVGDLDRSIKFYTERLGMKVLRKWDVPEDKYTLVFLGYGPEMSSTVLELTYNYGVTSYKHDEAYGHIAIGVEDVKELVADMRKHDVPIDYEDESGFMAFVVDPDGYYIELLNEKTMMEKAEADMKEQGTA,brenda,Q68RJ8,CCOC(=O)CN=C(O)[C@H](CS)N=C(O)CC[C@H](N)C(=O)O,0.7,27.0,7.0,4.4.1.5,5664.0,-0.1549019599857432,-0.1549019599857432,CCOC(=O)CN=C(O)[C@H](CS)N=C(O)CC[C@H](N)C(=O)O__MPSRRMLHTMIRVGDLDRSIKFYTERLGMKVLRKWDVPEDKYTLVFLGYGPEMSSTVLELTYNYGVTSYKHDEAYGHIAIGVEDVKELVADMRKHDVPIDYEDESGFMAFVVDPDGYYIELLNEKTMMEKAEADMKEQGTA,./data/raw/alphafold//AF-Q68RJ8-F1-model_v4.pdb,3413,6205,8024,3130 +2787,40234,40967,MTVSGAIPSMTKNRTLVVGGTGFIGQFITKASLGFGYPTFLLVRPGPVSPSKAVIIKTFQDKGAKVIYGVINDKECMEKILKEYEIDVVISLVGGARLLDQLTLLEAIKSVKTIKRFLPSEFGHDVDRTDPVEPGLTMYKEKRLVRRAVEEYGIPFTNICCNSIASWPYYDNCHPSQVPPPMDQFQIYGDGNTKAYFIDGNDIGKFTMKTIDDIRTLNKNVHFRPSSNCYSINELASLWEKKIGRTLPRFTVTADKLLAHAAENIIPESIVSSFTHDIFINGCQVNFSIDEHSDVEIDTLYPDEKFRSLDDCYEDFVPMVHDKIHAGKSGEIKIKDGKPLVQTGTIEEINKDIKTLVETQPNEEIKKDMKALVEAVPISAMG,brenda,Q84V83,Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)[C@H]2O,0.005,30.0,7.0,1.17.1.3,225101.0,-2.3010299956639813,-2.3010299956639813,Oc1cc(O)c2c(c1)O[C@H](c1cc(O)c(O)c(O)c1)[C@@H](O)[C@H]2O__MTVSGAIPSMTKNRTLVVGGTGFIGQFITKASLGFGYPTFLLVRPGPVSPSKAVIIKTFQDKGAKVIYGVINDKECMEKILKEYEIDVVISLVGGARLLDQLTLLEAIKSVKTIKRFLPSEFGHDVDRTDPVEPGLTMYKEKRLVRRAVEEYGIPFTNICCNSIASWPYYDNCHPSQVPPPMDQFQIYGDGNTKAYFIDGNDIGKFTMKTIDDIRTLNKNVHFRPSSNCYSINELASLWEKKIGRTLPRFTVTADKLLAHAAENIIPESIVSSFTHDIFINGCQVNFSIDEHSDVEIDTLYPDEKFRSLDDCYEDFVPMVHDKIHAGKSGEIKIKDGKPLVQTGTIEEINKDIKTLVETQPNEEIKKDMKALVEAVPISAMG,./data/raw/alphafold//AF-Q84V83-F1-model_v4.pdb,4167,5041,6936,6930 +2788,3326,3381,MARSITMQQRIEFGDCDPAGIVWFPNYHRWLDAASRNYFIKCGLPPWRQTVVERGIVGTPIVSCNASFVCTASYDDVLTIETCIKEWRRKSFVQRHSVSRTTPGGDVQLVMRADEIRVFAMNDGERLRAIEVPADYIELCS,sabio,P56653,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)c1ccccc1,0.2,25.0,7.5,3.1.2.23,306.0,-0.6989700043360187,-0.4956999141190412,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)c1ccccc1__MARSITMQQRIEFGDCDPAGIVWFPNYHRWLDAASRNYFIKCGLPPWRQTVVERGIVGTPIVSCNASFVCTASYDDVLTIETCIKEWRRKSFVQRHSVSRTTPGGDVQLVMRADEIRVFAMNDGERLRAIEVPADYIELCS,./data/raw/alphafold//AF-P56653-F1-model_v4.pdb,3834,1552,2369,2318 +2789,15123,15337,MKNTLLKLGVCVSLLGITPFVSTISSVQAERTVEHKVIKNETGTISISQLNKNVWVHTELGYFSGEAVPSNGLVLNTSKGLVLVDSSWDDKLTKELIEMVEKKFKKRVTDVIITHAHADRIGGMKTLKERGIKAHSTALTAELAKKNGYEEPLGDLQSVTNLKFGNMKVETFYPGKGHTEDNIVVWLPQYQILAGGCLVKSASSKDLGNVADAYVNEWSTSIENVLKRYGNINLVVPGHGEVGDRGLLLHTLDLLK,sabio,P14488,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(Oc3ccc(C(N)=O)cc3)S[C@H]12,0.025,30.0,6.5,3.5.2.6,1396.0,-1.6020599913279625,-1.6020599913279625,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(Oc3ccc(C(N)=O)cc3)S[C@H]12__MKNTLLKLGVCVSLLGITPFVSTISSVQAERTVEHKVIKNETGTISISQLNKNVWVHTELGYFSGEAVPSNGLVLNTSKGLVLVDSSWDDKLTKELIEMVEKKFKKRVTDVIITHAHADRIGGMKTLKERGIKAHSTALTAELAKKNGYEEPLGDLQSVTNLKFGNMKVETFYPGKGHTEDNIVVWLPQYQILAGGCLVKSASSKDLGNVADAYVNEWSTSIENVLKRYGNINLVVPGHGEVGDRGLLLHTLDLLK,./data/raw/alphafold//AF-P14488-F1-model_v4.pdb,3568,1177,1892,1757 +2790,23666,24037,MNDFLLLLLVLFLGVPRSENHVINLEECFQEPEYENWLATASHGLTKTLNPKKIVIVGAGISGLTAAKLFREAGHEVVILEASDRVGGRIKTHREDGWYVDVGPMRVPQTHRIVREYIKKFNISLNPFRQTDENAWYLIKHVRQKMSANNPENFGYQLNPNERGKSASQLFDETLDKVTDDCTLQKEKYDSFSTKEYLIKEGKLSTGAVEMIGDFLNEEAGFHNSFLISVMDHFLFLNNSFDEITGGFDQLPERFFKDMDSIVHLNSTVEKIVHINNKVTVFYEGLSTNMRLVADYVLITATARATRLIKFVPPLSIPKTRALRSLIYASATKIILVCTDKFWEKDGIHGGRSITDLPSRVIYYPNHDFTNGIGVLLASYTWYSDSEFYTTLSDEKCVDVVMDDLVEIHNVSKDYLKSVCGKHVVQKWALDQYSMGAFSTYTPYQITHYSQMLAQNEGRIYFAGEYTAHPHGWIETSMKSAIREAINIHNA,sabio,P81383,NC(Cc1ccc(O)cc1)C(=O)O,0.01,25.0,8.5,1.4.3.2,8665.0,-2.0,-2.0,NC(Cc1ccc(O)cc1)C(=O)O__MNDFLLLLLVLFLGVPRSENHVINLEECFQEPEYENWLATASHGLTKTLNPKKIVIVGAGISGLTAAKLFREAGHEVVILEASDRVGGRIKTHREDGWYVDVGPMRVPQTHRIVREYIKKFNISLNPFRQTDENAWYLIKHVRQKMSANNPENFGYQLNPNERGKSASQLFDETLDKVTDDCTLQKEKYDSFSTKEYLIKEGKLSTGAVEMIGDFLNEEAGFHNSFLISVMDHFLFLNNSFDEITGGFDQLPERFFKDMDSIVHLNSTVEKIVHINNKVTVFYEGLSTNMRLVADYVLITATARATRLIKFVPPLSIPKTRALRSLIYASATKIILVCTDKFWEKDGIHGGRSITDLPSRVIYYPNHDFTNGIGVLLASYTWYSDSEFYTTLSDEKCVDVVMDDLVEIHNVSKDYLKSVCGKHVVQKWALDQYSMGAFSTYTPYQITHYSQMLAQNEGRIYFAGEYTAHPHGWIETSMKSAIREAINIHNA,./data/raw/alphafold//AF-P81383-F1-model_v4.pdb,5084,978,1175,1446 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+2792,23274,23632,MVKLTLYGLDPSPPVRAVKLTLAALNLTYEYVNVDIVARAQLSPEYLEKNPQHTVPTLEDDGHYIWDSHAIIAYLVSKYADSDALYPKDPLKRAVVDQRLHFESGVVFANGIRSISKSVLFQGQTKVPKERYDAIIEIYDFVETFLKGQDYIAGNQLTIADFSLVSSVASLEAFVALDTTKYPRIGAWIKKLEQLPYYEEANGKGVRQLVAIFKKTNFTFEA,sabio,A1ZB71,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O,1.71,25.0,6.5,2.5.1.18,7227.0,0.2329961103921538,0.2329961103921538,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O__MVKLTLYGLDPSPPVRAVKLTLAALNLTYEYVNVDIVARAQLSPEYLEKNPQHTVPTLEDDGHYIWDSHAIIAYLVSKYADSDALYPKDPLKRAVVDQRLHFESGVVFANGIRSISKSVLFQGQTKVPKERYDAIIEIYDFVETFLKGQDYIAGNQLTIADFSLVSSVASLEAFVALDTTKYPRIGAWIKKLEQLPYYEEANGKGVRQLVAIFKKTNFTFEA,./data/raw/alphafold//AF-A1ZB71-F1-model_v4.pdb,4680,5815,7551,8496 +2793,16811,17054,MALVRALVCCLLTAWHCRSGLGLPVAPAGGRNPPPAIGQFWHVTDLHLDPTYHITDDHTKVCASSKGANASNPGPFGDVLCDSPYQLILSAFDFIKNSGQEASFMIWTGDSPPHVPVPELSTDTVINVITNMTTTIQSLFPNLQVFPALGNHDYWPQDQLPVVTSKVYNAVANLWKPWLDEEAISTLRKGGFYSQKVTTNPNLRIISLNTNLYYGPNIMTLNKTDPANQFEWLESTLNNSQQNKEKVYIIAHVPVGYLPSSQNITAMREYYNEKLIDIFQKYSDVIAGQFYGHTHRDSIMVLSDKKGSPVNSLFVAPAVTPVKSVLEKQTNNPGIRLFQYDPRDYKLLDMLQYYLNLTEANLKGESIWKLEYILTQTYDIEDLQPESLYGLAKQFTILDSKQFIKYYNYFFVSYDSSVTCDKTCKAFQICAIMNLDNISYADCLKQLYIKHNY,brenda,Q92484,C[N+](C)(C)CCOP(=O)(O)OP(=O)(O)OC[C@@H]1O[C@H](n2ccc(=N)nc2O)[C@@H](O)[C@H]1O,0.262,37.0,5.0,3.1.4.12,9606.0,-0.5816987086802545,-0.5816987086802545,C[N+](C)(C)CCOP(=O)(O)OP(=O)(O)OC[C@@H]1O[C@H](n2ccc(=N)nc2O)[C@@H](O)[C@H]1O__MALVRALVCCLLTAWHCRSGLGLPVAPAGGRNPPPAIGQFWHVTDLHLDPTYHITDDHTKVCASSKGANASNPGPFGDVLCDSPYQLILSAFDFIKNSGQEASFMIWTGDSPPHVPVPELSTDTVINVITNMTTTIQSLFPNLQVFPALGNHDYWPQDQLPVVTSKVYNAVANLWKPWLDEEAISTLRKGGFYSQKVTTNPNLRIISLNTNLYYGPNIMTLNKTDPANQFEWLESTLNNSQQNKEKVYIIAHVPVGYLPSSQNITAMREYYNEKLIDIFQKYSDVIAGQFYGHTHRDSIMVLSDKKGSPVNSLFVAPAVTPVKSVLEKQTNNPGIRLFQYDPRDYKLLDMLQYYLNLTEANLKGESIWKLEYILTQTYDIEDLQPESLYGLAKQFTILDSKQFIKYYNYFFVSYDSSVTCDKTCKAFQICAIMNLDNISYADCLKQLYIKHNY,./data/raw/alphafold//AF-Q92484-F1-model_v4.pdb,1301,6530,8415,5838 +2794,10180,10334,MSTAGKVIKCKAAVLWELKKPFSIEEVEVAPPKAHEVRIKMVAAGICRSDEHVVSGNLVTPLPVILGHEAAGIVESVGEGVTTVKPGDKVIPLFTPQCGKCRICKNPESNYCLKNDLGNPRGTLQDGTRRFTCSGKPIHHFVGVSTFSQYTVVDENAVAKIDAASPLEKVCLIGCGFSTGYGSAVKVAKVTPGSTCAVFGLGGVGLSVVMGCKAAGAARIIAVDINKDKFAKAKELGATECINPQDYKKPIQEVLKEMTDGGVDFSFEVIGRLDTMMASLLCCHEACGTSVIVGVPPDSQNLSINPMLLLTGRTWKGAIFGGFKSKESVPKLVADFMAKKFSLDALITNILPFEKINEGFDLLRSGKSIRTVLTF,brenda,P00326,CCCCCCCC=O,9.6,33.5,8.09375,1.1.1.1,9606.0,0.9822712330395684,0.9822712330395684,CCCCCCCC=O__MSTAGKVIKCKAAVLWELKKPFSIEEVEVAPPKAHEVRIKMVAAGICRSDEHVVSGNLVTPLPVILGHEAAGIVESVGEGVTTVKPGDKVIPLFTPQCGKCRICKNPESNYCLKNDLGNPRGTLQDGTRRFTCSGKPIHHFVGVSTFSQYTVVDENAVAKIDAASPLEKVCLIGCGFSTGYGSAVKVAKVTPGSTCAVFGLGGVGLSVVMGCKAAGAARIIAVDINKDKFAKAKELGATECINPQDYKKPIQEVLKEMTDGGVDFSFEVIGRLDTMMASLLCCHEACGTSVIVGVPPDSQNLSINPMLLLTGRTWKGAIFGGFKSKESVPKLVADFMAKKFSLDALITNILPFEKINEGFDLLRSGKSIRTVLTF,./data/raw/alphafold//AF-P00326-F1-model_v4.pdb,5403,3181,1064,1309 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+2934,39170,39868,MITKVTARNNKITPVELLNQKFGNKINLGNFADAVFTDAAFKNVAGIANLPMKAPVMQVLMENCIVSKYLKQFVPDRSVCFVEEGQKFYIVLEDGQKIEVPEDVNKALKATVSDVKHWAGYLTEDGEHVIDLLKPAPGPHFYVNLLIGNRLGFKRTLQTTPKSVVDRFGRGSFRSHAATQVLATRFDMRQEENGFPANRQFYLYEDGKQIFYSALIDDNIVEATCKHSCNRTVIKYKTACNLEITRTIFLVPHKKGFPLATELQRIEIKNASDKARNLSITYTGMFGTGAVHAIFEDVTYTNVIMQSAALYNDKGEFIGITPDYYPEEFKQDTRFVTMIVRNGDEKSFPQSFCTDYNDFVGTGTLEHPAGGCNLNNKLNRKGPGFFALGAPFTVEPGKTVIIDTFTGLSSSKDNENYSDAVMLRELDNLLRYFEKSESVEETLNEIINFHENYGKYFQFNTGNKLFDSGFNRNLAFQVLYQTFMSRSFGQTQKGYREIGFREIQDLFASMYYFINIGYQDFVKELLFEWTANVYKMGYANHNFYWVGKQPGLYSDDSLWLLQAYYRYIIYTKDTSVLNEEVPVADGNNEKRAVRETLKAIIQYSACISVGDHGLPLLDLADWNDCLKIASNSIDGATKEKLYYEQLKKTNGKYGDRFMSDYSESVMNAFLLKLAIDHLAEIATLDNDTQLAQQMSELSKEVTDRIQKHAWKENFFARVLINRYKDGSYTYLGAKGDKLSADPNIDGVYFLNSFAWSVLSDVATDEQIAIMVDVIKKHLLTPYGLRLVTPADLNKIANDTATGHYFFGDRENGAVFKHASMMAVAALIKAAKKVKDNELAKEMARIAYFMIDLVLPYKNLENPFQVAGNPRICTQYINTDTGENIGPLLSGTATWLNLNLISLAGIEYTRDGISFNPILREEETQLNFTLKAPKCSYKFSITKPVGFARMESSEYELFVDGQKIDNTVIPMYTDEKEHIVTLKFK,brenda,Q93HT8,OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O,0.68,21.0,7.5,2.4.1.49,1515.0,-0.1674910872937636,-0.1674910872937636,OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O__MITKVTARNNKITPVELLNQKFGNKINLGNFADAVFTDAAFKNVAGIANLPMKAPVMQVLMENCIVSKYLKQFVPDRSVCFVEEGQKFYIVLEDGQKIEVPEDVNKALKATVSDVKHWAGYLTEDGEHVIDLLKPAPGPHFYVNLLIGNRLGFKRTLQTTPKSVVDRFGRGSFRSHAATQVLATRFDMRQEENGFPANRQFYLYEDGKQIFYSALIDDNIVEATCKHSCNRTVIKYKTACNLEITRTIFLVPHKKGFPLATELQRIEIKNASDKARNLSITYTGMFGTGAVHAIFEDVTYTNVIMQSAALYNDKGEFIGITPDYYPEEFKQDTRFVTMIVRNGDEKSFPQSFCTDYNDFVGTGTLEHPAGGCNLNNKLNRKGPGFFALGAPFTVEPGKTVIIDTFTGLSSSKDNENYSDAVMLRELDNLLRYFEKSESVEETLNEIINFHENYGKYFQFNTGNKLFDSGFNRNLAFQVLYQTFMSRSFGQTQKGYREIGFREIQDLFASMYYFINIGYQDFVKELLFEWTANVYKMGYANHNFYWVGKQPGLYSDDSLWLLQAYYRYIIYTKDTSVLNEEVPVADGNNEKRAVRETLKAIIQYSACISVGDHGLPLLDLADWNDCLKIASNSIDGATKEKLYYEQLKKTNGKYGDRFMSDYSESVMNAFLLKLAIDHLAEIATLDNDTQLAQQMSELSKEVTDRIQKHAWKENFFARVLINRYKDGSYTYLGAKGDKLSADPNIDGVYFLNSFAWSVLSDVATDEQIAIMVDVIKKHLLTPYGLRLVTPADLNKIANDTATGHYFFGDRENGAVFKHASMMAVAALIKAAKKVKDNELAKEMARIAYFMIDLVLPYKNLENPFQVAGNPRICTQYINTDTGENIGPLLSGTATWLNLNLISLAGIEYTRDGISFNPILREEETQLNFTLKAPKCSYKFSITKPVGFARMESSEYELFVDGQKIDNTVIPMYTDEKEHIVTLKFK,./data/raw/alphafold//AF-Q93HT8-F1-model_v4.pdb,2670,8386,10327,11550 +2935,14479,14688,MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFVGKNDGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEESAGKATITLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,sabio,Q83U23,CSCCC(N)C(O)=NC(Cc1ccccc1)C(=O)O,1.92,37.0,7.5,3.4.13.-,44688.0,0.2833012287035495,0.2833012287035495,CSCCC(N)C(O)=NC(Cc1ccccc1)C(=O)O__MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFVGKNDGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEESAGKATITLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,./data/raw/alphafold//AF-Q83U23-F1-model_v4.pdb,5060,1897,2799,2825 +2936,36281,36912,MLAIFFCLFIALASAYPARGPCTGDCWTHDPAMIQRESDGTYFRFSTGTGVNTMKSPSLKGPWTDVGPALPNGSKITLDGVDSSDIWAPDVHYQDGTYYMYYVLSKLGTQTSQIGVATSTTMEPGSWTDHGIIGVPANSAYNRIDPNWITIGGKQYLQFGSYWQDIYQVALESPLQVGSNTPHQIAYNASSNHRVEGSFLYQHGSFYYLFFSGGVAGSYTATYPAQGEEYRVHVCRSSSGTGGFVDQAGISCLESGGTIILASHDQVYAPGGQGVLTDKDLGPVLYYHYYSLAAKEAGGTGIKGYLYGWNELDFSTGWPVVKAV,brenda,A0A2H4RAB6,O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)cc1,5.37,37.0,4.5,3.2.1.99,1266744.0,0.7299742856995556,0.7299742856995556,O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)cc1__MLAIFFCLFIALASAYPARGPCTGDCWTHDPAMIQRESDGTYFRFSTGTGVNTMKSPSLKGPWTDVGPALPNGSKITLDGVDSSDIWAPDVHYQDGTYYMYYVLSKLGTQTSQIGVATSTTMEPGSWTDHGIIGVPANSAYNRIDPNWITIGGKQYLQFGSYWQDIYQVALESPLQVGSNTPHQIAYNASSNHRVEGSFLYQHGSFYYLFFSGGVAGSYTATYPAQGEEYRVHVCRSSSGTGGFVDQAGISCLESGGTIILASHDQVYAPGGQGVLTDKDLGPVLYYHYYSLAAKEAGGTGIKGYLYGWNELDFSTGWPVVKAV,./data/raw/alphafold//AF-A0A2H4RAB6-F1-model_v4.pdb,2431,8025,9871,11047 +2937,19633,19918,MDSSSSSSSSGPSPLDLMSALVKAKMDPSNASSDSAAQVTTVLFENREFVMILTTSIAVLIGCVVILIWRRSASQKPKQIQLPLKPSIIKEPELEVDDGKKKVTILFGTQTGTAEGFAKALVEEAKARYEKATFNIVDLDDYAADDEEYEEKMKKDNLAFFFLATYGDGEPTDNAARFYKWFTEGKERGEWLQNMKYGIFGLGNKQYEHFNKVAKVVDELLTEQGAKRIVPLGLGDDDQCIEDDFTAWRELVWPELDQLLRDEDDATVSTPYTAAVLEYRVVFYDPADAPLEDKNWSNANGHATYDAQHPCRSNVAVRKELHAPESDRSCTHLEFDIAGTGLSYETGDHVGVYCENLDEVVDEALSLLGLSPDTYFSVHTDKEDGTPLGGSSLPSSFPPCTLRTALARYADLLSSPKKAALLALAAHASDPTEADRLRHLASPAGKDEYAQWIVANQRSLLEVMAEFPSAKPPLGVFFAAVAPRLQPRYYSISSSPRLAPSRIHVTCALVYEKTPTGRIHKGVCSTWMKNAVSSGKSDDCGWAPIFVRQSNFKLPSDTKVPIIMIGPGTGLAPFRGFLQERLALKEAGAELGPSVLFFGCRNRKMDFIYEDELNNFVNSGALSELVVAFSREGPTKEYVQHKMMEKAKDIWDMISQGGYLYVCGDAKGMARDVHRALHTIFQEQGSLDSSKAESMVKNLQMSGRYLRDVW,brenda,C0LLU5,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.0056,25.0,7.4,1.6.2.4,3635.0,-2.2518119729938,-2.2518119729938,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MDSSSSSSSSGPSPLDLMSALVKAKMDPSNASSDSAAQVTTVLFENREFVMILTTSIAVLIGCVVILIWRRSASQKPKQIQLPLKPSIIKEPELEVDDGKKKVTILFGTQTGTAEGFAKALVEEAKARYEKATFNIVDLDDYAADDEEYEEKMKKDNLAFFFLATYGDGEPTDNAARFYKWFTEGKERGEWLQNMKYGIFGLGNKQYEHFNKVAKVVDELLTEQGAKRIVPLGLGDDDQCIEDDFTAWRELVWPELDQLLRDEDDATVSTPYTAAVLEYRVVFYDPADAPLEDKNWSNANGHATYDAQHPCRSNVAVRKELHAPESDRSCTHLEFDIAGTGLSYETGDHVGVYCENLDEVVDEALSLLGLSPDTYFSVHTDKEDGTPLGGSSLPSSFPPCTLRTALARYADLLSSPKKAALLALAAHASDPTEADRLRHLASPAGKDEYAQWIVANQRSLLEVMAEFPSAKPPLGVFFAAVAPRLQPRYYSISSSPRLAPSRIHVTCALVYEKTPTGRIHKGVCSTWMKNAVSSGKSDDCGWAPIFVRQSNFKLPSDTKVPIIMIGPGTGLAPFRGFLQERLALKEAGAELGPSVLFFGCRNRKMDFIYEDELNNFVNSGALSELVVAFSREGPTKEYVQHKMMEKAKDIWDMISQGGYLYVCGDAKGMARDVHRALHTIFQEQGSLDSSKAESMVKNLQMSGRYLRDVW,./data/raw/alphafold//AF-C0LLU5-F1-model_v4.pdb,4124,4973,702,844 +2938,23962,24346,MAKMRISPELKKLIEKYRCVKDTEGMSPAKVYKLVGENENLYLKMTDSRYKGTTYDVEREKDMMLWLEGKLPVPKVLHFERHDGWSNLLMSEADGVLCSEEYEDEQSPEKIIELYAECIRLFHSIDISDCPYTNSLDSRLAELDYLLNNDLADVDCENWEEDTPFKDPRELYDFLKTEKPEEELVFSHGDLGDSNIFVKDGKVSGFIDLGRSGRADKWYDIAFCVRSIREDIGEEQYVELFFDLLGIKPDWEKIKYYILLDELF,sabio,P0A3Y5,NCC1OC(OC2C(N)CC(N)C(O)C2OC2OC(CO)C(O)C2O)C(N)C(O)C1O,0.0093,37.0,7.5,2.7.1.95,1351.0,-2.0315170514460648,-2.0315170514460648,NCC1OC(OC2C(N)CC(N)C(O)C2OC2OC(CO)C(O)C2O)C(N)C(O)C1O__MAKMRISPELKKLIEKYRCVKDTEGMSPAKVYKLVGENENLYLKMTDSRYKGTTYDVEREKDMMLWLEGKLPVPKVLHFERHDGWSNLLMSEADGVLCSEEYEDEQSPEKIIELYAECIRLFHSIDISDCPYTNSLDSRLAELDYLLNNDLADVDCENWEEDTPFKDPRELYDFLKTEKPEEELVFSHGDLGDSNIFVKDGKVSGFIDLGRSGRADKWYDIAFCVRSIREDIGEEQYVELFFDLLGIKPDWEKIKYYILLDELF,./data/raw/alphafold//AF-P0A3Y5-F1-model_v4.pdb,2935,118,127,141 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+2940,36970,37620,MTQFNPVDHPHRRYNPLTGQWILVSPHRAKRPWQGAQETPAKQVLPAHDPDCFLCAGNVRVTGDKNPDYTGTYVFTNDFAALMSDTPDAPESHDPLMRCQSARGTSRVICFSPDHSKTLPELSVAALTEIVKTWQEQTAELGKTYPWVQVFENKGAAMGCSNPHPHGQIWANSFLPNEAEREDRLQKEYFAEQKSPMLVDYVQRELADGSRTVVETEHWLAVVPYWAAWPFETLLLPKAHVLRITDLTDAQRSDLALALKKLTSRYDNLFQCSFPYSMGWHGAPFNGEENQHWQLHAHFYPPLLRSATVRKFMVGYEMLAETQRDLTAEQAAERLRAVSDIHFRESGV,sabio,P09148,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1,0.412,25.0,8.5,2.7.7.12,562.0,-0.3851027839668654,-0.3851027839668654,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1__MTQFNPVDHPHRRYNPLTGQWILVSPHRAKRPWQGAQETPAKQVLPAHDPDCFLCAGNVRVTGDKNPDYTGTYVFTNDFAALMSDTPDAPESHDPLMRCQSARGTSRVICFSPDHSKTLPELSVAALTEIVKTWQEQTAELGKTYPWVQVFENKGAAMGCSNPHPHGQIWANSFLPNEAEREDRLQKEYFAEQKSPMLVDYVQRELADGSRTVVETEHWLAVVPYWAAWPFETLLLPKAHVLRITDLTDAQRSDLALALKKLTSRYDNLFQCSFPYSMGWHGAPFNGEENQHWQLHAHFYPPLLRSATVRKFMVGYEMLAETQRDLTAEQAAERLRAVSDIHFRESGV,./data/raw/alphafold//AF-P09148-F1-model_v4.pdb,2186,7666,9439,10551 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+2979,18174,18438,MSSFVVPSLTAVRPRDHHDYADRIALSAATTDGVQMRTEDVRAWIAERRDANVFHVERIPFADLDQWWFEGVTGNLVHRSGRFFTIEGLHVIEHDGPHGDGPYREWQQPVIRQPEVGILGILAKEFDGVLHFLMQAKMEPGNPNLVQLSPTVQATRSNYTKAHGGTNVKLIEYFAPPDPERVIVDVLQAEQGSWFFRKSNRNMIVETVDDVPLWDDFCWLTLGQIAELMHEDETINMNSRSVLSCLPYQDITPRALFSDVQLLSWFTNERSRHDVRVRRIPLADVCGWKQGAEEIEHEDGRYFKVLAVAVKGSNREKISWTQPLVESVDLGVVAFLVRKIDGVPHVLVQARVDGGFLDTVELAPTVQCTPLNYAHLPAEERPPFLDLVQNAPRSRIRYEAIHSEEGGRFLGVRARYLVIDADEAIDPPPGYAWVTPAQLTALTRHGHYVNVEARTLLACINAAAAQPRGGA,brenda,O52793,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](C)C(=O)[C@H](O)[C@H]3O)O2)c(=O)nc1O,0.056,25.0,7.5,4.2.1.159,31958.0,-1.2518119729937995,-1.2518119729937995,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](C)C(=O)[C@H](O)[C@H]3O)O2)c(=O)nc1O__MSSFVVPSLTAVRPRDHHDYADRIALSAATTDGVQMRTEDVRAWIAERRDANVFHVERIPFADLDQWWFEGVTGNLVHRSGRFFTIEGLHVIEHDGPHGDGPYREWQQPVIRQPEVGILGILAKEFDGVLHFLMQAKMEPGNPNLVQLSPTVQATRSNYTKAHGGTNVKLIEYFAPPDPERVIVDVLQAEQGSWFFRKSNRNMIVETVDDVPLWDDFCWLTLGQIAELMHEDETINMNSRSVLSCLPYQDITPRALFSDVQLLSWFTNERSRHDVRVRRIPLADVCGWKQGAEEIEHEDGRYFKVLAVAVKGSNREKISWTQPLVESVDLGVVAFLVRKIDGVPHVLVQARVDGGFLDTVELAPTVQCTPLNYAHLPAEERPPFLDLVQNAPRSRIRYEAIHSEEGGRFLGVRARYLVIDADEAIDPPPGYAWVTPAQLTALTRHGHYVNVEARTLLACINAAAAQPRGGA,./data/raw/alphafold//AF-O52793-F1-model_v4.pdb,998,4445,5911,3281 +2980,40896,41634,MTDKTSLSYKDAGVDIDAGNALVGRIKGVVKKTRRPEVMGGLGGFGALCALPQKYREPVLVSGTDGVGTKLRLAMDLKRHDTIGIDLVAMCVNDLVVQGAEPLFFLDYYATGKLDVDTASAVISGIAEGCLQSGCSLVGGETAEMPGMYHGEDYDVAGFCVGVVEKSEIIDGSKVSDGDVLIALGSSGPHSNGYSLVRKILEVSGCDPQTTELDGKPLADHLLAPTRIYVKSVLELIEKVDVHAIAHLTGGGFWENIPRVLPDNTQAVIDESSWQWPEVFNWLQTAGNVEHHEMYRTFNCGVGMIIALPAPEVDKALALLNANGENAWKIGIIKASDSEQRVVIE,sabio,P08178,[Mg+2],0.3,37.0,,6.3.3.1,562.0,-0.5228787452803376,-0.5228787452803376,[Mg+2]__MTDKTSLSYKDAGVDIDAGNALVGRIKGVVKKTRRPEVMGGLGGFGALCALPQKYREPVLVSGTDGVGTKLRLAMDLKRHDTIGIDLVAMCVNDLVVQGAEPLFFLDYYATGKLDVDTASAVISGIAEGCLQSGCSLVGGETAEMPGMYHGEDYDVAGFCVGVVEKSEIIDGSKVSDGDVLIALGSSGPHSNGYSLVRKILEVSGCDPQTTELDGKPLADHLLAPTRIYVKSVLELIEKVDVHAIAHLTGGGFWENIPRVLPDNTQAVIDESSWQWPEVFNWLQTAGNVEHHEMYRTFNCGVGMIIALPAPEVDKALALLNANGENAWKIGIIKASDSEQRVVIE,./data/raw/alphafold//AF-P08178-F1-model_v4.pdb,1391,6642,6163,11882 +2981,37320,37980,MNLTIIGSGYVGLVTGACLADIGHDVFCLDVDQAKIDILNNGGVPIHEPGLKEVIARNRSAGRLRFSTDIEAAVAHGDVQFIAVGTPPDEDGSADLQYVLAAARNIGRYMTGFKVIVDKSTVPVGTAERVRAAVAEELAKRGGDQMFSVVSNPEFLKEGAAVDDFTRPDRIVIGCDDDVPGERARELMKKLYAPFNRNHERTLYMDVRSAEFTKYAANAMLATRISFMNELANLADRFGADIEAVRRGIGSDPRIGYHFLYAGCGYGGSCFPKDVEALIRTADEHGQSLQILKAVSSVNATQKRVLADKIVARFGEDLTGRTFAIWGLAFKPNTDDMREAPSRELIAELLSRGARIAAYDPVAQEEARRVIALDLADHPSWLERLSFVDDEAQAARDADALVIVTEWKIFKSPDFVALGRLWKTPVIFDGRNLYEPETMSEQGIEYHPIGRPGSRQAVAARVTGTAPASA,brenda,C9E261,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O,0.23,30.0,8.7,1.1.1.22,292.0,-0.6382721639824072,-0.6382721639824072,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O__MNLTIIGSGYVGLVTGACLADIGHDVFCLDVDQAKIDILNNGGVPIHEPGLKEVIARNRSAGRLRFSTDIEAAVAHGDVQFIAVGTPPDEDGSADLQYVLAAARNIGRYMTGFKVIVDKSTVPVGTAERVRAAVAEELAKRGGDQMFSVVSNPEFLKEGAAVDDFTRPDRIVIGCDDDVPGERARELMKKLYAPFNRNHERTLYMDVRSAEFTKYAANAMLATRISFMNELANLADRFGADIEAVRRGIGSDPRIGYHFLYAGCGYGGSCFPKDVEALIRTADEHGQSLQILKAVSSVNATQKRVLADKIVARFGEDLTGRTFAIWGLAFKPNTDDMREAPSRELIAELLSRGARIAAYDPVAQEEARRVIALDLADHPSWLERLSFVDDEAQAARDADALVIVTEWKIFKSPDFVALGRLWKTPVIFDGRNLYEPETMSEQGIEYHPIGRPGSRQAVAARVTGTAPASA,./data/raw/alphafold//AF-C9E261-F1-model_v4.pdb,4314,5231,10118,11312 +2982,12986,13179,MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,uniprot_search,P08246,COC(=O)CCC(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCSC)C(=O)Nc1ccc([N+](=O)[O-])cc1,2.4,25.0,7.5,3.4.21.37,9606.0,0.380211241711606,0.380211241711606,COC(=O)CCC(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCSC)C(=O)Nc1ccc([N+](=O)[O-])cc1__MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,./data/raw/alphafold//AF-P08246-F1-model_v4.pdb,5158,2136,1415,3198 +2983,14647,14858,MRASTVTIKTEQDLEKLRVSGRLAAQVLEMIGEYVKPGVTTEYLDNICNDYIVNTLKVIPANVGYHGFTKTICTSVNEVVCHGIPSQNKILKDGDIINIDVAIIKDGYFGDTSRMYYVGNVNPHAKKLVETTYEAMVAGIHVVKPGATLGDIGYAIQSVAHREGYSIVREYCGHGIGKVYHEQPNILHYGQRGQGLVLKKGMVFTIEPMVNAGKPQVKELNDGWTVITQDHSLSAQWEHMVAVTDTGFELLTPWPEGVGNYLEI,brenda,A0A1E3MBK2,CSCC[C@H](N)C(O)=Nc1ccc2c(C)cc(=O)oc2c1,0.111,30.0,8.0,3.4.11.18,470.0,-0.9546770212133424,-0.8514607199616472,CSCC[C@H](N)C(O)=Nc1ccc2c(C)cc(=O)oc2c1__MRASTVTIKTEQDLEKLRVSGRLAAQVLEMIGEYVKPGVTTEYLDNICNDYIVNTLKVIPANVGYHGFTKTICTSVNEVVCHGIPSQNKILKDGDIINIDVAIIKDGYFGDTSRMYYVGNVNPHAKKLVETTYEAMVAGIHVVKPGATLGDIGYAIQSVAHREGYSIVREYCGHGIGKVYHEQPNILHYGQRGQGLVLKKGMVFTIEPMVNAGKPQVKELNDGWTVITQDHSLSAQWEHMVAVTDTGFELLTPWPEGVGNYLEI,./data/raw/alphafold//AF-A0A1E3MBK2-F1-model_v4.pdb,448,3687,5029,5347 +2984,9087,9235,NTDQSFPGFVGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLHVYDGKFLSRVERVIVVSMNYRVGALGFLALPGNPEAPGNMGLFDQQLALQWVQKNIAAFGGNPKSVTLFGESAGAVSVSLHL,brenda,P32752,CCCC(=O)SCC[N+](C)(C)C,0.25,22.0,8.0,3.1.1.8,9823.0,-0.6020599913279624,-0.6201660776551847,CCCC(=O)SCC[N+](C)(C)C__NTDQSFPGFVGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLHVYDGKFLSRVERVIVVSMNYRVGALGFLALPGNPEAPGNMGLFDQQLALQWVQKNIAAFGGNPKSVTLFGESAGAVSVSLHL,./data/raw/alphafold//AF-P32752-F1-model_v4.pdb,3730,1407,2177,2091 +2985,16439,16680,MDLKHHYLELNDGHFIPILGFGTYAPEEVPKSMAREATKLAIEAGFRHIDSAYLYQNEKEIGLAIQSKIADGTVKREDIFYTSKLWCTFHLPEMVQPTLERCLKEVQLDYVDLYLIHFPIPLKPGEETIPRDEHGNLLYDTVDICDTWEAMEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYLNQSKMLNFCKSNNIALVAYFALGAQRDTWMDQSAPVLLEDPVLCALAKKYKRSPAQIALRYQLQRGVVVLAKSFNEKRIKENIQVFDFQLTSEDMKTIDGLNRNLRYNAGSYFDGHPNHPFSDEY,brenda,T2HVB4,C[C@]12CCC(=O)C[C@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12,0.003,25.0,7.4,1.1.1.357,9986.0,-2.5228787452803374,-2.5228787452803374,C[C@]12CCC(=O)C[C@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12__MDLKHHYLELNDGHFIPILGFGTYAPEEVPKSMAREATKLAIEAGFRHIDSAYLYQNEKEIGLAIQSKIADGTVKREDIFYTSKLWCTFHLPEMVQPTLERCLKEVQLDYVDLYLIHFPIPLKPGEETIPRDEHGNLLYDTVDICDTWEAMEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYLNQSKMLNFCKSNNIALVAYFALGAQRDTWMDQSAPVLLEDPVLCALAKKYKRSPAQIALRYQLQRGVVVLAKSFNEKRIKENIQVFDFQLTSEDMKTIDGLNRNLRYNAGSYFDGHPNHPFSDEY,./data/raw/alphafold//AF-T2HVB4-F1-model_v4.pdb,2022,202,2224,2147 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+3039,5598,5684,MKRLVCVLLVCSSAVAQLHKDPTLDHHWHLWKKTYGKQYKEKNEEAVRRLIWEKNLKFVMLHNLEHSMGMHSYDLGMNHLGDMTSEEVMSLMSSLRVPSQWQRNITYKSNPNRILPDSVDWREKGCVTEVKYQGSCGACWAFSAVGALEAQLKLKTGKLVSLSAQNLVDCSTEKYGNKGCNGGFMTTAFQYIIDNKGIDSDASYPYKAMDQKCQYDSKYRAATCSKYTELPYGREDVLKEAVANKGPVSVGVDARHPSFFLYRSGVYYEPSCTQNVNHGVLVVGYGDLNGKEYWLVKNSWGHNFGEEGYIRMARNKGNHCGIASFPSYPEI,uniprot_search,P25774,CC(C)[C@H](N=C(O)CN=C(O)[C@@H](N=C(O)[C@@H](N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN)[C@@H](C)O)C(C)C)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=N[C@H](CCCNC(=N)N)C(=N)O,0.00237,37.0,5.5,3.4.22.27,9606.0,-2.625251653989896,-2.625251653989896,CC(C)[C@H](N=C(O)CN=C(O)[C@@H](N=C(O)[C@@H](N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN)[C@@H](C)O)C(C)C)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=N[C@H](CCCNC(=N)N)C(=N)O__MKRLVCVLLVCSSAVAQLHKDPTLDHHWHLWKKTYGKQYKEKNEEAVRRLIWEKNLKFVMLHNLEHSMGMHSYDLGMNHLGDMTSEEVMSLMSSLRVPSQWQRNITYKSNPNRILPDSVDWREKGCVTEVKYQGSCGACWAFSAVGALEAQLKLKTGKLVSLSAQNLVDCSTEKYGNKGCNGGFMTTAFQYIIDNKGIDSDASYPYKAMDQKCQYDSKYRAATCSKYTELPYGREDVLKEAVANKGPVSVGVDARHPSFFLYRSGVYYEPSCTQNVNHGVLVVGYGDLNGKEYWLVKNSWGHNFGEEGYIRMARNKGNHCGIASFPSYPEI,./data/raw/alphafold//AF-P25774-F1-model_v4.pdb,847,4216,5647,3021 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+3066,20744,21056,MKVGIPREVKNNEFRVAITPAGVHELVRHGHQVVIEKDAGVGSSITDQEFVAAGAQILPTADEVWAAADLLLKVKEPVAEEYHRLRKDQTLFTYLHLAASRECTDALLASGTTAIAYETVETANRALPLLAPMSEVAGRLAPQVGAYHLMRSVGGRGVLPGGVPGTAAGKAVVIGGGVSGWNATQIAVGLGFHVTLLDRDINKLREADRIFGTKVQTVVSNAFELEKAVVEADLVIGAVLIPGAKAPKLVTNELVAKMKPGSVLVDIAIDQGGCFEDSRPTTHAEPTFQVHESVFYCVANMPGAVPHTSTYALTNATLPYIVELANRGWADALRRDAALAKGLNTHEGQVVYREVAEAHGLPHVELTALLG,brenda,A0A6G3T2F2,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.126,40.0,8.5,1.4.1.1,1892.0,-0.8996294548824371,-0.8996294548824371,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MKVGIPREVKNNEFRVAITPAGVHELVRHGHQVVIEKDAGVGSSITDQEFVAAGAQILPTADEVWAAADLLLKVKEPVAEEYHRLRKDQTLFTYLHLAASRECTDALLASGTTAIAYETVETANRALPLLAPMSEVAGRLAPQVGAYHLMRSVGGRGVLPGGVPGTAAGKAVVIGGGVSGWNATQIAVGLGFHVTLLDRDINKLREADRIFGTKVQTVVSNAFELEKAVVEADLVIGAVLIPGAKAPKLVTNELVAKMKPGSVLVDIAIDQGGCFEDSRPTTHAEPTFQVHESVFYCVANMPGAVPHTSTYALTNATLPYIVELANRGWADALRRDAALAKGLNTHEGQVVYREVAEAHGLPHVELTALLG,./data/raw/alphafold//AF-A0A6G3T2F2-F1-model_v4.pdb,3346,734,917,1123 +3067,22895,23248,MAPKAKIVLVGSGMIGGVMATLIVQKNLGDVVLFDIVKNMPHGKALDTSHTNVMAYSNCKVSGSNTYDDLAGADVVIVTAGFTKAPGKSDKEWNRDDLLPLNNKIMIEIGGHIKKNCPNAFIIVVTNPVDVMVQLLHQHSGVPKNKIIGLGGVLDTSRLKYYISQKLNVCPRDVNAHIVGAHGNKMVLLKRYITVGGIPLQEFINNKLISDAELEAIFDRTVNTALEIVNLHASPYVAPAAAIIEMAESYLKDLKKVLICSTLLEGQYGHSDIFGGTPVVLGANGVEQVIELQLNSEEKAKFDEAIAETKRMKALA,sabio,Q27743,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.086,25.0,9.2,1.1.1.27,5833.0,-1.0655015487564323,-1.0655015487564323,NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MAPKAKIVLVGSGMIGGVMATLIVQKNLGDVVLFDIVKNMPHGKALDTSHTNVMAYSNCKVSGSNTYDDLAGADVVIVTAGFTKAPGKSDKEWNRDDLLPLNNKIMIEIGGHIKKNCPNAFIIVVTNPVDVMVQLLHQHSGVPKNKIIGLGGVLDTSRLKYYISQKLNVCPRDVNAHIVGAHGNKMVLLKRYITVGGIPLQEFINNKLISDAELEAIFDRTVNTALEIVNLHASPYVAPAAAIIEMAESYLKDLKKVLICSTLLEGQYGHSDIFGGTPVVLGANGVEQVIELQLNSEEKAKFDEAIAETKRMKALA,./data/raw/alphafold//AF-Q27743-F1-model_v4.pdb,3333,717,853,1039 +3068,17408,17658,MWGLKVLLLPVVSFALYPEEILDTHWELWKKTHRKQYNNKVDEISRRLIWEKNLKYISIHNLEASLGVHTYELAMNHLGDMTSEEVVQKMTGLKVPLSHSRSNDTLYIPEWEGRAPDSVDYRKKGYVTPVKNQGQCGSCWAFSSVGALEGQLKKKTGKLLNLSPQNLVDCVSENDGCGGGYMTNAFQYVQKNRGIDSEDAYPYVGQEESCMYNPTGKAAKCRGYREIPEGNEKALKRAVARVGPVSVAIDASLTSFQFYSKGVYYDESCNSDNLNHAVLAVGYGIQKGNKHWIIKNSWGENWGNKGYILMARNKNNACGIANLASFPKM,brenda,P43235,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H]3CCCN3C(=O)CN=C(O)OCc3ccccc3)ccc12,0.048,28.0,5.5,3.4.22.38,9606.0,-1.3187587626244128,-1.3187587626244128,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H]3CCCN3C(=O)CN=C(O)OCc3ccccc3)ccc12__MWGLKVLLLPVVSFALYPEEILDTHWELWKKTHRKQYNNKVDEISRRLIWEKNLKYISIHNLEASLGVHTYELAMNHLGDMTSEEVVQKMTGLKVPLSHSRSNDTLYIPEWEGRAPDSVDYRKKGYVTPVKNQGQCGSCWAFSSVGALEGQLKKKTGKLLNLSPQNLVDCVSENDGCGGGYMTNAFQYVQKNRGIDSEDAYPYVGQEESCMYNPTGKAAKCRGYREIPEGNEKALKRAVARVGPVSVAIDASLTSFQFYSKGVYYDESCNSDNLNHAVLAVGYGIQKGNKHWIIKNSWGENWGNKGYILMARNKNNACGIANLASFPKM,./data/raw/alphafold//AF-P43235-F1-model_v4.pdb,847,4242,5677,3535 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+3112,16555,16796,MSSSKPSFSDYFGKLGGIPMYKKFIEQFHNVEEFEARPDDLVIVTYPKSGTTWLSEIICMIYNNGDVEKCKEDVIFNRVPYLECSTEHVMKGVKQLNEMASPRIVKSHLPVKLLPVSFWEKNCKIIYLSRNAKDVVVSYYFLILMVTAIPDPDSFQDFVEKFMDGEVPYGSWFEHTKSWWEKSKNPQVLFLFYEDMKENIRKEVMKLLEFLGRKASDELVDKIIKHTSFQEMKNNPSTNYTTLPDEVMNQKVSPFMRKGDVGDWKNHFTVALNEKFDMHYEQQMKGSTLKFRTKI,uniprot_search,P19217,C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CCC2=O,0.015,37.0,8.1,2.8.2.4,9913.0,-1.8239087409443189,-2.082138980369032,C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CCC2=O__MSSSKPSFSDYFGKLGGIPMYKKFIEQFHNVEEFEARPDDLVIVTYPKSGTTWLSEIICMIYNNGDVEKCKEDVIFNRVPYLECSTEHVMKGVKQLNEMASPRIVKSHLPVKLLPVSFWEKNCKIIYLSRNAKDVVVSYYFLILMVTAIPDPDSFQDFVEKFMDGEVPYGSWFEHTKSWWEKSKNPQVLFLFYEDMKENIRKEVMKLLEFLGRKASDELVDKIIKHTSFQEMKNNPSTNYTTLPDEVMNQKVSPFMRKGDVGDWKNHFTVALNEKFDMHYEQQMKGSTLKFRTKI,./data/raw/alphafold//AF-P19217-F1-model_v4.pdb,4829,2101,5226,5551 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+3114,28044,28526,MAKKLLGIDLGGTSIKFGILTLDGQVQEKWAIETNILEDGKHIVPDIVSSIKHRLGLYNLTKEDFVGIGMGSPGAVDRNLKTVTGAFNLNWAATQEVGTIIEAELGIPFAIDNDANVAALGERWVGAGNNNPDVVFVTLGTGVGGGIIADGNLIHGVAGAGGEIGHIIVEPDTGFECTCGNKGCLETVASATGVVRVARHLAEEYEGISSIKAGIDNGDDVSSKDIFVAAQAGDKFANSVVEKVTFYLGLATANISNILNPNTVVVGGGVSAAGEFLRSHIESYFKLYAFPQVKQSTKIKIAELGNDAGIIGAASLAHQFLES,uniprot_search,A0A2J9QFK1,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.21,22.0,7.5,2.7.1.2,1309.0,-0.6777807052660807,-0.6777807052660807,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MAKKLLGIDLGGTSIKFGILTLDGQVQEKWAIETNILEDGKHIVPDIVSSIKHRLGLYNLTKEDFVGIGMGSPGAVDRNLKTVTGAFNLNWAATQEVGTIIEAELGIPFAIDNDANVAALGERWVGAGNNNPDVVFVTLGTGVGGGIIADGNLIHGVAGAGGEIGHIIVEPDTGFECTCGNKGCLETVASATGVVRVARHLAEEYEGISSIKAGIDNGDDVSSKDIFVAAQAGDKFANSVVEKVTFYLGLATANISNILNPNTVVVGGGVSAAGEFLRSHIESYFKLYAFPQVKQSTKIKIAELGNDAGIIGAASLAHQFLES,./data/raw/alphafold//AF-A0A2J9QFK1-F1-model_v4.pdb,2618,8295,8412,7903 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+3116,1143,1173,MEPGSKSVSRSDWQPEPHQRPITPLEPGPEKTPIAQPESKTLQGSNTQQKPASNQRPLTQQETPAQHDAESQKEPRAQQKSASQEEFLAPQKPAPQQSPYIQRVLLTQQEAASQQGPGLGKESITQQEPALRQRHVAQPGPGPGEPPPAQQEAESTPAAQAKPGAKREPSAPTESTSQETPEQSDKQTTPVQGAKSKQGSLTELGFLTKLQELSIQRSALEWKALSEWVTDSESESDVGSSSDTDSPATMGGMVAQGVKLGFKGKSGYKVMSGYSGTSPHEKTSARNHRHYQDTASRLIHNMDLRTMTQSLVTLAEDNIAFFSSQGPGETAQRLSGVFAGVREQALGLEPALGRLLGVAHLFDLDPETPANGYRSLVHTARCCLAHLLHKSRYVASNRRSIFFRTSHNLAELEAYLAALTQLRALVYYAQRLLVTNRPGVLFFEGDEGLTADFLREYVTLHKGCFYGRCLGFQFTPAIRPFLQTISIGLVSFGEHYKRNETGLSVAASSLFTSGRFAIDPELRGAEFERITQNLDVHFWKAFWNITEMEVLSSLANMASATVRVSRLLSLPPEAFEMPLTADPTLTVTISPPLAHTGPGPVLVRLISYDLREGQDSEELSSLIKSNGQRSLELWPRPQQAPRSRSLIVHFHGGGFVAQTSRSHEPYLKSWAQELGAPIISIDYSLAPEAPFPRALEECFFAYCWAIKHCALLGSTGERICLAGDSAGGNLCFTVALRAAAYGVRVPDGIMAAYPATMLQPAASPSRLLSLMDPLLPLSVLSKCVSAYAGAKTEDHSNSDQKALGMMGLVRRDTALLLRDFRLGASSWLNSFLELSGRKSQKMSEPIAEPMRRSVSEAALAQPQGPLGTDSLKNLTLRDLSLRGNSETSSDTPEMSLSAETLSPSTPSDVNFLLPPEDAGEEAEAKNELSPMDRGLGVRAAFPEGFHPRRSSQGATQMPLYSSPIVKNPFMSPLLAPDSMLKSLPPVHIVACALDPMLDDSVMLARRLRNLGQPVTLRVVEDLPHGFLTLAALCRETRQAAELCVERIRLVLTPPAGAGPSGETGAAGVDGGCGGRH,sabio,Q05469,C=COC(=O)CC,70.0,25.0,7.0,3.1.1.1,9606.0,1.845098040014257,1.845098040014257,C=COC(=O)CC__MEPGSKSVSRSDWQPEPHQRPITPLEPGPEKTPIAQPESKTLQGSNTQQKPASNQRPLTQQETPAQHDAESQKEPRAQQKSASQEEFLAPQKPAPQQSPYIQRVLLTQQEAASQQGPGLGKESITQQEPALRQRHVAQPGPGPGEPPPAQQEAESTPAAQAKPGAKREPSAPTESTSQETPEQSDKQTTPVQGAKSKQGSLTELGFLTKLQELSIQRSALEWKALSEWVTDSESESDVGSSSDTDSPATMGGMVAQGVKLGFKGKSGYKVMSGYSGTSPHEKTSARNHRHYQDTASRLIHNMDLRTMTQSLVTLAEDNIAFFSSQGPGETAQRLSGVFAGVREQALGLEPALGRLLGVAHLFDLDPETPANGYRSLVHTARCCLAHLLHKSRYVASNRRSIFFRTSHNLAELEAYLAALTQLRALVYYAQRLLVTNRPGVLFFEGDEGLTADFLREYVTLHKGCFYGRCLGFQFTPAIRPFLQTISIGLVSFGEHYKRNETGLSVAASSLFTSGRFAIDPELRGAEFERITQNLDVHFWKAFWNITEMEVLSSLANMASATVRVSRLLSLPPEAFEMPLTADPTLTVTISPPLAHTGPGPVLVRLISYDLREGQDSEELSSLIKSNGQRSLELWPRPQQAPRSRSLIVHFHGGGFVAQTSRSHEPYLKSWAQELGAPIISIDYSLAPEAPFPRALEECFFAYCWAIKHCALLGSTGERICLAGDSAGGNLCFTVALRAAAYGVRVPDGIMAAYPATMLQPAASPSRLLSLMDPLLPLSVLSKCVSAYAGAKTEDHSNSDQKALGMMGLVRRDTALLLRDFRLGASSWLNSFLELSGRKSQKMSEPIAEPMRRSVSEAALAQPQGPLGTDSLKNLTLRDLSLRGNSETSSDTPEMSLSAETLSPSTPSDVNFLLPPEDAGEEAEAKNELSPMDRGLGVRAAFPEGFHPRRSSQGATQMPLYSSPIVKNPFMSPLLAPDSMLKSLPPVHIVACALDPMLDDSVMLARRLRNLGQPVTLRVVEDLPHGFLTLAALCRETRQAAELCVERIRLVLTPPAGAGPSGETGAAGVDGGCGGRH,./data/raw/alphafold//AF-Q05469-F1-model_v4.pdb,3268,620,723,874 +3117,39454,40157,MSTSSSAVSQLKNSPLAGNINYEPTVWSRADALKVNENDPTTTQPLVSADFPVMSDTVFIWDTMPLRELDGTVVSVNGWSVILTLTADRHPNDPQYLDANGRYDIKRDWEDRHGRARMSYWYSRTGKDWIFGGRVMAEGVSPTTREWAGTPILLNDKGDIDLYYTCVTPGAAIAKVRGRIVTSDQGVELKDFTQVKKLFEADGTYYQTEAQNSSWNFRDPSPFIDPNDGKLYMVFEGNVAGERGSHTVGAAELGPVPPGHEDVGGARFQVGCIGLAVAKDLSGEEWEILPPLVTAVGVNDQTERPHYVFQDGKYYLFTISHKFTYAEGLTGPDGVYGFVGEHLFGPYRPMNASGLVLGNPPEQPFQTYSHCVMPNGLVTSFIDSVPTEGEDYRIGGTEAPTVRILLKGDRSFVQEEYDYGYIPAMKDVTLS,brenda,O68609,OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,160.0,60.0,5.8,2.4.1.10,317.0,2.204119982655925,2.204119982655925,OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O__MSTSSSAVSQLKNSPLAGNINYEPTVWSRADALKVNENDPTTTQPLVSADFPVMSDTVFIWDTMPLRELDGTVVSVNGWSVILTLTADRHPNDPQYLDANGRYDIKRDWEDRHGRARMSYWYSRTGKDWIFGGRVMAEGVSPTTREWAGTPILLNDKGDIDLYYTCVTPGAAIAKVRGRIVTSDQGVELKDFTQVKKLFEADGTYYQTEAQNSSWNFRDPSPFIDPNDGKLYMVFEGNVAGERGSHTVGAAELGPVPPGHEDVGGARFQVGCIGLAVAKDLSGEEWEILPPLVTAVGVNDQTERPHYVFQDGKYYLFTISHKFTYAEGLTGPDGVYGFVGEHLFGPYRPMNASGLVLGNPPEQPFQTYSHCVMPNGLVTSFIDSVPTEGEDYRIGGTEAPTVRILLKGDRSFVQEEYDYGYIPAMKDVTLS,./data/raw/alphafold//AF-O68609-F1-model_v4.pdb,2723,8468,4513,11672 +3118,4865,4940,MAAATGPSFWLGNETLKVPLALFALNRQRLCERLRKNPAVQAGSIVVLQGGEETQRYCTDTGVLFRQESFFHWAFGVTEPGCYGVIDVDTGKSTLFVPRLPASHATWMGKIHSKEHFKEKYAVDDVQYVDEIASVLTSQKPSVLLTLRGVNTDSGSVCREASFDGISKFEVNNTILHPEIVECRVFKTDMELEVLRYTNKISSEAHREVMKAVKVGMKEYELESLFEHYCYSRGGMRHSSYTCICGSGENSAVLHYGHAGAPNDRTIQNGDMCLFDMGGEYYCFASDITCSFPANGKFTADQKAVYEAVLRSSRAVMGAMKPGVWWPDMHRLADRIHLEELAHMGILSGSVDAMVQAHLGAVFMPHGLGHFLGIDVHDVGGYPEGVERIDEPGLRSLRTARHLQPGMVLTVEPGIYFIDHLLDEALADPARASFLNREVLQRFRGFGGVRIEEDVVVTDSGIELLTCVPRTVEEIEACMAGCDKAFTPFSGPK,uniprot_search,P12955,CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O,1.3,43.5,7.660714285714286,3.4.13.9,9606.0,0.1139433523068367,0.1313833577423184,CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O__MAAATGPSFWLGNETLKVPLALFALNRQRLCERLRKNPAVQAGSIVVLQGGEETQRYCTDTGVLFRQESFFHWAFGVTEPGCYGVIDVDTGKSTLFVPRLPASHATWMGKIHSKEHFKEKYAVDDVQYVDEIASVLTSQKPSVLLTLRGVNTDSGSVCREASFDGISKFEVNNTILHPEIVECRVFKTDMELEVLRYTNKISSEAHREVMKAVKVGMKEYELESLFEHYCYSRGGMRHSSYTCICGSGENSAVLHYGHAGAPNDRTIQNGDMCLFDMGGEYYCFASDITCSFPANGKFTADQKAVYEAVLRSSRAVMGAMKPGVWWPDMHRLADRIHLEELAHMGILSGSVDAMVQAHLGAVFMPHGLGHFLGIDVHDVGGYPEGVERIDEPGLRSLRTARHLQPGMVLTVEPGIYFIDHLLDEALADPARASFLNREVLQRFRGFGGVRIEEDVVVTDSGIELLTCVPRTVEEIEACMAGCDKAFTPFSGPK,./data/raw/alphafold//AF-P12955-F1-model_v4.pdb,5125,1992,1471,2975 +3119,23950,24334,MSGADRSPNAGAAPDSAPGQAAVASAYQRFEPRAYLRNNYAPPRGDLCNPNGVGPWKLRCLAQTFATGEVSGRTLIDIGSGPTVYQLLSACSHFEDITMTDFLEVNRQELGRWLQEEPGAFNWSMYSQHACLIEGKGECWQDKERQLRARVKRVLPIDVHQPQPLGAGSPAPLPADALVSAFCLEAVSPDLASFQRALDHITTLLRPGGHLLLIGALEESWYLAGEARLTVVPVSEEEVREALVRSGYKVRDLRTYIMPAHLQTGVDDVKGVFFAWAQKVGL,brenda,P11086,NCC(O)c1ccc(O)cc1,0.0055,30.0,8.0,2.1.1.28,9606.0,-2.2596373105057563,-2.2596373105057563,NCC(O)c1ccc(O)cc1__MSGADRSPNAGAAPDSAPGQAAVASAYQRFEPRAYLRNNYAPPRGDLCNPNGVGPWKLRCLAQTFATGEVSGRTLIDIGSGPTVYQLLSACSHFEDITMTDFLEVNRQELGRWLQEEPGAFNWSMYSQHACLIEGKGECWQDKERQLRARVKRVLPIDVHQPQPLGAGSPAPLPADALVSAFCLEAVSPDLASFQRALDHITTLLRPGGHLLLIGALEESWYLAGEARLTVVPVSEEEVREALVRSGYKVRDLRTYIMPAHLQTGVDDVKGVFFAWAQKVGL,./data/raw/alphafold//AF-P11086-F1-model_v4.pdb,736,4157,5579,5970 +3120,25128,25523,MQLTKGLEVEIYTGKKTGEIVGLSDRIVRDLSGFVREPDSRNVEYTTPPLNSYDRLLCGILQPRRQLRHYLSQLGEDYTLIPGSCLALGGTDTFYRSDPQNPYHTYIEQTYSTQVVTASIHINIGIPDVEELIRACRLVRMEAPLYLALSASSPFLNGQVTGYHSSRWQMFPKTPQEVPLFTSHGHFVQWTEEQLTLGTMQNVRHLWSAVRPNGDNRPHNLNRLELRICDLVTNPLSLLAIVALLEARLQQMLADPTLDPLQQSQLTPSELLALADQNEISAAVSSLDSTLHHWRDGRAIAAREWIEELYQSVQLEAKYQGFACFLPPLRKILREGNQAQQWLTQYEQGKTPQTIVQEAILQTEMEEAILAQDLCLPLSKARDEILSLV,brenda,P74515,N[C@@H](CCC(=O)O)C(=O)O,0.953,25.0,7.5,6.3.2.2,1143.0,-0.0209070993616736,-0.0209070993616736,N[C@@H](CCC(=O)O)C(=O)O__MQLTKGLEVEIYTGKKTGEIVGLSDRIVRDLSGFVREPDSRNVEYTTPPLNSYDRLLCGILQPRRQLRHYLSQLGEDYTLIPGSCLALGGTDTFYRSDPQNPYHTYIEQTYSTQVVTASIHINIGIPDVEELIRACRLVRMEAPLYLALSASSPFLNGQVTGYHSSRWQMFPKTPQEVPLFTSHGHFVQWTEEQLTLGTMQNVRHLWSAVRPNGDNRPHNLNRLELRICDLVTNPLSLLAIVALLEARLQQMLADPTLDPLQQSQLTPSELLALADQNEISAAVSSLDSTLHHWRDGRAIAAREWIEELYQSVQLEAKYQGFACFLPPLRKILREGNQAQQWLTQYEQGKTPQTIVQEAILQTEMEEAILAQDLCLPLSKARDEILSLV,./data/raw/alphafold//AF-P74515-F1-model_v4.pdb,1035,6156,7955,8070 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+3188,10500,10655,MRRKTLKYLTFFLLFIFLTSFVLNYSNTGVPSAWFPKQMLLELSENFRRFIKSQPCTCRHCISQDKVSYWFDQRFNKTMQPLLTVHNALMEEDTYRWWLRLQRERKPNNLSDTVKELFRLVPGNVDPMLNKRLVGCRRCAVVGNSGNLKDSSYGPEIDSHDFVLRMNKAPTVGFEADVGSRTTHHLVYPESFRELGENVNMVLVPFKTTDLQWVISATTTGTITHTYVPVPPKIKVKQEKILIYHPAFIKYVFDNWLQGHGRYPSTGILSIIFSIHICDEVDLYGFGADSKGNWHHYWENNPSAGAFRKTGVHDGDFEYNITTTLAAINKIRIFKGR,brenda,P54751,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]3N=C(C)O)[C@H](O[C@@]3(C(=O)O)C[C@H](O)[C@@H](N=C(C)O)[C@H]([C@H](O)[C@@H](CO)O[C@@]4(C(=O)O)C[C@H](O)[C@@H](N=C(C)O)[C@H]([C@H](O)[C@H](O)CO)O4)O3)[C@H]2O)[C@H](O)C1O)N=C(O)CCCCCCCCCCCCCCCCCCCCC,0.15,30.0,6.0,2.4.99.2,10090.0,-0.8239087409443188,-0.8239087409443188,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]3N=C(C)O)[C@H](O[C@@]3(C(=O)O)C[C@H](O)[C@@H](N=C(C)O)[C@H]([C@H](O)[C@@H](CO)O[C@@]4(C(=O)O)C[C@H](O)[C@@H](N=C(C)O)[C@H]([C@H](O)[C@H](O)CO)O4)O3)[C@H]2O)[C@H](O)C1O)N=C(O)CCCCCCCCCCCCCCCCCCCCC__MRRKTLKYLTFFLLFIFLTSFVLNYSNTGVPSAWFPKQMLLELSENFRRFIKSQPCTCRHCISQDKVSYWFDQRFNKTMQPLLTVHNALMEEDTYRWWLRLQRERKPNNLSDTVKELFRLVPGNVDPMLNKRLVGCRRCAVVGNSGNLKDSSYGPEIDSHDFVLRMNKAPTVGFEADVGSRTTHHLVYPESFRELGENVNMVLVPFKTTDLQWVISATTTGTITHTYVPVPPKIKVKQEKILIYHPAFIKYVFDNWLQGHGRYPSTGILSIIFSIHICDEVDLYGFGADSKGNWHHYWENNPSAGAFRKTGVHDGDFEYNITTTLAAINKIRIFKGR,./data/raw/alphafold//AF-P54751-F1-model_v4.pdb,5684,2473,3109,3590 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+3191,13059,13252,MQSIKRTLLLLGAILPAVLGAPVQETRRAAEKLPGKYIVTFKSGIDEAKIQEHTTWATNIHQRSLERRGATGGDLPVGIERNYKINKFAAYAGSFDDATIEEIRKNEDVAYVEEDQIYYLDGLTTQKNAPWGLGSISHKGQQSTDYIYDTSAGEGTYAYVVDSGVNVDHEEFEGRASKAYNAAGGQHEDSIGHGTHVSGTIAGKTYGIAKKASILSVKVFQGESSSTSIILDGFNWAANDIVSKKRTSKAAINMSLGGGYSKAFNDAVENAFEQGVLSVVAAGNENSDAGQTSPASAPDALTVAAIQKSNSRASFSNFGTVVDIFAPGQDILSAWIGSSSATNTISGTSMATPHIVGLSLYLAALENLDGPAAVTKRIKELATKDVVKDVKGSPNLLAYNGNA,uniprot_search,A0A386IRJ1,COC(=O)[C@H](C)N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(C)O,7.0,50.0,9.5,3.4.21.63,41058.0,0.8450980400142568,0.8450980400142568,COC(=O)[C@H](C)N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(C)O__MQSIKRTLLLLGAILPAVLGAPVQETRRAAEKLPGKYIVTFKSGIDEAKIQEHTTWATNIHQRSLERRGATGGDLPVGIERNYKINKFAAYAGSFDDATIEEIRKNEDVAYVEEDQIYYLDGLTTQKNAPWGLGSISHKGQQSTDYIYDTSAGEGTYAYVVDSGVNVDHEEFEGRASKAYNAAGGQHEDSIGHGTHVSGTIAGKTYGIAKKASILSVKVFQGESSSTSIILDGFNWAANDIVSKKRTSKAAINMSLGGGYSKAFNDAVENAFEQGVLSVVAAGNENSDAGQTSPASAPDALTVAAIQKSNSRASFSNFGTVVDIFAPGQDILSAWIGSSSATNTISGTSMATPHIVGLSLYLAALENLDGPAAVTKRIKELATKDVVKDVKGSPNLLAYNGNA,./data/raw/alphafold//AF-A0A386IRJ1-F1-model_v4.pdb,299,3453,4713,4968 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+3193,11635,11799,MAKLIALTLLGMGLALFRNHQSSYQTRLNALREVQPVELPNCNLVKGIETGSEDLEILPNGLAFISSGLKYPGIKSFNPNSPGKILLMDLNEEDPTVLELGITGSKFDVSSFNPHGISTFTDEDNAMYLLVVNHPDAKSTVELFKFQEEEKSLLHLKTIRHKLLPNLNDIVAVGPEHFYGTNDHYFLDPYLQSWEMYLGLAWSYVVYYSPSEVRVVAEGFDFANGINISPDGKYVYIAELLAHKIHVYEKHANWTLTPLKSLDFNTLVDNISVDPETGDLWVGCHPNGMKIFFYDSENPPASEVLRIQNILTEEPKVTQVYAENGTVLQGSTVASVYKGKLLIGTVFHKALYCEL,brenda,P27169,CCOP(=O)(OCC)Oc1c(F)cccc1F,1.3,37.25,7.9125,3.1.8.1,9606.0,0.1139433523068367,0.1139433523068367,CCOP(=O)(OCC)Oc1c(F)cccc1F__MAKLIALTLLGMGLALFRNHQSSYQTRLNALREVQPVELPNCNLVKGIETGSEDLEILPNGLAFISSGLKYPGIKSFNPNSPGKILLMDLNEEDPTVLELGITGSKFDVSSFNPHGISTFTDEDNAMYLLVVNHPDAKSTVELFKFQEEEKSLLHLKTIRHKLLPNLNDIVAVGPEHFYGTNDHYFLDPYLQSWEMYLGLAWSYVVYYSPSEVRVVAEGFDFANGINISPDGKYVYIAELLAHKIHVYEKHANWTLTPLKSLDFNTLVDNISVDPETGDLWVGCHPNGMKIFFYDSENPPASEVLRIQNILTEEPKVTQVYAENGTVLQGSTVASVYKGKLLIGTVFHKALYCEL,./data/raw/alphafold//AF-P27169-F1-model_v4.pdb,3621,1260,1994,565 +3194,20565,20874,MANVTYTDTQLLIDGEWVDAASGKTIDVVNPATGKPIGRVAHAGIADLDRALAAAQSGFEAWRKVPAHERAATMRKAAALVRERADAIAQLMTQEQGKPLTEARVEVLSAADIIEWFADEGRRVYGRIVPPRNLGAQQTVVKEPVGPVAAFTPWNFPVNQVVRKLSAALATGCSFLVKAPEETPASPAALLRAFVDAGVPAGVIGLVYGDPAEISSYLIPHPVIRKVTFTGSTPVGKQLASLAGLHMKRATMELGGHAPVIVAEDADVALAVKAAGGAKFRNAGQVCISPTRFLVHNSIRDEFTRALVKHAEGLKVGNGLEEGTTLGALANPRRLTAMASVIDNARKVGASIETGGERIGSEGNFFAPTVIANVPLDADVFNNEPFGPVAAIRGFDKLEEAIAEANRLPFGLAGYAFTRSFANVHLLTQRLEVGMLWINQPATPWPEMPFGGVKDSGYGSEGGPEALEPYLVTKSVTVMAV,brenda,Q1JUP4,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.21,25.0,8.0,1.2.1.26,192.0,-0.6777807052660807,-0.631487212882534,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MANVTYTDTQLLIDGEWVDAASGKTIDVVNPATGKPIGRVAHAGIADLDRALAAAQSGFEAWRKVPAHERAATMRKAAALVRERADAIAQLMTQEQGKPLTEARVEVLSAADIIEWFADEGRRVYGRIVPPRNLGAQQTVVKEPVGPVAAFTPWNFPVNQVVRKLSAALATGCSFLVKAPEETPASPAALLRAFVDAGVPAGVIGLVYGDPAEISSYLIPHPVIRKVTFTGSTPVGKQLASLAGLHMKRATMELGGHAPVIVAEDADVALAVKAAGGAKFRNAGQVCISPTRFLVHNSIRDEFTRALVKHAEGLKVGNGLEEGTTLGALANPRRLTAMASVIDNARKVGASIETGGERIGSEGNFFAPTVIANVPLDADVFNNEPFGPVAAIRGFDKLEEAIAEANRLPFGLAGYAFTRSFANVHLLTQRLEVGMLWINQPATPWPEMPFGGVKDSGYGSEGGPEALEPYLVTKSVTVMAV,./data/raw/alphafold//AF-Q1JUP4-F1-model_v4.pdb,213,5186,7104,7127 +3195,40128,40852,MKISDGNWLIQPGLNLIHPLQVFEVEQQDNEMVVYAAPRDVRERTWQLDTPLFTLRFFSPQEGIVGVRIEHFQGALNNGPHYPLNILQDVKVTIENTERYAEFKSGNLSARVSKGEFWSLDFLRNGERITGSQVKNNGYVQDTNNQRNYMFERLDLGVGETVYGLGERFTALVRNGQTVETWNRDGGTSTEQAYKNIPFYMTNRGYGVLVNHPQCVSFEVGSEKVSKVQFSVESEYLEYFVIDGPTPKAVLDRYTRFTGRPALPPAWSFGLWLTTSFTTNYDEATVNSFIDGMAERNLPLHVFHFDCFWMKAFQWCDFEWDPLTFPDPEGMIRRLKAKGLKICVWINPYIGQKSPVFKELQEKGYLLKRPDGSLWQWDKWQPGLAIYDFTNPDACKWYADKLKGLVAMGVDCFKTDFGERIPTDVQWFDGSDPQKMHNHYAYIYNELVWNVLKDTVGEEEAVLFARSASVGAQKFPVHWGGDCYANYESMAESLRGGLSIGLSGFGFWSHDIGGFENTAPAHVYKRWCAFGLLSSHSRLHGSKSYRVPWAYDDESCDVVRFFTQLKCRMMPYLYREAARANARGTPMMRAMMMEFPDDPACDYLDRQYMLGDNVMVAPVFTEAGDVQFYLPEGRWTHLWHNDELDGSRWHKQQHGFLSLPVYVRDNTLLALGNNDQRPDYVWHEGTAFHLFNLQDGHEAVCEVPAADGSVIFTLKAARTGNTITVTGAGEAKNWTLCLRNVVKVNGLQDGSQAESEQGLVVKPQGNALTITL,brenda,P31434,O[C@@H]1[C@@H](O)[C@@H](F)OC[C@H]1O,0.17,37.0,7.0,3.2.1.177,562.0,-0.7695510786217261,-0.3913896721777406,O[C@@H]1[C@@H](O)[C@@H](F)OC[C@H]1O__MKISDGNWLIQPGLNLIHPLQVFEVEQQDNEMVVYAAPRDVRERTWQLDTPLFTLRFFSPQEGIVGVRIEHFQGALNNGPHYPLNILQDVKVTIENTERYAEFKSGNLSARVSKGEFWSLDFLRNGERITGSQVKNNGYVQDTNNQRNYMFERLDLGVGETVYGLGERFTALVRNGQTVETWNRDGGTSTEQAYKNIPFYMTNRGYGVLVNHPQCVSFEVGSEKVSKVQFSVESEYLEYFVIDGPTPKAVLDRYTRFTGRPALPPAWSFGLWLTTSFTTNYDEATVNSFIDGMAERNLPLHVFHFDCFWMKAFQWCDFEWDPLTFPDPEGMIRRLKAKGLKICVWINPYIGQKSPVFKELQEKGYLLKRPDGSLWQWDKWQPGLAIYDFTNPDACKWYADKLKGLVAMGVDCFKTDFGERIPTDVQWFDGSDPQKMHNHYAYIYNELVWNVLKDTVGEEEAVLFARSASVGAQKFPVHWGGDCYANYESMAESLRGGLSIGLSGFGFWSHDIGGFENTAPAHVYKRWCAFGLLSSHSRLHGSKSYRVPWAYDDESCDVVRFFTQLKCRMMPYLYREAARANARGTPMMRAMMMEFPDDPACDYLDRQYMLGDNVMVAPVFTEAGDVQFYLPEGRWTHLWHNDELDGSRWHKQQHGFLSLPVYVRDNTLLALGNNDQRPDYVWHEGTAFHLFNLQDGHEAVCEVPAADGSVIFTLKAARTGNTITVTGAGEAKNWTLCLRNVVKVNGLQDGSQAESEQGLVVKPQGNALTITL,./data/raw/alphafold//AF-P31434-F1-model_v4.pdb,2104,5614,4397,10109 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+3197,39931,40651,MASSPASLLFKVHRREPELIKPAKPTPHEFKLLSDIDDQEGLRFHIPVMQFYRNNPSMQGKDPVKIIREALAKTLVFYYPFAGRLREGPNRKLMVECTGEGILFIEADADVTLEQFGDALQPPFPCLEELLFDVPGSSGVLNCPLLLIQVTRLKCGGFLFALRLNHTMSDAVGLVQFMAAVGEMARGANAPSVPAVWERQVLNASDPPRVTCTHREYEEVADTKGTIIPLDDMAHRSFFFGPSEMSALRKFVPPHLSHCSTFEILTACLWKCRTIALQPDPTEEMRILCIVNAREKFNPPLPRGYYGNGFAFPVAVATAEELSKNPFGYALELVRKAKADVTEEYMRSVSSLMVIKGRPHFTVVRAYLVSDLRRAGFEEVDFGWGNAIYGGAAKGGVGAIPGVASFYIPFTNKKGENGVVVPFCLPAPAMERFVKELDGMLKDDQTVSAQTKSKFIVSSL,brenda,A0A0B4VSM7,OCc1cccc(O)c1,0.067,30.0,7.0,2.3.1.196,3694.0,-1.1739251972991736,-1.1739251972991736,OCc1cccc(O)c1__MASSPASLLFKVHRREPELIKPAKPTPHEFKLLSDIDDQEGLRFHIPVMQFYRNNPSMQGKDPVKIIREALAKTLVFYYPFAGRLREGPNRKLMVECTGEGILFIEADADVTLEQFGDALQPPFPCLEELLFDVPGSSGVLNCPLLLIQVTRLKCGGFLFALRLNHTMSDAVGLVQFMAAVGEMARGANAPSVPAVWERQVLNASDPPRVTCTHREYEEVADTKGTIIPLDDMAHRSFFFGPSEMSALRKFVPPHLSHCSTFEILTACLWKCRTIALQPDPTEEMRILCIVNAREKFNPPLPRGYYGNGFAFPVAVATAEELSKNPFGYALELVRKAKADVTEEYMRSVSSLMVIKGRPHFTVVRAYLVSDLRRAGFEEVDFGWGNAIYGGAAKGGVGAIPGVASFYIPFTNKKGENGVVVPFCLPAPAMERFVKELDGMLKDDQTVSAQTKSKFIVSSL,./data/raw/alphafold//AF-A0A0B4VSM7-F1-model_v4.pdb,3275,1272,2018,1913 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+3199,16392,16633,MNLPTAQEVQGLMARYIELVDVGDIEAIVQMYADDATVEDPFGQPPIHGREQIAAFYRQGLGGGKVRACLTGPVRASHNGCGAMPFRVEMVWNGQPCALDVIDVMRFDEHGRIQTMQAYWSEVNLSVREPQ,uniprot_search,P07445,C[C@]12CCC(=O)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12,0.0503,25.0,7.0,5.3.3.1,303.0,-1.298432014944073,-1.3001657346603412,C[C@]12CCC(=O)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12__MNLPTAQEVQGLMARYIELVDVGDIEAIVQMYADDATVEDPFGQPPIHGREQIAAFYRQGLGGGKVRACLTGPVRASHNGCGAMPFRVEMVWNGQPCALDVIDVMRFDEHGRIQTMQAYWSEVNLSVREPQ,./data/raw/alphafold//AF-P07445-F1-model_v4.pdb,679,4023,5418,5764 +3200,19263,19542,MGDTDLPCVTGVLLAAGAGKRLGRGPKALLPYRGRTLVEDAAETMLVGGCHEVVIVLGANAQAVCARANLEPYRIVVNHDWSSGMGSSYLAGDAAAHTKNHILVALVDQPGLSVTTVGRLLVSHRPGRISSAAYSSLDSPRVLRRGHPMVIDAGLRPAVASTVSGDAGARVFLRQKPWLVDLIDCSDESTGEDVDTVEQMYRLL,uniprot_search,Q93NF6,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.035,25.0,8.35,1.1.1.328,29320.0,-1.4559319556497243,-1.4559319556497243,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MGDTDLPCVTGVLLAAGAGKRLGRGPKALLPYRGRTLVEDAAETMLVGGCHEVVIVLGANAQAVCARANLEPYRIVVNHDWSSGMGSSYLAGDAAAHTKNHILVALVDQPGLSVTTVGRLLVSHRPGRISSAAYSSLDSPRVLRRGHPMVIDAGLRPAVASTVSGDAGARVFLRQKPWLVDLIDCSDESTGEDVDTVEQMYRLL,./data/raw/alphafold//AF-Q93NF6-F1-model_v4.pdb,4039,4842,6693,6661 +3201,9781,9932,MGFFADLFKVVYSTWRQYIYTTGALLTLTWKWFTEGNEYFVEHVYPEPECLKNWNHKFVQLKNIRMHYVEEGPADGDVLLMVHGFPEFWYSWRFQLEHFKHTHRCIAIDMRGYNTTDRPSGISDYNLTHLVEDIRQFIEILELKRVTLAAHDWGAIVCWRVAMLHSNLIDRLVICNVPHPFAFFEVYNMSKEQRNKSWYIYLFQSQYIPEIAMRSNKMKMLEAMFRGSKAGIRNSENFTDEDMLAWKHVFSQPGGTTGPLNYYRDLFNAPAIPRKLQIVQPKVLILWGDEDAFLDKKGAELSVQFCRDCRVQMIRGASHWVQQDQPQLVNVYMEQFMNEDSYRPIGEIKTFKSHL,sabio,G5EDL5,CCCCCC=CCC1OC1CCCCCCCC(=O)O,0.0084,30.0,7.4,3.3.2.10,6239.0,-2.0757207139381184,-2.0757207139381184,CCCCCC=CCC1OC1CCCCCCCC(=O)O__MGFFADLFKVVYSTWRQYIYTTGALLTLTWKWFTEGNEYFVEHVYPEPECLKNWNHKFVQLKNIRMHYVEEGPADGDVLLMVHGFPEFWYSWRFQLEHFKHTHRCIAIDMRGYNTTDRPSGISDYNLTHLVEDIRQFIEILELKRVTLAAHDWGAIVCWRVAMLHSNLIDRLVICNVPHPFAFFEVYNMSKEQRNKSWYIYLFQSQYIPEIAMRSNKMKMLEAMFRGSKAGIRNSENFTDEDMLAWKHVFSQPGGTTGPLNYYRDLFNAPAIPRKLQIVQPKVLILWGDEDAFLDKKGAELSVQFCRDCRVQMIRGASHWVQQDQPQLVNVYMEQFMNEDSYRPIGEIKTFKSHL,./data/raw/alphafold//AF-G5EDL5-F1-model_v4.pdb,5488,3020,3741,4350 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+3203,27953,28432,MTTIDTLATCTQQNRDAVYTLLRRYFTANRTLLLQSDLREGLLQTEQDCGQSDMLRAFVFRLQEGIFSSPWAYLALRPEIAKWEFMRIHQEHLIPEKLTISEFLKFKETVVKGEATESVLEVDFGPFNRGFPRLKESRSIGQGVIFLNRKLSSEMFSRIEAGHTSLLHFLGVHAIEGQQLMFSNNSHDIHAVRNQLRQALEMLETLDGTTPWIELAPKMNQLGFAPGWGHNANRVAETMNMLMDILEAPSPSALEEFLACIPMISRLLILSPHGYFGQDNVLGLPDTGGQVVYILDQVRALEKEMHDRLQLQGVQVEPKILIVTRLIPDAGDTTCNQRLEKVSGCTNTWILRVPFRKHNGEIIPHWISRFEIWPHLEIFAGDVEREALAELGGHPDLIIGNYSDGNLVATLLSRRLGVTQCNIAHALEKTKYLHSDIYWQENEDKYHFSCQYTADLLAMNSADFIVTSTYQEIAGTREAEGQYESYQAFSMPDLYRVIHGIDLFDPKFNIVSPGANADIYFPYSDPNRRLHSLIPEIESLIFDDATNLPARGYLQDPDKPLIFTMARLDRIKNITGLVELYAASPRLRSLANLVIVGGKIDPQHSSDHEEQEQIHRMHQLMDEHELDQQVRWLGMRLDKNLAGELYRYIADKRGIFVQPALFEAFGLTIIEAMASGLPTFATRYGGPLEIIQNNRSGFHIDPNQGAATADLIADFFEKNLENPQEWERISQGALDRVASRYTWKLYAERMMTLSRIYGFWKFVSGLEREETDRYLNMFYHLQFRPLANRLAHEI,brenda,Q820M5,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.44,60.0,7.0,2.4.1.13,915.0,-0.3565473235138126,-0.3565473235138126,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MTTIDTLATCTQQNRDAVYTLLRRYFTANRTLLLQSDLREGLLQTEQDCGQSDMLRAFVFRLQEGIFSSPWAYLALRPEIAKWEFMRIHQEHLIPEKLTISEFLKFKETVVKGEATESVLEVDFGPFNRGFPRLKESRSIGQGVIFLNRKLSSEMFSRIEAGHTSLLHFLGVHAIEGQQLMFSNNSHDIHAVRNQLRQALEMLETLDGTTPWIELAPKMNQLGFAPGWGHNANRVAETMNMLMDILEAPSPSALEEFLACIPMISRLLILSPHGYFGQDNVLGLPDTGGQVVYILDQVRALEKEMHDRLQLQGVQVEPKILIVTRLIPDAGDTTCNQRLEKVSGCTNTWILRVPFRKHNGEIIPHWISRFEIWPHLEIFAGDVEREALAELGGHPDLIIGNYSDGNLVATLLSRRLGVTQCNIAHALEKTKYLHSDIYWQENEDKYHFSCQYTADLLAMNSADFIVTSTYQEIAGTREAEGQYESYQAFSMPDLYRVIHGIDLFDPKFNIVSPGANADIYFPYSDPNRRLHSLIPEIESLIFDDATNLPARGYLQDPDKPLIFTMARLDRIKNITGLVELYAASPRLRSLANLVIVGGKIDPQHSSDHEEQEQIHRMHQLMDEHELDQQVRWLGMRLDKNLAGELYRYIADKRGIFVQPALFEAFGLTIIEAMASGLPTFATRYGGPLEIIQNNRSGFHIDPNQGAATADLIADFFEKNLENPQEWERISQGALDRVASRYTWKLYAERMMTLSRIYGFWKFVSGLEREETDRYLNMFYHLQFRPLANRLAHEI,./data/raw/alphafold//AF-Q820M5-F1-model_v4.pdb,2543,6953,8801,7460 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+3316,35820,36447,MASTLFSRTFLAASHRLITPSLPQKIFNPATFLSRSLHSQLGSASTAYKSTTWARRAMASTGVETKAGYSTSSVSTSEPVVSVDWLHANLREPDLKILDASWYMPDEQRNPIQEYQVAHIPRALFFDLDGISDRKTSLPHMLPTEEAFAAGCSALGIDNKDEVVVYDGKGIFSAARVWWMFRVFGHEKVWVLDGGLPRWRASGYDVESSASGDAILKASAASEAIEKIYQGQTVSPITFQTKFQPHLVWTLDQVKNNMEDPTYQHIDARSKARFDGTAPEPRKGIRSGHIPGSKCIPFPQMFDSCNTLLPAEELKKRFDQEDISLDKPIMASCGTGVTACILAMGLHRLGKTDVPIYDGSWTEWATQPDLPIESVESSS,sabio,O64530,O=S(=O)(O)[S-],1.7,30.0,,2.8.1.1,3702.0,0.2304489213782739,0.0377734806962653,O=S(=O)(O)[S-]__MASTLFSRTFLAASHRLITPSLPQKIFNPATFLSRSLHSQLGSASTAYKSTTWARRAMASTGVETKAGYSTSSVSTSEPVVSVDWLHANLREPDLKILDASWYMPDEQRNPIQEYQVAHIPRALFFDLDGISDRKTSLPHMLPTEEAFAAGCSALGIDNKDEVVVYDGKGIFSAARVWWMFRVFGHEKVWVLDGGLPRWRASGYDVESSASGDAILKASAASEAIEKIYQGQTVSPITFQTKFQPHLVWTLDQVKNNMEDPTYQHIDARSKARFDGTAPEPRKGIRSGHIPGSKCIPFPQMFDSCNTLLPAEELKKRFDQEDISLDKPIMASCGTGVTACILAMGLHRLGKTDVPIYDGSWTEWATQPDLPIESVESSS,./data/raw/alphafold//AF-O64530-F1-model_v4.pdb,2352,7131,9016,9296 