diff --git "a/datasets/splits/kcat-random_test.csv" "b/datasets/splits/kcat-random_test.csv"
new file mode 100644--- /dev/null
+++ "b/datasets/splits/kcat-random_test.csv"
@@ -0,0 +1,2321 @@
+,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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+14,9899,10049,MRWWTTCVALTSLIPYALLPSYGFNLPQQLEARQNDYPSGSLLHDYPGQHTLPTLELIQKLNATNGTFLPLEEIQGDIMIGMRKPKEIFFFYSLQNPRKFKSVLAKLIYPHITTTAQMVCTTCAQPSAMLNVAWTSQGLRKLGVLDNLGDPYFAMGQLSDAAALGDTDPSTTWAPGLYANKTDGAFLIAAKDWEPIDTLLNQMKAWLGDAIVETHSNRGAVRPGDAAGKEHFGWLDGFIQPAVAGFATSTYPGQQLLLPGTLLTKEIGDPRRAARPAWTKWGSFMAYRQLQELVPEFDDYLMQEAALIQDSSRSVRERADLLGARMFGRWKSGTPLDLAPEKDDPSIGPNLMLNNNFDFNHPAPFNINTNQSYCPFSAHIRKIRPRADQGNQNLKNQMIRASIPYGEELSDDEINNKKTGTERGVAFVTYQSDLGSGFHFQQAEWANNVNIPTGKSDPTPGFDPIVGQNSGKPLVVSGIDYTDLNHDLTFMSFVVSKGGDYFFSPSMSAILHKIAA,brenda,A0A0F7VJ89,COc1ccccc1O.OO.[H+]>>COc1ccccc1OOc1ccccc1OC.O,74.0,24.765925765365026,30.0,4.5,1.11.1.19,98349.0,1.869231719730976,COc1ccccc1O.OO.[H+],COc1ccccc1OOc1ccccc1OC.O,1.869231719730976,COc1ccccc1O.OO.[H+]__MRWWTTCVALTSLIPYALLPSYGFNLPQQLEARQNDYPSGSLLHDYPGQHTLPTLELIQKLNATNGTFLPLEEIQGDIMIGMRKPKEIFFFYSLQNPRKFKSVLAKLIYPHITTTAQMVCTTCAQPSAMLNVAWTSQGLRKLGVLDNLGDPYFAMGQLSDAAALGDTDPSTTWAPGLYANKTDGAFLIAAKDWEPIDTLLNQMKAWLGDAIVETHSNRGAVRPGDAAGKEHFGWLDGFIQPAVAGFATSTYPGQQLLLPGTLLTKEIGDPRRAARPAWTKWGSFMAYRQLQELVPEFDDYLMQEAALIQDSSRSVRERADLLGARMFGRWKSGTPLDLAPEKDDPSIGPNLMLNNNFDFNHPAPFNINTNQSYCPFSAHIRKIRPRADQGNQNLKNQMIRASIPYGEELSDDEINNKKTGTERGVAFVTYQSDLGSGFHFQQAEWANNVNIPTGKSDPTPGFDPIVGQNSGKPLVVSGIDYTDLNHDLTFMSFVVSKGGDYFFSPSMSAILHKIAA,./data/raw/alphafold//AF-A0A0F7VJ89-F1-model_v4.pdb,2842,2334,1053,2954
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+16,16840,17070,MTSQTPTRKPRARDLGLPFTGVTGPYNAITDVDGVGVGFQTIIENEPRPGRKRPARSGVTAILPHMQSETPVPVYAGVHRFNGNGEMTGTHWIEDGGYFLGPVVITNTHGIGMAHHATVRWMVDRYASTYQTDDFLWIMPVVAETYDGALNDINGFPVTEADVRKALDNVASGPVQEGNCGGGTGMITYGFKGGTGTASRVVEFGGRSFTIGALVQANHGQRDWLTIAGVPVGQHMRDGTPQSQLQERGSIIVVLATDLPLMPHQLKRLARRASIGIGRNGTPGGNNSGDIFIAFSTANQRPMQHRSAPFLDVEMVNDEPLDTVYLAAVDSVEEAVVNAMIAAEDMGGTPFDRLLVQAIDHERLRAVLRQYGRLA,brenda,Q59632,NCCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>NCCCC[C@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,0.11,9.978972189204264e-15,30.0,8.0,3.4.13.20,529.0,-0.958607314841775,NCCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,NCCCC[C@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,-0.958607314841775,NCCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MTSQTPTRKPRARDLGLPFTGVTGPYNAITDVDGVGVGFQTIIENEPRPGRKRPARSGVTAILPHMQSETPVPVYAGVHRFNGNGEMTGTHWIEDGGYFLGPVVITNTHGIGMAHHATVRWMVDRYASTYQTDDFLWIMPVVAETYDGALNDINGFPVTEADVRKALDNVASGPVQEGNCGGGTGMITYGFKGGTGTASRVVEFGGRSFTIGALVQANHGQRDWLTIAGVPVGQHMRDGTPQSQLQERGSIIVVLATDLPLMPHQLKRLARRASIGIGRNGTPGGNNSGDIFIAFSTANQRPMQHRSAPFLDVEMVNDEPLDTVYLAAVDSVEEAVVNAMIAAEDMGGTPFDRLLVQAIDHERLRAVLRQYGRLA,./data/raw/alphafold//AF-Q59632-F1-model_v4.pdb,2700,3623,1414,3376
+17,16554,16783,MRVCIIGAGVIGHSTAQSIYQHFHDRIAPLTIEVYADVFTPLTTSDGAAGLWQPYLYDKGNVQETKWNKETFQYLLSCLSSPDSVRMGIFLQSGYNLCTEPLPDPSFKDTVLGFRKLTQRELDMFPGYSFGWFNTALMVEGKTYLPWLMDWLRQRKVKFYQRKIGSFKELADIGADVIINCSGVRSGDLQPDPELQPGRGQIIKVDAPWLKHWILTHDSSSGVYNSPYIIPGSRLVTVGGVFQIGNWNLQNSSVDHKGIWEAACKLDPSLQHARIVEDWTGLRPARSKVRLERETIRSGPTSFEVIHNYGHGGFGLTIHRGCAEEAARLFGQILEQKGLLAHSKSRL,sabio,Q6TGN2,NC(Cc1ccc(O)cc1)C(=O)O.O.O=O>>N.O=C(O)C(=O)Cc1ccc(O)cc1.OO,117.0,1.2266387041399378e-14,37.0,8.0,1.4.3.3,7962.0,2.0681858617461617,NC(Cc1ccc(O)cc1)C(=O)O.O.O=O,N.O=C(O)C(=O)Cc1ccc(O)cc1.OO,2.0681858617461617,NC(Cc1ccc(O)cc1)C(=O)O.O.O=O__MRVCIIGAGVIGHSTAQSIYQHFHDRIAPLTIEVYADVFTPLTTSDGAAGLWQPYLYDKGNVQETKWNKETFQYLLSCLSSPDSVRMGIFLQSGYNLCTEPLPDPSFKDTVLGFRKLTQRELDMFPGYSFGWFNTALMVEGKTYLPWLMDWLRQRKVKFYQRKIGSFKELADIGADVIINCSGVRSGDLQPDPELQPGRGQIIKVDAPWLKHWILTHDSSSGVYNSPYIIPGSRLVTVGGVFQIGNWNLQNSSVDHKGIWEAACKLDPSLQHARIVEDWTGLRPARSKVRLERETIRSGPTSFEVIHNYGHGGFGLTIHRGCAEEAARLFGQILEQKGLLAHSKSRL,./data/raw/alphafold//AF-Q6TGN2-F1-model_v4.pdb,2817,3638,3044,1792
+18,12385,12555,MENKVINFKKIIDSRGSLVAIEENKNIPFSIKRVYYIFDTKGEEPRGFHAHKKLEQVLVCLNGSCRVILDDGNIIQEITLDSPAVGLYVGPAVWHEMHDFSSDCVMMVLASDYYDETDYIRQYDNFKKYIAKINLEKEG,brenda,Q6T1W8,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>>Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](C)[C@H](O)C(=O)[C@H]3O)O2)c(=O)nc1O,10.5,0.0,37.0,7.5,5.3.2.3,143495.0,1.021189299069938,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,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](C)[C@H](O)C(=O)[C@H]3O)O2)c(=O)nc1O,1.021189299069938,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__MENKVINFKKIIDSRGSLVAIEENKNIPFSIKRVYYIFDTKGEEPRGFHAHKKLEQVLVCLNGSCRVILDDGNIIQEITLDSPAVGLYVGPAVWHEMHDFSSDCVMMVLASDYYDETDYIRQYDNFKKYIAKINLEKEG,./data/raw/alphafold//AF-Q6T1W8-F1-model_v4.pdb,2078,4262,4144,4000
+19,21677,22002,MSAASPAPDDLATLMAPSADGMRYALYSPTAMPTAGGFLWNRRMMVQLTCRGYATAQFMQPEPAKYAHAPLLEARNFMMPEQPYYAHHPGRFFYLKDEDTGALYSVPHEPVRAPAETFEFSAGKHDVRWRVRHDGIVVELCVSLPTDDAVELWECRVHNQSGRTRRLSLYPYFPIGYMSWMHQSGGYSPELGGIVCRSVTPYQKVDDYFRQRDFKDCTFLLHEQPPVAWDAQQMAFEGEGGLHAPSAVQAEQLGNHDAHYENPAAALQYRLSLAPDAATVYRFAFGPAKDDAEIAALRARYLSAEGFAAAAQDYAQYLQAGRGCVQIATPDAALDNLVNHWLPRQVFYHGDVNRLTTDPQTRNYLQDHMGMAYLQPATARAALLHALSQQEPSGAMPDGILLVEGAELKYINQVPHTDHCVWLPIFLDAYLAETGDVAVLDAVVRTHDGQALSVAARLDAAMQWLLDARDARGLSFIAQGDWNDPMNMVGWRGVGVSGWLTVATAYALRLWSGICAANGRSAQATQFGQAVEEVNAAANRELWDGHWYARGITDDGVRFGIADDEEGRIYLNPQSWALLAGTADAEQRTALLAAVREQLHTPYGPVMLAPAYTHMRDDVGRLTQKWPGAAENGAVYNHAVAFYLYSLYQIGDADRAWEILRAMLPGPDMADALQRGHLPVSLPNYYRGAWHQYPRTAGRSSQLFNTGTVAWVYRCVLEGLFGLVGDGDALAVRPQLPSHWPQAQVTRQFRGAQFEVALTREPGRTQLEVQVDGVVSPDQRVHGIVAGRTYQLQVRLPG,sabio,Q8P3J4,O=C([O-])[C@H](O)[C@@H](O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO.O=P(O)(O)O>>O=C(O)C(O)C(O)C(O)C(O)CO.O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,114.0,0.110457037910425,30.0,7.0,2.4.1.321,339.0,2.0569048513364727,O=C([O-])[C@H](O)[C@@H](O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO.O=P(O)(O)O,O=C(O)C(O)C(O)C(O)C(O)CO.O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O,2.0569048513364727,O=C([O-])[C@H](O)[C@@H](O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO.O=P(O)(O)O__MSAASPAPDDLATLMAPSADGMRYALYSPTAMPTAGGFLWNRRMMVQLTCRGYATAQFMQPEPAKYAHAPLLEARNFMMPEQPYYAHHPGRFFYLKDEDTGALYSVPHEPVRAPAETFEFSAGKHDVRWRVRHDGIVVELCVSLPTDDAVELWECRVHNQSGRTRRLSLYPYFPIGYMSWMHQSGGYSPELGGIVCRSVTPYQKVDDYFRQRDFKDCTFLLHEQPPVAWDAQQMAFEGEGGLHAPSAVQAEQLGNHDAHYENPAAALQYRLSLAPDAATVYRFAFGPAKDDAEIAALRARYLSAEGFAAAAQDYAQYLQAGRGCVQIATPDAALDNLVNHWLPRQVFYHGDVNRLTTDPQTRNYLQDHMGMAYLQPATARAALLHALSQQEPSGAMPDGILLVEGAELKYINQVPHTDHCVWLPIFLDAYLAETGDVAVLDAVVRTHDGQALSVAARLDAAMQWLLDARDARGLSFIAQGDWNDPMNMVGWRGVGVSGWLTVATAYALRLWSGICAANGRSAQATQFGQAVEEVNAAANRELWDGHWYARGITDDGVRFGIADDEEGRIYLNPQSWALLAGTADAEQRTALLAAVREQLHTPYGPVMLAPAYTHMRDDVGRLTQKWPGAAENGAVYNHAVAFYLYSLYQIGDADRAWEILRAMLPGPDMADALQRGHLPVSLPNYYRGAWHQYPRTAGRSSQLFNTGTVAWVYRCVLEGLFGLVGDGDALAVRPQLPSHWPQAQVTRQFRGAQFEVALTREPGRTQLEVQVDGVVSPDQRVHGIVAGRTYQLQVRLPG,./data/raw/alphafold//AF-Q8P3J4-F1-model_v4.pdb,672,56,5663,6556
+20,21419,21743,MHAYLHCLSHSPLVGYVDPAQEVLDEVNGVIASARERIAAFSPELVVLFAPDHYNGFFYDVMPPFCLGVGATAIGDFGSAAGELPVPVELAEACAHAVMKSGIDLAVSYCMQVDHGFAQPLEFLLGGLDKVPVLPVFINGVATPLPGFQRTRMLGEAIGRFTSTLNKRVLFLGSGGLSHQPPVPELAKADAHMRDRLLGSGKDLPASERELRQQRVISAAEKFVEDQRTLHPLNPIWDNQFMTLLEQGRIQELDAVSNEELSAIAGKSTHEIKTWVAAFAAISAFGNWRSEGRYYRPIPEWIAGFGSLSARTEN,brenda,P0ABR9,O=C(O)CCc1cccc([O-])c1O.O=O>>O=C(O)CCC(=O)/C=C/C=C(\O)C(=O)O,29.0,0.2353281754128837,30.0,8.75,1.13.11.16,562.0,1.462397997898956,O=C(O)CCc1cccc([O-])c1O.O=O,O=C(O)CCC(=O)/C=C/C=C(\O)C(=O)O,1.462397997898956,O=C(O)CCc1cccc([O-])c1O.O=O__MHAYLHCLSHSPLVGYVDPAQEVLDEVNGVIASARERIAAFSPELVVLFAPDHYNGFFYDVMPPFCLGVGATAIGDFGSAAGELPVPVELAEACAHAVMKSGIDLAVSYCMQVDHGFAQPLEFLLGGLDKVPVLPVFINGVATPLPGFQRTRMLGEAIGRFTSTLNKRVLFLGSGGLSHQPPVPELAKADAHMRDRLLGSGKDLPASERELRQQRVISAAEKFVEDQRTLHPLNPIWDNQFMTLLEQGRIQELDAVSNEELSAIAGKSTHEIKTWVAAFAAISAFGNWRSEGRYYRPIPEWIAGFGSLSARTEN,./data/raw/alphafold//AF-P0ABR9-F1-model_v4.pdb,2010,4168,4036,3882
+21,3522,3571,MTLEIFEYLEKYDYEQVVFCQDKESGLKAIIAIHDTTLGPALGGTRMWTYDSEEAAIEDALRLAKGMTYKNAAAGLNLGGAKTVIIGDPRKDKSEAMFRALGRYIQGLNGRYITAEDVGTTVDDMDIIHEETDFVTGISPSFGSSGNPSPVTAYGVYRGMKAAAKEAFGTDNLEGKVIAVQGVGNVAYHLCKHLHAEGAKLIVTDINKEAVQRAVEEFGASAVEPNEIYGVECDIYAPCALGATVNDETIPQLKAKVIAGSANNQLKEDRHGDIIHEMGIVYAPDYVINAGGVINVADELYGYNRERALKRVESIYDTIAKVIEISKRDGIATYVAADRLAEERIASLKNSRSTYLRNGHDIISRR,brenda,P0A392,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](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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O,0.478,0.0,35.0,9.5,1.4.1.9,1396.0,-0.3205721033878811,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](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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O,-0.3205721033878811,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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]__MTLEIFEYLEKYDYEQVVFCQDKESGLKAIIAIHDTTLGPALGGTRMWTYDSEEAAIEDALRLAKGMTYKNAAAGLNLGGAKTVIIGDPRKDKSEAMFRALGRYIQGLNGRYITAEDVGTTVDDMDIIHEETDFVTGISPSFGSSGNPSPVTAYGVYRGMKAAAKEAFGTDNLEGKVIAVQGVGNVAYHLCKHLHAEGAKLIVTDINKEAVQRAVEEFGASAVEPNEIYGVECDIYAPCALGATVNDETIPQLKAKVIAGSANNQLKEDRHGDIIHEMGIVYAPDYVINAGGVINVADELYGYNRERALKRVESIYDTIAKVIEISKRDGIATYVAADRLAEERIASLKNSRSTYLRNGHDIISRR,./data/raw/alphafold//AF-P0A392-F1-model_v4.pdb,1591,1174,3020,1370
+22,10422,10575,MKFKMKGLFCVILSSLAFSGCVYDSKLQRPVISERETEIPLLFDQAQTQAVFVTYDGIHLKSYGNDLSRAKTEYIPASTFKMLNALIGLQNAKATNTEVFHWNGEKRAFSAWEKDMTLAEAMQASAVPVYQELARRIGLELMREEVKRVGFGNAEIGQQVDNFWLVGPLKISPEQEVQFAYQLAMKQLPFDSNVQQQVKDMLYIERRGDSKLYAKSGWGMDVEPQVGWYTGWVEQPNGKVTAFALNMNMQAGDDPTERKQLTLSILDKLGLFFYLR,brenda,I6S7G0,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(S[C@@H]3CN[C@H](C(=O)N(C)C)C3)[C@H](C)[C@H]12.O>>,0.01,99.75154353578397,30.0,7.0,3.5.2.6,106648.0,-2.0,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,,-2.0,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__MKFKMKGLFCVILSSLAFSGCVYDSKLQRPVISERETEIPLLFDQAQTQAVFVTYDGIHLKSYGNDLSRAKTEYIPASTFKMLNALIGLQNAKATNTEVFHWNGEKRAFSAWEKDMTLAEAMQASAVPVYQELARRIGLELMREEVKRVGFGNAEIGQQVDNFWLVGPLKISPEQEVQFAYQLAMKQLPFDSNVQQQVKDMLYIERRGDSKLYAKSGWGMDVEPQVGWYTGWVEQPNGKVTAFALNMNMQAGDDPTERKQLTLSILDKLGLFFYLR,./data/raw/alphafold//AF-I6S7G0-F1-model_v4.pdb,1457,991,795,1106
+23,6206,6315,MSASQRHDRGAERILVINPGSTTTKVALFEGEVPLFDETVEHGKESLRAFPAVTDQFAFRLRAVKDVLEHHGVLDTPLDAVAGRGGLLAPMQGGTWRVGPAMLATLAEARHGEHPCNLGAALARHFADLHGVEAYIVDPVVTDEMDDVARYTGLPQIRRRSVFHALSHRAAARVAASRCGVAYEEGRFLVAHMGGGVSVAAHRCGRIVDVVNALDGDGPITAERTGRLPVLPVLDLIERGLQTFESMRRIVLREGGLWAHCGTNDLREVERRMETGDAAAAAIFDALAYTIAKELASLAPAVLGTARGGVTTVTAVVLTGGMARSVRLTSRLEAHLGWLGPMVVLPDVEEMRALTQGVLRVLRGEEVAKEYV,brenda,Q72EF0,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,4.35,0.0867086331863563,44.0,7.4,2.7.2.7,881.0,0.6384892569546373,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,0.6384892569546373,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__MSASQRHDRGAERILVINPGSTTTKVALFEGEVPLFDETVEHGKESLRAFPAVTDQFAFRLRAVKDVLEHHGVLDTPLDAVAGRGGLLAPMQGGTWRVGPAMLATLAEARHGEHPCNLGAALARHFADLHGVEAYIVDPVVTDEMDDVARYTGLPQIRRRSVFHALSHRAAARVAASRCGVAYEEGRFLVAHMGGGVSVAAHRCGRIVDVVNALDGDGPITAERTGRLPVLPVLDLIERGLQTFESMRRIVLREGGLWAHCGTNDLREVERRMETGDAAAAAIFDALAYTIAKELASLAPAVLGTARGGVTTVTAVVLTGGMARSVRLTSRLEAHLGWLGPMVVLPDVEEMRALTQGVLRVLRGEEVAKEYV,./data/raw/alphafold//AF-Q72EF0-F1-model_v4.pdb,1793,1466,3034,1782
+24,8659,8795,MGRIGILGAGLAGLAAATKLAEAGENVTVFEARNRPGGRVWSETLDTPKGSYVIERGAEFVLDGYTSMRRLLSQFGLSLVDTGMSYYVREPGDTTGITCDDIIRTGREALELASGSGLQGTAEELLAKLPDEPELVDALRARIEISTAVSASEVTARSLQHIASFEPKPSWRVAGGNQRLPDAMAAALGSAVRYGETVRAVENISDGGVLVTTDTDTSVFDTVVVALPLAVIRDSQLNLPTTEARDAALKHVLQGHAAKLHLPLETQPATSAVMSVEGRYWTWTATDESGAVAPVLNAFMGSPSAITRANLKQRPAEWVAKARALRTDLAIPQDAAALTTVWSEDQLAGGAYAAHAPGVTAAGTALLEKPVGDVFWAGEYSEPEFVGLMEGAIRSGERAAGRVMQRLETKSGNSDSERSKA,uniprot_search,Q8GAJ0,CNCCCC(=O)O.O.O=O>>CN.O=CCCC(=O)O.OO,1230.0,0.0,22.0,9.8,1.5.3.21,29320.0,3.089905111439398,CNCCCC(=O)O.O.O=O,CN.O=CCCC(=O)O.OO,3.089905111439398,CNCCCC(=O)O.O.O=O__MGRIGILGAGLAGLAAATKLAEAGENVTVFEARNRPGGRVWSETLDTPKGSYVIERGAEFVLDGYTSMRRLLSQFGLSLVDTGMSYYVREPGDTTGITCDDIIRTGREALELASGSGLQGTAEELLAKLPDEPELVDALRARIEISTAVSASEVTARSLQHIASFEPKPSWRVAGGNQRLPDAMAAALGSAVRYGETVRAVENISDGGVLVTTDTDTSVFDTVVVALPLAVIRDSQLNLPTTEARDAALKHVLQGHAAKLHLPLETQPATSAVMSVEGRYWTWTATDESGAVAPVLNAFMGSPSAITRANLKQRPAEWVAKARALRTDLAIPQDAAALTTVWSEDQLAGGAYAAHAPGVTAAGTALLEKPVGDVFWAGEYSEPEFVGLMEGAIRSGERAAGRVMQRLETKSGNSDSERSKA,./data/raw/alphafold//AF-Q8GAJ0-F1-model_v4.pdb,3482,3398,1132,3049
+25,11666,11824,MESGFTSKDTYLSHFNPRDYLEKYYKFGSRHSAESQILKHLLKNLFKIFCLDGVKGDLLIDIGSGPTIYQLLSACESFKEIVVTDYSDQNLQELEKWLKKEPEAFDWSPVVTYVCDLEGNRVKGPEKEEKLRQAVKQVLKCDVTQSQPLGAVPLPPADCVLSTLCLDAACPDLPTYCRALRNLGSLLKPGGFLVIMDALKSSYYMIGEQKFSSLPLGREAVEAAVKEAGYTIEWFEVISQSYSSTMANNEGLFSLVARKLSRPL,brenda,P40261,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.[H+].c1ccc2c(c1)[nH]c1cnccc12>>Cn1ccc2c3ccccc3nc-2c1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,0.0004,0.1774173108604906,37.0,8.6,2.1.1.1,9606.0,-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.[H+].c1ccc2c(c1)[nH]c1cnccc12,Cn1ccc2c3ccccc3nc-2c1.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.[H+].c1ccc2c(c1)[nH]c1cnccc12__MESGFTSKDTYLSHFNPRDYLEKYYKFGSRHSAESQILKHLLKNLFKIFCLDGVKGDLLIDIGSGPTIYQLLSACESFKEIVVTDYSDQNLQELEKWLKKEPEAFDWSPVVTYVCDLEGNRVKGPEKEEKLRQAVKQVLKCDVTQSQPLGAVPLPPADCVLSTLCLDAACPDLPTYCRALRNLGSLLKPGGFLVIMDALKSSYYMIGEQKFSSLPLGREAVEAAVKEAGYTIEWFEVISQSYSSTMANNEGLFSLVARKLSRPL,./data/raw/alphafold//AF-P40261-F1-model_v4.pdb,3485,1167,3012,1361
+26,14057,14239,MGIATVNPATGETVKIFEPITVDEIEVKLALAETTFRQYRKISLEQRSQWLKAAADILERDQQKLGEIMTLEMGKPIKGAIAEAKKCALVCRYYADNAAEFLKDVEAQTDASRSFIRYQPLGVILAVMPWNFPLWQVFRFAAPALMAGNVGILKHASNVPQCALAVEAILAEAGFPAGCFQTFLIGASEVESIINDPRVKAATLTGSEPAGASLASAAGKQIKKTVLELGGSDPFIVLESADIEAAATTAVTARMLNNGQSCIAAKRFILAESIADEFQALLLEKFKALKVGDPMEEDTDIGPLANASMLLELNQQVQETVTKGGTILLGGHIISDRPGYFYPPTILTDIPVDSPGYYDEFFGPVALLFRVKDIDQAIELANDTIFGLGASAWTNDSAEQDRLIEDIEAGCVFINGMVKSDPRLPFGGIKRSGYGRELSIEGMQEFLNVKTVWIK,brenda,B1WSJ7,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+],3.9,7.240812448354101e-15,25.0,9.0,1.2.1.16,2546360.0,0.5910646070264992,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+],0.5910646070264992,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__MGIATVNPATGETVKIFEPITVDEIEVKLALAETTFRQYRKISLEQRSQWLKAAADILERDQQKLGEIMTLEMGKPIKGAIAEAKKCALVCRYYADNAAEFLKDVEAQTDASRSFIRYQPLGVILAVMPWNFPLWQVFRFAAPALMAGNVGILKHASNVPQCALAVEAILAEAGFPAGCFQTFLIGASEVESIINDPRVKAATLTGSEPAGASLASAAGKQIKKTVLELGGSDPFIVLESADIEAAATTAVTARMLNNGQSCIAAKRFILAESIADEFQALLLEKFKALKVGDPMEEDTDIGPLANASMLLELNQQVQETVTKGGTILLGGHIISDRPGYFYPPTILTDIPVDSPGYYDEFFGPVALLFRVKDIDQAIELANDTIFGLGASAWTNDSAEQDRLIEDIEAGCVFINGMVKSDPRLPFGGIKRSGYGRELSIEGMQEFLNVKTVWIK,./data/raw/alphafold//AF-B1WSJ7-F1-model_v4.pdb,2372,4746,4714,4548
+27,6895,7011,MAEMATATRLLGWRVASWRLRPPLAGFVSQRAHSLLPVDDAINGLSEEQRQLRQTMAKFLQEHLAPKAQEIDRSNEFKNLREFWKQLGNLGVLGITAPVQYGGSGLGYLEHVLVMEEISRASGAVGLSYGAHSNLCINQLVRNGNEAQKEKYLPKLISGEYIGALAMSEPNAGSDVVSMKLKAEKKGNHYILNGNKFWITNGPDADVLIVYAKTDLAAVPASRGITAFIVEKGMPGFSTSKKLDKLGMRGSNTCELIFEDCKIPAANILGHENKGVYVLMSGLDLERLVLAGGPLGLMQAVLDHTIPYLHVREAFGQKIGHFQLMQGKMADMYTRLMACRQYVYNVAKACDEGHCTAKDCAGVILYSAECATQVALDGIQCFGGNGYINDFPMGRFLRDAKLYEIGAGTSEVRRLVIGRAFNADFH,sabio,P26440,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)c1N2,2.1,0.0,32.0,8.0,1.3.8.4,9606.0,0.3222192947339193,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)c1N2,0.3222192947339193,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__MAEMATATRLLGWRVASWRLRPPLAGFVSQRAHSLLPVDDAINGLSEEQRQLRQTMAKFLQEHLAPKAQEIDRSNEFKNLREFWKQLGNLGVLGITAPVQYGGSGLGYLEHVLVMEEISRASGAVGLSYGAHSNLCINQLVRNGNEAQKEKYLPKLISGEYIGALAMSEPNAGSDVVSMKLKAEKKGNHYILNGNKFWITNGPDADVLIVYAKTDLAAVPASRGITAFIVEKGMPGFSTSKKLDKLGMRGSNTCELIFEDCKIPAANILGHENKGVYVLMSGLDLERLVLAGGPLGLMQAVLDHTIPYLHVREAFGQKIGHFQLMQGKMADMYTRLMACRQYVYNVAKACDEGHCTAKDCAGVILYSAECATQVALDGIQCFGGNGYINDFPMGRFLRDAKLYEIGAGTSEVRRLVIGRAFNADFH,./data/raw/alphafold//AF-P26440-F1-model_v4.pdb,3217,2030,3057,1807
+28,9258,9400,MKGRLHPARRGLRYEKRHRRPILLGGACVLGYLVLGLFVLPHASLSDVTQPTVSMAPVPPSSLSPRSTEHATSGAPSFTLPFTDAPPGTLTSITTAAPLPRPAVDERSNAAHATGEAPTGSTHSISDAPQPTEVPQRGADELHSRYVSELAQLDVLDVFPLRPHERRISFIEFARCLGARLSVSPETGVEVERDDLASDRYAPFLISVTLENTQDLKALICNLTMPYRYIVLAQNGDTPEVTPFFRLLRRMFAFTTRLTVLQFPENIGFAGAVNAGLREALRHPFSEVPFLHIVHNDVRFLFSSLEQAVAGAYKTTARDTDMIEALEKEVATEPNEYTPLIRQPDGLRTPLLPGTPLPQQHDRKPVVVTSALLPDRVRYMAPSRRAELMVGHTSFMFANSRGEYTSVFLSRLAVLAVGFFDENFFPILYDDTDYRWRAHLLGFVEDRNAAMNDQVISFDLDCVNQAMNDVDDDGNAEGRLGGLRKAATGPTLSLKGKALQRDCRKAFYAGVQYTYMQQKWGVESMTELMQAHTRREPFSGEAFGGKLRLPLDAWVVDRNRLTNLRTWLRDVGRRILDVDNYNTDVILQAVSP,brenda,Q6XFB6,CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O.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>>O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.4,32.818898186831944,37.0,8.0,2.4.1.288,5664.0,-0.3979400086720376,CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O.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,O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-0.3979400086720376,CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O.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__MKGRLHPARRGLRYEKRHRRPILLGGACVLGYLVLGLFVLPHASLSDVTQPTVSMAPVPPSSLSPRSTEHATSGAPSFTLPFTDAPPGTLTSITTAAPLPRPAVDERSNAAHATGEAPTGSTHSISDAPQPTEVPQRGADELHSRYVSELAQLDVLDVFPLRPHERRISFIEFARCLGARLSVSPETGVEVERDDLASDRYAPFLISVTLENTQDLKALICNLTMPYRYIVLAQNGDTPEVTPFFRLLRRMFAFTTRLTVLQFPENIGFAGAVNAGLREALRHPFSEVPFLHIVHNDVRFLFSSLEQAVAGAYKTTARDTDMIEALEKEVATEPNEYTPLIRQPDGLRTPLLPGTPLPQQHDRKPVVVTSALLPDRVRYMAPSRRAELMVGHTSFMFANSRGEYTSVFLSRLAVLAVGFFDENFFPILYDDTDYRWRAHLLGFVEDRNAAMNDQVISFDLDCVNQAMNDVDDDGNAEGRLGGLRKAATGPTLSLKGKALQRDCRKAFYAGVQYTYMQQKWGVESMTELMQAHTRREPFSGEAFGGKLRLPLDAWVVDRNRLTNLRTWLRDVGRRILDVDNYNTDVILQAVSP,./data/raw/alphafold//AF-Q6XFB6-F1-model_v4.pdb,3529,3467,1215,3142
+29,2625,2660,MPIRVPDELPAVNFLREENVFVMTTSRASGQEIRPLKVLILNLMPKKIETENQFLRLLSNSPLQVDIQLLRIDSRESRNTPAEHLNNFYCNFEDIQDQNFDGLIVTGAPLGLVEFNDVAYWPQIKQVLEWSKDHVTSTLFVCWAVQAALNILYGIPKQTRTEKLSGVYEHHILHPHALLTRGFDDSFLAPHSRYADFPAALIRDYTDLEILAETEEGDAYLFASKDKRIAFVTGHPEYDAQTLAQEFFRDVEAGLDPDVPYNYFPHNDPQNTPRASWRSHGNLLFTNWLNYYVYQITPYDLRHMNPTLD,sabio,P07623,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.CC(O)C(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,0.015,12.487672871772222,25.0,7.5,2.3.1.46,562.0,-1.8239087409443189,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.CC(O)C(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,-1.8239087409443189,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.CC(O)C(N)C(=O)O__MPIRVPDELPAVNFLREENVFVMTTSRASGQEIRPLKVLILNLMPKKIETENQFLRLLSNSPLQVDIQLLRIDSRESRNTPAEHLNNFYCNFEDIQDQNFDGLIVTGAPLGLVEFNDVAYWPQIKQVLEWSKDHVTSTLFVCWAVQAALNILYGIPKQTRTEKLSGVYEHHILHPHALLTRGFDDSFLAPHSRYADFPAALIRDYTDLEILAETEEGDAYLFASKDKRIAFVTGHPEYDAQTLAQEFFRDVEAGLDPDVPYNYFPHNDPQNTPRASWRSHGNLLFTNWLNYYVYQITPYDLRHMNPTLD,./data/raw/alphafold//AF-P07623-F1-model_v4.pdb,1630,1230,1707,1436
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+43,9469,9611,MSKFQSLAAFIALSLSTGRLAAAAIGPKADLTISNANISPDGFTRAAVVANNQFPGPLITGNKGDNFQINVIDNLSNDTMLTSTTIHWHGFFQKGTNWADGPAFVNQCPISEGNSFLYDFSAADQAGTFWYHSHLSTQYCDGLRGVMVVYDPNDPHQSLYDVDDESTVITLSDWYHTAARLGPRFPLGADTVLINGLGRFATGDPDAELAVITVTKGKRYRFRLANISCDPNFTFSIQGHTMNVIEVDSVNVTPYEVDSIQTFAGQRYSFVLTADQDVDNYWMWAIPNVGTINTDGGVNSAILRYDGAAEIEPEAASPSVNNQLVESNVVPLTDVAAPGNPTVGGVDYALNLDFSFDGTNFAINGESYTSPSVPVLLQILSGAQTAPDLLPNGSVYVLPSNATVELSFPMTATNAPGAPHPFHLHGHTFYVVRSAGQTDYNYVNPPQRDTVSVGAAGDNVTIRFRTDNPGPWFLHCHIDFHLEAGFAVVFAEDTPNVASVNKPSAAWEDLCPTYNSVYPNGDSGDARR,sabio,Q8NID5,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O>>O,1000000.0,90.9985682302694,30.0,5.7,1.10.3.2,191221.0,6.0,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O,O,6.0,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O__MSKFQSLAAFIALSLSTGRLAAAAIGPKADLTISNANISPDGFTRAAVVANNQFPGPLITGNKGDNFQINVIDNLSNDTMLTSTTIHWHGFFQKGTNWADGPAFVNQCPISEGNSFLYDFSAADQAGTFWYHSHLSTQYCDGLRGVMVVYDPNDPHQSLYDVDDESTVITLSDWYHTAARLGPRFPLGADTVLINGLGRFATGDPDAELAVITVTKGKRYRFRLANISCDPNFTFSIQGHTMNVIEVDSVNVTPYEVDSIQTFAGQRYSFVLTADQDVDNYWMWAIPNVGTINTDGGVNSAILRYDGAAEIEPEAASPSVNNQLVESNVVPLTDVAAPGNPTVGGVDYALNLDFSFDGTNFAINGESYTSPSVPVLLQILSGAQTAPDLLPNGSVYVLPSNATVELSFPMTATNAPGAPHPFHLHGHTFYVVRSAGQTDYNYVNPPQRDTVSVGAAGDNVTIRFRTDNPGPWFLHCHIDFHLEAGFAVVFAEDTPNVASVNKPSAAWEDLCPTYNSVYPNGDSGDARR,./data/raw/alphafold//AF-Q8NID5-F1-model_v4.pdb,3424,2318,1012,2907
