diff --git "a/datasets/splits/kcat-random_val.csv" "b/datasets/splits/kcat-random_val.csv"
new file mode 100644--- /dev/null
+++ "b/datasets/splits/kcat-random_val.csv"
@@ -0,0 +1,2089 @@
+,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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+21,7453,7575,MANEVIKCKAAVAWEAGKPLSIEEIEVAPPKAHEVRIKIIATAVCHTDAYTLSGADPEGCFPVILGHEGAGIVESVGEGVTKLKAGDTVIPLYIPQCGECKFCLNPKTNLCQKIRVTQGKGLMPDGTSRFTCKGKTILHYMGTSTFSEYTVVADISVAKIDPLAPLDKVCLLGCGISTGYGAAVNTAKLEPGSVCAVFGLGGVGLAVIMGCKVAGASRIIGVDINKDKFARAKEFGATECINPQDFSKPIQEVLIEMTDGGVDYSFECIGNVKVMRAALEACHKGWGVSVVVGVAASGEEIATRPFQLVTGRTWKGTAFGGWKSVESVPKLVSEYMSKKIKVDEFVTHNLSFDEINKAFELMHSGKSIRTVVKI,sabio,P11766,CCCCCCCCCCCCO.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>>CCCCCCCCCCCC=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],1080.0,6.677429187069309e-15,25.0,10.0,1.1.1.1,9606.0,3.03342375548695,CCCCCCCCCCCCO.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,CCCCCCCCCCCC=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],3.03342375548695,CCCCCCCCCCCCO.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__MANEVIKCKAAVAWEAGKPLSIEEIEVAPPKAHEVRIKIIATAVCHTDAYTLSGADPEGCFPVILGHEGAGIVESVGEGVTKLKAGDTVIPLYIPQCGECKFCLNPKTNLCQKIRVTQGKGLMPDGTSRFTCKGKTILHYMGTSTFSEYTVVADISVAKIDPLAPLDKVCLLGCGISTGYGAAVNTAKLEPGSVCAVFGLGGVGLAVIMGCKVAGASRIIGVDINKDKFARAKEFGATECINPQDFSKPIQEVLIEMTDGGVDYSFECIGNVKVMRAALEACHKGWGVSVVVGVAASGEEIATRPFQLVTGRTWKGTAFGGWKSVESVPKLVSEYMSKKIKVDEFVTHNLSFDEINKAFELMHSGKSIRTVVKI,./data/raw/alphafold//AF-P11766-F1-model_v4.pdb,1323,2177,273,298
+22,4760,4819,MDAMKRGLCCVLLLCGAVFVSPSQEIHARFRRGARSYQVICRDEKTQMIYQQHQSWLRPVLRSNRVEYCWCNSGRAQCHSVPVKSCSEPRCFNGGTCQQALYFSDFVCQCPEGFAGKCCEIDTRATCYEDQGISYRGTWSTAESGAECTNWNSSALAQKPYSGRRPDAIRLGLGNHNYCRNPDRDSKPWCYVFKAGKYSSEFCSTPACSEGNSDCYFGNGSAYRGTHSLTESGASCLPWNSMILIGKVYTAQNPSAQALGLGKHNYCRNPDGDAKPWCHVLKNRRLTWEYCDVPSCSTCGLRQYSQPQFRIKGGLFADIASHPWQAAIFAKHRRSPGERFLCGGILISSCWILSAAHCFQERFPPHHLTVILGRTYRVVPGEEEQKFEVEKYIVHKEFDDDTYDNDIALLQLKSDSSRCAQESSVVRTVCLPPADLQLPDWTECELSGYGKHEALSPFYSERLKEAHVRLYPSSRCTSQHLLNRTVTDNMLCAGDTRSGGPQANLHDACQGDSGGPLVCLNDGRMTLVGIISWGLGCGQKDVPGVYTKVTNYLDWIRDNMRP,brenda,P00750,CC(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>CC(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,0.46,7.925155957633921e-15,25.0,7.675000000000001,3.4.21.68,9606.0,-0.3372421683184259,CC(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,CC(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,-0.3372421683184259,CC(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MDAMKRGLCCVLLLCGAVFVSPSQEIHARFRRGARSYQVICRDEKTQMIYQQHQSWLRPVLRSNRVEYCWCNSGRAQCHSVPVKSCSEPRCFNGGTCQQALYFSDFVCQCPEGFAGKCCEIDTRATCYEDQGISYRGTWSTAESGAECTNWNSSALAQKPYSGRRPDAIRLGLGNHNYCRNPDRDSKPWCYVFKAGKYSSEFCSTPACSEGNSDCYFGNGSAYRGTHSLTESGASCLPWNSMILIGKVYTAQNPSAQALGLGKHNYCRNPDGDAKPWCHVLKNRRLTWEYCDVPSCSTCGLRQYSQPQFRIKGGLFADIASHPWQAAIFAKHRRSPGERFLCGGILISSCWILSAAHCFQERFPPHHLTVILGRTYRVVPGEEEQKFEVEKYIVHKEFDDDTYDNDIALLQLKSDSSRCAQESSVVRTVCLPPADLQLPDWTECELSGYGKHEALSPFYSERLKEAHVRLYPSSRCTSQHLLNRTVTDNMLCAGDTRSGGPQANLHDACQGDSGGPLVCLNDGRMTLVGIISWGLGCGQKDVPGVYTKVTNYLDWIRDNMRP,./data/raw/alphafold//AF-P00750-F1-model_v4.pdb,2959,1698,3310,2111
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+24,16487,16715,MALADISGYLDVLDSVRGFSYLENAREVLRSGEARCLGNPRSEPEYVKALYVIGASRIPVGDGCSHTLEELGVFDISVPGEMVFPSPLDFFERGKPTPLVRSRLQLPNGVRVWLKLEWYNPFSLSVKDRPAVEIISRLSRRVEKGSLVADATSSNFGVALSAVARLYGYRARVYLPGAAEEFGKLLPRLLGAQVIVDPEAPSTVHLLPRVMKDSKNEGFVHVNQFYNDANFEAHMRGTAREIFVQSRRGGLALRGVAGSLGTSGHMSAAAFYLQSVDPSIRAVLVQPAQGDSIPGIRRVETGMLWINMLDISYTLAEVTLEEAMEAVVEVARSDGLVIGPSGGAAVKALAKKAAEGDLEPGDYVVVVPDTGFKYLSLVQNALEGAGDSV,sabio,Q9YBL2,NC(COP(=O)(O)O)C(=O)O.S>>NC(CS)C(=O)O.O=P(O)(O)O,14000.0,6.469624964240289e-15,85.0,7.6,2.5.1.47,56636.0,4.146128035678238,NC(COP(=O)(O)O)C(=O)O.S,NC(CS)C(=O)O.O=P(O)(O)O,4.146128035678238,NC(COP(=O)(O)O)C(=O)O.S__MALADISGYLDVLDSVRGFSYLENAREVLRSGEARCLGNPRSEPEYVKALYVIGASRIPVGDGCSHTLEELGVFDISVPGEMVFPSPLDFFERGKPTPLVRSRLQLPNGVRVWLKLEWYNPFSLSVKDRPAVEIISRLSRRVEKGSLVADATSSNFGVALSAVARLYGYRARVYLPGAAEEFGKLLPRLLGAQVIVDPEAPSTVHLLPRVMKDSKNEGFVHVNQFYNDANFEAHMRGTAREIFVQSRRGGLALRGVAGSLGTSGHMSAAAFYLQSVDPSIRAVLVQPAQGDSIPGIRRVETGMLWINMLDISYTLAEVTLEEAMEAVVEVARSDGLVIGPSGGAAVKALAKKAAEGDLEPGDYVVVVPDTGFKYLSLVQNALEGAGDSV,./data/raw/alphafold//AF-Q9YBL2-F1-model_v4.pdb,991,520,164,177
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+28,20180,20469,MITMAPHQNQFLLFIGVSLVLLSSYATANNSFNRSAFPDDFIFGASAAAYQYEGEANKSGRGPSVWDIFTHEYPEKITDRSNGDEAIDFYHRYKEDIQRMKNMNLDAFRFSISWTRIIPNGQISAGVNQEGIDFYNDLIDELISNGLEPFVTIFHWDSPQGLEDKYTGFLSRSIVKDFQDFAELCYKTFGDRVKYWTTFNEPRAYATRGYDSGLGAPGRCSEWVDRSCEAGNSATEPYIVSHHIILAHAAAVQVYRQKYQASQNGKIGITLNAYWYVPYSNNTVDEEAAQVAFDFFTGWHLDPITYGHYPRTMQALVGDRLPKFTEEEFMVIKGSYDFLGLNYYGAYYAYFNDHPDPNPLHKRYTTDSHVNTTGKRDGKPMGPQGTTSMFNIYPEGIRYLLNYTKDAYRNPTMYITENGYNQDDNGTVPMSILLNDTRRIIYYETHLENVLRSIKEYNVDVKGFIAWSFEDNFEWSSGYTQRFGLYYIDYKNHLERHAKNSTEWFTNFLQKNQSSTISEGSGSRWIRPFGYSIRSAAA,brenda,A0A023MIF8,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[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](O)[C@H]1O,7.95,0.0,37.0,4.6,3.2.1.21,28504.0,0.9003671286564703,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[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](O)[C@H]1O,0.9003671286564703,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1__MITMAPHQNQFLLFIGVSLVLLSSYATANNSFNRSAFPDDFIFGASAAAYQYEGEANKSGRGPSVWDIFTHEYPEKITDRSNGDEAIDFYHRYKEDIQRMKNMNLDAFRFSISWTRIIPNGQISAGVNQEGIDFYNDLIDELISNGLEPFVTIFHWDSPQGLEDKYTGFLSRSIVKDFQDFAELCYKTFGDRVKYWTTFNEPRAYATRGYDSGLGAPGRCSEWVDRSCEAGNSATEPYIVSHHIILAHAAAVQVYRQKYQASQNGKIGITLNAYWYVPYSNNTVDEEAAQVAFDFFTGWHLDPITYGHYPRTMQALVGDRLPKFTEEEFMVIKGSYDFLGLNYYGAYYAYFNDHPDPNPLHKRYTTDSHVNTTGKRDGKPMGPQGTTSMFNIYPEGIRYLLNYTKDAYRNPTMYITENGYNQDDNGTVPMSILLNDTRRIIYYETHLENVLRSIKEYNVDVKGFIAWSFEDNFEWSSGYTQRFGLYYIDYKNHLERHAKNSTEWFTNFLQKNQSSTISEGSGSRWIRPFGYSIRSAAA,./data/raw/alphafold//AF-A0A023MIF8-F1-model_v4.pdb,1219,3919,1757,3564
+29,13513,13690,MATFVELSTKAKMPIVGLGTWKSPLGKVKEAVKVAIDAGYRHIDCAYVYQNEHEVGEAIQEKIQEKAVKREDLFIVSKLWPTFFERPLVRKAFEKTLKDLKLSYLDVYLIHWPQGFKSGDDLFPKDDKGNAIGGKATFLDAWEAMEELVDEGLVKALGVSNFSHFQIEKLLNKPGLKYKPVTNQVECHPYLTQEKLIQYCHSKGITVTAYSPLGSPDRPWAKPEDPSLLEDPKIKEIAAKHKKTAAQVLIRFHIQRNVIVIPKSVTPARIVENIQVFDFKLSDEEMATILSFNRNWRACNVLQSSHLEDYPFNAEY,brenda,O60218,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=CCO.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.OCCO,0.58,7.043925086687856e-15,25.0,7.4,1.1.1.21,9606.0,-0.2365720064370627,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=CCO.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.OCCO,-0.2365720064370627,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=CCO.[H+]__MATFVELSTKAKMPIVGLGTWKSPLGKVKEAVKVAIDAGYRHIDCAYVYQNEHEVGEAIQEKIQEKAVKREDLFIVSKLWPTFFERPLVRKAFEKTLKDLKLSYLDVYLIHWPQGFKSGDDLFPKDDKGNAIGGKATFLDAWEAMEELVDEGLVKALGVSNFSHFQIEKLLNKPGLKYKPVTNQVECHPYLTQEKLIQYCHSKGITVTAYSPLGSPDRPWAKPEDPSLLEDPKIKEIAAKHKKTAAQVLIRFHIQRNVIVIPKSVTPARIVENIQVFDFKLSDEEMATILSFNRNWRACNVLQSSHLEDYPFNAEY,./data/raw/alphafold//AF-O60218-F1-model_v4.pdb,1329,607,647,301
+30,6980,7096,MFSAGHKIKGTVVLMPKNELEVNPDGSAVDNLNAFLGRSVSLQLISATKADAHGKGKVGKDTFLEGINTSLPTLGAGESAFNIHFEWDGSMGIPGAFYIKNYMQVEFFLKSLTLEAISNQGTIRFVCNSWVYNTKLYKSVRIFFANHTYVPSETPAPLVSYREEELKSLRGNGTGERKEYDRIYDYDVYNDLGNPDKSEKLARPVLGGSSTFPYPRRGRTGRGPTVTDPNTEKQGEVFYVPRDENLGHLKSKDALEIGTKSLSQIVQPAFESAFDLKSTPIEFHSFQDVHDLYEGGIKLPRDVISTIIPLPVIKELYRTDGQHILKFPQPHVVQVSQSAWMTDEEFAREMIAGVNPCVIRGLEEFPPKSNLDPAIYGDQSSKITADSLDLDGYTMDEALGSRRLFMLDYHDIFMPYVRQINQLNSAKTYATRTILFLREDGTLKPVAIELSLPHSAGDLSAAVSQVVLPAKEGVESTIWLLAKAYVIVNDSCYHQLMSHWLNTHAAMEPFVIATHRHLSVLHPIYKLLTPHYRNNMNINALARQSLINANGIIETTFLPSKYSVEMSSAVYKNWVFTDQALPADLIKRGVAIKDPSTPHGVRLLIEDYPYAADGLEIWAAIKTWVQEYVPLYYARDDDVKNDSELQHWWKEAVEKGHGDLKDKPWWPKLQTLEDLVEVCLIIIWIASALHAAVNFGQYPYGGLIMNRPTASRRLLPEKGTPEYEEMINNHEKAYLRTITSKLPTLISLSVIEILSTHASDEVYLGQRDNPHWTSDSKALQAFQKFGNKLKEIEEKLVRRNNDPSLQGNRLGPVQLPYTLLYPSSEEGLTFRGIPNSISI,sabio,P08170,CCCCCC=CCC=CCC=CCC=CCCCC(=O)O.O=O>>CCCCCC(C=CC=CCC=CCC=CCCCC(=O)O)OO,237.0,0.0,22.0,7.5,1.13.11.12,3847.0,2.374748346010104,CCCCCC=CCC=CCC=CCC=CCCCC(=O)O.O=O,CCCCCC(C=CC=CCC=CCC=CCCCC(=O)O)OO,2.531478917042256,CCCCCC=CCC=CCC=CCC=CCCCC(=O)O.O=O__MFSAGHKIKGTVVLMPKNELEVNPDGSAVDNLNAFLGRSVSLQLISATKADAHGKGKVGKDTFLEGINTSLPTLGAGESAFNIHFEWDGSMGIPGAFYIKNYMQVEFFLKSLTLEAISNQGTIRFVCNSWVYNTKLYKSVRIFFANHTYVPSETPAPLVSYREEELKSLRGNGTGERKEYDRIYDYDVYNDLGNPDKSEKLARPVLGGSSTFPYPRRGRTGRGPTVTDPNTEKQGEVFYVPRDENLGHLKSKDALEIGTKSLSQIVQPAFESAFDLKSTPIEFHSFQDVHDLYEGGIKLPRDVISTIIPLPVIKELYRTDGQHILKFPQPHVVQVSQSAWMTDEEFAREMIAGVNPCVIRGLEEFPPKSNLDPAIYGDQSSKITADSLDLDGYTMDEALGSRRLFMLDYHDIFMPYVRQINQLNSAKTYATRTILFLREDGTLKPVAIELSLPHSAGDLSAAVSQVVLPAKEGVESTIWLLAKAYVIVNDSCYHQLMSHWLNTHAAMEPFVIATHRHLSVLHPIYKLLTPHYRNNMNINALARQSLINANGIIETTFLPSKYSVEMSSAVYKNWVFTDQALPADLIKRGVAIKDPSTPHGVRLLIEDYPYAADGLEIWAAIKTWVQEYVPLYYARDDDVKNDSELQHWWKEAVEKGHGDLKDKPWWPKLQTLEDLVEVCLIIIWIASALHAAVNFGQYPYGGLIMNRPTASRRLLPEKGTPEYEEMINNHEKAYLRTITSKLPTLISLSVIEILSTHASDEVYLGQRDNPHWTSDSKALQAFQKFGNKLKEIEEKLVRRNNDPSLQGNRLGPVQLPYTLLYPSSEEGLTFRGIPNSISI,./data/raw/alphafold//AF-P08170-F1-model_v4.pdb,3283,2117,3786,2646
+31,16816,17046,MTKSALADTKEEPHVPFGEIQGYTPCGVPAYSNGHDGFFSGERSIDGNLFCGFKYQCVEFARRWLYEAKGLVLPDVNWAAHIFDLTEVHDASTATPVPCVKVSNGTAAKPVADSLLIYAVNEDAPWGHVAVITEVGDKWVRIADQNHRFHKWKGTYSAELLLKHEGSVWTVEDHAAEGIFVPLGWVTFPSRPNRNPKEPLVLHESLYFKQPEKPFLRRVVFTPENRKTDWLDLTNEAEAEFYKTFGKEATRGGVYESCYYLMNRELYLNCVRYGTQLHSFFLEATKQVLESDDKLRRFRIPEEYWPRIRHSWKTQPHAITGRFDFVFDENTQEFKCFEYNADSASTLLECAVIQEKWANSVGLDDNATRSSGKFMPQTLVRAWEMTGLKGRVHFLVDDDGEERYTALYVMEKAREAGIDAKLCVMFDEFHFDEKGAVVDSDGIPVTAVWKTWMWETAISDHQAAREQRGAEWKPTPKDKVRLCDILLGNNWDIRVFEPMWKLIPSNKAILPIIYNNHPDHPAILPASYELTDELRRTGYAKKPIVGRVGRNVTVTEPDGKVLAESDGNFSNRDMVYQQLFRIPKRGDYYAILGGWMLGDTYSGTGVREDKKLITGLESPFGPVRIQM,sabio,Q8IEX1,NCCCCNCCCNC(=O)CNC(=O)C(CS)NC(=O)CCC(N)C(=O)O.O>>NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O.NCCCCNCCCN,5.1,1.8819083754058243e-14,37.0,7.0,3.5.1.78,5691.0,0.7075701760979364,NCCCCNCCCNC(=O)CNC(=O)C(CS)NC(=O)CCC(N)C(=O)O.O,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O.NCCCCNCCCN,0.7075701760979364,NCCCCNCCCNC(=O)CNC(=O)C(CS)NC(=O)CCC(N)C(=O)O.O__MTKSALADTKEEPHVPFGEIQGYTPCGVPAYSNGHDGFFSGERSIDGNLFCGFKYQCVEFARRWLYEAKGLVLPDVNWAAHIFDLTEVHDASTATPVPCVKVSNGTAAKPVADSLLIYAVNEDAPWGHVAVITEVGDKWVRIADQNHRFHKWKGTYSAELLLKHEGSVWTVEDHAAEGIFVPLGWVTFPSRPNRNPKEPLVLHESLYFKQPEKPFLRRVVFTPENRKTDWLDLTNEAEAEFYKTFGKEATRGGVYESCYYLMNRELYLNCVRYGTQLHSFFLEATKQVLESDDKLRRFRIPEEYWPRIRHSWKTQPHAITGRFDFVFDENTQEFKCFEYNADSASTLLECAVIQEKWANSVGLDDNATRSSGKFMPQTLVRAWEMTGLKGRVHFLVDDDGEERYTALYVMEKAREAGIDAKLCVMFDEFHFDEKGAVVDSDGIPVTAVWKTWMWETAISDHQAAREQRGAEWKPTPKDKVRLCDILLGNNWDIRVFEPMWKLIPSNKAILPIIYNNHPDHPAILPASYELTDELRRTGYAKKPIVGRVGRNVTVTEPDGKVLAESDGNFSNRDMVYQQLFRIPKRGDYYAILGGWMLGDTYSGTGVREDKKLITGLESPFGPVRIQM,./data/raw/alphafold//AF-Q8IEX1-F1-model_v4.pdb,2638,5131,2259,5145
+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
+36,18762,19036,MAAVETRVCETDGCSSEAKLQCPTCIKLGIQGSYFCSQECFKGSWATHKLLHKKAKDEKAKREVSSWTVEGDINTDPWAGYRYTGKLRPHYPLMPTRPVPSYIQRPDYADHPLGMSESEQALKGTSQIKLLSSEDIEGMRLVCRLAREVLDVAAGMIKPGVTTEEIDHAVHLACIARNCYPSPLNYYNFPKSCCTSVNEVICHGIPDRRPLQEGDIVNVDITLYRNGYHGDLNETFFVGEVDDGARKLVQTTYECLMQAIDAVKPGVRYRELGNIIQKHAQANGFSVVRSYCGHGIHKLFHTAPNVPHYAKNKAVGVMKSGHVFTIEPMICEGGWQDETWPDGWTAVTRDGKRSAQFEHTLLVTDTGCEILTRRLDSARPHFMSQF,sabio,P53582,O>>CSCCC(N)C(=O)O.O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN1,1530.0,90.82218636686964,23.0,8.0,3.4.11.18,9606.0,3.184691430817599,O,CSCCC(N)C(=O)O.O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN1,3.184691430817599,O__MAAVETRVCETDGCSSEAKLQCPTCIKLGIQGSYFCSQECFKGSWATHKLLHKKAKDEKAKREVSSWTVEGDINTDPWAGYRYTGKLRPHYPLMPTRPVPSYIQRPDYADHPLGMSESEQALKGTSQIKLLSSEDIEGMRLVCRLAREVLDVAAGMIKPGVTTEEIDHAVHLACIARNCYPSPLNYYNFPKSCCTSVNEVICHGIPDRRPLQEGDIVNVDITLYRNGYHGDLNETFFVGEVDDGARKLVQTTYECLMQAIDAVKPGVRYRELGNIIQKHAQANGFSVVRSYCGHGIHKLFHTAPNVPHYAKNKAVGVMKSGHVFTIEPMICEGGWQDETWPDGWTAVTRDGKRSAQFEHTLLVTDTGCEILTRRLDSARPHFMSQF,./data/raw/alphafold//AF-P53582-F1-model_v4.pdb,3603,3573,1356,3314
+37,19782,20068,MKLASFDVWNTLLDINIMLDAMAVELSKLMGACIIDVVEGMMFTRERIKRMRAETAGDPTQALEESQKMLAELLGTEIEVVRRAAARAVLKVSDEIVLPGAREALESVKRKGLKVTVTGNVMFWPGSYTRLLLERFGLMEFVDRTFFADEVFAYKPMPEMFEKPLKAFGVEPGEAIHIGDTYAEDFEGALKMGMWAVWINPEAEEVKRIHERGFEVPSVEGILEVLGELEG,brenda,B6YSF3,O.O=P(O)(O)OP(=O)(O)O>>O=P(O)(O)O.O=P(O)(O)O,0.22,7.232428807460001e-15,80.0,6.5,3.6.1.1,342948.0,-0.6575773191777937,O.O=P(O)(O)OP(=O)(O)O,O=P(O)(O)O.O=P(O)(O)O,-0.6575773191777937,O.O=P(O)(O)OP(=O)(O)O__MKLASFDVWNTLLDINIMLDAMAVELSKLMGACIIDVVEGMMFTRERIKRMRAETAGDPTQALEESQKMLAELLGTEIEVVRRAAARAVLKVSDEIVLPGAREALESVKRKGLKVTVTGNVMFWPGSYTRLLLERFGLMEFVDRTFFADEVFAYKPMPEMFEKPLKAFGVEPGEAIHIGDTYAEDFEGALKMGMWAVWINPEAEEVKRIHERGFEVPSVEGILEVLGELEG,./data/raw/alphafold//AF-B6YSF3-F1-model_v4.pdb,352,2912,5245,6111
+38,4989,5067,MIHTNLKKKFSLFILVFLLFAVICVWKKGSDYEALTLQAKEFQMPKSQEKVAMGSASQVVFSNSKQDPKEDIPILSYHRVTAKVKPQPSFQVWDKDSTYSKLNPRLLKIWRNYLNMNKYKVSYKGPGPGVKFSVEALRCHLRDHVNVSMIEATDFPFNTTEWEGYLPKENFRTKVGPWQRCAVVSSAGSLKNSQLGREIDNHDAVLRFNGAPTDNFQQDVGSKTTIRLMNSQLVTTEKRFLKDSLYTEGILIVWDPSVYHADIPKWYQKPDYNFFETYKSYRRLNPSQPFYILKPQMPWELWDIIQEISADLIQPNPPSSGMLGIIIMMTLCDQVDIYEFLPSKRKTDVCYYHQKFFDSACTMGAYHPLLFEKNMVKHLNEGTDEDIYLFGKATLSGFRNIRC,brenda,P13721,CC(O)=N[C@H]1[C@H](OCCOCCNS(=O)(=O)c2cccc3c(N(C)C)cccc23)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.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>>CC(O)=N[C@H]1[C@H](OCCOCCNS(=O)(=O)c2cccc3c(N(C)C)cccc23)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO[C@]3(C(=O)O)C[C@H](O)[C@@H](N=C(C)O)[C@H]([C@H](O)[C@H](O)CO)O3)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O.N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1,1.13,0.0,37.0,6.5,2.4.99.1,10116.0,0.0530784434834196,CC(O)=N[C@H]1[C@H](OCCOCCNS(=O)(=O)c2cccc3c(N(C)C)cccc23)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.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,CC(O)=N[C@H]1[C@H](OCCOCCNS(=O)(=O)c2cccc3c(N(C)C)cccc23)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO[C@]3(C(=O)O)C[C@H](O)[C@@H](N=C(C)O)[C@H]([C@H](O)[C@H](O)CO)O3)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O.N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1,0.0530784434834196,CC(O)=N[C@H]1[C@H](OCCOCCNS(=O)(=O)c2cccc3c(N(C)C)cccc23)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.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__MIHTNLKKKFSLFILVFLLFAVICVWKKGSDYEALTLQAKEFQMPKSQEKVAMGSASQVVFSNSKQDPKEDIPILSYHRVTAKVKPQPSFQVWDKDSTYSKLNPRLLKIWRNYLNMNKYKVSYKGPGPGVKFSVEALRCHLRDHVNVSMIEATDFPFNTTEWEGYLPKENFRTKVGPWQRCAVVSSAGSLKNSQLGREIDNHDAVLRFNGAPTDNFQQDVGSKTTIRLMNSQLVTTEKRFLKDSLYTEGILIVWDPSVYHADIPKWYQKPDYNFFETYKSYRRLNPSQPFYILKPQMPWELWDIIQEISADLIQPNPPSSGMLGIIIMMTLCDQVDIYEFLPSKRKTDVCYYHQKFFDSACTMGAYHPLLFEKNMVKHLNEGTDEDIYLFGKATLSGFRNIRC,./data/raw/alphafold//AF-P13721-F1-model_v4.pdb,3007,1755,3374,2181
+39,15526,15750,MLSAASRVVSRAAVHCALRSPPPEARALAMSRPPPPRVASVLGTMEMGRRMDAPASAAAVRAFLERGHTELDTAFMYSDGQSETILGGLGLGLGGGDCRVKIATKANPWDGKSLKPDSVRSQLETSLKRLQCPQVDLFYLHAPDHGTPVEETLHACQRLHQEGKFVELGLSNYASWEVAEICTLCKSNGWILPTVYQGMYNATTRQVETELFPCLRHFGLRFYAYNPLAGGLLTGKYKYEDKDGKQPVGRFFGNSWAETYRNRFWKEHHFEAIALVEKALQAAYGASAPSVTSAALRWMYHHSQLQGAHGDAVILGMSSLEQLEQNLAATEEGPLEPAVVDAFNQAWHLVAHECPNYFR,sabio,O43488,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=Cc1cccc(Cl)c1.[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.OCc1cccc(Cl)c1,540.0,0.0,25.0,7.0,1.1.1.2,9606.0,2.7323937598229686,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=Cc1cccc(Cl)c1.[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.OCc1cccc(Cl)c1,2.7323937598229686,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=Cc1cccc(Cl)c1.[H]__MLSAASRVVSRAAVHCALRSPPPEARALAMSRPPPPRVASVLGTMEMGRRMDAPASAAAVRAFLERGHTELDTAFMYSDGQSETILGGLGLGLGGGDCRVKIATKANPWDGKSLKPDSVRSQLETSLKRLQCPQVDLFYLHAPDHGTPVEETLHACQRLHQEGKFVELGLSNYASWEVAEICTLCKSNGWILPTVYQGMYNATTRQVETELFPCLRHFGLRFYAYNPLAGGLLTGKYKYEDKDGKQPVGRFFGNSWAETYRNRFWKEHHFEAIALVEKALQAAYGASAPSVTSAALRWMYHHSQLQGAHGDAVILGMSSLEQLEQNLAATEEGPLEPAVVDAFNQAWHLVAHECPNYFR,./data/raw/alphafold//AF-O43488-F1-model_v4.pdb,3137,1923,3565,2394
+40,2698,2735,MVFVIGITGRICSGKSTLSKTLIKRKIPVIDCDKLGHELYQKGSIVYNDFIKLFGKEVVGVDGSIDRKKLSELVFSNPQNVKIISDLTWPAIYTLLQERIKVLEKEGHPIVGVEAALLIRANWSIVNVIWETRIDEAETIKRLKTRNGLSEEQAKKRIQSQPTQEEYDNKSQVQINTMGTIEETATLINKEVDKLLEQLKITLN,brenda,C4LWC7,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O)[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>>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)O)[C@@H](O)[C@H]1O,0.96,9.511600787924143e-15,37.0,8.0,2.7.1.24,5759.0,-0.0177287669604316,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O)[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,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)O)[C@@H](O)[C@H]1O,-0.0177287669604316,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O)[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__MVFVIGITGRICSGKSTLSKTLIKRKIPVIDCDKLGHELYQKGSIVYNDFIKLFGKEVVGVDGSIDRKKLSELVFSNPQNVKIISDLTWPAIYTLLQERIKVLEKEGHPIVGVEAALLIRANWSIVNVIWETRIDEAETIKRLKTRNGLSEEQAKKRIQSQPTQEEYDNKSQVQINTMGTIEETATLINKEVDKLLEQLKITLN,./data/raw/alphafold//AF-C4LWC7-F1-model_v4.pdb,1654,1259,4534,1477
+41,13832,14012,MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,uniprot_search,P24155,N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)Cc1ccccc1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].Nc1ccccc1C(O)=NCC(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCC(=O)O)C(=O)O,1.5,1.8702353482769224e-14,37.0,7.4,3.4.24.15,10116.0,0.1760912590556812,N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)Cc1ccccc1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].Nc1ccccc1C(O)=NCC(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCC(=O)O)C(=O)O,0.1760912590556812,N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,./data/raw/alphafold//AF-P24155-F1-model_v4.pdb,1820,1500,3134,1830
+42,15762,15989,MLLHFSPAKPLISPPNLRRNSPTFLISPPRSLRIRAIDAAQIFDYETQLKSEYRKSSALKIAVLGFGNFGQFLSKTLIRHGHDLITHSRSDYSDAANSIGARFFDNPHDLCEQHPDVVLLCTSILSTESVLRSFPFQRLRRSTLFVDVLSVKEFPKALFIKYLPKEFDILCTHPMFGPESGKHSWSGLPFVYDKVRIGDAASRQERCEKFLRIFENEGCKMVEMSCEKHDYYAAGSQFVTHTMGRVLEKYGVESSPINTKGYETLLDLVENTSSDSFELFYGLFMYNPNALEQLERLDMAFESVKKELFGRLHQQYRKQMFGGEVQSPKKTEQKLLNDGGVVPMNDISSSSSSSSSSS,sabio,Q9LMR3,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(CC1(C(=O)O)C=CC(O)C=C1)C(=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(Cc1ccc(O)cc1)C(=O)O.O=C=O.[H],37.3,5.847288268252183e-15,25.0,7.5,1.3.1.78,3702.0,1.5717088318086876,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(CC1(C(=O)O)C=CC(O)C=C1)C(=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(Cc1ccc(O)cc1)C(=O)O.O=C=O.[H],1.5717088318086876,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(CC1(C(=O)O)C=CC(O)C=C1)C(=O)O__MLLHFSPAKPLISPPNLRRNSPTFLISPPRSLRIRAIDAAQIFDYETQLKSEYRKSSALKIAVLGFGNFGQFLSKTLIRHGHDLITHSRSDYSDAANSIGARFFDNPHDLCEQHPDVVLLCTSILSTESVLRSFPFQRLRRSTLFVDVLSVKEFPKALFIKYLPKEFDILCTHPMFGPESGKHSWSGLPFVYDKVRIGDAASRQERCEKFLRIFENEGCKMVEMSCEKHDYYAAGSQFVTHTMGRVLEKYGVESSPINTKGYETLLDLVENTSSDSFELFYGLFMYNPNALEQLERLDMAFESVKKELFGRLHQQYRKQMFGGEVQSPKKTEQKLLNDGGVVPMNDISSSSSSSSSSS,./data/raw/alphafold//AF-Q9LMR3-F1-model_v4.pdb,2585,5051,2153,5025
+43,12509,12679,MNKGLHRKRLSKRLLLPMLLCLLAQQTQAVAAEQTKVSDVCSEVTAEGWQEVRRWDKLFESAGVKGSLLLWDQKRSLGLSNNLSRAAEGFIPASTFKLPSSLIALETGAVRDETSRFSWDGKVREIAVWNRDQSFRTAMKYSVVPVYQQLAREIGPKVMAAMVRQLEYGNQDIGGQADSFWLDGQLRITAFQQVDFLRQLHDNKLPVSERSQRIVKQMMLTEASTDYIIRAKTGYGVRRTPAIGWWVGWLELDDNTVYFAVNLDLASASQLPLRQQLVKQVLKQEQLLP,sabio,Q6VCW0,Cc1onc(-c2ccccc2)c1C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O.O>>,5.0,99.76216468193093,30.0,7.0,3.5.2.6,38313.0,0.6989700043360189,Cc1onc(-c2ccccc2)c1C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O.O,,0.6989700043360189,Cc1onc(-c2ccccc2)c1C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O.O__MNKGLHRKRLSKRLLLPMLLCLLAQQTQAVAAEQTKVSDVCSEVTAEGWQEVRRWDKLFESAGVKGSLLLWDQKRSLGLSNNLSRAAEGFIPASTFKLPSSLIALETGAVRDETSRFSWDGKVREIAVWNRDQSFRTAMKYSVVPVYQQLAREIGPKVMAAMVRQLEYGNQDIGGQADSFWLDGQLRITAFQQVDFLRQLHDNKLPVSERSQRIVKQMMLTEASTDYIIRAKTGYGVRRTPAIGWWVGWLELDDNTVYFAVNLDLASASQLPLRQQLVKQVLKQEQLLP,./data/raw/alphafold//AF-Q6VCW0-F1-model_v4.pdb,1244,973,780,1086
+44,16770,17000,MSSFTKDEFDCHILDEGFTAKDILDQKINEVSSSDDKDAFYVADLGDILKKHLRWLKALPRVTPFYAVKCNDSRAIVSTLAAIGTGFDCASKTEIQLVQGLGVPAERVIYANPCKQVSQIKYAASNGVQMMTFDSEIELMKVARAHPKAKLVLRIATDDSKAVCRLSVKFGATLKTSRLLLERAKELNIDVIGVSFHVGSGCTDPETFVQAVSDARCVFDMATEVGFSMHLLDIGGGFPGSEDTKLKFEEITSVINPALDKYFPSDSGVRIIAEPGRYYVASAFTLAVNIIAKKTVWKEQPGSDDEDESNEQTFMYYVNDGVYGSFNCILYDHAHVKALLQKRPKPDEKYYSSSIWGPTCDGLDRIVERCNLPEMHVGDWMLFENMGAYTVAAASTFNGFQRPNIYYVMSRPMWQLMKQIQSHGFPPEVEEQDDGTLPMSCAQESGMDRHPAACASARINV,sabio,P00860,NCCCCC(N)C(=O)O>>NCCCCCN.O=C=O,1.8,0.0,37.0,8.0,4.1.1.17,10090.0,0.255272505103306,NCCCCC(N)C(=O)O,NCCCCCN.O=C=O,0.255272505103306,NCCCCC(N)C(=O)O__MSSFTKDEFDCHILDEGFTAKDILDQKINEVSSSDDKDAFYVADLGDILKKHLRWLKALPRVTPFYAVKCNDSRAIVSTLAAIGTGFDCASKTEIQLVQGLGVPAERVIYANPCKQVSQIKYAASNGVQMMTFDSEIELMKVARAHPKAKLVLRIATDDSKAVCRLSVKFGATLKTSRLLLERAKELNIDVIGVSFHVGSGCTDPETFVQAVSDARCVFDMATEVGFSMHLLDIGGGFPGSEDTKLKFEEITSVINPALDKYFPSDSGVRIIAEPGRYYVASAFTLAVNIIAKKTVWKEQPGSDDEDESNEQTFMYYVNDGVYGSFNCILYDHAHVKALLQKRPKPDEKYYSSSIWGPTCDGLDRIVERCNLPEMHVGDWMLFENMGAYTVAAASTFNGFQRPNIYYVMSRPMWQLMKQIQSHGFPPEVEEQDDGTLPMSCAQESGMDRHPAACASARINV,./data/raw/alphafold//AF-P00860-F1-model_v4.pdb,2175,4395,4294,4169
+45,10302,10454,MTDKIAVLLGGTSAEREVSLNSGAAVLAGLREGGIDAYPVDPKEVDVTQLKSMGFQKVFIALHGRGGEDGTLQGMLELMGLPYTGSGVMASALSMDKLRSKLLWQGAGLPVAPWVALTRAEFEKGLSDKQLAEISALGLPVIVKPSREGSSVGMSKVVAENALQDALRLAFQHDEEVLIEKWLSGPEFTVAILGEEILPSIRIQPSGTFYDYEAKYLSDETQYFCPAGLEASQEANLQALVLKAWTTLGCKGWGRIDVMLDSDGQFYLLEANTSPGMTSHSLVPMAARQAGMSFSQLVVRILELAD,brenda,P07862,C[C@@H](N)C(=O)O.C[C@@H](N)C(=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@@H](N)C(O)=N[C@H](C)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,26.7,0.0,37.0,9.2,6.3.2.4,562.0,1.4265112613645752,C[C@@H](N)C(=O)O.C[C@@H](N)C(=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@@H](N)C(O)=N[C@H](C)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,1.4265112613645752,C[C@@H](N)C(=O)O.C[C@@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MTDKIAVLLGGTSAEREVSLNSGAAVLAGLREGGIDAYPVDPKEVDVTQLKSMGFQKVFIALHGRGGEDGTLQGMLELMGLPYTGSGVMASALSMDKLRSKLLWQGAGLPVAPWVALTRAEFEKGLSDKQLAEISALGLPVIVKPSREGSSVGMSKVVAENALQDALRLAFQHDEEVLIEKWLSGPEFTVAILGEEILPSIRIQPSGTFYDYEAKYLSDETQYFCPAGLEASQEANLQALVLKAWTTLGCKGWGRIDVMLDSDGQFYLLEANTSPGMTSHSLVPMAARQAGMSFSQLVVRILELAD,./data/raw/alphafold//AF-P07862-F1-model_v4.pdb,3648,3635,1427,3389
+46,7603,7725,MLRRASLPHRKTTRRSFVAAALLLAFAAPAAPAVAADSPGRSAVESPAPTTRQPLGTKTLHLVDTSRPDPWKPSAGHRELMVSLWYPALPSRSDRAPYMSAALSKAMLGSEVLSGVRTHAVAGARPAPVARPLVVLSPGFQMSRLTLTALGEDLASRGYAVAALDHTYEAPVEFPGGRVEPCLICEKPDLNAVVRNRAQDIRFLLDRLTGPGGELRVDRHRIAVVGHSIGGASAVETMREDPRVGAAVNLDGDFFLDPPAKGLNRPVLLLGAQRGRDTEDSRGDWERNWPHLTGWKRWLDVPDGGHMTFTDVPWIVDRFGRPAQIPPEQVPGQFGTLGGARATALTRAYVAAFLDRQLRGRPSPLLDRPSTAYPEVTILK,brenda,A0A1E1FNX1,CCCCO.COC(=O)/C=C/c1cc(OC)c(O)c(OC)c1>>CCCCOC(=O)C=Cc1cc(OC)c(O)c(OC)c1.CO,0.0008,0.0,,6.5,3.1.1.73,1827093.0,-3.096910013008056,CCCCO.COC(=O)/C=C/c1cc(OC)c(O)c(OC)c1,CCCCOC(=O)C=Cc1cc(OC)c(O)c(OC)c1.CO,-3.096910013008056,CCCCO.COC(=O)/C=C/c1cc(OC)c(O)c(OC)c1__MLRRASLPHRKTTRRSFVAAALLLAFAAPAAPAVAADSPGRSAVESPAPTTRQPLGTKTLHLVDTSRPDPWKPSAGHRELMVSLWYPALPSRSDRAPYMSAALSKAMLGSEVLSGVRTHAVAGARPAPVARPLVVLSPGFQMSRLTLTALGEDLASRGYAVAALDHTYEAPVEFPGGRVEPCLICEKPDLNAVVRNRAQDIRFLLDRLTGPGGELRVDRHRIAVVGHSIGGASAVETMREDPRVGAAVNLDGDFFLDPPAKGLNRPVLLLGAQRGRDTEDSRGDWERNWPHLTGWKRWLDVPDGGHMTFTDVPWIVDRFGRPAQIPPEQVPGQFGTLGGARATALTRAYVAAFLDRQLRGRPSPLLDRPSTAYPEVTILK,./data/raw/alphafold//AF-A0A1E1FNX1-F1-model_v4.pdb,3337,2196,3882,2752
+47,20639,20946,MTVDKVKLVIDSDGVSDDVRAISLALQHPKAEILAFTAVHGCVTVDQACANIKRTIRANDRSNIPVYKGAAKSILSLPKDDTVSDFFGIDGIGDKPEEFPKVERSDFEGEGKHASLALIDILRENRDATLVTIGPLTNVAIALQLCEEFSTYPSRLVIMGGNYYAVGNVDGGSSAEYNFHGDPEAASIVLRRMKCPITIVPWEAFYFESKTHDASVDFSAHLKYGTPLANYLSLATSIGRVKCEANGRQYSYCDEIAVATAIDEDKIAKKSQYLYVDVELNGTKTRGQVVVDWTEQLWSNEEAPNQHTHRRVKFVTSYDVHTVDKWLHAATSGSGKFD,uniprot_search,Q9XWN7,O.OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O>>OC[C@H]1OC(O)[C@H](O)[C@@H]1O.Oc1nc(O)c2nc[nH]c2n1,0.029,0.0,25.0,7.5,3.2.2.1,6239.0,-1.537602002101044,O.OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O,OC[C@H]1OC(O)[C@H](O)[C@@H]1O.Oc1nc(O)c2nc[nH]c2n1,-1.537602002101044,O.OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O__MTVDKVKLVIDSDGVSDDVRAISLALQHPKAEILAFTAVHGCVTVDQACANIKRTIRANDRSNIPVYKGAAKSILSLPKDDTVSDFFGIDGIGDKPEEFPKVERSDFEGEGKHASLALIDILRENRDATLVTIGPLTNVAIALQLCEEFSTYPSRLVIMGGNYYAVGNVDGGSSAEYNFHGDPEAASIVLRRMKCPITIVPWEAFYFESKTHDASVDFSAHLKYGTPLANYLSLATSIGRVKCEANGRQYSYCDEIAVATAIDEDKIAKKSQYLYVDVELNGTKTRGQVVVDWTEQLWSNEEAPNQHTHRRVKFVTSYDVHTVDKWLHAATSGSGKFD,./data/raw/alphafold//AF-Q9XWN7-F1-model_v4.pdb,1909,4044,1897,3725
+48,7102,7223,MAAALRRGYKVLRSVSHFECRAQHTKPSLKQEPGLGFSFELTEQQKEFQTIARKFAREEIIPVAPDYDKSGEYPFPLIKRAWELGLINTHIPESCGGLGLGTFDACLITEELAYGCTGVQTAIEANSLGQMPVIIAGNDQQKKKYLGRMTEQPMMCAYCVTEPSAGSDVAGIKTKAEKKGDEYVINGQKMWITNGGKANWYFVLTRSNPDPKVPASKAFTGFIVEADTPGIHIGKKELNMGQRCSDTRGITFEDVRVPKENVLIGEGAGFKIAMGAFDRTRPTVAAGAVGLAQRALDEATKYALDRKTFGKLLVEHQGVSFLLAEMAMKVELARLSYQRAAWEVDSGRRNTYFASIAKAFAGDIANQLATDAVQIFGGYGFNTEYPVEKLMRDAKIYQIYEGTAQIQRLIIAREHIEKYKN,sabio,P08503,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>>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,3.2,0.1128486216346971,,7.4,1.3.8.7,10116.0,0.505149978319906,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,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,0.505149978319906,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__MAAALRRGYKVLRSVSHFECRAQHTKPSLKQEPGLGFSFELTEQQKEFQTIARKFAREEIIPVAPDYDKSGEYPFPLIKRAWELGLINTHIPESCGGLGLGTFDACLITEELAYGCTGVQTAIEANSLGQMPVIIAGNDQQKKKYLGRMTEQPMMCAYCVTEPSAGSDVAGIKTKAEKKGDEYVINGQKMWITNGGKANWYFVLTRSNPDPKVPASKAFTGFIVEADTPGIHIGKKELNMGQRCSDTRGITFEDVRVPKENVLIGEGAGFKIAMGAFDRTRPTVAAGAVGLAQRALDEATKYALDRKTFGKLLVEHQGVSFLLAEMAMKVELARLSYQRAAWEVDSGRRNTYFASIAKAFAGDIANQLATDAVQIFGGYGFNTEYPVEKLMRDAKIYQIYEGTAQIQRLIIAREHIEKYKN,./data/raw/alphafold//AF-P08503-F1-model_v4.pdb,3214,1249,1731,2326
+49,2116,2147,MMVCEYKPGLEGIPAAQSSISYVDGQKGILEYRGIRIEDLAQQSTFLETAYLLIWGELPTKEELQVFEEEVRLHRRIKYRIRDMMKCFPESGHPMDALQASAAALGLFYSRRDLHNPAYIRDAVVRLIATIPTMVAAFQLMRKGNDPVKPRDDLDYSANFLYMLNEKEPDALAAKIFDICLILHVEHTMNASTFSARVTASTLTDPYAVVASAVGTLGGPLHGGANEEVIQMLEEIGSVENVRSYVEERLQRKDKLMGFGHRVYKVKDPRATILQGLAEQLFAKFGADKYYDIAQEMERVVEEKLGHKGIYPNVDFYSGLVYRKMGIPTDLFTPIFAIARVAGWLAHWKEQLEENRIFRPTQVYNGKHSVTYTPIDQR,brenda,Q9R6Y4,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.O.O=C(O)CC(=O)C(=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.O=C(O)CC(O)(CC(=O)O)C(=O)O,23.0,0.0,25.0,8.0,2.3.3.16,103690.0,1.3617278360175928,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.O.O=C(O)CC(=O)C(=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.O=C(O)CC(O)(CC(=O)O)C(=O)O,1.5037906830571812,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.O.O=C(O)CC(=O)C(=O)O__MMVCEYKPGLEGIPAAQSSISYVDGQKGILEYRGIRIEDLAQQSTFLETAYLLIWGELPTKEELQVFEEEVRLHRRIKYRIRDMMKCFPESGHPMDALQASAAALGLFYSRRDLHNPAYIRDAVVRLIATIPTMVAAFQLMRKGNDPVKPRDDLDYSANFLYMLNEKEPDALAAKIFDICLILHVEHTMNASTFSARVTASTLTDPYAVVASAVGTLGGPLHGGANEEVIQMLEEIGSVENVRSYVEERLQRKDKLMGFGHRVYKVKDPRATILQGLAEQLFAKFGADKYYDIAQEMERVVEEKLGHKGIYPNVDFYSGLVYRKMGIPTDLFTPIFAIARVAGWLAHWKEQLEENRIFRPTQVYNGKHSVTYTPIDQR,./data/raw/alphafold//AF-Q9R6Y4-F1-model_v4.pdb,1542,1101,932,1272
+50,7029,7146,MGFLDGKRILLTGLLSNRSIAYGIAKACKREGAELAFTYVGDRFKDRITEFAAEFGSELVFPCDVADDAQIDALFASLKTHWDSLDGLVHSIGFAPREAIAGDFLDGLTRENFRIAHDISAYSFPALAKAALPMLSDDASLLTLSYLGAERAIPNYNTMGLAKAALEASVRYLAVSLGAKGVRVNAISAGPIKTLAASGIKSFGKILDFVESNSPLKRNVTIEQVGNAGAFLLSDLASGVTAEVMHVDSGFNAVVGGMAGLEE,brenda,Q3JQY0,CCCCCCC/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.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+]>>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.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)c1,5.6,7.164841808296297e-15,25.0,6.8,1.3.1.9,28450.0,0.7481880270062004,CCCCCCC/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.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+],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.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)c1,0.7481880270062004,CCCCCCC/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.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+]__MGFLDGKRILLTGLLSNRSIAYGIAKACKREGAELAFTYVGDRFKDRITEFAAEFGSELVFPCDVADDAQIDALFASLKTHWDSLDGLVHSIGFAPREAIAGDFLDGLTRENFRIAHDISAYSFPALAKAALPMLSDDASLLTLSYLGAERAIPNYNTMGLAKAALEASVRYLAVSLGAKGVRVNAISAGPIKTLAASGIKSFGKILDFVESNSPLKRNVTIEQVGNAGAFLLSDLASGVTAEVMHVDSGFNAVVGGMAGLEE,./data/raw/alphafold//AF-Q3JQY0-F1-model_v4.pdb,994,525,261,284
+51,10078,10229,MSEEIITPVYCTGVSAQVQKQRARELGLGRHENAIKYLGQDYEQLRVRCLQSGTLFRDEAFPPVPQSLGYKDLGPNSSKTYGIKWKRPTELLSNPQFIVDGATRTDICQGALGDCWLLAAIASLTLNDTLLHRVVPHGQSFQNGYAGIFHFQLWQFGEWVDVVVDDLLPIKDGKLVFVHSAEGNEFWSALLEKAYAKVNGSYEALSGGSTSEGFEDFTGGVTEWYELRKAPSDLYQIILKALERGSLLGCSIDISSVLDMEAITFKKLVKGHAYSVTGAKQVNYRGQVVSLIRMRNPWGEVEWTGAWSDSSSEWNNVDPYERDQLRVKMEDGEFWMSFRDFMREFTRLEICNLTPDALKSRTIRKWNTTLYEGTWRRGSTAGGCRNYPATFWVNPQFKIRLDETDDPDDYGDRESGCSFVLALMQKHRRRERRFGRDMETIGFAVYEVPPELVGQPAVHLKRDFFLANASRARSEQFINLREVSTRFRLPPGEYVVVPSTFEPNKEGDFVLRFFSEKSAGTVELDDQIQANLPDEQVLSEEEIDENFKALFRQLAGEDMEISVKELRTILNRIISKHKDLRTKGFSLESCRSMVNLMDRDGNGKLGLVEFNILWNRIRNYLSIFRKFDLDKSGSMSAYEMRMAIESAGFKLNKKLYELIITRYSEPDLAVDFDNFVCCLVRLETMFRFFKTLDTDLDGVVTFDLFKWLQLTMFA,uniprot_search,P07384,CSCC[C@H](N=C(O)CN=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H](N=C(O)[C@H](CCC(=O)O)N=C(O)c1ccccc1N)C(C)C)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O.O>>CC(C)[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=O)O.CSCC[C@H](N=C(O)CN)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O,0.025,3.1735356700261844e-14,30.0,7.5,3.4.22.52,9606.0,-1.6020599913279625,CSCC[C@H](N=C(O)CN=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H](N=C(O)[C@H](CCC(=O)O)N=C(O)c1ccccc1N)C(C)C)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O.O,CC(C)[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=O)O.CSCC[C@H](N=C(O)CN)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O,-1.6020599913279625,CSCC[C@H](N=C(O)CN=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H](N=C(O)[C@H](CCC(=O)O)N=C(O)c1ccccc1N)C(C)C)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O.O__MSEEIITPVYCTGVSAQVQKQRARELGLGRHENAIKYLGQDYEQLRVRCLQSGTLFRDEAFPPVPQSLGYKDLGPNSSKTYGIKWKRPTELLSNPQFIVDGATRTDICQGALGDCWLLAAIASLTLNDTLLHRVVPHGQSFQNGYAGIFHFQLWQFGEWVDVVVDDLLPIKDGKLVFVHSAEGNEFWSALLEKAYAKVNGSYEALSGGSTSEGFEDFTGGVTEWYELRKAPSDLYQIILKALERGSLLGCSIDISSVLDMEAITFKKLVKGHAYSVTGAKQVNYRGQVVSLIRMRNPWGEVEWTGAWSDSSSEWNNVDPYERDQLRVKMEDGEFWMSFRDFMREFTRLEICNLTPDALKSRTIRKWNTTLYEGTWRRGSTAGGCRNYPATFWVNPQFKIRLDETDDPDDYGDRESGCSFVLALMQKHRRRERRFGRDMETIGFAVYEVPPELVGQPAVHLKRDFFLANASRARSEQFINLREVSTRFRLPPGEYVVVPSTFEPNKEGDFVLRFFSEKSAGTVELDDQIQANLPDEQVLSEEEIDENFKALFRQLAGEDMEISVKELRTILNRIISKHKDLRTKGFSLESCRSMVNLMDRDGNGKLGLVEFNILWNRIRNYLSIFRKFDLDKSGSMSAYEMRMAIESAGFKLNKKLYELIITRYSEPDLAVDFDNFVCCLVRLETMFRFFKTLDTDLDGVVTFDLFKWLQLTMFA,./data/raw/alphafold//AF-P07384-F1-model_v4.pdb,3615,3589,3154,1925
+52,4640,4696,MAAAVAAAPGALGSLHAGGARLVAACSAWLCPGLRLPGSLAGRRAGPAIWAQGWVPAAGGPAPKRGYSSEMKTEDELRVRHLEEENRGIVVLGINRAYGKNSLSKNLIKMLSKAVDALKSDKKVRTIIIRSEVPGIFCAGADLKERAKMSSSEVGPFVSKIRAVINDIANLPVPTIAAIDGLALGGGLELALACDIRVAASSAKMGLVETKLAIIPGGGGTQRLPRAIGMSLAKELIFSARVLDGKEAKAVGLISHVLEQNQEGDAAYRKALDLAREFLPQGPVAMRVAKLAINQGMEVDLVTGLAIEEACYAQTIPTKDRLEGLLAFKEKRPPRYKGE,brenda,Q13825,CC(O)(CC(=O)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>>,0.26,99.89043101152996,37.0,7.25,4.2.1.18,9606.0,-0.585026652029182,CC(O)(CC(=O)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,,-0.585026652029182,CC(O)(CC(=O)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__MAAAVAAAPGALGSLHAGGARLVAACSAWLCPGLRLPGSLAGRRAGPAIWAQGWVPAAGGPAPKRGYSSEMKTEDELRVRHLEEENRGIVVLGINRAYGKNSLSKNLIKMLSKAVDALKSDKKVRTIIIRSEVPGIFCAGADLKERAKMSSSEVGPFVSKIRAVINDIANLPVPTIAAIDGLALGGGLELALACDIRVAASSAKMGLVETKLAIIPGGGGTQRLPRAIGMSLAKELIFSARVLDGKEAKAVGLISHVLEQNQEGDAAYRKALDLAREFLPQGPVAMRVAKLAINQGMEVDLVTGLAIEEACYAQTIPTKDRLEGLLAFKEKRPPRYKGE,./data/raw/alphafold//AF-Q13825-F1-model_v4.pdb,1699,573,235,255
+53,3511,3560,MANLEIGKSILAAGVLTNYHDVGEGQPVILIHGSGPGVSAYANWRLTIPALSKFYRVIAPDMVGFGFTDRPENYNYSKDSWVDHIIGIMDALEIEKAHIVGNSFGGGLAIATALRYSERVDRMVLMGAAGTRFDVTEGLNAVWGYTPSIENMRNLLDIFAYDRSLVTDELARLRYEASIQPGFQESFSSMFPEPRQRWIDALASSDEDIKTLPNETLIIHGREDQVVPLSSSLRLGELIDRAQLHVFGRCGHWTQIEQTDRFNRLVVEFFNEANTPKLVGRP,brenda,P96965,CC(C)C(=O)/C=C/C=C(\O)C(=O)O.O>>,21.0,99.50788854659802,25.0,7.5,3.7.1.9,294.0,1.3222192947339193,CC(C)C(=O)/C=C/C=C(\O)C(=O)O.O,,1.3222192947339193,CC(C)C(=O)/C=C/C=C(\O)C(=O)O.O__MANLEIGKSILAAGVLTNYHDVGEGQPVILIHGSGPGVSAYANWRLTIPALSKFYRVIAPDMVGFGFTDRPENYNYSKDSWVDHIIGIMDALEIEKAHIVGNSFGGGLAIATALRYSERVDRMVLMGAAGTRFDVTEGLNAVWGYTPSIENMRNLLDIFAYDRSLVTDELARLRYEASIQPGFQESFSSMFPEPRQRWIDALASSDEDIKTLPNETLIIHGREDQVVPLSSSLRLGELIDRAQLHVFGRCGHWTQIEQTDRFNRLVVEFFNEANTPKLVGRP,./data/raw/alphafold//AF-P96965-F1-model_v4.pdb,222,2740,3025,1772
+54,18530,18794,MSIPFTRWPEEFARRYREKGYWQDLPLTDILTRHAASDSIAVIDGERQLSYRELNQAADNLACSLRRQGIKPGETALVQLGNVAELYITFFALLKLGVAPVLALFSHQRSELNAYASQIEPALLIADRQHALFSGDDFLNTFVTEHSSIRVVQLHNDSGEHNLQDAINHPAEDFTATPSPADEVAYFQLSGGTTGTPKLIPRTHNDYYYSVRRSVEICQFTQQTRYLCAIPAAHNYAMSSPGSLGVFLAGGTVVLAADPSATLCFPLIEKHQVNVTALVPPAVSLWLQALTEGESRAQLASLKLLQVGGARLSATLAARIPAEIGCQLQQVFGMAEGLVNYTRLDDSAEKIIHTQGYPMCPDDEVWVADAEGNPLPQGEVGRLMTRGPYTFRGYYKSPQHNASAFDANGFYCSGDLISIDPEGYITVQGREKDQINRGGEKIAAEEIENLLLRHPAVIYAALVSMEDELMGEKSCAYLVVKEPLRAVQVRRFLREQGIAEFKLPDRVECVDSLPLTAVGKVDKKQLRQWLASRASA,uniprot_search,D3K2Z7,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)c1cc(O)ccc1O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OC(=O)c2cc(O)ccc2O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,3.15,0.0,37.0,9.0,6.2.1.71,562.0,0.4983105537896005,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)c1cc(O)ccc1O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OC(=O)c2cc(O)ccc2O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.4983105537896005,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)c1cc(O)ccc1O__MSIPFTRWPEEFARRYREKGYWQDLPLTDILTRHAASDSIAVIDGERQLSYRELNQAADNLACSLRRQGIKPGETALVQLGNVAELYITFFALLKLGVAPVLALFSHQRSELNAYASQIEPALLIADRQHALFSGDDFLNTFVTEHSSIRVVQLHNDSGEHNLQDAINHPAEDFTATPSPADEVAYFQLSGGTTGTPKLIPRTHNDYYYSVRRSVEICQFTQQTRYLCAIPAAHNYAMSSPGSLGVFLAGGTVVLAADPSATLCFPLIEKHQVNVTALVPPAVSLWLQALTEGESRAQLASLKLLQVGGARLSATLAARIPAEIGCQLQQVFGMAEGLVNYTRLDDSAEKIIHTQGYPMCPDDEVWVADAEGNPLPQGEVGRLMTRGPYTFRGYYKSPQHNASAFDANGFYCSGDLISIDPEGYITVQGREKDQINRGGEKIAAEEIENLLLRHPAVIYAALVSMEDELMGEKSCAYLVVKEPLRAVQVRRFLREQGIAEFKLPDRVECVDSLPLTAVGKVDKKQLRQWLASRASA,./data/raw/alphafold//AF-D3K2Z7-F1-model_v4.pdb,132,2623,2923,5771
+55,8474,8605,MRWWTTCVALTSLIPYALLPSYGFNLPQQLEARQNDYPSGSLLHDYPGQHTLPTLELIQKLNATNGTFLPLEEIQGDIMIGMRKPKEIFFFYSLQNPRKFKSVLAKLIYPHITTTAQMVCTTCAQPSAMLNVAWTSQGLRKLGVLDNLGDPYFAMGQLSDAAALGDTDPSTTWAPGLYANKTDGAFLIAAKDWEPIDTLLNQMKAWLGDAIVETHSNRGAVRPGDAAGKEHFGWLDGFIQPAVAGFATSTYPGQQLLLPGTLLTKEIGDPRRAARPAWTKWGSFMAYRQLQELVPEFDDYLMQEAALIQDSSRSVRERADLLGARMFGRWKSGTPLDLAPEKDDPSIGPNLMLNNNFDFNHPAPFNINTNQSYCPFSAHIRKIRPRADQGNQNLKNQMIRASIPYGEELSDDEINNKKTGTERGVAFVTYQSDLGSGFHFQQAEWANNVNIPTGKSDPTPGFDPIVGQNSGKPLVVSGIDYTDLNHDLTFMSFVVSKGGDYFFSPSMSAILHKIAA,brenda,A0A0F7VJ89,CCn1/c(=N/N=c2\sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.OO>>O,375.0,93.47674051942974,30.0,3.8,1.11.1.19,98349.0,2.574031267727719,CCn1/c(=N/N=c2\sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.OO,O,2.574031267727719,CCn1/c(=N/N=c2\sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.OO__MRWWTTCVALTSLIPYALLPSYGFNLPQQLEARQNDYPSGSLLHDYPGQHTLPTLELIQKLNATNGTFLPLEEIQGDIMIGMRKPKEIFFFYSLQNPRKFKSVLAKLIYPHITTTAQMVCTTCAQPSAMLNVAWTSQGLRKLGVLDNLGDPYFAMGQLSDAAALGDTDPSTTWAPGLYANKTDGAFLIAAKDWEPIDTLLNQMKAWLGDAIVETHSNRGAVRPGDAAGKEHFGWLDGFIQPAVAGFATSTYPGQQLLLPGTLLTKEIGDPRRAARPAWTKWGSFMAYRQLQELVPEFDDYLMQEAALIQDSSRSVRERADLLGARMFGRWKSGTPLDLAPEKDDPSIGPNLMLNNNFDFNHPAPFNINTNQSYCPFSAHIRKIRPRADQGNQNLKNQMIRASIPYGEELSDDEINNKKTGTERGVAFVTYQSDLGSGFHFQQAEWANNVNIPTGKSDPTPGFDPIVGQNSGKPLVVSGIDYTDLNHDLTFMSFVVSKGGDYFFSPSMSAILHKIAA,./data/raw/alphafold//AF-A0A0F7VJ89-F1-model_v4.pdb,2842,2334,1053,2954
+56,19103,19389,MNKGLHRKRLSKRLLLPMLLCLLAQQTQAVAAEQTKVSDVCSEVTAEGWQEVRRWDKLFESAGVKGSLLLWDQKRSLGLSNNLSRAAEGFIPASTFKLPSSLIALETGAVRDETSRFSWDGKVREIAVWNRDQSFRTAMKYSVVPVYQQLAREIGPKVMAAMVRQLEYGNQDIGGQADSFWLDGQLRITAFQQVDFLRQLHDNKLPVSERSQRIVKQMMLTEASTDYIIRAKTGYGVRRTPAIGWWVGWLELDDNTVYFAVNLDLASASQLPLRQQLVKQVLKQEQLLP,sabio,Q6VCW0,O.O=C(Cc1cccs1)NC1C(=O)N2C(C(=O)O)=C(C[n+]3ccccc3)CSC12>>,10.0,99.77038889233305,30.0,7.0,3.5.2.6,38313.0,1.0,O.O=C(Cc1cccs1)NC1C(=O)N2C(C(=O)O)=C(C[n+]3ccccc3)CSC12,,1.0,O.O=C(Cc1cccs1)NC1C(=O)N2C(C(=O)O)=C(C[n+]3ccccc3)CSC12__MNKGLHRKRLSKRLLLPMLLCLLAQQTQAVAAEQTKVSDVCSEVTAEGWQEVRRWDKLFESAGVKGSLLLWDQKRSLGLSNNLSRAAEGFIPASTFKLPSSLIALETGAVRDETSRFSWDGKVREIAVWNRDQSFRTAMKYSVVPVYQQLAREIGPKVMAAMVRQLEYGNQDIGGQADSFWLDGQLRITAFQQVDFLRQLHDNKLPVSERSQRIVKQMMLTEASTDYIIRAKTGYGVRRTPAIGWWVGWLELDDNTVYFAVNLDLASASQLPLRQQLVKQVLKQEQLLP,./data/raw/alphafold//AF-Q6VCW0-F1-model_v4.pdb,1244,973,780,1086
+57,14559,14764,MKNTLLKLGVCVSLLGITPFVSTISSVQAERTVEHKVIKNETGTISISQLNKNVWVHTELGYFSGEAVPSNGLVLNTSKGLVLVDSSWDDKLTKELIEMVEKKFKKRVTDVIITHAHADRIGGMKTLKERGIKAHSTALTAELAKKNGYEEPLGDLQSVTNLKFGNMKVETFYPGKGHTEDNIVVWLPQYQILAGGCLVKSASSKDLGNVADAYVNEWSTSIENVLKRYGNINLVVPGHGEVGDRGLLLHTLDLLK,sabio,P14488,N=c1[nH]c(C(N=CO)C(O)=N[C@@H]2C(=O)N3C(C(=O)O)=C(CSc4cnns4)CS[C@H]23)cs1.O>>,25.0,99.81224994038936,30.0,6.5,3.5.2.6,1396.0,1.3979400086720375,N=c1[nH]c(C(N=CO)C(O)=N[C@@H]2C(=O)N3C(C(=O)O)=C(CSc4cnns4)CS[C@H]23)cs1.O,,1.3979400086720375,N=c1[nH]c(C(N=CO)C(O)=N[C@@H]2C(=O)N3C(C(=O)O)=C(CSc4cnns4)CS[C@H]23)cs1.O__MKNTLLKLGVCVSLLGITPFVSTISSVQAERTVEHKVIKNETGTISISQLNKNVWVHTELGYFSGEAVPSNGLVLNTSKGLVLVDSSWDDKLTKELIEMVEKKFKKRVTDVIITHAHADRIGGMKTLKERGIKAHSTALTAELAKKNGYEEPLGDLQSVTNLKFGNMKVETFYPGKGHTEDNIVVWLPQYQILAGGCLVKSASSKDLGNVADAYVNEWSTSIENVLKRYGNINLVVPGHGEVGDRGLLLHTLDLLK,./data/raw/alphafold//AF-P14488-F1-model_v4.pdb,1462,998,813,1132
+58,4644,4700,MSSMTQNLREVMKVMFKVPGFDRVLEKVTLVSAAPEKLICEMKVEEQHTNKLGTLHGGLTATLVDSISTMALMCTERGAPGVSVDMNITYMSPAKIGEEIVITAHILKQGKTLAFASVDLTNKTTGKLIAQGRHTKHLGN,sabio,Q9CQR4,CC(O)(CC(=O)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.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.CC(O)(CC(=O)O)CC(=O)O,0.007,6.110999660368403e-15,37.0,7.5,3.1.2.-,10090.0,-2.154901959985743,CC(O)(CC(=O)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.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.CC(O)(CC(=O)O)CC(=O)O,-2.154901959985743,CC(O)(CC(=O)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.O__MSSMTQNLREVMKVMFKVPGFDRVLEKVTLVSAAPEKLICEMKVEEQHTNKLGTLHGGLTATLVDSISTMALMCTERGAPGVSVDMNITYMSPAKIGEEIVITAHILKQGKTLAFASVDLTNKTTGKLIAQGRHTKHLGN,./data/raw/alphafold//AF-Q9CQR4-F1-model_v4.pdb,1636,1238,1720,1453
+59,19248,19534,MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,uniprot_search,P23946,O.O=C(O)CC(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1>>,38.0,99.82595347040078,45.66666666666666,8.375,3.4.21.39,9606.0,1.57978359661681,O.O=C(O)CC(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1,,1.57978359661681,O.O=C(O)CC(O)=N[C@@H](CO)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,1858,1553,3136,1905
+60,22281,22615,MKFGYFDDKNREYVIVTPRTPYPWINYLGTEDFFSIISHMAGGYCFYKDARLRRITRFRYNNVPTDAGGRYFYIREEDGDFWSPTWMPVRRDLSFFEARHGLGYTKIAGERNGLRATITFFVPRHFTGEVHHLVLQNRTERPRRIKLFSFIEFCLWNALDDMTNFQRNYSTGEVEIEGSVIYHKTEYRERRNHYAFYSVNHSIDGFDTDRESFMGLYNGFEAPQAVVEGNPRNSVASGWAPIASHYLELEIPPLGEKELIFILGYVENPEEEKWERPGVINKKRAKEMIERFKTGEDVERALKELKEYWDELLGRIQVETHDEKLNRMVNIWNQYQCMVTFNIARSASYFESGISRGIGFRDSNQDILGFVHMIPEKARQRILDLASIQFEDGSTYHQFQPLTKKGNNEIGGGFNDDPLWLILSTSAYIKETGDWSILNEEVPFDNDPDKKATLFEHLKRSFYFTVNNLGPHGLPLIGRADWNDCLNLNCFSKNPDESFQTTVNALDGRVAESVFIAGLFVLAGKEFVEICRRLGLEDEAKEAEKHVKKMIETTLEYGWDGEWFLRAYDAFGRKVGSKECEEGKIFIEPQGMCVMAGIGVENGYAKKALDSVKEHLDTPYGLVLQQPAYSRYYIELGEISSYPPGYKENAGIFCHNNPWVAIAETVIGRGDRAFEIYRKITPAYLEDISEIHRTEPYVYAQMVAGKDAPRHGEAKNSWLTGTAAWSFVAITQYILGVRPTYDGLMVDPCIPEDWDGFKITRRFRGATYEITVKNPHHVSKGVKEIIVDGKKIEGQVLPVFNDGKVHRVEVLMG,sabio,B9K7M6,O=P(O)(O)O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O>>O=P(O)(O)OC1OC(CO)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O,26.3,0.0,85.0,5.5,2.4.1.20,2337.0,1.4199557484897578,O=P(O)(O)O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O,O=P(O)(O)OC1OC(CO)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O,1.4199557484897578,O=P(O)(O)O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O__MKFGYFDDKNREYVIVTPRTPYPWINYLGTEDFFSIISHMAGGYCFYKDARLRRITRFRYNNVPTDAGGRYFYIREEDGDFWSPTWMPVRRDLSFFEARHGLGYTKIAGERNGLRATITFFVPRHFTGEVHHLVLQNRTERPRRIKLFSFIEFCLWNALDDMTNFQRNYSTGEVEIEGSVIYHKTEYRERRNHYAFYSVNHSIDGFDTDRESFMGLYNGFEAPQAVVEGNPRNSVASGWAPIASHYLELEIPPLGEKELIFILGYVENPEEEKWERPGVINKKRAKEMIERFKTGEDVERALKELKEYWDELLGRIQVETHDEKLNRMVNIWNQYQCMVTFNIARSASYFESGISRGIGFRDSNQDILGFVHMIPEKARQRILDLASIQFEDGSTYHQFQPLTKKGNNEIGGGFNDDPLWLILSTSAYIKETGDWSILNEEVPFDNDPDKKATLFEHLKRSFYFTVNNLGPHGLPLIGRADWNDCLNLNCFSKNPDESFQTTVNALDGRVAESVFIAGLFVLAGKEFVEICRRLGLEDEAKEAEKHVKKMIETTLEYGWDGEWFLRAYDAFGRKVGSKECEEGKIFIEPQGMCVMAGIGVENGYAKKALDSVKEHLDTPYGLVLQQPAYSRYYIELGEISSYPPGYKENAGIFCHNNPWVAIAETVIGRGDRAFEIYRKITPAYLEDISEIHRTEPYVYAQMVAGKDAPRHGEAKNSWLTGTAAWSFVAITQYILGVRPTYDGLMVDPCIPEDWDGFKITRRFRGATYEITVKNPHHVSKGVKEIIVDGKKIEGQVLPVFNDGKVHRVEVLMG,./data/raw/alphafold//AF-B9K7M6-F1-model_v4.pdb,770,196,5928,6845
+61,6897,7013,MAAMFRRSCRVLRSLSHFGWRSQHTKAVPQCEPGSGFSFELTEQQKEFQATARKFAREEIIPVAAEYDRTGEYPVPLLKRAWELGLMNTHIPESFGGLGLGIIDSCLITEELAYGCTGVQTAIEANTLGQVPLIIGGNYQQQKKYLGRMTEEPLMCAYCVTEPGAGSDVAGIKTKAEKKGDEYIINGQKMWITNGGKANWYFLLARSDPDPKAPASKAFTGFIVEADTPGVQIGRKEINMGQRCSDTRGIVFEDVRVPKENVLTGEGAGFKIAMGTFDKTRPPVAAGAVGLAQRALDEATKYALERKTFGKLLAEHQGISFLLADMAMKVELARLSYQRAAWEIDSGRRNTYYASIAKAYAADIANQLATDAVQVFGGNGFNTEYPVEKLMRDAKIYQIYEGTAQIQRIIIAREHIGRYKN,sabio,P41367,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.F[P-](F)(F)(F)(F)F.[Fe+3].c1cc[cH-]c1.c1cc[cH-]c1>>CCCC=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.F[P-](F)(F)(F)(F)F.[Fe+2].c1cc[cH-]c1.c1cc[cH-]c1,19.6,0.0842686061822089,25.0,7.6,1.3.8.7,9823.0,1.292256071356476,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.F[P-](F)(F)(F)(F)F.[Fe+3].c1cc[cH-]c1.c1cc[cH-]c1,CCCC=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.F[P-](F)(F)(F)(F)F.[Fe+2].c1cc[cH-]c1.c1cc[cH-]c1,1.292256071356476,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.F[P-](F)(F)(F)(F)F.[Fe+3].c1cc[cH-]c1.c1cc[cH-]c1__MAAMFRRSCRVLRSLSHFGWRSQHTKAVPQCEPGSGFSFELTEQQKEFQATARKFAREEIIPVAAEYDRTGEYPVPLLKRAWELGLMNTHIPESFGGLGLGIIDSCLITEELAYGCTGVQTAIEANTLGQVPLIIGGNYQQQKKYLGRMTEEPLMCAYCVTEPGAGSDVAGIKTKAEKKGDEYIINGQKMWITNGGKANWYFLLARSDPDPKAPASKAFTGFIVEADTPGVQIGRKEINMGQRCSDTRGIVFEDVRVPKENVLTGEGAGFKIAMGTFDKTRPPVAAGAVGLAQRALDEATKYALERKTFGKLLAEHQGISFLLADMAMKVELARLSYQRAAWEIDSGRRNTYYASIAKAYAADIANQLATDAVQVFGGNGFNTEYPVEKLMRDAKIYQIYEGTAQIQRIIIAREHIGRYKN,./data/raw/alphafold//AF-P41367-F1-model_v4.pdb,3214,1249,1731,1465
+62,719,739,MSPSKMNATVGSTSEVEQKIRQELALSDEVTTIRRNAPAAVLYEDGLKENKTVISSSGALIAYSGVKTGRSPKDKRIVEEPTSKDEIWWGPVNKPCSERTWSINRERAADYLRTRDHIYIVDAFAGWDPKYRIKVRVVCARAYHALFMTNMLIRPTEEELAHFGEPDFTVWNAGQFPANLHTQDMSSKSTIEINFKAMEMIILGTEYAGEMKKGIFTVMFYLMPVHHNVLTLHSSANQGIQNGDVTLFFGLSGTGKTTLSADPHRLLIGDDEHCWSDHGVFNIEGGCYAKCINLSAEKEPEIFDAIKFGSVLENVIYDEKSHVVDYDDSSITENTRCAYPIDYIPSAKIPCLADSHPKNIILLTCDASGVLPPVSKLTPEQVMYHFISGYTSKMAGTEQGVTEPEPTFSSCFGQPFLALHPIRYATMLATKMSQHKANAYLINTGWTGSSYVSGGKRCPLKYTRAILDSIHDGSLANETYETLPIFNLQVPTKVNGVPAELLNPAKNWSQGESKYRGAVTNLANLFVQNFKIYQDRATPDVLAAGPQFE,sabio,P10963,C=C(OP(=O)(O)O)C(=O)O.O=C=O.O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O>>O=C(O)CC(=O)C(=O)O.O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,4.9,8.871568031939474e-15,30.0,6.9,4.1.1.49,4932.0,0.6901960800285137,C=C(OP(=O)(O)O)C(=O)O.O=C=O.O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,O=C(O)CC(=O)C(=O)O.O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,0.6901960800285137,C=C(OP(=O)(O)O)C(=O)O.O=C=O.O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O__MSPSKMNATVGSTSEVEQKIRQELALSDEVTTIRRNAPAAVLYEDGLKENKTVISSSGALIAYSGVKTGRSPKDKRIVEEPTSKDEIWWGPVNKPCSERTWSINRERAADYLRTRDHIYIVDAFAGWDPKYRIKVRVVCARAYHALFMTNMLIRPTEEELAHFGEPDFTVWNAGQFPANLHTQDMSSKSTIEINFKAMEMIILGTEYAGEMKKGIFTVMFYLMPVHHNVLTLHSSANQGIQNGDVTLFFGLSGTGKTTLSADPHRLLIGDDEHCWSDHGVFNIEGGCYAKCINLSAEKEPEIFDAIKFGSVLENVIYDEKSHVVDYDDSSITENTRCAYPIDYIPSAKIPCLADSHPKNIILLTCDASGVLPPVSKLTPEQVMYHFISGYTSKMAGTEQGVTEPEPTFSSCFGQPFLALHPIRYATMLATKMSQHKANAYLINTGWTGSSYVSGGKRCPLKYTRAILDSIHDGSLANETYETLPIFNLQVPTKVNGVPAELLNPAKNWSQGESKYRGAVTNLANLFVQNFKIYQDRATPDVLAAGPQFE,./data/raw/alphafold//AF-P10963-F1-model_v4.pdb,1139,725,415,471
+63,8092,8220,MAAIRFLVLAFLFACGASEPINEKEGRIIGGTTTTITSYPYIASLHKGTEHICGATIINSEWLVTAASCISIPNAREYLVRVGSTYSSSGGNVYQVSKIYRHEFDLNTMDNDIALVRLSTGVIFGTNVQSITLQESDVSDGTSATVLGWGTISEGGAQSNILKQVVVPVVGFHSCNTSYATYGGITDNMLCAGYNEGGVDACQGDTGGPLVASGHLIGIVSWGAGCGHSTFPGVYTKVSAYRDWIKDKTGV,uniprot_search,A0A059WCN6,CC[C@H](C)[C@H](N=C(O)CN=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)CN=C(O)[C@H](C)N=C(O)c1ccccc1N)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>CC[C@H](C)[C@H](N=C(O)CN)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].C[C@H](N=C(O)c1ccccc1N)C(O)=NCC(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(=O)O,0.0007,4.2876545086066056e-14,30.0,8.5,3.4.21.4,6978.0,-3.154901959985743,CC[C@H](C)[C@H](N=C(O)CN=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)CN=C(O)[C@H](C)N=C(O)c1ccccc1N)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,CC[C@H](C)[C@H](N=C(O)CN)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].C[C@H](N=C(O)c1ccccc1N)C(O)=NCC(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(=O)O,-3.154901959985743,CC[C@H](C)[C@H](N=C(O)CN=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)CN=C(O)[C@H](C)N=C(O)c1ccccc1N)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MAAIRFLVLAFLFACGASEPINEKEGRIIGGTTTTITSYPYIASLHKGTEHICGATIINSEWLVTAASCISIPNAREYLVRVGSTYSSSGGNVYQVSKIYRHEFDLNTMDNDIALVRLSTGVIFGTNVQSITLQESDVSDGTSATVLGWGTISEGGAQSNILKQVVVPVVGFHSCNTSYATYGGITDNMLCAGYNEGGVDACQGDTGGPLVASGHLIGIVSWGAGCGHSTFPGVYTKVSAYRDWIKDKTGV,./data/raw/alphafold//AF-A0A059WCN6-F1-model_v4.pdb,1862,1558,3143,1914
+64,14384,14586,MQYEKVKPPENGEKIRYENGKLIVPDNPIIPYFEGDGIGKDVVPAAIRVLDAAADKIGKEVVWFQVYAGEDAYKLYGNYLPDDTLNAIKEFRVALKGPLTTPVGGGYRSLNVTIRQVLDLYANVRPVYYLKGVPSPIKHPEKVNFVIFRENTEDVYAGIEWPRGSEEALKLIRFLKNEFGVTIREDSGIGIKPISEFATKRLVRMAIRYAIENNRKSVTLVHKGNIMKYTEGAFRDWGYEVAKQEFGEYCITEDELWDKYGGKQPEGKIVVKDRIADNMFQQILTRTDEYDVIALPNLNGDYLSDAAAALIGGLGIAPGSNIGDGIGVFEPVHGSAPKYAGQNKVNPTAEILTGALMFEYIGWKDASEMIKKAVEMTISSGIVTYDIHRHMGGTKVGTREFAEAVVENLQSL,brenda,O29610,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)CC(C(=O)O)C(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.O=C(O)CCC(=O)C(=O)O.O=C=O.[H+],255.0,0.0,60.0,8.0,1.1.1.42,2234.0,2.406540180433955,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)CC(C(=O)O)C(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.O=C(O)CCC(=O)C(=O)O.O=C=O.[H+],2.406540180433955,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)CC(C(=O)O)C(O)C(=O)O__MQYEKVKPPENGEKIRYENGKLIVPDNPIIPYFEGDGIGKDVVPAAIRVLDAAADKIGKEVVWFQVYAGEDAYKLYGNYLPDDTLNAIKEFRVALKGPLTTPVGGGYRSLNVTIRQVLDLYANVRPVYYLKGVPSPIKHPEKVNFVIFRENTEDVYAGIEWPRGSEEALKLIRFLKNEFGVTIREDSGIGIKPISEFATKRLVRMAIRYAIENNRKSVTLVHKGNIMKYTEGAFRDWGYEVAKQEFGEYCITEDELWDKYGGKQPEGKIVVKDRIADNMFQQILTRTDEYDVIALPNLNGDYLSDAAAALIGGLGIAPGSNIGDGIGVFEPVHGSAPKYAGQNKVNPTAEILTGALMFEYIGWKDASEMIKKAVEMTISSGIVTYDIHRHMGGTKVGTREFAEAVVENLQSL,./data/raw/alphafold//AF-O29610-F1-model_v4.pdb,2594,4769,4822,4663
+65,11614,11772,MGKRAAHIGLRALADLATPMAVRVAATLRVADHIAAGHRTAAEIASAAGAHADSLDRLLRHLVAVGLFTRDGQGVYGLTEFGEQLRDDHAAGKRKWLDMNSAVGRGDLGFVELAHSIRTGQPAYPVRYGTSFWEDLGSDPVLSASFDTLMSHHLELDYTGIAAKYDWAALGHVVDVGGGSGGLLSALLTAHEDLSGTVLDLQGPASAAHRRFLDTGLSGRAQVVVGSFFDPLPAGAGGYVLSAVLHDWDDLSAVAILRRCAEAAGSGGVVLVIEAVAGDEHAGTGMDLRMLTYFGGKERSLAELGELAAQAGLAVRAAHPISYVSIVEMTAL,brenda,Q84HC8,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.O=C(O)c1cc2cc(O)ccc2cc1O>>COc1ccc2cc(O)c(C(=O)O)cc2c1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,0.0004,0.0834948561204837,25.0,6.0,2.1.1.303,1897.0,-3.397940008672037,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.O=C(O)c1cc2cc(O)ccc2cc1O,COc1ccc2cc(O)c(C(=O)O)cc2c1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,-3.397940008672037,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.O=C(O)c1cc2cc(O)ccc2cc1O__MGKRAAHIGLRALADLATPMAVRVAATLRVADHIAAGHRTAAEIASAAGAHADSLDRLLRHLVAVGLFTRDGQGVYGLTEFGEQLRDDHAAGKRKWLDMNSAVGRGDLGFVELAHSIRTGQPAYPVRYGTSFWEDLGSDPVLSASFDTLMSHHLELDYTGIAAKYDWAALGHVVDVGGGSGGLLSALLTAHEDLSGTVLDLQGPASAAHRRFLDTGLSGRAQVVVGSFFDPLPAGAGGYVLSAVLHDWDDLSAVAILRRCAEAAGSGGVVLVIEAVAGDEHAGTGMDLRMLTYFGGKERSLAELGELAAQAGLAVRAAHPISYVSIVEMTAL,./data/raw/alphafold//AF-Q84HC8-F1-model_v4.pdb,1881,4009,1855,3679
+66,6483,6596,EDCLYLNIYAPAHAETGSKLPVMVWFPGGAFETGSASIFDGSALASYENVLVVTIQYRLGIFGFFNTGDEHARGNWAFMDQVAALVWVQENIEFFGGDPRCVTIFGESAGAISVSSLILSPMTKGLFHKAIMASGVAIIPYLKASDYERNDDLQTIASICDCNASDSVALLQCLRAKSSEELLSISQKTKSFTRVVDGLFFPNELLDLLAQKLFHLVPSIIGVNNHECGFLLPMKEFPEILGGSNKSLALQLIHSVLHIPVQYSYLVADEYFHNKHSLLDIRNRFLDLLGDVFFVVPGLVTAQYHTDAGAPVYFYEFQHRPQCLKDRKPPFVKADHTDEIRFVFGGAFLKGNIVMFEEATEEEKALSRKMMRYWANFARTG,uniprot_search,Q3T930,CCCC(=O)OCC.O>>CCCC(=O)O.CCO,559.0,0.0,37.0,7.816666666666666,3.1.1.1,9940.0,2.747411807886423,CCCC(=O)OCC.O,CCCC(=O)O.CCO,2.747411807886423,CCCC(=O)OCC.O__EDCLYLNIYAPAHAETGSKLPVMVWFPGGAFETGSASIFDGSALASYENVLVVTIQYRLGIFGFFNTGDEHARGNWAFMDQVAALVWVQENIEFFGGDPRCVTIFGESAGAISVSSLILSPMTKGLFHKAIMASGVAIIPYLKASDYERNDDLQTIASICDCNASDSVALLQCLRAKSSEELLSISQKTKSFTRVVDGLFFPNELLDLLAQKLFHLVPSIIGVNNHECGFLLPMKEFPEILGGSNKSLALQLIHSVLHIPVQYSYLVADEYFHNKHSLLDIRNRFLDLLGDVFFVVPGLVTAQYHTDAGAPVYFYEFQHRPQCLKDRKPPFVKADHTDEIRFVFGGAFLKGNIVMFEEATEEEKALSRKMMRYWANFARTG,./data/raw/alphafold//AF-Q3T930-F1-model_v4.pdb,3237,2058,3709,2563
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+91,7316,7438,MAHLTKEYYEPFHHDVILGGKRWHYLDIPPEGKDNGRVLVLVHGFPDFWYGWRHQIPVFRKRGHRIILPTLMGFPGSEVPEPPAMEEFEENEDGINIYTELGQEDDCRELHFYGFKFFADCMAELLKKLNIKSATFLGHDWGAHYVPKVWAYHPEIVDAISSACWYYQVPEPEWVPLTDFSDKWPTTKYQLQFGGDAVNNIGPGMIPFFLRRSYTVGANFDGEPDPEAPMHMTEEEFAVYEEHFSKEKRSLAGPFTYYRSRKLNWEQDKENFLDKGATKKDLTVNVPYLYIGSTNDIALIPEMSMHLDEYVEKGKLTREHVPTSHWALFEAPDQINKIYVDWLDKLDKTSKL,brenda,Q6C598,CCCCCCCCCCCCBr.O>>CCCCCCCCCCCCO.[Br-],0.16,0.1885895819223486,30.0,4.5,3.8.1.5,4952.0,-0.7958800173440752,CCCCCCCCCCCCBr.O,CCCCCCCCCCCCO.[Br-],-0.7958800173440752,CCCCCCCCCCCCBr.O__MAHLTKEYYEPFHHDVILGGKRWHYLDIPPEGKDNGRVLVLVHGFPDFWYGWRHQIPVFRKRGHRIILPTLMGFPGSEVPEPPAMEEFEENEDGINIYTELGQEDDCRELHFYGFKFFADCMAELLKKLNIKSATFLGHDWGAHYVPKVWAYHPEIVDAISSACWYYQVPEPEWVPLTDFSDKWPTTKYQLQFGGDAVNNIGPGMIPFFLRRSYTVGANFDGEPDPEAPMHMTEEEFAVYEEHFSKEKRSLAGPFTYYRSRKLNWEQDKENFLDKGATKKDLTVNVPYLYIGSTNDIALIPEMSMHLDEYVEKGKLTREHVPTSHWALFEAPDQINKIYVDWLDKLDKTSKL,./data/raw/alphafold//AF-Q6C598-F1-model_v4.pdb,3230,2051,3702,2556
+92,3602,3651,MTKIAMYNVSPIEVPYIEDWAKKNDVEIKTTDQALTSATVDLAEGCSSVSLKPLGPVDEEVVYQKLSEYGVKCIGLRIVGFNTINFDWTKKYNLLVTNVPVYSPRAIAEMTVTQAMYLLRKIGEFRYRMDHDHDFTWPSNLISNEIYNLTVGLIGVGHIGSGLAEIFSAMGAKVIAYDVAYNPEFEPFLTYTDFDTVLKEADIVSLHTPLFPSTENMIGEKQLKEMKKSAYLINCARGELVDTGALIKALQDGEIAGAGLDTLAGESSYFGHTGLTDSEIPEDYKTLAKMPNVVITPHSAFYTETSIRNMVQICLTDQLTIAKGRRPRSIVNL,sabio,Q48534,CC(C)CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]>>CC(C)CC(O)C(=O)O.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)c1,20.0,0.0,25.0,7.5,1.1.1.-,1585.0,1.3010299956639813,CC(C)CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],CC(C)CC(O)C(=O)O.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)c1,1.3010299956639813,CC(C)CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]__MTKIAMYNVSPIEVPYIEDWAKKNDVEIKTTDQALTSATVDLAEGCSSVSLKPLGPVDEEVVYQKLSEYGVKCIGLRIVGFNTINFDWTKKYNLLVTNVPVYSPRAIAEMTVTQAMYLLRKIGEFRYRMDHDHDFTWPSNLISNEIYNLTVGLIGVGHIGSGLAEIFSAMGAKVIAYDVAYNPEFEPFLTYTDFDTVLKEADIVSLHTPLFPSTENMIGEKQLKEMKKSAYLINCARGELVDTGALIKALQDGEIAGAGLDTLAGESSYFGHTGLTDSEIPEDYKTLAKMPNVVITPHSAFYTETSIRNMVQICLTDQLTIAKGRRPRSIVNL,./data/raw/alphafold//AF-Q48534-F1-model_v4.pdb,1277,4484,4392,4281
+93,19915,20201,MKISDGNWLIQPGLNLIHPLQVFEVEQQDNEMVVYAAPRDVRERTWQLDTPLFTLRFFSPQEGIVGVRIEHFQGALNNGPHYPLNILQDVKVTIENTERYAEFKSGNLSARVSKGEFWSLDFLRNGERITGSQVKNNGYVQDTNNQRNYMFERLDLGVGETVYGLGERFTALVRNGQTVETWNRDGGTSTEQAYKNIPFYMTNRGYGVLVNHPQCVSFEVGSEKVSKVQFSVESEYLEYFVIDGPTPKAVLDRYTRFTGRPALPPAWSFGLWLTTSFTTNYDEATVNSFIDGMAERNLPLHVFHFDCFWMKAFQWCDFEWDPLTFPDPEGMIRRLKAKGLKICVWINPYIGQKSPVFKELQEKGYLLKRPDGSLWQWDKWQPGLAIYDFTNPDACKWYADKLKGLVAMGVDCFKTDFGERIPTDVQWFDGSDPQKMHNHYAYIYNELVWNVLKDTVGEEEAVLFARSASVGAQKFPVHWGGDCYANYESMAESLRGGLSIGLSGFGFWSHDIGGFENTAPAHVYKRWCAFGLLSSHSRLHGSKSYRVPWAYDDESCDVVRFFTQLKCRMMPYLYREAARANARGTPMMRAMMMEFPDDPACDYLDRQYMLGDNVMVAPVFTEAGDVQFYLPEGRWTHLWHNDELDGSRWHKQQHGFLSLPVYVRDNTLLALGNNDQRPDYVWHEGTAFHLFNLQDGHEAVCEVPAADGSVIFTLKAARTGNTITVTGAGEAKNWTLCLRNVVKVNGLQDGSQAESEQGLVVKPQGNALTITL,sabio,P31434,O.O=[N+]([O-])c1ccc(OC2OC(CO)C(O)C(O)C2O)cc1>>O=[N+]([O-])c1ccc(O)cc1.OCC1OC(O)C(O)C(O)C1O,0.046,0.0,37.0,7.0,3.2.1.-,562.0,-1.337242168318426,O.O=[N+]([O-])c1ccc(OC2OC(CO)C(O)C(O)C2O)cc1,O=[N+]([O-])c1ccc(O)cc1.OCC1OC(O)C(O)C(O)C1O,-1.337242168318426,O.O=[N+]([O-])c1ccc(OC2OC(CO)C(O)C(O)C2O)cc1__MKISDGNWLIQPGLNLIHPLQVFEVEQQDNEMVVYAAPRDVRERTWQLDTPLFTLRFFSPQEGIVGVRIEHFQGALNNGPHYPLNILQDVKVTIENTERYAEFKSGNLSARVSKGEFWSLDFLRNGERITGSQVKNNGYVQDTNNQRNYMFERLDLGVGETVYGLGERFTALVRNGQTVETWNRDGGTSTEQAYKNIPFYMTNRGYGVLVNHPQCVSFEVGSEKVSKVQFSVESEYLEYFVIDGPTPKAVLDRYTRFTGRPALPPAWSFGLWLTTSFTTNYDEATVNSFIDGMAERNLPLHVFHFDCFWMKAFQWCDFEWDPLTFPDPEGMIRRLKAKGLKICVWINPYIGQKSPVFKELQEKGYLLKRPDGSLWQWDKWQPGLAIYDFTNPDACKWYADKLKGLVAMGVDCFKTDFGERIPTDVQWFDGSDPQKMHNHYAYIYNELVWNVLKDTVGEEEAVLFARSASVGAQKFPVHWGGDCYANYESMAESLRGGLSIGLSGFGFWSHDIGGFENTAPAHVYKRWCAFGLLSSHSRLHGSKSYRVPWAYDDESCDVVRFFTQLKCRMMPYLYREAARANARGTPMMRAMMMEFPDDPACDYLDRQYMLGDNVMVAPVFTEAGDVQFYLPEGRWTHLWHNDELDGSRWHKQQHGFLSLPVYVRDNTLLALGNNDQRPDYVWHEGTAFHLFNLQDGHEAVCEVPAADGSVIFTLKAARTGNTITVTGAGEAKNWTLCLRNVVKVNGLQDGSQAESEQGLVVKPQGNALTITL,./data/raw/alphafold//AF-P31434-F1-model_v4.pdb,381,2952,5291,6168
+94,21162,21486,MNKAVIYTLPKGTYSEKATKKFLDYIDGDYKIDYCNSIYDVFERVDNNGLGVVPIENSIEGSVSLTQDLLLQFKDIKILGELALDIHHNLIGYDKNKIKTVISHPQALAQCRNYIKKHGWDVKAVESTAKAVKIVAESKDETLGAIGSKESAEHYNLKILDENIEDYKNNKTRFILIGKKVKFKYHPKNYKVSIVFELKEDKPGALYHILKEFAERNINLTRIESRPSKKRLGTYIFYIDFENNKEKLEEILKSLERHTTFINLLGKYPVFD,uniprot_search,A0A832T1J7,O=C(O)C(=O)C[C@]1(C(=O)O)C=C[C@@H](O)C=C1>>O.O=C(O)C(=O)Cc1ccccc1.O=C=O,12.3,0.0,60.0,7.5,4.2.1.51,2190.0,1.089905111439398,O=C(O)C(=O)C[C@]1(C(=O)O)C=C[C@@H](O)C=C1,O.O=C(O)C(=O)Cc1ccccc1.O=C=O,1.089905111439398,O=C(O)C(=O)C[C@]1(C(=O)O)C=C[C@@H](O)C=C1__MNKAVIYTLPKGTYSEKATKKFLDYIDGDYKIDYCNSIYDVFERVDNNGLGVVPIENSIEGSVSLTQDLLLQFKDIKILGELALDIHHNLIGYDKNKIKTVISHPQALAQCRNYIKKHGWDVKAVESTAKAVKIVAESKDETLGAIGSKESAEHYNLKILDENIEDYKNNKTRFILIGKKVKFKYHPKNYKVSIVFELKEDKPGALYHILKEFAERNINLTRIESRPSKKRLGTYIFYIDFENNKEKLEEILKSLERHTTFINLLGKYPVFD,./data/raw/alphafold//AF-A0A832T1J7-F1-model_v4.pdb,588,3312,5624,6516
+95,18073,18327,MATGGAAADLEDVQTVDLMSELLRRLKCSQKPDKRLIFIGPPGSGKGTQSPVVKDEYCLCHLSTGDMLRAAVASKTPLGVKAKEAMEKGELVSDDLVVGIIDEAMNKPKCQKGFILDGFPRTVTQAEKLDEMLKRRGTEIDKVLNFAIDDAILEERITGRWIHPSSGRSYHTKFAPPKTPGVDDITGEPLIQRKDDNADVLKSRLAAFHSQTQPVIDYYAKKAVLTNIQAEKAPQEVTSEVKKALS,sabio,O82514,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.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,3.65,33.30734463893516,30.0,,2.7.4.3,3702.0,0.5622928644564748,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.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,0.5622928644564748,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MATGGAAADLEDVQTVDLMSELLRRLKCSQKPDKRLIFIGPPGSGKGTQSPVVKDEYCLCHLSTGDMLRAAVASKTPLGVKAKEAMEKGELVSDDLVVGIIDEAMNKPKCQKGFILDGFPRTVTQAEKLDEMLKRRGTEIDKVLNFAIDDAILEERITGRWIHPSSGRSYHTKFAPPKTPGVDDITGEPLIQRKDDNADVLKSRLAAFHSQTQPVIDYYAKKAVLTNIQAEKAPQEVTSEVKKALS,./data/raw/alphafold//AF-O82514-F1-model_v4.pdb,2420,3411,1149,3067
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+106,1496,1524,MPDYHALIVGAGFSGIGAAIKLDRAGFSDYLVVEAGDGVGGTWHWNTYPGIAVDIPSFSYQFSFEQSRHWSRTYAPGHELKAYAEHCVDKYGIRSRIRLNTKVLAAEFDDEHSLWRVQTDPGGEITARFLISACGILTVPKLPDIDGVDSFEGVTMHTARWDHTQDLTGKRVGIIGTGASAVQVIPEMAPIVSHLTVFQRTPIWCFPKFDVPLPTAVRWAMRIPGGKAVHRLLSQAFVEATFPIAAHYFAVFPLAKHMESAGRRYLRQQVHDPVVREQLTPRYAVGCKRPGFHNTYLSTFNRDNVRLGTXGADRQDHTHCGGHHRRRQPRDRCAGAGDRLQGARHRQHPDLCRHRNWRCVLEPVLGRASAAGL,uniprot_search,A0A654TM06,CC(=O)CCc1ccccc1.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>>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,0.021,9.661942145335267,25.0,8.5,1.14.13.92,1773.0,-1.6777807052660807,CC(=O)CCc1ccccc1.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,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,-1.6777807052660807,CC(=O)CCc1ccccc1.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__MPDYHALIVGAGFSGIGAAIKLDRAGFSDYLVVEAGDGVGGTWHWNTYPGIAVDIPSFSYQFSFEQSRHWSRTYAPGHELKAYAEHCVDKYGIRSRIRLNTKVLAAEFDDEHSLWRVQTDPGGEITARFLISACGILTVPKLPDIDGVDSFEGVTMHTARWDHTQDLTGKRVGIIGTGASAVQVIPEMAPIVSHLTVFQRTPIWCFPKFDVPLPTAVRWAMRIPGGKAVHRLLSQAFVEATFPIAAHYFAVFPLAKHMESAGRRYLRQQVHDPVVREQLTPRYAVGCKRPGFHNTYLSTFNRDNVRLGTXGADRQDHTHCGGHHRRRQPRDRCAGAGDRLQGARHRQHPDLCRHRNWRCVLEPVLGRASAAGL,./data/raw/esmfold//ESMFold-A0A654TM06-v1.pdb,1370,869,665,954
+107,4075,4128,MMDGPRSDMGRWGGNPLQPPTTPSPEPQPDRDRDRYRDLDPDRDHRSRRGGARSFWARCCGCCSCRNREDDDWGPEPSGSRGSRNRGSRNRRPESRGSGVNAAGDGTIREGMLVVTGVDLLSSRSDQNRREHHTDEFEYDELIVRRGQPFQLVLFLNRPYESSDRIALELLIGNNPEVGKGTHVIIPVDKGGSGGWKAHVTKASGQNLNLRVHTSPSAIIGKFQFTVRTRCEAGEFQLPFDPQNEIYILFNPWCPEDIVYVDHEDWRQEYVLNESGRIYYGTEAQIGERTWNYGQFDHGVLDACLYILDRRGMPYGGRGDPVSVSRVISAMVNSLDDNGVLIGNWSGDYSRGTNPSAWVGSVEILLSYLRTGYSVPYGQCWVFAGVTTTVLRCLGLATRTVTNFNSAHDTDTSLTMDIYFDENMKPLEHLNHDSVWNFHVWNDCWMKRPDLPSGFDGWQVVDATPQETSSGIFCCGPCSVESIKNGLVYMKYDTPFIFAEVNSDKVYWQRQEDGSFKIVYVEEKAIGTLIVTKAISSNMREDITHIYKHPEGSEAERKAVETAAAHGSKPNVYATRDSAEDVAMQVEAQDAVTGQDLTVSVVLTNRGSSQRTVKLHLYLSVTYYTGVTGSIFKESKKEVALAPGASDQVTMPVAYKEYRPHLVDQGAMLLNVSGHVKESGQVLAKQHTFRVRTPDLSLTLLGAAVVGQECEVQIIFKNPLPITLTSVVFRLEGSGLQRPKVLNVGDIGGNETVTLRQTFVPVRPGPRQLIASLDSPQLSQVHGVIQVDVAPASGGRFFSEAGGDSRSGESIPMASRGGA,brenda,A0A286XL02,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CO)C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)O.CCCCCN>>CCCCCN=C(O)CC[C@H](N=C(O)[C@@H](N)Cc1ccc(O)cc1)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](Cc1cnc[nH]1)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CO)C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)O.N,0.064,0.0306376173897241,22.0,8.5,2.3.2.13,10141.0,-1.193820026016113,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CO)C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)O.CCCCCN,CCCCCN=C(O)CC[C@H](N=C(O)[C@@H](N)Cc1ccc(O)cc1)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](Cc1cnc[nH]1)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CO)C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)O.N,-1.193820026016113,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CO)C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)O.CCCCCN__MMDGPRSDMGRWGGNPLQPPTTPSPEPQPDRDRDRYRDLDPDRDHRSRRGGARSFWARCCGCCSCRNREDDDWGPEPSGSRGSRNRGSRNRRPESRGSGVNAAGDGTIREGMLVVTGVDLLSSRSDQNRREHHTDEFEYDELIVRRGQPFQLVLFLNRPYESSDRIALELLIGNNPEVGKGTHVIIPVDKGGSGGWKAHVTKASGQNLNLRVHTSPSAIIGKFQFTVRTRCEAGEFQLPFDPQNEIYILFNPWCPEDIVYVDHEDWRQEYVLNESGRIYYGTEAQIGERTWNYGQFDHGVLDACLYILDRRGMPYGGRGDPVSVSRVISAMVNSLDDNGVLIGNWSGDYSRGTNPSAWVGSVEILLSYLRTGYSVPYGQCWVFAGVTTTVLRCLGLATRTVTNFNSAHDTDTSLTMDIYFDENMKPLEHLNHDSVWNFHVWNDCWMKRPDLPSGFDGWQVVDATPQETSSGIFCCGPCSVESIKNGLVYMKYDTPFIFAEVNSDKVYWQRQEDGSFKIVYVEEKAIGTLIVTKAISSNMREDITHIYKHPEGSEAERKAVETAAAHGSKPNVYATRDSAEDVAMQVEAQDAVTGQDLTVSVVLTNRGSSQRTVKLHLYLSVTYYTGVTGSIFKESKKEVALAPGASDQVTMPVAYKEYRPHLVDQGAMLLNVSGHVKESGQVLAKQHTFRVRTPDLSLTLLGAAVVGQECEVQIIFKNPLPITLTSVVFRLEGSGLQRPKVLNVGDIGGNETVTLRQTFVPVRPGPRQLIASLDSPQLSQVHGVIQVDVAPASGGRFFSEAGGDSRSGESIPMASRGGA,./data/raw/alphafold//AF-A0A286XL02-F1-model_v4.pdb,2887,1594,3188,1960
+108,18526,18790,MSLSSKLSVQDLDLKDKRVFIRVDFNVPLDGKKITSNQRIVAALPTIKYVLEHHPRYVVLASHLGRPNGERNEKYSLAPVAKELQSLLGKDVTFLNDCVGPEVEAAVKASAPGSVILLENLRYHIEEEGSRKVDGQKVKASKEDVQKFRHELSSLADVYINDAFGTAHRAHSSMVGFDLPQRAAGFLLEKELKYFGKALENPTRPFLAILGGAKVADKIQLIDNLLDKVDSIIIGGGMAFTFKKVLENTEIGDSIFDKAGAEIVPKLMEKAKAKGVEVVLPVDFIIADAFSADANTKTVTDKEGIPAGWQGLDNGPESRKLFAATVAKAKTIVWNGPPGVFEFEKFAAGTKALLDEVVKSSAAGNTVIIGGGDTATVAKKYGVTDKISHVSTGGGASLELLEGKELPGVAFLSEKK,uniprot_search,A0A6A5Q0F0,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@H](O)COP(=O)(O)O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(OP(=O)(O)O)[C@H](O)COP(=O)(O)O,354.0,0.0,25.0,7.5,2.7.2.3,4932.0,2.549003262025788,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@H](O)COP(=O)(O)O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(OP(=O)(O)O)[C@H](O)COP(=O)(O)O,2.549003262025788,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@H](O)COP(=O)(O)O__MSLSSKLSVQDLDLKDKRVFIRVDFNVPLDGKKITSNQRIVAALPTIKYVLEHHPRYVVLASHLGRPNGERNEKYSLAPVAKELQSLLGKDVTFLNDCVGPEVEAAVKASAPGSVILLENLRYHIEEEGSRKVDGQKVKASKEDVQKFRHELSSLADVYINDAFGTAHRAHSSMVGFDLPQRAAGFLLEKELKYFGKALENPTRPFLAILGGAKVADKIQLIDNLLDKVDSIIIGGGMAFTFKKVLENTEIGDSIFDKAGAEIVPKLMEKAKAKGVEVVLPVDFIIADAFSADANTKTVTDKEGIPAGWQGLDNGPESRKLFAATVAKAKTIVWNGPPGVFEFEKFAAGTKALLDEVVKSSAAGNTVIIGGGDTATVAKKYGVTDKISHVSTGGGASLELLEGKELPGVAFLSEKK,./data/raw/alphafold//AF-A0A6A5Q0F0-F1-model_v4.pdb,46,2473,2757,5602
+109,688,707,MKTSNTKTPKPVLIAGPCVIESLENLRSIAIKLQPLANNERLDFYFKASFDKANRTSLESYRGPGLEKGLEMLQTIKDEFGYKILTDVHESYQASVAAKVADILQIPAFLCRQTDLIVEVSQTNAIVNIKKGQFMNPKDMQYSVLKALKTRDSSIQSPTYETALKNGVWLCERGSSFGYGNLVVDMRSLKIMREFAPVIFDATHSVQMPGGANGKSSGDSSFPPILPRAAAAVGIDGLFAETHIDPKNALSDGANMLKPDELEHLVTDMLKIQNLF,sabio,Q9ZN55,C=C(OP(=O)(O)O)C(=O)O.O.O=CC(O)C(O)C(O)COP(=O)(O)O>>O=C(O)C1(O)CC(O)C(O)C(C(O)COP(=O)(O)O)O1.O=P(O)(O)O,3906.0,6.8212375482471574e-15,22.0,,2.5.1.55,210.0,3.591732238951836,C=C(OP(=O)(O)O)C(=O)O.O.O=CC(O)C(O)C(O)COP(=O)(O)O,O=C(O)C1(O)CC(O)C(O)C(C(O)COP(=O)(O)O)O1.O=P(O)(O)O,3.591732238951836,C=C(OP(=O)(O)O)C(=O)O.O.O=CC(O)C(O)C(O)COP(=O)(O)O__MKTSNTKTPKPVLIAGPCVIESLENLRSIAIKLQPLANNERLDFYFKASFDKANRTSLESYRGPGLEKGLEMLQTIKDEFGYKILTDVHESYQASVAAKVADILQIPAFLCRQTDLIVEVSQTNAIVNIKKGQFMNPKDMQYSVLKALKTRDSSIQSPTYETALKNGVWLCERGSSFGYGNLVVDMRSLKIMREFAPVIFDATHSVQMPGGANGKSSGDSSFPPILPRAAAAVGIDGLFAETHIDPKNALSDGANMLKPDELEHLVTDMLKIQNLF,./data/raw/alphafold//AF-Q9ZN55-F1-model_v4.pdb,1145,744,438,504
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+111,10048,10199,MKLTKGCAYKYIIFTVLILANILYDNKKRCMIKKNLRISSCGIISRLLKSNSNYNSFNKNYNFTSAISELQFSNFWNLDILQKDIFSNIHNNKNKPQSYIIHKRLMSEKGDNNNNNHQNNNGNDNKKRLGSVVNNEENTCSDKRMKPFEEGHGITQVDKMNNNSDHLQQNGVMNLNSNNVENNNNNNSVVVKKNEPKIHYRKDYKPSGFIINNVTLNINIHDNETIVRSVLDMDISKHNVGEDLVFDGVGLKINEISINNKKLVEGEEYTYDNEFLTIFSKFVPKSKFAFSSEVIIHPETNYALTGLYKSKNIIVSQCEATGFRRITFFIDRPDMMAKYDVTVTADKEKYPVLLSNGDKVNEFEIPGGRHGARFNDPHLKPCYLFAVVAGDLKHLSATYITKYTKKKVELYVFSEEKYVSKLQWALECLKKSMAFDEDYFGLEYDLSRLNLVAVSDFNVGAMENKGLNIFNANSLLASKKNSIDFSYARILTVVGHEYFHNYTGNRVTLRDWFQLTLKEGLTVHRENLFSEEMTKTVTTRLSHVDLLRSVQFLEDSSPLSHPIRPESYVSMENFYTTTVYDKGSEVMRMYLTILGEEYYKKGFDIYIKKNDGNTATCEDFNYAMEQAYKMKKADNSANLNQYLLWFSQSGTPHVSFKYNYDAEKKQYSIHVNQYTKPDENQKEKKPLFIPISVGLINPENGKEMISQTTLELTKESDTFVFNNIAVKPIPSLFRGFSAPVYIEDNLTDEERILLLKYDSDAFVRYNSCTNIYMKQILMNYNEFLKAKNEKLESFNLTPVNAQFIDAIKYLLEDPHADAGFKSYIVSLPQDRYIINFVSNLDTDVLADTKEYIYKQIGDKLNDVYYKMFKSLEAKADDLTYFNDESHVDFDQMNMRTLRNTLLSLLSKAQYPNILNEIIEHSKSPYPSNWLTSLSVSAYFDKYFELYDKTYKLSKDDELLLQEWLKTVSRSDRKDIYEILKKLENEVLKDSKNPNDIRAVYLPFTNNLRRFHDISGKGYKLIAEVITKTDKFNPMVATQLCEPFKLWNKLDTKRQELMLNEMNTMLQEPNISNNLKEYLLRLTNKL,brenda,Q8IEK1,CSCC[C@H](N)C(O)=N[C@@H](Cc1ccccc1)C(=O)O.O>>CSCC[C@H](N)C(=O)O.N[C@@H](Cc1ccccc1)C(=O)O,7.4,1.8050859098339523e-14,37.0,5.0,3.4.11.20,5833.0,0.8692317197309762,CSCC[C@H](N)C(O)=N[C@@H](Cc1ccccc1)C(=O)O.O,CSCC[C@H](N)C(=O)O.N[C@@H](Cc1ccccc1)C(=O)O,0.8750612633917001,CSCC[C@H](N)C(O)=N[C@@H](Cc1ccccc1)C(=O)O.O__MKLTKGCAYKYIIFTVLILANILYDNKKRCMIKKNLRISSCGIISRLLKSNSNYNSFNKNYNFTSAISELQFSNFWNLDILQKDIFSNIHNNKNKPQSYIIHKRLMSEKGDNNNNNHQNNNGNDNKKRLGSVVNNEENTCSDKRMKPFEEGHGITQVDKMNNNSDHLQQNGVMNLNSNNVENNNNNNSVVVKKNEPKIHYRKDYKPSGFIINNVTLNINIHDNETIVRSVLDMDISKHNVGEDLVFDGVGLKINEISINNKKLVEGEEYTYDNEFLTIFSKFVPKSKFAFSSEVIIHPETNYALTGLYKSKNIIVSQCEATGFRRITFFIDRPDMMAKYDVTVTADKEKYPVLLSNGDKVNEFEIPGGRHGARFNDPHLKPCYLFAVVAGDLKHLSATYITKYTKKKVELYVFSEEKYVSKLQWALECLKKSMAFDEDYFGLEYDLSRLNLVAVSDFNVGAMENKGLNIFNANSLLASKKNSIDFSYARILTVVGHEYFHNYTGNRVTLRDWFQLTLKEGLTVHRENLFSEEMTKTVTTRLSHVDLLRSVQFLEDSSPLSHPIRPESYVSMENFYTTTVYDKGSEVMRMYLTILGEEYYKKGFDIYIKKNDGNTATCEDFNYAMEQAYKMKKADNSANLNQYLLWFSQSGTPHVSFKYNYDAEKKQYSIHVNQYTKPDENQKEKKPLFIPISVGLINPENGKEMISQTTLELTKESDTFVFNNIAVKPIPSLFRGFSAPVYIEDNLTDEERILLLKYDSDAFVRYNSCTNIYMKQILMNYNEFLKAKNEKLESFNLTPVNAQFIDAIKYLLEDPHADAGFKSYIVSLPQDRYIINFVSNLDTDVLADTKEYIYKQIGDKLNDVYYKMFKSLEAKADDLTYFNDESHVDFDQMNMRTLRNTLLSLLSKAQYPNILNEIIEHSKSPYPSNWLTSLSVSAYFDKYFELYDKTYKLSKDDELLLQEWLKTVSRSDRKDIYEILKKLENEVLKDSKNPNDIRAVYLPFTNNLRRFHDISGKGYKLIAEVITKTDKFNPMVATQLCEPFKLWNKLDTKRQELMLNEMNTMLQEPNISNNLKEYLLRLTNKL,./data/raw/alphafold//AF-Q8IEK1-F1-model_v4.pdb,1845,1536,3117,1883
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+115,3867,3920,MDFPCLWLGLLLPLVAALDFNYHRQEGMEAFLKTVAQNYSSVTHLHSIGKSVKGRNLWVLVVGRFPKEHRIGIPEFKYVANMHGDETVGRELLLHLIDYLVTSDGKDPEITNLINSTRIHIMPSMNPDGFEAVKKPDCYYSIGRENYNQYDLNRNFPDAFEYNNVSRQPETVAVMKWLKTETFVLSANLHGGALVASYPFDNGVQATGALYSRSLTPDDDVFQYLAHTYASRNPNMKKGDECKNKMNFPNGVTNGYSWYPLQGGMQDYNYIWAQCFEITLELSCCKYPREEKLPSFWNNNKASLIEYIKQVHLGVKGQVFDQNGNPLPNVIVEVQDRKHICPYRTNKYGEYYLLLLPGSYIINVTVPGHDPHITKVIIPEKSQNFSALKKDILLPFQGQLDSIPVSNPSCPMIPLYRNLPDHSAATKPSLFLFLVSLLHIFFK,brenda,P14384,CC(C)C[C@H](N=C(O)CN)C(O)=N[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.O>>CC(C)C[C@H](N=C(O)CN)C(O)=N[C@@H](C)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O,8.2,1.9645890253960047e-14,37.0,7.4,3.4.17.12,9606.0,0.9138138523837168,CC(C)C[C@H](N=C(O)CN)C(O)=N[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.O,CC(C)C[C@H](N=C(O)CN)C(O)=N[C@@H](C)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O,0.9138138523837168,CC(C)C[C@H](N=C(O)CN)C(O)=N[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.O__MDFPCLWLGLLLPLVAALDFNYHRQEGMEAFLKTVAQNYSSVTHLHSIGKSVKGRNLWVLVVGRFPKEHRIGIPEFKYVANMHGDETVGRELLLHLIDYLVTSDGKDPEITNLINSTRIHIMPSMNPDGFEAVKKPDCYYSIGRENYNQYDLNRNFPDAFEYNNVSRQPETVAVMKWLKTETFVLSANLHGGALVASYPFDNGVQATGALYSRSLTPDDDVFQYLAHTYASRNPNMKKGDECKNKMNFPNGVTNGYSWYPLQGGMQDYNYIWAQCFEITLELSCCKYPREEKLPSFWNNNKASLIEYIKQVHLGVKGQVFDQNGNPLPNVIVEVQDRKHICPYRTNKYGEYYLLLLPGSYIINVTVPGHDPHITKVIIPEKSQNFSALKKDILLPFQGQLDSIPVSNPSCPMIPLYRNLPDHSAATKPSLFLFLVSLLHIFFK,./data/raw/alphafold//AF-P14384-F1-model_v4.pdb,1855,1549,3131,1898
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+127,4464,4519,MDLWNLSWFLFLDALLVISGLATPENFDVDGGMDQDIFDINEGLGLDLFEGDIRLDRAQIRNSIIGEKYRWPHTIPYVLEDSLEMNAKGVILNAFERYRLKTCIDFKPWAGETNYISVFKGSGCWSSVGNRRVGKQELSIGANCDRIATVQHEFLHALGFWHEQSRSDRDDYVRIMWDRILSGREHNFNTYSDDISDSLNVPYDYTSVMHYSKTAFQNGTEPTIVTRISDFEDVIGQRMDFSDSDLLKLNQLYNCSSSLSFMDSCSFELENVCGMIQSSGDNADWQRVSQVPRGPESDHSNMGQCQGSGFFMHFDSSSVNVGATAVLESRTLYPKRGFQCLQFYLYNSGSESDQLNIYIREYSADNVDGNLTLVEEIKEIPTGSWQLYHVTLKVTKKFRVVFEGRKGSGASLGGLSIDDINLSETRCPHHIWHIRNFTQFIGSPNGTLYSPPFYSSKGYAFQIYLNLAHVTNAGIYFHLISGANDDQLQWPCPWQQATMTLLDQNPDIRQRMSNQRSITTDPFMTTDNGNYFWDRPSKVGTVALFSNGTQFRRGGGYGTSAFITHERLKSRDFIKGDDVYILLTVEDISHLNSTQIQLTPAPSVQDLCSKTTCKNDGVCTVRDGKAECRCQSGEDWWYMGERCEKRGSTRDTIVIAVSSTVAVFALMLIITLVSVYCTRKKYRERMSSNRPNLTPQNQHAF,brenda,Q16820,CC(C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)CN=C(O)[C@H](CCCCN)N=C(O)[C@@H](N)CCCCN)C(O)=N[C@@H](C)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>CC(C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N)CCCCN)C(O)=N[C@@H](C)C(=O)O.C[C@H](N=C(O)[C@@H](N)CC(=O)O)C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1,20.0,3.1667950540630567,30.0,7.5,3.4.24.63,9606.0,1.3010299956639813,CC(C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)CN=C(O)[C@H](CCCCN)N=C(O)[C@@H](N)CCCCN)C(O)=N[C@@H](C)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1.O,CC(C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N)CCCCN)C(O)=N[C@@H](C)C(=O)O.C[C@H](N=C(O)[C@@H](N)CC(=O)O)C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1,1.3010299956639813,CC(C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)CN=C(O)[C@H](CCCCN)N=C(O)[C@@H](N)CCCCN)C(O)=N[C@@H](C)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MDLWNLSWFLFLDALLVISGLATPENFDVDGGMDQDIFDINEGLGLDLFEGDIRLDRAQIRNSIIGEKYRWPHTIPYVLEDSLEMNAKGVILNAFERYRLKTCIDFKPWAGETNYISVFKGSGCWSSVGNRRVGKQELSIGANCDRIATVQHEFLHALGFWHEQSRSDRDDYVRIMWDRILSGREHNFNTYSDDISDSLNVPYDYTSVMHYSKTAFQNGTEPTIVTRISDFEDVIGQRMDFSDSDLLKLNQLYNCSSSLSFMDSCSFELENVCGMIQSSGDNADWQRVSQVPRGPESDHSNMGQCQGSGFFMHFDSSSVNVGATAVLESRTLYPKRGFQCLQFYLYNSGSESDQLNIYIREYSADNVDGNLTLVEEIKEIPTGSWQLYHVTLKVTKKFRVVFEGRKGSGASLGGLSIDDINLSETRCPHHIWHIRNFTQFIGSPNGTLYSPPFYSSKGYAFQIYLNLAHVTNAGIYFHLISGANDDQLQWPCPWQQATMTLLDQNPDIRQRMSNQRSITTDPFMTTDNGNYFWDRPSKVGTVALFSNGTQFRRGGGYGTSAFITHERLKSRDFIKGDDVYILLTVEDISHLNSTQIQLTPAPSVQDLCSKTTCKNDGVCTVRDGKAECRCQSGEDWWYMGERCEKRGSTRDTIVIAVSSTVAVFALMLIITLVSVYCTRKKYRERMSSNRPNLTPQNQHAF,./data/raw/alphafold//AF-Q16820-F1-model_v4.pdb,2921,1643,3178,1950
+128,10791,10946,MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,uniprot_search,P24155,C[C@H](N=C(O)CN=C(O)c1ccccc1)C(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)O)cc1>>C[C@H](N)C(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)O)cc1.O=C(O)CN=C(O)c1ccccc1,179.0,1.5084389687184063,37.0,8.2,3.4.24.15,10116.0,2.2528530309798933,C[C@H](N=C(O)CN=C(O)c1ccccc1)C(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)O)cc1,C[C@H](N)C(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)O)cc1.O=C(O)CN=C(O)c1ccccc1,2.2528530309798933,C[C@H](N=C(O)CN=C(O)c1ccccc1)C(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)O)cc1__MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,./data/raw/alphafold//AF-P24155-F1-model_v4.pdb,1820,1500,3134,1830
+129,21033,21354,MSSRKELANAIRALSMDAVQKAKSGHPGAPMGMADIAEVLWRDFLNHNPTNPSWADRDRFVLSNGHGSMLIYSLLHLTGYDLPMSELQNFRQLHSKTPGHPEVGYTAGVETTTGPLGQGIANAVGMAIAEKTLAAQFNRPGHDIVDHFTYVFMGDGCMMEGISHEVCSLAGTLKLGKLIAFYDDNGISIDGHVEGWFTDDTAKRFEAYGWHVIRGIDGHDADAIKRATEEARAVTDKPSLLMCKTIIGFGSPNKQGTHDSHGAPLGDAEIALTREQLGWKYAPFEIPSEIYAQWDAKEAGQAKESAWNEKFAAYEKAFPQEAAEFTRRMKGDMPADFDAKANEFIAKLQANPSKIASRKASQNTIEAFGPLLPEFLGGSADLAPSNLTLWSGSKAINEDAAGNYIHYGVREFGMTAIANGIALHGGFLPYTSTFLMFVEYARNAVRMAALMKQRQVMVYTHDSIGLGEDGPTHQPVEQVASLRVTPNMSTWRPCDQVESAVAWKYGVERQDGPTALILSRQNLAQQERTEEQLANIARGGYVLKDCAGQPQIIFIATGSEVELAVAAYEKLTAEGVKARVVSMPSTDAFDKQDAAYRESVLPKAVSARVAIEAGIADYWFKYVGLNGAIVGMTTFGESAPAELLFEEFGFTVDNVIAKAKALL,brenda,A0A0F6B6H7,O=C(CO)[C@@H](O)[C@H](O)COP(=O)(O)O.O=C[C@H](O)[C@H](O)COP(=O)(O)O>>O=C[C@H](O)COP(=O)(O)O.O=P(O)(O)OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,104000.0,6.599079952821045e-15,37.0,7.5,2.2.1.1,90371.0,5.017033339298781,O=C(CO)[C@@H](O)[C@H](O)COP(=O)(O)O.O=C[C@H](O)[C@H](O)COP(=O)(O)O,O=C[C@H](O)COP(=O)(O)O.O=P(O)(O)OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,5.117271295655764,O=C(CO)[C@@H](O)[C@H](O)COP(=O)(O)O.O=C[C@H](O)[C@H](O)COP(=O)(O)O__MSSRKELANAIRALSMDAVQKAKSGHPGAPMGMADIAEVLWRDFLNHNPTNPSWADRDRFVLSNGHGSMLIYSLLHLTGYDLPMSELQNFRQLHSKTPGHPEVGYTAGVETTTGPLGQGIANAVGMAIAEKTLAAQFNRPGHDIVDHFTYVFMGDGCMMEGISHEVCSLAGTLKLGKLIAFYDDNGISIDGHVEGWFTDDTAKRFEAYGWHVIRGIDGHDADAIKRATEEARAVTDKPSLLMCKTIIGFGSPNKQGTHDSHGAPLGDAEIALTREQLGWKYAPFEIPSEIYAQWDAKEAGQAKESAWNEKFAAYEKAFPQEAAEFTRRMKGDMPADFDAKANEFIAKLQANPSKIASRKASQNTIEAFGPLLPEFLGGSADLAPSNLTLWSGSKAINEDAAGNYIHYGVREFGMTAIANGIALHGGFLPYTSTFLMFVEYARNAVRMAALMKQRQVMVYTHDSIGLGEDGPTHQPVEQVASLRVTPNMSTWRPCDQVESAVAWKYGVERQDGPTALILSRQNLAQQERTEEQLANIARGGYVLKDCAGQPQIIFIATGSEVELAVAAYEKLTAEGVKARVVSMPSTDAFDKQDAAYRESVLPKAVSARVAIEAGIADYWFKYVGLNGAIVGMTTFGESAPAELLFEEFGFTVDNVIAKAKALL,./data/raw/alphafold//AF-A0A0F6B6H7-F1-model_v4.pdb,564,3278,5588,6474
+130,21288,21612,MRSTKTIHVISAHAEGEVGDVIVGGVAPPPGDTIWEQSRWIAREQTLRNFVLNEPRGGVFRHVNLLVPPKHPDADAAFIIMEPEDTPPMSGSNSICVSTVLLDSGILPMKEPVTEITLEAPGGLVRVRAECRDGKAERIFVENLPSFAERLDAKLEVEGLGTLTVDTAYGGDSFVIVDAAAMGFALKPDEAHDIARLGVRITNAANAKLGFHHPENPDWRHFSFCLFAGPVERTAEGLRAGAAVAIQPGKVDRSPTGTALSARMAVLHARGQMGLSDRLTAVSLIGSTFSGRILGTTEVGGRPAVLPEISGRAWITGTHQHMLDPSDPWPEGYRLTDTWGAR,sabio,Q92WR9,O=C(O)C1NCCC1O>>O.O=C(O)C1=NCCC1,7.9,1.0795978694382026e-14,25.0,8.0,4.2.1.77,382.0,0.8976270912904415,O=C(O)C1NCCC1O,O.O=C(O)C1=NCCC1,0.8976270912904415,O=C(O)C1NCCC1O__MRSTKTIHVISAHAEGEVGDVIVGGVAPPPGDTIWEQSRWIAREQTLRNFVLNEPRGGVFRHVNLLVPPKHPDADAAFIIMEPEDTPPMSGSNSICVSTVLLDSGILPMKEPVTEITLEAPGGLVRVRAECRDGKAERIFVENLPSFAERLDAKLEVEGLGTLTVDTAYGGDSFVIVDAAAMGFALKPDEAHDIARLGVRITNAANAKLGFHHPENPDWRHFSFCLFAGPVERTAEGLRAGAAVAIQPGKVDRSPTGTALSARMAVLHARGQMGLSDRLTAVSLIGSTFSGRILGTTEVGGRPAVLPEISGRAWITGTHQHMLDPSDPWPEGYRLTDTWGAR,./data/raw/alphafold//AF-Q92WR9-F1-model_v4.pdb,619,3358,5677,6573
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+135,5757,5843,MSSRQPFVRLNDGHCIPALGFGTYKPIEVPKSKSLEAANLAIGVGYRHIDTAYAYQIEEEIGQAIQSNIKAGIVKREDMFITTKLWCTCFQPELVRPSLEKSLKKLQLEHVDLFIMHYPVPMKAGDNDFPLDEQGKLLLDTVDFCATWEALEKCKDAGLVKSIGVSNFNHRQLERILNKPGLKYKPVCNQVECHVYNNQSKLLDYCKSKDIVLVAFGALGTQRYKEWVDQDSPVLLNDPVLCGVAKKNKRSPALIALRYLVQRGVVPLAQSFYESEMKENLQVFEFQLSPEDMKILDGLNKNFRYLPAQFFADHPEYPFSEEY,brenda,A0A097ZMY7,CC1=C(/C=C/C(C)O)C(C)(C)CCC1.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>>CC(=O)/C=C/C1=C(C)CCCC1(C)C.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+],0.053,1.3230845955293418e-14,25.0,7.4,1.1.1.239,10036.0,-1.275724130399211,CC1=C(/C=C/C(C)O)C(C)(C)CCC1.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,CC(=O)/C=C/C1=C(C)CCCC1(C)C.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+],-1.275724130399211,CC1=C(/C=C/C(C)O)C(C)(C)CCC1.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__MSSRQPFVRLNDGHCIPALGFGTYKPIEVPKSKSLEAANLAIGVGYRHIDTAYAYQIEEEIGQAIQSNIKAGIVKREDMFITTKLWCTCFQPELVRPSLEKSLKKLQLEHVDLFIMHYPVPMKAGDNDFPLDEQGKLLLDTVDFCATWEALEKCKDAGLVKSIGVSNFNHRQLERILNKPGLKYKPVCNQVECHVYNNQSKLLDYCKSKDIVLVAFGALGTQRYKEWVDQDSPVLLNDPVLCGVAKKNKRSPALIALRYLVQRGVVPLAQSFYESEMKENLQVFEFQLSPEDMKILDGLNKNFRYLPAQFFADHPEYPFSEEY,./data/raw/alphafold//AF-A0A097ZMY7-F1-model_v4.pdb,1329,1150,6276,1625
+136,3812,3865,MELEKRLKEKLEAPTLDYEKYFSKKALGMKASEVRELLKLVESSDVISLAGGLPAPETFPVEIIAEITKEVLEKHAAQALQYGTTKGFTPLRLALAEWMRKRYDIPISKVDIMITSGSQQALDLIGRVFINPGDIVVVEAPTYLAALQAFKYYEPEFVQIPLDDEGMRVDLLEEKLQELEKEGKKVKLVYTIPTFQNPAGVTMSEKRRKRLLELASEYDFLIVEDNPYGELRYSGEPVKPIKAWDDEGRVMYLGTFSKILAPGFRIGWIAAEPHLIRKLEIAKQSVDLCTNPFSQVIAWKYVEGGHLDNHIPNIIEFYKPRRDAMLKALEEFMPEGVRWTKPEGGMFVWVTLPEGIDTKLMLEKAVAKGVAYVPGEAFFAHRDVKNTMRLNFTYVPEEKIREGIKRLAETIKEEMKK,brenda,A0A060PQX5,CC(C)C[C@H](N)C(=O)O.CCCC(=O)C(=O)[O-]>>CC(C)CC(=O)C(=O)O.CCCC(N)C(=O)[O-],190.0,0.0,90.0,8.0,2.6.1.42,35749.0,2.278753600952829,CC(C)C[C@H](N)C(=O)O.CCCC(=O)C(=O)[O-],CC(C)CC(=O)C(=O)O.CCCC(N)C(=O)[O-],2.278753600952829,CC(C)C[C@H](N)C(=O)O.CCCC(=O)C(=O)[O-]__MELEKRLKEKLEAPTLDYEKYFSKKALGMKASEVRELLKLVESSDVISLAGGLPAPETFPVEIIAEITKEVLEKHAAQALQYGTTKGFTPLRLALAEWMRKRYDIPISKVDIMITSGSQQALDLIGRVFINPGDIVVVEAPTYLAALQAFKYYEPEFVQIPLDDEGMRVDLLEEKLQELEKEGKKVKLVYTIPTFQNPAGVTMSEKRRKRLLELASEYDFLIVEDNPYGELRYSGEPVKPIKAWDDEGRVMYLGTFSKILAPGFRIGWIAAEPHLIRKLEIAKQSVDLCTNPFSQVIAWKYVEGGHLDNHIPNIIEFYKPRRDAMLKALEEFMPEGVRWTKPEGGMFVWVTLPEGIDTKLMLEKAVAKGVAYVPGEAFFAHRDVKNTMRLNFTYVPEEKIREGIKRLAETIKEEMKK,./data/raw/alphafold//AF-A0A060PQX5-F1-model_v4.pdb,1805,1461,3027,1775
+137,1360,1388,MSTAGKVIKCKAAVLWELKKPFSIEEVEVAPPKAHEVRIKMVAAGICRSDEHVVSGNLVTPLPVILGHEAAGIVESVGEGVTTVKPGDKVIPLFTPQCGKCRICKNPESNYCLKNDLGNPRGTLQDGTRRFTCSGKPIHHFVGVSTFSQYTVVDENAVAKIDAASPLEKVCLIGCGFSTGYGSAVKVAKVTPGSTCAVFGLGGVGLSVVMGCKAAGAARIIAVDINKDKFAKAKELGATECINPQDYKKPIQEVLKEMTDGGVDFSFEVIGRLDTMMASLLCCHEACGTSVIVGVPPDSQNLSINPMLLLTGRTWKGAIFGGFKSKESVPKLVADFMAKKFSLDALITNILPFEKINEGFDLLRSGKSIRTVLTF,sabio,P00326,CC(=O)C1CCC2C3CCC4CC(=O)CCC4(C)C3CCC12C.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]>>CC(=O)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C.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)c1,0.022,0.0,37.0,7.3,1.1.1.1,9606.0,-1.6575773191777938,CC(=O)C1CCC2C3CCC4CC(=O)CCC4(C)C3CCC12C.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],CC(=O)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C.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,-1.6575773191777938,CC(=O)C1CCC2C3CCC4CC(=O)CCC4(C)C3CCC12C.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]__MSTAGKVIKCKAAVLWELKKPFSIEEVEVAPPKAHEVRIKMVAAGICRSDEHVVSGNLVTPLPVILGHEAAGIVESVGEGVTTVKPGDKVIPLFTPQCGKCRICKNPESNYCLKNDLGNPRGTLQDGTRRFTCSGKPIHHFVGVSTFSQYTVVDENAVAKIDAASPLEKVCLIGCGFSTGYGSAVKVAKVTPGSTCAVFGLGGVGLSVVMGCKAAGAARIIAVDINKDKFAKAKELGATECINPQDYKKPIQEVLKEMTDGGVDFSFEVIGRLDTMMASLLCCHEACGTSVIVGVPPDSQNLSINPMLLLTGRTWKGAIFGGFKSKESVPKLVADFMAKKFSLDALITNILPFEKINEGFDLLRSGKSIRTVLTF,./data/raw/alphafold//AF-P00326-F1-model_v4.pdb,1323,1999,6213,876
+138,4413,4468,MPGVARLPLLLGLLLLPRPGRPLDLADYTYDLAEEDDSEPLNYKDPCKAAAFLGDIALDEEDLRAFQVQQAVDLRRHTARKSSIKAAVPGNTSTPSCQSTNGQPQRGACGRWRGRSRSRRAATSRPERVWPDGVIPFVIGGNFTGSQRAVFRQAMRHWEKHTCVTFLERTDEDSYIVFTYRPCGCCSYVGRRGGGPQAISIGKNCDKFGIVVHELGHVVGFWHEHTRPDRDRHVSIVRENIQPGQEYNFLKMEPQEVESLGETYDFDSIMHYARNTFSRGIFLDTIVPKYEVNGVKPPIGQRTRLSKGDIAQARKLYKCPACGETLQDSTGNFSSPEYPNGYSAHMHCVWRISVTPGEKIILNFTSLDLYRSRLCWYDYVEVRDGFWRKAPLRGRFCGSKLPEPIVSTDSRLWVEFRSSSNWVGKGFFAVYEAICGGDVKKDYGHIQSPNYPDDYRPSKVCIWRIQVSEGFHVGLTFQSFEIERHDSCAYDYLEVRDGHSESSTLIGRYCGYEKPDDIKSTSSRLWLKFVSDGSINKAGFAVNFFKEVDECSRPNRGGCEQRCLNTLGSYKCSCDPGYELAPDKRRCEAACGGFLTKLNGSITSPGWPKEYPPNKNCIWQLVAPTQYRISLQFDFFETEGNDVCKYDFVEVRSGLTADSKLHGKFCGSEKPEVITSQYNNMRVEFKSDNTVSKKGFKAHFFSDKDECSKDNGGCQQDCVNTFGSYECQCRSGFVLHDNKHDCKEAGCDHKVTSTSGTITSPNWPDKYPSKKECTWAISSTPGHRVKLTFMEMDIESQPECAYDHLEVFDGRDAKAPVLGRFCGSKKPEPVLATGSRMFLRFYSDNSVQRKGFQASHATECGGQVRADVKTKDLYSHAQFGDNNYPGGVDCEWVIVAEEGYGVELVFQTFEVEEETDCGYDYMELFDGYDSTAPRLGRYCGSGPPEEVYSAGDSVLVKFHSDDTITKKGFHLRYTSTKFQDTLHSRK,brenda,P13497,CC(C)[C@H](N=C(O)[C@H](CCC(=N)O)N=C(O)CN=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N)CCC(=N)O)C(O)=N[C@@H](CCC(=O)O)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CS)C(=O)O.O>>,0.016,99.93930631979012,30.0,7.416666666666667,3.4.24.19,9606.0,-1.7958800173440752,CC(C)[C@H](N=C(O)[C@H](CCC(=N)O)N=C(O)CN=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N)CCC(=N)O)C(O)=N[C@@H](CCC(=O)O)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CS)C(=O)O.O,,-1.2291479883578558,CC(C)[C@H](N=C(O)[C@H](CCC(=N)O)N=C(O)CN=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N)CCC(=N)O)C(O)=N[C@@H](CCC(=O)O)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CS)C(=O)O.O__MPGVARLPLLLGLLLLPRPGRPLDLADYTYDLAEEDDSEPLNYKDPCKAAAFLGDIALDEEDLRAFQVQQAVDLRRHTARKSSIKAAVPGNTSTPSCQSTNGQPQRGACGRWRGRSRSRRAATSRPERVWPDGVIPFVIGGNFTGSQRAVFRQAMRHWEKHTCVTFLERTDEDSYIVFTYRPCGCCSYVGRRGGGPQAISIGKNCDKFGIVVHELGHVVGFWHEHTRPDRDRHVSIVRENIQPGQEYNFLKMEPQEVESLGETYDFDSIMHYARNTFSRGIFLDTIVPKYEVNGVKPPIGQRTRLSKGDIAQARKLYKCPACGETLQDSTGNFSSPEYPNGYSAHMHCVWRISVTPGEKIILNFTSLDLYRSRLCWYDYVEVRDGFWRKAPLRGRFCGSKLPEPIVSTDSRLWVEFRSSSNWVGKGFFAVYEAICGGDVKKDYGHIQSPNYPDDYRPSKVCIWRIQVSEGFHVGLTFQSFEIERHDSCAYDYLEVRDGHSESSTLIGRYCGYEKPDDIKSTSSRLWLKFVSDGSINKAGFAVNFFKEVDECSRPNRGGCEQRCLNTLGSYKCSCDPGYELAPDKRRCEAACGGFLTKLNGSITSPGWPKEYPPNKNCIWQLVAPTQYRISLQFDFFETEGNDVCKYDFVEVRSGLTADSKLHGKFCGSEKPEVITSQYNNMRVEFKSDNTVSKKGFKAHFFSDKDECSKDNGGCQQDCVNTFGSYECQCRSGFVLHDNKHDCKEAGCDHKVTSTSGTITSPNWPDKYPSKKECTWAISSTPGHRVKLTFMEMDIESQPECAYDHLEVFDGRDAKAPVLGRFCGSKKPEPVLATGSRMFLRFYSDNSVQRKGFQASHATECGGQVRADVKTKDLYSHAQFGDNNYPGGVDCEWVIVAEEGYGVELVFQTFEVEEETDCGYDYMELFDGYDSTAPRLGRYCGSGPPEEVYSAGDSVLVKFHSDDTITKKGFHLRYTSTKFQDTLHSRK,./data/raw/alphafold//AF-P13497-F1-model_v4.pdb,2923,1646,3251,2041
+139,3063,3105,MFFKQFYDNHLSQASYLVGCQRTGEAIIIDPVRDLSKYIEVADSEGLTITQATETHIHADFASGIRDVAKRLNANIYVSGEGEDALGYKNMPSKTQFVKHGDIIQVGNVKLEVLHTPGHTPESISFLLTDLGGGSSVPMGLFSGDFIFVGDIGRPDLLEKSVQIKGSTEISAKQMYESVQNIKNLPDYVQIWPGHGAGSPCGKALGAIPISTIGYEKINNWAFNEIDETKFIESLTSNQPAPPHHFAQMKQVNQFGMNLYQSYDVYPSLDNKRVAFDLRSKEAFHGGHTKGTINIPYNKNFINQIGWYLDFEKDIDLIGDKSTVEKAKHTLQLIGFDKVAGYRLPKSGISTQSVHSADMTGKEEHVLDVRNDEEWNNGHLDQAVNIPHGKLLNENIPFNKEDKIYVHCQSGVRSSIAVGILESKGFENVVNIREGYQDFPESLK,brenda,G5ELA4,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)=NCCSS.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.O=S([O-])[O-],19.3,0.9522018365550462,25.0,6.0,1.13.11.18,1280.0,1.285557309007774,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)=NCCSS.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.O=S([O-])[O-],1.285557309007774,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)=NCCSS.O=O__MFFKQFYDNHLSQASYLVGCQRTGEAIIIDPVRDLSKYIEVADSEGLTITQATETHIHADFASGIRDVAKRLNANIYVSGEGEDALGYKNMPSKTQFVKHGDIIQVGNVKLEVLHTPGHTPESISFLLTDLGGGSSVPMGLFSGDFIFVGDIGRPDLLEKSVQIKGSTEISAKQMYESVQNIKNLPDYVQIWPGHGAGSPCGKALGAIPISTIGYEKINNWAFNEIDETKFIESLTSNQPAPPHHFAQMKQVNQFGMNLYQSYDVYPSLDNKRVAFDLRSKEAFHGGHTKGTINIPYNKNFINQIGWYLDFEKDIDLIGDKSTVEKAKHTLQLIGFDKVAGYRLPKSGISTQSVHSADMTGKEEHVLDVRNDEEWNNGHLDQAVNIPHGKLLNENIPFNKEDKIYVHCQSGVRSSIAVGILESKGFENVVNIREGYQDFPESLK,./data/raw/alphafold//AF-G5ELA4-F1-model_v4.pdb,1708,1328,6253,1598
+140,14941,15150,MSKFSYLQNGKASTNGVPHANGHHQQHQNGHSNGVARNGGTATDTLPVAYQQKAATSGPFHMPRTEHVGYTYDTLQEIATYLLERTELRPKVGIICGSGLGTLAEQLTDVDSFDYETIPHFPVSTVAGHVGRLVFGYLAGVPVMCMQGRFHHYEGYPLAKCAMPVRVMHLIGCTHLIATNAAGGANPKYRVGDIMLIKDHINLMGFAGNNPLQGPNDERFGPRFFGMANTYDPKLNQQAKVIARQIGIENELREGVYTCLGGPNFETVAEVKMLSMLGVDAIGMSTVHEIITARHCGMTCFAFSLITNMCTMSYEEEEEHCHDSIVGVGKNREKTLGEFVSRIVKHIHYEAKK,brenda,A4Q998,N=c1nc(O)c2ncn([C@H]3C[C@H](O)[C@@H](CO)O3)c2[nH]1.O=P(O)(O)O>>N=c1nc(O)c2nc[nH]c2[nH]1.O=P(O)(O)O[C@@H]1C[C@H](O)[C@@H](CO)O1,5.4,7.771036020332539e-15,27.0,7.4,2.4.2.1,7165.0,0.7323937598229685,N=c1nc(O)c2ncn([C@H]3C[C@H](O)[C@@H](CO)O3)c2[nH]1.O=P(O)(O)O,N=c1nc(O)c2nc[nH]c2[nH]1.O=P(O)(O)O[C@@H]1C[C@H](O)[C@@H](CO)O1,0.7323937598229685,N=c1nc(O)c2ncn([C@H]3C[C@H](O)[C@@H](CO)O3)c2[nH]1.O=P(O)(O)O__MSKFSYLQNGKASTNGVPHANGHHQQHQNGHSNGVARNGGTATDTLPVAYQQKAATSGPFHMPRTEHVGYTYDTLQEIATYLLERTELRPKVGIICGSGLGTLAEQLTDVDSFDYETIPHFPVSTVAGHVGRLVFGYLAGVPVMCMQGRFHHYEGYPLAKCAMPVRVMHLIGCTHLIATNAAGGANPKYRVGDIMLIKDHINLMGFAGNNPLQGPNDERFGPRFFGMANTYDPKLNQQAKVIARQIGIENELREGVYTCLGGPNFETVAEVKMLSMLGVDAIGMSTVHEIITARHCGMTCFAFSLITNMCTMSYEEEEEHCHDSIVGVGKNREKTLGEFVSRIVKHIHYEAKK,./data/raw/alphafold//AF-A4Q998-F1-model_v4.pdb,2477,4904,4976,4830
+141,16306,16533,MAEKPKLHYFNARGRMESTRWLLAAAGVEFEEKFIKSAEDLDKLRNDGYLMFQQVPMVEIDGMKLVQTRAILNYIASKYNLYGKDIKERALIDMYIEGIADLGEMILLLPVCPPEEKDAKLALIKEKIKNRYFPAFEKVLKSHGQDYLVGNKLSRADIHLVELLYYVEELDSSLISSFPLLKALKTRISNLPTVKKFLQPGSPRKPPMDEKSLEEARKIFRF,sabio,P08263,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1>>Cl.NC(CCC(=O)NC(CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)NCC(=O)O)C(=O)O,46.0,2.7843620188059523e-14,25.0,7.5,2.5.1.18,9606.0,1.662757831681574,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1,Cl.NC(CCC(=O)NC(CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)NCC(=O)O)C(=O)O,1.662757831681574,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1__MAEKPKLHYFNARGRMESTRWLLAAAGVEFEEKFIKSAEDLDKLRNDGYLMFQQVPMVEIDGMKLVQTRAILNYIASKYNLYGKDIKERALIDMYIEGIADLGEMILLLPVCPPEEKDAKLALIKEKIKNRYFPAFEKVLKSHGQDYLVGNKLSRADIHLVELLYYVEELDSSLISSFPLLKALKTRISNLPTVKKFLQPGSPRKPPMDEKSLEEARKIFRF,./data/raw/alphafold//AF-P08263-F1-model_v4.pdb,1108,689,3562,2388
+142,1028,1054,MKVAFVQMEPVLLEPEKNYSKAERLVREAAKEGAKLVVLPELFDTGYNFESGDEVYAIAQPIPNGKTTDFLMELAEELDIFIVAGTAEKDRDRLYNSAVVVGPEGYIGKYRKVHLFYRERLFFEPGNLGFRVFDLGSVKLGVMICFDWFFPESARTLALKGADIIAHPANLVMPYAPRAMPIRALENRVYTITADRIGEERGLRFIGLSTIASPRAEVLVQGSEDKEEVGVAEIDLSLARNKRLNELNDIFKDRRPEYYEL,brenda,F8AEP0,CC(=N)O.O>>CC(=O)O.N,5051.0,0.0,60.0,7.6,3.5.1.4,1008460.0,3.7033773685123497,CC(=N)O.O,CC(=O)O.N,3.7033773685123497,CC(=N)O.O__MKVAFVQMEPVLLEPEKNYSKAERLVREAAKEGAKLVVLPELFDTGYNFESGDEVYAIAQPIPNGKTTDFLMELAEELDIFIVAGTAEKDRDRLYNSAVVVGPEGYIGKYRKVHLFYRERLFFEPGNLGFRVFDLGSVKLGVMICFDWFFPESARTLALKGADIIAHPANLVMPYAPRAMPIRALENRVYTITADRIGEERGLRFIGLSTIASPRAEVLVQGSEDKEEVGVAEIDLSLARNKRLNELNDIFKDRRPEYYEL,./data/raw/alphafold//AF-F8AEP0-F1-model_v4.pdb,1181,797,500,571
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+149,17651,17893,MLEQPIGVIDSGVGGLTVAKEIMRQLPKENIIYVGDTKRCPYGPRPEEEVLQYTWELTNYLLENHHIKMLVIACNTATAIALDDIQRSVGIPVVGVIQPGARAAIKVTDNQHIGVIGTENTIKSNAYEEALLALNPDLKVENLACPLLVPFVESGKFLDKTADEIVKTSLYPLKDTSIDSLILGCTHYPILKEAIQRYMGEHVNIISSGDETAREVSTILSYKGLLNQSPIAPDHQFLTTGARDQFAKIADDWFGHEVGHVECISLQEPIKR,brenda,P94556,N[C@H](CCC(=O)O)C(=O)O>>N[C@@H](CCC(=O)O)C(=O)O,8.3,0.0,37.0,8.0,5.1.1.3,1423.0,0.919078092376074,N[C@H](CCC(=O)O)C(=O)O,N[C@@H](CCC(=O)O)C(=O)O,0.919078092376074,N[C@H](CCC(=O)O)C(=O)O__MLEQPIGVIDSGVGGLTVAKEIMRQLPKENIIYVGDTKRCPYGPRPEEEVLQYTWELTNYLLENHHIKMLVIACNTATAIALDDIQRSVGIPVVGVIQPGARAAIKVTDNQHIGVIGTENTIKSNAYEEALLALNPDLKVENLACPLLVPFVESGKFLDKTADEIVKTSLYPLKDTSIDSLILGCTHYPILKEAIQRYMGEHVNIISSGDETAREVSTILSYKGLLNQSPIAPDHQFLTTGARDQFAKIADDWFGHEVGHVECISLQEPIKR,./data/raw/alphafold//AF-P94556-F1-model_v4.pdb,2657,5303,2565,5388
+150,6290,6399,MWCIVLFSLLAWVYAEPTMYGEILSPNYPQAYPSEVEKSWDIEVPEGYGIHLYFTHLDIELSENCAYDSVQIISGDTEEGRLCGQRSSNNPHSPIVEEFQVPYNKLQVIFKSDFSNEERFTGFAAYYVATDINECTDFVDVPCSHFCNNFIGGYFCSCPPEYFLHDDMKNCGVNCSGDVFTALIGEIASPNYPKPYPENSRCEYQIRLEKGFQVVVTLRREDFDVEAADSAGNCLDSLVFVAGDRQFGPYCGHGFPGPLNIETKSNALDIIFQTDLTGQKKGWKLRYHGDPMPCPKEDTPNSVWEPAKAKYVFRDVVQITCLDGFEVVEGRVGATSFYSTCQSNGKWSNSKLKCQPVDCGIPESIENGKVEDPESTLFGSVIRYTCEEPYYYMENGGGGEYHCAGNGSWVNEVLGPELPKCVPVCGVPREPFEEKQRIIGGSDADIKNFPWQVFFDNPWAGGALINEYWVLTAAHVVEGNREPTMYVGSTSVQTSRLAKSKMLTPEHVFIHPGWKLLEVPEGRTNFDNDIALVRLKDPVKMGPTVSPICLPGTSSDYNLMDGDLGLISGWGRTEKRDRAVRLKAARLPVAPLRKCKEVKVEKPTADAEAYVFTPNMICAGGEKGMDSCKGDSGGAFAVQDPNDKTKFYAAGLVSWGPQCGTYGLYTRVKNYVDWIMKTMQENSTPRED,uniprot_search,P09871,CCC(C)[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N=C(O)[C@H](C)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CC(C)C)N=C(O)CN)C(C)O)C(=O)O.O>>CC(C)C[C@H](N=C(O)CN)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.CC[C@H](C)[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N=C(O)[C@H](C)N)[C@@H](C)O)C(=O)O,0.000147,2.510970760956753e-14,37.0,7.4,3.4.21.42,9606.0,-3.832682665251824,CCC(C)[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N=C(O)[C@H](C)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CC(C)C)N=C(O)CN)C(C)O)C(=O)O.O,CC(C)C[C@H](N=C(O)CN)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.CC[C@H](C)[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N=C(O)[C@H](C)N)[C@@H](C)O)C(=O)O,-3.832682665251824,CCC(C)[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N=C(O)[C@H](C)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CC(C)C)N=C(O)CN)C(C)O)C(=O)O.O__MWCIVLFSLLAWVYAEPTMYGEILSPNYPQAYPSEVEKSWDIEVPEGYGIHLYFTHLDIELSENCAYDSVQIISGDTEEGRLCGQRSSNNPHSPIVEEFQVPYNKLQVIFKSDFSNEERFTGFAAYYVATDINECTDFVDVPCSHFCNNFIGGYFCSCPPEYFLHDDMKNCGVNCSGDVFTALIGEIASPNYPKPYPENSRCEYQIRLEKGFQVVVTLRREDFDVEAADSAGNCLDSLVFVAGDRQFGPYCGHGFPGPLNIETKSNALDIIFQTDLTGQKKGWKLRYHGDPMPCPKEDTPNSVWEPAKAKYVFRDVVQITCLDGFEVVEGRVGATSFYSTCQSNGKWSNSKLKCQPVDCGIPESIENGKVEDPESTLFGSVIRYTCEEPYYYMENGGGGEYHCAGNGSWVNEVLGPELPKCVPVCGVPREPFEEKQRIIGGSDADIKNFPWQVFFDNPWAGGALINEYWVLTAAHVVEGNREPTMYVGSTSVQTSRLAKSKMLTPEHVFIHPGWKLLEVPEGRTNFDNDIALVRLKDPVKMGPTVSPICLPGTSSDYNLMDGDLGLISGWGRTEKRDRAVRLKAARLPVAPLRKCKEVKVEKPTADAEAYVFTPNMICAGGEKGMDSCKGDSGGAFAVQDPNDKTKFYAAGLVSWGPQCGTYGLYTRVKNYVDWIMKTMQENSTPRED,./data/raw/alphafold//AF-P09871-F1-model_v4.pdb,1419,932,731,1026
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+154,16782,17012,MNARSTGQHPARYPGAAAGEPTLDSWQEAPHNRWAFARLGELLPTAAVSRRDPATPAEPVVRLDALATRLPDLEQRLEETCTDAFLVLRGSEVLAEYYRAGFAPDDRHLLMSVSKSLCGTVVGALIDEGRIDPAQPVTEYVPELAGSVYDGPSVLQVLDMQISIDYNEDYVDPASEVQTHDRSAGWRTRRDGDPADTYEFLTTLRGDGGTGEFQYCSANTDVLAWIVERVTGLRYVEALSTYLWAKLDADRDATITVDQTGFGFANGGVSCTARDLARVGRMMLDGGVAPGGRVVSQGWVESVLAGGSREAMTDEGFTSAFPEGSYTRQWWCTGNERGNVSGIGIHGQNLWLDPRTDSVIVKLSSWPDPDTRHWHGLQSGILLDVSRALDAV,brenda,P07061,NCCCCCC(O)=NCCCCCC(=O)O.O>>NCCCCCC(=O)O.NCCCCCC(=O)O,1.17,2.1625801354692052e-14,30.0,7.3,3.5.1.46,37931.0,0.0681858617461616,NCCCCCC(O)=NCCCCCC(=O)O.O,NCCCCCC(=O)O.NCCCCCC(=O)O,0.0681858617461616,NCCCCCC(O)=NCCCCCC(=O)O.O__MNARSTGQHPARYPGAAAGEPTLDSWQEAPHNRWAFARLGELLPTAAVSRRDPATPAEPVVRLDALATRLPDLEQRLEETCTDAFLVLRGSEVLAEYYRAGFAPDDRHLLMSVSKSLCGTVVGALIDEGRIDPAQPVTEYVPELAGSVYDGPSVLQVLDMQISIDYNEDYVDPASEVQTHDRSAGWRTRRDGDPADTYEFLTTLRGDGGTGEFQYCSANTDVLAWIVERVTGLRYVEALSTYLWAKLDADRDATITVDQTGFGFANGGVSCTARDLARVGRMMLDGGVAPGGRVVSQGWVESVLAGGSREAMTDEGFTSAFPEGSYTRQWWCTGNERGNVSGIGIHGQNLWLDPRTDSVIVKLSSWPDPDTRHWHGLQSGILLDVSRALDAV,./data/raw/alphafold//AF-P07061-F1-model_v4.pdb,2708,3813,2395,5297
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+167,19642,19928,APSYPRYTREEVGRHRSPEERVWVTHGTDVFDVTDFVELHPGGPDKILLAAGGALEPFWALYAVHGEPHVLELLQQYKVGELSPDEAPAAPDAQDPFAGDPPRHPGLRVNSQKPFNAEPPAELLAERFLTPNELFFTRNHLPVPAVEPSSYRLRVDGPGGRTLSLSLAELRSRFPKHEVTATLQCAGNRRSEMSRVRPVKGLPWDIGAISTARWGGASLRDVLLHAGFPEELQGGEHVCFEGLDADPGGAPYGASIPYGRALSPAADVLLAYEMNGTELPRDHRFPVRVVVPGVVGARSVKWLRRVAVSPDESPSRWQQNDYKGFSPCVDWDTVDYRTAPAIQELPVQSAVTQPRPGAAVPPGELTVKGYAWSGGGREVVRVDVSLDGGRTWKVARLMGDKAPPGRAWAWALWELTVPVEAGTELEIVCKAVDSSYNVQPDSVAPIWNLRGVLSTAWHR,brenda,P07850,O.O=O.O=S([O-])[O-]>>O=S(=O)([O-])[O-].OO,73.0,0.0,25.0,8.5,1.8.3.1,9031.0,1.863322860120456,O.O=O.O=S([O-])[O-],O=S(=O)([O-])[O-].OO,1.863322860120456,O.O=O.O=S([O-])[O-]__APSYPRYTREEVGRHRSPEERVWVTHGTDVFDVTDFVELHPGGPDKILLAAGGALEPFWALYAVHGEPHVLELLQQYKVGELSPDEAPAAPDAQDPFAGDPPRHPGLRVNSQKPFNAEPPAELLAERFLTPNELFFTRNHLPVPAVEPSSYRLRVDGPGGRTLSLSLAELRSRFPKHEVTATLQCAGNRRSEMSRVRPVKGLPWDIGAISTARWGGASLRDVLLHAGFPEELQGGEHVCFEGLDADPGGAPYGASIPYGRALSPAADVLLAYEMNGTELPRDHRFPVRVVVPGVVGARSVKWLRRVAVSPDESPSRWQQNDYKGFSPCVDWDTVDYRTAPAIQELPVQSAVTQPRPGAAVPPGELTVKGYAWSGGGREVVRVDVSLDGGRTWKVARLMGDKAPPGRAWAWALWELTVPVEAGTELEIVCKAVDSSYNVQPDSVAPIWNLRGVLSTAWHR,./data/raw/alphafold//AF-P07850-F1-model_v4.pdb,316,2861,5188,6052
+168,1338,1366,MASKRALVILAKGAEEMETVIPVDVMRRAGIKVTVAGLAGKDPVQCSRDVVICPDASLEDAKKEGPYDVVVLPGGNLGAQNLSESAAVKEILKEQENRKGLIAAICAGPTALLAHEIGFGSKVTTHPLAKDKMMNGGHYTYSENRVEKDGLILTSRGPGTSFEFALAIVEALNGKEVAAQVKAPLVLKD,brenda,Q99497,CC(=O)C(O)SC[C@H](N=C(C)O)C(=O)O.O>>CC(O)=N[C@@H](CS)C(=O)O.C[C@@H](O)C(=O)O,0.42,0.0,22.0,7.0,3.5.1.124,9606.0,-0.3767507096020995,CC(=O)C(O)SC[C@H](N=C(C)O)C(=O)O.O,CC(O)=N[C@@H](CS)C(=O)O.C[C@@H](O)C(=O)O,-0.3767507096020995,CC(=O)C(O)SC[C@H](N=C(C)O)C(=O)O.O__MASKRALVILAKGAEEMETVIPVDVMRRAGIKVTVAGLAGKDPVQCSRDVVICPDASLEDAKKEGPYDVVVLPGGNLGAQNLSESAAVKEILKEQENRKGLIAAICAGPTALLAHEIGFGSKVTTHPLAKDKMMNGGHYTYSENRVEKDGLILTSRGPGTSFEFALAIVEALNGKEVAAQVKAPLVLKD,./data/raw/alphafold//AF-Q99497-F1-model_v4.pdb,1322,3888,6206,869
+169,113,120,MTVRVRLAPSPTGNLHIGTARTAVFNWLYARHRGGKFILRIEDTDRERSRPEYTENILEGLQWLGLTWDEGPYFQSDRLDLYRQAIQTLLDKGLAYYCYCTPEELEALRAEQKAKGQAPRYDNRHRHLTPEEQAAFEAAGRTPVIRFKIEDDRQIEWQDLVRGRVSWQGADLGGDMVIARAAPRGEIGYPLYNLVVVVDDIAMGITDVIRGEDHIGNTPKQILLYEALGATPPNFAHTPLILNSTGQKLSKRDGVTSISDFRAMGYLAPALANYMTLLGWSPPEGVGELFTLDLAAKHFSFERINKAGARFDWDKLNWLNRQYIQQLEPEEFLAELIPLWQGAGYAFDEERDRPWLFDLAQLLQPGLNTLREAIDQGAVFFIPSVTFDSEAMAQLGQPQSATILAYLLEHLPAEPALTVAMGQQLIQQAAKAAGVKKGATMRTLRAALTGAVHGPDLMAAWQILHQRGWDEPRLAAALKQAQTTS,sabio,Q8DLI5,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)C1O.NC(CCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(OC(=O)C(N)CCC(=O)O)C2O)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,0.1,8.663629934182019e-15,37.0,7.5,6.1.1.17,146786.0,-1.0,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)C1O.NC(CCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(OC(=O)C(N)CCC(=O)O)C2O)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,-1.0,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)C1O.NC(CCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MTVRVRLAPSPTGNLHIGTARTAVFNWLYARHRGGKFILRIEDTDRERSRPEYTENILEGLQWLGLTWDEGPYFQSDRLDLYRQAIQTLLDKGLAYYCYCTPEELEALRAEQKAKGQAPRYDNRHRHLTPEEQAAFEAAGRTPVIRFKIEDDRQIEWQDLVRGRVSWQGADLGGDMVIARAAPRGEIGYPLYNLVVVVDDIAMGITDVIRGEDHIGNTPKQILLYEALGATPPNFAHTPLILNSTGQKLSKRDGVTSISDFRAMGYLAPALANYMTLLGWSPPEGVGELFTLDLAAKHFSFERINKAGARFDWDKLNWLNRQYIQQLEPEEFLAELIPLWQGAGYAFDEERDRPWLFDLAQLLQPGLNTLREAIDQGAVFFIPSVTFDSEAMAQLGQPQSATILAYLLEHLPAEPALTVAMGQQLIQQAAKAAGVKKGATMRTLRAALTGAVHGPDLMAAWQILHQRGWDEPRLAAALKQAQTTS,./data/raw/alphafold//AF-Q8DLI5-F1-model_v4.pdb,940,454,93,101
+170,16281,16508,MIWRRAALAGTRLVWSRSGSAGWLDRAAGAAGAAAAAASGMESNTSSSLENLATAPVNQIQETISDNCVVIFSKTSCSYCTMAKKLFHDMNVNYKVVELDLLEYGNQFQDALYKMTGERTVPRIFVNGTFIGGATDTHRLHKEGKLLPLVHQCYLKKSKRKEFQ,sabio,Q9NS18,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O>>NC(CCC(=O)NC(CSSCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O)C(=O)NCC(=O)O)C(=O)O,1.83,33.151206122254,,7.0,1.8.4.2,9606.0,0.2624510897304295,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O,NC(CCC(=O)NC(CSSCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O)C(=O)NCC(=O)O)C(=O)O,0.2764618041732441,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O__MIWRRAALAGTRLVWSRSGSAGWLDRAAGAAGAAAAAASGMESNTSSSLENLATAPVNQIQETISDNCVVIFSKTSCSYCTMAKKLFHDMNVNYKVVELDLLEYGNQFQDALYKMTGERTVPRIFVNGTFIGGATDTHRLHKEGKLLPLVHQCYLKKSKRKEFQ,./data/raw/alphafold//AF-Q9NS18-F1-model_v4.pdb,2556,5007,2098,4962
+171,14996,15207,MKQASAIPQPKTYGPLKNLPHLEKEQLSQSLWRIADELGPIFRFDFPGVSSVFVSGHNLVAEVCDEKRFDKNLGKGLQKVREFGGDGLFTSWTHEPNWQKAHRILLPSFSQKAMKGYHSMMLDIATQLIQKWSRLNPNEEIDVADDMTRLTLDTIGLCGFNYRFNSFYRDSQHPFITSMLRALKEAMNQSKRLGLQDKMMVKTKLQFQKDIEVMNSLVDRMIAERKANPDENIKDLLSLMLYAKDPVTGETLDDENIRYQIITFLIAGHETTSGLLSFAIYCLLTHPEKLKKAQEEADRVLTDDTPEYKQIQQLKYIRMVLNETLRLYPTAPAFSLYAKEDTVLGGEYPISKGQPVTVLIPKLHRDQNAWGPDAEDFRPERFEDPSSIPHHAYKPFGNGQRACIGMQFALQEATMVLGLVLKHFELINHTGYELKIKEALTIKPDDFKITVKPRKTAAINVQRKEQADIKAETKPKETKPKHGTPLLVLFGSNLGTAEGIAGELAAQGRQMGFTAETAPLDDYIGKLPEEGAVVIVTASYNGAPPDNAAGFVEWLKELEEGQLKGVSYAVFGCGNRSWASTYQRIPRLIDDMMKAKGASRLTAIGEGDAADDFESHRESWENRFWKETMDAFDINEIAQKEDRPSLSITFLSEATETPVAKAYGAFEGIVLENRELQTAASTRSTRHIELEIPAGKTYKEGDHIGILPKNSRELVQRVLSRFGLQSNHVIKVSGSAHMAHLPMDRPIKVVDLLSSYVELQEPASRLQLRELASYTVCPPHQKELEQLVSDDGIYKEQVLAKRLTMLDFLEDYPACEMPFERFLALLPSLKPRYYSISSSPKVHANIVSMTVGVVKASAWSGRGEYRGVASNYLAELNTGDAAACFIRTPQSGFQMPNDPETPMIMVGPGTGIAPFRGFIQARSVLKKEGSTLGEALLYFGCRRPDHDDLYREELDQAEQDGLVTIRRCYSRVENEPKGYVQHLLKQDTQKLMTLIEKGAHIYVCGDGSQMAPDVERTLRLAYEAEKAASQEESAVWLQKLQDQRRYVKDVWTGM,sabio,O08336,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]>>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)c1,5724.0,33.41757879737931,30.0,7.4,1.14.14.1,1423.0,3.7576996250877386,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],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)c1,3.7576996250877386,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]__MKQASAIPQPKTYGPLKNLPHLEKEQLSQSLWRIADELGPIFRFDFPGVSSVFVSGHNLVAEVCDEKRFDKNLGKGLQKVREFGGDGLFTSWTHEPNWQKAHRILLPSFSQKAMKGYHSMMLDIATQLIQKWSRLNPNEEIDVADDMTRLTLDTIGLCGFNYRFNSFYRDSQHPFITSMLRALKEAMNQSKRLGLQDKMMVKTKLQFQKDIEVMNSLVDRMIAERKANPDENIKDLLSLMLYAKDPVTGETLDDENIRYQIITFLIAGHETTSGLLSFAIYCLLTHPEKLKKAQEEADRVLTDDTPEYKQIQQLKYIRMVLNETLRLYPTAPAFSLYAKEDTVLGGEYPISKGQPVTVLIPKLHRDQNAWGPDAEDFRPERFEDPSSIPHHAYKPFGNGQRACIGMQFALQEATMVLGLVLKHFELINHTGYELKIKEALTIKPDDFKITVKPRKTAAINVQRKEQADIKAETKPKETKPKHGTPLLVLFGSNLGTAEGIAGELAAQGRQMGFTAETAPLDDYIGKLPEEGAVVIVTASYNGAPPDNAAGFVEWLKELEEGQLKGVSYAVFGCGNRSWASTYQRIPRLIDDMMKAKGASRLTAIGEGDAADDFESHRESWENRFWKETMDAFDINEIAQKEDRPSLSITFLSEATETPVAKAYGAFEGIVLENRELQTAASTRSTRHIELEIPAGKTYKEGDHIGILPKNSRELVQRVLSRFGLQSNHVIKVSGSAHMAHLPMDRPIKVVDLLSSYVELQEPASRLQLRELASYTVCPPHQKELEQLVSDDGIYKEQVLAKRLTMLDFLEDYPACEMPFERFLALLPSLKPRYYSISSSPKVHANIVSMTVGVVKASAWSGRGEYRGVASNYLAELNTGDAAACFIRTPQSGFQMPNDPETPMIMVGPGTGIAPFRGFIQARSVLKKEGSTLGEALLYFGCRRPDHDDLYREELDQAEQDGLVTIRRCYSRVENEPKGYVQHLLKQDTQKLMTLIEKGAHIYVCGDGSQMAPDVERTLRLAYEAEKAASQEESAVWLQKLQDQRRYVKDVWTGM,./data/raw/alphafold//AF-O08336-F1-model_v4.pdb,1826,1506,3080,1840
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+173,3718,3768,MMTTSLIWGIAIAACCCLWLILGIRRRQTGEPPLENGLIPYLGCALQFGANPLEFLRANQRKHGHVFTCKLMGKYVHFITNPLSYHKVLCHGKYFDWKKFHFATSAKAFGHRSIDPMDGNTTENINDTFIKTLQGHALNSLTESMMENLQRIMRPPVSSNSKTAAWVTEGMYSFCYRVMFEAGYLTIFGRDLTRRDTQKAHILNNLDNFKQFDKVFPALVAGLPIHMFRTAHNAREKLAESLRHENLQKRESISELISLRMFLNDTLSTFDDLEKAKTHLVVLWASQANTIPATFWSLFQMIRNPEAMKAATEEVKRTLENAGQKVSLEGNPICLSQAELNDLPVLDSIIKESLRLSSASLNIRTAKEDFTLHLEDGSYNIRKDDIIALYPQLMHLDPEIYPDPLTFKYDRYLDENGKTKTTFYCNGLKLKYYYMPFGSGATICPGRLFAIHEIKQFLILMLSYFELELIEGQAKCPPLDQSRAGLGILPPLNDIEFKYKFKHL,uniprot_search,P22680,CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC=C4C[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]>>CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C(=O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.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,0.04,1.3941511702887823,30.0,7.4,1.14.14.23,9606.0,-1.3979400086720375,CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC=C4C[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C(=O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.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,-1.3979400086720375,CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC=C4C[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]__MMTTSLIWGIAIAACCCLWLILGIRRRQTGEPPLENGLIPYLGCALQFGANPLEFLRANQRKHGHVFTCKLMGKYVHFITNPLSYHKVLCHGKYFDWKKFHFATSAKAFGHRSIDPMDGNTTENINDTFIKTLQGHALNSLTESMMENLQRIMRPPVSSNSKTAAWVTEGMYSFCYRVMFEAGYLTIFGRDLTRRDTQKAHILNNLDNFKQFDKVFPALVAGLPIHMFRTAHNAREKLAESLRHENLQKRESISELISLRMFLNDTLSTFDDLEKAKTHLVVLWASQANTIPATFWSLFQMIRNPEAMKAATEEVKRTLENAGQKVSLEGNPICLSQAELNDLPVLDSIIKESLRLSSASLNIRTAKEDFTLHLEDGSYNIRKDDIIALYPQLMHLDPEIYPDPLTFKYDRYLDENGKTKTTFYCNGLKLKYYYMPFGSGATICPGRLFAIHEIKQFLILMLSYFELELIEGQAKCPPLDQSRAGLGILPPLNDIEFKYKFKHL,./data/raw/alphafold//AF-P22680-F1-model_v4.pdb,1828,1511,3086,1846
+174,10217,10368,MHGSNKLPGFATRAIHHGYDPQDHGGALVPPVYQTATFTFPTVEYGAACFAGEQAGHFYSRISNPTLNLLEARMASLEGGEAGLALASGMGAITSTLWTLLRPGDEVLLGNTLYGCTFAFLHHGIGEFGVKLRHVDMADLQALEAAMTPATRVIYFESPANPNMHMADIAGVAKIARKHGATVVVDNTYCTPYLQRPLELGADLVVHSATKYLSGHGDITAGIVVGSQALVDRIRLQGLKDMTGAVLSPHDAALLMRGIKTLNLRMDRHCANAQVLAEFLARQPQVELIHYPGLASFPQYTLARQQMSQPGGMIAFELKGGIGAGRRFMNALQLFSRAVSLGDAESLAQHPASMTHSSYTPEERAHYGISEGLVRLSVGLEDIDDLLADVQQALKASA,brenda,P13254,CSC[C@H](N)C(=O)O.O>>CC(=O)C(=O)O.CS.N,1.58,9.245658650255366e-15,37.0,8.0,4.4.1.11,303.0,0.1986570869544226,CSC[C@H](N)C(=O)O.O,CC(=O)C(=O)O.CS.N,0.1986570869544226,CSC[C@H](N)C(=O)O.O__MHGSNKLPGFATRAIHHGYDPQDHGGALVPPVYQTATFTFPTVEYGAACFAGEQAGHFYSRISNPTLNLLEARMASLEGGEAGLALASGMGAITSTLWTLLRPGDEVLLGNTLYGCTFAFLHHGIGEFGVKLRHVDMADLQALEAAMTPATRVIYFESPANPNMHMADIAGVAKIARKHGATVVVDNTYCTPYLQRPLELGADLVVHSATKYLSGHGDITAGIVVGSQALVDRIRLQGLKDMTGAVLSPHDAALLMRGIKTLNLRMDRHCANAQVLAEFLARQPQVELIHYPGLASFPQYTLARQQMSQPGGMIAFELKGGIGAGRRFMNALQLFSRAVSLGDAESLAQHPASMTHSSYTPEERAHYGISEGLVRLSVGLEDIDDLLADVQQALKASA,./data/raw/alphafold//AF-P13254-F1-model_v4.pdb,2662,3583,1369,3327
+175,20255,20548,MNRWENIQLTHENRLAPRAYFFSYDSVAQARTFARETSSLFLPLSGQWNFHFFDHPLQVPEAFTSELMADWGHITVPAMWQMEGHGKLQYTDEGFPFPIDVPFVPSDNPTGAYQRIFTLSDGWQGKQTLIKFDGVETYFEVYVNGQYVGFSKGSRLTAEFDISAMVKTGDNLLCVRVMQWADSTYVEDQDMWWSAGIFRDVYLVGKHLTHINDFTVRTDFDEAYCDATLSCEVVLENLAASPVVTTLEYTLFDGERVVHSSAIDHLAIEKLTSASFAFTVEQPQQWSAESPYLYHLVMTLKDANGNVLEVVPQRVGFRDIKVRDGLFWINNRYVMLHGVNRHDNDHRKGRAVGMDRVEKDLQLMKQHNINSVRTAHYPNDPRFYELCDIYGLFVMAETDVESHGFANVGDISRITDDPQWEKVYVERIVRHIHAQKNHPSIIIWSLGNESGYGCNIRAMYHAAKALDDTRLVHYEEDRDAEVVDIISTMYTRVPLMNEFGEYPHPKPRIICEYAHAMGNGPGGLTEYQNVFYKHDCIQGHYVWEWCDHGIQAQDDHGNVWYKFGGDYGDYPNNYNFCLDGLIYSDQTPGPGLKEYKQVIAPVKIHARDLTRGELKVENKLWFTTLDDYTLHAEVRAEGETLATQQIKLRDVAPNSEAPLQITLPQLDAREAFLNITVTKDSRTRYSEAGHPIATYQFPLKENTAQPVPFAPNNARPLTLEDDRLSCTVRGYNFAITFSKMSGKPTSWQVNGESLLTREPKINFFKPMIDNHKQEYEGLWQPNHLQIMQEHLRDFAVEQSDGEVLIISRTVIAPPVFDFGMRCTYIWRIAADGQVNVALSGERYGDYPHIIPCIGFTMGINGEYDQVAYYGRGPGENYADSQQANIIDIWRSTVDAMFENYPFPQNNGNRQHVRWTALTNRHGNGLLVVPQRPINFSAWHYTQENIHAAQHCNELQRSDDITLNLDHQLLGLGSNSWGSEVLDSWRVWFRDFSYGFTLLPVSGGEATAQSLASYEFGAGFFSTNLHSENKQ,sabio,P06864,O.O=[N+]([O-])c1cccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1>>O=[N+]([O-])c1cccc(O)c1.OCC1OC(O)C(O)C(O)C1O,0.72,0.0,25.0,7.5,3.2.1.23,562.0,-0.1426675035687315,O.O=[N+]([O-])c1cccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1,O=[N+]([O-])c1cccc(O)c1.OCC1OC(O)C(O)C(O)C1O,-0.1426675035687315,O.O=[N+]([O-])c1cccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1__MNRWENIQLTHENRLAPRAYFFSYDSVAQARTFARETSSLFLPLSGQWNFHFFDHPLQVPEAFTSELMADWGHITVPAMWQMEGHGKLQYTDEGFPFPIDVPFVPSDNPTGAYQRIFTLSDGWQGKQTLIKFDGVETYFEVYVNGQYVGFSKGSRLTAEFDISAMVKTGDNLLCVRVMQWADSTYVEDQDMWWSAGIFRDVYLVGKHLTHINDFTVRTDFDEAYCDATLSCEVVLENLAASPVVTTLEYTLFDGERVVHSSAIDHLAIEKLTSASFAFTVEQPQQWSAESPYLYHLVMTLKDANGNVLEVVPQRVGFRDIKVRDGLFWINNRYVMLHGVNRHDNDHRKGRAVGMDRVEKDLQLMKQHNINSVRTAHYPNDPRFYELCDIYGLFVMAETDVESHGFANVGDISRITDDPQWEKVYVERIVRHIHAQKNHPSIIIWSLGNESGYGCNIRAMYHAAKALDDTRLVHYEEDRDAEVVDIISTMYTRVPLMNEFGEYPHPKPRIICEYAHAMGNGPGGLTEYQNVFYKHDCIQGHYVWEWCDHGIQAQDDHGNVWYKFGGDYGDYPNNYNFCLDGLIYSDQTPGPGLKEYKQVIAPVKIHARDLTRGELKVENKLWFTTLDDYTLHAEVRAEGETLATQQIKLRDVAPNSEAPLQITLPQLDAREAFLNITVTKDSRTRYSEAGHPIATYQFPLKENTAQPVPFAPNNARPLTLEDDRLSCTVRGYNFAITFSKMSGKPTSWQVNGESLLTREPKINFFKPMIDNHKQEYEGLWQPNHLQIMQEHLRDFAVEQSDGEVLIISRTVIAPPVFDFGMRCTYIWRIAADGQVNVALSGERYGDYPHIIPCIGFTMGINGEYDQVAYYGRGPGENYADSQQANIIDIWRSTVDAMFENYPFPQNNGNRQHVRWTALTNRHGNGLLVVPQRPINFSAWHYTQENIHAAQHCNELQRSDDITLNLDHQLLGLGSNSWGSEVLDSWRVWFRDFSYGFTLLPVSGGEATAQSLASYEFGAGFFSTNLHSENKQ,./data/raw/alphafold//AF-P06864-F1-model_v4.pdb,2003,4160,4028,3873
+176,2023,2054,MDIEAYFERIGYKNSRNKLDLETLTDILEHQIRAVPFENLNMHCGQAMELGLEAIFDHIVRRNRGGWCLQVNQLLYWALTTIGFQTTMLGGYFYIPPVNKYSTGMVHLLLQVTIDGRNYIVDAGSGSSSQMWQPLELISGKDQPQVPCIFCLTEERGIWYLDQIRREQYITNKEFLNSHLLPKKKHQKIYLFTLEPRTIEDFESMNTYLQTSPTSSFITTSFCSLQTPEGVYCLVGFILTYRKFNYKDNTDLVEFKTLTEEEVEEVLRNIFKISLGRNLVPKPGDGSLTI,brenda,P11245,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.Cc1ccccc1N>>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)=Nc1ccccc1C,72.0,0.0,23.0,7.0,2.3.1.5,9606.0,1.8573324964312683,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.Cc1ccccc1N,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)=Nc1ccccc1C,1.8573324964312683,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.Cc1ccccc1N__MDIEAYFERIGYKNSRNKLDLETLTDILEHQIRAVPFENLNMHCGQAMELGLEAIFDHIVRRNRGGWCLQVNQLLYWALTTIGFQTTMLGGYFYIPPVNKYSTGMVHLLLQVTIDGRNYIVDAGSGSSSQMWQPLELISGKDQPQVPCIFCLTEERGIWYLDQIRREQYITNKEFLNSHLLPKKKHQKIYLFTLEPRTIEDFESMNTYLQTSPTSSFITTSFCSLQTPEGVYCLVGFILTYRKFNYKDNTDLVEFKTLTEEEVEEVLRNIFKISLGRNLVPKPGDGSLTI,./data/raw/alphafold//AF-P11245-F1-model_v4.pdb,1479,1020,845,1168
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+180,15565,15789,MDPKYQRVELNDGHFMPVLGFGTYAPPEVPRNRAVEVTKLAIEAGFRHIDSAYLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCTFFQPQMVQPALESSLKKLQLDYVDLYLLHFPMALKPGETPLPKDENGKVIFDTVDLSATWEVMEKCKDAGLAKSIGVSNFNCRQLEMILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAHSALGTQRHKLWVDPNSPVLLEDPVLCALAKKHKQTPALIALRYQLQRGVVVLAKSYNEQRIRENIQVFEFQLTSEDMKVLDGLNRNYRYVVMDFLMDHPDYPFSDEY,sabio,P17516,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=Cc1cccnc1.[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.OCc1cccnc1,600.0,6.655787325118465e-15,25.0,7.4,1.1.1.50,9606.0,2.778151250383644,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=Cc1cccnc1.[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.OCc1cccnc1,2.778151250383644,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=Cc1cccnc1.[H]__MDPKYQRVELNDGHFMPVLGFGTYAPPEVPRNRAVEVTKLAIEAGFRHIDSAYLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCTFFQPQMVQPALESSLKKLQLDYVDLYLLHFPMALKPGETPLPKDENGKVIFDTVDLSATWEVMEKCKDAGLAKSIGVSNFNCRQLEMILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAHSALGTQRHKLWVDPNSPVLLEDPVLCALAKKHKQTPALIALRYQLQRGVVVLAKSYNEQRIRENIQVFEFQLTSEDMKVLDGLNRNYRYVVMDFLMDHPDYPFSDEY,./data/raw/alphafold//AF-P17516-F1-model_v4.pdb,1329,1150,197,212
+181,9047,9189,MVPLVAVVSGPRAQLFACLLRLGTQQVGPLQLHTGASHAARNHYEVLVLGGGSGGITMAARMKRKVGAENVAIVEPSERHFYQPIWTLVGAGAKQLSSSGRPTASVIPSGVEWIKARVTELNPDKNCIHTDDDEKISYRYLIIALGIQLDYEKIKGLPEGFAHPKIGSNYSVKTVEKTWKALQDFKEGNAIFTFPNTPVKCAGAPQKIMYLSEAYFRKTGKRSKANIIFNTSLGAIFGVKKYADALQEIIQERNLTVNYKKNLIEVRADKQEAVFENLDKPGETQVISYEMLHVTPPMSPPDVLKTSPVADAAGWVDVDKETLQHRRYPNVFGIGDCTNLPTSKTAAAVAAQSGILDRTISVIMKNQTPTKKYDGYTSCPLVTGYNRVILAEFDYKAEPLETFPFDQSKERLSMYLMKADLMPFLYWNMMLRGYWGGPAFLRKLFHLGMS,brenda,Q9Y6N5,COC1=C(OC)C(=O)C(CC=C(C)C)=C(C)C1=O.O=S([O-])[O-].[S-2]>>COc1c(O)c(C)c(CC=C(C)C)c(O)c1OC.O=S([O-])([O-])=S,368.0,0.2769740584118533,25.0,7.5,1.8.5.4,9606.0,2.5658478186735176,COC1=C(OC)C(=O)C(CC=C(C)C)=C(C)C1=O.O=S([O-])[O-].[S-2],COc1c(O)c(C)c(CC=C(C)C)c(O)c1OC.O=S([O-])([O-])=S,2.5658478186735176,COC1=C(OC)C(=O)C(CC=C(C)C)=C(C)C1=O.O=S([O-])[O-].[S-2]__MVPLVAVVSGPRAQLFACLLRLGTQQVGPLQLHTGASHAARNHYEVLVLGGGSGGITMAARMKRKVGAENVAIVEPSERHFYQPIWTLVGAGAKQLSSSGRPTASVIPSGVEWIKARVTELNPDKNCIHTDDDEKISYRYLIIALGIQLDYEKIKGLPEGFAHPKIGSNYSVKTVEKTWKALQDFKEGNAIFTFPNTPVKCAGAPQKIMYLSEAYFRKTGKRSKANIIFNTSLGAIFGVKKYADALQEIIQERNLTVNYKKNLIEVRADKQEAVFENLDKPGETQVISYEMLHVTPPMSPPDVLKTSPVADAAGWVDVDKETLQHRRYPNVFGIGDCTNLPTSKTAAAVAAQSGILDRTISVIMKNQTPTKKYDGYTSCPLVTGYNRVILAEFDYKAEPLETFPFDQSKERLSMYLMKADLMPFLYWNMMLRGYWGGPAFLRKLFHLGMS,./data/raw/alphafold//AF-Q9Y6N5-F1-model_v4.pdb,1008,544,200,217
+182,11958,12118,MDYNMDYAPHEVISQQGERFVDKYVDRKILKNKKSLLVIISLSVLSVVGFVLFYFTPNSRKSDLFKNSSVENNNDDYIINSLLKSPNGKKFIVSKIDEALSFYDSKKNDINKYNEGNNNNNADFKGLSLFKENTPSNNFIHNKDYFINFFDNKFLMNNAEHINQFYMFIKTNNKQYNSPNEMKERFQVFLQNAHKVNMHNNNKNSLYKKELNRFADLTYHEFKNKYLSLRSSKPLKNSKYLLDQMNYEEVIKKYRGEENFDHAAYDWRLHSGVTPVKDQKNCGSCWAFSSIGSVESQYAIRKNKLITLSEQELVDCSFKNYGCNGGLINNAFEDMIELGGICPDGDYPYVSDAPNLCNIDRCTEKYGIKNYLSVPDNKLKEALRFLGPISISVAVSDDFAFYKEGIFDGECGDQLNHAVMLVGFGMKEIVNPLTKKGEKHYYYIIKNSWGQQWGERGFINIETDESGLMRKCGLGTDAFIPLIE,sabio,Q9N6S8,Cc1cc(=O)oc2cc(NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)OCc3ccccc3)ccc12.O>>Cc1cc(=O)oc2cc(N)ccc12.N=C(N)NCCCC(NC(=O)C(CCCNC(=N)N)NC(=O)OCc1ccccc1)C(=O)O,0.055,8.878815343120896e-15,37.0,5.5,3.4.22.-,5833.0,-1.259637310505756,Cc1cc(=O)oc2cc(NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)OCc3ccccc3)ccc12.O,Cc1cc(=O)oc2cc(N)ccc12.N=C(N)NCCCC(NC(=O)C(CCCNC(=N)N)NC(=O)OCc1ccccc1)C(=O)O,-0.6382721639824072,Cc1cc(=O)oc2cc(NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)OCc3ccccc3)ccc12.O__MDYNMDYAPHEVISQQGERFVDKYVDRKILKNKKSLLVIISLSVLSVVGFVLFYFTPNSRKSDLFKNSSVENNNDDYIINSLLKSPNGKKFIVSKIDEALSFYDSKKNDINKYNEGNNNNNADFKGLSLFKENTPSNNFIHNKDYFINFFDNKFLMNNAEHINQFYMFIKTNNKQYNSPNEMKERFQVFLQNAHKVNMHNNNKNSLYKKELNRFADLTYHEFKNKYLSLRSSKPLKNSKYLLDQMNYEEVIKKYRGEENFDHAAYDWRLHSGVTPVKDQKNCGSCWAFSSIGSVESQYAIRKNKLITLSEQELVDCSFKNYGCNGGLINNAFEDMIELGGICPDGDYPYVSDAPNLCNIDRCTEKYGIKNYLSVPDNKLKEALRFLGPISISVAVSDDFAFYKEGIFDGECGDQLNHAVMLVGFGMKEIVNPLTKKGEKHYYYIIKNSWGQQWGERGFINIETDESGLMRKCGLGTDAFIPLIE,./data/raw/alphafold//AF-Q9N6S8-F1-model_v4.pdb,1938,4085,1940,3776
+183,18408,18668,MFDPESLKKLAIEIVKKSIEAVFPDRAVKETLPKLNLDRVILVAVGKAAWRMAKAAYEVLGKKIRKGVVVTKYGHSEGPIDDFEIYEAGHPVPDENTIKTTRRVLELVDQLNENDTVLFLLSGGGSSLFELPLEGVSLEEIQKLTSALLKSGASIEEINTVRKHLSQVKGGRFAERVFPAKVVALVLSDVLGDRLDVIASGPAWPDSSTSEDALKVLEKYGIETSESVKRAILQETPKHLSNVEIHLIGNVQKVCDEAKSLAKEKGFNAEIITTSLDCEAREAGRFIASIMKEVKFKDRPLKKPAALIFGGETVVHVKGNGIGGRNQELALSAAIALEGIEGVILCSAGTDGTDGPTDAAGGIVDGSTAKTLKAMGEDPYQYLKNNDSYNALKKSGALLITGPTGTNVNDLIIGLIV,brenda,Q9X1S1,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)[C@H](O)CO>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)[C@@H](CO)OP(=O)(O)O,0.054,0.0,37.0,7.0,2.7.1.165,2336.0,-1.2676062401770316,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)[C@H](O)CO,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)[C@@H](CO)OP(=O)(O)O,-1.2676062401770316,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)[C@H](O)CO__MFDPESLKKLAIEIVKKSIEAVFPDRAVKETLPKLNLDRVILVAVGKAAWRMAKAAYEVLGKKIRKGVVVTKYGHSEGPIDDFEIYEAGHPVPDENTIKTTRRVLELVDQLNENDTVLFLLSGGGSSLFELPLEGVSLEEIQKLTSALLKSGASIEEINTVRKHLSQVKGGRFAERVFPAKVVALVLSDVLGDRLDVIASGPAWPDSSTSEDALKVLEKYGIETSESVKRAILQETPKHLSNVEIHLIGNVQKVCDEAKSLAKEKGFNAEIITTSLDCEAREAGRFIASIMKEVKFKDRPLKKPAALIFGGETVVHVKGNGIGGRNQELALSAAIALEGIEGVILCSAGTDGTDGPTDAAGGIVDGSTAKTLKAMGEDPYQYLKNNDSYNALKKSGALLITGPTGTNVNDLIIGLIV,./data/raw/alphafold//AF-Q9X1S1-F1-model_v4.pdb,44,2514,2803,5649
+184,9980,10130,MAAFLQTNIRLEIIPGRYSSLTDHKFRAPYRIRCAAASPVKKRYNITLLPGDGIGPEVISVAKNVLQKAGFLQGLEFDFQEMPFGGAALDLVGVPLPEETSTAAKQSDAILLGAIGGYKWDKNEKHLRPEMGLLNIRRDLNVFANLRPATVLPQLVDASTLKKEVAQGVDMMIVRELTGGIYFGEPRGITINENGEEVGFNTEIYAAHEIDRIARVAFETARKRRGKLCSVDKANVLDASILWRKRVTALASEYPDVELSHMYVDNAAMQLVRDPKQFDTIVTNNIFGDILSDEASMITGSIGMLPSASLGESGPGLFEPIHGSAPDIAGQDKANPLATILSAAMLLKYGLGEEKAAKMIEDAVVDALNKGFRTGDIYSPGNKLVGCKEMGEEVLKSVDSKVPV,brenda,Q9SA14,CSCCC(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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1>>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+],0.85,13.389739937031155,25.0,7.5,1.1.1.85,3702.0,-0.0705810742857072,CSCCC(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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,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+],-0.0705810742857072,CSCCC(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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MAAFLQTNIRLEIIPGRYSSLTDHKFRAPYRIRCAAASPVKKRYNITLLPGDGIGPEVISVAKNVLQKAGFLQGLEFDFQEMPFGGAALDLVGVPLPEETSTAAKQSDAILLGAIGGYKWDKNEKHLRPEMGLLNIRRDLNVFANLRPATVLPQLVDASTLKKEVAQGVDMMIVRELTGGIYFGEPRGITINENGEEVGFNTEIYAAHEIDRIARVAFETARKRRGKLCSVDKANVLDASILWRKRVTALASEYPDVELSHMYVDNAAMQLVRDPKQFDTIVTNNIFGDILSDEASMITGSIGMLPSASLGESGPGLFEPIHGSAPDIAGQDKANPLATILSAAMLLKYGLGEEKAAKMIEDAVVDALNKGFRTGDIYSPGNKLVGCKEMGEEVLKSVDSKVPV,./data/raw/alphafold//AF-Q9SA14-F1-model_v4.pdb,2913,1629,3230,2011
+185,20592,20898,MTSQSTTPLGNLEETPKPDIRFPSDFVWGVATASFQIEGSTTADGRGPSIWDTFCATPGKVENGDTGDPACDHYNRYRDDVALMRELGVGAYRFSIAWPRIQPEGKGTPVEAGLDFYDRLVDCLLEAGIEPWPTLYHWDLPQALEDAGGWPNRDTAKRFADYAEIVYRRLGDRITNWNTLNEPWCSAFLGYASGVHAPGRQEPAAALAAAHHLMLGHGLAAAVMRDLAGQAGRSVRIGVAHNQTTVRPYTDSEADRDAARRIDALRNRIFTEPLVKGRYPEDLIEDVAAVTDYSFVQDGDLKTISANLDMMGVNFYNPSWVSGNRENGGSDRLPDEGYSPSVGSEHVVEVDPGLPVTAMGWPIDPTGLYDTLTRLANDYPGLPLYITENGAAFEDKVVDGAVHDTERIAYLDSHLRAAHAAIEAGVPLKGYFAWSFMDNFEWALGYGKRFGIVHVDYESQTRTVKDSGWWYSRVMRNGGIFGQE,uniprot_search,Q9LAV5,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>>OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O,16.3,0.0,25.0,7.2,3.2.1.21,2021.0,1.212187604403958,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,OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O,1.212187604403958,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__MTSQSTTPLGNLEETPKPDIRFPSDFVWGVATASFQIEGSTTADGRGPSIWDTFCATPGKVENGDTGDPACDHYNRYRDDVALMRELGVGAYRFSIAWPRIQPEGKGTPVEAGLDFYDRLVDCLLEAGIEPWPTLYHWDLPQALEDAGGWPNRDTAKRFADYAEIVYRRLGDRITNWNTLNEPWCSAFLGYASGVHAPGRQEPAAALAAAHHLMLGHGLAAAVMRDLAGQAGRSVRIGVAHNQTTVRPYTDSEADRDAARRIDALRNRIFTEPLVKGRYPEDLIEDVAAVTDYSFVQDGDLKTISANLDMMGVNFYNPSWVSGNRENGGSDRLPDEGYSPSVGSEHVVEVDPGLPVTAMGWPIDPTGLYDTLTRLANDYPGLPLYITENGAAFEDKVVDGAVHDTERIAYLDSHLRAAHAAIEAGVPLKGYFAWSFMDNFEWALGYGKRFGIVHVDYESQTRTVKDSGWWYSRVMRNGGIFGQE,./data/raw/alphafold//AF-Q9LAV5-F1-model_v4.pdb,221,3168,5463,6346
+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
+187,17641,17883,MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG,sabio,P14902,N[C@H](CC(=O)c1ccccc1N=CO)C(=O)O.O=O>>N[C@H](CC(=O)c1ccccc1N=CO)C(=O)O,42332.4,6.330571448920964,37.0,6.5,1.13.11.52,9606.0,4.62667289113429,N[C@H](CC(=O)c1ccccc1N=CO)C(=O)O.O=O,N[C@H](CC(=O)c1ccccc1N=CO)C(=O)O,4.62667289113429,N[C@H](CC(=O)c1ccccc1N=CO)C(=O)O.O=O__MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG,./data/raw/alphafold//AF-P14902-F1-model_v4.pdb,2630,3525,1301,3252
+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
+195,12171,12335,MEPHRPNVKTAVPLSLESYHISEEYGFLLPDSLKELPDHYRPWMEIANKLPQLIDAHQLQAHVDKMPLLSCQFLKGHREQRLAHLVLSFLTMGYVWQEGEAQPAEVLPRNLALPFVEVSRNLGLPPILVHSDLVLTNWTKKDPDGFLEIGNLETIISFPGGESLHGFILVTALVEKEAVPGIKALVQATNAILQPNQEALLQALQRLRLSIQDITKTLGQMHDYVDPDIFYAGIRIFLSGWKDNPAMPAGLMYEGVSQEPLKYSGGSAAQSTVLHAFDEFLGIRHSKESGDFLYRMRDYMPPSHKAFIEDIHSAPSLRDYILSSGQDHLLTAYNQCVQALAELRSYHITMVTKYLITAAAKAKHGKPNHLPGPPQALKDRGTGGTAVMSFLKSVRDKTLESILHPRG,brenda,Q6ZQW0,Cc1ccc2c(CC(N)C(=O)O)c[nH]c2c1.O=O>>Cc1cccc(N=CO)c1C(=O)CC(N)C(=O)O,0.108,1.1334498923408608e-14,25.0,7.5,1.13.11.52,9606.0,-0.9665762445130504,Cc1ccc2c(CC(N)C(=O)O)c[nH]c2c1.O=O,Cc1cccc(N=CO)c1C(=O)CC(N)C(=O)O,-0.9665762445130504,Cc1ccc2c(CC(N)C(=O)O)c[nH]c2c1.O=O__MEPHRPNVKTAVPLSLESYHISEEYGFLLPDSLKELPDHYRPWMEIANKLPQLIDAHQLQAHVDKMPLLSCQFLKGHREQRLAHLVLSFLTMGYVWQEGEAQPAEVLPRNLALPFVEVSRNLGLPPILVHSDLVLTNWTKKDPDGFLEIGNLETIISFPGGESLHGFILVTALVEKEAVPGIKALVQATNAILQPNQEALLQALQRLRLSIQDITKTLGQMHDYVDPDIFYAGIRIFLSGWKDNPAMPAGLMYEGVSQEPLKYSGGSAAQSTVLHAFDEFLGIRHSKESGDFLYRMRDYMPPSHKAFIEDIHSAPSLRDYILSSGQDHLLTAYNQCVQALAELRSYHITMVTKYLITAAAKAKHGKPNHLPGPPQALKDRGTGGTAVMSFLKSVRDKTLESILHPRG,./data/raw/alphafold//AF-Q6ZQW0-F1-model_v4.pdb,2630,5367,1302,3253
+196,4583,4639,MTVFSAIPPISCWFTGRTPASWDKTMDMQTSFLDRLFEEGLLIETGVDGLYGRSGQFEDVIAAFERLIDRTGGADGAEAIRFPPGINRAYFEKSGYMKSFPQLAGTVHSFCGCELDHVSLLKSMDEGGDWTKDQKATDIVLTPAACYPLYPTIAKRGALPAGGGLYDIQSYCFRHEPSKDPARQQLFRMREYVCMGTESDVTEFRQTWMDRGVEMMKAVGLDVTIDIANDPFFGRAGKMLANNQRDQNLKFELLIPVTSATNPTACMSFNYHQDAFGQKWGLNLENGDVAHTACVGFGLERIALALFAHHGLDVKKWPAKVVETLWG,sabio,Q7CWR3,CC(N)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>O=P(O)(O)OP(=O)(O)O,2.3,53.95724470460458,30.0,7.5,6.2.1.n2,358.0,0.3617278360175928,CC(N)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,O=P(O)(O)OP(=O)(O)O,0.3617278360175928,CC(N)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MTVFSAIPPISCWFTGRTPASWDKTMDMQTSFLDRLFEEGLLIETGVDGLYGRSGQFEDVIAAFERLIDRTGGADGAEAIRFPPGINRAYFEKSGYMKSFPQLAGTVHSFCGCELDHVSLLKSMDEGGDWTKDQKATDIVLTPAACYPLYPTIAKRGALPAGGGLYDIQSYCFRHEPSKDPARQQLFRMREYVCMGTESDVTEFRQTWMDRGVEMMKAVGLDVTIDIANDPFFGRAGKMLANNQRDQNLKFELLIPVTSATNPTACMSFNYHQDAFGQKWGLNLENGDVAHTACVGFGLERIALALFAHHGLDVKKWPAKVVETLWG,./data/raw/alphafold//AF-Q7CWR3-F1-model_v4.pdb,993,523,172,186
+197,15674,15901,MTALSPIPVFDAADTAALLAYPALLATLGQAVADYAAGEIVSPERLVVPLQAGGVMLSMPSSARDLATHKLVNVCPGNGARGLPTILGQVTAYDASTGEMRFALDGPTVTGRRTAAVTALGIQALHGAAPRDILLIGTGKQAANHAEALAAIFPEARLHVRGTSADSAAAFCAAHRAQAPRLVPLDGDAIPDAIDVVVTLTTSRTPVYREAAREGRLVVGVGAFTADAAEIDANTVRASRLVVDDPAGARHEAGDLIVAQVDWQHVASLADVLGGTFDRSGPLLFKSVGCAAWDLAACRTARDALAARRAG,sabio,V5YW53,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]>>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=C(O)C1CC(O)CN1,37260.0,7.955422768350326,30.0,6.5,1.5.1.-,192.0,4.571242850560224,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],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=C(O)C1CC(O)CN1,4.571242850560224,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]__MTALSPIPVFDAADTAALLAYPALLATLGQAVADYAAGEIVSPERLVVPLQAGGVMLSMPSSARDLATHKLVNVCPGNGARGLPTILGQVTAYDASTGEMRFALDGPTVTGRRTAAVTALGIQALHGAAPRDILLIGTGKQAANHAEALAAIFPEARLHVRGTSADSAAAFCAAHRAQAPRLVPLDGDAIPDAIDVVVTLTTSRTPVYREAAREGRLVVGVGAFTADAAEIDANTVRASRLVVDDPAGARHEAGDLIVAQVDWQHVASLADVLGGTFDRSGPLLFKSVGCAAWDLAACRTARDALAARRAG,./data/raw/alphafold//AF-V5YW53-F1-model_v4.pdb,2568,5026,2121,3874
+198,13556,13733,MSTYPINAPGQSADAAVLIVGGGPTGLIAANELLRRGVSCRMIDRLPVAHQTSKSCTIHARSMEMMEHIGIAARYIETGVRSNGFTFNFENTDANALLDFSVLPGRYPFITIYNQNETERVLRHDLEATYSFQPEWGTQLLALNQDENGIRADLRLKDGTKQTISPRWVIGADGVRSRVRECLGIAYEGEDYEENVLQMMDVGIQDFEAGDDWIHYFIGQDKFVFVTKLPGSNYRVIISDLGGANKSNLEETREAFQGYLSSFDDHATLDEPRWATKWRVWKRMATAYRKGNVFLAGDAAHCHSPSGGSGMNVGMQDAFNLGWKIAMVERGEAKPDLLDTYHTERTPVAQQLLEGTHAMHEIIMGHGKGLTDRIELTQAPGWHDAATYRVSGMSYNYRDQLVSFNDDRLAGPSAGDRIPDAELAPRIRLFDLVRNTRPTLLVAPATEAEVAEAEKLRDLIREQWPLVKPVLVRPQGSEESIEGDVHVDSYGQLKREWGDNAKGWAALLRPDNYIHARAGLDRGDLLVQAIDAMLVRCA,brenda,P42535,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.Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O.Oc1c(Cl)c(Cl)c(O)c(Cl)c1Cl.[Cl-],0.02,0.0481940153360259,22.0,7.0,1.14.13.50,46429.0,-1.6989700043360187,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.Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O.Oc1c(Cl)c(Cl)c(O)c(Cl)c1Cl.[Cl-],-1.6989700043360187,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.Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl.[H+]__MSTYPINAPGQSADAAVLIVGGGPTGLIAANELLRRGVSCRMIDRLPVAHQTSKSCTIHARSMEMMEHIGIAARYIETGVRSNGFTFNFENTDANALLDFSVLPGRYPFITIYNQNETERVLRHDLEATYSFQPEWGTQLLALNQDENGIRADLRLKDGTKQTISPRWVIGADGVRSRVRECLGIAYEGEDYEENVLQMMDVGIQDFEAGDDWIHYFIGQDKFVFVTKLPGSNYRVIISDLGGANKSNLEETREAFQGYLSSFDDHATLDEPRWATKWRVWKRMATAYRKGNVFLAGDAAHCHSPSGGSGMNVGMQDAFNLGWKIAMVERGEAKPDLLDTYHTERTPVAQQLLEGTHAMHEIIMGHGKGLTDRIELTQAPGWHDAATYRVSGMSYNYRDQLVSFNDDRLAGPSAGDRIPDAELAPRIRLFDLVRNTRPTLLVAPATEAEVAEAEKLRDLIREQWPLVKPVLVRPQGSEESIEGDVHVDSYGQLKREWGDNAKGWAALLRPDNYIHARAGLDRGDLLVQAIDAMLVRCA,./data/raw/alphafold//AF-P42535-F1-model_v4.pdb,3787,4588,4525,4430
+199,9679,9825,MSFKTLSALVLALGAAVQFTSAAVPRVQKRATCADGRTTANAACCVLFPILDDIQENLFDGGQCGEEVHESLRLTFHDAIGFSPTLGGGGADGSIITFDTIETVFPANAGIDEIVSAQKPFVAKHNISAGDFIQFAGAVGVSNCPGGVRIPFFLGRPDAVAASPDHLVPEPFDSVDTILARMGDAGFSAVEVVWLLASHSIAAADLVDPSIPGTPFDSTPGVFDSQFFIETQLKGRLFPGTPDNKGEVQSPLQGEIRLQSDHLLARDPQTACEWQSMVNNQPKIQNRFAATMSKMALLGQDKSKLIDCSDVIPTPPALVGAAHLPAGFSLSDVEQACAETPFPALTADPGPVTSVPPVPGS,brenda,Q4QZ27,COc1ccc(CO)cc1OC.OO.[H+]>>COc1ccc(C=O)cc1OC.O,1600.0,4.897722737863834,30.0,4.5,1.11.1.16,98349.0,3.204119982655925,COc1ccc(CO)cc1OC.OO.[H+],COc1ccc(C=O)cc1OC.O,3.204119982655925,COc1ccc(CO)cc1OC.OO.[H+]__MSFKTLSALVLALGAAVQFTSAAVPRVQKRATCADGRTTANAACCVLFPILDDIQENLFDGGQCGEEVHESLRLTFHDAIGFSPTLGGGGADGSIITFDTIETVFPANAGIDEIVSAQKPFVAKHNISAGDFIQFAGAVGVSNCPGGVRIPFFLGRPDAVAASPDHLVPEPFDSVDTILARMGDAGFSAVEVVWLLASHSIAAADLVDPSIPGTPFDSTPGVFDSQFFIETQLKGRLFPGTPDNKGEVQSPLQGEIRLQSDHLLARDPQTACEWQSMVNNQPKIQNRFAATMSKMALLGQDKSKLIDCSDVIPTPPALVGAAHLPAGFSLSDVEQACAETPFPALTADPGPVTSVPPVPGS,./data/raw/alphafold//AF-Q4QZ27-F1-model_v4.pdb,3565,2335,1054,2401
+200,19821,20107,MSDDTRYMYPARKAHAMDLDSSLNPEGDQKQRWGSAASIAEVMSPTAEIKPSAPQVTHFGTGLGVQSSTGDLTLQDADSDGDKTEVVNEFDLAAYSKEDLTQTLHRRIMSRMFSAFDVTQVGYLDINKLKELCVYVGRNMSPEASEKMFDELKGIDGHITFDVFWNWWTTYPDTKMTKDTFSLVSADFSVPYHQQQLKIKEEGEIFTPSYRVKYYFKDMETGLRRRVSPWHDIPLYVRDPVRTKPESIRANRYNFICEIPKWTRAKFEIATDEPFNPIKQDIKNGVPRFYKHGDMMWNYGAFPQTWESTEVIFEDGVSGDNDPIDGVEIGMRQMRVGEVHPVRILGVLGMIDDGQMDWKVICMSVNDPVARFIKDIDDIPKFLPGCLDALREWFRVYKICQGGVENKFAFNGEYKDKTYAMKVVDESHYMWENLRKIKKKEEV,brenda,Q7Z031,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)O>>,131.0,99.63894615604023,37.0,8.0,7.1.3.1,5659.0,2.1172712956557644,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)O,,2.1172712956557644,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)O__MSDDTRYMYPARKAHAMDLDSSLNPEGDQKQRWGSAASIAEVMSPTAEIKPSAPQVTHFGTGLGVQSSTGDLTLQDADSDGDKTEVVNEFDLAAYSKEDLTQTLHRRIMSRMFSAFDVTQVGYLDINKLKELCVYVGRNMSPEASEKMFDELKGIDGHITFDVFWNWWTTYPDTKMTKDTFSLVSADFSVPYHQQQLKIKEEGEIFTPSYRVKYYFKDMETGLRRRVSPWHDIPLYVRDPVRTKPESIRANRYNFICEIPKWTRAKFEIATDEPFNPIKQDIKNGVPRFYKHGDMMWNYGAFPQTWESTEVIFEDGVSGDNDPIDGVEIGMRQMRVGEVHPVRILGVLGMIDDGQMDWKVICMSVNDPVARFIKDIDDIPKFLPGCLDALREWFRVYKICQGGVENKFAFNGEYKDKTYAMKVVDESHYMWENLRKIKKKEEV,./data/raw/alphafold//AF-Q7Z031-F1-model_v4.pdb,354,2916,5253,6119
+201,5907,6000,MEPFTNDRLQLPRNMIENSMFEEEPDVVDLAKEPCLHPLEPDEVEYEPRGSRLLVRGLGEHEMEEDEEDYESSAKLLGMSFMNRSSGLRNSATGYRQSPDGACSVPSARTMVVCAFVIVVAVSVIMVIYLLPRCTFTKEGCHKKNQSIGLIQPFATNGKLFPWAQIRLPTAVVPLRYELSLHPNLTSMTFRGSVTISVQALQVTWNIILHSTGHNISRVTFMSAVSSQEKQAEILEYAYHGQIAIVAPEALLAGHNYTLKIEYSANISSSYYGFYGFSYTDESNEKKYFAATQFEPLAARSAFPCFDEPAFKATFIIKIIRDEQYTALSNMPKKSSVVLDDGLVQDEFSESVKMSTYLVAFIVGEMKNLSQDVNGTLVSIYAVPEKIGQVHYALETTVKLLEFFQNYFEIQYPLKKLDLVAIPDFEAGAMENWGLLTFREETLLYDSNTSSMADRKLVTKIIAHELAHQWFGNLVTMKWWNDLWLNEGFATFMEYFSLEKIFKELSSYEDFLDARFKTMKKDSLNSSHPISSSVQSSEQIEEMFDSLSYFKGSSLLLMLKTYLSEDVFQHAVVLYLHNHSYASIQSDDLWDSFNEVTNQTLDVKRMMKTWTLQKGFPLVTVQKKGKELFIQQERFFLNMKPEIQPSDTSYLWHIPLSYVTEGRNYSKYQSVSLLDKKSGVINLTEEVLWVKVNINMNGYYIVHYADDDWEALIHQLKINPYVLSDKDRANLINNIFELAGLGKVPLKRAFDLINYLGNENHTAPITEALFQTDLIYNLLEKLGYMDLASRLVTRVFKLLQNQIQQQTWTDEGTPSMRELRSALLEFACTHNLGNCSTTAMKLFDDWMASNGTQSLPTDVMTTVFKVGAKTDKGWSFLLGKYISIGSEAEKNKILEALASSEDVRKLYWLMKSSLNGDNFRTQKLSFIIRTVGRHFPGHLLAWDFVKENWNKLVQKFPLGSYTIQNIVAGSTYLFSTKTHLSEVQAFFENQSEATFRLRCVQEALEVIQLNIQWMEKNLKSLTWWL,uniprot_search,Q9UIQ6,CC1=CCOc2cc(N=C(O)[C@@H](N)CSCc3ccccc3)ccc21.O>>Cc1cc(=O)oc2cc(N)ccc12.N[C@@H](CSCc1ccccc1)C(=O)O,12.4,1.8399579979551568,37.0,7.5,3.4.11.3,9606.0,1.0934216851622351,CC1=CCOc2cc(N=C(O)[C@@H](N)CSCc3ccccc3)ccc21.O,Cc1cc(=O)oc2cc(N)ccc12.N[C@@H](CSCc1ccccc1)C(=O)O,1.0934216851622351,CC1=CCOc2cc(N=C(O)[C@@H](N)CSCc3ccccc3)ccc21.O__MEPFTNDRLQLPRNMIENSMFEEEPDVVDLAKEPCLHPLEPDEVEYEPRGSRLLVRGLGEHEMEEDEEDYESSAKLLGMSFMNRSSGLRNSATGYRQSPDGACSVPSARTMVVCAFVIVVAVSVIMVIYLLPRCTFTKEGCHKKNQSIGLIQPFATNGKLFPWAQIRLPTAVVPLRYELSLHPNLTSMTFRGSVTISVQALQVTWNIILHSTGHNISRVTFMSAVSSQEKQAEILEYAYHGQIAIVAPEALLAGHNYTLKIEYSANISSSYYGFYGFSYTDESNEKKYFAATQFEPLAARSAFPCFDEPAFKATFIIKIIRDEQYTALSNMPKKSSVVLDDGLVQDEFSESVKMSTYLVAFIVGEMKNLSQDVNGTLVSIYAVPEKIGQVHYALETTVKLLEFFQNYFEIQYPLKKLDLVAIPDFEAGAMENWGLLTFREETLLYDSNTSSMADRKLVTKIIAHELAHQWFGNLVTMKWWNDLWLNEGFATFMEYFSLEKIFKELSSYEDFLDARFKTMKKDSLNSSHPISSSVQSSEQIEEMFDSLSYFKGSSLLLMLKTYLSEDVFQHAVVLYLHNHSYASIQSDDLWDSFNEVTNQTLDVKRMMKTWTLQKGFPLVTVQKKGKELFIQQERFFLNMKPEIQPSDTSYLWHIPLSYVTEGRNYSKYQSVSLLDKKSGVINLTEEVLWVKVNINMNGYYIVHYADDDWEALIHQLKINPYVLSDKDRANLINNIFELAGLGKVPLKRAFDLINYLGNENHTAPITEALFQTDLIYNLLEKLGYMDLASRLVTRVFKLLQNQIQQQTWTDEGTPSMRELRSALLEFACTHNLGNCSTTAMKLFDDWMASNGTQSLPTDVMTTVFKVGAKTDKGWSFLLGKYISIGSEAEKNKILEALASSEDVRKLYWLMKSSLNGDNFRTQKLSFIIRTVGRHFPGHLLAWDFVKENWNKLVQKFPLGSYTIQNIVAGSTYLFSTKTHLSEVQAFFENQSEATFRLRCVQEALEVIQLNIQWMEKNLKSLTWWL,./data/raw/alphafold//AF-Q9UIQ6-F1-model_v4.pdb,3178,1973,3618,2457
+202,21713,22038,MNQPTSRSGLTTFTVIIIGLLALFLLIGGIWLATLGGSIYYIIAGVLLLIVAWQLYKRASTALWFYAALMLGTIIWSVWEVGTDFWALAPRLDILGILGLWLLVPAVTRGINNLGSSKVALSSTLAIAIVLMVYSIFNDPQEINGEIKTPQPETAQAVPGVAESDWPAYGRTQAGVRYSPLKQINDQNVKDLKVAWTLRTGDLKTDNDSGETTNQVTPIKIGNNMFICTAHQQLIAIDPATGKEKWRFDPKLKTDKSFQHLTCRGVMYYDANNTTEFATSLQSKKSSSTQCPRKVFVPVNDGRLVAVNADTGKACTDFGQNGQVNLQEFMPYAYPGGYNPTSPGIVTGSTVVIAGSVTDNYSNKEPSGVIRGYDVNTGKLLWVFDTGAADPNAMPGEGTTFVHNSPNAWAPLAYDAKLDIVYVPTGVGTPDIWGGDRTELKERYANSMLAINASTGKLVWNFQTTHHDLWDMDVPSQPSLADIKNKAGQTVPAIYVLTKTGNAFVLDRRNGQPIVPVTEKPVPQTVKRGPQTKGEFYSKTQPFSDLNLAPQDKLTDKDMWGATMLDQLMCRVSFKRLNYDGIYTPPSENGTLVFPGNLGVFEWGGMSVNPDRQVAVMNPIGLPFVSRLIPADPNRAQTAKGAGTEQGVQPMYGVPYGVEISAFLSPLGLPCKQPAWGYVAGVDLKTHEVVWKKRIGTIRDSLPNLFQLPAVKIGVPGLGGSISTAGNVMFVGATQDNYLRAFNVTNGKKLWEARLPAGGQATPMTYEINGKQYVVIMAGGHGSFGTKMGDYLVAYALPDNK,uniprot_search,P05465,O=C1C(Cl)=CC(=Nc2ccc(O)cc2)C=C1Cl.OC[C@H]1O[C@@H](O)C[C@@H](O)[C@@H]1O>>O=C1C[C@@H](O)[C@H](O)[C@@H](CO)O1.Oc1ccc(Nc2cc(Cl)c(O)c(Cl)c2)cc1,331.0,1.3135212189041408e-14,25.0,6.75,1.1.99.35,471.0,2.519827993775719,O=C1C(Cl)=CC(=Nc2ccc(O)cc2)C=C1Cl.OC[C@H]1O[C@@H](O)C[C@@H](O)[C@@H]1O,O=C1C[C@@H](O)[C@H](O)[C@@H](CO)O1.Oc1ccc(Nc2cc(Cl)c(O)c(Cl)c2)cc1,2.519827993775719,O=C1C(Cl)=CC(=Nc2ccc(O)cc2)C=C1Cl.OC[C@H]1O[C@@H](O)C[C@@H](O)[C@@H]1O__MNQPTSRSGLTTFTVIIIGLLALFLLIGGIWLATLGGSIYYIIAGVLLLIVAWQLYKRASTALWFYAALMLGTIIWSVWEVGTDFWALAPRLDILGILGLWLLVPAVTRGINNLGSSKVALSSTLAIAIVLMVYSIFNDPQEINGEIKTPQPETAQAVPGVAESDWPAYGRTQAGVRYSPLKQINDQNVKDLKVAWTLRTGDLKTDNDSGETTNQVTPIKIGNNMFICTAHQQLIAIDPATGKEKWRFDPKLKTDKSFQHLTCRGVMYYDANNTTEFATSLQSKKSSSTQCPRKVFVPVNDGRLVAVNADTGKACTDFGQNGQVNLQEFMPYAYPGGYNPTSPGIVTGSTVVIAGSVTDNYSNKEPSGVIRGYDVNTGKLLWVFDTGAADPNAMPGEGTTFVHNSPNAWAPLAYDAKLDIVYVPTGVGTPDIWGGDRTELKERYANSMLAINASTGKLVWNFQTTHHDLWDMDVPSQPSLADIKNKAGQTVPAIYVLTKTGNAFVLDRRNGQPIVPVTEKPVPQTVKRGPQTKGEFYSKTQPFSDLNLAPQDKLTDKDMWGATMLDQLMCRVSFKRLNYDGIYTPPSENGTLVFPGNLGVFEWGGMSVNPDRQVAVMNPIGLPFVSRLIPADPNRAQTAKGAGTEQGVQPMYGVPYGVEISAFLSPLGLPCKQPAWGYVAGVDLKTHEVVWKKRIGTIRDSLPNLFQLPAVKIGVPGLGGSISTAGNVMFVGATQDNYLRAFNVTNGKKLWEARLPAGGQATPMTYEINGKQYVVIMAGGHGSFGTKMGDYLVAYALPDNK,./data/raw/alphafold//AF-P05465-F1-model_v4.pdb,3521,3456,1201,3128
+203,6588,6701,AKPAAENLSLVVHGPGDLRLENYPIPEPGPNEVLLKMHSVGICGSDVHYWQGRIGDFVVKKPMVLGHEASGTVVKVGSLVRHLQPGDRVAIQPGAPRQTDEFCKIGRYNLSPTIFFCATPPDDGNLCRFYKHNANFCYKLPDNVTFEEGALIEPLSVGIHACRRAGVTLGNKVLVCGAGPIGLVNLLAAKAMGAAQVVVTDLSASRLSKAKEVGADFILEISNESPEEIAKKVEGLLGSKPEVTIECTGVETSIQAGIYATHSGGTLVLVGLGSEMTSVPLVHAATREVDIKGVFRYCNTWPMAISMLASKSVNVKPLVTHRFPLEKALEAFETSKKGLGLKVMIKCDPSDQNP,sabio,P07846,CCCC(C(CO)O)O.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>>NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],0.075,9.014526621225343,23.5,7.4,1.1.1.14,9940.0,-1.1249387366083,CCCC(C(CO)O)O.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,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],-0.2006594505464183,CCCC(C(CO)O)O.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__AKPAAENLSLVVHGPGDLRLENYPIPEPGPNEVLLKMHSVGICGSDVHYWQGRIGDFVVKKPMVLGHEASGTVVKVGSLVRHLQPGDRVAIQPGAPRQTDEFCKIGRYNLSPTIFFCATPPDDGNLCRFYKHNANFCYKLPDNVTFEEGALIEPLSVGIHACRRAGVTLGNKVLVCGAGPIGLVNLLAAKAMGAAQVVVTDLSASRLSKAKEVGADFILEISNESPEEIAKKVEGLLGSKPEVTIECTGVETSIQAGIYATHSGGTLVLVGLGSEMTSVPLVHAATREVDIKGVFRYCNTWPMAISMLASKSVNVKPLVTHRFPLEKALEAFETSKKGLGLKVMIKCDPSDQNP,./data/raw/alphafold//AF-P07846-F1-model_v4.pdb,2358,553,213,231
+204,8485,8616,MAGLGHPAAFGRATHAVVRALPESLGQHALRSAKGEEVDVARAERQHQLYVGVLGSKLGLQVVELPADESLPDCVFVEDVAVVCEETALITRPGAPSRRKEVDMMKEALEKLQLNIVEMKDENATLDGGDVLFTGREFFVGLSKRTNQRGAEILADTFKDYAVSTVPVADGLHLKSFCSMAGPNLIAIGSSESAQKALKIMQQMSDHRYDKLTVPDDIAANCIYLNIPNKGHVLLHRTPEEYPESAKVYEKLKDHMLIPVSMSELEKVDGLLTCCSVLINKKVDS,brenda,O94760,CN(C)C(=N)NCCC[C@H](N)C(=O)O.O>>CNC.N=C(O)NCCC[C@H](N)C(=O)O,0.014,6.436862621426536e-15,37.0,7.95,3.5.3.18,9606.0,-1.853871964321762,CN(C)C(=N)NCCC[C@H](N)C(=O)O.O,CNC.N=C(O)NCCC[C@H](N)C(=O)O,-1.853871964321762,CN(C)C(=N)NCCC[C@H](N)C(=O)O.O__MAGLGHPAAFGRATHAVVRALPESLGQHALRSAKGEEVDVARAERQHQLYVGVLGSKLGLQVVELPADESLPDCVFVEDVAVVCEETALITRPGAPSRRKEVDMMKEALEKLQLNIVEMKDENATLDGGDVLFTGREFFVGLSKRTNQRGAEILADTFKDYAVSTVPVADGLHLKSFCSMAGPNLIAIGSSESAQKALKIMQQMSDHRYDKLTVPDDIAANCIYLNIPNKGHVLLHRTPEEYPESAKVYEKLKDHMLIPVSMSELEKVDGLLTCCSVLINKKVDS,./data/raw/alphafold//AF-O94760-F1-model_v4.pdb,3432,2337,1056,2958
+205,19420,19706,CGVPAIQPVLSGLSRIVNGEEAVPGSWPWQVSLQDKTGFHFCGGSLINENWVVTAAHCGVTTSDVVVAGEFDQGSSSEKIQKLKIAKVFKNSKYNSLTINNDITLLKLSTAASFSQTVSAVCLPSASDDFAAGTTCVTTGWGLTRYTNANTPDRLQQASLPLLSNTNCKKYWGTKIKDAMICAGASGVSSCMGDSGGPLVCKKNGAWTLVGIVSWGSSTCSTSTPGVYARVTALVNWVQQTLAAN,brenda,P00766,O.O=C(Oc1ccc([N+](=O)[O-])cc1)c1ccccc1>>O=C(O)c1ccccc1.O=[N+]([O-])c1ccc(O)cc1,0.017,1.0859046979327796e-14,27.0,7.8,3.4.21.1,9913.0,-1.769551078621726,O.O=C(Oc1ccc([N+](=O)[O-])cc1)c1ccccc1,O=C(O)c1ccccc1.O=[N+]([O-])c1ccc(O)cc1,-1.3279021420642825,O.O=C(Oc1ccc([N+](=O)[O-])cc1)c1ccccc1__CGVPAIQPVLSGLSRIVNGEEAVPGSWPWQVSLQDKTGFHFCGGSLINENWVVTAAHCGVTTSDVVVAGEFDQGSSSEKIQKLKIAKVFKNSKYNSLTINNDITLLKLSTAASFSQTVSAVCLPSASDDFAAGTTCVTTGWGLTRYTNANTPDRLQQASLPLLSNTNCKKYWGTKIKDAMICAGASGVSSCMGDSGGPLVCKKNGAWTLVGIVSWGSSTCSTSTPGVYARVTALVNWVQQTLAAN,./data/raw/alphafold//AF-P00766-F1-model_v4.pdb,3744,1024,850,1175
+206,19730,20016,MIEDLHVHSTMSDGSDTFEQVLEQAAQRGVERLAFTNHDTTAGLTAARELGERLGVQVVGGIEVSAYDFERGRKVHILGLGVEEGAPALAALCGSTLERRHANSLWQLDRLVEAGYEVDVERALELGRASTCLYKQHLMAALTSEPYPSAAYRTLYRSLFKNGGICDRDIDYVDARDAVRVVVEDGGLAVLAHPGQLDSYDLLPDLVECGLGGIERFHPDHTLADHARCAELAVRYRLVCTGGSDYHGKFGRVPHVGFRVPA,brenda,C8WJZ5,O.O=P(O)(O)OC[C@H]1O[C@@H]2OP(=O)(O)O[C@@H]2[C@@H]1O>>O=P(O)(O)OC[C@H]1OC(O)[C@H](OP(=O)(O)O)[C@@H]1O,2.0,0.0,25.0,8.0,3.1.4.57,84112.0,0.3010299956639812,O.O=P(O)(O)OC[C@H]1O[C@@H]2OP(=O)(O)O[C@@H]2[C@@H]1O,O=P(O)(O)OC[C@H]1OC(O)[C@H](OP(=O)(O)O)[C@@H]1O,0.3010299956639812,O.O=P(O)(O)OC[C@H]1O[C@@H]2OP(=O)(O)O[C@@H]2[C@@H]1O__MIEDLHVHSTMSDGSDTFEQVLEQAAQRGVERLAFTNHDTTAGLTAARELGERLGVQVVGGIEVSAYDFERGRKVHILGLGVEEGAPALAALCGSTLERRHANSLWQLDRLVEAGYEVDVERALELGRASTCLYKQHLMAALTSEPYPSAAYRTLYRSLFKNGGICDRDIDYVDARDAVRVVVEDGGLAVLAHPGQLDSYDLLPDLVECGLGGIERFHPDHTLADHARCAELAVRYRLVCTGGSDYHGKFGRVPHVGFRVPA,./data/raw/alphafold//AF-C8WJZ5-F1-model_v4.pdb,335,2884,5213,6078
+207,7942,8070,MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,brenda,A0A077JBW9,CCOP(=O)(OCC)Oc1ccc([N+](=O)[O-])cc1.O>>CCOP(=O)(O)OCC.O=[N+]([O-])c1ccc(O)cc1,6.5,0.0,30.0,8.5,3.1.8.1,453246.0,0.8129133566428556,CCOP(=O)(OCC)Oc1ccc([N+](=O)[O-])cc1.O,CCOP(=O)(O)OCC.O=[N+]([O-])c1ccc(O)cc1,1.505149978319906,CCOP(=O)(OCC)Oc1ccc([N+](=O)[O-])cc1.O__MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,./data/raw/alphafold//AF-A0A077JBW9-F1-model_v4.pdb,3110,1877,3509,2328
+208,11957,12117,MESSGPSSCHSAARRPLHSAQAVDVASASSFRAFEILHLHLDLRAEFGPPGPGPGSRGLNGKATLELRCLLPEGASELRLDSHSCLEVMAATLLRGQPGDQQQLTEPVPFHTQPFSHYGQALCVVFPKPCCAAERFRLELTYRVGEGPGVCWLAPEQTAGKKKPFVYTQGQAVLNRAFFPCFDTPAVKCTYSALVEVPDGFTAVMSASTWERRGPNKFFFQMSQPIPSYLIALAIGDLASAEVGPRSRVWAEPCLIEAAKEEYNGVIEEFLATGEKLFGPYVWGRYDLLFMPPSFPFGGMENPCLTFVTPCLLAGDRSLADVIIHEISHSWFGNLVTNANWGEFWLNEGFTMYAQRRISTILFGAAYTCLEAATGRALLRQHMDVSGEENPLNKLRVKIEPGVDPDDTYNETPYEKGYCFVSYLAHLVGDQEQFDKFLKAYVDEFKFQSILAEDFLEFYLEYFPELKKKGVDSIPGFEFNRWLNTPGWPPYLPDLSPGDSLMKPAEELAELWAASEPDMQAIEAVAISTWKTYQLVYFLDKILQKSPLPPGNVKKLGETYPKISNAQNAELRLRWGQIILKNDHQEEFWKVKDFLQSQGKQKYTLPLYHAMMGGSEMARTLAKETFSATASQLHSNVVNYVQQILAPKGS,uniprot_search,O09175,Cc1cc(=O)oc2cc(N=C(O)[C@H](N)CCCNC(=N)N)ccc12.O>>Cc1cc(=O)oc2cc(N)ccc12.N=C(N)NCCC[C@H](N)C(=O)O,43.0,8.123018148624577e-15,28.0,7.4,3.4.11.6,10116.0,1.6334684555795866,Cc1cc(=O)oc2cc(N=C(O)[C@H](N)CCCNC(=N)N)ccc12.O,Cc1cc(=O)oc2cc(N)ccc12.N=C(N)NCCC[C@H](N)C(=O)O,1.6334684555795866,Cc1cc(=O)oc2cc(N=C(O)[C@H](N)CCCNC(=N)N)ccc12.O__MESSGPSSCHSAARRPLHSAQAVDVASASSFRAFEILHLHLDLRAEFGPPGPGPGSRGLNGKATLELRCLLPEGASELRLDSHSCLEVMAATLLRGQPGDQQQLTEPVPFHTQPFSHYGQALCVVFPKPCCAAERFRLELTYRVGEGPGVCWLAPEQTAGKKKPFVYTQGQAVLNRAFFPCFDTPAVKCTYSALVEVPDGFTAVMSASTWERRGPNKFFFQMSQPIPSYLIALAIGDLASAEVGPRSRVWAEPCLIEAAKEEYNGVIEEFLATGEKLFGPYVWGRYDLLFMPPSFPFGGMENPCLTFVTPCLLAGDRSLADVIIHEISHSWFGNLVTNANWGEFWLNEGFTMYAQRRISTILFGAAYTCLEAATGRALLRQHMDVSGEENPLNKLRVKIEPGVDPDDTYNETPYEKGYCFVSYLAHLVGDQEQFDKFLKAYVDEFKFQSILAEDFLEFYLEYFPELKKKGVDSIPGFEFNRWLNTPGWPPYLPDLSPGDSLMKPAEELAELWAASEPDMQAIEAVAISTWKTYQLVYFLDKILQKSPLPPGNVKKLGETYPKISNAQNAELRLRWGQIILKNDHQEEFWKVKDFLQSQGKQKYTLPLYHAMMGGSEMARTLAKETFSATASQLHSNVVNYVQQILAPKGS,./data/raw/alphafold//AF-O09175-F1-model_v4.pdb,1937,4084,1939,3775
+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
+214,16068,16295,MFATRQAFNLFQKRAFSASARQSSKVAILGAAGGIGQPLSLLMKLNPRVTELALYDIRGGPGVAADLSHINTNSTVTGYQPTPEGLRDALKGSEIVLIPAGVPRKRGMTRDDLFNTNASIVRDLAKAAADACPNANILVISNPVNSTVPIVAEVFKSKGVYNPKRLFGVTTLDVVRASRFISEVKNTDPANEEVTVVGGHSGVTIVPLISQSNHPDIEGETRDKLVNRIQFGGDEGVKAKDGAGSAALSMAFAGARSPSLCSSGQGVKGVVKPSFVDSPLYKDQGIDFFASRVELGPNGAEKVLPVGKVSPYEEKLLEAAFADLKKNIQKGIDFVKNNP,sabio,Q8X1C8,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.O=C(O)CC(O)C(=O)O>>NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)CC(=O)C(=O)O.[H],2900.0,7.114097664129157e-15,30.0,7.4,1.1.1.37,68825.0,3.462397997898956,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.O=C(O)CC(O)C(=O)O,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)CC(=O)C(=O)O.[H],3.462397997898956,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.O=C(O)CC(O)C(=O)O__MFATRQAFNLFQKRAFSASARQSSKVAILGAAGGIGQPLSLLMKLNPRVTELALYDIRGGPGVAADLSHINTNSTVTGYQPTPEGLRDALKGSEIVLIPAGVPRKRGMTRDDLFNTNASIVRDLAKAAADACPNANILVISNPVNSTVPIVAEVFKSKGVYNPKRLFGVTTLDVVRASRFISEVKNTDPANEEVTVVGGHSGVTIVPLISQSNHPDIEGETRDKLVNRIQFGGDEGVKAKDGAGSAALSMAFAGARSPSLCSSGQGVKGVVKPSFVDSPLYKDQGIDFFASRVELGPNGAEKVLPVGKVSPYEEKLLEAAFADLKKNIQKGIDFVKNNP,./data/raw/alphafold//AF-Q8X1C8-F1-model_v4.pdb,2247,4985,2068,4928
+215,13281,13456,MSVRRLTVCIVGAGPRGLSVLERFCAHERKSASHPAVTVHVVDPARPGAGRVWRTGQPRQLLMNTVASQVTVFTDGSVDMAGPVEAGPSLHEWARELAALTPVEELLGGHDDATLAEARALGADSYPTRAFYGCYLEEMFRRVVCGAPAHLEVRVHRSTAVSLADETPGSGGAQSLLLADGTRLAGLDAVVLALGHVRAEEPGAPDPRAAALGLAHFPPANPADLDLSGIAPGTPVLLRGLGLNFFDHMALFTLGRGGAFSRRPHGLRYHPSGLEPRLYAGSRRGVPYHARGENEKGVDGRHTPLLLTPERIAELTGRHREGPGLSFLRTLWPLIAREVECVYYGTLLASRGRAAERDAFVTAYLAGGDDTDRGGVLERFGIGPADRWCWERTASPHPRHGFTGPDGHRRWLLEHLAQDVRRARAGNVSDPHKAALDVLRDLRNEIRLVVDHGGLDGLSHRDDLDGWYTGLNAFLSIGPPASRIEEMAALIEAGVLDVVGPGLEVDIDEADAAFVARSPLVPGRPVRAHVLIEARLPVTDLRRTADPLLRDLLRSGQCRSYRIPAGRAPEGYETGGLEVTRRPYRLVDALGRAHPRRFAFGVPTEAVHWVTAAGARPGVNSVTLGDADAIAHAVASLTPAAAPRLPAYEDPGVRCPSDDRLTEVTA,brenda,A0A0K2JL70,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.N[C@@H](CC(=O)O)C(=O)O.O=O.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O.O=C(O)C[C@H](NO)C(=O)O,1.14,6.2325986597876834e-15,,,1.14.13.248,66881.0,0.0569048513364725,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.N[C@@H](CC(=O)O)C(=O)O.O=O.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O.O=C(O)C[C@H](NO)C(=O)O,0.0569048513364725,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.N[C@@H](CC(=O)O)C(=O)O.O=O.[H+]__MSVRRLTVCIVGAGPRGLSVLERFCAHERKSASHPAVTVHVVDPARPGAGRVWRTGQPRQLLMNTVASQVTVFTDGSVDMAGPVEAGPSLHEWARELAALTPVEELLGGHDDATLAEARALGADSYPTRAFYGCYLEEMFRRVVCGAPAHLEVRVHRSTAVSLADETPGSGGAQSLLLADGTRLAGLDAVVLALGHVRAEEPGAPDPRAAALGLAHFPPANPADLDLSGIAPGTPVLLRGLGLNFFDHMALFTLGRGGAFSRRPHGLRYHPSGLEPRLYAGSRRGVPYHARGENEKGVDGRHTPLLLTPERIAELTGRHREGPGLSFLRTLWPLIAREVECVYYGTLLASRGRAAERDAFVTAYLAGGDDTDRGGVLERFGIGPADRWCWERTASPHPRHGFTGPDGHRRWLLEHLAQDVRRARAGNVSDPHKAALDVLRDLRNEIRLVVDHGGLDGLSHRDDLDGWYTGLNAFLSIGPPASRIEEMAALIEAGVLDVVGPGLEVDIDEADAAFVARSPLVPGRPVRAHVLIEARLPVTDLRRTADPLLRDLLRSGQCRSYRIPAGRAPEGYETGGLEVTRRPYRLVDALGRAHPRRFAFGVPTEAVHWVTAAGARPGVNSVTLGDADAIAHAVASLTPAAAPRLPAYEDPGVRCPSDDRLTEVTA,./data/raw/alphafold//AF-A0A0K2JL70-F1-model_v4.pdb,3760,4541,4464,4358
+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
+218,22895,23237,MAYFPNVSKITYSGKQLKSGLSFNHYNPKELVGGKTMEEQLRFSVAFWHTFTESGTDPFGAGSKIRPWDRFTGMDLAKARVEAAFEFFEKLGNPYFCFHDRDIAPEGDTLRETNKNLDVIVAMIKDYMKTSKVKLLWNTANMFTNPRFVHGAASSCNADVFAYAAAQVKKGLEVGKELGAENYVFWGGREGYETLLNTDLKLEQDNLARFFHMAVDYAKEIGFDAQFLLEPKPKEPTKHQYDFDAATTIAFLKTYDLDQHFKLNLEANHATLAGHTFEHEIRVARTHGLLGSLDANQGDPLLGWDTDEFPTDLYSTTLAMYEVLKNGGLGRGGLNFDAKTRRASFTDEDLFYAHIAGMDSFALGLKVANRLIEDRVFDAFIEERYSSYKEGIGADIVSGKADFKSLENYILDKKEIINQSGRLEQLKNTLNHYIVQEAYQSVNA,sabio,A0A290GAT0,OCC1(O)OCC(O)C1O>>OC1COC(O)C(O)C1O,1.4,0.0,35.0,7.0,5.3.1.5,1398.0,0.1461280356782379,OCC1(O)OCC(O)C1O,OC1COC(O)C(O)C1O,1.0413926851582251,OCC1(O)OCC(O)C1O__MAYFPNVSKITYSGKQLKSGLSFNHYNPKELVGGKTMEEQLRFSVAFWHTFTESGTDPFGAGSKIRPWDRFTGMDLAKARVEAAFEFFEKLGNPYFCFHDRDIAPEGDTLRETNKNLDVIVAMIKDYMKTSKVKLLWNTANMFTNPRFVHGAASSCNADVFAYAAAQVKKGLEVGKELGAENYVFWGGREGYETLLNTDLKLEQDNLARFFHMAVDYAKEIGFDAQFLLEPKPKEPTKHQYDFDAATTIAFLKTYDLDQHFKLNLEANHATLAGHTFEHEIRVARTHGLLGSLDANQGDPLLGWDTDEFPTDLYSTTLAMYEVLKNGGLGRGGLNFDAKTRRASFTDEDLFYAHIAGMDSFALGLKVANRLIEDRVFDAFIEERYSSYKEGIGADIVSGKADFKSLENYILDKKEIINQSGRLEQLKNTLNHYIVQEAYQSVNA,./data/raw/alphafold//AF-A0A290GAT0-F1-model_v4.pdb,844,3275,5583,6469
+219,6594,6707,MSSGIHVALVTGGNKGIGLAIVRDLCRLFSGDVVLTARDVTRGQAAVQQLQAEGLSPRFHQLDIDDLQSIRALRDFLRKEYGGLDVLVNNAGIAFKVADPTPFHIQAEVTMKTNFFGTRDVCTELLPLIKPQGRVVNVSSIMSVRALKSCSPELQQKFRSETITEEELVGLMNKFVEDTKKGVHQKEGWPSSAYGVTKIGVTVLSRIHARKLSEQRKGDKILLNACCPGWVRTDMAGPKATKSPEEGAETPVYLALLPPDAEGPHGQFVSEKRVEQW,brenda,P16152,CCCC(CC=O)SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=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+]>>CCCC(CCO)SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=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)c1,30.5,0.0,25.0,8.4,1.1.1.184,9606.0,1.484299839346786,CCCC(CC=O)SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=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+],CCCC(CCO)SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=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)c1,1.484299839346786,CCCC(CC=O)SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=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+]__MSSGIHVALVTGGNKGIGLAIVRDLCRLFSGDVVLTARDVTRGQAAVQQLQAEGLSPRFHQLDIDDLQSIRALRDFLRKEYGGLDVLVNNAGIAFKVADPTPFHIQAEVTMKTNFFGTRDVCTELLPLIKPQGRVVNVSSIMSVRALKSCSPELQQKFRSETITEEELVGLMNKFVEDTKKGVHQKEGWPSSAYGVTKIGVTVLSRIHARKLSEQRKGDKILLNACCPGWVRTDMAGPKATKSPEEGAETPVYLALLPPDAEGPHGQFVSEKRVEQW,./data/raw/alphafold//AF-P16152-F1-model_v4.pdb,1319,3880,4509,857
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+224,15978,16205,MSAKQVSKDEEKEALNLFLSTQTIIKEALRKLGYPGDMYELMKEPQRMLTVRIPVKMDNGSVKVFTGYRSQHNDAVGPTKGGVRFHPEVNEEEVKALSIWMTLKCGIANLPYGGGKGGIICDPRTMSFGELERLSRGYVRAISQIVGPTKDIPAPDVYTNSQIMAWMMDEYSRLREFDSPGFITGKPLVLGGSQGRETATAQGVTICIEEAVKKKGIKLQNARIIIQGFGNAGSFLAKFMHDAGAKVIGISDANGGLYNPDGLDIPYLLDKRDSFGMVTNLFTDVITNEELLEKDCDILVPAAISNQITAKNAHNIQASIVVEAANGPTTIDATKILNERGVLLVPDILASAGGVTVSYFEWVQNNQGYYWSEEEVAEKLRSVMVSSFETIYQTAATHKVDMRLAAYMTGIRKSAEASRFRGWV,sabio,P39633,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.NC(CCC(=O)O)C(=O)O.O>>N.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)CCC(=O)C(=O)O.[H],18.1,6.847919890036056e-15,37.0,7.7,1.4.1.2,1423.0,1.2576785748691846,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.NC(CCC(=O)O)C(=O)O.O,N.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)CCC(=O)C(=O)O.[H],1.2576785748691846,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.NC(CCC(=O)O)C(=O)O.O__MSAKQVSKDEEKEALNLFLSTQTIIKEALRKLGYPGDMYELMKEPQRMLTVRIPVKMDNGSVKVFTGYRSQHNDAVGPTKGGVRFHPEVNEEEVKALSIWMTLKCGIANLPYGGGKGGIICDPRTMSFGELERLSRGYVRAISQIVGPTKDIPAPDVYTNSQIMAWMMDEYSRLREFDSPGFITGKPLVLGGSQGRETATAQGVTICIEEAVKKKGIKLQNARIIIQGFGNAGSFLAKFMHDAGAKVIGISDANGGLYNPDGLDIPYLLDKRDSFGMVTNLFTDVITNEELLEKDCDILVPAAISNQITAKNAHNIQASIVVEAANGPTTIDATKILNERGVLLVPDILASAGGVTVSYFEWVQNNQGYYWSEEEVAEKLRSVMVSSFETIYQTAATHKVDMRLAAYMTGIRKSAEASRFRGWV,./data/raw/alphafold//AF-P39633-F1-model_v4.pdb,2148,4354,4244,4108
+225,14575,14780,MAGDSEQTLQNHQQPNGGEPFLIGVSGGTASGKSSVCAKIVQLLGQNEVDYRQKQVVILSQDSFYRVLTSEQKAKALKGQFNFDHPDAFDNELILKTLKEITEGKTVQIPVYDFVSHSRKEETVTVYPADVVLFEGILAFYSQEVRDLFQMKLFVDTDADTRLSRRVLRDISERGRDLEQILSQYITFVKPAFEEFCLPTKKYADVIIPRGADNLVAINLIVQHIQDILNGGPSKRQTNGCLNGYTPSRKRQASESSSRPH,brenda,Q9BZX2,N=c1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(O)n1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,3.2,0.0,25.0,7.766666666666667,2.7.1.48,9606.0,0.505149978319906,N=c1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(O)n1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.6334684555795865,N=c1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(O)n1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MAGDSEQTLQNHQQPNGGEPFLIGVSGGTASGKSSVCAKIVQLLGQNEVDYRQKQVVILSQDSFYRVLTSEQKAKALKGQFNFDHPDAFDNELILKTLKEITEGKTVQIPVYDFVSHSRKEETVTVYPADVVLFEGILAFYSQEVRDLFQMKLFVDTDADTRLSRRVLRDISERGRDLEQILSQYITFVKPAFEEFCLPTKKYADVIIPRGADNLVAINLIVQHIQDILNGGPSKRQTNGCLNGYTPSRKRQASESSSRPH,./data/raw/alphafold//AF-Q9BZX2-F1-model_v4.pdb,2408,4810,4872,4721
+226,10283,10434,MSQGRKAAERLAKKTVLITGASAGIGKATALEYLEASNGDMKLILAARRLEKLEELKKTIDQEFPNAKVHVAQLDITQAEKIKPFIENLPQEFKDIDILVNNAGKALGSDRVGQIATEDIQDVFDTNVTALINITQAVLPIFQAKNSGDIVNLGSIAGRDAYPTGSIYCASKFAVGAFTDSLRKELINTKIRVILIAPGLVETEFSLVRYRGNEEQAKNVYKDTTPLMADDVADLIVYATSRKQNTVIADTLIFPTNQASPHHIFRG,brenda,Q05016,C[C@@H](CO)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>>,20.1,99.88228674478115,30.0,9.0,1.1.1.381,4932.0,1.3031960574204888,C[C@@H](CO)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,,1.3031960574204888,C[C@@H](CO)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__MSQGRKAAERLAKKTVLITGASAGIGKATALEYLEASNGDMKLILAARRLEKLEELKKTIDQEFPNAKVHVAQLDITQAEKIKPFIENLPQEFKDIDILVNNAGKALGSDRVGQIATEDIQDVFDTNVTALINITQAVLPIFQAKNSGDIVNLGSIAGRDAYPTGSIYCASKFAVGAFTDSLRKELINTKIRVILIAPGLVETEFSLVRYRGNEEQAKNVYKDTTPLMADDVADLIVYATSRKQNTVIADTLIFPTNQASPHHIFRG,./data/raw/alphafold//AF-Q05016-F1-model_v4.pdb,3104,1869,3501,2319
+227,22181,22514,MSHKTISSLVAVFGLLVSPWTLAAIKEYHLNINEQQVNVTGKPLKRITVNGKFIAPLLEFEEGDEAVIHVHNQLKNQDTSLHWHGLLLLGLMDGVPGFNNFKGIAPNGDFVYRFKVKQNGTYWYHAHSKGQEQDGLYGPLVIYPKGKIPVAAHEKTDRDYVVMLSDFHDSSSDSIMKNLKKSAEYYQNRRETVSDVWKQVKAQGLKATWQDRSMWNQMRMLKTDMSDVTGYTFLVNGKTPQQNWTANFKAGDKVRLRFINASAMSFFDVRIPNLKMTVVSADGQPVKPVAIDEFRIGTAETYDVIVEPTQSNYQIEAESIDRSGFAIATLHDENTQAVGPIQMPAPRPRALLTMDDMGMSHGDGSNEHAGHQMNMQHDMSAMPEMKKETSQANHDHTMMKMDHDMKNMSSGEHDHSMMHMKHDMSAMSEMNHDMQVMSSSEHDHAMMNMNHEMPAQSENKPKKDEPVYGWANASTPAGMKALQYSDLQSLTPQPDTRVPERELVIRLGGNMERYIWTINGKKFSDTTPLQVKYGERIRLKFVNDSMMAHPMHLHGMFMQLENGQQAENLPNKHTIIVPPGKTVTALLTADALGEWAIHCHLLYHMSAGMMNKLIVAQVNDGQQPAQTQPTVQSENEKGASHAHH,sabio,D0C997,O=O.Oc1cccc(O)c1O>>O,20.0,79.09374223707687,50.0,8.0,1.10.3.2,470.0,1.3010299956639813,O=O.Oc1cccc(O)c1O,O,1.3010299956639813,O=O.Oc1cccc(O)c1O__MSHKTISSLVAVFGLLVSPWTLAAIKEYHLNINEQQVNVTGKPLKRITVNGKFIAPLLEFEEGDEAVIHVHNQLKNQDTSLHWHGLLLLGLMDGVPGFNNFKGIAPNGDFVYRFKVKQNGTYWYHAHSKGQEQDGLYGPLVIYPKGKIPVAAHEKTDRDYVVMLSDFHDSSSDSIMKNLKKSAEYYQNRRETVSDVWKQVKAQGLKATWQDRSMWNQMRMLKTDMSDVTGYTFLVNGKTPQQNWTANFKAGDKVRLRFINASAMSFFDVRIPNLKMTVVSADGQPVKPVAIDEFRIGTAETYDVIVEPTQSNYQIEAESIDRSGFAIATLHDENTQAVGPIQMPAPRPRALLTMDDMGMSHGDGSNEHAGHQMNMQHDMSAMPEMKKETSQANHDHTMMKMDHDMKNMSSGEHDHSMMHMKHDMSAMSEMNHDMQVMSSSEHDHAMMNMNHEMPAQSENKPKKDEPVYGWANASTPAGMKALQYSDLQSLTPQPDTRVPERELVIRLGGNMERYIWTINGKKFSDTTPLQVKYGERIRLKFVNDSMMAHPMHLHGMFMQLENGQQAENLPNKHTIIVPPGKTVTALLTADALGEWAIHCHLLYHMSAGMMNKLIVAQVNDGQQPAQTQPTVQSENEKGASHAHH,./data/raw/alphafold//AF-D0C997-F1-model_v4.pdb,3410,2303,1011,2906
+228,16664,16893,MCKKYDVAIIGGGVIGSSVAHFLAERGHKVAIVEKQSIASEASKAAAGLLGVQAEWDAYDPLFELARESRAIFPQLAAVLREKTGVDIGYEEKGIYRIAQNEDEKERILHIMDWQQKTGEDSYFLTGDHVREKEPYLSESIIGAVYYPKDGHVIAPELTKAFAHSAAISGADIYEQTEVFDIRIENNKVTGVITSEGIVTCEKVVIAGGSWSTKLLSYFHRDWGTYPVKGEVVAVRSRKQLLKAPIFQERFYITPKRGGRYVIGATMKPHTFNKTVQPESITSILERAYTILPALKEAEWESTWAGLRPQSNHEAPYMGEHEEIKGLYTCTGHYRNGILLSPISGQYMADLIEGKQENHLLDSLLSRRV,brenda,L7T8Y9,NCC(=O)O.O=O>>N=CC(=O)O.OO,0.14,0.0,60.0,8.5,1.4.3.19,1396.0,-0.8538719643217619,NCC(=O)O.O=O,N=CC(=O)O.OO,-0.1487416512809247,NCC(=O)O.O=O__MCKKYDVAIIGGGVIGSSVAHFLAERGHKVAIVEKQSIASEASKAAAGLLGVQAEWDAYDPLFELARESRAIFPQLAAVLREKTGVDIGYEEKGIYRIAQNEDEKERILHIMDWQQKTGEDSYFLTGDHVREKEPYLSESIIGAVYYPKDGHVIAPELTKAFAHSAAISGADIYEQTEVFDIRIENNKVTGVITSEGIVTCEKVVIAGGSWSTKLLSYFHRDWGTYPVKGEVVAVRSRKQLLKAPIFQERFYITPKRGGRYVIGATMKPHTFNKTVQPESITSILERAYTILPALKEAEWESTWAGLRPQSNHEAPYMGEHEEIKGLYTCTGHYRNGILLSPISGQYMADLIEGKQENHLLDSLLSRRV,./data/raw/alphafold//AF-L7T8Y9-F1-model_v4.pdb,3477,3393,1127,3044