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+3318,10040,10193,MTFRNRLRLFAVSGLALFTVSASLPPAAASGAPEARHPSGGGLSATVRYTEYGIPHIVAKDYANLGFGTGWAQAADQVCTLADGFVTVRGERSKFFGPDAAPDFSLSSAAKNLSSDLYFRGVRDSGTVEKLLKVPAPAGPSRDAKESMRGFAAGYNAWLRQNRDRITDPACRGASWVRPVTALDVAVRGFALAVLGGQGRGIDGITAAQPPTAAPPAAGVTPKEAAAAAQRLLSTQNADMGSNAVAFRGSTTANGRGLLLGNPHYPWDGGRRFWQSQQTIPGELNVAGGSLLGSTTVSIGHNADVAWSHTVATGVTLNLHQLTLDPADPTVYLVDGKPQRMTQRTVAVPVKGAAPVTRTQWWTRYGPVVTSLGAALPLPWTASTAYALNDPNAVNLRSADTSLGFSKARSTAGIERALHRSQGLPWVNTIAADRSGNSFFSQSQVLPRITDELAARCSTPLGQATYPSAGLAVLDGSTSACALGSDRDAVQPGIFGPGRMPTLKNAPYVENSNDSAWLTNADRPLTGYERVFGTTATQRSIRTRGAIEDVAAMAERGRLRVTDLERQQLANRAPTGDLVAADVAKWCAALPGGTAVGSSGTPVDVSAACPVLRRWDRSVDSDSRGALLFDRFWRKAAAVPAAELWKVPFDAADPVRTPRGLNTAAPGVGKALADTVTELKAAGIALNAPLGEHQFVVRNGKRIPVGGGTESLGIWNKIEPVWNPAAGGYTEVSAGSSYIQAVGWDNSRCPVARTLLTYSQSSNPNSPHYSDQTRLFSGERWVTSRFCEKDIARSPQLKVVRVHERR,brenda,Q539C0,CCCCCCCC(O)=N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O,0.14,40.0,8.0,3.5.1.11,58340.0,-0.8538719643217619,-0.8538719643217619,CCCCCCCC(O)=N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O__MTFRNRLRLFAVSGLALFTVSASLPPAAASGAPEARHPSGGGLSATVRYTEYGIPHIVAKDYANLGFGTGWAQAADQVCTLADGFVTVRGERSKFFGPDAAPDFSLSSAAKNLSSDLYFRGVRDSGTVEKLLKVPAPAGPSRDAKESMRGFAAGYNAWLRQNRDRITDPACRGASWVRPVTALDVAVRGFALAVLGGQGRGIDGITAAQPPTAAPPAAGVTPKEAAAAAQRLLSTQNADMGSNAVAFRGSTTANGRGLLLGNPHYPWDGGRRFWQSQQTIPGELNVAGGSLLGSTTVSIGHNADVAWSHTVATGVTLNLHQLTLDPADPTVYLVDGKPQRMTQRTVAVPVKGAAPVTRTQWWTRYGPVVTSLGAALPLPWTASTAYALNDPNAVNLRSADTSLGFSKARSTAGIERALHRSQGLPWVNTIAADRSGNSFFSQSQVLPRITDELAARCSTPLGQATYPSAGLAVLDGSTSACALGSDRDAVQPGIFGPGRMPTLKNAPYVENSNDSAWLTNADRPLTGYERVFGTTATQRSIRTRGAIEDVAAMAERGRLRVTDLERQQLANRAPTGDLVAADVAKWCAALPGGTAVGSSGTPVDVSAACPVLRRWDRSVDSDSRGALLFDRFWRKAAAVPAAELWKVPFDAADPVRTPRGLNTAAPGVGKALADTVTELKAAGIALNAPLGEHQFVVRNGKRIPVGGGTESLGIWNKIEPVWNPAAGGYTEVSAGSSYIQAVGWDNSRCPVARTLLTYSQSSNPNSPHYSDQTRLFSGERWVTSRFCEKDIARSPQLKVVRVHERR,./data/raw/alphafold//AF-Q539C0-F1-model_v4.pdb,5830,2655,3311,3826 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+3338,22414,22762,MEEVVIAGMSGKLPESENLQEFWANLIGGVDMVTDDDRRWKAGLYGLPKRSGKLKDLSKFDASFFGVHPKQAHTMDPQLRLLLEVSYEAIVDGGINPASLRGTNTGVWVGVSGSEASEALSRDPETLLGYSMVGCQRAMMANRLSFFFDFKGPSIALDTACSSSLLALQNAYQAIRSGECPAAIVGGINLLLKPNTSVQFMKLGMLSPDGTCRSFDDSGNGYCRAEAVVAVLLTKKSLARRVYATILNAGTNTDGCKEQGVTFPSGEAQEQLIRSLYQPGGVAPESLEYIEAHGTGTKVGDPQELNGITRSLCAFRQSPLLIGSTKSNMGHPEPASGLAALTKVLLSLENGVWAPNLHFHNPNPEIPALLDGRLQVVDRPLPVRGGIVGINSFGFGGANVHVILQPNTQQAPAPAPHAALPHLLHASGRTMEAVQGLLEQGRQHSQDLAFVSMLNDIAATPTAAMPFRGYTVLGVEGHVQEVQQVPASQRPLWFICSGMGTQWRGMGLSLMRLDSFRESILRSDEALKPLGVKVSDLLLSTDEHTFDDIVHSFVSLTAIQIALIDLLTSMGLKPDGIIGHSLGEVACGYADGCLSQREAVLAAYWRGQCIKDANLPAGSMAAVGLSWEECKQRCPPGVVPACHNSEDTVTISGPQAAVNEFVEQLKQEGVFAKEVRTGGLAFHSYFMEGIAPTLLQALKKVIREPRPRSARWLSTSIPEAQWQSSLARTSSAEYNVNNLVSPVLFQEALWHVPEHAVVLEIAPHALLQAVLKRGVKPSCTIIPLMKRDHKDNLEFFLTNLGKVHLTGIDINPNALFPPVEFPVPRGTPLISPHIKWDHSQTWDIPVAEDFPNGSSSSSATVYNIDASSESSDHYLVDHCIDGRVLFPGTGYLYLVWKTLARSLSLSLEETPVVFENVTFHQATILPRTGTVPLEVRLLEASHAFEVSDSGNLIVSGKVYQWEDPDSKLFDHPEVPIPAESESVSRLTQGEVYKELRLRGYDYGPHFQGVYEATLEGEQGKLLWKDNWVTFMDTMLQISILGFSKQSLQLPTRVTAIYIDPATHLQKVYMLEGDTQVADVTTSRCLGVTVSGGVYISRLQTTATSRRQQEQLVPTLEKFVFTPHVEPECLSESAILQKELQLCKGLAKALQTKATQQGLKMTVPGLEDLPQHGLPRLLAAACQLQLNGNLQLELGEVLARERLLLPEDPLISGLLNSQALKACIDTALENLSTLKMKVVEVLAGEGHLYSHISALLNTQPMLQLEYTATDRHPQALKDVQTKLQQHDVAQGQWDPSGPAPTNLGALDLVVCNCALATLGDPALALDNMVAALKDGGFLLMHTVLKGHALGETLACLPSEVQPGPSFLSQEEWESLFSRKALHLVGLKKSFYGTALFLCRRLSPQDKPIFLPVEDTSFQWVDSLKSILATSSSQPVWLTAMNCPTSGVVGLVNCLRKEPGGHRIRCILLSNLSSTSHVPKLDPGSSELQKVLESDLVMNVYRDGAWGAFRHFQLEQDKPEEQTAHAFVNVLTRGDLASIRWVSSPLKHMQPPSSSGAQLCTVYYASLNFRDIMLATGKLSPDAIPGKWASRDCMLGMEFSGRDKCGRRVMGLVPAEGLATSVLLSPDFLWDVPSSWTLEEAASVPVVYTTAYYSLVVRGRIQHGETVLIHSGSGGVGQAAISIALSLGCRVFTTVGSAEKRAYLQARFPQLDDTSFANSRDTSFEQHVLLHTGGKGVDLVLNSLAEEKLQASVRCLAQHGRFLEIGKFDLSNNHPLGMAIFLKNVTFHGILLDALFEGANDSWREVAELLKAGIRDGVVKPLKCTVFPKAQVEDAFRYMAQGKHIGKVLVQVREEEPEAMLPGAQPTLISAISKTFCPEHKSYIITGGLGGFGLELARWLVLRGAQRLVLTSRSGIRTGYQAKHVREWRRQGIHVLVSTSNVSSLEGARALIAEATKLGPVGGVFNLAMVLRDAMLENQTPELFQDVNKPKYNGTLNLDRATREACPELDYFVAFSSVSCGRGNAGQSNYGFANSTMERICEQRRHDGLPGLAVQWGAIGDVGIILEAMGTNDTVVGGTLPQRISSCMEVLDLFLNQPHAVLSSFVLAEKKAVAHGDGEAQRDLVKAVAHILGIRDLAGINLDSSLADLGLDSLMGVEVRQILEREHDLVLPIREVRQLTLRKLQEMSSKAGSDTELAAPKSKNDTSLKQAQLNLSILLVNPEGPTLTRLNSVQSSERPLFLVHPIEGSITVFHSLAAKLSVPTYGLQCTQAAPLDSIPNLAAYYIDCIKQVQPEGPYRVAGYSFGACVAFEMCSQLQAQQGPAPAHNNLFLFDGSHTYVLAYTQSYRAKLTPGCEAEAEAEAICFFIKQFVDAEHSKVLEALLPLKSLEDRVAAAVDLITRSHQSLDRRDLSFAAVSFYYKLRAADQYKPKAKYHGNVILLRAKTGGTYGEDLGADYNLSQVCDGKVSVHIIEGDHRTLLEGRGLESIINIIHSSLAEPRVSVREG,sabio,P12785,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1,0.012,25.0,6.5,2.3.1.85,10116.0,-1.9208187539523751,-1.9208187539523751,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1__MEEVVIAGMSGKLPESENLQEFWANLIGGVDMVTDDDRRWKAGLYGLPKRSGKLKDLSKFDASFFGVHPKQAHTMDPQLRLLLEVSYEAIVDGGINPASLRGTNTGVWVGVSGSEASEALSRDPETLLGYSMVGCQRAMMANRLSFFFDFKGPSIALDTACSSSLLALQNAYQAIRSGECPAAIVGGINLLLKPNTSVQFMKLGMLSPDGTCRSFDDSGNGYCRAEAVVAVLLTKKSLARRVYATILNAGTNTDGCKEQGVTFPSGEAQEQLIRSLYQPGGVAPESLEYIEAHGTGTKVGDPQELNGITRSLCAFRQSPLLIGSTKSNMGHPEPASGLAALTKVLLSLENGVWAPNLHFHNPNPEIPALLDGRLQVVDRPLPVRGGIVGINSFGFGGANVHVILQPNTQQAPAPAPHAALPHLLHASGRTMEAVQGLLEQGRQHSQDLAFVSMLNDIAATPTAAMPFRGYTVLGVEGHVQEVQQVPASQRPLWFICSGMGTQWRGMGLSLMRLDSFRESILRSDEALKPLGVKVSDLLLSTDEHTFDDIVHSFVSLTAIQIALIDLLTSMGLKPDGIIGHSLGEVACGYADGCLSQREAVLAAYWRGQCIKDANLPAGSMAAVGLSWEECKQRCPPGVVPACHNSEDTVTISGPQAAVNEFVEQLKQEGVFAKEVRTGGLAFHSYFMEGIAPTLLQALKKVIREPRPRSARWLSTSIPEAQWQSSLARTSSAEYNVNNLVSPVLFQEALWHVPEHAVVLEIAPHALLQAVLKRGVKPSCTIIPLMKRDHKDNLEFFLTNLGKVHLTGIDINPNALFPPVEFPVPRGTPLISPHIKWDHSQTWDIPVAEDFPNGSSSSSATVYNIDASSESSDHYLVDHCIDGRVLFPGTGYLYLVWKTLARSLSLSLEETPVVFENVTFHQATILPRTGTVPLEVRLLEASHAFEVSDSGNLIVSGKVYQWEDPDSKLFDHPEVPIPAESESVSRLTQGEVYKELRLRGYDYGPHFQGVYEATLEGEQGKLLWKDNWVTFMDTMLQISILGFSKQSLQLPTRVTAIYIDPATHLQKVYMLEGDTQVADVTTSRCLGVTVSGGVYISRLQTTATSRRQQEQLVPTLEKFVFTPHVEPECLSESAILQKELQLCKGLAKALQTKATQQGLKMTVPGLEDLPQHGLPRLLAAACQLQLNGNLQLELGEVLARERLLLPEDPLISGLLNSQALKACIDTALENLSTLKMKVVEVLAGEGHLYSHISALLNTQPMLQLEYTATDRHPQALKDVQTKLQQHDVAQGQWDPSGPAPTNLGALDLVVCNCALATLGDPALALDNMVAALKDGGFLLMHTVLKGHALGETLACLPSEVQPGPSFLSQEEWESLFSRKALHLVGLKKSFYGTALFLCRRLSPQDKPIFLPVEDTSFQWVDSLKSILATSSSQPVWLTAMNCPTSGVVGLVNCLRKEPGGHRIRCILLSNLSSTSHVPKLDPGSSELQKVLESDLVMNVYRDGAWGAFRHFQLEQDKPEEQTAHAFVNVLTRGDLASIRWVSSPLKHMQPPSSSGAQLCTVYYASLNFRDIMLATGKLSPDAIPGKWASRDCMLGMEFSGRDKCGRRVMGLVPAEGLATSVLLSPDFLWDVPSSWTLEEAASVPVVYTTAYYSLVVRGRIQHGETVLIHSGSGGVGQAAISIALSLGCRVFTTVGSAEKRAYLQARFPQLDDTSFANSRDTSFEQHVLLHTGGKGVDLVLNSLAEEKLQASVRCLAQHGRFLEIGKFDLSNNHPLGMAIFLKNVTFHGILLDALFEGANDSWREVAELLKAGIRDGVVKPLKCTVFPKAQVEDAFRYMAQGKHIGKVLVQVREEEPEAMLPGAQPTLISAISKTFCPEHKSYIITGGLGGFGLELARWLVLRGAQRLVLTSRSGIRTGYQAKHVREWRRQGIHVLVSTSNVSSLEGARALIAEATKLGPVGGVFNLAMVLRDAMLENQTPELFQDVNKPKYNGTLNLDRATREACPELDYFVAFSSVSCGRGNAGQSNYGFANSTMERICEQRRHDGLPGLAVQWGAIGDVGIILEAMGTNDTVVGGTLPQRISSCMEVLDLFLNQPHAVLSSFVLAEKKAVAHGDGEAQRDLVKAVAHILGIRDLAGINLDSSLADLGLDSLMGVEVRQILEREHDLVLPIREVRQLTLRKLQEMSSKAGSDTELAAPKSKNDTSLKQAQLNLSILLVNPEGPTLTRLNSVQSSERPLFLVHPIEGSITVFHSLAAKLSVPTYGLQCTQAAPLDSIPNLAAYYIDCIKQVQPEGPYRVAGYSFGACVAFEMCSQLQAQQGPAPAHNNLFLFDGSHTYVLAYTQSYRAKLTPGCEAEAEAEAICFFIKQFVDAEHSKVLEALLPLKSLEDRVAAAVDLITRSHQSLDRRDLSFAAVSFYYKLRAADQYKPKAKYHGNVILLRAKTGGTYGEDLGADYNLSQVCDGKVSVHIIEGDHRTLLEGRGLESIINIIHSSLAEPRVSVREG,./data/raw/alphafold//AF-P12785-F1-model_v4.pdb,3460,274,1142,2045 +3339,25751,26172,MSRGHKKITVLGAGVAGLVAAHELEELGHEVEVLEGSDRLGGRVHTHRFGEGGSVPFVELGAMRIPTKHRHTIDYIGKLGLTPKLKEFKTLFSDDGAYHTTSAGFVRVRDAAKVLVDEFRLLMSGRDLREETILFGAWLTAVGDAIAPADFRAALRTDFTADLLEVVDRIDLDPFLVGAARDQFDLHAFFAAHPEVRTSCTGKLNRFVDDILDETSPRLLRLEGGMDQLVDALVERIRGDIRTGHEVSAIDVREDHVAVTVHNGHGVNTLRSDHVLCTIPFSVLRNLRLTGLSTDKLEIIHDVKYWSATKVAFRCREPFWERDGINGGASFGGGRIRQTYYPPVEGDPTRGAVLLASYTMGDDADVLGGMPEAQRHEVVLDEVGRMHPELHEPGMVVEAVSRAWGEDRWSNGAGVTRWGKDVAACEEERDRAARPEGRLYFAGEHCSSTTAWIDGAVESALAAVRAIEAGDGR,brenda,Q8KHS0,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,1.53,30.0,7.8,1.4.3.23,68170.0,0.1846914308175988,0.1846914308175988,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O__MSRGHKKITVLGAGVAGLVAAHELEELGHEVEVLEGSDRLGGRVHTHRFGEGGSVPFVELGAMRIPTKHRHTIDYIGKLGLTPKLKEFKTLFSDDGAYHTTSAGFVRVRDAAKVLVDEFRLLMSGRDLREETILFGAWLTAVGDAIAPADFRAALRTDFTADLLEVVDRIDLDPFLVGAARDQFDLHAFFAAHPEVRTSCTGKLNRFVDDILDETSPRLLRLEGGMDQLVDALVERIRGDIRTGHEVSAIDVREDHVAVTVHNGHGVNTLRSDHVLCTIPFSVLRNLRLTGLSTDKLEIIHDVKYWSATKVAFRCREPFWERDGINGGASFGGGRIRQTYYPPVEGDPTRGAVLLASYTMGDDADVLGGMPEAQRHEVVLDEVGRMHPELHEPGMVVEAVSRAWGEDRWSNGAGVTRWGKDVAACEEERDRAARPEGRLYFAGEHCSSTTAWIDGAVESALAAVRAIEAGDGR,./data/raw/alphafold//AF-Q8KHS0-F1-model_v4.pdb,3897,4633,6429,6337 +3340,27854,28333,MAPLGGAPRLVLLFSGKRKSGKDFVTEALQSRLGADVCAVLRLSGPLKEQYAQEHGLNFQRLLDTSTYKEAFRKDMIRWGEEKRQADPGFFCRKIVEGISQPIWLVSDTRRVSDIQWFREAYGAVTQTVRVVALEQSRQQRGWVFTPGVDDAESECGLDNFGDFDWVIENHGVEQRLEEQLENLIEFIRSRL,brenda,Q15126,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.047,30.0,7.0,2.7.4.2,9606.0,-1.3279021420642825,-1.3279021420642825,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MAPLGGAPRLVLLFSGKRKSGKDFVTEALQSRLGADVCAVLRLSGPLKEQYAQEHGLNFQRLLDTSTYKEAFRKDMIRWGEEKRQADPGFFCRKIVEGISQPIWLVSDTRRVSDIQWFREAYGAVTQTVRVVALEQSRQQRGWVFTPGVDDAESECGLDNFGDFDWVIENHGVEQRLEEQLENLIEFIRSRL,./data/raw/alphafold//AF-Q15126-F1-model_v4.pdb,5580,2345,2966,3430 +3341,34547,35154,MKLQGVIFDLDGVITDTAHLHFQAWQQIAAEIGISIDAQFNESLKGISRDESLRRILQHGGKEGDFNSQERAQLAYRKNLLYVHSLRELTVNAVLPGIRSLLADLRAQQISVGLASVSLNAPTILAALELREFFTFCADASQLKNSKPDPEIFLAACAGLGVPPQACIGIEDAQAGIDAINASGMRSVGIGAGLTGAQLLLPSTESLTWPRLSAFWQNV,sabio,P77366,O=P(O)(O)OC1OC(CO)C(O)C(O)C1O,0.018,30.0,,5.4.2.6,562.0,-1.744727494896694,-1.744727494896694,O=P(O)(O)OC1OC(CO)C(O)C(O)C1O__MKLQGVIFDLDGVITDTAHLHFQAWQQIAAEIGISIDAQFNESLKGISRDESLRRILQHGGKEGDFNSQERAQLAYRKNLLYVHSLRELTVNAVLPGIRSLLADLRAQQISVGLASVSLNAPTILAALELREFFTFCADASQLKNSKPDPEIFLAACAGLGVPPQACIGIEDAQAGIDAINASGMRSVGIGAGLTGAQLLLPSTESLTWPRLSAFWQNV,./data/raw/alphafold//AF-P77366-F1-model_v4.pdb,2183,7659,9431,10542 +3342,28628,29139,MTENIHKHRILILDFGSQYTQLVARRVRELGVYCELWAWDVTEAQIRDFNPSGIILSGGPESTTEENSPRAPQYVFEAGVPVFGVCYGMQTMAMQLGGHVEASNEREFGYAQVEVVNDSALVRGIEDALTADGKPLLDVWMSHGDKVTAIPSDFITVASTESCPFAIMANEEKRFYGVQFHPEVTHTRQGMRMLERFVRDICQCEALWTPAKIIDDAVARIREQVGDDKVILGLSGGVDSSVTAMLLHRAIGKNLTCVFVDNGLLRLNEAEQVLDMFGDHFGLNIVHVPAEDRFLSALAGENDPEAKRKIIGRVFVEVFDEEALKLEDVKWLAQGTIYPDVIESAASATGKAHVIKSHHNVGGLPKEMKMGLVEPLKELFKDEVRKIGLELGLPYDMLYRHPFPGPGLGVRVLGEVKKEYCDLLRRADAIFIEELRKADLYDKVSQAFTVFLPVRSVGVMGDGRKYDWVVSLRAVETIDFMTAHWAHLPYDFLGRVSNRIINEVNGISRVVYDISGKPPATIEWE,brenda,P04079,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.2,40.0,8.0,6.3.5.2,562.0,-0.6989700043360187,-0.808086030056018,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MTENIHKHRILILDFGSQYTQLVARRVRELGVYCELWAWDVTEAQIRDFNPSGIILSGGPESTTEENSPRAPQYVFEAGVPVFGVCYGMQTMAMQLGGHVEASNEREFGYAQVEVVNDSALVRGIEDALTADGKPLLDVWMSHGDKVTAIPSDFITVASTESCPFAIMANEEKRFYGVQFHPEVTHTRQGMRMLERFVRDICQCEALWTPAKIIDDAVARIREQVGDDKVILGLSGGVDSSVTAMLLHRAIGKNLTCVFVDNGLLRLNEAEQVLDMFGDHFGLNIVHVPAEDRFLSALAGENDPEAKRKIIGRVFVEVFDEEALKLEDVKWLAQGTIYPDVIESAASATGKAHVIKSHHNVGGLPKEMKMGLVEPLKELFKDEVRKIGLELGLPYDMLYRHPFPGPGLGVRVLGEVKKEYCDLLRRADAIFIEELRKADLYDKVSQAFTVFLPVRSVGVMGDGRKYDWVVSLRAVETIDFMTAHWAHLPYDFLGRVSNRIINEVNGISRVVYDISGKPPATIEWE,./data/raw/alphafold//AF-P04079-F1-model_v4.pdb,3915,4660,6460,6380 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+3355,30140,30669,MKRDKVQTLHGEIHIPGDKSISHRSVMFGALAAGTTTVKNFLPGADCLSTIDCFRKMGVHIEQSSSDVVIHGKGIDALKEPESLLDVGNSGTTIRLMLGILAGRPFYSAVAGDESIAKRPMKRVTEPLKKMGAKIDGRAGGEFTPLSVSGASLKGIDYVSPVASAQIKSAVLLAGLQAEGTTTVTEPHKSRDHTERMLSAFGVKLSEDQTSVSIAGGQKLTAADIFVPGDISSAAFFLAAGAMVPNSRIVLKNVGLNPTRTGIIDVLQNMGAKLEIKPSADSGAEPYGDLIIETSSLKAVEIGGDIIPRLIDEIPIIALLATQAEGTTVIKDAAELKVKETNRIDTVVSELRKLGAEIEPTADGMKVYGKQTLKGGAAVSSHGDHRIGMMLGIASCITEEPIEIEHTDAIHVSYPTFFEHLNKLSKKS,sabio,P20691,O=C(O)C1=CC(OP(=O)(O)O)C(O)C(O)C1,0.33,37.0,7.2,2.5.1.19,1423.0,-0.4814860601221125,-0.4814860601221125,O=C(O)C1=CC(OP(=O)(O)O)C(O)C(O)C1__MKRDKVQTLHGEIHIPGDKSISHRSVMFGALAAGTTTVKNFLPGADCLSTIDCFRKMGVHIEQSSSDVVIHGKGIDALKEPESLLDVGNSGTTIRLMLGILAGRPFYSAVAGDESIAKRPMKRVTEPLKKMGAKIDGRAGGEFTPLSVSGASLKGIDYVSPVASAQIKSAVLLAGLQAEGTTTVTEPHKSRDHTERMLSAFGVKLSEDQTSVSIAGGQKLTAADIFVPGDISSAAFFLAAGAMVPNSRIVLKNVGLNPTRTGIIDVLQNMGAKLEIKPSADSGAEPYGDLIIETSSLKAVEIGGDIIPRLIDEIPIIALLATQAEGTTVIKDAAELKVKETNRIDTVVSELRKLGAEIEPTADGMKVYGKQTLKGGAAVSSHGDHRIGMMLGIASCITEEPIEIEHTDAIHVSYPTFFEHLNKLSKKS,./data/raw/alphafold//AF-P20691-F1-model_v4.pdb,3147,466,537,649 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+3357,19234,19511,MDPKHQRAALNDGHSIPVLGLGTYAPDAVPKSEAGEATKIAIDVGYRHIDSSHAYQNEEEVGLAIRSKITDGTVKREDIFYTSKLWCTFFRPELVRTGLEQSLKKLQLDYVDLYLMHYPAAMKPGKELYPKDEQGKIMHDTVDICATWEAMEKCKDAGLAKSIGVSNFNHRQLEMILSKPGLKYKPVCNQVECHLYLNQSKLLDFCKSKDIVLVAYGALGSSRDPKWVDQSYPVLLEDPVICALAKKHKRSPALIALRYQLQRGVVVLAKSFIEKEIKENIQVFEFQLSSEDMKALDGLNKNLRYYPADL,brenda,G1T465,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.0043,25.0,7.4,1.1.1.239,9986.0,-2.3665315444204134,-2.3665315444204134,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MDPKHQRAALNDGHSIPVLGLGTYAPDAVPKSEAGEATKIAIDVGYRHIDSSHAYQNEEEVGLAIRSKITDGTVKREDIFYTSKLWCTFFRPELVRTGLEQSLKKLQLDYVDLYLMHYPAAMKPGKELYPKDEQGKIMHDTVDICATWEAMEKCKDAGLAKSIGVSNFNHRQLEMILSKPGLKYKPVCNQVECHLYLNQSKLLDFCKSKDIVLVAYGALGSSRDPKWVDQSYPVLLEDPVICALAKKHKRSPALIALRYQLQRGVVVLAKSFIEKEIKENIQVFEFQLSSEDMKALDGLNKNLRYYPADL,./data/raw/alphafold//AF-G1T465-F1-model_v4.pdb,2022,202,1007,1238 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+3360,6868,6999,MKPLLKENSLIQVKHILKAHQNVKDVVIHTPLQRNDRLSERYECNIYLKREDLQVVRSFKLRGAYHKMKQLSSEQTENGVVCASAGNHAQGVAFSCKHLGIHGKIFMPSTTPRQKVSQVELFGKGFIDIILTGDTFDDVYKSAAECCEAESRTFIHPFDDPDVMAGQGTLAVEILNDIDTEPHFLFASVGGGGLLSGVGTYLKNVSPDTKVIAVEPAGAASYFESNKAGHVVTLDKIDKFVDGAAVKKIGEETFRTLETVVDDILLVPEGKVCTSILELYNECAVVAEPAGALSVAALDLYKDQIKGKNVVCVVSGGNNDIGRMQEMKERSLIFEGLQHYFIVNFPQRAGALREFLDEVLGPNDDITRFEYTKKNNKSNGPALVGIELQNKADYGPLIERMNKKPFHYVEVNKDEDLFHLLI,sabio,P37946,CC(O)C(N)C(=O)O,11.67,37.0,8.2,4.3.1.19,1423.0,1.06707085604537,0.885866872527736,CC(O)C(N)C(=O)O__MKPLLKENSLIQVKHILKAHQNVKDVVIHTPLQRNDRLSERYECNIYLKREDLQVVRSFKLRGAYHKMKQLSSEQTENGVVCASAGNHAQGVAFSCKHLGIHGKIFMPSTTPRQKVSQVELFGKGFIDIILTGDTFDDVYKSAAECCEAESRTFIHPFDDPDVMAGQGTLAVEILNDIDTEPHFLFASVGGGGLLSGVGTYLKNVSPDTKVIAVEPAGAASYFESNKAGHVVTLDKIDKFVDGAAVKKIGEETFRTLETVVDDILLVPEGKVCTSILELYNECAVVAEPAGALSVAALDLYKDQIKGKNVVCVVSGGNNDIGRMQEMKERSLIFEGLQHYFIVNFPQRAGALREFLDEVLGPNDDITRFEYTKKNNKSNGPALVGIELQNKADYGPLIERMNKKPFHYVEVNKDEDLFHLLI,./data/raw/alphafold//AF-P37946-F1-model_v4.pdb,5803,2612,3263,3760 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+3374,6330,6429,MRIIMPVEFSRIVRDVERLIAVEKYSLQGVVDGDKLLVVGFSEGSVNAYLYDGGETVKLNREPINSVLDPHYGVGRVILVRDVSKGAEQHALFKVNTSRPGEEQRLEAVKPMRILSGVDTGEAVVFTGATEDRVALYALDGGGLRELARLPGFGFVSDIRGDLIAGLGFFGGGRVSLFTSNLSSGGLRVFDSGEGSFSSASISPGMKVTAGLETAREARLVTVDPRDGSVEDLELPSKDFSSYRPTAITWLGYLPDGRLAVVARREGRSAVFIDGERVEAPQGNHGRVVLWRGKLVTSHTSLSTPPRIVSLPSGEPLLEGGLPEDLRRSIAGSRLVWVESFDGSRVPTYVLESGRAPTPGPTVVLVHGGPFAEDSDSWDTFAASLAAAGFHVVMPNYRGSTGYGEEWRLKIIGDPCGGELEDVSAAARWARESGLASELYIMGYSYGGYMTLCALTMKPGLFKAGVAGASVVDWEEMYELSDAAFRNFIEQLTGGSREIMRSRSPINHVDRIKEPLALIHPQNDSRTPLKPLLRLMGELLARGKTFEAHIIPDAGHAINTMEDAVKILLPAVFFLATQRERR,brenda,Q9YBQ2,CC(O)=N[C@@H](Cc1ccccc1)C(O)=Nc1ccc2ccccc2c1,0.0082,84.5,7.5,3.4.19.1,272557.0,-2.086186147616284,-2.1398519546814314,CC(O)=N[C@@H](Cc1ccccc1)C(O)=Nc1ccc2ccccc2c1__MRIIMPVEFSRIVRDVERLIAVEKYSLQGVVDGDKLLVVGFSEGSVNAYLYDGGETVKLNREPINSVLDPHYGVGRVILVRDVSKGAEQHALFKVNTSRPGEEQRLEAVKPMRILSGVDTGEAVVFTGATEDRVALYALDGGGLRELARLPGFGFVSDIRGDLIAGLGFFGGGRVSLFTSNLSSGGLRVFDSGEGSFSSASISPGMKVTAGLETAREARLVTVDPRDGSVEDLELPSKDFSSYRPTAITWLGYLPDGRLAVVARREGRSAVFIDGERVEAPQGNHGRVVLWRGKLVTSHTSLSTPPRIVSLPSGEPLLEGGLPEDLRRSIAGSRLVWVESFDGSRVPTYVLESGRAPTPGPTVVLVHGGPFAEDSDSWDTFAASLAAAGFHVVMPNYRGSTGYGEEWRLKIIGDPCGGELEDVSAAARWARESGLASELYIMGYSYGGYMTLCALTMKPGLFKAGVAGASVVDWEEMYELSDAAFRNFIEQLTGGSREIMRSRSPINHVDRIKEPLALIHPQNDSRTPLKPLLRLMGELLARGKTFEAHIIPDAGHAINTMEDAVKILLPAVFFLATQRERR,./data/raw/alphafold//AF-Q9YBQ2-F1-model_v4.pdb,5170,2058,1315,3076 +3375,14092,14295,TRRTAFLFDELSLWHSASQYALILPVGG,uniprot_search,P35902,COc1ccc2[nH]cc(CCN=C(C)O)c2c1,1.5,70.0,8.0,3.5.1.76,303.0,0.1760912590556812,0.1760912590556812,COc1ccc2[nH]cc(CCN=C(C)O)c2c1__TRRTAFLFDELSLWHSASQYALILPVGG,./data/raw/alphafold//AF-P35902-F1-model_v4.pdb,5617,2393,3016,3485 +3376,19677,19963,MGFLNGKTVIVTGGGRSVLSDGRCGSIGYGIVTAFAKEGANIVITGRNVKKLEDAKEEIERLYGVKVLPVRADVSAGGDNKAVVDEVIKQTIDTFGRIDVLVNNAQASASGVTLEDHTTEQFDLAIYSGLYATFYYMQACLPYLKETKGSVINFASGAGLFGNYGQCAYAAAKEGVRGLTRVAATEWGQFGINVNIICPLAWTAQLENFEKAYPEAFKENVKMPPAGHYGDAEKEIGRVCVQLASPDFKYMSGETITLEGGMGLRP,brenda,B6FYX7,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.04037,25.0,6.75,1.1.1.176,89152.0,-1.3939412505896855,-1.3939412505896855,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MGFLNGKTVIVTGGGRSVLSDGRCGSIGYGIVTAFAKEGANIVITGRNVKKLEDAKEEIERLYGVKVLPVRADVSAGGDNKAVVDEVIKQTIDTFGRIDVLVNNAQASASGVTLEDHTTEQFDLAIYSGLYATFYYMQACLPYLKETKGSVINFASGAGLFGNYGQCAYAAAKEGVRGLTRVAATEWGQFGINVNIICPLAWTAQLENFEKAYPEAFKENVKMPPAGHYGDAEKEIGRVCVQLASPDFKYMSGETITLEGGMGLRP,./data/raw/alphafold//AF-B6FYX7-F1-model_v4.pdb,570,3869,5239,5565 +3377,8544,8684,MTKQTIRVELTSTKKPKPDPNQLSFGRVFTDHMFVMDYAADKGWYDPRIIPYQPLSMDPAAMVYHYGQTVFEGLKAYVSEDDHVLLFRPEKNMERLNQSNDRLCIPQIDEEQVLEGLKQLVAIDKDWIPNAEGTSLYIRPFIIATEPFLGVAASHTYKLLIILSPVGSYYKEGIKPVKIAVESEFVRAVKGGTGNAKTAGNYASSLKAQQVAEEKGFSQVLWLDGIEKKYIEEVGSMNIFFKINGEIVTPMLNGSILEGITRNSVIALLKHWGLQVSERKIAIDEVIQAHKDGILEEAFGTGTAAVISPVGELIWQDETLSINNGETGEIAKKLYDTITGIQKGAVADEFGWTTEVAALTESK,sabio,P39576,CCC(C)C(N)C(=O)O,4.83,37.0,7.4,2.6.1.42,1423.0,0.6839471307515121,0.5041147930246024,CCC(C)C(N)C(=O)O__MTKQTIRVELTSTKKPKPDPNQLSFGRVFTDHMFVMDYAADKGWYDPRIIPYQPLSMDPAAMVYHYGQTVFEGLKAYVSEDDHVLLFRPEKNMERLNQSNDRLCIPQIDEEQVLEGLKQLVAIDKDWIPNAEGTSLYIRPFIIATEPFLGVAASHTYKLLIILSPVGSYYKEGIKPVKIAVESEFVRAVKGGTGNAKTAGNYASSLKAQQVAEEKGFSQVLWLDGIEKKYIEEVGSMNIFFKINGEIVTPMLNGSILEGITRNSVIALLKHWGLQVSERKIAIDEVIQAHKDGILEEAFGTGTAAVISPVGELIWQDETLSINNGETGEIAKKLYDTITGIQKGAVADEFGWTTEVAALTESK,./data/raw/alphafold//AF-P39576-F1-model_v4.pdb,5043,1890,2797,2821 +3378,25400,25808,MKNIPLILMGCGGVGRQLLQHIVSCRSLHFTQGLCLRVVGVGDSKSLVVTEDLLHEGLNDGFLLELCRVKSVGESLLKLLDFGKCQAFVHPESQGKILEIAFQLGKKTGLVFVDCSASSDTVAVLKQAIDMGCCAVMANKKPLTSTMEDFKKLFIYPRRIRHESTVGAGLPVIASLNRIISSGDPVHQIIGSLSGTLGYVMSEVEDGKPLSQVVRDAKSLGYTEPDPRDDLGGMDVARKALILARILGHQINLDSIQIESLYPKEMGPGVMTVEDFLNRGLLLLDKDIQDRVEKAASNGNVLRYVCVIMGSRCEVGIQELPKNSPLGRLRGSDNVLEIYTRCYSKQPLVIQGAGAGNDTTAAGVLADIVDIQDLFP,brenda,Q3S3F6,N[C@@H](CCO)C(=O)O,0.275,25.0,8.0,1.1.1.3,3847.0,-0.5606673061697374,0.3399409710564312,N[C@@H](CCO)C(=O)O__MKNIPLILMGCGGVGRQLLQHIVSCRSLHFTQGLCLRVVGVGDSKSLVVTEDLLHEGLNDGFLLELCRVKSVGESLLKLLDFGKCQAFVHPESQGKILEIAFQLGKKTGLVFVDCSASSDTVAVLKQAIDMGCCAVMANKKPLTSTMEDFKKLFIYPRRIRHESTVGAGLPVIASLNRIISSGDPVHQIIGSLSGTLGYVMSEVEDGKPLSQVVRDAKSLGYTEPDPRDDLGGMDVARKALILARILGHQINLDSIQIESLYPKEMGPGVMTVEDFLNRGLLLLDKDIQDRVEKAASNGNVLRYVCVIMGSRCEVGIQELPKNSPLGRLRGSDNVLEIYTRCYSKQPLVIQGAGAGNDTTAAGVLADIVDIQDLFP,./data/raw/alphafold//AF-Q3S3F6-F1-model_v4.pdb,4051,4863,6717,6685 +3379,8534,8674,MNKLIEREKTVYYKEKPDPSSLGFGQYFTDYMFVMDYEEGIGWHHPRIAPYAPLTLDPSSSVFHYGQAVFEGLKAYRTDDGRVLLFRPDQNIKRLNRSCERMSMPPLDEELVLEALTQLVELEKDWVPKEKGTSLYIRPFVIATEPSLGVKASRSYTFMIVLSPVGSYYGDDQLKPVRIYVEDEYVRAVNGGVGFAKTAGNYAASLQAQRKANELGYDQVLWLDAIEKKYVEEVGSMNIFFVINGEAVTPALSGSILSGVTRASAIELIRSWGIPVREERISIDEVYAASARGELTEVFGTGTAAVVTPVGELNIHGKTVIVGDGQIGDLSKKLYETITDIQLGKVKGPFNWTVEV,sabio,O31461,CCC(C)C(N)C(=O)O,3.15,37.0,7.4,2.6.1.42,1423.0,0.4983105537896005,0.4356112783798535,CCC(C)C(N)C(=O)O__MNKLIEREKTVYYKEKPDPSSLGFGQYFTDYMFVMDYEEGIGWHHPRIAPYAPLTLDPSSSVFHYGQAVFEGLKAYRTDDGRVLLFRPDQNIKRLNRSCERMSMPPLDEELVLEALTQLVELEKDWVPKEKGTSLYIRPFVIATEPSLGVKASRSYTFMIVLSPVGSYYGDDQLKPVRIYVEDEYVRAVNGGVGFAKTAGNYAASLQAQRKANELGYDQVLWLDAIEKKYVEEVGSMNIFFVINGEAVTPALSGSILSGVTRASAIELIRSWGIPVREERISIDEVYAASARGELTEVFGTGTAAVVTPVGELNIHGKTVIVGDGQIGDLSKKLYETITDIQLGKVKGPFNWTVEV,./data/raw/alphafold//AF-O31461-F1-model_v4.pdb,5043,1890,2791,2814 +3380,11894,12059,MLCVGRLGGLGARAAALPPRRAGRGSLEAGIRARRVSTSWSPVGAAFNVKPQGSRLDLFGERRGLFGVPELSAPEGFHIAQEKALRKTELLVDRACSTPPGPQTVLIFDELSDSLCRVADLADFVKIAHPEPAFREAAEEACRSIGTMVEKLNTNVDLYQSLQKLLADKKLVDSLDPETRRVAELFMFDFEISGIHLDKEKRKRAVDLNVKILDLSSTFLMGTNFPNKIEKHLLPEHIRRNFTSAGDHIIIDGLHAESPDDLVREAAYKIFLYPNAGQLKCLEELLSSRDLLAKLVGYSTFSHRALQGTIAKNPETVMQFLEKLSDKLSERTLKDFEMIRGMKMKLNPQNSEVMPWDPPYYSGVIRAERYNIEPSLYCPFFSLGACMEGLNILLNRLLGISLYAEQPAKGEVWSEDVRKLAVVHESEGLLGYIYCDFFQRADKPHQDCHFTIRGGRLKEDGDYQLPVVVLMLNLPRSSRSSPTLLTPSMMENLFHEMGHAMHSMLGRTRYQHVTGTRCPTDFAEVPSILMEYFANDYRVVNQFARHYQTGQPLPKNMVSRLCESKKVCAAADMQLQVFYATLDQIYHGKHPLRNSTTDILKETQEKFYGLPYVPNTAWQLRFSHLVGYGARYYSYLMSRAVASMVWKECFLQDPFNRAAGERYRREMLAHGGGREPMLMVEGMLQKCPSVDDFVSALVSDLDLDFETFLMDSE,uniprot_search,Q99797,CC[C@H](C)[C@H](N=C(O)[C@@H](N=C(O)c1ccccc1N)C(C)C)C(O)=N[C@@H](CO)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=N)O,0.0019,25.0,8.0,3.4.24.59,9606.0,-2.721246399047171,-2.721246399047171,CC[C@H](C)[C@H](N=C(O)[C@@H](N=C(O)c1ccccc1N)C(C)C)C(O)=N[C@@H](CO)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=N)O__MLCVGRLGGLGARAAALPPRRAGRGSLEAGIRARRVSTSWSPVGAAFNVKPQGSRLDLFGERRGLFGVPELSAPEGFHIAQEKALRKTELLVDRACSTPPGPQTVLIFDELSDSLCRVADLADFVKIAHPEPAFREAAEEACRSIGTMVEKLNTNVDLYQSLQKLLADKKLVDSLDPETRRVAELFMFDFEISGIHLDKEKRKRAVDLNVKILDLSSTFLMGTNFPNKIEKHLLPEHIRRNFTSAGDHIIIDGLHAESPDDLVREAAYKIFLYPNAGQLKCLEELLSSRDLLAKLVGYSTFSHRALQGTIAKNPETVMQFLEKLSDKLSERTLKDFEMIRGMKMKLNPQNSEVMPWDPPYYSGVIRAERYNIEPSLYCPFFSLGACMEGLNILLNRLLGISLYAEQPAKGEVWSEDVRKLAVVHESEGLLGYIYCDFFQRADKPHQDCHFTIRGGRLKEDGDYQLPVVVLMLNLPRSSRSSPTLLTPSMMENLFHEMGHAMHSMLGRTRYQHVTGTRCPTDFAEVPSILMEYFANDYRVVNQFARHYQTGQPLPKNMVSRLCESKKVCAAADMQLQVFYATLDQIYHGKHPLRNSTTDILKETQEKFYGLPYVPNTAWQLRFSHLVGYGARYYSYLMSRAVASMVWKECFLQDPFNRAAGERYRREMLAHGGGREPMLMVEGMLQKCPSVDDFVSALVSDLDLDFETFLMDSE,./data/raw/alphafold//AF-Q99797-F1-model_v4.pdb,5161,2049,1304,3065 +3381,16947,17192,MTTETTTATATAKIPAPATPYQEDIARYWNNEARPVNLRLGDVDGLYHHHYGIGPVDRAALGDPEHSEYEKKVIAELHRLESAQAEFLMDHLGQAGPDDTLVDAGCGRGGSMVMAHRRFGSRVEGVTLSAAQADFGNRRARELRIDDHVRSRVCNMLDTPFDKGAVTASWNNESTMYVDLHDLFSEHSRFLKVGGRYVTITGCWNPRYGQPSKWVSQINAHFECNIHSRREYLRAMADNRLVPHTIVDLTPDTLPYWELRATSSLVTGIEKAFIESYRDGSFQYVLIAADRV,sabio,Q9F1Y5,C[S+](CCC(N)C(=O)O)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O,0.0043,37.0,7.0,2.1.1.255,1902.0,-2.3665315444204134,-2.3665315444204134,C[S+](CCC(N)C(=O)O)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O__MTTETTTATATAKIPAPATPYQEDIARYWNNEARPVNLRLGDVDGLYHHHYGIGPVDRAALGDPEHSEYEKKVIAELHRLESAQAEFLMDHLGQAGPDDTLVDAGCGRGGSMVMAHRRFGSRVEGVTLSAAQADFGNRRARELRIDDHVRSRVCNMLDTPFDKGAVTASWNNESTMYVDLHDLFSEHSRFLKVGGRYVTITGCWNPRYGQPSKWVSQINAHFECNIHSRREYLRAMADNRLVPHTIVDLTPDTLPYWELRATSSLVTGIEKAFIESYRDGSFQYVLIAADRV,./data/raw/alphafold//AF-Q9F1Y5-F1-model_v4.pdb,4919,1667,2519,2504 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+3456,3088,3141,VGQAATGHCV,uniprot_search,Q7M0W1,CC(C)(C)C(=O)ONCCCC[C@H](N=C(O)Oc1ccccc1)C(O)=N[C@@H](Cc1ccccc1)C(=O)O,2.64,25.0,7.0,3.4.22.10,1306.0,0.421603926869831,0.421603926869831,CC(C)(C)C(=O)ONCCCC[C@H](N=C(O)Oc1ccccc1)C(O)=N[C@@H](Cc1ccccc1)C(=O)O__VGQAATGHCV,./data/raw/esmfold//ESMFold-Q7M0W1-v1.pdb,3772,1468,2267,2198 +3457,40861,41599,MKKTKIVCTIGPKTESEEMLAKMLDAGMNVMRLNFSHGDYAEHGQRIQNLRNVMSKTGKTAAILLDTKGPEIRTMKLEGGNDVSLKAGQTFTFTTDKSVIGNSEMVAVTYEGFTTDLSVGNTVLVDDGLIGMEVTAIEGNKVICKVLNNGDLGENKGVNLPGVSIALPALAEKDKQDLIFGCEQGVDFVAASFIRKRSDVIEIREHLKAHGGENIHIISKIENQEGLNNFDEILEASDGIMVARGDLGVEIPVEEVIFAQKMMIEKCIRARKVVITATQMLDSMIKNPRPTRAEAGDVANAILDGTDAVMLSGESAKGKYPLEAVSIMATICERTDRVMNSRLEFNNDNRKLRITEAVCRGAVETAEKLDAPLIVVATQGGKSARAVRKYFPDATILALTTNEKTAHQLVLSKGVVPQLVKEITSTDDFYRLGKELALQSGLAHKGDVVVMVSGALVPSGTTNTASVHVL,sabio,P0AD61,[Mg+2],0.4,,7.0,2.7.1.40,562.0,-0.3979400086720376,-0.3979400086720376,[Mg+2]__MKKTKIVCTIGPKTESEEMLAKMLDAGMNVMRLNFSHGDYAEHGQRIQNLRNVMSKTGKTAAILLDTKGPEIRTMKLEGGNDVSLKAGQTFTFTTDKSVIGNSEMVAVTYEGFTTDLSVGNTVLVDDGLIGMEVTAIEGNKVICKVLNNGDLGENKGVNLPGVSIALPALAEKDKQDLIFGCEQGVDFVAASFIRKRSDVIEIREHLKAHGGENIHIISKIENQEGLNNFDEILEASDGIMVARGDLGVEIPVEEVIFAQKMMIEKCIRARKVVITATQMLDSMIKNPRPTRAEAGDVANAILDGTDAVMLSGESAKGKYPLEAVSIMATICERTDRVMNSRLEFNNDNRKLRITEAVCRGAVETAEKLDAPLIVVATQGGKSARAVRKYFPDATILALTTNEKTAHQLVLSKGVVPQLVKEITSTDDFYRLGKELALQSGLAHKGDVVVMVSGALVPSGTTNTASVHVL,./data/raw/alphafold//AF-P0AD61-F1-model_v4.pdb,3167,464,534,646 +3458,804,827,MPESRLQRLANLKIGTPQQLRRTSIIGTIGPKTNSCEAITALRKAGLNIIRLNFSHGSYEFHQSVIENAVKSEQQFPGRPLAIALDTKGPEIRTGRTLNDQDLYIPVDHQMIFTTDASFANTSNDKIMYIDYANLTKVIVPGRFIYVDDGILSFKVLQIIDESNLRVQAVNSGYIASHKGVNLPNTDVDLPPLSAKDMKDLQFGVRNGIHIVFASFIRTSEDVLSIRKALGSEGQDIKIISKIENQQGLDNFDEILEVTDGVMIARGDLGIEILAPEVLAIQKKLIAKCNLAGKPVICATQMLDSMTHNPRPTRAEVSDVGNAVLDGADCVMLSGETAKGDYPVNAVNIMAATALIAESTIAHLALYDDLRDATPKPTSTTETVAAAATAAILEQDGKAIVVLSTTGNTARLLSKYRPSCPIILVTRHARTARIAHLYRGVFPFLYEPKRLDDWGEDVHRRLKFGVEMARSFGMVDNGDTVVSIQGFKGGVGHSNTLRISTVGQEF,sabio,P52489,C=C(OP(=O)(O)O)C(=O)O,0.4,30.0,7.0,2.7.1.40,4932.0,-0.3979400086720376,-0.2764209843288904,C=C(OP(=O)(O)O)C(=O)O__MPESRLQRLANLKIGTPQQLRRTSIIGTIGPKTNSCEAITALRKAGLNIIRLNFSHGSYEFHQSVIENAVKSEQQFPGRPLAIALDTKGPEIRTGRTLNDQDLYIPVDHQMIFTTDASFANTSNDKIMYIDYANLTKVIVPGRFIYVDDGILSFKVLQIIDESNLRVQAVNSGYIASHKGVNLPNTDVDLPPLSAKDMKDLQFGVRNGIHIVFASFIRTSEDVLSIRKALGSEGQDIKIISKIENQQGLDNFDEILEVTDGVMIARGDLGIEILAPEVLAIQKKLIAKCNLAGKPVICATQMLDSMTHNPRPTRAEVSDVGNAVLDGADCVMLSGETAKGDYPVNAVNIMAATALIAESTIAHLALYDDLRDATPKPTSTTETVAAAATAAILEQDGKAIVVLSTTGNTARLLSKYRPSCPIILVTRHARTARIAHLYRGVFPFLYEPKRLDDWGEDVHRRLKFGVEMARSFGMVDNGDTVVSIQGFKGGVGHSNTLRISTVGQEF,./data/raw/alphafold//AF-P52489-F1-model_v4.pdb,3167,498,553,667 +3459,39235,39934,MKQEKVQELVSQMTLDEKIAQCLQLSPFLFKGTNKNAELTGPLLQEMKLTDAHTENAGSVLGSSSALDMIGIQEAYLKTNRLGIPLVFMADVIHGYKTVFPIPLALGCSFDRETVRVMAEVSALEATADGHHVTFSPMLDLVRDPRWGRVMESTGEDPFLNSELGKAMVDGYQGDASKLNENLEQMAACVKHFAAYGAAEAGLEYNTVNMSTRELYQNYLPAYNAAIQAGAKLVMTAFNVVDGIPATMNKWLNRDVLRGEMEFDGVLISDWGAVAEVINHGTARNPKEAAQFSMEAGVDLEMMTTCYIHELKGLIEEGKLSENLLDEAVLRMLNLKNDLGLFEDPYRGLKNNDRTKDILTDESRGKARAAGVESAVLLENKSRLLPLAKEAKIALVGPLATSPDILGGWNVYGEEKDGINVETGLREVFETVEVVSTEYTELSEEDKVAVKAAVQNMDVVVLALGEKNEWGGEAGSLATIRLPEAQYQLAKFVQTLGKPVVITLFNGRPLEVKELAESSDALLELWFPGTEAGRVTADLLSGASNPSGKLSMSFPQTTGQIPVYYNHLRTGRPQTPENKGERYVSHYLDIPNEPFYPFGYGKSYSEFELKTSSLPKELNLGESLHVEVTIKNISDIAGKEVIQVYLQDVTASISRPVKELKAFEKVALQAGEEKTVTFELTSEAFSFYNHQLEKVQEPGLHRVFVGTSSEDVDVFEVEVGGYV,brenda,Q92AS9,OC[C@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3[C@H](O[C@H]4[C@H](O[C@H]5C(O)O[C@H](CO)[C@@H](O)[C@@H]5O)O[C@H](CO)[C@@H](O)[C@@H]4O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,11.0,20.0,6.0,3.2.1.21,272626.0,1.0413926851582251,1.0413926851582251,OC[C@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3[C@H](O[C@H]4[C@H](O[C@H]5C(O)O[C@H](CO)[C@@H](O)[C@@H]5O)O[C@H](CO)[C@@H](O)[C@@H]4O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O__MKQEKVQELVSQMTLDEKIAQCLQLSPFLFKGTNKNAELTGPLLQEMKLTDAHTENAGSVLGSSSALDMIGIQEAYLKTNRLGIPLVFMADVIHGYKTVFPIPLALGCSFDRETVRVMAEVSALEATADGHHVTFSPMLDLVRDPRWGRVMESTGEDPFLNSELGKAMVDGYQGDASKLNENLEQMAACVKHFAAYGAAEAGLEYNTVNMSTRELYQNYLPAYNAAIQAGAKLVMTAFNVVDGIPATMNKWLNRDVLRGEMEFDGVLISDWGAVAEVINHGTARNPKEAAQFSMEAGVDLEMMTTCYIHELKGLIEEGKLSENLLDEAVLRMLNLKNDLGLFEDPYRGLKNNDRTKDILTDESRGKARAAGVESAVLLENKSRLLPLAKEAKIALVGPLATSPDILGGWNVYGEEKDGINVETGLREVFETVEVVSTEYTELSEEDKVAVKAAVQNMDVVVLALGEKNEWGGEAGSLATIRLPEAQYQLAKFVQTLGKPVVITLFNGRPLEVKELAESSDALLELWFPGTEAGRVTADLLSGASNPSGKLSMSFPQTTGQIPVYYNHLRTGRPQTPENKGERYVSHYLDIPNEPFYPFGYGKSYSEFELKTSSLPKELNLGESLHVEVTIKNISDIAGKEVIQVYLQDVTASISRPVKELKAFEKVALQAGEEKTVTFELTSEAFSFYNHQLEKVQEPGLHRVFVGTSSEDVDVFEVEVGGYV,./data/raw/alphafold//AF-Q92AS9-F1-model_v4.pdb,2457,8066,9923,11101 +3460,24404,24791,VPTLQRDVAIVGAGPSGLAAATALRKAGLSVAVIEARDRVGGRTWTDTIDGAVLEIGGQWVSPDQTALISLLDELGLKTFERYREGESVYISSAGERTRYTGDSFPTNETTKKEMDRLIDEMDDLAAQIGAEEPWAHPLARDLDTVSFKQWLINQSDDAEARDNIGLFIAGGMLTKPAHSFSALQAVLMAASAGSFSHLVDEDFILDKRVIGGMQQVSIRMAEALGDDVFLNAPVRTVKWNESGATVLADGDIRVEASRVILAVPPNLYSRISYDPPLPRRQHQMHQHQSLGLVIKVHAVYETPFWREDGLSGTGFGASEVVQEVYDNTNHEDDRGTLVAFVSDEKADAMFELSAEERKATILASLARYLGPKAEEPVVYYESDWGSEEWTRGAYAASFDLGGLHRYGADSRTPVGPIHFSCSDIAAEGYQHVDGAVRMGQRTAADIIARSKA,brenda,B0F9F6,NCCCNCCCCNCCCN,0.47,25.0,8.0,1.4.3.10,1833.0,-0.3279021420642826,-0.3279021420642826,NCCCNCCCCNCCCN__VPTLQRDVAIVGAGPSGLAAATALRKAGLSVAVIEARDRVGGRTWTDTIDGAVLEIGGQWVSPDQTALISLLDELGLKTFERYREGESVYISSAGERTRYTGDSFPTNETTKKEMDRLIDEMDDLAAQIGAEEPWAHPLARDLDTVSFKQWLINQSDDAEARDNIGLFIAGGMLTKPAHSFSALQAVLMAASAGSFSHLVDEDFILDKRVIGGMQQVSIRMAEALGDDVFLNAPVRTVKWNESGATVLADGDIRVEASRVILAVPPNLYSRISYDPPLPRRQHQMHQHQSLGLVIKVHAVYETPFWREDGLSGTGFGASEVVQEVYDNTNHEDDRGTLVAFVSDEKADAMFELSAEERKATILASLARYLGPKAEEPVVYYESDWGSEEWTRGAYAASFDLGGLHRYGADSRTPVGPIHFSCSDIAAEGYQHVDGAVRMGQRTAADIIARSKA,./data/raw/alphafold//AF-B0F9F6-F1-model_v4.pdb,4780,5979,7732,8718 +3461,8849,8996,MAKQLEKSSKIGNEDVFQKIANHEQIVFCNDPVSGLQAIIAIHDTTLGPALGGTRMYPYKNVDEALEDVLRLSEGMTYKCAAADIDFGGGKAVIIGDPEKDKSPALFRAFGQFVESLNGRFYTGTDMGTTMDDFVHAQKETNFINGIPEQYGGSGDSSIPTAQGVIYALKATNQYLFGSDSLSGKTYAIQGLGKVGYKVAEQLLKAGADLFVTDIHENVLNSIKQKSEELGGSVTIVKSDDIYSVQADIFVPCAMGGIINDKTIPKLKVKAVVGSANNQLKDLRHANVLNEKGILYAPDYIVNAGGLIQVADELYGPNKERVLLKTKEIYRSLLEIFNQAALDCITTVEAANRKCQKTIEGQQTRNSFFSRGRRPKWNIKE,uniprot_search,P23307,CCCC(=O)C(=O)[O-],52.0,50.0,10.2,1.4.1.20,1421.0,1.7160033436347992,1.7160033436347992,CCCC(=O)C(=O)[O-]__MAKQLEKSSKIGNEDVFQKIANHEQIVFCNDPVSGLQAIIAIHDTTLGPALGGTRMYPYKNVDEALEDVLRLSEGMTYKCAAADIDFGGGKAVIIGDPEKDKSPALFRAFGQFVESLNGRFYTGTDMGTTMDDFVHAQKETNFINGIPEQYGGSGDSSIPTAQGVIYALKATNQYLFGSDSLSGKTYAIQGLGKVGYKVAEQLLKAGADLFVTDIHENVLNSIKQKSEELGGSVTIVKSDDIYSVQADIFVPCAMGGIINDKTIPKLKVKAVVGSANNQLKDLRHANVLNEKGILYAPDYIVNAGGLIQVADELYGPNKERVLLKTKEIYRSLLEIFNQAALDCITTVEAANRKCQKTIEGQQTRNSFFSRGRRPKWNIKE,./data/raw/alphafold//AF-P23307-F1-model_v4.pdb,3769,2959,215,239 +3462,10375,10530,MIPYAAGVIVPLALTLLVRNAKKDKKRGVVVDDVGGEPGHTVRNHRFKDPVSSHWEDISTLPELFEISCKSHSDRFFLGTRRLIAREVETSEDGKVFEKLHLGDYEWKTFGETLEAVCSFASGLVQIGHKSEERVAIFADTREEWFIALQGCFRRNVTVVTIYSSLGEEALCHSLNETEVTTVICGNKELKKLMDISQQLETVKRVICMDDEFPSEASSTWTTTSLADVQKLGRESPVDPSFPLSADVAVIMYTSGSTGLPKGVMMTHGNVLATVSAVMTIVPDLGKRDTYMAYLPLAHILELAAESVMATIGSAIGYGSPLTLTDTSNKIKKGTKGDVTALKPTIMTAVPAILDRVRDGVRKKVDAKGGAAKKLFDFAYARRLSAINGSWFGAWGLEKLLWDVLVFGKIRAVLGGQLRYLLSGGAPLSGDTQRFINICVGAPIGQGYGLTETCAGGTFSEFDDTSVGRVGAPLPCSFVKLIDWPEGGYLISDKPMPRGEIVIGGSNITLGYFKNEEKTKEVYKVDEKGMRWFYTGDIGQFHPDGCLEIIDRKKDIVKLQHGEYVSLGKVEAALSISPYVENIMVHADPFYSYCVALVVAAQQTLEGWASKQGIEFTNFEELCAKEQPVKEVYASLVKAAKQSRLEKFEIPAKIKVLAAPWTPESGLVTAALKLKRDVIRKEFSEDLTKLYAS,brenda,Q9FNT6,CCCCCCCCCCCC(=O)O,0.1,30.0,8.5,6.2.1.3,3708.0,-1.0,-1.0,CCCCCCCCCCCC(=O)O__MIPYAAGVIVPLALTLLVRNAKKDKKRGVVVDDVGGEPGHTVRNHRFKDPVSSHWEDISTLPELFEISCKSHSDRFFLGTRRLIAREVETSEDGKVFEKLHLGDYEWKTFGETLEAVCSFASGLVQIGHKSEERVAIFADTREEWFIALQGCFRRNVTVVTIYSSLGEEALCHSLNETEVTTVICGNKELKKLMDISQQLETVKRVICMDDEFPSEASSTWTTTSLADVQKLGRESPVDPSFPLSADVAVIMYTSGSTGLPKGVMMTHGNVLATVSAVMTIVPDLGKRDTYMAYLPLAHILELAAESVMATIGSAIGYGSPLTLTDTSNKIKKGTKGDVTALKPTIMTAVPAILDRVRDGVRKKVDAKGGAAKKLFDFAYARRLSAINGSWFGAWGLEKLLWDVLVFGKIRAVLGGQLRYLLSGGAPLSGDTQRFINICVGAPIGQGYGLTETCAGGTFSEFDDTSVGRVGAPLPCSFVKLIDWPEGGYLISDKPMPRGEIVIGGSNITLGYFKNEEKTKEVYKVDEKGMRWFYTGDIGQFHPDGCLEIIDRKKDIVKLQHGEYVSLGKVEAALSISPYVENIMVHADPFYSYCVALVVAAQQTLEGWASKQGIEFTNFEELCAKEQPVKEVYASLVKAAKQSRLEKFEIPAKIKVLAAPWTPESGLVTAALKLKRDVIRKEFSEDLTKLYAS,./data/raw/alphafold//AF-Q9FNT6-F1-model_v4.pdb,5834,2660,3318,3834 +3463,16611,16852,MTGWSCLVTGAGGFLGQRIIRLLVKEKELKEIRVLDKAFGPELREEFSKLQNKTKLTVLEGDILDEPFLKRACQDVSVIIHTACIIDVFGVTHRESIMNVNVKGTQLLLEACVQASVPVFIYTSSIEVAGPNSYKEIIQNGHEEEPLENTWPAPYPHSKKLAEKAVLAANGWNLKNGGTLYTCALRPMYIYGEGSRFLSASINEALNNNGILSSVGKFSTVNPVYVGNVAWAHILALRALQDPKKAPSIRGQFYYISDDTPHQSYDNLNYTLSKEFGLRLDSRWSFPLSLMYWIGFLLEIVSFLLRPIYTYRPPFNRHIVTLSNSVFTFSYKKAQRDLAYKPLYSWEEAKQKTVEWVGSLVDRHKETLKSKTQ,brenda,P14060,C[C@]12CC[C@H](O)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12,0.0037,27.0,7.4,1.1.1.145,9606.0,-2.431798275933005,-2.431798275933005,C[C@]12CC[C@H](O)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12__MTGWSCLVTGAGGFLGQRIIRLLVKEKELKEIRVLDKAFGPELREEFSKLQNKTKLTVLEGDILDEPFLKRACQDVSVIIHTACIIDVFGVTHRESIMNVNVKGTQLLLEACVQASVPVFIYTSSIEVAGPNSYKEIIQNGHEEEPLENTWPAPYPHSKKLAEKAVLAANGWNLKNGGTLYTCALRPMYIYGEGSRFLSASINEALNNNGILSSVGKFSTVNPVYVGNVAWAHILALRALQDPKKAPSIRGQFYYISDDTPHQSYDNLNYTLSKEFGLRLDSRWSFPLSLMYWIGFLLEIVSFLLRPIYTYRPPFNRHIVTLSNSVFTFSYKKAQRDLAYKPLYSWEEAKQKTVEWVGSLVDRHKETLKSKTQ,./data/raw/alphafold//AF-P14060-F1-model_v4.pdb,3414,874,5428,3911 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+3479,38871,39559,MKIAIASDHAAFELKEKVKNYLLGKGIEVEDHGTYSEESVDYPDYAKKVVQSILSNEADFGILLCGTGLGMSIAANRYRGIRAALCLFPDMARLARSHNNANILVLPGRLIGAELAFWIVDTFLSTPFDGGRHERRIRKIDEV,brenda,Q9X0G9,OC[C@H]1OC(O)[C@H](O)[C@@H]1O,110.0,70.0,8.0,5.3.1.6,2336.0,2.041392685158225,2.041392685158225,OC[C@H]1OC(O)[C@H](O)[C@@H]1O__MKIAIASDHAAFELKEKVKNYLLGKGIEVEDHGTYSEESVDYPDYAKKVVQSILSNEADFGILLCGTGLGMSIAANRYRGIRAALCLFPDMARLARSHNNANILVLPGRLIGAELAFWIVDTFLSTPFDGGRHERRIRKIDEV,./data/raw/alphafold//AF-Q9X0G9-F1-model_v4.pdb,2260,7780,9581,10722 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+3518,23926,24309,MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFVGKNDGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEESAGKATITLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,sabio,Q83U23,NCC(O)=NC(Cc1ccccc1)C(=O)O,6.52,37.0,7.5,3.4.13.-,44688.0,0.8142475957319202,0.8142475957319202,NCC(O)=NC(Cc1ccccc1)C(=O)O__MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFVGKNDGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEESAGKATITLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,./data/raw/alphafold//AF-Q83U23-F1-model_v4.pdb,5060,1897,2799,2825 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+3522,15402,15622,QVIAITGSASGIGAA,uniprot_search,P80701,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C,0.069,37.0,8.5,1.1.1.50,306.0,-1.1611509092627446,-1.1611509092627446,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C__QVIAITGSASGIGAA,./data/raw/esmfold//ESMFold-P80701-v1.pdb,2995,201,221,247 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+3573,282,294,MDVLRTPDERFEGLADWSFAPHYTEVTDADGTALRIHHVDEGPKDQRPILLMHGEPSWAYLYRKVIAELVAKGHRVVAPDLVGFGRSDKPAKRTDYTYERHVAWMSAWLEQNDLKDIVLFCQDWGGLIGLRLVAAFPERFSAVVVSNTGLPIGVGKSEGFEAWLNFSQNTPELPVGFILNGGTARDLSDAERSAYDAPFPDESYKEGARIFPALVPITPEHASVEENKAAWAVLETFDKPFVTAFSDADPITRGGEAMFLARVPGTKNVAHTTLKGGHFVQEDSPVEIAALLDGLVAGLPQA,brenda,Q9A919,BrCCCBr,7.2,25.0,8.2,3.8.1.5,155892.0,0.8573324964312685,0.8573324964312685,BrCCCBr__MDVLRTPDERFEGLADWSFAPHYTEVTDADGTALRIHHVDEGPKDQRPILLMHGEPSWAYLYRKVIAELVAKGHRVVAPDLVGFGRSDKPAKRTDYTYERHVAWMSAWLEQNDLKDIVLFCQDWGGLIGLRLVAAFPERFSAVVVSNTGLPIGVGKSEGFEAWLNFSQNTPELPVGFILNGGTARDLSDAERSAYDAPFPDESYKEGARIFPALVPITPEHASVEENKAAWAVLETFDKPFVTAFSDADPITRGGEAMFLARVPGTKNVAHTTLKGGHFVQEDSPVEIAALLDGLVAGLPQA,./data/raw/alphafold//AF-Q9A919-F1-model_v4.pdb,2987,192,210,232 +3574,26448,26900,MRIERDLHMATGDGETSYTKNSRIQEKTMFQIKPVLEEATRAVYTALHPQTMVVADLGCSSGPNTLRFVSEVIGIIARHCKEYGRQHDHTQLQFFLNDLPGNDFNNLFQLIQQFNKSTAINHKSEAAEALPPPCYISGLPGSYYTRIFPSESVHLFHSLFCLQWRSEAPEGNKKTCLDIYITKTMSPSMVKLFQQQFQKDFSLFLRLRYEELVSGGQMVLTFIGRKHENVFTGESNHLYGLLAQSLKSLVDEGLVEKEKLESFYLPMYSPSVGEVEAILKQVGLFNMNHVKVFQTNWDPYDDLESDVVHNSIRSGENVAKCLRAVMQPLVASQFGEPILDKLFKEYARRVAKHLENEKTKHAIIVLSIEKAIHL,brenda,B6SU46,Nc1ccccc1C(=O)O,0.311,30.0,7.4,2.1.1.277,4577.0,-0.5072396109731625,-0.5072396109731625,Nc1ccccc1C(=O)O__MRIERDLHMATGDGETSYTKNSRIQEKTMFQIKPVLEEATRAVYTALHPQTMVVADLGCSSGPNTLRFVSEVIGIIARHCKEYGRQHDHTQLQFFLNDLPGNDFNNLFQLIQQFNKSTAINHKSEAAEALPPPCYISGLPGSYYTRIFPSESVHLFHSLFCLQWRSEAPEGNKKTCLDIYITKTMSPSMVKLFQQQFQKDFSLFLRLRYEELVSGGQMVLTFIGRKHENVFTGESNHLYGLLAQSLKSLVDEGLVEKEKLESFYLPMYSPSVGEVEAILKQVGLFNMNHVKVFQTNWDPYDDLESDVVHNSIRSGENVAKCLRAVMQPLVASQFGEPILDKLFKEYARRVAKHLENEKTKHAIIVLSIEKAIHL,./data/raw/alphafold//AF-B6SU46-F1-model_v4.pdb,5847,4152,5574,5965 +3575,9107,9255,MRNPGAQDNVSVSQGMRAMFYMMKPSETAFQTVEEVPDYVKKATPFFIFLILLELVVSWILKGKPSGRLDDILTSMSAGVVSRLPNLFFRSLEVTSYIYIWENYRVCELPWDSPWTWYLTFLGVDFGYYWFHRMAHEINIIWAAHQAHHSSEDYNLSTALRQSVLQQYSSWVFYCPLALFVPPSVFAVHIQFNLLYQFWIHTEVIRTLGPLELVLNTPSHHRVHHGRNRYCIDKNYAGTLIIWDRIFGTFEAENEQVIYGLTHPIGTFEPFKVQFHHLLYIWTTFWATPGFCHKFSVLFKGPGWGPGKPRLGLSEEIPEVTGQEVPFTSSASQFLKIYAVLQFAVMLVFYEETFANTAVLSQVTILLRICFIILTLTSIGFLLDQRPKAAIVETLRCLLFLTLYRFGHLKPLIESLSFAFEIFFSVCIAFWGVRSITHLASGSWKKP,uniprot_search,A0JPQ8,CCCC(CC)OCOC(O)CC,0.265,37.0,8.733333333333333,1.14.16.5,10116.0,-0.5767541260631921,-0.5767541260631921,CCCC(CC)OCOC(O)CC__MRNPGAQDNVSVSQGMRAMFYMMKPSETAFQTVEEVPDYVKKATPFFIFLILLELVVSWILKGKPSGRLDDILTSMSAGVVSRLPNLFFRSLEVTSYIYIWENYRVCELPWDSPWTWYLTFLGVDFGYYWFHRMAHEINIIWAAHQAHHSSEDYNLSTALRQSVLQQYSSWVFYCPLALFVPPSVFAVHIQFNLLYQFWIHTEVIRTLGPLELVLNTPSHHRVHHGRNRYCIDKNYAGTLIIWDRIFGTFEAENEQVIYGLTHPIGTFEPFKVQFHHLLYIWTTFWATPGFCHKFSVLFKGPGWGPGKPRLGLSEEIPEVTGQEVPFTSSASQFLKIYAVLQFAVMLVFYEETFANTAVLSQVTILLRICFIILTLTSIGFLLDQRPKAAIVETLRCLLFLTLYRFGHLKPLIESLSFAFEIFFSVCIAFWGVRSITHLASGSWKKP,./data/raw/alphafold//AF-A0JPQ8-F1-model_v4.pdb,637,3969,5356,4041 +3576,26367,26815,MIIQTPSRIHMGLIDLNGSIGRVDGGIGLALEEPNIKIEGKESDDISIEFDKKLIEKYGEDYIKSVRDRVYNTAIKVLDVIGGEGVDLKILSLFPAHSGLGSGTQLSLAVGKLISKIYNKEMNAYNIAKITGRGGTSGIGIGAFEYGGFLIDGGHSFGKGKDKEDFRPSSASKGVKPAPIIFRHDFDWETILIIPKGEHVYGKKEVDIFKKYCPVPLNEVEKICHLVLMKMMPAVVEKNLDDFGEVINKLQYLGFKKVELSLQSDIVKDLINELHKDVYAGLSSFGPTIYAFGDKKLIVEKANDIFDKYGVYGEIIITKANNVGHKIW,brenda,Q58822,Nc1ccc(C(=O)[O-])cc1,0.15,70.0,4.8,2.4.2.54,2190.0,-0.8239087409443188,-0.8239087409443188,Nc1ccc(C(=O)[O-])cc1__MIIQTPSRIHMGLIDLNGSIGRVDGGIGLALEEPNIKIEGKESDDISIEFDKKLIEKYGEDYIKSVRDRVYNTAIKVLDVIGGEGVDLKILSLFPAHSGLGSGTQLSLAVGKLISKIYNKEMNAYNIAKITGRGGTSGIGIGAFEYGGFLIDGGHSFGKGKDKEDFRPSSASKGVKPAPIIFRHDFDWETILIIPKGEHVYGKKEVDIFKKYCPVPLNEVEKICHLVLMKMMPAVVEKNLDDFGEVINKLQYLGFKKVELSLQSDIVKDLINELHKDVYAGLSSFGPTIYAFGDKKLIVEKANDIFDKYGVYGEIIITKANNVGHKIW,./data/raw/alphafold//AF-Q58822-F1-model_v4.pdb,1201,6390,8250,10247 +3577,38047,38720,MALRWGIVSVGLISSDFTAVLQTLPRSEHQVVAVAARDLSRAKEFAQKHDIPKAYGSYEELAKDPNVEVAYVGTQHPQHKAAVMLCLAAGKAVLCEKPMGVNAAEVREMVTEARSRGLFLMEAIWTRFFPASEALRSVLAQGTLGDLRVARAEFGKNLTHVPRAVDWAQAGGALLDLGIYCVQFISMVFGGQKPEKISVMGRRHETGVDDTVTVLLQYPGEVHGSFTCSITAQLSNTASVSGTKGMAQLLNPCWCPTELVVKGEHKEFLLPPVPKNCNFDNGAGMSYEAKHVRECLRKGLKESPVIPLVESELLADILEEVRRAIGVTFPQDKH,sabio,Q7JK39,OCC1OC(O)C(O)C1O,26.0,25.0,7.5,1.3.1.20,9542.0,1.414973347970818,1.414973347970818,OCC1OC(O)C(O)C1O__MALRWGIVSVGLISSDFTAVLQTLPRSEHQVVAVAARDLSRAKEFAQKHDIPKAYGSYEELAKDPNVEVAYVGTQHPQHKAAVMLCLAAGKAVLCEKPMGVNAAEVREMVTEARSRGLFLMEAIWTRFFPASEALRSVLAQGTLGDLRVARAEFGKNLTHVPRAVDWAQAGGALLDLGIYCVQFISMVFGGQKPEKISVMGRRHETGVDDTVTVLLQYPGEVHGSFTCSITAQLSNTASVSGTKGMAQLLNPCWCPTELVVKGEHKEFLLPPVPKNCNFDNGAGMSYEAKHVRECLRKGLKESPVIPLVESELLADILEEVRRAIGVTFPQDKH,./data/raw/alphafold//AF-Q7JK39-F1-model_v4.pdb,3396,839,3387,1325 +3578,14617,14828,MVGREKELSIHFVPGSCRLVEEEVNIPNRRVLVTGATGLLGRAVHKEFQQNNWHAVGCGFRRARPKFEQVNLLDSNAVHHIIHDFQPHVIVHCAAERRPDVVENQPDAASQLNVDASGNLAKEAAAVGAFLIYISSDYVFDGTNPPYREEDIPAPLNLYGKTKLDGEKAVLENNLGAAVLRIPILYGEVEKLEESAVTVMFDKVQFSNKSANMDHWQQRFPTHVKDVATVCRQLAEKRMLDPSIKGTFHWSGNEQMTKYEMACAIADAFNLPSSHLRPITDSPVLGAQRPRNAQLDCSKLETLGIGQRTPFRIGIKESLWPFLIDKRWRQTVFH,brenda,Q9NZL9,CSCC[C@H](N)C(=O)O,0.076,37.0,8.0,2.5.1.6,9606.0,-1.1191864077192086,-1.3883818634485012,CSCC[C@H](N)C(=O)O__MVGREKELSIHFVPGSCRLVEEEVNIPNRRVLVTGATGLLGRAVHKEFQQNNWHAVGCGFRRARPKFEQVNLLDSNAVHHIIHDFQPHVIVHCAAERRPDVVENQPDAASQLNVDASGNLAKEAAAVGAFLIYISSDYVFDGTNPPYREEDIPAPLNLYGKTKLDGEKAVLENNLGAAVLRIPILYGEVEKLEESAVTVMFDKVQFSNKSANMDHWQQRFPTHVKDVATVCRQLAEKRMLDPSIKGTFHWSGNEQMTKYEMACAIADAFNLPSSHLRPITDSPVLGAQRPRNAQLDCSKLETLGIGQRTPFRIGIKESLWPFLIDKRWRQTVFH,./data/raw/alphafold//AF-Q9NZL9-F1-model_v4.pdb,444,3682,5024,5342 +3579,21076,21394,MELFLAGRRVLVTGAGKGIGRGTVQALHATGARVVAVSRTQADLDSLVRECPGIEPVCVDLGDWEATERALGSVGPVDLLVNNAAVALLQPFLEVTKEAFDRSFEVNLRAVIQVSQIVARGLIARGVPGAIVNVSSQCSQRAVTNHSVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTSMGQATWSDPHKAKTMLNRIPLGKFAEVEHVVNAILFLLSDRSGMTTGSTLPVEGGFWAC,brenda,Q7Z4W1,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.001,25.0,7.0,1.1.1.10,9606.0,-3.0,-3.0,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MELFLAGRRVLVTGAGKGIGRGTVQALHATGARVVAVSRTQADLDSLVRECPGIEPVCVDLGDWEATERALGSVGPVDLLVNNAAVALLQPFLEVTKEAFDRSFEVNLRAVIQVSQIVARGLIARGVPGAIVNVSSQCSQRAVTNHSVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTSMGQATWSDPHKAKTMLNRIPLGKFAEVEHVVNAILFLLSDRSGMTTGSTLPVEGGFWAC,./data/raw/alphafold//AF-Q7Z4W1-F1-model_v4.pdb,3403,841,1006,1241 +3580,23827,24206,MTDLIQRPRRLRKSPALRAMFEETTLSLNDLVLPIFVEEEIDDYKAVEAMPGVMRIPEKHLAREIERIANAGIRSVMTFGISHHTDETGSDAWREDGLVARMSRICKQTVPEMIVMSDTCFCEYTSHGHCGVLCEHGVDNDATLENLGKQAVVAAAAGADFIAPSAAMDGQVQAIRQALDAAGFKDTAIMSYSTKFASSFYGPFREAAGSALKGDRKSYQMNPMNRREAIRESLLDEAQGADCLMVKPAGAYLDIVRELRERTELPIGAYQVSGEYAMIKFAALAGAIDEEKVVLESLGSIKRAGADLIFSYFALDLAEKKILR,sabio,P0ACB2,NCC(=O)CCC(=O)O,1.0,37.0,,4.2.1.24,562.0,0.0,-0.0484550065040281,NCC(=O)CCC(=O)O__MTDLIQRPRRLRKSPALRAMFEETTLSLNDLVLPIFVEEEIDDYKAVEAMPGVMRIPEKHLAREIERIANAGIRSVMTFGISHHTDETGSDAWREDGLVARMSRICKQTVPEMIVMSDTCFCEYTSHGHCGVLCEHGVDNDATLENLGKQAVVAAAAGADFIAPSAAMDGQVQAIRQALDAAGFKDTAIMSYSTKFASSFYGPFREAAGSALKGDRKSYQMNPMNRREAIRESLLDEAQGADCLMVKPAGAYLDIVRELRERTELPIGAYQVSGEYAMIKFAALAGAIDEEKVVLESLGSIKRAGADLIFSYFALDLAEKKILR,./data/raw/alphafold//AF-P0ACB2-F1-model_v4.pdb,4760,5952,7700,8680 +3581,10209,10364,MRIPLVGKEPIEAEDMGFTLIHEHLRVFSEAVRYQWPHLYNEDEELRNAVNEVKRAMQFGVKTIVDPTVMGLGRDIRFMEKVVKTTGINLVAGTGIYIYVDLPFYFLNRSIDEIADLFIHDIKEGIQATSNKAGFVKIAADEPGITKDVEKVIRAAAITHKEAKVPIITHSNAHNNTGLEEQRILMEEGVDPGKILIGHLGDTDNTDYIKKIADKGSFIGLDRYGLDLFLPVDKRNETTLKLIKDGYSDRIMISHDYCCTIDWGTARPELKPKLAPRWSMALIFEDTIPFLKKNGVSEEVIDIIFKENPKKFFS,brenda,C4KKZ9,CCCCCCCCC1CCC(=O)O1,0.48,25.0,8.3,3.1.1.25,43080.0,-0.3187587626244128,-0.3187587626244128,CCCCCCCCC1CCC(=O)O1__MRIPLVGKEPIEAEDMGFTLIHEHLRVFSEAVRYQWPHLYNEDEELRNAVNEVKRAMQFGVKTIVDPTVMGLGRDIRFMEKVVKTTGINLVAGTGIYIYVDLPFYFLNRSIDEIADLFIHDIKEGIQATSNKAGFVKIAADEPGITKDVEKVIRAAAITHKEAKVPIITHSNAHNNTGLEEQRILMEEGVDPGKILIGHLGDTDNTDYIKKIADKGSFIGLDRYGLDLFLPVDKRNETTLKLIKDGYSDRIMISHDYCCTIDWGTARPELKPKLAPRWSMALIFEDTIPFLKKNGVSEEVIDIIFKENPKKFFS,./data/raw/alphafold//AF-C4KKZ9-F1-model_v4.pdb,158,2916,3616,1850 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+3647,38410,39090,MPGQQATKHESLLDQLSLKGKVVVVTGASGPKGMGIEAARGCAEMGAAVAITYASRAQGAEENVKELEKTYGIKAKAYKCQVDSYESCEKLVKDVVADFGQIDAFIANAGATADSGILDGSVEAWNHVVQVDLNGTFHCAKAVGHHFKERGTGSLVITASMSGHIANFPQEQTSYNVAKAGCIHMARSLANEWRDFARVNSISPGYIDTGLSDFVPKETQQLWHSMIPMGRDGLAKELKGAYVYFASDASTYTTGADLLIDGGYTTR,brenda,P0C0Y5,OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,33.0,22.0,7.5,1.1.1.138,29918.0,1.5185139398778875,1.9401208879477403,OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO__MPGQQATKHESLLDQLSLKGKVVVVTGASGPKGMGIEAARGCAEMGAAVAITYASRAQGAEENVKELEKTYGIKAKAYKCQVDSYESCEKLVKDVVADFGQIDAFIANAGATADSGILDGSVEAWNHVVQVDLNGTFHCAKAVGHHFKERGTGSLVITASMSGHIANFPQEQTSYNVAKAGCIHMARSLANEWRDFARVNSISPGYIDTGLSDFVPKETQQLWHSMIPMGRDGLAKELKGAYVYFASDASTYTTGADLLIDGGYTTR,./data/raw/alphafold//AF-P0C0Y5-F1-model_v4.pdb,4065,5005,6887,6877 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+3673,40758,41495,MKLWVSALLMAWFGVLSCVQAEFFTSIGHMTDLIYAEKELVQSLKEYILVEEAKLSKIKSWANKMEALTSKSAADAEGYLAHPVNAYKLVKRLNTDWPALEDLVLQDSAAGFIANLSVQRQFFPTDEDEIGAAKALMRLQDTYRLDPGTISRGELPGTKYQAMLSVDDCFGMGRSAYNEGDYYHTVLWMEQVLKQLDAGEEATTTKSQVLDYLSYAVFQLGDLHRALELTRRLLSLDPSHERAGGNLRYFEQLLEEEREKTLTNQTEAELATPEGIYERPVDYLPERDVYESLCRGEGVKLTPRRQKRLFCRYHHGNRAPQLLIAPFKEEDEWDSPHIVRYYDVMSDEEIERIKEIAKPKLARATVRDPKTGVLTVASYRVSKSSWLEEDDDPVVARVNRRMQHITGLTVKTAELLQVANYGVGGQYEPHFDFSRNDERDTFKHLGTGNRVATFLNYMSDVEAGGATVFPDLGAAIWPKKGTAVFWYNLLRSGEGDYRTRHAACPVLVGCKWVSNKWFHERGQEFLRPCGSTEVD,brenda,O15460,[Fe+2],0.006,21.0,7.8,1.14.11.2,9606.0,-2.2218487496163566,-2.2218487496163566,[Fe+2]__MKLWVSALLMAWFGVLSCVQAEFFTSIGHMTDLIYAEKELVQSLKEYILVEEAKLSKIKSWANKMEALTSKSAADAEGYLAHPVNAYKLVKRLNTDWPALEDLVLQDSAAGFIANLSVQRQFFPTDEDEIGAAKALMRLQDTYRLDPGTISRGELPGTKYQAMLSVDDCFGMGRSAYNEGDYYHTVLWMEQVLKQLDAGEEATTTKSQVLDYLSYAVFQLGDLHRALELTRRLLSLDPSHERAGGNLRYFEQLLEEEREKTLTNQTEAELATPEGIYERPVDYLPERDVYESLCRGEGVKLTPRRQKRLFCRYHHGNRAPQLLIAPFKEEDEWDSPHIVRYYDVMSDEEIERIKEIAKPKLARATVRDPKTGVLTVASYRVSKSSWLEEDDDPVVARVNRRMQHITGLTVKTAELLQVANYGVGGQYEPHFDFSRNDERDTFKHLGTGNRVATFLNYMSDVEAGGATVFPDLGAAIWPKKGTAVFWYNLLRSGEGDYRTRHAACPVLVGCKWVSNKWFHERGQEFLRPCGSTEVD,./data/raw/alphafold//AF-O15460-F1-model_v4.pdb,2050,7594,1378,3150 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+3685,32965,33553,MAFMKKYLLPILGLFMAYYYYSANEEFRPEMLQGKKVIVTGASKGIGREMAYHLAKMGAHVVVTARSKETLQKVVSHCLELGAASAHYIAGTMEDMTFAEQFVAQAGKLMGGLDMLILNHITNTSLNLFHDDIHHVRKSMEVNFLSYVVLTVAALPMLKQSNGSIVVVSSLAGKVAYPMVAAYSASKFALDGFFSSIRKEYSVSRVNVSITLCVLGLIDTETAMKAVSGIVHMQAAPKEECALEIIKGGALRQEEVYYDSSLWTTLLIRNPCRKILEFLYSTSYNMDRFINK,uniprot_search,P28845,O=C1c2ccccc2-c2c1c1ccccc1c(=O)n2CCNCCO,0.042,24.0,7.966666666666666,1.1.1.146,9606.0,-1.3767507096020994,-1.3767507096020994,O=C1c2ccccc2-c2c1c1ccccc1c(=O)n2CCNCCO__MAFMKKYLLPILGLFMAYYYYSANEEFRPEMLQGKKVIVTGASKGIGREMAYHLAKMGAHVVVTARSKETLQKVVSHCLELGAASAHYIAGTMEDMTFAEQFVAQAGKLMGGLDMLILNHITNTSLNLFHDDIHHVRKSMEVNFLSYVVLTVAALPMLKQSNGSIVVVSSLAGKVAYPMVAAYSASKFALDGFFSSIRKEYSVSRVNVSITLCVLGLIDTETAMKAVSGIVHMQAAPKEECALEIIKGGALRQEEVYYDSSLWTTLLIRNPCRKILEFLYSTSYNMDRFINK,./data/raw/alphafold//AF-P28845-F1-model_v4.pdb,5105,1962,1587,2929 +3686,10125,10279,LGASRLGPSPGCLAVASAAKLGSVYTEGGFVEGVNKKLSLFGDSIDIFKGIPFAAAPKALEKPERHPGWQGTLKAKSFKKRCLQATLTQDSTYGNEDCLYLNIWVPQGRKEVSHDLPVMIWIYGGAFLMGASQGANFLSNYLYDGEEIATRGNVIVVTFNYRVGPLGFLSTGDSNLPGNYGLWDQHMAIAWVKRNIEAFGGDPDNITLFGESAGGASVSLQTLSPYNKGLIKRAISQSGVGLCPWAIQQDPLFWAKRIAEKVGCPVDDTSKMAGCLKITDPRALTLAYKLPLGSTEYPKLHYLSFVPVIDGDFIPDDPVNLYANAADVDYIAGTNDMDGHLFVGMDVPAINSNKQDVTEEDFYKLVSGLTVTKGLRGANATYEVYTEPWAQDSSQETRKKTMVDLETDILFLIPTKIAVAQHKSHAKSANTYTYLFSQPSRMPIYPKWMGADHADDLQYVFGKPFATPLGYRAQDRTVSKAMIAYWTNFARTGDPNTGHSTVPANWDPYTLEDDNYLEINKQMDSNSMKLHLRTNYLQFWTQTYQALPTVTSAGASLLPPEDNSQASPVPPADNSGAPTEPSAGDSEVAQMPVVIGF,uniprot_search,P30122,CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@H]3[C@@H]4CC[C@H]([C@H](C)CCCC(C)C)[C@@]4(C)CC[C@@H]32)C1,0.012,37.5,6.833333333333333,3.1.1.13,9913.0,-1.9208187539523751,-1.627930291398867,CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@H]3[C@@H]4CC[C@H]([C@H](C)CCCC(C)C)[C@@]4(C)CC[C@@H]32)C1__LGASRLGPSPGCLAVASAAKLGSVYTEGGFVEGVNKKLSLFGDSIDIFKGIPFAAAPKALEKPERHPGWQGTLKAKSFKKRCLQATLTQDSTYGNEDCLYLNIWVPQGRKEVSHDLPVMIWIYGGAFLMGASQGANFLSNYLYDGEEIATRGNVIVVTFNYRVGPLGFLSTGDSNLPGNYGLWDQHMAIAWVKRNIEAFGGDPDNITLFGESAGGASVSLQTLSPYNKGLIKRAISQSGVGLCPWAIQQDPLFWAKRIAEKVGCPVDDTSKMAGCLKITDPRALTLAYKLPLGSTEYPKLHYLSFVPVIDGDFIPDDPVNLYANAADVDYIAGTNDMDGHLFVGMDVPAINSNKQDVTEEDFYKLVSGLTVTKGLRGANATYEVYTEPWAQDSSQETRKKTMVDLETDILFLIPTKIAVAQHKSHAKSANTYTYLFSQPSRMPIYPKWMGADHADDLQYVFGKPFATPLGYRAQDRTVSKAMIAYWTNFARTGDPNTGHSTVPANWDPYTLEDDNYLEINKQMDSNSMKLHLRTNYLQFWTQTYQALPTVTSAGASLLPPEDNSQASPVPPADNSGAPTEPSAGDSEVAQMPVVIGF,./data/raw/alphafold//AF-P30122-F1-model_v4.pdb,165,2923,3624,4205 +3687,11461,11623,MKSAVYRGPGDVRIEEKPEPELQQPTDAVIRVTHTAICGSDLWFYRGHEEHEEGSGVGHEPMGIVEEVGEDVTSVQPGDRVLVPFAYSCGECEFCRKGIHTACVDGGFFGPHGDETGGAQAEKVRVLHADGTVVRVPERYADDEETLKSLLPLTDVMSTGHHAAVLADLEAGDTAVVIGDGAVGLCGVLAAKRIGAERIIAVGHHEDRLEVARELGATDTVSSRGQEAVEEVLELTHGGANHVLECVGAASALETAAQVARPGGSIGAVGVPHVESADFLQPIFYKNLSFSAGGAPVRNYIEELMDDVLQGTLDPSPILTKTVDLDGVPEGYQAMDDREAIKVMVKVDE,brenda,D4GP73,CCO,44.0,87.5,7.5,1.1.1.71,2246.0,1.6434526764861874,1.6434526764861874,CCO__MKSAVYRGPGDVRIEEKPEPELQQPTDAVIRVTHTAICGSDLWFYRGHEEHEEGSGVGHEPMGIVEEVGEDVTSVQPGDRVLVPFAYSCGECEFCRKGIHTACVDGGFFGPHGDETGGAQAEKVRVLHADGTVVRVPERYADDEETLKSLLPLTDVMSTGHHAAVLADLEAGDTAVVIGDGAVGLCGVLAAKRIGAERIIAVGHHEDRLEVARELGATDTVSSRGQEAVEEVLELTHGGANHVLECVGAASALETAAQVARPGGSIGAVGVPHVESADFLQPIFYKNLSFSAGGAPVRNYIEELMDDVLQGTLDPSPILTKTVDLDGVPEGYQAMDDREAIKVMVKVDE,./data/raw/alphafold//AF-D4GP73-F1-model_v4.pdb,111,2839,3522,4084 +3688,8491,8631,MELEKRLKEKLEAPTLDYEKYFSKKALGMKASEVRELLKLVESSDVISLAGGLPAPETFPVEIIAEITKEVLEKHAAQALQYGTTKGFTPLRLALAEWMRKRYDIPISKVDIMITSGSQQALDLIGRVFINPGDIVVVEAPTYLAALQAFKYYEPEFVQIPLDDEGMRVDLLEEKLQELEKEGKKVKLVYTIPTFQNPAGVTMSEKRRKRLLELASEYDFLIVEDNPYGELRYSGEPVKPIKAWDDEGRVMYLGTFSKILAPGFRIGWIAAEPHLIRKLEIAKQSVDLCTNPFSQVIAWKYVEGGHLDNHIPNIIEFYKPRRDAMLKALEEFMPEGVRWTKPEGGMFVWVTLPEGIDTKLMLEKAVAKGVAYVPGEAFFAHRDVKNTMRLNFTYVPEEKIREGIKRLAETIKEEMKK,brenda,A0A060PQX5,CCC(C)C(=O)C(=O)O,0.034,90.0,8.0,2.6.1.42,35749.0,-1.4685210829577449,-1.4685210829577449,CCC(C)C(=O)C(=O)O__MELEKRLKEKLEAPTLDYEKYFSKKALGMKASEVRELLKLVESSDVISLAGGLPAPETFPVEIIAEITKEVLEKHAAQALQYGTTKGFTPLRLALAEWMRKRYDIPISKVDIMITSGSQQALDLIGRVFINPGDIVVVEAPTYLAALQAFKYYEPEFVQIPLDDEGMRVDLLEEKLQELEKEGKKVKLVYTIPTFQNPAGVTMSEKRRKRLLELASEYDFLIVEDNPYGELRYSGEPVKPIKAWDDEGRVMYLGTFSKILAPGFRIGWIAAEPHLIRKLEIAKQSVDLCTNPFSQVIAWKYVEGGHLDNHIPNIIEFYKPRRDAMLKALEEFMPEGVRWTKPEGGMFVWVTLPEGIDTKLMLEKAVAKGVAYVPGEAFFAHRDVKNTMRLNFTYVPEEKIREGIKRLAETIKEEMKK,./data/raw/alphafold//AF-A0A060PQX5-F1-model_v4.pdb,5041,1866,2761,2777 +3689,7431,7562,MMQRRHFLQKTLLALPIIFSGNLLTGCKTNLSDDYLPDDKITNNPNLLQNKLKEILPIWENKFNAKIGMTIIADNGELSSHRGNEYFPVNSTIKAFIASHILLLVDKEKLDLNEKIIIKESDLIEYSPVCKKYFDENKPISISELCEATITLSDNGSANILLDKIGGLTAFNQFLKEIGADMVLANNEPLLNRSHYGETSDTAKPIPYTKSLKALIVGNILSNQSKEQLITWLINDKVADNLLRKYLPKNWRIGDKTGTGSESKNIIAVIWNENNKPYFISLFITQPHDGKSLGFKNQKDEIMAQIGKEIYPFL,sabio,Q49095,CC1(C)S[C@@H]2[C@H](N=CN3CCCCCC3)C(=O)N2[C@H]1C(=O)O,0.063,30.0,7.0,3.5.2.6,480.0,-1.2006594505464183,-1.2006594505464183,CC1(C)S[C@@H]2[C@H](N=CN3CCCCCC3)C(=O)N2[C@H]1C(=O)O__MMQRRHFLQKTLLALPIIFSGNLLTGCKTNLSDDYLPDDKITNNPNLLQNKLKEILPIWENKFNAKIGMTIIADNGELSSHRGNEYFPVNSTIKAFIASHILLLVDKEKLDLNEKIIIKESDLIEYSPVCKKYFDENKPISISELCEATITLSDNGSANILLDKIGGLTAFNQFLKEIGADMVLANNEPLLNRSHYGETSDTAKPIPYTKSLKALIVGNILSNQSKEQLITWLINDKVADNLLRKYLPKNWRIGDKTGTGSESKNIIAVIWNENNKPYFISLFITQPHDGKSLGFKNQKDEIMAQIGKEIYPFL,./data/raw/alphafold//AF-Q49095-F1-model_v4.pdb,3547,1144,1850,1695 +3690,31323,31880,MSQSKEDKIRSILEAKNIKSNFQNKENLSEFNEKKASKRAEDLLDVYYNTLSTADMEFPYWYNREYRKSDGDIPVVRRAKALKAAFSHMTPNIIPGEKIVMQKTRHYRGSFPMPWVSESFFVAQGEQMREEAKKLASNTADELTKFGSGGGNVTESFGNVVSIAGKFGMRKEEVPVLVKMAKEWVGKSVEDLGFHYEKMMPDYDLKENLMSTLICMFDSGYTLPQGREVINYFYPLNYGLDGIIEMAKECKKAVAGNASGDGLIGMDRLYFYEAVIQVIEGLQTWILNYAKHAKYLESIETDLEAKKEYSDLVEILEHIAHKQPRTFREALQLTYTIHIASVNEDAISGMSIGRFGQILYPWYEQDIEKGLITKEEVIELLELYRIKITCIDCFASAGVNGGVLSGNTFNTLSIGGLKEDGSTGANELEELLLEASMRCRTPQPSLTMLYDEKLPEDFLMKAAECTKLGSGYPAWVNNSNGTTFMMKQFADEGMTVEEARAFALGGCLETSPGCWKQLTLNGKTYSIAGGAGQSAGSGVHFIANPKILELVLMNGKDYRMNIQVFEPHNKPLDTYEEVIEVFKDYYKQAINVLERANNIELDIWRKFDTSIINSLLKPDCLDKGQHIGNMGYRYNATLNVETCGTVTMVNSFAALKKLVYDDKAFTIEEIKDAILNNFGFKDALEVGNYSMADQVKVDKTGKYDAIYKACLDAPKYGNNDLYADNILKNYEVWLSKVCEEAQSLYAKKMYPCQISVSTHGPQGAATLATPDGRLSGTTYSDGSVSAYAGTDKNGVYALFESATIWDQAVVQNSQMNLKLHPTTIKGQQGTKKLLDLTRSYLRKGGFHIQYNVVDSETLKDAQKNPDNYRQLMVRVAGFTQYWCELGKPIQDEVIARTEYEGV,sabio,Q84F16,O=C(O)Cc1ccc(O)c(O)c1,0.5,30.0,7.5,4.1.1.83,1496.0,-0.3010299956639812,-0.3010299956639812,O=C(O)Cc1ccc(O)c(O)c1__MSQSKEDKIRSILEAKNIKSNFQNKENLSEFNEKKASKRAEDLLDVYYNTLSTADMEFPYWYNREYRKSDGDIPVVRRAKALKAAFSHMTPNIIPGEKIVMQKTRHYRGSFPMPWVSESFFVAQGEQMREEAKKLASNTADELTKFGSGGGNVTESFGNVVSIAGKFGMRKEEVPVLVKMAKEWVGKSVEDLGFHYEKMMPDYDLKENLMSTLICMFDSGYTLPQGREVINYFYPLNYGLDGIIEMAKECKKAVAGNASGDGLIGMDRLYFYEAVIQVIEGLQTWILNYAKHAKYLESIETDLEAKKEYSDLVEILEHIAHKQPRTFREALQLTYTIHIASVNEDAISGMSIGRFGQILYPWYEQDIEKGLITKEEVIELLELYRIKITCIDCFASAGVNGGVLSGNTFNTLSIGGLKEDGSTGANELEELLLEASMRCRTPQPSLTMLYDEKLPEDFLMKAAECTKLGSGYPAWVNNSNGTTFMMKQFADEGMTVEEARAFALGGCLETSPGCWKQLTLNGKTYSIAGGAGQSAGSGVHFIANPKILELVLMNGKDYRMNIQVFEPHNKPLDTYEEVIEVFKDYYKQAINVLERANNIELDIWRKFDTSIINSLLKPDCLDKGQHIGNMGYRYNATLNVETCGTVTMVNSFAALKKLVYDDKAFTIEEIKDAILNNFGFKDALEVGNYSMADQVKVDKTGKYDAIYKACLDAPKYGNNDLYADNILKNYEVWLSKVCEEAQSLYAKKMYPCQISVSTHGPQGAATLATPDGRLSGTTYSDGSVSAYAGTDKNGVYALFESATIWDQAVVQNSQMNLKLHPTTIKGQQGTKKLLDLTRSYLRKGGFHIQYNVVDSETLKDAQKNPDNYRQLMVRVAGFTQYWCELGKPIQDEVIARTEYEGV,./data/raw/alphafold//AF-Q84F16-F1-model_v4.pdb,1872,7340,9295,9629 +3691,40108,40831,MSSRQPFVRLNDGHCIPALGFGTYKPIEVPKSKSLEAANLAIGVGYRHIDTAYAYQIEEEIGQAIQSNIKAGIVKREDMFITTKLWCTCFQPELVRPSLEKSLKKLQLEHVDLFIMHYPVPMKAGDNDFPLDEQGKLLLDTVDFCATWEALEKCKDAGLVKSIGVSNFNHRQLERILNKPGLKYKPVCNQVECHVYNNQSKLLDYCKSKDIVLVAFGALGTQRYKEWVDQDSPVLLNDPVLCGVAKKNKRSPALIALRYLVQRGVVPLAQSFYESEMKENLQVFEFQLSPEDMKILDGLNKNFRYLPAQFFADHPEYPFSEEY,brenda,A0A097ZMY7,O[C@@H]1C=CC=C[C@@H]1O,0.63,25.0,7.4,1.1.1.239,10036.0,-0.2006594505464183,-0.2006594505464183,O[C@@H]1C=CC=C[C@@H]1O__MSSRQPFVRLNDGHCIPALGFGTYKPIEVPKSKSLEAANLAIGVGYRHIDTAYAYQIEEEIGQAIQSNIKAGIVKREDMFITTKLWCTCFQPELVRPSLEKSLKKLQLEHVDLFIMHYPVPMKAGDNDFPLDEQGKLLLDTVDFCATWEALEKCKDAGLVKSIGVSNFNHRQLERILNKPGLKYKPVCNQVECHVYNNQSKLLDYCKSKDIVLVAFGALGTQRYKEWVDQDSPVLLNDPVLCGVAKKNKRSPALIALRYLVQRGVVPLAQSFYESEMKENLQVFEFQLSPEDMKILDGLNKNFRYLPAQFFADHPEYPFSEEY,./data/raw/alphafold//AF-A0A097ZMY7-F1-model_v4.pdb,2022,202,2530,2517 +3692,5736,5822,MEQLLRAELRTATLRAFGGPGAGCISEGRAYDTDAGPVFVKVNRRTQARQMFEGEVASLEALRSTGLVRVPRPMKVIDLPGGGAAFVMEHLKMKSLSSQASKLGEQMADLHLYNQKLREKLKEEENTVGRRGEGAEPQYVDKFGFHTVTCCGFIPQVNEWQDDWPTFFARHRLQAQLDLIEKDYADREARELWSRLQVKIPDLFCGLEIVPALLHGDLWSGNVAEDDVGPIIYDPASFYGHSEFELAIALMFGGFPRSFFTAYHRKIPKAPGFDQRLLLYQLFNYLNHWNHFGREYRSPSLGTMRRLLK,brenda,Q9H479,CC(C)[C@H](NC[C@@]1(O)O[C@H](CO)[C@@H](O)[C@@H]1O)C(=O)O,0.8,31.0,7.7,2.7.1.171,9606.0,-0.0969100130080563,-0.0969100130080563,CC(C)[C@H](NC[C@@]1(O)O[C@H](CO)[C@@H](O)[C@@H]1O)C(=O)O__MEQLLRAELRTATLRAFGGPGAGCISEGRAYDTDAGPVFVKVNRRTQARQMFEGEVASLEALRSTGLVRVPRPMKVIDLPGGGAAFVMEHLKMKSLSSQASKLGEQMADLHLYNQKLREKLKEEENTVGRRGEGAEPQYVDKFGFHTVTCCGFIPQVNEWQDDWPTFFARHRLQAQLDLIEKDYADREARELWSRLQVKIPDLFCGLEIVPALLHGDLWSGNVAEDDVGPIIYDPASFYGHSEFELAIALMFGGFPRSFFTAYHRKIPKAPGFDQRLLLYQLFNYLNHWNHFGREYRSPSLGTMRRLLK,./data/raw/alphafold//AF-Q9H479-F1-model_v4.pdb,1160,6342,8034,3202 +3693,30613,31153,MAGEKSTIIYTLTDEAPLLATYSLLPIIETFTKPAGIEIVKSDISVAARVLAEFADYLSEEQKVSDNLAELGRLTQDPDTNIIKLPNISASVAQLTACIKELQSKGYAIPDYPENPATEEEKTIKARYGKCLGSAVNPVLREGNSDRRAPAAVKNYAKKHPHSMSEWKQWSQTHVSHMEEGDFYHGEKSMTLDRPRNVKMELITNSGKSIVLKPKVALQEGEIIDSMFMSKKALCDFYEKQLDDCREAGILFSLHVKATMMKVSHPIVFGHCVKIYYKEAFEKHGKLFDELGINVNNGMAGLYEKIETLPTSLREEIIEDLHACQEHRPALAMVDSAKGITNFHSPNDIIVDASMPAMIRAGGKMWGADGKQYDAKAVMPESTFARIYQEMINFCKWHGNFDPKTMGTVPNVGLMAQKAEEYGSHDKTFEIPEAGIANITDLDTGEVLLTQNVEEGDIWRMCQVKDAPIRDWVKLAVTRARNSGMPAIFWLDPYRPHENELIKKVQKYLKDHDTTGLDIQIMSQVRAMRYTLERVVRGLDTISVTGNILRDYLTDLFPIMELGTSAKMLSIVPLMAGGGMYETGAGGSAPKHVQQLVEENHLRWDSLGEFLALAVSLEEMGIKENNARAKLLAKTLDEATGKLLDNDKSPSRRTGELDNRGSHFYLSLYWAEALAAQNEDAELKAKFAPLAKALAENEQKIVAELAQVQGKPADIGGYYAVDPAKVSAVMRPSATFNAALSTVQA,brenda,V5VCI0,O=C(O)CC(C(=O)O)C(O)C(=O)O,0.0505,25.0,8.0,1.1.1.42,470.0,-1.2967086218813386,-1.2405654367785357,O=C(O)CC(C(=O)O)C(O)C(=O)O__MAGEKSTIIYTLTDEAPLLATYSLLPIIETFTKPAGIEIVKSDISVAARVLAEFADYLSEEQKVSDNLAELGRLTQDPDTNIIKLPNISASVAQLTACIKELQSKGYAIPDYPENPATEEEKTIKARYGKCLGSAVNPVLREGNSDRRAPAAVKNYAKKHPHSMSEWKQWSQTHVSHMEEGDFYHGEKSMTLDRPRNVKMELITNSGKSIVLKPKVALQEGEIIDSMFMSKKALCDFYEKQLDDCREAGILFSLHVKATMMKVSHPIVFGHCVKIYYKEAFEKHGKLFDELGINVNNGMAGLYEKIETLPTSLREEIIEDLHACQEHRPALAMVDSAKGITNFHSPNDIIVDASMPAMIRAGGKMWGADGKQYDAKAVMPESTFARIYQEMINFCKWHGNFDPKTMGTVPNVGLMAQKAEEYGSHDKTFEIPEAGIANITDLDTGEVLLTQNVEEGDIWRMCQVKDAPIRDWVKLAVTRARNSGMPAIFWLDPYRPHENELIKKVQKYLKDHDTTGLDIQIMSQVRAMRYTLERVVRGLDTISVTGNILRDYLTDLFPIMELGTSAKMLSIVPLMAGGGMYETGAGGSAPKHVQQLVEENHLRWDSLGEFLALAVSLEEMGIKENNARAKLLAKTLDEATGKLLDNDKSPSRRTGELDNRGSHFYLSLYWAEALAAQNEDAELKAKFAPLAKALAENEQKIVAELAQVQGKPADIGGYYAVDPAKVSAVMRPSATFNAALSTVQA,./data/raw/alphafold//AF-V5VCI0-F1-model_v4.pdb,4317,5300,4336,7331 +3694,9892,10044,MLPRLICINDYEQHAKSVLPKSIYDYYRSGANDEETLADNIAAFSRWKLYPRMLRNVAETDLSTSVLGQRVSMPICVGATAMQRMAHVDGELATVRACQSLGTGMMLSSWATSSIEEVAEAGPEALRWLQLYIYKDREVTKKLVRQAEKMGYKAIFVTVDTPYLGNRLDDVRNRFKLPPQLRMKNFETSTLSFSPEENFGDDSGLAAYVAKAIDPSISWEDIKWLRRLTSLPIVAKGILRGDDAREAVKHGLNGILVSNHGARQLDGVPATIDVLPEIVEAVEGKVEVFLDGGVRKGTDVLKALALGAKAVFVGRPIVWGLAFQGEKGVQDVLEILKEEFRLAMALSGCQNVKVIDKTLVRKNPLAVSKI,brenda,Q9UJM8,CCCCCCC(=O)C(=O)O,0.04,37.0,7.0,1.1.3.15,9606.0,-1.3979400086720375,-1.3979400086720375,CCCCCCC(=O)C(=O)O__MLPRLICINDYEQHAKSVLPKSIYDYYRSGANDEETLADNIAAFSRWKLYPRMLRNVAETDLSTSVLGQRVSMPICVGATAMQRMAHVDGELATVRACQSLGTGMMLSSWATSSIEEVAEAGPEALRWLQLYIYKDREVTKKLVRQAEKMGYKAIFVTVDTPYLGNRLDDVRNRFKLPPQLRMKNFETSTLSFSPEENFGDDSGLAAYVAKAIDPSISWEDIKWLRRLTSLPIVAKGILRGDDAREAVKHGLNGILVSNHGARQLDGVPATIDVLPEIVEAVEGKVEVFLDGGVRKGTDVLKALALGAKAVFVGRPIVWGLAFQGEKGVQDVLEILKEEFRLAMALSGCQNVKVIDKTLVRKNPLAVSKI,./data/raw/alphafold//AF-Q9UJM8-F1-model_v4.pdb,1895,2599,3246,3737 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+69,15334,15552,MTYRSIGSTAYPTIGVVLLGGIANPVTRTPLHTSAGIAYSDSCGSIRSETRIYADEATHIYFNGTESTDDNRSVRRVLDRYSSVFEEAFGTKTVSYSSQNFGILSGSSDAGAASIGAAILGLKPDLDPHDVENDLRAVSESAGRSLFGGLTITWSDGFHAYTEKILDPEAFSGYSIVAFAFDYQRNPSDVIHQNIVRSDLYPARKKHADEHAHMIKEYAKTNDIKGIFDLAQEDTEEYHSILRGVGVNVIRENMQKLISYLKLIRKDYWNAYIVTGGSNVYVAVESENADRLFSIENTFGSKKKMLRIVGGAWHRRPE,brenda,Q9HIN1,C[C@@](O)(CCO)CC(=O)O,0.13,55.0,8.5,2.7.1.185,2303.0,-0.8860566476931633,-0.9496424567134591,C[C@@](O)(CCO)CC(=O)O__MTYRSIGSTAYPTIGVVLLGGIANPVTRTPLHTSAGIAYSDSCGSIRSETRIYADEATHIYFNGTESTDDNRSVRRVLDRYSSVFEEAFGTKTVSYSSQNFGILSGSSDAGAASIGAAILGLKPDLDPHDVENDLRAVSESAGRSLFGGLTITWSDGFHAYTEKILDPEAFSGYSIVAFAFDYQRNPSDVIHQNIVRSDLYPARKKHADEHAHMIKEYAKTNDIKGIFDLAQEDTEEYHSILRGVGVNVIRENMQKLISYLKLIRKDYWNAYIVTGGSNVYVAVESENADRLFSIENTFGSKKKMLRIVGGAWHRRPE,./data/raw/alphafold//AF-Q9HIN1-F1-model_v4.pdb,561,3855,5220,5544 +134,34628,35235,MFSVTRRRAAGAAAAMATATGTLYWMTSQGDRPLVHNDPSYMVQFPTAAPPQVSRRDLLDRLAKTHQFDVLIIGGGATGTGCALDAATRGLNVALVEKGDFASGTSSKSTKMIHGGVRYLEKAFWEFSKAQLDLVIEALNERKHLINTAPHLCTVLPILIPIYSTWQVPYIYMGCKFYDFFAGSQNLKKSYLLSKSATVEKAPMLTTDNLKASLVYHDGSFNDSRLNATLAITAVENGATVLNYVEVQKLIKDPTSGKVIGAEARDVETNELVRINAKCVVNATGPYSDAILQMDRNPSGLPDSPLNDNSKIKSTFNQIAVMDPKMVIPSIGVHIVLPSFYCPKDMGLLDVRTSDGRVMFFLPWQGKVLAGTTDIPLKQVPENPMPTEADIQDILKELQHYIEFPVKREDVLSAWAGVRPLVRDPRTIPADGKKGSATQGVVRSHFLFTSDNGLITIAGGKWTTYRQMAEETVDKVVEVGGFHNLKPCHTRDIKLAGAEEWTQNYVALLAQNYHLSSKMSNYLVQNYGTRSSIICEFFKESMENKLPLSLADKENNVIYSSEENNLVNFDTFRYPFTIGELKYSMQYEYCRTPLDFLLRRTRFAFLDAKEALNAVHATVKVMGDEFNWSEKKRQWELEKTVNFIKTFGV,sabio,P32191,O=P(O)(O)OCC(O)CO,23.0,,6.8,1.1.5.3,4932.0,1.3617278360175928,1.446603376529924,O=P(O)(O)OCC(O)CO__MFSVTRRRAAGAAAAMATATGTLYWMTSQGDRPLVHNDPSYMVQFPTAAPPQVSRRDLLDRLAKTHQFDVLIIGGGATGTGCALDAATRGLNVALVEKGDFASGTSSKSTKMIHGGVRYLEKAFWEFSKAQLDLVIEALNERKHLINTAPHLCTVLPILIPIYSTWQVPYIYMGCKFYDFFAGSQNLKKSYLLSKSATVEKAPMLTTDNLKASLVYHDGSFNDSRLNATLAITAVENGATVLNYVEVQKLIKDPTSGKVIGAEARDVETNELVRINAKCVVNATGPYSDAILQMDRNPSGLPDSPLNDNSKIKSTFNQIAVMDPKMVIPSIGVHIVLPSFYCPKDMGLLDVRTSDGRVMFFLPWQGKVLAGTTDIPLKQVPENPMPTEADIQDILKELQHYIEFPVKREDVLSAWAGVRPLVRDPRTIPADGKKGSATQGVVRSHFLFTSDNGLITIAGGKWTTYRQMAEETVDKVVEVGGFHNLKPCHTRDIKLAGAEEWTQNYVALLAQNYHLSSKMSNYLVQNYGTRSSIICEFFKESMENKLPLSLADKENNVIYSSEENNLVNFDTFRYPFTIGELKYSMQYEYCRTPLDFLLRRTRFAFLDAKEALNAVHATVKVMGDEFNWSEKKRQWELEKTVNFIKTFGV,./data/raw/alphafold//AF-P32191-F1-model_v4.pdb,2193,7675,9450,10566 +138,26894,27357,MNIVVLISGNGSNLQAIIDACKTNKIKGTVRAVFSNKADAFGLERARQAGIATHTLIASAFDSREAYDRELIHEIDMYAPDVVVLAGFMRILSPAFVSHYAGRLLNIHPSLLPKYPGLHTHRQALENGDEEHGTSVHFVTDELDGGPVILQAKVPVFAGDSEDDITARVQTQEHAIYPLVISWFADGRLKMHENAAWLDGQRLPPQGYAADE,sabio,P08179,Nc1nc2ncc(CN(C=O)c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1,0.6,26.0,,2.1.2.2,562.0,-0.2218487496163563,-0.2218487496163563,Nc1nc2ncc(CN(C=O)c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1__MNIVVLISGNGSNLQAIIDACKTNKIKGTVRAVFSNKADAFGLERARQAGIATHTLIASAFDSREAYDRELIHEIDMYAPDVVVLAGFMRILSPAFVSHYAGRLLNIHPSLLPKYPGLHTHRQALENGDEEHGTSVHFVTDELDGGPVILQAKVPVFAGDSEDDITARVQTQEHAIYPLVISWFADGRLKMHENAAWLDGQRLPPQGYAADE,./data/raw/alphafold//AF-P08179-F1-model_v4.pdb,1261,6468,8338,10349 +157,10393,10548,MQRPVELEVDGLVLRGMEH,sabio,Q7M0L6,CCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1,0.0043,70.0,7.1,3.1.1.1,405212.0,-2.3665315444204134,-2.4067223989288262,CCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1__MQRPVELEVDGLVLRGMEH,./data/raw/alphafold//AF-Q7M0L6-F1-model_v4.pdb,5437,3095,3826,4445 +168,26810,27270,MALVKEVLVVLNRLSPFELQESWDNSGLNVGSENSEFSEIVACLEITLKIALNAPQNALIITHHPLIFKPLKTLNDEIYPGNILKILIQKNVSVISMHTNFDKTHLNKHFAHALLEFDGLVEKGLMLVKENANIEFDALVKKIKSSLGVGSLACVKSSQTIKDLAFVCGSGASMFSSLKAQSCLITGDVKYHDAMIAQSLGISLIDATHYYSERGFALIVAEILHSFNYLVTIENFKNPLQII,sabio,O25613,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,0.04,30.0,4.0,3.5.4.16,210.0,-1.3979400086720375,-1.3979400086720375,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1__MALVKEVLVVLNRLSPFELQESWDNSGLNVGSENSEFSEIVACLEITLKIALNAPQNALIITHHPLIFKPLKTLNDEIYPGNILKILIQKNVSVISMHTNFDKTHLNKHFAHALLEFDGLVEKGLMLVKENANIEFDALVKKIKSSLGVGSLACVKSSQTIKDLAFVCGSGASMFSSLKAQSCLITGDVKYHDAMIAQSLGISLIDATHYYSERGFALIVAEILHSFNYLVTIENFKNPLQII,./data/raw/alphafold//AF-O25613-F1-model_v4.pdb,1243,6447,8316,10322 +175,10487,10642,MSGIQFDVSRLCAATISIQGRHFVDSHGRVLHLRGANVSAASKVPATPAPKIHDHAQASYVGRPFRLEEADEHWARLKSWGLTFVRITVTWEALEHKERGVYDEDYLAYLRALLQSMEPYGLVAYIALHQDVWSRYCGGSGAPGWTLEAAGFDLSNEGENLSLSGAAFLDGIKSGRLAGERGLWPTGYQKLAAATMNTLFWGGETFAPLLKVPGQIDGKWVSRNIQVYLQEAFLAATAKLVKAVGDLETVMGFELMNEPHPGFIGIQSIHEWDYTTDLHLGQFPSPLQSFSMGAGHPTPNVPVYTRSFPFPTRVTSHVTANPEGACAWASKECPWEKHGVWRWSEAKQEAAALQQDYFVKNRDGGKVDFYEDFYFPFVRKWEQVIGENISSTKGLKARMVEAIPNELCPEWKEESRPKNMVYAPHWYDLNTLFKKKFGFMSVNVQGLARGMFILRALYFGTAAAKANYALQIKTIVLAARLKLGPVPVIFGECGVPMDINNEEAFRTGDWKWQERSMDALISAMEGALMGFNLWTYNPANRDDIGDDWNAENFSWYSESNRTKLLKNAEKSSDGLDVGARLLNVIVRPYPIATAGNPTSLAYDANACAFTYRFRSPLRVSAAAPTPEEYTEIFLPRRVFRKESTEWTVTAGGKVHVDWERERVFVWFEDSSLTAASIKDDTRPRRIDIWVIGRKVEENWSIAQILVAVVILLLGVLVAYYAQLYEWEKDKMIFQHLREANGM,brenda,H1AE12,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)N=C(O)CCCCCNc1ccc([N+](=O)[O-])c2nonc12,0.0058,30.0,7.3,3.2.1.62,5207.0,-2.2365720064370627,-2.2365720064370627,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)N=C(O)CCCCCNc1ccc([N+](=O)[O-])c2nonc12__MSGIQFDVSRLCAATISIQGRHFVDSHGRVLHLRGANVSAASKVPATPAPKIHDHAQASYVGRPFRLEEADEHWARLKSWGLTFVRITVTWEALEHKERGVYDEDYLAYLRALLQSMEPYGLVAYIALHQDVWSRYCGGSGAPGWTLEAAGFDLSNEGENLSLSGAAFLDGIKSGRLAGERGLWPTGYQKLAAATMNTLFWGGETFAPLLKVPGQIDGKWVSRNIQVYLQEAFLAATAKLVKAVGDLETVMGFELMNEPHPGFIGIQSIHEWDYTTDLHLGQFPSPLQSFSMGAGHPTPNVPVYTRSFPFPTRVTSHVTANPEGACAWASKECPWEKHGVWRWSEAKQEAAALQQDYFVKNRDGGKVDFYEDFYFPFVRKWEQVIGENISSTKGLKARMVEAIPNELCPEWKEESRPKNMVYAPHWYDLNTLFKKKFGFMSVNVQGLARGMFILRALYFGTAAAKANYALQIKTIVLAARLKLGPVPVIFGECGVPMDINNEEAFRTGDWKWQERSMDALISAMEGALMGFNLWTYNPANRDDIGDDWNAENFSWYSESNRTKLLKNAEKSSDGLDVGARLLNVIVRPYPIATAGNPTSLAYDANACAFTYRFRSPLRVSAAAPTPEEYTEIFLPRRVFRKESTEWTVTAGGKVHVDWERERVFVWFEDSSLTAASIKDDTRPRRIDIWVIGRKVEENWSIAQILVAVVILLLGVLVAYYAQLYEWEKDKMIFQHLREANGM,./data/raw/alphafold//AF-H1AE12-F1-model_v4.pdb,5453,3111,3844,4472 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+729,10114,10268,MAKVMRLIIFVCVALVAISVPAASSVQSQQERIRPGFRQQLPSSIRPFSAFRRRGQEASDSVVYLNIVYLRLVGTRQCATGELTVVVHGKALNNATLGDVQTSLTRTFASSLKEPSSTLAIRRWSWKDPLFLMLTLNRRAVRTGTGLPRSTPLYQVAKQRLFVFVRKPTPTSSCRRAALDPRPLYGVPKVGVQDKYTLHVSMDVLGMSLREPLEHQEEEPGPASVSTYAAAQAILDGASSFGIGAFGSAKPNLKQISMYASGAELEKQVYTPTTSQLALFLPSKTFFGVEVTSVSDGTFRIPVSASRLVPFSAMSYMCTGSQTHKLTQTGMNVLEKRVHGKENPPSEGAEVLLNLLAARKPVNGVFEQDPTVVLLQLWRTPEGSESWQETPLMWEFPDTLEAIEDAGEYRSGILSSIAANTRIIGKMAGWLASRSFSRRFIRTLIRLNNIDLEEAFSMSDKDRRHSAADFRSVQEFFTRPINYHVYRDMDPRASIMAPADSLIQNIYTIRPDFKGEISHPIIPQVKSTSFNLREFLYGARQVPPLQLQSPSNRLFVSILYLAPSDYHRVHSPADWRVTSQTYIPGCTPSVSRRNLEAGDLLHRYERTALIGHWDPEKNGQQLFFSVTMVAAMFVGGLRLSWEEEPLGASMRLGRCTRYTESYEKQVDVELCASQEIGAFRFGSTVVMIFEAPEDFDMTSVGQCSHVAAGQPAGYLGQGRERPLQERCNAFRGNFESPFHFWKHLQKTSSVDDILKQNTLAPRAWRQEPGRVWAEVLRATERGLLYGFALSHYLLKRWATENGNLGELVLGQPEVLRQNINGSDSVIREGFRCFAAKDKKQIRLQMSGRQSQVSLTATVTPDEQFLFQHPFYGCVGDEKLGKLVRGIDATWILLPERAVLLTLKVSTGSKQEDGRVLRVATTKIEVQTEPCQGGWEESRVGTTSTTCAIRTVEKREESISEGVLTNGDL,sabio,F6N7K6,CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](N)C(=O)O)OC(=O)CCCCCCC/C=C\CCCCCCCC,0.067,37.0,6.8,4.1.1.65,5811.0,-1.1739251972991736,-1.1739251972991736,CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](N)C(=O)O)OC(=O)CCCCCCC/C=C\CCCCCCCC__MAKVMRLIIFVCVALVAISVPAASSVQSQQERIRPGFRQQLPSSIRPFSAFRRRGQEASDSVVYLNIVYLRLVGTRQCATGELTVVVHGKALNNATLGDVQTSLTRTFASSLKEPSSTLAIRRWSWKDPLFLMLTLNRRAVRTGTGLPRSTPLYQVAKQRLFVFVRKPTPTSSCRRAALDPRPLYGVPKVGVQDKYTLHVSMDVLGMSLREPLEHQEEEPGPASVSTYAAAQAILDGASSFGIGAFGSAKPNLKQISMYASGAELEKQVYTPTTSQLALFLPSKTFFGVEVTSVSDGTFRIPVSASRLVPFSAMSYMCTGSQTHKLTQTGMNVLEKRVHGKENPPSEGAEVLLNLLAARKPVNGVFEQDPTVVLLQLWRTPEGSESWQETPLMWEFPDTLEAIEDAGEYRSGILSSIAANTRIIGKMAGWLASRSFSRRFIRTLIRLNNIDLEEAFSMSDKDRRHSAADFRSVQEFFTRPINYHVYRDMDPRASIMAPADSLIQNIYTIRPDFKGEISHPIIPQVKSTSFNLREFLYGARQVPPLQLQSPSNRLFVSILYLAPSDYHRVHSPADWRVTSQTYIPGCTPSVSRRNLEAGDLLHRYERTALIGHWDPEKNGQQLFFSVTMVAAMFVGGLRLSWEEEPLGASMRLGRCTRYTESYEKQVDVELCASQEIGAFRFGSTVVMIFEAPEDFDMTSVGQCSHVAAGQPAGYLGQGRERPLQERCNAFRGNFESPFHFWKHLQKTSSVDDILKQNTLAPRAWRQEPGRVWAEVLRATERGLLYGFALSHYLLKRWATENGNLGELVLGQPEVLRQNINGSDSVIREGFRCFAAKDKKQIRLQMSGRQSQVSLTATVTPDEQFLFQHPFYGCVGDEKLGKLVRGIDATWILLPERAVLLTLKVSTGSKQEDGRVLRVATTKIEVQTEPCQGGWEESRVGTTSTTCAIRTVEKREESISEGVLTNGDL,./data/raw/alphafold//AF-F6N7K6-F1-model_v4.pdb,5525,3065,3791,4405 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+755,24715,25104,MFTSTGSSGLYKAPLSKSLLLVPSALSLLLTLLLPHCQKFFVYDLHAVKHDLQIWRLICGRIICLDLKDAFCSGLLIYNFRIFERRYGSRKFASFLLGSWVLSALFDFILVEAVQYSLGVTVASNLPSGFLAPVFALFVPFHCSIPRVQVAQILGPLSITNKTLIYILGLQLFTSGSYIWIVAMSGLISGMCYDRKVLQVHQVLRIPGRMAEFFSWALEPIFSSSEPTSEARVGMGATVDIQRQQRMEQLDRQLMLSQFAQVRRQRQQQGGMINWNRLFPPLRQRRNINYQDGPRSEQRASPPLEVSEEQVARLMEMGFSRGDALEALRASNNDLNVATNFLLQH,brenda,Q8R1K1,NC[C@@H](CC[C@H](N)C(=O)O)OP(=O)(O)O,0.0169,30.0,7.4,4.2.3.134,10090.0,-1.7721132953863266,-1.7721132953863266,NC[C@@H](CC[C@H](N)C(=O)O)OP(=O)(O)O__MFTSTGSSGLYKAPLSKSLLLVPSALSLLLTLLLPHCQKFFVYDLHAVKHDLQIWRLICGRIICLDLKDAFCSGLLIYNFRIFERRYGSRKFASFLLGSWVLSALFDFILVEAVQYSLGVTVASNLPSGFLAPVFALFVPFHCSIPRVQVAQILGPLSITNKTLIYILGLQLFTSGSYIWIVAMSGLISGMCYDRKVLQVHQVLRIPGRMAEFFSWALEPIFSSSEPTSEARVGMGATVDIQRQQRMEQLDRQLMLSQFAQVRRQRQQQGGMINWNRLFPPLRQRRNINYQDGPRSEQRASPPLEVSEEQVARLMEMGFSRGDALEALRASNNDLNVATNFLLQH,./data/raw/alphafold//AF-Q8R1K1-F1-model_v4.pdb,4833,6064,7843,10394 +774,20406,20714,MTRQMILAVGQQGPIARAETREQVVVRLLYMLTKAASRGANFIVFPELAFTTFFPRWHFTDEAELDSFYETEMPGPVVRPLFEKAAELGIGFNLGYAELVVEGGVKRRFNTSILVDKPGKIVGKYRKIHLPGHKEYEAYRPFQHLEKRYFEPGDLGFPVYDVDAAKMGMFICNDRRWPEAWRVMGLRGAEIICGGYNTPTHNPPVPQHDHLTSFHHLLSMQAGSYQNGAWSAAAGKVGMEENCMLLGHSCIVAPTGEIVALTTTLEDEVITAAVCLDRCRELREHIFNFKQHRQPQHYGLIAEL,brenda,Q5S260,N=C(O)N[C@@H](C(=O)O)c1ccc(O)cc1,3.76,40.0,7.0,3.5.1.77,106592.0,0.5751878449276611,0.5751878449276611,N=C(O)N[C@@H](C(=O)O)c1ccc(O)cc1__MTRQMILAVGQQGPIARAETREQVVVRLLYMLTKAASRGANFIVFPELAFTTFFPRWHFTDEAELDSFYETEMPGPVVRPLFEKAAELGIGFNLGYAELVVEGGVKRRFNTSILVDKPGKIVGKYRKIHLPGHKEYEAYRPFQHLEKRYFEPGDLGFPVYDVDAAKMGMFICNDRRWPEAWRVMGLRGAEIICGGYNTPTHNPPVPQHDHLTSFHHLLSMQAGSYQNGAWSAAAGKVGMEENCMLLGHSCIVAPTGEIVALTTTLEDEVITAAVCLDRCRELREHIFNFKQHRQPQHYGLIAEL,./data/raw/alphafold//AF-Q5S260-F1-model_v4.pdb,4222,5127,7034,7041 +785,13904,14105,GTSTVALIAVIISSILYLLFGGSGHKNLPPGPKPWPIVGNLLQLGEKPHAQFAELAQTYGDIFTLKMGTETVVVASTSSAASEILKTHDRILSARYVFQSFRVKGHVENSIVWSDCTETWKNLRKVCRTELFTQKMIESQAHVREKKCEEMVEYLMKKQGEEVKIVEVIFGTLVNIFGNLIFSQNIFELGDPNSGSSEFKEYLWRMLELGNSTNPADYFPMLGKFDLFGQRKEVAECLKGIYAIWGAMLQERKLAKKVDGYKSKNDFVDVCLDSGLNDYQINALLMELFGAGTETSASTIEWAMTELTKNPKITAKIRSEIQTVVGERSVKESDFPNLPYLEATVKETLRLHPPTPLLLPRRALETCTILNYTIPKDCQIMVNAWGIGRDPKTWTDPLTFSPERFLNSSVDFRGNDFSLIPFGAGRRICPGLPIANQFIALLVATFVQNLDWCLPNGMSVDHLIVEEKFGLTLQKEPPLFIVPKSRV,sabio,O64899,COc1cc2c(cc1O)C(Cc1ccc(O)cc1)N(C)CC2,0.015,37.0,8.0,1.14.14.102,3467.0,-1.8239087409443189,-1.8239087409443189,COc1cc2c(cc1O)C(Cc1ccc(O)cc1)N(C)CC2__GTSTVALIAVIISSILYLLFGGSGHKNLPPGPKPWPIVGNLLQLGEKPHAQFAELAQTYGDIFTLKMGTETVVVASTSSAASEILKTHDRILSARYVFQSFRVKGHVENSIVWSDCTETWKNLRKVCRTELFTQKMIESQAHVREKKCEEMVEYLMKKQGEEVKIVEVIFGTLVNIFGNLIFSQNIFELGDPNSGSSEFKEYLWRMLELGNSTNPADYFPMLGKFDLFGQRKEVAECLKGIYAIWGAMLQERKLAKKVDGYKSKNDFVDVCLDSGLNDYQINALLMELFGAGTETSASTIEWAMTELTKNPKITAKIRSEIQTVVGERSVKESDFPNLPYLEATVKETLRLHPPTPLLLPRRALETCTILNYTIPKDCQIMVNAWGIGRDPKTWTDPLTFSPERFLNSSVDFRGNDFSLIPFGAGRRICPGLPIANQFIALLVATFVQNLDWCLPNGMSVDHLIVEEKFGLTLQKEPPLFIVPKSRV,./data/raw/alphafold//AF-O64899-F1-model_v4.pdb,368,3561,4866,5164 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+813,28285,28778,MISASRAAAARLVGAAASRGPTAARHQDSWNGLSHEAFRLVSRRDYASEAIKGAVVGIDLGTTNSCVAVMEGKQAKVLENAEGARTTPSVVAFTADGERLVGMPAKRQAVTNPNNTFYATKRLIGRRYDDPEVQKDIKNVPFKIVRASNGDAWVEAHGKLYSPSQIGAFVLMKMKETAENYLGHTAKNAVITVPAYFNDSQRQATKDAGQISGLNVLRVINEPTAAALAYGLDKSEDKVIAVYDLGGGTFDISILEIQKGVFEVKSTNGDTFLGGEDFDQALLRHIVKEFKRETGVDLTKDNMALQRVREAAEKAKCELSSSVQTDINLPYLTMDSSGPKHLNMKLTRAQFEGIVTDLIRRTIAPCQKAMQDAEVSKSDIGEVILVGGMTRMPKVQQTVQDLFGRAPSKAVNPDEAVAIGAAIQGGVLAGDVTDVLLLDVTPLSLGIETLGGVFTKLINRNTTIPTKKSQVFSTAADGQTQVEIKVCQGEREMAGDNKLLGQFTLIGIPPAPRGVPQIEVTFDIDANGIVHVSAKDKGTGREQQIVIQSSGGLSKDDIENMVKNAEKYAEEDRRKKERVEAVNMAEGIIHDTETKMEEFKDQLPADECNKLKEEISKMRELLARKDSETGENIRQAASSLQQASLKLFEMAYKKMASEREGSGSSGTGEQKEDQKEEKQ,brenda,P38646,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.19,25.0,7.5,3.6.4.10,9606.0,-0.721246399047171,-0.721246399047171,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MISASRAAAARLVGAAASRGPTAARHQDSWNGLSHEAFRLVSRRDYASEAIKGAVVGIDLGTTNSCVAVMEGKQAKVLENAEGARTTPSVVAFTADGERLVGMPAKRQAVTNPNNTFYATKRLIGRRYDDPEVQKDIKNVPFKIVRASNGDAWVEAHGKLYSPSQIGAFVLMKMKETAENYLGHTAKNAVITVPAYFNDSQRQATKDAGQISGLNVLRVINEPTAAALAYGLDKSEDKVIAVYDLGGGTFDISILEIQKGVFEVKSTNGDTFLGGEDFDQALLRHIVKEFKRETGVDLTKDNMALQRVREAAEKAKCELSSSVQTDINLPYLTMDSSGPKHLNMKLTRAQFEGIVTDLIRRTIAPCQKAMQDAEVSKSDIGEVILVGGMTRMPKVQQTVQDLFGRAPSKAVNPDEAVAIGAAIQGGVLAGDVTDVLLLDVTPLSLGIETLGGVFTKLINRNTTIPTKKSQVFSTAADGQTQVEIKVCQGEREMAGDNKLLGQFTLIGIPPAPRGVPQIEVTFDIDANGIVHVSAKDKGTGREQQIVIQSSGGLSKDDIENMVKNAEKYAEEDRRKKERVEAVNMAEGIIHDTETKMEEFKDQLPADECNKLKEEISKMRELLARKDSETGENIRQAASSLQQASLKLFEMAYKKMASEREGSGSSGTGEQKEDQKEEKQ,./data/raw/alphafold//AF-P38646-F1-model_v4.pdb,1523,6821,8659,8884 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+918,35790,36417,MAIALWYCPPQGSVAYETLQMLIFSFQTLFPDSPVFEPHVTVTSHLVCNSKDDVNKILTSCVAAIQSIRSHQTAKKGRKGQVSHAVAAPLVSFNGCSVGKQYFKKIVLECNKNKILYGVAQVMREMYVEIDPETRSSRAATWVHEEFHPHVSLLYSDIHPVSQASLRVVQQRIEDALDVQLVPREKRKGSGNADGSNEVQMRWDFDVSSSLSWNIPGTFKVVNCVGPVQEWEVLGRVDV,sabio,P53314,O=P1([O-])OC2O[C@H](CO)[C@@H](O1)[C@H]2O,0.33,37.0,7.0,3.1.4.-,4932.0,-0.4814860601221125,-0.4814860601221125,O=P1([O-])OC2O[C@H](CO)[C@@H](O1)[C@H]2O__MAIALWYCPPQGSVAYETLQMLIFSFQTLFPDSPVFEPHVTVTSHLVCNSKDDVNKILTSCVAAIQSIRSHQTAKKGRKGQVSHAVAAPLVSFNGCSVGKQYFKKIVLECNKNKILYGVAQVMREMYVEIDPETRSSRAATWVHEEFHPHVSLLYSDIHPVSQASLRVVQQRIEDALDVQLVPREKRKGSGNADGSNEVQMRWDFDVSSSLSWNIPGTFKVVNCVGPVQEWEVLGRVDV,./data/raw/alphafold//AF-P53314-F1-model_v4.pdb,2344,7919,9744,10910 +933,36087,36715,MGNGMNKILPGLYIGNFKDARDAEQLSKNKVTHILSVHDSARPMLEGVKYLCIPAADSPSQNLTRHFKESIKFIHECRLRGESCLVHCLAGVSRSVTLVIAYIMTVTDFGWEDALHTVRAGRSCANPNVGFQRQLQEFEKHEVHQYRQWLKEEYGESPLQDAEEAKNILAAPGILKFWAFLRRL,sabio,Q9NRW4,O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,0.412,30.0,6.0,3.1.3.48,9606.0,-0.3851027839668654,-0.3851027839668654,O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MGNGMNKILPGLYIGNFKDARDAEQLSKNKVTHILSVHDSARPMLEGVKYLCIPAADSPSQNLTRHFKESIKFIHECRLRGESCLVHCLAGVSRSVTLVIAYIMTVTDFGWEDALHTVRAGRSCANPNVGFQRQLQEFEKHEVHQYRQWLKEEYGESPLQDAEEAKNILAAPGILKFWAFLRRL,./data/raw/alphafold//AF-Q9NRW4-F1-model_v4.pdb,2386,7976,9814,10983 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+998,10915,11071,MATLFIADLHLCVEEPAITAGFLRFLAGEARKADALYILGDLFEAWIGDDDPNPLHRKMAAAIKAVSDSGVPCYFIHGNRDFLLGKRFARESGMTLLPEEKVLELYGRRVLIMHGDTLCTDDAGYQAFRAKVHKPWLQTLFLALPLFVRKRIAARMRANSKEANSSKSLAIMDVNQNAVVSAMEKHQVQWLIHGHTHRPAVHELIANQQPAFRVVLGAWHTEGSMVKVTADDVELIHFPF,brenda,P43341,CCCCCCCCCCC[C@@H](O)CC(=O)O[C@H]1[C@H](O)[C@@H](CO)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)[C@@H]1N=C(O)C[C@H](O)CCCCCCCCCCC,0.0617,30.0,8.0,3.6.1.54,562.0,-1.2097148359667584,-1.2097148359667584,CCCCCCCCCCC[C@@H](O)CC(=O)O[C@H]1[C@H](O)[C@@H](CO)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)[C@@H]1N=C(O)C[C@H](O)CCCCCCCCCCC__MATLFIADLHLCVEEPAITAGFLRFLAGEARKADALYILGDLFEAWIGDDDPNPLHRKMAAAIKAVSDSGVPCYFIHGNRDFLLGKRFARESGMTLLPEEKVLELYGRRVLIMHGDTLCTDDAGYQAFRAKVHKPWLQTLFLALPLFVRKRIAARMRANSKEANSSKSLAIMDVNQNAVVSAMEKHQVQWLIHGHTHRPAVHELIANQQPAFRVVLGAWHTEGSMVKVTADDVELIHFPF,./data/raw/alphafold//AF-P43341-F1-model_v4.pdb,5397,3175,3916,4560 +1004,20349,20656,MLPVKNLFVLYTGGTIGMLETPRGLAPAGGFETRMRDHLRTLGDAPDLRWRFAELQPPLDSANMSQGNWLAMRDAIVAALDAGHDGVLLLHGTDTLAYSAAALSFLLLDLPVPVLLTGSMLPAGAPGSDAWDNLVGALRVLQAGHARGVQVYFNDALLHGARVSKLRSDAFDAFAELPRPRQAEHAPVPATLGYRQPRREVNLAVLPLYPGLRAAHLRGLLDSGVEALLLECYGSGTGPSDDEELLAALREAHARGVLLAAVSQCAYGAVEFGVYAAGSRLRDAGLVSAGGMTREAALGKLFGLLGAGLGRDDAQRWFALDLCGENAD,brenda,A0A0U3U5E8,N=C(O)C[C@H](N)C(=O)O,63.3,37.0,7.5,3.5.1.1,287.0,1.801403710017355,1.801403710017355,N=C(O)C[C@H](N)C(=O)O__MLPVKNLFVLYTGGTIGMLETPRGLAPAGGFETRMRDHLRTLGDAPDLRWRFAELQPPLDSANMSQGNWLAMRDAIVAALDAGHDGVLLLHGTDTLAYSAAALSFLLLDLPVPVLLTGSMLPAGAPGSDAWDNLVGALRVLQAGHARGVQVYFNDALLHGARVSKLRSDAFDAFAELPRPRQAEHAPVPATLGYRQPRREVNLAVLPLYPGLRAAHLRGLLDSGVEALLLECYGSGTGPSDDEELLAALREAHARGVLLAAVSQCAYGAVEFGVYAAGSRLRDAGLVSAGGMTREAALGKLFGLLGAGLGRDDAQRWFALDLCGENAD,./data/raw/alphafold//AF-A0A0U3U5E8-F1-model_v4.pdb,4209,5107,7013,7018 +1029,25004,25394,MPYLQPPRPHPHPHPTSRLSRASPPSPFPFFPAGTSRSGRLQPVPVSGHSASRVSKGKFAVAAVTLDDYLPMRSTEVKNRTSTDGIKSLRLITAVKTPYLPDGRFDLEAYDSLINTQINGGAEGVIVGGTTGEGHLMSWDEHIMLIGHTVNCFGANIKVIGNTGSNSTREAVHATEQGFAVGMHAALHVNPYYGKTSTEGLISHFKEVLPMGPTIIYNVPSRTSQDIPPPVIEALSSYSNMAGVKECVGHERVKCYTDKGISIWSGNDDECHDSRWKYGATGVISVASNLVPGLMHSLMFEGENAALNEKLLPLMKWLFCEPNPIGLNTALAQLGVVRPVFRLPYTPLPLEKRVEFVRIVEAIGRENFVGQKESRVLDDDDFVLISRY,brenda,P24846,N[C@@H](CC=O)C(=O)O,0.07,30.0,8.0,4.3.3.7,4565.0,-1.154901959985743,-1.154901959985743,N[C@@H](CC=O)C(=O)O__MPYLQPPRPHPHPHPTSRLSRASPPSPFPFFPAGTSRSGRLQPVPVSGHSASRVSKGKFAVAAVTLDDYLPMRSTEVKNRTSTDGIKSLRLITAVKTPYLPDGRFDLEAYDSLINTQINGGAEGVIVGGTTGEGHLMSWDEHIMLIGHTVNCFGANIKVIGNTGSNSTREAVHATEQGFAVGMHAALHVNPYYGKTSTEGLISHFKEVLPMGPTIIYNVPSRTSQDIPPPVIEALSSYSNMAGVKECVGHERVKCYTDKGISIWSGNDDECHDSRWKYGATGVISVASNLVPGLMHSLMFEGENAALNEKLLPLMKWLFCEPNPIGLNTALAQLGVVRPVFRLPYTPLPLEKRVEFVRIVEAIGRENFVGQKESRVLDDDDFVLISRY,./data/raw/alphafold//AF-P24846-F1-model_v4.pdb,1017,6119,7911,10468 +1091,24966,25356,MYNPRCKDLDRDYFPSYHTTRFQDQPEPNLAVLEHFVRVTKQHGRELTEKQGITVDHLRYGEGRQLVDVFYSEKTTNQAPLFVFVHGGYWQEMDMSMSCSIVGPLVRRGYRVAVMDYNLCPQVTLEQLMTQFTHFLNWIFDYTEMTKVSSLTFAGHSAGAHLLAQILMRPNVITAQRSKMVWALIFLCGVYDLRELSNLESVNPKNILGLNERNIESVSPMLWEYTDVTVWNSTKIYVVAAEHDSTTFIEQSRHYADVLRKKGYKASFTLFKGYDHFDIIEETAIDDSDVSRFLRNIEIE,brenda,Q9VMC9,N[C@@H](CC(=O)c1ccccc1N=CO)C(=O)O,0.32,22.0,7.4,3.5.1.9,7227.0,-0.494850021680094,-0.494850021680094,N[C@@H](CC(=O)c1ccccc1N=CO)C(=O)O__MYNPRCKDLDRDYFPSYHTTRFQDQPEPNLAVLEHFVRVTKQHGRELTEKQGITVDHLRYGEGRQLVDVFYSEKTTNQAPLFVFVHGGYWQEMDMSMSCSIVGPLVRRGYRVAVMDYNLCPQVTLEQLMTQFTHFLNWIFDYTEMTKVSSLTFAGHSAGAHLLAQILMRPNVITAQRSKMVWALIFLCGVYDLRELSNLESVNPKNILGLNERNIESVSPMLWEYTDVTVWNSTKIYVVAAEHDSTTFIEQSRHYADVLRKKGYKASFTLFKGYDHFDIIEETAIDDSDVSRFLRNIEIE,./data/raw/alphafold//AF-Q9VMC9-F1-model_v4.pdb,1014,6115,7906,10461 +1123,27574,28053,MYILVWKEGQQIRTFQDLEECGQFQTASNITDGQIFSINVTPTMSKGGETGETQLRRLMYLSASTEPEKCNAEYLADMAHVATLRNKQIGVSGFLLYSSPFFFQVIEGTDEDLDFLFAKISADPRHERCIVLANGPCTGRMYGEWHMKDSHIDNITKHPAIKTILFQIARSFSSMWSYLPKNAANMLLLGKNPNKQAPEPMSVVVTFIYLVEFSSILAHPGLTEQCADILAAFVDACVRNVEGTGGQVAKFITGICMAYWPINRAEDALVGLQQLSEDLAELRSQQPPGSALSLIYSRCGVHYGRALLCNAGFRKADFTLLGDCINTASRITSLSVKLKVPLLLSFEVRCLLGDEMREELESSGLHKVKGRDKPVQVYQFNAPELDSAMVRAKIEQFNPGRYRALCPVKPYESLHPAQRPPIFDDTPRENQPKLSQVQRRDSLVDRLSLIAKLAFPSSMMAGGEGQLITLTYISQAAHPMSRLDLASIQRIAFARNESSNITGSLLYVSGLFVQTLEGPKGAVVSLYLKIRQDKRHKDVVAVFMAPIDERVYGSPLDMTSATEEMLATFPPLQDVLSQLAKSFISLETYVPSTVVRYLTAGNNPRNLQPVSVEVVMLATDICSFTPLSEKCSLTEVWTICNTFIDACTSAICNEGGEVIKLIGDCVTAYFPPTGADNAVHACQEIVSFCAQLRDAFHDVLDCRSVVACGVGLDFGQVIMAQCGSLGMTEFVVAGEVSARVMEVEALTREAGRAIVITEPVADRLSPKLRDTGIVPCQEGVDGVPCYGILGPEWELDVATIKKNIYGFHDARALAAMKKVDDGTNAPGRGAPAGGIPSSPKVRPPGRTNSVSSYTPDPNEALDPRMAESVFLDMCHQRGDTANNSIAVKLRQAANDDRLDLGRMLQGPHELMPVMQAIKHLTNLRMLNMSDNFVDDNNVGELVESCIPMRSLQVLDLSNNPGLTKVIALKRLIKHNTQVREILLNGTRIAPTEQRKLQSSMNVNRLCASTDLKGSHKYEH,sabio,Q8S9F2,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,0.0005,27.0,7.5,4.6.1.1,3039.0,-3.3010299956639813,-3.3010299956639813,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MYILVWKEGQQIRTFQDLEECGQFQTASNITDGQIFSINVTPTMSKGGETGETQLRRLMYLSASTEPEKCNAEYLADMAHVATLRNKQIGVSGFLLYSSPFFFQVIEGTDEDLDFLFAKISADPRHERCIVLANGPCTGRMYGEWHMKDSHIDNITKHPAIKTILFQIARSFSSMWSYLPKNAANMLLLGKNPNKQAPEPMSVVVTFIYLVEFSSILAHPGLTEQCADILAAFVDACVRNVEGTGGQVAKFITGICMAYWPINRAEDALVGLQQLSEDLAELRSQQPPGSALSLIYSRCGVHYGRALLCNAGFRKADFTLLGDCINTASRITSLSVKLKVPLLLSFEVRCLLGDEMREELESSGLHKVKGRDKPVQVYQFNAPELDSAMVRAKIEQFNPGRYRALCPVKPYESLHPAQRPPIFDDTPRENQPKLSQVQRRDSLVDRLSLIAKLAFPSSMMAGGEGQLITLTYISQAAHPMSRLDLASIQRIAFARNESSNITGSLLYVSGLFVQTLEGPKGAVVSLYLKIRQDKRHKDVVAVFMAPIDERVYGSPLDMTSATEEMLATFPPLQDVLSQLAKSFISLETYVPSTVVRYLTAGNNPRNLQPVSVEVVMLATDICSFTPLSEKCSLTEVWTICNTFIDACTSAICNEGGEVIKLIGDCVTAYFPPTGADNAVHACQEIVSFCAQLRDAFHDVLDCRSVVACGVGLDFGQVIMAQCGSLGMTEFVVAGEVSARVMEVEALTREAGRAIVITEPVADRLSPKLRDTGIVPCQEGVDGVPCYGILGPEWELDVATIKKNIYGFHDARALAAMKKVDDGTNAPGRGAPAGGIPSSPKVRPPGRTNSVSSYTPDPNEALDPRMAESVFLDMCHQRGDTANNSIAVKLRQAANDDRLDLGRMLQGPHELMPVMQAIKHLTNLRMLNMSDNFVDDNNVGELVESCIPMRSLQVLDLSNNPGLTKVIALKRLIKHNTQVREILLNGTRIAPTEQRKLQSSMNVNRLCASTDLKGSHKYEH,./data/raw/alphafold//AF-Q8S9F2-F1-model_v4.pdb,1383,6631,6151,11870 +1159,1584,1620,MARLFTLSESKYYLMALDAGTGSIRAVIFDLEGNQIAVGQAEWRHLAVPDVPGSMEFDLNKNWQLACECMRQALHNAGIAPEYIAAVSACSMREGIVLYNNEGAPIWACANVDARAAREVSELKELHNNTFENEVYRATGQTLALSAIPRLLWLAHHRSDIYRQASTITMISDWLAYMLSGELAVDPSNAGTTGLLDLTTRDWKPALLDMAGLRADILSPVKETGTLLGVVSSQAAELCGLKAGTPVVVGGGDVQLGCLGLGVVRPAQTAVLGGTFWQQVVNLAAPVTDPEMNVRVNPHVIPGMVQAESISFFTGLTMRWFRDAFCAEEKLIAERLGIDTYTLLEEMASRVPPGSWGVMPIFSDRMRFKTWYHAAPSFINLSIDPDKCNKATLFRALEENAAIVSACNLQQIADFSNIHPSSLVFAGGGSKGKLWSQILADVSGLPVNIPVVKEATALGCAIAAGVGAGIFSSMAETGERLVRWERTHTPDPEKHELYQDSRDKWQAVYQDQLGLVDHGLTTSLWKAPGL,brenda,P77432,CC(=O)C(=O)[C@@H](O)CO,0.058,30.0,7.5,2.7.1.189,562.0,-1.2365720064370629,-1.2365720064370629,CC(=O)C(=O)[C@@H](O)CO__MARLFTLSESKYYLMALDAGTGSIRAVIFDLEGNQIAVGQAEWRHLAVPDVPGSMEFDLNKNWQLACECMRQALHNAGIAPEYIAAVSACSMREGIVLYNNEGAPIWACANVDARAAREVSELKELHNNTFENEVYRATGQTLALSAIPRLLWLAHHRSDIYRQASTITMISDWLAYMLSGELAVDPSNAGTTGLLDLTTRDWKPALLDMAGLRADILSPVKETGTLLGVVSSQAAELCGLKAGTPVVVGGGDVQLGCLGLGVVRPAQTAVLGGTFWQQVVNLAAPVTDPEMNVRVNPHVIPGMVQAESISFFTGLTMRWFRDAFCAEEKLIAERLGIDTYTLLEEMASRVPPGSWGVMPIFSDRMRFKTWYHAAPSFINLSIDPDKCNKATLFRALEENAAIVSACNLQQIADFSNIHPSSLVFAGGGSKGKLWSQILADVSGLPVNIPVVKEATALGCAIAAGVGAGIFSSMAETGERLVRWERTHTPDPEKHELYQDSRDKWQAVYQDQLGLVDHGLTTSLWKAPGL,./data/raw/alphafold//AF-P77432-F1-model_v4.pdb,3394,837,1003,1229 +1168,151,157,MAWPGPLLLKDRKGRAYLVFPKEGGVFHHHKGSVPHEALLEAGPGGVVRTHLGEELSVHRPTLEEYLLHMKRSATPTYPKDASAMVTLLDLAPGMRVLEAGTGSGGLTLFLARAVGEKGLVESYEARPHHLAQAERNVRAFWQVENVRFHLGKLEEAELEEAAYDGVALDLMEPWKVLEKAALALKPDRFLVAYLPNITQVLELVRAAEAHPFRLERVLEVGWREWEVRLPVAHPRFQQVGHTAFLVALRRWKAS,sabio,Q8GBB2,*C1OC(COP(=O)(O)OC2C(COP(=O)(O)OC3C(CO)OC(*)C3O)OC(*)C2O)C(O)C1O,0.0027,60.0,8.0,2.1.1.220,274.0,-2.5686362358410126,-2.5686362358410126,*C1OC(COP(=O)(O)OC2C(COP(=O)(O)OC3C(CO)OC(*)C3O)OC(*)C2O)C(O)C1O__MAWPGPLLLKDRKGRAYLVFPKEGGVFHHHKGSVPHEALLEAGPGGVVRTHLGEELSVHRPTLEEYLLHMKRSATPTYPKDASAMVTLLDLAPGMRVLEAGTGSGGLTLFLARAVGEKGLVESYEARPHHLAQAERNVRAFWQVENVRFHLGKLEEAELEEAAYDGVALDLMEPWKVLEKAALALKPDRFLVAYLPNITQVLELVRAAEAHPFRLERVLEVGWREWEVRLPVAHPRFQQVGHTAFLVALRRWKAS,./data/raw/alphafold//AF-Q8GBB2-F1-model_v4.pdb,2922,103,111,125 +1237,34118,34717,MGDVEKGKKIFVQKCAQCHTVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE,sabio,P00004,O=NO,1.42,37.0,7.0,-.-.-.-,9796.0,0.1522883443830564,0.2829130432533325,O=NO__MGDVEKGKKIFVQKCAQCHTVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE,./data/raw/alphafold//AF-P00004-F1-model_v4.pdb,2117,5632,4417,10130 +1258,32984,33572,MGRENILKYQLEHDHESDLVTEKDQSLLLDNNNNLNGMNNTIKTHPVRVSSGNHNNFPFTLSSESTLQDFLNNNKFFVDSIKHNHGNQIFDLNGQGQSPHTLWIGCSDSRAGDQCLATLPGEIFVHRNIANIVNANDISSQGVIQFAIDVLKVKKIIVCGHTDCGGIWASLSKKKIGGVLDLWLNPVRHIRAANLKLLEEYNQDPKLKAKKLAELNVISSVTALKRHPSASVALKKNEIEVWGMLYDVATGYLSQVEIPQDEFEDLFHVHDEHDEEEYNPH,sabio,Q5AJ71,O=C=O,8.2,25.0,,4.2.1.1,5476.0,0.9138138523837168,0.9138138523837168,O=C=O__MGRENILKYQLEHDHESDLVTEKDQSLLLDNNNNLNGMNNTIKTHPVRVSSGNHNNFPFTLSSESTLQDFLNNNKFFVDSIKHNHGNQIFDLNGQGQSPHTLWIGCSDSRAGDQCLATLPGEIFVHRNIANIVNANDISSQGVIQFAIDVLKVKKIIVCGHTDCGGIWASLSKKKIGGVLDLWLNPVRHIRAANLKLLEEYNQDPKLKAKKLAELNVISSVTALKRHPSASVALKKNEIEVWGMLYDVATGYLSQVEIPQDEFEDLFHVHDEHDEEEYNPH,./data/raw/alphafold//AF-Q5AJ71-F1-model_v4.pdb,2062,7607,6297,9989 +1269,35712,36337,MHAFTRRLSGVVAATATLVFTAAAAVPPADASALAAPPEVLPRAETAALFDDDAGGNANADDPAIWRNSADPDASLVVATAKEGGLRVYDLDARQVQSVPAPEAPGADDAPGRFNNVDLVHGMSLGTGATDLAVVSDRGSDKLRVYRVDGDRPHAPLTDVTDPSAPWIFSGSQDEVNEESTAYGLATYTDSVTGRSYALVSQNATTHIALLELTATREGTVNYRQVRTLDLPATFTMPDGTKWSPCGEPGEGPQVEGMAVDPETGTLFAGQEDVGIWRLRADLRGRPVLQDKVREYGVPATYDEASDECVAGADPGFGGARVSADVEGLTLLEQEDGDGYLLTSGQGDDTFVAYDRERSDDYEYEGRFRVGAASEALDGSEECDGADVLAEPLGSRYPNGLLVVQDGHMAPEDGDREATGFKFVDLADVLEALDD,brenda,A0A0F7VP60,O=P(O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O,1.073,65.0,7.0,3.1.3.8,1931.0,0.030599721965951,0.030599721965951,O=P(O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O__MHAFTRRLSGVVAATATLVFTAAAAVPPADASALAAPPEVLPRAETAALFDDDAGGNANADDPAIWRNSADPDASLVVATAKEGGLRVYDLDARQVQSVPAPEAPGADDAPGRFNNVDLVHGMSLGTGATDLAVVSDRGSDKLRVYRVDGDRPHAPLTDVTDPSAPWIFSGSQDEVNEESTAYGLATYTDSVTGRSYALVSQNATTHIALLELTATREGTVNYRQVRTLDLPATFTMPDGTKWSPCGEPGEGPQVEGMAVDPETGTLFAGQEDVGIWRLRADLRGRPVLQDKVREYGVPATYDEASDECVAGADPGFGGARVSADVEGLTLLEQEDGDGYLLTSGQGDDTFVAYDRERSDDYEYEGRFRVGAASEALDGSEECDGADVLAEPLGSRYPNGLLVVQDGHMAPEDGDREATGFKFVDLADVLEALDD,./data/raw/alphafold//AF-A0A0F7VP60-F1-model_v4.pdb,2331,7901,9723,10881 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+1292,19187,19463,MANTKGLKTGNEKDLWVYVEHYKGEPVHVVYELLGECRKLADKCNQKLAAVLITDDAKDVPSKLIARGADLVYVCQDPAFKYYSTDEYTNAFCEMIDEYQPSSVFIGATNDGRDLGPRIAARVNTGLCADCTILDAEEDGLIEWTRPAAGGNIMATILCKEHRPQMGTVRPKTFKAMEPDASRTGEVINYTLKNHVDDRVTCIRREEVVSEGEMAIDDAPFVCSGGRGMKAKENFSLLYDLAHALGGAVGGSRAAVDEGFIEHPRQVGQSGKTVTPKIYFACGISGSVQHKAGMSKSDTIVCINKDPDAPMFEISKYGIVGDALKILPLLTAKIKAFKES,brenda,D2RIQ3,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.145,37.0,7.5,1.3.8.1,1496.0,-0.8386319977650252,-0.8386319977650252,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MANTKGLKTGNEKDLWVYVEHYKGEPVHVVYELLGECRKLADKCNQKLAAVLITDDAKDVPSKLIARGADLVYVCQDPAFKYYSTDEYTNAFCEMIDEYQPSSVFIGATNDGRDLGPRIAARVNTGLCADCTILDAEEDGLIEWTRPAAGGNIMATILCKEHRPQMGTVRPKTFKAMEPDASRTGEVINYTLKNHVDDRVTCIRREEVVSEGEMAIDDAPFVCSGGRGMKAKENFSLLYDLAHALGGAVGGSRAAVDEGFIEHPRQVGQSGKTVTPKIYFACGISGSVQHKAGMSKSDTIVCINKDPDAPMFEISKYGIVGDALKILPLLTAKIKAFKES,./data/raw/alphafold//AF-D2RIQ3-F1-model_v4.pdb,4025,4822,6661,6620 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+3796,38935,39626,MHSIHFLAAFLAAVSEALPNQTRADKAHAITTNVDQVSNKTFDYIVCGGGLTGLVVASRLSEDPNISVLVIENGEDDHEDPRVNDVRTYGEAFKSDLDYNLTSTPVPWQNDTGLLLVAGRTLGGSGSLNGASWTKGDRTQYDLLPVLSGDDSWSFDALNEIMLGIEEFHEPTEEQIAKGAQYADEYHGRDGVVQVSFPAGMFGGIQLSALEASTLVWKGLKLVADFAAGVTSGATIIPNMVEPNDSQNRSSPFTVYAKHQTQERSNFLILTGHRVTSINWRNGTGMVADGVTFQACRECEVHTATTKREVLLAAGSLQSPQLLELSGVGDPEVLAAAYVPLKLCSPNVGKNMQEQTKNTLWFDPISTDFDGSGPPNAVAFPDVHQLFKNDSASIYKSIISSLEGYSQNLTAAGIVTNATATRLILEAQVNNLWKDNAGAAEIFFVTSPTTGQVGIDLWNLIVLSRGYVHITSNSSWDHPQIEPSYFGHPFDLEIQLAATKQSREVSQTEPLASLISAETFPGFDEVPQNATDDVWEQWVKETFTSVWHYIATLGMMKEELGGVVDSRLKVYGIENVRAVDASVLPIQLSAHLSSSLYGIAEKAAMMIKEDQGH,brenda,A0A5Q2UVJ5,OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O,103.0,25.0,7.0,1.1.3.4,1970635.0,2.012837224705172,2.012837224705172,OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O__MHSIHFLAAFLAAVSEALPNQTRADKAHAITTNVDQVSNKTFDYIVCGGGLTGLVVASRLSEDPNISVLVIENGEDDHEDPRVNDVRTYGEAFKSDLDYNLTSTPVPWQNDTGLLLVAGRTLGGSGSLNGASWTKGDRTQYDLLPVLSGDDSWSFDALNEIMLGIEEFHEPTEEQIAKGAQYADEYHGRDGVVQVSFPAGMFGGIQLSALEASTLVWKGLKLVADFAAGVTSGATIIPNMVEPNDSQNRSSPFTVYAKHQTQERSNFLILTGHRVTSINWRNGTGMVADGVTFQACRECEVHTATTKREVLLAAGSLQSPQLLELSGVGDPEVLAAAYVPLKLCSPNVGKNMQEQTKNTLWFDPISTDFDGSGPPNAVAFPDVHQLFKNDSASIYKSIISSLEGYSQNLTAAGIVTNATATRLILEAQVNNLWKDNAGAAEIFFVTSPTTGQVGIDLWNLIVLSRGYVHITSNSSWDHPQIEPSYFGHPFDLEIQLAATKQSREVSQTEPLASLISAETFPGFDEVPQNATDDVWEQWVKETFTSVWHYIATLGMMKEELGGVVDSRLKVYGIENVRAVDASVLPIQLSAHLSSSLYGIAEKAAMMIKEDQGH,./data/raw/alphafold//AF-A0A5Q2UVJ5-F1-model_v4.pdb,2662,8366,10303,11524 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+3828,6471,6587,MNTLLRGGRVVDPKTGADRIADLLMSDGRIAAVGVDLIAPPGTAVVDVRGLIVGPGFVDLHSHVHSIAGQRLQAMDGVTTALDLEAGLMPVAEAMARAAADGRPLNYGFSASWAQARAFAHLDRVPVADFTASMDLLGNGEWQRSSSAPERTRWLGLLEGELAAGALGIGVLMGYAPRSDPDEYLALSRLAAAAHAPTFTHVRELIEADPATPIDGSEELVRAAAETGAAMHHCHVNSTSLRHIDRVLTLLDRSRAAGSRVTVEAYPYGAGSTAIGAFFLAPEKLRGLGITPSSLVLVDTGERIADEARLREVRAADPGATCIVTFLDEADPLDRAHLHRALAYPDSIVASDAMPVSWTSTTGTPTAYEQREWPLPPGGHTHPRTAGTFAKSLRLMVRESETWTWVEAFRRCSYLPARVLDEVSSAMRGKGHLAVGADADVVVIDPVTITDRATYADPTRPSQGVRQLYVHGIPVVHAGEIVTDAFPGRAIRGDA,brenda,I7HFV7,CC(O)=N[C@H](Cc1ccccc1)C(=O)O,2.5,37.0,7.0,3.5.1.81,284570.0,0.3979400086720376,0.3979400086720376,CC(O)=N[C@H](Cc1ccccc1)C(=O)O__MNTLLRGGRVVDPKTGADRIADLLMSDGRIAAVGVDLIAPPGTAVVDVRGLIVGPGFVDLHSHVHSIAGQRLQAMDGVTTALDLEAGLMPVAEAMARAAADGRPLNYGFSASWAQARAFAHLDRVPVADFTASMDLLGNGEWQRSSSAPERTRWLGLLEGELAAGALGIGVLMGYAPRSDPDEYLALSRLAAAAHAPTFTHVRELIEADPATPIDGSEELVRAAAETGAAMHHCHVNSTSLRHIDRVLTLLDRSRAAGSRVTVEAYPYGAGSTAIGAFFLAPEKLRGLGITPSSLVLVDTGERIADEARLREVRAADPGATCIVTFLDEADPLDRAHLHRALAYPDSIVASDAMPVSWTSTTGTPTAYEQREWPLPPGGHTHPRTAGTFAKSLRLMVRESETWTWVEAFRRCSYLPARVLDEVSSAMRGKGHLAVGADADVVVIDPVTITDRATYADPTRPSQGVRQLYVHGIPVVHAGEIVTDAFPGRAIRGDA,./data/raw/alphafold//AF-I7HFV7-F1-model_v4.pdb,5693,2483,3121,3603 +3839,23852,24232,MALRVVRSLRAAACSLFAASAPAAPCSPLPWRLRAGAVRTLRTGPALLSVRKFTEKHEWITTENGIGTVGISNFAQEALGDVVYCSLPEVGTKLKKQDEFGALESVKAASELYSPLSGEVTEINEALAENPGLVNKSCYEDGWLIKMTLSNPSELDELMSEEAYEKYIKSIEE,sabio,Q9N121,NCC(=O)O,3.75,37.0,7.4,1.4.4.2;1.8.1.4;2.1.2.10,9986.0,0.5740312677277188,0.5740312677277188,NCC(=O)O__MALRVVRSLRAAACSLFAASAPAAPCSPLPWRLRAGAVRTLRTGPALLSVRKFTEKHEWITTENGIGTVGISNFAQEALGDVVYCSLPEVGTKLKKQDEFGALESVKAASELYSPLSGEVTEINEALAENPGLVNKSCYEDGWLIKMTLSNPSELDELMSEEAYEKYIKSIEE,./data/raw/alphafold//AF-Q9N121-F1-model_v4.pdb,4764,5957,7705,8685 +3856,21951,22295,MNWRCDVQNFEPDVKISLTRVGVTNLKKLVRLKRTNKRPIILLSTFEVFVNLPSSQKGIHMSRNPEVIEGIIDEALELESYEMETICEEIVKRLFEKHEYATEAEVFMVSDFMTKEKSPISGKYSQEIHKIMGGAKGIKKDDEIELTKIVGAEVVGITACPCAQNLIKEICIKNLKEKGFSDEDIDKILDSVIFATHNQRGIGRIILEVPTGYDIEIMDIIEIIKKSMSAEIHGILKRADEAYVVEQSHKNPKFVEDCVREMAKRVVEKFKHLPDETKVLIRQINMESIHRHDAFAEKVATLGELRRELLSYE,brenda,Q58185,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1,0.096,70.0,7.2,3.5.4.39,2190.0,-1.0177287669604316,-1.0177287669604316,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1__MNWRCDVQNFEPDVKISLTRVGVTNLKKLVRLKRTNKRPIILLSTFEVFVNLPSSQKGIHMSRNPEVIEGIIDEALELESYEMETICEEIVKRLFEKHEYATEAEVFMVSDFMTKEKSPISGKYSQEIHKIMGGAKGIKKDDEIELTKIVGAEVVGITACPCAQNLIKEICIKNLKEKGFSDEDIDKILDSVIFATHNQRGIGRIILEVPTGYDIEIMDIIEIIKKSMSAEIHGILKRADEAYVVEQSHKNPKFVEDCVREMAKRVVEKFKHLPDETKVLIRQINMESIHRHDAFAEKVATLGELRRELLSYE,./data/raw/alphafold//AF-Q58185-F1-model_v4.pdb,4530,5594,6042,7673 +3902,40749,41486,MAGDTHCPAEPLAREGTLWEALRALLPHSKEDLKLDLGEKVERSVVTLLQRATELFYEGRRDECLQSSEVILDYSWEKLNTGTWQDVDKDWRRVYAIGCLLKALCLCQAPEDANTVAAALRVCDMGLLMGAAILGDILLKVAAILQTHLPGKRPARGSLPEQPCTKKARADHGLIPDVKLEKTVPRLHRPSLQHFREQFLVPGRPVILKGVADHWPCMQKWSLEYIQEIAGCRTVPVEVGSRYTDEEWSQTLMTVNEFISKYIVNEPRDVGYLAQHQLFDQIPELKQDISIPDYCSLGDGEEEEITINAWFGPQGTISPLHQDPQQNFLVQVMGRKYIRLYSPQESGALYPHDTHLLHNTSQVDVENPDLEKFPKFAKAPFLSCILSPGEILFIPVKYWHYVRALDLSFSVSFWWS,sabio,Q8N371,[Fe+2],0.0027,37.0,,1.14.11.73,9606.0,-2.5686362358410126,-2.5686362358410126,[Fe+2]__MAGDTHCPAEPLAREGTLWEALRALLPHSKEDLKLDLGEKVERSVVTLLQRATELFYEGRRDECLQSSEVILDYSWEKLNTGTWQDVDKDWRRVYAIGCLLKALCLCQAPEDANTVAAALRVCDMGLLMGAAILGDILLKVAAILQTHLPGKRPARGSLPEQPCTKKARADHGLIPDVKLEKTVPRLHRPSLQHFREQFLVPGRPVILKGVADHWPCMQKWSLEYIQEIAGCRTVPVEVGSRYTDEEWSQTLMTVNEFISKYIVNEPRDVGYLAQHQLFDQIPELKQDISIPDYCSLGDGEEEEITINAWFGPQGTISPLHQDPQQNFLVQVMGRKYIRLYSPQESGALYPHDTHLLHNTSQVDVENPDLEKFPKFAKAPFLSCILSPGEILFIPVKYWHYVRALDLSFSVSFWWS,./data/raw/alphafold//AF-Q8N371-F1-model_v4.pdb,1817,7268,9215,9541 +3937,27283,27755,MGITAATEMALRRHLVAQLDNQLGGTSYRSVLMYPEKMPRPPWRHETHNYIRSGPGPRFLDAPGQPAGMVAAVVSDGTTVAAGYLTGSGSRAALTSTGRSQLERIAGSRTPLTLDLDGLGRYRVLAAPSRNGHDVIVTGLSMGNVDATMLQMLIIFGIVTVIALVAATTAGIVIIKRALAPLRRVAQTASEVVDLPLDRGEVKLPVRVPEPDANPSTEVGQLGSALNRMLDHIAAALSARQASETCVRQFVADASHELRTPLAAIRGYTELTQRIGDDPEAVAHAMSRVASETERITRLVEDLLLLARLDSGRPLERGPVDMSRLAVDAVSDAHVAGPDHQWALDLPPEPVVIPGDAARLHQVVTNLLANARVHTGPGTIVTTRLSTGPTHVVLQVIDNGPGIPAALQSEVFERFARGDTSRSRQAGSTGLGLAIVSAVVKAHNGTITVSSSPGYTEFAVRLPLDGWQPLESSPR,sabio,O69729,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,10.0,,7.5,2.7.13.3,1773.0,1.0,1.0,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MGITAATEMALRRHLVAQLDNQLGGTSYRSVLMYPEKMPRPPWRHETHNYIRSGPGPRFLDAPGQPAGMVAAVVSDGTTVAAGYLTGSGSRAALTSTGRSQLERIAGSRTPLTLDLDGLGRYRVLAAPSRNGHDVIVTGLSMGNVDATMLQMLIIFGIVTVIALVAATTAGIVIIKRALAPLRRVAQTASEVVDLPLDRGEVKLPVRVPEPDANPSTEVGQLGSALNRMLDHIAAALSARQASETCVRQFVADASHELRTPLAAIRGYTELTQRIGDDPEAVAHAMSRVASETERITRLVEDLLLLARLDSGRPLERGPVDMSRLAVDAVSDAHVAGPDHQWALDLPPEPVVIPGDAARLHQVVTNLLANARVHTGPGTIVTTRLSTGPTHVVLQVIDNGPGIPAALQSEVFERFARGDTSRSRQAGSTGLGLAIVSAVVKAHNGTITVSSSPGYTEFAVRLPLDGWQPLESSPR,./data/raw/alphafold//AF-O69729-F1-model_v4.pdb,1317,6549,8438,7930 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+134,34628,35235,MFSVTRRRAAGAAAAMATATGTLYWMTSQGDRPLVHNDPSYMVQFPTAAPPQVSRRDLLDRLAKTHQFDVLIIGGGATGTGCALDAATRGLNVALVEKGDFASGTSSKSTKMIHGGVRYLEKAFWEFSKAQLDLVIEALNERKHLINTAPHLCTVLPILIPIYSTWQVPYIYMGCKFYDFFAGSQNLKKSYLLSKSATVEKAPMLTTDNLKASLVYHDGSFNDSRLNATLAITAVENGATVLNYVEVQKLIKDPTSGKVIGAEARDVETNELVRINAKCVVNATGPYSDAILQMDRNPSGLPDSPLNDNSKIKSTFNQIAVMDPKMVIPSIGVHIVLPSFYCPKDMGLLDVRTSDGRVMFFLPWQGKVLAGTTDIPLKQVPENPMPTEADIQDILKELQHYIEFPVKREDVLSAWAGVRPLVRDPRTIPADGKKGSATQGVVRSHFLFTSDNGLITIAGGKWTTYRQMAEETVDKVVEVGGFHNLKPCHTRDIKLAGAEEWTQNYVALLAQNYHLSSKMSNYLVQNYGTRSSIICEFFKESMENKLPLSLADKENNVIYSSEENNLVNFDTFRYPFTIGELKYSMQYEYCRTPLDFLLRRTRFAFLDAKEALNAVHATVKVMGDEFNWSEKKRQWELEKTVNFIKTFGV,sabio,P32191,O=P(O)(O)OCC(O)CO,23.0,,6.8,1.1.5.3,4932.0,1.3617278360175928,1.446603376529924,O=P(O)(O)OCC(O)CO__MFSVTRRRAAGAAAAMATATGTLYWMTSQGDRPLVHNDPSYMVQFPTAAPPQVSRRDLLDRLAKTHQFDVLIIGGGATGTGCALDAATRGLNVALVEKGDFASGTSSKSTKMIHGGVRYLEKAFWEFSKAQLDLVIEALNERKHLINTAPHLCTVLPILIPIYSTWQVPYIYMGCKFYDFFAGSQNLKKSYLLSKSATVEKAPMLTTDNLKASLVYHDGSFNDSRLNATLAITAVENGATVLNYVEVQKLIKDPTSGKVIGAEARDVETNELVRINAKCVVNATGPYSDAILQMDRNPSGLPDSPLNDNSKIKSTFNQIAVMDPKMVIPSIGVHIVLPSFYCPKDMGLLDVRTSDGRVMFFLPWQGKVLAGTTDIPLKQVPENPMPTEADIQDILKELQHYIEFPVKREDVLSAWAGVRPLVRDPRTIPADGKKGSATQGVVRSHFLFTSDNGLITIAGGKWTTYRQMAEETVDKVVEVGGFHNLKPCHTRDIKLAGAEEWTQNYVALLAQNYHLSSKMSNYLVQNYGTRSSIICEFFKESMENKLPLSLADKENNVIYSSEENNLVNFDTFRYPFTIGELKYSMQYEYCRTPLDFLLRRTRFAFLDAKEALNAVHATVKVMGDEFNWSEKKRQWELEKTVNFIKTFGV,./data/raw/alphafold//AF-P32191-F1-model_v4.pdb,2193,7675,9450,10566 +138,26894,27357,MNIVVLISGNGSNLQAIIDACKTNKIKGTVRAVFSNKADAFGLERARQAGIATHTLIASAFDSREAYDRELIHEIDMYAPDVVVLAGFMRILSPAFVSHYAGRLLNIHPSLLPKYPGLHTHRQALENGDEEHGTSVHFVTDELDGGPVILQAKVPVFAGDSEDDITARVQTQEHAIYPLVISWFADGRLKMHENAAWLDGQRLPPQGYAADE,sabio,P08179,Nc1nc2ncc(CN(C=O)c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1,0.6,26.0,,2.1.2.2,562.0,-0.2218487496163563,-0.2218487496163563,Nc1nc2ncc(CN(C=O)c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1__MNIVVLISGNGSNLQAIIDACKTNKIKGTVRAVFSNKADAFGLERARQAGIATHTLIASAFDSREAYDRELIHEIDMYAPDVVVLAGFMRILSPAFVSHYAGRLLNIHPSLLPKYPGLHTHRQALENGDEEHGTSVHFVTDELDGGPVILQAKVPVFAGDSEDDITARVQTQEHAIYPLVISWFADGRLKMHENAAWLDGQRLPPQGYAADE,./data/raw/alphafold//AF-P08179-F1-model_v4.pdb,1261,6468,8338,10349 +149,18002,18262,MMIVIKTAIPDVLILEPKVFGDERGFFFESYNQQTFEELIGRKVTFVQDNHSKSKKNVLRGLHFQRGENAQGKLVRCAVGEVFDVAVDIRKESPTFGQWVGVNLSAENKRQLWIPEGFAHGFVTLSEYAEFLYKATNYYSPSSEGSILWNDEAIGIEWPFSQLPELSAKDAAAPLLDQALLTE,sabio,P26394,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OC3OC(C)C(=O)C(O)C3O)O2)c(=O)[nH]c1=O,0.71,25.0,7.0,5.1.3.13,90371.0,-0.1487416512809247,-0.1487416512809247,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OC3OC(C)C(=O)C(O)C3O)O2)c(=O)[nH]c1=O__MMIVIKTAIPDVLILEPKVFGDERGFFFESYNQQTFEELIGRKVTFVQDNHSKSKKNVLRGLHFQRGENAQGKLVRCAVGEVFDVAVDIRKESPTFGQWVGVNLSAENKRQLWIPEGFAHGFVTLSEYAEFLYKATNYYSPSSEGSILWNDEAIGIEWPFSQLPELSAKDAAAPLLDQALLTE,./data/raw/alphafold//AF-P26394-F1-model_v4.pdb,942,4375,5829,6251 +153,21741,22079,MARLGRLLSVLGLVLCGATGLGLSAPPAPTPKKPIIGILMQKCHNKNMRALGKYYIAASYVKFLESAGARVVPVRLDLKNEEYEKLFKSINGVLFPGGSVNLMRSGYARVAKMFYNLSIKSFGEGDYFPVWGTCLGFEELIYLVSGESLLTLTDTVGIKLPLNFSRGTLQSRMFQNFPADLLLSLAVEPLTAHFHKWSLSVMNFTKNEKLKAFFSILTTNTDGNIDFISTMEGYRYPIYGVQWHPEKAPYEWGQLRGISHAPNAVKAAFYLAEFFVAEARKSNHHFESDVEETKALIYQYRPTYTGNVSSFQQSYIFD,uniprot_search,A7YWG4,N=c1nc(O)c2nc(CNc3ccc(C(=O)N[C@@H](CCC(O)=N[C@@H](CCC(O)=N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)cc3)cnc2[nH]1,0.0017,70.0,3.9,3.4.19.9,9913.0,-2.7695510786217263,-2.7695510786217263,N=c1nc(O)c2nc(CNc3ccc(C(=O)N[C@@H](CCC(O)=N[C@@H](CCC(O)=N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)cc3)cnc2[nH]1__MARLGRLLSVLGLVLCGATGLGLSAPPAPTPKKPIIGILMQKCHNKNMRALGKYYIAASYVKFLESAGARVVPVRLDLKNEEYEKLFKSINGVLFPGGSVNLMRSGYARVAKMFYNLSIKSFGEGDYFPVWGTCLGFEELIYLVSGESLLTLTDTVGIKLPLNFSRGTLQSRMFQNFPADLLLSLAVEPLTAHFHKWSLSVMNFTKNEKLKAFFSILTTNTDGNIDFISTMEGYRYPIYGVQWHPEKAPYEWGQLRGISHAPNAVKAAFYLAEFFVAEARKSNHHFESDVEETKALIYQYRPTYTGNVSSFQQSYIFD,./data/raw/alphafold//AF-A7YWG4-F1-model_v4.pdb,4437,5500,1664,7563 +157,10393,10548,MQRPVELEVDGLVLRGMEH,sabio,Q7M0L6,CCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1,0.0043,70.0,7.1,3.1.1.1,405212.0,-2.3665315444204134,-2.4067223989288262,CCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1__MQRPVELEVDGLVLRGMEH,./data/raw/alphafold//AF-Q7M0L6-F1-model_v4.pdb,5437,3095,3826,4445 +168,26810,27270,MALVKEVLVVLNRLSPFELQESWDNSGLNVGSENSEFSEIVACLEITLKIALNAPQNALIITHHPLIFKPLKTLNDEIYPGNILKILIQKNVSVISMHTNFDKTHLNKHFAHALLEFDGLVEKGLMLVKENANIEFDALVKKIKSSLGVGSLACVKSSQTIKDLAFVCGSGASMFSSLKAQSCLITGDVKYHDAMIAQSLGISLIDATHYYSERGFALIVAEILHSFNYLVTIENFKNPLQII,sabio,O25613,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,0.04,30.0,4.0,3.5.4.16,210.0,-1.3979400086720375,-1.3979400086720375,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1__MALVKEVLVVLNRLSPFELQESWDNSGLNVGSENSEFSEIVACLEITLKIALNAPQNALIITHHPLIFKPLKTLNDEIYPGNILKILIQKNVSVISMHTNFDKTHLNKHFAHALLEFDGLVEKGLMLVKENANIEFDALVKKIKSSLGVGSLACVKSSQTIKDLAFVCGSGASMFSSLKAQSCLITGDVKYHDAMIAQSLGISLIDATHYYSERGFALIVAEILHSFNYLVTIENFKNPLQII,./data/raw/alphafold//AF-O25613-F1-model_v4.pdb,1243,6447,8316,10322 +173,17641,17900,MRLLSWLPFVFLLEVIFASNQIKFDLYDNNELQSNNDTVDLATQYSQISNSSLLWGPYRSALYFGLRPRFPRSLLSGLMWFSINDYEGIGKIRHFYEQHDKMSKANWVSYDPRIGGRQIIDDDECHIKIIIDFVKSDDGLSWGVKIRAKPHKGFENIKTSFIWYSGLEGEQKVIEENGDETTSRTGFLKLENPKNVLGYEGNVKFAGVSEELGAFELEINDGPKTNVHPAGRTDVDPELDPRKAHHYSLTVPDDNVWRARDIFMTMLQESIQKLVEKFGGVEAIPPENLFILRDLQDFEGNLHFVQKVYQGSCEFDVVYNNALTPITERITFENLKFRIQNSLKAFDEKFNNHFELAPPFNSKKYKKFGKEVLSGLLGGLSYFYGDQLVDRETVFDEDSFESYKLEGTFEGPYELFTLVPSRPFFPRGFLWDEGFHLLPLLNYDSDLVLEITKSWFNLIDEDGWIAREQILGKESRSRVPAEFVVQSPQIVNPPTLTLVLTYLLDSVVGNYDTINEPKNVDESLSRENLGGFVLKNPEVLTNYTKQVYPKLKSHLDMFRRTQKGYVEEFDRGTNPEAYRWRGRTLTHCLASGLDDYPRALPADVAELNVDLISWIGIMTRSIRLMAEILNIDEDVETYKNLENDIIDNIEKLHWSPEDKTYCDVSVNDDDENIFVCFKGYISLFPFLTKLIPEANTDKLEHIINLISNPEELWTPYGIRSLSKADEFYKTGEDYWRSPIWIPINYLILDSIQDYYIRSKHHMSTNLQEKFAKTYHDLRINIVKNVFDQADKTGFVWEQYNDETGEAQRAKNFLGWSSLVLIMMTMPEHLQ,brenda,Q2V621,Cc1cc(=O)oc2cc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12,0.133,37.0,7.0,3.2.1.106,5476.0,-0.8761483590329142,-1.0039780095238615,Cc1cc(=O)oc2cc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12__MRLLSWLPFVFLLEVIFASNQIKFDLYDNNELQSNNDTVDLATQYSQISNSSLLWGPYRSALYFGLRPRFPRSLLSGLMWFSINDYEGIGKIRHFYEQHDKMSKANWVSYDPRIGGRQIIDDDECHIKIIIDFVKSDDGLSWGVKIRAKPHKGFENIKTSFIWYSGLEGEQKVIEENGDETTSRTGFLKLENPKNVLGYEGNVKFAGVSEELGAFELEINDGPKTNVHPAGRTDVDPELDPRKAHHYSLTVPDDNVWRARDIFMTMLQESIQKLVEKFGGVEAIPPENLFILRDLQDFEGNLHFVQKVYQGSCEFDVVYNNALTPITERITFENLKFRIQNSLKAFDEKFNNHFELAPPFNSKKYKKFGKEVLSGLLGGLSYFYGDQLVDRETVFDEDSFESYKLEGTFEGPYELFTLVPSRPFFPRGFLWDEGFHLLPLLNYDSDLVLEITKSWFNLIDEDGWIAREQILGKESRSRVPAEFVVQSPQIVNPPTLTLVLTYLLDSVVGNYDTINEPKNVDESLSRENLGGFVLKNPEVLTNYTKQVYPKLKSHLDMFRRTQKGYVEEFDRGTNPEAYRWRGRTLTHCLASGLDDYPRALPADVAELNVDLISWIGIMTRSIRLMAEILNIDEDVETYKNLENDIIDNIEKLHWSPEDKTYCDVSVNDDDENIFVCFKGYISLFPFLTKLIPEANTDKLEHIINLISNPEELWTPYGIRSLSKADEFYKTGEDYWRSPIWIPINYLILDSIQDYYIRSKHHMSTNLQEKFAKTYHDLRINIVKNVFDQADKTGFVWEQYNDETGEAQRAKNFLGWSSLVLIMMTMPEHLQ,./data/raw/alphafold//AF-Q2V621-F1-model_v4.pdb,1153,4276,5721,6131 +175,10487,10642,MSGIQFDVSRLCAATISIQGRHFVDSHGRVLHLRGANVSAASKVPATPAPKIHDHAQASYVGRPFRLEEADEHWARLKSWGLTFVRITVTWEALEHKERGVYDEDYLAYLRALLQSMEPYGLVAYIALHQDVWSRYCGGSGAPGWTLEAAGFDLSNEGENLSLSGAAFLDGIKSGRLAGERGLWPTGYQKLAAATMNTLFWGGETFAPLLKVPGQIDGKWVSRNIQVYLQEAFLAATAKLVKAVGDLETVMGFELMNEPHPGFIGIQSIHEWDYTTDLHLGQFPSPLQSFSMGAGHPTPNVPVYTRSFPFPTRVTSHVTANPEGACAWASKECPWEKHGVWRWSEAKQEAAALQQDYFVKNRDGGKVDFYEDFYFPFVRKWEQVIGENISSTKGLKARMVEAIPNELCPEWKEESRPKNMVYAPHWYDLNTLFKKKFGFMSVNVQGLARGMFILRALYFGTAAAKANYALQIKTIVLAARLKLGPVPVIFGECGVPMDINNEEAFRTGDWKWQERSMDALISAMEGALMGFNLWTYNPANRDDIGDDWNAENFSWYSESNRTKLLKNAEKSSDGLDVGARLLNVIVRPYPIATAGNPTSLAYDANACAFTYRFRSPLRVSAAAPTPEEYTEIFLPRRVFRKESTEWTVTAGGKVHVDWERERVFVWFEDSSLTAASIKDDTRPRRIDIWVIGRKVEENWSIAQILVAVVILLLGVLVAYYAQLYEWEKDKMIFQHLREANGM,brenda,H1AE12,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)N=C(O)CCCCCNc1ccc([N+](=O)[O-])c2nonc12,0.0058,30.0,7.3,3.2.1.62,5207.0,-2.2365720064370627,-2.2365720064370627,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)N=C(O)CCCCCNc1ccc([N+](=O)[O-])c2nonc12__MSGIQFDVSRLCAATISIQGRHFVDSHGRVLHLRGANVSAASKVPATPAPKIHDHAQASYVGRPFRLEEADEHWARLKSWGLTFVRITVTWEALEHKERGVYDEDYLAYLRALLQSMEPYGLVAYIALHQDVWSRYCGGSGAPGWTLEAAGFDLSNEGENLSLSGAAFLDGIKSGRLAGERGLWPTGYQKLAAATMNTLFWGGETFAPLLKVPGQIDGKWVSRNIQVYLQEAFLAATAKLVKAVGDLETVMGFELMNEPHPGFIGIQSIHEWDYTTDLHLGQFPSPLQSFSMGAGHPTPNVPVYTRSFPFPTRVTSHVTANPEGACAWASKECPWEKHGVWRWSEAKQEAAALQQDYFVKNRDGGKVDFYEDFYFPFVRKWEQVIGENISSTKGLKARMVEAIPNELCPEWKEESRPKNMVYAPHWYDLNTLFKKKFGFMSVNVQGLARGMFILRALYFGTAAAKANYALQIKTIVLAARLKLGPVPVIFGECGVPMDINNEEAFRTGDWKWQERSMDALISAMEGALMGFNLWTYNPANRDDIGDDWNAENFSWYSESNRTKLLKNAEKSSDGLDVGARLLNVIVRPYPIATAGNPTSLAYDANACAFTYRFRSPLRVSAAAPTPEEYTEIFLPRRVFRKESTEWTVTAGGKVHVDWERERVFVWFEDSSLTAASIKDDTRPRRIDIWVIGRKVEENWSIAQILVAVVILLLGVLVAYYAQLYEWEKDKMIFQHLREANGM,./data/raw/alphafold//AF-H1AE12-F1-model_v4.pdb,5453,3111,3844,4472 +212,22675,23027,MKHLTTMSELSTEEIKDLLQTAQELKSGKTDNQLTGKFAANLFFEPSTRTRFSFEVAEKKLGMNVLNLDGTSTSVQKGETLYDTIRTLESIGVDVCVIRHSEDEYYEELVSQVNIPILNAGDGCGQHPTQSLLDLMTIYEEFNTFKGLTVSIHGDIKHSRVARSNAEVLTRLGARVLFSGPSEWQDEENTFGTYVSMDEAVESSDVVMLLRIQNERHQSAVSQEGYLNKYGLTVERAERMKRHAIIMHPAPVNRGVEIDDSLVESEKSRIFKQMKNGVFIRMAVIQRALQTNVKRGEAAYVISH,sabio,P05654,NC(=O)OP(=O)(O)O,0.095,25.0,8.3,2.1.3.2,1423.0,-1.0222763947111522,-1.0222763947111522,NC(=O)OP(=O)(O)O__MKHLTTMSELSTEEIKDLLQTAQELKSGKTDNQLTGKFAANLFFEPSTRTRFSFEVAEKKLGMNVLNLDGTSTSVQKGETLYDTIRTLESIGVDVCVIRHSEDEYYEELVSQVNIPILNAGDGCGQHPTQSLLDLMTIYEEFNTFKGLTVSIHGDIKHSRVARSNAEVLTRLGARVLFSGPSEWQDEENTFGTYVSMDEAVESSDVVMLLRIQNERHQSAVSQEGYLNKYGLTVERAERMKRHAIIMHPAPVNRGVEIDDSLVESEKSRIFKQMKNGVFIRMAVIQRALQTNVKRGEAAYVISH,./data/raw/alphafold//AF-P05654-F1-model_v4.pdb,4614,5722,7398,8306 +254,154,160,MKYRTHKCNELSLDHVGEHVRLSGWVHRYRNHGGVVFIDLRDCFGITQIVCRQEENPELHQLMDQVRSEWVLCVEGLVCARLEGMENPNLVTGSIEVEVSSLEVLSRAQNLPFSISDEHINVNEELRLTYRYLDMRRGDILDRLMCRHKVMLACRQYLDEQGFTEVVTPILGKSTPEGARDYLVPSRIYPGNFYALPQSPQLFKQILMVGGLDRYFQIATCFRDEDLRADRQPEFTQIDMEMSFGGPEDLFPVVEELVARLFAVKGIELKAPFLRMTYQEAKDSYGTDKPDLRFGLRLKNCCEYARKFTFSIFLDQLAYGGTVKGFCVPGGADMSRKQLDIYTDFVKRYGAMGLVWIKKQDGGVSSNVAKFASEDVFQEMFEAFEAKDQDILLLIAAPEAVANQALDHLRRLIARERQLYDSTQYNFVWITDFPLFAKEEGELCPEHHPFTAPLDEDISLLDSDPFAVRSSSYDLVLNGYEIASGSQRIHNPDLQNKIFALLKLSQESVKEKFGFFIDALSFGTPPHLGIALGLDRIMMVLTGAETIREVIAFPKTQKAGDLMMSAPSEILPIQLKELGLKL,sabio,O84546,*C1OC(COP(=O)(O)OC2C(COP(=O)(O)OC3C(CO)OC(*)C3O)OC(*)C2O)C(O)C1O,0.00276,37.0,7.2,6.1.1.23,813.0,-2.5590909179347823,-2.790683656322967,*C1OC(COP(=O)(O)OC2C(COP(=O)(O)OC3C(CO)OC(*)C3O)OC(*)C2O)C(O)C1O__MKYRTHKCNELSLDHVGEHVRLSGWVHRYRNHGGVVFIDLRDCFGITQIVCRQEENPELHQLMDQVRSEWVLCVEGLVCARLEGMENPNLVTGSIEVEVSSLEVLSRAQNLPFSISDEHINVNEELRLTYRYLDMRRGDILDRLMCRHKVMLACRQYLDEQGFTEVVTPILGKSTPEGARDYLVPSRIYPGNFYALPQSPQLFKQILMVGGLDRYFQIATCFRDEDLRADRQPEFTQIDMEMSFGGPEDLFPVVEELVARLFAVKGIELKAPFLRMTYQEAKDSYGTDKPDLRFGLRLKNCCEYARKFTFSIFLDQLAYGGTVKGFCVPGGADMSRKQLDIYTDFVKRYGAMGLVWIKKQDGGVSSNVAKFASEDVFQEMFEAFEAKDQDILLLIAAPEAVANQALDHLRRLIARERQLYDSTQYNFVWITDFPLFAKEEGELCPEHHPFTAPLDEDISLLDSDPFAVRSSSYDLVLNGYEIASGSQRIHNPDLQNKIFALLKLSQESVKEKFGFFIDALSFGTPPHLGIALGLDRIMMVLTGAETIREVIAFPKTQKAGDLMMSAPSEILPIQLKELGLKL,./data/raw/alphafold//AF-O84546-F1-model_v4.pdb,2926,106,114,128 +256,21371,21697,MKTIVKLDLDKKPWEQDGQIHNRWHPDLPMIAMVKPGDEFRVECMDWTGGQIGNNDSANDVRDVDLTQVHYLSGPIGVEGAEPGDLMVVDILDVGTFDDSQWGFNGLFAKENGGGFLTDHFPEASKTIWDFHGVYTTSRHVPKVRYAGIMHPGLIGCLPSKELLDTWNKREGDLIATDPDRVPPLACPPTSQSAVMGRLSGDAAKKAAAEGARTVPPRDHGGNCDIKNLTKGSRVYFPVYVKDGGLSMGDLHFSQGDGEITFCGAIEMAGYLDIKVGLIKDGVKKYGIKNPVFQPSPITPTYRDYMIFEGISVDEAGKQHYLDVHIAYRQACLNAIEYLKKFGYSGEQAVSILGTAPVEGHISGIVDIPNACATLWIPTEIFEFDIRPNADGPKIMVPPGVDVSFTS,uniprot_search,Q50228,N=CO,2.1,25.0,7.733333333333333,3.5.1.49,17.0,0.3222192947339193,0.3222192947339193,N=CO__MKTIVKLDLDKKPWEQDGQIHNRWHPDLPMIAMVKPGDEFRVECMDWTGGQIGNNDSANDVRDVDLTQVHYLSGPIGVEGAEPGDLMVVDILDVGTFDDSQWGFNGLFAKENGGGFLTDHFPEASKTIWDFHGVYTTSRHVPKVRYAGIMHPGLIGCLPSKELLDTWNKREGDLIATDPDRVPPLACPPTSQSAVMGRLSGDAAKKAAAEGARTVPPRDHGGNCDIKNLTKGSRVYFPVYVKDGGLSMGDLHFSQGDGEITFCGAIEMAGYLDIKVGLIKDGVKKYGIKNPVFQPSPITPTYRDYMIFEGISVDEAGKQHYLDVHIAYRQACLNAIEYLKKFGYSGEQAVSILGTAPVEGHISGIVDIPNACATLWIPTEIFEFDIRPNADGPKIMVPPGVDVSFTS,./data/raw/alphafold//AF-Q50228-F1-model_v4.pdb,4385,5391,6088,7427 +267,32029,32593,MLGKIALEEAFALPRFEEKTRWWASLFSVDPEIEHADKYGVGYQILSYTAPGVQDIWDPVEAQAGEVGVDRILSIDYPFETFEDAAVVLRRDVQTYGFIGALVNDTQRTGPMGNNQEEAYNINDYIAEQIRDKPDRFGAFTLSMHNPQEAGRDNAARLFERNPTGTIYEKLGAFRDYDAKVKAEITDINKLRIENASWDIFWQTDTEAQALAVEDADVWFDGAEFYDNAAMQYVIAYGAKQADIYGPINHWFEDRLLGLAETCKWLVGPDLSFAHGVSLHVLGMTVNGVFDR,uniprot_search,P80346,O=C(O)c1cccc([O-])c1O,0.3,42.0,5.2,4.1.1.46,5061.0,-0.5228787452803376,-0.4956999141190412,O=C(O)c1cccc([O-])c1O__MLGKIALEEAFALPRFEEKTRWWASLFSVDPEIEHADKYGVGYQILSYTAPGVQDIWDPVEAQAGEVGVDRILSIDYPFETFEDAAVVLRRDVQTYGFIGALVNDTQRTGPMGNNQEEAYNINDYIAEQIRDKPDRFGAFTLSMHNPQEAGRDNAARLFERNPTGTIYEKLGAFRDYDAKVKAEITDINKLRIENASWDIFWQTDTEAQALAVEDADVWFDGAEFYDNAAMQYVIAYGAKQADIYGPINHWFEDRLLGLAETCKWLVGPDLSFAHGVSLHVLGMTVNGVFDR,./data/raw/alphafold//AF-P80346-F1-model_v4.pdb,1976,7474,7320,9794 +287,17073,17321,MNLISLFSGAGGLDLGFQKAGFRIICANEYDKSIWKTYESNHSAKLIKGDISKISSDEFPKCDGIIGGPPCQSWSEGGSLRGIDDPRGKLFYEYIRILKQKKPIFFLAENVKGMMAQRHNKAVQEFIQEFDNAGYDVHIILLNANDYGVAQDRKRVFYIGFRKELNINYLPPIPHLIKPTFKDVIWDLKDNPIPALDKNKTNGNKCIYPNHEYFIGSYSTIFMSRNRVRQWNEPAFTVQASGRQCQLHPQAPVMLKVSKNLNKFVEGKEHLYRRLTVRECARVQGFPDDFIFHYESLNDGYKMIGNAVPVNLAYEIAKTIKSALEICKGN,brenda,P20589,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,0.00028,37.0,8.5,2.1.1.37,197575.0,-3.552841968657781,-3.552841968657781,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MNLISLFSGAGGLDLGFQKAGFRIICANEYDKSIWKTYESNHSAKLIKGDISKISSDEFPKCDGIIGGPPCQSWSEGGSLRGIDDPRGKLFYEYIRILKQKKPIFFLAENVKGMMAQRHNKAVQEFIQEFDNAGYDVHIILLNANDYGVAQDRKRVFYIGFRKELNINYLPPIPHLIKPTFKDVIWDLKDNPIPALDKNKTNGNKCIYPNHEYFIGSYSTIFMSRNRVRQWNEPAFTVQASGRQCQLHPQAPVMLKVSKNLNKFVEGKEHLYRRLTVRECARVQGFPDDFIFHYESLNDGYKMIGNAVPVNLAYEIAKTIKSALEICKGN,./data/raw/alphafold//AF-P20589-F1-model_v4.pdb,772,4147,5569,5959 +304,10483,10638,MNEPTENRLGCSRTPEPDIRLRKGHQLDGTRRGDNDSHQGDLEPILEASVLSSHHKKSSEEHEYSDEAPQEDEGFMGMSPLLQAHHAMEKMEEFVCKVWEGRWRVIPHDVLPDWLKDNDFLLHGHRPPMPSFRACFKSIFRIHTETGNIWTHLLGCVFFLCLGIFYMFRPNISFVAPLQEKVVFGLFFLGAILCLSFSWLFHTVYCHSEGVSRLFSKLDYSGIALLIMGSFVPWLYYSFYCNPQPCFIYLIVICVLGIAAIIVSQWDMFATPQYRGVRAGVFLGLGLSGIIPTLHYVISEGFLKAATIGQIGWLMLMASLYITGAALYAARIPERFFPGKCDIWFHSHQLFHIFVVAGAFVHFHGVSNLQEFRFMIGGGCSEEDAL,brenda,Q86V24,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)N=C(O)CCCCCCCCCCCCCCCCC,0.0156,37.0,7.0,3.5.1.23,9606.0,-1.8068754016455384,-1.8068754016455384,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)N=C(O)CCCCCCCCCCCCCCCCC__MNEPTENRLGCSRTPEPDIRLRKGHQLDGTRRGDNDSHQGDLEPILEASVLSSHHKKSSEEHEYSDEAPQEDEGFMGMSPLLQAHHAMEKMEEFVCKVWEGRWRVIPHDVLPDWLKDNDFLLHGHRPPMPSFRACFKSIFRIHTETGNIWTHLLGCVFFLCLGIFYMFRPNISFVAPLQEKVVFGLFFLGAILCLSFSWLFHTVYCHSEGVSRLFSKLDYSGIALLIMGSFVPWLYYSFYCNPQPCFIYLIVICVLGIAAIIVSQWDMFATPQYRGVRAGVFLGLGLSGIIPTLHYVISEGFLKAATIGQIGWLMLMASLYITGAALYAARIPERFFPGKCDIWFHSHQLFHIFVVAGAFVHFHGVSNLQEFRFMIGGGCSEEDAL,./data/raw/alphafold//AF-Q86V24-F1-model_v4.pdb,5451,3110,3842,4469 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+673,36327,36959,MAQLTLEEKAGLCSGESFWRTKAIDRLGIPSIMMTDGPHGLRKQAGEADHLGLNESIPATCFPTAAGLASSWDRELVRKVGEALGKESQAENVSILLGPGANIKRSPLCGRNFEYFSEDPYLTGELAAAHIAGVQSQGVGTSLKHFAVNNQEHRRMTTDAVVDERTLREIYLTGFEIAVKKSQPWTVMSAYNRMNGTYCSENETLLTRILKEEWGHEGIVVSDWGAVNEAAASVAAGMELEMPSSHGIGQRKIVAAVESGELSVEALDRAVTRLLTVIFKAVDSRKTDATYDKEAHHLLAREIARESMVLLKNEGNLLPLAKTGKLAIIGAMAEQVRYQGGGSSHIKPTKLDSIRDEIEKSARSAEIRYSKGYLLESDESDESLLNEAKQAAADSDVAVLFVGLPDRYESEGYDRTHLNLPANHIELIERIASVQPNVVVILSNGSPVVMPWLGHAKAVLEAYLGGQAAGGAIADLLFGDANPSGKLAETFPHSLKHNPSHPFYPGEGDRTEYREGIFVGYRYFDAKDIEPLFPFGHGLSYTAFSYSGLKLDKSEMTDRDIVQVRVNVKNTGGRFGKETVQLYVHSRNSSVIRPEKELKGFAKVSLNPEEEQTVTFALDKRSFAYYNAELKEWHAETGEYEILIGSSSRDIALRTALTVQSTTEIVPTFHRNTTLGELMENPATLPILAHLQSMAPQQQAQSDSVSPDMMMAMMRYMPLRALLPFTGGAMTEETLGMLLEQFNQAVRGEKNQPHASEGSSAAFNEYSTLGDLLAHEAAVAVLEKHLPGISTNPMISMGKGLTLKQLAGIPQANIPEELISTIVTDLSVVRG,sabio,Q8GAT9,O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,0.27,37.0,6.5,3.2.1.45,58172.0,-0.5686362358410126,-0.5686362358410126,O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1__MAQLTLEEKAGLCSGESFWRTKAIDRLGIPSIMMTDGPHGLRKQAGEADHLGLNESIPATCFPTAAGLASSWDRELVRKVGEALGKESQAENVSILLGPGANIKRSPLCGRNFEYFSEDPYLTGELAAAHIAGVQSQGVGTSLKHFAVNNQEHRRMTTDAVVDERTLREIYLTGFEIAVKKSQPWTVMSAYNRMNGTYCSENETLLTRILKEEWGHEGIVVSDWGAVNEAAASVAAGMELEMPSSHGIGQRKIVAAVESGELSVEALDRAVTRLLTVIFKAVDSRKTDATYDKEAHHLLAREIARESMVLLKNEGNLLPLAKTGKLAIIGAMAEQVRYQGGGSSHIKPTKLDSIRDEIEKSARSAEIRYSKGYLLESDESDESLLNEAKQAAADSDVAVLFVGLPDRYESEGYDRTHLNLPANHIELIERIASVQPNVVVILSNGSPVVMPWLGHAKAVLEAYLGGQAAGGAIADLLFGDANPSGKLAETFPHSLKHNPSHPFYPGEGDRTEYREGIFVGYRYFDAKDIEPLFPFGHGLSYTAFSYSGLKLDKSEMTDRDIVQVRVNVKNTGGRFGKETVQLYVHSRNSSVIRPEKELKGFAKVSLNPEEEQTVTFALDKRSFAYYNAELKEWHAETGEYEILIGSSSRDIALRTALTVQSTTEIVPTFHRNTTLGELMENPATLPILAHLQSMAPQQQAQSDSVSPDMMMAMMRYMPLRALLPFTGGAMTEETLGMLLEQFNQAVRGEKNQPHASEGSSAAFNEYSTLGDLLAHEAAVAVLEKHLPGISTNPMISMGKGLTLKQLAGIPQANIPEELISTIVTDLSVVRG,./data/raw/alphafold//AF-Q8GAT9-F1-model_v4.pdb,2460,8059,9914,11092 +684,30248,30785,MSRIRTSLEVLSLGFGLFTAEALYSGNEHFYKDWFLPTARLLVRDGETAHNLSVYLASYGFIPHKQRNSFPQLKCKVFGLEFDHPIGLAAGFDKDGKAFMGLLNAGFSHIEVGTVTPNPQLGNARPRIFRWTEKEAVVNRCGFNSDGHDAVYERLKDRPWEGRGVIGVNLGCNKTSADPTADYVAGVRKFGEVADYLVINVSSPNTPGLRSLQTKEKLRDLLSKVLAARNQLSKKTPILLKISPDENDQNLKDIVEVALDSKTRIDGMIISNTTLTTYEEAVACGAAPIPGNNKQNVVYGGLSGRPLFEKSTDCLRKVSALTKGAIPLIGVGGISCGEDALSKLNAGASLVQLYTSFVYQGPPVAHKVAREINKLKMTS,brenda,G4VFD7,O=C(O)C1CC(O)=NC(O)=N1,0.23,25.0,8.2,1.3.5.2,6183.0,-0.6382721639824072,-0.6382721639824072,O=C(O)C1CC(O)=NC(O)=N1__MSRIRTSLEVLSLGFGLFTAEALYSGNEHFYKDWFLPTARLLVRDGETAHNLSVYLASYGFIPHKQRNSFPQLKCKVFGLEFDHPIGLAAGFDKDGKAFMGLLNAGFSHIEVGTVTPNPQLGNARPRIFRWTEKEAVVNRCGFNSDGHDAVYERLKDRPWEGRGVIGVNLGCNKTSADPTADYVAGVRKFGEVADYLVINVSSPNTPGLRSLQTKEKLRDLLSKVLAARNQLSKKTPILLKISPDENDQNLKDIVEVALDSKTRIDGMIISNTTLTTYEEAVACGAAPIPGNNKQNVVYGGLSGRPLFEKSTDCLRKVSALTKGAIPLIGVGGISCGEDALSKLNAGASLVQLYTSFVYQGPPVAHKVAREINKLKMTS,./data/raw/alphafold//AF-G4VFD7-F1-model_v4.pdb,5433,3471,4733,4991 +685,29434,29957,MHFRRCIRKYCINKKIVNPFEHVQRTLNEKNYYYYDINELHDSRIKSLPYSIRVLLESAVRNCDNLKVSEKNVETILGWKENCKKKKEVPFMPTRVLLQDLTGVPCIVDLATMRDTAEKLGCDAERINPLIPVDLVIDHSVQVDYSRREDALELNEKKEYERNLERFKFLKWGMNSFKNMLILPPGSGIVHQINLEYLAHCVFNKDNLLYPDSVVGTDSHTTMINGLGILGWGVGGIEAEATMLGLPISMTLPEVVGINVVGKLSDYLLSTDIVLYITSFLRKEVGVVNKYVEFFGTGLKDLKLADRATISNMAPEYGATVGFFPVDDITLEYLLQTGRDKEKVELIREYLMKNSMFNTYKDNVEYTDVYTLDLSKLNLSLSGPKRPHDNVLLSELHKDFTMCLESPIGFKGYNIAKEEREKKISFVCSKDGKEYVLSQGSVVLCAITSCTNTSNSSSMIAAGLLAKKAIEEFGLKSLPYIKSSLSPGSKTVQKYLEAGGLLKYLEQLGFYNVGYGCMTCIGNSGHLDEEVEEVINKNDLIVSSVLSGNRNFEGRVHPLIKANYLASPVLVVLFSIIGNVNVDLSNYTFNYKGKKINALDLIPRKEEIEEYESTYIKPEMYTEIYKNIKYVNKYWNDIQIKKNKLYEWDKNSTYIHKPPYFENMTLEIEKIQDIKDAHVLLFLGDSITTDHISPAGMIHKTSEAYKFLKTKNIKDQDLNTYGARRGNDEVMIRGTFANIRLINKLCPDKGPNTIHIPTNQLMSVYQAAMKYKQDNIDVIIIAGKEYGCGSSRDWAAKGPNLLGVKAVIAESYERIHRSNLIGMSVLPLQFINNQSPQYYNMDGTEKFTILLNDGNIKAQQTIKVQMNQKGKIIIFDVLCRIDTEIEERYFRNGGILKYVLRSLVNEANK,uniprot_search,Q9Y007,O=C(O)/C=C(/CC(=O)O)C(=O)O,0.0035,37.0,7.4,4.2.1.3,5833.0,-2.4559319556497243,-2.4559319556497243,O=C(O)/C=C(/CC(=O)O)C(=O)O__MHFRRCIRKYCINKKIVNPFEHVQRTLNEKNYYYYDINELHDSRIKSLPYSIRVLLESAVRNCDNLKVSEKNVETILGWKENCKKKKEVPFMPTRVLLQDLTGVPCIVDLATMRDTAEKLGCDAERINPLIPVDLVIDHSVQVDYSRREDALELNEKKEYERNLERFKFLKWGMNSFKNMLILPPGSGIVHQINLEYLAHCVFNKDNLLYPDSVVGTDSHTTMINGLGILGWGVGGIEAEATMLGLPISMTLPEVVGINVVGKLSDYLLSTDIVLYITSFLRKEVGVVNKYVEFFGTGLKDLKLADRATISNMAPEYGATVGFFPVDDITLEYLLQTGRDKEKVELIREYLMKNSMFNTYKDNVEYTDVYTLDLSKLNLSLSGPKRPHDNVLLSELHKDFTMCLESPIGFKGYNIAKEEREKKISFVCSKDGKEYVLSQGSVVLCAITSCTNTSNSSSMIAAGLLAKKAIEEFGLKSLPYIKSSLSPGSKTVQKYLEAGGLLKYLEQLGFYNVGYGCMTCIGNSGHLDEEVEEVINKNDLIVSSVLSGNRNFEGRVHPLIKANYLASPVLVVLFSIIGNVNVDLSNYTFNYKGKKINALDLIPRKEEIEEYESTYIKPEMYTEIYKNIKYVNKYWNDIQIKKNKLYEWDKNSTYIHKPPYFENMTLEIEKIQDIKDAHVLLFLGDSITTDHISPAGMIHKTSEAYKFLKTKNIKDQDLNTYGARRGNDEVMIRGTFANIRLINKLCPDKGPNTIHIPTNQLMSVYQAAMKYKQDNIDVIIIAGKEYGCGSSRDWAAKGPNLLGVKAVIAESYERIHRSNLIGMSVLPLQFINNQSPQYYNMDGTEKFTILLNDGNIKAQQTIKVQMNQKGKIIIFDVLCRIDTEIEERYFRNGGILKYVLRSLVNEANK,./data/raw/alphafold//AF-Q9Y007-F1-model_v4.pdb,1702,7084,8959,9223 +687,18242,18506,MSWSPSLTTQTCGAWEMKERLGTGGFGNVIRWHNQETGEQIAIKQCRQELSPRNRERWCLEIQIMRRLTHPNVVAARDVPEGMQNLAPNDLPLLAMEYCQGGDLRKYLNQFENCCGLREGAILTLLSDIASALRYLHENRIIHRDLKPENIVLQQGEQRLIHKIIDLGYAKELDQGSLCTSFVGTLQYLAPELLEQQKYTVTVDYWSFGTLAFECITGFRPFLPNWQPVQWHSKVRQKSEVDIVVSEDLNGTVKFSSSLPYPNNLNSVLAERLEKWLQLMLMWHPRQRGTDPTYGPNGCFKALDDILNLKLVHILNMVTGTIHTYPVTEDESLQSLKARIQQDTGIPEEDQELLQEAGLALIPDKPATQCISDGKLNEGHTLDMDLVFLFDNSKITYETQISPRPQPESVSCILQEPKRNLAFFQLRKVWGQVWHSIQTLKEDCNRLQQGQRAAMMNLLRNNSCLSKMKNSMASMSQQLKAKLDFFKTSIQIDLEKYSEQTEFGITSDKLLLAWREMEQAVELCGRENEVKLLVERMMALQTDIVDLQRSPMGRKQGGTLDDLEEQARELYRRLREKPRDQRTEGDSQEMVRLLLQAIQSFEKKVRVIYTQLSKTVVCKQKALELLPKVEEVVSLMNEDEKTVVRLQEKRQKELWNLLKIACSKVRGPVSGSPDSMNASRLSQPGQLMSQPSTASNSLPEPAKKSEELVAEAHNLCTLLENAIQDTVREQDQSFTALDWSWLQTEEEEHSCLEQAS,sabio,O14920,Cc1nc(N)nc(N)c1OCCCOc1cc(Cl)c(Cl)cc1Cl,0.00075,25.0,7.6,2.7.11.10,9606.0,-3.1249387366083,-3.1249387366083,Cc1nc(N)nc(N)c1OCCCOc1cc(Cl)c(Cl)cc1Cl__MSWSPSLTTQTCGAWEMKERLGTGGFGNVIRWHNQETGEQIAIKQCRQELSPRNRERWCLEIQIMRRLTHPNVVAARDVPEGMQNLAPNDLPLLAMEYCQGGDLRKYLNQFENCCGLREGAILTLLSDIASALRYLHENRIIHRDLKPENIVLQQGEQRLIHKIIDLGYAKELDQGSLCTSFVGTLQYLAPELLEQQKYTVTVDYWSFGTLAFECITGFRPFLPNWQPVQWHSKVRQKSEVDIVVSEDLNGTVKFSSSLPYPNNLNSVLAERLEKWLQLMLMWHPRQRGTDPTYGPNGCFKALDDILNLKLVHILNMVTGTIHTYPVTEDESLQSLKARIQQDTGIPEEDQELLQEAGLALIPDKPATQCISDGKLNEGHTLDMDLVFLFDNSKITYETQISPRPQPESVSCILQEPKRNLAFFQLRKVWGQVWHSIQTLKEDCNRLQQGQRAAMMNLLRNNSCLSKMKNSMASMSQQLKAKLDFFKTSIQIDLEKYSEQTEFGITSDKLLLAWREMEQAVELCGRENEVKLLVERMMALQTDIVDLQRSPMGRKQGGTLDDLEEQARELYRRLREKPRDQRTEGDSQEMVRLLLQAIQSFEKKVRVIYTQLSKTVVCKQKALELLPKVEEVVSLMNEDEKTVVRLQEKRQKELWNLLKIACSKVRGPVSGSPDSMNASRLSQPGQLMSQPSTASNSLPEPAKKSEELVAEAHNLCTLLENAIQDTVREQDQSFTALDWSWLQTEEEEHSCLEQAS,./data/raw/alphafold//AF-O14920-F1-model_v4.pdb,3859,4467,5935,3308 +689,10624,10780,MKDFFLFLGKFFKHGTAIASLAPSSPWLSRTTVRNIPWENARVVVELGAGTGPITKVIADRVHPDCRVIVLERDPDFARLLRERFANRANFDVVEGDVRDLTQILQQRGIEQADFVVSGLPVPSFPKELQRDLFRVVKQVLAPSGTFNQITEMPWVYQRFYRRFFDEVTFVFEPRNLPPAGAYFCRGVKESF,brenda,L0D9B6,CCCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCCCC)CC(O)=N[C@@H](CCCN)C(=O)O,0.0377,28.0,8.0,2.1.1.344,466153.0,-1.4236586497942072,-1.4236586497942072,CCCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCCCC)CC(O)=N[C@@H](CCCN)C(=O)O__MKDFFLFLGKFFKHGTAIASLAPSSPWLSRTTVRNIPWENARVVVELGAGTGPITKVIADRVHPDCRVIVLERDPDFARLLRERFANRANFDVVEGDVRDLTQILQQRGIEQADFVVSGLPVPSFPKELQRDLFRVVKQVLAPSGTFNQITEMPWVYQRFYRRFFDEVTFVFEPRNLPPAGAYFCRGVKESF,./data/raw/alphafold//AF-L0D9B6-F1-model_v4.pdb,5460,3124,3860,4490 +698,29281,29804,MVDKAVSEFWQNIPAIANPFKPDALPEAYIPNAATDDERYYVPFTETVSSRPLWISPSQNKWCDILMAKEAGLVNRHYHPHEVFAYTLSGKWGYLEHEWTATRGDFVYETPGEGHTLVAFDHPEPMRAFFIVTGPLIWLDEEGNPDGYFDVHSYIAMCKAHYEKVGLGAQAIEKLFR,brenda,F7J5X4,O=C(CO)c1ccc(O)cc1,0.0016,25.0,7.0,1.13.11.41,36773.0,-2.7958800173440754,-2.7958800173440754,O=C(CO)c1ccc(O)cc1__MVDKAVSEFWQNIPAIANPFKPDALPEAYIPNAATDDERYYVPFTETVSSRPLWISPSQNKWCDILMAKEAGLVNRHYHPHEVFAYTLSGKWGYLEHEWTATRGDFVYETPGEGHTLVAFDHPEPMRAFFIVTGPLIWLDEEGNPDGYFDVHSYIAMCKAHYEKVGLGAQAIEKLFR,./data/raw/alphafold//AF-F7J5X4-F1-model_v4.pdb,1682,7058,8924,9179 +729,10114,10268,MAKVMRLIIFVCVALVAISVPAASSVQSQQERIRPGFRQQLPSSIRPFSAFRRRGQEASDSVVYLNIVYLRLVGTRQCATGELTVVVHGKALNNATLGDVQTSLTRTFASSLKEPSSTLAIRRWSWKDPLFLMLTLNRRAVRTGTGLPRSTPLYQVAKQRLFVFVRKPTPTSSCRRAALDPRPLYGVPKVGVQDKYTLHVSMDVLGMSLREPLEHQEEEPGPASVSTYAAAQAILDGASSFGIGAFGSAKPNLKQISMYASGAELEKQVYTPTTSQLALFLPSKTFFGVEVTSVSDGTFRIPVSASRLVPFSAMSYMCTGSQTHKLTQTGMNVLEKRVHGKENPPSEGAEVLLNLLAARKPVNGVFEQDPTVVLLQLWRTPEGSESWQETPLMWEFPDTLEAIEDAGEYRSGILSSIAANTRIIGKMAGWLASRSFSRRFIRTLIRLNNIDLEEAFSMSDKDRRHSAADFRSVQEFFTRPINYHVYRDMDPRASIMAPADSLIQNIYTIRPDFKGEISHPIIPQVKSTSFNLREFLYGARQVPPLQLQSPSNRLFVSILYLAPSDYHRVHSPADWRVTSQTYIPGCTPSVSRRNLEAGDLLHRYERTALIGHWDPEKNGQQLFFSVTMVAAMFVGGLRLSWEEEPLGASMRLGRCTRYTESYEKQVDVELCASQEIGAFRFGSTVVMIFEAPEDFDMTSVGQCSHVAAGQPAGYLGQGRERPLQERCNAFRGNFESPFHFWKHLQKTSSVDDILKQNTLAPRAWRQEPGRVWAEVLRATERGLLYGFALSHYLLKRWATENGNLGELVLGQPEVLRQNINGSDSVIREGFRCFAAKDKKQIRLQMSGRQSQVSLTATVTPDEQFLFQHPFYGCVGDEKLGKLVRGIDATWILLPERAVLLTLKVSTGSKQEDGRVLRVATTKIEVQTEPCQGGWEESRVGTTSTTCAIRTVEKREESISEGVLTNGDL,sabio,F6N7K6,CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](N)C(=O)O)OC(=O)CCCCCCC/C=C\CCCCCCCC,0.067,37.0,6.8,4.1.1.65,5811.0,-1.1739251972991736,-1.1739251972991736,CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](N)C(=O)O)OC(=O)CCCCCCC/C=C\CCCCCCCC__MAKVMRLIIFVCVALVAISVPAASSVQSQQERIRPGFRQQLPSSIRPFSAFRRRGQEASDSVVYLNIVYLRLVGTRQCATGELTVVVHGKALNNATLGDVQTSLTRTFASSLKEPSSTLAIRRWSWKDPLFLMLTLNRRAVRTGTGLPRSTPLYQVAKQRLFVFVRKPTPTSSCRRAALDPRPLYGVPKVGVQDKYTLHVSMDVLGMSLREPLEHQEEEPGPASVSTYAAAQAILDGASSFGIGAFGSAKPNLKQISMYASGAELEKQVYTPTTSQLALFLPSKTFFGVEVTSVSDGTFRIPVSASRLVPFSAMSYMCTGSQTHKLTQTGMNVLEKRVHGKENPPSEGAEVLLNLLAARKPVNGVFEQDPTVVLLQLWRTPEGSESWQETPLMWEFPDTLEAIEDAGEYRSGILSSIAANTRIIGKMAGWLASRSFSRRFIRTLIRLNNIDLEEAFSMSDKDRRHSAADFRSVQEFFTRPINYHVYRDMDPRASIMAPADSLIQNIYTIRPDFKGEISHPIIPQVKSTSFNLREFLYGARQVPPLQLQSPSNRLFVSILYLAPSDYHRVHSPADWRVTSQTYIPGCTPSVSRRNLEAGDLLHRYERTALIGHWDPEKNGQQLFFSVTMVAAMFVGGLRLSWEEEPLGASMRLGRCTRYTESYEKQVDVELCASQEIGAFRFGSTVVMIFEAPEDFDMTSVGQCSHVAAGQPAGYLGQGRERPLQERCNAFRGNFESPFHFWKHLQKTSSVDDILKQNTLAPRAWRQEPGRVWAEVLRATERGLLYGFALSHYLLKRWATENGNLGELVLGQPEVLRQNINGSDSVIREGFRCFAAKDKKQIRLQMSGRQSQVSLTATVTPDEQFLFQHPFYGCVGDEKLGKLVRGIDATWILLPERAVLLTLKVSTGSKQEDGRVLRVATTKIEVQTEPCQGGWEESRVGTTSTTCAIRTVEKREESISEGVLTNGDL,./data/raw/alphafold//AF-F6N7K6-F1-model_v4.pdb,5525,3065,3791,4405 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+907,29688,30215,MGFADQRFNVNLSILFTELPLLERPAAAAAAGFTAVELWWPWIDSPTPEQSELDALKSAIEDAGVQLTGLNFYAGQLPGPDRGALSIPGEESERFRANIDVAADFARSLGCTALNALYGNRVEGVDPAEQDRLALENLVLAARAADRIGAVLLVEALNKPESPRYPLVSAPAAIAVVDRVNEATGLGNAKFLMDLYHLSMNGEDLPQVIDAYAAKTGHVQIADNPGRGAPGTGSLPLEDLLDRLAKAGYDGWVGLEYKPGDDPSAQSFSWLPAGARAAR,brenda,Q9Z596,O=C(O)C(=O)CO,55.0,30.0,7.0,5.3.1.22,1902.0,1.740362689494244,1.740362689494244,O=C(O)C(=O)CO__MGFADQRFNVNLSILFTELPLLERPAAAAAAGFTAVELWWPWIDSPTPEQSELDALKSAIEDAGVQLTGLNFYAGQLPGPDRGALSIPGEESERFRANIDVAADFARSLGCTALNALYGNRVEGVDPAEQDRLALENLVLAARAADRIGAVLLVEALNKPESPRYPLVSAPAAIAVVDRVNEATGLGNAKFLMDLYHLSMNGEDLPQVIDAYAAKTGHVQIADNPGRGAPGTGSLPLEDLLDRLAKAGYDGWVGLEYKPGDDPSAQSFSWLPAGARAAR,./data/raw/alphafold//AF-Q9Z596-F1-model_v4.pdb,1729,7121,9005,9281 +915,27609,28088,MALPAFAARALGPPLQPEQGAPARTTCPRRHSRVEAELAASRPGSVAASVRAGPPRGVSLGFNSPPLQDKPPKAFSSLAGALRAPLFALLPRGRRRRMHDLRRRWDLGSLCRALLTRGLAAVGHSLKHVLSAIFSKIFGPLASVGNMDEKSNKLLLALVMLFLFAVIVLQYVCPGTECQLLRLQAFSSPVPDPYRSEDESSARFVPRYNFSRGDLLRKVDFDIKGDDLIVFLHIQKTGGTTFGRHLVRNIQLEQPCECRVGQKKCTCHRPGKRETWLFSRFSTGWSCGLHADWTELTSCVPAVVDGKRDARLRPSRNFHYITILRDPVSRYLSEWRHVQRGATWKASLHVCDGRPPTSEELPSCYTGDDWSGCPLKEFMDCPYNLANNRQVRMLSDLTLVGCYNLSVMPEKQRNKVLLESAKSNLKHMAFFGLTEFQRKTQYLFEKTFNMNFISPFTQYNTTRASSVEINEEIQKRIEGLNFLDMELYSYAKDLFLQRYQFMRQKEHQDARRKRQEQRKFLKGRFLQTHFQSQSQGQSQSQSPGQNLSQNPNPNPNQNLTQNLSHNLTPSSNPNSTQRENRGSQKQGSGQGQGDSGTSNGTNDYIGSVETWR,sabio,Q80UW0,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O,0.0002399999999999,37.0,6.8,2.8.2.-,10090.0,-3.619788758288575,-3.619788758288575,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O__MALPAFAARALGPPLQPEQGAPARTTCPRRHSRVEAELAASRPGSVAASVRAGPPRGVSLGFNSPPLQDKPPKAFSSLAGALRAPLFALLPRGRRRRMHDLRRRWDLGSLCRALLTRGLAAVGHSLKHVLSAIFSKIFGPLASVGNMDEKSNKLLLALVMLFLFAVIVLQYVCPGTECQLLRLQAFSSPVPDPYRSEDESSARFVPRYNFSRGDLLRKVDFDIKGDDLIVFLHIQKTGGTTFGRHLVRNIQLEQPCECRVGQKKCTCHRPGKRETWLFSRFSTGWSCGLHADWTELTSCVPAVVDGKRDARLRPSRNFHYITILRDPVSRYLSEWRHVQRGATWKASLHVCDGRPPTSEELPSCYTGDDWSGCPLKEFMDCPYNLANNRQVRMLSDLTLVGCYNLSVMPEKQRNKVLLESAKSNLKHMAFFGLTEFQRKTQYLFEKTFNMNFISPFTQYNTTRASSVEINEEIQKRIEGLNFLDMELYSYAKDLFLQRYQFMRQKEHQDARRKRQEQRKFLKGRFLQTHFQSQSQGQSQSQSPGQNLSQNPNPNPNQNLTQNLSHNLTPSSNPNSTQRENRGSQKQGSGQGQGDSGTSNGTNDYIGSVETWR,./data/raw/alphafold//AF-Q80UW0-F1-model_v4.pdb,1395,6647,6168,11887 +918,35790,36417,MAIALWYCPPQGSVAYETLQMLIFSFQTLFPDSPVFEPHVTVTSHLVCNSKDDVNKILTSCVAAIQSIRSHQTAKKGRKGQVSHAVAAPLVSFNGCSVGKQYFKKIVLECNKNKILYGVAQVMREMYVEIDPETRSSRAATWVHEEFHPHVSLLYSDIHPVSQASLRVVQQRIEDALDVQLVPREKRKGSGNADGSNEVQMRWDFDVSSSLSWNIPGTFKVVNCVGPVQEWEVLGRVDV,sabio,P53314,O=P1([O-])OC2O[C@H](CO)[C@@H](O1)[C@H]2O,0.33,37.0,7.0,3.1.4.-,4932.0,-0.4814860601221125,-0.4814860601221125,O=P1([O-])OC2O[C@H](CO)[C@@H](O1)[C@H]2O__MAIALWYCPPQGSVAYETLQMLIFSFQTLFPDSPVFEPHVTVTSHLVCNSKDDVNKILTSCVAAIQSIRSHQTAKKGRKGQVSHAVAAPLVSFNGCSVGKQYFKKIVLECNKNKILYGVAQVMREMYVEIDPETRSSRAATWVHEEFHPHVSLLYSDIHPVSQASLRVVQQRIEDALDVQLVPREKRKGSGNADGSNEVQMRWDFDVSSSLSWNIPGTFKVVNCVGPVQEWEVLGRVDV,./data/raw/alphafold//AF-P53314-F1-model_v4.pdb,2344,7919,9744,10910 +933,36087,36715,MGNGMNKILPGLYIGNFKDARDAEQLSKNKVTHILSVHDSARPMLEGVKYLCIPAADSPSQNLTRHFKESIKFIHECRLRGESCLVHCLAGVSRSVTLVIAYIMTVTDFGWEDALHTVRAGRSCANPNVGFQRQLQEFEKHEVHQYRQWLKEEYGESPLQDAEEAKNILAAPGILKFWAFLRRL,sabio,Q9NRW4,O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,0.412,30.0,6.0,3.1.3.48,9606.0,-0.3851027839668654,-0.3851027839668654,O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MGNGMNKILPGLYIGNFKDARDAEQLSKNKVTHILSVHDSARPMLEGVKYLCIPAADSPSQNLTRHFKESIKFIHECRLRGESCLVHCLAGVSRSVTLVIAYIMTVTDFGWEDALHTVRAGRSCANPNVGFQRQLQEFEKHEVHQYRQWLKEEYGESPLQDAEEAKNILAAPGILKFWAFLRRL,./data/raw/alphafold//AF-Q9NRW4-F1-model_v4.pdb,2386,7976,9814,10983 +955,14975,15188,MRRAVLEILEERIIHNVKEIHRFSGKRIIAVVKANAYGIGVREVSRILEGLEEVDAFAVACTQEGVELRECGIKKKILILGGILEEDVKLLEEYDLTPVISDPEHLKVLKDRNIKFHVKYDTGMGRLGFTNEIIKDPRVEGVMSHFSSPADRNFSKLQIKRFEEILKNYEKVKYIHLESSAGLIYRVPFTTHVRVGLAIYGEKPLKDYPLEVKPALRLRARLISVKELPENYPVSYGRTYITKRKTKLGVVAFGYADGLMKTLSNRSFLIFEGRKVPIIGNITMDMTMVDLSGTEARTGDWVYIVNEERSFTPLARDAGTIPYEIMCNLSRRVERLVIKKR,uniprot_search,Q9RER4,C[C@@H](N)C(=O)O,1.8,90.0,9.5,5.1.1.1,2714.0,0.255272505103306,0.255272505103306,C[C@@H](N)C(=O)O__MRRAVLEILEERIIHNVKEIHRFSGKRIIAVVKANAYGIGVREVSRILEGLEEVDAFAVACTQEGVELRECGIKKKILILGGILEEDVKLLEEYDLTPVISDPEHLKVLKDRNIKFHVKYDTGMGRLGFTNEIIKDPRVEGVMSHFSSPADRNFSKLQIKRFEEILKNYEKVKYIHLESSAGLIYRVPFTTHVRVGLAIYGEKPLKDYPLEVKPALRLRARLISVKELPENYPVSYGRTYITKRKTKLGVVAFGYADGLMKTLSNRSFLIFEGRKVPIIGNITMDMTMVDLSGTEARTGDWVYIVNEERSFTPLARDAGTIPYEIMCNLSRRVERLVIKKR,./data/raw/alphafold//AF-Q9RER4-F1-model_v4.pdb,488,3748,5100,5419 +965,32823,33408,MSSLNQLVSGLASGAVRIVDLTHTLDPDFPVIVLPPEFGQCARFRMEEISAYDHRGPAWKWHNISMSEHTGTHFDAPSHWISGKDVPNGSVDEIPAEAFVGPVVVIDCSKGAAENDDFELTPEIIAGWESEHGRIPEDAWVLMRTDWSKRRGADYLNMRADGPHSPGPTPEAIRFLIEERNIRGFGTETVGTDAGQGAHYVPPYPAHYLLHGAGKYGLQCLANLDQLPATGAVLIAAPLKIKNGTGSPLRVLAMVTE,brenda,A0P0F0,O=C1Nc2ccccc2C1=O,0.0157,40.0,8.15,3.5.2.20,187304.0,-1.8041003475907664,-1.8041003475907664,O=C1Nc2ccccc2C1=O__MSSLNQLVSGLASGAVRIVDLTHTLDPDFPVIVLPPEFGQCARFRMEEISAYDHRGPAWKWHNISMSEHTGTHFDAPSHWISGKDVPNGSVDEIPAEAFVGPVVVIDCSKGAAENDDFELTPEIIAGWESEHGRIPEDAWVLMRTDWSKRRGADYLNMRADGPHSPGPTPEAIRFLIEERNIRGFGTETVGTDAGQGAHYVPPYPAHYLLHGAGKYGLQCLANLDQLPATGAVLIAAPLKIKNGTGSPLRVLAMVTE,./data/raw/alphafold//AF-A0P0F0-F1-model_v4.pdb,2035,7576,6261,9942 +998,10915,11071,MATLFIADLHLCVEEPAITAGFLRFLAGEARKADALYILGDLFEAWIGDDDPNPLHRKMAAAIKAVSDSGVPCYFIHGNRDFLLGKRFARESGMTLLPEEKVLELYGRRVLIMHGDTLCTDDAGYQAFRAKVHKPWLQTLFLALPLFVRKRIAARMRANSKEANSSKSLAIMDVNQNAVVSAMEKHQVQWLIHGHTHRPAVHELIANQQPAFRVVLGAWHTEGSMVKVTADDVELIHFPF,brenda,P43341,CCCCCCCCCCC[C@@H](O)CC(=O)O[C@H]1[C@H](O)[C@@H](CO)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)[C@@H]1N=C(O)C[C@H](O)CCCCCCCCCCC,0.0617,30.0,8.0,3.6.1.54,562.0,-1.2097148359667584,-1.2097148359667584,CCCCCCCCCCC[C@@H](O)CC(=O)O[C@H]1[C@H](O)[C@@H](CO)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)[C@@H]1N=C(O)C[C@H](O)CCCCCCCCCCC__MATLFIADLHLCVEEPAITAGFLRFLAGEARKADALYILGDLFEAWIGDDDPNPLHRKMAAAIKAVSDSGVPCYFIHGNRDFLLGKRFARESGMTLLPEEKVLELYGRRVLIMHGDTLCTDDAGYQAFRAKVHKPWLQTLFLALPLFVRKRIAARMRANSKEANSSKSLAIMDVNQNAVVSAMEKHQVQWLIHGHTHRPAVHELIANQQPAFRVVLGAWHTEGSMVKVTADDVELIHFPF,./data/raw/alphafold//AF-P43341-F1-model_v4.pdb,5397,3175,3916,4560 +1004,20349,20656,MLPVKNLFVLYTGGTIGMLETPRGLAPAGGFETRMRDHLRTLGDAPDLRWRFAELQPPLDSANMSQGNWLAMRDAIVAALDAGHDGVLLLHGTDTLAYSAAALSFLLLDLPVPVLLTGSMLPAGAPGSDAWDNLVGALRVLQAGHARGVQVYFNDALLHGARVSKLRSDAFDAFAELPRPRQAEHAPVPATLGYRQPRREVNLAVLPLYPGLRAAHLRGLLDSGVEALLLECYGSGTGPSDDEELLAALREAHARGVLLAAVSQCAYGAVEFGVYAAGSRLRDAGLVSAGGMTREAALGKLFGLLGAGLGRDDAQRWFALDLCGENAD,brenda,A0A0U3U5E8,N=C(O)C[C@H](N)C(=O)O,63.3,37.0,7.5,3.5.1.1,287.0,1.801403710017355,1.801403710017355,N=C(O)C[C@H](N)C(=O)O__MLPVKNLFVLYTGGTIGMLETPRGLAPAGGFETRMRDHLRTLGDAPDLRWRFAELQPPLDSANMSQGNWLAMRDAIVAALDAGHDGVLLLHGTDTLAYSAAALSFLLLDLPVPVLLTGSMLPAGAPGSDAWDNLVGALRVLQAGHARGVQVYFNDALLHGARVSKLRSDAFDAFAELPRPRQAEHAPVPATLGYRQPRREVNLAVLPLYPGLRAAHLRGLLDSGVEALLLECYGSGTGPSDDEELLAALREAHARGVLLAAVSQCAYGAVEFGVYAAGSRLRDAGLVSAGGMTREAALGKLFGLLGAGLGRDDAQRWFALDLCGENAD,./data/raw/alphafold//AF-A0A0U3U5E8-F1-model_v4.pdb,4209,5107,7013,7018 +1029,25004,25394,MPYLQPPRPHPHPHPTSRLSRASPPSPFPFFPAGTSRSGRLQPVPVSGHSASRVSKGKFAVAAVTLDDYLPMRSTEVKNRTSTDGIKSLRLITAVKTPYLPDGRFDLEAYDSLINTQINGGAEGVIVGGTTGEGHLMSWDEHIMLIGHTVNCFGANIKVIGNTGSNSTREAVHATEQGFAVGMHAALHVNPYYGKTSTEGLISHFKEVLPMGPTIIYNVPSRTSQDIPPPVIEALSSYSNMAGVKECVGHERVKCYTDKGISIWSGNDDECHDSRWKYGATGVISVASNLVPGLMHSLMFEGENAALNEKLLPLMKWLFCEPNPIGLNTALAQLGVVRPVFRLPYTPLPLEKRVEFVRIVEAIGRENFVGQKESRVLDDDDFVLISRY,brenda,P24846,N[C@@H](CC=O)C(=O)O,0.07,30.0,8.0,4.3.3.7,4565.0,-1.154901959985743,-1.154901959985743,N[C@@H](CC=O)C(=O)O__MPYLQPPRPHPHPHPTSRLSRASPPSPFPFFPAGTSRSGRLQPVPVSGHSASRVSKGKFAVAAVTLDDYLPMRSTEVKNRTSTDGIKSLRLITAVKTPYLPDGRFDLEAYDSLINTQINGGAEGVIVGGTTGEGHLMSWDEHIMLIGHTVNCFGANIKVIGNTGSNSTREAVHATEQGFAVGMHAALHVNPYYGKTSTEGLISHFKEVLPMGPTIIYNVPSRTSQDIPPPVIEALSSYSNMAGVKECVGHERVKCYTDKGISIWSGNDDECHDSRWKYGATGVISVASNLVPGLMHSLMFEGENAALNEKLLPLMKWLFCEPNPIGLNTALAQLGVVRPVFRLPYTPLPLEKRVEFVRIVEAIGRENFVGQKESRVLDDDDFVLISRY,./data/raw/alphafold//AF-P24846-F1-model_v4.pdb,1017,6119,7911,10468 +1041,30370,30907,MSSEKPETITHVGCNRFGFDSTVDIETLRSLYLSPAYIKEGGDVKVSLDAPQKDFSTETTYDHNTNTIQYSTVNKFPPVKLLPNHERKRILVTGGAGFVGSHLVDRLMLLGHEVTVLDNFFTGSRTTVSHWIGHPNFEMVRHDVVEPFLIEVDQIYHLACPASPPHYQINAVKTLKTSFEGTLNMLGLAKRTGARFLITSTSEVYGDPEEHPQREDYWGHVNCIGPRACYDEGKRVAETLTYGYHRKDGVEVRVARIFNTFGPRMNPYDGRVVSNFIIQALKGEDMTVYGDGSQTRSFQYVHDLIDGLILLMNGPDTRPVNIGNGDEFTILEFAEAVRDIVEKVQKEEGNPLAKRVNIIHKEIPIDDPQRRRPDTTRAKESLQWQPRWNVRQGVEEMVRYYSARIREGAI,sabio,Q96V00,O=C(O)C1OC(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)C(O)C(O)C1O,0.7,23.0,7.4,4.1.1.35,5207.0,-0.1549019599857432,-0.1549019599857432,O=C(O)C1OC(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)C(O)C(O)C1O__MSSEKPETITHVGCNRFGFDSTVDIETLRSLYLSPAYIKEGGDVKVSLDAPQKDFSTETTYDHNTNTIQYSTVNKFPPVKLLPNHERKRILVTGGAGFVGSHLVDRLMLLGHEVTVLDNFFTGSRTTVSHWIGHPNFEMVRHDVVEPFLIEVDQIYHLACPASPPHYQINAVKTLKTSFEGTLNMLGLAKRTGARFLITSTSEVYGDPEEHPQREDYWGHVNCIGPRACYDEGKRVAETLTYGYHRKDGVEVRVARIFNTFGPRMNPYDGRVVSNFIIQALKGEDMTVYGDGSQTRSFQYVHDLIDGLILLMNGPDTRPVNIGNGDEFTILEFAEAVRDIVEKVQKEEGNPLAKRVNIIHKEIPIDDPQRRRPDTTRAKESLQWQPRWNVRQGVEEMVRYYSARIREGAI,./data/raw/alphafold//AF-Q96V00-F1-model_v4.pdb,1786,7223,9155,9477 +1067,25486,25896,MKHNLQDNLQGEQMANTNSNGGKKPFSDAKIIERANLLRDNDLYFFFRAIEETEASTVTVKGKKQIMIGSNNYLGLTHHPAVKEAAIKAVEKYGTGCTGSRFLNGNLNIHEELDEKLAAYLGHEKAIVFSTGMQANLGALSAICGPKDLMLFDSENHASIIDASRLSLGTTFKYKHNDMASLEELLESNMSRFNRVIIVADGVFSMTGDILRLPEVVKLAKKYGAYVYVDDAHGLGVMGPQGRGTMAHFDVTKDVDFNMGTFSKSFASIGGVISGSKDAIDYVRHSARSFMFSASMPPAAVATVSACIDVVQNDETILNNLWSNVEFMRNGFKELGFFTYGSQTPIIPLFIGDDMKALKMTKWLESKGVFCTPVLPPAVPKGETLIRTSYMASHNREDLSTVLEVFAEAKKIFDIPNHLH,brenda,A7BFV8,N[C@@H](CO)C(=O)O,3.7,,,2.3.1.50,960.0,0.568201724066995,0.568201724066995,N[C@@H](CO)C(=O)O__MKHNLQDNLQGEQMANTNSNGGKKPFSDAKIIERANLLRDNDLYFFFRAIEETEASTVTVKGKKQIMIGSNNYLGLTHHPAVKEAAIKAVEKYGTGCTGSRFLNGNLNIHEELDEKLAAYLGHEKAIVFSTGMQANLGALSAICGPKDLMLFDSENHASIIDASRLSLGTTFKYKHNDMASLEELLESNMSRFNRVIIVADGVFSMTGDILRLPEVVKLAKKYGAYVYVDDAHGLGVMGPQGRGTMAHFDVTKDVDFNMGTFSKSFASIGGVISGSKDAIDYVRHSARSFMFSASMPPAAVATVSACIDVVQNDETILNNLWSNVEFMRNGFKELGFFTYGSQTPIIPLFIGDDMKALKMTKWLESKGVFCTPVLPPAVPKGETLIRTSYMASHNREDLSTVLEVFAEAKKIFDIPNHLH,./data/raw/alphafold//AF-A7BFV8-F1-model_v4.pdb,3832,6236,8063,12008 +1071,30263,30800,MRTKRVFHAVDSHTEGMPTRVITGGVGVIPGSTMAERREHFLAEMDHVRTLLMYEPRGHSAMSGAILQPPTRPDADYGVLYIEVSGCLPMCGHGTIGVATVLVETGMVEVVEPVTTIRLDTPAGLVVAEVRVEDGAATAVTITNVPSFSAGLDRTVKVPGIGEVTYDLAYGGNFYAILPIESVGLPFDRAHKQQILDAGLAIMDAINEQDEPVHPLDAGIRGCHHVQFTAPGSDARHSRHAMAIHPGWFDRSPCGTGTSARMAQLHARGELPLDTDFVNESFIGTRFVGRLVEETEVTDLPAVVPTITGRAWVTGTAQYFLDPRDPFPEGFLL,sabio,D2AV87,O=C(O)C1CC(O)CN1,7.8,25.0,8.0,5.1.1.8,2001.0,0.8920946026904804,0.8920946026904804,O=C(O)C1CC(O)CN1__MRTKRVFHAVDSHTEGMPTRVITGGVGVIPGSTMAERREHFLAEMDHVRTLLMYEPRGHSAMSGAILQPPTRPDADYGVLYIEVSGCLPMCGHGTIGVATVLVETGMVEVVEPVTTIRLDTPAGLVVAEVRVEDGAATAVTITNVPSFSAGLDRTVKVPGIGEVTYDLAYGGNFYAILPIESVGLPFDRAHKQQILDAGLAIMDAINEQDEPVHPLDAGIRGCHHVQFTAPGSDARHSRHAMAIHPGWFDRSPCGTGTSARMAQLHARGELPLDTDFVNESFIGTRFVGRLVEETEVTDLPAVVPTITGRAWVTGTAQYFLDPRDPFPEGFLL,./data/raw/alphafold//AF-D2AV87-F1-model_v4.pdb,1906,7206,9131,9446 +1081,28178,28664,MELLRTITYQPAASTKMCEQALGKGCGADSKKKRPPQPPEESQPPQSQAQVPPAAPHHHHHHSHSGPEISRIIVDPTTGKRYCRGKVLGKGGFAKCYEMTDLTNNKVYAAKIIPHSRVAKPHQREKIDKEIELHRILHHKHVVQFYHYFEDKENIYILLEYCSRRSMAHILKARKVLTEPEVRYYLRQIVSGLKYLHEQEILHRDLKLGNFFINEAMELKVGDFGLAARLEPLEHRRRTICGTPNYLSPEVLNKQGHGCESDIWALGCVMYTMLLGRPPFETTNLKETYRCIREARYTMPSSLLAPAKHLIASMLSKNPEDRPSLDDIIRHDFFLQGFTPDRLSSSCCHTVPDFHLSSPAKNFFKKAAAALFGGKKDKARYIDTHNRVSKEDEDIYKLRHDLKKTSITQQPSKHRTDEELQPPTTTVARSGTPAVENKQQIGDAIRMIVRGTLGSCSSSSECLEDSTMGSVADTVARVLRGCLENMPEADCIPKEQLSTSFQWVTKWVDYSNKYGFGYQLSDHTVGVLFNNGAHMSLLPDKKTVHYYAELGQCSVFPATDAPEQFISQVTVLKYFSHYMEENLMDGGDLPSVTDIRRPRLYLLQWLKSDKALMMLFNDGTFQVNFYHDHTKIIICSQNEEYLLTYINEDRISTTFRLTTLLMSGCSSELKNRMEYALNMLLQRCN,brenda,Q9NYY3,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.002,25.0,7.75,2.7.11.21,9606.0,-2.6989700043360187,-2.6989700043360187,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MELLRTITYQPAASTKMCEQALGKGCGADSKKKRPPQPPEESQPPQSQAQVPPAAPHHHHHHSHSGPEISRIIVDPTTGKRYCRGKVLGKGGFAKCYEMTDLTNNKVYAAKIIPHSRVAKPHQREKIDKEIELHRILHHKHVVQFYHYFEDKENIYILLEYCSRRSMAHILKARKVLTEPEVRYYLRQIVSGLKYLHEQEILHRDLKLGNFFINEAMELKVGDFGLAARLEPLEHRRRTICGTPNYLSPEVLNKQGHGCESDIWALGCVMYTMLLGRPPFETTNLKETYRCIREARYTMPSSLLAPAKHLIASMLSKNPEDRPSLDDIIRHDFFLQGFTPDRLSSSCCHTVPDFHLSSPAKNFFKKAAAALFGGKKDKARYIDTHNRVSKEDEDIYKLRHDLKKTSITQQPSKHRTDEELQPPTTTVARSGTPAVENKQQIGDAIRMIVRGTLGSCSSSSECLEDSTMGSVADTVARVLRGCLENMPEADCIPKEQLSTSFQWVTKWVDYSNKYGFGYQLSDHTVGVLFNNGAHMSLLPDKKTVHYYAELGQCSVFPATDAPEQFISQVTVLKYFSHYMEENLMDGGDLPSVTDIRRPRLYLLQWLKSDKALMMLFNDGTFQVNFYHDHTKIIICSQNEEYLLTYINEDRISTTFRLTTLLMSGCSSELKNRMEYALNMLLQRCN,./data/raw/alphafold//AF-Q9NYY3-F1-model_v4.pdb,1509,6795,8631,8852 +1089,30728,31274,MSYQPQTEAATSRFLNVEEAGKTLRIHFNDCGQGDETVVLLHGSGPGATGWANFSRNIDPLVEAGYRVILLDCPGWGKSDSVVNSGSRSDLNARILKSVVDQLDIAKIHLLGNSMGGHSSVAFTLKWPERVGKLVLMGGGTGGMSLFTPMPTEGIKRLNQLYRQPTIENLKLMMDIFVFDTSDLTDALFEARLNNMLSRRDHLENFVKSLEANPKQFPDFGPRLAEIKAQTLIVWGRNDRFVPMDAGLRLLSGIAGSELHIFRDCGHWAQWEHADAFNQLVLNFLARP,brenda,P77044,O=C(O)CCC(=O)/C=C\C=C(\O)C(=O)O,0.0068,25.0,8.0,3.7.1.14,562.0,-2.167491087293764,-2.167491087293764,O=C(O)CCC(=O)/C=C\C=C(\O)C(=O)O__MSYQPQTEAATSRFLNVEEAGKTLRIHFNDCGQGDETVVLLHGSGPGATGWANFSRNIDPLVEAGYRVILLDCPGWGKSDSVVNSGSRSDLNARILKSVVDQLDIAKIHLLGNSMGGHSSVAFTLKWPERVGKLVLMGGGTGGMSLFTPMPTEGIKRLNQLYRQPTIENLKLMMDIFVFDTSDLTDALFEARLNNMLSRRDHLENFVKSLEANPKQFPDFGPRLAEIKAQTLIVWGRNDRFVPMDAGLRLLSGIAGSELHIFRDCGHWAQWEHADAFNQLVLNFLARP,./data/raw/alphafold//AF-P77044-F1-model_v4.pdb,1763,7265,9212,9538 +1091,24966,25356,MYNPRCKDLDRDYFPSYHTTRFQDQPEPNLAVLEHFVRVTKQHGRELTEKQGITVDHLRYGEGRQLVDVFYSEKTTNQAPLFVFVHGGYWQEMDMSMSCSIVGPLVRRGYRVAVMDYNLCPQVTLEQLMTQFTHFLNWIFDYTEMTKVSSLTFAGHSAGAHLLAQILMRPNVITAQRSKMVWALIFLCGVYDLRELSNLESVNPKNILGLNERNIESVSPMLWEYTDVTVWNSTKIYVVAAEHDSTTFIEQSRHYADVLRKKGYKASFTLFKGYDHFDIIEETAIDDSDVSRFLRNIEIE,brenda,Q9VMC9,N[C@@H](CC(=O)c1ccccc1N=CO)C(=O)O,0.32,22.0,7.4,3.5.1.9,7227.0,-0.494850021680094,-0.494850021680094,N[C@@H](CC(=O)c1ccccc1N=CO)C(=O)O__MYNPRCKDLDRDYFPSYHTTRFQDQPEPNLAVLEHFVRVTKQHGRELTEKQGITVDHLRYGEGRQLVDVFYSEKTTNQAPLFVFVHGGYWQEMDMSMSCSIVGPLVRRGYRVAVMDYNLCPQVTLEQLMTQFTHFLNWIFDYTEMTKVSSLTFAGHSAGAHLLAQILMRPNVITAQRSKMVWALIFLCGVYDLRELSNLESVNPKNILGLNERNIESVSPMLWEYTDVTVWNSTKIYVVAAEHDSTTFIEQSRHYADVLRKKGYKASFTLFKGYDHFDIIEETAIDDSDVSRFLRNIEIE,./data/raw/alphafold//AF-Q9VMC9-F1-model_v4.pdb,1014,6115,7906,10461 +1093,8457,8597,MRKVPIITADEAAKLIKDGDTVTTSGFVGNAIPEALDRAVEKRFLETGEPKNITYVYCGSQGNRDGRGAEHFAHEGLLKRYIAGHWATVPALGKMAMENKMEAYNVSQGALCHLFRDIASHKPGVFTKVGIGTFIDPRNGGGKVNDITKEDIVELVEIKGQEYLFYPAFPIHVALIRGTYADESGNITFEKEVAPLEGTSVCQAVKNSGGIVVVQVERVVKAGTLDPRHVKVPGIYVDYVVVADPEDHQQSLDCEYDPALSGEHRRPEVVGEPLPLSAKKVIGRRGAIELEKDVAVNLGVGAPEYVASVADEEGIVDFMTLTAESGAIGGVPAGGVRFGASYNADALIDQGYQFDYYDGGGLDLCYLGLAECDEKGNINVSRFGPRIAGCGGFINITQNTPKVFFCGTFTAGGLKVKIEDGKVIIVQEGKQKKFLKAVEQITFNGDVALANKQQVTYITERCVFLLKEDGLHLSEIAPGIDLQTQILDVMDFAPIIDRDANGQIKLMDAALFAEGLMGLKEMKS,uniprot_search,Q9L3F7,CCC(=O)[O-],0.36,25.0,7.0,2.8.3.1,28446.0,-0.4436974992327127,-0.9498147274412184,CCC(=O)[O-]__MRKVPIITADEAAKLIKDGDTVTTSGFVGNAIPEALDRAVEKRFLETGEPKNITYVYCGSQGNRDGRGAEHFAHEGLLKRYIAGHWATVPALGKMAMENKMEAYNVSQGALCHLFRDIASHKPGVFTKVGIGTFIDPRNGGGKVNDITKEDIVELVEIKGQEYLFYPAFPIHVALIRGTYADESGNITFEKEVAPLEGTSVCQAVKNSGGIVVVQVERVVKAGTLDPRHVKVPGIYVDYVVVADPEDHQQSLDCEYDPALSGEHRRPEVVGEPLPLSAKKVIGRRGAIELEKDVAVNLGVGAPEYVASVADEEGIVDFMTLTAESGAIGGVPAGGVRFGASYNADALIDQGYQFDYYDGGGLDLCYLGLAECDEKGNINVSRFGPRIAGCGGFINITQNTPKVFFCGTFTAGGLKVKIEDGKVIIVQEGKQKKFLKAVEQITFNGDVALANKQQVTYITERCVFLLKEDGLHLSEIAPGIDLQTQILDVMDFAPIIDRDANGQIKLMDAALFAEGLMGLKEMKS,./data/raw/alphafold//AF-Q9L3F7-F1-model_v4.pdb,128,2870,3559,4128 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+1543,23400,23760,MQFSKMHGLGNDFMVVDAVTQNVFFSPELIRRLADRHLGVGFDQLLVVEPPYDPELDFHYRIFNADGSEVAQCGNGARCFARFVRLKGLTNKRDIRVSTANGRMVLTVTDDDLVRVNMGEPNFEPSAVPFRANKAEKTYIMRAAEQTILCGVVSMGNPHCVIQVDDVDTAAVETLGPVLESHERFPERANIGFMQVVKREHIRLRVYERGAGETQACGSGACAAVAVGIQQGLLAEEVRVELPGGRLDIAWKGPGHPLYMTGPAVHVYDGFIHL,sabio,P0A6K1,NC(CCCC(N)C(=O)O)C(=O)O,0.36,25.0,,5.1.1.7,562.0,-0.4436974992327127,-0.619788758288394,NC(CCCC(N)C(=O)O)C(=O)O__MQFSKMHGLGNDFMVVDAVTQNVFFSPELIRRLADRHLGVGFDQLLVVEPPYDPELDFHYRIFNADGSEVAQCGNGARCFARFVRLKGLTNKRDIRVSTANGRMVLTVTDDDLVRVNMGEPNFEPSAVPFRANKAEKTYIMRAAEQTILCGVVSMGNPHCVIQVDDVDTAAVETLGPVLESHERFPERANIGFMQVVKREHIRLRVYERGAGETQACGSGACAAVAVGIQQGLLAEEVRVELPGGRLDIAWKGPGHPLYMTGPAVHVYDGFIHL,./data/raw/alphafold//AF-P0A6K1-F1-model_v4.pdb,4697,5858,7582,8532 +1557,11918,12083,MQARALLLAALAALALAREPPAAPCPARCDVSRCPSPRCPGGYVPDLCNCCLVCAASEGEPCGGPLDSPCGESLECVRGLCRCRWSHAVCGTDGHTYANVCALQAASRRALQLSGTPVRQLQKGACPLGLHQLSSPRYKFNFIADVVEKIAPAVVHIELFLRHPLFGRNVPLSSGSGFIMSEAGLIITNAHVVSSNSAAPGRQQLKVQLQNGDSYEATIKDIDKKSDIATIKIHPKKKLPVLLLGHSADLRPGEFVVAIGSPFALQNTVTTGIVSTAQREGRELGLRDSDMDYIQTDAIINYGNSGGPLVNLDGEVIGINTLKVTAGISFAIPSDRITRFLTEFQDKQIKDWKKRFIGIRMRTITPSLVDELKASNPDFPEVSSGIYVQEVAPNSPSQRGGIQDGDIIVKVNGRPLVDSSELQEAVLTESPLLLEVRRGNDDLLFSIAPEVVM,brenda,P83110,CC[C@H](C)[C@H](N=C(O)[C@H](C)N=C(O)Cc1cc(=O)oc2cc(OC)ccc12)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@H](C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1ccccc1)C(O)=Nc1ccc([N+](=O)[O-])c(C(=N)O)c1)C(C)C,0.00096,37.0,8.0,3.4.21.108,9606.0,-3.017728766960432,-3.068004791693096,CC[C@H](C)[C@H](N=C(O)[C@H](C)N=C(O)Cc1cc(=O)oc2cc(OC)ccc12)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@H](C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1ccccc1)C(O)=Nc1ccc([N+](=O)[O-])c(C(=N)O)c1)C(C)C__MQARALLLAALAALALAREPPAAPCPARCDVSRCPSPRCPGGYVPDLCNCCLVCAASEGEPCGGPLDSPCGESLECVRGLCRCRWSHAVCGTDGHTYANVCALQAASRRALQLSGTPVRQLQKGACPLGLHQLSSPRYKFNFIADVVEKIAPAVVHIELFLRHPLFGRNVPLSSGSGFIMSEAGLIITNAHVVSSNSAAPGRQQLKVQLQNGDSYEATIKDIDKKSDIATIKIHPKKKLPVLLLGHSADLRPGEFVVAIGSPFALQNTVTTGIVSTAQREGRELGLRDSDMDYIQTDAIINYGNSGGPLVNLDGEVIGINTLKVTAGISFAIPSDRITRFLTEFQDKQIKDWKKRFIGIRMRTITPSLVDELKASNPDFPEVSSGIYVQEVAPNSPSQRGGIQDGDIIVKVNGRPLVDSSELQEAVLTESPLLLEVRRGNDDLLFSIAPEVVM,./data/raw/alphafold//AF-P83110-F1-model_v4.pdb,5368,3294,4051,4718 +1566,20785,21097,MNKYYKELLGMMNKNENEVKRLLILNYANALTEIKKELKDYMSRYDDLTYAQMLQCNRLKSLEAQINSILDKLYNTNSKDISNHAFRSYEENYFGLFYELESKYKINLSFSMISEDYVKKAIEYPVGGLNLSERLYGKHLNDLKIKVKACLTDHMINDKGYKVMAKKLSEISNADYKQSLRIAITEGNRLRSLARQDSYEEATDLGIDLKKKWLATLDSKTRCLHRALDGQVKNVDEEFEISGYTALEPRLFGVASMDIHCRCDTINVVEGISPELRRDNETKKVIPYKNYNEWYENRVVGEQLEM,uniprot_search,A0A2X2Y0Y0,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.77,37.0,6.6,2.4.2.31,1502.0,-0.1135092748275181,-0.0031496525898248,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MNKYYKELLGMMNKNENEVKRLLILNYANALTEIKKELKDYMSRYDDLTYAQMLQCNRLKSLEAQINSILDKLYNTNSKDISNHAFRSYEENYFGLFYELESKYKINLSFSMISEDYVKKAIEYPVGGLNLSERLYGKHLNDLKIKVKACLTDHMINDKGYKVMAKKLSEISNADYKQSLRIAITEGNRLRSLARQDSYEEATDLGIDLKKKWLATLDSKTRCLHRALDGQVKNVDEEFEISGYTALEPRLFGVASMDIHCRCDTINVVEGISPELRRDNETKKVIPYKNYNEWYENRVVGEQLEM,./data/raw/alphafold//AF-A0A2X2Y0Y0-F1-model_v4.pdb,4305,5253,7188,7221 +1569,25697,26117,MALKEKSHLENPRSILEKFHVSEEFGFVLSDPLVELPEYYAPWMKIATELTSLIETKQLHAEVQKLPLLTIDQLQGHRELRLAHLALGFITMGYVWQEGDKNAAKILPKKIAVPFCQISEKLDLPPVLVYADCILANWKKKDPNRPMDLENLDTIVSLPGGDNSKAFFLVSLLVELAAASAVKVIPVIMDALSREDASSLQIALHELTSSVQKTQDAFTLIHDHVDSTCYYETLRIFLSGWKDNPLLPDGLLYEGVWKTPKEFSGGSAAQSTIIQCFDLLLGIQHSSRDEAAANFLKRMRDYMPPAHRDFLQLVASGPTVRPFVLSKGDPDLQKAFDKCVSALVALRNYHLKVVAKYIVWPGQKLQREENQKEGLQKELVALEKGTGGTGFMQFLKTVRDSTRKSLLKEY,brenda,B3Y9H6,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,0.0537,25.0,7.4,1.13.11.52,9258.0,-1.2700257143004443,-1.2700257143004443,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O__MALKEKSHLENPRSILEKFHVSEEFGFVLSDPLVELPEYYAPWMKIATELTSLIETKQLHAEVQKLPLLTIDQLQGHRELRLAHLALGFITMGYVWQEGDKNAAKILPKKIAVPFCQISEKLDLPPVLVYADCILANWKKKDPNRPMDLENLDTIVSLPGGDNSKAFFLVSLLVELAAASAVKVIPVIMDALSREDASSLQIALHELTSSVQKTQDAFTLIHDHVDSTCYYETLRIFLSGWKDNPLLPDGLLYEGVWKTPKEFSGGSAAQSTIIQCFDLLLGIQHSSRDEAAANFLKRMRDYMPPAHRDFLQLVASGPTVRPFVLSKGDPDLQKAFDKCVSALVALRNYHLKVVAKYIVWPGQKLQREENQKEGLQKELVALEKGTGGTGFMQFLKTVRDSTRKSLLKEY,./data/raw/alphafold//AF-B3Y9H6-F1-model_v4.pdb,1117,6279,8117,12073 +1571,37388,38050,MRKSTSVYTLRSHRCFITLRAVIPILIFICLCGAVGTIFLTSSHQSALGWTREPTTSAPSGELTTTEPGEPRRSMTPTSAITTSAPATATTAEQTPLPPEQTSMFDAPGTPTPAVSAASARATGAQDSSTLMEGAKTETTKQNLAMKGLDRWMKMQLPADWMECIRQNLQLDKHGQPMHAVTEMKDAIPLLITPLTGDVKFFPYFVCSMDVAVRYHYVIQNERDPDTTAVIDDLQRRFGNSGRLLVVRNRYNRGYSGSMNQAFEWALKERTAEEVPWVFACGVDAIFEPGLLAKMIEVVQQNTRGDAAMLAALRAEVELEERLVREGNYSYYERWAPRGRPLKVLRSGYPGVPLNVRTAPLLPDRIRYTVADENRESGIVRPAELRTRFFGNYVATVTPVPDALGTIAVTRLALSAVGYFDENYFPAYMDDIDLRWRHFAYGFGALHGERNGPVTRWHHYNAANLRGSPFVDPDLEKYGTEDNYSRRAFLSYIRRSKGIYDKLKYGPRDMDGVWRQAAQKAEFKYSSFNVSHYPADTWVLDEDARGCMFHHTYNYKTQNWSRPSDCSYNPRTLEESGILGVDQLASYRSMLAEKAFAYQ,brenda,Q4QD44,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O,0.005,37.0,8.0,2.4.1.288,5664.0,-2.3010299956639813,-2.3010299956639813,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O__MRKSTSVYTLRSHRCFITLRAVIPILIFICLCGAVGTIFLTSSHQSALGWTREPTTSAPSGELTTTEPGEPRRSMTPTSAITTSAPATATTAEQTPLPPEQTSMFDAPGTPTPAVSAASARATGAQDSSTLMEGAKTETTKQNLAMKGLDRWMKMQLPADWMECIRQNLQLDKHGQPMHAVTEMKDAIPLLITPLTGDVKFFPYFVCSMDVAVRYHYVIQNERDPDTTAVIDDLQRRFGNSGRLLVVRNRYNRGYSGSMNQAFEWALKERTAEEVPWVFACGVDAIFEPGLLAKMIEVVQQNTRGDAAMLAALRAEVELEERLVREGNYSYYERWAPRGRPLKVLRSGYPGVPLNVRTAPLLPDRIRYTVADENRESGIVRPAELRTRFFGNYVATVTPVPDALGTIAVTRLALSAVGYFDENYFPAYMDDIDLRWRHFAYGFGALHGERNGPVTRWHHYNAANLRGSPFVDPDLEKYGTEDNYSRRAFLSYIRRSKGIYDKLKYGPRDMDGVWRQAAQKAEFKYSSFNVSHYPADTWVLDEDARGCMFHHTYNYKTQNWSRPSDCSYNPRTLEESGILGVDQLASYRSMLAEKAFAYQ,./data/raw/alphafold//AF-Q4QD44-F1-model_v4.pdb,2584,8245,10133,11328 +1586,36396,37028,MKHLISPRILTGLFVIGLGGQAVADCNAPAWSSTTQYKGGEAVVYQGGAFKARWWANVGVAPDTSNPWDVWQFIQPCSSGGNSSSVQASASVSSSGIIVGAQCNWYGNSYPVCQQAASGWGWENQQSCIAYADCASLPAPYGVMGGNSSSVLSGSSVSSSSRLSSSSSIPLSSSLPSSSSSVSSIASSSLSSSSSSMAVPEGNSWTYTAASASITAPAQLVGNVGELQGAGSAVIWNVDVPVTGEYRINLTWSSPYSSKVNTLVMDGTALSYAFAEATVPVTYVQTKTLSAGNHSFGVRVGSSDWGYMNVHSLKLELLGGLTIRSPANFAQLPSGSNIQVVYEKQGSGRLTYSVNDGATQLYGGESPLTIPTQGDGVYRLKFGLEGTVLSSNLRVTVGSANVPEFVEASGTQFVLGNKPFYFNGSNQYYLMYKPEPMANDFFARAKALDMKVVRTWMFCNSSSTHDGVCINKKSGSSFILVKPESERTADEKALITRSFERFDNYVAQAEANDMRLVLSLSDYWDYFGKIEDYGPYGSASGRALFKTFITNLLNHVNPLTGKAYKDDPTIMMWELANEPRYTTGNFADFKVWVADIAAHIKSIAPHQLVSIGSESSFGIALDDTYASLVELNRDPNIDAISAHLYPTSWRMTDEQVLSNIQKLADLAREVGKPAYIGELGWPAHAQRTTGSNFIELSSFTDQAAVDSFVSISLTQRANYMESWYAKAYANKDAIGGFLIWQLSGKEWGNGGTPLRGCQWCAGPYGEPTGGWSGNHDGYQFYCALNEAEMSLTQLGALGSNKEGDKIHMDLHKLSCDVMKAYSGKYRSLMQ,uniprot_search,Q840C0,O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@H](O)[C@@H]2O)c([N+](=O)[O-])c1,0.0093,37.0,6.5,3.2.1.78,155077.0,-2.0315170514460648,-2.0315170514460648,O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@H](O)[C@@H]2O)c([N+](=O)[O-])c1__MKHLISPRILTGLFVIGLGGQAVADCNAPAWSSTTQYKGGEAVVYQGGAFKARWWANVGVAPDTSNPWDVWQFIQPCSSGGNSSSVQASASVSSSGIIVGAQCNWYGNSYPVCQQAASGWGWENQQSCIAYADCASLPAPYGVMGGNSSSVLSGSSVSSSSRLSSSSSIPLSSSLPSSSSSVSSIASSSLSSSSSSMAVPEGNSWTYTAASASITAPAQLVGNVGELQGAGSAVIWNVDVPVTGEYRINLTWSSPYSSKVNTLVMDGTALSYAFAEATVPVTYVQTKTLSAGNHSFGVRVGSSDWGYMNVHSLKLELLGGLTIRSPANFAQLPSGSNIQVVYEKQGSGRLTYSVNDGATQLYGGESPLTIPTQGDGVYRLKFGLEGTVLSSNLRVTVGSANVPEFVEASGTQFVLGNKPFYFNGSNQYYLMYKPEPMANDFFARAKALDMKVVRTWMFCNSSSTHDGVCINKKSGSSFILVKPESERTADEKALITRSFERFDNYVAQAEANDMRLVLSLSDYWDYFGKIEDYGPYGSASGRALFKTFITNLLNHVNPLTGKAYKDDPTIMMWELANEPRYTTGNFADFKVWVADIAAHIKSIAPHQLVSIGSESSFGIALDDTYASLVELNRDPNIDAISAHLYPTSWRMTDEQVLSNIQKLADLAREVGKPAYIGELGWPAHAQRTTGSNFIELSSFTDQAAVDSFVSISLTQRANYMESWYAKAYANKDAIGGFLIWQLSGKEWGNGGTPLRGCQWCAGPYGEPTGGWSGNHDGYQFYCALNEAEMSLTQLGALGSNKEGDKIHMDLHKLSCDVMKAYSGKYRSLMQ,./data/raw/alphafold//AF-Q840C0-F1-model_v4.pdb,2464,8079,9942,11122 +1603,22006,22350,MENAVGSGSATNGEVAPPRKVALITGITGQDGSYLTEFLLNKGYEVHGLIRRSSNFNTQRIDHIYVDPHNAHKARMKLHYADLTDASSLRRWLDTILPDEVYNLAAQSHVAVSFEIPDYTADVVATGALRLLEAVRSHIADSGRSHIRYYQAGSSEMFGSTPPPQSETTPFHPRSPYAASKCAAHWYTVNYREAYGLYACNGILFNHESPRRGENFVTRKITRAVGRIKIGLQSKLFLGNLQASRDWGFAGDYVEAMWLMLQQEKPDDYVVATEESHTVEEFLEVAFGYVGLNWRDHVVIDKRYFRPAEVDNLKGDASKAKKVLGWKPKVGFAQLVKMMVDQDVEMAKKEKVLVDAGYIDAQQQP,uniprot_search,V7CIA4,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)[C@@H](O)[C@H]3O)c2[nH]1,0.028,30.0,7.0,4.2.1.47,3885.0,-1.5528419686577808,-1.5528419686577808,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)[C@@H](O)[C@H]3O)c2[nH]1__MENAVGSGSATNGEVAPPRKVALITGITGQDGSYLTEFLLNKGYEVHGLIRRSSNFNTQRIDHIYVDPHNAHKARMKLHYADLTDASSLRRWLDTILPDEVYNLAAQSHVAVSFEIPDYTADVVATGALRLLEAVRSHIADSGRSHIRYYQAGSSEMFGSTPPPQSETTPFHPRSPYAASKCAAHWYTVNYREAYGLYACNGILFNHESPRRGENFVTRKITRAVGRIKIGLQSKLFLGNLQASRDWGFAGDYVEAMWLMLQQEKPDDYVVATEESHTVEEFLEVAFGYVGLNWRDHVVIDKRYFRPAEVDNLKGDASKAKKVLGWKPKVGFAQLVKMMVDQDVEMAKKEKVLVDAGYIDAQQQP,./data/raw/alphafold//AF-V7CIA4-F1-model_v4.pdb,4554,2179,4228,7705 +1611,36160,36788,MVQAHGGRSRAQPLTLSLGAAMTQPPPEKTPAKKHVRLQERRGSNVALMLDVRSLGAVEPICSVNTPREVTLHFLRTAGHPLTRWALQRQPPSPKQLEEEFLKIPSNFVSPEDLDIPGHASKDRYKTILPNPQSRVCLGRAQSQEDGDYINANYIRGYDGKEKVYIATQGPMPNTVSDFWEMVWQEEVSLIVMLTQLREGKEKCVHYWPTEEETYGPFQIRIQDMKECPEYTVRQLTIQYQEERRSVKHILFSAWPDHQTPESAGPLLRLVAEVEESPETAAHPGPIVVHCSAGIGRTGCFIATRIGCQQLKARGEVDILGIVCQLRLDRGGMIQTAEQYQFLHHTLALYAGQLPEEPSP,brenda,P35236,O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,3.26,30.0,6.0,3.1.3.48,9606.0,0.5132176000679389,0.7257435417654252,O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MVQAHGGRSRAQPLTLSLGAAMTQPPPEKTPAKKHVRLQERRGSNVALMLDVRSLGAVEPICSVNTPREVTLHFLRTAGHPLTRWALQRQPPSPKQLEEEFLKIPSNFVSPEDLDIPGHASKDRYKTILPNPQSRVCLGRAQSQEDGDYINANYIRGYDGKEKVYIATQGPMPNTVSDFWEMVWQEEVSLIVMLTQLREGKEKCVHYWPTEEETYGPFQIRIQDMKECPEYTVRQLTIQYQEERRSVKHILFSAWPDHQTPESAGPLLRLVAEVEESPETAAHPGPIVVHCSAGIGRTGCFIATRIGCQQLKARGEVDILGIVCQLRLDRGGMIQTAEQYQFLHHTLALYAGQLPEEPSP,./data/raw/alphafold//AF-P35236-F1-model_v4.pdb,2416,8007,9848,11019 +1656,40513,41247,RTMFYGKGDVYVFRTYANPLKGLKQIPESNFTEKHNTIFGMNAKVALKGEQLLTSFTEGDNSLVVATDSMKNFIQRHAASYEGATLEGFLQYVCEAFLAKYSHLDAVRLEAKEYAFDDIQVGTDKGVVTSDLVFRKSRNEYATATVEVARTASGTEVVEQASGIADIQLIKVSGSSFYGYIIDEYTTLAEATDRPLYIFLNIGWAYENQDDAKGDNPANYVAAEQVRDIAASVFHTLDNKSIQHLIYHIGLTILDRFPQLTEVNFGTNNRTWDTVVEGTDGFKGAVFTEPRPPFGFQGFSVHQEDLAREKASANSEYVAL,uniprot_search,C5HDG5,Oc1nc(O)c2nc(O)[nH]c2n1,0.042,32.5,9.75,1.7.3.3,1458.0,-1.3767507096020994,-0.7947397714027931,Oc1nc(O)c2nc(O)[nH]c2n1__RTMFYGKGDVYVFRTYANPLKGLKQIPESNFTEKHNTIFGMNAKVALKGEQLLTSFTEGDNSLVVATDSMKNFIQRHAASYEGATLEGFLQYVCEAFLAKYSHLDAVRLEAKEYAFDDIQVGTDKGVVTSDLVFRKSRNEYATATVEVARTASGTEVVEQASGIADIQLIKVSGSSFYGYIIDEYTTLAEATDRPLYIFLNIGWAYENQDDAKGDNPANYVAAEQVRDIAASVFHTLDNKSIQHLIYHIGLTILDRFPQLTEVNFGTNNRTWDTVVEGTDGFKGAVFTEPRPPFGFQGFSVHQEDLAREKASANSEYVAL,./data/raw/alphafold//AF-C5HDG5-F1-model_v4.pdb,2803,4580,6369,11831 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+3093,13194,13388,MSRIRTSLEVLSLGFGLFTAEALYSGNEHFYKDWFLPTARLLVRDGETAHNLSVYLASYGFIPHKQRNSFPQLKCKVFGLEFDHPIGLAAGFDKDGKAFMGLLNAGFSHIEVGTVTPNPQLGNARPRIFRWTEKEAVVNRCGFNSDGHDAVYERLKDRPWEGRGVIGVNLGCNKTSADPTADYVAGVRKFGEVADYLVINVSSPNTPGLRSLQTKEKLRDLLSKVLAARNQLSKKTPILLKISPDENDQNLKDIVEVALDSKTRIDGMIISNTTLTTYEEAVACGAAPIPGNNKQNVVYGGLSGRPLFEKSTDCLRKVSALTKGAIPLIGVGGISCGEDALSKLNAGASLVQLYTSFVYQGPPVAHKVAREINKLKMTS,brenda,G4VFD7,COC1=C(OC)C(=O)C(C)=CC1=O,0.17,25.0,8.2,1.3.5.2,6183.0,-0.7695510786217261,-0.7695510786217261,COC1=C(OC)C(=O)C(C)=CC1=O__MSRIRTSLEVLSLGFGLFTAEALYSGNEHFYKDWFLPTARLLVRDGETAHNLSVYLASYGFIPHKQRNSFPQLKCKVFGLEFDHPIGLAAGFDKDGKAFMGLLNAGFSHIEVGTVTPNPQLGNARPRIFRWTEKEAVVNRCGFNSDGHDAVYERLKDRPWEGRGVIGVNLGCNKTSADPTADYVAGVRKFGEVADYLVINVSSPNTPGLRSLQTKEKLRDLLSKVLAARNQLSKKTPILLKISPDENDQNLKDIVEVALDSKTRIDGMIISNTTLTTYEEAVACGAAPIPGNNKQNVVYGGLSGRPLFEKSTDCLRKVSALTKGAIPLIGVGGISCGEDALSKLNAGASLVQLYTSFVYQGPPVAHKVAREINKLKMTS,./data/raw/alphafold//AF-G4VFD7-F1-model_v4.pdb,5433,3471,4733,4991 +3103,29670,30197,MKTKEDMQELYFPTPKLIEWENGVRQYSTVRGDTEVLMSYVPPHTNVEPHQHKEVQIGMVVSGELMMTVGDVTRKMTALESAYIAPPHVPHGARNDTDQEVIAIDIKRLKADETYTSPEDYFLDIFKTRDLLPGMEVTFFVEDWVEIMLAKIPGNGGEMPFHKHRNEQIGICIGGGYDMTVEGCTVEMKFGTAYFCEPREDHGAINRSEKESKSINIFFPPRYNRAKAKKMKADE,brenda,P39639,O=C(O)C(=O)CC1=CC[C@H](O)C=C1,0.423,37.0,8.1,5.3.3.19,1423.0,-0.3736596326249576,-0.3736596326249576,O=C(O)C(=O)CC1=CC[C@H](O)C=C1__MKTKEDMQELYFPTPKLIEWENGVRQYSTVRGDTEVLMSYVPPHTNVEPHQHKEVQIGMVVSGELMMTVGDVTRKMTALESAYIAPPHVPHGARNDTDQEVIAIDIKRLKADETYTSPEDYFLDIFKTRDLLPGMEVTFFVEDWVEIMLAKIPGNGGEMPFHKHRNEQIGICIGGGYDMTVEGCTVEMKFGTAYFCEPREDHGAINRSEKESKSINIFFPPRYNRAKAKKMKADE,./data/raw/alphafold//AF-P39639-F1-model_v4.pdb,1725,7117,9001,9276 +3120,28838,29354,MNNCLIKFFIFLLVFSNSYVAFSKNVNVLIVTAMDSEFDQINKLMSNKEEIVLKEYGLNKKILKGKLSNRNVMVIICGVGKVNAGVWTSYILSKYNISHVINSGVAGGVVSAKYKDIKVGDVVVSSEVAYHDVDLTKFGYKVGQLTGGLPQKFNANKNLIKNAIEAIKSKVGGSNAYSGLIVSGDQFIDPTYINKIIGNFKDVIAVEMEGAAIGHVSHMFNIPFIVIRSISDIVNKEGNEVEYKKFSKIAAFNSAKVVQEILRKL,uniprot_search,Q9F952,Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,0.0012,25.0,7.3,3.2.2.9,139.0,-2.920818753952376,-2.8583493856482254,Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O__MNNCLIKFFIFLLVFSNSYVAFSKNVNVLIVTAMDSEFDQINKLMSNKEEIVLKEYGLNKKILKGKLSNRNVMVIICGVGKVNAGVWTSYILSKYNISHVINSGVAGGVVSAKYKDIKVGDVVVSSEVAYHDVDLTKFGYKVGQLTGGLPQKFNANKNLIKNAIEAIKSKVGGSNAYSGLIVSGDQFIDPTYINKIIGNFKDVIAVEMEGAAIGHVSHMFNIPFIVIRSISDIVNKEGNEVEYKKFSKIAAFNSAKVVQEILRKL,./data/raw/alphafold//AF-Q9F952-F1-model_v4.pdb,1626,6965,8817,9061 +3127,21622,21958,MSQLTHINAAGEAHMVDVSAKAETVREARAEAFVTMRSETLAMIIDGRHHKGDVFATARIAGIQAAKRTWDLIPLCHPLMLSKVEVNLQAEPEHNRVRIETLCRLTGKTGVEMEALTAASVAALTIYDMCKAVQKDMVIGPVRLLAKSGGKSGDFKVEADD,brenda,P0A738,N=c1nc(O)c2c([nH]1)N1[C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@](O)([C@H]3O)[C@H]1N2,0.00025,30.0,7.5,4.6.1.17,562.0,-3.6020599913279625,-3.6399203482970215,N=c1nc(O)c2c([nH]1)N1[C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@](O)([C@H]3O)[C@H]1N2__MSQLTHINAAGEAHMVDVSAKAETVREARAEAFVTMRSETLAMIIDGRHHKGDVFATARIAGIQAAKRTWDLIPLCHPLMLSKVEVNLQAEPEHNRVRIETLCRLTGKTGVEMEALTAASVAALTIYDMCKAVQKDMVIGPVRLLAKSGGKSGDFKVEADD,./data/raw/alphafold//AF-P0A738-F1-model_v4.pdb,4433,5462,1617,7511 +3191,26112,26554,MFNYEELFQTHKTPFYLYDFDKIKQAFLNYKEAFKGRKSLICYALKANSNLSILSLLAHLESGADCVSIGEIYRALKAGIKPYRIVFSGVGKSGFEIEQALKLNILFLNVESFMELTTIETIAQSLGIKARISIRINPNIDAKTHPYISTGLKENKFGVGEKEALEMFLWAKKSAFLEPVSVHFHIGSQLSDLEPIIEASQKVAKIAKSLIALGIDLRFFDVGGGIGVSYENEETIKLYDYAQGILNSLQGLDLTIICEPGRSIVAESGELITQVLYEKKAQNKRFVVVDAGMNDFLRPSLYHAKHAIRVITPSKGREISPCDVVGPVCESSDTFLKDAHLPELEPGDKLVIEKVGAYGSSMASQYNSRPKLLELALEDHKIRVIRKREALEDLWRLEEEGLKGV,brenda,P56129,N[C@H](CCC[C@H](N)C(=O)O)C(=O)O,0.39,37.0,7.5,4.1.1.20,210.0,-0.4089353929735008,-0.4089353929735008,N[C@H](CCC[C@H](N)C(=O)O)C(=O)O__MFNYEELFQTHKTPFYLYDFDKIKQAFLNYKEAFKGRKSLICYALKANSNLSILSLLAHLESGADCVSIGEIYRALKAGIKPYRIVFSGVGKSGFEIEQALKLNILFLNVESFMELTTIETIAQSLGIKARISIRINPNIDAKTHPYISTGLKENKFGVGEKEALEMFLWAKKSAFLEPVSVHFHIGSQLSDLEPIIEASQKVAKIAKSLIALGIDLRFFDVGGGIGVSYENEETIKLYDYAQGILNSLQGLDLTIICEPGRSIVAESGELITQVLYEKKAQNKRFVVVDAGMNDFLRPSLYHAKHAIRVITPSKGREISPCDVVGPVCESSDTFLKDAHLPELEPGDKLVIEKVGAYGSSMASQYNSRPKLLELALEDHKIRVIRKREALEDLWRLEEEGLKGV,./data/raw/alphafold//AF-P56129-F1-model_v4.pdb,1161,6343,8195,10189 +3216,23796,24175,MTIITQPPVVPHFVQAETTKENLDWADLDAVDLSKAKTHEGRKGLVKQVHDAMKNDGFLFVTNHSVTPQQMSRMFDLSNYAVDNVSDEEKQKYVGNMRENGTYRGYKPRKFWHIAGGVRDQIEQYNMNFREIKDGTHPEPLRPFLSEIDDFSDQIHSDIINTILRLIAMSLELDEDYFIQMHDRSANAETFLRFVNYFPHPEEEENKSGGVWLKGHTDFMTLTLLFSQPVASLQIMTKDGQWKWVKHVENGVLVNIGEAIEFLTGGYYKPTIHRVRQPPLDQQNKTRVGLLYFCSAHDDVVLRPIAESPVVQKGGDSESRLLDDKFPTAGEYGKARVMAYGGTQALKQDVQKGIDEEVVAGVLLRHYN,brenda,H9ZYN5,NC1(C(=O)O)CC1,0.25,37.0,5.975,1.14.17.4,5341.0,-0.6020599913279624,-0.6020599913279624,NC1(C(=O)O)CC1__MTIITQPPVVPHFVQAETTKENLDWADLDAVDLSKAKTHEGRKGLVKQVHDAMKNDGFLFVTNHSVTPQQMSRMFDLSNYAVDNVSDEEKQKYVGNMRENGTYRGYKPRKFWHIAGGVRDQIEQYNMNFREIKDGTHPEPLRPFLSEIDDFSDQIHSDIINTILRLIAMSLELDEDYFIQMHDRSANAETFLRFVNYFPHPEEEENKSGGVWLKGHTDFMTLTLLFSQPVASLQIMTKDGQWKWVKHVENGVLVNIGEAIEFLTGGYYKPTIHRVRQPPLDQQNKTRVGLLYFCSAHDDVVLRPIAESPVVQKGGDSESRLLDDKFPTAGEYGKARVMAYGGTQALKQDVQKGIDEEVVAGVLLRHYN,./data/raw/alphafold//AF-H9ZYN5-F1-model_v4.pdb,4755,5945,7689,8667 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diff --git a/datasets/splits/km-seq_test_sequence_80cluster.csv b/datasets/splits/km-seq_test_sequence_80cluster.csv new file mode 100644 index 0000000000000000000000000000000000000000..0db9234125ef8839bda93dc9c3ccbcf939546809 --- /dev/null +++ b/datasets/splits/km-seq_test_sequence_80cluster.csv @@ -0,0 +1,381 @@ +,Unnamed: 0,Unnamed: 0.1,sequence,sequence_source,uniprot,substrate_smiles,value,temperature,ph,ec,taxonomy_id,log10_value,log10km_mean,group,pdbpath,sequence_40cluster,sequence_60cluster,sequence_80cluster,sequence_99cluster 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+134,34628,35235,MFSVTRRRAAGAAAAMATATGTLYWMTSQGDRPLVHNDPSYMVQFPTAAPPQVSRRDLLDRLAKTHQFDVLIIGGGATGTGCALDAATRGLNVALVEKGDFASGTSSKSTKMIHGGVRYLEKAFWEFSKAQLDLVIEALNERKHLINTAPHLCTVLPILIPIYSTWQVPYIYMGCKFYDFFAGSQNLKKSYLLSKSATVEKAPMLTTDNLKASLVYHDGSFNDSRLNATLAITAVENGATVLNYVEVQKLIKDPTSGKVIGAEARDVETNELVRINAKCVVNATGPYSDAILQMDRNPSGLPDSPLNDNSKIKSTFNQIAVMDPKMVIPSIGVHIVLPSFYCPKDMGLLDVRTSDGRVMFFLPWQGKVLAGTTDIPLKQVPENPMPTEADIQDILKELQHYIEFPVKREDVLSAWAGVRPLVRDPRTIPADGKKGSATQGVVRSHFLFTSDNGLITIAGGKWTTYRQMAEETVDKVVEVGGFHNLKPCHTRDIKLAGAEEWTQNYVALLAQNYHLSSKMSNYLVQNYGTRSSIICEFFKESMENKLPLSLADKENNVIYSSEENNLVNFDTFRYPFTIGELKYSMQYEYCRTPLDFLLRRTRFAFLDAKEALNAVHATVKVMGDEFNWSEKKRQWELEKTVNFIKTFGV,sabio,P32191,O=P(O)(O)OCC(O)CO,23.0,,6.8,1.1.5.3,4932.0,1.3617278360175928,1.446603376529924,O=P(O)(O)OCC(O)CO__MFSVTRRRAAGAAAAMATATGTLYWMTSQGDRPLVHNDPSYMVQFPTAAPPQVSRRDLLDRLAKTHQFDVLIIGGGATGTGCALDAATRGLNVALVEKGDFASGTSSKSTKMIHGGVRYLEKAFWEFSKAQLDLVIEALNERKHLINTAPHLCTVLPILIPIYSTWQVPYIYMGCKFYDFFAGSQNLKKSYLLSKSATVEKAPMLTTDNLKASLVYHDGSFNDSRLNATLAITAVENGATVLNYVEVQKLIKDPTSGKVIGAEARDVETNELVRINAKCVVNATGPYSDAILQMDRNPSGLPDSPLNDNSKIKSTFNQIAVMDPKMVIPSIGVHIVLPSFYCPKDMGLLDVRTSDGRVMFFLPWQGKVLAGTTDIPLKQVPENPMPTEADIQDILKELQHYIEFPVKREDVLSAWAGVRPLVRDPRTIPADGKKGSATQGVVRSHFLFTSDNGLITIAGGKWTTYRQMAEETVDKVVEVGGFHNLKPCHTRDIKLAGAEEWTQNYVALLAQNYHLSSKMSNYLVQNYGTRSSIICEFFKESMENKLPLSLADKENNVIYSSEENNLVNFDTFRYPFTIGELKYSMQYEYCRTPLDFLLRRTRFAFLDAKEALNAVHATVKVMGDEFNWSEKKRQWELEKTVNFIKTFGV,./data/raw/alphafold//AF-P32191-F1-model_v4.pdb,2193,7675,9450,10566 +138,26894,27357,MNIVVLISGNGSNLQAIIDACKTNKIKGTVRAVFSNKADAFGLERARQAGIATHTLIASAFDSREAYDRELIHEIDMYAPDVVVLAGFMRILSPAFVSHYAGRLLNIHPSLLPKYPGLHTHRQALENGDEEHGTSVHFVTDELDGGPVILQAKVPVFAGDSEDDITARVQTQEHAIYPLVISWFADGRLKMHENAAWLDGQRLPPQGYAADE,sabio,P08179,Nc1nc2ncc(CN(C=O)c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1,0.6,26.0,,2.1.2.2,562.0,-0.2218487496163563,-0.2218487496163563,Nc1nc2ncc(CN(C=O)c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1__MNIVVLISGNGSNLQAIIDACKTNKIKGTVRAVFSNKADAFGLERARQAGIATHTLIASAFDSREAYDRELIHEIDMYAPDVVVLAGFMRILSPAFVSHYAGRLLNIHPSLLPKYPGLHTHRQALENGDEEHGTSVHFVTDELDGGPVILQAKVPVFAGDSEDDITARVQTQEHAIYPLVISWFADGRLKMHENAAWLDGQRLPPQGYAADE,./data/raw/alphafold//AF-P08179-F1-model_v4.pdb,1261,6468,8338,10349 +149,18002,18262,MMIVIKTAIPDVLILEPKVFGDERGFFFESYNQQTFEELIGRKVTFVQDNHSKSKKNVLRGLHFQRGENAQGKLVRCAVGEVFDVAVDIRKESPTFGQWVGVNLSAENKRQLWIPEGFAHGFVTLSEYAEFLYKATNYYSPSSEGSILWNDEAIGIEWPFSQLPELSAKDAAAPLLDQALLTE,sabio,P26394,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OC3OC(C)C(=O)C(O)C3O)O2)c(=O)[nH]c1=O,0.71,25.0,7.0,5.1.3.13,90371.0,-0.1487416512809247,-0.1487416512809247,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OC3OC(C)C(=O)C(O)C3O)O2)c(=O)[nH]c1=O__MMIVIKTAIPDVLILEPKVFGDERGFFFESYNQQTFEELIGRKVTFVQDNHSKSKKNVLRGLHFQRGENAQGKLVRCAVGEVFDVAVDIRKESPTFGQWVGVNLSAENKRQLWIPEGFAHGFVTLSEYAEFLYKATNYYSPSSEGSILWNDEAIGIEWPFSQLPELSAKDAAAPLLDQALLTE,./data/raw/alphafold//AF-P26394-F1-model_v4.pdb,942,4375,5829,6251 +153,21741,22079,MARLGRLLSVLGLVLCGATGLGLSAPPAPTPKKPIIGILMQKCHNKNMRALGKYYIAASYVKFLESAGARVVPVRLDLKNEEYEKLFKSINGVLFPGGSVNLMRSGYARVAKMFYNLSIKSFGEGDYFPVWGTCLGFEELIYLVSGESLLTLTDTVGIKLPLNFSRGTLQSRMFQNFPADLLLSLAVEPLTAHFHKWSLSVMNFTKNEKLKAFFSILTTNTDGNIDFISTMEGYRYPIYGVQWHPEKAPYEWGQLRGISHAPNAVKAAFYLAEFFVAEARKSNHHFESDVEETKALIYQYRPTYTGNVSSFQQSYIFD,uniprot_search,A7YWG4,N=c1nc(O)c2nc(CNc3ccc(C(=O)N[C@@H](CCC(O)=N[C@@H](CCC(O)=N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)cc3)cnc2[nH]1,0.0017,70.0,3.9,3.4.19.9,9913.0,-2.7695510786217263,-2.7695510786217263,N=c1nc(O)c2nc(CNc3ccc(C(=O)N[C@@H](CCC(O)=N[C@@H](CCC(O)=N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)cc3)cnc2[nH]1__MARLGRLLSVLGLVLCGATGLGLSAPPAPTPKKPIIGILMQKCHNKNMRALGKYYIAASYVKFLESAGARVVPVRLDLKNEEYEKLFKSINGVLFPGGSVNLMRSGYARVAKMFYNLSIKSFGEGDYFPVWGTCLGFEELIYLVSGESLLTLTDTVGIKLPLNFSRGTLQSRMFQNFPADLLLSLAVEPLTAHFHKWSLSVMNFTKNEKLKAFFSILTTNTDGNIDFISTMEGYRYPIYGVQWHPEKAPYEWGQLRGISHAPNAVKAAFYLAEFFVAEARKSNHHFESDVEETKALIYQYRPTYTGNVSSFQQSYIFD,./data/raw/alphafold//AF-A7YWG4-F1-model_v4.pdb,4437,5500,1664,7563 +157,10393,10548,MQRPVELEVDGLVLRGMEH,sabio,Q7M0L6,CCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1,0.0043,70.0,7.1,3.1.1.1,405212.0,-2.3665315444204134,-2.4067223989288262,CCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1__MQRPVELEVDGLVLRGMEH,./data/raw/alphafold//AF-Q7M0L6-F1-model_v4.pdb,5437,3095,3826,4445 +168,26810,27270,MALVKEVLVVLNRLSPFELQESWDNSGLNVGSENSEFSEIVACLEITLKIALNAPQNALIITHHPLIFKPLKTLNDEIYPGNILKILIQKNVSVISMHTNFDKTHLNKHFAHALLEFDGLVEKGLMLVKENANIEFDALVKKIKSSLGVGSLACVKSSQTIKDLAFVCGSGASMFSSLKAQSCLITGDVKYHDAMIAQSLGISLIDATHYYSERGFALIVAEILHSFNYLVTIENFKNPLQII,sabio,O25613,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,0.04,30.0,4.0,3.5.4.16,210.0,-1.3979400086720375,-1.3979400086720375,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1__MALVKEVLVVLNRLSPFELQESWDNSGLNVGSENSEFSEIVACLEITLKIALNAPQNALIITHHPLIFKPLKTLNDEIYPGNILKILIQKNVSVISMHTNFDKTHLNKHFAHALLEFDGLVEKGLMLVKENANIEFDALVKKIKSSLGVGSLACVKSSQTIKDLAFVCGSGASMFSSLKAQSCLITGDVKYHDAMIAQSLGISLIDATHYYSERGFALIVAEILHSFNYLVTIENFKNPLQII,./data/raw/alphafold//AF-O25613-F1-model_v4.pdb,1243,6447,8316,10322 +173,17641,17900,MRLLSWLPFVFLLEVIFASNQIKFDLYDNNELQSNNDTVDLATQYSQISNSSLLWGPYRSALYFGLRPRFPRSLLSGLMWFSINDYEGIGKIRHFYEQHDKMSKANWVSYDPRIGGRQIIDDDECHIKIIIDFVKSDDGLSWGVKIRAKPHKGFENIKTSFIWYSGLEGEQKVIEENGDETTSRTGFLKLENPKNVLGYEGNVKFAGVSEELGAFELEINDGPKTNVHPAGRTDVDPELDPRKAHHYSLTVPDDNVWRARDIFMTMLQESIQKLVEKFGGVEAIPPENLFILRDLQDFEGNLHFVQKVYQGSCEFDVVYNNALTPITERITFENLKFRIQNSLKAFDEKFNNHFELAPPFNSKKYKKFGKEVLSGLLGGLSYFYGDQLVDRETVFDEDSFESYKLEGTFEGPYELFTLVPSRPFFPRGFLWDEGFHLLPLLNYDSDLVLEITKSWFNLIDEDGWIAREQILGKESRSRVPAEFVVQSPQIVNPPTLTLVLTYLLDSVVGNYDTINEPKNVDESLSRENLGGFVLKNPEVLTNYTKQVYPKLKSHLDMFRRTQKGYVEEFDRGTNPEAYRWRGRTLTHCLASGLDDYPRALPADVAELNVDLISWIGIMTRSIRLMAEILNIDEDVETYKNLENDIIDNIEKLHWSPEDKTYCDVSVNDDDENIFVCFKGYISLFPFLTKLIPEANTDKLEHIINLISNPEELWTPYGIRSLSKADEFYKTGEDYWRSPIWIPINYLILDSIQDYYIRSKHHMSTNLQEKFAKTYHDLRINIVKNVFDQADKTGFVWEQYNDETGEAQRAKNFLGWSSLVLIMMTMPEHLQ,brenda,Q2V621,Cc1cc(=O)oc2cc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12,0.133,37.0,7.0,3.2.1.106,5476.0,-0.8761483590329142,-1.0039780095238615,Cc1cc(=O)oc2cc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12__MRLLSWLPFVFLLEVIFASNQIKFDLYDNNELQSNNDTVDLATQYSQISNSSLLWGPYRSALYFGLRPRFPRSLLSGLMWFSINDYEGIGKIRHFYEQHDKMSKANWVSYDPRIGGRQIIDDDECHIKIIIDFVKSDDGLSWGVKIRAKPHKGFENIKTSFIWYSGLEGEQKVIEENGDETTSRTGFLKLENPKNVLGYEGNVKFAGVSEELGAFELEINDGPKTNVHPAGRTDVDPELDPRKAHHYSLTVPDDNVWRARDIFMTMLQESIQKLVEKFGGVEAIPPENLFILRDLQDFEGNLHFVQKVYQGSCEFDVVYNNALTPITERITFENLKFRIQNSLKAFDEKFNNHFELAPPFNSKKYKKFGKEVLSGLLGGLSYFYGDQLVDRETVFDEDSFESYKLEGTFEGPYELFTLVPSRPFFPRGFLWDEGFHLLPLLNYDSDLVLEITKSWFNLIDEDGWIAREQILGKESRSRVPAEFVVQSPQIVNPPTLTLVLTYLLDSVVGNYDTINEPKNVDESLSRENLGGFVLKNPEVLTNYTKQVYPKLKSHLDMFRRTQKGYVEEFDRGTNPEAYRWRGRTLTHCLASGLDDYPRALPADVAELNVDLISWIGIMTRSIRLMAEILNIDEDVETYKNLENDIIDNIEKLHWSPEDKTYCDVSVNDDDENIFVCFKGYISLFPFLTKLIPEANTDKLEHIINLISNPEELWTPYGIRSLSKADEFYKTGEDYWRSPIWIPINYLILDSIQDYYIRSKHHMSTNLQEKFAKTYHDLRINIVKNVFDQADKTGFVWEQYNDETGEAQRAKNFLGWSSLVLIMMTMPEHLQ,./data/raw/alphafold//AF-Q2V621-F1-model_v4.pdb,1153,4276,5721,6131 +175,10487,10642,MSGIQFDVSRLCAATISIQGRHFVDSHGRVLHLRGANVSAASKVPATPAPKIHDHAQASYVGRPFRLEEADEHWARLKSWGLTFVRITVTWEALEHKERGVYDEDYLAYLRALLQSMEPYGLVAYIALHQDVWSRYCGGSGAPGWTLEAAGFDLSNEGENLSLSGAAFLDGIKSGRLAGERGLWPTGYQKLAAATMNTLFWGGETFAPLLKVPGQIDGKWVSRNIQVYLQEAFLAATAKLVKAVGDLETVMGFELMNEPHPGFIGIQSIHEWDYTTDLHLGQFPSPLQSFSMGAGHPTPNVPVYTRSFPFPTRVTSHVTANPEGACAWASKECPWEKHGVWRWSEAKQEAAALQQDYFVKNRDGGKVDFYEDFYFPFVRKWEQVIGENISSTKGLKARMVEAIPNELCPEWKEESRPKNMVYAPHWYDLNTLFKKKFGFMSVNVQGLARGMFILRALYFGTAAAKANYALQIKTIVLAARLKLGPVPVIFGECGVPMDINNEEAFRTGDWKWQERSMDALISAMEGALMGFNLWTYNPANRDDIGDDWNAENFSWYSESNRTKLLKNAEKSSDGLDVGARLLNVIVRPYPIATAGNPTSLAYDANACAFTYRFRSPLRVSAAAPTPEEYTEIFLPRRVFRKESTEWTVTAGGKVHVDWERERVFVWFEDSSLTAASIKDDTRPRRIDIWVIGRKVEENWSIAQILVAVVILLLGVLVAYYAQLYEWEKDKMIFQHLREANGM,brenda,H1AE12,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)N=C(O)CCCCCNc1ccc([N+](=O)[O-])c2nonc12,0.0058,30.0,7.3,3.2.1.62,5207.0,-2.2365720064370627,-2.2365720064370627,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)N=C(O)CCCCCNc1ccc([N+](=O)[O-])c2nonc12__MSGIQFDVSRLCAATISIQGRHFVDSHGRVLHLRGANVSAASKVPATPAPKIHDHAQASYVGRPFRLEEADEHWARLKSWGLTFVRITVTWEALEHKERGVYDEDYLAYLRALLQSMEPYGLVAYIALHQDVWSRYCGGSGAPGWTLEAAGFDLSNEGENLSLSGAAFLDGIKSGRLAGERGLWPTGYQKLAAATMNTLFWGGETFAPLLKVPGQIDGKWVSRNIQVYLQEAFLAATAKLVKAVGDLETVMGFELMNEPHPGFIGIQSIHEWDYTTDLHLGQFPSPLQSFSMGAGHPTPNVPVYTRSFPFPTRVTSHVTANPEGACAWASKECPWEKHGVWRWSEAKQEAAALQQDYFVKNRDGGKVDFYEDFYFPFVRKWEQVIGENISSTKGLKARMVEAIPNELCPEWKEESRPKNMVYAPHWYDLNTLFKKKFGFMSVNVQGLARGMFILRALYFGTAAAKANYALQIKTIVLAARLKLGPVPVIFGECGVPMDINNEEAFRTGDWKWQERSMDALISAMEGALMGFNLWTYNPANRDDIGDDWNAENFSWYSESNRTKLLKNAEKSSDGLDVGARLLNVIVRPYPIATAGNPTSLAYDANACAFTYRFRSPLRVSAAAPTPEEYTEIFLPRRVFRKESTEWTVTAGGKVHVDWERERVFVWFEDSSLTAASIKDDTRPRRIDIWVIGRKVEENWSIAQILVAVVILLLGVLVAYYAQLYEWEKDKMIFQHLREANGM,./data/raw/alphafold//AF-H1AE12-F1-model_v4.pdb,5453,3111,3844,4472 +212,22675,23027,MKHLTTMSELSTEEIKDLLQTAQELKSGKTDNQLTGKFAANLFFEPSTRTRFSFEVAEKKLGMNVLNLDGTSTSVQKGETLYDTIRTLESIGVDVCVIRHSEDEYYEELVSQVNIPILNAGDGCGQHPTQSLLDLMTIYEEFNTFKGLTVSIHGDIKHSRVARSNAEVLTRLGARVLFSGPSEWQDEENTFGTYVSMDEAVESSDVVMLLRIQNERHQSAVSQEGYLNKYGLTVERAERMKRHAIIMHPAPVNRGVEIDDSLVESEKSRIFKQMKNGVFIRMAVIQRALQTNVKRGEAAYVISH,sabio,P05654,NC(=O)OP(=O)(O)O,0.095,25.0,8.3,2.1.3.2,1423.0,-1.0222763947111522,-1.0222763947111522,NC(=O)OP(=O)(O)O__MKHLTTMSELSTEEIKDLLQTAQELKSGKTDNQLTGKFAANLFFEPSTRTRFSFEVAEKKLGMNVLNLDGTSTSVQKGETLYDTIRTLESIGVDVCVIRHSEDEYYEELVSQVNIPILNAGDGCGQHPTQSLLDLMTIYEEFNTFKGLTVSIHGDIKHSRVARSNAEVLTRLGARVLFSGPSEWQDEENTFGTYVSMDEAVESSDVVMLLRIQNERHQSAVSQEGYLNKYGLTVERAERMKRHAIIMHPAPVNRGVEIDDSLVESEKSRIFKQMKNGVFIRMAVIQRALQTNVKRGEAAYVISH,./data/raw/alphafold//AF-P05654-F1-model_v4.pdb,4614,5722,7398,8306 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+254,154,160,MKYRTHKCNELSLDHVGEHVRLSGWVHRYRNHGGVVFIDLRDCFGITQIVCRQEENPELHQLMDQVRSEWVLCVEGLVCARLEGMENPNLVTGSIEVEVSSLEVLSRAQNLPFSISDEHINVNEELRLTYRYLDMRRGDILDRLMCRHKVMLACRQYLDEQGFTEVVTPILGKSTPEGARDYLVPSRIYPGNFYALPQSPQLFKQILMVGGLDRYFQIATCFRDEDLRADRQPEFTQIDMEMSFGGPEDLFPVVEELVARLFAVKGIELKAPFLRMTYQEAKDSYGTDKPDLRFGLRLKNCCEYARKFTFSIFLDQLAYGGTVKGFCVPGGADMSRKQLDIYTDFVKRYGAMGLVWIKKQDGGVSSNVAKFASEDVFQEMFEAFEAKDQDILLLIAAPEAVANQALDHLRRLIARERQLYDSTQYNFVWITDFPLFAKEEGELCPEHHPFTAPLDEDISLLDSDPFAVRSSSYDLVLNGYEIASGSQRIHNPDLQNKIFALLKLSQESVKEKFGFFIDALSFGTPPHLGIALGLDRIMMVLTGAETIREVIAFPKTQKAGDLMMSAPSEILPIQLKELGLKL,sabio,O84546,*C1OC(COP(=O)(O)OC2C(COP(=O)(O)OC3C(CO)OC(*)C3O)OC(*)C2O)C(O)C1O,0.00276,37.0,7.2,6.1.1.23,813.0,-2.5590909179347823,-2.790683656322967,*C1OC(COP(=O)(O)OC2C(COP(=O)(O)OC3C(CO)OC(*)C3O)OC(*)C2O)C(O)C1O__MKYRTHKCNELSLDHVGEHVRLSGWVHRYRNHGGVVFIDLRDCFGITQIVCRQEENPELHQLMDQVRSEWVLCVEGLVCARLEGMENPNLVTGSIEVEVSSLEVLSRAQNLPFSISDEHINVNEELRLTYRYLDMRRGDILDRLMCRHKVMLACRQYLDEQGFTEVVTPILGKSTPEGARDYLVPSRIYPGNFYALPQSPQLFKQILMVGGLDRYFQIATCFRDEDLRADRQPEFTQIDMEMSFGGPEDLFPVVEELVARLFAVKGIELKAPFLRMTYQEAKDSYGTDKPDLRFGLRLKNCCEYARKFTFSIFLDQLAYGGTVKGFCVPGGADMSRKQLDIYTDFVKRYGAMGLVWIKKQDGGVSSNVAKFASEDVFQEMFEAFEAKDQDILLLIAAPEAVANQALDHLRRLIARERQLYDSTQYNFVWITDFPLFAKEEGELCPEHHPFTAPLDEDISLLDSDPFAVRSSSYDLVLNGYEIASGSQRIHNPDLQNKIFALLKLSQESVKEKFGFFIDALSFGTPPHLGIALGLDRIMMVLTGAETIREVIAFPKTQKAGDLMMSAPSEILPIQLKELGLKL,./data/raw/alphafold//AF-O84546-F1-model_v4.pdb,2926,106,114,128 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+684,30248,30785,MSRIRTSLEVLSLGFGLFTAEALYSGNEHFYKDWFLPTARLLVRDGETAHNLSVYLASYGFIPHKQRNSFPQLKCKVFGLEFDHPIGLAAGFDKDGKAFMGLLNAGFSHIEVGTVTPNPQLGNARPRIFRWTEKEAVVNRCGFNSDGHDAVYERLKDRPWEGRGVIGVNLGCNKTSADPTADYVAGVRKFGEVADYLVINVSSPNTPGLRSLQTKEKLRDLLSKVLAARNQLSKKTPILLKISPDENDQNLKDIVEVALDSKTRIDGMIISNTTLTTYEEAVACGAAPIPGNNKQNVVYGGLSGRPLFEKSTDCLRKVSALTKGAIPLIGVGGISCGEDALSKLNAGASLVQLYTSFVYQGPPVAHKVAREINKLKMTS,brenda,G4VFD7,O=C(O)C1CC(O)=NC(O)=N1,0.23,25.0,8.2,1.3.5.2,6183.0,-0.6382721639824072,-0.6382721639824072,O=C(O)C1CC(O)=NC(O)=N1__MSRIRTSLEVLSLGFGLFTAEALYSGNEHFYKDWFLPTARLLVRDGETAHNLSVYLASYGFIPHKQRNSFPQLKCKVFGLEFDHPIGLAAGFDKDGKAFMGLLNAGFSHIEVGTVTPNPQLGNARPRIFRWTEKEAVVNRCGFNSDGHDAVYERLKDRPWEGRGVIGVNLGCNKTSADPTADYVAGVRKFGEVADYLVINVSSPNTPGLRSLQTKEKLRDLLSKVLAARNQLSKKTPILLKISPDENDQNLKDIVEVALDSKTRIDGMIISNTTLTTYEEAVACGAAPIPGNNKQNVVYGGLSGRPLFEKSTDCLRKVSALTKGAIPLIGVGGISCGEDALSKLNAGASLVQLYTSFVYQGPPVAHKVAREINKLKMTS,./data/raw/alphafold//AF-G4VFD7-F1-model_v4.pdb,5433,3471,4733,4991 +685,29434,29957,MHFRRCIRKYCINKKIVNPFEHVQRTLNEKNYYYYDINELHDSRIKSLPYSIRVLLESAVRNCDNLKVSEKNVETILGWKENCKKKKEVPFMPTRVLLQDLTGVPCIVDLATMRDTAEKLGCDAERINPLIPVDLVIDHSVQVDYSRREDALELNEKKEYERNLERFKFLKWGMNSFKNMLILPPGSGIVHQINLEYLAHCVFNKDNLLYPDSVVGTDSHTTMINGLGILGWGVGGIEAEATMLGLPISMTLPEVVGINVVGKLSDYLLSTDIVLYITSFLRKEVGVVNKYVEFFGTGLKDLKLADRATISNMAPEYGATVGFFPVDDITLEYLLQTGRDKEKVELIREYLMKNSMFNTYKDNVEYTDVYTLDLSKLNLSLSGPKRPHDNVLLSELHKDFTMCLESPIGFKGYNIAKEEREKKISFVCSKDGKEYVLSQGSVVLCAITSCTNTSNSSSMIAAGLLAKKAIEEFGLKSLPYIKSSLSPGSKTVQKYLEAGGLLKYLEQLGFYNVGYGCMTCIGNSGHLDEEVEEVINKNDLIVSSVLSGNRNFEGRVHPLIKANYLASPVLVVLFSIIGNVNVDLSNYTFNYKGKKINALDLIPRKEEIEEYESTYIKPEMYTEIYKNIKYVNKYWNDIQIKKNKLYEWDKNSTYIHKPPYFENMTLEIEKIQDIKDAHVLLFLGDSITTDHISPAGMIHKTSEAYKFLKTKNIKDQDLNTYGARRGNDEVMIRGTFANIRLINKLCPDKGPNTIHIPTNQLMSVYQAAMKYKQDNIDVIIIAGKEYGCGSSRDWAAKGPNLLGVKAVIAESYERIHRSNLIGMSVLPLQFINNQSPQYYNMDGTEKFTILLNDGNIKAQQTIKVQMNQKGKIIIFDVLCRIDTEIEERYFRNGGILKYVLRSLVNEANK,uniprot_search,Q9Y007,O=C(O)/C=C(/CC(=O)O)C(=O)O,0.0035,37.0,7.4,4.2.1.3,5833.0,-2.4559319556497243,-2.4559319556497243,O=C(O)/C=C(/CC(=O)O)C(=O)O__MHFRRCIRKYCINKKIVNPFEHVQRTLNEKNYYYYDINELHDSRIKSLPYSIRVLLESAVRNCDNLKVSEKNVETILGWKENCKKKKEVPFMPTRVLLQDLTGVPCIVDLATMRDTAEKLGCDAERINPLIPVDLVIDHSVQVDYSRREDALELNEKKEYERNLERFKFLKWGMNSFKNMLILPPGSGIVHQINLEYLAHCVFNKDNLLYPDSVVGTDSHTTMINGLGILGWGVGGIEAEATMLGLPISMTLPEVVGINVVGKLSDYLLSTDIVLYITSFLRKEVGVVNKYVEFFGTGLKDLKLADRATISNMAPEYGATVGFFPVDDITLEYLLQTGRDKEKVELIREYLMKNSMFNTYKDNVEYTDVYTLDLSKLNLSLSGPKRPHDNVLLSELHKDFTMCLESPIGFKGYNIAKEEREKKISFVCSKDGKEYVLSQGSVVLCAITSCTNTSNSSSMIAAGLLAKKAIEEFGLKSLPYIKSSLSPGSKTVQKYLEAGGLLKYLEQLGFYNVGYGCMTCIGNSGHLDEEVEEVINKNDLIVSSVLSGNRNFEGRVHPLIKANYLASPVLVVLFSIIGNVNVDLSNYTFNYKGKKINALDLIPRKEEIEEYESTYIKPEMYTEIYKNIKYVNKYWNDIQIKKNKLYEWDKNSTYIHKPPYFENMTLEIEKIQDIKDAHVLLFLGDSITTDHISPAGMIHKTSEAYKFLKTKNIKDQDLNTYGARRGNDEVMIRGTFANIRLINKLCPDKGPNTIHIPTNQLMSVYQAAMKYKQDNIDVIIIAGKEYGCGSSRDWAAKGPNLLGVKAVIAESYERIHRSNLIGMSVLPLQFINNQSPQYYNMDGTEKFTILLNDGNIKAQQTIKVQMNQKGKIIIFDVLCRIDTEIEERYFRNGGILKYVLRSLVNEANK,./data/raw/alphafold//AF-Q9Y007-F1-model_v4.pdb,1702,7084,8959,9223 +687,18242,18506,MSWSPSLTTQTCGAWEMKERLGTGGFGNVIRWHNQETGEQIAIKQCRQELSPRNRERWCLEIQIMRRLTHPNVVAARDVPEGMQNLAPNDLPLLAMEYCQGGDLRKYLNQFENCCGLREGAILTLLSDIASALRYLHENRIIHRDLKPENIVLQQGEQRLIHKIIDLGYAKELDQGSLCTSFVGTLQYLAPELLEQQKYTVTVDYWSFGTLAFECITGFRPFLPNWQPVQWHSKVRQKSEVDIVVSEDLNGTVKFSSSLPYPNNLNSVLAERLEKWLQLMLMWHPRQRGTDPTYGPNGCFKALDDILNLKLVHILNMVTGTIHTYPVTEDESLQSLKARIQQDTGIPEEDQELLQEAGLALIPDKPATQCISDGKLNEGHTLDMDLVFLFDNSKITYETQISPRPQPESVSCILQEPKRNLAFFQLRKVWGQVWHSIQTLKEDCNRLQQGQRAAMMNLLRNNSCLSKMKNSMASMSQQLKAKLDFFKTSIQIDLEKYSEQTEFGITSDKLLLAWREMEQAVELCGRENEVKLLVERMMALQTDIVDLQRSPMGRKQGGTLDDLEEQARELYRRLREKPRDQRTEGDSQEMVRLLLQAIQSFEKKVRVIYTQLSKTVVCKQKALELLPKVEEVVSLMNEDEKTVVRLQEKRQKELWNLLKIACSKVRGPVSGSPDSMNASRLSQPGQLMSQPSTASNSLPEPAKKSEELVAEAHNLCTLLENAIQDTVREQDQSFTALDWSWLQTEEEEHSCLEQAS,sabio,O14920,Cc1nc(N)nc(N)c1OCCCOc1cc(Cl)c(Cl)cc1Cl,0.00075,25.0,7.6,2.7.11.10,9606.0,-3.1249387366083,-3.1249387366083,Cc1nc(N)nc(N)c1OCCCOc1cc(Cl)c(Cl)cc1Cl__MSWSPSLTTQTCGAWEMKERLGTGGFGNVIRWHNQETGEQIAIKQCRQELSPRNRERWCLEIQIMRRLTHPNVVAARDVPEGMQNLAPNDLPLLAMEYCQGGDLRKYLNQFENCCGLREGAILTLLSDIASALRYLHENRIIHRDLKPENIVLQQGEQRLIHKIIDLGYAKELDQGSLCTSFVGTLQYLAPELLEQQKYTVTVDYWSFGTLAFECITGFRPFLPNWQPVQWHSKVRQKSEVDIVVSEDLNGTVKFSSSLPYPNNLNSVLAERLEKWLQLMLMWHPRQRGTDPTYGPNGCFKALDDILNLKLVHILNMVTGTIHTYPVTEDESLQSLKARIQQDTGIPEEDQELLQEAGLALIPDKPATQCISDGKLNEGHTLDMDLVFLFDNSKITYETQISPRPQPESVSCILQEPKRNLAFFQLRKVWGQVWHSIQTLKEDCNRLQQGQRAAMMNLLRNNSCLSKMKNSMASMSQQLKAKLDFFKTSIQIDLEKYSEQTEFGITSDKLLLAWREMEQAVELCGRENEVKLLVERMMALQTDIVDLQRSPMGRKQGGTLDDLEEQARELYRRLREKPRDQRTEGDSQEMVRLLLQAIQSFEKKVRVIYTQLSKTVVCKQKALELLPKVEEVVSLMNEDEKTVVRLQEKRQKELWNLLKIACSKVRGPVSGSPDSMNASRLSQPGQLMSQPSTASNSLPEPAKKSEELVAEAHNLCTLLENAIQDTVREQDQSFTALDWSWLQTEEEEHSCLEQAS,./data/raw/alphafold//AF-O14920-F1-model_v4.pdb,3859,4467,5935,3308 +689,10624,10780,MKDFFLFLGKFFKHGTAIASLAPSSPWLSRTTVRNIPWENARVVVELGAGTGPITKVIADRVHPDCRVIVLERDPDFARLLRERFANRANFDVVEGDVRDLTQILQQRGIEQADFVVSGLPVPSFPKELQRDLFRVVKQVLAPSGTFNQITEMPWVYQRFYRRFFDEVTFVFEPRNLPPAGAYFCRGVKESF,brenda,L0D9B6,CCCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCCCC)CC(O)=N[C@@H](CCCN)C(=O)O,0.0377,28.0,8.0,2.1.1.344,466153.0,-1.4236586497942072,-1.4236586497942072,CCCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCCCC)CC(O)=N[C@@H](CCCN)C(=O)O__MKDFFLFLGKFFKHGTAIASLAPSSPWLSRTTVRNIPWENARVVVELGAGTGPITKVIADRVHPDCRVIVLERDPDFARLLRERFANRANFDVVEGDVRDLTQILQQRGIEQADFVVSGLPVPSFPKELQRDLFRVVKQVLAPSGTFNQITEMPWVYQRFYRRFFDEVTFVFEPRNLPPAGAYFCRGVKESF,./data/raw/alphafold//AF-L0D9B6-F1-model_v4.pdb,5460,3124,3860,4490 +698,29281,29804,MVDKAVSEFWQNIPAIANPFKPDALPEAYIPNAATDDERYYVPFTETVSSRPLWISPSQNKWCDILMAKEAGLVNRHYHPHEVFAYTLSGKWGYLEHEWTATRGDFVYETPGEGHTLVAFDHPEPMRAFFIVTGPLIWLDEEGNPDGYFDVHSYIAMCKAHYEKVGLGAQAIEKLFR,brenda,F7J5X4,O=C(CO)c1ccc(O)cc1,0.0016,25.0,7.0,1.13.11.41,36773.0,-2.7958800173440754,-2.7958800173440754,O=C(CO)c1ccc(O)cc1__MVDKAVSEFWQNIPAIANPFKPDALPEAYIPNAATDDERYYVPFTETVSSRPLWISPSQNKWCDILMAKEAGLVNRHYHPHEVFAYTLSGKWGYLEHEWTATRGDFVYETPGEGHTLVAFDHPEPMRAFFIVTGPLIWLDEEGNPDGYFDVHSYIAMCKAHYEKVGLGAQAIEKLFR,./data/raw/alphafold//AF-F7J5X4-F1-model_v4.pdb,1682,7058,8924,9179 +707,39348,40047,MISLRIALAINALSYICALVELAVADDYRPTFHFCPAENWMNEPNGLIKIDSTWHLFYQADPTANVWGNECWGHATSSDLLHWDHLPVAIPVENGIESFTGTSYYDANNTSSLGTSTNPPYLAFFTGYTSSNGTQDQRLAYSTDLGTTWLKFSGNPIISAALEAPHDVTGGLESRDPKVFFHEPSGKWVMVLAHGGQDKLTFWTSLDAKSWTWMSDLLASQIEGFPSSVTGWEVPDMFQLPIQGTNETTWVIIFTPAQGSPAGGNGVVALTGSFDGETFLANPVDSSTLWLDYGRDFDGAMSWENVPASDGRLIIAAVMNSYGSNPPTNTWKGMLSFPRTLTLEKIGSKQYFLQQPIAELSTVDNALASIQNQTIAPKQTLLSSIHGSSLDVRIAFSVDSGATLSLAVRKGGSEQTVIRYSQSNSTLSVDRTASGDISYDPAAGGIHSAQLARDNTELVYLRVLVDTCSVEVFGGQGEAVISDLIFPSNSSDGLSLEVIGGTATLQSVEVFSVSL,brenda,O00056,OC[C@H]1O[C@@](CO)(OC[C@@]2(OC[C@@]3(OC[C@@]4(OC[C@@]5(O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)O[C@H](CO)[C@@H](O)[C@@H]5O)O[C@H](CO)[C@@H](O)[C@@H]4O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O,0.78,55.0,5.4,3.2.1.7,1266744.0,-0.1079053973095195,-0.3928430512878001,OC[C@H]1O[C@@](CO)(OC[C@@]2(OC[C@@]3(OC[C@@]4(OC[C@@]5(O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)O[C@H](CO)[C@@H](O)[C@@H]5O)O[C@H](CO)[C@@H](O)[C@@H]4O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H]1O__MISLRIALAINALSYICALVELAVADDYRPTFHFCPAENWMNEPNGLIKIDSTWHLFYQADPTANVWGNECWGHATSSDLLHWDHLPVAIPVENGIESFTGTSYYDANNTSSLGTSTNPPYLAFFTGYTSSNGTQDQRLAYSTDLGTTWLKFSGNPIISAALEAPHDVTGGLESRDPKVFFHEPSGKWVMVLAHGGQDKLTFWTSLDAKSWTWMSDLLASQIEGFPSSVTGWEVPDMFQLPIQGTNETTWVIIFTPAQGSPAGGNGVVALTGSFDGETFLANPVDSSTLWLDYGRDFDGAMSWENVPASDGRLIIAAVMNSYGSNPPTNTWKGMLSFPRTLTLEKIGSKQYFLQQPIAELSTVDNALASIQNQTIAPKQTLLSSIHGSSLDVRIAFSVDSGATLSLAVRKGGSEQTVIRYSQSNSTLSVDRTASGDISYDPAAGGIHSAQLARDNTELVYLRVLVDTCSVEVFGGQGEAVISDLIFPSNSSDGLSLEVIGGTATLQSVEVFSVSL,./data/raw/alphafold//AF-O00056-F1-model_v4.pdb,2701,8438,8483,11608 +720,16067,16303,MRSKRFEALAKRPVNQDGFVKEWIEEGFIAMESPNDPKPSIKIVNGAVTELDGKPVSDFDLIDHFIARYGINLNRAEEVMAMDSVKLANMLCDPNVKRSEIVPLTTAMTPAKIVEVVSHMNVVEMMMAMQKMRARRTPSQQAHVTNVKDNPVQIAADAAEGAWRGFDEQETTVAVARYAPFNAIALLVGSQVGRPGVLTQCSLEEATELKLGMLGHTCYAETISVYGTEPVFTDGDDTPWSKGFLASSYASRGLKMRFTSGSGSEVQMGYAEGKSMLYLEARCIYITKAAGVQGLQNGSVSCIGVPSAVPSGIRAVLAENLICSSLDLECASSNDQTFTHSDMRRTARLLMQFLPGTDFISSGYSAVPNYDNMFAGSNEDAEDFDDYNVIQRDLKVDGGLRPVREEDVIAIRNKAARALQAVFAGMGLPPITDEEVEAATYAHGSKDMPERNIVEDIKFAQEIINKNRNGLEVVKALAQGGFTDVAQDMLNIQKAKLTGDYLHTSAIIVGDGQVLSAVNDVNDYAGPATGYRLQGERWEEIKNIPGALDPNEID,brenda,Q59470,C[C@H](O)CO,0.11,37.0,8.0,4.2.1.28,571.0,-0.958607314841775,-0.958607314841775,C[C@H](O)CO__MRSKRFEALAKRPVNQDGFVKEWIEEGFIAMESPNDPKPSIKIVNGAVTELDGKPVSDFDLIDHFIARYGINLNRAEEVMAMDSVKLANMLCDPNVKRSEIVPLTTAMTPAKIVEVVSHMNVVEMMMAMQKMRARRTPSQQAHVTNVKDNPVQIAADAAEGAWRGFDEQETTVAVARYAPFNAIALLVGSQVGRPGVLTQCSLEEATELKLGMLGHTCYAETISVYGTEPVFTDGDDTPWSKGFLASSYASRGLKMRFTSGSGSEVQMGYAEGKSMLYLEARCIYITKAAGVQGLQNGSVSCIGVPSAVPSGIRAVLAENLICSSLDLECASSNDQTFTHSDMRRTARLLMQFLPGTDFISSGYSAVPNYDNMFAGSNEDAEDFDDYNVIQRDLKVDGGLRPVREEDVIAIRNKAARALQAVFAGMGLPPITDEEVEAATYAHGSKDMPERNIVEDIKFAQEIINKNRNGLEVVKALAQGGFTDVAQDMLNIQKAKLTGDYLHTSAIIVGDGQVLSAVNDVNDYAGPATGYRLQGERWEEIKNIPGALDPNEID,./data/raw/alphafold//AF-Q59470-F1-model_v4.pdb,5819,2640,5127,5447 +729,10114,10268,MAKVMRLIIFVCVALVAISVPAASSVQSQQERIRPGFRQQLPSSIRPFSAFRRRGQEASDSVVYLNIVYLRLVGTRQCATGELTVVVHGKALNNATLGDVQTSLTRTFASSLKEPSSTLAIRRWSWKDPLFLMLTLNRRAVRTGTGLPRSTPLYQVAKQRLFVFVRKPTPTSSCRRAALDPRPLYGVPKVGVQDKYTLHVSMDVLGMSLREPLEHQEEEPGPASVSTYAAAQAILDGASSFGIGAFGSAKPNLKQISMYASGAELEKQVYTPTTSQLALFLPSKTFFGVEVTSVSDGTFRIPVSASRLVPFSAMSYMCTGSQTHKLTQTGMNVLEKRVHGKENPPSEGAEVLLNLLAARKPVNGVFEQDPTVVLLQLWRTPEGSESWQETPLMWEFPDTLEAIEDAGEYRSGILSSIAANTRIIGKMAGWLASRSFSRRFIRTLIRLNNIDLEEAFSMSDKDRRHSAADFRSVQEFFTRPINYHVYRDMDPRASIMAPADSLIQNIYTIRPDFKGEISHPIIPQVKSTSFNLREFLYGARQVPPLQLQSPSNRLFVSILYLAPSDYHRVHSPADWRVTSQTYIPGCTPSVSRRNLEAGDLLHRYERTALIGHWDPEKNGQQLFFSVTMVAAMFVGGLRLSWEEEPLGASMRLGRCTRYTESYEKQVDVELCASQEIGAFRFGSTVVMIFEAPEDFDMTSVGQCSHVAAGQPAGYLGQGRERPLQERCNAFRGNFESPFHFWKHLQKTSSVDDILKQNTLAPRAWRQEPGRVWAEVLRATERGLLYGFALSHYLLKRWATENGNLGELVLGQPEVLRQNINGSDSVIREGFRCFAAKDKKQIRLQMSGRQSQVSLTATVTPDEQFLFQHPFYGCVGDEKLGKLVRGIDATWILLPERAVLLTLKVSTGSKQEDGRVLRVATTKIEVQTEPCQGGWEESRVGTTSTTCAIRTVEKREESISEGVLTNGDL,sabio,F6N7K6,CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](N)C(=O)O)OC(=O)CCCCCCC/C=C\CCCCCCCC,0.067,37.0,6.8,4.1.1.65,5811.0,-1.1739251972991736,-1.1739251972991736,CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](N)C(=O)O)OC(=O)CCCCCCC/C=C\CCCCCCCC__MAKVMRLIIFVCVALVAISVPAASSVQSQQERIRPGFRQQLPSSIRPFSAFRRRGQEASDSVVYLNIVYLRLVGTRQCATGELTVVVHGKALNNATLGDVQTSLTRTFASSLKEPSSTLAIRRWSWKDPLFLMLTLNRRAVRTGTGLPRSTPLYQVAKQRLFVFVRKPTPTSSCRRAALDPRPLYGVPKVGVQDKYTLHVSMDVLGMSLREPLEHQEEEPGPASVSTYAAAQAILDGASSFGIGAFGSAKPNLKQISMYASGAELEKQVYTPTTSQLALFLPSKTFFGVEVTSVSDGTFRIPVSASRLVPFSAMSYMCTGSQTHKLTQTGMNVLEKRVHGKENPPSEGAEVLLNLLAARKPVNGVFEQDPTVVLLQLWRTPEGSESWQETPLMWEFPDTLEAIEDAGEYRSGILSSIAANTRIIGKMAGWLASRSFSRRFIRTLIRLNNIDLEEAFSMSDKDRRHSAADFRSVQEFFTRPINYHVYRDMDPRASIMAPADSLIQNIYTIRPDFKGEISHPIIPQVKSTSFNLREFLYGARQVPPLQLQSPSNRLFVSILYLAPSDYHRVHSPADWRVTSQTYIPGCTPSVSRRNLEAGDLLHRYERTALIGHWDPEKNGQQLFFSVTMVAAMFVGGLRLSWEEEPLGASMRLGRCTRYTESYEKQVDVELCASQEIGAFRFGSTVVMIFEAPEDFDMTSVGQCSHVAAGQPAGYLGQGRERPLQERCNAFRGNFESPFHFWKHLQKTSSVDDILKQNTLAPRAWRQEPGRVWAEVLRATERGLLYGFALSHYLLKRWATENGNLGELVLGQPEVLRQNINGSDSVIREGFRCFAAKDKKQIRLQMSGRQSQVSLTATVTPDEQFLFQHPFYGCVGDEKLGKLVRGIDATWILLPERAVLLTLKVSTGSKQEDGRVLRVATTKIEVQTEPCQGGWEESRVGTTSTTCAIRTVEKREESISEGVLTNGDL,./data/raw/alphafold//AF-F6N7K6-F1-model_v4.pdb,5525,3065,3791,4405 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+742,36504,37139,MKSWGLLLVAALALSGSYAVDRNNFKTCDQSGFCKRLRGFKPEKSEYSLNLDTVLVHGNVLSAEVDTVDTTAQERKVLWHYAMRLSALVDGTFRVEIDEVDPLYPRYRTQLALDGEPKADGLKLLSNENGKLTLMNSQGHKVVIRATPLKIEFLNKAGDVAVVLNDNAQLVVEPLRVKKERIDDEDGNAVEVEEEGTWGESFKSHHDSKPRGNEAVSLDFSFPDADNVYGIPEHTDKFALKTTTSGEPYRLFNLDVFEYELDSRMALYGAVPVMYSHGPKHSAGVFWHNSAETWVDVVNYADSTVVSSLVNLVTGGQKRRVDARFISESGIVDVFVFLGEKPADVFRQYAMLTGPAPLPPKFSLAYHQCRWNYVDEADVRSVDNGFDEHDIPADVIWLDIEYTDRKKYFTWDALKFPNPAEMVANLTSKGRKLVTIIDPHVKREAGYFLHEDATDLGYYVKDKEGKDYEGWCWPGSSSYLDFFNPVVSKYYAERYSFDNFPGTSKDVHIWNDMNEPSVFNGPEITMPKDCRHYKPPQDGNDGLAAFWEHRHVHNEYGLWNIRATHDGMLQRADNKYRPFILTRSAFAGTQRYAAVWTGDNMAEWGFLAVSVPMCLSLASAGISFCGSDVGGFFKYPEAELMTRWYQAGAFQPFFRAHSHIETKRREPWLYEPATTALLRDATRRRYALIDFWYTLFYEHSVDGLPVMRALFQEYPGEEDTYTIDDQYLLGNKLLVRPVVEPGVSNVKVYLPGAATRTLWYDVDTYHAYPANGYLTFDVTLSKIPVFQRGGSIVLRKERVRRSSALMADDPYTIVVALDANGTSEGSLYIDDGETYDYRNNKYIYAKLAYETGSMTYSFVNEKASYPTRSWVERIVIAGIKNPPKTAKLVQGDKQTSLQMTLHKGNDVLVVRKPAASMAQPWKIIFSY,brenda,L8B8V1,O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,2.37,37.0,6.5,3.2.1.207,7108.0,0.3747483460101038,0.3747483460101038,O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1__MKSWGLLLVAALALSGSYAVDRNNFKTCDQSGFCKRLRGFKPEKSEYSLNLDTVLVHGNVLSAEVDTVDTTAQERKVLWHYAMRLSALVDGTFRVEIDEVDPLYPRYRTQLALDGEPKADGLKLLSNENGKLTLMNSQGHKVVIRATPLKIEFLNKAGDVAVVLNDNAQLVVEPLRVKKERIDDEDGNAVEVEEEGTWGESFKSHHDSKPRGNEAVSLDFSFPDADNVYGIPEHTDKFALKTTTSGEPYRLFNLDVFEYELDSRMALYGAVPVMYSHGPKHSAGVFWHNSAETWVDVVNYADSTVVSSLVNLVTGGQKRRVDARFISESGIVDVFVFLGEKPADVFRQYAMLTGPAPLPPKFSLAYHQCRWNYVDEADVRSVDNGFDEHDIPADVIWLDIEYTDRKKYFTWDALKFPNPAEMVANLTSKGRKLVTIIDPHVKREAGYFLHEDATDLGYYVKDKEGKDYEGWCWPGSSSYLDFFNPVVSKYYAERYSFDNFPGTSKDVHIWNDMNEPSVFNGPEITMPKDCRHYKPPQDGNDGLAAFWEHRHVHNEYGLWNIRATHDGMLQRADNKYRPFILTRSAFAGTQRYAAVWTGDNMAEWGFLAVSVPMCLSLASAGISFCGSDVGGFFKYPEAELMTRWYQAGAFQPFFRAHSHIETKRREPWLYEPATTALLRDATRRRYALIDFWYTLFYEHSVDGLPVMRALFQEYPGEEDTYTIDDQYLLGNKLLVRPVVEPGVSNVKVYLPGAATRTLWYDVDTYHAYPANGYLTFDVTLSKIPVFQRGGSIVLRKERVRRSSALMADDPYTIVVALDANGTSEGSLYIDDGETYDYRNNKYIYAKLAYETGSMTYSFVNEKASYPTRSWVERIVIAGIKNPPKTAKLVQGDKQTSLQMTLHKGNDVLVVRKPAASMAQPWKIIFSY,./data/raw/alphafold//AF-L8B8V1-F1-model_v4.pdb,2491,8114,9985,11168 +755,24715,25104,MFTSTGSSGLYKAPLSKSLLLVPSALSLLLTLLLPHCQKFFVYDLHAVKHDLQIWRLICGRIICLDLKDAFCSGLLIYNFRIFERRYGSRKFASFLLGSWVLSALFDFILVEAVQYSLGVTVASNLPSGFLAPVFALFVPFHCSIPRVQVAQILGPLSITNKTLIYILGLQLFTSGSYIWIVAMSGLISGMCYDRKVLQVHQVLRIPGRMAEFFSWALEPIFSSSEPTSEARVGMGATVDIQRQQRMEQLDRQLMLSQFAQVRRQRQQQGGMINWNRLFPPLRQRRNINYQDGPRSEQRASPPLEVSEEQVARLMEMGFSRGDALEALRASNNDLNVATNFLLQH,brenda,Q8R1K1,NC[C@@H](CC[C@H](N)C(=O)O)OP(=O)(O)O,0.0169,30.0,7.4,4.2.3.134,10090.0,-1.7721132953863266,-1.7721132953863266,NC[C@@H](CC[C@H](N)C(=O)O)OP(=O)(O)O__MFTSTGSSGLYKAPLSKSLLLVPSALSLLLTLLLPHCQKFFVYDLHAVKHDLQIWRLICGRIICLDLKDAFCSGLLIYNFRIFERRYGSRKFASFLLGSWVLSALFDFILVEAVQYSLGVTVASNLPSGFLAPVFALFVPFHCSIPRVQVAQILGPLSITNKTLIYILGLQLFTSGSYIWIVAMSGLISGMCYDRKVLQVHQVLRIPGRMAEFFSWALEPIFSSSEPTSEARVGMGATVDIQRQQRMEQLDRQLMLSQFAQVRRQRQQQGGMINWNRLFPPLRQRRNINYQDGPRSEQRASPPLEVSEEQVARLMEMGFSRGDALEALRASNNDLNVATNFLLQH,./data/raw/alphafold//AF-Q8R1K1-F1-model_v4.pdb,4833,6064,7843,10394 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+785,13904,14105,GTSTVALIAVIISSILYLLFGGSGHKNLPPGPKPWPIVGNLLQLGEKPHAQFAELAQTYGDIFTLKMGTETVVVASTSSAASEILKTHDRILSARYVFQSFRVKGHVENSIVWSDCTETWKNLRKVCRTELFTQKMIESQAHVREKKCEEMVEYLMKKQGEEVKIVEVIFGTLVNIFGNLIFSQNIFELGDPNSGSSEFKEYLWRMLELGNSTNPADYFPMLGKFDLFGQRKEVAECLKGIYAIWGAMLQERKLAKKVDGYKSKNDFVDVCLDSGLNDYQINALLMELFGAGTETSASTIEWAMTELTKNPKITAKIRSEIQTVVGERSVKESDFPNLPYLEATVKETLRLHPPTPLLLPRRALETCTILNYTIPKDCQIMVNAWGIGRDPKTWTDPLTFSPERFLNSSVDFRGNDFSLIPFGAGRRICPGLPIANQFIALLVATFVQNLDWCLPNGMSVDHLIVEEKFGLTLQKEPPLFIVPKSRV,sabio,O64899,COc1cc2c(cc1O)C(Cc1ccc(O)cc1)N(C)CC2,0.015,37.0,8.0,1.14.14.102,3467.0,-1.8239087409443189,-1.8239087409443189,COc1cc2c(cc1O)C(Cc1ccc(O)cc1)N(C)CC2__GTSTVALIAVIISSILYLLFGGSGHKNLPPGPKPWPIVGNLLQLGEKPHAQFAELAQTYGDIFTLKMGTETVVVASTSSAASEILKTHDRILSARYVFQSFRVKGHVENSIVWSDCTETWKNLRKVCRTELFTQKMIESQAHVREKKCEEMVEYLMKKQGEEVKIVEVIFGTLVNIFGNLIFSQNIFELGDPNSGSSEFKEYLWRMLELGNSTNPADYFPMLGKFDLFGQRKEVAECLKGIYAIWGAMLQERKLAKKVDGYKSKNDFVDVCLDSGLNDYQINALLMELFGAGTETSASTIEWAMTELTKNPKITAKIRSEIQTVVGERSVKESDFPNLPYLEATVKETLRLHPPTPLLLPRRALETCTILNYTIPKDCQIMVNAWGIGRDPKTWTDPLTFSPERFLNSSVDFRGNDFSLIPFGAGRRICPGLPIANQFIALLVATFVQNLDWCLPNGMSVDHLIVEEKFGLTLQKEPPLFIVPKSRV,./data/raw/alphafold//AF-O64899-F1-model_v4.pdb,368,3561,4866,5164 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+918,35790,36417,MAIALWYCPPQGSVAYETLQMLIFSFQTLFPDSPVFEPHVTVTSHLVCNSKDDVNKILTSCVAAIQSIRSHQTAKKGRKGQVSHAVAAPLVSFNGCSVGKQYFKKIVLECNKNKILYGVAQVMREMYVEIDPETRSSRAATWVHEEFHPHVSLLYSDIHPVSQASLRVVQQRIEDALDVQLVPREKRKGSGNADGSNEVQMRWDFDVSSSLSWNIPGTFKVVNCVGPVQEWEVLGRVDV,sabio,P53314,O=P1([O-])OC2O[C@H](CO)[C@@H](O1)[C@H]2O,0.33,37.0,7.0,3.1.4.-,4932.0,-0.4814860601221125,-0.4814860601221125,O=P1([O-])OC2O[C@H](CO)[C@@H](O1)[C@H]2O__MAIALWYCPPQGSVAYETLQMLIFSFQTLFPDSPVFEPHVTVTSHLVCNSKDDVNKILTSCVAAIQSIRSHQTAKKGRKGQVSHAVAAPLVSFNGCSVGKQYFKKIVLECNKNKILYGVAQVMREMYVEIDPETRSSRAATWVHEEFHPHVSLLYSDIHPVSQASLRVVQQRIEDALDVQLVPREKRKGSGNADGSNEVQMRWDFDVSSSLSWNIPGTFKVVNCVGPVQEWEVLGRVDV,./data/raw/alphafold//AF-P53314-F1-model_v4.pdb,2344,7919,9744,10910 +933,36087,36715,MGNGMNKILPGLYIGNFKDARDAEQLSKNKVTHILSVHDSARPMLEGVKYLCIPAADSPSQNLTRHFKESIKFIHECRLRGESCLVHCLAGVSRSVTLVIAYIMTVTDFGWEDALHTVRAGRSCANPNVGFQRQLQEFEKHEVHQYRQWLKEEYGESPLQDAEEAKNILAAPGILKFWAFLRRL,sabio,Q9NRW4,O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,0.412,30.0,6.0,3.1.3.48,9606.0,-0.3851027839668654,-0.3851027839668654,O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MGNGMNKILPGLYIGNFKDARDAEQLSKNKVTHILSVHDSARPMLEGVKYLCIPAADSPSQNLTRHFKESIKFIHECRLRGESCLVHCLAGVSRSVTLVIAYIMTVTDFGWEDALHTVRAGRSCANPNVGFQRQLQEFEKHEVHQYRQWLKEEYGESPLQDAEEAKNILAAPGILKFWAFLRRL,./data/raw/alphafold//AF-Q9NRW4-F1-model_v4.pdb,2386,7976,9814,10983 +955,14975,15188,MRRAVLEILEERIIHNVKEIHRFSGKRIIAVVKANAYGIGVREVSRILEGLEEVDAFAVACTQEGVELRECGIKKKILILGGILEEDVKLLEEYDLTPVISDPEHLKVLKDRNIKFHVKYDTGMGRLGFTNEIIKDPRVEGVMSHFSSPADRNFSKLQIKRFEEILKNYEKVKYIHLESSAGLIYRVPFTTHVRVGLAIYGEKPLKDYPLEVKPALRLRARLISVKELPENYPVSYGRTYITKRKTKLGVVAFGYADGLMKTLSNRSFLIFEGRKVPIIGNITMDMTMVDLSGTEARTGDWVYIVNEERSFTPLARDAGTIPYEIMCNLSRRVERLVIKKR,uniprot_search,Q9RER4,C[C@@H](N)C(=O)O,1.8,90.0,9.5,5.1.1.1,2714.0,0.255272505103306,0.255272505103306,C[C@@H](N)C(=O)O__MRRAVLEILEERIIHNVKEIHRFSGKRIIAVVKANAYGIGVREVSRILEGLEEVDAFAVACTQEGVELRECGIKKKILILGGILEEDVKLLEEYDLTPVISDPEHLKVLKDRNIKFHVKYDTGMGRLGFTNEIIKDPRVEGVMSHFSSPADRNFSKLQIKRFEEILKNYEKVKYIHLESSAGLIYRVPFTTHVRVGLAIYGEKPLKDYPLEVKPALRLRARLISVKELPENYPVSYGRTYITKRKTKLGVVAFGYADGLMKTLSNRSFLIFEGRKVPIIGNITMDMTMVDLSGTEARTGDWVYIVNEERSFTPLARDAGTIPYEIMCNLSRRVERLVIKKR,./data/raw/alphafold//AF-Q9RER4-F1-model_v4.pdb,488,3748,5100,5419 +965,32823,33408,MSSLNQLVSGLASGAVRIVDLTHTLDPDFPVIVLPPEFGQCARFRMEEISAYDHRGPAWKWHNISMSEHTGTHFDAPSHWISGKDVPNGSVDEIPAEAFVGPVVVIDCSKGAAENDDFELTPEIIAGWESEHGRIPEDAWVLMRTDWSKRRGADYLNMRADGPHSPGPTPEAIRFLIEERNIRGFGTETVGTDAGQGAHYVPPYPAHYLLHGAGKYGLQCLANLDQLPATGAVLIAAPLKIKNGTGSPLRVLAMVTE,brenda,A0P0F0,O=C1Nc2ccccc2C1=O,0.0157,40.0,8.15,3.5.2.20,187304.0,-1.8041003475907664,-1.8041003475907664,O=C1Nc2ccccc2C1=O__MSSLNQLVSGLASGAVRIVDLTHTLDPDFPVIVLPPEFGQCARFRMEEISAYDHRGPAWKWHNISMSEHTGTHFDAPSHWISGKDVPNGSVDEIPAEAFVGPVVVIDCSKGAAENDDFELTPEIIAGWESEHGRIPEDAWVLMRTDWSKRRGADYLNMRADGPHSPGPTPEAIRFLIEERNIRGFGTETVGTDAGQGAHYVPPYPAHYLLHGAGKYGLQCLANLDQLPATGAVLIAAPLKIKNGTGSPLRVLAMVTE,./data/raw/alphafold//AF-A0P0F0-F1-model_v4.pdb,2035,7576,6261,9942 +982,38961,39653,MALTRNRPFVVVLLLGFVIMSTITIGAQSIGVCYGRNGNNLPSASQVINLYKSNGIGSMRIYDPNSDTLQALRGSDIELILDVPNTDLQSLASDASAAATWVQNNVVNYASEVKFRYIAVGNEVLPTGSNAQYAQYVLPAMKNVQSAITSAGLQDQIKVSTATFSAVLGKSYPPSEGSFSDDVSSFINPIISFLAENGSPLLANIYPYFSYTGDTQNIRLDYALFTASGVVVQDGSYQYQNLFDALLDALYAALEKAGGSNLKIVVSESGWPSEGGTAATVDNARTYYKNLINHVKGGTPRKSGAIETYLFAMFDENQKTGLETEKHFGLFTPGQESKYQISFS,brenda,A7PQW3,OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@@H]3[C@@H](O)[C@@H](O)O[C@H](CO)[C@H]3O)O[C@H](CO)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,0.228,37.0,5.4,3.2.1.39,29760.0,-0.6420651529995463,-0.6420651529995463,OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@@H]3[C@@H](O)[C@@H](O)O[C@H](CO)[C@H]3O)O[C@H](CO)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O__MALTRNRPFVVVLLLGFVIMSTITIGAQSIGVCYGRNGNNLPSASQVINLYKSNGIGSMRIYDPNSDTLQALRGSDIELILDVPNTDLQSLASDASAAATWVQNNVVNYASEVKFRYIAVGNEVLPTGSNAQYAQYVLPAMKNVQSAITSAGLQDQIKVSTATFSAVLGKSYPPSEGSFSDDVSSFINPIISFLAENGSPLLANIYPYFSYTGDTQNIRLDYALFTASGVVVQDGSYQYQNLFDALLDALYAALEKAGGSNLKIVVSESGWPSEGGTAATVDNARTYYKNLINHVKGGTPRKSGAIETYLFAMFDENQKTGLETEKHFGLFTPGQESKYQISFS,./data/raw/alphafold//AF-A7PQW3-F1-model_v4.pdb,2665,8370,10308,11531 +998,10915,11071,MATLFIADLHLCVEEPAITAGFLRFLAGEARKADALYILGDLFEAWIGDDDPNPLHRKMAAAIKAVSDSGVPCYFIHGNRDFLLGKRFARESGMTLLPEEKVLELYGRRVLIMHGDTLCTDDAGYQAFRAKVHKPWLQTLFLALPLFVRKRIAARMRANSKEANSSKSLAIMDVNQNAVVSAMEKHQVQWLIHGHTHRPAVHELIANQQPAFRVVLGAWHTEGSMVKVTADDVELIHFPF,brenda,P43341,CCCCCCCCCCC[C@@H](O)CC(=O)O[C@H]1[C@H](O)[C@@H](CO)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)[C@@H]1N=C(O)C[C@H](O)CCCCCCCCCCC,0.0617,30.0,8.0,3.6.1.54,562.0,-1.2097148359667584,-1.2097148359667584,CCCCCCCCCCC[C@@H](O)CC(=O)O[C@H]1[C@H](O)[C@@H](CO)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)[C@@H]1N=C(O)C[C@H](O)CCCCCCCCCCC__MATLFIADLHLCVEEPAITAGFLRFLAGEARKADALYILGDLFEAWIGDDDPNPLHRKMAAAIKAVSDSGVPCYFIHGNRDFLLGKRFARESGMTLLPEEKVLELYGRRVLIMHGDTLCTDDAGYQAFRAKVHKPWLQTLFLALPLFVRKRIAARMRANSKEANSSKSLAIMDVNQNAVVSAMEKHQVQWLIHGHTHRPAVHELIANQQPAFRVVLGAWHTEGSMVKVTADDVELIHFPF,./data/raw/alphafold//AF-P43341-F1-model_v4.pdb,5397,3175,3916,4560 +1004,20349,20656,MLPVKNLFVLYTGGTIGMLETPRGLAPAGGFETRMRDHLRTLGDAPDLRWRFAELQPPLDSANMSQGNWLAMRDAIVAALDAGHDGVLLLHGTDTLAYSAAALSFLLLDLPVPVLLTGSMLPAGAPGSDAWDNLVGALRVLQAGHARGVQVYFNDALLHGARVSKLRSDAFDAFAELPRPRQAEHAPVPATLGYRQPRREVNLAVLPLYPGLRAAHLRGLLDSGVEALLLECYGSGTGPSDDEELLAALREAHARGVLLAAVSQCAYGAVEFGVYAAGSRLRDAGLVSAGGMTREAALGKLFGLLGAGLGRDDAQRWFALDLCGENAD,brenda,A0A0U3U5E8,N=C(O)C[C@H](N)C(=O)O,63.3,37.0,7.5,3.5.1.1,287.0,1.801403710017355,1.801403710017355,N=C(O)C[C@H](N)C(=O)O__MLPVKNLFVLYTGGTIGMLETPRGLAPAGGFETRMRDHLRTLGDAPDLRWRFAELQPPLDSANMSQGNWLAMRDAIVAALDAGHDGVLLLHGTDTLAYSAAALSFLLLDLPVPVLLTGSMLPAGAPGSDAWDNLVGALRVLQAGHARGVQVYFNDALLHGARVSKLRSDAFDAFAELPRPRQAEHAPVPATLGYRQPRREVNLAVLPLYPGLRAAHLRGLLDSGVEALLLECYGSGTGPSDDEELLAALREAHARGVLLAAVSQCAYGAVEFGVYAAGSRLRDAGLVSAGGMTREAALGKLFGLLGAGLGRDDAQRWFALDLCGENAD,./data/raw/alphafold//AF-A0A0U3U5E8-F1-model_v4.pdb,4209,5107,7013,7018 +1029,25004,25394,MPYLQPPRPHPHPHPTSRLSRASPPSPFPFFPAGTSRSGRLQPVPVSGHSASRVSKGKFAVAAVTLDDYLPMRSTEVKNRTSTDGIKSLRLITAVKTPYLPDGRFDLEAYDSLINTQINGGAEGVIVGGTTGEGHLMSWDEHIMLIGHTVNCFGANIKVIGNTGSNSTREAVHATEQGFAVGMHAALHVNPYYGKTSTEGLISHFKEVLPMGPTIIYNVPSRTSQDIPPPVIEALSSYSNMAGVKECVGHERVKCYTDKGISIWSGNDDECHDSRWKYGATGVISVASNLVPGLMHSLMFEGENAALNEKLLPLMKWLFCEPNPIGLNTALAQLGVVRPVFRLPYTPLPLEKRVEFVRIVEAIGRENFVGQKESRVLDDDDFVLISRY,brenda,P24846,N[C@@H](CC=O)C(=O)O,0.07,30.0,8.0,4.3.3.7,4565.0,-1.154901959985743,-1.154901959985743,N[C@@H](CC=O)C(=O)O__MPYLQPPRPHPHPHPTSRLSRASPPSPFPFFPAGTSRSGRLQPVPVSGHSASRVSKGKFAVAAVTLDDYLPMRSTEVKNRTSTDGIKSLRLITAVKTPYLPDGRFDLEAYDSLINTQINGGAEGVIVGGTTGEGHLMSWDEHIMLIGHTVNCFGANIKVIGNTGSNSTREAVHATEQGFAVGMHAALHVNPYYGKTSTEGLISHFKEVLPMGPTIIYNVPSRTSQDIPPPVIEALSSYSNMAGVKECVGHERVKCYTDKGISIWSGNDDECHDSRWKYGATGVISVASNLVPGLMHSLMFEGENAALNEKLLPLMKWLFCEPNPIGLNTALAQLGVVRPVFRLPYTPLPLEKRVEFVRIVEAIGRENFVGQKESRVLDDDDFVLISRY,./data/raw/alphafold//AF-P24846-F1-model_v4.pdb,1017,6119,7911,10468 +1041,30370,30907,MSSEKPETITHVGCNRFGFDSTVDIETLRSLYLSPAYIKEGGDVKVSLDAPQKDFSTETTYDHNTNTIQYSTVNKFPPVKLLPNHERKRILVTGGAGFVGSHLVDRLMLLGHEVTVLDNFFTGSRTTVSHWIGHPNFEMVRHDVVEPFLIEVDQIYHLACPASPPHYQINAVKTLKTSFEGTLNMLGLAKRTGARFLITSTSEVYGDPEEHPQREDYWGHVNCIGPRACYDEGKRVAETLTYGYHRKDGVEVRVARIFNTFGPRMNPYDGRVVSNFIIQALKGEDMTVYGDGSQTRSFQYVHDLIDGLILLMNGPDTRPVNIGNGDEFTILEFAEAVRDIVEKVQKEEGNPLAKRVNIIHKEIPIDDPQRRRPDTTRAKESLQWQPRWNVRQGVEEMVRYYSARIREGAI,sabio,Q96V00,O=C(O)C1OC(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)C(O)C(O)C1O,0.7,23.0,7.4,4.1.1.35,5207.0,-0.1549019599857432,-0.1549019599857432,O=C(O)C1OC(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)C(O)C(O)C1O__MSSEKPETITHVGCNRFGFDSTVDIETLRSLYLSPAYIKEGGDVKVSLDAPQKDFSTETTYDHNTNTIQYSTVNKFPPVKLLPNHERKRILVTGGAGFVGSHLVDRLMLLGHEVTVLDNFFTGSRTTVSHWIGHPNFEMVRHDVVEPFLIEVDQIYHLACPASPPHYQINAVKTLKTSFEGTLNMLGLAKRTGARFLITSTSEVYGDPEEHPQREDYWGHVNCIGPRACYDEGKRVAETLTYGYHRKDGVEVRVARIFNTFGPRMNPYDGRVVSNFIIQALKGEDMTVYGDGSQTRSFQYVHDLIDGLILLMNGPDTRPVNIGNGDEFTILEFAEAVRDIVEKVQKEEGNPLAKRVNIIHKEIPIDDPQRRRPDTTRAKESLQWQPRWNVRQGVEEMVRYYSARIREGAI,./data/raw/alphafold//AF-Q96V00-F1-model_v4.pdb,1786,7223,9155,9477 +1047,4114,4182,MRRSGNYQAPVWNNDFIQSFSTDKYKDEKFLKKKEELIAQVKVLLNTKMEAVKQLELIEDLRNLGLTYYFEDEFKKILTSIYNEHKGFKNEQVGDLYFTSLAFRLLRLHGFDVSEDVFNFFKNEDGSDFKASLGENTKDVLELYEASFLIRVGEVTLEQARVFSTKILEKKVEEGIKDEKLLAWIQHSLALPLHWRIQRLEARWFLDAYKARKDMNPIIYELGKIDFHIIQETQLQEVQEVSQWWTNTNLAEKLPFVRDRIVECYFWALGLFEPHEYGYQRKMAAIIITFVTIIDDVYDVYDTLDELQLFTDAIRKWDVESISTLPYYMQVCYLAVFTYASELAYDILKDQGFNSISYLQRSWLSLVEGFFQEAKWYYAGYTPTLAEYLENAKVSISSPTIISQVYFTLPNSTERTVVENVFGYHNILYLSGMILRLADDLGTTQFELKRGDVQKAIQCYMNDNNATEEEGTEHVKYLLREAWQEMNSAMADPDCPLSEDLVFAAANLGRTSQFIYLDGDGHGVQHSEIHNQMGGLIFEPYV,uniprot_search,A0A0M3Q1Q3,CC(C)=CCC/C(C)=C\COP(=O)(O)OP(=O)(O)O,0.009,30.0,6.6,4.2.3.114,49992.0,-2.0457574905606752,-2.0457574905606752,CC(C)=CCC/C(C)=C\COP(=O)(O)OP(=O)(O)O__MRRSGNYQAPVWNNDFIQSFSTDKYKDEKFLKKKEELIAQVKVLLNTKMEAVKQLELIEDLRNLGLTYYFEDEFKKILTSIYNEHKGFKNEQVGDLYFTSLAFRLLRLHGFDVSEDVFNFFKNEDGSDFKASLGENTKDVLELYEASFLIRVGEVTLEQARVFSTKILEKKVEEGIKDEKLLAWIQHSLALPLHWRIQRLEARWFLDAYKARKDMNPIIYELGKIDFHIIQETQLQEVQEVSQWWTNTNLAEKLPFVRDRIVECYFWALGLFEPHEYGYQRKMAAIIITFVTIIDDVYDVYDTLDELQLFTDAIRKWDVESISTLPYYMQVCYLAVFTYASELAYDILKDQGFNSISYLQRSWLSLVEGFFQEAKWYYAGYTPTLAEYLENAKVSISSPTIISQVYFTLPNSTERTVVENVFGYHNILYLSGMILRLADDLGTTQFELKRGDVQKAIQCYMNDNNATEEEGTEHVKYLLREAWQEMNSAMADPDCPLSEDLVFAAANLGRTSQFIYLDGDGHGVQHSEIHNQMGGLIFEPYV,./data/raw/alphafold//AF-A0A0M3Q1Q3-F1-model_v4.pdb,4963,1784,2657,2659 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+1247,24301,24687,MGAHVMKCEIYVVSVLLFTMSQSQTAALSFRAHLSDCLEDKDYQTLLQTVENGLPPIHTPPRHVVVVGAGMAGLTAAKLLQDAGHKVTILEASGRVGGRVETYRNEQGWYVELGAMRIPSTHKIVLFFVELLKLKLNEFIMTDPNTFYLVNGIKKRTFEVNAHPDILGYNLEGNEKGKSADQLLQQALKKVNVYVEEHGCSEALKKYDHYTVKEYLKTEGGLSSEAVRMIGDLLNEESLMYTALTEMIYDQTDISDNDVYFEITGGSDLLPNALHKQLKAPALLNSRVKRISRSETGVFISYQKDKQSSLTDLEADAVLVTTTTKAALFIDFDPPLPIKKMEALRVVHYDSSTKIILTFSEKFWERDGIKGGKSITDRPSRFIYYSSHSFQIKDIGVLLASYTWSDDSLLFLGATDEDLKELVLGDLAAIHGEYVRSLCTGVVVKKWSLDPYSLGAFALFTPYQHLEYSKELFKSEGRLHFAGEHTGFPHAWIETAMKTGIRAATSIYSNLLDVSTQTRDEF,brenda,D2KWB6,NCCCC[C@H](N)C(=O)O,13.0,,,1.4.3.2,195632.0,1.1139433523068367,1.4722660104959906,NCCCC[C@H](N)C(=O)O__MGAHVMKCEIYVVSVLLFTMSQSQTAALSFRAHLSDCLEDKDYQTLLQTVENGLPPIHTPPRHVVVVGAGMAGLTAAKLLQDAGHKVTILEASGRVGGRVETYRNEQGWYVELGAMRIPSTHKIVLFFVELLKLKLNEFIMTDPNTFYLVNGIKKRTFEVNAHPDILGYNLEGNEKGKSADQLLQQALKKVNVYVEEHGCSEALKKYDHYTVKEYLKTEGGLSSEAVRMIGDLLNEESLMYTALTEMIYDQTDISDNDVYFEITGGSDLLPNALHKQLKAPALLNSRVKRISRSETGVFISYQKDKQSSLTDLEADAVLVTTTTKAALFIDFDPPLPIKKMEALRVVHYDSSTKIILTFSEKFWERDGIKGGKSITDRPSRFIYYSSHSFQIKDIGVLLASYTWSDDSLLFLGATDEDLKELVLGDLAAIHGEYVRSLCTGVVVKKWSLDPYSLGAFALFTPYQHLEYSKELFKSEGRLHFAGEHTGFPHAWIETAMKTGIRAATSIYSNLLDVSTQTRDEF,./data/raw/alphafold//AF-D2KWB6-F1-model_v4.pdb,5084,6022,7787,8184 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+1537,17070,17318,MLSNKDPLSLMAMWGSVKGYDPNQGASFEGPEKRLEVIMRIIDETHSEGLHALGDEVWKGVVGSLNAQIVSKESNEYIRSYVLTESSLFVMRDRIILITCGTTTLLNAVPFVLDAVSDVRGEVEWVSFMHKNYSFPWEQKGPHLSMAEEFNTLRTYFPSGKPFIFGPVDSDHYFLFVYDDVIRPCETENDTQLSMTMYGLDRTQTKHWFSDRFISTGTETAAIRKATKLDKVADDSWKLHDLQFEPCGYSINTIRGAEYQTIHITPEDHCSFASYETNTPAVNYSERINTVLGVFAPIRFSVIVFIDPDSDVGRLYQKGQNVGVEAEYYPKYELQNRTVNEFAPGYVVMKMNYARRAEVTEKDSTDSVEE,brenda,O76240,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,0.05,37.0,7.5,4.1.1.50,10116.0,-1.3010299956639813,-1.3010299956639813,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MLSNKDPLSLMAMWGSVKGYDPNQGASFEGPEKRLEVIMRIIDETHSEGLHALGDEVWKGVVGSLNAQIVSKESNEYIRSYVLTESSLFVMRDRIILITCGTTTLLNAVPFVLDAVSDVRGEVEWVSFMHKNYSFPWEQKGPHLSMAEEFNTLRTYFPSGKPFIFGPVDSDHYFLFVYDDVIRPCETENDTQLSMTMYGLDRTQTKHWFSDRFISTGTETAAIRKATKLDKVADDSWKLHDLQFEPCGYSINTIRGAEYQTIHITPEDHCSFASYETNTPAVNYSERINTVLGVFAPIRFSVIVFIDPDSDVGRLYQKGQNVGVEAEYYPKYELQNRTVNEFAPGYVVMKMNYARRAEVTEKDSTDSVEE,./data/raw/alphafold//AF-O76240-F1-model_v4.pdb,782,4159,5566,5956 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+1553,1244,1276,MEQPMKPTVIITGASSGVGLYGAKALIDKGWHVIMACRNLDKTQKVADELGFPKDSYTIIKLDLGYLDSVRRFVAQFRELGRPLKALVCNAAVYFPLLDEPLWSADDYELSVATNHLGHFLLCNLLLEDLKACPDADKRLIILGTVTANSKELGGKIPIPAPPDLGNFEGFEAGFKKPIAMINNKKFKSGKAYKDSKLCNMLTTRELHRRFHQETGIVFNSLYPGCVADTPLFRNHYSLFRTIFPWFQKNVTKGYVSQELAGERVAMVVADDKFKDSGVHWSWGNRQQAGREAFVQELSEQGSDAQKAQRMWDLSEKLVGLV,brenda,Q59987,C=Cc1c(C)c2cc3nc(c4c5nc(cc6[nH]c(cc1[n-]2)c(C)c6CC)C(C)=C5C(=O)[C@@H]4C(=O)OC)C(CCC(=O)[O-])=C3C.[Mg+2],0.0086,30.0,7.5,1.3.1.33,1143.0,-2.065501548756432,-2.065501548756432,C=Cc1c(C)c2cc3nc(c4c5nc(cc6[nH]c(cc1[n-]2)c(C)c6CC)C(C)=C5C(=O)[C@@H]4C(=O)OC)C(CCC(=O)[O-])=C3C.