+44,8779,8916,MKQRIALSLLALGPLLLVPRVYAAADEPMANIVEKAVQPLLEEYRIPGMAVAVLKEGKPHYFNYGVANRESGRRISERTLFEIGSVSKTFTATLGTYAVVKGGFRLDDKVSQHAPWLQNSAFDRVTMAQLATYSAGGLPLQFPDAVDSNERMRQYYRQWSPLYAAGTHREYSNPSIGLFGHLAASTLGQPFRQLMSQTLLPKLDLQHTYLEVPDAAMVDYAYGYSKEDKPVRVNPGVLADEAYGIKTSAADLIKFVGANMTGSGDKAVQQALAMTRTGFYSVGEMTQGLGWESYAYPVTEQALLAGNSPAVSFKANPVKPFVAPRVMGNERLYNKTGSTNGFGAYVVFVPARGVGIVMLANRNYPIEARVKAAYAIMRHLAP,brenda,B2BSN6,CO/N=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nc(=O)c(=O)[nH]n3C)CS[C@H]12)c1csc(=N)[nH]1.O>>,0.042,99.8256646100902,30.0,7.0,3.5.2.6,29489.0,-1.3767507096020994,CO/N=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nc(=O)c(=O)[nH]n3C)CS[C@H]12)c1csc(=N)[nH]1.O,,-1.3767507096020994,CO/N=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(CSc3nc(=O)c(=O)[nH]n3C)CS[C@H]12)c1csc(=N)[nH]1.O__MKQRIALSLLALGPLLLVPRVYAAADEPMANIVEKAVQPLLEEYRIPGMAVAVLKEGKPHYFNYGVANRESGRRISERTLFEIGSVSKTFTATLGTYAVVKGGFRLDDKVSQHAPWLQNSAFDRVTMAQLATYSAGGLPLQFPDAVDSNERMRQYYRQWSPLYAAGTHREYSNPSIGLFGHLAASTLGQPFRQLMSQTLLPKLDLQHTYLEVPDAAMVDYAYGYSKEDKPVRVNPGVLADEAYGIKTSAADLIKFVGANMTGSGDKAVQQALAMTRTGFYSVGEMTQGLGWESYAYPVTEQALLAGNSPAVSFKANPVKPFVAPRVMGNERLYNKTGSTNGFGAYVVFVPARGVGIVMLANRNYPIEARVKAAYAIMRHLAP,./data/raw/alphafold//AF-B2BSN6-F1-model_v4.pdb,1456,988,799,1113
+45,20459,20764,MRKFIAALRLALAAAAHLLLTLPPAQCYWLNPEIYDAGGLSRRAFPEGFVFGTAASAYQVEGMAKQGGRGPSIWDAFIEKPGTIPNNATADVTVDEYHRYKEDVNIMKNMGFDAYRFSISWSRIFPNGTGMVNQEGVDYYNRLIDYMVKKGIKPYANLYHYDLPLALHEQYLGWLSPNIVEAFADYADFCFQTFGDRVKDWFTFNEPRCVAALGYDNGFHAPGRCSGCDAGGNSTTEPYLAAHHLILSHAAAVKRYREKYQLYQKGRIGILLDFVWYEPFSDSNADRAAAQRARDFHLGWFLDPIIHGRYPYSMLEIVKDRMPTFSDEESRMVKDSIDYVGINHYTSFYMKDPGPWNLTPTSYQDDWHVGFAYERNGVPIGAQANSYWLYIVPWGINKAVTYVKETYGNPTMILSENGMDQPGNVSITQGVHDTVRIRYYRNYITELKKAIDDGAKVIGYFAWSLLDNFEWRLGYTSRFGIVYVDYKTLKRYPKDSAFWFKNMLSSKKRN,sabio,A3BMZ5,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,0.97,3.318868293157318e-14,40.0,4.5,3.2.1.21,4530.0,-0.0132282657337551,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,-0.0132282657337551,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__MRKFIAALRLALAAAAHLLLTLPPAQCYWLNPEIYDAGGLSRRAFPEGFVFGTAASAYQVEGMAKQGGRGPSIWDAFIEKPGTIPNNATADVTVDEYHRYKEDVNIMKNMGFDAYRFSISWSRIFPNGTGMVNQEGVDYYNRLIDYMVKKGIKPYANLYHYDLPLALHEQYLGWLSPNIVEAFADYADFCFQTFGDRVKDWFTFNEPRCVAALGYDNGFHAPGRCSGCDAGGNSTTEPYLAAHHLILSHAAAVKRYREKYQLYQKGRIGILLDFVWYEPFSDSNADRAAAQRARDFHLGWFLDPIIHGRYPYSMLEIVKDRMPTFSDEESRMVKDSIDYVGINHYTSFYMKDPGPWNLTPTSYQDDWHVGFAYERNGVPIGAQANSYWLYIVPWGINKAVTYVKETYGNPTMILSENGMDQPGNVSITQGVHDTVRIRYYRNYITELKKAIDDGAKVIGYFAWSLLDNFEWRLGYTSRFGIVYVDYKTLKRYPKDSAFWFKNMLSSKKRN,./data/raw/alphafold//AF-A3BMZ5-F1-model_v4.pdb,1219,623,296,326
+46,2179,2211,MLNNAMSVVILAAGKGTRMYSDLPKVLHTLAGKAMVQHVIDAANELGAAHVHLVYGHGGDLLKQALKDDNLNWVLQAEQLGTGHAMQQAAPFFADDEDILMLYGDVPLISVETLQRLRDAKPQGGIGLLTVKLDDPTGYGRITRENGKVTGIVEHKDATDEQRQIQEINTGILIANGADMKRWLAKLTNNNAQGEYYITDIIALAYQEGREIVAVHPQRLSEVEGVNNRLQLSRLERVYQSEQAEKLLLAGVMLRDPARFDLRGTLTHGRDVEIDTNVIIEGNVTLGHRVKIGTGCVIKNSVIGDDCEISPYTVVEDANLAAACTIGPFARLRPGAELLEGAHVGNFVEMKKARLGKGSKAGHLTYLGDAEIGDNVNIGAGTITCNYDGANKFKTIIGDDVFVGSDTQLVAPVTVGKGATIAAGTTVTRNVGENALAISRVPQTQKEGWRRPVKKK,sabio,P0ACC7,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.NC1C(O)OC(CO)C(O)C1O>>CC(=O)NC1C(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,0.0005,0.0,,7.6,2.3.1.157,562.0,-3.3010299956639813,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.NC1C(O)OC(CO)C(O)C1O,CC(=O)NC1C(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,-3.3010299956639813,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.NC1C(O)OC(CO)C(O)C1O__MLNNAMSVVILAAGKGTRMYSDLPKVLHTLAGKAMVQHVIDAANELGAAHVHLVYGHGGDLLKQALKDDNLNWVLQAEQLGTGHAMQQAAPFFADDEDILMLYGDVPLISVETLQRLRDAKPQGGIGLLTVKLDDPTGYGRITRENGKVTGIVEHKDATDEQRQIQEINTGILIANGADMKRWLAKLTNNNAQGEYYITDIIALAYQEGREIVAVHPQRLSEVEGVNNRLQLSRLERVYQSEQAEKLLLAGVMLRDPARFDLRGTLTHGRDVEIDTNVIIEGNVTLGHRVKIGTGCVIKNSVIGDDCEISPYTVVEDANLAAACTIGPFARLRPGAELLEGAHVGNFVEMKKARLGKGSKAGHLTYLGDAEIGDNVNIGAGTITCNYDGANKFKTIIGDDVFVGSDTQLVAPVTVGKGATIAAGTTVTRNVGENALAISRVPQTQKEGWRRPVKKK,./data/raw/alphafold//AF-P0ACC7-F1-model_v4.pdb,1391,899,697,988
+47,7724,7849,MITLCLSTLRGLHRAGGSRLQLTMTLGKELASPLQAMSSYTAAGRNVLRWDLSPEQIKTRTEQLIAQTKQVYDTVGTIALKEVTYENCLQVLADIEVTYIVERTMLDFPQHVSSDREVRAASTEADKKLSRFDIEMSMREDVFQRIVHLQETCDLEKIKPEARRYLEKSIKMGKRNGLHLSEHIRNEIKSMKKRMSELCIDFNKNLNEDDTSLVFSKAELGALPDDFIDSLEKTDEDKYKVTLKYPHYFPVMKKCCVPETRRKMEMAFHTRCKQENTAILQQLLPLRAQVAKLLGYNTHADFVLELNTAKSTSRVAAFLDDLSQKLKPLGEAEREFILSLKKKECEERGFEYDGKINAWDLHYYMTQTEELKYSVDQESLKEYFPIEVVTEGLLSIYQELLGLSFEQVPDAHVWNKSVSLYTVKDKATGEVLGQFYLDLYPREGKYNHAACFGLQPGCLLPDGSRMMSVAALVVNFSQPVAGRPSLLRHDEVRTYFHEFGHVMHQICAQTDFARFSGTNVETDFVEVPSQMLENWVWDVDSLRKLSKHYKDGHPITDELLEKLVASRLVNTGLLTLRQIVLSKVDQSLHTNATLDAASEYAKYCTEILGVAATPGTNMPATFGHLAGGYDGQYYGYLWSEVFSMDMFHSCFKKEGIMNPEVGMKYRNLILKPGGSLDGMDMLQNFLQREPNQKAFLMSRGLNGS,uniprot_search,P42676,CCC[C@H](N=C(O)[C@H](C)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N=C(O)Cc1cc(=O)oc2cc(OC)ccc12)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=N)O.O>>CCC[C@H](N=C(O)[C@H](C)N)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=N)O.COc1ccc2c(CC(O)=N[C@@H](CCCNC(=N)N)C(=O)N3CCC[C@H]3C(O)=N[C@@H](CCCCN)C(=O)N3CCC[C@H]3C(O)=N[C@@H](Cc3ccc(O)cc3)C(=O)O)cc(=O)oc2c1,2.1,6.7856331884897116e-15,37.0,7.525,3.4.24.16,10116.0,0.3222192947339193,CCC[C@H](N=C(O)[C@H](C)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N=C(O)Cc1cc(=O)oc2cc(OC)ccc12)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=N)O.O,CCC[C@H](N=C(O)[C@H](C)N)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=N)O.COc1ccc2c(CC(O)=N[C@@H](CCCNC(=N)N)C(=O)N3CCC[C@H]3C(O)=N[C@@H](CCCCN)C(=O)N3CCC[C@H]3C(O)=N[C@@H](Cc3ccc(O)cc3)C(=O)O)cc(=O)oc2c1,0.3222192947339193,CCC[C@H](N=C(O)[C@H](C)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N=C(O)Cc1cc(=O)oc2cc(OC)ccc12)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](CCSC)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=N)O.O__MITLCLSTLRGLHRAGGSRLQLTMTLGKELASPLQAMSSYTAAGRNVLRWDLSPEQIKTRTEQLIAQTKQVYDTVGTIALKEVTYENCLQVLADIEVTYIVERTMLDFPQHVSSDREVRAASTEADKKLSRFDIEMSMREDVFQRIVHLQETCDLEKIKPEARRYLEKSIKMGKRNGLHLSEHIRNEIKSMKKRMSELCIDFNKNLNEDDTSLVFSKAELGALPDDFIDSLEKTDEDKYKVTLKYPHYFPVMKKCCVPETRRKMEMAFHTRCKQENTAILQQLLPLRAQVAKLLGYNTHADFVLELNTAKSTSRVAAFLDDLSQKLKPLGEAEREFILSLKKKECEERGFEYDGKINAWDLHYYMTQTEELKYSVDQESLKEYFPIEVVTEGLLSIYQELLGLSFEQVPDAHVWNKSVSLYTVKDKATGEVLGQFYLDLYPREGKYNHAACFGLQPGCLLPDGSRMMSVAALVVNFSQPVAGRPSLLRHDEVRTYFHEFGHVMHQICAQTDFARFSGTNVETDFVEVPSQMLENWVWDVDSLRKLSKHYKDGHPITDELLEKLVASRLVNTGLLTLRQIVLSKVDQSLHTNATLDAASEYAKYCTEILGVAATPGTNMPATFGHLAGGYDGQYYGYLWSEVFSMDMFHSCFKKEGIMNPEVGMKYRNLILKPGGSLDGMDMLQNFLQREPNQKAFLMSRGLNGS,./data/raw/alphafold//AF-P42676-F1-model_v4.pdb,1820,1500,3201,1976
+48,16150,16377,AKPAAENLSLVVHGPGDLRLENYPIPEPGPNEVLLKMHSVGICGSDVHYWQGRIGDFVVKKPMVLGHEASGTVVKVGSLVRHLQPGDRVAIQPGAPRQTDEFCKIGRYNLSPTIFFCATPPDDGNLCRFYKHNANFCYKLPDNVTFEEGALIEPLSVGIHACRRAGVTLGNKVLVCGAGPIGLVNLLAAKAMGAAQVVVTDLSASRLSKAKEVGADFILEISNESPEEIAKKVEGLLGSKPEVTIECTGVETSIQAGIYATHSGGTLVLVGLGSEMTSVPLVHAATREVDIKGVFRYCNTWPMAISMLASKSVNVKPLVTHRFPLEKALEAFETSKKGLGLKVMIKCDPSDQNP,sabio,P07846,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.OCC1(O)OCC(O)C1O.[H],0.5,6.956863536773207e-15,23.5,7.4,1.1.1.14,9940.0,-0.3010299956639812,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.OCC1(O)OCC(O)C1O.[H],0.2304489213782739,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__AKPAAENLSLVVHGPGDLRLENYPIPEPGPNEVLLKMHSVGICGSDVHYWQGRIGDFVVKKPMVLGHEASGTVVKVGSLVRHLQPGDRVAIQPGAPRQTDEFCKIGRYNLSPTIFFCATPPDDGNLCRFYKHNANFCYKLPDNVTFEEGALIEPLSVGIHACRRAGVTLGNKVLVCGAGPIGLVNLLAAKAMGAAQVVVTDLSASRLSKAKEVGADFILEISNESPEEIAKKVEGLLGSKPEVTIECTGVETSIQAGIYATHSGGTLVLVGLGSEMTSVPLVHAATREVDIKGVFRYCNTWPMAISMLASKSVNVKPLVTHRFPLEKALEAFETSKKGLGLKVMIKCDPSDQNP,./data/raw/alphafold//AF-P07846-F1-model_v4.pdb,2358,553,213,231
+49,21155,21479,MAATTTLRSPKIPHPPPESTPSNLSYLSQISLTPVPKRRRFISIYACSNAESNSQFGSEIKKSQAIELNKVSDEHPYEFNSKDSPNPLPRPLTSADLSNMATEGSRLRVAYQGVRGAYSESAAEKAYPNCEAVPCEQFDTAFEAVERWLVDRAVLPIENSLGGSIHRNYDLLLRHRLHIVGEVKLAIRHCLLANNGVKIEDLKRVLSHPQALAQCENNLTKLGLVREAVDDTAGAAKYIAFQQLKDAGAVASLAAARIYGLNVLAQDIQDDSDNVTRFLMLAREPIIPGTDKPFKTSVVFSLDEGPGVLFKALAVFAMRNINLTKIESRPLQKQALRVLDDSADGFPKYFPYLFYVDFEASMADQRAQNALGHLKEFATFLRVLGSYPSDSGIA,brenda,D3U716,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,0.06,0.0,37.0,8.2,4.2.1.91,4102.0,-1.2218487496163564,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,-1.2218487496163564,O=C(O)C(=O)C[C@]1(C(=O)O)C=C[C@@H](O)C=C1__MAATTTLRSPKIPHPPPESTPSNLSYLSQISLTPVPKRRRFISIYACSNAESNSQFGSEIKKSQAIELNKVSDEHPYEFNSKDSPNPLPRPLTSADLSNMATEGSRLRVAYQGVRGAYSESAAEKAYPNCEAVPCEQFDTAFEAVERWLVDRAVLPIENSLGGSIHRNYDLLLRHRLHIVGEVKLAIRHCLLANNGVKIEDLKRVLSHPQALAQCENNLTKLGLVREAVDDTAGAAKYIAFQQLKDAGAVASLAAARIYGLNVLAQDIQDDSDNVTRFLMLAREPIIPGTDKPFKTSVVFSLDEGPGVLFKALAVFAMRNINLTKIESRPLQKQALRVLDDSADGFPKYFPYLFYVDFEASMADQRAQNALGHLKEFATFLRVLGSYPSDSGIA,./data/raw/alphafold//AF-D3U716-F1-model_v4.pdb,2634,5126,2558,5378
+50,4436,4491,MAAAEAANCIMENFVATLANGMSLQPPLEEVSCGQAESSEKPNAEDMTSKDYYFDSYAHFGIHEEMLKDEVRTLTYRNSMFHNRHLFKDKVVLDVGSGTGILCMFAAKAGARKVIGIECSSISDYAVKIVKANKLDHVVTIIKGKVEEVELPVEKVDIIISEWMGYCLFYESMLNTVLYARDKWLAPDGLIFPDRATLYVTAIEDRQYKDYKIHWWENVYGFDMSCIKDVAIKEPLVDVVDPKQLVTNACLIKEVDIYTVKVEDLTFTSPFCLQVKRNDYVHALVAYFNIEFTRCHKRTGFSTSPESPYTHWKQTVFYMEDYLTVKTGEEIFGTIGMRPNAKNNRDLDFTIDLDFKGQLCELSCSTDYRMR,brenda,Q99873,CC(C)[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)[C@H](CCCNC(=N)N(C)C)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N(C)C)N=C(O)[C@H](CO)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)[C@H](CO)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H](N)Cc1ccccc1)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](C)C(O)=N[C@H](C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,0.0024,75.6036143497786,30.0,7.3,2.1.1.319,9606.0,-2.619788758288394,CC(C)[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)[C@H](CCCNC(=N)N(C)C)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N(C)C)N=C(O)[C@H](CO)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)[C@H](CO)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H](N)Cc1ccccc1)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](C)C(O)=N[C@H](C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,-2.619788758288394,CC(C)[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)[C@H](CCCNC(=N)N(C)C)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N(C)C)N=C(O)[C@H](CO)N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)[C@H](CO)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@@H](N)Cc1ccccc1)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](C)C(O)=N[C@H](C(O)=N[C@@H](CO)C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MAAAEAANCIMENFVATLANGMSLQPPLEEVSCGQAESSEKPNAEDMTSKDYYFDSYAHFGIHEEMLKDEVRTLTYRNSMFHNRHLFKDKVVLDVGSGTGILCMFAAKAGARKVIGIECSSISDYAVKIVKANKLDHVVTIIKGKVEEVELPVEKVDIIISEWMGYCLFYESMLNTVLYARDKWLAPDGLIFPDRATLYVTAIEDRQYKDYKIHWWENVYGFDMSCIKDVAIKEPLVDVVDPKQLVTNACLIKEVDIYTVKVEDLTFTSPFCLQVKRNDYVHALVAYFNIEFTRCHKRTGFSTSPESPYTHWKQTVFYMEDYLTVKTGEEIFGTIGMRPNAKNNRDLDFTIDLDFKGQLCELSCSTDYRMR,./data/raw/alphafold//AF-Q99873-F1-model_v4.pdb,3846,3970,1814,2043
+51,22423,22758,MSKRVEVLLTQLPAYNRLKTPYEAELIETAKKMTAPGKGLLAADESTGSCSKRFAGIGLSNTAEHRRQYRALMLECEGFEQYISGVILHDETVYQKAKTGETFPQYLRRRGVVPGIKTDCGLEPLVEGAKGEQMTAGLDGYIKRAKKYYAMGCRFCKWRNVYKIQNGTVSEAVVRFNAETLARYAILSQLCGLVPIVEPEVMIDGTHDIETCQRVSQHVWSEVVSALHRHGVVWEGCLLKPNMVVPGAESGLKATAEQVAEYTVKTLARVIPPALPGVTFLSGGLSEVMASEYLNAMNNCPLPRPWKLTFSYARALQSSAIKAWGGKESGVEAGRRAFMHRAKMNSLAQLGKYNRADDDKDSQSLYVAGNTY,sabio,Q38B42,O=P(O)(O)OCC1OC(O)(COP(=O)(O)O)C(O)C1O>>O=C(CO)COP(=O)(O)O.O=CC(O)COP(=O)(O)O,18120.0,8.344257555591964e-15,25.0,5.5,4.1.2.13,5691.0,4.258158193340794,O=P(O)(O)OCC1OC(O)(COP(=O)(O)O)C(O)C1O,O=C(CO)COP(=O)(O)O.O=CC(O)COP(=O)(O)O,4.568436414416885,O=P(O)(O)OCC1OC(O)(COP(=O)(O)O)C(O)C1O__MSKRVEVLLTQLPAYNRLKTPYEAELIETAKKMTAPGKGLLAADESTGSCSKRFAGIGLSNTAEHRRQYRALMLECEGFEQYISGVILHDETVYQKAKTGETFPQYLRRRGVVPGIKTDCGLEPLVEGAKGEQMTAGLDGYIKRAKKYYAMGCRFCKWRNVYKIQNGTVSEAVVRFNAETLARYAILSQLCGLVPIVEPEVMIDGTHDIETCQRVSQHVWSEVVSALHRHGVVWEGCLLKPNMVVPGAESGLKATAEQVAEYTVKTLARVIPPALPGVTFLSGGLSEVMASEYLNAMNNCPLPRPWKLTFSYARALQSSAIKAWGGKESGVEAGRRAFMHRAKMNSLAQLGKYNRADDDKDSQSLYVAGNTY,./data/raw/alphafold//AF-Q38B42-F1-model_v4.pdb,811,3268,5576,6895
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+53,12926,13098,MSHFFADHDAPLSMLSVKTEYFPQLTDKEQKYAHFMSKASHAGSRVVMRQVSHESEPIFDLILAIHSKLNGKYPEDDITQKQQTGLYLEYVSQFLSNLGNFKSFGDTKFIPRCEVKFFKQLLELAKINPCSSPLTLSPVDVNHEFTSHHLFSTINELIDIGIYHVEEKAALLGFPSQGYTSAYYLGLPVTPEDMALLKEQLFAELAILPENTRINKVGENSFQIWVASENVKNQITETYPSGQITLSNAVTKVEFIFGDHSREMRLVASYLKEAQKFAANDTQKAMLQEYINHFVTGSSQAHKEAQKLWVKDISPVIETNIGFIETYREPSGIIGEFESLVAIQNKERTAKFSSLVNNAEEFISLLPWSKDYEKPIFNPPDFTSLEVLTFTGSGIPAGINIPNYDDVRLKIGFKNVSLGNILSAAAKSSSKHPPSFISQEDRPIFEKYQSDSFEVQVGIHELLGHGSGKLLTEFTDGFNFDKENPPLGLDGKPVSTYYKVGETWGSKFGQLAGPFEECRAEVIAMFLLTNKKILDIFGFHDVESQDKVIYAGYLQMARAGLLALEYWNPKTGKWGQPHMQARFSIMKTFMKHSTDKNFLKLEMNSTNDDFAIKLDKSLIKTAGHECVKDYLKHLHVYKCSGDVEQGSKYFIDRSTVTPDLASLRDIVLSKRLPRRQFIQSNSYIDDNNKVTLKEYDETPQGMLQSFLDREL,brenda,Q08225,N=C(N)NCCC[C@H](N=C(O)[C@@H](N)CCCNC(=N)N)C(O)=Nc1ccc2ccccc2c1.O>>N=C(N)NCCC[C@H](N=C(O)[C@@H](N)CCCNC(=N)N)C(=O)O.Nc1ccc2ccccc2c1,0.248,1.1990208204658273e-14,25.0,8.0,3.4.14.4,4932.0,-0.6055483191737837,N=C(N)NCCC[C@H](N=C(O)[C@@H](N)CCCNC(=N)N)C(O)=Nc1ccc2ccccc2c1.O,N=C(N)NCCC[C@H](N=C(O)[C@@H](N)CCCNC(=N)N)C(=O)O.Nc1ccc2ccccc2c1,-0.4762535331884355,N=C(N)NCCC[C@H](N=C(O)[C@@H](N)CCCNC(=N)N)C(O)=Nc1ccc2ccccc2c1.O__MSHFFADHDAPLSMLSVKTEYFPQLTDKEQKYAHFMSKASHAGSRVVMRQVSHESEPIFDLILAIHSKLNGKYPEDDITQKQQTGLYLEYVSQFLSNLGNFKSFGDTKFIPRCEVKFFKQLLELAKINPCSSPLTLSPVDVNHEFTSHHLFSTINELIDIGIYHVEEKAALLGFPSQGYTSAYYLGLPVTPEDMALLKEQLFAELAILPENTRINKVGENSFQIWVASENVKNQITETYPSGQITLSNAVTKVEFIFGDHSREMRLVASYLKEAQKFAANDTQKAMLQEYINHFVTGSSQAHKEAQKLWVKDISPVIETNIGFIETYREPSGIIGEFESLVAIQNKERTAKFSSLVNNAEEFISLLPWSKDYEKPIFNPPDFTSLEVLTFTGSGIPAGINIPNYDDVRLKIGFKNVSLGNILSAAAKSSSKHPPSFISQEDRPIFEKYQSDSFEVQVGIHELLGHGSGKLLTEFTDGFNFDKENPPLGLDGKPVSTYYKVGETWGSKFGQLAGPFEECRAEVIAMFLLTNKKILDIFGFHDVESQDKVIYAGYLQMARAGLLALEYWNPKTGKWGQPHMQARFSIMKTFMKHSTDKNFLKLEMNSTNDDFAIKLDKSLIKTAGHECVKDYLKHLHVYKCSGDVEQGSKYFIDRSTVTPDLASLRDIVLSKRLPRRQFIQSNSYIDDNNKVTLKEYDETPQGMLQSFLDREL,./data/raw/alphafold//AF-Q08225-F1-model_v4.pdb,3729,3744,1548,3519
+54,10325,10477,MKYNKLSVAVAAFAFAAVSAQNSNVLKYPETKKVSHTDTYFGTQVSDPYRWLEDDRAEDTKAWVQQEVKFTQDYLAQIPFRDQLKKQLMDIWNYEKISAPFKKGKYTYFSKNDGLQAQSVLYRKDAAGKTEVFLDPNKFSEKGTTSLASVSFNKKGTLVAYSISEGGSDWNKIIILDAETKKQLDETLLDVKFSGISWLGDEGFFYSSYDKPKEGSVLSGMTDKHKVYFHKLGTKQSQDELIIGGDKFPRRYIGAYVTDDQRYLVVSAANATNGNELYIKDLKNKTDFIPIITGFDSNVNVADTDGDTLYLFTDKDAPNKRLVKTTIQNPKAETWKDVIAETSEPLEINTGGGYFFATYMKDAIDQVKQYDKNGKLVRAIKLPGSGNASGFGGEKTEKDLYYSFTNYITPPTIFKYNVTTGNSEVYQKPKVKFNPENYVSEQVFYTSSDGTKIPMMISYKKGLKKDGKNPTILYSYGGFNISLQPAFSVVNAIWMENGGIYAVPNIRGGGEYGKKWHDAGTKMQKKNVFNDFIAAGEYLQKNGYTSKEYMALSGRSNGGLLVGATMTMRPDLAKVAFPGVGVLDMLRYNKFTAGAGWAYDYGTAEDSKEMFEYLKSYSPVHNVKAGTCYPSTMVITSDHDDRVVPAHSFKFGSELQAKQSCKNPILIRIETNAGHGAGRSTEQVVAENADLLSFALYEMGIKSLK,uniprot_search,P27028,C[C@@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)N1CCC[C@H]1C(O)=Nc1ccc2ccccc2c1.O>>C[C@@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)N1CCC[C@H]1C(=O)O.Nc1ccc2ccccc2c1,38.0,1.0908644419694255e-14,37.0,7.0,3.4.21.26,238.0,1.57978359661681,C[C@@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)N1CCC[C@H]1C(O)=Nc1ccc2ccccc2c1.O,C[C@@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)N1CCC[C@H]1C(=O)O.Nc1ccc2ccccc2c1,1.57978359661681,C[C@@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)N1CCC[C@H]1C(O)=Nc1ccc2ccccc2c1.O__MKYNKLSVAVAAFAFAAVSAQNSNVLKYPETKKVSHTDTYFGTQVSDPYRWLEDDRAEDTKAWVQQEVKFTQDYLAQIPFRDQLKKQLMDIWNYEKISAPFKKGKYTYFSKNDGLQAQSVLYRKDAAGKTEVFLDPNKFSEKGTTSLASVSFNKKGTLVAYSISEGGSDWNKIIILDAETKKQLDETLLDVKFSGISWLGDEGFFYSSYDKPKEGSVLSGMTDKHKVYFHKLGTKQSQDELIIGGDKFPRRYIGAYVTDDQRYLVVSAANATNGNELYIKDLKNKTDFIPIITGFDSNVNVADTDGDTLYLFTDKDAPNKRLVKTTIQNPKAETWKDVIAETSEPLEINTGGGYFFATYMKDAIDQVKQYDKNGKLVRAIKLPGSGNASGFGGEKTEKDLYYSFTNYITPPTIFKYNVTTGNSEVYQKPKVKFNPENYVSEQVFYTSSDGTKIPMMISYKKGLKKDGKNPTILYSYGGFNISLQPAFSVVNAIWMENGGIYAVPNIRGGGEYGKKWHDAGTKMQKKNVFNDFIAAGEYLQKNGYTSKEYMALSGRSNGGLLVGATMTMRPDLAKVAFPGVGVLDMLRYNKFTAGAGWAYDYGTAEDSKEMFEYLKSYSPVHNVKAGTCYPSTMVITSDHDDRVVPAHSFKFGSELQAKQSCKNPILIRIETNAGHGAGRSTEQVVAENADLLSFALYEMGIKSLK,./data/raw/alphafold//AF-P27028-F1-model_v4.pdb,243,1552,3135,1904
+55,1416,1444,MVWLANPERYGQMQYRYCGKSGLRLPALSLGLWHNFGHVNALESQRAILRKAFDLGITHFDLANNYGPPPGSAEENFGRLLREDFAAYRDELIISTKAGYDMWPGPYGSGGSRKYLLASLDQSLKRMGLEYVDIFYSHRVDENTPMEETASALAHAVQSGKALYVGISSYSPERTQKMVELLREWKIPLLIHQPSYNLLNRWVDKSGLLDTLQNNGVGCIAFTPLAQGLLTGKYLNGIPQDSRMHREGNKVRGLTPKMLTEANLNSLRLLNEMAQQRGQSMAQMALSWLLKDDRVTSVLIGASRAEQLEENVQALNNLTFSTKELAQIDQHIADGELNLWQASSDK,sabio,Q46851,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)c1,39660.0,6.94062228152616e-15,25.0,7.0,1.1.1.-,562.0,4.598352709869284,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)c1,4.598352709869284,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]__MVWLANPERYGQMQYRYCGKSGLRLPALSLGLWHNFGHVNALESQRAILRKAFDLGITHFDLANNYGPPPGSAEENFGRLLREDFAAYRDELIISTKAGYDMWPGPYGSGGSRKYLLASLDQSLKRMGLEYVDIFYSHRVDENTPMEETASALAHAVQSGKALYVGISSYSPERTQKMVELLREWKIPLLIHQPSYNLLNRWVDKSGLLDTLQNNGVGCIAFTPLAQGLLTGKYLNGIPQDSRMHREGNKVRGLTPKMLTEANLNSLRLLNEMAQQRGQSMAQMALSWLLKDDRVTSVLIGASRAEQLEENVQALNNLTFSTKELAQIDQHIADGELNLWQASSDK,./data/raw/alphafold//AF-Q46851-F1-model_v4.pdb,1335,822,612,899
+56,17995,18249,MIQSVRIKNFKNFKNTKIDGFTKLNIITGQNNAGKSNLLEALYYLVGKSMHPCTNVLEIYDNIRKEPLTSESKSLMFYGLDTKEEIQIVTTLDNNQTLDLQIKFIASENQKVIESQIIPTAEQTQMSSQLNFTLKKNNEEIYNDHLNIAKVPNFPPIPNQSGYNRQFKNFDSNQLQKLLPFESAVIIPSDVVYRQAHMIQAVSKICSNNQLEEELNKHLNQFDNNIQAISFNTNNQLKLKVKDIKEKVPLSVFGDGLKKYLHIVSAFMADNAKTIYIDEVENGLHFSRMRLLLKNTIDFINNNKDGNLQVFMTTHSQEFIEILDQVIREKDFAHQTKLFCLKQDDQYVIPRTYYGENLEYYFENEENLFG,sabio,O25711,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,34.2,1.0493601366967451e-14,30.0,6.0,3.6.1.3,210.0,1.534026106056135,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,1.534026106056135,Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1.O__MIQSVRIKNFKNFKNTKIDGFTKLNIITGQNNAGKSNLLEALYYLVGKSMHPCTNVLEIYDNIRKEPLTSESKSLMFYGLDTKEEIQIVTTLDNNQTLDLQIKFIASENQKVIESQIIPTAEQTQMSSQLNFTLKKNNEEIYNDHLNIAKVPNFPPIPNQSGYNRQFKNFDSNQLQKLLPFESAVIIPSDVVYRQAHMIQAVSKICSNNQLEEELNKHLNQFDNNIQAISFNTNNQLKLKVKDIKEKVPLSVFGDGLKKYLHIVSAFMADNAKTIYIDEVENGLHFSRMRLLLKNTIDFINNNKDGNLQVFMTTHSQEFIEILDQVIREKDFAHQTKLFCLKQDDQYVIPRTYYGENLEYYFENEENLFG,./data/raw/alphafold//AF-O25711-F1-model_v4.pdb,2868,2455,2734,5577
+57,1561,1589,MNTQQLAKLRSIVPEMRRVRHIHFVGIGGAGMGGIAEVLANEGYQISGSDLAPNPVTQQLMNLGATIYFNHRPENVRDASVVVVSSAISADNPEIVAAHEARIPVIRRAEMLAELMRFRHGIAIAGTHGKTTTTAMVSSIYAEAGLDPTFVNGGLVKAAGVHARLGHGRYLIAEADESDASFLHLQPMVAIVTNIEADHMDTYQGDFENLKQTFINFLHNLPFYGRAVMCVDDPVIRELLPRVGRQTTTYGFSEDADVRVEDYQQIGPQGHFTLLRQDKEPMRVTLNAPGRHNALNAAAAVAVATEEGIDDEAILRALESFQGTGRRFDFLGEFPLEPVNGKSGTAMLVDDYGHHPTEVDATIKAARAGWPDKNLVMLFQPHRFTRTRDLYDDFANVLTQVDTLLMLEVYPAGEAPIPGADSRSLCRTIRGRGKIDPILVPDPARVAEMLAPVLTGNDLILVQGAGNIGKIARSLAEIKLKPQTPEEEQHD,sabio,P17952,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)O.NC(CCl)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,11.1,42.74500962786769,37.0,,6.3.2.8,562.0,1.0453229787866574,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)O.NC(CCl)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,1.0453229787866574,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)O.NC(CCl)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MNTQQLAKLRSIVPEMRRVRHIHFVGIGGAGMGGIAEVLANEGYQISGSDLAPNPVTQQLMNLGATIYFNHRPENVRDASVVVVSSAISADNPEIVAAHEARIPVIRRAEMLAELMRFRHGIAIAGTHGKTTTTAMVSSIYAEAGLDPTFVNGGLVKAAGVHARLGHGRYLIAEADESDASFLHLQPMVAIVTNIEADHMDTYQGDFENLKQTFINFLHNLPFYGRAVMCVDDPVIRELLPRVGRQTTTYGFSEDADVRVEDYQQIGPQGHFTLLRQDKEPMRVTLNAPGRHNALNAAAAVAVATEEGIDDEAILRALESFQGTGRRFDFLGEFPLEPVNGKSGTAMLVDDYGHHPTEVDATIKAARAGWPDKNLVMLFQPHRFTRTRDLYDDFANVLTQVDTLLMLEVYPAGEAPIPGADSRSLCRTIRGRGKIDPILVPDPARVAEMLAPVLTGNDLILVQGAGNIGKIARSLAEIKLKPQTPEEEQHD,./data/raw/alphafold//AF-P17952-F1-model_v4.pdb,1404,912,711,1004