+229,5464,5550,MRFIRLCIISLLATLPLAVHASPQPLEQIKLSESQLSGRVGMIEMDLASGRTLTAWRADERFPMMSTFKVVLCGAVLARVDAGDEQLERKIHYRQQDLVDYSPVSEKHLADGMTVGELCAAAITMSDNSAANLLLATVGGPAGLTAFLRQIGDNVTRLDRWETELNEALPGDARDTTTPASMAATLRKLLTSQRLSARSQRQLLQWMVDDRVAGPLIRSVLPAGWFIADKTGASKRGARGIVALLGPNNKAERIVVIYLRDTPASMAERNQQIAGIGAALIEHWQR,brenda,Q4TVR4,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.O>>,8.0,99.75213781137688,30.0,7.0,3.5.2.6,573.0,0.9030899869919436,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.O,,0.9030899869919436,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.O__MRFIRLCIISLLATLPLAVHASPQPLEQIKLSESQLSGRVGMIEMDLASGRTLTAWRADERFPMMSTFKVVLCGAVLARVDAGDEQLERKIHYRQQDLVDYSPVSEKHLADGMTVGELCAAAITMSDNSAANLLLATVGGPAGLTAFLRQIGDNVTRLDRWETELNEALPGDARDTTTPASMAATLRKLLTSQRLSARSQRQLLQWMVDDRVAGPLIRSVLPAGWFIADKTGASKRGARGIVALLGPNNKAERIVVIYLRDTPASMAERNQQIAGIGAALIEHWQR,./data/raw/alphafold//AF-Q4TVR4-F1-model_v4.pdb,1458,402,784,1122
+230,19983,20269,MRRAVCFPALCLLLNLHAAGCFSGNNDHFLAINQKKSGKPVFIYKHSQDIEKSLDIAPQKIYRHSYHSSSEAQVSKRHQIVNSAFPRPAYDPSLNLLAMDGQDLEVENLPIPAANVIVVTLQMDVNKLNITLLRIFRQGVAAALGLLPQQVHINRLIGKKNSIELFVSPINRKTGISDALPSEEVLRSLNINVLHQSLSQFGITEVSPEKNVLQGQHEADKIWSKEGFYAVVIFLSIFVIIVTCLMILYRLKERFQLSLRQDKEKNQEIHLSPITLQPALSEAKTVHSMVQPEQAPKVLNVVVDPQGRGAPEIKATTATSVCPSPFKMKPIGLQERRGSNVSLTLDMSSLGNIEPFVSIPTPREKVAMEYLQSASRILTRSQLRDVVASSHLLQSEFMEIPMNFVDPKEIDIPRHGTKNRYKTILPNPLSRVCLRPKNVTDSLSTYINANYIRGYSGKEKAFIATQGPMINTVDDFWQMVWQEDSPVIVMITKLKEKNEKCVLYWPEKRGIYGKVEVLVISVNECDNYTIRNLVLKQGSHTQHVKHYWYTSWPDHKTPDSAQPLLQLMLDVEEDRLASQGRGPVVVHCSAGIGRTGCFIATSIGCQQLKEEGVVDALSIVCQLRMDRGGMVQTSEQYEFVHHALCLYESRLSAETVQ,brenda,Q15256,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1>>O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,0.207,0.0,22.0,7.3,3.1.3.48,9606.0,-0.6840296545430823,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,1.9822712330395684,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MRRAVCFPALCLLLNLHAAGCFSGNNDHFLAINQKKSGKPVFIYKHSQDIEKSLDIAPQKIYRHSYHSSSEAQVSKRHQIVNSAFPRPAYDPSLNLLAMDGQDLEVENLPIPAANVIVVTLQMDVNKLNITLLRIFRQGVAAALGLLPQQVHINRLIGKKNSIELFVSPINRKTGISDALPSEEVLRSLNINVLHQSLSQFGITEVSPEKNVLQGQHEADKIWSKEGFYAVVIFLSIFVIIVTCLMILYRLKERFQLSLRQDKEKNQEIHLSPITLQPALSEAKTVHSMVQPEQAPKVLNVVVDPQGRGAPEIKATTATSVCPSPFKMKPIGLQERRGSNVSLTLDMSSLGNIEPFVSIPTPREKVAMEYLQSASRILTRSQLRDVVASSHLLQSEFMEIPMNFVDPKEIDIPRHGTKNRYKTILPNPLSRVCLRPKNVTDSLSTYINANYIRGYSGKEKAFIATQGPMINTVDDFWQMVWQEDSPVIVMITKLKEKNEKCVLYWPEKRGIYGKVEVLVISVNECDNYTIRNLVLKQGSHTQHVKHYWYTSWPDHKTPDSAQPLLQLMLDVEEDRLASQGRGPVVVHCSAGIGRTGCFIATSIGCQQLKEEGVVDALSIVCQLRMDRGGMVQTSEQYEFVHHALCLYESRLSAETVQ,./data/raw/alphafold//AF-Q15256-F1-model_v4.pdb,402,2974,5316,6193
+231,9661,9807,MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,sabio,O94219,COc1ccc(CO)cc1O.O=O>>COc1ccc(C=O)cc1O.OO,127.0,0.0,24.0,6.0,1.1.3.7,5323.0,2.103803720955957,COc1ccc(CO)cc1O.O=O,COc1ccc(C=O)cc1O.OO,2.103803720955957,COc1ccc(CO)cc1O.O=O__MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,./data/raw/alphafold//AF-O94219-F1-model_v4.pdb,1050,3522,1297,300
+232,15222,15435,MTATDNARQVTIIGAGLAGTLVARLLARNGWQVNLFERRPDPRIETGARGRSINLALAERGAHALRLAGLEREVLAEAVMMRGRMVHVPGTPPNLQPYGRDDSEVIWSINRDRLNRILLDGAEAAGASIHFNLGLDSVDFARQRLTLSNVSGERLEKRFHLLIGADGCNSAVRQAMASVVDLGEHLETQPHGYKELQITPEASAQFNLEPNALHIWPHGDYMCIALPNLDRSFTVTLFLHHQSPAAQPASPCFAQLVDGHAARRFFQRQFPDLSPMLDSLEQDFEHHPTGKLATLRLTTWHVGGQAVLLGDAAHPMVPFHGQGMNCALEDAVALAEHLQSAADNASALAAFTAQRQPDALAIQAMALENYVEMSSKVASPTYLLERELGQIMAQRQPTRFIPRYSMVTFSRLPYAQAMARGQIQEQLLKFAVANHSDLTSINLDAVEHEVTRCLPPLSHLC,sabio,Q84HF5,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.Nc1ccccc1C(=O)CC(N)C(=O)O.O=O.[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.Nc1c(O)cccc1C(=O)CC(N)C(=O)O.O,2.3,0.0,20.0,,1.14.13.9,294.0,0.3617278360175928,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.Nc1ccccc1C(=O)CC(N)C(=O)O.O=O.[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.Nc1c(O)cccc1C(=O)CC(N)C(=O)O.O,0.3617278360175928,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.Nc1ccccc1C(=O)CC(N)C(=O)O.O=O.[H]__MTATDNARQVTIIGAGLAGTLVARLLARNGWQVNLFERRPDPRIETGARGRSINLALAERGAHALRLAGLEREVLAEAVMMRGRMVHVPGTPPNLQPYGRDDSEVIWSINRDRLNRILLDGAEAAGASIHFNLGLDSVDFARQRLTLSNVSGERLEKRFHLLIGADGCNSAVRQAMASVVDLGEHLETQPHGYKELQITPEASAQFNLEPNALHIWPHGDYMCIALPNLDRSFTVTLFLHHQSPAAQPASPCFAQLVDGHAARRFFQRQFPDLSPMLDSLEQDFEHHPTGKLATLRLTTWHVGGQAVLLGDAAHPMVPFHGQGMNCALEDAVALAEHLQSAADNASALAAFTAQRQPDALAIQAMALENYVEMSSKVASPTYLLERELGQIMAQRQPTRFIPRYSMVTFSRLPYAQAMARGQIQEQLLKFAVANHSDLTSINLDAVEHEVTRCLPPLSHLC,./data/raw/alphafold//AF-Q84HF5-F1-model_v4.pdb,2557,5010,2101,4965
+233,9087,9229,MKKNTLLKVGLCVGLLGTIQFVSTISSVQASQKVEKTVIKNETGTISISQLNKNVWVHTELGSFNGEAVPSNGLVLNTSKGLVLVDSSWDDKLTKELIEMVEKKFQKRVTDVIITHAHADRIGGIKTLKERGIKAHSTALTAELAKKNGYEEPLGDLQTVTNLKFGNMKVETFYPGKGHTEDNIVVWLPQYNILVGGCLVKSTSAKDLGNVADAYVNEWSTSIENVLKRYRNINAVVPGHGEVGDKGLLLHTLDLLK,sabio,P04190,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1.O>>,78.0,99.78924695830672,15.0,7.5,3.5.2.6,1396.0,1.8920946026904804,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1.O,,2.0791812460476247,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1.O__MKKNTLLKVGLCVGLLGTIQFVSTISSVQASQKVEKTVIKNETGTISISQLNKNVWVHTELGSFNGEAVPSNGLVLNTSKGLVLVDSSWDDKLTKELIEMVEKKFQKRVTDVIITHAHADRIGGIKTLKERGIKAHSTALTAELAKKNGYEEPLGDLQTVTNLKFGNMKVETFYPGKGHTEDNIVVWLPQYNILVGGCLVKSTSAKDLGNVADAYVNEWSTSIENVLKRYRNINAVVPGHGEVGDKGLLLHTLDLLK,./data/raw/alphafold//AF-P04190-F1-model_v4.pdb,1462,998,813,1076
+234,22788,23130,MGSSVEQNILVTGGAGFIGTHTVVQLLKDGFKVSIIDNFDNSVIEAVDRVRELVGPDLSKKLDFNLGDLRNKGDIEKLFSKQRFDAVIHFAGLKAVGESVENPRRYFDNNLVGTINLYETMAKYNCKMMVFSSSATVYGQPEKIPCMEDFELKAMNPYGRTKLFLEEIARDIQKAEPEWRIILLRYFNPVGAHESGSIGEDPKGIPNNLMPYIQQVAVGRLPELNVYGHDYPTEDGSAVRDYIHVMDLADGHIAALRKLFADPKIGCTAYNLGTGQGTSVLEMVAAFEKASGKKIPIKLCPRRSGDATAVYASTEKAEKELGWKAKYGVDEMCRDQWKWANNNPWGYQNKL,brenda,Q42605,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O>>O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2OC[C@H](O)[C@H](O)C2O)[C@@H](O)[C@H]1O,19.0,0.0,25.0,8.6,5.1.3.5,3702.0,1.2787536009528289,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2OC[C@H](O)[C@H](O)C2O)[C@@H](O)[C@H]1O,1.2787536009528289,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O__MGSSVEQNILVTGGAGFIGTHTVVQLLKDGFKVSIIDNFDNSVIEAVDRVRELVGPDLSKKLDFNLGDLRNKGDIEKLFSKQRFDAVIHFAGLKAVGESVENPRRYFDNNLVGTINLYETMAKYNCKMMVFSSSATVYGQPEKIPCMEDFELKAMNPYGRTKLFLEEIARDIQKAEPEWRIILLRYFNPVGAHESGSIGEDPKGIPNNLMPYIQQVAVGRLPELNVYGHDYPTEDGSAVRDYIHVMDLADGHIAALRKLFADPKIGCTAYNLGTGQGTSVLEMVAAFEKASGKKIPIKLCPRRSGDATAVYASTEKAEKELGWKAKYGVDEMCRDQWKWANNNPWGYQNKL,./data/raw/alphafold//AF-Q42605-F1-model_v4.pdb,2955,278,6031,6961
+235,16820,17050,MESRKNSDRQMRRANCFSAGERMKTRSPSVIVIGGGFGGISAARTLQDASFQVMVLESRDRIGGRVHTDYSFGFPVDLGASWLHGVCKENPLAPVIGRLGLPLYRTSGDNSVLYDHDLESYALFDMDGNQVPQELVTQIGVTFERILEEINKVRDEQDADISISQAFSIVFSRKPELRLEGLAHNVLQWYVCRMEGWFAADAETISAKCWDQEELLPGGHGLMVRGYRPVINTLAKGLDIRVGHRVTKIVRRYNGVKVTTENGQTFVADAAVIAVPLGVLKSGTIKFEPKLPEWKQEAINDLGVGIENKIILHFEKVFWPKVEFLGVVAETSYGCSYFLNLHKATGHPVLVYMPAGQLAKDIEKMSDEAAANFAVLQLQRILPDALPPVQYLVSRWGSDVNSMGSYSYDIVGKPHDLYERLRVPVDNLFFAGEATSSSFPGSVHGAYSTGLMAAEDCRMRVLERYGELDLFQPVMGEEGPASVPLLISRL,brenda,Q9SKX5,NCCCCNCCCNCCCN.O.O=O>>CC(O)=NCCC=O.NCCCNCCCN.OO,0.4,5.247991486300137,25.0,7.5,1.5.3.17,3702.0,-0.3979400086720376,NCCCCNCCCNCCCN.O.O=O,CC(O)=NCCC=O.NCCCNCCCN.OO,-0.3979400086720376,NCCCCNCCCNCCCN.O.O=O__MESRKNSDRQMRRANCFSAGERMKTRSPSVIVIGGGFGGISAARTLQDASFQVMVLESRDRIGGRVHTDYSFGFPVDLGASWLHGVCKENPLAPVIGRLGLPLYRTSGDNSVLYDHDLESYALFDMDGNQVPQELVTQIGVTFERILEEINKVRDEQDADISISQAFSIVFSRKPELRLEGLAHNVLQWYVCRMEGWFAADAETISAKCWDQEELLPGGHGLMVRGYRPVINTLAKGLDIRVGHRVTKIVRRYNGVKVTTENGQTFVADAAVIAVPLGVLKSGTIKFEPKLPEWKQEAINDLGVGIENKIILHFEKVFWPKVEFLGVVAETSYGCSYFLNLHKATGHPVLVYMPAGQLAKDIEKMSDEAAANFAVLQLQRILPDALPPVQYLVSRWGSDVNSMGSYSYDIVGKPHDLYERLRVPVDNLFFAGEATSSSFPGSVHGAYSTGLMAAEDCRMRVLERYGELDLFQPVMGEEGPASVPLLISRL,./data/raw/alphafold//AF-Q9SKX5-F1-model_v4.pdb,2964,1705,3317,2123
+236,23063,23405,MDSTVNSQSNTVAPKQAECKKMRYSIRKVAAVGATSALVGTLAFLGATQVKADQVTETAPAVATATATPETSTASLTVASETATSVATSEAVESSVAHSEVTTTPVTETQPSNTTPSVVEEKASSTVVTSSSDATTPSSTVAAVSAPAHTSEAAVEAPTSTASSETADTHTEVALKPTENSAANANLSKLNGRIKSIVEDNMTSDQIVALTEEEIKALNKVDFSDDAIKGTGTSLTYRNLKDIVASFLKQDSKLAVPYFKADTIINMPAFNTVDAQTMKKEEIDVWDSWPVQDAESGVVSNWNGYQLVISMAGAPNKNSNHIYLLYSKYGDNDFTHWKNAGPIFGYNALEDDQQWSGSATVNSDGSIQLYYTKNDTSGGKLNWQQLASATLNLAVENDEVVIKSVENDHILFGGDNYHYQSYPKFMSTFNDDHNHDGNPDRTDNYCLRDPHIIEDNGSRYLIFESNTGDENYQGEKQIYNWSNYGGDDAFNLKSFLNIVNNKHLYNLASWANGSIGILKLDDKEKNPSVAELYTPLVTSHLVTDEVERPSVVKMGNKYYLFTASRINKSTDAEGTVAAREAVGDDVVMLGFVSDSLRGEYRPLNGSGVVLTASVPADWRTSTYSYYAVPVEGSSDTLLVTSYMTNRGGIAGAENKSTWAPSFLIKMNADDTTEVLPKMTNQGDWIWDKSSESLVHVGDQNSAKLPNEDFNVDYYAVSGYGLKPHTYPTVDGSTGVSEAHGVLTVTVKDGKDKKADKPETPVSPTEGNHSVDDKSNKPDTPSKPADNNQPSTNKEDKPATPTNPDSPVRNPFPYFTDRPSNDNNSSDDHHVEVPAKPSTEGSVGDRRPVAQATEIASPVPEAIVATGPTVSTTPVKEESVTETEAPKPAKSEEEVQSHGVAKADEVTKSDESSKDNNTKVAAKLATTPKTPSDSEGSKSNILSILATIFAAIASLALLGYGLVTGKIHLPKK,brenda,J7TH23,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.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>>OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@@](CO)(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@@H](O)[C@@H]1O,33600.0,0.0,37.0,6.0,2.4.1.10,1304.0,4.526339277389844,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.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,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@@](CO)(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@@H](O)[C@@H]1O,4.743509764728429,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.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__MDSTVNSQSNTVAPKQAECKKMRYSIRKVAAVGATSALVGTLAFLGATQVKADQVTETAPAVATATATPETSTASLTVASETATSVATSEAVESSVAHSEVTTTPVTETQPSNTTPSVVEEKASSTVVTSSSDATTPSSTVAAVSAPAHTSEAAVEAPTSTASSETADTHTEVALKPTENSAANANLSKLNGRIKSIVEDNMTSDQIVALTEEEIKALNKVDFSDDAIKGTGTSLTYRNLKDIVASFLKQDSKLAVPYFKADTIINMPAFNTVDAQTMKKEEIDVWDSWPVQDAESGVVSNWNGYQLVISMAGAPNKNSNHIYLLYSKYGDNDFTHWKNAGPIFGYNALEDDQQWSGSATVNSDGSIQLYYTKNDTSGGKLNWQQLASATLNLAVENDEVVIKSVENDHILFGGDNYHYQSYPKFMSTFNDDHNHDGNPDRTDNYCLRDPHIIEDNGSRYLIFESNTGDENYQGEKQIYNWSNYGGDDAFNLKSFLNIVNNKHLYNLASWANGSIGILKLDDKEKNPSVAELYTPLVTSHLVTDEVERPSVVKMGNKYYLFTASRINKSTDAEGTVAAREAVGDDVVMLGFVSDSLRGEYRPLNGSGVVLTASVPADWRTSTYSYYAVPVEGSSDTLLVTSYMTNRGGIAGAENKSTWAPSFLIKMNADDTTEVLPKMTNQGDWIWDKSSESLVHVGDQNSAKLPNEDFNVDYYAVSGYGLKPHTYPTVDGSTGVSEAHGVLTVTVKDGKDKKADKPETPVSPTEGNHSVDDKSNKPDTPSKPADNNQPSTNKEDKPATPTNPDSPVRNPFPYFTDRPSNDNNSSDDHHVEVPAKPSTEGSVGDRRPVAQATEIASPVPEAIVATGPTVSTTPVKEESVTETEAPKPAKSEEEVQSHGVAKADEVTKSDESSKDNNTKVAAKLATTPKTPSDSEGSKSNILSILATIFAAIASLALLGYGLVTGKIHLPKK,./data/raw/alphafold//AF-J7TH23-F1-model_v4.pdb,480,335,6103,7042
+237,7200,7322,MRIPLVGKEPIEAEDMGFTLIHEHLRVFSEAVRYQWPHLYNEDEELRNAVNEVKRAMQFGVKTIVDPTVMGLGRDIRFMEKVVKTTGINLVAGTGIYIYVDLPFYFLNRSIDEIADLFIHDIKEGIQATSNKAGFVKIAADEPGITKDVEKVIRAAAITHKEAKVPIITHSNAHNNTGLEEQRILMEEGVDPGKILIGHLGDTDNTDYIKKIADKGSFIGLDRYGLDLFLPVDKRNETTLKLIKDGYSDRIMISHDYCCTIDWGTARPELKPKLAPRWSMALIFEDTIPFLKKNGVSEEVIDIIFKENPKKFFS,brenda,C4KKZ9,CCCCCCCCC1CCC(=O)O1.O>>CCCCCCCCC(O)CCC(=O)O,1.5,0.0,25.0,8.3,3.1.1.25,43080.0,0.1760912590556812,CCCCCCCCC1CCC(=O)O1.O,CCCCCCCCC(O)CCC(=O)O,0.1760912590556812,CCCCCCCCC1CCC(=O)O1.O__MRIPLVGKEPIEAEDMGFTLIHEHLRVFSEAVRYQWPHLYNEDEELRNAVNEVKRAMQFGVKTIVDPTVMGLGRDIRFMEKVVKTTGINLVAGTGIYIYVDLPFYFLNRSIDEIADLFIHDIKEGIQATSNKAGFVKIAADEPGITKDVEKVIRAAAITHKEAKVPIITHSNAHNNTGLEEQRILMEEGVDPGKILIGHLGDTDNTDYIKKIADKGSFIGLDRYGLDLFLPVDKRNETTLKLIKDGYSDRIMISHDYCCTIDWGTARPELKPKLAPRWSMALIFEDTIPFLKKNGVSEEVIDIIFKENPKKFFS,./data/raw/alphafold//AF-C4KKZ9-F1-model_v4.pdb,3234,2055,3706,1199
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+240,7823,7948,MDLTNKNVIFVAALGGIGLDTSRELVKRNLKNFVILDRVENPTALAELKAINPKVNITFHTYDVTVPVAESKKLLKKIFDQLKTVDILINGAGILDDHQIERTIAINFTGLVNTTTAILDFWDKRKGGPGGIIANICSVTGFNAIHQVPVYSASKAAVVSFTNSLAKLAPITGVTAYSINPGITRTPLVHTFNSWLDVEPRVAELLLSHPTQTSEQCGQNFVKAIEANKNGAIWKLDLGTLEAIEWTKHWDSHI,sabio,P10807,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=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],2.3,7.994776262513307e-15,23.5,9.5,1.1.1.1,7225.0,0.3617278360175928,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=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],0.380211241711606,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__MDLTNKNVIFVAALGGIGLDTSRELVKRNLKNFVILDRVENPTALAELKAINPKVNITFHTYDVTVPVAESKKLLKKIFDQLKTVDILINGAGILDDHQIERTIAINFTGLVNTTTAILDFWDKRKGGPGGIIANICSVTGFNAIHQVPVYSASKAAVVSFTNSLAKLAPITGVTAYSINPGITRTPLVHTFNSWLDVEPRVAELLLSHPTQTSEQCGQNFVKAIEANKNGAIWKLDLGTLEAIEWTKHWDSHI,./data/raw/alphafold//AF-P10807-F1-model_v4.pdb,1827,1509,3084,1844
+241,10044,10195,MKERLEKLVKFMDENSIDRVFIAKPVNVYYFSGTSPLGGGYIIVDGDEATLYVPELEYEMAKEESKLPVVKFKKFDEIYEILKNTETLGIEGTLSYSMVENFKEKSNVKEFKKIDDVIKDLRIIKTKEEIEIIEKACEIADKAVMAAIEEITEGKREREVAAKVEYLMKMNGAEKPAFDTIIASGHRSALPHGVASDKRIERGDLVVIDLGALYNHYNSDITRTIVVGSPNEKQREIYEIVLEAQKRAVEAAKPGMTAKELDSIAREIIKEYGYGDYFIHSLGHGVGLEIHEWPRISQYDETVLKEGMVITIEPGIYIPKLGGVRIEDTVLITENGAKRLTKTERELL,brenda,P81535,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,27.0,9.171606977489936e-15,97.0,7.0,3.4.13.9,2261.0,1.4313637641589874,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,1.4313637641589874,CSCC[C@H](N)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)O.O__MKERLEKLVKFMDENSIDRVFIAKPVNVYYFSGTSPLGGGYIIVDGDEATLYVPELEYEMAKEESKLPVVKFKKFDEIYEILKNTETLGIEGTLSYSMVENFKEKSNVKEFKKIDDVIKDLRIIKTKEEIEIIEKACEIADKAVMAAIEEITEGKREREVAAKVEYLMKMNGAEKPAFDTIIASGHRSALPHGVASDKRIERGDLVVIDLGALYNHYNSDITRTIVVGSPNEKQREIYEIVLEAQKRAVEAAKPGMTAKELDSIAREIIKEYGYGDYFIHSLGHGVGLEIHEWPRISQYDETVLKEGMVITIEPGIYIPKLGGVRIEDTVLITENGAKRLTKTERELL,./data/raw/alphafold//AF-P81535-F1-model_v4.pdb,3598,3567,1350,3308
+242,20149,20438,MPRKIILDCDPGIDDAVAILLAYGNPEIELLAITTVVGNQTLEKVTRNAQLVADVAGIVGVPIAAGCCKPLVRKVRTAPQIHGETGLGTVSYPSEFKTKLDKRHAVHLIIELIMSHEPKSITLVPTGGLTNIAMAARLEPRIVERVKEVVLMGGSCCIGNASPVAEFNIFVDPEAAHIVFNESWDVTMVGLDLTSQALATPEVLQRVKEVRTKPADFILKILEFYTKVYETQRNTYAKVHDPCAVAYVIDPTVMTTNRVPVNIELNGELTAGMTVTDFRYPRPEQCHTQVASKLDFSKYWDLVIDALQRIGDP,brenda,A4H9Q9,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]1OC(O)[C@H](O)[C@@H]1O,344.0,9.809384078968736e-15,25.0,7.5,3.2.2.8,5660.0,2.53655844257153,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]1OC(O)[C@H](O)[C@@H]1O,2.53655844257153,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1__MPRKIILDCDPGIDDAVAILLAYGNPEIELLAITTVVGNQTLEKVTRNAQLVADVAGIVGVPIAAGCCKPLVRKVRTAPQIHGETGLGTVSYPSEFKTKLDKRHAVHLIIELIMSHEPKSITLVPTGGLTNIAMAARLEPRIVERVKEVVLMGGSCCIGNASPVAEFNIFVDPEAAHIVFNESWDVTMVGLDLTSQALATPEVLQRVKEVRTKPADFILKILEFYTKVYETQRNTYAKVHDPCAVAYVIDPTVMTTNRVPVNIELNGELTAGMTVTDFRYPRPEQCHTQVASKLDFSKYWDLVIDALQRIGDP,./data/raw/alphafold//AF-A4H9Q9-F1-model_v4.pdb,2412,4815,4877,4726
+243,10371,10523,MPLHNDSSGLAMEPAARPGDPLDRVDTPSLALDLTVFDANLRTMQDWADRHGVALRPHAKAHKCPQIALRQLALGARGICCQKVSEAVPFVAAGVRDILISNEVVGPAKHALLARLARTARMAVCVDNAANLVQLSRAMSQAGVEIDVLVEVDVGQGRCGVTGPEAVLALARQAHDLPGVNFAGLQAYHGAVQHRRSREERAQVCREAARQAAACAQLLRDNGMACDTITGGGTGSVEFDAASGVYTELQPGSYAFMDGDYGANEWDGALAFRSSLFLLSTVMSTPAPDRVILDVGLKSTSAECGPPAVYGTPGLRCVAINDEHSVVRVEPGAQAPALGSVLQLLPSHVDPTFNLHDELVVLHDGVVHALWPIAARGLSR,brenda,A0A031HCH9,C[C@@H](O)[C@@H](N)C(=O)O>>CC=O.NCC(=O)O,0.25,0.0,50.0,6.0,4.1.2.42,1886637.0,-0.6020599913279624,C[C@@H](O)[C@@H](N)C(=O)O,CC=O.NCC(=O)O,-0.6020599913279624,C[C@@H](O)[C@@H](N)C(=O)O__MPLHNDSSGLAMEPAARPGDPLDRVDTPSLALDLTVFDANLRTMQDWADRHGVALRPHAKAHKCPQIALRQLALGARGICCQKVSEAVPFVAAGVRDILISNEVVGPAKHALLARLARTARMAVCVDNAANLVQLSRAMSQAGVEIDVLVEVDVGQGRCGVTGPEAVLALARQAHDLPGVNFAGLQAYHGAVQHRRSREERAQVCREAARQAAACAQLLRDNGMACDTITGGGTGSVEFDAASGVYTELQPGSYAFMDGDYGANEWDGALAFRSSLFLLSTVMSTPAPDRVILDVGLKSTSAECGPPAVYGTPGLRCVAINDEHSVVRVEPGAQAPALGSVLQLLPSHVDPTFNLHDELVVLHDGVVHALWPIAARGLSR,./data/raw/alphafold//AF-A0A031HCH9-F1-model_v4.pdb,3100,1864,3496,2313
+244,19772,20058,MALAIRSSLRAAAMGRKAFRQAVPVRVAPAQRVRSVTTASAEITAYSVEEKGPKDSLEYRMFFKQGAKEVSCWHEIPLYAGDGHLHYICEIPKETSAKMEVATDEPRTPIKQDVKKGKLRFYPYNINWNYGMLPQTWEDPGHTDATLGAAGDNDPVDVVEIGAAAAKRGGVYKVKPVGVLAMIDDGELDWKVIAISADDPKAALCNDVEDVEKHFPGEIQKVLEWFRDYKIPDGKPANKFGYDNKCMNKEFTLNVIKETHEAYVKLKSGARANSEELSLI,sabio,Q93Y52,O.O=P(O)(O)OP(=O)(O)O>>O=P(O)(O)O,314.6,33.22033208805961,22.0,7.5,3.6.1.1,3055.0,2.497758718287268,O.O=P(O)(O)OP(=O)(O)O,O=P(O)(O)O,2.497758718287268,O.O=P(O)(O)OP(=O)(O)O__MALAIRSSLRAAAMGRKAFRQAVPVRVAPAQRVRSVTTASAEITAYSVEEKGPKDSLEYRMFFKQGAKEVSCWHEIPLYAGDGHLHYICEIPKETSAKMEVATDEPRTPIKQDVKKGKLRFYPYNINWNYGMLPQTWEDPGHTDATLGAAGDNDPVDVVEIGAAAAKRGGVYKVKPVGVLAMIDDGELDWKVIAISADDPKAALCNDVEDVEKHFPGEIQKVLEWFRDYKIPDGKPANKFGYDNKCMNKEFTLNVIKETHEAYVKLKSGARANSEELSLI,./data/raw/alphafold//AF-Q93Y52-F1-model_v4.pdb,353,2907,5239,6104
+245,201,213,MFKFKKNFLVGLSAALMSISLFSATASAASTDYWQNWTDGGGIVNAVNGSGGNYSVNWSNTGNFVVGKGWTTGSPFRTINYNAGVWAPNGNGYLTLYGWTRSPLIEYYVVDSWGTYRPTGTYKGTVKSDGGTYDIYTTTRYNAPSIDGDRTTFTQYWSVRQSKRPTGSNATITFSNHVNAWKSHGMNLGSNWAYQVMATEGYQSSGSSNVTVW,sabio,Q45VU1,*OC1COC(*)C(O)C1O.O>>*OC1COC(*)C(O)C1O.OC1COC(O)C(O)C1O,389460.0,30.485145659071243,50.0,9.0,3.2.1.8,1423.0,5.590462859514767,*OC1COC(*)C(O)C1O.O,*OC1COC(*)C(O)C1O.OC1COC(O)C(O)C1O,5.590462859514767,*OC1COC(*)C(O)C1O.O__MFKFKKNFLVGLSAALMSISLFSATASAASTDYWQNWTDGGGIVNAVNGSGGNYSVNWSNTGNFVVGKGWTTGSPFRTINYNAGVWAPNGNGYLTLYGWTRSPLIEYYVVDSWGTYRPTGTYKGTVKSDGGTYDIYTTTRYNAPSIDGDRTTFTQYWSVRQSKRPTGSNATITFSNHVNAWKSHGMNLGSNWAYQVMATEGYQSSGSSNVTVW,./data/raw/alphafold//AF-Q45VU1-F1-model_v4.pdb,1945,506,149,159
+246,13123,13298,MATSLNLSSIFSSSSRLVTTPSSVFPIRQRRRIILVTSSSSGGGGKPTILVTEKLGQAGIDLLKKYANVDCSYDLSLEELCTKISLCDALIVRSGTKVGRDVFESSRGRLKVVGRAGVGIDNVDLAAATEYGCLVVNAPTANTVAAAEHGIALLTAMARNIAQADASIKAGKWTRNKYVGVSLVGKTLAVLGFGKVGSEVARRARGLGMHVITHDPYAPADRARAIGVELVSFEVAISTADFISLHLPLTAATSKMMNDVTFAMMKKGVRIVNVARGGVIDEEALLRALDSGIVAQAALDVFTVEPPVKDNKLVLHESVTATPHLGASTMEAQEGVSIEVAEAVIGALRGELAATAVNAPMVPLEVLRELKPYVVLAEKLGRLAVQLVTGGSGVNAVKVTYASSRAPDDLDTRLLRAMVIKGIIEPISSVFINLVNSDYIAKQRGVKISEERMVLDGSPENPIEYITVRIANVESRFASALSESGEIKVEGRVKQGVPSLTKVGLFGVDVSLEGSVILCRQVDQPGMIGKVASILGDENVNVSFMSVGRIAPGKQAVMAIGVDEQPSKETLKKIGDIPAIEEFVFLKL,brenda,Q9LT69,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.O=C(O)CC(=O)C(=O)O.[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.O=C(O)CC(O)C(=O)O,0.00051,7.114097664129157e-15,25.0,6.0,1.1.1.95,3702.0,-3.292429823902064,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.O=C(O)CC(=O)C(=O)O.[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.O=C(O)CC(O)C(=O)O,-3.292429823902064,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.O=C(O)CC(=O)C(=O)O.[H+]__MATSLNLSSIFSSSSRLVTTPSSVFPIRQRRRIILVTSSSSGGGGKPTILVTEKLGQAGIDLLKKYANVDCSYDLSLEELCTKISLCDALIVRSGTKVGRDVFESSRGRLKVVGRAGVGIDNVDLAAATEYGCLVVNAPTANTVAAAEHGIALLTAMARNIAQADASIKAGKWTRNKYVGVSLVGKTLAVLGFGKVGSEVARRARGLGMHVITHDPYAPADRARAIGVELVSFEVAISTADFISLHLPLTAATSKMMNDVTFAMMKKGVRIVNVARGGVIDEEALLRALDSGIVAQAALDVFTVEPPVKDNKLVLHESVTATPHLGASTMEAQEGVSIEVAEAVIGALRGELAATAVNAPMVPLEVLRELKPYVVLAEKLGRLAVQLVTGGSGVNAVKVTYASSRAPDDLDTRLLRAMVIKGIIEPISSVFINLVNSDYIAKQRGVKISEERMVLDGSPENPIEYITVRIANVESRFASALSESGEIKVEGRVKQGVPSLTKVGLFGVDVSLEGSVILCRQVDQPGMIGKVASILGDENVNVSFMSVGRIAPGKQAVMAIGVDEQPSKETLKKIGDIPAIEEFVFLKL,./data/raw/alphafold//AF-Q9LT69-F1-model_v4.pdb,2246,4495,4405,4296
+247,17169,17400,MSEAEARPTNFIRQIIDEDLASGKHTTVHTRFPPEPNGYLHIGHAKSICLNFGIAQDYKGQCNLRFDDTNPVKEDIEYVESIKNDVEWLGFHWSGNVRYSSDYFDQLHAYAIELINKGLAYVDELTPEQIREYRGTLTQPGKNSPYRDRSVEENLALFEKMRAGGFEEGKACLRAKIDMASPFIVMRDPVLYRIKFAEHHQTGNKWCIYPMYDFTHCISDALEGITHSLCTLEFQDNRRLYDWVLDNITIPVHPRQYEFSRLNLEYTVMSKRKLNLLVTDKHVEGWDDPRMPTISGLRRRGYTAASIREFCKRIGVTKQDNTIEMASLESCIREDLNENAPRAMAVIDPVKLVIENYQGEGEMVTMPNHPNKPEMGSRQVPFSGEIWIDRADFREEANKQYKRLVLGKEVRLRNAYVIKAERVEKDAEGNITTIFCTYDADTLSKDPADGRKVKGVIHWVSAAHALPVEIRLYDRLFSVPNPGAADDFLSVINPESLVIKQGFAEPSLKDAVAGKAFQFEREGYFCLDSRHSTAEKPVFNRTVGLRDTWAKVGE,brenda,P00962,N[C@@H](CCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=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=P(O)(O)OP(=O)(O)O,0.046,10000000.0,22.0,7.5,6.1.1.18,562.0,-1.337242168318426,N[C@@H](CCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=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=P(O)(O)OP(=O)(O)O,-1.337242168318426,N[C@@H](CCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MSEAEARPTNFIRQIIDEDLASGKHTTVHTRFPPEPNGYLHIGHAKSICLNFGIAQDYKGQCNLRFDDTNPVKEDIEYVESIKNDVEWLGFHWSGNVRYSSDYFDQLHAYAIELINKGLAYVDELTPEQIREYRGTLTQPGKNSPYRDRSVEENLALFEKMRAGGFEEGKACLRAKIDMASPFIVMRDPVLYRIKFAEHHQTGNKWCIYPMYDFTHCISDALEGITHSLCTLEFQDNRRLYDWVLDNITIPVHPRQYEFSRLNLEYTVMSKRKLNLLVTDKHVEGWDDPRMPTISGLRRRGYTAASIREFCKRIGVTKQDNTIEMASLESCIREDLNENAPRAMAVIDPVKLVIENYQGEGEMVTMPNHPNKPEMGSRQVPFSGEIWIDRADFREEANKQYKRLVLGKEVRLRNAYVIKAERVEKDAEGNITTIFCTYDADTLSKDPADGRKVKGVIHWVSAAHALPVEIRLYDRLFSVPNPGAADDFLSVINPESLVIKQGFAEPSLKDAVAGKAFQFEREGYFCLDSRHSTAEKPVFNRTVGLRDTWAKVGE,./data/raw/alphafold//AF-P00962-F1-model_v4.pdb,938,450,89,97
+248,5002,5083,MDVDLGKLFFCGFNDFNEEVKEIIRKYRPTGILIYPGVLSKEYLLMDFMSFLSKEGDFLISSDHEGGQLEVLKYVPSSPGNLAFGKNSPDVTYRYSRVAGKIMEIVGLNMVFAPVLDLLSEESSSVIDIRSYGSDPKIVAEHGARACEGYLEGGVIPCIKHFPGHGKAREDSHLTLPVVDAPFEKLWEEDLLPFRKVLEREKKVTVMTAHVRYSSIDSLPATLSEKIITDVLREKIGFDGLVISDAMEMSAVSNNFSVEEIVSLFLNAGGNMILLGDYRNLPVYYETLVKLLEDGKVQKDKVERSIRTVEKYLAFAKKNSGVGFLADVSMKAVEFLGFEKIDHTSEVTLLVPSSENLSQADTTGGDYDQIPEIVSRFFEVENVVRYTVEDGPEFVEGDLIFDFVADIPNEKALKAHLSLPAEKTVYFVLRNPFDVRYFEGRKIVVTRSTKPISIYKSLEHFLGRCDS,brenda,Q9WZR6,CC(O)=N[C@H]1[C@H](Oc2ccc([N+](=O)[O-])cc2)O[C@H](CO)[C@@H](O)[C@@H]1O.O>>CC(O)=N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O.O=[N+]([O-])c1ccc(O)cc1,246.2,7.876999113240716e-15,70.0,7.5,3.2.1.52,243274.0,2.3912880485952974,CC(O)=N[C@H]1[C@H](Oc2ccc([N+](=O)[O-])cc2)O[C@H](CO)[C@@H](O)[C@@H]1O.O,CC(O)=N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O.O=[N+]([O-])c1ccc(O)cc1,2.3912880485952974,CC(O)=N[C@H]1[C@H](Oc2ccc([N+](=O)[O-])cc2)O[C@H](CO)[C@@H](O)[C@@H]1O.O__MDVDLGKLFFCGFNDFNEEVKEIIRKYRPTGILIYPGVLSKEYLLMDFMSFLSKEGDFLISSDHEGGQLEVLKYVPSSPGNLAFGKNSPDVTYRYSRVAGKIMEIVGLNMVFAPVLDLLSEESSSVIDIRSYGSDPKIVAEHGARACEGYLEGGVIPCIKHFPGHGKAREDSHLTLPVVDAPFEKLWEEDLLPFRKVLEREKKVTVMTAHVRYSSIDSLPATLSEKIITDVLREKIGFDGLVISDAMEMSAVSNNFSVEEIVSLFLNAGGNMILLGDYRNLPVYYETLVKLLEDGKVQKDKVERSIRTVEKYLAFAKKNSGVGFLADVSMKAVEFLGFEKIDHTSEVTLLVPSSENLSQADTTGGDYDQIPEIVSRFFEVENVVRYTVEDGPEFVEGDLIFDFVADIPNEKALKAHLSLPAEKTVYFVLRNPFDVRYFEGRKIVVTRSTKPISIYKSLEHFLGRCDS,./data/raw/alphafold//AF-Q9WZR6-F1-model_v4.pdb,3057,1811,3437,2244
+249,10410,10563,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.O>>,10.0,99.72926655602694,30.0,6.5,3.5.2.6,1396.0,1.0,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(Oc3ccc(C(N)=O)cc3)S[C@H]12.O,,1.0,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(Oc3ccc(C(N)=O)cc3)S[C@H]12.O__MKNTLLKLGVCVSLLGITPFVSTISSVQAERTVEHKVIKNETGTISISQLNKNVWVHTELGYFSGEAVPSNGLVLNTSKGLVLVDSSWDDKLTKELIEMVEKKFKKRVTDVIITHAHADRIGGMKTLKERGIKAHSTALTAELAKKNGYEEPLGDLQSVTNLKFGNMKVETFYPGKGHTEDNIVVWLPQYQILAGGCLVKSASSKDLGNVADAYVNEWSTSIENVLKRYGNINLVVPGHGEVGDRGLLLHTLDLLK,./data/raw/alphafold//AF-P14488-F1-model_v4.pdb,1462,998,813,1132
+250,22495,22832,MSEKYIVTWDMLQIHARKLASRLMPSEQWKGIIAVSRGGLVPGALLARELGIRHVDTVCISSYDHDNQRELKVLKRAEGDGEGFIVIDDLVDTGGTAVAIREMYPKAHFVTIFAKPAGRPLVDDYVVDIPQDTWIEQPWDMGVVFVPPISGR,brenda,P0A9M5,O=P(O)(O)OC[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1O.Oc1nc(O)c2nc[nH]c2n1>>O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O.O=P(O)(O)OP(=O)(O)O,150.0,0.0,30.0,7.5,2.4.2.22,562.0,2.1760912590556813,O=P(O)(O)OC[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1O.Oc1nc(O)c2nc[nH]c2n1,O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O.O=P(O)(O)OP(=O)(O)O,2.1760912590556813,O=P(O)(O)OC[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1O.Oc1nc(O)c2nc[nH]c2n1__MSEKYIVTWDMLQIHARKLASRLMPSEQWKGIIAVSRGGLVPGALLARELGIRHVDTVCISSYDHDNQRELKVLKRAEGDGEGFIVIDDLVDTGGTAVAIREMYPKAHFVTIFAKPAGRPLVDDYVVDIPQDTWIEQPWDMGVVFVPPISGR,./data/raw/alphafold//AF-P0A9M5-F1-model_v4.pdb,2467,4891,4961,4815
+251,4170,4223,MKLCSLAVLVPIVLFCEQHVFAFQSGQVLAALPRTSRQVQVLQNLTTTYEIVLWQPVTADLIVKKKQVHFFVNASDVDNVKAHLNVSGIPCSVLLADVEDLIQQQISNDTVSPRASASYYEQYHSLNEIYSWIEFITERHPDMLTKIHIGSSFEKYPLYVLKVSGKEQAAKNAIWIDCGIHAREWISPAFCLWFIGHITQFYGIIGQYTNLLRLVDFYVMPVVNVDGYDYSWKKNRMWRKNRSFYANNHCIGTDLNRNFASKHWCEEGASSSSCSETYCGLYPESEPEVKAVASFLRRNINQIKAYISMHSYSQHIVFPYSYTRSKSKDHEELSLVASEAVRAIEKISKNTRYTHGHGSETLYLAPGGGDDWIYDLGIKYSFTIELRDTGTYGFLLPERYIKPTCREAFAAVSKIAWHVIRNV,uniprot_search,Q96IY4,CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)[C@@H](N)Cc1ccc(O)cc1)C(O)=N[C@@H](CCCCN)C(=O)O.O>>CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O.NCCCC[C@H](N)C(=O)O,282.0,2.428092193928483e-14,22.75,7.808333333333333,3.4.17.20,9606.0,2.450249108319361,CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)[C@@H](N)Cc1ccc(O)cc1)C(O)=N[C@@H](CCCCN)C(=O)O.O,CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O.NCCCC[C@H](N)C(=O)O,2.450249108319361,CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)[C@@H](N)Cc1ccc(O)cc1)C(O)=N[C@@H](CCCCN)C(=O)O.O__MKLCSLAVLVPIVLFCEQHVFAFQSGQVLAALPRTSRQVQVLQNLTTTYEIVLWQPVTADLIVKKKQVHFFVNASDVDNVKAHLNVSGIPCSVLLADVEDLIQQQISNDTVSPRASASYYEQYHSLNEIYSWIEFITERHPDMLTKIHIGSSFEKYPLYVLKVSGKEQAAKNAIWIDCGIHAREWISPAFCLWFIGHITQFYGIIGQYTNLLRLVDFYVMPVVNVDGYDYSWKKNRMWRKNRSFYANNHCIGTDLNRNFASKHWCEEGASSSSCSETYCGLYPESEPEVKAVASFLRRNINQIKAYISMHSYSQHIVFPYSYTRSKSKDHEELSLVASEAVRAIEKISKNTRYTHGHGSETLYLAPGGGDDWIYDLGIKYSFTIELRDTGTYGFLLPERYIKPTCREAFAAVSKIAWHVIRNV,./data/raw/alphafold//AF-Q96IY4-F1-model_v4.pdb,3735,4437,3205,1980
+252,14803,15012,MLNVTQLQEATTFIQQQIETKPTIGLILGSGLGILADEIEQPVKVPYSDIPHFPVSTVQGHAGQLVIGMLEGKQVIAMQGRFHFYEGYSLEVVTFPVRVMKALGVEQIIVTNAAGGVNESFEAGDLMIIRDHINNMAQNPLIGPNDEAFGVRFPDMSNAYSERLRTLAKEKGNTLNLKLQEGVYVANTGPVYETPAEVRMIRKLGGDAVGMSTVPEVIVARHAGLEVLGISCISNMAAGILPQPLSHDEVIETTERVRQDFLNLVKAIVKDM,brenda,C7FLN0,N=c1nc(O)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2[nH]1.O=P(O)(O)O>>N=c1nc(O)c2nc[nH]c2[nH]1.O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H]1O,12.0,0.0,40.0,8.0,2.4.2.1,86665.0,1.0791812460476249,N=c1nc(O)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2[nH]1.O=P(O)(O)O,N=c1nc(O)c2nc[nH]c2[nH]1.O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H]1O,1.0791812460476249,N=c1nc(O)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2[nH]1.O=P(O)(O)O__MLNVTQLQEATTFIQQQIETKPTIGLILGSGLGILADEIEQPVKVPYSDIPHFPVSTVQGHAGQLVIGMLEGKQVIAMQGRFHFYEGYSLEVVTFPVRVMKALGVEQIIVTNAAGGVNESFEAGDLMIIRDHINNMAQNPLIGPNDEAFGVRFPDMSNAYSERLRTLAKEKGNTLNLKLQEGVYVANTGPVYETPAEVRMIRKLGGDAVGMSTVPEVIVARHAGLEVLGISCISNMAAGILPQPLSHDEVIETTERVRQDFLNLVKAIVKDM,./data/raw/alphafold//AF-C7FLN0-F1-model_v4.pdb,775,4902,4974,4828
+253,10842,10997,MLRLLVVASLVLYGHSTQDFPETNARVVGGTEAQRNSWPSQISLQYRSGSSWAHTCGGTLIRQNWVMTAAHCVDRELTFRVVVGEHNLNQNDGTEQYVGVQKIVVHPYWNTDDVAAGYDIALLRLAQSVTLNSYVQLGVLPRAGTILANNSPCYITGWGLTRTNGQLAQTLQQAYLPTVDYAICSSSSYWGSTVKNSMVCAGGDGVRSGCQGDSGGPLHCLVNGQYAVHGVTSFVSRLGCNVTRKPTVFTRVSAYISWINNVIASN,uniprot_search,P00772,C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)CCC(=O)O)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>,115.0,99.79858566856468,22.0,8.0,3.4.21.36,9823.0,2.060697840353612,C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)CCC(=O)O)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,,2.060697840353612,C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)CCC(=O)O)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MLRLLVVASLVLYGHSTQDFPETNARVVGGTEAQRNSWPSQISLQYRSGSSWAHTCGGTLIRQNWVMTAAHCVDRELTFRVVVGEHNLNQNDGTEQYVGVQKIVVHPYWNTDDVAAGYDIALLRLAQSVTLNSYVQLGVLPRAGTILANNSPCYITGWGLTRTNGQLAQTLQQAYLPTVDYAICSSSSYWGSTVKNSMVCAGGDGVRSGCQGDSGGPLHCLVNGQYAVHGVTSFVSRLGCNVTRKPTVFTRVSAYISWINNVIASN,./data/raw/alphafold//AF-P00772-F1-model_v4.pdb,3744,1574,3164,1193
+254,10708,10863,MKKVSTLDLLFVAIMGVSPAAFAADLIDVSKLPSKAAQGAPGPVTLQAAVGAGGADELKAIRSTTLPNGKQVTRYEQFHNGVRVVGEAITEVKGPGKSVAAQRSGHFVANIAADLPGSTTAAVSAEQVLAQAKSLKAQGRKTENDKVELVIRLGENNIAQLVYNVSYLIPGEGLSRPHFVIDAKTGEVLDQWEGLAHAEAGGPGGNQKIGKYTYGSDYGPLIVNDRCEMDDGNVITVDMNSSTDDSKTTPFRFACPTNTYKQVNGAYSPLNDAHFFGGVVFKLYRDWFGTSPLTHKLYMKVHYGRSVENAYWDGTAMLFGDGATMFYPLVSLDVAAHEVSHGFTEQNSGLIYRGQSGGMNEAFSDMAGEAAEFYMRGKNDFLIGYDIKKGSGALRYMDQPSRDGRSIDNASQYYNGIDVHHSSGVYNRAFYLLANSPGWDTRKAFEVFVDANRYYWTATSNYNSGACGVIRSAQNRNYSAADVTRAFSTVGVTCPSAL,brenda,P14756,C[C@H](N)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](C)C(=O)O.O>>,769.6,99.78656330639052,55.0,6.659999999999999,3.4.24.26,287.0,2.8862650590297565,C[C@H](N)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](C)C(=O)O.O,,2.8862650590297565,C[C@H](N)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](C)C(=O)O.O__MKKVSTLDLLFVAIMGVSPAAFAADLIDVSKLPSKAAQGAPGPVTLQAAVGAGGADELKAIRSTTLPNGKQVTRYEQFHNGVRVVGEAITEVKGPGKSVAAQRSGHFVANIAADLPGSTTAAVSAEQVLAQAKSLKAQGRKTENDKVELVIRLGENNIAQLVYNVSYLIPGEGLSRPHFVIDAKTGEVLDQWEGLAHAEAGGPGGNQKIGKYTYGSDYGPLIVNDRCEMDDGNVITVDMNSSTDDSKTTPFRFACPTNTYKQVNGAYSPLNDAHFFGGVVFKLYRDWFGTSPLTHKLYMKVHYGRSVENAYWDGTAMLFGDGATMFYPLVSLDVAAHEVSHGFTEQNSGLIYRGQSGGMNEAFSDMAGEAAEFYMRGKNDFLIGYDIKKGSGALRYMDQPSRDGRSIDNASQYYNGIDVHHSSGVYNRAFYLLANSPGWDTRKAFEVFVDANRYYWTATSNYNSGACGVIRSAQNRNYSAADVTRAFSTVGVTCPSAL,./data/raw/alphafold//AF-P14756-F1-model_v4.pdb,1859,1554,3138,1907
+255,11036,11191,MENSFKAALKAGRPQIGLWLGLSSSYSAELLAGAGFDWLLIDGEHAPNNVQTVLTQLQAIAPYPSQPVVRPSWNDPVQIKQLLDVGTQTLLVPMVQNADEAREAVRATRYPPAGIRGVGSALARASRWNRIPDYLQKANDQMCVLVQIETREAMKNLPQILDVEGVDGVFIGPADLSADMGYAGNPQHPEVQAAIEQAIVQIRESGKAPGILIANEQLAKRYLELGALFVAVGVDTTLLARAAEALAARFGAQATAVKPGVY,brenda,B1IS70,C[C@H](O)CC(=O)C(=O)O>>,353.5,99.2487698606468,25.0,8.0,4.1.2.52,562.0,2.5483894181329183,C[C@H](O)CC(=O)C(=O)O,,2.5483894181329183,C[C@H](O)CC(=O)C(=O)O__MENSFKAALKAGRPQIGLWLGLSSSYSAELLAGAGFDWLLIDGEHAPNNVQTVLTQLQAIAPYPSQPVVRPSWNDPVQIKQLLDVGTQTLLVPMVQNADEAREAVRATRYPPAGIRGVGSALARASRWNRIPDYLQKANDQMCVLVQIETREAMKNLPQILDVEGVDGVFIGPADLSADMGYAGNPQHPEVQAAIEQAIVQIRESGKAPGILIANEQLAKRYLELGALFVAVGVDTTLLARAAEALAARFGAQATAVKPGVY,./data/raw/alphafold//AF-B1IS70-F1-model_v4.pdb,3095,5206,1591,718
+256,16549,16778,MDLLAELQWRGLVNQTTDEDGLRKLLNEERVTLYCGFDPTADSLHIGHLATILTMRRFQQAGHRPIALVGGATGLIGDPSGKKSERTLNAKETVEAWSARIKEQLGRFLDFEADGNPAKIKNNYDWIGPLDVITFLRDVGKHFSVNYMMAKESVQSRIETGISFTEFSYMMLQAYDFLRLYETEGCRLQIGGSDQWGNITAGLELIRKTKGEARAFGLTIPLVTKADGTKFGKTESGTIWLDKEKTSPYEFYQFWINTDDRDVIRYLKYFTFLSKEEIEALEQELREAPEKRAAQKTLAEEVTKLVHGEEALRQAIRISEALFSGDIANLTAAEIEQGFKDVPSFVHEGGDVPLVELLVSAGISPSKRQAREDIQNGAIYVNGERLQDVGAILTAEHRLEGRFTVIRRGKKKYYLIRYA,sabio,P00952,NC(Cc1ccc(O)cc1)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OC[C@@H](N)Cc2ccc(O)cc2)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,6.9,1.0253247815052784,37.0,7.0,6.1.1.1,1422.0,0.8388490907372553,NC(Cc1ccc(O)cc1)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OC[C@@H](N)Cc2ccc(O)cc2)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.9030899869919436,NC(Cc1ccc(O)cc1)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MDLLAELQWRGLVNQTTDEDGLRKLLNEERVTLYCGFDPTADSLHIGHLATILTMRRFQQAGHRPIALVGGATGLIGDPSGKKSERTLNAKETVEAWSARIKEQLGRFLDFEADGNPAKIKNNYDWIGPLDVITFLRDVGKHFSVNYMMAKESVQSRIETGISFTEFSYMMLQAYDFLRLYETEGCRLQIGGSDQWGNITAGLELIRKTKGEARAFGLTIPLVTKADGTKFGKTESGTIWLDKEKTSPYEFYQFWINTDDRDVIRYLKYFTFLSKEEIEALEQELREAPEKRAAQKTLAEEVTKLVHGEEALRQAIRISEALFSGDIANLTAAEIEQGFKDVPSFVHEGGDVPLVELLVSAGISPSKRQAREDIQNGAIYVNGERLQDVGAILTAEHRLEGRFTVIRRGKKKYYLIRYA,./data/raw/alphafold//AF-P00952-F1-model_v4.pdb,2683,3781,2354,5252
+257,16489,16717,MAHTLGLTQPNSTEPHKISFTAKEIDVIEWKGDILVVGVTEKDLAKDGNSKFENPILSKVDAHLSGLLAQVSSEEDFTGKPGQSTVLRLPGLGSKRIALIGLGQSVSSPVAFHSLGEAVATVSKASQSTSAAIVLASSVSDESKLSSVSALASGIVLGLFEDGRYKSESKKPSLKAVDIIGFGTGAEVEKKLKYAEDVSYGVIFGRELINSPANVLTPAVLAEEAAKVASTYSDVFTANILNEEQCKELKMGSYLAVAAASANPPHFIHLVYKPPNGSVKTKLALVGKGLTFDSGGYNIKTGPGCSIELMKFDMGGSAAVLGAAKAIGEIKPPGVEVHFIVAACENMISGTGMRPGDVITASNGKTIEVNNTDAEGRLTLADALVYACNQGVDKIVDLATLTGACVIALGTSMAGIYTPSDELAKEVIAASERSGEKLWRMPLEESYWEMMKSGVADMVNTGGRAGGSITAALFLKQFVSEKVQWMHIDMAGPVWNEKKKSGTGFGVATLVEWVQKNSSS,sabio,P30184,NC(CS)C(=O)NCC(=O)O.O>>NC(CS)C(=O)O.NCC(=O)O,386160.0,0.0,37.0,8.0,3.4.11.1,3702.0,5.586767285810636,NC(CS)C(=O)NCC(=O)O.O,NC(CS)C(=O)O.NCC(=O)O,5.586767285810636,NC(CS)C(=O)NCC(=O)O.O__MAHTLGLTQPNSTEPHKISFTAKEIDVIEWKGDILVVGVTEKDLAKDGNSKFENPILSKVDAHLSGLLAQVSSEEDFTGKPGQSTVLRLPGLGSKRIALIGLGQSVSSPVAFHSLGEAVATVSKASQSTSAAIVLASSVSDESKLSSVSALASGIVLGLFEDGRYKSESKKPSLKAVDIIGFGTGAEVEKKLKYAEDVSYGVIFGRELINSPANVLTPAVLAEEAAKVASTYSDVFTANILNEEQCKELKMGSYLAVAAASANPPHFIHLVYKPPNGSVKTKLALVGKGLTFDSGGYNIKTGPGCSIELMKFDMGGSAAVLGAAKAIGEIKPPGVEVHFIVAACENMISGTGMRPGDVITASNGKTIEVNNTDAEGRLTLADALVYACNQGVDKIVDLATLTGACVIALGTSMAGIYTPSDELAKEVIAASERSGEKLWRMPLEESYWEMMKSGVADMVNTGGRAGGSITAALFLKQFVSEKVQWMHIDMAGPVWNEKKKSGTGFGVATLVEWVQKNSSS,./data/raw/alphafold//AF-P30184-F1-model_v4.pdb,1822,1502,3073,1833
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+281,3871,3924,MWCIVLFSLLAWVYAEPTMYGEILSPNYPQAYPSEVEKSWDIEVPEGYGIHLYFTHLDIELSENCAYDSVQIISGDTEEGRLCGQRSSNNPHSPIVEEFQVPYNKLQVIFKSDFSNEERFTGFAAYYVATDINECTDFVDVPCSHFCNNFIGGYFCSCPPEYFLHDDMKNCGVNCSGDVFTALIGEIASPNYPKPYPENSRCEYQIRLEKGFQVVVTLRREDFDVEAADSAGNCLDSLVFVAGDRQFGPYCGHGFPGPLNIETKSNALDIIFQTDLTGQKKGWKLRYHGDPMPCPKEDTPNSVWEPAKAKYVFRDVVQITCLDGFEVVEGRVGATSFYSTCQSNGKWSNSKLKCQPVDCGIPESIENGKVEDPESTLFGSVIRYTCEEPYYYMENGGGGEYHCAGNGSWVNEVLGPELPKCVPVCGVPREPFEEKQRIIGGSDADIKNFPWQVFFDNPWAGGALINEYWVLTAAHVVEGNREPTMYVGSTSVQTSRLAKSKMLTPEHVFIHPGWKLLEVPEGRTNFDNDIALVRLKDPVKMGPTVSPICLPGTSSDYNLMDGDLGLISGWGRTEKRDRAVRLKAARLPVAPLRKCKEVKVEKPTADAEAYVFTPNMICAGGEKGMDSCKGDSGGAFAVQDPNDKTKFYAAGLVSWGPQCGTYGLYTRVKNYVDWIMKTMQENSTPRED,uniprot_search,P09871,CC(C)C[C@H](N=C(O)CN)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](C)C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](C)C(=O)O.O>>CC(C)C[C@H](N=C(O)CN)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.CC(C)C[C@H](N=C(O)[C@H](C)N)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](C)C(=O)O,0.000392,1.9478153111374024e-14,37.0,7.4,3.4.21.42,9606.0,-3.406713932979543,CC(C)C[C@H](N=C(O)CN)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](C)C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](C)C(=O)O.O,CC(C)C[C@H](N=C(O)CN)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.CC(C)C[C@H](N=C(O)[C@H](C)N)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](C)C(=O)O,-3.406713932979543,CC(C)C[C@H](N=C(O)CN)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](C)C(O)=N[C@@H](CC(C)C)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](C)C(=O)O.O__MWCIVLFSLLAWVYAEPTMYGEILSPNYPQAYPSEVEKSWDIEVPEGYGIHLYFTHLDIELSENCAYDSVQIISGDTEEGRLCGQRSSNNPHSPIVEEFQVPYNKLQVIFKSDFSNEERFTGFAAYYVATDINECTDFVDVPCSHFCNNFIGGYFCSCPPEYFLHDDMKNCGVNCSGDVFTALIGEIASPNYPKPYPENSRCEYQIRLEKGFQVVVTLRREDFDVEAADSAGNCLDSLVFVAGDRQFGPYCGHGFPGPLNIETKSNALDIIFQTDLTGQKKGWKLRYHGDPMPCPKEDTPNSVWEPAKAKYVFRDVVQITCLDGFEVVEGRVGATSFYSTCQSNGKWSNSKLKCQPVDCGIPESIENGKVEDPESTLFGSVIRYTCEEPYYYMENGGGGEYHCAGNGSWVNEVLGPELPKCVPVCGVPREPFEEKQRIIGGSDADIKNFPWQVFFDNPWAGGALINEYWVLTAAHVVEGNREPTMYVGSTSVQTSRLAKSKMLTPEHVFIHPGWKLLEVPEGRTNFDNDIALVRLKDPVKMGPTVSPICLPGTSSDYNLMDGDLGLISGWGRTEKRDRAVRLKAARLPVAPLRKCKEVKVEKPTADAEAYVFTPNMICAGGEKGMDSCKGDSGGAFAVQDPNDKTKFYAAGLVSWGPQCGTYGLYTRVKNYVDWIMKTMQENSTPRED,./data/raw/alphafold//AF-P09871-F1-model_v4.pdb,1419,932,731,1026
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+283,10829,10984,MGLHPCSPVDHGVPSWVLVLLLTLGLCSLQATADSVLDPDFRENYFEQYMDHFNFESFSNKTFGQRFLVSDKFWKMGEGPIFFYTGNEGDIWSLANNSGFIVELAAQQEALLVFAEHRYYGKSLPFGVQSTQRGYTQLLTVEQALADFAVLLQALRHNLGVQDAPTIAFGGSYGGMLSAYMRMKYPHLVAGALAASAPVIAVAGLGNPDQFFRDVTADFYGQSPKCAQAVRDAFQQIKDLFLQGAYDTISQNFGTCQSLSSPKDLTQLFGFARNAFTVLAMMDYPYPTNFLGPLPANPVKVGCERLLSEGQRIMGLRALAGLVYNSSGMEPCFDIYQMYQSCADPTGCGTGSNARAWDYQACTEINLTFDSNNVTDMFPEIPFSDELRQQYCLDTWGVWPRPDWLQTSFWGGDLKAASNIIFSNGDLDPWAGGGIQRNLSTSIIAVTIQGGAHHLDLRASNSEDPPSVVEVRKLEATLIREWVAAARLKQPAEAQWPGPK,uniprot_search,Q9EPB1,C[C@H](N=C(O)[C@@H](N)CCCCN)C(O)=Nc1ccc2ccccc2c1.O>>CC(N=C(O)C(N)CCCCN)C(=O)O.Nc1ccc2ccccc2c1,536.0,7.873965788375383e-15,37.0,5.5,3.4.14.2,10116.0,2.72916478969277,C[C@H](N=C(O)[C@@H](N)CCCCN)C(O)=Nc1ccc2ccccc2c1.O,CC(N=C(O)C(N)CCCCN)C(=O)O.Nc1ccc2ccccc2c1,2.72916478969277,C[C@H](N=C(O)[C@@H](N)CCCCN)C(O)=Nc1ccc2ccccc2c1.O__MGLHPCSPVDHGVPSWVLVLLLTLGLCSLQATADSVLDPDFRENYFEQYMDHFNFESFSNKTFGQRFLVSDKFWKMGEGPIFFYTGNEGDIWSLANNSGFIVELAAQQEALLVFAEHRYYGKSLPFGVQSTQRGYTQLLTVEQALADFAVLLQALRHNLGVQDAPTIAFGGSYGGMLSAYMRMKYPHLVAGALAASAPVIAVAGLGNPDQFFRDVTADFYGQSPKCAQAVRDAFQQIKDLFLQGAYDTISQNFGTCQSLSSPKDLTQLFGFARNAFTVLAMMDYPYPTNFLGPLPANPVKVGCERLLSEGQRIMGLRALAGLVYNSSGMEPCFDIYQMYQSCADPTGCGTGSNARAWDYQACTEINLTFDSNNVTDMFPEIPFSDELRQQYCLDTWGVWPRPDWLQTSFWGGDLKAASNIIFSNGDLDPWAGGGIQRNLSTSIIAVTIQGGAHHLDLRASNSEDPPSVVEVRKLEATLIREWVAAARLKQPAEAQWPGPK,./data/raw/alphafold//AF-Q9EPB1-F1-model_v4.pdb,3344,2208,3895,3516
+284,10761,10916,MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,uniprot_search,P23946,C[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.O>>,51.0,99.8216120561708,45.66666666666666,8.375,3.4.21.39,9606.0,1.7075701760979365,C[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.O,,1.7075701760979365,C[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.O__MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,./data/raw/alphafold//AF-P23946-F1-model_v4.pdb,1858,1553,3136,1905
+285,23136,23478,MNSLEKVLYTAIVTATGGRDGSVVSSDNVLNVKLSVPQGLGGPGGSGTNPEQLFAAGYSACFIGALKFVANKEKVDLPAEPRVEGRVGIGEIPGGFGLVVELRIAVSGMERSMLQTLVDKAHRVCPYSNATRGNIDVVLILID,brenda,Q9PCF4,OO>>O,9.53,30.17028418412567,37.0,7.4,1.11.1.28,2371.0,0.9790929006383264,OO,O,0.9790929006383264,OO__MNSLEKVLYTAIVTATGGRDGSVVSSDNVLNVKLSVPQGLGGPGGSGTNPEQLFAAGYSACFIGALKFVANKEKVDLPAEPRVEGRVGIGEIPGGFGLVVELRIAVSGMERSMLQTLVDKAHRVCPYSNATRGNIDVVLILID,./data/raw/alphafold//AF-Q9PCF4-F1-model_v4.pdb,1601,1188,1663,1391
+286,19979,20265,MQTRRVVLKSAAAAGTLLGGLAGCASVAGSIGTGDRINTVRGPITISEAGFTLTHEHICGSSAGFLRAWPEFFGSRKALAEKAVRGLRRARAAGVRTIVDVSTFDIGRDVSLLAEVSRAADVHIVAATGLWFDPPLSMRLRSVEELTQFFLREIQYGIEDTGIRAGIIKVATTGKATPFQELVLKAAARASLATGVPVTTHTAASQRDGEQQAAIFESEGLSPSRVCIGHSDDTDDLSYLTALAARGYLIGLDHIPHSAIGLEDNASASALLGIRSWQTRALLIKALIDQGYMKQILVSNDWLFGFSSYVTNIMDVMDRVNPDGMAFIPLRVIPFLREKGVPQETLAGITVTNPARFLSPTLRAS,brenda,P0A434,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1>>O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,2500.0,0.0,30.0,9.0,3.1.8.1,293.0,3.397940008672037,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,3.397940008672037,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MQTRRVVLKSAAAAGTLLGGLAGCASVAGSIGTGDRINTVRGPITISEAGFTLTHEHICGSSAGFLRAWPEFFGSRKALAEKAVRGLRRARAAGVRTIVDVSTFDIGRDVSLLAEVSRAADVHIVAATGLWFDPPLSMRLRSVEELTQFFLREIQYGIEDTGIRAGIIKVATTGKATPFQELVLKAAARASLATGVPVTTHTAASQRDGEQQAAIFESEGLSPSRVCIGHSDDTDDLSYLTALAARGYLIGLDHIPHSAIGLEDNASASALLGIRSWQTRALLIKALIDQGYMKQILVSNDWLFGFSSYVTNIMDVMDRVNPDGMAFIPLRVIPFLREKGVPQETLAGITVTNPARFLSPTLRAS,./data/raw/alphafold//AF-P0A434-F1-model_v4.pdb,1579,1158,3003,1351
+287,20252,20545,MLSNARIIAAGCIAAGSLVAAGPCDIYSSGGTPCVAAHSTTRALFSAYTGPLYQVKRGSDGATTAISPLSSGVANAAAQDAFCAGTTCLITIIYDQSGRGNHLREAPPGGFSGPESNGYDNLASAIGAPVTLNGQKAYGVFVSPGTGYRNNAASGTAKGDAAEGMYAVLDGTHYNGACCFDYGNAETNSRDTGNGHMEAIYFGDSTVWGTGSGKGPWIMADLENGLFSGSSPGNNAGDPSISYRFVTAAIKGQPNQWAIRGGNAASGSLSTFYSGARPQVSGYNPMSKEGAIILGIGGDNSNGGQGTFYEGVMTSGYPSDATENSVQANIVAARYAVAPLTSGPALTVGSSISLRATTACCTTRYIAHSGSTVNTQVVSSSSATALKQQASWTVRAGLANNACFSFESQDTSGSYIRHSNFGLVLNANDGSKLFAEDATFCTQAGINGQGSSIRSWSYPTRYFRHYNNTLYIASNGGVHVFDATAAFNDDVSFVVSGGFA,uniprot_search,P48792,O.O=[N+]([O-])c1cccc(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)c1>>O=[N+]([O-])c1cccc(O)c1.O[C@@H]1[C@@H](O)[C@H](O)OC[C@H]1O,5.22,9.809384078968736e-15,25.0,4.2,3.2.1.37,97093.0,0.7176705030022621,O.O=[N+]([O-])c1cccc(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)c1,O=[N+]([O-])c1cccc(O)c1.O[C@@H]1[C@@H](O)[C@H](O)OC[C@H]1O,0.7176705030022621,O.O=[N+]([O-])c1cccc(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)c1__MLSNARIIAAGCIAAGSLVAAGPCDIYSSGGTPCVAAHSTTRALFSAYTGPLYQVKRGSDGATTAISPLSSGVANAAAQDAFCAGTTCLITIIYDQSGRGNHLREAPPGGFSGPESNGYDNLASAIGAPVTLNGQKAYGVFVSPGTGYRNNAASGTAKGDAAEGMYAVLDGTHYNGACCFDYGNAETNSRDTGNGHMEAIYFGDSTVWGTGSGKGPWIMADLENGLFSGSSPGNNAGDPSISYRFVTAAIKGQPNQWAIRGGNAASGSLSTFYSGARPQVSGYNPMSKEGAIILGIGGDNSNGGQGTFYEGVMTSGYPSDATENSVQANIVAARYAVAPLTSGPALTVGSSISLRATTACCTTRYIAHSGSTVNTQVVSSSSATALKQQASWTVRAGLANNACFSFESQDTSGSYIRHSNFGLVLNANDGSKLFAEDATFCTQAGINGQGSSIRSWSYPTRYFRHYNNTLYIASNGGVHVFDATAAFNDDVSFVVSGGFA,./data/raw/alphafold//AF-P48792-F1-model_v4.pdb,2147,4351,4240,4104
+288,15468,15692,MANAITFFKLNTGAKFPSVGLGTWQASPGLVGDAVAAAVKIGYRHIDCAQIYGNEKEIGAVLKKLFEDRVVKREDLFITSKLWCTDHDPQDVPEALNRTLKDLQLEYVDLYLIHWPARIKKGSVGIKPENLLPVDIPSTWKAMEALYDSGKARAIGVSNFSTKKLADLLELARVPPAVNQVECHPSWRQTKLQEFCKSKGVHLSAYSPLGSPGTTWLKSDVLKNPILNMVAEKLGKSPAQVALRWGLQMGHSVLPKSTNEGRIKENFNVFDWSIPDYMFAKFAEIEQARLVTGSFLVHETLSPYKSIEELWDGEI,sabio,Q0PGJ6,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.[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.O=CCO,34860.0,0.0,25.0,7.0,1.1.1.-,3702.0,4.542327382773975,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.[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.O=CCO,4.542327382773975,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.[H]__MANAITFFKLNTGAKFPSVGLGTWQASPGLVGDAVAAAVKIGYRHIDCAQIYGNEKEIGAVLKKLFEDRVVKREDLFITSKLWCTDHDPQDVPEALNRTLKDLQLEYVDLYLIHWPARIKKGSVGIKPENLLPVDIPSTWKAMEALYDSGKARAIGVSNFSTKKLADLLELARVPPAVNQVECHPSWRQTKLQEFCKSKGVHLSAYSPLGSPGTTWLKSDVLKNPILNMVAEKLGKSPAQVALRWGLQMGHSVLPKSTNEGRIKENFNVFDWSIPDYMFAKFAEIEQARLVTGSFLVHETLSPYKSIEELWDGEI,./data/raw/alphafold//AF-Q0PGJ6-F1-model_v4.pdb,1329,3901,224,242
+289,1406,1434,MANAITFFKLNTGAKFPSVGLGTWQASPGLVGDAVAAAVKIGYRHIDCAQIYGNEKEIGAVLKKLFEDRVVKREDLFITSKLWCTDHDPQDVPEALNRTLKDLQLEYVDLYLIHWPARIKKGSVGIKPENLLPVDIPSTWKAMEALYDSGKARAIGVSNFSTKKLADLLELARVPPAVNQVECHPSWRQTKLQEFCKSKGVHLSAYSPLGSPGTTWLKSDVLKNPILNMVAEKLGKSPAQVALRWGLQMGHSVLPKSTNEGRIKENFNVFDWSIPDYMFAKFAEIEQARLVTGSFLVHETLSPYKSIEELWDGEI,sabio,Q0PGJ6,CC(=O)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)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)c1,54180.0,6.94062228152616e-15,25.0,7.0,1.1.1.-,3702.0,4.73383900069715,CC(=O)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)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)c1,4.73383900069715,CC(=O)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]__MANAITFFKLNTGAKFPSVGLGTWQASPGLVGDAVAAAVKIGYRHIDCAQIYGNEKEIGAVLKKLFEDRVVKREDLFITSKLWCTDHDPQDVPEALNRTLKDLQLEYVDLYLIHWPARIKKGSVGIKPENLLPVDIPSTWKAMEALYDSGKARAIGVSNFSTKKLADLLELARVPPAVNQVECHPSWRQTKLQEFCKSKGVHLSAYSPLGSPGTTWLKSDVLKNPILNMVAEKLGKSPAQVALRWGLQMGHSVLPKSTNEGRIKENFNVFDWSIPDYMFAKFAEIEQARLVTGSFLVHETLSPYKSIEELWDGEI,./data/raw/alphafold//AF-Q0PGJ6-F1-model_v4.pdb,1329,3901,224,242
+290,6372,6482,MVRISIAGGNEIDPGSMGLTLFHEHLRLITEVVRWNWPHLYNEDEELKRAIDAVNAAKKYGVKTIIDLTVAGIGCDVRFNEKVAKATGVNIIMGTGFYTYTEIPFYFKNRGIDSLVDAFVHDITIGIQGTNTRAAFVKAVIDSSGLTKDVEMAIRAAAKAHIKTDVPIITHSFVGNKSSLDLIRIFKEEGVDLARTVIGHVGDTDDISFIEQILREGAFIGLDRFGLDIYLPLDKRVKTAIELIKRGWIDQLLLSHDYCPTIDWYPPEVVRSTVPDWTMTLIFEKVIPRMRSEGITEEQINRVLIDNPRRLFTGR,brenda,F0QXN6,CCC1CCC(=O)O1.O>>CCC(O)CCC(=O)O,112.3,1.0712318587658591e-14,40.0,8.3,3.1.1.25,985052.0,2.050379756261458,CCC1CCC(=O)O1.O,CCC(O)CCC(=O)O,2.050379756261458,CCC1CCC(=O)O1.O__MVRISIAGGNEIDPGSMGLTLFHEHLRLITEVVRWNWPHLYNEDEELKRAIDAVNAAKKYGVKTIIDLTVAGIGCDVRFNEKVAKATGVNIIMGTGFYTYTEIPFYFKNRGIDSLVDAFVHDITIGIQGTNTRAAFVKAVIDSSGLTKDVEMAIRAAAKAHIKTDVPIITHSFVGNKSSLDLIRIFKEEGVDLARTVIGHVGDTDDISFIEQILREGAFIGLDRFGLDIYLPLDKRVKTAIELIKRGWIDQLLLSHDYCPTIDWYPPEVVRSTVPDWTMTLIFEKVIPRMRSEGITEEQINRVLIDNPRRLFTGR,./data/raw/alphafold//AF-F0QXN6-F1-model_v4.pdb,3234,1051,877,1209
+291,8051,8179,MAAAALGQIWARKLLSVPWLLCGPRRYASSSFKAADLQLEMTQKPHKKPGPGEPLVFGKTFTDHMLMVEWNDKGWGQPRIQPFQNLTLHPASSSLHYSLQLFEGMKAFKGKDQQVRLFRPWLNMDRMLRSAMRLCLPSFDKLELLECIRRLIEVDKDWVPDAAGTSLYVRPVLIGNEPSLGVSQPTRALLFVILCPVGAYFPGGSVTPVSLLADPAFIRAWVGGVGNYKLGGNYGPTVLVQQEALKRGCEQVLWLYGPDHQLTEVGTMNIFVYWTHEDGVLELVTPPLNGVILPGVVRQSLLDMAQTWGEFRVVERTITMKQLLRALEEGRVREVFGSGTACQVCPVHRILYKDRNLHIPTMENGPELILRFQKELKEIQYGIRAHEWMFPV,brenda,O15382,CC[C@H](C)[C@H](N)C(=O)O.O=C(O)CC(=O)C(=O)O>>CC(C)CC(=O)C(=O)O.N[C@@H](CC(=O)O)C(=O)O,371.0,0.0,20.0,7.8,2.6.1.42,9606.0,2.569373909615046,CC[C@H](C)[C@H](N)C(=O)O.O=C(O)CC(=O)C(=O)O,CC(C)CC(=O)C(=O)O.N[C@@H](CC(=O)O)C(=O)O,2.569373909615046,CC[C@H](C)[C@H](N)C(=O)O.O=C(O)CC(=O)C(=O)O__MAAAALGQIWARKLLSVPWLLCGPRRYASSSFKAADLQLEMTQKPHKKPGPGEPLVFGKTFTDHMLMVEWNDKGWGQPRIQPFQNLTLHPASSSLHYSLQLFEGMKAFKGKDQQVRLFRPWLNMDRMLRSAMRLCLPSFDKLELLECIRRLIEVDKDWVPDAAGTSLYVRPVLIGNEPSLGVSQPTRALLFVILCPVGAYFPGGSVTPVSLLADPAFIRAWVGGVGNYKLGGNYGPTVLVQQEALKRGCEQVLWLYGPDHQLTEVGTMNIFVYWTHEDGVLELVTPPLNGVILPGVVRQSLLDMAQTWGEFRVVERTITMKQLLRALEEGRVREVFGSGTACQVCPVHRILYKDRNLHIPTMENGPELILRFQKELKEIQYGIRAHEWMFPV,./data/raw/alphafold//AF-O15382-F1-model_v4.pdb,1789,1460,3026,1774
+292,9616,9762,MDTAEERLKGQAEIWEHMFAFVDSMALKCAVELGIPDIINSHGRPVTISEIVDSLKTNTPSSSPNIDYLTRIMRLLVHKRLFTSELHQESNQLLYNLTRSSKWLLKDSKFNLSPLVLWETNPILLKPWQYLGKCAQEKSSPFERAHGCEIWDLALADPKFNNFLNGAMQCSTTTIINEMLLEYKDGFSGIAGSLVDVGGGTGSIIAEIVKAHPHIQGINFDLPHVVATAAEFPGVKHVGGDMFVDIPEADAVIMKWILHDWSDEDCTIILKNCYRAIRKKKNGKVIIVDCVLRPDGNDLFDKMGLIFDVLMMAHTTAGKERTEAEWKILLNNAGFPRYNVIRTPAFPCIIEAFPE,sabio,Q6WUC2,COc1ccc(C(=O)O)cc1[O-].C[S+](CCC(N)C(=O)O)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O>>Nc1ncnc2c1ncn2C1OC(CSCCC(N)C(=O)O)C(O)C1O,0.02,19.13580830473597,35.0,8.0,2.1.1.-,3469.0,-1.6989700043360187,COc1ccc(C(=O)O)cc1[O-].C[S+](CCC(N)C(=O)O)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O,Nc1ncnc2c1ncn2C1OC(CSCCC(N)C(=O)O)C(O)C1O,-1.6989700043360187,COc1ccc(C(=O)O)cc1[O-].C[S+](CCC(N)C(=O)O)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O__MDTAEERLKGQAEIWEHMFAFVDSMALKCAVELGIPDIINSHGRPVTISEIVDSLKTNTPSSSPNIDYLTRIMRLLVHKRLFTSELHQESNQLLYNLTRSSKWLLKDSKFNLSPLVLWETNPILLKPWQYLGKCAQEKSSPFERAHGCEIWDLALADPKFNNFLNGAMQCSTTTIINEMLLEYKDGFSGIAGSLVDVGGGTGSIIAEIVKAHPHIQGINFDLPHVVATAAEFPGVKHVGGDMFVDIPEADAVIMKWILHDWSDEDCTIILKNCYRAIRKKKNGKVIIVDCVLRPDGNDLFDKMGLIFDVLMMAHTTAGKERTEAEWKILLNNAGFPRYNVIRTPAFPCIIEAFPE,./data/raw/alphafold//AF-Q6WUC2-F1-model_v4.pdb,3512,3514,1286,3235
+293,12192,12356,MKKGVLRPGHIQLRVLNLESALAHYRDLLGLIEVDRDDFGRVYLKAWTEVDKFSLVLREADEPGMDFMGFKVVDEDALRQLERDLMAYGCAVEQLPAGELNSCGRRVRFQAPSGHHFELYADKEYTGKWGVNEVNPEAWPRDLKGMAAVRFDHALMYGDELPATYDLFTKVLGFYLAEQVLDENGTRVAQFLSLSTKAHDVAFIHHPEKGRLHHVSFHLETWEDVLRAADLISMTDTSIDIGPTRHGLTHGKTIYFFDPSGNRNEVFCGGDYNYPDHKPVTWTTDQLGKAIFYHDRILNERFMTVLT,sabio,Q8KLV4,Cc1cccc(O)c1O.O=O>>CC(=O)C=CC=C(O)C(=O)O,112.0,0.0,25.0,7.5,1.13.11.2,316.0,2.049218022670181,Cc1cccc(O)c1O.O=O,CC(=O)C=CC=C(O)C(=O)O,2.049218022670181,Cc1cccc(O)c1O.O=O__MKKGVLRPGHIQLRVLNLESALAHYRDLLGLIEVDRDDFGRVYLKAWTEVDKFSLVLREADEPGMDFMGFKVVDEDALRQLERDLMAYGCAVEQLPAGELNSCGRRVRFQAPSGHHFELYADKEYTGKWGVNEVNPEAWPRDLKGMAAVRFDHALMYGDELPATYDLFTKVLGFYLAEQVLDENGTRVAQFLSLSTKAHDVAFIHHPEKGRLHHVSFHLETWEDVLRAADLISMTDTSIDIGPTRHGLTHGKTIYFFDPSGNRNEVFCGGDYNYPDHKPVTWTTDQLGKAIFYHDRILNERFMTVLT,./data/raw/alphafold//AF-Q8KLV4-F1-model_v4.pdb,752,4169,4037,3883
+294,21207,21531,MSLITDIIAREVLDSRGNPTLEAEVITELGGFGRGMVPSGASTGEHEAVELRDGDKSRFGGKGTTKAVANVNDAIAKALVGKFDVTDQRAIDQAMIELDGTENKGNLGANAILAVSIAAARAAADELGVPLFSYLGGANSYVLPTPMMNVINGGAHSANKVDFQEFMIMPVGAPTVKEAIRYGSETFHALKKLLEADGKATSVGDEGGFAPDFADNEEPLKYLIRAIEAAGYKPGKDIAIAVDVASSELYDAETKTYKLRWSTGEEFTTPEFIKYLEDLADRYPIISIEDPIDENEWEDWAAITAELGKKVQLVGDDFFVTNTQYLEKGINMGAANSILIKVNQIGTLTETFEAIEMAKEAGYTAIVSHRSGETEDTTISDLVVATNAGQIKTGSLSRTDRIAKYNQLIRIEELLDTTAKYKGIHSFYNLSAAAREVIENK,sabio,Q1ET73,O=C(O)C(CO)OP(=O)(O)O>>C=C(OP(=O)(O)O)C(=O)O.O,27.53,7.617473956989862e-15,30.0,6.8,4.2.1.11,1245.0,1.4398062113933303,O=C(O)C(CO)OP(=O)(O)O,C=C(OP(=O)(O)O)C(=O)O.O,1.4398062113933303,O=C(O)C(CO)OP(=O)(O)O__MSLITDIIAREVLDSRGNPTLEAEVITELGGFGRGMVPSGASTGEHEAVELRDGDKSRFGGKGTTKAVANVNDAIAKALVGKFDVTDQRAIDQAMIELDGTENKGNLGANAILAVSIAAARAAADELGVPLFSYLGGANSYVLPTPMMNVINGGAHSANKVDFQEFMIMPVGAPTVKEAIRYGSETFHALKKLLEADGKATSVGDEGGFAPDFADNEEPLKYLIRAIEAAGYKPGKDIAIAVDVASSELYDAETKTYKLRWSTGEEFTTPEFIKYLEDLADRYPIISIEDPIDENEWEDWAAITAELGKKVQLVGDDFFVTNTQYLEKGINMGAANSILIKVNQIGTLTETFEAIEMAKEAGYTAIVSHRSGETEDTTISDLVVATNAGQIKTGSLSRTDRIAKYNQLIRIEELLDTTAKYKGIHSFYNLSAAAREVIENK,./data/raw/alphafold//AF-Q1ET73-F1-model_v4.pdb,606,3337,5656,6549
+295,2370,2404,MEFVRTPDDRFADLPDFPYAPHYLEGLPGFEGLRMHYVDEGPRDAEHTFLCLHGEPSWSFLYRKMLPVFTAAGGRVVAPDLFGFGRSDKPTDDAVYTFGFHRRSLLAFLDALQLERVTLVCQDWGGILGLTLPVDRPQLVDRLIVMNTALAVGLSPGKGFESWRDFVANSPDLDVGKLMQRAIPGITDAEVAAYDAPFPGPEFKAGVRRFPAIVPITPDMEGAEIGRQAMSFWSTQWSGPTFMAVGPQDPVLGPEVMGMLRQAIGGCPEPMIVEAGGHFVQEHGEPIARAALAAFGQ,brenda,A6G7B1,CC(Br)CBr.O>>CC(Br)CO.[Br-],1.97,0.2291950886766669,35.0,8.2,3.8.1.5,191768.0,0.2944662261615929,CC(Br)CBr.O,CC(Br)CO.[Br-],0.2944662261615929,CC(Br)CBr.O__MEFVRTPDDRFADLPDFPYAPHYLEGLPGFEGLRMHYVDEGPRDAEHTFLCLHGEPSWSFLYRKMLPVFTAAGGRVVAPDLFGFGRSDKPTDDAVYTFGFHRRSLLAFLDALQLERVTLVCQDWGGILGLTLPVDRPQLVDRLIVMNTALAVGLSPGKGFESWRDFVANSPDLDVGKLMQRAIPGITDAEVAAYDAPFPGPEFKAGVRRFPAIVPITPDMEGAEIGRQAMSFWSTQWSGPTFMAVGPQDPVLGPEVMGMLRQAIGGCPEPMIVEAGGHFVQEHGEPIARAALAAFGQ,./data/raw/alphafold//AF-A6G7B1-F1-model_v4.pdb,1001,534,185,200
+296,19012,19297,MVQAHGGRSRAQPLTLSLGAAMTQPPPEKTPAKKHVRLQERRGSNVALMLDVRSLGAVEPICSVNTPREVTLHFLRTAGHPLTRWALQRQPPSPKQLEEEFLKIPSNFVSPEDLDIPGHASKDRYKTILPNPQSRVCLGRAQSQEDGDYINANYIRGYDGKEKVYIATQGPMPNTVSDFWEMVWQEEVSLIVMLTQLREGKEKCVHYWPTEEETYGPFQIRIQDMKECPEYTVRQLTIQYQEERRSVKHILFSAWPDHQTPESAGPLLRLVAEVEESPETAAHPGPIVVHCSAGIGRTGCFIATRIGCQQLKARGEVDILGIVCQLRLDRGGMIQTAEQYQFLHHTLALYAGQLPEEPSP,sabio,P35236,O>>*C(N)C(=O)NC(*)C(=O)NC(*)C(=O)O.O=P(O)(O)O,0.86,87.78516671284753,25.0,7.0,3.1.3.-,9606.0,-0.0655015487564322,O,*C(N)C(=O)NC(*)C(=O)NC(*)C(=O)O.O=P(O)(O)O,-0.0655015487564322,O__MVQAHGGRSRAQPLTLSLGAAMTQPPPEKTPAKKHVRLQERRGSNVALMLDVRSLGAVEPICSVNTPREVTLHFLRTAGHPLTRWALQRQPPSPKQLEEEFLKIPSNFVSPEDLDIPGHASKDRYKTILPNPQSRVCLGRAQSQEDGDYINANYIRGYDGKEKVYIATQGPMPNTVSDFWEMVWQEEVSLIVMLTQLREGKEKCVHYWPTEEETYGPFQIRIQDMKECPEYTVRQLTIQYQEERRSVKHILFSAWPDHQTPESAGPLLRLVAEVEESPETAAHPGPIVVHCSAGIGRTGCFIATRIGCQQLKARGEVDILGIVCQLRLDRGGMIQTAEQYQFLHHTLALYAGQLPEEPSP,./data/raw/alphafold//AF-P35236-F1-model_v4.pdb,225,2744,5056,5913
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+303,12862,13034,MTATPEVQKSIEEVYTKLQGASDCSSLLKKHLTKDVVAKNKSKKTRLGATLLDVIQSGGENLDSGVGIYAPDAESYTLFADLFNPVIEEYHNGFKATDTQPAMDLGEKNVGELADLDPEGKFIVSTRIRCGRSLQGYPFNPCLSETNYKMMETRMKEIFNSITDPELKGTYYPLTGMDEETKKKLIADHFLFKEGDRFLKAANANRYWPNGRGIFHNEKKTFLVWVNEEDHLRIISMQNGGNVGEVLARLIKGLNLVAAKAPFARHPRLGWLTFCPTNLGTTVRASVHIKLPKISAKDDFKKICSDMKLQIRGIHGEHSESKEGIYDISNKQRLGLTEYQAVRQMYDGLKKLIELEKAAA,brenda,Q27535,N=C(N)NCCC[C@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>N=C(NCCC[C@H](N)C(=O)O)NP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,180.0,0.0,25.0,8.0,2.7.3.3,6239.0,2.255272505103306,N=C(N)NCCC[C@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,N=C(NCCC[C@H](N)C(=O)O)NP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,2.255272505103306,N=C(N)NCCC[C@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MTATPEVQKSIEEVYTKLQGASDCSSLLKKHLTKDVVAKNKSKKTRLGATLLDVIQSGGENLDSGVGIYAPDAESYTLFADLFNPVIEEYHNGFKATDTQPAMDLGEKNVGELADLDPEGKFIVSTRIRCGRSLQGYPFNPCLSETNYKMMETRMKEIFNSITDPELKGTYYPLTGMDEETKKKLIADHFLFKEGDRFLKAANANRYWPNGRGIFHNEKKTFLVWVNEEDHLRIISMQNGGNVGEVLARLIKGLNLVAAKAPFARHPRLGWLTFCPTNLGTTVRASVHIKLPKISAKDDFKKICSDMKLQIRGIHGEHSESKEGIYDISNKQRLGLTEYQAVRQMYDGLKKLIELEKAAA,./data/raw/alphafold//AF-Q27535-F1-model_v4.pdb,2198,4425,4324,4204
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+305,12241,12409,MQRIETKFQDVVLLEPKVFGDGRGFFMESYNKAVLEVLGIHIDFVQDNQSLSREAGVLRGLHYQLNPKAQTKLVRVLTGAIYDVVVDIRKNSPTFGQWEAFILSEENKRQLLVPKGFAHGFCTLVPNTQVFYKVDEYYSPEHDRGIAWDDAALNIPWPTSEPILSEKDKCHPVLAEAEINFE,sabio,Q93F86,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OC3OC(C)C(=O)C(O)C3O)O2)c(=O)[nH]c1=O>>Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OC3OC(C)C(=O)C(O)C3O)O2)c(=O)[nH]c1=O,2.0,0.0,25.0,7.0,5.1.3.13,143495.0,0.3010299956639812,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OC3OC(C)C(=O)C(O)C3O)O2)c(=O)[nH]c1=O,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OC3OC(C)C(=O)C(O)C3O)O2)c(=O)[nH]c1=O,0.3010299956639812,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OC3OC(C)C(=O)C(O)C3O)O2)c(=O)[nH]c1=O__MQRIETKFQDVVLLEPKVFGDGRGFFMESYNKAVLEVLGIHIDFVQDNQSLSREAGVLRGLHYQLNPKAQTKLVRVLTGAIYDVVVDIRKNSPTFGQWEAFILSEENKRQLLVPKGFAHGFCTLVPNTQVFYKVDEYYSPEHDRGIAWDDAALNIPWPTSEPILSEKDKCHPVLAEAEINFE,./data/raw/alphafold//AF-Q93F86-F1-model_v4.pdb,2029,4191,4060,3907
+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
+307,7303,7425,MAARLLLRSLRVLSARSATLPPPSARCSHSGAEARLETPSAKKLTDIGIRRIFSSEHDIFRESVRKFFQEEVIPYHEEWEKAGEVSRELWEKAGKQGLLGINIAEKHGGIGGDLLSTAVTWEEQAYSNCTGPGFSLHSDIVMPYIANYGTKEQIEQFIPQMTAGKCIGAIAMTEPGAGSDLQGVRTNAKRSGSDWILNGSKVFITNGWLSDLVIVVAVTNREARSPAHGISLFLVENGMKGFIKGKKLHKMGMKAQDTAELFFEDVRLPASALLGEENKGFYYLMQELPQERLLIADLAISACEFMFEETRNYVRQRKAFGKTVAHIQTVQHKLAELKTNICVTRAFVDSCLQLHETKRLDSASASMAKYWASELQNTVAYQCVQLHGGWGYMWEYPIAKAYVDARVQPIYGGTNEIMKELIARQIVSDS,sabio,P15650,CCCCCCCCCCCC(=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>>CCCCCCCCCC=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)c1N2,5.4,6.549139366590686e-15,32.0,8.0,1.3.8.8,10116.0,0.7323937598229685,CCCCCCCCCCCC(=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,CCCCCCCCCC=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)c1N2,0.7323937598229685,CCCCCCCCCCCC(=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
+308,21041,21363,MSLSTEQMLRDYPRSMQINGQIPKNAIHETYGNDGVDVFIAGSGPIGATYAKLCVEAGLRVVMVEIGAADSFYAVNAEEGTAVPYVPGYHKKNEIEFQKDIDRFVNVIKGALQQVSVPVRNQNVPTLDPGAWSAPPGSSAISNGKNPHQREFENLSAEAVTRGVGGMSTHWTCSTPRIHPPMESLPGIGRPKLSNDPAEDDKEWNELYSEAERLIGTSTKEFDESIRHTLVLRSLQDAYKDRQRIFRPLPLACHRLKNAPEYVEWHSAENLFHSIYNDDKQKKLFTLLTNHRCTRLALTGGYEKKIGAAEVRNLLATRNPSSQLDSYIMAKVYVLASGAIGNPQILYNSGFSGLQVTPRNDSLIPNLGRYITEQPMAFCQIVLRQEFVDSVRDDPYGLPWWKEAVAQHIAKNPTDALPIPFRDPEPQVTTPFTEEHPWHTQIHRDAFSYGAVGPEVDSRVIVDLRWFGATDPEANNLLVFQNDVQDGYSMPQPTFRYRPSTASNVRARKMMADMCEVASNLGGYLPTSPPQFMDPGLALHLAGTTRIGFDKATTVADNNSLVWDFANLYVAGNGTIRTGFGENPTLTSMCHAIKSARSIINTLKGGTDGKNTGEHRNL,brenda,Q75ZP8,O=C(CO)[C@@H](O)[C@H](O)[C@@H](O)CO.O=O>>O=C(CO)[C@@H](O)[C@H](O)C(=O)CO.OO,7.7,0.0,30.0,6.5,1.1.3.10,47721.0,0.8864907251724818,O=C(CO)[C@@H](O)[C@H](O)[C@@H](O)CO.O=O,O=C(CO)[C@@H](O)[C@H](O)C(=O)CO.OO,0.8864907251724818,O=C(CO)[C@@H](O)[C@H](O)[C@@H](O)CO.O=O__MSLSTEQMLRDYPRSMQINGQIPKNAIHETYGNDGVDVFIAGSGPIGATYAKLCVEAGLRVVMVEIGAADSFYAVNAEEGTAVPYVPGYHKKNEIEFQKDIDRFVNVIKGALQQVSVPVRNQNVPTLDPGAWSAPPGSSAISNGKNPHQREFENLSAEAVTRGVGGMSTHWTCSTPRIHPPMESLPGIGRPKLSNDPAEDDKEWNELYSEAERLIGTSTKEFDESIRHTLVLRSLQDAYKDRQRIFRPLPLACHRLKNAPEYVEWHSAENLFHSIYNDDKQKKLFTLLTNHRCTRLALTGGYEKKIGAAEVRNLLATRNPSSQLDSYIMAKVYVLASGAIGNPQILYNSGFSGLQVTPRNDSLIPNLGRYITEQPMAFCQIVLRQEFVDSVRDDPYGLPWWKEAVAQHIAKNPTDALPIPFRDPEPQVTTPFTEEHPWHTQIHRDAFSYGAVGPEVDSRVIVDLRWFGATDPEANNLLVFQNDVQDGYSMPQPTFRYRPSTASNVRARKMMADMCEVASNLGGYLPTSPPQFMDPGLALHLAGTTRIGFDKATTVADNNSLVWDFANLYVAGNGTIRTGFGENPTLTSMCHAIKSARSIINTLKGGTDGKNTGEHRNL,./data/raw/alphafold//AF-Q75ZP8-F1-model_v4.pdb,567,3284,5594,6480
+309,17736,17979,MHLLVRALVEEMAGRGVPHRVLTMSPPKVPKDIRIGQRIKVHARRLPVLPIPSDLEGYFGLVGAWAKGSLLWVLRNRKRLRREIGARVHAHCDGSGAAAFYPYLMSRILGVPLVVQIHSSRYLSQHPTTLFERVTDPIAKWAERHAVRKAAAVLMLTDRARDEMRRKAQLPAERVHRLAYLASDQFKDADTEARRAELRERYGLDDRPIVLYVGRIAAEKGVEYYIEAAAELTRRGRDCQFVIAGDGPARPDLEKLIGARGLRDRVTITGFMSHEFIPSMISLGELVVLPSRYEELGIVILECMTMRRPLVAHDVNGVNKLIEDGTTGIVVPPFRTPEMADAVERLLDDPELRERMAENAAPLPAAKYSLSAAGDQLAGIYREIGL,brenda,Q65CC7,N[C@H]1[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](N)C[C@@H]2N)O[C@H](CO)[C@@H](O)[C@@H]1O.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>>O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.053,37.49487376130379,30.0,7.6,2.4.1.301,1967.0,-1.275724130399211,N[C@H]1[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](N)C[C@@H]2N)O[C@H](CO)[C@@H](O)[C@@H]1O.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,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-1.275724130399211,N[C@H]1[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](N)C[C@@H]2N)O[C@H](CO)[C@@H](O)[C@@H]1O.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__MHLLVRALVEEMAGRGVPHRVLTMSPPKVPKDIRIGQRIKVHARRLPVLPIPSDLEGYFGLVGAWAKGSLLWVLRNRKRLRREIGARVHAHCDGSGAAAFYPYLMSRILGVPLVVQIHSSRYLSQHPTTLFERVTDPIAKWAERHAVRKAAAVLMLTDRARDEMRRKAQLPAERVHRLAYLASDQFKDADTEARRAELRERYGLDDRPIVLYVGRIAAEKGVEYYIEAAAELTRRGRDCQFVIAGDGPARPDLEKLIGARGLRDRVTITGFMSHEFIPSMISLGELVVLPSRYEELGIVILECMTMRRPLVAHDVNGVNKLIEDGTTGIVVPPFRTPEMADAVERLLDDPELRERMAENAAPLPAAKYSLSAAGDQLAGIYREIGL,./data/raw/alphafold//AF-Q65CC7-F1-model_v4.pdb,2809,2382,2658,5497
+310,12720,12891,MVEIDPFEMAVQQLERAAQFMDISEEALEWLKRPMRIVEVSVPVEMDDGSVKVFTGFRVQHNWARGPTKGGIRWHPAETLSTVKALATWMTWKVAVVDLPYGGGKGGIIVDPKKLSEREQERLARSYIRAVYDVIGPWTDIPAPDVYTNPKIMAWMMDEYETIMRRKGPAFGVITGKPPGVGGIVARMDATARGAAFTIREAAKALGWDDLKGKTIAIQGYGNAGYYLHKIMSEEFGMKVVAVSDSKGGIYNPDGLPPADEVLKWKKEHGSVKDMPGTQNITNEELLELEVDILAPSAIEGVITKENADNVKAKIVAEVANGPVTPEADEILHEKGILQIPDFLCNAGGVTVSYFEWVQNINGFYWTVEETRKRLDDKMTKAFWDVFNTHKEKNIHMRDAAYVVAVSRVYEAMKHRGWVKK,sabio,O59650,N.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=C(O)CCC(=O)C(=O)O.[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.NC(CCC(=O)O)C(=O)O.O,702000.0,0.0,70.0,7.6,1.4.1.3,311400.0,5.846337112129805,N.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=C(O)CCC(=O)C(=O)O.[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.NC(CCC(=O)O)C(=O)O.O,5.846337112129805,N.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=C(O)CCC(=O)C(=O)O.[H]__MVEIDPFEMAVQQLERAAQFMDISEEALEWLKRPMRIVEVSVPVEMDDGSVKVFTGFRVQHNWARGPTKGGIRWHPAETLSTVKALATWMTWKVAVVDLPYGGGKGGIIVDPKKLSEREQERLARSYIRAVYDVIGPWTDIPAPDVYTNPKIMAWMMDEYETIMRRKGPAFGVITGKPPGVGGIVARMDATARGAAFTIREAAKALGWDDLKGKTIAIQGYGNAGYYLHKIMSEEFGMKVVAVSDSKGGIYNPDGLPPADEVLKWKKEHGSVKDMPGTQNITNEELLELEVDILAPSAIEGVITKENADNVKAKIVAEVANGPVTPEADEILHEKGILQIPDFLCNAGGVTVSYFEWVQNINGFYWTVEETRKRLDDKMTKAFWDVFNTHKEKNIHMRDAAYVVAVSRVYEAMKHRGWVKK,./data/raw/alphafold//AF-O59650-F1-model_v4.pdb,2148,4362,4252,4120
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+319,20388,20693,MSLLIRGATVITYDERYRADVLCAGGLIRAIGTGLDVPAGTEVLDGSGQYLMPGGIDPHTHMQLPFMGTVASEDFFSGTAAGLAGGTTSIIDFVIPNPQQSLMEAFHQWRGWAEKSASDYGFHVAITWWSEQVREEMAELVSHHGINSFKHFMAYKNAIMAADDTLVASFERCLELGAVPTVHAENGELVYHLQRKLMAQGITGPEAHPLSRPSQVEGEAASRAIRIAETIGTPLYLVHVSTKEALDEITYARGKGQPVYGEVLAGHLLLDDSVYQHPDWHTAAGYVMSPPFRPRGHQEALWHGLQSGNLHTTATDHCCFCAEQKAAGRDDFSKIPNGTAGIEDRMALLWHEGVNTGRLSMQEFVALTSTNTAKIFNLYPRKGAIRVGADADLVLWDPEGTRTISAKTHHQKVDFNIFEGKTVRGVPSHTISQGKLVWADGDLRAERGAGRYVERPAYPSVFEQLSKRAEHSRPTAVKR,brenda,S5MPT0,O.OC1=NC(Cc2c[nH]c3ccccc23)C(O)=N1>>N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,1.43,9.50864452366167,45.0,9.0,3.5.2.2,294.0,0.1553360374650617,O.OC1=NC(Cc2c[nH]c3ccccc23)C(O)=N1,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,0.1553360374650617,O.OC1=NC(Cc2c[nH]c3ccccc23)C(O)=N1__MSLLIRGATVITYDERYRADVLCAGGLIRAIGTGLDVPAGTEVLDGSGQYLMPGGIDPHTHMQLPFMGTVASEDFFSGTAAGLAGGTTSIIDFVIPNPQQSLMEAFHQWRGWAEKSASDYGFHVAITWWSEQVREEMAELVSHHGINSFKHFMAYKNAIMAADDTLVASFERCLELGAVPTVHAENGELVYHLQRKLMAQGITGPEAHPLSRPSQVEGEAASRAIRIAETIGTPLYLVHVSTKEALDEITYARGKGQPVYGEVLAGHLLLDDSVYQHPDWHTAAGYVMSPPFRPRGHQEALWHGLQSGNLHTTATDHCCFCAEQKAAGRDDFSKIPNGTAGIEDRMALLWHEGVNTGRLSMQEFVALTSTNTAKIFNLYPRKGAIRVGADADLVLWDPEGTRTISAKTHHQKVDFNIFEGKTVRGVPSHTISQGKLVWADGDLRAERGAGRYVERPAYPSVFEQLSKRAEHSRPTAVKR,./data/raw/alphafold//AF-S5MPT0-F1-model_v4.pdb,477,1479,3049,1799
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+335,7062,7183,MRIPLVGKDSIESKDIGFTLIHEHLRVFSEAVRQQWPHLYNEDEEFRNAVNEVKRAMQFGVKTIVDPTVMGLGRDIRFMEKVVKATGINLVAGTGIYIYIDLPFYFLNRSIDEIADLFIHDIKEGIQGTLNKAGFVKIAADEPGITKDVEKVIRAAAIANKETKVPIITHSNAHNNTGLEQQRILTEEGVDPGKILIGHLGDTDNIDYIKKIADKGSFIGLDRYGLDLFLPVDKRNETTLRLIKDGYSDKIMISHDYCCTIDWGTAKPEYKPKLAPRWSITLIFEDTIPFLKRNGVNEEVIATIFKENPKKFFS,brenda,Q97VT7,CCCCCCCC(=O)CC(O)=N[C@H]1CCOC1=O.O>>CCCCCCCC(=O)CC(O)=N[C@@H](CCO)C(=O)O,4.52,9.873585900729537e-15,25.0,8.3,3.1.1.25,2287.0,0.6551384348113821,CCCCCCCC(=O)CC(O)=N[C@H]1CCOC1=O.O,CCCCCCCC(=O)CC(O)=N[C@@H](CCO)C(=O)O,0.6551384348113821,CCCCCCCC(=O)CC(O)=N[C@H]1CCOC1=O.O__MRIPLVGKDSIESKDIGFTLIHEHLRVFSEAVRQQWPHLYNEDEEFRNAVNEVKRAMQFGVKTIVDPTVMGLGRDIRFMEKVVKATGINLVAGTGIYIYIDLPFYFLNRSIDEIADLFIHDIKEGIQGTLNKAGFVKIAADEPGITKDVEKVIRAAAIANKETKVPIITHSNAHNNTGLEQQRILTEEGVDPGKILIGHLGDTDNIDYIKKIADKGSFIGLDRYGLDLFLPVDKRNETTLRLIKDGYSDKIMISHDYCCTIDWGTAKPEYKPKLAPRWSITLIFEDTIPFLKRNGVNEEVIATIFKENPKKFFS,./data/raw/alphafold//AF-Q97VT7-F1-model_v4.pdb,3234,2055,3706,2560
+336,13315,13490,MAVDSPDERLQRRIAQLFAEDEQVKAARPLEAVSAAVSAPGMRLAQIAATVMAGYADRPAAGQRAFELNTDDATGRTSLRLLPRFETITYRELWQRVGEVAAAWHHDPENPLRAGDFVALLGFTSIDYATLDLADIHLGAVTVPLQASAAVSQLIAILTETSPRLLASTPEHLDAAVECLLAGTTPERLVVFDYHPEDDDQRAAFESARRRLADAGSLVIVETLDAVRARGRDLPAAPLFVPDTDDDPLALLIYTSGSTGTPKGAMYTNRLAATMWQGNSMLQGNSQRVGINLNYMPMSHIAGRISLFGVLARGGTAYFAAKSDMSTLFEDIGLVRPTEIFFVPRVCDMVFQRYQSELDRRSVAGADLDTLDREVKADLRQNYLGGRFLVAVVGSAPLAAEMKTFMESVLDLPLHDGYGSTEAGASVLLDNQIQRPPVLDYKLVDVPELGYFRTDRPHPRGELLLKAETTIPGYYKRPEVTAEIFDEDGFYKTGDIVAELEHDRLVYVDRRNNVLKLSQGEFVTVAHLEAVFASSPLIRQIFIYGSSERSYLLAVIVPTDDALRGRDTATLKSALAESIQRIAKDANLQPYEIPRDFLIETEPFTIANGLLSGIAKLLRPNLKERYGAQLEQMYTDLATGQADELLALRREAADLPVLETVSRAAKAMLGVASADMRPDAHFTDLGGDSLSALSFSNLLHEIFGVEVPVGVVVSPANELRDLANYIEAERNSGAKRPTFTSVHGGGSEIRAADLTLDKFIDARTLAAADSIPHAPVPAQTVLLTGANGYLGRFLCLEWLERLDKTGGTLICVVRGSDAAAARKRLDSAFDSGDPGLLEHYQQLAARTLEVLAGDIGDPNLGLDDATWQRLAETVDLIVHPAALVNHVLPYTQLFGPNVVGTAEIVRLAITARRKPVTYLSTVGVADQVDPAEYQEDSDVREMSAVRVVRESYANGYGNSKWAGEVLLREAHDLCGLPVAVFRSDMILAHSRYAGQLNVQDVFTRLILSLVATGIAPYSFYRTDADGNRQRAHYDGLPADFTAAAITALGIQATEGFRTYDVLNPYDDGISLDEFVDWLVESGHPIQRITDYSDWFHRFETAIRALPEKQRQASVLPLLDAYRNPCPAVRGAILPAKEFQAAVQTAKIGPEQDIPHLSAPLIDKYVSDLELLQLL,brenda,Q6RKB1,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.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)c1ccccc1.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=Cc1ccccc1.O=P(O)(O)OP(=O)(O)O,1.63,8.260696022171749e-15,30.0,7.5,1.2.1.30,204891.0,0.2121876044039577,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.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)c1ccccc1.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=Cc1ccccc1.O=P(O)(O)OP(=O)(O)O,0.2121876044039577,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.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)c1ccccc1.[H+]__MAVDSPDERLQRRIAQLFAEDEQVKAARPLEAVSAAVSAPGMRLAQIAATVMAGYADRPAAGQRAFELNTDDATGRTSLRLLPRFETITYRELWQRVGEVAAAWHHDPENPLRAGDFVALLGFTSIDYATLDLADIHLGAVTVPLQASAAVSQLIAILTETSPRLLASTPEHLDAAVECLLAGTTPERLVVFDYHPEDDDQRAAFESARRRLADAGSLVIVETLDAVRARGRDLPAAPLFVPDTDDDPLALLIYTSGSTGTPKGAMYTNRLAATMWQGNSMLQGNSQRVGINLNYMPMSHIAGRISLFGVLARGGTAYFAAKSDMSTLFEDIGLVRPTEIFFVPRVCDMVFQRYQSELDRRSVAGADLDTLDREVKADLRQNYLGGRFLVAVVGSAPLAAEMKTFMESVLDLPLHDGYGSTEAGASVLLDNQIQRPPVLDYKLVDVPELGYFRTDRPHPRGELLLKAETTIPGYYKRPEVTAEIFDEDGFYKTGDIVAELEHDRLVYVDRRNNVLKLSQGEFVTVAHLEAVFASSPLIRQIFIYGSSERSYLLAVIVPTDDALRGRDTATLKSALAESIQRIAKDANLQPYEIPRDFLIETEPFTIANGLLSGIAKLLRPNLKERYGAQLEQMYTDLATGQADELLALRREAADLPVLETVSRAAKAMLGVASADMRPDAHFTDLGGDSLSALSFSNLLHEIFGVEVPVGVVVSPANELRDLANYIEAERNSGAKRPTFTSVHGGGSEIRAADLTLDKFIDARTLAAADSIPHAPVPAQTVLLTGANGYLGRFLCLEWLERLDKTGGTLICVVRGSDAAAARKRLDSAFDSGDPGLLEHYQQLAARTLEVLAGDIGDPNLGLDDATWQRLAETVDLIVHPAALVNHVLPYTQLFGPNVVGTAEIVRLAITARRKPVTYLSTVGVADQVDPAEYQEDSDVREMSAVRVVRESYANGYGNSKWAGEVLLREAHDLCGLPVAVFRSDMILAHSRYAGQLNVQDVFTRLILSLVATGIAPYSFYRTDADGNRQRAHYDGLPADFTAAAITALGIQATEGFRTYDVLNPYDDGISLDEFVDWLVESGHPIQRITDYSDWFHRFETAIRALPEKQRQASVLPLLDAYRNPCPAVRGAILPAKEFQAAVQTAKIGPEQDIPHLSAPLIDKYVSDLELLQLL,./data/raw/alphafold//AF-Q6RKB1-F1-model_v4.pdb,3236,2057,3708,2562
+337,894,919,MLPLWTLSLLLGAVAGKEVCYERLGCFSDDSPWSGITERPLHILPWSPKDVNTRFLLYTNENPNNFQEVAADSSSISGSNFKTNRKTRFIIHGFIDKGEENWLANVCKNLFKVESVNCICVDWKGGSRTGYTQASQNIRIVGAEVAYFVEFLQSAFGYSPSNVHVIGHSLGAHAAGEAGRRTNGTIGRITGLDPAEPCFQGTPELVRLDPSDAKFVDVIHTDGAPIVPNLGFGMSQVVGHLDFFPNGGVEMPGCKKNILSQIVDIDGIWEGTRDFAACNHLRSYKYYTDSIVNPDGFAGFPCASYNVFTANKCFPCPSGGCPQMGHYADRYPGKTNDVGQKFYLDTGDASNFARWRYKVSVTLSGKKVTGHILVSLFGNKGNSKQYEIFKGTLKPDSTHSNEFDSDVDVGDLQMVKFIWYNNVINPTLPRVGASKIIVETNVGKQFNFCSPETVREEVLLTLTPC,sabio,P16233,C=CCC(=O)O.O>>*CC(*)O.CC(=O)O,170.0,1.3585253778693184e-14,25.0,7.0,3.1.1.1,9606.0,2.230448921378274,C=CCC(=O)O.O,*CC(*)O.CC(=O)O,2.230448921378274,C=CCC(=O)O.O__MLPLWTLSLLLGAVAGKEVCYERLGCFSDDSPWSGITERPLHILPWSPKDVNTRFLLYTNENPNNFQEVAADSSSISGSNFKTNRKTRFIIHGFIDKGEENWLANVCKNLFKVESVNCICVDWKGGSRTGYTQASQNIRIVGAEVAYFVEFLQSAFGYSPSNVHVIGHSLGAHAAGEAGRRTNGTIGRITGLDPAEPCFQGTPELVRLDPSDAKFVDVIHTDGAPIVPNLGFGMSQVVGHLDFFPNGGVEMPGCKKNILSQIVDIDGIWEGTRDFAACNHLRSYKYYTDSIVNPDGFAGFPCASYNVFTANKCFPCPSGGCPQMGHYADRYPGKTNDVGQKFYLDTGDASNFARWRYKVSVTLSGKKVTGHILVSLFGNKGNSKQYEIFKGTLKPDSTHSNEFDSDVDVGDLQMVKFIWYNNVINPTLPRVGASKIIVETNVGKQFNFCSPETVREEVLLTLTPC,./data/raw/alphafold//AF-P16233-F1-model_v4.pdb,1212,3017,551,629
+338,18592,18862,MAGDSEQTLQNHQQPNGGEPFLIGVSGGTASGKSSVCAKIVQLLGQNEVDYRQKQVVILSQDSFYRVLTSEQKAKALKGQFNFDHPDAFDNELILKTLKEITEGKTVQIPVYDFVSHSRKEETVTVYPADVVLFEGILAFYSQEVRDLFQMKLFVDTDADTRLSRRVLRDISERGRDLEQILSQYITFVKPAFEEFCLPTKKYADVIIPRGADNLVAINLIVQHIQDILNGGPSKRQTNGCLNGYTPSRKRQASESSSRPH,brenda,Q9BZX2,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=c1nc(O)ccn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O,5.2,0.0,25.0,7.2,2.7.1.48,9606.0,0.7160033436347992,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=c1nc(O)ccn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O,0.7160033436347992,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.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,2408,4810,4872,4721
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+352,19626,19912,MSPSKESDELIFFVNGKKVTERNADPEVNLLFYLRKVIRLTGTKYGCGGGDCGACTVMISRYDPISKRISHFSATACLVPICSLHGAAVTTVEGIGSTKTRIHPVQERIAKGHGTQCGFCTPGMVMSIYTLLRNHPEPSTEQIMETLGGNLCRCTGYRPIVESAKSFCPSSTCCQMNGEGKCCLDEEKNEPERKNSVCTKLYEKKEFQPLDPTQELIFPPELMRMAEESQNTVLTFRGERTTWIAPGTLNDLLELKMKHPSAPLVIGNTYLGLHMKFTDVSYPIIISPARILELFVVTNTKQGLTLGAGLSLTQVKNVLSDVVSRLPKEKTQIYCALLKQLKTLAGQQIRNVASLGGHIISRLPTSDLNPILGIGNCILNVASTEGIQQIPLNDHFLAGVPDAILKPEQVLISVFVPRSSKWEFVSAFRQAPRQQNAFATVNAGMKVVFKEDTNTITDLGILYGGIGATVISADKSCRQLIGRCWDEEMLDDAGKMICEEVSLLMAAPGGMEEYRKTLAISFLFMFYLDVLKQLKTRDPHKYPDISQKLLHILEDFPLTMPYGMQSFQDVDFQQPLQDPIGRPIMHQSGIKHATGEAVFCDDMSVLPGELFLAVVTSSKSHAKIISLDASEALASLGVVDVVTARDVPGDNGREEESLYAQDEVICVGQIVCAVAADSYAHAQQAAKKVKIVYQDIEPMIVTVQDALQYESFIGPERKLEQGNVEEAFQCADQILEGEVHLGGQEHFYMETQSVRVVPKGEDKEMDIYVSSQDAAFTQEMVARTLGIPKNRINCHVKRVGGAFGGKASKPGLLASVAAVAAQKTGRPIRFILERRDDMLITGGRHPLLGKYKIGFMNNGKIKAADIQLYINGGCTPDDSELVIEYALLKLENAYKIPNLRVRGRVCKTNLPSNTAFRGFGFPQGAFVTETCMSAVAAKCRLPPEKVRELNMYRTIDRTIHNQEFDPTNLLQCWEACVENSSYYNRKKAVDEFNQQRFWKKRGIAIIPMKFSVGFPKTFYYQAAALVQIYTDGSVLVAHGGVELGQGINTKMIQVASRELKIPMSYIHLDEMSTVTVPNTVTTGASTGADVNGRAVQNACQILMKRLEPIIKQNPSGTWEEWVKEAFVQSISLSATGYFRGYQADMDWEKGEGDIFPYFVFGAACSEVEIDCLTGAHKNIRTDIVMDGSFSINPAVDIGQIEGAFVQGLGLYTLEELKYSPEGVLYTRGPHQYKIASVTDIPEEFHVSLLTPTPNPKAIYSSKGLGEAGTFLGCSVFFAIAAAVAAAREERGLSPIWAINSPATAEVIRMACEDQFTNLVPQTDSKCCKPWSIPVA,brenda,G3X982,O.O=Cc1ccc([N+](=O)[O-])cc1.O=O>>O=C(O)c1ccc([N+](=O)[O-])cc1.OO,1.57,0.0,37.0,8.0,1.2.3.1,10090.0,0.1958996524092337,O.O=Cc1ccc([N+](=O)[O-])cc1.O=O,O=C(O)c1ccc([N+](=O)[O-])cc1.OO,0.1958996524092337,O.O=Cc1ccc([N+](=O)[O-])cc1.O=O__MSPSKESDELIFFVNGKKVTERNADPEVNLLFYLRKVIRLTGTKYGCGGGDCGACTVMISRYDPISKRISHFSATACLVPICSLHGAAVTTVEGIGSTKTRIHPVQERIAKGHGTQCGFCTPGMVMSIYTLLRNHPEPSTEQIMETLGGNLCRCTGYRPIVESAKSFCPSSTCCQMNGEGKCCLDEEKNEPERKNSVCTKLYEKKEFQPLDPTQELIFPPELMRMAEESQNTVLTFRGERTTWIAPGTLNDLLELKMKHPSAPLVIGNTYLGLHMKFTDVSYPIIISPARILELFVVTNTKQGLTLGAGLSLTQVKNVLSDVVSRLPKEKTQIYCALLKQLKTLAGQQIRNVASLGGHIISRLPTSDLNPILGIGNCILNVASTEGIQQIPLNDHFLAGVPDAILKPEQVLISVFVPRSSKWEFVSAFRQAPRQQNAFATVNAGMKVVFKEDTNTITDLGILYGGIGATVISADKSCRQLIGRCWDEEMLDDAGKMICEEVSLLMAAPGGMEEYRKTLAISFLFMFYLDVLKQLKTRDPHKYPDISQKLLHILEDFPLTMPYGMQSFQDVDFQQPLQDPIGRPIMHQSGIKHATGEAVFCDDMSVLPGELFLAVVTSSKSHAKIISLDASEALASLGVVDVVTARDVPGDNGREEESLYAQDEVICVGQIVCAVAADSYAHAQQAAKKVKIVYQDIEPMIVTVQDALQYESFIGPERKLEQGNVEEAFQCADQILEGEVHLGGQEHFYMETQSVRVVPKGEDKEMDIYVSSQDAAFTQEMVARTLGIPKNRINCHVKRVGGAFGGKASKPGLLASVAAVAAQKTGRPIRFILERRDDMLITGGRHPLLGKYKIGFMNNGKIKAADIQLYINGGCTPDDSELVIEYALLKLENAYKIPNLRVRGRVCKTNLPSNTAFRGFGFPQGAFVTETCMSAVAAKCRLPPEKVRELNMYRTIDRTIHNQEFDPTNLLQCWEACVENSSYYNRKKAVDEFNQQRFWKKRGIAIIPMKFSVGFPKTFYYQAAALVQIYTDGSVLVAHGGVELGQGINTKMIQVASRELKIPMSYIHLDEMSTVTVPNTVTTGASTGADVNGRAVQNACQILMKRLEPIIKQNPSGTWEEWVKEAFVQSISLSATGYFRGYQADMDWEKGEGDIFPYFVFGAACSEVEIDCLTGAHKNIRTDIVMDGSFSINPAVDIGQIEGAFVQGLGLYTLEELKYSPEGVLYTRGPHQYKIASVTDIPEEFHVSLLTPTPNPKAIYSSKGLGEAGTFLGCSVFFAIAAAVAAAREERGLSPIWAINSPATAEVIRMACEDQFTNLVPQTDSKCCKPWSIPVA,./data/raw/alphafold//AF-G3X982-F1-model_v4.pdb,1051,609,279,306
+353,16865,17095,MESSGPSSCHSAARRPLHSAQAVDVASASSFRAFEILHLHLDLRAEFGPPGPGPGSRGLNGKATLELRCLLPEGASELRLDSHSCLEVMAATLLRGQPGDQQQLTEPVPFHTQPFSHYGQALCVVFPKPCCAAERFRLELTYRVGEGPGVCWLAPEQTAGKKKPFVYTQGQAVLNRAFFPCFDTPAVKCTYSALVEVPDGFTAVMSASTWERRGPNKFFFQMSQPIPSYLIALAIGDLASAEVGPRSRVWAEPCLIEAAKEEYNGVIEEFLATGEKLFGPYVWGRYDLLFMPPSFPFGGMENPCLTFVTPCLLAGDRSLADVIIHEISHSWFGNLVTNANWGEFWLNEGFTMYAQRRISTILFGAAYTCLEAATGRALLRQHMDVSGEENPLNKLRVKIEPGVDPDDTYNETPYEKGYCFVSYLAHLVGDQEQFDKFLKAYVDEFKFQSILAEDFLEFYLEYFPELKKKGVDSIPGFEFNRWLNTPGWPPYLPDLSPGDSLMKPAEELAELWAASEPDMQAIEAVAISTWKTYQLVYFLDKILQKSPLPPGNVKKLGETYPKISNAQNAELRLRWGQIILKNDHQEEFWKVKDFLQSQGKQKYTLPLYHAMMGGSEMARTLAKETFSATASQLHSNVVNYVQQILAPKGS,uniprot_search,O09175,NCCCC[C@H](N)C(O)=Nc1ccc2ccccc2c1.O>>NCCCC[C@H](N)C(=O)O.Nc1ccc2ccccc2c1,3.0,0.0,27.5,6.8,3.4.11.6,10116.0,0.4771212547196624,NCCCC[C@H](N)C(O)=Nc1ccc2ccccc2c1.O,NCCCC[C@H](N)C(=O)O.Nc1ccc2ccccc2c1,1.3729120029701067,NCCCC[C@H](N)C(O)=Nc1ccc2ccccc2c1.O__MESSGPSSCHSAARRPLHSAQAVDVASASSFRAFEILHLHLDLRAEFGPPGPGPGSRGLNGKATLELRCLLPEGASELRLDSHSCLEVMAATLLRGQPGDQQQLTEPVPFHTQPFSHYGQALCVVFPKPCCAAERFRLELTYRVGEGPGVCWLAPEQTAGKKKPFVYTQGQAVLNRAFFPCFDTPAVKCTYSALVEVPDGFTAVMSASTWERRGPNKFFFQMSQPIPSYLIALAIGDLASAEVGPRSRVWAEPCLIEAAKEEYNGVIEEFLATGEKLFGPYVWGRYDLLFMPPSFPFGGMENPCLTFVTPCLLAGDRSLADVIIHEISHSWFGNLVTNANWGEFWLNEGFTMYAQRRISTILFGAAYTCLEAATGRALLRQHMDVSGEENPLNKLRVKIEPGVDPDDTYNETPYEKGYCFVSYLAHLVGDQEQFDKFLKAYVDEFKFQSILAEDFLEFYLEYFPELKKKGVDSIPGFEFNRWLNTPGWPPYLPDLSPGDSLMKPAEELAELWAASEPDMQAIEAVAISTWKTYQLVYFLDKILQKSPLPPGNVKKLGETYPKISNAQNAELRLRWGQIILKNDHQEEFWKVKDFLQSQGKQKYTLPLYHAMMGGSEMARTLAKETFSATASQLHSNVVNYVQQILAPKGS,./data/raw/alphafold//AF-O09175-F1-model_v4.pdb,1937,4084,1939,3775
+354,20980,21301,MAASITAITVENLEYPAVVTSPVTGKSYFLGGAGERGLTIEGNFIKFTAIGVYLEDIAVASLAAKWKGKSSEELLETLDFYRDIISGPFEKLIRGSKIRELSGPEYSRKVMENCVAHLKSVGTYGDAEAEAMQKFAEAFKPVNFPPGASVFYRQSPDGILGLSFSPDTSIPEKEAALIENKAVSSAVLETMIGEHAVSPDLKRCLAARLPALLNEGAFKIGN,sabio,P28012,O=C(C=Cc1ccc(O)cc1)c1c(O)cc(O)cc1O>>O=C1CC(c2ccc(O)cc2)Oc2cc(O)cc(O)c21,670800.0,1.0420195863850481e-14,25.0,7.5,5.5.1.6,3879.0,5.826593053934048,O=C(C=Cc1ccc(O)cc1)c1c(O)cc(O)cc1O,O=C1CC(c2ccc(O)cc2)Oc2cc(O)cc(O)c21,5.826593053934048,O=C(C=Cc1ccc(O)cc1)c1c(O)cc(O)cc1O__MAASITAITVENLEYPAVVTSPVTGKSYFLGGAGERGLTIEGNFIKFTAIGVYLEDIAVASLAAKWKGKSSEELLETLDFYRDIISGPFEKLIRGSKIRELSGPEYSRKVMENCVAHLKSVGTYGDAEAEAMQKFAEAFKPVNFPPGASVFYRQSPDGILGLSFSPDTSIPEKEAALIENKAVSSAVLETMIGEHAVSPDLKRCLAARLPALLNEGAFKIGN,./data/raw/alphafold//AF-P28012-F1-model_v4.pdb,1991,4147,4012,6433
+355,17914,18163,MATPPKRSCPSFSASSEGTRIKKISIEGNIAAGKSTFVNILKQLCEDWEVVPEPVARWCNVQSTQDEFEELTMSQKNGGNVLQMMYEKPERWSFTFQTYACLSRIRAQLASLNGKLKDAEKPVLFFERSVYSDRYIFASNLYESECMNETEWTIYQDWHDWMNNQFGQSLELDGIIYLQATPETCLHRIYLRGRNEEQGIPLEYLEKLHYKHESWLLHRTLKTNFDYLQEVPILTLDVNEDFKDKYESLVEKVKEFLSTL,brenda,P27707,Nc1nc(Cl)nc2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1.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>>Nc1nc(Cl)nc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)O)O1.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.6,0.0,37.0,7.5,2.7.1.74,9606.0,-0.2218487496163563,Nc1nc(Cl)nc2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1.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,Nc1nc(Cl)nc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)O)O1.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-0.2218487496163563,Nc1nc(Cl)nc2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1.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__MATPPKRSCPSFSASSEGTRIKKISIEGNIAAGKSTFVNILKQLCEDWEVVPEPVARWCNVQSTQDEFEELTMSQKNGGNVLQMMYEKPERWSFTFQTYACLSRIRAQLASLNGKLKDAEKPVLFFERSVYSDRYIFASNLYESECMNETEWTIYQDWHDWMNNQFGQSLELDGIIYLQATPETCLHRIYLRGRNEEQGIPLEYLEKLHYKHESWLLHRTLKTNFDYLQEVPILTLDVNEDFKDKYESLVEKVKEFLSTL,./data/raw/alphafold//AF-P27707-F1-model_v4.pdb,2050,4218,4091,3939
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+370,22292,22626,MITKVTARNNKITPVELLNQKFGNKINLGNFADAVFTDAAFKNVAGIANLPMKAPVMQVLMENCIVSKYLKQFVPDRSVCFVEEGQKFYIVLEDGQKIEVPEDVNKALKATVSDVKHWAGYLTEDGEHVIDLLKPAPGPHFYVNLLIGNRLGFKRTLQTTPKSVVDRFGRGSFRSHAATQVLATRFDMRQEENGFPANRQFYLYEDGKQIFYSALIDDNIVEATCKHSCNRTVIKYKTACNLEITRTIFLVPHKKGFPLATELQRIEIKNASDKARNLSITYTGMFGTGAVHAIFEDVTYTNVIMQSAALYNDKGEFIGITPDYYPEEFKQDTRFVTMIVRNGDEKSFPQSFCTDYNDFVGTGTLEHPAGGCNLNNKLNRKGPGFFALGAPFTVEPGKTVIIDTFTGLSSSKDNENYSDAVMLRELDNLLRYFEKSESVEETLNEIINFHENYGKYFQFNTGNKLFDSGFNRNLAFQVLYQTFMSRSFGQTQKGYREIGFREIQDLFASMYYFINIGYQDFVKELLFEWTANVYKMGYANHNFYWVGKQPGLYSDDSLWLLQAYYRYIIYTKDTSVLNEEVPVADGNNEKRAVRETLKAIIQYSACISVGDHGLPLLDLADWNDCLKIASNSIDGATKEKLYYEQLKKTNGKYGDRFMSDYSESVMNAFLLKLAIDHLAEIATLDNDTQLAQQMSELSKEVTDRIQKHAWKENFFARVLINRYKDGSYTYLGAKGDKLSADPNIDGVYFLNSFAWSVLSDVATDEQIAIMVDVIKKHLLTPYGLRLVTPADLNKIANDTATGHYFFGDRENGAVFKHASMMAVAALIKAAKKVKDNELAKEMARIAYFMIDLVLPYKNLENPFQVAGNPRICTQYINTDTGENIGPLLSGTATWLNLNLISLAGIEYTRDGISFNPILREEETQLNFTLKAPKCSYKFSITKPVGFARMESSEYELFVDGQKIDNTVIPMYTDEKEHIVTLKFK,brenda,Q93HT8,O=P(O)(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>>O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,17.0,0.0,21.0,7.5,2.4.1.49,1515.0,1.230448921378274,O=P(O)(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,O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,1.230448921378274,O=P(O)(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__MITKVTARNNKITPVELLNQKFGNKINLGNFADAVFTDAAFKNVAGIANLPMKAPVMQVLMENCIVSKYLKQFVPDRSVCFVEEGQKFYIVLEDGQKIEVPEDVNKALKATVSDVKHWAGYLTEDGEHVIDLLKPAPGPHFYVNLLIGNRLGFKRTLQTTPKSVVDRFGRGSFRSHAATQVLATRFDMRQEENGFPANRQFYLYEDGKQIFYSALIDDNIVEATCKHSCNRTVIKYKTACNLEITRTIFLVPHKKGFPLATELQRIEIKNASDKARNLSITYTGMFGTGAVHAIFEDVTYTNVIMQSAALYNDKGEFIGITPDYYPEEFKQDTRFVTMIVRNGDEKSFPQSFCTDYNDFVGTGTLEHPAGGCNLNNKLNRKGPGFFALGAPFTVEPGKTVIIDTFTGLSSSKDNENYSDAVMLRELDNLLRYFEKSESVEETLNEIINFHENYGKYFQFNTGNKLFDSGFNRNLAFQVLYQTFMSRSFGQTQKGYREIGFREIQDLFASMYYFINIGYQDFVKELLFEWTANVYKMGYANHNFYWVGKQPGLYSDDSLWLLQAYYRYIIYTKDTSVLNEEVPVADGNNEKRAVRETLKAIIQYSACISVGDHGLPLLDLADWNDCLKIASNSIDGATKEKLYYEQLKKTNGKYGDRFMSDYSESVMNAFLLKLAIDHLAEIATLDNDTQLAQQMSELSKEVTDRIQKHAWKENFFARVLINRYKDGSYTYLGAKGDKLSADPNIDGVYFLNSFAWSVLSDVATDEQIAIMVDVIKKHLLTPYGLRLVTPADLNKIANDTATGHYFFGDRENGAVFKHASMMAVAALIKAAKKVKDNELAKEMARIAYFMIDLVLPYKNLENPFQVAGNPRICTQYINTDTGENIGPLLSGTATWLNLNLISLAGIEYTRDGISFNPILREEETQLNFTLKAPKCSYKFSITKPVGFARMESSEYELFVDGQKIDNTVIPMYTDEKEHIVTLKFK,./data/raw/alphafold//AF-Q93HT8-F1-model_v4.pdb,769,195,5935,6852
+371,12706,12877,MTNIRVAIVGYGNLGRSVEKLIAKQPDMDLVGIFSRRATLDTKTPVFDVADVDKHADDVDVLFLCMGSATDIPEQAPKFAQFACTVDTYDNHRDIPRHRQVMNEAATAAGNVALVSTGWDPGMFSINRVYAAAVLAEHQQHTFWGPGLSQGHSDALRRIPGVQKAVQYTLPSEDALEKARRGEAGDLTGKQTHKRQCFVVADAADHERIENDIRTMPDYFVGYEVEVNFIDEATFDSEHTGMPHGGHVITTGDTGGFNHTVEYILKLDRNPDFTASSQIAFGRAAHRMKQQGQSGAFTVLEVAPYLLSPENLDDLIARDV,brenda,P04964,N.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)CC(=O)C(=O)O.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.N[C@H](CC(=O)O)C(=O)O,0.087,1.015470208082618,30.0,8.45,1.4.1.16,1718.0,-1.0604807473813815,N.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)CC(=O)C(=O)O.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.N[C@H](CC(=O)O)C(=O)O,-1.0604807473813815,N.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)CC(=O)C(=O)O.[H+]__MTNIRVAIVGYGNLGRSVEKLIAKQPDMDLVGIFSRRATLDTKTPVFDVADVDKHADDVDVLFLCMGSATDIPEQAPKFAQFACTVDTYDNHRDIPRHRQVMNEAATAAGNVALVSTGWDPGMFSINRVYAAAVLAEHQQHTFWGPGLSQGHSDALRRIPGVQKAVQYTLPSEDALEKARRGEAGDLTGKQTHKRQCFVVADAADHERIENDIRTMPDYFVGYEVEVNFIDEATFDSEHTGMPHGGHVITTGDTGGFNHTVEYILKLDRNPDFTASSQIAFGRAAHRMKQQGQSGAFTVLEVAPYLLSPENLDDLIARDV,./data/raw/alphafold//AF-P04964-F1-model_v4.pdb,1273,5226,1614,741
+372,16025,16252,MADGWDAEKIFNTTVFGFTYDDLILMPGHIDFGVNDVDLSTRITRNLHVRTPIVSSPMDTVTEHRMAIGCALMGGMGVIHNNMETARQVAEVQKVKRYENGFILDPFVLRPSDSVADVYRIKEKYGYSSVPITDTGMLGGKLLGIVTSRDIDFLTDVHTPLSEVMTSDLVVGHEPVQLAEANELLRESKKGKLPIVNDNFELVALISRNDLKKNREFPLASKDSNKQLLVGAAVSTKPHDIERAKALQEAGADVLVVDSSQGDSIYQVDLVKRLKAAFPELQIIGGNVVTARQAKSLIDAGVDGLRIGMGSGSICTTQVVCAVGRAQATAVYHVCKYAREHGDVPCIADGGIQNSGHVMKALALGANAVMMGSMLAGTEEAPGEYYFHNGVRVKTYRGMGSLDAMRAGTRRTASPPARGLRSPEASPSTAASSGGASRASALSEASPSAKSEASRTSTSTGSAARYFAENQTIRVAQGVSGCVVDKGTVMQLIPYVIQGVKHGMQDIGARTLRDLHAQLVGGELRFDVRSGAAQREGDVHDLHSFERKLYA,sabio,Q4VRV8,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.O.O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O>>NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=c1[nH]c(=O)c2ncn(C3OC(COP(=O)(O)O)C(O)C3O)c2[nH]1.[H],0.98,0.0,37.0,8.0,1.1.1.205,5811.0,-0.0087739243075051,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.O.O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=c1[nH]c(=O)c2ncn(C3OC(COP(=O)(O)O)C(O)C3O)c2[nH]1.[H],-0.0087739243075051,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.O.O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O__MADGWDAEKIFNTTVFGFTYDDLILMPGHIDFGVNDVDLSTRITRNLHVRTPIVSSPMDTVTEHRMAIGCALMGGMGVIHNNMETARQVAEVQKVKRYENGFILDPFVLRPSDSVADVYRIKEKYGYSSVPITDTGMLGGKLLGIVTSRDIDFLTDVHTPLSEVMTSDLVVGHEPVQLAEANELLRESKKGKLPIVNDNFELVALISRNDLKKNREFPLASKDSNKQLLVGAAVSTKPHDIERAKALQEAGADVLVVDSSQGDSIYQVDLVKRLKAAFPELQIIGGNVVTARQAKSLIDAGVDGLRIGMGSGSICTTQVVCAVGRAQATAVYHVCKYAREHGDVPCIADGGIQNSGHVMKALALGANAVMMGSMLAGTEEAPGEYYFHNGVRVKTYRGMGSLDAMRAGTRRTASPPARGLRSPEASPSTAASSGGASRASALSEASPSAKSEASRTSTSTGSAARYFAENQTIRVAQGVSGCVVDKGTVMQLIPYVIQGVKHGMQDIGARTLRDLHAQLVGGELRFDVRSGAAQREGDVHDLHSFERKLYA,./data/raw/alphafold//AF-Q4VRV8-F1-model_v4.pdb,2335,4688,4724,4559
+373,17122,17352,MNPIVVVHGGGAGPISKDRKERVHQGMVRAATVGYGILREGGSAVDAVEGAVVALEDDPEFNAGCGSVLNTNGEVEMDASIMDGKDLSAGAVSAVQCIANPIKLARLVMEKTPHCFLTDQGAAQFAAAMGVPEIPGEKLVTERNKKRLEKEKHEKGAQKTDCQKNLGTVGAVALDCKGNVAYATSTGGIVNKMVGRVGDSPCLGAGGYADNDIGAVSTTGHGESILKVNLARLTLFHIEQGKTVEEAADLSLGYMKSRVKGLGGLIVVSKTGDWVAKWTSTSMPWAAAKDGKLHFGIDPDDTTITDLP,brenda,Q7L266,N[C@@H](CC(O)=N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O.O>>,0.8,99.66588148816383,37.0,7.5,3.5.1.1,9606.0,-0.0969100130080563,N[C@@H](CC(O)=N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O.O,,-0.0969100130080563,N[C@@H](CC(O)=N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O.O__MNPIVVVHGGGAGPISKDRKERVHQGMVRAATVGYGILREGGSAVDAVEGAVVALEDDPEFNAGCGSVLNTNGEVEMDASIMDGKDLSAGAVSAVQCIANPIKLARLVMEKTPHCFLTDQGAAQFAAAMGVPEIPGEKLVTERNKKRLEKEKHEKGAQKTDCQKNLGTVGAVALDCKGNVAYATSTGGIVNKMVGRVGDSPCLGAGGYADNDIGAVSTTGHGESILKVNLARLTLFHIEQGKTVEEAADLSLGYMKSRVKGLGGLIVVSKTGDWVAKWTSTSMPWAAAKDGKLHFGIDPDDTTITDLP,./data/raw/alphafold//AF-Q7L266-F1-model_v4.pdb,2288,4626,4652,4480
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+384,13324,13499,MDLLLIIAGLVAAAAFFFLRSTTKKSLRLPPGPKGLPIIGNLHQMEKFNPQHFLFRLSKLYGPIFTMKIGGRRLAVISSAELAKELLKTQDLNFTARPLLKGQQTMSYQGRELGFGQYTAYYREMRKMCMVNLFSPNRVASFRPVREEECQRMMDKIYKAADQSGTVDLSELLLSFTNCVVCRQAFGKRYNEYGTEMKRFIDILYETQALLGTLFFSDLFPYFGFLDNLTGLSARLKKAFKELDTYLQELLDETLDPNRPKQETESFIDLLMQIYKDQPFSIKFTHENVKAMILDIVVPGTDTAAAVVVWAMTYLIKYPEAMKKAQDEVRSVIGDKGYVSEEDIPNLPYLKAVIKESLRLEPVIPILLHRETIADAKIGGYDIPAKTIIQVNAWAVSRDTAAWGDNPNEFIPERFMNEHKGVDFKGQDFELLPFGSGRRMCPAMHLGIAMVEIPFANLLYKFDWSLPKGIKPEDIKMDVMTGLAMHKKEHLVLAPTKHI,brenda,O65782,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/N=C/Cc1ccc(O)cc1.OCCS.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O.OCCS/C(=N\O)c1ccc(O)cc1,0.16,0.0022536088472577,29.0,8.1,1.14.14.45,3702.0,-0.7958800173440752,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/N=C/Cc1ccc(O)cc1.OCCS.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O.OCCS/C(=N\O)c1ccc(O)cc1,-0.5686362358410126,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/N=C/Cc1ccc(O)cc1.OCCS.[H+]__MDLLLIIAGLVAAAAFFFLRSTTKKSLRLPPGPKGLPIIGNLHQMEKFNPQHFLFRLSKLYGPIFTMKIGGRRLAVISSAELAKELLKTQDLNFTARPLLKGQQTMSYQGRELGFGQYTAYYREMRKMCMVNLFSPNRVASFRPVREEECQRMMDKIYKAADQSGTVDLSELLLSFTNCVVCRQAFGKRYNEYGTEMKRFIDILYETQALLGTLFFSDLFPYFGFLDNLTGLSARLKKAFKELDTYLQELLDETLDPNRPKQETESFIDLLMQIYKDQPFSIKFTHENVKAMILDIVVPGTDTAAAVVVWAMTYLIKYPEAMKKAQDEVRSVIGDKGYVSEEDIPNLPYLKAVIKESLRLEPVIPILLHRETIADAKIGGYDIPAKTIIQVNAWAVSRDTAAWGDNPNEFIPERFMNEHKGVDFKGQDFELLPFGSGRRMCPAMHLGIAMVEIPFANLLYKFDWSLPKGIKPEDIKMDVMTGLAMHKKEHLVLAPTKHI,./data/raw/alphafold//AF-O65782-F1-model_v4.pdb,2555,4554,4479,4376
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+389,2386,2420,MSFRLQPAPPARPNRCQLFGPGSRPALFEKMAASAADVINLDLEDSVAPDDKAQARANIIEAINGLDWGRKYLSVRINGLDTPFWYRDVVDLLEQAGDRLDQIMIPKVGCAADVYAVDALVTAIERAKGRTKPLSFEVIIESAAGIAHVEEIAASSPRLQAMSLGAADFAASMGMQTTGIGGTQENYYMLHDGQKHWSDPWHWAQAAIVAACRTHGILPVDGPFGDFSDDEGFRAQARRSATLGMVGKWAIHPKQVALANEVFTPSETAVTEAREILAAMDAAKARGEGATVYKGRLVDIASIKQAEVIVRQAEMISA,sabio,Q3J5L6,CC(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)C(O)C(=O)O>>CCC(=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(=O)O,2.8,0.112106127133697,30.0,7.5,4.1.3.24,1063.0,0.4471580313422192,CC(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)C(O)C(=O)O,CCC(=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(=O)O,0.4471580313422192,CC(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)C(O)C(=O)O__MSFRLQPAPPARPNRCQLFGPGSRPALFEKMAASAADVINLDLEDSVAPDDKAQARANIIEAINGLDWGRKYLSVRINGLDTPFWYRDVVDLLEQAGDRLDQIMIPKVGCAADVYAVDALVTAIERAKGRTKPLSFEVIIESAAGIAHVEEIAASSPRLQAMSLGAADFAASMGMQTTGIGGTQENYYMLHDGQKHWSDPWHWAQAAIVAACRTHGILPVDGPFGDFSDDEGFRAQARRSATLGMVGKWAIHPKQVALANEVFTPSETAVTEAREILAAMDAAKARGEGATVYKGRLVDIASIKQAEVIVRQAEMISA,./data/raw/alphafold//AF-Q3J5L6-F1-model_v4.pdb,1548,1111,945,1285
+390,18071,18325,MRKITQAISAVCLLFALNSSAVALASSPSPLNPGTNVARLAEQAPIHWVSVAQIENSLAGRPPMAVGFDIDDTVLFSSPGFWRGKKTFSPESEDYLKNPVFWEKMNNGWDEFSIPKEVARQLIDMHVRRGDAIFFVTGRSPTKTETVSKTLADNFHIPATNMNPVIFAGDKPGQNTKSQWLQDKNIRIFYGDSDNDITAARDVGARGIRILRASNSTYKPLPQAGAFGEEVIVNSEY,sabio,P0AE22,Nc1ncnc2c1ncn2C1OC(CO)C(OP(=O)(O)O)C1O.O>>Nc1ncnc2c1ncn2C1OC(CO)C(O)C1O.O=P(O)(O)O,33.0,7.771036020332536e-15,37.0,6.0,3.1.3.2,562.0,1.5185139398778875,Nc1ncnc2c1ncn2C1OC(CO)C(OP(=O)(O)O)C1O.O,Nc1ncnc2c1ncn2C1OC(CO)C(O)C1O.O=P(O)(O)O,1.5185139398778875,Nc1ncnc2c1ncn2C1OC(CO)C(OP(=O)(O)O)C1O.O__MRKITQAISAVCLLFALNSSAVALASSPSPLNPGTNVARLAEQAPIHWVSVAQIENSLAGRPPMAVGFDIDDTVLFSSPGFWRGKKTFSPESEDYLKNPVFWEKMNNGWDEFSIPKEVARQLIDMHVRRGDAIFFVTGRSPTKTETVSKTLADNFHIPATNMNPVIFAGDKPGQNTKSQWLQDKNIRIFYGDSDNDITAARDVGARGIRILRASNSTYKPLPQAGAFGEEVIVNSEY,./data/raw/alphafold//AF-P0AE22-F1-model_v4.pdb,392,2964,5306,4775
+391,14879,15088,MKNIRNFSIIAHIDHGKSTLSDRIIQICGGLSDREMEAQVLDSMDLERERGITIKAQSVTLDYKASDGETYQLNFIDTPGHVDFSYEVSRSLAACEGALLVVDAGQGVEAQTLANCYTAMEMDLEVVPVLNKIDLPAADPERVAEEIEDIVGIDATDAVRCSAKTGVGVQDVLERLVRDIPPPEGDPEGPLQALIIDSWFDNYLGVVSLIRIKNGTLRKGDKVKVMSTGQTYNADRLGIFTPKQVDRTELKCGEVGWLVCAIKDIHGAPVGDTLTLARNPAEKALPGFKKVKPQVYAGLFPVSSDDYEAFRDALGKLSLNDASLFYEPESSSALGFGFRCGFLGLLHMEIIQERLEREYDLDLITTAPTVVYEVETTSREVIYVDSPSKLPAVNNIYELREPIAECHMLLPQAYLGNVITLCVEKRGVQTNMVYHGNQVALTYEIPMAEVVLDFFDRLKSTSRGYASLDYNFKRFQASDMVRVDVLINGERVDALALITHRDNSQNRGRELVEKMKDLIPRQQFDIAIQAAIGTHIIARSTVKQLRKNVLAKCYGGDISRKKKLLQKQKEGKKRMKQIGNVELPQEAFLAILHVGKDNK,brenda,P60785,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>>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,0.003,1.0493601366967451e-14,50.0,7.8,3.6.5.3,2287.0,-2.5228787452803374,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,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,0.3617278360175928,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__MKNIRNFSIIAHIDHGKSTLSDRIIQICGGLSDREMEAQVLDSMDLERERGITIKAQSVTLDYKASDGETYQLNFIDTPGHVDFSYEVSRSLAACEGALLVVDAGQGVEAQTLANCYTAMEMDLEVVPVLNKIDLPAADPERVAEEIEDIVGIDATDAVRCSAKTGVGVQDVLERLVRDIPPPEGDPEGPLQALIIDSWFDNYLGVVSLIRIKNGTLRKGDKVKVMSTGQTYNADRLGIFTPKQVDRTELKCGEVGWLVCAIKDIHGAPVGDTLTLARNPAEKALPGFKKVKPQVYAGLFPVSSDDYEAFRDALGKLSLNDASLFYEPESSSALGFGFRCGFLGLLHMEIIQERLEREYDLDLITTAPTVVYEVETTSREVIYVDSPSKLPAVNNIYELREPIAECHMLLPQAYLGNVITLCVEKRGVQTNMVYHGNQVALTYEIPMAEVVLDFFDRLKSTSRGYASLDYNFKRFQASDMVRVDVLINGERVDALALITHRDNSQNRGRELVEKMKDLIPRQQFDIAIQAAIGTHIIARSTVKQLRKNVLAKCYGGDISRKKKLLQKQKEGKKRMKQIGNVELPQEAFLAILHVGKDNK,./data/raw/alphafold//AF-P60785-F1-model_v4.pdb,2509,4942,2016,4870
+392,6305,6414,MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,uniprot_search,P24155,CCC(C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@@H](CCCNC(=N)N)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)N=C(O)[C@H](CC(N)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H](N)CCC(=O)O)C(O)=N[C@@H](CC(C)C)C(=O)O>>CC(C)C[C@H](N=C(O)[C@@H](N)CCC(=O)O)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CC(N)O)C(O)=N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(O)=N[C@@H](CC(C)C)C(=O)O,7.9,0.5290775313709245,37.0,8.2,3.4.24.15,10116.0,0.8976270912904415,CCC(C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@@H](CCCNC(=N)N)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)N=C(O)[C@H](CC(N)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H](N)CCC(=O)O)C(O)=N[C@@H](CC(C)C)C(=O)O,CC(C)C[C@H](N=C(O)[C@@H](N)CCC(=O)O)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CC(N)O)C(O)=N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(O)=N[C@@H](CC(C)C)C(=O)O,0.8976270912904415,CCC(C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@@H](CCCNC(=N)N)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)N=C(O)[C@H](CC(N)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H](N)CCC(=O)O)C(O)=N[C@@H](CC(C)C)C(=O)O__MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,./data/raw/alphafold//AF-P24155-F1-model_v4.pdb,1820,1500,3134,1830
+393,7224,7346,MSEKYVAVEGRRVRYLVGGSGRPVVLLHGWSFNADTWVESGVFNSLAGHFAVYAIDMPYGIRTKSERFQAPRREYAVFLRRVLDALDLADPPLVGPSASGEVVLWYVAKRLPTRAAVVVGPVGLAGELLEELRGAGVPILAVWGEGDEVSPPSRASLLRDVAKVVILRDAGHAAYLDKPGEFVEVVLDFLRGVY,brenda,G7VG08,CCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCCCCCCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,6.19,0.0,80.0,8.0,3.1.1.1,2004705.0,0.791690649020118,CCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCCCCCCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,0.791690649020118,CCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MSEKYVAVEGRRVRYLVGGSGRPVVLLHGWSFNADTWVESGVFNSLAGHFAVYAIDMPYGIRTKSERFQAPRREYAVFLRRVLDALDLADPPLVGPSASGEVVLWYVAKRLPTRAAVVVGPVGLAGELLEELRGAGVPILAVWGEGDEVSPPSRASLLRDVAKVVILRDAGHAAYLDKPGEFVEVVLDFLRGVY,./data/raw/alphafold//AF-G7VG08-F1-model_v4.pdb,1496,1045,870,1201
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+404,3664,3714,MKYEKLLPRFLEYVKVNTRSDENSTTTPSTQALVEFAHKMGEDMKALGLKDVHYLESNGYVIGTIPANTDKKVRKIGLLAHLDTADFNAEGVNPQILENYDGESVIKLGDTEFTLDPKDFPNLKNYKGQTLVHTDGTTLLGSDDKSGVAEIMTLADYLLNINPDFEHGEIRVGFGPDEEIGVGADKFDVADFDVDFAYTVDGGPLGELQYETFSAAGAVIEFQGKNVHPGTAKNTMVNALQLAIDYHNALPEFDRPEKTEGREGFFHLLKLDGTPEEARAQYIIRDHEEGKFNERKALMQEIADKMNAELGQNRVKPVIKDQYYNMAQIIEKDMSIIDIAKKAMENLDIVPIIEPIRGGTDGSKISFMGLPTPNLFAGGENMHGRFEFVSVQTMEKAVDTLLEIIRLNNEVVK,sabio,Q76HM5,CC(C)CC(N)C(O)=NCC(O)=NCC(=O)O.O>>CC(C)CC(N)C(=O)O.NCC(O)=NCC(=O)O,197.0,0.0,37.0,7.5,3.4.11.-,44688.0,2.294466226161593,CC(C)CC(N)C(O)=NCC(O)=NCC(=O)O.O,CC(C)CC(N)C(=O)O.NCC(O)=NCC(=O)O,2.294466226161593,CC(C)CC(N)C(O)=NCC(O)=NCC(=O)O.O__MKYEKLLPRFLEYVKVNTRSDENSTTTPSTQALVEFAHKMGEDMKALGLKDVHYLESNGYVIGTIPANTDKKVRKIGLLAHLDTADFNAEGVNPQILENYDGESVIKLGDTEFTLDPKDFPNLKNYKGQTLVHTDGTTLLGSDDKSGVAEIMTLADYLLNINPDFEHGEIRVGFGPDEEIGVGADKFDVADFDVDFAYTVDGGPLGELQYETFSAAGAVIEFQGKNVHPGTAKNTMVNALQLAIDYHNALPEFDRPEKTEGREGFFHLLKLDGTPEEARAQYIIRDHEEGKFNERKALMQEIADKMNAELGQNRVKPVIKDQYYNMAQIIEKDMSIIDIAKKAMENLDIVPIIEPIRGGTDGSKISFMGLPTPNLFAGGENMHGRFEFVSVQTMEKAVDTLLEIIRLNNEVVK,./data/raw/alphafold//AF-Q76HM5-F1-model_v4.pdb,1818,1497,3069,2077
+405,1260,1287,MDPKHQRAALNDGHSIPVLGLGTYAPDAVPKSEAGEATKIAIDVGYRHIDSSHAYQNEEEVGLAIRSKITDGTVKREDIFYTSKLWCTFFRPELVRTGLEQSLKKLQLDYVDLYLMHYPAAMKPGKELYPKDEQGKIMHDTVDICATWEAMEKCKDAGLAKSIGVSNFNHRQLEMILSKPGLKYKPVCNQVECHLYLNQSKLLDFCKSKDIVLVAYGALGSSRDPKWVDQSYPVLLEDPVICALAKKHKRSPALIALRYQLQRGVVVLAKSFIEKEIKENIQVFEFQLSSEDMKALDGLNKNLRYYPADL,brenda,G1T465,CC(=O)C(=O)c1ccccc1.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)c1,0.45,10.146731231922097,25.0,7.4,1.1.1.239,9986.0,-0.3467874862246563,CC(=O)C(=O)c1ccccc1.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,-0.3467874862246563,CC(=O)C(=O)c1ccccc1.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+]__MDPKHQRAALNDGHSIPVLGLGTYAPDAVPKSEAGEATKIAIDVGYRHIDSSHAYQNEEEVGLAIRSKITDGTVKREDIFYTSKLWCTFFRPELVRTGLEQSLKKLQLDYVDLYLMHYPAAMKPGKELYPKDEQGKIMHDTVDICATWEAMEKCKDAGLAKSIGVSNFNHRQLEMILSKPGLKYKPVCNQVECHLYLNQSKLLDFCKSKDIVLVAYGALGSSRDPKWVDQSYPVLLEDPVICALAKKHKRSPALIALRYQLQRGVVVLAKSFIEKEIKENIQVFEFQLSSEDMKALDGLNKNLRYYPADL,./data/raw/alphafold//AF-G1T465-F1-model_v4.pdb,1329,1150,6188,841
+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
+409,1456,1484,MTSVGIDAMEIWTGKLVLDLPNTFAPVKGEDPEKYTKGLGLHTSSFPDVYEDIVTMGANAAKKLMDRKGLTPADIGRIDVATESAFDNSKPVSTYIAGCLEQVYDGDFRHANKGERKFACIAGTQSLDDAYNWIKAGRNRGRAALVIATDTALYERGDPGEATQGAGAVAMLIDEDPDLVELSTEQGYGSMDETDFLKPNQQFPSVDGKRSMQVYLARMREALEDYESVAGRTHPDLFEYIPFHTPFPGMVRKAALLGFRHMTRDTDIEDDLESEIGRQPREEDFETWDDYEEAIRGYMDELKTTEQYRDWYGRVIEPTLDISSRVGNWYTGSVHIARLSALKAAADEGKDMTGKQLLVGSYGSGAQAEIHAERVQETWLDEIEAVDVDDQLAARTEISFDDYELIHDVHNHEKEIEVEEFTQPEAEFVFTGWGRMNERRYEYVE,brenda,D4GWR6,CC(=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.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.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)(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)(O)CC(=O)O,4.6,0.0,30.0,8.0,2.3.3.10,2246.0,0.6627578316815741,CC(=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.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.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)(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)(O)CC(=O)O,0.6627578316815741,CC(=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.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.O__MTSVGIDAMEIWTGKLVLDLPNTFAPVKGEDPEKYTKGLGLHTSSFPDVYEDIVTMGANAAKKLMDRKGLTPADIGRIDVATESAFDNSKPVSTYIAGCLEQVYDGDFRHANKGERKFACIAGTQSLDDAYNWIKAGRNRGRAALVIATDTALYERGDPGEATQGAGAVAMLIDEDPDLVELSTEQGYGSMDETDFLKPNQQFPSVDGKRSMQVYLARMREALEDYESVAGRTHPDLFEYIPFHTPFPGMVRKAALLGFRHMTRDTDIEDDLESEIGRQPREEDFETWDDYEEAIRGYMDELKTTEQYRDWYGRVIEPTLDISSRVGNWYTGSVHIARLSALKAAADEGKDMTGKQLLVGSYGSGAQAEIHAERVQETWLDEIEAVDVDDQLAARTEISFDDYELIHDVHNHEKEIEVEEFTQPEAEFVFTGWGRMNERRYEYVE,./data/raw/alphafold//AF-D4GWR6-F1-model_v4.pdb,1352,843,638,926
+410,21519,21844,MKQKITDYLDEIYGGTFTATHLQKLVTRLESAKRLITQRRKKHWDESDVVLITYADQFHSNDLKPLPTFNQFYHQWLQSIFSHVHLLPFYPWSSDDGFSVIDYHQVASEAGEWQDIQQLGECSHLMFDFVCNHMSAKSEWFKNYLQQHPGFEDFFIAVDPQTDLSAVTRPRALPLLTPFQMRDHSTRHLWTTFSDDQIDLNYRSPEVLLAMVDVLLCYLAKGAEYVRLDAVGFMWKEPGTSCIHLEKTHLIIKLLRSIIDNVAPGTVIITETNVPHKDNIAYFGAGDDEAHMVYQFSLPPLVLHAVQKQNVEALCAWAQNLTLPSSNTTWFNFLASHDGIGLNPLRGLLPESEILELVEALQQEGALVNWKNNPDGTRSPYEINVTYMDALSRRESSDEERCARFILAHAILLSFPGVPAIYIQSILGSRNDYAGVEKLGYNRAINRKKYHSKEITRELNDEATLRHAVYHELSRLITLRRSHNEFHPDNNFTIDTINSSVMRIPRSNADGNCLTGLFNVSKNIQHVNITNLHGRDLISEVDILGNEITLRPWQVMWIK,sabio,P76041,O=C(O)[C@H](O)[C@H](O)CO.O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O>>O=P(O)(O)O,68.0,60.223087361075216,30.0,,2.4.1.352,562.0,1.8325089127062364,O=C(O)[C@H](O)[C@H](O)CO.O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,O=P(O)(O)O,1.8325089127062364,O=C(O)[C@H](O)[C@H](O)CO.O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O__MKQKITDYLDEIYGGTFTATHLQKLVTRLESAKRLITQRRKKHWDESDVVLITYADQFHSNDLKPLPTFNQFYHQWLQSIFSHVHLLPFYPWSSDDGFSVIDYHQVASEAGEWQDIQQLGECSHLMFDFVCNHMSAKSEWFKNYLQQHPGFEDFFIAVDPQTDLSAVTRPRALPLLTPFQMRDHSTRHLWTTFSDDQIDLNYRSPEVLLAMVDVLLCYLAKGAEYVRLDAVGFMWKEPGTSCIHLEKTHLIIKLLRSIIDNVAPGTVIITETNVPHKDNIAYFGAGDDEAHMVYQFSLPPLVLHAVQKQNVEALCAWAQNLTLPSSNTTWFNFLASHDGIGLNPLRGLLPESEILELVEALQQEGALVNWKNNPDGTRSPYEINVTYMDALSRRESSDEERCARFILAHAILLSFPGVPAIYIQSILGSRNDYAGVEKLGYNRAINRKKYHSKEITRELNDEATLRHAVYHELSRLITLRRSHNEFHPDNNFTIDTINSSVMRIPRSNADGNCLTGLFNVSKNIQHVNITNLHGRDLISEVDILGNEITLRPWQVMWIK,./data/raw/alphafold//AF-P76041-F1-model_v4.pdb,658,2934,5270,6142
+411,9376,9518,MGSVEGERTTVGWAARDPSGTLSPYTFNLRNTGPDDVYIKVHYCGICHSDLHQIKNDLGMSNYPMVPGHEVVGEVIEVGSNVTKFKVGEVVGAGLIVGSCRNCRACKSDIEQYCAKKIWNCNDVYTDGKPTQGGFAETMVVNQNFVVKIPEGMSPEQVAPLLCAGVTVYSPLSHFGLKESGLRGGILGLGGVGHMGVKIAKAMGHNVTVISSSEKKKQEALEHLGADDYVVSSDETQMQKIADSLDYIIDTVPVGHPLEPYLSLLKVDGKLILMGVINTPLQFVSPMVMLGRKTITGSFIGSIKETEEMLGFWKEKGLSSMIEVVKMDYINKAFERLEKNDVRYRFVVDVAGSKLDQ,brenda,B5AR58,COc1cc(/C=C/C=O)cc(OC)c1O.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+]>>COc1cc(/C=C/CO)cc(OC)c1O.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)c1,32.2,0.0,40.0,6.5,1.1.1.195,3866.0,1.507855871695831,COc1cc(/C=C/C=O)cc(OC)c1O.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+],COc1cc(/C=C/CO)cc(OC)c1O.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)c1,1.507855871695831,COc1cc(/C=C/C=O)cc(OC)c1O.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+]__MGSVEGERTTVGWAARDPSGTLSPYTFNLRNTGPDDVYIKVHYCGICHSDLHQIKNDLGMSNYPMVPGHEVVGEVIEVGSNVTKFKVGEVVGAGLIVGSCRNCRACKSDIEQYCAKKIWNCNDVYTDGKPTQGGFAETMVVNQNFVVKIPEGMSPEQVAPLLCAGVTVYSPLSHFGLKESGLRGGILGLGGVGHMGVKIAKAMGHNVTVISSSEKKKQEALEHLGADDYVVSSDETQMQKIADSLDYIIDTVPVGHPLEPYLSLLKVDGKLILMGVINTPLQFVSPMVMLGRKTITGSFIGSIKETEEMLGFWKEKGLSSMIEVVKMDYINKAFERLEKNDVRYRFVVDVAGSKLDQ,./data/raw/alphafold//AF-B5AR58-F1-model_v4.pdb,3542,3485,2480,3185
+412,4728,4786,APPIQSRIIGGRECEKNSHPWQVAIYHYSSFQCGGVLVNPKWVLTAAHCKNDNYEVWLGRHNLFENENTAQFFGVTADFPHPGFNLSLLKXHTKADGKDYSHDLMLLRLQSPAKITDAVKVLELPTQEPELGSTCEASGWGSIEPGPDBFEFPDEIQCVQLTLLQNTFCABAHPBKVTESMLCAGYLPGGKDTCMGDSGGPLICNGMWQGITSWGHTPCGSANKPSIYTKLIFYLDWINDTITENP,uniprot_search,P00752,CC(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>CC(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,1.71,9.91818839251051e-15,25.0,8.0,3.4.21.35,9823.0,0.2329961103921538,CC(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,CC(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,0.2329961103921538,CC(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__APPIQSRIIGGRECEKNSHPWQVAIYHYSSFQCGGVLVNPKWVLTAAHCKNDNYEVWLGRHNLFENENTAQFFGVTADFPHPGFNLSLLKXHTKADGKDYSHDLMLLRLQSPAKITDAVKVLELPTQEPELGSTCEASGWGSIEPGPDBFEFPDEIQCVQLTLLQNTFCABAHPBKVTESMLCAGYLPGGKDTCMGDSGGPLICNGMWQGITSWGHTPCGSANKPSIYTKLIFYLDWINDTITENP,./data/raw/esmfold//ESMFold-P00752-v1.pdb,3382,2262,676,965
+413,11225,11381,MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEATKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEEVIPKDENGKILFDTVDLCATWEAVEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRNVRYLTLDIFAGPPNYPFSDEY,sabio,Q04828,C[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C(=O)CO)CC[C@@H]12.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]>>NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,33.6,18.33545830971741,25.0,7.0,1.1.1.357,9606.0,1.526339277389844,C[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C(=O)CO)CC[C@@H]12.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],NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,1.526339277389844,C[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C(=O)CO)CC[C@@H]12.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]__MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEATKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEEVIPKDENGKILFDTVDLCATWEAVEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRNVRYLTLDIFAGPPNYPFSDEY,./data/raw/alphafold//AF-Q04828-F1-model_v4.pdb,1329,1150,197,213
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+420,5652,5738,MNSKQQTVRLSDGHFIPVLGFGTYAPREVPKSKALEATKIAIDAGFRHIDSAAVYQNEKEVGLAIRSKIADGTVKREDIFYTSKVWCTFNHPERVQVCLEQSLKQLQLEYVDLYLIHFPMALKPEEDLKAKDENEKLLFDVVDICDTWKAMEKCKDAGLAKSIGVSNFNRRQLEKILNKPGLKHRPVCNQVECHPYLNQRKLLDFCKSKDIVLVAYSALGSHRETRCVDKSLPVLLADPVLCAIAKKYNWTPALIALRYQLERGVVVLAKSFTEKRIKENMQVFEFQLTSEDMKVLDGLNKNIRYMSGSRFQGHPDFPFLDEY,sabio,Q3MHS3,CC12CCC3C(CCC4CC(=O)CCC43C)C1CCC2=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]>>CC12CCC3C(CCC4CC(=O)CCC43C)C1CCC2O.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,150.0,0.0,25.0,7.4,1.1.1.62,10116.0,2.1760912590556813,CC12CCC3C(CCC4CC(=O)CCC43C)C1CCC2=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],CC12CCC3C(CCC4CC(=O)CCC43C)C1CCC2O.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,2.1760912590556813,CC12CCC3C(CCC4CC(=O)CCC43C)C1CCC2=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
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+423,3931,3984,MRAKLLGIVLTTPIAISSFASTETLSFTPDNINADISLGTLSGKTKERVYLAEEGGRKVSQLDWKFNNAAIIKGAINWDLMPQISIGAAGWTTLGSRGGNMVDQDWMDSSNPGTWTDESRHPDTQLNYANEFDLNIKGWLLNEPNYRLGLMAGYQESRYSFTARGGSYIYSSEEGFRDDIGSFPNGERAIGYKQRFKMPYIGLTGSYRYEDFELGGTFKYSGWVESSDNDEHYDPGKRITYRSKVKDQNYYSVAVNAGYYVTPNAKVYVEGAWNRVTNKKGNTSLYDHNNNTSDYSKNGAGIENYNFITTAGLKYTF,brenda,P09169,CC(C)C[C@H](N=C(O)[C@@H](N)Cc1c[nH]c2ccccc12)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](C)C(O)=NCC(=O)O.O>>,0.03,99.88974787544156,25.0,6.1,3.4.23.49,562.0,-1.5228787452803376,CC(C)C[C@H](N=C(O)[C@@H](N)Cc1c[nH]c2ccccc12)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](C)C(O)=NCC(=O)O.O,,-1.5228787452803376,CC(C)C[C@H](N=C(O)[C@@H](N)Cc1c[nH]c2ccccc12)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](C)C(O)=NCC(=O)O.O__MRAKLLGIVLTTPIAISSFASTETLSFTPDNINADISLGTLSGKTKERVYLAEEGGRKVSQLDWKFNNAAIIKGAINWDLMPQISIGAAGWTTLGSRGGNMVDQDWMDSSNPGTWTDESRHPDTQLNYANEFDLNIKGWLLNEPNYRLGLMAGYQESRYSFTARGGSYIYSSEEGFRDDIGSFPNGERAIGYKQRFKMPYIGLTGSYRYEDFELGGTFKYSGWVESSDNDEHYDPGKRITYRSKVKDQNYYSVAVNAGYYVTPNAKVYVEGAWNRVTNKKGNTSLYDHNNNTSDYSKNGAGIENYNFITTAGLKYTF,./data/raw/alphafold//AF-P09169-F1-model_v4.pdb,1867,1570,3158,1929
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+426,8077,8205,MAGSEDKRVVGTLHLLLLQATVLSLTAGNLSLVSAAWTQEKNHHQPAHLNSSSLQQVAEGTSISEMWQNDLRPLLIERYPGSPGSYSARQHIMQRIQRLQAEWVVEVDTFLSRTPYGYRSFSNIISTLNPEAKRHLVLACHYDSKYFPRWDSRVFVGATDSAVPCAMMLELARALDKKLHSLKDVSGSKPDLSLRLIFFDGEEAFHHWSPQDSLYGSRHLAQKMASSPHPPGSRGTNQLDGMDLLVLLDLIGAANPTFPNFFPKTTRWFNRLQAIEKELYELGLLKDHSLERKYFQNFGYGNIIQDDHIPFLRKGVPVLHLIASPFPEVWHTMDDNEENLHASTIDNLNKIIQVFVLEYLHL,brenda,Q9CYK2,CC[C@H](C)[C@H](N=C(O)CN=C(O)[C@@H](N=C(O)[C@@H](N)CCC(=N)O)[C@@H](C)O)C(=N)O>>CC[C@H](C)[C@H](N=C(O)CN=C(O)[C@@H](N=C(O)[C@@H]1CCC(O)=N1)[C@@H](C)O)C(=N)O.N,23.0,6.816100914051788e-15,30.0,8.0,2.3.2.5,10090.0,1.3617278360175928,CC[C@H](C)[C@H](N=C(O)CN=C(O)[C@@H](N=C(O)[C@@H](N)CCC(=N)O)[C@@H](C)O)C(=N)O,CC[C@H](C)[C@H](N=C(O)CN=C(O)[C@@H](N=C(O)[C@@H]1CCC(O)=N1)[C@@H](C)O)C(=N)O.N,1.3617278360175928,CC[C@H](C)[C@H](N=C(O)CN=C(O)[C@@H](N=C(O)[C@@H](N)CCC(=N)O)[C@@H](C)O)C(=N)O__MAGSEDKRVVGTLHLLLLQATVLSLTAGNLSLVSAAWTQEKNHHQPAHLNSSSLQQVAEGTSISEMWQNDLRPLLIERYPGSPGSYSARQHIMQRIQRLQAEWVVEVDTFLSRTPYGYRSFSNIISTLNPEAKRHLVLACHYDSKYFPRWDSRVFVGATDSAVPCAMMLELARALDKKLHSLKDVSGSKPDLSLRLIFFDGEEAFHHWSPQDSLYGSRHLAQKMASSPHPPGSRGTNQLDGMDLLVLLDLIGAANPTFPNFFPKTTRWFNRLQAIEKELYELGLLKDHSLERKYFQNFGYGNIIQDDHIPFLRKGVPVLHLIASPFPEVWHTMDDNEENLHASTIDNLNKIIQVFVLEYLHL,./data/raw/alphafold//AF-Q9CYK2-F1-model_v4.pdb,2883,4616,4642,2824
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+436,15090,15302,MVRVAINGFGRIGRLVMRIALSRPNVEVVALNDPFITNDYAAYMFKYDSTHGRYAGEVSHDDKHIIVDGKKIATYQERDPANLPWGSSNVDIAIDSTGVFKELDTAQKHIDAGAKKVVITAPSSTAPMFVMGVNEEKYTSDLKIVSNASCTTNCLAPLAKVINDAFGIEEGLMTTVHSLTATQKTVDGPSHKDWRGGRTASGNIIPSSTGAAKAVGKVLPELQGKLTGMAFRVPTVDVSVVDLTVKLNKETTYDEIKKVVKAAAEGKLKGVLGYTEDAVVSSDFLGDSHSSIFDASAGIQLSPKFVKLVSWYDNEYGYSTRVVDLVEHVAKA,sabio,P00359,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(OP(=O)(O)O)[C@H](O)COP(=O)(O)O.[H]>>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.O=CC(O)COP(=O)(O)O.O=P(O)(O)O,10.211097448,0.0,30.0,6.5,1.2.1.12,4932.0,1.0090724208329716,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(OP(=O)(O)O)[C@H](O)COP(=O)(O)O.[H],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.O=CC(O)COP(=O)(O)O.O=P(O)(O)O,1.0090724208329716,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(OP(=O)(O)O)[C@H](O)COP(=O)(O)O.[H]__MVRVAINGFGRIGRLVMRIALSRPNVEVVALNDPFITNDYAAYMFKYDSTHGRYAGEVSHDDKHIIVDGKKIATYQERDPANLPWGSSNVDIAIDSTGVFKELDTAQKHIDAGAKKVVITAPSSTAPMFVMGVNEEKYTSDLKIVSNASCTTNCLAPLAKVINDAFGIEEGLMTTVHSLTATQKTVDGPSHKDWRGGRTASGNIIPSSTGAAKAVGKVLPELQGKLTGMAFRVPTVDVSVVDLTVKLNKETTYDEIKKVVKAAAEGKLKGVLGYTEDAVVSSDFLGDSHSSIFDASAGIQLSPKFVKLVSWYDNEYGYSTRVVDLVEHVAKA,./data/raw/alphafold//AF-P00359-F1-model_v4.pdb,2541,5093,2076,4936
+437,12128,12291,MGFAVESRSHVKDILGLINTFNEVKKITVDGTTPITVAHVAALARRHDVKVALEAEQCRARVETCSSWVQRKAEDGADIYGVTTGFGACSSRRTNQLSELQESLIRCLLAGVFTKGCASSVDELPATATRSAMLLRLNSFTYGCSGIRWEVMEALEKLLNSNVSPKVPLRGSVSASGDLIPLAYIAGLLIGKPSVVARIGDDVEVPAPEALSRVGLRPFKLQAKEGLALVNGTSFATALASTVMYDANVLLLLVETLCGMFCEVIFGREEFAHPLIHKVKPHPGQIESAELLEWLLRSSPFQDLSREYYSIDKLKKPKQDRYALRSSPQWLAPLVQTIRDATTTVETEVNSANDNPIIDHANDRALHGANFQGSAVGFYMDYVRIAVAGLGKLLFAQFTELMIEYYSNGLPGNLSLGPDLSVDYGLKGLDIAMAAYSSELQYLANPVTTHVHSAEQHNQDINSLALISARKTEEALDILKLMIASHLTAMCQAVDLRQLEEALVKVVENVVSTLADECGLPNDTKARLLYVAKAVPVYTYLESPCDPTLPLLLGLEQSCFGSILALHKKDGIETDTLVDRLAEFEKRLSDRLENEMTAVRVLYEKKGHKTADNNDALVRIQGSRFLPFYRFVREELDTGVMSARREQTPQEDVQKVFDAIADGRITVPLLHCLQGFLGQPNGCANGVESFQSVWNKSA,brenda,Q6GZ04,Cc1ccc(C[C@H](N)C(=O)O)cc1>>Cc1ccc(C(N)CC(=O)O)cc1,0.03,0.0,31.0,8.5,5.4.3.10,88032.0,-1.5228787452803376,Cc1ccc(C[C@H](N)C(=O)O)cc1,Cc1ccc(C(N)CC(=O)O)cc1,-1.5228787452803376,Cc1ccc(C[C@H](N)C(=O)O)cc1__MGFAVESRSHVKDILGLINTFNEVKKITVDGTTPITVAHVAALARRHDVKVALEAEQCRARVETCSSWVQRKAEDGADIYGVTTGFGACSSRRTNQLSELQESLIRCLLAGVFTKGCASSVDELPATATRSAMLLRLNSFTYGCSGIRWEVMEALEKLLNSNVSPKVPLRGSVSASGDLIPLAYIAGLLIGKPSVVARIGDDVEVPAPEALSRVGLRPFKLQAKEGLALVNGTSFATALASTVMYDANVLLLLVETLCGMFCEVIFGREEFAHPLIHKVKPHPGQIESAELLEWLLRSSPFQDLSREYYSIDKLKKPKQDRYALRSSPQWLAPLVQTIRDATTTVETEVNSANDNPIIDHANDRALHGANFQGSAVGFYMDYVRIAVAGLGKLLFAQFTELMIEYYSNGLPGNLSLGPDLSVDYGLKGLDIAMAAYSSELQYLANPVTTHVHSAEQHNQDINSLALISARKTEEALDILKLMIASHLTAMCQAVDLRQLEEALVKVVENVVSTLADECGLPNDTKARLLYVAKAVPVYTYLESPCDPTLPLLLGLEQSCFGSILALHKKDGIETDTLVDRLAEFEKRLSDRLENEMTAVRVLYEKKGHKTADNNDALVRIQGSRFLPFYRFVREELDTGVMSARREQTPQEDVQKVFDAIADGRITVPLLHCLQGFLGQPNGCANGVESFQSVWNKSA,./data/raw/alphafold//AF-Q6GZ04-F1-model_v4.pdb,2681,5291,2551,3859
+438,21387,21711,MRSAQVYRWQIPMDAGVVLRDRRLKTRDGLYVCLREGEREGWGEISPLPGFSQETWEEAQSVLLAWVNNWLAGDCELPQMPSVAFGVSCALAELTDTLPQAANYRAAPLCNGDPDDLILKLADMPGEKVAKVKVGLYEAVRDGMVVNLLLEAIPDLHLRLDANRAWTPLKGQQFAKYVNPDYRDRIAFLEEPCKTRDDSRAFARETGIAIAWDESLREPDFAFVAEEGVRAVVIKPTLTGSLEKVREQVQAAHALGLTAVISSSIESSLGLTQLARIAAWLTPDTIPGLDTLDLMQAQQVRRWPGSTLPVVEVDALERLL,sabio,P29208,O=C(O)CCC(=O)C1=CC=CC(O)C1C(=O)O>>O.O=C(O)CCC(=O)c1ccccc1C(=O)O,19.0,0.0,25.0,8.0,4.2.1.113,562.0,1.2787536009528289,O=C(O)CCC(=O)C1=CC=CC(O)C1C(=O)O,O.O=C(O)CCC(=O)c1ccccc1C(=O)O,1.2787536009528289,O=C(O)CCC(=O)C1=CC=CC(O)C1C(=O)O__MRSAQVYRWQIPMDAGVVLRDRRLKTRDGLYVCLREGEREGWGEISPLPGFSQETWEEAQSVLLAWVNNWLAGDCELPQMPSVAFGVSCALAELTDTLPQAANYRAAPLCNGDPDDLILKLADMPGEKVAKVKVGLYEAVRDGMVVNLLLEAIPDLHLRLDANRAWTPLKGQQFAKYVNPDYRDRIAFLEEPCKTRDDSRAFARETGIAIAWDESLREPDFAFVAEEGVRAVVIKPTLTGSLEKVREQVQAAHALGLTAVISSSIESSLGLTQLARIAAWLTPDTIPGLDTLDLMQAQQVRRWPGSTLPVVEVDALERLL,./data/raw/alphafold//AF-P29208-F1-model_v4.pdb,3596,3564,1347,3304
+439,10009,10159,MRPNRFSLRRSPTAVAAVALAAVLAAGAPAAQAAGAAAPTAAAAAAPDIPLANVKAHLTQLSTIAANNGGNRAHGRPGYKASVDYVKAKLDAAGYTTTLQQFTSGGATGYNLIADWPGGDPNKVLMAGAHLDSVSSGAGINDNGSGSAAVLETALAVSRAGYQPDKHLRFAWWGAEELGLIGSKYYVNNLPSADRSKLAGYLNFDMIGSPNPGYFVYDDDPVIEKTFKDYFAGLNVPTEIETEGDGRSDHAPFKNVGVPVGGLFTGAGYTKSAAQAQKWGGTAGQAFDRCYHSSCDSLSNINDTALDRNSDAAAHAIWTLSSGTGEPPTGEGVFSNTTDVAIPDAGAAVTSSVAVTGRTGNAPAALQVGVDIKHTYRGDLVVDLLAPDGTAYRLKNSSSGDSADNVIATYTVNASSEVANGSWKLRVQDIARQDTGYIDSWKLTF,brenda,P80561,CSCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>CSCC[C@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,43.3,0.0,30.0,8.0,3.4.11.24,1911.0,1.6364878963533651,CSCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,CSCC[C@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,1.6364878963533651,CSCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MRPNRFSLRRSPTAVAAVALAAVLAAGAPAAQAAGAAAPTAAAAAAPDIPLANVKAHLTQLSTIAANNGGNRAHGRPGYKASVDYVKAKLDAAGYTTTLQQFTSGGATGYNLIADWPGGDPNKVLMAGAHLDSVSSGAGINDNGSGSAAVLETALAVSRAGYQPDKHLRFAWWGAEELGLIGSKYYVNNLPSADRSKLAGYLNFDMIGSPNPGYFVYDDDPVIEKTFKDYFAGLNVPTEIETEGDGRSDHAPFKNVGVPVGGLFTGAGYTKSAAQAQKWGGTAGQAFDRCYHSSCDSLSNINDTALDRNSDAAAHAIWTLSSGTGEPPTGEGVFSNTTDVAIPDAGAAVTSSVAVTGRTGNAPAALQVGVDIKHTYRGDLVVDLLAPDGTAYRLKNSSSGDSADNVIATYTVNASSEVANGSWKLRVQDIARQDTGYIDSWKLTF,./data/raw/alphafold//AF-P80561-F1-model_v4.pdb,1815,1493,3064,1817
+440,5260,5346,MASSDSKLPLKPIPGSYGLPFFGPMSDRHDYFYNQGRDKFFAERIKKYNSTVIRTNMPPGPFISSNPRVIALLDGVSFPTLFDNSKVDKRDVLDGTFMPSTSFTGGYRACAFQDTTEPSHALLKRFYLNFLASKHETFLPLFRNNLSDHFSDLEDKLAGKPDKASFNSSVGSATFNFLFRLLSDKDPSETIIGSDGPSLVQTWLAAQLAPLATLGLPRIFNYVEDFLIRSIPFPAWTVKSSYKKLYEGLSTAGTAILDEAGRVGIKRDEACHNLVFMLSFNAQGGLVNQFPILIKWLGLAGEGLHKQLAEEIRTVVKDEGGVSLRALDQMTLTKSVVYEVLRIEPAVPFQYAKAREDLVVESHDAAYEIKKGEMIFGYQPFATKDPKIFENAEDFVAHRFLGHDGEKLLRHVLWSNGPQTEEPTPDDKQCPAKNLVVLMCRLYLVEFFLRYDTFTFDFKPVVLGPDVTIKSLAKASSF,brenda,M4WFN0,CC/C=C\C/C=C\C=C\[C@H](CCCCCCCC(=O)O)OO>>CC/C=C\C/C=C\C=C1/O[C@H]1CCCCCCCC(=O)O.O,173.8,0.0,23.0,7.0,4.2.1.92,3847.0,2.240049772112648,CC/C=C\C/C=C\C=C\[C@H](CCCCCCCC(=O)O)OO,CC/C=C\C/C=C\C=C1/O[C@H]1CCCCCCCC(=O)O.O,2.240049772112648,CC/C=C\C/C=C\C=C\[C@H](CCCCCCCC(=O)O)OO__MASSDSKLPLKPIPGSYGLPFFGPMSDRHDYFYNQGRDKFFAERIKKYNSTVIRTNMPPGPFISSNPRVIALLDGVSFPTLFDNSKVDKRDVLDGTFMPSTSFTGGYRACAFQDTTEPSHALLKRFYLNFLASKHETFLPLFRNNLSDHFSDLEDKLAGKPDKASFNSSVGSATFNFLFRLLSDKDPSETIIGSDGPSLVQTWLAAQLAPLATLGLPRIFNYVEDFLIRSIPFPAWTVKSSYKKLYEGLSTAGTAILDEAGRVGIKRDEACHNLVFMLSFNAQGGLVNQFPILIKWLGLAGEGLHKQLAEEIRTVVKDEGGVSLRALDQMTLTKSVVYEVLRIEPAVPFQYAKAREDLVVESHDAAYEIKKGEMIFGYQPFATKDPKIFENAEDFVAHRFLGHDGEKLLRHVLWSNGPQTEEPTPDDKQCPAKNLVVLMCRLYLVEFFLRYDTFTFDFKPVVLGPDVTIKSLAKASSF,./data/raw/alphafold//AF-M4WFN0-F1-model_v4.pdb,3119,1888,3522,2341
+441,13979,14160,MADCCTPRKKLCWCVLLFFLVAGITGGAIGIYKWHYSGLNRWHGAGSTADFQKIIQERCDTYTQTIRPGSRSRNCQAIRQAFMSAFISKDPCKATKEDYNSLINLAPPTVPCGQQVFWSKTKELAHEYAKRRRLMTLEDTLLGYLADGLRWCGEPGSSDLNIWSCPDWRKDCRTNYLSVFWEVLSERFAESACNTVRVVLNGSLENAFDSMSIFGRVEAPNLRPQVELEAWLVHDTGKPPSDSCSGSSIRKLKSILDGRNVKFRCMDNLSRDQFLQRS,brenda,Q9TTF5,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>>N=C(O)c1cccnc1.Nc1ncnc2c1[NH+]1[CH-]N2[C@@H]2O[C@H](COP(=O)(O)OP(=O)([O-])OC[C@H]3O[C@@H]1[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O,57.9,1.7097359110415706e-14,37.0,7.4,3.2.2.6,9913.0,1.7626785637274365,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,N=C(O)c1cccnc1.Nc1ncnc2c1[NH+]1[CH-]N2[C@@H]2O[C@H](COP(=O)(O)OP(=O)([O-])OC[C@H]3O[C@@H]1[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O,1.7626785637274365,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__MADCCTPRKKLCWCVLLFFLVAGITGGAIGIYKWHYSGLNRWHGAGSTADFQKIIQERCDTYTQTIRPGSRSRNCQAIRQAFMSAFISKDPCKATKEDYNSLINLAPPTVPCGQQVFWSKTKELAHEYAKRRRLMTLEDTLLGYLADGLRWCGEPGSSDLNIWSCPDWRKDCRTNYLSVFWEVLSERFAESACNTVRVVLNGSLENAFDSMSIFGRVEAPNLRPQVELEAWLVHDTGKPPSDSCSGSSIRKLKSILDGRNVKFRCMDNLSRDQFLQRS,./data/raw/alphafold//AF-Q9TTF5-F1-model_v4.pdb,2323,4662,4690,4520
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+447,17585,17825,MKTLSQAQSKTSSQQFSFTGNSSANVIIGNQKLTINDVARVARNGTLVSLTNNTDILQGIQASCDYINNAVESGEPIYGVTSGFGGMANVAISREQASELQTNLVWFLKTGAGNKLPLADVRAAMLLRANSHMRGASGIRLELIKRMEIFLNAGVTPYVYEFGSIGASGDLVPLSYITGSLIGLDPSFKVDFNGKEMDAPTALRQLNLSPLTLLPKEGLAMMNGTSVMTGIAANCVYDTQILTAIAMGVHALDIQALNGTNQSFHPFIHNSKPHPGQLWAADQMISLLANSQLVRDELDGKHDYRDHELIQDRYSLRCLPQYLGPIVDGISQIAKQIEIEINSVTDNPLIDVDNQASYHGGNFLGQYVGMGMDHLRYYIGLLAKHLDVQIALLASPEFSNGLPPSLLGNRERKVNMGLKGLQICGNSIMPLLTFYGNSIADRFPTHAEQFNQNINSQGYTSATLARRSVDIFQNYVAIALMFGVQAVDLRTYKKTGHYDARACLSPATERLYSAVRHVVGQKPTSDRPYIWNDNEQGLDEHIARISADIAAGGVIVQAVQDILPCLH,brenda,Q3M5Z3,N[C@@H](Cc1cccnc1)C(=O)O>>N.O=C(O)/C=C/c1cccnc1,0.91,0.0,30.0,8.3,4.3.1.24,264691.0,-0.0409586076789063,N[C@@H](Cc1cccnc1)C(=O)O,N.O=C(O)/C=C/c1cccnc1,-0.0409586076789063,N[C@@H](Cc1cccnc1)C(=O)O__MKTLSQAQSKTSSQQFSFTGNSSANVIIGNQKLTINDVARVARNGTLVSLTNNTDILQGIQASCDYINNAVESGEPIYGVTSGFGGMANVAISREQASELQTNLVWFLKTGAGNKLPLADVRAAMLLRANSHMRGASGIRLELIKRMEIFLNAGVTPYVYEFGSIGASGDLVPLSYITGSLIGLDPSFKVDFNGKEMDAPTALRQLNLSPLTLLPKEGLAMMNGTSVMTGIAANCVYDTQILTAIAMGVHALDIQALNGTNQSFHPFIHNSKPHPGQLWAADQMISLLANSQLVRDELDGKHDYRDHELIQDRYSLRCLPQYLGPIVDGISQIAKQIEIEINSVTDNPLIDVDNQASYHGGNFLGQYVGMGMDHLRYYIGLLAKHLDVQIALLASPEFSNGLPPSLLGNRERKVNMGLKGLQICGNSIMPLLTFYGNSIADRFPTHAEQFNQNINSQGYTSATLARRSVDIFQNYVAIALMFGVQAVDLRTYKKTGHYDARACLSPATERLYSAVRHVVGQKPTSDRPYIWNDNEQGLDEHIARISADIAAGGVIVQAVQDILPCLH,./data/raw/alphafold//AF-Q3M5Z3-F1-model_v4.pdb,2167,4384,4275,4147
+448,5130,5216,MSYSFMSPPNAARFVLSNATVPAVTVVGFTGPSSEGLMKADIVVADGLIKDILPAGTAPAELAKADMRDGMVWPTFADMHTHLDKGHIWERRANPDGSFMGALDAVRSDREANWSAADVRKRMEFSLRAAYAHGTSLIRTHLDSLAPQHRISFEVFSEVREAWKDKIALQAVALFPLDFMVDDAFFADLTTVVREAGGLLGGVTQMNPDIDAQLDKLIRAAAANGLDIDLHVDETEDREVLTLKAIAAAVLRNGFTGKVTAGHCCSLARQDENVAAATIDLVAKAGISIVALPMCNMYLQDRHPGRTPRWRGVTLLHELAAAGVPTAVASDNTRDPFYAYGDLDPVEVFREAVRILHLDHPLDTAARVVTTSPASILGRPDIGRIAVGGPADLVLFSARRWSEFLSRPQSDRVVLRKGKVIDRSLPDYRELDTVIGA,sabio,B9J8S0,CC(O)C(O)c1cnc2nc(N)[nH]c(=O)c2n1.O>>C[C@@H](O)[C@@H](O)c1cnc2[nH]c(=O)[nH]c(=O)c2n1.N,46.0,5.556889078183584e-15,,7.7,3.5.4.11,358.0,1.662757831681574,CC(O)C(O)c1cnc2nc(N)[nH]c(=O)c2n1.O,C[C@@H](O)[C@@H](O)c1cnc2[nH]c(=O)[nH]c(=O)c2n1.N,1.662757831681574,CC(O)C(O)c1cnc2nc(N)[nH]c(=O)c2n1.O__MSYSFMSPPNAARFVLSNATVPAVTVVGFTGPSSEGLMKADIVVADGLIKDILPAGTAPAELAKADMRDGMVWPTFADMHTHLDKGHIWERRANPDGSFMGALDAVRSDREANWSAADVRKRMEFSLRAAYAHGTSLIRTHLDSLAPQHRISFEVFSEVREAWKDKIALQAVALFPLDFMVDDAFFADLTTVVREAGGLLGGVTQMNPDIDAQLDKLIRAAAANGLDIDLHVDETEDREVLTLKAIAAAVLRNGFTGKVTAGHCCSLARQDENVAAATIDLVAKAGISIVALPMCNMYLQDRHPGRTPRWRGVTLLHELAAAGVPTAVASDNTRDPFYAYGDLDPVEVFREAVRILHLDHPLDTAARVVTTSPASILGRPDIGRIAVGGPADLVLFSARRWSEFLSRPQSDRVVLRKGKVIDRSLPDYRELDTVIGA,./data/raw/alphafold//AF-B9J8S0-F1-model_v4.pdb,3081,1838,3466,2274
+449,8592,8724,MGESKVYMNGNHGGTRWSLKGTTALVTGGSKGIGYAVVEELAGFGATVYTCSRNEKELQQCLEIWSKEGLKVEGSVCDLLLRSEREKLMQAVGDLFNGKLNILVNNAGVVIHKEAKDFTEEDYNIVMGTNFEAAYHLSQLAYPLLKASENGNVIFLSSIAGFSALPSVSLYSASKAAINQMTKNLACEWAKENIRVNSVAPGIILTPLVETAIKKNPHQKEEIDNFIVKTPMGRAGKPKEVSALIAFLCFPAASYITGQIIWADGGFTANGGF,brenda,R4QQK2,CN1[C@@H]2CC[C@H]1CC(=O)C2.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+]>>CN1[C@@H]2CC[C@@H]1CC(O)C2.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)c1,0.98,7.0512036019023704e-15,30.0,6.4,1.1.1.206,258458.0,-0.0087739243075051,CN1[C@@H]2CC[C@H]1CC(=O)C2.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+],CN1[C@@H]2CC[C@@H]1CC(O)C2.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,-0.0087739243075051,CN1[C@@H]2CC[C@H]1CC(=O)C2.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+]__MGESKVYMNGNHGGTRWSLKGTTALVTGGSKGIGYAVVEELAGFGATVYTCSRNEKELQQCLEIWSKEGLKVEGSVCDLLLRSEREKLMQAVGDLFNGKLNILVNNAGVVIHKEAKDFTEEDYNIVMGTNFEAAYHLSQLAYPLLKASENGNVIFLSSIAGFSALPSVSLYSASKAAINQMTKNLACEWAKENIRVNSVAPGIILTPLVETAIKKNPHQKEEIDNFIVKTPMGRAGKPKEVSALIAFLCFPAASYITGQIIWADGGFTANGGF,./data/raw/alphafold//AF-R4QQK2-F1-model_v4.pdb,3453,2366,1081,3002
+450,1133,1160,MRILFFSSQAYDSESFQASNHRHGFELHFQQAHLQADTAVLAQGFEVVCAFVNDDLSRPVLERLAAGGTRLVALRSAGYNHVDLAAAEALGLPVVHVPAYSPHAVAEHAVGLILTLNRRLHRAYNRTREGDFSLHGLTGFDLHGKRVGVIGTGQIGETFARIMAGFGCELLAYDPYPNPRIQALGGRYLALDALLAESDIVSLHCPLTADTRHLIDAQRLATMKPGAMLINTGRGALVNAAALIEALKSGQLGYLGLDVYEEEADIFFEDRSDQPLQDDVLARLLSFPNVVVTAHQAFLTREALAAIADTTLDNIAAWQDGTPRNRVRA,brenda,Q9I530,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)c1,290.0,6.8076358374371095e-15,30.0,8.0,1.1.1.28,287.0,2.462397997898956,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)c1,2.462397997898956,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+]__MRILFFSSQAYDSESFQASNHRHGFELHFQQAHLQADTAVLAQGFEVVCAFVNDDLSRPVLERLAAGGTRLVALRSAGYNHVDLAAAEALGLPVVHVPAYSPHAVAEHAVGLILTLNRRLHRAYNRTREGDFSLHGLTGFDLHGKRVGVIGTGQIGETFARIMAGFGCELLAYDPYPNPRIQALGGRYLALDALLAESDIVSLHCPLTADTRHLIDAQRLATMKPGAMLINTGRGALVNAAALIEALKSGQLGYLGLDVYEEEADIFFEDRSDQPLQDDVLARLLSFPNVVVTAHQAFLTREALAAIADTTLDNIAAWQDGTPRNRVRA,./data/raw/alphafold//AF-Q9I530-F1-model_v4.pdb,1278,5239,1627,763
+451,18281,18541,MIKKIGVLTSGGDAPGMNAAIRGVVRSALTEGLEVMGIYDGYLGLYEDRMVQLDRYSVSDMINRGGTFLGSARFPEFRDENIRAVAIENLKKRGIDALVVIGGDGSYMGAMRLTEMGFPCIGLPGTIDNDIKGTDYTIGFFTALSTVVEAIDRLRDTSSSHQRISVVEVMGRYCGDLTLAAAIAGGCEFVVVPEVEFSREDLVNEIKAGIAKGKKHAIVAITEHMCDVDELAHFIEKETGRETRATVLGHIQRGGSPVPYDRILASRMGAYAIDLLLAGYGGRCVGIQNEQLVHHDIIDAIENMKRPFKGDWLDCAKKLY,sabio,P0A796,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)S)C(O)C1O.O=P(O)(O)OCC1OC(O)(CO)C(O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,0.33,29.397947156954345,,8.2,2.7.1.11,562.0,-0.4814860601221125,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)S)C(O)C1O.O=P(O)(O)OCC1OC(O)(CO)C(O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,-0.4814860601221125,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)S)C(O)C1O.O=P(O)(O)OCC1OC(O)(CO)C(O)C1O__MIKKIGVLTSGGDAPGMNAAIRGVVRSALTEGLEVMGIYDGYLGLYEDRMVQLDRYSVSDMINRGGTFLGSARFPEFRDENIRAVAIENLKKRGIDALVVIGGDGSYMGAMRLTEMGFPCIGLPGTIDNDIKGTDYTIGFFTALSTVVEAIDRLRDTSSSHQRISVVEVMGRYCGDLTLAAAIAGGCEFVVVPEVEFSREDLVNEIKAGIAKGKKHAIVAITEHMCDVDELAHFIEKETGRETRATVLGHIQRGGSPVPYDRILASRMGAYAIDLLLAGYGGRCVGIQNEQLVHHDIIDAIENMKRPFKGDWLDCAKKLY,./data/raw/alphafold//AF-P0A796-F1-model_v4.pdb,2852,2524,2814,5660
+452,19953,20239,MGVVEGLLALALVLSACVMCNGGSSSPFIRKVEKTVDMPLDSDVFAVPPGYNAPQQVHITQGDLVGKAVIVSWVTVDEPGSSEVHYWSENSDKKKIAEGKLVTYRFFNYSSGFIHHTTIRNLEYKTKYYYEVGLGNTTRQFWFVTPPEIGPDVPYTFGLIGDLGQSFDSNKTLSHYELNPRKGQTVLFVGDLSYADNYPNHDNIRWDSWGRFTERSVAYQPWIWTAGNHENHFAPEIGETVPFKPYTHRYHVPYKASQSTSPFWYSIKRASAHIIVLASYSAYGKYTPQYKWLEKELPKVNRTETPWLIVLMHSPWYNSYNYHYMEGETMRVMYEPWFVQYKVDVVFAGHVHAYERSERVSNVAYNIVNGLCAPVNDKSAPVYITIGDGGTLEGLATNMTEPQPKYSAFREASFGHAIFDITNRTHAHYSWHRNQDGVAVEADSLWSFNRYWHPVDDSTAHVSH,sabio,Q09131,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1>>O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,230.0,0.0,25.0,,3.1.3.2,3847.0,2.361727836017593,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,2.361727836017593,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MGVVEGLLALALVLSACVMCNGGSSSPFIRKVEKTVDMPLDSDVFAVPPGYNAPQQVHITQGDLVGKAVIVSWVTVDEPGSSEVHYWSENSDKKKIAEGKLVTYRFFNYSSGFIHHTTIRNLEYKTKYYYEVGLGNTTRQFWFVTPPEIGPDVPYTFGLIGDLGQSFDSNKTLSHYELNPRKGQTVLFVGDLSYADNYPNHDNIRWDSWGRFTERSVAYQPWIWTAGNHENHFAPEIGETVPFKPYTHRYHVPYKASQSTSPFWYSIKRASAHIIVLASYSAYGKYTPQYKWLEKELPKVNRTETPWLIVLMHSPWYNSYNYHYMEGETMRVMYEPWFVQYKVDVVFAGHVHAYERSERVSNVAYNIVNGLCAPVNDKSAPVYITIGDGGTLEGLATNMTEPQPKYSAFREASFGHAIFDITNRTHAHYSWHRNQDGVAVEADSLWSFNRYWHPVDDSTAHVSH,./data/raw/alphafold//AF-Q09131-F1-model_v4.pdb,5,2472,2751,5596
+453,9845,9994,MSSGIHVALVTGGNKGIGLAIVRDLCRLFSGDVVLTARDVTRGQAAVQQLQAEGLSPRFHQLDIDDLQSIRALRDFLRKEYGGLDVLVNNAGIAFKVADPTPFHIQAEVTMKTNFFGTRDVCTELLPLIKPQGRVVNVSSIMSVRALKSCSPELQQKFRSETITEEELVGLMNKFVEDTKKGVHQKEGWPSSAYGVTKIGVTVLSRIHARKLSEQRKGDKILLNACCPGWVRTDMAGPKATKSPEEGAETPVYLALLPPDAEGPHGQFVSEKRVEQW,sabio,P16152,COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)CC(O)(C(C)=O)CC3OC1CC(N)C(O)C(C)O1.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]>>NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,3.0,26.22305108112605,,7.0,1.1.1.184,9606.0,0.4771212547196624,COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)CC(O)(C(C)=O)CC3OC1CC(N)C(O)C(C)O1.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],NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,1.9590413923210936,COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)CC(O)(C(C)=O)CC3OC1CC(N)C(O)C(C)O1.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]__MSSGIHVALVTGGNKGIGLAIVRDLCRLFSGDVVLTARDVTRGQAAVQQLQAEGLSPRFHQLDIDDLQSIRALRDFLRKEYGGLDVLVNNAGIAFKVADPTPFHIQAEVTMKTNFFGTRDVCTELLPLIKPQGRVVNVSSIMSVRALKSCSPELQQKFRSETITEEELVGLMNKFVEDTKKGVHQKEGWPSSAYGVTKIGVTVLSRIHARKLSEQRKGDKILLNACCPGWVRTDMAGPKATKSPEEGAETPVYLALLPPDAEGPHGQFVSEKRVEQW,./data/raw/alphafold//AF-P16152-F1-model_v4.pdb,1319,3880,4509,857
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+455,6511,6624,MLDMPIDPVYYQLAEYFDSLPKFDQFSSAREYREAINRIYEERNRQLSQHERVERVEDRTIKGRNGDIRVRVYQQKPDSPVLVYYHGGGFVICSIESHDALCRRIARLSNSTVVSVDYRLAPEHKFPAAVYDCYDATKWVAENAEELRIDPSKIFVGGDSAGGNLAAAVSIMARDSGEDFIKHQILIYPVVNFVAPTPSLLEFGEGLWILDQKIMSWFSEQYFSREEDKFNPLASVIFADLENLPPALIITAEYDPLRDEGEVFGQMLRRAGVEASIVRYRGVLHGFINYYPVLKAARDAINQIAALLVFD,brenda,O28558,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,680.0,0.0,70.0,7.1,3.1.1.1,2234.0,2.832508912706236,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,2.832508912706236,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MLDMPIDPVYYQLAEYFDSLPKFDQFSSAREYREAINRIYEERNRQLSQHERVERVEDRTIKGRNGDIRVRVYQQKPDSPVLVYYHGGGFVICSIESHDALCRRIARLSNSTVVSVDYRLAPEHKFPAAVYDCYDATKWVAENAEELRIDPSKIFVGGDSAGGNLAAAVSIMARDSGEDFIKHQILIYPVVNFVAPTPSLLEFGEGLWILDQKIMSWFSEQYFSREEDKFNPLASVIFADLENLPPALIITAEYDPLRDEGEVFGQMLRRAGVEASIVRYRGVLHGFINYYPVLKAARDAINQIAALLVFD,./data/raw/alphafold//AF-O28558-F1-model_v4.pdb,1438,3020,549,627
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+460,5561,5647,MHSKVTIICIRFLFWFLLLCMLIGKSHTEDDIIIATKNGKVRGMNLTVFGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSDIWNATKYANSCCQNIDQSFPGFHGSEMWNPNTDLSEDCLYLNVWIPAPKPKNATVLIWIYGGGFQTGTSSLHVYDGKFLARVERVIVVSMNYRVGALGFLALPGNPEAPGNMGLFDQQLALQWVQKNIAAFGGNPKSVTLFGESAGAASVSLHLLSPGSHSLFTRAILQSGSFNAPWAVTSLYEARNRTLNLAKLTGCSRENETEIIKCLRNKDPQEILLNEAFVVPYGTPLSVNFGPTVDGDFLTDMPDILLELGQFKKTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPGVSEFGKESILFHYTDWVDDQRPENYREALGDVVGDYNFICPALEFTKKFSEWGNNAFFYYFEHRSSKLPWPEWMGVMHGYEIEFVFGLPLERRDNYTKAEEILSRSIVKRWANFAKYGNPNETQNNSTSWPVFKSTEQKYLTLNTESTRIMTKLRAQQCRFWTSFFPKVLEMTGNIDEAEWEWKAGFHRWNNYMMDWKNQFNDYTSKKESCVGL,sabio,P06276,CC1(C)[C@@H](C=C(Cl)Cl)[C@@H]1C(=O)OCc1cccc(Oc2ccccc2)c1.O>>CC1(C)C(C=C(Cl)Cl)C1C(=O)[O-].OCc1cccc(Oc2ccccc2)c1,0.12,0.1231355590574312,37.0,7.4,3.1.1.8,9606.0,-0.9208187539523752,CC1(C)[C@@H](C=C(Cl)Cl)[C@@H]1C(=O)OCc1cccc(Oc2ccccc2)c1.O,CC1(C)C(C=C(Cl)Cl)C1C(=O)[O-].OCc1cccc(Oc2ccccc2)c1,-0.9208187539523752,CC1(C)[C@@H](C=C(Cl)Cl)[C@@H]1C(=O)OCc1cccc(Oc2ccccc2)c1.O__MHSKVTIICIRFLFWFLLLCMLIGKSHTEDDIIIATKNGKVRGMNLTVFGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSDIWNATKYANSCCQNIDQSFPGFHGSEMWNPNTDLSEDCLYLNVWIPAPKPKNATVLIWIYGGGFQTGTSSLHVYDGKFLARVERVIVVSMNYRVGALGFLALPGNPEAPGNMGLFDQQLALQWVQKNIAAFGGNPKSVTLFGESAGAASVSLHLLSPGSHSLFTRAILQSGSFNAPWAVTSLYEARNRTLNLAKLTGCSRENETEIIKCLRNKDPQEILLNEAFVVPYGTPLSVNFGPTVDGDFLTDMPDILLELGQFKKTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPGVSEFGKESILFHYTDWVDDQRPENYREALGDVVGDYNFICPALEFTKKFSEWGNNAFFYYFEHRSSKLPWPEWMGVMHGYEIEFVFGLPLERRDNYTKAEEILSRSIVKRWANFAKYGNPNETQNNSTSWPVFKSTEQKYLTLNTESTRIMTKLRAQQCRFWTSFFPKVLEMTGNIDEAEWEWKAGFHRWNNYMMDWKNQFNDYTSKKESCVGL,./data/raw/alphafold//AF-P06276-F1-model_v4.pdb,1568,1137,973,1159
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+462,20769,21080,MLDDIRGFMNTFSETMFMDVINYSLTRDRYDSVFLQRQNYRDLGQLKEILTNDDGIKIKFDGYDLKIQGTADGTIKFTWTDGPEIPVTDPEFVKPRLDNGVYEFGDYRLLIEKDGFSIRDVEGTILHREFFPSFGENITHAFELNQGDIIAGLGEKAAPINMIGHVFRLWNHDANGSYGPDSDPLYVNVPIMLHGHAGRFILILYVNAGDATVDVGYSDEHRVSSSFKSKPLAYYVITGNLDTIYEKLSLITGKPQKPPYWAFEFQQSRYSYMDTKEVRDLVDGFASRGIPLGAVYLDIDYMDRFKMFTFDPQRFGDVKQLTEYMEQKGVKLITIMEPSIKMEHGFDLYEEGLKGGYFVKYPDGNVMYAPVWPEMAAFPDFTDEKAREWYASKYDFMRSMGVSGFWHDMNEPAIFVGWGDNTMPRSAVHRIGRHEEVHNLYGYYMDKAAYDHLSKVERPFILSRSGWAGISRYGWIWTGDTETSWKELKQNIITIMHMSMSGITLTGCDIGGFTGSPTPELFIRWLQASLFFPLYRVHSDKKSKRREPWAFGSHEKEIIEIIRLRHSFVPHIYSEAISSSITGLPLVRPVFWADPSRNDLMSVDDEYTFGGSILIAPIVEEHAVIRRIILPSGRWYNISDDRIVEGSLSINVDLSTVPIFVREGSAILRENDGIELHLYLANERRKSILYISDGNDDIKVEVEFDSKSVDINPQKVPKIKAIVMHGFREDELILNGEPIKTSDGIIRLK,brenda,Q9HLD0,O.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>>OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O,127.0,0.0,80.0,5.5,3.2.1.20,2303.0,2.103803720955957,O.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,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O,2.103803720955957,O.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__MLDDIRGFMNTFSETMFMDVINYSLTRDRYDSVFLQRQNYRDLGQLKEILTNDDGIKIKFDGYDLKIQGTADGTIKFTWTDGPEIPVTDPEFVKPRLDNGVYEFGDYRLLIEKDGFSIRDVEGTILHREFFPSFGENITHAFELNQGDIIAGLGEKAAPINMIGHVFRLWNHDANGSYGPDSDPLYVNVPIMLHGHAGRFILILYVNAGDATVDVGYSDEHRVSSSFKSKPLAYYVITGNLDTIYEKLSLITGKPQKPPYWAFEFQQSRYSYMDTKEVRDLVDGFASRGIPLGAVYLDIDYMDRFKMFTFDPQRFGDVKQLTEYMEQKGVKLITIMEPSIKMEHGFDLYEEGLKGGYFVKYPDGNVMYAPVWPEMAAFPDFTDEKAREWYASKYDFMRSMGVSGFWHDMNEPAIFVGWGDNTMPRSAVHRIGRHEEVHNLYGYYMDKAAYDHLSKVERPFILSRSGWAGISRYGWIWTGDTETSWKELKQNIITIMHMSMSGITLTGCDIGGFTGSPTPELFIRWLQASLFFPLYRVHSDKKSKRREPWAFGSHEKEIIEIIRLRHSFVPHIYSEAISSSITGLPLVRPVFWADPSRNDLMSVDDEYTFGGSILIAPIVEEHAVIRRIILPSGRWYNISDDRIVEGSLSINVDLSTVPIFVREGSAILRENDGIELHLYLANERRKSILYISDGNDDIKVEVEFDSKSVDINPQKVPKIKAIVMHGFREDELILNGEPIKTSDGIIRLK,./data/raw/alphafold//AF-Q9HLD0-F1-model_v4.pdb,451,3120,5407,6288
+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
+464,9849,9998,MSSSRPVALVTGANKGIGFAITRDLCRKFSGDVVLAARDEERGQTAVQKLQAEGLSPRFHQLDIDNPQSIRALRDFLLKEYGGLDVLVNNAGIAFKVNDDTPFHIQAEVTMKTNFFGTRDVCKELLPLIKPQGRVVNVSSMVSLRALKNCRLELQQKFRSETITEEELVGLMNKFVEDTKKGVHAEEGWPNSAYGVTKIGVTVLSRILARKLNEQRRGDKILLNACCPGWVRTDMAGPKATKSPEEGAETPVYLALLPPDAEGPHGQFVQDKKVEPW,brenda,P48758,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)c1,0.015,0.0,37.0,7.0,1.1.1.184,10090.0,-1.8239087409443189,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,-1.8239087409443189,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+]__MSSSRPVALVTGANKGIGFAITRDLCRKFSGDVVLAARDEERGQTAVQKLQAEGLSPRFHQLDIDNPQSIRALRDFLLKEYGGLDVLVNNAGIAFKVNDDTPFHIQAEVTMKTNFFGTRDVCKELLPLIKPQGRVVNVSSMVSLRALKNCRLELQQKFRSETITEEELVGLMNKFVEDTKKGVHAEEGWPNSAYGVTKIGVTVLSRILARKLNEQRRGDKILLNACCPGWVRTDMAGPKATKSPEEGAETPVYLALLPPDAEGPHGQFVQDKKVEPW,./data/raw/alphafold//AF-P48758-F1-model_v4.pdb,1319,3880,4509,3276
+465,18692,18965,MELIQDTSRPPLEYVKGVPLIKYFAEALGPLQSFQARPDDLLISTYPKSGTTWVSQILDMIYQGGDLEKCHRAPIFMRVPFLEFKAPGIPSGMETLKDTPAPRLLKTHLPLALLPQTLLDQKVKVVYVARNAKDVAVSYYHFYHMAKVHPEPGTWDSFLEKFMVGEVSYGSWYQHVQEWWELSRTHPVLYLFYEDMKENPKREIQKILEFVGRSLPEETVDFVVQHTSFKEMKKNPMTNYTTVPQEFMDHSISPFMRKGMAGDWKTTFTVAQNERFDADYAEKMAGCSLSFRSEL,brenda,P50225,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OS(=O)(=O)O)[C@@H](OP(=O)(O)O)[C@H]1O.Oc1ccc2ccc3cccc4ccc1c2c34>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O.O=S(=O)(O)Oc1ccc2ccc3cccc4ccc1c2c34,2.0,0.0,25.0,7.5,2.8.2.1,9606.0,0.3010299956639812,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OS(=O)(=O)O)[C@@H](OP(=O)(O)O)[C@H]1O.Oc1ccc2ccc3cccc4ccc1c2c34,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O.O=S(=O)(O)Oc1ccc2ccc3cccc4ccc1c2c34,0.3010299956639812,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OS(=O)(=O)O)[C@@H](OP(=O)(O)O)[C@H]1O.Oc1ccc2ccc3cccc4ccc1c2c34__MELIQDTSRPPLEYVKGVPLIKYFAEALGPLQSFQARPDDLLISTYPKSGTTWVSQILDMIYQGGDLEKCHRAPIFMRVPFLEFKAPGIPSGMETLKDTPAPRLLKTHLPLALLPQTLLDQKVKVVYVARNAKDVAVSYYHFYHMAKVHPEPGTWDSFLEKFMVGEVSYGSWYQHVQEWWELSRTHPVLYLFYEDMKENPKREIQKILEFVGRSLPEETVDFVVQHTSFKEMKKNPMTNYTTVPQEFMDHSISPFMRKGMAGDWKTTFTVAQNERFDADYAEKMAGCSLSFRSEL,./data/raw/alphafold//AF-P50225-F1-model_v4.pdb,2908,2660,2963,5812
+466,4936,5008,SLTKSSHAGGISIYWGQNGNEGTLEATCATGKYAYVNIAFLNKFGKGQTPELNLAGHCNPANNGCVGTSTGIKSCQSRGIKVLLSLGGGIGSYNLTSRLDAKNVADYLWNSFLGGKSRSATRPLGDAVLDGIDFDIEQGSGGHWPDLARYLSEYSKRGRKVYLGAAPQCPFPDSNLGTALNTGLFDYVWVQFYNNPPCQYTTGNTANILDSWTRWTTSINAREIFLGLPAAPAAGGSGFIPVADLNSKVLPAIR,brenda,U5LKV8,CC(O)=N[C@H]1C(Oc2ccc([N+](=O)[O-])cc2)O[C@H](CO)[C@@H](O)[C@@H]1O.O>>CC(O)=N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1O.O=[N+]([O-])c1ccc(O)cc1,34.0,7.876999113240716e-15,40.0,5.0,3.2.1.14,3991.0,1.5314789170422551,CC(O)=N[C@H]1C(Oc2ccc([N+](=O)[O-])cc2)O[C@H](CO)[C@@H](O)[C@@H]1O.O,CC(O)=N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1O.O=[N+]([O-])c1ccc(O)cc1,1.5314789170422551,CC(O)=N[C@H]1C(Oc2ccc([N+](=O)[O-])cc2)O[C@H](CO)[C@@H](O)[C@@H]1O.O__SLTKSSHAGGISIYWGQNGNEGTLEATCATGKYAYVNIAFLNKFGKGQTPELNLAGHCNPANNGCVGTSTGIKSCQSRGIKVLLSLGGGIGSYNLTSRLDAKNVADYLWNSFLGGKSRSATRPLGDAVLDGIDFDIEQGSGGHWPDLARYLSEYSKRGRKVYLGAAPQCPFPDSNLGTALNTGLFDYVWVQFYNNPPCQYTTGNTANILDSWTRWTTSINAREIFLGLPAAPAAGGSGFIPVADLNSKVLPAIR,./data/raw/alphafold//AF-U5LKV8-F1-model_v4.pdb,3034,1786,3412,2219
+467,19188,19474,MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGANADAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFSGKNAGQVVLHSFKAGLAENMVPESATAVISGAKDLEAALEKFVAEHASKNLRFDLEEADGKATITLYGKSAHGAMPEKGINGATYLTLFLNQFDFADGAAAFIKVGAEKLLEDHEGEKLGTAFVDELMENTSMNAGVWSFDENGEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHTPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELAK,sabio,Q84BV1,O.O=C(O)C(Cc1ccccc1)N=C(O)C1CCCN1>>NC(Cc1ccccc1)C(=O)O.O=C(O)[C@@H]1CCCN1,56.1,0.0,37.0,7.5,3.4.13.-,1359.0,1.7489628612561614,O.O=C(O)C(Cc1ccccc1)N=C(O)C1CCCN1,NC(Cc1ccccc1)C(=O)O.O=C(O)[C@@H]1CCCN1,1.7489628612561614,O.O=C(O)C(Cc1ccccc1)N=C(O)C1CCCN1__MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGANADAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFSGKNAGQVVLHSFKAGLAENMVPESATAVISGAKDLEAALEKFVAEHASKNLRFDLEEADGKATITLYGKSAHGAMPEKGINGATYLTLFLNQFDFADGAAAFIKVGAEKLLEDHEGEKLGTAFVDELMENTSMNAGVWSFDENGEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHTPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELAK,./data/raw/alphafold//AF-Q84BV1-F1-model_v4.pdb,1801,1476,3046,1795
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+471,18136,18391,MALLGNFLCCLLVAWLCGPGLGVPLAPADRAPAVGQFWHVTDLHLDPTYHITDDRTKVCASSKGANASNPGPFGDVLCDSPYQLILSAFDFIKNSGQEASFMIWTGDSPPHVPVPELSTGTVIKVITNMTMTVQNLFPNLQVFPALGNHDYWPQDQLPIVTSKVYSAVADLWKPWLGEEAISTLKKGGFYSQKVASNPGLRIISLNTNLYYGPNIMTLNKTDPANQFEWLENTLNSSLWNKEKVYIIAHVPVGYLPYATDTPAIRQYYNEKLLDIFRRYSSVIAGQFYGHTHRDSLMVLSDKNGNPLNSVFVAPAVTPVKGVLQKETNNPGVRLFQYKPGDYTLLDMVQYYLNLTEANLKGESNWTLEYVLTQAYSVADLQPKSLYALVQQFATKDSKQFLKYYHYYFVSYDSSATCDQHCKTLQVCAIMNLDSMSYDDCLKQHL,sabio,P70158,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,15600.0,1.0812962383427719e-14,37.0,7.5,3.1.4.-,10090.0,4.193124598354462,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,4.966235624098582,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O__MALLGNFLCCLLVAWLCGPGLGVPLAPADRAPAVGQFWHVTDLHLDPTYHITDDRTKVCASSKGANASNPGPFGDVLCDSPYQLILSAFDFIKNSGQEASFMIWTGDSPPHVPVPELSTGTVIKVITNMTMTVQNLFPNLQVFPALGNHDYWPQDQLPIVTSKVYSAVADLWKPWLGEEAISTLKKGGFYSQKVASNPGLRIISLNTNLYYGPNIMTLNKTDPANQFEWLENTLNSSLWNKEKVYIIAHVPVGYLPYATDTPAIRQYYNEKLLDIFRRYSSVIAGQFYGHTHRDSLMVLSDKNGNPLNSVFVAPAVTPVKGVLQKETNNPGVRLFQYKPGDYTLLDMVQYYLNLTEANLKGESNWTLEYVLTQAYSVADLQPKSLYALVQQFATKDSKQFLKYYHYYFVSYDSSATCDQHCKTLQVCAIMNLDSMSYDDCLKQHL,./data/raw/alphafold//AF-P70158-F1-model_v4.pdb,20,2488,2773,5618
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+493,19057,19342,MRPLLGALVGALALSTFVYAQSDFSSNCSSFVEAITLENVTVQSTEFVAAGTNISVYVPESCMSASYQVVSSNLCRATMNVSTSDRSGIRLEAWFPQNYTGRFLSTGNGGIGGCIQYSDLDYAASLGFAAVGANNGHDGMTGEPFLNNPDVITDFAWRSLHTGVIVGKQLVETFYGAPHNKSYYLGCSTGGRQGWKMVQDFPEDFDGVVAGAPAMAFNALLYWSGSFYTVTGTSDDPTFVPVDFWANNIHQAVLDQCDALDGATDGVLENPDLCDFDVTPLICADGNTTDCLTETQAETVRTVLSAIYDGNGTLVYPRLQPGAEVMAGQQQFNGQPFDITQDWYRYVIYNDSTWDPATLTLNDYAVALAQNPAGIETFNGDISAFEAAGGKVLHYHGLMDGLISSDNSKRYYSLVQQTMGKDSSELDDFYRFFPISGMSHCSGGDGAYRIGNMDGGAGTSADDNVLMSMVRWVEEGVAPEVVRGANANVTYWRSHCKWPLTNKYVGPGSYEDESAWQCS,brenda,D8QHC3,O.O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O>>O=C(O)/C=C/c1ccc(O)c(O)c1.O=C(O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](O)C1,6.6,0.0,37.0,7.5,3.1.1.73,5334.0,0.8195439355418687,O.O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O,O=C(O)/C=C/c1ccc(O)c(O)c1.O=C(O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](O)C1,0.8195439355418687,O.O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O__MRPLLGALVGALALSTFVYAQSDFSSNCSSFVEAITLENVTVQSTEFVAAGTNISVYVPESCMSASYQVVSSNLCRATMNVSTSDRSGIRLEAWFPQNYTGRFLSTGNGGIGGCIQYSDLDYAASLGFAAVGANNGHDGMTGEPFLNNPDVITDFAWRSLHTGVIVGKQLVETFYGAPHNKSYYLGCSTGGRQGWKMVQDFPEDFDGVVAGAPAMAFNALLYWSGSFYTVTGTSDDPTFVPVDFWANNIHQAVLDQCDALDGATDGVLENPDLCDFDVTPLICADGNTTDCLTETQAETVRTVLSAIYDGNGTLVYPRLQPGAEVMAGQQQFNGQPFDITQDWYRYVIYNDSTWDPATLTLNDYAVALAQNPAGIETFNGDISAFEAAGGKVLHYHGLMDGLISSDNSKRYYSLVQQTMGKDSSELDDFYRFFPISGMSHCSGGDGAYRIGNMDGGAGTSADDNVLMSMVRWVEEGVAPEVVRGANANVTYWRSHCKWPLTNKYVGPGSYEDESAWQCS,./data/raw/alphafold//AF-D8QHC3-F1-model_v4.pdb,3340,2202,3889,2760
+494,11096,11251,MDPKYQRVELNDGHFMPVLGFGTYAPPEVPRNRAVEVTKLAIEAGFRHIDSAYLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCTFFQPQMVQPALESSLKKLQLDYVDLYLLHFPMALKPGETPLPKDENGKVIFDTVDLSATWEVMEKCKDAGLAKSIGVSNFNCRQLEMILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAHSALGTQRHKLWVDPNSPVLLEDPVLCALAKKHKQTPALIALRYQLQRGVVVLAKSYNEQRIRENIQVFEFQLTSEDMKVLDGLNRNYRYVVMDFLMDHPDYPFSDEY,sabio,P17516,C[C@H](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.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>>C[C@H](O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C.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],240.0,1.0670472100722895e-14,25.0,7.0,1.1.1.357,9606.0,2.380211241711606,C[C@H](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.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,C[C@H](O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C.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],2.380211241711606,C[C@H](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.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__MDPKYQRVELNDGHFMPVLGFGTYAPPEVPRNRAVEVTKLAIEAGFRHIDSAYLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCTFFQPQMVQPALESSLKKLQLDYVDLYLLHFPMALKPGETPLPKDENGKVIFDTVDLSATWEVMEKCKDAGLAKSIGVSNFNCRQLEMILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAHSALGTQRHKLWVDPNSPVLLEDPVLCALAKKHKQTPALIALRYQLQRGVVVLAKSYNEQRIRENIQVFEFQLTSEDMKVLDGLNRNYRYVVMDFLMDHPDYPFSDEY,./data/raw/alphafold//AF-P17516-F1-model_v4.pdb,1329,1150,197,212
+495,8056,8184,MAMNVSTTIGLLNATSFASSSSINTVKILFVTLFISIVSTIVKLQKSAANKEGSKKLPLPPGPTPWPLIGNIPEMIRYRPTFRWIHQLMKDMNTDICLIRFGRTNFVPISCPVLAREILKKNDAIFSNRPKTLSAKSMSGGYLTTIVVPYNDQWKKMRKILTSEIISPARHKWLHDKRAEEADNLVFYIHNQFKANKNVNLRTATRHYGGNVIRKMVFSKRYFGKGMPDGGPGPEEIEHIDAVFTALKYLYGFCISDFLPFLLGLDLDGQEKFVLDANKTIRDYQNPLIDERIQQWKSGERKEMEDLLDVFITLKDSDGNPLLTPDEIKNQIAEIMIATVDNPSNAIEWAMGEMLNQPEILKKATEELDRVVGKDRLVQESDIPNLDYVKACAREAFRLHPVAHFNVPHVAMEDTVIGDYFIPKGSWAVLSRYGLGRNPKTWSDPLKYDPERHMNEGEVVLTEHELRFVTFSTGRRGCVASLLGSCMTTMLLARMLQCFTWTPPANVSKIDLAETLDELTPATPISAFAKPRLAPHLYPTSP,brenda,Q9M7B8,CC[C@H](C)[C@H](N)C(=O)O.O=O>>CC[C@H](C)/C=N/O.O.O=C=O,0.1,10000000.0,30.0,7.9,1.14.14.39,3983.0,-1.0,CC[C@H](C)[C@H](N)C(=O)O.O=O,CC[C@H](C)/C=N/O.O.O=C=O,-1.0,CC[C@H](C)[C@H](N)C(=O)O.O=O__MAMNVSTTIGLLNATSFASSSSINTVKILFVTLFISIVSTIVKLQKSAANKEGSKKLPLPPGPTPWPLIGNIPEMIRYRPTFRWIHQLMKDMNTDICLIRFGRTNFVPISCPVLAREILKKNDAIFSNRPKTLSAKSMSGGYLTTIVVPYNDQWKKMRKILTSEIISPARHKWLHDKRAEEADNLVFYIHNQFKANKNVNLRTATRHYGGNVIRKMVFSKRYFGKGMPDGGPGPEEIEHIDAVFTALKYLYGFCISDFLPFLLGLDLDGQEKFVLDANKTIRDYQNPLIDERIQQWKSGERKEMEDLLDVFITLKDSDGNPLLTPDEIKNQIAEIMIATVDNPSNAIEWAMGEMLNQPEILKKATEELDRVVGKDRLVQESDIPNLDYVKACAREAFRLHPVAHFNVPHVAMEDTVIGDYFIPKGSWAVLSRYGLGRNPKTWSDPLKYDPERHMNEGEVVLTEHELRFVTFSTGRRGCVASLLGSCMTTMLLARMLQCFTWTPPANVSKIDLAETLDELTPATPISAFAKPRLAPHLYPTSP,./data/raw/alphafold//AF-Q9M7B8-F1-model_v4.pdb,2915,1471,3040,1788
+496,19853,20139,MSIWRGSLPLFLLLLAAATAEPASMLEGPSGPVTVLLQEDRGHAVDLPDTDPRVQRRVTGWAPEQIAVALSAAPTSAWVSWITGDFQMGGAVKPLDPGTVGSVVRYGLAADSVVREATGDALVYSQLYPFEGLQNYTSGIIHHVRLQGLEPGTKYYYQCGDPAIPGAMSAVHAFRTMPAVGPRSYPGRIAVVGDLGLTYNTTSTVEHMASNQPDLVLLVGDVSYANLYLTNGTGTDCYSCSFAKSTPIHETYQPRWDYWGRYMEPVTSSTPMMVVEGNHEIEQQIGNKTFAAYSARFAFPSKESESFSPFYYSFDVGGIHFIMLAAYANYSKSGDQYRWLEKDLAKVDRSVTPWLVAGWHAPWYSTYKAHYREAECMRVAMEELLYSYGIDIVFTGHVHAYERSNRVFNYTLDPCGAVHISVGDGGNREKMATTHADEPGRCPEPLSTPDDFMGGFCAFNFTSGPAAGSFCWDRQPDYSAYRESSFGHGILEVKNETHALWKWHRNQDLYQGAVGDEIYIVREPGRCLLSSSIAAYF,brenda,C4PKL4,O.O=P(O)(O)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]2OP(=O)(O)OP(=O)(O)O[C@H]2[C@@H]1OP(=O)(O)O>>O=P(O)(O)O.O=P(O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O,253.0,1.3453316655153724,36.0,5.0,3.1.3.8,4513.0,2.403120521175818,O.O=P(O)(O)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]2OP(=O)(O)OP(=O)(O)O[C@H]2[C@@H]1OP(=O)(O)O,O=P(O)(O)O.O=P(O)(O)O[C@@H]1[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](O)[C@@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O,2.403120521175818,O.O=P(O)(O)O[C@@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]2OP(=O)(O)OP(=O)(O)O[C@H]2[C@@H]1OP(=O)(O)O__MSIWRGSLPLFLLLLAAATAEPASMLEGPSGPVTVLLQEDRGHAVDLPDTDPRVQRRVTGWAPEQIAVALSAAPTSAWVSWITGDFQMGGAVKPLDPGTVGSVVRYGLAADSVVREATGDALVYSQLYPFEGLQNYTSGIIHHVRLQGLEPGTKYYYQCGDPAIPGAMSAVHAFRTMPAVGPRSYPGRIAVVGDLGLTYNTTSTVEHMASNQPDLVLLVGDVSYANLYLTNGTGTDCYSCSFAKSTPIHETYQPRWDYWGRYMEPVTSSTPMMVVEGNHEIEQQIGNKTFAAYSARFAFPSKESESFSPFYYSFDVGGIHFIMLAAYANYSKSGDQYRWLEKDLAKVDRSVTPWLVAGWHAPWYSTYKAHYREAECMRVAMEELLYSYGIDIVFTGHVHAYERSNRVFNYTLDPCGAVHISVGDGGNREKMATTHADEPGRCPEPLSTPDDFMGGFCAFNFTSGPAAGSFCWDRQPDYSAYRESSFGHGILEVKNETHALWKWHRNQDLYQGAVGDEIYIVREPGRCLLSSSIAAYF,./data/raw/alphafold//AF-C4PKL4-F1-model_v4.pdb,1143,742,5269,6139
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+501,1545,1573,MSGQGKRLMVMAGGTGGHVFPGLAVAHHLMAQGWQVRWLGTADRMEADLVPKHGIEIDFIRISGLRGKGIKALIAAPLRIFNAWRQARAIMKAYKPDVVLGMGGYVSGPGGLAAWSLGIPVVLHEQNGIAGLTNKWLAKIATKVMQAFPGAFPNAEVVGNPVRTDVLALPLPQQRLAGREGPVRVLVVGGSQGARILNQTMPQVAAKLGDSVTIWHQSGKGSQQSVEQAYAEAGQPQHKVTEFIDDMAAAYAWADVVVCRSGALTVSEIAAAGLPALFVPFQHKDRQQYWNALPLEKAGAAKIIEQPQLSVDAVANTLAGWSRETLLTMAERARAASIPDATERVANEVSRVARA,sabio,P17443,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1O>>O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,2580.0,20.068226082353288,37.0,7.5,2.4.1.227,562.0,3.41161970596323,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1O,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,3.41161970596323,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1O__MSGQGKRLMVMAGGTGGHVFPGLAVAHHLMAQGWQVRWLGTADRMEADLVPKHGIEIDFIRISGLRGKGIKALIAAPLRIFNAWRQARAIMKAYKPDVVLGMGGYVSGPGGLAAWSLGIPVVLHEQNGIAGLTNKWLAKIATKVMQAFPGAFPNAEVVGNPVRTDVLALPLPQQRLAGREGPVRVLVVGGSQGARILNQTMPQVAAKLGDSVTIWHQSGKGSQQSVEQAYAEAGQPQHKVTEFIDDMAAAYAWADVVVCRSGALTVSEIAAAGLPALFVPFQHKDRQQYWNALPLEKAGAAKIIEQPQLSVDAVANTLAGWSRETLLTMAERARAASIPDATERVANEVSRVARA,./data/raw/alphafold//AF-P17443-F1-model_v4.pdb,1396,904,702,993
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+519,5788,5874,MTDSSLLRGCVRLVKIISLVACASTIVEAQAGPPDITKHVEVRRTAYGVPHIRADNMEAAGYGLGYVQIEDYGARVAMGLLHARGEMGRWFGPDSIEGDFSARLNYETAVQGYPTLDSDTRAIYDGFAEGVNRYIELHPEEFPGGFTPRFTGYDVLAHEVSDASARQAARFLGRIDPAARRRRAADENVAIIAPIAGGQDPPDVGSNAWAFAPSRTKSGHSILLRNPHLNWNSGYYEAQLTVPGVMDFYGDFRVGSPFGVVGGFNRDLGWSTTNNAPLLSQIYSLDVDSTQTDHYLLDGASIPLQRQLTSVEFRNGNGLSSETRETWRTTLGPVIYRGNGKVYVLKAAGDGDVRGGEQFLRMMRSHSLAEWKDAMRMRARITSNFTYADRAGNILYVWNASIPKLPLPSGGDTAAVPITRTSEAWTSFVPFDSLPQLLNPKGGYVENSNDPPYFTNLQQPLDRSKYPAYFPELRLGLRQQLALDLINNERKLNLQDVLALKQSYRMLLADRVRDDLVKEVRASNPSPDVAKAIDMIARWDKTVAPASRGGVLFEMWWRKYIDHTRPDTMYAVQWTAKAPASTPTGIRFPDRSVDAFKWAVDETTRRFGAPDVAWGDVHRVRVGKVDVPVGGCNGDIGCFRVLWYKDDPDGKREATGGDGWILAVQFDNEPQAYSILAYGESSREDSPHHSDQAAMFARGEMKRVYWMDKDVDAQTVERYRPGEKR,brenda,D6R1Q1,CC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)[C@H](N)c3ccccc3)[C@H]2SC1.O>>CC1=C(C(=O)O)N2C(=O)[C@@H](N)[C@H]2SC1.N[C@@H](C(=O)O)c1ccccc1,34.2,1.5534766339576572e-14,37.0,7.4,3.5.1.11,77133.0,1.534026106056135,CC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)[C@H](N)c3ccccc3)[C@H]2SC1.O,CC1=C(C(=O)O)N2C(=O)[C@@H](N)[C@H]2SC1.N[C@@H](C(=O)O)c1ccccc1,1.534026106056135,CC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)[C@H](N)c3ccccc3)[C@H]2SC1.O__MTDSSLLRGCVRLVKIISLVACASTIVEAQAGPPDITKHVEVRRTAYGVPHIRADNMEAAGYGLGYVQIEDYGARVAMGLLHARGEMGRWFGPDSIEGDFSARLNYETAVQGYPTLDSDTRAIYDGFAEGVNRYIELHPEEFPGGFTPRFTGYDVLAHEVSDASARQAARFLGRIDPAARRRRAADENVAIIAPIAGGQDPPDVGSNAWAFAPSRTKSGHSILLRNPHLNWNSGYYEAQLTVPGVMDFYGDFRVGSPFGVVGGFNRDLGWSTTNNAPLLSQIYSLDVDSTQTDHYLLDGASIPLQRQLTSVEFRNGNGLSSETRETWRTTLGPVIYRGNGKVYVLKAAGDGDVRGGEQFLRMMRSHSLAEWKDAMRMRARITSNFTYADRAGNILYVWNASIPKLPLPSGGDTAAVPITRTSEAWTSFVPFDSLPQLLNPKGGYVENSNDPPYFTNLQQPLDRSKYPAYFPELRLGLRQQLALDLINNERKLNLQDVLALKQSYRMLLADRVRDDLVKEVRASNPSPDVAKAIDMIARWDKTVAPASRGGVLFEMWWRKYIDHTRPDTMYAVQWTAKAPASTPTGIRFPDRSVDAFKWAVDETTRRFGAPDVAWGDVHRVRVGKVDVPVGGCNGDIGCFRVLWYKDDPDGKREATGGDGWILAVQFDNEPQAYSILAYGESSREDSPHHSDQAAMFARGEMKRVYWMDKDVDAQTVERYRPGEKR,./data/raw/alphafold//AF-D6R1Q1-F1-model_v4.pdb,1460,996,809,1127
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+521,9996,10146,MSTQIGGMSLDQARTQLAPWTQRAAPIGADEYQQRIERARVLMRAQGVDALLIGAGTSLRYFSGVPWGASERLVALLLTTEGDPVLICPAFEEGSLDAVLQLPVRKRLWEEHEDPYALVVQAMDEQHAHALALDPGIAFAVHTGLRAHLGTAIRDAGAIIDGCRMCKSPAELALMQQACDMTLLVQRLAAGIAHEGIGTDQLVRFIDEAHRALGADNGSTFCIVQFGHATAFPHGIPGVQHLRAGELVLIDTGCTVQGYHSDITRTWIYGTPSDAQQRIWELELAAQAAAFAAVRPGVACEAVDQAARAVLQAAGLGPDYRLPGLPHRTGHGCGLAIHEAPYLVRGNRQPLQPGMCASNEPMIVVPGAFGVRLEDHFYVTDTGAQWFTPPSVAIDQPFA,brenda,Q8P839,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]1CCCN1,9100.0,1.0731369217096672e-14,55.0,7.5,3.4.13.9,340.0,3.959041392321093,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]1CCCN1,3.959041392321093,CSCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)O.O__MSTQIGGMSLDQARTQLAPWTQRAAPIGADEYQQRIERARVLMRAQGVDALLIGAGTSLRYFSGVPWGASERLVALLLTTEGDPVLICPAFEEGSLDAVLQLPVRKRLWEEHEDPYALVVQAMDEQHAHALALDPGIAFAVHTGLRAHLGTAIRDAGAIIDGCRMCKSPAELALMQQACDMTLLVQRLAAGIAHEGIGTDQLVRFIDEAHRALGADNGSTFCIVQFGHATAFPHGIPGVQHLRAGELVLIDTGCTVQGYHSDITRTWIYGTPSDAQQRIWELELAAQAAAFAAVRPGVACEAVDQAARAVLQAAGLGPDYRLPGLPHRTGHGCGLAIHEAPYLVRGNRQPLQPGMCASNEPMIVVPGAFGVRLEDHFYVTDTGAQWFTPPSVAIDQPFA,./data/raw/alphafold//AF-Q8P839-F1-model_v4.pdb,1844,1533,3114,1879
+522,15209,15422,MSKAFDLVIIGAGSGGLEAGWNAATLYKKRVAVVDVQTVHGPPFFAALGGTCVNVGCVPKKLMVTGAQYMDQLRESAGFGWEFDASTIKANWKTLIAAKNAAVLDINKSYEDMFKDTEGLEFFLGWGALEQKNVVTVREGADPKSKVKERLQAEHIIIATGSWPQMLKIPGIEHCISSNEAFYLEEPPRRVLTVGGGFISVEFAGIFNAYKPVGGKVTLCYRNNPILRGFDYTLRQELTKQLVANGIDIMTNENPSKIELNPDGSKHVTFESGKTLDVDVVMMAIGRLPRTGYLQLQTVGVNLTDKGAIQVDEFSRTNVPNIYAIGDVTGRIMLTPVAINEGASVVDTIFGSKPRKTDHTRVASAVFSIPPIGTCGLTEEEAAKSFEKVAVYLSCFTPLMHNISGSKYKKFVAKIITDHGDGTVVGVHLLGDSSPEIIQAVGICMKLNAKISDFYNTIGVHPTSAEELCSMRTPSHYYIKGEKMETLPDSSL,sabio,P13110,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(CCC(=O)NC1CSSCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)NCCCNCCCCNC(=O)CNC1=O)C(=O)O.[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.NC(CCC(=O)NC(CS)C(=O)NCC(=O)NCCCCNCCCNC(=O)CNC(=O)C(CS)NC(=O)CCC(N)C(=O)O)C(=O)O,318000.0,7.740153835265826e-15,25.0,7.8,1.8.1.12,5692.0,5.502427119984433,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(CCC(=O)NC1CSSCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)NCCCNCCCCNC(=O)CNC1=O)C(=O)O.[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.NC(CCC(=O)NC(CS)C(=O)NCC(=O)NCCCCNCCCNC(=O)CNC(=O)C(CS)NC(=O)CCC(N)C(=O)O)C(=O)O,5.737192642704738,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(CCC(=O)NC1CSSCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)NCCCNCCCCNC(=O)CNC1=O)C(=O)O.[H]__MSKAFDLVIIGAGSGGLEAGWNAATLYKKRVAVVDVQTVHGPPFFAALGGTCVNVGCVPKKLMVTGAQYMDQLRESAGFGWEFDASTIKANWKTLIAAKNAAVLDINKSYEDMFKDTEGLEFFLGWGALEQKNVVTVREGADPKSKVKERLQAEHIIIATGSWPQMLKIPGIEHCISSNEAFYLEEPPRRVLTVGGGFISVEFAGIFNAYKPVGGKVTLCYRNNPILRGFDYTLRQELTKQLVANGIDIMTNENPSKIELNPDGSKHVTFESGKTLDVDVVMMAIGRLPRTGYLQLQTVGVNLTDKGAIQVDEFSRTNVPNIYAIGDVTGRIMLTPVAINEGASVVDTIFGSKPRKTDHTRVASAVFSIPPIGTCGLTEEEAAKSFEKVAVYLSCFTPLMHNISGSKYKKFVAKIITDHGDGTVVGVHLLGDSSPEIIQAVGICMKLNAKISDFYNTIGVHPTSAEELCSMRTPSHYYIKGEKMETLPDSSL,./data/raw/alphafold//AF-P13110-F1-model_v4.pdb,3758,4538,4467,4355
+523,3091,3133,MKIALVISFGLLLFTNMVCADDSLPELDIQKIEDGVYLYTAYEKIEGWGLVGSNGLVVLDNKNAYLIDTPISATDTEKLVKWIDAQGFTAKASISTHFHTDSTGGIAFLNSKSIPTYASKLTNQLLKNKGEEQATHSFGKNPYWLLKNKIEAFYPGAGHTPDNLVVWLPKQKILFGGCFVKPEGLGNLSHAVIAEWPASAEKLIARYSNATMVVPGHGKVGDASLLEKTRQRAVEALAAKK,brenda,A8R403,CC(C)(O/N=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@H]12)c1csc(=N)[nH]1)C(=O)[O-].O>>,118.0,99.82319723056142,30.0,8.0,3.5.2.6,546.0,2.071882007306125,CC(C)(O/N=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@H]12)c1csc(=N)[nH]1)C(=O)[O-].O,,2.071882007306125,CC(C)(O/N=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(C[n+]3ccccc3)CS[C@H]12)c1csc(=N)[nH]1)C(=O)[O-].O__MKIALVISFGLLLFTNMVCADDSLPELDIQKIEDGVYLYTAYEKIEGWGLVGSNGLVVLDNKNAYLIDTPISATDTEKLVKWIDAQGFTAKASISTHFHTDSTGGIAFLNSKSIPTYASKLTNQLLKNKGEEQATHSFGKNPYWLLKNKIEAFYPGAGHTPDNLVVWLPKQKILFGGCFVKPEGLGNLSHAVIAEWPASAEKLIARYSNATMVVPGHGKVGDASLLEKTRQRAVEALAAKK,./data/raw/alphafold//AF-A8R403-F1-model_v4.pdb,1448,1335,6262,1607
+524,14445,14648,MAQADIALIGLAVMGQNLILNMNDHGFVVCAFNRTVSKVDDFLANEAKGTKVLGAHSLEEMVSKLKKPRRIILLVKAGQAVDNFIEKLVPLLDIGDIIIDGGNSEYRDTMRRCRDLKDKGILFVGSGVSGGEDGARYGPSLMPGGNKEAWPHIKAIFQGIAAKVGTGEPCCDWVGDDGAGHFVKMVHNGIEYGDMQLICEAYHLMKDVLGLGHKEMAKAFEEWNKTELDSFLIEITASILKFQDADGKHLLPKIRDSAGQKGTGKWTAISALEYGVPVTLIGEAVFARCLSSLKDERIQASKKLKGPQNIPFEGDKKSFLEDIRKALYASKIISYAQGFMLLRQAATEFGWTLNYGGIALMWRGGCIIRSVFLGKIKDAFDRNPGLQNLLLDDFFKSAVENCQDSWRRAISTGVQAGIPMPCFTTALSFYDGYRHAMLPANLIQAQRDYFGAHTYELLAKPGQFIHTNWTGHGGSVSSSSYNA,brenda,P00349,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](O)[C@H](O)[C@H](O)[C@@H](O)CCP(=O)(O)O>>,0.53,99.90182324059884,20.0,8.0,1.1.1.44,9940.0,-0.2757241303992109,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](O)[C@H](O)[C@H](O)[C@@H](O)CCP(=O)(O)O,,-0.2757241303992109,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](O)[C@H](O)[C@H](O)[C@@H](O)CCP(=O)(O)O__MAQADIALIGLAVMGQNLILNMNDHGFVVCAFNRTVSKVDDFLANEAKGTKVLGAHSLEEMVSKLKKPRRIILLVKAGQAVDNFIEKLVPLLDIGDIIIDGGNSEYRDTMRRCRDLKDKGILFVGSGVSGGEDGARYGPSLMPGGNKEAWPHIKAIFQGIAAKVGTGEPCCDWVGDDGAGHFVKMVHNGIEYGDMQLICEAYHLMKDVLGLGHKEMAKAFEEWNKTELDSFLIEITASILKFQDADGKHLLPKIRDSAGQKGTGKWTAISALEYGVPVTLIGEAVFARCLSSLKDERIQASKKLKGPQNIPFEGDKKSFLEDIRKALYASKIISYAQGFMLLRQAATEFGWTLNYGGIALMWRGGCIIRSVFLGKIKDAFDRNPGLQNLLLDDFFKSAVENCQDSWRRAISTGVQAGIPMPCFTTALSFYDGYRHAMLPANLIQAQRDYFGAHTYELLAKPGQFIHTNWTGHGGSVSSSSYNA,./data/raw/alphafold//AF-P00349-F1-model_v4.pdb,2388,4786,4843,4689