[Mg+2]__MEQPMKPTVIITGASSGVGLYGAKALIDKGWHVIMACRNLDKTQKVADELGFPKDSYTIIKLDLGYLDSVRRFVAQFRELGRPLKALVCNAAVYFPLLDEPLWSADDYELSVATNHLGHFLLCNLLLEDLKACPDADKRLIILGTVTANSKELGGKIPIPAPPDLGNFEGFEAGFKKPIAMINNKKFKSGKAYKDSKLCNMLTTRELHRRFHQETGIVFNSLYPGCVADTPLFRNHYSLFRTIFPWFQKNVTKGYVSQELAGERVAMVVADDKFKDSGVHWSWGNRQQAGREAFVQELSEQGSDAQKAQRMWDLSEKLVGLV,./data/raw/alphafold//AF-Q59987-F1-model_v4.pdb,3289,651,767,935 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+1596,15825,16051,ASGNPAAGKPWHWKSPKPLVDPRIHVNATPRIVGGVEATPHSWPHQAALFIDDMYFCGGSLISSEWVLTAAHCMDGAGFVEVVLGAHNIRQNEASQVSIISTNFFTHENWNSWLLTNDIALIKLPSPVSLNSNIKTVRLPSSDVSVGTTVTPTGWGRPSDSASGISDVLRQVNVPIMTNADCDSVYGIVGDGVVCIDGAGGKSTCNGDSGGPLNLNGMTYGITSFGSSAGCEVGYPAAFTRVHYYLDWIKQKTGVTP,brenda,U5KGX4,C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1,0.12,25.0,8.0,3.4.21.1,171294.0,-0.9208187539523752,-0.9208187539523752,C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1__ASGNPAAGKPWHWKSPKPLVDPRIHVNATPRIVGGVEATPHSWPHQAALFIDDMYFCGGSLISSEWVLTAAHCMDGAGFVEVVLGAHNIRQNEASQVSIISTNFFTHENWNSWLLTNDIALIKLPSPVSLNSNIKTVRLPSSDVSVGTTVTPTGWGRPSDSASGISDVLRQVNVPIMTNADCDSVYGIVGDGVVCIDGAGGKSTCNGDSGGPLNLNGMTYGITSFGSSAGCEVGYPAAFTRVHYYLDWIKQKTGVTP,./data/raw/alphafold//AF-U5KGX4-F1-model_v4.pdb,612,3931,5310,5644 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+1656,40513,41247,RTMFYGKGDVYVFRTYANPLKGLKQIPESNFTEKHNTIFGMNAKVALKGEQLLTSFTEGDNSLVVATDSMKNFIQRHAASYEGATLEGFLQYVCEAFLAKYSHLDAVRLEAKEYAFDDIQVGTDKGVVTSDLVFRKSRNEYATATVEVARTASGTEVVEQASGIADIQLIKVSGSSFYGYIIDEYTTLAEATDRPLYIFLNIGWAYENQDDAKGDNPANYVAAEQVRDIAASVFHTLDNKSIQHLIYHIGLTILDRFPQLTEVNFGTNNRTWDTVVEGTDGFKGAVFTEPRPPFGFQGFSVHQEDLAREKASANSEYVAL,uniprot_search,C5HDG5,Oc1nc(O)c2nc(O)[nH]c2n1,0.042,32.5,9.75,1.7.3.3,1458.0,-1.3767507096020994,-0.7947397714027931,Oc1nc(O)c2nc(O)[nH]c2n1__RTMFYGKGDVYVFRTYANPLKGLKQIPESNFTEKHNTIFGMNAKVALKGEQLLTSFTEGDNSLVVATDSMKNFIQRHAASYEGATLEGFLQYVCEAFLAKYSHLDAVRLEAKEYAFDDIQVGTDKGVVTSDLVFRKSRNEYATATVEVARTASGTEVVEQASGIADIQLIKVSGSSFYGYIIDEYTTLAEATDRPLYIFLNIGWAYENQDDAKGDNPANYVAAEQVRDIAASVFHTLDNKSIQHLIYHIGLTILDRFPQLTEVNFGTNNRTWDTVVEGTDGFKGAVFTEPRPPFGFQGFSVHQEDLAREKASANSEYVAL,./data/raw/alphafold//AF-C5HDG5-F1-model_v4.pdb,2803,4580,6369,11831 +1657,12497,12674,MQMPKTLRIRNGDKVRSTFSAQEYANRQARLRAHLAAENIDAAIFTSYHNINYYSDFLYCSFGRPYALVVTEDDVISISANIDGGQPWRRTVGTDNIVYTDWQRDNYFAAIQQALPKARRIGIEHDHLNLQNRDKLAARYPDAELVDVAAACMRMRMIKSAEEHVMIRHGARIADIGGAAVVEALGDQVPEYEVALHATQAMVRAIADTFEDVELMDTWTWFQSGINTDGAHNPVTTRKVNKGDILSLNCFPMIAGYYTALERTLFLDHCSDDHLRLWQVNVEVHEAGLKLIKPGARCSDIARELNEIFLKHDVLQYRTFGYGHSFGTLSHYYGREAGLELREDIDTVLEPGMVVSMEPMIMLPEGLPGAGGYREHDILIVNENGAENITKFPYGPEKNIIRK,brenda,P38488,CN(CC(=O)O)C(=N)N,7.0,50.0,7.7,3.5.3.3,303.0,0.8450980400142568,0.9248730468817868,CN(CC(=O)O)C(=N)N__MQMPKTLRIRNGDKVRSTFSAQEYANRQARLRAHLAAENIDAAIFTSYHNINYYSDFLYCSFGRPYALVVTEDDVISISANIDGGQPWRRTVGTDNIVYTDWQRDNYFAAIQQALPKARRIGIEHDHLNLQNRDKLAARYPDAELVDVAAACMRMRMIKSAEEHVMIRHGARIADIGGAAVVEALGDQVPEYEVALHATQAMVRAIADTFEDVELMDTWTWFQSGINTDGAHNPVTTRKVNKGDILSLNCFPMIAGYYTALERTLFLDHCSDDHLRLWQVNVEVHEAGLKLIKPGARCSDIARELNEIFLKHDVLQYRTFGYGHSFGTLSHYYGREAGLELREDIDTVLEPGMVVSMEPMIMLPEGLPGAGGYREHDILIVNENGAENITKFPYGPEKNIIRK,./data/raw/alphafold//AF-P38488-F1-model_v4.pdb,233,3362,4607,4830 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+1699,5161,5241,MAVAAPSPAAAAEPGPAARPRSTRGQVRLPGGEFAMGDAFGEGYPADGETPVHTVRLRPFHIDETAVTNARFAAFVKATGHVTDAERFGSSAVFHLVVAAPDADVLGSAAGAPWWINVRGAHWRRPEGARSDITGRPNHPVVHVSWNDATAYARWAGKRLPTEAEWEYAARGGLAGRRYAWGDELTPGGRWRCNIWQGRFPHVNTAEDGHLSTAPVKSYRPNGHGLWNTAGNVWEWCSDWFSPTYYAESPTVDPHGPGTGAARVLRGGSYLCHDSYCNRYRVAARSSNTPDSSSGNLGFRCANDADLTSGSAAE,brenda,Q9F3C7,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)[C@H](CO)N=C(O)c1ccccc1N)C(O)=N[C@@H](CS)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](C)C(=N)O)[C@@H](C)O,0.58,25.0,8.0,1.8.3.7,2020.0,-0.2365720064370627,-0.2365720064370627,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)[C@H](CO)N=C(O)c1ccccc1N)C(O)=N[C@@H](CS)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](C)C(=N)O)[C@@H](C)O__MAVAAPSPAAAAEPGPAARPRSTRGQVRLPGGEFAMGDAFGEGYPADGETPVHTVRLRPFHIDETAVTNARFAAFVKATGHVTDAERFGSSAVFHLVVAAPDADVLGSAAGAPWWINVRGAHWRRPEGARSDITGRPNHPVVHVSWNDATAYARWAGKRLPTEAEWEYAARGGLAGRRYAWGDELTPGGRWRCNIWQGRFPHVNTAEDGHLSTAPVKSYRPNGHGLWNTAGNVWEWCSDWFSPTYYAESPTVDPHGPGTGAARVLRGGSYLCHDSYCNRYRVAARSSNTPDSSSGNLGFRCANDADLTSGSAAE,./data/raw/alphafold//AF-Q9F3C7-F1-model_v4.pdb,5168,2056,1311,3072 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+2996,19477,19762,MSVKTKEKEMAVTILYEQDVDPKVIQGLKVGIIGYGSQGHAHALNLMDSGVDVRVGLREGSSSWKTAEEAGLKVTDMDTAAEEADVIMVLVPDEIQPKVYQEHIAAHLKAGNTLAFAHGFNIHYGYIVPPEDVNVIMCAPKGPGHIVRRQFTEGSGVPDLACVQQDATGNAWDIVLSYCWGVGGARSGIIKATFAEETEEDLFGEQAVLCGGLVELVKAGFETLTEAGYPPELAYFECYHEMKMIVDLMYESGIHFMNYSISNTAEYGEYYAGPKVINEQSREAMKEILKRIQDGSFAQEFVDDCNNGHKRLLEQREAINTHPIETTGAQIRSMFSWIKKED,brenda,D0WGK0,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1,0.045,,,1.1.1.383,84109.0,-1.3467874862246565,-1.3467874862246565,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1__MSVKTKEKEMAVTILYEQDVDPKVIQGLKVGIIGYGSQGHAHALNLMDSGVDVRVGLREGSSSWKTAEEAGLKVTDMDTAAEEADVIMVLVPDEIQPKVYQEHIAAHLKAGNTLAFAHGFNIHYGYIVPPEDVNVIMCAPKGPGHIVRRQFTEGSGVPDLACVQQDATGNAWDIVLSYCWGVGGARSGIIKATFAEETEEDLFGEQAVLCGGLVELVKAGFETLTEAGYPPELAYFECYHEMKMIVDLMYESGIHFMNYSISNTAEYGEYYAGPKVINEQSREAMKEILKRIQDGSFAQEFVDDCNNGHKRLLEQREAINTHPIETTGAQIRSMFSWIKKED,./data/raw/alphafold//AF-D0WGK0-F1-model_v4.pdb,4021,4931,6797,6775 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+175,10487,10642,MSGIQFDVSRLCAATISIQGRHFVDSHGRVLHLRGANVSAASKVPATPAPKIHDHAQASYVGRPFRLEEADEHWARLKSWGLTFVRITVTWEALEHKERGVYDEDYLAYLRALLQSMEPYGLVAYIALHQDVWSRYCGGSGAPGWTLEAAGFDLSNEGENLSLSGAAFLDGIKSGRLAGERGLWPTGYQKLAAATMNTLFWGGETFAPLLKVPGQIDGKWVSRNIQVYLQEAFLAATAKLVKAVGDLETVMGFELMNEPHPGFIGIQSIHEWDYTTDLHLGQFPSPLQSFSMGAGHPTPNVPVYTRSFPFPTRVTSHVTANPEGACAWASKECPWEKHGVWRWSEAKQEAAALQQDYFVKNRDGGKVDFYEDFYFPFVRKWEQVIGENISSTKGLKARMVEAIPNELCPEWKEESRPKNMVYAPHWYDLNTLFKKKFGFMSVNVQGLARGMFILRALYFGTAAAKANYALQIKTIVLAARLKLGPVPVIFGECGVPMDINNEEAFRTGDWKWQERSMDALISAMEGALMGFNLWTYNPANRDDIGDDWNAENFSWYSESNRTKLLKNAEKSSDGLDVGARLLNVIVRPYPIATAGNPTSLAYDANACAFTYRFRSPLRVSAAAPTPEEYTEIFLPRRVFRKESTEWTVTAGGKVHVDWERERVFVWFEDSSLTAASIKDDTRPRRIDIWVIGRKVEENWSIAQILVAVVILLLGVLVAYYAQLYEWEKDKMIFQHLREANGM,brenda,H1AE12,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)N=C(O)CCCCCNc1ccc([N+](=O)[O-])c2nonc12,0.0058,30.0,7.3,3.2.1.62,5207.0,-2.2365720064370627,-2.2365720064370627,CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)N=C(O)CCCCCNc1ccc([N+](=O)[O-])c2nonc12__MSGIQFDVSRLCAATISIQGRHFVDSHGRVLHLRGANVSAASKVPATPAPKIHDHAQASYVGRPFRLEEADEHWARLKSWGLTFVRITVTWEALEHKERGVYDEDYLAYLRALLQSMEPYGLVAYIALHQDVWSRYCGGSGAPGWTLEAAGFDLSNEGENLSLSGAAFLDGIKSGRLAGERGLWPTGYQKLAAATMNTLFWGGETFAPLLKVPGQIDGKWVSRNIQVYLQEAFLAATAKLVKAVGDLETVMGFELMNEPHPGFIGIQSIHEWDYTTDLHLGQFPSPLQSFSMGAGHPTPNVPVYTRSFPFPTRVTSHVTANPEGACAWASKECPWEKHGVWRWSEAKQEAAALQQDYFVKNRDGGKVDFYEDFYFPFVRKWEQVIGENISSTKGLKARMVEAIPNELCPEWKEESRPKNMVYAPHWYDLNTLFKKKFGFMSVNVQGLARGMFILRALYFGTAAAKANYALQIKTIVLAARLKLGPVPVIFGECGVPMDINNEEAFRTGDWKWQERSMDALISAMEGALMGFNLWTYNPANRDDIGDDWNAENFSWYSESNRTKLLKNAEKSSDGLDVGARLLNVIVRPYPIATAGNPTSLAYDANACAFTYRFRSPLRVSAAAPTPEEYTEIFLPRRVFRKESTEWTVTAGGKVHVDWERERVFVWFEDSSLTAASIKDDTRPRRIDIWVIGRKVEENWSIAQILVAVVILLLGVLVAYYAQLYEWEKDKMIFQHLREANGM,./data/raw/alphafold//AF-H1AE12-F1-model_v4.pdb,5453,3111,3844,4472 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+198,13677,13874,MEENGMKSKILIFGGTGYIGNHMVKGSLKLGHPTYVFTRPNSSKTTLLDEFQSLGAIIVKGELDEHEKLVELMKKVDVVISALAFPQILDQFKILEAIKVAGNIKRFLPSDFGVEEDRINALPPFEALIERKRMIRRAIEEANIPYTYVSANCFASYFINYLLRPYDPKDEITVYGTGEAKFAMNYEQDIGLYTIKVATDPRALNRVVIYRPSTNIITQLELISRWEKKIGKKFKKIHVPEEEIVALTKELPEPENIPIAILHCLFIDGATMSYDFKENDVEASTLYPELKFTTIDELLDIFVHDPPPPASAAF,brenda,A0A1B2U6R8,COc1cc(/C=C/COC(C)=O)ccc1O,0.7,25.0,6.5,1.1.1.318,39350.0,-0.1549019599857432,-0.1549019599857432,COc1cc(/C=C/COC(C)=O)ccc1O__MEENGMKSKILIFGGTGYIGNHMVKGSLKLGHPTYVFTRPNSSKTTLLDEFQSLGAIIVKGELDEHEKLVELMKKVDVVISALAFPQILDQFKILEAIKVAGNIKRFLPSDFGVEEDRINALPPFEALIERKRMIRRAIEEANIPYTYVSANCFASYFINYLLRPYDPKDEITVYGTGEAKFAMNYEQDIGLYTIKVATDPRALNRVVIYRPSTNIITQLELISRWEKKIGKKFKKIHVPEEEIVALTKELPEPENIPIAILHCLFIDGATMSYDFKENDVEASTLYPELKFTTIDELLDIFVHDPPPPASAAF,./data/raw/alphafold//AF-A0A1B2U6R8-F1-model_v4.pdb,351,1070,1278,5111 +212,22675,23027,MKHLTTMSELSTEEIKDLLQTAQELKSGKTDNQLTGKFAANLFFEPSTRTRFSFEVAEKKLGMNVLNLDGTSTSVQKGETLYDTIRTLESIGVDVCVIRHSEDEYYEELVSQVNIPILNAGDGCGQHPTQSLLDLMTIYEEFNTFKGLTVSIHGDIKHSRVARSNAEVLTRLGARVLFSGPSEWQDEENTFGTYVSMDEAVESSDVVMLLRIQNERHQSAVSQEGYLNKYGLTVERAERMKRHAIIMHPAPVNRGVEIDDSLVESEKSRIFKQMKNGVFIRMAVIQRALQTNVKRGEAAYVISH,sabio,P05654,NC(=O)OP(=O)(O)O,0.095,25.0,8.3,2.1.3.2,1423.0,-1.0222763947111522,-1.0222763947111522,NC(=O)OP(=O)(O)O__MKHLTTMSELSTEEIKDLLQTAQELKSGKTDNQLTGKFAANLFFEPSTRTRFSFEVAEKKLGMNVLNLDGTSTSVQKGETLYDTIRTLESIGVDVCVIRHSEDEYYEELVSQVNIPILNAGDGCGQHPTQSLLDLMTIYEEFNTFKGLTVSIHGDIKHSRVARSNAEVLTRLGARVLFSGPSEWQDEENTFGTYVSMDEAVESSDVVMLLRIQNERHQSAVSQEGYLNKYGLTVERAERMKRHAIIMHPAPVNRGVEIDDSLVESEKSRIFKQMKNGVFIRMAVIQRALQTNVKRGEAAYVISH,./data/raw/alphafold//AF-P05654-F1-model_v4.pdb,4614,5722,7398,8306 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+242,10280,10435,MASENIFLFVPNLIGYARIVFAIISFYFMPCCPLTASSFYLLSGLLDAFDGHAARVLNQGTRFGAMLDMLTDRCSTMCLLVNLALLYPRATLLFQLSMSLDVASHWLHLHSSVVRGSESHKMIDLSGNPVLRIYYTSRPALFTLCAGNELFYCLLYLFNFSEGPLVGSVGLFRMGLWITAPIALLKSLISVIHLITAARNMAALDAADRAKRK,uniprot_search,Q3T103,CCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2ccc(=N)nc2O)[C@H](O)[C@@H]1O)OC(=O)CCCCCCCCC,0.06,34.0,8.225,2.7.8.11,9913.0,-1.2218487496163564,-1.2218487496163564,CCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2ccc(=N)nc2O)[C@H](O)[C@@H]1O)OC(=O)CCCCCCCCC__MASENIFLFVPNLIGYARIVFAIISFYFMPCCPLTASSFYLLSGLLDAFDGHAARVLNQGTRFGAMLDMLTDRCSTMCLLVNLALLYPRATLLFQLSMSLDVASHWLHLHSSVVRGSESHKMIDLSGNPVLRIYYTSRPALFTLCAGNELFYCLLYLFNFSEGPLVGSVGLFRMGLWITAPIALLKSLISVIHLITAARNMAALDAADRAKRK,./data/raw/alphafold//AF-Q3T103-F1-model_v4.pdb,2788,48,52,4423 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+659,30852,31402,MNSNKELMQRRSQAIPRGVGQIHPIFADRAENCRVWDVEGREYLDFAGGIAVLNTGHLHPKVVAAVEAQLKKLSHTCFQVLAYEPYLELCEIMNQKVPGDFAKKTLLVTTGSEAVENAVKIARAATKRSGTIAFSGAYHGRTHYTLALTGKVNPYSAGMGLMPGHVYRALYPCPLHGISEDDAIASIHRIFKNDAAPEDIAAIVIEPVQGEGGFYASSPAFMQRLRALCDEHGIMLIADEVQSGAGRTGTLFAMEQMGVAPDLTTFAKSIAGGFPLAGVTGRAEVMDAVAPGGLGGTYAGNPIACVAALEVLKVFEQENLLQKANDLGQKLKDGLLAIAEKHPEIGDVRGLGAMIAIELFEDGDHNKPDAKLTAEIVARARDKGLILLSCGPYYNVLRILVPLTIEDAQIRQGLEIISQCFDEAKQ,brenda,P22256,O=C(O)CCC(=O)C(=O)O,1.07,25.0,7.8,2.6.1.19,562.0,0.0293837776852096,0.0293837776852096,O=C(O)CCC(=O)C(=O)O__MNSNKELMQRRSQAIPRGVGQIHPIFADRAENCRVWDVEGREYLDFAGGIAVLNTGHLHPKVVAAVEAQLKKLSHTCFQVLAYEPYLELCEIMNQKVPGDFAKKTLLVTTGSEAVENAVKIARAATKRSGTIAFSGAYHGRTHYTLALTGKVNPYSAGMGLMPGHVYRALYPCPLHGISEDDAIASIHRIFKNDAAPEDIAAIVIEPVQGEGGFYASSPAFMQRLRALCDEHGIMLIADEVQSGAGRTGTLFAMEQMGVAPDLTTFAKSIAGGFPLAGVTGRAEVMDAVAPGGLGGTYAGNPIACVAALEVLKVFEQENLLQKANDLGQKLKDGLLAIAEKHPEIGDVRGLGAMIAIELFEDGDHNKPDAKLTAEIVARARDKGLILLSCGPYYNVLRILVPLTIEDAQIRQGLEIISQCFDEAKQ,./data/raw/alphafold//AF-P22256-F1-model_v4.pdb,4783,5985,7737,8725 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+685,29434,29957,MHFRRCIRKYCINKKIVNPFEHVQRTLNEKNYYYYDINELHDSRIKSLPYSIRVLLESAVRNCDNLKVSEKNVETILGWKENCKKKKEVPFMPTRVLLQDLTGVPCIVDLATMRDTAEKLGCDAERINPLIPVDLVIDHSVQVDYSRREDALELNEKKEYERNLERFKFLKWGMNSFKNMLILPPGSGIVHQINLEYLAHCVFNKDNLLYPDSVVGTDSHTTMINGLGILGWGVGGIEAEATMLGLPISMTLPEVVGINVVGKLSDYLLSTDIVLYITSFLRKEVGVVNKYVEFFGTGLKDLKLADRATISNMAPEYGATVGFFPVDDITLEYLLQTGRDKEKVELIREYLMKNSMFNTYKDNVEYTDVYTLDLSKLNLSLSGPKRPHDNVLLSELHKDFTMCLESPIGFKGYNIAKEEREKKISFVCSKDGKEYVLSQGSVVLCAITSCTNTSNSSSMIAAGLLAKKAIEEFGLKSLPYIKSSLSPGSKTVQKYLEAGGLLKYLEQLGFYNVGYGCMTCIGNSGHLDEEVEEVINKNDLIVSSVLSGNRNFEGRVHPLIKANYLASPVLVVLFSIIGNVNVDLSNYTFNYKGKKINALDLIPRKEEIEEYESTYIKPEMYTEIYKNIKYVNKYWNDIQIKKNKLYEWDKNSTYIHKPPYFENMTLEIEKIQDIKDAHVLLFLGDSITTDHISPAGMIHKTSEAYKFLKTKNIKDQDLNTYGARRGNDEVMIRGTFANIRLINKLCPDKGPNTIHIPTNQLMSVYQAAMKYKQDNIDVIIIAGKEYGCGSSRDWAAKGPNLLGVKAVIAESYERIHRSNLIGMSVLPLQFINNQSPQYYNMDGTEKFTILLNDGNIKAQQTIKVQMNQKGKIIIFDVLCRIDTEIEERYFRNGGILKYVLRSLVNEANK,uniprot_search,Q9Y007,O=C(O)/C=C(/CC(=O)O)C(=O)O,0.0035,37.0,7.4,4.2.1.3,5833.0,-2.4559319556497243,-2.4559319556497243,O=C(O)/C=C(/CC(=O)O)C(=O)O__MHFRRCIRKYCINKKIVNPFEHVQRTLNEKNYYYYDINELHDSRIKSLPYSIRVLLESAVRNCDNLKVSEKNVETILGWKENCKKKKEVPFMPTRVLLQDLTGVPCIVDLATMRDTAEKLGCDAERINPLIPVDLVIDHSVQVDYSRREDALELNEKKEYERNLERFKFLKWGMNSFKNMLILPPGSGIVHQINLEYLAHCVFNKDNLLYPDSVVGTDSHTTMINGLGILGWGVGGIEAEATMLGLPISMTLPEVVGINVVGKLSDYLLSTDIVLYITSFLRKEVGVVNKYVEFFGTGLKDLKLADRATISNMAPEYGATVGFFPVDDITLEYLLQTGRDKEKVELIREYLMKNSMFNTYKDNVEYTDVYTLDLSKLNLSLSGPKRPHDNVLLSELHKDFTMCLESPIGFKGYNIAKEEREKKISFVCSKDGKEYVLSQGSVVLCAITSCTNTSNSSSMIAAGLLAKKAIEEFGLKSLPYIKSSLSPGSKTVQKYLEAGGLLKYLEQLGFYNVGYGCMTCIGNSGHLDEEVEEVINKNDLIVSSVLSGNRNFEGRVHPLIKANYLASPVLVVLFSIIGNVNVDLSNYTFNYKGKKINALDLIPRKEEIEEYESTYIKPEMYTEIYKNIKYVNKYWNDIQIKKNKLYEWDKNSTYIHKPPYFENMTLEIEKIQDIKDAHVLLFLGDSITTDHISPAGMIHKTSEAYKFLKTKNIKDQDLNTYGARRGNDEVMIRGTFANIRLINKLCPDKGPNTIHIPTNQLMSVYQAAMKYKQDNIDVIIIAGKEYGCGSSRDWAAKGPNLLGVKAVIAESYERIHRSNLIGMSVLPLQFINNQSPQYYNMDGTEKFTILLNDGNIKAQQTIKVQMNQKGKIIIFDVLCRIDTEIEERYFRNGGILKYVLRSLVNEANK,./data/raw/alphafold//AF-Q9Y007-F1-model_v4.pdb,1702,7084,8959,9223 +687,18242,18506,MSWSPSLTTQTCGAWEMKERLGTGGFGNVIRWHNQETGEQIAIKQCRQELSPRNRERWCLEIQIMRRLTHPNVVAARDVPEGMQNLAPNDLPLLAMEYCQGGDLRKYLNQFENCCGLREGAILTLLSDIASALRYLHENRIIHRDLKPENIVLQQGEQRLIHKIIDLGYAKELDQGSLCTSFVGTLQYLAPELLEQQKYTVTVDYWSFGTLAFECITGFRPFLPNWQPVQWHSKVRQKSEVDIVVSEDLNGTVKFSSSLPYPNNLNSVLAERLEKWLQLMLMWHPRQRGTDPTYGPNGCFKALDDILNLKLVHILNMVTGTIHTYPVTEDESLQSLKARIQQDTGIPEEDQELLQEAGLALIPDKPATQCISDGKLNEGHTLDMDLVFLFDNSKITYETQISPRPQPESVSCILQEPKRNLAFFQLRKVWGQVWHSIQTLKEDCNRLQQGQRAAMMNLLRNNSCLSKMKNSMASMSQQLKAKLDFFKTSIQIDLEKYSEQTEFGITSDKLLLAWREMEQAVELCGRENEVKLLVERMMALQTDIVDLQRSPMGRKQGGTLDDLEEQARELYRRLREKPRDQRTEGDSQEMVRLLLQAIQSFEKKVRVIYTQLSKTVVCKQKALELLPKVEEVVSLMNEDEKTVVRLQEKRQKELWNLLKIACSKVRGPVSGSPDSMNASRLSQPGQLMSQPSTASNSLPEPAKKSEELVAEAHNLCTLLENAIQDTVREQDQSFTALDWSWLQTEEEEHSCLEQAS,sabio,O14920,Cc1nc(N)nc(N)c1OCCCOc1cc(Cl)c(Cl)cc1Cl,0.00075,25.0,7.6,2.7.11.10,9606.0,-3.1249387366083,-3.1249387366083,Cc1nc(N)nc(N)c1OCCCOc1cc(Cl)c(Cl)cc1Cl__MSWSPSLTTQTCGAWEMKERLGTGGFGNVIRWHNQETGEQIAIKQCRQELSPRNRERWCLEIQIMRRLTHPNVVAARDVPEGMQNLAPNDLPLLAMEYCQGGDLRKYLNQFENCCGLREGAILTLLSDIASALRYLHENRIIHRDLKPENIVLQQGEQRLIHKIIDLGYAKELDQGSLCTSFVGTLQYLAPELLEQQKYTVTVDYWSFGTLAFECITGFRPFLPNWQPVQWHSKVRQKSEVDIVVSEDLNGTVKFSSSLPYPNNLNSVLAERLEKWLQLMLMWHPRQRGTDPTYGPNGCFKALDDILNLKLVHILNMVTGTIHTYPVTEDESLQSLKARIQQDTGIPEEDQELLQEAGLALIPDKPATQCISDGKLNEGHTLDMDLVFLFDNSKITYETQISPRPQPESVSCILQEPKRNLAFFQLRKVWGQVWHSIQTLKEDCNRLQQGQRAAMMNLLRNNSCLSKMKNSMASMSQQLKAKLDFFKTSIQIDLEKYSEQTEFGITSDKLLLAWREMEQAVELCGRENEVKLLVERMMALQTDIVDLQRSPMGRKQGGTLDDLEEQARELYRRLREKPRDQRTEGDSQEMVRLLLQAIQSFEKKVRVIYTQLSKTVVCKQKALELLPKVEEVVSLMNEDEKTVVRLQEKRQKELWNLLKIACSKVRGPVSGSPDSMNASRLSQPGQLMSQPSTASNSLPEPAKKSEELVAEAHNLCTLLENAIQDTVREQDQSFTALDWSWLQTEEEEHSCLEQAS,./data/raw/alphafold//AF-O14920-F1-model_v4.pdb,3859,4467,5935,3308 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+692,39419,40120,MKSNTEKFGKAPHQPSLWTRADALKVHADDPTTTQPLVSADFPVLSNEVFIWDTMPLRDLDGNITSVDGWSVIFTLTADRHPNDPEYIDENGNYDITRDWNDRHGRAKMYYWFSRTGKDWKLGGRVMAEGVSPTAREWAGTPILLNEQGDVDLYYTAVTPGATIVKVRGRVVTTEHGVSMVGFEKVKPLFEADGKMYQTEAQNPFWGFRDPWPFRDPNDGKLYMLFEGNVAGERGSHKVGKAEIGDVPPGYEDVGNSRFQTACVGIAVARDEDGDDWEMLPPLLTAVGVNDQTERPHFVFQDGKYYLFTISHTFTYADGVTGPDGVYGFVADSLFGPYVPLNGSGLVLGNPSSQPFQTYSHCVMPNGLVTSFIDSVPTDESGTQIRIGGTEAPTVEIKIKGQQTFVVAEYDYGYIPPMLDVTLK,brenda,Q93FU9,OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O,24.1,60.0,6.0,2.4.1.10,86192.0,1.3820170425748683,1.3820170425748683,OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O__MKSNTEKFGKAPHQPSLWTRADALKVHADDPTTTQPLVSADFPVLSNEVFIWDTMPLRDLDGNITSVDGWSVIFTLTADRHPNDPEYIDENGNYDITRDWNDRHGRAKMYYWFSRTGKDWKLGGRVMAEGVSPTAREWAGTPILLNEQGDVDLYYTAVTPGATIVKVRGRVVTTEHGVSMVGFEKVKPLFEADGKMYQTEAQNPFWGFRDPWPFRDPNDGKLYMLFEGNVAGERGSHKVGKAEIGDVPPGYEDVGNSRFQTACVGIAVARDEDGDDWEMLPPLLTAVGVNDQTERPHFVFQDGKYYLFTISHTFTYADGVTGPDGVYGFVADSLFGPYVPLNGSGLVLGNPSSQPFQTYSHCVMPNGLVTSFIDSVPTDESGTQIRIGGTEAPTVEIKIKGQQTFVVAEYDYGYIPPMLDVTLK,./data/raw/alphafold//AF-Q93FU9-F1-model_v4.pdb,2723,8468,8515,11645 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+720,16067,16303,MRSKRFEALAKRPVNQDGFVKEWIEEGFIAMESPNDPKPSIKIVNGAVTELDGKPVSDFDLIDHFIARYGINLNRAEEVMAMDSVKLANMLCDPNVKRSEIVPLTTAMTPAKIVEVVSHMNVVEMMMAMQKMRARRTPSQQAHVTNVKDNPVQIAADAAEGAWRGFDEQETTVAVARYAPFNAIALLVGSQVGRPGVLTQCSLEEATELKLGMLGHTCYAETISVYGTEPVFTDGDDTPWSKGFLASSYASRGLKMRFTSGSGSEVQMGYAEGKSMLYLEARCIYITKAAGVQGLQNGSVSCIGVPSAVPSGIRAVLAENLICSSLDLECASSNDQTFTHSDMRRTARLLMQFLPGTDFISSGYSAVPNYDNMFAGSNEDAEDFDDYNVIQRDLKVDGGLRPVREEDVIAIRNKAARALQAVFAGMGLPPITDEEVEAATYAHGSKDMPERNIVEDIKFAQEIINKNRNGLEVVKALAQGGFTDVAQDMLNIQKAKLTGDYLHTSAIIVGDGQVLSAVNDVNDYAGPATGYRLQGERWEEIKNIPGALDPNEID,brenda,Q59470,C[C@H](O)CO,0.11,37.0,8.0,4.2.1.28,571.0,-0.958607314841775,-0.958607314841775,C[C@H](O)CO__MRSKRFEALAKRPVNQDGFVKEWIEEGFIAMESPNDPKPSIKIVNGAVTELDGKPVSDFDLIDHFIARYGINLNRAEEVMAMDSVKLANMLCDPNVKRSEIVPLTTAMTPAKIVEVVSHMNVVEMMMAMQKMRARRTPSQQAHVTNVKDNPVQIAADAAEGAWRGFDEQETTVAVARYAPFNAIALLVGSQVGRPGVLTQCSLEEATELKLGMLGHTCYAETISVYGTEPVFTDGDDTPWSKGFLASSYASRGLKMRFTSGSGSEVQMGYAEGKSMLYLEARCIYITKAAGVQGLQNGSVSCIGVPSAVPSGIRAVLAENLICSSLDLECASSNDQTFTHSDMRRTARLLMQFLPGTDFISSGYSAVPNYDNMFAGSNEDAEDFDDYNVIQRDLKVDGGLRPVREEDVIAIRNKAARALQAVFAGMGLPPITDEEVEAATYAHGSKDMPERNIVEDIKFAQEIINKNRNGLEVVKALAQGGFTDVAQDMLNIQKAKLTGDYLHTSAIIVGDGQVLSAVNDVNDYAGPATGYRLQGERWEEIKNIPGALDPNEID,./data/raw/alphafold//AF-Q59470-F1-model_v4.pdb,5819,2640,5127,5447 +729,10114,10268,MAKVMRLIIFVCVALVAISVPAASSVQSQQERIRPGFRQQLPSSIRPFSAFRRRGQEASDSVVYLNIVYLRLVGTRQCATGELTVVVHGKALNNATLGDVQTSLTRTFASSLKEPSSTLAIRRWSWKDPLFLMLTLNRRAVRTGTGLPRSTPLYQVAKQRLFVFVRKPTPTSSCRRAALDPRPLYGVPKVGVQDKYTLHVSMDVLGMSLREPLEHQEEEPGPASVSTYAAAQAILDGASSFGIGAFGSAKPNLKQISMYASGAELEKQVYTPTTSQLALFLPSKTFFGVEVTSVSDGTFRIPVSASRLVPFSAMSYMCTGSQTHKLTQTGMNVLEKRVHGKENPPSEGAEVLLNLLAARKPVNGVFEQDPTVVLLQLWRTPEGSESWQETPLMWEFPDTLEAIEDAGEYRSGILSSIAANTRIIGKMAGWLASRSFSRRFIRTLIRLNNIDLEEAFSMSDKDRRHSAADFRSVQEFFTRPINYHVYRDMDPRASIMAPADSLIQNIYTIRPDFKGEISHPIIPQVKSTSFNLREFLYGARQVPPLQLQSPSNRLFVSILYLAPSDYHRVHSPADWRVTSQTYIPGCTPSVSRRNLEAGDLLHRYERTALIGHWDPEKNGQQLFFSVTMVAAMFVGGLRLSWEEEPLGASMRLGRCTRYTESYEKQVDVELCASQEIGAFRFGSTVVMIFEAPEDFDMTSVGQCSHVAAGQPAGYLGQGRERPLQERCNAFRGNFESPFHFWKHLQKTSSVDDILKQNTLAPRAWRQEPGRVWAEVLRATERGLLYGFALSHYLLKRWATENGNLGELVLGQPEVLRQNINGSDSVIREGFRCFAAKDKKQIRLQMSGRQSQVSLTATVTPDEQFLFQHPFYGCVGDEKLGKLVRGIDATWILLPERAVLLTLKVSTGSKQEDGRVLRVATTKIEVQTEPCQGGWEESRVGTTSTTCAIRTVEKREESISEGVLTNGDL,sabio,F6N7K6,CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](N)C(=O)O)OC(=O)CCCCCCC/C=C\CCCCCCCC,0.067,37.0,6.8,4.1.1.65,5811.0,-1.1739251972991736,-1.1739251972991736,CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](N)C(=O)O)OC(=O)CCCCCCC/C=C\CCCCCCCC__MAKVMRLIIFVCVALVAISVPAASSVQSQQERIRPGFRQQLPSSIRPFSAFRRRGQEASDSVVYLNIVYLRLVGTRQCATGELTVVVHGKALNNATLGDVQTSLTRTFASSLKEPSSTLAIRRWSWKDPLFLMLTLNRRAVRTGTGLPRSTPLYQVAKQRLFVFVRKPTPTSSCRRAALDPRPLYGVPKVGVQDKYTLHVSMDVLGMSLREPLEHQEEEPGPASVSTYAAAQAILDGASSFGIGAFGSAKPNLKQISMYASGAELEKQVYTPTTSQLALFLPSKTFFGVEVTSVSDGTFRIPVSASRLVPFSAMSYMCTGSQTHKLTQTGMNVLEKRVHGKENPPSEGAEVLLNLLAARKPVNGVFEQDPTVVLLQLWRTPEGSESWQETPLMWEFPDTLEAIEDAGEYRSGILSSIAANTRIIGKMAGWLASRSFSRRFIRTLIRLNNIDLEEAFSMSDKDRRHSAADFRSVQEFFTRPINYHVYRDMDPRASIMAPADSLIQNIYTIRPDFKGEISHPIIPQVKSTSFNLREFLYGARQVPPLQLQSPSNRLFVSILYLAPSDYHRVHSPADWRVTSQTYIPGCTPSVSRRNLEAGDLLHRYERTALIGHWDPEKNGQQLFFSVTMVAAMFVGGLRLSWEEEPLGASMRLGRCTRYTESYEKQVDVELCASQEIGAFRFGSTVVMIFEAPEDFDMTSVGQCSHVAAGQPAGYLGQGRERPLQERCNAFRGNFESPFHFWKHLQKTSSVDDILKQNTLAPRAWRQEPGRVWAEVLRATERGLLYGFALSHYLLKRWATENGNLGELVLGQPEVLRQNINGSDSVIREGFRCFAAKDKKQIRLQMSGRQSQVSLTATVTPDEQFLFQHPFYGCVGDEKLGKLVRGIDATWILLPERAVLLTLKVSTGSKQEDGRVLRVATTKIEVQTEPCQGGWEESRVGTTSTTCAIRTVEKREESISEGVLTNGDL,./data/raw/alphafold//AF-F6N7K6-F1-model_v4.pdb,5525,3065,3791,4405 +732,16291,16532,MFLKGYTSNVVLIILTFFILLTKEEKNIKNNISGYCFLNFGLKKNAIIKKREKQNLKLFCYNGIRIGQGYDIHKIKVLDEEYNTYANNDFNKNEQSFKTLTLGGVKINNVLVLSHSDGDIIYHSIVDSILGALGSLDIGTLFPDKDEKNKNKNSAIFLRYARLLIYKKNYDIGNVDINVIAQVPKISNIRKNIIKNISTVLNIDESQISVKGKTHEKLGVIGEKKAIECFANILLIPKNS,brenda,P62368,C[C@](O)(CO)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2ccc(=N)nc2O)[C@H](O)[C@@H]1O,0.252,27.0,7.0,4.6.1.12,5833.0,-0.5985994592184559,-0.5985994592184559,C[C@](O)(CO)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2ccc(=N)nc2O)[C@H](O)[C@@H]1O__MFLKGYTSNVVLIILTFFILLTKEEKNIKNNISGYCFLNFGLKKNAIIKKREKQNLKLFCYNGIRIGQGYDIHKIKVLDEEYNTYANNDFNKNEQSFKTLTLGGVKINNVLVLSHSDGDIIYHSIVDSILGALGSLDIGTLFPDKDEKNKNKNSAIFLRYARLLIYKKNYDIGNVDINVIAQVPKISNIRKNIIKNISTVLNIDESQISVKGKTHEKLGVIGEKKAIECFANILLIPKNS,./data/raw/alphafold//AF-P62368-F1-model_v4.pdb,667,4010,5404,5750 +740,40791,41528,MHKLAIIGYGAAGFAAMIKANELGVKPVLIGKGEIGGTCVNVGCVPSKRMLYIAEIYKKAREVTGSEVYPPFSSFQEKDGLVQEMRKTKYEDLLSYYDVELIQGEARFISPHAVKVNGQVIEAEKFVIATGSSPLIPRIPGLDKVGFWTNREALSPDRRIDSLAVIGGRALALEFAQMYSRMKVEVAILQRSPVLIPDWEPEASVEARRIMENDGVAVVTGVNVKEVRKGAGKIVITDKGEVEADEILLATGRKPNVDLGLENAGVRLNERGGIKVDDELRTDNPHIYAAGDVLGGKMLEALAGRQGSIATENALTGSHKRVDENAVPQVIFTQPNLARVGLTEAEARAKEGEVEARVLPMSSVAKAEIINSRLGFVKMVTMNGRIVGVHAVGENVAEMIGEAALAIRFGATVHDLIDTVHMFPTIAESLRLVALAFRSDVSRLSCCV,brenda,A4YG49,[Hg+2],0.4,37.0,6.7,1.16.1.1,43687.0,-0.3979400086720376,-0.6109243748081782,[Hg+2]__MHKLAIIGYGAAGFAAMIKANELGVKPVLIGKGEIGGTCVNVGCVPSKRMLYIAEIYKKAREVTGSEVYPPFSSFQEKDGLVQEMRKTKYEDLLSYYDVELIQGEARFISPHAVKVNGQVIEAEKFVIATGSSPLIPRIPGLDKVGFWTNREALSPDRRIDSLAVIGGRALALEFAQMYSRMKVEVAILQRSPVLIPDWEPEASVEARRIMENDGVAVVTGVNVKEVRKGAGKIVITDKGEVEADEILLATGRKPNVDLGLENAGVRLNERGGIKVDDELRTDNPHIYAAGDVLGGKMLEALAGRQGSIATENALTGSHKRVDENAVPQVIFTQPNLARVGLTEAEARAKEGEVEARVLPMSSVAKAEIINSRLGFVKMVTMNGRIVGVHAVGENVAEMIGEAALAIRFGATVHDLIDTVHMFPTIAESLRLVALAFRSDVSRLSCCV,./data/raw/alphafold//AF-A4YG49-F1-model_v4.pdb,2820,4491,4466,7790 +742,36504,37139,MKSWGLLLVAALALSGSYAVDRNNFKTCDQSGFCKRLRGFKPEKSEYSLNLDTVLVHGNVLSAEVDTVDTTAQERKVLWHYAMRLSALVDGTFRVEIDEVDPLYPRYRTQLALDGEPKADGLKLLSNENGKLTLMNSQGHKVVIRATPLKIEFLNKAGDVAVVLNDNAQLVVEPLRVKKERIDDEDGNAVEVEEEGTWGESFKSHHDSKPRGNEAVSLDFSFPDADNVYGIPEHTDKFALKTTTSGEPYRLFNLDVFEYELDSRMALYGAVPVMYSHGPKHSAGVFWHNSAETWVDVVNYADSTVVSSLVNLVTGGQKRRVDARFISESGIVDVFVFLGEKPADVFRQYAMLTGPAPLPPKFSLAYHQCRWNYVDEADVRSVDNGFDEHDIPADVIWLDIEYTDRKKYFTWDALKFPNPAEMVANLTSKGRKLVTIIDPHVKREAGYFLHEDATDLGYYVKDKEGKDYEGWCWPGSSSYLDFFNPVVSKYYAERYSFDNFPGTSKDVHIWNDMNEPSVFNGPEITMPKDCRHYKPPQDGNDGLAAFWEHRHVHNEYGLWNIRATHDGMLQRADNKYRPFILTRSAFAGTQRYAAVWTGDNMAEWGFLAVSVPMCLSLASAGISFCGSDVGGFFKYPEAELMTRWYQAGAFQPFFRAHSHIETKRREPWLYEPATTALLRDATRRRYALIDFWYTLFYEHSVDGLPVMRALFQEYPGEEDTYTIDDQYLLGNKLLVRPVVEPGVSNVKVYLPGAATRTLWYDVDTYHAYPANGYLTFDVTLSKIPVFQRGGSIVLRKERVRRSSALMADDPYTIVVALDANGTSEGSLYIDDGETYDYRNNKYIYAKLAYETGSMTYSFVNEKASYPTRSWVERIVIAGIKNPPKTAKLVQGDKQTSLQMTLHKGNDVLVVRKPAASMAQPWKIIFSY,brenda,L8B8V1,O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,2.37,37.0,6.5,3.2.1.207,7108.0,0.3747483460101038,0.3747483460101038,O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1__MKSWGLLLVAALALSGSYAVDRNNFKTCDQSGFCKRLRGFKPEKSEYSLNLDTVLVHGNVLSAEVDTVDTTAQERKVLWHYAMRLSALVDGTFRVEIDEVDPLYPRYRTQLALDGEPKADGLKLLSNENGKLTLMNSQGHKVVIRATPLKIEFLNKAGDVAVVLNDNAQLVVEPLRVKKERIDDEDGNAVEVEEEGTWGESFKSHHDSKPRGNEAVSLDFSFPDADNVYGIPEHTDKFALKTTTSGEPYRLFNLDVFEYELDSRMALYGAVPVMYSHGPKHSAGVFWHNSAETWVDVVNYADSTVVSSLVNLVTGGQKRRVDARFISESGIVDVFVFLGEKPADVFRQYAMLTGPAPLPPKFSLAYHQCRWNYVDEADVRSVDNGFDEHDIPADVIWLDIEYTDRKKYFTWDALKFPNPAEMVANLTSKGRKLVTIIDPHVKREAGYFLHEDATDLGYYVKDKEGKDYEGWCWPGSSSYLDFFNPVVSKYYAERYSFDNFPGTSKDVHIWNDMNEPSVFNGPEITMPKDCRHYKPPQDGNDGLAAFWEHRHVHNEYGLWNIRATHDGMLQRADNKYRPFILTRSAFAGTQRYAAVWTGDNMAEWGFLAVSVPMCLSLASAGISFCGSDVGGFFKYPEAELMTRWYQAGAFQPFFRAHSHIETKRREPWLYEPATTALLRDATRRRYALIDFWYTLFYEHSVDGLPVMRALFQEYPGEEDTYTIDDQYLLGNKLLVRPVVEPGVSNVKVYLPGAATRTLWYDVDTYHAYPANGYLTFDVTLSKIPVFQRGGSIVLRKERVRRSSALMADDPYTIVVALDANGTSEGSLYIDDGETYDYRNNKYIYAKLAYETGSMTYSFVNEKASYPTRSWVERIVIAGIKNPPKTAKLVQGDKQTSLQMTLHKGNDVLVVRKPAASMAQPWKIIFSY,./data/raw/alphafold//AF-L8B8V1-F1-model_v4.pdb,2491,8114,9985,11168 +751,18635,18906,MAGTGGGAEEFQLRGVLWGKAYSWKITGTTIDKVWSIVGDYVRVDNWVSSVVKSSHVVSGDANKTGCVRRFVCYPASEGESETVDYSELIHMNAAAHQYMYMIVGGNITGFSLMKNYVSNISLNSLPEADGGGVIFHWSFTAEPASNLTEQKCIEIVFPLYTTALKDLCTHLSIPESSVTLLGD,brenda,A0A1C9V3R6,N#C[C@H](O)c1ccccc1,0.63,10.0,5.0,4.1.2.10,328207.0,-0.2006594505464183,-0.2006594505464183,N#C[C@H](O)c1ccccc1__MAGTGGGAEEFQLRGVLWGKAYSWKITGTTIDKVWSIVGDYVRVDNWVSSVVKSSHVVSGDANKTGCVRRFVCYPASEGESETVDYSELIHMNAAAHQYMYMIVGGNITGFSLMKNYVSNISLNSLPEADGGGVIFHWSFTAEPASNLTEQKCIEIVFPLYTTALKDLCTHLSIPESSVTLLGD,./data/raw/alphafold//AF-A0A1C9V3R6-F1-model_v4.pdb,3930,4685,6491,6417 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+907,29688,30215,MGFADQRFNVNLSILFTELPLLERPAAAAAAGFTAVELWWPWIDSPTPEQSELDALKSAIEDAGVQLTGLNFYAGQLPGPDRGALSIPGEESERFRANIDVAADFARSLGCTALNALYGNRVEGVDPAEQDRLALENLVLAARAADRIGAVLLVEALNKPESPRYPLVSAPAAIAVVDRVNEATGLGNAKFLMDLYHLSMNGEDLPQVIDAYAAKTGHVQIADNPGRGAPGTGSLPLEDLLDRLAKAGYDGWVGLEYKPGDDPSAQSFSWLPAGARAAR,brenda,Q9Z596,O=C(O)C(=O)CO,55.0,30.0,7.0,5.3.1.22,1902.0,1.740362689494244,1.740362689494244,O=C(O)C(=O)CO__MGFADQRFNVNLSILFTELPLLERPAAAAAAGFTAVELWWPWIDSPTPEQSELDALKSAIEDAGVQLTGLNFYAGQLPGPDRGALSIPGEESERFRANIDVAADFARSLGCTALNALYGNRVEGVDPAEQDRLALENLVLAARAADRIGAVLLVEALNKPESPRYPLVSAPAAIAVVDRVNEATGLGNAKFLMDLYHLSMNGEDLPQVIDAYAAKTGHVQIADNPGRGAPGTGSLPLEDLLDRLAKAGYDGWVGLEYKPGDDPSAQSFSWLPAGARAAR,./data/raw/alphafold//AF-Q9Z596-F1-model_v4.pdb,1729,7121,9005,9281 +914,29502,30027,MGSTGETQMSPAQILDEEANFAMQLISSSVLPMVLKTAIELDLLEIMAKAGPGALLSPSDIASHLPTKNPDAPVMLDRILRLLASYSILICSLRDLPDGKVERLYGLASVCKFLTKNEDGVSVSPLCLMNQDKVLMESWYHLKDAILEGGIPFNKAYGMTAFEYHGTDPRFNKVFNKGMSDHSKIAMKKILETYKGFEGLASLVDVGGGTGAVLSTIVSKYPSIKGINFDLPHVIADAPAFPGVENVGGDMFVSVPQADAVFMKWICHDWSDEHCLRFLKNCYDALPENGKVILVECILPVAPDTSLATKGVMHVDAIMLAHNPGGKERTEKEFEGLARGAGFKGFEVMCCAFNTYVIEFRKQA,brenda,C6FFB6,O=C(O)/C=C/c1ccc(O)c(O)c1,0.01013,30.0,7.5,2.1.1.68,3694.0,-1.99439055463972,-1.99439055463972,O=C(O)/C=C/c1ccc(O)c(O)c1__MGSTGETQMSPAQILDEEANFAMQLISSSVLPMVLKTAIELDLLEIMAKAGPGALLSPSDIASHLPTKNPDAPVMLDRILRLLASYSILICSLRDLPDGKVERLYGLASVCKFLTKNEDGVSVSPLCLMNQDKVLMESWYHLKDAILEGGIPFNKAYGMTAFEYHGTDPRFNKVFNKGMSDHSKIAMKKILETYKGFEGLASLVDVGGGTGAVLSTIVSKYPSIKGINFDLPHVIADAPAFPGVENVGGDMFVSVPQADAVFMKWICHDWSDEHCLRFLKNCYDALPENGKVILVECILPVAPDTSLATKGVMHVDAIMLAHNPGGKERTEKEFEGLARGAGFKGFEVMCCAFNTYVIEFRKQA,./data/raw/alphafold//AF-C6FFB6-F1-model_v4.pdb,1707,2396,8976,9245 +915,27609,28088,MALPAFAARALGPPLQPEQGAPARTTCPRRHSRVEAELAASRPGSVAASVRAGPPRGVSLGFNSPPLQDKPPKAFSSLAGALRAPLFALLPRGRRRRMHDLRRRWDLGSLCRALLTRGLAAVGHSLKHVLSAIFSKIFGPLASVGNMDEKSNKLLLALVMLFLFAVIVLQYVCPGTECQLLRLQAFSSPVPDPYRSEDESSARFVPRYNFSRGDLLRKVDFDIKGDDLIVFLHIQKTGGTTFGRHLVRNIQLEQPCECRVGQKKCTCHRPGKRETWLFSRFSTGWSCGLHADWTELTSCVPAVVDGKRDARLRPSRNFHYITILRDPVSRYLSEWRHVQRGATWKASLHVCDGRPPTSEELPSCYTGDDWSGCPLKEFMDCPYNLANNRQVRMLSDLTLVGCYNLSVMPEKQRNKVLLESAKSNLKHMAFFGLTEFQRKTQYLFEKTFNMNFISPFTQYNTTRASSVEINEEIQKRIEGLNFLDMELYSYAKDLFLQRYQFMRQKEHQDARRKRQEQRKFLKGRFLQTHFQSQSQGQSQSQSPGQNLSQNPNPNPNQNLTQNLSHNLTPSSNPNSTQRENRGSQKQGSGQGQGDSGTSNGTNDYIGSVETWR,sabio,Q80UW0,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O,0.0002399999999999,37.0,6.8,2.8.2.-,10090.0,-3.619788758288575,-3.619788758288575,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O__MALPAFAARALGPPLQPEQGAPARTTCPRRHSRVEAELAASRPGSVAASVRAGPPRGVSLGFNSPPLQDKPPKAFSSLAGALRAPLFALLPRGRRRRMHDLRRRWDLGSLCRALLTRGLAAVGHSLKHVLSAIFSKIFGPLASVGNMDEKSNKLLLALVMLFLFAVIVLQYVCPGTECQLLRLQAFSSPVPDPYRSEDESSARFVPRYNFSRGDLLRKVDFDIKGDDLIVFLHIQKTGGTTFGRHLVRNIQLEQPCECRVGQKKCTCHRPGKRETWLFSRFSTGWSCGLHADWTELTSCVPAVVDGKRDARLRPSRNFHYITILRDPVSRYLSEWRHVQRGATWKASLHVCDGRPPTSEELPSCYTGDDWSGCPLKEFMDCPYNLANNRQVRMLSDLTLVGCYNLSVMPEKQRNKVLLESAKSNLKHMAFFGLTEFQRKTQYLFEKTFNMNFISPFTQYNTTRASSVEINEEIQKRIEGLNFLDMELYSYAKDLFLQRYQFMRQKEHQDARRKRQEQRKFLKGRFLQTHFQSQSQGQSQSQSPGQNLSQNPNPNPNQNLTQNLSHNLTPSSNPNSTQRENRGSQKQGSGQGQGDSGTSNGTNDYIGSVETWR,./data/raw/alphafold//AF-Q80UW0-F1-model_v4.pdb,1395,6647,6168,11887 +918,35790,36417,MAIALWYCPPQGSVAYETLQMLIFSFQTLFPDSPVFEPHVTVTSHLVCNSKDDVNKILTSCVAAIQSIRSHQTAKKGRKGQVSHAVAAPLVSFNGCSVGKQYFKKIVLECNKNKILYGVAQVMREMYVEIDPETRSSRAATWVHEEFHPHVSLLYSDIHPVSQASLRVVQQRIEDALDVQLVPREKRKGSGNADGSNEVQMRWDFDVSSSLSWNIPGTFKVVNCVGPVQEWEVLGRVDV,sabio,P53314,O=P1([O-])OC2O[C@H](CO)[C@@H](O1)[C@H]2O,0.33,37.0,7.0,3.1.4.-,4932.0,-0.4814860601221125,-0.4814860601221125,O=P1([O-])OC2O[C@H](CO)[C@@H](O1)[C@H]2O__MAIALWYCPPQGSVAYETLQMLIFSFQTLFPDSPVFEPHVTVTSHLVCNSKDDVNKILTSCVAAIQSIRSHQTAKKGRKGQVSHAVAAPLVSFNGCSVGKQYFKKIVLECNKNKILYGVAQVMREMYVEIDPETRSSRAATWVHEEFHPHVSLLYSDIHPVSQASLRVVQQRIEDALDVQLVPREKRKGSGNADGSNEVQMRWDFDVSSSLSWNIPGTFKVVNCVGPVQEWEVLGRVDV,./data/raw/alphafold//AF-P53314-F1-model_v4.pdb,2344,7919,9744,10910 +933,36087,36715,MGNGMNKILPGLYIGNFKDARDAEQLSKNKVTHILSVHDSARPMLEGVKYLCIPAADSPSQNLTRHFKESIKFIHECRLRGESCLVHCLAGVSRSVTLVIAYIMTVTDFGWEDALHTVRAGRSCANPNVGFQRQLQEFEKHEVHQYRQWLKEEYGESPLQDAEEAKNILAAPGILKFWAFLRRL,sabio,Q9NRW4,O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,0.412,30.0,6.0,3.1.3.48,9606.0,-0.3851027839668654,-0.3851027839668654,O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MGNGMNKILPGLYIGNFKDARDAEQLSKNKVTHILSVHDSARPMLEGVKYLCIPAADSPSQNLTRHFKESIKFIHECRLRGESCLVHCLAGVSRSVTLVIAYIMTVTDFGWEDALHTVRAGRSCANPNVGFQRQLQEFEKHEVHQYRQWLKEEYGESPLQDAEEAKNILAAPGILKFWAFLRRL,./data/raw/alphafold//AF-Q9NRW4-F1-model_v4.pdb,2386,7976,9814,10983 +955,14975,15188,MRRAVLEILEERIIHNVKEIHRFSGKRIIAVVKANAYGIGVREVSRILEGLEEVDAFAVACTQEGVELRECGIKKKILILGGILEEDVKLLEEYDLTPVISDPEHLKVLKDRNIKFHVKYDTGMGRLGFTNEIIKDPRVEGVMSHFSSPADRNFSKLQIKRFEEILKNYEKVKYIHLESSAGLIYRVPFTTHVRVGLAIYGEKPLKDYPLEVKPALRLRARLISVKELPENYPVSYGRTYITKRKTKLGVVAFGYADGLMKTLSNRSFLIFEGRKVPIIGNITMDMTMVDLSGTEARTGDWVYIVNEERSFTPLARDAGTIPYEIMCNLSRRVERLVIKKR,uniprot_search,Q9RER4,C[C@@H](N)C(=O)O,1.8,90.0,9.5,5.1.1.1,2714.0,0.255272505103306,0.255272505103306,C[C@@H](N)C(=O)O__MRRAVLEILEERIIHNVKEIHRFSGKRIIAVVKANAYGIGVREVSRILEGLEEVDAFAVACTQEGVELRECGIKKKILILGGILEEDVKLLEEYDLTPVISDPEHLKVLKDRNIKFHVKYDTGMGRLGFTNEIIKDPRVEGVMSHFSSPADRNFSKLQIKRFEEILKNYEKVKYIHLESSAGLIYRVPFTTHVRVGLAIYGEKPLKDYPLEVKPALRLRARLISVKELPENYPVSYGRTYITKRKTKLGVVAFGYADGLMKTLSNRSFLIFEGRKVPIIGNITMDMTMVDLSGTEARTGDWVYIVNEERSFTPLARDAGTIPYEIMCNLSRRVERLVIKKR,./data/raw/alphafold//AF-Q9RER4-F1-model_v4.pdb,488,3748,5100,5419 +965,32823,33408,MSSLNQLVSGLASGAVRIVDLTHTLDPDFPVIVLPPEFGQCARFRMEEISAYDHRGPAWKWHNISMSEHTGTHFDAPSHWISGKDVPNGSVDEIPAEAFVGPVVVIDCSKGAAENDDFELTPEIIAGWESEHGRIPEDAWVLMRTDWSKRRGADYLNMRADGPHSPGPTPEAIRFLIEERNIRGFGTETVGTDAGQGAHYVPPYPAHYLLHGAGKYGLQCLANLDQLPATGAVLIAAPLKIKNGTGSPLRVLAMVTE,brenda,A0P0F0,O=C1Nc2ccccc2C1=O,0.0157,40.0,8.15,3.5.2.20,187304.0,-1.8041003475907664,-1.8041003475907664,O=C1Nc2ccccc2C1=O__MSSLNQLVSGLASGAVRIVDLTHTLDPDFPVIVLPPEFGQCARFRMEEISAYDHRGPAWKWHNISMSEHTGTHFDAPSHWISGKDVPNGSVDEIPAEAFVGPVVVIDCSKGAAENDDFELTPEIIAGWESEHGRIPEDAWVLMRTDWSKRRGADYLNMRADGPHSPGPTPEAIRFLIEERNIRGFGTETVGTDAGQGAHYVPPYPAHYLLHGAGKYGLQCLANLDQLPATGAVLIAAPLKIKNGTGSPLRVLAMVTE,./data/raw/alphafold//AF-A0P0F0-F1-model_v4.pdb,2035,7576,6261,9942 +970,23559,23921,MEDRVLIKNDVTELIGNTPMVYLNKIVDGCVARIAAKLEMMEPCSSIKDRIAYSMIKDAEDKGLITPGKSTLIEATGGNTGIGLASIGASRGYKVILLMPSTMSLERRIILRALGAEVHLTDISIGIKGQLEKAKEILSKTPGGYIPHQFINPENPEIHYRTTGPEIWRDSAGKVDILVAGVGTGGTVTGTGKFLKEKNKDIKVCVVEPSESAVLSGGKPGPHLIQGIGSGEIPANLDLSIVDEIIQVTGEEAIETTKLLAIKEGLLVGISSGASAAAALKVAKRPENVGKLIVVIFPSGGERYLSTELFESVRYEAENLPVE,sabio,F4K5T2,NC(CS)C(=O)O,0.4,37.0,8.0,4.4.1.1,3702.0,-0.3979400086720376,-0.3979400086720376,NC(CS)C(=O)O__MEDRVLIKNDVTELIGNTPMVYLNKIVDGCVARIAAKLEMMEPCSSIKDRIAYSMIKDAEDKGLITPGKSTLIEATGGNTGIGLASIGASRGYKVILLMPSTMSLERRIILRALGAEVHLTDISIGIKGQLEKAKEILSKTPGGYIPHQFINPENPEIHYRTTGPEIWRDSAGKVDILVAGVGTGGTVTGTGKFLKEKNKDIKVCVVEPSESAVLSGGKPGPHLIQGIGSGEIPANLDLSIVDEIIQVTGEEAIETTKLLAIKEGLLVGISSGASAAAALKVAKRPENVGKLIVVIFPSGGERYLSTELFESVRYEAENLPVE,./data/raw/alphafold//AF-F4K5T2-F1-model_v4.pdb,3572,6258,8087,8585 +982,38961,39653,MALTRNRPFVVVLLLGFVIMSTITIGAQSIGVCYGRNGNNLPSASQVINLYKSNGIGSMRIYDPNSDTLQALRGSDIELILDVPNTDLQSLASDASAAATWVQNNVVNYASEVKFRYIAVGNEVLPTGSNAQYAQYVLPAMKNVQSAITSAGLQDQIKVSTATFSAVLGKSYPPSEGSFSDDVSSFINPIISFLAENGSPLLANIYPYFSYTGDTQNIRLDYALFTASGVVVQDGSYQYQNLFDALLDALYAALEKAGGSNLKIVVSESGWPSEGGTAATVDNARTYYKNLINHVKGGTPRKSGAIETYLFAMFDENQKTGLETEKHFGLFTPGQESKYQISFS,brenda,A7PQW3,OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@@H]3[C@@H](O)[C@@H](O)O[C@H](CO)[C@H]3O)O[C@H](CO)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,0.228,37.0,5.4,3.2.1.39,29760.0,-0.6420651529995463,-0.6420651529995463,OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@@H]3[C@@H](O)[C@@H](O)O[C@H](CO)[C@H]3O)O[C@H](CO)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O__MALTRNRPFVVVLLLGFVIMSTITIGAQSIGVCYGRNGNNLPSASQVINLYKSNGIGSMRIYDPNSDTLQALRGSDIELILDVPNTDLQSLASDASAAATWVQNNVVNYASEVKFRYIAVGNEVLPTGSNAQYAQYVLPAMKNVQSAITSAGLQDQIKVSTATFSAVLGKSYPPSEGSFSDDVSSFINPIISFLAENGSPLLANIYPYFSYTGDTQNIRLDYALFTASGVVVQDGSYQYQNLFDALLDALYAALEKAGGSNLKIVVSESGWPSEGGTAATVDNARTYYKNLINHVKGGTPRKSGAIETYLFAMFDENQKTGLETEKHFGLFTPGQESKYQISFS,./data/raw/alphafold//AF-A7PQW3-F1-model_v4.pdb,2665,8370,10308,11531 +992,39746,40455,MTQAHPEWYKSAVFYELSVRTFQDGNGDGKGDFPGLTSRLDYLKNLGVDCLWLLPWFPSPLRDDGYDVADYRGIHPDLGTLDDFKVFLREAHARGLRVIGDLVTNHTSSDHPWFQAARRGPTLPDGSPNEYHDYYVWSDEGKEYADTRIIFTDTEVSNWTLDEQAGKYYWHRFFASQPDLNYDNPKVVEELHGAARFWLDLGLDGFRVDAVPYLIEREGTSCENLPETHEILKGFRAMVDREYPGRLLLAEANQWPEEVVEYFGTEAEPEFHMCFNFPVMPRLYMSLKREDTSSIREIMGRLPKIPSFGQWCTFLRNHDELTLEMVTDDERAFMYAAYAPDARMKINVGIRRRLAPLLDNDRRRIELLNTVLLALPGSPILYYGDEIGMGDDLGLPDRNGVRTPMQWNAGTSGGFSTAQPSDCFFPPIQDPVYGFGRVNVQSQLQDPSSLLKWTARQLELRRAHPAFAHGDLTFIETGNPAILAFTRQYDGETLLIVSNFAGNAQAGLLDLAPFVGRAPVTLSGASPLPVVTGNGQYPVVMGKYDYYWLRLN,brenda,Q9RST7,OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O,290.7,30.0,7.6,5.4.99.16,1299.0,2.463445031770428,2.463445031770428,OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O__MTQAHPEWYKSAVFYELSVRTFQDGNGDGKGDFPGLTSRLDYLKNLGVDCLWLLPWFPSPLRDDGYDVADYRGIHPDLGTLDDFKVFLREAHARGLRVIGDLVTNHTSSDHPWFQAARRGPTLPDGSPNEYHDYYVWSDEGKEYADTRIIFTDTEVSNWTLDEQAGKYYWHRFFASQPDLNYDNPKVVEELHGAARFWLDLGLDGFRVDAVPYLIEREGTSCENLPETHEILKGFRAMVDREYPGRLLLAEANQWPEEVVEYFGTEAEPEFHMCFNFPVMPRLYMSLKREDTSSIREIMGRLPKIPSFGQWCTFLRNHDELTLEMVTDDERAFMYAAYAPDARMKINVGIRRRLAPLLDNDRRRIELLNTVLLALPGSPILYYGDEIGMGDDLGLPDRNGVRTPMQWNAGTSGGFSTAQPSDCFFPPIQDPVYGFGRVNVQSQLQDPSSLLKWTARQLELRRAHPAFAHGDLTFIETGNPAILAFTRQYDGETLLIVSNFAGNAQAGLLDLAPFVGRAPVTLSGASPLPVVTGNGQYPVVMGKYDYYWLRLN,./data/raw/alphafold//AF-Q9RST7-F1-model_v4.pdb,2750,8511,4563,11725 +998,10915,11071,MATLFIADLHLCVEEPAITAGFLRFLAGEARKADALYILGDLFEAWIGDDDPNPLHRKMAAAIKAVSDSGVPCYFIHGNRDFLLGKRFARESGMTLLPEEKVLELYGRRVLIMHGDTLCTDDAGYQAFRAKVHKPWLQTLFLALPLFVRKRIAARMRANSKEANSSKSLAIMDVNQNAVVSAMEKHQVQWLIHGHTHRPAVHELIANQQPAFRVVLGAWHTEGSMVKVTADDVELIHFPF,brenda,P43341,CCCCCCCCCCC[C@@H](O)CC(=O)O[C@H]1[C@H](O)[C@@H](CO)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)[C@@H]1N=C(O)C[C@H](O)CCCCCCCCCCC,0.0617,30.0,8.0,3.6.1.54,562.0,-1.2097148359667584,-1.2097148359667584,CCCCCCCCCCC[C@@H](O)CC(=O)O[C@H]1[C@H](O)[C@@H](CO)O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)[C@@H]1N=C(O)C[C@H](O)CCCCCCCCCCC__MATLFIADLHLCVEEPAITAGFLRFLAGEARKADALYILGDLFEAWIGDDDPNPLHRKMAAAIKAVSDSGVPCYFIHGNRDFLLGKRFARESGMTLLPEEKVLELYGRRVLIMHGDTLCTDDAGYQAFRAKVHKPWLQTLFLALPLFVRKRIAARMRANSKEANSSKSLAIMDVNQNAVVSAMEKHQVQWLIHGHTHRPAVHELIANQQPAFRVVLGAWHTEGSMVKVTADDVELIHFPF,./data/raw/alphafold//AF-P43341-F1-model_v4.pdb,5397,3175,3916,4560 +1004,20349,20656,MLPVKNLFVLYTGGTIGMLETPRGLAPAGGFETRMRDHLRTLGDAPDLRWRFAELQPPLDSANMSQGNWLAMRDAIVAALDAGHDGVLLLHGTDTLAYSAAALSFLLLDLPVPVLLTGSMLPAGAPGSDAWDNLVGALRVLQAGHARGVQVYFNDALLHGARVSKLRSDAFDAFAELPRPRQAEHAPVPATLGYRQPRREVNLAVLPLYPGLRAAHLRGLLDSGVEALLLECYGSGTGPSDDEELLAALREAHARGVLLAAVSQCAYGAVEFGVYAAGSRLRDAGLVSAGGMTREAALGKLFGLLGAGLGRDDAQRWFALDLCGENAD,brenda,A0A0U3U5E8,N=C(O)C[C@H](N)C(=O)O,63.3,37.0,7.5,3.5.1.1,287.0,1.801403710017355,1.801403710017355,N=C(O)C[C@H](N)C(=O)O__MLPVKNLFVLYTGGTIGMLETPRGLAPAGGFETRMRDHLRTLGDAPDLRWRFAELQPPLDSANMSQGNWLAMRDAIVAALDAGHDGVLLLHGTDTLAYSAAALSFLLLDLPVPVLLTGSMLPAGAPGSDAWDNLVGALRVLQAGHARGVQVYFNDALLHGARVSKLRSDAFDAFAELPRPRQAEHAPVPATLGYRQPRREVNLAVLPLYPGLRAAHLRGLLDSGVEALLLECYGSGTGPSDDEELLAALREAHARGVLLAAVSQCAYGAVEFGVYAAGSRLRDAGLVSAGGMTREAALGKLFGLLGAGLGRDDAQRWFALDLCGENAD,./data/raw/alphafold//AF-A0A0U3U5E8-F1-model_v4.pdb,4209,5107,7013,7018 +1029,25004,25394,MPYLQPPRPHPHPHPTSRLSRASPPSPFPFFPAGTSRSGRLQPVPVSGHSASRVSKGKFAVAAVTLDDYLPMRSTEVKNRTSTDGIKSLRLITAVKTPYLPDGRFDLEAYDSLINTQINGGAEGVIVGGTTGEGHLMSWDEHIMLIGHTVNCFGANIKVIGNTGSNSTREAVHATEQGFAVGMHAALHVNPYYGKTSTEGLISHFKEVLPMGPTIIYNVPSRTSQDIPPPVIEALSSYSNMAGVKECVGHERVKCYTDKGISIWSGNDDECHDSRWKYGATGVISVASNLVPGLMHSLMFEGENAALNEKLLPLMKWLFCEPNPIGLNTALAQLGVVRPVFRLPYTPLPLEKRVEFVRIVEAIGRENFVGQKESRVLDDDDFVLISRY,brenda,P24846,N[C@@H](CC=O)C(=O)O,0.07,30.0,8.0,4.3.3.7,4565.0,-1.154901959985743,-1.154901959985743,N[C@@H](CC=O)C(=O)O__MPYLQPPRPHPHPHPTSRLSRASPPSPFPFFPAGTSRSGRLQPVPVSGHSASRVSKGKFAVAAVTLDDYLPMRSTEVKNRTSTDGIKSLRLITAVKTPYLPDGRFDLEAYDSLINTQINGGAEGVIVGGTTGEGHLMSWDEHIMLIGHTVNCFGANIKVIGNTGSNSTREAVHATEQGFAVGMHAALHVNPYYGKTSTEGLISHFKEVLPMGPTIIYNVPSRTSQDIPPPVIEALSSYSNMAGVKECVGHERVKCYTDKGISIWSGNDDECHDSRWKYGATGVISVASNLVPGLMHSLMFEGENAALNEKLLPLMKWLFCEPNPIGLNTALAQLGVVRPVFRLPYTPLPLEKRVEFVRIVEAIGRENFVGQKESRVLDDDDFVLISRY,./data/raw/alphafold//AF-P24846-F1-model_v4.pdb,1017,6119,7911,10468 +1041,30370,30907,MSSEKPETITHVGCNRFGFDSTVDIETLRSLYLSPAYIKEGGDVKVSLDAPQKDFSTETTYDHNTNTIQYSTVNKFPPVKLLPNHERKRILVTGGAGFVGSHLVDRLMLLGHEVTVLDNFFTGSRTTVSHWIGHPNFEMVRHDVVEPFLIEVDQIYHLACPASPPHYQINAVKTLKTSFEGTLNMLGLAKRTGARFLITSTSEVYGDPEEHPQREDYWGHVNCIGPRACYDEGKRVAETLTYGYHRKDGVEVRVARIFNTFGPRMNPYDGRVVSNFIIQALKGEDMTVYGDGSQTRSFQYVHDLIDGLILLMNGPDTRPVNIGNGDEFTILEFAEAVRDIVEKVQKEEGNPLAKRVNIIHKEIPIDDPQRRRPDTTRAKESLQWQPRWNVRQGVEEMVRYYSARIREGAI,sabio,Q96V00,O=C(O)C1OC(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)C(O)C(O)C1O,0.7,23.0,7.4,4.1.1.35,5207.0,-0.1549019599857432,-0.1549019599857432,O=C(O)C1OC(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)C(O)C(O)C1O__MSSEKPETITHVGCNRFGFDSTVDIETLRSLYLSPAYIKEGGDVKVSLDAPQKDFSTETTYDHNTNTIQYSTVNKFPPVKLLPNHERKRILVTGGAGFVGSHLVDRLMLLGHEVTVLDNFFTGSRTTVSHWIGHPNFEMVRHDVVEPFLIEVDQIYHLACPASPPHYQINAVKTLKTSFEGTLNMLGLAKRTGARFLITSTSEVYGDPEEHPQREDYWGHVNCIGPRACYDEGKRVAETLTYGYHRKDGVEVRVARIFNTFGPRMNPYDGRVVSNFIIQALKGEDMTVYGDGSQTRSFQYVHDLIDGLILLMNGPDTRPVNIGNGDEFTILEFAEAVRDIVEKVQKEEGNPLAKRVNIIHKEIPIDDPQRRRPDTTRAKESLQWQPRWNVRQGVEEMVRYYSARIREGAI,./data/raw/alphafold//AF-Q96V00-F1-model_v4.pdb,1786,7223,9155,9477 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+1067,25486,25896,MKHNLQDNLQGEQMANTNSNGGKKPFSDAKIIERANLLRDNDLYFFFRAIEETEASTVTVKGKKQIMIGSNNYLGLTHHPAVKEAAIKAVEKYGTGCTGSRFLNGNLNIHEELDEKLAAYLGHEKAIVFSTGMQANLGALSAICGPKDLMLFDSENHASIIDASRLSLGTTFKYKHNDMASLEELLESNMSRFNRVIIVADGVFSMTGDILRLPEVVKLAKKYGAYVYVDDAHGLGVMGPQGRGTMAHFDVTKDVDFNMGTFSKSFASIGGVISGSKDAIDYVRHSARSFMFSASMPPAAVATVSACIDVVQNDETILNNLWSNVEFMRNGFKELGFFTYGSQTPIIPLFIGDDMKALKMTKWLESKGVFCTPVLPPAVPKGETLIRTSYMASHNREDLSTVLEVFAEAKKIFDIPNHLH,brenda,A7BFV8,N[C@@H](CO)C(=O)O,3.7,,,2.3.1.50,960.0,0.568201724066995,0.568201724066995,N[C@@H](CO)C(=O)O__MKHNLQDNLQGEQMANTNSNGGKKPFSDAKIIERANLLRDNDLYFFFRAIEETEASTVTVKGKKQIMIGSNNYLGLTHHPAVKEAAIKAVEKYGTGCTGSRFLNGNLNIHEELDEKLAAYLGHEKAIVFSTGMQANLGALSAICGPKDLMLFDSENHASIIDASRLSLGTTFKYKHNDMASLEELLESNMSRFNRVIIVADGVFSMTGDILRLPEVVKLAKKYGAYVYVDDAHGLGVMGPQGRGTMAHFDVTKDVDFNMGTFSKSFASIGGVISGSKDAIDYVRHSARSFMFSASMPPAAVATVSACIDVVQNDETILNNLWSNVEFMRNGFKELGFFTYGSQTPIIPLFIGDDMKALKMTKWLESKGVFCTPVLPPAVPKGETLIRTSYMASHNREDLSTVLEVFAEAKKIFDIPNHLH,./data/raw/alphafold//AF-A7BFV8-F1-model_v4.pdb,3832,6236,8063,12008 +1071,30263,30800,MRTKRVFHAVDSHTEGMPTRVITGGVGVIPGSTMAERREHFLAEMDHVRTLLMYEPRGHSAMSGAILQPPTRPDADYGVLYIEVSGCLPMCGHGTIGVATVLVETGMVEVVEPVTTIRLDTPAGLVVAEVRVEDGAATAVTITNVPSFSAGLDRTVKVPGIGEVTYDLAYGGNFYAILPIESVGLPFDRAHKQQILDAGLAIMDAINEQDEPVHPLDAGIRGCHHVQFTAPGSDARHSRHAMAIHPGWFDRSPCGTGTSARMAQLHARGELPLDTDFVNESFIGTRFVGRLVEETEVTDLPAVVPTITGRAWVTGTAQYFLDPRDPFPEGFLL,sabio,D2AV87,O=C(O)C1CC(O)CN1,7.8,25.0,8.0,5.1.1.8,2001.0,0.8920946026904804,0.8920946026904804,O=C(O)C1CC(O)CN1__MRTKRVFHAVDSHTEGMPTRVITGGVGVIPGSTMAERREHFLAEMDHVRTLLMYEPRGHSAMSGAILQPPTRPDADYGVLYIEVSGCLPMCGHGTIGVATVLVETGMVEVVEPVTTIRLDTPAGLVVAEVRVEDGAATAVTITNVPSFSAGLDRTVKVPGIGEVTYDLAYGGNFYAILPIESVGLPFDRAHKQQILDAGLAIMDAINEQDEPVHPLDAGIRGCHHVQFTAPGSDARHSRHAMAIHPGWFDRSPCGTGTSARMAQLHARGELPLDTDFVNESFIGTRFVGRLVEETEVTDLPAVVPTITGRAWVTGTAQYFLDPRDPFPEGFLL,./data/raw/alphafold//AF-D2AV87-F1-model_v4.pdb,1906,7206,9131,9446 +1080,20391,20699,MDHLLWRMLPLLALLASFFYFFQSQKLTYNDCSLLPYSHFWIISKNIVTPRGVISGAVEVKEGNIVSVVKEEDWHVNFKRGHMIDYGEVVVMPGFIDVHAHLDDPGRTEWEGFPSGTKAAAAGGITTLIDMPLNSDPSTVSVETLRLKLEAAEKNIYVDVGFWGGLVPENAFNGSSLEALLSAGVLGLKSFMCPSGINDFPMTDATHIKEGLSVLAKYRRPLLVHAEIQQDSESYIEDGMDDPRHYSTYLKTRPASWEEAAIRELLTVSKDTRIGGPAEGSHLHIVHLSDSGSSLQLLKQAKRSGDSVTVETCPHYLAFSAEEIQDGDTRFKCAPPIRDATNKEALWKALLKGDIDMLSSDHSPTVPELKLLNEGNFLRAWGGISSLQFVFPVTWTYGRKYGVTLEQLALWWSERPAKLAGQESKGGIVVGKHADIVIWDPNAEFDLSDDLPIYIKHSSISAYKGTKLSGKVLATFVRGNLVYREGKHAPTACGSPILAK,uniprot_search,B9RZ78,N=C(O)NC1N=C(O)N=C1O,13.8,30.0,7.55,3.5.2.5,3988.0,1.1398790864012365,1.1398790864012365,N=C(O)NC1N=C(O)N=C1O__MDHLLWRMLPLLALLASFFYFFQSQKLTYNDCSLLPYSHFWIISKNIVTPRGVISGAVEVKEGNIVSVVKEEDWHVNFKRGHMIDYGEVVVMPGFIDVHAHLDDPGRTEWEGFPSGTKAAAAGGITTLIDMPLNSDPSTVSVETLRLKLEAAEKNIYVDVGFWGGLVPENAFNGSSLEALLSAGVLGLKSFMCPSGINDFPMTDATHIKEGLSVLAKYRRPLLVHAEIQQDSESYIEDGMDDPRHYSTYLKTRPASWEEAAIRELLTVSKDTRIGGPAEGSHLHIVHLSDSGSSLQLLKQAKRSGDSVTVETCPHYLAFSAEEIQDGDTRFKCAPPIRDATNKEALWKALLKGDIDMLSSDHSPTVPELKLLNEGNFLRAWGGISSLQFVFPVTWTYGRKYGVTLEQLALWWSERPAKLAGQESKGGIVVGKHADIVIWDPNAEFDLSDDLPIYIKHSSISAYKGTKLSGKVLATFVRGNLVYREGKHAPTACGSPILAK,./data/raw/alphafold//AF-B9RZ78-F1-model_v4.pdb,4218,5119,7025,7031 +1081,28178,28664,MELLRTITYQPAASTKMCEQALGKGCGADSKKKRPPQPPEESQPPQSQAQVPPAAPHHHHHHSHSGPEISRIIVDPTTGKRYCRGKVLGKGGFAKCYEMTDLTNNKVYAAKIIPHSRVAKPHQREKIDKEIELHRILHHKHVVQFYHYFEDKENIYILLEYCSRRSMAHILKARKVLTEPEVRYYLRQIVSGLKYLHEQEILHRDLKLGNFFINEAMELKVGDFGLAARLEPLEHRRRTICGTPNYLSPEVLNKQGHGCESDIWALGCVMYTMLLGRPPFETTNLKETYRCIREARYTMPSSLLAPAKHLIASMLSKNPEDRPSLDDIIRHDFFLQGFTPDRLSSSCCHTVPDFHLSSPAKNFFKKAAAALFGGKKDKARYIDTHNRVSKEDEDIYKLRHDLKKTSITQQPSKHRTDEELQPPTTTVARSGTPAVENKQQIGDAIRMIVRGTLGSCSSSSECLEDSTMGSVADTVARVLRGCLENMPEADCIPKEQLSTSFQWVTKWVDYSNKYGFGYQLSDHTVGVLFNNGAHMSLLPDKKTVHYYAELGQCSVFPATDAPEQFISQVTVLKYFSHYMEENLMDGGDLPSVTDIRRPRLYLLQWLKSDKALMMLFNDGTFQVNFYHDHTKIIICSQNEEYLLTYINEDRISTTFRLTTLLMSGCSSELKNRMEYALNMLLQRCN,brenda,Q9NYY3,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.002,25.0,7.75,2.7.11.21,9606.0,-2.6989700043360187,-2.6989700043360187,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MELLRTITYQPAASTKMCEQALGKGCGADSKKKRPPQPPEESQPPQSQAQVPPAAPHHHHHHSHSGPEISRIIVDPTTGKRYCRGKVLGKGGFAKCYEMTDLTNNKVYAAKIIPHSRVAKPHQREKIDKEIELHRILHHKHVVQFYHYFEDKENIYILLEYCSRRSMAHILKARKVLTEPEVRYYLRQIVSGLKYLHEQEILHRDLKLGNFFINEAMELKVGDFGLAARLEPLEHRRRTICGTPNYLSPEVLNKQGHGCESDIWALGCVMYTMLLGRPPFETTNLKETYRCIREARYTMPSSLLAPAKHLIASMLSKNPEDRPSLDDIIRHDFFLQGFTPDRLSSSCCHTVPDFHLSSPAKNFFKKAAAALFGGKKDKARYIDTHNRVSKEDEDIYKLRHDLKKTSITQQPSKHRTDEELQPPTTTVARSGTPAVENKQQIGDAIRMIVRGTLGSCSSSSECLEDSTMGSVADTVARVLRGCLENMPEADCIPKEQLSTSFQWVTKWVDYSNKYGFGYQLSDHTVGVLFNNGAHMSLLPDKKTVHYYAELGQCSVFPATDAPEQFISQVTVLKYFSHYMEENLMDGGDLPSVTDIRRPRLYLLQWLKSDKALMMLFNDGTFQVNFYHDHTKIIICSQNEEYLLTYINEDRISTTFRLTTLLMSGCSSELKNRMEYALNMLLQRCN,./data/raw/alphafold//AF-Q9NYY3-F1-model_v4.pdb,1509,6795,8631,8852 +1089,30728,31274,MSYQPQTEAATSRFLNVEEAGKTLRIHFNDCGQGDETVVLLHGSGPGATGWANFSRNIDPLVEAGYRVILLDCPGWGKSDSVVNSGSRSDLNARILKSVVDQLDIAKIHLLGNSMGGHSSVAFTLKWPERVGKLVLMGGGTGGMSLFTPMPTEGIKRLNQLYRQPTIENLKLMMDIFVFDTSDLTDALFEARLNNMLSRRDHLENFVKSLEANPKQFPDFGPRLAEIKAQTLIVWGRNDRFVPMDAGLRLLSGIAGSELHIFRDCGHWAQWEHADAFNQLVLNFLARP,brenda,P77044,O=C(O)CCC(=O)/C=C\C=C(\O)C(=O)O,0.0068,25.0,8.0,3.7.1.14,562.0,-2.167491087293764,-2.167491087293764,O=C(O)CCC(=O)/C=C\C=C(\O)C(=O)O__MSYQPQTEAATSRFLNVEEAGKTLRIHFNDCGQGDETVVLLHGSGPGATGWANFSRNIDPLVEAGYRVILLDCPGWGKSDSVVNSGSRSDLNARILKSVVDQLDIAKIHLLGNSMGGHSSVAFTLKWPERVGKLVLMGGGTGGMSLFTPMPTEGIKRLNQLYRQPTIENLKLMMDIFVFDTSDLTDALFEARLNNMLSRRDHLENFVKSLEANPKQFPDFGPRLAEIKAQTLIVWGRNDRFVPMDAGLRLLSGIAGSELHIFRDCGHWAQWEHADAFNQLVLNFLARP,./data/raw/alphafold//AF-P77044-F1-model_v4.pdb,1763,7265,9212,9538 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+1203,27699,28178,MTAKNSPKEFTASESEVCIKTFKEQMRLELELPKLPGNRPTSPKISPRSSPRNSPCFFRKLLVNKSIRQRRRFTVAHTCFDVENGPSPGRSPLDPQAGSSSGLVLHAAFPGHSQRRESFLYDLDSDYDLSPKAMSRNSSLPSEQHGDDLIVTPFAQVLASLRSVRNNFTLLTNLHGAPNKRSPAASQAPVSRVSLQEESYQKLAMETLEELDWCLDQLETIQTYRSVSEMASNKFKRMLNRELTHLSEMSRSGNQVSEYISNTFLDKQNDVEIPSPTQKDREKKKKQQLMTQISGVKKLMHSSSLNNTSISRFGINTENEDHLAKELEDLNKWGLNIFNVAGYSHNRPLTCIMYAIFQERDLLKTFKISSDTFVTYMMTLEDHYHSDVAYHNSLHAADVAQSTHVLLSTPALDAVFTDLEILAAIFAAAIHDVDHPGVSNQFLINTNSELALMYNDESVLENHHLAVGFKLLQEEHCDIFQNLTKKQRQTLRKMVIDMVLATDMSKHMSLLADLKTMVETKKVTSSGVLLLDNYTDRIQVLRNMVHCADLSNPTKSLELYRQWTDRIMEEFFQQGDKERERGMEISPMCDKHTASVEKSQVGFIDYIVHPLWETWADLVQPDAQDILDTLEDNRNWYQSMIPQSPSPPLDERSRDCQGLMEKFQFELTLEEEDSEGPEKEGEGHSYFSSTKTLCVIDPENRDSLEETDIDIATEDKSPIDT,brenda,Q9QXI7,Nc1ncnc2c1ncn2[C@@H]1O[C@@H]2COP(=O)(O)O[C@H]2[C@H]1O,0.007,30.0,8.0,3.1.4.53,10090.0,-2.154901959985743,-2.154901959985743,Nc1ncnc2c1ncn2[C@@H]1O[C@@H]2COP(=O)(O)O[C@H]2[C@H]1O__MTAKNSPKEFTASESEVCIKTFKEQMRLELELPKLPGNRPTSPKISPRSSPRNSPCFFRKLLVNKSIRQRRRFTVAHTCFDVENGPSPGRSPLDPQAGSSSGLVLHAAFPGHSQRRESFLYDLDSDYDLSPKAMSRNSSLPSEQHGDDLIVTPFAQVLASLRSVRNNFTLLTNLHGAPNKRSPAASQAPVSRVSLQEESYQKLAMETLEELDWCLDQLETIQTYRSVSEMASNKFKRMLNRELTHLSEMSRSGNQVSEYISNTFLDKQNDVEIPSPTQKDREKKKKQQLMTQISGVKKLMHSSSLNNTSISRFGINTENEDHLAKELEDLNKWGLNIFNVAGYSHNRPLTCIMYAIFQERDLLKTFKISSDTFVTYMMTLEDHYHSDVAYHNSLHAADVAQSTHVLLSTPALDAVFTDLEILAAIFAAAIHDVDHPGVSNQFLINTNSELALMYNDESVLENHHLAVGFKLLQEEHCDIFQNLTKKQRQTLRKMVIDMVLATDMSKHMSLLADLKTMVETKKVTSSGVLLLDNYTDRIQVLRNMVHCADLSNPTKSLELYRQWTDRIMEEFFQQGDKERERGMEISPMCDKHTASVEKSQVGFIDYIVHPLWETWADLVQPDAQDILDTLEDNRNWYQSMIPQSPSPPLDERSRDCQGLMEKFQFELTLEEEDSEGPEKEGEGHSYFSSTKTLCVIDPENRDSLEETDIDIATEDKSPIDT,./data/raw/alphafold//AF-Q9QXI7-F1-model_v4.pdb,1420,6663,6202,11928 +1237,34118,34717,MGDVEKGKKIFVQKCAQCHTVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE,sabio,P00004,O=NO,1.42,37.0,7.0,-.-.-.-,9796.0,0.1522883443830564,0.2829130432533325,O=NO__MGDVEKGKKIFVQKCAQCHTVEKGGKHKTGPNLHGLFGRKTGQAPGFTYTDANKNKGITWKEETLMEYLENPKKYIPGTKMIFAGIKKKTEREDLIAYLKKATNE,./data/raw/alphafold//AF-P00004-F1-model_v4.pdb,2117,5632,4417,10130 +1239,10664,10820,MKFVKRRIIALVTILMLSVTSLFALQPSAKAAEHNPVVMVHGIGGASFNFAGIKSYLVSQGWSRDKLYAVDFWDKTGTNYNNGPVLSRFVQKVLDETGAKKVDIVAHSMGGANTLYYIKNLDGGNKVANVVTLGGANRLTTGKALPGTDPNQKILYTSIYSSADMIVMNYLSRLDGARNVQIHGVGHIGLLYSSQVNSLIKEGLNGGGQNTN,sabio,P37957,CCCCCCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1,0.1,37.0,8.0,3.1.1.3,1423.0,-1.0,-1.0,CCCCCCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1__MKFVKRRIIALVTILMLSVTSLFALQPSAKAAEHNPVVMVHGIGGASFNFAGIKSYLVSQGWSRDKLYAVDFWDKTGTNYNNGPVLSRFVQKVLDETGAKKVDIVAHSMGGANTLYYIKNLDGGNKVANVVTLGGANRLTTGKALPGTDPNQKILYTSIYSSADMIVMNYLSRLDGARNVQIHGVGHIGLLYSSQVNSLIKEGLNGGGQNTN,./data/raw/alphafold//AF-P37957-F1-model_v4.pdb,5467,3134,3871,4502 +1247,24301,24687,MGAHVMKCEIYVVSVLLFTMSQSQTAALSFRAHLSDCLEDKDYQTLLQTVENGLPPIHTPPRHVVVVGAGMAGLTAAKLLQDAGHKVTILEASGRVGGRVETYRNEQGWYVELGAMRIPSTHKIVLFFVELLKLKLNEFIMTDPNTFYLVNGIKKRTFEVNAHPDILGYNLEGNEKGKSADQLLQQALKKVNVYVEEHGCSEALKKYDHYTVKEYLKTEGGLSSEAVRMIGDLLNEESLMYTALTEMIYDQTDISDNDVYFEITGGSDLLPNALHKQLKAPALLNSRVKRISRSETGVFISYQKDKQSSLTDLEADAVLVTTTTKAALFIDFDPPLPIKKMEALRVVHYDSSTKIILTFSEKFWERDGIKGGKSITDRPSRFIYYSSHSFQIKDIGVLLASYTWSDDSLLFLGATDEDLKELVLGDLAAIHGEYVRSLCTGVVVKKWSLDPYSLGAFALFTPYQHLEYSKELFKSEGRLHFAGEHTGFPHAWIETAMKTGIRAATSIYSNLLDVSTQTRDEF,brenda,D2KWB6,NCCCC[C@H](N)C(=O)O,13.0,,,1.4.3.2,195632.0,1.1139433523068367,1.4722660104959906,NCCCC[C@H](N)C(=O)O__MGAHVMKCEIYVVSVLLFTMSQSQTAALSFRAHLSDCLEDKDYQTLLQTVENGLPPIHTPPRHVVVVGAGMAGLTAAKLLQDAGHKVTILEASGRVGGRVETYRNEQGWYVELGAMRIPSTHKIVLFFVELLKLKLNEFIMTDPNTFYLVNGIKKRTFEVNAHPDILGYNLEGNEKGKSADQLLQQALKKVNVYVEEHGCSEALKKYDHYTVKEYLKTEGGLSSEAVRMIGDLLNEESLMYTALTEMIYDQTDISDNDVYFEITGGSDLLPNALHKQLKAPALLNSRVKRISRSETGVFISYQKDKQSSLTDLEADAVLVTTTTKAALFIDFDPPLPIKKMEALRVVHYDSSTKIILTFSEKFWERDGIKGGKSITDRPSRFIYYSSHSFQIKDIGVLLASYTWSDDSLLFLGATDEDLKELVLGDLAAIHGEYVRSLCTGVVVKKWSLDPYSLGAFALFTPYQHLEYSKELFKSEGRLHFAGEHTGFPHAWIETAMKTGIRAATSIYSNLLDVSTQTRDEF,./data/raw/alphafold//AF-D2KWB6-F1-model_v4.pdb,5084,6022,7787,8184 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+1553,1244,1276,MEQPMKPTVIITGASSGVGLYGAKALIDKGWHVIMACRNLDKTQKVADELGFPKDSYTIIKLDLGYLDSVRRFVAQFRELGRPLKALVCNAAVYFPLLDEPLWSADDYELSVATNHLGHFLLCNLLLEDLKACPDADKRLIILGTVTANSKELGGKIPIPAPPDLGNFEGFEAGFKKPIAMINNKKFKSGKAYKDSKLCNMLTTRELHRRFHQETGIVFNSLYPGCVADTPLFRNHYSLFRTIFPWFQKNVTKGYVSQELAGERVAMVVADDKFKDSGVHWSWGNRQQAGREAFVQELSEQGSDAQKAQRMWDLSEKLVGLV,brenda,Q59987,C=Cc1c(C)c2cc3nc(c4c5nc(cc6[nH]c(cc1[n-]2)c(C)c6CC)C(C)=C5C(=O)[C@@H]4C(=O)OC)C(CCC(=O)[O-])=C3C.[Mg+2],0.0086,30.0,7.5,1.3.1.33,1143.0,-2.065501548756432,-2.065501548756432,C=Cc1c(C)c2cc3nc(c4c5nc(cc6[nH]c(cc1[n-]2)c(C)c6CC)C(C)=C5C(=O)[C@@H]4C(=O)OC)C(CCC(=O)[O-])=C3C.