+58,2680,2715,MEITSSAMLKTTTTPPHPLAGEKVPLSAFDRAAFDVFVPLVFAYRAPAPSSEAVKEGLRVAVAAYPLVSGRIAVDGQGRRRRRRVLHVNNEGVLVLDATVEVDLDAVLAANVATDLYPALPEHSFGAALLQVQLTRFGCGGLVVGLIGHHHVFDGHSMSTFCATWARAVRDSEAFIVPSPSLDRAITGVPRSPPAPVFDHRSIEFKVGNKSSDSSGAAAAAAVEKIANIGVRFTAKFVAELKARVGGRCSTFECVLAHAWKKITAARGLKPEEFTRVRVAVNCRRRANPPAPADLFGNMVLWAFPRLQVRRLLSSSYRDVVGAIRAAVARVDAEYIQSFVDYVEVADARGEELAATAAEPGETLCPDLEVDSWLGFRFHEMDLGTGPPAAVLSPDLPIEGLMILVPVGGDGGGVDLFVALADDHAQAFEQICYSLEEHAMIHSHL,sabio,Q2R0K3,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)c1ccccc1.NCCc1c[nH]c2ccccc12>>CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS.O=C(NCCc1c[nH]c2ccccc12)c1ccccc1,2.68,0.0,37.0,7.4,2.3.1.-,4530.0,0.4281347940287888,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)c1ccccc1.NCCc1c[nH]c2ccccc12,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS.O=C(NCCc1c[nH]c2ccccc12)c1ccccc1,0.4281347940287888,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)c1ccccc1.NCCc1c[nH]c2ccccc12__MEITSSAMLKTTTTPPHPLAGEKVPLSAFDRAAFDVFVPLVFAYRAPAPSSEAVKEGLRVAVAAYPLVSGRIAVDGQGRRRRRRVLHVNNEGVLVLDATVEVDLDAVLAANVATDLYPALPEHSFGAALLQVQLTRFGCGGLVVGLIGHHHVFDGHSMSTFCATWARAVRDSEAFIVPSPSLDRAITGVPRSPPAPVFDHRSIEFKVGNKSSDSSGAAAAAAVEKIANIGVRFTAKFVAELKARVGGRCSTFECVLAHAWKKITAARGLKPEEFTRVRVAVNCRRRANPPAPADLFGNMVLWAFPRLQVRRLLSSSYRDVVGAIRAAVARVDAEYIQSFVDYVEVADARGEELAATAAEPGETLCPDLEVDSWLGFRFHEMDLGTGPPAAVLSPDLPIEGLMILVPVGGDGGGVDLFVALADDHAQAFEQICYSLEEHAMIHSHL,./data/raw/alphafold//AF-Q2R0K3-F1-model_v4.pdb,1633,1235,1714,1444
+59,505,522,MIILKLGGSVITRKDSEEPAIDRDNLERIASEIGNASPSSLMIVHGAGSFGHPFAGEYRIGSEIENEEDLRRRRFGFALTQNWVKKLNSHVCDALLAEGIPAVSMQPSAFIRAHAGRISHADISLIRSYLEEGMVPVVYGDVVLDSDRRLKFSVISGDQLINHFSLRLMPERVILGTDVDGVYTRNPKKHPDARLLDVIGSLDDLESLDGTLNTDVTGGMVGKIRELLLLAEKGVESEIINAAVPGNIERALLGEEVRGTRITGKH,brenda,O26153,C=C(C)CCOP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>C=C(C)CCOP(=O)(O)OP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,27.5,0.0,37.0,7.5,2.7.4.26,145262.0,1.4393326938302626,C=C(C)CCOP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,C=C(C)CCOP(=O)(O)OP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,1.4393326938302626,C=C(C)CCOP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MIILKLGGSVITRKDSEEPAIDRDNLERIASEIGNASPSSLMIVHGAGSFGHPFAGEYRIGSEIENEEDLRRRRFGFALTQNWVKKLNSHVCDALLAEGIPAVSMQPSAFIRAHAGRISHADISLIRSYLEEGMVPVVYGDVVLDSDRRLKFSVISGDQLINHFSLRLMPERVILGTDVDGVYTRNPKKHPDARLLDVIGSLDDLESLDGTLNTDVTGGMVGKIRELLLLAEKGVESEIINAAVPGNIERALLGEEVRGTRITGKH,./data/raw/alphafold//AF-O26153-F1-model_v4.pdb,1089,659,341,385
+60,21493,21817,MFADHVFHVVDTHTEGEPTRIVLSGVNVKGEDIIEKREYFKEHYDWIRTALLHEPRGHSDQFGAVLVPSDIADFGVIYMDTSGYLDMCGHATMGVATVLVELGIIEKKEPYTTVKLETPAGLVEAKAKVKGGVVKEVTVVDVPSFYVGEFVIEYPGRGKIKVDVAFGGNFYVIADARDLGLRVRREYIKELIPTALKLIKVANEQIKVQHPRKGVQNRINLAMLTDEPEREDSDGKNVVIWGEGSVDRSPCGTGSASRVATLYSKGILKEGDIFVHESILGTQFRIKIVGTTKIGEYTAIIPEITGSAYITKISQDIISKNDPLWKGFLLR,brenda,H3ZMH5,O=C(O)[C@@H]1C[C@@H](O)CN1>>O=C(O)[C@H]1C[C@@H](O)CN1,12.13,0.0,50.0,8.0,5.1.1.8,2265.0,1.083860800866573,O=C(O)[C@@H]1C[C@@H](O)CN1,O=C(O)[C@H]1C[C@@H](O)CN1,1.083860800866573,O=C(O)[C@@H]1C[C@@H](O)CN1__MFADHVFHVVDTHTEGEPTRIVLSGVNVKGEDIIEKREYFKEHYDWIRTALLHEPRGHSDQFGAVLVPSDIADFGVIYMDTSGYLDMCGHATMGVATVLVELGIIEKKEPYTTVKLETPAGLVEAKAKVKGGVVKEVTVVDVPSFYVGEFVIEYPGRGKIKVDVAFGGNFYVIADARDLGLRVRREYIKELIPTALKLIKVANEQIKVQHPRKGVQNRINLAMLTDEPEREDSDGKNVVIWGEGSVDRSPCGTGSASRVATLYSKGILKEGDIFVHESILGTQFRIKIVGTTKIGEYTAIIPEITGSAYITKISQDIISKNDPLWKGFLLR,./data/raw/alphafold//AF-H3ZMH5-F1-model_v4.pdb,664,45,5755,6657
+61,7588,7710,MVLISEDSRELLQAHVELWNQTYSFMKSVALAVALDLHIADAIHRRGGAATLSQILGEIGVRPCKLPGLHRIMRVLTVSGTFTIVQPSAETMSSESDGREPVYKLTTASSLLVSSESSATASLSPMLNHVLSPFRDSPLSMGLTAWFRHDEDEQAPGMCPFTLMYGTTLWEVCRRDDAINALFNNAMAADSNFLMQILLKEFSEVFLGIDSLVDVAGGVGGATMAIAAAFPCLKCTVLDLPHVVAKAPSSSIGNVQFVGGDMFESIPPANVVLLKWILHDWSNDECIKILKNCKQAIPSRDAGGKIIIIDVVVGSDSSDTKLLETQVIYDLHLMKIGGVERDEQEWKKIFLEAGFKDYKIMPILGLRSIIELYP,sabio,A8QW53,CCCCCc1cc(O)cc(O)c1.C[S+](CCC(N)C(=O)O)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O>>CCCCCc1cc(O)cc(OC)c1.Nc1ncnc2c1ncn2C1OC(CSCCC(N)C(=O)O)C(O)C1O,0.00047,0.0869421213877749,30.0,,2.1.1.n7,4558.0,-3.3279021420642825,CCCCCc1cc(O)cc(O)c1.C[S+](CCC(N)C(=O)O)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O,CCCCCc1cc(O)cc(OC)c1.Nc1ncnc2c1ncn2C1OC(CSCCC(N)C(=O)O)C(O)C1O,-3.3279021420642825,CCCCCc1cc(O)cc(O)c1.C[S+](CCC(N)C(=O)O)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O__MVLISEDSRELLQAHVELWNQTYSFMKSVALAVALDLHIADAIHRRGGAATLSQILGEIGVRPCKLPGLHRIMRVLTVSGTFTIVQPSAETMSSESDGREPVYKLTTASSLLVSSESSATASLSPMLNHVLSPFRDSPLSMGLTAWFRHDEDEQAPGMCPFTLMYGTTLWEVCRRDDAINALFNNAMAADSNFLMQILLKEFSEVFLGIDSLVDVAGGVGGATMAIAAAFPCLKCTVLDLPHVVAKAPSSSIGNVQFVGGDMFESIPPANVVLLKWILHDWSNDECIKILKNCKQAIPSRDAGGKIIIIDVVVGSDSSDTKLLETQVIYDLHLMKIGGVERDEQEWKKIFLEAGFKDYKIMPILGLRSIIELYP,./data/raw/alphafold//AF-A8QW53-F1-model_v4.pdb,3512,2186,3868,2735
+62,12662,12833,MKQASAIPQPKTYGPLKNLPHLEKEQLSQSLWRIADELGPIFRFDFPGVSSVFVSGHNLVAEVCDEKRFDKNLGKGLQKVREFGGDGLFTSWTHEPNWQKAHRILLPSFSQKAMKGYHSMMLDIATQLIQKWSRLNPNEEIDVADDMTRLTLDTIGLCGFNYRFNSFYRDSQHPFITSMLRALKEAMNQSKRLGLQDKMMVKTKLQFQKDIEVMNSLVDRMIAERKANPDENIKDLLSLMLYAKDPVTGETLDDENIRYQIITFLIAGHETTSGLLSFAIYCLLTHPEKLKKAQEEADRVLTDDTPEYKQIQQLKYIRMVLNETLRLYPTAPAFSLYAKEDTVLGGEYPISKGQPVTVLIPKLHRDQNAWGPDAEDFRPERFEDPSSIPHHAYKPFGNGQRACIGMQFALQEATMVLGLVLKHFELINHTGYELKIKEALTIKPDDFKITVKPRKTAAINVQRKEQADIKAETKPKETKPKHGTPLLVLFGSNLGTAEGIAGELAAQGRQMGFTAETAPLDDYIGKLPEEGAVVIVTASYNGAPPDNAAGFVEWLKELEEGQLKGVSYAVFGCGNRSWASTYQRIPRLIDDMMKAKGASRLTAIGEGDAADDFESHRESWENRFWKETMDAFDINEIAQKEDRPSLSITFLSEATETPVAKAYGAFEGIVLENRELQTAASTRSTRHIELEIPAGKTYKEGDHIGILPKNSRELVQRVLSRFGLQSNHVIKVSGSAHMAHLPMDRPIKVVDLLSSYVELQEPASRLQLRELASYTVCPPHQKELEQLVSDDGIYKEQVLAKRLTMLDFLEDYPACEMPFERFLALLPSLKPRYYSISSSPKVHANIVSMTVGVVKASAWSGRGEYRGVASNYLAELNTGDAAACFIRTPQSGFQMPNDPETPMIMVGPGTGIAPFRGFIQARSVLKKEGSTLGEALLYFGCRRPDHDDLYREELDQAEQDGLVTIRRCYSRVENEPKGYVQHLLKQDTQKLMTLIEKGAHIYVCGDGSQMAPDVERTLRLAYEAEKAASQEESAVWLQKLQDQRRYVKDVWTGM,sabio,O08336,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.[H]>>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)c1,1000000.0,0.1052326079104059,30.0,7.4,1.14.14.1,1423.0,6.0,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.[H],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)c1,6.0,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.[H]__MKQASAIPQPKTYGPLKNLPHLEKEQLSQSLWRIADELGPIFRFDFPGVSSVFVSGHNLVAEVCDEKRFDKNLGKGLQKVREFGGDGLFTSWTHEPNWQKAHRILLPSFSQKAMKGYHSMMLDIATQLIQKWSRLNPNEEIDVADDMTRLTLDTIGLCGFNYRFNSFYRDSQHPFITSMLRALKEAMNQSKRLGLQDKMMVKTKLQFQKDIEVMNSLVDRMIAERKANPDENIKDLLSLMLYAKDPVTGETLDDENIRYQIITFLIAGHETTSGLLSFAIYCLLTHPEKLKKAQEEADRVLTDDTPEYKQIQQLKYIRMVLNETLRLYPTAPAFSLYAKEDTVLGGEYPISKGQPVTVLIPKLHRDQNAWGPDAEDFRPERFEDPSSIPHHAYKPFGNGQRACIGMQFALQEATMVLGLVLKHFELINHTGYELKIKEALTIKPDDFKITVKPRKTAAINVQRKEQADIKAETKPKETKPKHGTPLLVLFGSNLGTAEGIAGELAAQGRQMGFTAETAPLDDYIGKLPEEGAVVIVTASYNGAPPDNAAGFVEWLKELEEGQLKGVSYAVFGCGNRSWASTYQRIPRLIDDMMKAKGASRLTAIGEGDAADDFESHRESWENRFWKETMDAFDINEIAQKEDRPSLSITFLSEATETPVAKAYGAFEGIVLENRELQTAASTRSTRHIELEIPAGKTYKEGDHIGILPKNSRELVQRVLSRFGLQSNHVIKVSGSAHMAHLPMDRPIKVVDLLSSYVELQEPASRLQLRELASYTVCPPHQKELEQLVSDDGIYKEQVLAKRLTMLDFLEDYPACEMPFERFLALLPSLKPRYYSISSSPKVHANIVSMTVGVVKASAWSGRGEYRGVASNYLAELNTGDAAACFIRTPQSGFQMPNDPETPMIMVGPGTGIAPFRGFIQARSVLKKEGSTLGEALLYFGCRRPDHDDLYREELDQAEQDGLVTIRRCYSRVENEPKGYVQHLLKQDTQKLMTLIEKGAHIYVCGDGSQMAPDVERTLRLAYEAEKAASQEESAVWLQKLQDQRRYVKDVWTGM,./data/raw/alphafold//AF-O08336-F1-model_v4.pdb,1826,1506,3080,1840
+63,21819,22144,MKSIILASALASLAAAQGFTPAEQIDVQASLISDPNKVAGQTFDYIIAGGGLTGLTVAAKLSENPNITVLVIEKGFYESNNGPIIENPNDYGLIFGSSVDQNYLTVPMAINNRTLEVKSGKGLGGSTLINGDSWTGPDKVQIDSWETVLGNTGWNYDALKGYMKEAELARYPTASQIAAGIYFNETCHGFNGTVNAGPRDDGTPYSPLMKALMNTTSAKGVPTQLDFLCGRPRGVSMIYNNLLPDQTRADAAREWLLPNYKRPNLSILTGQVVGKVLFTQTATGPKATGVNFGTNKAINFNVLAKHEVLLAAGSAISPLILEHSGIGLKSVLDQFNITQLVELPVGLNMQDQTTTTVRARAKASSAGQGQAVYFANFTEVFGDYSARATDLLNTKLSQWANETVARGGFNNATALLIQYENYRNWLLNEDVAYVELFLDTNGKMNFDLWDLIPFTRGSTHIAHADPYLQSFSNNPMFLLNELDLLGQAAGSMLAREIQNSGELANYFDGEDIPGANLLPYNATLDGWVGYVKQNFRANWHAVGTCSMMSRELGGVVDPTAKVYGTQGLRVIDGSIPPTQVSSHVMTVFYGMALKIADAVLADYKP,uniprot_search,A0A7L7T1A0,O=C1C=CC(=O)C=C1.OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O>>O=C1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.Oc1ccc(O)cc1,741.0,0.0,25.0,7.0,1.1.3.4,5081.0,2.8698182079793284,O=C1C=CC(=O)C=C1.OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O,O=C1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.Oc1ccc(O)cc1,2.8698182079793284,O=C1C=CC(=O)C=C1.OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O__MKSIILASALASLAAAQGFTPAEQIDVQASLISDPNKVAGQTFDYIIAGGGLTGLTVAAKLSENPNITVLVIEKGFYESNNGPIIENPNDYGLIFGSSVDQNYLTVPMAINNRTLEVKSGKGLGGSTLINGDSWTGPDKVQIDSWETVLGNTGWNYDALKGYMKEAELARYPTASQIAAGIYFNETCHGFNGTVNAGPRDDGTPYSPLMKALMNTTSAKGVPTQLDFLCGRPRGVSMIYNNLLPDQTRADAAREWLLPNYKRPNLSILTGQVVGKVLFTQTATGPKATGVNFGTNKAINFNVLAKHEVLLAAGSAISPLILEHSGIGLKSVLDQFNITQLVELPVGLNMQDQTTTTVRARAKASSAGQGQAVYFANFTEVFGDYSARATDLLNTKLSQWANETVARGGFNNATALLIQYENYRNWLLNEDVAYVELFLDTNGKMNFDLWDLIPFTRGSTHIAHADPYLQSFSNNPMFLLNELDLLGQAAGSMLAREIQNSGELANYFDGEDIPGANLLPYNATLDGWVGYVKQNFRANWHAVGTCSMMSRELGGVVDPTAKVYGTQGLRVIDGSIPPTQVSSHVMTVFYGMALKIADAVLADYKP,./data/raw/alphafold//AF-A0A7L7T1A0-F1-model_v4.pdb,715,109,5823,6730
+64,9568,9714,MTDTIFDYVIVGGGTAGSVLANRLSARPENRVLLIEAGIDTPENNIPPEIHDGLRPWLPRLSGDKFFWPNLTIHRAAEHPGITREPQFYEQGRLLGGGSSVNMVVSNRGLPRDYDEWQALGADGWDWQGVLPYFIKTERDADYGDDPLHGNAGPIPIGRVDSRHWSDFTVAATQALEAAGLPNIHDQNARFDDGYFPPAFTLKGEERFSAARGYLDASVRVRPNLSLWTESRVLKLLTTGNAITGVSVLRGRETLQVQAREVILTAGALQSPAILLRTGIGPAADLHALGIPVLADRPGVGRNLWEHSSIGVVAPLTEQARADASTGKAGSRHQLGIRASSGVDPATPSDLFLHIGADPVSGLASAVFWVNKPSSTGWLKLKDADPFSYPDVDFNLLSDPRDLGRLKAGLRLITHYFAAPSLAKYGLALALSRFAAPQPGGPLLNDLLQDEAALERYLRTNVGGVWHASGTARIGRADDSQAVVDKAGRVYGVTGLRVADASIMPTVPTANTNLPTLMLAEKIADAILTQA,brenda,E4QP00,COc1cc(CO)ccc1O.O=O>>COc1cc(C=O)ccc1O.OO,21.0,0.0,25.0,7.5,1.1.3.47,887061.0,1.3222192947339193,COc1cc(CO)ccc1O.O=O,COc1cc(C=O)ccc1O.OO,1.3222192947339193,COc1cc(CO)ccc1O.O=O__MTDTIFDYVIVGGGTAGSVLANRLSARPENRVLLIEAGIDTPENNIPPEIHDGLRPWLPRLSGDKFFWPNLTIHRAAEHPGITREPQFYEQGRLLGGGSSVNMVVSNRGLPRDYDEWQALGADGWDWQGVLPYFIKTERDADYGDDPLHGNAGPIPIGRVDSRHWSDFTVAATQALEAAGLPNIHDQNARFDDGYFPPAFTLKGEERFSAARGYLDASVRVRPNLSLWTESRVLKLLTTGNAITGVSVLRGRETLQVQAREVILTAGALQSPAILLRTGIGPAADLHALGIPVLADRPGVGRNLWEHSSIGVVAPLTEQARADASTGKAGSRHQLGIRASSGVDPATPSDLFLHIGADPVSGLASAVFWVNKPSSTGWLKLKDADPFSYPDVDFNLLSDPRDLGRLKAGLRLITHYFAAPSLAKYGLALALSRFAAPQPGGPLLNDLLQDEAALERYLRTNVGGVWHASGTARIGRADDSQAVVDKAGRVYGVTGLRVADASIMPTVPTANTNLPTLMLAEKIADAILTQA,./data/raw/alphafold//AF-E4QP00-F1-model_v4.pdb,3522,3457,1202,3129
+65,7568,7690,MVAKATKIAIDAGFRHIDSAYFYQNEEEVGLAIRSKVADGTVRREDIFYTSKLPCTCHRPELVQPCLEQSLRKLQLDYVDLYLIHCPVSMKPGNDLIPTDENGKLLFDTVDLCDTWEAMEKCKDSGLAKSIGVFNFNRRQLEMILNKPGLRYKPVCNQVECHPYLNQSKLLDYCKSKDIVLVAYGALGSQRCKNWIEENAPYLLEDPTLCAMAERHKQTPALISLRYLLQRGIVIVTKSFNEKRIKENLKVFEFHLPAEDMAVIDRLNRNYRYATARIISAHPNYPFLDEY,brenda,Q9D5U2,CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)[C@@H](O)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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]>>CCCCC[C@H](O)/C=C/[C@H]1C(=O)C[C@H](O)[C@@H]1C/C=C\CCCC(=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)c1,0.055,0.1833720816005727,24.0,8.0,1.1.1.188,10090.0,-1.259637310505756,CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)[C@@H](O)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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],CCCCC[C@H](O)/C=C/[C@H]1C(=O)C[C@H](O)[C@@H]1C/C=C\CCCC(=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,-1.259637310505756,CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)[C@@H](O)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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]__MVAKATKIAIDAGFRHIDSAYFYQNEEEVGLAIRSKVADGTVRREDIFYTSKLPCTCHRPELVQPCLEQSLRKLQLDYVDLYLIHCPVSMKPGNDLIPTDENGKLLFDTVDLCDTWEAMEKCKDSGLAKSIGVFNFNRRQLEMILNKPGLRYKPVCNQVECHPYLNQSKLLDYCKSKDIVLVAYGALGSQRCKNWIEENAPYLLEDPTLCAMAERHKQTPALISLRYLLQRGIVIVTKSFNEKRIKENLKVFEFHLPAEDMAVIDRLNRNYRYATARIISAHPNYPFLDEY,./data/raw/alphafold//AF-Q9D5U2-F1-model_v4.pdb,1329,1150,3874,2741
+66,8412,8543,MTDWSRRRFLQTGAALGIAGTLPQTTTEVSAASPTLEKFVQPLPIPSVREPDGQRDGADAYEIAVTEFTQQLHPDLPETTVWGFDGSYPGPTIEADAGSPVHVRFDNSGLPSEHLFPVDDRLGGTTAENHPGYDGPVPEVRTVTHFHGLELDPANDGQSDMWTSPGGVEGPRFDSAWQELPMEQGRTTSTYHDHTLGITRLNAYAGLLGLYSITTDAERELGLPSGDYDIPLLLQDKEFNDDGSLHYPEEFVSAFLGDTAVVNGAVWPYVEVEPRRYRFRILNGANHRSFDLQLESESGSGVPTMYQFAPGHGFLESVVPIGPNGDLDSLLLTPFERGELVVDFSDHAGETLTLANGADMGPELTDLVEFRVSDPSTPPEDASADPTSLSLPTPASYDESDARVTREMTLGTEVRNGLITHTLNGHVFGDEDAPVYPQLGATEIWELQNESGGRHPIHLHLVTFRVIGRGPDGTQPPDPNELGPKDTVRVDPGERVRILVTFEGYTGQFPWHCHMLEHEDNKMMIPFVVENPVADYANEENVVDATGLTDAVGDWRNETLETEVLLEVIDQWRSGDEVA,sabio,D4GPK6,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,9.9,1.4837780463171737,45.0,6.0,1.10.3.2,2246.0,0.99563519459755,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,1.0,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O__MTDWSRRRFLQTGAALGIAGTLPQTTTEVSAASPTLEKFVQPLPIPSVREPDGQRDGADAYEIAVTEFTQQLHPDLPETTVWGFDGSYPGPTIEADAGSPVHVRFDNSGLPSEHLFPVDDRLGGTTAENHPGYDGPVPEVRTVTHFHGLELDPANDGQSDMWTSPGGVEGPRFDSAWQELPMEQGRTTSTYHDHTLGITRLNAYAGLLGLYSITTDAERELGLPSGDYDIPLLLQDKEFNDDGSLHYPEEFVSAFLGDTAVVNGAVWPYVEVEPRRYRFRILNGANHRSFDLQLESESGSGVPTMYQFAPGHGFLESVVPIGPNGDLDSLLLTPFERGELVVDFSDHAGETLTLANGADMGPELTDLVEFRVSDPSTPPEDASADPTSLSLPTPASYDESDARVTREMTLGTEVRNGLITHTLNGHVFGDEDAPVYPQLGATEIWELQNESGGRHPIHLHLVTFRVIGRGPDGTQPPDPNELGPKDTVRVDPGERVRILVTFEGYTGQFPWHCHMLEHEDNKMMIPFVVENPVADYANEENVVDATGLTDAVGDWRNETLETEVLLEVIDQWRSGDEVA,./data/raw/alphafold//AF-D4GPK6-F1-model_v4.pdb,3403,816,522,596
+67,22280,22614,MALKNKVQLITYPDSLGGNLKTLNDVLEKYFSDVFGGVHILPPFPSSGDRGFAPITYSEIEPKFGTWYDIKKMAENFDILLDLMVNHVSRRSIYFQDFLKKGRKSEYADMFITLDKLWKDGKPVKGDIEKMFLRRTLPYSTFKIEETGEEEKVWTTFGKTDPSEQIDLDVNSHLVREFLLEVFKTFSNFGVKIVRLDAVGYVIKKIGTSCFFVEPEIYEFLDWAKGQAASYGIELLLEVHSQFEVQYKLAERGFLIYDFILPFTVLYTLINKSNEMLYHYLKNRPINQFTMLDCHDGIPVKPDLDGLIDTKKAKEVVDICVQRGANLSLIYGDKYKSEDGFDVHQINCTYYSALNCDDDAYLAARAIQFFTPGIPQVYYVGLLAGVNDFEAVKKTKEGREINRHNYGLKEIEESVQKNVVQRLLKLIRFRNEYEAFNGEFFIEDCRKDEIRLTWKKDDKRCSLFIDLKTYKTTIDYINENGEEVKYLV,sabio,D9TT09,O=P(O)(O)O.OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O>>O=P(O)(O)OC1OC(CO)C(O)C(O)C1O.OCC1OC(O)(CO)C(O)C1O,66.2,0.0,55.0,6.5,2.4.1.329,1517.0,1.8208579894397,O=P(O)(O)O.OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O,O=P(O)(O)OC1OC(CO)C(O)C(O)C1O.OCC1OC(O)(CO)C(O)C1O,1.8208579894397,O=P(O)(O)O.OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O__MALKNKVQLITYPDSLGGNLKTLNDVLEKYFSDVFGGVHILPPFPSSGDRGFAPITYSEIEPKFGTWYDIKKMAENFDILLDLMVNHVSRRSIYFQDFLKKGRKSEYADMFITLDKLWKDGKPVKGDIEKMFLRRTLPYSTFKIEETGEEEKVWTTFGKTDPSEQIDLDVNSHLVREFLLEVFKTFSNFGVKIVRLDAVGYVIKKIGTSCFFVEPEIYEFLDWAKGQAASYGIELLLEVHSQFEVQYKLAERGFLIYDFILPFTVLYTLINKSNEMLYHYLKNRPINQFTMLDCHDGIPVKPDLDGLIDTKKAKEVVDICVQRGANLSLIYGDKYKSEDGFDVHQINCTYYSALNCDDDAYLAARAIQFFTPGIPQVYYVGLLAGVNDFEAVKKTKEGREINRHNYGLKEIEESVQKNVVQRLLKLIRFRNEYEAFNGEFFIEDCRKDEIRLTWKKDDKRCSLFIDLKTYKTTIDYINENGEEVKYLV,./data/raw/alphafold//AF-D9TT09-F1-model_v4.pdb,763,307,5944,6836
+68,13050,13225,MTAQYKQTNTNGLTARNLNVAVVGGGLVGSLFALHLGKKGHTVDLYEYREDIRTAELVIGRSINLALSARGRKALAEVGLEDALLQHGIPMKGRMLHDLKGNRKIVPYDANTNQCIYSVGRKHLNEVLLDAAEKYPNIHLYFNKKLQSANLDEGEMSFIDPTTKESTHTKADLIVGCDGAYSAVRKEIVKRPGYDYSQTYIEHGYLELCIPPTKDGDFAMPHNYLHIWPRGKFMMIALPNQDRTWTVTLFMPFTNFNSIKCDGDLLKFFRTYFPDAIDLIGRERLVKDFFKTRPQSLVMIKCKPYNVGGKAVIIGDAAHAMVPFYGQGMNAGFEDCTVLTELFNQHGSDVDRILAEFSDTRWEDAHSICDLAMYNYVEMRDLVTKRSYLFRKKLDELLYWMLPNTWVPLYNSVSFSHMRYSKCIANRKWQDKILTRVLYCCSITAVAAAGYFGYKYGNMDLVQHYSSSVLQLLKLK,brenda,Q86PM2,N=C(O)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.Nc1ccccc1C(=O)C[C@H](N)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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.Nc1c(O)cccc1C(=O)C[C@H](N)C(=O)O.O,1.88,6.266023074069771e-15,37.0,7.5,1.14.13.9,7159.0,0.2741578492636798,N=C(O)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.Nc1ccccc1C(=O)C[C@H](N)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](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.Nc1c(O)cccc1C(=O)C[C@H](N)C(=O)O.O,0.2741578492636798,N=C(O)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.Nc1ccccc1C(=O)C[C@H](N)C(=O)O.O=O.[H+]__MTAQYKQTNTNGLTARNLNVAVVGGGLVGSLFALHLGKKGHTVDLYEYREDIRTAELVIGRSINLALSARGRKALAEVGLEDALLQHGIPMKGRMLHDLKGNRKIVPYDANTNQCIYSVGRKHLNEVLLDAAEKYPNIHLYFNKKLQSANLDEGEMSFIDPTTKESTHTKADLIVGCDGAYSAVRKEIVKRPGYDYSQTYIEHGYLELCIPPTKDGDFAMPHNYLHIWPRGKFMMIALPNQDRTWTVTLFMPFTNFNSIKCDGDLLKFFRTYFPDAIDLIGRERLVKDFFKTRPQSLVMIKCKPYNVGGKAVIIGDAAHAMVPFYGQGMNAGFEDCTVLTELFNQHGSDVDRILAEFSDTRWEDAHSICDLAMYNYVEMRDLVTKRSYLFRKKLDELLYWMLPNTWVPLYNSVSFSHMRYSKCIANRKWQDKILTRVLYCCSITAVAAAGYFGYKYGNMDLVQHYSSSVLQLLKLK,./data/raw/alphafold//AF-Q86PM2-F1-model_v4.pdb,2219,4456,4361,4247
+69,5527,5613,MLLFMFSIISFGNENQFMKEIFERKGLNGTFVVYDLKNDKIDYYNLDRANERFYPASSFKIFNTLIGLENGIVKNVDEMFYYYDGSKVFLDSWAKDSNLRYAIKVSQVPAYKKLARELGKERMQEGLNKLNYGNKEIGSEIDKFWLEGPLKISAMEQVKLLNLLSQSKLPFKLENQEQVKDITILEKKDDFILHGKTGWATDNIVVPIGWFVGWIETSDNIYSFAINLDISDSKFLPKREEIVREYFKNINVIK,brenda,Q6XL56,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O>>,45.0,99.72857581013334,37.0,7.5,3.5.2.6,851.0,1.6532125137753435,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O,,1.6532125137753435,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O__MLLFMFSIISFGNENQFMKEIFERKGLNGTFVVYDLKNDKIDYYNLDRANERFYPASSFKIFNTLIGLENGIVKNVDEMFYYYDGSKVFLDSWAKDSNLRYAIKVSQVPAYKKLARELGKERMQEGLNKLNYGNKEIGSEIDKFWLEGPLKISAMEQVKLLNLLSQSKLPFKLENQEQVKDITILEKKDDFILHGKTGWATDNIVVPIGWFVGWIETSDNIYSFAINLDISDSKFLPKREEIVREYFKNINVIK,./data/raw/alphafold//AF-Q6XL56-F1-model_v4.pdb,1457,989,801,1116
+70,6122,6225,MASVHGTTYELLRRQGIDTVFGNPGSNELPFLKDFPEDFRYILALQEACVVGIADGYAQASRKPAFINLHSAAGTGNAMGALSNAWNSHSPLIVTAGQQTRAMIGVEALLTNVDAANLPRPLVKWSYEPASAAEVPHAMSRAIHMASMAPQGPVYLSVPYDDWDKDADPQSHHLFDRHVSSSVRLNDQDLDILVKALNSASNPAIVLGPDVDAANANADCVMLAERLKAPVWVAPSAPRCPFPTRHPCFRGLMPAGIAAISQLLEGHDVVLVIGAPVFRYHQYDPGQYLKPGTRLISVTCDPLEAARAPMGDAIVADIGAMASALANLVEESSRQLPTAAPEPAKVDQDAGRLHPETVFDTLNDMAPENAIYLNESTSTTAQMWQRLNMRNPGSYYFCAAGGLGFALPAAIGVQLAEPERQVIAVIGDGSANYSISALWTAAQYNIPTIFVIMNNGTYGALRWFAGVLEAENVPGLDVPGIDFRALAKGYGVQALKADNLEQLKGSLQEALSAKGPVLIEVSTVSPVK,brenda,P20906,CCC(=O)C(=O)[O-]>>CCC=O.O=C=O,7.5,0.4937062252044912,30.0,6.0,4.1.1.7,303.0,0.8750612633917001,CCC(=O)C(=O)[O-],CCC=O.O=C=O,0.8750612633917001,CCC(=O)C(=O)[O-]__MASVHGTTYELLRRQGIDTVFGNPGSNELPFLKDFPEDFRYILALQEACVVGIADGYAQASRKPAFINLHSAAGTGNAMGALSNAWNSHSPLIVTAGQQTRAMIGVEALLTNVDAANLPRPLVKWSYEPASAAEVPHAMSRAIHMASMAPQGPVYLSVPYDDWDKDADPQSHHLFDRHVSSSVRLNDQDLDILVKALNSASNPAIVLGPDVDAANANADCVMLAERLKAPVWVAPSAPRCPFPTRHPCFRGLMPAGIAAISQLLEGHDVVLVIGAPVFRYHQYDPGQYLKPGTRLISVTCDPLEAARAPMGDAIVADIGAMASALANLVEESSRQLPTAAPEPAKVDQDAGRLHPETVFDTLNDMAPENAIYLNESTSTTAQMWQRLNMRNPGSYYFCAAGGLGFALPAAIGVQLAEPERQVIAVIGDGSANYSISALWTAAQYNIPTIFVIMNNGTYGALRWFAGVLEAENVPGLDVPGIDFRALAKGYGVQALKADNLEQLKGSLQEALSAKGPVLIEVSTVSPVK,./data/raw/alphafold//AF-P20906-F1-model_v4.pdb,1249,3066,603,691