+525,6923,7039,MSSLPGSREPLLRVAVTGGTHGNEMCGVYLARYWLQNPGELQRPSFSAMPVLANPAATAACCRYLDRDLNRSCTLTFLGSTATPDDPYEVKRARELNQLLGPKGTGQAFDFTLDLHNTTANTGVCLISESNISFNLHLCHYLQRQNPGMPCRLFLYEPAGTETFSVESISKNGICLEMGPQPQGVLRADLFSRMRALVASILDFIELFNQGMDLPAFEMDIYRNLGSVDFPRTADGDLAGTVHPQLQDHDFEPLRPGEPIFKLFSGEDVLYEGDSIVYPVFINEAAYYEKHVAFLKSEKIRVTVPALLRLTPRSTQTP,brenda,Q91XE4,CCCCCC(O)C(CC=O)SCC(N=C(C)O)C(=O)O.O>>,1.67,99.7045249055957,37.0,7.6,3.5.1.114,10090.0,0.2227164711475832,CCCCCC(O)C(CC=O)SCC(N=C(C)O)C(=O)O.O,,0.2227164711475832,CCCCCC(O)C(CC=O)SCC(N=C(C)O)C(=O)O.O__MSSLPGSREPLLRVAVTGGTHGNEMCGVYLARYWLQNPGELQRPSFSAMPVLANPAATAACCRYLDRDLNRSCTLTFLGSTATPDDPYEVKRARELNQLLGPKGTGQAFDFTLDLHNTTANTGVCLISESNISFNLHLCHYLQRQNPGMPCRLFLYEPAGTETFSVESISKNGICLEMGPQPQGVLRADLFSRMRALVASILDFIELFNQGMDLPAFEMDIYRNLGSVDFPRTADGDLAGTVHPQLQDHDFEPLRPGEPIFKLFSGEDVLYEGDSIVYPVFINEAAYYEKHVAFLKSEKIRVTVPALLRLTPRSTQTP,./data/raw/alphafold//AF-Q91XE4-F1-model_v4.pdb,2976,1691,3303,2103
+526,22314,22648,MILKTLSAPIILENSNSTFTFLPGGDNFEWIHESIMINAFQGNTLDGSTNNLYLRIYKDNSLAFYPLIGMNSKSTIKSGTSTLIFEGTAEDISYTVTFRLTPYGIWFWDISLSGNCNKADIIYSQDIGVGTKGSVNSNELYLAQYLGHSIFQGDYGYVICSRQNMAQGDLFPYLQQGSLGIRSIAYSTDGTQFFGLSYKKTNIPEALYGDLPSKNKQYELAHTALQTEAFSLSGTKQFSFYGICKTNHPEVIREIEYIQELEKAYAYHESGEILPVNVPTLQNIGAPYASSRWDAKQVEHYFPKRLLEEKEEEALLSFFTPEKSHVVLQDKELTTERPHGHILMTNFDVTKVPQGVVSSTNYMYGAFNCQFVVGNTTYNKLLSNHRGLLNIQKDSGQRIFIKIGDCYRQLTLPAAYEMNVAGSTWYYQLDEDVLIITSFAMYNRPEIVLKVQSLGHKKYDFIVTHQLTVGPNEYENEIKLTREGNILQLSPTDPVVTNHFYPELSFRMRIPEDCTLSDDSIFFHNNTTINPSLLSIEILQKSSFDIVMQGFDTGNVIPFLDQYDYKEQLEAYRIYYDQLVCNFKLSAPDKIPLSAEKLNAIIHWYAHDALIHFASPHGLEQSGGAAWGTRDVCQGPIEFFLTTGHFDLVRHILITLYSHQIEGGFEWPQWFMFDHYPIHQEDCHGDVVFWPLKAISDYIQATGDTSILNELVDYRTAKDALPTNQPETILIHIKRAVTTIKNRYLSGTALISYAGGDWDDTLQPANSELKENLVSAWTQALAEQTLELLCSAIKGIDHDFSKELSHMANDIRTSFYQYLIKDGVIAGFLYRESEEHMKYMLHPDDTESSIHYRLLPLTRSIIAQLADFKLATRNLEIIDEHLACPDGVRLMDHPASYSGGISKIFLRAEQAANVGREISLQYVHAHIRYIEALATMGLSKKAWDALMRINPILLTDYVPNALTRQSNVYFSSSEGCFDDRYEYAKNFDKLRTGDINVKGGWRLYSSGPGIYIRRIIADLLGIRFGHNVIHIDPVVTKELDGVTLQFTCFGKTVFFTYHVDDTMDKHICVKSNNNILPGDNLNNIYRDGGIQIAKDVFLSAAMSDNNFHIYVKN,brenda,A9KJS6,O=P(O)(O)O.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>>O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.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,55.0,9.427832468803784e-15,40.0,7.0,2.4.1.333,66219.0,1.740362689494244,O=P(O)(O)O.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,O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.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,1.7993405494535817,O=P(O)(O)O.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__MILKTLSAPIILENSNSTFTFLPGGDNFEWIHESIMINAFQGNTLDGSTNNLYLRIYKDNSLAFYPLIGMNSKSTIKSGTSTLIFEGTAEDISYTVTFRLTPYGIWFWDISLSGNCNKADIIYSQDIGVGTKGSVNSNELYLAQYLGHSIFQGDYGYVICSRQNMAQGDLFPYLQQGSLGIRSIAYSTDGTQFFGLSYKKTNIPEALYGDLPSKNKQYELAHTALQTEAFSLSGTKQFSFYGICKTNHPEVIREIEYIQELEKAYAYHESGEILPVNVPTLQNIGAPYASSRWDAKQVEHYFPKRLLEEKEEEALLSFFTPEKSHVVLQDKELTTERPHGHILMTNFDVTKVPQGVVSSTNYMYGAFNCQFVVGNTTYNKLLSNHRGLLNIQKDSGQRIFIKIGDCYRQLTLPAAYEMNVAGSTWYYQLDEDVLIITSFAMYNRPEIVLKVQSLGHKKYDFIVTHQLTVGPNEYENEIKLTREGNILQLSPTDPVVTNHFYPELSFRMRIPEDCTLSDDSIFFHNNTTINPSLLSIEILQKSSFDIVMQGFDTGNVIPFLDQYDYKEQLEAYRIYYDQLVCNFKLSAPDKIPLSAEKLNAIIHWYAHDALIHFASPHGLEQSGGAAWGTRDVCQGPIEFFLTTGHFDLVRHILITLYSHQIEGGFEWPQWFMFDHYPIHQEDCHGDVVFWPLKAISDYIQATGDTSILNELVDYRTAKDALPTNQPETILIHIKRAVTTIKNRYLSGTALISYAGGDWDDTLQPANSELKENLVSAWTQALAEQTLELLCSAIKGIDHDFSKELSHMANDIRTSFYQYLIKDGVIAGFLYRESEEHMKYMLHPDDTESSIHYRLLPLTRSIIAQLADFKLATRNLEIIDEHLACPDGVRLMDHPASYSGGISKIFLRAEQAANVGREISLQYVHAHIRYIEALATMGLSKKAWDALMRINPILLTDYVPNALTRQSNVYFSSSEGCFDDRYEYAKNFDKLRTGDINVKGGWRLYSSGPGIYIRRIIADLLGIRFGHNVIHIDPVVTKELDGVTLQFTCFGKTVFFTYHVDDTMDKHICVKSNNNILPGDNLNNIYRDGGIQIAKDVFLSAAMSDNNFHIYVKN,./data/raw/alphafold//AF-A9KJS6-F1-model_v4.pdb,773,199,5940,6857
+527,879,904,MAAILASTPSQLNSYCHFISSKLCPSFSLSLRQSNRKTIGYSPVSSRIRLRVFANSQSAPASVVTSEVASVPSEMKAWVYGEYGGVDVLKFDSSVSVPEVKEDQVLIKVVAAALNPVDGKRMLGKFKATDSPLPTVPGYDVAGVVVKVGSQVKELKEGDEVYGNINEKALDGPKQFGSLAEYTAVEEKLLAVKPKNIDFVQAAGLPLAIETAYEGLEKTNFSTGKSILVLNGAGGVGSLVIQLAKNVFGASKVAATASTGKLEFLKSLGVDLAIDYTKENIEDLPEKFDVVYDAIGQCDKAVKVVKKGGSVVALTGAVTPPGFRFVVTSDGAVLKKLNPYLESGKVKPIVDPKGPFSFSQVVEAFAYVESSRATGKVVIHPIP,sabio,E2S0A5,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.[H]>>CCC=O.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)c1,75.0,0.0,,7.0,1.3.1.-,3659.0,1.8750612633917,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.[H],CCC=O.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)c1,1.8750612633917,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.[H]__MAAILASTPSQLNSYCHFISSKLCPSFSLSLRQSNRKTIGYSPVSSRIRLRVFANSQSAPASVVTSEVASVPSEMKAWVYGEYGGVDVLKFDSSVSVPEVKEDQVLIKVVAAALNPVDGKRMLGKFKATDSPLPTVPGYDVAGVVVKVGSQVKELKEGDEVYGNINEKALDGPKQFGSLAEYTAVEEKLLAVKPKNIDFVQAAGLPLAIETAYEGLEKTNFSTGKSILVLNGAGGVGSLVIQLAKNVFGASKVAATASTGKLEFLKSLGVDLAIDYTKENIEDLPEKFDVVYDAIGQCDKAVKVVKKGGSVVALTGAVTPPGFRFVVTSDGAVLKKLNPYLESGKVKPIVDPKGPFSFSQVVEAFAYVESSRATGKVVIHPIP,./data/raw/alphafold//AF-E2S0A5-F1-model_v4.pdb,1041,592,257,279
+528,22029,22361,MGTEVKATRTVVSLRKFHISEEYGFILPEPLMDLPVYYKPWMDIGRNVTELISSHSLRLRIHNMPLLTTDLLRTHRELRLAHLTLSVMAMGYVWQEGEKETVKMLPQTLSVPFCDVSRRLGLPPILIHADTVLANWKKTNPNGPFTMENLELLLSLPGGQSLRGFFLVTLLVELAAVPGLKAIIDVINGVHYNDIERVTKALDVICQSIDSMKQALKRMHEYVDPSIFYGVIRIFLSGWKDNPSMAEGLVYEGVDDQPMEFSGGSAAQSSILHCLDELLGIQHEGNNGAFLKRMRDYMPPSHKQFIQEISICPSLRDFVLQQADERLTHAFDKCVAGLVDFRNCHINIVTRFITIPASRAKQLRANKQNLMEELDTISRAPTALEERGTGGSGIMTFLKTVRNETKDSSISVFTNGNQEPPMEEIEKSASELTIE,sabio,A2Q0R5,O=O.O=O>>NC(CC(=O)c1ccccc1NC=O)C(=O)O,4158.0,57.17724078174639,37.0,6.5,1.13.11.52,7955.0,3.6188844849954505,O=O.O=O,NC(CC(=O)c1ccccc1NC=O)C(=O)O,3.6188844849954505,O=O.O=O__MGTEVKATRTVVSLRKFHISEEYGFILPEPLMDLPVYYKPWMDIGRNVTELISSHSLRLRIHNMPLLTTDLLRTHRELRLAHLTLSVMAMGYVWQEGEKETVKMLPQTLSVPFCDVSRRLGLPPILIHADTVLANWKKTNPNGPFTMENLELLLSLPGGQSLRGFFLVTLLVELAAVPGLKAIIDVINGVHYNDIERVTKALDVICQSIDSMKQALKRMHEYVDPSIFYGVIRIFLSGWKDNPSMAEGLVYEGVDDQPMEFSGGSAAQSSILHCLDELLGIQHEGNNGAFLKRMRDYMPPSHKQFIQEISICPSLRDFVLQQADERLTHAFDKCVAGLVDFRNCHINIVTRFITIPASRAKQLRANKQNLMEELDTISRAPTALEERGTGGSGIMTFLKTVRNETKDSSISVFTNGNQEPPMEEIEKSASELTIE,./data/raw/alphafold//AF-A2Q0R5-F1-model_v4.pdb,2630,5115,2244,5128
+529,17733,17976,MRLIPLTTAEQVGKWAARHIVNRINAFKPTADRPFVLGLPTGGTPMTTYKALVEMHKAGQVSFKHVVTFNMDEYVGLPKEHPESYYSFMHRNFFDHVDIPAENINLLNGNAPDIDAECRQYEEKIRSYGKIHLFMGGVGNDGHIAFNEPASSLASRTRIKTLTHDTRVANSRFFDNDVNQVPKYALTVGVGTLLDAEEVMILVLGSQKALALQAAVEGCVNHMWTISCLQLHPKAIMVCDEPSTMELKVKTLRYFNELEAENIKGL,brenda,P0A759,N[C@H]1C(O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O.O>>N.O=P(O)(O)OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,2.0,0.0,30.0,7.5,3.5.99.6,562.0,0.3010299956639812,N[C@H]1C(O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O.O,N.O=P(O)(O)OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,2.204119982655925,N[C@H]1C(O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@@H]1O.O__MRLIPLTTAEQVGKWAARHIVNRINAFKPTADRPFVLGLPTGGTPMTTYKALVEMHKAGQVSFKHVVTFNMDEYVGLPKEHPESYYSFMHRNFFDHVDIPAENINLLNGNAPDIDAECRQYEEKIRSYGKIHLFMGGVGNDGHIAFNEPASSLASRTRIKTLTHDTRVANSRFFDNDVNQVPKYALTVGVGTLLDAEEVMILVLGSQKALALQAAVEGCVNHMWTISCLQLHPKAIMVCDEPSTMELKVKTLRYFNELEAENIKGL,./data/raw/alphafold//AF-P0A759-F1-model_v4.pdb,2691,3789,2368,5270
+530,10719,10874,MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGANADAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFSGKNAGQVVLHSFKAGLAENMVPESATAVISGAKDLEAALEKFVAEHASKNLRFDLEEADGKATITLYGKSAHGAMPEKGINGATYLTLFLNQFDFADGAAAFIKVGAEKLLEDHEGEKLGTAFVDELMENTSMNAGVWSFDENGEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHTPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELAK,sabio,Q84BV1,C[C@H](N)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=O)O.O>>CC(N)C(=O)O.NC(Cc1ccc(O)cc1)C(=O)O,922.0,1.0496042775783007e-14,37.0,7.5,3.4.13.-,1359.0,2.964730921053629,C[C@H](N)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=O)O.O,CC(N)C(=O)O.NC(Cc1ccc(O)cc1)C(=O)O,2.964730921053629,C[C@H](N)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=O)O.O__MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGANADAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFSGKNAGQVVLHSFKAGLAENMVPESATAVISGAKDLEAALEKFVAEHASKNLRFDLEEADGKATITLYGKSAHGAMPEKGINGATYLTLFLNQFDFADGAAAFIKVGAEKLLEDHEGEKLGTAFVDELMENTSMNAGVWSFDENGEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHTPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELAK,./data/raw/alphafold//AF-Q84BV1-F1-model_v4.pdb,1801,1476,3046,1795
+531,8714,8851,MKAVVVPGKQKGYRIEEVSDPIPGKDEVVIRVNRAALCYRDLLQLQGFYPRMKYPVILGHEVVGTIEQIGENAKGFKEGDKVISLLYAPDGTCHYCQMGEEAYCHSRVGYSEELDGFFAEKAKVKVTSIVKVGTNVPDEGAVLVPCVTGMVYRSLRRAKLQKGETVLVTGASGGVGIHAIQVAKALGAKVIGVTTSEEKAAFIRKFADHVIVGSKFSEEAKKIGDVNVVIDTVGTPTIDESLKSLWMGGRLVQIGNVDPTQIYQLRLGYVILKDIAIIGHASATKRDAEETLKLTGEGKINPVIAATVGLDEIDKGYEILKDKHKIGKVLVKP,uniprot_search,Q9UXF1,CO.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>>C=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+],3.1,0.0,65.0,8.0,1.1.1.1,2287.0,0.4913616938342727,CO.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,C=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+],0.4913616938342727,CO.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__MKAVVVPGKQKGYRIEEVSDPIPGKDEVVIRVNRAALCYRDLLQLQGFYPRMKYPVILGHEVVGTIEQIGENAKGFKEGDKVISLLYAPDGTCHYCQMGEEAYCHSRVGYSEELDGFFAEKAKVKVTSIVKVGTNVPDEGAVLVPCVTGMVYRSLRRAKLQKGETVLVTGASGGVGIHAIQVAKALGAKVIGVTTSEEKAAFIRKFADHVIVGSKFSEEAKKIGDVNVVIDTVGTPTIDESLKSLWMGGRLVQIGNVDPTQIYQLRLGYVILKDIAIIGHASATKRDAEETLKLTGEGKINPVIAATVGLDEIDKGYEILKDKHKIGKVLVKP,./data/raw/alphafold//AF-Q9UXF1-F1-model_v4.pdb,1320,3884,6201,862
+532,22685,23025,MKYQLFLSLALCVGLGASAQTLPYQNPNLSAKERAVDLCSRLTLEEKAMLMLDESPAIPRLGIKKFFWWSEALHGAANMGNVTNFPEPVGMAASFNPHLLFKVFDIASTEFRAQYNHRMYDLNGEDMKMRSLSVWTPNVNIFRDPRWGRGQETYGEDPYLTSVMGVQVVKGLQGPEDARYRKLWACAKHYAVHSGPEYTRHTANLTDVSARDFWETYMPAFKTLVKDAKVREVMCAYQRLDDDPCCGSTRLLQQILRDEWGFEYLVVSDCGAVSDFYENHKSSSDAVHGTSKAVLAGTDVECGFNYAYKSLPEAVRKGLLSEKEVDKHVIRLLEGRFDLGEMDDPSLVEWSKIPYSAMSTKASANVALDMARQTIVLLQNKNNILPLKKNAEKIAIIGPNAHNEPMMWGNYNGTPNHTVTILDGVKAKQKKLVYIPGCDLTNDKVMECHLATDCVTPDGKKGLKGTFWNNTEMAGKPFTTEYYTKPVNVTTAGMHVFAPNLPIEDFSAKYETTFTAKEAGEYVVNVESTGHFELYVNGKQQFVNHIWRATPTRTVLKAEKGQKFDIEVRFQTVKTWGASMKIDVARELNIDYQETIAQLKGINKVIFCGGIAPSLEGEEMPVNIEGFKGGDRTSIELPKVQREFLKALKAAGKQVIYVNCSGSAIALQPETESCDAIVQAWYPGQEGGTAVADVLFGDYNPGGKLSVTFYKNDQQLPDYEDYSMKGRTYRYFDDALFPFGYGLSYTTFEVGEAKVEAATDGALYNVQIPVTNTGTKNGSETIQLYIRNLQDPDGPLKSLRGFERLDIKAGKTATANLKLTKESLEFWDAETNTMRTKPGKYEILYGTSSLDKDLKKLTITL,brenda,D5EY15,O=[N+]([O-])c1ccc(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1.O[C@@H]1[C@@H](O)[C@H](O[C@@H]2CO[C@@H](O)[C@H](O)[C@H]2O)OC[C@H]1O>>O=[N+]([O-])c1ccc(O)cc1.O[C@@H]1[C@@H](O)[C@H](O[C@@H]2CO[C@@H](O[C@@H]3CO[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)OC[C@H]1O,9.7,0.0,37.0,5.0,3.2.1.37,839.0,0.9867717342662448,O=[N+]([O-])c1ccc(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1.O[C@@H]1[C@@H](O)[C@H](O[C@@H]2CO[C@@H](O)[C@H](O)[C@H]2O)OC[C@H]1O,O=[N+]([O-])c1ccc(O)cc1.O[C@@H]1[C@@H](O)[C@H](O[C@@H]2CO[C@@H](O[C@@H]3CO[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)OC[C@H]1O,0.9867717342662448,O=[N+]([O-])c1ccc(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1.O[C@@H]1[C@@H](O)[C@H](O[C@@H]2CO[C@@H](O)[C@H](O)[C@H]2O)OC[C@H]1O__MKYQLFLSLALCVGLGASAQTLPYQNPNLSAKERAVDLCSRLTLEEKAMLMLDESPAIPRLGIKKFFWWSEALHGAANMGNVTNFPEPVGMAASFNPHLLFKVFDIASTEFRAQYNHRMYDLNGEDMKMRSLSVWTPNVNIFRDPRWGRGQETYGEDPYLTSVMGVQVVKGLQGPEDARYRKLWACAKHYAVHSGPEYTRHTANLTDVSARDFWETYMPAFKTLVKDAKVREVMCAYQRLDDDPCCGSTRLLQQILRDEWGFEYLVVSDCGAVSDFYENHKSSSDAVHGTSKAVLAGTDVECGFNYAYKSLPEAVRKGLLSEKEVDKHVIRLLEGRFDLGEMDDPSLVEWSKIPYSAMSTKASANVALDMARQTIVLLQNKNNILPLKKNAEKIAIIGPNAHNEPMMWGNYNGTPNHTVTILDGVKAKQKKLVYIPGCDLTNDKVMECHLATDCVTPDGKKGLKGTFWNNTEMAGKPFTTEYYTKPVNVTTAGMHVFAPNLPIEDFSAKYETTFTAKEAGEYVVNVESTGHFELYVNGKQQFVNHIWRATPTRTVLKAEKGQKFDIEVRFQTVKTWGASMKIDVARELNIDYQETIAQLKGINKVIFCGGIAPSLEGEEMPVNIEGFKGGDRTSIELPKVQREFLKALKAAGKQVIYVNCSGSAIALQPETESCDAIVQAWYPGQEGGTAVADVLFGDYNPGGKLSVTFYKNDQQLPDYEDYSMKGRTYRYFDDALFPFGYGLSYTTFEVGEAKVEAATDGALYNVQIPVTNTGTKNGSETIQLYIRNLQDPDGPLKSLRGFERLDIKAGKTATANLKLTKESLEFWDAETNTMRTKPGKYEILYGTSSLDKDLKKLTITL,./data/raw/alphafold//AF-D5EY15-F1-model_v4.pdb,824,271,6022,6951
+533,13191,13366,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.O=C1Nc2ccccc2C1=O.[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)c1,0.65,10.08427849427832,25.0,7.4,1.1.1.239,9986.0,-0.1870866433571444,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.O=C1Nc2ccccc2C1=O.[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,-0.1870866433571444,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.O=C1Nc2ccccc2C1=O.[H+]__MDPKHQRAALNDGHSIPVLGLGTYAPDAVPKSEAGEATKIAIDVGYRHIDSSHAYQNEEEVGLAIRSKITDGTVKREDIFYTSKLWCTFFRPELVRTGLEQSLKKLQLDYVDLYLMHYPAAMKPGKELYPKDEQGKIMHDTVDICATWEAMEKCKDAGLAKSIGVSNFNHRQLEMILSKPGLKYKPVCNQVECHLYLNQSKLLDFCKSKDIVLVAYGALGSSRDPKWVDQSYPVLLEDPVICALAKKHKRSPALIALRYQLQRGVVVLAKSFIEKEIKENIQVFEFQLSSEDMKALDGLNKNLRYYPADL,./data/raw/alphafold//AF-G1T465-F1-model_v4.pdb,1329,1150,6188,841
+534,17348,17581,MNYPAEPFRIKSVETVSMIPRDERLKKMQEAGYNTFLLNSKDIYIDLLTDSGTNAMSDKQWAGMMMGDEAYAGSENFYHLERTVQELFGFKHIVPTHQGRGAENLLSQLAIKPGQYVAGNMYFTTTRYHQEKNGAVFVDIVRDEAHDAGLNIAFKGDIDLKKLQKLIDEKGAENIAYICLAVTVNLAGGQPVSMANMRAVRELTEAHGIKVFYDATRCVENAYFIKEQEQGFENKSIAEIVHEMFSYADGCTMSGKKDCLVNIGGFLCMNDDEMFSSAKELVVVYEGMPSYGGLAGRDMEAMAIGLREAMQYEYIEHRVKQVRYLGDKLKAAGVPIVEPVGGHAVFLDARRFCEHLTQDEFPAQSLAASIYVETGVRSMERGIISAGRNNVTGEHHRPKLETVRLTIPRRVYTYAHMDVVADGIIKLYQHKEDIRGLKFIYEPKQLRFFTARFDYI,brenda,P31013,N[C@@H](COC(=O)c1ccccc1)C(=O)O.O>>,8.3,99.56181862796647,27.5,8.0,4.1.99.2,546.0,0.919078092376074,N[C@@H](COC(=O)c1ccccc1)C(=O)O.O,,0.919078092376074,N[C@@H](COC(=O)c1ccccc1)C(=O)O.O__MNYPAEPFRIKSVETVSMIPRDERLKKMQEAGYNTFLLNSKDIYIDLLTDSGTNAMSDKQWAGMMMGDEAYAGSENFYHLERTVQELFGFKHIVPTHQGRGAENLLSQLAIKPGQYVAGNMYFTTTRYHQEKNGAVFVDIVRDEAHDAGLNIAFKGDIDLKKLQKLIDEKGAENIAYICLAVTVNLAGGQPVSMANMRAVRELTEAHGIKVFYDATRCVENAYFIKEQEQGFENKSIAEIVHEMFSYADGCTMSGKKDCLVNIGGFLCMNDDEMFSSAKELVVVYEGMPSYGGLAGRDMEAMAIGLREAMQYEYIEHRVKQVRYLGDKLKAAGVPIVEPVGGHAVFLDARRFCEHLTQDEFPAQSLAASIYVETGVRSMERGIISAGRNNVTGEHHRPKLETVRLTIPRRVYTYAHMDVVADGIIKLYQHKEDIRGLKFIYEPKQLRFFTARFDYI,./data/raw/alphafold//AF-P31013-F1-model_v4.pdb,1307,3734,1536,3506
+535,19563,19849,MLPRLICINDYEQHAKSVLPKSIYDYYRSGANDEETLADNIAAFSRWKLYPRMLRNVAETDLSTSVLGQRVSMPICVGATAMQRMAHVDGELATVRACQSLGTGMMLSSWATSSIEEVAEAGPEALRWLQLYIYKDREVTKKLVRQAEKMGYKAIFVTVDTPYLGNRLDDVRNRFKLPPQLRMKNFETSTLSFSPEENFGDDSGLAAYVAKAIDPSISWEDIKWLRRLTSLPIVAKGILRGDDAREAVKHGLNGILVSNHGARQLDGVPATIDVLPEIVEAVEGKVEVFLDGGVRKGTDVLKALALGAKAVFVGRPIVWGLAFQGEKGVQDVLEILKEEFRLAMALSGCQNVKVIDKTLVRKNPLAVSKI,sabio,Q9UJM8,O.O=CC(=O)O.O=O>>O=C(O)C(=O)O.OO,0.7,0.0,37.0,7.5,1.1.3.15,9606.0,-0.1549019599857432,O.O=CC(=O)O.O=O,O=C(O)C(=O)O.OO,-0.1549019599857432,O.O=CC(=O)O.O=O__MLPRLICINDYEQHAKSVLPKSIYDYYRSGANDEETLADNIAAFSRWKLYPRMLRNVAETDLSTSVLGQRVSMPICVGATAMQRMAHVDGELATVRACQSLGTGMMLSSWATSSIEEVAEAGPEALRWLQLYIYKDREVTKKLVRQAEKMGYKAIFVTVDTPYLGNRLDDVRNRFKLPPQLRMKNFETSTLSFSPEENFGDDSGLAAYVAKAIDPSISWEDIKWLRRLTSLPIVAKGILRGDDAREAVKHGLNGILVSNHGARQLDGVPATIDVLPEIVEAVEGKVEVFLDGGVRKGTDVLKALALGAKAVFVGRPIVWGLAFQGEKGVQDVLEILKEEFRLAMALSGCQNVKVIDKTLVRKNPLAVSKI,./data/raw/alphafold//AF-Q9UJM8-F1-model_v4.pdb,663,1839,3467,2275
+536,11602,11760,MSGADRSPNAGAAPDSAPGQAAVASAYQRFEPRAYLRNNYAPPRGDLCNPNGVGPWKLRCLAQTFATGEVSGRTLIDIGSGPTVYQLLSACSHFEDITMTDFLEVNRQELGRWLQEEPGAFNWSMYSQHACLIEGKGECWQDKERQLRARVKRVLPIDVHQPQPLGAGSPAPLPADALVSAFCLEAVSPDLASFQRALDHITTLLRPGGHLLLIGALEESWYLAGEARLTVVPVSEEEVREALVRSGYKVRDLRTYIMPAHLQTGVDDVKGVFFAWAQKVGL,brenda,P11086,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.N[C@H]1CCc2ccccc2[C@H]1O>>CN[C@H]1CCc2ccccc2[C@H]1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,0.0048,0.0895730882632629,30.0,8.0,2.1.1.28,9606.0,-2.318758762624413,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.N[C@H]1CCc2ccccc2[C@H]1O,CN[C@H]1CCc2ccccc2[C@H]1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,-2.318758762624413,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.N[C@H]1CCc2ccccc2[C@H]1O__MSGADRSPNAGAAPDSAPGQAAVASAYQRFEPRAYLRNNYAPPRGDLCNPNGVGPWKLRCLAQTFATGEVSGRTLIDIGSGPTVYQLLSACSHFEDITMTDFLEVNRQELGRWLQEEPGAFNWSMYSQHACLIEGKGECWQDKERQLRARVKRVLPIDVHQPQPLGAGSPAPLPADALVSAFCLEAVSPDLASFQRALDHITTLLRPGGHLLLIGALEESWYLAGEARLTVVPVSEEEVREALVRSGYKVRDLRTYIMPAHLQTGVDDVKGVFFAWAQKVGL,./data/raw/alphafold//AF-P11086-F1-model_v4.pdb,3861,3986,1830,3647
+537,10419,10572,MELPNIMHPVAKLSTALAAALMLSGCMPGEIRPTIGQQMETGDQRFGDLVFRQLAPNVWQHTSYLDMPGFGAVASNGLIVRDGGRVLVVDTAWTNDQTAQILNWIKQEINLPVALAVVTHAHQDKMGGMDALHAAGIATYANALSNQLAPQEGMVAAQHSLTFAANGWVEPATAPNFGPLKVFYPGPGHTSDNITVGIDGTDIAFGGCLIKDSKAKSLGNLGDADTEHYAASARAFGAAFPKASMIVMSHSAPDSRAAITHTARMADKLR,brenda,I3VKD5,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.O>>,238.0,99.75154353578397,25.0,7.2,3.5.2.6,562.0,2.376576957056512,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.O,,2.376576957056512,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.O__MELPNIMHPVAKLSTALAAALMLSGCMPGEIRPTIGQQMETGDQRFGDLVFRQLAPNVWQHTSYLDMPGFGAVASNGLIVRDGGRVLVVDTAWTNDQTAQILNWIKQEINLPVALAVVTHAHQDKMGGMDALHAAGIATYANALSNQLAPQEGMVAAQHSLTFAANGWVEPATAPNFGPLKVFYPGPGHTSDNITVGIDGTDIAFGGCLIKDSKAKSLGNLGDADTEHYAASARAFGAAFPKASMIVMSHSAPDSRAAITHTARMADKLR,./data/raw/alphafold//AF-I3VKD5-F1-model_v4.pdb,1454,984,793,1104
+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
+539,8775,8912,MVTVFGILNLTEDSFF,brenda,Q704U4,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(=N)[nH]1.O>>,1.1,99.78924695830672,25.0,7.0,3.5.2.6,287.0,0.041392685158225,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(=N)[nH]1.O,,0.041392685158225,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(=N)[nH]1.O__MVTVFGILNLTEDSFF,./data/raw/alphafold//AF-Q704U4-F1-model_v4.pdb,1461,997,812,1131
+540,9799,9948,MNRREFLLTAGAVATGAGRSLVVPARLEAAAKADHTIRIAPVSFEIAPGKTIQTTGYNGKVPGPLLRMKEGKPVTVDVFNDTSSPEFLHWHGMYLSTKADGAEEEGSPVIPPHGHLRVSFTPKPAGTRWYHTHSMAMDDVTKGAYSGQFGFLYVEPKTDPGHYDQEIFLASRHWEPKIIHRGEPNNDWNLDYASATLGERSLGHGEPIRVKKGQRVLFRLLNANATRDVNLALAGHQFKVVALDGNPVPNPANVDILQLVVAERVDAVVEMNNPGVWILGSPRDDERARGLGIVVEYENEKGEPQWKTLPNTPFDYTLFGNPPAANPQPVEGSFDLSFHMLPDEGHAFNKWVVNDKVWPNTDPLMVKAGKRYRLVMHSGHEDSHPVHLHRHSFEIVKVGDKRTSGIFKDVVRVQRDNSTEVEFVADNPGNSLLHCHMQQHMDYGFKTLVKYS,sabio,A0A249JLA1,COc1cccc(OC)c1O.O=O>>O,6.7,81.95225608983418,25.0,4.0,1.10.3.2,204434.0,0.8260748027008264,COc1cccc(OC)c1O.O=O,O,0.8260748027008264,COc1cccc(OC)c1O.O=O__MNRREFLLTAGAVATGAGRSLVVPARLEAAAKADHTIRIAPVSFEIAPGKTIQTTGYNGKVPGPLLRMKEGKPVTVDVFNDTSSPEFLHWHGMYLSTKADGAEEEGSPVIPPHGHLRVSFTPKPAGTRWYHTHSMAMDDVTKGAYSGQFGFLYVEPKTDPGHYDQEIFLASRHWEPKIIHRGEPNNDWNLDYASATLGERSLGHGEPIRVKKGQRVLFRLLNANATRDVNLALAGHQFKVVALDGNPVPNPANVDILQLVVAERVDAVVEMNNPGVWILGSPRDDERARGLGIVVEYENEKGEPQWKTLPNTPFDYTLFGNPPAANPQPVEGSFDLSFHMLPDEGHAFNKWVVNDKVWPNTDPLMVKAGKRYRLVMHSGHEDSHPVHLHRHSFEIVKVGDKRTSGIFKDVVRVQRDNSTEVEFVADNPGNSLLHCHMQQHMDYGFKTLVKYS,./data/raw/alphafold//AF-A0A249JLA1-F1-model_v4.pdb,3405,2295,3999,2891
+541,22515,22852,MPLVSMKEMLIDAKENGYAVGQYNINNLEFTQAILEASQEENAPVILGVSEGAARYMSGFYTIVKMVEGLMHDLNITIPVAIHLDHGSSFEKCKEAIDAGFTSVMIDASHSPFEENVATTKKVVEYAHEKGVSVEAELGTVGGQEDDVVADGIIYADPKECQELVEKTGIDALAPALGSVHGPYKGEPKLGFKEMEEIGLSTGLPLVLHGGTGIPTKDIQKAIPFGTAKINVNTENQIASAKAVRDVLNNDKEVYDPRKYLGPAREAIKETVKGKIKEFGTSNRAK,brenda,Q5HE75,O=P(O)(O)OC[C@H]1O[C@](O)(COP(=O)(O)O)[C@@H](O)[C@@H]1O>>O=C(CO)COP(=O)(O)O.O=C[C@H](O)COP(=O)(O)O,1.16,8.344257555591964e-15,25.0,7.8,4.1.2.13,1280.0,0.0644579892269184,O=P(O)(O)OC[C@H]1O[C@](O)(COP(=O)(O)O)[C@@H](O)[C@@H]1O,O=C(CO)COP(=O)(O)O.O=C[C@H](O)COP(=O)(O)O,0.0644579892269184,O=P(O)(O)OC[C@H]1O[C@](O)(COP(=O)(O)O)[C@@H](O)[C@@H]1O__MPLVSMKEMLIDAKENGYAVGQYNINNLEFTQAILEASQEENAPVILGVSEGAARYMSGFYTIVKMVEGLMHDLNITIPVAIHLDHGSSFEKCKEAIDAGFTSVMIDASHSPFEENVATTKKVVEYAHEKGVSVEAELGTVGGQEDDVVADGIIYADPKECQELVEKTGIDALAPALGSVHGPYKGEPKLGFKEMEEIGLSTGLPLVLHGGTGIPTKDIQKAIPFGTAKINVNTENQIASAKAVRDVLNNDKEVYDPRKYLGPAREAIKETVKGKIKEFGTSNRAK,./data/raw/alphafold//AF-Q5HE75-F1-model_v4.pdb,558,3267,5575,6927
+542,10632,10787,MEKGDTHILVFPFPSQGHINPLLQLSKRLIAKGIKVSLVTTLHVSNHLQLQGAYSNSVKIEVISDGSEDRLETDTMRQTLDRFRQKMTKNLEDFLQKAMVSSNPPKFILYDSTMPWVLEVAKEFGLDRAPFYTQSCALNSINYHVLHGQLKLPPETPTISLPSMPLLRPSDLPAYDFDPASTDTIIDLLTSQYSNIQDANLLFCNTFDKLEGEIIQWMETLGRPVKTVGPTVPSAYLDKRVENDKHYGLSLFKPNEDVCLKWLDSKPSGSVLYVSYGSLVEMGEEQLKELALGIKETGKFFLWVVRDTEAEKLPPNFVESVAEKGLVVSWCSQLEVLAHPSVGCFFTHCGWNSTLEALCLGVPVVAFPQWADQVTNAKFLEDVWKVGKRVKRNEQRLASKEEVRSCIWEVMEGERASEFKSNSMEWKKWAKEAVDEGGSSDKNIEEFVAMLKQT,uniprot_search,K7NBW3,C[C@H](CC[C@@H](O)C(C)(C)O)[C@H]1CC[C@@]2(C)[C@@H]3CC=C4[C@@H](CC[C@H](O)C4(C)C)[C@]3(C)[C@H](O)C[C@]12C.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@H](CC[C@@H](O)C(C)(C)O)[C@H]1CC[C@@]2(C)[C@@H]3CC=C4[C@@H](CC[C@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C4(C)C)[C@]3(C)[C@H](O)C[C@]12C.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.000411,2.178860454788988e-14,30.0,7.2,2.4.1.350,190515.0,-3.3861581781239307,C[C@H](CC[C@@H](O)C(C)(C)O)[C@H]1CC[C@@]2(C)[C@@H]3CC=C4[C@@H](CC[C@H](O)C4(C)C)[C@]3(C)[C@H](O)C[C@]12C.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@H](CC[C@@H](O)C(C)(C)O)[C@H]1CC[C@@]2(C)[C@@H]3CC=C4[C@@H](CC[C@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C4(C)C)[C@]3(C)[C@H](O)C[C@]12C.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-3.3861581781239307,C[C@H](CC[C@@H](O)C(C)(C)O)[C@H]1CC[C@@]2(C)[C@@H]3CC=C4[C@@H](CC[C@H](O)C4(C)C)[C@]3(C)[C@H](O)C[C@]12C.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__MEKGDTHILVFPFPSQGHINPLLQLSKRLIAKGIKVSLVTTLHVSNHLQLQGAYSNSVKIEVISDGSEDRLETDTMRQTLDRFRQKMTKNLEDFLQKAMVSSNPPKFILYDSTMPWVLEVAKEFGLDRAPFYTQSCALNSINYHVLHGQLKLPPETPTISLPSMPLLRPSDLPAYDFDPASTDTIIDLLTSQYSNIQDANLLFCNTFDKLEGEIIQWMETLGRPVKTVGPTVPSAYLDKRVENDKHYGLSLFKPNEDVCLKWLDSKPSGSVLYVSYGSLVEMGEEQLKELALGIKETGKFFLWVVRDTEAEKLPPNFVESVAEKGLVVSWCSQLEVLAHPSVGCFFTHCGWNSTLEALCLGVPVVAFPQWADQVTNAKFLEDVWKVGKRVKRNEQRLASKEEVRSCIWEVMEGERASEFKSNSMEWKKWAKEAVDEGGSSDKNIEEFVAMLKQT,./data/raw/alphafold//AF-K7NBW3-F1-model_v4.pdb,1770,3724,1526,3496
+543,1881,1912,MLENISSVKVSGGWHKQYTHSAVSTHCTMRFAVFLPPGASESNKVPVLYWLSGLTCTDENFMQKAGAFKKAAELGIAIVAPDTSPRGDNVPNEDSYDFAQGAGFYVNATQAPYNTHFNMYDYVVNELPALIEQHFPVTSTKAISGHSMGGHGALMIALKNPQDYVSASAFSPIVNPINCPWGVKAFTGYLGADKTTWAQYDSCKLMAKAEQSNYLPMLVSQGDADNFLDEQLKPQNLVAVAKQKDYPLTLEMQTGYDHSYFFISSFIDQHLVFHHQYLSA,brenda,Q3IL66,CC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CC(=O)O.O=[N+]([O-])c1ccc(O)cc1,2.0,0.0,20.0,7.4,3.1.1.73,228.0,0.3010299956639812,CC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CC(=O)O.O=[N+]([O-])c1ccc(O)cc1,0.3010299956639812,CC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MLENISSVKVSGGWHKQYTHSAVSTHCTMRFAVFLPPGASESNKVPVLYWLSGLTCTDENFMQKAGAFKKAAELGIAIVAPDTSPRGDNVPNEDSYDFAQGAGFYVNATQAPYNTHFNMYDYVVNELPALIEQHFPVTSTKAISGHSMGGHGALMIALKNPQDYVSASAFSPIVNPINCPWGVKAFTGYLGADKTTWAQYDSCKLMAKAEQSNYLPMLVSQGDADNFLDEQLKPQNLVAVAKQKDYPLTLEMQTGYDHSYFFISSFIDQHLVFHHQYLSA,./data/raw/alphafold//AF-Q3IL66-F1-model_v4.pdb,1485,1036,862,1191
+544,5913,6006,MLRRVLSRGPLPRSLSVGPATKLTANRGKLAKSRGVHVHFLTTSECAAAAGDASVPIPLGFTGKAGEVDFQTVWTTAQDPAAAESAVTKRGRKTTGVRLAGEKPAELVAGMGTHSTVRDYRLAVTAAVRKAKVCNAAWVSLHPPKQDVFTMTDPYHPPQRLKSHEMVEKTAIFAVTGAYQYDRLKSGILASKDPAKTGSTRAGLAESRAKPPAAPQSPMELVVASSNAQAVRAGEVIGHCVNDARNLGNLREDEGVPEFYVEWAKKYMIPEGIKVRKVLRGQQLEEAGLHLMYNVGRGSRYEPYLMVLEYIGNPRSSATTAIVGKGVTFDCGGLNIKPYNSMETMHSDMMGAATAFCALKAIAKLQLPINVVAAVGLVENAIGPESYHPSSIITSLKGLTVKVLNTDAEGRLVLADVFTYVQRYAPLDKKPTRIIDLATLTGAIVVGLGSRRAGLFSPSATLASSLMAAGTQCGEELWPMPIGDEHKDMMKGGIADLINAAPGRQAGSCTAAAFISNFVEPEVQWAHLDIAGVADVGDKPKGYDPAGVTGFGMQLLVDFLRHNKP,brenda,Q95V76,CC1=CCOc2cc(N=C(O)[C@H](C)N)ccc21.O>>C[C@H](N)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,1.61,2.712096497335995,37.0,8.0,3.4.11.1,5659.0,0.2068258760318497,CC1=CCOc2cc(N=C(O)[C@H](C)N)ccc21.O,C[C@H](N)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,0.2068258760318497,CC1=CCOc2cc(N=C(O)[C@H](C)N)ccc21.O__MLRRVLSRGPLPRSLSVGPATKLTANRGKLAKSRGVHVHFLTTSECAAAAGDASVPIPLGFTGKAGEVDFQTVWTTAQDPAAAESAVTKRGRKTTGVRLAGEKPAELVAGMGTHSTVRDYRLAVTAAVRKAKVCNAAWVSLHPPKQDVFTMTDPYHPPQRLKSHEMVEKTAIFAVTGAYQYDRLKSGILASKDPAKTGSTRAGLAESRAKPPAAPQSPMELVVASSNAQAVRAGEVIGHCVNDARNLGNLREDEGVPEFYVEWAKKYMIPEGIKVRKVLRGQQLEEAGLHLMYNVGRGSRYEPYLMVLEYIGNPRSSATTAIVGKGVTFDCGGLNIKPYNSMETMHSDMMGAATAFCALKAIAKLQLPINVVAAVGLVENAIGPESYHPSSIITSLKGLTVKVLNTDAEGRLVLADVFTYVQRYAPLDKKPTRIIDLATLTGAIVVGLGSRRAGLFSPSATLASSLMAAGTQCGEELWPMPIGDEHKDMMKGGIADLINAAPGRQAGSCTAAAFISNFVEPEVQWAHLDIAGVADVGDKPKGYDPAGVTGFGMQLLVDFLRHNKP,./data/raw/alphafold//AF-Q95V76-F1-model_v4.pdb,3177,1972,3617,2456
+545,19277,19563,MAGEGAVERGSLAAEECSHVRVLRCVTRPHRPQKVTITTDASHVPVSSDLILERCDLQLEVNGRDHRTADLCRERLVLRRGQPFWLTLHFEGRGYEAGVDTLTFNAVTGPDPSEEAGTMARFSLSSAVEGGTWSASAVDQQDSTVSLLLSTPADAPIGLYRLSLEASTGYQGSSFVLGHFILLYNPWCPADAVYMDSDQERQEYVLTQQGFIYQGSAKFINGIPWNFGQFEDGILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLGIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHCWVESWMTRPDLEPGYEGWQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAGLTKDQKSVEVPDPVEAGEQAKVRVDLLPTEVGLHKLVVNFECDKLKAVKGYRNVIIGPA,brenda,H0VXN6,O.O=C(O)CN=C(O)[C@H](CCC(=O)Oc1ccc2ccc(=O)oc2c1)N=C(O)OCc1ccccc1>>,0.33,99.80058229968492,30.0,8.0,2.3.2.13,10141.0,-0.4814860601221125,O.O=C(O)CN=C(O)[C@H](CCC(=O)Oc1ccc2ccc(=O)oc2c1)N=C(O)OCc1ccccc1,,-0.4814860601221125,O.O=C(O)CN=C(O)[C@H](CCC(=O)Oc1ccc2ccc(=O)oc2c1)N=C(O)OCc1ccccc1__MAGEGAVERGSLAAEECSHVRVLRCVTRPHRPQKVTITTDASHVPVSSDLILERCDLQLEVNGRDHRTADLCRERLVLRRGQPFWLTLHFEGRGYEAGVDTLTFNAVTGPDPSEEAGTMARFSLSSAVEGGTWSASAVDQQDSTVSLLLSTPADAPIGLYRLSLEASTGYQGSSFVLGHFILLYNPWCPADAVYMDSDQERQEYVLTQQGFIYQGSAKFINGIPWNFGQFEDGILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLGIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHCWVESWMTRPDLEPGYEGWQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAGLTKDQKSVEVPDPVEAGEQAKVRVDLLPTEVGLHKLVVNFECDKLKAVKGYRNVIIGPA,./data/raw/alphafold//AF-H0VXN6-F1-model_v4.pdb,1941,4089,1945,3781
+546,4628,4684,MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFVGKNDGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEESAGKATITLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,sabio,Q83U23,CC(N=C(O)C(N)Cc1ccc(O)cc1)C(=O)O.O>>CC(N)C(=O)O.NC(Cc1ccc(O)cc1)C(=O)O,212.0,1.0496042775783007e-14,37.0,7.5,3.4.13.-,44688.0,2.326335860928752,CC(N=C(O)C(N)Cc1ccc(O)cc1)C(=O)O.O,CC(N)C(=O)O.NC(Cc1ccc(O)cc1)C(=O)O,2.326335860928752,CC(N=C(O)C(N)Cc1ccc(O)cc1)C(=O)O.O__MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFVGKNDGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEESAGKATITLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,./data/raw/alphafold//AF-Q83U23-F1-model_v4.pdb,1801,1476,3046,1796
+547,18303,18563,MMQVYHLSHIDLDGYACQLVSKQFFKNIQCYNANYGREVSARIYEILNAIAQSKESEFLILVSDLNLNLNEAEYLQDKIQEHRLQNKNIQIQLLDHHISGKEVAESFHWYFLDINRCATKIVYEFLKKHYAILEPKNTTWLEPLVEMVNSVDIWDTQGYGFELGKVCMRMINQSSELNRFMFDDENRNYKLKLLEEVKNYLFLENAPVAYDNDLFKLKKIALGGDPDAETMDNISSNAQTHLLSLKKHDCSVYYQDKKGFLSYSMGGISVLANLFLTQNPDFDFYMDVNAKGNVSLRANGNCDVCELSQMCFNGGGHRNASGGKIDGFRESFNYRDIKEQIEEIFNNA,sabio,O25683,Nc1ncnc2c1ncn2C1OC2COP(=O)(O)OC2C1O.O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O,120480.0,0.0,30.0,4.5,3.1.4.17,210.0,5.080914958856625,Nc1ncnc2c1ncn2C1OC2COP(=O)(O)OC2C1O.O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O,5.080914958856625,Nc1ncnc2c1ncn2C1OC2COP(=O)(O)OC2C1O.O__MMQVYHLSHIDLDGYACQLVSKQFFKNIQCYNANYGREVSARIYEILNAIAQSKESEFLILVSDLNLNLNEAEYLQDKIQEHRLQNKNIQIQLLDHHISGKEVAESFHWYFLDINRCATKIVYEFLKKHYAILEPKNTTWLEPLVEMVNSVDIWDTQGYGFELGKVCMRMINQSSELNRFMFDDENRNYKLKLLEEVKNYLFLENAPVAYDNDLFKLKKIALGGDPDAETMDNISSNAQTHLLSLKKHDCSVYYQDKKGFLSYSMGGISVLANLFLTQNPDFDFYMDVNAKGNVSLRANGNCDVCELSQMCFNGGGHRNASGGKIDGFRESFNYRDIKEQIEEIFNNA,./data/raw/alphafold//AF-O25683-F1-model_v4.pdb,2872,2459,2738,5581
+548,4079,4132,MKFTTAAVLSALVSAEIAFAAPGGNGFARRQARRQARAAGLKASPFRQVNAKEATVESNWGGAILIGSDFDTVSATANVPSASGGSSAAGTAWVGIDGDTCQTAILQTGFDWYGDGTYDAWYEWYPEVSDDFSGITISEGDSIQMSVTATSDTSGSATLENLTTGQKVSKSFSNESSGSLCRTNAEFIIEDFEECNSNGSDCEFVPFASFSPAVEFTDCSVTSDGESVSLDDAQITQVIINNQDVTDCSVSGTTVSCSYV,uniprot_search,P15369,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=NCC(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)=NCC(=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-],3.6,3.1213239493469545e-14,37.0,4.5,3.4.23.32,5539.0,0.5563025007672873,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=NCC(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)=NCC(=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-],0.5563025007672873,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=NCC(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
+549,6124,6227,MELEKRLKEKLEAPTLDYEKYFSKKALGMKASEVRELLKLVESSDVISLAGGLPAPETFPVEIIAEITKEVLEKHAAQALQYGTTKGFTPLRLALAEWMRKRYDIPISKVDIMITSGSQQALDLIGRVFINPGDIVVVEAPTYLAALQAFKYYEPEFVQIPLDDEGMRVDLLEEKLQELEKEGKKVKLVYTIPTFQNPAGVTMSEKRRKRLLELASEYDFLIVEDNPYGELRYSGEPVKPIKAWDDEGRVMYLGTFSKILAPGFRIGWIAAEPHLIRKLEIAKQSVDLCTNPFSQVIAWKYVEGGHLDNHIPNIIEFYKPRRDAMLKALEEFMPEGVRWTKPEGGMFVWVTLPEGIDTKLMLEKAVAKGVAYVPGEAFFAHRDVKNTMRLNFTYVPEEKIREGIKRLAETIKEEMKK,brenda,A0A060PQX5,CCC(=O)C(=O)[O-].CCCCCCC(N)C(=O)O>>CCCCCCC(=O)C(=O)[O-].CC[C@H](N)C(=O)O,81.0,1.0897476872207362e-14,90.0,8.0,2.6.1.42,35749.0,1.9084850188786493,CCC(=O)C(=O)[O-].CCCCCCC(N)C(=O)O,CCCCCCC(=O)C(=O)[O-].CC[C@H](N)C(=O)O,2.397940008672037,CCC(=O)C(=O)[O-].CCCCCCC(N)C(=O)O__MELEKRLKEKLEAPTLDYEKYFSKKALGMKASEVRELLKLVESSDVISLAGGLPAPETFPVEIIAEITKEVLEKHAAQALQYGTTKGFTPLRLALAEWMRKRYDIPISKVDIMITSGSQQALDLIGRVFINPGDIVVVEAPTYLAALQAFKYYEPEFVQIPLDDEGMRVDLLEEKLQELEKEGKKVKLVYTIPTFQNPAGVTMSEKRRKRLLELASEYDFLIVEDNPYGELRYSGEPVKPIKAWDDEGRVMYLGTFSKILAPGFRIGWIAAEPHLIRKLEIAKQSVDLCTNPFSQVIAWKYVEGGHLDNHIPNIIEFYKPRRDAMLKALEEFMPEGVRWTKPEGGMFVWVTLPEGIDTKLMLEKAVAKGVAYVPGEAFFAHRDVKNTMRLNFTYVPEEKIREGIKRLAETIKEEMKK,./data/raw/alphafold//AF-A0A060PQX5-F1-model_v4.pdb,1805,1461,3027,1775
+550,10376,10528,MQSPLLNVENLLDDRFDAIVFVNDSITEVDERHSAIKECLVSFSKVNPKIAEELTIVPFPKHPSGRLIFSPTGSLNTDLADVRNVYDASCEAIKRAIALGCKAPLLCVGPLQTASVGFRWMERRNILLNVLLGAYHAAYTPLEVREMLPEKYPKVTHIGLVNGDDTLFKVASAIEEGRWIARDIGGSDPERMAAPAVVQYLQSVLSGAEGITMQVEKVDGKKYPLMAAVNRAASVVSRHDGRVVHLNYVPPNSAAIDTTLYLIGKGITYDTGGADVKAGGVMAGMHRDKCGAAAIAGFFMTLSRLQPPALSVSASLAFVRNSIGPDSYVSDEIIVSRAGKRVRIGNTDAEGRMVMADLLCEAKEKAVKATNPFLFTIATLTGHVVRAYKHFTAVMDNGPARLKCVSQELQSAGDLLSDLAEISTVRKEDYEFNKGRTEYEDILQCNNLPSSATARGHQVPAAFLVMASGLDKHGMDSPKPLPYTHVDVAGSAAEIHVLPTAAPLMMFASRYILPRVGFL,brenda,C6FWH0,C[C@@H](O)[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>C[C@@H](O)[C@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,0.02,1.1027022506810587e-14,20.0,8.0,3.4.11.1,79923.0,-1.6989700043360187,C[C@@H](O)[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,C[C@@H](O)[C@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,-1.6989700043360187,C[C@@H](O)[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MQSPLLNVENLLDDRFDAIVFVNDSITEVDERHSAIKECLVSFSKVNPKIAEELTIVPFPKHPSGRLIFSPTGSLNTDLADVRNVYDASCEAIKRAIALGCKAPLLCVGPLQTASVGFRWMERRNILLNVLLGAYHAAYTPLEVREMLPEKYPKVTHIGLVNGDDTLFKVASAIEEGRWIARDIGGSDPERMAAPAVVQYLQSVLSGAEGITMQVEKVDGKKYPLMAAVNRAASVVSRHDGRVVHLNYVPPNSAAIDTTLYLIGKGITYDTGGADVKAGGVMAGMHRDKCGAAAIAGFFMTLSRLQPPALSVSASLAFVRNSIGPDSYVSDEIIVSRAGKRVRIGNTDAEGRMVMADLLCEAKEKAVKATNPFLFTIATLTGHVVRAYKHFTAVMDNGPARLKCVSQELQSAGDLLSDLAEISTVRKEDYEFNKGRTEYEDILQCNNLPSSATARGHQVPAAFLVMASGLDKHGMDSPKPLPYTHVDVAGSAAEIHVLPTAAPLMMFASRYILPRVGFL,./data/raw/alphafold//AF-C6FWH0-F1-model_v4.pdb,1847,1540,3121,1887
+551,13373,13548,MSKIRIGIVGYGNLGRGVEAAIQQNPDMELVAVFTRRDPKTVAVKSNVKVLHVDDAQSYKDEIDVMILCGGSATDLPEQGPYFAQYFNTIDSFDTHARIPDYFDAVNAAAEQSGKVAIISVGWDPGLFSLNRLLGEVVLPVGNTYTFWGKGVSQGHSDAIRRIQGVKNAVQYTIPIDEAVNRVRSGENPELSTREKHARECFVVLEEGADPAKVEHEIKTMPNYFDEYDTTVHFISEEELKQNHSGMPHGGFVIRSGKSDEGHKQIIEFSLNLESNPMFTSSALVAYARAAYRLSQNGDKGAKTVFDIPFGLLSPKSPEDLRKELL,brenda,G1UII1,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=N[C@H](C(=O)O)CCC1.[NH4+]>>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.N[C@H](CCC[C@H](N)C(=O)O)C(=O)O,50.6,0.0,30.0,8.5,1.4.1.16,51173.0,1.7041505168397992,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=N[C@H](C(=O)O)CCC1.[NH4+],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.N[C@H](CCC[C@H](N)C(=O)O)C(=O)O,2.5412046906832586,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=N[C@H](C(=O)O)CCC1.[NH4+]__MSKIRIGIVGYGNLGRGVEAAIQQNPDMELVAVFTRRDPKTVAVKSNVKVLHVDDAQSYKDEIDVMILCGGSATDLPEQGPYFAQYFNTIDSFDTHARIPDYFDAVNAAAEQSGKVAIISVGWDPGLFSLNRLLGEVVLPVGNTYTFWGKGVSQGHSDAIRRIQGVKNAVQYTIPIDEAVNRVRSGENPELSTREKHARECFVVLEEGADPAKVEHEIKTMPNYFDEYDTTVHFISEEELKQNHSGMPHGGFVIRSGKSDEGHKQIIEFSLNLESNPMFTSSALVAYARAAYRLSQNGDKGAKTVFDIPFGLLSPKSPEDLRKELL,./data/raw/alphafold//AF-G1UII1-F1-model_v4.pdb,1273,4564,4496,4395
+552,22001,22332,MASFSVKFSATSLPNHKRFSKLHATPPQTVAVAPSGAAEIASERLEPRVEEKDGYWVLKEKFRQGINPAEKAKIEKEPMKLFMENGIEDLAKISLEEIEGSKLTKDDIDVRLKWLGLFHRRKHHYGRFMMRLKLPNGVTTSSQTRYLASVIRKYGKDGCADVTTRQNWQIRGVVLPDVPEILKGLDEVGLTSLQSGMDNVRNPVGNPLAGIDPHEIVDTRPYTNLLSQYVTANFRGNPAVTNLPRKWNVCVIGSHDLYEHPQINDLAYMPATKDGRFGFNLLVGGFFSPKRCAEAVPLDAWVPADDVVPVCKAILEAYRDLGTRGNRQKTRMMWLVDELGVEGFRAEVVKRMPQQKLDRESTEDLVQKQWERREYLGVHPQKQEGYSFVGLHIPVGRVQADDMDELARLADEYGSGELRLTVEQNIIIPNVKNSKIEALLNEPLLKNRFSTDPPILMKNLVACTGNQFCGKAIIETKARSMKITEEVQLLVSITQPVRMHWTGCPNSCAQVQVADIGFMGCLTRKEGKTVEGADVYLGGRIGSDSHLGDVYKKSVPCEDLVPIIVDLLVDNFGAVPREREEAED,brenda,Q76KA9,O=N[O-]>>N.O,73.0,13.356327162374624,30.0,7.0,1.7.7.1,4097.0,1.863322860120456,O=N[O-],N.O,1.863322860120456,O=N[O-]__MASFSVKFSATSLPNHKRFSKLHATPPQTVAVAPSGAAEIASERLEPRVEEKDGYWVLKEKFRQGINPAEKAKIEKEPMKLFMENGIEDLAKISLEEIEGSKLTKDDIDVRLKWLGLFHRRKHHYGRFMMRLKLPNGVTTSSQTRYLASVIRKYGKDGCADVTTRQNWQIRGVVLPDVPEILKGLDEVGLTSLQSGMDNVRNPVGNPLAGIDPHEIVDTRPYTNLLSQYVTANFRGNPAVTNLPRKWNVCVIGSHDLYEHPQINDLAYMPATKDGRFGFNLLVGGFFSPKRCAEAVPLDAWVPADDVVPVCKAILEAYRDLGTRGNRQKTRMMWLVDELGVEGFRAEVVKRMPQQKLDRESTEDLVQKQWERREYLGVHPQKQEGYSFVGLHIPVGRVQADDMDELARLADEYGSGELRLTVEQNIIIPNVKNSKIEALLNEPLLKNRFSTDPPILMKNLVACTGNQFCGKAIIETKARSMKITEEVQLLVSITQPVRMHWTGCPNSCAQVQVADIGFMGCLTRKEGKTVEGADVYLGGRIGSDSHLGDVYKKSVPCEDLVPIIVDLLVDNFGAVPREREEAED,./data/raw/alphafold//AF-Q76KA9-F1-model_v4.pdb,737,154,5890,6804
+553,14719,14927,MCSLKWDYDLRCGEYTLNLNEKTLIMGILNVTPDSFSDGGSYNEVDAAVRHAKEMRDEGAHIIDIGGESTRPGFAKVSVEEEIKRVVPMIQAVSKEVKLPISIDTYKAEVAKQAIEAGAHIINDIWGAKAEPKIAEVAAHYDVPIILMHNRDNMNYRNLMADMIADLYDSIKIAKDAGVRDENIILDPGIGFAKTPEQNLEAMRNLEQLNVLGYPVLLGTSRKSFIGHVLDLPVEERLEGTGATVCLGIEKGCEFVRVHDVKEMSRMAKMMDAMIGKGVK,brenda,Q81VW8,N=c1nc(O)c2c([nH]1)NCC(COP(=O)(O)OP(=O)(O)O)=N2.Nc1ccc(S(=O)(=O)Nc2nccs2)cc1>>O=P(O)(O)OP(=O)(O)O.O=S(=O)(Nc1cccs1)c1ccc(N2C=N[C]3NCC=NC3=C2)cc1,0.0887,5.167089540163795,37.0,7.6,2.5.1.15,1392.0,-1.0520763801682735,N=c1nc(O)c2c([nH]1)NCC(COP(=O)(O)OP(=O)(O)O)=N2.Nc1ccc(S(=O)(=O)Nc2nccs2)cc1,O=P(O)(O)OP(=O)(O)O.O=S(=O)(Nc1cccs1)c1ccc(N2C=N[C]3NCC=NC3=C2)cc1,-1.0520763801682735,N=c1nc(O)c2c([nH]1)NCC(COP(=O)(O)OP(=O)(O)O)=N2.Nc1ccc(S(=O)(=O)Nc2nccs2)cc1__MCSLKWDYDLRCGEYTLNLNEKTLIMGILNVTPDSFSDGGSYNEVDAAVRHAKEMRDEGAHIIDIGGESTRPGFAKVSVEEEIKRVVPMIQAVSKEVKLPISIDTYKAEVAKQAIEAGAHIINDIWGAKAEPKIAEVAAHYDVPIILMHNRDNMNYRNLMADMIADLYDSIKIAKDAGVRDENIILDPGIGFAKTPEQNLEAMRNLEQLNVLGYPVLLGTSRKSFIGHVLDLPVEERLEGTGATVCLGIEKGCEFVRVHDVKEMSRMAKMMDAMIGKGVK,./data/raw/alphafold//AF-Q81VW8-F1-model_v4.pdb,1959,4108,1968,3806
+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
+555,18577,18847,MAARRGALIVLEGVDRAGKSTQSRKLVEALCAAGHRAELLRFPERSTEIGKLLSSYLQKKSDVEDHSVHLLFSANRWEQVPLIKEKLSQGVTLVVDRYAFSGVAFTGAKENFSLDWCKQPDVGLPKPDLVLFLQLQLADAAKRGAFGHERYENGAFQERALRCFHQLMKDTTLNWKMVDASKSIEAVHEDIRVLSEDAIRTATEKPLGELWK,brenda,P23919,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=c1nc(O)c(Br)cn1C/C=C/CCP(=O)(O)O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.058,32.881275074207494,37.0,7.4,2.7.4.9,9606.0,-1.2365720064370629,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=c1nc(O)c(Br)cn1C/C=C/CCP(=O)(O)O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-1.2365720064370629,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=c1nc(O)c(Br)cn1C/C=C/CCP(=O)(O)O__MAARRGALIVLEGVDRAGKSTQSRKLVEALCAAGHRAELLRFPERSTEIGKLLSSYLQKKSDVEDHSVHLLFSANRWEQVPLIKEKLSQGVTLVVDRYAFSGVAFTGAKENFSLDWCKQPDVGLPKPDLVLFLQLQLADAAKRGAFGHERYENGAFQERALRCFHQLMKDTTLNWKMVDASKSIEAVHEDIRVLSEDAIRTATEKPLGELWK,./data/raw/alphafold//AF-P23919-F1-model_v4.pdb,143,4175,4043,3890
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+602,5282,5368,MDLVMLLVLTLTCLILLSIWRQSSGRGKLPPGPIPLPIIGNIFQLNVKNITQSLTSFSKVYGPVFTLYFGTKPTVILHGYEAVKEALIDHGEEFAERGSFPVAEKINKDLGIVFSHGNRWKEIRRFTLTTLRNLGMGKRNIEDRVQEEARCLVEELRKTNGSPCDPTFILGCAPCNVICSIIFQNRFDYKDQDFLNLMEKLNENMKILSSPWTQFCSFFPVLIDYCPGSHTTLAKNVYHIRNYLLKKIKEHQESLDVTNPRDFIDYYLIKWKQENHNPHSEFTLENLSITVTDLFGAGTETTSTTLRYALLLLLKCPEVTAKVQEEIDRVVGKHRSPCMQDRSRMPYTDAHDHEVQRFIDLIPTNLPHAVTCDIKFRNYLIPKGTTIITSLSSVLHDSKEFPDPEIFDPGHFLDGNGKFKKSDYFMPFSAGKRMCAGEGLARMELFLFLTTILQNFKLKSVLHPKDIDTTPVFNGFASLPPFYELCFIPL,sabio,P05178,CC1(C)C(C=C(Br)Br)C1C(=O)OC(C#N)c1cccc(Oc2ccccc2)c1.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.[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.O,9000.0,25.46103721955636,37.0,7.4,1.14.14.1,10116.0,3.9542425094393248,CC1(C)C(C=C(Br)Br)C1C(=O)OC(C#N)c1cccc(Oc2ccccc2)c1.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.[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.O,3.9542425094393248,CC1(C)C(C=C(Br)Br)C1C(=O)OC(C#N)c1cccc(Oc2ccccc2)c1.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.[H]__MDLVMLLVLTLTCLILLSIWRQSSGRGKLPPGPIPLPIIGNIFQLNVKNITQSLTSFSKVYGPVFTLYFGTKPTVILHGYEAVKEALIDHGEEFAERGSFPVAEKINKDLGIVFSHGNRWKEIRRFTLTTLRNLGMGKRNIEDRVQEEARCLVEELRKTNGSPCDPTFILGCAPCNVICSIIFQNRFDYKDQDFLNLMEKLNENMKILSSPWTQFCSFFPVLIDYCPGSHTTLAKNVYHIRNYLLKKIKEHQESLDVTNPRDFIDYYLIKWKQENHNPHSEFTLENLSITVTDLFGAGTETTSTTLRYALLLLLKCPEVTAKVQEEIDRVVGKHRSPCMQDRSRMPYTDAHDHEVQRFIDLIPTNLPHAVTCDIKFRNYLIPKGTTIITSLSSVLHDSKEFPDPEIFDPGHFLDGNGKFKKSDYFMPFSAGKRMCAGEGLARMELFLFLTTILQNFKLKSVLHPKDIDTTPVFNGFASLPPFYELCFIPL,./data/raw/alphafold//AF-P05178-F1-model_v4.pdb,1176,3892,3236,2020
+603,22095,22428,MSDITVTNWAGNITYTAKELLRPHSLDALRALVADSARVRVLGSGHSFNEIAEPGDGGVLLSLAGLPSVVDVDTAARTVRVGGGVRYAELARVVHARGLALPNMASLPHISVAGSVATGTHGSGVGNGSLASVVREVELVTADGSTVVIARGDERFGGAVTSLGALGVVTSLTLDLEPAYEMEQHVFTELPLAGLDPATFETVMAAAYSVSLFTDWRAPGFRQVWLKRRTDRPLDGFPYAAPAAEKMHPVPGMPAVNCTEQFGVPGPWHERLPHFRAEFTPSSGAELQSEYLMPREHALAALHAMDAIRETLAPVLQTCEIRTVAADAQWLSPAYGRDTVAAHFTWVEDTAAVLPVVRRLEEALVPFAARPHWGKVFTVPAGELRALYPRLADFGALAGALDPAGKFTNAFVRGVLAG,brenda,Q9ZBU1,O=O.OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO>>OO,9.2,72.29838191858227,30.0,7.5,1.1.3.41,1902.0,0.9637878273455552,O=O.OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO,OO,0.9637878273455552,O=O.OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO__MSDITVTNWAGNITYTAKELLRPHSLDALRALVADSARVRVLGSGHSFNEIAEPGDGGVLLSLAGLPSVVDVDTAARTVRVGGGVRYAELARVVHARGLALPNMASLPHISVAGSVATGTHGSGVGNGSLASVVREVELVTADGSTVVIARGDERFGGAVTSLGALGVVTSLTLDLEPAYEMEQHVFTELPLAGLDPATFETVMAAAYSVSLFTDWRAPGFRQVWLKRRTDRPLDGFPYAAPAAEKMHPVPGMPAVNCTEQFGVPGPWHERLPHFRAEFTPSSGAELQSEYLMPREHALAALHAMDAIRETLAPVLQTCEIRTVAADAQWLSPAYGRDTVAAHFTWVEDTAAVLPVVRRLEEALVPFAARPHWGKVFTVPAGELRALYPRLADFGALAGALDPAGKFTNAFVRGVLAG,./data/raw/alphafold//AF-Q9ZBU1-F1-model_v4.pdb,748,169,5907,6821
+604,103,109,MASVWQRLGFYASLLKRQLNGGPDVIKWERRVIPGCTRSIYSATGKWTKEYTLQTRKDVEKWWHQRIKEQASKISEADKSKPKFYVLSMFPYPSGKLHMGHVRVYTISDTIARFQKMRGMQVINPMGWDAFGLPAENAAVERNLHPQSWTQSNIKHMRKQLDRLGLCFSWDREITTCLPDYYKWTQYLFIKLYEAGLAYQKEALVNWDPVDQTVLANEQVDEHGCSWRSGAKVEQKYLRQWFIKTTAYAKAMQDALADLPEWYGIKGMQAHWIGDCVGCHLDFTLKVHGQATGEKLTAYTATPEAIYGTSHVAISPSHRLLHGHSSLKEALRMALVPGKDCLTPVMAVNMLTQQEVPVVILAKADLEGSLDSKIGIPSTSSEDTILAQTLGLAYSEVIETLPDGTERLSSSAEFTGMTRQDAFLALTQKARGKRVGGDVTSDKLKDWLISRQRYWGTPIPIVHCPVCGPTPVPLEDLPVTLPNIASFTGKGGPPLAMASEWVNCSCPRCKGAAKRETDTMDTFVDSAWYYFRYTDPHNPHSPFNTAVADYWMPVDLYIGGKEHAVMHLFYARFFSHFCHDQKMVKHREPFHKLLAQGLIKGQTFRLPSGQYLQREEVDLTGSVPVHAKTKEKLEVTWEKMSKSKHNGVDPEEVVEQYGIDTIRLYILFAAPPEKDILWDVKTDALPGVLRWQQRLWTLTTRFIEARASGKSPQPQLLSNKEKAEARKLWEYKNSVISQVTTHFTEDFSLNSAISQLMGLSNALSQASQSVILHSPEFEDALCALMVMAAPLAPHVTSEIWAGLALVPRKLCAHYTWDASVLLQAWPAVDPEFLQQPEVVQMAVLINNKACGKIPVPQQVARDQDKVHEFVLQSELGVRLLQGRSIKKSFLSPRTALINFLVQD,sabio,Q15031,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)C1O.CC(C)CC(N)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(OC(=O)C(N)CC(C)C)C2O)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,0.041,1.754052959734131e-14,37.0,7.6,6.1.1.4,9606.0,-1.3872161432802643,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)C1O.CC(C)CC(N)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(OC(=O)C(N)CC(C)C)C2O)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,-0.8538719643217619,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)C1O.CC(C)CC(N)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MASVWQRLGFYASLLKRQLNGGPDVIKWERRVIPGCTRSIYSATGKWTKEYTLQTRKDVEKWWHQRIKEQASKISEADKSKPKFYVLSMFPYPSGKLHMGHVRVYTISDTIARFQKMRGMQVINPMGWDAFGLPAENAAVERNLHPQSWTQSNIKHMRKQLDRLGLCFSWDREITTCLPDYYKWTQYLFIKLYEAGLAYQKEALVNWDPVDQTVLANEQVDEHGCSWRSGAKVEQKYLRQWFIKTTAYAKAMQDALADLPEWYGIKGMQAHWIGDCVGCHLDFTLKVHGQATGEKLTAYTATPEAIYGTSHVAISPSHRLLHGHSSLKEALRMALVPGKDCLTPVMAVNMLTQQEVPVVILAKADLEGSLDSKIGIPSTSSEDTILAQTLGLAYSEVIETLPDGTERLSSSAEFTGMTRQDAFLALTQKARGKRVGGDVTSDKLKDWLISRQRYWGTPIPIVHCPVCGPTPVPLEDLPVTLPNIASFTGKGGPPLAMASEWVNCSCPRCKGAAKRETDTMDTFVDSAWYYFRYTDPHNPHSPFNTAVADYWMPVDLYIGGKEHAVMHLFYARFFSHFCHDQKMVKHREPFHKLLAQGLIKGQTFRLPSGQYLQREEVDLTGSVPVHAKTKEKLEVTWEKMSKSKHNGVDPEEVVEQYGIDTIRLYILFAAPPEKDILWDVKTDALPGVLRWQQRLWTLTTRFIEARASGKSPQPQLLSNKEKAEARKLWEYKNSVISQVTTHFTEDFSLNSAISQLMGLSNALSQASQSVILHSPEFEDALCALMVMAAPLAPHVTSEIWAGLALVPRKLCAHYTWDASVLLQAWPAVDPEFLQQPEVVQMAVLINNKACGKIPVPQQVARDQDKVHEFVLQSELGVRLLQGRSIKKSFLSPRTALINFLVQD,./data/raw/alphafold//AF-Q15031-F1-model_v4.pdb,934,445,84,91
+605,5784,5870,MKQRIALSLLALGPLLLVPRVYAAADEPMANIVEKAVQPLLEEYRIPGMAVAVLKEGKPHYFNYGVANRESGRRISERTLFEIGSVSKTFTATLGTYAVVKGGFRLDDKVSQHAPWLQNSAFDRVTMAQLATYSAGGLPLQFPDAVDSNERMRQYYRQWSPLYAAGTHREYSNPSIGLFGHLAASTLGQPFRQLMSQTLLPKLDLQHTYLEVPDAAMVDYAYGYSKEDKPVRVNPGVLADEAYGIKTSAADLIKFVGANMTGSGDKAVQQALAMTRTGFYSVGEMTQGLGWESYAYPVTEQALLAGNSPAVSFKANPVKPFVAPRVMGNERLYNKTGSTNGFGAYVVFVPARGVGIVMLANRNYPIEARVKAAYAIMRHLAP,brenda,B2BSN6,CC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)[C@H](N)c3ccccc3)[C@H]2SC1.O>>,160.0,99.72708242929389,30.0,7.0,3.5.2.6,29489.0,2.204119982655925,CC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)[C@H](N)c3ccccc3)[C@H]2SC1.O,,2.204119982655925,CC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)[C@H](N)c3ccccc3)[C@H]2SC1.O__MKQRIALSLLALGPLLLVPRVYAAADEPMANIVEKAVQPLLEEYRIPGMAVAVLKEGKPHYFNYGVANRESGRRISERTLFEIGSVSKTFTATLGTYAVVKGGFRLDDKVSQHAPWLQNSAFDRVTMAQLATYSAGGLPLQFPDAVDSNERMRQYYRQWSPLYAAGTHREYSNPSIGLFGHLAASTLGQPFRQLMSQTLLPKLDLQHTYLEVPDAAMVDYAYGYSKEDKPVRVNPGVLADEAYGIKTSAADLIKFVGANMTGSGDKAVQQALAMTRTGFYSVGEMTQGLGWESYAYPVTEQALLAGNSPAVSFKANPVKPFVAPRVMGNERLYNKTGSTNGFGAYVVFVPARGVGIVMLANRNYPIEARVKAAYAIMRHLAP,./data/raw/alphafold//AF-B2BSN6-F1-model_v4.pdb,1456,988,799,1113
+606,16132,16359,MDLTNKNVIFVAALGGIGLDTSRELVKRNLKNFVILDRVENPTALAELKAINPKVNITFHTYDVTVPVAESKKLLKKIFDQLKTVDILINGAGILDDHQIERTIAINFTGLVNTTTAILDFWDKRKGGPGGIIANICSVTGFNAIHQVPVYSASKAAVVSFTNSLAKLAPITGVTAYSINPGITRTPLVHTFNSWLDVEPRVAELLLSHPTQTSEQCGQNFVKAIEANKNGAIWKLDLGTLEAIEWTKHWDSHI,sabio,P10807,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.OC1CCCCC1>>NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C1CCCCC1,7.4,0.0659172503089821,23.5,9.5,1.1.1.1,7225.0,0.8692317197309762,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.OC1CCCCC1,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C1CCCCC1,0.8692317197309762,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.OC1CCCCC1__MDLTNKNVIFVAALGGIGLDTSRELVKRNLKNFVILDRVENPTALAELKAINPKVNITFHTYDVTVPVAESKKLLKKIFDQLKTVDILINGAGILDDHQIERTIAINFTGLVNTTTAILDFWDKRKGGPGGIIANICSVTGFNAIHQVPVYSASKAAVVSFTNSLAKLAPITGVTAYSINPGITRTPLVHTFNSWLDVEPRVAELLLSHPTQTSEQCGQNFVKAIEANKNGAIWKLDLGTLEAIEWTKHWDSHI,./data/raw/alphafold//AF-P10807-F1-model_v4.pdb,1827,1509,3084,1844
+607,8352,8482,MSTSSSDPFFNFAKSSFRSAAAQKASASSLPPLPGPDKKVPGMDIKYDVVIVGSGPIGCTYARELVGAGYKVAMFDIGEIDSGLKIGAHKKNTVEYQKNIDKFVNVIQGQLMSVSVPVNTLVVDTLSPTSWQASTFFVRNGSNPEQDPLRNLSGQAVTRVVGGMSTHWTCATPRFDREQRPLLVKDDADADDAEWDRLYTKAESYFQTGTDQFKESIRHNLVLNKLTEEYKGQRDFQQIPLAATRRSPTFVEWSSANTVFDLQNRPNTDAPEERFNLFPAVACERVVRNALNSEIESLHIHDLISGDRFEIKADVYVLTAGAVHNTQLLVNSGFGQLGRPNPANPPELLPSLGSYITEQSLVFCQTVMSTELIDSVKSDMTIRGTPGELTYSVTYTPGASTNKHPDWWNEKVKNHMMQHQEDPLPIPFEDPEPQVTTLFQPSHPWHTQIHRDAFSYGAVQQSIDSRLIVDWRFFGRTEPKEENKLWFSDKITDAYNMPQPTFDFRFPAGRTSKEAEDMMTDMCVMSAKIGGFLPGSLPQFMEPGLVLHLGGTHRMGFDEKEDNCCVNTDSRVFGFKNLFLGGCGNIPTAYGANPTLTAMSLAIKSCEYIKQNFTPSPFTSEAQ,sabio,Q7ZA32,CCn1/c(=N/N=C2/Sc3cc(S(=O)(=O)[O-])ccc3[N+]2CC)sc2cc(S(=O)(=O)[O-])ccc21.OCC1OC(O)C(O)C(O)C1O>>CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=C1C(O)OC(CO)C(O)C1O,21.0,0.0,30.0,6.5,1.1.3.10,230624.0,1.3222192947339193,CCn1/c(=N/N=C2/Sc3cc(S(=O)(=O)[O-])ccc3[N+]2CC)sc2cc(S(=O)(=O)[O-])ccc21.OCC1OC(O)C(O)C(O)C1O,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=C1C(O)OC(CO)C(O)C1O,1.3222192947339193,CCn1/c(=N/N=C2/Sc3cc(S(=O)(=O)[O-])ccc3[N+]2CC)sc2cc(S(=O)(=O)[O-])ccc21.OCC1OC(O)C(O)C(O)C1O__MSTSSSDPFFNFAKSSFRSAAAQKASASSLPPLPGPDKKVPGMDIKYDVVIVGSGPIGCTYARELVGAGYKVAMFDIGEIDSGLKIGAHKKNTVEYQKNIDKFVNVIQGQLMSVSVPVNTLVVDTLSPTSWQASTFFVRNGSNPEQDPLRNLSGQAVTRVVGGMSTHWTCATPRFDREQRPLLVKDDADADDAEWDRLYTKAESYFQTGTDQFKESIRHNLVLNKLTEEYKGQRDFQQIPLAATRRSPTFVEWSSANTVFDLQNRPNTDAPEERFNLFPAVACERVVRNALNSEIESLHIHDLISGDRFEIKADVYVLTAGAVHNTQLLVNSGFGQLGRPNPANPPELLPSLGSYITEQSLVFCQTVMSTELIDSVKSDMTIRGTPGELTYSVTYTPGASTNKHPDWWNEKVKNHMMQHQEDPLPIPFEDPEPQVTTLFQPSHPWHTQIHRDAFSYGAVQQSIDSRLIVDWRFFGRTEPKEENKLWFSDKITDAYNMPQPTFDFRFPAGRTSKEAEDMMTDMCVMSAKIGGFLPGSLPQFMEPGLVLHLGGTHRMGFDEKEDNCCVNTDSRVFGFKNLFLGGCGNIPTAYGANPTLTAMSLAIKSCEYIKQNFTPSPFTSEAQ,./data/raw/alphafold//AF-Q7ZA32-F1-model_v4.pdb,567,106,5819,335
+608,19540,19826,MLFSALLLEVIWILAADGGQHWTYEGPHGQDHWPASYPECGNNAQSPIDIQTDSVTFDPDLPALQPHGYDQPGTEPLDLHNNGHTVQLSLPSTLYLGGLPRKYVAAQLHLHWGQKGSPGGSEHQINSEATFAELHIVHYDSDSYDSLSEAAERPQGLAVLGILIEVGETKNIAYEHILSHLHEVRHKDQKTSVPPFNLRELLPKQLGQYFRYNGSLTTPPCYQSVLWTVFYRRSQISMEQLEKLQGTLFSTEEEPSKLLVQNYRALQPLNQRMVFASFIQAGSSYTTGEMLSLGVGILVGCLCLLLAVYFIARKIRKKRLENRKSVVFTSAQATTEA,sabio,Q9ULX7,O.O=C=O>>O=C(O)O,1000000.0,5.682159936665122e-15,25.0,7.5,4.2.1.1,9606.0,6.0,O.O=C=O,O=C(O)O,6.0,O.O=C=O__MLFSALLLEVIWILAADGGQHWTYEGPHGQDHWPASYPECGNNAQSPIDIQTDSVTFDPDLPALQPHGYDQPGTEPLDLHNNGHTVQLSLPSTLYLGGLPRKYVAAQLHLHWGQKGSPGGSEHQINSEATFAELHIVHYDSDSYDSLSEAAERPQGLAVLGILIEVGETKNIAYEHILSHLHEVRHKDQKTSVPPFNLRELLPKQLGQYFRYNGSLTTPPCYQSVLWTVFYRRSQISMEQLEKLQGTLFSTEEEPSKLLVQNYRALQPLNQRMVFASFIQAGSSYTTGEMLSLGVGILVGCLCLLLAVYFIARKIRKKRLENRKSVVFTSAQATTEA,./data/raw/alphafold//AF-Q9ULX7-F1-model_v4.pdb,297,2835,5157,6020
+609,21761,22086,MAHNEAVDVVLVGAGIMSATLAVLLKELDPGIKLEVVEQMDSGAAESSNPWNNAGTGHAGLCELNYTPQAADGSIDIKKAVHINAQFEVSKQFWAYLAQQGTFGSCKSFISPVPHLSYVQGEKGVSFLKKRFEVLSKHHAFSDMEYTEDKAKMAEWMPLMMPGRPADEVISATRVMHGTDVNFGALTQQLLKHLASAPDTQIKYSKKVTGLKRNGSGWTVSIKDTNSGNTRHIDAKFVFLGAGGAALPLLQASGIEESKGYGGFPVSGQWLRCDNPEVVKLHQAKVYSQAAVGSPPMSVPHLDTRVVDGKKSLLFGPYAGFTTKFLKHGSFMDLPMSIRLGNIGPMLAVARDNMDLTKYLVSEVRQSMEQRLDSLRRFYPQAKAEDWRLEIAGQRVQIIKKDPKKGGVLQFGTELVAAKDGSLAALLGASPGASVTVSIMLDLIERCFPQKAAGEWATKLKEIFPAREKTLETDAELYREISTRNSELLELVEPNTSIA,brenda,A0A0J6JSQ8,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>>Oc1ccc(Nc2cc(Cl)c(O)c(Cl)c2)cc1,7.22,38.60201404179868,30.0,5.5,1.1.5.4,47884.0,0.8585371975696391,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,Oc1ccc(Nc2cc(Cl)c(O)c(Cl)c2)cc1,0.8585371975696391,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__MAHNEAVDVVLVGAGIMSATLAVLLKELDPGIKLEVVEQMDSGAAESSNPWNNAGTGHAGLCELNYTPQAADGSIDIKKAVHINAQFEVSKQFWAYLAQQGTFGSCKSFISPVPHLSYVQGEKGVSFLKKRFEVLSKHHAFSDMEYTEDKAKMAEWMPLMMPGRPADEVISATRVMHGTDVNFGALTQQLLKHLASAPDTQIKYSKKVTGLKRNGSGWTVSIKDTNSGNTRHIDAKFVFLGAGGAALPLLQASGIEESKGYGGFPVSGQWLRCDNPEVVKLHQAKVYSQAAVGSPPMSVPHLDTRVVDGKKSLLFGPYAGFTTKFLKHGSFMDLPMSIRLGNIGPMLAVARDNMDLTKYLVSEVRQSMEQRLDSLRRFYPQAKAEDWRLEIAGQRVQIIKKDPKKGGVLQFGTELVAAKDGSLAALLGASPGASVTVSIMLDLIERCFPQKAAGEWATKLKEIFPAREKTLETDAELYREISTRNSELLELVEPNTSIA,./data/raw/alphafold//AF-A0A0J6JSQ8-F1-model_v4.pdb,3142,1933,3577,2410
+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
+611,10103,10254,MGKSESQMDITDINTPKPKKKQRWTPLEISLSVLVLLLTIIAVTMIALYATYDDGICKSSDCIKSAARLIQNMDATTEPCTDFFKYACGGWLKRNVIPETSSRYGNFDILRDELEVVLKDVLQEPKTEDIVAVQKAKALYRSCINESAIDSRGGEPLLKLLPDIYGWPVATENWEQKYGASWTAEKAIAQLNSKYGKKVLINLFVGTDDKNSVNHVIHIDQPRLGLPSRDYYECTGIYKEACTAYVDFMISVARLIRQEERLPIDENQLALEMNKVMELEKEIANATAKPEDRNDPMLLYNKMTLAQIQNNFSLEINGKPFSWLNFTNEIMSTVNISITNEEDVVVYAPEYLTKLKPILTKYSARDLQNLMSWRFIMDLVSSLSRTYKESRNAFRKALYGTTSETATWRRCANYVNGNMENAVGRLYVEAAFAGESKHVVEDLIAQIREVFIQTLDDLTWMDAETKKRAEEKALAIKERIGYPDDIVSNDNKLNNEYLELNYKEDEYFENIIQNLKFSQSKQLKKLREKVDKDEWISGAAVVNAFYSSGRNQIVFPAGILQPPFFSAQQSNSLNYGGIGMVIGHEITHGFDDNGRNFNKDGDLVDWWTQQSASNFKEQSQCMVYQYGNFSWDLAGGQHLNGINTLGENIADNGGLGQAYRAYQNYIKKNGEEKLLPGLDLNHKQLFFLNFAQVWCGTYRPEYAVNSIKTDVHSPGNFRIIGTLQNSAEFSEAFHCRKNSYMNPEKKCRVW,brenda,P08473,CSCC[C@H](N=C(O)[C@H](C)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CC(=N)O)N=C(O)[C@H](CO)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](C)N=C(O)[C@@H](N)CO)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](C)C(O)=NCC(O)=N[C@H]1CSSC[C@@H](C(=O)O)N=C(O)[C@H](CO)N=C(O)[C@H]([C@@H](C)O)N=C(O)[C@H](Cc2ccccc2)N=C(O)[C@H]([C@@H](C)O)N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc2c[nH]c3ccccc23)N=C(O)[C@H](Cc2ccccc2)N=C(O)[C@H](Cc2ccccc2)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](CCCCN)N=C1O.O>>,9.1,99.9684306264595,30.0,6.55,3.4.24.11,9606.0,0.9590413923210936,CSCC[C@H](N=C(O)[C@H](C)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CC(=N)O)N=C(O)[C@H](CO)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](C)N=C(O)[C@@H](N)CO)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](C)C(O)=NCC(O)=N[C@H]1CSSC[C@@H](C(=O)O)N=C(O)[C@H](CO)N=C(O)[C@H]([C@@H](C)O)N=C(O)[C@H](Cc2ccccc2)N=C(O)[C@H]([C@@H](C)O)N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc2c[nH]c3ccccc23)N=C(O)[C@H](Cc2ccccc2)N=C(O)[C@H](Cc2ccccc2)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](CCCCN)N=C1O.O,,0.9590413923210936,CSCC[C@H](N=C(O)[C@H](C)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CC(=N)O)N=C(O)[C@H](CO)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](C)N=C(O)[C@@H](N)CO)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCCN)C(O)=N[C@@H](C)C(O)=NCC(O)=N[C@H]1CSSC[C@@H](C(=O)O)N=C(O)[C@H](CO)N=C(O)[C@H]([C@@H](C)O)N=C(O)[C@H](Cc2ccccc2)N=C(O)[C@H]([C@@H](C)O)N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc2c[nH]c3ccccc23)N=C(O)[C@H](Cc2ccccc2)N=C(O)[C@H](Cc2ccccc2)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](CCCCN)N=C1O.O__MGKSESQMDITDINTPKPKKKQRWTPLEISLSVLVLLLTIIAVTMIALYATYDDGICKSSDCIKSAARLIQNMDATTEPCTDFFKYACGGWLKRNVIPETSSRYGNFDILRDELEVVLKDVLQEPKTEDIVAVQKAKALYRSCINESAIDSRGGEPLLKLLPDIYGWPVATENWEQKYGASWTAEKAIAQLNSKYGKKVLINLFVGTDDKNSVNHVIHIDQPRLGLPSRDYYECTGIYKEACTAYVDFMISVARLIRQEERLPIDENQLALEMNKVMELEKEIANATAKPEDRNDPMLLYNKMTLAQIQNNFSLEINGKPFSWLNFTNEIMSTVNISITNEEDVVVYAPEYLTKLKPILTKYSARDLQNLMSWRFIMDLVSSLSRTYKESRNAFRKALYGTTSETATWRRCANYVNGNMENAVGRLYVEAAFAGESKHVVEDLIAQIREVFIQTLDDLTWMDAETKKRAEEKALAIKERIGYPDDIVSNDNKLNNEYLELNYKEDEYFENIIQNLKFSQSKQLKKLREKVDKDEWISGAAVVNAFYSSGRNQIVFPAGILQPPFFSAQQSNSLNYGGIGMVIGHEITHGFDDNGRNFNKDGDLVDWWTQQSASNFKEQSQCMVYQYGNFSWDLAGGQHLNGINTLGENIADNGGLGQAYRAYQNYIKKNGEEKLLPGLDLNHKQLFFLNFAQVWCGTYRPEYAVNSIKTDVHSPGNFRIIGTLQNSAEFSEAFHCRKNSYMNPEKKCRVW,./data/raw/alphafold//AF-P08473-F1-model_v4.pdb,2897,1609,3207,1825
+612,20834,21145,MKSLVVVVLLLAVGLGAGQNNKGWWKNAVFYQIYPRSFMDSNNDGIGDLQGIKDKLSHFTESGITAIWLSPIYRSPMVDFGYDISDFKDIDPIFGTTEDLQDLTAEAKKRNLKVILDLVPNHTSDEHNWFQLSVNKTGKYKDYYVWVDPKNGTDPFEKRYPNNWLSVFNGTGWTFNEIRQQFYFHQFYKKQPDLNYRNPEVRKEMKSVMEFWLNNGIDGFRIDAIPHIYEVENISLNEPPIGQNLNLSLHASLNHIYTKDQPETYDLVREWRNFVDEYAKNNNRDEIVLLTEAYTSLNNTLRYYQYGANVPFNFKFITDANSSSTPEQFKTIIDNWVQGTPQNDVPNWVKGNHDRVRVSTRYPGRADHMIMLEMILPGVAVTYYGEEIGMEDNTTIYKYDVRDGCRTPFQWDNSINAGFSKVNESTLEKEWLPVHSSYKNGLNLEQEKKDNISHYHLYTNLTALRKRDVLKEGKLVTEILNKNVLAIVRQNEKEAVSLLINFSKNNTVVNISKLVDEGNNKIYTSSINSKLTANELVNPMAIDIPGDSSVIITSGATIVNYSIMTFLFVVFISFFQR,brenda,A1IHL0,O.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)O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O>>OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.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,15.0,1.659434146578659e-14,37.0,5.0,3.2.1.20,292787.0,1.1760912590556811,O.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)O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.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,1.1760912590556811,O.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)O[C@@H]4CO)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,450,3119,5406,6287
+613,5498,5584,MELPNIMHPVAKLSTALAAALMLSGCMPGEIRPTIGQQMETGDQRFGDLVFRQLAPNVWQHTSYLDMPGFGAVASNGLIVRDGGRVLVVDTAWTDDQTAQILNWIKQEINLPVALAVVTHAHQDKMGGMDALHAAGIATYANALSNQLAPQEGMVAAQHSLTFAANGWVEPATAPNFGPLKVFYPGPGHTSDNITVGIDGTDIAFGGCLIKDSKAKSLGNLGDADTEHYAASARAFGAAFPKASMIVMSHSAPDSRAAITHTARMADKLR,brenda,C7C422,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O>>,447.0,99.72857581013334,25.0,7.2,3.5.2.6,573.0,2.6503075231319366,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O,,2.671728088239558,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O__MELPNIMHPVAKLSTALAAALMLSGCMPGEIRPTIGQQMETGDQRFGDLVFRQLAPNVWQHTSYLDMPGFGAVASNGLIVRDGGRVLVVDTAWTDDQTAQILNWIKQEINLPVALAVVTHAHQDKMGGMDALHAAGIATYANALSNQLAPQEGMVAAQHSLTFAANGWVEPATAPNFGPLKVFYPGPGHTSDNITVGIDGTDIAFGGCLIKDSKAKSLGNLGDADTEHYAASARAFGAAFPKASMIVMSHSAPDSRAAITHTARMADKLR,./data/raw/alphafold//AF-C7C422-F1-model_v4.pdb,1454,984,793,1104
+614,23164,23507,MAPSQRPLSRRGLLAGGAIAAAAGALAACSEERAAGARPSATQTTGTATEPFHGPHQAGIATPPQAHAVFLGLDLRKGTGRKELGRLMRLLTDDARRLTQGRPALADPEPDLAPLPSRLTFTFGFGPGLFKAAGLEKQRPEGLRPLPPFKVDRLEDRWSGGDLLVQICCDDPITLAHALRMTVKDARAFTRVRWVQRGFRRSPGVQSSGATQRNLMGQLDGTVNPVPGTADFDQAVWVQDGPEWLRGGTTLVLRRIRMELEKWDEADPAGKEFAVGRRLTSGAPLTGRHEHDEPDFDAVDSAGFPVIAENAHIRLAHVDSPRLRMLRRPYNYDEGLTADGRSDAGLLFAAYQADIDRQFIPVQRRLDEGGDLLNLWTTPIGSAVFAIPPGCDENGWIGQGLLG,brenda,D1A807,OO.Oc1ccccc1O.[H+]>>,24.0,99.31569655247922,22.0,3.0,1.11.1.19,2020.0,1.380211241711606,OO.Oc1ccccc1O.[H+],,1.380211241711606,OO.Oc1ccccc1O.[H+]__MAPSQRPLSRRGLLAGGAIAAAAGALAACSEERAAGARPSATQTTGTATEPFHGPHQAGIATPPQAHAVFLGLDLRKGTGRKELGRLMRLLTDDARRLTQGRPALADPEPDLAPLPSRLTFTFGFGPGLFKAAGLEKQRPEGLRPLPPFKVDRLEDRWSGGDLLVQICCDDPITLAHALRMTVKDARAFTRVRWVQRGFRRSPGVQSSGATQRNLMGQLDGTVNPVPGTADFDQAVWVQDGPEWLRGGTTLVLRRIRMELEKWDEADPAGKEFAVGRRLTSGAPLTGRHEHDEPDFDAVDSAGFPVIAENAHIRLAHVDSPRLRMLRRPYNYDEGLTADGRSDAGLLFAAYQADIDRQFIPVQRRLDEGGDLLNLWTTPIGSAVFAIPPGCDENGWIGQGLLG,./data/raw/alphafold//AF-D1A807-F1-model_v4.pdb,3428,2329,1048,2949
+615,6194,6303,MLNNAMSVVILAAGKGTRMYSDLPKVLHTLAGKAMVQHVIDAANELGAAHVHLVYGHGGDLLKQALKDDNLNWVLQAEQLGTGHAMQQAAPFFADDEDILMLYGDVPLISVETLQRLRDAKPQGGIGLLTVKLDDPTGYGRITRENGKVTGIVEHKDATDEQRQIQEINTGILIANGADMKRWLAKLTNNNAQGEYYITDIIALAYQEGREIVAVHPQRLSEVEGVNNRLQLSRLERVYQSEQAEKLLLAGVMLRDPARFDLRGTLTHGRDVEIDTNVIIEGNVTLGHRVKIGTGCVIKNSVIGDDCEISPYTVVEDANLAAACTIGPFARLRPGAELLEGAHVGNFVEMKKARLGKGSKAGHLTYLGDAEIGDNVNIGAGTITCNYDGANKFKTIIGDDVFVGSDTQLVAPVTVGKGATIAAGTTVTRNVGENALAISRVPQTQKEGWRRPVKKK,sabio,P0ACC7,CCC(=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.NC1C(OP(=O)(O)O)OC(CO)C(O)C1O>>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,9.5,17.02671154331261,,7.6,2.3.1.157,562.0,0.9777236052888478,CCC(=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.NC1C(OP(=O)(O)O)OC(CO)C(O)C1O,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,0.9777236052888478,CCC(=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.NC1C(OP(=O)(O)O)OC(CO)C(O)C1O__MLNNAMSVVILAAGKGTRMYSDLPKVLHTLAGKAMVQHVIDAANELGAAHVHLVYGHGGDLLKQALKDDNLNWVLQAEQLGTGHAMQQAAPFFADDEDILMLYGDVPLISVETLQRLRDAKPQGGIGLLTVKLDDPTGYGRITRENGKVTGIVEHKDATDEQRQIQEINTGILIANGADMKRWLAKLTNNNAQGEYYITDIIALAYQEGREIVAVHPQRLSEVEGVNNRLQLSRLERVYQSEQAEKLLLAGVMLRDPARFDLRGTLTHGRDVEIDTNVIIEGNVTLGHRVKIGTGCVIKNSVIGDDCEISPYTVVEDANLAAACTIGPFARLRPGAELLEGAHVGNFVEMKKARLGKGSKAGHLTYLGDAEIGDNVNIGAGTITCNYDGANKFKTIIGDDVFVGSDTQLVAPVTVGKGATIAAGTTVTRNVGENALAISRVPQTQKEGWRRPVKKK,./data/raw/alphafold//AF-P0ACC7-F1-model_v4.pdb,1391,899,697,988
+616,13008,13181,MSGWARALLLAAVLVVMACLVPAATASLHAEETLTSQFAEFKQKHGRVYESAAEEAFRLSVFRENLFLARLHAAANPHATFGVTPFSDLTREEFRSRYHNGAAHFAAAQERARVPVKVEVVGAPAAVDWRARGAVTAVKDQGQCGSCWAFSAIGNVECQWFLAGHPLTNLSEQMLVSCDKTDSGCSGGLMNNAFEWIVQENNGAVYTEDSYPYASGEGISPPCTTSGHTVGATITGHVELPQDEAQIAAWLAVNGPVAVAVDASSWMTYTGGVMTSCVSEQLDHGVLLVGYNDSAAVPYWIIKNSWTTQWGEEGYIRIAKGSNQCLVKEEASSAVVGGPGPTPEPTTTTTTSAPGPSPSYFVQMSCTDAACIVGCENVTLPTGQCLLTTSGVSAIVTCGAETLTEEVFLTSTHCSGPSVRSSVPLNKCNRLLRGSVEFFCGSSSSGRLADVDRQRRHQPYHSRHRRL,uniprot_search,P25779,N=C(N)NCCC[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O.O>>,0.13,99.89010687106789,37.0,5.5,3.4.22.51,5693.0,-0.8860566476931633,N=C(N)NCCC[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O.O,,-0.8860566476931633,N=C(N)NCCC[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O.O__MSGWARALLLAAVLVVMACLVPAATASLHAEETLTSQFAEFKQKHGRVYESAAEEAFRLSVFRENLFLARLHAAANPHATFGVTPFSDLTREEFRSRYHNGAAHFAAAQERARVPVKVEVVGAPAAVDWRARGAVTAVKDQGQCGSCWAFSAIGNVECQWFLAGHPLTNLSEQMLVSCDKTDSGCSGGLMNNAFEWIVQENNGAVYTEDSYPYASGEGISPPCTTSGHTVGATITGHVELPQDEAQIAAWLAVNGPVAVAVDASSWMTYTGGVMTSCVSEQLDHGVLLVGYNDSAAVPYWIIKNSWTTQWGEEGYIRIAKGSNQCLVKEEASSAVVGGPGPTPEPTTTTTTSAPGPSPSYFVQMSCTDAACIVGCENVTLPTGQCLLTTSGVSAIVTCGAETLTEEVFLTSTHCSGPSVRSSVPLNKCNRLLRGSVEFFCGSSSSGRLADVDRQRRHQPYHSRHRRL,./data/raw/alphafold//AF-P25779-F1-model_v4.pdb,1573,1145,984,1328
+617,22238,22571,MNRISRRTILFGLAAAPLGLAVGCGPDPAAKSATLAEAGTSRPLPIPPLAESTVDDAGVRHFTLRAGAGTTEIVAGKLTDTWGFNGSILGPTVRAERGESVAFTIDNTLAEPTTVHWHGMHLPARYDGGPHQTIEAGGRWEPAWTIGQPASTLWYHPHPHGSTERHVQRGLAGLFLIDDADTRALDIPKTYGVDDVPLIIQDRRFLADGSFDESDPTDIGLLGDTIVTNGISDAYLDVTTGVVRLRILNGSSGRLYNLGFPDDRTFDLIATDCGLLESPIAIKRIQLSPGERAEIVVRVDPGATTTLVSFPIEDGGGVSSSDAENFGMNDRFDIIELRGVASRASRSTLPAQLAALPRLDPSKASVSRTFDLQWYMINGQRMDMNRIDFEAEVGATEVWTITNKDNWPHNFHVHDVQFQILDVDGRTPPPHLRGLKDTVYTPPGSRVRVALQWSEYTDPTFPYMFHCHLLMHEDQGMMGQFLVLEPGQKAAPMQMDMPMDMPMPGSHSGH,sabio,L7P6C5,O=O.[Cu+].[H]>>O.[Cu+2],558.0,8.36957674763975,30.0,5.5,1.10.3.2,1833.0,2.7466341989375787,O=O.[Cu+].[H],O.[Cu+2],2.7466341989375787,O=O.[Cu+].[H]__MNRISRRTILFGLAAAPLGLAVGCGPDPAAKSATLAEAGTSRPLPIPPLAESTVDDAGVRHFTLRAGAGTTEIVAGKLTDTWGFNGSILGPTVRAERGESVAFTIDNTLAEPTTVHWHGMHLPARYDGGPHQTIEAGGRWEPAWTIGQPASTLWYHPHPHGSTERHVQRGLAGLFLIDDADTRALDIPKTYGVDDVPLIIQDRRFLADGSFDESDPTDIGLLGDTIVTNGISDAYLDVTTGVVRLRILNGSSGRLYNLGFPDDRTFDLIATDCGLLESPIAIKRIQLSPGERAEIVVRVDPGATTTLVSFPIEDGGGVSSSDAENFGMNDRFDIIELRGVASRASRSTLPAQLAALPRLDPSKASVSRTFDLQWYMINGQRMDMNRIDFEAEVGATEVWTITNKDNWPHNFHVHDVQFQILDVDGRTPPPHLRGLKDTVYTPPGSRVRVALQWSEYTDPTFPYMFHCHLLMHEDQGMMGQFLVLEPGQKAAPMQMDMPMDMPMPGSHSGH,./data/raw/alphafold//AF-L7P6C5-F1-model_v4.pdb,3404,2294,3998,2890
+618,12360,12530,MKAMILAAGKGTRVRPITHTIPKPMIPILQKPVMEFLLELLRQHGFDQIMVNVSHLAEEIESYFRDGQRFGVQIAYSFEGNIVDGDLVGKALGSAGGLKKIQEFNPFFDDTFVVLCGDALIDLDLTTAVKLHREKGAIATIITKTVPQELVSSYGVVVTDDNGKILTFQEKPAVEEALSTEINTGIYIFEPEVIDYIPSGQEYDLGGDLFPKLVDSGLPFYAVNMDFEWVDIGKVPDYWQAIRGVLSREIKNVQIPGIEVRPGVYTGINVAANWDNIEIEGPVYIGGMTRIEDGVKIIGPSMIGPSCLICQGAVVDNSVIFEYSRLGPGARLVDKLVFGRYCVDKTGAAIDVQAAALDWLITDARHAAVQYRQEYPSQREISKLLQPE,brenda,P74285,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O.O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O>>Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O2)c(=O)nc1O.O=P(O)(O)OP(=O)(O)O,0.45,0.0,37.0,7.5,2.7.7.9,1143.0,-0.3467874862246563,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O.O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O2)c(=O)nc1O.O=P(O)(O)OP(=O)(O)O,-0.3467874862246563,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O.O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O__MKAMILAAGKGTRVRPITHTIPKPMIPILQKPVMEFLLELLRQHGFDQIMVNVSHLAEEIESYFRDGQRFGVQIAYSFEGNIVDGDLVGKALGSAGGLKKIQEFNPFFDDTFVVLCGDALIDLDLTTAVKLHREKGAIATIITKTVPQELVSSYGVVVTDDNGKILTFQEKPAVEEALSTEINTGIYIFEPEVIDYIPSGQEYDLGGDLFPKLVDSGLPFYAVNMDFEWVDIGKVPDYWQAIRGVLSREIKNVQIPGIEVRPGVYTGINVAANWDNIEIEGPVYIGGMTRIEDGVKIIGPSMIGPSCLICQGAVVDNSVIFEYSRLGPGARLVDKLVFGRYCVDKTGAAIDVQAAALDWLITDARHAAVQYRQEYPSQREISKLLQPE,./data/raw/alphafold//AF-P74285-F1-model_v4.pdb,2071,4249,4126,3977
+619,13439,13616,MAVRRALIVLAHAERTSFNYAMKEAAVEALKKKGWEVVESDLYAMNFNPLISRNDITGEPKDSENFQYPVESSLAYKEGRLSPDIVAEQKKLEAADLVIFQFPLYWFGVPAILKGWFERVLVAGFAYTYATMYDKGPFQNKKTLLSITTGGSGSMYSLQGVHGDMNVILWPIQSGILRFCGFQVLEPQLVYSIGHTPPDARVQVLEGWKKRLETVWEESPLYFAPSSLFDLNFQAGFLLKKEVQEEQKKNKFGLSVGHHLGKSIPADNQIKARK,uniprot_search,P05982,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=C1C=CC(=O)c2ccccc21.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.Oc1ccc(O)c2ccccc12,431.0,0.0,25.0,7.0,1.6.5.2,10116.0,2.6344772701607315,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=C1C=CC(=O)c2ccccc21.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.Oc1ccc(O)c2ccccc12,2.6344772701607315,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=C1C=CC(=O)c2ccccc21.[H+]__MAVRRALIVLAHAERTSFNYAMKEAAVEALKKKGWEVVESDLYAMNFNPLISRNDITGEPKDSENFQYPVESSLAYKEGRLSPDIVAEQKKLEAADLVIFQFPLYWFGVPAILKGWFERVLVAGFAYTYATMYDKGPFQNKKTLLSITTGGSGSMYSLQGVHGDMNVILWPIQSGILRFCGFQVLEPQLVYSIGHTPPDARVQVLEGWKKRLETVWEESPLYFAPSSLFDLNFQAGFLLKKEVQEEQKKNKFGLSVGHHLGKSIPADNQIKARK,./data/raw/alphafold//AF-P05982-F1-model_v4.pdb,3169,1965,3609,2408
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+629,11789,11947,MTIAKLVHRRFHNIPGKFRVAELFFDVPLNYSRPNDDTIRLFARSVRRLVTYPDQERDERYIPWFVYLQGGPGFGCSPPQDYGWVGTVLDKGYQILFLDQRGTGLSSTITAKTLALQGNAARQAEYLRHFRADNIVRDCEAVRKCLTADYPEENQKWSVLGQSFGGFCAVTYLSKFPEGLREVFTTGGLPPLVNGPEPVYKRTYEKVAQRNETYYKKYPEDADRVKRIYKYLRENKVALPSGTLTPARFQQLGIMFGAHGGLDSVHDIVLRATNDLDLFGFLTHPTLSIIDSHGGFDNNVIYAILHEVIYCQGQSSLWAADRLRATDSRFQIDSNEPQIYFTGEMIFRDMFESYHELSQLQLVADIIASYDDWPALYDEEQLARNEVPVYSATYVDDMYVHFDLATATASKIKGLKQFITNAMYHDALRTKTDELIRQLFALKEDSID,brenda,Q8X1C7,Cc1cc(=O)oc2cc(N=C(O)[C@@H]3CCCN3)ccc12.O>>Cc1cc(=O)oc2cc(N)ccc12.O=C(O)[C@@H]1CCCN1,213.7,9.77298918929094e-15,37.0,5.0,3.4.11.5,68825.0,2.329804522164069,Cc1cc(=O)oc2cc(N=C(O)[C@@H]3CCCN3)ccc12.O,Cc1cc(=O)oc2cc(N)ccc12.O=C(O)[C@@H]1CCCN1,2.329804522164069,Cc1cc(=O)oc2cc(N=C(O)[C@@H]3CCCN3)ccc12.O__MTIAKLVHRRFHNIPGKFRVAELFFDVPLNYSRPNDDTIRLFARSVRRLVTYPDQERDERYIPWFVYLQGGPGFGCSPPQDYGWVGTVLDKGYQILFLDQRGTGLSSTITAKTLALQGNAARQAEYLRHFRADNIVRDCEAVRKCLTADYPEENQKWSVLGQSFGGFCAVTYLSKFPEGLREVFTTGGLPPLVNGPEPVYKRTYEKVAQRNETYYKKYPEDADRVKRIYKYLRENKVALPSGTLTPARFQQLGIMFGAHGGLDSVHDIVLRATNDLDLFGFLTHPTLSIIDSHGGFDNNVIYAILHEVIYCQGQSSLWAADRLRATDSRFQIDSNEPQIYFTGEMIFRDMFESYHELSQLQLVADIIASYDDWPALYDEEQLARNEVPVYSATYVDDMYVHFDLATATASKIKGLKQFITNAMYHDALRTKTDELIRQLFALKEDSID,./data/raw/alphafold//AF-Q8X1C7-F1-model_v4.pdb,1925,4068,1922,3754
+630,1540,1568,MLNNAMSVVILAAGKGTRMYSDLPKVLHTLAGKAMVQHVIDAANELGAAHVHLVYGHGGDLLKQALKDDNLNWVLQAEQLGTGHAMQQAAPFFADDEDILMLYGDVPLISVETLQRLRDAKPQGGIGLLTVKLDDPTGYGRITRENGKVTGIVEHKDATDEQRQIQEINTGILIANGADMKRWLAKLTNNNAQGEYYITDIIALAYQEGREIVAVHPQRLSEVEGVNNRLQLSRLERVYQSEQAEKLLLAGVMLRDPARFDLRGTLTHGRDVEIDTNVIIEGNVTLGHRVKIGTGCVIKNSVIGDDCEISPYTVVEDANLAAACTIGPFARLRPGAELLEGAHVGNFVEMKKARLGKGSKAGHLTYLGDAEIGDNVNIGAGTITCNYDGANKFKTIIGDDVFVGSDTQLVAPVTVGKGATIAAGTTVTRNVGENALAISRVPQTQKEGWRRPVKKK,sabio,P0ACC7,CC(=O)NC1C(OP(=O)(O)O)OC(CO)C(O)C1O.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1>>CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1O.O=P(O)(O)OP(=O)(O)O,350.0,2.170071015316634e-14,37.0,8.2,2.7.7.23,562.0,2.544068044350276,CC(=O)NC1C(OP(=O)(O)O)OC(CO)C(O)C1O.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1O.O=P(O)(O)OP(=O)(O)O,2.544068044350276,CC(=O)NC1C(OP(=O)(O)O)OC(CO)C(O)C1O.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1__MLNNAMSVVILAAGKGTRMYSDLPKVLHTLAGKAMVQHVIDAANELGAAHVHLVYGHGGDLLKQALKDDNLNWVLQAEQLGTGHAMQQAAPFFADDEDILMLYGDVPLISVETLQRLRDAKPQGGIGLLTVKLDDPTGYGRITRENGKVTGIVEHKDATDEQRQIQEINTGILIANGADMKRWLAKLTNNNAQGEYYITDIIALAYQEGREIVAVHPQRLSEVEGVNNRLQLSRLERVYQSEQAEKLLLAGVMLRDPARFDLRGTLTHGRDVEIDTNVIIEGNVTLGHRVKIGTGCVIKNSVIGDDCEISPYTVVEDANLAAACTIGPFARLRPGAELLEGAHVGNFVEMKKARLGKGSKAGHLTYLGDAEIGDNVNIGAGTITCNYDGANKFKTIIGDDVFVGSDTQLVAPVTVGKGATIAAGTTVTRNVGENALAISRVPQTQKEGWRRPVKKK,./data/raw/alphafold//AF-P0ACC7-F1-model_v4.pdb,1391,899,697,988
+631,2248,2281,MPDQRSESGRFDVEVDVLVAGSGGGVAGAYTAAREGLSVLLVEATDKFGGTTAFSGGGGMWFPCNPVLERAGTDDTLDEALKYFHAVVGDRTPQELQDAYVTGGAGFIAYLEQDHGFEFAVLPWPDYYGSVPGARNDGYRHIVPKPLPDSALGSYQGLVRGPLDTERLGAPAPDTLIGGRALVGRFLAALDKLPNADCWCEAPLTELITESGRVVGAIVERGGERLRVCARRGVLLASGGFEQNADMRGRYGVPGSATDTMGGPGSTGAAHRAAMAVGADVDLMDQAWWSPGLTHPDGRSAFALWFTGGIFVDQDGKRFVNESAPYDRLGRAVIERLESGRLTLPYWMVYDSRAGDVPPVGATNVSMVDPAEYRAAGLWRSAETISGLAEEIGVPADALEATIQRFNEMATAGHDDDFGRGDEAYDRVFTGGASPLVPIDTPPYHAAAFGLSDLGTKGGLRTDTRARVRGRDGEPIPGLYAAGNTMAAVSGTTYPGGGNPIGASMLFSHFAALDMAAEGTTA,brenda,A0QW99,CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C.O=C1C=CC(=Nc2cc(Cl)c(O)c(Cl)c2)C=C1>>Oc1ccc(Nc2cc(Cl)c(O)c(Cl)c2)cc1,110.4,37.76690790426845,25.0,8.0,1.3.99.4,1772.0,2.04296907339318,CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C.O=C1C=CC(=Nc2cc(Cl)c(O)c(Cl)c2)C=C1,Oc1ccc(Nc2cc(Cl)c(O)c(Cl)c2)cc1,2.04296907339318,CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C.O=C1C=CC(=Nc2cc(Cl)c(O)c(Cl)c2)C=C1__MPDQRSESGRFDVEVDVLVAGSGGGVAGAYTAAREGLSVLLVEATDKFGGTTAFSGGGGMWFPCNPVLERAGTDDTLDEALKYFHAVVGDRTPQELQDAYVTGGAGFIAYLEQDHGFEFAVLPWPDYYGSVPGARNDGYRHIVPKPLPDSALGSYQGLVRGPLDTERLGAPAPDTLIGGRALVGRFLAALDKLPNADCWCEAPLTELITESGRVVGAIVERGGERLRVCARRGVLLASGGFEQNADMRGRYGVPGSATDTMGGPGSTGAAHRAAMAVGADVDLMDQAWWSPGLTHPDGRSAFALWFTGGIFVDQDGKRFVNESAPYDRLGRAVIERLESGRLTLPYWMVYDSRAGDVPPVGATNVSMVDPAEYRAAGLWRSAETISGLAEEIGVPADALEATIQRFNEMATAGHDDDFGRGDEAYDRVFTGGASPLVPIDTPPYHAAAFGLSDLGTKGGLRTDTRARVRGRDGEPIPGLYAAGNTMAAVSGTTYPGGGNPIGASMLFSHFAALDMAAEGTTA,./data/raw/alphafold//AF-A0QW99-F1-model_v4.pdb,1436,3891,6209,872
+632,22177,22510,GSGSAATDKFKAERATADTSPERLAAIAKDALGALNDVILKHGVTYPEYRVFKQWLIDVGEGGEWPLFLDVFIEHSVEEVLARSRKGTMGSIEGPYYIENSPELPSKCTLPMREEDEKITPLVFSGQVTDLDGNGLAGAKVELWHADNDGYYSQFAPHLPEWNLRGTIIADEEGRYEITTIQPAPYQIPTDGPTGQFIEAQNGHPWRPAHLHLIVSAPGKESVTTQLYFKGGEWIDSDVASATKPELILDPKTGDDGKNYVTYNFVLDPA,brenda,P95607,O=O.Oc1cccc(O)c1O>>O=C(O)/C=C\C=C(\O)C(=O)O,2.41,0.0,25.0,7.2,1.13.11.1,37919.0,0.3820170425748684,O=O.Oc1cccc(O)c1O,O=C(O)/C=C\C=C(\O)C(=O)O,0.3820170425748684,O=O.Oc1cccc(O)c1O__GSGSAATDKFKAERATADTSPERLAAIAKDALGALNDVILKHGVTYPEYRVFKQWLIDVGEGGEWPLFLDVFIEHSVEEVLARSRKGTMGSIEGPYYIENSPELPSKCTLPMREEDEKITPLVFSGQVTDLDGNGLAGAKVELWHADNDGYYSQFAPHLPEWNLRGTIIADEEGRYEITTIQPAPYQIPTDGPTGQFIEAQNGHPWRPAHLHLIVSAPGKESVTTQLYFKGGEWIDSDVASATKPELILDPKTGDDGKNYVTYNFVLDPA,./data/raw/alphafold//AF-P95607-F1-model_v4.pdb,1996,4152,4018,3861
+633,21276,21600,MTASLTTKFLNNTYENPFMNASGVHCMTTQELDELANSKAGAFITKSATTLEREGNPEPRYISVPLGSINSMGLPNEGIDYYLSYVLNRQKNYPDAPAIFFSVAGMSIDENLNLLRKIQDSEFNGITELNLSCPNVPGKPQVAYDFDLTKETLEKVFAFFKKPLGVKLPPYFDFAHFDIMAKILNEFPLAYVNSINSIGNGLFIDVEKESVVVKPKNGFGGIGGEYVKPTALANVRAFYTRLRPEIKVIGTGGIKSGKDAFEHLLCGASMLQIGTELQKEGVKIFERIEKELKDIMEAKGYTSIDQFRGKLNSI,uniprot_search,A0A8H4BXQ1,O=C(O)C1N=C(O)NC(O)=N1>>O=C([O-])c1nc(O)[nH]c(=O)n1,39.0,10000000.0,30.0,7.333333333333333,1.3.98.1,4932.0,1.591064607026499,O=C(O)C1N=C(O)NC(O)=N1,O=C([O-])c1nc(O)[nH]c(=O)n1,1.591064607026499,O=C(O)C1N=C(O)NC(O)=N1__MTASLTTKFLNNTYENPFMNASGVHCMTTQELDELANSKAGAFITKSATTLEREGNPEPRYISVPLGSINSMGLPNEGIDYYLSYVLNRQKNYPDAPAIFFSVAGMSIDENLNLLRKIQDSEFNGITELNLSCPNVPGKPQVAYDFDLTKETLEKVFAFFKKPLGVKLPPYFDFAHFDIMAKILNEFPLAYVNSINSIGNGLFIDVEKESVVVKPKNGFGGIGGEYVKPTALANVRAFYTRLRPEIKVIGTGGIKSGKDAFEHLLCGASMLQIGTELQKEGVKIFERIEKELKDIMEAKGYTSIDQFRGKLNSI,./data/raw/esmfold//ESMFold-A0A8H4BXQ1-v1.pdb,3174,1969,5698,4098
+634,5178,5264,MGRLDGKVIILTAAAQGIGQAAALAFAREGAKVIATDINESKLQELEKYPGIQTRVLDVTKKKQIDQFANEVERLDVLFNVAGFVHHGTVLDCEEKDWDFSMNLNVRSMYLMIKAFLPKMLAQKSGNIINMSSVASSVKGVVNRCVYSTTKAAVIGLTKSVAADFIQQGIRCNCVCPGTVDTPSLQERIQARGNPEEARNDFLKRQKTGRFATAEEIAMLCVYLASDESAYVTGNPVIIDGGWSL,sabio,Q9BUT1,CC(O)CC(=O)O.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(=O)CC(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],57.0,0.0,25.0,7.5,1.1.1.30,9606.0,1.7558748556724917,CC(O)CC(=O)O.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(=O)CC(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],2.1583624920952498,CC(O)CC(=O)O.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__MGRLDGKVIILTAAAQGIGQAAALAFAREGAKVIATDINESKLQELEKYPGIQTRVLDVTKKKQIDQFANEVERLDVLFNVAGFVHHGTVLDCEEKDWDFSMNLNVRSMYLMIKAFLPKMLAQKSGNIINMSSVASSVKGVVNRCVYSTTKAAVIGLTKSVAADFIQQGIRCNCVCPGTVDTPSLQERIQARGNPEEARNDFLKRQKTGRFATAEEIAMLCVYLASDESAYVTGNPVIIDGGWSL,./data/raw/alphafold//AF-Q9BUT1-F1-model_v4.pdb,3097,1861,3493,2309
+635,16272,16499,MQAATSCDLKFRSTDPTSRNKCFSHAIPKRVAVTCGYRSESFSFPNGVSVSRSDWQSSCAILSSKVASVENTGGLADKIAAVNGHTNGSVNLGLVAVESTNGKLAPAQPLTITDLSPAPLHGSSLRVAYQGVPGAYSEAAAGKAYPNCDAIPCDQFDVAFQAVELWIADRAVLPVENSLGGSIHRNYDLLLRHRLHIVGEVQIPVHHCLLALPGVRTDCVSRVISHPQALAQTEHSLDVLTPHAAREAFHDTAAAAEYISANDLHDTAAVASARAAELYNLQILADGIQDDPGNVTRFLMLAREPIIPRTDRPFKTSIVFAAQEHKGTSVLFKVLSAFAFRDISLTKIESRPHHNRPLRVVGDGSFGTSKNFEYMFYVDFEASMAEPRAQNALAEVQEYTSFLRVLGSYPMDMTPWSMTSTEEA,sabio,O22241,NC(CC1(C(=O)O)C=CC(O)C=C1)C(=O)O>>NC(Cc1ccccc1)C(=O)O.O.O=C=O,4.9,6.2406043998673835e-15,37.0,7.5,4.2.1.91,3702.0,0.6901960800285137,NC(CC1(C(=O)O)C=CC(O)C=C1)C(=O)O,NC(Cc1ccccc1)C(=O)O.O.O=C=O,0.6901960800285137,NC(CC1(C(=O)O)C=CC(O)C=C1)C(=O)O__MQAATSCDLKFRSTDPTSRNKCFSHAIPKRVAVTCGYRSESFSFPNGVSVSRSDWQSSCAILSSKVASVENTGGLADKIAAVNGHTNGSVNLGLVAVESTNGKLAPAQPLTITDLSPAPLHGSSLRVAYQGVPGAYSEAAAGKAYPNCDAIPCDQFDVAFQAVELWIADRAVLPVENSLGGSIHRNYDLLLRHRLHIVGEVQIPVHHCLLALPGVRTDCVSRVISHPQALAQTEHSLDVLTPHAAREAFHDTAAAAEYISANDLHDTAAVASARAAELYNLQILADGIQDDPGNVTRFLMLAREPIIPRTDRPFKTSIVFAAQEHKGTSVLFKVLSAFAFRDISLTKIESRPHHNRPLRVVGDGSFGTSKNFEYMFYVDFEASMAEPRAQNALAEVQEYTSFLRVLGSYPMDMTPWSMTSTEEA,./data/raw/alphafold//AF-O22241-F1-model_v4.pdb,2634,3324,2254,5138
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+664,22222,22555,MYWRFQMTKAKTMMPLSVSRRRFVQGLAVGGLLATFPHIVRAGSAFKDNAFTGYATELSGNVIDLTIGEALVNFTGVVRKATTINGSIPAPTLRLREGDDVTIRVTNTLSVPSSIHWHGIILPYQMDGVPGMSFRGIMPGETFVYRFTLKQSGTYWYHSHSGFQEMTGMYGALIIEPKAQDVIAADREYVVQLSDWTDEDPHTAFRKLKVQSDLYNFNQPTVQDMLRDITDRGLDAALAKRQMWQQMRMNPTDLADISAATFTYLINGSSPLANWRGLFKRGERVRLRFINGSSNSFFDVRIPELKMTVVQADGQNVHSVTVDEFRFGPGETYDVVVSPQMMPTPFLPRAWTAVAMPAVPWPWPRACMHRCLRWIRWNGCRWLTCWAICTMAQATATATATARWRTAMARKIIASMVLWLSITVSMARAVPYAKASSTVRHASTEYGPSVDMRVDMPRTNLDDPGIGLRNTGRRALTLADLHSLDGIIEPGGPEAEIELHLTGNMERYTWSFDGLEFSKSTPVHMKHNQRIRVILQNDTMMTHPMHLHGMWSDLESDNGAVQVRRHTIPVQPAQRISFLTTPHDVGRWAWHCHLLFHMDAGMFREVVVS,sabio,A0A3G8G7Z6,O=O.Oc1ccccc1O>>O,28.47,77.0178432893716,55.0,7.0,1.10.3.2,1869214.0,1.454387467146955,O=O.Oc1ccccc1O,O,1.454387467146955,O=O.Oc1ccccc1O__MYWRFQMTKAKTMMPLSVSRRRFVQGLAVGGLLATFPHIVRAGSAFKDNAFTGYATELSGNVIDLTIGEALVNFTGVVRKATTINGSIPAPTLRLREGDDVTIRVTNTLSVPSSIHWHGIILPYQMDGVPGMSFRGIMPGETFVYRFTLKQSGTYWYHSHSGFQEMTGMYGALIIEPKAQDVIAADREYVVQLSDWTDEDPHTAFRKLKVQSDLYNFNQPTVQDMLRDITDRGLDAALAKRQMWQQMRMNPTDLADISAATFTYLINGSSPLANWRGLFKRGERVRLRFINGSSNSFFDVRIPELKMTVVQADGQNVHSVTVDEFRFGPGETYDVVVSPQMMPTPFLPRAWTAVAMPAVPWPWPRACMHRCLRWIRWNGCRWLTCWAICTMAQATATATATARWRTAMARKIIASMVLWLSITVSMARAVPYAKASSTVRHASTEYGPSVDMRVDMPRTNLDDPGIGLRNTGRRALTLADLHSLDGIIEPGGPEAEIELHLTGNMERYTWSFDGLEFSKSTPVHMKHNQRIRVILQNDTMMTHPMHLHGMWSDLESDNGAVQVRRHTIPVQPAQRISFLTTPHDVGRWAWHCHLLFHMDAGMFREVVVS,./data/raw/alphafold//AF-A0A3G8G7Z6-F1-model_v4.pdb,3410,2313,1024,2921
+665,12565,12735,MSRGHKKITVLGAGVAGLVAAHELEELGHEVEVLEGSDRLGGRVHTHRFGEGGSVPFVELGAMRIPTKHRHTIDYIGKLGLTPKLKEFKTLFSDDGAYHTTSAGFVRVRDAAKVLVDEFRLLMSGRDLREETILFGAWLTAVGDAIAPADFRAALRTDFTADLLEVVDRIDLDPFLVGAARDQFDLHAFFAAHPEVRTSCTGKLNRFVDDILDETSPRLLRLEGGMDQLVDALVERIRGDIRTGHEVSAIDVREDHVAVTVHNGHGVNTLRSDHVLCTIPFSVLRNLRLTGLSTDKLEIIHDVKYWSATKVAFRCREPFWERDGINGGASFGGGRIRQTYYPPVEGDPTRGAVLLASYTMGDDADVLGGMPEAQRHEVVLDEVGRMHPELHEPGMVVEAVSRAWGEDRWSNGAGVTRWGKDVAACEEERDRAARPEGRLYFAGEHCSSTTAWIDGAVESALAAVRAIEAGDGR,brenda,Q8KHS0,Cn1cc(C[C@H](N)C(=O)O)c2ccccc21.O=O>>,0.0255,99.60199638612718,30.0,7.8,1.4.3.23,68170.0,-1.593459819566045,Cn1cc(C[C@H](N)C(=O)O)c2ccccc21.O=O,,-1.593459819566045,Cn1cc(C[C@H](N)C(=O)O)c2ccccc21.O=O__MSRGHKKITVLGAGVAGLVAAHELEELGHEVEVLEGSDRLGGRVHTHRFGEGGSVPFVELGAMRIPTKHRHTIDYIGKLGLTPKLKEFKTLFSDDGAYHTTSAGFVRVRDAAKVLVDEFRLLMSGRDLREETILFGAWLTAVGDAIAPADFRAALRTDFTADLLEVVDRIDLDPFLVGAARDQFDLHAFFAAHPEVRTSCTGKLNRFVDDILDETSPRLLRLEGGMDQLVDALVERIRGDIRTGHEVSAIDVREDHVAVTVHNGHGVNTLRSDHVLCTIPFSVLRNLRLTGLSTDKLEIIHDVKYWSATKVAFRCREPFWERDGINGGASFGGGRIRQTYYPPVEGDPTRGAVLLASYTMGDDADVLGGMPEAQRHEVVLDEVGRMHPELHEPGMVVEAVSRAWGEDRWSNGAGVTRWGKDVAACEEERDRAARPEGRLYFAGEHCSSTTAWIDGAVESALAAVRAIEAGDGR,./data/raw/alphafold//AF-Q8KHS0-F1-model_v4.pdb,2124,4320,4207,4064
+666,9211,9353,MTMLTKPFLLALCAWAAGSLAVPAPAPSASASLEQCPGYKASNVRQTRHSLTADLKLAGKPCNTYGKDLENLVLKVSYDTDTRLHVQIYDRDEEVYQVPESVFPRPKVTDGARRPALKFDYTKNPFSFKVSRRDTGEVLFDSSASNLVFQSQYVRLRTELPQEPNLYGLGEHSDPLRLPTDNYTRTIWNRDSYGIPERSNLYGTHPIYVDHRGKKGTHGVFLLNSNGMDIKINRTTDGQQYLEYNTIGGIIDLYFFAGPSPKDVAKQYAEVAGLPAMQPYWGFGFHQCRYGYRDIFDVAEVVYNYSQAGIPLETMWTDIDYMYRRRTFTNDPERFPLPKIRALVDYLHDHDQHYIVMTDPAMSKSDNPAYNRGLERGIFLKDADGSEYEGVVWPGVTVYPDWFNPDTQDWWTNEFSIFYNRDTGIDIDGLWIDMNEPSNFCDWPCEDPEQYVEDNDLPPAPPPVRENPRPLPGFPDVFQPPSSHSKRASQSRKGKKIGLEGRDLLTPPYAIQNEYGPLSQKTIDTDLVHAGEGYVEYDVHSLYGTMMSMASRVAMLARRPTVRPLVITRSTFAGAGAHVGHWLGDNLSTWEHYRISIAQMLAFASIFQIPMVGSDVCGFGGNVTETLCARWAQLGAFYPFFRNHNEIGSISQEFYRWETTTEAAKKAIDIRYRLLDYAYTQFHHQTVTGEPWLQPLFYVYPNDPNTYGIDTQFFYGDSILVSPVTDEDATSVDAYFPDDLWYDWYTGKPLRGQGKKVTLDNIDYTTIPIHIRGGSIIPVRASSANTTTALRKKPFHLIIAPGRDGSAKGSLYLDDGNSLHQKATLELDFYYKNGLLRLSGKFGFNAQVNVESITLLGQKAKPKTVKADNADADVEFNGERESVTIKTKLSLDKPVELTIQ,uniprot_search,B1Q1F4,CO[C@@H]1O[C@@H](CO)[C@H](O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H]1O.O>>,199.0,99.71040765913824,47.5,4.5,3.2.1.215,1679.0,2.298853076409707,CO[C@@H]1O[C@@H](CO)[C@H](O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H]1O.O,,2.298853076409707,CO[C@@H]1O[C@@H](CO)[C@H](O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H]1O.O__MTMLTKPFLLALCAWAAGSLAVPAPAPSASASLEQCPGYKASNVRQTRHSLTADLKLAGKPCNTYGKDLENLVLKVSYDTDTRLHVQIYDRDEEVYQVPESVFPRPKVTDGARRPALKFDYTKNPFSFKVSRRDTGEVLFDSSASNLVFQSQYVRLRTELPQEPNLYGLGEHSDPLRLPTDNYTRTIWNRDSYGIPERSNLYGTHPIYVDHRGKKGTHGVFLLNSNGMDIKINRTTDGQQYLEYNTIGGIIDLYFFAGPSPKDVAKQYAEVAGLPAMQPYWGFGFHQCRYGYRDIFDVAEVVYNYSQAGIPLETMWTDIDYMYRRRTFTNDPERFPLPKIRALVDYLHDHDQHYIVMTDPAMSKSDNPAYNRGLERGIFLKDADGSEYEGVVWPGVTVYPDWFNPDTQDWWTNEFSIFYNRDTGIDIDGLWIDMNEPSNFCDWPCEDPEQYVEDNDLPPAPPPVRENPRPLPGFPDVFQPPSSHSKRASQSRKGKKIGLEGRDLLTPPYAIQNEYGPLSQKTIDTDLVHAGEGYVEYDVHSLYGTMMSMASRVAMLARRPTVRPLVITRSTFAGAGAHVGHWLGDNLSTWEHYRISIAQMLAFASIFQIPMVGSDVCGFGGNVTETLCARWAQLGAFYPFFRNHNEIGSISQEFYRWETTTEAAKKAIDIRYRLLDYAYTQFHHQTVTGEPWLQPLFYVYPNDPNTYGIDTQFFYGDSILVSPVTDEDATSVDAYFPDDLWYDWYTGKPLRGQGKKVTLDNIDYTTIPIHIRGGSIIPVRASSANTTTALRKKPFHLIIAPGRDGSAKGSLYLDDGNSLHQKATLELDFYYKNGLLRLSGKFGFNAQVNVESITLLGQKAKPKTVKADNADADVEFNGERESVTIKTKLSLDKPVELTIQ,./data/raw/alphafold//AF-B1Q1F4-F1-model_v4.pdb,312,3461,1206,3133
+667,1586,1615,MLLLEHESKALLEKYGIKTAKCIFCETEEQAVKAAKEIGFPVVMKVAGREIVHKSDVGGVILNVKSEDEVREVFQRLMSIPKAEGVNIQPQLEKGIEVIVGVAENEQFGSVAMFGLGGVFVEVLKDVSFRLLPLTRRDAEEMVREVKGYKLLEGYRRVKGDVGAVVDLLLKLNEVVERESIVEMDLNPVFVYERGAVVADARIVVGERKRFDYTIPDLRDLFYPKSVAVIGASRTVGKPGFNIVWNLKQNGFMGKIYPVNPNADKILELKCYPSILDIPDEVDMAIIAVPAKIVPEVMAECAQKGIKGAVIVSSGFSEEGEKGAEYERRVLEIAKKHGIRIFGPNTTGVLNTENGFITSFAIQPVIKKGNIGIIAQTGLFLGIMMDIVTSNHPSIGFSKIVGMGNKIDVEDYEVLDFLLKDEQTKVIGIYMEGIKNGRAFYDVASSAEKPIVVFKSGRTEYGQKAAMSHTASICGDDDVFDAVCRQANLVRVYSFDELFDVTKAFSLQPLPKGDRVAIIHYTGSGCVQGSDAAYFAGLKLAEFSKDTVDKISEVTPEWHNVNNPIDIWPMVEYYGAFKAYQTAIEAVMEDEGVDSVIACVWANRLINADFEPDYKSLKKYGKPIYFCVEGARDVVFDHKNALELNGIPVYTNVINAVNVLGKVTKYAKRRIQS,sabio,O28341,CC(=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.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>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.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,2.9,8.514114150389701e-15,55.0,,6.2.1.13,2234.0,0.4623979978989561,CC(=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.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,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.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,0.4771212547196624,CC(=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.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MLLLEHESKALLEKYGIKTAKCIFCETEEQAVKAAKEIGFPVVMKVAGREIVHKSDVGGVILNVKSEDEVREVFQRLMSIPKAEGVNIQPQLEKGIEVIVGVAENEQFGSVAMFGLGGVFVEVLKDVSFRLLPLTRRDAEEMVREVKGYKLLEGYRRVKGDVGAVVDLLLKLNEVVERESIVEMDLNPVFVYERGAVVADARIVVGERKRFDYTIPDLRDLFYPKSVAVIGASRTVGKPGFNIVWNLKQNGFMGKIYPVNPNADKILELKCYPSILDIPDEVDMAIIAVPAKIVPEVMAECAQKGIKGAVIVSSGFSEEGEKGAEYERRVLEIAKKHGIRIFGPNTTGVLNTENGFITSFAIQPVIKKGNIGIIAQTGLFLGIMMDIVTSNHPSIGFSKIVGMGNKIDVEDYEVLDFLLKDEQTKVIGIYMEGIKNGRAFYDVASSAEKPIVVFKSGRTEYGQKAAMSHTASICGDDDVFDAVCRQANLVRVYSFDELFDVTKAFSLQPLPKGDRVAIIHYTGSGCVQGSDAAYFAGLKLAEFSKDTVDKISEVTPEWHNVNNPIDIWPMVEYYGAFKAYQTAIEAVMEDEGVDSVIACVWANRLINADFEPDYKSLKKYGKPIYFCVEGARDVVFDHKNALELNGIPVYTNVINAVNVLGKVTKYAKRRIQS,./data/raw/alphafold//AF-O28341-F1-model_v4.pdb,1414,925,724,1018
+668,9329,9471,MLPRTLLGLALTAATGLCASLQQVTNWGSNPTNIRMYTYVPDKLATKPAIIVALHGCGGTAPSWYSGTRLPSYADQYGFILIYPGTPNMSNCWGVNDPASLTHGAGGDSLGIVAMVNYTIAKYNADASRVYVMGTSSGGMMTNVMAATYPEVFEAGAAYSGVAHACFAGAASATPFSPNQTCARGLQHTPEEWGNFVRNSYPGYTGRRPRMQIYHGLADNLVYPRCAMEALKQWSNVLGVEFSRNVSGVPSQAYTQIVYGDGSKLVGYMGAGVGHVAPTNEQVMLKFFGLIN,brenda,Q9HGR3,COc1cc(/C=C/C(=O)O[C@H]2[C@H](OC[C@@H]3O[C@@H](O)[C@H](O)[C@H]3O)O[C@@H](CO)[C@@H]2O)ccc1O.O>>COc1cc(/C=C/C(=O)O)ccc1O.OC[C@@H]1O[C@@H](OC[C@@H]2OC(O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,6.04,5.959291685884125e-15,37.0,6.0,3.1.1.73,5141.0,0.7810369386211319,COc1cc(/C=C/C(=O)O[C@H]2[C@H](OC[C@@H]3O[C@@H](O)[C@H](O)[C@H]3O)O[C@@H](CO)[C@@H]2O)ccc1O.O,COc1cc(/C=C/C(=O)O)ccc1O.OC[C@@H]1O[C@@H](OC[C@@H]2OC(O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O,0.7810369386211319,COc1cc(/C=C/C(=O)O[C@H]2[C@H](OC[C@@H]3O[C@@H](O)[C@H](O)[C@H]3O)O[C@@H](CO)[C@@H]2O)ccc1O.O__MLPRTLLGLALTAATGLCASLQQVTNWGSNPTNIRMYTYVPDKLATKPAIIVALHGCGGTAPSWYSGTRLPSYADQYGFILIYPGTPNMSNCWGVNDPASLTHGAGGDSLGIVAMVNYTIAKYNADASRVYVMGTSSGGMMTNVMAATYPEVFEAGAAYSGVAHACFAGAASATPFSPNQTCARGLQHTPEEWGNFVRNSYPGYTGRRPRMQIYHGLADNLVYPRCAMEALKQWSNVLGVEFSRNVSGVPSQAYTQIVYGDGSKLVGYMGAGVGHVAPTNEQVMLKFFGLIN,./data/raw/alphafold//AF-Q9HGR3-F1-model_v4.pdb,1482,1023,3888,2759
+669,5619,5705,MNSKCHCVILNDGNFIPVLGFGTALPLECPKSKAKELTKIAIDAGFHHFDSASVYNTEDHVGEAIRSKIADGTVRREDIFYTSKVWCTSLHPELVRASLERSLQKLQFDYVDLYLIHYPMALKPGEENFPVDEHGKLIFDRVDLCATWEAMEKCKDAGLTKSIGVSNFNYRQLEMILNKPGLKYKPVCNQVECHPYLNQMKLLDFCKSKDIVLVAYGVLGTQRYGGWVDQNSPVLLDEPVLGSMAKKYNRTPALIALRYQLQRGIVVLNTSLKEERIKENMQVFEFQLSSEDMKVLDGLNRNMRYIPAAIFKGHPNWPFLDEY,sabio,Q91WR5,CC12CCC(=O)CC1CCC1C2C(=O)CC2(C)C1CCC2(O)C(=O)CO.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]>>CC12CCC(O)CC1CCC1C2C(=O)CC2(C)C1CCC2(O)C(=O)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)c1,210.0,0.0,25.0,7.0,1.1.1.209,10090.0,2.322219294733919,CC12CCC(=O)CC1CCC1C2C(=O)CC2(C)C1CCC2(O)C(=O)CO.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],CC12CCC(O)CC1CCC1C2C(=O)CC2(C)C1CCC2(O)C(=O)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)c1,2.322219294733919,CC12CCC(=O)CC1CCC1C2C(=O)CC2(C)C1CCC2(O)C(=O)CO.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]__MNSKCHCVILNDGNFIPVLGFGTALPLECPKSKAKELTKIAIDAGFHHFDSASVYNTEDHVGEAIRSKIADGTVRREDIFYTSKVWCTSLHPELVRASLERSLQKLQFDYVDLYLIHYPMALKPGEENFPVDEHGKLIFDRVDLCATWEAMEKCKDAGLTKSIGVSNFNYRQLEMILNKPGLKYKPVCNQVECHPYLNQMKLLDFCKSKDIVLVAYGVLGTQRYGGWVDQNSPVLLDEPVLGSMAKKYNRTPALIALRYQLQRGIVVLNTSLKEERIKENMQVFEFQLSSEDMKVLDGLNRNMRYIPAAIFKGHPNWPFLDEY,./data/raw/alphafold//AF-Q91WR5-F1-model_v4.pdb,1329,1150,6214,878
+670,20722,21030,MTTSARDTGLDSHELARLHELARHSHAVITRHQDAGGAYPAAPTFSAYRGYAWLRDGSFTAEGISRYGDVASAGRFHDWVDGVLRRRRGQVDDLLAAVDRGEVPSNEGMLPTRFTFDGNDGSDPWWDFQTDGYGMWLWSVVTHAARHGLDLERWRAGIDVAVDYLLAFWDRPCYDWWEEHVEHRHVSTLGAIHGGLVAVGTCAALRSAPWSAATLQVAARIRSLVSAEGVVDGHLVKWLGSSAVDGSLPACVVPFGLVPPDDDVAAMTRAAVAKDLDVDGGVHRFAADVFYGGGQWILLSALLGWNLAAAGDTAGALRHLRWIADQADADGDLPEQVPHHLLHPGSRAEWVARWGTVATPLLWSHGMYLILADELGLLPPAAKDA,brenda,D2PPM8,O.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>>OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O,11.4,0.0,35.0,6.0,3.2.1.205,182640.0,1.0569048513364727,O.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,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O,1.0569048513364727,O.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__MTTSARDTGLDSHELARLHELARHSHAVITRHQDAGGAYPAAPTFSAYRGYAWLRDGSFTAEGISRYGDVASAGRFHDWVDGVLRRRRGQVDDLLAAVDRGEVPSNEGMLPTRFTFDGNDGSDPWWDFQTDGYGMWLWSVVTHAARHGLDLERWRAGIDVAVDYLLAFWDRPCYDWWEEHVEHRHVSTLGAIHGGLVAVGTCAALRSAPWSAATLQVAARIRSLVSAEGVVDGHLVKWLGSSAVDGSLPACVVPFGLVPPDDDVAAMTRAAVAKDLDVDGGVHRFAADVFYGGGQWILLSALLGWNLAAAGDTAGALRHLRWIADQADADGDLPEQVPHHLLHPGSRAEWVARWGTVATPLLWSHGMYLILADELGLLPPAAKDA,./data/raw/alphafold//AF-D2PPM8-F1-model_v4.pdb,520,3207,5509,6392
+671,12784,12956,MNAEINPLHAYFKLPNTVSLVAGSSEGETPLNAFDGALLNAGIGNVNLIRISSIMPPEAEIVPLPKLPMGALVPTAYGYIISDVPGETISAAISVAIPKDKSLCGLIMEYEGKCSKKEAEKTVREMAKIGFEMRGWELDRIESIAVEHTVEKLGCAFAAAALWYK,sabio,Q57764,N=C(N)NCCCC(N)C(=O)O>>N=C(N)NCCCCN.O=C=O,2.7,0.0,83.0,6.0,4.1.1.19,2190.0,0.4313637641589873,N=C(N)NCCCC(N)C(=O)O,N=C(N)NCCCCN.O=C=O,0.4313637641589873,N=C(N)NCCCC(N)C(=O)O__MNAEINPLHAYFKLPNTVSLVAGSSEGETPLNAFDGALLNAGIGNVNLIRISSIMPPEAEIVPLPKLPMGALVPTAYGYIISDVPGETISAAISVAIPKDKSLCGLIMEYEGKCSKKEAEKTVREMAKIGFEMRGWELDRIESIAVEHTVEKLGCAFAAAALWYK,./data/raw/alphafold//AF-Q57764-F1-model_v4.pdb,2177,4397,4289,4164
+672,21885,22213,MATTLEFILCFTITALPFLYCILNMRILLNRHPRSLPPGPRPWPIVGNLPHLGTKPHHSIAAMARKYGPLLHLRMGIVHVVVAASADVAAQFLKNDANFSSRPPNSGAKHMAYNYHDMVFAPYGPRWRMLRKICALHIFSAKALDDFHRVREEEVAILARTLAHAGQKPVNLGQLFSTCNANALSVLMLGRRLFSTEVDSKAYDFKQMVVELMTLAGEFNVSDFIPPLEWLDLQGVAAKMKNVHNRFDAFLNVILEEHKLKLNNSGHGEQKHMDLLSTLILLKDDADSEGGKLTDTEIKALLLNLFSAGTDTSSSTIEWVIAELIRNPKILAQAQRELDLVVGPNRLVTDLDLKQLTYLQAIVKETFRLHPATPLSLPRIATESCEINGFYIPKGSTLLVNIWAIGRDPNTWAEPLVFRPERFLSDGESPNVDVKGRNFELIPFGAGRRICAGMNFGLRMVQLVTATLIHAFNWELPEGELPENMNMEEDYGISLQRTVPLVVHPKPRLDHEVYQSHGVVN,brenda,U3LXJ8,O=C1c2c(O)cc(O)cc2OC(c2ccc(O)cc2)C1O.O=O>>O.O=C1c2c(O)cc(O)cc2O[C@H](c2cc(O)c(O)c(O)c2)[C@H]1O,81.4,10000000.0,25.0,7.0,1.14.14.81,46425.0,1.9106244048892007,O=C1c2c(O)cc(O)cc2OC(c2ccc(O)cc2)C1O.O=O,O.O=C1c2c(O)cc(O)cc2O[C@H](c2cc(O)c(O)c(O)c2)[C@H]1O,1.9106244048892007,O=C1c2c(O)cc(O)cc2OC(c2ccc(O)cc2)C1O.O=O__MATTLEFILCFTITALPFLYCILNMRILLNRHPRSLPPGPRPWPIVGNLPHLGTKPHHSIAAMARKYGPLLHLRMGIVHVVVAASADVAAQFLKNDANFSSRPPNSGAKHMAYNYHDMVFAPYGPRWRMLRKICALHIFSAKALDDFHRVREEEVAILARTLAHAGQKPVNLGQLFSTCNANALSVLMLGRRLFSTEVDSKAYDFKQMVVELMTLAGEFNVSDFIPPLEWLDLQGVAAKMKNVHNRFDAFLNVILEEHKLKLNNSGHGEQKHMDLLSTLILLKDDADSEGGKLTDTEIKALLLNLFSAGTDTSSSTIEWVIAELIRNPKILAQAQRELDLVVGPNRLVTDLDLKQLTYLQAIVKETFRLHPATPLSLPRIATESCEINGFYIPKGSTLLVNIWAIGRDPNTWAEPLVFRPERFLSDGESPNVDVKGRNFELIPFGAGRRICAGMNFGLRMVQLVTATLIHAFNWELPEGELPENMNMEEDYGISLQRTVPLVVHPKPRLDHEVYQSHGVVN,./data/raw/alphafold//AF-U3LXJ8-F1-model_v4.pdb,717,111,5829,6737
+673,12599,12769,MALLLASAINHTAHPAGLRSHPNNESFSRHHLCSSPQNISKRRSNLSFRPRAQTISSESAGIHRLSPWEIPRRDWFPPSFLFGAATSAYQIEGAWNEDGKGPSTWDHFCHNFPEWIVDRSNGDVAADSYHMYAEDVRLLKEMGMDAYRFSISWPRILPKGTLAGGINEKGVEYYNKLIDLLLENGIEPYITIFHWDTPQALVDAYGGFLDEEDYKDYTDFAKVCFEKFGKTVKNWLTFNEPETFCSVSYGTGVLAPGRCSPGVSCAVPTGNSLSEPYIVAHNLLRAHAETVDIYNKYHKGADGRIGLALNVFGRVPYTNTFLDQQAQERSMDKCLGWFLEPVVRGDYPFSMRVSARDRVPYFKEKEQEKLVGSYDMIGINYYTSTFSKHIDLSPNNSPVLNTDDAYASQETKGPDGNAIGPPTGNAWINMYPKGLHDILMTMKNKYGNPPMYITENGMGDIDKGDLPKPVALEDHTRLDYIQRHLSVLKQSIDLGADVRGYFAWSLLDNFEWSSGYTERFGIVYVDRENGCERTMKRSARWLQEFNGAAKKVENNKILTPAGQLN,sabio,Q41290,N#CC(OC1OC(CO)C(O)C(O)C1O)c1ccc(O)cc1.O>>N#CC(O)c1ccc(O)cc1.OCC1OC(O)C(O)C(O)C1O,14.3,0.0,37.0,5.8,3.2.1.21,4558.0,1.155336037465062,N#CC(OC1OC(CO)C(O)C(O)C1O)c1ccc(O)cc1.O,N#CC(O)c1ccc(O)cc1.OCC1OC(O)C(O)C(O)C1O,1.8904210188009145,N#CC(OC1OC(CO)C(O)C(O)C1O)c1ccc(O)cc1.O__MALLLASAINHTAHPAGLRSHPNNESFSRHHLCSSPQNISKRRSNLSFRPRAQTISSESAGIHRLSPWEIPRRDWFPPSFLFGAATSAYQIEGAWNEDGKGPSTWDHFCHNFPEWIVDRSNGDVAADSYHMYAEDVRLLKEMGMDAYRFSISWPRILPKGTLAGGINEKGVEYYNKLIDLLLENGIEPYITIFHWDTPQALVDAYGGFLDEEDYKDYTDFAKVCFEKFGKTVKNWLTFNEPETFCSVSYGTGVLAPGRCSPGVSCAVPTGNSLSEPYIVAHNLLRAHAETVDIYNKYHKGADGRIGLALNVFGRVPYTNTFLDQQAQERSMDKCLGWFLEPVVRGDYPFSMRVSARDRVPYFKEKEQEKLVGSYDMIGINYYTSTFSKHIDLSPNNSPVLNTDDAYASQETKGPDGNAIGPPTGNAWINMYPKGLHDILMTMKNKYGNPPMYITENGMGDIDKGDLPKPVALEDHTRLDYIQRHLSVLKQSIDLGADVRGYFAWSLLDNFEWSSGYTERFGIVYVDRENGCERTMKRSARWLQEFNGAAKKVENNKILTPAGQLN,./data/raw/alphafold//AF-Q41290-F1-model_v4.pdb,1219,4325,4212,4070
+674,19254,19540,MTMAANTDRAVLQAALPPLSGSLPIPGLSASVRVRRDAWGIPHIKASGEADAYRALGFVHSQDRLFQMELTRRKALGRAAEWLGAEAAEADILVRRLGMEKVCRRDFEALGVEAKDMLRAYVAGVNAFLASGAPLPVEYGLLGAEPEPWEPWHSIAVMRRLGLLMGSVWFKLWRMLALPVVGAANALKLRYDDGGRDLLCIPPGAEADRLEADLATLRPAVDALLKAMGGDASDAAGGGSNNWAVAPGRTATGRPILAGDPHRVFEIPGFYAQHHLACDRFDMIGLTVPGVPGFPHFAHNGKVAYCVTHAFMDIHDLYLEQFAGEGRTARFGNDFEPVAWSRDRIAVRGGADREFDIVETRHGPVIAGDPRDGAALTLRSVQFAETDLSFDCLTRMPGASTVAQLYDATRGWGLIDHNLVAGDVAGSIGHLVRARVPSRPRENGWLPVPGWSGEHEWRGWIPHEAMPRVIDPPGGIIVTANNRVVADDHPDYLCTDCHPPYRAERIMKRLVANPAFAVDDAAAIHADTLSPHVGLLRRRLEALGARDDSAAEGLRQMLVAWDGRMDAASEVASAYNAFRRALTRLVTDRSGLEQAISHPFAAVAPGVSPQGQVWWAVPTLLRDDDAGMLKGWSWDQALSEALSVASQNLTGRSWGEEHRPRFTHPLATQFPAWAGLLNPASRPIGGDGDTVLANGLVPSAGPQATYGALSRYVFDVGNWDNSRWVVFHGASGHPASAHYADQNAPWSDCAMVPMLYSWDRIAAEAVTSQELVPA,uniprot_search,A0A1D8GRD5,O.O=C(O)CCCC(=O)Nc1ccc(C(=O)O)cc1>>Nc1ccc(C(=O)O)cc1.O=C(O)CCCC(=O)O,0.16,0.0,38.0,8.683333333333334,3.5.1.93,306.0,-0.7958800173440752,O.O=C(O)CCCC(=O)Nc1ccc(C(=O)O)cc1,Nc1ccc(C(=O)O)cc1.O=C(O)CCCC(=O)O,-0.7958800173440752,O.O=C(O)CCCC(=O)Nc1ccc(C(=O)O)cc1__MTMAANTDRAVLQAALPPLSGSLPIPGLSASVRVRRDAWGIPHIKASGEADAYRALGFVHSQDRLFQMELTRRKALGRAAEWLGAEAAEADILVRRLGMEKVCRRDFEALGVEAKDMLRAYVAGVNAFLASGAPLPVEYGLLGAEPEPWEPWHSIAVMRRLGLLMGSVWFKLWRMLALPVVGAANALKLRYDDGGRDLLCIPPGAEADRLEADLATLRPAVDALLKAMGGDASDAAGGGSNNWAVAPGRTATGRPILAGDPHRVFEIPGFYAQHHLACDRFDMIGLTVPGVPGFPHFAHNGKVAYCVTHAFMDIHDLYLEQFAGEGRTARFGNDFEPVAWSRDRIAVRGGADREFDIVETRHGPVIAGDPRDGAALTLRSVQFAETDLSFDCLTRMPGASTVAQLYDATRGWGLIDHNLVAGDVAGSIGHLVRARVPSRPRENGWLPVPGWSGEHEWRGWIPHEAMPRVIDPPGGIIVTANNRVVADDHPDYLCTDCHPPYRAERIMKRLVANPAFAVDDAAAIHADTLSPHVGLLRRRLEALGARDDSAAEGLRQMLVAWDGRMDAASEVASAYNAFRRALTRLVTDRSGLEQAISHPFAAVAPGVSPQGQVWWAVPTLLRDDDAGMLKGWSWDQALSEALSVASQNLTGRSWGEEHRPRFTHPLATQFPAWAGLLNPASRPIGGDGDTVLANGLVPSAGPQATYGALSRYVFDVGNWDNSRWVVFHGASGHPASAHYADQNAPWSDCAMVPMLYSWDRIAAEAVTSQELVPA,./data/raw/alphafold//AF-A0A1D8GRD5-F1-model_v4.pdb,1433,952,756,1054
+675,10760,10915,MSSSLIFKLFFFSLFFSNRLASRLDSDDDGKNIYIVYMGRKLEDPDSAHLHHRAMLEQVVGSTFAPESVLHTYKRSFNGFAVKLTEEEAEKIASMEGVVSVFLNEMNELHTTRSWDFLGFPLTVPRRSQVESNIVVGVLDTGIWPESPSFDDEGFSPPPPKWKGTCETSNNFRCNRKIIGARSYHIGRPISPGDVNGPRDTNGHGTHTASTAAGGLVSQANLYGLGLGTARGGVPLARIAAYKVCWNDGCSDTDILAAYDDAIADGVDIISLSVGGANPRHYFVDAIAIGSFHAVERGILTSNSAGNGGPNFFTTASLSPWLLSVAASTMDRKFVTQVQIGNGQSFQGVSINTFDNQYYPLVSGRDIPNTGFDKSTSRFCTDKSVNPNLLKGKIVVCEASFGPHEFFKSLDGAAGVLMTSNTRDYADSYPLPSSVLDPNDLLATLRYIYSIRSPGATIFKSTTILNASAPVVVSFSSRGPNRATKDVIKPDISGPGVEILAAWPSVAPVGGIRRNTLFNIISGTSMSCPHITGIATYVKTYNPTWSPAAIKSALMTTASPMNARFNPQAEFAYGSGHVNPLKAVRPGLVYDANESDYVKFLCGQGYNTQAVRRITGDYSACTSGNTGRVWDLNYPSFGLSVSPSQTFNQYFNRTLTSVAPQASTYRAMISAPQGLTISVNPNVLSFNGLGDRKSFTLTVRGSIKGFVVSASLVWSDGVHYVRSPITITSLV,uniprot_search,Q39547,C[C@H](N=C(O)CC(=O)O)C(=O)N1CCC[C@H]1C(O)N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>,0.31,99.79359227869996,66.4,9.375,3.4.21.25,3656.0,-0.5086383061657274,C[C@H](N=C(O)CC(=O)O)C(=O)N1CCC[C@H]1C(O)N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,,-0.5086383061657274,C[C@H](N=C(O)CC(=O)O)C(=O)N1CCC[C@H]1C(O)N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MSSSLIFKLFFFSLFFSNRLASRLDSDDDGKNIYIVYMGRKLEDPDSAHLHHRAMLEQVVGSTFAPESVLHTYKRSFNGFAVKLTEEEAEKIASMEGVVSVFLNEMNELHTTRSWDFLGFPLTVPRRSQVESNIVVGVLDTGIWPESPSFDDEGFSPPPPKWKGTCETSNNFRCNRKIIGARSYHIGRPISPGDVNGPRDTNGHGTHTASTAAGGLVSQANLYGLGLGTARGGVPLARIAAYKVCWNDGCSDTDILAAYDDAIADGVDIISLSVGGANPRHYFVDAIAIGSFHAVERGILTSNSAGNGGPNFFTTASLSPWLLSVAASTMDRKFVTQVQIGNGQSFQGVSINTFDNQYYPLVSGRDIPNTGFDKSTSRFCTDKSVNPNLLKGKIVVCEASFGPHEFFKSLDGAAGVLMTSNTRDYADSYPLPSSVLDPNDLLATLRYIYSIRSPGATIFKSTTILNASAPVVVSFSSRGPNRATKDVIKPDISGPGVEILAAWPSVAPVGGIRRNTLFNIISGTSMSCPHITGIATYVKTYNPTWSPAAIKSALMTTASPMNARFNPQAEFAYGSGHVNPLKAVRPGLVYDANESDYVKFLCGQGYNTQAVRRITGDYSACTSGNTGRVWDLNYPSFGLSVSPSQTFNQYFNRTLTSVAPQASTYRAMISAPQGLTISVNPNVLSFNGLGDRKSFTLTVRGSIKGFVVSASLVWSDGVHYVRSPITITSLV,./data/raw/alphafold//AF-Q39547-F1-model_v4.pdb,2875,1579,3169,1941
+676,23142,23484,MRPGHLMVLALLAPTLIAPPVFAQSVLTRDNGAKVGDNQNSQTAGATGPTLLQDVQLIQKLQRFDRERIPERVVHARGTGVKGEFTATADLSSLTKAKVFSAGEKTPVFVRFSSVVHGNHSPETLRDPHGFATKFYTSEGNWDLVGNNFPTFFIRDAIKFPDMVHAFKPDPRTNLDDDSRRFDFFSHVPEATRTLTLLYSNEGTPAGYRFMDGNGVHAYKLVNAQGEVHYVKFHWKTLQGIKNLDPKQVAAVQAKDYSHLTNDLVGAIKKGDYPKWDLYVQVLKPEDLAKFDFDPLDATKIWPDVPEQKVGQMVLNKNVDNFFQETEQVAMAPANLVPGIEPSEDRLLQGRIFSYADTQLYRIGANGLSLPVNRPRVAVNNGNQDGQGNIGQTTSGVNYEPSRLEPRPQDTAARYSELPLSGTTQQAKITREQNFKQAGELYRSYSKKDRADLVQSFGESLATTDTESKHLMLSFLYKADPEYGTGVTRVAKGDLARVKQLASSLQD,brenda,Q8L2Z7,OO>>O,255000.0,30.17028418412567,37.0,7.0,1.11.1.6,339.0,5.406540180433956,OO,O,5.406540180433956,OO__MRPGHLMVLALLAPTLIAPPVFAQSVLTRDNGAKVGDNQNSQTAGATGPTLLQDVQLIQKLQRFDRERIPERVVHARGTGVKGEFTATADLSSLTKAKVFSAGEKTPVFVRFSSVVHGNHSPETLRDPHGFATKFYTSEGNWDLVGNNFPTFFIRDAIKFPDMVHAFKPDPRTNLDDDSRRFDFFSHVPEATRTLTLLYSNEGTPAGYRFMDGNGVHAYKLVNAQGEVHYVKFHWKTLQGIKNLDPKQVAAVQAKDYSHLTNDLVGAIKKGDYPKWDLYVQVLKPEDLAKFDFDPLDATKIWPDVPEQKVGQMVLNKNVDNFFQETEQVAMAPANLVPGIEPSEDRLLQGRIFSYADTQLYRIGANGLSLPVNRPRVAVNNGNQDGQGNIGQTTSGVNYEPSRLEPRPQDTAARYSELPLSGTTQQAKITREQNFKQAGELYRSYSKKDRADLVQSFGESLATTDTESKHLMLSFLYKADPEYGTGVTRVAKGDLARVKQLASSLQD,./data/raw/alphafold//AF-Q8L2Z7-F1-model_v4.pdb,868,358,6136,7080
+677,9857,10006,MSIVNESGSQPVVSRDETLSQIERTSFHISSGKDISLEEIARAARDHQPVTLHDEVVNRVTRSRSILESMVSDERVIYGVNTSMGGFVNYIVPIAKASELQNNLINAVATNVGKYFDDTTVRATMLARIVSLSRGNSAISIVNFKKLIEIYNQGIVPCIPEKGSLGTSGDLGPLAAIALVCTGQWKARYQGEQMSGAMALEKAGISPMELSFKEGLALINGTSAMVGLGVLLYDEVKRLFDTYLTVTSLSIEGLHGKTKPFEPAVHRMKPHQGQLEVATTIWETLADSSLAVNEHEVEKLIAEEMDGLVKASNHQIEDAYSIRCTPQILGPVADTLKNIKQTLTNELNSSNDNPLIDQTTEEVFHNGHFHGQYVSMAMDHLNIALVTMMNLANRRIDRFMDKSNSNGLPPFLCAENAGLRLGLMGGQFMTASITAESRASCMPMSIQSLSTTGDFQDIVSFGLVAARRVREQLKNLKYVFSFELLCACQAVDIRGTAGLSKRTRALYDKTRTLVPYLEEDKTISDYIESIAQTVLTKNSDI,brenda,Q84FL5,COc1ccccc1C[C@H](N)C(=O)O>>COc1ccccc1[C@@H](N)CC(=O)O,0.003,1.4521765719251177e-14,31.0,8.0,5.4.3.11,549.0,-2.5228787452803374,COc1ccccc1C[C@H](N)C(=O)O,COc1ccccc1[C@@H](N)CC(=O)O,-2.5228787452803374,COc1ccccc1C[C@H](N)C(=O)O__MSIVNESGSQPVVSRDETLSQIERTSFHISSGKDISLEEIARAARDHQPVTLHDEVVNRVTRSRSILESMVSDERVIYGVNTSMGGFVNYIVPIAKASELQNNLINAVATNVGKYFDDTTVRATMLARIVSLSRGNSAISIVNFKKLIEIYNQGIVPCIPEKGSLGTSGDLGPLAAIALVCTGQWKARYQGEQMSGAMALEKAGISPMELSFKEGLALINGTSAMVGLGVLLYDEVKRLFDTYLTVTSLSIEGLHGKTKPFEPAVHRMKPHQGQLEVATTIWETLADSSLAVNEHEVEKLIAEEMDGLVKASNHQIEDAYSIRCTPQILGPVADTLKNIKQTLTNELNSSNDNPLIDQTTEEVFHNGHFHGQYVSMAMDHLNIALVTMMNLANRRIDRFMDKSNSNGLPPFLCAENAGLRLGLMGGQFMTASITAESRASCMPMSIQSLSTTGDFQDIVSFGLVAARRVREQLKNLKYVFSFELLCACQAVDIRGTAGLSKRTRALYDKTRTLVPYLEEDKTISDYIESIAQTVLTKNSDI,./data/raw/alphafold//AF-Q84FL5-F1-model_v4.pdb,2803,2376,1300,3251
+678,10011,10161,MSPTAFPAAETATAPATAVDPGPELDGGDFALPEGGLDDDRRLRALDAVDEYLTRKRKHLVGYQATQDMQGTALDLARFMPNNINNLGDPFQSGGYKPNTKVVERAVLDYYAKLWHAERPHDPADPESYWGYMLSMGSTEGNMYALWNARDYLSGKALIQPPTAPFDAVRYVKADPDRRNPNAHHPVAFYSEDTHYSFAKAVAVLGVETFHAVGLEKYADECPLVDPVTGLRTWPTEVPSRPGPSGLSWDGPGEIDVDALAVLVEFFAAKGHPVFVNLNLGSTFKGAHDDVRAVCERLLPIFERHGLVQREVVYGSCPQTGRPLVDVRRGFWIHVDGALGAGYAPFLRLAAEDPEGYGWTPEAELPEFDFGLRLPTAGHGEVDMVSSIAMSGHKWAGAPWPCGIYMTKVKYQISPPSQPDYIGAPDTTFAGSRNGFSPLILWDHLSRYSYRDQVERIREAQELAAYLERRLTAMERELGVELWPARTPGAVTVRFRKPSAELVAKWSLSSQDVLMVPGDETTRRSYVHVFVMPSVDRAKLDALLAELAEDPVILGAP,brenda,A0A0G4DBU7,CSCC[C@H](N)C(=O)O>>CSCCCN.O=C=O,239.0,9.491937825336141e-15,55.0,6.6,4.1.1.57,1510823.0,2.378397900948137,CSCC[C@H](N)C(=O)O,CSCCCN.O=C=O,2.378397900948137,CSCC[C@H](N)C(=O)O__MSPTAFPAAETATAPATAVDPGPELDGGDFALPEGGLDDDRRLRALDAVDEYLTRKRKHLVGYQATQDMQGTALDLARFMPNNINNLGDPFQSGGYKPNTKVVERAVLDYYAKLWHAERPHDPADPESYWGYMLSMGSTEGNMYALWNARDYLSGKALIQPPTAPFDAVRYVKADPDRRNPNAHHPVAFYSEDTHYSFAKAVAVLGVETFHAVGLEKYADECPLVDPVTGLRTWPTEVPSRPGPSGLSWDGPGEIDVDALAVLVEFFAAKGHPVFVNLNLGSTFKGAHDDVRAVCERLLPIFERHGLVQREVVYGSCPQTGRPLVDVRRGFWIHVDGALGAGYAPFLRLAAEDPEGYGWTPEAELPEFDFGLRLPTAGHGEVDMVSSIAMSGHKWAGAPWPCGIYMTKVKYQISPPSQPDYIGAPDTTFAGSRNGFSPLILWDHLSRYSYRDQVERIREAQELAAYLERRLTAMERELGVELWPARTPGAVTVRFRKPSAELVAKWSLSSQDVLMVPGDETTRRSYVHVFVMPSVDRAKLDALLAELAEDPVILGAP,./data/raw/alphafold//AF-A0A0G4DBU7-F1-model_v4.pdb,3342,2206,3893,2764
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+687,17993,18246,MGCTLSAEDKAAVERSKMIDRNLREDGEKAAREVKLLLLGAGESGKSTIVKQMKIIHEAGYSEEECKQYKAVVYSNTIQSIIAIIRAMGRLKIDFGDAARADDARQLFVLAGAAEEGFMTAELAGVIKRLWKDSGVQACFNRSREYQLNDSAAYYLNDLDRIAQPNYIPTQQDVLRTRVKTTGIVETHFTFKDLHFKMFDVGGQRSERKKWIHCFEGVTAIIFCVALSDYDLVLAEDEEMNRMHESMKLFDSICNNKWFTDTSIILFLNKKDLFEEKIKKSPLTICYPEYAGSNTYEEAAAYIQCQFEDLNKRKDTKEIYTHFTCATDTKNVQFVFDAVTDVIIKNNLKDCGLF,sabio,P10824,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1.O>>Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1.O=P(O)(O)O,144.0,1.0493601366967451e-14,20.0,8.0,3.6.5.1,10116.0,2.1583624920952498,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1.O,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1.O=P(O)(O)O,2.1583624920952498,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1.O__MGCTLSAEDKAAVERSKMIDRNLREDGEKAAREVKLLLLGAGESGKSTIVKQMKIIHEAGYSEEECKQYKAVVYSNTIQSIIAIIRAMGRLKIDFGDAARADDARQLFVLAGAAEEGFMTAELAGVIKRLWKDSGVQACFNRSREYQLNDSAAYYLNDLDRIAQPNYIPTQQDVLRTRVKTTGIVETHFTFKDLHFKMFDVGGQRSERKKWIHCFEGVTAIIFCVALSDYDLVLAEDEEMNRMHESMKLFDSICNNKWFTDTSIILFLNKKDLFEEKIKKSPLTICYPEYAGSNTYEEAAAYIQCQFEDLNKRKDTKEIYTHFTCATDTKNVQFVFDAVTDVIIKNNLKDCGLF,./data/raw/alphafold//AF-P10824-F1-model_v4.pdb,2867,2454,2733,5575
+688,22114,22447,MSLSTEQMLRDYPRSMQINGQIPKNAIHETYGNDGVDVFIAGSGPIGATYAKLCVEAGLRVVMVEIGAADSFYAVNAEEGTAVPYVPGYHKKNEIEFQKDIDRFVNVIKGALQQVSVPVRNQNVPTLDPGAWSAPPGSSAISNGKNPHQREFENLSAEAVTRGVGGMSTHWTCSTPRIHPPMESLPGIGRPKLSNDPAEDDKEWNELYSEAERLIGTSTKEFDESIRHTLVLRSLQDAYKDRQRIFRPLPLACHRLKNAPEYVEWHSAENLFHSIYNDDKQKKLFTLLTNHRCTRLALTGGYEKKIGAAEVRNLLATRNPSSQLDSYIMAKVYVLASGAIGNPQILYNSGFSGLQVTPRNDSLIPNLGRYITEQPMAFCQIVLRQEFVDSVRDDPYGLPWWKEAVAQHIAKNPTDALPIPFRDPEPQVTTPFTEEHPWHTQIHRDAFSYGAVGPEVDSRVIVDLRWFGATDPEANNLLVFQNDVQDGYSMPQPTFRYRPSTASNVRARKMMADMCEVASNLGGYLPTSPPQFMDPGLALHLAGTTRIGFDKATTVADNNSLVWDFANLYVAGNGTIRTGFGENPTLTSMCHAIKSARSIINTLKGGTDGKNTGEHRNL,brenda,Q75ZP8,O=O.OC[C@H]1O[C@H](OC[C@H]2OC(O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O>>,0.839,99.73354294621564,30.0,6.5,1.1.3.10,47721.0,-0.0762380391712997,O=O.OC[C@H]1O[C@H](OC[C@H]2OC(O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O,,-0.0762380391712997,O=O.OC[C@H]1O[C@H](OC[C@H]2OC(O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O__MSLSTEQMLRDYPRSMQINGQIPKNAIHETYGNDGVDVFIAGSGPIGATYAKLCVEAGLRVVMVEIGAADSFYAVNAEEGTAVPYVPGYHKKNEIEFQKDIDRFVNVIKGALQQVSVPVRNQNVPTLDPGAWSAPPGSSAISNGKNPHQREFENLSAEAVTRGVGGMSTHWTCSTPRIHPPMESLPGIGRPKLSNDPAEDDKEWNELYSEAERLIGTSTKEFDESIRHTLVLRSLQDAYKDRQRIFRPLPLACHRLKNAPEYVEWHSAENLFHSIYNDDKQKKLFTLLTNHRCTRLALTGGYEKKIGAAEVRNLLATRNPSSQLDSYIMAKVYVLASGAIGNPQILYNSGFSGLQVTPRNDSLIPNLGRYITEQPMAFCQIVLRQEFVDSVRDDPYGLPWWKEAVAQHIAKNPTDALPIPFRDPEPQVTTPFTEEHPWHTQIHRDAFSYGAVGPEVDSRVIVDLRWFGATDPEANNLLVFQNDVQDGYSMPQPTFRYRPSTASNVRARKMMADMCEVASNLGGYLPTSPPQFMDPGLALHLAGTTRIGFDKATTVADNNSLVWDFANLYVAGNGTIRTGFGENPTLTSMCHAIKSARSIINTLKGGTDGKNTGEHRNL,./data/raw/alphafold//AF-Q75ZP8-F1-model_v4.pdb,567,3284,5594,6480
+689,20500,20805,MAGTTNHRARGSEDYNVFDDAKTYYASEERHQNRFGSRTRTYSQNSLMKQFERNGLREPYRRGSHDESSLPQGRRFLIQVDPTLESLQAQEDTDGNMQITIEDEGPKVLSLRTAASAGHNRFEVRGTYMLSNLLQELTLAKEYGRKQIVLDEGRLNENPVDRLSRLIRDHFWDGLTRRIDASSIEIAARDPKDWTDDPRPRIYVPAGVPEQYEYYKQVAEERPEIRLDVQQLPEKITPELIRDMNEKPGLLAVETEQVVDPETGRKTLQGLPFVVPGGRFNELYGWDSYMESLGLLVNDRVDLAKSMVLNFCFCIEHYGKILNATRSYYLGRSQPPFLTDMALRVYEKIKHEPDAKEFLRRSILAAIKEYHSVWTCEPRLDPVTGLSRYRPEGLGVPPETEAGHFVHILEPYVKKHNMEFKEFVRAYNYGEIKEPELDDYFMHDRAVRESGHDTTYRFEGICADLATIDLNSLLFKYETDIARTIRNVFNDKLVIPGEFCDRTPYQPGEVLASAAWDRRAKRRKLTVDKLMWDEEQGVFFDYDTAKRERCNYESSTTFWALWAGIATPKQAADMVKKGLPRFEAYGGLLAGTEKSRGDIGLERPNRQWDYPYGWAPQQMLAWTGLLRYSFTEEAERLAYKWLFMITKAFVDFNGVVVEKYDVTRPADPHRVDAEYGNQGLDFKGVAKEGFGWVNASYVYGLQIVNAHMRRALGTLTPYPTFIKAIEQSLEKELADLP,sabio,Q9HDE9,O.OCC1OC(OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O>>OCC1OC(O)C(O)C(O)C1O,0.91,33.2717722930995,30.0,7.0,3.2.1.28,5530.0,-0.0409586076789063,O.OCC1OC(OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O,OCC1OC(O)C(O)C(O)C1O,-0.0409586076789063,O.OCC1OC(OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O__MAGTTNHRARGSEDYNVFDDAKTYYASEERHQNRFGSRTRTYSQNSLMKQFERNGLREPYRRGSHDESSLPQGRRFLIQVDPTLESLQAQEDTDGNMQITIEDEGPKVLSLRTAASAGHNRFEVRGTYMLSNLLQELTLAKEYGRKQIVLDEGRLNENPVDRLSRLIRDHFWDGLTRRIDASSIEIAARDPKDWTDDPRPRIYVPAGVPEQYEYYKQVAEERPEIRLDVQQLPEKITPELIRDMNEKPGLLAVETEQVVDPETGRKTLQGLPFVVPGGRFNELYGWDSYMESLGLLVNDRVDLAKSMVLNFCFCIEHYGKILNATRSYYLGRSQPPFLTDMALRVYEKIKHEPDAKEFLRRSILAAIKEYHSVWTCEPRLDPVTGLSRYRPEGLGVPPETEAGHFVHILEPYVKKHNMEFKEFVRAYNYGEIKEPELDDYFMHDRAVRESGHDTTYRFEGICADLATIDLNSLLFKYETDIARTIRNVFNDKLVIPGEFCDRTPYQPGEVLASAAWDRRAKRRKLTVDKLMWDEEQGVFFDYDTAKRERCNYESSTTFWALWAGIATPKQAADMVKKGLPRFEAYGGLLAGTEKSRGDIGLERPNRQWDYPYGWAPQQMLAWTGLLRYSFTEEAERLAYKWLFMITKAFVDFNGVVVEKYDVTRPADPHRVDAEYGNQGLDFKGVAKEGFGWVNASYVYGLQIVNAHMRRALGTLTPYPTFIKAIEQSLEKELADLP,./data/raw/alphafold//AF-Q9HDE9-F1-model_v4.pdb,484,3158,5451,6334
+690,16595,16824,MWLLPLVLTSLASSATWAGQPASPPVVDTAQGRVLGKYVSLEGLAQPVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTSYPPMCCQDPVVEQMTSDLFTNGKERLTLEFSEDCLYLNIYTPADLTKRGRLPVMVWIHGGGLVLGGAPMYDGVVLAAHENVVVVAIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQENIANFGGDPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTVALVRKDMKAAAKQIAVLAGCKTTTSAVFVHCLRQKSEDELLDLTLKMKFLTLDFHGDQRESHPFLPTVVDGVLLPKMPEEILAEKDFNTVPYIVGINKQEFGWLLPTMMGFPLSEGKLDQKTATSLLWKSYPIANIPEELTPVATDKYLGGTDDPVKKKDLFLDLMGDVVFGVPSVTVARQHRDAGAPTYMYEFQYRPSFSSDKKPKTVIGDHGDEIFSVFGFPLLKGDAPEEEVSLSKTVMKFWANFARSGNPNGEGLPHWPMYDQEEGYLQIGVNTQAAKRLKGEEVAFWNDLLSKEAAKKPPKIKHAEL,sabio,Q29550,NC(Cc1ccccc1)C(=O)OCc1ccccc1.O>>NC(Cc1ccccc1)C(=O)O.c1ccccc1,282.0,5.800578782855976,37.0,7.4,3.1.1.1,9823.0,2.450249108319361,NC(Cc1ccccc1)C(=O)OCc1ccccc1.O,NC(Cc1ccccc1)C(=O)O.c1ccccc1,2.450249108319361,NC(Cc1ccccc1)C(=O)OCc1ccccc1.O__MWLLPLVLTSLASSATWAGQPASPPVVDTAQGRVLGKYVSLEGLAQPVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTSYPPMCCQDPVVEQMTSDLFTNGKERLTLEFSEDCLYLNIYTPADLTKRGRLPVMVWIHGGGLVLGGAPMYDGVVLAAHENVVVVAIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQENIANFGGDPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTVALVRKDMKAAAKQIAVLAGCKTTTSAVFVHCLRQKSEDELLDLTLKMKFLTLDFHGDQRESHPFLPTVVDGVLLPKMPEEILAEKDFNTVPYIVGINKQEFGWLLPTMMGFPLSEGKLDQKTATSLLWKSYPIANIPEELTPVATDKYLGGTDDPVKKKDLFLDLMGDVVFGVPSVTVARQHRDAGAPTYMYEFQYRPSFSSDKKPKTVIGDHGDEIFSVFGFPLLKGDAPEEEVSLSKTVMKFWANFARSGNPNGEGLPHWPMYDQEEGYLQIGVNTQAAKRLKGEEVAFWNDLLSKEAAKKPPKIKHAEL,./data/raw/alphafold//AF-Q29550-F1-model_v4.pdb,1494,2159,554,633
+691,21227,21551,MRIREIEPIVLTSKEKGSATWASIMIVTRVITENGEVGYGEAVPTLRVISVYNAIKQVSKAYIGKEVEEVEKNYHEWYKQDFYLARSFESATAVSAIDIASWDIIGKELGAPIHKLLGGKTRDRVPVYANGWYQDCVTPEEFAEKAKDVVKMGYKALKFDPFGPYYDWIDERGLREAEERVKAVREAVGDNVDILIEHHGRFNANSAIMIAKRLEKYNPGFMEEPVHHEDVIGLRKYKASTHLRVALGERLISEKETAFYVEEGLVNILQPDLTNIGGVTVGRSVIKIAEANDVEVAFHNAFGSIQNAVEIQLSAVTQNLYLLENFYDWFPQWKRDLVYNETPVEGGHVKVPYKPGLGVSINEKIIEQLRAEPIPLDVIEEPVWVVKGTWKNYGV,sabio,Q97U27,O=C(O)C(O)C(O)C(O)C(O)CO>>O.O=C(O)C(=O)CC(O)C(O)CO,45600.0,7.226287007806568e-15,78.0,7.0,4.2.1.39,2287.0,4.658964842664435,O=C(O)C(O)C(O)C(O)C(O)CO,O.O=C(O)C(=O)CC(O)C(O)CO,4.658964842664435,O=C(O)C(O)C(O)C(O)C(O)CO__MRIREIEPIVLTSKEKGSATWASIMIVTRVITENGEVGYGEAVPTLRVISVYNAIKQVSKAYIGKEVEEVEKNYHEWYKQDFYLARSFESATAVSAIDIASWDIIGKELGAPIHKLLGGKTRDRVPVYANGWYQDCVTPEEFAEKAKDVVKMGYKALKFDPFGPYYDWIDERGLREAEERVKAVREAVGDNVDILIEHHGRFNANSAIMIAKRLEKYNPGFMEEPVHHEDVIGLRKYKASTHLRVALGERLISEKETAFYVEEGLVNILQPDLTNIGGVTVGRSVIKIAEANDVEVAFHNAFGSIQNAVEIQLSAVTQNLYLLENFYDWFPQWKRDLVYNETPVEGGHVKVPYKPGLGVSINEKIIEQLRAEPIPLDVIEEPVWVVKGTWKNYGV,./data/raw/alphafold//AF-Q97U27-F1-model_v4.pdb,610,3342,5662,6555
+692,4732,4790,MCAQVWLLTDRLIREDYPQVQILRALRQRCSEQDVGFRAVFLDQIAVTVVGGHLGLQLSQKPLTTFPDVVVVRVSTPSVQSDSEITILRHLEKLGCRLVNRPQSILNCINKFWTFQELAGHGVPMPDTFSYGGHEDFSKMIDEAEPLGYPVVVKSTRGHRGKAVFLARDKHHLSDICHLVRHDVPYLFQKYVKESHGKDIRVVVVGGQVIGSMLRCSTDGRMQSNCFLGGVGVKCPLTEQGKQLAIQVSNILGMDFCGIDLLIMDDGSFTVCEANANVGFLAFDQACNLDVGAIIADYAMSLLPNRQTGKMAILPGLASPREKNEPNGCVSAQGVAESVYAITNGSTSSESEPELGEARDSSVKTMGAPPAHVAQAWLQH,brenda,Q6PFX8,CC(O)=N[C@@H](CC(=O)O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>CC(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,2.6,6.8490007688165135e-15,30.0,8.0,6.3.2.41,10090.0,0.414973347970818,CC(O)=N[C@@H](CC(=O)O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,CC(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,0.414973347970818,CC(O)=N[C@@H](CC(=O)O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MCAQVWLLTDRLIREDYPQVQILRALRQRCSEQDVGFRAVFLDQIAVTVVGGHLGLQLSQKPLTTFPDVVVVRVSTPSVQSDSEITILRHLEKLGCRLVNRPQSILNCINKFWTFQELAGHGVPMPDTFSYGGHEDFSKMIDEAEPLGYPVVVKSTRGHRGKAVFLARDKHHLSDICHLVRHDVPYLFQKYVKESHGKDIRVVVVGGQVIGSMLRCSTDGRMQSNCFLGGVGVKCPLTEQGKQLAIQVSNILGMDFCGIDLLIMDDGSFTVCEANANVGFLAFDQACNLDVGAIIADYAMSLLPNRQTGKMAILPGLASPREKNEPNGCVSAQGVAESVYAITNGSTSSESEPELGEARDSSVKTMGAPPAHVAQAWLQH,./data/raw/alphafold//AF-Q6PFX8-F1-model_v4.pdb,2975,1716,3331,2135
+693,22962,23304,MKHGIYYAYWEQEWEADYKYYIEKVAKLGFDILEIAASPLPFYSDIQINELKACAHGNGITLTVGHGPSAEQNLSSPDPDIRKNAKAFYTDLLKRLYKLDVHLIGGALYSYWPIDYTKTIDKKGDWERSVESVREVAKVAEACGVDFCLEVLNRFENYLINTAQEGVDFVKQVDHNNVKVMLDTFHMNIEEDSIGGAIRTAGSYLGHLHTGECNRKVPGRGRIPWVEIGEALADIGYNGSVVMEPFVRMGGTVGSNIKVWRDISNGADEKMLDREAQAALDFSRYVLECHKHS,brenda,B8I944,OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O>>O=C(CO)[C@H](O)[C@H](O)[C@H](O)CO,55.9,7.866251170845146e-15,55.0,8.0,5.1.3.30,1521.0,1.7474118078864234,OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,O=C(CO)[C@H](O)[C@H](O)[C@H](O)CO,1.7474118078864234,OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O__MKHGIYYAYWEQEWEADYKYYIEKVAKLGFDILEIAASPLPFYSDIQINELKACAHGNGITLTVGHGPSAEQNLSSPDPDIRKNAKAFYTDLLKRLYKLDVHLIGGALYSYWPIDYTKTIDKKGDWERSVESVREVAKVAEACGVDFCLEVLNRFENYLINTAQEGVDFVKQVDHNNVKVMLDTFHMNIEEDSIGGAIRTAGSYLGHLHTGECNRKVPGRGRIPWVEIGEALADIGYNGSVVMEPFVRMGGTVGSNIKVWRDISNGADEKMLDREAQAALDFSRYVLECHKHS,./data/raw/alphafold//AF-B8I944-F1-model_v4.pdb,2229,4470,4376,4263
+694,4572,4628,MNRIKVAILFGGCSEEHDVSVKSAIEIAANINKEKYEPLYIGITKSGVWKMCEKPCAEWENDNCYSAVLSPDKKMHGLLVKKNHEYEINHVDVAFSALHGKSGEDGSIQGLFELSGIPFVGCDIQSSAICMDKSLTYIVAKNAGIATPAFWVINKDDRPVAATFTYPVFVKPARSGSSFGVKKVNSADELDYAIESARQYDSKILIEQAVSGCEVGCAVLGNSAALVVGEVDQIRLQYGIFRIHQEVEPEKGSENAVITVPADLSAEERGRIQETAKKIYKALGCRGLARVDMFLQDNGRIVLNEVNTLPGFTSYSRYPRMMAAAGIALPELIDRLIVLALKG,sabio,P25051,CC(N)C(=O)O.CCCCC(O)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,3960.0,16.19901293765822,,8.6,6.3.2.4,1352.0,3.597695185925512,CC(N)C(=O)O.CCCCC(O)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,3.597695185925512,CC(N)C(=O)O.CCCCC(O)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MNRIKVAILFGGCSEEHDVSVKSAIEIAANINKEKYEPLYIGITKSGVWKMCEKPCAEWENDNCYSAVLSPDKKMHGLLVKKNHEYEINHVDVAFSALHGKSGEDGSIQGLFELSGIPFVGCDIQSSAICMDKSLTYIVAKNAGIATPAFWVINKDDRPVAATFTYPVFVKPARSGSSFGVKKVNSADELDYAIESARQYDSKILIEQAVSGCEVGCAVLGNSAALVVGEVDQIRLQYGIFRIHQEVEPEKGSENAVITVPADLSAEERGRIQETAKKIYKALGCRGLARVDMFLQDNGRIVLNEVNTLPGFTSYSRYPRMMAAAGIALPELIDRLIVLALKG,./data/raw/alphafold//AF-P25051-F1-model_v4.pdb,2941,1675,3285,2083
+695,5149,5235,MSKLSVFFIFLFCSIATAAESLPDLKIEKLDEGVYVHTSFEEVNGWGVVPKHGLVVLVNAEAYLIDTPFTAKDTEKLVTWFVERGYKIKGSISSHFHSDSTGGIEWLNSRSIPTYASELTNELLKKDGKVQATNSFSGVNYWLVKNKIEVFYPGPGHTPDNVVVWLPERKILFGGCFIKPYGLGNLGDANIEAWPKSAKLLKSKYGKAKLVVPSHSEVGDASLLKLTLEQAVKGLNESKKPSKPSN,sabio,Q7DHD4,CC(O)C1C(=O)N2C(C(=O)O)=C(SCCNC=N)CC12.O>>,444000.0,99.6858970936058,30.0,7.4,3.5.2.6,615.0,5.64738297011462,CC(O)C1C(=O)N2C(C(=O)O)=C(SCCNC=N)CC12.O,,5.64738297011462,CC(O)C1C(=O)N2C(C(=O)O)=C(SCCNC=N)CC12.O__MSKLSVFFIFLFCSIATAAESLPDLKIEKLDEGVYVHTSFEEVNGWGVVPKHGLVVLVNAEAYLIDTPFTAKDTEKLVTWFVERGYKIKGSISSHFHSDSTGGIEWLNSRSIPTYASELTNELLKKDGKVQATNSFSGVNYWLVKNKIEVFYPGPGHTPDNVVVWLPERKILFGGCFIKPYGLGNLGDANIEAWPKSAKLLKSKYGKAKLVVPSHSEVGDASLLKLTLEQAVKGLNESKKPSKPSN,./data/raw/alphafold//AF-Q7DHD4-F1-model_v4.pdb,1448,985,796,1093
+696,3513,3562,MTKATKEQKSLVKNRGAELVVDCLVEQGVTHVFGIPGAKIDAVFDALQDKGPEIIVARHEQNAAFMAQAVGRLTGKPGVVLVTSGPGASNLATGLLTANTEGDPVVALAGNVIRADRLKRTHQSLDNAALFQPITKYSVEVQDVKNIPEAVTNAFRIASAGQAGAAFVSFPQDVVNEVTNTKNVRAVAAPKLGPAADDAISAAIAKIQTAKLPVVLVGMKGGRPEAIKAVRKLLKKVQLPFVETYQAAGTLSRDLEDQYFGRIGLFRNQPGDLLLEQADVVLTIGYDPIEYDPKFWNINGDRTIIHLDEIIADIDHAYQPDLELIGDIPSTINHIEHDAVKVEFAEREQKILSDLKQYMHEGEQVPADWKSDRAHPLEIVKELRNAVDDHVTVTCDIGSHAIWMSRYFRSYEPLTLMISNGMQTLGVALPWAIGASLVKPGEKVVSVSGDGGFLFSAMELETAVRLKAPIVHIVWNDSTYDMVAFQQLKKYNRTSAVDFGNIDIVKYAESFGATGLRVESPDQLADVLRQGMNAEGPVIIDVPVDYSDNINLASDKLPKEFGELMKTKAL,brenda,Q04789,CC(C)C(=O)C(=O)O>>CC(C)C=O.O=C=O,8.9,1.2186024829527688e-14,37.0,7.0,4.1.1.72,1423.0,0.9493900066449128,CC(C)C(=O)C(=O)O,CC(C)C=O.O=C=O,0.9493900066449128,CC(C)C(=O)C(=O)O__MTKATKEQKSLVKNRGAELVVDCLVEQGVTHVFGIPGAKIDAVFDALQDKGPEIIVARHEQNAAFMAQAVGRLTGKPGVVLVTSGPGASNLATGLLTANTEGDPVVALAGNVIRADRLKRTHQSLDNAALFQPITKYSVEVQDVKNIPEAVTNAFRIASAGQAGAAFVSFPQDVVNEVTNTKNVRAVAAPKLGPAADDAISAAIAKIQTAKLPVVLVGMKGGRPEAIKAVRKLLKKVQLPFVETYQAAGTLSRDLEDQYFGRIGLFRNQPGDLLLEQADVVLTIGYDPIEYDPKFWNINGDRTIIHLDEIIADIDHAYQPDLELIGDIPSTINHIEHDAVKVEFAEREQKILSDLKQYMHEGEQVPADWKSDRAHPLEIVKELRNAVDDHVTVTCDIGSHAIWMSRYFRSYEPLTLMISNGMQTLGVALPWAIGASLVKPGEKVVSVSGDGGFLFSAMELETAVRLKAPIVHIVWNDSTYDMVAFQQLKKYNRTSAVDFGNIDIVKYAESFGATGLRVESPDQLADVLRQGMNAEGPVIIDVPVDYSDNINLASDKLPKEFGELMKTKAL,./data/raw/alphafold//AF-Q04789-F1-model_v4.pdb,1254,5191,1575,701
+697,1945,1976,MTMIIGVYGASGFGKEVMPLVRQQFPTLSKEQFAFIDDGLSGTTLNGYPVLSYLDFISKPADHKAVTIAIANSVVREKLVSLLEKDGVQHLAVQSTNTVILDEVEIGEGSLLCPFTCLTSNIKIGKFFHANIYSYVAHDCVIGDYVTFAPGAKCNGNIHIEDHAYIGTGAVIKQGTPDKPLIIGKGAIVGMGAVVTKSVPAGVTVVGNPARILERK,brenda,B0V6J7,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.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](C)[C@@H](N)[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)=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](C)[C@@H](N=C(C)O)[C@@H]1O,510000.0,0.0,25.0,7.4,2.3.1.203,470.0,5.707570176097937,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.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](C)[C@@H](N)[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)=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](C)[C@@H](N=C(C)O)[C@@H]1O,5.707570176097937,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.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](C)[C@@H](N)[C@@H]1O__MTMIIGVYGASGFGKEVMPLVRQQFPTLSKEQFAFIDDGLSGTTLNGYPVLSYLDFISKPADHKAVTIAIANSVVREKLVSLLEKDGVQHLAVQSTNTVILDEVEIGEGSLLCPFTCLTSNIKIGKFFHANIYSYVAHDCVIGDYVTFAPGAKCNGNIHIEDHAYIGTGAVIKQGTPDKPLIIGKGAIVGMGAVVTKSVPAGVTVVGNPARILERK,./data/raw/alphafold//AF-B0V6J7-F1-model_v4.pdb,1513,1063,890,1225
+698,665,684,MASERHHSIDAQLRALAPGKVSEELIQYDALLVDRFLDILQDLHGPSLREFVQECYEVSADYEGKKDTSKLGELGAKLTGLAPADAILVASSILHMLNLANLAEEVELAHRRRNSKLKHGDFSDEGSATTESDIEETLKRLVSLGKTPAEVFEALKNQSVDLVFTAHPTQSARRSLLQKNARIRNCLTQLSAKDVTVEDKKELDEALHREIQAAFRTDEIRRAQPTPQDEMRYGMSYIHETVWNGVPKFLRRVDTALKNIGINERLPYDVPLIKFCSWMGGDRDGNPRVTPEVTRDVCLLSRMMAANLYINQVEDLMFELSMWRCNDELRARAEEVQSTPASKKVTKYYIEFWKQIPPNEPYRVILGAVRDKLYNTRERARHLLATGFSEISEDAVFTKIEEFLEPLELCYKSLCECGDKAIADGSLLDLLRQVFTFGLSLVKLDIRQESERQTDVIDAITTHLGIGSYRSWPEDKRMEWLVSELKGKRPLLPPDLPMTEEIADVIGAMRVLAELPIDSFGPYIISMCTAPSDVLAVELLQRECGIRQTLPVVPLFERLADLQAAPASVEKLFSTDWYINHINGKQQVMVGYSDSGKDAGRLSAAWQLYVAQEEMAKVAKKYGVKLTLFHGRGGTVGRGGGPTHLAILSQPPDTINGSIRVTVQGEVIEFMFGEENLCFQSLQRFTAATLEHGMHPPVSPKPEWRKLMEEMAVVATEEYRSVVVKEPRFVEYFRSATPETEYGKMNIGSRPAKRRPGGGITTLRAIPWIFSWTQTRFHLPVWLGVGAAFKWAIDKDIKNFQKLKEMYNEWPFFRVTLDLLEMVFAKGDPGIAGLYDELLVAEELKPFGKQLRDKYVETQQLLLQIAGHKDILEGDPYLKQGLRLRNPYITTLNVFQAYTLKRIRDPSFKVTPQPPLSKEFADENKPAGLVKLNGERVPPGLEDTLILTMKGIAAGMQNTG,brenda,P15804,C=C(OP(=O)(O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C=O>>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)CC(=O)C(=O)O,66.0,0.0,30.0,6.5,4.1.1.31,4558.0,1.8195439355418688,C=C(OP(=O)(O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C=O,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)CC(=O)C(=O)O,1.8195439355418688,C=C(OP(=O)(O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C=O__MASERHHSIDAQLRALAPGKVSEELIQYDALLVDRFLDILQDLHGPSLREFVQECYEVSADYEGKKDTSKLGELGAKLTGLAPADAILVASSILHMLNLANLAEEVELAHRRRNSKLKHGDFSDEGSATTESDIEETLKRLVSLGKTPAEVFEALKNQSVDLVFTAHPTQSARRSLLQKNARIRNCLTQLSAKDVTVEDKKELDEALHREIQAAFRTDEIRRAQPTPQDEMRYGMSYIHETVWNGVPKFLRRVDTALKNIGINERLPYDVPLIKFCSWMGGDRDGNPRVTPEVTRDVCLLSRMMAANLYINQVEDLMFELSMWRCNDELRARAEEVQSTPASKKVTKYYIEFWKQIPPNEPYRVILGAVRDKLYNTRERARHLLATGFSEISEDAVFTKIEEFLEPLELCYKSLCECGDKAIADGSLLDLLRQVFTFGLSLVKLDIRQESERQTDVIDAITTHLGIGSYRSWPEDKRMEWLVSELKGKRPLLPPDLPMTEEIADVIGAMRVLAELPIDSFGPYIISMCTAPSDVLAVELLQRECGIRQTLPVVPLFERLADLQAAPASVEKLFSTDWYINHINGKQQVMVGYSDSGKDAGRLSAAWQLYVAQEEMAKVAKKYGVKLTLFHGRGGTVGRGGGPTHLAILSQPPDTINGSIRVTVQGEVIEFMFGEENLCFQSLQRFTAATLEHGMHPPVSPKPEWRKLMEEMAVVATEEYRSVVVKEPRFVEYFRSATPETEYGKMNIGSRPAKRRPGGGITTLRAIPWIFSWTQTRFHLPVWLGVGAAFKWAIDKDIKNFQKLKEMYNEWPFFRVTLDLLEMVFAKGDPGIAGLYDELLVAEELKPFGKQLRDKYVETQQLLLQIAGHKDILEGDPYLKQGLRLRNPYITTLNVFQAYTLKRIRDPSFKVTPQPPLSKEFADENKPAGLVKLNGERVPPGLEDTLILTMKGIAAGMQNTG,./data/raw/alphafold//AF-P15804-F1-model_v4.pdb,1137,743,427,483
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+706,16719,16949,MAKMRISPELKKLIEKYRCVKDTEGMSPAKVYKLVGENENLYLKMTDSRYKGTTYDVEREKDMMLWLEGKLPVPKVLHFERHDGWSNLLMSEADGVLCSEEYEDEQSPEKIIELYAECIRLFHSIDISDCPYTNSLDSRLAELDYLLNNDLADVDCENWEEDTPFKDPRELYDFLKTEKPEEELVFSHGDLGDSNIFVKDGKVSGFIDLGRSGRADKWYDIAFCVRSIREDIGEEQYVELFFDLLGIKPDWEKIKYYILLDELF,sabio,P0A3Y5,NCCC(O)C(=O)NC1CC(N)C(OC2OC(CN)C(O)C(O)C2O)C(O)C1OC1OC(CO)C(O)C(N)C1O.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,2.46,43.760030453789085,37.0,7.5,2.7.1.95,1351.0,0.3909351071033791,NCCC(O)C(=O)NC1CC(N)C(OC2OC(CN)C(O)C(O)C2O)C(O)C1OC1OC(CO)C(O)C(N)C1O.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,0.3909351071033791,NCCC(O)C(=O)NC1CC(N)C(OC2OC(CN)C(O)C(O)C2O)C(O)C1OC1OC(CO)C(O)C(N)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MAKMRISPELKKLIEKYRCVKDTEGMSPAKVYKLVGENENLYLKMTDSRYKGTTYDVEREKDMMLWLEGKLPVPKVLHFERHDGWSNLLMSEADGVLCSEEYEDEQSPEKIIELYAECIRLFHSIDISDCPYTNSLDSRLAELDYLLNNDLADVDCENWEEDTPFKDPRELYDFLKTEKPEEELVFSHGDLGDSNIFVKDGKVSGFIDLGRSGRADKWYDIAFCVRSIREDIGEEQYVELFFDLLGIKPDWEKIKYYILLDELF,./data/raw/alphafold//AF-P0A3Y5-F1-model_v4.pdb,962,487,128,136
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+708,2800,2838,MSEQLQPQQSMNAADEIIGRPLAQGLGEQTAMLCAERSITYRELDAATNRHGNALRAHGVGKGDRVLFLMDDSPELVAAYLGTLRIGAVAVALNVRLAPRDVLYVIQDSACRLLYIDAEFLHLYQQIAGELEQPPQVVVRGDEAPAPAIIAFKHFLDGQAATLESVQVAPDDVAYWLYSSGTTGRPKAVMHAHRSVLIADRLEREYFGIKPGDRVFTTSKMFFGWSLGHSLMGGLQCGATVIVAPGWPDAERVMATAARHRPTILFSTPVMYRNLLREGAGESAAMRDIRHFVSAGEKLPENIGQQWLDTFGIPITEGIGASETVFLFLCARPDAYRIGSCGKRVPWAEVRLLDELGNEITTPDTPGLIAIRMASQFVGYWKLPETTEKALRDGWYYPGDMFSFDADGFWYHNGRADDMLKISGQWVSPGEIESCASAVPGIAEAVVVAVPNDDGLTRLTLFIVPEDPSASQQKLSEAWMTTLRGTLSIYKCPRTIQFLEELPRTATGKVQKYRLRDMLQATL,brenda,Q9AJS8,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.N=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O=C(O)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@@H](O)C(O)=NCCC(O)=NCCSC(=O)c1ccc(O)cc1.N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O=P(O)(O)OP(=O)(O)O,24.0,0.0,30.0,9.0,6.2.1.27,59405.0,1.380211241711606,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.N=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O=C(O)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@@H](O)C(O)=NCCC(O)=NCCSC(=O)c1ccc(O)cc1.N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O=P(O)(O)OP(=O)(O)O,1.380211241711606,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.N=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O=C(O)c1ccc(O)cc1__MSEQLQPQQSMNAADEIIGRPLAQGLGEQTAMLCAERSITYRELDAATNRHGNALRAHGVGKGDRVLFLMDDSPELVAAYLGTLRIGAVAVALNVRLAPRDVLYVIQDSACRLLYIDAEFLHLYQQIAGELEQPPQVVVRGDEAPAPAIIAFKHFLDGQAATLESVQVAPDDVAYWLYSSGTTGRPKAVMHAHRSVLIADRLEREYFGIKPGDRVFTTSKMFFGWSLGHSLMGGLQCGATVIVAPGWPDAERVMATAARHRPTILFSTPVMYRNLLREGAGESAAMRDIRHFVSAGEKLPENIGQQWLDTFGIPITEGIGASETVFLFLCARPDAYRIGSCGKRVPWAEVRLLDELGNEITTPDTPGLIAIRMASQFVGYWKLPETTEKALRDGWYYPGDMFSFDADGFWYHNGRADDMLKISGQWVSPGEIESCASAVPGIAEAVVVAVPNDDGLTRLTLFIVPEDPSASQQKLSEAWMTTLRGTLSIYKCPRTIQFLEELPRTATGKVQKYRLRDMLQATL,./data/raw/alphafold//AF-Q9AJS8-F1-model_v4.pdb,1673,1283,4578,1535
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+714,20270,20565,MRRAVCFPALCLLLNLHAAGCFSGNNDHFLAINQKKSGKPVFIYKHSQDIEKSLDIAPQKIYRHSYHSSSEAQVSKRHQIVNSAFPRPAYDPSLNLLAMDGQDLEVENLPIPAANVIVVTLQMDVNKLNITLLRIFRQGVAAALGLLPQQVHINRLIGKKNSIELFVSPINRKTGISDALPSEEVLRSLNINVLHQSLSQFGITEVSPEKNVLQGQHEADKIWSKEGFYAVVIFLSIFVIIVTCLMILYRLKERFQLSLRQDKEKNQEIHLSPITLQPALSEAKTVHSMVQPEQAPKVLNVVVDPQGRGAPEIKATTATSVCPSPFKMKPIGLQERRGSNVSLTLDMSSLGNIEPFVSIPTPREKVAMEYLQSASRILTRSQLRDVVASSHLLQSEFMEIPMNFVDPKEIDIPRHGTKNRYKTILPNPLSRVCLRPKNVTDSLSTYINANYIRGYSGKEKAFIATQGPMINTVDDFWQMVWQEDSPVIVMITKLKEKNEKCVLYWPEKRGIYGKVEVLVISVNECDNYTIRNLVLKQGSHTQHVKHYWYTSWPDHKTPDSAQPLLQLMLDVEEDRLASQGRGPVVVHCSAGIGRTGCFIATSIGCQQLKEEGVVDALSIVCQLRMDRGGMVQTSEQYEFVHHALCLYESRLSAETVQ,sabio,Q15256,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,0.000498,0.0,37.0,,3.1.3.-,9606.0,-3.3027706572402824,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,-3.3027706572402824,O.O=[N+]([O-])c1ccccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O__MRRAVCFPALCLLLNLHAAGCFSGNNDHFLAINQKKSGKPVFIYKHSQDIEKSLDIAPQKIYRHSYHSSSEAQVSKRHQIVNSAFPRPAYDPSLNLLAMDGQDLEVENLPIPAANVIVVTLQMDVNKLNITLLRIFRQGVAAALGLLPQQVHINRLIGKKNSIELFVSPINRKTGISDALPSEEVLRSLNINVLHQSLSQFGITEVSPEKNVLQGQHEADKIWSKEGFYAVVIFLSIFVIIVTCLMILYRLKERFQLSLRQDKEKNQEIHLSPITLQPALSEAKTVHSMVQPEQAPKVLNVVVDPQGRGAPEIKATTATSVCPSPFKMKPIGLQERRGSNVSLTLDMSSLGNIEPFVSIPTPREKVAMEYLQSASRILTRSQLRDVVASSHLLQSEFMEIPMNFVDPKEIDIPRHGTKNRYKTILPNPLSRVCLRPKNVTDSLSTYINANYIRGYSGKEKAFIATQGPMINTVDDFWQMVWQEDSPVIVMITKLKEKNEKCVLYWPEKRGIYGKVEVLVISVNECDNYTIRNLVLKQGSHTQHVKHYWYTSWPDHKTPDSAQPLLQLMLDVEEDRLASQGRGPVVVHCSAGIGRTGCFIATSIGCQQLKEEGVVDALSIVCQLRMDRGGMVQTSEQYEFVHHALCLYESRLSAETVQ,./data/raw/alphafold//AF-Q15256-F1-model_v4.pdb,402,2974,5316,6193
+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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+734,10639,10794,MGSAPWAPVLLLALGLRGLQAGARRAPDPGFQERFFQQRLDHFNFERFGNKTFPQRFLVSDRFWVRGEGPIFFYTGNEGDVWAFANNSAFVAELAAERGALLVFAEHRYYGKSLPFGAQSTQRGHTELLTVEQALADFAELLRALRRDLGAQDAPAIAFGGSYGGMLSAYLRMKYPHLVAGALAASAPVLAVAGLGDSNQFFRDVTADFEGQSPKCTQGVREAFRQIKDLFLQGAYDTVRWEFGTCQPLSDEKDLTQLFMFARNAFTVLAMMDYPYPTDFLGPLPANPVKVGCDRLLSEAQRITGLRALAGLVYNASGSEHCYDIYRLYHSCADPTGCGTGPDARAWDYQACTEINLTFASNNVTDMFPDLPFTDELRQRYCLDTWGVWPRPDWLLTSFWGGDLRAASNIIFSNGNLDPWAGGGIRRNLSASVIAVTIQGGAHHLDLRASHPEDPASVVEARKLEATIIGEWVKAARREQQPALRGGPRLSL,brenda,Q9UHL4,C[C@H](N)C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O.Nc1ccc([N+](=O)[O-])cc1,89.0,8.749529588810393e-15,37.0,5.5,3.4.14.2,9606.0,1.9493900066449128,C[C@H](N)C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1.O,C[C@H](N)C(=O)N1CCC[C@H]1C(=O)O.Nc1ccc([N+](=O)[O-])cc1,2.022840610876528,C[C@H](N)C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MGSAPWAPVLLLALGLRGLQAGARRAPDPGFQERFFQQRLDHFNFERFGNKTFPQRFLVSDRFWVRGEGPIFFYTGNEGDVWAFANNSAFVAELAAERGALLVFAEHRYYGKSLPFGAQSTQRGHTELLTVEQALADFAELLRALRRDLGAQDAPAIAFGGSYGGMLSAYLRMKYPHLVAGALAASAPVLAVAGLGDSNQFFRDVTADFEGQSPKCTQGVREAFRQIKDLFLQGAYDTVRWEFGTCQPLSDEKDLTQLFMFARNAFTVLAMMDYPYPTDFLGPLPANPVKVGCDRLLSEAQRITGLRALAGLVYNASGSEHCYDIYRLYHSCADPTGCGTGPDARAWDYQACTEINLTFASNNVTDMFPDLPFTDELRQRYCLDTWGVWPRPDWLLTSFWGGDLRAASNIIFSNGNLDPWAGGGIRRNLSASVIAVTIQGGAHHLDLRASHPEDPASVVEARKLEATIIGEWVKAARREQQPALRGGPRLSL,./data/raw/alphafold//AF-Q9UHL4-F1-model_v4.pdb,3344,2208,3895,2766
+735,15948,16175,MAEPDPSHPLETQAGKVQEAQDSDSDSEGGAAGGEADMDFLRNLFSQTLSLGSQKERLLDELTLEGVARYMQSERCRRVICLVGAGISTSAGIPDFRSPSTGLYDNLEKYHLPYPEAIFEISYFKKHPEPFFALAKELYPGQFKPTICHYFMRLLKDKGLLLRCYTQNIDTLERIAGLEQEDLVEAHGTFYTSHCVSASCRHEYPLSWMKEKIFSEVTPKCEDCQSLVKPDIVFFGESLPARFFSCMQSDFLKVDLLLVMGTSLQVQPFASLISKAPLSTPRLLINKEKAGQSDPFLGMIMGLGGGMDFDSKKAYRDVAWLGECDQGCLALAELLGWKKELEDLVRREHASIDAQSGAGVPNPSTSASPKKSPPPAKDEARTTEREKPQ,sabio,Q8IXJ6,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>>*C(N)C(=O)NC(*)C(=O)NC(*)C(=O)O.CC(=O)O[C@H]1C(O)O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@H]1O.NC(=O)c1cccnc1,2.4,15.567020323579872,37.0,7.5,3.5.1.-,9606.0,0.380211241711606,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,*C(N)C(=O)NC(*)C(=O)NC(*)C(=O)O.CC(=O)O[C@H]1C(O)O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@H]1O.NC(=O)c1cccnc1,0.380211241711606,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__MAEPDPSHPLETQAGKVQEAQDSDSDSEGGAAGGEADMDFLRNLFSQTLSLGSQKERLLDELTLEGVARYMQSERCRRVICLVGAGISTSAGIPDFRSPSTGLYDNLEKYHLPYPEAIFEISYFKKHPEPFFALAKELYPGQFKPTICHYFMRLLKDKGLLLRCYTQNIDTLERIAGLEQEDLVEAHGTFYTSHCVSASCRHEYPLSWMKEKIFSEVTPKCEDCQSLVKPDIVFFGESLPARFFSCMQSDFLKVDLLLVMGTSLQVQPFASLISKAPLSTPRLLINKEKAGQSDPFLGMIMGLGGGMDFDSKKAYRDVAWLGECDQGCLALAELLGWKKELEDLVRREHASIDAQSGAGVPNPSTSASPKKSPPPAKDEARTTEREKPQ,./data/raw/alphafold//AF-Q8IXJ6-F1-model_v4.pdb,877,370,2,2
+736,7220,7342,MLIKSFAIESNILKDNPLKDPNVRKVYSIEVGDVTQAPIVIYLSGFFSSSITLLNYDPLSESINEKLDRLHKEGKIKNLIFILPDLFTKLGGNQYINSTAVGMYEDFIIKELIPYLFDIYGKKDVILMGKSSGGYGSIVLAMKYPEIIRGLINHSGDSYFEYVYLPYFPHAIRHIRREGGLNKWLEKYWSKENKKDKDDLNTLNIIAMAAFYSPEGTEIVLPFDLDTGEIIEDVWKRWLEKDPVRLVEKYSENLKKLRLIYLDVGNKDEFRINFGMRILHKKMLRYNVKHEFEEYEGGHFNTSYRYDISISLISKVFNGDNS,brenda,Q96Z02,CCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCCCCCCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,1.5,0.0,80.0,9.0,3.1.1.1,111955.0,0.1760912590556812,CCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCCCCCCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,0.1760912590556812,CCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MLIKSFAIESNILKDNPLKDPNVRKVYSIEVGDVTQAPIVIYLSGFFSSSITLLNYDPLSESINEKLDRLHKEGKIKNLIFILPDLFTKLGGNQYINSTAVGMYEDFIIKELIPYLFDIYGKKDVILMGKSSGGYGSIVLAMKYPEIIRGLINHSGDSYFEYVYLPYFPHAIRHIRREGGLNKWLEKYWSKENKKDKDDLNTLNIIAMAAFYSPEGTEIVLPFDLDTGEIIEDVWKRWLEKDPVRLVEKYSENLKKLRLIYLDVGNKDEFRINFGMRILHKKMLRYNVKHEFEEYEGGHFNTSYRYDISISLISKVFNGDNS,./data/raw/alphafold//AF-Q96Z02-F1-model_v4.pdb,1490,1037,863,1192
+737,11431,11588,EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF,uniprot_search,P81908,C[N+]12CCC(CC1)[C@@H](OC(=O)c1ccccc1)C2.O.[I-]>>,227.0,99.74505989817692,38.5,8.45,3.1.1.8,9796.0,2.3560258571931225,C[N+]12CCC(CC1)[C@@H](OC(=O)c1ccccc1)C2.O.[I-],,2.3560258571931225,C[N+]12CCC(CC1)[C@@H](OC(=O)c1ccccc1)C2.O.[I-]__EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF,./data/raw/alphafold//AF-P81908-F1-model_v4.pdb,1568,1137,973,1316
+738,19702,19988,MIKNIVFDFGGVIVDIDRDKAVQAFIKLGLADADTRLDKYHQTGIFQELEEGKLSADEFRKQLGDLCGRELTMEETKQAWLGFFNEVDLRKLDYILGLRKSYHVYLLSNTNPFVMSWACSPEFSSEGKPLNDYCDKLYLSYQLGHTKPAPEIFDFMIKDSHVIPSETLFVDDGSSNIHIGKELGFETFQPENGADWRQELTVILNS,brenda,Q8A947,O.O=P(O)(O)OC[C@@H](O)[C@@H](O)[C@@H](O)CO>>O=P(O)(O)O.OC[C@@H](O)[C@@H](O)[C@@H](O)CO,1.5,0.0,25.0,7.5,3.1.3.104,818.0,0.1760912590556812,O.O=P(O)(O)OC[C@@H](O)[C@@H](O)[C@@H](O)CO,O=P(O)(O)O.OC[C@@H](O)[C@@H](O)[C@@H](O)CO,0.1760912590556812,O.O=P(O)(O)OC[C@@H](O)[C@@H](O)[C@@H](O)CO__MIKNIVFDFGGVIVDIDRDKAVQAFIKLGLADADTRLDKYHQTGIFQELEEGKLSADEFRKQLGDLCGRELTMEETKQAWLGFFNEVDLRKLDYILGLRKSYHVYLLSNTNPFVMSWACSPEFSSEGKPLNDYCDKLYLSYQLGHTKPAPEIFDFMIKDSHVIPSETLFVDDGSSNIHIGKELGFETFQPENGADWRQELTVILNS,./data/raw/alphafold//AF-Q8A947-F1-model_v4.pdb,2838,2415,2693,5534
+739,22573,22910,MIHEKYTEMRNEQEALLSRKNTKTSFYNGIYDRYEHPVLTREHIPLHWRYDLNKETNPFFQERLGINAVFNAGAIKLNDRYCLVARVEGNDRKSFFAVAESDKGTEGFRFRQYPVCLPALTDDETNVYDMRLTQHEDGWIYGVFCVEKSAGTADLSEAVASAGIARTKDLTNWERLPDLVTLRSPQQRNVTLLPEFVDGKYAFYTRPMDGFIETGSGGGIGFGLADDITHAVIDEERMTSIRRYHTITESKNGAGATPIKTERGWLNIAHGVRNTAAGLRYVIYCFVTDLSEPWKVIAEPGGYLIAPFKDERVGDVSNVVFTNGAIVDDNGDVYIYYASSDTRLHVAVSSIDKLLDYAFNTPADALRTAECVKQRCDLIKRNIELL,brenda,E6UIS7,O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O>>O=P(O)(O)O.OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)C(O)O[C@@H]2CO)[C@@H](O)[C@@H](O)[C@@H]1O,126.0,0.0,37.0,6.5,2.4.1.281,1264.0,2.100370545117563,O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,O=P(O)(O)O.OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)C(O)O[C@@H]2CO)[C@@H](O)[C@@H](O)[C@@H]1O,2.100370545117563,O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O__MIHEKYTEMRNEQEALLSRKNTKTSFYNGIYDRYEHPVLTREHIPLHWRYDLNKETNPFFQERLGINAVFNAGAIKLNDRYCLVARVEGNDRKSFFAVAESDKGTEGFRFRQYPVCLPALTDDETNVYDMRLTQHEDGWIYGVFCVEKSAGTADLSEAVASAGIARTKDLTNWERLPDLVTLRSPQQRNVTLLPEFVDGKYAFYTRPMDGFIETGSGGGIGFGLADDITHAVIDEERMTSIRRYHTITESKNGAGATPIKTERGWLNIAHGVRNTAAGLRYVIYCFVTDLSEPWKVIAEPGGYLIAPFKDERVGDVSNVVFTNGAIVDDNGDVYIYYASSDTRLHVAVSSIDKLLDYAFNTPADALRTAECVKQRCDLIKRNIELL,./data/raw/alphafold//AF-E6UIS7-F1-model_v4.pdb,3025,1775,3401,2208
+740,16378,16606,MANIIPKIAIIGEGVIGCTSALQISKAIPNAKITVLHDKPFKKSCSAGPAGLFRIDYEENTEYGRASFAWFSHLYRTTKGSETGVKLVSGHIQSDNLESLKQQQRAYGDIVYNFRFLDDRERLDIFPEPSKHCIHYTAYASEGNKYVPYLKNLLLEQKIEFKQQEVTSLDAVADAGYDVIVNCAGLYGGKLAGDDDTCYPIRGVILEVDAPWHKHFNYRDFTTFTIPKEHSVVVGSTKQDNRWDLEITDEDRNDILKRYIALHPGMREPKIIKEWSALRPGRKHVRIEAQKRTSVGNSKDYMVVHHYGHGSNGFTLGWGTAIEATKLVKTALGL,sabio,Q19564,NC(CCC(=O)O)C(=O)O.O.O=O>>N.O=C(O)CCC(=O)C(=O)O.OO,2.11,7.190163433666765e-15,37.0,8.3,1.4.3.1,6239.0,0.3242824552976926,NC(CCC(=O)O)C(=O)O.O.O=O,N.O=C(O)CCC(=O)C(=O)O.OO,0.4785664955938433,NC(CCC(=O)O)C(=O)O.O.O=O__MANIIPKIAIIGEGVIGCTSALQISKAIPNAKITVLHDKPFKKSCSAGPAGLFRIDYEENTEYGRASFAWFSHLYRTTKGSETGVKLVSGHIQSDNLESLKQQQRAYGDIVYNFRFLDDRERLDIFPEPSKHCIHYTAYASEGNKYVPYLKNLLLEQKIEFKQQEVTSLDAVADAGYDVIVNCAGLYGGKLAGDDDTCYPIRGVILEVDAPWHKHFNYRDFTTFTIPKEHSVVVGSTKQDNRWDLEITDEDRNDILKRYIALHPGMREPKIIKEWSALRPGRKHVRIEAQKRTSVGNSKDYMVVHHYGHGSNGFTLGWGTAIEATKLVKTALGL,./data/raw/alphafold//AF-Q19564-F1-model_v4.pdb,3467,3376,1097,3013
+741,12583,12753,MLGKIMLNYTKNIRAAAAQISPVLFSQQGTMEKVLDAIANAAKKGVELIVFPETFVPYYPYFSFVEPPVLMGKSHLKLYQEAVTVPGKVTQAIAQAAKTHGMVVVLGVNEREEGSLYNTQLIFDADGALVLKRRKITPTYHERMVWGQGDGAGLRTVDTTVGRLGALACWEHYNPLARYALMAQHEQIHCGQFPGSMVGQIFADQMEVTMRHHALESGCFVINATGWLTAEQKLQITTDEKMHQALSGGCYTAIISPEGKHLCEPIAEGEGLAIADLDFSLIAKRKRMMDSVGHYARPDLLQLTLNNQPWSALEANPVTPNAIPAVSDPELTETIEALPNNPIFSH,brenda,Q55949,N#C/C=C/C#N.O>>N.O=C(O)/C=C/C(=O)O,15.13,16.079620490720774,30.0,7.0,3.5.5.7,1143.0,1.179838928023187,N#C/C=C/C#N.O,N.O=C(O)/C=C/C(=O)O,1.179838928023187,N#C/C=C/C#N.O__MLGKIMLNYTKNIRAAAAQISPVLFSQQGTMEKVLDAIANAAKKGVELIVFPETFVPYYPYFSFVEPPVLMGKSHLKLYQEAVTVPGKVTQAIAQAAKTHGMVVVLGVNEREEGSLYNTQLIFDADGALVLKRRKITPTYHERMVWGQGDGAGLRTVDTTVGRLGALACWEHYNPLARYALMAQHEQIHCGQFPGSMVGQIFADQMEVTMRHHALESGCFVINATGWLTAEQKLQITTDEKMHQALSGGCYTAIISPEGKHLCEPIAEGEGLAIADLDFSLIAKRKRMMDSVGHYARPDLLQLTLNNQPWSALEANPVTPNAIPAVSDPELTETIEALPNNPIFSH,./data/raw/alphafold//AF-Q55949-F1-model_v4.pdb,2130,4328,256,278
+742,7671,7795,MSSSLIFKLFFFSLFFSNRLASRLDSDDDGKNIYIVYMGRKLEDPDSAHLHHRAMLEQVVGSTFAPESVLHTYKRSFNGFAVKLTEEEAEKIASMEGVVSVFLNEMNELHTTRSWDFLGFPLTVPRRSQVESNIVVGVLDTGIWPESPSFDDEGFSPPPPKWKGTCETSNNFRCNRKIIGARSYHIGRPISPGDVNGPRDTNGHGTHTASTAAGGLVSQANLYGLGLGTARGGVPLARIAAYKVCWNDGCSDTDILAAYDDAIADGVDIISLSVGGANPRHYFVDAIAIGSFHAVERGILTSNSAGNGGPNFFTTASLSPWLLSVAASTMDRKFVTQVQIGNGQSFQGVSINTFDNQYYPLVSGRDIPNTGFDKSTSRFCTDKSVNPNLLKGKIVVCEASFGPHEFFKSLDGAAGVLMTSNTRDYADSYPLPSSVLDPNDLLATLRYIYSIRSPGATIFKSTTILNASAPVVVSFSSRGPNRATKDVIKPDISGPGVEILAAWPSVAPVGGIRRNTLFNIISGTSMSCPHITGIATYVKTYNPTWSPAAIKSALMTTASPMNARFNPQAEFAYGSGHVNPLKAVRPGLVYDANESDYVKFLCGQGYNTQAVRRITGDYSACTSGNTGRVWDLNYPSFGLSVSPSQTFNQYFNRTLTSVAPQASTYRAMISAPQGLTISVNPNVLSFNGLGDRKSFTLTVRGSIKGFVVSASLVWSDGVHYVRSPITITSLV,uniprot_search,Q39547,CCCC[C@H](N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(O)OCc1ccccc1)C(=O)SCc1ccccc1.O>>,0.817,99.8122682686441,66.4,9.375,3.4.21.25,3656.0,-0.0877779434675845,CCCC[C@H](N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(O)OCc1ccccc1)C(=O)SCc1ccccc1.O,,-0.0877779434675845,CCCC[C@H](N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(O)OCc1ccccc1)C(=O)SCc1ccccc1.O__MSSSLIFKLFFFSLFFSNRLASRLDSDDDGKNIYIVYMGRKLEDPDSAHLHHRAMLEQVVGSTFAPESVLHTYKRSFNGFAVKLTEEEAEKIASMEGVVSVFLNEMNELHTTRSWDFLGFPLTVPRRSQVESNIVVGVLDTGIWPESPSFDDEGFSPPPPKWKGTCETSNNFRCNRKIIGARSYHIGRPISPGDVNGPRDTNGHGTHTASTAAGGLVSQANLYGLGLGTARGGVPLARIAAYKVCWNDGCSDTDILAAYDDAIADGVDIISLSVGGANPRHYFVDAIAIGSFHAVERGILTSNSAGNGGPNFFTTASLSPWLLSVAASTMDRKFVTQVQIGNGQSFQGVSINTFDNQYYPLVSGRDIPNTGFDKSTSRFCTDKSVNPNLLKGKIVVCEASFGPHEFFKSLDGAAGVLMTSNTRDYADSYPLPSSVLDPNDLLATLRYIYSIRSPGATIFKSTTILNASAPVVVSFSSRGPNRATKDVIKPDISGPGVEILAAWPSVAPVGGIRRNTLFNIISGTSMSCPHITGIATYVKTYNPTWSPAAIKSALMTTASPMNARFNPQAEFAYGSGHVNPLKAVRPGLVYDANESDYVKFLCGQGYNTQAVRRITGDYSACTSGNTGRVWDLNYPSFGLSVSPSQTFNQYFNRTLTSVAPQASTYRAMISAPQGLTISVNPNVLSFNGLGDRKSFTLTVRGSIKGFVVSASLVWSDGVHYVRSPITITSLV,./data/raw/alphafold//AF-Q39547-F1-model_v4.pdb,2875,1579,3169,1941
+743,5316,5402,MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDKLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVKYSPVTEKHLTDGMTVRELCSAAITMGDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDRWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGASERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEI,sabio,Q93LJ5,CC1(C)SC2C(NC(=O)C(N)c3ccc(O)cc3)C(=O)N2C1C(=O)O.O>>,50.0,99.73987191292991,37.0,7.0,3.5.2.6,584.0,1.6989700043360187,CC1(C)SC2C(NC(=O)C(N)c3ccc(O)cc3)C(=O)N2C1C(=O)O.O,,1.6989700043360187,CC1(C)SC2C(NC(=O)C(N)c3ccc(O)cc3)C(=O)N2C1C(=O)O.O__MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDKLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVKYSPVTEKHLTDGMTVRELCSAAITMGDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDRWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGASERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEI,./data/raw/alphafold//AF-Q93LJ5-F1-model_v4.pdb,1458,402,35,2356
+744,3932,3985,MQTKLLAIMLAAPVVFSSQEASASDFFGPEKISTEINLGTLSGKTKERVYEPEEGGRKVSQLDWKYSNAAILKGAVNWELNPWLSVGAAGWTTLNSRGGNMVDQDWMDSGTPGTWTDESRHPDTRLNYANEFDLNVKGWFLKESDYRLAIMAGYQESRYSFNATGGTYIYSENGGFRNETGALPDKIKVIGYKQHFKIPYVGLTGNYRYDNFEFGGAFKYSGWVRGSDNDEHYVRQTTFRSKVINQNYYSVAVNAGYYITPEAKVYIEGVWSRLTNKKGDTSLYDRSDNTSEHNNNGAGIENYNFITTAGLKYTF,brenda,P34210,CC(C)C[C@H](N=C(O)[C@@H](N)Cc1c[nH]c2ccccc12)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)=NCC(O)=N[C@@H](C)C(O)=NCC(=O)O.O>>,2.2,99.90576998642145,37.0,6.225,3.4.23.49,562.0,0.3424226808222063,CC(C)C[C@H](N=C(O)[C@@H](N)Cc1c[nH]c2ccccc12)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)=NCC(O)=N[C@@H](C)C(O)=NCC(=O)O.O,,0.3424226808222063,CC(C)C[C@H](N=C(O)[C@@H](N)Cc1c[nH]c2ccccc12)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)=NCC(O)=N[C@@H](C)C(O)=NCC(=O)O.O__MQTKLLAIMLAAPVVFSSQEASASDFFGPEKISTEINLGTLSGKTKERVYEPEEGGRKVSQLDWKYSNAAILKGAVNWELNPWLSVGAAGWTTLNSRGGNMVDQDWMDSGTPGTWTDESRHPDTRLNYANEFDLNVKGWFLKESDYRLAIMAGYQESRYSFNATGGTYIYSENGGFRNETGALPDKIKVIGYKQHFKIPYVGLTGNYRYDNFEFGGAFKYSGWVRGSDNDEHYVRQTTFRSKVINQNYYSVAVNAGYYITPEAKVYIEGVWSRLTNKKGDTSLYDRSDNTSEHNNNGAGIENYNFITTAGLKYTF,./data/raw/alphafold//AF-P34210-F1-model_v4.pdb,1867,1570,3157,1928
+745,9830,9979,SRHWHGFFQEGSSWADGPVGVTQCPIAPGDSFLYRFKVPDQAGTFWYHS,brenda,Q8X1D1,COc1cccc(OC)c1O.O=O>>COC1=CC(=C2C=C(OC)C(=O)C(OC)=C2)C=C(OC)C1=O.O,180.0,26.723535554177243,45.0,5.2,1.10.3.2,184115.0,2.255272505103306,COc1cccc(OC)c1O.O=O,COC1=CC(=C2C=C(OC)C(=O)C(OC)=C2)C=C(OC)C1=O.O,2.255272505103306,COc1cccc(OC)c1O.O=O__SRHWHGFFQEGSSWADGPVGVTQCPIAPGDSFLYRFKVPDQAGTFWYHS,./data/raw/alphafold//AF-Q8X1D1-F1-model_v4.pdb,3426,2327,1045,2946
+746,4769,4829,METRTLEDWRALLEAEKTLDSGVYNKHDLLIVRGQGARVWDAEGNEYIDCVGGYGVANLGHGNPEVVEAVKRQAETLMAMPQTLPTPMRGEFYRTLTAILPPELNRVFPVNSGTEANEAALKFARAHTGRKKFVAAMRGFSGRTMGSLSVTWEPKYREPFLPLVEPVEFIPYNDVEALKRAVDEETAAVILEPVQGEGGVRPATPEFLRAAREITQEKGALLILDEIQTGMGRTGKRFAFEHFGIVPDILTLAKALGGGVPLGVAVMREEVARSMPKGGHGTTFGGNPLAMAAGVAAIRYLERTRLWERAAELGPWFMEKLRAIPSPKIREVRGMGLMVGLELKEKAAPYIARLEKEHRVLALQAGPTVIRFLPPLVIEKEDLERVVEAVRAVLA,brenda,Q93R93,CC(O)=N[C@@H](CCCCN)C(=O)O.O=C(O)CCC(=O)C(=O)O>>CC(O)=N[C@@H](CCCC=O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O,0.8,0.0,45.0,8.9,2.6.1.118,274.0,-0.0969100130080563,CC(O)=N[C@@H](CCCCN)C(=O)O.O=C(O)CCC(=O)C(=O)O,CC(O)=N[C@@H](CCCC=O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O,-0.0969100130080563,CC(O)=N[C@@H](CCCCN)C(=O)O.O=C(O)CCC(=O)C(=O)O__METRTLEDWRALLEAEKTLDSGVYNKHDLLIVRGQGARVWDAEGNEYIDCVGGYGVANLGHGNPEVVEAVKRQAETLMAMPQTLPTPMRGEFYRTLTAILPPELNRVFPVNSGTEANEAALKFARAHTGRKKFVAAMRGFSGRTMGSLSVTWEPKYREPFLPLVEPVEFIPYNDVEALKRAVDEETAAVILEPVQGEGGVRPATPEFLRAAREITQEKGALLILDEIQTGMGRTGKRFAFEHFGIVPDILTLAKALGGGVPLGVAVMREEVARSMPKGGHGTTFGGNPLAMAAGVAAIRYLERTRLWERAAELGPWFMEKLRAIPSPKIREVRGMGLMVGLELKEKAAPYIARLEKEHRVLALQAGPTVIRFLPPLVIEKEDLERVVEAVRAVLA,./data/raw/alphafold//AF-Q93R93-F1-model_v4.pdb,2983,1726,3342,2147
+747,17595,17835,MNYNAPHRHAVIELSQSAVVHNLKVIKENTHAKEIMAVLKANAFSHGLPEMASLSITAGATRFGMAMLDEALILRDLGYIQPIDVLGLTDPRYARLAAERNITLAFSTKESIKAAAEQLAGTGLTLKVSLPVDTGLNRIGFKSREDLVAAIQEVSAQDTLIFQSMWTHFATADTPNVDYVDFQISEWQRLTHDLPVEPNEKHFANTGIATWYPEKINTDIVRLGIGLFGINGSVPIMSMPFELIPALSLKAKVVNSKPLKKGDAVGYGAEYHAPNDGYLITIPIGHSDGYPFNGSGMRALVADGQIGHIVGGVAMDQSMILVTNPVAVGTTVTLIGRVGDQSITMQDLAEHTQSSIVALMNDFAPRLQRIIVS,brenda,Q03Z32,N[C@@H](Cc1cnc[nH]1)C(=O)O>>N[C@H](Cc1cnc[nH]1)C(=O)O,96.9,0.0,30.0,7.0,5.1.1.24,33967.0,1.986323777050765,N[C@@H](Cc1cnc[nH]1)C(=O)O,N[C@H](Cc1cnc[nH]1)C(=O)O,1.986323777050765,N[C@@H](Cc1cnc[nH]1)C(=O)O__MNYNAPHRHAVIELSQSAVVHNLKVIKENTHAKEIMAVLKANAFSHGLPEMASLSITAGATRFGMAMLDEALILRDLGYIQPIDVLGLTDPRYARLAAERNITLAFSTKESIKAAAEQLAGTGLTLKVSLPVDTGLNRIGFKSREDLVAAIQEVSAQDTLIFQSMWTHFATADTPNVDYVDFQISEWQRLTHDLPVEPNEKHFANTGIATWYPEKINTDIVRLGIGLFGINGSVPIMSMPFELIPALSLKAKVVNSKPLKKGDAVGYGAEYHAPNDGYLITIPIGHSDGYPFNGSGMRALVADGQIGHIVGGVAMDQSMILVTNPVAVGTTVTLIGRVGDQSITMQDLAEHTQSSIVALMNDFAPRLQRIIVS,./data/raw/alphafold//AF-Q03Z32-F1-model_v4.pdb,2807,2380,2656,5495
+748,11988,12151,MFPSRRKAAQLPWEDGRSGLLSGGLPRKCSVFHLFVACLSLGFFSLLWLQLSCSGDVARAVRGQGQETSGPPRACPPEPPPEHWEEDASWGPHRLAVLVPFRERFEELLVFVPHMRRFLSRKKIRHHIYVLNQVDHFRFNRAALINVGFLESSNSTDYIAMHDVDLLPLNEELDYGFPEAGPFHVASPELHPLYHYKTYVGGILLLSKQHYRLCNGMSNRFWGWGREDDEFYRRIKGAGLQLFRPSGITTGYKTFRHLHDPAWRKRDQKRIAAQKQEQFKVDREGGLNTVKYHVASRTALSVGGAPCTVLNIMLDCDKTATPWCTFS,brenda,Q9UBV7,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12.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>>,72.0,99.88579103413934,37.0,6.6,2.4.1.133,9606.0,1.8573324964312683,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12.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,,1.8573324964312683,Cc1cc(=O)oc2cc(O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)ccc12.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__MFPSRRKAAQLPWEDGRSGLLSGGLPRKCSVFHLFVACLSLGFFSLLWLQLSCSGDVARAVRGQGQETSGPPRACPPEPPPEHWEEDASWGPHRLAVLVPFRERFEELLVFVPHMRRFLSRKKIRHHIYVLNQVDHFRFNRAALINVGFLESSNSTDYIAMHDVDLLPLNEELDYGFPEAGPFHVASPELHPLYHYKTYVGGILLLSKQHYRLCNGMSNRFWGWGREDDEFYRRIKGAGLQLFRPSGITTGYKTFRHLHDPAWRKRDQKRIAAQKQEQFKVDREGGLNTVKYHVASRTALSVGGAPCTVLNIMLDCDKTATPWCTFS,./data/raw/alphafold//AF-Q9UBV7-F1-model_v4.pdb,2968,1710,3323,2127
+749,6695,6809,MRDVFEMMDRYGHEQVIFCRHPQTGLKAIIALHNTTAGPALGGCRMIPYASTDEALEDVLRLSKGMTYKCSLADVDFGGGKMVIIGDPKKDKSPELFRVIGRFVGGLNGRFYTGTDMGTNPEDFVHAARESKSFAGLPKSYGGKGDTSIPTALGVFHGMRATARFLWGTDQLKGRVVAIQGVGKVGERLLQLLVEVGAYCKIADIDSVRCEQLKEKYGDKVQLVDVNRIHKESCDIFSPCAKGGVVNDDTIDEFRCLAIVGSANNQLVEDRHGALLQKRSICYAPDYLVNAGGLIQVADELEGFHEERVLAKTEAIYDMVLDIFHRAKNENITTCEAADRIVMERLKKLTDIRRILLEDPRNSARR,sabio,P22823,CCCCC(=O)C(=O)O.N.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1>>CCCCC(N)C(=O)O.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.O,79.0,0.0619450753665106,22.0,9.5,1.4.1.20,2024.0,1.8976270912904407,CCCCC(=O)C(=O)O.N.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,CCCCC(N)C(=O)O.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.O,1.8976270912904407,CCCCC(=O)C(=O)O.N.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1__MRDVFEMMDRYGHEQVIFCRHPQTGLKAIIALHNTTAGPALGGCRMIPYASTDEALEDVLRLSKGMTYKCSLADVDFGGGKMVIIGDPKKDKSPELFRVIGRFVGGLNGRFYTGTDMGTNPEDFVHAARESKSFAGLPKSYGGKGDTSIPTALGVFHGMRATARFLWGTDQLKGRVVAIQGVGKVGERLLQLLVEVGAYCKIADIDSVRCEQLKEKYGDKVQLVDVNRIHKESCDIFSPCAKGGVVNDDTIDEFRCLAIVGSANNQLVEDRHGALLQKRSICYAPDYLVNAGGLIQVADELEGFHEERVLAKTEAIYDMVLDIFHRAKNENITTCEAADRIVMERLKKLTDIRRILLEDPRNSARR,./data/raw/alphafold//AF-P22823-F1-model_v4.pdb,1591,1481,3051,1801
+750,11018,11173,MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,uniprot_search,P24155,C[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>C[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.N=C(O)CC[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],0.75,4.745544962737359e-14,37.0,8.0,3.4.24.15,10116.0,-0.1249387366082999,C[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,C[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.N=C(O)CC[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],-0.1249387366082999,C[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,./data/raw/alphafold//AF-P24155-F1-model_v4.pdb,1820,1500,3134,1830
+751,9725,9873,MALLAAATLNPTTHLSLRSRAGRNSENLWLRSAASSQKSKGRFCNLTIRAGTPSKPAEPIGPVFTKLKPWQIPKRDWFDKDFLFGASTSAYQIEGAWNEDGKGPSTWDHFCHTYPERISDRTNGDVAANSYHLYEEDVKALKDMGMKVYRFSIAWSRILPDGTGKVNQAGIDYYNKLINSLIDNDIVPYVTIWHWDTPQALEDKYGGFLNRKIVDDYKQFAEVCFKNFGDRVKNWFTFNEPHTYCCFSYGEGIHAPGRCSPGMDCAVPKGDSLREPYTAGHHILLAHAEAVELFKACYNKHGDSKIGMAFDVMGYEPFQDSFLDDQARERSIDYNLGWFLEPVVRGDYPFSMRSLIGDRLPKFTKEEQEKLASSCDIMGLNYYTSRFSKHIDISSDFTPKLNTDDAYASSETKGSDGNDIGPITGTYWIYMYPKGLTDLLLIMKEKYGNPPIFITENGIADVDSDPTMTDPLDDWKRLDYLQRHISAVKDAIDQGADVRGHFTWGLIDNFEWSLGYSSRFGLVYIDKKDGNKRKLKKSAKWFAKFNSVPKRLLKTTNNNATVTVTSVSV,sabio,Q1XIR9,COc1ccc2c(c1)OC(OC1OC(CO)C(O)C(O)C1O)C(=O)N2O.O>>COc1ccc2c(c1)OC(O)C(=O)N2O.OCC1OC(O)C(O)C(O)C1O,338.0,7.253600277264831e-15,30.0,5.5,3.2.1.182,4565.0,2.5289167002776547,COc1ccc2c(c1)OC(OC1OC(CO)C(O)C(O)C1O)C(=O)N2O.O,COc1ccc2c(c1)OC(O)C(=O)N2O.OCC1OC(O)C(O)C(O)C1O,2.5289167002776547,COc1ccc2c(c1)OC(OC1OC(CO)C(O)C(O)C1O)C(=O)N2O.O__MALLAAATLNPTTHLSLRSRAGRNSENLWLRSAASSQKSKGRFCNLTIRAGTPSKPAEPIGPVFTKLKPWQIPKRDWFDKDFLFGASTSAYQIEGAWNEDGKGPSTWDHFCHTYPERISDRTNGDVAANSYHLYEEDVKALKDMGMKVYRFSIAWSRILPDGTGKVNQAGIDYYNKLINSLIDNDIVPYVTIWHWDTPQALEDKYGGFLNRKIVDDYKQFAEVCFKNFGDRVKNWFTFNEPHTYCCFSYGEGIHAPGRCSPGMDCAVPKGDSLREPYTAGHHILLAHAEAVELFKACYNKHGDSKIGMAFDVMGYEPFQDSFLDDQARERSIDYNLGWFLEPVVRGDYPFSMRSLIGDRLPKFTKEEQEKLASSCDIMGLNYYTSRFSKHIDISSDFTPKLNTDDAYASSETKGSDGNDIGPITGTYWIYMYPKGLTDLLLIMKEKYGNPPIFITENGIADVDSDPTMTDPLDDWKRLDYLQRHISAVKDAIDQGADVRGHFTWGLIDNFEWSLGYSSRFGLVYIDKKDGNKRKLKKSAKWFAKFNSVPKRLLKTTNNNATVTVTSVSV,./data/raw/alphafold//AF-Q1XIR9-F1-model_v4.pdb,1219,3533,1311,3263
+752,17274,17505,MLAILYDRIRPDERMLFERAEALGLPYKKVYVPALPMVLGERPKELEGVTVALERCVSQSRGLAAARYLTALGIPVVNRPEVIEACGDKWATSVALAKAGLPQPKTALATDREEALRLMEAFGYPVVLKPVIGSWGRLLAKVTDRAAAEALLEHKEVLGGFQHQLFYIQEYVEKPGRDIRVFVVGERAIAAIYRRSAHWITNTARGGQAENCPLTEEVARLSVKAAEAVGGGVVAVDLFESERGLLVNEVNHTMEFKNSVHTTGVDIPGEILKYAWSLAS,brenda,Q5SH23,N[C@@H](CCCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,0.85,10000000.0,60.0,8.0,6.3.2.43,274.0,-0.0705810742857072,N[C@@H](CCCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,-0.0705810742857072,N[C@@H](CCCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MLAILYDRIRPDERMLFERAEALGLPYKKVYVPALPMVLGERPKELEGVTVALERCVSQSRGLAAARYLTALGIPVVNRPEVIEACGDKWATSVALAKAGLPQPKTALATDREEALRLMEAFGYPVVLKPVIGSWGRLLAKVTDRAAAEALLEHKEVLGGFQHQLFYIQEYVEKPGRDIRVFVVGERAIAAIYRRSAHWITNTARGGQAENCPLTEEVARLSVKAAEAVGGGVVAVDLFESERGLLVNEVNHTMEFKNSVHTTGVDIPGEILKYAWSLAS,./data/raw/alphafold//AF-Q5SH23-F1-model_v4.pdb,2659,5168,2308,5202
+753,13277,13452,MSFNESASIPTGLTYDDVLIIPQHSRVTSRKEVNTTTRLSRNVKLSIPIVASNMDTVCEQRMAVAMAREGGIGILHRFCSIEEQCAMLREVKRAQSFLIESPRIILPHETAREAWEGLNWKGRVGGVGCLLVVNCKNERKLLGIITRHDLKLADESTTVESLMTPVDKMVVSTNTSISLEEVTHLMRKGRTANVPIVGQNGQLLYLVTLSDVVKLRKNKQASLDSRGRLLVGAAVGVKKDDMNRAIRLVEAGADVLVVDIAHGHSDLCINMVKRLKGDPRTASVDIIAGNIASAEAAEALIDAGADGLKIGVGPGSICITRLVAGAGVPQLSAVLACTRVARRRGVPCIADGGLRTSGDISKAIGAGADTVMLGNMLAGTDEAPGRVLVKDGQKVKIIRGMAGFGANLSKAERERTQDEDVFSSLVPEGVEGSVACKGPVGPIVRQLVGGLRSGMSYSGAKSIEEMQRRTRFVRMTGAGLRESGSHGVAKL,brenda,Q57ZS7,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.N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.[H+]>>N.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=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O,0.519,0.0,35.0,8.0,1.7.1.7,5702.0,-0.2848326421515421,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.N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.[H+],N.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=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O,-0.2848326421515421,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.N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.[H+]__MSFNESASIPTGLTYDDVLIIPQHSRVTSRKEVNTTTRLSRNVKLSIPIVASNMDTVCEQRMAVAMAREGGIGILHRFCSIEEQCAMLREVKRAQSFLIESPRIILPHETAREAWEGLNWKGRVGGVGCLLVVNCKNERKLLGIITRHDLKLADESTTVESLMTPVDKMVVSTNTSISLEEVTHLMRKGRTANVPIVGQNGQLLYLVTLSDVVKLRKNKQASLDSRGRLLVGAAVGVKKDDMNRAIRLVEAGADVLVVDIAHGHSDLCINMVKRLKGDPRTASVDIIAGNIASAEAAEALIDAGADGLKIGVGPGSICITRLVAGAGVPQLSAVLACTRVARRRGVPCIADGGLRTSGDISKAIGAGADTVMLGNMLAGTDEAPGRVLVKDGQKVKIIRGMAGFGANLSKAERERTQDEDVFSSLVPEGVEGSVACKGPVGPIVRQLVGGLRSGMSYSGAKSIEEMQRRTRFVRMTGAGLRESGSHGVAKL,./data/raw/alphafold//AF-Q57ZS7-F1-model_v4.pdb,2335,4537,4461,4354
+754,3879,3932,MKKVSTLDLLFVAIMGVSPAAFAADLIDVSKLPSKAAQGAPGPVTLQAAVGAGGADELKAIRSTTLPNGKQVTRYEQFHNGVRVVGEAITEVKGPGKSVAAQRSGHFVANIAADLPGSTTAAVSAEQVLAQAKSLKAQGRKTENDKVELVIRLGENNIAQLVYNVSYLIPGEGLSRPHFVIDAKTGEVLDQWEGLAHAEAGGPGGNQKIGKYTYGSDYGPLIVNDRCEMDDGNVITVDMNSSTDDSKTTPFRFACPTNTYKQVNGAYSPLNDAHFFGGVVFKLYRDWFGTSPLTHKLYMKVHYGRSVENAYWDGTAMLFGDGATMFYPLVSLDVAAHEVSHGFTEQNSGLIYRGQSGGMNEAFSDMAGEAAEFYMRGKNDFLIGYDIKKGSGALRYMDQPSRDGRSIDNASQYYNGIDVHHSSGVYNRAFYLLANSPGWDTRKAFEVFVDANRYYWTATSNYNSGACGVIRSAQNRNYSAADVTRAFSTVGVTCPSAL,brenda,P14756,CC(C)C[C@H](N=C(O)CN=C(O)/C=C/c1ccco1)C(O)=N[C@@H](C)C(=O)O.O>>,95.0,99.7490136235405,55.0,6.659999999999999,3.4.24.26,287.0,1.977723605288848,CC(C)C[C@H](N=C(O)CN=C(O)/C=C/c1ccco1)C(O)=N[C@@H](C)C(=O)O.O,,1.977723605288848,CC(C)C[C@H](N=C(O)CN=C(O)/C=C/c1ccco1)C(O)=N[C@@H](C)C(=O)O.O__MKKVSTLDLLFVAIMGVSPAAFAADLIDVSKLPSKAAQGAPGPVTLQAAVGAGGADELKAIRSTTLPNGKQVTRYEQFHNGVRVVGEAITEVKGPGKSVAAQRSGHFVANIAADLPGSTTAAVSAEQVLAQAKSLKAQGRKTENDKVELVIRLGENNIAQLVYNVSYLIPGEGLSRPHFVIDAKTGEVLDQWEGLAHAEAGGPGGNQKIGKYTYGSDYGPLIVNDRCEMDDGNVITVDMNSSTDDSKTTPFRFACPTNTYKQVNGAYSPLNDAHFFGGVVFKLYRDWFGTSPLTHKLYMKVHYGRSVENAYWDGTAMLFGDGATMFYPLVSLDVAAHEVSHGFTEQNSGLIYRGQSGGMNEAFSDMAGEAAEFYMRGKNDFLIGYDIKKGSGALRYMDQPSRDGRSIDNASQYYNGIDVHHSSGVYNRAFYLLANSPGWDTRKAFEVFVDANRYYWTATSNYNSGACGVIRSAQNRNYSAADVTRAFSTVGVTCPSAL,./data/raw/alphafold//AF-P14756-F1-model_v4.pdb,1859,1554,3138,1907
+755,18555,18823,MELEHWEKNHSEAYSDISKSLENIKGIFVAYNSNIDAIKHIEKDDFDKLLKHVNLKNVKHRSMSFPRVIKDPDDLMARLVIAMRDGKAAEVPTYSTDVHEWLTNHIDFDNAYMGGQAGIISNFLANIDIKNVVTYVPWLSKEQAEYFTNSKNLLYPVVENSKLSFKHPINAYNPEYEPKVNWIMEFSKGLEVQCGEEEFVVPRDNRLILSSRPTWLRIDMSKELYEQLPELGKNVDGAILSGYQMIKENYEDGSTYHNYVKKSVDAIKRLKNGNPDIRIHVEFTSIQDKFIRERILKDIVSQHVHSLGLDTIEVANALNVLDYEELAYAVINKTEKGISALYEGAVRLLYELELERVHVHSLGYFICVVKNTHPVDIEDHRNALLFASTASAAKAKIGNIKSIDDIKKGLGTPVSEKGYNHLQELAKYLEKEGICLTEEFEKGYIRTPYHDVIIIPTKVVEKPVATVGIGDIISASAFAAVLAKMK,brenda,D7E8P3,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OC[C@H]1O[C@](O)(COP(=O)(O)O)[C@@H](O)[C@@H]1O,9.5,0.0,40.0,6.5,2.7.1.146,2322.0,0.9777236052888478,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OC[C@H]1O[C@](O)(COP(=O)(O)O)[C@@H](O)[C@@H]1O,0.9777236052888478,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O__MELEHWEKNHSEAYSDISKSLENIKGIFVAYNSNIDAIKHIEKDDFDKLLKHVNLKNVKHRSMSFPRVIKDPDDLMARLVIAMRDGKAAEVPTYSTDVHEWLTNHIDFDNAYMGGQAGIISNFLANIDIKNVVTYVPWLSKEQAEYFTNSKNLLYPVVENSKLSFKHPINAYNPEYEPKVNWIMEFSKGLEVQCGEEEFVVPRDNRLILSSRPTWLRIDMSKELYEQLPELGKNVDGAILSGYQMIKENYEDGSTYHNYVKKSVDAIKRLKNGNPDIRIHVEFTSIQDKFIRERILKDIVSQHVHSLGLDTIEVANALNVLDYEELAYAVINKTEKGISALYEGAVRLLYELELERVHVHSLGYFICVVKNTHPVDIEDHRNALLFASTASAAKAKIGNIKSIDDIKKGLGTPVSEKGYNHLQELAKYLEKEGICLTEEFEKGYIRTPYHDVIIIPTKVVEKPVATVGIGDIISASAFAAVLAKMK,./data/raw/alphafold//AF-D7E8P3-F1-model_v4.pdb,2059,4233,4106,3955
+756,18547,18813,MSSKLVLVLNCGSSSLKFAIIDAVNGDEYLSGLAECFHLPEARIKWKMDGSKQEAALGAGAAHSEALNFIVNTILAQKPELSAQLTAIGHRIVHGGEKYTSSVVIDESVIQGIKDSASFAPLHNPAHLIGIAEALKSFPQLKDKNVAVFDTAFHQTMPEESYLYALPYSLYKEHGVRRYGAHGTSHFYVTQEAAKMLNKPVEELNIITCHLGNGGSVSAIRNGKCVDTSMGLTPLEGLVMGTRSGDIDPAIIFHLHDTLGMSVDQINKMLTKESGLLGLTEVTSDCRYVEDNYATKEDAKRAMDVYCHRLAKYIGSYTALMDGRLDAVVFTGGIGENAAMVRELSLGKLGVLGFEVDHERNLAARFGKSGFINKEGTRPAVVIPTNEELVIAQDASRLTA,brenda,P63411,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=CO>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=COP(=O)(O)O,880.0,1.0265974398157876e-14,37.0,7.5,2.7.2.1,90371.0,2.9444826721501687,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=CO,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=COP(=O)(O)O,2.9444826721501687,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=CO__MSSKLVLVLNCGSSSLKFAIIDAVNGDEYLSGLAECFHLPEARIKWKMDGSKQEAALGAGAAHSEALNFIVNTILAQKPELSAQLTAIGHRIVHGGEKYTSSVVIDESVIQGIKDSASFAPLHNPAHLIGIAEALKSFPQLKDKNVAVFDTAFHQTMPEESYLYALPYSLYKEHGVRRYGAHGTSHFYVTQEAAKMLNKPVEELNIITCHLGNGGSVSAIRNGKCVDTSMGLTPLEGLVMGTRSGDIDPAIIFHLHDTLGMSVDQINKMLTKESGLLGLTEVTSDCRYVEDNYATKEDAKRAMDVYCHRLAKYIGSYTALMDGRLDAVVFTGGIGENAAMVRELSLGKLGVLGFEVDHERNLAARFGKSGFINKEGTRPAVVIPTNEELVIAQDASRLTA,./data/raw/alphafold//AF-P63411-F1-model_v4.pdb,1420,935,736,1031