[Mg+2]__MEQPMKPTVIITGASSGVGLYGAKALIDKGWHVIMACRNLDKTQKVADELGFPKDSYTIIKLDLGYLDSVRRFVAQFRELGRPLKALVCNAAVYFPLLDEPLWSADDYELSVATNHLGHFLLCNLLLEDLKACPDADKRLIILGTVTANSKELGGKIPIPAPPDLGNFEGFEAGFKKPIAMINNKKFKSGKAYKDSKLCNMLTTRELHRRFHQETGIVFNSLYPGCVADTPLFRNHYSLFRTIFPWFQKNVTKGYVSQELAGERVAMVVADDKFKDSGVHWSWGNRQQAGREAFVQELSEQGSDAQKAQRMWDLSEKLVGLV,./data/raw/alphafold//AF-Q59987-F1-model_v4.pdb,3289,651,767,935 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+1647,25778,26208,MAVFSSLTPVFVAVLCVIIGFLFKNSQRKESRSKQKPSDQTARPWVDEDLQDDTEISTKDNEENNEDWMDTTDEENLPHVPYSPVQYSVSEMLDRSERFYTLMNLRRSVRFISPEPVPKEVIDNVIRTAGTAPSGAHTEPWTFVVVSDTDVKHRIREIIEEEEEINYKQRMGNKWVQDLKRLRTNWVKEYLDVAPYLILVFKQAYGILPSGKKKTHYYNEISVSISCGILLAALQNAGLVTVTTTPLNCGPQLRSLLQRPANEKLLMLLPVGFPASDAKVPDLKRKDLNDIMVLV,uniprot_search,E7FDV5,N[C@@H](Cc1ccc(O)c(I)c1)C(=O)O,0.008,25.0,7.4,1.21.1.1,7955.0,-2.096910013008056,-2.096910013008056,N[C@@H](Cc1ccc(O)c(I)c1)C(=O)O__MAVFSSLTPVFVAVLCVIIGFLFKNSQRKESRSKQKPSDQTARPWVDEDLQDDTEISTKDNEENNEDWMDTTDEENLPHVPYSPVQYSVSEMLDRSERFYTLMNLRRSVRFISPEPVPKEVIDNVIRTAGTAPSGAHTEPWTFVVVSDTDVKHRIREIIEEEEEINYKQRMGNKWVQDLKRLRTNWVKEYLDVAPYLILVFKQAYGILPSGKKKTHYYNEISVSISCGILLAALQNAGLVTVTTTPLNCGPQLRSLLQRPANEKLLMLLPVGFPASDAKVPDLKRKDLNDIMVLV,./data/raw/alphafold//AF-E7FDV5-F1-model_v4.pdb,1129,6299,8146,12103 +1656,40513,41247,RTMFYGKGDVYVFRTYANPLKGLKQIPESNFTEKHNTIFGMNAKVALKGEQLLTSFTEGDNSLVVATDSMKNFIQRHAASYEGATLEGFLQYVCEAFLAKYSHLDAVRLEAKEYAFDDIQVGTDKGVVTSDLVFRKSRNEYATATVEVARTASGTEVVEQASGIADIQLIKVSGSSFYGYIIDEYTTLAEATDRPLYIFLNIGWAYENQDDAKGDNPANYVAAEQVRDIAASVFHTLDNKSIQHLIYHIGLTILDRFPQLTEVNFGTNNRTWDTVVEGTDGFKGAVFTEPRPPFGFQGFSVHQEDLAREKASANSEYVAL,uniprot_search,C5HDG5,Oc1nc(O)c2nc(O)[nH]c2n1,0.042,32.5,9.75,1.7.3.3,1458.0,-1.3767507096020994,-0.7947397714027931,Oc1nc(O)c2nc(O)[nH]c2n1__RTMFYGKGDVYVFRTYANPLKGLKQIPESNFTEKHNTIFGMNAKVALKGEQLLTSFTEGDNSLVVATDSMKNFIQRHAASYEGATLEGFLQYVCEAFLAKYSHLDAVRLEAKEYAFDDIQVGTDKGVVTSDLVFRKSRNEYATATVEVARTASGTEVVEQASGIADIQLIKVSGSSFYGYIIDEYTTLAEATDRPLYIFLNIGWAYENQDDAKGDNPANYVAAEQVRDIAASVFHTLDNKSIQHLIYHIGLTILDRFPQLTEVNFGTNNRTWDTVVEGTDGFKGAVFTEPRPPFGFQGFSVHQEDLAREKASANSEYVAL,./data/raw/alphafold//AF-C5HDG5-F1-model_v4.pdb,2803,4580,6369,11831 +1657,12497,12674,MQMPKTLRIRNGDKVRSTFSAQEYANRQARLRAHLAAENIDAAIFTSYHNINYYSDFLYCSFGRPYALVVTEDDVISISANIDGGQPWRRTVGTDNIVYTDWQRDNYFAAIQQALPKARRIGIEHDHLNLQNRDKLAARYPDAELVDVAAACMRMRMIKSAEEHVMIRHGARIADIGGAAVVEALGDQVPEYEVALHATQAMVRAIADTFEDVELMDTWTWFQSGINTDGAHNPVTTRKVNKGDILSLNCFPMIAGYYTALERTLFLDHCSDDHLRLWQVNVEVHEAGLKLIKPGARCSDIARELNEIFLKHDVLQYRTFGYGHSFGTLSHYYGREAGLELREDIDTVLEPGMVVSMEPMIMLPEGLPGAGGYREHDILIVNENGAENITKFPYGPEKNIIRK,brenda,P38488,CN(CC(=O)O)C(=N)N,7.0,50.0,7.7,3.5.3.3,303.0,0.8450980400142568,0.9248730468817868,CN(CC(=O)O)C(=N)N__MQMPKTLRIRNGDKVRSTFSAQEYANRQARLRAHLAAENIDAAIFTSYHNINYYSDFLYCSFGRPYALVVTEDDVISISANIDGGQPWRRTVGTDNIVYTDWQRDNYFAAIQQALPKARRIGIEHDHLNLQNRDKLAARYPDAELVDVAAACMRMRMIKSAEEHVMIRHGARIADIGGAAVVEALGDQVPEYEVALHATQAMVRAIADTFEDVELMDTWTWFQSGINTDGAHNPVTTRKVNKGDILSLNCFPMIAGYYTALERTLFLDHCSDDHLRLWQVNVEVHEAGLKLIKPGARCSDIARELNEIFLKHDVLQYRTFGYGHSFGTLSHYYGREAGLELREDIDTVLEPGMVVSMEPMIMLPEGLPGAGGYREHDILIVNENGAENITKFPYGPEKNIIRK,./data/raw/alphafold//AF-P38488-F1-model_v4.pdb,233,3362,4607,4830 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+3169,28188,28674,MEPVECPRGLLPRPCRVLVLLNPQGGKGKALQLFQSRVQPFLEEAEITFKLILTERKNHARELVCAEELGHWDALAVMSGDGLMHEVVNGLMERPDWETAIQKPLCSLPGGSGNALAASVNHYAGYEQVTNEDLLINCTLLLCRRRLSPMNLLSLHTASGLRLYSVLSLSWGFVADVDLESEKYRRLGEIRFTVGTFFRLASLRIYQGQLAYLPVGTVASKRPASTLVQKGPVDTHLVPLEEPVPSHWTVVPEQDFVLVLVLLHTHLSSELFAAPMGRCEAGVMHLFYVRAGVSRAALLRLFLAMQKGKHMELDCPYLVHVPVVAFRLEPRSQRGVFSVDGELMVCEAVQGQVHPNYLWMVCGSRDAPSGRDSRRGPPPEEP,brenda,Q8CI15,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.072,37.0,7.4,2.7.1.91,10090.0,-1.1426675035687317,-1.1426675035687317,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MEPVECPRGLLPRPCRVLVLLNPQGGKGKALQLFQSRVQPFLEEAEITFKLILTERKNHARELVCAEELGHWDALAVMSGDGLMHEVVNGLMERPDWETAIQKPLCSLPGGSGNALAASVNHYAGYEQVTNEDLLINCTLLLCRRRLSPMNLLSLHTASGLRLYSVLSLSWGFVADVDLESEKYRRLGEIRFTVGTFFRLASLRIYQGQLAYLPVGTVASKRPASTLVQKGPVDTHLVPLEEPVPSHWTVVPEQDFVLVLVLLHTHLSSELFAAPMGRCEAGVMHLFYVRAGVSRAALLRLFLAMQKGKHMELDCPYLVHVPVVAFRLEPRSQRGVFSVDGELMVCEAVQGQVHPNYLWMVCGSRDAPSGRDSRRGPPPEEP,./data/raw/alphafold//AF-Q8CI15-F1-model_v4.pdb,1511,6800,8636,8857 +3191,26112,26554,MFNYEELFQTHKTPFYLYDFDKIKQAFLNYKEAFKGRKSLICYALKANSNLSILSLLAHLESGADCVSIGEIYRALKAGIKPYRIVFSGVGKSGFEIEQALKLNILFLNVESFMELTTIETIAQSLGIKARISIRINPNIDAKTHPYISTGLKENKFGVGEKEALEMFLWAKKSAFLEPVSVHFHIGSQLSDLEPIIEASQKVAKIAKSLIALGIDLRFFDVGGGIGVSYENEETIKLYDYAQGILNSLQGLDLTIICEPGRSIVAESGELITQVLYEKKAQNKRFVVVDAGMNDFLRPSLYHAKHAIRVITPSKGREISPCDVVGPVCESSDTFLKDAHLPELEPGDKLVIEKVGAYGSSMASQYNSRPKLLELALEDHKIRVIRKREALEDLWRLEEEGLKGV,brenda,P56129,N[C@H](CCC[C@H](N)C(=O)O)C(=O)O,0.39,37.0,7.5,4.1.1.20,210.0,-0.4089353929735008,-0.4089353929735008,N[C@H](CCC[C@H](N)C(=O)O)C(=O)O__MFNYEELFQTHKTPFYLYDFDKIKQAFLNYKEAFKGRKSLICYALKANSNLSILSLLAHLESGADCVSIGEIYRALKAGIKPYRIVFSGVGKSGFEIEQALKLNILFLNVESFMELTTIETIAQSLGIKARISIRINPNIDAKTHPYISTGLKENKFGVGEKEALEMFLWAKKSAFLEPVSVHFHIGSQLSDLEPIIEASQKVAKIAKSLIALGIDLRFFDVGGGIGVSYENEETIKLYDYAQGILNSLQGLDLTIICEPGRSIVAESGELITQVLYEKKAQNKRFVVVDAGMNDFLRPSLYHAKHAIRVITPSKGREISPCDVVGPVCESSDTFLKDAHLPELEPGDKLVIEKVGAYGSSMASQYNSRPKLLELALEDHKIRVIRKREALEDLWRLEEEGLKGV,./data/raw/alphafold//AF-P56129-F1-model_v4.pdb,1161,6343,8195,10189 +3197,23539,23901,MVSHSELRNLFCSADAVCFDVDSTVIQEEGIDELAKFCGVEDAVSEMTRQAMGGAVPFKAALTQRLALIQPSREQVQRLLAEHPPHLTPGIRELVSRLQERNVQVFLISGGFRSIVEHVASKLNIPSTNVFANRLKFYFNGEYAGFDETQPTAESGGKGKVIKLLKEKFHFKKIVMVGDGATDMEACPPADAFIGFGGNVIRQQVKDNAEWYITDFVELLGALEE,uniprot_search,Q2KHU0,NC(COP(=O)(O)O)C(=O)O,0.05,34.0,6.1,3.1.3.3,9913.0,-1.3010299956639813,-1.1505149978319906,NC(COP(=O)(O)O)C(=O)O__MVSHSELRNLFCSADAVCFDVDSTVIQEEGIDELAKFCGVEDAVSEMTRQAMGGAVPFKAALTQRLALIQPSREQVQRLLAEHPPHLTPGIRELVSRLQERNVQVFLISGGFRSIVEHVASKLNIPSTNVFANRLKFYFNGEYAGFDETQPTAESGGKGKVIKLLKEKFHFKKIVMVGDGATDMEACPPADAFIGFGGNVIRQQVKDNAEWYITDFVELLGALEE,./data/raw/alphafold//AF-Q2KHU0-F1-model_v4.pdb,1102,6254,8082,8578 +3216,23796,24175,MTIITQPPVVPHFVQAETTKENLDWADLDAVDLSKAKTHEGRKGLVKQVHDAMKNDGFLFVTNHSVTPQQMSRMFDLSNYAVDNVSDEEKQKYVGNMRENGTYRGYKPRKFWHIAGGVRDQIEQYNMNFREIKDGTHPEPLRPFLSEIDDFSDQIHSDIINTILRLIAMSLELDEDYFIQMHDRSANAETFLRFVNYFPHPEEEENKSGGVWLKGHTDFMTLTLLFSQPVASLQIMTKDGQWKWVKHVENGVLVNIGEAIEFLTGGYYKPTIHRVRQPPLDQQNKTRVGLLYFCSAHDDVVLRPIAESPVVQKGGDSESRLLDDKFPTAGEYGKARVMAYGGTQALKQDVQKGIDEEVVAGVLLRHYN,brenda,H9ZYN5,NC1(C(=O)O)CC1,0.25,37.0,5.975,1.14.17.4,5341.0,-0.6020599913279624,-0.6020599913279624,NC1(C(=O)O)CC1__MTIITQPPVVPHFVQAETTKENLDWADLDAVDLSKAKTHEGRKGLVKQVHDAMKNDGFLFVTNHSVTPQQMSRMFDLSNYAVDNVSDEEKQKYVGNMRENGTYRGYKPRKFWHIAGGVRDQIEQYNMNFREIKDGTHPEPLRPFLSEIDDFSDQIHSDIINTILRLIAMSLELDEDYFIQMHDRSANAETFLRFVNYFPHPEEEENKSGGVWLKGHTDFMTLTLLFSQPVASLQIMTKDGQWKWVKHVENGVLVNIGEAIEFLTGGYYKPTIHRVRQPPLDQQNKTRVGLLYFCSAHDDVVLRPIAESPVVQKGGDSESRLLDDKFPTAGEYGKARVMAYGGTQALKQDVQKGIDEEVVAGVLLRHYN,./data/raw/alphafold//AF-H9ZYN5-F1-model_v4.pdb,4755,5945,7689,8667 +3227,8277,8417,MTLERLWQVLDPLWADPRVLSALFCGSAMAVVLLKRLGHRRIQQKMEEARRARDLALERMEKAARRFKQENPGTQTAHILSLTMVELAEKLKEGSLSPESVLYSYMGKALEVNREVNCVIDFIHGCEDQLQKVKQQKEKGLLYGIPVSIKDHIDCKGHVSSAGLVKFLGQVKEEDSVIVQVLKSQGAIPFVKTNIPQTMINYDCSNLIFGQTLNPLNHQKTPGGSSGGEGALIAGGGSLLGIGSDVAGSIRLPSSFCGLCGLKPTGFRISKLGVISPITGMNSVIGMLGPIARDVDSLALCMKALLCEEMFRLDPTVPPIPFDEEVYTSSKPLRIGYYEEDGYFQPSPSMKRAVQQTRKLLQEAGHTIVPFAPPKIDYVVDELFTRGIFSDGAAHLVDSFKGDIVDPNLKSQFNTYKLPALVKRILAIILKPIYPRIARDLSALCGVGSAKNLWDQHTAVGLPH,sabio,Q90578,CCC(=N)O,7.9,25.0,7.5,3.5.1.4,9031.0,0.8976270912904415,0.8976270912904415,CCC(=N)O__MTLERLWQVLDPLWADPRVLSALFCGSAMAVVLLKRLGHRRIQQKMEEARRARDLALERMEKAARRFKQENPGTQTAHILSLTMVELAEKLKEGSLSPESVLYSYMGKALEVNREVNCVIDFIHGCEDQLQKVKQQKEKGLLYGIPVSIKDHIDCKGHVSSAGLVKFLGQVKEEDSVIVQVLKSQGAIPFVKTNIPQTMINYDCSNLIFGQTLNPLNHQKTPGGSSGGEGALIAGGGSLLGIGSDVAGSIRLPSSFCGLCGLKPTGFRISKLGVISPITGMNSVIGMLGPIARDVDSLALCMKALLCEEMFRLDPTVPPIPFDEEVYTSSKPLRIGYYEEDGYFQPSPSMKRAVQQTRKLLQEAGHTIVPFAPPKIDYVVDELFTRGIFSDGAAHLVDSFKGDIVDPNLKSQFNTYKLPALVKRILAIILKPIYPRIARDLSALCGVGSAKNLWDQHTAVGLPH,./data/raw/alphafold//AF-Q90578-F1-model_v4.pdb,123,2861,3549,4117 +3257,37255,37913,MAITKGEDVYASLLLNDAYLPGALVLAHSLRDSGTHKKLAILITPENISNEVVEQLQTVYDYVIPVETIQNDRPANLFLMNRPDLHSAFTKINLWKQTQFRKIVYIDADVVAYRAPDELFDLPHAFSAAPDIGWPDLFNTGVMVLSPNMGDYYAMLAMAERGISFDGADQGLLNMHFRNTYNRLSFTYNVTPSAHYQYIPAYKHFQSSINLLHFIGSEKPWVQGRTQTTGSSTYDEMIGRWWAVYDRHYRGNSNKTTDVVQKFVKGEQQQQQQQQQRNVSFQLPSSQSHKTQSHQTQSQNTHSTYTSHGASWDASRHSPPAGSKPEAANFPQTHYTMSSNTQQFVPPARYPSPPKDMWYKVPEAAPTQKPAPIFPWEKQAPEPTRVFPEPPPEQGKLSAASTATPSAVASATASPTLEPKSEAVTPTTPASANPWTSFTTRGNAWDDVPEINRYVDALQKHRRSGSKGSAAATSRPTSPGRAQSRSRKSSRVTDFPTEDDRPSLTVTPAPIQGPRSSRGENERQFPAAAGVPAQSEWNPAVQLEKLAIHQQETLQKLGERPAFGGLAIGTAGKEIPARALPFGSEDARSPTYVTQYPSVLSPKPLRANTTGTNSTPSPLPTQPSVTTAPPSYQGPGVAFEKGEDFPTHETPALPTEEERDVLET,brenda,Q6Q2C8,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O,0.00441,30.0,6.8,2.4.1.186,5141.0,-2.3555614105321614,-2.3555614105321614,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O__MAITKGEDVYASLLLNDAYLPGALVLAHSLRDSGTHKKLAILITPENISNEVVEQLQTVYDYVIPVETIQNDRPANLFLMNRPDLHSAFTKINLWKQTQFRKIVYIDADVVAYRAPDELFDLPHAFSAAPDIGWPDLFNTGVMVLSPNMGDYYAMLAMAERGISFDGADQGLLNMHFRNTYNRLSFTYNVTPSAHYQYIPAYKHFQSSINLLHFIGSEKPWVQGRTQTTGSSTYDEMIGRWWAVYDRHYRGNSNKTTDVVQKFVKGEQQQQQQQQQRNVSFQLPSSQSHKTQSHQTQSQNTHSTYTSHGASWDASRHSPPAGSKPEAANFPQTHYTMSSNTQQFVPPARYPSPPKDMWYKVPEAAPTQKPAPIFPWEKQAPEPTRVFPEPPPEQGKLSAASTATPSAVASATASPTLEPKSEAVTPTTPASANPWTSFTTRGNAWDDVPEINRYVDALQKHRRSGSKGSAAATSRPTSPGRAQSRSRKSSRVTDFPTEDDRPSLTVTPAPIQGPRSSRGENERQFPAAAGVPAQSEWNPAVQLEKLAIHQQETLQKLGERPAFGGLAIGTAGKEIPARALPFGSEDARSPTYVTQYPSVLSPKPLRANTTGTNSTPSPLPTQPSVTTAPPSYQGPGVAFEKGEDFPTHETPALPTEEERDVLET,./data/raw/alphafold//AF-Q6Q2C8-F1-model_v4.pdb,2567,8223,10108,11302 +3268,35877,36505,MENKIIYFLCTGNSCRSQMAEGWAKQYLGDEWKVYSAGIEAHGLNPNAVKAMKEVGIDISNQTSDIIDSDILNNADLVVTLCGDAADKCPMTPPHVKREHWGFDDPARAQGTEEEKWAFFQRVRDEIGNRLKEFAETGK,brenda,P45947,O=[As]([O-])([O-])[O-],0.054,37.0,7.5,1.20.4.4,1423.0,-1.2676062401770316,-1.2462712410463852,O=[As]([O-])([O-])[O-]__MENKIIYFLCTGNSCRSQMAEGWAKQYLGDEWKVYSAGIEAHGLNPNAVKAMKEVGIDISNQTSDIIDSDILNNADLVVTLCGDAADKCPMTPPHVKREHWGFDDPARAQGTEEEKWAFFQRVRDEIGNRLKEFAETGK,./data/raw/alphafold//AF-P45947-F1-model_v4.pdb,2358,7936,9767,10934 +3271,15068,15281,MRSKRFEALAKRPVNQDGFVKEWIEEGFIAMESPNDPKPSIKIVNGAVTELDGKPVSDFDLIDHFIARYGINLNRAEEVMAMDSVKLANMLCDPNVKRSEIVPLTTAMTPAKIVEVVSHMNVVEMMMAMQKMRARRTPSQQAHVTNVKDNPVQIAADAAEGAWRGFDEQETTVAVARYAPFNAIALLVGSQVGRPGVLTQCSLEEATELKLGMLGHTCYAETISVYGTEPVFTDGDDTPWSKGFLASSYASRGLKMRFTSGSGSEVQMGYAEGKSMLYLEARCIYITKAAGVQGLQNGSVSCIGVPSAVPSGIRAVLAENLICSSLDLECASSNDQTFTHSDMRRTARLLMQFLPGTDFISSGYSAVPNYDNMFAGSNEDAEDFDDYNVIQRDLKVDGGLRPVREEDVIAIRNKAARALQAVFAGMGLPPITDEEVEAATYAHGSKDMPERNIVEDIKFAQEIINKNRNGLEVVKALAQGGFTDVAQDMLNIQKAKLTGDYLHTSAIIVGDGQVLSAVNDVNDYAGPATGYRLQGERWEEIKNIPGALDPNEID,brenda,Q59470,C[C@@H](O)CO,0.47,37.0,8.0,4.2.1.28,571.0,-0.3279021420642826,-0.3279021420642826,C[C@@H](O)CO__MRSKRFEALAKRPVNQDGFVKEWIEEGFIAMESPNDPKPSIKIVNGAVTELDGKPVSDFDLIDHFIARYGINLNRAEEVMAMDSVKLANMLCDPNVKRSEIVPLTTAMTPAKIVEVVSHMNVVEMMMAMQKMRARRTPSQQAHVTNVKDNPVQIAADAAEGAWRGFDEQETTVAVARYAPFNAIALLVGSQVGRPGVLTQCSLEEATELKLGMLGHTCYAETISVYGTEPVFTDGDDTPWSKGFLASSYASRGLKMRFTSGSGSEVQMGYAEGKSMLYLEARCIYITKAAGVQGLQNGSVSCIGVPSAVPSGIRAVLAENLICSSLDLECASSNDQTFTHSDMRRTARLLMQFLPGTDFISSGYSAVPNYDNMFAGSNEDAEDFDDYNVIQRDLKVDGGLRPVREEDVIAIRNKAARALQAVFAGMGLPPITDEEVEAATYAHGSKDMPERNIVEDIKFAQEIINKNRNGLEVVKALAQGGFTDVAQDMLNIQKAKLTGDYLHTSAIIVGDGQVLSAVNDVNDYAGPATGYRLQGERWEEIKNIPGALDPNEID,./data/raw/alphafold//AF-Q59470-F1-model_v4.pdb,5819,2640,5127,5447 +3280,11450,11611,MFRLARAQTSITTTSKALGGSRRLFVRLNSSFAIPESQKGVIFYENGGKLEYKDLPVPKPKPNEILINVKYSGVCHTDLHAWKGDWPLPVKLPLVGGHEGAGVVVAKGENVTNFEIGDYAGIKWLNGSCMSCELCEQGYESNCLQADLSGYTHDGSFQQYATADAVQAAQIPKGTDLAEIAPILCAGVTVYKALKTADLQPGQWIAISGAAGGLGSLAVQYAKAMGLRVLGIDGGPGKEELFKSLGGEVFIDFTKSKDMVADIQEATNGGPHGVINVSVSEAAISMSTEYVRPTGVVVLVGLPAHAYVKSEVFSHVVKSISIKGSYVGNRADTREAI,brenda,V9SFA1,CCO,17.0,37.5,7.633333333333334,1.1.1.1,4932.0,1.230448921378274,1.230448921378274,CCO__MFRLARAQTSITTTSKALGGSRRLFVRLNSSFAIPESQKGVIFYENGGKLEYKDLPVPKPKPNEILINVKYSGVCHTDLHAWKGDWPLPVKLPLVGGHEGAGVVVAKGENVTNFEIGDYAGIKWLNGSCMSCELCEQGYESNCLQADLSGYTHDGSFQQYATADAVQAAQIPKGTDLAEIAPILCAGVTVYKALKTADLQPGQWIAISGAAGGLGSLAVQYAKAMGLRVLGIDGGPGKEELFKSLGGEVFIDFTKSKDMVADIQEATNGGPHGVINVSVSEAAISMSTEYVRPTGVVVLVGLPAHAYVKSEVFSHVVKSISIKGSYVGNRADTREAI,./data/raw/alphafold//AF-V9SFA1-F1-model_v4.pdb,3774,2850,3987,4644 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+3789,6517,6634,MDPLGAAKPQWPWRRCLAALLFQLLVAVCFFSYLRVSRDDATGSPRAPSGSSRQDTTPTRPTLLILLWTWPFHIPVALSRCSEMVPGTADCHITADRKVYPQADTVIVHHWDIMSNPKSRLPPSPRPQGQRWIWFNLEPPPNCQHLEALDRYFNLTMSYRSDSDIFTPYGWLEPWSGQPAHPPLNLSAKTELVAWAVSNWKPDSARVRYYQSLQAHLKVDVYGRSHKPLPKGTMMETLSRYKFYLAFENSLHPDYITEKLWRNALEAWAVPVVLGPSRSNYERFLPPDAFIHVDDFQSPKDLARYLQELDKDHARYLSYFRWRETLRPRSFSWALDFCKACWKLQQESRYQTVRSIAAWFT,brenda,P21217,CC(O)=N[C@H]1[C@@H](OCCCN=C(O)CCCCCNOC(=O)CCCC[C@@H]2SC[C@@H]3N=C(O)N[C@@H]32)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O[C@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1O,0.2,37.0,6.279999999999999,2.4.1.65,9606.0,-0.6989700043360187,-0.6989700043360187,CC(O)=N[C@H]1[C@@H](OCCCN=C(O)CCCCCNOC(=O)CCCC[C@@H]2SC[C@@H]3N=C(O)N[C@@H]32)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O[C@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1O__MDPLGAAKPQWPWRRCLAALLFQLLVAVCFFSYLRVSRDDATGSPRAPSGSSRQDTTPTRPTLLILLWTWPFHIPVALSRCSEMVPGTADCHITADRKVYPQADTVIVHHWDIMSNPKSRLPPSPRPQGQRWIWFNLEPPPNCQHLEALDRYFNLTMSYRSDSDIFTPYGWLEPWSGQPAHPPLNLSAKTELVAWAVSNWKPDSARVRYYQSLQAHLKVDVYGRSHKPLPKGTMMETLSRYKFYLAFENSLHPDYITEKLWRNALEAWAVPVVLGPSRSNYERFLPPDAFIHVDDFQSPKDLARYLQELDKDHARYLSYFRWRETLRPRSFSWALDFCKACWKLQQESRYQTVRSIAAWFT,./data/raw/alphafold//AF-P21217-F1-model_v4.pdb,5705,2495,3135,3617 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+4055,14235,14441,MKRILTLVLLLTVFIIVLVGCSTSPVDHSKMVHGEDDSTDNKQQEETQQIETSEGKVVINLEAKVTHWMFNNDLMEDIWTYNGSLPGQEIRVQEGDHVVINLTNSLDVPTSLHLHGVPVPNEMDGVPGVTQNAIMPGETFTYEFVADTPGTYWYHSHQDGANQIGMGLYGALVVEHKDQPDYDLDQVIMIDEWSSMGMADMDHSGMDHGDHGNMGDNSDQPPHAEMMNMMYDTLIVNGKASPVIEAIGVSEDDTIKLRFVNTGLFTQVITIPGHEFKVTHYDGQQVNEPELISDTAIRIAPAERYDVEIEMNQPGAWGIQIYAEENENLRGIVPLVYAGFEDEELQTADSIQSFLDISAYGSPMNVNFGEITKEFDMILGSDDGGETFTINGKQMTTKGFESHEDHEIYEVEEGDVVKVNIVNDTDVDHPMHLHGHFFYVVSRNGQPVKGSPILKETLNVRPNEAYEIVFVADNPGHWMFHCHELHHASGGMVSEVRYSGYTPAFTPDPNIPNKPE,sabio,F5L3U7,COc1cccc(OC)c1O,0.2,70.0,8.0,1.10.3.2,296745.0,-0.6989700043360187,-0.6989700043360187,COc1cccc(OC)c1O__MKRILTLVLLLTVFIIVLVGCSTSPVDHSKMVHGEDDSTDNKQQEETQQIETSEGKVVINLEAKVTHWMFNNDLMEDIWTYNGSLPGQEIRVQEGDHVVINLTNSLDVPTSLHLHGVPVPNEMDGVPGVTQNAIMPGETFTYEFVADTPGTYWYHSHQDGANQIGMGLYGALVVEHKDQPDYDLDQVIMIDEWSSMGMADMDHSGMDHGDHGNMGDNSDQPPHAEMMNMMYDTLIVNGKASPVIEAIGVSEDDTIKLRFVNTGLFTQVITIPGHEFKVTHYDGQQVNEPELISDTAIRIAPAERYDVEIEMNQPGAWGIQIYAEENENLRGIVPLVYAGFEDEELQTADSIQSFLDISAYGSPMNVNFGEITKEFDMILGSDDGGETFTINGKQMTTKGFESHEDHEIYEVEEGDVVKVNIVNDTDVDHPMHLHGHFFYVVSRNGQPVKGSPILKETLNVRPNEAYEIVFVADNPGHWMFHCHELHHASGGMVSEVRYSGYTPAFTPDPNIPNKPE,./data/raw/alphafold//AF-F5L3U7-F1-model_v4.pdb,404,3616,4940,5250 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+4100,23716,24094,MEEKLKQLEQEALEQVEAASSLKVVNDIRVQYLGKKGPITEVLRGMGKLSAEERPKMGALANEVRERIANAIADKNEKLEEEEMKQKLAGQTIDVTLPGNPVAVGGRHPLTVVIEEIEDLFIGMGYTVEEGPEVETDYYNFESLNLPKEHPARDMQDSFYITEETLMRTQTSPVQTRTMEKHEGKGPVKIICPGKVYRRDNDDATHSHQFMQIEGLVVDKNISMSDLKGTLELVAKKMFGQDREIRLRPSFFPFTEPSVEVDVTCFKCGGNGCSVCKGTGWIEILGAGMVHPNVLKMAGFDPKEYQGFAFGMGVERIAMLKYGIDDIRHFYTNDVRFISQFKQA,sabio,P17921,NC(Cc1ccccc1)C(=O)O,0.028,,7.2,6.1.1.20,1423.0,-1.5528419686577808,-1.5528419686577808,NC(Cc1ccccc1)C(=O)O__MEEKLKQLEQEALEQVEAASSLKVVNDIRVQYLGKKGPITEVLRGMGKLSAEERPKMGALANEVRERIANAIADKNEKLEEEEMKQKLAGQTIDVTLPGNPVAVGGRHPLTVVIEEIEDLFIGMGYTVEEGPEVETDYYNFESLNLPKEHPARDMQDSFYITEETLMRTQTSPVQTRTMEKHEGKGPVKIICPGKVYRRDNDDATHSHQFMQIEGLVVDKNISMSDLKGTLELVAKKMFGQDREIRLRPSFFPFTEPSVEVDVTCFKCGGNGCSVCKGTGWIEILGAGMVHPNVLKMAGFDPKEYQGFAFGMGVERIAMLKYGIDDIRHFYTNDVRFISQFKQA,./data/raw/alphafold//AF-P17921-F1-model_v4.pdb,4749,5936,7671,8643 +4108,33150,33742,MSTPFPKTADKVKGVQILGPIPDEAKHIFNQETLAFVATLHRGFEARRQELLNNRKEQQKLRDQGFLPDFLPETEYIRNDSTWTGPALAPGLIDRRCEITGPTDRKMVINALNSNVATYMADFEDSLTPAWKNLVEGQVNLYDAVRRNLSATINGKQYNLNLEKGRHIPTLIVRPRGWHLTEKHVLVDGTPVSGGIFDFAVYFYNSAKEAIAQGFGPYFYLPKMEHHLEAKLWNDIFNYSQDYIGLKRGTIRASVLIETIPAVFQMDEIIYQLREHSAGLNCGRWDYIFSYIKCLRNHPDFILPDRSQVTMAAPFMSSYVKLLVHTTHKRKVHALGGMAAQIPIKDDEARNRAALENVTKDKLREVTLGCDSCWVAHPALVPVVLKVFNEHMKGPNQISLPPKEPFKPITQRDLLSPFVPGAKITEQGIRANIVIGISYIEAWLRNVGCVPINYLMEDAATAEVSRTQIWQWVTHGAKTDTGKVITKEYVKQLLDEEYAKLTKNAKPGNKFKRAFEYFAPEALGEKYSDFVTTLIYDDVTTIGRALPGERL,uniprot_search,Q02216,O=CC(=O)O,1.0,37.0,7.5,2.3.3.9,5482.0,0.0,0.0,O=CC(=O)O__MSTPFPKTADKVKGVQILGPIPDEAKHIFNQETLAFVATLHRGFEARRQELLNNRKEQQKLRDQGFLPDFLPETEYIRNDSTWTGPALAPGLIDRRCEITGPTDRKMVINALNSNVATYMADFEDSLTPAWKNLVEGQVNLYDAVRRNLSATINGKQYNLNLEKGRHIPTLIVRPRGWHLTEKHVLVDGTPVSGGIFDFAVYFYNSAKEAIAQGFGPYFYLPKMEHHLEAKLWNDIFNYSQDYIGLKRGTIRASVLIETIPAVFQMDEIIYQLREHSAGLNCGRWDYIFSYIKCLRNHPDFILPDRSQVTMAAPFMSSYVKLLVHTTHKRKVHALGGMAAQIPIKDDEARNRAALENVTKDKLREVTLGCDSCWVAHPALVPVVLKVFNEHMKGPNQISLPPKEPFKPITQRDLLSPFVPGAKITEQGIRANIVIGISYIEAWLRNVGCVPINYLMEDAATAEVSRTQIWQWVTHGAKTDTGKVITKEYVKQLLDEEYAKLTKNAKPGNKFKRAFEYFAPEALGEKYSDFVTTLIYDDVTTIGRALPGERL,./data/raw/alphafold//AF-Q02216-F1-model_v4.pdb,2074,2247,1697,10044 diff --git a/scripts/.DS_Store b/scripts/.DS_Store new file mode 100644 index 0000000000000000000000000000000000000000..0b015c1f63a9170ecef2156b529818ec90a153d7 Binary files /dev/null and b/scripts/.DS_Store differ diff --git a/scripts/add_pdb_paths.py b/scripts/add_pdb_paths.py new file mode 100644 index 0000000000000000000000000000000000000000..edd24c656d373c48766c0f62cb50fe02acd334f4 --- /dev/null +++ b/scripts/add_pdb_paths.py @@ -0,0 +1,53 @@ +import requests +from joblib import Parallel, delayed +import os +import argparse +import sys +import json +import pandas as pd +from tqdm import tqdm + +def parse_args(): + parser = argparse.ArgumentParser() + parser.add_argument("--data_file", help="data file", type=str, required=True) + parser.add_argument("--alphafold_dir", help="directory where alphafold models are stroed", type=str, required=True) + parser.add_argument("--esm_dir", help="directory where to store esm models", type=str, required=True) + parser.add_argument("--out_file", help="out file", type=str, required=True) + + args, unparsed = parser.parse_known_args() + parser = argparse.ArgumentParser() + + return args + +args = parse_args() + +def _is_empty_model(modelpath): + try: + structure = esm.inverse_folding.util.load_structure(modelpath, 'A') + return False + except: + return True + +import ipdb +ipdb.set_trace() +alphafold_models = os.listdir(args.alphafold_dir) +esm_models = os.listdir(args.esm_dir) + +af_model_path = lambda uni: args.alphafold_dir + f'/AF-{uni}-F1-model_v4.pdb' +esm_model_path = lambda uni: args.esm_dir + f'/ESMFold-{uni}-v1.pdb' + +df = pd.read_csv(args.data_file) + +modelpaths = [] +for uni in tqdm(df.uniprot): + modelpath = af_model_path(uni) + modelpath2 = esm_model_path(uni) + if not _is_empty_model(modelpath): modelpaths.append(modelpath) + elif not _is_empty_model(modelpath2): modelpaths.append(modelpath2) + else: modelpaths.append(None) +df['pdbpath'] = modelpaths + +df.info() +df.dropna(subset=['pdbpath'],inplace=True) +df.reset_index(inplace=True,drop=True) +df.to_csv(args.out_file) \ No newline at end of file diff --git a/scripts/count_natural.py b/scripts/count_natural.py new file mode 100644 index 0000000000000000000000000000000000000000..4998384c3840fac232774b240e167af220820352 --- /dev/null +++ b/scripts/count_natural.py @@ -0,0 +1,36 @@ +import json +import pandas as pd +from tqdm import tqdm +from rdkit import Chem + +natural_list = set(json.load(open('./all_natural_metabolite_names.json'))) +metabolite_inchi_smiles_dic = pd.read_csv('../datasets/metabolite_inchi_smiles_brenda_pubchem.tsv',sep='\t',index_col='metabolite') +name_to_smiles = {} +for ind, row in tqdm(metabolite_inchi_smiles_dic.iterrows()): + try: + name_to_smiles[row.name] = Chem.MolToSmiles(Chem.MolFromSmiles(row.smiles)) + except: + continue + +natural_smi_list = [name_to_smiles[name] for name in natural_list if name in name_to_smiles] + +for parameter in ['kcat','km','ki']: + print(parameter) + datafile = f'./data/processed/splits_wpdbs/{parameter}-random_trainvaltest.csv' + + if parameter=='kcat': + subcol = 'reactant_smiles' + else: + subcol = 'substrate_smiles' + + df = pd.read_csv(datafile) + count = 0 + for ind, row in tqdm(df.iterrows()): + natural = True + substrates = row[subcol].split('.') + for sub in substrates: + if not sub in natural_smi_list: + natural = False + if natural: count+=1 + + print(count) diff --git a/scripts/create_pdbrecords.py b/scripts/create_pdbrecords.py new file mode 100644 index 0000000000000000000000000000000000000000..10ea93e4047246e453b4d145ae6fd291a6e32cdc --- /dev/null +++ b/scripts/create_pdbrecords.py @@ -0,0 +1,35 @@ +import pandas as pd +import argparse +import json + +def parse_args(): + parser = argparse.ArgumentParser( + description="Generate json records for test file with only sequences" + ) + parser.add_argument( + "--in_file", + help="Path to csv file", + required=True, + ) + + parser.add_argument("--out_file", help="output file for json records") + + args = parser.parse_args() + return args + +args = parse_args() +df = pd.read_csv(args.data_file) +assert('pdbpath' in df.columns) +assert('sequence' in df.columns) + +import json +dic_full = {} +for ind, row in df.iterrows(): + dic = {} + dic['name'] = row.pdbpath + dic['seq'] = row.sequence + dic_full[row.pdbpath] = dic + +f = open(args.out_file,'w') +f.write(json.dumps(dic_full)) +f.close() \ No newline at end of file diff --git a/scripts/make_splits.py b/scripts/make_splits.py new file mode 100644 index 0000000000000000000000000000000000000000..7b1d6e059465b7284b43f1d9fa4e8eb2d847b620 --- /dev/null +++ b/scripts/make_splits.py @@ -0,0 +1,149 @@ +import pandas as pd +from rdkit import Chem +from rdkit.Chem import PandasTools, Draw +from rdkit import DataStructs +from rdkit.ML.Cluster import Butina +from rdkit.Chem import rdMolDescriptors as rdmd +from rdkit.Chem import Descriptors, rdChemReactions +import seaborn as sns +from tqdm import tqdm +import os +from sklearn.model_selection import GroupKFold, train_test_split + +def assign_seq_clusters(df, id_cutoff): + seqcol = 'sequence' + import tempfile + import uuid + + # Create a temporary directory and get a unique filename within that directory + # with tempfile.TemporaryDirectory() as unique_filedir: + unique_filedir = str(uuid.uuid4()) + # Using UUID for generating a unique filename + unique_filename = unique_filedir + '_temp_seqs.fasta' + + print('Clustering seqs..') + seqs_written = set() + seqind_to_seq = {} + f = open(unique_filename,'w') + for ind,seq in enumerate(df[seqcol]): + if pd.isna(seq): continue + if not seq in seqs_written: + f.write(f'>{ind}\n{seq}\n') + seqs_written.add(seq) + seqind_to_seq[ind] = seq + else: continue + f.close() + + cmd = f'mmseqs easy-cluster {unique_filename} {unique_filedir}_clusterRes /tmp/ --min-seq-id {id_cutoff} -v 0' + status = os.system(cmd) + print(status, cmd) + cluster_df = pd.read_csv(f'{unique_filedir}_clusterRes_cluster.tsv',sep='\t',names=['query_ind','target_ind']) + os.system(f'rm -r {unique_filedir}*') + + q_to_tinds = {} + for qind, tind in zip(cluster_df.query_ind,cluster_df.target_ind): + if not qind in q_to_tinds: + q_to_tinds[qind] = [tind] + else: + q_to_tinds[qind].append(tind) + c = 0 + ind_to_cluster = {} + for q, ts in q_to_tinds.items(): + ind_to_cluster[q] = c + for t in ts: ind_to_cluster[t] = c + c+=1 + seq_to_cluster = {seqind_to_seq[ind]:c for ind, c in ind_to_cluster.items()} + + cluster_col = [] + for seq in df[seqcol]: + if seq in seq_to_cluster: + cluster_col.append(seq_to_cluster[seq]) + else: + # print('no cluster found for ', seq) + cluster_col.append(-1) + df[f'{seqcol}_{int(100*id_cutoff)}cluster'] = cluster_col + return df + +def make_splits(df, frac = 0.1): + # ipdb.set_trace() + df.reset_index(drop=True, inplace=True) + train_df, test_df = train_test_split(df, test_size = frac, random_state=0) + train_df.reset_index(drop=True, inplace=True) + train_df, val_df = train_test_split(train_df, test_size = frac, random_state=0) + train_df.reset_index(drop=True, inplace=True) + val_df.reset_index(drop=True, inplace=True) + test_df.reset_index(drop=True, inplace=True) + + print(f'Train: {len(train_df)*100/len(df)}') + print(f'Val: {len(val_df)*100/len(df)}') + print(f'Test: {len(test_df)*100/len(df)}') + return train_df, val_df, test_df + +def print_stats(train, test, parameter, dire, sim_list = [0.4, 0.6, 0.8, 0.99]): + sequence_column = 'sequence' + smiles_column = 'smiles' + if parameter=='kcat': smiles_column='reactant_'+smiles_column + else: smiles_column='substrate_'+smiles_column + sim_list.reverse() + print('-'*20) + print('**Sequence stats**') + print('-'*20) + for sim in sim_list: + simperc = int(sim*100) + colname = sequence_column+f'_{simperc}cluster' + print('At sim-cutoff:', sim,) + now = test[~test[colname].isin(train[colname])] + now.to_csv(f'{dire}/{parameter}-seq_test_{colname}.csv') + perc = len(now)/len(test) + print('Test perc.:', perc) + print('Test number:', int(perc*len(test))) + print('\n') + print('-'*20) + +def assign_all_clusters(df, is_kcat, sim_list = [0.4, 0.6, 0.8, 0.99]): + for sim in sim_list: + print(f'Assigning clusters at sim-cutoff = {sim}') + df = assign_seq_clusters(df, id_cutoff=sim) + return df + +def make_and_savesplits(df, param, dire): + if param=='kcat': is_kcat = True + else: is_kcat = False + frac = 0.1 + train, val, test = make_splits(df, frac) + seqpre = 'random' + if not os.path.exists(dire): + os.mkdir(dire) + train.to_csv(dire+param+f'-{seqpre}_train.csv') + val.to_csv(dire+param+f'-{seqpre}_val.csv') + test.to_csv(dire+param+f'-{seqpre}_test.csv') + trainval = pd.concat([train,val]).reset_index(drop=True) + trainval.to_csv(dire+param+f'-{seqpre}_trainval.csv') + trainvaltest = pd.concat([trainval,test]).reset_index(drop=True) + trainvaltest.to_csv(dire+param+f'-{seqpre}_trainvaltest.csv') + print_stats(trainval, test, param, dire) + return train, val, test + +def main(args): + datafile, parameter, outdir = args.input_file, args.param, args.save_dir + df = pd.read_csv(datafile) + df = assign_all_clusters(df, is_kcat=(parameter=='kcat'))#, + df_train, df_val, df_test = make_and_savesplits(df, parameter, dire=outdir) + +import argparse + +def parse_args(): + parser = argparse.ArgumentParser() + parser.add_argument("--param", help="parameter name", + type=str, required=True) + parser.add_argument("--input_file", help="input_file", + type=str, required=True) + parser.add_argument("--save_dir", help="dir to save splits", + type=str, required=True) + + args, unparsed = parser.parse_known_args() + + return args + +args = parse_args() +main(args) diff --git a/scripts/pdb/.ipynb_checkpoints/Untitled-checkpoint.ipynb b/scripts/pdb/.ipynb_checkpoints/Untitled-checkpoint.ipynb new file mode 100644 index 0000000000000000000000000000000000000000..363fcab7ed6e9634e198cf5555ceb88932c9a245 --- /dev/null +++ b/scripts/pdb/.ipynb_checkpoints/Untitled-checkpoint.ipynb @@ -0,0 +1,6 @@ +{ + "cells": [], + "metadata": {}, + "nbformat": 4, + "nbformat_minor": 5 +} diff --git a/scripts/pdb/Untitled.ipynb b/scripts/pdb/Untitled.ipynb new file mode 100644 index 0000000000000000000000000000000000000000..50395a8fbfb0f45850f4d86f5584bca27dbf72f3 --- /dev/null +++ b/scripts/pdb/Untitled.ipynb @@ -0,0 +1,524 @@ +{ + "cells": [ + { + "cell_type": "code", + "execution_count": 1, + "id": "63b89129-eb15-489c-acae-c6255df4d9f0", + "metadata": {}, + "outputs": [ + { + "name": "stderr", + "output_type": "stream", + "text": [ + "/home/ubuntu/.local/lib/python3.8/site-packages/pandas/core/computation/expressions.py:20: UserWarning: Pandas requires version '2.7.3' or newer of 'numexpr' (version '2.7.1' currently installed).\n", + " from pandas.core.computation.check import NUMEXPR_INSTALLED\n", + "/home/ubuntu/.local/lib/python3.8/site-packages/Bio/pairwise2.py:278: BiopythonDeprecationWarning: Bio.pairwise2 has been deprecated, and we intend to remove it in a future release of Biopython. As an alternative, please consider using Bio.Align.PairwiseAligner as a replacement, and contact the Biopython developers if you still need the Bio.pairwise2 module.\n", + " warnings.warn(\n" + ] + } + ], + "source": [ + "# Copyright Amazon.com, Inc. or its affiliates. All Rights Reserved.\n", + "# SPDX-License-Identifier: MIT-0\n", + "\n", + "\"\"\"\n", + "Parse PDB files to extract the coordinates of the 4 key atoms from AAs to\n", + "generate json records compatible to the LM-GVP model.\n", + "\n", + "This script is intended for Fluorescence and Protease datasets from TAPE.\n", + "\"\"\"\n", + "\n", + "import json\n", + "import os\n", + "import argparse\n", + "from collections import defaultdict\n", + "import pandas as pd\n", + "import numpy as np\n", + "\n", + "from tqdm import tqdm\n", + "from joblib import Parallel, delayed\n", + "from Bio.PDB import PDBParser\n", + "from Bio.PDB.Polypeptide import three_to_one\n", + "\n", + "import xpdb\n", + "from contact_map_utils import parse_pdb_structure\n", + "\n", + "\n", + "def parse_args():\n", + " \"\"\"Prepare argument parser.\n", + "\n", + " Args:\n", + "\n", + " Return:\n", + "\n", + " \"\"\"\n", + " parser = argparse.ArgumentParser(\n", + " description=\"Generate GVP ProteinGraph datasets representing protein\"\n", + " + \"structures.\"\n", + " )\n", + " parser.add_argument(\n", + " \"--data-file\",\n", + " help=\"Path to protein data frame, including sequences, paths to\"\n", + " + \" structure files and labels\",\n", + " required=True,\n", + " )\n", + " parser.add_argument(\n", + " \"-t\",\n", + " \"--target-variable\",\n", + " help=\"target variable in the protein data frame\",\n", + " required=True,\n", + " )\n", + " parser.add_argument(\"-o\", \"--output\", help=\"output dir for graphs\")\n", + "\n", + " args = parser.parse_args()\n", + " return args\n", + "\n", + "\n", + "def get_atom_coords(residue, target_atoms=[\"N\", \"CA\", \"C\", \"O\"]):\n", + " \"\"\"Extract the coordinates of the target_atoms from an AA residue.\n", + "\n", + " Args:\n", + " residue: a Bio.PDB.Residue object representing the residue.\n", + " target_atoms: Target atoms which residues will be returned.\n", + "\n", + " Retruns:\n", + " Array of residue's target atoms (in the same order as target atoms).\n", + " \"\"\"\n", + " return np.asarray([residue[atom].coord for atom in target_atoms])\n", + "\n", + "\n", + "def structure_to_coords(struct, target_atoms=[\"N\", \"CA\", \"C\", \"O\"], name=\"\"):\n", + " \"\"\"Convert a PDB structure in to coordinates of target atoms from all AAs\n", + "\n", + " Args:\n", + " struct: a Bio.PDB.Structure object representing the protein structure\n", + " target_atoms: Target atoms which residues will be returned.\n", + " name: String. Name of the structure\n", + "\n", + " Return:\n", + " Dictionary with the pdb sequence, atom 3D coordinates and name.\n", + " \"\"\"\n", + " output = {}\n", + " # get AA sequence in the pdb structure\n", + " pdb_seq = \"\".join(\n", + " [three_to_one(res.get_resname()) for res in struct.get_residues()]\n", + " )\n", + " output[\"seq\"] = pdb_seq\n", + " # get the atom coords\n", + " coords = np.asarray(\n", + " [\n", + " get_atom_coords(res, target_atoms=target_atoms)\n", + " for res in struct.get_residues()\n", + " ]\n", + " )\n", + " output[\"coords\"] = coords.tolist()\n", + " output[\"name\"] = name\n", + " return output\n", + "\n", + "\n", + "def parse_pdb_gz_to_json_record(parser, sequence, pdb_file_path, name=\"\"):\n", + " \"\"\"\n", + " Reads and reformats a pdb strcuture into a dictionary.\n", + "\n", + " Args:\n", + " parser: a Bio.PDB.PDBParser or Bio.PDB.MMCIFParser instance.\n", + " sequence: String. Sequence of the structure.\n", + " pdb_file_path: String. Path to the pdb file.\n", + " name: String. Name of the protein.\n", + "\n", + " Return:\n", + " Dictionary with the pdb sequence, atom 3D coordinates and name.\n", + " \"\"\"\n", + " struct = parse_pdb_structure(parser, sequence, pdb_file_path)\n", + " record = structure_to_coords(struct, name=name)\n", + " return record" + ] + }, + { + "cell_type": "code", + "execution_count": null, + "id": "402ad072-edd1-4c04-a4c0-93390862770b", + "metadata": {}, + "outputs": [], + "source": [] + }, + { + "cell_type": "code", + "execution_count": 11, + "id": "72469cb0-878a-478b-849d-ee88774f3708", + "metadata": { + "collapsed": true, + "jupyter": { + "outputs_hidden": true + } + }, + "outputs": [ + { + "name": "stderr", + "output_type": "stream", + "text": [ + "\n", + " 0%| | 0/23197 [00:00 self.max_resseq: + self.max_resseq = resseq + + if field == " ": + fudged_resseq = False + while self.chain.has_id(res_id) or resseq == 0: + # There already is a residue with the id (field, resseq, icode) + # resseq == 0 catches already wrapped residue numbers which + # do not trigger the has_id() test. + # + # Be sloppy and just increment... + # (This code will not leave gaps in resids... I think) + # + # XXX: shouldn't we also do this for hetero atoms and water?? + self.max_resseq += 1 + resseq = self.max_resseq + res_id = (field, resseq, icode) # use max_resseq! + fudged_resseq = True + + if fudged_resseq and self.verbose: + sys.stderr.write( + "Residues are wrapping (Residue " + + "('%s', %i, '%s') at line %i)." + % (field, resseq, icode, self.line_counter) + + ".... assigning new resid %d.\n" % self.max_resseq + ) + residue = Residue(res_id, resname, self.segid) + self.chain.add(residue) + self.residue = residue + return None + + +class SloppyPDBIO(Bio.PDB.PDBIO): + """PDBIO class that can deal with large pdb files as used in MD simulations + + - resSeq simply wrap and are printed modulo 10,000. + - atom numbers wrap at 99,999 and are printed modulo 100,000 + + """ + + # The format string is derived from the PDB format as used in PDBIO.py + # (has to be copied to the class because of the package layout it is not + # externally accessible) + _ATOM_FORMAT_STRING = ( + "%s%5i %-4s%c%3s %c%4i%c " + + "%8.3f%8.3f%8.3f%6.2f%6.2f %4s%2s%2s\n" + ) + + def _get_atom_line( + self, + atom, + hetfield, + segid, + atom_number, + resname, + resseq, + icode, + chain_id, + element=" ", + charge=" ", + ): + """Returns an ATOM string that is guaranteed to fit the ATOM format. + + - Resid (resseq) is wrapped (modulo 10,000) to fit into %4i (4I) format + - Atom number (atom_number) is wrapped (modulo 100,000) to fit into + %5i (5I) format + + Args: #TODO + atom: + hetfield: + segid: + atom_number: + resname: + resseq: + icode: + chain_id: + element: + charge: + + Returns: + #TODO + """ + if hetfield != " ": + record_type = "HETATM" + else: + record_type = "ATOM " + name = atom.get_fullname() + altloc = atom.get_altloc() + x, y, z = atom.get_coord() + bfactor = atom.get_bfactor() + occupancy = atom.get_occupancy() + args = ( + record_type, + atom_number % 100000, + name, + altloc, + resname, + chain_id, + resseq % 10000, + icode, + x, + y, + z, + occupancy, + bfactor, + segid, + element, + charge, + ) + return self._ATOM_FORMAT_STRING % args diff --git a/scripts/processing/.DS_Store b/scripts/processing/.DS_Store new file mode 100644 index 0000000000000000000000000000000000000000..8fd0f721d71b7a098b84877f23edeade246d9b05 Binary files /dev/null and b/scripts/processing/.DS_Store differ diff --git a/scripts/processing/.process_brenda.py.swp b/scripts/processing/.process_brenda.py.swp new file mode 100644 index 0000000000000000000000000000000000000000..521922fb5e0554bee061b962f77614adbc1ed7e4 Binary files /dev/null and b/scripts/processing/.process_brenda.py.swp differ diff --git a/scripts/processing/README.md b/scripts/processing/README.md new file mode 100644 index 0000000000000000000000000000000000000000..65316c97bfb8227a261600f7d9dc97816706b5dd --- /dev/null +++ b/scripts/processing/README.md @@ -0,0 +1,11 @@ + +# Obtaining raw data +1. BRENDA raw data has been obtained from their website. Recently, they made .json format download for the database available. In this work, 'brenda_2022_2.json' is used. Also, raw data for compounds was obtained from https://www.brenda-enzymes.org/search_result.php?a=13 and placing a blank query. Thanks to samgoldman97 for the trick. Even with this some brenda compounds didn't have a known SMILES/InChi string. So, we also used the Pubchem id exchange service to map names (synonyms) to SMILES. All these are saved in ./data/raw/brenda/ +2. SABIO-rk raw data has been obtained using sbml exports from their website. Because only a 100 entries are shown in their website at a time, we manually exported a lot of sbml files from their website. Also, we scraped individual entry html files. These form the raw data. Saved in ./data/raw/sabio/ + +# Processing raw data +1. Processing BRENDA is relatively straightforward because everything is in the json file except SMILES strings of substrates and Sequences of proteins. See scripts/data/processing/ for details. +2. SABIO sbml files are a bit more tricky to process. We used an sbml parser from libsbml. Also, BeautifulSoup to parse html files of individual entries. See scripts/data/processing/ for details. + +# Merging processed data +1. Since data comes from two different sources, they need to be merged to make sure there are no unexpected duplicates. Also, each 'sequence,smiles' pair can appear in several entries (possibly with different parameter values). So, these have to be handled appropriately. See scripts/data/merging/ for details. diff --git a/scripts/processing/merge.py b/scripts/processing/merge.py new file mode 100644 index 0000000000000000000000000000000000000000..38921481d64dfa1f45b17572e84b7514a85d5276 --- /dev/null +++ b/scripts/processing/merge.py @@ -0,0 +1,214 @@ +import pandas as pd +import numpy as np +from tqdm import tqdm +import argparse +import ipdb +import os + +def parse_args(): + parser = argparse.ArgumentParser() + parser.add_argument("--brenda_file", help="full path to brenda processed data file", type=str, required=True) + parser.add_argument("--sabio_file", help="full path to sabio processed data file", type=str, required=True) + parser.add_argument("--output_dir", help="full path to output directory to save merged data files", type=str, required=True) + args, unparsed = parser.parse_known_args() + parser = argparse.ArgumentParser() + + return args + +args = parse_args() + +sabio_df = pd.read_csv(f'{args.sabio_file}') +brenda_df = pd.read_csv(f'{args.brenda_file}') + +# reaction_smiles can be not sorted and appearing as non unique +# For example A.B smiles is not same as B.A +# By sorting they can be made equal +reacsmi_col = [] +for ind, row in sabio_df.iterrows(): + smi = row.reaction_smiles + if not pd.isna(smi): + reacs, prods = smi.split('>>') + reacs = sorted(reacs.split('.')) + prods = sorted(prods.split('.')) + smi = ".".join(reacs) + '>>' + ".".join(prods) + reacsmi_col.append(smi) +sabio_df['reaction_smiles'] = reacsmi_col + +reacsmi_col = [] +for ind, row in brenda_df.iterrows(): + smi = row.reaction_smiles + if not pd.isna(smi): + reacs, prods = smi.split('>>') + reacs = sorted(reacs.split('.')) + prods = sorted(prods.split('.')) + smi = ".".join(reacs) + '>>' + ".".join(prods) + reacsmi_col.append(smi) +brenda_df['reaction_smiles'] = reacsmi_col + +cols = ['sequence','sequence_source','uniprot','reaction_smiles','value','temperature','ph','taxonomy_id']# + +kcat_brenda = brenda_df[brenda_df.parameter=='turnover_number'] +kcat_brenda = kcat_brenda[cols] +kcat_brenda.reset_index(inplace=True,drop=True) + +kcat_sabio = sabio_df[sabio_df.param_name=='kcat'] +kcat_sabio['value'] = kcat_sabio.param_value_stdunit +kcat_sabio = kcat_sabio[cols] + +kcat_merged = pd.concat([kcat_brenda,kcat_sabio]) +values = [] +for val in kcat_merged.value: + if val>1e6: val=1e6 + elif val<1e-6: val=1e-6 + values.append(val) +kcat_merged['value'] = values +# cap very large or very small values + +kcat_merged['log10_value'] = np.log10(kcat_merged.value) +kcat_merged.drop_duplicates(inplace=True) +kcat_merged[['reactant_smiles','product_smiles']] = kcat_merged['reaction_smiles'].str.split('>>',expand=True) +kcat_merged.dropna(subset=['ec','taxonomy_id','sequence','reactant_smiles','log10_value'],inplace=True) +kcat_merged.reset_index(inplace=True,drop=True) + +# km +cols = ['sequence','sequence_source','uniprot','substrate_smiles','value','temperature','ph','taxonomy_id'] + +km_brenda = brenda_df[brenda_df.parameter=='km_value'] +km_brenda = km_brenda[cols] + +km_sabio = sabio_df[sabio_df.param_name=='Km'] +km_sabio['value'] = km_sabio.param_value_stdunit +km_sabio['substrate_smiles'] = km_sabio.param_species_smiles +km_sabio = km_sabio[cols] + +km_merged = pd.concat([km_brenda,km_sabio]) +values = [] +for val in km_merged.value: + if val>1e4: val=1e4 + elif val<1e-8: val=1e-8 + values.append(val) +km_merged['value'] = values + +km_merged['log10_value'] = np.log10(km_merged.value) +km_merged.drop_duplicates(inplace=True) +km_merged.dropna(subset=['ec','taxonomy_id','sequence','substrate_smiles','log10_value'],inplace=True) +km_merged.reset_index(inplace=True,drop=True) + +# ki +cols = ['sequence','sequence_source','uniprot','substrate_smiles','value','temperature','ph','taxonomy_id'] + +ki_brenda = brenda_df[brenda_df.parameter=='ki_value'] +ki_brenda = ki_brenda[cols] + +ki_sabio = sabio_df[sabio_df.param_name=='Ki'] +ki_sabio['value'] = ki_sabio.param_value_stdunit +ki_sabio['substrate_smiles'] = ki_sabio.param_species_smiles +ki_sabio = ki_sabio[cols] + +ki_merged = pd.concat([ki_brenda,ki_sabio]) +values = [] +for val in ki_merged.value: + if val>1e4: val=1e4 + elif val<1e-10: val=1e-10 + values.append(val) +ki_merged['value'] = values + +ki_merged['log10_value'] = np.log10(ki_merged.value) +ki_merged.drop_duplicates(inplace=True) +ki_merged.dropna(subset=['ec','taxonomy_id','sequence','substrate_smiles','log10_value'],inplace=True) +ki_merged.reset_index(inplace=True,drop=True) + +def handle_duplicates(df, param): + if param=='kcat': grouper = ['reactant_smiles','sequence'] + else: grouper = ['substrate_smiles','sequence'] + newdf = pd.DataFrame() + groups = df.groupby(grouper) + for each in tqdm(groups): + groupname, group = each + if param=='kcat': + value = group.log10_value.max() + group['log10kcat_max'] = value + else: + value = group.log10_value.mean() + group[f'log10{param}_mean'] = value + + group['group'] = '__'.join(groupname) + newdf = pd.concat([newdf,group.iloc[:1]]) + return newdf.reset_index(drop=True) + +ipdb.set_trace() + +kcat_merged = handle_duplicates(kcat_merged,'kcat') +km_merged = handle_duplicates(km_merged,'km') +ki_merged = handle_duplicates(ki_merged,'ki') + +if not os.path.exists(args.output_dir): + os.mkdir(args.output_dir) + +kcat_merged.to_csv(f'{args.output_dir}/kcat_merged_max.csv') +km_merged.to_csv(f'{args.output_dir}/km_merged_mean.csv') +ki_merged.to_csv(f'{args.output_dir}/ki_merged_mean.csv') + +print(len(kcat_merged)) +print(len(km_merged)) +print(len(ki_merged)) + +import sys +sys.exit(0) + +from sklearn.model_selection import train_test_split + +def split_train_test(df): + train_df, test_df = train_test_split(df, test_size=0.1, random_state=0) + train_df, val_df = train_test_split(train_df, test_size=0.1, random_state=0) + train_df['split'] = 'train' + val_df['split'] = 'val' + test_df['split'] = 'test' + + return pd.concat([train_df, val_df]).reset_index(drop=True), test_df + + +kcat_train, kcat_test = split_train_test(kcat_merged) +km_train, km_test = split_train_test(km_merged) +ki_train, ki_test = split_train_test(ki_merged) + +kcat_train.to_csv('./final_data/kcat_train.csv') +kcat_test.to_csv('./final_data/kcat_test.csv') +km_train.to_csv('./final_data/km_train.csv') +km_test.to_csv('./final_data/km_test.csv') +ki_train.to_csv('./final_data/ki_train.csv') +ki_test.to_csv('./final_data/ki_test.csv') + +kcat_train_seq = kcat_train.dropna(subset=['sequence']).reset_index(drop=True) +kcat_test_seq = kcat_test.dropna(subset=['sequence']).reset_index(drop=True) +km_train_seq = km_train.dropna(subset=['sequence']).reset_index(drop=True) +km_test_seq = km_test.dropna(subset=['sequence']).reset_index(drop=True) +ki_train_seq = ki_train.dropna(subset=['sequence']).reset_index(drop=True) +ki_test_seq = ki_test.dropna(subset=['sequence']).reset_index(drop=True) + +# stats for data visualization + +# +ecs = set(kcat_merged.ec).union(set(km_merged.ec)).union(set(ki_merged.ec)) +ecs_seq = set(kcat_train_seq.ec).union(set(kcat_test_seq.ec)).union(set(km_train_seq.ec)).union(set(km_test_seq.ec)).union(set(ki_train_seq.ec)).union(set(ki_test_seq.ec)) + +ec_to_seq = {ec:0 for ec in ecs} +for ec in ecs_seq: ec_to_seq[ec] = 1 + +smis = set(km_merged.ec).union(set(ki_merged.ec)) +for reacsmi in kcat_merged.reactant_smiles: + reacs = smis.split('.') + for r in reacs:smis.add(r) + +smis_seq = set(km_train_seq.ec).union(set(km_test_seq.ec)).union(set(ki_train_seq.ec)).union(set(ki_test_seq.ec)) +for reacsmi in kcat_train_seq.reactant_smiles: + reacs = smis_seq.split('.') + for r in reacs:smis_seq.add(r) +for reacsmi in kcat_test_seq.reactant_smiles: + reacs = smis.split('.') + for r in reacs:smis_seq.add(r) + +smi_to_seq = {smi:0 for smi in smis} +for smi in smis_seq: smi_to_seq[smi] = 1 + + diff --git a/scripts/processing/process_brenda.py b/scripts/processing/process_brenda.py new file mode 100644 index 0000000000000000000000000000000000000000..bef594f30d13b647be22f5c7f543996806bf02f7 --- /dev/null +++ b/scripts/processing/process_brenda.py @@ -0,0 +1,804 @@ +import os +import json +import time +import pandas as pd +import numpy as np +import requests +import ete3 +import re +import rdkit +from tqdm import tqdm +from rdkit import Chem +from rdkit.Chem import AllChem +from rdkit import DataStructs +from rdkit.Chem import rdChemReactions +from joblib import delayed, Parallel +from rdkit.Chem import Descriptors +from rdkit import RDLogger +RDLogger.DisableLog('rdApp.