+71,3311,3357,MTTETTTATATAKIPAPATPYQEDIARYWNNEARPVNLRLGDVDGLYHHHYGIGPVDRAALGDPEHSEYEKKVIAELHRLESAQAEFLMDHLGQAGPDDTLVDAGCGRGGSMVMAHRRFGSRVEGVTLSAAQADFGNRRARELRIDDHVRSRVCNMLDTPFDKGAVTASWNNESTMYVDLHDLFSEHSRFLKVGGRYVTITGCWNPRYGQPSKWVSQINAHFECNIHSRREYLRAMADNRLVPHTIVDLTPDTLPYWELRATSSLVTGIEKAFIESYRDGSFQYVLIAADRV,brenda,Q9F1Y5,CC(C)=CCC/C(C)=C/COP(=O)(O)OP(=O)(O)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O>>CC(C)=CCC/C(C)=C(\C)COP(=O)(O)OP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,0.0075,0.0706218647535347,37.0,7.0,2.1.1.255,1902.0,-2.1249387366083,CC(C)=CCC/C(C)=C/COP(=O)(O)OP(=O)(O)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,CC(C)=CCC/C(C)=C(\C)COP(=O)(O)OP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,-2.1249387366083,CC(C)=CCC/C(C)=C/COP(=O)(O)OP(=O)(O)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MTTETTTATATAKIPAPATPYQEDIARYWNNEARPVNLRLGDVDGLYHHHYGIGPVDRAALGDPEHSEYEKKVIAELHRLESAQAEFLMDHLGQAGPDDTLVDAGCGRGGSMVMAHRRFGSRVEGVTLSAAQADFGNRRARELRIDDHVRSRVCNMLDTPFDKGAVTASWNNESTMYVDLHDLFSEHSRFLKVGGRYVTITGCWNPRYGQPSKWVSQINAHFECNIHSRREYLRAMADNRLVPHTIVDLTPDTLPYWELRATSSLVTGIEKAFIESYRDGSFQYVLIAADRV,./data/raw/alphafold//AF-Q9F1Y5-F1-model_v4.pdb,1716,1342,6271,1620
+72,14648,14854,MTSPLPFVAVVPARLASTRLPNKPLADLGGKPMVVRVAERAREAGAQQVLVASDAQSVLDAVREHGFDAVLTRADHPSGTDRLAEVAAKLGFSDDTIVVNVQGDEPLIDPQLVCDVASHLAAHPSCAIATAAHPIHEAHEVFNPNYVKVVLDANGVALYFSRAPIPWSRDAYLPHWPNIAAMPAPTCPVYRHIGLYAYRARFLRTYPTLAQAPIEAAEQLEQLRAMWHGERIAVLVTEHAPEAGIDTPADLERVQALFRSRAK,uniprot_search,A0A1B4JTG8,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(C(O)CO)O3)[C@@H](O)[C@H]2O)c(O)n1.O=P(O)(O)OP(=O)(O)O,0.142,7.874707536878681e-15,25.0,7.5,2.7.7.38,57975.0,-0.8477116556169436,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(C(O)CO)O3)[C@@H](O)[C@H]2O)c(O)n1.O=P(O)(O)OP(=O)(O)O,-0.8477116556169436,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__MTSPLPFVAVVPARLASTRLPNKPLADLGGKPMVVRVAERAREAGAQQVLVASDAQSVLDAVREHGFDAVLTRADHPSGTDRLAEVAAKLGFSDDTIVVNVQGDEPLIDPQLVCDVASHLAAHPSCAIATAAHPIHEAHEVFNPNYVKVVLDANGVALYFSRAPIPWSRDAYLPHWPNIAAMPAPTCPVYRHIGLYAYRARFLRTYPTLAQAPIEAAEQLEQLRAMWHGERIAVLVTEHAPEAGIDTPADLERVQALFRSRAK,./data/raw/alphafold//AF-A0A1B4JTG8-F1-model_v4.pdb,2428,4839,4902,4754
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+82,4602,4658,MDYMYGPGRHHLFVPGPVNIPEPVIRAMNRNNEDYRSPAIPALTKTLLEDVKKIFKTTSGTPFLFPTTGTGAWESALTNTLSPGDRIVSFLIGQFSLLWIDQQKRLNFNVDVVESDWGQGANLQVLASKLSQDENHTIKAICIVHNETATGVTNDISAVRTLLDHYKHPALLLVDGVSSICALDFRMDEWGVDVALTGSQKALSLPTGLGIVCASPKALEATKTSKSLKVFFDWNDYLKFYKLGTYWPYTPSIQLLYGLRAALDLIFEEGLENIIARHARLGKATRLAVEAWGLKNCTQKEEWISNTVTAVMVPPHIDGSEIVRRAWQRYNLSLGLGLNKVAGKVFRIGHLGNVNELQLLGCLAGVEMILKDVGYPVVMGSGVAAASTYLQHHIPLIPSRI,sabio,Q56YA5,CC(N)C(=O)O.O=CC(=O)O>>CC(=O)C(=O)O.NCC(=O)O,2.86,0.0,30.0,8.0,2.6.1.45,3702.0,0.456366033129043,CC(N)C(=O)O.O=CC(=O)O,CC(=O)C(=O)O.NCC(=O)O,0.456366033129043,CC(N)C(=O)O.O=CC(=O)O__MDYMYGPGRHHLFVPGPVNIPEPVIRAMNRNNEDYRSPAIPALTKTLLEDVKKIFKTTSGTPFLFPTTGTGAWESALTNTLSPGDRIVSFLIGQFSLLWIDQQKRLNFNVDVVESDWGQGANLQVLASKLSQDENHTIKAICIVHNETATGVTNDISAVRTLLDHYKHPALLLVDGVSSICALDFRMDEWGVDVALTGSQKALSLPTGLGIVCASPKALEATKTSKSLKVFFDWNDYLKFYKLGTYWPYTPSIQLLYGLRAALDLIFEEGLENIIARHARLGKATRLAVEAWGLKNCTQKEEWISNTVTAVMVPPHIDGSEIVRRAWQRYNLSLGLGLNKVAGKVFRIGHLGNVNELQLLGCLAGVEMILKDVGYPVVMGSGVAAASTYLQHHIPLIPSRI,./data/raw/alphafold//AF-Q56YA5-F1-model_v4.pdb,1300,3854,6170,822
+83,964,989,MESMLVAGAGAAAVAAVGGLVAAAALADKLVAAPPPRKNRANPPPAVPGLPIIGNLHQLKEKKPHQTFAKWSETYGPIYTIKTGASPVVVLNSTEVAKEAMIDKFSSISTRKLPKAMSVLTRKSMVAISDYGDYQKMAKRNIMIGMLGFNAQKQFRGTRERMISNVLSTLHKLVSLDPHSPLNFRDVYINELFSLSLIQSLGEDVSSVYVEEFGREISKDEIFDVLVHEMMMCAVEADWRDYFPYLSWLPNKSFDTIVSTTEFRRDAIMNALIKKQKERIARGEARASYIDFLLEAERSAQLTDDQLMLLLSESILAAADTVLVTTEWTMYEIAKNPDKQELLYQEIREACGGEAVTEDDLPRLPYLNAVFHETLRLHSPVPVLPPRFVHDDTTLAGYDIAAGTQMMINVYACHMDEKVWESPGEWSPERFLGEGFEVADRYKTMAFGAGRRTCAGSLQAMNIACVAVARLVQELEWRLREGDGDKEDTMQFTALKLDPLHVHLKPRGRM,brenda,Q0DBF4,C=C[C@]1(C)CC[C@@H]2C(=CC[C@H]3C(C)(C)CCC[C@]23C)C1.O=O>>C=C[C@]1(C)CC[C@@H]2C(=CC[C@H]3C(C)(C)[C@@H](O)CC[C@]23C)C1.O,1.4,10000000.0,32.0,7.5,1.14.14.68,4530.0,0.1461280356782379,C=C[C@]1(C)CC[C@@H]2C(=CC[C@H]3C(C)(C)CCC[C@]23C)C1.O=O,C=C[C@]1(C)CC[C@@H]2C(=CC[C@H]3C(C)(C)[C@@H](O)CC[C@]23C)C1.O,0.1461280356782379,C=C[C@]1(C)CC[C@@H]2C(=CC[C@H]3C(C)(C)CCC[C@]23C)C1.O=O__MESMLVAGAGAAAVAAVGGLVAAAALADKLVAAPPPRKNRANPPPAVPGLPIIGNLHQLKEKKPHQTFAKWSETYGPIYTIKTGASPVVVLNSTEVAKEAMIDKFSSISTRKLPKAMSVLTRKSMVAISDYGDYQKMAKRNIMIGMLGFNAQKQFRGTRERMISNVLSTLHKLVSLDPHSPLNFRDVYINELFSLSLIQSLGEDVSSVYVEEFGREISKDEIFDVLVHEMMMCAVEADWRDYFPYLSWLPNKSFDTIVSTTEFRRDAIMNALIKKQKERIARGEARASYIDFLLEAERSAQLTDDQLMLLLSESILAAADTVLVTTEWTMYEIAKNPDKQELLYQEIREACGGEAVTEDDLPRLPYLNAVFHETLRLHSPVPVLPPRFVHDDTTLAGYDIAAGTQMMINVYACHMDEKVWESPGEWSPERFLGEGFEVADRYKTMAFGAGRRTCAGSLQAMNIACVAVARLVQELEWRLREGDGDKEDTMQFTALKLDPLHVHLKPRGRM,./data/raw/alphafold//AF-Q0DBF4-F1-model_v4.pdb,1174,785,486,555
+84,11542,11699,MDYGMYFFEHVTPYETLVRRMERVIASGKTPFQDYFLFESKGFGKVLILDKDVQSTERDEYIYHETLVHPAMLTHPEPKRVLIVGGGEGATLREVLKHPTVEKAVMVDIDGELVEVAKRHMPEWHQGAFDDPRAVLVIDDARAYLERTEERYDVVIIDLTDPVGEDNPARLLYTVEFYRLVKAHLNPGGVMGMQAGMILLTHHRVHPVVHRTVREAFRYVRSYKNHIPGFFLNFGFLLASDAFDPAAFSEGVIEARIRERNLALRHLTAPYLEAMFVLPKDLLEALEKETMVSTDQNPFYVTPEGEARQAPYKG,brenda,Q5SK28,C[S+](CCCN)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCCCN>>CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCCCNCCC[NH3+],0.73,6.608608678660969e-15,37.0,9.0,2.5.1.104,274.0,-0.1366771398795441,C[S+](CCCN)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCCCN,CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCCCNCCC[NH3+],-0.1366771398795441,C[S+](CCCN)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCCCN__MDYGMYFFEHVTPYETLVRRMERVIASGKTPFQDYFLFESKGFGKVLILDKDVQSTERDEYIYHETLVHPAMLTHPEPKRVLIVGGGEGATLREVLKHPTVEKAVMVDIDGELVEVAKRHMPEWHQGAFDDPRAVLVIDDARAYLERTEERYDVVIIDLTDPVGEDNPARLLYTVEFYRLVKAHLNPGGVMGMQAGMILLTHHRVHPVVHRTVREAFRYVRSYKNHIPGFFLNFGFLLASDAFDPAAFSEGVIEARIRERNLALRHLTAPYLEAMFVLPKDLLEALEKETMVSTDQNPFYVTPEGEARQAPYKG,./data/raw/alphafold//AF-Q5SK28-F1-model_v4.pdb,1017,558,219,237
+85,20152,20441,MSVTEPPPRRRGRHSRARRFLTSLGATAALTAGMLGVPLATGTAHAEPAFNYAEALQKSMFFYEAQRSGKLPENNRVSWRGDSGLNDGADVGLDLTGGWYDAGDHVKFGFPMAFTATMLAWGAIESPEGYIRSGQMPYLKDNLRWVNDYFIKAHPSPNVLYVQVGDGDADHKWWGPAEVMPMERPSFKVDPSCPGSDVAAETAAAMAASSIVFADDDPAYAATLVQHAKQLYTFADTYRGVYSDCVPAGAFYNSWSGYQDELVWGAYWLYKATGDDSYLAKAEYEYDFLSTEQQTDLRSYRWTIAWDDKSYGTYVLLAKETGKQKYIDDANRWLDYWTVGVNGQRVPYSPGGMAVLDTWGALRYAANTAFVALVYAKVIDDPVRKQRYHDFAVRQINYALGDNPRNSSYVVGFGNNPPRNPHHRTAHGSWTDSIASPAENRHVLYGALVGGPGSPNDAYTDDRQDYVANEVATDYNAGFSSALAMLVEEYGGTPLADFPPTEEPDGPEIFVEAQINTPGTTFTEIKAMIRNQSGWPARMLDKGTFRYWFTLDEGVDPADITVSSAYNQCATPEDVHHVSGDLYYVEIDCTGEKIFPGGQSEHRREVQFRIAGGPGWDPSNDWSFQGIGNELAPAPYIVLYDDGVPVWGTAPEEGEEPGGGEGPGGGEEPGEDVTPPSAPGSPAVRDVTSTSAVLTWSASSDTGGSGVAGYDVFLRAGTGQEQKVGSTTRTSFTLTGLEPDTTYIAAVVARDNAGNVSQRSTVSFTTLAENGGGPDASCTVGYSTNDWDSGFTASIRITYHGTAPLSSWELSFTFPAGQQVTHGWNATWRQDGAAVTATPMSWNSSLAPGATVEVGFNGSWSGSNTPPTDFTLNGEPCALA,brenda,P26221,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c([N+](=O)[O-])c1>>,0.02,99.81039203343168,30.0,7.5,3.2.1.4,2021.0,-1.6989700043360187,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c([N+](=O)[O-])c1,,-1.6989700043360187,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c([N+](=O)[O-])c1__MSVTEPPPRRRGRHSRARRFLTSLGATAALTAGMLGVPLATGTAHAEPAFNYAEALQKSMFFYEAQRSGKLPENNRVSWRGDSGLNDGADVGLDLTGGWYDAGDHVKFGFPMAFTATMLAWGAIESPEGYIRSGQMPYLKDNLRWVNDYFIKAHPSPNVLYVQVGDGDADHKWWGPAEVMPMERPSFKVDPSCPGSDVAAETAAAMAASSIVFADDDPAYAATLVQHAKQLYTFADTYRGVYSDCVPAGAFYNSWSGYQDELVWGAYWLYKATGDDSYLAKAEYEYDFLSTEQQTDLRSYRWTIAWDDKSYGTYVLLAKETGKQKYIDDANRWLDYWTVGVNGQRVPYSPGGMAVLDTWGALRYAANTAFVALVYAKVIDDPVRKQRYHDFAVRQINYALGDNPRNSSYVVGFGNNPPRNPHHRTAHGSWTDSIASPAENRHVLYGALVGGPGSPNDAYTDDRQDYVANEVATDYNAGFSSALAMLVEEYGGTPLADFPPTEEPDGPEIFVEAQINTPGTTFTEIKAMIRNQSGWPARMLDKGTFRYWFTLDEGVDPADITVSSAYNQCATPEDVHHVSGDLYYVEIDCTGEKIFPGGQSEHRREVQFRIAGGPGWDPSNDWSFQGIGNELAPAPYIVLYDDGVPVWGTAPEEGEEPGGGEGPGGGEEPGEDVTPPSAPGSPAVRDVTSTSAVLTWSASSDTGGSGVAGYDVFLRAGTGQEQKVGSTTRTSFTLTGLEPDTTYIAAVVARDNAGNVSQRSTVSFTTLAENGGGPDASCTVGYSTNDWDSGFTASIRITYHGTAPLSSWELSFTFPAGQQVTHGWNATWRQDGAAVTATPMSWNSSLAPGATVEVGFNGSWSGSNTPPTDFTLNGEPCALA,./data/raw/alphafold//AF-P26221-F1-model_v4.pdb,433,3097,5379,6259
+86,1295,1323,MDLGLAGRRALVTGAGKGIGRSTVLALQAAGAQVVAVSRTREDLDSLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVATLQPFLEVTKEACDTSFNVNFRAVVQVSQIVARGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTPMGRANWSDPHKAKVMLDRIPLGKFAEVENVVDTILFLLSNRSSMTTGSALPVDGGFLAT,sabio,Q920P0,CC(=O)C(C)=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1>>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)c1,23.0,0.0669731841496746,25.0,7.0,1.1.1.10,10116.0,1.3617278360175928,CC(=O)C(C)=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,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)c1,1.3617278360175928,CC(=O)C(C)=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1__MDLGLAGRRALVTGAGKGIGRSTVLALQAAGAQVVAVSRTREDLDSLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVATLQPFLEVTKEACDTSFNVNFRAVVQVSQIVARGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTPMGRANWSDPHKAKVMLDRIPLGKFAEVENVVDTILFLLSNRSSMTTGSALPVDGGFLAT,./data/raw/alphafold//AF-Q920P0-F1-model_v4.pdb,1316,3874,6191,848
+87,20783,21094,MRYHGICWFIFQAAIIFAIFGSCQGAFRHQFKTAEQDGFARRNRDLAKFQKENLNWNGLFQLNSISYNSGVVSGVFEQQSENGENQHLFPFSISFLKNDVVRFQMDEKSRLEGTVEYEKNILTKRRFDASTELGFNERAEVYGKDAHLLEQTSTSLTIRYGSHGRFTVIVTFSPFKVEFQRDGEPQVVLNERHLLNMEYYRPKSSRTPEQEANGMWDETFDNFHDSKPKGPESVGLDIKFVDYGNVYGVPEHTSSLSLKETNNSDAGYTEPYRLYNVDLFEYEVDSPMSQYGAIPFMQAHKPNSDVAVFWSNAAATWIDVEKESGPSPHSQSTSTHWYSESGTLDLFIFLGPKASDVYESYSALVGRPLLPPLFSIGYHQCRWNYVSEEDVLNVDAKFDEVDMPYDTIWLDIEYASKRRYFTWDKATFPNPKAMLEKLDSKSRKLIVILDPHIKNDPNYFVSKELIDYNYAVKDKSGVDNYNADCWPGNSVWVDFFNPEAQAWWGSLYEFDRFESDKNLWIWNDMNEPSVFRGPETSMHRDAIHYGGWEHRDIHNIYGHKCINGTYNGLIKRGEGAVRPFILTRSFFAGTSALAANWIGDTMTTWEHLRGSIPTVLTNGISGMAFSGADVAGFFGNPDAELFVRWYETAIFYPFFRAHAHIDTKRREPWLYGEPYTSLVRELLRIRYRLLPTWYTAFYNSHTHGFPILYPQFLMHPEDEEGFAIDDQFYVGDSGLLVKPVTHPSIDKITIYLADDEVYFDLHDHTEYAGKGHQVVPAPLGRVPVLLRGGNILITRERIRRAAELTRNDPFTLTIAVSKIGKNASGFLYLDDGVTFNYKKGEYLIRHFSYENGILTMKDSHSNPPVSPKYSSSQKHLKVERINIYGEQTRKSIKIRKIIDSEVTEWDVSVDDSGCIRNPQLFLV,brenda,Q9US55,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>>OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,0.102,33.2717722930995,30.0,6.5,3.2.1.207,4896.0,-0.9913998282380824,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,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,-0.9913998282380824,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__MRYHGICWFIFQAAIIFAIFGSCQGAFRHQFKTAEQDGFARRNRDLAKFQKENLNWNGLFQLNSISYNSGVVSGVFEQQSENGENQHLFPFSISFLKNDVVRFQMDEKSRLEGTVEYEKNILTKRRFDASTELGFNERAEVYGKDAHLLEQTSTSLTIRYGSHGRFTVIVTFSPFKVEFQRDGEPQVVLNERHLLNMEYYRPKSSRTPEQEANGMWDETFDNFHDSKPKGPESVGLDIKFVDYGNVYGVPEHTSSLSLKETNNSDAGYTEPYRLYNVDLFEYEVDSPMSQYGAIPFMQAHKPNSDVAVFWSNAAATWIDVEKESGPSPHSQSTSTHWYSESGTLDLFIFLGPKASDVYESYSALVGRPLLPPLFSIGYHQCRWNYVSEEDVLNVDAKFDEVDMPYDTIWLDIEYASKRRYFTWDKATFPNPKAMLEKLDSKSRKLIVILDPHIKNDPNYFVSKELIDYNYAVKDKSGVDNYNADCWPGNSVWVDFFNPEAQAWWGSLYEFDRFESDKNLWIWNDMNEPSVFRGPETSMHRDAIHYGGWEHRDIHNIYGHKCINGTYNGLIKRGEGAVRPFILTRSFFAGTSALAANWIGDTMTTWEHLRGSIPTVLTNGISGMAFSGADVAGFFGNPDAELFVRWYETAIFYPFFRAHAHIDTKRREPWLYGEPYTSLVRELLRIRYRLLPTWYTAFYNSHTHGFPILYPQFLMHPEDEEGFAIDDQFYVGDSGLLVKPVTHPSIDKITIYLADDEVYFDLHDHTEYAGKGHQVVPAPLGRVPVLLRGGNILITRERIRRAAELTRNDPFTLTIAVSKIGKNASGFLYLDDGVTFNYKKGEYLIRHFSYENGILTMKDSHSNPPVSPKYSSSQKHLKVERINIYGEQTRKSIKIRKIIDSEVTEWDVSVDDSGCIRNPQLFLV,./data/raw/alphafold//AF-Q9US55-F1-model_v4.pdb,526,3214,5516,6399
+88,6999,7115,MATFVELSTKAKMPIVGLGTWKSPLGKVKEAVKVAIDAGYRHIDCAYVYQNEHEVGEAIQEKIQEKAVKREDLFIVSKLWPTFFERPLVRKAFEKTLKDLKLSYLDVYLIHWPQGFKSGDDLFPKDDKGNAIGGKATFLDAWEAMEELVDEGLVKALGVSNFSHFQIEKLLNKPGLKYKPVTNQVECHPYLTQEKLIQYCHSKGITVTAYSPLGSPDRPWAKPEDPSLLEDPKIKEIAAKHKKTAAQVLIRFHIQRNVIVIPKSVTPARIVENIQVFDFKLSDEEMATILSFNRNWRACNVLQSSHLEDYPFNAEY,brenda,O60218,CCCCCC=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+]>>CCCCCCO.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)c1,2.37,0.0,25.0,7.4,1.1.1.21,9606.0,0.3747483460101038,CCCCCC=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+],CCCCCCO.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)c1,0.3747483460101038,CCCCCC=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+]__MATFVELSTKAKMPIVGLGTWKSPLGKVKEAVKVAIDAGYRHIDCAYVYQNEHEVGEAIQEKIQEKAVKREDLFIVSKLWPTFFERPLVRKAFEKTLKDLKLSYLDVYLIHWPQGFKSGDDLFPKDDKGNAIGGKATFLDAWEAMEELVDEGLVKALGVSNFSHFQIEKLLNKPGLKYKPVTNQVECHPYLTQEKLIQYCHSKGITVTAYSPLGSPDRPWAKPEDPSLLEDPKIKEIAAKHKKTAAQVLIRFHIQRNVIVIPKSVTPARIVENIQVFDFKLSDEEMATILSFNRNWRACNVLQSSHLEDYPFNAEY,./data/raw/alphafold//AF-O60218-F1-model_v4.pdb,1329,607,647,301
+89,16626,16855,MAEVVAVDVGATWVRMAIVRGGVIEAIKRERNPGTEEGLERVLQGLAEGLGIDRGRVEKVGAASIGPLDLRRGYIVGSPNIKSHIVRLSTILKRLFPKSKVAIANDAVAAAWGEYLLGRLAGTPDLGYITMSTGVGGGFVVGGRLLLGSRGNAHEVGHIVVDMGWEGGRCGCGGTGHWEAIAGGRWIPRTSSVLARGWRGPETSLYRAALEGRVGSAREVFEAAAVGDDFALHVIDYIARASAAGIASVKAAYDVDAVIIGGSVYLNNRRMLRPLIERHLAAYAPFSSRIEVVDASFGDNEGVMGAYAIAYRNPEDLPIF,sabio,Q9YA47,NC1C(O)OC(CO)C(O)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>NC1C(O)OC(COP(=O)(O)O)C(O)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,18.0,0.0,90.0,6.2,2.7.1.2,56636.0,1.255272505103306,NC1C(O)OC(CO)C(O)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,NC1C(O)OC(COP(=O)(O)O)C(O)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,1.255272505103306,NC1C(O)OC(CO)C(O)C1O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MAEVVAVDVGATWVRMAIVRGGVIEAIKRERNPGTEEGLERVLQGLAEGLGIDRGRVEKVGAASIGPLDLRRGYIVGSPNIKSHIVRLSTILKRLFPKSKVAIANDAVAAAWGEYLLGRLAGTPDLGYITMSTGVGGGFVVGGRLLLGSRGNAHEVGHIVVDMGWEGGRCGCGGTGHWEAIAGGRWIPRTSSVLARGWRGPETSLYRAALEGRVGSAREVFEAAAVGDDFALHVIDYIARASAAGIASVKAAYDVDAVIIGGSVYLNNRRMLRPLIERHLAAYAPFSSRIEVVDASFGDNEGVMGAYAIAYRNPEDLPIF,./data/raw/alphafold//AF-Q9YA47-F1-model_v4.pdb,1385,892,690,980
+90,12056,12219,MSGKIDKILIVGGGTAGWMAASYLGKALQGTADITLLQAPDIPTLGVGEATIPNLQTAFFDFLGIPEDEWMRECNASYKVAIKFINWRTAGEGTSEARELDGGPDHFYHSFGLLKYHEQIPLSHYWFDRSYRGKTVEPFDYACYKEPVILDANRSPRRLDGSKVTNYAWHFDAHLVADFLRRFATEKLGVRHVEDRVEHVQRDANGNIESVRTATGRVFDADLFVDCSGFRGLLINKAMEEPFLDMSDHLLNDSAVATQVPHDDDANGVEPFTSAIAMKSGWTWKIPMLGRFGTGYVYSSRFATEDEAVREFCEMWHLDPETQPLNRIRFRVGRNRRAWVGNCVSIGTSSCFVEPLESTGIYFVYAALYQLVKHFPDKSLNPVLTARFNREIETMFDDTRDFIQAHFYFSPRTDTPFWRANKELRLADGMQEKIDMYRAGMAINAPASDDAQLYYGNFEEEFRNFWNNSNYYCVLAGLGLVPDAPSPRLAHMPQATESVDEVFGAVKDRQRNLLETLPSLHEFLRQQHGR,uniprot_search,Q8KHZ8,Cc1cc2c(cc1C)N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]1O)c1nc(O)nc(O)c1N2.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O=O.[Cl-]>>Cc1cc2nc3c(O)nc(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)c2cc1C.N[C@@H](Cc1c[nH]c2c(Cl)cccc12)C(=O)O.O,0.05,0.8088945583327192,25.0,7.5,1.14.19.9,68170.0,-1.3010299956639813,Cc1cc2c(cc1C)N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]1O)c1nc(O)nc(O)c1N2.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O=O.[Cl-],Cc1cc2nc3c(O)nc(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)c2cc1C.N[C@@H](Cc1c[nH]c2c(Cl)cccc12)C(=O)O.O,-1.3010299956639813,Cc1cc2c(cc1C)N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]1O)c1nc(O)nc(O)c1N2.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O=O.[Cl-]__MSGKIDKILIVGGGTAGWMAASYLGKALQGTADITLLQAPDIPTLGVGEATIPNLQTAFFDFLGIPEDEWMRECNASYKVAIKFINWRTAGEGTSEARELDGGPDHFYHSFGLLKYHEQIPLSHYWFDRSYRGKTVEPFDYACYKEPVILDANRSPRRLDGSKVTNYAWHFDAHLVADFLRRFATEKLGVRHVEDRVEHVQRDANGNIESVRTATGRVFDADLFVDCSGFRGLLINKAMEEPFLDMSDHLLNDSAVATQVPHDDDANGVEPFTSAIAMKSGWTWKIPMLGRFGTGYVYSSRFATEDEAVREFCEMWHLDPETQPLNRIRFRVGRNRRAWVGNCVSIGTSSCFVEPLESTGIYFVYAALYQLVKHFPDKSLNPVLTARFNREIETMFDDTRDFIQAHFYFSPRTDTPFWRANKELRLADGMQEKIDMYRAGMAINAPASDDAQLYYGNFEEEFRNFWNNSNYYCVLAGLGLVPDAPSPRLAHMPQATESVDEVFGAVKDRQRNLLETLPSLHEFLRQQHGR,./data/raw/alphafold//AF-Q8KHZ8-F1-model_v4.pdb,1969,4122,1987,3825
+91,4024,4077,MRIIMPVEFSRIVRDVERLIAVEKYSLQGVVDGDKLLVVGFSEGSVNAYLYDGGETVKLNREPINSVLDPHYGVGRVILVRDVSKGAEQHALFKVNTSRPGEEQRLEAVKPMRILSGVDTGEAVVFTGATEDRVALYALDGGGLRELARLPGFGFVSDIRGDLIAGLGFFGGGRVSLFTSNLSSGGLRVFDSGEGSFSSASISPGMKVTAGLETAREARLVTVDPRDGSVEDLELPSKDFSSYRPTAITWLGYLPDGRLAVVARREGRSAVFIDGERVEAPQGNHGRVVLWRGKLVTSHTSLSTPPRIVSLPSGEPLLEGGLPEDLRRSIAGSRLVWVESFDGSRVPTYVLESGRAPTPGPTVVLVHGGPFAEDSDSWDTFAASLAAAGFHVVMPNYRGSTGYGEEWRLKIIGDPCGGELEDVSAAARWARESGLASELYIMGYSYGGYMTLCALTMKPGLFKAGVAGASVVDWEEMYELSDAAFRNFIEQLTGGSREIMRSRSPINHVDRIKEPLALIHPQNDSRTPLKPLLRLMGELLARGKTFEAHIIPDAGHAINTMEDAVKILLPAVFFLATQRERR,brenda,Q9YBQ2,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCC(=N)O)C(O)=NCC(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(O)=N[C@@H](C)C(=O)O.O>>CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(=O)O.C[C@H](N=C(O)[C@H](Cc1ccc([N+](=O)[O-])cc1)N=C(O)[C@@H]1CCCN1C(=O)CN=C(O)[C@@H](N)CCC(=N)O)C(=O)O,8.2,4.403812342623575e-14,70.0,7.0,3.4.19.1,56636.0,0.9138138523837168,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCC(=N)O)C(O)=NCC(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(O)=N[C@@H](C)C(=O)O.O,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(=O)O.C[C@H](N=C(O)[C@H](Cc1ccc([N+](=O)[O-])cc1)N=C(O)[C@@H]1CCCN1C(=O)CN=C(O)[C@@H](N)CCC(=N)O)C(=O)O,0.9138138523837168,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(O)=N[C@@H](CCC(=N)O)C(O)=NCC(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(O)=N[C@@H](C)C(=O)O.O__MRIIMPVEFSRIVRDVERLIAVEKYSLQGVVDGDKLLVVGFSEGSVNAYLYDGGETVKLNREPINSVLDPHYGVGRVILVRDVSKGAEQHALFKVNTSRPGEEQRLEAVKPMRILSGVDTGEAVVFTGATEDRVALYALDGGGLRELARLPGFGFVSDIRGDLIAGLGFFGGGRVSLFTSNLSSGGLRVFDSGEGSFSSASISPGMKVTAGLETAREARLVTVDPRDGSVEDLELPSKDFSSYRPTAITWLGYLPDGRLAVVARREGRSAVFIDGERVEAPQGNHGRVVLWRGKLVTSHTSLSTPPRIVSLPSGEPLLEGGLPEDLRRSIAGSRLVWVESFDGSRVPTYVLESGRAPTPGPTVVLVHGGPFAEDSDSWDTFAASLAAAGFHVVMPNYRGSTGYGEEWRLKIIGDPCGGELEDVSAAARWARESGLASELYIMGYSYGGYMTLCALTMKPGLFKAGVAGASVVDWEEMYELSDAAFRNFIEQLTGGSREIMRSRSPINHVDRIKEPLALIHPQNDSRTPLKPLLRLMGELLARGKTFEAHIIPDAGHAINTMEDAVKILLPAVFFLATQRERR,./data/raw/alphafold//AF-Q9YBQ2-F1-model_v4.pdb,2880,1586,3177,1949
+92,9892,10042,MSFKTLSALALALGAAVQFASAAVPLVQKRATCDDGRTTANAACCILFPILDDIQENLFDGAQCGEEVHESLRLTFHDAIGFSPTLGGGGADGSIIAFDTIETNFPANAGIDEIVSAQKPFVAKHNISAGDFIQFAGAVGVSNCPGGVRIPFFLGRPDAVAASPDHLVPEPFDSVDSILARMGDAGFSPVEVVWLLASHSIAAADKVDPSIPGTPFDSTPGVFDSQFFIETQLKGRLFPGTADNKGEAQSPLQGEIRLQSDHLLARDPQTACEWQSMVNNQPKIQNRFAATMSKMALLGQDKTKLIDCSDVIPTPPALVGAAHLPAGFSLSDVEQACAATPFPALTADPGPVTSVPPVPGS,brenda,O94753,COc1ccccc1O.OO>>COC1=CC(=O)C=C/C1=C1\C=CC(=O)C=C1OC.O,22.7,24.70444740801208,25.0,3.5,1.11.1.16,5323.0,1.3560258571931227,COc1ccccc1O.OO,COC1=CC(=O)C=C/C1=C1\C=CC(=O)C=C1OC.O,1.3560258571931227,COc1ccccc1O.OO__MSFKTLSALALALGAAVQFASAAVPLVQKRATCDDGRTTANAACCILFPILDDIQENLFDGAQCGEEVHESLRLTFHDAIGFSPTLGGGGADGSIIAFDTIETNFPANAGIDEIVSAQKPFVAKHNISAGDFIQFAGAVGVSNCPGGVRIPFFLGRPDAVAASPDHLVPEPFDSVDSILARMGDAGFSPVEVVWLLASHSIAAADKVDPSIPGTPFDSTPGVFDSQFFIETQLKGRLFPGTADNKGEAQSPLQGEIRLQSDHLLARDPQTACEWQSMVNNQPKIQNRFAATMSKMALLGQDKTKLIDCSDVIPTPPALVGAAHLPAGFSLSDVEQACAATPFPALTADPGPVTSVPPVPGS,./data/raw/alphafold//AF-O94753-F1-model_v4.pdb,3565,2335,1054,2955
+93,3101,3143,MMRKSVRRAMLMTTACVSLLLASVPLCAQANDVQQKLAALEKSSGGRLGVALINTADNTQTLYRADERFAMCSTSKVMAVAAVLKQSETQKGLLSQRVEIKPSDLINYNPIAEKHVNGTMTFGELSAAALQYSDNTAMNKLIAHLGGPDKVTAFARTIGDDTFRLDRTEPTLNTAIPGDPRDTTTPLAMAQALRNLTLGNALGDTQRAQLVMWLKGNTTGAASIQAGLPTSWVVGDKTGSGGYGTTNDIAVIWPEGRAPLVLVTYFTQSEPKAESRRDVLAAAARIVTDGY,brenda,Q8KSA6,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>>,33.0,99.82319723056142,25.0,7.2,3.5.2.6,562.0,1.5185139398778875,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,,1.5185139398778875,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__MMRKSVRRAMLMTTACVSLLLASVPLCAQANDVQQKLAALEKSSGGRLGVALINTADNTQTLYRADERFAMCSTSKVMAVAAVLKQSETQKGLLSQRVEIKPSDLINYNPIAEKHVNGTMTFGELSAAALQYSDNTAMNKLIAHLGGPDKVTAFARTIGDDTFRLDRTEPTLNTAIPGDPRDTTTPLAMAQALRNLTLGNALGDTQRAQLVMWLKGNTTGAASIQAGLPTSWVVGDKTGSGGYGTTNDIAVIWPEGRAPLVLVTYFTQSEPKAESRRDVLAAAARIVTDGY,./data/raw/alphafold//AF-Q8KSA6-F1-model_v4.pdb,1458,649,811,1084