+757,6639,6752,MAALRALLPRVRAPLRPWLFCPVQRSFASSAAFEYIITAKKGRNSNVGLIQLNRPKALNALCNGLIVELNQALQAFEEDPAVGAIVLTGGEKVFAAGADIKEMQSLTFQNCYSGGFLSHWDQLTRVKKPVIAAVNGYALGGGCELAMMCDIIYAGEKAQFGQPEILIGTIPGAGGTQRLTRAVGKSLAMEMVLTGDRISAQDAKQAGLVSKIFPVETVVEEAIQCAEKIASNSKIVTAMAKESVNAAFEMTLAEGVKLEKKLFYSTFATEDRKEGMAAFVEKRKANFKDQ,sabio,Q58DM8,CCCC=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.O>>CCCC(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,180.0,0.0,25.0,8.0,4.2.1.17,9913.0,2.255272505103306,CCCC=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.O,CCCC(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,2.255272505103306,CCCC=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.O__MAALRALLPRVRAPLRPWLFCPVQRSFASSAAFEYIITAKKGRNSNVGLIQLNRPKALNALCNGLIVELNQALQAFEEDPAVGAIVLTGGEKVFAAGADIKEMQSLTFQNCYSGGFLSHWDQLTRVKKPVIAAVNGYALGGGCELAMMCDIIYAGEKAQFGQPEILIGTIPGAGGTQRLTRAVGKSLAMEMVLTGDRISAQDAKQAGLVSKIFPVETVVEEAIQCAEKIASNSKIVTAMAKESVNAAFEMTLAEGVKLEKKLFYSTFATEDRKEGMAAFVEKRKANFKDQ,./data/raw/alphafold//AF-Q58DM8-F1-model_v4.pdb,1696,2085,3744,2600
+758,7964,8092,MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,brenda,A0A077JBW9,CCO[P@@](=O)(Oc1ccc([N+](=O)[O-])cc1)OC1CCCCC1.O>>CCOP(=O)(O)OC1CCCCC1.O=[N+]([O-])c1ccc(O)cc1,2.5,4.0858801840122605e-14,30.0,8.5,3.1.8.1,453246.0,0.3979400086720376,CCO[P@@](=O)(Oc1ccc([N+](=O)[O-])cc1)OC1CCCCC1.O,CCOP(=O)(O)OC1CCCCC1.O=[N+]([O-])c1ccc(O)cc1,0.3979400086720376,CCO[P@@](=O)(Oc1ccc([N+](=O)[O-])cc1)OC1CCCCC1.O__MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,./data/raw/alphafold//AF-A0A077JBW9-F1-model_v4.pdb,3110,1877,3509,2328
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+779,4062,4115,MFSSVMVALVSLAVAVSANPGLSLKVSGPEAVDGVNNLKVVTTITNTGDETLKLLNDPRGALHTMPTDTFAITNESGETPSFIGVKVKYVPSMAAKSTGENVFAVIAPGQSVNVEHDLSAAYNFTSSGAGTYALEALNVFNYIDPETNEPVEIWADAEAHTTAVSGKLAVVRATPTLTRPVTYNGCSSSEQSALAAAASAAQSYVAESLSYLQTHTAATPRYTTWFGSYISSRHSTVLQHYTDMNSNDFSSYSFDCTCTAAGTFAYVYPNRFGTVYLCGAFWKAPTTGTDSQAGTLVHESSHFTRNGGTKDYAYGQAAAKSLATMDPDKAVMNADNHEYFSENNPAQS,brenda,P81054,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N=C(O)[C@H](C)N=C(O)[C@@H](N=C(O)[C@H](CO)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](C)O)[C@@H](C)O)C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O>>CC(C)C[C@H](N=C(O)[C@@H](N)CCCCN)C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.C[C@H](N=C(O)[C@@H](N=C(O)[C@H](CO)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)O)C(O)=N[C@H](C(=O)O)[C@@H](C)O,21.0,1.0549846858400023e-14,37.0,9.5,3.4.24.20,5627.0,1.3222192947339193,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N=C(O)[C@H](C)N=C(O)[C@@H](N=C(O)[C@H](CO)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](C)O)[C@@H](C)O)C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O,CC(C)C[C@H](N=C(O)[C@@H](N)CCCCN)C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.C[C@H](N=C(O)[C@@H](N=C(O)[C@H](CO)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)O)C(O)=N[C@H](C(=O)O)[C@@H](C)O,1.3222192947339193,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N=C(O)[C@H](C)N=C(O)[C@@H](N=C(O)[C@H](CO)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](C)O)[C@@H](C)O)C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O__MFSSVMVALVSLAVAVSANPGLSLKVSGPEAVDGVNNLKVVTTITNTGDETLKLLNDPRGALHTMPTDTFAITNESGETPSFIGVKVKYVPSMAAKSTGENVFAVIAPGQSVNVEHDLSAAYNFTSSGAGTYALEALNVFNYIDPETNEPVEIWADAEAHTTAVSGKLAVVRATPTLTRPVTYNGCSSSEQSALAAAASAAQSYVAESLSYLQTHTAATPRYTTWFGSYISSRHSTVLQHYTDMNSNDFSSYSFDCTCTAAGTFAYVYPNRFGTVYLCGAFWKAPTTGTDSQAGTLVHESSHFTRNGGTKDYAYGQAAAKSLATMDPDKAVMNADNHEYFSENNPAQS,./data/raw/alphafold//AF-P81054-F1-model_v4.pdb,2885,1592,3186,1958
+780,19232,19518,MRVVVIGAGVIGLSTALCIHERYHSVLQPLDVKVYADRFTPFTTTDVAAGLWQPYTSEPSNPQEANWNQQTFNYLLSHIGSPNAANMGLTPVSGYNLFREAVPDPYWKDMVLGFRKLTPRELDMFPDYRYGWFNTSLILEGRKYLQWLTERLTERGVKFFLRKVESFEEVARGGADVIINCTGVWAGVLQPDPLLQPGRGQIIKVDAPWLKNFIITHDLERGIYNSPYIIPGLQAVTLGGTFQVGNWNEINNIQDHNTIWEGCCRLEPTLKDAKIVGEYTGFRPVRPQVRLEREQLRFGSSNTEVIHNYGHGGYGLTIHWGCALEVAKLFGKVLEERNLLTMPPSHL,sabio,P00371,O.O=C(O)C1CCCN1.O=O>>CCCC(=O)C(=O)O.N.OO,9.8,0.6048495976669889,25.0,8.3,1.4.3.3,9823.0,0.9912260756924948,O.O=C(O)C1CCCN1.O=O,CCCC(=O)C(=O)O.N.OO,1.3222192947339193,O.O=C(O)C1CCCN1.O=O__MRVVVIGAGVIGLSTALCIHERYHSVLQPLDVKVYADRFTPFTTTDVAAGLWQPYTSEPSNPQEANWNQQTFNYLLSHIGSPNAANMGLTPVSGYNLFREAVPDPYWKDMVLGFRKLTPRELDMFPDYRYGWFNTSLILEGRKYLQWLTERLTERGVKFFLRKVESFEEVARGGADVIINCTGVWAGVLQPDPLLQPGRGQIIKVDAPWLKNFIITHDLERGIYNSPYIIPGLQAVTLGGTFQVGNWNEINNIQDHNTIWEGCCRLEPTLKDAKIVGEYTGFRPVRPQVRLEREQLRFGSSNTEVIHNYGHGGYGLTIHWGCALEVAKLFGKVLEERNLLTMPPSHL,./data/raw/alphafold//AF-P00371-F1-model_v4.pdb,2817,3638,1430,1102
+781,15665,15890,MKIISAEQVHQNLNFEELIPLLKQSFSRPFSMPQRQVYSLAPEQSENHDAFALLPSWNEEVIGNKAFTYFPDNAKKHDLPGLFSKIMLFKRQTGEPLALVDGTSVTYWRTAAISALASQLLSRKNSQHLMLFGTGNLASYLVKAHLTVRDIKQVTLWGRNAKKVSKLIADFSILYPAVTFKTSVDVNAEVASADIICCATGAKTPLFDGNSVSAGCHIDCLGNHMTDARECDTTTILRARVFVDSLTNTLNEAGELLIPMAEDAFNKDEIVGELADMCKTPSMLRQSSDEITLFKSVGTAISDLVAAHSVVEKLAD,sabio,Q485R8,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]>>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=C(O)C1CC(O)CN1,3678.0,7.955422768350326,30.0,6.5,1.5.1.-,28229.0,3.565611724902059,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],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=C(O)C1CC(O)CN1,3.565611724902059,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]__MKIISAEQVHQNLNFEELIPLLKQSFSRPFSMPQRQVYSLAPEQSENHDAFALLPSWNEEVIGNKAFTYFPDNAKKHDLPGLFSKIMLFKRQTGEPLALVDGTSVTYWRTAAISALASQLLSRKNSQHLMLFGTGNLASYLVKAHLTVRDIKQVTLWGRNAKKVSKLIADFSILYPAVTFKTSVDVNAEVASADIICCATGAKTPLFDGNSVSAGCHIDCLGNHMTDARECDTTTILRARVFVDSLTNTLNEAGELLIPMAEDAFNKDEIVGELADMCKTPSMLRQSSDEITLFKSVGTAISDLVAAHSVVEKLAD,./data/raw/alphafold//AF-Q485R8-F1-model_v4.pdb,2537,4561,4491,4390
+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
+783,18026,18280,MTVDAFTQFLCDLPKCEHHVHLEGTLSPELLFKLAEKNGITLPEDFPASPEALDERYQRFTGLDDFLQFYYIGMNALISEQDFEDLAYEYYAKSSSEGVVHAEVFFDPQAHTDRGIALETVVNGFNKGLKRAETDFGVSTKLIMCLLRHLPVASGVKTVHEAKDFIESGLISGIGLDSSEKGQNPGKFKDIYDAAKSLGVETLRYTAHAGEEGPAQYVDEALSVLGVERIDHGVNSVHDPHVLKRLADNKVLLTVCPLSNLKLRVVDDVAKVPLRELLDAGVRFSINCDDPAYFGGYCLDNYKAVQEKFKFDVPTWCTIVENGILGSWISLSRREELLNKLAQVKEKYQDLTPN,brenda,L8BT48,Nc1nc[nH]c2ncnc1-2.O>>N.Oc1ncnc2[nH]cnc12,20.8,9.249148826972571e-15,40.0,7.4,3.5.4.2,409370.0,1.3180633349627615,Nc1nc[nH]c2ncnc1-2.O,N.Oc1ncnc2[nH]cnc12,1.3180633349627615,Nc1nc[nH]c2ncnc1-2.O__MTVDAFTQFLCDLPKCEHHVHLEGTLSPELLFKLAEKNGITLPEDFPASPEALDERYQRFTGLDDFLQFYYIGMNALISEQDFEDLAYEYYAKSSSEGVVHAEVFFDPQAHTDRGIALETVVNGFNKGLKRAETDFGVSTKLIMCLLRHLPVASGVKTVHEAKDFIESGLISGIGLDSSEKGQNPGKFKDIYDAAKSLGVETLRYTAHAGEEGPAQYVDEALSVLGVERIDHGVNSVHDPHVLKRLADNKVLLTVCPLSNLKLRVVDDVAKVPLRELLDAGVRFSINCDDPAYFGGYCLDNYKAVQEKFKFDVPTWCTIVENGILGSWISLSRREELLNKLAQVKEKYQDLTPN,./data/raw/alphafold//AF-L8BT48-F1-model_v4.pdb,3585,4806,4868,4716
+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
+785,15647,15871,MASHLVLYTGAKMPILGLGTWKSPPGKVTEAVKVAIDLGYRHIDCAHVYQNENEVGLGLQEKLQGQVVKREDLFIVSKLWCTDHEKNLVKGACQTTLRDLKLDYLDLYLIHWPTGFKPGKDPFPLDGDGNVVPDESDFVETWEAMEELVDEGLVKAIGVSNFNHLQVEKILNKPGLKYKPAVNQIEVHPYLTQEKLIEYCKSKGIVVTAYSPLGSPDRPWAKPEDPSLLEDPRIKAIAAKYNKTTAQVLIRFPMQRNLIVIPKSVTPERIAENFQVFDFELSPEDMNTLLSYNRNWRVCALMSCASHKDYPFHEEY,sabio,P80276,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.OCC1OC(O)C(O)C(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)C(O)C(O)CO,1.2,0.0,30.0,6.5,1.1.1.21,9823.0,0.0791812460476248,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.OCC1OC(O)C(O)C(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)C(O)C(O)CO,0.0791812460476248,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.OCC1OC(O)C(O)C(O)C1O.[H]__MASHLVLYTGAKMPILGLGTWKSPPGKVTEAVKVAIDLGYRHIDCAHVYQNENEVGLGLQEKLQGQVVKREDLFIVSKLWCTDHEKNLVKGACQTTLRDLKLDYLDLYLIHWPTGFKPGKDPFPLDGDGNVVPDESDFVETWEAMEELVDEGLVKAIGVSNFNHLQVEKILNKPGLKYKPAVNQIEVHPYLTQEKLIEYCKSKGIVVTAYSPLGSPDRPWAKPEDPSLLEDPRIKAIAAKYNKTTAQVLIRFPMQRNLIVIPKSVTPERIAENFQVFDFELSPEDMNTLLSYNRNWRVCALMSCASHKDYPFHEEY,./data/raw/alphafold//AF-P80276-F1-model_v4.pdb,1329,607,3631,4939
+786,15388,15612,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.O=C1Nc2ccccc2C1=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=C1Nc2ccccc2C1=O,33.0,0.0564671717341492,25.0,7.0,1.1.1.-,4896.0,1.5185139398778875,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=C1Nc2ccccc2C1=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=C1Nc2ccccc2C1=O,1.5185139398778875,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=C1Nc2ccccc2C1=O__MLIAAMGPKIPVPAYGVGTALFKKEKGEINRTIVDSVKNALAAGFIHIDCAEVYGNEEEVGVALKEANVPRSKLFITSKVMHNVDNIPEALNESLRKLGTDYLDLYLLHSPIPFYEKKIPISEGWKAMETALGTGLVHSVGVSNFRIPDLEELLKTSTITPRVNQIEFHPQVYKAAKPLVEFCQSKGIIVEGYGPLSPLVRDAQGPVAEFTKSLESKYHVSDTQILLKWAYSKGVIPITTTSKIERMKECLNFDSFTLDKADIDELGTLGVQHHKRTFMKHMDE,./data/raw/alphafold//AF-O13848-F1-model_v4.pdb,2542,4991,2077,4937
+787,22223,22556,VDVHNYTFVLQEKNFTKWCSTKSMLVVNGSFPGPTITARKGDTIFVNVINQGKYGITIHWHGVKQPRNPWSDGPEYITQCPIKPGTNFIYEVILSTEEGTIWWHAHSDWTRATVHGALVILPANGTTYPFPPPYQEQTIVLASWFKGDVMEVIISSEETGVFPAAADGFTINGELGDLYNCSKETTYRLSVQPNKTYLLRIVNAVLNEEKFFGIAKHTLTVVAQDASYIKPINTSYIMITPGQTMDVLFTTDQTPSHYYMVASPFHDALDTFANFSTNAIIQYNGSYKAPKSPFVKPLPVYNDIKAADKFTGKLRSLANEKFPVNVPKVNVRRIFMAVSLNIVKCANKSCNNNIGHSTSASLNNISFALPQTDVLQAYYRGVFGRDFPTVQKKANFSLNTAQGTQVLMIEYGEAVEIVYQGTNLGAATSHPMHLHGFNFYLVGTGAGTFNNVTDPPKYNLVDPPELNTINLPRIGWAAIRFVADNPGVWFLHCHFERHTTEGMATVVIVKDGGTTNTSMLPSPAYMPPCS,brenda,Q8H979,O=O.Oc1ccccc1O>>O.O=C1C=CC=CC1O,2.6,5.155270114328061,25.0,5.0,1.10.3.2,4013.0,0.414973347970818,O=O.Oc1ccccc1O,O.O=C1C=CC=CC1O,0.414973347970818,O=O.Oc1ccccc1O__VDVHNYTFVLQEKNFTKWCSTKSMLVVNGSFPGPTITARKGDTIFVNVINQGKYGITIHWHGVKQPRNPWSDGPEYITQCPIKPGTNFIYEVILSTEEGTIWWHAHSDWTRATVHGALVILPANGTTYPFPPPYQEQTIVLASWFKGDVMEVIISSEETGVFPAAADGFTINGELGDLYNCSKETTYRLSVQPNKTYLLRIVNAVLNEEKFFGIAKHTLTVVAQDASYIKPINTSYIMITPGQTMDVLFTTDQTPSHYYMVASPFHDALDTFANFSTNAIIQYNGSYKAPKSPFVKPLPVYNDIKAADKFTGKLRSLANEKFPVNVPKVNVRRIFMAVSLNIVKCANKSCNNNIGHSTSASLNNISFALPQTDVLQAYYRGVFGRDFPTVQKKANFSLNTAQGTQVLMIEYGEAVEIVYQGTNLGAATSHPMHLHGFNFYLVGTGAGTFNNVTDPPKYNLVDPPELNTINLPRIGWAAIRFVADNPGVWFLHCHFERHTTEGMATVVIVKDGGTTNTSMLPSPAYMPPCS,./data/raw/alphafold//AF-Q8H979-F1-model_v4.pdb,3427,2328,1046,2947
+788,2976,3018,MAETPTLRIHEVCPISPPQETPSTTIPFTFFDVLWLRLPPVERLFFYSFPNPTTTSSFFDTTILPNLKHSLSLTLHHFPPLAGTITWPLHTPLPLIAYTPGNSIPFRIAESNADFNTLSSNLSEVNNHRRNLIPHLPTSHEEASVLALQLTHFPNQGYSIGITSHHAALDGKSSTLFMKSWAHICSYLNTSPEEPLLFSLPKHLTPSFDRSVIRDPLGIGEIYAKSWTSFGGATNDRSLNVWDTLGGNQTDLVKGLFELTPLDIKKLKKLAESKFVVGDNKKKVRVTSFTVTCAYLLSCAVKAEQPNCERVHFVFNVDCRARLDPPIPETYFGNCVVALLASAKREELLGEEAFFKSVIGISEELNGLEGDVLNGADKWIPKIQSVVSETPRLFSVAGSPRFEVYGIDFGWGRPEKVDVASVNKTGAFSLSESRDHSGGIQIGLALTKNQMEAFSRVFAQGLESLES,brenda,A0A1Y9TFD9,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.O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12>>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)CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H](O)[C@@H]1O,19.21,0.0,30.0,7.2,2.3.1.115,3847.0,1.2835273648616936,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.O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12,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)CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H](O)[C@@H]1O,1.2835273648616936,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.O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12__MAETPTLRIHEVCPISPPQETPSTTIPFTFFDVLWLRLPPVERLFFYSFPNPTTTSSFFDTTILPNLKHSLSLTLHHFPPLAGTITWPLHTPLPLIAYTPGNSIPFRIAESNADFNTLSSNLSEVNNHRRNLIPHLPTSHEEASVLALQLTHFPNQGYSIGITSHHAALDGKSSTLFMKSWAHICSYLNTSPEEPLLFSLPKHLTPSFDRSVIRDPLGIGEIYAKSWTSFGGATNDRSLNVWDTLGGNQTDLVKGLFELTPLDIKKLKKLAESKFVVGDNKKKVRVTSFTVTCAYLLSCAVKAEQPNCERVHFVFNVDCRARLDPPIPETYFGNCVVALLASAKREELLGEEAFFKSVIGISEELNGLEGDVLNGADKWIPKIQSVVSETPRLFSVAGSPRFEVYGIDFGWGRPEKVDVASVNKTGAFSLSESRDHSGGIQIGLALTKNQMEAFSRVFAQGLESLES,./data/raw/alphafold//AF-A0A1Y9TFD9-F1-model_v4.pdb,1687,1305,4607,1571
+789,11051,11206,MTEFELPPKYITAANDLRSDTFTTPTAEMMEAALEASIGDAVYGEDVDTVRLEQTVARMAGKEAGLFCVSGTLSNQIAIRTHLMQPPYSILCDYRAHVYTHEAAGLAILSQAMVVPVVPSNGDYLTLEDIKSHYVPDDGDIHGAPTRLISLENTLHGIVYPLEELVRIKAWCMENGLKLHCDGARIWNAAAQSGVPLKQYGEIFDSISICLSKSMGAPIGSVLVGNLKFVKKATHFRKQQGGGIRQSGMMARMALVNINNDWKSQLLYSHSLAHELAEYCEAKGIPLESPADTNFVFINLKAARMDPDVLVKKGLKYNVKLMGGRVSFHYQVTRDTLEKVKLAISEAFDYAKEHPFDCNGPTQIYRSESTEVDVDGNAIREIKTYKY,brenda,P37303,C[C@H](O)[C@H](N)C(=O)O>>CC=O.NCC(=O)O,41.0,0.0,30.0,8.0,4.1.2.48,4932.0,1.6127838567197357,C[C@H](O)[C@H](N)C(=O)O,CC=O.NCC(=O)O,1.6127838567197357,C[C@H](O)[C@H](N)C(=O)O__MTEFELPPKYITAANDLRSDTFTTPTAEMMEAALEASIGDAVYGEDVDTVRLEQTVARMAGKEAGLFCVSGTLSNQIAIRTHLMQPPYSILCDYRAHVYTHEAAGLAILSQAMVVPVVPSNGDYLTLEDIKSHYVPDDGDIHGAPTRLISLENTLHGIVYPLEELVRIKAWCMENGLKLHCDGARIWNAAAQSGVPLKQYGEIFDSISICLSKSMGAPIGSVLVGNLKFVKKATHFRKQQGGGIRQSGMMARMALVNINNDWKSQLLYSHSLAHELAEYCEAKGIPLESPADTNFVFINLKAARMDPDVLVKKGLKYNVKLMGGRVSFHYQVTRDTLEKVKLAISEAFDYAKEHPFDCNGPTQIYRSESTEVDVDGNAIREIKTYKY,./data/raw/alphafold//AF-P37303-F1-model_v4.pdb,3657,3651,1446,3409
+790,5969,6063,MANLRESSRDKSRWSLEGMTALVTGGSKGIGEAVVEELAMLGARVHTCARDETQLQESLREWQAKGFQVTTSVCDVSSRDQREKLMETVSSLFQGKLNILVNNAGTCITKPTIDYTSEDFSFLMSTNLESSFHLSQLAHPLLKSSGLGSIVLISSVASVVHVNVGSIYGATKGAMNQLARNLACEWASDSIKVNSVCPGFISTPLASNYFRNEEFKKEVENIIPTGRVGEANEVSSLVAYLCLPAASYVTGQTICVDGGFSVNGFTFKSLPLR,sabio,A7DY56,CC1CCC(O)CC1.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>>CC1CCC(=O)CC1.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],0.17,6.616585732920654e-15,30.0,9.5,1.1.1.-,270110.0,-0.7695510786217261,CC1CCC(O)CC1.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,CC1CCC(=O)CC1.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],-0.7695510786217261,CC1CCC(O)CC1.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__MANLRESSRDKSRWSLEGMTALVTGGSKGIGEAVVEELAMLGARVHTCARDETQLQESLREWQAKGFQVTTSVCDVSSRDQREKLMETVSSLFQGKLNILVNNAGTCITKPTIDYTSEDFSFLMSTNLESSFHLSQLAHPLLKSSGLGSIVLISSVASVVHVNVGSIYGATKGAMNQLARNLACEWASDSIKVNSVCPGFISTPLASNYFRNEEFKKEVENIIPTGRVGEANEVSSLVAYLCLPAASYVTGQTICVDGGFSVNGFTFKSLPLR,./data/raw/alphafold//AF-A7DY56-F1-model_v4.pdb,3453,1430,337,381
+791,9003,9145,MKNTLLKLGVCVSLLGITPFVSTISSVQAERTVEHKVIKNETGTISISQLNKNVWVHTELGYFSGEAVPSNGLVLNTSKGLVLVDSSWDDKLTKELIEMVEKKFKKRVTDVIITHAHADRIGGMKTLKERGIKAHSTALTAELAKKNGYEEPLGDLQSVTNLKFGNMKVETFYPGKGHTEDNIVVWLPQYQILAGGCLVKSASSKDLGNVADAYVNEWSTSIENVLKRYGNINLVVPGHGEVGDRGLLLHTLDLLK,sabio,P14488,COC1(NC(=O)Cc2cccs2)C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC21.O>>,0.2,99.77602329357748,30.0,6.0,3.5.2.6,1396.0,-0.6989700043360187,COC1(NC(=O)Cc2cccs2)C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC21.O,,-0.6989700043360187,COC1(NC(=O)Cc2cccs2)C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC21.O__MKNTLLKLGVCVSLLGITPFVSTISSVQAERTVEHKVIKNETGTISISQLNKNVWVHTELGYFSGEAVPSNGLVLNTSKGLVLVDSSWDDKLTKELIEMVEKKFKKRVTDVIITHAHADRIGGMKTLKERGIKAHSTALTAELAKKNGYEEPLGDLQSVTNLKFGNMKVETFYPGKGHTEDNIVVWLPQYQILAGGCLVKSASSKDLGNVADAYVNEWSTSIENVLKRYGNINLVVPGHGEVGDRGLLLHTLDLLK,./data/raw/alphafold//AF-P14488-F1-model_v4.pdb,1462,998,813,1132
+792,6095,6189,MAPVTIEKFVNQEERHLVSNRSATIPFGEYIFKRLLSIDTKSVFGVPGDFNLSLLEYLYSPSVESAGLRWVGTCNELNAAYAADGYSRYSNKIGCLITTYGVGELSALNGIAGSFAENVKVLHIVGVAKSIDSRSSNFSDRNLHHLVPQLHDSNFKGPNHKVYHDMVKDRVACSVAYLEDIETACDQVDNVIRDIYKYSKPGYIFVPADFADMSVTCDNLVNVPRISQQDCIVYPSENQLSDIINKITSWIYSSKTPAILGDVLTDRYGVSNFLNKLICKTGIWNFSTVMGKSVIDESNPTYMGQYNGKEGLKQVYEHFELCDLVLHFGVDINEINNGHYTFTYKPNAKIIQFHPNYIRLVDTRQGNEQMFKGINFAPILKELYKRIDVSKLSLQYDSNVTQYTNETMRLEDPTNGQSSIITQVHLQKTMPKFLNPGDVVVCETGSFQFSVRDFAFPSQLKYISQGFFLSIGMALPAALGVGIAMQDHSNAHINGGNVKEDYKPRLILFEGDGAAQMTIQELSTILKCNIPLEVIIWNNNGYTIERAIMGPTRSYNDVMSWKWTKLFEAFGDFDGKYTNSTLIQCPSKLALKLEELKNSNKRSGIELLEVKLGELDFPEQLKCMVEAAALKRNKK,brenda,Q06408,CCC(=O)C(=O)O>>,3.9,99.02996439969348,30.0,7.0,4.1.1.43,4932.0,0.5910646070264992,CCC(=O)C(=O)O,,0.5910646070264992,CCC(=O)C(=O)O__MAPVTIEKFVNQEERHLVSNRSATIPFGEYIFKRLLSIDTKSVFGVPGDFNLSLLEYLYSPSVESAGLRWVGTCNELNAAYAADGYSRYSNKIGCLITTYGVGELSALNGIAGSFAENVKVLHIVGVAKSIDSRSSNFSDRNLHHLVPQLHDSNFKGPNHKVYHDMVKDRVACSVAYLEDIETACDQVDNVIRDIYKYSKPGYIFVPADFADMSVTCDNLVNVPRISQQDCIVYPSENQLSDIINKITSWIYSSKTPAILGDVLTDRYGVSNFLNKLICKTGIWNFSTVMGKSVIDESNPTYMGQYNGKEGLKQVYEHFELCDLVLHFGVDINEINNGHYTFTYKPNAKIIQFHPNYIRLVDTRQGNEQMFKGINFAPILKELYKRIDVSKLSLQYDSNVTQYTNETMRLEDPTNGQSSIITQVHLQKTMPKFLNPGDVVVCETGSFQFSVRDFAFPSQLKYISQGFFLSIGMALPAALGVGIAMQDHSNAHINGGNVKEDYKPRLILFEGDGAAQMTIQELSTILKCNIPLEVIIWNNNGYTIERAIMGPTRSYNDVMSWKWTKLFEAFGDFDGKYTNSTLIQCPSKLALKLEELKNSNKRSGIELLEVKLGELDFPEQLKCMVEAAALKRNKK,./data/raw/alphafold//AF-Q06408-F1-model_v4.pdb,1248,3065,602,690
+793,8402,8533,MQSKTTRRSFVKGLAATGLLGGLGMWRAPVWAVTSPGQPNVLTGTDFDLYIGELPVNITGTVRTAMAINGSIPGPILRWREGDTVTLRVRNRLQQDTSIHWHGIILPANMDGVPGLSFHGIAPDGMYEYKFKVQQNGTYWYHSHSGFQEQVGVYGALVIDAKEPEPFTYDRDYVVMLSDWTDEDPARVLSKLKKQSDYYNYHKRTVGDFVNDVSEMGWSAAVADRKMWAEMKMSPTDLADVSGYTYTYLMNGQAPDGNWTGVFKPGEKIRLRFINGSAMTYFDVRIPGLKMTVVAADGQHVKRVAVDEFRIAVAETYDVIVEPEDEQAYTIFAQSMDRTGYSRGTLAVREGMQAAVPAVDPRPLISMSDMGMDHGSMAGMDHGNMAGMDHSKMAGMDHGNMAGMDHSKMAGMDHGNMTGMDHSKMAGMDHGSMAGMDHSKMAEMDHGGMAGMDHSKMAGMDQGGMADMDHSKMAGMDQGGMADMDHSSMEGMGGAMQSHPASETNNPLVDMQTMSPTPKLDDPGIGLRNNGRRVLTYADLRSTFIDPDGREPGRTIELHLTGHMEKFAWSFDGVKFSDAEPLRLKYGERLRITLVNDTMMTHPIHLHGMWSDLEDEDGNFMVRKHTIDMPPGSKRSYRVTADALGRWAYHCHLLFHMEMGMFREVRVDE,sabio,Q88C03,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,2.4,1.4837780463171737,20.0,4.0,1.10.3.2,303.0,0.380211241711606,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,0.380211241711606,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O__MQSKTTRRSFVKGLAATGLLGGLGMWRAPVWAVTSPGQPNVLTGTDFDLYIGELPVNITGTVRTAMAINGSIPGPILRWREGDTVTLRVRNRLQQDTSIHWHGIILPANMDGVPGLSFHGIAPDGMYEYKFKVQQNGTYWYHSHSGFQEQVGVYGALVIDAKEPEPFTYDRDYVVMLSDWTDEDPARVLSKLKKQSDYYNYHKRTVGDFVNDVSEMGWSAAVADRKMWAEMKMSPTDLADVSGYTYTYLMNGQAPDGNWTGVFKPGEKIRLRFINGSAMTYFDVRIPGLKMTVVAADGQHVKRVAVDEFRIAVAETYDVIVEPEDEQAYTIFAQSMDRTGYSRGTLAVREGMQAAVPAVDPRPLISMSDMGMDHGSMAGMDHGNMAGMDHSKMAGMDHGNMAGMDHSKMAGMDHGNMTGMDHSKMAGMDHGSMAGMDHSKMAEMDHGGMAGMDHSKMAGMDQGGMADMDHSKMAGMDQGGMADMDHSSMEGMGGAMQSHPASETNNPLVDMQTMSPTPKLDDPGIGLRNNGRRVLTYADLRSTFIDPDGREPGRTIELHLTGHMEKFAWSFDGVKFSDAEPLRLKYGERLRITLVNDTMMTHPIHLHGMWSDLEDEDGNFMVRKHTIDMPPGSKRSYRVTADALGRWAYHCHLLFHMEMGMFREVRVDE,./data/raw/alphafold//AF-Q88C03-F1-model_v4.pdb,3410,2298,1008,2903
+794,15008,15219,MKNNGGARVVVIGAGFVGASYVFALMNQGIADEIVLIDANESKAIGDAMDFNHGKVFAPKPVDIWHGDYDDCRDADLVVICAGANQKPGETRLDLVDKNIAIFRSIVESVMASGFQGLFLVATNPVDILTYATWKFSGLPHERVIGSGTILDTARFRFLLGEYFSVAPQNVHAYIIGEHGDTELPVWSQAYIGVMPIRKLVESKGEEAQKDLERIFVNVRDAAYQIIEKKGATYYGIAMGLARVTRAILHNENAILTVSAYLDGLYGERDVYIGVPAVINRNGIREVIEIELNDDEKNRFHHSAATLKSVLARAFTR,sabio,P00344,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.NCCCCC(=O)C(=O)O.[H]>>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)c1,0.008,9.964049964456178,25.0,6.0,1.1.1.27,1422.0,-2.096910013008056,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.NCCCCC(=O)C(=O)O.[H],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,-2.096910013008056,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.NCCCCC(=O)C(=O)O.[H]__MKNNGGARVVVIGAGFVGASYVFALMNQGIADEIVLIDANESKAIGDAMDFNHGKVFAPKPVDIWHGDYDDCRDADLVVICAGANQKPGETRLDLVDKNIAIFRSIVESVMASGFQGLFLVATNPVDILTYATWKFSGLPHERVIGSGTILDTARFRFLLGEYFSVAPQNVHAYIIGEHGDTELPVWSQAYIGVMPIRKLVESKGEEAQKDLERIFVNVRDAAYQIIEKKGATYYGIAMGLARVTRAILHNENAILTVSAYLDGLYGERDVYIGVPAVINRNGIREVIEIELNDDEKNRFHHSAATLKSVLARAFTR,./data/raw/alphafold//AF-P00344-F1-model_v4.pdb,1256,5193,1577,704
+795,23178,23521,MKYFPLFPTLVFAARVVAFPAYASLAGLSQQELDAIIPTLEAREPGLPPGPLENSSAKLVNDEAHPWKPLRPGDIRGPCPGLNTLASHGYLPRNGVATPVQIINAVQEGLNFDNQAAVFATYAAHLVDGNLITDLLSIGRKTRLTGPDPPPPASVGGLNEHGTFEGDASMTRGDAFFGNNHDFNETLFEQLVDYSNRFGGGKYNLTVAGELRFKRIQDSIATNPNFSFVDFRFFTAYGETTFPANLFVDGRRDDGQLDMDAARSFFQFSRMPDDFFRAPSPRSGTGVEVVIQAHPMQPGRNVGKINSYTVDPTSSDFSTPCLMYEKFVNITVKSLYPNPTVQLRKALNTNLDFFFQGVAAGCTQVFPYGRD,sabio,B9W4V6,OO.c1ccc2ccccc2c1>>O.Oc1cccc2ccccc12,166.0,8.735035598939078e-15,20.0,7.0,1.11.-.-,5400.0,2.220108088040055,OO.c1ccc2ccccc2c1,O.Oc1cccc2ccccc12,2.220108088040055,OO.c1ccc2ccccc2c1__MKYFPLFPTLVFAARVVAFPAYASLAGLSQQELDAIIPTLEAREPGLPPGPLENSSAKLVNDEAHPWKPLRPGDIRGPCPGLNTLASHGYLPRNGVATPVQIINAVQEGLNFDNQAAVFATYAAHLVDGNLITDLLSIGRKTRLTGPDPPPPASVGGLNEHGTFEGDASMTRGDAFFGNNHDFNETLFEQLVDYSNRFGGGKYNLTVAGELRFKRIQDSIATNPNFSFVDFRFFTAYGETTFPANLFVDGRRDDGQLDMDAARSFFQFSRMPDDFFRAPSPRSGTGVEVVIQAHPMQPGRNVGKINSYTVDPTSSDFSTPCLMYEKFVNITVKSLYPNPTVQLRKALNTNLDFFFQGVAAGCTQVFPYGRD,./data/raw/alphafold//AF-B9W4V6-F1-model_v4.pdb,1077,646,323,362
+796,13693,13873,MAIGSVVFAAAGLLLLLLPPSHQQATAGNIGSQWRDDEVHFNRTLDSILVPRVVGSRGHQQVREYLVQSLNGLGFQTEVDEFKQRVPVFGELTFANVVGTINPQAQNFLALACHYDSKYFPNDPGFVGATDSAVPCAILLNTAKTLGAYLQKEFRNRSDVGLMLIFFDGEEAFKEWTDADSVYGSKHLAAKLASKRSGSQAQLAPRNIDRIEVLVLLDLIGARNPKFSSFYENTDGLHSSLVQIEKSLRTAGQLEGNNNMFLSRVSGGLVDDDHRPFLDENVPVLHLVATPFPDVWHTPRDNAANLHWPSIRNFNRVFRNFVYQYLKRHTSPVNLRFYRT,brenda,Q9VRQ9,N=C(O)CC[C@H](N)C(O)=N[C@@H](CCC(=O)O)C(=O)O>>N.O=C(O)CC[C@H](N=C(O)[C@H]1CCC(O)=N1)C(=O)O,38.0,1.0306645765863924e-14,30.0,8.0,2.3.2.5,7227.0,1.57978359661681,N=C(O)CC[C@H](N)C(O)=N[C@@H](CCC(=O)O)C(=O)O,N.O=C(O)CC[C@H](N=C(O)[C@H]1CCC(O)=N1)C(=O)O,1.57978359661681,N=C(O)CC[C@H](N)C(O)=N[C@@H](CCC(=O)O)C(=O)O__MAIGSVVFAAAGLLLLLLPPSHQQATAGNIGSQWRDDEVHFNRTLDSILVPRVVGSRGHQQVREYLVQSLNGLGFQTEVDEFKQRVPVFGELTFANVVGTINPQAQNFLALACHYDSKYFPNDPGFVGATDSAVPCAILLNTAKTLGAYLQKEFRNRSDVGLMLIFFDGEEAFKEWTDADSVYGSKHLAAKLASKRSGSQAQLAPRNIDRIEVLVLLDLIGARNPKFSSFYENTDGLHSSLVQIEKSLRTAGQLEGNNNMFLSRVSGGLVDDDHRPFLDENVPVLHLVATPFPDVWHTPRDNAANLHWPSIRNFNRVFRNFVYQYLKRHTSPVNLRFYRT,./data/raw/alphafold//AF-Q9VRQ9-F1-model_v4.pdb,2883,1589,3182,1954
+797,1851,1882,MDIEAYLERIGYKKSRNKLDLETLTDILQHQIRAVPFENLNIHCGDAMDLGLEAIFDQVVRRNRGGWCLQVNHLLYWALTTIGFETTMLGGYVYSTPAKKYSTGMIHLLLQVTIDGRNYIVDAGFGRSYQMWQPLELISGKDQPQVPCVFRLTEENGFWYLDQIRREQYIPNEEFLHSDLLEDSKYRKIYSFTLKPRTIEDFESMNTYLQTSPSSVFTSKSFCSLQTPDGVHCLVGFTLTHRRFNYKDNTDLIEFKTLSEEEIEKVLKNIFNISLQRKLVPKHGDRFFTI,brenda,P18440,CC(=O)Oc1ccc([N+](=O)[O-])cc1.Cc1cc(C(=O)O)ccc1N>>CC(O)=Nc1ccc(C(=O)O)cc1C.O=[N+]([O-])c1ccc(O)cc1,1.3,0.0,23.0,7.0,2.3.1.5,9606.0,0.1139433523068367,CC(=O)Oc1ccc([N+](=O)[O-])cc1.Cc1cc(C(=O)O)ccc1N,CC(O)=Nc1ccc(C(=O)O)cc1C.O=[N+]([O-])c1ccc(O)cc1,0.1139433523068367,CC(=O)Oc1ccc([N+](=O)[O-])cc1.Cc1cc(C(=O)O)ccc1N__MDIEAYLERIGYKKSRNKLDLETLTDILQHQIRAVPFENLNIHCGDAMDLGLEAIFDQVVRRNRGGWCLQVNHLLYWALTTIGFETTMLGGYVYSTPAKKYSTGMIHLLLQVTIDGRNYIVDAGFGRSYQMWQPLELISGKDQPQVPCVFRLTEENGFWYLDQIRREQYIPNEEFLHSDLLEDSKYRKIYSFTLKPRTIEDFESMNTYLQTSPSSVFTSKSFCSLQTPDGVHCLVGFTLTHRRFNYKDNTDLIEFKTLSEEEIEKVLKNIFNISLQRKLVPKHGDRFFTI,./data/raw/alphafold//AF-P18440-F1-model_v4.pdb,1479,1020,845,1170
+798,3120,3162,MNVIIKAVVTASTLLMVSFSSFETSAQSPLLKEQIESIVIGKKATVGVAVWGPDDLEPLLINPFEKFPMQSVFKLHLAMLVLHQVDQGKLDLNQTVIVNRAKVLQNTWAPIMKAYQGDEFSVPVQQLLQYSVSHSDNVACDLLFELVGGPAALHDYIQSMGIKETAVVANEAQMHADDQVQYQNWTSMKGAAEILKKFEQKTQLSETSQALLWKWMVETTTGPERLKGLLPAGTVVAHKTGTSGIKAGKTAATNDLGIILLPDGRPLLVAVFVKDSAESSRTNEAIIAQVAQTAYQFELKKLSALSPN,sabio,P37321,CC(C)(ON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[n+]3ccccc3)CSC12)c1csc(N)n1)C(=O)O.O>>,70.0,99.82319723056142,30.0,7.0,3.5.2.6,287.0,1.845098040014257,CC(C)(ON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[n+]3ccccc3)CSC12)c1csc(N)n1)C(=O)O.O,,1.845098040014257,CC(C)(ON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[n+]3ccccc3)CSC12)c1csc(N)n1)C(=O)O.O__MNVIIKAVVTASTLLMVSFSSFETSAQSPLLKEQIESIVIGKKATVGVAVWGPDDLEPLLINPFEKFPMQSVFKLHLAMLVLHQVDQGKLDLNQTVIVNRAKVLQNTWAPIMKAYQGDEFSVPVQQLLQYSVSHSDNVACDLLFELVGGPAALHDYIQSMGIKETAVVANEAQMHADDQVQYQNWTSMKGAAEILKKFEQKTQLSETSQALLWKWMVETTTGPERLKGLLPAGTVVAHKTGTSGIKAGKTAATNDLGIILLPDGRPLLVAVFVKDSAESSRTNEAIIAQVAQTAYQFELKKLSALSPN,./data/raw/alphafold//AF-P37321-F1-model_v4.pdb,1447,974,781,1087
+799,12263,12432,MGDESLRSAARPEGEGGLQYHLRVRRGDVARYVLLPGDPERTDLIARLWDEARLVAHHREYRTWTGFYKGTSISVTSTGIGSPSTAIAVEELLRVGAETFIRVGTMGGIREDLRPGTLVIGSAAVRMEGTSGQYAPRGFPAAASYDVVAALVEAAEALGVRYEVGVVASTDSFYLGQGRPGYGGYMTPEASEVIPLLRSAGVLGFEMEASALFTLSQLYGARAGCVCAVVANRVSGEFVVNAGVEDAARVASEAVAILAGWDREREKRGKKWFYPSLACRRT,brenda,Q9YA34,Cc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)nc1O.O=P(O)(O)O>>Cc1cnc(O)nc1O.O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H]1O,56.0,7.967422834012856e-15,90.0,7.0,2.4.2.3,56636.0,1.7481880270062005,Cc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)nc1O.O=P(O)(O)O,Cc1cnc(O)nc1O.O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H]1O,1.7481880270062005,Cc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)nc1O.O=P(O)(O)O__MGDESLRSAARPEGEGGLQYHLRVRRGDVARYVLLPGDPERTDLIARLWDEARLVAHHREYRTWTGFYKGTSISVTSTGIGSPSTAIAVEELLRVGAETFIRVGTMGGIREDLRPGTLVIGSAAVRMEGTSGQYAPRGFPAAASYDVVAALVEAAEALGVRYEVGVVASTDSFYLGQGRPGYGGYMTPEASEVIPLLRSAGVLGFEMEASALFTLSQLYGARAGCVCAVVANRVSGEFVVNAGVEDAARVASEAVAILAGWDREREKRGKKWFYPSLACRRT,./data/raw/alphafold//AF-Q9YA34-F1-model_v4.pdb,761,4207,4078,3926
+800,22834,23176,MVGNILVTGGAGYIGSHTVLQLLLGGYNTVVIDNLDNSSLVSIQRVKDLAGDHGQNLTVHQVDLRDKPALEKVFSETKFDAVMHFAGLKAVGESVAKPLLYYNNNLIATITLLEVMAAHGCKKLVFSSSATVYGWPKEVPCTEESPLSGMSPYGRTKLFIEDICRDVQRGDPEWRIIMLRYFNPVGAHPSGRIGEDPCGTPNNLMPYVQQVVVGRLPNLKIYGTDYTTKDGTGVRDYIHVVDLADGHICALQKLDDTEIGCEVYNLGTGKGTTVLEMVDAFEKASGMKIPLVKVGRRPGDAETVYASTEKAERELNWKANFGIEEMCRDQWNWASNNPFGYGSSPNST,brenda,Q9C7W7,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>>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,20.0,0.0,35.0,8.25,5.1.3.2,3702.0,1.3010299956639813,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,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,1.3010299956639813,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__MVGNILVTGGAGYIGSHTVLQLLLGGYNTVVIDNLDNSSLVSIQRVKDLAGDHGQNLTVHQVDLRDKPALEKVFSETKFDAVMHFAGLKAVGESVAKPLLYYNNNLIATITLLEVMAAHGCKKLVFSSSATVYGWPKEVPCTEESPLSGMSPYGRTKLFIEDICRDVQRGDPEWRIIMLRYFNPVGAHPSGRIGEDPCGTPNNLMPYVQQVVVGRLPNLKIYGTDYTTKDGTGVRDYIHVVDLADGHICALQKLDDTEIGCEVYNLGTGKGTTVLEMVDAFEKASGMKIPLVKVGRRPGDAETVYASTEKAERELNWKANFGIEEMCRDQWNWASNNPFGYGSSPNST,./data/raw/alphafold//AF-Q9C7W7-F1-model_v4.pdb,2955,278,6032,6964
+801,1608,1637,MKVLVINAGSSSLKYQLIDMTNESALAVGLCERIGIDNSIITQKKFDGKKLEKLTDLPTHKDALEEVVKALTDDEFGVIKDMGEINAVGHRVVHGGEKFTTSALYDEGVEKAIKDCFELAPLHNPPNMMGISACAEIMPGTPMVIVFDTAFHQTMPPYAYMYALPYDLYEKHGVRKYGFHGTSHKYVAERAALMLGKPAEETKIITCHLGNGSSITAVEGGKSVETSMGFTPLEGLAMGTRCGSIDPAIVPFLMEKEGLTTREIDTLMNKKSGVLGVSGLSNDFRDLDEAASKGNRKAELALEIFAYKVKKFIGEYSAVLNGADAVVFTAGIGENSASIRKRILTGLDGIGIKIDDEKNKIRGQEIDISTPDAKVRVFVIPTNEELAIARETKEIVETEVKLRSSIPV,brenda,P38502,CC(=O)O.Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O>>CC(=O)OP(=O)(O)O.Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O,540.0,1.0473802119105252e-14,37.0,7.0,2.7.2.1,2210.0,2.7323937598229686,CC(=O)O.Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O,CC(=O)OP(=O)(O)O.Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O,2.7323937598229686,CC(=O)O.Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O__MKVLVINAGSSSLKYQLIDMTNESALAVGLCERIGIDNSIITQKKFDGKKLEKLTDLPTHKDALEEVVKALTDDEFGVIKDMGEINAVGHRVVHGGEKFTTSALYDEGVEKAIKDCFELAPLHNPPNMMGISACAEIMPGTPMVIVFDTAFHQTMPPYAYMYALPYDLYEKHGVRKYGFHGTSHKYVAERAALMLGKPAEETKIITCHLGNGSSITAVEGGKSVETSMGFTPLEGLAMGTRCGSIDPAIVPFLMEKEGLTTREIDTLMNKKSGVLGVSGLSNDFRDLDEAASKGNRKAELALEIFAYKVKKFIGEYSAVLNGADAVVFTAGIGENSASIRKRILTGLDGIGIKIDDEKNKIRGQEIDISTPDAKVRVFVIPTNEELAIARETKEIVETEVKLRSSIPV,./data/raw/alphafold//AF-P38502-F1-model_v4.pdb,1420,934,733,1028
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+804,8298,8427,MVLIRVLANLLILQLSYAQKSSELVIGGDECNINEHRFLVALYDYWSQSFLCGGTLINEEWVLTAKHCDRTHILIYVGVHDRSVQFDKEQRRFPKEKYFFDCSNNFTKWDKDIMLIRLNKPVSYSEHIAPLSLPSSPPIVGSVCRAMGWGQTTSPQETLPDVPHCANINLLDYEVCRTAHPQFRLPATSRTLCAGVLEGGIDTCNRDSGGPLICNGQFQGIVFWGPDPCAQPDKPGLYTKVFDHLDWIQSIIAGEKTVNCPP,uniprot_search,F8S114,CC[C@H](N=C(O)[C@H](N)C1CCCCC1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>CC[C@H](N=C(O)[C@H](N)C1CCCCC1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,0.68,1.0582725886055994e-14,27.0,7.5,3.4.21.74,8729.0,-0.1674910872937636,CC[C@H](N=C(O)[C@H](N)C1CCCCC1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,CC[C@H](N=C(O)[C@H](N)C1CCCCC1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,-0.1674910872937636,CC[C@H](N=C(O)[C@H](N)C1CCCCC1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MVLIRVLANLLILQLSYAQKSSELVIGGDECNINEHRFLVALYDYWSQSFLCGGTLINEEWVLTAKHCDRTHILIYVGVHDRSVQFDKEQRRFPKEKYFFDCSNNFTKWDKDIMLIRLNKPVSYSEHIAPLSLPSSPPIVGSVCRAMGWGQTTSPQETLPDVPHCANINLLDYEVCRTAHPQFRLPATSRTLCAGVLEGGIDTCNRDSGGPLICNGQFQGIVFWGPDPCAQPDKPGLYTKVFDHLDWIQSIIAGEKTVNCPP,./data/raw/alphafold//AF-F8S114-F1-model_v4.pdb,3507,1521,1169,1383
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+806,21448,21772,MSLIATVGPTGGVKNRLNIVDFVKNEKFFTLYVRSLELLQAKEQHDYSSFFQLAGIHGLPFTEWAKERPSMNLYKAGYCTHGQVLFPTWHRTYLSVLEQILQGAAIEVAKKFTSNQTDWVQAAQDLRQPYWDWGFELMPPDEVIKNEEVNITNYDGKKISVKNPILRYHFHPIDPSFKPYGDFATWRTTVRNPDRNRREDIPGLIKKMRLEEGQIREKTYNMLKFNDAWERFSNHGISDDQHANSLESVHDDIHVMVGYGKIEGHMDHPFFAAFDPIFWLHHTNVDRLLSLWKAINPDVWVTSGRNRDGTMGIAPNAQINSETPLEPFYQSGDKVWTSASLADTARLGYSYPDFDKLVGGTKELIRDAIDDLIDERYGSKPSSGARNTAFDLLADFKGITKEHKEDLKMYDWTIHVAFKKFELKESFSLLFYFASDGGDYDQENCFVGSINAFRGTAPETCANCQDNENLIQEGFIHLNHYLARDLESFEPQDVHKFLKEKGLSYKLYSRGDKPLTSLSVKIEGRPLHLPPGEHRPKYDHTQARVVFDDVAVHVIN,sabio,O42713,O=C(O)Cc1ccc(O)cc1.O=O>>O.O=C(O)Cc1ccc(O)c(O)c1,44.3,0.5429425547386335,25.0,6.8,1.14.18.1,5341.0,1.6464037262230695,O=C(O)Cc1ccc(O)cc1.O=O,O.O=C(O)Cc1ccc(O)c(O)c1,1.6464037262230695,O=C(O)Cc1ccc(O)cc1.O=O__MSLIATVGPTGGVKNRLNIVDFVKNEKFFTLYVRSLELLQAKEQHDYSSFFQLAGIHGLPFTEWAKERPSMNLYKAGYCTHGQVLFPTWHRTYLSVLEQILQGAAIEVAKKFTSNQTDWVQAAQDLRQPYWDWGFELMPPDEVIKNEEVNITNYDGKKISVKNPILRYHFHPIDPSFKPYGDFATWRTTVRNPDRNRREDIPGLIKKMRLEEGQIREKTYNMLKFNDAWERFSNHGISDDQHANSLESVHDDIHVMVGYGKIEGHMDHPFFAAFDPIFWLHHTNVDRLLSLWKAINPDVWVTSGRNRDGTMGIAPNAQINSETPLEPFYQSGDKVWTSASLADTARLGYSYPDFDKLVGGTKELIRDAIDDLIDERYGSKPSSGARNTAFDLLADFKGITKEHKEDLKMYDWTIHVAFKKFELKESFSLLFYFASDGGDYDQENCFVGSINAFRGTAPETCANCQDNENLIQEGFIHLNHYLARDLESFEPQDVHKFLKEKGLSYKLYSRGDKPLTSLSVKIEGRPLHLPPGEHRPKYDHTQARVVFDDVAVHVIN,./data/raw/alphafold//AF-O42713-F1-model_v4.pdb,1606,1194,1670,1398
+807,19209,19495,MKKSLSATLISALLAFSAPGFSAADNVAAVVDSTIKPLMAQQDIPGMAVAVSVKGKPYYFNYGFADVQAKQPVTENTLFELGSVSKTFTGVLGAVSVAKKEMTLNDPAEKYQPELALPQWKGITLLDLATYTAGGLPLQVPDAVKSRADLLHFYQQWQPSRKPGDMRLYANSSIGLFGALTANAAGMPYDQLLTARILAPLGLSHTFITVPESAQSQYAYGYKNKKPVRVSPGQLDAESYGVKSASKDMLRWAEMNMEPSRAGNADLEMAMYLAQTRYYKTAAINQGLGWEMYDWPQQKDMIINGVTNEVALQPHPVTDNQVQPYNRASWVHKTGATTGFGAYVAFIPEKQVAIVILANKNYPNTERVKAAQAILSALE,brenda,Q704Z0,O.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>>,93.0,99.8132684005318,30.0,7.0,3.5.2.6,180434.0,1.9684829485539352,O.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,,1.9684829485539352,O.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__MKKSLSATLISALLAFSAPGFSAADNVAAVVDSTIKPLMAQQDIPGMAVAVSVKGKPYYFNYGFADVQAKQPVTENTLFELGSVSKTFTGVLGAVSVAKKEMTLNDPAEKYQPELALPQWKGITLLDLATYTAGGLPLQVPDAVKSRADLLHFYQQWQPSRKPGDMRLYANSSIGLFGALTANAAGMPYDQLLTARILAPLGLSHTFITVPESAQSQYAYGYKNKKPVRVSPGQLDAESYGVKSASKDMLRWAEMNMEPSRAGNADLEMAMYLAQTRYYKTAAINQGLGWEMYDWPQQKDMIINGVTNEVALQPHPVTDNQVQPYNRASWVHKTGATTGFGAYVAFIPEKQVAIVILANKNYPNTERVKAAQAILSALE,./data/raw/alphafold//AF-Q704Z0-F1-model_v4.pdb,1456,986,797,1111
+808,14064,14246,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.O.O=CCCCC=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.O=C(O)CCCC(=O)O,12.3,0.9481187833266246,25.0,7.2,1.2.1.24,192.0,1.089905111439398,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.O.O=CCCCC=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.O=C(O)CCCC(=O)O,1.089905111439398,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.O.O=CCCCC=O__MANVTYTDTQLLIDGEWVDAASGKTIDVVNPATGKPIGRVAHAGIADLDRALAAAQSGFEAWRKVPAHERAATMRKAAALVRERADAIAQLMTQEQGKPLTEARVEVLSAADIIEWFADEGRRVYGRIVPPRNLGAQQTVVKEPVGPVAAFTPWNFPVNQVVRKLSAALATGCSFLVKAPEETPASPAALLRAFVDAGVPAGVIGLVYGDPAEISSYLIPHPVIRKVTFTGSTPVGKQLASLAGLHMKRATMELGGHAPVIVAEDADVALAVKAAGGAKFRNAGQVCISPTRFLVHNSIRDEFTRALVKHAEGLKVGNGLEEGTTLGALANPRRLTAMASVIDNARKVGASIETGGERIGSEGNFFAPTVIANVPLDADVFNNEPFGPVAAIRGFDKLEEAIAEANRLPFGLAGYAFTRSFANVHLLTQRLEVGMLWINQPATPWPEMPFGGVKDSGYGSEGGPEALEPYLVTKSVTVMAV,./data/raw/alphafold//AF-Q1JUP4-F1-model_v4.pdb,2332,4678,4713,4545
+809,3916,3969,MTEAMKITLSTQPADARWGDKATYSINNDGITLHLNGKDDLGLIQRAARKIDGLGIKQVALTGEGWDTERCWAFWAGYKGPKGVRTVMWPDLDDAQRQELDNRLTIIDWVRDTINAPAEELGPEQLAQRAVDLLCSVACDSVTYRITKGEDLREQNYMGLHTVGRGSERPPVLLALDYNPTGDKDAPVYACLVGKGITFDSGGYSIKQSAFMDSMKSDMGGAATVTGALAFAITRGLNKRVKLFLCCADNLISGNAFKLGDIIRYRNGKNVEVMNTDAEGRLVLADGLIDASAQHPQLIIDMATLTGAAKTALGNDYHALFSFDDTLAGRLLTSAAQENEPFWRLPLAEFHRNQLPSNFAELNNTGSAAYPAGASTAAGFLSHFVENYREGWLHIDCSATYRKAPVEQWAAGATGLGVRTIANLLTA,brenda,Q9RF52,CC(C)C[C@H](N=C(O)[C@@H](N)CC(=O)O)C(=O)O.O>>CC(C)C[C@H](N)C(=O)O.N[C@@H](CC(=O)O)C(=O)O,666.0,1.07341657654352e-14,37.0,8.5,3.4.11.1,28901.0,2.823474229170301,CC(C)C[C@H](N=C(O)[C@@H](N)CC(=O)O)C(=O)O.O,CC(C)C[C@H](N)C(=O)O.N[C@@H](CC(=O)O)C(=O)O,2.823474229170301,CC(C)C[C@H](N=C(O)[C@@H](N)CC(=O)O)C(=O)O.O__MTEAMKITLSTQPADARWGDKATYSINNDGITLHLNGKDDLGLIQRAARKIDGLGIKQVALTGEGWDTERCWAFWAGYKGPKGVRTVMWPDLDDAQRQELDNRLTIIDWVRDTINAPAEELGPEQLAQRAVDLLCSVACDSVTYRITKGEDLREQNYMGLHTVGRGSERPPVLLALDYNPTGDKDAPVYACLVGKGITFDSGGYSIKQSAFMDSMKSDMGGAATVTGALAFAITRGLNKRVKLFLCCADNLISGNAFKLGDIIRYRNGKNVEVMNTDAEGRLVLADGLIDASAQHPQLIIDMATLTGAAKTALGNDYHALFSFDDTLAGRLLTSAAQENEPFWRLPLAEFHRNQLPSNFAELNNTGSAAYPAGASTAAGFLSHFVENYREGWLHIDCSATYRKAPVEQWAAGATGLGVRTIANLLTA,./data/raw/alphafold//AF-Q9RF52-F1-model_v4.pdb,1856,1550,3133,1900
+810,7969,8097,MALSQSVPFSATELLLASAIFCLVFWVLKGLRPRVPKGLKSPPEPWGWPLLGHVLTLGKNPHLALSRMSQRYGDVLQIRIGSTPVLVLSRLDTIRQALVRQGDDFKGRPDLYTSTLITDGQSLTFSTDSGPVWAARRRLAQNALNTFSIASDPASSSSCYLEEHVSKEAKALISRLQELMAGPGHFDPYNQVVVSVANVIGAMCFGQHFPESSDEMLSLVKNTHEFVETASSGNPLDFFPILRYLPNPALQRFKAFNQRFLWFLQKTVQEHYQDFDKNSVRDITGALFKHSKKGPRASGNLIPQEKIVNLVNDIFGAGFDTVTTAISWSLMYLVTKPEIQRKIQKELDTVIGRERRPRLSDRPQLPYLEAFILETFRHSSFLPFTIPHSTTRDTTLNGFYIPKKCCVFVNQWQVNHDPELWEDPSEFRPERFLTADGTAINKPLSEKMMLFGMGKRRCIGEVLAKWEIFLFLAILLQQLEFSVPPGVKVDLTPIYGLTMKHARCEHVQARLRFSIN,sabio,P05177,CCOc1ccc(NC(C)=O)cc1.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.[H]>>CC(=O)Nc1ccc(O)cc1.CCO.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,90.0,0.105092174594787,37.0,7.4,1.14.14.1,9606.0,1.954242509439325,CCOc1ccc(NC(C)=O)cc1.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.[H],CC(=O)Nc1ccc(O)cc1.CCO.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,2.764026607692037,CCOc1ccc(NC(C)=O)cc1.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.[H]__MALSQSVPFSATELLLASAIFCLVFWVLKGLRPRVPKGLKSPPEPWGWPLLGHVLTLGKNPHLALSRMSQRYGDVLQIRIGSTPVLVLSRLDTIRQALVRQGDDFKGRPDLYTSTLITDGQSLTFSTDSGPVWAARRRLAQNALNTFSIASDPASSSSCYLEEHVSKEAKALISRLQELMAGPGHFDPYNQVVVSVANVIGAMCFGQHFPESSDEMLSLVKNTHEFVETASSGNPLDFFPILRYLPNPALQRFKAFNQRFLWFLQKTVQEHYQDFDKNSVRDITGALFKHSKKGPRASGNLIPQEKIVNLVNDIFGAGFDTVTTAISWSLMYLVTKPEIQRKIQKELDTVIGRERRPRLSDRPQLPYLEAFILETFRHSSFLPFTIPHSTTRDTTLNGFYIPKKCCVFVNQWQVNHDPELWEDPSEFRPERFLTADGTAINKPLSEKMMLFGMGKRRCIGEVLAKWEIFLFLAILLQQLEFSVPPGVKVDLTPIYGLTMKHARCEHVQARLRFSIN,./data/raw/alphafold//AF-P05177-F1-model_v4.pdb,3282,2116,3784,2644
+811,21857,22183,MKTVTVKNLIIGEGMPKIIVSLMGRDINSVKAEALAYREATFDILEWRVDHFMDIASTQSVLTAARVIRDAMPDIPLLFTFRSAKEGGEQTITTQHYLTLNRAAIDSGLVDMIDLELFTGDADVKATVDYAHAHNVYVVMSNHDFHQTPSAEEMVLRLRKMQALGADIPKIAVMPQSKHDVLTLLTATLEMQQHYADRPVITMSMAKEGVISRLAGEVFGSAATFGAVKQASAPGQIAVNDLRSVLMILHNA,brenda,P24670,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)C1,1.1,7.453857947349876e-15,25.0,7.2,4.2.1.10,90370.0,0.041392685158225,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)C1,0.041392685158225,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O__MKTVTVKNLIIGEGMPKIIVSLMGRDINSVKAEALAYREATFDILEWRVDHFMDIASTQSVLTAARVIRDAMPDIPLLFTFRSAKEGGEQTITTQHYLTLNRAAIDSGLVDMIDLELFTGDADVKATVDYAHAHNVYVVMSNHDFHQTPSAEEMVLRLRKMQALGADIPKIAVMPQSKHDVLTLLTATLEMQQHYADRPVITMSMAKEGVISRLAGEVFGSAATFGAVKQASAPGQIAVNDLRSVLMILHNA,./data/raw/alphafold//AF-P24670-F1-model_v4.pdb,720,121,5826,6733
+812,6873,6989,MPLDPRIKELLESGFIVPIGKASVDEVRKIFRQLASAAPKVEVGKVEDIKIPGSEANINARVYLPKANGPYGVLIYLHGGGFVIGDVESYDPLCRAITNACNCVVVSVDYRLAPEYKFPSAVIDSFDATNWVYNNLDKFDGKMGVAIAGDSAGGNLAAVVALLSKGKLNLKYQILIYPAVGFDSVSRSMIEYSDGFFLTREHIEWFGSQYLRSPADLLDFRFSPILVQDLSGLPPALIITAEYDPLRDQGEAYANRLLQAGVPVTSVRFNNVIHGFLSFFPLIEQGRDAIGLIGSVLRRAFYDKS,brenda,Q97VW1,CCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,79.3,0.0,70.0,7.2,3.1.1.1,2287.0,1.899273187317604,CCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,1.899273187317604,CCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MPLDPRIKELLESGFIVPIGKASVDEVRKIFRQLASAAPKVEVGKVEDIKIPGSEANINARVYLPKANGPYGVLIYLHGGGFVIGDVESYDPLCRAITNACNCVVVSVDYRLAPEYKFPSAVIDSFDATNWVYNNLDKFDGKMGVAIAGDSAGGNLAAVVALLSKGKLNLKYQILIYPAVGFDSVSRSMIEYSDGFFLTREHIEWFGSQYLRSPADLLDFRFSPILVQDLSGLPPALIITAEYDPLRDQGEAYANRLLQAGVPVTSVRFNNVIHGFLSFFPLIEQGRDAIGLIGSVLRRAFYDKS,./data/raw/alphafold//AF-Q97VW1-F1-model_v4.pdb,1438,1042,3724,2578
+813,12414,12584,MEKAAVNEDGLVIPLIDFSKFLEGDETLKLETAKAILHGFQTAGFIYLKNIPIQPDFREHVFNTSAKFFKLPKEKKLEVGWTTPEANRGYSAPGREKVTQLTDPAEIEKIRSAAPDIKESYEIGREDEPGHPNPWPAEQDDLVGFKSTMNNFFDQCKALHIEVMRAIAVGMGIDANYFDSFVDVGDNILRLLHYPAVKSEVFKINPGQVRAGEHTDYGSITLLFQDSRGGLQVKSPNGQFIDATPIENTVVVNAGDLLARWSNDTIKSTVHRVVEPPKQEDVHPPRYSIAYFCNPNHKSYIEAIPGTYAAESERKYEGINSGKYLVQRLAATY,brenda,Q7RYZ9,Cc1cnc(O)nc1O.O=C(O)CCC(=O)C(=O)O.O=O>>O=C(O)CCC(=O)O.O=C=O.OCc1cnc(O)nc1O,0.416,9.327431379373903e-15,25.0,7.5,1.14.11.6,5141.0,-0.3809066693732573,Cc1cnc(O)nc1O.O=C(O)CCC(=O)C(=O)O.O=O,O=C(O)CCC(=O)O.O=C=O.OCc1cnc(O)nc1O,-0.3809066693732573,Cc1cnc(O)nc1O.O=C(O)CCC(=O)C(=O)O.O=O__MEKAAVNEDGLVIPLIDFSKFLEGDETLKLETAKAILHGFQTAGFIYLKNIPIQPDFREHVFNTSAKFFKLPKEKKLEVGWTTPEANRGYSAPGREKVTQLTDPAEIEKIRSAAPDIKESYEIGREDEPGHPNPWPAEQDDLVGFKSTMNNFFDQCKALHIEVMRAIAVGMGIDANYFDSFVDVGDNILRLLHYPAVKSEVFKINPGQVRAGEHTDYGSITLLFQDSRGGLQVKSPNGQFIDATPIENTVVVNAGDLLARWSNDTIKSTVHRVVEPPKQEDVHPPRYSIAYFCNPNHKSYIEAIPGTYAAESERKYEGINSGKYLVQRLAATY,./data/raw/alphafold//AF-Q7RYZ9-F1-model_v4.pdb,2015,4278,4162,4018
+814,7557,7679,MASSSETSSTNLPLKPIPGSYGLPIIGPLHDRHDYFYNQGRDKYFQTRIEKYNSTVLKLNMPPGGFIAPDPKVIALLDGASFPILFDNAKVEKRDVLDGTFMPSTDFFGGYRTCAFQDTAEPSHSLLKRFIFHILSSKHDTFIPLFQTNLTEHFTDLEKELAGKHQKASFNTSIGGITFNFLFKLITDKNPSETKIGDSGPTLVQTWLAAQLAPLATAGLPKIFNYLEDVLIRTIPIPAWTVKSSYNKLYEGLMEAGTTVLDEAEKMGIKREEACHNLVFTLGFNAFGGLTNQFPILIKWVGLAGADLHKKLADEIRAIVREEGGVNLYALDKMTLTKSTVYEALRIEPAVPYQYAKAREDLVVQSHDASFEIKKGEMIFGYQPFATKDAKIFDKPEDFIAERFIGDGEKLLKHVFWSNGRETDEATPDNKICPAKNLVVLLCRLYLVEFFLNYDTFTFDFKPSVLGPTITIKSLVKASSTV,brenda,Q7X9B3,CCCCC[C@@H](/C=C/C=C\CCCCCCCC(=O)O)OO>>CCCCC[C@@H]1O/C1=C/C=C\CCCCCCCC(=O)O.O,913.3,0.0,23.0,7.0,4.2.1.92,3880.0,2.960613457647909,CCCCC[C@@H](/C=C/C=C\CCCCCCCC(=O)O)OO,CCCCC[C@@H]1O/C1=C/C=C\CCCCCCCC(=O)O.O,2.960613457647909,CCCCC[C@@H](/C=C/C=C\CCCCCCCC(=O)O)OO__MASSSETSSTNLPLKPIPGSYGLPIIGPLHDRHDYFYNQGRDKYFQTRIEKYNSTVLKLNMPPGGFIAPDPKVIALLDGASFPILFDNAKVEKRDVLDGTFMPSTDFFGGYRTCAFQDTAEPSHSLLKRFIFHILSSKHDTFIPLFQTNLTEHFTDLEKELAGKHQKASFNTSIGGITFNFLFKLITDKNPSETKIGDSGPTLVQTWLAAQLAPLATAGLPKIFNYLEDVLIRTIPIPAWTVKSSYNKLYEGLMEAGTTVLDEAEKMGIKREEACHNLVFTLGFNAFGGLTNQFPILIKWVGLAGADLHKKLADEIRAIVREEGGVNLYALDKMTLTKSTVYEALRIEPAVPYQYAKAREDLVVQSHDASFEIKKGEMIFGYQPFATKDAKIFDKPEDFIAERFIGDGEKLLKHVFWSNGRETDEATPDNKICPAKNLVVLLCRLYLVEFFLNYDTFTFDFKPSVLGPTITIKSLVKASSTV,./data/raw/alphafold//AF-Q7X9B3-F1-model_v4.pdb,3119,1888,3523,2342
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+842,19411,19697,MRSALNILAGAATLTVAQAASLSDVCTNSHVKSALPSIDLINGLVIDPSSITTNAVYNASTPGGDYFPAASAYDFCNVTLTYAHPGRNDRVHLKLWMPAPDQFQNRWLSTGGGGFAINHDEQQLPGGVQYGAAAGITDGGFGSFYTQFDQVFLLANGTINYEALYMFGYQAHHELSVIGKALTKNFYGTGDAKLYAYWQGCSEGGREGFSQVQRFQEFDGAVIGAPALRYGQQQANHLYGNLVEHTLKYYPPPCELEKIVNLTITACDRLDGRSDGVVSRTDLCKLHFNINSTIGAPYSCPASTTTTGTTPAQNGTVSALGAAAARKMLDGLRTLDSRRAYIFYQPSATFDDAQTKYNPETKQFELEVSAYAAEWIPRFLQLQNYTLSSLENVTYDTLKDWMELGWQRYEDVLQTTWPDLTPFQSAGGKVLHYHGESDPSIPAGSSVHYHESVRKTMYPNMSFNESNQALNEWNRLFLVPGAAHCASSTDQPNGPFPQATLKTLIEWVENSIVPETLNGTVLDGDHKGEQQQICAWPLRPLWTENGTVMNCVYDQASLDTWDYEFDAYRIPLY,brenda,Q2UII1,O.O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@H]1c1ccc(O)c(O)c1)c1cc(O)c(O)c(O)c1>>O=C(O)c1cc(O)c(O)c(O)c1.Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2,9.5,1.8500063635699548e-14,30.0,6.0,3.1.1.20,5062.0,0.9777236052888478,O.O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@H]1c1ccc(O)c(O)c1)c1cc(O)c(O)c(O)c1,O=C(O)c1cc(O)c(O)c(O)c1.Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2,0.9777236052888478,O.O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@H]1c1ccc(O)c(O)c1)c1cc(O)c(O)c(O)c1__MRSALNILAGAATLTVAQAASLSDVCTNSHVKSALPSIDLINGLVIDPSSITTNAVYNASTPGGDYFPAASAYDFCNVTLTYAHPGRNDRVHLKLWMPAPDQFQNRWLSTGGGGFAINHDEQQLPGGVQYGAAAGITDGGFGSFYTQFDQVFLLANGTINYEALYMFGYQAHHELSVIGKALTKNFYGTGDAKLYAYWQGCSEGGREGFSQVQRFQEFDGAVIGAPALRYGQQQANHLYGNLVEHTLKYYPPPCELEKIVNLTITACDRLDGRSDGVVSRTDLCKLHFNINSTIGAPYSCPASTTTTGTTPAQNGTVSALGAAAARKMLDGLRTLDSRRAYIFYQPSATFDDAQTKYNPETKQFELEVSAYAAEWIPRFLQLQNYTLSSLENVTYDTLKDWMELGWQRYEDVLQTTWPDLTPFQSAGGKVLHYHGESDPSIPAGSSVHYHESVRKTMYPNMSFNESNQALNEWNRLFLVPGAAHCASSTDQPNGPFPQATLKTLIEWVENSIVPETLNGTVLDGDHKGEQQQICAWPLRPLWTENGTVMNCVYDQASLDTWDYEFDAYRIPLY,./data/raw/alphafold//AF-Q2UII1-F1-model_v4.pdb,3364,2233,3923,2798
+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
+847,4532,4587,MDPKYQRVELNDGHFMPVLGFGTYAPPEVPRNRAVEVTKLAIEAGFRHIDSAYLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCTFFQPQMVQPALESSLKKLQLDYVDLYLLHFPMALKPGETPLPKDENGKVIFDTVDLSATWEVMEKCKDAGLAKSIGVSNFNCRQLEMILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAHSALGTQRHKLWVDPNSPVLLEDPVLCALAKKHKQTPALIALRYQLQRGVVVLAKSYNEQRIRENIQVFEFQLTSEDMKVLDGLNRNYRYVVMDFLMDHPDYPFSDEY,sabio,P17516,CC(CCC(=O)O)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CC(O)C12C.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>>C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(=O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C.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],900.0,0.0,25.0,7.4,1.1.1.50,9606.0,2.9542425094393248,CC(CCC(=O)O)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CC(O)C12C.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,C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(=O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C.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],2.9542425094393248,CC(CCC(=O)O)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CC(O)C12C.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__MDPKYQRVELNDGHFMPVLGFGTYAPPEVPRNRAVEVTKLAIEAGFRHIDSAYLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCTFFQPQMVQPALESSLKKLQLDYVDLYLLHFPMALKPGETPLPKDENGKVIFDTVDLSATWEVMEKCKDAGLAKSIGVSNFNCRQLEMILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAHSALGTQRHKLWVDPNSPVLLEDPVLCALAKKHKQTPALIALRYQLQRGVVVLAKSYNEQRIRENIQVFEFQLTSEDMKVLDGLNRNYRYVVMDFLMDHPDYPFSDEY,./data/raw/alphafold//AF-P17516-F1-model_v4.pdb,1329,1150,197,212
+848,15873,16100,MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEATKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEEVIPKDENGKILFDTVDLCATWEAVEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRNVRYLTLDIFAGPPNYPFSDEY,sabio,Q04828,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.OC1CCCc2ccccc21>>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.OC1=N[C@@H]2C(=C[C@H](O)[C@@H](O)[C@H]2O)c2cc3c(cc21)OCO3.[H],840.0,7.5114662866835795,25.0,7.4,1.3.1.20,9606.0,2.9242792860618816,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.OC1CCCc2ccccc21,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.OC1=N[C@@H]2C(=C[C@H](O)[C@@H](O)[C@H]2O)c2cc3c(cc21)OCO3.[H],3.1931245983544616,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.OC1CCCc2ccccc21__MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEATKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEEVIPKDENGKILFDTVDLCATWEAVEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRNVRYLTLDIFAGPPNYPFSDEY,./data/raw/alphafold//AF-Q04828-F1-model_v4.pdb,1329,1150,197,213
+849,7932,8060,MQTRRVVLKSAAAAGTLLGGLAGCASVAGSIGTGDRINTVRGPITISEAGFTLTHEHICGSSAGFLRAWPEFFGSRKALAEKAVRGLRRARAAGVRTIVDVSTFDIGRDVSLLAEVSRAADVHIVAATGLWFDPPLSMRLRSVEELTQFFLREIQYGIEDTGIRAGIIKVATTGKATPFQELVLKAAARASLATGVPVTTHTAASQRDGEQQAAIFESEGLSPSRVCIGHSDDTDDLSYLTALAARGYLIGLDHIPHSAIGLEDNASASALLGIRSWQTRALLIKALIDQGYMKQILVSNDWLFGFSSYVTNIMDVMDRVNPDGMAFIPLRVIPFLREKGVPQETLAGITVTNPARFLSPTLRAS,brenda,P0A434,CCOP(=O)(OCC)Oc1ccc(Cl)cc1.O>>CCOP(=O)([O-])OCC.Oc1ccc(Cl)cc1,0.13,0.1783086154194565,30.0,9.0,3.1.8.1,293.0,-0.8860566476931633,CCOP(=O)(OCC)Oc1ccc(Cl)cc1.O,CCOP(=O)([O-])OCC.Oc1ccc(Cl)cc1,-0.4436974992327127,CCOP(=O)(OCC)Oc1ccc(Cl)cc1.O__MQTRRVVLKSAAAAGTLLGGLAGCASVAGSIGTGDRINTVRGPITISEAGFTLTHEHICGSSAGFLRAWPEFFGSRKALAEKAVRGLRRARAAGVRTIVDVSTFDIGRDVSLLAEVSRAADVHIVAATGLWFDPPLSMRLRSVEELTQFFLREIQYGIEDTGIRAGIIKVATTGKATPFQELVLKAAARASLATGVPVTTHTAASQRDGEQQAAIFESEGLSPSRVCIGHSDDTDDLSYLTALAARGYLIGLDHIPHSAIGLEDNASASALLGIRSWQTRALLIKALIDQGYMKQILVSNDWLFGFSSYVTNIMDVMDRVNPDGMAFIPLRVIPFLREKGVPQETLAGITVTNPARFLSPTLRAS,./data/raw/alphafold//AF-P0A434-F1-model_v4.pdb,1579,1158,3003,1351
+850,7777,7902,MKNTIHINFAIFLIIANIIYSSASASTDISTVASPLFEGTEGCFLLYDVSTNAEIAQFNKAKCATQMAPDSTFKIALSLMAFDAEIIDQKTIFKWDKTPKGMEIWNSNHTPKTWMQFSVVWVSQEITQKIGLNKIKNYLKDFDYGNQDFSGDKERNNGLTEAWLESSLKISPEEQIQFLRKIINHNLPVKNSAIENTIENMYLQDLENSTKLYGKTGAGFTANRTLQNGWFEGFIISKSGHKYVFVSALTGNLGSNLTSSIKAKKNAITILNTLNL,brenda,E7BCS7,CCN1CCN(C(O)=N[C@@H](C(O)=N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c2ccccc2)C(=O)C1=O.O>>,3.3,99.81363415265972,25.0,7.2,3.5.2.6,944673.0,0.5185139398778875,CCN1CCN(C(O)=N[C@@H](C(O)=N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c2ccccc2)C(=O)C1=O.O,,0.5185139398778875,CCN1CCN(C(O)=N[C@@H](C(O)=N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c2ccccc2)C(=O)C1=O.O__MKNTIHINFAIFLIIANIIYSSASASTDISTVASPLFEGTEGCFLLYDVSTNAEIAQFNKAKCATQMAPDSTFKIALSLMAFDAEIIDQKTIFKWDKTPKGMEIWNSNHTPKTWMQFSVVWVSQEITQKIGLNKIKNYLKDFDYGNQDFSGDKERNNGLTEAWLESSLKISPEEQIQFLRKIINHNLPVKNSAIENTIENMYLQDLENSTKLYGKTGAGFTANRTLQNGWFEGFIISKSGHKYVFVSALTGNLGSNLTSSIKAKKNAITILNTLNL,./data/raw/alphafold//AF-E7BCS7-F1-model_v4.pdb,1713,1336,6263,1608
+851,7380,7502,MESQVRGGTRWKRFAVVMVPSVAAAACVGVGLAQGALAASFSVSGQEFKVSADHLHGDGFAQYGGIDSGYTSTDGKTKTVRPVAISSFDTAEITKMCQSVKTEIPLIGKTIYLRLDAGPDDKHKVEAEKLYIDVAQLDADATFKNIDIGVAVKDKTRGPAVKSGENALPGGFAQQAESADLYGVEQTAWATTAGTFKLSGLKMRLGTDSKMECF,brenda,Q82JC7,CCCCCCCCCCCCCCCC(=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.O>>CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.CCCCCCCCCCCCCCCC(=O)O,15.7,0.0,37.0,7.0,3.1.1.13,33903.0,1.1958996524092338,CCCCCCCCCCCCCCCC(=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.O,CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.CCCCCCCCCCCCCCCC(=O)O,1.1958996524092338,CCCCCCCCCCCCCCCC(=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.O__MESQVRGGTRWKRFAVVMVPSVAAAACVGVGLAQGALAASFSVSGQEFKVSADHLHGDGFAQYGGIDSGYTSTDGKTKTVRPVAISSFDTAEITKMCQSVKTEIPLIGKTIYLRLDAGPDDKHKVEAEKLYIDVAQLDADATFKNIDIGVAVKDKTRGPAVKSGENALPGGFAQQAESADLYGVEQTAWATTAGTFKLSGLKMRLGTDSKMECF,./data/raw/alphafold//AF-Q82JC7-F1-model_v4.pdb,3268,2100,3765,2624
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+854,6316,6425,MNDFLLLLLVLFLGVPRSENHVINLEECFQEPEYENWLATASHGLTKTLNPKKIVIVGAGISGLTAAKLFREAGHEVVILEASDRVGGRIKTHREDGWYVDVGPMRVPQTHRIVREYIKKFNISLNPFRQTDENAWYLIKHVRQKMSANNPENFGYQLNPNERGKSASQLFDETLDKVTDDCTLQKEKYDSFSTKEYLIKEGKLSTGAVEMIGDFLNEEAGFHNSFLISVMDHFLFLNNSFDEITGGFDQLPERFFKDMDSIVHLNSTVEKIVHINNKVTVFYEGLSTNMRLVADYVLITATARATRLIKFVPPLSIPKTRALRSLIYASATKIILVCTDKFWEKDGIHGGRSITDLPSRVIYYPNHDFTNGIGVLLASYTWYSDSEFYTTLSDEKCVDVVMDDLVEIHNVSKDYLKSVCGKHVVQKWALDQYSMGAFSTYTPYQITHYSQMLAQNEGRIYFAGEYTAHPHGWIETSMKSAIREAINIHNA,sabio,P81383,CCC(N)C(=O)O.O.O=O>>CCC(=O)C(=O)O.N.OO,56.0,9.249811054325224e-15,25.0,8.5,1.4.3.2,8665.0,1.7481880270062005,CCC(N)C(=O)O.O.O=O,CCC(=O)C(=O)O.N.OO,1.7481880270062005,CCC(N)C(=O)O.O.O=O__MNDFLLLLLVLFLGVPRSENHVINLEECFQEPEYENWLATASHGLTKTLNPKKIVIVGAGISGLTAAKLFREAGHEVVILEASDRVGGRIKTHREDGWYVDVGPMRVPQTHRIVREYIKKFNISLNPFRQTDENAWYLIKHVRQKMSANNPENFGYQLNPNERGKSASQLFDETLDKVTDDCTLQKEKYDSFSTKEYLIKEGKLSTGAVEMIGDFLNEEAGFHNSFLISVMDHFLFLNNSFDEITGGFDQLPERFFKDMDSIVHLNSTVEKIVHINNKVTVFYEGLSTNMRLVADYVLITATARATRLIKFVPPLSIPKTRALRSLIYASATKIILVCTDKFWEKDGIHGGRSITDLPSRVIYYPNHDFTNGIGVLLASYTWYSDSEFYTTLSDEKCVDVVMDDLVEIHNVSKDYLKSVCGKHVVQKWALDQYSMGAFSTYTPYQITHYSQMLAQNEGRIYFAGEYTAHPHGWIETSMKSAIREAINIHNA,./data/raw/alphafold//AF-P81383-F1-model_v4.pdb,1381,886,683,972
+855,21925,22254,MTHPLFLEPVFKERLWGGTKLRDAFGYAIPSQKTGECWAVSAHANGPSAVKNGPLAGKTLDQVWQDHPEIFGFPDRKVFPLLVKLLDANMDLSVQVHPDDDYAKLHENGDLGKTECWYIIDCKDDAELILGHHASTKEEFKQRIESGDWNGLLRRIKIKPGDFFYVPSGTLHALCEGTLVLEIQQNSDTTYRVYDYDRCNDQGQKRTLHIEKAMEVITIPHIDKVHTPEVKEVGNAEITVYVQSDYFSVYKWKISGRAAFPSYQTYLLGSVLSGSGRIINNGSQYECNAGSHFVLPAHFGEFSIEGTCEFMISHP,brenda,Q9AGZ4,O=C[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)CO>>OCC1(O)OC[C@@H](O)[C@H](O)[C@@H]1O,63970.0,7.866251170845146e-15,40.0,7.5,5.3.1.8,1423.0,4.805976350717563,O=C[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)CO,OCC1(O)OC[C@@H](O)[C@H](O)[C@@H]1O,4.805976350717563,O=C[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)CO__MTHPLFLEPVFKERLWGGTKLRDAFGYAIPSQKTGECWAVSAHANGPSAVKNGPLAGKTLDQVWQDHPEIFGFPDRKVFPLLVKLLDANMDLSVQVHPDDDYAKLHENGDLGKTECWYIIDCKDDAELILGHHASTKEEFKQRIESGDWNGLLRRIKIKPGDFFYVPSGTLHALCEGTLVLEIQQNSDTTYRVYDYDRCNDQGQKRTLHIEKAMEVITIPHIDKVHTPEVKEVGNAEITVYVQSDYFSVYKWKISGRAAFPSYQTYLLGSVLSGSGRIINNGSQYECNAGSHFVLPAHFGEFSIEGTCEFMISHP,./data/raw/alphafold//AF-Q9AGZ4-F1-model_v4.pdb,730,140,5873,6784
+856,20979,21300,MADFKFEPMRSLIYVDCVSEDYRPKLQRWIYKVHIPDSISQFEPYVTKYAFYPSFPIPPQGDRFGYARMQLTEHHWLVSDLDPRLEIKAIAETFPMDVLVWQGQIPAAAHTDAQIDSDGDAGNAARKSNNAEGNPFIFAFLPMWWEKDLKGKGRTIEDGANYRFNMTIGFPEGVDKAEGEKWLFEKVVPILQAAPECTRVLASAVKKDINGCVMDWVLEIWFENQSGWYKVMVDDMKALEKPSWAQQDAFPFLKPYHNVCSAAVADYTPSNNLANYRGYITMR,brenda,V9P0A9,O=C(C=Cc1ccc(O)c(O)c1)c1ccc(O)cc1O>>O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2cc(O)cc(O)c21,48.33,2.84927632762316,42.0,6.8,5.5.1.6,39490.0,1.6842167951388805,O=C(C=Cc1ccc(O)c(O)c1)c1ccc(O)cc1O,O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2cc(O)cc(O)c21,1.6842167951388805,O=C(C=Cc1ccc(O)c(O)c1)c1ccc(O)cc1O__MADFKFEPMRSLIYVDCVSEDYRPKLQRWIYKVHIPDSISQFEPYVTKYAFYPSFPIPPQGDRFGYARMQLTEHHWLVSDLDPRLEIKAIAETFPMDVLVWQGQIPAAAHTDAQIDSDGDAGNAARKSNNAEGNPFIFAFLPMWWEKDLKGKGRTIEDGANYRFNMTIGFPEGVDKAEGEKWLFEKVVPILQAAPECTRVLASAVKKDINGCVMDWVLEIWFENQSGWYKVMVDDMKALEKPSWAQQDAFPFLKPYHNVCSAAVADYTPSNNLANYRGYITMR,./data/raw/alphafold//AF-V9P0A9-F1-model_v4.pdb,544,3240,5544,6428
+857,6971,7087,MPEIVDTCSLASPASVCRTKHLHLRCSVDFTRRTLTGTAALTVQSQEDNLRSLVLDTKDLTIEKVVINGQEVKYALGERQSYKGSPMEISLPIALSKNQEIVIEISFETSPKSSALQWLTPEQTSGKEHPYLFSQCQAIHCRAILPCQDTPSVKLTYTAEVSVPKELVALMSAIRDGETPDPEDPSRKIYKFIQKVPIPCYLIALVVGALESRQIGPRTLVWSEKEQVEKSAYEFSETESMLKIAEDLGGPYVWGQYDLLVLPPSFPYGGMENPCLTFVTPTLLAGDKSLSNVIAHEISHSWTGNLVTNKTWDHFWLNEGHTVYLERHICGRLFGEKFRHFNALGGWGELQNSVKTFGETHPFTKLVVDLTDIDPDVAYSSVPYEKGFALLFYLEQLLGGPEIFLGFLKAYVEKFSYKSITTDDWKDFLYSYFKDKVDVLNQVDWNAWLYSPGLPPIKPNYDMTLTNACIALSQRWITAKEDDLNSFNATDLKDLSSHQLNEFLAQTLQRAPLPLGHIKRMQEVYNFNAINNSEIRFRWLRLCIQSKWEDAIPLALKMATEQGRMKFTRPLFKDLAAFDKSHDQAVRTYQEHKASMHPVTAMLVGKDLKVD,sabio,P09960,CCCCCC=CCC=CC=CC=CC1OC1CCCC(=O)O.O>>CCCCCC=CCC(O)C=CC=CC=CC(O)CCCC(=O)O,7500.0,1.6868884910558743e-14,37.0,8.0,3.3.2.6,9606.0,3.8750612633917,CCCCCC=CCC=CC=CC=CC1OC1CCCC(=O)O.O,CCCCCC=CCC(O)C=CC=CC=CC(O)CCCC(=O)O,3.8750612633917,CCCCCC=CCC=CC=CC=CC1OC1CCCC(=O)O.O__MPEIVDTCSLASPASVCRTKHLHLRCSVDFTRRTLTGTAALTVQSQEDNLRSLVLDTKDLTIEKVVINGQEVKYALGERQSYKGSPMEISLPIALSKNQEIVIEISFETSPKSSALQWLTPEQTSGKEHPYLFSQCQAIHCRAILPCQDTPSVKLTYTAEVSVPKELVALMSAIRDGETPDPEDPSRKIYKFIQKVPIPCYLIALVVGALESRQIGPRTLVWSEKEQVEKSAYEFSETESMLKIAEDLGGPYVWGQYDLLVLPPSFPYGGMENPCLTFVTPTLLAGDKSLSNVIAHEISHSWTGNLVTNKTWDHFWLNEGHTVYLERHICGRLFGEKFRHFNALGGWGELQNSVKTFGETHPFTKLVVDLTDIDPDVAYSSVPYEKGFALLFYLEQLLGGPEIFLGFLKAYVEKFSYKSITTDDWKDFLYSYFKDKVDVLNQVDWNAWLYSPGLPPIKPNYDMTLTNACIALSQRWITAKEDDLNSFNATDLKDLSSHQLNEFLAQTLQRAPLPLGHIKRMQEVYNFNAINNSEIRFRWLRLCIQSKWEDAIPLALKMATEQGRMKFTRPLFKDLAAFDKSHDQAVRTYQEHKASMHPVTAMLVGKDLKVD,./data/raw/alphafold//AF-P09960-F1-model_v4.pdb,1814,1492,3759,1816
+858,16360,16588,MHIESIPMRWGHGDNYAYLVVDTPTKQAWLIDSAQPDEVLEYFKKHKTDFNLKAIVNTHHHYDHSDGNPFFHKKYPDLPIIAGKDSPLVTYTPSDKETLELGEDLTITALHTPCHTQDSICYFVQDKKTNEKAVFTGDTLFISGCGRFFEGTGKEMNYSLNQVLAKLPKETKVYPGHEYTKSNVKFSQTVLSNEAIKELAEYCKSHEHTTGKFTIGDELQFNPFMKLTDPQVINSTGLTSPDEIMDKLRTMKNNM,uniprot_search,A0A8H6BX75,NC(CCC(=O)NC(CSC(=O)CCC(=O)O)C(=O)NCC(=O)O)C(=O)O.O>>NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O.O=C(O)CCC(=O)O,68.0,6.673078595404731e-15,25.0,7.2,3.1.2.6,5476.0,1.8325089127062364,NC(CCC(=O)NC(CSC(=O)CCC(=O)O)C(=O)NCC(=O)O)C(=O)O.O,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O.O=C(O)CCC(=O)O,1.8325089127062364,NC(CCC(=O)NC(CSC(=O)CCC(=O)O)C(=O)NCC(=O)O)C(=O)O.O__MHIESIPMRWGHGDNYAYLVVDTPTKQAWLIDSAQPDEVLEYFKKHKTDFNLKAIVNTHHHYDHSDGNPFFHKKYPDLPIIAGKDSPLVTYTPSDKETLELGEDLTITALHTPCHTQDSICYFVQDKKTNEKAVFTGDTLFISGCGRFFEGTGKEMNYSLNQVLAKLPKETKVYPGHEYTKSNVKFSQTVLSNEAIKELAEYCKSHEHTTGKFTIGDELQFNPFMKLTDPQVINSTGLTSPDEIMDKLRTMKNNM,./data/raw/esmfold//ESMFold-A0A8H6BX75-v1.pdb,3082,1840,3468,2276
+859,22937,23279,MLRGAGVLLHITSLPGGCFVGDLGPEAYKFADSLAYAEQTYWQTLPINHTVPEYENSPYSAVSSYAGDPVLISLELMKRDGLIDSVPQCPPAERADYIKAWEVKRKALEKALKRAGRLSDYRHFKDVTPWLDDYAYYMAMRERFGPWPVWPKEEPPPASLELYKFAQFVFWTQWERFKEYVNSLGIFLIGDLPFYPSLDSVDVWRNKKYFKVGEDGRPLYVAGVPPDYFSATGQLWGNPVYNWEALERDGFKWWVNRLKHAVTVFDYVRLDHFRGYVAYWEVPGGETTAVRGRWAPSPGRRLFEAAAAAVDLGRLIAEDLGYITPEVEALREELGLPGMRVLQFAWDGNPANPHKPHNHVKNAVVYTGTHDNNTAVGWYKEEATARARREFKKYSNCAGEVHWCFIKLAHMSVANVAIVPVQDLLGLGSEARMNRPGTVGGNWKWRLGAQPEPRVWKRLRDVTRTYGR,sabio,Q8ZXM0,OCC1OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O.OCC1OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O>>OCC1OC(O)C(O)C(O)C1O,8.9,83.29485065731865,80.0,6.7,2.4.1.25,13773.0,0.9493900066449128,OCC1OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O.OCC1OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,OCC1OC(O)C(O)C(O)C1O,0.9493900066449128,OCC1OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O.OCC1OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O__MLRGAGVLLHITSLPGGCFVGDLGPEAYKFADSLAYAEQTYWQTLPINHTVPEYENSPYSAVSSYAGDPVLISLELMKRDGLIDSVPQCPPAERADYIKAWEVKRKALEKALKRAGRLSDYRHFKDVTPWLDDYAYYMAMRERFGPWPVWPKEEPPPASLELYKFAQFVFWTQWERFKEYVNSLGIFLIGDLPFYPSLDSVDVWRNKKYFKVGEDGRPLYVAGVPPDYFSATGQLWGNPVYNWEALERDGFKWWVNRLKHAVTVFDYVRLDHFRGYVAYWEVPGGETTAVRGRWAPSPGRRLFEAAAAAVDLGRLIAEDLGYITPEVEALREELGLPGMRVLQFAWDGNPANPHKPHNHVKNAVVYTGTHDNNTAVGWYKEEATARARREFKKYSNCAGEVHWCFIKLAHMSVANVAIVPVQDLLGLGSEARMNRPGTVGGNWKWRLGAQPEPRVWKRLRDVTRTYGR,./data/raw/alphafold//AF-Q8ZXM0-F1-model_v4.pdb,733,149,5882,6795
+860,5124,5210,MEAPAAVVTGAAKRIGRAIAVKLHQTGYRVVIHYHNSAEAAVSLADELNKERSNTAVVCQADLTNSNVLPASCEEIINSCFRAFGRCDVLVNNASAFYPTPLVQGDHEDNSNGKTVETQVAELIGTNAIAPFLLTMSFAQRQKGTNPNCTSSNLSIVNLCDAMVDQPCMAFSLYNMGKHALVGLTQSAALELAPYGIRVNGVAPGVSLLPVAMGEEEKDKWRRKVPLGRREASAEQIADAVIFLVSGSAQYITGSIIKVDGGLSLVHA,sabio,O76290,CC(O)C(O)C1CNC2=NC(N)=NC(=O)C2=N1.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(O)C1CNc2nc(N)[nH]c(=O)c2N1.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,0.07,5.764070509366357e-15,22.0,6.0,1.5.1.33,5702.0,-1.154901959985743,CC(O)C(O)C1CNC2=NC(N)=NC(=O)C2=N1.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(O)C1CNc2nc(N)[nH]c(=O)c2N1.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,-1.154901959985743,CC(O)C(O)C1CNC2=NC(N)=NC(=O)C2=N1.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]__MEAPAAVVTGAAKRIGRAIAVKLHQTGYRVVIHYHNSAEAAVSLADELNKERSNTAVVCQADLTNSNVLPASCEEIINSCFRAFGRCDVLVNNASAFYPTPLVQGDHEDNSNGKTVETQVAELIGTNAIAPFLLTMSFAQRQKGTNPNCTSSNLSIVNLCDAMVDQPCMAFSLYNMGKHALVGLTQSAALELAPYGIRVNGVAPGVSLLPVAMGEEEKDKWRRKVPLGRREASAEQIADAVIFLVSGSAQYITGSIIKVDGGLSLVHA,./data/raw/alphafold//AF-O76290-F1-model_v4.pdb,3093,1855,3486,2299
+861,3966,4019,MQCAVLLVLLGVVAASPIIPEAARALYYNDGMFEGDIKLRAGRQPARVGAAILGDEYLWSGGVIPYTFAGVSGADQSAILSGMQELEEKTCIRFVPRTTESDYVEIFTSGSGCWSYVGRISGAQQVSLQANGCVYHGTIIHELMHAIGFYHEHTRMDRDNYVTINYQNVDPSMTSNFDIDTYSRYVGEDYQYYSIMHYGKYSFSIQWGVLETIVPLQNGIDLTDPYDKAHMLQTDANQINNLYTNECSLRH,uniprot_search,P07584,CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](C)N=C(O)[C@H](C)NS(=O)(=O)c1cccc2c(N(C)C)cccc12)C(O)=N[C@H](C(=O)O)C(C)C.O>>CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N)C(O)=N[C@H](C(=O)O)C(C)C.C[C@H](N=C(O)[C@H](C)NS(=O)(=O)c1cccc2c(N(C)C)cccc12)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O,200.0,1.7975946714456e-14,25.0,6.0,3.4.24.21,6715.0,2.3010299956639813,CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](C)N=C(O)[C@H](C)NS(=O)(=O)c1cccc2c(N(C)C)cccc12)C(O)=N[C@H](C(=O)O)C(C)C.O,CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N)C(O)=N[C@H](C(=O)O)C(C)C.C[C@H](N=C(O)[C@H](C)NS(=O)(=O)c1cccc2c(N(C)C)cccc12)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O,2.3010299956639813,CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](C)N=C(O)[C@H](C)NS(=O)(=O)c1cccc2c(N(C)C)cccc12)C(O)=N[C@H](C(=O)O)C(C)C.O__MQCAVLLVLLGVVAASPIIPEAARALYYNDGMFEGDIKLRAGRQPARVGAAILGDEYLWSGGVIPYTFAGVSGADQSAILSGMQELEEKTCIRFVPRTTESDYVEIFTSGSGCWSYVGRISGAQQVSLQANGCVYHGTIIHELMHAIGFYHEHTRMDRDNYVTINYQNVDPSMTSNFDIDTYSRYVGEDYQYYSIMHYGKYSFSIQWGVLETIVPLQNGIDLTDPYDKAHMLQTDANQINNLYTNECSLRH,./data/raw/alphafold//AF-P07584-F1-model_v4.pdb,1871,1575,3165,1936
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+863,12392,12562,MRLLVTGGAGFIGTNFVHSAVREHPDDAVTVLDALTYAGRRESLADVEDAIRLVQGDITDAELVSQLVAESDAVVHFAAESHVDNALDNPEPFLHTNVIGTFTILEAVRRHGVRLHHISTDEVYGDLELDDRARFTESTPYNPSSPYSATKAGADMLVRAWVRSYGVRATISNCSNNYGPYQHVEKFIPRQITNVLTGRRPKLYGAGANVRDWIHVDDHNSAVRRILDRGRIGRTYLISSEGERDNLTVLRTLLRLMDRDPDDFDHVTDRVGHDLRYAIDPSTLYDELCWAPKHTDFEEGLRTTIDWYRDNESWWRPLKDATEARYQERGQ,brenda,P9WN65,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O2)c(=O)nc1O>>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.O,466.6,0.0,30.0,7.5,4.2.1.46,1773.0,2.668944734457734,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O2)c(=O)nc1O,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.O,2.668944734457734,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O2)c(=O)nc1O__MRLLVTGGAGFIGTNFVHSAVREHPDDAVTVLDALTYAGRRESLADVEDAIRLVQGDITDAELVSQLVAESDAVVHFAAESHVDNALDNPEPFLHTNVIGTFTILEAVRRHGVRLHHISTDEVYGDLELDDRARFTESTPYNPSSPYSATKAGADMLVRAWVRSYGVRATISNCSNNYGPYQHVEKFIPRQITNVLTGRRPKLYGAGANVRDWIHVDDHNSAVRRILDRGRIGRTYLISSEGERDNLTVLRTLLRLMDRDPDDFDHVTDRVGHDLRYAIDPSTLYDELCWAPKHTDFEEGLRTTIDWYRDNESWWRPLKDATEARYQERGQ,./data/raw/alphafold//AF-P9WN65-F1-model_v4.pdb,2081,4266,4148,4004
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+873,7906,8034,MWLLPLVLTSLASSATWAGQPASPPVVDTAQGRVLGKYVSLEGLAQPVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTSYPPMCCQDPVVEQMTSDLFTNGKERLTLEFSEDCLYLNIYTPADLTKRGRLPVMVWIHGGGLVLGGAPMYDGVVLAAHENVVVVAIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQENIANFGGDPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTVALVRKDMKAAAKQIAVLAGCKTTTSAVFVHCLRQKSEDELLDLTLKMKFLTLDFHGDQRESHPFLPTVVDGVLLPKMPEEILAEKDFNTVPYIVGINKQEFGWLLPTMMGFPLSEGKLDQKTATSLLWKSYPIANIPEELTPVATDKYLGGTDDPVKKKDLFLDLMGDVVFGVPSVTVARQHRDAGAPTYMYEFQYRPSFSSDKKPKTVIGDHGDEIFSVFGFPLLKGDAPEEEVSLSKTVMKFWANFARSGNPNGEGLPHWPMYDQEEGYLQIGVNTQAAKRLKGEEVAFWNDLLSKEAAKKPPKIKHAEL,uniprot_search,Q29550,CCOC(=O)[C@H](N)Cc1ccc(O)cc1.O>>CCO.N[C@H](Cc1ccc(O)cc1)C(=O)O,71.0,1.24787976073077e-14,23.5,7.1,3.1.1.1,9823.0,1.8512583487190752,CCOC(=O)[C@H](N)Cc1ccc(O)cc1.O,CCO.N[C@H](Cc1ccc(O)cc1)C(=O)O,1.8512583487190752,CCOC(=O)[C@H](N)Cc1ccc(O)cc1.O__MWLLPLVLTSLASSATWAGQPASPPVVDTAQGRVLGKYVSLEGLAQPVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTSYPPMCCQDPVVEQMTSDLFTNGKERLTLEFSEDCLYLNIYTPADLTKRGRLPVMVWIHGGGLVLGGAPMYDGVVLAAHENVVVVAIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQENIANFGGDPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTVALVRKDMKAAAKQIAVLAGCKTTTSAVFVHCLRQKSEDELLDLTLKMKFLTLDFHGDQRESHPFLPTVVDGVLLPKMPEEILAEKDFNTVPYIVGINKQEFGWLLPTMMGFPLSEGKLDQKTATSLLWKSYPIANIPEELTPVATDKYLGGTDDPVKKKDLFLDLMGDVVFGVPSVTVARQHRDAGAPTYMYEFQYRPSFSSDKKPKTVIGDHGDEIFSVFGFPLLKGDAPEEEVSLSKTVMKFWANFARSGNPNGEGLPHWPMYDQEEGYLQIGVNTQAAKRLKGEEVAFWNDLLSKEAAKKPPKIKHAEL,./data/raw/alphafold//AF-Q29550-F1-model_v4.pdb,1494,2159,554,633
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+875,3471,3520,MLPPSDSKDPRPWQILSQALGFPNYDQELWWQNTAETLNRVLEQCDYSVHLQYKYLAFYHKYILPSLGPFRRPGVEPEYISGLSHGGHPLEISVKIDKSKTICRLGLQAIGPLAGTARDPLNSFGDRELLKNLATLLPHVDLRLFDHFNAQVGLDRAQCAVATTKLIKESHNIVCTSLDLKDGEVIPKVYFSTIPKGLVTETPLFDLTFAAIEQMEVYHKDAPLRTALSSLKDFLRPRVPTDASITPPLTGLIGVDCIDPMLSRLKVYLATFRMDLSLIRDYWTLGGLLTDAGTMKGLEMVETLAKTLKLGDEACETLDAERLPFGINYAMKPGTAELAPPQIYFPLLGINDGFIADALVEFFQYMGWEDQANRYKDELKAKFPNVDISQTKNVHRWLGVAYSETKGPSMNIYYDVVAGNVARV,brenda,A0A1B0UHJ4,CC(C)=CCOP(=O)(O)OP(=O)(O)O.O=C(c1ccccc1)c1c(O)cc(O)cc1O>>CC(C)=CCc1c(O)cc(O)c(C(=O)c2ccccc2)c1O.O=P(O)(O)OP(=O)(O)O,0.012,0.0,37.0,7.5,2.5.1.136,33178.0,-1.9208187539523751,CC(C)=CCOP(=O)(O)OP(=O)(O)O.O=C(c1ccccc1)c1c(O)cc(O)cc1O,CC(C)=CCc1c(O)cc(O)c(C(=O)c2ccccc2)c1O.O=P(O)(O)OP(=O)(O)O,-0.5686362358410126,CC(C)=CCOP(=O)(O)OP(=O)(O)O.O=C(c1ccccc1)c1c(O)cc(O)cc1O__MLPPSDSKDPRPWQILSQALGFPNYDQELWWQNTAETLNRVLEQCDYSVHLQYKYLAFYHKYILPSLGPFRRPGVEPEYISGLSHGGHPLEISVKIDKSKTICRLGLQAIGPLAGTARDPLNSFGDRELLKNLATLLPHVDLRLFDHFNAQVGLDRAQCAVATTKLIKESHNIVCTSLDLKDGEVIPKVYFSTIPKGLVTETPLFDLTFAAIEQMEVYHKDAPLRTALSSLKDFLRPRVPTDASITPPLTGLIGVDCIDPMLSRLKVYLATFRMDLSLIRDYWTLGGLLTDAGTMKGLEMVETLAKTLKLGDEACETLDAERLPFGINYAMKPGTAELAPPQIYFPLLGINDGFIADALVEFFQYMGWEDQANRYKDELKAKFPNVDISQTKNVHRWLGVAYSETKGPSMNIYYDVVAGNVARV,./data/raw/alphafold//AF-A0A1B0UHJ4-F1-model_v4.pdb,1756,1414,2458,1712
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+877,4648,4704,MAMLQTNLGFITSPTFLCPKLKVKLNSYLWFSYRSQVQKLDFSKRVNRSYKRDALLLSIKCSSSTGFDNSNVVVKEKSVSVILLAGGQGKRMKMSMPKQYIPLLGQPIALYSFFTFSRMPEVKEIVVVCDPFFRDIFEEYEESIDVDLRFAIPGKERQDSVYSGLQEIDVNSELVCIHDSARPLVNTEDVEKVLKDGSAVGAAVLGVPAKATIKEVNSDSLVVKTLDRKTLWEMQTPQVIKPELLKKGFELVKSEGLEVTDDVSIVEYLKHPVYVSQGSYTNIKVTTPDDLLLAERILSEDS,sabio,P69834,CC(O)(CO)C(O)COP(=O)(O)O.Nc1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)n1>>CC(O)(CO)C(O)COP(=O)(O)OP(=O)(O)OCC1OC(n2ccc(N)nc2=O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,26.0,0.0,37.0,8.0,2.7.7.60,3702.0,1.414973347970818,CC(O)(CO)C(O)COP(=O)(O)O.Nc1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)n1,CC(O)(CO)C(O)COP(=O)(O)OP(=O)(O)OCC1OC(n2ccc(N)nc2=O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,1.414973347970818,CC(O)(CO)C(O)COP(=O)(O)O.Nc1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)n1__MAMLQTNLGFITSPTFLCPKLKVKLNSYLWFSYRSQVQKLDFSKRVNRSYKRDALLLSIKCSSSTGFDNSNVVVKEKSVSVILLAGGQGKRMKMSMPKQYIPLLGQPIALYSFFTFSRMPEVKEIVVVCDPFFRDIFEEYEESIDVDLRFAIPGKERQDSVYSGLQEIDVNSELVCIHDSARPLVNTEDVEKVLKDGSAVGAAVLGVPAKATIKEVNSDSLVVKTLDRKTLWEMQTPQVIKPELLKKGFELVKSEGLEVTDDVSIVEYLKHPVYVSQGSYTNIKVTTPDDLLLAERILSEDS,./data/raw/alphafold//AF-P69834-F1-model_v4.pdb,2953,1688,3300,2099
+878,1485,1513,MLYKGDTLYLDWLEDGIAELVFDAPGSVNKLDTATVASLGEAIGVLEQQSDLKGLLLRSNKAAFIVGADITEFLSLFLVPEEQLSQWLHFANSVFNRLEDLPVPTIAAVNGYALGGGCECVLATDYRLATPDLRIGLPETKLGIMPGFGGSVRMPRMLGADSALEIIAAGKDVGADQALKIGLVDGVVKAEKLVEGAKAVLRQAINGDLDWKAKRQPKLEPLKLSKIEATMSFTIAKGMVAQTAGKHYPAPITAVKTIEAAARFGREEALNLENKSFVPLAHTNEARALVGIFLNDQYVKGKAKKLTKDVETPKQAAVLGAGIMGGGIAYQSAWKGVPVVMKDINDKSLTLGMTEAAKLLNKQLERGKIDGLKLAGVISTIHPTLDYAGFDRVDIVVEAVVENPKVKKAVLAETEQKVRQDTVLASNTSTIPISELANALERPENFCGMHFFNPVHRMPLVEIIRGEKSSDETIAKVVAWASKMGKTPIVVNDCPGFFVNRVLFPYFAGFSQLLRDGADFRKIDKVMEKQFGWPMGPAYLLDVVGIDTAHHAQAVMAAGFPQRMQKDYRDAIDALFDANRFGQKNGLGFWRYKEDSKGKPKKEEDAAVEDLLAEVSQPKRDFSEEEIIARMMIPMVNEVVRCLEEGIIATPAEADMALVYGLGFPPFHGGAFRWLDTLGSAKYLDMAQQYQHLGPLYEVPEGLRNKARHNEPYYPPVEPARPVGDLKTA,sabio,P21177,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.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]>>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.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)c1,382.0,7.486445312765902e-15,25.0,7.0,1.1.1.35,562.0,2.582063362911709,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.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],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.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)c1,2.582063362911709,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.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]__MLYKGDTLYLDWLEDGIAELVFDAPGSVNKLDTATVASLGEAIGVLEQQSDLKGLLLRSNKAAFIVGADITEFLSLFLVPEEQLSQWLHFANSVFNRLEDLPVPTIAAVNGYALGGGCECVLATDYRLATPDLRIGLPETKLGIMPGFGGSVRMPRMLGADSALEIIAAGKDVGADQALKIGLVDGVVKAEKLVEGAKAVLRQAINGDLDWKAKRQPKLEPLKLSKIEATMSFTIAKGMVAQTAGKHYPAPITAVKTIEAAARFGREEALNLENKSFVPLAHTNEARALVGIFLNDQYVKGKAKKLTKDVETPKQAAVLGAGIMGGGIAYQSAWKGVPVVMKDINDKSLTLGMTEAAKLLNKQLERGKIDGLKLAGVISTIHPTLDYAGFDRVDIVVEAVVENPKVKKAVLAETEQKVRQDTVLASNTSTIPISELANALERPENFCGMHFFNPVHRMPLVEIIRGEKSSDETIAKVVAWASKMGKTPIVVNDCPGFFVNRVLFPYFAGFSQLLRDGADFRKIDKVMEKQFGWPMGPAYLLDVVGIDTAHHAQAVMAAGFPQRMQKDYRDAIDALFDANRFGQKNGLGFWRYKEDSKGKPKKEEDAAVEDLLAEVSQPKRDFSEEEIIARMMIPMVNEVVRCLEEGIIATPAEADMALVYGLGFPPFHGGAFRWLDTLGSAKYLDMAQQYQHLGPLYEVPEGLRNKARHNEPYYPPVEPARPVGDLKTA,./data/raw/alphafold//AF-P21177-F1-model_v4.pdb,1365,861,657,946
+879,10322,10474,MVSGTVGRGTALGAVLLALLAVPAQAGTAAAADLPAPDDTGLQAVLHTALSQGAPGAMVRVDDNGTIHQLSEGVADRATGRAITTTDRFRVGSVTKSFSAVVLLQLVDEGKLDLDASVNTYLPGLLPDDRITVRQVMSHRSGLYDYTNDMFAQTVPGFESVRNKVFSYQDLITLSLKHGVTNAPGAAYSYSNTNFVVAGMLIEKLTGHSVATEYQNRIFTPLNLTDTFYVHPDTVIPGTHANGYLTPDEAGGALVDSTEQTVSWAQSAGAVISSTQDLDTFFSALMSGQLMSAAQLAQMQQWTTVNSTQGYGLGLRRRDLSCGISVYGHTGTVQGYYTYAFASKDGKRSVTALANTSNNVNVLNTMARTLESAFCGKPTTAKLRSATSSATTVERHEDIAPGIARD,uniprot_search,P15555,C[C@@H](N=C(O)Cc1ccccc1)C(=O)Oc1cccc(C(=O)O)c1.O>>,31.0,99.71127555572238,25.0,7.5,3.4.16.4,31952.0,1.4913616938342726,C[C@@H](N=C(O)Cc1ccccc1)C(=O)Oc1cccc(C(=O)O)c1.O,,1.4913616938342726,C[C@@H](N=C(O)Cc1ccccc1)C(=O)Oc1cccc(C(=O)O)c1.O__MVSGTVGRGTALGAVLLALLAVPAQAGTAAAADLPAPDDTGLQAVLHTALSQGAPGAMVRVDDNGTIHQLSEGVADRATGRAITTTDRFRVGSVTKSFSAVVLLQLVDEGKLDLDASVNTYLPGLLPDDRITVRQVMSHRSGLYDYTNDMFAQTVPGFESVRNKVFSYQDLITLSLKHGVTNAPGAAYSYSNTNFVVAGMLIEKLTGHSVATEYQNRIFTPLNLTDTFYVHPDTVIPGTHANGYLTPDEAGGALVDSTEQTVSWAQSAGAVISSTQDLDTFFSALMSGQLMSAAQLAQMQQWTTVNSTQGYGLGLRRRDLSCGISVYGHTGTVQGYYTYAFASKDGKRSVTALANTSNNVNVLNTMARTLESAFCGKPTTAKLRSATSSATTVERHEDIAPGIARD,./data/raw/alphafold//AF-P15555-F1-model_v4.pdb,2962,1702,3314,2115
+880,3663,3713,MATLRVSSLFASSSSSLHSNPSVFTKYQSSPKWAFSFPVTPLCSKRSKRIVHCIAGDTLGLTRPNESDAPKISIGAKDTAVVQWQGDLLAIGATENDMARDENSKFKNPLLQQLDSELNGLLSAASSEEDFSGKSGQSVNLRFPGGRITLVGLGSSASSPTSYHSLGQAAAAAAKSSQARNIAVALASTDGLSAESKINSASAIATGVVLGSFEDNRFRSESKKSTLESLDILGLGTGPEIERKIKYAEHVCAGVILGRELVNAPANIVTPAVLAEEAKKIASTYSDVISVNILDAEQCKELKMGAYLAVAAAATENPPYFIHLCFKTPTKERKTKLALVGKGLTFDSGGYNLKVGAGSRIELMKNDMGGAAAVLGAAKALGEIRPSRVEVHFIVAACENMISAEGMRPGDIVTASNGKTIEVNNTDAEGRLTLADALIYACNQGVEKIIDLATLTGAIMVALGPSVAGAFTPNDDLAREVVEAAEASGEKLWRMPMEESYWESMKSGSGDMINTGPGNGGAITGALFLKQFVDEKVQWLHLDVAGPVWSDEKKNATGYGVSTLVEWVLRN,sabio,Q10712,CC(C)CC(N)C(O)=NCC(O)=NCC(=O)O.O>>CC(C)CC(N)C(=O)O.NCC(O)=NCC(=O)O,837480.0,0.0,37.0,9.2,3.4.11.1,4081.0,5.922974444373537,CC(C)CC(N)C(O)=NCC(O)=NCC(=O)O.O,CC(C)CC(N)C(=O)O.NCC(O)=NCC(=O)O,5.922974444373537,CC(C)CC(N)C(O)=NCC(O)=NCC(=O)O.O__MATLRVSSLFASSSSSLHSNPSVFTKYQSSPKWAFSFPVTPLCSKRSKRIVHCIAGDTLGLTRPNESDAPKISIGAKDTAVVQWQGDLLAIGATENDMARDENSKFKNPLLQQLDSELNGLLSAASSEEDFSGKSGQSVNLRFPGGRITLVGLGSSASSPTSYHSLGQAAAAAAKSSQARNIAVALASTDGLSAESKINSASAIATGVVLGSFEDNRFRSESKKSTLESLDILGLGTGPEIERKIKYAEHVCAGVILGRELVNAPANIVTPAVLAEEAKKIASTYSDVISVNILDAEQCKELKMGAYLAVAAAATENPPYFIHLCFKTPTKERKTKLALVGKGLTFDSGGYNLKVGAGSRIELMKNDMGGAAAVLGAAKALGEIRPSRVEVHFIVAACENMISAEGMRPGDIVTASNGKTIEVNNTDAEGRLTLADALIYACNQGVEKIIDLATLTGAIMVALGPSVAGAFTPNDDLAREVVEAAEASGEKLWRMPMEESYWESMKSGSGDMINTGPGNGGAITGALFLKQFVDEKVQWLHLDVAGPVWSDEKKNATGYGVSTLVEWVLRN,./data/raw/alphafold//AF-Q10712-F1-model_v4.pdb,1822,1502,217,235
+881,4781,4841,MSQPITRENFDEWMIPVYASAPFIPVRGEGSRLWDQQGKEYIDFAGGIAVNALGHAHPELREALNEQASKFWHTGNGYTNEPVLRLAKKLIDATFADRVFFCNSGAEANEAALKLARKFAHDRYGSHKSGIVAFKNAFHGRTLFTVSAGGQPAYSQDFAPLPADIRHAAYNDINSASALIDDSTCAVIVEPIQGEGGVVPASNAFLQGLRELCNRHNALLIFDEVQTGVGRTGELYAYMHYGVTPDLLTTAKALGGGFPVGALLATEECARVMTVGTHGTTYGGNPLASAVAGKVLELINTPEMLNGVKQRHDWFVERLNTINHRYGLFSEVRGLGLLIGCVLNADYAGQAKQISQEAAKAGVMVLIAGGNVVRFAPALNVSEEEVTTGLDRFAAACEHFVSRGSS,brenda,A0A140N9B6,CC(O)=N[C@@H](CCCN)C(=O)O.O=C(O)CCC(=O)C(=O)O>>CC(O)=N[C@@H](CCC=O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O,4.7,0.0,30.0,7.5,2.6.1.81,562.0,0.6720978579357175,CC(O)=N[C@@H](CCCN)C(=O)O.O=C(O)CCC(=O)C(=O)O,CC(O)=N[C@@H](CCC=O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O,0.6720978579357175,CC(O)=N[C@@H](CCCN)C(=O)O.O=C(O)CCC(=O)C(=O)O__MSQPITRENFDEWMIPVYASAPFIPVRGEGSRLWDQQGKEYIDFAGGIAVNALGHAHPELREALNEQASKFWHTGNGYTNEPVLRLAKKLIDATFADRVFFCNSGAEANEAALKLARKFAHDRYGSHKSGIVAFKNAFHGRTLFTVSAGGQPAYSQDFAPLPADIRHAAYNDINSASALIDDSTCAVIVEPIQGEGGVVPASNAFLQGLRELCNRHNALLIFDEVQTGVGRTGELYAYMHYGVTPDLLTTAKALGGGFPVGALLATEECARVMTVGTHGTTYGGNPLASAVAGKVLELINTPEMLNGVKQRHDWFVERLNTINHRYGLFSEVRGLGLLIGCVLNADYAGQAKQISQEAAKAGVMVLIAGGNVVRFAPALNVSEEEVTTGLDRFAAACEHFVSRGSS,./data/raw/alphafold//AF-A0A140N9B6-F1-model_v4.pdb,2983,888,3350,2155
+882,13829,14009,MITLCLSTLRGLHRAGGSRLQLTMTLGKELASPLQAMSSYTAAGRNVLRWDLSPEQIKTRTEQLIAQTKQVYDTVGTIALKEVTYENCLQVLADIEVTYIVERTMLDFPQHVSSDREVRAASTEADKKLSRFDIEMSMREDVFQRIVHLQETCDLEKIKPEARRYLEKSIKMGKRNGLHLSEHIRNEIKSMKKRMSELCIDFNKNLNEDDTSLVFSKAELGALPDDFIDSLEKTDEDKYKVTLKYPHYFPVMKKCCVPETRRKMEMAFHTRCKQENTAILQQLLPLRAQVAKLLGYNTHADFVLELNTAKSTSRVAAFLDDLSQKLKPLGEAEREFILSLKKKECEERGFEYDGKINAWDLHYYMTQTEELKYSVDQESLKEYFPIEVVTEGLLSIYQELLGLSFEQVPDAHVWNKSVSLYTVKDKATGEVLGQFYLDLYPREGKYNHAACFGLQPGCLLPDGSRMMSVAALVVNFSQPVAGRPSLLRHDEVRTYFHEFGHVMHQICAQTDFARFSGTNVETDFVEVPSQMLENWVWDVDSLRKLSKHYKDGHPITDELLEKLVASRLVNTGLLTLRQIVLSKVDQSLHTNATLDAASEYAKYCTEILGVAATPGTNMPATFGHLAGGYDGQYYGYLWSEVFSMDMFHSCFKKEGIMNPEVGMKYRNLILKPGGSLDGMDMLQNFLQREPNQKAFLMSRGLNGS,uniprot_search,P42676,N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)Cc1ccccc1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].Nc1ccccc1C(O)=NCC(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCC(=O)O)C(=O)O,0.7,1.8702353482769224e-14,37.0,7.4,3.4.24.16,10116.0,-0.1549019599857432,N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)Cc1ccccc1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].Nc1ccccc1C(O)=NCC(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(O)=N[C@@H](CCC(=O)O)C(=O)O,-0.1549019599857432,N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CO)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MITLCLSTLRGLHRAGGSRLQLTMTLGKELASPLQAMSSYTAAGRNVLRWDLSPEQIKTRTEQLIAQTKQVYDTVGTIALKEVTYENCLQVLADIEVTYIVERTMLDFPQHVSSDREVRAASTEADKKLSRFDIEMSMREDVFQRIVHLQETCDLEKIKPEARRYLEKSIKMGKRNGLHLSEHIRNEIKSMKKRMSELCIDFNKNLNEDDTSLVFSKAELGALPDDFIDSLEKTDEDKYKVTLKYPHYFPVMKKCCVPETRRKMEMAFHTRCKQENTAILQQLLPLRAQVAKLLGYNTHADFVLELNTAKSTSRVAAFLDDLSQKLKPLGEAEREFILSLKKKECEERGFEYDGKINAWDLHYYMTQTEELKYSVDQESLKEYFPIEVVTEGLLSIYQELLGLSFEQVPDAHVWNKSVSLYTVKDKATGEVLGQFYLDLYPREGKYNHAACFGLQPGCLLPDGSRMMSVAALVVNFSQPVAGRPSLLRHDEVRTYFHEFGHVMHQICAQTDFARFSGTNVETDFVEVPSQMLENWVWDVDSLRKLSKHYKDGHPITDELLEKLVASRLVNTGLLTLRQIVLSKVDQSLHTNATLDAASEYAKYCTEILGVAATPGTNMPATFGHLAGGYDGQYYGYLWSEVFSMDMFHSCFKKEGIMNPEVGMKYRNLILKPGGSLDGMDMLQNFLQREPNQKAFLMSRGLNGS,./data/raw/alphafold//AF-P42676-F1-model_v4.pdb,1820,1500,3201,1976
+883,16364,16592,MATKLQDGNTPCLAATPSEPRPTVLVFDSGVGGLSVYDEIRHLLPDLHYIYAFDNVAFPYGEKSEAFIVERVVAIVTAVQERYPLALAVVACNTASTVSLPALREKFDFPVVGVVPAIKPAARLTANGIVGLLATRGTVKRSYTHELIARFANECQIEMLGSAEMVELAEAKLHGEDVSLDALKRILRPWLRMKEPPDTVVLGCTHFPLLQEELLQVLPEGTRLVDSGAAIARRTAWLLEHEAPDAKSADANIAFCMAMTPGAEQLLPVLQRYGFETLEKLAVLG,sabio,P22634,NC(CCC(=O)O)C(=O)O>>NC(CCC(=O)O)C(=O)O,43800.0,0.0,,8.0,5.1.1.3,562.0,4.6414741105041,NC(CCC(=O)O)C(=O)O,NC(CCC(=O)O)C(=O)O,5.193124598354462,NC(CCC(=O)O)C(=O)O__MATKLQDGNTPCLAATPSEPRPTVLVFDSGVGGLSVYDEIRHLLPDLHYIYAFDNVAFPYGEKSEAFIVERVVAIVTAVQERYPLALAVVACNTASTVSLPALREKFDFPVVGVVPAIKPAARLTANGIVGLLATRGTVKRSYTHELIARFANECQIEMLGSAEMVELAEAKLHGEDVSLDALKRILRPWLRMKEPPDTVVLGCTHFPLLQEELLQVLPEGTRLVDSGAAIARRTAWLLEHEAPDAKSADANIAFCMAMTPGAEQLLPVLQRYGFETLEKLAVLG,./data/raw/alphafold//AF-P22634-F1-model_v4.pdb,2654,5157,2297,5190
+884,13907,14088,MIVRCLSAARRLHRVGGSGILLRMTLGREAMSPLQAMSSYTVDGRNVLRWDLSPEQIKRRTEELIAQTKQVYDDIGMLDIEEVTYENCLQALADVEVKYIVERTMLDFPQHVSSDKEVRAASTEADKRLSRFDIEMSMREDIFLRIVRLKETCDLGKIKPEARRYLEKSVKMGKRNGLHLPEQVQNEIKAMKKRMSELCIDFNKNLNEDDTFLVFSKAELGALPDDFIDSLEKTDDNKYKITLKYPHYFPVMKKCCIPETRRKMEMAFNTRCKEENTIILQELLPLRAKVAKLLGYSTHADFVLEMNTAKSTHHVTAFLDDLSQKLKPLGEAEREFILNLKKKECEEKGFEYDGKINAWDLHYYMTQTEELKYSVDQEILKEYFPIEVVTEGLLNIYQELLGLSFEQVTDAHVWNKSVTLYTVKDKATGEVLGQFYLDLYPREGKYNHAACFGLQPGCLLPDGSRMMSVAALVVNFSQPRAGRPSLLRHDEVRTYFHEFGHVMHQICAQTDFARFSGTNVETDFVEVPSQMLENWVWDTDSLRRLSKHYKDGSPITDDLLEKLVASRLVNTGLLTLRQIVLSKVDQSLHTNTSLDAASEYAKYCTEILGVAATPGTNMPATFGHLAGGYDGQYYGYLWSEVFSMDMFYSCFKKEGIMNPEVGMKYRNLILKPGGSLDGMDMLQNFLKREPNQKAFLMSRGLHAP,uniprot_search,Q02038,N=C(O)C[C@H](N=C(O)[C@H](CCCNC(=N)N)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)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>N=C(O)C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)Cc1ccccc1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].Nc1ccccc1C(O)=NCC(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O,1.9,2.9157349354621095e-14,37.0,7.4,3.4.24.16,9823.0,0.2787536009528289,N=C(O)C[C@H](N=C(O)[C@H](CCCNC(=N)N)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)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,N=C(O)C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)Cc1ccccc1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].Nc1ccccc1C(O)=NCC(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O,0.2787536009528289,N=C(O)C[C@H](N=C(O)[C@H](CCCNC(=N)N)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)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MIVRCLSAARRLHRVGGSGILLRMTLGREAMSPLQAMSSYTVDGRNVLRWDLSPEQIKRRTEELIAQTKQVYDDIGMLDIEEVTYENCLQALADVEVKYIVERTMLDFPQHVSSDKEVRAASTEADKRLSRFDIEMSMREDIFLRIVRLKETCDLGKIKPEARRYLEKSVKMGKRNGLHLPEQVQNEIKAMKKRMSELCIDFNKNLNEDDTFLVFSKAELGALPDDFIDSLEKTDDNKYKITLKYPHYFPVMKKCCIPETRRKMEMAFNTRCKEENTIILQELLPLRAKVAKLLGYSTHADFVLEMNTAKSTHHVTAFLDDLSQKLKPLGEAEREFILNLKKKECEEKGFEYDGKINAWDLHYYMTQTEELKYSVDQEILKEYFPIEVVTEGLLNIYQELLGLSFEQVTDAHVWNKSVTLYTVKDKATGEVLGQFYLDLYPREGKYNHAACFGLQPGCLLPDGSRMMSVAALVVNFSQPRAGRPSLLRHDEVRTYFHEFGHVMHQICAQTDFARFSGTNVETDFVEVPSQMLENWVWDTDSLRRLSKHYKDGSPITDDLLEKLVASRLVNTGLLTLRQIVLSKVDQSLHTNTSLDAASEYAKYCTEILGVAATPGTNMPATFGHLAGGYDGQYYGYLWSEVFSMDMFYSCFKKEGIMNPEVGMKYRNLILKPGGSLDGMDMLQNFLKREPNQKAFLMSRGLHAP,./data/raw/alphafold//AF-Q02038-F1-model_v4.pdb,1820,1500,3201,1829
+885,15894,16121,MDLGLAGRRALVTGAGKGIGRSTVLALKAAGAQVVAVSRTREDLDDLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVALLQPFLEVTKEACDTSFNVNLRAVIQVSQIVAKGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKMMALELGPHKIRVNAVNPTVVMTPMGRTNWSDPHKAKAMLDRIPLGKFAEVENVVDTILFLLSNRSGMTTGSTLPVDGGFLAT,sabio,Q91X52,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)C(O)CO>>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=C(CO)[C@H](O)[C@@H](O)CO.[H],17.0,6.336613912379397e-15,25.0,7.0,1.1.1.10,10090.0,1.230448921378274,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)C(O)CO,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=C(CO)[C@H](O)[C@@H](O)CO.[H],1.230448921378274,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)C(O)CO__MDLGLAGRRALVTGAGKGIGRSTVLALKAAGAQVVAVSRTREDLDDLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVALLQPFLEVTKEACDTSFNVNLRAVIQVSQIVAKGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKMMALELGPHKIRVNAVNPTVVMTPMGRTNWSDPHKAKAMLDRIPLGKFAEVENVVDTILFLLSNRSGMTTGSTLPVDGGFLAT,./data/raw/alphafold//AF-Q91X52-F1-model_v4.pdb,1316,3874,6191,846
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+905,4093,4146,MKFTTAAVLSALVSAEIAFAAPGGNGFARRQARRQARAAGLKASPFRQVNAKEATVESNWGGAILIGSDFDTVSATANVPSASGGSSAAGTAWVGIDGDTCQTAILQTGFDWYGDGTYDAWYEWYPEVSDDFSGITISEGDSIQMSVTATSDTSGSATLENLTTGQKVSKSFSNESSGSLCRTNAEFIIEDFEECNSNGSDCEFVPFASFSPAVEFTDCSVTSDGESVSLDDAQITQVIINNQDVTDCSVSGTTVSCSYV,uniprot_search,P15369,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCN)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](CCCCN)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-],8.0,2.9305716364540366e-14,37.0,4.5,3.4.23.32,5539.0,0.9030899869919436,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCN)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](CCCCN)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-],0.9030899869919436,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCN)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
+906,2629,2664,MPLSLQIIETIEQLKEMARLEEEIWKTAPVPLHQTLTVAKNGGIIIGAYVDGKLVGFVYSFPGFRNGEVYLCSHMMGIAESFRDRGLGYRLKMKQAEEARRRGYRVIRWTYDPLQSRNGYLNLAKLGALGVEYVENCYGEMNDALNGQLPSDRFIVEWRLDERPTGERSLAKADLLKARSLTVLEAGQRADGLLRPVLRDIDETAAPLLLAAVPLDFPQLKERDLALALEWRLATRALFQRLLTEGWIAAGAWRRSGEPAMHYIWVRRNE,sabio,Q5L1H0,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)CCC(=O)O.N=C(N)NCCCC(N)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,11.0,15.15042044147044,25.0,7.9,2.3.1.-,1462.0,1.0413926851582251,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)CCC(=O)O.N=C(N)NCCCC(N)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,1.0413926851582251,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)CCC(=O)O.N=C(N)NCCCC(N)C(=O)O__MPLSLQIIETIEQLKEMARLEEEIWKTAPVPLHQTLTVAKNGGIIIGAYVDGKLVGFVYSFPGFRNGEVYLCSHMMGIAESFRDRGLGYRLKMKQAEEARRRGYRVIRWTYDPLQSRNGYLNLAKLGALGVEYVENCYGEMNDALNGQLPSDRFIVEWRLDERPTGERSLAKADLLKARSLTVLEAGQRADGLLRPVLRDIDETAAPLLLAAVPLDFPQLKERDLALALEWRLATRALFQRLLTEGWIAAGAWRRSGEPAMHYIWVRRNE,./data/raw/alphafold//AF-Q5L1H0-F1-model_v4.pdb,1639,1241,1723,1456
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+926,6516,6629,MNNIWWQTKGQGNVHLVLLHGWGLNAEVWRCIDEELSSHFTLHLVDLPGFGRSRGFGALSLADMAEAVLQQAPDKAIWLGWSLGGLVASQIALTHPERVQALVTVASSPCFSARDEWPGIKPDVLAGFQQQLSDDFQRTVERFLALQTMGTETARQDARALKKTVLALPMPEVDVLNGGLEILKTVDLRQPLQNVSMPFLRLYGYLDGLVPRKVVPMLDKLWPHSESYIFAKAAHAPFISHPAEFCHLLVALKQRV,brenda,P13001,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,6.1,0.0,37.0,7.5,3.1.1.1,562.0,0.785329835010767,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,0.785329835010767,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MNNIWWQTKGQGNVHLVLLHGWGLNAEVWRCIDEELSSHFTLHLVDLPGFGRSRGFGALSLADMAEAVLQQAPDKAIWLGWSLGGLVASQIALTHPERVQALVTVASSPCFSARDEWPGIKPDVLAGFQQQLSDDFQRTVERFLALQTMGTETARQDARALKKTVLALPMPEVDVLNGGLEILKTVDLRQPLQNVSMPFLRLYGYLDGLVPRKVVPMLDKLWPHSESYIFAKAAHAPFISHPAEFCHLLVALKQRV,./data/raw/alphafold//AF-P13001-F1-model_v4.pdb,1491,1039,865,1195
+927,4723,4781,MAHRPPSPALASVLLALLLSGAARAAEIVGGHEAQPHSRPYMASLQMRGNPGSHFCGGTLIHPSFVLTAAHCLRDIPQRLVNVVLGAHNVRTQEPTQQHFSVAQVFLNNYDAENKLNDVLLIQLSSPANLSASVATVQLPQQDQPVPHGTQCLAMGWGRVGAHDPPAQVLQELNVTVVTFFCRPHNICTFVPRRKAGICFGDSGGPLICDGIIQGIDSFVIWGCATRLFPDFFTRVALYVDWIRSTLRRVEAKGRP,uniprot_search,P24158,CC(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>,13.2,99.80374147256695,25.0,7.4,3.4.21.76,9606.0,1.1205739312058498,CC(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,,1.1205739312058498,CC(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MAHRPPSPALASVLLALLLSGAARAAEIVGGHEAQPHSRPYMASLQMRGNPGSHFCGGTLIHPSFVLTAAHCLRDIPQRLVNVVLGAHNVRTQEPTQQHFSVAQVFLNNYDAENKLNDVLLIQLSSPANLSASVATVQLPQQDQPVPHGTQCLAMGWGRVGAHDPPAQVLQELNVTVVTFFCRPHNICTFVPRRKAGICFGDSGGPLICDGIIQGIDSFVIWGCATRLFPDFFTRVALYVDWIRSTLRRVEAKGRP,./data/raw/alphafold//AF-P24158-F1-model_v4.pdb,1869,1572,3137,1906
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+929,22560,22897,MKPYLKEDPWSIIEEGFDKDKHEISESVFSLGNGHMGQRANFEETYTGSTLQGSYMAGVYYPDKTRVGWWKNGYPEYFAKVLNATNWIGLDISVDGTELDLNRAEVNDFVRELNMKEGYLKRSFRATIADGKDIKVEATRFVSVAMKEIGAIEYKITPLTFDGELTLRSYLDGDIMNKDANYDEKFWSKVSESAEGSRAHVTVKTKKLDFVYASLKETKVVHAGEEISPAECKTAEKYAEVTFTAPLKKNEATTIYKFAANVTNRDHEDQKLLDVAKEKLNQAIEKGFDTLKKEQADEWNKKWEDSDIVIEGDVAAQQGIRFNIFQMNQTYTGEDARLNIGPKGFTGEKYGGSTYWDTEAYCLPFYLATADQRIPKNLLVYRHNHLEKAKENAGKLGFTKGALYPMVTMNGEESHNEWEITFEEIHRNGAIAYAIYNYVNYTGDKSYIGELGIEVLVEISRFWEERVHYVPKKDVYMMHGVTGPNEYENNVNNNWYTNRIASWTLEYTLFALDYLKDSDPELYKKWITKLDLKDHETEKWLTIIDKMYYPEDKENGIFLQADNFEDKEIMPVSDLDEKHLPLNQNWSWDRILRSCFIKQADVLQGMYFLNHEFDIETKKRNFDYYEPMTVHESSLSPCVHSILACELGYKEKAYEMYLRTARLDLDNYNNDTEDGCHITSMAGTWMSVVEGFGGMKVKNDQLILNPFIPGQWSSFSFKVVFRGTRLLIKVTQDQVVVNNETDVKADLVIHGETYSLDGKGELSINH,brenda,D6XUS4,O=P(O)(O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.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>>O=P(O)(O)O.OC[C@H]1O[C@H](O[C@H]2C(O)O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,40.0,9.427832468803784e-15,30.0,6.5,2.4.1.8,85683.0,1.6020599913279625,O=P(O)(O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.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,O=P(O)(O)O.OC[C@H]1O[C@H](O[C@H]2C(O)O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O,1.6020599913279625,O=P(O)(O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.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__MKPYLKEDPWSIIEEGFDKDKHEISESVFSLGNGHMGQRANFEETYTGSTLQGSYMAGVYYPDKTRVGWWKNGYPEYFAKVLNATNWIGLDISVDGTELDLNRAEVNDFVRELNMKEGYLKRSFRATIADGKDIKVEATRFVSVAMKEIGAIEYKITPLTFDGELTLRSYLDGDIMNKDANYDEKFWSKVSESAEGSRAHVTVKTKKLDFVYASLKETKVVHAGEEISPAECKTAEKYAEVTFTAPLKKNEATTIYKFAANVTNRDHEDQKLLDVAKEKLNQAIEKGFDTLKKEQADEWNKKWEDSDIVIEGDVAAQQGIRFNIFQMNQTYTGEDARLNIGPKGFTGEKYGGSTYWDTEAYCLPFYLATADQRIPKNLLVYRHNHLEKAKENAGKLGFTKGALYPMVTMNGEESHNEWEITFEEIHRNGAIAYAIYNYVNYTGDKSYIGELGIEVLVEISRFWEERVHYVPKKDVYMMHGVTGPNEYENNVNNNWYTNRIASWTLEYTLFALDYLKDSDPELYKKWITKLDLKDHETEKWLTIIDKMYYPEDKENGIFLQADNFEDKEIMPVSDLDEKHLPLNQNWSWDRILRSCFIKQADVLQGMYFLNHEFDIETKKRNFDYYEPMTVHESSLSPCVHSILACELGYKEKAYEMYLRTARLDLDNYNNDTEDGCHITSMAGTWMSVVEGFGGMKVKNDQLILNPFIPGQWSSFSFKVVFRGTRLLIKVTQDQVVVNNETDVKADLVIHGETYSLDGKGELSINH,./data/raw/alphafold//AF-D6XUS4-F1-model_v4.pdb,781,208,5950,6868
+930,2662,2697,MEGKVYHFRVKFGDTDAAGIVFYPNYYKWMDEACHHFLTELGFPTSELIDKKIGFPIVEATCQFKAPLLFADHVFIRTSIRELKDKSFILEHHFIKQGRVIASGHEKRVWANFSNGKLAVCPIPSSVRVAFANIGTCE,sabio,Q9KBC9,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)c1ccc(Cl)cc1.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.O=C(O)c1ccc(Cl)cc1,7.3,6.147833177138447e-15,25.0,7.5,3.1.2.23,86665.0,0.8633228601204559,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)c1ccc(Cl)cc1.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.O=C(O)c1ccc(Cl)cc1,0.8633228601204559,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)c1ccc(Cl)cc1.O__MEGKVYHFRVKFGDTDAAGIVFYPNYYKWMDEACHHFLTELGFPTSELIDKKIGFPIVEATCQFKAPLLFADHVFIRTSIRELKDKSFILEHHFIKQGRVIASGHEKRVWANFSNGKLAVCPIPSSVRVAFANIGTCE,./data/raw/alphafold//AF-Q9KBC9-F1-model_v4.pdb,1646,1250,1732,1466
+931,3149,3191,MAEEVSNKQVILKNYVTGYPKESDMEIKNVTIKLKVPEGSNDVVVKNLYLSCDPYMRSRMRKIEGSYVESFAPGSPITGYGVAKVLESGDPKFQKGDLVWGMTGWEEYSIITPTQTLFKIHDKDVPLSYYTGILGMPGMTAYAGFHEVCSPKKGETVFVSAASGAVGQLVGQFAKMLGCYVVGSAGSKEKVDLLKSKFGFDEAFNYKEEQDLSAALKRYFPDGIDIYFENVGGKMLDAVLVNMKLYGRIAVCGMISQYNLEQTEGVHNLFCLITKRIRMEGFLVFDYYHLYPKYLEMVIPQIKAGKVVYVEDVAHGLESAPTALVGLFSGRNIGKQVVMVSRE,brenda,Q9SLN8,CC(C)=C1CC[C@@H](C)CC1=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+]>>CC(C)[C@@H]1CC[C@@H](C)CC1=O.CC(C)[C@H]1CC[C@@H](C)CC1=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)c1,3.3,7.899905407834607,35.0,7.0,1.3.1.102,4097.0,0.5185139398778875,CC(C)=C1CC[C@@H](C)CC1=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+],CC(C)[C@@H]1CC[C@@H](C)CC1=O.CC(C)[C@H]1CC[C@@H](C)CC1=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)c1,0.5185139398778875,CC(C)=C1CC[C@@H](C)CC1=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+]__MAEEVSNKQVILKNYVTGYPKESDMEIKNVTIKLKVPEGSNDVVVKNLYLSCDPYMRSRMRKIEGSYVESFAPGSPITGYGVAKVLESGDPKFQKGDLVWGMTGWEEYSIITPTQTLFKIHDKDVPLSYYTGILGMPGMTAYAGFHEVCSPKKGETVFVSAASGAVGQLVGQFAKMLGCYVVGSAGSKEKVDLLKSKFGFDEAFNYKEEQDLSAALKRYFPDGIDIYFENVGGKMLDAVLVNMKLYGRIAVCGMISQYNLEQTEGVHNLFCLITKRIRMEGFLVFDYYHLYPKYLEMVIPQIKAGKVVYVEDVAHGLESAPTALVGLFSGRNIGKQVVMVSRE,./data/raw/alphafold//AF-Q9SLN8-F1-model_v4.pdb,2392,1340,369,418
+932,767,789,MQTARLFQGNLNLAAANIRDYEKKEQRNLGVWLSLNQWLRLYDEDTRFWWTTTAPMLGRMMELIGYDQDAQQKHLLFYYIYVLPSLGRRPSPEGYPTGWNSFMTDDYSPLELSWDWGVAEGESSVRFSIEPIGKYAGTQADPLNQKMVYQLVDGLRPAFHHTLDLTLFDVFSEALTTSREKFGTRKLSLEGRSQYFVAFDLDVGHPRLKAYFMPGLKSIESNTPVSELVVKAMDACELHFGSLFMQAFRRLNSDLEAFSATSYHRPEIEIVGIDCVSPVKSRAKIYIRHRGTSFDSVCRMLSMGAKAPLDAASVASLRELWALVLGLPKDFPSDQELPSVPHRTSGVLYYFEIKPTSDAIVPKVYIPVRHYASNDLSIAQGLATYFERRGQTVAAENYVDALSDIFSHRSLDSGLGLHTYISCTFKKTGLSVTSYFNPEIYHPNRYRQ,brenda,Q6Q874,C=C/C=C/COP(=O)(O)OP(=O)(O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O>>C=C/C=C/COc1ccc(C[C@H](N)C(=O)O)cc1.O=P(O)(O)OP(=O)(O)O,0.00083,6.675413883744871e-15,35.0,7.5,2.5.1.122,5022.0,-3.0809219076239263,C=C/C=C/COP(=O)(O)OP(=O)(O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O,C=C/C=C/COc1ccc(C[C@H](N)C(=O)O)cc1.O=P(O)(O)OP(=O)(O)O,-3.0809219076239263,C=C/C=C/COP(=O)(O)OP(=O)(O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O__MQTARLFQGNLNLAAANIRDYEKKEQRNLGVWLSLNQWLRLYDEDTRFWWTTTAPMLGRMMELIGYDQDAQQKHLLFYYIYVLPSLGRRPSPEGYPTGWNSFMTDDYSPLELSWDWGVAEGESSVRFSIEPIGKYAGTQADPLNQKMVYQLVDGLRPAFHHTLDLTLFDVFSEALTTSREKFGTRKLSLEGRSQYFVAFDLDVGHPRLKAYFMPGLKSIESNTPVSELVVKAMDACELHFGSLFMQAFRRLNSDLEAFSATSYHRPEIEIVGIDCVSPVKSRAKIYIRHRGTSFDSVCRMLSMGAKAPLDAASVASLRELWALVLGLPKDFPSDQELPSVPHRTSGVLYYFEIKPTSDAIVPKVYIPVRHYASNDLSIAQGLATYFERRGQTVAAENYVDALSDIFSHRSLDSGLGLHTYISCTFKKTGLSVTSYFNPEIYHPNRYRQ,./data/raw/alphafold//AF-Q6Q874-F1-model_v4.pdb,1038,586,249,270
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+934,8376,8507,MKGKLKLFLAVGAISVIVAGCANANSQNGMKGTDQPKMNMGDSQQNTSQNKEQSGDMKLTQATPVADGKEFTITAQASNLKVSDDVTLPVWTFNNSVPGPQIRVKVGDTVKVKLKNELEEPVSIHWHGYPVPNNMDGIPGVTQDAVAAGKEFTYEFKATVPGTYWYHSHQDSVNQLDKGLYGTLIVEDPSESYDRDYTIVLDEWMSSGEMDMSNNEDMEGMDHSQMDMGDTSNNEDMQGMDHSQMDMGNTSNNEDMEGMDHSQMDMGDTSNMTEMAGHDMSMYDVYTMNGKTGDAIDKLTVKKGDKVRIRLVNAGYITHTIHLHGHEFKVIASDGQPVNSPAVITDQGIAIAPGERYDLEFTANNPGSWLLEEHGKEDRVKNMRAVIEYEGVPDRPDASNANEELPTFDLTKYGQQARTNFSLDQKFDQDVKLDLNTEMKAGEMVYTINGKLFPDTDPIKVDKGDKVKVTFVNNSKTDDHPMHLHGHFFQVLSKNGKPLEGTPVIKDTLNVKPGEEYVVAFEADNPGDWMFHCHDLHHASAGMVTDVMYNGYNSNYTPDPTVGNKPE,sabio,A0A165SC98,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,1400.0,1.4837780463171737,25.0,7.0,1.10.3.2,59843.0,3.146128035678238,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,3.146128035678238,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O__MKGKLKLFLAVGAISVIVAGCANANSQNGMKGTDQPKMNMGDSQQNTSQNKEQSGDMKLTQATPVADGKEFTITAQASNLKVSDDVTLPVWTFNNSVPGPQIRVKVGDTVKVKLKNELEEPVSIHWHGYPVPNNMDGIPGVTQDAVAAGKEFTYEFKATVPGTYWYHSHQDSVNQLDKGLYGTLIVEDPSESYDRDYTIVLDEWMSSGEMDMSNNEDMEGMDHSQMDMGDTSNNEDMQGMDHSQMDMGNTSNNEDMEGMDHSQMDMGDTSNMTEMAGHDMSMYDVYTMNGKTGDAIDKLTVKKGDKVRIRLVNAGYITHTIHLHGHEFKVIASDGQPVNSPAVITDQGIAIAPGERYDLEFTANNPGSWLLEEHGKEDRVKNMRAVIEYEGVPDRPDASNANEELPTFDLTKYGQQARTNFSLDQKFDQDVKLDLNTEMKAGEMVYTINGKLFPDTDPIKVDKGDKVKVTFVNNSKTDDHPMHLHGHFFQVLSKNGKPLEGTPVIKDTLNVKPGEEYVVAFEADNPGDWMFHCHDLHHASAGMVTDVMYNGYNSNYTPDPTVGNKPE,./data/raw/alphafold//AF-A0A165SC98-F1-model_v4.pdb,3579,2290,3992,2882
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+947,3910,3963,MNDSQTMLILLCNVNIYAPNPLGIKDVLIAGNKIAAIYDHGQGEITIPKQWPVKVINFDGAILTPGFIDSHAHITGGGGEAGFATQVPPVGLTEFTHAGVTTVVGLLGTDDTTRSTENLLSRVYGLREEGLSAYCWTGGYHFPLTTITGSAKSDIAFLEPVIGIGEFAISDHRSSQPTFEEVIRLASETHVAGLITGKAGVIHFHLGDGERRLELIERAIRETELPARVFNPTHVNRNKPLFEDSCKLLSKGCHIDLTAFPAGTAQPGWEACDAIEMAVERQLPLEQITLSSDGGGCLPCFDPQGELQHMDFGRASTLGETLVATLNKGLSLETVLPMLTSNVANILRFKNKGQIAVGFDADLLVMNEKYEITDVMAQGVWHKQNNQTMIKGTFE,brenda,Q484B6,CC(C)C[C@H](N=C(O)C[C@H](N)C(=O)O)C(=O)O.O>>CC(C)C[C@H](N)C(=O)O.N[C@@H](CC(=O)O)C(=O)O,164.0,1.07341657654352e-14,30.0,8.0,3.4.19.5,28229.0,2.214843848047698,CC(C)C[C@H](N=C(O)C[C@H](N)C(=O)O)C(=O)O.O,CC(C)C[C@H](N)C(=O)O.N[C@@H](CC(=O)O)C(=O)O,2.214843848047698,CC(C)C[C@H](N=C(O)C[C@H](N)C(=O)O)C(=O)O.O__MNDSQTMLILLCNVNIYAPNPLGIKDVLIAGNKIAAIYDHGQGEITIPKQWPVKVINFDGAILTPGFIDSHAHITGGGGEAGFATQVPPVGLTEFTHAGVTTVVGLLGTDDTTRSTENLLSRVYGLREEGLSAYCWTGGYHFPLTTITGSAKSDIAFLEPVIGIGEFAISDHRSSQPTFEEVIRLASETHVAGLITGKAGVIHFHLGDGERRLELIERAIRETELPARVFNPTHVNRNKPLFEDSCKLLSKGCHIDLTAFPAGTAQPGWEACDAIEMAVERQLPLEQITLSSDGGGCLPCFDPQGELQHMDFGRASTLGETLVATLNKGLSLETVLPMLTSNVANILRFKNKGQIAVGFDADLLVMNEKYEITDVMAQGVWHKQNNQTMIKGTFE,./data/raw/alphafold//AF-Q484B6-F1-model_v4.pdb,1865,1567,3153,1924
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+949,14110,14293,MRIAMIGTGYVGLVSGACFSDFGHEVVCVDKDARKIELLHQNVMPIYEPGLDALVASNVKAGRLSFTTDLAEGVKDADAVFIAVGTPSRRGDGHADLSYVFAAAREIAENLTKPSVIVTKSTVPVGTGDEVERIIAEVAPNSGAKVVSNPEFLREGAAIEDFKRPDRVVVGTEDEFARQVMREIYRPLSLNQSAPVLFTGRRTSELIKYAANAFLAVKITFINEIADLCEQVGADVQEVSRGIGMDNRIGGKFLHAGPGYGGSCFPKDTLALMKTAADNETPLRIVEATVQVNDARKRAMGRKVIKAMGGDVRGKTVGILGLTFKPNTDDMRDAPSLSIIAALQDAGATVKAYDPEGVEQASKMLTDVEFVENPYAAADGADALVIVTEWDAFRALDLTRIKNSLKSPVLVDLRNIYPPAELERAGLQYTGVGKPSRD,uniprot_search,A4UTT2,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.O.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>>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.O=C(O)[C@H]1O[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](O)[C@@H](O)[C@@H]1O.[H+],8.73,0.0807532483554967,30.0,8.7,1.1.1.22,179878.0,0.9410142437055696,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.O.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,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.O=C(O)[C@H]1O[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](O)[C@@H](O)[C@@H]1O.[H+],0.9410142437055696,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.O.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__MRIAMIGTGYVGLVSGACFSDFGHEVVCVDKDARKIELLHQNVMPIYEPGLDALVASNVKAGRLSFTTDLAEGVKDADAVFIAVGTPSRRGDGHADLSYVFAAAREIAENLTKPSVIVTKSTVPVGTGDEVERIIAEVAPNSGAKVVSNPEFLREGAAIEDFKRPDRVVVGTEDEFARQVMREIYRPLSLNQSAPVLFTGRRTSELIKYAANAFLAVKITFINEIADLCEQVGADVQEVSRGIGMDNRIGGKFLHAGPGYGGSCFPKDTLALMKTAADNETPLRIVEATVQVNDARKRAMGRKVIKAMGGDVRGKTVGILGLTFKPNTDDMRDAPSLSIIAALQDAGATVKAYDPEGVEQASKMLTDVEFVENPYAAADGADALVIVTEWDAFRALDLTRIKNSLKSPVLVDLRNIYPPAELERAGLQYTGVGKPSRD,./data/raw/alphafold//AF-A4UTT2-F1-model_v4.pdb,2337,4695,4738,4574
+950,6891,7007,MAAALLARAGGSLGRALRARDWRRLHTVYQSVELPETHQMLRQTCRDFAEKELVPIAAQLDKEHLFPTSQVKKMGELGLLAMDVPEELSGAGLDYLAYSIALEEISRGCASTGVIMSVNNSLYLGPILKFGSSQQKQQWITPFTNGDKIGCFALSEPGNGSDAGAASTTAREEGDSWVLNGTKAWITNSWEASATVVFASTDRSRQNKGISAFLVPMPTPGLTLGKKEDKLGIRASSTANLIFEDCRIPKENLLGEPGMGFKIAMQTLDMGRIGIASQALGIAQASLDCAVKYAENRHAFGAPLTKLQNIQFKLADMALALESARLLTWRAAMLKDNKKPFTKESAMAKLAASEAATAISHQAIQILGGMGYVTEMPAERYYRDARITEIYEGTSEIQRLVIAGHLLRSYRS,sabio,P15651,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.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>>CCCC=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)c1N2,8.5,0.0,32.0,8.0,1.3.8.1,10116.0,0.9294189257142929,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.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,CCCC=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)c1N2,0.9294189257142929,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.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__MAAALLARAGGSLGRALRARDWRRLHTVYQSVELPETHQMLRQTCRDFAEKELVPIAAQLDKEHLFPTSQVKKMGELGLLAMDVPEELSGAGLDYLAYSIALEEISRGCASTGVIMSVNNSLYLGPILKFGSSQQKQQWITPFTNGDKIGCFALSEPGNGSDAGAASTTAREEGDSWVLNGTKAWITNSWEASATVVFASTDRSRQNKGISAFLVPMPTPGLTLGKKEDKLGIRASSTANLIFEDCRIPKENLLGEPGMGFKIAMQTLDMGRIGIASQALGIAQASLDCAVKYAENRHAFGAPLTKLQNIQFKLADMALALESARLLTWRAAMLKDNKKPFTKESAMAKLAASEAATAISHQAIQILGGMGYVTEMPAERYYRDARITEIYEGTSEIQRLVIAGHLLRSYRS,./data/raw/alphafold//AF-P15651-F1-model_v4.pdb,3214,2079,3737,2591
+951,13386,13561,MAVQAPSKTYGFQKAPIQLTFVVVGAGLGGVAASICLRLAGHRVILLEAATELGEVGAGIQIPPPSTKILKAIGVLDAVDKVSIHPHDILVKKYKGELLSTQNLVPYVSEKYDGMYLHIHRADYHKVLVDRAEELGVEIHTNSRVVDIDFEKATVTTATGKQYSGDVIVGYDGVRSQTRALLTGDSSGAYDTGDLAYRALIKVEDMKKVPGLEKFYANPNINFWWGPTMHIVMYFLHEGEICNVVALCPDTLPKGVLKQDASQEELLDLVKGWDQDLTTVFKLITSVSKWRLQDSRELKTWVNSKTGNFIILGDASHSTLPYLASGASQAVEDGAVLAGLFSKIESRDQIPQLLQMTENLRKWRSSQVVRGSHQCQDIYHLPDGELQEIRDSYLYDKQPELGCPNRFADPVFQDFLWGYNAFDEVERAWKEFKAGGNPTYTYPNLYKPKSSGEKDVSGGGAAATLAAGNTPAAPLSASG,brenda,G8B709,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)c1ccc(O)cc1.O=O.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O.O=C=O.Oc1ccc(O)cc1,0.136,6.198487858477973e-15,30.0,7.5,1.14.13.64,5480.0,-0.8664610916297825,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)c1ccc(O)cc1.O=O.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O.O=C=O.Oc1ccc(O)cc1,-0.8664610916297825,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)c1ccc(O)cc1.O=O.[H+]__MAVQAPSKTYGFQKAPIQLTFVVVGAGLGGVAASICLRLAGHRVILLEAATELGEVGAGIQIPPPSTKILKAIGVLDAVDKVSIHPHDILVKKYKGELLSTQNLVPYVSEKYDGMYLHIHRADYHKVLVDRAEELGVEIHTNSRVVDIDFEKATVTTATGKQYSGDVIVGYDGVRSQTRALLTGDSSGAYDTGDLAYRALIKVEDMKKVPGLEKFYANPNINFWWGPTMHIVMYFLHEGEICNVVALCPDTLPKGVLKQDASQEELLDLVKGWDQDLTTVFKLITSVSKWRLQDSRELKTWVNSKTGNFIILGDASHSTLPYLASGASQAVEDGAVLAGLFSKIESRDQIPQLLQMTENLRKWRSSQVVRGSHQCQDIYHLPDGELQEIRDSYLYDKQPELGCPNRFADPVFQDFLWGYNAFDEVERAWKEFKAGGNPTYTYPNLYKPKSSGEKDVSGGGAAATLAAGNTPAAPLSASG,./data/raw/alphafold//AF-G8B709-F1-model_v4.pdb,3774,4567,4500,4401
+952,22166,22499,MKKGVMRPGHIQLRVLNLESALAHYRDLLGLIEVDRDDFGRAYLKAWTEVDKFSLVLREADEPGMDFMGFKVVDEDALRQLERDLTAYGCAVEQLPAGELNSCGRRVRFQAPSGHHFELYADKEYTGKWGVNEVNPEAWPRDLKGMAAVRFDHALMYGDELPATYDLFTKVLGFYLAEQVLDENGTRVAQFLSLSTKAHDVAFIHHPEKGRLHHVSFHLETWEDLLRAADLISMTDTSIDIGPTRHGLTHGKTIYFFDPSGNRNEVFCGGDYNYPDHKPVTWTTDQLGKAIFYHDRILNERFMTVLT,brenda,T1T1S4,O=O.Oc1cccc(-c2ccccc2)c1O>>O=C/C=C/C(=C(\O)C(=O)O)c1ccccc1,200.0,6.497638273498e-15,,,1.13.11.2,497782.0,2.3010299956639813,O=O.Oc1cccc(-c2ccccc2)c1O,O=C/C=C/C(=C(\O)C(=O)O)c1ccccc1,2.3010299956639813,O=O.Oc1cccc(-c2ccccc2)c1O__MKKGVMRPGHIQLRVLNLESALAHYRDLLGLIEVDRDDFGRAYLKAWTEVDKFSLVLREADEPGMDFMGFKVVDEDALRQLERDLTAYGCAVEQLPAGELNSCGRRVRFQAPSGHHFELYADKEYTGKWGVNEVNPEAWPRDLKGMAAVRFDHALMYGDELPATYDLFTKVLGFYLAEQVLDENGTRVAQFLSLSTKAHDVAFIHHPEKGRLHHVSFHLETWEDLLRAADLISMTDTSIDIGPTRHGLTHGKTIYFFDPSGNRNEVFCGGDYNYPDHKPVTWTTDQLGKAIFYHDRILNERFMTVLT,./data/raw/alphafold//AF-T1T1S4-F1-model_v4.pdb,752,4169,4037,3884
+953,5333,5419,MILKNKRMLKIGICVGILGLSITSLEAFTGESLQVEAKEKTGQVKHKNQATHKEFSQLEKKFDARLGVYAIDTGTNQTISYRPNERFAFASTYKALAAGVLLQQNSIDSLNEVITYTKEDLVDYSPVTEKHVDTGMKLGEIAEAAVRSSDNTAGNILFNKIGGPKGYEKALRHMGDRITMSNRFETELNEAIPGDIRDTSTAKAIATNLKAFTVGNALPAEKRKILTEWMKGNATGDKLIRAGIPTDWVVGDKSGAGSYGTRNDIAVVWPPNSAPIIVLISSKDEKEAIYNDQLIAEATKVIVKGS,sabio,P00809,CC1(C)SC2C(NC(=O)COc3ccccc3)C(=O)N2C1C(=O)O.O>>,4525.0,99.7292988026886,20.0,7.0,3.5.2.6,1396.0,3.655618583541222,CC1(C)SC2C(NC(=O)COc3ccccc3)C(=O)N2C1C(=O)O.O,,3.655618583541222,CC1(C)SC2C(NC(=O)COc3ccccc3)C(=O)N2C1C(=O)O.O__MILKNKRMLKIGICVGILGLSITSLEAFTGESLQVEAKEKTGQVKHKNQATHKEFSQLEKKFDARLGVYAIDTGTNQTISYRPNERFAFASTYKALAAGVLLQQNSIDSLNEVITYTKEDLVDYSPVTEKHVDTGMKLGEIAEAAVRSSDNTAGNILFNKIGGPKGYEKALRHMGDRITMSNRFETELNEAIPGDIRDTSTAKAIATNLKAFTVGNALPAEKRKILTEWMKGNATGDKLIRAGIPTDWVVGDKSGAGSYGTRNDIAVVWPPNSAPIIVLISSKDEKEAIYNDQLIAEATKVIVKGS,./data/raw/alphafold//AF-P00809-F1-model_v4.pdb,1458,966,771,1071
+954,4820,4881,MQPLLFLLIFVLFQEDEAGKIIGGREARPNSHPYMAFLLIQSPEGLSACGGFLVREDFVLTAGHCFGSSINVTLGAHNIRRQEGTQQHITVLRAIRHPDYNPPPVIQNDIMLLQLRSRARRSRAVKPVALPQATKRVQPGALCTVAGWGLVSQRRGTNVLQEVKLRVQTDQTCANRFQFYNSQTQICVGNPRERKSAFKGDSGGPLVCNNVAQGIVSYGSSSGNPPAVFTRIQSFMPWIKRTMRRLSSRY,uniprot_search,P17977,CC(O)=N[C@@H](Cc1ccccc1)C(=O)Oc1ccc([N+](=O)[O-])cc1.O>>,20.2,99.71209682759496,37.0,8.325,3.4.21.20,10116.0,1.305351369446624,CC(O)=N[C@@H](Cc1ccccc1)C(=O)Oc1ccc([N+](=O)[O-])cc1.O,,1.305351369446624,CC(O)=N[C@@H](Cc1ccccc1)C(=O)Oc1ccc([N+](=O)[O-])cc1.O__MQPLLFLLIFVLFQEDEAGKIIGGREARPNSHPYMAFLLIQSPEGLSACGGFLVREDFVLTAGHCFGSSINVTLGAHNIRRQEGTQQHITVLRAIRHPDYNPPPVIQNDIMLLQLRSRARRSRAVKPVALPQATKRVQPGALCTVAGWGLVSQRRGTNVLQEVKLRVQTDQTCANRFQFYNSQTQICVGNPRERKSAFKGDSGGPLVCNNVAQGIVSYGSSSGNPPAVFTRIQSFMPWIKRTMRRLSSRY,./data/raw/alphafold//AF-P17977-F1-model_v4.pdb,1858,1738,3357,2162
+955,361,376,MTATEELTFESTSRFAEVDVDGPLKLHYHEAGVGNDQTVVLLHGGGPGAASWTNFSRNIAVLARHFHVLAVDQPGYGHSDKRAEHGQFNRYAAMALKGLFDQLGLGRVPLVGNSLGGGTAVRFALDYPARAGRLVLMGPGGLSINLFAPDPTEGVKRLSKFSVAPTRENLEAFLRVMVYDKNLITPELVDQRFALASTPESLTATRAMGKSFAGADFEAGMMWREVYRLRQPVLLIWGREDRVNPLDGALVALKTIPRAQLHVFGQCGHWVQVEKFDEFNKLTIEFLGGGR,brenda,P9WNH5,C/C(O)=C/C=C(\C)C(=O)CCc1ccccc1Cl.O>>C=C/C=C(/O)C(=O)O.O=C(O)c1ccccc1,0.33,8.950941364257009,25.0,7.5,3.7.1.8,1773.0,-0.4814860601221125,C/C(O)=C/C=C(\C)C(=O)CCc1ccccc1Cl.O,C=C/C=C(/O)C(=O)O.O=C(O)c1ccccc1,-0.4814860601221125,C/C(O)=C/C=C(\C)C(=O)CCc1ccccc1Cl.O__MTATEELTFESTSRFAEVDVDGPLKLHYHEAGVGNDQTVVLLHGGGPGAASWTNFSRNIAVLARHFHVLAVDQPGYGHSDKRAEHGQFNRYAAMALKGLFDQLGLGRVPLVGNSLGGGTAVRFALDYPARAGRLVLMGPGGLSINLFAPDPTEGVKRLSKFSVAPTRENLEAFLRVMVYDKNLITPELVDQRFALASTPESLTATRAMGKSFAGADFEAGMMWREVYRLRQPVLLIWGREDRVNPLDGALVALKTIPRAQLHVFGQCGHWVQVEKFDEFNKLTIEFLGGGR,./data/raw/alphafold//AF-P9WNH5-F1-model_v4.pdb,250,587,250,271
+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
+960,3615,3664,MKVWLDGRLVDEEEAKVTVLSPSLNYGFGVFEGIRAYWNGENLYVFRLRDHMERLLRSAKIIGLDVPYTAEELSKAVVETVRANGFKEDLYIRPVAYISKPQISLDVRGLQASVAIAAIPFGKYLKVEGVRAAVVSWRRVHTSMMPVMAKATGIYLNSIMAAVEARARGYDEAIMLNAEGKVVEGSGENIFIVRRGVLMTPPLEDGILEGITRETVISIAGDLGIPLLEKSITREELYAADEAFFVGTAAEITPIIEIDGRVLQRGPITQKIAETYRRIVLGKEEKYLPWLTPVY,brenda,F2L0W0,CC(C)CC(=O)C(=O)[O-].CCCC[C@H](N)C(=O)O>>CC(C)C[C@H](N)C(=O)O.CCCCC(=O)C(=O)[O-],3.0,0.0,65.0,8.0,2.6.1.42,184117.0,0.4771212547196624,CC(C)CC(=O)C(=O)[O-].CCCC[C@H](N)C(=O)O,CC(C)C[C@H](N)C(=O)O.CCCCC(=O)C(=O)[O-],0.4771212547196624,CC(C)CC(=O)C(=O)[O-].CCCC[C@H](N)C(=O)O__MKVWLDGRLVDEEEAKVTVLSPSLNYGFGVFEGIRAYWNGENLYVFRLRDHMERLLRSAKIIGLDVPYTAEELSKAVVETVRANGFKEDLYIRPVAYISKPQISLDVRGLQASVAIAAIPFGKYLKVEGVRAAVVSWRRVHTSMMPVMAKATGIYLNSIMAAVEARARGYDEAIMLNAEGKVVEGSGENIFIVRRGVLMTPPLEDGILEGITRETVISIAGDLGIPLLEKSITREELYAADEAFFVGTAAEITPIIEIDGRVLQRGPITQKIAETYRRIVLGKEEKYLPWLTPVY,./data/raw/alphafold//AF-F2L0W0-F1-model_v4.pdb,1271,5220,1607,734
+961,18251,18511,MSFDDLHKATERAVIQAVDQICDDFEVTPEKLDELTAYFIEQMEKGLAPPKEGHTLASDKGLPMIPAFVTGSPNGTERGVLLAADLGGTNFRICSVNLHGDHTFSMEQMKSKIPDDLLDDENVTSDDLFGFLARRTLAFMKKYHPDELAKGKDAKPMKLGFTFSYPVDQTSLNSGTLIRWTKGFRIADTVGKDVVQLYQEQLSAQGMPMIKVVALTNDTVGTYLSHCYTSDNTDSMTSGEISEPVIGCIFGTGTNGCYMEEINKITKLPQELRDKLIKEGKTHMIINVEWGSFDNELKHLPTTKYDVVIDQKLSTNPGFHLFEKRVSGMFLGEVLRNILVDLHSQGLLLQQYRSKEQLPRHLTTPFQLSSEVLSHIEIDDSTGLRETELSLLQSLRLPTTPTERVQIQKLVRAISRRSAYLAAVPLAAILIKTNALNKRYHGEVEIGCDGSVVEYYPGFRSMLRHALALSPLGAEGERKVHLKIAKDGSGVGAALCALVA,sabio,P17709,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)C(O)C(O)C1O,0.0721,8.264070734796279e-15,30.0,6.5,2.7.1.2,4932.0,-1.142064735280571,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)C(O)C(O)C1O,-1.142064735280571,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O__MSFDDLHKATERAVIQAVDQICDDFEVTPEKLDELTAYFIEQMEKGLAPPKEGHTLASDKGLPMIPAFVTGSPNGTERGVLLAADLGGTNFRICSVNLHGDHTFSMEQMKSKIPDDLLDDENVTSDDLFGFLARRTLAFMKKYHPDELAKGKDAKPMKLGFTFSYPVDQTSLNSGTLIRWTKGFRIADTVGKDVVQLYQEQLSAQGMPMIKVVALTNDTVGTYLSHCYTSDNTDSMTSGEISEPVIGCIFGTGTNGCYMEEINKITKLPQELRDKLIKEGKTHMIINVEWGSFDNELKHLPTTKYDVVIDQKLSTNPGFHLFEKRVSGMFLGEVLRNILVDLHSQGLLLQQYRSKEQLPRHLTTPFQLSSEVLSHIEIDDSTGLRETELSLLQSLRLPTTPTERVQIQKLVRAISRRSAYLAAVPLAAILIKTNALNKRYHGEVEIGCDGSVVEYYPGFRSMLRHALALSPLGAEGERKVHLKIAKDGSGVGAALCALVA,./data/raw/alphafold//AF-P17709-F1-model_v4.pdb,835,287,2835,5682
+962,14217,14406,MYMEKLRLDGRVAVVTGGAQNIGLACVTALAEAGARVIIADLDETLAAQSAEDLRKQDLNVDSIRMDVTSTESVQSAIKTLHEKEGHLDILVACAGICISEVKAEDMTDGQWLKQVDINLNGMFRCCQAVGRIMIEQKKGAIVAIGSMSGQIVNRPQQQAAYNASKAGVHQYIRSLAAEWAPHGIRANAVAPTYIETTLTRFGMEKPELYDAWIAGTPMGRVGQPDEVASVVQFLASDAASLMTGAIVNVDAGFTVW,brenda,Q308C1,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.OCC(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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=C(CO)CO.[H+],16.3,0.0,25.0,8.5,1.1.1.11,442.0,1.212187604403958,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.OCC(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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=C(CO)CO.[H+],1.212187604403958,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.OCC(O)CO__MYMEKLRLDGRVAVVTGGAQNIGLACVTALAEAGARVIIADLDETLAAQSAEDLRKQDLNVDSIRMDVTSTESVQSAIKTLHEKEGHLDILVACAGICISEVKAEDMTDGQWLKQVDINLNGMFRCCQAVGRIMIEQKKGAIVAIGSMSGQIVNRPQQQAAYNASKAGVHQYIRSLAAEWAPHGIRANAVAPTYIETTLTRFGMEKPELYDAWIAGTPMGRVGQPDEVASVVQFLASDAASLMTGAIVNVDAGFTVW,./data/raw/alphafold//AF-Q308C1-F1-model_v4.pdb,1373,4724,4769,4608
+963,4913,4985,MKSLLSAFVATIALIGSANGMTVTKGNGDDWLKKSTKTAVIQLTRAAQTYTPGMNPRSVNPDGTVRLAPPRDWTTGFFPGTLWYGYELSGDKNLAAEAKRFTLALDTIQYVKDTHDLGFMLYCSYGNAYRVTGDKIYLKPLENGAANLYARFNKKVGAIRSWDFGHWQFPVIIDNLMNLEYLYWAGKEFNKPEWFDAAKTHAVTTMKNHFRKDYSSYHVISYDTLSGKVLQRETHQGLTNESAWARGQAWGLYGYTMSYKDTKDKKFIEHAEHIAAFIMNHPAMPADKIPLWDFDVHNRDRSPRDASAAAVIASALLDLSTQVKDGQKYFKFAEDILKTLSSDEYLAKPGENQFFILKHSVGALLYNSEIDTPLNYADYYYLEALKRYAEIKKIDLKTINQS,brenda,C6Y1N7,CC(O)=N[C@H]1C(O)O[C@H](CO)[C@@H](O[C@@H]2OC(C(=O)O)=C[C@H](O)[C@H]2O)[C@@H]1O.O>>,16.0,99.74895376481489,30.0,7.5,3.2.1.180,984.0,1.2041199826559248,CC(O)=N[C@H]1C(O)O[C@H](CO)[C@@H](O[C@@H]2OC(C(=O)O)=C[C@H](O)[C@H]2O)[C@@H]1O.O,,1.2041199826559248,CC(O)=N[C@H]1C(O)O[C@H](CO)[C@@H](O[C@@H]2OC(C(=O)O)=C[C@H](O)[C@H]2O)[C@@H]1O.O__MKSLLSAFVATIALIGSANGMTVTKGNGDDWLKKSTKTAVIQLTRAAQTYTPGMNPRSVNPDGTVRLAPPRDWTTGFFPGTLWYGYELSGDKNLAAEAKRFTLALDTIQYVKDTHDLGFMLYCSYGNAYRVTGDKIYLKPLENGAANLYARFNKKVGAIRSWDFGHWQFPVIIDNLMNLEYLYWAGKEFNKPEWFDAAKTHAVTTMKNHFRKDYSSYHVISYDTLSGKVLQRETHQGLTNESAWARGQAWGLYGYTMSYKDTKDKKFIEHAEHIAAFIMNHPAMPADKIPLWDFDVHNRDRSPRDASAAAVIASALLDLSTQVKDGQKYFKFAEDILKTLSSDEYLAKPGENQFFILKHSVGALLYNSEIDTPLNYADYYYLEALKRYAEIKKIDLKTINQS,./data/raw/alphafold//AF-C6Y1N7-F1-model_v4.pdb,3026,1776,3402,2209
+964,1316,1344,MAELFYDADADLSIIQGRKVAVIGYGSQGHAHALSLRDSGVDVRVGLHEGSKSKAKAEEQGLRVVSPSEAAAEADVIMILVPDPIQAQVYEEHIKDNLKDGDALFFGHGLNIRFGFIKPPAGVDVCMVAPKGPGHLVRRQYEEGRGVPCIAAVEQDASGNAFALALSYAKGIGGTRAGVIKTTFTEETETDLFGEQAVLCGGTAALVKAGFETLTEAGYQPEIAYFECLHELKLIVDLMYEGGLEKMRWSISETAEWGDYVTGPRIITDATKAEMKKVLAEIQDGTFAKNWMDEYHGGLKKYNEYKQQDSEHLLETTGKQLRKLMSWVDEEA,brenda,A0A0K2AZ61,CC(=O)C(C)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+]>>CC(O)C(C)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)c1,1.2,0.0,25.0,8.0,1.1.1.86,1889.0,0.0791812460476248,CC(=O)C(C)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+],CC(O)C(C)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)c1,0.0791812460476248,CC(=O)C(C)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+]__MAELFYDADADLSIIQGRKVAVIGYGSQGHAHALSLRDSGVDVRVGLHEGSKSKAKAEEQGLRVVSPSEAAAEADVIMILVPDPIQAQVYEEHIKDNLKDGDALFFGHGLNIRFGFIKPPAGVDVCMVAPKGPGHLVRRQYEEGRGVPCIAAVEQDASGNAFALALSYAKGIGGTRAGVIKTTFTEETETDLFGEQAVLCGGTAALVKAGFETLTEAGYQPEIAYFECLHELKLIVDLMYEGGLEKMRWSISETAEWGDYVTGPRIITDATKAEMKKVLAEIQDGTFAKNWMDEYHGGLKKYNEYKQQDSEHLLETTGKQLRKLMSWVDEEA,./data/raw/alphafold//AF-A0A0K2AZ61-F1-model_v4.pdb,1575,5234,1622,756
+965,8211,8339,MSSSSWLLLSLVAVTAAQSTIEEQAKTFLDKFNHEAEDLFYQSSLASWNYNTNITEENVQNMNNAGDKWSAFLKEQSTLAQMYPLQEIQNLTVKLQLQALQQNGSSVLSEDKSKRLNTILNTMSTIYSTGKVCNPDNPQECLLLEPGLNEIMANSLDYNERLWAWESWRSEVGKQLRPLYEEYVVLKNEMARANHYEDYGDYWRGDYEVNGVDGYDYSRGQLIEDVEHTFEEIKPLYEHLHAYVRAKLMNAYPSYISPIGCLPAHLLGDMWGRFWTNLYSLTVPFGQKPNIDVTDAMVDQAWDAQRIFKEAEKFFVSVGLPNMTQGFWENSMLTDPGNVQKAVCHPTAWDLGKGDFRILMCTKVTMDDFLTAHHEMGHIQYDMAYAAQPFLLRNGANEGFHEAVGEIMSLSAATPKHLKSIGLLSPDFQEDNETEINFLLKQALTIVGTLPFTYMLEKWRWMVFKGEIPKDQWMKKWWEMKREIVGVVEPVPHDETYCDPASLFHVSNDYSFIRYYTRTLYQFQFQEALCQAAKHEGPLHKCDISNSTEAGQKLFNMLRLGKSEPWTLALENVVGAKNMNVRPLLNYFEPLFTWLKDQNKNSFVGWSTDWSPYADQSIKVRISLKSALGDKAYEWNDNEMYLFRSSVAYAMRQYFLKVKNQMILFGEEDVRVANLKPRISFNFFVTAPKNVSDIIPRTEVEKAIRMSRSRINDAFRLNDNSLEFLGIQPTLGPPNQPPVSIWLIVFGVVMGVIVVGIVILIFTGIRDRKKKNKARSGENPYASIDISKGENNPGFQNTDDVQTSF,brenda,Q9BYF1,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H](N)C(C)C)C(O)=N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)O.O>>CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H](N)C(C)C)C(O)=N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)O.N[C@@H](Cc1ccccc1)C(=O)O,162.0,0.0,37.0,7.4,3.4.17.23,9606.0,2.2095150145426308,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H](N)C(C)C)C(O)=N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)O.O,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H](N)C(C)C)C(O)=N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)O.N[C@@H](Cc1ccccc1)C(=O)O,2.2095150145426308,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H](N)C(C)C)C(O)=N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)O.O__MSSSSWLLLSLVAVTAAQSTIEEQAKTFLDKFNHEAEDLFYQSSLASWNYNTNITEENVQNMNNAGDKWSAFLKEQSTLAQMYPLQEIQNLTVKLQLQALQQNGSSVLSEDKSKRLNTILNTMSTIYSTGKVCNPDNPQECLLLEPGLNEIMANSLDYNERLWAWESWRSEVGKQLRPLYEEYVVLKNEMARANHYEDYGDYWRGDYEVNGVDGYDYSRGQLIEDVEHTFEEIKPLYEHLHAYVRAKLMNAYPSYISPIGCLPAHLLGDMWGRFWTNLYSLTVPFGQKPNIDVTDAMVDQAWDAQRIFKEAEKFFVSVGLPNMTQGFWENSMLTDPGNVQKAVCHPTAWDLGKGDFRILMCTKVTMDDFLTAHHEMGHIQYDMAYAAQPFLLRNGANEGFHEAVGEIMSLSAATPKHLKSIGLLSPDFQEDNETEINFLLKQALTIVGTLPFTYMLEKWRWMVFKGEIPKDQWMKKWWEMKREIVGVVEPVPHDETYCDPASLFHVSNDYSFIRYYTRTLYQFQFQEALCQAAKHEGPLHKCDISNSTEAGQKLFNMLRLGKSEPWTLALENVVGAKNMNVRPLLNYFEPLFTWLKDQNKNSFVGWSTDWSPYADQSIKVRISLKSALGDKAYEWNDNEMYLFRSSVAYAMRQYFLKVKNQMILFGEEDVRVANLKPRISFNFFVTAPKNVSDIIPRTEVEKAIRMSRSRINDAFRLNDNSLEFLGIQPTLGPPNQPPVSIWLIVFGVVMGVIVVGIVILIFTGIRDRKKKNKARSGENPYASIDISKGENNPGFQNTDDVQTSF,./data/raw/alphafold//AF-Q9BYF1-F1-model_v4.pdb,1835,1522,3101,1865
+966,1961,1992,MAMDLGGYLTRIGLDGRPRPDLGTLHAIVAAHNRSIPFENLDPLLGIPVADLSAEALFAKLVDRRRGGYCYEHNGLLGYVLEELGFEVERLSGRVVWMRADDAPLPAQTHNVLSVAVPGADGRYLVDVGFGGQTLTSPIRLEAGPVQQTRHEPYRLTRHGDDHTLAAQVRGEWQPLYTFTTEPRPRIDLEVGSWYVSTHPGSHFVTGLTVAVVTDDARYNLRGRNLAVHRSGATEHIRFDSAAQVLDAIVNRFGIDLGDLAGRDVQARVAEVLDT,brenda,O86309,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.CCCCOc1ccc(N)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@@H](O)C(O)=NCCC(O)=NCCS.CCCCOc1ccc(N=C(C)O)cc1,0.039,5.828217257294372e-15,30.0,7.5,2.3.1.5,1772.0,-1.408935392973501,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.CCCCOc1ccc(N)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@@H](O)C(O)=NCCC(O)=NCCS.CCCCOc1ccc(N=C(C)O)cc1,-1.408935392973501,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.CCCCOc1ccc(N)cc1__MAMDLGGYLTRIGLDGRPRPDLGTLHAIVAAHNRSIPFENLDPLLGIPVADLSAEALFAKLVDRRRGGYCYEHNGLLGYVLEELGFEVERLSGRVVWMRADDAPLPAQTHNVLSVAVPGADGRYLVDVGFGGQTLTSPIRLEAGPVQQTRHEPYRLTRHGDDHTLAAQVRGEWQPLYTFTTEPRPRIDLEVGSWYVSTHPGSHFVTGLTVAVVTDDARYNLRGRNLAVHRSGATEHIRFDSAAQVLDAIVNRFGIDLGDLAGRDVQARVAEVLDT,./data/raw/alphafold//AF-O86309-F1-model_v4.pdb,1480,1021,846,1171
+967,3590,3639,MTPQKSDACSDPVYTVGDYLLDRLAELGVSEIFGVPGDYNLQFLDHIVAHPTIRWVGSANELNAGYAADGYGRLRGMSAVVTTFGVGELSVTNAIAGSYAEHVPVVHIVGGPTKDAQGTRRALHHSLGDGDFEHFLRISREITCAQANLMPATAGREIDRVLSEVREQKRPGYILLSSDVARFPTEPPAAPLPRYPGGTSPRALSLFTKAAIELIADHQLTVLADLLVHRLQAVKELEALLAADVVPHATLMWGKSLLDESSPNFLGIYAGAASAERVRAAIEGAPVLVTAGVVFTDMVSGFFSQRIDPARTIDIGQYQSSVADQVFAPLEMSAALQALATILTGRGISSPPVVPPPAEPPPAMPARDEPLTQQMVWDRVCSALTPGNVVLADQGTSFYGMADHRLPQGVTFIGQPLWGSIGYTLPAAVGAAVAHPDRRTVLLIGDGAAQLTVQELGTFSREGLSPVIVVVNNDGYTVERAIHGETAPYNDIVSWNWTELPSALGVTNHLAFRAQTYGQLDDALTVAAARRDRMVLVEVVLPRLEIPRLLGQLVGSMAPQ,brenda,P9WG37,CC(C)CC(=O)C(=O)O>>CC(C)CC=O.O=C=O,31.5,1.0877624300729476e-14,25.0,7.5,4.1.1.72,1773.0,1.4983105537896004,CC(C)CC(=O)C(=O)O,CC(C)CC=O.O=C=O,1.4983105537896004,CC(C)CC(=O)C(=O)O__MTPQKSDACSDPVYTVGDYLLDRLAELGVSEIFGVPGDYNLQFLDHIVAHPTIRWVGSANELNAGYAADGYGRLRGMSAVVTTFGVGELSVTNAIAGSYAEHVPVVHIVGGPTKDAQGTRRALHHSLGDGDFEHFLRISREITCAQANLMPATAGREIDRVLSEVREQKRPGYILLSSDVARFPTEPPAAPLPRYPGGTSPRALSLFTKAAIELIADHQLTVLADLLVHRLQAVKELEALLAADVVPHATLMWGKSLLDESSPNFLGIYAGAASAERVRAAIEGAPVLVTAGVVFTDMVSGFFSQRIDPARTIDIGQYQSSVADQVFAPLEMSAALQALATILTGRGISSPPVVPPPAEPPPAMPARDEPLTQQMVWDRVCSALTPGNVVLADQGTSFYGMADHRLPQGVTFIGQPLWGSIGYTLPAAVGAAVAHPDRRTVLLIGDGAAQLTVQELGTFSREGLSPVIVVVNNDGYTVERAIHGETAPYNDIVSWNWTELPSALGVTNHLAFRAQTYGQLDDALTVAAARRDRMVLVEVVLPRLEIPRLLGQLVGSMAPQ,./data/raw/alphafold//AF-P9WG37-F1-model_v4.pdb,900,3069,606,696
+968,302,314,MVSAHFILIHTICHGAWLWYKLIPLLQSAGHNATAIDLVASGIDPRQLEQIGTWEQYSEPLFTLIESIPEGKKVILVGESGGGINIALAAEKYPEKVSALVFHNALMPDIDHSPAFVYKKFSEVFTDWKDSIFSNYTYGNDTVTAVELGDRTLAENIFSNSPIEDVELAKHLVRKGSFFEQDLDTLPNFTSEGYGSIRRVYVYGEEDQIFSRDFQLWQINNYKPDKVYCVPSADHKIQISKVNELAQILQEVANSASDLLAVA,brenda,D1MX73,C#N.O=Cc1cccc2ccccc12>>,6.0,99.45714130611802,22.0,4.2,4.1.2.47,316758.0,0.7781512503836436,C#N.O=Cc1cccc2ccccc12,,0.7781512503836436,C#N.O=Cc1cccc2ccccc12__MVSAHFILIHTICHGAWLWYKLIPLLQSAGHNATAIDLVASGIDPRQLEQIGTWEQYSEPLFTLIESIPEGKKVILVGESGGGINIALAAEKYPEKVSALVFHNALMPDIDHSPAFVYKKFSEVFTDWKDSIFSNYTYGNDTVTAVELGDRTLAENIFSNSPIEDVELAKHLVRKGSFFEQDLDTLPNFTSEGYGSIRRVYVYGEEDQIFSRDFQLWQINNYKPDKVYCVPSADHKIQISKVNELAQILQEVANSASDLLAVA,./data/raw/alphafold//AF-D1MX73-F1-model_v4.pdb,1488,546,202,219
+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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+1035,21994,22325,MTADELVFFVNGKKVVEKNADPETTLLAYLRRKLGLRGTKLGCGEGGCGACTVMLSKYDRLQDKIIHFSANACLAPICTLHHVAVTTVEGIGSTKTRLHPVQERIAKSHGSQCGFCTPGIVMSMYTLLRNQPEPTVEEIEDAFQGNLCRCTGYRPILQGFRTFAKNGGCCGGNGNNPNCCMNQKKDHTVTLSPSLFNPEEFMPLDPTQEPIFPPELLRLKDVPPKQLRFEGERVTWIQASTLKELLDLKAQHPEAKLVVGNTEIGIEMKFKNQLFPMIICPAWIPELNAVEHGPEGISFGAACALSSVEKTLLEAVAKLPTQKTEVFRGVLEQLRWFAGKQVKSVASLGGNIITASPISDLNPVFMASGTKLTIVSRGTRRTVPMDHTFFPSYRKTLLGPEEILLSIEIPYSREDEFFSAFKQASRREDDIAKVTCGMRVLFQPGSMQVKELALCYGGMADRTISALKTTQKQLSKFWNEKLLQDVCAGLAEELSLSPDAPGGMIEFRRTLTLSFFFKFYLTVLKKLGKDSKDKCGKLDPTYTSATLLFQKDPPANIQLFQEVPNGQSKEDTVGRPLPHLAAAMQASGEAVYCDDIPRYENELFLRLVTSTRAHAKIKSIDVSEAQKVPGFVCFLSADDIPGSNETGLFNDETVFAKDTVTCVGHIIGAVVADTPEHAERAAHVVKVTYEDLPAIITIEDAIKNNSFYGSELKIEKGDLKKGFSEADNVVSGELYIGGQDHFYLETHCTIAIPKGEEGEMELFVSTQNAMKTQSFVAKMLGVPVNRILVRVKRMGGGFGGKETRSTLVSVAVALAAYKTGHPVRCMLDRNEDMLITGGRHPFLARYKVGFMKTGTIVALEVDHYSNAGNSRDLSHSIMERALFHMDNCYKIPNIRGTGRLCKTNLSSNTAFRGFGGPQALFIAENWMSEVAVTCGLPAEEVRWKNMYKEGDLTHFNQRLEGFSVPRCWDECLKSSQYYARKSEVDKFNKENCWKKRGLCIIPTKFGISFTVPFLNQAGALIHVYTDGSVLVSHGGTEMGQGLHTKMVQVASKALKIPISKIYISETSTNTVPNSSPTAASVSTDIYGQAVYEACQTILKRLEPFKKKNPDGSWEDWVMAAYQDRVSLSTTGFYRTPNLGYSFETNSGNAFHYFTYGVACSEVEIDCLTGDHKNLRTDIVMDVGSSLNPAIDIGQVEGAFVQGLGLFTLEELHYSPEGSLHTRGPSTYKIPAFGSIPTEFRVSLLRDCPNKKAIYASKAVGEPPLFLGASVFFAIKDAIRAARAQHTNNNTKELFRLDSPATPEKIRNACVDKFTTLCVTGAPGNCKPWSLRV,sabio,P80457,O=NO.O=NO>>N=O.O=c1[nH]c(=O)c2[nH]c(=O)[nH]c2[nH]1,0.68,35.729826756234864,37.0,,1.17.3.2,9913.0,-0.1674910872937636,O=NO.O=NO,N=O.O=c1[nH]c(=O)c2[nH]c(=O)[nH]c2[nH]1,0.3961993470957364,O=NO.O=NO__MTADELVFFVNGKKVVEKNADPETTLLAYLRRKLGLRGTKLGCGEGGCGACTVMLSKYDRLQDKIIHFSANACLAPICTLHHVAVTTVEGIGSTKTRLHPVQERIAKSHGSQCGFCTPGIVMSMYTLLRNQPEPTVEEIEDAFQGNLCRCTGYRPILQGFRTFAKNGGCCGGNGNNPNCCMNQKKDHTVTLSPSLFNPEEFMPLDPTQEPIFPPELLRLKDVPPKQLRFEGERVTWIQASTLKELLDLKAQHPEAKLVVGNTEIGIEMKFKNQLFPMIICPAWIPELNAVEHGPEGISFGAACALSSVEKTLLEAVAKLPTQKTEVFRGVLEQLRWFAGKQVKSVASLGGNIITASPISDLNPVFMASGTKLTIVSRGTRRTVPMDHTFFPSYRKTLLGPEEILLSIEIPYSREDEFFSAFKQASRREDDIAKVTCGMRVLFQPGSMQVKELALCYGGMADRTISALKTTQKQLSKFWNEKLLQDVCAGLAEELSLSPDAPGGMIEFRRTLTLSFFFKFYLTVLKKLGKDSKDKCGKLDPTYTSATLLFQKDPPANIQLFQEVPNGQSKEDTVGRPLPHLAAAMQASGEAVYCDDIPRYENELFLRLVTSTRAHAKIKSIDVSEAQKVPGFVCFLSADDIPGSNETGLFNDETVFAKDTVTCVGHIIGAVVADTPEHAERAAHVVKVTYEDLPAIITIEDAIKNNSFYGSELKIEKGDLKKGFSEADNVVSGELYIGGQDHFYLETHCTIAIPKGEEGEMELFVSTQNAMKTQSFVAKMLGVPVNRILVRVKRMGGGFGGKETRSTLVSVAVALAAYKTGHPVRCMLDRNEDMLITGGRHPFLARYKVGFMKTGTIVALEVDHYSNAGNSRDLSHSIMERALFHMDNCYKIPNIRGTGRLCKTNLSSNTAFRGFGGPQALFIAENWMSEVAVTCGLPAEEVRWKNMYKEGDLTHFNQRLEGFSVPRCWDECLKSSQYYARKSEVDKFNKENCWKKRGLCIIPTKFGISFTVPFLNQAGALIHVYTDGSVLVSHGGTEMGQGLHTKMVQVASKALKIPISKIYISETSTNTVPNSSPTAASVSTDIYGQAVYEACQTILKRLEPFKKKNPDGSWEDWVMAAYQDRVSLSTTGFYRTPNLGYSFETNSGNAFHYFTYGVACSEVEIDCLTGDHKNLRTDIVMDVGSSLNPAIDIGQVEGAFVQGLGLFTLEELHYSPEGSLHTRGPSTYKIPAFGSIPTEFRVSLLRDCPNKKAIYASKAVGEPPLFLGASVFFAIKDAIRAARAQHTNNNTKELFRLDSPATPEKIRNACVDKFTTLCVTGAPGNCKPWSLRV,./data/raw/alphafold//AF-P80457-F1-model_v4.pdb,1051,4687,2080,4941
+1036,18236,18496,MLDDRARMEAAKKEKVEQILAEFQLQEEDLKKVMRRMQKEMDRGLRLETHEEASVKMLPTYVRSTPEGSEVGDFLSLDLGGTNFRVMLVKVGEGEEGQWSVKTKHQMYSIPEDAMTGTAEMLFDYISECISDFLDKHQMKHKKLPLGFTFSFPVRHEDIDKGILLNWTKGFKASGAEGNNVVGLLRDAIKRRGDFEMDVVAMVNDTVATMISCYYEDHQCEVGMIVGTGCNACYMEEMQNVELVEGDEGRMCVNTEWGAFGDSGELDEFLLEYDRLVDESSANPGQQLYEKLIGGKYMGELVRLVLLRLVDENLLFHGEASEQLRTRGAFETRFVSQVESDTGDRKQIYNILSTLGLRPSTTDCDIVRRACESVSTRAAHMCSAGLAGVINRMRESRSEDVMRITVGVDGSVYKLHPSFKERFHASVRRLTPSCEITFIESEEGSGRGAALVSAVACKKACMLGQ,sabio,P35557,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.OCC1OC(O)(CO)C(O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)(CO)C(O)C1O,116.9,8.264070734796279e-15,30.0,7.5,2.7.1.2,9606.0,2.06781451116184,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.OCC1OC(O)(CO)C(O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)(CO)C(O)C1O,2.069668096911596,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.OCC1OC(O)(CO)C(O)C1O__MLDDRARMEAAKKEKVEQILAEFQLQEEDLKKVMRRMQKEMDRGLRLETHEEASVKMLPTYVRSTPEGSEVGDFLSLDLGGTNFRVMLVKVGEGEEGQWSVKTKHQMYSIPEDAMTGTAEMLFDYISECISDFLDKHQMKHKKLPLGFTFSFPVRHEDIDKGILLNWTKGFKASGAEGNNVVGLLRDAIKRRGDFEMDVVAMVNDTVATMISCYYEDHQCEVGMIVGTGCNACYMEEMQNVELVEGDEGRMCVNTEWGAFGDSGELDEFLLEYDRLVDESSANPGQQLYEKLIGGKYMGELVRLVLLRLVDENLLFHGEASEQLRTRGAFETRFVSQVESDTGDRKQIYNILSTLGLRPSTTDCDIVRRACESVSTRAAHMCSAGLAGVINRMRESRSEDVMRITVGVDGSVYKLHPSFKERFHASVRRLTPSCEITFIESEEGSGRGAALVSAVACKKACMLGQ,./data/raw/alphafold//AF-P35557-F1-model_v4.pdb,63,2538,2830,3996
+1037,3707,3757,MSPGLLLLGSAVLLAFGLCCTFVHRARSRYEHIPGPPRPSFLLGHLPCFWKKDEVGGRVLQDVFLDWAKKYGPVVRVNVFHKTSVIVTSPESVKKFLMSTKYNKDSKMYRALQTVFGERLFGQGLVSECNYERWHKQRRVIDLAFSRSSLVSLMETFNEKAEQLVEILEAKADGQTPVSMQDMLTYTAMDILAKAAFGMETSMLLGAQKPLSQAVKLMLEGITASRNTLAKFLPGKRKQLREVRESIRFLRQVGRDWVQRRREALKRGEEVPADILTQILKAEEGAQDDEGLLDNFVTFFIAGHETSANHLAFTVMELSRQPEIVARLQAEVDEVIGSKRYLDFEDLGRLQYLSQVLKESLRLYPPAWGTFRLLEEETLIDGVRVPGNTPLLFSTYVMGRMDTYFEDPLTFNPDRFGPGAPKPRFTYFPFSLGHRSCIGQQFAQMEVKVVMAKLLQRLEFRLVPGQRFGLQEQATLKPLDPVLCTLRPRGWQPAPPPPPC,brenda,Q9Y6A2,CC(C)CCCC(C)[C@H]1CCC2C3CC=C4C[C@@H](OS(=O)(=O)O)CC[C@]4(C)C3C[C@@H](C)C21.O=O.[H+]>>CC(C)[C@@H](O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](OS(=O)(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C.O,0.0076,10000000.0,37.0,7.2,1.14.14.25,9606.0,-2.1191864077192086,CC(C)CCCC(C)[C@H]1CCC2C3CC=C4C[C@@H](OS(=O)(=O)O)CC[C@]4(C)C3C[C@@H](C)C21.O=O.[H+],CC(C)[C@@H](O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](OS(=O)(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C.O,-2.1191864077192086,CC(C)CCCC(C)[C@H]1CCC2C3CC=C4C[C@@H](OS(=O)(=O)O)CC[C@]4(C)C3C[C@@H](C)C21.O=O.[H+]__MSPGLLLLGSAVLLAFGLCCTFVHRARSRYEHIPGPPRPSFLLGHLPCFWKKDEVGGRVLQDVFLDWAKKYGPVVRVNVFHKTSVIVTSPESVKKFLMSTKYNKDSKMYRALQTVFGERLFGQGLVSECNYERWHKQRRVIDLAFSRSSLVSLMETFNEKAEQLVEILEAKADGQTPVSMQDMLTYTAMDILAKAAFGMETSMLLGAQKPLSQAVKLMLEGITASRNTLAKFLPGKRKQLREVRESIRFLRQVGRDWVQRRREALKRGEEVPADILTQILKAEEGAQDDEGLLDNFVTFFIAGHETSANHLAFTVMELSRQPEIVARLQAEVDEVIGSKRYLDFEDLGRLQYLSQVLKESLRLYPPAWGTFRLLEEETLIDGVRVPGNTPLLFSTYVMGRMDTYFEDPLTFNPDRFGPGAPKPRFTYFPFSLGHRSCIGQQFAQMEVKVVMAKLLQRLEFRLVPGQRFGLQEQATLKPLDPVLCTLRPRGWQPAPPPPPC,./data/raw/alphafold//AF-Q9Y6A2-F1-model_v4.pdb,1824,1507,3081,1841
+1038,19084,19370,MSTPRQILAAIFDMDGLLIDSEPLWDRAELDVMASLGVDISRRNELPDTLGLRIDMVVDLWYARQPWNGPSRQEVVERVIARAISLVEETRPLLPGVREAVALCKEQGLLVGLASASPLHMLEKVLTMFDLRDSFDALASAEKLPYSKPHPQVYLDCAAKLGVDPLTCVALEDSVNGMIASKAARMRSIVVPAPEAQNDPRFVLANVKLSSLTELTAKDLLG,uniprot_search,C3T7L2,O.O=C(CO)[C@H](O)[C@@H](O)[C@H](O)COP(=O)(O)O>>O=P(O)(O)O.OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO,21.0,0.3604402520221264,30.0,7.0,3.1.3.50,562.0,1.3222192947339193,O.O=C(CO)[C@H](O)[C@@H](O)[C@H](O)COP(=O)(O)O,O=P(O)(O)O.OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO,1.7993405494535817,O.O=C(CO)[C@H](O)[C@@H](O)[C@H](O)COP(=O)(O)O__MSTPRQILAAIFDMDGLLIDSEPLWDRAELDVMASLGVDISRRNELPDTLGLRIDMVVDLWYARQPWNGPSRQEVVERVIARAISLVEETRPLLPGVREAVALCKEQGLLVGLASASPLHMLEKVLTMFDLRDSFDALASAEKLPYSKPHPQVYLDCAAKLGVDPLTCVALEDSVNGMIASKAARMRSIVVPAPEAQNDPRFVLANVKLSSLTELTAKDLLG,./data/raw/alphafold//AF-C3T7L2-F1-model_v4.pdb,236,2757,5070,5930
+1039,14232,14422,MTPNPSLVLNKVNDITFETLEAPTLLEPNEVMVEVKKTGICGSDIHYYSHGKIGDFVLTQPMVLGHESAGVVTAVGPKVTSLKVGDRVAIEPGVPSRFSDEYKSGHYQLCPHIVFAATPDPKHGSPSPPGTLCKYYKSPEDFLVKLPDCVSLELGAMVEPLSVGVHGCRQAKVTFGDVVVVFGGGPVGLLAAAAATKFGAAKVMVVDVIDDKLKMALEVGVATHTFNSKSGGADDLVKELGERPDVVIECTGAEVCINLGIESLKMGGRFSQVGNATRPVSFPIVAFSSRELTLYGSFRYGYNDYKTSVAILEHNYRNGRENAAIDFEKLITHRFKFEDAKKAYDYIRDGNVAVKVIIDGPE,brenda,A0A1B4XTS0,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.OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O.[H+],8.28,6.71027598078266e-15,30.0,7.0,1.1.1.12,66948.0,0.91803033678488,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.OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O.[H+],0.91803033678488,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.OC[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO__MTPNPSLVLNKVNDITFETLEAPTLLEPNEVMVEVKKTGICGSDIHYYSHGKIGDFVLTQPMVLGHESAGVVTAVGPKVTSLKVGDRVAIEPGVPSRFSDEYKSGHYQLCPHIVFAATPDPKHGSPSPPGTLCKYYKSPEDFLVKLPDCVSLELGAMVEPLSVGVHGCRQAKVTFGDVVVVFGGGPVGLLAAAAATKFGAAKVMVVDVIDDKLKMALEVGVATHTFNSKSGGADDLVKELGERPDVVIECTGAEVCINLGIESLKMGGRFSQVGNATRPVSFPIVAFSSRELTLYGSFRYGYNDYKTSVAILEHNYRNGRENAAIDFEKLITHRFKFEDAKKAYDYIRDGNVAVKVIIDGPE,./data/raw/alphafold//AF-A0A1B4XTS0-F1-model_v4.pdb,2358,4725,4770,4609
+1040,10914,11069,MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,uniprot_search,P24155,C[C@H](N=C(O)[C@H](C)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)O)cc1>>C[C@H](N)C(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)O)cc1.O=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1,8.6,1.2101690474830884,37.0,8.2,3.4.24.15,10116.0,0.9344984512435676,C[C@H](N=C(O)[C@H](C)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)O)cc1,C[C@H](N)C(O)=N[C@@H](C)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)O)cc1.O=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1,0.9344984512435676,C[C@H](N=C(O)[C@H](C)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)O)cc1__MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,./data/raw/alphafold//AF-P24155-F1-model_v4.pdb,1820,1500,3134,1830
+1041,6019,6113,MEEVVIAGMSGKLPESENLQEFWDNLIGGVDMVTDDDRRWKAGLYGLPRRSGKLKDLSRFDASFFGVHPKQAHTMDPQLRLLLEVTYEAIVDGGINPDSLRGTHTGVWVGVSGSETSEALSRDPETLVGYSMVGCQRAMMANRLSFFFDFRGPSIALDTACSSSLMALQNAYQAIHSGQCPAAIVGGINVLLKPNTSVQFLRLGMLSPEGTCKAFDTAGNGYCRSEGVVAVLLTKKSLARRVYATILNAGTNTDGFKEQGVTFPSGDIQEQLIRSLYQSAGVAPESFEYIEAHGTGTKVGDPQELNGITRALCATRQEPLLIGSTKSNMGHPEPASGLAALAKVLLSLEHGLWAPNLHFHSPNPEIPALLDGRLQVVDQPLPVRGGNVGINSFGFGGSNVHIILRPNTQPPPAPAPHATLPRLLRASGRTPEAVQKLLEQGLRHSQDLAFLSMLNDIAAVPATAMPFRGYAVLGGERGGPEVQQVPAGERPLWFICSGMGTQWRGMGLSLMRLDRFRDSILRSDEAVKPFGLKVSQLLLSTDESTFDDIVHSFVSLTAIQIGLIDLLSCMGLRPDGIVGHSLGEVACGYADGCLSQEEAVLAAYWRGQCIKEAHLPPGAMAAVGLSWEECKQRCPPGVVPACHNSKDTVTISGPQAPVFEFVEQLRKEGVFAKEVRTGGMAFHSYFMEAIAPPLLQELKKVIREPKPRSARWLSTSIPEAQWHSSLARTSSAEYNVNNLVSPVLFQEALWHVPEHAVVLEIAPHALLQAVLKRGLKPSCTIIPLMKKDHRDNLEFFLAGIGRLHLSGIDANPNALFPPVEFPAPRGTPLISPLIKWDHSLAWDVPAAEDFPNGSGSPSAAIYNIDTSSESPDHYLVDHTLDGRVLFPATGYLSIVWKTLARALGLGVEQLPVVFEDVVLHQATILPKTGTVSLEVRLLEASRAFEVSENGNLVVSGKVYQWDDPDPRLFDHPESPTPNPTEPLFLAQAEVYKELRLRGYDYGPHFQGILEASLEGDSGRLLWKDNWVSFMDTMLQMSILGSAKHGLYLPTRVTAIHIDPATHRQKLYTLQDKAQVADVVVSRWLRVTVAGGVHISGLHTESAPRRQQEQQVPILEKFCFTPHTEEGCLSERAALQEELQLCKGLVQALQTKVTQQGLKMVVPGLDGAQIPRDPSQQELPRLLSAACRLQLNGNLQLELAQVLAQERPKLPEDPLLSGLLDSPALKACLDTAVENMPSLKMKVVEVLAGHGHLYSRIPGLLSPHPLLQLSYTATDRHPQALEAAQAELQQHDVAQGQWDPADPAPSALGSADLLVCNCAVAALGDPASALSNMVAALREGGFLLLHTLLRGHPLGDIVAFLTSTEPQYGQGILSQDAWESLFSRVSLRLVGLKKSFYGSTLFLCRRPTPQDSPIFLPVDDTSFRWVESLKGILADEDSSRPVWLKAINCATSGVVGLVNCLRREPGGNRLRCVLLSNLSSTSHVPEVDPGSAELQKVLQGDLVMNVYRDGAWGAFRHFLLEEDKPEEPTAHAFVSTLTRGDLSSIRWVCSSLRHAQPTCPGAQLCTVYYASLNFRDIMLATGKLSPDAIPGKWTSQDSLLGMEFSGRDASGKRVMGLVPAKGLATSVLLSPDFLWDVPSNWTLEEAASVPVVYSTAYYALVVRGRVRPGETLLIHSGSGGVGQAAIAIALSLGCRVFTTVGSAEKRAYLQARFPQLDSTSFANSRDTSFEQHVLWHTGGKGVDLVLNSLAEEKLQASVRCLATHGRFLEIGKFDLSQNHPLGMAIFLKNVTFHGVLLDAFFNESSADWREVWALVQAGIRDGVVRPLKCTVFHGAQVEDAFRYMAQGKHIGKVVVQVLAEEPEAVLKGAKPKLMSAISKTFCPAHKSYIIAGGLGGFGLELAQWLIQRGVQKLVLTSRSGIRTGYQAKQVRRWRRQGVQVQVSTSNISSLEGARGLIAEAAQLGPVGGVFNLAVVLRDGLLENQTPEFFQDVCKPKYSGTLNLDRVTREACPELDYFVVFSSVSCGRGNAGQSNYGFANSAMERICEKRRHEGLPGLAVQWGAIGDVGILVETMSTNDTIVSGTLPQRMASCLEVLDLFLNQPHMVLSSFVLAEKAAAYRDRDSQRDLVEAVAHILGIRDLAAVNLDSSLADLGLDSLMSVEVRQTLERELNLVLSVREVRQLTLRKLQELSSKADEASELACPTPKEDGLAQQQTQLNLRSLLVNPEGPTLMRLNSVQSSERPLFLVHPIEGSTTVFHSLASRLSIPTYGLQCTRAAPLDSIHSLAAYYIDCIRQVQPEGPYRVAGYSYGACVAFEMCSQLQAQQSPAPTHNSLFLFDGSPTYVLAYTQSYRAKLTPGCEAEAETEAICFFVQQFTDMEHNRVLEALLPLKGLEERVAAAVDLIIKSHQGLDRQELSFAARSFYYKLRAAEQYTPKAKYHGNVMLLRAKTGGAYGEDLGADYNLSQVCDGKVSVHVIEGDHRTLLEGSGLESIISIIHSSLAEPRVSVREG,sabio,P49327,CC=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.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>>CCCC(=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.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,1200.0,0.0318575008928329,25.0,7.0,1.3.1.10,9606.0,3.0791812460476247,CC=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.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,CCCC(=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.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,3.0791812460476247,CC=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.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__MEEVVIAGMSGKLPESENLQEFWDNLIGGVDMVTDDDRRWKAGLYGLPRRSGKLKDLSRFDASFFGVHPKQAHTMDPQLRLLLEVTYEAIVDGGINPDSLRGTHTGVWVGVSGSETSEALSRDPETLVGYSMVGCQRAMMANRLSFFFDFRGPSIALDTACSSSLMALQNAYQAIHSGQCPAAIVGGINVLLKPNTSVQFLRLGMLSPEGTCKAFDTAGNGYCRSEGVVAVLLTKKSLARRVYATILNAGTNTDGFKEQGVTFPSGDIQEQLIRSLYQSAGVAPESFEYIEAHGTGTKVGDPQELNGITRALCATRQEPLLIGSTKSNMGHPEPASGLAALAKVLLSLEHGLWAPNLHFHSPNPEIPALLDGRLQVVDQPLPVRGGNVGINSFGFGGSNVHIILRPNTQPPPAPAPHATLPRLLRASGRTPEAVQKLLEQGLRHSQDLAFLSMLNDIAAVPATAMPFRGYAVLGGERGGPEVQQVPAGERPLWFICSGMGTQWRGMGLSLMRLDRFRDSILRSDEAVKPFGLKVSQLLLSTDESTFDDIVHSFVSLTAIQIGLIDLLSCMGLRPDGIVGHSLGEVACGYADGCLSQEEAVLAAYWRGQCIKEAHLPPGAMAAVGLSWEECKQRCPPGVVPACHNSKDTVTISGPQAPVFEFVEQLRKEGVFAKEVRTGGMAFHSYFMEAIAPPLLQELKKVIREPKPRSARWLSTSIPEAQWHSSLARTSSAEYNVNNLVSPVLFQEALWHVPEHAVVLEIAPHALLQAVLKRGLKPSCTIIPLMKKDHRDNLEFFLAGIGRLHLSGIDANPNALFPPVEFPAPRGTPLISPLIKWDHSLAWDVPAAEDFPNGSGSPSAAIYNIDTSSESPDHYLVDHTLDGRVLFPATGYLSIVWKTLARALGLGVEQLPVVFEDVVLHQATILPKTGTVSLEVRLLEASRAFEVSENGNLVVSGKVYQWDDPDPRLFDHPESPTPNPTEPLFLAQAEVYKELRLRGYDYGPHFQGILEASLEGDSGRLLWKDNWVSFMDTMLQMSILGSAKHGLYLPTRVTAIHIDPATHRQKLYTLQDKAQVADVVVSRWLRVTVAGGVHISGLHTESAPRRQQEQQVPILEKFCFTPHTEEGCLSERAALQEELQLCKGLVQALQTKVTQQGLKMVVPGLDGAQIPRDPSQQELPRLLSAACRLQLNGNLQLELAQVLAQERPKLPEDPLLSGLLDSPALKACLDTAVENMPSLKMKVVEVLAGHGHLYSRIPGLLSPHPLLQLSYTATDRHPQALEAAQAELQQHDVAQGQWDPADPAPSALGSADLLVCNCAVAALGDPASALSNMVAALREGGFLLLHTLLRGHPLGDIVAFLTSTEPQYGQGILSQDAWESLFSRVSLRLVGLKKSFYGSTLFLCRRPTPQDSPIFLPVDDTSFRWVESLKGILADEDSSRPVWLKAINCATSGVVGLVNCLRREPGGNRLRCVLLSNLSSTSHVPEVDPGSAELQKVLQGDLVMNVYRDGAWGAFRHFLLEEDKPEEPTAHAFVSTLTRGDLSSIRWVCSSLRHAQPTCPGAQLCTVYYASLNFRDIMLATGKLSPDAIPGKWTSQDSLLGMEFSGRDASGKRVMGLVPAKGLATSVLLSPDFLWDVPSNWTLEEAASVPVVYSTAYYALVVRGRVRPGETLLIHSGSGGVGQAAIAIALSLGCRVFTTVGSAEKRAYLQARFPQLDSTSFANSRDTSFEQHVLWHTGGKGVDLVLNSLAEEKLQASVRCLATHGRFLEIGKFDLSQNHPLGMAIFLKNVTFHGVLLDAFFNESSADWREVWALVQAGIRDGVVRPLKCTVFHGAQVEDAFRYMAQGKHIGKVVVQVLAEEPEAVLKGAKPKLMSAISKTFCPAHKSYIIAGGLGGFGLELAQWLIQRGVQKLVLTSRSGIRTGYQAKQVRRWRRQGVQVQVSTSNISSLEGARGLIAEAAQLGPVGGVFNLAVVLRDGLLENQTPEFFQDVCKPKYSGTLNLDRVTREACPELDYFVVFSSVSCGRGNAGQSNYGFANSAMERICEKRRHEGLPGLAVQWGAIGDVGILVETMSTNDTIVSGTLPQRMASCLEVLDLFLNQPHMVLSSFVLAEKAAAYRDRDSQRDLVEAVAHILGIRDLAAVNLDSSLADLGLDSLMSVEVRQTLERELNLVLSVREVRQLTLRKLQELSSKADEASELACPTPKEDGLAQQQTQLNLRSLLVNPEGPTLMRLNSVQSSERPLFLVHPIEGSTTVFHSLASRLSIPTYGLQCTRAAPLDSIHSLAAYYIDCIRQVQPEGPYRVAGYSYGACVAFEMCSQLQAQQSPAPTHNSLFLFDGSPTYVLAYTQSYRAKLTPGCEAEAETEAICFFVQQFTDMEHNRVLEALLPLKGLEERVAAAVDLIIKSHQGLDRQELSFAARSFYYKLRAAEQYTPKAKYHGNVMLLRAKTGGAYGEDLGADYNLSQVCDGKVSVHVIEGDHRTLLEGSGLESIISIIHSSLAEPRVSVREG,./data/raw/alphafold//AF-P49327-F1-model_v4.pdb,1366,865,661,950
+1042,8811,8950,MRLPNLTLLVWAATSVGLVSALPQVSYKADATASAPTVKLHQGTVRGLADDNYGLEQFFGIPYAKPPVGSLRFAKPQPLGPASSHKTVIDATRFGDICMQTVAPSPLYNMSEDCLNLNVVRPKGTTAKDKLPVLVWIYGGAFRQGSTPIYNASELVQKSVEIGKPIVFVAISYRVGPFGFIGGSEIADSDSATSNAGLYDQRLGLKWIRHNIGKFGGDKNRVTLFGQSAGAMSIALQNFAYDGNNHGLWHAAIMNSGGIAPGPLLTPKHPTVEQSFKRLANGVGCTGGSLLRCLRKANASEVQTVASNLTAQAGGTFPIPGALAWLPLVDYELITNYPSVNLPQGKLADIPVIQGNALDEGTSFAQKQLNSSADFERWVRSAAVIHNTSYTEQALQKVFELYPDVPEQGSPFYNAETATSAATTSDLNSRQYPPLTSNQYKRSAAFFGDFTFQAQRRTYLKAATLGWKKNKAKVWSYEFQQNDKFANGTGSLLGPYHGADVKYYFIRPDGRQKDPVLADRMPRAYISFVYHHDPTVLGGFEWPPYGKGKKLLQMKGDNTTVIEDAYRKEAMDALTNRKAAKVFGF,brenda,A0A060S684,COC(=O)/C=C/c1ccc(O)c(O)c1.O>>CO.O=C(O)/C=C/c1ccc(O)c(O)c1,1.9,6.681141468635319e-15,37.0,7.5,3.1.1.42,5270.0,0.2787536009528289,COC(=O)/C=C/c1ccc(O)c(O)c1.O,CO.O=C(O)/C=C/c1ccc(O)c(O)c1,0.2787536009528289,COC(=O)/C=C/c1ccc(O)c(O)c1.O__MRLPNLTLLVWAATSVGLVSALPQVSYKADATASAPTVKLHQGTVRGLADDNYGLEQFFGIPYAKPPVGSLRFAKPQPLGPASSHKTVIDATRFGDICMQTVAPSPLYNMSEDCLNLNVVRPKGTTAKDKLPVLVWIYGGAFRQGSTPIYNASELVQKSVEIGKPIVFVAISYRVGPFGFIGGSEIADSDSATSNAGLYDQRLGLKWIRHNIGKFGGDKNRVTLFGQSAGAMSIALQNFAYDGNNHGLWHAAIMNSGGIAPGPLLTPKHPTVEQSFKRLANGVGCTGGSLLRCLRKANASEVQTVASNLTAQAGGTFPIPGALAWLPLVDYELITNYPSVNLPQGKLADIPVIQGNALDEGTSFAQKQLNSSADFERWVRSAAVIHNTSYTEQALQKVFELYPDVPEQGSPFYNAETATSAATTSDLNSRQYPPLTSNQYKRSAAFFGDFTFQAQRRTYLKAATLGWKKNKAKVWSYEFQQNDKFANGTGSLLGPYHGADVKYYFIRPDGRQKDPVLADRMPRAYISFVYHHDPTVLGGFEWPPYGKGKKLLQMKGDNTTVIEDAYRKEAMDALTNRKAAKVFGF,./data/raw/alphafold//AF-A0A060S684-F1-model_v4.pdb,3500,3420,1158,3077
+1043,19722,20008,MKTYKGYLIDLDGTMYNGTEKIEEACEFVRTLKDRGVPYLFVTNNSSRTPKQVADKLVSFDIPATEEQVFTTSMATAQHIAQQKKDASVYVIGEEGIRQAIEENGLTFGGENADFVVVGIDRSITYEKFAVGCLAIRNGARFISTNGDIAIPTERGLLPGNGSLTSVLTVSTGVQPVFIGKPESIIMEQAMRVLGTDVSETLMVGDNYATDIMAGINAGMDTLLVHTGVTKREHMTDDMEKPTHAIDSLTEWIPYI,brenda,O32125,O.O=P(O)(O)OC[C@H]1O[C@@H](OP(=O)(O)OP(=O)(O)O)C(O)[C@H]1O>>,0.17,99.75555023198282,25.0,8.9,3.1.3.5,1423.0,-0.7695510786217261,O.O=P(O)(O)OC[C@H]1O[C@@H](OP(=O)(O)OP(=O)(O)O)C(O)[C@H]1O,,-0.7695510786217261,O.O=P(O)(O)OC[C@H]1O[C@@H](OP(=O)(O)OP(=O)(O)O)C(O)[C@H]1O__MKTYKGYLIDLDGTMYNGTEKIEEACEFVRTLKDRGVPYLFVTNNSSRTPKQVADKLVSFDIPATEEQVFTTSMATAQHIAQQKKDASVYVIGEEGIRQAIEENGLTFGGENADFVVVGIDRSITYEKFAVGCLAIRNGARFISTNGDIAIPTERGLLPGNGSLTSVLTVSTGVQPVFIGKPESIIMEQAMRVLGTDVSETLMVGDNYATDIMAGINAGMDTLLVHTGVTKREHMTDDMEKPTHAIDSLTEWIPYI,./data/raw/alphafold//AF-O32125-F1-model_v4.pdb,2487,4918,4991,4845
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+1050,3352,3400,MEKITFPNLYCPFPERKNQYFEVLQDYALQWVLRFKLIDSESLYQRFSKAKFYLLTAGAYPHCQLEELKIANDVISWLFIWDDQCDISDLGKKPELLKIWCNRFLEILNGAELTADDLPLGFALRDIRNRIINRGSITFFHHFVRNFEDYFYGCIEEAHNRVTVSIPDVEAYIKIRSANAAAALCLNLIEFCDRVMIPYSLRNHDTLNKLTQMTINILAWSNDIFSAPREIANGEVHNLVFVIHHHQKIPLEKAMLAAAAMHNQEVENLVKLESQITYFSAEIDAEITKYISGLHAWIRGNLDWYAHSGRYQITEKLELMAS,sabio,Q8YN85,CC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)O>>C=C(C)[C@@H]1C/C=C(\C)CC/C=C(\C)CC1.O=P(O)(O)OP(=O)(O)O,0.053,7.424107157329369e-15,30.0,8.0,4.2.3.-,1180.0,-1.275724130399211,CC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)O,C=C(C)[C@@H]1C/C=C(\C)CC/C=C(\C)CC1.O=P(O)(O)OP(=O)(O)O,-1.275724130399211,CC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)O__MEKITFPNLYCPFPERKNQYFEVLQDYALQWVLRFKLIDSESLYQRFSKAKFYLLTAGAYPHCQLEELKIANDVISWLFIWDDQCDISDLGKKPELLKIWCNRFLEILNGAELTADDLPLGFALRDIRNRIINRGSITFFHHFVRNFEDYFYGCIEEAHNRVTVSIPDVEAYIKIRSANAAAALCLNLIEFCDRVMIPYSLRNHDTLNKLTQMTINILAWSNDIFSAPREIANGEVHNLVFVIHHHQKIPLEKAMLAAAAMHNQEVENLVKLESQITYFSAEIDAEITKYISGLHAWIRGNLDWYAHSGRYQITEKLELMAS,./data/raw/alphafold//AF-Q8YN85-F1-model_v4.pdb,1764,1428,2477,1734
+1051,17639,17881,MSIVNESGSQPVVSRDETLSQIERTSFHISSGKDISLEEIARAARDHQPVTLHDEVVNRVTRSRSILESMVSDERVIYGVNTSMGGFVNYIVPIAKASELQNNLINAVATNVGKYFDDTTVRATMLARIVSLSRGNSAISIVNFKKLIEIYNQGIVPCIPEKGSLGTSGDLGPLAAIALVCTGQWKARYQGEQMSGAMALEKAGISPMELSFKEGLALINGTSAMVGLGVLLYDEVKRLFDTYLTVTSLSIEGLHGKTKPFEPAVHRMKPHQGQLEVATTIWETLADSSLAVNEHEVEKLIAEEMDGLVKASNHQIEDAYSIRCTPQILGPVADTLKNIKQTLTNELNSSNDNPLIDQTTEEVFHNGHFHGQYVSMAMDHLNIALVTMMNLANRRIDRFMDKSNSNGLPPFLCAENAGLRLGLMGGQFMTASITAESRASCMPMSIQSLSTTGDFQDIVSFGLVAARRVREQLKNLKYVFSFELLCACQAVDIRGTAGLSKRTRALYDKTRTLVPYLEEDKTISDYIESIAQTVLTKNSDI,brenda,Q84FL5,N[C@H](CC(=O)O)c1ccccc1>>N[C@@H](Cc1ccccc1)C(=O)O,0.059,8.576669190547531e-15,32.0,8.0,5.4.3.11,549.0,-1.2291479883578558,N[C@H](CC(=O)O)c1ccccc1,N[C@@H](Cc1ccccc1)C(=O)O,-1.2291479883578558,N[C@H](CC(=O)O)c1ccccc1__MSIVNESGSQPVVSRDETLSQIERTSFHISSGKDISLEEIARAARDHQPVTLHDEVVNRVTRSRSILESMVSDERVIYGVNTSMGGFVNYIVPIAKASELQNNLINAVATNVGKYFDDTTVRATMLARIVSLSRGNSAISIVNFKKLIEIYNQGIVPCIPEKGSLGTSGDLGPLAAIALVCTGQWKARYQGEQMSGAMALEKAGISPMELSFKEGLALINGTSAMVGLGVLLYDEVKRLFDTYLTVTSLSIEGLHGKTKPFEPAVHRMKPHQGQLEVATTIWETLADSSLAVNEHEVEKLIAEEMDGLVKASNHQIEDAYSIRCTPQILGPVADTLKNIKQTLTNELNSSNDNPLIDQTTEEVFHNGHFHGQYVSMAMDHLNIALVTMMNLANRRIDRFMDKSNSNGLPPFLCAENAGLRLGLMGGQFMTASITAESRASCMPMSIQSLSTTGDFQDIVSFGLVAARRVREQLKNLKYVFSFELLCACQAVDIRGTAGLSKRTRALYDKTRTLVPYLEEDKTISDYIESIAQTVLTKNSDI,./data/raw/alphafold//AF-Q84FL5-F1-model_v4.pdb,2803,2376,1300,3251
+1052,21330,21654,MNTLIGKTGIVVRNIQRAELDSIDALGRLGVATVHEAQNRKGLLSSKMRPIQQGTSLAGSAVTVLVAPGDNWMFHVAVEQCRPGDVLVVSPSSPCTDGYFGDLLATSLQARGVRALIVDAGVRDTQTLRDMGFAVWARAINAQGTVKETLGSVNLPVICGGQLINPGDIVVADDDGVVVVRRDECESTLVAAAERAGLEEEKRLRLAAGELGLDIYKMRERLEAKGLRYVDNIEDLEG,sabio,A5W059,O=C(O)CC(=O)C(=O)O>>CC(=O)C(=O)O.O=C=O,1.52,1.0719429373846476e-14,25.0,8.0,4.1.3.17,303.0,0.1818435879447725,O=C(O)CC(=O)C(=O)O,CC(=O)C(=O)O.O=C=O,0.2671717284030138,O=C(O)CC(=O)C(=O)O__MNTLIGKTGIVVRNIQRAELDSIDALGRLGVATVHEAQNRKGLLSSKMRPIQQGTSLAGSAVTVLVAPGDNWMFHVAVEQCRPGDVLVVSPSSPCTDGYFGDLLATSLQARGVRALIVDAGVRDTQTLRDMGFAVWARAINAQGTVKETLGSVNLPVICGGQLINPGDIVVADDDGVVVVRRDECESTLVAAAERAGLEEEKRLRLAAGELGLDIYKMRERLEAKGLRYVDNIEDLEG,./data/raw/alphafold//AF-A5W059-F1-model_v4.pdb,1309,3866,6182,834
+1053,12977,13149,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](CO)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>N=C(N)NCCC[C@H](N=C(O)[C@@H](N)Cc1ccccc1)C(O)=N[C@@H](CO)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].Nc1ccccc1C(O)=NCC(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O,4.3,3.9795934786484615e-14,37.0,7.4,3.4.24.15,10116.0,0.6334684555795865,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](CO)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,N=C(N)NCCC[C@H](N=C(O)[C@@H](N)Cc1ccccc1)C(O)=N[C@@H](CO)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].Nc1ccccc1C(O)=NCC(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O,0.6334684555795865,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](CO)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,./data/raw/alphafold//AF-P24155-F1-model_v4.pdb,1820,1500,3134,1830
+1054,21833,22158,MPSSGDAAGRRPHVVLIPSAGMGHLVPFGRLAVALSSGHGCDVSLVTVLPTVSTAESKHLDALFDAFPAVRRLDFELAPFDASEFPGADPFFLRFEAMRRSAPLLGPLLTGAGASALATDIALTSVVIPVAKEQGLPCHILFTASAAMLSLCAYFPTYLDANAGGGGGVGDVDIPGVYRIPKASIPQALHDPNHLFTRQFVANGRSLTSAAGILVNTFDALEPEAVAALQQGKVASGFPPVFAVGPLLPASNQAKDPQANYMEWLDAQPARSVVYVSFGSRKAISREQLRELAAGLEGSGHRFLWVVKSTVVDRDDAAELGELLDEGFLERVEKRGLVTKAWVDQEEVLKHESVALFVSHCGWNSVTEAAASGVPVLALPRFGDQRVNSGVVARAGLGVWADTWSWEGEAGVIGAEEISEKVKAAMADEALRMKAASLAEAAAKAVAGGGSSHRCLAEFARLCQGGTCRTN,brenda,C3W7B0,O=C1CC(O)(c2ccccc2)Oc2cc(O)cc(O)c21.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>>O.O=c1cc(-c2ccccc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.76,6.7746709835086505e-15,25.0,7.8,2.4.1.360,39946.0,-0.1191864077192086,O=C1CC(O)(c2ccccc2)Oc2cc(O)cc(O)c21.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,O.O=c1cc(-c2ccccc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-0.1191864077192086,O=C1CC(O)(c2ccccc2)Oc2cc(O)cc(O)c21.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__MPSSGDAAGRRPHVVLIPSAGMGHLVPFGRLAVALSSGHGCDVSLVTVLPTVSTAESKHLDALFDAFPAVRRLDFELAPFDASEFPGADPFFLRFEAMRRSAPLLGPLLTGAGASALATDIALTSVVIPVAKEQGLPCHILFTASAAMLSLCAYFPTYLDANAGGGGGVGDVDIPGVYRIPKASIPQALHDPNHLFTRQFVANGRSLTSAAGILVNTFDALEPEAVAALQQGKVASGFPPVFAVGPLLPASNQAKDPQANYMEWLDAQPARSVVYVSFGSRKAISREQLRELAAGLEGSGHRFLWVVKSTVVDRDDAAELGELLDEGFLERVEKRGLVTKAWVDQEEVLKHESVALFVSHCGWNSVTEAAASGVPVLALPRFGDQRVNSGVVARAGLGVWADTWSWEGEAGVIGAEEISEKVKAAMADEALRMKAASLAEAAAKAVAGGGSSHRCLAEFARLCQGGTCRTN,./data/raw/alphafold//AF-C3W7B0-F1-model_v4.pdb,546,3245,5550,6435
+1055,3708,3758,MKKLIISLLQDILPMTIFDKFDSIFTQVEQLWHRLPTPLALIKLLTFRNELREKNLHDTSQLPDKHLLPQPTPDPQGHHLTARTADGSFNDLEHPEMGMAGTRFGRNIPLTAIQPETPQQLMTPNPRVVSRTLMTREDFKPATILNLLAAAWIQFENHDWFSHGDNKPEDKLEIPLEANDPWPEEYRPLEVGKTLPDTSRPEGAKPPTFINTVTHWWDGSQIYGSNPETVDQLRSHEDGKLIIGENGLLPVDPETGVDITGFNDNWWIGLGMLHTLFTREHNLICDHLKQEYSQWSDDDLFDHARLINAALMAKIHTVDWTPAILPLPATDIALNVNWNGFLGEDIKQVLGTVGEGEIADLLTGIIGSDKNHHTAPYYLTEEFVSVYRMHPLIPDELEFRSLEGDKFLQEVNFFEMSGKRTRALLESISLPDLFYSFGITHPGAITLHNYPRFLQQLVRDNGEVFDLAAVDILRDRERGVPRYNRFREIMGRGRVKCFEEISSNKQWVEEMRRVYNDNIDQVDLMVGLFAEDTPEGFGFSDTAFRVFILMASRRLKSDRFFTTDYRAEIYTQFGLDWIANNNMVSVLQRHFPQLSPVLYGVDNAFKPWRRVPS,brenda,B1WSS6,CC(C)CCCCCCCCCCCC(=O)O.O=O>>,3.14,99.63689311222544,25.0,7.5,1.13.11.92,2546360.0,0.4969296480732149,CC(C)CCCCCCCCCCCC(=O)O.O=O,,0.4969296480732149,CC(C)CCCCCCCCCCCC(=O)O.O=O__MKKLIISLLQDILPMTIFDKFDSIFTQVEQLWHRLPTPLALIKLLTFRNELREKNLHDTSQLPDKHLLPQPTPDPQGHHLTARTADGSFNDLEHPEMGMAGTRFGRNIPLTAIQPETPQQLMTPNPRVVSRTLMTREDFKPATILNLLAAAWIQFENHDWFSHGDNKPEDKLEIPLEANDPWPEEYRPLEVGKTLPDTSRPEGAKPPTFINTVTHWWDGSQIYGSNPETVDQLRSHEDGKLIIGENGLLPVDPETGVDITGFNDNWWIGLGMLHTLFTREHNLICDHLKQEYSQWSDDDLFDHARLINAALMAKIHTVDWTPAILPLPATDIALNVNWNGFLGEDIKQVLGTVGEGEIADLLTGIIGSDKNHHTAPYYLTEEFVSVYRMHPLIPDELEFRSLEGDKFLQEVNFFEMSGKRTRALLESISLPDLFYSFGITHPGAITLHNYPRFLQQLVRDNGEVFDLAAVDILRDRERGVPRYNRFREIMGRGRVKCFEEISSNKQWVEEMRRVYNDNIDQVDLMVGLFAEDTPEGFGFSDTAFRVFILMASRRLKSDRFFTTDYRAEIYTQFGLDWIANNNMVSVLQRHFPQLSPVLYGVDNAFKPWRRVPS,./data/raw/alphafold//AF-B1WSS6-F1-model_v4.pdb,1825,1508,3082,1842
+1056,16172,16399,MANEVIKCKAAVAWEAGKPLSIEEIEVAPPKAHEVRIKIIATAVCHTDAYTLSGADPEGCFPVILGHEGAGIVESVGEGVTKLKAGDTVIPLYIPQCGECKFCLNPKTNLCQKIRVTQGKGLMPDGTSRFTCKGKTILHYMGTSTFSEYTVVADISVAKIDPLAPLDKVCLLGCGISTGYGAAVNTAKLEPGSVCAVFGLGGVGLAVIMGCKVAGASRIIGVDINKDKFARAKEFGATECINPQDFSKPIQEVLIEMTDGGVDYSFECIGNVKVMRAALEACHKGWGVSVVVGVAASGEEIATRPFQLVTGRTWKGTAFGGWKSVESVPKLVSEYMSKKIKVDEFVTHNLSFDEINKAFELMHSGKSIRTVVKI,sabio,P11766,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.OCCCCCCCCO>>C(CCCC=O)CCC=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],12060.0,0.1244198676804557,25.0,10.0,1.1.1.1,9606.0,4.0813473078041325,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.OCCCCCCCCO,C(CCCC=O)CCC=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],4.0813473078041325,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.OCCCCCCCCO__MANEVIKCKAAVAWEAGKPLSIEEIEVAPPKAHEVRIKIIATAVCHTDAYTLSGADPEGCFPVILGHEGAGIVESVGEGVTKLKAGDTVIPLYIPQCGECKFCLNPKTNLCQKIRVTQGKGLMPDGTSRFTCKGKTILHYMGTSTFSEYTVVADISVAKIDPLAPLDKVCLLGCGISTGYGAAVNTAKLEPGSVCAVFGLGGVGLAVIMGCKVAGASRIIGVDINKDKFARAKEFGATECINPQDFSKPIQEVLIEMTDGGVDYSFECIGNVKVMRAALEACHKGWGVSVVVGVAASGEEIATRPFQLVTGRTWKGTAFGGWKSVESVPKLVSEYMSKKIKVDEFVTHNLSFDEINKAFELMHSGKSIRTVVKI,./data/raw/alphafold//AF-P11766-F1-model_v4.pdb,1323,2177,273,298
+1057,22013,22345,MKLNRRDFVRLAAMSVFAQPVLAALPSVEEARRFRLELRPEQRNWIPQSEMPVDLWGLSDSQLTLRQGEPVEIEVVNQLPEPTTLHWHGLRIENAMDGVSGLTQEPIPPGGTFTYRFTPEDAGTFWAHSHHKTYEQLARGLYLPVVVEEKIASDTDQDILMVIDDWRVNNEGQLDSESLGSLHEWAHGGRLGNFLTINKEVQPSFTVKAGSRVRLRLLNTANARIFAVDLPEVPAWILAKDGQPLANLMQVTETVVMAPAERYDLILDIPRDAEGQLSVTMPTDRAPIEMAYLQVEGLHESERVQSPDPLPANPIEEISPDQIPDHKLVLDMTGGAMGSMTQAVYNGQQMSMQELIQHRQIWAFNGVANRPLDPLLEARSGELVEIEIINNTGWAHGMHLHGHHFKADLARYNPDLWHDTLLMDSGESSRIRFIAGKPGSWLLHCHMIEHQAAGMVSWIKVIG,sabio,G8IJH7,O=O>>O.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+3].[K+].[K+].[K+],320.98,82.90748435281122,45.0,7.5,1.10.3.2,2725.0,2.506477972715658,O=O,O.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+3].[K+].[K+].[K+],2.506477972715658,O=O__MKLNRRDFVRLAAMSVFAQPVLAALPSVEEARRFRLELRPEQRNWIPQSEMPVDLWGLSDSQLTLRQGEPVEIEVVNQLPEPTTLHWHGLRIENAMDGVSGLTQEPIPPGGTFTYRFTPEDAGTFWAHSHHKTYEQLARGLYLPVVVEEKIASDTDQDILMVIDDWRVNNEGQLDSESLGSLHEWAHGGRLGNFLTINKEVQPSFTVKAGSRVRLRLLNTANARIFAVDLPEVPAWILAKDGQPLANLMQVTETVVMAPAERYDLILDIPRDAEGQLSVTMPTDRAPIEMAYLQVEGLHESERVQSPDPLPANPIEEISPDQIPDHKLVLDMTGGAMGSMTQAVYNGQQMSMQELIQHRQIWAFNGVANRPLDPLLEARSGELVEIEIINNTGWAHGMHLHGHHFKADLARYNPDLWHDTLLMDSGESSRIRFIAGKPGSWLLHCHMIEHQAAGMVSWIKVIG,./data/raw/alphafold//AF-G8IJH7-F1-model_v4.pdb,3546,3493,1255,3198
+1058,1928,1959,MSLNPDLAAYLQLVEAGRSAGKVLPMHALEADEARRQFEESSALIAGKADEPDCISDLSLTTRDGHTLPVRLYRPPQDDPALAGAALLYLHGGGYVVGSLDSHDTLCWNLAQDAGVPVIAVGYRLAPQWRFPTASDDALDAWRWLVEQAEALGIDAQRLAVVGDSVGGSLATILANQLAAQRELAAPRLQVMIYPVTDASCRRPSVQRYGSGYLLEAQTLEWFYQQYATVPADRLDPRFSPLLGSVASNSAPALMLIAECDPLHDQGVAYARHLEQAGVAVQLAVIPGVTHDFMRMGSIIEEADEGLVMVVEALQQHL,brenda,Q8KQK1,CC(=O)Oc1cccc2ccccc12.O>>CC(=O)O.Oc1cccc2ccccc12,29.0,1.388287186733619e-14,37.0,7.5,3.1.1.113,303.0,1.462397997898956,CC(=O)Oc1cccc2ccccc12.O,CC(=O)O.Oc1cccc2ccccc12,1.462397997898956,CC(=O)Oc1cccc2ccccc12.O__MSLNPDLAAYLQLVEAGRSAGKVLPMHALEADEARRQFEESSALIAGKADEPDCISDLSLTTRDGHTLPVRLYRPPQDDPALAGAALLYLHGGGYVVGSLDSHDTLCWNLAQDAGVPVIAVGYRLAPQWRFPTASDDALDAWRWLVEQAEALGIDAQRLAVVGDSVGGSLATILANQLAAQRELAAPRLQVMIYPVTDASCRRPSVQRYGSGYLLEAQTLEWFYQQYATVPADRLDPRFSPLLGSVASNSAPALMLIAECDPLHDQGVAYARHLEQAGVAVQLAVIPGVTHDFMRMGSIIEEADEGLVMVVEALQQHL,./data/raw/alphafold//AF-Q8KQK1-F1-model_v4.pdb,1498,1047,872,1203
+1059,19516,19802,MLNMQQHPSAIASLRNQLAAGHIANLTDFWREAESLNVPLVTPVEGAEDEREVTFLWRARHPLQGVYLRLNRVTDKEHVEKGMMSALPETDIWTLTLRLPASYCGSYSLLEIPPGTTAETIALSGGRFATLAGKADPLNKMPEINVRGNAKESVLTLDKAPALSEWNGGFHTGQLLTSMRIIAGKSRQVRLYIPDIDISQPLGLVVLPDGETWFDHLGVCAAIDAAINNRRIVPVAVLGIDNINEHERTEILGGRSKLIKDIAGHLLPMIRAEQPQRQWADRSRTVLAGQSLGGISALMGARYAPETFGLVLSHSPSMWWTPERTSRPGLFSETDTSWVSEHLLSAPPQGVRISLCVGSLEGSTVPHVQQLHQRLITAGVESHCAIYTGGHDYAWWRGALIDGIGLLQG,brenda,A0A0H2V660,O.O=C1OC[C@H](N=C(O)c2cccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2[O-])C(=O)OC[C@H](N=C(O)c2cccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2[O-])C(=O)OC[C@@H]1N=C(O)c1cccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1[O-].[Fe+3]>>,1.4,99.91855424002554,23.0,7.5,3.1.1.109,562.0,0.1461280356782379,O.O=C1OC[C@H](N=C(O)c2cccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2[O-])C(=O)OC[C@H](N=C(O)c2cccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2[O-])C(=O)OC[C@@H]1N=C(O)c1cccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1[O-].[Fe+3],,0.1461280356782379,O.O=C1OC[C@H](N=C(O)c2cccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2[O-])C(=O)OC[C@H](N=C(O)c2cccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2[O-])C(=O)OC[C@@H]1N=C(O)c1cccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1[O-].[Fe+3]__MLNMQQHPSAIASLRNQLAAGHIANLTDFWREAESLNVPLVTPVEGAEDEREVTFLWRARHPLQGVYLRLNRVTDKEHVEKGMMSALPETDIWTLTLRLPASYCGSYSLLEIPPGTTAETIALSGGRFATLAGKADPLNKMPEINVRGNAKESVLTLDKAPALSEWNGGFHTGQLLTSMRIIAGKSRQVRLYIPDIDISQPLGLVVLPDGETWFDHLGVCAAIDAAINNRRIVPVAVLGIDNINEHERTEILGGRSKLIKDIAGHLLPMIRAEQPQRQWADRSRTVLAGQSLGGISALMGARYAPETFGLVLSHSPSMWWTPERTSRPGLFSETDTSWVSEHLLSAPPQGVRISLCVGSLEGSTVPHVQQLHQRLITAGVESHCAIYTGGHDYAWWRGALIDGIGLLQG,./data/raw/alphafold//AF-A0A0H2V660-F1-model_v4.pdb,285,2822,5144,6005
+1060,17468,17705,MNYPAEPFRIKSVETVSMIPRDERLKKMQEAGYNTFLLNSKDIYIDLLTDSGTNAMSDKQWAGMMMGDEAYAGSENFYHLERTVQELFGFKHIVPTHQGRGAENLLSQLAIKPGQYVAGNMYFTTTRYHQEKNGAVFVDIVRDEAHDAGLNIAFKGDIDLKKLQKLIDEKGAENIAYICLAVTVNLAGGQPVSMANMRAVRELTEAHGIKVFYDATRCVENAYFIKEQEQGFENKSIAEIVHEMFSYADGCTMSGKKDCLVNIGGFLCMNDDEMFSSAKELVVVYEGMPSYGGLAGRDMEAMAIGLREAMQYEYIEHRVKQVRYLGDKLKAAGVPIVEPVGGHAVFLDARRFCEHLTQDEFPAQSLAASIYVETGVRSMERGIISAGRNNVTGEHHRPKLETVRLTIPRRVYTYAHMDVVADGIIKLYQHKEDIRGLKFIYEPKQLRFFTARFDYI,brenda,P31013,N[C@@H](Cc1ccc(O)c(F)c1)C(=O)O.O>>CC(=O)C(=O)O.N.Oc1cccc(F)c1,1.4,0.0,30.0,8.0,4.1.99.2,546.0,0.1461280356782379,N[C@@H](Cc1ccc(O)c(F)c1)C(=O)O.O,CC(=O)C(=O)O.N.Oc1cccc(F)c1,0.1461280356782379,N[C@@H](Cc1ccc(O)c(F)c1)C(=O)O.O__MNYPAEPFRIKSVETVSMIPRDERLKKMQEAGYNTFLLNSKDIYIDLLTDSGTNAMSDKQWAGMMMGDEAYAGSENFYHLERTVQELFGFKHIVPTHQGRGAENLLSQLAIKPGQYVAGNMYFTTTRYHQEKNGAVFVDIVRDEAHDAGLNIAFKGDIDLKKLQKLIDEKGAENIAYICLAVTVNLAGGQPVSMANMRAVRELTEAHGIKVFYDATRCVENAYFIKEQEQGFENKSIAEIVHEMFSYADGCTMSGKKDCLVNIGGFLCMNDDEMFSSAKELVVVYEGMPSYGGLAGRDMEAMAIGLREAMQYEYIEHRVKQVRYLGDKLKAAGVPIVEPVGGHAVFLDARRFCEHLTQDEFPAQSLAASIYVETGVRSMERGIISAGRNNVTGEHHRPKLETVRLTIPRRVYTYAHMDVVADGIIKLYQHKEDIRGLKFIYEPKQLRFFTARFDYI,./data/raw/alphafold//AF-P31013-F1-model_v4.pdb,1307,3734,1536,3506
+1061,19225,19511,MVTVFGILNLTEDSFF,brenda,Q704U4,O.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>>,5.8,99.8132684005318,25.0,7.0,3.5.2.6,287.0,0.7634279935629373,O.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,,0.7634279935629373,O.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__MVTVFGILNLTEDSFF,./data/raw/alphafold//AF-Q704U4-F1-model_v4.pdb,1461,997,812,1131
+1062,3912,3965,MTSKVQLVFLFLFLCVMWASPSAASCDEPSDPMMKQFEEWMAEYGRVYKDNDEKMLRFQIFKNNVNHIETFNNRNGNSYTLGINQFTDMTNNEFVAQYTGLSLPLNIKREPVVSFDDVDISSVPQSIDWRDSGAVTSVKNQGRCGSCWAFASIATVESIYKIKRGNLVSLSEQQVLDCAVSYGCKGGWINKAYSFIISNKGVASAAIYPYKAAKGTCKTNGVPNSAYITRYTYVQRNNERNMMYAVSNQPIAAALDASGNFQHYKRGVFTGPCGTRLNHAIVIIGYGQDSSGKKFWIVRNSWGAGWGEGGYIRLARDVSSSFGLCGIAMDPLYPTLQSGPSVEVI,uniprot_search,P80884,CC(C)C[C@H](N=C(O)[C@@H](N)C(C)C)C(O)=N[C@@H](CCCCN)C(=O)O.O>>,6.29,99.73509793429368,37.0,7.4,3.4.22.31,4615.0,0.7986506454452689,CC(C)C[C@H](N=C(O)[C@@H](N)C(C)C)C(O)=N[C@@H](CCCCN)C(=O)O.O,,0.7986506454452689,CC(C)C[C@H](N=C(O)[C@@H](N)C(C)C)C(O)=N[C@@H](CCCCN)C(=O)O.O__MTSKVQLVFLFLFLCVMWASPSAASCDEPSDPMMKQFEEWMAEYGRVYKDNDEKMLRFQIFKNNVNHIETFNNRNGNSYTLGINQFTDMTNNEFVAQYTGLSLPLNIKREPVVSFDDVDISSVPQSIDWRDSGAVTSVKNQGRCGSCWAFASIATVESIYKIKRGNLVSLSEQQVLDCAVSYGCKGGWINKAYSFIISNKGVASAAIYPYKAAKGTCKTNGVPNSAYITRYTYVQRNNERNMMYAVSNQPIAAALDASGNFQHYKRGVFTGPCGTRLNHAIVIIGYGQDSSGKKFWIVRNSWGAGWGEGGYIRLARDVSSSFGLCGIAMDPLYPTLQSGPSVEVI,./data/raw/alphafold//AF-P80884-F1-model_v4.pdb,1940,1568,3155,1926
+1063,19444,19730,MTNDERILSWNETPSKPRYTPPPGAIDAHCHVFGPMAQFPFSPKAKYLPRDAGPDMLFALRDHLGFARNVIVQASCHGTDNAATLDAIARAQGKARGIAVVDPAIDEAELAALHEGGMRGIRFNFLKRLVDDAPKDKFLEVAGRLPAGWHVVIYFEADILEELRPFMDAIPVPIVIDHMGRPDVRQGPDGADMKAFRRLLDSREDIWFKATCPDRLDPAGPPWDDFARSVAPLVADYADRVIWGTDWPHPNMQDAIPDDGLVVDMIPRIAPTPELQHKMLVTNPMRLYWSEEM,brenda,O87170,O.O=C([O-])c1cc(C(=O)[O-])oc(=O)c1>>O=C([O-])/C=C(\CC(=O)C(=O)O)C(=O)O,342.0,0.2506141040048556,30.0,8.2,3.1.1.57,13689.0,2.534026106056135,O.O=C([O-])c1cc(C(=O)[O-])oc(=O)c1,O=C([O-])/C=C(\CC(=O)C(=O)O)C(=O)O,2.534026106056135,O.O=C([O-])c1cc(C(=O)[O-])oc(=O)c1__MTNDERILSWNETPSKPRYTPPPGAIDAHCHVFGPMAQFPFSPKAKYLPRDAGPDMLFALRDHLGFARNVIVQASCHGTDNAATLDAIARAQGKARGIAVVDPAIDEAELAALHEGGMRGIRFNFLKRLVDDAPKDKFLEVAGRLPAGWHVVIYFEADILEELRPFMDAIPVPIVIDHMGRPDVRQGPDGADMKAFRRLLDSREDIWFKATCPDRLDPAGPPWDDFARSVAPLVADYADRVIWGTDWPHPNMQDAIPDDGLVVDMIPRIAPTPELQHKMLVTNPMRLYWSEEM,./data/raw/alphafold//AF-O87170-F1-model_v4.pdb,276,2810,5132,5993