*') + +import requests +import sys +import argparse + +def parse_args(): + parser = argparse.ArgumentParser() + parser.add_argument("--rawdata_dir", help="raw data directory", type=str, required=True) + parser.add_argument("--processed_dir", help="processed dir to save", + type=str, required=True) + parser.add_argument("--out_file_name", help="name for out file", + type=str, required=True) + + args, unparsed = parser.parse_known_args() + parser = argparse.ArgumentParser() + + return args + +args = parse_args() +PARAMETERS_OF_INTEREST = ['km_value','kcat_km','ki_value','ic50','turnover_number'] +EC_WORD_NAMES = ["ec1", "ec2", "ec3", "ec"] +TAX_WORD_NAMES = [ +"superkingdom", +"phylum", +"class", +"order", +"family", +"genus", +"species"] +INCLUDE_OTHERS_AS_WILDTYPE = True +N_PROCS = 30 + +DATA_DIR = args.rawdata_dir +out_path = args.processed_dir + '/'+ args.out_file_name + +# Load BRENDA raw data +# Downloaded from https://www.brenda-enzymes.org/download.php +data = json.load(open(f'{DATA_DIR}/brenda_2022_2.json'))['data'] + +## Ligand data +# Go to https://www.brenda-enzymes.org/search_result.php?a=13 and place a blank query to get all ligands and their InChi strings +# Downloaded and pre-processed this along with missing metabolites using PubChem id-exchange service +# https://pubchem.ncbi.nlm.nih.gov/idexchange/idexchange.cgi + +metabolite_inchi_smiles_dic = pd.read_csv(f'{DATA_DIR}/metabolite_inchi_smiles_brenda_pubchem.tsv',sep='\t', + index_col='metabolite') + +# Create an empty dataframe and columns +df = pd.DataFrame() + +# storing ec numbers +eccol = [] +# storing organism names +orgcol = [] + +# storing parameter type (like turnover_number, km_value etc.) +paramcol = [] +# storing parameter values (like km,ki etc.) +valcol = [] + +# storing reactions (reactants, products) +rxncol = [] + +# storing substrates +subcol = [] + +# storing if the substrate is from a natural reaction or not +natural_substrate_col = [] + +# storing uniprots wherever available +unicol = [] + +# storing comment strings +commentcol = [] + +# storing ph optimum & temperature optimum +phopt_col = [] +topt_col = [] + +# all +all_metabolite_names = set() +all_natural_metabolite_names = set() + +#metals and ions list +metals_ions_list = set() + +for ec in tqdm(data): + if not ('proteins' in data[ec] or 'organisms' in data[ec]): + # this means we cannot featurize entries from this ec, so skip it + continue + + # not all entries for an ec number have all params + # see which among the parameters of interest are present + params_present = [] + for parameter_data in PARAMETERS_OF_INTEREST: + if parameter_data in data[ec]: params_present.append(parameter_data) + + # for mapping organisms + if 'organisms' in data[ec]: orgs_ec = data[ec]['organisms'] + else: orgs_ec = {} + if 'proteins' in data[ec]: orgs_protein = data[ec]['proteins'] + else: orgs_protein = orgs_ec + + metals_ions_now = set() + if 'metals_ions' in data[ec]: + for metalion_dict in data[ec]['metals_ions']: + metals_ions_now.add(metalion_dict['value']) + metals_ions_list = metals_ions_list.union(metals_ions_now) + + cofactors_now = set() + if 'cofactor' in data[ec]: + for cof_dict in data[ec]['cofactor']: + cofactors_now.add(cof_dict['value']) + # for mapping optimum temperatures by organism + topt_by_org = {} + if 'temperature_optimum' in data[ec]: + topt_data = data[ec]['temperature_optimum'] + for each in topt_data: + if 'organisms' in each: + org_topt = each['organisms'][0] + if 'num_value' in each: + topt_val = each['num_value'] + elif 'min_value' in each and 'max_value' in each: + topt_val = (each['min_value'] + each['max_value'])/2.0 + else: + topt_val = None + continue + + if org_topt in topt_by_org: + topt_by_org[org_topt].append(topt_val) + else: + topt_by_org[org_topt] = [topt_val] + + # for mapping optimum ph by organism + ph_by_org = {} + if 'ph_optimum' in data[ec]: + ph_data = data[ec]['ph_optimum'] + for each in ph_data: + if 'organisms' in each: + org_ph = each['organisms'][0] + if 'num_value' in each: + ph_val = each['num_value'] + elif 'min_value' in each and 'max_value' in each: + ph_val = (each['min_value'] + each['max_value'])/2.0 + else: + ph_val = None + continue + if org_ph in ph_by_org: + ph_by_org[org_ph].append(ph_val) + else: + ph_by_org[org_ph] = [ph_val] + + + # collect all the reactions of this EC grouped by substrates + sub_to_reactions = {} + + def _reaction_string(reacs,prods): + return f'{" + ".join(reacs)} >> {" + ".join(prods)}' + + if 'reaction' in data[ec]: + for rxn in data[ec]['reaction']: + try: + reacs = rxn['educts'] + prods = rxn['products'] + except KeyError: + reacs = [] + prods = [] + + each_rxn_str = _reaction_string(reacs,prods) + + for each in reacs: + if each in sub_to_reactions: + sub_to_reactions[each].add(each_rxn_str) + else: + sub_to_reactions[each] = set([each_rxn_str]) + + # collect any reactant or product from natural_reaction (s) as natural_substrates + natural_substrates = [] + if 'natural_reaction' in data[ec]: + for rxn in data[ec]['natural_reaction']: + found = False + try: + reacs = rxn['educts'] + prods = rxn['products'] + except KeyError: + reacs = [] + prods = [] + + each_rxn_str = _reaction_string(reacs,prods) + natural_substrates.extend(reacs) + natural_substrates.extend(prods) + for natural_met in reacs+prods: + all_natural_metabolite_names.add(natural_met) + for each in reacs: + if each in sub_to_reactions: + sub_to_reactions[each].add(each_rxn_str) + else: + sub_to_reactions[each] = set([each_rxn_str]) + + # now collect parameters + for parameter_data in params_present: + for entry in data[ec][parameter_data]: + if 'num_value' in entry and 'value' in entry and 'organisms' in entry: + val = entry['num_value'] + if 'organisms' in entry: + org_now = entry['organisms'] + prot_now = org_now + elif 'proteins' in entry: + prot_now = entry['proteins'] + + subname = entry['value'] + if parameter_data=='turnover_number' and (subname in cofactors_now or subname in metals_ions_now): + continue + if not pd.isna(val) and not pd.isna(subname): + try: + val = float(val) + except ValueError: + continue + # get orgname if present, skip entry otherwise + try: + orgname = data[ec]['organisms'][org_now[0]]['value'] + except KeyError: + continue + # get uniprot accessions , organism names + + unis = [] + orgnames = [] + + for org in prot_now: + if org in orgs_protein: + for each in orgs_protein[org]: + if 'accessions' in each: + unis.append(each['accessions']) + else: + unis.append(None) + + for org in org_now: + if org in orgs_ec: + if 'value' in orgs_ec[org]: + orgnames.append(orgs_ec[org]['value']) + else: + orgnames.append(None) + + orgcol.append(orgnames[0]) + if org_now[0] in ph_by_org: + phopt_col.append(ph_by_org[org_now[0]]) + else: + phopt_col.append([]) + + if org_now[0] in topt_by_org: + topt_col.append(topt_by_org[org_now[0]]) + else: + topt_col.append([]) + + unis_ = [] + for u in unis: + if u is None: continue + unis_.append(u) + + if not unis_: unis_ = None + + unicol.append(unis_) + valcol.append(val) + paramcol.append(parameter_data) + subcol.append(subname) + all_metabolite_names.add(subname) + if subname in natural_substrates: + natural_substrate_col.append(True) + else: + natural_substrate_col.append(False) + eccol.append(ec) + rxncol.append(sub_to_reactions) + # natrxncol.append(natural_reactions) + + if 'comment' in entry: + commentcol.append(entry['comment']) + else: + commentcol.append('') + +df['value'] = valcol +df['parameter'] = paramcol +df['substrate'] = subcol +df['natural_substrate'] = natural_substrate_col +df['organism'] = orgcol +df['ph_opt'] = phopt_col +df['temp_opt'] = topt_col +df['comment'] = commentcol +df['uniprot'] = unicol +df['ec'] = eccol +df['reactions'] = rxncol + +import ipdb +ipdb.set_trace() + +f = open('all_natural_metabolite_names.json','w') +f.write(json.dumps(list(all_natural_metabolite_names), indent=True)) +f.close() + +sys.exit(0) + +# Get NCBI Taxonomy parser - to convert organism names into their taxonomic lineages +ncbi = ete3.NCBITaxa() +get_taxid_from_organism = lambda organism: ncbi.get_name_translator([organism])[organism][0] + +ec_embed_cols = ["ec1", "ec2", "ec3", "ec"] +tax_embed_cols = [ + "superkingdom", + "phylum", + "class", + "order", + "family", + "genus", + "species", +] + +def get_ec_words(ec): + if '-' in ec: ec.replace('-','UNK') + ec_chars = ec.split('.') + ec_words = {f"ec{i}": '.'.join(ec_chars[:i]) for i in range(1,4)} + ec_words['ec'] = ec + return ec_words + +def get_tax_words(taxid, ncbi): + try: + lineage = ncbi.get_lineage(taxid) + rank_dict = ncbi.get_rank(lineage) + rank_dict_return = {} + for rankid, rankname in rank_dict.items(): + if rankname.lower() in tax_embed_cols: rank_dict_return[rankname.lower()] = ncbi.get_taxid_translator([rankid])[rankid] + except: + rank_dict_return = {tax: 'UNK' for tax in tax_embed_cols} + return rank_dict_return + +taxid_col = [] +for ind, row in tqdm(df.iterrows()): + org = row.organism + try: + taxid = get_taxid_from_organism(org) + except KeyError: + taxid = None + taxid_col.append(taxid) +df['taxonomy_id'] = taxid_col + +ec_words = [] +for ind, row in df.iterrows(): + words = get_ec_words(row.ec) + ec_words.append(words) +for col in ec_embed_cols: + col_values = [ec_words[i][col] for i in range(len(df))] + df[col] = col_values + +tax_words = [] +for ind, row in df.iterrows(): + words = get_tax_words(row.taxonomy_id, ncbi) + tax_words.append(words) +for col in tax_embed_cols: + col_values = [] + for i in range(len(df)): + if col in tax_words[i]: + col_values.append(tax_words[i][col]) + else: + col_values.append('UNK') + df[col] = col_values + +# import ipdb +# ipdb.set_trace() + +# now SMILES mapping +smiles_col = [] +for ind, row in tqdm(df.iterrows()): + sub = row.substrate + if not sub in metabolite_inchi_smiles_dic.index: + smiles_col.append(None) + else: + smiles_col.append(metabolite_inchi_smiles_dic.loc[sub].smiles) + +df['substrate_smiles'] = smiles_col + +mwcol = [] + +for smi in tqdm(metabolite_inchi_smiles_dic.smiles): + mw = None + if not smi is None: + try: + mol = Chem.MolFromSmiles(smi) + mw = Descriptors.MolWt(mol) + except: + pass + mwcol.append(mw) +metabolite_inchi_smiles_dic['MW'] = mwcol + +def sort_by_second(item): return item[1] + +smi_to_mw_dic = {} +for smi, mw in zip(metabolite_inchi_smiles_dic.smiles, metabolite_inchi_smiles_dic.MW): + smi_to_mw_dic[smi] = mw + +def sum_mwts(smis): + mw = 0 + for smi in smis: + mw+=smi_to_mw_dic[smi] + return mw + +# Assign enzyme type by parsing comments +# Assign everything as wild type first and filter out entries that are 'not possibly' wild-type +df["enzyme_type"] = np.nan +df.loc[pd.isnull(df["comment"])] = "" +df["enzyme_type"] = "wild type" +df["enzyme_type"][df['comment'].str.contains("mutant")] = "mutant" +df["enzyme_type"][df['comment'].str.contains("mutate")] = "mutant" +df["enzyme_type"][df['comment'].str.contains("chimera")] = "mutant" +df["enzyme_type"][df['comment'].str.contains("inhibitor")] = "inhibition" +df["enzyme_type"][df['comment'].str.contains("inhibition")] = "inhibition" +df["enzyme_type"][df['comment'].str.contains("presence of")] = "regulated" +df["enzyme_type"][df['comment'].str.contains("recombinant")] = "recombinant" +df["enzyme_type"][df['comment'].str.contains("allozyme")] = "allozyme" +df["enzyme_type"][df['comment'].str.contains("alloenzyme")] = "allozyme" +df["enzyme_type"][df['comment'].str.contains("isozyme")] = "isozyme" +df["enzyme_type"][df['comment'].str.contains("isoenzyme")] = "isozyme" +df["enzyme_type"][df['comment'].str.contains("isoform")] = "isozyme" + +# some entries still belong to mutants +# check for X__Y type of comments (eg: W358A) +# these correspond to mutations should be removed +pat = r'[ACDEFGHIKLMNPQRSTVWY][0-9]+[ACDEFGHIKLMNPQRSTVWY]' +mutations_col = [] +enztype_col = [] +for com,enz_type in zip(df.comment,df.enzyme_type): + items = re.findall(pattern=pat, string=com) + if len(items)>0: + mutations_col.append(';'.join(items)) + enztype_col.append('mutant') + else: + mutations_col.append(None) + enztype_col.append(enz_type) +df['enzyme_type'] = enztype_col +df['mutations'] = mutations_col + +# Now assigne ph and temperature first from comments +# then from optimum values for organism, ec +phrow = [] +temprow = [] +for com,phopt,topt in zip(df.comment,df.ph_opt,df.temp_opt): + pat = r'[0-9][0-9].C' + try: + temp = int(re.findall(pattern=pat, string=com)[0].split('C')[0][:2]) + pat = r'pH [0-9]\.[0-9]' + ph = float(re.findall(pattern=pat, string=com)[0].split('pH')[-1].strip()) + except: + if phopt: ph = np.average(phopt) + else: ph = None + if topt: temp = np.average(topt) + else: temp = None + phrow.append(ph) + temprow.append(temp) + +df['ph'] = phrow +df['temperature'] = temprow + +# fill in for missing ph, temperature using org,ec groups +orgec_to_topt = {} +orgec_to_phopt = {} +org_to_topt = {} +org_to_phopt = {} +for _, row in df.iterrows(): + org = row.organism + ec = row.ec + orgec = org+'__'+ec + if not orgec in orgec_to_topt: + orgec_to_topt[orgec] = [] + if not orgec in orgec_to_phopt: + orgec_to_phopt[orgec] = [] + if not org in org_to_topt: + org_to_topt[org] = [] + if not org in org_to_phopt: + org_to_phopt[org] = [] + if not pd.isna(row.temperature): + orgec_to_topt[orgec].append(row.temperature) + org_to_topt[org].append(row.temperature) + if not pd.isna(row.ph): + orgec_to_phopt[orgec].append(row.ph) + org_to_phopt[org].append(row.ph) + +tempcol = [] +phcol = [] +for org, ec, temp, ph in zip(df.organism, df.ec, df.temperature,df.ph): + orgec = org+'__'+ec + if pd.isna(temp): + if len(orgec_to_topt[orgec])>0: + temp = np.median(orgec_to_topt[orgec]) + else: + if len(org_to_topt[org])>0: + temp = np.median(org_to_topt[org]) + else: + temp = None + if pd.isna(ph): + if len(orgec_to_phopt[orgec])>0: + ph = np.median(orgec_to_phopt[orgec]) + else: + if len(org_to_phopt[org])>0: + ph = np.median(org_to_phopt[org]) + else: + ph = None + tempcol.append(temp) + phcol.append(ph) + +df['temperature'] = tempcol +df['ph'] = phcol + +def _split_reaction(reaction): + reacs, prods = reaction.split(" >> ") + reacs = reacs.split(' + ') + prods = prods.split(' + ') + return reacs, prods + +rxnsmi_col = [] +mwdiff_col = [] +mw_col = [] +all_rxnsmis = [] +for substrate, subsmi, sub_to_reactions in tqdm(zip(df.substrate, + df.substrate_smiles, + df.reactions)): + rxnsmis = [] + for sub, reactions in sub_to_reactions.items(): + try: + subsminow = metabolite_inchi_smiles_dic.loc[sub].smiles + except KeyError: + continue + if subsminow!=subsmi: + continue + for reaction in reactions: + reacs, prods = _split_reaction(reaction) + reacsmis = [] + prodsmis = [] + for reac in reacs: + if reac in metabolite_inchi_smiles_dic.index: + reacsmis.append(metabolite_inchi_smiles_dic.loc[reac].smiles) + for prod in prods: + if prod in metabolite_inchi_smiles_dic.index: + prodsmis.append(metabolite_inchi_smiles_dic.loc[prod].smiles) + + try: + reac_mw = sum_mwts(reacsmis) + except: + reac_mw = None + + try: + prod_mw = sum_mwts(prodsmis) + except: + prod_mw = None + + reacsmis_ = [] + for smi in reacsmis: + if pd.isna(smi): + continue + else: + reacsmis_.append(smi) + prodsmis_ = [] + for smi in prodsmis: + if pd.isna(smi): + continue + else: + prodsmis_.append(smi) + + reaction_smiles = f'{".".join(reacsmis_)}>>{".".join(prodsmis_)}' + + if pd.isna(reac_mw) or pd.isna(prod_mw): + rxnsmis.append((reaction_smiles,100000,0)) + else: + rxnsmis.append((reaction_smiles,abs(reac_mw-prod_mw),reac_mw+prod_mw)) + + rxn_now = None + mwdiff_now = None + mw_now = None + # if something found, add + if len(rxnsmis)>0: + rxnsmis_sorted = sorted(rxnsmis,key=sort_by_second) + for rxnsmi, mwdiff,mw in rxnsmis_sorted: + reacside, prodside = rxnsmi.split('>>') + if subsmi in reacside: + rxn_now = rxnsmi + mwdiff_now = mwdiff + mw_now = mw + break + + mwdiff_col.append(mwdiff_now) + mw_col.append(mw_now) + rxnsmi_col.append(rxn_now) + all_rxnsmis.append(rxnsmis) + +df['reaction_smiles'] = rxnsmi_col +df['reaction_mw_difference'] = mwdiff_col +df['reaction_mw'] = mw_col + +unicol = [] +for ind, row in tqdm(df.iterrows()): + if not type(row.uniprot) is list: + if pd.isna(row.uniprot): + unicol.append(None) + continue + unis = np.array(row.uniprot).flatten() + try: + unicol.append(';'.join(unis)) + except TypeError: + unis_ = [] + for each in unis: + unis_.extend(each) + unis_ = np.array(unis_).flatten() + unicol.append(';'.join(unis_)) + +df['uniprot'] = unicol + +seqcol = [] +uniset = set() +for uni in df.uniprot: + if pd.isna(uni): continue + else: + unis = uni.split(';') + for each in unis: + uniset.add(each) + +def _get_sequence(uni): + r = requests.get(f'https://rest.uniprot.org/uniprotkb/{uni}.fasta') + if r.status_code==200: + lines = r.text.split('\n') + seq = ''.join(lines[1:]) + return seq + +outputs = Parallel(n_jobs=30, verbose=5)(delayed(_get_sequence)(uni) for uni in uniset) +uni_to_seq = {} +for uni, seq in zip(uniset, outputs): + uni_to_seq[uni] = seq + +seqrow = [] +seq_srcrow = [] +for ind, row in tqdm(df.iterrows()): + uni = row.uniprot + if pd.isna(uni): + seqrow.append(None) + seq_srcrow.append(None) + else: + unis = row.uniprot.split(';') + seqs = [] + for uni in unis: + if uni in uni_to_seq: + seqs.append(uni_to_seq[uni]) + else: + continue + set_seqs = set(seqs) + if len(set_seqs)>=1: + seqrow.append(';'.join(set_seqs)) + seq_srcrow.append('brenda') + else: + seqrow.append(None) + seq_srcrow.append(None) + +df['sequence'] = seqrow +df['sequence_source'] = seq_srcrow +noseq_pairs = [] +for ind, row in df.iterrows(): + if pd.isna(seq) or seq.strip()=='': + if not pd.isna(tax) and not pd.isna(ec): + seq = row.sequence + tax = str(int(row.taxonomy_id)) + ec = row.ec + noseq_pairs.append(tax+'__'+ec) + +noseq_pairs = set(noseq_pairs) +noseq_tax_ec = [] +for each in noseq_pairs: + tax, ec = each.split('__') + noseq_tax_ec.append((tax, ec)) + +def get_url(taxid,ec): + return f"https://rest.uniprot.org/uniprotkb/stream?fields=accession%2Cid%2Csequence&format=tsv&query=%28%28organism_id%3A{taxid}%29+AND+%28ec%3A{ec}%29%29" + +import requests +def fetch_and_process(items): + ec,tax = items + url = get_url(ec, tax) + key = f'{tax}__{ec}.tsv' + keydir = f'{args.processed_dir}/tax_ec_seqdata/' + failed = False + dic = {} + if os.path.exists(keydir+key): + _df = pd.read_csv(keydir+key, sep='\t') + else: + r = requests.get(url) + if r.status_code==200: + text = r.text + try: + f = open(keydir + key, 'w') + f.write(text) + f.close() + except: + pass + _df = pd.read_csv(keydir+key, sep='\t') + else: + failed = True + if not failed: + for entry, seq in zip(_df.Entry, _df.Sequence): + dic[entry] = seq + + return dic + +noseq_tax_ec = list(noseq_tax_ec) +seq_dicts = Parallel(n_jobs=30, verbose=100)(delayed(fetch_and_process)(items) for items in noseq_tax_ec) + +tax_ec_seqs_dict = {} + +for (tax,ec), seqs in zip(noseq_tax_ec, seq_dicts): + tax_ec_seqs_dict[str(tax)+'__'+ec] = seqs + +f = open(f'{args.processed_dir}/tax_ec_seqs_dict.json','w') +f.write(json.dumps(tax_ec_seqs_dict,indent=True)) +f.close() + +seqrow = [] +srcrow = [] +unirow = [] +for ind, row in tqdm(df.iterrows()): + seq = row.sequence + src = row.sequence_source + uni = row.uniprot + if pd.isna(seq) and not pd.isna(row.taxonomy_id): + tax = str(int(row.taxonomy_id)) + ec = str(row.ec) + pair = tax+'__'+ec + if pair in tax_ec_seqs_dict: + seq_dict = tax_ec_seqs_dict[pair] + else: + seq_dict = {} + if len(seq_dict)>0: + unis = [] + seqs = [] + for uni, seq in seq_dict.items(): + unis.append(uni) + seqs.append(seq) + seqrow.append(';'.join(seqs)) + unirow.append(';'.join(unis)) + srcrow.append('uniprot_search') + else: + seqrow.append(seq) + unirow.append(uni) + srcrow.append('brenda') + else: + seqrow.append(seq) + unirow.append(uni) + srcrow.append('brenda') + +df['uniprot'] = unirow +df['sequence'] = seqrow +df['sequence_source'] = srcrow + +nseq_col = [] +for ind, row in tqdm(df.iterrows()): + if pd.isna(row.sequence): + nseq_col.append(0) + seqcol.append(None) + else: + seqs = row.sequence.split(';') + nseq_col.append(len(seqs)) + +df['n_sequence'] = nseq_col + +df.dropna(subset=['sequence'],inplace=True) +df.reset_index(inplace=True, drop=True) + +dfseq1 = df[df.n_sequence==1] +dfseq1.drop(columns=['reactions'],inplace=True) +dfseq1.reset_index(inplace=True, drop=True) +dfseq1.to_csv(f'{args.processed_dir}/brenda_processed_all_singleSeqs.csv') + +dfseq1_wt = dfseq1[dfseq1.enzyme_type=='wild type'] +dfseq1_wt.reset_index(inplace=True, drop=True) +dfseq1_wt.to_csv(f'{args.processed_dir}/brenda_processed_wt_singleSeqs.csv') + +dfseq2 = df[df.n_sequence>=1] +dfseq2 = df[df.n_sequence<=10] +dfseq2.drop(columns=['reactions'],inplace=True) +dfseq2.reset_index(inplace=True, drop=True) +dfseq2.to_csv(f'{args.processed_dir}/brenda_processed_all_multipleSeqs.csv') + +dfseq2_wt = dfseq2[dfseq2.enzyme_type=='wild type'] +dfseq2_wt.reset_index(inplace=True, drop=True) +dfseq2_wt.to_csv(f'{args.processed_dir}/brenda_processed_wt_multipleSeqs.csv') diff --git a/scripts/processing/process_sabio.py b/scripts/processing/process_sabio.py new file mode 100644 index 0000000000000000000000000000000000000000..e0a42c684091b8b4224a7bc1e045c0008727b1e0 --- /dev/null +++ b/scripts/processing/process_sabio.py @@ -0,0 +1,1066 @@ +import argparse +import re +from bs4 import BeautifulSoup +import sys +import os.path +from libsbml import * +import json +from tqdm import tqdm +from rdkit.Chem import Descriptors +from rdkit import RDLogger +RDLogger.DisableLog('rdApp.*') +import json +import sys +import os +import os.path + +import warnings +warnings.filterwarnings("ignore") + +from libsbml import * +import json +import numpy as np +from tqdm import tqdm +import pandas as pd +import matplotlib.pyplot as plt +from sklearn.model_selection import train_test_split +from rdkit import Chem +from joblib import Parallel, delayed +import ipdb +import ete3 + +def get_inchi_smiles(html_string): + + soup = BeautifulSoup(html_string, 'lxml') # Parse the HTML as a string + + table = soup.find_all('table')[0] # Grab the first table + + tds = table.find_all('td') + + items_all = [] + for td in tds: + items = td.find_all('span') + if not items: continue + else: items_all.extend(items) + + inchis = [] + smiles = [] + for item in items_all: + val = item.attrs['id'] + if 'Inchi' in val: + inchis.append(item.text) + elif 'Smiles' in val: + smiles.append(item.text) + + return inchis, smiles + +def has_regulator(html_string): + soup = BeautifulSoup(html_string, 'lxml') # Parse the HTML as a string + + name_to_cid = {} + + try: + table = soup.find_all('table')[0] # Grab the first table + except: + return name_to_cid + + tds = table.find_all('td') + + for td in tds: + if 'Modifier-Inhibitor' in td or 'Modifier-Activator' in td: + return True + + return False + +def get_name_to_cid(html_string): + soup = BeautifulSoup(html_string, 'lxml') # Parse the HTML as a string + + name_to_cid = {} + + try: + table = soup.find_all('table')[0] # Grab the first table + except: + return name_to_cid + + tds = table.find_all('td') + + for td in tds: + items = td.find_all('a') + for item in items: + if not 'compdetails.jsp?' in str(item): continue + cid = item.attrs['href'].split('./compdetails.jsp?cid=')[-1] + name = item.text.strip() + name_to_cid[name] = cid + + return name_to_cid + +def get_protein_units(html_string): + soup = BeautifulSoup(html_string, 'lxml') # Parse the HTML as a string + + table = soup.find_all('table')[0] # Grab the first table + + tds = table.find_all('td') + + ourlines = [] + for td in tds: + std = str(td) + if not 'proteindetails.jsp?' in std: continue + lines = std.split() + for line in lines: + if 'http://sabiork.h-its.org/proteindetails.jsp?' in line: + ourlines.append(line) + + ourlines = list(set(ourlines)) + + uniprots = [] + repeats = [] + + for line in ourlines: + try: + if ')*' in line: item = re.findall(r'>[A-Z,0-9]+[\)]*[\*,0-9]*',line)[0] + else: item = re.findall(r'>[A-Z,0-9]+[\)]*',line)[0] + except: + print(line) + uni, extra = item.split('') + uni = uni.split('>')[-1] + extra = extra.split(';')[0] + if '*' in extra: + repeat = extra.split('*')[-1] + else: + repeat = '1' + uniprots.append(uni) + repeats.append(repeat) + + return uniprots, repeats + + +def parse(filename): + document = readSBML(filename) + + errors = document.getNumErrors() + + m = document.getModel() + + species_data = { + } + # map species id to name + # Species + #print("----- " + 'Species' + "----- ") + for i in range(0, m.getNumSpecies()): + data = { + } + sp = m.getSpecies(i) + sp_str = str(sp)[1:-1] # 1, -1 to remove < > + items = sp_str.split('Species')[1].strip().split() + sp_id = items[0] + sp_name = ' '.join(items[1:]) + #print(sp_id, ':', sp_name[1:-1]) + data['name'] = sp_name[1:-1] + annot_lines = sp.annotation_string.split('\n') + # #print(annot_lines) + chebi_ids = [] + kegg_ids = [] + uni_ids = [] + for line in annot_lines: + if 'rdf:resource' in line: + link = line.split('rdf:resource')[1][2:-3] + some_id = link.split('/')[-1] + if 'chebi' in link: + chebi_ids.append(some_id) + elif 'kegg' in link: + kegg_ids.append(some_id) + elif 'uniprot' in link: + uni_ids.append(some_id) + #print(link) + data['chebi'] = chebi_ids + data['kegg'] = kegg_ids + data['uniprot'] = uni_ids + + species_data[sp_id] = data + + # FunctionDefinition + # for i in range (0, m.getNumFunctionDefinitions()): + # sp = m.getFunctionDefinition(i) + # #printAnnotation(sp) + + unit_data = {} # map unit id to name + # UnitDefinition + #print("----- " + "unitDefinition" + "----- ") + for i in range (0, m.getNumUnitDefinitions()): + sp = m.getUnitDefinition(i) + unit_str = str(sp)[1:-1] # 1, -1 to remove < > + unitid, unitname = unit_str.split('UnitDefinition')[1].strip().split() + unit_data[unitid] = unitname[1:-1] # 1, -1 to remove " " + #print(unitid, ':', unitname[1:-1]) + + rxn_data = [] + for i in range(0, m.getNumReactions()): + data = {} + re = m.getReaction(i) + annot_lines = re.annotation_string.split('\n') + re_links = [] + #print("----- " + 'Reaction' + ' id: ' + re.id + " ----- ") + ec_ids = [] + tax_ids = [] + sabio_rxn_ids = [] + for line in annot_lines: + if 'rdf:resource' in line: + link = line.split('rdf:resource')[1][2:-3] + re_links.append(link) + some_id = link.split('/')[-1] + if 'ec' in link: + ec_ids.append(some_id) + elif 'taxonomy' in link: + tax_ids.append(some_id) + elif 'sabiork' in link: + sabio_rxn_ids.append(some_id) + #print(link) + data['ec'] = ec_ids + data['taxonomy'] = tax_ids + data['sabio_reaction'] = sabio_rxn_ids + + # SpeciesReference (Reactant) + + #print("----- " + 'Reactants' + " ----- ") + reactant_species_ids = [] + reactant_stoichs = [] + for j in range(0, re.getNumReactants()): + rt = re.getReactant(j) + reactant_stoichs.append(rt.getStoichiometry()) + reactant_species_ids.append(rt.getSpecies()) + #print(rt.getStoichiometry(), rt.getSpecies()) + + data['reactants'] = {'species': reactant_species_ids,'stoichiometry':reactant_stoichs} + # SpeciesReference (Product) + + #print("----- " + 'Products' + " ----- ") + product_species_ids = [] + product_stoichs = [] + for j in range(0, re.getNumProducts()): + rt = re.getProduct(j) + product_stoichs.append(rt.getStoichiometry()) + product_species_ids.append(rt.getSpecies()) + #print(rt.getStoichiometry(), rt.getSpecies()) + + data['products'] = {'species': product_species_ids,'stoichiometry':product_stoichs} + + # ModifierSpeciesReference (Modifiers) + + #print("----- " + 'Modifiers' + " ----- ") + modifier_species_ids = [] + for j in range(0, re.getNumModifiers()): + md = re.getModifier(j) + modifier_species_ids.append(md.getSpecies()) + #print(md.getSpecies()) + + data['modifiers'] = modifier_species_ids + + # KineticLaw + + if re.isSetKineticLaw(): + kl = re.getKineticLaw() + #print("----- " + 'Kinetic Law' + " ----- ") + annot_lines = kl.annotation_string.split('\n') + kl_data = {} + temperature = '' + temperature_unit = '' + ph = '' + buffer = '' + for line in annot_lines: + tag = 'sbrk:startValueTemperature' + if tag in line: + items = line.split(tag) + temperature = items[1][1:-2] + tag = 'sbrk:temperatureUnit' + if tag in line: + items = line.split(tag) + temperature_unit = items[1][2:-2] + tag = 'sbrk:startValuepH' + if tag in line: + items = line.split(tag) + ph = items[1][1:-2] + tag = 'sbrk:buffer' + if tag in line: + items = line.split(tag) + buffer = items[1][1:-2] + if 'rdf:resource' in line: + link = line.split('rdf:resource')[1][2:-3] + some_id = link.split('/')[-1] + if 'pubmed' in link: + kl_data['pubmed'] = some_id + elif 'sabiork' in link: + kl_data['sabio_kinetic_law'] = some_id + + #print("----- " + 'Experimental conditions' + " ----- ") + #print('Temperature:', temperature, temperature_unit) + #print('pH:', ph) + #print('Buffer:', buffer) + kl_data['temperature'] = temperature + kl_data['ph'] = ph + kl_data['buffer'] = buffer + + # Parameter + parameter_ids = [] + parameter_values = [] + parameter_units = [] + + #print("----- " + 'Parameters' + " ----- ") + for j in range(0, kl.getNumParameters()): + pa = kl.getParameter(j) + parameter_ids.append(pa.id) + parameter_values.append(pa.getValue()) + parameter_units.append(pa.getUnits()) + #print(pa.id, ':', pa.getValue(), pa.getUnits()) + + kl_data['parameters'] = { + 'id': parameter_ids, + 'values': parameter_values, + 'units': parameter_units + } + + data['kinetic_law'] = kl_data + rxn_data.append(data) + + return species_data, unit_data, rxn_data + +def parse_args(): + parser = argparse.ArgumentParser() + parser.add_argument("--rawdata_dir", help="directory where raw data is stored", type=str, required=True) + parser.add_argument("--processed_dir", help="directory where to store processed data", type=str, required=True) + parser.add_argument("--out_file_name", help="out file name", + type=str, required=True) + + args, unparsed = parser.parse_known_args() + parser = argparse.ArgumentParser() + + return args + +args = parse_args() +N_PROCS = 30 + +sbml_data_dir = os.path.abspath(args.rawdata_dir) +processed_dir = os.path.abspath(args.processed_dir) +out_path = processed_dir + args.out_file_name + +# these xml files were downloaded using SABIO-RK web search interface for wild-type enzymes + +sbml_files = [os.path.join(sbml_data_dir, file) for file in os.listdir(sbml_data_dir) if file.endswith('.xml')] +species_data_all = {} +unit_data_all = {} +rxn_data_all = [] +for sbml_file in tqdm(sbml_files): + species_data, unit_data, rxn_data = parse(sbml_file.strip()) + species_data_all.update(species_data) + unit_data_all.update(unit_data) + rxn_data_all.extend(rxn_data) + +f = open(os.path.join(processed_dir, 'sabio_sbml_species_dict.json'),'w') +f.write(json.dumps(species_data_all,indent=True)) +f.close() +f = open(os.path.join(processed_dir, 'sabio_sbml_unit_dict.json'),'w') +f.write(json.dumps(unit_data_all,indent=True)) +f.close() +f = open(os.path.join(processed_dir, 'sabio_sbml_reaction_dict.json'),'w') +f.write(json.dumps(rxn_data_all,indent=True)) +f.close() + +rxn_data = json.load(open(os.path.join(processed_dir, 'sabio_sbml_reaction_dict.json'))) +species_data = json.load(open(os.path.join(processed_dir, 'sabio_sbml_species_dict.json'))) +unit_data = json.load(open(os.path.join(processed_dir, 'sabio_sbml_unit_dict.json'))) + +kl_sabio_id_col = [] +pubmed_col = [] +uni_col = [] +reactant_col = [] +reactant_stoich_col = [] +product_col = [] +product_stoich_col = [] + +param_species_col = [] + +param_col = [] +param_value_col = [] +param_unit_col = [] +temperature_col = [] +ph_col = [] +buffer_col = [] +ec_col = [] +tax_col = [] +rxn_sabio_id_col = [] + +for rxn in rxn_data: + for param,value,unit in zip(rxn['kinetic_law']['parameters']['id'],rxn['kinetic_law']['parameters']['values'],rxn['kinetic_law']['parameters']['units']): + param_col.append(param) + param_value_col.append(value) + param_unit_col.append(unit) + rxn_sabio_id_col.append(';'.join(rxn['sabio_reaction'])) + tax_col.append(';'.join(rxn['taxonomy'])) + ec_col.append(';'.join(rxn['ec'])) + uni = False + unis = [] + for mod in rxn['modifiers']: + if mod.startswith('ENZ') and mod in species_data: + if len(species_data[mod]['uniprot'])>0: + uni = True + unis.append(';'.join(species_data[mod]['uniprot'])) + + if len(unis)==0: + uni_col.append(None) + else: + uni_col.append(';'.join(unis)) + + if 'pubmed' in rxn['kinetic_law']: + pubmed_col.append(rxn['kinetic_law']['pubmed']) + else: + pubmed_col.append(None) + + if 'sabio_kinetic_law' in rxn['kinetic_law']: + kl_sabio_id_col.append(rxn['kinetic_law']['sabio_kinetic_law']) + else: + kl_sabio_id_col.append(None) + + reactant_col.append(rxn['reactants']['species']) + reactant_stoich_col.append(rxn['reactants']['stoichiometry']) + + product_col.append(rxn['products']['species']) + product_stoich_col.append(rxn['products']['stoichiometry']) + + buffer_col.append(rxn['kinetic_law']['buffer']) + temperature_col.append(rxn['kinetic_law']['temperature']) + ph_col.append(rxn['kinetic_law']['ph']) + +sabio_df = pd.DataFrame() +sabio_df['uniprot'] = uni_col +sabio_df['ec'] = ec_col +sabio_df['taxonomy_id'] = tax_col +sabio_df['param'] = param_col +sabio_df['param_value'] = param_value_col +sabio_df['param_unit'] = param_unit_col +sabio_df['reactant_species'] = reactant_col +sabio_df['product_species'] = product_col +sabio_df['reactant_stoichiometry'] = reactant_stoich_col +sabio_df['product_stoichiometry'] = product_stoich_col + +sabio_df['temperature'] = temperature_col +sabio_df['ph'] = ph_col +sabio_df['buffer'] = buffer_col +sabio_df['pubmed_id'] = pubmed_col +sabio_df['sabio_reaction_id'] = rxn_sabio_id_col +sabio_df['sabio_kinetic_law_id'] = kl_sabio_id_col + +# Get NCBI Taxonomy parser - to convert organism names into their taxonomic lineages +ncbi = ete3.NCBITaxa() +get_taxid_from_organism = lambda organism: ncbi.get_name_translator([organism])[organism][0] + +ec_embed_cols = ["ec1", "ec2", "ec3", "ec"] +tax_embed_cols = [ + "superkingdom", + "phylum", + "class", + "order", + "family", + "genus", + "species", +] + +def get_ec_words(ec): + if '-' in ec: ec.replace('-','UNK') + ec_chars = ec.split('.') + ec_words = {f"ec{i}": '.'.join(ec_chars[:i]) for i in range(1,4)} + ec_words['ec'] = ec + return ec_words + +def get_tax_words(taxid, ncbi): + try: + lineage = ncbi.get_lineage(taxid) + rank_dict = ncbi.get_rank(lineage) + rank_dict_return = {} + for rankid, rankname in rank_dict.items(): + if rankname.lower() in tax_embed_cols: rank_dict_return[rankname.lower()] = ncbi.get_taxid_translator([rankid])[rankid] + except: + rank_dict_return = {tax: 'UNK' for tax in tax_embed_cols} + return rank_dict_return + +ec_words = [] +for ind, row in sabio_df.iterrows(): + words = get_ec_words(row.ec) + ec_words.append(words) +for col in ec_embed_cols: + col_values = [ec_words[i][col] for i in range(len(sabio_df))] + sabio_df[col] = col_values + +tax_words = [] +for ind, row in sabio_df.iterrows(): + words = get_tax_words(row.taxonomy_id, ncbi) + tax_words.append(words) +for col in tax_embed_cols: + col_values = [] + for i in range(len(sabio_df)): + if col in tax_words[i]: + col_values.append(tax_words[i][col]) + else: + col_values.append('UNK') + sabio_df[col] = col_values + +# ipdb.set_trace() +# Add species names + +def convert_unit_kcat(kcat,unit): + if unit=='minwedgeone': + kcat = kcat*60 + elif unit=='swedgeone': + kcat = kcat + elif unit=='hwedgeone': + kcat = kcat*60*60 + else: + kcat = None + return kcat + +def convert_unit_km(km,unit): + if unit=='M': + km = km*1000 + elif unit=='microM': + km = km*0.001 + elif unit=='nM': + km = km*0.001*0.001 + elif unit=='mM': + km = km + else: + km = km + return km + +# def convert_unit_kcat_km(kcat_km, unit): +# if unit=='mMwedgeoneswedgeone': +# kcat_km = kcat_km +# elif unit=='Mwedgeoneminwedgeone': +# kcat_km = kcat_km/60. +# kcat_km = kcat_km/ +# ['','Mwedgeoneswedgeone','mMwedgeoneminwedgeone','', +# 'microMwedgeoneminwedgeone','nMwedgeoneminwedgeone','nMwedgeoneswedgeone'] + +reactant_names_col = [] +product_names_col = [] +param_names_col = [] +param_values_col = [] +units = [] +param_species_col = [] +param_species_name_col = [] +total = 0 +u = 0 +for reactants,products,param,param_unit,param_value in zip( + sabio_df.reactant_species, + sabio_df.product_species, + sabio_df.param, + sabio_df.param_unit, + sabio_df.param_value): + + if param=='kcat': + par = 'kcat' + val = convert_unit_kcat(param_value, param_unit) + elif param.startswith('Km_'): + _, species = param.split('Km_') + par = 'Km' + val = convert_unit_km(param_value, param_unit) + elif param.startswith('Ki_'): + _, species = param.split('Ki_') + par = 'Ki' + val = convert_unit_km(param_value, param_unit) + elif param.startswith('IC50_'): + _, species = param.split('IC50_') + par = 'IC50' + val = convert_unit_km(param_value, param_unit) + elif param.startswith('kcat_Km_'): + _, species = param.split('kcat_Km_') + par = 'kcat_Km' + units.append(param_unit) + # total+=1 + # if param_unit in ['Mwedgeoneminwedgeone','Mwedgeoneswedgeone','mMwedgeoneminwedgeone','mMwedgeoneswedgeone', + # 'microMwedgeoneminwedgeone','nMwedgeoneminwedgeone','nMwedgeoneswedgeone']: u+=1 + val = param_value#convert_unit_km(param_value, param_unit) + else: + par = None + val = None + param_values_col.append(val) + param_species_col.append(species) + param_names_col.append(par) + reactant_names = [] + product_names = [] + for reactant in reactants: + if pd.isna(reactant): + reactant_names.append(None) + continue + elif reactant in species_data: + name = species_data[reactant]['name'] + reactant_names.append(name) + for product in products: + if pd.isna(product): + product_names.append(None) + continue + elif product in species_data: + name = species_data[product]['name'] + product_names.append(name) + if species in species_data: + name = species_data[species]['name'] + param_species_name_col.append(name) + else: + param_species_name_col.append(None) + reactant_names_col.append(reactant_names) + product_names_col.append(product_names) + +sabio_df['reactant_names'] = reactant_names_col +sabio_df['product_names'] = product_names_col +sabio_df['param_name'] = param_names_col +sabio_df['param_value_stdunit'] = param_values_col +sabio_df['param_species'] = param_species_col +sabio_df['param_species_name'] = param_species_name_col + +print(sabio_df.columns) + +from joblib import Parallel, delayed +import requests + +def download_sabio_kl(kl): + r = requests.get(f'https://sabiork.h-its.org/kindatadirectiframe.jsp?kinlawid={kl}') + if r.status_code==200: + html_string = r.text + f = open(f'{sbml_data_dir}/kl_html/{kl}.html','w') + f.write(html_string) + f.close() + return True + else: + return False + +kls_to_download = set() +for klid in tqdm(sabio_df.sabio_kinetic_law_id.unique()): + html_file = f'{sbml_data_dir}/kl_html/{klid}.html' + if not os.path.exists(html_file): + kls_to_download.add(klid) + +outputs = Parallel(n_jobs=30, verbose=5)(delayed(download_sabio_kl)(kl) for kl in kls_to_download) + +def download_sabio_cid(cid): + r = requests.get(f'https://sabiork.h-its.org/compdetails.jsp?cid={cid}') + if r.status_code==200: + html_string = r.text + f = open(f'{sbml_data_dir}/cid_html/{cid}.html','w') + f.write(html_string) + f.close() + return True + else: + return False + os.path.exists(html_file) + +klids_regulated = [] +name_to_cid = {} +for klid in tqdm(sabio_df.sabio_kinetic_law_id.unique()): + html_file = f'{sbml_data_dir}/kl_html/{klid}.html' + try: + with open(html_file) as f: + html_text = f.read() + name_to_cid.update(get_name_to_cid(html_text)) + if has_regulator(html_text): klids_regulated.append(klid) + except: + continue + +cids_to_download = set() +for name, cid in name_to_cid.items(): + html_file = f'{sbml_data_dir}/cid_html/{cid}.html' + if not os.path.exists(html_file): + cids_to_download.add(cid) + +outputs = Parallel(n_jobs=30, verbose=5)(delayed(download_sabio_cid)(cid) for cid in cids_to_download) + +for klid in tqdm(sabio_df.sabio_kinetic_law_id.unique()): + html_file = f'{sbml_data_dir}/kl_html/{klid}.html' + try: + with open(html_file) as f: + html_text = f.read() + name_to_cid.update(get_name_to_cid(html_text)) + if has_regulator(html_text): klids_regulated.append(klid) + except: + continue + +regulated_col = [] +for klid in sabio_df.sabio_kinetic_law_id: + if klid in klids_regulated: regulated_col.append(True) + else: regulated_col.append(None) + +sabio_df['has_regulator'] = regulated_col + +all_metabolite_names = set() +name_to_smiles = {} +name_to_inchi = {} +nosmi_names = set() + +for reactants, products,species in zip(sabio_df.reactant_names,sabio_df.product_names,sabio_df.param_species_name): + for each in reactants+products: + if not pd.isna(each): all_metabolite_names.add(each) + if not pd.isna(species): all_metabolite_names.add(species) + +def inchi_to_smiles(inchi): + smi = Chem.MolToSmiles(Chem.MolFromInchi(inchi)) + return smi if not smi is None else 'None' + +for name in tqdm(all_metabolite_names): + if name in name_to_cid: + cid = name_to_cid[name] + else: + nosmi_names.add(name) + continue + html_file = f'{sbml_data_dir}/cid_html/{cid}.html' + with open(html_file) as f: + html_text = f.read() + inchi, smiles = get_inchi_smiles(html_text) + if smiles: name_to_smiles[name] = smiles[0] + if inchi: name_to_inchi[name] = inchi[0] + +for name, inchi in name_to_inchi.items(): + if name in name_to_smiles: continue + name_to_smiles[name] = inchi_to_smiles(inchi) + +name_to_smiles_can = {} +for name,smi in tqdm(name_to_smiles.items()): + if pd.isna(smi): + continue + else: + try: + name_to_smiles_can[name] = Chem.MolToSmiles(Chem.MolFromSmiles(smi)) + except: + name_to_smiles_can[name] = None + +name_to_smiles = name_to_smiles_can.copy() +metabolite_inchi_smiles_dic = pd.read_csv(f'{sbml_data_dir}/metabolite_inchi_smiles_brenda_pubchem.tsv',sep='\t', + index_col='metabolite') +for name,smi in tqdm(name_to_smiles.items()): + if pd.isna(smi): + if name in metabolite_inchi_smiles_dic.index: + name_to_smiles[name] = metabolite_inchi_smiles_dic.loc[name].smiles + +reac_smiles_col = [] +prod_smiles_col = [] +param_species_smiles_col = [] + +for reactants, products,param_species in zip(sabio_df.reactant_names,sabio_df.product_names,sabio_df.param_species_name): + reac_smiles = [] + prod_smiles = [] + for reac in reactants: + if pd.isna(reac): + smi = None + elif not reac in name_to_smiles: + nosmi_names.add(reac) + smi = None + else: + smi = name_to_smiles[reac] + reac_smiles.append(smi) + reac_smiles_col.append(reac_smiles) + for prod in products: + if pd.isna(prod): + smi = None + elif not prod in name_to_smiles: + nosmi_names.add(prod) + smi = None + else: + smi = name_to_smiles[prod] + prod_smiles.append(smi) + prod_smiles_col.append(prod_smiles) + if param_species in name_to_smiles: + smi = name_to_smiles[param_species] + else: + nosmi_names.add(param_species) + smi = None + param_species_smiles_col.append(smi) + +sabio_df['reactant_smiles'] = reac_smiles_col +sabio_df['product_smiles'] = prod_smiles_col +sabio_df['param_species_smiles'] = param_species_smiles_col +print(sabio_df.columns) + +f = open(f'{sbml_data_dir}/pubchem_nosmiles.txt','w') +for sub in nosmi_names: + if not pd.isna(sub):f.write(sub+'\n') +f.close() + +# get substrate to smiles mapping from https://pubchem.ncbi.nlm.nih.gov/idexchange/idexchange.cgi + +sub_to_smiles_data = open(f'{sbml_data_dir}/pubchem_sub_to_smiles.txt').read() +lines = sub_to_smiles_data.split('\n') +for line in lines: + if not line.strip(): continue + sub, smi = line.split('\t') + if smi: name_to_smiles[sub] = smi + +smi_to_mw_dic = {} +for smi in tqdm(name_to_smiles.values()): + mw = None + try: + mol = Chem.MolFromSmiles(smi) + mw = Descriptors.MolWt(mol) + except: + pass + smi_to_mw_dic[smi] = mw + +def sum_mwts(smis): + mw = 0 + for smi in smis: + mw+=smi_to_mw_dic[smi] + return mw + +mwdiff_col = [] +mw_col = [] +reaction_smiles_col = [] +param_species_smiles_col = [] + +for reactants, products,param_species, rst, pst in zip(sabio_df.reactant_names,sabio_df.product_names,sabio_df.param_species_name, sabio_df.reactant_stoichiometry, sabio_df.product_stoichiometry): + rxnsmi_now = None + mwdiff_now = None + mw_now = None + sminow = None + reac_smiles = [] + prod_smiles = [] + + if len(reactants)!=rst: + rst = [1]*len(reactants) + if len(products)!=pst: + pst = [1]*len(products) + + for reac,r in zip(reactants,rst): + if pd.isna(reac): + continue + elif not reac in name_to_smiles: + continue + elif not name_to_smiles[reac] is None: + try: + smi = '.'.join([name_to_smiles[reac]]*r) + except: + pass + reac_smiles.append(smi) + + reac_smiles_col.append(reac_smiles) + for prod,p in zip(products,pst): + if pd.isna(prod): + continue + elif not prod in name_to_smiles: + continue + elif not name_to_smiles[prod] is None: + try: + smi = '.'.join([name_to_smiles[prod]]*p) + except: + continue + prod_smiles.append(smi) + + prod_smiles_col.append(prod_smiles) + try: + reac_mw = sum_mwts(reac_smiles) + except: + reac_mw = None + + try: + prod_mw = sum_mwts(prod_smiles) + except: + prod_mw = None + + reacsmis_ = [] + for smi in reac_smiles: + if pd.isna(smi): + continue + else: + reacsmis_.append(smi) + prodsmis_ = [] + for smi in prod_smiles: + if pd.isna(smi): + continue + else: + prodsmis_.append(smi) + + rxnsmi_now = f'{".".join(reacsmis_)}>>{".".join(prodsmis_)}' + + if pd.isna(reac_mw) or pd.isna(prod_mw): + mwdiff_now = 100000 + mw_now = 0 + else: + rxnsmi_now = f'{".".join(reac_smiles)}>>{".".join(prod_smiles)}' + mwdiff_now = abs(reac_mw-prod_mw) + mw_now = reac_mw + prod_mw + + if param_species in name_to_smiles: + sminow = name_to_smiles[param_species] + + mwdiff_col.append(mwdiff_now) + mw_col.append(mw_now) + reaction_smiles_col.append(rxnsmi_now) + param_species_smiles_col.append(sminow) + +sabio_df['reaction_smiles'] = reaction_smiles_col +sabio_df['reaction_mw_difference'] = mwdiff_col +sabio_df['reaction_mw'] = mw_col +sabio_df['param_species_smiles'] = param_species_smiles_col +sabio_df = sabio_df[sabio_df.param_name.isin(['kcat','Km','Ki','kcat_Km'])] + +sabio_df.drop(columns=['reactant_species','product_species','reactant_stoichiometry','product_stoichiometry','reactant_names','product_names','reactant_smiles','product_smiles'],inplace=True) + +n_uniprot_col = [] +for ind, row in sabio_df.iterrows(): + try: + unis = row.uniprot.split(';') + n_uniprot_col.append(len(unis)) + except: + n_uniprot_col.append(0) + +sabio_df['N_uniprot'] = n_uniprot_col + +seqcol = [] +uniset = set() +for uni in sabio_df.uniprot: + if pd.isna(uni): continue + else: + unis = uni.split(';') + for each in unis: + uniset.add(each) + +def _get_sequence(uni): + r = requests.get(f'https://rest.uniprot.org/uniprotkb/{uni}.fasta') + if r.status_code==200: + lines = r.text.split('\n') + seq = ''.join(lines[1:]) + return seq + +outputs = Parallel(n_jobs=30, verbose=5)(delayed(_get_sequence)(uni) for uni in uniset) +uni_to_seq = {} +for uni, seq in zip(uniset, outputs): + uni_to_seq[uni] = seq + +seqrow = [] +for ind, row in tqdm(sabio_df.iterrows()): + uni = row.uniprot + if pd.isna(uni): + seqrow.append(None) + else: + unis = row.uniprot.split(';') + seqs = [] + for uni in unis: + if uni in uni_to_seq: seqs.append(uni_to_seq[uni]) + else: continue + if len(seqs)>0: + set_seqs = set() + for s in seqs: + if not pd.isna(s): set_seqs.add(s) + seqrow.append(';'.join(set_seqs)) + else: + seqrow.append(None) + +sabio_df['sequence'] = seqrow +sabio_df['sequence_source'] = 'sabio' + +noseq_pairs = [] +for ind, row in sabio_df.iterrows(): + seq = row.sequence + if pd.isna(seq) or seq.strip()=='': + noseq_pairs.append(row.taxonomy_id+'__'+row.ec) +noseq_pairs = set(noseq_pairs) +noseq_tax_ec = [] +for each in noseq_pairs: + tax, ec = each.split('__') + noseq_tax_ec.append((tax, ec)) + +def get_url(taxid,ec): + return f"https://rest.uniprot.org/uniprotkb/stream?fields=accession%2Cid%2Csequence&format=tsv&query=%28%28organism_id%3A{taxid}%29+AND+%28ec%3A{ec}%29%29" + +import requests +def fetch_and_process(items): + ec,tax = items + url = get_url(ec, tax) + key = f'{tax}__{ec}.tsv' + keydir = f'{args.processed_dir}/tax_ec_seqdata/' + if not os.path.exists(keydir): os.mkdir(keydir) + failed = False + dic = {} + if os.path.exists(keydir+key): + _df = pd.read_csv(keydir+key, sep='\t') + else: + r = requests.get(url) + if r.status_code==200: + text = r.text + try: + f = open(keydir + key, 'w') + f.write(text) + f.close() + except: + pass + _df = pd.read_csv(keydir+key, sep='\t') + else: + failed = True + if not failed: + for entry, seq in zip(_df.Entry, _df.Sequence): + dic[entry] = seq + + return dic + +noseq_tax_ec = list(noseq_tax_ec) +seq_dicts = Parallel(n_jobs=30, verbose=100)(delayed(fetch_and_process)(items) for items in noseq_tax_ec) + +tax_ec_seqs_dict = {} + +for (tax,ec), seqs in zip(noseq_tax_ec, seq_dicts): + tax_ec_seqs_dict[str(tax)+'__'+ec] = seqs + +f = open(f'{args.processed_dir}/tax_ec_seqs_dict.json','w') +f.write(json.dumps(tax_ec_seqs_dict,indent=True)) +f.close() + +seqrow = [] +srcrow = [] +unirow = [] +for ind, row in tqdm(sabio_df.iterrows()): + seq = row.sequence + src = row.sequence_source + uni = row.uniprot + if pd.isna(seq) and not pd.isna(row.taxonomy_id): + tax = str(row.taxonomy_id) + ec = str(row.ec) + pair = tax+'__'+ec + if pair in tax_ec_seqs_dict: + seq_dict = tax_ec_seqs_dict[pair] + if len(seq_dict)>0: + unis = [] + seqs = [] + for uni, seq in seq_dict.items(): + unis.append(uni) + seqs.append(seq) + seqrow.append(';'.join(seqs)) + unirow.append(';'.join(unis)) + srcrow.append('uniprot_search') + else: + seqrow.append(seq) + unirow.append(uni) + srcrow.append('sabio') + else: + seqrow.append(seq) + unirow.append(uni) + srcrow.append('sabio') + +sabio_df['uniprot'] = unirow +sabio_df['sequence'] = seqrow +sabio_df['sequence_source'] = srcrow + +nseq_col = [] +for ind, row in tqdm(sabio_df.iterrows()): + if pd.isna(row.sequence): + nseq_col.append(0) + seqcol.append(None) + else: + seqs = row.sequence.split(';') + nseq_col.append(len(seqs)) + +sabio_df['n_sequence'] = nseq_col + +print(sabio_df.columns) + +dfseq1 = sabio_df[sabio_df.n_sequence==1] +dfseq1.reset_index(inplace=True, drop=True) +dfseq1.to_csv(f'{args.processed_dir}/sabio_processed_wt_singleSeqs.csv') + +dfseq2 = sabio_df[sabio_df.n_sequence>=1] +dfseq2.reset_index(inplace=True, drop=True) +dfseq2.to_csv(f'{args.processed_dir}/sabio_processed_wt_multipleSeqs.csv') + +sabio_df.to_csv(out_path)