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+96,8177,8305,MELRPWLLWVVAATGTLVLLAADAQGQKVFTNTWAVRIPGGPAVANSVARKHGFLNLGQIFGDYYHFWHRGVTKRSLSPHRPRHSRLQREPQVQWLEQQVAKRRTKRDVYQEPTDPKFPQQWYLSGVTQRDLNVKAAWAQGYTGHGIVVSILDDGIEKNHPDLAGNYDPGASFDVNDQDPDPQPRYTQMNDNRHGTRCAGEVAAVANNGVCGVGVAYNARIGGVRMLDGEVTDAVEARSLGLNPNHIHIYSASWGPEDDGKTVDGPARLAEEAFFRGVSQGRGGLGSIFVWASGNGGREHDSCNCDGYTNSIYTLSISSATQFGNVPWYSEACSSTLATTYSSGNQNEKQIVTTDLRQKCTESHTGTSASAPLAAGIIALTLEANKNLTWRDMQHLVVQTSKPAHLNANDWATNGVGRKVSHSYGYGLLDAGAMVALAQNWTTVAPQRKCIIDILTEPKDIGKRLEVRKTVTACLGEPNHITRLEHAQARLTLSYNRRGDLAIHLVSPMGTRSTLLAARPHDYSADGFNDWAFMTTHSWDEDPSGEWVLEIENTSEANNYGTLTKFTLVLYGTAPEGLPVPPESSGCKTLTSSQACVVCEEGFSLHQKSCVQHCPPGFAPQVLDTHYSTENDVETIRASVCAPCHASCATCQGPALTDCLSCPSHASLDPVEQTCSRQSQSSRESPPQQQPPRLPPEVEAGQRLRAGLLPSHLPEVVAGLSCAFIVLVFVTVFLVLQLRSGFSFRGVKVYTMDRGLISYKGLPPEAWQEECPSDSEEDEGRGERTAFIKDQSAL,uniprot_search,P09958,CC[C@H](C)[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@H](C(O)=N[C@H](C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)C)C(C)C.O>>CC(C)[C@H](N=C(O)[C@@H](N=C(O)[C@@H](N)CC(=O)O)C(C)C)C(O)=N[C@@H](CC(=O)O)C(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](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O,3.1,1.90910528199282e-14,37.0,7.0,3.4.21.75,9606.0,0.4913616938342727,CC[C@H](C)[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@H](C(O)=N[C@H](C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)C)C(C)C.O,CC(C)[C@H](N=C(O)[C@@H](N=C(O)[C@@H](N)CC(=O)O)C(C)C)C(O)=N[C@@H](CC(=O)O)C(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](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O,0.4913616938342727,CC[C@H](C)[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@H](C(O)=N[C@H](C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)C)C(C)C.O__MELRPWLLWVVAATGTLVLLAADAQGQKVFTNTWAVRIPGGPAVANSVARKHGFLNLGQIFGDYYHFWHRGVTKRSLSPHRPRHSRLQREPQVQWLEQQVAKRRTKRDVYQEPTDPKFPQQWYLSGVTQRDLNVKAAWAQGYTGHGIVVSILDDGIEKNHPDLAGNYDPGASFDVNDQDPDPQPRYTQMNDNRHGTRCAGEVAAVANNGVCGVGVAYNARIGGVRMLDGEVTDAVEARSLGLNPNHIHIYSASWGPEDDGKTVDGPARLAEEAFFRGVSQGRGGLGSIFVWASGNGGREHDSCNCDGYTNSIYTLSISSATQFGNVPWYSEACSSTLATTYSSGNQNEKQIVTTDLRQKCTESHTGTSASAPLAAGIIALTLEANKNLTWRDMQHLVVQTSKPAHLNANDWATNGVGRKVSHSYGYGLLDAGAMVALAQNWTTVAPQRKCIIDILTEPKDIGKRLEVRKTVTACLGEPNHITRLEHAQARLTLSYNRRGDLAIHLVSPMGTRSTLLAARPHDYSADGFNDWAFMTTHSWDEDPSGEWVLEIENTSEANNYGTLTKFTLVLYGTAPEGLPVPPESSGCKTLTSSQACVVCEEGFSLHQKSCVQHCPPGFAPQVLDTHYSTENDVETIRASVCAPCHASCATCQGPALTDCLSCPSHASLDPVEQTCSRQSQSSRESPPQQQPPRLPPEVEAGQRLRAGLLPSHLPEVVAGLSCAFIVLVFVTVFLVLQLRSGFSFRGVKVYTMDRGLISYKGLPPEAWQEECPSDSEEDEGRGERTAFIKDQSAL,./data/raw/alphafold//AF-P09958-F1-model_v4.pdb,1933,1563,3148,1919
+97,390,405,MQQASTPTIGMIVPPAAGLVPADGARLYPDLPFIASGLGLGSVTPEGYDAVIESVVDHARRLQKQGAAVVSLMGTSLSFYRGAAFNAALTVAMREATGLPCTTMSTAVLNGLRALGVRRVALATAYIDDVNERLAAFLAEESLVPTGCRSLGITGVEAMARVDTATLVDLCVRAFEAAPDSDGILLSCGGLLTLDAIPEVERRLGVPVVSSSPAGFWDAVRLAGGGAKARPGYGRLFDES,brenda,Q05115,C/C=C/C(C)(C(=O)O)C(=O)O>>C/C=C\[C@H](C)C(=O)O.O=C=O,46.2,0.0,45.0,8.25,4.1.1.76,518.0,1.6646419755561257,C/C=C/C(C)(C(=O)O)C(=O)O,C/C=C\[C@H](C)C(=O)O.O=C=O,1.6646419755561257,C/C=C/C(C)(C(=O)O)C(=O)O__MQQASTPTIGMIVPPAAGLVPADGARLYPDLPFIASGLGLGSVTPEGYDAVIESVVDHARRLQKQGAAVVSLMGTSLSFYRGAAFNAALTVAMREATGLPCTTMSTAVLNGLRALGVRRVALATAYIDDVNERLAAFLAEESLVPTGCRSLGITGVEAMARVDTATLVDLCVRAFEAAPDSDGILLSCGGLLTLDAIPEVERRLGVPVVSSSPAGFWDAVRLAGGGAKARPGYGRLFDES,./data/raw/alphafold//AF-Q05115-F1-model_v4.pdb,1049,605,272,296
+98,13175,13350,MANDASTVFDLVILGGGSGGYAAALRGAQLGLDVALIEKDKVGGTCLHKGCIPTKALLHAGEIADQARESEQFGVKATFEGIDVPAVQKYKDDVISGLYKGLQGLIASRKVTYIEGEGRLSSPTSVDVNGQRIEGRHVLLATGSVPKSLPGLQIDGDRIISSDHALVLDRVPKSAIILGGGVIGVEFASAWKSFGADVTVIEGLKHLVPVEDENSSKLLERAFRKRGIKFSLGTFFEKAEYTQDGVKVTLADGKEFEAEVLLVAVGRGPVSQNLGYEEQGVNIDRGYVLVDEYMRTNVPTISAVGDLVPTLQLAHVGFAEGILVAERLAGLKTVPIDYDGVPRVTYCHPEVASVGITEAKAKEIYGADKVVALKYSLAGNGKSKILKTAGEIKLVQVKDGAVVGVHMVGDRMGEQVGEAQLIYNWEALPAEVAQLIHAHPTQNEALGEAHLALAGKPLHAHD,uniprot_search,Q9Z6I5,N=C(O)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=C1C=CC(=O)C=C1>>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.Oc1ccc(O)cc1,108.0,0.0650703767109973,,,1.8.1.4,73044.0,2.03342375548695,N=C(O)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=C1C=CC(=O)C=C1,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.Oc1ccc(O)cc1,2.03342375548695,N=C(O)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=C1C=CC(=O)C=C1__MANDASTVFDLVILGGGSGGYAAALRGAQLGLDVALIEKDKVGGTCLHKGCIPTKALLHAGEIADQARESEQFGVKATFEGIDVPAVQKYKDDVISGLYKGLQGLIASRKVTYIEGEGRLSSPTSVDVNGQRIEGRHVLLATGSVPKSLPGLQIDGDRIISSDHALVLDRVPKSAIILGGGVIGVEFASAWKSFGADVTVIEGLKHLVPVEDENSSKLLERAFRKRGIKFSLGTFFEKAEYTQDGVKVTLADGKEFEAEVLLVAVGRGPVSQNLGYEEQGVNIDRGYVLVDEYMRTNVPTISAVGDLVPTLQLAHVGFAEGILVAERLAGLKTVPIDYDGVPRVTYCHPEVASVGITEAKAKEIYGADKVVALKYSLAGNGKSKILKTAGEIKLVQVKDGAVVGVHMVGDRMGEQVGEAQLIYNWEALPAEVAQLIHAHPTQNEALGEAHLALAGKPLHAHD,./data/raw/alphafold//AF-Q9Z6I5-F1-model_v4.pdb,1227,4449,4353,4238
+99,21834,22159,MLKDVLTSELAAQVRDAFDDDRDAETFLLRLERYGEDLWESLRAVYGDQVRALPGRLLEVMLHAYHARPAELRRLDEARLLRPDWLQRPEMVGYVAYTDRFAGTLKGVEERLDYLEGLGVKYLHLMPLLRPREGENDGGYAVQDYRAVRPDLGTMDDLSALARALRGRGISLVLDLVLNHVAREHAWAQKARAGDPKYRAYFHLFPDRRGPDAFEATLPEIFPDFAPGNFSWDEEIGEGEGGWVWTTFNSYQWDLNWANPDVFLEFVDIILYLANRGVEVFRLDAIAFIWKRLGTDCQNQPEVHHLTRALRAAARIVAPAVAFKAEAIVAPADLIHYLGTRAHHGKVSDMAYHNSLMVQLWSSLASRNTRLFEEALRAFPPKPTSTTWGLYVRCHDDIGWAISDEDAARAGLNGAAHRHFLSDFYSGQFPGSFARGLVFQYNPVNGDRRISGSAASLAGLEAALETGDPGRIEDAVRRLLLLHTVILGFGGVPLLYMGDELALLNDYAFEDVPEHAPDNRWVHRPQMDWALAERVRQEPSSPAGRVNTGLRHLLRVRRDTPQLHASIESQVLPSPDSRALLLRRDHPLGGMVQVYNFSEETVMLPSHVLRDVLGDHVQDRLSGSAFRLDRPTVRLEGYRALWLTAGEAPA,brenda,Q1J0W0,O=C1CC(c2ccc(O)cc2)Oc2ccccc21.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]1OC(O)(CO)[C@@H](O)[C@@H]1O,0.015,52.68995732678986,45.0,7.0,2.4.1.4,68909.0,-1.8239087409443189,O=C1CC(c2ccc(O)cc2)Oc2ccccc21.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]1OC(O)(CO)[C@@H](O)[C@@H]1O,-1.8239087409443189,O=C1CC(c2ccc(O)cc2)Oc2ccccc21.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__MLKDVLTSELAAQVRDAFDDDRDAETFLLRLERYGEDLWESLRAVYGDQVRALPGRLLEVMLHAYHARPAELRRLDEARLLRPDWLQRPEMVGYVAYTDRFAGTLKGVEERLDYLEGLGVKYLHLMPLLRPREGENDGGYAVQDYRAVRPDLGTMDDLSALARALRGRGISLVLDLVLNHVAREHAWAQKARAGDPKYRAYFHLFPDRRGPDAFEATLPEIFPDFAPGNFSWDEEIGEGEGGWVWTTFNSYQWDLNWANPDVFLEFVDIILYLANRGVEVFRLDAIAFIWKRLGTDCQNQPEVHHLTRALRAAARIVAPAVAFKAEAIVAPADLIHYLGTRAHHGKVSDMAYHNSLMVQLWSSLASRNTRLFEEALRAFPPKPTSTTWGLYVRCHDDIGWAISDEDAARAGLNGAAHRHFLSDFYSGQFPGSFARGLVFQYNPVNGDRRISGSAASLAGLEAALETGDPGRIEDAVRRLLLLHTVILGFGGVPLLYMGDELALLNDYAFEDVPEHAPDNRWVHRPQMDWALAERVRQEPSSPAGRVNTGLRHLLRVRRDTPQLHASIESQVLPSPDSRALLLRRDHPLGGMVQVYNFSEETVMLPSHVLRDVLGDHVQDRLSGSAFRLDRPTVRLEGYRALWLTAGEAPA,./data/raw/alphafold//AF-Q1J0W0-F1-model_v4.pdb,716,110,5827,6735
+100,16886,17116,MGSKRGISSRHHSLSSYEIMFAALFAILVVLCAGLIAVSCLTIKESQRGAALGQSHEARATFKITSGVTYNPNLQDKLSVDFKVLAFDLQQMIDEIFLSSNLKNEYKNSRVLQFENGSIIVVFDLFFAQWVSDENVKEELIQGLEANKSSQLVTFHIDLNSVDILDKLTTTSHLATPGNVSIECLPGSSPCTDALTCIKADLFCDGEVNCPDGSDEDNKMCATVCDGRFLLTGSSGSFQATHYPKPSETSVVCQWIIRVNQGLSIKLSFDDFNTYYTDILDIYEGVGSSKILRASIWETNPGTIRIFSNQVTATFLIESDESDYVGFNATYTAFNSSELNNYEKINCNFEDGFCFWVQDLNDDNEWERIQGSTFSPFTGPNFDHTFGNASGFYISTPTGPGGRQERVGLLSLPLDPTLEPACLSFWYHMYGENVHKLSINISNDQNMEKTVFQKEGNYGDNWNYGQVTLNETVKFKVAFNAFKNKILSDIALDDISLTYGICNGSLYPEPTLVPTPPPELPTDCGGPFELWEPNTTFSSTNFPNSYPNLAFCVWILNAQKGKNIQLHFQEFDLENINDVVEIRDGEEADSLLLAVYTGPGPVKDVFSTTNRMTVLLITNDVLARGGFKANFTTGYHLGIPEPCKADHFQCKNGECVPLVNLCDGHLHCEDGSDEADCVRFFNGTTNNNGLVRFRIQSIWHTACAENWTTQISNDVCQLLGLGSGNSSKPIFPTDGGPFVKLNTAPDGHLILTPSQQCLQDSLIRLQCNHKSCGKKLAAQDITPKIVGGSNAKEGAWPWVVGLYYGGRLLCGASLVSSDWLVSAAHCVYGRNLEPSKWTAILGLHMKSNLTSPQTVPRLIDEIVINPHYNRRRKDNDIAMMHLEFKVNYTDYIQPICLPEENQVFPPGRNCSIAGWGTVVYQGTTANILQEADVPLLSNERCQQQMPEYNITENMICAGYEEGGIDSCQGDSGGPLMCQENNRWFLAGVTSFGYKCALPNRPGVYARVSRFTEWIQSFLH,brenda,P98073,NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(O)=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.Nc1ccc2ccccc2c1,115.0,7.041324896078328e-15,37.0,8.4,3.4.21.9,9606.0,2.060697840353612,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.Nc1ccc2ccccc2c1,2.0827853703164503,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__MGSKRGISSRHHSLSSYEIMFAALFAILVVLCAGLIAVSCLTIKESQRGAALGQSHEARATFKITSGVTYNPNLQDKLSVDFKVLAFDLQQMIDEIFLSSNLKNEYKNSRVLQFENGSIIVVFDLFFAQWVSDENVKEELIQGLEANKSSQLVTFHIDLNSVDILDKLTTTSHLATPGNVSIECLPGSSPCTDALTCIKADLFCDGEVNCPDGSDEDNKMCATVCDGRFLLTGSSGSFQATHYPKPSETSVVCQWIIRVNQGLSIKLSFDDFNTYYTDILDIYEGVGSSKILRASIWETNPGTIRIFSNQVTATFLIESDESDYVGFNATYTAFNSSELNNYEKINCNFEDGFCFWVQDLNDDNEWERIQGSTFSPFTGPNFDHTFGNASGFYISTPTGPGGRQERVGLLSLPLDPTLEPACLSFWYHMYGENVHKLSINISNDQNMEKTVFQKEGNYGDNWNYGQVTLNETVKFKVAFNAFKNKILSDIALDDISLTYGICNGSLYPEPTLVPTPPPELPTDCGGPFELWEPNTTFSSTNFPNSYPNLAFCVWILNAQKGKNIQLHFQEFDLENINDVVEIRDGEEADSLLLAVYTGPGPVKDVFSTTNRMTVLLITNDVLARGGFKANFTTGYHLGIPEPCKADHFQCKNGECVPLVNLCDGHLHCEDGSDEADCVRFFNGTTNNNGLVRFRIQSIWHTACAENWTTQISNDVCQLLGLGSGNSSKPIFPTDGGPFVKLNTAPDGHLILTPSQQCLQDSLIRLQCNHKSCGKKLAAQDITPKIVGGSNAKEGAWPWVVGLYYGGRLLCGASLVSSDWLVSAAHCVYGRNLEPSKWTAILGLHMKSNLTSPQTVPRLIDEIVINPHYNRRRKDNDIAMMHLEFKVNYTDYIQPICLPEENQVFPPGRNCSIAGWGTVVYQGTTANILQEADVPLLSNERCQQQMPEYNITENMICAGYEEGGIDSCQGDSGGPLMCQENNRWFLAGVTSFGYKCALPNRPGVYARVSRFTEWIQSFLH,./data/raw/alphafold//AF-P98073-F1-model_v4.pdb,1919,5255,2511,5329
+101,18769,19043,MAFPAGFGWAAATAAYQVEGGWDADGKGPCVWDTFTHQGGERVFKNQTGDVACGSYTLWEEDLKCIKQLGLTHYRFSLSWSRLLPDGTTGFINQKGIDYYNKIIDDLLKNGVTPIVTLYHFDLPQTLEDQGGWLSEAIIESFDKYAQFCFSTFGDRVKQWITINEANVLSVMSYDLGMFPPGIPHFGTGGYQAAHNLIKAHARSWHSYDSLFRKKQKGMVSLSLFAVWLEPADPNSVSDQEAAKRAITFHLDLFAKPIFIDGDYPEVVKSQIASMSQKQGYPSSRLPEFTEEEKKMIKGTADFFAVQYYTTRLIKYQENKKGELGILQDAEIEFFPDPSWKNVDWIYVVPWGVCKLLKYIKDTYNNPVIYITENGFPQSDPAPLDDTQRWEYFRQTFQELFKAIQLDKVNLQVYCAWSLLDNFEWNQGYSSRFGLFHVDFEDPARPRVPYTSAKEYAKIIRNNGLEAHL,sabio,Q9H227,O>>O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12.OCC1OC(O)C(O)C(O)C1O,1.5,92.61481146130204,37.0,6.5,3.2.1.21,9606.0,0.1760912590556812,O,O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12.OCC1OC(O)C(O)C(O)C1O,2.639087871083737,O__MAFPAGFGWAAATAAYQVEGGWDADGKGPCVWDTFTHQGGERVFKNQTGDVACGSYTLWEEDLKCIKQLGLTHYRFSLSWSRLLPDGTTGFINQKGIDYYNKIIDDLLKNGVTPIVTLYHFDLPQTLEDQGGWLSEAIIESFDKYAQFCFSTFGDRVKQWITINEANVLSVMSYDLGMFPPGIPHFGTGGYQAAHNLIKAHARSWHSYDSLFRKKQKGMVSLSLFAVWLEPADPNSVSDQEAAKRAITFHLDLFAKPIFIDGDYPEVVKSQIASMSQKQGYPSSRLPEFTEEEKKMIKGTADFFAVQYYTTRLIKYQENKKGELGILQDAEIEFFPDPSWKNVDWIYVVPWGVCKLLKYIKDTYNNPVIYITENGFPQSDPAPLDDTQRWEYFRQTFQELFKAIQLDKVNLQVYCAWSLLDNFEWNQGYSSRFGLFHVDFEDPARPRVPYTSAKEYAKIIRNNGLEAHL,./data/raw/alphafold//AF-Q9H227-F1-model_v4.pdb,481,418,57,60
+102,16402,16630,MNYARFITAASAARNPSPIRTMTDILSRGPKSMISLAGGLPNPNMFPFKTAVITVENGKTIQFGEEMMKRALQYSPSAGIPELLSWLKQLQIKLHNPPTIHYPPSQGQMDLCVTSGSQQGLCKVFEMIINPGDNVLLDEPAYSGTLQSLHPLGCNIINVASDESGIVPDSLRDILSRWKPEDAKNPQKNTPKFLYTVPNGNNPTGNSLTSERKKEIYELARKYDFLIIEDDPYYFLQFNKFRVPTFLSMDVDGRVIRADSFSKIISSGLRIGFLTGPKPLIERVILHIQVSTLHPSTFNQLMISQLLHEWGEEGFMAHVDRVIDFYSNQKDAILAAADKWLTGLAEWHVPAAGMFLWIKVKGINDVKELIEEKAVKMGVLMLPGNAFYVDSSAPSPYLRASFSSASPEQMDVAFQVLAQLIKESL,sabio,Q8N5Z0,NC(CCCC(=O)O)C(=O)O.O=CC(=O)O>>NCC(=O)O.O=C(O)CCCC(=O)C(=O)O,10764.0,6.029417508953213e-15,37.0,7.4,2.6.1.39,9606.0,4.031973689091717,NC(CCCC(=O)O)C(=O)O.O=CC(=O)O,NCC(=O)O.O=C(O)CCCC(=O)C(=O)O,4.031973689091717,NC(CCCC(=O)O)C(=O)O.O=CC(=O)O__MNYARFITAASAARNPSPIRTMTDILSRGPKSMISLAGGLPNPNMFPFKTAVITVENGKTIQFGEEMMKRALQYSPSAGIPELLSWLKQLQIKLHNPPTIHYPPSQGQMDLCVTSGSQQGLCKVFEMIINPGDNVLLDEPAYSGTLQSLHPLGCNIINVASDESGIVPDSLRDILSRWKPEDAKNPQKNTPKFLYTVPNGNNPTGNSLTSERKKEIYELARKYDFLIIEDDPYYFLQFNKFRVPTFLSMDVDGRVIRADSFSKIISSGLRIGFLTGPKPLIERVILHIQVSTLHPSTFNQLMISQLLHEWGEEGFMAHVDRVIDFYSNQKDAILAAADKWLTGLAEWHVPAAGMFLWIKVKGINDVKELIEEKAVKMGVLMLPGNAFYVDSSAPSPYLRASFSSASPEQMDVAFQVLAQLIKESL,./data/raw/alphafold//AF-Q8N5Z0-F1-model_v4.pdb,1302,3856,6172,824
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+130,12122,12285,MQQASTPTIGMIVPPAAGLVPADGARLYPDLPFIASGLGLGSVTPEGYDAVIESVVDHARRLQKQGAAVVSLMGTSLSFYRGAAFNAALTVAMREATGLPCTTMSTAVLNGLRALGVRRVALATAYIDDVNERLAAFLAEESLVPTGCRSLGITGVEAMARVDTATLVDLCVRAFEAAPDSDGILLSCGGLLTLDAIPEVERRLGVPVVSSSPAGFWDAVRLAGGGAKARPGYGRLFDES,uniprot_search,Q05115,Cc1ccc(C(O)(C(=O)O)C(=O)O)o1.[H+]>>Cc1ccc([C@@H](O)C(=O)O)o1.O=C=O,37.1,0.2505592841163264,45.0,8.5,4.1.1.76,518.0,1.569373909615046,Cc1ccc(C(O)(C(=O)O)C(=O)O)o1.[H+],Cc1ccc([C@@H](O)C(=O)O)o1.O=C=O,1.569373909615046,Cc1ccc(C(O)(C(=O)O)C(=O)O)o1.[H+]__MQQASTPTIGMIVPPAAGLVPADGARLYPDLPFIASGLGLGSVTPEGYDAVIESVVDHARRLQKQGAAVVSLMGTSLSFYRGAAFNAALTVAMREATGLPCTTMSTAVLNGLRALGVRRVALATAYIDDVNERLAAFLAEESLVPTGCRSLGITGVEAMARVDTATLVDLCVRAFEAAPDSDGILLSCGGLLTLDAIPEVERRLGVPVVSSSPAGFWDAVRLAGGGAKARPGYGRLFDES,./data/raw/alphafold//AF-Q05115-F1-model_v4.pdb,1049,605,272,296
+131,7210,7332,MDPKFQRVALSDGHFIPVLGFGTYAPEEVPKSKAMEATKIAIDAGFRHIDSAYFYKNEKEVGLAIRSKIADGTVKREDIFYTSKLWCTFHRPELVRPSLEDSLKNLQLDYVDLYIIHFPTALKPGVEIIPTDEHGKAIFDTVDICATWEAMEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYLNQGKLLEFCKSKGIVLVAYSALGSHREPEWVDQSAPVLLEDPLIGALAKKHQQTPALIALRYQLQRGIVVLAKSFTEKRIKENIQVFEFQLPSEDMKVIDSLNRNFRYVTADFAIGHPNYPFSDEY,uniprot_search,P80508,CCCCCCCCC=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+]>>,0.032,99.88759940427684,37.0,7.4,1.1.1.149,9986.0,-1.494850021680094,CCCCCCCCC=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+],,-1.494850021680094,CCCCCCCCC=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
+132,18908,19189,MKTFLGKKLWMASLAVALAAGSFAALPEMTSAAPSEPYTWKNVVTGAGGGFVPGIIFNESEKDLIYARTDIGGAYRWNPANESWIPLTDFVGWDDWNKNGVDALATDPVDPDRVYLAVGTYTNSWDKNNGAILRSTDRGDTWQTTTLPFKVGGNMPGRSMGERLVVDPNDNRILYFGARSGNGLWRSSDYGATWSKVTSFPNPGTYVQDPANEYGSDIVGLAWITFDKSSGQVGQATQTIYVGVADTAQSIYRSTDGGATWTAVPGQPTGYLPHHGVLDADGSLYITYSNGVGPYDGTKGDVWKLNTSTGAWTNISPIPSSSADNYFGYGGLAVDAQEPGTLMVATLNSWWPDAILFRSKDGGTTWTRIWEFDGYPNRKFRYTQNISAAPWLTFGTTPAPPEVSPKLGWMIGDLEIDPFDSDRMMYGTGATIYGTNNLTNWDNNEKIDISVMAKGVEEMAVLDLVSPPSGAHLVSGLGDVNGFRHDDLDQPPAKMFSSPNYASTESLDFAELNPSTMVRVGKADYAADPNAKSIGLSSDGGTNWYKANAEPAGTAGGGTVAISSDGSKLVWSTSDKGVHYSSTGGNSWTASTGIPAQAKVISDRVNPNKFYGFAAGKIYVSVNGGVSFSQTAAAGLPVDGNADLDAVPGVEGELWFAGGNEDGGPYGLWHSTDSGASFAKLSNVEEADSIGFGKAAPGRNSAALYAVAQIDGTRGFFRSDDGGASWVRINDDAHQYARVTTITGDPRIYGRVYLGTNGRGILYADPVGGNNGGETPPVSHSGISPQSTEFDLNADRQADIPVALTLNGNTLASIRNGNHVLVQGSDYTMSGSQVFLSKTYLATLSKGVQSLVFRFSAGNDATLSITVKDTTQVPLPEGSIRIEMYNGTTSATANSINPKFKLTNTGTAPLQLADVNIRYYYTIDGEKPLNFFCDWATAGSANVTGTFSALPAAVNGADHVLEIGFTASAGTLAAGQSTEVQVRFSKTDWTNFTQTDDYSFAASSTAYENWSKVTGYVSGTLQWGIEP,sabio,Q3MUH7,O>>,77.6,94.74099395214304,45.0,6.0,3.2.1.151,58172.0,1.8898617212581883,O,,1.8898617212581883,O__MKTFLGKKLWMASLAVALAAGSFAALPEMTSAAPSEPYTWKNVVTGAGGGFVPGIIFNESEKDLIYARTDIGGAYRWNPANESWIPLTDFVGWDDWNKNGVDALATDPVDPDRVYLAVGTYTNSWDKNNGAILRSTDRGDTWQTTTLPFKVGGNMPGRSMGERLVVDPNDNRILYFGARSGNGLWRSSDYGATWSKVTSFPNPGTYVQDPANEYGSDIVGLAWITFDKSSGQVGQATQTIYVGVADTAQSIYRSTDGGATWTAVPGQPTGYLPHHGVLDADGSLYITYSNGVGPYDGTKGDVWKLNTSTGAWTNISPIPSSSADNYFGYGGLAVDAQEPGTLMVATLNSWWPDAILFRSKDGGTTWTRIWEFDGYPNRKFRYTQNISAAPWLTFGTTPAPPEVSPKLGWMIGDLEIDPFDSDRMMYGTGATIYGTNNLTNWDNNEKIDISVMAKGVEEMAVLDLVSPPSGAHLVSGLGDVNGFRHDDLDQPPAKMFSSPNYASTESLDFAELNPSTMVRVGKADYAADPNAKSIGLSSDGGTNWYKANAEPAGTAGGGTVAISSDGSKLVWSTSDKGVHYSSTGGNSWTASTGIPAQAKVISDRVNPNKFYGFAAGKIYVSVNGGVSFSQTAAAGLPVDGNADLDAVPGVEGELWFAGGNEDGGPYGLWHSTDSGASFAKLSNVEEADSIGFGKAAPGRNSAALYAVAQIDGTRGFFRSDDGGASWVRINDDAHQYARVTTITGDPRIYGRVYLGTNGRGILYADPVGGNNGGETPPVSHSGISPQSTEFDLNADRQADIPVALTLNGNTLASIRNGNHVLVQGSDYTMSGSQVFLSKTYLATLSKGVQSLVFRFSAGNDATLSITVKDTTQVPLPEGSIRIEMYNGTTSATANSINPKFKLTNTGTAPLQLADVNIRYYYTIDGEKPLNFFCDWATAGSANVTGTFSALPAAVNGADHVLEIGFTASAGTLAAGQSTEVQVRFSKTDWTNFTQTDDYSFAASSTAYENWSKVTGYVSGTLQWGIEP,./data/raw/alphafold//AF-Q3MUH7-F1-model_v4.pdb,201,2717,5027,5879
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+149,3023,3065,SNAMKDFHFDAISAFENYEIEKMRDGHVVVTTKVVNSSLNYYGNAHGGYLFTLCDQISGLVVISLGLDGVTLQSSINYLKAGKLDDVLTIKGECVHQGRTTCVMDVDITNQEGRNVCKATFTMFVTGQRSEERRVRI,brenda,A0A0M3KL39,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)Cc1ccccc1.O>>CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.O=C(O)Cc1ccccc1,6.5,6.286660546367751e-15,21.0,7.6,3.1.2.25,1313.0,0.8129133566428556,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)Cc1ccccc1.O,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.O=C(O)Cc1ccccc1,0.8129133566428556,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)Cc1ccccc1.O__SNAMKDFHFDAISAFENYEIEKMRDGHVVVTTKVVNSSLNYYGNAHGGYLFTLCDQISGLVVISLGLDGVTLQSSINYLKAGKLDDVLTIKGECVHQGRTTCVMDVDITNQEGRNVCKATFTMFVTGQRSEERRVRI,./data/raw/alphafold//AF-A0A0M3KL39-F1-model_v4.pdb,1702,1321,6246,1591
+150,5770,5856,MMKGWIKCGLAGAVVLMASFWGGSVRAAGMSLTQVSGPVYVVEDNYYVQENSMVYFGAKGVTVVGATWTPDTARELHKLIKRVSSKPVLEVINNNYHTDRAGGNAYWKSIGAKVVSTRQTRELMKSDWAEIVAFTRKGLPEYPDLPLVLPNVVHDGDFTLQEGKLRAFYAGPAHTPDGIFVYFPDEQVLYGNCILKEKLGNLSFADVKAYPQTLERLKAMKLPIKTVVGGHDSPLHGPELIDHYEALIKAATHS,sabio,Q6X1Y9,CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(N)c3ccccc3)C2SC1.O>>,0.65,99.72708242929389,30.0,7.0,3.5.2.6,644.0,-0.1870866433571444,CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(N)c3ccccc3)C2SC1.O,,-0.1870866433571444,CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(N)c3ccccc3)C2SC1.O__MMKGWIKCGLAGAVVLMASFWGGSVRAAGMSLTQVSGPVYVVEDNYYVQENSMVYFGAKGVTVVGATWTPDTARELHKLIKRVSSKPVLEVINNNYHTDRAGGNAYWKSIGAKVVSTRQTRELMKSDWAEIVAFTRKGLPEYPDLPLVLPNVVHDGDFTLQEGKLRAFYAGPAHTPDGIFVYFPDEQVLYGNCILKEKLGNLSFADVKAYPQTLERLKAMKLPIKTVVGGHDSPLHGPELIDHYEALIKAATHS,./data/raw/alphafold//AF-Q6X1Y9-F1-model_v4.pdb,1463,1689,3301,1133
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+162,449,466,MEKKKKPELSRRDFGKLIIGGGAAATIAPFGVPGANAAEKEKNAAEIRQQFAMTAGSPIIVNDKLERYAEVRTAFTHPTSFFKPNYKGEVKPWFLSAYDEKVRQIENGENGPKMKAKNVGEARAGRALEAAGWTLDINYGNIYPNRFFMLWSGETMTNTQLWAPVGLDRRPPDTTDPVELTNYVKFAARMAGADLVGVARLNRNWVYSEAVTIPADVPYEQSLHKEIEKPIVFKDVPLPIETDDELIIPNTCENVIVAGIAMNREMMQTAPNSMACATTAFCYSRMCMFDMWLCQFIRYMGYYAIPSCNGVGQSVAFAVEAGLGQASRMGACITPEFGPNVRLTKVFTNMPLVPDKPIDFGVTEFCETCKKCARECPSKAITEGPRTFEGRSIHNQSGKLQWQNDYNKCLGYWPESGGYCGVCVAVCPFTKGNIWIHDGVEWLIDNTRFLDPLMLGMDDALGYGAKRNITEVWDGKINTYGLDADHFRDTVSFRKDRVKKS,uniprot_search,O68252,C1=CN(Cc2ccccc2)C=CC1C1C=CN(Cc2ccccc2)C=C1.ClC(Cl)=C(Cl)Cl>>ClC=C(Cl)Cl.[Cl-].c1ccc(C[n+]2ccc(-c3cc[n+](Cc4ccccc4)cc3)cc2)cc1,1.5,0.0995457238791212,33.5,8.0,1.21.99.5,66821.0,0.1760912590556812,C1=CN(Cc2ccccc2)C=CC1C1C=CN(Cc2ccccc2)C=C1.ClC(Cl)=C(Cl)Cl,ClC=C(Cl)Cl.[Cl-].c1ccc(C[n+]2ccc(-c3cc[n+](Cc4ccccc4)cc3)cc2)cc1,1.3096301674258988,C1=CN(Cc2ccccc2)C=CC1C1C=CN(Cc2ccccc2)C=C1.ClC(Cl)=C(Cl)Cl__MEKKKKPELSRRDFGKLIIGGGAAATIAPFGVPGANAAEKEKNAAEIRQQFAMTAGSPIIVNDKLERYAEVRTAFTHPTSFFKPNYKGEVKPWFLSAYDEKVRQIENGENGPKMKAKNVGEARAGRALEAAGWTLDINYGNIYPNRFFMLWSGETMTNTQLWAPVGLDRRPPDTTDPVELTNYVKFAARMAGADLVGVARLNRNWVYSEAVTIPADVPYEQSLHKEIEKPIVFKDVPLPIETDDELIIPNTCENVIVAGIAMNREMMQTAPNSMACATTAFCYSRMCMFDMWLCQFIRYMGYYAIPSCNGVGQSVAFAVEAGLGQASRMGACITPEFGPNVRLTKVFTNMPLVPDKPIDFGVTEFCETCKKCARECPSKAITEGPRTFEGRSIHNQSGKLQWQNDYNKCLGYWPESGGYCGVCVAVCPFTKGNIWIHDGVEWLIDNTRFLDPLMLGMDDALGYGAKRNITEVWDGKINTYGLDADHFRDTVSFRKDRVKKS,./data/raw/alphafold//AF-O68252-F1-model_v4.pdb,1066,631,306,340
+163,4959,5031,MTIYNINLGIGWASSGVEYAQAYRAGVFRKLNLSSKFIFTDMILADNIQHLTANIGFDDNQVIWLYNHFTDIKIAPTSVTVDDVLAYFGGEESHREKNGKVLRVFFFDQDKFVTCYLVDENKDLVQHAEYVFKGNLIRKDYFSYTRYCSEYFAPKDNVAVLYQRTFYNEDGTPVYDILMNQGKEEVYHFKDKIFYGKQAFVRAFMKSLNLNKSDLVILDRETGIGQVVFEEAQTAHLAVVVHAEHYSENATNEDYILWNNYYDYQFTNADKVDFFIVSTDRQNEVLQEQFAKYTQHQPKIVTIPVGSIDSLTDSSQGRKPFSLITASRLAKEKHIDWLVKAVIEAHKELPELTFDIYGSGGEDSLLREIIANHQAEDYIQLKGHAELSQIYSQYEVYLTASTSEGFGLTLMEAIGSGLPLIGFDVPYGNQTFIEDGQNGYLIPSSSDHVEDQIKQAYAAKICQLYQENRLEAMRAYSYQIAEGFLTKEILEKWKKTVEEVLHD,brenda,A0A0H2URG7,CC(O)=N[C@H]1[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O.C[C@@H](O)[C@H](N=C(O)[C@H](CO)N=C(O)[C@@H](N=C(O)[C@H](CO)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CO)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CO)N=C(O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)O>>CC(O)=N[C@H]1C(Oc2ccc(C[C@H](N)C(O)=N[C@@H](CO)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CO)C(=O)N3CCC[C@H]3C(O)=N[C@@H](CO)C(O)=N[C@H](C(O)=N[C@@H](CO)C(O)=N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)cc2)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](O)[C@H]1O,1.25,0.0,37.0,7.5,2.4.1.255,170187.0,0.0969100130080564,CC(O)=N[C@H]1[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O.C[C@@H](O)[C@H](N=C(O)[C@H](CO)N=C(O)[C@@H](N=C(O)[C@H](CO)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CO)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CO)N=C(O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)O,CC(O)=N[C@H]1C(Oc2ccc(C[C@H](N)C(O)=N[C@@H](CO)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H](CO)C(=O)N3CCC[C@H]3C(O)=N[C@@H](CO)C(O)=N[C@H](C(O)=N[C@@H](CO)C(O)=N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)cc2)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](O)[C@H]1O,0.0969100130080564,CC(O)=N[C@H]1[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(O)nc3=O)[C@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O.C[C@@H](O)[C@H](N=C(O)[C@H](CO)N=C(O)[C@@H](N=C(O)[C@H](CO)N=C(O)[C@@H]1CCCN1C(=O)[C@H](CO)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CO)N=C(O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)O__MTIYNINLGIGWASSGVEYAQAYRAGVFRKLNLSSKFIFTDMILADNIQHLTANIGFDDNQVIWLYNHFTDIKIAPTSVTVDDVLAYFGGEESHREKNGKVLRVFFFDQDKFVTCYLVDENKDLVQHAEYVFKGNLIRKDYFSYTRYCSEYFAPKDNVAVLYQRTFYNEDGTPVYDILMNQGKEEVYHFKDKIFYGKQAFVRAFMKSLNLNKSDLVILDRETGIGQVVFEEAQTAHLAVVVHAEHYSENATNEDYILWNNYYDYQFTNADKVDFFIVSTDRQNEVLQEQFAKYTQHQPKIVTIPVGSIDSLTDSSQGRKPFSLITASRLAKEKHIDWLVKAVIEAHKELPELTFDIYGSGGEDSLLREIIANHQAEDYIQLKGHAELSQIYSQYEVYLTASTSEGFGLTLMEAIGSGLPLIGFDVPYGNQTFIEDGQNGYLIPSSSDHVEDQIKQAYAAKICQLYQENRLEAMRAYSYQIAEGFLTKEILEKWKKTVEEVLHD,./data/raw/alphafold//AF-A0A0H2URG7-F1-model_v4.pdb,3042,1795,3421,2228