+1064,6085,6179,MGIKLPTLEDLREISKQFNLDLEDEELKSFLQLLKLQLESYERLDSLPDYTPRVKYQRTLGRPPMKEENPYGALVWITSIKGKEEGKLKGKRICIKDNVMIAGIPMLNGSKMLEGFVPHMDATVVSRILDEAGEIVAKTTCEDLCFSGGSHTSYPWPVLNPRNPEYMAGGSSSGSAVAVASGYCDMAVGGDQGGSIRIPSSWVGIYGLKPTHGLVPYTGAFSIEPTLDHLGPMANTVKDVALLLEVIAGRDELDSRQPDSLPPPPVKPYSKLIDGDVKDMKVGIVKEGFNWSNSEKDVDELVLDSAKKLEDYGIKVEDTSIPLHRMGLDIWTPIAIEGATATMILGSGVGWGRKGLFETQIADFFGNSLKSRARDLPNTVKGVLMLGYLMIKMYNNRYYAKARNLSIVLKEAYDSALRKYDALIMPTTPMKAMRYKSEPGFDEYFIMALGMINNTAPFDVTGHPAMNIPVGYSNGLPVGLMIIGRHFEEDKVLKLANVFERIKK,brenda,P95896,CCC(=N)O.O>>CCC(=O)O.N,3.2,0.0,70.0,7.5,3.5.1.4,2287.0,0.505149978319906,CCC(=N)O.O,CCC(=O)O.N,2.257678574869185,CCC(=N)O.O__MGIKLPTLEDLREISKQFNLDLEDEELKSFLQLLKLQLESYERLDSLPDYTPRVKYQRTLGRPPMKEENPYGALVWITSIKGKEEGKLKGKRICIKDNVMIAGIPMLNGSKMLEGFVPHMDATVVSRILDEAGEIVAKTTCEDLCFSGGSHTSYPWPVLNPRNPEYMAGGSSSGSAVAVASGYCDMAVGGDQGGSIRIPSSWVGIYGLKPTHGLVPYTGAFSIEPTLDHLGPMANTVKDVALLLEVIAGRDELDSRQPDSLPPPPVKPYSKLIDGDVKDMKVGIVKEGFNWSNSEKDVDELVLDSAKKLEDYGIKVEDTSIPLHRMGLDIWTPIAIEGATATMILGSGVGWGRKGLFETQIADFFGNSLKSRARDLPNTVKGVLMLGYLMIKMYNNRYYAKARNLSIVLKEAYDSALRKYDALIMPTTPMKAMRYKSEPGFDEYFIMALGMINNTAPFDVTGHPAMNIPVGYSNGLPVGLMIIGRHFEEDKVLKLANVFERIKK,./data/raw/alphafold//AF-P95896-F1-model_v4.pdb,1085,655,336,378
+1065,8739,8876,MLKVISSLLVYMTASVMAVASPLAHSGEPSGEYPTVNEIPVGEVRLYQIADGVWSHIATQSFDGAVYPSNGLIVRDGDELLLIDTAWGAKNTAALLAEIEKQIGLPVTRAVSTHFHDDRVGGVDVLRAAGVATYASPSTRRLAEAEGNEIPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVHELSRTSAGNVADADLAEWPTSVERIQKHYPEAEVVIPGHGLPGGLDLLQHTANVVKAHKNRSVAE,brenda,Q8KRJ3,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1ccco1.O>>,120.0,99.77447305629605,25.0,7.0,3.5.2.6,287.0,2.0791812460476247,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1ccco1.O,,2.0791812460476247,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1ccco1.O__MLKVISSLLVYMTASVMAVASPLAHSGEPSGEYPTVNEIPVGEVRLYQIADGVWSHIATQSFDGAVYPSNGLIVRDGDELLLIDTAWGAKNTAALLAEIEKQIGLPVTRAVSTHFHDDRVGGVDVLRAAGVATYASPSTRRLAEAEGNEIPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVHELSRTSAGNVADADLAEWPTSVERIQKHYPEAEVVIPGHGLPGGLDLLQHTANVVKAHKNRSVAE,./data/raw/alphafold//AF-Q8KRJ3-F1-model_v4.pdb,1446,972,778,1115
+1066,12775,12947,MDKNLHQPLGGNEMPRFGGIATMMRLPHVQSPAELDALDAAFVGVPLDIGTSLRSGTRFGPREIRAESVMIRPYNMATGAAPFDSLNVADIGDVAINTFNLLEAVRIIEQEYDRILGHGILPLTLGGDHTITLPILRAIKKKHGKVGLVHVDAHADVNDHMFGEKIAHGTTFRRAVEEDLLDCDRVVQIGLRAQGYTAEDFNWSRKQGFRVVQAEECWHKSLEPLMAEVREKVGGGPVYLSFDIDGIDPAWAPGTGTPEIGGLTTIQAMEIIRGCQGLDLIGCDLVEVSPPYDTTGNTSLLGANLLYEMLCVLPGVVRR,sabio,Q9I3S3,N=C(N)NCCCC(=O)O.O>>NC(N)=O.NCCCC(=O)O,1012.0,1.7364510242981005e-14,37.0,9.5,3.5.3.7,287.0,3.0051805125037805,N=C(N)NCCCC(=O)O.O,NC(N)=O.NCCCC(=O)O,3.0051805125037805,N=C(N)NCCCC(=O)O.O__MDKNLHQPLGGNEMPRFGGIATMMRLPHVQSPAELDALDAAFVGVPLDIGTSLRSGTRFGPREIRAESVMIRPYNMATGAAPFDSLNVADIGDVAINTFNLLEAVRIIEQEYDRILGHGILPLTLGGDHTITLPILRAIKKKHGKVGLVHVDAHADVNDHMFGEKIAHGTTFRRAVEEDLLDCDRVVQIGLRAQGYTAEDFNWSRKQGFRVVQAEECWHKSLEPLMAEVREKVGGGPVYLSFDIDGIDPAWAPGTGTPEIGGLTTIQAMEIIRGCQGLDLIGCDLVEVSPPYDTTGNTSLLGANLLYEMLCVLPGVVRR,./data/raw/alphafold//AF-Q9I3S3-F1-model_v4.pdb,2172,4392,4284,4158
+1067,19230,19516,MNDFLLLLLVLFLGVPRSENHVINLEECFQEPEYENWLATASHGLTKTLNPKKIVIVGAGISGLTAAKLFREAGHEVVILEASDRVGGRIKTHREDGWYVDVGPMRVPQTHRIVREYIKKFNISLNPFRQTDENAWYLIKHVRQKMSANNPENFGYQLNPNERGKSASQLFDETLDKVTDDCTLQKEKYDSFSTKEYLIKEGKLSTGAVEMIGDFLNEEAGFHNSFLISVMDHFLFLNNSFDEITGGFDQLPERFFKDMDSIVHLNSTVEKIVHINNKVTVFYEGLSTNMRLVADYVLITATARATRLIKFVPPLSIPKTRALRSLIYASATKIILVCTDKFWEKDGIHGGRSITDLPSRVIYYPNHDFTNGIGVLLASYTWYSDSEFYTTLSDEKCVDVVMDDLVEIHNVSKDYLKSVCGKHVVQKWALDQYSMGAFSTYTPYQITHYSQMLAQNEGRIYFAGEYTAHPHGWIETSMKSAIREAINIHNA,sabio,P81383,O.O=C(O)C1CCCN1.O=O>>CCCC(=O)C(=O)O.N.OO,0.1,0.6048495976669975,25.0,8.5,1.4.3.2,8665.0,-1.0,O.O=C(O)C1CCCN1.O=O,CCCC(=O)C(=O)O.N.OO,-1.0,O.O=C(O)C1CCCN1.O=O__MNDFLLLLLVLFLGVPRSENHVINLEECFQEPEYENWLATASHGLTKTLNPKKIVIVGAGISGLTAAKLFREAGHEVVILEASDRVGGRIKTHREDGWYVDVGPMRVPQTHRIVREYIKKFNISLNPFRQTDENAWYLIKHVRQKMSANNPENFGYQLNPNERGKSASQLFDETLDKVTDDCTLQKEKYDSFSTKEYLIKEGKLSTGAVEMIGDFLNEEAGFHNSFLISVMDHFLFLNNSFDEITGGFDQLPERFFKDMDSIVHLNSTVEKIVHINNKVTVFYEGLSTNMRLVADYVLITATARATRLIKFVPPLSIPKTRALRSLIYASATKIILVCTDKFWEKDGIHGGRSITDLPSRVIYYPNHDFTNGIGVLLASYTWYSDSEFYTTLSDEKCVDVVMDDLVEIHNVSKDYLKSVCGKHVVQKWALDQYSMGAFSTYTPYQITHYSQMLAQNEGRIYFAGEYTAHPHGWIETSMKSAIREAINIHNA,./data/raw/alphafold//AF-P81383-F1-model_v4.pdb,1381,886,683,972
+1068,19373,19659,MVSGTVGRGTALGAVLLALLAVPAQAGTAAAADLPAPDDTGLQAVLHTALSQGAPGAMVRVDDNGTIHQLSEGVADRATGRAITTTDRFRVGSVTKSFSAVVLLQLVDEGKLDLDASVNTYLPGLLPDDRITVRQVMSHRSGLYDYTNDMFAQTVPGFESVRNKVFSYQDLITLSLKHGVTNAPGAAYSYSNTNFVVAGMLIEKLTGHSVATEYQNRIFTPLNLTDTFYVHPDTVIPGTHANGYLTPDEAGGALVDSTEQTVSWAQSAGAVISSTQDLDTFFSALMSGQLMSAAQLAQMQQWTTVNSTQGYGLGLRRRDLSCGISVYGHTGTVQGYYTYAFASKDGKRSVTALANTSNNVNVLNTMARTLESAFCGKPTTAKLRSATSSATTVERHEDIAPGIARD,uniprot_search,P15555,O.O=C(O)c1cccc(OC(=O)C(CO)N=C(O)Cc2ccccc2)c1>>,2.2,99.72402373395887,25.0,7.5,3.4.16.4,31952.0,0.3424226808222063,O.O=C(O)c1cccc(OC(=O)C(CO)N=C(O)Cc2ccccc2)c1,,0.3424226808222063,O.O=C(O)c1cccc(OC(=O)C(CO)N=C(O)Cc2ccccc2)c1__MVSGTVGRGTALGAVLLALLAVPAQAGTAAAADLPAPDDTGLQAVLHTALSQGAPGAMVRVDDNGTIHQLSEGVADRATGRAITTTDRFRVGSVTKSFSAVVLLQLVDEGKLDLDASVNTYLPGLLPDDRITVRQVMSHRSGLYDYTNDMFAQTVPGFESVRNKVFSYQDLITLSLKHGVTNAPGAAYSYSNTNFVVAGMLIEKLTGHSVATEYQNRIFTPLNLTDTFYVHPDTVIPGTHANGYLTPDEAGGALVDSTEQTVSWAQSAGAVISSTQDLDTFFSALMSGQLMSAAQLAQMQQWTTVNSTQGYGLGLRRRDLSCGISVYGHTGTVQGYYTYAFASKDGKRSVTALANTSNNVNVLNTMARTLESAFCGKPTTAKLRSATSSATTVERHEDIAPGIARD,./data/raw/alphafold//AF-P15555-F1-model_v4.pdb,2962,1702,3314,2115
+1069,7772,7897,MFQIRSFLVGISAFVMAVLGSAAYSAQPGGEYPTVDDIPVGEVRLYKIGDGVWSHIATQKLGDTVYSSNGLIVRDADELLLIDTAWGAKNTVALLAEIEKQIGLPVTRSISTHFHDDRVGGVDVLRAAGVATYTSPLTRQLAEAAGNEVPAHSLKALSSSGDVVRFGPVEVFYPGAAHSGDNLVVYVPAVRVLFGGCAVHEASRESAGNVADANLAEWPATIKRIQQRYPEAEVVIPGHGLPGGLELLQHTTNVVKTHKVRPVAE,brenda,Q840P9,CCN1CCN(C(O)=N[C@@H](C(O)=N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c2ccccc2)C(=O)C1=O.O>>,140.0,99.81363415265972,37.0,7.0,3.5.2.6,287.0,2.146128035678238,CCN1CCN(C(O)=N[C@@H](C(O)=N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c2ccccc2)C(=O)C1=O.O,,2.146128035678238,CCN1CCN(C(O)=N[C@@H](C(O)=N[C@@H]2C(=O)N3[C@@H]2SC(C)(C)[C@@H]3C(=O)O)c2ccccc2)C(=O)C1=O.O__MFQIRSFLVGISAFVMAVLGSAAYSAQPGGEYPTVDDIPVGEVRLYKIGDGVWSHIATQKLGDTVYSSNGLIVRDADELLLIDTAWGAKNTVALLAEIEKQIGLPVTRSISTHFHDDRVGGVDVLRAAGVATYTSPLTRQLAEAAGNEVPAHSLKALSSSGDVVRFGPVEVFYPGAAHSGDNLVVYVPAVRVLFGGCAVHEASRESAGNVADANLAEWPATIKRIQQRYPEAEVVIPGHGLPGGLELLQHTTNVVKTHKVRPVAE,./data/raw/alphafold//AF-Q840P9-F1-model_v4.pdb,1446,972,794,1105
+1070,11462,11619,MSQPKKRKLESGGGGEGGEGTEEEDGAEREAALERPRRTKRERDQLYYECYSDVSVHEEMIADRVRTDAYRLGILRNWAALRGKTVLDVGAGTGILSIFCAQAGARRVYAVEASAIWQQAREVVRFNGLEDRVHVLPGPVETVELPEQVDAIVSEWMGYGLLHESMLSSVLHARTKWLKEGGLLLPASAELFIAPISDQMLEWRLGFWSQVKQHYGVDMSCLEGFATRCLMGHSEIVVQGLSGEDVLARPQRFAQLELSRAGLEQELEAGVGGRFRCSCYGSAPMHGFAIWFQVTFPGGESEKPLVLSTSPFHPATHWKQALLYLNEPVQVEQDTDVSGEITLLPSRDNPRRLRVLLRYKVGDQEEKTKDFAMED,sabio,Q96LA8,C[S+](CCC(N)C(=O)O)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O>>Nc1ncnc2c1ncn2C1OC(CSCCC(N)C(=O)O)C(O)C1O,0.0025,1.9156014173029807,37.0,8.0,2.1.1.-,9606.0,-2.6020599913279625,C[S+](CCC(N)C(=O)O)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O,Nc1ncnc2c1ncn2C1OC(CSCCC(N)C(=O)O)C(O)C1O,-2.6020599913279625,C[S+](CCC(N)C(=O)O)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O__MSQPKKRKLESGGGGEGGEGTEEEDGAEREAALERPRRTKRERDQLYYECYSDVSVHEEMIADRVRTDAYRLGILRNWAALRGKTVLDVGAGTGILSIFCAQAGARRVYAVEASAIWQQAREVVRFNGLEDRVHVLPGPVETVELPEQVDAIVSEWMGYGLLHESMLSSVLHARTKWLKEGGLLLPASAELFIAPISDQMLEWRLGFWSQVKQHYGVDMSCLEGFATRCLMGHSEIVVQGLSGEDVLARPQRFAQLELSRAGLEQELEAGVGGRFRCSCYGSAPMHGFAIWFQVTFPGGESEKPLVLSTSPFHPATHWKQALLYLNEPVQVEQDTDVSGEITLLPSRDNPRRLRVLLRYKVGDQEEKTKDFAMED,./data/raw/alphafold//AF-Q96LA8-F1-model_v4.pdb,3854,3978,1822,3636
+1071,1921,1952,MAKLIALTLLGMGLALFRNHQSSYQTRLNALREVQPVELPNCNLVKGIETGSEDLEILPNGLAFISSGLKYPGIKSFNPNSPGKILLMDLNEEDPTVLELGITGSKFDVSSFNPHGISTFTDEDNAMYLLVVNHPDAKSTVELFKFQEEEKSLLHLKTIRHKLLPNLNDIVAVGPEHFYGTNDHYFLDPYLQSWEMYLGLAWSYVVYYSPSEVRVVAEGFDFANGINISPDGKYVYIAELLAHKIHVYEKHANWTLTPLKSLDFNTLVDNISVDPETGDLWVGCHPNGMKIFFYDSENPPASEVLRIQNILTEEPKVTQVYAENGTVLQGSTVASVYKGKLLIGTVFHKALYCEL,brenda,P27169,CC(=O)Oc1cccc(C#N)c1.O>>CC(=O)O.N#Cc1cccc(O)c1,125.0,1.5818399571673308e-14,25.0,8.0,3.1.1.2,9606.0,2.096910013008056,CC(=O)Oc1cccc(C#N)c1.O,CC(=O)O.N#Cc1cccc(O)c1,2.096910013008056,CC(=O)Oc1cccc(C#N)c1.O__MAKLIALTLLGMGLALFRNHQSSYQTRLNALREVQPVELPNCNLVKGIETGSEDLEILPNGLAFISSGLKYPGIKSFNPNSPGKILLMDLNEEDPTVLELGITGSKFDVSSFNPHGISTFTDEDNAMYLLVVNHPDAKSTVELFKFQEEEKSLLHLKTIRHKLLPNLNDIVAVGPEHFYGTNDHYFLDPYLQSWEMYLGLAWSYVVYYSPSEVRVVAEGFDFANGINISPDGKYVYIAELLAHKIHVYEKHANWTLTPLKSLDFNTLVDNISVDPETGDLWVGCHPNGMKIFFYDSENPPASEVLRIQNILTEEPKVTQVYAENGTVLQGSTVASVYKGKLLIGTVFHKALYCEL,./data/raw/alphafold//AF-P27169-F1-model_v4.pdb,1506,1056,381,432
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+1081,17444,17681,MNVFSIFSLVFLAAFGSCADDRRSALEECFREADYEEFLEIARNGLKKTSNPKHVVVVGAGMAGLSAAYVLAGAGHRVTLLEASDRVGGRVNTYRDEKEGWYVNMGPMRLPERHRIVRTYIAKFGLKLNEFFQENENAWYFIRNIRKRVWEVKKDPGVFKYPVKPSEEGKSASQLYRESLKKVIEELKRTNCSYILDKYDTYSTKEYLIKEGNLSRGAVDMIGDLLNEDSSYYLSFIESLKNDDLFSYEKRFDEISDGFDQLPKSMHQAIAEMVHLNAQVIKIQRDAEKVRVAYQTPAKTLSYVTADYVIVCATSRAVRRISFEPPLPPKKAHALRSIHYKSATKIFLTCTRKFWEADGIHGGKSTTDLPSRFIYYPNHNFTSGVGVIVAYVLADDSDFFQALDIKTSADIVINDLSLIHQLPKNEIQALCYPSLIKKWSLDKYTMGALTSFTPYQFQDYIETVAAPVGRIYFAGEYTATVHGWLDSTIKSGLTAARNVNRASQKPSRIHLINDNQL,uniprot_search,A8QL52,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O.O=O>>N.O=C(O)C(=O)Cc1c[nH]c2ccccc12.OO,98.82,1.1157056720291124e-14,25.0,8.5,1.4.3.2,8613.0,1.994844849553398,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O.O=O,N.O=C(O)C(=O)Cc1c[nH]c2ccccc12.OO,1.994844849553398,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O.O=O__MNVFSIFSLVFLAAFGSCADDRRSALEECFREADYEEFLEIARNGLKKTSNPKHVVVVGAGMAGLSAAYVLAGAGHRVTLLEASDRVGGRVNTYRDEKEGWYVNMGPMRLPERHRIVRTYIAKFGLKLNEFFQENENAWYFIRNIRKRVWEVKKDPGVFKYPVKPSEEGKSASQLYRESLKKVIEELKRTNCSYILDKYDTYSTKEYLIKEGNLSRGAVDMIGDLLNEDSSYYLSFIESLKNDDLFSYEKRFDEISDGFDQLPKSMHQAIAEMVHLNAQVIKIQRDAEKVRVAYQTPAKTLSYVTADYVIVCATSRAVRRISFEPPLPPKKAHALRSIHYKSATKIFLTCTRKFWEADGIHGGKSTTDLPSRFIYYPNHNFTSGVGVIVAYVLADDSDFFQALDIKTSADIVINDLSLIHQLPKNEIQALCYPSLIKKWSLDKYTMGALTSFTPYQFQDYIETVAAPVGRIYFAGEYTATVHGWLDSTIKSGLTAARNVNRASQKPSRIHLINDNQL,./data/raw/alphafold//AF-A8QL52-F1-model_v4.pdb,1381,1496,3067,1822
+1082,19567,19853,MSASALVCLAPGSEETEAVTTIDLLVRGGIKVTTASVASDGNLAITCSRGVKLLADAPLVEVADGEYDVIVLPGGIKGAECFRDSTLLVETVKQFHRSGRIVAAICAAPATVLVPHDIFPIGNMTGFPTLKDKIPAEQWLDKRVVWDARVKLLTSQGPGTAIDFGLKIIDLLVGREKAHEVASQLVMAAGIYNYYE,brenda,Q46948,O.O=CC=O>>CC(=O)O,0.15,11.669328898711184,22.0,7.0,4.2.1.130,562.0,-0.8239087409443188,O.O=CC=O,CC(=O)O,-0.8239087409443188,O.O=CC=O__MSASALVCLAPGSEETEAVTTIDLLVRGGIKVTTASVASDGNLAITCSRGVKLLADAPLVEVADGEYDVIVLPGGIKGAECFRDSTLLVETVKQFHRSGRIVAAICAAPATVLVPHDIFPIGNMTGFPTLKDKIPAEQWLDKRVVWDARVKLLTSQGPGTAIDFGLKIIDLLVGREKAHEVASQLVMAAGIYNYYE,./data/raw/alphafold//AF-Q46948-F1-model_v4.pdb,1322,828,618,905
+1083,11352,11508,MPDQRSESGRFDVEVDVLVAGSGGGVAGAYTAAREGLSVLLVEATDKFGGTTAFSGGGGMWFPCNPVLERAGTDDTLDEALKYFHAVVGDRTPQELQDAYVTGGAGFIAYLEQDHGFEFAVLPWPDYYGSVPGARNDGYRHIVPKPLPDSALGSYQGLVRGPLDTERLGAPAPDTLIGGRALVGRFLAALDKLPNADCWCEAPLTELITESGRVVGAIVERGGERLRVCARRGVLLASGGFEQNADMRGRYGVPGSATDTMGGPGSTGAAHRAAMAVGADVDLMDQAWWSPGLTHPDGRSAFALWFTGGIFVDQDGKRFVNESAPYDRLGRAVIERLESGRLTLPYWMVYDSRAGDVPPVGATNVSMVDPAEYRAAGLWRSAETISGLAEEIGVPADALEATIQRFNEMATAGHDDDFGRGDEAYDRVFTGGASPLVPIDTPPYHAAAFGLSDLGTKGGLRTDTRARVRGRDGEPIPGLYAAGNTMAAVSGTTYPGGGNPIGASMLFSHFAALDMAAEGTTA,brenda,A0QW99,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2C(=O)O>>,94.1,10000000.0,25.0,8.0,1.3.99.4,1772.0,1.973589623427257,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2C(=O)O,,1.973589623427257,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2C(=O)O__MPDQRSESGRFDVEVDVLVAGSGGGVAGAYTAAREGLSVLLVEATDKFGGTTAFSGGGGMWFPCNPVLERAGTDDTLDEALKYFHAVVGDRTPQELQDAYVTGGAGFIAYLEQDHGFEFAVLPWPDYYGSVPGARNDGYRHIVPKPLPDSALGSYQGLVRGPLDTERLGAPAPDTLIGGRALVGRFLAALDKLPNADCWCEAPLTELITESGRVVGAIVERGGERLRVCARRGVLLASGGFEQNADMRGRYGVPGSATDTMGGPGSTGAAHRAAMAVGADVDLMDQAWWSPGLTHPDGRSAFALWFTGGIFVDQDGKRFVNESAPYDRLGRAVIERLESGRLTLPYWMVYDSRAGDVPPVGATNVSMVDPAEYRAAGLWRSAETISGLAEEIGVPADALEATIQRFNEMATAGHDDDFGRGDEAYDRVFTGGASPLVPIDTPPYHAAAFGLSDLGTKGGLRTDTRARVRGRDGEPIPGLYAAGNTMAAVSGTTYPGGGNPIGASMLFSHFAALDMAAEGTTA,./data/raw/alphafold//AF-A0QW99-F1-model_v4.pdb,1436,3891,6209,872
+1084,13247,13422,MNKFKVNISGMTCTGCEKHVESALEKIGAKNIESSYRRGEAVFELPDDIEVESAIKAIDEANYQAGEIEEVSSLENVALINEDNYDLLIIGSGAAAFSSAIKAIEYGAKVGMIERGTVGGTCVNIGCVPSKTLLRAGEIIHLSKDNPFIGLQTSAGEVDLASLITQKDKLVSELRNQKYMDLIDEYNFDLIKGEAKFVDASTVEVNGAKLSAKRFLIATGASPSLPQISGLEKMDYLTSTTLLELKKIPKRLTVIGSGYIGMELGQLFHHLGSEITLMQRSERLLKEYDPEISESVEKALIEQGINLVKGATFERVEQSGEIKRVYVTVNGSREVIESDQLLVATGRKPNTDSLNLSAAGVETGKNNEILINDFGQTSNEKIYAAGDVTLGPQFVYVAAYEGGIITDNAIGGLNKKIDLSVVPAVTFTNPTVATVGLTEEQAKEKGYDVKTSVLPLDAVPRAIVNRETTGVFKLVADAETLKVLGVHIVSENAGDVIYAASLAVKFGLTVEDLTETLAPYLTMAEGLKLAALTFDKDIWKLSCCAG,brenda,D9J041,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.[Hg+2]>>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.[H+].[Hg],17.7,0.0,25.0,7.4,1.16.1.1,1421.0,1.2479732663618066,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.[Hg+2],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.[H+].[Hg],1.2479732663618066,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.[Hg+2]__MNKFKVNISGMTCTGCEKHVESALEKIGAKNIESSYRRGEAVFELPDDIEVESAIKAIDEANYQAGEIEEVSSLENVALINEDNYDLLIIGSGAAAFSSAIKAIEYGAKVGMIERGTVGGTCVNIGCVPSKTLLRAGEIIHLSKDNPFIGLQTSAGEVDLASLITQKDKLVSELRNQKYMDLIDEYNFDLIKGEAKFVDASTVEVNGAKLSAKRFLIATGASPSLPQISGLEKMDYLTSTTLLELKKIPKRLTVIGSGYIGMELGQLFHHLGSEITLMQRSERLLKEYDPEISESVEKALIEQGINLVKGATFERVEQSGEIKRVYVTVNGSREVIESDQLLVATGRKPNTDSLNLSAAGVETGKNNEILINDFGQTSNEKIYAAGDVTLGPQFVYVAAYEGGIITDNAIGGLNKKIDLSVVPAVTFTNPTVATVGLTEEQAKEKGYDVKTSVLPLDAVPRAIVNRETTGVFKLVADAETLKVLGVHIVSENAGDVIYAASLAVKFGLTVEDLTETLAPYLTMAEGLKLAALTFDKDIWKLSCCAG,./data/raw/alphafold//AF-D9J041-F1-model_v4.pdb,2268,4521,4440,4331
+1085,11922,12082,MGAGPSLLLAALLLLLSGDGAVRCDTPANCTYLDLLGTWVFQVGSSGSQRDVNCSVMGPQEKKVVVYLQKLDTAYDDLGNSGHFTIIYNQGFEIVLNDYKWFAFFKYKEEGSKVTTYCNETMTGWVHDVLGRNWACFTGKKVGTASENVYVNIAHLKNSQEKYSNRLYKYDHNFVKAINAIQKSWTATTYMEYETLTLGDMIRRSGGHSRKIPRPKPAPLTAEIQQKILHLPTSWDWRNVHGINFVSPVRNQASCGSCYSFASMGMLEARIRILTNNSQTPILSPQEVVSCSQYAQGCEGGFPYLIAGKYAQDFGLVEEACFPYTGTDSPCKMKEDCFRYYSSEYHYVGGFYGGCNEALMKLELVHHGPMAVAFEVYDDFLHYKKGIYHHTGLRDPFNPFELTNHAVLLVGYGTDSASGMDYWIVKNSWGTGWGENGYFRIRRGTDECAIESIAVAATPIPKL,brenda,P53634,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc3ccccc3)N=C(O)OCc3ccccc3)ccc12.O>>Cc1cc(=O)oc2cc(N)ccc12.N=C(N)NCCC[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)OCc1ccccc1)C(=O)O,0.23,0.0,25.0,5.5,3.4.14.1,9606.0,-0.6382721639824072,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc3ccccc3)N=C(O)OCc3ccccc3)ccc12.O,Cc1cc(=O)oc2cc(N)ccc12.N=C(N)NCCC[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)OCc1ccccc1)C(=O)O,-0.6382721639824072,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc3ccccc3)N=C(O)OCc3ccccc3)ccc12.O__MGAGPSLLLAALLLLLSGDGAVRCDTPANCTYLDLLGTWVFQVGSSGSQRDVNCSVMGPQEKKVVVYLQKLDTAYDDLGNSGHFTIIYNQGFEIVLNDYKWFAFFKYKEEGSKVTTYCNETMTGWVHDVLGRNWACFTGKKVGTASENVYVNIAHLKNSQEKYSNRLYKYDHNFVKAINAIQKSWTATTYMEYETLTLGDMIRRSGGHSRKIPRPKPAPLTAEIQQKILHLPTSWDWRNVHGINFVSPVRNQASCGSCYSFASMGMLEARIRILTNNSQTPILSPQEVVSCSQYAQGCEGGFPYLIAGKYAQDFGLVEEACFPYTGTDSPCKMKEDCFRYYSSEYHYVGGFYGGCNEALMKLELVHHGPMAVAFEVYDDFLHYKKGIYHHTGLRDPFNPFELTNHAVLLVGYGTDSASGMDYWIVKNSWGTGWGENGYFRIRRGTDECAIESIAVAATPIPKL,./data/raw/alphafold//AF-P53634-F1-model_v4.pdb,1930,4074,1928,3760
+1086,20989,21310,MAERVLTRVHSLRERVDATLAAHRNEILLFLSRIESHGKGILKPHELLAEFDAIRQDDKNKLNEHAFEELLKSTQEAIVLPPWVALAIRLRPGVWEYIRVNVNALVVEELSVPEYLQFKEELVDGASNGNFVLELDFEPFTASFPKPTLTKSIGNGVEFLNRHLSAKMFHDKESMTPLLEFLRAHHYKGKTMMLNDRIQNSNTLQNVLRKAEEYLIMLPPETPYFEFEHKFQEIGLEKGWGDTAERVLEMVCMLLDLLEAPDSCTLEKFLGRIPMVFNVVILSPHGYFAQENVLGYPDTGGQVVYILDQVPALEREMLKRIKEQGLDIIPRILIVTRLLPDAVGTTCGQRIEKVYGAEHSHILRVPFRTEKGIVRKWISRFEVWPYMETFIEDVAKEISAELQAKPDLIIGNYSEGNLAASLLAHKLGVTQCTIAHALEKTKYPDSDIYWKKFDEKYHFSSQFTADLIAMNHTDFIITSTFQEIAGSKDTVGQYESHMAFTMPGLYRVVHGINVFDPKFNIVSPGADINLYFSYSETEKRLTAFHPEIDELLYSDVENDEHLCVLKDRTKPILFTMARLDRVKNLTGLVEWYAKNPRLRGLVNLVVVGGDRRKESKDLEEQAEMKKMYELIETHNLNGQFRWISSQMNRVRNGELYRYIADTKGAFVQPAFYEAFGLTVVEAMTCGLPTFATNHGGPAEIIVHGKSGFHIDPYHGEQAADLLADFFEKCKKDPSHWETISMGGLKRIEEKYTWQIYSESLLTLAAVYGFWKHVSKLDRLEIRRYLEMFYALKYRKMAEAVPLAAE,sabio,P10691,O=C(CF)[C@@H](O)[C@H](O)[C@H](O)CO.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>>O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,21.7,29.84440148750445,30.0,8.0,2.4.1.13,4113.0,1.3364597338485296,O=C(CF)[C@@H](O)[C@H](O)[C@H](O)CO.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,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,1.3364597338485296,O=C(CF)[C@@H](O)[C@H](O)[C@H](O)CO.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,98,2583,2881,999
+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
+1091,18160,18416,MRALWVLGLCCVLLTFGSVRADDEVDVDGTVEEDLGKSREGSRTDDEVVQREEEAIQLDGLNASQIRELREKSEKFAFQAEVNRMMKLIINSLYKNKEIFLRELISNASDALDKIRLISLTDENALAGNEELTVKIKCDKEKNLLHVTDTGVGMTREELVKNLGTIAKSGTSEFLNKMTEAQEDGQSTSELIGQFGVGFYSAFLVADKVIVTSKHNNDTQHIWESDSNEFSVIADPRGNTLGRGTTITLVLKEEASDYLELDTIKNLVKKYSQFINFPIYVWSSKTETVEEPMEEEEAAKEEKEDSDDEAAVEEEEEEKKPKTKKVEKTVWDWELMNDIKPIWQRPSKEVEDDEYKAFYKSFSKESDDPMAYIHFTAEGEVTFKSILFVPTSAPRGLFDEYGSKKSDYIKLYVRRVFITDDFHDMMPKYLNFVKGVVDSDDLPLNVSRETLQQHKLLKVIRKKLVRKTLDMIKKIADEKYNDTFWKEFGTNIKLGVIEDHSNRTRLAKLLRFQSSHHPSDITSLDQYVERMKEKQDKIYFMAGSSRKEAESSPFVERLLKKGYEVIYLTEPVDEYCIQALPEFDGKRFQNVAKEGVKFDESEKTKESREAIEKEFEPLLNWMKDKALKDKIEKAVVSQRLTESPCALVASQYGWSGNMERIMKAQAYQTGKDISTNYYASQKKTFEINPRHPLIKDMLRRVKEDEDDKTVSDLAVVLFETATLRSGYLLPDTKAYGDRIERMLRLSLNIDPDAKVEEEPEEEPEETTEDTTEDTEQDDEEEMDAGTDDEEQETVKKSTAEKDEL,sabio,P41148,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,4.319999999999999,1.0812962383427719e-14,,7.5,3.6.1.5,9615.0,0.635483746814912,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,0.635483746814912,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O__MRALWVLGLCCVLLTFGSVRADDEVDVDGTVEEDLGKSREGSRTDDEVVQREEEAIQLDGLNASQIRELREKSEKFAFQAEVNRMMKLIINSLYKNKEIFLRELISNASDALDKIRLISLTDENALAGNEELTVKIKCDKEKNLLHVTDTGVGMTREELVKNLGTIAKSGTSEFLNKMTEAQEDGQSTSELIGQFGVGFYSAFLVADKVIVTSKHNNDTQHIWESDSNEFSVIADPRGNTLGRGTTITLVLKEEASDYLELDTIKNLVKKYSQFINFPIYVWSSKTETVEEPMEEEEAAKEEKEDSDDEAAVEEEEEEKKPKTKKVEKTVWDWELMNDIKPIWQRPSKEVEDDEYKAFYKSFSKESDDPMAYIHFTAEGEVTFKSILFVPTSAPRGLFDEYGSKKSDYIKLYVRRVFITDDFHDMMPKYLNFVKGVVDSDDLPLNVSRETLQQHKLLKVIRKKLVRKTLDMIKKIADEKYNDTFWKEFGTNIKLGVIEDHSNRTRLAKLLRFQSSHHPSDITSLDQYVERMKEKQDKIYFMAGSSRKEAESSPFVERLLKKGYEVIYLTEPVDEYCIQALPEFDGKRFQNVAKEGVKFDESEKTKESREAIEKEFEPLLNWMKDKALKDKIEKAVVSQRLTESPCALVASQYGWSGNMERIMKAQAYQTGKDISTNYYASQKKTFEINPRHPLIKDMLRRVKEDEDDKTVSDLAVVLFETATLRSGYLLPDTKAYGDRIERMLRLSLNIDPDAKVEEEPEEEPEETTEDTTEDTEQDDEEEMDAGTDDEEQETVKKSTAEKDEL,./data/raw/alphafold//AF-P41148-F1-model_v4.pdb,30,2498,2786,5631
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+1104,10635,10790,MTTIAFLGLGNMGAPMSANLVGAGHVVRGFDPAPTAASGAAAHGVAVFRSAPEAVAEADVVITMLPTGEVVRRCYTDVLAAARPATLFIDSSTISVTDAREVHALAESHGMLQLDAPVSGGVKGAAAATLAFMVGGDESTLRRARPVLEPMAGKIIHCGAAGAGQAAKVCNNMVLAVQQIAIAEAFVLAEKLGLSAQSLFDVITGATGNCWAVHTNCPVPGPVPTSPANNDFKPGFSTALMNKDLGLAMDAVAATGATAPLGSHAADIYAKFAADHADLDFSAVIHTLRARADA,brenda,P9WNY5,C[C@H](CO)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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1>>CC(C=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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],0.205,0.0,30.0,8.5,1.1.1.31,1773.0,-0.6882461389442457,C[C@H](CO)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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,CC(C=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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],-0.6882461389442457,C[C@H](CO)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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MTTIAFLGLGNMGAPMSANLVGAGHVVRGFDPAPTAASGAAAHGVAVFRSAPEAVAEADVVITMLPTGEVVRRCYTDVLAAARPATLFIDSSTISVTDAREVHALAESHGMLQLDAPVSGGVKGAAAATLAFMVGGDESTLRRARPVLEPMAGKIIHCGAAGAGQAAKVCNNMVLAVQQIAIAEAFVLAEKLGLSAQSLFDVITGATGNCWAVHTNCPVPGPVPTSPANNDFKPGFSTALMNKDLGLAMDAVAATGATAPLGSHAADIYAKFAADHADLDFSAVIHTLRARADA,./data/raw/alphafold//AF-P9WNY5-F1-model_v4.pdb,3090,3619,1410,3372
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+1107,20455,20760,MKKRKILSLIAFLCISFIANAQQKLTSPDNNLVMTFQVDSKGAPTYELTYKNKVVIKPSTLGLELKKEDNTRTDFDWVDRRDLTKLDSKTNLYDGFEVKDTQTATFDETWQPVWGEEKEIRNHYNELAVTLYQPMNDRSIVIRFRLFNDGLGFRYEFPQQKSLNYFVIKEEHSQFGMNGDHIAFWIPGDYDTQEYDYTISRLSEIRGLMKEAITPNSSQTPFSQTGVQTALMMKTDDGLYINLHEAALVDYSCMHLNLDDKNMVFESWLTPDAKGDKGYMQTPCNTPWRTIIVSDDARNILASRITLNLNEPCKIADAASWVKPVKYIGVWWDMITGKGSWAYTDELTSVKLGETDYSKTKPNGKHSANTANVKRYIDFAAAHGFDAVLVEGWNEGWEDWFGNSKDYVFDFVTPYPDFDVKEIHRYAARKGIKMMMHHETSASVRNYERHMDKAYQFMADNGYNSVKSGYVGNIIPRGEHHYGQWMNNHYLYAVKKAADYKIMVNAHEATRPTGICRTYPNLIGNESARGTEYESFGGNKVYHTTILPFTRLVGGPMDYTPGIFETHCNKMNPANNSQVRSTIARQLALYVTMYSPLQMAADIPENYERFMDAFQFIKDVALDWDETNYLEAEPGEYITIARKAKDTDDWYVGCTAGENGHTSKLVFDFLTPGKQYIATVYADAKDADWKENPQAYTIKKGILTNKSKLNLHAANGGGYAISIKEVKDKSEAKGLKRL,sabio,G8JZS4,O.OCC1OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O>>OCC1OC(O)C(O)C(O)C1O.OCC1OC(OC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,321.0,3.318868293157318e-14,37.0,6.5,3.2.1.3,818.0,2.5065050324048723,O.OCC1OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,OCC1OC(O)C(O)C(O)C1O.OCC1OC(OC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,2.5065050324048723,O.OCC1OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O__MKKRKILSLIAFLCISFIANAQQKLTSPDNNLVMTFQVDSKGAPTYELTYKNKVVIKPSTLGLELKKEDNTRTDFDWVDRRDLTKLDSKTNLYDGFEVKDTQTATFDETWQPVWGEEKEIRNHYNELAVTLYQPMNDRSIVIRFRLFNDGLGFRYEFPQQKSLNYFVIKEEHSQFGMNGDHIAFWIPGDYDTQEYDYTISRLSEIRGLMKEAITPNSSQTPFSQTGVQTALMMKTDDGLYINLHEAALVDYSCMHLNLDDKNMVFESWLTPDAKGDKGYMQTPCNTPWRTIIVSDDARNILASRITLNLNEPCKIADAASWVKPVKYIGVWWDMITGKGSWAYTDELTSVKLGETDYSKTKPNGKHSANTANVKRYIDFAAAHGFDAVLVEGWNEGWEDWFGNSKDYVFDFVTPYPDFDVKEIHRYAARKGIKMMMHHETSASVRNYERHMDKAYQFMADNGYNSVKSGYVGNIIPRGEHHYGQWMNNHYLYAVKKAADYKIMVNAHEATRPTGICRTYPNLIGNESARGTEYESFGGNKVYHTTILPFTRLVGGPMDYTPGIFETHCNKMNPANNSQVRSTIARQLALYVTMYSPLQMAADIPENYERFMDAFQFIKDVALDWDETNYLEAEPGEYITIARKAKDTDDWYVGCTAGENGHTSKLVFDFLTPGKQYIATVYADAKDADWKENPQAYTIKKGILTNKSKLNLHAANGGGYAISIKEVKDKSEAKGLKRL,./data/raw/alphafold//AF-G8JZS4-F1-model_v4.pdb,988,516,159,172
+1108,4585,4641,DDRRSPLEECFQQNDYEEFLEIAKNGLKKTXNPKHVXV,sabio,P0C2D4,CC(N)C(=O)O.O.O=O>>CC(=O)C(=O)O.N.OO,6.23,1.0179184937146426e-14,25.0,8.5,1.4.3.2,8649.0,0.7944880466591696,CC(N)C(=O)O.O.O=O,CC(=O)C(=O)O.N.OO,0.7944880466591696,CC(N)C(=O)O.O.O=O__DDRRSPLEECFQQNDYEEFLEIAKNGLKKTXNPKHVXV,./data/raw/esmfold//ESMFold-P0C2D4-v1.pdb,1799,1474,3043,1791
+1109,20403,20708,MKISDGNWLIQPGLNLIHPLQVFEVEQQDNEMVVYAAPRDVRERTWQLDTPLFTLRFFSPQEGIVGVRIEHFQGALNNGPHYPLNILQDVKVTIENTERYAEFKSGNLSARVSKGEFWSLDFLRNGERITGSQVKNNGYVQDTNNQRNYMFERLDLGVGETVYGLGERFTALVRNGQTVETWNRDGGTSTEQAYKNIPFYMTNRGYGVLVNHPQCVSFEVGSEKVSKVQFSVESEYLEYFVIDGPTPKAVLDRYTRFTGRPALPPAWSFGLWLTTSFTTNYDEATVNSFIDGMAERNLPLHVFHFDCFWMKAFQWCDFEWDPLTFPDPEGMIRRLKAKGLKICVWINPYIGQKSPVFKELQEKGYLLKRPDGSLWQWDKWQPGLAIYDFTNPDACKWYADKLKGLVAMGVDCFKTDFGERIPTDVQWFDGSDPQKMHNHYAYIYNELVWNVLKDTVGEEEAVLFARSASVGAQKFPVHWGGDCYANYESMAESLRGGLSIGLSGFGFWSHDIGGFENTAPAHVYKRWCAFGLLSSHSRLHGSKSYRVPWAYDDESCDVVRFFTQLKCRMMPYLYREAARANARGTPMMRAMMMEFPDDPACDYLDRQYMLGDNVMVAPVFTEAGDVQFYLPEGRWTHLWHNDELDGSRWHKQQHGFLSLPVYVRDNTLLALGNNDQRPDYVWHEGTAFHLFNLQDGHEAVCEVPAADGSVIFTLKAARTGNTITVTGAGEAKNWTLCLRNVVKVNGLQDGSQAESEQGLVVKPQGNALTITL,sabio,P31434,O.OCC1OC(F)C(O)C1O>>OC1COC(O)C(O)C1O.[F-],75.0,0.2962405661486487,37.0,7.0,3.2.1.-,562.0,1.8750612633917,O.OCC1OC(F)C(O)C1O,OC1COC(O)C(O)C1O.[F-],1.8750612633917,O.OCC1OC(F)C(O)C1O__MKISDGNWLIQPGLNLIHPLQVFEVEQQDNEMVVYAAPRDVRERTWQLDTPLFTLRFFSPQEGIVGVRIEHFQGALNNGPHYPLNILQDVKVTIENTERYAEFKSGNLSARVSKGEFWSLDFLRNGERITGSQVKNNGYVQDTNNQRNYMFERLDLGVGETVYGLGERFTALVRNGQTVETWNRDGGTSTEQAYKNIPFYMTNRGYGVLVNHPQCVSFEVGSEKVSKVQFSVESEYLEYFVIDGPTPKAVLDRYTRFTGRPALPPAWSFGLWLTTSFTTNYDEATVNSFIDGMAERNLPLHVFHFDCFWMKAFQWCDFEWDPLTFPDPEGMIRRLKAKGLKICVWINPYIGQKSPVFKELQEKGYLLKRPDGSLWQWDKWQPGLAIYDFTNPDACKWYADKLKGLVAMGVDCFKTDFGERIPTDVQWFDGSDPQKMHNHYAYIYNELVWNVLKDTVGEEEAVLFARSASVGAQKFPVHWGGDCYANYESMAESLRGGLSIGLSGFGFWSHDIGGFENTAPAHVYKRWCAFGLLSSHSRLHGSKSYRVPWAYDDESCDVVRFFTQLKCRMMPYLYREAARANARGTPMMRAMMMEFPDDPACDYLDRQYMLGDNVMVAPVFTEAGDVQFYLPEGRWTHLWHNDELDGSRWHKQQHGFLSLPVYVRDNTLLALGNNDQRPDYVWHEGTAFHLFNLQDGHEAVCEVPAADGSVIFTLKAARTGNTITVTGAGEAKNWTLCLRNVVKVNGLQDGSQAESEQGLVVKPQGNALTITL,./data/raw/alphafold//AF-P31434-F1-model_v4.pdb,381,2952,5291,6168
+1110,7159,7280,MRIPLVGKDSIESKDIGFTLIHEHLRVFSEAVRQQWPHLYNEDEEFRNAVNEVKRAMQFGVKTIVDPTVMGLGRDIRFMEKVVKATGINLVAGTGIYIYIDLPFYFLNRSIDEIADLFIHDIKEGIQGTLNKAGFVKIAADEPGITKDVEKVIRAAAIANKETKVPIITHSNAHNNTGLEQQRILTEEGVDPGKILIGHLGDTDNIDYIKKIADKGSFIGLDRYGLDLFLPVDKRNETTLRLIKDGYSDKIMISHDYCCTIDWGTAKPEYKPKLAPRWSITLIFEDTIPFLKRNGVNEEVIATIFKENPKKFFS,brenda,Q97VT7,CCCCCCCC1CCC(=O)O1.O>>CCCCCCCC(O)CCC(=O)O,4.95,0.0,25.0,8.3,3.1.1.25,2287.0,0.6946051989335688,CCCCCCCC1CCC(=O)O1.O,CCCCCCCC(O)CCC(=O)O,0.6946051989335688,CCCCCCCC1CCC(=O)O1.O__MRIPLVGKDSIESKDIGFTLIHEHLRVFSEAVRQQWPHLYNEDEEFRNAVNEVKRAMQFGVKTIVDPTVMGLGRDIRFMEKVVKATGINLVAGTGIYIYIDLPFYFLNRSIDEIADLFIHDIKEGIQGTLNKAGFVKIAADEPGITKDVEKVIRAAAIANKETKVPIITHSNAHNNTGLEQQRILTEEGVDPGKILIGHLGDTDNIDYIKKIADKGSFIGLDRYGLDLFLPVDKRNETTLRLIKDGYSDKIMISHDYCCTIDWGTAKPEYKPKLAPRWSITLIFEDTIPFLKRNGVNEEVIATIFKENPKKFFS,./data/raw/alphafold//AF-Q97VT7-F1-model_v4.pdb,3234,2055,3706,2560
+1111,7296,7418,MQTQIKVRGYHLDVYQHVNNARYLEFLEEARWDGLENSDSFQWMTAHNIAFVVVNININYRRPAVLSDLLTITSQLQQLNGKSGILSQVITLEPEGQVVADALITFVCIDLKTQKALALEGELREKLEQMVK,brenda,P77712,CCCCCCCCCCCC(=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.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.CCCCCCCCCCCC(=O)O,1.6,5.8700527447669945e-15,25.0,7.5,3.1.2.20,562.0,0.2041199826559248,CCCCCCCCCCCC(=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.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.CCCCCCCCCCCC(=O)O,0.2041199826559248,CCCCCCCCCCCC(=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.O__MQTQIKVRGYHLDVYQHVNNARYLEFLEEARWDGLENSDSFQWMTAHNIAFVVVNININYRRPAVLSDLLTITSQLQQLNGKSGILSQVITLEPEGQVVADALITFVCIDLKTQKALALEGELREKLEQMVK,./data/raw/alphafold//AF-P77712-F1-model_v4.pdb,3279,2113,3781,2641
+1112,13952,14133,MKRICGSLLLLGLSISAALAAPASRPAAFDYANLSSVDKVALRTMPAVDVAKAKAEDLQRDKRGDIPRFALAIDVDMTPQNSGAWEYTADGQFAVWRQRVRSEKALSLNFGFTDYYMPAGGRLLVYPATQAPAGDRGLISQYDASNNNSARQLWTAVVPGAEAVIEAVIPRDKVGEFKLRLTKVNHDYVGFGPLARRLAAASGEKGVSGSCNIDVVCPEGDGRRDIIRAVGAYSKSGTLACTGSLVNNTANDRKMYFLTAHHCGMGTASTAASIVVYWNYQNSTCRAPNTPASGANGDGSMSQTQSGSTVKATYATSDFTLLELNNAANPAFNLFWAGWDRRDQNYPGAIAIHHPNVAEKRISNSTSPTSFVAWGGGAGTTHLNVQWQPSGGVTEPGSSGSPIYSPEKRVLGQLHGGPSSCSATGTNRSDQYGRVFTSWTGGGAAASRLSDWLDPASTGAQFIDGLDSGGGTPNTPPVANFTSTTSGLTATFTDSSTDSDGSIASRSWNFGDGSTSTATNPSKTYAAAGTYTVTLTVTDNGGATNTKTGSVTVSGGPGAQTYTNDTDVAIPDNATVESPITVSGRTGNGSATTPIQVTIYHTYKSDLKVDLVAPDGTVYNLHNRTGGSAHNIIQTFTKDLSSEAAQRAPGSCG,uniprot_search,P15636,N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1.O>>N,1.54,87.71306419960753,37.0,8.4,3.4.21.50,224.0,0.1875207208364631,N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1.O,N,0.1875207208364631,N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1.O__MKRICGSLLLLGLSISAALAAPASRPAAFDYANLSSVDKVALRTMPAVDVAKAKAEDLQRDKRGDIPRFALAIDVDMTPQNSGAWEYTADGQFAVWRQRVRSEKALSLNFGFTDYYMPAGGRLLVYPATQAPAGDRGLISQYDASNNNSARQLWTAVVPGAEAVIEAVIPRDKVGEFKLRLTKVNHDYVGFGPLARRLAAASGEKGVSGSCNIDVVCPEGDGRRDIIRAVGAYSKSGTLACTGSLVNNTANDRKMYFLTAHHCGMGTASTAASIVVYWNYQNSTCRAPNTPASGANGDGSMSQTQSGSTVKATYATSDFTLLELNNAANPAFNLFWAGWDRRDQNYPGAIAIHHPNVAEKRISNSTSPTSFVAWGGGAGTTHLNVQWQPSGGVTEPGSSGSPIYSPEKRVLGQLHGGPSSCSATGTNRSDQYGRVFTSWTGGGAAASRLSDWLDPASTGAQFIDGLDSGGGTPNTPPVANFTSTTSGLTATFTDSSTDSDGSIASRSWNFGDGSTSTATNPSKTYAAAGTYTVTLTVTDNGGATNTKTGSVTVSGGPGAQTYTNDTDVAIPDNATVESPITVSGRTGNGSATTPIQVTIYHTYKSDLKVDLVAPDGTVYNLHNRTGGSAHNIIQTFTKDLSSEAAQRAPGSCG,./data/raw/alphafold//AF-P15636-F1-model_v4.pdb,3179,1974,3619,2458
+1113,20650,20957,MHFAQIGSLLAASVALMGSSVDAATPAAWKTRTIYQIVTDRFGVANGVTPSSCGAGTNVYCGGTFQGIISKLDYIANMGFDAIWISPVVTNVDSQNAYHGYWSQDLYSINSHFGSTSDLQALSSALHSRGMYLMVDVVANHMGQQVNGNYASNNPSAYKPFNQPSHYHPFCTISNYNNQTNVEQCWLGSSQSDGLPDLNTENPTVYNGLYSWVKSLVGNYSIDGLRVDTVKHVRKDFWPGFNSNAGVYCTGEVLSGDPAYVSPYQGVMDGILNYPIFYPLTRAFQKPAQGFTEMKNMINTIRSQFKDPMLLTNFLENQDQPRFPSLTSDRALAKNAITYLLTGDGIPIIYYGQEQSFNGGNDPYNREALWTSNYNTQSEMYQHIAKVNKLRKAVKGLTTNNPITTPLTSVYDDSQAWVFRKAGMVVALSSAGSSGATQNLYVQASSLPSGQLQDVISCKTITVGTSGTVTIQLTGGQPAVYYPSSSLGGSGICGR,uniprot_search,A0A5C3FI84,O.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]1[C@H](O)[C@H]2O)O[C@@H]7CO)O[C@@H]6CO)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO>>,10.7,99.89917942131004,57.0,4.2,3.2.1.1,84753.0,1.0293837776852095,O.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]1[C@H](O)[C@H]2O)O[C@@H]7CO)O[C@@H]6CO)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO,,1.0293837776852095,O.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]1[C@H](O)[C@H]2O)O[C@@H]7CO)O[C@@H]6CO)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO__MHFAQIGSLLAASVALMGSSVDAATPAAWKTRTIYQIVTDRFGVANGVTPSSCGAGTNVYCGGTFQGIISKLDYIANMGFDAIWISPVVTNVDSQNAYHGYWSQDLYSINSHFGSTSDLQALSSALHSRGMYLMVDVVANHMGQQVNGNYASNNPSAYKPFNQPSHYHPFCTISNYNNQTNVEQCWLGSSQSDGLPDLNTENPTVYNGLYSWVKSLVGNYSIDGLRVDTVKHVRKDFWPGFNSNAGVYCTGEVLSGDPAYVSPYQGVMDGILNYPIFYPLTRAFQKPAQGFTEMKNMINTIRSQFKDPMLLTNFLENQDQPRFPSLTSDRALAKNAITYLLTGDGIPIIYYGQEQSFNGGNDPYNREALWTSNYNTQSEMYQHIAKVNKLRKAVKGLTTNNPITTPLTSVYDDSQAWVFRKAGMVVALSSAGSSGATQNLYVQASSLPSGQLQDVISCKTITVGTSGTVTIQLTGGQPAVYYPSSSLGGSGICGR,./data/raw/alphafold//AF-A0A5C3FI84-F1-model_v4.pdb,501,3181,5476,6359
+1114,14957,15167,MIVLFVDFDYFYAQVEEVLNPSLKGKPVVVCVFSGRFEDSGAVATANYEARKFGVKAGIPIVEAKKILPNAVYLPMRKEVYQQVSSRIMNLLREYSEKIEIASIDEAYLDISDKVRDYREAYNLGLEIKNKILEKEKITVTVGISKNKVFAKIAADMAKPNGIKVIDDEEVKRLIRELDIADVPGIGNITAEKLKKLGINKLVDTLSIEFDKLKGMIGEAKAKYLISLARDEYNEPIRTRVRKSIGRIVTMKRNSRNLEEIKPYLFRAIEESYYKLDKRIPKAIHVVAVTEDLDIVSRGRTFPHGISKETAYSESVKLLQKILEEDERKIRRIGVRFSKFIEAIGLDKFFDT,brenda,Q97W02,N=c1nc(O)c2ncn([C@H]3C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O3)c2[nH]1>>O=P(O)(O)OP(=O)(O)O,0.15,10000000.0,37.0,7.5,2.7.7.7,2287.0,-0.8239087409443188,N=c1nc(O)c2ncn([C@H]3C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O3)c2[nH]1,O=P(O)(O)OP(=O)(O)O,-0.8239087409443188,N=c1nc(O)c2ncn([C@H]3C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O3)c2[nH]1__MIVLFVDFDYFYAQVEEVLNPSLKGKPVVVCVFSGRFEDSGAVATANYEARKFGVKAGIPIVEAKKILPNAVYLPMRKEVYQQVSSRIMNLLREYSEKIEIASIDEAYLDISDKVRDYREAYNLGLEIKNKILEKEKITVTVGISKNKVFAKIAADMAKPNGIKVIDDEEVKRLIRELDIADVPGIGNITAEKLKKLGINKLVDTLSIEFDKLKGMIGEAKAKYLISLARDEYNEPIRTRVRKSIGRIVTMKRNSRNLEEIKPYLFRAIEESYYKLDKRIPKAIHVVAVTEDLDIVSRGRTFPHGISKETAYSESVKLLQKILEEDERKIRRIGVRFSKFIEAIGLDKFFDT,./data/raw/alphafold//AF-Q97W02-F1-model_v4.pdb,1911,4046,1899,3728
+1115,4656,4713,MASKGREGEHPSVTLFRQYLRIRTVQPEPDYGAAVAFLEERARQLGLGCQKVEVVPGHVVTVLTWPGTNPTLSSILLNSHTDVVPVFKEHWSHDPFEGFKDADGYIYGRGAQDMKCVSIQYLEAVRRLKVEGHHFPRTIHMTFVPDEEVGGHQGMELFVKRPEFQALRAGFALDEGLASPTDAFTVFYSERSPWWLRVTSTGKPGHGSRFIEDTAAEKLHKVINSILAFREKEKQRLQSNQLKPGAVTSVNLTMLEGGVAYNVVPATMSACFDFRVAPDVDLKAFEEQLQSWCQAAGEGVTFEFVQKWMETQVTSTDDSDPWWAAFSGVFKDMKLALELEICPASTDARYIRAAGVPALGFSPMNHTPVLLHDHDERLHEAVFLRGVDIYTQLLSALASVPALPSES,brenda,P37111,CC(O)=NC(CS[C@H]1CCCC[C@@H]1O)C(=O)O.O>>CC(=O)O.NC(CS[C@H]1CCCC[C@@H]1O)C(=O)O,30.0,1.0155760932474334e-14,37.0,7.6,3.5.1.14,9823.0,1.4771212547196624,CC(O)=NC(CS[C@H]1CCCC[C@@H]1O)C(=O)O.O,CC(=O)O.NC(CS[C@H]1CCCC[C@@H]1O)C(=O)O,1.4771212547196624,CC(O)=NC(CS[C@H]1CCCC[C@@H]1O)C(=O)O.O__MASKGREGEHPSVTLFRQYLRIRTVQPEPDYGAAVAFLEERARQLGLGCQKVEVVPGHVVTVLTWPGTNPTLSSILLNSHTDVVPVFKEHWSHDPFEGFKDADGYIYGRGAQDMKCVSIQYLEAVRRLKVEGHHFPRTIHMTFVPDEEVGGHQGMELFVKRPEFQALRAGFALDEGLASPTDAFTVFYSERSPWWLRVTSTGKPGHGSRFIEDTAAEKLHKVINSILAFREKEKQRLQSNQLKPGAVTSVNLTMLEGGVAYNVVPATMSACFDFRVAPDVDLKAFEEQLQSWCQAAGEGVTFEFVQKWMETQVTSTDDSDPWWAAFSGVFKDMKLALELEICPASTDARYIRAAGVPALGFSPMNHTPVLLHDHDERLHEAVFLRGVDIYTQLLSALASVPALPSES,./data/raw/alphafold//AF-P37111-F1-model_v4.pdb,2954,1690,3302,2102
+1116,21750,22075,MRPSSRFVGALAAAASFLPSALAQNNAAVTFTDPDTGIVFNSWGLANGAPQTQGGFTFGVALPSDALTTDATEFIGYLECASADNQGWCGVSMGGPMTNSLLITAWPHEDNVYTSLRFATGYAMPDVYSGDATITQISSSINATHFKLIFRCQNCLQWTHDGASGGASTSAGVLVLGWVQAFPSPGNPTCPDQITLEQHNNGMGIWGAVMDSNVANPSYTEWAAQATKTVEAECDGPSETDIVGVPVPTGTTFDYIVVGGGAGGIPTADKLSEAGKSVLLIEKGIASTAEHGGTLGPEWLEGNDLTRFDVPGLCNQIWVDSKGIACEDTDQMAGCVLGGGTAVNAGLWFKPYSLDWDYLFPSGWKYRDIQAAIGRVFSRIPGTDAPSTDGKRYYQQGFDVLAGGLSAGGWNKVTANSSPDKKNRTFSNAPFMFSGGERGGPLATYLTSAKKRSNFNLWLNTSVKRVIREGGHVTGVEVEPFRTGGYQGIVNVTAVSGRVVLSAGTFGSAKILLRGGIGPADQLEVVKASKIDGPTMISNASWIPLPVGYNLDDHLNTDTVITHPDVAFYDFYEAWNTPIEADKNSYLSSRTGILAQAAPNIGPMMWEEIKGADGIVRQLQWTARVEGSFDTPNGQAMTISQYLGRGATSRGRMTITPSLTTVVSDVPYLKDPNDKEAVIQGIVNLQNALKNVAGLTWTYPNSSITPREYVDNMVVSPSNRRANHWMGTAKIGTDDGRLAGGSAVVDLNTKVYGTDNLFVVDASIFPGTPTTNPSAYIVTAAEHASQRILGLAAPKPVGKWGQCGGRQWTGSFQCVSGTKCEVVNEWYSQCL,brenda,E7D6C0,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)cc1,33.7,0.0,30.0,6.0,1.1.99.18,1934350.0,1.5276299008713388,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)cc1,1.5276299008713388,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__MRPSSRFVGALAAAASFLPSALAQNNAAVTFTDPDTGIVFNSWGLANGAPQTQGGFTFGVALPSDALTTDATEFIGYLECASADNQGWCGVSMGGPMTNSLLITAWPHEDNVYTSLRFATGYAMPDVYSGDATITQISSSINATHFKLIFRCQNCLQWTHDGASGGASTSAGVLVLGWVQAFPSPGNPTCPDQITLEQHNNGMGIWGAVMDSNVANPSYTEWAAQATKTVEAECDGPSETDIVGVPVPTGTTFDYIVVGGGAGGIPTADKLSEAGKSVLLIEKGIASTAEHGGTLGPEWLEGNDLTRFDVPGLCNQIWVDSKGIACEDTDQMAGCVLGGGTAVNAGLWFKPYSLDWDYLFPSGWKYRDIQAAIGRVFSRIPGTDAPSTDGKRYYQQGFDVLAGGLSAGGWNKVTANSSPDKKNRTFSNAPFMFSGGERGGPLATYLTSAKKRSNFNLWLNTSVKRVIREGGHVTGVEVEPFRTGGYQGIVNVTAVSGRVVLSAGTFGSAKILLRGGIGPADQLEVVKASKIDGPTMISNASWIPLPVGYNLDDHLNTDTVITHPDVAFYDFYEAWNTPIEADKNSYLSSRTGILAQAAPNIGPMMWEEIKGADGIVRQLQWTARVEGSFDTPNGQAMTISQYLGRGATSRGRMTITPSLTTVVSDVPYLKDPNDKEAVIQGIVNLQNALKNVAGLTWTYPNSSITPREYVDNMVVSPSNRRANHWMGTAKIGTDDGRLAGGSAVVDLNTKVYGTDNLFVVDASIFPGTPTTNPSAYIVTAAEHASQRILGLAAPKPVGKWGQCGGRQWTGSFQCVSGTKCEVVNEWYSQCL,./data/raw/alphafold//AF-E7D6C0-F1-model_v4.pdb,3515,3443,5820,3114
+1117,8085,8213,MRLTVLCAVCLLPGSLALPLPQEAGGMSELQWEQAQDYLKRFYLYDSETKNANSLEAKLKEMQKFFGLPITGMLNSRVIEIMQKPRCGVPDVAEYSLFPNSPKWTSKVVTYRIVSYTRDLPHITVDRLVSKALNMWGKEIPLHFRKVVWGTADIMIGFARGAHGDSYPFDGPGNTLAHAFAPGTGLGGDAHFDEDERWTDGSSLGINFLYAATHELGHSLGMGHSSDPNAVMYPTYGNGDPQNFKLSQDDIKGIQKLYGKRSNSRKK,uniprot_search,P09237,CC[C@H](C)[C@H](N=C(O)CN=C(O)[C@H](CCC(=N)O)N=C(O)[C@@H]1CCCN1C(=O)CN)C(O)=N[C@@H](C)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(=O)O.O>>,0.222,99.86591651425844,25.0,7.125,3.4.24.23,9606.0,-0.6536470255493614,CC[C@H](C)[C@H](N=C(O)CN=C(O)[C@H](CCC(=N)O)N=C(O)[C@@H]1CCCN1C(=O)CN)C(O)=N[C@@H](C)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(=O)O.O,,-0.6536470255493614,CC[C@H](C)[C@H](N=C(O)CN=C(O)[C@H](CCC(=N)O)N=C(O)[C@@H]1CCCN1C(=O)CN)C(O)=N[C@@H](C)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(=O)O.O__MRLTVLCAVCLLPGSLALPLPQEAGGMSELQWEQAQDYLKRFYLYDSETKNANSLEAKLKEMQKFFGLPITGMLNSRVIEIMQKPRCGVPDVAEYSLFPNSPKWTSKVVTYRIVSYTRDLPHITVDRLVSKALNMWGKEIPLHFRKVVWGTADIMIGFARGAHGDSYPFDGPGNTLAHAFAPGTGLGGDAHFDEDERWTDGSSLGINFLYAATHELGHSLGMGHSSDPNAVMYPTYGNGDPQNFKLSQDDIKGIQKLYGKRSNSRKK,./data/raw/alphafold//AF-P09237-F1-model_v4.pdb,1863,1560,3145,1916
+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
+1122,13208,13383,MRAAVIKEWGTPLEVTDVPKPEPGPGEVLVRISASGVCHTDIHQWKGDWPPVQALMIQHGVRILGHEGIGVVEEVGLGVSTLKKGDRVGVPWMNYWCGRCEYCLSGYPHWCPHAKYTSVHVDGTHAEYAIISERATPRIPKEISDVEAAPLMCAGVTAYGAVRKLITEAAIPPGKPIAIIGAAGGLGHYAVQIAKAFGYTVVGIDVGAERVKFVEKLGADYAVDVGEADKFVMDKWGGVYASVVFTPRLEGYRLGLRLLRPLGALVFVGLPDMKEGGLELYPLVVVGRGIRIFGSSVGVTHEFEELFNLVVQGKVKSHVTKTASLSEINEVFKDLEEGKIVGRAVLKI,brenda,A3MVR8,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.O=CCCCC=O.[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)c1,93.13,7.132147912478201,80.0,10.0,1.1.1.1,181486.0,1.9690896029549207,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.O=CCCCC=O.[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)c1,1.9690896029549207,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.O=CCCCC=O.[H+]__MRAAVIKEWGTPLEVTDVPKPEPGPGEVLVRISASGVCHTDIHQWKGDWPPVQALMIQHGVRILGHEGIGVVEEVGLGVSTLKKGDRVGVPWMNYWCGRCEYCLSGYPHWCPHAKYTSVHVDGTHAEYAIISERATPRIPKEISDVEAAPLMCAGVTAYGAVRKLITEAAIPPGKPIAIIGAAGGLGHYAVQIAKAFGYTVVGIDVGAERVKFVEKLGADYAVDVGEADKFVMDKWGGVYASVVFTPRLEGYRLGLRLLRPLGALVFVGLPDMKEGGLELYPLVVVGRGIRIFGSSVGVTHEFEELFNLVVQGKVKSHVTKTASLSEINEVFKDLEEGKIVGRAVLKI,./data/raw/alphafold//AF-A3MVR8-F1-model_v4.pdb,2260,4512,4430,4321
+1123,21454,21778,MGSRRITLLGALFAVLAVAIEGRTLLTHNLKAEAAETVDAVSSVVAGSAGRQLLVSEPHDYNYEKVGFDWTGGVCVNTGTSKQSPINIETDSLAEESERLGTADDTSRLALKGLLSSSYQLTSEVAINLEQDMQFSFNAPDEDLPQLTIGGVVHTFKPVQIHFHHFASEHAIDGQLYPLEAHMVMASQNDGSDQLAVIGIMYKYGEEDPFLKRLQETAQSNGEAGDKNVELNSFSINVARDLLPESDLTYYGYDGSLTTPGCDERVKWHVFKEARTVSVAQLKVFSEVTLAAHPEATVTNNRVIQPLNGRKVYEYKGEPNDKYNYVQHGFDWRDNGLDSCAGDVQSPIDIVTSTLQAGSSRSDVSSVNLMTLNTDAFTLTGNTVNIGQGMQINFGDPPAGDLPVIRIGTRDVTFRPLQVHWHFFLSEHTVDGVHYPLEAHIVMKDNDNLGDSAGQLAVIGIMYKYGDADPFITDMQKRVSDKIASGAITYGQSGVSLNNPDDPFNVNIKNNFLPSELGYAGYDGSLTTPPCSEIVKWHVFLEPRTVSVEQMEVFADVTLNSNPGATVTTNRMIQPLEGRTVYGYNGAAA,brenda,P54212,O=C(O)O>>O.O=C=O,39400.0,5.682159936665122e-15,40.0,8.0,4.2.1.1,3046.0,4.595496221825575,O=C(O)O,O.O=C=O,4.653212513775344,O=C(O)O__MGSRRITLLGALFAVLAVAIEGRTLLTHNLKAEAAETVDAVSSVVAGSAGRQLLVSEPHDYNYEKVGFDWTGGVCVNTGTSKQSPINIETDSLAEESERLGTADDTSRLALKGLLSSSYQLTSEVAINLEQDMQFSFNAPDEDLPQLTIGGVVHTFKPVQIHFHHFASEHAIDGQLYPLEAHMVMASQNDGSDQLAVIGIMYKYGEEDPFLKRLQETAQSNGEAGDKNVELNSFSINVARDLLPESDLTYYGYDGSLTTPGCDERVKWHVFKEARTVSVAQLKVFSEVTLAAHPEATVTNNRVIQPLNGRKVYEYKGEPNDKYNYVQHGFDWRDNGLDSCAGDVQSPIDIVTSTLQAGSSRSDVSSVNLMTLNTDAFTLTGNTVNIGQGMQINFGDPPAGDLPVIRIGTRDVTFRPLQVHWHFFLSEHTVDGVHYPLEAHIVMKDNDNLGDSAGQLAVIGIMYKYGDADPFITDMQKRVSDKIASGAITYGQSGVSLNNPDDPFNVNIKNNFLPSELGYAGYDGSLTTPPCSEIVKWHVFLEPRTVSVEQMEVFADVTLNSNPGATVTTNRMIQPLEGRTVYGYNGAAA,./data/raw/alphafold//AF-P54212-F1-model_v4.pdb,655,33,5739,6641
+1124,12716,12887,MVEIDPFEMAVQQLERAAQFMDISEEALEWLKRPMRIVEVSVPVEMDDGSVKVFTGFRVQHNWARGPTKGGIRWHPAETLSTVKALATWMTWKVAVVDLPYGGGKGGIIVDPKKLSEREQERLARSYIRAVYDVIGPWTDIPAPDVYTNPKIMAWMMDEYETIMRRKGPAFGVITGKPPGVGGIVARMDATARGAAFTIREAAKALGWDDLKGKTIAIQGYGNAGYYLHKIMSEEFGMKVVAVSDSKGGIYNPDGLPPADEVLKWKKEHGSVKDMPGTQNITNEELLELEVDILAPSAIEGVITKENADNVKAKIVAEVANGPVTPEADEILHEKGILQIPDFLCNAGGVTVSYFEWVQNINGFYWTVEETRKRLDDKMTKAFWDVFNTHKEKNIHMRDAAYVVAVSRVYEAMKHRGWVKK,sabio,O59650,N.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)CCC(=O)C(=O)O.[H]>>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.NC(CCC(=O)O)C(=O)O.O,324000.0,6.847919890036056e-15,70.0,7.6,1.4.1.3,311400.0,5.510545010206612,N.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)CCC(=O)C(=O)O.[H],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.NC(CCC(=O)O)C(=O)O.O,5.510545010206612,N.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)CCC(=O)C(=O)O.[H]__MVEIDPFEMAVQQLERAAQFMDISEEALEWLKRPMRIVEVSVPVEMDDGSVKVFTGFRVQHNWARGPTKGGIRWHPAETLSTVKALATWMTWKVAVVDLPYGGGKGGIIVDPKKLSEREQERLARSYIRAVYDVIGPWTDIPAPDVYTNPKIMAWMMDEYETIMRRKGPAFGVITGKPPGVGGIVARMDATARGAAFTIREAAKALGWDDLKGKTIAIQGYGNAGYYLHKIMSEEFGMKVVAVSDSKGGIYNPDGLPPADEVLKWKKEHGSVKDMPGTQNITNEELLELEVDILAPSAIEGVITKENADNVKAKIVAEVANGPVTPEADEILHEKGILQIPDFLCNAGGVTVSYFEWVQNINGFYWTVEETRKRLDDKMTKAFWDVFNTHKEKNIHMRDAAYVVAVSRVYEAMKHRGWVKK,./data/raw/alphafold//AF-O59650-F1-model_v4.pdb,2148,4362,4252,4120
+1125,815,837,MPMSDAYRALYQRSIDDPAAFWGEQAQRIDWQTPYAAVLDDARLPFARWFVGGRTNLCHNAVDRHLATRGEQAALVYVSTETGIETTYTYRALHREVNRMAACLQALGVRRGDRVLIYLPMIPEAAFAMLACARIGAIHSVVFGGFASNSLATRIDDATPRVIVSADAGSRGGKVVEYKPLLDAAIDLAVHKPAHVLLVDRKLAPMQHRPHDIDYAALARQHTHADVPCEWMESSEPSYILYTSGTTGKPKGVQRDTGGYAVALAASMPLIFGAQAGDTMFTASDVGWVVGHSYIVYAPLLAGLATVMYEGTPVRPDGAIWWRIVEQYRVNVMFTAPTAIRVLKKQDPALLRRHDLSSLRRLFLAGEPLDEPTARWIGDALGKPIIDNYWQTETGWPMLAIPQGVAPSTPKLGSPGFPVYGYRLDILDEATGQPCAPGEKGLLAVAAPLPPGCMSTVWGDDARFLKTYWSAFPGRPLYSSFDWGVRDEAGYITILGRTDDVINVAGHRLGTREIEESLSSHPAIAEVAVVGVADPLKGQVAMGFAIVRDAARVAEPAGRMALEGELMRTVEGQLGAVARPSRVFFVNALPKTRSGKLLRRAMQAVAEGRDPGDLTTIEDPTALAQVREAMQA,sabio,Q8XZ86,C=CC(=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.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>C=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.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,1.3,8.438211168350006e-15,37.0,8.0,6.2.1.17,305.0,0.1139433523068367,C=CC(=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.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,C=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.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,0.1139433523068367,C=CC(=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.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MPMSDAYRALYQRSIDDPAAFWGEQAQRIDWQTPYAAVLDDARLPFARWFVGGRTNLCHNAVDRHLATRGEQAALVYVSTETGIETTYTYRALHREVNRMAACLQALGVRRGDRVLIYLPMIPEAAFAMLACARIGAIHSVVFGGFASNSLATRIDDATPRVIVSADAGSRGGKVVEYKPLLDAAIDLAVHKPAHVLLVDRKLAPMQHRPHDIDYAALARQHTHADVPCEWMESSEPSYILYTSGTTGKPKGVQRDTGGYAVALAASMPLIFGAQAGDTMFTASDVGWVVGHSYIVYAPLLAGLATVMYEGTPVRPDGAIWWRIVEQYRVNVMFTAPTAIRVLKKQDPALLRRHDLSSLRRLFLAGEPLDEPTARWIGDALGKPIIDNYWQTETGWPMLAIPQGVAPSTPKLGSPGFPVYGYRLDILDEATGQPCAPGEKGLLAVAAPLPPGCMSTVWGDDARFLKTYWSAFPGRPLYSSFDWGVRDEAGYITILGRTDDVINVAGHRLGTREIEESLSSHPAIAEVAVVGVADPLKGQVAMGFAIVRDAARVAEPAGRMALEGELMRTVEGQLGAVARPSRVFFVNALPKTRSGKLLRRAMQAVAEGRDPGDLTTIEDPTALAQVREAMQA,./data/raw/alphafold//AF-Q8XZ86-F1-model_v4.pdb,1182,798,502,573
+1126,7765,7890,MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMLSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVKYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDHWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,sabio,Q6GWS9,CCN1CCN(C(=O)NC(C(=O)NC2C(=O)N3C2SC(C)(C)C3C(=O)O)c2ccccc2)C(=O)C1=O.O>>,152.0,99.81363415265972,,,3.5.2.6,562.0,2.1818435879447726,CCN1CCN(C(=O)NC(C(=O)NC2C(=O)N3C2SC(C)(C)C3C(=O)O)c2ccccc2)C(=O)C1=O.O,,2.1818435879447726,CCN1CCN(C(=O)NC(C(=O)NC2C(=O)N3C2SC(C)(C)C3C(=O)O)c2ccccc2)C(=O)C1=O.O__MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMLSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVKYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDHWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,./data/raw/alphafold//AF-Q6GWS9-F1-model_v4.pdb,1458,402,35,1091
+1127,22851,23193,MKYFPLFPTLVFAARVVAFPAYASLAGLSQQELDAIIPTLEAREPGLPPGPLENSSAKLVNDEAHPWKPLRPGDIRGPCPGLNTLASHGYLPRNGVATPVQIINAVQEGLNFDNQAAVFATYAAHLVDGNLITDLLSIGRKTRLTGPDPPPPASVGGLNEHGTFEGDASMTRGDAFFGNNHDFNETLFEQLVDYSNRFGGGKYNLTVAGELRFKRIQDSIATNPNFSFVDFRFFTAYGETTFPANLFVDGRRDDGQLDMDAARSFFQFSRMPDDFFRAPSPRSGTGVEVVIQAHPMQPGRNVGKINSYTVDPTSSDFSTPCLMYEKFVNITVKSLYPNPTVQLRKALNTNLDFFFQGVAAGCTQVFPYGRD,brenda,B9W4V6,OC1CCCCC1.OO>>O.O=C1CCCCC1,5.0,7.16772435196053,22.0,7.0,1.11.2.1,1973307.0,0.6989700043360189,OC1CCCCC1.OO,O.O=C1CCCCC1,0.6989700043360189,OC1CCCCC1.OO__MKYFPLFPTLVFAARVVAFPAYASLAGLSQQELDAIIPTLEAREPGLPPGPLENSSAKLVNDEAHPWKPLRPGDIRGPCPGLNTLASHGYLPRNGVATPVQIINAVQEGLNFDNQAAVFATYAAHLVDGNLITDLLSIGRKTRLTGPDPPPPASVGGLNEHGTFEGDASMTRGDAFFGNNHDFNETLFEQLVDYSNRFGGGKYNLTVAGELRFKRIQDSIATNPNFSFVDFRFFTAYGETTFPANLFVDGRRDDGQLDMDAARSFFQFSRMPDDFFRAPSPRSGTGVEVVIQAHPMQPGRNVGKINSYTVDPTSSDFSTPCLMYEKFVNITVKSLYPNPTVQLRKALNTNLDFFFQGVAAGCTQVFPYGRD,./data/raw/alphafold//AF-B9W4V6-F1-model_v4.pdb,1077,646,323,362
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+1135,14710,14918,MVEATAQETDRPRFSFSIAAREGKARTGTIEMKRGVIRTPAFMPVGTAATVKALKPETVRATGADIILGNTYHLMLRPGAERIAKLGGLHSFMGWDRPILTDSGGYQVMSLSSLTKQSEEGVTFKSHLDGSRHMLSPERSIEIQHLLGSDIVMAFDECTPYPATPSRAASSMERSMRWAKRSRDAFDSRKEQAENAALFGIQQGSVFENLRQQSADALAEIGFDGYAVGGLAVGEGQDEMFRVLDFSVPMLPDDKPHYLMGVGKPDDIVGAVERGIDMFDCVLPTRSGRNGQAFTWDGPINIRNARFSEDLTPLDSECHCAVCQKWSRAYIHHLIRAGEILGAMLMTEHNIAFYQQLMQKIRDSISEGRFSQFAQDFRARYFARNS,brenda,P28720,N=c1nc(O)c2c(CN)c[nH]c2[nH]1>>N=c1nc(O)c2nc[nH]c2[nH]1,0.102,8.467547206258763,37.0,7.3,2.4.2.29,542.0,-0.9913998282380824,N=c1nc(O)c2c(CN)c[nH]c2[nH]1,N=c1nc(O)c2nc[nH]c2[nH]1,-0.9913998282380824,N=c1nc(O)c2c(CN)c[nH]c2[nH]1__MVEATAQETDRPRFSFSIAAREGKARTGTIEMKRGVIRTPAFMPVGTAATVKALKPETVRATGADIILGNTYHLMLRPGAERIAKLGGLHSFMGWDRPILTDSGGYQVMSLSSLTKQSEEGVTFKSHLDGSRHMLSPERSIEIQHLLGSDIVMAFDECTPYPATPSRAASSMERSMRWAKRSRDAFDSRKEQAENAALFGIQQGSVFENLRQQSADALAEIGFDGYAVGGLAVGEGQDEMFRVLDFSVPMLPDDKPHYLMGVGKPDDIVGAVERGIDMFDCVLPTRSGRNGQAFTWDGPINIRNARFSEDLTPLDSECHCAVCQKWSRAYIHHLIRAGEILGAMLMTEHNIAFYQQLMQKIRDSISEGRFSQFAQDFRARYFARNS,./data/raw/alphafold//AF-P28720-F1-model_v4.pdb,932,4348,4236,4100
+1136,15792,16019,MASHLVLYTGAKMPILGLGTWKSPPGKVTEAVKVAIDLGYRHIDCAHVYQNENEVGLGLQEKLQGQVVKREDLFIVSKLWCTDHEKNLVKGACQTTLRDLKLDYLDLYLIHWPTGFKPGKDPFPLDGDGNVVPDESDFVETWEAMEELVDEGLVKAIGVSNFNHLQVEKILNKPGLKYKPAVNQIEVHPYLTQEKLIEYCKSKGIVVTAYSPLGSPDRPWAKPEDPSLLEDPRIKAIAAKYNKTTAQVLIRFPMQRNLIVIPKSVTPERIAENFQVFDFELSPEDMNTLLSYNRNWRVCALMSCASHKDYPFHEEY,sabio,P80276,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.O=CCCC(=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.O=C(O)CCC(=O)O.[H],13.0,0.0,30.0,6.5,1.1.1.21,9823.0,1.1139433523068367,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.O=CCCC(=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.O=C(O)CCC(=O)O.[H],1.1139433523068367,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.O=CCCC(=O)O__MASHLVLYTGAKMPILGLGTWKSPPGKVTEAVKVAIDLGYRHIDCAHVYQNENEVGLGLQEKLQGQVVKREDLFIVSKLWCTDHEKNLVKGACQTTLRDLKLDYLDLYLIHWPTGFKPGKDPFPLDGDGNVVPDESDFVETWEAMEELVDEGLVKAIGVSNFNHLQVEKILNKPGLKYKPAVNQIEVHPYLTQEKLIEYCKSKGIVVTAYSPLGSPDRPWAKPEDPSLLEDPRIKAIAAKYNKTTAQVLIRFPMQRNLIVIPKSVTPERIAENFQVFDFELSPEDMNTLLSYNRNWRVCALMSCASHKDYPFHEEY,./data/raw/alphafold//AF-P80276-F1-model_v4.pdb,1329,607,3631,4939
+1137,15618,15842,MASPTLKLNSGYDMPQVGFGLWKVDNAVCADTVYNAIKAGYRLFDGACDYGNEKECGEGVARAIKDGLVKREDLFIVSKLWQTFHDEDKVEPITRRQLADWQIDYFDLFLVHFPAALEYVDPSVRYPPGWFYDGKSEVRWSKTTTLQQTWGAMERLVDKGLARSIGVSNYQAQSVYDALIYARIKPATLQIEHHPYLQQPDLVSLAQTEGIVVTAYSSFGPTGFMELDMPRAKSVAPLMDSPVIKALADKHRRTPAQVLLRWATQRGIAVIPKTSRPEVMAQNLDNTSFDLDSEDLAKIADMDLNIRFNKPTNYFSANKLYLFG,sabio,Q876L8,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)C(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)C(O)CO,16.43,6.336613912379397e-15,30.0,7.0,1.1.1.-,51453.0,1.2156375634350618,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)C(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)C(O)CO,1.2156375634350618,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)C(O)C1O.[H]__MASPTLKLNSGYDMPQVGFGLWKVDNAVCADTVYNAIKAGYRLFDGACDYGNEKECGEGVARAIKDGLVKREDLFIVSKLWQTFHDEDKVEPITRRQLADWQIDYFDLFLVHFPAALEYVDPSVRYPPGWFYDGKSEVRWSKTTTLQQTWGAMERLVDKGLARSIGVSNYQAQSVYDALIYARIKPATLQIEHHPYLQQPDLVSLAQTEGIVVTAYSSFGPTGFMELDMPRAKSVAPLMDSPVIKALADKHRRTPAQVLLRWATQRGIAVIPKTSRPEVMAQNLDNTSFDLDSEDLAKIADMDLNIRFNKPTNYFSANKLYLFG,./data/raw/alphafold//AF-Q876L8-F1-model_v4.pdb,1329,4592,2085,4946
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+1139,12120,12283,MGSQQEHIVMLPFMAQGHIIPFLALAKQIQQRTGFTITIANTPLNIQYLRTTISTSDDSSRPCIRLAELPFCSSDHGLPPNTENTEALSFHQIVDLFHASKTLQAPFHSLVSGIIEKEGRPPLCIISDVFFGWATEVAKSLGTSNVTFTTGGGYGTAAYISLWQNLPHRATDSDYFALPGFPDSCRFHITQLHQYLRAADGTDAWSRYFQPQIALSLDSSGWLCNTAEEIEPHGLEILRNYVKPPVWTIGPLLPPALLNHSLSSGSSIFGQRAWKVSGVSPEKCLDWLDKHPQSSVLYISFGSQNTISPSQMMELALGLEDSGKPFIWVIRPPVGFDIEGEFRAEWLPQNFEQRMAESNQGLIVHKWAPQLEILSHKSTGVFLSHCGWNSVMESLCVGVPIIGWPLAAEQCYNSKMLTEDMGVAVELTRGRQGALERKEVKRVIELVMDSKGKGEEMKKKATEIGEKIRDAMREGGSSLKAMDDFVSTMLSKRQGY,sabio,F6I4A7,Cc1ccc(C(C)C)cc1O.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1>>O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,0.09,27.84759343986364,30.0,8.0,2.4.1.-,29760.0,-1.0457574905606752,Cc1ccc(C(C)C)cc1O.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,-1.0457574905606752,Cc1ccc(C(C)C)cc1O.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1__MGSQQEHIVMLPFMAQGHIIPFLALAKQIQQRTGFTITIANTPLNIQYLRTTISTSDDSSRPCIRLAELPFCSSDHGLPPNTENTEALSFHQIVDLFHASKTLQAPFHSLVSGIIEKEGRPPLCIISDVFFGWATEVAKSLGTSNVTFTTGGGYGTAAYISLWQNLPHRATDSDYFALPGFPDSCRFHITQLHQYLRAADGTDAWSRYFQPQIALSLDSSGWLCNTAEEIEPHGLEILRNYVKPPVWTIGPLLPPALLNHSLSSGSSIFGQRAWKVSGVSPEKCLDWLDKHPQSSVLYISFGSQNTISPSQMMELALGLEDSGKPFIWVIRPPVGFDIEGEFRAEWLPQNFEQRMAESNQGLIVHKWAPQLEILSHKSTGVFLSHCGWNSVMESLCVGVPIIGWPLAAEQCYNSKMLTEDMGVAVELTRGRQGALERKEVKRVIELVMDSKGKGEEMKKKATEIGEKIRDAMREGGSSLKAMDDFVSTMLSKRQGY,./data/raw/alphafold//AF-F6I4A7-F1-model_v4.pdb,1243,3059,596,683
+1140,22023,22355,MALSKISPTEGSRRILEDHHIDEDVGFALPHPLVELPDAYSPWVLVARNLPVLIENGQLREEVEKLPTLSTDGLRGHRLQRLAHLALGYITMAYVWNRGDDDVRKVLPRNIAVPYCELSEKLGLPPILSYADCVLANWKKKDPNGPMTYENMDILFSFPGGDCDKGFFLVSLLVEIAASPAIKAIPTVSSAVERQDLKALEKALHDIATSLEKAKEIFKRMRDFVDPDTFFHVLRIYLSGWKCSSKLPEGLLYEGVWDTPKMFSGGSAGQSSIFQSLDVLLGIKHEAGKESPAEFLQEMREYMPPAHRNFLFFLESAPPVREFVISRHNEDLTKAYNECVNGLVSVRKFHLAIVDTYIMKPSKKKPTDGDKSEEPSNVESRGTGGTNPMTFLRSVKDTTEKALLSWP,sabio,P28776,O=O.O=O>>NC(CC(=O)c1ccccc1NC=O)C(=O)O,42848.4,57.17724078174639,37.0,6.5,1.13.11.52,10090.0,4.631934609593069,O=O.O=O,NC(CC(=O)c1ccccc1NC=O)C(=O)O,4.691525289385238,O=O.O=O__MALSKISPTEGSRRILEDHHIDEDVGFALPHPLVELPDAYSPWVLVARNLPVLIENGQLREEVEKLPTLSTDGLRGHRLQRLAHLALGYITMAYVWNRGDDDVRKVLPRNIAVPYCELSEKLGLPPILSYADCVLANWKKKDPNGPMTYENMDILFSFPGGDCDKGFFLVSLLVEIAASPAIKAIPTVSSAVERQDLKALEKALHDIATSLEKAKEIFKRMRDFVDPDTFFHVLRIYLSGWKCSSKLPEGLLYEGVWDTPKMFSGGSAGQSSIFQSLDVLLGIKHEAGKESPAEFLQEMREYMPPAHRNFLFFLESAPPVREFVISRHNEDLTKAYNECVNGLVSVRKFHLAIVDTYIMKPSKKKPTDGDKSEEPSNVESRGTGGTNPMTFLRSVKDTTEKALLSWP,./data/raw/alphafold//AF-P28776-F1-model_v4.pdb,2630,3525,2237,5121
+1141,6654,6767,MSTAGKVIKCKAAVLWEVKKPFSIEDVEVAPPKAYEVRIKMVAVGICHTDDHVVSGNLVTPLPVILGHEAAGIVESVGEGVTTVKPGDKVIPLFTPQCGKCRVCKNPESNYCLKNDLGNPRGTLQDGTRRFTCRGKPIHHFLGTSTFSQYTVVDENAVAKIDAASPLEKVCLIGCGFSTGYGSAVNVAKVTPGSTCAVFGLGGVGLSAVMGCKAAGAARIIAVDINKDKFAKAKELGATECINPQDYKKPIQEVLKEMTDGGVDFSFEVIGRLDTMMASLLCCHEACGTSVIVGVPPASQNLSINPMLLLTGRTWKGAVYGGFKSKEGIPKLVADFMAKKFSLDALITHVLPFEKINEGFDLLHSGKSIRTVLTF,sabio,P00325,CCCC=O>>CCCC(=O)O.CCCCO,4500.0,38.29503348403984,37.0,7.5,1.2.98.1,9606.0,3.653212513775344,CCCC=O,CCCC(=O)O.CCCCO,3.653212513775344,CCCC=O__MSTAGKVIKCKAAVLWEVKKPFSIEDVEVAPPKAYEVRIKMVAVGICHTDDHVVSGNLVTPLPVILGHEAAGIVESVGEGVTTVKPGDKVIPLFTPQCGKCRVCKNPESNYCLKNDLGNPRGTLQDGTRRFTCRGKPIHHFLGTSTFSQYTVVDENAVAKIDAASPLEKVCLIGCGFSTGYGSAVNVAKVTPGSTCAVFGLGGVGLSAVMGCKAAGAARIIAVDINKDKFAKAKELGATECINPQDYKKPIQEVLKEMTDGGVDFSFEVIGRLDTMMASLLCCHEACGTSVIVGVPPASQNLSINPMLLLTGRTWKGAVYGGFKSKEGIPKLVADFMAKKFSLDALITHVLPFEKINEGFDLLHSGKSIRTVLTF,./data/raw/alphafold//AF-P00325-F1-model_v4.pdb,1323,1999,6213,2060
+1142,16182,16409,MAAAKPENLSLVVHGPGDLRLENYPIPEPGPNEVLLKMHSVGICGSDVHYWQHGRIGDFVVKKPMVLGHEASGTVVKVGSLVRHLQPGDRVAIEPGAPRETDEFCKIGRYNLSPTIFFCATPPDDGNLCRFYKHNANFCYKLPDNVTFEEGALIEPLSVGIHACRRAGVTLGNKVLVCGAGPIGLVSLLAAKAMGAAQVVVTDLSASRLSKAKEVGADFILQISNESPQEIAKKVEGLLGSKPEVTIECTGVETSIQAGIYATHSGGTLVLVGLGSEMTSVPLVHAATREVDIKGVFRYCNTWPMAISMLASKSVNVKPLVTHRFPLEKALEAFETSKKGLGLKVMIKCDPNDQNP,sabio,Q58D31,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.OC[C@H](O)[C@@H](O)CO>>NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(CO)C(O)CO.[H],12.0,0.0,37.0,8.0,1.1.1.14,9913.0,1.0791812460476249,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.OC[C@H](O)[C@@H](O)CO,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(CO)C(O)CO.[H],1.0791812460476249,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.OC[C@H](O)[C@@H](O)CO__MAAAKPENLSLVVHGPGDLRLENYPIPEPGPNEVLLKMHSVGICGSDVHYWQHGRIGDFVVKKPMVLGHEASGTVVKVGSLVRHLQPGDRVAIEPGAPRETDEFCKIGRYNLSPTIFFCATPPDDGNLCRFYKHNANFCYKLPDNVTFEEGALIEPLSVGIHACRRAGVTLGNKVLVCGAGPIGLVSLLAAKAMGAAQVVVTDLSASRLSKAKEVGADFILQISNESPQEIAKKVEGLLGSKPEVTIECTGVETSIQAGIYATHSGGTLVLVGLGSEMTSVPLVHAATREVDIKGVFRYCNTWPMAISMLASKSVNVKPLVTHRFPLEKALEAFETSKKGLGLKVMIKCDPNDQNP,./data/raw/alphafold//AF-Q58D31-F1-model_v4.pdb,2358,553,213,4947
+1143,14428,14631,MAQADIALIGLAVMGQNLILNMNDHGFVVCAFNRTVSKVDDFLANEAKGTKVVGAQSLKEMVSKLKKPRRIILLVKAGQAVDDFIEKLVPLLDTGDIIIDGGNSEYRDTTRRCRDLKAKGILFVGSGVSGGEEGARYGPSLMPGGNKEAWPHIKTIFQGIAAKVGTGEPCCDWVGDEGAGHFVKMVHNGIEYGDMQLICEAYHLMKDVLGMAQDEMAQAFEDWNKTELDSFLIEITANILKFQDTDGKHLLPKIRDSAGQKGTGKWTAISALEYGVPVTLIGEAVFARCLSSLKDERIQASKKLKGPQKFQFDGDKKSFLEDIRKALYASKIISYAQGFMLLRQAATEFGWTLNYGGIALMWRGGCIIRSVFLGKIKDAFDRNPELQNLLLDDFFKSAVENCQDSWRRAVSTGVQAGIPMPCFTTALSFYDGYRHEMLPASLIQAQRDYFGAHTYELLAKPGQFIHTNWTGHGGTVSSSSYNA,brenda,P52209,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](O)[C@@H](O)[C@H](O)[C@H](O)COP(=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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=C(CO)[C@H](O)[C@H](O)COP(=O)(O)O.O=C=O.[H+],73.0,0.0,22.0,7.5,1.1.1.44,9606.0,1.863322860120456,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](O)[C@@H](O)[C@H](O)[C@H](O)COP(=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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=C(CO)[C@H](O)[C@H](O)COP(=O)(O)O.O=C=O.[H+],1.863322860120456,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](O)[C@@H](O)[C@H](O)[C@H](O)COP(=O)(O)O__MAQADIALIGLAVMGQNLILNMNDHGFVVCAFNRTVSKVDDFLANEAKGTKVVGAQSLKEMVSKLKKPRRIILLVKAGQAVDDFIEKLVPLLDTGDIIIDGGNSEYRDTTRRCRDLKAKGILFVGSGVSGGEEGARYGPSLMPGGNKEAWPHIKTIFQGIAAKVGTGEPCCDWVGDEGAGHFVKMVHNGIEYGDMQLICEAYHLMKDVLGMAQDEMAQAFEDWNKTELDSFLIEITANILKFQDTDGKHLLPKIRDSAGQKGTGKWTAISALEYGVPVTLIGEAVFARCLSSLKDERIQASKKLKGPQKFQFDGDKKSFLEDIRKALYASKIISYAQGFMLLRQAATEFGWTLNYGGIALMWRGGCIIRSVFLGKIKDAFDRNPELQNLLLDDFFKSAVENCQDSWRRAVSTGVQAGIPMPCFTTALSFYDGYRHEMLPASLIQAQRDYFGAHTYELLAKPGQFIHTNWTGHGGTVSSSSYNA,./data/raw/alphafold//AF-P52209-F1-model_v4.pdb,2388,4786,4843,4681
+1144,16173,16400,MANEVIKCKAAVAWEAGKPLSIEEIEVAPPKAHEVRIKIIATAVCHTDAYTLSGADPEGCFPVILGHEGAGIVESVGEGVTKLKAGDTVIPLYIPQCGECKFCLNPKTNLCQKIRVTQGKGLMPDGTSRFTCKGKTILHYMGTSTFSEYTVVADISVAKIDPLAPLDKVCLLGCGISTGYGAAVNTAKLEPGSVCAVFGLGGVGLAVIMGCKVAGASRIIGVDINKDKFARAKEFGATECINPQDFSKPIQEVLIEMTDGGVDYSFECIGNVKVMRAALEACHKGWGVSVVVGVAASGEEIATRPFQLVTGRTWKGTAFGGWKSVESVPKLVSEYMSKKIKVDEFVTHNLSFDEINKAFELMHSGKSIRTVVKI,sabio,P11766,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.OCCCCCCO>>C(CCC=O)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.[H],9240.0,0.1288827857093515,25.0,10.0,1.1.1.1,9606.0,3.965671971220107,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.OCCCCCCO,C(CCC=O)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.[H],3.965671971220107,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.OCCCCCCO__MANEVIKCKAAVAWEAGKPLSIEEIEVAPPKAHEVRIKIIATAVCHTDAYTLSGADPEGCFPVILGHEGAGIVESVGEGVTKLKAGDTVIPLYIPQCGECKFCLNPKTNLCQKIRVTQGKGLMPDGTSRFTCKGKTILHYMGTSTFSEYTVVADISVAKIDPLAPLDKVCLLGCGISTGYGAAVNTAKLEPGSVCAVFGLGGVGLAVIMGCKVAGASRIIGVDINKDKFARAKEFGATECINPQDFSKPIQEVLIEMTDGGVDYSFECIGNVKVMRAALEACHKGWGVSVVVGVAASGEEIATRPFQLVTGRTWKGTAFGGWKSVESVPKLVSEYMSKKIKVDEFVTHNLSFDEINKAFELMHSGKSIRTVVKI,./data/raw/alphafold//AF-P11766-F1-model_v4.pdb,1323,2177,273,298
+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
+1146,4220,4273,MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,uniprot_search,P24155,CC(C)C[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](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>CC(C)C[C@H](N=C(O)[C@@H](N)Cc1ccccc1)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].Nc1ccccc1C(O)=NCC(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O,3.1,2.989865306050449e-14,37.0,7.4,3.4.24.15,10116.0,0.4913616938342727,CC(C)C[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](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,CC(C)C[C@H](N=C(O)[C@@H](N)Cc1ccccc1)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].Nc1ccccc1C(O)=NCC(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O,0.4913616938342727,CC(C)C[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](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,./data/raw/alphafold//AF-P24155-F1-model_v4.pdb,1820,1500,3134,1830
+1147,9131,9273,MPGVDISFLKKSGRRTMAAAAVIALLGGCGADAGSEPATTAASTTAPSAATDAATAEFAALEQRFGARLGVYAVDTTSGAVVAYRADERFGMASTFKGLACGALLREHPLSSGYFDQVVRYSREEVVSYSPVTETRVDTGMTVAELCHATITVSDNTAGNQILKLLGGPAGFTAFLRSLGDEVSRLDRWETELNEVPPGEERDTTTPAAVAANYRALVLGDVLAEPERAQLRDWLVANTTGDQRIRAGVPAGWTVGDKTGGGSHGGNNDVAVAWTETGDPIVIALLSHRTDPAAKADNALLAEATRAVVTALR,sabio,Q5YXD6,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC12)c1ccco1.O>>,3.3,99.77447305629605,30.0,7.0,3.5.2.6,37329.0,0.5185139398778875,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC12)c1ccco1.O,,0.5185139398778875,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC12)c1ccco1.O__MPGVDISFLKKSGRRTMAAAAVIALLGGCGADAGSEPATTAASTTAPSAATDAATAEFAALEQRFGARLGVYAVDTTSGAVVAYRADERFGMASTFKGLACGALLREHPLSSGYFDQVVRYSREEVVSYSPVTETRVDTGMTVAELCHATITVSDNTAGNQILKLLGGPAGFTAFLRSLGDEVSRLDRWETELNEVPPGEERDTTTPAAVAANYRALVLGDVLAEPERAQLRDWLVANTTGDQRIRAGVPAGWTVGDKTGGGSHGGNNDVAVAWTETGDPIVIALLSHRTDPAAKADNALLAEATRAVVTALR,./data/raw/alphafold//AF-Q5YXD6-F1-model_v4.pdb,1458,975,782,1088
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+1152,17814,18059,MNYARFITAASAARNPSPIRTMTDILSRGPKSMISLAGGLPNPNMFPFKTAVITVENGKTIQFGEEMMKRALQYSPSAGIPELLSWLKQLQIKLHNPPTIHYPPSQGQMDLCVTSGSQQGLCKVFEMIINPGDNVLLDEPAYSGTLQSLHPLGCNIINVASDESGIVPDSLRDILSRWKPEDAKNPQKNTPKFLYTVPNGNNPTGNSLTSERKKEIYELARKYDFLIIEDDPYYFLQFNKFRVPTFLSMDVDGRVIRADSFSKIISSGLRIGFLTGPKPLIERVILHIQVSTLHPSTFNQLMISQLLHEWGEEGFMAHVDRVIDFYSNQKDAILAAADKWLTGLAEWHVPAAGMFLWIKVKGINDVKELIEEKAVKMGVLMLPGNAFYVDSSAPSPYLRASFSSASPEQMDVAFQVLAQLIKESL,sabio,Q8N5Z0,Nc1ccccc1C(=O)CC(N)C(=O)O.O=CC(=O)O>>NCC(=O)O.Nc1ccccc1C(=O)CC(=O)C(=O)O,13104.0,0.0,37.0,7.4,2.6.1.7,9606.0,4.117403884416343,Nc1ccccc1C(=O)CC(N)C(=O)O.O=CC(=O)O,NCC(=O)O.Nc1ccccc1C(=O)CC(=O)C(=O)O,4.545529774497824,Nc1ccccc1C(=O)CC(N)C(=O)O.O=CC(=O)O__MNYARFITAASAARNPSPIRTMTDILSRGPKSMISLAGGLPNPNMFPFKTAVITVENGKTIQFGEEMMKRALQYSPSAGIPELLSWLKQLQIKLHNPPTIHYPPSQGQMDLCVTSGSQQGLCKVFEMIINPGDNVLLDEPAYSGTLQSLHPLGCNIINVASDESGIVPDSLRDILSRWKPEDAKNPQKNTPKFLYTVPNGNNPTGNSLTSERKKEIYELARKYDFLIIEDDPYYFLQFNKFRVPTFLSMDVDGRVIRADSFSKIISSGLRIGFLTGPKPLIERVILHIQVSTLHPSTFNQLMISQLLHEWGEEGFMAHVDRVIDFYSNQKDAILAAADKWLTGLAEWHVPAAGMFLWIKVKGINDVKELIEEKAVKMGVLMLPGNAFYVDSSAPSPYLRASFSSASPEQMDVAFQVLAQLIKESL,./data/raw/alphafold//AF-Q8N5Z0-F1-model_v4.pdb,1302,3856,6172,824
+1153,9320,9462,MGCDRPRQALHSLQEFTVMFSKWLPISAILLYGASAKALDCAGLFKKSQTLIKGINPFVAEVHPANVTFVPVGNIAYPDPVPDLPEFCRFGAEYNTSSKSKFRFEVWLPTSKKWNGRFAFIGNGGDAGGVNYADMAIPLAKYGFVVASTNTGHDGTHGDGTFAISNPESQIDFGHRAVHLSTVFAKTIAKSYYGKPSTYNYWIGCSSGGKQGLKSAQAYPADFDGVIAGAPAQWWPHLNGFTTHVNMLNAKATTPGATIPTSFFTALNQEVVAQCGKLDGVDDGIITNPRLCKPDLTRVACGSTNASPYVNSSNCLSKLQLVTLKAIYTNWTSSNGEFLFPTFEPGSEFGWPNTVNGVPYGPGPDYFLYQVYNKTSVQKLQINEAELQRLVAIADVTNPGQSRAIDPNLNPFFKRGGKLLQYHGFADPLIPSGSSLWYYEHVRSYFKNADLSDRYRLFMIPGVAHCSGGPGADAFGRPGQRSVSLGGAGQSLSFTPQYDMILATINWVEKGVAPKSLIGTKYKNNNIREGAKFTRLFCPYPQEAIYRGGNVNVASSYSCGVRA,brenda,A0A1D0BQV8,COc1cc(/C=C/C(=O)OC[C@@H]2O[C@@H](O)[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@H]2O)ccc1O.O>>COc1cc(/C=C/C(=O)O)ccc1O.OC[C@@H]1OC(O)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,29.1,5.959291685884125e-15,37.0,6.0,3.1.1.73,456999.0,1.4638929889859074,COc1cc(/C=C/C(=O)OC[C@@H]2O[C@@H](O)[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@H]2O)ccc1O.O,COc1cc(/C=C/C(=O)O)ccc1O.OC[C@@H]1OC(O)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,1.4638929889859074,COc1cc(/C=C/C(=O)OC[C@@H]2O[C@@H](O)[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@H]2O)ccc1O.O__MGCDRPRQALHSLQEFTVMFSKWLPISAILLYGASAKALDCAGLFKKSQTLIKGINPFVAEVHPANVTFVPVGNIAYPDPVPDLPEFCRFGAEYNTSSKSKFRFEVWLPTSKKWNGRFAFIGNGGDAGGVNYADMAIPLAKYGFVVASTNTGHDGTHGDGTFAISNPESQIDFGHRAVHLSTVFAKTIAKSYYGKPSTYNYWIGCSSGGKQGLKSAQAYPADFDGVIAGAPAQWWPHLNGFTTHVNMLNAKATTPGATIPTSFFTALNQEVVAQCGKLDGVDDGIITNPRLCKPDLTRVACGSTNASPYVNSSNCLSKLQLVTLKAIYTNWTSSNGEFLFPTFEPGSEFGWPNTVNGVPYGPGPDYFLYQVYNKTSVQKLQINEAELQRLVAIADVTNPGQSRAIDPNLNPFFKRGGKLLQYHGFADPLIPSGSSLWYYEHVRSYFKNADLSDRYRLFMIPGVAHCSGGPGADAFGRPGQRSVSLGGAGQSLSFTPQYDMILATINWVEKGVAPKSLIGTKYKNNNIREGAKFTRLFCPYPQEAIYRGGNVNVASSYSCGVRA,./data/raw/alphafold//AF-A0A1D0BQV8-F1-model_v4.pdb,3338,2199,3885,2756
+1154,7476,7598,MSTAGKVIKCKAAVLWEVKKPFSIEDVEVAPPKAYEVRIKMVAVGICHTDDHVVSGNLVTPLPVILGHEAAGIVESVGEGVTTVKPGDKVIPLFTPQCGKCRVCKNPESNYCLKNDLGNPRGTLQDGTRRFTCRGKPIHHFLGTSTFSQYTVVDENAVAKIDAASPLEKVCLIGCGFSTGYGSAVNVAKVTPGSTCAVFGLGGVGLSAVMGCKAAGAARIIAVDINKDKFAKAKELGATECINPQDYKKPIQEVLKEMTDGGVDFSFEVIGRLDTMMASLLCCHEACGTSVIVGVPPASQNLSINPMLLLTGRTWKGAVYGGFKSKEGIPKLVADFMAKKFSLDALITHVLPFEKINEGFDLLHSGKSIRTVLTF,sabio,P00325,CCCCCCCCO.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>>CCCCCCCC=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,138.0,0.0634229518098773,25.0,7.5,1.1.1.1,9606.0,2.1398790864012365,CCCCCCCCO.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,CCCCCCCC=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,3.1760912590556813,CCCCCCCCO.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__MSTAGKVIKCKAAVLWEVKKPFSIEDVEVAPPKAYEVRIKMVAVGICHTDDHVVSGNLVTPLPVILGHEAAGIVESVGEGVTTVKPGDKVIPLFTPQCGKCRVCKNPESNYCLKNDLGNPRGTLQDGTRRFTCRGKPIHHFLGTSTFSQYTVVDENAVAKIDAASPLEKVCLIGCGFSTGYGSAVNVAKVTPGSTCAVFGLGGVGLSAVMGCKAAGAARIIAVDINKDKFAKAKELGATECINPQDYKKPIQEVLKEMTDGGVDFSFEVIGRLDTMMASLLCCHEACGTSVIVGVPPASQNLSINPMLLLTGRTWKGAVYGGFKSKEGIPKLVADFMAKKFSLDALITHVLPFEKINEGFDLLHSGKSIRTVLTF,./data/raw/alphafold//AF-P00325-F1-model_v4.pdb,1323,1999,6213,2060
+1155,5287,5373,MTVTDIILIHGALNRGACYDAVVPLLEARGYRVHAPDLTGHTPGDGGHLSVVDMEHYTRPVADILARAEGQSILLGHSLGGASISWLAQHHPDKVAGLIYLTAVLTAPGITPETFVLPGEPNRGTPHALDLIQPVDEGRGLQADFSRLERLREVFMGDYPGEGMPPAEQFIQTQSTVPFGTPNPMEGRALEIPRLYIEALDDVVIPIAVQRQMQKEFPGPVAVVSLPASHAPYYSMPERLAEAIADFADAPAEYRQTATKAGPDRPAGADGGRADRADLP,sabio,C0LA90,CC1(C)C(C=C(Cl)C(F)(F)F)C1C(=O)OC(C#N)c1cccc(Oc2ccccc2)c1.O>>O=Cc1cccc(Oc2ccccc2)c1.[C-]#N,1.28,35.15055330322749,37.0,7.5,3.1.1.88,595605.0,0.1072099696478683,CC1(C)C(C=C(Cl)C(F)(F)F)C1C(=O)OC(C#N)c1cccc(Oc2ccccc2)c1.O,O=Cc1cccc(Oc2ccccc2)c1.[C-]#N,0.1072099696478683,CC1(C)C(C=C(Cl)C(F)(F)F)C1C(=O)OC(C#N)c1cccc(Oc2ccccc2)c1.O__MTVTDIILIHGALNRGACYDAVVPLLEARGYRVHAPDLTGHTPGDGGHLSVVDMEHYTRPVADILARAEGQSILLGHSLGGASISWLAQHHPDKVAGLIYLTAVLTAPGITPETFVLPGEPNRGTPHALDLIQPVDEGRGLQADFSRLERLREVFMGDYPGEGMPPAEQFIQTQSTVPFGTPNPMEGRALEIPRLYIEALDDVVIPIAVQRQMQKEFPGPVAVVSLPASHAPYYSMPERLAEAIADFADAPAEYRQTATKAGPDRPAGADGGRADRADLP,./data/raw/alphafold//AF-C0LA90-F1-model_v4.pdb,1501,1050,876,1208
+1156,17771,18014,MKSIFTLGVALLGLSSHVQGAAVKVERMEMTRIQPRNDLVERQSAACGSNGPNSRHCWTPGFTSSTDMYNSWPNTGQIVSYNLRIENTTCNPDGNGSRVCMLINGRMPGPTIVANWGDTIRVTVRNLLQHNGTSIHWHGFRMLNKVIQDGTNGVTECALAPGDIKTYEFQATEYGTTWYHSHFSHQYGDGVVGTVQINGPATANYDVDLGVMPMTDWYYITAFQAARRAATGGGGPPLPDNVLINGTSKNAAGGGAWNKVSIQSGKRYRLRLVNTAVDTNFMVNLDNHNFQVIATDFVPVEPYNTSYLQIGIGQRYDVIFTANQTAGNYWFRAVANSNCQSRAAREGRAVFTYQGQTVADPTSNAQGNPPTGCTDPVTTPKIVKTVPSSTFAAQAKSLPVAFGPVAVQNNLVLWTINGTSQVVDPGNPTIKYVAENNNNFPQALNVVEVSSTSATTWTYWVIQQAANAPPIAHPIHLHGHDSYILGQGTGQFNVTTHFSQLRFNNPPRRDVAQLQGGGWLVLAYPTDNPGAWLMHCHIAFHVGMGLSIQFLERKQSINLPAPGSQWFQNCNNWAAYKAGNTDVYPQDDSGLRKRWPALGAENSMAEW,brenda,B3TLA6,Nc1c(S(=O)(=O)O)cc(NC2CCCCC2)c2c1C(=O)c1ccccc1C2=O.O=O>>,32.2,99.76929501169674,65.0,5.5,1.10.3.2,1707701.0,1.507855871695831,Nc1c(S(=O)(=O)O)cc(NC2CCCCC2)c2c1C(=O)c1ccccc1C2=O.O=O,,1.507855871695831,Nc1c(S(=O)(=O)O)cc(NC2CCCCC2)c2c1C(=O)c1ccccc1C2=O.O=O__MKSIFTLGVALLGLSSHVQGAAVKVERMEMTRIQPRNDLVERQSAACGSNGPNSRHCWTPGFTSSTDMYNSWPNTGQIVSYNLRIENTTCNPDGNGSRVCMLINGRMPGPTIVANWGDTIRVTVRNLLQHNGTSIHWHGFRMLNKVIQDGTNGVTECALAPGDIKTYEFQATEYGTTWYHSHFSHQYGDGVVGTVQINGPATANYDVDLGVMPMTDWYYITAFQAARRAATGGGGPPLPDNVLINGTSKNAAGGGAWNKVSIQSGKRYRLRLVNTAVDTNFMVNLDNHNFQVIATDFVPVEPYNTSYLQIGIGQRYDVIFTANQTAGNYWFRAVANSNCQSRAAREGRAVFTYQGQTVADPTSNAQGNPPTGCTDPVTTPKIVKTVPSSTFAAQAKSLPVAFGPVAVQNNLVLWTINGTSQVVDPGNPTIKYVAENNNNFPQALNVVEVSSTSATTWTYWVIQQAANAPPIAHPIHLHGHDSYILGQGTGQFNVTTHFSQLRFNNPPRRDVAQLQGGGWLVLAYPTDNPGAWLMHCHIAFHVGMGLSIQFLERKQSINLPAPGSQWFQNCNNWAAYKAGNTDVYPQDDSGLRKRWPALGAENSMAEW,./data/raw/alphafold//AF-B3TLA6-F1-model_v4.pdb,3423,2321,1034,2932
+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
+1158,9604,9750,MGILSYLCYSLFYLSIFFIIRLLFQSRKFKNLPPGPTSLPIIGNLHHLKRPLNRTFKALTEKYGNVISLWFGSRLVVVVSSLSEFQECFTKNDVVLANRPRFLSGKYIFYNYTTLGSTSYGEHWRNLRRITSLDVLSNHRINNFAPIRRDETQRLIKKLAEDSSTKFAEVELTFRFFDMTFNNIMRMISGKRYYGDDCDISEVQEASQFRDMVSELLQLSGANNKTDFMPLLKFLDFENLEKRVKRIGEKNDVFLSGLLQEQRSKKERTNTMIDHLLNMQESQPEYYTDTIIKGLCLAMLLAGTDSSAVTLEWTMSNILNYPEVLKKVRDEVDTHVGQDRLVDESDLPKLTYLRNVIYETLRLYTPAPLLLPHSTADECIMGGYKVPRDTIVLINAWAIHRDPETWSEATTFKPERFDKKGELEKMIAFGMGRRACPGEGLALRAISMTLALLVQCFDWKRINDEKIDMSERDGFTMTKLLPLKAMCKTRPVVNKVFK,sabio,Q6WNR0,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1.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.[H]>>COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)c(O)c1.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,0.033,1.0692913053035842e-14,25.0,8.0,1.14.14.90,3880.0,-1.4814860601221125,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1.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.[H],COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)c(O)c1.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,-1.4814860601221125,COc1ccc(-c2coc3cc(O)cc(O)c3c2=O)cc1.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.[H]__MGILSYLCYSLFYLSIFFIIRLLFQSRKFKNLPPGPTSLPIIGNLHHLKRPLNRTFKALTEKYGNVISLWFGSRLVVVVSSLSEFQECFTKNDVVLANRPRFLSGKYIFYNYTTLGSTSYGEHWRNLRRITSLDVLSNHRINNFAPIRRDETQRLIKKLAEDSSTKFAEVELTFRFFDMTFNNIMRMISGKRYYGDDCDISEVQEASQFRDMVSELLQLSGANNKTDFMPLLKFLDFENLEKRVKRIGEKNDVFLSGLLQEQRSKKERTNTMIDHLLNMQESQPEYYTDTIIKGLCLAMLLAGTDSSAVTLEWTMSNILNYPEVLKKVRDEVDTHVGQDRLVDESDLPKLTYLRNVIYETLRLYTPAPLLLPHSTADECIMGGYKVPRDTIVLINAWAIHRDPETWSEATTFKPERFDKKGELEKMIAFGMGRRACPGEGLALRAISMTLALLVQCFDWKRINDEKIDMSERDGFTMTKLLPLKAMCKTRPVVNKVFK,./data/raw/alphafold//AF-Q6WNR0-F1-model_v4.pdb,3555,3511,1283,3232
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+1171,10057,10208,MWLAAAAPSLARRLLFLGPPPPPLLLLVFSRSSRRRLHSLGLAAMPEKRPFERLPADVSPINYSLCLKPDLLDFTFEGKLEAAAQVRQATNQIVMNCADIDIITASYAPEGDEEIHATGFNYQNEDEKVTLSFPSTLQTGTGTLKIDFVGELNDKMKGFYRSKYTTPSGEVRYAAVTQFEATDARRAFPCWDEPAIKATFDISLVVPKDRVALSNMNVIDRKPYPDDENLVEVKFARTPVMSTYLVAFVVGEYDFVETRSKDGVCVRVYTPVGKAEQGKFALEVAAKTLPFYKDYFNVPYPLPKIDLIAIADFAAGAMENWGLVTYRETALLIDPKNSCSSSRQWVALVVGHELAHQWFGNLVTMEWWTHLWLNEGFASWIEYLCVDHCFPEYDIWTQFVSADYTRAQELDALDNSHPIEVSVGHPSEVDEIFDAISYSKGASVIRMLHDYIGDKDFKKGMNMYLTKFQQKNAATEDLWESLENASGKPIAAVMNTWTKQMGFPLIYVEAEQVEDDRLLRLSQKKFCAGGSYVGEDCPQWMVPITISTSEDPNQAKLKILMDKPEMNVVLKNVKPDQWVKLNLGTVGFYRTQYSSAMLESLLPGIRDLSLPPVDRLGLQNDLFSLARAGIISTVEVLKVMEAFVNEPNYTVWSDLSCNLGILSTLLSHTDFYEEIQEFVKDVFSPIGERLGWDPKPGEGHLDALLRGLVLGKLGKAGHKATLEEARRRFKDHVEGKQILSADLRSPVYLTVLKHGDGTTLDIMLKLHKQADMQEEKNRIERVLGATLLPDLIQKVLTFALSEEVRPQDTVSVIGGVAGGSKHGRKAAWKFIKDNWEELYNRYQGGFLISRLIKLSVEGFAVDKMAGEVKAFFESHPAPSAERTIQQCCENILLNAAWLKRDAESIHQYLLQRKASPPTV,uniprot_search,P55786,CSCC[C@H](N)C(O)=Nc1ccc2ccccc2c1.O>>CSCC[C@H](N)C(=O)O.Nc1ccc2ccccc2c1,95.5,9.703421404420568e-15,37.0,6.8,3.4.11.14,9606.0,1.9800033715837464,CSCC[C@H](N)C(O)=Nc1ccc2ccccc2c1.O,CSCC[C@H](N)C(=O)O.Nc1ccc2ccccc2c1,1.9800033715837464,CSCC[C@H](N)C(O)=Nc1ccc2ccccc2c1.O__MWLAAAAPSLARRLLFLGPPPPPLLLLVFSRSSRRRLHSLGLAAMPEKRPFERLPADVSPINYSLCLKPDLLDFTFEGKLEAAAQVRQATNQIVMNCADIDIITASYAPEGDEEIHATGFNYQNEDEKVTLSFPSTLQTGTGTLKIDFVGELNDKMKGFYRSKYTTPSGEVRYAAVTQFEATDARRAFPCWDEPAIKATFDISLVVPKDRVALSNMNVIDRKPYPDDENLVEVKFARTPVMSTYLVAFVVGEYDFVETRSKDGVCVRVYTPVGKAEQGKFALEVAAKTLPFYKDYFNVPYPLPKIDLIAIADFAAGAMENWGLVTYRETALLIDPKNSCSSSRQWVALVVGHELAHQWFGNLVTMEWWTHLWLNEGFASWIEYLCVDHCFPEYDIWTQFVSADYTRAQELDALDNSHPIEVSVGHPSEVDEIFDAISYSKGASVIRMLHDYIGDKDFKKGMNMYLTKFQQKNAATEDLWESLENASGKPIAAVMNTWTKQMGFPLIYVEAEQVEDDRLLRLSQKKFCAGGSYVGEDCPQWMVPITISTSEDPNQAKLKILMDKPEMNVVLKNVKPDQWVKLNLGTVGFYRTQYSSAMLESLLPGIRDLSLPPVDRLGLQNDLFSLARAGIISTVEVLKVMEAFVNEPNYTVWSDLSCNLGILSTLLSHTDFYEEIQEFVKDVFSPIGERLGWDPKPGEGHLDALLRGLVLGKLGKAGHKATLEEARRRFKDHVEGKQILSADLRSPVYLTVLKHGDGTTLDIMLKLHKQADMQEEKNRIERVLGATLLPDLIQKVLTFALSEEVRPQDTVSVIGGVAGGSKHGRKAAWKFIKDNWEELYNRYQGGFLISRLIKLSVEGFAVDKMAGEVKAFFESHPAPSAERTIQQCCENILLNAAWLKRDAESIHQYLLQRKASPPTV,./data/raw/alphafold//AF-P55786-F1-model_v4.pdb,1848,1541,3123,1889
+1172,22253,22586,MTNALLSIAVLLFSMLSLAQAETHTFNWTTGWDYRNVDGLKSRPVITCNGQFPWPDITVNKGDRVQIYLTNGMNNTNTSMHFHGLFQNGTASMDGVPFLTQCPIAPGSTMLYNFTVDYNVGTYWYHSHTDGQYEDGMKGLFIIKDDSFPYDYDEELSLSLSEWYHDLVTDLTKSFMSVYNPTGAEPIPQNLIVNNTMNLTWEVQPDTTYLLRIVNVGGFVSQYFWIEDHEMTVVEIDGITTEKNVTDMLYITVAQRYTVLVHTKNDTDKNFAIMQKFDDTMLDVIPSDLQLNATSYMVYNKTAALPTQNYVDSIDNFLDDFYLQPYEKEAIYGEPDHVITVDVVMDNLKNGVNYAFFNNITYTAPKVPTLMTVLSSGDQANNSEIYGSNTHTFILEKDEIVEIVLNNQDTGTHPFHLHGHAFQTIQRDRTYDDALGEVPHSFDPDNHPAFPEYPMRRDTLYVRPQSNFVIRFKADNPGVWFFHCHIEWHLLQGLGLVLVEDPFGIQDAHSQQLSENHLEVCQSCSVATEGNAAANTLDLTDLTGENVQHAFIPTGFTKKGIIAMTFSCFAGILGIITIAIYGMMDMEDATEKVIRDLHVDPEVLLNEVDENEERQVNEDRHSTEKHQFLTKAKRFF,sabio,P38993,O=O.[Fe+2].[H]>>O.[Fe+3],138.0,9.156990061755163,25.0,6.0,1.16.3.1,4932.0,2.1398790864012365,O=O.[Fe+2].[H],O.[Fe+3],2.7558748556724915,O=O.[Fe+2].[H]__MTNALLSIAVLLFSMLSLAQAETHTFNWTTGWDYRNVDGLKSRPVITCNGQFPWPDITVNKGDRVQIYLTNGMNNTNTSMHFHGLFQNGTASMDGVPFLTQCPIAPGSTMLYNFTVDYNVGTYWYHSHTDGQYEDGMKGLFIIKDDSFPYDYDEELSLSLSEWYHDLVTDLTKSFMSVYNPTGAEPIPQNLIVNNTMNLTWEVQPDTTYLLRIVNVGGFVSQYFWIEDHEMTVVEIDGITTEKNVTDMLYITVAQRYTVLVHTKNDTDKNFAIMQKFDDTMLDVIPSDLQLNATSYMVYNKTAALPTQNYVDSIDNFLDDFYLQPYEKEAIYGEPDHVITVDVVMDNLKNGVNYAFFNNITYTAPKVPTLMTVLSSGDQANNSEIYGSNTHTFILEKDEIVEIVLNNQDTGTHPFHLHGHAFQTIQRDRTYDDALGEVPHSFDPDNHPAFPEYPMRRDTLYVRPQSNFVIRFKADNPGVWFFHCHIEWHLLQGLGLVLVEDPFGIQDAHSQQLSENHLEVCQSCSVATEGNAAANTLDLTDLTGENVQHAFIPTGFTKKGIIAMTFSCFAGILGIITIAIYGMMDMEDATEKVIRDLHVDPEVLLNEVDENEERQVNEDRHSTEKHQFLTKAKRFF,./data/raw/alphafold//AF-P38993-F1-model_v4.pdb,755,177,5916,6832
+1173,5459,5545,MMRKSVRRAMLMTTACVSLLLASVPLCAQANDVQQKLAALEKSSGGRLGVALINTADNTQTLYRADERFAMCSTSKVMAAAAVLKQSETQKGLLSQRVEIKPSDLINYNPIAEKHVNGTMTFGELSAAALQYSDNTAMNKLIAHLGGPDKVTAFARTIGDDTFRLDRTEPTLNTAIPGDPRDTTTPLAMAQALRNLTLGNALGDTQRAQLVMWLKGNTTGAASIRAGLPTSWVVGDKTGSGDYGTTNDIAVIWPEGRAPLVLVTYFTQSEPKAESRRDVLAAAARIVTDGY,brenda,Q8GD10,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.O>>,84.0,99.75213781137688,30.0,7.0,3.5.2.6,573.0,1.9242792860618816,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.O,,1.9242792860618816,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.O__MMRKSVRRAMLMTTACVSLLLASVPLCAQANDVQQKLAALEKSSGGRLGVALINTADNTQTLYRADERFAMCSTSKVMAAAAVLKQSETQKGLLSQRVEIKPSDLINYNPIAEKHVNGTMTFGELSAAALQYSDNTAMNKLIAHLGGPDKVTAFARTIGDDTFRLDRTEPTLNTAIPGDPRDTTTPLAMAQALRNLTLGNALGDTQRAQLVMWLKGNTTGAASIRAGLPTSWVVGDKTGSGDYGTTNDIAVIWPEGRAPLVLVTYFTQSEPKAESRRDVLAAAARIVTDGY,./data/raw/alphafold//AF-Q8GD10-F1-model_v4.pdb,1458,649,811,1083
+1174,2651,2686,MAAMFRRSCRVLRSLSHFGWRSQHTKAVPQCEPGSGFSFELTEQQKEFQATARKFAREEIIPVAAEYDRTGEYPVPLLKRAWELGLMNTHIPESFGGLGLGIIDSCLITEELAYGCTGVQTAIEANTLGQVPLIIGGNYQQQKKYLGRMTEEPLMCAYCVTEPGAGSDVAGIKTKAEKKGDEYIINGQKMWITNGGKANWYFLLARSDPDPKAPASKAFTGFIVEADTPGVQIGRKEINMGQRCSDTRGIVFEDVRVPKENVLTGEGAGFKIAMGTFDKTRPPVAAGAVGLAQRALDEATKYALERKTFGKLLAEHQGISFLLADMAMKVELARLSYQRAAWEIDSGRRNTYYASIAKAYAADIANQLATDAVQVFGGNGFNTEYPVEKLMRDAKIYQIYEGTAQIQRIIIAREHIGRYKN,sabio,P41367,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)CCc1ccco1.F[P-](F)(F)(F)(F)F.[Fe+3].c1cc[cH-]c1.c1cc[cH-]c1>>F[P-](F)(F)(F)(F)F.[Fe+2].c1cc[cH-]c1.c1cc[cH-]c1,13.2,57.2994181590537,25.0,7.6,1.3.8.7,9823.0,1.1205739312058498,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)CCc1ccco1.F[P-](F)(F)(F)(F)F.[Fe+3].c1cc[cH-]c1.c1cc[cH-]c1,F[P-](F)(F)(F)(F)F.[Fe+2].c1cc[cH-]c1.c1cc[cH-]c1,1.1205739312058498,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)CCc1ccco1.F[P-](F)(F)(F)(F)F.[Fe+3].c1cc[cH-]c1.c1cc[cH-]c1__MAAMFRRSCRVLRSLSHFGWRSQHTKAVPQCEPGSGFSFELTEQQKEFQATARKFAREEIIPVAAEYDRTGEYPVPLLKRAWELGLMNTHIPESFGGLGLGIIDSCLITEELAYGCTGVQTAIEANTLGQVPLIIGGNYQQQKKYLGRMTEEPLMCAYCVTEPGAGSDVAGIKTKAEKKGDEYIINGQKMWITNGGKANWYFLLARSDPDPKAPASKAFTGFIVEADTPGVQIGRKEINMGQRCSDTRGIVFEDVRVPKENVLTGEGAGFKIAMGTFDKTRPPVAAGAVGLAQRALDEATKYALERKTFGKLLAEHQGISFLLADMAMKVELARLSYQRAAWEIDSGRRNTYYASIAKAYAADIANQLATDAVQVFGGNGFNTEYPVEKLMRDAKIYQIYEGTAQIQRIIIAREHIGRYKN,./data/raw/alphafold//AF-P41367-F1-model_v4.pdb,3214,1249,1731,1465
+1175,1494,1522,MLKGKKAVVTGSTSGIGLAMATELAKAGADVVINGFGQPEDIERERSTLESKFGVKAYYLNADLSDAQATRDFIAKAAEALGGLDILVNNAGIQHTAPIEEFPVDKWNAIIALNLSAVFHGTAAALPIMQKQGWGRIINIASAHGLVASVNKSAYVAAKHGVVGLTKVTALENAGKGITCNAICPGWVRTPLVEKQIEAISQQKGIDIEAAARELLAEKQPSLQFVTPEQLGGAAVFLSSAAADQMTGTTLSLDGGWTAR,brenda,D0VWQ0,CC(=O)CCC(=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+]>>CC(O)CCC(=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)c1,0.006,7.259046938435645e-15,30.0,6.5,1.1.1.30,511.0,-2.2218487496163566,CC(=O)CCC(=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+],CC(O)CCC(=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,-2.114638779968488,CC(=O)CCC(=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+]__MLKGKKAVVTGSTSGIGLAMATELAKAGADVVINGFGQPEDIERERSTLESKFGVKAYYLNADLSDAQATRDFIAKAAEALGGLDILVNNAGIQHTAPIEEFPVDKWNAIIALNLSAVFHGTAAALPIMQKQGWGRIINIASAHGLVASVNKSAYVAAKHGVVGLTKVTALENAGKGITCNAICPGWVRTPLVEKQIEAISQQKGIDIEAAARELLAEKQPSLQFVTPEQLGGAAVFLSSAAADQMTGTTLSLDGGWTAR,./data/raw/alphafold//AF-D0VWQ0-F1-model_v4.pdb,1348,838,630,918
+1176,6242,6351,MNDFLLLLLVLFLGVPRSENHVINLEECFQEPEYENWLATASHGLTKTLNPKKIVIVGAGISGLTAAKLFREAGHEVVILEASDRVGGRIKTHREDGWYVDVGPMRVPQTHRIVREYIKKFNISLNPFRQTDENAWYLIKHVRQKMSANNPENFGYQLNPNERGKSASQLFDETLDKVTDDCTLQKEKYDSFSTKEYLIKEGKLSTGAVEMIGDFLNEEAGFHNSFLISVMDHFLFLNNSFDEITGGFDQLPERFFKDMDSIVHLNSTVEKIVHINNKVTVFYEGLSTNMRLVADYVLITATARATRLIKFVPPLSIPKTRALRSLIYASATKIILVCTDKFWEKDGIHGGRSITDLPSRVIYYPNHDFTNGIGVLLASYTWYSDSEFYTTLSDEKCVDVVMDDLVEIHNVSKDYLKSVCGKHVVQKWALDQYSMGAFSTYTPYQITHYSQMLAQNEGRIYFAGEYTAHPHGWIETSMKSAIREAINIHNA,sabio,P81383,CCC(C)C(N)C(=O)O.O.O=O>>CCC(C)C(=O)C(=O)O.N.OO,13.5,0.0,25.0,8.5,1.4.3.2,8665.0,1.130333768495006,CCC(C)C(N)C(=O)O.O.O=O,CCC(C)C(=O)C(=O)O.N.OO,1.130333768495006,CCC(C)C(N)C(=O)O.O.O=O__MNDFLLLLLVLFLGVPRSENHVINLEECFQEPEYENWLATASHGLTKTLNPKKIVIVGAGISGLTAAKLFREAGHEVVILEASDRVGGRIKTHREDGWYVDVGPMRVPQTHRIVREYIKKFNISLNPFRQTDENAWYLIKHVRQKMSANNPENFGYQLNPNERGKSASQLFDETLDKVTDDCTLQKEKYDSFSTKEYLIKEGKLSTGAVEMIGDFLNEEAGFHNSFLISVMDHFLFLNNSFDEITGGFDQLPERFFKDMDSIVHLNSTVEKIVHINNKVTVFYEGLSTNMRLVADYVLITATARATRLIKFVPPLSIPKTRALRSLIYASATKIILVCTDKFWEKDGIHGGRSITDLPSRVIYYPNHDFTNGIGVLLASYTWYSDSEFYTTLSDEKCVDVVMDDLVEIHNVSKDYLKSVCGKHVVQKWALDQYSMGAFSTYTPYQITHYSQMLAQNEGRIYFAGEYTAHPHGWIETSMKSAIREAINIHNA,./data/raw/alphafold//AF-P81383-F1-model_v4.pdb,1381,886,683,972
+1177,16623,16852,MSLDDFERYPLLFGPSPVHRLDRLTAHLGGAAVWAKREDCNSGIAFGGNKTRKLEYLVADAIAQGCDTLVSIGGVQSNHTRQVAAVAARAGLKCVLVQESWVDWPDAVYDKVGNILISRLAGAEVRLVKAGFGIGFKESWEQALDEIRERGGKPYAIPAGASDHRLGGLGFARWAAEVAEQERELGVHFDTIIVCSVTGSTQAGMIAGFAALDEDRPRRILGIDGSAKPKVTRDQIARIARNTASLLGVEPELDVELDERYHAGIYGIPDEQTLDAMKLAARTEGMVTDPVYEGKSMAGLIDLVSRKEIPAGSTVLYAHLGGQPALNGYSALFS,brenda,A0A076MQB4,NC1(C(=O)O)CC1.O>>CCC(=O)C(=O)O.N,0.085,1.1879998925933795e-14,60.0,8.5,3.5.99.7,1814.0,-1.0705810742857071,NC1(C(=O)O)CC1.O,CCC(=O)C(=O)O.N,-1.0705810742857071,NC1(C(=O)O)CC1.O__MSLDDFERYPLLFGPSPVHRLDRLTAHLGGAAVWAKREDCNSGIAFGGNKTRKLEYLVADAIAQGCDTLVSIGGVQSNHTRQVAAVAARAGLKCVLVQESWVDWPDAVYDKVGNILISRLAGAEVRLVKAGFGIGFKESWEQALDEIRERGGKPYAIPAGASDHRLGGLGFARWAAEVAEQERELGVHFDTIIVCSVTGSTQAGMIAGFAALDEDRPRRILGIDGSAKPKVTRDQIARIARNTASLLGVEPELDVELDERYHAGIYGIPDEQTLDAMKLAARTEGMVTDPVYEGKSMAGLIDLVSRKEIPAGSTVLYAHLGGQPALNGYSALFS,./data/raw/alphafold//AF-A0A076MQB4-F1-model_v4.pdb,2688,3786,2364,5266
+1178,2810,2849,MGSMAAAAEAAQEEETVVFRSKLPDIEIPSHLTLQAYCFEKLPEVAARPCLIDGQTGAVYSYGEVEELSRRAAAGLRRLGVGKGDVVMSLLRNCPEFAFTFLGAARLGAATTTANPFYTPHEIHRQASAAGARVIVTEACAVEKVRGFAADRGIPVVAVDGDFDGCVGFGEAMLDASIEPLDADEEVHPDDVVALPYSSGTTGLPKGVMLTHRSLVTSVAQQVDGENPNLYFRREDVVLCLLPLFHIYSLNSVLLAGLRAGSAIVIMRKFDLGALVDLTRRHGVTVAPFVPPIVVEIAKSPRVTADDLASIRMVMSGAAPMGKDLQDAFMAKIPNAVLGQGYGMTEAGPVLAMCLAFAKEPFEVKSGSCGTVVRNAELKIVDPDTGATLGRNQSGEICIRGEQIMKGYLNDPESTKNTIDKGGWLHTGDIGYVDDDDEIFIVDRLKEIIKYKGFQVPPAELEALLITHPDIKDAAVVPMIDEIAGEVPVAFIVRIEGSAISENEIKQFVAKEVVFYKRLNKVFFADSIPKSPSGKILRKDLRAKLAAGIPTNDNTQLKS,brenda,Q67W82,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)c(O)c1>>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/c1ccc(O)c(O)c1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.036,7.811477517353936e-15,30.0,7.5,6.2.1.12,4530.0,-1.4436974992327127,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)c(O)c1,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/c1ccc(O)c(O)c1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,-1.4436974992327127,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)c(O)c1__MGSMAAAAEAAQEEETVVFRSKLPDIEIPSHLTLQAYCFEKLPEVAARPCLIDGQTGAVYSYGEVEELSRRAAAGLRRLGVGKGDVVMSLLRNCPEFAFTFLGAARLGAATTTANPFYTPHEIHRQASAAGARVIVTEACAVEKVRGFAADRGIPVVAVDGDFDGCVGFGEAMLDASIEPLDADEEVHPDDVVALPYSSGTTGLPKGVMLTHRSLVTSVAQQVDGENPNLYFRREDVVLCLLPLFHIYSLNSVLLAGLRAGSAIVIMRKFDLGALVDLTRRHGVTVAPFVPPIVVEIAKSPRVTADDLASIRMVMSGAAPMGKDLQDAFMAKIPNAVLGQGYGMTEAGPVLAMCLAFAKEPFEVKSGSCGTVVRNAELKIVDPDTGATLGRNQSGEICIRGEQIMKGYLNDPESTKNTIDKGGWLHTGDIGYVDDDDEIFIVDRLKEIIKYKGFQVPPAELEALLITHPDIKDAAVVPMIDEIAGEVPVAFIVRIEGSAISENEIKQFVAKEVVFYKRLNKVFFADSIPKSPSGKILRKDLRAKLAAGIPTNDNTQLKS,./data/raw/alphafold//AF-Q67W82-F1-model_v4.pdb,1669,1278,4567,1522
+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
+1183,17042,17272,MTANAYDVIVIGGGISGLSAAKLLVDSGLNPVVLEARSRVGGRTYTVQNKETKWVDLGGAYIGPTQNRILRIAKQYGVKTYKVNEEESLVHYVKGKSYPFKGPFPPMWNPFAYMDYNNLWRTMDKMGMEIPKEAPWRAPHAEEWDKMTMQQLFDKICWTRSARRFATLFVNVNVTSEPHEVSALWFLWYVKQCGGTMRIFSTTNGGQERKFAGGANQISEGMARELGDRVKLSRAVCSIDQTGDLVEVRTVNEEVYKAKYVILAIPPGLNLKIHFNPELPPLRNQLIHRVPMGSVIKCMVYYKENFWRKKGYCGSMVIEEEDAPIGLTLDDTKPDGSVPAIMGFILARKSRKLANLTRDERKRRICEIYARVLGSEEALYPVHYEEKNWCEEEYSGGCYTAYFPPGIMTQFGRVLREPVGRLYFAGTETATEWSGYMEGAVQAGERASREVMCAMGKLHASQIWQSEPESMDVPARPFVTTFWERNLPSVGGFLKFMGVSSFLAAATAAGLVACKKGLLPRC,uniprot_search,Q6NSN2,NCc1ccc(F)cc1.O.O=O>>N.O=Cc1ccc(F)cc1.OO,0.25,8.090023690902265e-15,25.0,7.4,1.4.3.4,7955.0,-0.6020599913279624,NCc1ccc(F)cc1.O.O=O,N.O=Cc1ccc(F)cc1.OO,-0.6020599913279624,NCc1ccc(F)cc1.O.O=O__MTANAYDVIVIGGGISGLSAAKLLVDSGLNPVVLEARSRVGGRTYTVQNKETKWVDLGGAYIGPTQNRILRIAKQYGVKTYKVNEEESLVHYVKGKSYPFKGPFPPMWNPFAYMDYNNLWRTMDKMGMEIPKEAPWRAPHAEEWDKMTMQQLFDKICWTRSARRFATLFVNVNVTSEPHEVSALWFLWYVKQCGGTMRIFSTTNGGQERKFAGGANQISEGMARELGDRVKLSRAVCSIDQTGDLVEVRTVNEEVYKAKYVILAIPPGLNLKIHFNPELPPLRNQLIHRVPMGSVIKCMVYYKENFWRKKGYCGSMVIEEEDAPIGLTLDDTKPDGSVPAIMGFILARKSRKLANLTRDERKRRICEIYARVLGSEEALYPVHYEEKNWCEEEYSGGCYTAYFPPGIMTQFGRVLREPVGRLYFAGTETATEWSGYMEGAVQAGERASREVMCAMGKLHASQIWQSEPESMDVPARPFVTTFWERNLPSVGGFLKFMGVSSFLAAATAAGLVACKKGLLPRC,./data/raw/alphafold//AF-Q6NSN2-F1-model_v4.pdb,3455,2362,1292,3242
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+1190,4943,5015,MTDTKQLFIEAGQSQLFHNWESLSRKDQEELLSNLEQISSKRSPAKLLEDCQNAIKFSLANSSKDTGVEISPLPPTSYESLIGNSKKENEYWRLGLEAIGKGEVAVILMAGGQGTRLGSSQPKGCYDIGLPSKKSLFQIQAEKLIRLQDMVKDKKVEIPWYIMTSGPTRAATEAYFQEHNYFGLNKEQITFFNQGTLPAFDLTGKHFLMKDPVNLSQSPDGNGGLYRAIKENKLNEDFDRRGIKHVYMYCVDNVLSKIADPVFIGFAIKHGFELATKAVRKRDAHESVGLIATKNEKPCVIEYSEISNELAEAKDKDGLLKLRAGNIVNHYYLVDLLKRDLDQWCENMPYHIAKKKIPAYDSVTGKYTKPTEPNGIKLEQFIFDVFDTVPLNKFGCLEVDRCKEFSPLKNGPGSKNDNPETSRLAYLKLGTSWLEDAGAIVKDGVLVEVSSKLSYAGENLSQFKGKVFDRSGIVLEK,brenda,P43123,CC(O)=N[C@H]1[C@@H](OP(=O)(O)O)O[C@H](CO)[C@@H](O)[C@@H]1O.N=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1>>CC(O)=N[C@H]1[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=N)nc3O)[C@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O.O=P(O)(O)OP(=O)(O)O,15.4,1.4485278312838735e-14,30.0,8.3,2.7.7.23,4932.0,1.187520720836463,CC(O)=N[C@H]1[C@@H](OP(=O)(O)O)O[C@H](CO)[C@@H](O)[C@@H]1O.N=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1,CC(O)=N[C@H]1[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=N)nc3O)[C@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O.O=P(O)(O)OP(=O)(O)O,1.187520720836463,CC(O)=N[C@H]1[C@@H](OP(=O)(O)O)O[C@H](CO)[C@@H](O)[C@@H]1O.N=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1__MTDTKQLFIEAGQSQLFHNWESLSRKDQEELLSNLEQISSKRSPAKLLEDCQNAIKFSLANSSKDTGVEISPLPPTSYESLIGNSKKENEYWRLGLEAIGKGEVAVILMAGGQGTRLGSSQPKGCYDIGLPSKKSLFQIQAEKLIRLQDMVKDKKVEIPWYIMTSGPTRAATEAYFQEHNYFGLNKEQITFFNQGTLPAFDLTGKHFLMKDPVNLSQSPDGNGGLYRAIKENKLNEDFDRRGIKHVYMYCVDNVLSKIADPVFIGFAIKHGFELATKAVRKRDAHESVGLIATKNEKPCVIEYSEISNELAEAKDKDGLLKLRAGNIVNHYYLVDLLKRDLDQWCENMPYHIAKKKIPAYDSVTGKYTKPTEPNGIKLEQFIFDVFDTVPLNKFGCLEVDRCKEFSPLKNGPGSKNDNPETSRLAYLKLGTSWLEDAGAIVKDGVLVEVSSKLSYAGENLSQFKGKVFDRSGIVLEK,./data/raw/alphafold//AF-P43123-F1-model_v4.pdb,1392,900,698,989
+1191,11686,11844,MAEEVSTLMKATVLMRQPGRVQEIVGALRKGGGDRLQVISDFDMTLSRFAYNGKRCPSSYNILDNSKIISEECRKELTALLHHYYPIEIDPHRTVKEKLPHMVEWWTKAHNLLCQQKIQKFQIAQVVRESNAMLREGYKTFFNTLYHNNIPLFIFSAGIGDILEEIIRQMKVFHPNIHIVSNYMDFNEDGFLQGFKGQLIHTYNKNSSACENSGYFQQLEGKTNVILLGDSIGDLTMADGVPGVQNILKIGFLNDKVEERRERYMDSYDIVLEKDETLDVVNGLLQHILCQGVQLEMQGP,sabio,Q969T7,C[n+]1cn(C2OC(COP(=O)(O)O)C(O)C2O)c2nc(N)[nH]c(=O)c21.O>>CN=c1nc(O)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2[nH]1.O=P(O)(O)O,0.24,0.1271863304977294,37.0,7.5,3.1.3.91,9606.0,-0.619788758288394,C[n+]1cn(C2OC(COP(=O)(O)O)C(O)C2O)c2nc(N)[nH]c(=O)c21.O,CN=c1nc(O)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2[nH]1.O=P(O)(O)O,-0.619788758288394,C[n+]1cn(C2OC(COP(=O)(O)O)C(O)C2O)c2nc(N)[nH]c(=O)c21.O__MAEEVSTLMKATVLMRQPGRVQEIVGALRKGGGDRLQVISDFDMTLSRFAYNGKRCPSSYNILDNSKIISEECRKELTALLHHYYPIEIDPHRTVKEKLPHMVEWWTKAHNLLCQQKIQKFQIAQVVRESNAMLREGYKTFFNTLYHNNIPLFIFSAGIGDILEEIIRQMKVFHPNIHIVSNYMDFNEDGFLQGFKGQLIHTYNKNSSACENSGYFQQLEGKTNVILLGDSIGDLTMADGVPGVQNILKIGFLNDKVEERRERYMDSYDIVLEKDETLDVVNGLLQHILCQGVQLEMQGP,./data/raw/alphafold//AF-Q969T7-F1-model_v4.pdb,1906,4041,1894,3722
+1192,18273,18533,MELGAGGVVFNAKREVLLLRDRMGFWVFPKGHPEPGESLEEAAVREVWEETGVRAEVLLPLYPTRYVNPKGVEREVHWFLMRGEGAPRLEEGMTGAGWFSPEEARALLAFPEDLGLLEVALERLPL,brenda,Q75UV1,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=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(O)C1O.O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,4.1,33.311440179804094,25.0,7.0,3.6.1.61,274.0,0.6127838567197355,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=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(O)C1O.O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.6127838567197355,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=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(O)C1O.O__MELGAGGVVFNAKREVLLLRDRMGFWVFPKGHPEPGESLEEAAVREVWEETGVRAEVLLPLYPTRYVNPKGVEREVHWFLMRGEGAPRLEEGMTGAGWFSPEEARALLAFPEDLGLLEVALERLPL,./data/raw/alphafold//AF-Q75UV1-F1-model_v4.pdb,71,2548,2843,5690
+1193,5456,5542,MKNQRLTPLAAFLLLISVAATAHTLPSQGTETKGAETNSPAITSLTGCGPSSAINQFFNQFGSSGKMPAELGRWLNDAKAQAVEPYQVFDNVYYVGICWVSAWLIKTSEGPVLIDTLYGEFTDQLMDNIKKIGVEPSDIKMVLLTHGHFDHVGGVSKLKSLTNARFVMSEEGWKEAQADAKKTLGKPSAWAMPDPATTDILVKDGDALTVGDTTFHAYITPGHTWGTTSYVLDVKERNNTYHAITIGGLGLNAIDGPQQVEAYIRSIDRIKVMVEDSKHPITVHLTAHPFSNGQIEMQNQLKVHQPDQPHPMVDAKGLLKQLATLRAGAIERLAVEQARIQK,brenda,Q6D395,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.O>>,9.0,99.75213781137688,30.0,7.0,3.5.2.6,554.0,0.9542425094393248,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.O,,0.9542425094393248,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.O__MKNQRLTPLAAFLLLISVAATAHTLPSQGTETKGAETNSPAITSLTGCGPSSAINQFFNQFGSSGKMPAELGRWLNDAKAQAVEPYQVFDNVYYVGICWVSAWLIKTSEGPVLIDTLYGEFTDQLMDNIKKIGVEPSDIKMVLLTHGHFDHVGGVSKLKSLTNARFVMSEEGWKEAQADAKKTLGKPSAWAMPDPATTDILVKDGDALTVGDTTFHAYITPGHTWGTTSYVLDVKERNNTYHAITIGGLGLNAIDGPQQVEAYIRSIDRIKVMVEDSKHPITVHLTAHPFSNGQIEMQNQLKVHQPDQPHPMVDAKGLLKQLATLRAGAIERLAVEQARIQK,./data/raw/alphafold//AF-Q6D395-F1-model_v4.pdb,1455,987,798,1112
+1194,21098,21420,MTTTITEMSATIVDLPSRRPHKFAATTMHHQSIVLVRVRDSDGGEGIGEAVTPGGPWWGGESVETIKTIIDQYLAPVIIGRDPSTIGVASQSMDGLVFGNSVAKAAIETALWTSAERRSRIPVSDLLGGLRRKRIPITWAFSAGSASDLIDEAAQKLDVGHRSFKFKMGAEPADTDSRRVLDVLECIPDECAVIVDPNGRWSELEAHRWLPILADAGVTVAEQPIARWNTDGLARLRDKLSIPIMADESVTTVQQAIALADAGAVSAFAIKIPKSGGLSRAREIAAIAEASGLACFGAATPESSVMGAISAQLYGTMPDLSVGCELFGPGLLIDEVVTEPLKYDRGELLIPTGPGSGVNLDEERLRKYSRD,brenda,Q8G9L1,O=C(O)/C=C\C(Cl)=C/C(=O)O>>O=C(O)/C=C1\C=CC(=O)O1,8.8,11.478392817229084,65.0,5.95,5.5.1.7,37919.0,0.9444826721501688,O=C(O)/C=C\C(Cl)=C/C(=O)O,O=C(O)/C=C1\C=CC(=O)O1,0.9444826721501688,O=C(O)/C=C\C(Cl)=C/C(=O)O__MTTTITEMSATIVDLPSRRPHKFAATTMHHQSIVLVRVRDSDGGEGIGEAVTPGGPWWGGESVETIKTIIDQYLAPVIIGRDPSTIGVASQSMDGLVFGNSVAKAAIETALWTSAERRSRIPVSDLLGGLRRKRIPITWAFSAGSASDLIDEAAQKLDVGHRSFKFKMGAEPADTDSRRVLDVLECIPDECAVIVDPNGRWSELEAHRWLPILADAGVTVAEQPIARWNTDGLARLRDKLSIPIMADESVTTVQQAIALADAGAVSAFAIKIPKSGGLSRAREIAAIAEASGLACFGAATPESSVMGAISAQLYGTMPDLSVGCELFGPGLLIDEVVTEPLKYDRGELLIPTGPGSGVNLDEERLRKYSRD,./data/raw/alphafold//AF-Q8G9L1-F1-model_v4.pdb,586,3310,5621,6513
+1195,10301,10453,MSTENLPQSPEQPSRKPRVAVVFGGRSSEHGISVVTAGAVLKAIDRTKYDVLPIGITRDGRWALTADEPERMAITDRALPAVEDLAESHEGDVVLPVAPANREVVYSEPGSVPKALGEVDVVFPVLHGPYGEDGTLQGLLELSGVPYVGAGVLASAVGQDKEYMKRVFTSFGLKVGPYVVIRPREWQQDEAAARKKIVDFAGEHGWPLFVKPARAGSSIGITKVDDLSGLDEAIAEAQSHDPKILVEAAITGREIECGVLEFEDGPRASVPAEIPPPDAHAYYDFEAKYIDSTPGIVPAPLTEAETAEIRRLAVDAFEAASCEGLVRADFFLTEDGEFVINEINTLPGFTPISMYPQMWQATGVGYPELIDLLVRAALRRSTGLR,uniprot_search,A0A5C8H210,C[C@@H](N)C(=O)O.C[C@@H](N)C(=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@@H](N)C(O)=N[C@H](C)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,1.67,0.0,30.0,8.0,6.3.2.4,1914.0,0.2227164711475832,C[C@@H](N)C(=O)O.C[C@@H](N)C(=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@@H](N)C(O)=N[C@H](C)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,0.2227164711475832,C[C@@H](N)C(=O)O.C[C@@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MSTENLPQSPEQPSRKPRVAVVFGGRSSEHGISVVTAGAVLKAIDRTKYDVLPIGITRDGRWALTADEPERMAITDRALPAVEDLAESHEGDVVLPVAPANREVVYSEPGSVPKALGEVDVVFPVLHGPYGEDGTLQGLLELSGVPYVGAGVLASAVGQDKEYMKRVFTSFGLKVGPYVVIRPREWQQDEAAARKKIVDFAGEHGWPLFVKPARAGSSIGITKVDDLSGLDEAIAEAQSHDPKILVEAAITGREIECGVLEFEDGPRASVPAEIPPPDAHAYYDFEAKYIDSTPGIVPAPLTEAETAEIRRLAVDAFEAASCEGLVRADFFLTEDGEFVINEINTLPGFTPISMYPQMWQATGVGYPELIDLLVRAALRRSTGLR,./data/raw/alphafold//AF-A0A5C8H210-F1-model_v4.pdb,3647,3634,1426,3388
+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
+1198,22211,22544,MSLLATVGPTGGVKNRLDIVDFVRDEKFFTLYVRALQAIQDKDQADYSSFFQLSGIHGLPFTPWAKPKDTPTVPYESGYCTHSQVLFPTWHRVYVSIYEQVLQEAAKGIAKKFTVHKKEWVQAAEDLRQPYWDTGFALVPPDEIIKLEQVKITNYDGTKITVRNPILRYSFHPIDPSFSGYPNFDTWRTTVRNPDADKKENIPALIAKLDLEADSTREKTYNMLKFNANWEAFSNHGEFDDTHANSLEAVHDDIHGFVGRGAIRGHMTHALFAAFDPIFWLHHSNVDRHLSLWQALYPGVWVTQGPEREGSMGFAPGTELNKDSALEPFYETEDKPWTSVPLTDTALLNYSYPDFDKVKGGTPDLVRDYINDHIDRRYGIKKSEGGKNPALDLLSDFKGVTHDHNEDLKMFDWTIQASWKKFELDDSFAIIFYFAADGSTNVTKENYIGSINIFRGTTPTNCANCRTQDNLVQEGFVHLDRFIARDLDTFDPQAVHRYLKEKKLSYKVVADDHSVTLKSLRIRVQGRPLHLPPGVSFPRLDKNIPIVNFDDVLDLVTGVVNIGLTAVGATAGVAIGVVGATAGTAIGVAGAATDAVTNIAKGGLGALGRIF,brenda,C7FF05,O=O.Oc1ccccc1O>>O.O=C1C=CC=CC1=O,1080.0,5.942701349448964,25.0,6.8,1.14.18.1,5341.0,3.03342375548695,O=O.Oc1ccccc1O,O.O=C1C=CC=CC1=O,3.03342375548695,O=O.Oc1ccccc1O__MSLLATVGPTGGVKNRLDIVDFVRDEKFFTLYVRALQAIQDKDQADYSSFFQLSGIHGLPFTPWAKPKDTPTVPYESGYCTHSQVLFPTWHRVYVSIYEQVLQEAAKGIAKKFTVHKKEWVQAAEDLRQPYWDTGFALVPPDEIIKLEQVKITNYDGTKITVRNPILRYSFHPIDPSFSGYPNFDTWRTTVRNPDADKKENIPALIAKLDLEADSTREKTYNMLKFNANWEAFSNHGEFDDTHANSLEAVHDDIHGFVGRGAIRGHMTHALFAAFDPIFWLHHSNVDRHLSLWQALYPGVWVTQGPEREGSMGFAPGTELNKDSALEPFYETEDKPWTSVPLTDTALLNYSYPDFDKVKGGTPDLVRDYINDHIDRRYGIKKSEGGKNPALDLLSDFKGVTHDHNEDLKMFDWTIQASWKKFELDDSFAIIFYFAADGSTNVTKENYIGSINIFRGTTPTNCANCRTQDNLVQEGFVHLDRFIARDLDTFDPQAVHRYLKEKKLSYKVVADDHSVTLKSLRIRVQGRPLHLPPGVSFPRLDKNIPIVNFDDVLDLVTGVVNIGLTAVGATAGVAIGVVGATAGTAIGVAGAATDAVTNIAKGGLGALGRIF,./data/raw/alphafold//AF-C7FF05-F1-model_v4.pdb,1606,1194,2526,5344
+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
+1200,2279,2312,MDPKHQRVTLNDGHSIPVLGFGTYAPDEVPKSEAGEAAKIAIDVGFRHIDTAHAYQNEEEVGLAIRSKIADGTVKREDVFCTTKLWCTFFRPELVRKGLEQSLRKLQLDYVDLYLMHYPIAMKPGEEMFPTDEHGKTISDTVDICATWEAMEKCKDAGLAKSIGVSNFNHKQLEKILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAYSALGSSRDPKWVDQSSPVLLEDPVIGALAKKHKQSPALIALRYQLQRGVVVLAKSFIEREIKENIKVFGFQLSSEDMKALDGLNQNLRYCPAHFYIGHPHYPFSDEY,brenda,J7M9D0,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)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(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=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+],0.0014,5.791938731903369e-15,25.0,7.4,1.1.1.239,9986.0,-2.853871964321762,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)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(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=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+],-2.853871964321762,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)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__MDPKHQRVTLNDGHSIPVLGFGTYAPDEVPKSEAGEAAKIAIDVGFRHIDTAHAYQNEEEVGLAIRSKIADGTVKREDVFCTTKLWCTFFRPELVRKGLEQSLRKLQLDYVDLYLMHYPIAMKPGEEMFPTDEHGKTISDTVDICATWEAMEKCKDAGLAKSIGVSNFNHKQLEKILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAYSALGSSRDPKWVDQSSPVLLEDPVIGALAKKHKQSPALIALRYQLQRGVVVLAKSFIEREIKENIKVFGFQLSSEDMKALDGLNQNLRYCPAHFYIGHPHYPFSDEY,./data/raw/esmfold//ESMFold-J7M9D0-v1.pdb,1329,1150,6188,842
+1201,8764,8901,MLKVISSLLVYMTASVMAVASPLAHSGEPSGEYPTVNEIPVGEVRLYQIADGVWSHIATQSFDGAVYPSNGLIVRDGDELLLIDTAWGAKNTAALLAEIEKQIGLPVTRAVSTHFHDDRVGGVDVLRKAGVATYASPSTRRLAEAEGNEIPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVLALSRTSAGNVADADLAEWPTSVERIQKHYPEAEVVIPGHGLPGGLDLLQHTANVVTAHKNRSVAE,brenda,Q4ZE97,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(=N)[nH]1.O>>,9.2,99.78924695830672,25.0,7.5,3.5.2.6,550.0,0.9637878273455552,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(=N)[nH]1.O,,0.9637878273455552,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(=N)[nH]1.O__MLKVISSLLVYMTASVMAVASPLAHSGEPSGEYPTVNEIPVGEVRLYQIADGVWSHIATQSFDGAVYPSNGLIVRDGDELLLIDTAWGAKNTAALLAEIEKQIGLPVTRAVSTHFHDDRVGGVDVLRKAGVATYASPSTRRLAEAEGNEIPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVLALSRTSAGNVADADLAEWPTSVERIQKHYPEAEVVIPGHGLPGGLDLLQHTANVVTAHKNRSVAE,./data/raw/alphafold//AF-Q4ZE97-F1-model_v4.pdb,1446,972,778,2375
+1202,17697,17939,MPIKRLDTVVVNTGSQNDQHSASVPPVYLSTTFKVDLNNEDAQNYDYSRSGNPTRSVLQHQIGKLYRVPQENVLAVSSGMTTLDVILRGLVLLNGTDNHTPTIIAGDDLYGGTQRLLNFFKQQSHAVSVHVDTSDFEKFKTVFQSLDKVDCVLLESPTNPLCKVVDIPRILRFVKCISPDTTVVVDNTMMSGLNCNPLQLNPGCDVVYESATKYLNGHHDLMGGVIISKTPEIASKLYFVINSTGAGLSPMDSWLLVRGLKTLGVRLYQQQRNAMILAHWLENSCGFKPTRTNKATKTRFVGLRSNPDFKLHKSFNNGPGAVLSFETGSFEHSKRLVSSKKLSIWAVTVSFGCVNSLLSMPCKMSHASIDPELRKERDFPEDLVRLCCGIENIVDLKKDLLAAMVDADIIEVRENGKYLFNKLNKNLAVNTTIDDLHKPLSIYEEFYNQDLIRKDSELNIKSSKL,brenda,E3VL26,N[C@H](CSCSC[C@@H](N)C(=O)O)C(=O)O>>CC(=O)C(=O)O.N.N[C@@H](CSCS)C(=O)O,1.27,3.413994439822541,37.0,8.5,4.4.1.13,4932.0,0.1038037209559568,N[C@H](CSCSC[C@@H](N)C(=O)O)C(=O)O,CC(=O)C(=O)O.N.N[C@@H](CSCS)C(=O)O,0.1038037209559568,N[C@H](CSCSC[C@@H](N)C(=O)O)C(=O)O__MPIKRLDTVVVNTGSQNDQHSASVPPVYLSTTFKVDLNNEDAQNYDYSRSGNPTRSVLQHQIGKLYRVPQENVLAVSSGMTTLDVILRGLVLLNGTDNHTPTIIAGDDLYGGTQRLLNFFKQQSHAVSVHVDTSDFEKFKTVFQSLDKVDCVLLESPTNPLCKVVDIPRILRFVKCISPDTTVVVDNTMMSGLNCNPLQLNPGCDVVYESATKYLNGHHDLMGGVIISKTPEIASKLYFVINSTGAGLSPMDSWLLVRGLKTLGVRLYQQQRNAMILAHWLENSCGFKPTRTNKATKTRFVGLRSNPDFKLHKSFNNGPGAVLSFETGSFEHSKRLVSSKKLSIWAVTVSFGCVNSLLSMPCKMSHASIDPELRKERDFPEDLVRLCCGIENIVDLKKDLLAAMVDADIIEVRENGKYLFNKLNKNLAVNTTIDDLHKPLSIYEEFYNQDLIRKDSELNIKSSKL,./data/raw/alphafold//AF-E3VL26-F1-model_v4.pdb,2777,5337,2605,5430
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+1204,11219,11375,MNTPEHMTAVVQRYVAALNAGDLDGIVALFADDATVEDPVGSEPRSGTAAIREFYANSLKLPLAVELTQEVRAVANEAAFAFTVSFEYQGRKTVVAPIDHFRFNGAGKVVSMRALFGEKNIHAGA,brenda,P00947,C[C@]12CCC(=O)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12>>C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12,31700.0,0.0,25.0,7.0,5.3.3.1,285.0,4.501059262217751,C[C@]12CCC(=O)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12,C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12,4.501059262217751,C[C@]12CCC(=O)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12__MNTPEHMTAVVQRYVAALNAGDLDGIVALFADDATVEDPVGSEPRSGTAAIREFYANSLKLPLAVELTQEVRAVANEAAFAFTVSFEYQGRKTVVAPIDHFRFNGAGKVVSMRALFGEKNIHAGA,./data/raw/alphafold//AF-P00947-F1-model_v4.pdb,3136,1921,3563,2390
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+1216,83,89,MRKKQKLPFDKLAIALMSTSILLNAQSDIKANTVTEDTPVTEQAVETPQPTAVSEEVPSSKETKTPQTPDDAEETIADDANDLAPQAPAKTADTPATSKATIRDLNDPSQVKTLQEKAGKGAGTVVAVIDAGFDKNHEAWRLTDKTKARYQSKEDLEKAKKEHGITYGEWVNDKVAYYHDYSKDGKTAVDQEHGTHVSGILSGNAPSETKEPYRLEGAMPEAQLLLMRVEIVNGLADYARNYAQAIRDAVNLGAKVINMSFGNAALAYANLPDETKKAFDYAKSKGVSIVTSAGNDSSFGGKTRLPLADHPDYGVVGTPAAADSTLTVASYSPDKQLTETAMVKTDDQQDKEMPVLSTNRFEPNKAYDYAYANRGMKEDDFKDVKGKIALIERGDIDFKDKVANAKKAGAVGVLIYDNQDKGFPIELPNVDQMPAAFISRKDGLLLKDNPQKTITFNATPKVLPTASGTKLSRFSSWGLTADGNIKPDIAAPGQDILSSVANNKYAKLSGTSMSAPLVAGIMGLLQKQYETQYPDMTPSERLDLAKKVLMSSATALYDEDEKAYFSPRQQGAGAVDAKKASAATMYVTDKDNTSSKVHLNNVSDKFEVTVTVHNKSDKPQELYYQATVQTDKVDGKHFALAPKVLYEASWQKITIPANSSKQVTVPIDASRFSKDLLAQMKNGYFLEGFVRFKQDPTKEELMSIPYIGFRGDFGNLSAVEKPIYDSKDGSSYYHEANSDAKDQLDGDGLQFYALKNNFTALTTESNPWTIIKAVKEGVENIEDIESSEITETIFAGTFAKQDDDSHYYIHRHANGEPYAAISPNGDGNRDYVQFQGTFLRNAKNLVAEVLDKEGNVVWTSEVTEQVVKNYNNDLASTLGSTRFEKTRWDGKDKDGKVVANGTYTYRVRYTPISSGAKEQHTDFDVIVDNTTPEVATSATFSTEDRRLTLASKPKTSQPVYRERIAYTYMDEDLPTTEYISPNEDGTFTLPEEAETMEGATVPLKMSDFTYVVEDMAGNITYTPVTKLLEGHSNKPEQDGSGQTPDKKPEAKPEQDGSDQAPDKKPEAKPEQDGSGQTPDKKPETKPEKDSSGQTPGKTPQKGQPSRTLEKRSSKRALATKASTRDQLPTTNDKDTNRLHLLKLVMTTFFFGLVAHIFKTKRQKETKK,sabio,P15926,*C(N)C(=O)NC(*)C(=O)O.O>>*C(N)C(=O)NC(*)C(=O)O.*C(N)C(=O)NC(*)C(=O)O,1.1,27.38368627297689,25.0,7.4,3.4.21.110,1314.0,0.041392685158225,*C(N)C(=O)NC(*)C(=O)O.O,*C(N)C(=O)NC(*)C(=O)O.*C(N)C(=O)NC(*)C(=O)O,0.041392685158225,*C(N)C(=O)NC(*)C(=O)O.O__MRKKQKLPFDKLAIALMSTSILLNAQSDIKANTVTEDTPVTEQAVETPQPTAVSEEVPSSKETKTPQTPDDAEETIADDANDLAPQAPAKTADTPATSKATIRDLNDPSQVKTLQEKAGKGAGTVVAVIDAGFDKNHEAWRLTDKTKARYQSKEDLEKAKKEHGITYGEWVNDKVAYYHDYSKDGKTAVDQEHGTHVSGILSGNAPSETKEPYRLEGAMPEAQLLLMRVEIVNGLADYARNYAQAIRDAVNLGAKVINMSFGNAALAYANLPDETKKAFDYAKSKGVSIVTSAGNDSSFGGKTRLPLADHPDYGVVGTPAAADSTLTVASYSPDKQLTETAMVKTDDQQDKEMPVLSTNRFEPNKAYDYAYANRGMKEDDFKDVKGKIALIERGDIDFKDKVANAKKAGAVGVLIYDNQDKGFPIELPNVDQMPAAFISRKDGLLLKDNPQKTITFNATPKVLPTASGTKLSRFSSWGLTADGNIKPDIAAPGQDILSSVANNKYAKLSGTSMSAPLVAGIMGLLQKQYETQYPDMTPSERLDLAKKVLMSSATALYDEDEKAYFSPRQQGAGAVDAKKASAATMYVTDKDNTSSKVHLNNVSDKFEVTVTVHNKSDKPQELYYQATVQTDKVDGKHFALAPKVLYEASWQKITIPANSSKQVTVPIDASRFSKDLLAQMKNGYFLEGFVRFKQDPTKEELMSIPYIGFRGDFGNLSAVEKPIYDSKDGSSYYHEANSDAKDQLDGDGLQFYALKNNFTALTTESNPWTIIKAVKEGVENIEDIESSEITETIFAGTFAKQDDDSHYYIHRHANGEPYAAISPNGDGNRDYVQFQGTFLRNAKNLVAEVLDKEGNVVWTSEVTEQVVKNYNNDLASTLGSTRFEKTRWDGKDKDGKVVANGTYTYRVRYTPISSGAKEQHTDFDVIVDNTTPEVATSATFSTEDRRLTLASKPKTSQPVYRERIAYTYMDEDLPTTEYISPNEDGTFTLPEEAETMEGATVPLKMSDFTYVVEDMAGNITYTPVTKLLEGHSNKPEQDGSGQTPDKKPEAKPEQDGSDQAPDKKPEAKPEQDGSGQTPDKKPETKPEKDSSGQTPGKTPQKGQPSRTLEKRSSKRALATKASTRDQLPTTNDKDTNRLHLLKLVMTTFFFGLVAHIFKTKRQKETKK,./data/raw/alphafold//AF-P15926-F1-model_v4.pdb,922,428,67,73
+1217,10836,10991,MKYNQYAYVETDFQQQVKELIDINFLPKNYQVWDFSSLLAKLVKNAIAEAKTDAAKNAKLAEFAVSDHQTLADFLKEKPTEIGTKQFYNVALQLLGYHVHYDYDFADPTGFMQRNALPFLQDISDNQKLISAFYRLLNTRAKNGQILLDVMAGKGYFTQFWGQNKFKFFNGKSIPVFDTNKVIREVVYVETDLDTDHDGKSDLIQVTVFRPEETNKGLKVPALYTASPYFGGIIANEKRNHNVDENLSDSTEWNDPQYVHSPIVKAEKPDGSSRPATEEAVHKSSYPLNEYMLARGFASVFAGAIGTRGSDGVRITGAPEETESAAAVIEWLHGDRVAYTDRTRTVQTTADWCNGNIGMTGRSYLGTLQIAIATTGVKGLKTVVSEAAISSWYDYYREHGLVIAPEACQGEDLDLLAETCQSNLWDAGSYLKIKPEYDKMQKQLREKEDRNTGQYSDFWEARNYRHHADGIKCSWISVHGLNDWNVKPKNVYKIWQLVKKMPMKHHLFLHQGPHYNMNNLVSIDFTDLMNLWFVHELLGIENNAYNQWPTVMIQDNLQADKWHEEPDWSNDLGQEKIYYPTDEGELFQDGNGKAQKSFTDVGGIEFKKAGISESDWQYKFICGDEKWAKPSLRFETDEFTHPTTIVGRPEVKVRVSASLPKGEISVALVELGERQRLTATPKFLMHGGQELGYRFGTDTLQEFVPDKKTKAKLITKAHMNLQNFKDMKKPEAIDADKFYDLDFLLQPTYYTIPSGSKLALIIYSTDQGMTKRPLEDETYTIDLANTEIKFYEK,brenda,S4TJ23,C[C@H](N=C(O)[C@@H]1CCCN1C(=O)O[C@H](N)C(O)OC(=O)O)C(=O)O.O>>C[C@H](N)C(=O)O.N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)O,199.0,6.980112706780613,37.0,6.5,3.4.14.11,1587.0,2.298853076409707,C[C@H](N=C(O)[C@@H]1CCCN1C(=O)O[C@H](N)C(O)OC(=O)O)C(=O)O.O,C[C@H](N)C(=O)O.N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)O,2.298853076409707,C[C@H](N=C(O)[C@@H]1CCCN1C(=O)O[C@H](N)C(O)OC(=O)O)C(=O)O.O__MKYNQYAYVETDFQQQVKELIDINFLPKNYQVWDFSSLLAKLVKNAIAEAKTDAAKNAKLAEFAVSDHQTLADFLKEKPTEIGTKQFYNVALQLLGYHVHYDYDFADPTGFMQRNALPFLQDISDNQKLISAFYRLLNTRAKNGQILLDVMAGKGYFTQFWGQNKFKFFNGKSIPVFDTNKVIREVVYVETDLDTDHDGKSDLIQVTVFRPEETNKGLKVPALYTASPYFGGIIANEKRNHNVDENLSDSTEWNDPQYVHSPIVKAEKPDGSSRPATEEAVHKSSYPLNEYMLARGFASVFAGAIGTRGSDGVRITGAPEETESAAAVIEWLHGDRVAYTDRTRTVQTTADWCNGNIGMTGRSYLGTLQIAIATTGVKGLKTVVSEAAISSWYDYYREHGLVIAPEACQGEDLDLLAETCQSNLWDAGSYLKIKPEYDKMQKQLREKEDRNTGQYSDFWEARNYRHHADGIKCSWISVHGLNDWNVKPKNVYKIWQLVKKMPMKHHLFLHQGPHYNMNNLVSIDFTDLMNLWFVHELLGIENNAYNQWPTVMIQDNLQADKWHEEPDWSNDLGQEKIYYPTDEGELFQDGNGKAQKSFTDVGGIEFKKAGISESDWQYKFICGDEKWAKPSLRFETDEFTHPTTIVGRPEVKVRVSASLPKGEISVALVELGERQRLTATPKFLMHGGQELGYRFGTDTLQEFVPDKKTKAKLITKAHMNLQNFKDMKKPEAIDADKFYDLDFLLQPTYYTIPSGSKLALIIYSTDQGMTKRPLEDETYTIDLANTEIKFYEK,./data/raw/alphafold//AF-S4TJ23-F1-model_v4.pdb,3714,3725,1527,3497
+1218,5442,5528,MTDSSLLRGCVRLVKIISLVACASTIVEAQAGPPDITKHVEVRRTAYGVPHIRADNMEAAGYGLGYVQIEDYGARVAMGLLHARGEMGRWFGPDSIEGDFSARLNYETAVQGYPTLDSDTRAIYDGFAEGVNRYIELHPEEFPGGFTPRFTGYDVLAHEVSDASARQAARFLGRIDPAARRRRAADENVAIIAPIAGGQDPPDVGSNAWAFAPSRTKSGHSILLRNPHLNWNSGYYEAQLTVPGVMDFYGDFRVGSPFGVVGGFNRDLGWSTTNNAPLLSQIYSLDVDSTQTDHYLLDGASIPLQRQLTSVEFRNGNGLSSETRETWRTTLGPVIYRGNGKVYVLKAAGDGDVRGGEQFLRMMRSHSLAEWKDAMRMRARITSNFTYADRAGNILYVWNASIPKLPLPSGGDTAAVPITRTSEAWTSFVPFDSLPQLLNPKGGYVENSNDPPYFTNLQQPLDRSKYPAYFPELRLGLRQQLALDLINNERKLNLQDVLALKQSYRMLLADRVRDDLVKEVRASNPSPDVAKAIDMIARWDKTVAPASRGGVLFEMWWRKYIDHTRPDTMYAVQWTAKAPASTPTGIRFPDRSVDAFKWAVDETTRRFGAPDVAWGDVHRVRVGKVDVPVGGCNGDIGCFRVLWYKDDPDGKREATGGDGWILAVQFDNEPQAYSILAYGESSREDSPHHSDQAAMFARGEMKRVYWMDKDVDAQTVERYRPGEKR,brenda,D6R1Q1,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)Cc1ccccc1,64.2,8.053483426577734e-15,37.0,7.4,3.5.1.11,77133.0,1.8075350280688527,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)Cc1ccccc1,1.8075350280688527,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O.O__MTDSSLLRGCVRLVKIISLVACASTIVEAQAGPPDITKHVEVRRTAYGVPHIRADNMEAAGYGLGYVQIEDYGARVAMGLLHARGEMGRWFGPDSIEGDFSARLNYETAVQGYPTLDSDTRAIYDGFAEGVNRYIELHPEEFPGGFTPRFTGYDVLAHEVSDASARQAARFLGRIDPAARRRRAADENVAIIAPIAGGQDPPDVGSNAWAFAPSRTKSGHSILLRNPHLNWNSGYYEAQLTVPGVMDFYGDFRVGSPFGVVGGFNRDLGWSTTNNAPLLSQIYSLDVDSTQTDHYLLDGASIPLQRQLTSVEFRNGNGLSSETRETWRTTLGPVIYRGNGKVYVLKAAGDGDVRGGEQFLRMMRSHSLAEWKDAMRMRARITSNFTYADRAGNILYVWNASIPKLPLPSGGDTAAVPITRTSEAWTSFVPFDSLPQLLNPKGGYVENSNDPPYFTNLQQPLDRSKYPAYFPELRLGLRQQLALDLINNERKLNLQDVLALKQSYRMLLADRVRDDLVKEVRASNPSPDVAKAIDMIARWDKTVAPASRGGVLFEMWWRKYIDHTRPDTMYAVQWTAKAPASTPTGIRFPDRSVDAFKWAVDETTRRFGAPDVAWGDVHRVRVGKVDVPVGGCNGDIGCFRVLWYKDDPDGKREATGGDGWILAVQFDNEPQAYSILAYGESSREDSPHHSDQAAMFARGEMKRVYWMDKDVDAQTVERYRPGEKR,./data/raw/alphafold//AF-D6R1Q1-F1-model_v4.pdb,1460,996,809,1127
+1219,22760,23100,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.OCC1OC(O)(CO)C(O)C1O>>O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1.OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O,142.8,1.5219977257304432e-14,30.0,8.0,2.4.1.13,4113.0,2.154728207440156,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.OCC1OC(O)(CO)C(O)C1O,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1.OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O,2.154728207440156,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.OCC1OC(O)(CO)C(O)C1O__MAERVLTRVHSLRERVDATLAAHRNEILLFLSRIESHGKGILKPHELLAEFDAIRQDDKNKLNEHAFEELLKSTQEAIVLPPWVALAIRLRPGVWEYIRVNVNALVVEELSVPEYLQFKEELVDGASNGNFVLELDFEPFTASFPKPTLTKSIGNGVEFLNRHLSAKMFHDKESMTPLLEFLRAHHYKGKTMMLNDRIQNSNTLQNVLRKAEEYLIMLPPETPYFEFEHKFQEIGLEKGWGDTAERVLEMVCMLLDLLEAPDSCTLEKFLGRIPMVFNVVILSPHGYFAQENVLGYPDTGGQVVYILDQVPALEREMLKRIKEQGLDIIPRILIVTRLLPDAVGTTCGQRIEKVYGAEHSHILRVPFRTEKGIVRKWISRFEVWPYMETFIEDVAKEISAELQAKPDLIIGNYSEGNLAASLLAHKLGVTQCTIAHALEKTKYPDSDIYWKKFDEKYHFSSQFTADLIAMNHTDFIITSTFQEIAGSKDTVGQYESHMAFTMPGLYRVVHGINVFDPKFNIVSPGADINLYFSYSETEKRLTAFHPEIDELLYSDVENDEHLCVLKDRTKPILFTMARLDRVKNLTGLVEWYAKNPRLRGLVNLVVVGGDRRKESKDLEEQAEMKKMYELIETHNLNGQFRWISSQMNRVRNGELYRYIADTKGAFVQPAFYEAFGLTVVEAMTCGLPTFATNHGGPAEIIVHGKSGFHIDPYHGEQAADLLADFFEKCKKDPSHWETISMGGLKRIEEKYTWQIYSESLLTLAAVYGFWKHVSKLDRLEIRRYLEMFYALKYRKMAEAVPLAAE,./data/raw/alphafold//AF-P10691-F1-model_v4.pdb,98,2583,2881,999
+1220,10493,10646,MGLFAGKGVLVTGGARGIGRAIAQAFAREGALVALCDLRPEGKEVAEAIGGAFFQVDLEDERERVRFVEEAAYALGRVDVLVNNAAIAAPGSALTVRLPEWRRVLEVNLTAPMHLSALAAREMRKVGGGAIVNVASVQGLFAEQENAAYNASKGGLVNLTRSLALDLAPLRIRVNAVAPGAIATEAVLEAIALSPDPERTRRDWEDLHALRRLGKPEEVAEAVLFLASEKASFITGAILPVDGGMTASFMMAGRPV,brenda,Q5SLC4,C[C@@H]1OC(O)[C@@H](O)[C@H](O)[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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1>>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+],0.1067,10.837947152800467,50.0,7.4,1.1.1.121,300852.0,-0.97183558057553,C[C@@H]1OC(O)[C@@H](O)[C@H](O)[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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,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+],-0.958607314841775,C[C@@H]1OC(O)[C@@H](O)[C@H](O)[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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MGLFAGKGVLVTGGARGIGRAIAQAFAREGALVALCDLRPEGKEVAEAIGGAFFQVDLEDERERVRFVEEAAYALGRVDVLVNNAAIAAPGSALTVRLPEWRRVLEVNLTAPMHLSALAAREMRKVGGGAIVNVASVQGLFAEQENAAYNASKGGLVNLTRSLALDLAPLRIRVNAVAPGAIATEAVLEAIALSPDPERTRRDWEDLHALRRLGKPEEVAEAVLFLASEKASFITGAILPVDGGMTASFMMAGRPV,./data/raw/alphafold//AF-Q5SLC4-F1-model_v4.pdb,1373,3679,1476,3442
+1221,14098,14280,MSRGMSGLEDSSDLVVSPYVRMGGLTTDPVPTGGDDPHKVAMLGLTFDDVLLLPAASDVVPATADTSSQLTKKIRLKVPLVSSAMDTVTESRMAIAMARAGGMGVLHRNLPVAEQAGQVEMVKRSEAGMVTDPVTCRPDNTLAQVDALCARFRISGLPVVDDDGALVGIITNRDMRFEVDQSKQVAEVMTKAPLITAQEGVSASAALGLLRRNKIEKLPVVDGRGRLTGLITVKDFVKTEQHPLATKDSDGRLLVGAAVGVGGDAWVRAMMLVDAGVDVLVVDTAHAHNRLVLDMVGKLKSEVGDRVEVVGGNVATRSAAAALVDAGADAVKVGVGPGSICTTRVVAGVGAPQITAILEAVAACRPAGVPVIADGGLQYSGDIAKALAAGASTAMLGSLLAGTAEAPGELIFVNGKQYKSYRGMGSLGAMRGRGGATSYSKDRYFADDALSEDKLVPEGIEGRVPFRGPLSSVIHQLTGGLRAAMGYTGSPTIEVLQQAQFVRITPAGLKESHPHDVAMTVEAPNYYAR,brenda,P9WKI7,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.O.O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O>>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.O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O.[H+],0.53,0.0,22.0,8.0,1.1.1.205,1773.0,-0.2757241303992109,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.O.O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O,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.O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O.[H+],-0.2757241303992109,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.O.O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O__MSRGMSGLEDSSDLVVSPYVRMGGLTTDPVPTGGDDPHKVAMLGLTFDDVLLLPAASDVVPATADTSSQLTKKIRLKVPLVSSAMDTVTESRMAIAMARAGGMGVLHRNLPVAEQAGQVEMVKRSEAGMVTDPVTCRPDNTLAQVDALCARFRISGLPVVDDDGALVGIITNRDMRFEVDQSKQVAEVMTKAPLITAQEGVSASAALGLLRRNKIEKLPVVDGRGRLTGLITVKDFVKTEQHPLATKDSDGRLLVGAAVGVGGDAWVRAMMLVDAGVDVLVVDTAHAHNRLVLDMVGKLKSEVGDRVEVVGGNVATRSAAAALVDAGADAVKVGVGPGSICTTRVVAGVGAPQITAILEAVAACRPAGVPVIADGGLQYSGDIAKALAAGASTAMLGSLLAGTAEAPGELIFVNGKQYKSYRGMGSLGAMRGRGGATSYSKDRYFADDALSEDKLVPEGIEGRVPFRGPLSSVIHQLTGGLRAAMGYTGSPTIEVLQQAQFVRITPAGLKESHPHDVAMTVEAPNYYAR,./data/raw/alphafold//AF-P9WKI7-F1-model_v4.pdb,2335,4689,4727,4562
+1222,342,356,MAAAVAAAPGALGSLHAGGARLVAACSAWLCPGLRLPGSLAGRRAGPAIWAQGWVPAAGGPAPKRGYSSEMKTEDELRVRHLEEENRGIVVLGINRAYGKNSLSKNLIKMLSKAVDALKSDKKVRTIIIRSEVPGIFCAGADLKERAKMSSSEVGPFVSKIRAVINDIANLPVPTIAAIDGLALGGGLELALACDIRVAASSAKMGLVETKLAIIPGGGGTQRLPRAIGMSLAKELIFSARVLDGKEAKAVGLISHVLEQNQEGDAAYRKALDLAREFLPQGPVAMRVAKLAINQGMEVDLVTGLAIEEACYAQTIPTKDRLEGLLAFKEKRPPRYKGE,brenda,Q13825,C/C(=C\C(=O)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.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)=NCCSC(=O)C[C@@](C)(O)CC(=O)O,5.1,6.2316899055554544e-15,37.0,7.25,4.2.1.18,9606.0,0.7075701760979364,C/C(=C\C(=O)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.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)=NCCSC(=O)C[C@@](C)(O)CC(=O)O,0.7075701760979364,C/C(=C\C(=O)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.O__MAAAVAAAPGALGSLHAGGARLVAACSAWLCPGLRLPGSLAGRRAGPAIWAQGWVPAAGGPAPKRGYSSEMKTEDELRVRHLEEENRGIVVLGINRAYGKNSLSKNLIKMLSKAVDALKSDKKVRTIIIRSEVPGIFCAGADLKERAKMSSSEVGPFVSKIRAVINDIANLPVPTIAAIDGLALGGGLELALACDIRVAASSAKMGLVETKLAIIPGGGGTQRLPRAIGMSLAKELIFSARVLDGKEAKAVGLISHVLEQNQEGDAAYRKALDLAREFLPQGPVAMRVAKLAINQGMEVDLVTGLAIEEACYAQTIPTKDRLEGLLAFKEKRPPRYKGE,./data/raw/alphafold//AF-Q13825-F1-model_v4.pdb,1699,573,235,255
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+1225,18508,18771,MAEKRNIFLVGPMGAGKSTIGRQLAQQLNMEFYDSDQEIEKRTGADVGWVFDLEGEEGFRDREEKVINELTEKQGIVLATGGGSVKSRETRNRLSARGVVVYLETTIEKQLARTQRDKKRPLLHVETPPREVLEALANERNPLYEEIADVTIRTDDQSAKVVANQIIHMLESN,brenda,P0A6D7,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)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)C1=C[C@@H](OP(=O)(O)O)[C@@H](O)[C@H](O)C1,55.86,0.0,25.0,7.5,2.7.1.71,562.0,1.7471009313649863,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)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)C1=C[C@@H](OP(=O)(O)O)[C@@H](O)[C@H](O)C1,1.7471009313649863,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)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1__MAEKRNIFLVGPMGAGKSTIGRQLAQQLNMEFYDSDQEIEKRTGADVGWVFDLEGEEGFRDREEKVINELTEKQGIVLATGGGSVKSRETRNRLSARGVVVYLETTIEKQLARTQRDKKRPLLHVETPPREVLEALANERNPLYEEIADVTIRTDDQSAKVVANQIIHMLESN,./data/raw/alphafold//AF-P0A6D7-F1-model_v4.pdb,126,2617,2917,5765
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+1233,6880,6996,MSYKNNHSILSKPNDPVEVIRDALSKALQFYYPLAGRLREGPNKKLMVDCTGEGILFVEANAEVTLDELGDAILPPCPFLDGFLFNVPGSDGILGSPLCLIQVTRLSCGGFIFALRLNHTICDALGLVQFLNAVGEIAQGKYAPSITPVWERELLSARDPPRISCTHEEFDDSIDHSYPNYGATVQQCYCFGPKEIKSLREHLPPHLSTCSSTFELITACVWKCRTISLDMDPEQIVRLSCVVTALGKHNNVCLPLGYYGNTFTYPAVVSTAERLCNSPLGYAVELVKKSKAKMSEEYLRSAIDFVEVRGRPPFALEGMSDFLVSDNTRTGLGEIDFGFGKPVYAGVAKSTDLISFYVRSTNKEEREILVPVCLPILSMEIFQQELKKMIG,brenda,G1EFQ3,CCCCCC(=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.CO>>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.CCCCCC(=O)OC,18.5,0.0,30.0,7.5,2.3.1.84,3747.0,1.2671717284030135,CCCCCC(=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.CO,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.CCCCCC(=O)OC,1.2671717284030135,CCCCCC(=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.CO__MSYKNNHSILSKPNDPVEVIRDALSKALQFYYPLAGRLREGPNKKLMVDCTGEGILFVEANAEVTLDELGDAILPPCPFLDGFLFNVPGSDGILGSPLCLIQVTRLSCGGFIFALRLNHTICDALGLVQFLNAVGEIAQGKYAPSITPVWERELLSARDPPRISCTHEEFDDSIDHSYPNYGATVQQCYCFGPKEIKSLREHLPPHLSTCSSTFELITACVWKCRTISLDMDPEQIVRLSCVVTALGKHNNVCLPLGYYGNTFTYPAVVSTAERLCNSPLGYAVELVKKSKAKMSEEYLRSAIDFVEVRGRPPFALEGMSDFLVSDNTRTGLGEIDFGFGKPVYAGVAKSTDLISFYVRSTNKEEREILVPVCLPILSMEIFQQELKKMIG,./data/raw/alphafold//AF-G1EFQ3-F1-model_v4.pdb,1218,3025,557,637
+1234,17830,18075,MGKMELAKRVQGMQDSVWVEFIQLAQETKPVNLGQGFPDFPPPEFVVKALQEAASGNALHQYTRGYGHLRLVNALAKMYSRLTGRQIDPQKEVLVTVGAYEALYCTMLGLVNPGEEVIIIEPFFDCYEPMTLMAGGVPVFIPLRPRKQGQISSADWVLDPEELASKFTSKTKLIIVNTPHNPLGKVFSRQELEMIAELCKKHDVICIMDEVYEWIIYEGSKHIRMNTLPGMWERTITIGSAGKTFSITGWKVGWAYGPSHLLKGLQMIHQNCVYTLGTLLQEAIAVGLEKEMDRTGDPTGYWNDLSSSLQKKRDTICGFLNSVGMTPTVPEGGYFLICDFSKLASKIKLEGNEPKDYLFAKWLSRTKKLQGIPPSAFYGAEHKPLAQDLIRFCFIKDDATLKKAADILAELKNMS,brenda,B1B6U5,Nc1ccccc1C(=O)C[C@H](N)C(=O)O.O=C(O)C(=O)Cc1ccccc1>>N[C@@H](Cc1ccccc1)C(=O)O.O.O=C(O)c1cc(=O)c2ccccc2[nH]1,55.5,0.0,37.0,7.5,2.6.1.7,44386.0,1.7442929831226763,Nc1ccccc1C(=O)C[C@H](N)C(=O)O.O=C(O)C(=O)Cc1ccccc1,N[C@@H](Cc1ccccc1)C(=O)O.O.O=C(O)c1cc(=O)c2ccccc2[nH]1,1.7442929831226763,Nc1ccccc1C(=O)C[C@H](N)C(=O)O.O=C(O)C(=O)Cc1ccccc1__MGKMELAKRVQGMQDSVWVEFIQLAQETKPVNLGQGFPDFPPPEFVVKALQEAASGNALHQYTRGYGHLRLVNALAKMYSRLTGRQIDPQKEVLVTVGAYEALYCTMLGLVNPGEEVIIIEPFFDCYEPMTLMAGGVPVFIPLRPRKQGQISSADWVLDPEELASKFTSKTKLIIVNTPHNPLGKVFSRQELEMIAELCKKHDVICIMDEVYEWIIYEGSKHIRMNTLPGMWERTITIGSAGKTFSITGWKVGWAYGPSHLLKGLQMIHQNCVYTLGTLLQEAIAVGLEKEMDRTGDPTGYWNDLSSSLQKKRDTICGFLNSVGMTPTVPEGGYFLICDFSKLASKIKLEGNEPKDYLFAKWLSRTKKLQGIPPSAFYGAEHKPLAQDLIRFCFIKDDATLKKAADILAELKNMS,./data/raw/alphafold//AF-B1B6U5-F1-model_v4.pdb,1303,3858,6174,826
+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
+1237,1562,1590,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(CO)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,11.4,42.16404732959642,37.0,,6.3.2.8,562.0,1.0569048513364727,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(CO)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,1.0569048513364727,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(CO)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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+1254,15577,15801,MDPFVVLVLCLSCLLLLSIWRQSSGRGKLPPGPTPLPVIGNILQIDIKDVSKSLTNLSKIYGPVFTLYFGLERMVVLHGYEVVKEALIDLGEEFSGRGHFPLAERANRGFGIVFSNGKRWKEIRRFSLMTLRNFGMGKRSIEDRVQEEARCLVEELRKTKASPCDPTFILGCAPCNVICSIIFQKRFDYKDQQFLNLMEKLNENIRIVSTPWIQICNNFPTIIDYFPGTHNKLLKNLAFMESDILEKVKEHQESMDINNPRDFIDCFLIKMEKEKQNQQSEFTIENLVITAADLLGAGTETTSTTLRYALLLLLKHPEVTAKVQEEIERVIGRNRSPCMQDRGHMPYTDAVVHEVQRYIDLIPTSLPHAVTCDVKFRNYLIPKGTTILTSLTSVLHDNKEFPNPEMFDPRHFLDEGGNFKKSNYFMPFSAGKRICVGEGLARMELFLFLTFILQNFNLKSLIDPKDLDTTPVVNGFASVPPFYQLCFIPV,sabio,P33261,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,960.0,0.972901408633524,28.0,7.4,1.14.13.-,9606.0,2.9822712330395684,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,2.9822712330395684,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__MDPFVVLVLCLSCLLLLSIWRQSSGRGKLPPGPTPLPVIGNILQIDIKDVSKSLTNLSKIYGPVFTLYFGLERMVVLHGYEVVKEALIDLGEEFSGRGHFPLAERANRGFGIVFSNGKRWKEIRRFSLMTLRNFGMGKRSIEDRVQEEARCLVEELRKTKASPCDPTFILGCAPCNVICSIIFQKRFDYKDQQFLNLMEKLNENIRIVSTPWIQICNNFPTIIDYFPGTHNKLLKNLAFMESDILEKVKEHQESMDINNPRDFIDCFLIKMEKEKQNQQSEFTIENLVITAADLLGAGTETTSTTLRYALLLLLKHPEVTAKVQEEIERVIGRNRSPCMQDRGHMPYTDAVVHEVQRYIDLIPTSLPHAVTCDVKFRNYLIPKGTTILTSLTSVLHDNKEFPNPEMFDPRHFLDEGGNFKKSNYFMPFSAGKRICVGEGLARMELFLFLTFILQNFNLKSLIDPKDLDTTPVVNGFASVPPFYQLCFIPV,./data/raw/alphafold//AF-P33261-F1-model_v4.pdb,1176,3892,2131,2021
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+1261,9908,10058,MIINNVKLVLENEVVSGSLEVQNGEIRAFAESQSRLPEAMDGEGGWLLPGLIELHTDNLDKFFTPRPKVDWPAHSAMSSHDALMVASGITTVLDAVAIGDVRDGGDRLENLEKMINAIEETQKRGVNRAEHRLHLRCELPHHTTLPLFEKLVQREPVTLVSLMDHSPGQRQFANREKYREYYQGKYSLTDAQMQQYEEEQLALAARWSQPNRESIAALCRARKIALASHDDATHAHVAESHQLGSVIAEFPTTFEAAEASRKHGMNVLMGAPNIVRGGSHSGNVAASELAQLGLLDILSSDYYPASLLDAAFRVADDQSNRFTLPQAVKLVTKNPAQALNLQDRGVIGEGKRADLVLAHRKDNHIHIDHVWRQGKRVF,sabio,P16689,CP(=O)(O)O[C@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O>>CP(=O)(O)O[C@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,6.4,5.841009441315775e-15,30.0,8.5,3.6.1.63,562.0,0.8061799739838872,CP(=O)(O)O[C@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O,CP(=O)(O)O[C@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.8061799739838872,CP(=O)(O)O[C@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O__MIINNVKLVLENEVVSGSLEVQNGEIRAFAESQSRLPEAMDGEGGWLLPGLIELHTDNLDKFFTPRPKVDWPAHSAMSSHDALMVASGITTVLDAVAIGDVRDGGDRLENLEKMINAIEETQKRGVNRAEHRLHLRCELPHHTTLPLFEKLVQREPVTLVSLMDHSPGQRQFANREKYREYYQGKYSLTDAQMQQYEEEQLALAARWSQPNRESIAALCRARKIALASHDDATHAHVAESHQLGSVIAEFPTTFEAAEASRKHGMNVLMGAPNIVRGGSHSGNVAASELAQLGLLDILSSDYYPASLLDAAFRVADDQSNRFTLPQAVKLVTKNPAQALNLQDRGVIGEGKRADLVLAHRKDNHIHIDHVWRQGKRVF,./data/raw/alphafold//AF-P16689-F1-model_v4.pdb,1019,561,222,240
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+1273,15857,16084,MKCSLGLEKCPDDTLRCFPKIEQPFGIVIFGASGDLTKRKLIPALNRLFEAGILPERFFVLGAARTKMDDKKFRSRFDANPDFLEHCSYISVDYQDPESFKQLKNTIETLIKRIDSSNLVFYLAVPPDLYIPILENLSKTGLNEKPARVVIEKPFGKDLESARRLEDTLQKYFQEDQIFRIDHYLGKETVQNILVFRFANFIFEEIWNNKFVDHVQITMAEDIGVEHRAGYFENVGLLRDIFQNHMLQILALIAMEPPSSFNGENFRNERVKLLRSIRPFPVEELESWIVRGQYGRGVVNGKEVPAYREEPGVAKDSNVETFVAMKLFIDNWRWSGVPFYLRSGKRLPKKITEVAVVFKKIPHSIFAGVPSDELEPNTIVFTLQPNEGISLEFQVKRPCPGMFPQLLSMDFRYEDYFGVKLPDAYERLLLDVILGDPTLFMRRDDLEVSWELLDPVLKAWENDPVRFSPYVYPAGTWGPREADLLIERDGRKWRKL,sabio,Q9X0N9,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=P(O)(O)OCC1OC(O)CC(O)C1O>>C1[C@H]([C@@H]([C@H](OC1=O)COP(=O)([O-])[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.[H],18000.0,0.1020196448542304,80.0,7.4,1.1.1.49,2336.0,4.2552725051033065,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=P(O)(O)OCC1OC(O)CC(O)C1O,C1[C@H]([C@@H]([C@H](OC1=O)COP(=O)([O-])[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.[H],4.2552725051033065,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=P(O)(O)OCC1OC(O)CC(O)C1O__MKCSLGLEKCPDDTLRCFPKIEQPFGIVIFGASGDLTKRKLIPALNRLFEAGILPERFFVLGAARTKMDDKKFRSRFDANPDFLEHCSYISVDYQDPESFKQLKNTIETLIKRIDSSNLVFYLAVPPDLYIPILENLSKTGLNEKPARVVIEKPFGKDLESARRLEDTLQKYFQEDQIFRIDHYLGKETVQNILVFRFANFIFEEIWNNKFVDHVQITMAEDIGVEHRAGYFENVGLLRDIFQNHMLQILALIAMEPPSSFNGENFRNERVKLLRSIRPFPVEELESWIVRGQYGRGVVNGKEVPAYREEPGVAKDSNVETFVAMKLFIDNWRWSGVPFYLRSGKRLPKKITEVAVVFKKIPHSIFAGVPSDELEPNTIVFTLQPNEGISLEFQVKRPCPGMFPQLLSMDFRYEDYFGVKLPDAYERLLLDVILGDPTLFMRRDDLEVSWELLDPVLKAWENDPVRFSPYVYPAGTWGPREADLLIERDGRKWRKL,./data/raw/alphafold//AF-Q9X0N9-F1-model_v4.pdb,2595,5065,2176,5048
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+1275,11777,11935,MWATLPLLCAGAWLLGVPVCGAAELCVNSLEKFHFKSWMSKHRKTYSTEEYHHRLQTFASNWRKINAHNNGNHTFKMALNQFSDMSFAEIKHKYLWSEPQNCSATKSNYLRGTGPYPPSVDWRKKGNFVSPVKNQGACGSCWTFSTTGALESAIAIATGKMLSLAEQQLVDCAQDFNNHGCQGGLPSQAFEYILYNKGIMGEDTYPYQGKDGYCKFQPGKAIGFVKDVANITIYDEEAMVEAVALYNPVSFAFEVTQDFMMYRTGIYSSTSCHKTPDKVNHAVLAVGYGEKNGIPYWIVKNSWGPQWGMNGYFLIERGKNMCGLAACASYPIPLV,uniprot_search,P09668,Cc1cc(=O)oc2cc(N=C(O)[C@@H](N)CCCNC(=N)N)ccc12.O>>Cc1cc(=O)oc2cc(N)ccc12.N=C(N)NCCC[C@H](N)C(=O)O,2.53,8.123018148624577e-15,40.0,5.95,3.4.22.16,9606.0,0.4031205211758178,Cc1cc(=O)oc2cc(N=C(O)[C@@H](N)CCCNC(=N)N)ccc12.O,Cc1cc(=O)oc2cc(N)ccc12.N=C(N)NCCC[C@H](N)C(=O)O,0.4031205211758178,Cc1cc(=O)oc2cc(N=C(O)[C@@H](N)CCCNC(=N)N)ccc12.O__MWATLPLLCAGAWLLGVPVCGAAELCVNSLEKFHFKSWMSKHRKTYSTEEYHHRLQTFASNWRKINAHNNGNHTFKMALNQFSDMSFAEIKHKYLWSEPQNCSATKSNYLRGTGPYPPSVDWRKKGNFVSPVKNQGACGSCWTFSTTGALESAIAIATGKMLSLAEQQLVDCAQDFNNHGCQGGLPSQAFEYILYNKGIMGEDTYPYQGKDGYCKFQPGKAIGFVKDVANITIYDEEAMVEAVALYNPVSFAFEVTQDFMMYRTGIYSSTSCHKTPDKVNHAVLAVGYGEKNGIPYWIVKNSWGPQWGMNGYFLIERGKNMCGLAACASYPIPLV,./data/raw/alphafold//AF-P09668-F1-model_v4.pdb,1924,4067,1564,3753
+1276,21592,21917,MGFKVKLEKRRNAINTCLCIGLDPDEKDIENFMKNEKENNYNNIKKNLKEKYINNVSIKKDILLKAPDNIIREEKSEEFFYFFNHFCFYIINETNKYALTFKMNFAFYIPYGSVGIDVLKNVFDYLYELNIPTILDMKINDIGNTVKNYRKFIFEYLKSDSCTVNIYMGTNMLKDICYDEEKNKYYSAFVLVKTTNPDSAIFQKNLSLDNKQAYVIMAQEALNMSSYLNLEQNNEFIGFVVGANSYDEMNYIRTYFPNCYILSPGIGAQNGDLHKTLTNGYHKSYEKILINIGRAITKNPYPQKAAQMYYDQINAILKQNMES,brenda,Q8T6J6,O=C(O)c1cc(O)nc(O)n1.O=P(O)(O)OC[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1O>>O=C(O)c1cc(O)nc(=O)n1[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,6.0,0.0,25.0,8.0,2.4.2.10,5833.0,0.7781512503836436,O=C(O)c1cc(O)nc(O)n1.O=P(O)(O)OC[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1O,O=C(O)c1cc(O)nc(=O)n1[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,1.0334237554869496,O=C(O)c1cc(O)nc(O)n1.O=P(O)(O)OC[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1O__MGFKVKLEKRRNAINTCLCIGLDPDEKDIENFMKNEKENNYNNIKKNLKEKYINNVSIKKDILLKAPDNIIREEKSEEFFYFFNHFCFYIINETNKYALTFKMNFAFYIPYGSVGIDVLKNVFDYLYELNIPTILDMKINDIGNTVKNYRKFIFEYLKSDSCTVNIYMGTNMLKDICYDEEKNKYYSAFVLVKTTNPDSAIFQKNLSLDNKQAYVIMAQEALNMSSYLNLEQNNEFIGFVVGANSYDEMNYIRTYFPNCYILSPGIGAQNGDLHKTLTNGYHKSYEKILINIGRAITKNPYPQKAAQMYYDQINAILKQNMES,./data/raw/alphafold//AF-Q8T6J6-F1-model_v4.pdb,690,79,5791,6697
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+1278,19063,19348,MAGEGAVERGSLAAEECSHVRVLRCVTRPHRPQKVTITTDASHVPVSSDLILERCDLQLEVNGRDHRTADLCRERLVLRRGQPFWLTLHFEGRGYEAGVDTLTFNAVTGPDPSEEAGTMARFSLSSAVEGGTWSASAVDQQDSTVSLLLSTPADAPIGLYRLSLEASTGYQGSSFVLGHFILLYNPWCPADAVYMDSDQERQEYVLTQQGFIYQGSAKFINGIPWNFGQFEDGILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLGIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHCWVESWMTRPDLEPGYEGWQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAGLTKDQKSVEVPDPVEAGEQAKVRVDLLPTEVGLHKLVVNFECDKLKAVKGYRNVIIGPA,brenda,H0VXN6,O.O=C(CCCN=C(O)[C@H](Cc1ccccc1)N=C(O)OCc1ccccc1)Oc1ccc2ccc(=O)oc2c1>>O=C(O)CCCN=C(O)[C@H](Cc1ccccc1)N=C(O)OCc1ccccc1.O=c1ccc2ccc(O)cc2o1,0.3,1.039040624352156e-14,30.0,8.0,2.3.2.13,10141.0,-0.5228787452803376,O.O=C(CCCN=C(O)[C@H](Cc1ccccc1)N=C(O)OCc1ccccc1)Oc1ccc2ccc(=O)oc2c1,O=C(O)CCCN=C(O)[C@H](Cc1ccccc1)N=C(O)OCc1ccccc1.O=c1ccc2ccc(O)cc2o1,-0.5228787452803376,O.O=C(CCCN=C(O)[C@H](Cc1ccccc1)N=C(O)OCc1ccccc1)Oc1ccc2ccc(=O)oc2c1__MAGEGAVERGSLAAEECSHVRVLRCVTRPHRPQKVTITTDASHVPVSSDLILERCDLQLEVNGRDHRTADLCRERLVLRRGQPFWLTLHFEGRGYEAGVDTLTFNAVTGPDPSEEAGTMARFSLSSAVEGGTWSASAVDQQDSTVSLLLSTPADAPIGLYRLSLEASTGYQGSSFVLGHFILLYNPWCPADAVYMDSDQERQEYVLTQQGFIYQGSAKFINGIPWNFGQFEDGILDICLMLLDTNPKFLKNAGQDCSRRSRPVYVGRVVSAMVNCNDDQGVLQGRWDNNYSDGVSPMSWIGSVDILRRWKDYGCQRVKYGQCWVFAAVACTVLRCLGIPTRVVTNFNSAHDQNSNLLIEYFRNESGEIEGNKSEMIWNFHCWVESWMTRPDLEPGYEGWQALDPTPQEKSEGTYCCGPVPVRAIKEGHLNVKYDAPFVFAEVNADVVNWIRQKDGSLRKSINHLVVGLKISTKSVGRDEREDITHTYKYPEGSEEEREAFVRANHLNKLATKEEAQEETGVAMRIRVGQNMTMGSDFDIFAYITNGTAESHECQLLLCARIVSYNGVLGPVCSTNDLLNLTLDPFSENSIPLHILYEKYGDYLTESNLIKVRGLLIEPAANSYVLAERDIYLENPEIKIRVLGEPKQNRKLIAEVSLKNPLPVPLLGCIFTVEGAGLTKDQKSVEVPDPVEAGEQAKVRVDLLPTEVGLHKLVVNFECDKLKAVKGYRNVIIGPA,./data/raw/alphafold//AF-H0VXN6-F1-model_v4.pdb,1941,4089,1945,3781
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+1294,15180,15392,MFRCGGLAAGALKQKLVPLVRTVCVRSPRQRNRLPGNLFQRWHVPLELQMTRQMASSGASGGKIDNSVLVLIVGLSTVGAGAYAYKTMKEDEKRYNERISGLGLTPEQKQKKAALSASEGEEVPQDKAPSHVPFLLIGGGTAAFAAARSIRARDPGARVLIVSEDPELPYMRPPLSKELWFSDDPNVTKTLRFKQWNGKERSIYFQPPSFYVSAQDLPHIENGGVAVLTGKKVVQLDVRDNMVKLNDGSQITYEKCLIATGGTPRSLSAIDRAGAEVKSRTTLFRKIGDFRSLEKISREVKSITIIGGGFLGSELACALGRKARALGTEVIQLFPEKGNMGKILPEYLSNWTMEKVRREGVKVMPNAIVQSVGVSSGKLLIKLKDGRKVETDHIVAAVGLEPNVELAKTGGLEIDSDFGGFRVNAELQARSNIWVAGDAACFYDIKLGRRRVEHHDHAVVSGRLAGENMTGAAKPYWHQSMFWSDLGPDVGYEAIGLVDSSLPTVGVFAKATAQDNPKSATEQSGTGIRSESETESEASEITIPPSTPAVPQAPVQGEDYGKGVIFYLRDKVVVGIVLWNIFNRMPIARKIIKDGEQHEDLNEVAKLFNIHED,sabio,O95831,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H].[H]>>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)c1,3240.0,0.2268737339635465,25.0,7.4,1.1.1.-,9606.0,3.510545010206612,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H].[H],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)c1,3.510545010206612,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H].[H]__MFRCGGLAAGALKQKLVPLVRTVCVRSPRQRNRLPGNLFQRWHVPLELQMTRQMASSGASGGKIDNSVLVLIVGLSTVGAGAYAYKTMKEDEKRYNERISGLGLTPEQKQKKAALSASEGEEVPQDKAPSHVPFLLIGGGTAAFAAARSIRARDPGARVLIVSEDPELPYMRPPLSKELWFSDDPNVTKTLRFKQWNGKERSIYFQPPSFYVSAQDLPHIENGGVAVLTGKKVVQLDVRDNMVKLNDGSQITYEKCLIATGGTPRSLSAIDRAGAEVKSRTTLFRKIGDFRSLEKISREVKSITIIGGGFLGSELACALGRKARALGTEVIQLFPEKGNMGKILPEYLSNWTMEKVRREGVKVMPNAIVQSVGVSSGKLLIKLKDGRKVETDHIVAAVGLEPNVELAKTGGLEIDSDFGGFRVNAELQARSNIWVAGDAACFYDIKLGRRRVEHHDHAVVSGRLAGENMTGAAKPYWHQSMFWSDLGPDVGYEAIGLVDSSLPTVGVFAKATAQDNPKSATEQSGTGIRSESETESEASEITIPPSTPAVPQAPVQGEDYGKGVIFYLRDKVVVGIVLWNIFNRMPIARKIIKDGEQHEDLNEVAKLFNIHED,./data/raw/alphafold//AF-O95831-F1-model_v4.pdb,3537,3477,1229,4091
+1295,10857,11012,MWTALPLLCAGAWLLSAGATAELTVNAIEKFHFTSWMKQHQKTYSSREYSHRLQVFANNWRKIQAHNQRNHTFKMGLNQFSDMSFAEIKHKYLWSEPQNCSATKSNYLRGTGPYPSSMDWRKKGNVVSPVKNQGACGSCWTFSTTGALESAVAIASGKMMTLAEQQLVDCAQNFNNHGCQGGLPSQAFEYILYNKGIMGEDSYPYIGKNGQCKFNPEKAVAFVKNVVNITLNDEAAMVEAVALYNPVSFAFEVTEDFMMYKSGVYSSNSCHKTPDKVNHAVLAVGYGEQNGLLYWIVKNSWGSNWGNNGYFLIERGKNMCGLAACASYPIPQV,uniprot_search,P00786,C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>C[C@H](N=C(O)[C@H](C)N1C(=O)CCC1=O)C(=O)N1CCC[C@H]1C(=O)O.Nc1ccc([N+](=O)[O-])cc1,0.004,1.8496595866578256,37.0,7.75,3.4.22.16,10116.0,-2.397940008672037,C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1.O,C[C@H](N=C(O)[C@H](C)N1C(=O)CCC1=O)C(=O)N1CCC[C@H]1C(=O)O.Nc1ccc([N+](=O)[O-])cc1,-2.397940008672037,C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MWTALPLLCAGAWLLSAGATAELTVNAIEKFHFTSWMKQHQKTYSSREYSHRLQVFANNWRKIQAHNQRNHTFKMGLNQFSDMSFAEIKHKYLWSEPQNCSATKSNYLRGTGPYPSSMDWRKKGNVVSPVKNQGACGSCWTFSTTGALESAVAIASGKMMTLAEQQLVDCAQNFNNHGCQGGLPSQAFEYILYNKGIMGEDSYPYIGKNGQCKFNPEKAVAFVKNVVNITLNDEAAMVEAVALYNPVSFAFEVTEDFMMYKSGVYSSNSCHKTPDKVNHAVLAVGYGEQNGLLYWIVKNSWGSNWGNNGYFLIERGKNMCGLAACASYPIPQV,./data/raw/alphafold//AF-P00786-F1-model_v4.pdb,1924,4067,1564,3536
+1296,7594,7716,MSQKLLMSRRATFAAGTAGLVAVAAGVPVAGRAQSQPPLQLPISSEFPFAKRTVEVEGATIAYVDEGSGQPVLFLHGNPTSSYLWRNIIPYVVAAGYRAVAPDLIGMGDSAKPDIEYRLQDHVAYMDGFIDALGLDDMVLVIHDWGSVIGMRHARLNPDRVAAVAFMEALVPPALPMPSYEAMGPQLGPLFRDLRTADVGEKMVLDGNFFVETILPEMGVVRSLSEAEMAAYRAPFPTRQSRLPTLQWPREVPIGGEPAFAEAEVLKNGEWLMASPIPKLLFHAEPGALAPKPVVDYLSENVPNLEVRFVGAGTHFLQEDHPHLIGQGIADWLRRNKPHAS,brenda,Q6DND9,CCCCI.O>>CCCCO.[I-],0.21,0.2494666660066973,37.0,8.6,3.8.1.5,158786.0,-0.6777807052660807,CCCCI.O,CCCCO.[I-],-0.6777807052660807,CCCCI.O__MSQKLLMSRRATFAAGTAGLVAVAAGVPVAGRAQSQPPLQLPISSEFPFAKRTVEVEGATIAYVDEGSGQPVLFLHGNPTSSYLWRNIIPYVVAAGYRAVAPDLIGMGDSAKPDIEYRLQDHVAYMDGFIDALGLDDMVLVIHDWGSVIGMRHARLNPDRVAAVAFMEALVPPALPMPSYEAMGPQLGPLFRDLRTADVGEKMVLDGNFFVETILPEMGVVRSLSEAEMAAYRAPFPTRQSRLPTLQWPREVPIGGEPAFAEAEVLKNGEWLMASPIPKLLFHAEPGALAPKPVVDYLSENVPNLEVRFVGAGTHFLQEDHPHLIGQGIADWLRRNKPHAS,./data/raw/alphafold//AF-Q6DND9-F1-model_v4.pdb,2119,536,187,202
+1297,7042,7162,MATGQKLMRAVRVFEFGGPEVLKLRSDIAVPIPKDHQVLIKVHACGVNPVETYIRSGTYSRKPLLPYTPGSDVAGVIEAVGDNASAFKKGDRVFTSSTISGGYAEYALAADHTVYKLPEKLDFKQGAAIGIPYFTAYRALIHSACVKAGESVLVHGASGGVGLAACQIARAYGLKILGTAGTEEGQKIVLQNGAHEVFNHREVNYIDKIKKYVGEKGIDIIIEMLANVNLSKDLSLLSHGGRVIVVGSRGTIEINPRDTMAKESSIIGVTLFSSTKEEFQQYAAALQAGMEIGWLKPVIGSQYPLEKVAEAHENIIHGSGATGKMILLL,brenda,Q08257,CCCCCCC=CC=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+]>>CCCCCCCCC=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)c1,0.113,6.407354133904745e-15,30.0,7.416666666666667,1.3.1.27,9606.0,-0.9469215565165804,CCCCCCC=CC=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+],CCCCCCCCC=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,-0.9469215565165804,CCCCCCC=CC=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+]__MATGQKLMRAVRVFEFGGPEVLKLRSDIAVPIPKDHQVLIKVHACGVNPVETYIRSGTYSRKPLLPYTPGSDVAGVIEAVGDNASAFKKGDRVFTSSTISGGYAEYALAADHTVYKLPEKLDFKQGAAIGIPYFTAYRALIHSACVKAGESVLVHGASGGVGLAACQIARAYGLKILGTAGTEEGQKIVLQNGAHEVFNHREVNYIDKIKKYVGEKGIDIIIEMLANVNLSKDLSLLSHGGRVIVVGSRGTIEINPRDTMAKESSIIGVTLFSSTKEEFQQYAAALQAGMEIGWLKPVIGSQYPLEKVAEAHENIIHGSGATGKMILLL,./data/raw/alphafold//AF-Q08257-F1-model_v4.pdb,3166,1960,3604,297
+1298,18893,19174,MKLRYIINENKLVFTSCNMRDKIITGKKIIFSQSVAKDQTKNLSSFLSERFYSVNQSHNHSIIIGSSLSHQENDIEHDTILDTSGVLVTTDTNGIVNGARVAITDGLGGGNGDQEEDDEIYRVSHSSCENFLNCDQNIDTTLSLITQPKASDKKQTAPKTLQHTEASMAAFIYQNHPGKGYIGEFANIGDGLIIILDKRFKIKHMVSACHIYRGFGTWTPPSLQALATTANKDALLVRQTLKLAEGDIIISMTDGVWGELKTSLIAQTNDRRDIGVDKEYFKTLFDELTDAPYPSSFDIARIITQRAMSRSLERRKTLIKLINEIEQQHFHEKSVKTINEVLEYFIKTGHVETAQTLKAILFEDGLSDGITYFENIEIPLEMVMHDLKSRTVGDCSTINVTRIPYHLDELIRGFINYPEKHQILAPLFKARVKSEADLEEAFHRLSLEMVQPEIECPISETHFERAFKKETLDKTQAVLTHYFRISTGLDSKKNYQERLNDLSAYLSKESSLEKNDIKLLLSMLDSEIKPKTGVFQTLFGENQNKLYKAFHKKIELQLLDSEIENKNELK,sabio,Q5ZXN5,O>>C[N+](C)(C)CCOP(=O)(O)O,14.3,81.7736148094917,25.0,7.5,3.1.3.-,446.0,1.155336037465062,O,C[N+](C)(C)CCOP(=O)(O)O,1.155336037465062,O__MKLRYIINENKLVFTSCNMRDKIITGKKIIFSQSVAKDQTKNLSSFLSERFYSVNQSHNHSIIIGSSLSHQENDIEHDTILDTSGVLVTTDTNGIVNGARVAITDGLGGGNGDQEEDDEIYRVSHSSCENFLNCDQNIDTTLSLITQPKASDKKQTAPKTLQHTEASMAAFIYQNHPGKGYIGEFANIGDGLIIILDKRFKIKHMVSACHIYRGFGTWTPPSLQALATTANKDALLVRQTLKLAEGDIIISMTDGVWGELKTSLIAQTNDRRDIGVDKEYFKTLFDELTDAPYPSSFDIARIITQRAMSRSLERRKTLIKLINEIEQQHFHEKSVKTINEVLEYFIKTGHVETAQTLKAILFEDGLSDGITYFENIEIPLEMVMHDLKSRTVGDCSTINVTRIPYHLDELIRGFINYPEKHQILAPLFKARVKSEADLEEAFHRLSLEMVQPEIECPISETHFERAFKKETLDKTQAVLTHYFRISTGLDSKKNYQERLNDLSAYLSKESSLEKNDIKLLLSMLDSEIKPKTGVFQTLFGENQNKLYKAFHKKIELQLLDSEIENKNELK,./data/raw/alphafold//AF-Q5ZXN5-F1-model_v4.pdb,198,2713,5023,5873
+1299,6419,6530,MATIRPDDNAIDTAARHYGITLDQSARLEWPALIDGALGSYDVVDQLYADEATPPTTSREHTVPTASENPLSAWYVTTSIPPTSDGVLTGRRVAIKDNVTVAGVPMMNGSRTVEGFTPSRDATVVTRLLAAGATVAGKAVCEDLCFSGSSFTPASGPVRNPWDPQREAGGSSGGSAALVANGDVDFAIGGDQGGSIRIPAAFCGVVGHKPTFGLVPYTGAFPIERTIDHLGPITRTVHDAALMLSVIAGRDGNDPRQADSVEAGDYLSTLDSDVDGLRIGIVREGFGHAVSQPEVDDAVRAAAHSLAEIGCTVEEVNIPWHLHAFHIWNVIATDGGAYQMLDGNGYGMNAEGLYDPELMAHFASRRLQHADALSETVKLVALTGHHGITTLGGASYGKARNLVPLARAAYDTALRQFDVLVMPTLPYVASELPANDVDRATFITKALGMIANTAPFDVTGHPSLSVPAGLVNGLPVGMMITGKTFDDATVLRVGRAFEKLRGAFPTPADHISDSAPQLSPA,brenda,B4XEY3,CCCC(=N)O.NO>>CCCC(O)=NO.N,2.04,0.0,55.0,5.9,3.5.1.4,1833.0,0.3096301674258988,CCCC(=N)O.NO,CCCC(O)=NO.N,0.3096301674258988,CCCC(=N)O.NO__MATIRPDDNAIDTAARHYGITLDQSARLEWPALIDGALGSYDVVDQLYADEATPPTTSREHTVPTASENPLSAWYVTTSIPPTSDGVLTGRRVAIKDNVTVAGVPMMNGSRTVEGFTPSRDATVVTRLLAAGATVAGKAVCEDLCFSGSSFTPASGPVRNPWDPQREAGGSSGGSAALVANGDVDFAIGGDQGGSIRIPAAFCGVVGHKPTFGLVPYTGAFPIERTIDHLGPITRTVHDAALMLSVIAGRDGNDPRQADSVEAGDYLSTLDSDVDGLRIGIVREGFGHAVSQPEVDDAVRAAAHSLAEIGCTVEEVNIPWHLHAFHIWNVIATDGGAYQMLDGNGYGMNAEGLYDPELMAHFASRRLQHADALSETVKLVALTGHHGITTLGGASYGKARNLVPLARAAYDTALRQFDVLVMPTLPYVASELPANDVDRATFITKALGMIANTAPFDVTGHPSLSVPAGLVNGLPVGMMITGKTFDDATVLRVGRAFEKLRGAFPTPADHISDSAPQLSPA,./data/raw/alphafold//AF-B4XEY3-F1-model_v4.pdb,1085,796,499,570
+1300,476,493,MKYFPLFPTLVFAARVVAFPAYASLAGLSQQELDAIIPTLEAREPGLPPGPLENSSAKLVNDEAHPWKPLRPGDIRGPCPGLNTLASHGYLPRNGVATPVQIINAVQEGLNFDNQAAVFATYAAHLVDGNLITDLLSIGRKTRLTGPDPPPPASVGGLNEHGTFEGDASMTRGDAFFGNNHDFNETLFEQLVDYSNRFGGGKYNLTVAGELRFKRIQDSIATNPNFSFVDFRFFTAYGETTFPANLFVDGRRDDGQLDMDAARSFFQFSRMPDDFFRAPSPRSGTGVEVVIQAHPMQPGRNVGKINSYTVDPTSSDFSTPCLMYEKFVNITVKSLYPNPTVQLRKALNTNLDFFFQGVAAGCTQVFPYGRD,brenda,B9W4V6,C1CCCCC1.OO>>O.OC1CCCCC1,72.0,5.9872487761645155e-15,22.0,7.0,1.11.2.1,1973307.0,1.8573324964312683,C1CCCCC1.OO,O.OC1CCCCC1,1.8573324964312683,C1CCCCC1.OO__MKYFPLFPTLVFAARVVAFPAYASLAGLSQQELDAIIPTLEAREPGLPPGPLENSSAKLVNDEAHPWKPLRPGDIRGPCPGLNTLASHGYLPRNGVATPVQIINAVQEGLNFDNQAAVFATYAAHLVDGNLITDLLSIGRKTRLTGPDPPPPASVGGLNEHGTFEGDASMTRGDAFFGNNHDFNETLFEQLVDYSNRFGGGKYNLTVAGELRFKRIQDSIATNPNFSFVDFRFFTAYGETTFPANLFVDGRRDDGQLDMDAARSFFQFSRMPDDFFRAPSPRSGTGVEVVIQAHPMQPGRNVGKINSYTVDPTSSDFSTPCLMYEKFVNITVKSLYPNPTVQLRKALNTNLDFFFQGVAAGCTQVFPYGRD,./data/raw/alphafold//AF-B9W4V6-F1-model_v4.pdb,1077,646,323,362
+1301,12299,12468,MAKLYFYYSAMNAGKSTVLLQSSFNYQERGMKTILFTISKDCRFEEGSICSRIGLSEKAHTFTPDLKLLDIINQENNKEKIDCVLVDESQFLTKFQVRELCIVVDKLNIPVLCYGLRTDFKGNLFEGSKYLLAWADKLTEIKTICRCGKKATMTIRLNSNGEPVFSGEQILIGDNSIYTSVCRKHHIINCEEYNF,uniprot_search,Q6S4W6,Cc1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)nc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)c(=O)nc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.28,0.0,25.0,7.8,2.7.1.21,5807.0,-0.5528419686577808,Cc1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)nc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)c(=O)nc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-0.5528419686577808,Cc1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)nc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MAKLYFYYSAMNAGKSTVLLQSSFNYQERGMKTILFTISKDCRFEEGSICSRIGLSEKAHTFTPDLKLLDIINQENNKEKIDCVLVDESQFLTKFQVRELCIVVDKLNIPVLCYGLRTDFKGNLFEGSKYLLAWADKLTEIKTICRCGKKATMTIRLNSNGEPVFSGEQILIGDNSIYTSVCRKHHIINCEEYNF,./data/raw/alphafold//AF-Q6S4W6-F1-model_v4.pdb,2042,4205,4076,3924
+1302,19641,19927,MRVVVIGAGVIGLSTALCIHERYHSVLQPLDIKVYADRFTPLTTTDVAAGLWQPYLSDPNNPQEADWSQQTFDYLLSHVHSPNAENLGLFLISGYNLFHEAIPDPSWKDTVLGFRKLTPRELDMFPDYGYGWFHTSLILEGKNYLQWLTERLTERGVKFFQRKVESFEEVAREGADVIVNCTGVWAGALQRDPLLQPGRGQIMKVDAPWMKHFILTHDPERGIYNSPYIIPGTQTVTLGGIFQLGNWSELNNIQDHNTIWEGCCRLEPTLKNARIIGERTGFRPVRPQIRLEREQLRTGPSNTEVIHNYGHGGYGLTIHWGCALEAAKLFGRILEEKKLSRMPPSHL,sabio,P14920,O.O=O.O=O>>N.O=C(O)C(=O)c1cnc[nH]1.OO,0.68,39.80682390189456,37.0,8.3,1.4.3.3,9606.0,-0.1674910872937636,O.O=O.O=O,N.O=C(O)C(=O)c1cnc[nH]1.OO,-0.1674910872937636,O.O=O.O=O__MRVVVIGAGVIGLSTALCIHERYHSVLQPLDIKVYADRFTPLTTTDVAAGLWQPYLSDPNNPQEADWSQQTFDYLLSHVHSPNAENLGLFLISGYNLFHEAIPDPSWKDTVLGFRKLTPRELDMFPDYGYGWFHTSLILEGKNYLQWLTERLTERGVKFFQRKVESFEEVAREGADVIVNCTGVWAGALQRDPLLQPGRGQIMKVDAPWMKHFILTHDPERGIYNSPYIIPGTQTVTLGGIFQLGNWSELNNIQDHNTIWEGCCRLEPTLKNARIIGERTGFRPVRPQIRLEREQLRTGPSNTEVIHNYGHGGYGLTIHWGCALEAAKLFGRILEEKKLSRMPPSHL,./data/raw/alphafold//AF-P14920-F1-model_v4.pdb,2817,3638,1430,2086
+1303,20608,20915,MRIYKLSPIFSAAVLLSAGVASAETKFFYNQVGYDVDQPISVIVQSENLADGAEFSVMSGGTAVKTGKLSTGSNPDNWLNSGKFYVADLTGLKAGKYTLQVSENGQPQKSGEFTVGENALAANTLASVLNYFYDDRADDPTVEGWDKQMPVYKSDKKLDVHGGWYDASGDVSKYLSHLSYANYLNPQQIPLTVWSLAFASERIPKLLGSTSTKAKTADEAAYGADFLVRMLDEQGFFYMTVFDNWGSPMGKREICAFSGSDGIKSTDYQTAFREGGGMAIAALASAARLKLKGDFTSEQYLAAAEKAYKHLSEKQSVGGDCAYCDDHKENIIDDYTALLAATELYAATKKQEYLEDAYDRAEHLSSRVSKDGYFWSDDAKTRPFWHASDAGLPLVALARYSEVVGAIDEDAGIKVHGRPFPYWGCVTMIGGGCVNESIDNVRNAIRSHFDWLVKITNKVDNPFGYARQTYKTQDKIKDGFFIPHDNESNYWWQGEDARLASLSAAIMYANRIIDGEYRNVTTSDVQKYATDQLDWILGKNPYATCMMYGKGTKNPQKYDGQSKYDATLEGGIANGISGKNQDGSGIAWTDDGVAAVGFDSEKESWQVWRWDEQWLPHSTWYLMALVERYDELTKPVEFSVGLSKSTVAAKASVSLVGKMLSLNLPRSVVGKSVKVLDVRGNVLMQKTVQGVSETMDVSTLNRGLYLVQIQGFAAKKFVVK,brenda,B0FWI3,O.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>>OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.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,6.21,2.1739398707267392e-14,,,3.2.1.74,59374.0,0.7930916001765802,O.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,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.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,0.7930916001765802,O.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__MRIYKLSPIFSAAVLLSAGVASAETKFFYNQVGYDVDQPISVIVQSENLADGAEFSVMSGGTAVKTGKLSTGSNPDNWLNSGKFYVADLTGLKAGKYTLQVSENGQPQKSGEFTVGENALAANTLASVLNYFYDDRADDPTVEGWDKQMPVYKSDKKLDVHGGWYDASGDVSKYLSHLSYANYLNPQQIPLTVWSLAFASERIPKLLGSTSTKAKTADEAAYGADFLVRMLDEQGFFYMTVFDNWGSPMGKREICAFSGSDGIKSTDYQTAFREGGGMAIAALASAARLKLKGDFTSEQYLAAAEKAYKHLSEKQSVGGDCAYCDDHKENIIDDYTALLAATELYAATKKQEYLEDAYDRAEHLSSRVSKDGYFWSDDAKTRPFWHASDAGLPLVALARYSEVVGAIDEDAGIKVHGRPFPYWGCVTMIGGGCVNESIDNVRNAIRSHFDWLVKITNKVDNPFGYARQTYKTQDKIKDGFFIPHDNESNYWWQGEDARLASLSAAIMYANRIIDGEYRNVTTSDVQKYATDQLDWILGKNPYATCMMYGKGTKNPQKYDGQSKYDATLEGGIANGISGKNQDGSGIAWTDDGVAAVGFDSEKESWQVWRWDEQWLPHSTWYLMALVERYDELTKPVEFSVGLSKSTVAAKASVSLVGKMLSLNLPRSVVGKSVKVLDVRGNVLMQKTVQGVSETMDVSTLNRGLYLVQIQGFAAKKFVVK,./data/raw/alphafold//AF-B0FWI3-F1-model_v4.pdb,492,3167,5462,6345
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+1306,18803,19080,MDERDALRISREIAGEVRKAIASMPLRERVKDVGMGKDGTPTKAADRVAEDAALEILRKERVTVVTEESGVLGEGDVFVALDPLDGTFNATRGIPVYSVSLCFSYSDKLKDAFFGYVYNLATGDEYYADSSGAYRNGERIEVSDAEELYCNAIIYYPDRKFPFKRMRIFGSAATELCFFADGSFDCFLDIRPGKMLRIYDAAAGVFIAEKAGGKVTELDGESLGNKKFDMQERLNIVAANEKLHPKLLELIK,sabio,O30298,O>>O=P(O)(O)O.OC1C(O)C(O)C(O)C(O)C1O,28.7,87.53890936011979,85.0,8.5,3.1.3.25,2234.0,1.4578818967339924,O,O=P(O)(O)O.OC1C(O)C(O)C(O)C(O)C1O,1.4578818967339924,O__MDERDALRISREIAGEVRKAIASMPLRERVKDVGMGKDGTPTKAADRVAEDAALEILRKERVTVVTEESGVLGEGDVFVALDPLDGTFNATRGIPVYSVSLCFSYSDKLKDAFFGYVYNLATGDEYYADSSGAYRNGERIEVSDAEELYCNAIIYYPDRKFPFKRMRIFGSAATELCFFADGSFDCFLDIRPGKMLRIYDAAAGVFIAEKAGGKVTELDGESLGNKKFDMQERLNIVAANEKLHPKLLELIK,./data/raw/alphafold//AF-O30298-F1-model_v4.pdb,3764,4551,4476,4373
+1307,17135,17365,MAFLADALSRVKPSATIAVSQKARELKAKGRDVIGLGAGEPDFDTPDNIKKAAIDAIDRGETKYTPVSGIPELREAIAKKFKRENNLDYTAAQTIVGTGGKQILFNAFMATLNPGDEVVIPAPYWVSYPEMVALCGGTPVFVPTRQENNFKLKAEDLDRAITPKTKWFVFNSPSNPSGAAYSHEELKALTDVLMKHPHVWVLTDDMYEHLTYGDFRFATPVEVEPGLYERTLTMNGVSKAYAMTGWRIGYAAGPLHLIKAMDMIQGQQTSGAASIAQWAAVEALNGPQDFIGRNKEIFQGRRDLVVSMLNQAKGISCPTPEGAFYVYPSCAGLIGKTAPSGKVIETDEDFVSELLETEGVAVVHGSAFGLGPNFRISYATSEALLEEACRRIQRFCAACR,brenda,Q02635,N[C@@H](CC1(C(=O)O)C=CC(O)C=C1)C(=O)O.O=C(O)CC(=O)C(=O)O>>N[C@@H](CC(=O)O)C(=O)O.O=C(O)C(=O)C[C@]1(C(=O)O)C=C[C@@H](O)C=C1,158.4,7.899593212207225e-15,30.0,8.0,2.6.1.78,382.0,2.1997551772534747,N[C@@H](CC1(C(=O)O)C=CC(O)C=C1)C(=O)O.O=C(O)CC(=O)C(=O)O,N[C@@H](CC(=O)O)C(=O)O.O=C(O)C(=O)C[C@]1(C(=O)O)C=C[C@@H](O)C=C1,2.1997551772534747,N[C@@H](CC1(C(=O)O)C=CC(O)C=C1)C(=O)O.O=C(O)CC(=O)C(=O)O__MAFLADALSRVKPSATIAVSQKARELKAKGRDVIGLGAGEPDFDTPDNIKKAAIDAIDRGETKYTPVSGIPELREAIAKKFKRENNLDYTAAQTIVGTGGKQILFNAFMATLNPGDEVVIPAPYWVSYPEMVALCGGTPVFVPTRQENNFKLKAEDLDRAITPKTKWFVFNSPSNPSGAAYSHEELKALTDVLMKHPHVWVLTDDMYEHLTYGDFRFATPVEVEPGLYERTLTMNGVSKAYAMTGWRIGYAAGPLHLIKAMDMIQGQQTSGAASIAQWAAVEALNGPQDFIGRNKEIFQGRRDLVVSMLNQAKGISCPTPEGAFYVYPSCAGLIGKTAPSGKVIETDEDFVSELLETEGVAVVHGSAFGLGPNFRISYATSEALLEEACRRIQRFCAACR,./data/raw/alphafold//AF-Q02635-F1-model_v4.pdb,1293,3428,1166,3086
+1308,21060,21382,MARIGIHSFVWSASSAQSELERTLANTRDAGFDLIEFSYLDPADVDIGRLAKRIADLGLGVAISIGLPADGDISSADKAVAARGVEILNQTIALTRDLGGRKVAGILSAGHGLQVEAPTRDQWNRSAAALAKVAETAKAAGVTLNLEIVNRFESNLLNTAAQGLAFIEDTGSDNIFLHLDTFHMNIEEADVGLAIRHAAGKIGYVHIGESHRGFLGTGNIDFAAIFDALTAIGYADDLSFESFSSEIVDENLSKKTAIWRNLWTDNMALAKHARAFIGLGLETARRKAELVSARHKP,brenda,N0DP12,O=C(CO)[C@H](O)[C@H](O)[C@H](O)CO>>OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,0.0057,7.866251170845146e-15,60.0,8.0,5.1.3.31,381.0,-2.2441251443275085,O=C(CO)[C@H](O)[C@H](O)[C@H](O)CO,OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,-2.2441251443275085,O=C(CO)[C@H](O)[C@H](O)[C@H](O)CO__MARIGIHSFVWSASSAQSELERTLANTRDAGFDLIEFSYLDPADVDIGRLAKRIADLGLGVAISIGLPADGDISSADKAVAARGVEILNQTIALTRDLGGRKVAGILSAGHGLQVEAPTRDQWNRSAAALAKVAETAKAAGVTLNLEIVNRFESNLLNTAAQGLAFIEDTGSDNIFLHLDTFHMNIEEADVGLAIRHAAGKIGYVHIGESHRGFLGTGNIDFAAIFDALTAIGYADDLSFESFSSEIVDENLSKKTAIWRNLWTDNMALAKHARAFIGLGLETARRKAELVSARHKP,./data/raw/alphafold//AF-N0DP12-F1-model_v4.pdb,574,3295,5605,6491
+1309,11525,11682,MDYGMYFFEHVTPYETLVRRMERVIASGKTPFQDYFLFESKGFGKVLILDKDVQSTERDEYIYHETLVHPAMLTHPEPKRVLIVGGGEGATLREVLKHPTVEKAVMVDIDGELVEVAKRHMPEWHQGAFDDPRAVLVIDDARAYLERTEERYDVVIIDLTDPVGEDNPARLLYTVEFYRLVKAHLNPGGVMGMQAGMILLTHHRVHPVVHRTVREAFRYVRSYKNHIPGFFLNFGFLLASDAFDPAAFSEGVIEARIRERNLALRHLTAPYLEAMFVLPKDLLEALEKETMVSTDQNPFYVTPEGEARQAPYKG,sabio,Q5SK28,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCNCCCN>>CSCC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCNCCCCNCCCN,0.73,0.1006610876989849,37.0,9.0,2.5.1.79,274.0,-0.1366771398795441,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCNCCCN,CSCC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCNCCCCNCCCN,-0.1366771398795441,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCNCCCN__MDYGMYFFEHVTPYETLVRRMERVIASGKTPFQDYFLFESKGFGKVLILDKDVQSTERDEYIYHETLVHPAMLTHPEPKRVLIVGGGEGATLREVLKHPTVEKAVMVDIDGELVEVAKRHMPEWHQGAFDDPRAVLVIDDARAYLERTEERYDVVIIDLTDPVGEDNPARLLYTVEFYRLVKAHLNPGGVMGMQAGMILLTHHRVHPVVHRTVREAFRYVRSYKNHIPGFFLNFGFLLASDAFDPAAFSEGVIEARIRERNLALRHLTAPYLEAMFVLPKDLLEALEKETMVSTDQNPFYVTPEGEARQAPYKG,./data/raw/alphafold//AF-Q5SK28-F1-model_v4.pdb,1017,558,219,237
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+1311,15823,16050,ARAAARHYADQRIKVAKPVVEMDGDEMTRIIWQFIKEKLILPHVDVQLKYFDLGLPNRDQTNDQVTIDSALATQKYSVAVKCATITPDEARVEEFKLKKMWKSPNGTIRNILGGTVFREPIICKNIPRLVPGWTKPITIGRHAHGDQYKATDFVVDRAGTFKIVFTPKDGSSAKQWEVYNFPAGGVGMGMYNTDESISGFAHSCFQYAIQKKWPLYMSTKNTILKAYDGRFKDIFQEIFEKHYKTDFDKYKIWYEHRLIDDMVAQVLKSSGGFVWACKNYDGDVQSDILAQGFGSLGLMTSVLVCPDGKTIEAEAAHGTVTRHYREHQKGRPTSTNPIASIFAWTRGLEHRGKLDGNQDLIRFAQTLEKVCVETVESGAMTKDLAGCIHGLSNVKLNEHFLNTSDFLDTIKSNLDRALGRQ,sabio,P33198,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=C(O)CC(C(=O)O)C(O)C(=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.O=C(O)CCC(=O)C(=O)O.O=C=O.[H],30.7,0.0,25.0,7.4,1.1.1.42,9823.0,1.4871383754771863,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=C(O)CC(C(=O)O)C(O)C(=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.O=C(O)CCC(=O)C(=O)O.O=C=O.[H],1.4871383754771863,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=C(O)CC(C(=O)O)C(O)C(=O)O__ARAAARHYADQRIKVAKPVVEMDGDEMTRIIWQFIKEKLILPHVDVQLKYFDLGLPNRDQTNDQVTIDSALATQKYSVAVKCATITPDEARVEEFKLKKMWKSPNGTIRNILGGTVFREPIICKNIPRLVPGWTKPITIGRHAHGDQYKATDFVVDRAGTFKIVFTPKDGSSAKQWEVYNFPAGGVGMGMYNTDESISGFAHSCFQYAIQKKWPLYMSTKNTILKAYDGRFKDIFQEIFEKHYKTDFDKYKIWYEHRLIDDMVAQVLKSSGGFVWACKNYDGDVQSDILAQGFGSLGLMTSVLVCPDGKTIEAEAAHGTVTRHYREHQKGRPTSTNPIASIFAWTRGLEHRGKLDGNQDLIRFAQTLEKVCVETVESGAMTKDLAGCIHGLSNVKLNEHFLNTSDFLDTIKSNLDRALGRQ,./data/raw/alphafold//AF-P33198-F1-model_v4.pdb,2384,4766,2165,5037
+1312,15989,16216,MSLVEKTSIIKDFTLFEKMSEHEQVVFCNDPATGLRAIIAIHDTTLGPALGGCRMQPYNSVEEALEDALRLSKGMTYKCAASDVDFGGGKAVIIGDPQKDKSPELFRAFGQFVDSLGGRFYTGTDMGTNMEDFIHAMKETNCIVGVPEAYGGGGDSSIPTAMGVLYGIKATNKMLFGKDDLGGVTYAIQGLGKVGYKVAEGLLEEGAHLFVTDINEQTLEAIQEKAKTTSGSVTVVASDEIYSQEADVFVPCAFGGVVNDETMKQFKVKAIAGSANNQLLTEDHGRHLADKGILYAPDYIVNSGGLIQVADELYEVNKERVLAKTKHIYDAILEVYQQAELDQITTMEAANRMCEQRMAARGRRNSFFTSSVKPKWDIRN,sabio,Q59224,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.NC(Cc1ccccc1)C(=O)O.O>>N.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)C(=O)Cc1ccccc1,39.0,0.0594591342325235,25.0,10.4,1.4.1.20,1455.0,1.591064607026499,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.NC(Cc1ccccc1)C(=O)O.O,N.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)C(=O)Cc1ccccc1,1.591064607026499,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.NC(Cc1ccccc1)C(=O)O.O__MSLVEKTSIIKDFTLFEKMSEHEQVVFCNDPATGLRAIIAIHDTTLGPALGGCRMQPYNSVEEALEDALRLSKGMTYKCAASDVDFGGGKAVIIGDPQKDKSPELFRAFGQFVDSLGGRFYTGTDMGTNMEDFIHAMKETNCIVGVPEAYGGGGDSSIPTAMGVLYGIKATNKMLFGKDDLGGVTYAIQGLGKVGYKVAEGLLEEGAHLFVTDINEQTLEAIQEKAKTTSGSVTVVASDEIYSQEADVFVPCAFGGVVNDETMKQFKVKAIAGSANNQLLTEDHGRHLADKGILYAPDYIVNSGGLIQVADELYEVNKERVLAKTKHIYDAILEVYQQAELDQITTMEAANRMCEQRMAARGRRNSFFTSSVKPKWDIRN,./data/raw/alphafold//AF-Q59224-F1-model_v4.pdb,1591,4670,4702,4533
+1313,4890,4960,MASKGREGEHPSVTLFRQYLRIRTVQPEPDYGAAVAFLEERARQLGLGCQKVEVVPGHVVTVLTWPGTNPTLSSILLNSHTDVVPVFKEHWSHDPFEGFKDADGYIYGRGAQDMKCVSIQYLEAVRRLKVEGHHFPRTIHMTFVPDEEVGGHQGMELFVKRPEFQALRAGFALDEGLASPTDAFTVFYSERSPWWLRVTSTGKPGHGSRFIEDTAAEKLHKVINSILAFREKEKQRLQSNQLKPGAVTSVNLTMLEGGVAYNVVPATMSACFDFRVAPDVDLKAFEEQLQSWCQAAGEGVTFEFVQKWMETQVTSTDDSDPWWAAFSGVFKDMKLALELEICPASTDARYIRAAGVPALGFSPMNHTPVLLHDHDERLHEAVFLRGVDIYTQLLSALASVPALPSES,brenda,P37111,CC(O)=N[C@H](C(=O)O)C(C)C.O>>CC(=O)O.CC(C)[C@H](N)C(=O)O,2.0,0.0,37.0,7.6,3.5.1.14,9823.0,0.3010299956639812,CC(O)=N[C@H](C(=O)O)C(C)C.O,CC(=O)O.CC(C)[C@H](N)C(=O)O,1.0755469613925308,CC(O)=N[C@H](C(=O)O)C(C)C.O__MASKGREGEHPSVTLFRQYLRIRTVQPEPDYGAAVAFLEERARQLGLGCQKVEVVPGHVVTVLTWPGTNPTLSSILLNSHTDVVPVFKEHWSHDPFEGFKDADGYIYGRGAQDMKCVSIQYLEAVRRLKVEGHHFPRTIHMTFVPDEEVGGHQGMELFVKRPEFQALRAGFALDEGLASPTDAFTVFYSERSPWWLRVTSTGKPGHGSRFIEDTAAEKLHKVINSILAFREKEKQRLQSNQLKPGAVTSVNLTMLEGGVAYNVVPATMSACFDFRVAPDVDLKAFEEQLQSWCQAAGEGVTFEFVQKWMETQVTSTDDSDPWWAAFSGVFKDMKLALELEICPASTDARYIRAAGVPALGFSPMNHTPVLLHDHDERLHEAVFLRGVDIYTQLLSALASVPALPSES,./data/raw/alphafold//AF-P37111-F1-model_v4.pdb,2954,1690,3302,2102
+1314,12208,12372,MLALLLSPYGAYLGLALLVLYYLLPYLKRAHLRDIPAPGLAAFTNFWLLLQTRRGHRFVVVDNAHKKYGKLVRIAPRHTSIADDGAIQAVYGHGNGFLKSDFYDAFVSIHRGLFNTRDRAEHTRKRKTVSHTFSMKSIGQFEQYIHGNIELFVKQWNRMADTQRNPKTGFASLDALNWFNYLAFDIIGDLAFGAPFGMLDKGKDFAEMRKTPDSPPSYVQAVEVLNRRGEVSATLGCYPALKPFAKYLPDSFFRDGIQAVEDLAGIAVARVNERLRPEVMANNTRVDLLARLMEGKDSNGEKLGRAELTAEALTQLIAGSDTTSNTSCAILYWCMRTPGVIEKLHKALDEAIPQDVDVPTHAMVKDIPYLQWVIWETMRIHSTSAMGLPREIPAGNPPVTISGHTFYPGDVVSVPSYTIHRSKEIWGPDAEQFVPERWDPARLTPRQKAAFIPFSTGPRACVGRNVAEMELLVICGTVFRLFEFEMQQEGPMETREGFLRKPLGLQVGMKRRQPGSA,uniprot_search,P17549,Cc1ccccc1C(=O)[O-].O=O>>Cc1cc(O)ccc1C(=O)O.O,3.67,10000000.0,37.0,6.2,1.14.14.92,5061.0,0.5646660642520893,Cc1ccccc1C(=O)[O-].O=O,Cc1cc(O)ccc1C(=O)O.O,0.5646660642520893,Cc1ccccc1C(=O)[O-].O=O__MLALLLSPYGAYLGLALLVLYYLLPYLKRAHLRDIPAPGLAAFTNFWLLLQTRRGHRFVVVDNAHKKYGKLVRIAPRHTSIADDGAIQAVYGHGNGFLKSDFYDAFVSIHRGLFNTRDRAEHTRKRKTVSHTFSMKSIGQFEQYIHGNIELFVKQWNRMADTQRNPKTGFASLDALNWFNYLAFDIIGDLAFGAPFGMLDKGKDFAEMRKTPDSPPSYVQAVEVLNRRGEVSATLGCYPALKPFAKYLPDSFFRDGIQAVEDLAGIAVARVNERLRPEVMANNTRVDLLARLMEGKDSNGEKLGRAELTAEALTQLIAGSDTTSNTSCAILYWCMRTPGVIEKLHKALDEAIPQDVDVPTHAMVKDIPYLQWVIWETMRIHSTSAMGLPREIPAGNPPVTISGHTFYPGDVVSVPSYTIHRSKEIWGPDAEQFVPERWDPARLTPRQKAAFIPFSTGPRACVGRNVAEMELLVICGTVFRLFEFEMQQEGPMETREGFLRKPLGLQVGMKRRQPGSA,./data/raw/alphafold//AF-P17549-F1-model_v4.pdb,3578,3539,1318,3273
+1315,5714,5800,MGLMLIDWCALALVVFIGLPHGALDAAISFSMISSAKRIARLAGILLIYLLLATAFFLIWYQLPAFSLLIFLLISIIHFGMADFNASPSKLKWPHIIAHGGVVTVWLPLIQKNEVTKLFSILTNGPTPILWDILLIFFLCWSIGVCLHTYETLRSKHYNIAFELIGLIFLAWYAPPLVTFATYFCFIHSRRHFSFVWKQLQHMSSKKMMIGSAIILSCTSWLIGGGIYFFLNSKMIASEAALQTVFIGLAALTVPHMILIDFIFRPHSSRIKIKN,brenda,Q4PNI0,CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C[C@@H](O)CC2(C)C)C(C)(C)CCC1.O=O>>CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=O)C(C)(C)CCC1.CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=O)C(C)(C)C[C@H](O)C1,0.013,1.9420866219943463e-14,40.0,8.0,1.13.11.63,56765.0,-1.8860566476931635,CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C[C@@H](O)CC2(C)C)C(C)(C)CCC1.O=O,CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=O)C(C)(C)CCC1.CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=O)C(C)(C)C[C@H](O)C1,-1.8860566476931635,CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C[C@@H](O)CC2(C)C)C(C)(C)CCC1.O=O__MGLMLIDWCALALVVFIGLPHGALDAAISFSMISSAKRIARLAGILLIYLLLATAFFLIWYQLPAFSLLIFLLISIIHFGMADFNASPSKLKWPHIIAHGGVVTVWLPLIQKNEVTKLFSILTNGPTPILWDILLIFFLCWSIGVCLHTYETLRSKHYNIAFELIGLIFLAWYAPPLVTFATYFCFIHSRRHFSFVWKQLQHMSSKKMMIGSAIILSCTSWLIGGGIYFFLNSKMIASEAALQTVFIGLAALTVPHMILIDFIFRPHSSRIKIKN,./data/raw/alphafold//AF-Q4PNI0-F1-model_v4.pdb,1718,1345,6274,1623
+1316,11851,12009,MNWLVWALLLCSSAMAHVHRDPTLDHHWDLWKKTYGKQYKEKNEEVARRLIWEKNLKTVTLHNLEHSMGMHSYELGMNHLGDMTSEEVISLMSSLRVPSQWPRNVTYKSDPNQKLPDSMDWREKGCVTEVKYQGACGSCWAFSAVGALEAQVKLKTGKLVSLSAQNLVDCSTAKYGNKGCNGGFMTEAFQYIIDNNGIDSEASYPYKAMDGKCQYDVKNRAATCSRYIELPFGSEEALKEAVANKGPVSVGIDASHSSFFLYKTGVYYDPSCTQNVNHGVLVVGYGNLDGKDYWLVKNSWGLHFGDQGYIRMARNSGNHCGIANYPSYPEI,uniprot_search,P25326,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N=C(O)[C@H](Cc3ccccc3)N=C(O)c3ccccc3)C(C)C)ccc12.O>>CC(C)[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)c1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,13.0,1.6233810749485733e-14,25.0,6.5,3.4.22.27,9913.0,1.1139433523068367,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N=C(O)[C@H](Cc3ccccc3)N=C(O)c3ccccc3)C(C)C)ccc12.O,CC(C)[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)c1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,1.1139433523068367,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N=C(O)[C@H](Cc3ccccc3)N=C(O)c3ccccc3)C(C)C)ccc12.O__MNWLVWALLLCSSAMAHVHRDPTLDHHWDLWKKTYGKQYKEKNEEVARRLIWEKNLKTVTLHNLEHSMGMHSYELGMNHLGDMTSEEVISLMSSLRVPSQWPRNVTYKSDPNQKLPDSMDWREKGCVTEVKYQGACGSCWAFSAVGALEAQVKLKTGKLVSLSAQNLVDCSTAKYGNKGCNGGFMTEAFQYIIDNNGIDSEASYPYKAMDGKCQYDVKNRAATCSRYIELPFGSEEALKEAVANKGPVSVGIDASHSSFFLYKTGVYYDPSCTQNVNHGVLVVGYGNLDGKDYWLVKNSWGLHFGDQGYIRMARNSGNHCGIANYPSYPEI,./data/raw/alphafold//AF-P25326-F1-model_v4.pdb,1940,2205,3892,3745
+1317,7245,7367,MAEYLRLPHSLAMIRLCNPPVNAVSPTVIREVRNGLQKAGSDHTVKAIVICGANGNFCAGADIHGFSAFTPGLALGSLVDEIQRYQKPVLAAIQGVALGGGLELALGCHYRIANAKARVGLPEVTLGILPGARGTQLLPRVVGVPVALDLITSGKYLSADEALRLGILDAVVKSDPVEEAIKFAQKIIDKPIEPRRIFNKPVPSLPNMDSVFAEAIAKVRKQYPGVLAPETCVRSIQASVKHPYEVGIKEEEKLFMYLRASGQAKALQYAFFAEKSANKWSTPSGASWKTASAQPVSSVGVLGLGTMGRGIAISFARVGISVVAVESDPKQLDAAKKIITFTLEKEASRAHQNGQASAKPKLRFSSSTKELSTVDLVVEAVFEDMNLKKKVFAELSALCKPGAFLCTNTSALNVDDIASSTDRPQLVIGTHFFSPAHVMRLLEVIPSRYSSPTTIATVMSLSKKIGKIGVVVGNCYGFVGNRMLAPYYNQGFFLLEEGSKPEDVDGVLEEFGFKMGPFRVSDLAGLDVGWKIRKGQGLTGPSLPPGTPVRKRGNSRYSPLGDMLCEAGRFGQKTGKGWYQYDKPLGRIHKPDPWLSTFLSQYREVHHIEQRTISKEEILERCLYSLINEAFRILEEGMAARPEHIDVIYLHGYGWPRHKGGPMFYAASVGLPTVLEKLQKYYRQNPDIPQLEPSDYLRRLVAQGSPPLKEWQSLAGPHGSKL,sabio,P07896,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>>CCCCCCCCCCCC=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,1.4,0.0,25.0,8.0,5.3.3.8,10116.0,0.1461280356782379,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,CCCCCCCCCCCC=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,0.1461280356782379,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__MAEYLRLPHSLAMIRLCNPPVNAVSPTVIREVRNGLQKAGSDHTVKAIVICGANGNFCAGADIHGFSAFTPGLALGSLVDEIQRYQKPVLAAIQGVALGGGLELALGCHYRIANAKARVGLPEVTLGILPGARGTQLLPRVVGVPVALDLITSGKYLSADEALRLGILDAVVKSDPVEEAIKFAQKIIDKPIEPRRIFNKPVPSLPNMDSVFAEAIAKVRKQYPGVLAPETCVRSIQASVKHPYEVGIKEEEKLFMYLRASGQAKALQYAFFAEKSANKWSTPSGASWKTASAQPVSSVGVLGLGTMGRGIAISFARVGISVVAVESDPKQLDAAKKIITFTLEKEASRAHQNGQASAKPKLRFSSSTKELSTVDLVVEAVFEDMNLKKKVFAELSALCKPGAFLCTNTSALNVDDIASSTDRPQLVIGTHFFSPAHVMRLLEVIPSRYSSPTTIATVMSLSKKIGKIGVVVGNCYGFVGNRMLAPYYNQGFFLLEEGSKPEDVDGVLEEFGFKMGPFRVSDLAGLDVGWKIRKGQGLTGPSLPPGTPVRKRGNSRYSPLGDMLCEAGRFGQKTGKGWYQYDKPLGRIHKPDPWLSTFLSQYREVHHIEQRTISKEEILERCLYSLINEAFRILEEGMAARPEHIDVIYLHGYGWPRHKGGPMFYAASVGLPTVLEKLQKYYRQNPDIPQLEPSDYLRRLVAQGSPPLKEWQSLAGPHGSKL,./data/raw/alphafold//AF-P07896-F1-model_v4.pdb,878,371,3,4
+1318,10157,10308,MKSLPILLLLCVAVCSAYPLDGAARGEDTSMNLVQKYLENYYDLKKDVKQFVRRKDSGPVVKKIREMQKFLGLEVTGKLDSDTLEVMRKPRCGVPDVGHFRTFPGIPKWRKTHLTYRIVNYTPDLPKDAVDSAVEKALKVWEEVTPLTFSRLYEGEADIMISFAVREHGDFYPFDGPGNVLAHAYAPGPGINGDAHFDDDEQWTKDTTGTNLFLVAAHEIGHSLGLFHSANTEALMYPLYHSLTDLTRFRLSQDDINGIQSLYGPPPDSPETPLVPTEPVPPEPGTPANCDPALSFDAVSTLRGEILIFKDRHFWRKSLRKLEPELHLISSFWPSLPSGVDAAYEVTSKDLVFIFKGNQFWAIRGNEVRAGYPRGIHTLGFPPTVRKIDAAISDKEKNKTYFFVEDKYWRFDEKRNSMEPGFPKQIAEDFPGIDSKIDAVFEEFGFFYFFTGSSQLEFDPNAKKVTHTLKSNSWLNC,uniprot_search,P08254,CSCC[C@H](N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](C)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=N[C@@H](CCCNC(=N)N)C(=N)O.O>>CSCC[C@H](N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@@H](N)Cc1ccc(O)cc1)C(O)=N[C@@H](CCCNC(=N)N)C(=N)O.C[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O,0.24,9.718576403233064e-15,25.0,6.75,3.4.24.17,9606.0,-0.619788758288394,CSCC[C@H](N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](C)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=N[C@@H](CCCNC(=N)N)C(=N)O.O,CSCC[C@H](N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@@H](N)Cc1ccc(O)cc1)C(O)=N[C@@H](CCCNC(=N)N)C(=N)O.C[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O,-0.619788758288394,CSCC[C@H](N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](C)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=N[C@@H](CCCNC(=N)N)C(=N)O.O__MKSLPILLLLCVAVCSAYPLDGAARGEDTSMNLVQKYLENYYDLKKDVKQFVRRKDSGPVVKKIREMQKFLGLEVTGKLDSDTLEVMRKPRCGVPDVGHFRTFPGIPKWRKTHLTYRIVNYTPDLPKDAVDSAVEKALKVWEEVTPLTFSRLYEGEADIMISFAVREHGDFYPFDGPGNVLAHAYAPGPGINGDAHFDDDEQWTKDTTGTNLFLVAAHEIGHSLGLFHSANTEALMYPLYHSLTDLTRFRLSQDDINGIQSLYGPPPDSPETPLVPTEPVPPEPGTPANCDPALSFDAVSTLRGEILIFKDRHFWRKSLRKLEPELHLISSFWPSLPSGVDAAYEVTSKDLVFIFKGNQFWAIRGNEVRAGYPRGIHTLGFPPTVRKIDAAISDKEKNKTYFFVEDKYWRFDEKRNSMEPGFPKQIAEDFPGIDSKIDAVFEEFGFFYFFTGSSQLEFDPNAKKVTHTLKSNSWLNC,./data/raw/alphafold//AF-P08254-F1-model_v4.pdb,3567,2209,3896,2767
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+1330,9659,9805,MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,sabio,O94219,COc1ccc(CO)cc1Cl.O=O>>COc1ccc(C=O)cc1Cl.OO,46.0,0.0,24.0,6.0,1.1.3.7,5323.0,1.662757831681574,COc1ccc(CO)cc1Cl.O=O,COc1ccc(C=O)cc1Cl.OO,1.662757831681574,COc1ccc(CO)cc1Cl.O=O__MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,./data/raw/alphafold//AF-O94219-F1-model_v4.pdb,1050,3522,1297,300
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+1332,5100,5186,AKPAAENLSLVVHGPGDLRLENYPIPEPGPNEVLLKMHSVGICGSDVHYWQGRIGDFVVKKPMVLGHEASGTVVKVGSLVRHLQPGDRVAIQPGAPRQTDEFCKIGRYNLSPTIFFCATPPDDGNLCRFYKHNANFCYKLPDNVTFEEGALIEPLSVGIHACRRAGVTLGNKVLVCGAGPIGLVNLLAAKAMGAAQVVVTDLSASRLSKAKEVGADFILEISNESPEEIAKKVEGLLGSKPEVTIECTGVETSIQAGIYATHSGGTLVLVGLGSEMTSVPLVHAATREVDIKGVFRYCNTWPMAISMLASKSVNVKPLVTHRFPLEKALEAFETSKKGLGLKVMIKCDPSDQNP,sabio,P07846,CC(O)C(C)O.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>>NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],0.5,6.195860237662907,23.5,7.4,1.1.1.14,9940.0,-0.3010299956639812,CC(O)C(C)O.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,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],0.1760912590556812,CC(O)C(C)O.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__AKPAAENLSLVVHGPGDLRLENYPIPEPGPNEVLLKMHSVGICGSDVHYWQGRIGDFVVKKPMVLGHEASGTVVKVGSLVRHLQPGDRVAIQPGAPRQTDEFCKIGRYNLSPTIFFCATPPDDGNLCRFYKHNANFCYKLPDNVTFEEGALIEPLSVGIHACRRAGVTLGNKVLVCGAGPIGLVNLLAAKAMGAAQVVVTDLSASRLSKAKEVGADFILEISNESPEEIAKKVEGLLGSKPEVTIECTGVETSIQAGIYATHSGGTLVLVGLGSEMTSVPLVHAATREVDIKGVFRYCNTWPMAISMLASKSVNVKPLVTHRFPLEKALEAFETSKKGLGLKVMIKCDPSDQNP,./data/raw/alphafold//AF-P07846-F1-model_v4.pdb,2358,553,213,231
+1333,14880,15089,MKTAALFVSKEFEEEAIALVEGANYKVTSIYKLPKSPNVKFYIQYDKLQQIKNDEEISTLIIFEQLKPRHFINIRRELKGKEVLDKILLLLEIFALHAGSKEAKMQIELARLKYELPIIKETYTKSKIGEQQGPLGAGTYGVESTIKFYKRRINKLMKELESIKIFKEKSIESNKRNNIPSIGIVGYTNSGKTSLFNSLTGLTQKVDTKLFTTMSPKRYAIPINNRKIMLVDTVGFIRGIPPQIVDAFFVTLSEAKYSDALILVIDSTFSENLLIETLQSSFEILREIGVSGKPILVTLNKIDKINGDLYKKLDLVEKLSKELYSPIFDVIPISALKRTNLELLRDKIYQLATQLS,brenda,Q980M3,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>>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,0.0004,1.0493601366967451e-14,50.0,7.5,3.6.5.3,2287.0,-3.397940008672037,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,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,-2.978810700930062,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__MKTAALFVSKEFEEEAIALVEGANYKVTSIYKLPKSPNVKFYIQYDKLQQIKNDEEISTLIIFEQLKPRHFINIRRELKGKEVLDKILLLLEIFALHAGSKEAKMQIELARLKYELPIIKETYTKSKIGEQQGPLGAGTYGVESTIKFYKRRINKLMKELESIKIFKEKSIESNKRNNIPSIGIVGYTNSGKTSLFNSLTGLTQKVDTKLFTTMSPKRYAIPINNRKIMLVDTVGFIRGIPPQIVDAFFVTLSEAKYSDALILVIDSTFSENLLIETLQSSFEILREIGVSGKPILVTLNKIDKINGDLYKKLDLVEKLSKELYSPIFDVIPISALKRTNLELLRDKIYQLATQLS,./data/raw/alphafold//AF-Q980M3-F1-model_v4.pdb,2510,4943,2017,4871
+1334,22754,23094,MIEALRQQLLDDPRSWYAFLRHLVASQRDSWLYTDLQRACADFREQLPEGYAEGIGPLEDFVAHTQEVIFRDPWMVFAWRPRPGRWIYVRIHREQLALEELSTDAYLQAKEGIVGLGAEGEAVLTVDFRDFRPVSRRLRDESTIGDGLTHLNRRLAGRIFSDLAAGRSQILEFLSLHRLDGQNLMLSNGNTDFDSLRQTVQYLGTLPRETPWAEIREDMRRRGFAPGWGNTAGRVRETMRLLMDLLDSPSPAALESFLDRIPMISRILIVSIHGWFAQDKVLGRPDTGGQVVYILDQARALEREMRNRLRQQGVDVEPRILIATRLIPESDGTTCDQRLEPVVGAENVQILRVPFRYPDGRIHPHWISRFKIWPWLERYAQDLEREVLAELGSRPDLIIGNYSDGNLVATLLSERLGVTQCNIAHALEKSKYLYSDLHWRDHEQDHHFACQFTADLIAMNAADIIVTSTYQEIAGNDREIGQYEGHQDYTLPGLYRVENGIDVFDSKFNIVSPGADPRFYFSYARTEERPSFLEPEIESLLFGREPGADRRGVLEDRQKPLLLSMARMDRIKNLSGLAELYGRSSRLRGLANLVIIGGHVDVGNSRDAEEREEIRRMHEIMDHYQLDGQLRWVGALLDKTVAGELYRVVADGRGVFVQPALFEAFGLTVIEAMSSGLPVFATRFGGPLEIIEDGVSGFHIDPNDHEATAERLADFLEAARERPKYWLEISDAALARVAERYTWERYAERLMTIARIFGFWRFVLDRESQVMERYLQMFRHLQWRPLAHAVPME,uniprot_search,A0A1E7YJD9,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.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>>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.OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,82.0,1.5219977257304432e-14,60.0,7.0,2.4.1.13,33059.0,1.9138138523837167,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.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,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.OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,1.9138138523837167,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.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__MIEALRQQLLDDPRSWYAFLRHLVASQRDSWLYTDLQRACADFREQLPEGYAEGIGPLEDFVAHTQEVIFRDPWMVFAWRPRPGRWIYVRIHREQLALEELSTDAYLQAKEGIVGLGAEGEAVLTVDFRDFRPVSRRLRDESTIGDGLTHLNRRLAGRIFSDLAAGRSQILEFLSLHRLDGQNLMLSNGNTDFDSLRQTVQYLGTLPRETPWAEIREDMRRRGFAPGWGNTAGRVRETMRLLMDLLDSPSPAALESFLDRIPMISRILIVSIHGWFAQDKVLGRPDTGGQVVYILDQARALEREMRNRLRQQGVDVEPRILIATRLIPESDGTTCDQRLEPVVGAENVQILRVPFRYPDGRIHPHWISRFKIWPWLERYAQDLEREVLAELGSRPDLIIGNYSDGNLVATLLSERLGVTQCNIAHALEKSKYLYSDLHWRDHEQDHHFACQFTADLIAMNAADIIVTSTYQEIAGNDREIGQYEGHQDYTLPGLYRVENGIDVFDSKFNIVSPGADPRFYFSYARTEERPSFLEPEIESLLFGREPGADRRGVLEDRQKPLLLSMARMDRIKNLSGLAELYGRSSRLRGLANLVIIGGHVDVGNSRDAEEREEIRRMHEIMDHYQLDGQLRWVGALLDKTVAGELYRVVADGRGVFVQPALFEAFGLTVIEAMSSGLPVFATRFGGPLEIIEDGVSGFHIDPNDHEATAERLADFLEAARERPKYWLEISDAALARVAERYTWERYAERLMTIARIFGFWRFVLDRESQVMERYLQMFRHLQWRPLAHAVPME,./data/raw/alphafold//AF-A0A1E7YJD9-F1-model_v4.pdb,98,2584,2882,5730
+1335,7415,7537,MIWKRHLTLDELNATSDNTMVAHLGIVYTRLGDDVLEAEMPVDTRTHQPFGLLHGGASAALAETLGSMAGFMMTRDGQCVVGTELNATHHRPVSEGKVRGVCQPLHLGRQNQSWEIVVFDEQGRRCCTCRLGTAVLG,sabio,P0A8Y8,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,0.085,2.2194252003544465e-14,25.0,7.5,3.1.2.-,562.0,-1.0705810742857071,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,-1.0705810742857071,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__MIWKRHLTLDELNATSDNTMVAHLGIVYTRLGDDVLEAEMPVDTRTHQPFGLLHGGASAALAETLGSMAGFMMTRDGQCVVGTELNATHHRPVSEGKVRGVCQPLHLGRQNQSWEIVVFDEQGRRCCTCRLGTAVLG,./data/raw/alphafold//AF-P0A8Y8-F1-model_v4.pdb,1703,1131,967,1309
+1336,10449,10602,MPTPQKHSTQSTNFEINLKHHGGKLGVTGSCHELCINSNGNKHGILIDCGLFQGKDAKDKHGNDKKLDIEFPISHLKALILTHTHIDHIGRLPWLLTKGFKQPIYCTPATAELVPLMLDDGLKLQLGLNKGQRERVLELIRKQIKPIPYNQWHRIKLTSTMVPSHSKSSCSSLKAKRPESLNLLLRFQPAGHILGSAYVEIKLPNDEIVVFSGDLGPSNTPLLPDPISPKRADLLVIESTYGNKLHDSVETRAKRLQEIIERSLQDGGAIIIPAFSVGRTQELLFDIEHLIHHNKIDSKIPIILDSPLANKVTKQYRRFKKLWSKEAKTKLNNQRHPLNFEQCITIESHKEHMQIVNRLKSTAKPCIIVAASGMCAGGRVMNYLEALLPDKRTDIILAGYQAHGTLGRDLQNQRSTVWIDNQPVDVNAQIHTMSGYSAHADQADLIKFVDGIEEGRKEVVVVHGEDNVREEFERVLEARNYTLR,brenda,B6EPH0,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(S[C@@H]3CN[C@H](C(O)=Nc4cccc(C(=O)O)c4)C3)[C@H](C)[C@H]12.O>>,4.0,99.7977910696448,37.0,7.2,3.5.2.6,40269.0,0.6020599913279624,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(S[C@@H]3CN[C@H](C(O)=Nc4cccc(C(=O)O)c4)C3)[C@H](C)[C@H]12.O,,0.6334684555795865,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(S[C@@H]3CN[C@H](C(O)=Nc4cccc(C(=O)O)c4)C3)[C@H](C)[C@H]12.O__MPTPQKHSTQSTNFEINLKHHGGKLGVTGSCHELCINSNGNKHGILIDCGLFQGKDAKDKHGNDKKLDIEFPISHLKALILTHTHIDHIGRLPWLLTKGFKQPIYCTPATAELVPLMLDDGLKLQLGLNKGQRERVLELIRKQIKPIPYNQWHRIKLTSTMVPSHSKSSCSSLKAKRPESLNLLLRFQPAGHILGSAYVEIKLPNDEIVVFSGDLGPSNTPLLPDPISPKRADLLVIESTYGNKLHDSVETRAKRLQEIIERSLQDGGAIIIPAFSVGRTQELLFDIEHLIHHNKIDSKIPIILDSPLANKVTKQYRRFKKLWSKEAKTKLNNQRHPLNFEQCITIESHKEHMQIVNRLKSTAKPCIIVAASGMCAGGRVMNYLEALLPDKRTDIILAGYQAHGTLGRDLQNQRSTVWIDNQPVDVNAQIHTMSGYSAHADQADLIKFVDGIEEGRKEVVVVHGEDNVREEFERVLEARNYTLR,./data/raw/alphafold//AF-B6EPH0-F1-model_v4.pdb,1714,1337,6264,1609
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+1343,5302,5388,MATFPVVDLSLVNGEERAATLEKINDACENWGFFELVNHGMSTELLDTVEKMTKDHYKKTMEQRFKEMVAAKGLDDVQSEIHDLDWESTFFLRHLPSSNISEIPDLEEEYRKTMKEFAVELEKLAEKLLDLLCENLGLEKGYLKKVFYGSKGPNFGTKVSNYPPCPKPDLIKGLRAHSDAGGIILLFQDDKVSGLQLLKDGEWVDVPPMHHSIVINLGDQIEVITNGKYKSVMHRVIAQSDGTRMSIASFYNPGNDSFISPAPAVLEKKTEDAPTYPKFVFDDYMKLYSGLKFQAKEPRFEAMKAKESTPVATA,brenda,Q00985,CC1(C)OC[C@H]([C@H]2OC(=O)C(O)=C2O)O1.NC1(C(=O)O)CC1.O=O>>C#N.C=C.CC(C)(C)OC[C@@H](O)[C@@H]1OC(=O)C(=O)C1=O.O.O=C=O,0.066,0.2826786236475343,20.0,7.2,1.14.17.4,3750.0,-1.1804560644581312,CC1(C)OC[C@H]([C@H]2OC(=O)C(O)=C2O)O1.NC1(C(=O)O)CC1.O=O,C#N.C=C.CC(C)(C)OC[C@@H](O)[C@@H]1OC(=O)C(=O)C1=O.O.O=C=O,-1.1804560644581312,CC1(C)OC[C@H]([C@H]2OC(=O)C(O)=C2O)O1.NC1(C(=O)O)CC1.O=O__MATFPVVDLSLVNGEERAATLEKINDACENWGFFELVNHGMSTELLDTVEKMTKDHYKKTMEQRFKEMVAAKGLDDVQSEIHDLDWESTFFLRHLPSSNISEIPDLEEEYRKTMKEFAVELEKLAEKLLDLLCENLGLEKGYLKKVFYGSKGPNFGTKVSNYPPCPKPDLIKGLRAHSDAGGIILLFQDDKVSGLQLLKDGEWVDVPPMHHSIVINLGDQIEVITNGKYKSVMHRVIAQSDGTRMSIASFYNPGNDSFISPAPAVLEKKTEDAPTYPKFVFDDYMKLYSGLKFQAKEPRFEAMKAKESTPVATA,./data/raw/alphafold//AF-Q00985-F1-model_v4.pdb,3123,1897,3534,2354
+1344,4502,4557,MDFSGLFLTLSAAALFLCLLRFIAGVRRSSSTKLPLPPGTMGYPYVGETFQLYSQDPNVFFAAKQRRYGSVFKTHVLGCPCVMISSPEAAKFVLVTKSHLFKPTFPASKERMLGKQAIFFHQGDYHSKLRKLVLRAFMPDAIRNMVPHIESIAQESLNSWDGTQLNTYQEMKTYTFNVALISILGKDEVYYREDLKRCYYILEKGYNSMPINLPGTLFHKAMKARKELAQILANILSKRRQNPSSHTDLLGSFMEDKAGLTDEQIADNIIGVIFAARDTTASVLTWILKYLADNPTVLEAVTEEQMAIRKDKKEGESLTWEDTKKMPLTYRVIQETLRAATILSFTFREAVEDVEYEGYLIPKGWKVLPLFRNIHHNADIFSDPGKFDPSRFEVAPKPNTFMPFGSGIHSCPGNELAKLEISVLIHHLTTKYRWSIVGPSDGIQYGPFALPQNGLPIALERKP,sabio,Q9FH76,CC(C=CC1(O)C(C)=CC(=O)CC1(C)C)=CC(=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.O=O.[H]>>CC1=CC(=O)C[C@](C)(CO)[C@@]1(O)/C=C/C(C)=C\C(=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,900.0,0.0,30.0,7.25,1.14.14.137,3702.0,2.9542425094393248,CC(C=CC1(O)C(C)=CC(=O)CC1(C)C)=CC(=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.O=O.[H],CC1=CC(=O)C[C@](C)(CO)[C@@]1(O)/C=C/C(C)=C\C(=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,2.9542425094393248,CC(C=CC1(O)C(C)=CC(=O)CC1(C)C)=CC(=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.O=O.[H]__MDFSGLFLTLSAAALFLCLLRFIAGVRRSSSTKLPLPPGTMGYPYVGETFQLYSQDPNVFFAAKQRRYGSVFKTHVLGCPCVMISSPEAAKFVLVTKSHLFKPTFPASKERMLGKQAIFFHQGDYHSKLRKLVLRAFMPDAIRNMVPHIESIAQESLNSWDGTQLNTYQEMKTYTFNVALISILGKDEVYYREDLKRCYYILEKGYNSMPINLPGTLFHKAMKARKELAQILANILSKRRQNPSSHTDLLGSFMEDKAGLTDEQIADNIIGVIFAARDTTASVLTWILKYLADNPTVLEAVTEEQMAIRKDKKEGESLTWEDTKKMPLTYRVIQETLRAATILSFTFREAVEDVEYEGYLIPKGWKVLPLFRNIHHNADIFSDPGKFDPSRFEVAPKPNTFMPFGSGIHSCPGNELAKLEISVLIHHLTTKYRWSIVGPSDGIQYGPFALPQNGLPIALERKP,./data/raw/alphafold//AF-Q9FH76-F1-model_v4.pdb,2928,1658,3263,2054
+1345,23149,23491,MSQHNEKNPHQHQSPLHDSSEAKPGMDSLAPEDGSHRPAAEPTPPGAQPTAPGSLKAPDTRNEKLNSLEDVRKGSENYALTTNQGVRIADDQNSLRAGSRGPTLLEDFILREKITHFDHERIPERIVHARGSAAHGYFQPYKSLSDITKADFLSDPNKITPVFVRFSTVQGGAGSADTVRDIRGFATKFYTEEGIFDLVGNNTPIFFIQDAHKFPDFVHAVKPEPHWAIPQGQSAHDTFWDYVSLQPETLHNVMWAMSDRGIPRSYRTMEGFGIHTFRLINAEGKATFVRFHWKPLAGKASLVWDEAQKLTGRDPDFHRRELWEAIEAGDFPEYELGFQLIPEEDEFKFDFDLLDPTKLIPEELVPVQRVGKMVLNRNPDNFFAENEQAAFHPGHIVPGLDFTNDPLLQGRLFSYTDTQISRLGGPNFHEIPINRPTCPYHNFQRDGMHRMGIDTNPANYEPNSINDNWPRETPPGPKRGGFESYQERVEGNKVRERSPSFGEYYSHPRLFWLSQTPFEQRHIVDGFSFELSKVVRPYIRERVVDQLAHIDLTLAQAVAKNLGIELTDDQLNITPPPDVNGLKKDPSLSLYAIPDGDVKGRVVAILLNDEVRSADLLAILKALKAKGVHAKLLYSRMGEVTADDGTVLPIAATFAGAPSLTVDAVIVPCGNIADIADNGDANYYLMEAYKHLKPIALAGDARKFKATIKIADQGEEGIVEADSADGSFMDELLTLMAAHRVWSRIPKIDKIPA,sabio,P21179,OO>>O.O=O,151000.0,18.81637597469039,37.0,7.0,1.11.1.6,562.0,5.17897694729317,OO,O.O=O,5.17897694729317,OO__MSQHNEKNPHQHQSPLHDSSEAKPGMDSLAPEDGSHRPAAEPTPPGAQPTAPGSLKAPDTRNEKLNSLEDVRKGSENYALTTNQGVRIADDQNSLRAGSRGPTLLEDFILREKITHFDHERIPERIVHARGSAAHGYFQPYKSLSDITKADFLSDPNKITPVFVRFSTVQGGAGSADTVRDIRGFATKFYTEEGIFDLVGNNTPIFFIQDAHKFPDFVHAVKPEPHWAIPQGQSAHDTFWDYVSLQPETLHNVMWAMSDRGIPRSYRTMEGFGIHTFRLINAEGKATFVRFHWKPLAGKASLVWDEAQKLTGRDPDFHRRELWEAIEAGDFPEYELGFQLIPEEDEFKFDFDLLDPTKLIPEELVPVQRVGKMVLNRNPDNFFAENEQAAFHPGHIVPGLDFTNDPLLQGRLFSYTDTQISRLGGPNFHEIPINRPTCPYHNFQRDGMHRMGIDTNPANYEPNSINDNWPRETPPGPKRGGFESYQERVEGNKVRERSPSFGEYYSHPRLFWLSQTPFEQRHIVDGFSFELSKVVRPYIRERVVDQLAHIDLTLAQAVAKNLGIELTDDQLNITPPPDVNGLKKDPSLSLYAIPDGDVKGRVVAILLNDEVRSADLLAILKALKAKGVHAKLLYSRMGEVTADDGTVLPIAATFAGAPSLTVDAVIVPCGNIADIADNGDANYYLMEAYKHLKPIALAGDARKFKATIKIADQGEEGIVEADSADGSFMDELLTLMAAHRVWSRIPKIDKIPA,./data/raw/alphafold//AF-P21179-F1-model_v4.pdb,871,362,6138,7082
+1346,4716,4774,MAEKLKLARSMSLFEEAKQLVPGGVAGIRRPYNFVPGEYPIFFDHGKGGRVVDVDGNEYIDFLCAYGPIIIGYREDEIDDAVINQIKNKGFCFSLTQEMQNTLVKKLRELIPCCEMAALVKTGSDATTIAIRVARGYTGKTKIARYGYHGWHDWCVEVKGGIPPKLYEDIYEFHYNDLDSLKAILEANKDDMAGIIITPIGHPNGAEVQMPKPGYLEAVRELANQYHCLLIFDEIRSGFRCSLGGAQKLFGVTPDLSTFGKAMANGYAIAALVGKEEYMQVLADKVFLSSTFFPNSDGIVAAIKTIEILERDRILDVVAAKGRKFGAEVEKVVEESGVPVNFTGAPWMPYITFKKDEAGLYKKLRTEYYTQLIRHNVFMQPYHHGYICYRHTDEDLAYTVEAIRESLAEVKKML,brenda,B0VH76,CC(O)=NCCSC(=O)CC(N)c1ccccc1.O=C(O)CCC(=O)C(=O)O>>CC(O)=NCCSC(=O)CC(=O)c1ccccc1.N[C@@H](CCC(=O)O)C(=O)O,1.8,0.0,28.0,8.1,2.6.1.111,456827.0,0.255272505103306,CC(O)=NCCSC(=O)CC(N)c1ccccc1.O=C(O)CCC(=O)C(=O)O,CC(O)=NCCSC(=O)CC(=O)c1ccccc1.N[C@@H](CCC(=O)O)C(=O)O,0.255272505103306,CC(O)=NCCSC(=O)CC(N)c1ccccc1.O=C(O)CCC(=O)C(=O)O__MAEKLKLARSMSLFEEAKQLVPGGVAGIRRPYNFVPGEYPIFFDHGKGGRVVDVDGNEYIDFLCAYGPIIIGYREDEIDDAVINQIKNKGFCFSLTQEMQNTLVKKLRELIPCCEMAALVKTGSDATTIAIRVARGYTGKTKIARYGYHGWHDWCVEVKGGIPPKLYEDIYEFHYNDLDSLKAILEANKDDMAGIIITPIGHPNGAEVQMPKPGYLEAVRELANQYHCLLIFDEIRSGFRCSLGGAQKLFGVTPDLSTFGKAMANGYAIAALVGKEEYMQVLADKVFLSSTFFPNSDGIVAAIKTIEILERDRILDVVAAKGRKFGAEVEKVVEESGVPVNFTGAPWMPYITFKKDEAGLYKKLRTEYYTQLIRHNVFMQPYHHGYICYRHTDEDLAYTVEAIRESLAEVKKML,./data/raw/alphafold//AF-B0VH76-F1-model_v4.pdb,1272,5224,1611,738
+1347,15781,16008,MKWDEIGKNIAKEIEKEILPYFGRKDKSYVVGTSPSGDETEIFDKISEDIALKYLKSLNVNIVSEELGVIDNSSEWTVVIDPIDGSFNFINGIPFFAFCFGVFKNNEPYYGLTYEFLTKSFYEAYKGKGAYLNGRKIKVKDFNPNNIVISYYPSKKIDLEKLRNKVKRVRIFGAFGLEMCYVAKGTLDAVFDVRPKVRAVDIASSYIICKEAGALITDENGDELKFDLNATDRLNIIVANSKEMLDIILDLL,sabio,Q57573,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>>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.O=P(O)(O)O,5.0,7.450653382058689e-15,85.0,8.5,3.1.3.108,2190.0,0.6989700043360189,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,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.O=P(O)(O)O,0.6989700043360189,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__MKWDEIGKNIAKEIEKEILPYFGRKDKSYVVGTSPSGDETEIFDKISEDIALKYLKSLNVNIVSEELGVIDNSSEWTVVIDPIDGSFNFINGIPFFAFCFGVFKNNEPYYGLTYEFLTKSFYEAYKGKGAYLNGRKIKVKDFNPNNIVISYYPSKKIDLEKLRNKVKRVRIFGAFGLEMCYVAKGTLDAVFDVRPKVRAVDIASSYIICKEAGALITDENGDELKFDLNATDRLNIIVANSKEMLDIILDLL,./data/raw/alphafold//AF-Q57573-F1-model_v4.pdb,3765,4552,4477,4374
+1348,10742,10897,MWLAAAAPSLARRLLFLGPPPPPLLLLVFSRSSRRRLHSLGLAAMPEKRPFERLPADVSPINYSLCLKPDLLDFTFEGKLEAAAQVRQATNQIVMNCADIDIITASYAPEGDEEIHATGFNYQNEDEKVTLSFPSTLQTGTGTLKIDFVGELNDKMKGFYRSKYTTPSGEVRYAAVTQFEATDARRAFPCWDEPAIKATFDISLVVPKDRVALSNMNVIDRKPYPDDENLVEVKFARTPVMSTYLVAFVVGEYDFVETRSKDGVCVRVYTPVGKAEQGKFALEVAAKTLPFYKDYFNVPYPLPKIDLIAIADFAAGAMENWGLVTYRETALLIDPKNSCSSSRQWVALVVGHELAHQWFGNLVTMEWWTHLWLNEGFASWIEYLCVDHCFPEYDIWTQFVSADYTRAQELDALDNSHPIEVSVGHPSEVDEIFDAISYSKGASVIRMLHDYIGDKDFKKGMNMYLTKFQQKNAATEDLWESLENASGKPIAAVMNTWTKQMGFPLIYVEAEQVEDDRLLRLSQKKFCAGGSYVGEDCPQWMVPITISTSEDPNQAKLKILMDKPEMNVVLKNVKPDQWVKLNLGTVGFYRTQYSSAMLESLLPGIRDLSLPPVDRLGLQNDLFSLARAGIISTVEVLKVMEAFVNEPNYTVWSDLSCNLGILSTLLSHTDFYEEIQEFVKDVFSPIGERLGWDPKPGEGHLDALLRGLVLGKLGKAGHKATLEEARRRFKDHVEGKQILSADLRSPVYLTVLKHGDGTTLDIMLKLHKQADMQEEKNRIERVLGATLLPDLIQKVLTFALSEEVRPQDTVSVIGGVAGGSKHGRKAAWKFIKDNWEELYNRYQGGFLISRLIKLSVEGFAVDKMAGEVKAFFESHPAPSAERTIQQCCENILLNAAWLKRDAESIHQYLLQRKASPPTV,uniprot_search,P55786,C[C@H](N)C(O)=Nc1ccc2ccccc2c1.O>>C[C@H](N)C(=O)O.Nc1ccc2ccccc2c1,141.0,1.2209529660844656e-14,37.0,6.8,3.4.11.14,9606.0,2.14921911265538,C[C@H](N)C(O)=Nc1ccc2ccccc2c1.O,C[C@H](N)C(=O)O.Nc1ccc2ccccc2c1,2.14921911265538,C[C@H](N)C(O)=Nc1ccc2ccccc2c1.O__MWLAAAAPSLARRLLFLGPPPPPLLLLVFSRSSRRRLHSLGLAAMPEKRPFERLPADVSPINYSLCLKPDLLDFTFEGKLEAAAQVRQATNQIVMNCADIDIITASYAPEGDEEIHATGFNYQNEDEKVTLSFPSTLQTGTGTLKIDFVGELNDKMKGFYRSKYTTPSGEVRYAAVTQFEATDARRAFPCWDEPAIKATFDISLVVPKDRVALSNMNVIDRKPYPDDENLVEVKFARTPVMSTYLVAFVVGEYDFVETRSKDGVCVRVYTPVGKAEQGKFALEVAAKTLPFYKDYFNVPYPLPKIDLIAIADFAAGAMENWGLVTYRETALLIDPKNSCSSSRQWVALVVGHELAHQWFGNLVTMEWWTHLWLNEGFASWIEYLCVDHCFPEYDIWTQFVSADYTRAQELDALDNSHPIEVSVGHPSEVDEIFDAISYSKGASVIRMLHDYIGDKDFKKGMNMYLTKFQQKNAATEDLWESLENASGKPIAAVMNTWTKQMGFPLIYVEAEQVEDDRLLRLSQKKFCAGGSYVGEDCPQWMVPITISTSEDPNQAKLKILMDKPEMNVVLKNVKPDQWVKLNLGTVGFYRTQYSSAMLESLLPGIRDLSLPPVDRLGLQNDLFSLARAGIISTVEVLKVMEAFVNEPNYTVWSDLSCNLGILSTLLSHTDFYEEIQEFVKDVFSPIGERLGWDPKPGEGHLDALLRGLVLGKLGKAGHKATLEEARRRFKDHVEGKQILSADLRSPVYLTVLKHGDGTTLDIMLKLHKQADMQEEKNRIERVLGATLLPDLIQKVLTFALSEEVRPQDTVSVIGGVAGGSKHGRKAAWKFIKDNWEELYNRYQGGFLISRLIKLSVEGFAVDKMAGEVKAFFESHPAPSAERTIQQCCENILLNAAWLKRDAESIHQYLLQRKASPPTV,./data/raw/alphafold//AF-P55786-F1-model_v4.pdb,1848,1541,3123,1889
+1349,14516,14719,MGIKLPTLEDLREISKQFNLDLEDEELKSFLQLLKLQLESYERLDSLPDYTPRVKYQRTLGRPPMKEENPYGALVWITSIKGKEEGKLKGKRICIKDNVMIAGIPMLNGSKMLEGFVPHMDATVVSRILDEAGEIVAKTTCEDLCFSGGSHTSYPWPVLNPRNPEYMAGGSSSGSAVAVASGYCDMAVGGDQGGSIRIPSSWVGIYGLKPTHGLVPYTGAFSIEPTLDHLGPMANTVKDVALLLEVIAGRDELDSRQPDSLPPPPVKPYSKLIDGDVKDMKVGIVKEGFNWSNSEKDVDELVLDSAKKLEDYGIKVEDTSIPLHRMGLDIWTPIAIEGATATMILGSGVGWGRKGLFETQIADFFGNSLKSRARDLPNTVKGVLMLGYLMIKMYNNRYYAKARNLSIVLKEAYDSALRKYDALIMPTTPMKAMRYKSEPGFDEYFIMALGMINNTAPFDVTGHPAMNIPVGYSNGLPVGLMIIGRHFEEDKVLKLANVFERIKK,brenda,P95896,N=C(O)c1ccccc1.O>>N.O=C(O)c1ccccc1,6.7,1.017575917281425e-14,70.0,5.0,3.5.1.4,2287.0,0.8260748027008264,N=C(O)c1ccccc1.O,N.O=C(O)c1ccccc1,3.076276255404218,N=C(O)c1ccccc1.O__MGIKLPTLEDLREISKQFNLDLEDEELKSFLQLLKLQLESYERLDSLPDYTPRVKYQRTLGRPPMKEENPYGALVWITSIKGKEEGKLKGKRICIKDNVMIAGIPMLNGSKMLEGFVPHMDATVVSRILDEAGEIVAKTTCEDLCFSGGSHTSYPWPVLNPRNPEYMAGGSSSGSAVAVASGYCDMAVGGDQGGSIRIPSSWVGIYGLKPTHGLVPYTGAFSIEPTLDHLGPMANTVKDVALLLEVIAGRDELDSRQPDSLPPPPVKPYSKLIDGDVKDMKVGIVKEGFNWSNSEKDVDELVLDSAKKLEDYGIKVEDTSIPLHRMGLDIWTPIAIEGATATMILGSGVGWGRKGLFETQIADFFGNSLKSRARDLPNTVKGVLMLGYLMIKMYNNRYYAKARNLSIVLKEAYDSALRKYDALIMPTTPMKAMRYKSEPGFDEYFIMALGMINNTAPFDVTGHPAMNIPVGYSNGLPVGLMIIGRHFEEDKVLKLANVFERIKK,./data/raw/alphafold//AF-P95896-F1-model_v4.pdb,1085,655,336,378
+1350,10696,10851,MKYEKLLPRFLEYVKVNTRSDENSTTTPSTQALVEFAHKMGEDMKALGLKDVHYLESNGYVIGTIPANTDKKVRKIGLLAHLDTADFNAEGVNPQILENYDGESVIKLGDTEFTLDPKDFPNLKNYKGQTLVHTDGTTLLGSDDKSGVAEIMTLADYLLNINPDFEHGEIRVGFGPDEEIGVGADKFDVADFDVDFAYTVDGGPLGELQYETFSAAGAVIEFQGKNVHPGTAKNTMVNALQLAIDYHNALPEFDRPEKTEGREGFFHLLKLDGTPEEARAQYIIRDHEEGKFNERKALMQEIADKMNAELGQNRVKPVIKDQYYNMAQIIEKDMSIIDIAKKAMENLDIVPIIEPIRGGTDGSKISFMGLPTPNLFAGGENMHGRFEFVSVQTMEKAVDTLLEIIRLNNEVVK,sabio,Q76HM5,C[C@H](N)C(O)=NCC(O)=N[C@@H](C)C(=O)O.O>>CC(N)C(=O)O.CC(N=C(O)CN)C(=O)O,713.0,0.0,37.0,7.5,3.4.11.-,44688.0,2.8530895298518657,C[C@H](N)C(O)=NCC(O)=N[C@@H](C)C(=O)O.O,CC(N)C(=O)O.CC(N=C(O)CN)C(=O)O,2.8530895298518657,C[C@H](N)C(O)=NCC(O)=N[C@@H](C)C(=O)O.O__MKYEKLLPRFLEYVKVNTRSDENSTTTPSTQALVEFAHKMGEDMKALGLKDVHYLESNGYVIGTIPANTDKKVRKIGLLAHLDTADFNAEGVNPQILENYDGESVIKLGDTEFTLDPKDFPNLKNYKGQTLVHTDGTTLLGSDDKSGVAEIMTLADYLLNINPDFEHGEIRVGFGPDEEIGVGADKFDVADFDVDFAYTVDGGPLGELQYETFSAAGAVIEFQGKNVHPGTAKNTMVNALQLAIDYHNALPEFDRPEKTEGREGFFHLLKLDGTPEEARAQYIIRDHEEGKFNERKALMQEIADKMNAELGQNRVKPVIKDQYYNMAQIIEKDMSIIDIAKKAMENLDIVPIIEPIRGGTDGSKISFMGLPTPNLFAGGENMHGRFEFVSVQTMEKAVDTLLEIIRLNNEVVK,./data/raw/alphafold//AF-Q76HM5-F1-model_v4.pdb,1818,1497,3069,2077
+1351,2354,2387,MRTYNTTLASLECDDETLRAHLQGADIPTLLLTVAHLTGDLNVLKPAWKPVVAMGVAHSGMTPEVEAEVREDCLQKLLAFRDSGLPVPARPSSEQLHALGTWLMGPVIEPYLPLVAEELVTAEEDPRAPRWHKDHVAAGREFKVVIIGAGVSGMIAALRFKQAGVPFVVYEKGTDVGGTWRENTYPGCRIDINSFFYSFSFARSTWDDCFAPGPQVFSYMQAVARDKGLYDHIQFNTEVTDAHWDEDRQRWQLLCRDSAGQTRVDSNVVVFAVGQLNRPMIPAIPGKETFQGPAFHSAQWDHNVDWSGKRVAVIGTGASAAQFIPQLAKTAADLKVFARTTNWLLPTPDLHEKISDSCKWLLANLPNYSLWYRATKVMPQSVGFLEDVVVDVDYPPTEVAVSARNDQLRRDICAWMEPQFADRPDLRNVLIPDSPVGSKRIIRDNGTWISTLKRDNVSMIRQPIEAIRPTGICCIDGTVHEFDLIVYGTGFHASKFLMPINITGRDGLALREVWKDDDARAYMGMTVPGFPNMFCMYGPNTGLVVYSTIIQFSEFTATYIVDAVRLLLEGGHQSMEIKAQVFESYNQRVDQANGLRAWGFSRVNSWYKNSKGRVTQNFPFNAVEFWHRTHEVQATDYCLS,brenda,B7T912,CC(=O)c1cccc([N+](=O)[O-])c1.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.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O,1.2,10.611940989249623,30.0,8.0,1.14.13.84,303.0,0.0791812460476248,CC(=O)c1cccc([N+](=O)[O-])c1.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.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O,0.0791812460476248,CC(=O)c1cccc([N+](=O)[O-])c1.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.[H+]__MRTYNTTLASLECDDETLRAHLQGADIPTLLLTVAHLTGDLNVLKPAWKPVVAMGVAHSGMTPEVEAEVREDCLQKLLAFRDSGLPVPARPSSEQLHALGTWLMGPVIEPYLPLVAEELVTAEEDPRAPRWHKDHVAAGREFKVVIIGAGVSGMIAALRFKQAGVPFVVYEKGTDVGGTWRENTYPGCRIDINSFFYSFSFARSTWDDCFAPGPQVFSYMQAVARDKGLYDHIQFNTEVTDAHWDEDRQRWQLLCRDSAGQTRVDSNVVVFAVGQLNRPMIPAIPGKETFQGPAFHSAQWDHNVDWSGKRVAVIGTGASAAQFIPQLAKTAADLKVFARTTNWLLPTPDLHEKISDSCKWLLANLPNYSLWYRATKVMPQSVGFLEDVVVDVDYPPTEVAVSARNDQLRRDICAWMEPQFADRPDLRNVLIPDSPVGSKRIIRDNGTWISTLKRDNVSMIRQPIEAIRPTGICCIDGTVHEFDLIVYGTGFHASKFLMPINITGRDGLALREVWKDDDARAYMGMTVPGFPNMFCMYGPNTGLVVYSTIIQFSEFTATYIVDAVRLLLEGGHQSMEIKAQVFESYNQRVDQANGLRAWGFSRVNSWYKNSKGRVTQNFPFNAVEFWHRTHEVQATDYCLS,./data/raw/alphafold//AF-B7T912-F1-model_v4.pdb,1369,868,664,953
+1352,9387,9529,MGSLAAEKTVTGWAARDASGHLTPYNYTLRKTGPEDVVVKVLYCGICHTDIHQAKNHLGASKYPMVPGHEVVGEVVEVGPEVTKYSAGDVVGVGVIVGCCRECHPCKANVEQYCNKRIWSYNDVYTDGRPTQGGFASAMVVDQKFVVKIPAGLAPEQAAPLLCAGLTVYSPLKHFGLMSPGLRGGVLGLGGVGHMGVKVAKSMGHHVTVISSSARKRGEAMDDLGADAYLVSSDAAAMAAAGDSLDYIIDTVPVHHPLEPYLALLKLDGKLILMGVINQPLSFISPMVMLGRKAITGSFIGSMAETEEVLNFCVDKGLTSQIEVVKMDYVNQALERLERNDVRYRFVVDVAGSNIDDADAPPA,brenda,Q6ZHS4,COc1cc(/C=C/C=O)ccc1O.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+]>>COc1cc(/C=C/CO)ccc1O.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)c1,30.13,6.1444373552412666e-15,30.0,6.3,1.1.1.195,39947.0,1.478999131673357,COc1cc(/C=C/C=O)ccc1O.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+],COc1cc(/C=C/CO)ccc1O.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)c1,1.478999131673357,COc1cc(/C=C/C=O)ccc1O.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+]__MGSLAAEKTVTGWAARDASGHLTPYNYTLRKTGPEDVVVKVLYCGICHTDIHQAKNHLGASKYPMVPGHEVVGEVVEVGPEVTKYSAGDVVGVGVIVGCCRECHPCKANVEQYCNKRIWSYNDVYTDGRPTQGGFASAMVVDQKFVVKIPAGLAPEQAAPLLCAGLTVYSPLKHFGLMSPGLRGGVLGLGGVGHMGVKVAKSMGHHVTVISSSARKRGEAMDDLGADAYLVSSDAAAMAAAGDSLDYIIDTVPVHHPLEPYLALLKLDGKLILMGVINQPLSFISPMVMLGRKAITGSFIGSMAETEEVLNFCVDKGLTSQIEVVKMDYVNQALERLERNDVRYRFVVDVAGSNIDDADAPPA,./data/raw/alphafold//AF-Q6ZHS4-F1-model_v4.pdb,3542,3485,1244,3177
+1353,10383,10535,MTEFELPPKYITAANDLRSDTFTTPTAEMMEAALEASIGDAVYGEDVDTVRLEQTVARMAGKEAGLFCVSGTLSNQIAIRTHLMQPPYSILCDYRAHVYTHEAAGLAILSQAMVVPVVPSNGDYLTLEDIKSHYVPDDGDIHGAPTRLISLENTLHGIVYPLEELVRIKAWCMENGLKLHCDGARIWNAAAQSGVPLKQYGEIFDSISICLSKSMGAPIGSVLVGNLKFVKKATHFRKQQGGGIRQSGMMARMALVNINNDWKSQLLYSHSLAHELAEYCEAKGIPLESPADTNFVFINLKAARMDPDVLVKKGLKYNVKLMGGRVSFHYQVTRDTLEKVKLAISEAFDYAKEHPFDCNGPTQIYRSESTEVDVDGNAIREIKTYKY,brenda,P37303,C[C@@H](O)[C@H](N)C(=O)O>>CC=O.NCC(=O)O,43.0,0.0,30.0,8.0,4.1.2.48,4932.0,1.6334684555795866,C[C@@H](O)[C@H](N)C(=O)O,CC=O.NCC(=O)O,1.6334684555795866,C[C@@H](O)[C@H](N)C(=O)O__MTEFELPPKYITAANDLRSDTFTTPTAEMMEAALEASIGDAVYGEDVDTVRLEQTVARMAGKEAGLFCVSGTLSNQIAIRTHLMQPPYSILCDYRAHVYTHEAAGLAILSQAMVVPVVPSNGDYLTLEDIKSHYVPDDGDIHGAPTRLISLENTLHGIVYPLEELVRIKAWCMENGLKLHCDGARIWNAAAQSGVPLKQYGEIFDSISICLSKSMGAPIGSVLVGNLKFVKKATHFRKQQGGGIRQSGMMARMALVNINNDWKSQLLYSHSLAHELAEYCEAKGIPLESPADTNFVFINLKAARMDPDVLVKKGLKYNVKLMGGRVSFHYQVTRDTLEKVKLAISEAFDYAKEHPFDCNGPTQIYRSESTEVDVDGNAIREIKTYKY,./data/raw/alphafold//AF-P37303-F1-model_v4.pdb,3657,3651,1446,3409
+1354,11277,11433,MANAITFFKLNTGAKFPSVGLGTWQASPGLVGDAVAAAVKIGYRHIDCAQIYGNEKEIGAVLKKLFEDRVVKREDLFITSKLWCTDHDPQDVPEALNRTLKDLQLEYVDLYLIHWPARIKKGSVGIKPENLLPVDIPSTWKAMEALYDSGKARAIGVSNFSTKKLADLLELARVPPAVNQVECHPSWRQTKLQEFCKSKGVHLSAYSPLGSPGTTWLKSDVLKNPILNMVAEKLGKSPAQVALRWGLQMGHSVLPKSTNEGRIKENFNVFDWSIPDYMFAKFAEIEQARLVTGSFLVHETLSPYKSIEELWDGEI,sabio,Q0PGJ6,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.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]>>C[C@]12CC[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)CC[C@@H]12.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,21.6,0.0,25.0,7.0,1.1.1.-,3702.0,1.334453751150931,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.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],C[C@]12CC[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)CC[C@@H]12.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,1.334453751150931,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.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]__MANAITFFKLNTGAKFPSVGLGTWQASPGLVGDAVAAAVKIGYRHIDCAQIYGNEKEIGAVLKKLFEDRVVKREDLFITSKLWCTDHDPQDVPEALNRTLKDLQLEYVDLYLIHWPARIKKGSVGIKPENLLPVDIPSTWKAMEALYDSGKARAIGVSNFSTKKLADLLELARVPPAVNQVECHPSWRQTKLQEFCKSKGVHLSAYSPLGSPGTTWLKSDVLKNPILNMVAEKLGKSPAQVALRWGLQMGHSVLPKSTNEGRIKENFNVFDWSIPDYMFAKFAEIEQARLVTGSFLVHETLSPYKSIEELWDGEI,./data/raw/alphafold//AF-Q0PGJ6-F1-model_v4.pdb,1329,3901,224,242
+1355,3134,3176,MSIEKLKAALPEYAKDIKLNLSSITRSSVLDQEQLWGTLLASAAATRNPQVLADIGAEATDHLSAAARHAALGAAAIMGMNNVFYRGRGFLEGRYDDLRPGLRMNIIANPGIPKANFELWSFAVSAINGCSHCLVAHEHTLRTVGVDREAIFEALKAAAIVSGVAQALATIEALSPS,brenda,P9WQB5,CC(C)(OO)c1ccccc1>>CC(C)(O)c1ccccc1.O,0.067,0.6558187650047886,25.0,7.0,1.11.1.28,1773.0,-1.1739251972991736,CC(C)(OO)c1ccccc1,CC(C)(O)c1ccccc1.O,-1.1739251972991736,CC(C)(OO)c1ccccc1__MSIEKLKAALPEYAKDIKLNLSSITRSSVLDQEQLWGTLLASAAATRNPQVLADIGAEATDHLSAAARHAALGAAAIMGMNNVFYRGRGFLEGRYDDLRPGLRMNIIANPGIPKANFELWSFAVSAINGCSHCLVAHEHTLRTVGVDREAIFEALKAAAIVSGVAQALATIEALSPS,./data/raw/alphafold//AF-P9WQB5-F1-model_v4.pdb,1179,793,496,566
+1356,17781,18024,MAPSQRPLSRRGLLAGGAIAAAAGALAACSEERAAGARPSATQTTGTATEPFHGPHQAGIATPPQAHAVFLGLDLRKGTGRKELGRLMRLLTDDARRLTQGRPALADPEPDLAPLPSRLTFTFGFGPGLFKAAGLEKQRPEGLRPLPPFKVDRLEDRWSGGDLLVQICCDDPITLAHALRMTVKDARAFTRVRWVQRGFRRSPGVQSSGATQRNLMGQLDGTVNPVPGTADFDQAVWVQDGPEWLRGGTTLVLRRIRMELEKWDEADPAGKEFAVGRRLTSGAPLTGRHEHDEPDFDAVDSAGFPVIAENAHIRLAHVDSPRLRMLRRPYNYDEGLTADGRSDAGLLFAAYQADIDRQFIPVQRRLDEGGDLLNLWTTPIGSAVFAIPPGCDENGWIGQGLLG,brenda,D1A807,Nc1c(S(=O)(=O)[O-])cc(Nc2cccc(S(=O)(=O)CCOS(=O)(=O)[O-])c2)c2c1C(=O)c1ccccc1C2=O.OO.[Na+].[Na+]>>O,41.0,94.55107028869176,22.0,3.0,1.11.1.19,2020.0,1.6127838567197357,Nc1c(S(=O)(=O)[O-])cc(Nc2cccc(S(=O)(=O)CCOS(=O)(=O)[O-])c2)c2c1C(=O)c1ccccc1C2=O.OO.[Na+].[Na+],O,1.6127838567197357,Nc1c(S(=O)(=O)[O-])cc(Nc2cccc(S(=O)(=O)CCOS(=O)(=O)[O-])c2)c2c1C(=O)c1ccccc1C2=O.OO.[Na+].[Na+]__MAPSQRPLSRRGLLAGGAIAAAAGALAACSEERAAGARPSATQTTGTATEPFHGPHQAGIATPPQAHAVFLGLDLRKGTGRKELGRLMRLLTDDARRLTQGRPALADPEPDLAPLPSRLTFTFGFGPGLFKAAGLEKQRPEGLRPLPPFKVDRLEDRWSGGDLLVQICCDDPITLAHALRMTVKDARAFTRVRWVQRGFRRSPGVQSSGATQRNLMGQLDGTVNPVPGTADFDQAVWVQDGPEWLRGGTTLVLRRIRMELEKWDEADPAGKEFAVGRRLTSGAPLTGRHEHDEPDFDAVDSAGFPVIAENAHIRLAHVDSPRLRMLRRPYNYDEGLTADGRSDAGLLFAAYQADIDRQFIPVQRRLDEGGDLLNLWTTPIGSAVFAIPPGCDENGWIGQGLLG,./data/raw/alphafold//AF-D1A807-F1-model_v4.pdb,3428,2329,1048,2949
+1357,14493,14696,MNVDALTGGFDRRDWQEQTATDNPVRFAMIGVGWWTTEQAMPAVDAGDLCETTVLVSSDREKAADVAADSETVEHAITYEEFHDGAASDAYDAVYIVTPNALHLPYVETAAELDKAILCEKPMEATIERAERMVEVCDEHDATLMIAYRMHTEPAVRRAKDLIDEGYIGEPLFVHGNMTEPILELVPDPDQWRLDGELSGGCAVMDIGIYPLNTSRFLLDADPVAVRGTVASVQEEFADVPDEHGAFQLDFPGHVYAVCTASQNAHLDSHISVLGTEGKVRVEPAFYPWDDRALQLSHEGTTVEIDFEQIDQMEEEFEYFAHCLLTDTEPYADGEHGLVDINTIKSVYEASETESTVRLD,brenda,Q5UY95,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.OC[C@H]1OC(O)[C@H](O)[C@@H]1O>>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=C1OC(CO)C(O)C1O.[H+],360.0,6.350886474208392e-15,37.0,8.3,1.1.1.179,2238.0,2.556302500767288,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.OC[C@H]1OC(O)[C@H](O)[C@@H]1O,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=C1OC(CO)C(O)C1O.[H+],2.556302500767288,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.OC[C@H]1OC(O)[C@H](O)[C@@H]1O__MNVDALTGGFDRRDWQEQTATDNPVRFAMIGVGWWTTEQAMPAVDAGDLCETTVLVSSDREKAADVAADSETVEHAITYEEFHDGAASDAYDAVYIVTPNALHLPYVETAAELDKAILCEKPMEATIERAERMVEVCDEHDATLMIAYRMHTEPAVRRAKDLIDEGYIGEPLFVHGNMTEPILELVPDPDQWRLDGELSGGCAVMDIGIYPLNTSRFLLDADPVAVRGTVASVQEEFADVPDEHGAFQLDFPGHVYAVCTASQNAHLDSHISVLGTEGKVRVEPAFYPWDDRALQLSHEGTTVEIDFEQIDQMEEEFEYFAHCLLTDTEPYADGEHGLVDINTIKSVYEASETESTVRLD,./data/raw/alphafold//AF-Q5UY95-F1-model_v4.pdb,2353,4720,4765,4603
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+1362,725,745,MASLQCSFHFLGTNPKKYNPSSIFQSYSRTSFTKLSSRVSRQRFLRCTLSMNGCEADHKAPLGTVETRTLSTVPSPAAATERLITAVSDLKSQPPPFSSGIVRLQVPIEQKIGAIDWLHAQNEILPRSFFSRRSDSGRPDLLQDFSSDNGSSDHNPVSVAGIGSAVFFRDLDPFSHDDWRSIRRFLSSKSPLIRAYGGLRFDPTGKIAVEWEHFGSFYFTVPQVEFDEFGGSSMLAATVAWDNELSWTLENAIEALQETMLQVSSVIMRLRRESLGVIVVSKNHVPSEGAYYPAVNNALEIIKDKHSPLSKVVLARSSRIITDTDIDPIAWLARLQCEGQDAYQFCLQPPGAPAFIGNTPERLFHRKHLGVCSEALAATRPRGDSKVREMEIERDLLTSPKDDLEFSIVRENIREKLKTICDRVVVKPHKSVRKLARVQHLYSQLAGQLKREDDEFNILTALHPTPAVCGCPVEEARLLIKQIESFDRGMYAGPIGFFGGGESEFSVGIRSALVEKGLGALIYAGTGIVSGSNPSSEWNELELKISQFTKSLEHESALQPIN,brenda,Q9M9V6,C=C(O[C@@H]1C=C(C(=O)O)C=C[C@H]1O)C(=O)O>>C=C(O[C@H]1C=CC=C(C(=O)O)[C@@H]1O)C(=O)O,17.0,0.0,33.0,7.0,5.4.4.2,3702.0,1.230448921378274,C=C(O[C@@H]1C=C(C(=O)O)C=C[C@H]1O)C(=O)O,C=C(O[C@H]1C=CC=C(C(=O)O)[C@@H]1O)C(=O)O,1.230448921378274,C=C(O[C@@H]1C=C(C(=O)O)C=C[C@H]1O)C(=O)O__MASLQCSFHFLGTNPKKYNPSSIFQSYSRTSFTKLSSRVSRQRFLRCTLSMNGCEADHKAPLGTVETRTLSTVPSPAAATERLITAVSDLKSQPPPFSSGIVRLQVPIEQKIGAIDWLHAQNEILPRSFFSRRSDSGRPDLLQDFSSDNGSSDHNPVSVAGIGSAVFFRDLDPFSHDDWRSIRRFLSSKSPLIRAYGGLRFDPTGKIAVEWEHFGSFYFTVPQVEFDEFGGSSMLAATVAWDNELSWTLENAIEALQETMLQVSSVIMRLRRESLGVIVVSKNHVPSEGAYYPAVNNALEIIKDKHSPLSKVVLARSSRIITDTDIDPIAWLARLQCEGQDAYQFCLQPPGAPAFIGNTPERLFHRKHLGVCSEALAATRPRGDSKVREMEIERDLLTSPKDDLEFSIVRENIREKLKTICDRVVVKPHKSVRKLARVQHLYSQLAGQLKREDDEFNILTALHPTPAVCGCPVEEARLLIKQIESFDRGMYAGPIGFFGGGESEFSVGIRSALVEKGLGALIYAGTGIVSGSNPSSEWNELELKISQFTKSLEHESALQPIN,./data/raw/alphafold//AF-Q9M9V6-F1-model_v4.pdb,1155,762,460,527
+1363,21287,21611,MRSIKTVHVISAHAEGEVGDVIVGGVKPPPGETIWEQSRFIARDETLRNFVLNEPRGGVFRHVNLLVPPKHPDADAAFIIMEPEDTPPMSGSNSICVSTVLLDGGIVPMQEPETHMLLEAPGGLVKVRAECRNGKAERIFVQNLPSFAAKLDAELEVEGLGKLKVDTAYGGDSFVIVDAEAMGFSLKPEEAHEIARLGVRITNAANKALGFDHPENPDWRHFSFCLFAGKVERTAEGLRAGAAVAIQPGKVDRSPTGTALSARMAVLHARGEMKEGETLTAVSLIGSTFTGRILGTTTVGDRPAILPEISGRGWITGIHQHMLDPSDPWPEGYRLTDTWGAR,sabio,A9CH01,O=C(O)C1NCCC1O>>O.O=C(O)C1=NCCC1,27.0,1.0795978694382026e-14,25.0,8.0,4.2.1.77,358.0,1.4313637641589874,O=C(O)C1NCCC1O,O.O=C(O)C1=NCCC1,1.4313637641589874,O=C(O)C1NCCC1O__MRSIKTVHVISAHAEGEVGDVIVGGVKPPPGETIWEQSRFIARDETLRNFVLNEPRGGVFRHVNLLVPPKHPDADAAFIIMEPEDTPPMSGSNSICVSTVLLDGGIVPMQEPETHMLLEAPGGLVKVRAECRNGKAERIFVQNLPSFAAKLDAELEVEGLGKLKVDTAYGGDSFVIVDAEAMGFSLKPEEAHEIARLGVRITNAANKALGFDHPENPDWRHFSFCLFAGKVERTAEGLRAGAAVAIQPGKVDRSPTGTALSARMAVLHARGEMKEGETLTAVSLIGSTFTGRILGTTTVGDRPAILPEISGRGWITGIHQHMLDPSDPWPEGYRLTDTWGAR,./data/raw/alphafold//AF-A9CH01-F1-model_v4.pdb,619,3358,5677,6572
+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
+1371,3518,3567,MAAAALGQIWARKLLSVPWLLCGPRRYASSSFKAADLQLEMTQKPHKKPGPGEPLVFGKTFTDHMLMVEWNDKGWGQPRIQPFQNLTLHPASSSLHYSLQLFEGMKAFKGKDQQVRLFRPWLNMDRMLRSAMRLCLPSFDKLELLECIRRLIEVDKDWVPDAAGTSLYVRPVLIGNEPSLGVSQPTRALLFVILCPVGAYFPGGSVTPVSLLADPAFIRAWVGGVGNYKLGGNYGPTVLVQQEALKRGCEQVLWLYGPDHQLTEVGTMNIFVYWTHEDGVLELVTPPLNGVILPGVVRQSLLDMAQTWGEFRVVERTITMKQLLRALEEGRVREVFGSGTACQVCPVHRILYKDRNLHIPTMENGPELILRFQKELKEIQYGIRAHEWMFPV,sabio,O15382,CC(C)C(=O)C(=O)O.CCC(C)C(N)C(=O)O>>CC(C)C(N)C(=O)O.CCC(C)C(=O)C(=O)O,230.0,0.0,37.0,7.8,2.6.1.42,9606.0,2.361727836017593,CC(C)C(=O)C(=O)O.CCC(C)C(N)C(=O)O,CC(C)C(N)C(=O)O.CCC(C)C(=O)C(=O)O,2.361727836017593,CC(C)C(=O)C(=O)O.CCC(C)C(N)C(=O)O__MAAAALGQIWARKLLSVPWLLCGPRRYASSSFKAADLQLEMTQKPHKKPGPGEPLVFGKTFTDHMLMVEWNDKGWGQPRIQPFQNLTLHPASSSLHYSLQLFEGMKAFKGKDQQVRLFRPWLNMDRMLRSAMRLCLPSFDKLELLECIRRLIEVDKDWVPDAAGTSLYVRPVLIGNEPSLGVSQPTRALLFVILCPVGAYFPGGSVTPVSLLADPAFIRAWVGGVGNYKLGGNYGPTVLVQQEALKRGCEQVLWLYGPDHQLTEVGTMNIFVYWTHEDGVLELVTPPLNGVILPGVVRQSLLDMAQTWGEFRVVERTITMKQLLRALEEGRVREVFGSGTACQVCPVHRILYKDRNLHIPTMENGPELILRFQKELKEIQYGIRAHEWMFPV,./data/raw/alphafold//AF-O15382-F1-model_v4.pdb,1789,1460,3026,1774
+1372,3810,3861,MRPNRFSLRRSPTAVAAVALAAVLAAGAPAAQAAGAAAPTAAAAAAPDIPLANVKAHLTQLSTIAANNGGNRAHGRPGYKASVDYVKAKLDAAGYTTTLQQFTSGGATGYNLIADWPGGDPNKVLMAGAHLDSVSSGAGINDNGSGSAAVLETALAVSRAGYQPDKHLRFAWWGAEELGLIGSKYYVNNLPSADRSKLAGYLNFDMIGSPNPGYFVYDDDPVIEKTFKDYFAGLNVPTEIETEGDGRSDHAPFKNVGVPVGGLFTGAGYTKSAAQAQKWGGTAGQAFDRCYHSSCDSLSNINDTALDRNSDAAAHAIWTLSSGTGEPPTGEGVFSNTTDVAIPDAGAAVTSSVAVTGRTGNAPAALQVGVDIKHTYRGDLVVDLLAPDGTAYRLKNSSSGDSADNVIATYTVNASSEVANGSWKLRVQDIARQDTGYIDSWKLTF,brenda,P80561,CC(C)C[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>CC(C)C[C@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,657.0,1.0534323234681862e-14,30.0,8.0,3.4.11.24,1911.0,2.8175653695597807,CC(C)C[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,CC(C)C[C@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,2.8175653695597807,CC(C)C[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MRPNRFSLRRSPTAVAAVALAAVLAAGAPAAQAAGAAAPTAAAAAAPDIPLANVKAHLTQLSTIAANNGGNRAHGRPGYKASVDYVKAKLDAAGYTTTLQQFTSGGATGYNLIADWPGGDPNKVLMAGAHLDSVSSGAGINDNGSGSAAVLETALAVSRAGYQPDKHLRFAWWGAEELGLIGSKYYVNNLPSADRSKLAGYLNFDMIGSPNPGYFVYDDDPVIEKTFKDYFAGLNVPTEIETEGDGRSDHAPFKNVGVPVGGLFTGAGYTKSAAQAQKWGGTAGQAFDRCYHSSCDSLSNINDTALDRNSDAAAHAIWTLSSGTGEPPTGEGVFSNTTDVAIPDAGAAVTSSVAVTGRTGNAPAALQVGVDIKHTYRGDLVVDLLAPDGTAYRLKNSSSGDSADNVIATYTVNASSEVANGSWKLRVQDIARQDTGYIDSWKLTF,./data/raw/alphafold//AF-P80561-F1-model_v4.pdb,1815,1493,3064,1817
+1373,14776,14985,MPIPNNPGAGENAFDPVFVNDDDGYDLDSFMIPAHYKKYLTKVLVPNGVIKNRIEKLAYDIKKVYNNEEFHILCLLKGSRGFFTALLKHLSRIHNYSAVETSKPLFGEHYVRVKSYCNDQSTGTLEIVSEDLSCLKGKHVLIVEDIIDTGKTLVKFCEYLKKFEIKTVAIACLFIKRTPLWNGFKADFVGFSIPDHFVVGYSLDYNEIFRDLDHCCLVNDEGKKKYKATSL,brenda,P20035,N=c1nc(O)c2nc[nH]c2[nH]1.O=P(O)(O)OC[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1O>>N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.O=P(O)(O)OP(=O)(O)O,0.3,0.0,23.0,7.4,2.4.2.8,5833.0,-0.5228787452803376,N=c1nc(O)c2nc[nH]c2[nH]1.O=P(O)(O)OC[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1O,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.O=P(O)(O)OP(=O)(O)O,-0.3979400086720376,N=c1nc(O)c2nc[nH]c2[nH]1.O=P(O)(O)OC[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1O__MPIPNNPGAGENAFDPVFVNDDDGYDLDSFMIPAHYKKYLTKVLVPNGVIKNRIEKLAYDIKKVYNNEEFHILCLLKGSRGFFTALLKHLSRIHNYSAVETSKPLFGEHYVRVKSYCNDQSTGTLEIVSEDLSCLKGKHVLIVEDIIDTGKTLVKFCEYLKKFEIKTVAIACLFIKRTPLWNGFKADFVGFSIPDHFVVGYSLDYNEIFRDLDHCCLVNDEGKKKYKATSL,./data/raw/alphafold//AF-P20035-F1-model_v4.pdb,2463,4889,4959,4813
+1374,13019,13193,MFKKILIANRGEIAARVIKTARKMGIATVAVHSEADRFTLPVLAADEAICLGPAPAKESYLRAEAIVQACIDTGAEAVHPGYGFLSENAGFAEALAAKGIRFIGPRPEHLRDFGLKHTARALAEAAGVPLLPGTGILLSAEEALAAAHEIGYPVMLKSTAGGGGIGMSLCHDASELQARFEAVQRMASSSFGDARVYIERFVSTARHVEVQIFGDGKGNVVALGERDCSLQRRNQKVVEETPAPGLSPELRARLHAAAVALGKAVAYESAGTVEFIYDVARGDFSFLEVNTRLQVEHPVTESVFGVDLVEWMIRQAAGELLLPAQGSLVPRGAAIEVRLYAENPQANFRPQTGRLTEVAFPDDIRVDTWVATGTEVTPFYDPMLAKVIVTGADRPAAIAALSDALAKTKVWGIETNLAYLRAIAASDVFTSGAVSTAALGQFVFTAPTIEVIVAGAQTSVQDWPGRLGLWDVGVPPSGPFDDRSFRLANRILGNAEGAAGLECTLSGPTLKFHGDALIALAGAEMPAALDGVAVPMLTAIPVKAGQTLSLGQIKGAGQRTYLAVRGGIDGPKFLGARACFSLGQFGGHATGVLKAGDTLHIAAETAGEPMPADEKPLITRDWVIGVHYGPHGAPDFFQDADIDDLFAATYEVHFNSARTGVRLIGPKPRWARADGGEAGLHPSNIHDNAYAIGAIDFTGDMPIILGPDGPSLGGFVCPAVIARDELWKAGQLKPGDKVRFVPHGMAAPQVITSKDIGTPILGTIDGGPVPVVYRRAGDDYLLVEYGPMVLDIALRLRIHLLAQAVREARLPAIIDLTPGIRSLQIHYDSRVLKTATLVAALREIEAGLPPAEAVKVPSRIVHLPLSWNDPSIQLAARKYQELVRPNAPWCPSNIEFIRRINGLGSVDDVQNIIFDASYLVLGLGDVYLGAPVATPVDPRHRLVTTKYNPARTWTPENAVGIGGAYMCIYGMEGPGGYQLFGRTVQMWNAWRTTPVFTPGHPWLLRFFDQIRFFPVSEQELIEAREAFPHGRYPVRIEETTFDYAQHAAFLAAERPAIEAAKARQQTAFEVERQDWKARGLDSFVVEDGPAASDADVPEGQTPVEAQVTGNVWKIIAEEGTNVAAGDIVVIVESMKMEMEIRSPVAGKVTALRCQPGRTVQAGQIVALIEAA,brenda,Q75RY4,N=C(N)O.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-])O.[H+]>>N=C(O)NC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,44.2,9.026174786793747e-15,30.0,7.5,6.3.4.6,89018.0,1.645422269349092,N=C(N)O.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-])O.[H+],N=C(O)NC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,1.645422269349092,N=C(N)O.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-])O.[H+]__MFKKILIANRGEIAARVIKTARKMGIATVAVHSEADRFTLPVLAADEAICLGPAPAKESYLRAEAIVQACIDTGAEAVHPGYGFLSENAGFAEALAAKGIRFIGPRPEHLRDFGLKHTARALAEAAGVPLLPGTGILLSAEEALAAAHEIGYPVMLKSTAGGGGIGMSLCHDASELQARFEAVQRMASSSFGDARVYIERFVSTARHVEVQIFGDGKGNVVALGERDCSLQRRNQKVVEETPAPGLSPELRARLHAAAVALGKAVAYESAGTVEFIYDVARGDFSFLEVNTRLQVEHPVTESVFGVDLVEWMIRQAAGELLLPAQGSLVPRGAAIEVRLYAENPQANFRPQTGRLTEVAFPDDIRVDTWVATGTEVTPFYDPMLAKVIVTGADRPAAIAALSDALAKTKVWGIETNLAYLRAIAASDVFTSGAVSTAALGQFVFTAPTIEVIVAGAQTSVQDWPGRLGLWDVGVPPSGPFDDRSFRLANRILGNAEGAAGLECTLSGPTLKFHGDALIALAGAEMPAALDGVAVPMLTAIPVKAGQTLSLGQIKGAGQRTYLAVRGGIDGPKFLGARACFSLGQFGGHATGVLKAGDTLHIAAETAGEPMPADEKPLITRDWVIGVHYGPHGAPDFFQDADIDDLFAATYEVHFNSARTGVRLIGPKPRWARADGGEAGLHPSNIHDNAYAIGAIDFTGDMPIILGPDGPSLGGFVCPAVIARDELWKAGQLKPGDKVRFVPHGMAAPQVITSKDIGTPILGTIDGGPVPVVYRRAGDDYLLVEYGPMVLDIALRLRIHLLAQAVREARLPAIIDLTPGIRSLQIHYDSRVLKTATLVAALREIEAGLPPAEAVKVPSRIVHLPLSWNDPSIQLAARKYQELVRPNAPWCPSNIEFIRRINGLGSVDDVQNIIFDASYLVLGLGDVYLGAPVATPVDPRHRLVTTKYNPARTWTPENAVGIGGAYMCIYGMEGPGGYQLFGRTVQMWNAWRTTPVFTPGHPWLLRFFDQIRFFPVSEQELIEAREAFPHGRYPVRIEETTFDYAQHAAFLAAERPAIEAAKARQQTAFEVERQDWKARGLDSFVVEDGPAASDADVPEGQTPVEAQVTGNVWKIIAEEGTNVAAGDIVVIVESMKMEMEIRSPVAGKVTALRCQPGRTVQAGQIVALIEAA,./data/raw/alphafold//AF-Q75RY4-F1-model_v4.pdb,1245,3062,599,686
+1375,15137,15349,MSASIPDIKLSSGHLMPSIGFGCWKLANATAGEQVYQAIKAGYRLFDGAEDYGNEKEVGDGVKRAIDEGLVKREEIFLTSKLWNNYHDPKNVETALNKTLADLKVDYVDLFLIHFPIAFKFVPIEEKYPPGFYCGDGNNFVYEDVPILETWKALEKLVAAGKIKSIGVSNFPGALLLDLLRGATIKPAVLQVEHHPYLQQPKLIEFAQKAGVTITAYSSFGPQSFVEMNQGRALNTPTLFAHDTIKAIAAKYNKTPAEVLLRWAAQRGIAVIPKSNLPERLVQNRSFNTFDLTKEDFEEIAKLDIGLRFNDPWDWDNIPIFV,sabio,O74237,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=Cc1cccc(F)c1.[H]>>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.OCc1cccc(F)c1,19.3,0.0,25.0,7.0,1.1.1.21,45596.0,1.285557309007774,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=Cc1cccc(F)c1.[H],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.OCc1cccc(F)c1,1.285557309007774,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=Cc1cccc(F)c1.[H]__MSASIPDIKLSSGHLMPSIGFGCWKLANATAGEQVYQAIKAGYRLFDGAEDYGNEKEVGDGVKRAIDEGLVKREEIFLTSKLWNNYHDPKNVETALNKTLADLKVDYVDLFLIHFPIAFKFVPIEEKYPPGFYCGDGNNFVYEDVPILETWKALEKLVAAGKIKSIGVSNFPGALLLDLLRGATIKPAVLQVEHHPYLQQPKLIEFAQKAGVTITAYSSFGPQSFVEMNQGRALNTPTLFAHDTIKAIAAKYNKTPAEVLLRWAAQRGIAVIPKSNLPERLVQNRSFNTFDLTKEDFEEIAKLDIGLRFNDPWDWDNIPIFV,./data/raw/alphafold//AF-O74237-F1-model_v4.pdb,1329,4592,6223,889
+1376,15122,15334,MKVGFIGLGIMGKPMSKNLLKAGYSLVVADRNPEAIADVIAAGAETASTAKAIAEQCDVIITMLPNSPHVKEVALGENGIIEGAKPGTVLIDMSSIAPLASREISEALKAKGIDMLDAPVSGGEPKAIDGTLSVMVGGDKAIFDKYYDLMKAMAGSVVHTGEIGAGNVTKLANQVIVALNIAAMSEALTLATKAGVNPDLVYQAIRGGLAGSTVLDAKAPMVMDRNFKPGFRIDLHIKDLANALDTSHGVGAQLPLTAAVMEMMQALRADGLGTADHSALACYYEKLAKVEVTR,sabio,P0ABQ2,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=CC(O)C(=O)O.[H]>>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.O=C(O)C(O)CO,23.0,7.372543836476332e-15,22.0,7.5,1.1.1.60,562.0,1.3617278360175928,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=CC(O)C(=O)O.[H],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.O=C(O)C(O)CO,1.3617278360175928,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=CC(O)C(=O)O.[H]__MKVGFIGLGIMGKPMSKNLLKAGYSLVVADRNPEAIADVIAAGAETASTAKAIAEQCDVIITMLPNSPHVKEVALGENGIIEGAKPGTVLIDMSSIAPLASREISEALKAKGIDMLDAPVSGGEPKAIDGTLSVMVGGDKAIFDKYYDLMKAMAGSVVHTGEIGAGNVTKLANQVIVALNIAAMSEALTLATKAGVNPDLVYQAIRGGLAGSTVLDAKAPMVMDRNFKPGFRIDLHIKDLANALDTSHGVGAQLPLTAAVMEMMQALRADGLGTADHSALACYYEKLAKVEVTR,./data/raw/alphafold//AF-P0ABQ2-F1-model_v4.pdb,2543,4992,2078,4938
+1377,395,411,MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,sabio,O94219,C/C=C/C=C/CO.O=O>>C/C=C/C=C/C=O.OO,119.0,0.0,24.0,6.0,1.1.3.7,5323.0,2.0755469613925306,C/C=C/C=C/CO.O=O,C/C=C/C=C/C=O.OO,2.0755469613925306,C/C=C/C=C/CO.O=O__MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,./data/raw/alphafold//AF-O94219-F1-model_v4.pdb,1050,3522,1297,300
+1378,19280,19566,MKNKLPPFIEIYRALIATPSISATEEALDQSNADLITLLADWFKDLGFNVEVQPVPGTRNKFNMLASIGQGAGGLLLAGHTDTVPFDDGRWTRDPFTLTEHDGKLYGLGTADMKGFFAFILDALRDVDVTKLKKPLYILATADEETSMAGARYFAETTALRPDCAIIGEPTSLQPVRAHKGHISNAIRIQGQSGHSSDPARGVNAIELMHDAIGHILQLRDNLKERYHYEAFTVPYPTLNLGHIHGGDASNRICACCELHMDIRPLPGMTLNELNGLLNDALAPVSERWPGRLTVDELHPPIPGYECPPNHQLVEVVEKLLGAKTEVVNYCTEAPFIQTLCPTLVLGPGSINQAHQPDEYLETRFIKPTRELITQVIHHFCWH,sabio,P23908,O.O=C(O)CNC(=O)CCl>>NCC(=O)O.O=C(O)CCl,130.0,1.6712360893783527e-14,25.0,7.0,3.5.1.16,562.0,2.113943352306837,O.O=C(O)CNC(=O)CCl,NCC(=O)O.O=C(O)CCl,2.113943352306837,O.O=C(O)CNC(=O)CCl__MKNKLPPFIEIYRALIATPSISATEEALDQSNADLITLLADWFKDLGFNVEVQPVPGTRNKFNMLASIGQGAGGLLLAGHTDTVPFDDGRWTRDPFTLTEHDGKLYGLGTADMKGFFAFILDALRDVDVTKLKKPLYILATADEETSMAGARYFAETTALRPDCAIIGEPTSLQPVRAHKGHISNAIRIQGQSGHSSDPARGVNAIELMHDAIGHILQLRDNLKERYHYEAFTVPYPTLNLGHIHGGDASNRICACCELHMDIRPLPGMTLNELNGLLNDALAPVSERWPGRLTVDELHPPIPGYECPPNHQLVEVVEKLLGAKTEVVNYCTEAPFIQTLCPTLVLGPGSINQAHQPDEYLETRFIKPTRELITQVIHHFCWH,./data/raw/alphafold//AF-P23908-F1-model_v4.pdb,1378,883,680,969
+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
+1382,10672,10827,MVVLVICGGGNGAHVLAGIASSNPNADVRVLTLYADEAERWTKAMEGNDFVVTVNNQDKSQTILKNKPRLVTKDPALAANKADMIVFTVPAFAHRQYLDALKPHIRPGTVLVGLPGQSGFEFEVWTAWGDLAKQCSIMSFESLPWACRFTEFGRAATVIGTKENLAGAAWYGSVPPKADPTLVLQGCLGPHPVLLTRGALLGITLMATNGYIHPSILFGRWHKWDGNPVNEPPLFYNGLDEFSAQTMSSVSDEILAVASSLMKQRPQVDLTNVAHIWQWYLRVYADDIGDKTSLFTTIRTNAAYSGLTHPTTKTDDGKFVPDFKHRYLMEDIPFGLLVSKGIAEVAGVPTPTIDSVISWAQQKMGKEYIVNGKLAGKDVSSTRCPQRYGLTTVDAILGL,brenda,A0A9I9,C[C@H](N)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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=CC(=O)O.[H+]>>C[C@H](NCC(=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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O,51.7,6.847919890036056e-15,30.0,7.2,1.5.1.22,167828.0,1.7134905430939424,C[C@H](N)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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=CC(=O)O.[H+],C[C@H](NCC(=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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O,1.7134905430939424,C[C@H](N)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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=CC(=O)O.[H+]__MVVLVICGGGNGAHVLAGIASSNPNADVRVLTLYADEAERWTKAMEGNDFVVTVNNQDKSQTILKNKPRLVTKDPALAANKADMIVFTVPAFAHRQYLDALKPHIRPGTVLVGLPGQSGFEFEVWTAWGDLAKQCSIMSFESLPWACRFTEFGRAATVIGTKENLAGAAWYGSVPPKADPTLVLQGCLGPHPVLLTRGALLGITLMATNGYIHPSILFGRWHKWDGNPVNEPPLFYNGLDEFSAQTMSSVSDEILAVASSLMKQRPQVDLTNVAHIWQWYLRVYADDIGDKTSLFTTIRTNAAYSGLTHPTTKTDDGKFVPDFKHRYLMEDIPFGLLVSKGIAEVAGVPTPTIDSVISWAQQKMGKEYIVNGKLAGKDVSSTRCPQRYGLTTVDAILGL,./data/raw/alphafold//AF-A0A9I9-F1-model_v4.pdb,1275,5229,1618,745
+1383,8948,9090,MWCIVLFSLLAWVYAEPTMYGEILSPNYPQAYPSEVEKSWDIEVPEGYGIHLYFTHLDIELSENCAYDSVQIISGDTEEGRLCGQRSSNNPHSPIVEEFQVPYNKLQVIFKSDFSNEERFTGFAAYYVATDINECTDFVDVPCSHFCNNFIGGYFCSCPPEYFLHDDMKNCGVNCSGDVFTALIGEIASPNYPKPYPENSRCEYQIRLEKGFQVVVTLRREDFDVEAADSAGNCLDSLVFVAGDRQFGPYCGHGFPGPLNIETKSNALDIIFQTDLTGQKKGWKLRYHGDPMPCPKEDTPNSVWEPAKAKYVFRDVVQITCLDGFEVVEGRVGATSFYSTCQSNGKWSNSKLKCQPVDCGIPESIENGKVEDPESTLFGSVIRYTCEEPYYYMENGGGGEYHCAGNGSWVNEVLGPELPKCVPVCGVPREPFEEKQRIIGGSDADIKNFPWQVFFDNPWAGGALINEYWVLTAAHVVEGNREPTMYVGSTSVQTSRLAKSKMLTPEHVFIHPGWKLLEVPEGRTNFDNDIALVRLKDPVKMGPTVSPICLPGTSSDYNLMDGDLGLISGWGRTEKRDRAVRLKAARLPVAPLRKCKEVKVEKPTADAEAYVFTPNMICAGGEKGMDSCKGDSGGAFAVQDPNDKTKFYAAGLVSWGPQCGTYGLYTRVKNYVDWIMKTMQENSTPRED,sabio,P09871,COC(=O)[C@H](CCCNC(=N)N)NS(=O)(=O)c1ccc(C)cc1.O>>CO.Cc1ccc(S(=O)(=O)N[C@@H](CCCN=C(N)N)C(=O)O)cc1,11.9,7.874445727332273e-15,30.0,7.5,3.4.21.42,9606.0,1.0755469613925308,COC(=O)[C@H](CCCNC(=N)N)NS(=O)(=O)c1ccc(C)cc1.O,CO.Cc1ccc(S(=O)(=O)N[C@@H](CCCN=C(N)N)C(=O)O)cc1,1.0755469613925308,COC(=O)[C@H](CCCNC(=N)N)NS(=O)(=O)c1ccc(C)cc1.O__MWCIVLFSLLAWVYAEPTMYGEILSPNYPQAYPSEVEKSWDIEVPEGYGIHLYFTHLDIELSENCAYDSVQIISGDTEEGRLCGQRSSNNPHSPIVEEFQVPYNKLQVIFKSDFSNEERFTGFAAYYVATDINECTDFVDVPCSHFCNNFIGGYFCSCPPEYFLHDDMKNCGVNCSGDVFTALIGEIASPNYPKPYPENSRCEYQIRLEKGFQVVVTLRREDFDVEAADSAGNCLDSLVFVAGDRQFGPYCGHGFPGPLNIETKSNALDIIFQTDLTGQKKGWKLRYHGDPMPCPKEDTPNSVWEPAKAKYVFRDVVQITCLDGFEVVEGRVGATSFYSTCQSNGKWSNSKLKCQPVDCGIPESIENGKVEDPESTLFGSVIRYTCEEPYYYMENGGGGEYHCAGNGSWVNEVLGPELPKCVPVCGVPREPFEEKQRIIGGSDADIKNFPWQVFFDNPWAGGALINEYWVLTAAHVVEGNREPTMYVGSTSVQTSRLAKSKMLTPEHVFIHPGWKLLEVPEGRTNFDNDIALVRLKDPVKMGPTVSPICLPGTSSDYNLMDGDLGLISGWGRTEKRDRAVRLKAARLPVAPLRKCKEVKVEKPTADAEAYVFTPNMICAGGEKGMDSCKGDSGGAFAVQDPNDKTKFYAAGLVSWGPQCGTYGLYTRVKNYVDWIMKTMQENSTPRED,./data/raw/alphafold//AF-P09871-F1-model_v4.pdb,1419,932,731,1026
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+1387,16668,16897,MFLLPLPAAARVAVRHLSVKRLWAPGPAAADMTKGLVLGIYSKEKEEDEPQFTSAGENFNKLVSGKLREILNISGPPLKAGKTRTFYGLHEDFPSVVVVGLGKKTAGIDEQENWHEGKENIRAAVAAGCRQIQDLEIPSVEVDPCGDAQAAAEGAVLGLYEYDDLKQKRKVVVSAKLHGSEDQEAWQRGVLFASGQNLARRLMETPANEMTPTKFAEIVEENLKSASIKTDVFIRPKSWIEEQEMGSFLSVAKGSEEPPVFLEIHYKGSPNASEPPLVFVGKGITFDSGGISIKAAANMDLMRADMGGAATICSAIVSAAKLDLPINIVGLAPLCENMPSGKANKPGDVVRARNGKTIQVDNTDAEGRLILADALCYAHTFNPKVIINAATLTGAMDIALGSGATGVFTNSSWLWNKLFEASIETGDRVWRMPLFEHYTRQVIDCQLADVNNIGKYRSAGACTAAAFLKEFVTHPKWAHLDIAGVMTNKDEVPYLRKGMAGRPTRTLIEFLFRFSQDSA,brenda,P00727,NCC(O)=NC(CO)C(=O)O.O>>NCC(=O)O.N[C@@H](CO)C(=O)O,42.0,0.0,25.0,8.3,3.4.11.1,9913.0,1.6232492903979006,NCC(O)=NC(CO)C(=O)O.O,NCC(=O)O.N[C@@H](CO)C(=O)O,1.6232492903979006,NCC(O)=NC(CO)C(=O)O.O__MFLLPLPAAARVAVRHLSVKRLWAPGPAAADMTKGLVLGIYSKEKEEDEPQFTSAGENFNKLVSGKLREILNISGPPLKAGKTRTFYGLHEDFPSVVVVGLGKKTAGIDEQENWHEGKENIRAAVAAGCRQIQDLEIPSVEVDPCGDAQAAAEGAVLGLYEYDDLKQKRKVVVSAKLHGSEDQEAWQRGVLFASGQNLARRLMETPANEMTPTKFAEIVEENLKSASIKTDVFIRPKSWIEEQEMGSFLSVAKGSEEPPVFLEIHYKGSPNASEPPLVFVGKGITFDSGGISIKAAANMDLMRADMGGAATICSAIVSAAKLDLPINIVGLAPLCENMPSGKANKPGDVVRARNGKTIQVDNTDAEGRLILADALCYAHTFNPKVIINAATLTGAMDIALGSGATGVFTNSSWLWNKLFEASIETGDRVWRMPLFEHYTRQVIDCQLADVNNIGKYRSAGACTAAAFLKEFVTHPKWAHLDIAGVMTNKDEVPYLRKGMAGRPTRTLIEFLFRFSQDSA,./data/raw/alphafold//AF-P00727-F1-model_v4.pdb,1854,1548,3130,1882
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+1395,6911,7027,MATGQKLMRAVRVFEFGGPEVLKLRSDIAVPIPKDHQVLIKVHACGVNPVETYIRSGTYSRKPLLPYTPGSDVAGVIEAVGDNASAFKKGDRVFTSSTISGGYAEYALAADHTVYKLPEKLDFKQGAAIGIPYFTAYRALIHSACVKAGESVLVHGASGGVGLAACQIARAYGLKILGTAGTEEGQKIVLQNGAHEVFNHREVNYIDKIKKYVGEKGIDIIIEMLANVNLSKDLSLLSHGGRVIVVGSRGTIEINPRDTMAKESSIIGVTLFSSTKEEFQQYAAALQAGMEIGWLKPVIGSQYPLEKVAEAHENIIHGSGATGKMILLL,brenda,Q08257,CCCCCC(O)/C=C/C=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>>CCCCCC(O)CCC=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)c1,1.15,0.0558353477633754,25.0,7.5,1.6.5.5,9606.0,0.0606978403536116,CCCCCC(O)/C=C/C=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,CCCCCC(O)CCC=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)c1,0.0606978403536116,CCCCCC(O)/C=C/C=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__MATGQKLMRAVRVFEFGGPEVLKLRSDIAVPIPKDHQVLIKVHACGVNPVETYIRSGTYSRKPLLPYTPGSDVAGVIEAVGDNASAFKKGDRVFTSSTISGGYAEYALAADHTVYKLPEKLDFKQGAAIGIPYFTAYRALIHSACVKAGESVLVHGASGGVGLAACQIARAYGLKILGTAGTEEGQKIVLQNGAHEVFNHREVNYIDKIKKYVGEKGIDIIIEMLANVNLSKDLSLLSHGGRVIVVGSRGTIEINPRDTMAKESSIIGVTLFSSTKEEFQQYAAALQAGMEIGWLKPVIGSQYPLEKVAEAHENIIHGSGATGKMILLL,./data/raw/alphafold//AF-Q08257-F1-model_v4.pdb,3166,1960,3604,297
+1396,16000,16227,MRVAVLSGAGISAESGVPTFRDDKNGLWARFDPYELSSTQGWLRNPERVWGWYLWRHYLVANVEPNDGHRAIAAWQDHAEVSVITQNVDDLHERAGSGAVHHLHGSLFEFRCARCGVPYTDALPEMPEPAIEVEPPVCDCGGLIRPDIVWFGEPLPEEPWRSAVEATGSADVMVVVGTSAIVYPAAGLPDLALARGTAVIEVNPEPTPLSGSATISIRESASQALPGLLERLPALLK,sabio,P9WGG3,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.O>>CC(=O)O[C@H]1C(O)O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@H]1O.NC(=O)c1cccnc1,0.02,2.9161972656874684,22.0,7.5,2.3.1.286,1773.0,-1.6989700043360187,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.O,CC(=O)O[C@H]1C(O)O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@H]1O.NC(=O)c1cccnc1,-1.6989700043360187,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.O__MRVAVLSGAGISAESGVPTFRDDKNGLWARFDPYELSSTQGWLRNPERVWGWYLWRHYLVANVEPNDGHRAIAAWQDHAEVSVITQNVDDLHERAGSGAVHHLHGSLFEFRCARCGVPYTDALPEMPEPAIEVEPPVCDCGGLIRPDIVWFGEPLPEEPWRSAVEATGSADVMVVVGTSAIVYPAAGLPDLALARGTAVIEVNPEPTPLSGSATISIRESASQALPGLLERLPALLK,./data/raw/alphafold//AF-P9WGG3-F1-model_v4.pdb,2606,5078,2189,5064
+1397,4346,4401,MQPPASAGLFRSPENLPWPYNYMDYLVAGFLVLTAGILLRPWLWLRLRNSKTKDGDEEEDNEEKKKGMIPNGSLGWPVIGETLNFIACGYSSRPVTFMDKRKSLYGKVFKTNIIGTPIIISTDAEVNKVVLQNHGNTFVPAYPKSITELLGENSILSINGPHQKRLHTLIGAFLRSPHLKDRITRDIEASVVLTLASWAQLPLVHVQDEIKKMTFEILVKVLMSTSPGEDMNILKLEFEEFIKGLICIPIKFPGTRLYKSLKAKERLIKMVKKVVEERQVAMTTTSPANDVVDVLLRDGGDSEKQSQPSDFVSGKIVEMMIPGEETMPTAMTLAVKFLSDNPVALAKLVEENMEMKRRKLELGEEYKWTDYMSLSFTQNVINETLRMANIINGVWRKALKDVEIKGYLIPKGWCVLASFISVHMDEDIYDNPYQFDPWRWDRINGSANSSICFTPFGGGQRLCPGLELSKLEISIFLHHLVTRYSWTAEEDEIVSFPTVKMKRRLPIRVATVDDSASPISLEDH,brenda,Q9M066,CC(C)[C@H](C)C[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.O=O>>CC(C)[C@H](C)[C@@H](O)[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.O,0.05,10000000.0,30.0,7.3,1.14.14.147,3702.0,-1.3010299956639813,CC(C)[C@H](C)C[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.O=O,CC(C)[C@H](C)[C@@H](O)[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.O,-1.3010299956639813,CC(C)[C@H](C)C[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.O=O__MQPPASAGLFRSPENLPWPYNYMDYLVAGFLVLTAGILLRPWLWLRLRNSKTKDGDEEEDNEEKKKGMIPNGSLGWPVIGETLNFIACGYSSRPVTFMDKRKSLYGKVFKTNIIGTPIIISTDAEVNKVVLQNHGNTFVPAYPKSITELLGENSILSINGPHQKRLHTLIGAFLRSPHLKDRITRDIEASVVLTLASWAQLPLVHVQDEIKKMTFEILVKVLMSTSPGEDMNILKLEFEEFIKGLICIPIKFPGTRLYKSLKAKERLIKMVKKVVEERQVAMTTTSPANDVVDVLLRDGGDSEKQSQPSDFVSGKIVEMMIPGEETMPTAMTLAVKFLSDNPVALAKLVEENMEMKRRKLELGEEYKWTDYMSLSFTQNVINETLRMANIINGVWRKALKDVEIKGYLIPKGWCVLASFISVHMDEDIYDNPYQFDPWRWDRINGSANSSICFTPFGGGQRLCPGLELSKLEISIFLHHLVTRYSWTAEEDEIVSFPTVKMKRRLPIRVATVDDSASPISLEDH,./data/raw/alphafold//AF-Q9M066-F1-model_v4.pdb,2905,1620,3219,1996
+1398,23084,23426,MLNETPALAPDGQPYRLLTLRNNAGMVVTLMDWGATLLSARIPLSDGSVREALLGCASPECYQDQAAFLGASIGRYANRIANSRYTFDGETVTLSPSQGVNQLHGGPEGFDKRRWQIVNQNDRQVLFALSSDDGDQGFPGNLGATVQYRLTDDNRISITYRATVDKPCPVNMTNHVYFNLDGEQSDVRNHKLQILADEYLPVDEGGIPHDGLKSVAGTSFDFRSAKIIASEFLADDDQRKVKGYDHAFLLQAKGDGKKVAAHVWSADEKLQLKVYTTAPALQFYSGNFLGGTPSRGTEPYADWQGLALESEFLPDSPNHPEWPQPDCFLRPGEEYSSLTEYQFIAE,brenda,P0A9C3,OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O>>OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O,19000.0,0.0,25.0,7.0,5.1.3.3,562.0,4.278753600952829,OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O,OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O,4.278753600952829,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,848,310,6074,7011
+1399,9161,9303,MAKLIALTLLGMGLALFRNHQSSYQTRLNALREVQPVELPNCNLVKGIETGSEDLEILPNGLAFISSGLKYPGIKSFNPNSPGKILLMDLNEEDPTVLELGITGSKFDVSSFNPHGISTFTDEDNAMYLLVVNHPDAKSTVELFKFQEEEKSLLHLKTIRHKLLPNLNDIVAVGPEHFYGTNDHYFLDPYLQSWEMYLGLAWSYVVYYSPSEVRVVAEGFDFANGINISPDGKYVYIAELLAHKIHVYEKHANWTLTPLKSLDFNTLVDNISVDPETGDLWVGCHPNGMKIFFYDSENPPASEVLRIQNILTEEPKVTQVYAENGTVLQGSTVASVYKGKLLIGTVFHKALYCEL,brenda,P27169,COP(=O)(OC)Oc1ccc([N+](=O)[O-])cc1.O>>COP(=O)(O)OC.O=[N+]([O-])c1ccc(O)cc1,0.9,1.0698608523140284e-14,25.0,8.0,3.1.8.1,9606.0,-0.0457574905606751,COP(=O)(OC)Oc1ccc([N+](=O)[O-])cc1.O,COP(=O)(O)OC.O=[N+]([O-])c1ccc(O)cc1,-0.0457574905606751,COP(=O)(OC)Oc1ccc([N+](=O)[O-])cc1.O__MAKLIALTLLGMGLALFRNHQSSYQTRLNALREVQPVELPNCNLVKGIETGSEDLEILPNGLAFISSGLKYPGIKSFNPNSPGKILLMDLNEEDPTVLELGITGSKFDVSSFNPHGISTFTDEDNAMYLLVVNHPDAKSTVELFKFQEEEKSLLHLKTIRHKLLPNLNDIVAVGPEHFYGTNDHYFLDPYLQSWEMYLGLAWSYVVYYSPSEVRVVAEGFDFANGINISPDGKYVYIAELLAHKIHVYEKHANWTLTPLKSLDFNTLVDNISVDPETGDLWVGCHPNGMKIFFYDSENPPASEVLRIQNILTEEPKVTQVYAENGTVLQGSTVASVYKGKLLIGTVFHKALYCEL,./data/raw/alphafold//AF-P27169-F1-model_v4.pdb,1506,1056,381,432
+1400,5041,5126,MKRNHYLFTLILLLGCSIFVKASDTVFVHQTQIPILIERQDNVLFYFRLDAKESRMMDEIVLDFGKSVNLSDVQAVKLYYGGTEALQDKGKKRFAPVDYISSHRPGNTLAAIPSYSIKCAEALQPSAKVVLKSHYKLFPGINFFWISLQMKPETSLFTKISSELQSVKIDGKEAICEERSPKDIIHRMAVGVRHAGDDGSASFRIPGLVTSNKGTLLGVYDVRYNSSVDLQEYVDVGLSRSTDGGKTWEKMRLPLSFGEYDGLPAAQNGVGDPSILVDTQTNTIWVVAAWTHGMGNQRAWWSSHPGMDLYQTAQLVMAKSTDDGKTWSKPINITEQVKDPSWYFLLQGPGRGITMSDGTLVFPTQFIDSTRVPNAGIMYSKDRGKTWKMHNMARTNTTEAQVVETEPGVLMLNMRDNRGGSRAVAITKDLGKTWTEHPSSRKALQEPVCMASLIHVEAEDNVLDKDILLFSNPNTTRGRNHITIKASLDDGLTWLPEHQLMLDEGEGWGYSCLTMIDRETIGILYESSAAHMTFQAVKLKDLIR,brenda,Q8AAK9,CC(O)=N[C@H]1[C@H]([C@@H](O)[C@@H](O)CO)O[C@](OC[C@H]2O[C@@H](O[C@H]3[C@H](O)[C@@H](O)C(O)O[C@@H]3CO)[C@H](O)[C@@H](O)[C@H]2O)(C(O)O)C[C@@H]1O.O>>,161.0,99.847231218606,37.0,7.0,3.2.1.18,818.0,2.206825876031849,CC(O)=N[C@H]1[C@H]([C@@H](O)[C@@H](O)CO)O[C@](OC[C@H]2O[C@@H](O[C@H]3[C@H](O)[C@@H](O)C(O)O[C@@H]3CO)[C@H](O)[C@@H](O)[C@H]2O)(C(O)O)C[C@@H]1O.O,,2.206825876031849,CC(O)=N[C@H]1[C@H]([C@@H](O)[C@@H](O)CO)O[C@](OC[C@H]2O[C@@H](O[C@H]3[C@H](O)[C@@H](O)C(O)O[C@@H]3CO)[C@H](O)[C@@H](O)[C@H]2O)(C(O)O)C[C@@H]1O.O__MKRNHYLFTLILLLGCSIFVKASDTVFVHQTQIPILIERQDNVLFYFRLDAKESRMMDEIVLDFGKSVNLSDVQAVKLYYGGTEALQDKGKKRFAPVDYISSHRPGNTLAAIPSYSIKCAEALQPSAKVVLKSHYKLFPGINFFWISLQMKPETSLFTKISSELQSVKIDGKEAICEERSPKDIIHRMAVGVRHAGDDGSASFRIPGLVTSNKGTLLGVYDVRYNSSVDLQEYVDVGLSRSTDGGKTWEKMRLPLSFGEYDGLPAAQNGVGDPSILVDTQTNTIWVVAAWTHGMGNQRAWWSSHPGMDLYQTAQLVMAKSTDDGKTWSKPINITEQVKDPSWYFLLQGPGRGITMSDGTLVFPTQFIDSTRVPNAGIMYSKDRGKTWKMHNMARTNTTEAQVVETEPGVLMLNMRDNRGGSRAVAITKDLGKTWTEHPSSRKALQEPVCMASLIHVEAEDNVLDKDILLFSNPNTTRGRNHITIKASLDDGLTWLPEHQLMLDEGEGWGYSCLTMIDRETIGILYESSAAHMTFQAVKLKDLIR,./data/raw/alphafold//AF-Q8AAK9-F1-model_v4.pdb,2995,1741,3360,2166
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+1402,17714,17957,MAKIVVIGAGVAGLTTALQLLRKGHEVTIVSEFTPGDLSIGYTSPWAGANWLTFYDGGKLADYDAVSYPILRELARSSPEAGIRLISQRSHVLKRDLPKLEVAMSAICQRNPWFKNTVDSFEIIEDRSRIVHDDVAYLVEFRSVCIHTGVYLNWLMSQCLSLGATVVKRRVNHIKDANLLHSSGSRPDVIVNCSGLFARFLGGVEDKKMYPIRGQVVLVRNSLPFMASFSSTPEKENEDEALYIMTRFDGTSIIGGCFQPNNWSSEPDPSLTHRILSRALDRFPELTKDGPLDIVRECVGHRPGREGGPRVELEKIPGVGFVVHNYGAAGAGYQSSYGMADEAVSYVERALTRPNL,uniprot_search,Q99042,N[C@H](Cc1ccccc1)C(=O)O.O.O=O>>N.O=C(O)C(=O)Cc1ccccc1.OO,27.2,1.9764291113143416e-14,30.0,8.0,1.4.3.3,34364.0,1.434568904034199,N[C@H](Cc1ccccc1)C(=O)O.O.O=O,N.O=C(O)C(=O)Cc1ccccc1.OO,1.434568904034199,N[C@H](Cc1ccccc1)C(=O)O.O.O=O__MAKIVVIGAGVAGLTTALQLLRKGHEVTIVSEFTPGDLSIGYTSPWAGANWLTFYDGGKLADYDAVSYPILRELARSSPEAGIRLISQRSHVLKRDLPKLEVAMSAICQRNPWFKNTVDSFEIIEDRSRIVHDDVAYLVEFRSVCIHTGVYLNWLMSQCLSLGATVVKRRVNHIKDANLLHSSGSRPDVIVNCSGLFARFLGGVEDKKMYPIRGQVVLVRNSLPFMASFSSTPEKENEDEALYIMTRFDGTSIIGGCFQPNNWSSEPDPSLTHRILSRALDRFPELTKDGPLDIVRECVGHRPGREGGPRVELEKIPGVGFVVHNYGAAGAGYQSSYGMADEAVSYVERALTRPNL,./data/raw/alphafold//AF-Q99042-F1-model_v4.pdb,1451,981,790,1100
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+1404,5805,5892,MAVRRALIVLAHAERTSFNYAMKEAAVEALKKKGWEVVESDLYAMNFNPLISRNDITGEPKDSENFQYPVESSLAYKEGRLSPDIVAEQKKLEAADLVIFQFPLYWFGVPAILKGWFERVLVAGFAYTYATMYDKGPFQNKKTLLSITTGGSGSMYSLQGVHGDMNVILWPIQSGILRFCGFQVLEPQLVYSIGHTPPDARVQVLEGWKKRLETVWEESPLYFAPSSLFDLNFQAGFLLKKEVQEEQKKNKFGLSVGHHLGKSIPADNQIKARK,uniprot_search,P05982,CC1=C(N2CC2)C(=O)C(C)=C(N2CC2)C1=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+]>>Cc1c(O)c(N2CC2)c(C)c(O)c1N1CC1.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)c1,111.0,5.889356267094632e-15,25.0,7.0,1.6.5.2,10116.0,2.0453229787866576,CC1=C(N2CC2)C(=O)C(C)=C(N2CC2)C1=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+],Cc1c(O)c(N2CC2)c(C)c(O)c1N1CC1.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)c1,2.346352974450639,CC1=C(N2CC2)C(=O)C(C)=C(N2CC2)C1=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+]__MAVRRALIVLAHAERTSFNYAMKEAAVEALKKKGWEVVESDLYAMNFNPLISRNDITGEPKDSENFQYPVESSLAYKEGRLSPDIVAEQKKLEAADLVIFQFPLYWFGVPAILKGWFERVLVAGFAYTYATMYDKGPFQNKKTLLSITTGGSGSMYSLQGVHGDMNVILWPIQSGILRFCGFQVLEPQLVYSIGHTPPDARVQVLEGWKKRLETVWEESPLYFAPSSLFDLNFQAGFLLKKEVQEEQKKNKFGLSVGHHLGKSIPADNQIKARK,./data/raw/alphafold//AF-P05982-F1-model_v4.pdb,3169,1965,3609,2408
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+1408,10636,10791,MKIIRIETSRIAVPLTKPFKTALRTVYTAESVIVRITYDSGAVGWGEAPPTLVITGDSMDSIESAIHHVLKPALLGKSLAGYEAILHDIQHLLTGNMSAKAAVEMALYDGWAQMCGLPLYQMLGGYRDTLETDYTVSVNSPEEMAADAENYLKQGFQTLKIKVGKDDIATDIARIQEIRKRVGSAVKLRLDANQGWRPKEAVTAIRKMEDAGLGIELVEQPVHKDDLAGLKKVTDATDTPIMADESVFTPRQAFEVLQTRSADLINIKLMKAGGISGAEKINAMAEACGVECMVGSMIETKLGITAAAHFAASKRNITRFDFDAPLMLKTDVFNGGITYSGSTISMPGKPGLGIIGAALLKGEKEQ,brenda,O34508,C[C@H](N)C(=O)CN[C@H](CC(=O)O)C(=O)O>>C[C@H](N)C(O)=N[C@@H](CC(=O)O)C(=O)O,0.053,3.3130132666967387,37.0,8.5,5.1.1.20,1423.0,-1.275724130399211,C[C@H](N)C(=O)CN[C@H](CC(=O)O)C(=O)O,C[C@H](N)C(O)=N[C@@H](CC(=O)O)C(=O)O,-1.275724130399211,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,888,383,16,19
+1409,16672,16901,MTTIDFKAEVEKLKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFAGKNAGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEETAGKATVTLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,sabio,Q84BU9,NCC(O)=NC(Cc1ccccc1)C(=O)O.O>>NC(Cc1ccccc1)C(=O)O.NCC(=O)O,671.0,1.180504547302656e-14,37.0,7.5,3.4.13.-,203404.0,2.826722520168992,NCC(O)=NC(Cc1ccccc1)C(=O)O.O,NC(Cc1ccccc1)C(=O)O.NCC(=O)O,2.826722520168992,NCC(O)=NC(Cc1ccccc1)C(=O)O.O__MTTIDFKAEVEKLKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFAGKNAGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEETAGKATVTLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,./data/raw/alphafold//AF-Q84BU9-F1-model_v4.pdb,1801,1476,3046,1794
+1410,2434,2468,MSRQSISLRFPLLLLLLSPSPVFSADPGAPAPVNPCCYYPCQHQGICVRFGLDRYQCDCTRTGYSGPNCTIPEIWTWLRTTLRPSPSFIHFLLTHGRWLWDFVNATFIRDTLMRLVLTVRSNLIPSPPTYNIAHDYISWESFSNVSYYTRILPSVPRDCPTPMDTKGKKQLPDAEFLSRRFLLRRKFIPDPQSTNLMFAFFAQHFTHQFFKTSGKMGPGFTKALGHGVDLGHIYGDNLERQYQLRLFKDGKLKYQMLNGEVYPPSVEEAPVLMHYPRGIPPQSQMAVGQEVFGLLPGLMLYATIWLREHNRVCDLLKAEHPTWGDEQLFQTARLILIGETIKIVIEEYVQQLSGYFLQLKFDPELLFGAQFQYRNRIAMEFNQLYHWHPLMPDSFRVGPQDYSYEQFLFNTSMLVDYGVEALVDAFSRQPAGRIGGGRNIDHHILHVAVDVIKESRVLRLQPFNEYRKRFGMKPYTSFQELTGEKEMAAELEELYGDIDALEFYPGLLLEKCHPNSIFGESMIEMGAPFSLKGLLGNPICSPEYWKASTFGGEVGFNLVKTATLKKLVCLNTKTCPYVSFHVPDPRQEDRPGVERPPTEL,sabio,P05979,CC(C)(C)OO.COc1ccccc1O>>CC(C)(C)O.COC1=C/C(=C2\C=CC(=O)C(OC)=C2)C=CC1=O.O,35.0,22.1379691649521,4.0,8.0,1.14.99.1,9940.0,1.5440680443502757,CC(C)(C)OO.COc1ccccc1O,CC(C)(C)O.COC1=C/C(=C2\C=CC(=O)C(OC)=C2)C=CC1=O.O,1.5440680443502757,CC(C)(C)OO.COc1ccccc1O__MSRQSISLRFPLLLLLLSPSPVFSADPGAPAPVNPCCYYPCQHQGICVRFGLDRYQCDCTRTGYSGPNCTIPEIWTWLRTTLRPSPSFIHFLLTHGRWLWDFVNATFIRDTLMRLVLTVRSNLIPSPPTYNIAHDYISWESFSNVSYYTRILPSVPRDCPTPMDTKGKKQLPDAEFLSRRFLLRRKFIPDPQSTNLMFAFFAQHFTHQFFKTSGKMGPGFTKALGHGVDLGHIYGDNLERQYQLRLFKDGKLKYQMLNGEVYPPSVEEAPVLMHYPRGIPPQSQMAVGQEVFGLLPGLMLYATIWLREHNRVCDLLKAEHPTWGDEQLFQTARLILIGETIKIVIEEYVQQLSGYFLQLKFDPELLFGAQFQYRNRIAMEFNQLYHWHPLMPDSFRVGPQDYSYEQFLFNTSMLVDYGVEALVDAFSRQPAGRIGGGRNIDHHILHVAVDVIKESRVLRLQPFNEYRKRFGMKPYTSFQELTGEKEMAAELEELYGDIDALEFYPGLLLEKCHPNSIFGESMIEMGAPFSLKGLLGNPICSPEYWKASTFGGEVGFNLVKTATLKKLVCLNTKTCPYVSFHVPDPRQEDRPGVERPPTEL,./data/raw/alphafold//AF-P05979-F1-model_v4.pdb,1602,1190,1665,1393
+1411,18107,18361,MGRVYYGGVERTYLYRGRILNLALEGRYEIVEHKPAVAVIALREGRMLFVRQMRPAVGLAPLEIPAGLIEPGEDPLEAARRELAEETGLSGDLTYLFSYFVSPGFTDEKTHVFLAENLKEVEAHPDEDEAIEVVWMRPEEALERHQRGEVEFSATGLVGVLYYHAFLRGR,sabio,Q5SKW5,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OC2OC(CO)C(O)C(O)C2O)C(O)C1O.O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OC1OC(CO)C(O)C(O)C1O,9.1,3.7405660760675095e-14,25.0,7.63,3.6.1.13,274.0,0.9590413923210936,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OC2OC(CO)C(O)C(O)C2O)C(O)C1O.O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OC1OC(CO)C(O)C(O)C1O,0.9590413923210936,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OC2OC(CO)C(O)C(O)C2O)C(O)C1O.O__MGRVYYGGVERTYLYRGRILNLALEGRYEIVEHKPAVAVIALREGRMLFVRQMRPAVGLAPLEIPAGLIEPGEDPLEAARRELAEETGLSGDLTYLFSYFVSPGFTDEKTHVFLAENLKEVEAHPDEDEAIEVVWMRPEEALERHQRGEVEFSATGLVGVLYYHAFLRGR,./data/raw/alphafold//AF-Q5SKW5-F1-model_v4.pdb,1990,4146,4011,3853
+1412,16678,16907,MATLRVSSLFASSSSSLHSNPSVFTKYQSSPKWAFSFPVTPLCSKRSKRIVHCIAGDTLGLTRPNESDAPKISIGAKDTAVVQWQGDLLAIGATENDMARDENSKFKNPLLQQLDSELNGLLSAASSEEDFSGKSGQSVNLRFPGGRITLVGLGSSASSPTSYHSLGQAAAAAAKSSQARNIAVALASTDGLSAESKINSASAIATGVVLGSFEDNRFRSESKKSTLESLDILGLGTGPEIERKIKYAEHVCAGVILGRELVNAPANIVTPAVLAEEAKKIASTYSDVISVNILDAEQCKELKMGAYLAVAAAATENPPYFIHLCFKTPTKERKTKLALVGKGLTFDSGGYNLKVGAGSRIELMKNDMGGAAAVLGAAKALGEIRPSRVEVHFIVAACENMISAEGMRPGDIVTASNGKTIEVNNTDAEGRLTLADALIYACNQGVEKIIDLATLTGAIMVALGPSVAGAFTPNDDLAREVVEAAEASGEKLWRMPMEESYWESMKSGSGDMINTGPGNGGAITGALFLKQFVDEKVQWLHLDVAGPVWSDEKKNATGYGVSTLVEWVLRN,sabio,Q10712,NCC(O)=NCC(=O)O.O>>NCC(=O)O,651720.0,33.18597176847142,37.0,9.2,3.4.11.1,4081.0,5.814061048840252,NCC(O)=NCC(=O)O.O,NCC(=O)O,5.814061048840252,NCC(O)=NCC(=O)O.O__MATLRVSSLFASSSSSLHSNPSVFTKYQSSPKWAFSFPVTPLCSKRSKRIVHCIAGDTLGLTRPNESDAPKISIGAKDTAVVQWQGDLLAIGATENDMARDENSKFKNPLLQQLDSELNGLLSAASSEEDFSGKSGQSVNLRFPGGRITLVGLGSSASSPTSYHSLGQAAAAAAKSSQARNIAVALASTDGLSAESKINSASAIATGVVLGSFEDNRFRSESKKSTLESLDILGLGTGPEIERKIKYAEHVCAGVILGRELVNAPANIVTPAVLAEEAKKIASTYSDVISVNILDAEQCKELKMGAYLAVAAAATENPPYFIHLCFKTPTKERKTKLALVGKGLTFDSGGYNLKVGAGSRIELMKNDMGGAAAVLGAAKALGEIRPSRVEVHFIVAACENMISAEGMRPGDIVTASNGKTIEVNNTDAEGRLTLADALIYACNQGVEKIIDLATLTGAIMVALGPSVAGAFTPNDDLAREVVEAAEASGEKLWRMPMEESYWESMKSGSGDMINTGPGNGGAITGALFLKQFVDEKVQWLHLDVAGPVWSDEKKNATGYGVSTLVEWVLRN,./data/raw/alphafold//AF-Q10712-F1-model_v4.pdb,1822,1502,217,235
+1413,16260,16487,MGTEVKATRTVVSLRKFHISEEYGFILPEPLMDLPVYYKPWMDIGRNVTELISSHSLRLRIHNMPLLTTDLLRTHRELRLAHLTLSVMAMGYVWQEGEKETVKMLPQTLSVPFCDVSRRLGLPPILIHADTVLANWKKTNPNGPFTMENLELLLSLPGGQSLRGFFLVTLLVELAAVPGLKAIIDVINGVHYNDIERVTKALDVICQSIDSMKQALKRMHEYVDPSIFYGVIRIFLSGWKDNPSMAEGLVYEGVDDQPMEFSGGSAAQSSILHCLDELLGIQHEGNNGAFLKRMRDYMPPSHKQFIQEISICPSLRDFVLQQADERLTHAFDKCVAGLVDFRNCHINIVTRFITIPASRAKQLRANKQNLMEELDTISRAPTALEERGTGGSGIMTFLKTVRNETKDSSISVFTNGNQEPPMEEIEKSASELTIE,sabio,A2Q0R5,NC(CC(=O)c1ccccc1NC=O)C(=O)O.O=O>>NC(CC(=O)c1ccccc1NC=O)C(=O)O,9462.6,6.330571448920964,37.0,6.5,1.13.11.52,7955.0,3.976010482121732,NC(CC(=O)c1ccccc1NC=O)C(=O)O.O=O,NC(CC(=O)c1ccccc1NC=O)C(=O)O,3.976010482121732,NC(CC(=O)c1ccccc1NC=O)C(=O)O.O=O__MGTEVKATRTVVSLRKFHISEEYGFILPEPLMDLPVYYKPWMDIGRNVTELISSHSLRLRIHNMPLLTTDLLRTHRELRLAHLTLSVMAMGYVWQEGEKETVKMLPQTLSVPFCDVSRRLGLPPILIHADTVLANWKKTNPNGPFTMENLELLLSLPGGQSLRGFFLVTLLVELAAVPGLKAIIDVINGVHYNDIERVTKALDVICQSIDSMKQALKRMHEYVDPSIFYGVIRIFLSGWKDNPSMAEGLVYEGVDDQPMEFSGGSAAQSSILHCLDELLGIQHEGNNGAFLKRMRDYMPPSHKQFIQEISICPSLRDFVLQQADERLTHAFDKCVAGLVDFRNCHINIVTRFITIPASRAKQLRANKQNLMEELDTISRAPTALEERGTGGSGIMTFLKTVRNETKDSSISVFTNGNQEPPMEEIEKSASELTIE,./data/raw/alphafold//AF-A2Q0R5-F1-model_v4.pdb,2630,5115,2244,5128
+1414,10751,10906,MTILVVTGTGTGVGKTVVCAALASAARQAGIDVAVCKPVQTGTARGDDDLAEVGRLAGVTQLAGLARYPQPMAPAAAAEHAGMALPARDQIVRLIADLDRPGRLTLVEGAGGLLVELAEPGVTLRDVAVDVAAAALVVVTADLGTLNHTKLTLEALAAQQVSCAGLVIGSWPDPPGLVAASNRSALARIAMVRAALPAGAASLDAGDFAAMSAAAFDRNWVAGLVG,brenda,P9WPQ5,C[C@H](N)[C@H](N)CCCCCC(=O)O.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-])O.[Na+]>>C[C@@H]1N=C(O)N[C@@H]1CCCCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O.[Na+].[OH-],13.3,7.288000889893961e-15,37.0,7.5,6.3.3.3,1773.0,1.1238516409670858,C[C@H](N)[C@H](N)CCCCCC(=O)O.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-])O.[Na+],C[C@@H]1N=C(O)N[C@@H]1CCCCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O.[Na+].[OH-],1.1238516409670858,C[C@H](N)[C@H](N)CCCCCC(=O)O.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-])O.[Na+]__MTILVVTGTGTGVGKTVVCAALASAARQAGIDVAVCKPVQTGTARGDDDLAEVGRLAGVTQLAGLARYPQPMAPAAAAEHAGMALPARDQIVRLIADLDRPGRLTLVEGAGGLLVELAEPGVTLRDVAVDVAAAALVVVTADLGTLNHTKLTLEALAAQQVSCAGLVIGSWPDPPGLVAASNRSALARIAMVRAALPAGAASLDAGDFAAMSAAAFDRNWVAGLVG,./data/raw/alphafold//AF-P9WPQ5-F1-model_v4.pdb,2946,1681,3291,2090
+1415,2564,2599,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)C=Cc1ccc(O)cc1.NCCc1c[nH]c2ccc(O)cc12>>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(/C=C/c1ccc(O)cc1)NCCc1c[nH]c2ccc(O)cc12,2.5,0.0,37.0,7.4,2.3.1.-,4530.0,0.3979400086720376,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)C=Cc1ccc(O)cc1.NCCc1c[nH]c2ccc(O)cc12,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(/C=C/c1ccc(O)cc1)NCCc1c[nH]c2ccc(O)cc12,0.3979400086720376,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)C=Cc1ccc(O)cc1.NCCc1c[nH]c2ccc(O)cc12__MEITSSAMLKTTTTPPHPLAGEKVPLSAFDRAAFDVFVPLVFAYRAPAPSSEAVKEGLRVAVAAYPLVSGRIAVDGQGRRRRRRVLHVNNEGVLVLDATVEVDLDAVLAANVATDLYPALPEHSFGAALLQVQLTRFGCGGLVVGLIGHHHVFDGHSMSTFCATWARAVRDSEAFIVPSPSLDRAITGVPRSPPAPVFDHRSIEFKVGNKSSDSSGAAAAAAVEKIANIGVRFTAKFVAELKARVGGRCSTFECVLAHAWKKITAARGLKPEEFTRVRVAVNCRRRANPPAPADLFGNMVLWAFPRLQVRRLLSSSYRDVVGAIRAAVARVDAEYIQSFVDYVEVADARGEELAATAAEPGETLCPDLEVDSWLGFRFHEMDLGTGPPAAVLSPDLPIEGLMILVPVGGDGGGVDLFVALADDHAQAFEQICYSLEEHAMIHSHL,./data/raw/alphafold//AF-Q2R0K3-F1-model_v4.pdb,1633,1235,1714,1444
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+1417,6273,6382,MKYTKTLLAMVLSATFCQAYAEDKVWISIGADANQTVMKSGAESILPNSVASSGQVWVGQVDVAQLAELSHNMHEEHNRCGGYMVHPSAQSAMAASAMPTTLASFVMPPITQQATVTAWLPQVDASQITGTISSLESFTNRFYTTTSGAQASDWIASEWQALSASLPNASVKQVSHSGYNQKSVVMTITGSEAPDEWIVIGGHLDSTIGSHTNEQSVAPGADDDASGIAAVTEVIRVLSENNFQPKRSIAFMAYAAEEVGLRGSQDLANQYKSEGKNVVSALQLDMTNYKGSAQDVVFITDYTDSNFTQYLTQLMDEYLPSLTYGFDTCGYACSDHASWHNAGYPAAMPFESKFNDYNPRIHTTQDTLANSDPTGSHAKKFTQLGLAYAIEMGSATGDTPTPGNQLEDGVPVTDLSGSRGSNVWYTFELETQKNLQITTSGGYGDLDLYVKFGSKASKQNWDCRPYLSGNNEVCTFNNASPGTYSVMLTGYSNYSGASLKASTF,uniprot_search,Q01693,CCC(C)[C@H](N)C(=N)O.O>>CC[C@H](C)[C@H](N)C(=O)O.N,6.2,0.0,15.65,8.5,3.4.11.10,671.0,0.7923916894982539,CCC(C)[C@H](N)C(=N)O.O,CC[C@H](C)[C@H](N)C(=O)O.N,0.7923916894982539,CCC(C)[C@H](N)C(=N)O.O__MKYTKTLLAMVLSATFCQAYAEDKVWISIGADANQTVMKSGAESILPNSVASSGQVWVGQVDVAQLAELSHNMHEEHNRCGGYMVHPSAQSAMAASAMPTTLASFVMPPITQQATVTAWLPQVDASQITGTISSLESFTNRFYTTTSGAQASDWIASEWQALSASLPNASVKQVSHSGYNQKSVVMTITGSEAPDEWIVIGGHLDSTIGSHTNEQSVAPGADDDASGIAAVTEVIRVLSENNFQPKRSIAFMAYAAEEVGLRGSQDLANQYKSEGKNVVSALQLDMTNYKGSAQDVVFITDYTDSNFTQYLTQLMDEYLPSLTYGFDTCGYACSDHASWHNAGYPAAMPFESKFNDYNPRIHTTQDTLANSDPTGSHAKKFTQLGLAYAIEMGSATGDTPTPGNQLEDGVPVTDLSGSRGSNVWYTFELETQKNLQITTSGGYGDLDLYVKFGSKASKQNWDCRPYLSGNNEVCTFNNASPGTYSVMLTGYSNYSGASLKASTF,./data/raw/alphafold//AF-Q01693-F1-model_v4.pdb,1813,1491,3063,1815
+1418,21077,21399,MPVLIVYGPKLDVGKKREFVERLTSVAAEIYGMDRSAITILIHEPPAENVGVGGKLIADRERE,brenda,O29588,O=C(O)/C(O)=C\c1ccccc1>>O=C(O)C(=O)Cc1ccccc1,2.4,0.0,23.0,7.3,5.3.2.6,2234.0,0.380211241711606,O=C(O)/C(O)=C\c1ccccc1,O=C(O)C(=O)Cc1ccccc1,0.380211241711606,O=C(O)/C(O)=C\c1ccccc1__MPVLIVYGPKLDVGKKREFVERLTSVAAEIYGMDRSAITILIHEPPAENVGVGGKLIADRERE,./data/raw/alphafold//AF-O29588-F1-model_v4.pdb,1172,782,483,550
+1419,1889,1920,MPLYKLLGWLNAVACGVLLLVLHVQGQDSASPIRNTHTGQVRGSLVHVKDTDIAVHTFLGIPFAKPPVGPLRFAPPEAPEPWSGVRDGTSHPNMCLQNDNLMGSEDLKMMNLILPPISMSEDCLYLNIYVPAHAHEGSNLPVMVWIHGGALTVGMASMYDGSMLAATEDVVVVAIQYRLGVLGFFSTGDQHAKGNWGYLDQVAALRWVQQNIVHFGGNPDRVTIFGESAGGTSVSSHVVSPMSQGLFHGAIMESGVAVLPDLISSSSEMVHRIVANLSGCAAVNSETLMCCLRGKNEAEMLAINKVFKIIPGVVDGEFLPKHPQELMASKDFHPVPSIIGINNDEYGWILPTIMDPAQKIEEITRKTLPAVLKSTALKMMLPPECGDLLMEEYMGDTEDPETLQAQFREMKGDFMFVIPALQVAHFQRSHAPVYFYEFQHRPSFFKDFRPPYVKADHGDEIFLVFGYQFGNIKLPYTEEEEQLSRRIMKYWANFARHGNPNSEGLPYWPVMDHDEQYLQLDIQPSVGRALKARRLQFWTKTLPQKIQELKGSQERHKEL,brenda,Q8BK48,CC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CC(=O)O.O=[N+]([O-])c1ccc(O)cc1,94.0,0.0,30.0,8.0,3.1.1.1,10090.0,1.9731278535996988,CC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CC(=O)O.O=[N+]([O-])c1ccc(O)cc1,1.9731278535996988,CC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MPLYKLLGWLNAVACGVLLLVLHVQGQDSASPIRNTHTGQVRGSLVHVKDTDIAVHTFLGIPFAKPPVGPLRFAPPEAPEPWSGVRDGTSHPNMCLQNDNLMGSEDLKMMNLILPPISMSEDCLYLNIYVPAHAHEGSNLPVMVWIHGGALTVGMASMYDGSMLAATEDVVVVAIQYRLGVLGFFSTGDQHAKGNWGYLDQVAALRWVQQNIVHFGGNPDRVTIFGESAGGTSVSSHVVSPMSQGLFHGAIMESGVAVLPDLISSSSEMVHRIVANLSGCAAVNSETLMCCLRGKNEAEMLAINKVFKIIPGVVDGEFLPKHPQELMASKDFHPVPSIIGINNDEYGWILPTIMDPAQKIEEITRKTLPAVLKSTALKMMLPPECGDLLMEEYMGDTEDPETLQAQFREMKGDFMFVIPALQVAHFQRSHAPVYFYEFQHRPSFFKDFRPPYVKADHGDEIFLVFGYQFGNIKLPYTEEEEQLSRRIMKYWANFARHGNPNSEGLPYWPVMDHDEQYLQLDIQPSVGRALKARRLQFWTKTLPQKIQELKGSQERHKEL,./data/raw/alphafold//AF-Q8BK48-F1-model_v4.pdb,1494,1043,868,1198
+1420,19548,19834,MSHAWGYAPDNGPDKWCEGFPIANGPRQSPIDIVPGEAAFDAALKALTLKYDPSTSIDILNNGHSFQVTYTDDNDNSTLTGGPISGTYRLKQFHFHWGASDDRGSEHTVAGTKYAAELHLVHWNTKYPSFGDAASKSDGLAVVGVFLQVGNENANLQKVLDAFDAIKAKGKQTSFENFDPTILLPKSLDYWTYDGSLTTPPLLESVTWIVCKESISVSPAQMGKFRSLLFSGEGEAACCMVDNYRPPQPLKGRAITARS,brenda,Q6R4A2,O.O=C=O>>O=C(O)O,89000.0,5.682159936665122e-15,25.0,7.5,4.2.1.1,927.0,4.949390006644913,O.O=C=O,O=C(O)O,4.949390006644913,O.O=C=O__MSHAWGYAPDNGPDKWCEGFPIANGPRQSPIDIVPGEAAFDAALKALTLKYDPSTSIDILNNGHSFQVTYTDDNDNSTLTGGPISGTYRLKQFHFHWGASDDRGSEHTVAGTKYAAELHLVHWNTKYPSFGDAASKSDGLAVVGVFLQVGNENANLQKVLDAFDAIKAKGKQTSFENFDPTILLPKSLDYWTYDGSLTTPPLLESVTWIVCKESISVSPAQMGKFRSLLFSGEGEAACCMVDNYRPPQPLKGRAITARS,./data/raw/alphafold//AF-Q6R4A2-F1-model_v4.pdb,287,2824,5165,6028
+1421,14222,14412,MAPLKLNSRNLSQIAAAGGALVKIPTYQRGRAVKEGIVHIGVGGFHRAHLAVYIDQLMQKHGVNDYAICGVGLQPFDSAMRDALASQDHLYTLIERSAKGSFAHVIGSINSYLFAPDNREAVIAKMAHPDTKIVSLTITESGYYYNENTHELQSEHPDIQFDLDPANEKAPRTTFGFLYAGLTRRYQQGLKPFTVMSCDNMQKNGSITRHMLESFARLRNPEVAEWIAEEGAFPNAMVDRITPQTSETDKTALAEKFGIVDSWPVVTEPFTQWVIEDQFSDGRPPFEKVGVQVVKDVHAVEQFEKHKLRLLNGSHSALGYPGQLAGFQYVHEVMANPLFRKFVWQMMQEEVKPLLPEIPGVDIDEYCNTLIERFTNPTIMDQLPRICLNASGKIPQFIMPSIAEAIWETGPFRRLCFVAAAWFHYIKGVDDRGKPFEVVDPMREELQAKARAGGNDPSELLSIKSLFGDDLRNDERFLREITTAMNDIARDGIMKTLPKYIN,brenda,Q4WQY4,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.OC[C@@H](O)C(O)[C@H](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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.OCC1(O)OC[C@@H](O)[C@@H]1O.[H+],162.0,6.956863536773207e-15,25.0,7.1,1.1.1.67,746128.0,2.2095150145426308,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.OC[C@@H](O)C(O)[C@H](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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.OCC1(O)OC[C@@H](O)[C@@H]1O.[H+],2.2095150145426308,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.OC[C@@H](O)C(O)[C@H](O)CO__MAPLKLNSRNLSQIAAAGGALVKIPTYQRGRAVKEGIVHIGVGGFHRAHLAVYIDQLMQKHGVNDYAICGVGLQPFDSAMRDALASQDHLYTLIERSAKGSFAHVIGSINSYLFAPDNREAVIAKMAHPDTKIVSLTITESGYYYNENTHELQSEHPDIQFDLDPANEKAPRTTFGFLYAGLTRRYQQGLKPFTVMSCDNMQKNGSITRHMLESFARLRNPEVAEWIAEEGAFPNAMVDRITPQTSETDKTALAEKFGIVDSWPVVTEPFTQWVIEDQFSDGRPPFEKVGVQVVKDVHAVEQFEKHKLRLLNGSHSALGYPGQLAGFQYVHEVMANPLFRKFVWQMMQEEVKPLLPEIPGVDIDEYCNTLIERFTNPTIMDQLPRICLNASGKIPQFIMPSIAEAIWETGPFRRLCFVAAAWFHYIKGVDDRGKPFEVVDPMREELQAKARAGGNDPSELLSIKSLFGDDLRNDERFLREITTAMNDIARDGIMKTLPKYIN,./data/raw/alphafold//AF-Q4WQY4-F1-model_v4.pdb,2272,4518,4437,4328
+1422,17442,17679,MNVFFMFSLLFLAALGSCADDRNPLAECFQENDYEEFLEIARNGLKATSNPKHVVIVGAGMAGLSAAYVLAGAGHQVTVLEASERPGGRVRTYRNEEAGWYANLGPMRLPEKHRIVREYIRKFDLRLNEFSQENDNAWYFIKNIRKKVGEVKKDPGLLKYPVKPSEAGKSAGQLYEESLGKVVEELKRTNCSYILNKYDTYSTKEYLIKEGDLSPGAVDMIGDLLNEDSGYYVSFIESLKHDDIFAYEKRFDEIVDGMDKLPTAMYRDIQDKVHFNAQVIKIQQNDQKVTVVYETLSKETPSVTADYVIVCTTSRAVRLIKFNPPLLPKKAHALRSVHYRSGTKIFLTCTTKFWEDDGIHGGKSTTDLPSRFIYYPNHNFTNGVGVIIAYGIGDDANFFQALDFKDCADIVFNDLSLIHQLPKKDIQSFCYPSVIQKWSLDKYAMGGITTFTPYQFQHFSDPLTASQGRIYFAGEYTAQAHGWIDSTIKSGLRAARDVNLASENPSGIHLSNDNEL,uniprot_search,P81382,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O.O=O>>N.O=C(O)C(=O)Cc1c[nH]c2ccccc12.OO,0.88,1.1157056720291124e-14,,,1.4.3.2,8717.0,-0.0555173278498313,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O.O=O,N.O=C(O)C(=O)Cc1c[nH]c2ccccc12.OO,-0.0555173278498313,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O.O=O__MNVFFMFSLLFLAALGSCADDRNPLAECFQENDYEEFLEIARNGLKATSNPKHVVIVGAGMAGLSAAYVLAGAGHQVTVLEASERPGGRVRTYRNEEAGWYANLGPMRLPEKHRIVREYIRKFDLRLNEFSQENDNAWYFIKNIRKKVGEVKKDPGLLKYPVKPSEAGKSAGQLYEESLGKVVEELKRTNCSYILNKYDTYSTKEYLIKEGDLSPGAVDMIGDLLNEDSGYYVSFIESLKHDDIFAYEKRFDEIVDGMDKLPTAMYRDIQDKVHFNAQVIKIQQNDQKVTVVYETLSKETPSVTADYVIVCTTSRAVRLIKFNPPLLPKKAHALRSVHYRSGTKIFLTCTTKFWEDDGIHGGKSTTDLPSRFIYYPNHNFTNGVGVIIAYGIGDDANFFQALDFKDCADIVFNDLSLIHQLPKKDIQSFCYPSVIQKWSLDKYAMGGITTFTPYQFQHFSDPLTASQGRIYFAGEYTAQAHGWIDSTIKSGLRAARDVNLASENPSGIHLSNDNEL,./data/raw/alphafold//AF-P81382-F1-model_v4.pdb,1381,1496,3068,1821
+1423,12653,12824,MARILVIFHSITGNTMKLAKAVADGAREGGAEVAVKRVPETIPAEILEKNPGYVKVREELESFEVARPEELQDYDAIIFGSPTRFGVMSSQMKQFIDMTGRLWMERRLEGKVGAVFTSNEMPHGGKEATLLSMLLPLFAHGMIIVGLPPAKELYRAGSYYGAASTGVPKEDDLQVAKMLGKRVAEVAEKLC,sabio,O29904,N#C[Fe+3](C#N)(C#N)(C#N)(C#N)C#N.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>>N#C[Fe+2](C#N)(C#N)(C#N)(C#N)C#N.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.[H],170.0,0.0,37.0,7.2,1.6.5.2,2234.0,2.230448921378274,N#C[Fe+3](C#N)(C#N)(C#N)(C#N)C#N.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,N#C[Fe+2](C#N)(C#N)(C#N)(C#N)C#N.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.[H],2.230448921378274,N#C[Fe+3](C#N)(C#N)(C#N)(C#N)C#N.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__MARILVIFHSITGNTMKLAKAVADGAREGGAEVAVKRVPETIPAEILEKNPGYVKVREELESFEVARPEELQDYDAIIFGSPTRFGVMSSQMKQFIDMTGRLWMERRLEGKVGAVFTSNEMPHGGKEATLLSMLLPLFAHGMIIVGLPPAKELYRAGSYYGAASTGVPKEDDLQVAKMLGKRVAEVAEKLC,./data/raw/alphafold//AF-O29904-F1-model_v4.pdb,2137,4339,4226,4087
+1424,3693,3743,MLARGLPLRSALVKACPPILSTVGEGWGHHRVGTGEGAGISTKTPRPYSEIPSPGDNGWLNLYHFWREKGSQRIHFRHIENFQKYGPIYREKLGNLESVYIIHPEDVAHLFKFEGSYPERYDIPPWLAYHRYYQKPIGVLFKKSGTWKKDRVVLNTEVMAPEAIKNFIPLLNPVSQDFVSLLHKRIKQQGSGKFVGDIKEDLFHFAFESITNVMFGERLGMLEETVNPEAQKFIDAVYKMFHTSVPLLNVPPELYRLFRTKTWRDHVAAWDTIFNKAEKYTEIFYQDLRRKTEFRNYPGILYCLLKSEKMLLEDVKANITEMLAGGVNTTSMTLQWHLYEMARSLNVQEMLREEVLNARRQAEGDISKMLQMVPLLKASIKETLRLHPISVTLQRYPESDLVLQDYLIPAKTLVQVAIYAMGRDPAFFSSPDKFDPTRWLSKDKDLIHFRNLGFGWGVRQCVGRRIAELEMTLFLIHILENFKVEMQHIGDVDTIFNLILTPDKPIFLVFRPFNQDPPQA,sabio,P00189,CC(C)CCCC(C)C1CCC2C3=CC=C4CC(O)CCC4(C)C3CCC21C.O=O>>CC(=O)C1CCC2C3=CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C.CC(C)CCC=O.O,1464.0,1.8815911258615985,37.0,7.4,1.14.15.6,9913.0,3.165541076722373,CC(C)CCCC(C)C1CCC2C3=CC=C4CC(O)CCC4(C)C3CCC21C.O=O,CC(=O)C1CCC2C3=CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C.CC(C)CCC=O.O,3.165541076722373,CC(C)CCCC(C)C1CCC2C3=CC=C4CC(O)CCC4(C)C3CCC21C.O=O__MLARGLPLRSALVKACPPILSTVGEGWGHHRVGTGEGAGISTKTPRPYSEIPSPGDNGWLNLYHFWREKGSQRIHFRHIENFQKYGPIYREKLGNLESVYIIHPEDVAHLFKFEGSYPERYDIPPWLAYHRYYQKPIGVLFKKSGTWKKDRVVLNTEVMAPEAIKNFIPLLNPVSQDFVSLLHKRIKQQGSGKFVGDIKEDLFHFAFESITNVMFGERLGMLEETVNPEAQKFIDAVYKMFHTSVPLLNVPPELYRLFRTKTWRDHVAAWDTIFNKAEKYTEIFYQDLRRKTEFRNYPGILYCLLKSEKMLLEDVKANITEMLAGGVNTTSMTLQWHLYEMARSLNVQEMLREEVLNARRQAEGDISKMLQMVPLLKASIKETLRLHPISVTLQRYPESDLVLQDYLIPAKTLVQVAIYAMGRDPAFFSSPDKFDPTRWLSKDKDLIHFRNLGFGWGVRQCVGRRIAELEMTLFLIHILENFKVEMQHIGDVDTIFNLILTPDKPIFLVFRPFNQDPPQA,./data/raw/alphafold//AF-P00189-F1-model_v4.pdb,1823,1505,3077,1837
+1425,4328,4383,MGFVVALIQGDGIGPEVVSKSKTILARLNEKFSLPIEYIEVEAGDTTKNKFGDALPKDSLRVIEKADMILKGPVGETAADVVVKLRLMYDLYANLRPAKSLPGLENKFGDVDILVVRENTEDLYKGLEHVISDGVTVGIKVITRAASTRIAQVALNQALRRKKKVVCVHKSNVMRITDGLFAESCRNVLKGKVEYSEMYVDAAAANLVRNPQAFDVIVTENTYGDILSDEAGQIAGSLGISPSANIGDRKSLFEPVHGAAFDIAGKNIANPTAFLLSVGMMLDRMQELSGDIRYNNAAKSLRDAIYSVYSEGKYLTPDVGGSSTTDEMISAIRSKIG,brenda,Q4JB37,CC(C)[C@H](C(=O)O)[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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1>>CC(C)[C@H](C(=O)O)C(=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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],8.5,0.0,60.0,8.0,1.1.1.85,2285.0,0.9294189257142929,CC(C)[C@H](C(=O)O)[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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,CC(C)[C@H](C(=O)O)C(=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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],0.9294189257142929,CC(C)[C@H](C(=O)O)[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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MGFVVALIQGDGIGPEVVSKSKTILARLNEKFSLPIEYIEVEAGDTTKNKFGDALPKDSLRVIEKADMILKGPVGETAADVVVKLRLMYDLYANLRPAKSLPGLENKFGDVDILVVRENTEDLYKGLEHVISDGVTVGIKVITRAASTRIAQVALNQALRRKKKVVCVHKSNVMRITDGLFAESCRNVLKGKVEYSEMYVDAAAANLVRNPQAFDVIVTENTYGDILSDEAGQIAGSLGISPSANIGDRKSLFEPVHGAAFDIAGKNIANPTAFLLSVGMMLDRMQELSGDIRYNNAAKSLRDAIYSVYSEGKYLTPDVGGSSTTDEMISAIRSKIG,./data/raw/alphafold//AF-Q4JB37-F1-model_v4.pdb,2912,1631,3232,2014
+1426,15717,15944,MNVFFMFSLLFLAALGSCADDRNPLAECFQENDYEEFLEIARNGLKATSNPKHVVIVGAGMAGLSAAYVLAGAGHQVTVLEASERPGGRVRTYRNEEAGWYANLGPMRLPEKHRIVREYIRKFDLRLNEFSQENDNAWYFIKNIRKKVGEVKKDPGLLKYPVKPSEAGKSAGQLYEESLGKVVEELKRTNCSYILNKYDTYSTKEYLIKEGDLSPGAVDMIGDLLNEDSGYYVSFIESLKHDDIFAYEKRFDEIVDGMDKLPTAMYRDIQDKVHFNAQVIKIQQNDQKVTVVYETLSKETPSVTADYVIVCTTSRAVRLIKFNPPLLPKKAHALRSVHYRSGTKIFLTCTTKFWEDDGIHGGKSTTDLPSRFIYYPNHNFTNGVGVIIAYGIGDDANFFQALDFKDCADIVFNDLSLIHQLPKKDIQSFCYPSVIQKWSLDKYAMGGITTFTPYQFQHFSDPLTASQGRIYFAGEYTAQAHGWIDSTIKSGLRAARDVNLASENPSGIHLSNDNEL,sabio,P81382,NC(=O)CCC(N)C(=O)O.O.O=O>>N.NC(=O)CCC(=O)C(=O)O.OO,0.38,7.226140026747827e-15,25.0,8.5,1.4.3.2,8717.0,-0.4202164033831898,NC(=O)CCC(N)C(=O)O.O.O=O,N.NC(=O)CCC(=O)C(=O)O.OO,-0.4202164033831898,NC(=O)CCC(N)C(=O)O.O.O=O__MNVFFMFSLLFLAALGSCADDRNPLAECFQENDYEEFLEIARNGLKATSNPKHVVIVGAGMAGLSAAYVLAGAGHQVTVLEASERPGGRVRTYRNEEAGWYANLGPMRLPEKHRIVREYIRKFDLRLNEFSQENDNAWYFIKNIRKKVGEVKKDPGLLKYPVKPSEAGKSAGQLYEESLGKVVEELKRTNCSYILNKYDTYSTKEYLIKEGDLSPGAVDMIGDLLNEDSGYYVSFIESLKHDDIFAYEKRFDEIVDGMDKLPTAMYRDIQDKVHFNAQVIKIQQNDQKVTVVYETLSKETPSVTADYVIVCTTSRAVRLIKFNPPLLPKKAHALRSVHYRSGTKIFLTCTTKFWEDDGIHGGKSTTDLPSRFIYYPNHNFTNGVGVIIAYGIGDDANFFQALDFKDCADIVFNDLSLIHQLPKKDIQSFCYPSVIQKWSLDKYAMGGITTFTPYQFQHFSDPLTASQGRIYFAGEYTAQAHGWIDSTIKSGLRAARDVNLASENPSGIHLSNDNEL,./data/raw/alphafold//AF-P81382-F1-model_v4.pdb,1381,1496,3068,1821
+1427,4652,4709,MRSTLLAFALAVALPAAHTSAAEVPLPQLRAYTVDASWLQPMAPLQIADHTWQIGTEDLTALLVQTPDGAVLLDGGMPQMASHLLDNMKARGVTPRDLRLILLSHAHADHAGPVAELKRRTGAKVAANAESAVLLARGGSDDLHFGDGITYPPANADRIVMDGEVITVGGIVFTAHFMAGHTPGSTAWTWTDTRNGKPVRIAYADSLSAPGYQLQGNPRYPHLIEDYRRSFATVRALPCDVLLTPHPGASNWDYAAGARAGAKALTCKAYADAAEQKFDGQLAKETAGAR,sabio,P52700,CC(O)=N/C=C/S(=O)C1=C(C(=O)O)N2C(=O)/C(=C(\C)CO)[C@H]2C1.O>>,14.0,99.72173680754204,30.0,6.5,3.5.2.6,40324.0,1.146128035678238,CC(O)=N/C=C/S(=O)C1=C(C(=O)O)N2C(=O)/C(=C(\C)CO)[C@H]2C1.O,,1.146128035678238,CC(O)=N/C=C/S(=O)C1=C(C(=O)O)N2C(=O)/C(=C(\C)CO)[C@H]2C1.O__MRSTLLAFALAVALPAAHTSAAEVPLPQLRAYTVDASWLQPMAPLQIADHTWQIGTEDLTALLVQTPDGAVLLDGGMPQMASHLLDNMKARGVTPRDLRLILLSHAHADHAGPVAELKRRTGAKVAANAESAVLLARGGSDDLHFGDGITYPPANADRIVMDGEVITVGGIVFTAHFMAGHTPGSTAWTWTDTRNGKPVRIAYADSLSAPGYQLQGNPRYPHLIEDYRRSFATVRALPCDVLLTPHPGASNWDYAAGARAGAKALTCKAYADAAEQKFDGQLAKETAGAR,./data/raw/alphafold//AF-P52700-F1-model_v4.pdb,1443,3060,814,1074
+1428,16154,16381,MDLGLAGRRALVTGAGKGIGRSTVLALQAAGAQVVAVSRTREDLDSLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVATLQPFLEVTKEACDTSFNVNFRAVVQVSQIVARGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTPMGRANWSDPHKAKVMLDRIPLGKFAEVENVVDTILFLLSNRSSMTTGSALPVDGGFLAT,sabio,Q920P0,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.OCC(O)C(O)C(O)CO>>NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(CO)[C@H](O)[C@@H](O)CO.[H],41.0,6.956863536773207e-15,25.0,7.0,1.1.1.10,10116.0,1.6127838567197357,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.OCC(O)C(O)C(O)CO,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(CO)[C@H](O)[C@@H](O)CO.[H],1.6127838567197357,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.OCC(O)C(O)C(O)CO__MDLGLAGRRALVTGAGKGIGRSTVLALQAAGAQVVAVSRTREDLDSLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVATLQPFLEVTKEACDTSFNVNFRAVVQVSQIVARGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTPMGRANWSDPHKAKVMLDRIPLGKFAEVENVVDTILFLLSNRSSMTTGSALPVDGGFLAT,./data/raw/alphafold//AF-Q920P0-F1-model_v4.pdb,1316,3874,6191,848
+1429,16371,16599,MSNQEAIGLIDSGVGGLTVLKEALKQLPNERLIYLGDTARCPYGPRPAEQVVQFTWEMADFLLKKRIKMLVIACNTATAVALEEIKAALPIPVVGVILPGARAAVKVTKNNKIGVIGTLGTIKSASYEIAIKSKAPTIEVTSLDCPKFVPIVESNQYRSSVAKKIVAETLQALQLKGLDTLILGCTHYPLLRPVIQNVMGSHVTLIDSGAETVGEVSMLLDYFDIAHTPEAPTQPHEFYTTGSAKMFEEIASSWLGIENLKAQQIHLGGNEND,sabio,Q836J0,NC(CCC(=O)O)C(=O)O>>NC(CCC(=O)O)C(=O)O,90000.0,0.0,,8.0,5.1.1.3,1351.0,4.954242509439325,NC(CCC(=O)O)C(=O)O,NC(CCC(=O)O)C(=O)O,4.954242509439325,NC(CCC(=O)O)C(=O)O__MSNQEAIGLIDSGVGGLTVLKEALKQLPNERLIYLGDTARCPYGPRPAEQVVQFTWEMADFLLKKRIKMLVIACNTATAVALEEIKAALPIPVVGVILPGARAAVKVTKNNKIGVIGTLGTIKSASYEIAIKSKAPTIEVTSLDCPKFVPIVESNQYRSSVAKKIVAETLQALQLKGLDTLILGCTHYPLLRPVIQNVMGSHVTLIDSGAETVGEVSMLLDYFDIAHTPEAPTQPHEFYTTGSAKMFEEIASSWLGIENLKAQQIHLGGNEND,./data/raw/alphafold//AF-Q836J0-F1-model_v4.pdb,2657,5164,2304,5197
+1430,127,134,MASSNLIKQLQERGLVAQVTDEEALAERLAQGPIALYCGFDPTADSLHLGHLVPLLCLKRFQQAGHKPVALVGGATGLIGDPSFKAAERKLNTEETVQEWVDKIRKQVAPFLDFDCGENSAIAANNYDWFGNMNVLTFLRDIGKHFSVNQMINKEAVKQRLNREDQGISFTEFSYNLLQGYDFACLNKQYGVVLQIGGSDQWGNITSGIDLTRRLHQNQVFGLTVPLITKADGTKFGKTEGGAVWLDPKKTSPYKFYQFWINTADADVYRFLKFFTFMSIEEINALEEEDKNSGKAPRAQYVLAEQVTRLVHGEEGLQAAKRITECLFSGSLSALSEADFEQLAQDGVPMVEMEKGADLMQALVDSELQPSRGQARKTIASNAITINGEKQSDPEYFFKEEDRLFGRFTLLRRGKKNYCLICWK,sabio,P0AGJ9,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)C1O.NC(Cc1ccc(O)cc1)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(OC(=O)C(N)Cc3ccc(O)cc3)C2O)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,0.74,1.6888882608173565e-14,30.0,7.5,6.1.1.1,562.0,-0.1307682802690238,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)C1O.NC(Cc1ccc(O)cc1)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(OC(=O)C(N)Cc3ccc(O)cc3)C2O)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,-0.1307682802690238,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)C1O.NC(Cc1ccc(O)cc1)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MASSNLIKQLQERGLVAQVTDEEALAERLAQGPIALYCGFDPTADSLHLGHLVPLLCLKRFQQAGHKPVALVGGATGLIGDPSFKAAERKLNTEETVQEWVDKIRKQVAPFLDFDCGENSAIAANNYDWFGNMNVLTFLRDIGKHFSVNQMINKEAVKQRLNREDQGISFTEFSYNLLQGYDFACLNKQYGVVLQIGGSDQWGNITSGIDLTRRLHQNQVFGLTVPLITKADGTKFGKTEGGAVWLDPKKTSPYKFYQFWINTADADVYRFLKFFTFMSIEEINALEEEDKNSGKAPRAQYVLAEQVTRLVHGEEGLQAAKRITECLFSGSLSALSEADFEQLAQDGVPMVEMEKGADLMQALVDSELQPSRGQARKTIASNAITINGEKQSDPEYFFKEEDRLFGRFTLLRRGKKNYCLICWK,./data/raw/alphafold//AF-P0AGJ9-F1-model_v4.pdb,2683,467,107,115
+1431,1146,1173,MATLKEKLIAPVAEEEATVPNNKITVVGVGQVGMACAISILGKSLADELALVDVLEDKLKGEMMDLQHGSLFLQTPKIVADKDYSVTANSKIVVVTAGVRQQEGESRLNLVQRNVNVFKFIIPQIVKYSPDCIIIVVSNPVDILTYVTWKLSGLPKHRVIGSGCNLDSARFRYLMAEKLGIHPSSCHGWILGEHGDSSVAVWSGVNVAGVSLQELNPEMGTDNDSENWKEVHKMVVESAYEVIKLKGYTNWAIGLSVADLIESMLKNLSRIHPVSTMVKGMYGIENEVFLSLPCILNARGLTSVINQKLKDDEVAQLKKSADTLWDIQKDLKDL,sabio,P07195,CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]>>CC(O)C(=O)O.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)c1,143.0,7.528770100343302e-15,25.0,6.0,1.1.1.27,9606.0,2.155336037465062,CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],CC(O)C(=O)O.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)c1,5.892094602690481,CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]__MATLKEKLIAPVAEEEATVPNNKITVVGVGQVGMACAISILGKSLADELALVDVLEDKLKGEMMDLQHGSLFLQTPKIVADKDYSVTANSKIVVVTAGVRQQEGESRLNLVQRNVNVFKFIIPQIVKYSPDCIIIVVSNPVDILTYVTWKLSGLPKHRVIGSGCNLDSARFRYLMAEKLGIHPSSCHGWILGEHGDSSVAVWSGVNVAGVSLQELNPEMGTDNDSENWKEVHKMVVESAYEVIKLKGYTNWAIGLSVADLIESMLKNLSRIHPVSTMVKGMYGIENEVFLSLPCILNARGLTSVINQKLKDDEVAQLKKSADTLWDIQKDLKDL,./data/raw/alphafold//AF-P07195-F1-model_v4.pdb,1282,5245,1635,774
+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
+1433,8689,8825,MPPSDPIIVLGAGVIGLTTAVRLLEAHLGANVHILADHWPSDALDAQYASTIAGAHHLSFADDGDARQRRWDMRTFDVLYDEWKAVGERTGLMALTQTEMWEGATSHLAVYEGNPDFRVLDPRTAPCSNITHMVSFTSLTIAPTVYLAALEARVRDLGAKLHRAHVPSLGALRTDPALLALYTRPPAAVFVCAGLGARHLVPAPEAAALFPTRGQVVVVRAPWMRAGFTRQVGSLGGGEGGTRTYIIPRCNGEVVLGGTMEQGDWTPYPRDETVTDILTRALQICPDIAPPYARSWPKDDQVAALRSIVVRDAVGFRPSRAGGARVALASAAGMRVVYNYGHGGAGWQSCWGCAEDAVALWAGGAGGARL,brenda,Q75WF1,CN[C@H](CC(=O)O)C(=O)O.O.O=O>>CN.O=C(O)CC(=O)C(=O)O.OO,38.1,7.190163433666767e-15,37.0,7.5,1.4.3.1,5417.0,1.5809249756756194,CN[C@H](CC(=O)O)C(=O)O.O.O=O,CN.O=C(O)CC(=O)C(=O)O.OO,1.5809249756756194,CN[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
+1434,22601,22940,MKAMILAAGKGTRVRPITHTIPKPMIPILQKPVMEFLLELLRQHGFDQIMVNVSHLAEEIESYFRDGQRFGVQIAYSFEGNIVDGDLVGKALGSAGGLKKIQEFNPFFDDTFVVLCGDALIDLDLTTAVKLHREKGAIATIITKTVPQELVSSYGVVVTDDNGKILTFQEKPAVEEALSTEINTGIYIFEPEVIDYIPSGQEYDLGGDLFPKLVDSGLPFYAVNMDFEWVDIGKVPDYWQAIRGVLSREIKNVQIPGIEVRPGVYTGINVAANWDNIEIEGPVYIGGMTRIEDGVKIIGPSMIGPSCLICQGAVVDNSVIFEYSRLGPGARLVDKLVFGRYCVDKTGAAIDVQAAALDWLITDARHAAVQYRQEYPSQREISKLLQPE,brenda,P74285,O=P(O)(O)O[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)OP(=O)(O)O)[C@@H](O)[C@H]1O>>O=P(O)(O)OP(=O)(O)O.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,0.47,1.5264588328235512e-14,37.0,7.5,2.7.7.9,1143.0,-0.3279021420642826,O=P(O)(O)O[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)OP(=O)(O)O)[C@@H](O)[C@H]1O,O=P(O)(O)OP(=O)(O)O.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,-0.3279021420642826,O=P(O)(O)O[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)OP(=O)(O)O)[C@@H](O)[C@H]1O__MKAMILAAGKGTRVRPITHTIPKPMIPILQKPVMEFLLELLRQHGFDQIMVNVSHLAEEIESYFRDGQRFGVQIAYSFEGNIVDGDLVGKALGSAGGLKKIQEFNPFFDDTFVVLCGDALIDLDLTTAVKLHREKGAIATIITKTVPQELVSSYGVVVTDDNGKILTFQEKPAVEEALSTEINTGIYIFEPEVIDYIPSGQEYDLGGDLFPKLVDSGLPFYAVNMDFEWVDIGKVPDYWQAIRGVLSREIKNVQIPGIEVRPGVYTGINVAANWDNIEIEGPVYIGGMTRIEDGVKIIGPSMIGPSCLICQGAVVDNSVIFEYSRLGPGARLVDKLVFGRYCVDKTGAAIDVQAAALDWLITDARHAAVQYRQEYPSQREISKLLQPE,./data/raw/alphafold//AF-P74285-F1-model_v4.pdb,2071,4249,4126,3977
+1435,8003,8131,MTSYHSHPPKAYRRFESVCTQAPNAIAVVHEGKPVTYQQLQTQVLERSEALIRQGLADHPYMPLMANRCLEYLITMLACCKLGITYVSIEPSTPSKRLIAVLEQLGCNHLLLLGQPTDLRPDPTLTCFRLDDCGTLCSDGPALRQPIRRRLDDASVITVMFTSGTTGVPKGVRISQDGLLNLVDNVQQQVQGKPRSYVHHSSIGFDAALFEVWVPLLTGACVTLQPSEFNIDALDHCVRAASCDVLLLTTSLFHLVAQHRLSMLEAVRVLYVGGEVLKPVHARALLLANPRITLVNGYGPTENTVFSTWYSLNKPEDAERDVIPIGQFLHQVHGKIVDAKLQEVEVGTPGELLLTGANLALGYLDEALTPTRFLQLPEGTYYRTGDYVIQDEHGMLFYQGRIDEQVKIKGFRVEIAEVEHALTQLPGVAQAVVQAHVMNDLENSLHAFIVFRHGSPTIEESKLMSLLGDRLPHYMVPRRIHYLAELPLTANGKVDKRSLQPPEKAAVVSPQAGSAVLEIWSGILGTRNLQLEHSIYGYGASSLSVVMAHSRINEILGRTTPFDEVARLSTFQEWVQYYATHADPVTSLRSQHGNH,brenda,Q6TNA5,CC[C@@H](C)[C@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=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=P(O)(O)OP(=O)(O)O,0.0015,9.717024715041129,25.0,7.5,6.2.1.46,317.0,-2.8239087409443187,CC[C@@H](C)[C@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=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=P(O)(O)OP(=O)(O)O,-2.8239087409443187,CC[C@@H](C)[C@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MTSYHSHPPKAYRRFESVCTQAPNAIAVVHEGKPVTYQQLQTQVLERSEALIRQGLADHPYMPLMANRCLEYLITMLACCKLGITYVSIEPSTPSKRLIAVLEQLGCNHLLLLGQPTDLRPDPTLTCFRLDDCGTLCSDGPALRQPIRRRLDDASVITVMFTSGTTGVPKGVRISQDGLLNLVDNVQQQVQGKPRSYVHHSSIGFDAALFEVWVPLLTGACVTLQPSEFNIDALDHCVRAASCDVLLLTTSLFHLVAQHRLSMLEAVRVLYVGGEVLKPVHARALLLANPRITLVNGYGPTENTVFSTWYSLNKPEDAERDVIPIGQFLHQVHGKIVDAKLQEVEVGTPGELLLTGANLALGYLDEALTPTRFLQLPEGTYYRTGDYVIQDEHGMLFYQGRIDEQVKIKGFRVEIAEVEHALTQLPGVAQAVVQAHVMNDLENSLHAFIVFRHGSPTIEESKLMSLLGDRLPHYMVPRRIHYLAELPLTANGKVDKRSLQPPEKAAVVSPQAGSAVLEIWSGILGTRNLQLEHSIYGYGASSLSVVMAHSRINEILGRTTPFDEVARLSTFQEWVQYYATHADPVTSLRSQHGNH,./data/raw/alphafold//AF-Q6TNA5-F1-model_v4.pdb,1850,1544,3126,1892
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+1449,12316,12485,MTSQEKTEEYPFADIFDEDETERNFLLSKPVCFVVFGKPGVGKTTLARYITQAWKCIRVEALPILEEQIAAETESGVMLQSMLISGQSIPDELVIKLMLEKLNSPEVCHFGYIITEIPSLSQDAMTTLQQIELIKNLNLKPDVIINIKCPDYDLCQRISGQRQHNNTGYIYSRDQWDPEVIENHRKKKKEAQKDGKGEEEEEEEEQEEEEAFIAEMQMVAEILHHLVQRPEDYLENVENIVKLYKETILQTLEEVMAEHNPQYLIELNGNKPAEELFMIVMDRLKYLNLKRAAILTKLQGAEEEINDTMENDELFRTLASYKLIAPRYRWQRSKWGRTCPVNLKDGNIYSGLPDYSVSFLGKIYCLSSEEALKPFLLNPRPYLLPPMPGPPCKVFILGPQYSGKTTLCNMLAENYKGKVVDYAQLVQPRFDKARETLVENTIAEATAAAIKVVKEKLLRELQARKQAETALREFQRQYEKMEFGVFPMEATHSSIDEEGYIQGSQRDRGSSLVDTEEAKTKSENVLHDQAAKVDKDDGKETGETFTFKRHSQDASQDVKLYSDTAPTEDLIEEVTADHPEVVTMIEETIKMSQDINFEQPYEKHAEILQEVLGEVMEENKDRFPGAPKYGGWIVDNCPIVKELWMALIKKGIIPDLVIYLSDTENNGKCLFNRIYLQKKSEIDSKILERLLEELQKKKKEEEEARKATEEELRLEEENRRLLELMKVKAKEAEETDNEDEEEIEGDELEVHEEPEASHDTRGSWLPEEFEASEVPETEPEAVSEPIEETTVETEIPKGSKEGLEIEKLSETVVLPEFPEDSYPDVPEMEPFKEKIGSFIILWKQLEATISEAYIKILNLEIADRTPQELLQKVVETMEKPFQYTAWELTGEDYEEETEDYQTEAEVDEELEEEEEEEGEDKMKERKRHLGDTKHFCPVVLKENFILQPGNTEEAAKYREKIYYFSSAEAKEKFLEHPEDYVAHEEPLKAPPLRICLVGPQGSGKTMCGRQLAEKLNIFHIQFEEVLQEKLLLKTEKKVGPEFEEDSENEQAAKQELEELAIQANVKVEEENTKKQLPEVQLTEEEEVIKSSLMENEPLPPEILEVILSEWWLKEPIRSTGFILDGFPRYPEEAQFLGDRGFFPDAAVFIQVDDQDIFDRLLPAQIEKWKLKQKKKLERKKLIKDMKAKIRVDTIAKRRAELILERDKKRRENVVRDDEEISEEELEEDNDDIENILEDEFPKDEEEMSGEEDEEQETDAIERLRGELGEKFEADTHNLQIIQDELERYLIPIISINGARRNHIVQYTLNMKLKPLVENRASIFEKCHPIPAPLAQKMLTFTYKYISSFGYWDPVKLSEGETIKPVENAENPIYPVIHRQYIYFLSSKETKEKFMKNPIKYIRQPKPKPTVPIRIIIVGPPKSGKTTVAKKITSEYGLKHLSIGGALRYVLNNHPETELALMLNWHLHKGMTAPDELAIQALELSLMESVCNTAGVVIDGYPVTKHQMNLLEARSIIPMVIFELSVPSKEIFKRLLLEKENEQRLPYPLHNSAQIVAVNNVKYRKNIGEIRQYYQEQHQNWYVIDGFHSKWWVWNEVIKNVQMVNKYMQTYLERIKAGKAACIDKLCITPQELLSRLGEFEQFCPVSLAESQELFDCSATDSLEFAAEFRGHYYKMSSQEKLNKFLENPELYVPPLAPHPLPSADMIPKRLTLSELKSRFPKCAELQGYCPVTYKDGNQRYEALVPGSINYALEYHNRIYICENKEKLQKFLRSPLKYWEQKLPHKLPPLREPILLTSLPLPGYLEQGIATSLIKAMNAAGCLKPKFPFLSIRRSALLYIALHLKAFNPKGSEYTRKKYKKKMEQFMESCELITYLGAKMTRKYKEPQFRAIDFDHKLKTFLSLRNIDPING,uniprot_search,Q5TCS8,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)c(=O)nc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,1.25,0.0,37.0,7.4,2.7.4.4,9606.0,0.0969100130080564,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)c(=O)nc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.0969100130080564,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)c(=O)nc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MTSQEKTEEYPFADIFDEDETERNFLLSKPVCFVVFGKPGVGKTTLARYITQAWKCIRVEALPILEEQIAAETESGVMLQSMLISGQSIPDELVIKLMLEKLNSPEVCHFGYIITEIPSLSQDAMTTLQQIELIKNLNLKPDVIINIKCPDYDLCQRISGQRQHNNTGYIYSRDQWDPEVIENHRKKKKEAQKDGKGEEEEEEEEQEEEEAFIAEMQMVAEILHHLVQRPEDYLENVENIVKLYKETILQTLEEVMAEHNPQYLIELNGNKPAEELFMIVMDRLKYLNLKRAAILTKLQGAEEEINDTMENDELFRTLASYKLIAPRYRWQRSKWGRTCPVNLKDGNIYSGLPDYSVSFLGKIYCLSSEEALKPFLLNPRPYLLPPMPGPPCKVFILGPQYSGKTTLCNMLAENYKGKVVDYAQLVQPRFDKARETLVENTIAEATAAAIKVVKEKLLRELQARKQAETALREFQRQYEKMEFGVFPMEATHSSIDEEGYIQGSQRDRGSSLVDTEEAKTKSENVLHDQAAKVDKDDGKETGETFTFKRHSQDASQDVKLYSDTAPTEDLIEEVTADHPEVVTMIEETIKMSQDINFEQPYEKHAEILQEVLGEVMEENKDRFPGAPKYGGWIVDNCPIVKELWMALIKKGIIPDLVIYLSDTENNGKCLFNRIYLQKKSEIDSKILERLLEELQKKKKEEEEARKATEEELRLEEENRRLLELMKVKAKEAEETDNEDEEEIEGDELEVHEEPEASHDTRGSWLPEEFEASEVPETEPEAVSEPIEETTVETEIPKGSKEGLEIEKLSETVVLPEFPEDSYPDVPEMEPFKEKIGSFIILWKQLEATISEAYIKILNLEIADRTPQELLQKVVETMEKPFQYTAWELTGEDYEEETEDYQTEAEVDEELEEEEEEEGEDKMKERKRHLGDTKHFCPVVLKENFILQPGNTEEAAKYREKIYYFSSAEAKEKFLEHPEDYVAHEEPLKAPPLRICLVGPQGSGKTMCGRQLAEKLNIFHIQFEEVLQEKLLLKTEKKVGPEFEEDSENEQAAKQELEELAIQANVKVEEENTKKQLPEVQLTEEEEVIKSSLMENEPLPPEILEVILSEWWLKEPIRSTGFILDGFPRYPEEAQFLGDRGFFPDAAVFIQVDDQDIFDRLLPAQIEKWKLKQKKKLERKKLIKDMKAKIRVDTIAKRRAELILERDKKRRENVVRDDEEISEEELEEDNDDIENILEDEFPKDEEEMSGEEDEEQETDAIERLRGELGEKFEADTHNLQIIQDELERYLIPIISINGARRNHIVQYTLNMKLKPLVENRASIFEKCHPIPAPLAQKMLTFTYKYISSFGYWDPVKLSEGETIKPVENAENPIYPVIHRQYIYFLSSKETKEKFMKNPIKYIRQPKPKPTVPIRIIIVGPPKSGKTTVAKKITSEYGLKHLSIGGALRYVLNNHPETELALMLNWHLHKGMTAPDELAIQALELSLMESVCNTAGVVIDGYPVTKHQMNLLEARSIIPMVIFELSVPSKEIFKRLLLEKENEQRLPYPLHNSAQIVAVNNVKYRKNIGEIRQYYQEQHQNWYVIDGFHSKWWVWNEVIKNVQMVNKYMQTYLERIKAGKAACIDKLCITPQELLSRLGEFEQFCPVSLAESQELFDCSATDSLEFAAEFRGHYYKMSSQEKLNKFLENPELYVPPLAPHPLPSADMIPKRLTLSELKSRFPKCAELQGYCPVTYKDGNQRYEALVPGSINYALEYHNRIYICENKEKLQKFLRSPLKYWEQKLPHKLPPLREPILLTSLPLPGYLEQGIATSLIKAMNAAGCLKPKFPFLSIRRSALLYIALHLKAFNPKGSEYTRKKYKKKMEQFMESCELITYLGAKMTRKYKEPQFRAIDFDHKLKTFLSLRNIDPING,./data/raw/alphafold//AF-Q5TCS8-F1-model_v4.pdb,2054,4224,4097,3945
+1450,14060,14242,MQTYTPYSEAMVFSMLEHAHAAHLAWRQVPLHERTALLLKLADVLRENSESYARLMTEETGKTIRAARAEIEKCAWACEIYADKAAAWLAEEEIAADGIKHRVVIEPLGVILAVMPWNFPFWQVMRFLIPALLAGNGALLKHATNVTGSALKIQEAVNEAGFPKGLFVTLLVSHTVVEQVIAHPLCQGVSLTGSAEAGRAVASVAGRHLKKVVLELGGSDPFIVLGDADIPAAAKAAVIGRFQNNGQSCIAAKRLIVLKEIEEVFTSTLLAEVEKLVVGDPLDEATDIGPLVSEQAAETMEQFVLDAVAKGAMVRTGGTRKGAYFTPTVLTGVHSAMEVMTQEVFGPVLPVITADTVEEAITLANATRFGLGASVWSRDLEKGEQVARQLAAGATFVNSITKSDPRMPFGGIRESGLGRELSYWGVREFANIKTVNVYGGEEV,brenda,Q82TA7,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.O.O=CCCC(=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.O=C(O)CCC(=O)O.[H+],0.583,7.240812448354101e-15,30.0,8.5,1.2.1.16,915.0,-0.2343314452409859,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.O.O=CCCC(=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.O=C(O)CCC(=O)O.[H+],-0.2343314452409859,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.O.O=CCCC(=O)O__MQTYTPYSEAMVFSMLEHAHAAHLAWRQVPLHERTALLLKLADVLRENSESYARLMTEETGKTIRAARAEIEKCAWACEIYADKAAAWLAEEEIAADGIKHRVVIEPLGVILAVMPWNFPFWQVMRFLIPALLAGNGALLKHATNVTGSALKIQEAVNEAGFPKGLFVTLLVSHTVVEQVIAHPLCQGVSLTGSAEAGRAVASVAGRHLKKVVLELGGSDPFIVLGDADIPAAAKAAVIGRFQNNGQSCIAAKRLIVLKEIEEVFTSTLLAEVEKLVVGDPLDEATDIGPLVSEQAAETMEQFVLDAVAKGAMVRTGGTRKGAYFTPTVLTGVHSAMEVMTQEVFGPVLPVITADTVEEAITLANATRFGLGASVWSRDLEKGEQVARQLAAGATFVNSITKSDPRMPFGGIRESGLGRELSYWGVREFANIKTVNVYGGEEV,./data/raw/alphafold//AF-Q82TA7-F1-model_v4.pdb,2372,4680,4716,4550
+1451,10786,10941,MAAIRFLVLAFLFACGASEPINEKEGRIIGGTTTTITSYPYIASLHKGTEHICGATIINSEWLVTAASCISIPNAREYLVRVGSTYSSSGGNVYQVSKIYRHEFDLNTMDNDIALVRLSTGVIFGTNVQSITLQESDVSDGTSATVLGWGTISEGGAQSNILKQVVVPVVGFHSCNTSYATYGGITDNMLCAGYNEGGVDACQGDTGGPLVASGHLIGIVSWGAGCGHSTFPGVYTKVSAYRDWIKDKTGV,uniprot_search,A0A059WCN6,C[C@H](N=C(O)CN=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCCN)N=C(O)CN=C(O)[C@H](C)N=C(O)c1ccccc1N)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>C[C@H](N=C(O)CN)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].C[C@H](N=C(O)c1ccccc1N)C(O)=NCC(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O,117000.0,2.0866881182045794e-14,30.0,8.5,3.4.21.4,6978.0,5.068185861746161,C[C@H](N=C(O)CN=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCCN)N=C(O)CN=C(O)[C@H](C)N=C(O)c1ccccc1N)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,C[C@H](N=C(O)CN)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].C[C@H](N=C(O)c1ccccc1N)C(O)=NCC(O)=N[C@@H](CCCCN)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O,5.068185861746161,C[C@H](N=C(O)CN=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCCN)N=C(O)CN=C(O)[C@H](C)N=C(O)c1ccccc1N)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MAAIRFLVLAFLFACGASEPINEKEGRIIGGTTTTITSYPYIASLHKGTEHICGATIINSEWLVTAASCISIPNAREYLVRVGSTYSSSGGNVYQVSKIYRHEFDLNTMDNDIALVRLSTGVIFGTNVQSITLQESDVSDGTSATVLGWGTISEGGAQSNILKQVVVPVVGFHSCNTSYATYGGITDNMLCAGYNEGGVDACQGDTGGPLVASGHLIGIVSWGAGCGHSTFPGVYTKVSAYRDWIKDKTGV,./data/raw/alphafold//AF-A0A059WCN6-F1-model_v4.pdb,1862,1558,3143,1914
+1452,1424,1452,MKSTALLWFPVVRNSKGVAVWQESNRIKFPKGKSERRFAFHKSPAVYALIFTLYIFYARIRTDRDKNYKPIWARLSANQEEAATLPDRSQLTKYFFFNILVHKSVQIKTLVKEPPPETNDFYFQQTMLRIKDPRKTLPFYCNVLGMRLLKQMDYPDGKFSLYFVGYKPASEIPNDPIEQKRYALSTLATIELTHNWGTENDPNFNYHNGNKEPRGFGHIGIAVKDVYAACKRFEELGVQFVKKPDDGRMKGLAFIQDPDGYWIEIFNPHTV,uniprot_search,A0A8R1XMM4,CC(=O)C=O.NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O>>CC(O)C(=O)SCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O,714000.0,1.4963086480281983e-14,,6.6,4.4.1.5,6282.0,5.853698211776175,CC(=O)C=O.NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O,CC(O)C(=O)SCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O,5.853698211776175,CC(=O)C=O.NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O__MKSTALLWFPVVRNSKGVAVWQESNRIKFPKGKSERRFAFHKSPAVYALIFTLYIFYARIRTDRDKNYKPIWARLSANQEEAATLPDRSQLTKYFFFNILVHKSVQIKTLVKEPPPETNDFYFQQTMLRIKDPRKTLPFYCNVLGMRLLKQMDYPDGKFSLYFVGYKPASEIPNDPIEQKRYALSTLATIELTHNWGTENDPNFNYHNGNKEPRGFGHIGIAVKDVYAACKRFEELGVQFVKKPDDGRMKGLAFIQDPDGYWIEIFNPHTV,./data/raw/esmfold//ESMFold-A0A8R1XMM4-v1.pdb,1337,825,615,902
+1453,21328,21652,MKLEGKKVTVHDMTLRDGMHPKRHQMTLEQMKSIACGLDAAGIPLIEVTHGDGLGGSSVNYGFPAHSDEEYLGAVIPLMKQAKVSALLLPGIGTVEHLKMAKDLGVNTIRVATHCTEADVSEQHITQSRKLGLDTVGFLMMAHMASPEKLVSQALLMQGYGANCIYVTDSAGYMLPDDVKARLSAVRAALKPETELGFHGHHNLAMGVANSIAAIEAGATRIDAAAAGLGAGAGNTPMEVFIAVCARMGIETGVDVFKIQDVAEDLVVPIMDHVIRIDRDSLTLGYAGVYSSFLLFAKRASAKYGVPARDILVELGRRGMVGGQEDMIEDTAMTMARERGLTLTAA,brenda,P51015,O=C(O)CC(=O)C(=O)O>>CC(=O)C(=O)O.O=C=O,16.5,1.0719429373846476e-14,25.0,8.0,4.1.3.43,36873.0,1.2174839442139065,O=C(O)CC(=O)C(=O)O,CC(=O)C(=O)O.O=C=O,1.2174839442139065,O=C(O)CC(=O)C(=O)O__MKLEGKKVTVHDMTLRDGMHPKRHQMTLEQMKSIACGLDAAGIPLIEVTHGDGLGGSSVNYGFPAHSDEEYLGAVIPLMKQAKVSALLLPGIGTVEHLKMAKDLGVNTIRVATHCTEADVSEQHITQSRKLGLDTVGFLMMAHMASPEKLVSQALLMQGYGANCIYVTDSAGYMLPDDVKARLSAVRAALKPETELGFHGHHNLAMGVANSIAAIEAGATRIDAAAAGLGAGAGNTPMEVFIAVCARMGIETGVDVFKIQDVAEDLVVPIMDHVIRIDRDSLTLGYAGVYSSFLLFAKRASAKYGVPARDILVELGRRGMVGGQEDMIEDTAMTMARERGLTLTAA,./data/raw/alphafold//AF-P51015-F1-model_v4.pdb,3387,385,18,21
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+1476,6635,6748,MTNIAKAQPKLYVMDNGRMRMDKNWMIAMHNPATIANPNAPTEFIEFPIYTVLIDHPEGKILFDTSCNPDSMGAQGRWGEATQSMFPWTASEECYLHNRLEQLKVRPEDIKFVIASHLHLDHAGCLEMFTNATIIVHEDEFSGALQTYARNQTEGAYIWGDIDAWIKNNLNWRTIKRDEDNIVLAEGIKILNFGSGHAWGMLGLHVQLPEKGGIILASDAVYSAESYGPPIKPPGIIYDSLGFVRSVEKIKRIAKETNSEVWFGHDSEQFKRFRKSTEGYYE,brenda,T0BMH6,CCCC1CCC(=O)O1.O>>CCCC(O)CCC(=O)O,7.0,9.687942077091209e-15,25.0,8.3,3.1.1.81,1450.0,0.8450980400142568,CCCC1CCC(=O)O1.O,CCCC(O)CCC(=O)O,0.8450980400142568,CCCC1CCC(=O)O1.O__MTNIAKAQPKLYVMDNGRMRMDKNWMIAMHNPATIANPNAPTEFIEFPIYTVLIDHPEGKILFDTSCNPDSMGAQGRWGEATQSMFPWTASEECYLHNRLEQLKVRPEDIKFVIASHLHLDHAGCLEMFTNATIIVHEDEFSGALQTYARNQTEGAYIWGDIDAWIKNNLNWRTIKRDEDNIVLAEGIKILNFGSGHAWGMLGLHVQLPEKGGIILASDAVYSAESYGPPIKPPGIIYDSLGFVRSVEKIKRIAKETNSEVWFGHDSEQFKRFRKSTEGYYE,./data/raw/alphafold//AF-T0BMH6-F1-model_v4.pdb,3255,2082,3740,2596
+1477,17662,17904,MIFAKGHGTQNDFVLLPDVDAELVLTAARVAALCDRRKGLGADGVLRVTTAGAAQAVGVLDSLPEGVRVTDWYMDYRNADGSAAQMCGNGVRVFAHYLRASGLEVRDEFVVGSLAGPRPVTCHHVEAAYADVSVDMGKANRLGAGEAVVGGRRFHGLAVDVGNPHLACVDSQLTVDGLAALDVGAPVSFDGAQFPDGVNVEVLTAPVDGAVWMRVHERGVGETRSCGTGTVAAAVAALAAVGSPTGTLTVHVPGGEVVVTVTDATSFLRGPSVLVARGDLADDWWNAMG,brenda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data/raw/alphafold//AF-P9WP19-F1-model_v4.pdb,2821,2395,2671,5512
+1478,4857,4927,MHFSTLFGAAATAALAGSTNASPLARRQVPVGTPILQCTQPGLVALTYDDGPFTFTPQLLDILKQNDVRATFFVNGNNWANIEAGSNPDTIRRMRADGHLVGSHTYAHPDLNTLSSADRISQMRHVEEATRRIDGFAPKYMRAPYLSCDAGCQGDLGGLGYHIIDTNLDTKDYENNKPETTHLSAEKFNNELSADVGANSYIVLSHDVHEQTVVSLTQKLIDTLKSKGYRAVTVGECLGDAPENWYKA,uniprot_search,Q6DWK3,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]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4N=C(C)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.O>>CC(=O)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]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4N=C(C)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,7.0,2.415018765989009,30.0,8.5,3.5.1.41,290576.0,0.8450980400142568,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]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4N=C(C)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.O,CC(=O)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]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4N=C(C)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,0.8450980400142568,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]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4N=C(C)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.O__MHFSTLFGAAATAALAGSTNASPLARRQVPVGTPILQCTQPGLVALTYDDGPFTFTPQLLDILKQNDVRATFFVNGNNWANIEAGSNPDTIRRMRADGHLVGSHTYAHPDLNTLSSADRISQMRHVEEATRRIDGFAPKYMRAPYLSCDAGCQGDLGGLGYHIIDTNLDTKDYENNKPETTHLSAEKFNNELSADVGANSYIVLSHDVHEQTVVSLTQKLIDTLKSKGYRAVTVGECLGDAPENWYKA,./data/raw/alphafold//AF-Q6DWK3-F1-model_v4.pdb,3006,1750,3369,2176
+1479,6804,6918,MTSSSSEHPQIPLPLKPIPGSYGFPIFGPIIDRYHYFYIQGRETFFRSRMAKYNSTVFRTNMPPGPFISSNSKVIVLLDALTFPILFDTTKVEKRNVLDGTYMPSLAFTGGIRTCAFLDPSETEHSVLKRHFLKFLASRHHQFIPLFRTSISEMFDKLEKELQNNNVANFNPISDYASFDFIFRLLSDRSPDKNFSSEGPGLVDRWLTMQLAPLATLGLPKIFSCFEDLIIHTFRLPFALVKSAYRKLYESFYESSGSFLDEAEKQGINREKACHNLVFLAGFNAYAGMKVLLPILLNWVGSAGEELHRKLVGEIRAAVKIDGGITFGALEKMSLLKSVVYEVLRIDPPVPYQYAKAKQDIVIESHDSAFEIKKGEMIFGYQPIATKDPKVFENAEEFVGERFVGEKGEKLLKYVYWSNGRETEEPTAENKQCPARDLVVLMCRVVLVELFLRYDTFTVEGTRSSLGWSVKVKSLTKA,brenda,A0A0A0K2U8,CCCCC/C=C\C=C\[C@H](CCCCCCCC(=O)O)OO>>CCCCC/C=C\C=C1/O[C@H]1CCCCCCCC(=O)O.O,455.3,0.0,23.0,7.0,4.2.1.92,3659.0,2.6582976503081897,CCCCC/C=C\C=C\[C@H](CCCCCCCC(=O)O)OO,CCCCC/C=C\C=C1/O[C@H]1CCCCCCCC(=O)O.O,2.6582976503081897,CCCCC/C=C\C=C\[C@H](CCCCCCCC(=O)O)OO__MTSSSSEHPQIPLPLKPIPGSYGFPIFGPIIDRYHYFYIQGRETFFRSRMAKYNSTVFRTNMPPGPFISSNSKVIVLLDALTFPILFDTTKVEKRNVLDGTYMPSLAFTGGIRTCAFLDPSETEHSVLKRHFLKFLASRHHQFIPLFRTSISEMFDKLEKELQNNNVANFNPISDYASFDFIFRLLSDRSPDKNFSSEGPGLVDRWLTMQLAPLATLGLPKIFSCFEDLIIHTFRLPFALVKSAYRKLYESFYESSGSFLDEAEKQGINREKACHNLVFLAGFNAYAGMKVLLPILLNWVGSAGEELHRKLVGEIRAAVKIDGGITFGALEKMSLLKSVVYEVLRIDPPVPYQYAKAKQDIVIESHDSAFEIKKGEMIFGYQPIATKDPKVFENAEEFVGERFVGEKGEKLLKYVYWSNGRETEEPTAENKQCPARDLVVLMCRVVLVELFLRYDTFTVEGTRSSLGWSVKVKSLTKA,./data/raw/alphafold//AF-A0A0A0K2U8-F1-model_v4.pdb,3119,1891,3527,2346
+1480,14908,15117,MAKITTVIDIGSNSVRLAIFKKTSQFGFYLLFETKSKVRISEGCYAFNGILQEIPMQRAVKALSEFKEIALKYKSKKILCVATSAVRDAPNRLEFVARVKKACGLQIKIIDGQKEALYGGIACANLLHKNSGITIDIGGGSTECALIEKGKIKDLISLDVGTIRIKEMFLDKDLEVKLAKAFIQKEVSKLPFKHKNAFGVGGTIRALSKILMKRFDYPIDSLHGYEIDAYKNLAFIEKIVMLKEDQLRLLGVNEERLDSIRSGALILSVVLEHLKTSLMITSGVGVREGVFLSDLLRHHYHKFPPNINPSLISLKDRFLPHEKHSQKVKKECVKLFEALSPLHKIDEKYLFHLKIAGELASMGKILSVYLAHKHSAYFILNALSYGFSHQDRAIICLLAQFSHKKIPKDNAIAHMSAMMPSLLTLQWLSFILSLAENLCLTDSHHLKYTLEKNKLVIHSNDALYLAKEMLPKLVKPIPLTIEFA,brenda,C7BYL8,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](OP(=O)(O)OP(=O)(O)O)[C@H]3O)c2[nH]1.O>>N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](OP(=O)(O)OP(=O)(O)O)[C@H]3O)c2[nH]1.O=P(O)(O)O,0.044,8.101346085222634e-15,37.0,7.4,3.6.1.40,210.0,-1.3565473235138126,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](OP(=O)(O)OP(=O)(O)O)[C@H]3O)c2[nH]1.O,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](OP(=O)(O)OP(=O)(O)O)[C@H]3O)c2[nH]1.O=P(O)(O)O,-1.3565473235138126,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](OP(=O)(O)OP(=O)(O)O)[C@H]3O)c2[nH]1.O__MAKITTVIDIGSNSVRLAIFKKTSQFGFYLLFETKSKVRISEGCYAFNGILQEIPMQRAVKALSEFKEIALKYKSKKILCVATSAVRDAPNRLEFVARVKKACGLQIKIIDGQKEALYGGIACANLLHKNSGITIDIGGGSTECALIEKGKIKDLISLDVGTIRIKEMFLDKDLEVKLAKAFIQKEVSKLPFKHKNAFGVGGTIRALSKILMKRFDYPIDSLHGYEIDAYKNLAFIEKIVMLKEDQLRLLGVNEERLDSIRSGALILSVVLEHLKTSLMITSGVGVREGVFLSDLLRHHYHKFPPNINPSLISLKDRFLPHEKHSQKVKKECVKLFEALSPLHKIDEKYLFHLKIAGELASMGKILSVYLAHKHSAYFILNALSYGFSHQDRAIICLLAQFSHKKIPKDNAIAHMSAMMPSLLTLQWLSFILSLAENLCLTDSHHLKYTLEKNKLVIHSNDALYLAKEMLPKLVKPIPLTIEFA,./data/raw/alphafold//AF-C7BYL8-F1-model_v4.pdb,2519,4954,2030,4884
+1481,1502,1530,MASRLLLNNGAKMPILGLGTWKSPPGQVTEAVKVAIDVGYRHIDCAHVYQNENEVGVAIQEKLREQVVKREELFIVSKLWCTYHEKGLVKGACQKTLSDLKLDYLDLYLIHWPTGFKPGKEFFPLDESGNVVPSDTNILDTWAAMEELVDEGLVKAIGISNFNHLQVEMILNKPGLKYKPAVNQIECHPYLTQEKLIQYCQSKGIVVTAYSPLGSPDRPWAKPEDPSLLEDPRIKAIAAKHNKTTAQVLIRFPMQRNLVVIPKSVTPERIAENFKVFDFELSSQDMTTLLSYNRNWRVCALLSCTSHKDYPFHEEF,sabio,P15121,CC(=O)CO.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)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)c1,4380.0,0.0,25.0,7.0,1.1.1.21,9606.0,3.6414741105041,CC(=O)CO.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)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)c1,3.6414741105041,CC(=O)CO.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]__MASRLLLNNGAKMPILGLGTWKSPPGQVTEAVKVAIDVGYRHIDCAHVYQNENEVGVAIQEKLREQVVKREELFIVSKLWCTYHEKGLVKGACQKTLSDLKLDYLDLYLIHWPTGFKPGKEFFPLDESGNVVPSDTNILDTWAAMEELVDEGLVKAIGISNFNHLQVEMILNKPGLKYKPAVNQIECHPYLTQEKLIQYCQSKGIVVTAYSPLGSPDRPWAKPEDPSLLEDPRIKAIAAKHNKTTAQVLIRFPMQRNLVVIPKSVTPERIAENFKVFDFELSSQDMTTLLSYNRNWRVCALLSCTSHKDYPFHEEF,./data/raw/alphafold//AF-P15121-F1-model_v4.pdb,1329,607,3631,676
+1482,551,568,MACSSSLSSKWASWGASSRPHPSVQPFVTRKNVVRYHKPTSELSYSPLTTTLSSNLDSQFMQVYETLKSELIHDPSFEFDDDSRQWVERMIDYNVPGGKMVRGYSVVDSYQLLKGEELTEDEAFLACALGWCTEWLQAFILVLDDIMDGSHTRRGQPCWFRLPEVGVVAINDGVLLRNHVHRILKKYFQGKPYYVHLLDLFNETEFQTISGQMIDTICRLAGQKDLSKYTMTLNRRIVQYKGSYYSCYLPIACALLMFGENLEDHVQVKDILVELGMYYQIQNDYLDTFGDPDVFGKTGTDIEECKCSWLIAKALELANEEQKKILSENYGINDPSKVAKVKELYHALDLKGAYEDYETNLYETSMTSIKAHPNIAVQAVLKSCLEKMYKGHK,brenda,P0C565,C=C(C)CCOP(=O)(O)OP(=O)(O)O.CC(C)=CCOP(=O)(O)OP(=O)(O)O>>CC(C)=CCC/C(C)=C/COP(=O)(O)OP(=O)(O)O.O=P(O)(O)OP(=O)(O)O,0.008,5.768750239586432e-15,30.0,7.5,2.5.1.67,118510.0,-2.096910013008056,C=C(C)CCOP(=O)(O)OP(=O)(O)O.CC(C)=CCOP(=O)(O)OP(=O)(O)O,CC(C)=CCC/C(C)=C/COP(=O)(O)OP(=O)(O)O.O=P(O)(O)OP(=O)(O)O,-2.096910013008056,C=C(C)CCOP(=O)(O)OP(=O)(O)O.CC(C)=CCOP(=O)(O)OP(=O)(O)O__MACSSSLSSKWASWGASSRPHPSVQPFVTRKNVVRYHKPTSELSYSPLTTTLSSNLDSQFMQVYETLKSELIHDPSFEFDDDSRQWVERMIDYNVPGGKMVRGYSVVDSYQLLKGEELTEDEAFLACALGWCTEWLQAFILVLDDIMDGSHTRRGQPCWFRLPEVGVVAINDGVLLRNHVHRILKKYFQGKPYYVHLLDLFNETEFQTISGQMIDTICRLAGQKDLSKYTMTLNRRIVQYKGSYYSCYLPIACALLMFGENLEDHVQVKDILVELGMYYQIQNDYLDTFGDPDVFGKTGTDIEECKCSWLIAKALELANEEQKKILSENYGINDPSKVAKVKELYHALDLKGAYEDYETNLYETSMTSIKAHPNIAVQAVLKSCLEKMYKGHK,./data/raw/alphafold//AF-P0C565-F1-model_v4.pdb,1106,683,366,413
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+1484,19150,19436,MWKRSEQMKIKSGKCNMAAAMETEQLGVEIFETADCEENIESQDRPKLEPFYVERYSWSQLKKLLADTRKYHGYMMAKAPHDFMFVKRNDPDGPHSDRIYYLAMSGENRENTLFYSEIPKTINRAAVLMLSWKPLLDLFQATLDYGMYSREEELLRERKRIGTVGIASYDYHQGSGTFLFQAGSGIYHVKDGGPQGFTQQPLRPNLVETSCPNIRMDPKLCPADPDWIAFIHSNDIWISNIVTREERRLTYVHNELANMEEDARSAGVATFVLQEEFDRYSGYWWCPKAETTPSGGKILRILYEENDESEVEIIHVTSPMLETRRADSFRYPKTGTANPKVTFKMSEIMIDAEGRIIDVIDKELIQPFEILFEGVEYIARAGWTPEGKYAWSILLDRSQTRLQIVLISPELFIPVEDDVMERQRLIESVPDSVTPLIIYEETTDIWINIHDIFHVFPQSHEEEIEFIFASECKTGFRHLYKITSILKESKYKRSSGGLPAPSDFKCPIKEEIAITSGEWEVLGRHGSNIQVDEVRRLVYFEGTKDSPLEHHLYVVSYVNPGEVTRLTDRGYSHSCCISQHCDFFISKYSNQKNPHCVSLYKLSSPEDDPTCKTKEFWATILDSAGPLPDYTPPEIFSFESTTGFTLYGMLYKPHDLQPGKKYPTVLFIYGGPQVQLVNNRFKGVKYFRLNTLASLGYVVVVIDNRGSCHRGLKFEGAFKYKMGQIEIDDQVEGLQYLASRYDFIDLDRVGIHGWSYGGYLSLMALMQRSDIFRVAIAGAPVTLWIFYDTGYTERYMGHPDQNEQGYYLGSVAMQAEKFPSEPNRLLLLHGFLDENVHFAHTSILLSFLVRAGKPYDLQIYPQERHSIRVPESGEHYELHLLHYLQENLGSRIAALKVI,sabio,Q6V1X1,O.O=C(NCC(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1)OCc1ccccc1>>NCC(=O)N1CCC[C@H]1C(=O)O.Nc1ccc([N+](=O)[O-])cc1,62.0,17.748367855148658,25.0,7.5,3.4.14.5,9606.0,1.792391689498254,O.O=C(NCC(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1)OCc1ccccc1,NCC(=O)N1CCC[C@H]1C(=O)O.Nc1ccc([N+](=O)[O-])cc1,1.792391689498254,O.O=C(NCC(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1)OCc1ccccc1__MWKRSEQMKIKSGKCNMAAAMETEQLGVEIFETADCEENIESQDRPKLEPFYVERYSWSQLKKLLADTRKYHGYMMAKAPHDFMFVKRNDPDGPHSDRIYYLAMSGENRENTLFYSEIPKTINRAAVLMLSWKPLLDLFQATLDYGMYSREEELLRERKRIGTVGIASYDYHQGSGTFLFQAGSGIYHVKDGGPQGFTQQPLRPNLVETSCPNIRMDPKLCPADPDWIAFIHSNDIWISNIVTREERRLTYVHNELANMEEDARSAGVATFVLQEEFDRYSGYWWCPKAETTPSGGKILRILYEENDESEVEIIHVTSPMLETRRADSFRYPKTGTANPKVTFKMSEIMIDAEGRIIDVIDKELIQPFEILFEGVEYIARAGWTPEGKYAWSILLDRSQTRLQIVLISPELFIPVEDDVMERQRLIESVPDSVTPLIIYEETTDIWINIHDIFHVFPQSHEEEIEFIFASECKTGFRHLYKITSILKESKYKRSSGGLPAPSDFKCPIKEEIAITSGEWEVLGRHGSNIQVDEVRRLVYFEGTKDSPLEHHLYVVSYVNPGEVTRLTDRGYSHSCCISQHCDFFISKYSNQKNPHCVSLYKLSSPEDDPTCKTKEFWATILDSAGPLPDYTPPEIFSFESTTGFTLYGMLYKPHDLQPGKKYPTVLFIYGGPQVQLVNNRFKGVKYFRLNTLASLGYVVVVIDNRGSCHRGLKFEGAFKYKMGQIEIDDQVEGLQYLASRYDFIDLDRVGIHGWSYGGYLSLMALMQRSDIFRVAIAGAPVTLWIFYDTGYTERYMGHPDQNEQGYYLGSVAMQAEKFPSEPNRLLLLHGFLDENVHFAHTSILLSFLVRAGKPYDLQIYPQERHSIRVPESGEHYELHLLHYLQENLGSRIAALKVI,./data/raw/alphafold//AF-Q6V1X1-F1-model_v4.pdb,230,2749,5061,5919
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+1526,7371,7493,MCLSFLFLVSLATCVVYGNPSSPPVVDTTKGKVLGKYVSLEGVTQSVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTTYPPMCSQDAAKGQRMNDLLTNRKEKIHLEFSEDCLYLNIYTPADFTKNSRLPVMVWIHGGGMTLGGASTYDGRVLSAYENVVVVAIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQDNIANFGGDPGSVTIFGESAGGFSVSVLVLSPLTKNLFHRAISESGVVFLPGLLTKDVRPAAKQIADMAGCETTTSAIIVHCLRQKTEEELLEIMKKMNLIKLSSQRDNKESYHFLSTVVDNVVLPKDPKEILAEKNFNTVPYIVGINKQECGWLLPTMMGFVPADVELDKKMAITLLEKFASLYGIPEDIIPVAIEKYRKGSDDSIKIRDGILAFIGDVSFSIPSVMVSRDHRDAGAPTYMYEYQYYPSFSSPQRPKHVVGDHADDLYSVFGAPILRDGASEEEIKLSKMVMKFWANFARNGNPNGRGLPHWPQYDQKEEYLQIGATTQQSQRLKAEEVAFWTQLLAKRQPQPHHNEL,brenda,Q64573,CCCCCCCCCCCCCCCC(=O)OC/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C.O>>CC1=C(/C=C/C(C)=C/C=C/C(C)=C/CO)C(C)(C)CCC1.CCCCCCCCCCCCCCCC(=O)O,0.0075,4.184362867912895e-14,37.0,8.0,3.1.1.1,10116.0,-2.1249387366083,CCCCCCCCCCCCCCCC(=O)OC/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C.O,CC1=C(/C=C/C(C)=C/C=C/C(C)=C/CO)C(C)(C)CCC1.CCCCCCCCCCCCCCCC(=O)O,-2.1249387366083,CCCCCCCCCCCCCCCC(=O)OC/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C.O__MCLSFLFLVSLATCVVYGNPSSPPVVDTTKGKVLGKYVSLEGVTQSVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTTYPPMCSQDAAKGQRMNDLLTNRKEKIHLEFSEDCLYLNIYTPADFTKNSRLPVMVWIHGGGMTLGGASTYDGRVLSAYENVVVVAIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQDNIANFGGDPGSVTIFGESAGGFSVSVLVLSPLTKNLFHRAISESGVVFLPGLLTKDVRPAAKQIADMAGCETTTSAIIVHCLRQKTEEELLEIMKKMNLIKLSSQRDNKESYHFLSTVVDNVVLPKDPKEILAEKNFNTVPYIVGINKQECGWLLPTMMGFVPADVELDKKMAITLLEKFASLYGIPEDIIPVAIEKYRKGSDDSIKIRDGILAFIGDVSFSIPSVMVSRDHRDAGAPTYMYEYQYYPSFSSPQRPKHVVGDHADDLYSVFGAPILRDGASEEEIKLSKMVMKFWANFARNGNPNGRGLPHWPQYDQKEEYLQIGATTQQSQRLKAEEVAFWTQLLAKRQPQPHHNEL,./data/raw/alphafold//AF-Q64573-F1-model_v4.pdb,1494,2159,3837,2702
+1527,6833,6948,MDPKFQRVALSDGHFIPVLGFGTYAPEEVPKSKAMEATKIAIDAGFRHIDSAYFYKNEKEVGLAIRSKIADGTVKREDIFYTSKLWCTFHRPELVRPSLEDSLKNLQLDYVDLYIIHFPTALKPGVEIIPTDEHGKAIFDTVDICATWEAMEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYLNQGKLLEFCKSKGIVLVAYSALGSHREPEWVDQSAPVLLEDPLIGALAKKHQQTPALIALRYQLQRGIVVLAKSFTEKRIKENIQVFEFQLPSEDMKVIDSLNRNFRYVTADFAIGHPNYPFSDEY,uniprot_search,P80508,CCCCCC(=O)/C=C/C=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+]>>,0.112,99.88909123576762,37.0,7.4,1.1.1.149,9986.0,-0.9507819773298184,CCCCCC(=O)/C=C/C=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+],,-0.9507819773298184,CCCCCC(=O)/C=C/C=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+]__MDPKFQRVALSDGHFIPVLGFGTYAPEEVPKSKAMEATKIAIDAGFRHIDSAYFYKNEKEVGLAIRSKIADGTVKREDIFYTSKLWCTFHRPELVRPSLEDSLKNLQLDYVDLYIIHFPTALKPGVEIIPTDEHGKAIFDTVDICATWEAMEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYLNQGKLLEFCKSKGIVLVAYSALGSHREPEWVDQSAPVLLEDPLIGALAKKHQQTPALIALRYQLQRGIVVLAKSFTEKRIKENIQVFEFQLPSEDMKVIDSLNRNFRYVTADFAIGHPNYPFSDEY,./data/raw/alphafold//AF-P80508-F1-model_v4.pdb,1329,1150,197,619
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+1529,6966,7082,MWVCSTLWRVRTPARQWRGLLPASGCHGPAASSYSASAEPARVRALVYGHHGDPAKVVELKNLELAAVRGSDVRVKMLAAPINPSDINMIQGNYGFLPELPAVGGNEGVAQVVAVGSNVTGLKPGDWVIPANAGLGTWRTEAVFSEEALIQVPSDIPLQSAATLGVNPCTAYRMLMDFEQLQPGDSVIQNASNSGVGQAVIQIAAALGLRTINVVRDRPDIQKLSDRLKSLGAEHVITEEELRRPEMKNFFKDMPQPRLALNCVGGKSSTELLRQLARGGTMVTYGGMAKQPVVASVSLLIFKDLKLRGFWLSQWKKDHSPDQFKELILTLCDLIRRGQLTAPACSQVPLQDYQSALEASMKPFISSKQILTM,sabio,Q9BV79,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.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]>>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.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,3.0,0.0,22.0,7.5,1.3.1.104,9606.0,0.4771212547196624,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.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],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.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,0.4771212547196624,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.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]__MWVCSTLWRVRTPARQWRGLLPASGCHGPAASSYSASAEPARVRALVYGHHGDPAKVVELKNLELAAVRGSDVRVKMLAAPINPSDINMIQGNYGFLPELPAVGGNEGVAQVVAVGSNVTGLKPGDWVIPANAGLGTWRTEAVFSEEALIQVPSDIPLQSAATLGVNPCTAYRMLMDFEQLQPGDSVIQNASNSGVGQAVIQIAAALGLRTINVVRDRPDIQKLSDRLKSLGAEHVITEEELRRPEMKNFFKDMPQPRLALNCVGGKSSTELLRQLARGGTMVTYGGMAKQPVVASVSLLIFKDLKLRGFWLSQWKKDHSPDQFKELILTLCDLIRRGQLTAPACSQVPLQDYQSALEASMKPFISSKQILTM,./data/raw/alphafold//AF-Q9BV79-F1-model_v4.pdb,3297,2135,3808,2487
+1530,8366,8497,MELEKFVDPMPIMKTAIPKKTSKDGDYYEIEMKEFSQKLHRDLNPTRLWGYDGQFPGPTIEVMRGKPARIKWMNNLPDTHFLPIDRSIHHVAHEPEVRTVVHLHGSETTPASDGYPEAWFTKDFAEVGSFFEQETYEYPNDQRAATLWYHDHAMGITRLNVYAGLSGLYIIRDPREEQLNLPKGEFDIPLLIQDRSFNDDGSLFYPAQPANPAPNLPNPSVLPFFVGDTILVNGKVWPYLQVEPRKYRFRILNGSNSRSYQLALDSEAPFYQIASDGGLLRRTVSLQAFDIRPAERIEAIIDFSKFEGQTITLKNNASTDATADVMQFQVVLPLSGEDTSIIPQNLSYIPSLQQNDVKRIRNLKISGTTDEYGRPLLLLNNKLWSDPVEEKPCLGTTEIWSFVNVTNVPHPMHIHLVQFQLLDHRAFNVELYNENGQIELVGPTIPPKINERGWKDTITAPAGQITRVIARFAPFSGYYVWHCHILEHEDYDMMRPFVVIDPKTEKERR,sabio,Q5WEM6,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,90.0,1.4837780463171737,30.0,4.0,1.10.3.2,79880.0,1.954242509439325,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,1.954242509439325,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O__MELEKFVDPMPIMKTAIPKKTSKDGDYYEIEMKEFSQKLHRDLNPTRLWGYDGQFPGPTIEVMRGKPARIKWMNNLPDTHFLPIDRSIHHVAHEPEVRTVVHLHGSETTPASDGYPEAWFTKDFAEVGSFFEQETYEYPNDQRAATLWYHDHAMGITRLNVYAGLSGLYIIRDPREEQLNLPKGEFDIPLLIQDRSFNDDGSLFYPAQPANPAPNLPNPSVLPFFVGDTILVNGKVWPYLQVEPRKYRFRILNGSNSRSYQLALDSEAPFYQIASDGGLLRRTVSLQAFDIRPAERIEAIIDFSKFEGQTITLKNNASTDATADVMQFQVVLPLSGEDTSIIPQNLSYIPSLQQNDVKRIRNLKISGTTDEYGRPLLLLNNKLWSDPVEEKPCLGTTEIWSFVNVTNVPHPMHIHLVQFQLLDHRAFNVELYNENGQIELVGPTIPPKINERGWKDTITAPAGQITRVIARFAPFSGYYVWHCHILEHEDYDMMRPFVVIDPKTEKERR,./data/raw/alphafold//AF-Q5WEM6-F1-model_v4.pdb,3403,2284,3984,2872
+1531,14409,14612,MSASPLKVAVTGAAGQIGYSLLFRLASGSLLGPDRPIELRLLEIEPALQALEGVVMELDDCAFPLLSGVEIGSDPQKIFDGVSLALLVGARPRGAGMERSDLLEANGAIFTAQGKALNAVAADDVRVGVTGNPANTNALIAMTNAPDIPRERFSALTRLDHNRAISQLAAKTGAAVTDIKKMTIWGNHSATQYPDLFHAEVAGKNAAEVVNDQAWIEDEFIPTVAKRGAAIIDARGASSAASAASATIDAARDWLLGTPADDWVSMAVVSDGSYGVPEGLISSFPVTTKGGNWTIVSGLEIDEFSRGRIDKSTAELADERSAVTELGLI,brenda,P9WK13,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[C@H](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.O=C(O)CC(=O)C(=O)O.[H+],302.0,6.466798656298264e-15,30.0,7.4,1.1.1.37,1773.0,2.4800069429571505,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[C@H](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.O=C(O)CC(=O)C(=O)O.[H+],2.4800069429571505,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[C@H](O)C(=O)O__MSASPLKVAVTGAAGQIGYSLLFRLASGSLLGPDRPIELRLLEIEPALQALEGVVMELDDCAFPLLSGVEIGSDPQKIFDGVSLALLVGARPRGAGMERSDLLEANGAIFTAQGKALNAVAADDVRVGVTGNPANTNALIAMTNAPDIPRERFSALTRLDHNRAISQLAAKTGAAVTDIKKMTIWGNHSATQYPDLFHAEVAGKNAAEVVNDQAWIEDEFIPTVAKRGAAIIDARGASSAASAASATIDAARDWLLGTPADDWVSMAVVSDGSYGVPEGLISSFPVTTKGGNWTIVSGLEIDEFSRGRIDKSTAELADERSAVTELGLI,./data/raw/alphafold//AF-P9WK13-F1-model_v4.pdb,2276,4599,4411,4302
+1532,991,1017,MPSDYAEIRNRVEHYFDRTATRAWARLTTADEKVSKVRQTVREGRDTMRAVMLSRLPDDLTGCRVMDAGCGTGLTTVELARRGADVVAVDISPQLIDIAKDRLPPELRGKVSFHVGDMADPALGQFDYVVAMDSLIYYRAPDIGRVLTELGKRTHSAIVFTVAPKTAFLMAFWWLGKLFPRSNRSPVMIPHALDKLQRHAGDSLIKIDRVARGFYISECLEYRP,brenda,P26236,C=Cc1c(C)c2cc3nc(cc4nc(cc5[nH]c(cc1[n-]2)c(C)c5C=C)C(C)=C4CCC(=O)O)C(CCC(=O)[O-])=C3C.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.[Zn+2]>>C=CC1=C(C)c2cc3[n-]c(cc4[nH]c(cc5nc(cc1n2)C(C)=C5C=C)c(C)c4CCC(=O)O)c(CCC(=O)OC)c3C.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O.[Zn+2],0.018,0.0,25.0,8.0,2.1.1.11,1061.0,-1.744727494896694,C=Cc1c(C)c2cc3nc(cc4nc(cc5[nH]c(cc1[n-]2)c(C)c5C=C)C(C)=C4CCC(=O)O)C(CCC(=O)[O-])=C3C.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.[Zn+2],C=CC1=C(C)c2cc3[n-]c(cc4[nH]c(cc5nc(cc1n2)C(C)=C5C=C)c(C)c4CCC(=O)O)c(CCC(=O)OC)c3C.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O.[Zn+2],-1.744727494896694,C=Cc1c(C)c2cc3nc(cc4nc(cc5[nH]c(cc1[n-]2)c(C)c5C=C)C(C)=C4CCC(=O)O)C(CCC(=O)[O-])=C3C.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.[Zn+2]__MPSDYAEIRNRVEHYFDRTATRAWARLTTADEKVSKVRQTVREGRDTMRAVMLSRLPDDLTGCRVMDAGCGTGLTTVELARRGADVVAVDISPQLIDIAKDRLPPELRGKVSFHVGDMADPALGQFDYVVAMDSLIYYRAPDIGRVLTELGKRTHSAIVFTVAPKTAFLMAFWWLGKLFPRSNRSPVMIPHALDKLQRHAGDSLIKIDRVARGFYISECLEYRP,./data/raw/alphafold//AF-P26236-F1-model_v4.pdb,1232,3044,579,665
+1533,996,1022,MSDGKKHVVIIGGGITGLAAAFYMEKEIKEKNLPLELTLVEASPRVGGKIQTVKKDGYIIERGPDSFLERKKSAPQLVKDLGLEHLLVNNATGQSYVLVNRTLHPMPKGAVMGIPTKIAPFVSTGLFSLSGKARAAMDFILPASKTKDDQSLGEFFRRRVGDEVVENLIEPLLSGIYAGDIDKLSLMSTFPQFYQTEQKHRSLILGMKKTRPQGSGQQLTAKKQGQFQTLSTGLQTLVEEIEKQLKLTKVYKGTKVTKLSHSGSCYSLELDNGVTLDADSVIVTAPHKAAAGMLSELPAISHLKNMHSTSVANVALGFPEGSVQMEHEGTGFVISRNSDFAITACTWTNKKWPHAAPEGKTLLRAYVGKAGDESIVDLSDNDIINIVLEDLKKVMNINGEPEMTCVTRWHESMPQYHVGHKQRIKELREALASAYPGVYMTGASFEGVGIPDCIDQGKAAVSDALTYLFS,brenda,P32397,C=Cc1c2[nH]c(c1C)Cc1[nH]c(c(CCC(=O)O)c1C)Cc1[nH]c(c(C)c1CCC(=O)O)Cc1[nH]c(c(C)c1C=C)C2.O=O>>C=CC1=C(C)c2cc3[nH]c(cc4nc(cc5[nH]c(cc1n2)c(C)c5CCC(=O)O)C(CCC(=O)O)=C4C)c(C)c3C=C.OO,14.1,0.3364485981308253,25.0,7.4,1.3.3.4,1423.0,1.14921911265538,C=Cc1c2[nH]c(c1C)Cc1[nH]c(c(CCC(=O)O)c1C)Cc1[nH]c(c(C)c1CCC(=O)O)Cc1[nH]c(c(C)c1C=C)C2.O=O,C=CC1=C(C)c2cc3[nH]c(cc4nc(cc5[nH]c(cc1n2)c(C)c5CCC(=O)O)C(CCC(=O)O)=C4C)c(C)c3C=C.OO,1.14921911265538,C=Cc1c2[nH]c(c1C)Cc1[nH]c(c(CCC(=O)O)c1C)Cc1[nH]c(c(C)c1CCC(=O)O)Cc1[nH]c(c(C)c1C=C)C2.O=O__MSDGKKHVVIIGGGITGLAAAFYMEKEIKEKNLPLELTLVEASPRVGGKIQTVKKDGYIIERGPDSFLERKKSAPQLVKDLGLEHLLVNNATGQSYVLVNRTLHPMPKGAVMGIPTKIAPFVSTGLFSLSGKARAAMDFILPASKTKDDQSLGEFFRRRVGDEVVENLIEPLLSGIYAGDIDKLSLMSTFPQFYQTEQKHRSLILGMKKTRPQGSGQQLTAKKQGQFQTLSTGLQTLVEEIEKQLKLTKVYKGTKVTKLSHSGSCYSLELDNGVTLDADSVIVTAPHKAAAGMLSELPAISHLKNMHSTSVANVALGFPEGSVQMEHEGTGFVISRNSDFAITACTWTNKKWPHAAPEGKTLLRAYVGKAGDESIVDLSDNDIINIVLEDLKKVMNINGEPEMTCVTRWHESMPQYHVGHKQRIKELREALASAYPGVYMTGASFEGVGIPDCIDQGKAAVSDALTYLFS,./data/raw/alphafold//AF-P32397-F1-model_v4.pdb,1235,3047,582,668
+1534,6465,6578,MNEFPVVLVINCGSSSIKFSVLDVATCDVLMAGIADGMNTENAFLSINGDKPINLAHSNYEDALKAIAFELEKRDLTDSVALIGHRIAHGGELFTQSVIITDEIIDNIRRVSPLAPLHNYANLSGIDAARHLFPAVRQVAVFDTSFHQTLAPEAYLYGLPWEYFSSLGVRRYGFHGTSHRYVSRRAYELLDLDEKDSGLIVAHLGNGASICAVRNGQSVDTSMGMTPLEGLMMGTRSGDVDFGAMAWIAKETGQTLSDLERVVNKESGLLGISGLSSDLRVLEKAWHEGHERARLAIKTFVHRIARHIAGHAASLHRLDGIIFTGGIGENSVLIRQLVIEHLGVLGLTLDVEMNKQPNSHGERIISANPSQVICAVIPTNEEKMIALDAIHLGNVKAPVEFA,brenda,O06961,CCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>CCCC(=O)OP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,60.0,0.0,25.0,7.5,2.7.2.15,90371.0,1.7781512503836436,CCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,CCCC(=O)OP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,1.7781512503836436,CCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MNEFPVVLVINCGSSSIKFSVLDVATCDVLMAGIADGMNTENAFLSINGDKPINLAHSNYEDALKAIAFELEKRDLTDSVALIGHRIAHGGELFTQSVIITDEIIDNIRRVSPLAPLHNYANLSGIDAARHLFPAVRQVAVFDTSFHQTLAPEAYLYGLPWEYFSSLGVRRYGFHGTSHRYVSRRAYELLDLDEKDSGLIVAHLGNGASICAVRNGQSVDTSMGMTPLEGLMMGTRSGDVDFGAMAWIAKETGQTLSDLERVVNKESGLLGISGLSSDLRVLEKAWHEGHERARLAIKTFVHRIARHIAGHAASLHRLDGIIFTGGIGENSVLIRQLVIEHLGVLGLTLDVEMNKQPNSHGERIISANPSQVICAVIPTNEEKMIALDAIHLGNVKAPVEFA,./data/raw/alphafold//AF-O06961-F1-model_v4.pdb,1420,938,739,1035
+1535,3045,3087,MIVPLQGAQMLQMLEKSLRKYLPESLKVYGTVYHMIHGNPFNLKALVDKWPDFNTVVVRPQEQEMTDDLDFYINTYQVYSKDPQNCQEFLESSEVINWKQHLQIQSSQSHLNKTIQNLASIQSFQIKHSENILYVSSETIKKLFPSLLDTKNLSTGSGKPKAIDQDKFKLSSLDVVHAALVNKFWLFGGNERSQRFIERCIKNFPSSCVLGPEGTPASWTLMDQTGEMRMGGTMPEYRLQGLVSFVVHSQDQIMTKRGYPVYSHTEKSNIAMQKMSYTLQHLPMPCAWNQWKCMPM,brenda,Q91XE0,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)c1ccccc1.N=C(O)C[C@H](N)C(=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.N=C(O)C[C@H](N=C(O)c1ccccc1)C(=O)O,4.2,0.0,37.0,7.5,2.3.1.13,10090.0,0.6232492903979004,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)c1ccccc1.N=C(O)C[C@H](N)C(=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.N=C(O)C[C@H](N=C(O)c1ccccc1)C(=O)O,0.6232492903979004,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)c1ccccc1.N=C(O)C[C@H](N)C(=O)O__MIVPLQGAQMLQMLEKSLRKYLPESLKVYGTVYHMIHGNPFNLKALVDKWPDFNTVVVRPQEQEMTDDLDFYINTYQVYSKDPQNCQEFLESSEVINWKQHLQIQSSQSHLNKTIQNLASIQSFQIKHSENILYVSSETIKKLFPSLLDTKNLSTGSGKPKAIDQDKFKLSSLDVVHAALVNKFWLFGGNERSQRFIERCIKNFPSSCVLGPEGTPASWTLMDQTGEMRMGGTMPEYRLQGLVSFVVHSQDQIMTKRGYPVYSHTEKSNIAMQKMSYTLQHLPMPCAWNQWKCMPM,./data/raw/alphafold//AF-Q91XE0-F1-model_v4.pdb,1535,1091,919,1256
+1536,15042,15253,MKNNGGARVVVIGAGFVGASYVFALMNQGIADEIVLIDANESKAIGDAMDFNHGKVFAPKPVDIWHGDYDDCRDADLVVICAGANQKPGETRLDLVDKNIAIFRSIVESVMASGFQGLFLVATNPVDILTYATWKFSGLPHERVIGSGTILDTARFRFLLGEYFSVAPQNVHAYIIGEHGDTELPVWSQAYIGVMPIRKLVESKGEEAQKDLERIFVNVRDAAYQIIEKKGATYYGIAMGLARVTRAILHNENAILTVSAYLDGLYGERDVYIGVPAVINRNGIREVIEIELNDDEKNRFHHSAATLKSVLARAFTR,sabio,P00344,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)C(=O)Cc1ccccc1.[H]>>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.O=C(O)C(O)Cc1ccccc1,75.0,0.0,25.0,6.0,1.1.1.27,1422.0,1.8750612633917,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)C(=O)Cc1ccccc1.[H],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.O=C(O)C(O)Cc1ccccc1,1.8750612633917,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)C(=O)Cc1ccccc1.[H]__MKNNGGARVVVIGAGFVGASYVFALMNQGIADEIVLIDANESKAIGDAMDFNHGKVFAPKPVDIWHGDYDDCRDADLVVICAGANQKPGETRLDLVDKNIAIFRSIVESVMASGFQGLFLVATNPVDILTYATWKFSGLPHERVIGSGTILDTARFRFLLGEYFSVAPQNVHAYIIGEHGDTELPVWSQAYIGVMPIRKLVESKGEEAQKDLERIFVNVRDAAYQIIEKKGATYYGIAMGLARVTRAILHNENAILTVSAYLDGLYGERDVYIGVPAVINRNGIREVIEIELNDDEKNRFHHSAATLKSVLARAFTR,./data/raw/alphafold//AF-P00344-F1-model_v4.pdb,1256,5193,1577,704
+1537,3115,3157,MMRKSLCCALLLGISCSALATPVSEKQLAEVVANTITPLMKAQSVPGMAVAVIYQGKPHYYTFGKADIAANKPVTPQTLFELGSISKTFTGVLGGDAIARGEISLDDAVTRYWPQLTGKQWQGIRMLDLATYTAGGLPLQVPDEVTDNASLLRFYQNWQPQWKPGTTRLYANASIGLFGALAVKPSGMPYEQAMTTRVLKPLKLDHTWINVPKAEEAHYAWGYRDGKAVRVSPGMLDAQAYGVKTNVQDMANWVMANMAPENVADASLKQGIALAQSRYWRIGSMYQGLGWEMLNWPVEANTVVEGSDSKVALAPLPVAEVNPPAPPVKASWVHKTGSTGGFGSYVAFIPEKQIGIVMLANTSYPNPARVEAAYHILEALQ,sabio,P05364,CC(C)(ON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[n+]3ccccc3)CSC12)c1csc(N)n1)C(=O)O.O>>,0.065,99.82319723056142,30.0,7.0,3.5.2.6,550.0,-1.1870866433571443,CC(C)(ON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[n+]3ccccc3)CSC12)c1csc(N)n1)C(=O)O.O,,-1.1870866433571443,CC(C)(ON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[n+]3ccccc3)CSC12)c1csc(N)n1)C(=O)O.O__MMRKSLCCALLLGISCSALATPVSEKQLAEVVANTITPLMKAQSVPGMAVAVIYQGKPHYYTFGKADIAANKPVTPQTLFELGSISKTFTGVLGGDAIARGEISLDDAVTRYWPQLTGKQWQGIRMLDLATYTAGGLPLQVPDEVTDNASLLRFYQNWQPQWKPGTTRLYANASIGLFGALAVKPSGMPYEQAMTTRVLKPLKLDHTWINVPKAEEAHYAWGYRDGKAVRVSPGMLDAQAYGVKTNVQDMANWVMANMAPENVADASLKQGIALAQSRYWRIGSMYQGLGWEMLNWPVEANTVVEGSDSKVALAPLPVAEVNPPAPPVKASWVHKTGSTGGFGSYVAFIPEKQIGIVMLANTSYPNPARVEAAYHILEALQ,./data/raw/alphafold//AF-P05364-F1-model_v4.pdb,1456,965,772,1072
+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
+1541,8833,8973,MASKNGIIHEKTLFSHELEEEMTVLVYLPATFSPLYKYHTVIAQDGHDYFRLGRIGRQAEELMSKGEIDRCIIIGVPYKNVRERRNTYHPEGSKFASYKRFIANELVPFIDKEYPTYQVGYGRTMIGDSLGGTVSLMTAIDYPNMFGNVIMQSPYVDGHVLDAVRQSEDLKQISVYHQIGEKETAVHTTDGQVLDFTAPNEELKQLLESKQSEYTYETFDGDHKWTYWQPLITPALKKML,brenda,A0A1B1WA14,COC(=O)/C=C/c1ccc(O)cc1.O>>CO.O=C(O)/C=C/c1ccc(O)cc1,43.88,0.0,35.0,8.0,3.1.1.73,1390.0,1.6422666189026736,COC(=O)/C=C/c1ccc(O)cc1.O,CO.O=C(O)/C=C/c1ccc(O)cc1,1.6422666189026736,COC(=O)/C=C/c1ccc(O)cc1.O__MASKNGIIHEKTLFSHELEEEMTVLVYLPATFSPLYKYHTVIAQDGHDYFRLGRIGRQAEELMSKGEIDRCIIIGVPYKNVRERRNTYHPEGSKFASYKRFIANELVPFIDKEYPTYQVGYGRTMIGDSLGGTVSLMTAIDYPNMFGNVIMQSPYVDGHVLDAVRQSEDLKQISVYHQIGEKETAVHTTDGQVLDFTAPNEELKQLLESKQSEYTYETFDGDHKWTYWQPLITPALKKML,./data/raw/alphafold//AF-A0A1B1WA14-F1-model_v4.pdb,3356,2222,3911,2785
+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
+1543,9054,9196,MLFKLSNWLLALALFVGNVVAQLVGPTPYTDPDTGIVFQSWVNPAGTLKFGYTYPANAATVAATEFIGFLECQGAGWCSVSLGGSMLNKPLVVAYPSGDEVLASLKWATGYANPEPYGGNHKLSQISSSVTSAGFRVVYRCEGCLAWNYQGIEGGSPTNGASMPIGWAYSASSVLNGDCVDNTVLIQHDTFGNYGFVPDESSLRTEYNDWTELPTRVVRGDCGGSTTTSSVPSSTAPPQGTGIPVPTGASYDYIVVGSGAGGIPIADKLTEAGKKVLLIEKGPPSSGRYDGKLKPTWLEGTNLTRFDVPGLCNQIWVDSAGIACRDTDQMAGCVLGGGTAVNAGLWWKPNPIDWDYNFPSGWKSSEMIGATNRVFSRIGGTTVPSQDGKTYYQQGFNVLSSGLKAAGWTSVSLNNAPAQKNRTYGAGPFMFSGGERGGPLATYLATAKKRGNFDLWTNTQVKRVIRQGGHVTGVEVENYNGDGYKGTVKVTPVSGRVVLSAGTFGSAKLLLRSGIGPKDQLAIVKNSTDGPTMASERDWINLPVGYNLEDHTNTDIVISHPDVVHYDFYEAWTAPIESDKTAYLGKRSGILAQAAPNIGPLFFDEVRGADNIVRSIQYTARVEGNSVVPNGKAMVISQYLGRGAVSRGRMTISQGLNTIVSTAPYLSNVNDLEAVIKSLENIANSLTSKVKNLKIEWPASGTSIRDHVTNMPLDPATRRANHWIGTNKIGTKDGRLTGGDSVVDLNTKVYGTDNLFVVDASIFPGMVTTNPSAYIVIAAEHAASKILSLPTAKAAAKYEQCGGLEYNGNFQCASGLTCTWLNDYYWQCT,brenda,E7D6C4,COC1=C(OC)C(=O)C(CC=C(C)C)=C(C)C1=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>>COc1c(O)c(C)c(CC=C(C)C)c(O)c1OC.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,19.9,0.0,30.0,5.5,1.1.99.18,80385.0,1.2988530764097066,COC1=C(OC)C(=O)C(CC=C(C)C)=C(C)C1=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,COc1c(O)c(C)c(CC=C(C)C)c(O)c1OC.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,1.2988530764097066,COC1=C(OC)C(=O)C(CC=C(C)C)=C(C)C1=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__MLFKLSNWLLALALFVGNVVAQLVGPTPYTDPDTGIVFQSWVNPAGTLKFGYTYPANAATVAATEFIGFLECQGAGWCSVSLGGSMLNKPLVVAYPSGDEVLASLKWATGYANPEPYGGNHKLSQISSSVTSAGFRVVYRCEGCLAWNYQGIEGGSPTNGASMPIGWAYSASSVLNGDCVDNTVLIQHDTFGNYGFVPDESSLRTEYNDWTELPTRVVRGDCGGSTTTSSVPSSTAPPQGTGIPVPTGASYDYIVVGSGAGGIPIADKLTEAGKKVLLIEKGPPSSGRYDGKLKPTWLEGTNLTRFDVPGLCNQIWVDSAGIACRDTDQMAGCVLGGGTAVNAGLWWKPNPIDWDYNFPSGWKSSEMIGATNRVFSRIGGTTVPSQDGKTYYQQGFNVLSSGLKAAGWTSVSLNNAPAQKNRTYGAGPFMFSGGERGGPLATYLATAKKRGNFDLWTNTQVKRVIRQGGHVTGVEVENYNGDGYKGTVKVTPVSGRVVLSAGTFGSAKLLLRSGIGPKDQLAIVKNSTDGPTMASERDWINLPVGYNLEDHTNTDIVISHPDVVHYDFYEAWTAPIESDKTAYLGKRSGILAQAAPNIGPLFFDEVRGADNIVRSIQYTARVEGNSVVPNGKAMVISQYLGRGAVSRGRMTISQGLNTIVSTAPYLSNVNDLEAVIKSLENIANSLTSKVKNLKIEWPASGTSIRDHVTNMPLDPATRRANHWIGTNKIGTKDGRLTGGDSVVDLNTKVYGTDNLFVVDASIFPGMVTTNPSAYIVIAAEHAASKILSLPTAKAAAKYEQCGGLEYNGNFQCASGLTCTWLNDYYWQCT,./data/raw/alphafold//AF-E7D6C4-F1-model_v4.pdb,3515,3446,1187,3112
+1544,4003,4056,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](CCC(=O)O)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](CCC(=O)O)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,0.17,3.0579267901262446e-14,30.0,7.5,3.4.24.65,9606.0,-0.7695510786217261,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](CCC(=O)O)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](CCC(=O)O)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,0.1139433523068367,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](CCC(=O)O)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
+1545,6170,6279,MLDMPIDPVYYQLAEYFDSLPKFDQFSSAREYREAINRIYEERNRQLSQHERVERVEDRTIKGRNGDIRVRVYQQKPDSPVLVYYHGGGFVICSIESHDALCRRIARLSNSTVVSVDYRLAPEHKFPAAVYDCYDATKWVAENAEELRIDPSKIFVGGDSAGGNLAAAVSIMARDSGEDFIKHQILIYPVVNFVAPTPSLLEFGEGLWILDQKIMSWFSEQYFSREEDKFNPLASVIFADLENLPPALIITAEYDPLRDEGEVFGQMLRRAGVEASIVRYRGVLHGFINYYPVLKAARDAINQIAALLVFD,brenda,O28558,CCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,348.0,0.0,70.0,7.1,3.1.1.1,2234.0,2.5415792439465807,CCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,2.5415792439465807,CCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MLDMPIDPVYYQLAEYFDSLPKFDQFSSAREYREAINRIYEERNRQLSQHERVERVEDRTIKGRNGDIRVRVYQQKPDSPVLVYYHGGGFVICSIESHDALCRRIARLSNSTVVSVDYRLAPEHKFPAAVYDCYDATKWVAENAEELRIDPSKIFVGGDSAGGNLAAAVSIMARDSGEDFIKHQILIYPVVNFVAPTPSLLEFGEGLWILDQKIMSWFSEQYFSREEDKFNPLASVIFADLENLPPALIITAEYDPLRDEGEVFGQMLRRAGVEASIVRYRGVLHGFINYYPVLKAARDAINQIAALLVFD,./data/raw/alphafold//AF-O28558-F1-model_v4.pdb,1438,3020,549,627
+1546,6208,6317,MSAFNTTLPSLDYDDDTLREHLQGADIPTLLLTVAHLTGDLQILKPNWKPSIAMGVARSGMDLETEAQVREFCLQRLIDFRDSGQPAPGRPTSDQLHILGTWLMGPVIEPYLPLIAEEAVTAEEDLRAPRWHKDHVASGRDFKVVIIGAGESGMIAALRFKQAGVPFVIYEKGNDVGGTWRENTYPGCRVDINSFWYSFSFARGIWDDCFAPAPQVFAYMQAVAREHGLYEHIRFNTEVSDAHWDESTQRWQLLYRDSEGQTQVDSNVVVFAVGQLNRPMIPAIPGIETFKGPMFHSAQWDHDVDWSGKRVGVIGTGASATQFIPQLAQTAAELKVFARTTNWLLPTPDLHEKISDSCKWLLAHVPHYSLWYRVAMAMPQSVGFLEDVMVDVGYPPTELAVSARNDRLRQDISAWMEPQFADRPDLREVLIPDSPVGGKRIVRDNGTWISTLKRDNVSMIRQPIEVITPKGICCVDGTEHEFDLIVYGTGFHASKFLMPINVTGRDGVALHDVWKGDDARAYLGMTVPQFPNMFCMYGPNTGLVVYSTVIQFSEMTASYIVDAVRLLLEGGHQSMEVKTPVFESYNQRVDEGNALRAWGFSKVNSWYKNSKGRVTQNFPFTAVEFWQRTHSVEPTDYQLG,brenda,Q93TJ5,CCC(=O)c1ccc(O)cc1.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.[H+]>>CC(C(=O)O)c1ccc(O)cc1.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,10.6,1.2236127309378026e-14,30.0,7.0,1.14.13.84,294.0,1.0253058652647702,CCC(=O)c1ccc(O)cc1.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.[H+],CC(C(=O)O)c1ccc(O)cc1.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,1.0253058652647702,CCC(=O)c1ccc(O)cc1.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.[H+]__MSAFNTTLPSLDYDDDTLREHLQGADIPTLLLTVAHLTGDLQILKPNWKPSIAMGVARSGMDLETEAQVREFCLQRLIDFRDSGQPAPGRPTSDQLHILGTWLMGPVIEPYLPLIAEEAVTAEEDLRAPRWHKDHVASGRDFKVVIIGAGESGMIAALRFKQAGVPFVIYEKGNDVGGTWRENTYPGCRVDINSFWYSFSFARGIWDDCFAPAPQVFAYMQAVAREHGLYEHIRFNTEVSDAHWDESTQRWQLLYRDSEGQTQVDSNVVVFAVGQLNRPMIPAIPGIETFKGPMFHSAQWDHDVDWSGKRVGVIGTGASATQFIPQLAQTAAELKVFARTTNWLLPTPDLHEKISDSCKWLLAHVPHYSLWYRVAMAMPQSVGFLEDVMVDVGYPPTELAVSARNDRLRQDISAWMEPQFADRPDLREVLIPDSPVGGKRIVRDNGTWISTLKRDNVSMIRQPIEVITPKGICCVDGTEHEFDLIVYGTGFHASKFLMPINVTGRDGVALHDVWKGDDARAYLGMTVPQFPNMFCMYGPNTGLVVYSTVIQFSEMTASYIVDAVRLLLEGGHQSMEVKTPVFESYNQRVDEGNALRAWGFSKVNSWYKNSKGRVTQNFPFTAVEFWQRTHSVEPTDYQLG,./data/raw/alphafold//AF-Q93TJ5-F1-model_v4.pdb,1369,868,664,864
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+1560,475,492,MGDNRTPVTVIGLGLMGQALAAAFLEAGHTTTVWNRSAGKAEQLVSQGAVQAATPADAVAASELVVVCLSTYDNMHDVIGSLGESLRGKVIVNLTSGSSDQGRETAAWAEKQGVEYLDGAIMITPPGIGTETAVLFYAGTQSVFEKYEPALKLLGGGTTYLGTDHGMPALYDVSLLGLMWGTLNSFLHGVAVVETAGVGAQQFLPWAHMWLEAIKMFTADYAAQIDAGDGKFPANDATLETHLAALKHLVHESEALGIDAELPKYSEALMERVISQGHAKNSYAAVLKAFRKPSE,brenda,M4ZRJ3,C1CCC(C2=NCCCC2)CC1.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+]>>C1CCC([C@@H]2CCCCN2)CC1.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)c1,0.0215,0.0,,,1.5.1.48,1231257.0,-1.6675615400843946,C1CCC(C2=NCCCC2)CC1.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+],C1CCC([C@@H]2CCCCN2)CC1.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,-1.6675615400843946,C1CCC(C2=NCCCC2)CC1.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+]__MGDNRTPVTVIGLGLMGQALAAAFLEAGHTTTVWNRSAGKAEQLVSQGAVQAATPADAVAASELVVVCLSTYDNMHDVIGSLGESLRGKVIVNLTSGSSDQGRETAAWAEKQGVEYLDGAIMITPPGIGTETAVLFYAGTQSVFEKYEPALKLLGGGTTYLGTDHGMPALYDVSLLGLMWGTLNSFLHGVAVVETAGVGAQQFLPWAHMWLEAIKMFTADYAAQIDAGDGKFPANDATLETHLAALKHLVHESEALGIDAELPKYSEALMERVISQGHAKNSYAAVLKAFRKPSE,./data/raw/alphafold//AF-M4ZRJ3-F1-model_v4.pdb,1074,641,318,355
+1561,18162,18418,MRLVVVGLWCLILGLILNPTKFCDAGVTSSYVRKSLSALPNAEDVDMPWDSDVFAVPSGYNAPQQVHITQGDYEGRGVIISWTTPYDKAGANKVVYWSENSKSQKRAMGTVVTYKYYNYTSAFIHHCTIKDLEYDTKYYYRLGFGDAKRQFWFVTPPKPGPDVPYVFGLIGDIGQTHDSNTTLTHYEQNSAKGQAVLFMGDLSYSNRWPNHDNNRWDTWGRFSERSVAYQPWIWTAGNHEIDYAPDIGEYQPFVPFTNRYPTPHEASGSGDPLWYAIKRASAHIIVLSSYSGFVKYSPQYKWFTSELEKVNRSETPWLIVLVHAPLYNSYEAHYMEGEAMRAIFEPYFVYYKVDIVFSGHVHSYERSERVSNVAYNIVNAKCTPVSDESAPVYITIGDGGNSEGLASEMTQPQPSYSAFREASFGHGIFDIKNRTHAHFSWHRNQDGASVEADSLWLLNRYWASEDASSMSAM,sabio,Q9SE00,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,980.0,1.0812962383427719e-14,25.0,,3.1.3.2,4120.0,2.991226075692495,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,2.991226075692495,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O__MRLVVVGLWCLILGLILNPTKFCDAGVTSSYVRKSLSALPNAEDVDMPWDSDVFAVPSGYNAPQQVHITQGDYEGRGVIISWTTPYDKAGANKVVYWSENSKSQKRAMGTVVTYKYYNYTSAFIHHCTIKDLEYDTKYYYRLGFGDAKRQFWFVTPPKPGPDVPYVFGLIGDIGQTHDSNTTLTHYEQNSAKGQAVLFMGDLSYSNRWPNHDNNRWDTWGRFSERSVAYQPWIWTAGNHEIDYAPDIGEYQPFVPFTNRYPTPHEASGSGDPLWYAIKRASAHIIVLSSYSGFVKYSPQYKWFTSELEKVNRSETPWLIVLVHAPLYNSYEAHYMEGEAMRAIFEPYFVYYKVDIVFSGHVHSYERSERVSNVAYNIVNAKCTPVSDESAPVYITIGDGGNSEGLASEMTQPQPSYSAFREASFGHGIFDIKNRTHAHFSWHRNQDGASVEADSLWLLNRYWASEDASSMSAM,./data/raw/alphafold//AF-Q9SE00-F1-model_v4.pdb,5,2472,2753,5598
+1562,20177,20466,MERIDEILSQLTTEEKVKLVVGVGLPGLFGNPHSRVAGAAGETHPIPRLGIPAFVLADGPAGLRINPTRENDENTYYTTAFPVEIMLASTWNRDLLEEVGKAMGEEVREYGVDVLLAPAMNIHRNPLCGRNFEYYSEDPVLSGEMASAFVKGVQSQGVGACIKHFVANNQETNRMVVDTIVSERALREIYLKGFEIAVKKARPWTVMSAYNKLNGKYCSQNEWLLKKVLREEWGFDGFVMSDWYAGDNPVEQLKAGNDMIMPGKAYQVNTERRDEIEEIMEALKEGKLSEEVLDECVRNILKVLVNAPSFKGYRYSNKPDLESHAEVAYKAGAEGVVLLENNGVLPFDENTHVAVFGTGQIETIKGGTGSGDTHPRYTISILEGIKERNMKFDEELASTYEEYIKKMRETEEYKPRTDSWGTAIKPKLPENFLPEKEIKKAAKKNDVAVVVISRISGEGYDRKPVKGDFYLSDDELELIKTVSKEFHDQGKKVVVLLNIGSPIEVASWRDLVDGILLVWQAGQEMGRIVADVLVGKINPSGKLPTTFPKDYSDVPSWTFPGEPKDNPQRVVYEEDIYVGYRYYDTFGVEPAYEFGYGLSYTKFEYKDLKIAIDGDILRVSYTITNTGDRAGKEVSQVYVKAPKGKIDKPFQELKAFHKTKLLNPGESEKIFLEIPLRDLASFDGKEWVVESGEYEVRVGASSRDIRLKDVFLVEEEKRFKP,brenda,D2C716,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[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](O)[C@H]1O,78809.5,0.0,85.0,5.0,3.2.1.21,93929.0,4.8965785721710064,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[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](O)[C@H]1O,4.8965785721710064,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1__MERIDEILSQLTTEEKVKLVVGVGLPGLFGNPHSRVAGAAGETHPIPRLGIPAFVLADGPAGLRINPTRENDENTYYTTAFPVEIMLASTWNRDLLEEVGKAMGEEVREYGVDVLLAPAMNIHRNPLCGRNFEYYSEDPVLSGEMASAFVKGVQSQGVGACIKHFVANNQETNRMVVDTIVSERALREIYLKGFEIAVKKARPWTVMSAYNKLNGKYCSQNEWLLKKVLREEWGFDGFVMSDWYAGDNPVEQLKAGNDMIMPGKAYQVNTERRDEIEEIMEALKEGKLSEEVLDECVRNILKVLVNAPSFKGYRYSNKPDLESHAEVAYKAGAEGVVLLENNGVLPFDENTHVAVFGTGQIETIKGGTGSGDTHPRYTISILEGIKERNMKFDEELASTYEEYIKKMRETEEYKPRTDSWGTAIKPKLPENFLPEKEIKKAAKKNDVAVVVISRISGEGYDRKPVKGDFYLSDDELELIKTVSKEFHDQGKKVVVLLNIGSPIEVASWRDLVDGILLVWQAGQEMGRIVADVLVGKINPSGKLPTTFPKDYSDVPSWTFPGEPKDNPQRVVYEEDIYVGYRYYDTFGVEPAYEFGYGLSYTKFEYKDLKIAIDGDILRVSYTITNTGDRAGKEVSQVYVKAPKGKIDKPFQELKAFHKTKLLNPGESEKIFLEIPLRDLASFDGKEWVVESGEYEVRVGASSRDIRLKDVFLVEEEKRFKP,./data/raw/alphafold//AF-D2C716-F1-model_v4.pdb,431,3091,5368,3574
+1563,9238,9380,MELPNIMHPVAKLSTALAAALMLSGCMPGEIRPTIGQQMETGDQRFGDLVFRQLAPNVWQHTSYLDMPGFGAVASNGLIVRDGGRVLVVDTAWTDDQTAQILNWIKQEINLPVALAVVTHAHQDKMGGMDALHAAGIATYANALSNQLAPQEGLVAAQHSLTFAANGWVEPATAPNFGPLKVFYPGPGHTSDNITVGIDGTDIAFGGCLIKDSKAKSLGNLGDADTEHYAASARAFGAAFPKASMIVMSHSAPDSRAAITHTARMADKLR,brenda,H6WZS9,CO[C@@]1(N=C(O)Cc2cccs2)C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@@H]21.O>>,14.0,99.77602329357748,25.0,7.2,3.5.2.6,562.0,1.146128035678238,CO[C@@]1(N=C(O)Cc2cccs2)C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@@H]21.O,,1.146128035678238,CO[C@@]1(N=C(O)Cc2cccs2)C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@@H]21.O__MELPNIMHPVAKLSTALAAALMLSGCMPGEIRPTIGQQMETGDQRFGDLVFRQLAPNVWQHTSYLDMPGFGAVASNGLIVRDGGRVLVVDTAWTDDQTAQILNWIKQEINLPVALAVVTHAHQDKMGGMDALHAAGIATYANALSNQLAPQEGLVAAQHSLTFAANGWVEPATAPNFGPLKVFYPGPGHTSDNITVGIDGTDIAFGGCLIKDSKAKSLGNLGDADTEHYAASARAFGAAFPKASMIVMSHSAPDSRAAITHTARMADKLR,./data/raw/alphafold//AF-H6WZS9-F1-model_v4.pdb,1454,984,793,1104
+1564,14602,14808,MKAKIRILDMFSGRYTVLINEEDAKEAKLHPDDLVKIEAGKKAVYGSVALSNLVGKGEVGISRDVLDLHNFSEGETVSVIPAGTPESVRYIKKKMHGEKLRKVEIEAIVRDIVDRKLRDIEISSFVTALEINGLDMDEIAALTIAMAETGDMLDIDRKPIMDVHSIGGVPGNKTNILVVPIVAAAGLTIPKTSSRAITSAAGTADVVEVFADVSFSLDEIKRIVEKVGACLVWGGALNLAPADDITIKAERALSIDPTGLMLASIMSKKYAMGSQYVLIDIPTGKGVKVETVEEARSLARDFIELGKRLGQYVEVAITYGGQPIGHTVGPALEAREALSALMTGKGPGSLIEKATGLAGILLEMGGVAPAGTGKKMAKEILESGKAWEKMKEIIEAQGGDPNIKPEEIPIGDKTYTFTAATSGYVTAIDNRAITAIARAAGAPEDKGAGIELYVKVGEKVKEGDPLFTIHAEHEARLDQAIVLARRTEPIRIEGMVLQRIGNI,brenda,Q5JCX3,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O=P(O)(O)O>>N=c1ccnc(O)[nH]1.O=P(O)(O)OC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O)[C@@H]1O,39.1,6.739921419046132e-15,85.0,7.5,2.4.2.57,311400.0,1.5921767573958667,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O=P(O)(O)O,N=c1ccnc(O)[nH]1.O=P(O)(O)OC[C@H]1O[C@H](OP(=O)(O)O)[C@H](O)[C@@H]1O,1.5921767573958667,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O=P(O)(O)O__MKAKIRILDMFSGRYTVLINEEDAKEAKLHPDDLVKIEAGKKAVYGSVALSNLVGKGEVGISRDVLDLHNFSEGETVSVIPAGTPESVRYIKKKMHGEKLRKVEIEAIVRDIVDRKLRDIEISSFVTALEINGLDMDEIAALTIAMAETGDMLDIDRKPIMDVHSIGGVPGNKTNILVVPIVAAAGLTIPKTSSRAITSAAGTADVVEVFADVSFSLDEIKRIVEKVGACLVWGGALNLAPADDITIKAERALSIDPTGLMLASIMSKKYAMGSQYVLIDIPTGKGVKVETVEEARSLARDFIELGKRLGQYVEVAITYGGQPIGHTVGPALEAREALSALMTGKGPGSLIEKATGLAGILLEMGGVAPAGTGKKMAKEILESGKAWEKMKEIIEAQGGDPNIKPEEIPIGDKTYTFTAATSGYVTAIDNRAITAIARAAGAPEDKGAGIELYVKVGEKVKEGDPLFTIHAEHEARLDQAIVLARRTEPIRIEGMVLQRIGNI,./data/raw/alphafold//AF-Q5JCX3-F1-model_v4.pdb,2416,4821,4884,4733
+1565,9743,9891,MDLLLIEKTLVALFAAIIGAILISKLRGKKFKLPPGPIPVPIFGNWLQVGDDLNHRNLTDLAKRFGEILLLRMGQRNLVVVSSPELAKEVLHTQGVEFGSRTRNVVFDIFTGKGQDMVFTVYGEHWRKMRRIMTVPFFTNKVVQQYRYGWEAEAAAVVDDVKKNPAAATEGIVIRRRLQLMMYNNMFRIMFDRRFESEDDPLFLKLKALNGERSRLAQSFEYNYGDFIPILRPFLRNYLKLCKEVKDKRIQLFKDYFVDERKKIGSTKKMDNNQLKCAIDHILEAKEKGEINEDNVLYIVENINVAAIETTLWSIEWGIAELVNHPEIQAKLRHELDTKLGPGVQITEPDVQNLPYLQAVVKETLRLRMAIPLLVPHMNLHDAKLGGFDIPAESKILVNAWWLANNPDQWKKPEEFRPERFLEEEAKVEANGNDFRYLPFGVGRRSCPGIILALPILGITIGRLVQNFELLPPPGQSKIDTDEKGGQFSLHILKHSTIVAKPRSF,uniprot_search,Q04468,COc1ccc2ccc(=O)oc2c1.O=O>>O.O=c1ccc2ccc(O)cc2o1,0.19,10000000.0,30.0,7.199999999999999,1.14.14.91,4233.0,-0.721246399047171,COc1ccc2ccc(=O)oc2c1.O=O,O.O=c1ccc2ccc(O)cc2o1,-0.721246399047171,COc1ccc2ccc(=O)oc2c1.O=O__MDLLLIEKTLVALFAAIIGAILISKLRGKKFKLPPGPIPVPIFGNWLQVGDDLNHRNLTDLAKRFGEILLLRMGQRNLVVVSSPELAKEVLHTQGVEFGSRTRNVVFDIFTGKGQDMVFTVYGEHWRKMRRIMTVPFFTNKVVQQYRYGWEAEAAAVVDDVKKNPAAATEGIVIRRRLQLMMYNNMFRIMFDRRFESEDDPLFLKLKALNGERSRLAQSFEYNYGDFIPILRPFLRNYLKLCKEVKDKRIQLFKDYFVDERKKIGSTKKMDNNQLKCAIDHILEAKEKGEINEDNVLYIVENINVAAIETTLWSIEWGIAELVNHPEIQAKLRHELDTKLGPGVQITEPDVQNLPYLQAVVKETLRLRMAIPLLVPHMNLHDAKLGGFDIPAESKILVNAWWLANNPDQWKKPEEFRPERFLEEEAKVEANGNDFRYLPFGVGRRSCPGIILALPILGITIGRLVQNFELLPPPGQSKIDTDEKGGQFSLHILKHSTIVAKPRSF,./data/raw/alphafold//AF-Q04468-F1-model_v4.pdb,3368,2239,3931,2806