+164,1785,1816,MDYEKFLLFGDSITEFAFNTRPIEDGKDQYALGAALVNEYTRKMDILQRGFKGYTSRWALKILPEILKHESNIVMATIFLGANDACSAGPQSVPLPEFIDNIRQMVSLMKSYHIRPIIIGPGLVDREKWEKEKSEEIALGYFRTNENFAIYSDALAKLANEEKVPFVALNKAFQQEGGDAWQQLLTDGLHFSGKGYKIFHDELLKVIETFYPQYHPKNMQYKLKDWRDVLDDGSNIMS,sabio,P41734,CC(=O)OCCC(C)C.O>>CC(=O)O.CC(C)CCO,179.0,0.0,25.0,6.0,3.1.-.-,4932.0,2.2528530309798933,CC(=O)OCCC(C)C.O,CC(=O)O.CC(C)CCO,2.2528530309798933,CC(=O)OCCC(C)C.O__MDYEKFLLFGDSITEFAFNTRPIEDGKDQYALGAALVNEYTRKMDILQRGFKGYTSRWALKILPEILKHESNIVMATIFLGANDACSAGPQSVPLPEFIDNIRQMVSLMKSYHIRPIIIGPGLVDREKWEKEKSEEIALGYFRTNENFAIYSDALAKLANEEKVPFVALNKAFQQEGGDAWQQLLTDGLHFSGKGYKIFHDELLKVIETFYPQYHPKNMQYKLKDWRDVLDDGSNIMS,./data/raw/alphafold//AF-P41734-F1-model_v4.pdb,1417,930,729,1024
+165,17816,18061,MALSKISPTEGSRRILEDHHIDEDVGFALPHPLVELPDAYSPWVLVARNLPVLIENGQLREEVEKLPTLSTDGLRGHRLQRLAHLALGYITMAYVWNRGDDDVRKVLPRNIAVPYCELSEKLGLPPILSYADCVLANWKKKDPNGPMTYENMDILFSFPGGDCDKGFFLVSLLVEIAASPAIKAIPTVSSAVERQDLKALEKALHDIATSLEKAKEIFKRMRDFVDPDTFFHVLRIYLSGWKCSSKLPEGLLYEGVWDTPKMFSGGSAGQSSIFQSLDVLLGIKHEAGKESPAEFLQEMREYMPPAHRNFLFFLESAPPVREFVISRHNEDLTKAYNECVNGLVSVRKFHLAIVDTYIMKPSKKKPTDGDKSEEPSNVESRGTGGTNPMTFLRSVKDTTEKALLSWP,uniprot_search,P28776,Nc1ccccc1C(=O)C[C@H](N)C(=O)O>>,0.002,99.52202736871288,37.0,6.9,1.13.11.52,10090.0,-2.6989700043360187,Nc1ccccc1C(=O)C[C@H](N)C(=O)O,,-2.6989700043360187,Nc1ccccc1C(=O)C[C@H](N)C(=O)O__MALSKISPTEGSRRILEDHHIDEDVGFALPHPLVELPDAYSPWVLVARNLPVLIENGQLREEVEKLPTLSTDGLRGHRLQRLAHLALGYITMAYVWNRGDDDVRKVLPRNIAVPYCELSEKLGLPPILSYADCVLANWKKKDPNGPMTYENMDILFSFPGGDCDKGFFLVSLLVEIAASPAIKAIPTVSSAVERQDLKALEKALHDIATSLEKAKEIFKRMRDFVDPDTFFHVLRIYLSGWKCSSKLPEGLLYEGVWDTPKMFSGGSAGQSSIFQSLDVLLGIKHEAGKESPAEFLQEMREYMPPAHRNFLFFLESAPPVREFVISRHNEDLTKAYNECVNGLVSVRKFHLAIVDTYIMKPSKKKPTDGDKSEEPSNVESRGTGGTNPMTFLRSVKDTTEKALLSWP,./data/raw/alphafold//AF-P28776-F1-model_v4.pdb,2630,3525,2237,5121
+166,21573,21898,MGSEALVHVLLVSFPGQGHVNPLLRLGKRLASKGLLVTFTTPESIGKAMRKASNIGEELSPVGDGFIRFEFFEDGWDEDETRRQDLDQYLPQLEKVGKVLIPEMIRRNAEQGRPISCLINNPFIPWVSDVADSLGLPSAMLWVQSCACFTSYYYYYHGLVPFPSETAMEIDVQLPCMPLLKHDEVPSFLYPTTPYPFLRRAIMGQYKNLDKPFCILMDTFQELEHEIIEYMSKISPIKTVGPLFKNPKAPNATVKGDFMKADDCVGWLDSKPASSIVYVSFGSVVYLKQDQWDEIAYGLLNSGVNFLWVMKPPHKDSGYEVLKMPEGFLEKAGDRGKVVQWSPQEQVLAHPSVACFVTHCGWNSTMEALTSGMPVVAFPQWGDQVTDAKYLVDVFKVGVRMCRGEAENKLITRDVVEQCLREATSGPKAEEMKQNAKKWSAAAEAAVAEGGSSDRNIQAFVDEVKRRSLEVLAASGKSTANGGADLANKVAGNGVAELGEPKVNGELKVVS,brenda,A0A2Z5V6P3,O=C(O)c1cc(O)c(O)c(O)c1.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=C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1cc(O)c(O)c(O)c1.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,10.7,1.5427255221260327e-14,30.0,6.0,2.4.1.136,34316.0,1.0293837776852095,O=C(O)c1cc(O)c(O)c(O)c1.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=C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1cc(O)c(O)c(O)c1.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,1.0293837776852095,O=C(O)c1cc(O)c(O)c(O)c1.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__MGSEALVHVLLVSFPGQGHVNPLLRLGKRLASKGLLVTFTTPESIGKAMRKASNIGEELSPVGDGFIRFEFFEDGWDEDETRRQDLDQYLPQLEKVGKVLIPEMIRRNAEQGRPISCLINNPFIPWVSDVADSLGLPSAMLWVQSCACFTSYYYYYHGLVPFPSETAMEIDVQLPCMPLLKHDEVPSFLYPTTPYPFLRRAIMGQYKNLDKPFCILMDTFQELEHEIIEYMSKISPIKTVGPLFKNPKAPNATVKGDFMKADDCVGWLDSKPASSIVYVSFGSVVYLKQDQWDEIAYGLLNSGVNFLWVMKPPHKDSGYEVLKMPEGFLEKAGDRGKVVQWSPQEQVLAHPSVACFVTHCGWNSTMEALTSGMPVVAFPQWGDQVTDAKYLVDVFKVGVRMCRGEAENKLITRDVVEQCLREATSGPKAEEMKQNAKKWSAAAEAAVAEGGSSDRNIQAFVDEVKRRSLEVLAASGKSTANGGADLANKVAGNGVAELGEPKVNGELKVVS,./data/raw/alphafold//AF-A0A2Z5V6P3-F1-model_v4.pdb,3539,3480,1258,3201
+167,18156,18412,MKIYLVGGAVRDALLGLPVKDRDWVVVGSTPQEMLDAGYQQVGRDFPVFLHPQTHEEYALARTERKSGSGYTGFTCYAAPDVTLEDDLKRRDLTINALAQDDNGEIIDPYNGLGDLQNRLLRHVSPAFGEDPLRVLRVARFAARYAHLGFRIADETLALMREMTHAGELEHLTPERVWKETESALTTRNPQVFFQVLRDCGALRVLFPEIDALFGVPAPAKWHPEIDTGIHTLMTLSMAAMLSPQVDVRFATLCHDLGKGLTPPELWPRHHGHGPAGVKLVEQLCQRLRVPNEIRDLARLVAEFHDLIHTFPMLNPKTIVKLFDSIDAWRKPQRVEQLALTSEADVRGRTGFESADYPQGRWLREAWEVAQSVPTKAVVEAGFKGVEIREELTRRRIAAVASWKEQRCPKPE,sabio,P06961,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,3.78,1.0812962383427719e-14,37.0,7.5,3.1.3.-,562.0,0.5774917998372253,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,0.5774917998372253,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O__MKIYLVGGAVRDALLGLPVKDRDWVVVGSTPQEMLDAGYQQVGRDFPVFLHPQTHEEYALARTERKSGSGYTGFTCYAAPDVTLEDDLKRRDLTINALAQDDNGEIIDPYNGLGDLQNRLLRHVSPAFGEDPLRVLRVARFAARYAHLGFRIADETLALMREMTHAGELEHLTPERVWKETESALTTRNPQVFFQVLRDCGALRVLFPEIDALFGVPAPAKWHPEIDTGIHTLMTLSMAAMLSPQVDVRFATLCHDLGKGLTPPELWPRHHGHGPAGVKLVEQLCQRLRVPNEIRDLARLVAEFHDLIHTFPMLNPKTIVKLFDSIDAWRKPQRVEQLALTSEADVRGRTGFESADYPQGRWLREAWEVAQSVPTKAVVEAGFKGVEIREELTRRRIAAVASWKEQRCPKPE,./data/raw/alphafold//AF-P06961-F1-model_v4.pdb,2369,4742,4791,4631
+168,18717,18990,MATPPKRGRLEGRVKKIAVEGNIAAGKSTFVNILKQADEGWEVVPEPVARWCNVQQNSEEDCEELTTSQKSGGNVLQMMYEKPERWSFTFQMYACLSRIRAQLKSIDGKLREAENPVVFFERSVYSDRYIFAANLYESDCMNETEWTIYQDWHDWMNKQFGQSLALDGIIYLRATPEKCLNRIYLRGRDEEQEIPIEYLEKLHYKHESWLQHKTLRTDFEYLQEIPILTLDVNEDFKGKKDRYDHMTEKVKEFLSTL,brenda,Q5ZMF3,Nc1ncnc2c1ncn2[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>>Nc1ncnc2c1ncn2[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,4.07,0.0,32.0,7.5,2.7.1.74,9031.0,0.6095944092252201,Nc1ncnc2c1ncn2[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,Nc1ncnc2c1ncn2[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,0.6095944092252201,Nc1ncnc2c1ncn2[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__MATPPKRGRLEGRVKKIAVEGNIAAGKSTFVNILKQADEGWEVVPEPVARWCNVQQNSEEDCEELTTSQKSGGNVLQMMYEKPERWSFTFQMYACLSRIRAQLKSIDGKLREAENPVVFFERSVYSDRYIFAANLYESDCMNETEWTIYQDWHDWMNKQFGQSLALDGIIYLRATPEKCLNRIYLRGRDEEQEIPIEYLEKLHYKHESWLQHKTLRTDFEYLQEIPILTLDVNEDFKGKKDRYDHMTEKVKEFLSTL,./data/raw/alphafold//AF-Q5ZMF3-F1-model_v4.pdb,2050,4218,4089,3937
+169,12350,12520,MSTAGDGERGTVGQEDSAAARPFRFSPEPTLEDIRRLHAEFAAERDWEQFHQPRNLLLALVGEVGELAELFQWKSDTEPGPQAWPPKERAALQEELSDVLIYLVALAARCHVDLPQAVISKMDTNRQRYPVHLSRGSACKYTDLPRGTISENQAVGAGDPASELRDQAST,brenda,Q9QY93,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O.O>>Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)c(=O)nc1O.O=P(O)(O)OP(=O)(O)O,0.76,5.6765876673272326e-15,30.0,8.0,3.6.1.12,10090.0,-0.1191864077192086,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O.O,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)c(=O)nc1O.O=P(O)(O)OP(=O)(O)O,-0.1191864077192086,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O.O__MSTAGDGERGTVGQEDSAAARPFRFSPEPTLEDIRRLHAEFAAERDWEQFHQPRNLLLALVGEVGELAELFQWKSDTEPGPQAWPPKERAALQEELSDVLIYLVALAARCHVDLPQAVISKMDTNRQRYPVHLSRGSACKYTDLPRGTISENQAVGAGDPASELRDQAST,./data/raw/alphafold//AF-Q9QY93-F1-model_v4.pdb,2067,4244,4120,3971
+170,12115,12278,MNNNSSKQSLRIGIVGGGISGVALALDLCRNSDVEVQLFEAAPAFGEVGAGVAFGANSVRALNGLGIGDAYRKVEDRTPAPWEDVWFEWRHGTGESKYLATTVMPGMGQSTVHRADFLDVLTTHLPAGIAQFNKRAVGVEQNGNEARVTFADGTDYRCDLLIAADGIKSALRAHVLEGINAEPAEPRFTGTCAYRGMIDSDTLRAAYRAKGINTHLVDVPQMYLVKDGHILTFPVKQGRIINVVAFLSDRSSATPQWPADAPWVRKTTQAQMLEDFAEWGEAARTLLECIPEPTYWALHDLAELPGYVHNRVVLIGDAAHAMLPHQGAGAGQGLEDAYFLARLLGDSRLTADNLPAVLTTYDELRRPRACKVQRTSWQAGELYEMRDPEIGADEQALAAKLESRFNWLWNHDPETDVVEARARLGWGNAVRRILIVCAQTGVRPGDTPAQITITRRAMPCELST,brenda,Q0VH44,Cc1ccc(C(=O)O)c([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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=O.[H+]>>Cc1ccc(O)c(O)c1.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,6.4,0.0592525014783689,25.0,6.4,1.14.13.1,395598.0,0.8061799739838872,Cc1ccc(C(=O)O)c([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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=O.[H+],Cc1ccc(O)c(O)c1.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,0.8061799739838872,Cc1ccc(C(=O)O)c([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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=O.[H+]__MNNNSSKQSLRIGIVGGGISGVALALDLCRNSDVEVQLFEAAPAFGEVGAGVAFGANSVRALNGLGIGDAYRKVEDRTPAPWEDVWFEWRHGTGESKYLATTVMPGMGQSTVHRADFLDVLTTHLPAGIAQFNKRAVGVEQNGNEARVTFADGTDYRCDLLIAADGIKSALRAHVLEGINAEPAEPRFTGTCAYRGMIDSDTLRAAYRAKGINTHLVDVPQMYLVKDGHILTFPVKQGRIINVVAFLSDRSSATPQWPADAPWVRKTTQAQMLEDFAEWGEAARTLLECIPEPTYWALHDLAELPGYVHNRVVLIGDAAHAMLPHQGAGAGQGLEDAYFLARLLGDSRLTADNLPAVLTTYDELRRPRACKVQRTSWQAGELYEMRDPEIGADEQALAAKLESRFNWLWNHDPETDVVEARARLGWGNAVRRILIVCAQTGVRPGDTPAQITITRRAMPCELST,./data/raw/alphafold//AF-Q0VH44-F1-model_v4.pdb,1993,4149,4015,3857
+171,18988,19273,MTAPSQVLKIRRPDDWHLHLRDGDMLKTVVPYTSEIYGRAIVMPNLAPPVTTVEAAVAYRQRILDAVPAGHDFTPLMTCYLTDSLDPNELERGFNEGVFTAAKLYPANATTNSSHGVTSIDAIMPVLERMEKIGMPLLVHGEVTHADIDIFDREARFIESVMEPLRQRLTALKVVFEHITTKDAADYVRDGNERLAATITPQHLMFNRNHMLVGGVRPHLYCLPILKRNIHQQALRELVASGFNRVFLGTDSAPHARHRKESSCGCAGCFNAPTALGSYATVFEEMNALQHFEAFCSVNGPQFYGLPVNDTFIELVREEQQVAESIALTDDTLVPFLAGETVRWSVKQ,sabio,P05020,O>>NC(=O)NC(CC(=O)O)C(=O)O,4.4,81.02417201744362,,8.0,3.5.2.3,562.0,0.6434526764861874,O,NC(=O)NC(CC(=O)O)C(=O)O,0.6434526764861874,O__MTAPSQVLKIRRPDDWHLHLRDGDMLKTVVPYTSEIYGRAIVMPNLAPPVTTVEAAVAYRQRILDAVPAGHDFTPLMTCYLTDSLDPNELERGFNEGVFTAAKLYPANATTNSSHGVTSIDAIMPVLERMEKIGMPLLVHGEVTHADIDIFDREARFIESVMEPLRQRLTALKVVFEHITTKDAADYVRDGNERLAATITPQHLMFNRNHMLVGGVRPHLYCLPILKRNIHQQALRELVASGFNRVFLGTDSAPHARHRKESSCGCAGCFNAPTALGSYATVFEEMNALQHFEAFCSVNGPQFYGLPVNDTFIELVREEQQVAESIALTDDTLVPFLAGETVRWSVKQ,./data/raw/alphafold//AF-P05020-F1-model_v4.pdb,2303,4640,4668,4497
+172,6776,6890,MKDEVALLATVTLVGVLLQAYFSLQVISARRAFHVSPPLTSGPPEFERVFRAQVNCSEYFPLFLATLWVAGIFFHEGAAALCGLFYLFARLRYFQGYARSAQLRLTPLYASARALWLLVAMAALGLLVHFLPGTLRTALFRWLQMLLPMA,brenda,Q60860,CCCCC/C=C\C/C=C\C=C\C=C\[C@@H]1O[C@H]1CCCC(=O)OC.N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O>>CCCCC/C=C\C/C=C\C=C\C=C\[C@@H](SCC(N=C(O)CCC(N)C(=O)O)C(O)=NCC(=O)O)[C@@H](O)CCCC(=O)OC,84.0,8.87745643698822e-15,31.0,7.45,4.4.1.20,10090.0,1.9242792860618816,CCCCC/C=C\C/C=C\C=C\C=C\[C@@H]1O[C@H]1CCCC(=O)OC.N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O,CCCCC/C=C\C/C=C\C=C\C=C\[C@@H](SCC(N=C(O)CCC(N)C(=O)O)C(O)=NCC(=O)O)[C@@H](O)CCCC(=O)OC,1.9242792860618816,CCCCC/C=C\C/C=C\C=C\C=C\[C@@H]1O[C@H]1CCCC(=O)OC.N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O__MKDEVALLATVTLVGVLLQAYFSLQVISARRAFHVSPPLTSGPPEFERVFRAQVNCSEYFPLFLATLWVAGIFFHEGAAALCGLFYLFARLRYFQGYARSAQLRLTPLYASARALWLLVAMAALGLLVHFLPGTLRTALFRWLQMLLPMA,./data/raw/alphafold//AF-Q60860-F1-model_v4.pdb,3265,2095,3758,2617
+173,6439,6550,MTNIRVAIVGYGNLGRSVEKLIAKQPDMDLVGIFSRRATLDTKTPVFDVADVDKHADDVDVLFLCMGSATDIPEQAPKFAQFACTVDTYDNHRDIPRHRQVMNEAATAAGNVALVSTGWDPGMFSINRVYAAAVLAEHQQHTFWGPGLSQGHSDALRRIPGVQKAVQYTLPSEDALEKARRGEAGDLTGKQTHKRQCFVVADAADHERIENDIRTMPDYFVGYEVEVNFIDEATFDSEHTGMPHGGHVITTGDTGGFNHTVEYILKLDRNPDFTASSQIAFGRAAHRMKQQGQSGAFTVLEVAPYLLSPENLDDLIARDV,brenda,P04964,CCCC(=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+]>>CCC[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)c1,0.93,0.9767755208234647,30.0,8.45,1.4.1.16,1718.0,-0.0315170514460648,CCCC(=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+],CCC[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,-0.0315170514460648,CCCC(=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
+174,4348,4403,MSDDFLWFEGIAFPTMGFRSETLRKVRDEFVIRDEDVIILTYPKSGTNWLAEILCLMHSKGDAKWIQSVPIWERSPWVESEIGYTALSETESPRLFSSHLPIQLFPKSFFSSKAKVIYLMRNPRDVLVSGYFFWKNMKFIKKPKSWEEYFEWFCQGTVLYGSWFDHIHGWMPMREEKNFLLLSYEELKQDTGRTIEKICQFLGKTLEPEELNLILKNSSFQSMKENKMSNYSLLSVDYVVDKAQLLRKGVSGDWKNHFTVAQAEDFDKLFQEKMADLPRELFPWE,sabio,Q06520,CC(C)[C@H](CC[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)OS(=O)(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O>>CC(C)C(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)OS(=O)(=O)[O-].Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(OP(=O)(O)O)C1O.[H],144600.0,0.0509096051475171,37.0,7.4,2.8.2.2,9606.0,5.160168292958512,CC(C)[C@H](CC[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)OS(=O)(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O,CC(C)C(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)OS(=O)(=O)[O-].Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(OP(=O)(O)O)C1O.[H],5.160168292958512,CC(C)[C@H](CC[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)OS(=O)(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O__MSDDFLWFEGIAFPTMGFRSETLRKVRDEFVIRDEDVIILTYPKSGTNWLAEILCLMHSKGDAKWIQSVPIWERSPWVESEIGYTALSETESPRLFSSHLPIQLFPKSFFSSKAKVIYLMRNPRDVLVSGYFFWKNMKFIKKPKSWEEYFEWFCQGTVLYGSWFDHIHGWMPMREEKNFLLLSYEELKQDTGRTIEKICQFLGKTLEPEELNLILKNSSFQSMKENKMSNYSLLSVDYVVDKAQLLRKGVSGDWKNHFTVAQAEDFDKLFQEKMADLPRELFPWE,./data/raw/alphafold//AF-Q06520-F1-model_v4.pdb,2909,1625,3224,2001
+175,14817,15026,MAVENEGVLLVLSSPSGAGKTTILERLLERSTNLVRSVSMTTRKPRPGEINGKDYFFVTKKEFHELCEAGQMLEYARVFENFYGIPKSFIEQNLSSGISVLLSIDWQGAFHLFELMREKVISVFILPPSMEELRLRLQKRNSDSASEIEHRLAEAQKEMSKRDKYDYVVINDDIDKSVEEISSILDKERLKRSGV,brenda,Q5GS56,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)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)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,1500.0,0.0,25.0,7.5,2.7.4.8,6279.0,3.1760912590556813,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)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)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,3.1760912590556813,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MAVENEGVLLVLSSPSGAGKTTILERLLERSTNLVRSVSMTTRKPRPGEINGKDYFFVTKKEFHELCEAGQMLEYARVFENFYGIPKSFIEQNLSSGISVLLSIDWQGAFHLFELMREKVISVFILPPSMEELRLRLQKRNSDSASEIEHRLAEAQKEMSKRDKYDYVVINDDIDKSVEEISSILDKERLKRSGV,./data/raw/alphafold//AF-Q5GS56-F1-model_v4.pdb,2482,4912,4985,4839
+176,19378,19664,MQGLLILSVLLGAALGKEDFVGHQVLRITAADEAEVQTVKELEDLEHLQLDFWRGPGQPGSPIDVRVPFPSLQAVKVFLEAHGIRYRIMIEDVQSLLDEEQEQMFASQSRARSTNTFNYATYHTLDEIYDFMDLLVAEHPQLVSKLQIGRSYEGRPIYVLKFSTGGSNRPAIWIDLGIHSREWITQATGVWFAKKFTEDYGQDPSFTAILDSMDIFLEIVTNPDGFAFTHSQNRLWRKTRSVTSSSLCVGVDANRNWDAGFGKAGASSSPCSETYHGKYANSEVEVKSIVDFVKDHGNFKAFLSIHSYSQLLLYPYGYTTQSIPDKTELNQVAKSAVEALKSLYGTSYKYGSIITTIYQASGGSIDWSYNQGIKYSFTFELRDTGRYGFLLPASQIIPTAQETWLGVLTIMEHTLNNLY,uniprot_search,P00730,O.O=C(OC(C(=O)O)c1ccccc1)/C(=C/c1ccccc1)Nc1cccc2ccccc12>>O=C(O)/C(=C/c1ccccc1)Nc1cccc2ccccc12,0.276,20.79058015870088,34.0,7.57,3.4.17.1,9913.0,-0.5590909179347823,O.O=C(OC(C(=O)O)c1ccccc1)/C(=C/c1ccccc1)Nc1cccc2ccccc12,O=C(O)/C(=C/c1ccccc1)Nc1cccc2ccccc12,-0.5590909179347823,O.O=C(OC(C(=O)O)c1ccccc1)/C(=C/c1ccccc1)Nc1cccc2ccccc12__MQGLLILSVLLGAALGKEDFVGHQVLRITAADEAEVQTVKELEDLEHLQLDFWRGPGQPGSPIDVRVPFPSLQAVKVFLEAHGIRYRIMIEDVQSLLDEEQEQMFASQSRARSTNTFNYATYHTLDEIYDFMDLLVAEHPQLVSKLQIGRSYEGRPIYVLKFSTGGSNRPAIWIDLGIHSREWITQATGVWFAKKFTEDYGQDPSFTAILDSMDIFLEIVTNPDGFAFTHSQNRLWRKTRSVTSSSLCVGVDANRNWDAGFGKAGASSSPCSETYHGKYANSEVEVKSIVDFVKDHGNFKAFLSIHSYSQLLLYPYGYTTQSIPDKTELNQVAKSAVEALKSLYGTSYKYGSIITTIYQASGGSIDWSYNQGIKYSFTFELRDTGRYGFLLPASQIIPTAQETWLGVLTIMEHTLNNLY,./data/raw/alphafold//AF-P00730-F1-model_v4.pdb,3735,2714,3142,2100
+177,15110,15322,MKVIVLGSSHGGYEAVEELLNLHPDAEIQWYEKGDFISFLSCGMQLYLEGKVKDVNSVRYMTGEKMESRGVNVFSNTEITAIQPKEHQVTVKDLVSGEERVENYDKLIISPGAVPFELDIPGKDLDNIYLMRGRQWAIKLKQKTVDPEVNNVVVIGSGYIGIEAAEAFAKAGKKVTVIDILDRPLGVYLDKEFTDVLTEEMEANNITIATGETVERYEGDGRVQKIVTDKNAYDADLVVVAVGVRPNTAWLKGTLELHPNGLIKTDEYMRTSEPDVFAVGDATLIKYNPADTEVNIALATNARKQGRFAVKNLEEPVKPFPGVQGSSGLAVFDYKFASTGINEVMAQKLGKETKAVTVVEDYLMDFNPDKQKAWFKLVYDPETTQILGAQLMSKADLTANINAISLAIQAKMTIEDLAYADFFFQPAFDKPWNIINTAALEAVKQER,sabio,P37062,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C1C=CC(=O)c2ccccc21.[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.Oc1ccc(O)c2ccccc12,3.4,6.8891928180252316e-15,25.0,7.5,1.11.1.1,1351.0,0.5314789170422551,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C1C=CC(=O)c2ccccc21.[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.Oc1ccc(O)c2ccccc12,0.5314789170422551,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C1C=CC(=O)c2ccccc21.[H]__MKVIVLGSSHGGYEAVEELLNLHPDAEIQWYEKGDFISFLSCGMQLYLEGKVKDVNSVRYMTGEKMESRGVNVFSNTEITAIQPKEHQVTVKDLVSGEERVENYDKLIISPGAVPFELDIPGKDLDNIYLMRGRQWAIKLKQKTVDPEVNNVVVIGSGYIGIEAAEAFAKAGKKVTVIDILDRPLGVYLDKEFTDVLTEEMEANNITIATGETVERYEGDGRVQKIVTDKNAYDADLVVVAVGVRPNTAWLKGTLELHPNGLIKTDEYMRTSEPDVFAVGDATLIKYNPADTEVNIALATNARKQGRFAVKNLEEPVKPFPGVQGSSGLAVFDYKFASTGINEVMAQKLGKETKAVTVVEDYLMDFNPDKQKAWFKLVYDPETTQILGAQLMSKADLTANINAISLAIQAKMTIEDLAYADFFFQPAFDKPWNIINTAALEAVKQER,./data/raw/alphafold//AF-P37062-F1-model_v4.pdb,2546,1932,3576,2409
+178,17115,17345,MSNTVRAISPDITLFNKTLTFQEISQNTREAVIYIHGGAWNDPENTPNDFNQLANTIKSMDTESTVCQYSIEYRLSPEITNPRNLYDAVSNITRLVKEKGLTNINMVGHSVGATFIWQILAALKDPQEKMSEAQLQMLGLLQIVKRVFLLDGIYSLKELLVEYPEYDCFTRLAFPDGIQMYEEEPSRVMPYVKKALSRFSIDMHLVHSYSDELLTLRQTNCLISCLQDYQLSFKLYLDDLGLHNDVYKNGKVAKYIFDNIC,brenda,Q04066,N[C@@H](CC(=O)c1ccccc1N=CO)C(=O)O.O>>Nc1ccccc1C(=O)C[C@H](N)C(=O)O.O=CO,161.0,5.578528360145563e-15,30.0,7.333333333333333,3.5.1.9,4932.0,2.206825876031849,N[C@@H](CC(=O)c1ccccc1N=CO)C(=O)O.O,Nc1ccccc1C(=O)C[C@H](N)C(=O)O.O=CO,2.206825876031849,N[C@@H](CC(=O)c1ccccc1N=CO)C(=O)O.O__MSNTVRAISPDITLFNKTLTFQEISQNTREAVIYIHGGAWNDPENTPNDFNQLANTIKSMDTESTVCQYSIEYRLSPEITNPRNLYDAVSNITRLVKEKGLTNINMVGHSVGATFIWQILAALKDPQEKMSEAQLQMLGLLQIVKRVFLLDGIYSLKELLVEYPEYDCFTRLAFPDGIQMYEEEPSRVMPYVKKALSRFSIDMHLVHSYSDELLTLRQTNCLISCLQDYQLSFKLYLDDLGLHNDVYKNGKVAKYIFDNIC,./data/raw/alphafold//AF-Q04066-F1-model_v4.pdb,2749,5293,2554,5374
+179,10321,10473,MVSGTVGRGTALGAVLLALLAVPAQAGTAAAADLPAPDDTGLQAVLHTALSQGAPGAMVRVDDNGTIHQLSEGVADRATGRAITTTDRFRVGSVTKSFSAVVLLQLVDEGKLDLDASVNTYLPGLLPDDRITVRQVMSHRSGLYDYTNDMFAQTVPGFESVRNKVFSYQDLITLSLKHGVTNAPGAAYSYSNTNFVVAGMLIEKLTGHSVATEYQNRIFTPLNLTDTFYVHPDTVIPGTHANGYLTPDEAGGALVDSTEQTVSWAQSAGAVISSTQDLDTFFSALMSGQLMSAAQLAQMQQWTTVNSTQGYGLGLRRRDLSCGISVYGHTGTVQGYYTYAFASKDGKRSVTALANTSNNVNVLNTMARTLESAFCGKPTTAKLRSATSSATTVERHEDIAPGIARD,uniprot_search,P15555,C[C@@H](N=C(O)CCSC[C@H](N=C(O)CN)C(=O)O)C(=O)S[C@H](C)C(=O)O.O>>C[C@@H](N=C(O)CCSC[C@H](NOC(=O)CN)C(=O)O)C(=O)O.C[C@@H](S)C(=O)O,42.0,1.83474560235595,25.0,7.5,3.4.16.4,31952.0,1.6232492903979006,C[C@@H](N=C(O)CCSC[C@H](N=C(O)CN)C(=O)O)C(=O)S[C@H](C)C(=O)O.O,C[C@@H](N=C(O)CCSC[C@H](NOC(=O)CN)C(=O)O)C(=O)O.C[C@@H](S)C(=O)O,1.6232492903979006,C[C@@H](N=C(O)CCSC[C@H](N=C(O)CN)C(=O)O)C(=O)S[C@H](C)C(=O)O.O__MVSGTVGRGTALGAVLLALLAVPAQAGTAAAADLPAPDDTGLQAVLHTALSQGAPGAMVRVDDNGTIHQLSEGVADRATGRAITTTDRFRVGSVTKSFSAVVLLQLVDEGKLDLDASVNTYLPGLLPDDRITVRQVMSHRSGLYDYTNDMFAQTVPGFESVRNKVFSYQDLITLSLKHGVTNAPGAAYSYSNTNFVVAGMLIEKLTGHSVATEYQNRIFTPLNLTDTFYVHPDTVIPGTHANGYLTPDEAGGALVDSTEQTVSWAQSAGAVISSTQDLDTFFSALMSGQLMSAAQLAQMQQWTTVNSTQGYGLGLRRRDLSCGISVYGHTGTVQGYYTYAFASKDGKRSVTALANTSNNVNVLNTMARTLESAFCGKPTTAKLRSATSSATTVERHEDIAPGIARD,./data/raw/alphafold//AF-P15555-F1-model_v4.pdb,2962,1702,3314,2115