+1566,2356,2389,MSAFNTTLPSLDYDDDTLREHLQGADIPTLLLTVAHLTGDLQILKPNWKPSIAMGVARSGMDLETEAQVREFCLQRLIDFRDSGQPAPGRPTSDQLHILGTWLMGPVIEPYLPLIAEEAVTAEEDLRAPRWHKDHVASGRDFKVVIIGAGESGMIAALRFKQAGVPFVIYEKGNDVGGTWRENTYPGCRVDINSFWYSFSFARGIWDDCFAPAPQVFAYMQAVAREHGLYEHIRFNTEVSDAHWDESTQRWQLLYRDSEGQTQVDSNVVVFAVGQLNRPMIPAIPGIETFKGPMFHSAQWDHDVDWSGKRVGVIGTGASATQFIPQLAQTAAELKVFARTTNWLLPTPDLHEKISDSCKWLLAHVPHYSLWYRVAMAMPQSVGFLEDVMVDVGYPPTELAVSARNDRLRQDISAWMEPQFADRPDLREVLIPDSPVGGKRIVRDNGTWISTLKRDNVSMIRQPIEVITPKGICCVDGTEHEFDLIVYGTGFHASKFLMPINVTGRDGVALHDVWKGDDARAYLGMTVPQFPNMFCMYGPNTGLVVYSTVIQFSEMTASYIVDAVRLLLEGGHQSMEVKTPVFESYNQRVDEGNALRAWGFSKVNSWYKNSKGRVTQNFPFTAVEFWQRTHSVEPTDYQLG,brenda,Q93TJ5,CC(=O)c1ccccc1.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.[H+]>>CC(=O)Oc1ccccc1.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,4.5,6.322384260924809e-15,30.0,7.0,1.14.13.84,294.0,0.6532125137753437,CC(=O)c1ccccc1.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.[H+],CC(=O)Oc1ccccc1.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,0.6532125137753437,CC(=O)c1ccccc1.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.[H+]__MSAFNTTLPSLDYDDDTLREHLQGADIPTLLLTVAHLTGDLQILKPNWKPSIAMGVARSGMDLETEAQVREFCLQRLIDFRDSGQPAPGRPTSDQLHILGTWLMGPVIEPYLPLIAEEAVTAEEDLRAPRWHKDHVASGRDFKVVIIGAGESGMIAALRFKQAGVPFVIYEKGNDVGGTWRENTYPGCRVDINSFWYSFSFARGIWDDCFAPAPQVFAYMQAVAREHGLYEHIRFNTEVSDAHWDESTQRWQLLYRDSEGQTQVDSNVVVFAVGQLNRPMIPAIPGIETFKGPMFHSAQWDHDVDWSGKRVGVIGTGASATQFIPQLAQTAAELKVFARTTNWLLPTPDLHEKISDSCKWLLAHVPHYSLWYRVAMAMPQSVGFLEDVMVDVGYPPTELAVSARNDRLRQDISAWMEPQFADRPDLREVLIPDSPVGGKRIVRDNGTWISTLKRDNVSMIRQPIEVITPKGICCVDGTEHEFDLIVYGTGFHASKFLMPINVTGRDGVALHDVWKGDDARAYLGMTVPQFPNMFCMYGPNTGLVVYSTVIQFSEMTASYIVDAVRLLLEGGHQSMEVKTPVFESYNQRVDEGNALRAWGFSKVNSWYKNSKGRVTQNFPFTAVEFWQRTHSVEPTDYQLG,./data/raw/alphafold//AF-Q93TJ5-F1-model_v4.pdb,1369,868,664,864
+1567,17972,18222,MATRSPGVVISDDEPGYDLDLFCIPNHYAEDLERVFIPHGLIMDRTERLARDVMKEMGGHHIVALCVLKGGYKFFADLLDYIKALNRNSDRSIPMTVDFIRLKSYCNDQSTGDIKVIGGDDLSTLTGKNVLIVEDIIDTGKTMQTLLSLVRQYNPKMVKVASLLVKRTPRSVGYKPDFVGFEIPDKFVVGYALDYNEYFRDLNHVCVISETGKAKYKA,sabio,P00492,Nc1nc2c(ncn2C2OC(COP(=O)(O)O)C(O)C2O)c(=O)[nH]1.O=P(O)(O)OP(=O)(O)O>>O=P(O)(O)OCC1OC(OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,10.48,2.417864309930496,30.0,7.4,2.4.2.8,9606.0,1.0203612826477078,Nc1nc2c(ncn2C2OC(COP(=O)(O)O)C(O)C2O)c(=O)[nH]1.O=P(O)(O)OP(=O)(O)O,O=P(O)(O)OCC1OC(OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,1.0203612826477078,Nc1nc2c(ncn2C2OC(COP(=O)(O)O)C(O)C2O)c(=O)[nH]1.O=P(O)(O)OP(=O)(O)O__MATRSPGVVISDDEPGYDLDLFCIPNHYAEDLERVFIPHGLIMDRTERLARDVMKEMGGHHIVALCVLKGGYKFFADLLDYIKALNRNSDRSIPMTVDFIRLKSYCNDQSTGDIKVIGGDDLSTLTGKNVLIVEDIIDTGKTMQTLLSLVRQYNPKMVKVASLLVKRTPRSVGYKPDFVGFEIPDKFVVGYALDYNEYFRDLNHVCVISETGKAKYKA,./data/raw/alphafold//AF-P00492-F1-model_v4.pdb,2463,4884,4954,4808
+1568,10888,11043,MLHRINPVRFSMQSCQRYFSKLVSPLEQHKSNTFTNRVRIPIEAGQPLHETRPFLIKSGELTPGISALEYYERRIRLAETLPPKSCVILAGNDIQFASGAVFYPFQQENDLFYLSGWNEPNSVMILEKPTDSLSDTIFHMLVPPKDAFAEKWEGFRSGVYGVQEIFNADESASINDLSKYLPKIINRNDFIYFDMLSTSNPSSSNFKHIKSLLDGSGNSNRSLNSIANKTIKPISKRIAEFRKIKSPQELRIMRRAGQISGRSFNQAFAKRFRNERTLDSFLHYKFISGGCDKDAYIPVVATGSNSLCIHYTRNDDVMFDDEMVLVDAAGSLGGYCADISRTWPNSGKFTDAQRDLYEAVLNVQRDCIKLCKASNNYSLHDIHEKSITLMKQELKNLGIDKVSGWNVEKLYPHYIGHNLGLDVHDVPKVSRYEPLKVGQVITIEPGLYIPNEESFPSYFRNVGIRIEDDIAIGEDTYTNLTVEAVKEIDDLENVMQNGLSTKFEEDQVAPL,brenda,P40051,C[C@H](N=C(O)[C@H](C)N=C(O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O.O>>C[C@H](N)C(O)=N[C@@H](C)C(=O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O,1.4,1.6627494811038317e-14,40.0,7.5,3.4.11.26,4932.0,0.1461280356782379,C[C@H](N=C(O)[C@H](C)N=C(O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O.O,C[C@H](N)C(O)=N[C@@H](C)C(=O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.1461280356782379,C[C@H](N=C(O)[C@H](C)N=C(O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O.O__MLHRINPVRFSMQSCQRYFSKLVSPLEQHKSNTFTNRVRIPIEAGQPLHETRPFLIKSGELTPGISALEYYERRIRLAETLPPKSCVILAGNDIQFASGAVFYPFQQENDLFYLSGWNEPNSVMILEKPTDSLSDTIFHMLVPPKDAFAEKWEGFRSGVYGVQEIFNADESASINDLSKYLPKIINRNDFIYFDMLSTSNPSSSNFKHIKSLLDGSGNSNRSLNSIANKTIKPISKRIAEFRKIKSPQELRIMRRAGQISGRSFNQAFAKRFRNERTLDSFLHYKFISGGCDKDAYIPVVATGSNSLCIHYTRNDDVMFDDEMVLVDAAGSLGGYCADISRTWPNSGKFTDAQRDLYEAVLNVQRDCIKLCKASNNYSLHDIHEKSITLMKQELKNLGIDKVSGWNVEKLYPHYIGHNLGLDVHDVPKVSRYEPLKVGQVITIEPGLYIPNEESFPSYFRNVGIRIEDDIAIGEDTYTNLTVEAVKEIDDLENVMQNGLSTKFEEDQVAPL,./data/raw/alphafold//AF-P40051-F1-model_v4.pdb,3602,3572,1355,3313
+1569,9513,9657,MPVDVASPAGKTVCVTGAGGYIASWIVKILLERGYTVKGTVRNPDDPKNTHLRELEGGKERLILCKADLQDYEALKAAIDGCDGVFHTASPVTDDPEQMVEPAVNGAKFVINAAAEAKVKRVVITSSIGAVYMDPNRDPEAVVDESCWSDLDFCKNTKNWYCYGKMVAEQAAWETAKEKGVDLVVLNPVLVLGPPLQPTINASLYHVLKYLTGSAKTYANLTQAYVDVRDVALAHVLVYEAPSASGRYLLAESARHRGEVVEILAKLFPEYPLPTKCKDEKNPRAKPYKFTNQKIKDLGLEFTSTKQSLYDTVKSLQEKGHLAPPPPPPSASQESVENGIKIGS,sabio,Q9S9N9,COc1cc(C=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2OP(=O)(O)O)ccc1O.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(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS.COc1cc(C=CC=O)ccc1O.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,136.79999999999998,6.724465379876674e-15,30.0,6.25,1.2.1.44,3702.0,2.1360860973840974,COc1cc(C=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2OP(=O)(O)O)ccc1O.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(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS.COc1cc(C=CC=O)ccc1O.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,2.1360860973840974,COc1cc(C=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2OP(=O)(O)O)ccc1O.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]__MPVDVASPAGKTVCVTGAGGYIASWIVKILLERGYTVKGTVRNPDDPKNTHLRELEGGKERLILCKADLQDYEALKAAIDGCDGVFHTASPVTDDPEQMVEPAVNGAKFVINAAAEAKVKRVVITSSIGAVYMDPNRDPEAVVDESCWSDLDFCKNTKNWYCYGKMVAEQAAWETAKEKGVDLVVLNPVLVLGPPLQPTINASLYHVLKYLTGSAKTYANLTQAYVDVRDVALAHVLVYEAPSASGRYLLAESARHRGEVVEILAKLFPEYPLPTKCKDEKNPRAKPYKFTNQKIKDLGLEFTSTKQSLYDTVKSLQEKGHLAPPPPPPSASQESVENGIKIGS,./data/raw/alphafold//AF-Q9S9N9-F1-model_v4.pdb,1657,3483,1712,1433
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+1601,5202,5288,MLVYGLYKSPLGYITVAKDDKGFIMLDFCDCVEGNSRDDSSFTEFFHKLDLYFEGKPINLREPINLKTYPFRLSVFKEVMKIPWGKVMTYKQIADSLGTSPRAVGMALSKNPILLIIPCHRVIAENGIGGYSRGVKLKRALLELEGVKIPE,brenda,Q97VW7,CC(O)[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](CO)N=C(O)[C@H](CC(=N)O)N=C(O)[C@@H](N)CS)C(=O)O.N=c1nc(OCc2ccc(CN=C(O)c3ccc(C(=O)O)c(C4=C5C=CC(=O)CC5Oc5cc(O)ccc54)c3)cc2)c2nc[nH]c2[nH]1>>N=c1nc(O)c2nc[nH]c2[nH]1,8.4,79.74965693852273,50.0,6.5,2.1.1.63,2287.0,0.9242792860618816,CC(O)[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](CO)N=C(O)[C@H](CC(=N)O)N=C(O)[C@@H](N)CS)C(=O)O.N=c1nc(OCc2ccc(CN=C(O)c3ccc(C(=O)O)c(C4=C5C=CC(=O)CC5Oc5cc(O)ccc54)c3)cc2)c2nc[nH]c2[nH]1,N=c1nc(O)c2nc[nH]c2[nH]1,0.9242792860618816,CC(O)[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](CO)N=C(O)[C@H](CC(=N)O)N=C(O)[C@@H](N)CS)C(=O)O.N=c1nc(OCc2ccc(CN=C(O)c3ccc(C(=O)O)c(C4=C5C=CC(=O)CC5Oc5cc(O)ccc54)c3)cc2)c2nc[nH]c2[nH]1__MLVYGLYKSPLGYITVAKDDKGFIMLDFCDCVEGNSRDDSSFTEFFHKLDLYFEGKPINLREPINLKTYPFRLSVFKEVMKIPWGKVMTYKQIADSLGTSPRAVGMALSKNPILLIIPCHRVIAENGIGGYSRGVKLKRALLELEGVKIPE,./data/raw/alphafold//AF-Q97VW7-F1-model_v4.pdb,3105,1870,3502,2320
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+1604,3344,3392,MAEQLVEAPAYARTLDRAVEYLLSCQKDEGYWWGPLLSNVTMEAEYVLLCHILDRVDRDRMEKIRRYLLHEQREDGTWALYPGGPPDLDTTIEAYVALKYIGMSRDEEPMQKALRFIQSQGGIESSRVFTRMWLALVGEYPWEKVPMVPPEIMFLGKRMPLNIYEFGSWARATVVALSIVMSRQPVFPLPERARVPELYETDVPPRRRGAKGGGGWIFDALDRALHGYQKLSVHPFRRAAEIRALDWLLERQAGDGSWGGIQPPWFYALIALKILDMTQHPAFIKGWEGLELYGVELDYGGWMFQASISPVWDTGLAVLALRAAGLPADHDRLVKAGEWLLDRQITVPGDWAVKRPNLKPGGFAFQFDNVYYPDVDDTAVVVWALNTLRLPDERRRRDAMTKGFRWIVGMQSSNGGWGAYDVDNTSDLPNHIPFCDFGEVTDPPSEDVTAHVLECFGSFGYDDAWKVIRRAVEYLKREQKPDGSWFGRWGVNYLYGTGAVVSALKAVGIDTREPYIQKALDWVEQHQNPDGGWGEDCRSYEDPAYAGKGASTPSQTAWALMALIAGGRAESEAARRGVQYLVETQRPDGGWDEPYYTGTGFPGDFYLGYTMYRHVFPTLALGRYKQAIERR,sabio,P33247,CC(C)=CCCC(C)=CCCC(C)=CCCC=C(C)CCC=C(C)CCC=C(C)C>>C=C(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCCC(C)(C)C3CCC21C,3108.0,0.0,45.0,6.0,5.4.99.17,405212.0,3.492481010128877,CC(C)=CCCC(C)=CCCC(C)=CCCC=C(C)CCC=C(C)CCC=C(C)C,C=C(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCCC(C)(C)C3CCC21C,3.567731962548069,CC(C)=CCCC(C)=CCCC(C)=CCCC=C(C)CCC=C(C)CCC=C(C)C__MAEQLVEAPAYARTLDRAVEYLLSCQKDEGYWWGPLLSNVTMEAEYVLLCHILDRVDRDRMEKIRRYLLHEQREDGTWALYPGGPPDLDTTIEAYVALKYIGMSRDEEPMQKALRFIQSQGGIESSRVFTRMWLALVGEYPWEKVPMVPPEIMFLGKRMPLNIYEFGSWARATVVALSIVMSRQPVFPLPERARVPELYETDVPPRRRGAKGGGGWIFDALDRALHGYQKLSVHPFRRAAEIRALDWLLERQAGDGSWGGIQPPWFYALIALKILDMTQHPAFIKGWEGLELYGVELDYGGWMFQASISPVWDTGLAVLALRAAGLPADHDRLVKAGEWLLDRQITVPGDWAVKRPNLKPGGFAFQFDNVYYPDVDDTAVVVWALNTLRLPDERRRRDAMTKGFRWIVGMQSSNGGWGAYDVDNTSDLPNHIPFCDFGEVTDPPSEDVTAHVLECFGSFGYDDAWKVIRRAVEYLKREQKPDGSWFGRWGVNYLYGTGAVVSALKAVGIDTREPYIQKALDWVEQHQNPDGGWGEDCRSYEDPAYAGKGASTPSQTAWALMALIAGGRAESEAARRGVQYLVETQRPDGGWDEPYYTGTGFPGDFYLGYTMYRHVFPTLALGRYKQAIERR,./data/raw/alphafold//AF-P33247-F1-model_v4.pdb,1762,1425,2473,1730
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+1606,15581,15805,METSQPHNAESMSQDLSELLKEATKEVHEQAENTPFMKNFQKGQVSLHEFKLVTASLYFIYSALEEEIERNKDNPVYAPVYFPMELHRKAALEKDLEYFYGSNWRAEIPCPEATQKYVERLHVVGKKHPELLVAHAYTRYLGDLSGGQVLKKIAQKALQLPSTGEGLAFFTFDGVSNATKFKQLYRSRMNALEMDHATKKRVLEEAKKAFLLNIQVFEALQKLVSKSQENGHAVQPKAELRTRSVNKSHENSPAAGKESERTSRMQADMLTTSPLVRWLLALGFIATTVAVGLFAM,sabio,P14791,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.O=O>>C=CC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\N=C(O)C(C)=C4C=C)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)N=C1O.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.[C-]#[O+].[Fe+2],1152.0,27.66511935303088,37.0,7.4,1.14.14.18,9031.0,3.061452479087193,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.O=O,C=CC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\N=C(O)C(C)=C4C=C)c(C)c3CCC(=O)O)C(CCC(=O)O)=C2C)N=C1O.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.[C-]#[O+].[Fe+2],3.061452479087193,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.O=O__METSQPHNAESMSQDLSELLKEATKEVHEQAENTPFMKNFQKGQVSLHEFKLVTASLYFIYSALEEEIERNKDNPVYAPVYFPMELHRKAALEKDLEYFYGSNWRAEIPCPEATQKYVERLHVVGKKHPELLVAHAYTRYLGDLSGGQVLKKIAQKALQLPSTGEGLAFFTFDGVSNATKFKQLYRSRMNALEMDHATKKRVLEEAKKAFLLNIQVFEALQKLVSKSQENGHAVQPKAELRTRSVNKSHENSPAAGKESERTSRMQADMLTTSPLVRWLLALGFIATTVAVGLFAM,./data/raw/alphafold//AF-P14791-F1-model_v4.pdb,1191,812,2132,5000
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+1620,10965,11120,MAFRQALQLAACGLAGGSAAVLFSAVAVGKPRAGGDAEPRPAEPPAWAGGARPGPGVWDPNWDRREPLSLINVRKRNVESGEEELASKLDHYKAKATRHIFLIRHSQYHVDGSLEKDRTLTPLGREQAELTGLRLASLGLKFNKIVHSSMTRAIETTDIISRHLPGVCKVSTDLLREGAPIEPDPPVSHWKPEAVQYYEDGARIEAAFRNYIHRADARQEEDSYEIFICHANVIRYIVCRALQFPPEGWLRLSLNNGSITHLVIRPNGRVALRTLGDTGFMPPDKITRS,brenda,Q96HS1,C[C@H](N=C(O)[C@H](COP(=O)(O)O)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H](N)CC(=N)O)C(=O)N1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(O)=N[C@@H](CO)C(=O)N1CCC[C@@H]1C(=O)O.O>>C[C@H](N=C(O)[C@H](CO)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H](N)CC(=N)O)C(=O)N1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(O)=N[C@@H](CO)C(=O)N1CCC[C@@H]1C(=O)O.O=P(O)(O)O,1.33,8.774021392075613e-15,30.0,7.75,3.1.3.16,9606.0,0.1238516409670858,C[C@H](N=C(O)[C@H](COP(=O)(O)O)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H](N)CC(=N)O)C(=O)N1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(O)=N[C@@H](CO)C(=O)N1CCC[C@@H]1C(=O)O.O,C[C@H](N=C(O)[C@H](CO)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H](N)CC(=N)O)C(=O)N1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(O)=N[C@@H](CO)C(=O)N1CCC[C@@H]1C(=O)O.O=P(O)(O)O,0.1238516409670858,C[C@H](N=C(O)[C@H](COP(=O)(O)O)N=C(O)[C@H](Cc1cnc[nH]1)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H](N)CC(=N)O)C(=O)N1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(O)=N[C@@H](CO)C(=O)N1CCC[C@@H]1C(=O)O.O__MAFRQALQLAACGLAGGSAAVLFSAVAVGKPRAGGDAEPRPAEPPAWAGGARPGPGVWDPNWDRREPLSLINVRKRNVESGEEELASKLDHYKAKATRHIFLIRHSQYHVDGSLEKDRTLTPLGREQAELTGLRLASLGLKFNKIVHSSMTRAIETTDIISRHLPGVCKVSTDLLREGAPIEPDPPVSHWKPEAVQYYEDGARIEAAFRNYIHRADARQEEDSYEIFICHANVIRYIVCRALQFPPEGWLRLSLNNGSITHLVIRPNGRVALRTLGDTGFMPPDKITRS,./data/raw/alphafold//AF-Q96HS1-F1-model_v4.pdb,1868,1571,3159,1930
+1621,6950,7066,MYYSNGNYEAFARPKKPEGVDNKSAYLVGSGLASLAAASFLIRDGQMKGENIHILEELDLPGGSLDGILNPERGYIMRGGREMENHFECLWDLFRSVPSLEVEDASVLDEFYWLNKEDPNYSKCRVIENRGQRLESDGKMTLTKKANKEIIQLCLMKEEQLNDVKISDVFSKDFLDSNFWIYWKTMFAFEPWHSAMEMRRYLMRFIHHIGGLADFSALKFTKFNQFESLVMPLIEHLKAKNVTFEYGVTVKNIQVECSKESKVAKAIDIVRRGNEESIPLTENDLVFVTNGSITESTTYGDNDTPAPPTSKPGGAWQLWENLSTQCEEFGNPAKFYKDLPEKSWFVSATATTNNKEVIDYIQKICKRDPLSGRTVTGGIVTVDDSNWQLSFTLNRQQQFKNQPDDQVSVWIYALYSDERGERTNKTIVECSGKEICEEWLYHMGVPEEKISALAAECNTIPSYMPYITAYFMPRKEGDRPLVVPHGSKNIAFIGNFAETERDTVFTTEYSVRTAMEAVYKLLEVDRGVPEVFASVYDVRILLHALSVLNDGKKLDEIDMPFYERLVEKRLLKKASGTFIEELLEEANLI,brenda,B9E972,CCCCCC/C=C\CCCCCCCC(=O)O.O>>CCCCCCC(O)CCCCCCCCC(=O)O,3.83,1.041359087176666e-14,25.0,6.5,4.2.1.53,69966.0,0.5831987739686227,CCCCCC/C=C\CCCCCCCC(=O)O.O,CCCCCCC(O)CCCCCCCCC(=O)O,0.5831987739686227,CCCCCC/C=C\CCCCCCCC(=O)O.O__MYYSNGNYEAFARPKKPEGVDNKSAYLVGSGLASLAAASFLIRDGQMKGENIHILEELDLPGGSLDGILNPERGYIMRGGREMENHFECLWDLFRSVPSLEVEDASVLDEFYWLNKEDPNYSKCRVIENRGQRLESDGKMTLTKKANKEIIQLCLMKEEQLNDVKISDVFSKDFLDSNFWIYWKTMFAFEPWHSAMEMRRYLMRFIHHIGGLADFSALKFTKFNQFESLVMPLIEHLKAKNVTFEYGVTVKNIQVECSKESKVAKAIDIVRRGNEESIPLTENDLVFVTNGSITESTTYGDNDTPAPPTSKPGGAWQLWENLSTQCEEFGNPAKFYKDLPEKSWFVSATATTNNKEVIDYIQKICKRDPLSGRTVTGGIVTVDDSNWQLSFTLNRQQQFKNQPDDQVSVWIYALYSDERGERTNKTIVECSGKEICEEWLYHMGVPEEKISALAAECNTIPSYMPYITAYFMPRKEGDRPLVVPHGSKNIAFIGNFAETERDTVFTTEYSVRTAMEAVYKLLEVDRGVPEVFASVYDVRILLHALSVLNDGKKLDEIDMPFYERLVEKRLLKKASGTFIEELLEEANLI,./data/raw/alphafold//AF-B9E972-F1-model_v4.pdb,3115,1882,3514,2333
+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
+1628,1149,1176,MATLKEKLITPVAAGSTVPSNKITVVGVGQVGMACAISILGKGLCDELALVDVLEDKLKGEMMDLQHGSLFLQTHKIVADKDYAVTANSKIVVVTAGVRQQEGESRLNLVQRNVNVFKFIIPQIVKYSPNCTILVVSNPVDILTYVTWKLSGLPKHRVIGSGCNLDTARFRYLMAERLGIHPTSCHGWILGEHGDSSVAVWSGVNVAGVSLQELNPAMGTDKDSENWKEVHKQVVESAYEVIRLKGYTNWAIGLSVAELCETMLKNLYRVHSVSTLVKGTYGIENDVFLSLPCVLSASGLTSVINQKLKDDEVAQLKKSADTLWSIQKDLKDL,sabio,P00337,CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]>>CC(O)C(=O)O.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)c1,1000000.0,7.528770100343302e-15,25.0,7.5,1.1.1.27,9031.0,6.0,CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],CC(O)C(=O)O.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)c1,6.0,CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]__MATLKEKLITPVAAGSTVPSNKITVVGVGQVGMACAISILGKGLCDELALVDVLEDKLKGEMMDLQHGSLFLQTHKIVADKDYAVTANSKIVVVTAGVRQQEGESRLNLVQRNVNVFKFIIPQIVKYSPNCTILVVSNPVDILTYVTWKLSGLPKHRVIGSGCNLDTARFRYLMAERLGIHPTSCHGWILGEHGDSSVAVWSGVNVAGVSLQELNPAMGTDKDSENWKEVHKQVVESAYEVIRLKGYTNWAIGLSVAELCETMLKNLYRVHSVSTLVKGTYGIENDVFLSLPCVLSASGLTSVINQKLKDDEVAQLKKSADTLWSIQKDLKDL,./data/raw/alphafold//AF-P00337-F1-model_v4.pdb,1282,5245,1635,777
+1629,3245,3289,MPKRQAQRRFTRKTDSKTPSQPLVSRRSANYQPSLWQHEYLLSLGNTYVKEDNVERVTLLKQEVSKMLNETEGLLEQLELIDTLQRLGVSYHFEQEIKKTLTNVHVKNVRAHKNRIDRNRWGDLYATALEFRLLRQHGFSIAQDVFDGNIGVDLDDKDIKGILSLYEASYLSTRIDTKLKESIYYTTKRLRKFVEVNKNETKSYTLRRMVIHALEMPYHRRVGRLEARWYIEVYGERHDMNPILLELAKLDFNFVQAIHQDELKSLSSWWSKTGLTKHLDFVRDRITEGYFSSVGVMYEPEFAYHRQMLTKVFMLITTIDDIYDIYGTLEELQLFTTIVEKWDVNRLEELPNYMKLCFLCLVNEINQIGYFVLRDKGFNVIPYLKESWADMCTTFLKEAKWYKSGYKPNFEEYMQNGWISSSVPTILLHLFCLLSDQTLDILGSYNHSVVRSSATILRLANDLATSSEELARGDTMKSVQCHMHETGASEAESRAYIQGIIGVAWDDLNMEKKSCRLHQGFLEAAANLGRVAQCVYQYGDGHGCPDKAKTVNHVRSLLVHPLPLN,brenda,A4FVP2,CC(C)=CCC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O>>C=C/C(C)=C/CC=C(C)C.O=P(O)(O)OP(=O)(O)O,0.0048,9.765590839821598,30.0,7.5,4.2.3.106,3702.0,-2.318758762624413,CC(C)=CCC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O,C=C/C(C)=C/CC=C(C)C.O=P(O)(O)OP(=O)(O)O,-2.318758762624413,CC(C)=CCC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O__MPKRQAQRRFTRKTDSKTPSQPLVSRRSANYQPSLWQHEYLLSLGNTYVKEDNVERVTLLKQEVSKMLNETEGLLEQLELIDTLQRLGVSYHFEQEIKKTLTNVHVKNVRAHKNRIDRNRWGDLYATALEFRLLRQHGFSIAQDVFDGNIGVDLDDKDIKGILSLYEASYLSTRIDTKLKESIYYTTKRLRKFVEVNKNETKSYTLRRMVIHALEMPYHRRVGRLEARWYIEVYGERHDMNPILLELAKLDFNFVQAIHQDELKSLSSWWSKTGLTKHLDFVRDRITEGYFSSVGVMYEPEFAYHRQMLTKVFMLITTIDDIYDIYGTLEELQLFTTIVEKWDVNRLEELPNYMKLCFLCLVNEINQIGYFVLRDKGFNVIPYLKESWADMCTTFLKEAKWYKSGYKPNFEEYMQNGWISSSVPTILLHLFCLLSDQTLDILGSYNHSVVRSSATILRLANDLATSSEELARGDTMKSVQCHMHETGASEAESRAYIQGIIGVAWDDLNMEKKSCRLHQGFLEAAANLGRVAQCVYQYGDGHGCPDKAKTVNHVRSLLVHPLPLN,./data/raw/alphafold//AF-A4FVP2-F1-model_v4.pdb,1744,1383,2422,1674
+1630,17523,17761,MTAPADTVHPAGQPDYVAQVATVPFRLGRPEELPGTLDELRAAVSARAGEAVRGLNRPGARTDLAALLAATERTRAALAPVGAGPVGDDPSESEANRDNDLAFGIVRTRGPVAELLVDAALAALAGILEVAVDRGSDLEDAAWQRFIGGFDALLGWLADPHSAPRPATVPGAGPAGPPVHQDALRRWVRGHHVFMVLAQGCALATACLRDSAARGDLPGAEASAAAAEALMRGCQGALLYAGDANREQYNEQIRPTLMPPVAPPKMSGLHWRDHEVLIKELAGSRDAWEWLSAQGSERPATFRAALAETYDSHIGVCGHFVGDQSPSLLAAQGSTRSAVGVIGQFRKIRLSALPEQPATQQGEPS,brenda,B0CN28,N[C@@H](Cc1ccc(O)cc1)C(=O)O.OO.[H+]>>,0.205,99.53962239829109,25.0,9.0,1.11.2.5,1914.0,-0.6882461389442457,N[C@@H](Cc1ccc(O)cc1)C(=O)O.OO.[H+],,-0.6882461389442457,N[C@@H](Cc1ccc(O)cc1)C(=O)O.OO.[H+]__MTAPADTVHPAGQPDYVAQVATVPFRLGRPEELPGTLDELRAAVSARAGEAVRGLNRPGARTDLAALLAATERTRAALAPVGAGPVGDDPSESEANRDNDLAFGIVRTRGPVAELLVDAALAALAGILEVAVDRGSDLEDAAWQRFIGGFDALLGWLADPHSAPRPATVPGAGPAGPPVHQDALRRWVRGHHVFMVLAQGCALATACLRDSAARGDLPGAEASAAAAEALMRGCQGALLYAGDANREQYNEQIRPTLMPPVAPPKMSGLHWRDHEVLIKELAGSRDAWEWLSAQGSERPATFRAALAETYDSHIGVCGHFVGDQSPSLLAAQGSTRSAVGVIGQFRKIRLSALPEQPATQQGEPS,./data/raw/alphafold//AF-B0CN28-F1-model_v4.pdb,1956,4105,1965,3803
+1631,8479,8610,MLPRVARLNTHLVSLALLGFQITYGAITYQHPDDLPSDVDYDFIVAGGGTAGLVVASRLSENPDWNILVIEAGPSNKDAPETRVPGLAGSLPASRTDWNYTTIPQDALGGRSLNYSRAKVLGGCSSHNSMVYTRGSKDDWNHWADITGDQGLSWDSILPVMKKAEKFSKDFSNQSVDGHIDPSMHGHDGLLSVVSSYTNVSFNDLLLETTKELSDEFPFKLDLNDGNPHGLAWTQYTIDHRAERSSSATSYLESTRDNVHVLVNSRVTRIFSAGNGTDFRSVEFAVDANSPKKVLTAKKEVILSAGVIASPQVLMNSGIGGREELQAIGVDTLIDNPSVGKNLSDQAATLLMFDTTLPNTDYDVAAALTEWEDSRSGPMAYGARLNHLTWVRLLDDKLNGSDPSSGKNSPHIEFQFMQISHQLPPADAPNQVKLPDPDSIGAVLLLAVVNLYSVSHGSIILNDNDPFANPMIDLNMFGDQKDIAILREGVRSARRMFSSQAFKDVVNGTVYPPADVTSDEDLDAFLRTSAISYWHGVGTLSMSPQNASWGVVDPDFRVKGTSGLRVVDASVIPYAPAGHTQVPVYTFAEHASVLIAKSYA,brenda,Q0R4L2,CCn1/c(=N\N=c2\sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O>>O=C1[C@@H](O)C(O)O[C@H](CO)[C@H]1O,5.32,59.11791360386669,30.0,4.0,1.1.99.29,201219.0,0.7259116322950482,CCn1/c(=N\N=c2\sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,O=C1[C@@H](O)C(O)O[C@H](CO)[C@H]1O,0.7259116322950482,CCn1/c(=N\N=c2\sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O__MLPRVARLNTHLVSLALLGFQITYGAITYQHPDDLPSDVDYDFIVAGGGTAGLVVASRLSENPDWNILVIEAGPSNKDAPETRVPGLAGSLPASRTDWNYTTIPQDALGGRSLNYSRAKVLGGCSSHNSMVYTRGSKDDWNHWADITGDQGLSWDSILPVMKKAEKFSKDFSNQSVDGHIDPSMHGHDGLLSVVSSYTNVSFNDLLLETTKELSDEFPFKLDLNDGNPHGLAWTQYTIDHRAERSSSATSYLESTRDNVHVLVNSRVTRIFSAGNGTDFRSVEFAVDANSPKKVLTAKKEVILSAGVIASPQVLMNSGIGGREELQAIGVDTLIDNPSVGKNLSDQAATLLMFDTTLPNTDYDVAAALTEWEDSRSGPMAYGARLNHLTWVRLLDDKLNGSDPSSGKNSPHIEFQFMQISHQLPPADAPNQVKLPDPDSIGAVLLLAVVNLYSVSHGSIILNDNDPFANPMIDLNMFGDQKDIAILREGVRSARRMFSSQAFKDVVNGTVYPPADVTSDEDLDAFLRTSAISYWHGVGTLSMSPQNASWGVVDPDFRVKGTSGLRVVDASVIPYAPAGHTQVPVYTFAEHASVLIAKSYA,./data/raw/alphafold//AF-Q0R4L2-F1-model_v4.pdb,1062,627,1222,332
+1632,9634,9780,MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,brenda,O94219,COc1ccc(C=O)cc1.O=O>>COc1ccc(C(=O)O)cc1.OO,0.11,5.070206101133949,25.0,6.0,1.1.3.47,5323.0,-0.958607314841775,COc1ccc(C=O)cc1.O=O,COc1ccc(C(=O)O)cc1.OO,-0.9208187539523752,COc1ccc(C=O)cc1.O=O__MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,./data/raw/alphafold//AF-O94219-F1-model_v4.pdb,1050,3522,1297,300
+1633,13109,13284,MKYGIVGYSGRMGQEIQKVFSEKGHELVLKVDVNGVEELDSPDVVIDFSSPEALPKTVDLCKKYRAGLVLGTTALKEEHLQMLRELSKEVPVVQAYNFSIGINVLKRFLSELVKVLEDWDVEIVETHHRFKKDAPSGTAILLESALGKSVPIHSLRVGGVPGDHVVVFGNIGETIEIKHRAISRTVFAIGALKAAEFLVGKDPGMYSFEEVIFGGE,brenda,Q9X1K8,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.O=C(O)C1=NC(C(=O)O)CC=C1.[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.O=C(O)C1=NC(C(=O)O)CCC1,8.1,6.798720097215373e-15,50.0,7.5,1.17.1.8,2336.0,0.9084850188786496,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.O=C(O)C1=NC(C(=O)O)CC=C1.[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.O=C(O)C1=NC(C(=O)O)CCC1,1.2787536009528289,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.O=C(O)C1=NC(C(=O)O)CC=C1.[H+]__MKYGIVGYSGRMGQEIQKVFSEKGHELVLKVDVNGVEELDSPDVVIDFSSPEALPKTVDLCKKYRAGLVLGTTALKEEHLQMLRELSKEVPVVQAYNFSIGINVLKRFLSELVKVLEDWDVEIVETHHRFKKDAPSGTAILLESALGKSVPIHSLRVGGVPGDHVVVFGNIGETIEIKHRAISRTVFAIGALKAAEFLVGKDPGMYSFEEVIFGGE,./data/raw/alphafold//AF-Q9X1K8-F1-model_v4.pdb,2241,4487,4395,4284
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+1638,6489,6602,ASLQQVSNFGSNPTNINMHIYVPDRLASKPPIIVALHPCGGNAQQWFSGTRLPQYADSHGFILIYPSTPHMSNCWDVQNPASLTHGAGGDALGIVSMVNYAINRYGADRDRVYAMGFSSGGMMTNVLAGSYPDVFEAGAAYSGVPHACFLGAPAATPFSPNQTCAQGLQKTPEEWGNLVRNSYPGYNGRRPRMQITHGLNDWLVRPQCAYETLKQWSNVLGLELTRQVTSGQWTQHIYGDGTKLVGYFGQGVGHEPSVNEEQLLRFFGIIN,brenda,A0A1B1LML0,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,59.0,0.0,55.0,6.0,3.1.1.73,2588329.0,1.7708520116421442,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,1.7708520116421442,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__ASLQQVSNFGSNPTNINMHIYVPDRLASKPPIIVALHPCGGNAQQWFSGTRLPQYADSHGFILIYPSTPHMSNCWDVQNPASLTHGAGGDALGIVSMVNYAINRYGADRDRVYAMGFSSGGMMTNVLAGSYPDVFEAGAAYSGVPHACFLGAPAATPFSPNQTCAQGLQKTPEEWGNLVRNSYPGYNGRRPRMQITHGLNDWLVRPQCAYETLKQWSNVLGLELTRQVTSGQWTQHIYGDGTKLVGYFGQGVGHEPSVNEEQLLRFFGIIN,./data/raw/alphafold//AF-A0A1B1LML0-F1-model_v4.pdb,1482,1023,849,1174
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+1640,11429,11586,MKIAEIQLFQHDLPVVNGPYRIASGDVWSLTTTIVKIIAEDGTIGWGETCPVGPTYAEAHAGGALAALEVLASGLAGAEALPLPLHTRMDSLLCGHNYAKSALDIAVHDLWGKRLGVPVHELLGGALTDSVSSYYSLGVMEPDEAARQALEKQREGYSRLQVKLGARPIEIDIEAIRKVWEAVRGTGIALAADGNRGWTTRDALRFSRECPDIPFVMEQPCNSFEDLEAIRPLCHHALYMDEDGTSLNTVITAAATSLVDGFGMKVSRIGGLQHMRAFRDFCAARNLPHTCDDAWGGDIVSAACTHIASTVLPRLMEGAWLAQPYVAEHYDAENGVRIEGGRIRVPQGPGLGLTIDPERFGPPLFSA,brenda,Q0FPQ4,C[N+]1(C)CCC[C@H]1C(=O)[O-]>>C[N+]1(C)CCC[C@@H]1C(=O)[O-],5.3,0.0,,,5.1.1.22,344736.0,0.724275869600789,C[N+]1(C)CCC[C@H]1C(=O)[O-],C[N+]1(C)CCC[C@@H]1C(=O)[O-],0.724275869600789,C[N+]1(C)CCC[C@H]1C(=O)[O-]__MKIAEIQLFQHDLPVVNGPYRIASGDVWSLTTTIVKIIAEDGTIGWGETCPVGPTYAEAHAGGALAALEVLASGLAGAEALPLPLHTRMDSLLCGHNYAKSALDIAVHDLWGKRLGVPVHELLGGALTDSVSSYYSLGVMEPDEAARQALEKQREGYSRLQVKLGARPIEIDIEAIRKVWEAVRGTGIALAADGNRGWTTRDALRFSRECPDIPFVMEQPCNSFEDLEAIRPLCHHALYMDEDGTSLNTVITAAATSLVDGFGMKVSRIGGLQHMRAFRDFCAARNLPHTCDDAWGGDIVSAACTHIASTVLPRLMEGAWLAQPYVAEHYDAENGVRIEGGRIRVPQGPGLGLTIDPERFGPPLFSA,./data/raw/alphafold//AF-Q0FPQ4-F1-model_v4.pdb,3843,3965,1809,3622
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+1653,19847,20133,MKWDEIGKNIAKEIEKEILPYFGRKDKSYVVGTSPSGDETEIFDKISEDIALKYLKSLNVNIVSEELGVIDNSSEWTVVIDPIDGSFNFINGIPFFAFCFGVFKNNEPYYGLTYEFLTKSFYEAYKGKGAYLNGRKIKVKDFNPNNIVISYYPSKKIDLEKLRNKVKRVRIFGAFGLEMCYVAKGTLDAVFDVRPKVRAVDIASSYIICKEAGALITDENGDELKFDLNATDRLNIIVANSKEMLDIILDLL,uniprot_search,A0A832SVS8,O.O=P(O)(O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@@H]1O>>O=P(O)(O)O.O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O,7.72,0.0,85.0,8.0,3.1.3.25,2190.0,0.8876173003357362,O.O=P(O)(O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@@H]1O,O=P(O)(O)O.O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O,0.8987251815894935,O.O=P(O)(O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@@H]1O__MKWDEIGKNIAKEIEKEILPYFGRKDKSYVVGTSPSGDETEIFDKISEDIALKYLKSLNVNIVSEELGVIDNSSEWTVVIDPIDGSFNFINGIPFFAFCFGVFKNNEPYYGLTYEFLTKSFYEAYKGKGAYLNGRKIKVKDFNPNNIVISYYPSKKIDLEKLRNKVKRVRIFGAFGLEMCYVAKGTLDAVFDVRPKVRAVDIASSYIICKEAGALITDENGDELKFDLNATDRLNIIVANSKEMLDIILDLL,./data/raw/alphafold//AF-A0A832SVS8-F1-model_v4.pdb,3765,4552,4477,4374
+1654,2712,2749,MANLHALRREQRAQGPATIMAIGTATPPNLYEQSTFPDFYFRVTNSDDKQELKKKFRRMCEKTMVKKRYLHLTEEILKERPKLCSYKEASFDDRQDIVVEEIPRLAKEAAEKAIKEWGRPKSEITHLVFCSISGIDMPGADYRLATLLGLPLTVNRLMIYSQACHMGAAMLRIAKDLAENNRGARVLVVACEITVLSFRGPNEGDFEALAGQAGFGDGAGAVVVGADPLEGIEKPIYEIAAAMQETVAESQGAVGGHLRAFGWTFYFLNQLPAIIADNLGRSLERALAPLGVREWNDVFWVAHPGNWAIIDAIEAKLQLSPDKLSTARHVFTEYGNMQSATVYFVMDELRKRSAVEGRSTTGDGLQWGVLLGFGPGLSIETVVLRSMPL,brenda,C0SVZ6,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.CC(O)=NCCSC(=O)CC(=O)/C=C/c1ccccc1.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(O)=NCCS.O=C(/C=C(O)/C=C/c1ccccc1)/C=C/c1ccc(O)cc1,0.0142,1.8313146524729969,37.0,7.5,2.3.1.219,136217.0,-1.8477116556169435,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.CC(O)=NCCSC(=O)CC(=O)/C=C/c1ccccc1.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(O)=NCCS.O=C(/C=C(O)/C=C/c1ccccc1)/C=C/c1ccc(O)cc1,-1.8477116556169435,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.CC(O)=NCCSC(=O)CC(=O)/C=C/c1ccccc1.O__MANLHALRREQRAQGPATIMAIGTATPPNLYEQSTFPDFYFRVTNSDDKQELKKKFRRMCEKTMVKKRYLHLTEEILKERPKLCSYKEASFDDRQDIVVEEIPRLAKEAAEKAIKEWGRPKSEITHLVFCSISGIDMPGADYRLATLLGLPLTVNRLMIYSQACHMGAAMLRIAKDLAENNRGARVLVVACEITVLSFRGPNEGDFEALAGQAGFGDGAGAVVVGADPLEGIEKPIYEIAAAMQETVAESQGAVGGHLRAFGWTFYFLNQLPAIIADNLGRSLERALAPLGVREWNDVFWVAHPGNWAIIDAIEAKLQLSPDKLSTARHVFTEYGNMQSATVYFVMDELRKRSAVEGRSTTGDGLQWGVLLGFGPGLSIETVVLRSMPL,./data/raw/alphafold//AF-C0SVZ6-F1-model_v4.pdb,1656,1262,4541,1489
+1655,8241,8369,MLRRVAVAAVFATGRKLRCEAGRDVTAVGRIEARGLCEESAKPFPTLTMPGRNKAKSTCSCPDLQPNGQDLGESGRVARLGADESEEEGRSLSNVGDPEIIKSPSDPKQYRYIKLQNGLQALLISDLSNVEGKTGNATDEEEEEEEEEEEGEEEEEEEEDDDDDDDEDSGAEIQDDDEEGFDDEEEFDDDEHDDDDLDNEENELEELEERVEARKKTTEKQSAAALCVGVGSFADPDDLPGLAHFLEHMVFMGSLKYPDENGFDAFLKKHGGSDNASTDCERTVFQFDVQRKYFKEALDRWAQFFIHPLMIRDAIDREVEAVDSEYQLARPSDANRKEMLFGSLARPGHPMGKFFWGNAETLKHEPKKNNIDTHARLREFWMRYYSAHYMTLVVQSKETLDTLEKWVTEIFSQIPNNGLPKPNFSHLTDPFDTPAFNKLYRVVPIRKIHALTITWALPPQQQHYRVKPLHYISWLVGHEGKGSILSYLRKKCWALALFGGNGETGFEQNSTYSVFSISITLTDEGYEHFYEVAHTVFQYLKMLQKLGPEKRVFEEIQKIEDNEFHYQEQTDPVEYVENMCENMQLYPRQDFLTGDQLLFEYKPEVIAEALNQLVPQKANLVLLSGANEGRCDLKEKWFGTQYSIEDIENSWTELWKSNFDLNSDLHLPAENKYIATDFTLKAFDCPETEYPAKIVNTPQGCLWYKKDNKFKIPKAYIRFHLISPLIQKSAANVVLFDIFVNILTHNLAEPAYEADVAQLEYKLVAGEHGLIIRVKGFNHKLPLLFQLIIDYLTEFSSTPAVFTMITEQLKKTYFNILIKPETLAKDVRLLILEYSRWSMIDKYRALMDGLSLESLLNFVKDFKSQLFVEGLVQGNVTSTESMDFLRYVVDKLNFVPLEREMPVQFQVVELPSGHHLCKVRALNKGDANSEVTVYYQSGTRSLREYTLMELLVMHMEEPCFDFLRTKQTLGYHVYPTCRNTSGILGFSVTVGTQATKYNSETVDKKIEEFLSSFEEKIENLTEDAFNTQVTALIKLKECEDTHLGEEVDRNWNEVVTQQYLFDRLAHEIEALKSFSKSDLVSWFKAHRGPGSKMLSVHVVGYGKYELEEDGAPVCEDPNSREGMQLIYLPPSPLLAESTTPITDIRAFTATLSLFPYHKIVK,uniprot_search,P47245,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@H](C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)C.O>>CC(C)[C@H](N=C(O)[C@@H](N)CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O,15.73,1.7032182524877586e-14,37.0,8.129999999999999,3.4.24.61,10116.0,1.1967287226232868,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@H](C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)C.O,CC(C)[C@H](N=C(O)[C@@H](N)CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O,1.1967287226232868,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@H](C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)C.O__MLRRVAVAAVFATGRKLRCEAGRDVTAVGRIEARGLCEESAKPFPTLTMPGRNKAKSTCSCPDLQPNGQDLGESGRVARLGADESEEEGRSLSNVGDPEIIKSPSDPKQYRYIKLQNGLQALLISDLSNVEGKTGNATDEEEEEEEEEEEGEEEEEEEEDDDDDDDEDSGAEIQDDDEEGFDDEEEFDDDEHDDDDLDNEENELEELEERVEARKKTTEKQSAAALCVGVGSFADPDDLPGLAHFLEHMVFMGSLKYPDENGFDAFLKKHGGSDNASTDCERTVFQFDVQRKYFKEALDRWAQFFIHPLMIRDAIDREVEAVDSEYQLARPSDANRKEMLFGSLARPGHPMGKFFWGNAETLKHEPKKNNIDTHARLREFWMRYYSAHYMTLVVQSKETLDTLEKWVTEIFSQIPNNGLPKPNFSHLTDPFDTPAFNKLYRVVPIRKIHALTITWALPPQQQHYRVKPLHYISWLVGHEGKGSILSYLRKKCWALALFGGNGETGFEQNSTYSVFSISITLTDEGYEHFYEVAHTVFQYLKMLQKLGPEKRVFEEIQKIEDNEFHYQEQTDPVEYVENMCENMQLYPRQDFLTGDQLLFEYKPEVIAEALNQLVPQKANLVLLSGANEGRCDLKEKWFGTQYSIEDIENSWTELWKSNFDLNSDLHLPAENKYIATDFTLKAFDCPETEYPAKIVNTPQGCLWYKKDNKFKIPKAYIRFHLISPLIQKSAANVVLFDIFVNILTHNLAEPAYEADVAQLEYKLVAGEHGLIIRVKGFNHKLPLLFQLIIDYLTEFSSTPAVFTMITEQLKKTYFNILIKPETLAKDVRLLILEYSRWSMIDKYRALMDGLSLESLLNFVKDFKSQLFVEGLVQGNVTSTESMDFLRYVVDKLNFVPLEREMPVQFQVVELPSGHHLCKVRALNKGDANSEVTVYYQSGTRSLREYTLMELLVMHMEEPCFDFLRTKQTLGYHVYPTCRNTSGILGFSVTVGTQATKYNSETVDKKIEEFLSSFEEKIENLTEDAFNTQVTALIKLKECEDTHLGEEVDRNWNEVVTQQYLFDRLAHEIEALKSFSKSDLVSWFKAHRGPGSKMLSVHVVGYGKYELEEDGAPVCEDPNSREGMQLIYLPPSPLLAESTTPITDIRAFTATLSLFPYHKIVK,./data/raw/alphafold//AF-P47245-F1-model_v4.pdb,1860,1498,3070,1910
+1656,9976,10126,MKNKLPPFIEIYRALIATPSISATEEALDQSNADLITLLADWFKDLGFNVEVQPVPGTRNKFNMLASIGQGAGGLLLAGHTDTVPFDDGRWTRDPFTLTEHDGKLYGLGTADMKGFFAFILDALRDVDVTKLKKPLYILATADEETSMAGARYFAETTALRPDCAIIGEPTSLQPVRAHKGHISNAIRIQGQSGHSSDPARGVNAIELMHDAIGHILQLRDNLKERYHYEAFTVPYPTLNLGHIHGGDASNRICACCELHMDIRPLPGMTLNELNGLLNDALAPVSERWPGRLTVDELHPPIPGYECPPNHQLVEVVEKLLGAKTEVVNYCTEAPFIQTLCPTLVLGPGSINQAHQPDEYLETRFIKPTRELITQVIHHFCWH,sabio,P23908,CSCCC(NC(C)=O)C(=O)O.O>>CC(=O)O.CSCCC(N)C(=O)O,1700.0,0.0,25.0,7.0,3.5.1.16,562.0,3.230448921378274,CSCCC(NC(C)=O)C(=O)O.O,CC(=O)O.CSCCC(N)C(=O)O,3.230448921378274,CSCCC(NC(C)=O)C(=O)O.O__MKNKLPPFIEIYRALIATPSISATEEALDQSNADLITLLADWFKDLGFNVEVQPVPGTRNKFNMLASIGQGAGGLLLAGHTDTVPFDDGRWTRDPFTLTEHDGKLYGLGTADMKGFFAFILDALRDVDVTKLKKPLYILATADEETSMAGARYFAETTALRPDCAIIGEPTSLQPVRAHKGHISNAIRIQGQSGHSSDPARGVNAIELMHDAIGHILQLRDNLKERYHYEAFTVPYPTLNLGHIHGGDASNRICACCELHMDIRPLPGMTLNELNGLLNDALAPVSERWPGRLTVDELHPPIPGYECPPNHQLVEVVEKLLGAKTEVVNYCTEAPFIQTLCPTLVLGPGSINQAHQPDEYLETRFIKPTRELITQVIHHFCWH,./data/raw/alphafold//AF-P23908-F1-model_v4.pdb,1378,883,680,969
+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
+1658,22643,22982,MEQQKEITKGGFTLPGEAGFEKLTLELANRWGADVIRDSDGTELSDDILNAGYGIYSTICLIRDHNAWAKANIDKLQQTFLVTSPVVANSETLTIDLMEGFFKEQFLVNDSEEALEYWQVYDRTTETLLQKESWSYHPQNQTVVLTGICPWHKYTVSFMAYRIWEEISMYNHTTNNWNKEHLMQIDPIHKETQEYLLTWMDDWCKKHEQTTVVRFTSMFYNFVWMWGSNEKNRYLFSDWASYDFTVSPHALKLFEEEYGYVLTAEDFIHQGKFHVTHMPADKHKLDWMEFINNFVVDFGKKLIDIVHNYGKLAYVFYDDSWVGVEPYHKNFEKFGFDGLIKCVFSGFEVRLCAGVKVNTHELRLHPYLFPVGLGGAPTFMEGGNPTLDAKNYWISVRRALLREPIDRIGLGGYLHLVEDFPDFTDYIEKIANEFRRIKELHNAGKPMALKPRIAVLHSWGSLRSWTLSGHFHETYMHDLIHINESLSGLPFDVKFINFEDINQGALEEVDVVINAGIMGSAWTGGQAWEDQEIIERLTRFVYEGKAFIGVNEPSALTGYDTLYRMAHVLGVDMDLGDRVSHGRYSFTEEPVEELEFAECGPKAKRNIYLTDGLAKVLKEENGIPVMTSYEFGRGRGIYLASYEHSIKNARTLLNIILYAAGESFHQEGITNNVYTECAYYEKDKILVMINNSNTLQESSVTIKGRTYTKDIPAFDTVILPLE,brenda,A9KHK4,O=P(O)(O)O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O>>O=P(O)(O)O.OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](CO)OC(O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O,85.0,0.0,30.0,6.5,2.4.1.247,66219.0,1.9294189257142929,O=P(O)(O)O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,O=P(O)(O)O.OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](CO)OC(O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O,1.9294189257142929,O=P(O)(O)O[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O__MEQQKEITKGGFTLPGEAGFEKLTLELANRWGADVIRDSDGTELSDDILNAGYGIYSTICLIRDHNAWAKANIDKLQQTFLVTSPVVANSETLTIDLMEGFFKEQFLVNDSEEALEYWQVYDRTTETLLQKESWSYHPQNQTVVLTGICPWHKYTVSFMAYRIWEEISMYNHTTNNWNKEHLMQIDPIHKETQEYLLTWMDDWCKKHEQTTVVRFTSMFYNFVWMWGSNEKNRYLFSDWASYDFTVSPHALKLFEEEYGYVLTAEDFIHQGKFHVTHMPADKHKLDWMEFINNFVVDFGKKLIDIVHNYGKLAYVFYDDSWVGVEPYHKNFEKFGFDGLIKCVFSGFEVRLCAGVKVNTHELRLHPYLFPVGLGGAPTFMEGGNPTLDAKNYWISVRRALLREPIDRIGLGGYLHLVEDFPDFTDYIEKIANEFRRIKELHNAGKPMALKPRIAVLHSWGSLRSWTLSGHFHETYMHDLIHINESLSGLPFDVKFINFEDINQGALEEVDVVINAGIMGSAWTGGQAWEDQEIIERLTRFVYEGKAFIGVNEPSALTGYDTLYRMAHVLGVDMDLGDRVSHGRYSFTEEPVEELEFAECGPKAKRNIYLTDGLAKVLKEENGIPVMTSYEFGRGRGIYLASYEHSIKNARTLLNIILYAAGESFHQEGITNNVYTECAYYEKDKILVMINNSNTLQESSVTIKGRTYTKDIPAFDTVILPLE,./data/raw/alphafold//AF-A9KHK4-F1-model_v4.pdb,3687,3688,1486,3452
+1659,16275,16502,MAATTTTSSSSRIAYSRHNIPGLHSDSLNPKSISFSSNLHTFSLKSSGSRRQLYSRRTGAVVIMQSMDKVEVDISLSPRVNSVKPSKTVAITDQATALVQAGVPVIRLAAGEPDFDTPAPIVEAGINAIREGHTRYTPNAGTMELRSAISHKLKEENGLSYTPDQILVSNGAKQSIIQAVLAVCSPGDEVLIPAPYWVSYPEMARLADATPVILPTSISEDFLLDPKLLESKLTEKSRLLILCSPSNPTGSVYPRKLLEQIAEIVARHPRLLVISDEIYEHIIYAPATHTSFASLPGMWDRTLTVNGFSKAFAMTGWRLGYIAGPKHFIAACNKIQSQFTSGASSISQKAAVAALGLGYAGGELVATMVKSFRERRDYLVKSFGEIEGVKISEPRGAFYLFIDLSSYYGVEVDGFGSINNSESLCRYLLDKAQVALVPGDAFGDDTCIRISYAASLSTLQAAVERIKKALVTIKPPVPV,sabio,E9L7A5,NC(CC1(C(=O)O)C=CC(O)C=C1)C(=O)O.O=C(O)CCC(=O)C(=O)O>>NC(CCC(=O)O)C(=O)O.O=C(O)C(=O)CC1(C(=O)O)C=CC(O)C=C1,6.4,7.603168803309672e-15,37.0,8.0,2.6.1.1,4102.0,0.8061799739838872,NC(CC1(C(=O)O)C=CC(O)C=C1)C(=O)O.O=C(O)CCC(=O)C(=O)O,NC(CCC(=O)O)C(=O)O.O=C(O)C(=O)CC1(C(=O)O)C=CC(O)C=C1,0.8061799739838872,NC(CC1(C(=O)O)C=CC(O)C=C1)C(=O)O.O=C(O)CCC(=O)C(=O)O__MAATTTTSSSSRIAYSRHNIPGLHSDSLNPKSISFSSNLHTFSLKSSGSRRQLYSRRTGAVVIMQSMDKVEVDISLSPRVNSVKPSKTVAITDQATALVQAGVPVIRLAAGEPDFDTPAPIVEAGINAIREGHTRYTPNAGTMELRSAISHKLKEENGLSYTPDQILVSNGAKQSIIQAVLAVCSPGDEVLIPAPYWVSYPEMARLADATPVILPTSISEDFLLDPKLLESKLTEKSRLLILCSPSNPTGSVYPRKLLEQIAEIVARHPRLLVISDEIYEHIIYAPATHTSFASLPGMWDRTLTVNGFSKAFAMTGWRLGYIAGPKHFIAACNKIQSQFTSGASSISQKAAVAALGLGYAGGELVATMVKSFRERRDYLVKSFGEIEGVKISEPRGAFYLFIDLSSYYGVEVDGFGSINNSESLCRYLLDKAQVALVPGDAFGDDTCIRISYAASLSTLQAAVERIKKALVTIKPPVPV,./data/raw/alphafold//AF-E9L7A5-F1-model_v4.pdb,1293,3838,2233,5115
+1660,17010,17240,MSNKCDVVVVGGGISGMAAAKLLHDSGLNVVVLEARDRVGGRTYTLRNQKVKYVDLGGSYVGPTQNRILRLAKELGLETYKVNEVERLIHHVKGKSYPFRGPFPPVWNPITYLDHNNFWRTMDDMGREIPSDAPWKAPLAEEWDNMTMKELLDKLCWTESAKQLATLFVNLCVTAETHEVSALWFLWYVKQCGGTTRIISTTNGGQERKFVGGSGQVSERIMDLLGDRVKLERPVIYIDQTRENVLVETLNHEMYEAKYVISAIPPTLGMKIHFNPPLPMMRNQMITRVPLGSVIKCIVYYKEPFWRKKDYCGTMIIDGEEAPVAYTLDDTKPEGNYAAIMGFILAHKARKLARLTKEERLKKLCELYAKVLGSLEALEPVHYEEKNWCEEQYSGGCYTTYFPPGILTQYGRVLRQPVDRIYFAGTETATHWSGYMEGAVEAGERAAREILHAMGKIPEDEIWQSEPESVDVPAQPITTTFLERHLPSVPGLLRLIGLTTIFSATALGFLAHKRGLLVRV,brenda,P27338,NCCc1ccccc1.O.O=O>>N.O=CCc1ccccc1.OO,3.82,0.0,25.0,7.5,1.4.3.4,9606.0,0.5820633629117087,NCCc1ccccc1.O.O=O,N.O=CCc1ccccc1.OO,0.5820633629117087,NCCc1ccccc1.O.O=O__MSNKCDVVVVGGGISGMAAAKLLHDSGLNVVVLEARDRVGGRTYTLRNQKVKYVDLGGSYVGPTQNRILRLAKELGLETYKVNEVERLIHHVKGKSYPFRGPFPPVWNPITYLDHNNFWRTMDDMGREIPSDAPWKAPLAEEWDNMTMKELLDKLCWTESAKQLATLFVNLCVTAETHEVSALWFLWYVKQCGGTTRIISTTNGGQERKFVGGSGQVSERIMDLLGDRVKLERPVIYIDQTRENVLVETLNHEMYEAKYVISAIPPTLGMKIHFNPPLPMMRNQMITRVPLGSVIKCIVYYKEPFWRKKDYCGTMIIDGEEAPVAYTLDDTKPEGNYAAIMGFILAHKARKLARLTKEERLKKLCELYAKVLGSLEALEPVHYEEKNWCEEQYSGGCYTTYFPPGILTQYGRVLRQPVDRIYFAGTETATHWSGYMEGAVEAGERAAREILHAMGKIPEDEIWQSEPESVDVPAQPITTTFLERHLPSVPGLLRLIGLTTIFSATALGFLAHKRGLLVRV,./data/raw/alphafold//AF-P27338-F1-model_v4.pdb,3455,2362,2533,5348
+1661,17870,18118,MRKITQAISAVCLLFALNSSAVALASSPSPLNPGTNVARLAEQAPIHWVSVAQIENSLAGRPPMAVGFDIDDTVLFSSPGFWRGKKTFSPESEDYLKNPVFWEKMNNGWDEFSIPKEVARQLIDMHVRRGDAIFFVTGRSPTKTETVSKTLADNFHIPATNMNPVIFAGDKPGQNTKSQWLQDKNIRIFYGDSDNDITAARDVGARGIRILRASNSTYKPLPQAGAFGEEVIVNSEY,sabio,P0AE22,Nc1ccn(C2OC(CO)C(OP(=O)(O)O)C2O)c(=O)n1.O>>Nc1ccn(C2OC(CO)C(O)C2O)c(=O)n1.O=P(O)(O)O,91.0,0.0,37.0,6.0,3.1.3.2,562.0,1.9590413923210936,Nc1ccn(C2OC(CO)C(OP(=O)(O)O)C2O)c(=O)n1.O,Nc1ccn(C2OC(CO)C(O)C2O)c(=O)n1.O=P(O)(O)O,1.9590413923210936,Nc1ccn(C2OC(CO)C(OP(=O)(O)O)C2O)c(=O)n1.O__MRKITQAISAVCLLFALNSSAVALASSPSPLNPGTNVARLAEQAPIHWVSVAQIENSLAGRPPMAVGFDIDDTVLFSSPGFWRGKKTFSPESEDYLKNPVFWEKMNNGWDEFSIPKEVARQLIDMHVRRGDAIFFVTGRSPTKTETVSKTLADNFHIPATNMNPVIFAGDKPGQNTKSQWLQDKNIRIFYGDSDNDITAARDVGARGIRILRASNSTYKPLPQAGAFGEEVIVNSEY,./data/raw/alphafold//AF-P0AE22-F1-model_v4.pdb,392,2964,5306,4775
+1662,341,355,IESQVATVWINRAELHNAFNTQVIEELNHCFTTLNANDDVRVVVLASRGKSFSAGADLNWMKQAGQASKVENEEDALKLAKMLQSLATLKQPTIARVHGIAFGGGMGLASACDICVASTDAKFATSEVRLGLAPSTISPYVIRAIGARQASRYFLTAERISAEQAKHIGLVHEVCQPEQLDATVLEIIDAILLGGPEAQAASKSLIRLVDHQEVTEDLLIQTAQHIAHVRQGDEAKNGLTAFLNKQSPAWIQAEQ,brenda,Q3HW12,C/C(=C\C(=O)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.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)=NCCSC(=O)C[C@@](C)(O)CC(=O)O,138.0,6.2316899055554544e-15,30.0,9.0,4.2.1.18,472.0,2.1398790864012365,C/C(=C\C(=O)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.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)=NCCSC(=O)C[C@@](C)(O)CC(=O)O,2.1398790864012365,C/C(=C\C(=O)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.O__IESQVATVWINRAELHNAFNTQVIEELNHCFTTLNANDDVRVVVLASRGKSFSAGADLNWMKQAGQASKVENEEDALKLAKMLQSLATLKQPTIARVHGIAFGGGMGLASACDICVASTDAKFATSEVRLGLAPSTISPYVIRAIGARQASRYFLTAERISAEQAKHIGLVHEVCQPEQLDATVLEIIDAILLGGPEAQAASKSLIRLVDHQEVTEDLLIQTAQHIAHVRQGDEAKNGLTAFLNKQSPAWIQAEQ,./data/raw/alphafold//AF-Q3HW12-F1-model_v4.pdb,1029,572,234,254
+1663,22815,23157,MTTIDTLATCTQQNRDAVYTLLRRYFTANRTLLLQSDLREGLLQTEQDCGQSDMLRAFVFRLQEGIFSSPWAYLALRPEIAKWEFMRIHQEHLIPEKVTISEFLKFKETVVKGEATESVLEVDFGPFNRGFPRLKESRSIGQGVIFLNRKLSSEMFSRIEAGHTSLLHFLGVHAIEGQQLMFSNNSHDIHAVRNQLRQALEMLETLDGTTPWIELAPKMNQLGFAPGWGHNANRVAETMNMLMDILEAPSPSALEEFLARIPMISRLLILSPHGYFGQDNVLGLPDTGGQVVYILDQVRALEKEMHDRLQLQGVQVEPKILIVTRLIPDAGDTTCNQRLEKVSGCTNTWILRVPFRKHNGEIIPHWISRFEIWPHLEIFAGDVEREALAELGGHPDLIIGNYSDGNLVATLLSRRLGVTQCNIAHALEKTKYLHSDIYWQENEDKYHFSCQYTADLLAMNSADFIVTSTYQEIAGTREAEGQYESYQAFSMPDLYRVIHGIDLFDPKFNIVSPGANADIYFPYSDPNRRLHSLIPEIESLIFDDTTSLPARGYLQDPDKPLIFTMRAPGSDQNITGLVELYAASPRLRSLANLVIVGGKIDPQHSSDHEEQEQIHRMHQLMDEHELDQQVRWLGMRLDKNLAGELYRYIADKRGIFVQPALFEAFGLTIIEAMASGLPTFATRYGGPLEIIQNNRSGFHIDPNQGAATADLIADFFEKNLENPQEWERISQGALDRVASRYTWKLYAERMMTLSRIYGFWKFVSGLEREETDRYLNMFYHLQFRPLANRLAHEI,uniprot_search,A0A837WWY2,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.OC[C@H]1OC(O)(CO)[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.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,6.7,1.5219977257304432e-14,37.0,8.0,2.4.1.13,915.0,0.8260748027008264,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.OC[C@H]1OC(O)(CO)[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.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,0.8260748027008264,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.OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O__MTTIDTLATCTQQNRDAVYTLLRRYFTANRTLLLQSDLREGLLQTEQDCGQSDMLRAFVFRLQEGIFSSPWAYLALRPEIAKWEFMRIHQEHLIPEKVTISEFLKFKETVVKGEATESVLEVDFGPFNRGFPRLKESRSIGQGVIFLNRKLSSEMFSRIEAGHTSLLHFLGVHAIEGQQLMFSNNSHDIHAVRNQLRQALEMLETLDGTTPWIELAPKMNQLGFAPGWGHNANRVAETMNMLMDILEAPSPSALEEFLARIPMISRLLILSPHGYFGQDNVLGLPDTGGQVVYILDQVRALEKEMHDRLQLQGVQVEPKILIVTRLIPDAGDTTCNQRLEKVSGCTNTWILRVPFRKHNGEIIPHWISRFEIWPHLEIFAGDVEREALAELGGHPDLIIGNYSDGNLVATLLSRRLGVTQCNIAHALEKTKYLHSDIYWQENEDKYHFSCQYTADLLAMNSADFIVTSTYQEIAGTREAEGQYESYQAFSMPDLYRVIHGIDLFDPKFNIVSPGANADIYFPYSDPNRRLHSLIPEIESLIFDDTTSLPARGYLQDPDKPLIFTMRAPGSDQNITGLVELYAASPRLRSLANLVIVGGKIDPQHSSDHEEQEQIHRMHQLMDEHELDQQVRWLGMRLDKNLAGELYRYIADKRGIFVQPALFEAFGLTIIEAMASGLPTFATRYGGPLEIIQNNRSGFHIDPNQGAATADLIADFFEKNLENPQEWERISQGALDRVASRYTWKLYAERMMTLSRIYGFWKFVSGLEREETDRYLNMFYHLQFRPLANRLAHEI,./data/raw/alphafold//AF-A0A837WWY2-F1-model_v4.pdb,98,4235,4111,3961
+1664,10561,10716,MSIDTARSGSDDDVEIREIQAAAAPTRFARGWHCLGLLRDFQDGKPHSIEAFGTKLVVFADSKGQLNVLDAYCRHMGGDLSRGEVKGDSIACPFHDWRWNGKGKCTDIPYARRVPPIAKTRAWTTLERNGQLYVWNDPQGNPPPEDVTIPEIAGYGTDEWTDWSWKSLRIKGSHCREIVDNVVDMAHFFYIHYSFPRYFKNVFEGHTATQYMHSTGREDVISGTNYDDPNAELRSEATYFGPSYMIDWLESDANGQTIETILINCHYPVSNNEFVLQYGAIVKKLPGVSDEIAAGMAEQFAEGVQLGFEQDVEIWKNKAPIDNPLLSEEDGPVYQLRRWYQQFYVDVEDITEDMTKRFEFEIDTTRAVASWQKEVAENLAKQAEGSTATP,brenda,F1CMY8,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.O=O.[H+]>>C[C@H](C(=O)O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@]3(O)CC[C@]12C.O,0.6,0.1331554404829577,22.0,7.0,1.14.15.30,1829.0,-0.2218487496163563,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.O=O.[H+],C[C@H](C(=O)O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@]3(O)CC[C@]12C.O,-0.2218487496163563,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.O=O.[H+]__MSIDTARSGSDDDVEIREIQAAAAPTRFARGWHCLGLLRDFQDGKPHSIEAFGTKLVVFADSKGQLNVLDAYCRHMGGDLSRGEVKGDSIACPFHDWRWNGKGKCTDIPYARRVPPIAKTRAWTTLERNGQLYVWNDPQGNPPPEDVTIPEIAGYGTDEWTDWSWKSLRIKGSHCREIVDNVVDMAHFFYIHYSFPRYFKNVFEGHTATQYMHSTGREDVISGTNYDDPNAELRSEATYFGPSYMIDWLESDANGQTIETILINCHYPVSNNEFVLQYGAIVKKLPGVSDEIAAGMAEQFAEGVQLGFEQDVEIWKNKAPIDNPLLSEEDGPVYQLRRWYQQFYVDVEDITEDMTKRFEFEIDTTRAVASWQKEVAENLAKQAEGSTATP,./data/raw/alphafold//AF-F1CMY8-F1-model_v4.pdb,3815,3934,1510,3476
+1665,3275,3321,MDPKHQRVTLNDGHSIPVLGFGTYAPDEVPKSEAGEAAKIAIDVGFRHIDTAHAYQNEEEVGLAIRSKIADGTVKREDVFCTTKLWCTFFRPELVRKGLEQSLRKLQLDYVDLYLMHYPIAMKPGEEMFPTDEHGKTISDTVDICATWEAMEKCKDAGLAKSIGVSNFNHKQLEKILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAYSALGSSRDPKWVDQSSPVLLEDPVIGALAKKHKQSPALIALRYQLQRGVVVLAKSFIEREIKENIKVFGFQLSSEDMKALDGLNQNLRYCPAHFYIGHPHYPFSDEY,brenda,J7M9D0,CC(C)=CCC/C(C)=C/CC/C(C)=C\CO.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>>CC(C)=CCC/C(C)=C/CC/C(C)=C/C=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+],0.0055,6.4062637478229705e-15,25.0,7.4,1.1.1.239,9986.0,-2.2596373105057563,CC(C)=CCC/C(C)=C/CC/C(C)=C\CO.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,CC(C)=CCC/C(C)=C/CC/C(C)=C/C=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+],-2.2596373105057563,CC(C)=CCC/C(C)=C/CC/C(C)=C\CO.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__MDPKHQRVTLNDGHSIPVLGFGTYAPDEVPKSEAGEAAKIAIDVGFRHIDTAHAYQNEEEVGLAIRSKIADGTVKREDVFCTTKLWCTFFRPELVRKGLEQSLRKLQLDYVDLYLMHYPIAMKPGEEMFPTDEHGKTISDTVDICATWEAMEKCKDAGLAKSIGVSNFNHKQLEKILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAYSALGSSRDPKWVDQSSPVLLEDPVIGALAKKHKQSPALIALRYQLQRGVVVLAKSFIEREIKENIKVFGFQLSSEDMKALDGLNQNLRYCPAHFYIGHPHYPFSDEY,./data/raw/esmfold//ESMFold-J7M9D0-v1.pdb,1329,1150,6188,842
+1666,21907,22236,GSHMPTRKKFVAGNWKMNTTLAEAKALGAAVAKGVTDDRVTVAVFPPYPWLTAVGEVLKGSPVALGAQDVSSEKKGAFTGEVSPAMLLETGCKYALIGHSERRHIIGESETFINHKVHTALEEGLSVVLCMGETLAERERGLQERVFQRQVYAACAGLTDEQFGRIVIAYEPVWAIGTGKVATPEQAQEAHAFVRSKLRLLYGDKIADSTPIVYGGSVTPDNTVGLMSQPDVDGALVGGASLKADSFLAIVKAAG,sabio,A0A0M3KL18,O=CC(O)COP(=O)(O)O>>O=C(CO)COP(=O)(O)O,1306.0,0.0,25.0,8.0,5.3.1.1,114.0,3.115943176939055,O=CC(O)COP(=O)(O)O,O=C(CO)COP(=O)(O)O,3.115943176939055,O=CC(O)COP(=O)(O)O__GSHMPTRKKFVAGNWKMNTTLAEAKALGAAVAKGVTDDRVTVAVFPPYPWLTAVGEVLKGSPVALGAQDVSSEKKGAFTGEVSPAMLLETGCKYALIGHSERRHIIGESETFINHKVHTALEEGLSVVLCMGETLAERERGLQERVFQRQVYAACAGLTDEQFGRIVIAYEPVWAIGTGKVATPEQAQEAHAFVRSKLRLLYGDKIADSTPIVYGGSVTPDNTVGLMSQPDVDGALVGGASLKADSFLAIVKAAG,./data/raw/alphafold//AF-A0A0M3KL18-F1-model_v4.pdb,728,133,5863,6773
+1667,16458,16686,MEPVSSWGNTSLVSVDPEIHDLIEKEKRRQCRGIELIASENFTSFAVIEALGSALTNKYSEGIPGNRYYGGNEFIDEIENLCRSRALEAFHCDPAAWGVNVQPYSGSPANFAAYTALLQPHDRIMGLDLPSGGHLTHGYYTSGGKKISATSIYFESLPYKVNFTTGYIDYDKLEEKALDFRPKLLICGGSAYPRDWDYARFRAIADKVGALLLCDMAHISGLVAAQEAANPFEYCDVVTTTTHKSLRGPRAGMIFYRKGPKPPKKGQPEGAVYDFEDKINFAVFPALQGGPHNHQIGALAVALKQANTPGFKVYAKQVKANAVALGNYLMSKGYQIVTNGTENHLVLWDLRPLGLTGNKVEKLCDLCSITLNKNAVFGDSSALAPGGVRIGAPAMTSRGLVEKDFEQIGEFLSRAVTLTLDIQKTYGKLLKDFNKGLVNNKDLDQLKADVEKFSASYEMPGFLMSEMKYKD,sabio,O23254,NC(CO)C(=O)O.Nc1nc2c(c(=O)[nH]1)NC(CNc1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1)CN2>>NCC(=O)O.Nc1nc2c(c(=O)[nH]1)N1CN(c3ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc3)CC1CN2.O,16.2,0.0,30.0,,2.1.2.1,3702.0,1.209515014542631,NC(CO)C(=O)O.Nc1nc2c(c(=O)[nH]1)NC(CNc1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1)CN2,NCC(=O)O.Nc1nc2c(c(=O)[nH]1)N1CN(c3ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc3)CC1CN2.O,1.292256071356476,NC(CO)C(=O)O.Nc1nc2c(c(=O)[nH]1)NC(CNc1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1)CN2__MEPVSSWGNTSLVSVDPEIHDLIEKEKRRQCRGIELIASENFTSFAVIEALGSALTNKYSEGIPGNRYYGGNEFIDEIENLCRSRALEAFHCDPAAWGVNVQPYSGSPANFAAYTALLQPHDRIMGLDLPSGGHLTHGYYTSGGKKISATSIYFESLPYKVNFTTGYIDYDKLEEKALDFRPKLLICGGSAYPRDWDYARFRAIADKVGALLLCDMAHISGLVAAQEAANPFEYCDVVTTTTHKSLRGPRAGMIFYRKGPKPPKKGQPEGAVYDFEDKINFAVFPALQGGPHNHQIGALAVALKQANTPGFKVYAKQVKANAVALGNYLMSKGYQIVTNGTENHLVLWDLRPLGLTGNKVEKLCDLCSITLNKNAVFGDSSALAPGGVRIGAPAMTSRGLVEKDFEQIGEFLSRAVTLTLDIQKTYGKLLKDFNKGLVNNKDLDQLKADVEKFSASYEMPGFLMSEMKYKD,./data/raw/alphafold//AF-O23254-F1-model_v4.pdb,2621,4869,2327,5222
+1668,22884,23226,MSTAIVTNVKHFGGMGSALRLSEAGHTVACHDESFKQKDELEAFAETYPQLKPMSEQEPAELIEAVTSAYGQVDVLVSNDIFAPEFQPIDKYAVEDYRGAVEALQIRPFALVNAVASQMKKRKSGHIIFITSATPFGPWKELSTYTSARAGACTLANALSKELGEYNIPVFAIGPNYLHSEDSPYFYPTEPWKTNPEHVAHVKKVTALQRLGTQKELGELVAFLASGSCDYLTGQVFWLAGGFPMIERWPGMPE,sabio,Q93D82,OCC(Br)CBr>>Br.BrCC1CO1,15.5,0.0,30.0,7.5,3.8.1.-,358.0,1.1903316981702914,OCC(Br)CBr,Br.BrCC1CO1,1.1903316981702914,OCC(Br)CBr__MSTAIVTNVKHFGGMGSALRLSEAGHTVACHDESFKQKDELEAFAETYPQLKPMSEQEPAELIEAVTSAYGQVDVLVSNDIFAPEFQPIDKYAVEDYRGAVEALQIRPFALVNAVASQMKKRKSGHIIFITSATPFGPWKELSTYTSARAGACTLANALSKELGEYNIPVFAIGPNYLHSEDSPYFYPTEPWKTNPEHVAHVKKVTALQRLGTQKELGELVAFLASGSCDYLTGQVFWLAGGFPMIERWPGMPE,./data/raw/alphafold//AF-Q93D82-F1-model_v4.pdb,825,272,6023,6952
+1669,14307,14505,MVEHTVGIYGLGRFGSFWAKSLAASGLKVIGYNRSKRALPEGVVSGSETEVLSCNTLFYCVAISSFEEVLSRTAAKIGKHTLVFDTCSVKVEPVRTMERLLPQGCTFAGSHPMFGPDSASEGMDGLPMVLCPGRDDEGKVDFWRHHFSKMGLRVIEITADRHDKEAAYTQGITHVVGRILGELDLHESEIATSGYKRLLQVREQTCNDPLQLFIDLQRYNPYTHGMRMELTSALEQIMTLFAQADLPPDRP,brenda,E1R5M5,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.N[C@@H](CC1(C(=O)O)C=CC(O)C=C1)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.N[C@@H](Cc1ccc(O)cc1)C(=O)O.O=C=O.[H+],3.44,5.847288268252183e-15,,,1.3.1.79,55206.0,0.5365584425715301,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.N[C@@H](CC1(C(=O)O)C=CC(O)C=C1)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.N[C@@H](Cc1ccc(O)cc1)C(=O)O.O=C=O.[H+],0.5365584425715301,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.N[C@@H](CC1(C(=O)O)C=CC(O)C=C1)C(=O)O__MVEHTVGIYGLGRFGSFWAKSLAASGLKVIGYNRSKRALPEGVVSGSETEVLSCNTLFYCVAISSFEEVLSRTAAKIGKHTLVFDTCSVKVEPVRTMERLLPQGCTFAGSHPMFGPDSASEGMDGLPMVLCPGRDDEGKVDFWRHHFSKMGLRVIEITADRHDKEAAYTQGITHVVGRILGELDLHESEIATSGYKRLLQVREQTCNDPLQLFIDLQRYNPYTHGMRMELTSALEQIMTLFAQADLPPDRP,./data/raw/alphafold//AF-E1R5M5-F1-model_v4.pdb,2367,4739,4788,4628
+1670,8236,8364,MAPEPAPGRRMVPLVPALVMLGLMAGAHGDSKPVFVKVPEDQIGLSGGVASFVCQATGEPKPRITWMKKGKKVSSQRFEVIEFDDGAGSVLRIQPLRVQRDEAIYECTATNSLGEINTSAKLSVLEEDQLPSGFPTIDMGPQLKVVEKARTATMLCAAGGNPDPEISWFKDFLPVDPASSNGRIKQLRSGALQIESSEESDQGKYECVATNSAGTRYSAPANLYVRVRRVAPRFSIPPSSQEVMPGGNVNLTCVAVGAPMPYVKWMMGAEELTKEDEMPVGRNVLELSNVMRSANYTCVAISSLGMIEATAQVTVKALPKPPIDLVVTETTATSVTLTWDSGNTEPVSFYGIQYRAAGTDGPFQEVDGVASTRYSIGGLSPFSEYAFRVLAVNSIGRGPPSEAVRARTGEQAPSSPPRRVQARMLSASTMLVQWEPPEEPNGLVRGYRVYYTPDSRRPLSAWHKHNTDAGLLTTVGSLLPGITYSLRVLAFTAVGDGPPSPTIQVKTQQGVPAQPADFQAKAESDTRIQLSWLLPPQERIIKYELVYWAAEDEGQQHKVTFDPTSSYTLEDLKPDTLYHFQLAARSDLGVGVFTPTVEACTAQSTPSAPPQKVTCVSTGSTTVRVSWVPPPADSRNGIITQYSVAYEAVDGEDRKRHVVDGISREHSSWDLLGLEKWTEYRVWVRAHTDVGPGPESSPVLVRTDEDVPSGPPRKVEVEPLNSTAVHVSWKLPVPNKQHGQIRGYQVTYVRLENGEPRGQPIIQDVMLAEAQETTISGLTPETTYSITVAAYTTKGDGARSKPKVVTTTGAVPGRPTMMVSTTAMHTALLQWHPPKELPGELLGYRLQYRRADEARPNTIDFGKDDQHFTVTGLHKGATYIFRLAAKNRAGPGEEFEKEITTPEDAPSGFPQNLRVTGLTTSTTELAWDPPVLAERNGRITNYTVVYRDINSQHELQNVTGDVHLTLLGLKPDTTYDIKVRAHTSKGAGPLSPSIQSRTMPMEQVFAKNFRVAAAMKTSVLLSWEVPDSYKSAVPFKILYNGQSVEVDGHSMRKLIADLQPNTEYSFVLMNRGTSAGGLQHLVSIRTAPDLLPQKPLPASAFIEDGRFSLSMPQVQDPSLVRWFYIVVVPIDRVGGNLLAPRWSTPEELELDELLEAIEQGEEKQRRRRRQAERLKPYVAAQVDELPETFTLGDKKNYRGFYNRPLSPDLSYQCFVLASLKEPMDQKRYASSPYSDEIVVQVTPAQQQEEPEMLWVTGPVLAVILIILIVIAILLFKRKRTHSPSSKDEQSIGLKDSLLAHSSDPVEMRRLNYQTPGMRDHPPIPITDLADNIERLKANDGLKFSQEYESIDPGQQFTWENSNSEVNKPKNRYANVIAYDHSRVLLTSIDGVPGSDYINANYIDGYRKQNAYIATQGPLPETMGDFWRMVWEQRIATVVMMTRLEEKSRVKCDQYWPARGTETYGLIQVTLVDTVELATYTMRTFALHKSGSSEKRELRQFQFMAWPDHGVPEYPTPILAFLRRVKACNPLDAGPMVVHCSAGVGRTGCFIVIDAMLERMKHEKTVDIYGHVTCMRSQRNYMVQTEDQYVFIHEALLEAAMCGHTEVLARNLYAHIQKLGQVPPGESVTAMELEFKLLAGSKARASRFISANLPCNKFKNRLVNIMPYELTRVCLQPIRGVEGSDYINASFLDGYRQQKAYIATQGPLAESTEDFWRMLWEHNSTIIVMLTKLREMGREKCHQYWPAERSARYQYFVVDPMAEYNMPQYILREFKVTDARDGQSRTIRQFQFTDWPEQGVPKTGEGFIDFIGQVHKTKEQFGQDGPITVHCSAGVGRTGVFITLSIVLERMRYEGVVDMFQTVKTLRTQRPAMVQTEDQYQLCYRAALEYLGSFDHYAT,brenda,Q64604,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccc(OP(=O)(O)O)cc1)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.O>>CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)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.O=P(O)(O)O,3.1,0.0,22.0,9.0,3.1.3.48,10116.0,0.4913616938342727,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccc(OP(=O)(O)O)cc1)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.O,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)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.O=P(O)(O)O,0.4913616938342727,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1ccc(OP(=O)(O)O)cc1)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.O__MAPEPAPGRRMVPLVPALVMLGLMAGAHGDSKPVFVKVPEDQIGLSGGVASFVCQATGEPKPRITWMKKGKKVSSQRFEVIEFDDGAGSVLRIQPLRVQRDEAIYECTATNSLGEINTSAKLSVLEEDQLPSGFPTIDMGPQLKVVEKARTATMLCAAGGNPDPEISWFKDFLPVDPASSNGRIKQLRSGALQIESSEESDQGKYECVATNSAGTRYSAPANLYVRVRRVAPRFSIPPSSQEVMPGGNVNLTCVAVGAPMPYVKWMMGAEELTKEDEMPVGRNVLELSNVMRSANYTCVAISSLGMIEATAQVTVKALPKPPIDLVVTETTATSVTLTWDSGNTEPVSFYGIQYRAAGTDGPFQEVDGVASTRYSIGGLSPFSEYAFRVLAVNSIGRGPPSEAVRARTGEQAPSSPPRRVQARMLSASTMLVQWEPPEEPNGLVRGYRVYYTPDSRRPLSAWHKHNTDAGLLTTVGSLLPGITYSLRVLAFTAVGDGPPSPTIQVKTQQGVPAQPADFQAKAESDTRIQLSWLLPPQERIIKYELVYWAAEDEGQQHKVTFDPTSSYTLEDLKPDTLYHFQLAARSDLGVGVFTPTVEACTAQSTPSAPPQKVTCVSTGSTTVRVSWVPPPADSRNGIITQYSVAYEAVDGEDRKRHVVDGISREHSSWDLLGLEKWTEYRVWVRAHTDVGPGPESSPVLVRTDEDVPSGPPRKVEVEPLNSTAVHVSWKLPVPNKQHGQIRGYQVTYVRLENGEPRGQPIIQDVMLAEAQETTISGLTPETTYSITVAAYTTKGDGARSKPKVVTTTGAVPGRPTMMVSTTAMHTALLQWHPPKELPGELLGYRLQYRRADEARPNTIDFGKDDQHFTVTGLHKGATYIFRLAAKNRAGPGEEFEKEITTPEDAPSGFPQNLRVTGLTTSTTELAWDPPVLAERNGRITNYTVVYRDINSQHELQNVTGDVHLTLLGLKPDTTYDIKVRAHTSKGAGPLSPSIQSRTMPMEQVFAKNFRVAAAMKTSVLLSWEVPDSYKSAVPFKILYNGQSVEVDGHSMRKLIADLQPNTEYSFVLMNRGTSAGGLQHLVSIRTAPDLLPQKPLPASAFIEDGRFSLSMPQVQDPSLVRWFYIVVVPIDRVGGNLLAPRWSTPEELELDELLEAIEQGEEKQRRRRRQAERLKPYVAAQVDELPETFTLGDKKNYRGFYNRPLSPDLSYQCFVLASLKEPMDQKRYASSPYSDEIVVQVTPAQQQEEPEMLWVTGPVLAVILIILIVIAILLFKRKRTHSPSSKDEQSIGLKDSLLAHSSDPVEMRRLNYQTPGMRDHPPIPITDLADNIERLKANDGLKFSQEYESIDPGQQFTWENSNSEVNKPKNRYANVIAYDHSRVLLTSIDGVPGSDYINANYIDGYRKQNAYIATQGPLPETMGDFWRMVWEQRIATVVMMTRLEEKSRVKCDQYWPARGTETYGLIQVTLVDTVELATYTMRTFALHKSGSSEKRELRQFQFMAWPDHGVPEYPTPILAFLRRVKACNPLDAGPMVVHCSAGVGRTGCFIVIDAMLERMKHEKTVDIYGHVTCMRSQRNYMVQTEDQYVFIHEALLEAAMCGHTEVLARNLYAHIQKLGQVPPGESVTAMELEFKLLAGSKARASRFISANLPCNKFKNRLVNIMPYELTRVCLQPIRGVEGSDYINASFLDGYRQQKAYIATQGPLAESTEDFWRMLWEHNSTIIVMLTKLREMGREKCHQYWPAERSARYQYFVVDPMAEYNMPQYILREFKVTDARDGQSRTIRQFQFTDWPEQGVPKTGEGFIDFIGQVHKTKEQFGQDGPITVHCSAGVGRTGVFITLSIVLERMRYEGVVDMFQTVKTLRTQRPAMVQTEDQYQLCYRAALEYLGSFDHYAT,./data/raw/alphafold//AF-Q64604-F1-model_v4.pdb,411,2983,3958,2838
+1671,22712,23052,MSNYHVAVLAFPFATHAGLLLGLVQRLANALPNVTFTFFNTSKSNSSLFTTPHDNNIKPFNISDGVPEGYVVGKGGIEALIGLFFKSAKENIQNAMAAAVEESGKKITCVMADAFMWFSGEIAEELSVGWIPLWTSAAGSLSVHVYTDLIRENVEAQGIAGREDEILTFIPGFAELRLGSLPSGVVSGDLESPFSVMLHKMGKTIGKATALPVNSFEELDPPIVEDLKSKFNNFLNVGPFNLTTPPPSANITDEYGCIAWLDKQEPGSVAYIGFGTVATPPPNELKAMAEALEESKTPFLWSLKDLFKSFFPEGFLERTSEYGKIVSWAPQVQVLSHGSVGVFINHCGWNSVLESIAAGVPVICRPFFGDHQLNAWMVEKVWKIGVKIEGGVFTKDGTMLALDLVLSKDKRNTELKQQIGMYKELALNAVGPSGSSAENFKKLVDIITSCN,brenda,Q9SBQ8,O=c1c(O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12.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>>O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,57.4,0.0,43.0,7.5,2.4.1.234,4102.0,1.7589118923979736,O=c1c(O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12.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,O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,1.7867514221455612,O=c1c(O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12.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__MSNYHVAVLAFPFATHAGLLLGLVQRLANALPNVTFTFFNTSKSNSSLFTTPHDNNIKPFNISDGVPEGYVVGKGGIEALIGLFFKSAKENIQNAMAAAVEESGKKITCVMADAFMWFSGEIAEELSVGWIPLWTSAAGSLSVHVYTDLIRENVEAQGIAGREDEILTFIPGFAELRLGSLPSGVVSGDLESPFSVMLHKMGKTIGKATALPVNSFEELDPPIVEDLKSKFNNFLNVGPFNLTTPPPSANITDEYGCIAWLDKQEPGSVAYIGFGTVATPPPNELKAMAEALEESKTPFLWSLKDLFKSFFPEGFLERTSEYGKIVSWAPQVQVLSHGSVGVFINHCGWNSVLESIAAGVPVICRPFFGDHQLNAWMVEKVWKIGVKIEGGVFTKDGTMLALDLVLSKDKRNTELKQQIGMYKELALNAVGPSGSSAENFKKLVDIITSCN,./data/raw/alphafold//AF-Q9SBQ8-F1-model_v4.pdb,626,276,6028,6957
+1672,233,245,MNNLAFLFPGQGSQFVGMGKSFWNDFVLAKRLFEEASDAISMDVKKLCFDGDMTELTRTMNAQPAILTVSVIAYQVYMQEIGIKPHFLAGHSLGEYSALVCAGVLSFQEAVKLIRQRGILMQNADPEQLGTMAAITQVYIQPLQDLCTEISTEDFPVGVACMNSDQQHVISGHRQAVEFVIKKAERMGANHTYLNVSAPFHSSMMRSASEQFQTALNQYSFRDAEWPIISNVTAIPYNNGHSVREHLQTHMTMPVRWAESMHYLLLHGVTEVIEMGPKNVLVGLLKKITNHIAAYPLGQTSDLHLLSDSAERNENIVNLRKKQLNKMMIQSIIARNYNKDAKTYSNLTTPLFPQIQLLKERVERKEVELSAEELEHSIHLCQLICEAKQLPTWEQLRILK,sabio,Q9R9J2,*S.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>>CC(=O)S.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,0.13,0.0597399179998461,,8.25,2.3.1.39,1423.0,-0.8860566476931633,*S.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,CC(=O)S.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,-0.8860566476931633,*S.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__MNNLAFLFPGQGSQFVGMGKSFWNDFVLAKRLFEEASDAISMDVKKLCFDGDMTELTRTMNAQPAILTVSVIAYQVYMQEIGIKPHFLAGHSLGEYSALVCAGVLSFQEAVKLIRQRGILMQNADPEQLGTMAAITQVYIQPLQDLCTEISTEDFPVGVACMNSDQQHVISGHRQAVEFVIKKAERMGANHTYLNVSAPFHSSMMRSASEQFQTALNQYSFRDAEWPIISNVTAIPYNNGHSVREHLQTHMTMPVRWAESMHYLLLHGVTEVIEMGPKNVLVGLLKKITNHIAAYPLGQTSDLHLLSDSAERNENIVNLRKKQLNKMMIQSIIARNYNKDAKTYSNLTTPLFPQIQLLKERVERKEVELSAEELEHSIHLCQLICEAKQLPTWEQLRILK,./data/raw/alphafold//AF-Q9R9J2-F1-model_v4.pdb,992,522,171,185
+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
+1675,11005,11160,MAAIRFLVLAFLFACGASEPINEKEGRIIGGTTTTITSYPYIASLHKGTEHICGATIINSEWLVTAASCISIPNAREYLVRVGSTYSSSGGNVYQVSKIYRHEFDLNTMDNDIALVRLSTGVIFGTNVQSITLQESDVSDGTSATVLGWGTISEGGAQSNILKQVVVPVVGFHSCNTSYATYGGITDNMLCAGYNEGGVDACQGDTGGPLVASGHLIGIVSWGAGCGHSTFPGVYTKVSAYRDWIKDKTGV,uniprot_search,A0A059WCN6,C[C@H](N=C(O)c1ccccc1N)C(O)=NCC(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](Cc1cnc[nH]1)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>C[C@H](N=C(O)c1ccccc1N)C(O)=NCC(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(=O)O.N=C(O)CC[C@H](N=C(O)CN=C(O)[C@H](Cc1cnc[nH]1)N=C(O)CN)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],0.00063,3.144635044241572e-14,30.0,8.5,3.4.21.4,6978.0,-3.2006594505464183,C[C@H](N=C(O)c1ccccc1N)C(O)=NCC(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](Cc1cnc[nH]1)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,C[C@H](N=C(O)c1ccccc1N)C(O)=NCC(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(=O)O.N=C(O)CC[C@H](N=C(O)CN=C(O)[C@H](Cc1cnc[nH]1)N=C(O)CN)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],-3.2006594505464183,C[C@H](N=C(O)c1ccccc1N)C(O)=NCC(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(O)=NCC(O)=N[C@@H](Cc1cnc[nH]1)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MAAIRFLVLAFLFACGASEPINEKEGRIIGGTTTTITSYPYIASLHKGTEHICGATIINSEWLVTAASCISIPNAREYLVRVGSTYSSSGGNVYQVSKIYRHEFDLNTMDNDIALVRLSTGVIFGTNVQSITLQESDVSDGTSATVLGWGTISEGGAQSNILKQVVVPVVGFHSCNTSYATYGGITDNMLCAGYNEGGVDACQGDTGGPLVASGHLIGIVSWGAGCGHSTFPGVYTKVSAYRDWIKDKTGV,./data/raw/alphafold//AF-A0A059WCN6-F1-model_v4.pdb,1862,1558,3143,1914
+1676,20815,21126,MKSLVVVVLLLAVGLGAGQNNKGWWKNAVFYQIYPRSFMDSNNDGIGDLQGIKDKLSHFTESGITAIWLSPIYRSPMVDFGYDISDFKDIDPIFGTTEDLQDLTAEAKKRNLKVILDLVPNHTSDEHNWFQLSVNKTGKYKDYYVWVDPKNGTDPFEKRYPNNWLSVFNGTGWTFNEIRQQFYFHQFYKKQPDLNYRNPEVRKEMKSVMEFWLNNGIDGFRIDAIPHIYEVENISLNEPPIGQNLNLSLHASLNHIYTKDQPETYDLVREWRNFVDEYAKNNNRDEIVLLTEAYTSLNNTLRYYQYGANVPFNFKFITDANSSSTPEQFKTIIDNWVQGTPQNDVPNWVKGNHDRVRVSTRYPGRADHMIMLEMILPGVAVTYYGEEIGMEDNTTIYKYDVRDGCRTPFQWDNSINAGFSKVNESTLEKEWLPVHSSYKNGLNLEQEKKDNISHYHLYTNLTALRKRDVLKEGKLVTEILNKNVLAIVRQNEKEAVSLLINFSKNNTVVNISKLVDEGNNKIYTSSINSKLTANELVNPMAIDIPGDSSVIITSGATIVNYSIMTFLFVVFISFFQR,brenda,A1IHL0,O.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>>OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.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,15.0,2.1739398707267392e-14,37.0,5.0,3.2.1.20,292787.0,1.1760912590556811,O.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,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.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,1.1760912590556811,O.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,450,3119,5406,6287
+1677,21273,21597,MKQIHVIDSHTGGEPTRLVMKGFPQLHGRSMAEQRDELRELHDRWRRACLLEPRGNDVLVGALYCPPVSADATCGVIFFNNAGYLNMCGHGTIGLVASLQHLGLIAPGVHKIDTPVGQVSATLHEDGAITVANVPSYRYRQHVAVNVPGHGVVHGDIAWGGNWFFLVAEHGQRIELDNREVLTEYTWAMLKALEAQGITGENGAPIDHVELFADDPNADSRNFVMCPGKAYDRSPCGTGTSAKLACLAADGTLAEGQTWVQASITGSQFHGRYERDGERIRPFITGRAHMTADSTLLIDEQDPFAWGI,sabio,A5VZY6,O=C(O)C1CCCN1>>O=C(O)C1CCCN1,2.8,0.0,25.0,8.0,5.1.1.8,303.0,0.4471580313422192,O=C(O)C1CCCN1,O=C(O)C1CCCN1,0.4471580313422192,O=C(O)C1CCCN1__MKQIHVIDSHTGGEPTRLVMKGFPQLHGRSMAEQRDELRELHDRWRRACLLEPRGNDVLVGALYCPPVSADATCGVIFFNNAGYLNMCGHGTIGLVASLQHLGLIAPGVHKIDTPVGQVSATLHEDGAITVANVPSYRYRQHVAVNVPGHGVVHGDIAWGGNWFFLVAEHGQRIELDNREVLTEYTWAMLKALEAQGITGENGAPIDHVELFADDPNADSRNFVMCPGKAYDRSPCGTGTSAKLACLAADGTLAEGQTWVQASITGSQFHGRYERDGERIRPFITGRAHMTADSTLLIDEQDPFAWGI,./data/raw/alphafold//AF-A5VZY6-F1-model_v4.pdb,615,3348,5673,6567
+1678,675,694,MDMWTALLILQALLLPSLADGATPALRFVAVGDWGGVPNAPFHTAREMANAKEIARTVQILGADFILSLGDNFYFTGVQDINDKRFQETFEDVFSDRSLRKVPWYVLAGNHDHLGNVSAQIAYSKISKRWNFPSPFYRLHFKIPQTNVSVAIFMLDTVTLCGNSDDFLSQQPERPRDVKLARTQLSWLKKQLAAAREDYVLVAGHYPVWSIAEHGPTHCLVKQLRPLLATYGVTAYLCGHDHNLQYLQDENGVGYVLSGAGNFMDPSKRHQRKVPNGYLRFHYGTEDSLGGFAYVEISSKEMTVTYIEASGKSLFKTRLPRRARP,sabio,P13686,C=C(OP(=O)(O)O)C(=O)O.O>>CC(=O)C(=O)O.O=P(O)(O)O,2.0,0.0,25.0,5.7,3.1.3.2,9606.0,0.3010299956639812,C=C(OP(=O)(O)O)C(=O)O.O,CC(=O)C(=O)O.O=P(O)(O)O,0.3010299956639812,C=C(OP(=O)(O)O)C(=O)O.O__MDMWTALLILQALLLPSLADGATPALRFVAVGDWGGVPNAPFHTAREMANAKEIARTVQILGADFILSLGDNFYFTGVQDINDKRFQETFEDVFSDRSLRKVPWYVLAGNHDHLGNVSAQIAYSKISKRWNFPSPFYRLHFKIPQTNVSVAIFMLDTVTLCGNSDDFLSQQPERPRDVKLARTQLSWLKKQLAAAREDYVLVAGHYPVWSIAEHGPTHCLVKQLRPLLATYGVTAYLCGHDHNLQYLQDENGVGYVLSGAGNFMDPSKRHQRKVPNGYLRFHYGTEDSLGGFAYVEISSKEMTVTYIEASGKSLFKTRLPRRARP,./data/raw/alphafold//AF-P13686-F1-model_v4.pdb,1141,740,432,492
+1679,14294,14490,MSSRQPFVRLNDGHCIPALGFGTYKPIEVPKSKSLEAANLAIGVGYRHIDTAYAYQIEEEIGQAIQSNIKAGIVKREDMFITTKLWCTCFQPELVRPSLEKSLKKLQLEHVDLFIMHYPVPMKAGDNDFPLDEQGKLLLDTVDFCATWEALEKCKDAGLVKSIGVSNFNHRQLERILNKPGLKYKPVCNQVECHVYNNQSKLLDYCKSKDIVLVAFGALGTQRYKEWVDQDSPVLLNDPVLCGVAKKNKRSPALIALRYLVQRGVVPLAQSFYESEMKENLQVFEFQLSPEDMKILDGLNKNFRYLPAQFFADHPEYPFSEEY,brenda,A0A097ZMY7,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.O[C@H]1CCCc2ccccc21>>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.O=C1CCCc2ccccc21.[H+],0.105,0.0,25.0,7.4,1.1.1.239,10036.0,-0.978810700930062,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.O[C@H]1CCCc2ccccc21,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.O=C1CCCc2ccccc21.[H+],-0.978810700930062,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.O[C@H]1CCCc2ccccc21__MSSRQPFVRLNDGHCIPALGFGTYKPIEVPKSKSLEAANLAIGVGYRHIDTAYAYQIEEEIGQAIQSNIKAGIVKREDMFITTKLWCTCFQPELVRPSLEKSLKKLQLEHVDLFIMHYPVPMKAGDNDFPLDEQGKLLLDTVDFCATWEALEKCKDAGLVKSIGVSNFNHRQLERILNKPGLKYKPVCNQVECHVYNNQSKLLDYCKSKDIVLVAFGALGTQRYKEWVDQDSPVLLNDPVLCGVAKKNKRSPALIALRYLVQRGVVPLAQSFYESEMKENLQVFEFQLSPEDMKILDGLNKNFRYLPAQFFADHPEYPFSEEY,./data/raw/alphafold//AF-A0A097ZMY7-F1-model_v4.pdb,1329,1150,6276,1625
+1680,17792,18035,MSIPFTRWPEEFARRYREKGYWQDLPLTDILTRHAASDSIAVIDGERQLSYRELNQAADNLACSLRRQGIKPGETALVQLGNVAELYITFFALLKLGVAPVLALFSHQRSELNAYASQIEPALLIADRQHALFSGDDFLNTFVTEHSSIRVVQLLNDSGEHNLQDAINHPAEDFTATPSPADEVAYFQLSGGTTGTPKLIPRTHNDYYYSVRRSVEICQFTQQTRYLCAIPAAHNYAMSSPGSLGVFLAGGTVVLAADPSATLCFPLIEKHQVNVTALVPPAVSLWLQALIEGESRAQLASLKLLQVGGARLSATLAARIPAEIGCQLQQVFGMAEGLVNYTRLDDSAEKIIHTQGYPMCPDDEVWVADAEGNPLPQGEVGRLMTRGPYTFRGYYKSPQHNASAFDANGFYCSGDLISIDPEGYITVQGREKDQINRGGEKIAAEEIENLLLRHPAVIYAALVSMEDELMGEKSCAYLVVKEPLRAVQVRRFLREQGIAEFKLPDRVECVDSLPLTAVGKVDKKQLRQWLASRASA,brenda,P10378,Nc1ccc(C(=O)O)c(O)c1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=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=P(O)(O)OP(=O)(O)O,4.4,11.3881313020642,25.0,7.8,6.3.2.14,562.0,0.6434526764861874,Nc1ccc(C(=O)O)c(O)c1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=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=P(O)(O)OP(=O)(O)O,0.6434526764861874,Nc1ccc(C(=O)O)c(O)c1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MSIPFTRWPEEFARRYREKGYWQDLPLTDILTRHAASDSIAVIDGERQLSYRELNQAADNLACSLRRQGIKPGETALVQLGNVAELYITFFALLKLGVAPVLALFSHQRSELNAYASQIEPALLIADRQHALFSGDDFLNTFVTEHSSIRVVQLLNDSGEHNLQDAINHPAEDFTATPSPADEVAYFQLSGGTTGTPKLIPRTHNDYYYSVRRSVEICQFTQQTRYLCAIPAAHNYAMSSPGSLGVFLAGGTVVLAADPSATLCFPLIEKHQVNVTALVPPAVSLWLQALIEGESRAQLASLKLLQVGGARLSATLAARIPAEIGCQLQQVFGMAEGLVNYTRLDDSAEKIIHTQGYPMCPDDEVWVADAEGNPLPQGEVGRLMTRGPYTFRGYYKSPQHNASAFDANGFYCSGDLISIDPEGYITVQGREKDQINRGGEKIAAEEIENLLLRHPAVIYAALVSMEDELMGEKSCAYLVVKEPLRAVQVRRFLREQGIAEFKLPDRVECVDSLPLTAVGKVDKKQLRQWLASRASA,./data/raw/alphafold//AF-P10378-F1-model_v4.pdb,132,2623,2923,5771
+1681,13780,13960,MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,uniprot_search,P24155,N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)Cc1ccccc1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].Nc1ccccc1C(O)=NCC(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)O,4.0,1.854918431598548e-14,37.0,7.4,3.4.24.15,10116.0,0.6020599913279624,N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)Cc1ccccc1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].Nc1ccccc1C(O)=NCC(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)O,0.6020599913279624,N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,./data/raw/alphafold//AF-P24155-F1-model_v4.pdb,1820,1500,3134,1830
+1682,15241,15454,MVRPLNCIVAVSQNMGIGKNGDLPWPPLRNEFQYFQRMTTVSSVEGKQNLVIMGRKTWFSIPEKNRPLKDRINIVLSRELKEPPKGAHFLAKSLDDALELIEDPELTNKVDVVWIVGGSSVYKEAMNKPGHVRLFVTRIMQEFESDAFFPEIDFEKYKLLPEYPGVPLDVQEEKGIKYKFEVYEKNN,sabio,P00376,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.Nc1nc2ncc(CNc3ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1.[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.Nc1nc2c(c(=O)[nH]1)N=C(CNc1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1)CN2,0.15,0.0,,6.0,1.5.1.3,9913.0,-0.8239087409443188,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.Nc1nc2ncc(CNc3ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1.[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.Nc1nc2c(c(=O)[nH]1)N=C(CNc1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1)CN2,-0.8239087409443188,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.Nc1nc2ncc(CNc3ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1.[H]__MVRPLNCIVAVSQNMGIGKNGDLPWPPLRNEFQYFQRMTTVSSVEGKQNLVIMGRKTWFSIPEKNRPLKDRINIVLSRELKEPPKGAHFLAKSLDDALELIEDPELTNKVDVVWIVGGSSVYKEAMNKPGHVRLFVTRIMQEFESDAFFPEIDFEKYKLLPEYPGVPLDVQEEKGIKYKFEVYEKNN,./data/raw/alphafold//AF-P00376-F1-model_v4.pdb,3752,5017,2110,2302
+1683,18638,18911,MEPVIIGALILDVHAKPSTTPISGTTVPGQVLFAPGGVARNVADCIFKLGITPFMIGTLGLDGPANVLLKEWKLSMKGILRREDISTPIVSLVYDTNGEVAAGVAGVDAVENFLTPEWIQRFEYNISSARLLMVDANLSSLALEASCKLAAESSVPVWFEPVSVTKSQRIASIAKYVTIVSPNQDELIAMANALCAKNLFHPFRSDENKLSIEDMFRALKPAILVLLKNGVKVVIVTLGSNGALLCSKGNPKKALNIDRKFLRSGEVFKRVQSVCSPNRFSELGSNRSPSLFAMHFPTIPAKVKKLTGAGDCLVGGTVASLSDGLDLIQSLAVGIASAKAAVESDDNVPPEFKLDLISGDAELVYNGAKMLMVHQSML,uniprot_search,Q94AT3,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.OC[C@H]1O[C@@H](c2cnc(O)nc2O)[C@H](O)[C@@H]1O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OC[C@H]1O[C@@H](c2cnc(O)nc2O)[C@H](O)[C@@H]1O,0.23,7.560121409631531e-15,30.0,7.5,2.7.1.83,3702.0,-0.6382721639824072,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.OC[C@H]1O[C@@H](c2cnc(O)nc2O)[C@H](O)[C@@H]1O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OC[C@H]1O[C@@H](c2cnc(O)nc2O)[C@H](O)[C@@H]1O,-0.6382721639824072,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.OC[C@H]1O[C@@H](c2cnc(O)nc2O)[C@H](O)[C@@H]1O__MEPVIIGALILDVHAKPSTTPISGTTVPGQVLFAPGGVARNVADCIFKLGITPFMIGTLGLDGPANVLLKEWKLSMKGILRREDISTPIVSLVYDTNGEVAAGVAGVDAVENFLTPEWIQRFEYNISSARLLMVDANLSSLALEASCKLAAESSVPVWFEPVSVTKSQRIASIAKYVTIVSPNQDELIAMANALCAKNLFHPFRSDENKLSIEDMFRALKPAILVLLKNGVKVVIVTLGSNGALLCSKGNPKKALNIDRKFLRSGEVFKRVQSVCSPNRFSELGSNRSPSLFAMHFPTIPAKVKKLTGAGDCLVGGTVASLSDGLDLIQSLAVGIASAKAAVESDDNVPPEFKLDLISGDAELVYNGAKMLMVHQSML,./data/raw/alphafold//AF-Q94AT3-F1-model_v4.pdb,149,2646,2946,5794
+1684,16793,17023,HEVNIYVRPITGITIVTSDVTYLMKIVEYHDRDIEAVPTA,brenda,Q42432,NCCCCN.O.O=O>>N.NCCCC=O.OO,91.5,0.0,22.0,7.2,1.4.3.22,3888.0,1.9614210940664485,NCCCCN.O.O=O,N.NCCCC=O.OO,1.9614210940664485,NCCCCN.O.O=O__HEVNIYVRPITGITIVTSDVTYLMKIVEYHDRDIEAVPTA,./data/raw/alphafold//AF-Q42432-F1-model_v4.pdb,2711,3817,2400,5303
+1685,14378,14580,MAGEKSTIIYTLTDEAPLLATYSLLPIIETFTKPAGIEIVKSDISVAARVLAEFADYLSEEQKVSDNLAELGRLTQDPDTNIIKLPNISASVAQLTACIKELQSKGYAIPDYPENPATEEEKTIKARYGKCLGSAVNPVLREGNSDRRAPAAVKNYAKKHPHSMSEWKQWSQTHVSHMEEGDFYHGEKSMTLDRPRNVKMELITNSGKSIVLKPKVALQEGEIIDSMFMSKKALCDFYEKQLDDCREAGILFSLHVKATMMKVSHPIVFGHCVKIYYKEAFEKHGKLFDELGINVNNGMAGLYEKIETLPTSLREEIIEDLHACQEHRPALAMVDSAKGITNFHSPNDIIVDASMPAMIRAGGKMWGADGKQYDAKAVMPESTFARIYQEMINFCKWHGNFDPKTMGTVPNVGLMAQKAEEYGSHDKTFEIPEAGIANITDLDTGEVLLTQNVEEGDIWRMCQVKDAPIRDWVKLAVTRARNSGMPAIFWLDPYRPHENELIKKVQKYLKDHDTTGLDIQIMSQVRAMRYTLERVVRGLDTISVTGNILRDYLTDLFPIMELGTSAKMLSIVPLMAGGGMYETGAGGSAPKHVQQLVEENHLRWDSLGEFLALAVSLEEMGIKENNARAKLLAKTLDEATGKLLDNDKSPSRRTGELDNRGSHFYLSLYWAEALAAQNEDAELKAKFAPLAKALAENEQKIVAELAQVQGKPADIGGYYAVDPAKVSAVMRPSATFNAALSTVQA,brenda,V5VCI0,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)CC(C(=O)O)C(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.O=C(O)CCC(=O)C(=O)O.O=C=O.[H+],50.4,0.0,25.0,8.0,1.1.1.42,470.0,1.7024305364455252,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)CC(C(=O)O)C(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.O=C(O)CCC(=O)C(=O)O.O=C=O.[H+],1.7024305364455252,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)CC(C(=O)O)C(O)C(=O)O__MAGEKSTIIYTLTDEAPLLATYSLLPIIETFTKPAGIEIVKSDISVAARVLAEFADYLSEEQKVSDNLAELGRLTQDPDTNIIKLPNISASVAQLTACIKELQSKGYAIPDYPENPATEEEKTIKARYGKCLGSAVNPVLREGNSDRRAPAAVKNYAKKHPHSMSEWKQWSQTHVSHMEEGDFYHGEKSMTLDRPRNVKMELITNSGKSIVLKPKVALQEGEIIDSMFMSKKALCDFYEKQLDDCREAGILFSLHVKATMMKVSHPIVFGHCVKIYYKEAFEKHGKLFDELGINVNNGMAGLYEKIETLPTSLREEIIEDLHACQEHRPALAMVDSAKGITNFHSPNDIIVDASMPAMIRAGGKMWGADGKQYDAKAVMPESTFARIYQEMINFCKWHGNFDPKTMGTVPNVGLMAQKAEEYGSHDKTFEIPEAGIANITDLDTGEVLLTQNVEEGDIWRMCQVKDAPIRDWVKLAVTRARNSGMPAIFWLDPYRPHENELIKKVQKYLKDHDTTGLDIQIMSQVRAMRYTLERVVRGLDTISVTGNILRDYLTDLFPIMELGTSAKMLSIVPLMAGGGMYETGAGGSAPKHVQQLVEENHLRWDSLGEFLALAVSLEEMGIKENNARAKLLAKTLDEATGKLLDNDKSPSRRTGELDNRGSHFYLSLYWAEALAAQNEDAELKAKFAPLAKALAENEQKIVAELAQVQGKPADIGGYYAVDPAKVSAVMRPSATFNAALSTVQA,./data/raw/alphafold//AF-V5VCI0-F1-model_v4.pdb,2593,5061,4819,4659
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+1687,12690,12861,MLLFETVREMGHEQVLFCHSKNPEIKAIIAIHDTTLGPAMGATRILPYINEEAALKDALRLSRGMTYKAACANIPAGGGKAVIIANPENKTDDLLRAYGRFVDSLNGRFITGQDVNITPDDVRTISQETKYVVGVSEKSGGPAPITSLGVFLGIKAAVESRWQSKRLDGMKVAVQGLGNVGKNLCRHLHEHDVQLFVSDVDPIKAEEVKRLFGATVVEPTEIYSLDVDIFAPCALGGILNSHTIPFLQASIIAGAANNQLENEQLHSQMLAKKGILYSPDYVINAGGLINVYNEMIGYDEEKAFKQVHNIYDTLLAIFEIAKEQGVTTNDAARRLAEDRINNSKRSKSKAIAA,uniprot_search,W8CV45,N.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.O=C(O)C(=O)Cc1c[nH]c2ccccc12.[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.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O,16.0,6.407188024645225e-15,25.0,7.5,1.4.1.19,272131.0,1.2041199826559248,N.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.O=C(O)C(=O)Cc1c[nH]c2ccccc12.[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.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O,1.230448921378274,N.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.O=C(O)C(=O)Cc1c[nH]c2ccccc12.[H+]__MLLFETVREMGHEQVLFCHSKNPEIKAIIAIHDTTLGPAMGATRILPYINEEAALKDALRLSRGMTYKAACANIPAGGGKAVIIANPENKTDDLLRAYGRFVDSLNGRFITGQDVNITPDDVRTISQETKYVVGVSEKSGGPAPITSLGVFLGIKAAVESRWQSKRLDGMKVAVQGLGNVGKNLCRHLHEHDVQLFVSDVDPIKAEEVKRLFGATVVEPTEIYSLDVDIFAPCALGGILNSHTIPFLQASIIAGAANNQLENEQLHSQMLAKKGILYSPDYVINAGGLINVYNEMIGYDEEKAFKQVHNIYDTLLAIFEIAKEQGVTTNDAARRLAEDRINNSKRSKSKAIAA,./data/raw/alphafold//AF-W8CV45-F1-model_v4.pdb,1591,4352,4241,4105
+1688,17591,17831,MSTQIGGMSLDQARTQLAPWTQRAAPIGADEYQQRIERARVLMRAQGVDALLIGAGTSLRYFSGVPWGASERLVALLLTTEGDPVLICPAFEEGSLDAVLQLPVRKRLWEEHEDPYALVVQAMDEQHAHALALDPGIAFAVHTGLRAHLGTAIRDAGAIIDGCRMCKSPAELALMQQACDMTLLVQRLAAGIAHEGIGTDQLVRFIDEAHRALGADNGSTFCIVQFGHATAFPHGIPGVQHLRAGELVLIDTGCTVQGYHSDITRTWIYGTPSDAQQRIWELELAAQAAAFAAVRPGVACEAVDQAARAVLQAAGLGPDYRLPGLPHRTGHGCGLAIHEAPYLVRGNRQPLQPGMCASNEPMIVVPGAFGVRLEDHFYVTDTGAQWFTPPSVAIDQPFA,brenda,Q8P839,N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)O.O>>N[C@@H](Cc1cnc[nH]1)C(=O)O.O=C(O)[C@@H]1CCCN1,3000.0,1.04958877319256e-14,55.0,7.5,3.4.13.9,340.0,3.4771212547196626,N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)O.O,N[C@@H](Cc1cnc[nH]1)C(=O)O.O=C(O)[C@@H]1CCCN1,3.4771212547196626,N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)O.O__MSTQIGGMSLDQARTQLAPWTQRAAPIGADEYQQRIERARVLMRAQGVDALLIGAGTSLRYFSGVPWGASERLVALLLTTEGDPVLICPAFEEGSLDAVLQLPVRKRLWEEHEDPYALVVQAMDEQHAHALALDPGIAFAVHTGLRAHLGTAIRDAGAIIDGCRMCKSPAELALMQQACDMTLLVQRLAAGIAHEGIGTDQLVRFIDEAHRALGADNGSTFCIVQFGHATAFPHGIPGVQHLRAGELVLIDTGCTVQGYHSDITRTWIYGTPSDAQQRIWELELAAQAAAFAAVRPGVACEAVDQAARAVLQAAGLGPDYRLPGLPHRTGHGCGLAIHEAPYLVRGNRQPLQPGMCASNEPMIVVPGAFGVRLEDHFYVTDTGAQWFTPPSVAIDQPFA,./data/raw/alphafold//AF-Q8P839-F1-model_v4.pdb,1844,1533,3114,1879
+1689,2312,2345,MSAFNTTLPSLDYDDDTLREHLQGADIPTLLLTVAHLTGDLQILKPNWKPSIAMGVARSGMDLETEAQVREFCLQRLIDFRDSGQPAPGRPTSDQLHILGTWLMGPVIEPYLPLIAEEAVTAEEDLRAPRWHKDHVASGRDFKVVIIGAGESGMIAALRFKQAGVPFVIYEKGNDVGGTWRENTYPGCRVDINSFWYSFSFARGIWDDCFAPAPQVFAYMQAVAREHGLYEHIRFNTEVSDAHWDESTQRWQLLYRDSEGQTQVDSNVVVFAVGQLNRPMIPAIPGIETFKGPMFHSAQWDHDVDWSGKRVGVIGTGASATQFIPQLAQTAAELKVFARTTNWLLPTPDLHEKISDSCKWLLAHVPHYSLWYRVAMAMPQSVGFLEDVMVDVGYPPTELAVSARNDRLRQDISAWMEPQFADRPDLREVLIPDSPVGGKRIVRDNGTWISTLKRDNVSMIRQPIEVITPKGICCVDGTEHEFDLIVYGTGFHASKFLMPINVTGRDGVALHDVWKGDDARAYLGMTVPQFPNMFCMYGPNTGLVVYSTVIQFSEMTASYIVDAVRLLLEGGHQSMEVKTPVFESYNQRVDEGNALRAWGFSKVNSWYKNSKGRVTQNFPFTAVEFWQRTHSVEPTDYQLG,sabio,Q93TJ5,CC(=O)c1ccc(C)cc1.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.[H]>>CC(=O)Oc1ccc(C)cc1.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,6.3,6.225261043403143e-15,30.0,8.0,1.14.13.84,294.0,0.7993405494535817,CC(=O)c1ccc(C)cc1.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.[H],CC(=O)Oc1ccc(C)cc1.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,0.7993405494535817,CC(=O)c1ccc(C)cc1.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.[H]__MSAFNTTLPSLDYDDDTLREHLQGADIPTLLLTVAHLTGDLQILKPNWKPSIAMGVARSGMDLETEAQVREFCLQRLIDFRDSGQPAPGRPTSDQLHILGTWLMGPVIEPYLPLIAEEAVTAEEDLRAPRWHKDHVASGRDFKVVIIGAGESGMIAALRFKQAGVPFVIYEKGNDVGGTWRENTYPGCRVDINSFWYSFSFARGIWDDCFAPAPQVFAYMQAVAREHGLYEHIRFNTEVSDAHWDESTQRWQLLYRDSEGQTQVDSNVVVFAVGQLNRPMIPAIPGIETFKGPMFHSAQWDHDVDWSGKRVGVIGTGASATQFIPQLAQTAAELKVFARTTNWLLPTPDLHEKISDSCKWLLAHVPHYSLWYRVAMAMPQSVGFLEDVMVDVGYPPTELAVSARNDRLRQDISAWMEPQFADRPDLREVLIPDSPVGGKRIVRDNGTWISTLKRDNVSMIRQPIEVITPKGICCVDGTEHEFDLIVYGTGFHASKFLMPINVTGRDGVALHDVWKGDDARAYLGMTVPQFPNMFCMYGPNTGLVVYSTVIQFSEMTASYIVDAVRLLLEGGHQSMEVKTPVFESYNQRVDEGNALRAWGFSKVNSWYKNSKGRVTQNFPFTAVEFWQRTHSVEPTDYQLG,./data/raw/alphafold//AF-Q93TJ5-F1-model_v4.pdb,1369,868,664,864
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+1707,3559,3608,MFETEHHTLLPLLLLPSLLSLLLFLILLKRRNRKTRFNLPPGKSGWPFLGETIGYLKPYTATTLGDFMQQHVSKYGKIYRSNLFGEPTIVSADAGLNRFILQNEGRLFECSYPRSIGGILGKWSMLVLVGDMHRDMRSISLNFLSHARLRTILLKDVERHTLFVLDSWQQNSIFSAQDEAKKFTFNLMAKHIMSMDPGEEETEQLKKEYVTFMKGVVSAPLNLPGTAYHKALQSRATILKFIERKMEERKLDIKEEDQEEEEVKTEDEAEMSKSDHVRKQRTDDDLLGWVLKHSNLSTEQILDLILSLLFAGHETSSVAIALAIFFLQACPKAVEELREEHLEIARAKKELGESELNWDDYKKMDFTQCVINETLRLGNVVRFLHRKALKDVRYKGYDIPSGWKVLPVISAVHLDNSRYDQPNLFNPWRWQQQNNGASSSGSGSFSTWGNNYMPFGGGPRLCAGSELAKLEMAVFIHHLVLKFNWELAEDDKPFAFPFVDFPNGLPIRVSRIL,sabio,O64989,CC(C)C(C)CCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C.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>>CC(C)[C@H](C)C[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.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,108.0,0.0427438135962562,30.0,7.25,1.14.13.-,3702.0,2.03342375548695,CC(C)C(C)CCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C.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,CC(C)[C@H](C)C[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.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,2.03342375548695,CC(C)C(C)CCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C.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__MFETEHHTLLPLLLLPSLLSLLLFLILLKRRNRKTRFNLPPGKSGWPFLGETIGYLKPYTATTLGDFMQQHVSKYGKIYRSNLFGEPTIVSADAGLNRFILQNEGRLFECSYPRSIGGILGKWSMLVLVGDMHRDMRSISLNFLSHARLRTILLKDVERHTLFVLDSWQQNSIFSAQDEAKKFTFNLMAKHIMSMDPGEEETEQLKKEYVTFMKGVVSAPLNLPGTAYHKALQSRATILKFIERKMEERKLDIKEEDQEEEEVKTEDEAEMSKSDHVRKQRTDDDLLGWVLKHSNLSTEQILDLILSLLFAGHETSSVAIALAIFFLQACPKAVEELREEHLEIARAKKELGESELNWDDYKKMDFTQCVINETLRLGNVVRFLHRKALKDVRYKGYDIPSGWKVLPVISAVHLDNSRYDQPNLFNPWRWQQQNNGASSSGSGSFSTWGNNYMPFGGGPRLCAGSELAKLEMAVFIHHLVLKFNWELAEDDKPFAFPFVDFPNGLPIRVSRIL,./data/raw/alphafold//AF-O64989-F1-model_v4.pdb,1796,1469,3038,1786
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+1709,13184,13359,MGLFAGKGVLVTGGARGIGRAIAQAFAREGALVALCDLRPEGKEVAEAIGGAFFQVDLEDERERVRFVEEAAYALGRVDVLVNNAAIAAPGSALTVRLPEWRRVLEVNLTAPMHLSALAAREMRKVGGGAIVNVASVQGLFAEQENAAYNASKGGLVNLTRSLALDLAPLRIRVNAVAPGAIATEAVLEAIALSPDPERTRRDWEDLHALRRLGKPEEVAEAVLFLASEKASFITGAILPVDGGMTASFMMAGRPV,brenda,Q5SLC4,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.O=C1CCCc2ccccc21.[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)c1,3.9,10.026852384950482,50.0,7.4,1.1.1.121,300852.0,0.5910646070264992,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.O=C1CCCc2ccccc21.[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)c1,0.5910646070264992,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.O=C1CCCc2ccccc21.[H+]__MGLFAGKGVLVTGGARGIGRAIAQAFAREGALVALCDLRPEGKEVAEAIGGAFFQVDLEDERERVRFVEEAAYALGRVDVLVNNAAIAAPGSALTVRLPEWRRVLEVNLTAPMHLSALAAREMRKVGGGAIVNVASVQGLFAEQENAAYNASKGGLVNLTRSLALDLAPLRIRVNAVAPGAIATEAVLEAIALSPDPERTRRDWEDLHALRRLGKPEEVAEAVLFLASEKASFITGAILPVDGGMTASFMMAGRPV,./data/raw/alphafold//AF-Q5SLC4-F1-model_v4.pdb,1373,3679,1476,3442
+1710,6073,6167,MDPIQLLFYVNGQKVVEKNVDPEMMLLPYLRKNLRLTGTKYGCGGGGCGACTVMISRYNPSTKAIRHHPVNACLTPICSLHGTAVTTVEGLGNTRTRLHPIQERIAKCHGTQCGFCTPGMVMSMYALLRNHPEPTLDQLTDALGGNLCRCTGYRPIIDACKTFCKASACCQSKENGVCCLDQEINGLAESQEEDKTSPELFSEEEFLPLDPTQELIFPPELMRIAEKQPPKTRVFYGERVTWISPVTLKELVEAKFKYPQAPIVMGYTSVGPEVKFKGVFHPIIISPDRIEELGVISQARDGLTLGAGLSLDQVKDILADIVQKLPEEKTQTYRALLKHLRTLAGSQIRNMASLGGHIVSRHLDSDLNPLLAVGNCTLNLLSKDGERRIPLSEEFLRKCPEADLKPQEVLVSVNIPWSRKWEFVSAFRQAQRQQNALAIVNSGMRVLFREGGGVIEELSILYGGVGSTIISAKNSCQRLIGRPWNEGMLDTRCRLVLDEVTLAASAPGGKVEFKRTLIISFLFKFYLEVSQGLKREDPGHSPSLAGNHESALDDLHSKHPWRTLTHQNVDPAQLPQDPIGRPIMHLSGIKHATGEAIYCDDMPAVDRELFLTFVTSSRAHAKIVSIDLSEALSLPGVVDIITADHLQEANTFGTETFLATDEVHCVGHLVCAVIADSETRAKQAAKQVKVVYQDLAPLILTIEEAIQHKSFFKSERKLECGNVDEAFKIVDQILEGEIHIGGQEHFYMETQSMLVVPKGEDGEIDIYVSTQFPKYIQDIVAATLKLSANKVMCHVRRVGGAFGGKVGKTSILAAITAFAASKHGRAVRCILERGEDMLITGGRHPYLGKYKAGFMNEGRILALDVEHYCNGGCSLDESLWVIEMGLLKLDNAYKFPNLRCRGWACRTNLPSNTALRGFGFPQAGLVTEACITEVAIKCGLSPEQVRTINMYKHVDTTHYKQEFSAKALSECWRECMAKCSYFERKAAIGKFNAENSWKKRGMAVIPLKFPVGIGSVAMGQAAALVHIYLDGSALVSHGGIEMGQGVHTKMIQVVSRELRMPMSSVHLRGTSTETVPNTNASGGSVVADLNGLAVKDACQTLLKRLEPIISKNPQGTWKDWAQTAFDQSISLSAVGYFRGYESNIDWEKGEGHPFEYFVFGAACSEVEINCLTGDHKNIRTNIVMDVGHSINPALDIGQVEGAFIQGMGLYTIEELSYSPQGTLYSRGPNQYKIPAICDIPTEMHISFLPPSEHSNTLYSSKGLGESGVFLGCSVFFAIHDAVKAARQERGISGPWKLNSPLTPEKIRMACEDKFTKMIPRDEPGSYVPCNIPV,brenda,O54754,CC=O.O.O=O>>CC(=O)O.OO,7.04,0.0,37.0,8.0,1.2.3.1,10090.0,0.8475726591421122,CC=O.O.O=O,CC(=O)O.OO,0.9375178920173468,CC=O.O.O=O__MDPIQLLFYVNGQKVVEKNVDPEMMLLPYLRKNLRLTGTKYGCGGGGCGACTVMISRYNPSTKAIRHHPVNACLTPICSLHGTAVTTVEGLGNTRTRLHPIQERIAKCHGTQCGFCTPGMVMSMYALLRNHPEPTLDQLTDALGGNLCRCTGYRPIIDACKTFCKASACCQSKENGVCCLDQEINGLAESQEEDKTSPELFSEEEFLPLDPTQELIFPPELMRIAEKQPPKTRVFYGERVTWISPVTLKELVEAKFKYPQAPIVMGYTSVGPEVKFKGVFHPIIISPDRIEELGVISQARDGLTLGAGLSLDQVKDILADIVQKLPEEKTQTYRALLKHLRTLAGSQIRNMASLGGHIVSRHLDSDLNPLLAVGNCTLNLLSKDGERRIPLSEEFLRKCPEADLKPQEVLVSVNIPWSRKWEFVSAFRQAQRQQNALAIVNSGMRVLFREGGGVIEELSILYGGVGSTIISAKNSCQRLIGRPWNEGMLDTRCRLVLDEVTLAASAPGGKVEFKRTLIISFLFKFYLEVSQGLKREDPGHSPSLAGNHESALDDLHSKHPWRTLTHQNVDPAQLPQDPIGRPIMHLSGIKHATGEAIYCDDMPAVDRELFLTFVTSSRAHAKIVSIDLSEALSLPGVVDIITADHLQEANTFGTETFLATDEVHCVGHLVCAVIADSETRAKQAAKQVKVVYQDLAPLILTIEEAIQHKSFFKSERKLECGNVDEAFKIVDQILEGEIHIGGQEHFYMETQSMLVVPKGEDGEIDIYVSTQFPKYIQDIVAATLKLSANKVMCHVRRVGGAFGGKVGKTSILAAITAFAASKHGRAVRCILERGEDMLITGGRHPYLGKYKAGFMNEGRILALDVEHYCNGGCSLDESLWVIEMGLLKLDNAYKFPNLRCRGWACRTNLPSNTALRGFGFPQAGLVTEACITEVAIKCGLSPEQVRTINMYKHVDTTHYKQEFSAKALSECWRECMAKCSYFERKAAIGKFNAENSWKKRGMAVIPLKFPVGIGSVAMGQAAALVHIYLDGSALVSHGGIEMGQGVHTKMIQVVSRELRMPMSSVHLRGTSTETVPNTNASGGSVVADLNGLAVKDACQTLLKRLEPIISKNPQGTWKDWAQTAFDQSISLSAVGYFRGYESNIDWEKGEGHPFEYFVFGAACSEVEINCLTGDHKNIRTNIVMDVGHSINPALDIGQVEGAFIQGMGLYTIEELSYSPQGTLYSRGPNQYKIPAICDIPTEMHISFLPPSEHSNTLYSSKGLGESGVFLGCSVFFAIHDAVKAARQERGISGPWKLNSPLTPEKIRMACEDKFTKMIPRDEPGSYVPCNIPV,./data/raw/alphafold//AF-O54754-F1-model_v4.pdb,1051,609,276,303
+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
+1713,7247,7369,MWVCSTLWRVRTPARQWRGLLPASGCHGPAASSYSASAEPARVRALVYGHHGDPAKVVELKNLELAAVRGSDVRVKMLAAPINPSDINMIQGNYGFLPELPAVGGNEGVAQVVAVGSNVTGLKPGDWVIPANAGLGTWRTEAVFSEEALIQVPSDIPLQSAATLGVNPCTAYRMLMDFEQLQPGDSVIQNASNSGVGQAVIQIAAALGLRTINVVRDRPDIQKLSDRLKSLGAEHVITEEELRRPEMKNFFKDMPQPRLALNCVGGKSSTELLRQLARGGTMVTYGGMAKQPVVASVSLLIFKDLKLRGFWLSQWKKDHSPDQFKELILTLCDLIRRGQLTAPACSQVPLQDYQSALEASMKPFISSKQILTM,sabio,Q9BV79,CCCCCCCCCC=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.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]>>CCCCCCCCCCCC(=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.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,3.6,1.3416236200489858e-14,22.0,7.5,1.3.1.104,9606.0,0.5563025007672873,CCCCCCCCCC=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.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],CCCCCCCCCCCC(=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.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,0.5563025007672873,CCCCCCCCCC=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.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]__MWVCSTLWRVRTPARQWRGLLPASGCHGPAASSYSASAEPARVRALVYGHHGDPAKVVELKNLELAAVRGSDVRVKMLAAPINPSDINMIQGNYGFLPELPAVGGNEGVAQVVAVGSNVTGLKPGDWVIPANAGLGTWRTEAVFSEEALIQVPSDIPLQSAATLGVNPCTAYRMLMDFEQLQPGDSVIQNASNSGVGQAVIQIAAALGLRTINVVRDRPDIQKLSDRLKSLGAEHVITEEELRRPEMKNFFKDMPQPRLALNCVGGKSSTELLRQLARGGTMVTYGGMAKQPVVASVSLLIFKDLKLRGFWLSQWKKDHSPDQFKELILTLCDLIRRGQLTAPACSQVPLQDYQSALEASMKPFISSKQILTM,./data/raw/alphafold//AF-Q9BV79-F1-model_v4.pdb,3297,2135,3808,2487
+1714,4805,4866,MKSVLFVCVGNGGKSQMAAALAQKYASDSVEIHSAGTKPAQGLNQLSVESIAEVGADMSQGIPKAIDPELLRTVDRVVILGDDAQVDMPESAQGALERWSIEEPDAQGMERMRIVRDQIDNRVQALLAG,brenda,P0DKS7,CC(O)=N[C@@H](CS)C(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=[As]([O-])([O-])[O-]>>CC(O)=N[C@@H](CS[As](=O)(O)O)C(O)=N[C@H]1[C@@H](OC2[C@H](O)[C@H](O)C(O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O.O,0.53,0.2409845941991656,30.0,7.5,2.8.4.2,1718.0,-0.2757241303992109,CC(O)=N[C@@H](CS)C(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=[As]([O-])([O-])[O-],CC(O)=N[C@@H](CS[As](=O)(O)O)C(O)=N[C@H]1[C@@H](OC2[C@H](O)[C@H](O)C(O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O.O,-0.2757241303992109,CC(O)=N[C@@H](CS)C(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=[As]([O-])([O-])[O-]__MKSVLFVCVGNGGKSQMAAALAQKYASDSVEIHSAGTKPAQGLNQLSVESIAEVGADMSQGIPKAIDPELLRTVDRVVILGDDAQVDMPESAQGALERWSIEEPDAQGMERMRIVRDQIDNRVQALLAG,./data/raw/alphafold//AF-P0DKS7-F1-model_v4.pdb,1383,889,686,975
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+1717,4720,4778,MQIQFHYMEYSELIKLLEETVRIPFYAILGKLKNNLIYLATSEGEISIYALIGGKNVKLTKSPIAISTRPKSSLDFIPFARDVEKGKEIHAIHIANLKGEEFQIESPRVRISSLTYDDKRIVFTGSSQNETSLYVIENGKLSKLTTIPPFSFVTDVNEKYIIGSGVLKGNPRSQEFFIADFSGNIEILTPKEGSVTNAYYLMGNKVYLISDYETPGESYWIYIYDIESKKYDRVEIPGFEFKAIEIYYDPEDLLIIAKKDGESRLFDNGKEINTPKGTISGATRIGDEIYFSHSSLVSPHKIYKVSRYGKIEVVVDNRKVDVGEVEYVKVKTDVEVPTWVIKRKIPGNTIIYIHGGPWSEVDNSWNLLIAPLVLAGYNVIAPNYRGSTGYGSKFMFMNIGDAGGGDLRDVVKVRDYAIETGITNKVGIMGYSYGGYMTLLAVGKEPDKWDFGIAGAAVADWVEMYDLSDSLFRGFMEILFNGKNIDLMKERSPITYVRNVKVPLCIIHSQNDTRTPLNPVMRYIQELQRTGKTYEFHVIPNLGHAIYKVSDAIDILLPALIFLKKLEEQ,brenda,Q7LX61,CC(O)=N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>CC(O)=N[C@@H](C)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,5.0,0.0,80.0,7.5,3.4.19.1,2287.0,0.6989700043360189,CC(O)=N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,CC(O)=N[C@@H](C)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,0.6989700043360189,CC(O)=N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MQIQFHYMEYSELIKLLEETVRIPFYAILGKLKNNLIYLATSEGEISIYALIGGKNVKLTKSPIAISTRPKSSLDFIPFARDVEKGKEIHAIHIANLKGEEFQIESPRVRISSLTYDDKRIVFTGSSQNETSLYVIENGKLSKLTTIPPFSFVTDVNEKYIIGSGVLKGNPRSQEFFIADFSGNIEILTPKEGSVTNAYYLMGNKVYLISDYETPGESYWIYIYDIESKKYDRVEIPGFEFKAIEIYYDPEDLLIIAKKDGESRLFDNGKEINTPKGTISGATRIGDEIYFSHSSLVSPHKIYKVSRYGKIEVVVDNRKVDVGEVEYVKVKTDVEVPTWVIKRKIPGNTIIYIHGGPWSEVDNSWNLLIAPLVLAGYNVIAPNYRGSTGYGSKFMFMNIGDAGGGDLRDVVKVRDYAIETGITNKVGIMGYSYGGYMTLLAVGKEPDKWDFGIAGAAVADWVEMYDLSDSLFRGFMEILFNGKNIDLMKERSPITYVRNVKVPLCIIHSQNDTRTPLNPVMRYIQELQRTGKTYEFHVIPNLGHAIYKVSDAIDILLPALIFLKKLEEQ,./data/raw/alphafold//AF-Q7LX61-F1-model_v4.pdb,2971,1713,3327,2131
+1718,21984,22315,MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,brenda,O94219,O=Cc1cccc(F)c1.O=O>>O=C(O)c1cccc(F)c1.OO,0.883,5.438671170967201,24.0,6.0,1.1.3.7,5323.0,-0.0540392964224314,O=Cc1cccc(F)c1.O=O,O=C(O)c1cccc(F)c1.OO,-0.0540392964224314,O=Cc1cccc(F)c1.O=O__MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,./data/raw/alphafold//AF-O94219-F1-model_v4.pdb,1050,3522,1297,300
+1719,15679,15906,MKETSPIPQPKTFGPLGNLPLIDKDKPTLSLIKLAEEQGPIFQIHTPAGTTIVVSGHELVKEVCDEERFDKSIEGALEKVRAFSGDGLFTSWTHEPNWRKAHNILMPTFSQRAMKDYHEKMVDIAVQLIQKWARLNPNEAVDVPGDMTRLTLDTIGLCGFNYRFNSYYRETPHPFINSMVRALDEAMHQMQRLDVQDKLMVRTKRQFRYDIQTMFSLVDSIIAERRANGDQDEKDLLARMLNVEDPETGEKLDDENIRFQIITFLIAGHETTSGLLSFATYFLLKHPDKLKKAYEEVDRVLTDAAPTYKQVLELTYIRMILNESLRLWPTAPAFSLYPKEDTVIGGKFPITTNDRISVLIPQLHRDRDAWGKDAEEFRPERFEHQDQVPHHAYKPFGNGQRACIGMQFALHEATLVLGMILKYFTLIDHENYELDIKQTLTLKPGDFHISVQSRHQEAIHADVQAAEKAAPDEQKEKTEAKGASVIGLNNRPLLVLYGSDTGTAEGVARELADTASLHGVRTKTAPLNDRIGKLPKEGAVVIVTSSYNGKPPSNAGQFVQWLQEIKPGELEGVHYAVFGCGDHNWASTYQYVPRFIDEQLAEKGATRFSARGEGDVSGDFEGQLDEWKKSMWADAIKAFGLELNENADKERSTLSLQFVRGLGESPLARSYEASHASIAENRELQSADSDRSTRHIEIALPPDVEYQEGDHLGVLPKNSQTNVSRILHRFGLKGTDQVTLSASGRSAGHLPLGRPVSLHDLLSYSVEVQEAATRAQIRELASFTVCPPHRRELEELSAEGVYQEQILKKRISMLDLLEKYEACDMPFERFLELLRPLKPRYYSISSSPRVNPRQASITVGVVRGPAWSGRGEYRGVASNDLAERQAGDDVVMFIRTPESRFQLPKDPETPIIMVGPGTGVAPFRGFLQARDVLKREGKTLGEAHLYFGCRNDRDFIYRDELERFEKDGIVTVHTAFSRKEGMPKTYVQHLMADQADTLISILDRGGRLYVCGDGSKMAPDVEAALQKAYQAVHGTGEQEAQNWLRHLQDTGMYAKDVWAGI,sabio,O08394,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].[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)c1,684000.0,0.2025644769964724,30.0,7.4,1.14.14.1,1423.0,5.835056101720117,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].[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)c1,5.835056101720117,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].[H]__MKETSPIPQPKTFGPLGNLPLIDKDKPTLSLIKLAEEQGPIFQIHTPAGTTIVVSGHELVKEVCDEERFDKSIEGALEKVRAFSGDGLFTSWTHEPNWRKAHNILMPTFSQRAMKDYHEKMVDIAVQLIQKWARLNPNEAVDVPGDMTRLTLDTIGLCGFNYRFNSYYRETPHPFINSMVRALDEAMHQMQRLDVQDKLMVRTKRQFRYDIQTMFSLVDSIIAERRANGDQDEKDLLARMLNVEDPETGEKLDDENIRFQIITFLIAGHETTSGLLSFATYFLLKHPDKLKKAYEEVDRVLTDAAPTYKQVLELTYIRMILNESLRLWPTAPAFSLYPKEDTVIGGKFPITTNDRISVLIPQLHRDRDAWGKDAEEFRPERFEHQDQVPHHAYKPFGNGQRACIGMQFALHEATLVLGMILKYFTLIDHENYELDIKQTLTLKPGDFHISVQSRHQEAIHADVQAAEKAAPDEQKEKTEAKGASVIGLNNRPLLVLYGSDTGTAEGVARELADTASLHGVRTKTAPLNDRIGKLPKEGAVVIVTSSYNGKPPSNAGQFVQWLQEIKPGELEGVHYAVFGCGDHNWASTYQYVPRFIDEQLAEKGATRFSARGEGDVSGDFEGQLDEWKKSMWADAIKAFGLELNENADKERSTLSLQFVRGLGESPLARSYEASHASIAENRELQSADSDRSTRHIEIALPPDVEYQEGDHLGVLPKNSQTNVSRILHRFGLKGTDQVTLSASGRSAGHLPLGRPVSLHDLLSYSVEVQEAATRAQIRELASFTVCPPHRRELEELSAEGVYQEQILKKRISMLDLLEKYEACDMPFERFLELLRPLKPRYYSISSSPRVNPRQASITVGVVRGPAWSGRGEYRGVASNDLAERQAGDDVVMFIRTPESRFQLPKDPETPIIMVGPGTGVAPFRGFLQARDVLKREGKTLGEAHLYFGCRNDRDFIYRDELERFEKDGIVTVHTAFSRKEGMPKTYVQHLMADQADTLISILDRGGRLYVCGDGSKMAPDVEAALQKAYQAVHGTGEQEAQNWLRHLQDTGMYAKDVWAGI,./data/raw/alphafold//AF-O08394-F1-model_v4.pdb,1826,1506,3079,1839
+1720,10863,11018,MLGITVLAALLACASSCGVPSFPPNLSARVVGGEDARPHSWPWQISLQYLKNDTWRHTCGGTLIASNFVLTAAHCISNTRTYRVAVGKNNLEVEDEEGSLFVGVDTIHVHKRWNALLLRNDIALIKLAEHVELSDTIQVACLPEKDSLLPKDYPCYVTGWGRLWTNGPIADKLQQGLQPVVDHATCSRIDWWGFRVKKTMVCAGGDGVISACNGDSGGPLNCQLENGSWEVFGIVSFGSRRGCNTRKKPVVYTRVSAYIDWINEKMQL,brenda,Q99895,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](Cc1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>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](Cc1c[nH]c2ccccc12)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,0.1,8.33233199807213e-15,22.0,8.0,3.4.21.2,9606.0,-1.0,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](Cc1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,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](Cc1c[nH]c2ccccc12)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,-1.0,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](Cc1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MLGITVLAALLACASSCGVPSFPPNLSARVVGGEDARPHSWPWQISLQYLKNDTWRHTCGGTLIASNFVLTAAHCISNTRTYRVAVGKNNLEVEDEEGSLFVGVDTIHVHKRWNALLLRNDIALIKLAEHVELSDTIQVACLPEKDSLLPKDYPCYVTGWGRLWTNGPIADKLQQGLQPVVDHATCSRIDWWGFRVKKTMVCAGGDGVISACNGDSGGPLNCQLENGSWEVFGIVSFGSRRGCNTRKKPVVYTRVSAYIDWINEKMQL,./data/raw/alphafold//AF-Q99895-F1-model_v4.pdb,3744,1612,3210,1987
+1721,4356,4411,MIMLNKEPIVQHLMKYVWVNGKLIPEKEATIPILTHALHYGTSIFEGIRAYWNSDNNNLYVFRARDHYVRFHDSAKIMSIKVGYSVDELIDATVELLRANDVHEDVYIRPITFVSASTVNLDIRNLDVTTAIITVPFGHYLEPKGIKAKVVSWLRVHNSMFPMKAKVSGIYVNSVIAIIDAKVSGFDEAILLNRDGYVAEGSGENIFIIKDGILYTPPVYDSILEGITRDTVITIARDLGLTVTEKRITREELYTADEVFFTGTAAEVTPVVNIDGRVIGNGEPGPIALKVRSYYMDVVHGRVSKYKNWLTPIY,brenda,F0QW25,CC(C)[C@H](N)C(=O)O.CCC(=O)C(=O)O>>CC(C)C(=O)C(=O)O.CCC(N)C(=O)O,2.1,0.0,65.0,8.0,2.6.1.42,985052.0,0.3222192947339193,CC(C)[C@H](N)C(=O)O.CCC(=O)C(=O)O,CC(C)C(=O)C(=O)O.CCC(N)C(=O)O,0.3222192947339193,CC(C)[C@H](N)C(=O)O.CCC(=O)C(=O)O__MIMLNKEPIVQHLMKYVWVNGKLIPEKEATIPILTHALHYGTSIFEGIRAYWNSDNNNLYVFRARDHYVRFHDSAKIMSIKVGYSVDELIDATVELLRANDVHEDVYIRPITFVSASTVNLDIRNLDVTTAIITVPFGHYLEPKGIKAKVVSWLRVHNSMFPMKAKVSGIYVNSVIAIIDAKVSGFDEAILLNRDGYVAEGSGENIFIIKDGILYTPPVYDSILEGITRDTVITIARDLGLTVTEKRITREELYTADEVFFTGTAAEVTPVVNIDGRVIGNGEPGPIALKVRSYYMDVVHGRVSKYKNWLTPIY,./data/raw/alphafold//AF-F0QW25-F1-model_v4.pdb,1271,1483,3053,1803
+1722,835,857,MAIQYFFLLLLVFSAVCSHGARHMPFSIINLDKNTGKSYKMFDEKDLTRNDFPKNFAFGTATSAFQIEGVTHRGFNIWDSFTHRYPEKSTDGSYGDIAADSYHLYKTDVKMMKDMGADAYRFSIAWSRILPNGRINGEINKEGIQYYKNLIDELLANDIEPFVTIFHWDVPQTLEDMYGGLLDRNFVSHYRDFANLCFKEFGDKVKYWITFNQPYSLGFNAYGKGEQAPGRCSSWMNKNCTGGDSGTEPYIVAYHELIAHAEVVQLYRREYKEIQRGHIGITLVANWFWPLTDTKADIDAAQRAQDFKLGWFLDPIMFGDYPASMKELVGKRLPQFAPWESELIKGSIDFIGLNYYFPLFAYNKPTPDPKKPSVLTDGRFGTIDNRDGVMIGINSTLFCYNATGFYDLLTYMRNKYNNPLIYITENGYADSSAISLNETLTDVGRIDYYQAHIAVLKQAIDEGSNIAGYFAWSLLDNYEFVQGFSVRFGLHYLDYKNPSDRRPKASALWFTDFLNPDSKEVA,brenda,C9WCQ0,C=CC/C(=N/OS(=O)(=O)O)S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.O>>C=CCC(S)=NOS(=O)(=O)O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,65.3,0.0,37.0,7.5,3.2.1.147,3649.0,1.8149131812750736,C=CC/C(=N/OS(=O)(=O)O)S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.O,C=CCC(S)=NOS(=O)(=O)O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,1.8149131812750736,C=CC/C(=N/OS(=O)(=O)O)S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.O__MAIQYFFLLLLVFSAVCSHGARHMPFSIINLDKNTGKSYKMFDEKDLTRNDFPKNFAFGTATSAFQIEGVTHRGFNIWDSFTHRYPEKSTDGSYGDIAADSYHLYKTDVKMMKDMGADAYRFSIAWSRILPNGRINGEINKEGIQYYKNLIDELLANDIEPFVTIFHWDVPQTLEDMYGGLLDRNFVSHYRDFANLCFKEFGDKVKYWITFNQPYSLGFNAYGKGEQAPGRCSSWMNKNCTGGDSGTEPYIVAYHELIAHAEVVQLYRREYKEIQRGHIGITLVANWFWPLTDTKADIDAAQRAQDFKLGWFLDPIMFGDYPASMKELVGKRLPQFAPWESELIKGSIDFIGLNYYFPLFAYNKPTPDPKKPSVLTDGRFGTIDNRDGVMIGINSTLFCYNATGFYDLLTYMRNKYNNPLIYITENGYADSSAISLNETLTDVGRIDYYQAHIAVLKQAIDEGSNIAGYFAWSLLDNYEFVQGFSVRFGLHYLDYKNPSDRRPKASALWFTDFLNPDSKEVA,./data/raw/alphafold//AF-C9WCQ0-F1-model_v4.pdb,1219,809,513,586
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+1736,5591,5677,MNSKCHCVILNDGNFIPVLGFGTALPLECPKSKAKELTKIAIDAGFHHFDSASVYNTEDHVGEAIRSKIADGTVRREDIFYTSKVWCTSLHPELVRASLERSLQKLQFDYVDLYLIHYPMALKPGEENFPVDEHGKLIFDRVDLCATWEAMEKCKDAGLTKSIGVSNFNYRQLEMILNKPGLKYKPVCNQVECHPYLNQMKLLDFCKSKDIVLVAYGVLGTQRYGGWVDQNSPVLLDEPVLGSMAKKYNRTPALIALRYQLQRGIVVLNTSLKEERIKENMQVFEFQLSSEDMKVLDGLNRNMRYIPAAIFKGHPNWPFLDEY,sabio,Q91WR5,CC1(C)[C@H]2CC[C@]1(C)C(=O)C2=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]>>CC1(C)C2CCC1(C)C(O)C2O.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,2520.0,0.1102650408407188,25.0,7.0,1.1.1.209,10090.0,3.401400540781544,CC1(C)[C@H]2CC[C@]1(C)C(=O)C2=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],CC1(C)C2CCC1(C)C(O)C2O.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,3.617000341120899,CC1(C)[C@H]2CC[C@]1(C)C(=O)C2=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]__MNSKCHCVILNDGNFIPVLGFGTALPLECPKSKAKELTKIAIDAGFHHFDSASVYNTEDHVGEAIRSKIADGTVRREDIFYTSKVWCTSLHPELVRASLERSLQKLQFDYVDLYLIHYPMALKPGEENFPVDEHGKLIFDRVDLCATWEAMEKCKDAGLTKSIGVSNFNYRQLEMILNKPGLKYKPVCNQVECHPYLNQMKLLDFCKSKDIVLVAYGVLGTQRYGGWVDQNSPVLLDEPVLGSMAKKYNRTPALIALRYQLQRGIVVLNTSLKEERIKENMQVFEFQLSSEDMKVLDGLNRNMRYIPAAIFKGHPNWPFLDEY,./data/raw/alphafold//AF-Q91WR5-F1-model_v4.pdb,1329,1150,6214,878
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+1738,8762,8899,MLKVISSLLFYMTASLMAVASPLAHSGESRGEYPTVSEIPVGEVRLYQIDDGVWSHIATHTFDGVVYPSNGLIVRDGDELLLIDTAWGTKNTVALLAEIEKQIGLPVTRSVSTHFHDDRVGGVDALRAAGVATYASPSTRRLAEAEGNEVPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVLELSRTSAGNVADADLAEWPGSVERIQQHYPEAEVVIPGHGLPGGLDLLQHTANVVKAHTNRSVAE,brenda,Q2HY42,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(=N)[nH]1.O>>,612.0,99.78924695830672,40.0,7.0,3.5.2.6,287.0,2.7867514221455614,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(=N)[nH]1.O,,2.7867514221455614,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(C)=O)CS[C@H]12)c1csc(=N)[nH]1.O__MLKVISSLLFYMTASLMAVASPLAHSGESRGEYPTVSEIPVGEVRLYQIDDGVWSHIATHTFDGVVYPSNGLIVRDGDELLLIDTAWGTKNTVALLAEIEKQIGLPVTRSVSTHFHDDRVGGVDALRAAGVATYASPSTRRLAEAEGNEVPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVLELSRTSAGNVADADLAEWPGSVERIQQHYPEAEVVIPGHGLPGGLDLLQHTANVVKAHTNRSVAE,./data/raw/alphafold//AF-Q2HY42-F1-model_v4.pdb,1446,972,778,1081
+1739,8330,8459,MWLLPLVLTSLASSATWAGQPASPPVVDTAQGRVLGKYVSLEGLAQPVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTSYPPMCCQDPVVEQMTSDLFTNGKERLTLEFSEDCLYLNIYTPADLTKRGRLPVMVWIHGGGLVLGGAPMYDGVVLAAHENVVVVAIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQENIANFGGDPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTVALVRKDMKAAAKQIAVLAGCKTTTSAVFVHCLRQKSEDELLDLTLKMKFLTLDFHGDQRESHPFLPTVVDGVLLPKMPEEILAEKDFNTVPYIVGINKQEFGWLLPTMMGFPLSEGKLDQKTATSLLWKSYPIANIPEELTPVATDKYLGGTDDPVKKKDLFLDLMGDVVFGVPSVTVARQHRDAGAPTYMYEFQYRPSFSSDKKPKTVIGDHGDEIFSVFGFPLLKGDAPEEEVSLSKTVMKFWANFARSGNPNGEGLPHWPMYDQEEGYLQIGVNTQAAKRLKGEEVAFWNDLLSKEAAKKPPKIKHAEL,sabio,Q29550,CCc1c2c(nc3ccc(OC(=O)N4CCC(N5CCCCC5)CC4)cc13)-c1cc3c(c(=O)n1C2)COC(=O)[C@]3(O)CC.Cl.O>>CCc1c2c(nc3ccc(O)cc13)-c1cc3c(c(=O)n1C2)COC(=O)C3(O)CC.O=C(O)N1CCC(N2CCCCC2)CC1,33.0,2.924204547550723,37.0,7.4,3.1.1.1,9823.0,1.5185139398778875,CCc1c2c(nc3ccc(OC(=O)N4CCC(N5CCCCC5)CC4)cc13)-c1cc3c(c(=O)n1C2)COC(=O)[C@]3(O)CC.Cl.O,CCc1c2c(nc3ccc(O)cc13)-c1cc3c(c(=O)n1C2)COC(=O)C3(O)CC.O=C(O)N1CCC(N2CCCCC2)CC1,1.5185139398778875,CCc1c2c(nc3ccc(OC(=O)N4CCC(N5CCCCC5)CC4)cc13)-c1cc3c(c(=O)n1C2)COC(=O)[C@]3(O)CC.Cl.O__MWLLPLVLTSLASSATWAGQPASPPVVDTAQGRVLGKYVSLEGLAQPVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTSYPPMCCQDPVVEQMTSDLFTNGKERLTLEFSEDCLYLNIYTPADLTKRGRLPVMVWIHGGGLVLGGAPMYDGVVLAAHENVVVVAIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQENIANFGGDPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTVALVRKDMKAAAKQIAVLAGCKTTTSAVFVHCLRQKSEDELLDLTLKMKFLTLDFHGDQRESHPFLPTVVDGVLLPKMPEEILAEKDFNTVPYIVGINKQEFGWLLPTMMGFPLSEGKLDQKTATSLLWKSYPIANIPEELTPVATDKYLGGTDDPVKKKDLFLDLMGDVVFGVPSVTVARQHRDAGAPTYMYEFQYRPSFSSDKKPKTVIGDHGDEIFSVFGFPLLKGDAPEEEVSLSKTVMKFWANFARSGNPNGEGLPHWPMYDQEEGYLQIGVNTQAAKRLKGEEVAFWNDLLSKEAAKKPPKIKHAEL,./data/raw/alphafold//AF-Q29550-F1-model_v4.pdb,1494,2159,554,633
+1740,11660,11818,MRRFLLLYATQQGQAKAIAEEICEQAVVHGFSADLHCISESDKYDLKTETAPLVVVVSTTGTGDPPDTARKFVKEIQNQTLPVDFFAHLRYGLLGLGDSEYTYFCNGGKIIDKRLQELGARHFYDTGHADDCVGLELVVEPWIAGLWPALRKHFRSSRGQEEISGALPVASPASSRTDLVKSELLHIESQVELLRFDDSGRKDSEVLKQNAVNSNQSNVVIEDFESSLTRSVPPLSQASLNIPGLPPEYLQVHLQESLGQEESQVSVTSADPVFQVPISKAVQLTTNDAIKTTLLVELDISNTDFSYQPGDAFSVICPNSDSEVQSLLQRLQLEDKREHCVLLKIKADTKKKGATLPQHIPAGCSLQFIFTWCLEIRAIPKKAFLRALVDYTSDSAEKRRLQELCSKQGAADYSRFVRDACACLLDLLLAFPSCQPPLSLLLEHLPKLQPRPYSCASSSLFHPGKLHFVFNIVEFLSTATTEVLRKGVCTGWLALLVASVLQPNIHASHEDSGKALAPKISISPRTTNSFHLPDDPSIPIIMVGPGTGIAPFIGFLQHREKLQEQHPDGNFGAMWLFFGCRHKDRDYLFRKELRHFLKHGILTHLKVSFSRDAPVGEEEAPAKYVQDNIQLHGQQVARILLQENGHIYVCGDAKNMAKDVHDALVQIISKEVGVEKLEAMKTLATLKEEKRYLQDIWS,brenda,Q9UBK8,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[Fe-3]>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,8.24,10000000.0,24.25,7.5,1.16.1.8,9606.0,0.9159272116971158,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[Fe-3],Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,0.9159272116971158,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[Fe-3]__MRRFLLLYATQQGQAKAIAEEICEQAVVHGFSADLHCISESDKYDLKTETAPLVVVVSTTGTGDPPDTARKFVKEIQNQTLPVDFFAHLRYGLLGLGDSEYTYFCNGGKIIDKRLQELGARHFYDTGHADDCVGLELVVEPWIAGLWPALRKHFRSSRGQEEISGALPVASPASSRTDLVKSELLHIESQVELLRFDDSGRKDSEVLKQNAVNSNQSNVVIEDFESSLTRSVPPLSQASLNIPGLPPEYLQVHLQESLGQEESQVSVTSADPVFQVPISKAVQLTTNDAIKTTLLVELDISNTDFSYQPGDAFSVICPNSDSEVQSLLQRLQLEDKREHCVLLKIKADTKKKGATLPQHIPAGCSLQFIFTWCLEIRAIPKKAFLRALVDYTSDSAEKRRLQELCSKQGAADYSRFVRDACACLLDLLLAFPSCQPPLSLLLEHLPKLQPRPYSCASSSLFHPGKLHFVFNIVEFLSTATTEVLRKGVCTGWLALLVASVLQPNIHASHEDSGKALAPKISISPRTTNSFHLPDDPSIPIIMVGPGTGIAPFIGFLQHREKLQEQHPDGNFGAMWLFFGCRHKDRDYLFRKELRHFLKHGILTHLKVSFSRDAPVGEEEAPAKYVQDNIQLHGQQVARILLQENGHIYVCGDAKNMAKDVHDALVQIISKEVGVEKLEAMKTLATLKEEKRYLQDIWS,./data/raw/alphafold//AF-Q9UBK8-F1-model_v4.pdb,1583,1164,3009,1358
+1741,15459,15683,MGSVEAGEKKALGWAARDPSGVLSPYSYTLRSTGADDVYIKVICCGICHTDIHQIKNDLGMSNYPMVPGHEVVGEVLEVGSDVSKFTVGDVVGVGVVVGCCGSCKPCSSELEQYCNKRIWSYNDVYTDGKPTQGGFADTMIVNQKFVVKIPEGMAVEQAAPLLCAGVTVYSPLSHFGLMASGLKGGILGLGGVGHMGVKIAKAMGHHVTVISSSDKKKEEAIEHLGADDYVVSSDPAEMQRLADSLDYIIDTVPVFHPLDPYLACLKLDGKLILMGVINTPLQFVTPLVILGRKVISGSFIGSIKETEEVLAFCKEKGLTSTIETVKIDELNIAFERLRKNDVRYRFVVDVAGSNLVEEAATTTN,sabio,P48523,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=Cc1ccc(O)cc1.[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=Cc1ccc(O)cc1,3.44,6.350552998993176e-15,30.0,6.25,1.1.1.195,3702.0,0.5365584425715301,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=Cc1ccc(O)cc1.[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=Cc1ccc(O)cc1,0.5365584425715301,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=Cc1ccc(O)cc1.[H]__MGSVEAGEKKALGWAARDPSGVLSPYSYTLRSTGADDVYIKVICCGICHTDIHQIKNDLGMSNYPMVPGHEVVGEVLEVGSDVSKFTVGDVVGVGVVVGCCGSCKPCSSELEQYCNKRIWSYNDVYTDGKPTQGGFADTMIVNQKFVVKIPEGMAVEQAAPLLCAGVTVYSPLSHFGLMASGLKGGILGLGGVGHMGVKIAKAMGHHVTVISSSDKKKEEAIEHLGADDYVVSSDPAEMQRLADSLDYIIDTVPVFHPLDPYLACLKLDGKLILMGVINTPLQFVTPLVILGRKVISGSFIGSIKETEEVLAFCKEKGLTSTIETVKIDELNIAFERLRKNDVRYRFVVDVAGSNLVEEAATTTN,./data/raw/alphafold//AF-P48523-F1-model_v4.pdb,3542,3485,1261,3209
+1742,185,197,MEEEQDLPEQPVKKAKMQESGEQTISQVSNPDVSDQKPETSSLASNLPMSEEIMTCTDYIPRSSNDYTSQMYSAKPYAHILSVPVSETAYPGQTQYQTLQQTQPYAVYPQATQTYGLPPFGALWPGMKPESGLIQTPSPSQHSVLTCTTGLTTSQPSPAHYSYPIQASSTNASLISTSSTIANIPAAAVASISNQDYPTYTILGQNQYQACYPSSSFGVTGQTNSDAESTTLAATTYQSEKPSVMAPAPAAQRLSSGDPSTSPSLSQTTPSKDTDDQSRKNMTSKNRGKRKADATSSQDSELERVFLWDLDETIIIFHSLLTGSYAQKYGKDPTVVIGSGLTMEEMIFEVADTHLFFNDLEECDQVHVEDVASDDNGQDLSNYSFSTDGFSGSGGSGSHGSSVGVQGGVDWMRKLAFRYRKVREIYDKHKSNVGGLLSPQRKEALQRLRAEIEVLTDSWLGTALKSLLLIQSRKNCVNVLITTTQLVPALAKVLLYGLGEIFPIENIYSATKIGKESCFERIVSRFGKKVTYVVIGDGRDEEIAAKQHNMPFWRITNHGDLVSLHQALELDFL,sabio,Q99504,*NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(*)=O.O>>*NC(=O)C(Cc1ccc(O)cc1)NC(*)=O.O=P(O)(O)O,5.2,0.0,,,3.1.3.48,9606.0,0.7160033436347992,*NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(*)=O.O,*NC(=O)C(Cc1ccc(O)cc1)NC(*)=O.O=P(O)(O)O,0.7160033436347992,*NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(*)=O.O__MEEEQDLPEQPVKKAKMQESGEQTISQVSNPDVSDQKPETSSLASNLPMSEEIMTCTDYIPRSSNDYTSQMYSAKPYAHILSVPVSETAYPGQTQYQTLQQTQPYAVYPQATQTYGLPPFGALWPGMKPESGLIQTPSPSQHSVLTCTTGLTTSQPSPAHYSYPIQASSTNASLISTSSTIANIPAAAVASISNQDYPTYTILGQNQYQACYPSSSFGVTGQTNSDAESTTLAATTYQSEKPSVMAPAPAAQRLSSGDPSTSPSLSQTTPSKDTDDQSRKNMTSKNRGKRKADATSSQDSELERVFLWDLDETIIIFHSLLTGSYAQKYGKDPTVVIGSGLTMEEMIFEVADTHLFFNDLEECDQVHVEDVASDDNGQDLSNYSFSTDGFSGSGGSGSHGSSVGVQGGVDWMRKLAFRYRKVREIYDKHKSNVGGLLSPQRKEALQRLRAEIEVLTDSWLGTALKSLLLIQSRKNCVNVLITTTQLVPALAKVLLYGLGEIFPIENIYSATKIGKESCFERIVSRFGKKVTYVVIGDGRDEEIAAKQHNMPFWRITNHGDLVSLHQALELDFL,./data/raw/alphafold//AF-Q99504-F1-model_v4.pdb,969,495,136,144
+1743,8988,9130,MKHYVLVHGGCHGAWCWYKVKPMLEHSGHRVTVFDLTAHGVNMSRVEDIQTLEDFAKPLLEVLESFGSDDKVVLVAHSLGGIPAALAADMFPSKISVAVFVTSFMPDTTNPPSYVFEKFLGSITEEERMDFELGSYGTDDHPLKTAFLGPNYLKNMYLLSPIEDYELAKMLMRVTPAITSNLTGTKSLTAQGYGSISRVYIVCGEDKGIRVDFQRWMIENSPVKEVMEIKDADHMPMFSKPHELCDRLLKIADKYP,sabio,O23171,COC(=O)c1ccccc1O.O>>CO.O=C(O)c1ccccc1O,0.0137,0.0,22.0,,3.1.1.-,3702.0,-1.863279432843593,COC(=O)c1ccccc1O.O,CO.O=C(O)c1ccccc1O,-1.863279432843593,COC(=O)c1ccccc1O.O__MKHYVLVHGGCHGAWCWYKVKPMLEHSGHRVTVFDLTAHGVNMSRVEDIQTLEDFAKPLLEVLESFGSDDKVVLVAHSLGGIPAALAADMFPSKISVAVFVTSFMPDTTNPPSYVFEKFLGSITEEERMDFELGSYGTDDHPLKTAFLGPNYLKNMYLLSPIEDYELAKMLMRVTPAITSNLTGTKSLTAQGYGSISRVYIVCGEDKGIRVDFQRWMIENSPVKEVMEIKDADHMPMFSKPHELCDRLLKIADKYP,./data/raw/alphafold//AF-O23171-F1-model_v4.pdb,1488,3436,1175,3100
+1744,22920,23262,MAYFPNVSKITYSGKQLKSGLSFNHYNPKELVGGKTMEEQLRFSVAFWHTFTESGTDPFGAGSKIRPWDRFTGMDLAKARVEAAFEFFEKLGNPYFCFHDRDIAPEGDTLRETNKNLDVIVAMIKDYMKTSKVKLLWNTANMFTNPRFVHGAASSCNADVFAYAAAQVKKGLEVGKELGAENYVFWGGREGYETLLNTDLKLEQDNLARFFHMAVDYAKEIGFDAQFLLEPKPKEPTKHQYDFDAATTIAFLKTYDLDQHFKLNLEANHATLAGHTFEHEIRVARTHGLLGSLDANQGDPLLGWDTDEFPTDLYSTTLAMYEVLKNGGLGRGGLNFDAKTRRASFTDEDLFYAHIAGMDSFALGLKVANRLIEDRVFDAFIEERYSSYKEGIGADIVSGKADFKSLENYILDKKEIINQSGRLEQLKNTLNHYIVQEAYQSVNA,sabio,A0A290GAT0,OCC1OC(O)C(O)C(O)C1O>>OCC1OC(O)(CO)C(O)C1O,0.243,0.0,35.0,7.0,5.3.1.5,1398.0,-0.6143937264016879,OCC1OC(O)C(O)C(O)C1O,OCC1OC(O)(CO)C(O)C1O,0.3304137733491908,OCC1OC(O)C(O)C(O)C1O__MAYFPNVSKITYSGKQLKSGLSFNHYNPKELVGGKTMEEQLRFSVAFWHTFTESGTDPFGAGSKIRPWDRFTGMDLAKARVEAAFEFFEKLGNPYFCFHDRDIAPEGDTLRETNKNLDVIVAMIKDYMKTSKVKLLWNTANMFTNPRFVHGAASSCNADVFAYAAAQVKKGLEVGKELGAENYVFWGGREGYETLLNTDLKLEQDNLARFFHMAVDYAKEIGFDAQFLLEPKPKEPTKHQYDFDAATTIAFLKTYDLDQHFKLNLEANHATLAGHTFEHEIRVARTHGLLGSLDANQGDPLLGWDTDEFPTDLYSTTLAMYEVLKNGGLGRGGLNFDAKTRRASFTDEDLFYAHIAGMDSFALGLKVANRLIEDRVFDAFIEERYSSYKEGIGADIVSGKADFKSLENYILDKKEIINQSGRLEQLKNTLNHYIVQEAYQSVNA,./data/raw/alphafold//AF-A0A290GAT0-F1-model_v4.pdb,844,3275,5583,6469
+1745,20285,20580,MAAPPQPVTHLIFDMDGLLLDTERLYSVVFQEICNRYDKKYSWDVKSLVMGKKALEAAQIIIDVLQLPMSKEELVEESQTKLKEVFPTAALMPGAEKLIIHLRKHGIPFALATSSGSASFDMKTSRHKEFFSLFSHIVLGDDPEVQHGKPDPDIFLACAKRFSPPPAMEKCLVFEDAPNGVEAALAAGMQVVMVPDGNLSRDLTTKATLVLNSLQDFQPELFGLPSYE,sabio,Q08623,O.O=c1[nH]cc(C2OC(COP(=O)(O)O)C(O)C2O)c(=O)[nH]1>>O=P(O)(O)O.O=c1[nH]cc(C2OC(CO)C(O)C2O)c(=O)[nH]1,1.59,0.0,30.0,,3.1.3.96,9606.0,0.2013971243204514,O.O=c1[nH]cc(C2OC(COP(=O)(O)O)C(O)C2O)c(=O)[nH]1,O=P(O)(O)O.O=c1[nH]cc(C2OC(CO)C(O)C2O)c(=O)[nH]1,0.2013971243204514,O.O=c1[nH]cc(C2OC(COP(=O)(O)O)C(O)C2O)c(=O)[nH]1__MAAPPQPVTHLIFDMDGLLLDTERLYSVVFQEICNRYDKKYSWDVKSLVMGKKALEAAQIIIDVLQLPMSKEELVEESQTKLKEVFPTAALMPGAEKLIIHLRKHGIPFALATSSGSASFDMKTSRHKEFFSLFSHIVLGDDPEVQHGKPDPDIFLACAKRFSPPPAMEKCLVFEDAPNGVEAALAAGMQVVMVPDGNLSRDLTTKATLVLNSLQDFQPELFGLPSYE,./data/raw/alphafold//AF-Q08623-F1-model_v4.pdb,1980,4132,1997,3835
+1746,2390,2424,MEIFKYMEKYDYEQLVFCQDEASGLKAIIAIHDTTLGPALGGARMWTYATEENAIEDALRLARGMTYKNAAAGLNLGGGKTVIIGDPFKDKNEEMFRALGRFIQGLNGRYITAEDVGTTVTDMDLIHEETNYVTGISPAFGSSGNPSPVTAYGVYRGMKAAAKEAFGTDMLEGRTISVQGLGNVAYKLCEYLHNEGAKLVVTDINQAAIDRVVNDFGATAVAPDEIYSQEVDIFSPCALGAILNDETIPQLKAKVIAGSANNQLQDSRHGDYLHELGIVYAPDYVINAGGVINVADELYGYNRERALKRVDGIYDSIEKIFEISKRDSIPTYVAANRLAEERIARVAKSRSQFLKNEKNILNGR,brenda,Q76GS2,CC(C)(C)C(=O)C(=O)O.N.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+]>>CC(C)(C)[C@H](N)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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O,31.0,0.0,32.5,10.65,1.4.1.9,1421.0,1.4913616938342726,CC(C)(C)C(=O)C(=O)O.N.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+],CC(C)(C)[C@H](N)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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O,1.4913616938342726,CC(C)(C)C(=O)C(=O)O.N.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+]__MEIFKYMEKYDYEQLVFCQDEASGLKAIIAIHDTTLGPALGGARMWTYATEENAIEDALRLARGMTYKNAAAGLNLGGGKTVIIGDPFKDKNEEMFRALGRFIQGLNGRYITAEDVGTTVTDMDLIHEETNYVTGISPAFGSSGNPSPVTAYGVYRGMKAAAKEAFGTDMLEGRTISVQGLGNVAYKLCEYLHNEGAKLVVTDINQAAIDRVVNDFGATAVAPDEIYSQEVDIFSPCALGAILNDETIPQLKAKVIAGSANNQLQDSRHGDYLHELGIVYAPDYVINAGGVINVADELYGYNRERALKRVDGIYDSIEKIFEISKRDSIPTYVAANRLAEERIARVAKSRSQFLKNEKNILNGR,./data/raw/alphafold//AF-Q76GS2-F1-model_v4.pdb,1591,1174,3056,1806
+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
+1748,13025,13199,MVDQATLDKLEAGFKKLQEASDCKSLLKKHLTKDVFDSIKNKKTGMGATLLDVIQSGVENLDSGVGIYAPDAESYRTFGPLFDPIIDDYHGGFKLTDKHPPKEWGDINTLVDLDPGGQFIISTRVRCGRSLQGYPFNPCLTAEQYKEMEEKVSSTLSSMEDELKGTYYPLTGMSKATQQQLIDDHFLFKEGDRFLQTANACRYWPTGRGIFHNDAKTFLVWVNEEDHLRIISMQKGGDLKTVYKRLVTAVDNIESKLPFSHDDRFGFLTFCPTNLGTTMRASVHIQLPKLAKDRKVLEDIASKFNLQVRGTRGEHTESEGGVYDISNKRRLGLTEYQAVREMQDGILEMIKMEKAAA,uniprot_search,P51541,N=C(NCCC[C@H](N)C(=O)O)NP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>N=C(N)NCCC[C@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,140.0,0.0,,7.5,2.7.3.3,6850.0,2.146128035678238,N=C(NCCC[C@H](N)C(=O)O)NP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,N=C(N)NCCC[C@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,2.146128035678238,N=C(NCCC[C@H](N)C(=O)O)NP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MVDQATLDKLEAGFKKLQEASDCKSLLKKHLTKDVFDSIKNKKTGMGATLLDVIQSGVENLDSGVGIYAPDAESYRTFGPLFDPIIDDYHGGFKLTDKHPPKEWGDINTLVDLDPGGQFIISTRVRCGRSLQGYPFNPCLTAEQYKEMEEKVSSTLSSMEDELKGTYYPLTGMSKATQQQLIDDHFLFKEGDRFLQTANACRYWPTGRGIFHNDAKTFLVWVNEEDHLRIISMQKGGDLKTVYKRLVTAVDNIESKLPFSHDDRFGFLTFCPTNLGTTMRASVHIQLPKLAKDRKVLEDIASKFNLQVRGTRGEHTESEGGVYDISNKRRLGLTEYQAVREMQDGILEMIKMEKAAA,./data/raw/alphafold//AF-P51541-F1-model_v4.pdb,2198,4425,4351,4236
+1749,9290,9432,MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,brenda,A0A077JBW9,CO[P@@](=O)(Oc1ccc([N+](=O)[O-])cc1)OC(C)C.O>>COP(=O)(O)OC(C)C.O=[N+]([O-])c1ccc(O)cc1,5.0,0.0,30.0,8.5,3.1.8.1,453246.0,0.6989700043360189,CO[P@@](=O)(Oc1ccc([N+](=O)[O-])cc1)OC(C)C.O,COP(=O)(O)OC(C)C.O=[N+]([O-])c1ccc(O)cc1,0.6989700043360189,CO[P@@](=O)(Oc1ccc([N+](=O)[O-])cc1)OC(C)C.O__MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,./data/raw/alphafold//AF-A0A077JBW9-F1-model_v4.pdb,3110,1877,3509,2328
+1750,12035,12198,METNHITSLHHITICTGTAQGDIDFFVKVMGQRFVKRTLFYDGSIPIYHLYFADELGTPGTVMTTFPTRRTGQKGRKGSNQFTVCTYAIPKGSLEWWIGHLNAHGIATGEPGTRFGQRYVGFQHPDCGIDFEVLEDENDTRQPYDSPYVPIEHAQRGFHSWTASVRELEDMDFFMENCWNFEKIGEEGNRHRYRVKGTTESGTIIDLLHEPDRRQGSWTIAEGIIHHGAFAVPDMDIQARIKFETEGVGFTDFSDRKNRGYFESTYVRTPGGVMFEATHSLGFTHDEDERSLGMDLKVSPQFDDKKHLIEQAMEDDPIVV,brenda,Q9ZBB0,Cc1cc(O)cc(Cl)c1O>>,2.41,99.37337076398636,23.0,7.0,1.13.11.66,46429.0,0.3820170425748684,Cc1cc(O)cc(Cl)c1O,,0.3820170425748684,Cc1cc(O)cc(Cl)c1O__METNHITSLHHITICTGTAQGDIDFFVKVMGQRFVKRTLFYDGSIPIYHLYFADELGTPGTVMTTFPTRRTGQKGRKGSNQFTVCTYAIPKGSLEWWIGHLNAHGIATGEPGTRFGQRYVGFQHPDCGIDFEVLEDENDTRQPYDSPYVPIEHAQRGFHSWTASVRELEDMDFFMENCWNFEKIGEEGNRHRYRVKGTTESGTIIDLLHEPDRRQGSWTIAEGIIHHGAFAVPDMDIQARIKFETEGVGFTDFSDRKNRGYFESTYVRTPGGVMFEATHSLGFTHDEDERSLGMDLKVSPQFDDKKHLIEQAMEDDPIVV,./data/raw/alphafold//AF-Q9ZBB0-F1-model_v4.pdb,1963,4112,1973,3811
+1751,13913,14094,MARFINLETESMKQHLLSAAILAACAGVGAAPAHAQSQPQSQPSPDRRRSAPAAGQVTIRRDGYGMPHVYANTVYGIFYGYGYAVAQDRLFQMEMARRSTQGQVAEVLGEKMVAFDKSIRGNFSPERIQRQLAALPASERQILDGYAAGMNAWIARVRAEPGTLMPKEFNDLQFQPSDWTPYDVAMVFVGTMANRFSDANSEIDNLALLTALRDKHGEARAMQIFNQLRWMTDSRALTTVPEEEGVYQPATYQPATARAPAKLSYALPRYDGTPPMLERVARDPQTRGVLQDAPADAPARLLAQFAQSGQPGIAGFPTTSNMWIVGREHAKDARSILLNGPQFGWWNPAYTYGIGLHGAGYDVVGNTPFAYPSILFGHNAHVTWGSTAGFGDDVDIYAEKLDPADRTRYFHNGEWKTMEKRTELIQVKDGKPVLMDVYRTVHGIVTKFDDKQHVAYAKARAWEGFELQSLMAWTHKTQARNWDQWKQQAARHALTINWYYADDRGNIGYAHTGFYPKRKPGHDPRLPVPGTGEMDWDGMLPFATNPQVYNPRQGYIANWNNQPMRGYPSTDLFAIVWGQADRYAEIETRMKAMTADGGKISAQQMWDLIRTTSYADVNRRHFLPFLQRAVAGLPADDARARLVADLSTWDGMGTSDKQPGYYDNAGSAVMDAWLRAMLRSTLADEMPADFFKWYSATGYPTPATPATGSLNLTVGVKVLFNALAGPNAGVPQPYDFFNGKRPEAVSLAALDEALAALQKAYGQDPAAWRIPAPPMVFAPKNFLGVPQADDKAVLSFSATQNRGTENNMTVFDGKGVRAVDVVAPGQSGFVAPDGTPSVHTRDQFDLYNHFGSKRVWFTDVEVRANTKSVETLRY,brenda,Q6PWR5,N=C(O)Cc1ccccc1.O>>N.O=C(O)Cc1ccccc1,23.0,0.0,30.0,7.0,3.5.1.11,86473.0,1.3617278360175928,N=C(O)Cc1ccccc1.O,N.O=C(O)Cc1ccccc1,1.3617278360175928,N=C(O)Cc1ccccc1.O__MARFINLETESMKQHLLSAAILAACAGVGAAPAHAQSQPQSQPSPDRRRSAPAAGQVTIRRDGYGMPHVYANTVYGIFYGYGYAVAQDRLFQMEMARRSTQGQVAEVLGEKMVAFDKSIRGNFSPERIQRQLAALPASERQILDGYAAGMNAWIARVRAEPGTLMPKEFNDLQFQPSDWTPYDVAMVFVGTMANRFSDANSEIDNLALLTALRDKHGEARAMQIFNQLRWMTDSRALTTVPEEEGVYQPATYQPATARAPAKLSYALPRYDGTPPMLERVARDPQTRGVLQDAPADAPARLLAQFAQSGQPGIAGFPTTSNMWIVGREHAKDARSILLNGPQFGWWNPAYTYGIGLHGAGYDVVGNTPFAYPSILFGHNAHVTWGSTAGFGDDVDIYAEKLDPADRTRYFHNGEWKTMEKRTELIQVKDGKPVLMDVYRTVHGIVTKFDDKQHVAYAKARAWEGFELQSLMAWTHKTQARNWDQWKQQAARHALTINWYYADDRGNIGYAHTGFYPKRKPGHDPRLPVPGTGEMDWDGMLPFATNPQVYNPRQGYIANWNNQPMRGYPSTDLFAIVWGQADRYAEIETRMKAMTADGGKISAQQMWDLIRTTSYADVNRRHFLPFLQRAVAGLPADDARARLVADLSTWDGMGTSDKQPGYYDNAGSAVMDAWLRAMLRSTLADEMPADFFKWYSATGYPTPATPATGSLNLTVGVKVLFNALAGPNAGVPQPYDFFNGKRPEAVSLAALDEALAALQKAYGQDPAAWRIPAPPMVFAPKNFLGVPQADDKAVLSFSATQNRGTENNMTVFDGKGVRAVDVVAPGQSGFVAPDGTPSVHTRDQFDLYNHFGSKRVWFTDVEVRANTKSVETLRY,./data/raw/alphafold//AF-Q6PWR5-F1-model_v4.pdb,3127,1906,3544,2360
+1752,3538,3587,MQPNDITFFQRFQDDILAGRKTITIRDESESHFKTGDVLRVGRFEDDGYFCTIEVTATSTVTLDTLTEKHAEQENMTLTELKKVIADIYPGQTQFYVIEFKCL,brenda,P67603,CC(C)C(=O)N=c1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(O)n1.O>>,75.0,99.68387043746009,22.0,8.0,3.5.1.135,562.0,1.8750612633917,CC(C)C(=O)N=c1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(O)n1.O,,1.8750612633917,CC(C)C(=O)N=c1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(O)n1.O__MQPNDITFFQRFQDDILAGRKTITIRDESESHFKTGDVLRVGRFEDDGYFCTIEVTATSTVTLDTLTEKHAEQENMTLTELKKVIADIYPGQTQFYVIEFKCL,./data/raw/alphafold//AF-P67603-F1-model_v4.pdb,1790,1462,3029,1777
+1753,9778,9926,MDRRSFNRRVLLGGATVATSLSLTSVPEVAGAAAPARTAPAGGEVRHLKLYIEKLADGQLGYGFEKGRATIPGPLIELNEGDTAHIEVENTLDVPASLHVHGLDYEITSDGTKLNRSDVEPGGTRTYTWRTHAPGRRADGTWRAGSAGYWHYHDHVVGTEHGTGGIRKGLYGPVVVRRKGDVLPDATHTIVFNDMLINNQPAHSGPNFEATVGDRVEFVMITHGEYYHTFHMHGHRWADNRTGLLTGPDDPSQVIDNKIVGPADSFGFQVIAGEGVGAGAWMYHCHVQSHSDMGMVGLFLVKKKDGTIPGHEH,brenda,J9S5G3,COc1cccc(OC)c1O.O=O>>COC1=CC(=C2C=C(OC)C(=O)C(OC)=C2)C=C(OC)C1=O.O,34.4,26.723535554177243,30.0,8.0,1.10.3.2,1938.0,1.5365584425715302,COc1cccc(OC)c1O.O=O,COC1=CC(=C2C=C(OC)C(=O)C(OC)=C2)C=C(OC)C1=O.O,1.5365584425715302,COc1cccc(OC)c1O.O=O__MDRRSFNRRVLLGGATVATSLSLTSVPEVAGAAAPARTAPAGGEVRHLKLYIEKLADGQLGYGFEKGRATIPGPLIELNEGDTAHIEVENTLDVPASLHVHGLDYEITSDGTKLNRSDVEPGGTRTYTWRTHAPGRRADGTWRAGSAGYWHYHDHVVGTEHGTGGIRKGLYGPVVVRRKGDVLPDATHTIVFNDMLINNQPAHSGPNFEATVGDRVEFVMITHGEYYHTFHMHGHRWADNRTGLLTGPDDPSQVIDNKIVGPADSFGFQVIAGEGVGAGAWMYHCHVQSHSDMGMVGLFLVKKKDGTIPGHEH,./data/raw/alphafold//AF-J9S5G3-F1-model_v4.pdb,3584,3545,1325,2871
+1754,17043,17273,MSNKCDVVVVGGGISGMAAAKLLHDSGLNVVVLEARDRVGGRTYTLRNQKVKYVDLGGSYVGPTQNRILRLAKELGLETYKVNEVERLIHHVKGKSYPFRGPFPPVWNPITYLDHNNFWRTMDDMGREIPSDAPWKAPLAEEWDNMTMKELLDKLCWTESAKQLATLFVNLCVTAETHEVSALWFLWYVKQCGGTTRIISTTNGGQERKFVGGSGQVSERIMDLLGDRVKLERPVIYIDQTRENVLVETLNHEMYEAKYVISAIPPTLGMKIHFNPPLPMMRNQMITRVPLGSVIKCIVYYKEPFWRKKDYCGTMIIDGEEAPVAYTLDDTKPEGNYAAIMGFILAHKARKLARLTKEERLKKLCELYAKVLGSLEALEPVHYEEKNWCEEQYSGGCYTTYFPPGILTQYGRVLRQPVDRIYFAGTETATHWSGYMEGAVEAGERAAREILHAMGKIPEDEIWQSEPESVDVPAQPITTTFLERHLPSVPGLLRLIGLTTIFSATALGFLAHKRGLLVRV,brenda,P27338,NCc1ccc([N+](=O)[O-])cc1.O.O=O>>N.O=Cc1ccc([N+](=O)[O-])cc1.OO,0.185,7.01195795802059e-15,25.0,7.5,1.4.3.4,9606.0,-0.7328282715969863,NCc1ccc([N+](=O)[O-])cc1.O.O=O,N.O=Cc1ccc([N+](=O)[O-])cc1.OO,-0.7328282715969863,NCc1ccc([N+](=O)[O-])cc1.O.O=O__MSNKCDVVVVGGGISGMAAAKLLHDSGLNVVVLEARDRVGGRTYTLRNQKVKYVDLGGSYVGPTQNRILRLAKELGLETYKVNEVERLIHHVKGKSYPFRGPFPPVWNPITYLDHNNFWRTMDDMGREIPSDAPWKAPLAEEWDNMTMKELLDKLCWTESAKQLATLFVNLCVTAETHEVSALWFLWYVKQCGGTTRIISTTNGGQERKFVGGSGQVSERIMDLLGDRVKLERPVIYIDQTRENVLVETLNHEMYEAKYVISAIPPTLGMKIHFNPPLPMMRNQMITRVPLGSVIKCIVYYKEPFWRKKDYCGTMIIDGEEAPVAYTLDDTKPEGNYAAIMGFILAHKARKLARLTKEERLKKLCELYAKVLGSLEALEPVHYEEKNWCEEQYSGGCYTTYFPPGILTQYGRVLRQPVDRIYFAGTETATHWSGYMEGAVEAGERAAREILHAMGKIPEDEIWQSEPESVDVPAQPITTTFLERHLPSVPGLLRLIGLTTIFSATALGFLAHKRGLLVRV,./data/raw/alphafold//AF-P27338-F1-model_v4.pdb,3455,2362,2533,5348
+1755,3587,3636,MEKSMVFHVLLVLQLCVHLQSEVQSLATPSEHDFSYSKSVVNATDLPQEEVYDYIVVGGGTAGCPLAATLSLNYSVLVLERGSFPTSYPNVLTQDGFIYNLQQEDDGETPVQRVMSEDGIPTVRGRILGGTSIINAGVYARASISFFSQSGVEWDMDLVNATYEWIEDTIVYKPNAFAWQTVTQQAFLEAGVLPDNGFSLDHVLGTRITGSTFDNNGTRHAADELLNKGDLDNLRVAVHANVEKILISSTFESNLSARGVIFKDSNGTSHRAYVRNQGEVILSAGTMGTPQLLLLSGVGPESYLSSLGIPVVIDHPYVGHFLYDNPRNFINILPPNPVEGSIVTALGIRNNFWQCSISGGPLTVPPYSFFPSQSYPLPNSTFVHIPNKVPGPLSHGFLTLNSSNDVTVGPNVIFNYYSNATDLAHCVSGMKQFGDLLRTDAFEPYKTQDLPGVEGFTFLGVPFPNNQTYDALETFCNDSLASYWHYHGGCIVGKVVDGGLRVRGIDALRVVDSSTFPVTPASHPTGFYLMLGRYMGLQILQERSPWAGISSA,sabio,B7VF77,CC(C)C=O.[C-]#N>>CC(C)[C@@H](O)C#N,110.0,0.5084284114638479,,4.0,4.1.2.10,32224.0,2.041392685158225,CC(C)C=O.[C-]#N,CC(C)[C@@H](O)C#N,2.041392685158225,CC(C)C=O.[C-]#N__MEKSMVFHVLLVLQLCVHLQSEVQSLATPSEHDFSYSKSVVNATDLPQEEVYDYIVVGGGTAGCPLAATLSLNYSVLVLERGSFPTSYPNVLTQDGFIYNLQQEDDGETPVQRVMSEDGIPTVRGRILGGTSIINAGVYARASISFFSQSGVEWDMDLVNATYEWIEDTIVYKPNAFAWQTVTQQAFLEAGVLPDNGFSLDHVLGTRITGSTFDNNGTRHAADELLNKGDLDNLRVAVHANVEKILISSTFESNLSARGVIFKDSNGTSHRAYVRNQGEVILSAGTMGTPQLLLLSGVGPESYLSSLGIPVVIDHPYVGHFLYDNPRNFINILPPNPVEGSIVTALGIRNNFWQCSISGGPLTVPPYSFFPSQSYPLPNSTFVHIPNKVPGPLSHGFLTLNSSNDVTVGPNVIFNYYSNATDLAHCVSGMKQFGDLLRTDAFEPYKTQDLPGVEGFTFLGVPFPNNQTYDALETFCNDSLASYWHYHGGCIVGKVVDGGLRVRGIDALRVVDSSTFPVTPASHPTGFYLMLGRYMGLQILQERSPWAGISSA,./data/raw/alphafold//AF-B7VF77-F1-model_v4.pdb,1007,543,199,216
+1756,1554,1582,MISVTLSQLTDILNGELQGADITLDAVTTDTRKLTPGCLFVALKGERFDAHDFADQAKAGGAGALLVSRPLDIDLPQLIVKDTRLAFGELAAWVRQQVPARVVALTGSSGKTSVKEMTAAILSQCGNTLYTAGNLNNDIGVPMTLLRLTPEYDYAVIELGANHQGEIAWTVSLTRPEAALVNNLAAAHLEGFGSLAGVAKAKGEIFSGLPENGIAIMNADNNDWLNWQSVIGSRKVWRFSPNAANSDFTATNIHVTSHGTEFTLQTPTGSVDVLLPLPGRHNIANALAAAALSMSVGATLDAIKAGLANLKAVPGRLFPIQLAENQLLLDDSYNANVGSMTAAVQVLAEMPGYRVLVVGDMAELGAESEACHVQVGEAAKAAGIDRVLSVGKQSHAISTASGVGEHFADKTALITRLKLLIAEQQVITILVKGSRSAAMEEVVRALQENGTC,sabio,P11880,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)NC(CCC(=O)NC(CCCC(N)C(=O)O)C(=O)O)C(=O)O.C[C@@H]([NH3+])C(=O)N[C@H](Cc1ccccc1)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,3300.0,54.70952156543808,37.0,8.6,6.3.2.10,562.0,3.5185139398778875,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)NC(CCC(=O)NC(CCCC(N)C(=O)O)C(=O)O)C(=O)O.C[C@@H]([NH3+])C(=O)N[C@H](Cc1ccccc1)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,3.5185139398778875,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)NC(CCC(=O)NC(CCCC(N)C(=O)O)C(=O)O)C(=O)O.C[C@@H]([NH3+])C(=O)N[C@H](Cc1ccccc1)C(=O)[O-].Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MISVTLSQLTDILNGELQGADITLDAVTTDTRKLTPGCLFVALKGERFDAHDFADQAKAGGAGALLVSRPLDIDLPQLIVKDTRLAFGELAAWVRQQVPARVVALTGSSGKTSVKEMTAAILSQCGNTLYTAGNLNNDIGVPMTLLRLTPEYDYAVIELGANHQGEIAWTVSLTRPEAALVNNLAAAHLEGFGSLAGVAKAKGEIFSGLPENGIAIMNADNNDWLNWQSVIGSRKVWRFSPNAANSDFTATNIHVTSHGTEFTLQTPTGSVDVLLPLPGRHNIANALAAAALSMSVGATLDAIKAGLANLKAVPGRLFPIQLAENQLLLDDSYNANVGSMTAAVQVLAEMPGYRVLVVGDMAELGAESEACHVQVGEAAKAAGIDRVLSVGKQSHAISTASGVGEHFADKTALITRLKLLIAEQQVITILVKGSRSAAMEEVVRALQENGTC,./data/raw/alphafold//AF-P11880-F1-model_v4.pdb,1400,908,707,1000
+1757,124,131,MSDFIASKEDDYSKWYLDIVQKAKLADYSPVKGCMVIMPYGYSIWSKIQSILDKKFKETGHENAYFPMLIPYSFLEREKDHIDGFSPEFAIIKDAGGESLAEPLVLRPTSETIIWNMYSKWIKSYRDLPLKINQWANVVRWEKRTRPFLRTTEFLWQEGHTAHATEEEALEETLLILDVYKRFIEDYLAIPVFCGKKSEKEKFAGAVSTYSIEALMQDKKALQAATSHYLGLNFAKAFDVKFQDKDGKMRHVFASSWGVSTRLIGALIMVHSDEKGLVLPPRIAPIEIIVIPIFKKEDEINKKILDYSDCVVDALKKAEFRVEIDKDVRSSPGFRFSSAEFKGIPIRLEVGINDVLLNSVTISRRDKDRKFKYQISLDSLISKVKVELDLMQKDLFQRALNFRILNTKEIFRSSKDSYETFKAYVNDYSGFVLSCWCGSLNCENIIKNETKATIRCIPDDFKARDLTGMTCIYCSSKAKYFVLFAKSY,sabio,O51363,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)C1O.NC(CS)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(OC(=O)C(N)CS)C2O)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,0.022,1.7677088761327944e-14,37.0,7.2,6.1.1.15,139.0,-1.6575773191777938,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)C1O.NC(CS)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(OC(=O)C(N)CS)C2O)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,-1.6575773191777938,*C1OC(CO)C(OP(=O)(O)OCC2OC(*)C(O)C2OP(=O)(O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)C1O.NC(CS)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MSDFIASKEDDYSKWYLDIVQKAKLADYSPVKGCMVIMPYGYSIWSKIQSILDKKFKETGHENAYFPMLIPYSFLEREKDHIDGFSPEFAIIKDAGGESLAEPLVLRPTSETIIWNMYSKWIKSYRDLPLKINQWANVVRWEKRTRPFLRTTEFLWQEGHTAHATEEEALEETLLILDVYKRFIEDYLAIPVFCGKKSEKEKFAGAVSTYSIEALMQDKKALQAATSHYLGLNFAKAFDVKFQDKDGKMRHVFASSWGVSTRLIGALIMVHSDEKGLVLPPRIAPIEIIVIPIFKKEDEINKKILDYSDCVVDALKKAEFRVEIDKDVRSSPGFRFSSAEFKGIPIRLEVGINDVLLNSVTISRRDKDRKFKYQISLDSLISKVKVELDLMQKDLFQRALNFRILNTKEIFRSSKDSYETFKAYVNDYSGFVLSCWCGSLNCENIIKNETKATIRCIPDDFKARDLTGMTCIYCSSKAKYFVLFAKSY,./data/raw/alphafold//AF-O51363-F1-model_v4.pdb,942,464,104,112
+1758,19994,20280,MTFLLLLLFCFLSPAISSAHSIPSTLDGPFVPVTVPLDTSLRGQAIDLPDTDPRVRRRVIGFEPEQISLSLSSDHDSIWVSWITGEFQIGKKVKPLDPTSINSVVQFGTLRHSLSHEAKGHSLVYSQLYPFDGLLNYTSGIIHHVRITGLKPSTIYYYRCGDPSRRAMSKIHHFRTMPVSSPSSYPGRIAVVGDLGLTYNTTDTISHLIHNSPDLILLIGDVSYANLYLTNGTSSDCYSCSFPETPIHETYQPRWDYWGRFMENLTSKVPLMVIEGNHEIELQAENKTFEAYSSRFAFPFNESGSSSTLYYSFNAGGIHFVMLGAYIAYDKSAEQYEWLKKDLAKVDRSVTPWLVASWHPPWYSSYTAHYREAECMKEAMEELLYSYGTDIVFNGHVHAYERSNRVYNYELDPCGPVYIVIGDGGNREKMAIEHADDPGKCPEPLTTPDPVMGGFCAWNFTPSDKFCWDRQPDYSALRESSFGHGILEMKNETWALWTWYRNQDSSSEVGDQIYIVRQPDRCPLHHRLVNHC,brenda,Q9SFU3,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1>>O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,161.9,0.0,37.0,4.5,3.1.3.2,3702.0,2.2092468487533736,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,2.2092468487533736,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MTFLLLLLFCFLSPAISSAHSIPSTLDGPFVPVTVPLDTSLRGQAIDLPDTDPRVRRRVIGFEPEQISLSLSSDHDSIWVSWITGEFQIGKKVKPLDPTSINSVVQFGTLRHSLSHEAKGHSLVYSQLYPFDGLLNYTSGIIHHVRITGLKPSTIYYYRCGDPSRRAMSKIHHFRTMPVSSPSSYPGRIAVVGDLGLTYNTTDTISHLIHNSPDLILLIGDVSYANLYLTNGTSSDCYSCSFPETPIHETYQPRWDYWGRFMENLTSKVPLMVIEGNHEIELQAENKTFEAYSSRFAFPFNESGSSSTLYYSFNAGGIHFVMLGAYIAYDKSAEQYEWLKKDLAKVDRSVTPWLVASWHPPWYSSYTAHYREAECMKEAMEELLYSYGTDIVFNGHVHAYERSNRVYNYELDPCGPVYIVIGDGGNREKMAIEHADDPGKCPEPLTTPDPVMGGFCAWNFTPSDKFCWDRQPDYSALRESSFGHGILEMKNETWALWTWYRNQDSSSEVGDQIYIVRQPDRCPLHHRLVNHC,./data/raw/alphafold//AF-Q9SFU3-F1-model_v4.pdb,1143,742,435,495
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+1786,5376,5462,MVTKRVQRMMFAAAACIPLLLGSAPLYAQTSAVQQKLAALEKSSGGRLGVALIDTADNTQVLYRGDERFPMCSTSKVMAAAAVLKQSETQKQLLNQPVEIKPADLVNYNPIAEKHVNGTMTLAELSAAALQYSDNTAMNKLIAQLGGPGGVTAFARAIGDETFRLDRTEPTLNTAIPGDPRDTTTPRAMAQTLRQLTLGHALGETQRAQLVTWLKGNTTGAASIRAGLPTSWTVGDKTGSGDYGTTNDIAVIWPQGRAPLVLVTYFTQPQQNAESRRDVLASAARIIAEGL,sabio,Q9L5C7,CC1(C)SC2C(NC(=O)Cc3ccccc3)C(=O)N2C1C(=O)O.O>>,48.0,99.71704412979751,30.0,7.0,3.5.2.6,562.0,1.6812412373755872,CC1(C)SC2C(NC(=O)Cc3ccccc3)C(=O)N2C1C(=O)O.O,,1.6812412373755872,CC1(C)SC2C(NC(=O)Cc3ccccc3)C(=O)N2C1C(=O)O.O__MVTKRVQRMMFAAAACIPLLLGSAPLYAQTSAVQQKLAALEKSSGGRLGVALIDTADNTQVLYRGDERFPMCSTSKVMAAAAVLKQSETQKQLLNQPVEIKPADLVNYNPIAEKHVNGTMTLAELSAAALQYSDNTAMNKLIAQLGGPGGVTAFARAIGDETFRLDRTEPTLNTAIPGDPRDTTTPRAMAQTLRQLTLGHALGETQRAQLVTWLKGNTTGAASIRAGLPTSWTVGDKTGSGDYGTTNDIAVIWPQGRAPLVLVTYFTQPQQNAESRRDVLASAARIIAEGL,./data/raw/alphafold//AF-Q9L5C7-F1-model_v4.pdb,1458,649,811,590
+1787,7522,7644,MGSNAPPPPTPHVVLVPFPGQGHVAPLMQLARLLHARGARVTFVYTQYNYRRLLRAKGEAAVRPPATSSARFRIEVIDDGLSLSVPQNDVGGLVDSLRKNCLHPFRALLRRLGQEVEGQDAPPVTCVVGDVVMTFAAAAAREAGIPEVQFFTASACGLLGYLHYGELVERGLVPFRDASLLADDDYLDTPLEWVPGMSHMRLRDMPTFCRTTDPDDVMVSATLQQMESAAGSKALILNTLYELEKDVVDALAAFFPPIYTVGPLAEVIASSDSASAGLAAMDISIWQEDTRCLSWLDGKPAGSVVYVNFGSMAVMTAAQAREFALGLASCGSPFLWVKRPDVVEGEEVLLPEALLDEVARGRGLVVPWCPQAAVLKHAAVGLFVSHCGWNSLLEATAAGQPVLAWPCHGEQTTNCRQLCEVWGNGAQLPREVESGAVARLVREMMVGDLGKEKRAKAAEWKAAAEAAARKGGASWRNVERVVNDLLLVGGKQ,sabio,Q9SBL1,CCCCCCO.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1>>CCCCCCOC1OC(CO)C(O)C(O)C1O.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,0.06,8.497040842957406e-15,30.0,7.5,2.4.1.85,4558.0,-1.2218487496163564,CCCCCCO.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1,CCCCCCOC1OC(CO)C(O)C(O)C1O.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,-1.2218487496163564,CCCCCCO.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1__MGSNAPPPPTPHVVLVPFPGQGHVAPLMQLARLLHARGARVTFVYTQYNYRRLLRAKGEAAVRPPATSSARFRIEVIDDGLSLSVPQNDVGGLVDSLRKNCLHPFRALLRRLGQEVEGQDAPPVTCVVGDVVMTFAAAAAREAGIPEVQFFTASACGLLGYLHYGELVERGLVPFRDASLLADDDYLDTPLEWVPGMSHMRLRDMPTFCRTTDPDDVMVSATLQQMESAAGSKALILNTLYELEKDVVDALAAFFPPIYTVGPLAEVIASSDSASAGLAAMDISIWQEDTRCLSWLDGKPAGSVVYVNFGSMAVMTAAQAREFALGLASCGSPFLWVKRPDVVEGEEVLLPEALLDEVARGRGLVVPWCPQAAVLKHAAVGLFVSHCGWNSLLEATAAGQPVLAWPCHGEQTTNCRQLCEVWGNGAQLPREVESGAVARLVREMMVGDLGKEKRAKAAEWKAAAEAAARKGGASWRNVERVVNDLLLVGGKQ,./data/raw/alphafold//AF-Q9SBL1-F1-model_v4.pdb,1087,657,339,383
+1788,3523,3572,MTNIRVAIVGYGNLGRSVEKLIAKQPDMDLVGIFSRRATLDTKTPVFDVADVDKHADDVDVLFLCMGSATDIPEQAPKFAQFACTVDTYDNHRDIPRHRQVMNEAATAAGNVALVSTGWDPGMFSINRVYAAAVLAEHQQHTFWGPGLSQGHSDALRRIPGVQKAVQYTLPSEDALEKARRGEAGDLTGKQTHKRQCFVVADAADHERIENDIRTMPDYFVGYEVEVNFIDEATFDSEHTGMPHGGHVITTGDTGGFNHTVEYILKLDRNPDFTASSQIAFGRAAHRMKQQGQSGAFTVLEVAPYLLSPENLDDLIARDV,brenda,P04964,CC(C)C(=O)C(=O)O.N.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+]>>CC(C)[C@@H](N)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)c1,0.27,1.0340700687945017,30.0,8.45,1.4.1.16,1718.0,-0.5686362358410126,CC(C)C(=O)C(=O)O.N.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+],CC(C)[C@@H](N)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,-0.5686362358410126,CC(C)C(=O)C(=O)O.N.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+]__MTNIRVAIVGYGNLGRSVEKLIAKQPDMDLVGIFSRRATLDTKTPVFDVADVDKHADDVDVLFLCMGSATDIPEQAPKFAQFACTVDTYDNHRDIPRHRQVMNEAATAAGNVALVSTGWDPGMFSINRVYAAAVLAEHQQHTFWGPGLSQGHSDALRRIPGVQKAVQYTLPSEDALEKARRGEAGDLTGKQTHKRQCFVVADAADHERIENDIRTMPDYFVGYEVEVNFIDEATFDSEHTGMPHGGHVITTGDTGGFNHTVEYILKLDRNPDFTASSQIAFGRAAHRMKQQGQSGAFTVLEVAPYLLSPENLDDLIARDV,./data/raw/alphafold//AF-P04964-F1-model_v4.pdb,1273,5226,1614,741
+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
+1792,20123,20412,MMGKIDEILSQLTIEEKVKLVVGVGLPGLFGNPHSRVAGAAGETHPVPRLGIPSFVLADGPAGLRINPTRENDENTYYTTAFPVEIMLASTWNKDLLEEVGKAMGEEVREYGVDVLLAPAMNIHRNPLCGRNFEYYSEDPVLSGEMASAFVKGVQSQGVGACIKHFVANNQETNRMVVDTIVSERALREIYLKGFEIAVKKARPWTVMSAYNKLNGKYCSQNEWLLKKVLREEWGFDGFVMSDWYAGDNPVEQLKAGNDMIMPGKAYQVNTERRDEIEEIMEALKEGRLSEEVLNECVRNILKVLVNAPSFKGYRYSNKPDLESHAKVAYEAGVEGVVLLENNGVLPFDESIHVAVFGTGQIETIKGGTGSGDTHPRYTISILEGIKERNMKFDEELTSIYEDYIKKMRETEEYKPRTDSWGTVIKPKLPENFLSEKEIKKAAKKNDAAVVVISRISGEGYDRKPVKGDFYLSDDELELIKTVSREFHEQGKKVVVLLNIGSPIEVASWRDLVDGILLVWQAGQEMGRIVADVLVGRVNPSGKLPTTFPKDYSDVPSWTFPGEPKDNPQRVVYEEDIYVGYRYYDTFGVEPAYEFGYGLSYTKFEYKDLKIAIDGDILRVSYTITNTGDRAGKEVSQVYVKAPKGKIDKPFQELKAFHKTKLLNPGESEKIFLEIPLRDLASFDGKEWVVESGEYEVRVGASSRDIRLRDIFLVEGEKRFKP,brenda,A5IL43,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[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](O)[C@@H]1O,26.89,0.0,90.0,5.0,3.2.1.21,93929.0,1.4295908022233017,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[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](O)[C@@H]1O,1.7112165243210902,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1__MMGKIDEILSQLTIEEKVKLVVGVGLPGLFGNPHSRVAGAAGETHPVPRLGIPSFVLADGPAGLRINPTRENDENTYYTTAFPVEIMLASTWNKDLLEEVGKAMGEEVREYGVDVLLAPAMNIHRNPLCGRNFEYYSEDPVLSGEMASAFVKGVQSQGVGACIKHFVANNQETNRMVVDTIVSERALREIYLKGFEIAVKKARPWTVMSAYNKLNGKYCSQNEWLLKKVLREEWGFDGFVMSDWYAGDNPVEQLKAGNDMIMPGKAYQVNTERRDEIEEIMEALKEGRLSEEVLNECVRNILKVLVNAPSFKGYRYSNKPDLESHAKVAYEAGVEGVVLLENNGVLPFDESIHVAVFGTGQIETIKGGTGSGDTHPRYTISILEGIKERNMKFDEELTSIYEDYIKKMRETEEYKPRTDSWGTVIKPKLPENFLSEKEIKKAAKKNDAAVVVISRISGEGYDRKPVKGDFYLSDDELELIKTVSREFHEQGKKVVVLLNIGSPIEVASWRDLVDGILLVWQAGQEMGRIVADVLVGRVNPSGKLPTTFPKDYSDVPSWTFPGEPKDNPQRVVYEEDIYVGYRYYDTFGVEPAYEFGYGLSYTKFEYKDLKIAIDGDILRVSYTITNTGDRAGKEVSQVYVKAPKGKIDKPFQELKAFHKTKLLNPGESEKIFLEIPLRDLASFDGKEWVVESGEYEVRVGASSRDIRLRDIFLVEGEKRFKP,./data/raw/alphafold//AF-A5IL43-F1-model_v4.pdb,431,3091,5368,6248
+1793,7746,7871,MFKLLSKLLVYLTASIMAIASPLAFSVDSSGEYPTVSEIPVGEVRLYQIADGVWSHIATRSFDGAVYPSNGLIVRDGDELLLIDTAWGAKNTAALLAEIEKQIGLPVTRAVSTHFHDDRVGGVDVLRAAGVATYASPSTRRLAEVEGSEIPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSASVLYGGCAIYELSRTSAGNVADADLAEWPTSIERIQQHYPEAQFVIPGHGLPGGLDLLKHTTNVVKAHTNRSVVE,sabio,Q8GCU7,CCN1CCN(C(=O)NC(C(=O)NC2C(=O)N3C2SC(C)(C)C3C(=O)O)c2ccccc2)C(=O)C1=O.O>>,328.0,99.81363415265972,30.0,,3.5.2.6,303.0,2.515873843711679,CCN1CCN(C(=O)NC(C(=O)NC2C(=O)N3C2SC(C)(C)C3C(=O)O)c2ccccc2)C(=O)C1=O.O,,2.515873843711679,CCN1CCN(C(=O)NC(C(=O)NC2C(=O)N3C2SC(C)(C)C3C(=O)O)c2ccccc2)C(=O)C1=O.O__MFKLLSKLLVYLTASIMAIASPLAFSVDSSGEYPTVSEIPVGEVRLYQIADGVWSHIATRSFDGAVYPSNGLIVRDGDELLLIDTAWGAKNTAALLAEIEKQIGLPVTRAVSTHFHDDRVGGVDVLRAAGVATYASPSTRRLAEVEGSEIPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSASVLYGGCAIYELSRTSAGNVADADLAEWPTSIERIQQHYPEAQFVIPGHGLPGGLDLLKHTTNVVKAHTNRSVVE,./data/raw/alphafold//AF-Q8GCU7-F1-model_v4.pdb,1446,972,778,1078
+1794,22860,23202,MMLSLRPYEFWFVTGSQHLYGEEALKQVEEHSMMIVNELNQDSVFPFPLVFKSVVTTPEEIRRVCLEANASEQCAGVITWMHTFSPAKMWIGGLLELRKPLLHLHTQFNRDIPWDSIDMDFMNLNQSAHGDREYGFIGARMGVARKVVVGHWEDPSVRERLAKWMRTAVAFAESRHLKVARFGDNMREVAVTEGDKVGAQIQFGWSVNGYGVGDLVQYIRDVSEQKINELLEEYAELYDIVPAGRQDGPVRESIREQARIELGLKAFLKDGNFAAFTTTFEDLHGMKQLPGLAVQRLMAEGYGFGGEGDWKTAALVRLMKVMADGKGTSFMEDYTYHFEPGNEMILGAHMLEVCPTIAATRPRIEVHPLSIGGKEDPARLVFDGGEGAAVNASLIDLGHRFRLIVNEVDAVKPEHDMPKLPVARILWKPRPSLRDSAEAWILAGGAHHTCFSFAVTTEQLQDFAEMAGIECVVINEHTSVSSFKNELRWNEVFWRGR,sabio,Q2VMT2,OC1COC(O)C(O)C1O>>OCC1(O)OCC(O)C1O,119.34,0.0,65.0,6.0,5.3.1.4,405212.0,2.076786033508079,OC1COC(O)C(O)C1O,OCC1(O)OCC(O)C1O,2.076786033508079,OC1COC(O)C(O)C1O__MMLSLRPYEFWFVTGSQHLYGEEALKQVEEHSMMIVNELNQDSVFPFPLVFKSVVTTPEEIRRVCLEANASEQCAGVITWMHTFSPAKMWIGGLLELRKPLLHLHTQFNRDIPWDSIDMDFMNLNQSAHGDREYGFIGARMGVARKVVVGHWEDPSVRERLAKWMRTAVAFAESRHLKVARFGDNMREVAVTEGDKVGAQIQFGWSVNGYGVGDLVQYIRDVSEQKINELLEEYAELYDIVPAGRQDGPVRESIREQARIELGLKAFLKDGNFAAFTTTFEDLHGMKQLPGLAVQRLMAEGYGFGGEGDWKTAALVRLMKVMADGKGTSFMEDYTYHFEPGNEMILGAHMLEVCPTIAATRPRIEVHPLSIGGKEDPARLVFDGGEGAAVNASLIDLGHRFRLIVNEVDAVKPEHDMPKLPVARILWKPRPSLRDSAEAWILAGGAHHTCFSFAVTTEQLQDFAEMAGIECVVINEHTSVSSFKNELRWNEVFWRGR,./data/raw/alphafold//AF-Q2VMT2-F1-model_v4.pdb,849,311,6077,6995
+1795,3029,3071,MIWKRKITLEALNAMGEGNMVGFLDIRFEHIGDDTLEATMPVDSRTKQPFGLLHGGASVVLAESIGSVAGYLCTEGEQKVVGLEINANHVRSAREGRVRGVCKPLHLGSRHQVWQIEIFDEKGRLCCSSRLTTAIL,brenda,P77781,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)c1cc(O)cc(O)c1.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)c1cc(O)cc(O)c1,12.6,0.0,25.0,7.0,3.1.2.28,562.0,1.100370545117563,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)c1cc(O)cc(O)c1.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)c1cc(O)cc(O)c1,1.100370545117563,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)c1cc(O)cc(O)c1.O__MIWKRKITLEALNAMGEGNMVGFLDIRFEHIGDDTLEATMPVDSRTKQPFGLLHGGASVVLAESIGSVAGYLCTEGEQKVVGLEINANHVRSAREGRVRGVCKPLHLGSRHQVWQIEIFDEKGRLCCSSRLTTAIL,./data/raw/alphafold//AF-P77781-F1-model_v4.pdb,1703,1322,6247,1592
+1796,16974,17204,MTDLEKPNLAGHMFDVGLIGGGISGLAAAKLLSEYKINVLVLEARDRVGGRTYTVRNEHVKWVDVGGAYVGPTQNRILRLSKELGIETYKVNVNERLVQYVKGKTYPFRGAFPPVWNPLAYLDYNNLWRTMDEMGKEIPVDAPWQARHAQEWDKMTMKDLIDKICWTKTAREFAYLFVNINVTSEPHEVSALWFLWYVRQCGGTARIFSVTNGGQERKFVGGSGQVSEQIMGLLGDKVKLSSPVTYIDQTDDNIIVETLNHEHYECKYVISAIPPILTAKIHFKPELPPERNQLIQRLPMGAVIKCMVYYKEAFWKKKDYCGCMIIEDEEAPIAITLDDTKPDGSLPAIMGFILARKADRQAKLHKDIRKRKICELYAKVLGSQEALYPVHYEEKNWCEEQYSGGCYTAYFPPGIMTQYGRVIRQPVGRIYFAGTETATQWSGYMEGAVEAGERAAREVLNALGKVAKKDIWVEEPESKDVPAIEITHTFLERNLPSVPGLLKITGVSTSVALLCFVLYKIKKLPC,sabio,P21396,NCCc1c[nH]c2ccccc12.O.O=O>>N.O=CCc1c[nH]c2ccccc12.OO,0.0126,1.3487071047441082e-14,30.0,,1.4.3.4,10116.0,-1.899629454882437,NCCc1c[nH]c2ccccc12.O.O=O,N.O=CCc1c[nH]c2ccccc12.OO,-1.899629454882437,NCCc1c[nH]c2ccccc12.O.O=O__MTDLEKPNLAGHMFDVGLIGGGISGLAAAKLLSEYKINVLVLEARDRVGGRTYTVRNEHVKWVDVGGAYVGPTQNRILRLSKELGIETYKVNVNERLVQYVKGKTYPFRGAFPPVWNPLAYLDYNNLWRTMDEMGKEIPVDAPWQARHAQEWDKMTMKDLIDKICWTKTAREFAYLFVNINVTSEPHEVSALWFLWYVRQCGGTARIFSVTNGGQERKFVGGSGQVSEQIMGLLGDKVKLSSPVTYIDQTDDNIIVETLNHEHYECKYVISAIPPILTAKIHFKPELPPERNQLIQRLPMGAVIKCMVYYKEAFWKKKDYCGCMIIEDEEAPIAITLDDTKPDGSLPAIMGFILARKADRQAKLHKDIRKRKICELYAKVLGSQEALYPVHYEEKNWCEEQYSGGCYTAYFPPGIMTQYGRVIRQPVGRIYFAGTETATQWSGYMEGAVEAGERAAREVLNALGKVAKKDIWVEEPESKDVPAIEITHTFLERNLPSVPGLLKITGVSTSVALLCFVLYKIKKLPC,./data/raw/alphafold//AF-P21396-F1-model_v4.pdb,3455,2362,2381,5283
+1797,14919,15128,MSSPIEVVNMSPADYRNRKVALITGITGQDGSYLAELLIEKGYQVHGIIRRSSSFNTGRIEHLYKDAHENPKMRLHHGDLTDSTCLVHIISKVLPTEIYNLGAQSHVKVSFDMSEYTADVDAVGTLRLLDAIRTCGLSHLVRFYQASTSELYGKVAEIPQSETTPFYPRSPYGVAKMYAYWITINYREAYDMYACNGILFNHESPRRGRTFVTRKITCAVASIHLGKQECLYLGNLDAKRDWGHARDYVEGMWRMLQQETAEDFVLATGEMHTVREFVEKSFKAIGSTIRWEGSAEEEVGLDEKGVIRVRVDPAYYRPTEVELLLGNPAKANEKLGWKRQVEFDALVEEMVKSDLIGVAAGDVFN,brenda,D3JU53,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>>C[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(O)nc(=N)[nH]c43)[C@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)C1=O.O,5.96,0.0,37.0,8.0,4.2.1.47,64518.0,0.7752462597402364,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,C[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(O)nc(=N)[nH]c43)[C@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)C1=O.O,0.7752462597402364,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__MSSPIEVVNMSPADYRNRKVALITGITGQDGSYLAELLIEKGYQVHGIIRRSSSFNTGRIEHLYKDAHENPKMRLHHGDLTDSTCLVHIISKVLPTEIYNLGAQSHVKVSFDMSEYTADVDAVGTLRLLDAIRTCGLSHLVRFYQASTSELYGKVAEIPQSETTPFYPRSPYGVAKMYAYWITINYREAYDMYACNGILFNHESPRRGRTFVTRKITCAVASIHLGKQECLYLGNLDAKRDWGHARDYVEGMWRMLQQETAEDFVLATGEMHTVREFVEKSFKAIGSTIRWEGSAEEEVGLDEKGVIRVRVDPAYYRPTEVELLLGNPAKANEKLGWKRQVEFDALVEEMVKSDLIGVAAGDVFN,./data/raw/alphafold//AF-D3JU53-F1-model_v4.pdb,2525,4962,2039,4894
+1798,1805,1836,MSKVNGVPNEIKASALDIIGETPLLALDRLHPGPGRILVKCEFMNPGASIKCRSSLHMIQEARAKGLLKPGQPVLEVTSGNQGCGLAIVCAIYGHPLTVTMSKGNSVQRAIHMEALGAKCIRVPQVEGTYGNVTINDVKAAEEEGLKIAEETGAYYVNQFNNEDNANSHYLTTGPEIWRQSGHRIDAFIATVGTAGTFAGTSRYLKEKNPDIKCFVVEPEGSQPIKGTPITKPLHLLQGSGYGCIPNLFNFETMDGTLSVTDEEAVEYRKLIGEKEGLYVGYTSGANVAAAVKLLKSGLIPEDAWVVTPLNDSGLKYTPVPDSLT,brenda,A0A0U3S5Y4,CC(=O)OC[C@H](N)C(=O)O.S>>CC(=O)O.N[C@@H](CS)C(=O)O,0.43,1.5640988498568633e-14,31.0,8.5,4.4.1.9,64459.0,-0.3665315444204134,CC(=O)OC[C@H](N)C(=O)O.S,CC(=O)O.N[C@@H](CS)C(=O)O,-0.3665315444204134,CC(=O)OC[C@H](N)C(=O)O.S__MSKVNGVPNEIKASALDIIGETPLLALDRLHPGPGRILVKCEFMNPGASIKCRSSLHMIQEARAKGLLKPGQPVLEVTSGNQGCGLAIVCAIYGHPLTVTMSKGNSVQRAIHMEALGAKCIRVPQVEGTYGNVTINDVKAAEEEGLKIAEETGAYYVNQFNNEDNANSHYLTTGPEIWRQSGHRIDAFIATVGTAGTFAGTSRYLKEKNPDIKCFVVEPEGSQPIKGTPITKPLHLLQGSGYGCIPNLFNFETMDGTLSVTDEEAVEYRKLIGEKEGLYVGYTSGANVAAAVKLLKSGLIPEDAWVVTPLNDSGLKYTPVPDSLT,./data/raw/alphafold//AF-A0A0U3S5Y4-F1-model_v4.pdb,1010,547,205,222
+1799,10753,10908,MDFPCLWLGLLLPLVAALDFNYHRQEGMEAFLKTVAQNYSSVTHLHSIGKSVKGRNLWVLVVGRFPKEHRIGIPEFKYVANMHGDETVGRELLLHLIDYLVTSDGKDPEITNLINSTRIHIMPSMNPDGFEAVKKPDCYYSIGRENYNQYDLNRNFPDAFEYNNVSRQPETVAVMKWLKTETFVLSANLHGGALVASYPFDNGVQATGALYSRSLTPDDDVFQYLAHTYASRNPNMKKGDECKNKMNFPNGVTNGYSWYPLQGGMQDYNYIWAQCFEITLELSCCKYPREEKLPSFWNNNKASLIEYIKQVHLGVKGQVFDQNGNPLPNVIVEVQDRKHICPYRTNKYGEYYLLLLPGSYIINVTVPGHDPHITKVIIPEKSQNFSALKKDILLPFQGQLDSIPVSNPSCPMIPLYRNLPDHSAATKPSLFLFLVSLLHIFFK,brenda,P14384,C[C@H](N=C(O)/C=C/c1ccco1)C(O)=N[C@@H](CCCCN)C(=O)O.O>>C[C@H](N=C(O)/C=C/c1ccco1)C(=O)O.NCCCC[C@H](N)C(=O)O,11.0,1.597214283609533e-14,37.0,7.2,3.4.17.12,9606.0,1.0413926851582251,C[C@H](N=C(O)/C=C/c1ccco1)C(O)=N[C@@H](CCCCN)C(=O)O.O,C[C@H](N=C(O)/C=C/c1ccco1)C(=O)O.NCCCC[C@H](N)C(=O)O,1.0413926851582251,C[C@H](N=C(O)/C=C/c1ccco1)C(O)=N[C@@H](CCCCN)C(=O)O.O__MDFPCLWLGLLLPLVAALDFNYHRQEGMEAFLKTVAQNYSSVTHLHSIGKSVKGRNLWVLVVGRFPKEHRIGIPEFKYVANMHGDETVGRELLLHLIDYLVTSDGKDPEITNLINSTRIHIMPSMNPDGFEAVKKPDCYYSIGRENYNQYDLNRNFPDAFEYNNVSRQPETVAVMKWLKTETFVLSANLHGGALVASYPFDNGVQATGALYSRSLTPDDDVFQYLAHTYASRNPNMKKGDECKNKMNFPNGVTNGYSWYPLQGGMQDYNYIWAQCFEITLELSCCKYPREEKLPSFWNNNKASLIEYIKQVHLGVKGQVFDQNGNPLPNVIVEVQDRKHICPYRTNKYGEYYLLLLPGSYIINVTVPGHDPHITKVIIPEKSQNFSALKKDILLPFQGQLDSIPVSNPSCPMIPLYRNLPDHSAATKPSLFLFLVSLLHIFFK,./data/raw/alphafold//AF-P14384-F1-model_v4.pdb,1855,1549,3131,1898
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+1810,4188,4241,MIVRCLSAARRLHRVGGSGILLRMTLGREAMSPLQAMSSYTVDGRNVLRWDLSPEQIKRRTEELIAQTKQVYDDIGMLDIEEVTYENCLQALADVEVKYIVERTMLDFPQHVSSDKEVRAASTEADKRLSRFDIEMSMREDIFLRIVRLKETCDLGKIKPEARRYLEKSVKMGKRNGLHLPEQVQNEIKAMKKRMSELCIDFNKNLNEDDTFLVFSKAELGALPDDFIDSLEKTDDNKYKITLKYPHYFPVMKKCCIPETRRKMEMAFNTRCKEENTIILQELLPLRAKVAKLLGYSTHADFVLEMNTAKSTHHVTAFLDDLSQKLKPLGEAEREFILNLKKKECEEKGFEYDGKINAWDLHYYMTQTEELKYSVDQEILKEYFPIEVVTEGLLNIYQELLGLSFEQVTDAHVWNKSVTLYTVKDKATGEVLGQFYLDLYPREGKYNHAACFGLQPGCLLPDGSRMMSVAALVVNFSQPRAGRPSLLRHDEVRTYFHEFGHVMHQICAQTDFARFSGTNVETDFVEVPSQMLENWVWDTDSLRRLSKHYKDGSPITDDLLEKLVASRLVNTGLLTLRQIVLSKVDQSLHTNTSLDAASEYAKYCTEILGVAATPGTNMPATFGHLAGGYDGQYYGYLWSEVFSMDMFYSCFKKEGIMNPEVGMKYRNLILKPGGSLDGMDMLQNFLKREPNQKAFLMSRGLHAP,uniprot_search,Q02038,CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=NC(CCCNC(=N)N)C(O)=N[C@@H](CCC(=O)O)C(O)=NC(CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.N=C(O)CC[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N)CCCNC(=N)N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],1.1,2.607705612184832e-14,37.0,7.4,3.4.24.16,9823.0,0.041392685158225,CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=NC(CCCNC(=N)N)C(O)=N[C@@H](CCC(=O)O)C(O)=NC(CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.N=C(O)CC[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N)CCCNC(=N)N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],0.041392685158225,CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=NC(CCCNC(=N)N)C(O)=N[C@@H](CCC(=O)O)C(O)=NC(CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MIVRCLSAARRLHRVGGSGILLRMTLGREAMSPLQAMSSYTVDGRNVLRWDLSPEQIKRRTEELIAQTKQVYDDIGMLDIEEVTYENCLQALADVEVKYIVERTMLDFPQHVSSDKEVRAASTEADKRLSRFDIEMSMREDIFLRIVRLKETCDLGKIKPEARRYLEKSVKMGKRNGLHLPEQVQNEIKAMKKRMSELCIDFNKNLNEDDTFLVFSKAELGALPDDFIDSLEKTDDNKYKITLKYPHYFPVMKKCCIPETRRKMEMAFNTRCKEENTIILQELLPLRAKVAKLLGYSTHADFVLEMNTAKSTHHVTAFLDDLSQKLKPLGEAEREFILNLKKKECEEKGFEYDGKINAWDLHYYMTQTEELKYSVDQEILKEYFPIEVVTEGLLNIYQELLGLSFEQVTDAHVWNKSVTLYTVKDKATGEVLGQFYLDLYPREGKYNHAACFGLQPGCLLPDGSRMMSVAALVVNFSQPRAGRPSLLRHDEVRTYFHEFGHVMHQICAQTDFARFSGTNVETDFVEVPSQMLENWVWDTDSLRRLSKHYKDGSPITDDLLEKLVASRLVNTGLLTLRQIVLSKVDQSLHTNTSLDAASEYAKYCTEILGVAATPGTNMPATFGHLAGGYDGQYYGYLWSEVFSMDMFYSCFKKEGIMNPEVGMKYRNLILKPGGSLDGMDMLQNFLKREPNQKAFLMSRGLHAP,./data/raw/alphafold//AF-Q02038-F1-model_v4.pdb,1820,1500,3201,1829
+1811,6036,6130,MAIPETQKGVIFYENGGELQYKDIPVPKPKPNELLINVKYSGVCHTDLHAWQGDWPLDTKLPLVGGHEGAGIVVAMGENVTGWEIGDYAGIKWLNGSCMSCEECELSNEPNCPKADLSGYTHDGSFQQYATADAVQAARIPKNVDLAEVAPILCAGVTVYKALKSAHIKAGDWVAISGACGGLGSLAIQYAKAMGYRVLGIDAGDEKAKLFKELGGEYFIDFTKTKDMVAEVIEATNGGAHAVINVSVSEAAISTSVLYTRSNGTVVLVGLPRDAQCKSDVFNQVVKSISIVGSYVGNRADTREALDFFSRGLVKAPIKILGLSELATVYDKMSKGQIIGRIVVDTSK,brenda,G3FFC9,CC=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+]>>CCO.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)c1,283.0,7.994776262513307e-15,34.75,6.5,1.1.1.1,4911.0,2.45178643552429,CC=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+],CCO.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)c1,2.45178643552429,CC=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+]__MAIPETQKGVIFYENGGELQYKDIPVPKPKPNELLINVKYSGVCHTDLHAWQGDWPLDTKLPLVGGHEGAGIVVAMGENVTGWEIGDYAGIKWLNGSCMSCEECELSNEPNCPKADLSGYTHDGSFQQYATADAVQAARIPKNVDLAEVAPILCAGVTVYKALKSAHIKAGDWVAISGACGGLGSLAIQYAKAMGYRVLGIDAGDEKAKLFKELGGEYFIDFTKTKDMVAEVIEATNGGAHAVINVSVSEAAISTSVLYTRSNGTVVLVGLPRDAQCKSDVFNQVVKSISIVGSYVGNRADTREALDFFSRGLVKAPIKILGLSELATVYDKMSKGQIIGRIVVDTSK,./data/raw/alphafold//AF-G3FFC9-F1-model_v4.pdb,3353,2005,3651,2492
+1812,11994,12157,MAPLLAAAMNHAAAHPGLRSHLVGPNNESFSRHHLPSSSPQSSKRRCNLSFTTRSARVGSQNGVQMLSPSEIPQRDWFPSDFTFGAATSAYQIEGAWNEDGKGESNWDHFCHNHPERILDGSNSDIGANSYHMYKTDVRLLKEMGMDAYRFSISWPRILPKGTKEGGINPDGIKYYRNLINLLLENGIEPYVTIFHWDVPQALEEKYGGFLDKSHKSIVEDYTYFAKVCFDNFGDKVKNWLTFNEPQTFTSFSYGTGVFAPGRCSPGLDCAYPTGNSLVEPYTAGHNILLAHAEAVDLYNKHYKRDDTRIGLAFDVMGRVPYGTSFLDKQAEERSWDINLGWFLEPVVRGDYPFSMRSLARERLPFFKDEQKEKLAGSYNMLGLNYYTSRFSKNIDISPNYSPVLNTDDAYASQEVNGPDGKPIGPPMGNPWIYMYPEGLKDLLMIMKNKYGNPPIYITENGIGDVDTKETPLPMEAALNDYKRLDYIQRHIATLKESIDLGSNVQGYFAWSLLDNFEWFAGFTERYGIVYVDRNNNCTRYMKESAKWLKEFNTAKKPSKKILTPA,brenda,P49235,Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12.O>>Cc1cc(=O)oc2cc(O)ccc12.OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O,53.8,0.0,37.0,5.8,3.2.1.21,4577.0,1.730782275666389,Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12.O,Cc1cc(=O)oc2cc(O)ccc12.OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O,1.730782275666389,Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12.O__MAPLLAAAMNHAAAHPGLRSHLVGPNNESFSRHHLPSSSPQSSKRRCNLSFTTRSARVGSQNGVQMLSPSEIPQRDWFPSDFTFGAATSAYQIEGAWNEDGKGESNWDHFCHNHPERILDGSNSDIGANSYHMYKTDVRLLKEMGMDAYRFSISWPRILPKGTKEGGINPDGIKYYRNLINLLLENGIEPYVTIFHWDVPQALEEKYGGFLDKSHKSIVEDYTYFAKVCFDNFGDKVKNWLTFNEPQTFTSFSYGTGVFAPGRCSPGLDCAYPTGNSLVEPYTAGHNILLAHAEAVDLYNKHYKRDDTRIGLAFDVMGRVPYGTSFLDKQAEERSWDINLGWFLEPVVRGDYPFSMRSLARERLPFFKDEQKEKLAGSYNMLGLNYYTSRFSKNIDISPNYSPVLNTDDAYASQEVNGPDGKPIGPPMGNPWIYMYPEGLKDLLMIMKNKYGNPPIYITENGIGDVDTKETPLPMEAALNDYKRLDYIQRHIATLKESIDLGSNVQGYFAWSLLDNFEWFAGFTERYGIVYVDRNNNCTRYMKESAKWLKEFNTAKKPSKKILTPA,./data/raw/alphafold//AF-P49235-F1-model_v4.pdb,1219,4325,1312,3266
+1813,9242,9384,MFKTTLCTLLITASCSTFAAPQQINDIVHRTITPLIEQQKIPGMAVAVIYQGKPYYFTWGYADIAKKQPVTQQTLFELGSVSKTFTGVLGGDAIARGEIKLSDPTTKYWPELTAKQWNGITLLHLATYTAGGLPLQVPDEVKSSSDLLRFYQNWQPAWAPGTQRLYANSSIGLFGALAVKPSGLSFEQAMKTRVFQPLKLNHTWINVPSAEEKNYAWGYREGKAVHVSPRALDAEAYGVKSTIEDMARWVQSNLKPLDINEKTLQQGIQLAQSRYWQTGDMYQGLGWEMLDWPVNPDIIINNKIALAARPVKPITPPTPAVRASWVHKTGATGGFGSYVAFIPEKELGIVMLANKNYPNPARVAAAWQILNALQ,brenda,Q76DI4,CO[C@@]1(N=C(O)Cc2cccs2)C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@@H]21.O>>,0.043,99.77602329357748,37.0,7.0,3.5.2.6,562.0,-1.3665315444204136,CO[C@@]1(N=C(O)Cc2cccs2)C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@@H]21.O,,-1.3665315444204136,CO[C@@]1(N=C(O)Cc2cccs2)C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@@H]21.O__MFKTTLCTLLITASCSTFAAPQQINDIVHRTITPLIEQQKIPGMAVAVIYQGKPYYFTWGYADIAKKQPVTQQTLFELGSVSKTFTGVLGGDAIARGEIKLSDPTTKYWPELTAKQWNGITLLHLATYTAGGLPLQVPDEVKSSSDLLRFYQNWQPAWAPGTQRLYANSSIGLFGALAVKPSGLSFEQAMKTRVFQPLKLNHTWINVPSAEEKNYAWGYREGKAVHVSPRALDAEAYGVKSTIEDMARWVQSNLKPLDINEKTLQQGIQLAQSRYWQTGDMYQGLGWEMLDWPVNPDIIINNKIALAARPVKPITPPTPAVRASWVHKTGATGGFGSYVAFIPEKELGIVMLANKNYPNPARVAAAWQILNALQ,./data/raw/alphafold//AF-Q76DI4-F1-model_v4.pdb,1456,965,6261,1606
+1814,6599,6712,MNDFLLLLLVLFLGVPRSENHVINLEECFQEPEYENWLATASHGLTKTLNPKKIVIVGAGISGLTAAKLFREAGHEVVILEASDRVGGRIKTHREDGWYVDVGPMRVPQTHRIVREYIKKFNISLNPFRQTDENAWYLIKHVRQKMSANNPENFGYQLNPNERGKSASQLFDETLDKVTDDCTLQKEKYDSFSTKEYLIKEGKLSTGAVEMIGDFLNEEAGFHNSFLISVMDHFLFLNNSFDEITGGFDQLPERFFKDMDSIVHLNSTVEKIVHINNKVTVFYEGLSTNMRLVADYVLITATARATRLIKFVPPLSIPKTRALRSLIYASATKIILVCTDKFWEKDGIHGGRSITDLPSRVIYYPNHDFTNGIGVLLASYTWYSDSEFYTTLSDEKCVDVVMDDLVEIHNVSKDYLKSVCGKHVVQKWALDQYSMGAFSTYTPYQITHYSQMLAQNEGRIYFAGEYTAHPHGWIETSMKSAIREAINIHNA,sabio,P81383,CCCC(N)C(=O)O.O.O=O>>CCCC(=O)C(=O)O.N.OO,59.5,8.475945339227374e-15,25.0,8.5,1.4.3.2,8665.0,1.7745169657285496,CCCC(N)C(=O)O.O.O=O,CCCC(=O)C(=O)O.N.OO,1.7745169657285496,CCCC(N)C(=O)O.O.O=O__MNDFLLLLLVLFLGVPRSENHVINLEECFQEPEYENWLATASHGLTKTLNPKKIVIVGAGISGLTAAKLFREAGHEVVILEASDRVGGRIKTHREDGWYVDVGPMRVPQTHRIVREYIKKFNISLNPFRQTDENAWYLIKHVRQKMSANNPENFGYQLNPNERGKSASQLFDETLDKVTDDCTLQKEKYDSFSTKEYLIKEGKLSTGAVEMIGDFLNEEAGFHNSFLISVMDHFLFLNNSFDEITGGFDQLPERFFKDMDSIVHLNSTVEKIVHINNKVTVFYEGLSTNMRLVADYVLITATARATRLIKFVPPLSIPKTRALRSLIYASATKIILVCTDKFWEKDGIHGGRSITDLPSRVIYYPNHDFTNGIGVLLASYTWYSDSEFYTTLSDEKCVDVVMDDLVEIHNVSKDYLKSVCGKHVVQKWALDQYSMGAFSTYTPYQITHYSQMLAQNEGRIYFAGEYTAHPHGWIETSMKSAIREAINIHNA,./data/raw/alphafold//AF-P81383-F1-model_v4.pdb,1381,886,683,972
+1815,9854,10003,MSMAEGDTLISVDYEIFGKVQGVFFRKYTQAEGKKLGLVGWVQNTDQGTVQGQLQGPASKVRHMQEWLETKGSPKSHIDRASFHNEKVIVKLDYTDFQIVK,sabio,P41500,COc1ccccc1C(=O)OP(=O)(OC(=O)c1ccccc1OC)OC(=O)c1ccccc1OC.O>>COc1ccccc1C(=O)O.O=P(O)(O)O,1457.0,34.86019174742776,,,3.6.1.7,9913.0,3.16345955176999,COc1ccccc1C(=O)OP(=O)(OC(=O)c1ccccc1OC)OC(=O)c1ccccc1OC.O,COc1ccccc1C(=O)O.O=P(O)(O)O,3.16345955176999,COc1ccccc1C(=O)OP(=O)(OC(=O)c1ccccc1OC)OC(=O)c1ccccc1OC.O__MSMAEGDTLISVDYEIFGKVQGVFFRKYTQAEGKKLGLVGWVQNTDQGTVQGQLQGPASKVRHMQEWLETKGSPKSHIDRASFHNEKVIVKLDYTDFQIVK,./data/raw/alphafold//AF-P41500-F1-model_v4.pdb,1471,1011,832,1153
+1816,12117,12280,MARSITMQQRIEFGDCDPAGIVWFPNYHRWLDAASRNYFIKCGLPPWRQTVVERGIVGTPIVSCNASFVCTASYDDVLTIETCIKEWRRKSFVQRHSVSRTTPGGDVQLVMRADEIRVFAMNDGERLRAIEVPADYIELCS,brenda,P56653,Cc1ccc(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)cc1.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.Cc1ccc(C(=O)[O-])cc1,0.047,0.0557715226621502,25.0,7.5,3.1.2.23,306.0,-1.3279021420642825,Cc1ccc(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)cc1.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.Cc1ccc(C(=O)[O-])cc1,-1.3279021420642825,Cc1ccc(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)cc1.O__MARSITMQQRIEFGDCDPAGIVWFPNYHRWLDAASRNYFIKCGLPPWRQTVVERGIVGTPIVSCNASFVCTASYDDVLTIETCIKEWRRKSFVQRHSVSRTTPGGDVQLVMRADEIRVFAMNDGERLRAIEVPADYIELCS,./data/raw/alphafold//AF-P56653-F1-model_v4.pdb,1647,1251,1733,1467
+1817,20428,20733,MRSSPVLLLVIALVAAAHLAPLECDGPNPNPEIGNTGGLSRQGFPAGFVFGTAASAYQVEGMARQGGRGPCIWDAFVAIPGMIAGNGTADVTVDEYHRYKEDVGIMKNMGFDAYRFSIIWSRIFPDGTGKVNQEGVDYYNRLIDYMLQQGITPYANLYHYDLPLALHQQYLGWLSPKIVGAFADYAEFCFKVFGDRVKNWFTFNEPRVVAALGYDNGFHAPGRCSKCPAGGDSRTEPYIVTHNIILSHAAAVQRYREKYQPHQKGRIGILLDFVWYEPHSDSNADQAAAQRARDFHIGWFLDPITNGRYPSSMLKIVGNRLPGFSADESRMVKGSIDYVGINQYTSYYMKDPGAWNQTPVSYQDDWHVGFVYERNGVPIGPRANSDWLYIVPWGMNKAVTYVKERYGNPTMILSENGMDQPGNVSIADGVHDTVRIRYYRDYITELKKAIDNGARVAGYFAWSLLDNFEWRLGYTARFGIVYVDFNTLKRYPKDSALWFKNMLSEKKRS,sabio,B5A496,O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O>>OCC1OC(O)C(O)C(O)C1O,16.1,33.2717722930995,30.0,4.0,3.2.1.25,4513.0,1.2068258760318498,O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O,OCC1OC(O)C(O)C(O)C1O,1.2068258760318498,O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O__MRSSPVLLLVIALVAAAHLAPLECDGPNPNPEIGNTGGLSRQGFPAGFVFGTAASAYQVEGMARQGGRGPCIWDAFVAIPGMIAGNGTADVTVDEYHRYKEDVGIMKNMGFDAYRFSIIWSRIFPDGTGKVNQEGVDYYNRLIDYMLQQGITPYANLYHYDLPLALHQQYLGWLSPKIVGAFADYAEFCFKVFGDRVKNWFTFNEPRVVAALGYDNGFHAPGRCSKCPAGGDSRTEPYIVTHNIILSHAAAVQRYREKYQPHQKGRIGILLDFVWYEPHSDSNADQAAAQRARDFHIGWFLDPITNGRYPSSMLKIVGNRLPGFSADESRMVKGSIDYVGINQYTSYYMKDPGAWNQTPVSYQDDWHVGFVYERNGVPIGPRANSDWLYIVPWGMNKAVTYVKERYGNPTMILSENGMDQPGNVSIADGVHDTVRIRYYRDYITELKKAIDNGARVAGYFAWSLLDNFEWRLGYTARFGIVYVDFNTLKRYPKDSALWFKNMLSEKKRS,./data/raw/alphafold//AF-B5A496-F1-model_v4.pdb,1219,623,296,327
+1818,11351,11507,MNSKCHCVILNDGNFIPVLGFGTALPLECPKSKAKELTKIAIDAGFHHFDSASVYNTEDHVGEAIRSKIADGTVRREDIFYTSKVWCTSLHPELVRASLERSLQKLQFDYVDLYLIHYPMALKPGEENFPVDEHGKLIFDRVDLCATWEAMEKCKDAGLTKSIGVSNFNYRQLEMILNKPGLKYKPVCNQVECHPYLNQMKLLDFCKSKDIVLVAYGVLGTQRYGGWVDQNSPVLLDEPVLGSMAKKYNRTPALIALRYQLQRGIVVLNTSLKEERIKENMQVFEFQLSSEDMKVLDGLNRNMRYIPAAIFKGHPNWPFLDEY,sabio,Q91WR5,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CC[C@H]2O.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(=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],318.0,15.421790976835704,25.0,7.0,1.1.1.209,10090.0,2.502427119984433,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CC[C@H]2O.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(=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],2.6589648426644352,C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1CC[C@H]2O.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__MNSKCHCVILNDGNFIPVLGFGTALPLECPKSKAKELTKIAIDAGFHHFDSASVYNTEDHVGEAIRSKIADGTVRREDIFYTSKVWCTSLHPELVRASLERSLQKLQFDYVDLYLIHYPMALKPGEENFPVDEHGKLIFDRVDLCATWEAMEKCKDAGLTKSIGVSNFNYRQLEMILNKPGLKYKPVCNQVECHPYLNQMKLLDFCKSKDIVLVAYGVLGTQRYGGWVDQNSPVLLDEPVLGSMAKKYNRTPALIALRYQLQRGIVVLNTSLKEERIKENMQVFEFQLSSEDMKVLDGLNRNMRYIPAAIFKGHPNWPFLDEY,./data/raw/alphafold//AF-Q91WR5-F1-model_v4.pdb,1329,1150,6214,878
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+1820,2683,2718,MEGKVYHFRVKFGDTDAAGIVFYPNYYKWMDEACHHFLTELGFPTSELIDKKIGFPIVEATCQFKAPLLFADHVFIRTSIRELKDKSFILEHHFIKQGRVIASGHEKRVWANFSNGKLAVCPIPSSVRVAFANIGTCE,sabio,Q9KBC9,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.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.O=C(O)c1ccccc1,0.068,0.0,25.0,7.5,3.1.2.23,86665.0,-1.1674910872937636,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.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.O=C(O)c1ccccc1,-1.1674910872937636,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.O__MEGKVYHFRVKFGDTDAAGIVFYPNYYKWMDEACHHFLTELGFPTSELIDKKIGFPIVEATCQFKAPLLFADHVFIRTSIRELKDKSFILEHHFIKQGRVIASGHEKRVWANFSNGKLAVCPIPSSVRVAFANIGTCE,./data/raw/alphafold//AF-Q9KBC9-F1-model_v4.pdb,1646,1250,1732,1466
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+1828,14614,14820,MVRESIPKEGENIKIQSYKHDGKIHRVWSETTILKGTDHVVIGGNDHTLVTESDGRTWITREPAIVYFHSEYWFNVICMFREDGIYYYCNLSSPFVCDEEALKYIDYDLDIKVYPNGKYHLLDEDEYEQHMNQMNYPHDIDIILRRNVDILQQWIEQKKGPFAPDFIKVWKERYKKIRQY,brenda,Q7A4T2,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O>>N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O=P(O)(O)O,0.763,0.0,26.0,7.5,3.6.1.6,1280.0,-0.1174754620451195,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O=P(O)(O)O,-0.1174754620451195,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O__MVRESIPKEGENIKIQSYKHDGKIHRVWSETTILKGTDHVVIGGNDHTLVTESDGRTWITREPAIVYFHSEYWFNVICMFREDGIYYYCNLSSPFVCDEEALKYIDYDLDIKVYPNGKYHLLDEDEYEQHMNQMNYPHDIDIILRRNVDILQQWIEQKKGPFAPDFIKVWKERYKKIRQY,./data/raw/alphafold//AF-Q7A4T2-F1-model_v4.pdb,2058,4228,4102,3951