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+198,16936,17166,MNKNNRHPADGKKPITIFGPDFPFAFDDWLEHPAGLGSIPAARHGEEVAIVGAGIAGLVAAYELMKLGLKPVVYEASKMGGRLRSQAFNGTDGIIAELGGMRFPVSSTAFYHYVDKLGLETKPFPNPLTPASRSTVIDLEGQTYYAEKAADLPALFQEVTDAWADALESGARFGDIQQAIRDRDVPRLKELWNTLVPLWDDRTFYDFVATSKAFAKLSFQHREVFGQVGFGTGGWDSDFPNSMLEIFRVVMTNCDDHQHLVVGGVEQVPQGIWRHVPERCAHWPEGTSLSSLHGGAPRTGVKRIARASDGRLAVTDNWGDCRHYAAVLTTCQSWLLTTQIDCEESLFSQKMWMALDRTRYMQSSKTFVMVDRPFWKDKDPETGRDLMSMTLTDRLTRGTYLFDNGDDKPGVICLSYAWMSDALKMLPHPVEKRVQLALDALKKIYPKTDIAGHIIGDPITISWEADPHFLGAFKGALPGHYRYNQRMYAHFMQAQMPVEQRGIFIAGDDVSWTPAWVEGAVQTSLNAVWGIMNHFGGKTHADNPGPGDVFDEIGQIALAD,brenda,W6JQJ6,NCCC[C@H](N)C(=O)O.O.O=O>>N.NCCCC(=O)C(=O)O.OO,1.5,7.779267509252452e-15,37.0,7.8,1.4.3.2,306.0,0.1760912590556812,NCCC[C@H](N)C(=O)O.O.O=O,N.NCCCC(=O)C(=O)O.OO,0.1760912590556812,NCCC[C@H](N)C(=O)O.O.O=O__MNKNNRHPADGKKPITIFGPDFPFAFDDWLEHPAGLGSIPAARHGEEVAIVGAGIAGLVAAYELMKLGLKPVVYEASKMGGRLRSQAFNGTDGIIAELGGMRFPVSSTAFYHYVDKLGLETKPFPNPLTPASRSTVIDLEGQTYYAEKAADLPALFQEVTDAWADALESGARFGDIQQAIRDRDVPRLKELWNTLVPLWDDRTFYDFVATSKAFAKLSFQHREVFGQVGFGTGGWDSDFPNSMLEIFRVVMTNCDDHQHLVVGGVEQVPQGIWRHVPERCAHWPEGTSLSSLHGGAPRTGVKRIARASDGRLAVTDNWGDCRHYAAVLTTCQSWLLTTQIDCEESLFSQKMWMALDRTRYMQSSKTFVMVDRPFWKDKDPETGRDLMSMTLTDRLTRGTYLFDNGDDKPGVICLSYAWMSDALKMLPHPVEKRVQLALDALKKIYPKTDIAGHIIGDPITISWEADPHFLGAFKGALPGHYRYNQRMYAHFMQAQMPVEQRGIFIAGDDVSWTPAWVEGAVQTSLNAVWGIMNHFGGKTHADNPGPGDVFDEIGQIALAD,./data/raw/alphafold//AF-W6JQJ6-F1-model_v4.pdb,2205,4432,4333,4215
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+203,20406,20711,MATKIVLVGAGSAQFGYGTLGDIFQSRALYGSEIILHDINPVALAVTEKTAKDFLAKEDLPFIVSATTDRRTALRGAEFVIISIEVGDRFALWDLDWQIPQQYGIQQVYGENGGPGGLFHSLRIIPPILDICADVADICPDAWIFNYSNPMSRICTTVHRRFPELNFVGMCHEIASLERYLPEMLNTSFDNLSLRAGGLNHFSVLLDARYKDSGKDAYADVRAKAPDYFASLPGYSDILAYTRQHGKLVDTEGSTERHALGGKDSSYPWADRTLFKEILEKFHCMPITVDSHFGEYISWAGEVSDHRGILDFYTFYRNYLGGVQPKIELKLKERVVSIMEGILTDSGYEEAAVNIPNRGFIKQLPEFIAVEVPAIIDRKGVHGIQVDIPPGIGGLLSNQIAIHDLTAEAIIAGSRDLVIQALLVDSVNNQCRAIPELVDVMISRQQPWLNYLK,sabio,Q9AI65,O.OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O>>OCC1OC(O)(CO)C(O)C1O.OCC1OC(O)C(O)C(O)C1O,960.0,0.0,25.0,7.5,3.2.1.20,55212.0,2.9822712330395684,O.OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O,OCC1OC(O)(CO)C(O)C1O.OCC1OC(O)C(O)C(O)C1O,2.9822712330395684,O.OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O__MATKIVLVGAGSAQFGYGTLGDIFQSRALYGSEIILHDINPVALAVTEKTAKDFLAKEDLPFIVSATTDRRTALRGAEFVIISIEVGDRFALWDLDWQIPQQYGIQQVYGENGGPGGLFHSLRIIPPILDICADVADICPDAWIFNYSNPMSRICTTVHRRFPELNFVGMCHEIASLERYLPEMLNTSFDNLSLRAGGLNHFSVLLDARYKDSGKDAYADVRAKAPDYFASLPGYSDILAYTRQHGKLVDTEGSTERHALGGKDSSYPWADRTLFKEILEKFHCMPITVDSHFGEYISWAGEVSDHRGILDFYTFYRNYLGGVQPKIELKLKERVVSIMEGILTDSGYEEAAVNIPNRGFIKQLPEFIAVEVPAIIDRKGVHGIQVDIPPGIGGLLSNQIAIHDLTAEAIIAGSRDLVIQALLVDSVNNQCRAIPELVDVMISRQQPWLNYLK,./data/raw/alphafold//AF-Q9AI65-F1-model_v4.pdb,235,2755,5068,5928
+204,1039,1065,MSYTVGTYLAERLVQIGLKHHFAVAGDYNLVLLDNLLLNKNMEQVYCCNELNCGFSAEGYARAKGAAAAVVTYSVGALSAFDAIGGAYAENLPVILISGAPNNNDHAAGHVLHHALGKTDYHYQLEMAKNITAAAEAIYTPEEAPAKIDHVIKTALREKKPVYLEIACNIASMPCAAPGPASALFNDEASDEASLNAAVEETLKFIANRDKVAVLVGSKLRAAGAEEAAVKFADALGGAVATMAAAKSFFPEENPHYIGTSWGEVSYPGVEKTMKEADAVIALAPVFNDYSTTGWTDIPDPKKLVLAEPRSVVVNGIRFPSVHLKDYLTRLAQKVSKKTGALDFFKSLNAGELKKAAPADPSAPLVNAEIARQVEALLTPNTTVIAETGDSWFNAQRMKLPNGARVEYEMQWGHIGWSVPAAFGYAVGAPERRNILMVGDGSFQLTAQEVAQMVRLKLPVIIFLINNYGYTIEVMIHDGPYNNIKNWDYAGLMEVFNGNGGYDSGAGKGLKAKTGGELAEAIKVALANTDGPTLIECFIGREDCTEELVKWGKRVAAANSRKPVNKLL,sabio,P06672,CC(=O)C(=O)O>>CC=O.O=C=O,486.0,8.023110767147313e-15,30.0,6.5,4.1.1.1,542.0,2.6866362692622934,CC(=O)C(=O)O,CC=O.O=C=O,2.6866362692622934,CC(=O)C(=O)O__MSYTVGTYLAERLVQIGLKHHFAVAGDYNLVLLDNLLLNKNMEQVYCCNELNCGFSAEGYARAKGAAAAVVTYSVGALSAFDAIGGAYAENLPVILISGAPNNNDHAAGHVLHHALGKTDYHYQLEMAKNITAAAEAIYTPEEAPAKIDHVIKTALREKKPVYLEIACNIASMPCAAPGPASALFNDEASDEASLNAAVEETLKFIANRDKVAVLVGSKLRAAGAEEAAVKFADALGGAVATMAAAKSFFPEENPHYIGTSWGEVSYPGVEKTMKEADAVIALAPVFNDYSTTGWTDIPDPKKLVLAEPRSVVVNGIRFPSVHLKDYLTRLAQKVSKKTGALDFFKSLNAGELKKAAPADPSAPLVNAEIARQVEALLTPNTTVIAETGDSWFNAQRMKLPNGARVEYEMQWGHIGWSVPAAFGYAVGAPERRNILMVGDGSFQLTAQEVAQMVRLKLPVIIFLINNYGYTIEVMIHDGPYNNIKNWDYAGLMEVFNGNGGYDSGAGKGLKAKTGGELAEAIKVALANTDGPTLIECFIGREDCTEELVKWGKRVAAANSRKPVNKLL,./data/raw/alphafold//AF-P06672-F1-model_v4.pdb,1251,3068,605,695
+205,2306,2339,MEARNMTPFTYFSLPMQKLFLRNQAAVRNKPYAKYFRSEMRVPLSAVRKIQQGPMALEDTLTPSIEDINRLLEPDFVSEESGYALLPGPMAYVQSRKFFPGCTAQMFKWWFIWHPAESERYTLWFPYAHVSNPCVHHQRLRDESLSFEERLYGNTFCASEYVGDRLMHLHIDFQQPASLGLNTDLYREAKIDGSVSALMSLADHPEVPVSLMVHLFKEVPDGMYLTSRYWVGAHPSMARFPGAEKAASLLKENGFGEAELETLAYEFAVHDMCEFNHLASFLPDLYREFGTPAA,brenda,Q4K423,CC(=O)c1c(O)cc(O)c(C(C)=O)c1O.O>>CC(=O)O.CC(=O)c1c(O)cc(O)cc1O,4.7,1.2427507402887634e-14,25.0,7.1,3.7.1.24,294.0,0.6720978579357175,CC(=O)c1c(O)cc(O)c(C(C)=O)c1O.O,CC(=O)O.CC(=O)c1c(O)cc(O)cc1O,0.6720978579357175,CC(=O)c1c(O)cc(O)c(C(C)=O)c1O.O__MEARNMTPFTYFSLPMQKLFLRNQAAVRNKPYAKYFRSEMRVPLSAVRKIQQGPMALEDTLTPSIEDINRLLEPDFVSEESGYALLPGPMAYVQSRKFFPGCTAQMFKWWFIWHPAESERYTLWFPYAHVSNPCVHHQRLRDESLSFEERLYGNTFCASEYVGDRLMHLHIDFQQPASLGLNTDLYREAKIDGSVSALMSLADHPEVPVSLMVHLFKEVPDGMYLTSRYWVGAHPSMARFPGAEKAASLLKENGFGEAELETLAYEFAVHDMCEFNHLASFLPDLYREFGTPAA,./data/raw/alphafold//AF-Q4K423-F1-model_v4.pdb,1577,1156,3001,1349
+206,8150,8278,MWCIVLFSLLAWVYAEPTMYGEILSPNYPQAYPSEVEKSWDIEVPEGYGIHLYFTHLDIELSENCAYDSVQIISGDTEEGRLCGQRSSNNPHSPIVEEFQVPYNKLQVIFKSDFSNEERFTGFAAYYVATDINECTDFVDVPCSHFCNNFIGGYFCSCPPEYFLHDDMKNCGVNCSGDVFTALIGEIASPNYPKPYPENSRCEYQIRLEKGFQVVVTLRREDFDVEAADSAGNCLDSLVFVAGDRQFGPYCGHGFPGPLNIETKSNALDIIFQTDLTGQKKGWKLRYHGDPMPCPKEDTPNSVWEPAKAKYVFRDVVQITCLDGFEVVEGRVGATSFYSTCQSNGKWSNSKLKCQPVDCGIPESIENGKVEDPESTLFGSVIRYTCEEPYYYMENGGGGEYHCAGNGSWVNEVLGPELPKCVPVCGVPREPFEEKQRIIGGSDADIKNFPWQVFFDNPWAGGALINEYWVLTAAHVVEGNREPTMYVGSTSVQTSRLAKSKMLTPEHVFIHPGWKLLEVPEGRTNFDNDIALVRLKDPVKMGPTVSPICLPGTSSDYNLMDGDLGLISGWGRTEKRDRAVRLKAARLPVAPLRKCKEVKVEKPTADAEAYVFTPNMICAGGEKGMDSCKGDSGGAFAVQDPNDKTKFYAAGLVSWGPQCGTYGLYTRVKNYVDWIMKTMQENSTPRED,uniprot_search,P09871,CC[C@H](C)[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H](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@@H](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](CC(C)C)N=C(O)[C@@H](N)[C@@H](C)O)C(=O)O,0.00155,2.9993298273329953e-14,37.0,7.4,3.4.21.42,9606.0,-2.8096683018297086,CC[C@H](C)[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H](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@@H](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](CC(C)C)N=C(O)[C@@H](N)[C@@H](C)O)C(=O)O,-2.8096683018297086,CC[C@H](C)[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H](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@@H](C)O)C(=O)O.O__MWCIVLFSLLAWVYAEPTMYGEILSPNYPQAYPSEVEKSWDIEVPEGYGIHLYFTHLDIELSENCAYDSVQIISGDTEEGRLCGQRSSNNPHSPIVEEFQVPYNKLQVIFKSDFSNEERFTGFAAYYVATDINECTDFVDVPCSHFCNNFIGGYFCSCPPEYFLHDDMKNCGVNCSGDVFTALIGEIASPNYPKPYPENSRCEYQIRLEKGFQVVVTLRREDFDVEAADSAGNCLDSLVFVAGDRQFGPYCGHGFPGPLNIETKSNALDIIFQTDLTGQKKGWKLRYHGDPMPCPKEDTPNSVWEPAKAKYVFRDVVQITCLDGFEVVEGRVGATSFYSTCQSNGKWSNSKLKCQPVDCGIPESIENGKVEDPESTLFGSVIRYTCEEPYYYMENGGGGEYHCAGNGSWVNEVLGPELPKCVPVCGVPREPFEEKQRIIGGSDADIKNFPWQVFFDNPWAGGALINEYWVLTAAHVVEGNREPTMYVGSTSVQTSRLAKSKMLTPEHVFIHPGWKLLEVPEGRTNFDNDIALVRLKDPVKMGPTVSPICLPGTSSDYNLMDGDLGLISGWGRTEKRDRAVRLKAARLPVAPLRKCKEVKVEKPTADAEAYVFTPNMICAGGEKGMDSCKGDSGGAFAVQDPNDKTKFYAAGLVSWGPQCGTYGLYTRVKNYVDWIMKTMQENSTPRED,./data/raw/alphafold//AF-P09871-F1-model_v4.pdb,1419,932,731,1026
+207,18,18,MGVPAFFRWLTKKYPATVVNANEDRQRDQDGNRVPVDCTQPNPNFQEFDNLYLDMNGIIHPCTHPEDRPAPKNEDEMFALIFEYIDRIYSIVRPRRLLYMAIDGVAPRAKMNQQRSRRFRASKEMAEKEASIEEQRNRLMAEGIAVPPKKKEEAHFDSNCITPGTPFMARLADALRYYIHDRVTNDASWANIEIILSDANVPGEGEHKIMDYVRKQRGNPAHDPNTVHCLCGADADLIMLGIATHEANFNIIREEFVPNQPRACDLCGQYGHELKECRGAENETDLGDDYCKPEQREKNFIFLRIPVLREYLEKELSMPNLPFKFDVERALDDWVFLCFFVGNDFLPHLPSLEIREGAIDRLIKLYKEMVYQMKGYLTKDGIPELDRVEMIMKGLGRVEDEIFKRRQQDEERFQENQRNKKARMQMYGGGGRGGRGRGRGRGQQPAFVPTHGILAPMAAPMHHSGESTRQMASEARQTAMKFTNDANETAAANLKALLNVKGEESPADIASRKRKAEQPLIKPEEEEDEGPKDDIRLYESGWKDRYYRAKFDVGSDDIEFRHRVAWAYVEGLCWVLRYYYQGCASWDWYFPYHYAPFASDFETVGEFQPDFTRPTKPFNPLEQLMSVFPAASKQHLPVEWQKLMIQDDSPIIDLYPADFRIDLNGKKYAWQGVALLPFVDETRLLATLQSVYPTLTAEEKQRNTRGPNRIFIGRNHKSFEFFQQVAESKSDDLVPLDPTLLNGVSGKIAYDSTATAPGLPFVSPVNHDECQDLPTNCGICVLYEDPEYPQDYIFPALRLDGAKEPEKTLKPDDWNDRRDGRYQPQVGFNRNAPRGSLDQSGHRQVHHYVRGGGGGGGGYRGNSYDDRRGGGGGGGGYNDRQDFGRNYGGRDGGGPQRYHDQQQQRQGGYQGGGYGGGYGGGGGGGGGGGGGSYHQPYNQDQRRGGRGGGGGPPGYQRPPYRGGGGGGYHGNSSWR,sabio,Q9U299,>>,0.013,0.0,30.0,8.0,3.1.13.-,6239.0,-1.8860566476931635,,,-1.8860566476931635,__MGVPAFFRWLTKKYPATVVNANEDRQRDQDGNRVPVDCTQPNPNFQEFDNLYLDMNGIIHPCTHPEDRPAPKNEDEMFALIFEYIDRIYSIVRPRRLLYMAIDGVAPRAKMNQQRSRRFRASKEMAEKEASIEEQRNRLMAEGIAVPPKKKEEAHFDSNCITPGTPFMARLADALRYYIHDRVTNDASWANIEIILSDANVPGEGEHKIMDYVRKQRGNPAHDPNTVHCLCGADADLIMLGIATHEANFNIIREEFVPNQPRACDLCGQYGHELKECRGAENETDLGDDYCKPEQREKNFIFLRIPVLREYLEKELSMPNLPFKFDVERALDDWVFLCFFVGNDFLPHLPSLEIREGAIDRLIKLYKEMVYQMKGYLTKDGIPELDRVEMIMKGLGRVEDEIFKRRQQDEERFQENQRNKKARMQMYGGGGRGGRGRGRGRGQQPAFVPTHGILAPMAAPMHHSGESTRQMASEARQTAMKFTNDANETAAANLKALLNVKGEESPADIASRKRKAEQPLIKPEEEEDEGPKDDIRLYESGWKDRYYRAKFDVGSDDIEFRHRVAWAYVEGLCWVLRYYYQGCASWDWYFPYHYAPFASDFETVGEFQPDFTRPTKPFNPLEQLMSVFPAASKQHLPVEWQKLMIQDDSPIIDLYPADFRIDLNGKKYAWQGVALLPFVDETRLLATLQSVYPTLTAEEKQRNTRGPNRIFIGRNHKSFEFFQQVAESKSDDLVPLDPTLLNGVSGKIAYDSTATAPGLPFVSPVNHDECQDLPTNCGICVLYEDPEYPQDYIFPALRLDGAKEPEKTLKPDDWNDRRDGRYQPQVGFNRNAPRGSLDQSGHRQVHHYVRGGGGGGGGYRGNSYDDRRGGGGGGGGYNDRQDFGRNYGGRDGGGPQRYHDQQQQRQGGYQGGGYGGGYGGGGGGGGGGGGGSYHQPYNQDQRRGGRGGGGGPPGYQRPPYRGGGGGGYHGNSSWR,./data/raw/alphafold//AF-Q9U299-F1-model_v4.pdb,887,382,15,18
+208,22237,22570,MLRRDFLKYSVALGVASALPLWSRAAFAAERPALPIPDLLTADASNRMQLIVKAGQSTFAGKNATTWGYNGNLLGPAVQLHKGKSVTVDIHNQLAEDTTLHWHGLEIPGIVDGGPQGIIPAGGTRTVTFTPEQRAATCWIHPHKHGKTGRQVAMGLAGLVLIEDDEIRKLRLPKQWGIDDVPVIIQDKRFSADGQIDYQLDIMTAAVGWFGDTLLTNGAIYPQHSAPKGWLRLRLLNGCNARSLNIAASDNRPLYVIASDGGLLAEPVKVTELPLLMGERFEVLVDISDGKAFDLVTLPVSQMGMAIAPFDKPHPVMRIQPLRITASGTLPDTLTTMPALPSLEGLTVRNLKLSMDPRLDMMGMQMLMKKYGAQAMSGMDHDSMNAHMQGGNMGHGEMDHGNMDHSGMNHGAMGNMNHGGKFDFHNANFINGQVFDMNKPMFAAQKGRHERWVISGVGDMMLHPFHIHGTQFRILSENGKAPAAHRTGWKDTVRVEGGISEVLVKFDHDAPKEHAYMAHCHLLEHEDTGMMLGFTV,sabio,Q8ZRS2,O=O.[Cu+].[H]>>O.[Cu+2],33480.0,8.36957674763975,,5.0,1.10.3.2,90371.0,4.524785449321223,O=O.[Cu+].[H],O.[Cu+2],4.524785449321223,O=O.[Cu+].[H]__MLRRDFLKYSVALGVASALPLWSRAAFAAERPALPIPDLLTADASNRMQLIVKAGQSTFAGKNATTWGYNGNLLGPAVQLHKGKSVTVDIHNQLAEDTTLHWHGLEIPGIVDGGPQGIIPAGGTRTVTFTPEQRAATCWIHPHKHGKTGRQVAMGLAGLVLIEDDEIRKLRLPKQWGIDDVPVIIQDKRFSADGQIDYQLDIMTAAVGWFGDTLLTNGAIYPQHSAPKGWLRLRLLNGCNARSLNIAASDNRPLYVIASDGGLLAEPVKVTELPLLMGERFEVLVDISDGKAFDLVTLPVSQMGMAIAPFDKPHPVMRIQPLRITASGTLPDTLTTMPALPSLEGLTVRNLKLSMDPRLDMMGMQMLMKKYGAQAMSGMDHDSMNAHMQGGNMGHGEMDHGNMDHSGMNHGAMGNMNHGGKFDFHNANFINGQVFDMNKPMFAAQKGRHERWVISGVGDMMLHPFHIHGTQFRILSENGKAPAAHRTGWKDTVRVEGGISEVLVKFDHDAPKEHAYMAHCHLLEHEDTGMMLGFTV,./data/raw/alphafold//AF-Q8ZRS2-F1-model_v4.pdb,3416,2300,1007,6829
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+242,14397,14600,MESTMKGIRGDNAPCVLDLDDAATVGGGVGDTYGEDCATEEQLVTPWTVSVASGYNLLRDPRYNKGLAFNERERETHYLRGLLPPAIVSQELQERKIMHNIRQYQLPLQKYMAMMDLQEGNERLFYKLLIDNVEELLPVVYTPTVGEACQKYGSIFSRPQGLYISLKEKGKILEVLKNWPERSIQVIVVTDGERILGLGDLGCQGMGIPVGKLALYTALGGVRPSACLPITLDVGTNNEALPNDEFYIGLRQKRATAQEYADFLHEFMTAVKQNYGEKVLIQFEDFANHNAFELLAKYGTTHLVFNDDIQGTASVVLSGLVAALKLVGGSLSEHSYLFLGVGEAGTGIAELIALEISRQTKAPIEECRKKIWLVDSKGLIVSSRKETLQHFKKPWAHEHEPVGNLLDAVKTIKPTVLIGTSGKGQTFTQEVVEAISSFNERPVIFALSNPTSQSECTAEQAYTWSKGRAVFASGSPFDPVEYDGKIYVPGQANNAYIFPGFGLGVVMSGAIRVHDDMLLAASEALAQQVTQENFDKGLTYPPFSNIRKISAHIAANVAAKAYELGLASRRPRPKDLVKYAESCMYSPLYRNYR,brenda,Q9FRT2,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>>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.O=C=O.[H+],91.7,0.0,30.0,7.7,1.1.1.40,4530.0,1.9623693356700207,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,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.O=C=O.[H+],1.9623693356700207,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__MESTMKGIRGDNAPCVLDLDDAATVGGGVGDTYGEDCATEEQLVTPWTVSVASGYNLLRDPRYNKGLAFNERERETHYLRGLLPPAIVSQELQERKIMHNIRQYQLPLQKYMAMMDLQEGNERLFYKLLIDNVEELLPVVYTPTVGEACQKYGSIFSRPQGLYISLKEKGKILEVLKNWPERSIQVIVVTDGERILGLGDLGCQGMGIPVGKLALYTALGGVRPSACLPITLDVGTNNEALPNDEFYIGLRQKRATAQEYADFLHEFMTAVKQNYGEKVLIQFEDFANHNAFELLAKYGTTHLVFNDDIQGTASVVLSGLVAALKLVGGSLSEHSYLFLGVGEAGTGIAELIALEISRQTKAPIEECRKKIWLVDSKGLIVSSRKETLQHFKKPWAHEHEPVGNLLDAVKTIKPTVLIGTSGKGQTFTQEVVEAISSFNERPVIFALSNPTSQSECTAEQAYTWSKGRAVFASGSPFDPVEYDGKIYVPGQANNAYIFPGFGLGVVMSGAIRVHDDMLLAASEALAQQVTQENFDKGLTYPPFSNIRKISAHIAANVAAKAYELGLASRRPRPKDLVKYAESCMYSPLYRNYR,./data/raw/alphafold//AF-Q9FRT2-F1-model_v4.pdb,2344,5233,4827,4670
+243,13623,13800,MGDNRTPVTVIGLGLMGQALAAAFLEAGHTTTVWNRSAGKAEQLVSQGAVQAATPADAVAASELVVVCLSTYDNMHDVIGSLGESLRGKVIVNLTSGSSDQGRETAAWAEKQGVEYLDGAIMITPPGIGTETAVLFYAGTQSVFEKYEPALKLLGGGTTYLGTDHGMPALYDVSLLGLMWGTLNSFLHGVAVVETAGVGAQQFLPWAHMWLEAIKMFTADYAAQIDAGDGKFPANDATLETHLAALKHLVHESEALGIDAELPKYSEALMERVISQGHAKNSYAAVLKAFRKPSE,brenda,M4ZRJ3,N=C(O)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+].c1csc(C2=NCCCC2)c1>>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.c1csc([C@@H]2CCCCN2)c1,0.643,0.0,,,1.5.1.48,1231257.0,-0.1917890270757779,N=C(O)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+].c1csc(C2=NCCCC2)c1,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.c1csc([C@@H]2CCCCN2)c1,-0.1917890270757779,N=C(O)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+].c1csc(C2=NCCCC2)c1__MGDNRTPVTVIGLGLMGQALAAAFLEAGHTTTVWNRSAGKAEQLVSQGAVQAATPADAVAASELVVVCLSTYDNMHDVIGSLGESLRGKVIVNLTSGSSDQGRETAAWAEKQGVEYLDGAIMITPPGIGTETAVLFYAGTQSVFEKYEPALKLLGGGTTYLGTDHGMPALYDVSLLGLMWGTLNSFLHGVAVVETAGVGAQQFLPWAHMWLEAIKMFTADYAAQIDAGDGKFPANDATLETHLAALKHLVHESEALGIDAELPKYSEALMERVISQGHAKNSYAAVLKAFRKPSE,./data/raw/alphafold//AF-M4ZRJ3-F1-model_v4.pdb,1074,641,318,355
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+245,9888,10038,MYWRFQMTKAKTMMPLSVSRRRFVQGLAVGGLLATFPHIVRAGSAFKDNAFTGYATELSGNVIDLTIGEALVNFTGVVRKATTINGSIPAPTLRLREGDDVTIRVTNTLSVPSSIHWHGIILPYQMDGVPGMSFRGIMPGETFVYRFTLKQSGTYWYHSHSGFQEMTGMYGALIIEPKAQDVIAADREYVVQLSDWTDEDPHTAFRKLKVQSDLYNFNQPTVQDMLRDITDRGLDAALAKRQMWQQMRMNPTDLADISAATFTYLINGSSPLANWRGLFKRGERVRLRFINGSSNSFFDVRIPELKMTVVQADGQNVHSVTVDEFRFGPGETYDVVVSPQMMPTPFLPRAWTAVAMPAVPWPWPRACMHRCLRWIRWNGCRWLTCWAICTMAQATATATATARWRTAMARKIIASMVLWLSITVSMARAVPYAKASSTVRHASTEYGPSVDMRVDMPRTNLDDPGIGLRNTGRRALTLADLHSLDGIIEPGGPEAEIELHLTGNMERYTWSFDGLEFSKSTPVHMKHNQRIRVILQNDTMMTHPMHLHGMWSDLESDNGAVQVRRHTIPVQPAQRISFLTTPHDVGRWAWHCHLLFHMDAGMFREVVVS,sabio,A0A3G8G7Z6,COc1ccccc1O.O=O>>O,7.39,78.85836302183245,55.0,8.0,1.10.3.2,1869214.0,0.8686444383948257,COc1ccccc1O.O=O,O,0.8686444383948257,COc1ccccc1O.O=O__MYWRFQMTKAKTMMPLSVSRRRFVQGLAVGGLLATFPHIVRAGSAFKDNAFTGYATELSGNVIDLTIGEALVNFTGVVRKATTINGSIPAPTLRLREGDDVTIRVTNTLSVPSSIHWHGIILPYQMDGVPGMSFRGIMPGETFVYRFTLKQSGTYWYHSHSGFQEMTGMYGALIIEPKAQDVIAADREYVVQLSDWTDEDPHTAFRKLKVQSDLYNFNQPTVQDMLRDITDRGLDAALAKRQMWQQMRMNPTDLADISAATFTYLINGSSPLANWRGLFKRGERVRLRFINGSSNSFFDVRIPELKMTVVQADGQNVHSVTVDEFRFGPGETYDVVVSPQMMPTPFLPRAWTAVAMPAVPWPWPRACMHRCLRWIRWNGCRWLTCWAICTMAQATATATATARWRTAMARKIIASMVLWLSITVSMARAVPYAKASSTVRHASTEYGPSVDMRVDMPRTNLDDPGIGLRNTGRRALTLADLHSLDGIIEPGGPEAEIELHLTGNMERYTWSFDGLEFSKSTPVHMKHNQRIRVILQNDTMMTHPMHLHGMWSDLESDNGAVQVRRHTIPVQPAQRISFLTTPHDVGRWAWHCHLLFHMDAGMFREVVVS,./data/raw/alphafold//AF-A0A3G8G7Z6-F1-model_v4.pdb,3410,2313,1024,2921
+246,4617,4673,MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFVGKNDGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEESAGKATITLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,sabio,Q83U23,CC(N)C(O)=NC(Cc1cnc[nH]1)C(=O)O.O>>CC(N)C(=O)O.N[C@@H](Cc1cnc[nH]1)C(=O)O,1390.0,1.1612499818347632e-14,37.0,7.5,3.4.13.-,44688.0,3.143014800254095,CC(N)C(O)=NC(Cc1cnc[nH]1)C(=O)O.O,CC(N)C(=O)O.N[C@@H](Cc1cnc[nH]1)C(=O)O,3.143014800254095,CC(N)C(O)=NC(Cc1cnc[nH]1)C(=O)O.O__MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFVGKNDGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEESAGKATITLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,./data/raw/alphafold//AF-Q83U23-F1-model_v4.pdb,1801,1476,3046,1796
+247,16745,16975,MSSFTKDEFDCHILDEGFTAKDILDQKINEVSSSDDKDAFYVADLGDILKKHLRWLKALPRVTPFYAVKCNDSRAIVSTLAAIGTGFDCASKTEIQLVQGLGVPAERVIYANPCKQVSQIKYAASNGVQMMTFDSEIELMKVARAHPKAKLVLRIATDDSKAVCRLSVKFGATLKTSRLLLERAKELNIDVIGVSFHVGSGCTDPETFVQAVSDARCVFDMATEVGFSMHLLDIGGGFPGSEDTKLKFEEITSVINPALDKYFPSDSGVRIIAEPGRYYVASAFTLAVNIIAKKTVWKEQPGSDDEDESNEQTFMYYVNDGVYGSFNCILYDHAHVKALLQKRPKPDEKYYSSSIWGPTCDGLDRIVERCNLPEMHVGDWMLFENMGAYTVAAASTFNGFQRPNIYYVMSRPMWQLMKQIQSHGFPPEVEEQDDGTLPMSCAQESGMDRHPAACASARINV,sabio,P00860,NCCCC(N)C(=O)O>>NCCCCN.O=C=O,7.8,0.0,37.0,8.0,4.1.1.17,10090.0,0.8920946026904804,NCCCC(N)C(=O)O,NCCCCN.O=C=O,0.8920946026904804,NCCCC(N)C(=O)O__MSSFTKDEFDCHILDEGFTAKDILDQKINEVSSSDDKDAFYVADLGDILKKHLRWLKALPRVTPFYAVKCNDSRAIVSTLAAIGTGFDCASKTEIQLVQGLGVPAERVIYANPCKQVSQIKYAASNGVQMMTFDSEIELMKVARAHPKAKLVLRIATDDSKAVCRLSVKFGATLKTSRLLLERAKELNIDVIGVSFHVGSGCTDPETFVQAVSDARCVFDMATEVGFSMHLLDIGGGFPGSEDTKLKFEEITSVINPALDKYFPSDSGVRIIAEPGRYYVASAFTLAVNIIAKKTVWKEQPGSDDEDESNEQTFMYYVNDGVYGSFNCILYDHAHVKALLQKRPKPDEKYYSSSIWGPTCDGLDRIVERCNLPEMHVGDWMLFENMGAYTVAAASTFNGFQRPNIYYVMSRPMWQLMKQIQSHGFPPEVEEQDDGTLPMSCAQESGMDRHPAACASARINV,./data/raw/alphafold//AF-P00860-F1-model_v4.pdb,2175,4395,4294,4169
+248,20220,20510,MKSLVVVVLLLAVGLGAGQNNKGWWKNAVFYQIYPRSFMDSNNDGIGDLQGIKDKLSHFTESGITAIWLSPIYRSPMVDFGYDISDFKDIDPIFGTTEDLQDLTAEAKKRNLKVILDLVPNHTSDEHNWFQLSVNKTGKYKDYYVWVDPKNGTDPFEKRYPNNWLSVFNGTGWTFNEIRQQFYFHQFYKKQPDLNYRNPEVRKEMKSVMEFWLNNGIDGFRIDAIPHIYEVENISLNEPPIGQNLNLSLHASLNHIYTKDQPETYDLVREWRNFVDEYAKNNNRDEIVLLTEAYTSLNNTLRYYQYGANVPFNFKFITDANSSSTPEQFKTIIDNWVQGTPQNDVPNWVKGNHDRVRVSTRYPGRADHMIMLEMILPGVAVTYYGEEIGMEDNTTIYKYDVRDGCRTPFQWDNSINAGFSKVNESTLEKEWLPVHSSYKNGLNLEQEKKDNISHYHLYTNLTALRKRDVLKEGKLVTEILNKNVLAIVRQNEKEAVSLLINFSKNNTVVNISKLVDEGNNKIYTSSINSKLTANELVNPMAIDIPGDSSVIITSGATIVNYSIMTFLFVVFISFFQR,brenda,A1IHL0,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]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,13.0,0.0,37.0,5.0,3.2.1.20,292787.0,1.1139433523068367,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]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,1.1139433523068367,O.O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1__MKSLVVVVLLLAVGLGAGQNNKGWWKNAVFYQIYPRSFMDSNNDGIGDLQGIKDKLSHFTESGITAIWLSPIYRSPMVDFGYDISDFKDIDPIFGTTEDLQDLTAEAKKRNLKVILDLVPNHTSDEHNWFQLSVNKTGKYKDYYVWVDPKNGTDPFEKRYPNNWLSVFNGTGWTFNEIRQQFYFHQFYKKQPDLNYRNPEVRKEMKSVMEFWLNNGIDGFRIDAIPHIYEVENISLNEPPIGQNLNLSLHASLNHIYTKDQPETYDLVREWRNFVDEYAKNNNRDEIVLLTEAYTSLNNTLRYYQYGANVPFNFKFITDANSSSTPEQFKTIIDNWVQGTPQNDVPNWVKGNHDRVRVSTRYPGRADHMIMLEMILPGVAVTYYGEEIGMEDNTTIYKYDVRDGCRTPFQWDNSINAGFSKVNESTLEKEWLPVHSSYKNGLNLEQEKKDNISHYHLYTNLTALRKRDVLKEGKLVTEILNKNVLAIVRQNEKEAVSLLINFSKNNTVVNISKLVDEGNNKIYTSSINSKLTANELVNPMAIDIPGDSSVIITSGATIVNYSIMTFLFVVFISFFQR,./data/raw/alphafold//AF-A1IHL0-F1-model_v4.pdb,450,3119,5406,6287
+249,8488,8619,MAKRVAIVGAGVSGLASIKCCLEEGLEPTCFERSDDLGGLWRFTEHVEEGRASLYKSVVSNSCKEMSCYPDFPFPEDYPNYVPNSHFLEYLRMYANQFNLLKCIQFKTKVCSVTKHEDFNTTGQWDVVTLCEGKQESAVFDAVMVCTGFLTNPYLPLDSFPGINTFKGQYFHSRQYKHPDIFKDKSVLVVGMGNSGTDIAVEASHLAKKVFLSTTGGAWVISRVFDSGYPWDMVFMTRFQNMFRNSLPTPIVNWLIAKKMNSWFNHANYGLIPEDRIQLREPVLNDELPGRIITGKVLIKPSIKEVKENSVVFNSSPEEEPIDIIVFATGYTFAFPFLDESVVKVEDGQASLYKYIFPAHLQKPTLAVIGLIKPLGSLLPTGDTQARWAVRVLKGVNKLPPSSVMIQEVNTRKENKPSGFGLCYCKALQSDYIAYIDELLTYIDAKPNMFSLLLTDPHLALTIFFGPCTPYQFRLTGPGKWEGARNAIMTQWDRTFKVTKTRIVKESPSPFASLLKLFSFLALLVAIFQIFL,sabio,P16549,CN(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.O=O.[H]>>C[N+](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.O,1980.0,0.0,37.0,7.4,1.14.13.8,9823.0,3.296665190261531,CN(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.O=O.[H],C[N+](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.O,3.296665190261531,CN(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.O=O.[H]__MAKRVAIVGAGVSGLASIKCCLEEGLEPTCFERSDDLGGLWRFTEHVEEGRASLYKSVVSNSCKEMSCYPDFPFPEDYPNYVPNSHFLEYLRMYANQFNLLKCIQFKTKVCSVTKHEDFNTTGQWDVVTLCEGKQESAVFDAVMVCTGFLTNPYLPLDSFPGINTFKGQYFHSRQYKHPDIFKDKSVLVVGMGNSGTDIAVEASHLAKKVFLSTTGGAWVISRVFDSGYPWDMVFMTRFQNMFRNSLPTPIVNWLIAKKMNSWFNHANYGLIPEDRIQLREPVLNDELPGRIITGKVLIKPSIKEVKENSVVFNSSPEEEPIDIIVFATGYTFAFPFLDESVVKVEDGQASLYKYIFPAHLQKPTLAVIGLIKPLGSLLPTGDTQARWAVRVLKGVNKLPPSSVMIQEVNTRKENKPSGFGLCYCKALQSDYIAYIDELLTYIDAKPNMFSLLLTDPHLALTIFFGPCTPYQFRLTGPGKWEGARNAIMTQWDRTFKVTKTRIVKESPSPFASLLKLFSFLALLVAIFQIFL,./data/raw/alphafold//AF-P16549-F1-model_v4.pdb,3144,1836,3463,2961