+1829,18493,18756,MTSKKLVNSVAGCADDALAGLVACNPNLQLLQGHRVALRSDLDSLKGRVALLSGGGSGHEPAHAGFIGKGMLTGVIAGAVFTSPAVGSILAAIRAVAQAGTVGTLLIVKNYTGDRLNFGLAREQARAEGIPVEMVVIGDDSAFTVLKKAGRRGLCGTVLIHKVAGALAEAGVGLEEIAKQVNVVAKAMGTLGVSLSSCSVPGSKPTFELSADEVELGLGIHGEAGVRRIKMATADEIVKLMLDHMTNTTNASHVPVQPGSSVVMMVNNLGGLSFLELGIIADATVRSLEGRGVKIARALVGTFMSALEMPGISLTLLLVDEPLLKLIDAETTAAAWPNVAAVSITGRKRSRVAPAEPQEAPDSTAAGGSASKRMALVLERVCSTLLGLEEHLNALDRAAGDGDCGTTHSRAARAIQEWLKEGPPPASPAQLLSKLSVLLLEKMGGSSGALYGLFLTAAAQPLKAKTSLPAWSAAMDAGLEAMQKYGKAAPGDRTMLDSLWAAGQELQAWKSPGADLLQVLTKAVKSAEAAAEATKNMEAGAGRASYISSARLEQPDPGAVAAAAILRAILEVLQS,brenda,Q3LXA3,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(CO)CO>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(CO)COP(=O)(O)O,5.0,9.509404921842883e-15,37.0,7.5,2.7.1.28,9606.0,0.6989700043360189,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(CO)CO,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(CO)COP(=O)(O)O,0.6989700043360189,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(CO)CO__MTSKKLVNSVAGCADDALAGLVACNPNLQLLQGHRVALRSDLDSLKGRVALLSGGGSGHEPAHAGFIGKGMLTGVIAGAVFTSPAVGSILAAIRAVAQAGTVGTLLIVKNYTGDRLNFGLAREQARAEGIPVEMVVIGDDSAFTVLKKAGRRGLCGTVLIHKVAGALAEAGVGLEEIAKQVNVVAKAMGTLGVSLSSCSVPGSKPTFELSADEVELGLGIHGEAGVRRIKMATADEIVKLMLDHMTNTTNASHVPVQPGSSVVMMVNNLGGLSFLELGIIADATVRSLEGRGVKIARALVGTFMSALEMPGISLTLLLVDEPLLKLIDAETTAAAWPNVAAVSITGRKRSRVAPAEPQEAPDSTAAGGSASKRMALVLERVCSTLLGLEEHLNALDRAAGDGDCGTTHSRAARAIQEWLKEGPPPASPAQLLSKLSVLLLEKMGGSSGALYGLFLTAAAQPLKAKTSLPAWSAAMDAGLEAMQKYGKAAPGDRTMLDSLWAAGQELQAWKSPGADLLQVLTKAVKSAEAAAEATKNMEAGAGRASYISSARLEQPDPGAVAAAAILRAILEVLQS,./data/raw/alphafold//AF-Q3LXA3-F1-model_v4.pdb,122,2612,2912,5760
+1830,13485,13662,MEVGFLGLGIMGKAMSMNLLRHGFKVTVWNRTLSKSHELVEHGASVAETPAEVVRKCKYTIAMLSDPSAALSVVFGKDGILEQICAGKSYVDMSTVDADTSSKINEAIKERGGYFLEAPVSGSKKPAEDGQLVILAAGEKALYEEVIPAFNVMGKKSFYLGQVGNGAKMKLVVNMIMGSMMNAFSEGLVLAGRSGLEPSVLLDVLDLGGIANPMFRLKGPTMIQGSHSPAFPLKHQQKDMRLALALGDETATSMPVAAAANEAFKKARSMGLGDLDFSAVYETVKTLEEPSRNSQLR,brenda,A0A1C8M582,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=CC(=O)O.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O=C(O)CO,30.9,0.0,25.0,7.5,1.1.1.79,3750.0,1.4899584794248346,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=CC(=O)O.[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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O=C(O)CO,1.4899584794248346,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=CC(=O)O.[H+]__MEVGFLGLGIMGKAMSMNLLRHGFKVTVWNRTLSKSHELVEHGASVAETPAEVVRKCKYTIAMLSDPSAALSVVFGKDGILEQICAGKSYVDMSTVDADTSSKINEAIKERGGYFLEAPVSGSKKPAEDGQLVILAAGEKALYEEVIPAFNVMGKKSFYLGQVGNGAKMKLVVNMIMGSMMNAFSEGLVLAGRSGLEPSVLLDVLDLGGIANPMFRLKGPTMIQGSHSPAFPLKHQQKDMRLALALGDETATSMPVAAAANEAFKKARSMGLGDLDFSAVYETVKTLEEPSRNSQLR,./data/raw/alphafold//AF-A0A1C8M582-F1-model_v4.pdb,3782,4582,4517,4422
+1831,13525,13702,MELFLAGRRVLVTGAGKGIGRGTVQALHATGARVVAVSRTQADLDSLVRECPGIEPVCVDLGDWEATERALGSVGPVDLLVNNAAVALLQPFLEVTKEAFDRSFEVNLRAVIQVSQIVARGLIARGVPGAIVNVSSQCSQRAVTNHSVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTSMGQATWSDPHKAKTMLNRIPLGKFAEVEHVVNAILFLLSDRSGMTTGSTLPVEGGFWAC,brenda,Q7Z4W1,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[C@H](O)[C@@H](O)CO>>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.OC[C@H](O)[C@@H](O)CO,0.52,0.0581628166497942,25.0,7.0,1.1.1.10,9606.0,-0.2839966563652008,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[C@H](O)[C@@H](O)CO,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.OC[C@H](O)[C@@H](O)CO,-0.2839966563652008,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[C@H](O)[C@@H](O)CO__MELFLAGRRVLVTGAGKGIGRGTVQALHATGARVVAVSRTQADLDSLVRECPGIEPVCVDLGDWEATERALGSVGPVDLLVNNAAVALLQPFLEVTKEAFDRSFEVNLRAVIQVSQIVARGLIARGVPGAIVNVSSQCSQRAVTNHSVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTSMGQATWSDPHKAKTMLNRIPLGKFAEVEHVVNAILFLLSDRSGMTTGSTLPVEGGFWAC,./data/raw/alphafold//AF-Q7Z4W1-F1-model_v4.pdb,1316,3874,6191,849
+1832,9472,9614,MTFTRRQVLGGIAGLAVLGLGAGGARLWLARPEVAAEHDYELIAAPLDLELVSGHKTPGLGYGGQAPGVEIRARQGDWLRVRFTNKLDEPTTIHWHGIRLPIEMDGVPYISQPPVQPGESFVYQFKTPDAGSYWYHPHLMSSEQLGRGLVGPLIIDEREPSEFTREKILCLKTWHVDEEGNFTPFSVPREAAREGTRGRLSTINGERTPVIELPAGEIVRVRILNVDNTVTYRLNLPGAEAKIYAIDGHPVEPRDFGKGPNDQYWIGPGMRLELGIRGPAEGAELSLRNGPVRLATIRGVANTKAPTAQWPAPLPHNPVAEPDLKNAETINFKFEWVGAISDYSKGQSVPSLWQINGVAWQGGEGHKHNAPPLAKLKEGNSYIFVLRNMTQYQHPIHLHGMAFKVLDSDRRDIIPYFTDTYLLGKNETARVALVADNPGLWMFHCHVIDHMETGLMGTIAVGEAWCG,sabio,A0A0K1P839,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O>>O,0.031,90.9985682302694,60.0,7.5,1.10.3.2,306.0,-1.5086383061657274,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O,O,-1.5086383061657274,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O__MTFTRRQVLGGIAGLAVLGLGAGGARLWLARPEVAAEHDYELIAAPLDLELVSGHKTPGLGYGGQAPGVEIRARQGDWLRVRFTNKLDEPTTIHWHGIRLPIEMDGVPYISQPPVQPGESFVYQFKTPDAGSYWYHPHLMSSEQLGRGLVGPLIIDEREPSEFTREKILCLKTWHVDEEGNFTPFSVPREAAREGTRGRLSTINGERTPVIELPAGEIVRVRILNVDNTVTYRLNLPGAEAKIYAIDGHPVEPRDFGKGPNDQYWIGPGMRLELGIRGPAEGAELSLRNGPVRLATIRGVANTKAPTAQWPAPLPHNPVAEPDLKNAETINFKFEWVGAISDYSKGQSVPSLWQINGVAWQGGEGHKHNAPPLAKLKEGNSYIFVLRNMTQYQHPIHLHGMAFKVLDSDRRDIIPYFTDTYLLGKNETARVALVADNPGLWMFHCHVIDHMETGLMGTIAVGEAWCG,./data/raw/alphafold//AF-A0A0K1P839-F1-model_v4.pdb,3415,2307,1017,2912
+1833,9431,9573,MMKSFFSAAALLLGLVAPSAVLAAPSLPGVPREVTRDLLRPVEERQSSCHTAANRACWAPGFDINTDYEVSTPNTGVTRTYTLTLTEVDNWLGPDGVVKQKVMLVNGDIFGPTITANWGDWIQVNVINNLRTNGTSIHWHGLHQKGTNMHDGANGVTECPIPPKGGSRIYRFRAQQYGTSWYHSHFSAQYGNGVVGTIVVNGPASVPYDIDLGVFPITDYYHKPADVLVEETMNGGPPPSDTVLFKGHGKNPQTGAGKFANVTLTPGKRHRLRIINTSTHDHFQLKLQNHTMTIIAADMVPVQAQTVDSLFLAVGQRYDVTIDANKSVGNYWFNATFGGGLACGASLNPHPAAVFRYQGAPNTLPTNIGTPAADANCMDLNNLTPVVSRSVPTSGFTPRPNNTLPVSLTLGGTPLFVWKVNGSSINVDWDKPIVDYVIAQNTSYPPQANVITVNSVNQWTYWLIENDPTGPFSIPHPMHLHGHDFLVVGRSPDQPAGVPQTRYRFNPATDMALLKSSNPVRRDVAMLPANGWLLIAFKSDNPGAWLFHCHIAWHVSGGLSVQYLERPNDLRNGFSQADKNQHNNNCNAWRAYWPTNPFPKIDSGLKVKKWVGEHPDWYIKN,uniprot_search,P78722,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O>>,1.29,99.73641273548226,37.0,6.2,1.10.3.2,2587412.0,0.1105897102992489,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O,,0.1105897102992489,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O__MMKSFFSAAALLLGLVAPSAVLAAPSLPGVPREVTRDLLRPVEERQSSCHTAANRACWAPGFDINTDYEVSTPNTGVTRTYTLTLTEVDNWLGPDGVVKQKVMLVNGDIFGPTITANWGDWIQVNVINNLRTNGTSIHWHGLHQKGTNMHDGANGVTECPIPPKGGSRIYRFRAQQYGTSWYHSHFSAQYGNGVVGTIVVNGPASVPYDIDLGVFPITDYYHKPADVLVEETMNGGPPPSDTVLFKGHGKNPQTGAGKFANVTLTPGKRHRLRIINTSTHDHFQLKLQNHTMTIIAADMVPVQAQTVDSLFLAVGQRYDVTIDANKSVGNYWFNATFGGGLACGASLNPHPAAVFRYQGAPNTLPTNIGTPAADANCMDLNNLTPVVSRSVPTSGFTPRPNNTLPVSLTLGGTPLFVWKVNGSSINVDWDKPIVDYVIAQNTSYPPQANVITVNSVNQWTYWLIENDPTGPFSIPHPMHLHGHDFLVVGRSPDQPAGVPQTRYRFNPATDMALLKSSNPVRRDVAMLPANGWLLIAFKSDNPGAWLFHCHIAWHVSGGLSVQYLERPNDLRNGFSQADKNQHNNNCNAWRAYWPTNPFPKIDSGLKVKKWVGEHPDWYIKN,./data/raw/alphafold//AF-P78722-F1-model_v4.pdb,3423,2323,1039,2937
+1834,4535,4590,MSTAGKVIKCKAAVLWEQKKPFSIEEVEVAPPKAHEVRIKMVAAGICRSDDHVVSGTLVAPLPVIAGHEAAGIVESIGEGVTTVRPGDKVIPLFIPQCGKCSVCKHPEGNLCLKNLSMPRGTMQDGTSRFTCRGKPIHHFLGTSTFSQYTVVDEISVAKIDAASPLEKVCLVGCGFSTGYGSAVKVAKVTQGSTCAVFGLGGVGLSVIMGCKAAGAARIIGVDINKDKFAKAKEVGATECVNPQDYKKPIQEVLTEMSNGGVDFSFEVIGRLDTMVAALSCCQEAYGVSVIVGVPPDSQNLSMNPMLLLSGRTWKGAIFGGFKSKDSVPKLVADFMAKKFALDPLITHVLPFEKINEGFDLLRSGKSIRTILTF,sabio,P00328,CC(CCC(=O)O)C1CCC2C3CCC4CC(=O)CCC4(C)C3CCC12C.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]>>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)c1,0.81,22.06800405752972,30.0,7.3,1.1.1.1,9796.0,-0.0915149811213502,CC(CCC(=O)O)C1CCC2C3CCC4CC(=O)CCC4(C)C3CCC12C.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],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,-0.0915149811213502,CC(CCC(=O)O)C1CCC2C3CCC4CC(=O)CCC4(C)C3CCC12C.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]__MSTAGKVIKCKAAVLWEQKKPFSIEEVEVAPPKAHEVRIKMVAAGICRSDDHVVSGTLVAPLPVIAGHEAAGIVESIGEGVTTVRPGDKVIPLFIPQCGKCSVCKHPEGNLCLKNLSMPRGTMQDGTSRFTCRGKPIHHFLGTSTFSQYTVVDEISVAKIDAASPLEKVCLVGCGFSTGYGSAVKVAKVTQGSTCAVFGLGGVGLSVIMGCKAAGAARIIGVDINKDKFAKAKEVGATECVNPQDYKKPIQEVLTEMSNGGVDFSFEVIGRLDTMVAALSCCQEAYGVSVIVGVPPDSQNLSMNPMLLLSGRTWKGAIFGGFKSKDSVPKLVADFMAKKFALDPLITHVLPFEKINEGFDLLRSGKSIRTILTF,./data/raw/alphafold//AF-P00328-F1-model_v4.pdb,1323,1999,6213,2066
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+1836,15602,15826,MALIPDLAMETWLLLAVSLVLLYLYGTHSHGLFKKLGIPGPTPLPFLGNILSYHKGFCMFDMECHKKYGKVWGFYDGQQPVLAITDPDMIKTVLVKECYSVFTNRRPFGPVGFMKSAISIAEDEEWKRLRSLLSPTFTSGKLKEMVPIIAQYGDVLVRNLRREAETGKPVTLKDVFGAYSMDVITSTSFGVNIDSLNNPQDPFVENTKKLLRFDFLDPFFLSITVFPFLIPILEVLNICVFPREVTNFLRKSVKRMKESRLEDTQKHRVDFLQLMIDSQNSKETESHKALSDLELVAQSIIFIFAGYETTSSVLSFIMYELATHPDVQQKLQEEIDAVLPNKAPPTYDTVLQMEYLDMVVNETLRLFPIAMRLERVCKKDVEINGMFIPKGVVVMIPSYALHRDPKYWTEPEKFLPERFSKKNKDNIDPYIYTPFGSGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQIPLKLSLGGLLQPEKPVVLKVESRDGTVSGA,sabio,P08684,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.[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.O,0.043,1.0376408280113163,37.0,7.4,1.14.14.57,9606.0,-1.3665315444204136,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.[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.O,-1.3665315444204136,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.[H]__MALIPDLAMETWLLLAVSLVLLYLYGTHSHGLFKKLGIPGPTPLPFLGNILSYHKGFCMFDMECHKKYGKVWGFYDGQQPVLAITDPDMIKTVLVKECYSVFTNRRPFGPVGFMKSAISIAEDEEWKRLRSLLSPTFTSGKLKEMVPIIAQYGDVLVRNLRREAETGKPVTLKDVFGAYSMDVITSTSFGVNIDSLNNPQDPFVENTKKLLRFDFLDPFFLSITVFPFLIPILEVLNICVFPREVTNFLRKSVKRMKESRLEDTQKHRVDFLQLMIDSQNSKETESHKALSDLELVAQSIIFIFAGYETTSSVLSFIMYELATHPDVQQKLQEEIDAVLPNKAPPTYDTVLQMEYLDMVVNETLRLFPIAMRLERVCKKDVEINGMFIPKGVVVMIPSYALHRDPKYWTEPEKFLPERFSKKNKDNIDPYIYTPFGSGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQIPLKLSLGGLLQPEKPVVLKVESRDGTVSGA,./data/raw/alphafold//AF-P08684-F1-model_v4.pdb,3345,2210,3897,2768
+1837,14280,14475,MSSRQPFVRLNDGHCIPALGFGTYKPIEVPKSKSLEAANLAIGVGYRHIDTAYAYQIEEEIGQAIQSNIKAGIVKREDMFITTKLWCTCFQPELVRPSLEKSLKKLQLEHVDLFIMHYPVPMKAGDNDFPLDEQGKLLLDTVDFCATWEALEKCKDAGLVKSIGVSNFNHRQLERILNKPGLKYKPVCNQVECHVYNNQSKLLDYCKSKDIVLVAFGALGTQRYKEWVDQDSPVLLNDPVLCGVAKKNKRSPALIALRYLVQRGVVPLAQSFYESEMKENLQVFEFQLSPEDMKILDGLNKNFRYLPAQFFADHPEYPFSEEY,brenda,A0A097ZMY7,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.O[C@@H]1C=CC=C[C@@H]1O>>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+],0.032,7.625379149873255,25.0,7.4,1.1.1.239,10036.0,-1.494850021680094,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.O[C@@H]1C=CC=C[C@@H]1O,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+],-1.494850021680094,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.O[C@@H]1C=CC=C[C@@H]1O__MSSRQPFVRLNDGHCIPALGFGTYKPIEVPKSKSLEAANLAIGVGYRHIDTAYAYQIEEEIGQAIQSNIKAGIVKREDMFITTKLWCTCFQPELVRPSLEKSLKKLQLEHVDLFIMHYPVPMKAGDNDFPLDEQGKLLLDTVDFCATWEALEKCKDAGLVKSIGVSNFNHRQLERILNKPGLKYKPVCNQVECHVYNNQSKLLDYCKSKDIVLVAFGALGTQRYKEWVDQDSPVLLNDPVLCGVAKKNKRSPALIALRYLVQRGVVPLAQSFYESEMKENLQVFEFQLSPEDMKILDGLNKNFRYLPAQFFADHPEYPFSEEY,./data/raw/alphafold//AF-A0A097ZMY7-F1-model_v4.pdb,1329,1150,6276,1625
+1838,18288,18548,MPALACLRRLCRHLSPQAVLFLLFVFCLFSVFVSAYYLYGWNRGLEPSADASESDCGDPPPVAPSRLLPIKPVQAVAPSRTDPLVLVFVESLYSQLGQEVVAILESSRFKYRTEIAPGKGDMPTLTDKGRGRFALIIYENILKYVNLDAWNRELLDKYCVAYGVGIIGFFKANENSLLSAQLKGFPLFLHSNLGLKDCSINPKSPLLYVTRPSEVEKGVLPGEDWTVFQSNHSTYEPVLLAKTRSSESIPHLGADAGLHAALHATVVQDLGLHDGIQRVLFGNNLNFWLHKLVFVDAVAFLTGKRLSLPLDRYILVDIDDIFVGKEGTRMKVEDVKALFDTQNELRTHIPNFTFNLGYSGKFFHTGTDAEDAGDDLLLSYVKEFWWFPHMWSHMQPHLFHNQSVLAEQMALNKKFAVEHGIPTDMGYAVAPHHSGVYPVHVQLYEAWKQVWNIRVTSTEEYPHLKPARYRRGFIHNGIMVLPRQTCGLFTHTIFYNEYPGGSSELDKIINGGELFLTVLLNPISVFMTHLSNYGNDRLGLYTFKHLVRFLHSWTNLRLQTLPPVQLAQKYFQIFSEEKDPLWQDPCEDKRHKDIWSKEKTCDRFPKLLIIGPQKTGTTALYLFLGMHPDLSSNYPSSETFEEIQFFNGHNYHKGIDWYMEFFPIPSNTTSDFYFEKSANYFDSEVAPRRAAALLPKAKVLTILINPADRAYSWYQHQRAHDDPVALKYTFHEVITAGPDASSKLRALQNRCLVPGWYATHIERWLSAFHANQILVLDGKLLRTEPAKVMDTVQKFLGVTSTVDYHKTLAFDPKKGFWCQLLEGGKTKCLGKSKGRKYPEMDLDSRAFLKDYYRDHNIELSKLLYKMGQTLPTWLREDLQNTR,sabio,Q02353,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,4.2,8.558692421991093,37.0,7.2,2.8.2.8,10116.0,0.6232492903979004,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,0.6232492903979004,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O__MPALACLRRLCRHLSPQAVLFLLFVFCLFSVFVSAYYLYGWNRGLEPSADASESDCGDPPPVAPSRLLPIKPVQAVAPSRTDPLVLVFVESLYSQLGQEVVAILESSRFKYRTEIAPGKGDMPTLTDKGRGRFALIIYENILKYVNLDAWNRELLDKYCVAYGVGIIGFFKANENSLLSAQLKGFPLFLHSNLGLKDCSINPKSPLLYVTRPSEVEKGVLPGEDWTVFQSNHSTYEPVLLAKTRSSESIPHLGADAGLHAALHATVVQDLGLHDGIQRVLFGNNLNFWLHKLVFVDAVAFLTGKRLSLPLDRYILVDIDDIFVGKEGTRMKVEDVKALFDTQNELRTHIPNFTFNLGYSGKFFHTGTDAEDAGDDLLLSYVKEFWWFPHMWSHMQPHLFHNQSVLAEQMALNKKFAVEHGIPTDMGYAVAPHHSGVYPVHVQLYEAWKQVWNIRVTSTEEYPHLKPARYRRGFIHNGIMVLPRQTCGLFTHTIFYNEYPGGSSELDKIINGGELFLTVLLNPISVFMTHLSNYGNDRLGLYTFKHLVRFLHSWTNLRLQTLPPVQLAQKYFQIFSEEKDPLWQDPCEDKRHKDIWSKEKTCDRFPKLLIIGPQKTGTTALYLFLGMHPDLSSNYPSSETFEEIQFFNGHNYHKGIDWYMEFFPIPSNTTSDFYFEKSANYFDSEVAPRRAAALLPKAKVLTILINPADRAYSWYQHQRAHDDPVALKYTFHEVITAGPDASSKLRALQNRCLVPGWYATHIERWLSAFHANQILVLDGKLLRTEPAKVMDTVQKFLGVTSTVDYHKTLAFDPKKGFWCQLLEGGKTKCLGKSKGRKYPEMDLDSRAFLKDYYRDHNIELSKLLYKMGQTLPTWLREDLQNTR,./data/raw/alphafold//AF-Q02353-F1-model_v4.pdb,1408,917,716,1010
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+1840,5419,5505,MKLFTSTLTAKKSSTHKPLISLALSVLISTLLISETAQAADANDRLEQEVDKQAKQLMAQYQIPGMAFGIIVDGKSHFYNYGLADKQRNQPVSEDTIFELGSVSKTFAATLASYSELNGTLSLDDTADKYIPYLKNSAIGNTKLISLVTYSAGGYHYRCLKTLENNKELLQYYKSWHPDFPVNSKRLYSNASIGLFGYISALSMHSDYTKLIENTVLPSLKMTNTFVDVPANKMEDYAFGYNAAGEPIRVNPGMLDAEAYGIKSTSADMTRFMAANMGLVTVDSQMQQALDNNRKGYYRTKSFTQGLAWEMYPLPTTLQQLVEGNSTETILQPQPIQLNEPPTPVLNDVWVNKTGATNGFGAYIAYMPAKKTGMFILANKNYPNTERVKAAYTILDSVMNN,uniprot_search,O05465,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O.O>>,20.0,99.71704412979751,30.0,7.0,3.5.2.6,498.0,1.3010299956639813,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O.O,,1.3010299956639813,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O.O__MKLFTSTLTAKKSSTHKPLISLALSVLISTLLISETAQAADANDRLEQEVDKQAKQLMAQYQIPGMAFGIIVDGKSHFYNYGLADKQRNQPVSEDTIFELGSVSKTFAATLASYSELNGTLSLDDTADKYIPYLKNSAIGNTKLISLVTYSAGGYHYRCLKTLENNKELLQYYKSWHPDFPVNSKRLYSNASIGLFGYISALSMHSDYTKLIENTVLPSLKMTNTFVDVPANKMEDYAFGYNAAGEPIRVNPGMLDAEAYGIKSTSADMTRFMAANMGLVTVDSQMQQALDNNRKGYYRTKSFTQGLAWEMYPLPTTLQQLVEGNSTETILQPQPIQLNEPPTPVLNDVWVNKTGATNGFGAYIAYMPAKKTGMFILANKNYPNTERVKAAYTILDSVMNN,./data/raw/alphafold//AF-O05465-F1-model_v4.pdb,1456,1907,3545,2368
+1841,16538,16767,YWHYHDHVVGTEHGTGGIHKGLYGPLIVRRKGDVLPDATHTIVFNDMIINNKPPHTSPNFEATVGDRVEFVMITHGEYYHTFHMHGHRWADNRTGMLTGPDDPSQVIDNKIIGPADSFGFQIIAGEHVGAGAWMYHCHVQSH,sabio,G4XJK9,NC(Cc1ccc(O)c(O)c1)C(=O)O.O=O>>O,3.47,85.08076050652086,40.0,8.0,1.10.3.2,181243.0,0.5403294747908738,NC(Cc1ccc(O)c(O)c1)C(=O)O.O=O,O,0.5403294747908738,NC(Cc1ccc(O)c(O)c1)C(=O)O.O=O__YWHYHDHVVGTEHGTGGIHKGLYGPLIVRRKGDVLPDATHTIVFNDMIINNKPPHTSPNFEATVGDRVEFVMITHGEYYHTFHMHGHRWADNRTGMLTGPDDPSQVIDNKIIGPADSFGFQIIAGEHVGAGAWMYHCHVQSH,./data/raw/alphafold//AF-G4XJK9-F1-model_v4.pdb,3420,2314,1025,2922
+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
+1843,6263,6372,MKAARLHEYNKPLRIEDVDYPRLEGRFDVIVRIAGAGVCHTDLHLVQGMWHELLQPKLPYTLGHENVGYIEEVAEGVEGLEKGDPVILHPAVTDGTCLACRAGEDMHCENLEFPGLNIDGGFAEFMRTSHRSVIKLPKDISREKLVEMAPLADAGITAYRAVKKAARTLYPGAYVAIVGVGGLGHIAVQLLKVMTPATVIALDVKEEKLKLAERLGADHVVDARRDPVKQVMELTRGRGVNVAMDFVGSQATVDYTPYLLGRMGRLIIVGYGGELRFPTIRVISSEVSFEGSLVGNYVELHELVTLALQGKVRVEVDIHKLDEINDVLERLEKGEVLGRAVLIP,brenda,Q9Y9P9,CCC(C)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>>CCC(C)=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+],0.48,7.691302728842139e-15,60.0,8.0,1.1.1.1,56636.0,-0.3187587626244128,CCC(C)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,CCC(C)=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+],-0.3187587626244128,CCC(C)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__MKAARLHEYNKPLRIEDVDYPRLEGRFDVIVRIAGAGVCHTDLHLVQGMWHELLQPKLPYTLGHENVGYIEEVAEGVEGLEKGDPVILHPAVTDGTCLACRAGEDMHCENLEFPGLNIDGGFAEFMRTSHRSVIKLPKDISREKLVEMAPLADAGITAYRAVKKAARTLYPGAYVAIVGVGGLGHIAVQLLKVMTPATVIALDVKEEKLKLAERLGADHVVDARRDPVKQVMELTRGRGVNVAMDFVGSQATVDYTPYLLGRMGRLIIVGYGGELRFPTIRVISSEVSFEGSLVGNYVELHELVTLALQGKVRVEVDIHKLDEINDVLERLEKGEVLGRAVLIP,./data/raw/alphafold//AF-Q9Y9P9-F1-model_v4.pdb,1350,840,635,923
+1844,16812,17042,MPTLQSLAVPFGCVQGYAPGGIPAYSNKHESYFSGERSIDGNLFCGFKYQCVEFARRWLFERKSLVLPDVDWAVHIFNLKEVSDARTGKPVRCVAIRNGTAAKPVVDSLLIYPSDDYSPVGHVAAITEVGDKWVRIADQNHRFHKWDANYAAELPLIHEKGVWTILDPLEDEVLKPLGWVTFPDTPDRNPNEPLVLHESLHFKRGELPTLRRLTFTPTSREKDWLDLTNEAEAYFADVCGIDVKNPKLEKASYYQMNRELYLDCAKYGNQLHQMFLEATKFVLGSDELLRLFCIPEEYWPRLRHSWETQPHAITGRFDFAFDEDTQQFKCFEYNADSASTLLECGVIQQKWARSVGLDDGTTYSSGSLVSSRLQLAWEMAEVTGRVHFLIDNDDEEHYTALYVMQHASAAGLETKLCVLFDEFHFDENGVVVDSDGVAVTTVWKTWMWETAIADHQKARVQRGNDWRPTPKDEVRLCDILLGPNWDLRVFEPMWKIIPSNKAILPIIYNKHPDHPALLRASYELTVELQRTGYVRKPIVGRVGRNVTVTEASGDIAAKSDGDFSDRDMVYQELFRLPERDGYYAILGGWVIGDVYCGTGVREDKTIITGLESPFSALRVYQGAQRRPLTHEDLDKAEAAAVGGGLKT,brenda,Q9GT49,NCCCCNCCCN=C(O)CN=C(O)[C@H](CS)N=C(O)CC[C@H](N)C(=O)O.N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(O)=NCCCCNCCCN=C(O)CN=C(O)[C@H](CS)N=C(O)CC[C@H](N)C(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,2.8,0.0,26.666666666666668,8.1,6.3.1.9,5693.0,0.4471580313422192,NCCCCNCCCN=C(O)CN=C(O)[C@H](CS)N=C(O)CC[C@H](N)C(=O)O.N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(O)=NCCCCNCCCN=C(O)CN=C(O)[C@H](CS)N=C(O)CC[C@H](N)C(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,0.4471580313422192,NCCCCNCCCN=C(O)CN=C(O)[C@H](CS)N=C(O)CC[C@H](N)C(=O)O.N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MPTLQSLAVPFGCVQGYAPGGIPAYSNKHESYFSGERSIDGNLFCGFKYQCVEFARRWLFERKSLVLPDVDWAVHIFNLKEVSDARTGKPVRCVAIRNGTAAKPVVDSLLIYPSDDYSPVGHVAAITEVGDKWVRIADQNHRFHKWDANYAAELPLIHEKGVWTILDPLEDEVLKPLGWVTFPDTPDRNPNEPLVLHESLHFKRGELPTLRRLTFTPTSREKDWLDLTNEAEAYFADVCGIDVKNPKLEKASYYQMNRELYLDCAKYGNQLHQMFLEATKFVLGSDELLRLFCIPEEYWPRLRHSWETQPHAITGRFDFAFDEDTQQFKCFEYNADSASTLLECGVIQQKWARSVGLDDGTTYSSGSLVSSRLQLAWEMAEVTGRVHFLIDNDDEEHYTALYVMQHASAAGLETKLCVLFDEFHFDENGVVVDSDGVAVTTVWKTWMWETAIADHQKARVQRGNDWRPTPKDEVRLCDILLGPNWDLRVFEPMWKIIPSNKAILPIIYNKHPDHPALLRASYELTVELQRTGYVRKPIVGRVGRNVTVTEASGDIAAKSDGDFSDRDMVYQELFRLPERDGYYAILGGWVIGDVYCGTGVREDKTIITGLESPFSALRVYQGAQRRPLTHEDLDKAEAAAVGGGLKT,./data/raw/alphafold//AF-Q9GT49-F1-model_v4.pdb,2638,5131,2401,5307
+1845,22168,22501,MSIRSLGYMGFAVSDVAAWRSFLTQKLGLMEAGTTDNGDLFRIDSRAWRIAVQQGEVDDLAFAGYEVADAAGLAQMADKLKQAGIAVTTGDASLARRRGVTGLITFADPFGLPLEIYYGASEVFEKPFLPGAAVSGFLTGEQGLGHFVRCVPDSDKALAFYTDVLGFQLSDVIDMKMGPDVTVPAYFLHCNERHHTLAIAAFPLPKRIHHFMLEVASLDDVGFAFDRVDADGLITSTLGRHTNDHMVSFYASTPSGVEVEYGWSARTVDRSWVVVRHDSPSMWGHKSVRDKAAARNKA,brenda,B3VTK1,O=O.Oc1cccc(-c2ccccc2)c1O>>O=C(O)/C(O)=C/C=C/C(=O)c1ccccc1,86.32,0.0,30.0,7.5,1.13.11.39,134375.0,1.9361114316748544,O=O.Oc1cccc(-c2ccccc2)c1O,O=C(O)/C(O)=C/C=C/C(=O)c1ccccc1,1.9361114316748544,O=O.Oc1cccc(-c2ccccc2)c1O__MSIRSLGYMGFAVSDVAAWRSFLTQKLGLMEAGTTDNGDLFRIDSRAWRIAVQQGEVDDLAFAGYEVADAAGLAQMADKLKQAGIAVTTGDASLARRRGVTGLITFADPFGLPLEIYYGASEVFEKPFLPGAAVSGFLTGEQGLGHFVRCVPDSDKALAFYTDVLGFQLSDVIDMKMGPDVTVPAYFLHCNERHHTLAIAAFPLPKRIHHFMLEVASLDDVGFAFDRVDADGLITSTLGRHTNDHMVSFYASTPSGVEVEYGWSARTVDRSWVVVRHDSPSMWGHKSVRDKAAARNKA,./data/raw/alphafold//AF-B3VTK1-F1-model_v4.pdb,2011,4170,4038,3867
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+1885,9132,9274,MQRRHFLQKTLLALPIIFSGNLLTGCKTNLSDDYLPDDKITNNPNLLQNKLKEILPIWENKFNAKIGMTIIADNGELSSHRGNEYFPVNSTIKAFIASHILLLVDKEKLDLNEKIIIKESDLIEYSPVCKKYFDENKPISISELCEATITLSDNGSANILLDKIGGLTAFNQFLKEIGADMVLANNEPLLNRSHYGETSDTAKPIPYTKSLKALIVGNILSNQSKEQLITWLINDKVADNLLRKYLPKNWRIGDKTGTGSESKNIIAVIWNENNKPYFISLFITQPHDGKSLDFKNQKDEIMAQIGKEIYPFL,sabio,Q59514,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC12)c1ccco1.O>>,4.1,99.77447305629605,30.0,7.0,3.5.2.6,480.0,0.6127838567197355,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC12)c1ccco1.O,,0.6127838567197355,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC12)c1ccco1.O__MQRRHFLQKTLLALPIIFSGNLLTGCKTNLSDDYLPDDKITNNPNLLQNKLKEILPIWENKFNAKIGMTIIADNGELSSHRGNEYFPVNSTIKAFIASHILLLVDKEKLDLNEKIIIKESDLIEYSPVCKKYFDENKPISISELCEATITLSDNGSANILLDKIGGLTAFNQFLKEIGADMVLANNEPLLNRSHYGETSDTAKPIPYTKSLKALIVGNILSNQSKEQLITWLINDKVADNLLRKYLPKNWRIGDKTGTGSESKNIIAVIWNENNKPYFISLFITQPHDGKSLDFKNQKDEIMAQIGKEIYPFL,./data/raw/alphafold//AF-Q59514-F1-model_v4.pdb,1442,967,773,1073
+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
+1887,20071,20359,MPKKLKKIIKLCSMVFVIGILTLLLPEKGAADYPIFSQRFTADPAAVVYNGRLYIYCSHDSDATPGQSTYNIPDITCISTDDLKNWTDHGEVFNAKRDSRWASVSWAPSIVYRNNKFYLYYGNGGNGIGVAVSDSPTGPFKDPLPGPLVSWNTPGVQPAQNMWLFDPGVFVDDDGQAYMYFGGNGQNNIRVIKLGNDMISTVGSAMTMSAPRFFEAAYMHKYNGKYYFSYASDFSQGASKIEYMMSDKPTTGFQYKGVILPQPPDNYSNNNHHAIVEYKGNWYVVYHNRTVAKQRGLDPVYQRNVCIDQMFYNADGTIKQVVPTVDGLKQLKYVDPYTKNLAVTMHKESGIETEECSEGGRNVAFIENGDWIQVKGVDFGNVGPTSFEARVASATNGGNIEIRLDSPTGTLIGTCKVEGTGDWQKWVTKTCSVSKVTGVHDLFFRFTGGSGYLFNFSWWKFNSDATPTPTPPPQPSTVPVTERSAFSKIEVEDFNDIKSSTIQKIGTPNGGSGIGYIENGDWLAYKNIDFGNGATTFKALVASTLSPNIELRLDSPTGTLIGTLKVAATGGFNAYEEQSCNISKVTGKHDLYLVFSGAVNIDWFTFGGSSGIIKRGDTNSDGKINSTDVTALKRHLLRVTQLTGDNLANADVNGDGNVNSTDLLLLKRYILGEIENFPI,brenda,A3DEX4,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]1OC(O)[C@H](O)[C@H]1O,4.72,9.809384078968736e-15,50.0,5.7,3.2.1.55,1515.0,0.6739419986340878,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]1OC(O)[C@H](O)[C@H]1O,0.6794278966121189,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)cc1__MPKKLKKIIKLCSMVFVIGILTLLLPEKGAADYPIFSQRFTADPAAVVYNGRLYIYCSHDSDATPGQSTYNIPDITCISTDDLKNWTDHGEVFNAKRDSRWASVSWAPSIVYRNNKFYLYYGNGGNGIGVAVSDSPTGPFKDPLPGPLVSWNTPGVQPAQNMWLFDPGVFVDDDGQAYMYFGGNGQNNIRVIKLGNDMISTVGSAMTMSAPRFFEAAYMHKYNGKYYFSYASDFSQGASKIEYMMSDKPTTGFQYKGVILPQPPDNYSNNNHHAIVEYKGNWYVVYHNRTVAKQRGLDPVYQRNVCIDQMFYNADGTIKQVVPTVDGLKQLKYVDPYTKNLAVTMHKESGIETEECSEGGRNVAFIENGDWIQVKGVDFGNVGPTSFEARVASATNGGNIEIRLDSPTGTLIGTCKVEGTGDWQKWVTKTCSVSKVTGVHDLFFRFTGGSGYLFNFSWWKFNSDATPTPTPPPQPSTVPVTERSAFSKIEVEDFNDIKSSTIQKIGTPNGGSGIGYIENGDWLAYKNIDFGNGATTFKALVASTLSPNIELRLDSPTGTLIGTLKVAATGGFNAYEEQSCNISKVTGKHDLYLVFSGAVNIDWFTFGGSSGIIKRGDTNSDGKINSTDVTALKRHLLRVTQLTGDNLANADVNGDGNVNSTDLLLLKRYILGEIENFPI,./data/raw/alphafold//AF-A3DEX4-F1-model_v4.pdb,417,2993,5338,6217
+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
+1889,16835,17065,MKLTKGCAYKYIIFTVLILANILYDNKKRCMIKKNLRISSCGIISRLLKSNSNYNSFNKNYNFTSAISELQFSNFWNLDILQKDIFSNIHNNKNKPQSYIIHKRLMSEKGDNNNNNHQNNNGNDNKKRLGSVVNNEENTCSDKRMKPFEEGHGITQVDKMNNNSDHLQQNGVMNLNSNNVENNNNNNSVVVKKNEPKIHYRKDYKPSGFIINNVTLNINIHDNETIVRSVLDMDISKHNVGEDLVFDGVGLKINEISINNKKLVEGEEYTYDNEFLTIFSKFVPKSKFAFSSEVIIHPETNYALTGLYKSKNIIVSQCEATGFRRITFFIDRPDMMAKYDVTVTADKEKYPVLLSNGDKVNEFEIPGGRHGARFNDPHLKPCYLFAVVAGDLKHLSATYITKYTKKKVELYVFSEEKYVSKLQWALECLKKSMAFDEDYFGLEYDLSRLNLVAVSDFNVGAMENKGLNIFNANSLLASKKNSIDFSYARILTVVGHEYFHNYTGNRVTLRDWFQLTLKEGLTVHRENLFSEEMTKTVTTRLSHVDLLRSVQFLEDSSPLSHPIRPESYVSMENFYTTTVYDKGSEVMRMYLTILGEEYYKKGFDIYIKKNDGNTATCEDFNYAMEQAYKMKKADNSANLNQYLLWFSQSGTPHVSFKYNYDAEKKQYSIHVNQYTKPDENQKEKKPLFIPISVGLINPENGKEMISQTTLELTKESDTFVFNNIAVKPIPSLFRGFSAPVYIEDNLTDEERILLLKYDSDAFVRYNSCTNIYMKQILMNYNEFLKAKNEKLESFNLTPVNAQFIDAIKYLLEDPHADAGFKSYIVSLPQDRYIINFVSNLDTDVLADTKEYIYKQIGDKLNDVYYKMFKSLEAKADDLTYFNDESHVDFDQMNMRTLRNTLLSLLSKAQYPNILNEIIEHSKSPYPSNWLTSLSVSAYFDKYFELYDKTYKLSKDDELLLQEWLKTVSRSDRKDIYEILKKLENEVLKDSKNPNDIRAVYLPFTNNLRRFHDISGKGYKLIAEVITKTDKFNPMVATQLCEPFKLWNKLDTKRQELMLNEMNTMLQEPNISNNLKEYLLRLTNKL,brenda,Q8IEK1,NCCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>NCCCC[C@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,1.55,9.978972189204264e-15,37.0,7.2,3.4.11.20,5833.0,0.1903316981702915,NCCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,NCCCC[C@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,0.1903316981702915,NCCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MKLTKGCAYKYIIFTVLILANILYDNKKRCMIKKNLRISSCGIISRLLKSNSNYNSFNKNYNFTSAISELQFSNFWNLDILQKDIFSNIHNNKNKPQSYIIHKRLMSEKGDNNNNNHQNNNGNDNKKRLGSVVNNEENTCSDKRMKPFEEGHGITQVDKMNNNSDHLQQNGVMNLNSNNVENNNNNNSVVVKKNEPKIHYRKDYKPSGFIINNVTLNINIHDNETIVRSVLDMDISKHNVGEDLVFDGVGLKINEISINNKKLVEGEEYTYDNEFLTIFSKFVPKSKFAFSSEVIIHPETNYALTGLYKSKNIIVSQCEATGFRRITFFIDRPDMMAKYDVTVTADKEKYPVLLSNGDKVNEFEIPGGRHGARFNDPHLKPCYLFAVVAGDLKHLSATYITKYTKKKVELYVFSEEKYVSKLQWALECLKKSMAFDEDYFGLEYDLSRLNLVAVSDFNVGAMENKGLNIFNANSLLASKKNSIDFSYARILTVVGHEYFHNYTGNRVTLRDWFQLTLKEGLTVHRENLFSEEMTKTVTTRLSHVDLLRSVQFLEDSSPLSHPIRPESYVSMENFYTTTVYDKGSEVMRMYLTILGEEYYKKGFDIYIKKNDGNTATCEDFNYAMEQAYKMKKADNSANLNQYLLWFSQSGTPHVSFKYNYDAEKKQYSIHVNQYTKPDENQKEKKPLFIPISVGLINPENGKEMISQTTLELTKESDTFVFNNIAVKPIPSLFRGFSAPVYIEDNLTDEERILLLKYDSDAFVRYNSCTNIYMKQILMNYNEFLKAKNEKLESFNLTPVNAQFIDAIKYLLEDPHADAGFKSYIVSLPQDRYIINFVSNLDTDVLADTKEYIYKQIGDKLNDVYYKMFKSLEAKADDLTYFNDESHVDFDQMNMRTLRNTLLSLLSKAQYPNILNEIIEHSKSPYPSNWLTSLSVSAYFDKYFELYDKTYKLSKDDELLLQEWLKTVSRSDRKDIYEILKKLENEVLKDSKNPNDIRAVYLPFTNNLRRFHDISGKGYKLIAEVITKTDKFNPMVATQLCEPFKLWNKLDTKRQELMLNEMNTMLQEPNISNNLKEYLLRLTNKL,./data/raw/alphafold//AF-Q8IEK1-F1-model_v4.pdb,1845,1536,3117,1883
+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
+1894,20096,20385,MALLVGGTLNPTTHLSLRSRAGRNSENVWLRSAASSQTSKGRFCNLTVRAGTPSKPSEPIGPVFTKLKPWQIPKRDWFSKDFLFGASTSAYQIEGAWNEDGKGPSTWDHFCHTYPERISDGTNGDVAANSYHMYEEDVKALKDMGMKVYRFSISWSRILPNGTGKPNQKGIDYYNNLINSLIRHGIVPYVTIWHWDTPQALEDKYGGFLDKQIVNDYKYFAELCFQSFGDRVKNWFTFNEPHTYCCFSYGEGIHAPGRCSPGLDCAVPEGDSLREPYTAGHHILLAHAEAVELFKAHYNKHGDSKIGMAFDVMGYEPYQDSFLDDQARERSIDYNMGWFLEPVVRGDYPFSMRSLIGDRLPMFTKEEQEKLGSLCDIMGLNYYTSRFSKHVDISSDYTPTLNTDDAYASSETTGSDGNEIGPITGTYWIYMYPKGLTDLLLIMKEKYGNPPIFITENGIADVEGDPEMPDPLDDWKRLDYLQRHISAVKDAIDQGADVRGHFTWGLIDNFEWGSGYSSRFGLVYIDKEDGNKRKLKKSAKWFAKFNSVPKTLLKTTNNNATVTASVSV,sabio,Q9FYS3,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1>>O=[N+]([O-])c1ccc(O)cc1.OCC1OC(O)C(O)C(O)C1O,22.2,0.0,30.0,5.5,3.2.1.21,4550.0,1.3463529744506386,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1,O=[N+]([O-])c1ccc(O)cc1.OCC1OC(O)C(O)C(O)C1O,1.3463529744506386,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1__MALLVGGTLNPTTHLSLRSRAGRNSENVWLRSAASSQTSKGRFCNLTVRAGTPSKPSEPIGPVFTKLKPWQIPKRDWFSKDFLFGASTSAYQIEGAWNEDGKGPSTWDHFCHTYPERISDGTNGDVAANSYHMYEEDVKALKDMGMKVYRFSISWSRILPNGTGKPNQKGIDYYNNLINSLIRHGIVPYVTIWHWDTPQALEDKYGGFLDKQIVNDYKYFAELCFQSFGDRVKNWFTFNEPHTYCCFSYGEGIHAPGRCSPGLDCAVPEGDSLREPYTAGHHILLAHAEAVELFKAHYNKHGDSKIGMAFDVMGYEPYQDSFLDDQARERSIDYNMGWFLEPVVRGDYPFSMRSLIGDRLPMFTKEEQEKLGSLCDIMGLNYYTSRFSKHVDISSDYTPTLNTDDAYASSETTGSDGNEIGPITGTYWIYMYPKGLTDLLLIMKEKYGNPPIFITENGIADVEGDPEMPDPLDDWKRLDYLQRHISAVKDAIDQGADVRGHFTWGLIDNFEWGSGYSSRFGLVYIDKEDGNKRKLKKSAKWFAKFNSVPKTLLKTTNNNATVTASVSV,./data/raw/alphafold//AF-Q9FYS3-F1-model_v4.pdb,1219,3533,1311,3265
+1895,14577,14782,MKTFIIGISGVTNSGKTTLAKNLQKHLPNCSVISQDDFFKPESEIETDKNGFLQYDVLEALNMEKMMSAISCWMESARHSVVSTDQESAEEIPILIIEGFLLFNYKPLDTIWNRSYFLTIPYEECKRRRSTRVYQPPDSPGYFDGHVWPMYLKYRQEMQDITWEVVYLDGTKSEEDLFLQVYEDLIQELAKQKCLQVTA,brenda,Q9NWW6,N=c1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(O)n1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.48,0.0,37.0,7.5,2.7.1.173,9606.0,-0.3187587626244128,N=c1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(O)n1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-0.3187587626244128,N=c1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(O)n1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MKTFIIGISGVTNSGKTTLAKNLQKHLPNCSVISQDDFFKPESEIETDKNGFLQYDVLEALNMEKMMSAISCWMESARHSVVSTDQESAEEIPILIIEGFLLFNYKPLDTIWNRSYFLTIPYEECKRRRSTRVYQPPDSPGYFDGHVWPMYLKYRQEMQDITWEVVYLDGTKSEEDLFLQVYEDLIQELAKQKCLQVTA,./data/raw/alphafold//AF-Q9NWW6-F1-model_v4.pdb,2314,4652,4680,4509
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+1901,186,198,MVELVISPSLTVNSDCLDKLKFNRADAAVWTLSDRQGITKSAPLRVSQLFSRSCPRVLPRQPSTAMAAYGQTQYSAGIQQATPYTAYPPPAQAYGIPSYSIKTEDSLNHSPGQSGFLSYGSSFSTSPTGQSPYTYQMHGTTGFYQGGNGLGNAAGFGSVHQDYPSYPGFPQSQYPQYYGSSYNPPYVPASSICPSPLSTSTYVLQEASHNVPNQSSESLAGEYNTHNGPSTPAKEGDTDRPHRASDGKLRGRSKRSSDPSPAGDNEIERVFVWDLDETIIIFHSLLTGTFASRYGKDTTTSVRIGLMMEEMIFNLADTHLFFNDLEDCDQIHVDDVSSDDNGQDLSTYNFSADGFHSSAPGANLCLGSGVHGGVDWMRKLAFRYRRVKEMYNTYKNNVGGLIGTPKRETWLQLRAELEALTDLWLTHSLKALNLINSRPNCVNVLVTTTQLIPALAKVLLYGLGSVFPIENIYSATKTGKESCFERIMQRFGRKAVYVVIGDGVEEEQGAKKHNMPFWRISCHADLEALRHALELEYL,sabio,O00167,*NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(*)=O.O>>*NC(=O)C(Cc1ccc(O)cc1)NC(*)=O.O=P(O)(O)O,5.1,0.0,,,3.1.3.48,9606.0,0.7075701760979364,*NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(*)=O.O,*NC(=O)C(Cc1ccc(O)cc1)NC(*)=O.O=P(O)(O)O,0.7075701760979364,*NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(*)=O.O__MVELVISPSLTVNSDCLDKLKFNRADAAVWTLSDRQGITKSAPLRVSQLFSRSCPRVLPRQPSTAMAAYGQTQYSAGIQQATPYTAYPPPAQAYGIPSYSIKTEDSLNHSPGQSGFLSYGSSFSTSPTGQSPYTYQMHGTTGFYQGGNGLGNAAGFGSVHQDYPSYPGFPQSQYPQYYGSSYNPPYVPASSICPSPLSTSTYVLQEASHNVPNQSSESLAGEYNTHNGPSTPAKEGDTDRPHRASDGKLRGRSKRSSDPSPAGDNEIERVFVWDLDETIIIFHSLLTGTFASRYGKDTTTSVRIGLMMEEMIFNLADTHLFFNDLEDCDQIHVDDVSSDDNGQDLSTYNFSADGFHSSAPGANLCLGSGVHGGVDWMRKLAFRYRRVKEMYNTYKNNVGGLIGTPKRETWLQLRAELEALTDLWLTHSLKALNLINSRPNCVNVLVTTTQLIPALAKVLLYGLGSVFPIENIYSATKTGKESCFERIMQRFGRKAVYVVIGDGVEEEQGAKKHNMPFWRISCHADLEALRHALELEYL,./data/raw/alphafold//AF-O00167-F1-model_v4.pdb,969,496,137,145
+1902,4130,4183,MATRSPYKRQTKRSMIQSLPASSSASSRRRFISRKRFAMMIPLALLSGAVFLFFMPFNSWGQSSGSSLDLSHRINEIEVVAEFPHDPDAFTQGLLYAGNDTLFESTGLYGKSSVRKVDLRTGKVEILEKMDNTYFGEGLTLLGERLFQVAWLTNTGFTYDLRNLSKVKPFKHHMKDGWGLATDGKALFGSDGTSTLYRMDPQTMKVTDKHIVRYNGREVRYLNELEYINNEVWANVWQSDCIARISPKDGSLLGWILLSKLSRGLLKSGHRGIDVLNGIAWDSDKQRLFVTGKLWPKLYQIKLKQASAKSGNYIEQQCLV,uniprot_search,Q84WV9,CC(C)C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N)CCC(=N)O)C(=N)O>>CC(C)C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCCN)N=C(O)[C@H]1CCC(O)=N1)C(=N)O.N,20.6,1.0464816630179716e-14,30.0,8.0,2.3.2.5,3702.0,1.3138672203691537,CC(C)C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N)CCC(=N)O)C(=N)O,CC(C)C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCCN)N=C(O)[C@H]1CCC(O)=N1)C(=N)O.N,1.3138672203691537,CC(C)C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCCN)N=C(O)[C@@H](N)CCC(=N)O)C(=N)O__MATRSPYKRQTKRSMIQSLPASSSASSRRRFISRKRFAMMIPLALLSGAVFLFFMPFNSWGQSSGSSLDLSHRINEIEVVAEFPHDPDAFTQGLLYAGNDTLFESTGLYGKSSVRKVDLRTGKVEILEKMDNTYFGEGLTLLGERLFQVAWLTNTGFTYDLRNLSKVKPFKHHMKDGWGLATDGKALFGSDGTSTLYRMDPQTMKVTDKHIVRYNGREVRYLNELEYINNEVWANVWQSDCIARISPKDGSLLGWILLSKLSRGLLKSGHRGIDVLNGIAWDSDKQRLFVTGKLWPKLYQIKLKQASAKSGNYIEQQCLV,./data/raw/alphafold//AF-Q84WV9-F1-model_v4.pdb,1595,1179,1653,1379
+1903,18930,19213,MMRPVSLLSAVVLLLTGIDATSIGLHGGRPRDIILDDAKGPLQNIVTWDEHSLFVHGERVVIFSGEVHPFRLPVPSLYLDVFHKIKALGFNTVSFYVDWALLEGKPGRFRADGIFSLEPFFEAATKAGIYLLARPGPYINAEVSGGGFPGWLQRVKGKLRTDAPDYLHATDNYVAHIASIIAKAQITNGGPVILYQPENEYSGAAEGVLFPNKPYMQYVIDQARNAGIIVPLINNDAFPGGTGAPGTGLGSVDIYGHDGYPLGFDCAHPSAWPDNGLPTTWRQDHLNISPSTPFSLVEFQGGAFDPFGGWGFEQCSALVNHEFERVFYKNNMAAGVTIFNIYMTFGGTNWGNLGHPGGYTSYDYGASIREDRRIDREKYSELKLQGQFLKVSPGYITATPENATQGVYSDSQNIVITPLLAKESGDFFVVRHANYSSTDTASYTVKLPTSAGDLTIPQLGGSLTLTGRDSKIHVTDYPVGKFTLLYSTAEIFTWNEFAEKTVLVLYGGAQELHEFAVKNPFGSSKTAKAKKIEGSNVTIHTTSNLTVVLQWTASSARQVVQLGSLVIYMVDRNSAYNYWVPTLPGSGKQSAYGSSLMNPDSVIINGGYLIRSVAIKGNALSVQADFNVTTPLEIIGIPKGISKLAVNGKELGYSVSELGDWIAHPAIEIPHVQVPELTKLKWYKVDSLPEIRSNYDDSRWPLANLRTSNNTYAPLKTPVSLYGSDYGFHAGTLLFRGRFTARTARQQLFLSTQGGSAFASSVWLNDRFIGSFTGFDAASAANSSYTLDRLVRGRRYILTVVVDSTGLDENWTTGDDSMKAPRGILDYALTSSSGANVSISWKLTGNLGGEDYRDVFRGPLNEGGLFFERQGFHLPSPPLSDFTHGPSSSSSSSSPLDGIAHAGIAFYAAKLPLHLPAQEYDIPLSFVFDNATAAAPYRALLYVNGFQYGKYVSNIGPQTEFPVPEGILDYNGDNWIGVALWALESRGAKVPGLALKSKSPILTGRERVEVVKGPHFKKRHGAY,sabio,Q70SY0,O>>OCC1OC(O)C(O)C(O)C1O,5.68,81.4079358942818,30.0,5.0,3.2.1.23,51453.0,0.7543483357110189,O,OCC1OC(O)C(O)C(O)C1O,0.7543483357110189,O__MMRPVSLLSAVVLLLTGIDATSIGLHGGRPRDIILDDAKGPLQNIVTWDEHSLFVHGERVVIFSGEVHPFRLPVPSLYLDVFHKIKALGFNTVSFYVDWALLEGKPGRFRADGIFSLEPFFEAATKAGIYLLARPGPYINAEVSGGGFPGWLQRVKGKLRTDAPDYLHATDNYVAHIASIIAKAQITNGGPVILYQPENEYSGAAEGVLFPNKPYMQYVIDQARNAGIIVPLINNDAFPGGTGAPGTGLGSVDIYGHDGYPLGFDCAHPSAWPDNGLPTTWRQDHLNISPSTPFSLVEFQGGAFDPFGGWGFEQCSALVNHEFERVFYKNNMAAGVTIFNIYMTFGGTNWGNLGHPGGYTSYDYGASIREDRRIDREKYSELKLQGQFLKVSPGYITATPENATQGVYSDSQNIVITPLLAKESGDFFVVRHANYSSTDTASYTVKLPTSAGDLTIPQLGGSLTLTGRDSKIHVTDYPVGKFTLLYSTAEIFTWNEFAEKTVLVLYGGAQELHEFAVKNPFGSSKTAKAKKIEGSNVTIHTTSNLTVVLQWTASSARQVVQLGSLVIYMVDRNSAYNYWVPTLPGSGKQSAYGSSLMNPDSVIINGGYLIRSVAIKGNALSVQADFNVTTPLEIIGIPKGISKLAVNGKELGYSVSELGDWIAHPAIEIPHVQVPELTKLKWYKVDSLPEIRSNYDDSRWPLANLRTSNNTYAPLKTPVSLYGSDYGFHAGTLLFRGRFTARTARQQLFLSTQGGSAFASSVWLNDRFIGSFTGFDAASAANSSYTLDRLVRGRRYILTVVVDSTGLDENWTTGDDSMKAPRGILDYALTSSSGANVSISWKLTGNLGGEDYRDVFRGPLNEGGLFFERQGFHLPSPPLSDFTHGPSSSSSSSSPLDGIAHAGIAFYAAKLPLHLPAQEYDIPLSFVFDNATAAAPYRALLYVNGFQYGKYVSNIGPQTEFPVPEGILDYNGDNWIGVALWALESRGAKVPGLALKSKSPILTGRERVEVVKGPHFKKRHGAY,./data/raw/alphafold//AF-Q70SY0-F1-model_v4.pdb,989,517,160,173
+1904,17869,18117,MRILLSNDDGVHAPGIQTLAKALREFADVQVVAPDRNRSGASNSLTLESSLRTFTFENGDIAVQMGTPTDCVYLGVNALMRPRPDIVVSGINAGPNLGDDVIYSGTVAAAMEGRHLGFPALAVSLDGHKHYDTAAAVTCSILRALCKEPLRTGRILNINVPDLPLDQIKGIRVTRCGTRHPADQVIPQQDPRGNTLYWIGPPGGKCDAGPGTDFAAVDEGYVSITPLHVDLTAHSAQDVVSDWLNSVGVGTQW,sabio,P0A840,Nc1ccn(C2OC(CO)C(OP(=O)(O)O)C2O)c(=O)n1.O>>Nc1ccn(C2OC(CO)C(O)C2O)c(=O)n1.O=P(O)(O)O,5.93,0.0,37.0,7.0,3.1.3.6,562.0,0.7730546933642626,Nc1ccn(C2OC(CO)C(OP(=O)(O)O)C2O)c(=O)n1.O,Nc1ccn(C2OC(CO)C(O)C2O)c(=O)n1.O=P(O)(O)O,0.7730546933642626,Nc1ccn(C2OC(CO)C(OP(=O)(O)O)C2O)c(=O)n1.O__MRILLSNDDGVHAPGIQTLAKALREFADVQVVAPDRNRSGASNSLTLESSLRTFTFENGDIAVQMGTPTDCVYLGVNALMRPRPDIVVSGINAGPNLGDDVIYSGTVAAAMEGRHLGFPALAVSLDGHKHYDTAAAVTCSILRALCKEPLRTGRILNINVPDLPLDQIKGIRVTRCGTRHPADQVIPQQDPRGNTLYWIGPPGGKCDAGPGTDFAAVDEGYVSITPLHVDLTAHSAQDVVSDWLNSVGVGTQW,./data/raw/alphafold//AF-P0A840-F1-model_v4.pdb,2223,4461,4366,4252
+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
+1909,22900,23242,MNKAHYRQQVVNFLEKAHIRLTEEEKARIEIASFGLPDYPRSGLQLLTYCNSERYCAKELVLFPHQVCPEHRHPPFGSSMGKQETFRCRWGEVYLFVDDDSLTLNKNESGEPICPKPEGDEQWYQCDRFILLKPGEQYTIKPNTLHWFKAGSMGAVVSEFSSESRDEFDIFTDPRVRRLEGVE,uniprot_search,A0A379GZ77,OCC1(O)OC[C@@H](O)[C@@H]1O>>OC[C@H]1OC(O)[C@@H](O)[C@H]1O,34960.0,0.0,45.0,7.5,5.3.1.15,588.0,4.543571423962366,OCC1(O)OC[C@@H](O)[C@@H]1O,OC[C@H]1OC(O)[C@@H](O)[C@H]1O,4.543571423962366,OCC1(O)OC[C@@H](O)[C@@H]1O__MNKAHYRQQVVNFLEKAHIRLTEEEKARIEIASFGLPDYPRSGLQLLTYCNSERYCAKELVLFPHQVCPEHRHPPFGSSMGKQETFRCRWGEVYLFVDDDSLTLNKNESGEPICPKPEGDEQWYQCDRFILLKPGEQYTIKPNTLHWFKAGSMGAVVSEFSSESRDEFDIFTDPRVRRLEGVE,./data/raw/alphafold//AF-A0A379GZ77-F1-model_v4.pdb,843,304,6068,7003
+1910,18361,18621,MATDFSKLSKYVETLRVKPKQSIDLKKDFDTDYDHKMLTKEEGEELLNLGISKLSEIQEKLYASGTKSVLIVFQAMDAAGKDGTVKHIMTGLNPQGVKVTSFKVPSKIELSHDYLWRHYVALPATGEIGIFNRSHYENVLVTRVHPEYLLSEQTSGVTAIEQVNQKFWDKRFQQINNFEQHISENGTIVLKFFLHVSKKEQKKRFIERIELDTKNWKFSTGDLKERAHWKDYRNAYEDMLANTSTKQAPWFVIPADDKWFTRLLIAEIICTELEKLNLTFPTVSLEQKAELEKAKAELVAEKSSD,brenda,A0A6N4SMB5,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)O)[C@@H](O)[C@H]1O,16.83,10.314188182768982,30.0,8.0,2.7.4.1,985.0,1.2260841159758238,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)O)[C@@H](O)[C@H]1O,1.2260841159758238,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O__MATDFSKLSKYVETLRVKPKQSIDLKKDFDTDYDHKMLTKEEGEELLNLGISKLSEIQEKLYASGTKSVLIVFQAMDAAGKDGTVKHIMTGLNPQGVKVTSFKVPSKIELSHDYLWRHYVALPATGEIGIFNRSHYENVLVTRVHPEYLLSEQTSGVTAIEQVNQKFWDKRFQQINNFEQHISENGTIVLKFFLHVSKKEQKKRFIERIELDTKNWKFSTGDLKERAHWKDYRNAYEDMLANTSTKQAPWFVIPADDKWFTRLLIAEIICTELEKLNLTFPTVSLEQKAELEKAKAELVAEKSSD,./data/raw/alphafold//AF-A0A6N4SMB5-F1-model_v4.pdb,2479,4907,4979,4833
+1911,21792,22117,MFPRVVRLNSRLVSFALLGLQIANGAITYQHPDDLPSNVNYDFIVAGGGTAGLVVASRLSENSDWNILVIEAGPSNKDTPETRVPGLADSLPGSRTDWNYTTIPQDALGGRSLNYSRAKVLGGCSTHNGMVYTRGSEDDWNYWAEVTGDQALSWDSVLPIMKKAEKFSQDFSDQSVDGHIDPAVHGRDGLLSVVASYTNVSFNDLLLQTTKELSDEFPFKLDLNDGKPHELAWTQYTIDHNAERSSSATSYLETTGDNVHVLVNTHVTRIVSAGNGTNFRSVEFAVDSNSPKKVLQAKKELILSAGVIASPQVLMNSGIGGREELQAIGVDTLIDNPSVGKNLSDQAATLLMFDTTLPNTDYDVAAALTEWDKSRSGPMAHGARLNHLTWVRLPDDKLNGSDPSSGKDSPHIEFQFRQISHQLPPADVPNQVQLPDPDSIGVVLQFSVVNLYSISPGSVILNDNDPFANPMIDLNMFGDQKDIAILREGVRSARRMFSSPAFKDVINGTVYPPADVTSDEDLDAFLRTSAESYWHGVGTLSMSPQNASWGVVNPDFRVKGTSGLRVVDASVIPRAPAGHTQVPVYTFAEHASVLIAASYH,brenda,V5NC32,O=C1C=CC(=O)C=C1.OC[C@@H]1OC(O)[C@H](O)[C@H]1O>>O=CC(=O)[C@@H](O)[C@@H](O)CO.Oc1ccc(O)cc1,22.9,1.0985254450810515e-14,30.0,7.5,1.1.99.29,83518.0,1.359835482339888,O=C1C=CC(=O)C=C1.OC[C@@H]1OC(O)[C@H](O)[C@H]1O,O=CC(=O)[C@@H](O)[C@@H](O)CO.Oc1ccc(O)cc1,1.359835482339888,O=C1C=CC(=O)C=C1.OC[C@@H]1OC(O)[C@H](O)[C@H]1O__MFPRVVRLNSRLVSFALLGLQIANGAITYQHPDDLPSNVNYDFIVAGGGTAGLVVASRLSENSDWNILVIEAGPSNKDTPETRVPGLADSLPGSRTDWNYTTIPQDALGGRSLNYSRAKVLGGCSTHNGMVYTRGSEDDWNYWAEVTGDQALSWDSVLPIMKKAEKFSQDFSDQSVDGHIDPAVHGRDGLLSVVASYTNVSFNDLLLQTTKELSDEFPFKLDLNDGKPHELAWTQYTIDHNAERSSSATSYLETTGDNVHVLVNTHVTRIVSAGNGTNFRSVEFAVDSNSPKKVLQAKKELILSAGVIASPQVLMNSGIGGREELQAIGVDTLIDNPSVGKNLSDQAATLLMFDTTLPNTDYDVAAALTEWDKSRSGPMAHGARLNHLTWVRLPDDKLNGSDPSSGKDSPHIEFQFRQISHQLPPADVPNQVQLPDPDSIGVVLQFSVVNLYSISPGSVILNDNDPFANPMIDLNMFGDQKDIAILREGVRSARRMFSSPAFKDVINGTVYPPADVTSDEDLDAFLRTSAESYWHGVGTLSMSPQNASWGVVNPDFRVKGTSGLRVVDASVIPRAPAGHTQVPVYTFAEHASVLIAASYH,./data/raw/alphafold//AF-V5NC32-F1-model_v4.pdb,1062,627,1222,3150
+1912,15327,15542,MNSFLFSGGNMYDLIIIGGGPAGLAAGIYAVRFGLDTLVLEKSEISGQISMSDIVENYPGFPSISGLELMEKYRTHAQEVGVKTKITEVLSVRTEGAKKIVSTDSGDLEAKTLIIATGANPKHLGVPGEKEFISKGVSYCAICDGPFFKNKTVVVVGGGNSAVTDALLLSKVAQNVYLIHRRDRLKAAKVLQDRALATPNIEFILNTLVQEIAGSREGVKKVEKVILQDLNSKESRELSTNGVFIYVGIQPNTEFVNVEKNNEGFIITNRWMETSEKGIYAAGDCRDTPIWQLVAAVRDGAIAATAANEYIESLK,sabio,Q8TR16,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=C(O)c1cc(SSc2ccc([N+](=O)[O-])c(C(=O)O)c2)ccc1[N+](=O)[O-].[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.O=C(O)c1cc(S)ccc1[N+](=O)[O-],2340.0,9.542372191176089,,,1.8.1.9,2214.0,3.369215857410143,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=C(O)c1cc(SSc2ccc([N+](=O)[O-])c(C(=O)O)c2)ccc1[N+](=O)[O-].[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.O=C(O)c1cc(S)ccc1[N+](=O)[O-],3.369215857410143,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=C(O)c1cc(SSc2ccc([N+](=O)[O-])c(C(=O)O)c2)ccc1[N+](=O)[O-].[H]__MNSFLFSGGNMYDLIIIGGGPAGLAAGIYAVRFGLDTLVLEKSEISGQISMSDIVENYPGFPSISGLELMEKYRTHAQEVGVKTKITEVLSVRTEGAKKIVSTDSGDLEAKTLIIATGANPKHLGVPGEKEFISKGVSYCAICDGPFFKNKTVVVVGGGNSAVTDALLLSKVAQNVYLIHRRDRLKAAKVLQDRALATPNIEFILNTLVQEIAGSREGVKKVEKVILQDLNSKESRELSTNGVFIYVGIQPNTEFVNVEKNNEGFIITNRWMETSEKGIYAAGDCRDTPIWQLVAAVRDGAIAATAANEYIESLK,./data/raw/alphafold//AF-Q8TR16-F1-model_v4.pdb,913,417,56,58
+1913,10219,10370,MSDCRTYGFNTQIVHAGQQPDPSTGALSTPIFQTSTFVFDSAEQGAARFALEESGYIYTRLGNPTTDALEKKLAVLERGEAGLATASGISAITTTLLTLCQQGDHIVSASAIYGCTHAFLSHSMPKFGINVRLVDAGKPEEIRAAMRPETKVVYIETPANPTLSLVDIETVAGIAHQQGALLVVDNTFMSPYCQQPLQLGADIVVHSVTKYINGHGDVIGGIIVGKQEFIDQARFVGLKDITGGCMSPFNAWLTLRGVKTLGIRMERHCENALKIARFLEGHPSITRVYYPGLSSHPQYELGQRQMSLPGGIISFEIAGGLEAGRRMINSVELCLLAVSLGDTETLIQHPASMTHSPVAPEERLKAGITDGLIRLSVGLEDPEDIINDLEHAIRKATF,brenda,Q84AR1,CSC[C@H](N)C(=O)O.O>>CC(=O)C(=O)O.CS.N,4.6,9.245658650255366e-15,30.0,8.0,4.4.1.11,546.0,0.6627578316815741,CSC[C@H](N)C(=O)O.O,CC(=O)C(=O)O.CS.N,0.7759743311293691,CSC[C@H](N)C(=O)O.O__MSDCRTYGFNTQIVHAGQQPDPSTGALSTPIFQTSTFVFDSAEQGAARFALEESGYIYTRLGNPTTDALEKKLAVLERGEAGLATASGISAITTTLLTLCQQGDHIVSASAIYGCTHAFLSHSMPKFGINVRLVDAGKPEEIRAAMRPETKVVYIETPANPTLSLVDIETVAGIAHQQGALLVVDNTFMSPYCQQPLQLGADIVVHSVTKYINGHGDVIGGIIVGKQEFIDQARFVGLKDITGGCMSPFNAWLTLRGVKTLGIRMERHCENALKIARFLEGHPSITRVYYPGLSSHPQYELGQRQMSLPGGIISFEIAGGLEAGRRMINSVELCLLAVSLGDTETLIQHPASMTHSPVAPEERLKAGITDGLIRLSVGLEDPEDIINDLEHAIRKATF,./data/raw/alphafold//AF-Q84AR1-F1-model_v4.pdb,2662,2241,3933,2809
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+1923,1203,1230,MRGLSRRVQAMKPSATVAVNAKALELRRQGVDLVALTAGEPDFDTPEHVKEAARRALAQGKTKYAPPAGIPELREALAEKFRRENGLSVTPEETIVTVGGKQALFNLFQAILDPGDEVIVLSPYWVSYPEMVRFAGGVVVEVETLPEEGFVPDPERVRRAITPRTKALVVNSPNNPTGAVYPKEVLEALARLAVEHDFYLVSDEIYEHLLYEGEHFSPGRVAPEHTLTVNGAAKAFAMTGWRIGYACGPKEVIKAMASVSSQSTTSPDTIAQWATLEALTNQEASRAFVEMAREAYRRRRDLLLEGLTALGLKAVRPSGAFYVLMDTSPIAPDEVRAAERLLEAGVAVVPGTDFAAFGHVRLSYATSEENLRKALERFARVLGRA,brenda,Q56232,CC(=O)C(=O)O.N[C@@H](CC(=O)O)C(=O)O>>C[C@H](N)C(=O)O.O=C(O)CC(=O)C(=O)O,120.0,0.0,25.0,8.0,2.6.1.1,274.0,2.0791812460476247,CC(=O)C(=O)O.N[C@@H](CC(=O)O)C(=O)O,C[C@H](N)C(=O)O.O=C(O)CC(=O)C(=O)O,2.0791812460476247,CC(=O)C(=O)O.N[C@@H](CC(=O)O)C(=O)O__MRGLSRRVQAMKPSATVAVNAKALELRRQGVDLVALTAGEPDFDTPEHVKEAARRALAQGKTKYAPPAGIPELREALAEKFRRENGLSVTPEETIVTVGGKQALFNLFQAILDPGDEVIVLSPYWVSYPEMVRFAGGVVVEVETLPEEGFVPDPERVRRAITPRTKALVVNSPNNPTGAVYPKEVLEALARLAVEHDFYLVSDEIYEHLLYEGEHFSPGRVAPEHTLTVNGAAKAFAMTGWRIGYACGPKEVIKAMASVSSQSTTSPDTIAQWATLEALTNQEASRAFVEMAREAYRRRRDLLLEGLTALGLKAVRPSGAFYVLMDTSPIAPDEVRAAERLLEAGVAVVPGTDFAAFGHVRLSYATSEENLRKALERFARVLGRA,./data/raw/alphafold//AF-Q56232-F1-model_v4.pdb,1293,3842,6158,809
+1924,17538,17776,MLELNGPLNGPARRSRAVALLATGAALAATLLGTASGAADAVPTTAKTTATTAAAKGHVRTKAGAPAIPVANVKAHLNQLQSIARANNGNRAHGRSGYKASVDYVKGKLDAAGFTTTVQQFSANGATGYNLIADWPGGDTDHVVFAGSHLDSVSAGPGINDNGSGSAGVLEVALAVAREGYKPDKHLRFGWWGAEELGMVGSQNYVDNLSSADRSKIDAYLNFDMIGSPNPGYYVYGYDANLQSLFENWFAAKNIATEVDHEGDGRSDHAPFQNVGIPVGGLFSGADYIKTAEQAQKWGGTAGRAFDACYHRSCDTYANLNDTALGTNTDAIAGAVWSLSGSATS,brenda,Q75V72,N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>N[C@@H](Cc1ccccc1)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,17.6,0.0,37.0,8.0,3.4.11.24,156648.0,1.24551266781415,N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,N[C@@H](Cc1ccccc1)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,1.24551266781415,N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MLELNGPLNGPARRSRAVALLATGAALAATLLGTASGAADAVPTTAKTTATTAAAKGHVRTKAGAPAIPVANVKAHLNQLQSIARANNGNRAHGRSGYKASVDYVKGKLDAAGFTTTVQQFSANGATGYNLIADWPGGDTDHVVFAGSHLDSVSAGPGINDNGSGSAGVLEVALAVAREGYKPDKHLRFGWWGAEELGMVGSQNYVDNLSSADRSKIDAYLNFDMIGSPNPGYYVYGYDANLQSLFENWFAAKNIATEVDHEGDGRSDHAPFQNVGIPVGGLFSGADYIKTAEQAQKWGGTAGRAFDACYHRSCDTYANLNDTALGTNTDAIAGAVWSLSGSATS,./data/raw/alphafold//AF-Q75V72-F1-model_v4.pdb,1842,1531,3111,1875
+1925,22170,22503,MSVKNLGYMGFSVKDVPAWRSFMTHKLGLHEAIGDDTHALYRLDSRAWRIAVDKGDADDLAYAGYEVTDARDLAQMEEKLKQAGVAVTNDAALAKRRGVLGLISFSDPFGLPLEIYYGPSEVFDQPFASPTGVSGFLTGEQGLGHFVRCVPDPQKALAFYTDVLGFQLSDVIDIKAGPNFVVPAYFLHCNGRHHTIALAAFPLPRRIHHFMIEANSLDDVGLAYDRIAADDMITSTLGRHSNDHMVSFYAVTPSGFDVEFGWGARTVDASWTVVRHDAISVWGHKPVRHGALVPGQVVPTGETA,brenda,A9QT35,O=O.Oc1cccc(-c2ccccc2)c1O>>O=C(O)/C(O)=C/C=C/C(=O)c1ccccc1,84.1,0.0,20.0,8.0,1.13.11.39,363848.0,1.924795995797912,O=O.Oc1cccc(-c2ccccc2)c1O,O=C(O)/C(O)=C/C=C/C(=O)c1ccccc1,1.924795995797912,O=O.Oc1cccc(-c2ccccc2)c1O__MSVKNLGYMGFSVKDVPAWRSFMTHKLGLHEAIGDDTHALYRLDSRAWRIAVDKGDADDLAYAGYEVTDARDLAQMEEKLKQAGVAVTNDAALAKRRGVLGLISFSDPFGLPLEIYYGPSEVFDQPFASPTGVSGFLTGEQGLGHFVRCVPDPQKALAFYTDVLGFQLSDVIDIKAGPNFVVPAYFLHCNGRHHTIALAAFPLPRRIHHFMIEANSLDDVGLAYDRIAADDMITSTLGRHSNDHMVSFYAVTPSGFDVEFGWGARTVDASWTVVRHDAISVWGHKPVRHGALVPGQVVPTGETA,./data/raw/alphafold//AF-A9QT35-F1-model_v4.pdb,2011,4170,4024,3869
+1926,19394,19680,MKSTVASALLVLAGTAVQAQSGPWQQCGGIGWQGPFTCVSGHTCQVLNDWYHQCVPGGGPSPPPTSPPPTTPPPTSPPPTSPPPTSPPPTSPPPTSPPPTSPPPTSPPPTSPPPTSPPPTSPPPSSGSCPSTPGGLGSGNQRLPDPFTFHNGNTVTSAADFQCRQREVSSLIQQYELGQFPAPPQSVTSSYSGNTLSITVSDQGRSISFSVSISGGSGSKSPAIIAYGAPSIPVPNGVATIRFNNDDIAAQQSGSSRGQGKFYNLYGSGHSAGAMTAWAWGVARIIDALEKTPAAGIDPTRVGVTGCSRNGKGAMVAGALEPRIALTIPQESGSGGSACWRISNWQGQQGQNVQTPAQIITENVWLGPVFNNHANNVNALPFDHHQLAGLIAPRALYVIENSDMEWLGWTATYGCMAAARTQWEALGALDNFGFSQVGGNQHCSFNSGKQSAELNAFINKFLLQSGGGTTSILRTERNHGSFNLAEWTPWNVPNLR,sabio,A0A1D8EJG8,O.O=C(OCc1ccccc1)C1OC(O)[C@@H](O)C(O)[C@@H]1O>>O=C(O)C1OC(O)C(O)C(O)C1O.OCc1ccccc1,0.79,0.0,35.0,,3.1.1.117,398408.0,-0.1023729087095585,O.O=C(OCc1ccccc1)C1OC(O)[C@@H](O)C(O)[C@@H]1O,O=C(O)C1OC(O)C(O)C(O)C1O.OCc1ccccc1,-0.1023729087095585,O.O=C(OCc1ccccc1)C1OC(O)[C@@H](O)C(O)[C@@H]1O__MKSTVASALLVLAGTAVQAQSGPWQQCGGIGWQGPFTCVSGHTCQVLNDWYHQCVPGGGPSPPPTSPPPTTPPPTSPPPTSPPPTSPPPTSPPPTSPPPTSPPPTSPPPTSPPPTSPPPTSPPPSSGSCPSTPGGLGSGNQRLPDPFTFHNGNTVTSAADFQCRQREVSSLIQQYELGQFPAPPQSVTSSYSGNTLSITVSDQGRSISFSVSISGGSGSKSPAIIAYGAPSIPVPNGVATIRFNNDDIAAQQSGSSRGQGKFYNLYGSGHSAGAMTAWAWGVARIIDALEKTPAAGIDPTRVGVTGCSRNGKGAMVAGALEPRIALTIPQESGSGGSACWRISNWQGQQGQNVQTPAQIITENVWLGPVFNNHANNVNALPFDHHQLAGLIAPRALYVIENSDMEWLGWTATYGCMAAARTQWEALGALDNFGFSQVGGNQHCSFNSGKQSAELNAFINKFLLQSGGGTTSILRTERNHGSFNLAEWTPWNVPNLR,./data/raw/alphafold//AF-A0A1D8EJG8-F1-model_v4.pdb,3536,3474,5113,5974
+1927,21184,21508,MTPQKSDACSDPVYTVGDYLLDRLAELGVSEIFGVPGDYNLQFLDHIVAHPTIRWVGSANELNAGYAADGYGRLRGMSAVVTTFGVGELSVTNAIAGSYAEHVPVVHIVGGPTKDAQGTRRALHHSLGDGDFEHFLRISREITCAQANLMPATAGREIDRVLSEVREQKRPGYILLSSDVARFPTEPPAAPLPRYPGGTSPRALSLFTKAAIELIADHQLTVLADLLVHRLQAVKELEALLAADVVPHATLMWGKSLLDESSPNFLGIYAGAASAERVRAAIEGAPVLVTAGVVFTDMVSGFFSQRIDPARTIDIGQYQSSVADQVFAPLEMSAALQALATILTGRGISSPPVVPPPAEPPPAMPARDEPLTQQMVWDRVCSALTPGNVVLADQGTSFYGMADHRLPQGVTFIGQPLWGSIGYTLPAAVGAAVAHPDRRTVLLIGDGAAQLTVQELGTFSREGLSPVIVVVNNDGYTVERAIHGETAPYNDIVSWNWTELPSALGVTNHLAFRAQTYGQLDDALTVAAARRDRMVLVEVVLPRLEIPRLLGQLVGSMAPQ,brenda,P9WG37,O=C(O)C(=O)Cc1ccccc1>>O=C=O.O=CCc1ccccc1,7.5,8.630423123528491e-15,25.0,7.5,4.1.1.72,1773.0,0.8750612633917001,O=C(O)C(=O)Cc1ccccc1,O=C=O.O=CCc1ccccc1,0.8750612633917001,O=C(O)C(=O)Cc1ccccc1__MTPQKSDACSDPVYTVGDYLLDRLAELGVSEIFGVPGDYNLQFLDHIVAHPTIRWVGSANELNAGYAADGYGRLRGMSAVVTTFGVGELSVTNAIAGSYAEHVPVVHIVGGPTKDAQGTRRALHHSLGDGDFEHFLRISREITCAQANLMPATAGREIDRVLSEVREQKRPGYILLSSDVARFPTEPPAAPLPRYPGGTSPRALSLFTKAAIELIADHQLTVLADLLVHRLQAVKELEALLAADVVPHATLMWGKSLLDESSPNFLGIYAGAASAERVRAAIEGAPVLVTAGVVFTDMVSGFFSQRIDPARTIDIGQYQSSVADQVFAPLEMSAALQALATILTGRGISSPPVVPPPAEPPPAMPARDEPLTQQMVWDRVCSALTPGNVVLADQGTSFYGMADHRLPQGVTFIGQPLWGSIGYTLPAAVGAAVAHPDRRTVLLIGDGAAQLTVQELGTFSREGLSPVIVVVNNDGYTVERAIHGETAPYNDIVSWNWTELPSALGVTNHLAFRAQTYGQLDDALTVAAARRDRMVLVEVVLPRLEIPRLLGQLVGSMAPQ,./data/raw/alphafold//AF-P9WG37-F1-model_v4.pdb,900,3069,606,696
+1928,19547,19833,MSATESSSIFTLSHNSNLQDILAANAKWASQMNNIQPTLFPDHNAKGQSPHTLFIGCSDSRYNENCLGVLPGEVFTWKNVANICHSEDLTLKATLEFAIICLKVNKVIICGHTDCGGIKTCLTNQREALPKVNCSHLYKYLDDIDTMYHEESQNLIHLKTQREKSHYLSHCNVKRQFNRIIENPTVQTAVQNGELQVYGLLYNVEDGLLQTVSTYTKVTPK,uniprot_search,A0A6A5Q7R6,O.O=C=O>>O=C(O)O,940000.0,5.682159936665122e-15,20.0,8.3,4.2.1.1,4932.0,5.973127853599698,O.O=C=O,O=C(O)O,5.973127853599698,O.O=C=O__MSATESSSIFTLSHNSNLQDILAANAKWASQMNNIQPTLFPDHNAKGQSPHTLFIGCSDSRYNENCLGVLPGEVFTWKNVANICHSEDLTLKATLEFAIICLKVNKVIICGHTDCGGIKTCLTNQREALPKVNCSHLYKYLDDIDTMYHEESQNLIHLKTQREKSHYLSHCNVKRQFNRIIENPTVQTAVQNGELQVYGLLYNVEDGLLQTVSTYTKVTPK,./data/raw/alphafold//AF-A0A6A5Q7R6-F1-model_v4.pdb,301,2842,5164,6027
+1929,4513,4568,MSTAGKVIKCKAAVLWEVKKPFSIEDVEVAPPKAYEVRIKMVAVGICHTDDHVVSGNLVTPLPVILGHEAAGIVESVGEGVTTVKPGDKVIPLFTPQCGKCRVCKNPESNYCLKNDLGNPRGTLQDGTRRFTCRGKPIHHFLGTSTFSQYTVVDENAVAKIDAASPLEKVCLIGCGFSTGYGSAVNVAKVTPGSTCAVFGLGGVGLSAVMGCKAAGAARIIAVDINKDKFAKAKELGATECINPQDYKKPIQEVLKEMTDGGVDFSFEVIGRLDTMMASLLCCHEACGTSVIVGVPPASQNLSINPMLLLTGRTWKGAVYGGFKSKEGIPKLVADFMAKKFSLDALITHVLPFEKINEGFDLLHSGKSIRTVLTF,sabio,P00325,CC(C=CC=C(C)C=CC1=C(C)C=CCC1(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.[H]>>CC1=C(C(CC=C1)(C)C)/C=C/C(=C/C=C/C(=C/CO)/C)/C.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)c1,780.0,0.0,25.0,7.5,1.1.1.1,9606.0,2.8920946026904804,CC(C=CC=C(C)C=CC1=C(C)C=CCC1(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.[H],CC1=C(C(CC=C1)(C)C)/C=C/C(=C/C=C/C(=C/CO)/C)/C.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)c1,2.8920946026904804,CC(C=CC=C(C)C=CC1=C(C)C=CCC1(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.[H]__MSTAGKVIKCKAAVLWEVKKPFSIEDVEVAPPKAYEVRIKMVAVGICHTDDHVVSGNLVTPLPVILGHEAAGIVESVGEGVTTVKPGDKVIPLFTPQCGKCRVCKNPESNYCLKNDLGNPRGTLQDGTRRFTCRGKPIHHFLGTSTFSQYTVVDENAVAKIDAASPLEKVCLIGCGFSTGYGSAVNVAKVTPGSTCAVFGLGGVGLSAVMGCKAAGAARIIAVDINKDKFAKAKELGATECINPQDYKKPIQEVLKEMTDGGVDFSFEVIGRLDTMMASLLCCHEACGTSVIVGVPPASQNLSINPMLLLTGRTWKGAVYGGFKSKEGIPKLVADFMAKKFSLDALITHVLPFEKINEGFDLLHSGKSIRTVLTF,./data/raw/alphafold//AF-P00325-F1-model_v4.pdb,1323,1999,6213,2060
+1930,5060,5146,MKEIKLILTDIDGVWTDGGMFYDQTGNEWKKFNTSDSAGIFWAHNKGIPVGILTGEKTEIVRRRAEKLKVDYLFQGVVDKLSAAEELCNELGINLEQVAYIGDDLNDAKLLKRVGIAGVPASAPFYIRRLSTIFLEKRGGEGVFREFVEKVLGINLEDFIAVIQ,brenda,Q8A712,CC(O)=N[C@H]1[C@H]([C@H](O)[C@H](O)COP(=O)(O)O)O[C@@](O)(C(=O)O)C[C@@H]1O.O>>CC(O)=N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](O)(C(=O)O)C[C@@H]1O.O=P(O)(O)O,0.73,1.3940239809892468e-14,37.0,7.0,3.1.3.103,818.0,-0.1366771398795441,CC(O)=N[C@H]1[C@H]([C@H](O)[C@H](O)COP(=O)(O)O)O[C@@](O)(C(=O)O)C[C@@H]1O.O,CC(O)=N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](O)(C(=O)O)C[C@@H]1O.O=P(O)(O)O,-0.1366771398795441,CC(O)=N[C@H]1[C@H]([C@H](O)[C@H](O)COP(=O)(O)O)O[C@@](O)(C(=O)O)C[C@@H]1O.O__MKEIKLILTDIDGVWTDGGMFYDQTGNEWKKFNTSDSAGIFWAHNKGIPVGILTGEKTEIVRRRAEKLKVDYLFQGVVDKLSAAEELCNELGINLEQVAYIGDDLNDAKLLKRVGIAGVPASAPFYIRRLSTIFLEKRGGEGVFREFVEKVLGINLEDFIAVIQ,./data/raw/alphafold//AF-Q8A712-F1-model_v4.pdb,3079,1835,3462,2270
+1931,10180,10331,MTSKGPEEEHPSVTLFRQYLRIRTVQPKPDYGAAVAFFEETARQLGLGCQKVEVAPGYVVTVLTWPGTNPTLSSILLNSHTDVVPVFKEHWSHDPFEAFKDSEGYIYARGAQDMKCVSIQYLEAVRRLKVEGHRFPRTIHMTFVPDEEVGGHQGMELFVQRPEFHALRAGFALDEGIANPTDAFTVFYSERSPWWVRVTSTGRPGHASRFMEDTAAEKLHKVVNSILAFREKEWQRLQSNPHLKEGSVTSVNLTKLEGGVAYNVIPATMSASFDFRVAPDVDFKAFEEQLQSWCQAAGEGVTLEFAQKWMHPQVTPTDDSNPWWAAFSRVCKDMNLTLEPEIMPAATDNRYIRAVGVPALGFSPMNRTPVLLHDHDERLHEAVFLRGVDIYTRLLPALASVPALPSDS,brenda,Q03154,CSCC[C@H](N=CO)C(=O)O.O>>CSCC[C@H](N)C(=O)O.O=CO,177.0,0.0,37.0,7.6,3.5.1.14,9606.0,2.247973266361807,CSCC[C@H](N=CO)C(=O)O.O,CSCC[C@H](N)C(=O)O.O=CO,2.247973266361807,CSCC[C@H](N=CO)C(=O)O.O__MTSKGPEEEHPSVTLFRQYLRIRTVQPKPDYGAAVAFFEETARQLGLGCQKVEVAPGYVVTVLTWPGTNPTLSSILLNSHTDVVPVFKEHWSHDPFEAFKDSEGYIYARGAQDMKCVSIQYLEAVRRLKVEGHRFPRTIHMTFVPDEEVGGHQGMELFVQRPEFHALRAGFALDEGIANPTDAFTVFYSERSPWWVRVTSTGRPGHASRFMEDTAAEKLHKVVNSILAFREKEWQRLQSNPHLKEGSVTSVNLTKLEGGVAYNVIPATMSASFDFRVAPDVDFKAFEEQLQSWCQAAGEGVTLEFAQKWMHPQVTPTDDSNPWWAAFSRVCKDMNLTLEPEIMPAATDNRYIRAVGVPALGFSPMNRTPVLLHDHDERLHEAVFLRGVDIYTRLLPALASVPALPSDS,./data/raw/alphafold//AF-Q03154-F1-model_v4.pdb,2954,1690,3302,2109
+1932,15047,15258,MARKSSAPQFLSYGDATGRLSWRDAVEALRQGHTLPQAQIRDVFLGPPTGTMMSRSAWIEGLGYGAKTFTVFDGNAARGLPTVQGAMLVFDKDDGRLQAIVDSPLVTEFKTAADSVLGASLLARPDSRHLLIVGAGTVAASLVRAYTAVLPGIERVSVWARRPQQAQDLIEGLDGIEADLAAVSDLPAAVGQADIVSSATMARQPVILGAWVRPGTHVDLIGAFKADMREADDALMARAALFVDSRETTLGHIGELMLPIASGAITAESVLGDLYDLVRPGARRRQSEDEITVFKNGGGAHLDLMIASYIARVMAG,sabio,A1B196,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)C1=NCCC1.[H]>>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.O=C(O)C1CCCN1,81.0,0.0,25.0,7.6,1.5.1.49,266.0,1.9084850188786493,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)C1=NCCC1.[H],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.O=C(O)C1CCCN1,1.9084850188786493,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C(O)C1=NCCC1.[H]__MARKSSAPQFLSYGDATGRLSWRDAVEALRQGHTLPQAQIRDVFLGPPTGTMMSRSAWIEGLGYGAKTFTVFDGNAARGLPTVQGAMLVFDKDDGRLQAIVDSPLVTEFKTAADSVLGASLLARPDSRHLLIVGAGTVAASLVRAYTAVLPGIERVSVWARRPQQAQDLIEGLDGIEADLAAVSDLPAAVGQADIVSSATMARQPVILGAWVRPGTHVDLIGAFKADMREADDALMARAALFVDSRETTLGHIGELMLPIASGAITAESVLGDLYDLVRPGARRRQSEDEITVFKNGGGAHLDLMIASYIARVMAG,./data/raw/alphafold//AF-A1B196-F1-model_v4.pdb,2538,4980,2059,4915
+1933,5295,5381,MANLRESSRDKSRWSLEGMTALVTGGSKGIGEAVVEELAMLGARVHTCARDETQLQESLREWQAKGFQVTTSVCDVSSRDQREKLMETVSSLFQGKLNILVNNAGTCITKPTIDYTSEDFSFLMSTNLESSFHLSQLAHPLLKSSGLGSIVLISSVASVVHVNVGSIYGATKGAMNQLARNLACEWASDSIKVNSVCPGFISTPLASNYFRNEEFKKEVENIIPTGRVGEANEVSSLVAYLCLPAASYVTGQTICVDGGFSVNGFTFKSLPLR,sabio,A7DY56,CC1(C)C2CCC1(C)C(O)C2.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>>CC12CCC(CC1=O)C2(C)C.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],0.09,6.321765501607927e-15,30.0,9.5,1.1.1.-,270110.0,-1.0457574905606752,CC1(C)C2CCC1(C)C(O)C2.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,CC12CCC(CC1=O)C2(C)C.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],-1.0457574905606752,CC1(C)C2CCC1(C)C(O)C2.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__MANLRESSRDKSRWSLEGMTALVTGGSKGIGEAVVEELAMLGARVHTCARDETQLQESLREWQAKGFQVTTSVCDVSSRDQREKLMETVSSLFQGKLNILVNNAGTCITKPTIDYTSEDFSFLMSTNLESSFHLSQLAHPLLKSSGLGSIVLISSVASVVHVNVGSIYGATKGAMNQLARNLACEWASDSIKVNSVCPGFISTPLASNYFRNEEFKKEVENIIPTGRVGEANEVSSLVAYLCLPAASYVTGQTICVDGGFSVNGFTFKSLPLR,./data/raw/alphafold//AF-A7DY56-F1-model_v4.pdb,3453,1430,337,381
+1934,1159,1186,VLVGSGMIGGVMATLIVQKNLGDVVMFDIVKNMPLGKALDTSHTNVMAYSNCQVTGSNTYEDLKGADVVIVTAGFTKAPGKSDKEWNRDDLLPLNNKIMIEIGGHIKNYCPNAFIIVVTNPADVMVQLLHQHSGVSKNKIVGLGGVLDTSRLKYYISQKLNVCPRDVNAHIVGAHGNKMVVLKRYITVGGIPLQEFINNKKITDAELDAIFDRTVNTALEIVNYHASPYVAPAAAIIEMAESYLKDLKKVLICSTLLEGQYGHTGVFGGTPLVLGCNGVEQVFELQLNAEEKKMFDDAI,sabio,Q6JH32,CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]>>CC(O)C(=O)O.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)c1,960000.0,0.0,25.0,7.5,1.1.1.27,36330.0,5.982271233039569,CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],CC(O)C(=O)O.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)c1,5.982271233039569,CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]__VLVGSGMIGGVMATLIVQKNLGDVVMFDIVKNMPLGKALDTSHTNVMAYSNCQVTGSNTYEDLKGADVVIVTAGFTKAPGKSDKEWNRDDLLPLNNKIMIEIGGHIKNYCPNAFIIVVTNPADVMVQLLHQHSGVSKNKIVGLGGVLDTSRLKYYISQKLNVCPRDVNAHIVGAHGNKMVVLKRYITVGGIPLQEFINNKKITDAELDAIFDRTVNTALEIVNYHASPYVAPAAAIIEMAESYLKDLKKVLICSTLLEGQYGHTGVFGGTPLVLGCNGVEQVFELQLNAEEKKMFDDAI,./data/raw/alphafold//AF-Q6JH32-F1-model_v4.pdb,1258,5198,1583,783
+1935,10367,10519,MKAARFHGQKDIRIEEIPEPELRPGTVKLKVAWCGICGTDLHEYLEGPIFISAPGHPHPLSHENAPVTMGHEFSGTVEEVGEGVTDVEVGENVVVEPYFVCNECAPCKAGNYHLCTKMGFIGLAGGGGGLSEKVVVDRRWIHKIGNIPLDEAALIEPLSVAHHAVVRSGAESGNVAIVGGAGPIGLLVAAVLKGLGVTTIVTELSEARKAKALSSGVADYVIDPTTEDVKARVLELSGGIGADIGFECAGVNAVLDTMLDTVRPAGVVVNVSIWGKPATIDMQKLVLKEIDLRGTIAYVRDHEAVIKMVQDGVVDLAPFITGRIQLEELISEGFTTLIEHNDTAVKILVRS,brenda,A0A0E4A9D6,C[C@@H](O)[C@@H](C)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>>CC(=O)C(C)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+],4.28,7.528331372448283e-15,55.0,6.5,1.1.1.4,1833.0,0.631443769013172,C[C@@H](O)[C@@H](C)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,CC(=O)C(C)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+],0.631443769013172,C[C@@H](O)[C@@H](C)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__MKAARFHGQKDIRIEEIPEPELRPGTVKLKVAWCGICGTDLHEYLEGPIFISAPGHPHPLSHENAPVTMGHEFSGTVEEVGEGVTDVEVGENVVVEPYFVCNECAPCKAGNYHLCTKMGFIGLAGGGGGLSEKVVVDRRWIHKIGNIPLDEAALIEPLSVAHHAVVRSGAESGNVAIVGGAGPIGLLVAAVLKGLGVTTIVTELSEARKAKALSSGVADYVIDPTTEDVKARVLELSGGIGADIGFECAGVNAVLDTMLDTVRPAGVVVNVSIWGKPATIDMQKLVLKEIDLRGTIAYVRDHEAVIKMVQDGVVDLAPFITGRIQLEELISEGFTTLIEHNDTAVKILVRS,./data/raw/alphafold//AF-A0A0E4A9D6-F1-model_v4.pdb,1317,3877,6195,854
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+1945,22932,23274,MKKTFKLILVLMLSLTLVFGLTAPIQAASDTAVSNVVNYSTDVIYQIVTDRFVDGNTSNNPTGDLYDPTHTSLKKYFGGDWQGIINKINDGYLTGMGVTAIWISQPVENIYAVLPDSTFGGSTSYHGYWARDFKRTNPYFGSFTDFQNLINTAHAHNIKVIIDFAPNHTSPASETDPTYAENGRLYDNGTLLGGYTNDTNGYFHHYGGTDFSSYEDGIYRNLFDLADLNQQNSTIDSYLKSAIKVWLDMGIDGIRLDAVKHMPFGWQKNFMDSILSYRPVFTFGEWFLGTNEIDVNNTYFANESGMSLLDFRFSQKVRQVFRDNTDTMYGLDSMIQSTASDYNFINDMVTFIDNHDMDRFYNGGSTRPVEQALAFTLTSRGVPAIYYGTEQYMTGNGDPYNRAMMTSFNTSTTAYNVIKKLAPLRKSNPAIAYGTTQQRWINNDVYIYERKFGNNVALVAINRNLSTSYNITGLYTALPAGTYTDVLGGLLNGNSISVASDGSVTPFTLSAGEVAVWQYVSSSNSPLIGHVGPTMTKAGQTITIDGRGFGTTSGQVLFGSTAGTIVSWDDTEVKVKVPSVTPGKYNISLKTSSGATSNTYNNINILTGNQICVRFVVNNASTVYGENVYLTGNVAELGNWDTSKAIGPMFNQVVYQYPTWYYDVSVPAGTTIQFKFIKKNGNTITWEGGSNHTYTVPSSSTGTVIVNWQQ,sabio,P26827,OCC1OC(OC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O>>CCO,1115.0,83.11209105233478,60.0,6.0,2.4.1.19,33950.0,3.0472748673841794,OCC1OC(OC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,CCO,3.0472748673841794,OCC1OC(OC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O__MKKTFKLILVLMLSLTLVFGLTAPIQAASDTAVSNVVNYSTDVIYQIVTDRFVDGNTSNNPTGDLYDPTHTSLKKYFGGDWQGIINKINDGYLTGMGVTAIWISQPVENIYAVLPDSTFGGSTSYHGYWARDFKRTNPYFGSFTDFQNLINTAHAHNIKVIIDFAPNHTSPASETDPTYAENGRLYDNGTLLGGYTNDTNGYFHHYGGTDFSSYEDGIYRNLFDLADLNQQNSTIDSYLKSAIKVWLDMGIDGIRLDAVKHMPFGWQKNFMDSILSYRPVFTFGEWFLGTNEIDVNNTYFANESGMSLLDFRFSQKVRQVFRDNTDTMYGLDSMIQSTASDYNFINDMVTFIDNHDMDRFYNGGSTRPVEQALAFTLTSRGVPAIYYGTEQYMTGNGDPYNRAMMTSFNTSTTAYNVIKKLAPLRKSNPAIAYGTTQQRWINNDVYIYERKFGNNVALVAINRNLSTSYNITGLYTALPAGTYTDVLGGLLNGNSISVASDGSVTPFTLSAGEVAVWQYVSSSNSPLIGHVGPTMTKAGQTITIDGRGFGTTSGQVLFGSTAGTIVSWDDTEVKVKVPSVTPGKYNISLKTSSGATSNTYNNINILTGNQICVRFVVNNASTVYGENVYLTGNVAELGNWDTSKAIGPMFNQVVYQYPTWYYDVSVPAGTTIQFKFIKKNGNTITWEGGSNHTYTVPSSSTGTVIVNWQQ,./data/raw/alphafold//AF-P26827-F1-model_v4.pdb,985,514,157,168
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+1948,12451,12621,MSEKTVLSIQSFVTHGYVGNKAATFPLQLHGFDVDGINTVCLSNHSGYPVIRGHRMSLQEYDELMEGVRANNFLSNYRYILTGYINNVDIIGRIRDTLKEVRELREKEDKKLTFICDPVMGDDGIMYCKKEVLDAYRELVPLADIVTPNYFEASLLSGVTVNDLSSAILAADWFHNCGVAHVIIKSFREQENPTHLRFLYSVKEGSEAAVRRFSGVVPYHEGRYTGTGDVFAACLLAFSHSHPMDVAIGKSMAVLQELIIATRKEGGDGKSSLKSRELRVVASPQVVLQPSTVVDVKPIS,uniprot_search,O15927,Cc1ncc(CO)c(CN)c1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>Cc1ncc(COP(=O)([O-])O)c(CN)c1[O-].Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,127.0,0.1493620993672912,37.0,7.4,2.7.1.35,5691.0,2.103803720955957,Cc1ncc(CO)c(CN)c1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,Cc1ncc(COP(=O)([O-])O)c(CN)c1[O-].Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,2.103803720955957,Cc1ncc(CO)c(CN)c1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MSEKTVLSIQSFVTHGYVGNKAATFPLQLHGFDVDGINTVCLSNHSGYPVIRGHRMSLQEYDELMEGVRANNFLSNYRYILTGYINNVDIIGRIRDTLKEVRELREKEDKKLTFICDPVMGDDGIMYCKKEVLDAYRELVPLADIVTPNYFEASLLSGVTVNDLSSAILAADWFHNCGVAHVIIKSFREQENPTHLRFLYSVKEGSEAAVRRFSGVVPYHEGRYTGTGDVFAACLLAFSHSHPMDVAIGKSMAVLQELIIATRKEGGDGKSSLKSRELRVVASPQVVLQPSTVVDVKPIS,./data/raw/alphafold//AF-O15927-F1-model_v4.pdb,2103,4295,1198,3125
+1949,11758,11916,MAGSEDKRVVGTLHLLLLQATVLSLTAGNLSLVSAAWTQEKNHHQPAHLNSSSLQQVAEGTSISEMWQNDLRPLLIERYPGSPGSYSARQHIMQRIQRLQAEWVVEVDTFLSRTPYGYRSFSNIISTLNPEAKRHLVLACHYDSKYFPRWDSRVFVGATDSAVPCAMMLELARALDKKLHSLKDVSGSKPDLSLRLIFFDGEEAFHHWSPQDSLYGSRHLAQKMASSPHPPGSRGTNQLDGMDLLVLLDLIGAANPTFPNFFPKTTRWFNRLQAIEKELYELGLLKDHSLERKYFQNFGYGNIIQDDHIPFLRKGVPVLHLIASPFPEVWHTMDDNEENLHASTIDNLNKIIQVFVLEYLHL,brenda,Q9CYK2,Cc1cc(=O)oc2cc(N=C(O)[C@@H](N)CCC(=N)O)ccc12>>Cc1cc(=O)oc2cc(N=C(O)[C@@H]3CCC(O)=N3)ccc12.N,6.0,0.0,30.0,8.0,2.3.2.5,10090.0,0.7781512503836436,Cc1cc(=O)oc2cc(N=C(O)[C@@H](N)CCC(=N)O)ccc12,Cc1cc(=O)oc2cc(N=C(O)[C@@H]3CCC(O)=N3)ccc12.N,0.7781512503836436,Cc1cc(=O)oc2cc(N=C(O)[C@@H](N)CCC(=N)O)ccc12__MAGSEDKRVVGTLHLLLLQATVLSLTAGNLSLVSAAWTQEKNHHQPAHLNSSSLQQVAEGTSISEMWQNDLRPLLIERYPGSPGSYSARQHIMQRIQRLQAEWVVEVDTFLSRTPYGYRSFSNIISTLNPEAKRHLVLACHYDSKYFPRWDSRVFVGATDSAVPCAMMLELARALDKKLHSLKDVSGSKPDLSLRLIFFDGEEAFHHWSPQDSLYGSRHLAQKMASSPHPPGSRGTNQLDGMDLLVLLDLIGAANPTFPNFFPKTTRWFNRLQAIEKELYELGLLKDHSLERKYFQNFGYGNIIQDDHIPFLRKGVPVLHLIASPFPEVWHTMDDNEENLHASTIDNLNKIIQVFVLEYLHL,./data/raw/alphafold//AF-Q9CYK2-F1-model_v4.pdb,2883,4616,4642,2824
+1950,9552,9698,MTLEKFVDALPIPDTLKPVQQSKEKTYYEVTMEECTHQLHRDLPPTRLWGYNGLFPGPTIEVKRNENVYVKWMNNLPSTHFLPIDHTIHHSDSQHEEPEVKTVVHLHGGVTPDDSDGYPEAWFSKDFEQTGPYFKREVYHYPNQQRGAILWYHDHAMALTRLNVYAGLVGAYIIHDPKEKRLKLPSDEYDVPLLITDRTINEDGSLFYPSAPENPSPSLPNPSIVPAFCGETILVNGKVWPYLEVEPRKYRFRVINASNTRTYNLSLDNGGDFIQIGSDGGLLPRSVKLNSFSLAPAERYDIIIDFTAYEGESIILANSAGCGGDVNPETDANIMQFRVTKPLAQKDESRKPKYLASYPSVQHERIQNIRTLKLAGTQDEYGRPVLLLNNKRWHDPVTETPKVGTTEIWSIINPTRGTHPIHLHLVSFRVLDRRPFDIARYQESGELSYTGPAVPPPPSEKGWKDTIQAHAGEVLRIAATFGPYSGRYVWHCHILEHEDYDMMRPMDITDPHK,sabio,P07788,COc1cc(C=O)cc(OC)c1O.O=O>>O,16.0,84.12010909652298,37.0,8.0,1.10.3.2,1423.0,1.2041199826559248,COc1cc(C=O)cc(OC)c1O.O=O,O,1.2041199826559248,COc1cc(C=O)cc(OC)c1O.O=O__MTLEKFVDALPIPDTLKPVQQSKEKTYYEVTMEECTHQLHRDLPPTRLWGYNGLFPGPTIEVKRNENVYVKWMNNLPSTHFLPIDHTIHHSDSQHEEPEVKTVVHLHGGVTPDDSDGYPEAWFSKDFEQTGPYFKREVYHYPNQQRGAILWYHDHAMALTRLNVYAGLVGAYIIHDPKEKRLKLPSDEYDVPLLITDRTINEDGSLFYPSAPENPSPSLPNPSIVPAFCGETILVNGKVWPYLEVEPRKYRFRVINASNTRTYNLSLDNGGDFIQIGSDGGLLPRSVKLNSFSLAPAERYDIIIDFTAYEGESIILANSAGCGGDVNPETDANIMQFRVTKPLAQKDESRKPKYLASYPSVQHERIQNIRTLKLAGTQDEYGRPVLLLNNKRWHDPVTETPKVGTTEIWSIINPTRGTHPIHLHLVSFRVLDRRPFDIARYQESGELSYTGPAVPPPPSEKGWKDTIQAHAGEVLRIAATFGPYSGRYVWHCHILEHEDYDMMRPMDITDPHK,./data/raw/alphafold//AF-P07788-F1-model_v4.pdb,3403,2293,1019,2915
+1951,14086,14268,MNYLSPAKIDSLFSAQKAYFATRATADVGFRKQSLERLKEAVINNKEALYSALAEDLGKPKDVVDLAEIGAVLHEIDFALAHLDEWVAPVSVPSPDIIAPSECYVVQEPYGVTYIIGPFNYPVNLTLTPLIGAIIGGNTCIIKPSETTPETSAVIEKIIAEAFAPEYVAVIQGGRDENSHLLSLPFDFIFFTGSPNVGKVVMQAAAKHLTPVVLELGGKCPLIVLPDADLDQTVNQLMFGKFINSGQTCIAPDYLYVHYSVKDALLERLVERVKTELPEINSTGKLVTERQVQRLVSLLEATQGQVLVGSQADVSKRALSATVVDGVEWNDPLMSEELFGPILPVLEFDSVRTAIDQVNKHHPKPLAVYVFGKDMDVAKGIINQIQSGDAQVNGVMLHAFSPYLPFGGIGASGMGEYHGHFSYLTFTHKKSVRIVP,brenda,Q84DC3,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.O.O=Cc1ccccc1>>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.O=C(O)c1ccccc1.[H+],156.0,0.0,30.0,8.5,1.2.1.28,303.0,2.1931245983544616,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.O.O=Cc1ccccc1,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.O=C(O)c1ccccc1.[H+],2.1931245983544616,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.O.O=Cc1ccccc1__MNYLSPAKIDSLFSAQKAYFATRATADVGFRKQSLERLKEAVINNKEALYSALAEDLGKPKDVVDLAEIGAVLHEIDFALAHLDEWVAPVSVPSPDIIAPSECYVVQEPYGVTYIIGPFNYPVNLTLTPLIGAIIGGNTCIIKPSETTPETSAVIEKIIAEAFAPEYVAVIQGGRDENSHLLSLPFDFIFFTGSPNVGKVVMQAAAKHLTPVVLELGGKCPLIVLPDADLDQTVNQLMFGKFINSGQTCIAPDYLYVHYSVKDALLERLVERVKTELPEINSTGKLVTERQVQRLVSLLEATQGQVLVGSQADVSKRALSATVVDGVEWNDPLMSEELFGPILPVLEFDSVRTAIDQVNKHHPKPLAVYVFGKDMDVAKGIINQIQSGDAQVNGVMLHAFSPYLPFGGIGASGMGEYHGHFSYLTFTHKKSVRIVP,./data/raw/alphafold//AF-Q84DC3-F1-model_v4.pdb,3559,3517,1290,3239
+1952,2780,2818,MNPQEEFIFRSKLPDIYIPKNLPLHSYVLENLSNHSSKPCLINGANGDVYTYADVELTARRVASGLNKIGIQQGDVIMLFLPSSPEFVLAFLGASHRGAIITAANPFSTPAELAKHAKASRAKLLITQACYYEKVKDFARESDVKVMCVDSAPDGCLHFSELTQADENEAPQVDISPDDVVALPYSSGTTGLPKGVMLTHKGLITSVAQQVDGDNPNLYFHSEDVILCVLPMFHIYALNSIMLCGLRVGAPILIMPKFEIGSLLGLIEKYKVSIAPVVPPVMMSIAKSPDLDKHDLSSLRMIKSGGAPLGKELEDTVRAKFPQARLGQGYGMTEAGPVLAMCLAFAKEPFDIKPGACGTVVRNAEMKIVDPETGASLPRNQPGEICIRGDQIMKGYLNDPEATSRTIDKEGWLHTGDIGYIDDDDELFIVDRLKELIKYKGFQVAPAELEALLIAHPEISDAAVVGLKDEDAGEVPVAFVVKSEKSQATEDEIKQYISKQVIFYKRIKRVFFIEAIPKAPSGKILRKNLKEKLAGI,brenda,Q941M3,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,2.23,0.0,37.0,6.0,6.2.1.12,118781.0,0.3483048630481606,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,0.3483048630481606,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__MNPQEEFIFRSKLPDIYIPKNLPLHSYVLENLSNHSSKPCLINGANGDVYTYADVELTARRVASGLNKIGIQQGDVIMLFLPSSPEFVLAFLGASHRGAIITAANPFSTPAELAKHAKASRAKLLITQACYYEKVKDFARESDVKVMCVDSAPDGCLHFSELTQADENEAPQVDISPDDVVALPYSSGTTGLPKGVMLTHKGLITSVAQQVDGDNPNLYFHSEDVILCVLPMFHIYALNSIMLCGLRVGAPILIMPKFEIGSLLGLIEKYKVSIAPVVPPVMMSIAKSPDLDKHDLSSLRMIKSGGAPLGKELEDTVRAKFPQARLGQGYGMTEAGPVLAMCLAFAKEPFDIKPGACGTVVRNAEMKIVDPETGASLPRNQPGEICIRGDQIMKGYLNDPEATSRTIDKEGWLHTGDIGYIDDDDELFIVDRLKELIKYKGFQVAPAELEALLIAHPEISDAAVVGLKDEDAGEVPVAFVVKSEKSQATEDEIKQYISKQVIFYKRIKRVFFIEAIPKAPSGKILRKNLKEKLAGI,./data/raw/alphafold//AF-Q941M3-F1-model_v4.pdb,1669,1278,4572,1529
+1953,8266,8394,MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,uniprot_search,P24155,CC[C@H](C)[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)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-].O>>CC[C@H](C)[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(=O)O.CC[C@H](C)[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O.N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)Cc1ccccc1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N)CO)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],6.08,33.32437053602279,37.0,7.4,3.4.24.15,10116.0,0.7839035792727349,CC[C@H](C)[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)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-].O,CC[C@H](C)[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(=O)O.CC[C@H](C)[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O.N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)Cc1ccccc1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].N=C(O)CC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N)CO)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],0.7839035792727349,CC[C@H](C)[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)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-].O__MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,./data/raw/alphafold//AF-P24155-F1-model_v4.pdb,1820,1500,3134,1830
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+1961,6912,7028,MATGQKLMRAVRVFEFGGPEVLKLRSDIAVPIPKDHQVLIKVHACGVNPVETYIRSGTYSRKPLLPYTPGSDVAGVIEAVGDNASAFKKGDRVFTSSTISGGYAEYALAADHTVYKLPEKLDFKQGAAIGIPYFTAYRALIHSACVKAGESVLVHGASGGVGLAACQIARAYGLKILGTAGTEEGQKIVLQNGAHEVFNHREVNYIDKIKKYVGEKGIDIIIEMLANVNLSKDLSLLSHGGRVIVVGSRGTIEINPRDTMAKESSIIGVTLFSSTKEEFQQYAAALQAGMEIGWLKPVIGSQYPLEKVAEAHENIIHGSGATGKMILLL,brenda,Q08257,CCCCCC(O)/C=C/C=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+]>>CCCCCC(O)CCC=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)c1,1.15,0.0,30.0,7.416666666666667,1.3.1.27,9606.0,0.0606978403536116,CCCCCC(O)/C=C/C=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+],CCCCCC(O)CCC=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)c1,0.0606978403536116,CCCCCC(O)/C=C/C=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+]__MATGQKLMRAVRVFEFGGPEVLKLRSDIAVPIPKDHQVLIKVHACGVNPVETYIRSGTYSRKPLLPYTPGSDVAGVIEAVGDNASAFKKGDRVFTSSTISGGYAEYALAADHTVYKLPEKLDFKQGAAIGIPYFTAYRALIHSACVKAGESVLVHGASGGVGLAACQIARAYGLKILGTAGTEEGQKIVLQNGAHEVFNHREVNYIDKIKKYVGEKGIDIIIEMLANVNLSKDLSLLSHGGRVIVVGSRGTIEINPRDTMAKESSIIGVTLFSSTKEEFQQYAAALQAGMEIGWLKPVIGSQYPLEKVAEAHENIIHGSGATGKMILLL,./data/raw/alphafold//AF-Q08257-F1-model_v4.pdb,3166,1960,3604,297
+1962,14046,14228,MASAHTTQTPFNRLLLTGAAGGLGKVLRETLRPYSHILRLSDIAEMAPAVGDHEEVQVCDLADKDAVHRLVEGVDAILHFGGVSVERPFEEILGANICGVFHIYEAARRHGVKRVIFASSNHVIGFYKQNETIDAHSPRRPDSYYGLSKSYGEDMASFYFDRYGIETVSIRIGSSFPEPQNRRMMSTWLSFDDLTRLLERALYTPDVGHTVVYGVSDNKTVWWDNRFASKLDYAPKDSSEVFRAKVDAQPMPADDDPAMVYQGGAFVASGPFGDK,brenda,Q888H1,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.O.O=C(O)[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O>>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.O=C(O)[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)C(=O)O.[H+],0.24,6.480895830860161e-15,35.0,8.0,1.1.1.203,323.0,-0.619788758288394,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.O.O=C(O)[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O,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.O=C(O)[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)C(=O)O.[H+],-0.619788758288394,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.O.O=C(O)[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O__MASAHTTQTPFNRLLLTGAAGGLGKVLRETLRPYSHILRLSDIAEMAPAVGDHEEVQVCDLADKDAVHRLVEGVDAILHFGGVSVERPFEEILGANICGVFHIYEAARRHGVKRVIFASSNHVIGFYKQNETIDAHSPRRPDSYYGLSKSYGEDMASFYFDRYGIETVSIRIGSSFPEPQNRRMMSTWLSFDDLTRLLERALYTPDVGHTVVYGVSDNKTVWWDNRFASKLDYAPKDSSEVFRAKVDAQPMPADDDPAMVYQGGAFVASGPFGDK,./data/raw/alphafold//AF-Q888H1-F1-model_v4.pdb,2330,4674,4707,4539
+1963,11209,11365,MPDQRSESGRFDVEVDVLVAGSGGGVAGAYTAAREGLSVLLVEATDKFGGTTAFSGGGGMWFPCNPVLERAGTDDTLDEALKYFHAVVGDRTPQELQDAYVTGGAGFIAYLEQDHGFEFAVLPWPDYYGSVPGARNDGYRHIVPKPLPDSALGSYQGLVRGPLDTERLGAPAPDTLIGGRALVGRFLAALDKLPNADCWCEAPLTELITESGRVVGAIVERGGERLRVCARRGVLLASGGFEQNADMRGRYGVPGSATDTMGGPGSTGAAHRAAMAVGADVDLMDQAWWSPGLTHPDGRSAFALWFTGGIFVDQDGKRFVNESAPYDRLGRAVIERLESGRLTLPYWMVYDSRAGDVPPVGATNVSMVDPAEYRAAGLWRSAETISGLAEEIGVPADALEATIQRFNEMATAGHDDDFGRGDEAYDRVFTGGASPLVPIDTPPYHAAAFGLSDLGTKGGLRTDTRARVRGRDGEPIPGLYAAGNTMAAVSGTTYPGGGNPIGASMLFSHFAALDMAAEGTTA,brenda,A0QW99,C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO.O=C1C=CC(=Nc2cc(Cl)c(O)c(Cl)c2)C=C1>>C[C@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO.Oc1ccc(Nc2cc(Cl)c(O)c(Cl)c2)cc1,60.3,9.007537870236506e-15,25.0,8.0,1.3.99.4,1772.0,1.7803173121401512,C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO.O=C1C=CC(=Nc2cc(Cl)c(O)c(Cl)c2)C=C1,C[C@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO.Oc1ccc(Nc2cc(Cl)c(O)c(Cl)c2)cc1,1.7803173121401512,C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO.O=C1C=CC(=Nc2cc(Cl)c(O)c(Cl)c2)C=C1__MPDQRSESGRFDVEVDVLVAGSGGGVAGAYTAAREGLSVLLVEATDKFGGTTAFSGGGGMWFPCNPVLERAGTDDTLDEALKYFHAVVGDRTPQELQDAYVTGGAGFIAYLEQDHGFEFAVLPWPDYYGSVPGARNDGYRHIVPKPLPDSALGSYQGLVRGPLDTERLGAPAPDTLIGGRALVGRFLAALDKLPNADCWCEAPLTELITESGRVVGAIVERGGERLRVCARRGVLLASGGFEQNADMRGRYGVPGSATDTMGGPGSTGAAHRAAMAVGADVDLMDQAWWSPGLTHPDGRSAFALWFTGGIFVDQDGKRFVNESAPYDRLGRAVIERLESGRLTLPYWMVYDSRAGDVPPVGATNVSMVDPAEYRAAGLWRSAETISGLAEEIGVPADALEATIQRFNEMATAGHDDDFGRGDEAYDRVFTGGASPLVPIDTPPYHAAAFGLSDLGTKGGLRTDTRARVRGRDGEPIPGLYAAGNTMAAVSGTTYPGGGNPIGASMLFSHFAALDMAAEGTTA,./data/raw/alphafold//AF-A0QW99-F1-model_v4.pdb,1436,3891,6209,872
+1964,11328,11484,MTDSRANRADATRGVASVSRRRFLAGAGLTAGAIALSSMSTSASAAPSRTLADGDRVPALVIGSGYGGAVAALRLTQAGIPTQIVEMGRSWDTPGSDGKIFCGMLNPDKRSMWLADKTDQPVSNFMGFGINKSIDRYVGVLDSERFSGIKVYQGRGVGGGSLVNGGMAVTPKRNYFEEILPSVDSNEMYNKYFPRANTGLGVNNIDQAWFESTEWYKFARTGRKTAQRSGFTTAFVPNVYDFEYMKKEAAGQVTKSGLGGEVIYGNNAGKKSLDKTYLAQAAATGKLTITTLHRVTKVAPATGSGYSVTMEQIDEQGNVVATKVVTADRVFFAAGSVGTSKLLVSMKAQGHLPNLSSQVGEGWGNNGNIMVGRANHMWDATGSKQATIPTMGIDNWADPTAPIFAEIAPLPAGLETYVSLYLAITKNPERARFQFNSGTGKVDLTWAQSQNQKGIDMAKKVFDKINQKEGTIYRTDLFGVYFKTWGDDFTYHPLGGVLLNKATDNFGRLPEYPGLYVVDGSLVPGNVGVNPFVTITRLAERNMDKIISSDIQ,uniprot_search,P22637,C[C@]12CC[C@H](O)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12.O=O>>C[C@]12CCC(=O)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12.OO,0.8,0.0,25.0,7.5,1.1.3.6,1702.0,-0.0969100130080563,C[C@]12CC[C@H](O)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12.O=O,C[C@]12CCC(=O)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12.OO,0.0,C[C@]12CC[C@H](O)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12.O=O__MTDSRANRADATRGVASVSRRRFLAGAGLTAGAIALSSMSTSASAAPSRTLADGDRVPALVIGSGYGGAVAALRLTQAGIPTQIVEMGRSWDTPGSDGKIFCGMLNPDKRSMWLADKTDQPVSNFMGFGINKSIDRYVGVLDSERFSGIKVYQGRGVGGGSLVNGGMAVTPKRNYFEEILPSVDSNEMYNKYFPRANTGLGVNNIDQAWFESTEWYKFARTGRKTAQRSGFTTAFVPNVYDFEYMKKEAAGQVTKSGLGGEVIYGNNAGKKSLDKTYLAQAAATGKLTITTLHRVTKVAPATGSGYSVTMEQIDEQGNVVATKVVTADRVFFAAGSVGTSKLLVSMKAQGHLPNLSSQVGEGWGNNGNIMVGRANHMWDATGSKQATIPTMGIDNWADPTAPIFAEIAPLPAGLETYVSLYLAITKNPERARFQFNSGTGKVDLTWAQSQNQKGIDMAKKVFDKINQKEGTIYRTDLFGVYFKTWGDDFTYHPLGGVLLNKATDNFGRLPEYPGLYVVDGSLVPGNVGVNPFVTITRLAERNMDKIISSDIQ,./data/raw/alphafold//AF-P22637-F1-model_v4.pdb,1830,1514,3089,1849
+1965,14642,14848,MSFVVIIPARYASTRLPGKPLVDINGKPMIVHVLERARESGAERIIVATDHEDVARAVEAAGGEVCMTRADHQSGTERLAEVVEKCAFSDDTVIVNVQGDEPMIPATIIRQVADNLAQRQVGMATLAVPIHNAEEAFNPNAVKVVLDAEGYALYFSRATIPWDRDRFAEGLETVGDNFLRHLGIYGYRAGFIRRYVNWQPSPLEHIEMLEQLRVLWYGEKIHVAVAQEVPGTGVDTPEDLERVRAEMR,brenda,P04951,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O=C(O)[C@@]1(O)C[C@@H](O)[C@@H](O)[C@@H]([C@H](O)CO)O1>>N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O[C@]3(C(=O)O)C[C@@H](O)[C@@H](O)[C@@H]([C@H](O)CO)O3)[C@@H](O)[C@H]2O)c(O)n1.O=P(O)(O)OP(=O)(O)O,1.21,7.874707536878681e-15,37.0,9.215,2.7.7.38,562.0,0.08278537031645,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O=C(O)[C@@]1(O)C[C@@H](O)[C@@H](O)[C@@H]([C@H](O)CO)O1,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O[C@]3(C(=O)O)C[C@@H](O)[C@@H](O)[C@@H]([C@H](O)CO)O3)[C@@H](O)[C@H]2O)c(O)n1.O=P(O)(O)OP(=O)(O)O,0.08278537031645,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1.O=C(O)[C@@]1(O)C[C@@H](O)[C@@H](O)[C@@H]([C@H](O)CO)O1__MSFVVIIPARYASTRLPGKPLVDINGKPMIVHVLERARESGAERIIVATDHEDVARAVEAAGGEVCMTRADHQSGTERLAEVVEKCAFSDDTVIVNVQGDEPMIPATIIRQVADNLAQRQVGMATLAVPIHNAEEAFNPNAVKVVLDAEGYALYFSRATIPWDRDRFAEGLETVGDNFLRHLGIYGYRAGFIRRYVNWQPSPLEHIEMLEQLRVLWYGEKIHVAVAQEVPGTGVDTPEDLERVRAEMR,./data/raw/alphafold//AF-P04951-F1-model_v4.pdb,2428,4837,4900,4751
+1966,16828,17058,MRVCIIGAGVIGHSTAQSIYQHFHDRIAPLTIEVYADVFTPLTTSDGAAGLWQPYLYDKGNVQETKWNKETFQYLLSCLSSPDSVRMGIFLQSGYNLCTEPLPDPSFKDTVLGFRKLTQRELDMFPGYSFGWFNTALMVEGKTYLPWLMDWLRQRKVKFYQRKIGSFKELADIGADVIINCSGVRSGDLQPDPELQPGRGQIIKVDAPWLKHWILTHDSSSGVYNSPYIIPGSRLVTVGGVFQIGNWNLQNSSVDHKGIWEAACKLDPSLQHARIVEDWTGLRPARSKVRLERETIRSGPTSFEVIHNYGHGGFGLTIHRGCAEEAARLFGQILEQKGLLAHSKSRL,brenda,Q6TGN2,NCCCC[C@@H](N)C(=O)O.O.O=O>>N.NCCCCC(=O)C(=O)O.OO,42.3,7.224523629635546e-15,37.0,8.0,1.4.3.3,7962.0,1.6263403673750425,NCCCC[C@@H](N)C(=O)O.O.O=O,N.NCCCCC(=O)C(=O)O.OO,1.6263403673750425,NCCCC[C@@H](N)C(=O)O.O.O=O__MRVCIIGAGVIGHSTAQSIYQHFHDRIAPLTIEVYADVFTPLTTSDGAAGLWQPYLYDKGNVQETKWNKETFQYLLSCLSSPDSVRMGIFLQSGYNLCTEPLPDPSFKDTVLGFRKLTQRELDMFPGYSFGWFNTALMVEGKTYLPWLMDWLRQRKVKFYQRKIGSFKELADIGADVIINCSGVRSGDLQPDPELQPGRGQIIKVDAPWLKHWILTHDSSSGVYNSPYIIPGSRLVTVGGVFQIGNWNLQNSSVDHKGIWEAACKLDPSLQHARIVEDWTGLRPARSKVRLERETIRSGPTSFEVIHNYGHGGFGLTIHRGCAEEAARLFGQILEQKGLLAHSKSRL,./data/raw/alphafold//AF-Q6TGN2-F1-model_v4.pdb,2817,3638,3044,1792
+1967,9784,9933,MIELEKLDFAKSVEGVEAFSTTRGQVDGRNAYSGVNLCDYVGDDALRVLDARLTLAMQLGVDLDDLVMPRQTHSCRVAVIDERFRALDIDEQEAALEGVDALVTRLQGIVIGVNTADCVPIVLVDSQAGIVAVSHAGWRGTVGRIAKAVVEEMCRQGATVDRIQAAMGPSICQDCFEVGDEVVEAFKKAHFNLNDIVVRNPATGKAHIDLRAANRAVLVAAGVPAANIVESQHCSRCEHTSFFSARRLGINSGRTFTGIYRK,sabio,Q1EIR0,COc1cccc(OC)c1O.O=O>>O,1000000.0,81.95225608983418,40.0,4.5,1.10.3.2,2725.0,6.0,COc1cccc(OC)c1O.O=O,O,6.0,COc1cccc(OC)c1O.O=O__MIELEKLDFAKSVEGVEAFSTTRGQVDGRNAYSGVNLCDYVGDDALRVLDARLTLAMQLGVDLDDLVMPRQTHSCRVAVIDERFRALDIDEQEAALEGVDALVTRLQGIVIGVNTADCVPIVLVDSQAGIVAVSHAGWRGTVGRIAKAVVEEMCRQGATVDRIQAAMGPSICQDCFEVGDEVVEAFKKAHFNLNDIVVRNPATGKAHIDLRAANRAVLVAAGVPAANIVESQHCSRCEHTSFFSARRLGINSGRTFTGIYRK,./data/raw/alphafold//AF-Q1EIR0-F1-model_v4.pdb,3400,2287,3989,2879
+1968,4359,4414,MSILNNKEVIVIIDAWSGGKHLIPAFQALGYFCLHVQSTFLPEVFIADNQLAIARSDRHIVHDGNIETLLSQLQPYTIKAILAGSEGAVGLADCLNDALELTFSNQFELSAARRNKYLMQEQLALKGVASINQQLAGHSDELKQWLAGHAHWPVVLKPIQSAGTDGVFICHDLAQALQAFEAILAKKDFFGSPNREVLCQEFLAGEEFVVNGIACQGEYFFTELWQSKKQQRNGFPVYETQYLHYQNDAGFDVLTAYTVQVCQTLGINNGAFHAEVMMTSGGPVLIEIGARVAGGADPYIIEECLGHSQISKLAQAVLHPAKFLQECRRQHDFSGHRRAAYVYMISPSPGRVQVSPEEKFIKIDGVISINYHYAPGDIQQETCDLLSSPGVIIAIRDNPALLKQTIAEIRDVEADFYHLGLIDE,brenda,E2JA31,CC(C)[C@H](N)C(=O)O.N=C(O)/C=C/C(O)=NC[C@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>CC(C)[C@H](N=C(O)[C@@H](N)CN=C(O)/C=C/C(=N)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,0.3,0.0,22.0,8.0,6.3.2.47,549.0,-0.5228787452803376,CC(C)[C@H](N)C(=O)O.N=C(O)/C=C/C(O)=NC[C@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,CC(C)[C@H](N=C(O)[C@@H](N)CN=C(O)/C=C/C(=N)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,-0.5228787452803376,CC(C)[C@H](N)C(=O)O.N=C(O)/C=C/C(O)=NC[C@H](N)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MSILNNKEVIVIIDAWSGGKHLIPAFQALGYFCLHVQSTFLPEVFIADNQLAIARSDRHIVHDGNIETLLSQLQPYTIKAILAGSEGAVGLADCLNDALELTFSNQFELSAARRNKYLMQEQLALKGVASINQQLAGHSDELKQWLAGHAHWPVVLKPIQSAGTDGVFICHDLAQALQAFEAILAKKDFFGSPNREVLCQEFLAGEEFVVNGIACQGEYFFTELWQSKKQQRNGFPVYETQYLHYQNDAGFDVLTAYTVQVCQTLGINNGAFHAEVMMTSGGPVLIEIGARVAGGADPYIIEECLGHSQISKLAQAVLHPAKFLQECRRQHDFSGHRRAAYVYMISPSPGRVQVSPEEKFIKIDGVISINYHYAPGDIQQETCDLLSSPGVIIAIRDNPALLKQTIAEIRDVEADFYHLGLIDE,./data/raw/alphafold//AF-E2JA31-F1-model_v4.pdb,2914,1634,3239,2025
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+1970,10516,10670,MKSSNIYSPFDLKCEFTTNPLGVDKKNPIFSWKLRHLEKNEKQTAYQVIVSSSLETINDNIGDVWDTGKVLSSEQVIKYEGKELEPCKVYFWKVRWWDSKDQESPFSVVNTFETGLMNEENWKAKWITKKEHKYEVYSPDGAPFGLNYTIAYAPMFRKSFSISKKIKRARVYIAGLGLYELYINGERIGDRVLDPGQTDYKKRVLYTVYDVSKNIRDGKNAIGVILGNGRYVKEYGYDFPKLIIQVLVEYEDDSIEWIVSDESWKTTYGPITLNSLYHGEIYDGRKEIKGWNLPDFDDSTWENAILAEPPGGKLYSEIYPPIRITKTIKPIKMWSPEPGTYVYDFGQNYTGWIKIKVRTNESGKEIRIRHAELTYEDGTLNYSTNRTALATDVYITKGEGYEEYEPRFTYHGFRYVEILGYPGVPTLEDIEGKVVHTAVESNGEFICSNELINKIHHNIIWGQLSNLMSIPTDCPQRDERMGWMGDAQLSAEEAIFNFDMIGFYRKYLNDIRDAQKENGSLSDVIPPYWSIYPGDPAWSTAYITIAWYLYQYYGDKYVLEEHYEGFKKYVEFLKKLAPDYIVSFYKYGDWCQPGTVRPKDNSGELTSTFYFYHDVITLSKIAKLLGKEADYKYYSELADKIKSAFNKKFLKEKAYASIPTELSEENVKALLEKYPEDIKDFLRQQFTILSSLGMFTSQTLNTLPLYLNLVPEDKVQDVLKTLLEDIIIRHDYHLDTGIVATRYIFDVLTSYGYDEVAYKIVNQKTYPSFGYMIEEGATTLWERWEKLTSTGMNSHNHIMFGSVDAWFYRVIAGVRVGEPGWNKIIFEPHPVGDLKYAKARLNTIKGEVEINWQKTENIFSMRISVPVNSEGEVHVPKLFERFVVKEGDNIIYEKKGDLEENEKYIVIRVGSGSYNFYMEKI,brenda,B5YC64,C[C@@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@H](O)[C@H]1O.O>>C[C@@H]1O[C@@H](O)[C@H](O)[C@H](O)[C@H]1O.O=[N+]([O-])c1ccc(O)cc1,0.17,9.356417724902316e-15,37.0,5.0,3.2.1.40,14.0,-0.7695510786217261,C[C@@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@H](O)[C@H]1O.O,C[C@@H]1O[C@@H](O)[C@H](O)[C@H](O)[C@H]1O.O=[N+]([O-])c1ccc(O)cc1,-0.7695510786217261,C[C@@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@H](O)[C@H]1O.O__MKSSNIYSPFDLKCEFTTNPLGVDKKNPIFSWKLRHLEKNEKQTAYQVIVSSSLETINDNIGDVWDTGKVLSSEQVIKYEGKELEPCKVYFWKVRWWDSKDQESPFSVVNTFETGLMNEENWKAKWITKKEHKYEVYSPDGAPFGLNYTIAYAPMFRKSFSISKKIKRARVYIAGLGLYELYINGERIGDRVLDPGQTDYKKRVLYTVYDVSKNIRDGKNAIGVILGNGRYVKEYGYDFPKLIIQVLVEYEDDSIEWIVSDESWKTTYGPITLNSLYHGEIYDGRKEIKGWNLPDFDDSTWENAILAEPPGGKLYSEIYPPIRITKTIKPIKMWSPEPGTYVYDFGQNYTGWIKIKVRTNESGKEIRIRHAELTYEDGTLNYSTNRTALATDVYITKGEGYEEYEPRFTYHGFRYVEILGYPGVPTLEDIEGKVVHTAVESNGEFICSNELINKIHHNIIWGQLSNLMSIPTDCPQRDERMGWMGDAQLSAEEAIFNFDMIGFYRKYLNDIRDAQKENGSLSDVIPPYWSIYPGDPAWSTAYITIAWYLYQYYGDKYVLEEHYEGFKKYVEFLKKLAPDYIVSFYKYGDWCQPGTVRPKDNSGELTSTFYFYHDVITLSKIAKLLGKEADYKYYSELADKIKSAFNKKFLKEKAYASIPTELSEENVKALLEKYPEDIKDFLRQQFTILSSLGMFTSQTLNTLPLYLNLVPEDKVQDVLKTLLEDIIIRHDYHLDTGIVATRYIFDVLTSYGYDEVAYKIVNQKTYPSFGYMIEEGATTLWERWEKLTSTGMNSHNHIMFGSVDAWFYRVIAGVRVGEPGWNKIIFEPHPVGDLKYAKARLNTIKGEVEINWQKTENIFSMRISVPVNSEGEVHVPKLFERFVVKEGDNIIYEKKGDLEENEKYIVIRVGSGSYNFYMEKI,./data/raw/alphafold//AF-B5YC64-F1-model_v4.pdb,3694,3696,1494,3460
+1971,17880,18128,MDMWTALLILQALLLPSLADGATPALRFVAVGDWGGVPNAPFHTAREMANAKEIARTVQILGADFILSLGDNFYFTGVQDINDKRFQETFEDVFSDRSLRKVPWYVLAGNHDHLGNVSAQIAYSKISKRWNFPSPFYRLHFKIPQTNVSVAIFMLDTVTLCGNSDDFLSQQPERPRDVKLARTQLSWLKKQLAAAREDYVLVAGHYPVWSIAEHGPTHCLVKQLRPLLATYGVTAYLCGHDHNLQYLQDENGVGYVLSGAGNFMDPSKRHQRKVPNGYLRFHYGTEDSLGGFAYVEISSKEMTVTYIEASGKSLFKTRLPRRARP,sabio,P13686,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,58.0,6.739921419046132e-15,25.0,5.7,3.1.3.2,9606.0,1.7634279935629371,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,1.7634279935629371,Nc1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)n1.O__MDMWTALLILQALLLPSLADGATPALRFVAVGDWGGVPNAPFHTAREMANAKEIARTVQILGADFILSLGDNFYFTGVQDINDKRFQETFEDVFSDRSLRKVPWYVLAGNHDHLGNVSAQIAYSKISKRWNFPSPFYRLHFKIPQTNVSVAIFMLDTVTLCGNSDDFLSQQPERPRDVKLARTQLSWLKKQLAAAREDYVLVAGHYPVWSIAEHGPTHCLVKQLRPLLATYGVTAYLCGHDHNLQYLQDENGVGYVLSGAGNFMDPSKRHQRKVPNGYLRFHYGTEDSLGGFAYVEISSKEMTVTYIEASGKSLFKTRLPRRARP,./data/raw/alphafold//AF-P13686-F1-model_v4.pdb,1141,740,432,492
+1972,17254,17485,MAGKPILHYFNGRGRMECIRWLLAAAGVEFEEKFIKTPEDLDKLTNDGSLLFQQVPMVEIDGMKLVQTRAILNYIATKYNLYGKDAKERALIDMYTEGVADLGEMILLLPLCPPNEKDAKVASIKEKSTNRYLPAFEKVLKSHGQDYLVGNKLSRADIQLVELLYYVEELDPSLLANFPLLKALKTRVSNLPTVKKFLQPGSQRKPPMDAKKIRRSQEYFPD,brenda,P51781,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.S=C=NCCc1ccccc1>>N[C@@H](CCC(O)=N[C@@H](CSC(S)=NCCc1ccccc1)C(O)=NCC(=O)O)C(=O)O,9.5,1.8100194299230056e-14,30.0,7.8,2.5.1.18,9823.0,0.9777236052888478,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.S=C=NCCc1ccccc1,N[C@@H](CCC(O)=N[C@@H](CSC(S)=NCCc1ccccc1)C(O)=NCC(=O)O)C(=O)O,0.9777236052888478,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.S=C=NCCc1ccccc1__MAGKPILHYFNGRGRMECIRWLLAAAGVEFEEKFIKTPEDLDKLTNDGSLLFQQVPMVEIDGMKLVQTRAILNYIATKYNLYGKDAKERALIDMYTEGVADLGEMILLLPLCPPNEKDAKVASIKEKSTNRYLPAFEKVLKSHGQDYLVGNKLSRADIQLVELLYYVEELDPSLLANFPLLKALKTRVSNLPTVKKFLQPGSQRKPPMDAKKIRRSQEYFPD,./data/raw/alphafold//AF-P51781-F1-model_v4.pdb,1108,689,3562,1329
+1973,10777,10932,MAAIRFLVLAFLFACGASEPINEKEGRIIGGTTTTITSYPYIASLHKGTEHICGATIINSEWLVTAASCISIPNAREYLVRVGSTYSSSGGNVYQVSKIYRHEFDLNTMDNDIALVRLSTGVIFGTNVQSITLQESDVSDGTSATVLGWGTISEGGAQSNILKQVVVPVVGFHSCNTSYATYGGITDNMLCAGYNEGGVDACQGDTGGPLVASGHLIGIVSWGAGCGHSTFPGVYTKVSAYRDWIKDKTGV,uniprot_search,A0A059WCN6,C[C@H](N=C(O)CN=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](C)N=C(O)c1ccccc1N)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>C[C@H](N=C(O)CN)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].C[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCC(=N)O)C(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(=O)O,50000.0,2.0867723827957363e-14,30.0,8.5,3.4.21.4,6978.0,4.698970004336019,C[C@H](N=C(O)CN=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](C)N=C(O)c1ccccc1N)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,C[C@H](N=C(O)CN)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].C[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](CCC(=N)O)C(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(=O)O,4.698970004336019,C[C@H](N=C(O)CN=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](C)N=C(O)c1ccccc1N)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MAAIRFLVLAFLFACGASEPINEKEGRIIGGTTTTITSYPYIASLHKGTEHICGATIINSEWLVTAASCISIPNAREYLVRVGSTYSSSGGNVYQVSKIYRHEFDLNTMDNDIALVRLSTGVIFGTNVQSITLQESDVSDGTSATVLGWGTISEGGAQSNILKQVVVPVVGFHSCNTSYATYGGITDNMLCAGYNEGGVDACQGDTGGPLVASGHLIGIVSWGAGCGHSTFPGVYTKVSAYRDWIKDKTGV,./data/raw/alphafold//AF-A0A059WCN6-F1-model_v4.pdb,1862,1558,3143,1914
+1974,289,301,MSKVNGVPNEIKASALDIIGETPLLALDRLHPGPGRILVKCEFMNPGASIKCRSSLHMIQEARAKGLLKPGQPVLEVTSGNQGCGLAIVCAIYGHPLTVTMSKGNSVQRAIHMEALGAKCIRVPQVEGTYGNVTINDVKAAEEEGLKIAEETGAYYVNQFNNEDNANSHYLTTGPEIWRQSGHRIDAFIATVGTAGTFAGTSRYLKEKNPDIKCFVVEPEGSQPIKGTPITKPLHLLQGSGYGCIPNLFNFETMDGTLSVTDEEAVEYRKLIGEKEGLYVGYTSGANVAAAVKLLKSGLIPEDAWVVTPLNDSGLKYTPVPDSLT,brenda,A0A0U3S5Y4,C#N.N[C@@H](CS)C(=O)O>>N#CC[C@H](N)C(=O)O.S,1.69,9.557563684250816e-15,31.0,8.5,4.4.1.9,64459.0,0.2278867046136735,C#N.N[C@@H](CS)C(=O)O,N#CC[C@H](N)C(=O)O.S,0.2278867046136735,C#N.N[C@@H](CS)C(=O)O__MSKVNGVPNEIKASALDIIGETPLLALDRLHPGPGRILVKCEFMNPGASIKCRSSLHMIQEARAKGLLKPGQPVLEVTSGNQGCGLAIVCAIYGHPLTVTMSKGNSVQRAIHMEALGAKCIRVPQVEGTYGNVTINDVKAAEEEGLKIAEETGAYYVNQFNNEDNANSHYLTTGPEIWRQSGHRIDAFIATVGTAGTFAGTSRYLKEKNPDIKCFVVEPEGSQPIKGTPITKPLHLLQGSGYGCIPNLFNFETMDGTLSVTDEEAVEYRKLIGEKEGLYVGYTSGANVAAAVKLLKSGLIPEDAWVVTPLNDSGLKYTPVPDSLT,./data/raw/alphafold//AF-A0A0U3S5Y4-F1-model_v4.pdb,1010,547,205,222
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+1976,22519,22856,MSKIFDFVKPGVITGDDVQKVFQVAKENNFALPAVNCVGTDSINAVLETAAKVKAPVIVQFSNGGASFIAGKGVKSDVPQGAAILGAISGAHHVHQMAEHYGVPVILHTDHCAKKLLPWIDGLLDAGEKHFAATGKPLFSSHMIDLSEESLQENIEICSKYLERMSKIGMTLEIELGCTGGEEDGVDNSHMDASALYTQPEDVDYAYTELSKISPRFTIAASFGNVHGVYKPGNVVLTPTILRDSQEYVSKKHNLPHNSLNFVFHGGSGSTAQEIKDSVSYGVVKMNIDTDTQWATWEGVLNYYKANEAYLQGQLGNPKGEDQPNKKYYDPRVWLRAGQTSMIARLEKAFQELNAIDVL,brenda,P0AB71,O=P(O)(O)OC[C@H]1O[C@](O)(COP(=O)(O)O)[C@@H](O)[C@@H]1O>>O=C(CO)COP(=O)(O)O.O=C[C@H](O)COP(=O)(O)O,14.2,8.344257555591964e-15,57.0,9.0,4.1.2.13,562.0,1.1522883443830565,O=P(O)(O)OC[C@H]1O[C@](O)(COP(=O)(O)O)[C@@H](O)[C@@H]1O,O=C(CO)COP(=O)(O)O.O=C[C@H](O)COP(=O)(O)O,1.1522883443830565,O=P(O)(O)OC[C@H]1O[C@](O)(COP(=O)(O)O)[C@@H](O)[C@@H]1O__MSKIFDFVKPGVITGDDVQKVFQVAKENNFALPAVNCVGTDSINAVLETAAKVKAPVIVQFSNGGASFIAGKGVKSDVPQGAAILGAISGAHHVHQMAEHYGVPVILHTDHCAKKLLPWIDGLLDAGEKHFAATGKPLFSSHMIDLSEESLQENIEICSKYLERMSKIGMTLEIELGCTGGEEDGVDNSHMDASALYTQPEDVDYAYTELSKISPRFTIAASFGNVHGVYKPGNVVLTPTILRDSQEYVSKKHNLPHNSLNFVFHGGSGSTAQEIKDSVSYGVVKMNIDTDTQWATWEGVLNYYKANEAYLQGQLGNPKGEDQPNKKYYDPRVWLRAGQTSMIARLEKAFQELNAIDVL,./data/raw/alphafold//AF-P0AB71-F1-model_v4.pdb,791,222,5970,4097
+1977,6205,6314,MKPVWLVLNIGSSTVKFGLFDVADARPLVRGLIEGIGLQPRLKASLPDGTLELRAPADARDAKELTLWLLGLLEGRLGPLDLHAAGHRVVHGGPDYNAPVLLTPEVIERLESFSPLAPSHQPFNLAGVRAVEARWPGVPQIACFDTAFHHDRPRLARLYALPRAMAEEGILRYGFHGLSYDYIAGRLPEVLGETGRGKVIVAHLGSGASLCAMENLRSLDTTMGFSALDGLMMGTRCGQLDPGVILHFLRQGLTGPEIETILGRQSGLAGVSGISPDMRDLLASDRPEAAEAVDLFVRFILRQIGALSAGMGGLDALVFTAGIGQHAPEIRARVMEGLGWLGLEMDAAANGAGQGVISAPGSRVTAAVIATDEEAVILRALHCGEVAHYSAGVALA,brenda,Q3IYF1,CCC(=O)[O-].Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>CCC(=O)OP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,172.0,0.0867086331863563,37.0,5.7,2.7.2.18,1063.0,2.2355284469075487,CCC(=O)[O-].Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,CCC(=O)OP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,2.2355284469075487,CCC(=O)[O-].Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MKPVWLVLNIGSSTVKFGLFDVADARPLVRGLIEGIGLQPRLKASLPDGTLELRAPADARDAKELTLWLLGLLEGRLGPLDLHAAGHRVVHGGPDYNAPVLLTPEVIERLESFSPLAPSHQPFNLAGVRAVEARWPGVPQIACFDTAFHHDRPRLARLYALPRAMAEEGILRYGFHGLSYDYIAGRLPEVLGETGRGKVIVAHLGSGASLCAMENLRSLDTTMGFSALDGLMMGTRCGQLDPGVILHFLRQGLTGPEIETILGRQSGLAGVSGISPDMRDLLASDRPEAAEAVDLFVRFILRQIGALSAGMGGLDALVFTAGIGQHAPEIRARVMEGLGWLGLEMDAAANGAGQGVISAPGSRVTAAVIATDEEAVILRALHCGEVAHYSAGVALA,./data/raw/alphafold//AF-Q3IYF1-F1-model_v4.pdb,1421,939,740,1036
+1978,14562,14767,MVTGGMASKWDQKGMDIAYEEAALGYKEGGVPIGGCLINNKDGSVLGRGHNMRFQKGSATLHGEISTLENCGRLEGKVYKDTTLYTTLSPCDMCTGAIIMYGIPRCVVGENVNFKSKGEKYLQTRGHEVVVVDDERCKKIMKQFIDERPQDWFEDIGE,brenda,Q12178,N=c1[nH]c(O)ncc1F.O>>N.Oc1ncc(F)c(O)n1,18.8,9.627363314704391e-15,25.0,6.85,3.5.4.1,4932.0,1.2741578492636798,N=c1[nH]c(O)ncc1F.O,N.Oc1ncc(F)c(O)n1,1.2741578492636798,N=c1[nH]c(O)ncc1F.O__MVTGGMASKWDQKGMDIAYEEAALGYKEGGVPIGGCLINNKDGSVLGRGHNMRFQKGSATLHGEISTLENCGRLEGKVYKDTTLYTTLSPCDMCTGAIIMYGIPRCVVGENVNFKSKGEKYLQTRGHEVVVVDDERCKKIMKQFIDERPQDWFEDIGE,./data/raw/alphafold//AF-Q12178-F1-model_v4.pdb,2405,4805,4867,4715
+1979,4505,4560,MATFVELSTKAKMPIVGLGTWKSPLGKVKEAVKVAIDAGYRHIDCAYVYQNEHEVGEAIQEKIQEKAVKREDLFIVSKLWPTFFERPLVRKAFEKTLKDLKLSYLDVYLIHWPQGFKSGDDLFPKDDKGNAIGGKATFLDAWEAMEELVDEGLVKALGVSNFSHFQIEKLLNKPGLKYKPVTNQVECHPYLTQEKLIQYCHSKGITVTAYSPLGSPDRPWAKPEDPSLLEDPKIKEIAAKHKKTAAQVLIRFHIQRNVIVIPKSVTPARIVENIQVFDFKLSDEEMATILSFNRNWRACNVLQSSHLEDYPFNAEY,sabio,O60218,CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CCO.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>>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(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.[H],432.0,0.0,37.0,7.4,1.1.1.21,9606.0,2.635483746814912,CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CCO.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,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(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.[H],2.635483746814912,CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CCO.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__MATFVELSTKAKMPIVGLGTWKSPLGKVKEAVKVAIDAGYRHIDCAYVYQNEHEVGEAIQEKIQEKAVKREDLFIVSKLWPTFFERPLVRKAFEKTLKDLKLSYLDVYLIHWPQGFKSGDDLFPKDDKGNAIGGKATFLDAWEAMEELVDEGLVKALGVSNFSHFQIEKLLNKPGLKYKPVTNQVECHPYLTQEKLIQYCHSKGITVTAYSPLGSPDRPWAKPEDPSLLEDPKIKEIAAKHKKTAAQVLIRFHIQRNVIVIPKSVTPARIVENIQVFDFKLSDEEMATILSFNRNWRACNVLQSSHLEDYPFNAEY,./data/raw/alphafold//AF-O60218-F1-model_v4.pdb,1329,607,647,301
+1980,5257,5343,MIRRCFQVAARLGHHRGLLEAPRILPRLNPASAFGSSTDSMFSRFLPEKTDLKDYALPNASWCSDMLSLYQEFLEKTKSSGWIKLPSFKSNRDHIRGLKLPSGLAVSSDKGDCRIFTRCIQVEGQGFEYVIFFQPTQKKSVCLFQPGSYLEGPPGFAHGGSLAAMMDETFSKTAFLAGEGLFTLSLNIRFKNLIPVDSLVVMDVELDKIEDQKLYMSCIAHSRDQQTVYAKSSGVFLQLQLEEESPQ,sabio,Q8N1Q8,CC/C=C\C/C=C\C/C=C\CCCCCCCC(=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.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.CCC=CCC=CCC=CCCCCCCCC(=O)O,13.3,2.1727536815738142e-14,37.0,7.5,3.1.2.2,9606.0,1.1238516409670858,CC/C=C\C/C=C\C/C=C\CCCCCCCC(=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.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.CCC=CCC=CCC=CCCCCCCCC(=O)O,1.1238516409670858,CC/C=C\C/C=C\C/C=C\CCCCCCCC(=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.O__MIRRCFQVAARLGHHRGLLEAPRILPRLNPASAFGSSTDSMFSRFLPEKTDLKDYALPNASWCSDMLSLYQEFLEKTKSSGWIKLPSFKSNRDHIRGLKLPSGLAVSSDKGDCRIFTRCIQVEGQGFEYVIFFQPTQKKSVCLFQPGSYLEGPPGFAHGGSLAAMMDETFSKTAFLAGEGLFTLSLNIRFKNLIPVDSLVVMDVELDKIEDQKLYMSCIAHSRDQQTVYAKSSGVFLQLQLEEESPQ,./data/raw/alphafold//AF-Q8N1Q8-F1-model_v4.pdb,3117,1886,3520,2339
+1981,656,675,MDRRTKIVCTLGPAVASADGILRLVEDGMDVARLNFSHGDHPDHEQNYKWVREAAEKTGRAVGILADLQGPKIRLGRFTDGATVWENGETIRITVDDVEGTHDRVSTTYKNLAKDAKPGDRLLVDDGKVGLVCVSVEGNDVICEVVEGGPVSNNKGVSLPGMDISVPALSEKDIRDLRFALKLGVDFIALSFVRSPADAELVHKIMDEEGRRVPVIAKLEKPEAVTSLEPIVLAFDAVMVARGDLGVEVPLEEVPLVQKRAIQIARENAKPVIVATQMLDSMIENSRPTRAEASDVANAVLDGADAVMLSGETSVGKDPHNVVRTMSRIVRFAETDGRVPDLTHIPRTKRGVISYSARDIAERLNARALVAFTTSGDTAKRVARLHSHLPLLVFTPNEAVRSELALTWGATTFLCPPVSDTDDMMREVDRALLAMPEYNKGDMMVVVAGSPPGVTGNTNMIHVHLLGDDTRIAKL,sabio,Q46078,C=C(OP(=O)(O)O)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O>>CC(=O)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,2540.0,0.0,22.0,7.7,2.7.1.40,1718.0,3.404833716619938,C=C(OP(=O)(O)O)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,CC(=O)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,3.404833716619938,C=C(OP(=O)(O)O)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O__MDRRTKIVCTLGPAVASADGILRLVEDGMDVARLNFSHGDHPDHEQNYKWVREAAEKTGRAVGILADLQGPKIRLGRFTDGATVWENGETIRITVDDVEGTHDRVSTTYKNLAKDAKPGDRLLVDDGKVGLVCVSVEGNDVICEVVEGGPVSNNKGVSLPGMDISVPALSEKDIRDLRFALKLGVDFIALSFVRSPADAELVHKIMDEEGRRVPVIAKLEKPEAVTSLEPIVLAFDAVMVARGDLGVEVPLEEVPLVQKRAIQIARENAKPVIVATQMLDSMIENSRPTRAEASDVANAVLDGADAVMLSGETSVGKDPHNVVRTMSRIVRFAETDGRVPDLTHIPRTKRGVISYSARDIAERLNARALVAFTTSGDTAKRVARLHSHLPLLVFTPNEAVRSELALTWGATTFLCPPVSDTDDMMREVDRALLAMPEYNKGDMMVVVAGSPPGVTGNTNMIHVHLLGDDTRIAKL,./data/raw/alphafold//AF-Q46078-F1-model_v4.pdb,1135,730,420,476
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+1994,17773,18016,MAPSQRPLSRRGLLAGGAIAAAAGALAACSEERAAGARPSATQTTGTATEPFHGPHQAGIATPPQAHAVFLGLDLRKGTGRKELGRLMRLLTDDARRLTQGRPALADPEPDLAPLPSRLTFTFGFGPGLFKAAGLEKQRPEGLRPLPPFKVDRLEDRWSGGDLLVQICCDDPITLAHALRMTVKDARAFTRVRWVQRGFRRSPGVQSSGATQRNLMGQLDGTVNPVPGTADFDQAVWVQDGPEWLRGGTTLVLRRIRMELEKWDEADPAGKEFAVGRRLTSGAPLTGRHEHDEPDFDAVDSAGFPVIAENAHIRLAHVDSPRLRMLRRPYNYDEGLTADGRSDAGLLFAAYQADIDRQFIPVQRRLDEGGDLLNLWTTPIGSAVFAIPPGCDENGWIGQGLLG,brenda,D1A807,Nc1c(S(=O)(=O)O)cc(Nc2ccc(S(=O)(=O)O)c(N=c3[nH]c(Cl)nc(=Nc4cccc(S(=O)(=O)O)c4)[nH]3)c2)c2c1C(=O)c1ccccc1C2=O.OO>>N=c1nc(Cl)[nH]c(=Nc2cccc(S(=O)(=O)O)c2)[nH]1.O=C(O)c1ccccc1C(=O)O.O=S(=O)(O)c1ccccc1/N=N/c1ccccc1S(=O)(=O)O,27.0,0.1244916283085047,22.0,3.0,1.11.1.19,2020.0,1.4313637641589874,Nc1c(S(=O)(=O)O)cc(Nc2ccc(S(=O)(=O)O)c(N=c3[nH]c(Cl)nc(=Nc4cccc(S(=O)(=O)O)c4)[nH]3)c2)c2c1C(=O)c1ccccc1C2=O.OO,N=c1nc(Cl)[nH]c(=Nc2cccc(S(=O)(=O)O)c2)[nH]1.O=C(O)c1ccccc1C(=O)O.O=S(=O)(O)c1ccccc1/N=N/c1ccccc1S(=O)(=O)O,2.4471580313422194,Nc1c(S(=O)(=O)O)cc(Nc2ccc(S(=O)(=O)O)c(N=c3[nH]c(Cl)nc(=Nc4cccc(S(=O)(=O)O)c4)[nH]3)c2)c2c1C(=O)c1ccccc1C2=O.OO__MAPSQRPLSRRGLLAGGAIAAAAGALAACSEERAAGARPSATQTTGTATEPFHGPHQAGIATPPQAHAVFLGLDLRKGTGRKELGRLMRLLTDDARRLTQGRPALADPEPDLAPLPSRLTFTFGFGPGLFKAAGLEKQRPEGLRPLPPFKVDRLEDRWSGGDLLVQICCDDPITLAHALRMTVKDARAFTRVRWVQRGFRRSPGVQSSGATQRNLMGQLDGTVNPVPGTADFDQAVWVQDGPEWLRGGTTLVLRRIRMELEKWDEADPAGKEFAVGRRLTSGAPLTGRHEHDEPDFDAVDSAGFPVIAENAHIRLAHVDSPRLRMLRRPYNYDEGLTADGRSDAGLLFAAYQADIDRQFIPVQRRLDEGGDLLNLWTTPIGSAVFAIPPGCDENGWIGQGLLG,./data/raw/alphafold//AF-D1A807-F1-model_v4.pdb,3428,2329,1048,2949
+1995,11129,11285,MGRIKSSSGRCSTARLEAVAVLVVVFGVASSSLRGCIAQQSGGGLTRGSFPEGFVFGTASAAYQYEGAVKEDGRGQTIWDTFAHTFGKITDFSNADVAVDQYHRFEEDIQLMADMGMDAYRFSIAWSRIYPNGVGQVNQAGIDHYNKLIDALLAKGIQPYVTLYHWDLPQALEDKYKGWLDRQIVDDFAAYAETCFREFGDRVKHWITLNEPHTVAIQGYDAGLQAPGRCSVLLHLYCKAGNSGTEPYVVAHHFILAHAAAASIYRTKYKATQNGQLGIAFDVMWFEPMSNTTIDIEAAKRAQEFQLGWFADPFFFGDYPATMRARVGERLPRFTADEAAVVKGALDFVGINHYTTYYTRHNNTNIIGTLLNNTLADTGTVSLPFKNGKPIGDRANSIWLYIVPRGMRSLMNYVKERYNSPPVYITENGMDDSNNPFISIKDALKDSKRIKYHNDYLTNLAASIKEDGCDVRGYFAWSLLDNWEWAAGYSSRFGLYFVDYKDNLKRYPKNSVQWFKALLKT,brenda,Q8L7J2,C[C@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@@H](O)[C@H]1O.OCCc1ccccc1>>C[C@H]1O[C@@H](OCCc2ccccc2)[C@H](O)[C@@H](O)[C@H]1O.O=[N+]([O-])c1ccc(O)cc1,33.5,0.0,30.0,5.0,3.2.1.21,4530.0,1.5250448070368452,C[C@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@@H](O)[C@H]1O.OCCc1ccccc1,C[C@H]1O[C@@H](OCCc2ccccc2)[C@H](O)[C@@H](O)[C@H]1O.O=[N+]([O-])c1ccc(O)cc1,1.5250448070368452,C[C@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@@H](O)[C@H]1O.OCCc1ccccc1__MGRIKSSSGRCSTARLEAVAVLVVVFGVASSSLRGCIAQQSGGGLTRGSFPEGFVFGTASAAYQYEGAVKEDGRGQTIWDTFAHTFGKITDFSNADVAVDQYHRFEEDIQLMADMGMDAYRFSIAWSRIYPNGVGQVNQAGIDHYNKLIDALLAKGIQPYVTLYHWDLPQALEDKYKGWLDRQIVDDFAAYAETCFREFGDRVKHWITLNEPHTVAIQGYDAGLQAPGRCSVLLHLYCKAGNSGTEPYVVAHHFILAHAAAASIYRTKYKATQNGQLGIAFDVMWFEPMSNTTIDIEAAKRAQEFQLGWFADPFFFGDYPATMRARVGERLPRFTADEAAVVKGALDFVGINHYTTYYTRHNNTNIIGTLLNNTLADTGTVSLPFKNGKPIGDRANSIWLYIVPRGMRSLMNYVKERYNSPPVYITENGMDDSNNPFISIKDALKDSKRIKYHNDYLTNLAASIKEDGCDVRGYFAWSLLDNWEWAAGYSSRFGLYFVDYKDNLKRYPKNSVQWFKALLKT,./data/raw/alphafold//AF-Q8L7J2-F1-model_v4.pdb,1057,2180,3861,2728
+1996,18722,18995,MATDFSKLSKYVETLRVKPKQSIDLKKDFDTDYDHKMLTKEEGEELLNLGISKLSEIQEKLYASGTKSVLIVFQAMDAAGKDGTVKHIMTGLNPQGVKVTSFKVPSKIELSHDYLWRHYVALPATGEIGIFNRSHYENVLVTRVHPEYLLSEQTSGVTAIEQVNQKFWDKRFQQINNFEQHISENGTIVLKFFLHVSKKEQKKRFIERIELDTKNWKFSTGDLKERAHWKDYRNAYEDMLANTSTKQAPWFVIPADDKWFTRLLIAEIICTELEKLNLTFPTVSLEQKAELEKAKAELVAEKSSD,brenda,A0A6N4SMB5,Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)O)O1>>Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O1,2.77,10000000.0,30.0,8.0,2.7.4.1,985.0,0.4424797690644485,Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)O)O1,Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O1,0.4424797690644485,Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)O)O1__MATDFSKLSKYVETLRVKPKQSIDLKKDFDTDYDHKMLTKEEGEELLNLGISKLSEIQEKLYASGTKSVLIVFQAMDAAGKDGTVKHIMTGLNPQGVKVTSFKVPSKIELSHDYLWRHYVALPATGEIGIFNRSHYENVLVTRVHPEYLLSEQTSGVTAIEQVNQKFWDKRFQQINNFEQHISENGTIVLKFFLHVSKKEQKKRFIERIELDTKNWKFSTGDLKERAHWKDYRNAYEDMLANTSTKQAPWFVIPADDKWFTRLLIAEIICTELEKLNLTFPTVSLEQKAELEKAKAELVAEKSSD,./data/raw/alphafold//AF-A0A6N4SMB5-F1-model_v4.pdb,2479,4907,4979,4833
+1997,21479,21803,MREPLTLDDFARLARGQLPAATWDFIAGGAGRERTLAANEAVFGAVRLRPRALPGIEEPDTSVEVLGSRWPAPVGIAPVAYHGLAHPDGEPATAAAAGALGLPLVVSTFAGRSLEEVARAASAPLWLQLYCFRDHETTLGLARRARDSGYQALVLTVDTPFTGRRLRDLRNGFAVPAHITPANLTGTAAAGSATPGAHSRLAFDRRLDWSFVARLGAASGLPVLAKGVLTAPDAEAAVAAGVAGIVVSNHGGRQLDGAPATLEALPEVVSAVRGRCPVLLDGGVRTGADVLAALALGARAVLVGRPALYALAVGGASGVRRMLTLLTEDFADTMVLTGHAATGTIGPDTLAPPHHAPPHHGPPTAPRPAPHRDRSHG,brenda,Q9Z4X8,O=C(O)[C@@H](O)c1ccc(O)cc1.O=O>>O=C(O)C(=O)c1ccc(O)cc1.OO,3.5,7.082550718779347e-15,28.0,7.5,1.1.3.46,1902.0,0.5440680443502757,O=C(O)[C@@H](O)c1ccc(O)cc1.O=O,O=C(O)C(=O)c1ccc(O)cc1.OO,0.5440680443502757,O=C(O)[C@@H](O)c1ccc(O)cc1.O=O__MREPLTLDDFARLARGQLPAATWDFIAGGAGRERTLAANEAVFGAVRLRPRALPGIEEPDTSVEVLGSRWPAPVGIAPVAYHGLAHPDGEPATAAAAGALGLPLVVSTFAGRSLEEVARAASAPLWLQLYCFRDHETTLGLARRARDSGYQALVLTVDTPFTGRRLRDLRNGFAVPAHITPANLTGTAAAGSATPGAHSRLAFDRRLDWSFVARLGAASGLPVLAKGVLTAPDAEAAVAAGVAGIVVSNHGGRQLDGAPATLEALPEVVSAVRGRCPVLLDGGVRTGADVLAALALGARAVLVGRPALYALAVGGASGVRRMLTLLTEDFADTMVLTGHAATGTIGPDTLAPPHHAPPHHGPPTAPRPAPHRDRSHG,./data/raw/alphafold//AF-Q9Z4X8-F1-model_v4.pdb,663,43,5753,6655
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+1999,19482,19768,MAIKRGADLIVEALEEYGTEQVVGFIGHTSHFVADAFSKSHLGKRVINPATELGGAWMVNGYNYVKDRSAAVGAWHCVGNLLLHAAMQEARTGRIPAVHIGLNSDGRLAGRSEAAQQVPWQSFTPIARSTQRVERLDKVGEAIHEAFRVAEGHPAGPAYVDIPFDLTADQIDDKALVPRGATRAKSVLHAPNEDVREAAAQLVAAKNPVILAGGGVARSGGSEALLKLAEMVGVPVVTTSTGAGVFPETHALAMGSAGFCGWKSANDMMAAADFVLVLGSRLSDWGIAQGYITKMPKFVHVDTDPAVLGTFYFPLLSVVADAKTFMEQLIEVLPGTSGFKAVRYQERENFRQATEFRAAWDGWVREQESGDGMPASMFRAMAEVRKVQRPEDIIVTDIGNHTLPMFGGAILQRPRRLVTSMAEGILGCGFPMALGAQLAEPNSRVFLGTGDGALYYHFNEFRVAVEHKLPVITMVFTNESYGANWTLMNHQFGQNNWTEFMNPDWVGIAKAFGAYGESVRETGDIAGALQRAIDSGKPALIEIPVSKTQGLASDPVGGVGPNLLLKGREIPVDTGGSMYPGENLLHLKS,brenda,P0CH62,O.O=C1CCCCC1=O>>O=CCCCCC(=O)O,1.6,0.0,37.0,8.0,3.7.1.11,29544.0,0.2041199826559248,O.O=C1CCCCC1=O,O=CCCCCC(=O)O,0.2041199826559248,O.O=C1CCCCC1=O__MAIKRGADLIVEALEEYGTEQVVGFIGHTSHFVADAFSKSHLGKRVINPATELGGAWMVNGYNYVKDRSAAVGAWHCVGNLLLHAAMQEARTGRIPAVHIGLNSDGRLAGRSEAAQQVPWQSFTPIARSTQRVERLDKVGEAIHEAFRVAEGHPAGPAYVDIPFDLTADQIDDKALVPRGATRAKSVLHAPNEDVREAAAQLVAAKNPVILAGGGVARSGGSEALLKLAEMVGVPVVTTSTGAGVFPETHALAMGSAGFCGWKSANDMMAAADFVLVLGSRLSDWGIAQGYITKMPKFVHVDTDPAVLGTFYFPLLSVVADAKTFMEQLIEVLPGTSGFKAVRYQERENFRQATEFRAAWDGWVREQESGDGMPASMFRAMAEVRKVQRPEDIIVTDIGNHTLPMFGGAILQRPRRLVTSMAEGILGCGFPMALGAQLAEPNSRVFLGTGDGALYYHFNEFRVAVEHKLPVITMVFTNESYGANWTLMNHQFGQNNWTEFMNPDWVGIAKAFGAYGESVRETGDIAGALQRAIDSGKPALIEIPVSKTQGLASDPVGGVGPNLLLKGREIPVDTGGSMYPGENLLHLKS,./data/raw/alphafold//AF-P0CH62-F1-model_v4.pdb,280,2815,5137,5998
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+2011,21922,22251,MLQTKDYEFWFVTGSQHLYGEETLELVDQHAKSICEGLSGVSSRYKITHKPVVTSSETIRQLLREAEYSETCAGIITWMHTFSPAKMWIEGLSSYQKPLMHLHTQYNRDIPWGTIDMDFMNSNQSAHGDREYGYINSRMGLSRKIVAGYWDDEEVKKEISQWMDTAAALNESRHIKVARFGDNMRHVAVTDGEQVGAHIQFGWQVDGYGIGDLVEVMNRITDDEVDTLYAEYDRLYAISEEPKRDEPKVASIKEQAKIELGLTAFLEQGGYSAFTTSFEVLHGMKQLPGLAVQRLMEKGYGFAGEGDWKTAALYRMMKIMAQGKRTSFMEDYTYHFDPGNEMILGSHMLKVCPTVALDQPKMRFHPLSIGGKEDPARFVFNGISGSAIQASLVDIGGRFRLVLNEVNGQEIEKDMPNLPVARVLWKPEPSLKTAAEAWILAGGAHHTCLSYELTVEQMLDWAEMAGIESVLISRDTTIHKLKHELKWNEALYRLQK,brenda,C7F8M0,O=CC(O)[C@@H](O)CO>>,241.7,99.17426344299116,23.0,7.5,5.3.1.4,1423.0,2.3832766504076504,O=CC(O)[C@@H](O)CO,,2.3832766504076504,O=CC(O)[C@@H](O)CO__MLQTKDYEFWFVTGSQHLYGEETLELVDQHAKSICEGLSGVSSRYKITHKPVVTSSETIRQLLREAEYSETCAGIITWMHTFSPAKMWIEGLSSYQKPLMHLHTQYNRDIPWGTIDMDFMNSNQSAHGDREYGYINSRMGLSRKIVAGYWDDEEVKKEISQWMDTAAALNESRHIKVARFGDNMRHVAVTDGEQVGAHIQFGWQVDGYGIGDLVEVMNRITDDEVDTLYAEYDRLYAISEEPKRDEPKVASIKEQAKIELGLTAFLEQGGYSAFTTSFEVLHGMKQLPGLAVQRLMEKGYGFAGEGDWKTAALYRMMKIMAQGKRTSFMEDYTYHFDPGNEMILGSHMLKVCPTVALDQPKMRFHPLSIGGKEDPARFVFNGISGSAIQASLVDIGGRFRLVLNEVNGQEIEKDMPNLPVARVLWKPEPSLKTAAEAWILAGGAHHTCLSYELTVEQMLDWAEMAGIESVLISRDTTIHKLKHELKWNEALYRLQK,./data/raw/alphafold//AF-C7F8M0-F1-model_v4.pdb,849,311,5871,6782
+2012,12625,12795,MALLTLFNQIWQEGQLQSSTSSFNIFLVPILCLSIFILFSLTRSSSPSEKNRKLKLPPSPPRLPWIGNLHQLGSFPHRSLRALSKKYGDVMFMHFGKVPTLIVSSAEMAKDVMKTQDIVFCSRPQTTAPSILFYDGHDIAFAPYGEYWRQVRRICVLELLSLKRVHQFQYARVEEVAELVSKIRKASASANGAPINLGELLVSTSNNIICRCILGQKFEDKEDNWFGETTKELMTQVMSFSFGDFFPSLKWIDRARGYLAYLKSIWLEFDKFFDKLIDEHKAAQKEGKPRKKDIVDILLDVQNDGSLDFELTTSNVKAILQDMFVGGSDTSWTAAIWLMSELSQNPRVMKKVQEEVRRVAGKRGYVEESDINEMKYLTCVIKENLRLHPPAPLLLPREAMSDVKLGGFDIPAKTQVFVNAYAVQRDPKVWDKPDEFMPERFEENNVGFVGQDFELIPFGAGRRVCPGLAFGVASAQYVLANMLYWFDWKLPSGGSKLAETLDMSEVYGLTVHKKSPLYLVPTPYSP,brenda,A0A068Q609,N#CCc1ccc(O)cc1.O=O>>N#CC(O)c1ccc(O)cc1.O,0.57,10000000.0,30.0,7.6,1.14.14.44,102107.0,-0.2441251443275086,N#CCc1ccc(O)cc1.O=O,N#CC(O)c1ccc(O)cc1.O,-0.2441251443275086,N#CCc1ccc(O)cc1.O=O__MALLTLFNQIWQEGQLQSSTSSFNIFLVPILCLSIFILFSLTRSSSPSEKNRKLKLPPSPPRLPWIGNLHQLGSFPHRSLRALSKKYGDVMFMHFGKVPTLIVSSAEMAKDVMKTQDIVFCSRPQTTAPSILFYDGHDIAFAPYGEYWRQVRRICVLELLSLKRVHQFQYARVEEVAELVSKIRKASASANGAPINLGELLVSTSNNIICRCILGQKFEDKEDNWFGETTKELMTQVMSFSFGDFFPSLKWIDRARGYLAYLKSIWLEFDKFFDKLIDEHKAAQKEGKPRKKDIVDILLDVQNDGSLDFELTTSNVKAILQDMFVGGSDTSWTAAIWLMSELSQNPRVMKKVQEEVRRVAGKRGYVEESDINEMKYLTCVIKENLRLHPPAPLLLPREAMSDVKLGGFDIPAKTQVFVNAYAVQRDPKVWDKPDEFMPERFEENNVGFVGQDFELIPFGAGRRVCPGLAFGVASAQYVLANMLYWFDWKLPSGGSKLAETLDMSEVYGLTVHKKSPLYLVPTPYSP,./data/raw/alphafold//AF-A0A068Q609-F1-model_v4.pdb,2132,4332,4219,4077
+2013,411,427,MQTARLFQGNLNLAAANIRDYEKKEQRNLGVWLSLNQWLRLYDEDTRFWWTTTAPMLGRMMELIGYDQDAQQKHLLFYYIYVLPSLGRRPSPEGYPTGWNSFMTDDYSPLELSWDWGVAEGESSVRFSIEPIGKYAGTQADPLNQKMVYQLVDGLRPAFHHTLDLTLFDVFSEALTTSREKFGTRKLSLEGRSQYFVAFDLDVGHPRLKAYFMPGLKSIESNTPVSELVVKAMDACELHFGSLFMQAFRRLNSDLEAFSATSYHRPEIEIVGIDCVSPVKSRAKIYIRHRGTSFDSVCRMLSMGAKAPLDAASVASLRELWALVLGLPKDFPSDQELPSVPHRTSGVLYYFEIKPTSDAIVPKVYIPVRHYASNDLSIAQGLATYFERRGQTVAAENYVDALSDIFSHRSLDSGLGLHTYISCTFKKTGLSVTSYFNPEIYHPNRYRQ,brenda,Q6Q874,C/C=C/COP(=O)(O)OP(=O)(O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O>>C/C=C/COc1ccc(C[C@H](N)C(=O)O)cc1.O=P(O)(O)OP(=O)(O)O,0.001,0.0,35.0,7.5,2.5.1.122,5022.0,-3.0,C/C=C/COP(=O)(O)OP(=O)(O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O,C/C=C/COc1ccc(C[C@H](N)C(=O)O)cc1.O=P(O)(O)OP(=O)(O)O,-2.5228787452803374,C/C=C/COP(=O)(O)OP(=O)(O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O__MQTARLFQGNLNLAAANIRDYEKKEQRNLGVWLSLNQWLRLYDEDTRFWWTTTAPMLGRMMELIGYDQDAQQKHLLFYYIYVLPSLGRRPSPEGYPTGWNSFMTDDYSPLELSWDWGVAEGESSVRFSIEPIGKYAGTQADPLNQKMVYQLVDGLRPAFHHTLDLTLFDVFSEALTTSREKFGTRKLSLEGRSQYFVAFDLDVGHPRLKAYFMPGLKSIESNTPVSELVVKAMDACELHFGSLFMQAFRRLNSDLEAFSATSYHRPEIEIVGIDCVSPVKSRAKIYIRHRGTSFDSVCRMLSMGAKAPLDAASVASLRELWALVLGLPKDFPSDQELPSVPHRTSGVLYYFEIKPTSDAIVPKVYIPVRHYASNDLSIAQGLATYFERRGQTVAAENYVDALSDIFSHRSLDSGLGLHTYISCTFKKTGLSVTSYFNPEIYHPNRYRQ,./data/raw/alphafold//AF-Q6Q874-F1-model_v4.pdb,1038,586,249,270
+2014,7368,7490,MSVSALSSTRFTGSISGFLQVASVLGLLLLLVKAVQFYLQRQWLLKAFQQFPSPPFHWFFGHKQFQGDKELQQIMTCVENFPSAFPRWFWGSKAYLIVYDPDYMKVILGRSDPKANGVYRLLAPWIGYGLLLLNGQPWFQHRRMLTPAFHYDILKPYVKNMADSIRLMLDKWEQLAGQDSSIEIFQHISLMTLDTVMKCAFSHNGSVQVDGNYKSYIQAIGNLNDLFHSRVRNIFHQNDTIYNFSSNGHLFNRACQLAHDHTDGVIKLRKDQLQNAGELEKVKKKRRLDFLDILLLARMENGDSLSDKDLRAEVDTFMFEGHDTTASGVSWIFYALATHPEHQQRCREEVQSVLGDGSSITWDHLDQIPYTTMCIKEALRLYPPVPGIVRELSTSVTFPDGRSLPKGIQVTLSIYGLHHNPKVWPNPEVFDPSRFAPDSPRHSHSFLPFSGGARNCIGKQFAMSEMKVIVALTLLRFELLPDPTKVPIPLPRLVLKSKNGIYLYLKKLH,brenda,P08516,CCCCCCCCCCCCCCCC(=O)O.O=O>>O.O=C(O)CCCCCCCCCCCCCCCO,1.0,10000000.0,37.0,7.4,1.14.14.80,10116.0,0.0,CCCCCCCCCCCCCCCC(=O)O.O=O,O.O=C(O)CCCCCCCCCCCCCCCO,0.0,CCCCCCCCCCCCCCCC(=O)O.O=O__MSVSALSSTRFTGSISGFLQVASVLGLLLLLVKAVQFYLQRQWLLKAFQQFPSPPFHWFFGHKQFQGDKELQQIMTCVENFPSAFPRWFWGSKAYLIVYDPDYMKVILGRSDPKANGVYRLLAPWIGYGLLLLNGQPWFQHRRMLTPAFHYDILKPYVKNMADSIRLMLDKWEQLAGQDSSIEIFQHISLMTLDTVMKCAFSHNGSVQVDGNYKSYIQAIGNLNDLFHSRVRNIFHQNDTIYNFSSNGHLFNRACQLAHDHTDGVIKLRKDQLQNAGELEKVKKKRRLDFLDILLLARMENGDSLSDKDLRAEVDTFMFEGHDTTASGVSWIFYALATHPEHQQRCREEVQSVLGDGSSITWDHLDQIPYTTMCIKEALRLYPPVPGIVRELSTSVTFPDGRSLPKGIQVTLSIYGLHHNPKVWPNPEVFDPSRFAPDSPRHSHSFLPFSGGARNCIGKQFAMSEMKVIVALTLLRFELLPDPTKVPIPLPRLVLKSKNGIYLYLKKLH,./data/raw/alphafold//AF-P08516-F1-model_v4.pdb,3263,2093,3755,2613
+2015,753,773,MNALPTSLLQRLLERPAPFALLYRPESNGPGLLDVIRGEALELHGLADLPLDEPGPGLPRHDLLALIPYRQIAERGFEALDDGTPLLALKVLEQELLPLEQALALLPNQALELSEEGFDLDDEAYAEVVGRVIADEIGRGEGANFVIKRRFQARIDGYATASALSFFRQLLLREKGAYWTFIVHTGERTLVGASPERHISVRDGLAVMNPISGTYRYPPAGPNLAEVMEFLDNRKEADELYMVVDEELKMMARICEDGGRVLGPYLKEMAHLAHTEYFIEGQTSRDVREVLRETLFAPTVTGSPLESACRVIRRYEPQGRGYYSGVAALIGGDGQGGRTLDSAILIRTAEIEGDGRLRIGVGSTIVRHSDPLGEAAESRAKASGLIAALKSQAPQRLGSHPHVVAALASRNAPIADFWLRGASERQQLQADLSGREVLIVDAEDTFTSMIAKQLKSLGLTVTVRGFQEPYSFDGYDLVIMGPGPGNPTEIGQPKIGHLHLAIRSLLSERRPFLAVCLSHQVLSLCLGLDLQRRQEPNQGVQKQIDLFGAAERVGFYNTFAARALQDRIEIPEVGPIEISRDRETGEVHALRGPRFASMQFHPESVLTREGPRIIADLLRHALVERRP,brenda,G3XCK6,C=C(O[C@@H]1C=C(C(=O)O)C=C[C@H]1O)C(=O)O.N=C(O)CC[C@H](N)C(=O)O>>C=C(O[C@H]1C=CC=C(C(=O)O)[C@@H]1N)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O,2.2,7.623235638334902e-15,25.0,7.0,2.6.1.86,287.0,0.3424226808222063,C=C(O[C@@H]1C=C(C(=O)O)C=C[C@H]1O)C(=O)O.N=C(O)CC[C@H](N)C(=O)O,C=C(O[C@H]1C=CC=C(C(=O)O)[C@@H]1N)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O,0.3424226808222063,C=C(O[C@@H]1C=C(C(=O)O)C=C[C@H]1O)C(=O)O.N=C(O)CC[C@H](N)C(=O)O__MNALPTSLLQRLLERPAPFALLYRPESNGPGLLDVIRGEALELHGLADLPLDEPGPGLPRHDLLALIPYRQIAERGFEALDDGTPLLALKVLEQELLPLEQALALLPNQALELSEEGFDLDDEAYAEVVGRVIADEIGRGEGANFVIKRRFQARIDGYATASALSFFRQLLLREKGAYWTFIVHTGERTLVGASPERHISVRDGLAVMNPISGTYRYPPAGPNLAEVMEFLDNRKEADELYMVVDEELKMMARICEDGGRVLGPYLKEMAHLAHTEYFIEGQTSRDVREVLRETLFAPTVTGSPLESACRVIRRYEPQGRGYYSGVAALIGGDGQGGRTLDSAILIRTAEIEGDGRLRIGVGSTIVRHSDPLGEAAESRAKASGLIAALKSQAPQRLGSHPHVVAALASRNAPIADFWLRGASERQQLQADLSGREVLIVDAEDTFTSMIAKQLKSLGLTVTVRGFQEPYSFDGYDLVIMGPGPGNPTEIGQPKIGHLHLAIRSLLSERRPFLAVCLSHQVLSLCLGLDLQRRQEPNQGVQKQIDLFGAAERVGFYNTFAARALQDRIEIPEVGPIEISRDRETGEVHALRGPRFASMQFHPESVLTREGPRIIADLLRHALVERRP,./data/raw/alphafold//AF-G3XCK6-F1-model_v4.pdb,1167,777,478,545
+2016,2383,2417,MRRCEVNSKPISEYFGIPCENREMAKCLLTSSLSVRTKLLQTGVSLYNTSHGFHEEEVKKILEQFPGGSIDLLKKQNGIGILTLNNPNKMNAFSGVMMLQLLERVIELENWTEGKGLIIHGAKNTFCSGSDLNAVKALSTPESGVALSMFMQNTLTRFMRLPLISVALVQGWAMGGGAELTTACDFRLMTEESVIRFVHKEMGIVPSWGGTSRLVEIIGSRQALKVLSGTLKLDSKEALNIGLTDEVLQPSDETTALEQAQEWLEKFVSGPPQVIRGLKKSVCSARELYIEEALQNERDVLETLWGGPANLEAIAKKGKHTK,sabio,Q9D9V3,CC(C(=O)O)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>>CCC(=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=C=O,1.68,6.547920994340377e-15,30.0,7.1,4.1.1.94,10090.0,0.2253092817258628,CC(C(=O)O)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,CCC(=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=C=O,0.2253092817258628,CC(C(=O)O)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__MRRCEVNSKPISEYFGIPCENREMAKCLLTSSLSVRTKLLQTGVSLYNTSHGFHEEEVKKILEQFPGGSIDLLKKQNGIGILTLNNPNKMNAFSGVMMLQLLERVIELENWTEGKGLIIHGAKNTFCSGSDLNAVKALSTPESGVALSMFMQNTLTRFMRLPLISVALVQGWAMGGGAELTTACDFRLMTEESVIRFVHKEMGIVPSWGGTSRLVEIIGSRQALKVLSGTLKLDSKEALNIGLTDEVLQPSDETTALEQAQEWLEKFVSGPPQVIRGLKKSVCSARELYIEEALQNERDVLETLWGGPANLEAIAKKGKHTK,./data/raw/alphafold//AF-Q9D9V3-F1-model_v4.pdb,1588,1170,3015,1364
+2017,3327,3375,MQTFQADLAIVGAGGAGLRAAIAAAQANPNAKIALISKVYPMRSHTVAAEGGSAAVAQDHDSFEYHFHDTVAGGDWLCEQDVVDYFVHHCPTEMTQLELWGCPWSRRPDGSVNVRRFGGMKIERTWFAADKTGFHMLHTLFQTSLQFPQIQRFDEHFVLDILVDDGHVRGLVAMNMMEGTLVQIRANAVVMATGGAGRVYRYNTNGGIVTGDGMGMALSHGVPLRDMEFVQYHPTGLPGSGILMTEGCRGEGGILVNKNGYRYLQDYGMGPETPLGEPKNKYMELGPRDKVSQAFWHEWRKGNTISTPRGDVVYLDLRHLGEKKLHERLPFICELAKAYVGVDPVKEPIPVRPTAHYTMGGIETDQNCETRIKGLFAVGECSSVGLHGANRLGSNSLAELVVFGRLAGEQATERAATAGNGNEAAIEAQAAGVEQRLKDLVNQDGGENWAKIRDEMGLAMEEGCGIYRTPELMQKTIDKLAELQERFKRVRITDTSSVFNTDLLYTIELGHGLNVAECMAHSAMARKESRGAHQRLDEGCTERDDVNFLKHTLAFRDADGTTRLEYSDVKITTLPPAKRVYGGEADAADKAEAANKKEKANG,brenda,P00363,CC(C)=CCC/C(C)=C/Cc1c(C)c(O)c2ccccc2c1O.O=C(O)/C=C/C(=O)O>>CC(C)=CCC/C(C)=C/CC1=C(C)C(=O)c2ccccc2C1=O.O=C(O)CCC(=O)O,250.0,0.0,30.0,7.0,1.3.5.4,562.0,2.397940008672037,CC(C)=CCC/C(C)=C/Cc1c(C)c(O)c2ccccc2c1O.O=C(O)/C=C/C(=O)O,CC(C)=CCC/C(C)=C/CC1=C(C)C(=O)c2ccccc2C1=O.O=C(O)CCC(=O)O,2.397940008672037,CC(C)=CCC/C(C)=C/Cc1c(C)c(O)c2ccccc2c1O.O=C(O)/C=C/C(=O)O__MQTFQADLAIVGAGGAGLRAAIAAAQANPNAKIALISKVYPMRSHTVAAEGGSAAVAQDHDSFEYHFHDTVAGGDWLCEQDVVDYFVHHCPTEMTQLELWGCPWSRRPDGSVNVRRFGGMKIERTWFAADKTGFHMLHTLFQTSLQFPQIQRFDEHFVLDILVDDGHVRGLVAMNMMEGTLVQIRANAVVMATGGAGRVYRYNTNGGIVTGDGMGMALSHGVPLRDMEFVQYHPTGLPGSGILMTEGCRGEGGILVNKNGYRYLQDYGMGPETPLGEPKNKYMELGPRDKVSQAFWHEWRKGNTISTPRGDVVYLDLRHLGEKKLHERLPFICELAKAYVGVDPVKEPIPVRPTAHYTMGGIETDQNCETRIKGLFAVGECSSVGLHGANRLGSNSLAELVVFGRLAGEQATERAATAGNGNEAAIEAQAAGVEQRLKDLVNQDGGENWAKIRDEMGLAMEEGCGIYRTPELMQKTIDKLAELQERFKRVRITDTSSVFNTDLLYTIELGHGLNVAECMAHSAMARKESRGAHQRLDEGCTERDDVNFLKHTLAFRDADGTTRLEYSDVKITTLPPAKRVYGGEADAADKAEAANKKEKANG,./data/raw/alphafold//AF-P00363-F1-model_v4.pdb,3518,1420,2467,1723
+2018,7957,8085,MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,brenda,A0A077JBW9,CCOP(=O)(OCC)Oc1ccccc1F.O>>CCOP(=O)([O-])OCC.Oc1ccccc1F,21.0,0.1893306185927247,30.0,9.5,3.1.8.1,453246.0,1.3222192947339193,CCOP(=O)(OCC)Oc1ccccc1F.O,CCOP(=O)([O-])OCC.Oc1ccccc1F,1.3222192947339193,CCOP(=O)(OCC)Oc1ccccc1F.O__MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,./data/raw/alphafold//AF-A0A077JBW9-F1-model_v4.pdb,3110,1877,3509,2328
+2019,7616,7739,MKAARLHEYNKPLRIEDVDYPRLEGRFDVIVRIAGAGVCHTDLHLVQGMWHELLQPKLPYTLGHENVGYIEEVAEGVEGLEKGDPVILHPAVTDGTCLACRAGEDMHCENLEFPGLNIDGGFAEFMRTSHRSVIKLPKDISREKLVEMAPLADAGITAYRAVKKAARTLYPGAYVAIVGVGGLGHIAVQLLKVMTPATVIALDVKEEKLKLAERLGADHVVDARRDPVKQVMELTRGRGVNVAMDFVGSQATVDYTPYLLGRMGRLIIVGYGGELRFPTIRVISSEVSFEGSLVGNYVELHELVTLALQGKVRVEVDIHKLDEINDVLERLEKGEVLGRAVLIP,brenda,Q9Y9P9,CCCCO.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>>CCCC=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+],0.41,7.691302728842139e-15,60.0,8.0,1.1.1.1,56636.0,-0.3872161432802645,CCCCO.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,CCCC=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+],-0.3872161432802645,CCCCO.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__MKAARLHEYNKPLRIEDVDYPRLEGRFDVIVRIAGAGVCHTDLHLVQGMWHELLQPKLPYTLGHENVGYIEEVAEGVEGLEKGDPVILHPAVTDGTCLACRAGEDMHCENLEFPGLNIDGGFAEFMRTSHRSVIKLPKDISREKLVEMAPLADAGITAYRAVKKAARTLYPGAYVAIVGVGGLGHIAVQLLKVMTPATVIALDVKEEKLKLAERLGADHVVDARRDPVKQVMELTRGRGVNVAMDFVGSQATVDYTPYLLGRMGRLIIVGYGGELRFPTIRVISSEVSFEGSLVGNYVELHELVTLALQGKVRVEVDIHKLDEINDVLERLEKGEVLGRAVLIP,./data/raw/alphafold//AF-Q9Y9P9-F1-model_v4.pdb,1350,840,635,923
+2020,15481,15705,MASRLLLNNGAKMPILGLGTWKSPPGQVTEAVKVAIDVGYRHIDCAHVYQNENEVGVAIQEKLREQVVKREELFIVSKLWCTYHEKGLVKGACQKTLSDLKLDYLDLYLIHWPTGFKPGKEFFPLDESGNVVPSDTNILDTWAAMEELVDEGLVKAIGISNFNHLQVEMILNKPGLKYKPAVNQIECHPYLTQEKLIQYCQSKGIVVTAYSPLGSPDRPWAKPEDPSLLEDPRIKAIAAKHNKTTAQVLIRFPMQRNLVVIPKSVTPERIAENFKVFDFELSSQDMTTLLSYNRNWRVCALLSCTSHKDYPFHEEF,sabio,P15121,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=CCc1ccc(O)cc1.[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.OCCc1ccc(O)cc1,0.59,6.4369282231464086e-15,25.0,7.0,1.1.1.21,9606.0,-0.2291479883578558,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=CCc1ccc(O)cc1.[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.OCCc1ccc(O)cc1,-0.2291479883578558,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=CCc1ccc(O)cc1.[H]__MASRLLLNNGAKMPILGLGTWKSPPGQVTEAVKVAIDVGYRHIDCAHVYQNENEVGVAIQEKLREQVVKREELFIVSKLWCTYHEKGLVKGACQKTLSDLKLDYLDLYLIHWPTGFKPGKEFFPLDESGNVVPSDTNILDTWAAMEELVDEGLVKAIGISNFNHLQVEMILNKPGLKYKPAVNQIECHPYLTQEKLIQYCQSKGIVVTAYSPLGSPDRPWAKPEDPSLLEDPRIKAIAAKHNKTTAQVLIRFPMQRNLVVIPKSVTPERIAENFKVFDFELSSQDMTTLLSYNRNWRVCALLSCTSHKDYPFHEEF,./data/raw/alphafold//AF-P15121-F1-model_v4.pdb,1329,607,3631,676
+2021,20640,20947,MAKNVVLDHDGNLDDFVAMVLLASNTEKVRLIGALCTDADCFVENGFNVTGKIMCLMHNNMNLPLFPIGKSAATAVNPFPKEWRCLAKNMDDMPILNIPENVELWDKIKAENEKYEGQQLLADLVMNSEEKVTICVTGPLSNVAWCIDKYGEKFTSKVEECVIMGGAVDVRGNVFLPSTDGTAEWNIYWDPASAKTVFGCPGLRRIMFSLDSTNTVPVRSPYVQRFGEQTNFLLSILVGTMWAMCTHCELLRDGDGYYAWDALTAAYVVDQKVANVDPVPIDVVVDKQPNEGATVRTDAEKYPLTFVARNPEAEFFLDMLLRSARAC,brenda,Q9GPQ4,O.OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O>>OC[C@H]1OC(O)[C@H](O)[C@@H]1O.Oc1ncnc2[nH]cnc12,5.19,0.0,35.0,7.2,3.2.2.1,5699.0,0.7151673578484579,O.OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O,OC[C@H]1OC(O)[C@H](O)[C@@H]1O.Oc1ncnc2[nH]cnc12,0.7395723444500919,O.OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O__MAKNVVLDHDGNLDDFVAMVLLASNTEKVRLIGALCTDADCFVENGFNVTGKIMCLMHNNMNLPLFPIGKSAATAVNPFPKEWRCLAKNMDDMPILNIPENVELWDKIKAENEKYEGQQLLADLVMNSEEKVTICVTGPLSNVAWCIDKYGEKFTSKVEECVIMGGAVDVRGNVFLPSTDGTAEWNIYWDPASAKTVFGCPGLRRIMFSLDSTNTVPVRSPYVQRFGEQTNFLLSILVGTMWAMCTHCELLRDGDGYYAWDALTAAYVVDQKVANVDPVPIDVVVDKQPNEGATVRTDAEKYPLTFVARNPEAEFFLDMLLRSARAC,./data/raw/alphafold//AF-Q9GPQ4-F1-model_v4.pdb,1908,4043,1896,3724
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+2023,10824,10979,MASSASTTNHHAKMSLLNRRFVVVGLIVLLIFAVFSEAEASYGAYKVKVINEFPHDPEAYTQGLLYAENDTLFESTGLYGRSSVRKVALQNGKVETVHEMQASDFGEGLTLLGESLFQLTWLQDTGFIYDRYNFSKFKKFTHHMQDGWGLATDGKVIFGSDGTSTLYKIDPKTMKVIRKQVVKSQGHEVRYLNELEYVKDEVWSNVYGTDCIARISPKDGTVIGWILLQSLREDLKSRGYKYFEVLNGIAWDRDGDRIFVTGKLWPKIFEIKLLPLPPSAPLIGEINNLCTPKLNHSILEI,brenda,M1AKD0,C[C@H](N=C(O)[C@@H](N)CCC(=N)O)C(=O)O>>C[C@H](N=C(O)[C@H]1CCC(O)=N1)C(=O)O.N,37.7,0.0,30.0,8.0,2.3.2.5,4113.0,1.576341350205793,C[C@H](N=C(O)[C@@H](N)CCC(=N)O)C(=O)O,C[C@H](N=C(O)[C@H]1CCC(O)=N1)C(=O)O.N,1.576341350205793,C[C@H](N=C(O)[C@@H](N)CCC(=N)O)C(=O)O__MASSASTTNHHAKMSLLNRRFVVVGLIVLLIFAVFSEAEASYGAYKVKVINEFPHDPEAYTQGLLYAENDTLFESTGLYGRSSVRKVALQNGKVETVHEMQASDFGEGLTLLGESLFQLTWLQDTGFIYDRYNFSKFKKFTHHMQDGWGLATDGKVIFGSDGTSTLYKIDPKTMKVIRKQVVKSQGHEVRYLNELEYVKDEVWSNVYGTDCIARISPKDGTVIGWILLQSLREDLKSRGYKYFEVLNGIAWDRDGDRIFVTGKLWPKIFEIKLLPLPPSAPLIGEINNLCTPKLNHSILEI,./data/raw/alphafold//AF-M1AKD0-F1-model_v4.pdb,1595,1182,3183,1955
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+2039,12876,13048,MTDFSKDKEKLAQATQGGENERAEIVVVHLPQGTSFLTSLNPEGNLLEEPICPDELRRDHEGFQAVLKEKGCRVYMPYDVLSEASPAEREVLMDQAMASLKYELHATGARITPKMKYCVSDEYKRKVLSALSTRNLVDVILSEPVIHLAPGVRNTALVTNSVEIHDSNNMVFMRDQQITTRRGIVMGQFQAPQRRREQVLALIFWKRLGARVVGDCREGGPHCMLEGGDFVPVSPGLAMMGVGLRSTYVGAQYLMSKDLLGTRRFAVVKDCFDQHQDRMHLDCTFSVLHDKLVVLDDYICSGMGLRYVDEWIDVGADAVKKAKSSAVTCGNYVLAKANVEFQQWLSENGYTIVRIPHEYQLAYGCNNLNLGNNCVLSVHQPTVDFIKADPAYISYCKSNNLPNGLDLVYVPFRGITRMYGSLHCASQVVYRTPLAPAAVKACEQEGDGIAAIYEKNGEPVDAAGKKFDCVIYIPSSVDDLIDGLKINLRDDAAPSREIIADAYGLYQKLVSEGRVPYITWRMPSMPVVSLKGAAKAGSLKAVLDKIPQLTPFTPKAVEGAPAAYTRYLGLEQADICVDIK,brenda,Q27657,N=C(N)NCCC[C@H](N)C(=O)O.O>>N.N=C(O)NCCC[C@H](N)C(=O)O,2.6,0.0,25.0,7.5,3.5.3.6,5741.0,0.414973347970818,N=C(N)NCCC[C@H](N)C(=O)O.O,N.N=C(O)NCCC[C@H](N)C(=O)O,0.414973347970818,N=C(N)NCCC[C@H](N)C(=O)O.O__MTDFSKDKEKLAQATQGGENERAEIVVVHLPQGTSFLTSLNPEGNLLEEPICPDELRRDHEGFQAVLKEKGCRVYMPYDVLSEASPAEREVLMDQAMASLKYELHATGARITPKMKYCVSDEYKRKVLSALSTRNLVDVILSEPVIHLAPGVRNTALVTNSVEIHDSNNMVFMRDQQITTRRGIVMGQFQAPQRRREQVLALIFWKRLGARVVGDCREGGPHCMLEGGDFVPVSPGLAMMGVGLRSTYVGAQYLMSKDLLGTRRFAVVKDCFDQHQDRMHLDCTFSVLHDKLVVLDDYICSGMGLRYVDEWIDVGADAVKKAKSSAVTCGNYVLAKANVEFQQWLSENGYTIVRIPHEYQLAYGCNNLNLGNNCVLSVHQPTVDFIKADPAYISYCKSNNLPNGLDLVYVPFRGITRMYGSLHCASQVVYRTPLAPAAVKACEQEGDGIAAIYEKNGEPVDAAGKKFDCVIYIPSSVDDLIDGLKINLRDDAAPSREIIADAYGLYQKLVSEGRVPYITWRMPSMPVVSLKGAAKAGSLKAVLDKIPQLTPFTPKAVEGAPAAYTRYLGLEQADICVDIK,./data/raw/alphafold//AF-Q27657-F1-model_v4.pdb,3361,2228,3918,2792
+2040,2403,2437,MPKVAIIIYSMYGHIAKLAEAEKAGIEEAGGSATIYQIPETLPEEVLAKMHAPPKPEYPVITPEKLPEFDAFVFGIPTRYGNFPGQWKAFWDATGGLWAQGALAGKYASVFVSTGTPGGGQESTVLNSISTLTHHGIVFVPLGYSTTFAQLANLSEVRGGSPWGAGTFAGADGSRSPSALELELATAQGKYFWNIIKKVAF,brenda,Q9Y763,CC(C)(C)C1=CC(=O)C(C(C)(C)C)=CC1=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>>CC(C)(C)c1cc(O)c(C(C)(C)C)cc1O.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)c1,1400.0,0.0568359943254178,30.0,5.75,1.6.5.2,2822231.0,3.146128035678238,CC(C)(C)C1=CC(=O)C(C(C)(C)C)=CC1=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,CC(C)(C)c1cc(O)c(C(C)(C)C)cc1O.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)c1,3.146128035678238,CC(C)(C)C1=CC(=O)C(C(C)(C)C)=CC1=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__MPKVAIIIYSMYGHIAKLAEAEKAGIEEAGGSATIYQIPETLPEEVLAKMHAPPKPEYPVITPEKLPEFDAFVFGIPTRYGNFPGQWKAFWDATGGLWAQGALAGKYASVFVSTGTPGGGQESTVLNSISTLTHHGIVFVPLGYSTTFAQLANLSEVRGGSPWGAGTFAGADGSRSPSALELELATAQGKYFWNIIKKVAF,./data/raw/alphafold//AF-Q9Y763-F1-model_v4.pdb,2137,1178,1651,1377
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+2043,15801,16028,MLPKLVITHRVHDEILQLLAPHCELMTNQTDSTLTREEILRRCRDAQAMMAFMPDRVDADFLQACPELRVVGCALKGFDNFDVDACTARGVWLTFVPDLLTVPTAELAIGLAVGLGRHLRAADAFVRSGEFQGWQPQFYGTGLDNATVGILGMGAIGLAMADRLQGWGATLQYHEAKALDTQTEQRLGLRQVACSELFASSDFILLALPLNADTQHLVNAELLALVRPGALLVNPCRGSVVDEAAVLAALERGQLGGYAADVFEMEDWARADRPRLIDPALLAHPNTLFTPHIGSAVRAVRLEIERCAAQNIIQVLAGARPINAANRLPKAEPAAC,sabio,O69054,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.O=[PH](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.O=P(O)(O)O.[H],5076.0,0.0,25.0,7.25,1.20.1.1,316.0,3.7055216134226674,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.O=[PH](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.O=P(O)(O)O.[H],3.7055216134226674,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.O=[PH](O)O__MLPKLVITHRVHDEILQLLAPHCELMTNQTDSTLTREEILRRCRDAQAMMAFMPDRVDADFLQACPELRVVGCALKGFDNFDVDACTARGVWLTFVPDLLTVPTAELAIGLAVGLGRHLRAADAFVRSGEFQGWQPQFYGTGLDNATVGILGMGAIGLAMADRLQGWGATLQYHEAKALDTQTEQRLGLRQVACSELFASSDFILLALPLNADTQHLVNAELLALVRPGALLVNPCRGSVVDEAAVLAALERGQLGGYAADVFEMEDWARADRPRLIDPALLAHPNTLFTPHIGSAVRAVRLEIERCAAQNIIQVLAGARPINAANRLPKAEPAAC,./data/raw/alphafold//AF-O69054-F1-model_v4.pdb,2590,5058,2161,5033
+2044,7372,7494,MCLYALILVFLAAFTAGGHPSSLPVVDTLQGKVLGKYVSLEGFTQPVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTSYPPMCSQDPVAGQIVNDLLTNWEENISLQFSEDCLYLNIYTPADLTKRDRLPVMVWIHGGGLVLGGASTYDGLALSTHENVVVVVIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQDNIDNFGGDPGSVTIFGESAGGESVSVLVLSPLAKNLFHKAISESGVALTAGLVKKNTRPLAEKIAVVSGCKSTTSASMVHCLRQKTEEELLETTLKLNLFSLDLHGDSRQSYPFVPTVLDGVVLPKMPEEILAEKDFNTVPYIVGINKQEFGWILPTMMNYPPSDMKLDPMTATSLLKKSSFLLNLPEEAIPVAVEKYLRHTDDPDRNKDQLLELIGDVIFGVPSVIVSRGHRDAGARTYMYEFQYRPSFSSKMKPSTVVGDHGDEIYSVFGAPILRGGTSKEEINLSKMMMKFWANFARNGNPNGQGLPHWPEYDQKEGYLQIGATTQQAQKLKEKEVAFWSELLAMKPLHAGHTEL,brenda,Q63108,CCCCCCCCCCCCCCCC(=O)OC/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C.O>>CC1=C(/C=C/C(C)=C/C=C/C(C)=C/CO)C(C)(C)CCC1.CCCCCCCCCCCCCCCC(=O)O,0.0032,4.184362867912895e-14,37.0,8.0,3.1.1.1,10116.0,-2.494850021680094,CCCCCCCCCCCCCCCC(=O)OC/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C.O,CC1=C(/C=C/C(C)=C/C=C/C(C)=C/CO)C(C)(C)CCC1.CCCCCCCCCCCCCCCC(=O)O,-2.494850021680094,CCCCCCCCCCCCCCCC(=O)OC/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C.O__MCLYALILVFLAAFTAGGHPSSLPVVDTLQGKVLGKYVSLEGFTQPVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTSYPPMCSQDPVAGQIVNDLLTNWEENISLQFSEDCLYLNIYTPADLTKRDRLPVMVWIHGGGLVLGGASTYDGLALSTHENVVVVVIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQDNIDNFGGDPGSVTIFGESAGGESVSVLVLSPLAKNLFHKAISESGVALTAGLVKKNTRPLAEKIAVVSGCKSTTSASMVHCLRQKTEEELLETTLKLNLFSLDLHGDSRQSYPFVPTVLDGVVLPKMPEEILAEKDFNTVPYIVGINKQEFGWILPTMMNYPPSDMKLDPMTATSLLKKSSFLLNLPEEAIPVAVEKYLRHTDDPDRNKDQLLELIGDVIFGVPSVIVSRGHRDAGARTYMYEFQYRPSFSSKMKPSTVVGDHGDEIYSVFGAPILRGGTSKEEINLSKMMMKFWANFARNGNPNGQGLPHWPEYDQKEGYLQIGATTQQAQKLKEKEVAFWSELLAMKPLHAGHTEL,./data/raw/alphafold//AF-Q63108-F1-model_v4.pdb,1494,2159,3838,2703
+2045,6545,6658,MNTRSLVLPELLPLLGEIPTVDLSAESLPAFRAGLEQTAGQSFLQAEDYPVTLERLNIPGTENAPPIRLLTVRPRKEATGPRRALLHLHGGGYFAGQPELTTTQLCQFAQELDCVVISPDYRLTPEHPFPAAIEDAYTTLCWITRNADTLGIDPARIGLTGESAGGGLAAGLALLTRDREGPALLFQNLIYPVLDDRTITGQPDASPVGGEFLWTRASNTFMWTALLNPVAPGSADVSPYAAPARATDLSDLPPVYLCVGALDLFLDEDLAYARRLIHQGISVELEIVPGACHIFDQTDTPVATRSIARRIDAMKRGFGL,brenda,Q5FSJ2,CCCC(=O)Oc1ccc2ccccc2c1.O>>CCCC(=O)O.Oc1ccc2ccccc2c1,7.0,1.2209739465503342e-14,25.0,7.0,3.1.1.2,442.0,0.8450980400142568,CCCC(=O)Oc1ccc2ccccc2c1.O,CCCC(=O)O.Oc1ccc2ccccc2c1,1.214843848047698,CCCC(=O)Oc1ccc2ccccc2c1.O__MNTRSLVLPELLPLLGEIPTVDLSAESLPAFRAGLEQTAGQSFLQAEDYPVTLERLNIPGTENAPPIRLLTVRPRKEATGPRRALLHLHGGGYFAGQPELTTTQLCQFAQELDCVVISPDYRLTPEHPFPAAIEDAYTTLCWITRNADTLGIDPARIGLTGESAGGGLAAGLALLTRDREGPALLFQNLIYPVLDDRTITGQPDASPVGGEFLWTRASNTFMWTALLNPVAPGSADVSPYAAPARATDLSDLPPVYLCVGALDLFLDEDLAYARRLIHQGISVELEIVPGACHIFDQTDTPVATRSIARRIDAMKRGFGL,./data/raw/alphafold//AF-Q5FSJ2-F1-model_v4.pdb,1492,1040,866,1196
+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
+2047,2963,3005,MNHDEAWGADELDLDRYLRRVGLDAPVAADPDGLARLVAAHATTLPWENIDAVRGIPGELTIGALQRRMIDGRRGYGCTGHTPLLAAVLQRHGFVFSAVAGRVLLQGETSASTHALLVVQVDGARWLVEVGFGAVPLAPLRLVDGLEQDAGGWTYRVTRSTPGFAEEWQLDFFDPSSGQWRPQYRFPLAARTWSDLRMTNYYVATSPFSPFRGRLMVVMNHPDRRLVLTGDSIITTRPDGFREVAPYPAADRREILAEAFAIDLSDEVAAEVDRLVENRVSAS,brenda,D5UNC2,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.Nc1ccccc1O>>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)CC(O)=Nc1ccccc1O,9.7,0.0,30.0,7.8,2.3.1.5,2061.0,0.9867717342662448,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.Nc1ccccc1O,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)CC(O)=Nc1ccccc1O,0.9867717342662448,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.Nc1ccccc1O__MNHDEAWGADELDLDRYLRRVGLDAPVAADPDGLARLVAAHATTLPWENIDAVRGIPGELTIGALQRRMIDGRRGYGCTGHTPLLAAVLQRHGFVFSAVAGRVLLQGETSASTHALLVVQVDGARWLVEVGFGAVPLAPLRLVDGLEQDAGGWTYRVTRSTPGFAEEWQLDFFDPSSGQWRPQYRFPLAARTWSDLRMTNYYVATSPFSPFRGRLMVVMNHPDRRLVLTGDSIITTRPDGFREVAPYPAADRREILAEAFAIDLSDEVAAEVDRLVENRVSAS,./data/raw/alphafold//AF-D5UNC2-F1-model_v4.pdb,1689,1308,6229,1574
+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
+2049,22449,22785,MATRSPGVVISDDEPGYDLDLFCIPNHYAEDLERVFIPHGLIMDRTERLARDVMKEMGGHHIVALCVLKGGYKFFADLLDYIKALNRNSDRSIPMTVDFIRLKSYCNDQSTGDIKVIGGDDLSTLTGKNVLIVEDIIDTGKTMQTLLSLVRQYNPKMVKVASLLVKRTPRSVGYKPDFVGFEIPDKFVVGYALDYNEYFRDLNHVCVISETGKAKYKA,sabio,P00492,O=P(O)(O)OCC1OC(OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(OP(=O)(O)OP(=O)(O)O)C(O)C1O>>O=P(O)(O)OP(=O)(O)O.O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O,5.7,19.42554013378566,30.0,7.4,2.4.2.8,9606.0,0.7558748556724915,O=P(O)(O)OCC1OC(OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(OP(=O)(O)OP(=O)(O)O)C(O)C1O,O=P(O)(O)OP(=O)(O)O.O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O,0.7558748556724915,O=P(O)(O)OCC1OC(OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(OP(=O)(O)OP(=O)(O)O)C(O)C1O__MATRSPGVVISDDEPGYDLDLFCIPNHYAEDLERVFIPHGLIMDRTERLARDVMKEMGGHHIVALCVLKGGYKFFADLLDYIKALNRNSDRSIPMTVDFIRLKSYCNDQSTGDIKVIGGDDLSTLTGKNVLIVEDIIDTGKTMQTLLSLVRQYNPKMVKVASLLVKRTPRSVGYKPDFVGFEIPDKFVVGYALDYNEYFRDLNHVCVISETGKAKYKA,./data/raw/alphafold//AF-P00492-F1-model_v4.pdb,2463,4884,4954,4808
+2050,6979,7095,MLFPISMSATEFLLASVIFCLVFWVIRASRPQVPKGLKNPPGPWGWPLIGHMLTLGKNPHLALSRMSQQYGDVLQIRIGSTPVVVLSGLDTIRQALVRQGDDFKGRPDLYTFTLISNGQSMSFSPDSGPVWAARRRLAQNGLKSFSIASDPASSTSCYLEEHVSKEAEVLISTLQELMAGPGHFNPYRYVVVSVTNVICAICFGRRYDHNHQELLSLVNLNNNFGEVVGSGNPADFIPILRYLPNPSLNAFKDLNEKFYSFMQKMVKEHYKTFEKGHIRDITDSLIEHCQEKQLDENANVQLSDEKIINIVLDLFGAGFDTVTTAISWSLMYLVMNPRVQRKIQEELDTVIGRSRRPRLSDRSHLPYMEAFILETFRHSSFVPFTIPHSTTRDTSLKGFYIPKGRCVFVNQWQINHDQKLWVNPSEFLPERFLTPDGAIDKVLSEKVIIFGMGKRKCIGETIARWEVFLFLAILLQRVEFSVPLGVKVDMTPIYGLTMKHACCEHFQMQLRS,sabio,P04798,CCCCCC=CCC=CCC=CCC=CCCCC(=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.O=O.[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.O,696.0,17.357232184590348,37.0,7.5,1.14.14.1,9606.0,2.842609239610562,CCCCCC=CCC=CCC=CCC=CCCCC(=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.O=O.[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.O,2.842609239610562,CCCCCC=CCC=CCC=CCC=CCCCC(=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.O=O.[H]__MLFPISMSATEFLLASVIFCLVFWVIRASRPQVPKGLKNPPGPWGWPLIGHMLTLGKNPHLALSRMSQQYGDVLQIRIGSTPVVVLSGLDTIRQALVRQGDDFKGRPDLYTFTLISNGQSMSFSPDSGPVWAARRRLAQNGLKSFSIASDPASSTSCYLEEHVSKEAEVLISTLQELMAGPGHFNPYRYVVVSVTNVICAICFGRRYDHNHQELLSLVNLNNNFGEVVGSGNPADFIPILRYLPNPSLNAFKDLNEKFYSFMQKMVKEHYKTFEKGHIRDITDSLIEHCQEKQLDENANVQLSDEKIINIVLDLFGAGFDTVTTAISWSLMYLVMNPRVQRKIQEELDTVIGRSRRPRLSDRSHLPYMEAFILETFRHSSFVPFTIPHSTTRDTSLKGFYIPKGRCVFVNQWQINHDQKLWVNPSEFLPERFLTPDGAIDKVLSEKVIIFGMGKRKCIGETIARWEVFLFLAILLQRVEFSVPLGVKVDMTPIYGLTMKHACCEHFQMQLRS,./data/raw/alphafold//AF-P04798-F1-model_v4.pdb,3282,2116,3785,2645
+2051,23180,23523,VPGGLXPPPEYVGPKLVNDADHPWEPLRPGDIRGPCPGLNTLASHGYLPRNGVATPAQIINAIVEGFNFNYEGAVFVTYFAHIVDGNLVTDLLSIGGKTNLTGEDTGAPAIIGGLNTHSVFEGDASMTRDDFHFGDNHSFNQTLFDQFVEYSNTYGGGFYNQEVAGHLRRRRIEQSIATNPEFDFTSPRFFTAFAESSFPYSFFVDGRITERPGGLSMENATLFFRDHKMPDDFWRNVNGEMTFTGTPDPNSAPSNLALGH,sabio,B9W4V8,OO.c1ccc2ccccc2c1>>O.Oc1cccc2ccccc12,15.0,8.735035598939078e-15,,7.0,1.11.2.1,71721.0,1.1760912590556811,OO.c1ccc2ccccc2c1,O.Oc1cccc2ccccc12,1.1760912590556811,OO.c1ccc2ccccc2c1__VPGGLXPPPEYVGPKLVNDADHPWEPLRPGDIRGPCPGLNTLASHGYLPRNGVATPAQIINAIVEGFNFNYEGAVFVTYFAHIVDGNLVTDLLSIGGKTNLTGEDTGAPAIIGGLNTHSVFEGDASMTRDDFHFGDNHSFNQTLFDQFVEYSNTYGGGFYNQEVAGHLRRRRIEQSIATNPEFDFTSPRFFTAFAESSFPYSFFVDGRITERPGGLSMENATLFFRDHKMPDDFWRNVNGEMTFTGTPDPNSAPSNLALGH,./data/raw/esmfold//ESMFold-B9W4V8-v1.pdb,3422,2317,1028,2925
+2052,6568,6681,MMTFRDEDFLPVEVPVGVSNRHIHLCRQDLDTLFGPGYELTVYRQLSQPGEYAARETVTIVGPRGVLEGVRVLGPVRSYSQVEIAMTDGFRLGLKPPVRESGDLEGTPGIAVVGPSGALTLHRGVILAARHIHMEAERAASLNLHDDQRVQVLVPGMRGMIFNNVIVRVSPNFRLELHLDTDEANAALLANGDKVKILRP,brenda,Q2RK58,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.O=P(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.CCCC(=O)OP(=O)(O)O,0.12,6.072197424364671e-15,55.0,7.6,2.3.1.222,1525.0,-0.9208187539523752,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.O=P(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.CCCC(=O)OP(=O)(O)O,-0.9208187539523752,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.O=P(O)(O)O__MMTFRDEDFLPVEVPVGVSNRHIHLCRQDLDTLFGPGYELTVYRQLSQPGEYAARETVTIVGPRGVLEGVRVLGPVRSYSQVEIAMTDGFRLGLKPPVRESGDLEGTPGIAVVGPSGALTLHRGVILAARHIHMEAERAASLNLHDDQRVQVLVPGMRGMIFNNVIVRVSPNFRLELHLDTDEANAALLANGDKVKILRP,./data/raw/alphafold//AF-Q2RK58-F1-model_v4.pdb,3215,2028,3676,2526
+2053,13723,13903,MTEAMKITLSTQPADARWGDKATYSINNDGITLHLNGKDDLGLIQRAARKIDGLGIKQVALTGEGWDTERCWAFWAGYKGPKGVRTVMWPDLDDAQRQELDNRLTIIDWVRDTINAPAEELGPEQLAQRAVDLLCSVACDSVTYRITKGEDLREQNYMGLHTVGRGSERPPVLLALDYNPTGDKDAPVYACLVGKGITFDSGGYSIKQSAFMDSMKSDMGGAATVTGALAFAITRGLNKRVKLFLCCADNLISGNAFKLGDIIRYRNGKNVEVMNTDAEGRLVLADGLIDASAQHPQLIIDMATLTGAAKTALGNDYHALFSFDDTLAGRLLTSAAQENEPFWRLPLAEFHRNQLPSNFAELNNTGSAAYPAGASTAAGFLSHFVENYREGWLHIDCSATYRKAPVEQWAAGATGLGVRTIANLLTA,brenda,Q9RF52,N=C(O)CC[C@H](N=C(O)[C@@H](N)CC(=O)O)C(=O)O.O>>N=C(O)CC[C@H](N)C(=O)O.N[C@@H](CC(=O)O)C(=O)O,761.0,1.0159717972326628e-14,37.0,8.5,3.4.11.1,28901.0,2.8813846567705728,N=C(O)CC[C@H](N=C(O)[C@@H](N)CC(=O)O)C(=O)O.O,N=C(O)CC[C@H](N)C(=O)O.N[C@@H](CC(=O)O)C(=O)O,2.8813846567705728,N=C(O)CC[C@H](N=C(O)[C@@H](N)CC(=O)O)C(=O)O.O__MTEAMKITLSTQPADARWGDKATYSINNDGITLHLNGKDDLGLIQRAARKIDGLGIKQVALTGEGWDTERCWAFWAGYKGPKGVRTVMWPDLDDAQRQELDNRLTIIDWVRDTINAPAEELGPEQLAQRAVDLLCSVACDSVTYRITKGEDLREQNYMGLHTVGRGSERPPVLLALDYNPTGDKDAPVYACLVGKGITFDSGGYSIKQSAFMDSMKSDMGGAATVTGALAFAITRGLNKRVKLFLCCADNLISGNAFKLGDIIRYRNGKNVEVMNTDAEGRLVLADGLIDASAQHPQLIIDMATLTGAAKTALGNDYHALFSFDDTLAGRLLTSAAQENEPFWRLPLAEFHRNQLPSNFAELNNTGSAAYPAGASTAAGFLSHFVENYREGWLHIDCSATYRKAPVEQWAAGATGLGVRTIANLLTA,./data/raw/alphafold//AF-Q9RF52-F1-model_v4.pdb,1856,1550,3133,1900
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+2058,310,322,MVSAHFILIHTICHGAWLWYKLIPLLQSAGHNATAIDLVASGIDPRQLEQIGTWEQYSEPLFTLIESIPEGKKVILVGESGGGINIALAAEKYPEKVSALVFHNALMPDIDHSPAFVYKKFSEVFTDWKDSIFSNYTYGNDTVTAVELGDRTLAENIFSNSPIEDVELAKHLVRKGSFFEQDLDTLPNFTSEGYGSIRRVYVYGEEDQIFSRDFQLWQINNYKPDKVYCVPSADHKIQISKVNELAQILQEVANSASDLLAVA,brenda,D1MX73,C#N.O=Cc1cccs1>>N#C[C@H](O)c1cccs1,31.5,0.0,22.0,4.2,4.1.2.47,316758.0,1.4983105537896004,C#N.O=Cc1cccs1,N#C[C@H](O)c1cccs1,1.4983105537896004,C#N.O=Cc1cccs1__MVSAHFILIHTICHGAWLWYKLIPLLQSAGHNATAIDLVASGIDPRQLEQIGTWEQYSEPLFTLIESIPEGKKVILVGESGGGINIALAAEKYPEKVSALVFHNALMPDIDHSPAFVYKKFSEVFTDWKDSIFSNYTYGNDTVTAVELGDRTLAENIFSNSPIEDVELAKHLVRKGSFFEQDLDTLPNFTSEGYGSIRRVYVYGEEDQIFSRDFQLWQINNYKPDKVYCVPSADHKIQISKVNELAQILQEVANSASDLLAVA,./data/raw/alphafold//AF-D1MX73-F1-model_v4.pdb,1488,546,202,219
+2059,16261,16488,MLTVFSFCSYCVIRLPVCNRRKTAARGANPDPNSQPQLPRYRNGHPFSSVAVLISSLWRPNTLYPTPATDKRIPTHTYTHTHMQISIFLSLSLFSLVRSTIIHQESHVQLTPCPAHDGDTRRRISMSTSSDYGTGAPPASAVAAVADLCHIPVHHTQAPSKQADPPAPIKEEPAGPEEVVDSITPATEGELNYGSYLQLDRLLSSQTLQSRGPDGNPVHDEHLFIVIHQAYELWFKQILFELDSVLDVFKAGFVDEAKMRLLAARLQRINVIMNLLVDQISVLDTMTPRDFFSFRSFLGTASGFQSVQFRILENKIGVKKSLRIRYHSDDYKAALSGPDLKAVQDSEEQPSLFAMIESWLARTPGLKDGDFDFWTQFQANLHESWRAAWQRIEAEPNAHLQESMRAAQKETEAQFERIFDEDVHANELLKGNRRFSYPAFKALFFISFYRDFPRFHLAYDVLNQLEVLDKHLQKWRLNHVNLVQRMLGTKAGSGGSSGYHYLRSTLSDRYKVFLDLYNLSTYLVDDDCIPALPPHVKKLLNVPPES,sabio,A9V766,NC(CC(=O)c1ccccc1NC=O)C(=O)O.O=O>>NC(CC(=O)c1ccccc1NC=O)C(=O)O,30648.0,6.330571448920964,37.0,8.0,1.13.11.11,81824.0,4.486402138975022,NC(CC(=O)c1ccccc1NC=O)C(=O)O.O=O,NC(CC(=O)c1ccccc1NC=O)C(=O)O,4.486402138975022,NC(CC(=O)c1ccccc1NC=O)C(=O)O.O=O__MLTVFSFCSYCVIRLPVCNRRKTAARGANPDPNSQPQLPRYRNGHPFSSVAVLISSLWRPNTLYPTPATDKRIPTHTYTHTHMQISIFLSLSLFSLVRSTIIHQESHVQLTPCPAHDGDTRRRISMSTSSDYGTGAPPASAVAAVADLCHIPVHHTQAPSKQADPPAPIKEEPAGPEEVVDSITPATEGELNYGSYLQLDRLLSSQTLQSRGPDGNPVHDEHLFIVIHQAYELWFKQILFELDSVLDVFKAGFVDEAKMRLLAARLQRINVIMNLLVDQISVLDTMTPRDFFSFRSFLGTASGFQSVQFRILENKIGVKKSLRIRYHSDDYKAALSGPDLKAVQDSEEQPSLFAMIESWLARTPGLKDGDFDFWTQFQANLHESWRAAWQRIEAEPNAHLQESMRAAQKETEAQFERIFDEDVHANELLKGNRRFSYPAFKALFFISFYRDFPRFHLAYDVLNQLEVLDKHLQKWRLNHVNLVQRMLGTKAGSGGSSGYHYLRSTLSDRYKVFLDLYNLSTYLVDDDCIPALPPHVKKLLNVPPES,./data/raw/alphafold//AF-A9V766-F1-model_v4.pdb,2631,5119,2245,5129
+2060,13190,13365,MDPKHQRAALNDGHSIPVLGLGTYAPDAVPKSEAGEATKIAIDVGYRHIDSSHAYQNEEEVGLAIRSKIADGTVKREDVFYTSKLWCTFFRPELVRTGLEQSLKKLQLDYVDLYLMHFPVAMKPGKELYPKDEQGKIILDIVDICATWEAMEKCRDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSIDVVLVAYGALGSSRDPKWVDQSYPVLLEDPVICALAKKHKRSPALIALRYQLQRGVVVLAKSFIEKEIKENIQVFEFQLSSEDMKALDGLNKNLRYYPADIFIGYPNYPFSDEY,brenda,J7MBS9,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.O=C1Nc2ccccc2C1=O.[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)c1,0.183,10.08427849427832,25.0,7.4,1.1.1.239,9986.0,-0.7375489102695706,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.O=C1Nc2ccccc2C1=O.[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,-0.7375489102695706,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.O=C1Nc2ccccc2C1=O.[H+]__MDPKHQRAALNDGHSIPVLGLGTYAPDAVPKSEAGEATKIAIDVGYRHIDSSHAYQNEEEVGLAIRSKIADGTVKREDVFYTSKLWCTFFRPELVRTGLEQSLKKLQLDYVDLYLMHFPVAMKPGKELYPKDEQGKIILDIVDICATWEAMEKCRDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSIDVVLVAYGALGSSRDPKWVDQSYPVLLEDPVICALAKKHKRSPALIALRYQLQRGVVVLAKSFIEKEIKENIQVFEFQLSSEDMKALDGLNKNLRYYPADIFIGYPNYPFSDEY,./data/raw/alphafold//AF-J7MBS9-F1-model_v4.pdb,1329,1150,6188,840
+2061,2542,2577,MQTVHEMLRRAVSRVPHRWAIVDAARSTFDICRTGETSRNEGSATARLWPQPARPLAVVSGNSVEAVIAVLALHRLQAVPALMNPRLKPAEISELVARGEMARAVVANDAGVMEAIRTRVPSVCVLALDDLVSGSRVPEVAGKSLPPPPCEPEQAGFVFYTSGTTGLPKGAVIPQRAAESRVLFMATQAGLRHGSHNVVLGLMPLYHTIGFFAVLVAAMAFDGTYVVVEEFDAGNVLKLIERERVTAMFATPTHLDALTTAVEQAGARLESLEHVTFAGATMPDTVLERVNRFIPGEKVNIYGTTEAMNSLYMRAVRIAGTVMRPGFFSEVRIVRVGGDVDDGCPTVKRASWRWRRRMRPFQATLTNLRLLQKSFRKAGTGRAICVRDGSGNIVVLGRVDDMIISGGENIHPSEVERILAAAPGVAEVVVIGVKDERWGQSVVACVVLQPGASASAERLDAFCRASALADFKRPRRYVFLDELPKSAMNKVLRRQLMQHVSATSSAAVVPAPAVKQRTYAPSGRAIAR,sabio,A5JTM6,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.O=C([O-])c1ccc(I)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@@H](O)C([O-])=NCCC([O-])=NCCSC(=O)c1ccc(I)cc1.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,14.0,0.0994264566436318,25.0,7.5,6.2.1.33,306.0,1.146128035678238,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.O=C([O-])c1ccc(I)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@@H](O)C([O-])=NCCC([O-])=NCCSC(=O)c1ccc(I)cc1.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,1.146128035678238,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.O=C([O-])c1ccc(I)cc1__MQTVHEMLRRAVSRVPHRWAIVDAARSTFDICRTGETSRNEGSATARLWPQPARPLAVVSGNSVEAVIAVLALHRLQAVPALMNPRLKPAEISELVARGEMARAVVANDAGVMEAIRTRVPSVCVLALDDLVSGSRVPEVAGKSLPPPPCEPEQAGFVFYTSGTTGLPKGAVIPQRAAESRVLFMATQAGLRHGSHNVVLGLMPLYHTIGFFAVLVAAMAFDGTYVVVEEFDAGNVLKLIERERVTAMFATPTHLDALTTAVEQAGARLESLEHVTFAGATMPDTVLERVNRFIPGEKVNIYGTTEAMNSLYMRAVRIAGTVMRPGFFSEVRIVRVGGDVDDGCPTVKRASWRWRRRMRPFQATLTNLRLLQKSFRKAGTGRAICVRDGSGNIVVLGRVDDMIISGGENIHPSEVERILAAAPGVAEVVVIGVKDERWGQSVVACVVLQPGASASAERLDAFCRASALADFKRPRRYVFLDELPKSAMNKVLRRQLMQHVSATSSAAVVPAPAVKQRTYAPSGRAIAR,./data/raw/alphafold//AF-A5JTM6-F1-model_v4.pdb,1629,1229,1706,1435
+2062,3241,3284,MESCLSFSSPPPTKKNIQEPVRPNAKFHKSVWGNHFLKYASNPEQIDYDADEQHEQLKEELRKKLVVNVTNERVEEQLKLIDAIQRLGVAYHFQREIDAVLNNLLLFRSNKDSDDIYMVSLRFRLLRQQGHNVSCSVFEKFKNIDGRFKDSLRDDVRGLLSLYEATHMRVHKEDILEEALEFTIYELEQVVKLSSNDTLLASEVIHALNMPIRKGLTRIEARHFISVYQHDKSHDETLLKFSKIDFNMLQKLHQRELADLTIWWEKLNVAEKMPYARDRFVECYFWGLGVYFEPQYSRARKMFVKVINLTSLIDDTYDSYGTFDELDLFTDAVKRWNVNETDKLPEYMRPLFMELLNVYNAMEEELKEEGVSYRVEYAKQSMIQIVTAYNDEAIWYHNGYVPTFDEYLKVALISCGYMLLSTISFVGMGVTTVTKPAFDWVTNNPLILIASCTINRLADDKVGHELEQERGHVASGVECYMKHNNATKQEVVIEFNKRISNAWKDINQECLHPLPVPLHLVVRPLYLACFMNVFYKDEDWYTHSNTQMKECINSLLVESVPY,uniprot_search,J9R5V4,CC(C)=CCC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O>>CC(C)=C[C@@H]1CC[C@@H](C)[C@H]2CCC(C)=C12.O=P(O)(O)OP(=O)(O)O,0.01,0.0,30.0,7.5,4.2.3.139,19953.0,-2.0,CC(C)=CCC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O,CC(C)=C[C@@H]1CC[C@@H](C)[C@H]2CCC(C)=C12.O=P(O)(O)OP(=O)(O)O,-2.0,CC(C)=CCC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O__MESCLSFSSPPPTKKNIQEPVRPNAKFHKSVWGNHFLKYASNPEQIDYDADEQHEQLKEELRKKLVVNVTNERVEEQLKLIDAIQRLGVAYHFQREIDAVLNNLLLFRSNKDSDDIYMVSLRFRLLRQQGHNVSCSVFEKFKNIDGRFKDSLRDDVRGLLSLYEATHMRVHKEDILEEALEFTIYELEQVVKLSSNDTLLASEVIHALNMPIRKGLTRIEARHFISVYQHDKSHDETLLKFSKIDFNMLQKLHQRELADLTIWWEKLNVAEKMPYARDRFVECYFWGLGVYFEPQYSRARKMFVKVINLTSLIDDTYDSYGTFDELDLFTDAVKRWNVNETDKLPEYMRPLFMELLNVYNAMEEELKEEGVSYRVEYAKQSMIQIVTAYNDEAIWYHNGYVPTFDEYLKVALISCGYMLLSTISFVGMGVTTVTKPAFDWVTNNPLILIASCTINRLADDKVGHELEQERGHVASGVECYMKHNNATKQEVVIEFNKRISNAWKDINQECLHPLPVPLHLVVRPLYLACFMNVFYKDEDWYTHSNTQMKECINSLLVESVPY,./data/raw/alphafold//AF-J9R5V4-F1-model_v4.pdb,1734,1381,2420,1671
+2063,21321,21645,MGSQQEHIVMLPFMAQGHIIPFLALAKQIQQRTGFTITIANTPLNIQYLRTTISTSDDSSRPCIRLAELPFCSSDHGLPPNTENTEALSFHQIVDLFHASKTLQAPFHSLVSGIIEKEGRPPLCIISDVFFGWATEVAKSLGTSNVTFTTGGGYGTAAYISLWQNLPHRATDSDYFALPGFPDSCRFHITQLHQYLRAADGTDAWSRYFQPQIALSLDSSGWLCNTAEEIEPHGLEILRNYVKPPVWTIGPLLPPALLNHSLSSGSSIFGQRAWKVSGVSPEKCLDWLDKHPQSSVLYISFGSQNTISPSQMMELALGLEDSGKPFIWVIRPPVGFDIEGEFRAEWLPQNFEQRMAESNQGLIVHKWAPQLEILSHKSTGVFLSHCGWNSVMESLCVGVPIIGWPLAAEQCYNSKMLTEDMGVAVELTRGRQGALERKEVKRVIELVMDSKGKGEEMKKKATEIGEKIRDAMREGGSSLKAMDDFVSTMLSKRQGY,sabio,F6I4A7,O=C(O)C=Cc1ccc(O)c(O)c1.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1>>O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,1.19,29.723294622714743,30.0,8.0,2.4.1.-,29760.0,0.0755469613925307,O=C(O)C=Cc1ccc(O)c(O)c1.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,0.0755469613925307,O=C(O)C=Cc1ccc(O)c(O)c1.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1__MGSQQEHIVMLPFMAQGHIIPFLALAKQIQQRTGFTITIANTPLNIQYLRTTISTSDDSSRPCIRLAELPFCSSDHGLPPNTENTEALSFHQIVDLFHASKTLQAPFHSLVSGIIEKEGRPPLCIISDVFFGWATEVAKSLGTSNVTFTTGGGYGTAAYISLWQNLPHRATDSDYFALPGFPDSCRFHITQLHQYLRAADGTDAWSRYFQPQIALSLDSSGWLCNTAEEIEPHGLEILRNYVKPPVWTIGPLLPPALLNHSLSSGSSIFGQRAWKVSGVSPEKCLDWLDKHPQSSVLYISFGSQNTISPSQMMELALGLEDSGKPFIWVIRPPVGFDIEGEFRAEWLPQNFEQRMAESNQGLIVHKWAPQLEILSHKSTGVFLSHCGWNSVMESLCVGVPIIGWPLAAEQCYNSKMLTEDMGVAVELTRGRQGALERKEVKRVIELVMDSKGKGEEMKKKATEIGEKIRDAMREGGSSLKAMDDFVSTMLSKRQGY,./data/raw/alphafold//AF-F6I4A7-F1-model_v4.pdb,1243,3059,596,683
+2064,19906,20192,MKFPKNFMFGYSWSGFQFEMGLPGSEVESDWWVWVHDKENIASGLVSGDLPENGPAYWHLYKQDHDIAEKLGMDCIRGGIEWARIFPKPTFDVKVDVEKDEEGNIISVDVPESTIKELEKIANMEALEHYRKIYSDWKERGKTFILNLYHWPLPLWIHDPIAVRKLGPDRAPAGWLDEKTVVEFVKFAAFVAYHLDDLVDMWSTMNEPNVVYNQGYINLRSGFPPGYLSFEAAEKAKFNLIQAHIGAYDAIKEYSEKSVGVIYAFAWHDPLAEEYKDEVEEIRKKDYEFVTILHSKGKLDWIGVNYYSRLVYGAKDGHLVPLPGYGFMSERGGFAKSGRPASDFGWEMYPEGLENLLKYLNNAYELPMIITENGMADAADRYRPHYLVSHLKAVYNAMKEGADVRGYLHWSLTDNYEWAQGFRMRFGLVYVDFETKKRYLRPSALVFREIATQKEIPEELAHLADLKFVTRK,brenda,Q51723,O.O=[N+](O[C@@H]1[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]1COP(=O)(O)O)c1ccccc1>>,49.0,99.74043098838688,96.25,5.5,3.2.1.21,2261.0,1.6901960800285136,O.O=[N+](O[C@@H]1[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]1COP(=O)(O)O)c1ccccc1,,1.6901960800285136,O.O=[N+](O[C@@H]1[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]1COP(=O)(O)O)c1ccccc1__MKFPKNFMFGYSWSGFQFEMGLPGSEVESDWWVWVHDKENIASGLVSGDLPENGPAYWHLYKQDHDIAEKLGMDCIRGGIEWARIFPKPTFDVKVDVEKDEEGNIISVDVPESTIKELEKIANMEALEHYRKIYSDWKERGKTFILNLYHWPLPLWIHDPIAVRKLGPDRAPAGWLDEKTVVEFVKFAAFVAYHLDDLVDMWSTMNEPNVVYNQGYINLRSGFPPGYLSFEAAEKAKFNLIQAHIGAYDAIKEYSEKSVGVIYAFAWHDPLAEEYKDEVEEIRKKDYEFVTILHSKGKLDWIGVNYYSRLVYGAKDGHLVPLPGYGFMSERGGFAKSGRPASDFGWEMYPEGLENLLKYLNNAYELPMIITENGMADAADRYRPHYLVSHLKAVYNAMKEGADVRGYLHWSLTDNYEWAQGFRMRFGLVYVDFETKKRYLRPSALVFREIATQKEIPEELAHLADLKFVTRK,./data/raw/alphafold//AF-Q51723-F1-model_v4.pdb,193,2706,5016,5866
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+2068,14342,14541,MKSYQGLADKWIKGSGEEYLDINPADKDHVLAKIRLYTKDDVKEAINKAVAKFDEWSRTPAPKRGSILLKAGELMEQEAQEFALLMTLEEGKTLKDSMFEVTRSYNLLKFYGALAFKISGKTLPSADPNTRIFTVKEPLGVVALITPWNFPLSIPVWKLAPALAAGNTAVIKPATKTPLMVAKLVEVLSKAGLPEGVVNLVVGKGSEVGDTIVSDDNIAAVSFTGSTEVGKRIYKLVGNKNRMTRIQLELGGKNALYVDKSADLTLAAELAVRGGFGLTGQSCTATSRLIINKDVYTQFKQRLLERVKKWRVGPGTEDVDMGPVVDEGQFKKDLEYIEYGKNVGAKLIYGGNIIPGKGYFLEPTIFEGVTSDMRLFKEEIFGPVLSVTEAKDLDEAIRLVNAVDYGHTAGIVASDIKAINEFVSRVEAGVIKVNKPTVGLELQAPFGGFKNSGATTWKEMGEDALEFYLKEKTVYEGW,brenda,Q97UA1,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=CCO>>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)CO.[H+],5.3,6.906989547890116e-15,70.0,7.5,1.2.1.26,2287.0,0.724275869600789,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=CCO,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)CO.[H+],0.724275869600789,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=CCO__MKSYQGLADKWIKGSGEEYLDINPADKDHVLAKIRLYTKDDVKEAINKAVAKFDEWSRTPAPKRGSILLKAGELMEQEAQEFALLMTLEEGKTLKDSMFEVTRSYNLLKFYGALAFKISGKTLPSADPNTRIFTVKEPLGVVALITPWNFPLSIPVWKLAPALAAGNTAVIKPATKTPLMVAKLVEVLSKAGLPEGVVNLVVGKGSEVGDTIVSDDNIAAVSFTGSTEVGKRIYKLVGNKNRMTRIQLELGGKNALYVDKSADLTLAAELAVRGGFGLTGQSCTATSRLIINKDVYTQFKQRLLERVKKWRVGPGTEDVDMGPVVDEGQFKKDLEYIEYGKNVGAKLIYGGNIIPGKGYFLEPTIFEGVTSDMRLFKEEIFGPVLSVTEAKDLDEAIRLVNAVDYGHTAGIVASDIKAINEFVSRVEAGVIKVNKPTVGLELQAPFGGFKNSGATTWKEMGEDALEFYLKEKTVYEGW,./data/raw/alphafold//AF-Q97UA1-F1-model_v4.pdb,2370,4743,4792,4632
+2069,11440,11597,MKNFSIAKSRRLRSTPYTSRIEKQGVTAYTIYNHMLLPAAFGSIEDSYKHLKEHVQIWDVAAERQVEISGKDSAELVQLMTCRDLSKSKIGRCYYCPIIDENGNLVNDPVVLKLDENKWWISIADSDVIFFAKGLASGHKFDVKIVEPVVDIMAIQGPKSFALMEKVFGKKITELKFFGFDYFDFEGTKHLIARSGWSKQGGYEVYVENTQSGQKLYDHLFEVGKEFNVGPGCPNLIERIESALLSYGNDFDNNDNPFECGFDQYVSLDSDINFLGKEKLKEIKLKGPQKKLRGVKIDIKEISLTGSKNIYDENNNVIGELRSACYSPHFQKVIGIAMIKKSHWEASQGFKIQINDNTINGNVCDLPFI,brenda,Q4FP21,C[S+](C)CCC(=O)O.N=c1nc(O)c2c([nH]1)NC[C@H](CNc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1)N2>>CN1c2c(O)nc(=N)[nH]c2NC[C@@H]1CNc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1.CSCCC(=O)O,8.1,0.0868007715624073,30.0,7.5,2.1.1.269,198252.0,0.9084850188786496,C[S+](C)CCC(=O)O.N=c1nc(O)c2c([nH]1)NC[C@H](CNc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1)N2,CN1c2c(O)nc(=N)[nH]c2NC[C@@H]1CNc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1.CSCCC(=O)O,0.9084850188786496,C[S+](C)CCC(=O)O.N=c1nc(O)c2c([nH]1)NC[C@H](CNc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1)N2__MKNFSIAKSRRLRSTPYTSRIEKQGVTAYTIYNHMLLPAAFGSIEDSYKHLKEHVQIWDVAAERQVEISGKDSAELVQLMTCRDLSKSKIGRCYYCPIIDENGNLVNDPVVLKLDENKWWISIADSDVIFFAKGLASGHKFDVKIVEPVVDIMAIQGPKSFALMEKVFGKKITELKFFGFDYFDFEGTKHLIARSGWSKQGGYEVYVENTQSGQKLYDHLFEVGKEFNVGPGCPNLIERIESALLSYGNDFDNNDNPFECGFDQYVSLDSDINFLGKEKLKEIKLKGPQKKLRGVKIDIKEISLTGSKNIYDENNNVIGELRSACYSPHFQKVIGIAMIKKSHWEASQGFKIQINDNTINGNVCDLPFI,./data/raw/alphafold//AF-Q4FP21-F1-model_v4.pdb,3845,3968,1812,3626
+2070,9058,9200,MRSSSRFLGALAAAASFVPSALAQNSVPVTFTDPSTGIVFNSWGLPNGSAETQGGYTFGVALPSNALTTDATEFIGYLQCASTDGKGWCGVSLGGPMTNSLLIAAWPYGDNIYTSFRYATGYAMPDVYTGNATLTQISSTINSTSFTLIFRCQNCLSWNQDGSSGGASTSSGALILGWCQAFPSPGNPTCPDQITIEQHDNGQGIWGAQLDSNAANPSYTAWAAKATKTVPAQCSGPTSTGVVGVPVPTGATYDYIVVGAGAGGIPIADKLSEAGKSVLLIEKGFASTGQNGGTLGPDWLAGTGLTRFDVPGLCNEIWVDSKGIACDDTDQMAGCVLGGGTAVNAGLWFHPYSLDFDYLFPTGWKSSDVQAAISRVFSRIPGTYTPSMDGKLYYQQGFDVISGGLSKGGWTQVVANSSPDSKNRTFSHSPFMFSGGERGGPLATYLQTAKKRSNFNLWLNTTVKRVVRDGGHITGVEVEAFRSGGYEGVVNVTNISGRVILSAGTFGTAKILLRSGIGPSDQLQVVQNSTIDGPTMINSTSWIPLPVGYNLDDHCNTDTVITHPNVVFYDFYAAWDNPIPSDEQSYLNSRSGILAQAAPNIGPMFWEEIKGADGIVRQLQWTARVEGSFDTPNGHAMTMSQYLGRGATSRGRMTITPSLTTVVSDVPYLKDPNDKEAVIQGIVNLQNALKNVANLTWTYPNSSISARDYVNSLSLSPSIRRSNHWVGTAKIGSDDGRTGGSAVVDLNARVYGTDNLFVVDASIFPGVPTTNPSAYIVTVSEHASEKILALAAPQPVPKWGQCGGRQWTGSFICAAGTKCTYQNDWYSQCL,brenda,G2RB43,COC1=C(OC)C(=O)C(CC=C(C)C)=C(C)C1=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>>COc1c(O)c(C)c(CC=C(C)C)c(O)c1OC.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,1.23,0.0,25.0,6.0,1.1.99.18,2587410.0,0.0899051114393979,COC1=C(OC)C(=O)C(CC=C(C)C)=C(C)C1=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,COc1c(O)c(C)c(CC=C(C)C)c(O)c1OC.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,0.0899051114393979,COC1=C(OC)C(=O)C(CC=C(C)C)=C(C)C1=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__MRSSSRFLGALAAAASFVPSALAQNSVPVTFTDPSTGIVFNSWGLPNGSAETQGGYTFGVALPSNALTTDATEFIGYLQCASTDGKGWCGVSLGGPMTNSLLIAAWPYGDNIYTSFRYATGYAMPDVYTGNATLTQISSTINSTSFTLIFRCQNCLSWNQDGSSGGASTSSGALILGWCQAFPSPGNPTCPDQITIEQHDNGQGIWGAQLDSNAANPSYTAWAAKATKTVPAQCSGPTSTGVVGVPVPTGATYDYIVVGAGAGGIPIADKLSEAGKSVLLIEKGFASTGQNGGTLGPDWLAGTGLTRFDVPGLCNEIWVDSKGIACDDTDQMAGCVLGGGTAVNAGLWFHPYSLDFDYLFPTGWKSSDVQAAISRVFSRIPGTYTPSMDGKLYYQQGFDVISGGLSKGGWTQVVANSSPDSKNRTFSHSPFMFSGGERGGPLATYLQTAKKRSNFNLWLNTTVKRVVRDGGHITGVEVEAFRSGGYEGVVNVTNISGRVILSAGTFGTAKILLRSGIGPSDQLQVVQNSTIDGPTMINSTSWIPLPVGYNLDDHCNTDTVITHPNVVFYDFYAAWDNPIPSDEQSYLNSRSGILAQAAPNIGPMFWEEIKGADGIVRQLQWTARVEGSFDTPNGHAMTMSQYLGRGATSRGRMTITPSLTTVVSDVPYLKDPNDKEAVIQGIVNLQNALKNVANLTWTYPNSSISARDYVNSLSLSPSIRRSNHWVGTAKIGSDDGRTGGSAVVDLNARVYGTDNLFVVDASIFPGVPTTNPSAYIVTVSEHASEKILALAAPQPVPKWGQCGGRQWTGSFICAAGTKCTYQNDWYSQCL,./data/raw/alphafold//AF-G2RB43-F1-model_v4.pdb,3515,3443,1189,3115
+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
+2072,1138,1165,GKFIIPQIVKYSPNCIIIVVSNPVDILTYVTWKLSGLPKHRVIGSGCNLDSARFRYLMAEKLGIHPSSCHGWILGEHGDSRLAVWSGVNVAGVSLQELNPEMGTDNDSENWKEVHKMVVESAYEVIKLKGYTNWAIGLSVADLIESMLKNLSRIHPVSTMVRGMYGIESEVFLSLPCILNARGLTSVINQKLKDDEVAQLKKSADTLWDIQKDLKDL,sabio,P13490,CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]>>CC(O)C(=O)O.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)c1,1000000.0,0.0,25.0,7.5,1.1.1.27,9986.0,6.0,CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H],CC(O)C(=O)O.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)c1,6.0,CC(=O)C(=O)O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]__GKFIIPQIVKYSPNCIIIVVSNPVDILTYVTWKLSGLPKHRVIGSGCNLDSARFRYLMAEKLGIHPSSCHGWILGEHGDSRLAVWSGVNVAGVSLQELNPEMGTDNDSENWKEVHKMVVESAYEVIKLKGYTNWAIGLSVADLIESMLKNLSRIHPVSTMVRGMYGIESEVFLSLPCILNARGLTSVINQKLKDDEVAQLKKSADTLWDIQKDLKDL,./data/raw/alphafold//AF-P13490-F1-model_v4.pdb,1283,5247,1632,768
+2073,3605,3654,MKPLSWSEAFGKGAGRIQASTIRELLKLTQRPGILSFAGGLPAPELFPKEEAAEAAARILREKGEVALQYSPTEGYAPLRAFVAEWIGVRPEEVLITTGSQQALDLVGKVFLDEGSPVLLEAPSYMGAIQAFRLQGPRFLTVPAGEEGPDLDALEEVLKRERPRFLYLIPSFQNPTGGLTPLPARKRLLQMVMERGLVVVEDDAYRELYFGEARLPSLFELAREAGYPGVIYLGSFSKVLSPGLRVAFAVAHPEALQKLVQAKQGADLHTPMLNQMLVHELLKEGFSERLERVRRVYREKAQAMLHALDREVPKEVRYTRPKGGMFVWMELPKGLSAEGLFRRALEENVAFVPGGPFFANGGGENTLRLSYATLDREGIAEGVRRLGRALKGLLALV,sabio,Q72LL6,CC(C)CC(=O)C(=O)O.NC(CCC(=O)O)C(=O)O>>CC(C)CC(N)C(=O)O.O=C(O)CCC(=O)C(=O)O,16.0,0.0,45.0,,2.6.1.39,274.0,1.2041199826559248,CC(C)CC(=O)C(=O)O.NC(CCC(=O)O)C(=O)O,CC(C)CC(N)C(=O)O.O=C(O)CCC(=O)C(=O)O,1.2041199826559248,CC(C)CC(=O)C(=O)O.NC(CCC(=O)O)C(=O)O__MKPLSWSEAFGKGAGRIQASTIRELLKLTQRPGILSFAGGLPAPELFPKEEAAEAAARILREKGEVALQYSPTEGYAPLRAFVAEWIGVRPEEVLITTGSQQALDLVGKVFLDEGSPVLLEAPSYMGAIQAFRLQGPRFLTVPAGEEGPDLDALEEVLKRERPRFLYLIPSFQNPTGGLTPLPARKRLLQMVMERGLVVVEDDAYRELYFGEARLPSLFELAREAGYPGVIYLGSFSKVLSPGLRVAFAVAHPEALQKLVQAKQGADLHTPMLNQMLVHELLKEGFSERLERVRRVYREKAQAMLHALDREVPKEVRYTRPKGGMFVWMELPKGLSAEGLFRRALEENVAFVPGGPFFANGGGENTLRLSYATLDREGIAEGVRRLGRALKGLLALV,./data/raw/alphafold//AF-Q72LL6-F1-model_v4.pdb,1805,1482,3052,1802
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