+250,992,1018,MAGKEDSETFFSAATPLAFELGSLPTTVIPADPSATDLTAPPKPVIITSPTVAGTYPVVLFFHGFYLRNYFYSDVINHVASHGYIVVAPQLCKILPPGGQVEVDDAGKVINWTSKNLKAHLPSSVNANGNYTALVGHSRGGKTAFAVALGHAATLDPSIKFSALVGIDPVAGISKCIRTDPEILTYKPESFDLDMPVAVIGTGLGPKSNMLMPPCAPAEVNHEEFYIECKATKGHFVAADYGHMDMLDDNLPGFVGFMAGCMCKNGKRKKSEMRSFVGGIVVAFLKYSIWGEMSEIRQILKDPSVSPARLDPSPELEEASGYLV,brenda,Q8GTM4,C=Cc1c2[nH]c(c1C)/C=C1\N=C(C3=C4NC(/C=c5\[nH]/c(c(C)c5CC)=C\2)C(C)=C4C(=O)[C@@H]3C(=O)OC)[C@@H](CCC(=O)OC)[C@@H]1C.O>>,0.259,99.8407019310112,40.0,7.4,3.1.1.14,3712.0,-0.5867002359187482,C=Cc1c2[nH]c(c1C)/C=C1\N=C(C3=C4NC(/C=c5\[nH]/c(c(C)c5CC)=C\2)C(C)=C4C(=O)[C@@H]3C(=O)OC)[C@@H](CCC(=O)OC)[C@@H]1C.O,,-0.5867002359187482,C=Cc1c2[nH]c(c1C)/C=C1\N=C(C3=C4NC(/C=c5\[nH]/c(c(C)c5CC)=C\2)C(C)=C4C(=O)[C@@H]3C(=O)OC)[C@@H](CCC(=O)OC)[C@@H]1C.O__MAGKEDSETFFSAATPLAFELGSLPTTVIPADPSATDLTAPPKPVIITSPTVAGTYPVVLFFHGFYLRNYFYSDVINHVASHGYIVVAPQLCKILPPGGQVEVDDAGKVINWTSKNLKAHLPSSVNANGNYTALVGHSRGGKTAFAVALGHAATLDPSIKFSALVGIDPVAGISKCIRTDPEILTYKPESFDLDMPVAVIGTGLGPKSNMLMPPCAPAEVNHEEFYIECKATKGHFVAADYGHMDMLDDNLPGFVGFMAGCMCKNGKRKKSEMRSFVGGIVVAFLKYSIWGEMSEIRQILKDPSVSPARLDPSPELEEASGYLV,./data/raw/alphafold//AF-Q8GTM4-F1-model_v4.pdb,1222,3032,566,648
+251,1741,1772,MFQIRSFLVGISAFVMAVLGSAAYSAQPGGEYPTVDDIPVGEVRLYKIGDGVWSHIATQKLGDTVYSSNGLIVRDADELLLIDTAWGAKNTVALLAEIEKQIGLPVTRSISTHFHDDRVGGVDVLRAAGVATYTSPLTRQLAEAAGNEVPAHSLKALSSSGDVVRFGPVEVFYPGAAHSGDNLVVYVPAVRVLFGGCAVHEASRESAGNVADANLAEWPATIKRIQQRYPEAEVVIPGHGLPGGLELLQHTTNVVKTHKVRPVAE,brenda,Q840P9,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)Cc3cccs3)[C@H]2SC1.O>>,180.0,99.7593035206674,37.0,7.0,3.5.2.6,287.0,2.255272505103306,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)Cc3cccs3)[C@H]2SC1.O,,2.255272505103306,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)Cc3cccs3)[C@H]2SC1.O__MFQIRSFLVGISAFVMAVLGSAAYSAQPGGEYPTVDDIPVGEVRLYKIGDGVWSHIATQKLGDTVYSSNGLIVRDADELLLIDTAWGAKNTVALLAEIEKQIGLPVTRSISTHFHDDRVGGVDVLRAAGVATYTSPLTRQLAEAAGNEVPAHSLKALSSSGDVVRFGPVEVFYPGAAHSGDNLVVYVPAVRVLFGGCAVHEASRESAGNVADANLAEWPATIKRIQQRYPEAEVVIPGHGLPGGLELLQHTTNVVKTHKVRPVAE,./data/raw/alphafold//AF-Q840P9-F1-model_v4.pdb,1446,972,794,1105
+252,17334,17565,MKANKQLNHTASHLLATAVLKLFPNTKLGFGPAIDEGFYYDFKFEKPLLEEDLKKIKKEMQKITKQNYILEKHHGEDFFNSEKPFKKELYDELKQKGENVTFYAIKDPRLNKIIFNDLCLGNHIQNVSEVKHFELLSIAGAYWRGNSDKEQLTRIYGTAWETQEELDQYLDLLKERKERDHRTIAKNLDLFMFSPLSGLGFPIWLENGMKIKNAIMKTVLELDDRYGFDEVHTPIVGEQKLYETSGHWAHYKDDMYPPIKVENENLILRPMTCPHHILIFNSRLYSYRDLPKRFSEQSWLFRHEKSGALTGFERVRALQLTEGHIFARKSQIVDEFKHLYKMINEALSIFGIKIDYVSFSRRDPKDKEKFYQDDKLWETAEKDLETVLKELKIEYKEMIGEAAFYGPKIDFQVRTVLNHEITMSTLQLDFLLPEKFDMSYVNENNEREKPVLIHRGLIGTYERFLSILLEQNKGVFPFWLAPKQFAIAVVNPNDKMQIEYADSVYKTLKSKKFHVYFDNRDERLSKKIREAQISKTKYIFVIGEEEAKTKTITIRAYGEESTTTSTIENFLKNLDYKKA,brenda,Q6KH76,N[C@@H](CO)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>>,0.55,10000000.0,30.0,7.5,6.1.1.3,2118.0,-0.2596373105057561,N[C@@H](CO)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,,-0.2596373105057561,N[C@@H](CO)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__MKANKQLNHTASHLLATAVLKLFPNTKLGFGPAIDEGFYYDFKFEKPLLEEDLKKIKKEMQKITKQNYILEKHHGEDFFNSEKPFKKELYDELKQKGENVTFYAIKDPRLNKIIFNDLCLGNHIQNVSEVKHFELLSIAGAYWRGNSDKEQLTRIYGTAWETQEELDQYLDLLKERKERDHRTIAKNLDLFMFSPLSGLGFPIWLENGMKIKNAIMKTVLELDDRYGFDEVHTPIVGEQKLYETSGHWAHYKDDMYPPIKVENENLILRPMTCPHHILIFNSRLYSYRDLPKRFSEQSWLFRHEKSGALTGFERVRALQLTEGHIFARKSQIVDEFKHLYKMINEALSIFGIKIDYVSFSRRDPKDKEKFYQDDKLWETAEKDLETVLKELKIEYKEMIGEAAFYGPKIDFQVRTVLNHEITMSTLQLDFLLPEKFDMSYVNENNEREKPVLIHRGLIGTYERFLSILLEQNKGVFPFWLAPKQFAIAVVNPNDKMQIEYADSVYKTLKSKKFHVYFDNRDERLSKKIREAQISKTKYIFVIGEEEAKTKTITIRAYGEESTTTSTIENFLKNLDYKKA,./data/raw/alphafold//AF-Q6KH76-F1-model_v4.pdb,3665,3661,1456,3420
+253,19819,20105,MNPFHDLEPGPDVPEVVYAIIEIPKGSRNKYELDKKTGLLKLDRVLYSPFFYPVDYGIIPRTWYEDDDPFDIMVIMREPVYPLTIIEARPIGLFKMIDSGDKDYKVLAVPVEDPYFKDWKDIDDVPKAFLDEIAHFFKRYKELQGKEIIVEGWEGAEAAKREILRAIEMYKEKFGKKE,brenda,Q8U438,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)O>>,226.0,99.63894615604023,95.0,9.5,3.6.1.1,2261.0,2.3541084391474008,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)O,,2.3541084391474008,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)O__MNPFHDLEPGPDVPEVVYAIIEIPKGSRNKYELDKKTGLLKLDRVLYSPFFYPVDYGIIPRTWYEDDDPFDIMVIMREPVYPLTIIEARPIGLFKMIDSGDKDYKVLAVPVEDPYFKDWKDIDDVPKAFLDEIAHFFKRYKELQGKEIIVEGWEGAEAAKREILRAIEMYKEKFGKKE,./data/raw/alphafold//AF-Q8U438-F1-model_v4.pdb,350,2917,5250,4739
+254,4501,4556,MYRTIETILVDIPTIRPHQLSVTTMRTQTLVLVKITTTDGIVGWGEATTIGGLNYGEESPESVKANIDTYFAPLLTSVKDLNVAQTLKLIRKNINGNRFAKCAIQTALLDIQAKRLGVPLSEVLGGRLRNSLPVLWTLASGDTEKDIAEARKMIELKRHNTFKLKIGARPLQHDVDHVIAIKKALGADISVRVDVNRAWSELECIQGIQQLQDGGIDLIEQPCAIQNTEALARLTHRFDVAIMADEALTGPDSAYRISKNHGADVFAVKIEQSGGLIEACEVAKIAGLAGIDLYGGTMLEGPVGSIASAHAFATFETLAFGTELFGPLLLTEEILKEPLRYENFELHLPTAPGLGIEIDENKVEKLRR,uniprot_search,A0A446ZJB9,CC(C=CC(=O)O)=CC(=O)O>>CC1=CC=CCOC1=O,108000.0,11.376015017278403,25.0,7.5,5.5.1.1,471.0,5.033423755486949,CC(C=CC(=O)O)=CC(=O)O,CC1=CC=CCOC1=O,5.033423755486949,CC(C=CC(=O)O)=CC(=O)O__MYRTIETILVDIPTIRPHQLSVTTMRTQTLVLVKITTTDGIVGWGEATTIGGLNYGEESPESVKANIDTYFAPLLTSVKDLNVAQTLKLIRKNINGNRFAKCAIQTALLDIQAKRLGVPLSEVLGGRLRNSLPVLWTLASGDTEKDIAEARKMIELKRHNTFKLKIGARPLQHDVDHVIAIKKALGADISVRVDVNRAWSELECIQGIQQLQDGGIDLIEQPCAIQNTEALARLTHRFDVAIMADEALTGPDSAYRISKNHGADVFAVKIEQSGGLIEACEVAKIAGLAGIDLYGGTMLEGPVGSIASAHAFATFETLAFGTELFGPLLLTEEILKEPLRYENFELHLPTAPGLGIEIDENKVEKLRR,./data/raw/alphafold//AF-A0A446ZJB9-F1-model_v4.pdb,1022,564,226,245
+255,8462,8593,MTTRLLAYLQLGIALYHSGVRAQATLNPTDTMIISNAQVSPDGFARSAVVVNGVHPGPLLTGQKDDTFAINVVNELNDPTMLRSTSVHWHGLFQKGTNWADGAEGVNQCPISPASPENTENAFEYRFTPAGHAGTFWYHSHFGTQYCDGLRGPMVVYDPQDPYLGDYDVDNASTVITLADWFHTPAPSLRAPFRPDATLINGIGRTPGGEQVDLAVVNVEAGKKYRFRVVSLACDVNFQFSIDGHKLTIIEADGQLTDRLEVDRIQIFTGQRYSVILNANQEPGNYRIRAIPNAGVPGLVGTVDEGVNSAILRYAGAPIEEPSSDPPANPVDLREWELHAFSGPGFDPSAPGTPEIGAADVVLPLQFTFVGGKFQVNGVAYESPDVPTLLQIMSGRNPGELMPEGSVHYLPRNQVVEVQIPSGSISNSGPHPFHLHGHAFSVVRSAGNSTPNFVNPVKRDVVSIGGASDSVTIRFVTDNPGPWFFHCHIEPHLVDGLAIVFAEAMEDTVQANPLPEDREYCSVLHAFSGNLC,brenda,Q08AC1,CCn1/c(=N/N=c2\sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O>>O,32.03,93.45349114727436,37.0,3.0,1.10.3.2,5346.0,1.505556938663822,CCn1/c(=N/N=c2\sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O,O,1.505556938663822,CCn1/c(=N/N=c2\sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O__MTTRLLAYLQLGIALYHSGVRAQATLNPTDTMIISNAQVSPDGFARSAVVVNGVHPGPLLTGQKDDTFAINVVNELNDPTMLRSTSVHWHGLFQKGTNWADGAEGVNQCPISPASPENTENAFEYRFTPAGHAGTFWYHSHFGTQYCDGLRGPMVVYDPQDPYLGDYDVDNASTVITLADWFHTPAPSLRAPFRPDATLINGIGRTPGGEQVDLAVVNVEAGKKYRFRVVSLACDVNFQFSIDGHKLTIIEADGQLTDRLEVDRIQIFTGQRYSVILNANQEPGNYRIRAIPNAGVPGLVGTVDEGVNSAILRYAGAPIEEPSSDPPANPVDLREWELHAFSGPGFDPSAPGTPEIGAADVVLPLQFTFVGGKFQVNGVAYESPDVPTLLQIMSGRNPGELMPEGSVHYLPRNQVVEVQIPSGSISNSGPHPFHLHGHAFSVVRSAGNSTPNFVNPVKRDVVSIGGASDSVTIRFVTDNPGPWFFHCHIEPHLVDGLAIVFAEAMEDTVQANPLPEDREYCSVLHAFSGNLC,./data/raw/alphafold//AF-Q08AC1-F1-model_v4.pdb,3424,2325,1043,2944
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+258,11598,11756,MEGGFTGGDEYQKHFLPRDYLNTYYSFQSGPSPEAEMLKFNLECLHKTFGPGGLQGDTLIDIGSGPTIYQVLAACESFKDITLSDFTDRNREELAKWLKKEPGAYDWTPALKFACELEGNSGRWQEKAEKLRATVKRVLKCDANLSNPLTPVVLPPADCVLTLLAMECACCSLDAYRAALRNLASLLKPGGHLVTTVTLQLSSYMVGEREFSCVALEKEEVEQAVLDAGFDIEQLLYSPQSYSASTAPNRGVCFLVARKKPGS,uniprot_search,O97972,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCCc1c[nH]c2ccccc12>>CNCCc1c[nH]c2ccccc12.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,0.4,0.0900532278900598,25.0,8.5,2.1.1.49,9986.0,-0.3979400086720376,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCCc1c[nH]c2ccccc12,CNCCc1c[nH]c2ccccc12.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,-0.3467874862246563,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCCc1c[nH]c2ccccc12__MEGGFTGGDEYQKHFLPRDYLNTYYSFQSGPSPEAEMLKFNLECLHKTFGPGGLQGDTLIDIGSGPTIYQVLAACESFKDITLSDFTDRNREELAKWLKKEPGAYDWTPALKFACELEGNSGRWQEKAEKLRATVKRVLKCDANLSNPLTPVVLPPADCVLTLLAMECACCSLDAYRAALRNLASLLKPGGHLVTTVTLQLSSYMVGEREFSCVALEKEEVEQAVLDAGFDIEQLLYSPQSYSASTAPNRGVCFLVARKKPGS,./data/raw/alphafold//AF-O97972-F1-model_v4.pdb,3485,3401,1135,3052
+259,2470,2505,MSRLSEPSPYVEFDRRQWRALRMSTPLALTEEELVGLRGLGEQIDLLEVEEVYLPLARLIHLQVAARQRLFAATAEFLGEPQQNPDRPVPFIIGVAGSVAVGKSTTARVLQALLARWDHHPRVDLVTTDGFLYPNAELQRRNLMHRKGFPESYNRRALMRFVTSVKSGSDYACAPVYSHLHYDIIPGAEQVVRHPDILILEGLNVLQTGPTLMVSDLFDFSLYVDARIEDIEQWYVSRFLAMRTTAFADPESHFHHYAAFSDSQAVVAAREIWRTINRPNLVENILPTRPRATLVLRKDADHSINRLRLRKL,brenda,P9WPA7,CC(C)(CO)[C@@H](O)C(O)=NCCC(=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)(COP(=O)(O)O)[C@@H](O)C(O)=NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.62,0.0,25.0,7.8,2.7.1.33,1773.0,-0.2076083105017461,CC(C)(CO)[C@@H](O)C(O)=NCCC(=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)(COP(=O)(O)O)[C@@H](O)C(O)=NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-0.2076083105017461,CC(C)(CO)[C@@H](O)C(O)=NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MSRLSEPSPYVEFDRRQWRALRMSTPLALTEEELVGLRGLGEQIDLLEVEEVYLPLARLIHLQVAARQRLFAATAEFLGEPQQNPDRPVPFIIGVAGSVAVGKSTTARVLQALLARWDHHPRVDLVTTDGFLYPNAELQRRNLMHRKGFPESYNRRALMRFVTSVKSGSDYACAPVYSHLHYDIIPGAEQVVRHPDILILEGLNVLQTGPTLMVSDLFDFSLYVDARIEDIEQWYVSRFLAMRTTAFADPESHFHHYAAFSDSQAVVAAREIWRTINRPNLVENILPTRPRATLVLRKDADHSINRLRLRKL,./data/raw/alphafold//AF-P9WPA7-F1-model_v4.pdb,1615,1205,1681,1409
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+262,19461,19747,MPLPTQTYYLLAFLFLVIIISAANPTLESKCDCFHSSFNRRIFPADFVFGAASSAFQVEGAFKENGKGPSMWDNFTHMCPEKIKDHSNGDIAIDSYHLYKEDVKIARDLGLDAYRISISWPRILPGGKIEAGVNQDGIDYYNNLINELLANGIEPFVTLLHLDIPLALQDAYGGFLNSQIVTDFVDFANILFQQFGDRVKNWITINEPWTLSVYGYANSYFAPGRCSEWQQLGCTGGDSATEPYIVAHHQLLAHSALVNLYKNKYQAWQKGKIGITFASYWFVPLDETNENLKAKDRALDFMLGWFMEPLTSGYYPESMKMRVGDRLPEFTENERKMMKGSFDFIGFNYYGAIYAFNKPNSSSSSYTTDAEFEITGTRDGKAIGEQGRNTSRIYIYPKGLYQILKLFKERYNDPLIYITENGLDEAANETLEVSEAIKDNMRKHYIYDHLCCLHKSIEEDATNVKGYFVWSLMDNFEWSAGFSVRFGLNYVDYKDKFLTRYPKHSAMWFKDFLSIQHNLPMNLNSSKMLYAM,brenda,A0A3G1VCB1,O.O=C1C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)Oc2ccccc2N1O>>O=C1C(O)Oc2ccccc2N1O.OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O,211.1,7.855575943373608e-15,30.0,5.5,3.2.1.21,53161.0,2.3244882333076564,O.O=C1C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)Oc2ccccc2N1O,O=C1C(O)Oc2ccccc2N1O.OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O,2.3244882333076564,O.O=C1C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)Oc2ccccc2N1O__MPLPTQTYYLLAFLFLVIIISAANPTLESKCDCFHSSFNRRIFPADFVFGAASSAFQVEGAFKENGKGPSMWDNFTHMCPEKIKDHSNGDIAIDSYHLYKEDVKIARDLGLDAYRISISWPRILPGGKIEAGVNQDGIDYYNNLINELLANGIEPFVTLLHLDIPLALQDAYGGFLNSQIVTDFVDFANILFQQFGDRVKNWITINEPWTLSVYGYANSYFAPGRCSEWQQLGCTGGDSATEPYIVAHHQLLAHSALVNLYKNKYQAWQKGKIGITFASYWFVPLDETNENLKAKDRALDFMLGWFMEPLTSGYYPESMKMRVGDRLPEFTENERKMMKGSFDFIGFNYYGAIYAFNKPNSSSSSYTTDAEFEITGTRDGKAIGEQGRNTSRIYIYPKGLYQILKLFKERYNDPLIYITENGLDEAANETLEVSEAIKDNMRKHYIYDHLCCLHKSIEEDATNVKGYFVWSLMDNFEWSAGFSVRFGLNYVDYKDKFLTRYPKHSAMWFKDFLSIQHNLPMNLNSSKMLYAM,./data/raw/alphafold//AF-A0A3G1VCB1-F1-model_v4.pdb,1219,615,286,316
+263,16929,17159,MDSEINDDSVHQTNLPHKFSTDELKIASTAHATAYFDTNRTVVDADNSDFVDVAAVVVMDDEKAIINKADETKFNIPIFIITDDSSKVDGETMSKIFHIIDWHNNYDRRLYDREIEAAAKKYEDGVLPPFFKALKAYVERGNIQFDCPGHQGGQYFRKSPAGREFYNFYGENIFRSDICNADVDLGDLLIHEGPAMDAEKHAARVFNADKTYFVMNGTTTSNNIAITAAVAPGDLVLFDRNNHKSVYNAALVQAGGRPVYLETSRDSYGFIGGIYSKDFDEKSIREKIAKVDPEKAKAKRPFRLAVIQLGTYDGTIYNAKQVVERIGHLCDYILFDSAWVGYEQFIPMMKDSSPLLLNLGPDDPGILVTQSTHKQQAGFSQASQIHKKDSHIKGQKRYINHKQFNNAYMKFSSTSPFYPLFATLDINAKMQEGEAGKKLWHDALVTSVNARKNLLKNATMIKPFLPPVVHGKPWQDADTEKIVSDIDYWKFEKGAKWHGFDGYADNQYFVDPNKFMLTTPGIDVETGEYEDFGIPAVILANYLREHGIIPEKNDLNSILFLMTPAETQAKMDNLVTQIVKFESLVKADAPLDEVLPRLYSEHQDRYEGYTIKQLCQEVHDFYKNNNTKEYQKEMFLGKYFPEQAMTPYQANVELLKNNAKLVPLTDIEGLAALEGALPYPPGIFCIVPGEKWTKVAQKYFLILEESINRFPGFAPEIQGVYFEKENGKSVAYGYVYDKSKDEEKR,brenda,Q5ZH57,NCCC[C@H](N)C(=O)O>>NCCCCN.O=C=O,6.9,0.0,30.0,5.5,4.1.1.17,1247.0,0.8388490907372553,NCCC[C@H](N)C(=O)O,NCCCCN.O=C=O,0.8388490907372553,NCCC[C@H](N)C(=O)O__MDSEINDDSVHQTNLPHKFSTDELKIASTAHATAYFDTNRTVVDADNSDFVDVAAVVVMDDEKAIINKADETKFNIPIFIITDDSSKVDGETMSKIFHIIDWHNNYDRRLYDREIEAAAKKYEDGVLPPFFKALKAYVERGNIQFDCPGHQGGQYFRKSPAGREFYNFYGENIFRSDICNADVDLGDLLIHEGPAMDAEKHAARVFNADKTYFVMNGTTTSNNIAITAAVAPGDLVLFDRNNHKSVYNAALVQAGGRPVYLETSRDSYGFIGGIYSKDFDEKSIREKIAKVDPEKAKAKRPFRLAVIQLGTYDGTIYNAKQVVERIGHLCDYILFDSAWVGYEQFIPMMKDSSPLLLNLGPDDPGILVTQSTHKQQAGFSQASQIHKKDSHIKGQKRYINHKQFNNAYMKFSSTSPFYPLFATLDINAKMQEGEAGKKLWHDALVTSVNARKNLLKNATMIKPFLPPVVHGKPWQDADTEKIVSDIDYWKFEKGAKWHGFDGYADNQYFVDPNKFMLTTPGIDVETGEYEDFGIPAVILANYLREHGIIPEKNDLNSILFLMTPAETQAKMDNLVTQIVKFESLVKADAPLDEVLPRLYSEHQDRYEGYTIKQLCQEVHDFYKNNNTKEYQKEMFLGKYFPEQAMTPYQANVELLKNNAKLVPLTDIEGLAALEGALPYPPGIFCIVPGEKWTKVAQKYFLILEESINRFPGFAPEIQGVYFEKENGKSVAYGYVYDKSKDEEKR,./data/raw/alphafold//AF-Q5ZH57-F1-model_v4.pdb,2716,3822,2407,5315
+264,16179,16406,AKPAAENLSLVVHGPGDLRLENYPIPEPGPNEVLLKMHSVGICGSDVHYWQGRIGDFVVKKPMVLGHEASGTVVKVGSLVRHLQPGDRVAIQPGAPRQTDEFCKIGRYNLSPTIFFCATPPDDGNLCRFYKHNANFCYKLPDNVTFEEGALIEPLSVGIHACRRAGVTLGNKVLVCGAGPIGLVNLLAAKAMGAAQVVVTDLSASRLSKAKEVGADFILEISNESPEEIAKKVEGLLGSKPEVTIECTGVETSIQAGIYATHSGGTLVLVGLGSEMTSVPLVHAATREVDIKGVFRYCNTWPMAISMLASKSVNVKPLVTHRFPLEKALEAFETSKKGLGLKVMIKCDPSDQNP,sabio,P07846,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)[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.OCC1(O)OCC(O)C(O)C1O.[H],4.3,6.71027598078266e-15,23.5,7.4,1.1.1.14,9940.0,0.6334684555795865,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)[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.OCC1(O)OCC(O)C(O)C1O.[H],0.8450980400142568,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)[C@@H](O)[C@@H](O)CO__AKPAAENLSLVVHGPGDLRLENYPIPEPGPNEVLLKMHSVGICGSDVHYWQGRIGDFVVKKPMVLGHEASGTVVKVGSLVRHLQPGDRVAIQPGAPRQTDEFCKIGRYNLSPTIFFCATPPDDGNLCRFYKHNANFCYKLPDNVTFEEGALIEPLSVGIHACRRAGVTLGNKVLVCGAGPIGLVNLLAAKAMGAAQVVVTDLSASRLSKAKEVGADFILEISNESPEEIAKKVEGLLGSKPEVTIECTGVETSIQAGIYATHSGGTLVLVGLGSEMTSVPLVHAATREVDIKGVFRYCNTWPMAISMLASKSVNVKPLVTHRFPLEKALEAFETSKKGLGLKVMIKCDPSDQNP,./data/raw/alphafold//AF-P07846-F1-model_v4.pdb,2358,553,213,231
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+266,18155,18411,MKIYFATGNPNKIKEANIILKDLKDVEIEQIKISYPEIQGTLEEVAEFGAKWVYNILKKPVIVEDSGFFVEALNGFPGTYSKFVQETIGNEGILKLLEGKDNRNAYFKTVIGYCDENGVRLFKGIVKGRVSEEIRSKGYGFAYDSIFIPEEEERTFAEMTTEEKSQISHRKKAFEEFKKFLLDRI,sabio,Q57679,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,1.02,1.0812962383427719e-14,80.0,7.6,3.6.1.9,2190.0,0.0086001717619175,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,0.0086001717619175,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O__MKIYFATGNPNKIKEANIILKDLKDVEIEQIKISYPEIQGTLEEVAEFGAKWVYNILKKPVIVEDSGFFVEALNGFPGTYSKFVQETIGNEGILKLLEGKDNRNAYFKTVIGYCDENGVRLFKGIVKGRVSEEIRSKGYGFAYDSIFIPEEEERTFAEMTTEEKSQISHRKKAFEEFKKFLLDRI,./data/raw/alphafold//AF-Q57679-F1-model_v4.pdb,2037,4201,4071,3918
+267,12635,12806,MAGTGGGAEEFQLRGVLWGKAYSWKISGTTIDKVWAIVGDYVRVDNWVSSVVKSSHVVSGDANKTGCVRRFVCYPASEGESETVDYSELIHMNAAAHQYMYMIVGGNITGFSLMKNYVSNISLNSLPEADGGGVILHWSFTAEPASNLTEQKCIEIVFPLYTTALKDLCTHLSIPESSVTLLGD,brenda,A0A1C9V3R4,N#C[C@H](O)c1ccccc1>>C#N.O=Cc1ccccc1,356.0,0.0,10.0,5.0,4.1.2.10,328207.0,2.551449997972876,N#C[C@H](O)c1ccccc1,C#N.O=Cc1ccccc1,2.551449997972876,N#C[C@H](O)c1ccccc1__MAGTGGGAEEFQLRGVLWGKAYSWKISGTTIDKVWAIVGDYVRVDNWVSSVVKSSHVVSGDANKTGCVRRFVCYPASEGESETVDYSELIHMNAAAHQYMYMIVGGNITGFSLMKNYVSNISLNSLPEADGGGVILHWSFTAEPASNLTEQKCIEIVFPLYTTALKDLCTHLSIPESSVTLLGD,./data/raw/alphafold//AF-A0A1C9V3R4-F1-model_v4.pdb,2135,4335,4222,4080
+268,1728,1759,MTMAANTDRAVLQAALPPLSGSLPIPGLSASVRVRRDAWGIPHIKASGEADAYRALGFVHSQDRLFQMELTRRKALGRAAEWLGAEAAEADILVRRLGMEKVCRRDFEALGVEAKDMLRAYVAGVNAFLASGAPLPVEYGLLGAEPEPWEPWHSIAVMRRLGLLMGSVWFKLWRMLALPVVGAANALKLRYDDGGRDLLCIPPGAEADRLEADLATLRPAVDALLKAMGGDASDAAGGGSNNWAVAPGRTATGRPILAGDPHRVFEIPGFYAQHHLACDRFDMIGLTVPGVPGFPHFAHNGKVAYCVTHAFMDIHDLYLEQFAGEGRTARFGNDFEPVAWSRDRIAVRGGADREFDIVETRHGPVIAGDPRDGAALTLRSVQFAETDLSFDCLTRMPGASTVAQLYDATRGWGLIDHNLVAGDVAGSIGHLVRARVPSRPRENGWLPVPGWSGEHEWRGWIPHEAMPRVIDPPGGIIVTANNRVVADDHPDYLCTDCHPPYRAERIMKRLVANPAFAVDDAAAIHADTLSPHVGLLRRRLEALGARDDSAAEGLRQMLVAWDGRMDAASEVASAYNAFRRALTRLVTDRSGLEQAISHPFAAVAPGVSPQGQVWWAVPTLLRDDDAGMLKGWSWDQALSEALSVASQNLTGRSWGEEHRPRFTHPLATQFPAWAGLLNPASRPIGGDGDTVLANGLVPSAGPQATYGALSRYVFDVGNWDNSRWVVFHGASGHPASAHYADQNAPWSDCAMVPMLYSWDRIAAEAVTSQELVPA,uniprot_search,A0A1D8GRD5,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)CCC[C@@H](N)C(=O)O)[C@H]2SC1.O>>CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N)[C@H]2SC1.NC(CCCC(=O)O)C(=O)O,0.015,1.9649104664759795e-14,38.0,8.683333333333334,3.5.1.93,306.0,-1.8239087409443189,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)CCC[C@@H](N)C(=O)O)[C@H]2SC1.O,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N)[C@H]2SC1.NC(CCCC(=O)O)C(=O)O,0.7730546933642626,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)CCC[C@@H](N)C(=O)O)[C@H]2SC1.O__MTMAANTDRAVLQAALPPLSGSLPIPGLSASVRVRRDAWGIPHIKASGEADAYRALGFVHSQDRLFQMELTRRKALGRAAEWLGAEAAEADILVRRLGMEKVCRRDFEALGVEAKDMLRAYVAGVNAFLASGAPLPVEYGLLGAEPEPWEPWHSIAVMRRLGLLMGSVWFKLWRMLALPVVGAANALKLRYDDGGRDLLCIPPGAEADRLEADLATLRPAVDALLKAMGGDASDAAGGGSNNWAVAPGRTATGRPILAGDPHRVFEIPGFYAQHHLACDRFDMIGLTVPGVPGFPHFAHNGKVAYCVTHAFMDIHDLYLEQFAGEGRTARFGNDFEPVAWSRDRIAVRGGADREFDIVETRHGPVIAGDPRDGAALTLRSVQFAETDLSFDCLTRMPGASTVAQLYDATRGWGLIDHNLVAGDVAGSIGHLVRARVPSRPRENGWLPVPGWSGEHEWRGWIPHEAMPRVIDPPGGIIVTANNRVVADDHPDYLCTDCHPPYRAERIMKRLVANPAFAVDDAAAIHADTLSPHVGLLRRRLEALGARDDSAAEGLRQMLVAWDGRMDAASEVASAYNAFRRALTRLVTDRSGLEQAISHPFAAVAPGVSPQGQVWWAVPTLLRDDDAGMLKGWSWDQALSEALSVASQNLTGRSWGEEHRPRFTHPLATQFPAWAGLLNPASRPIGGDGDTVLANGLVPSAGPQATYGALSRYVFDVGNWDNSRWVVFHGASGHPASAHYADQNAPWSDCAMVPMLYSWDRIAAEAVTSQELVPA,./data/raw/alphafold//AF-A0A1D8GRD5-F1-model_v4.pdb,1433,952,756,1054
+269,12231,12399,MTTPILNSSVPGNIQKKSLEGTHIAISGLIGAGKTTLAVALGKVLNLPTYFEEVIDNLYLQDFYKDPKKYGFQLQIYLLNSRFQQQQQIIWQARGGVQDRTIYEDSVFAKMLNESGLLDDRDYNTYCKLFQNLSNFMRRPDLIIHLDVSPEKSLERIKLRNRDCEKDVSLEYLQNLYNAYHEFLQDISRYIPVIRINWSEFVDPEQLAQMIKAEYESMRFMNQINPPTFGNGPTTNKIISTPKDL,sabio,Q54YL2,Cc1cn(C2CC(O)C(CO)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>Cc1cn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,0.0081,0.0,22.0,8.0,2.7.1.76,44689.0,-2.0915149811213505,Cc1cn(C2CC(O)C(CO)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,Cc1cn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,-2.0915149811213505,Cc1cn(C2CC(O)C(CO)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MTTPILNSSVPGNIQKKSLEGTHIAISGLIGAGKTTLAVALGKVLNLPTYFEEVIDNLYLQDFYKDPKKYGFQLQIYLLNSRFQQQQQIIWQARGGVQDRTIYEDSVFAKMLNESGLLDDRDYNTYCKLFQNLSNFMRRPDLIIHLDVSPEKSLERIKLRNRDCEKDVSLEYLQNLYNAYHEFLQDISRYIPVIRINWSEFVDPEQLAQMIKAEYESMRFMNQINPPTFGNGPTTNKIISTPKDL,./data/raw/alphafold//AF-Q54YL2-F1-model_v4.pdb,2021,4182,4051,3898
+270,15420,15644,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=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.OCC(O)CO,2.5,0.0602505418364722,25.0,7.0,1.1.1.-,4896.0,0.3979400086720376,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,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,0.3979400086720376,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__MLIAAMGPKIPVPAYGVGTALFKKEKGEINRTIVDSVKNALAAGFIHIDCAEVYGNEEEVGVALKEANVPRSKLFITSKVMHNVDNIPEALNESLRKLGTDYLDLYLLHSPIPFYEKKIPISEGWKAMETALGTGLVHSVGVSNFRIPDLEELLKTSTITPRVNQIEFHPQVYKAAKPLVEFCQSKGIIVEGYGPLSPLVRDAQGPVAEFTKSLESKYHVSDTQILLKWAYSKGVIPITTTSKIERMKECLNFDSFTLDKADIDELGTLGVQHHKRTFMKHMDE,./data/raw/alphafold//AF-O13848-F1-model_v4.pdb,2542,4991,2077,4937
+271,15247,15460,MDLGLAGRRALVTGAGKGIGRSTVLALQAAGAQVVAVSRTREDLDSLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVATLQPFLEVTKEACDTSFNVNFRAVVQVSQIVARGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTPMGRANWSDPHKAKVMLDRIPLGKFAEVENVVDTILFLLSNRSSMTTGSALPVDGGFLAT,sabio,Q920P0,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(CBr)C(=O)CBr>>NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,90000.0,14.11694309872924,25.0,7.0,1.1.1.10,10116.0,4.954242509439325,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(CBr)C(=O)CBr,NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,4.954242509439325,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(CBr)C(=O)CBr__MDLGLAGRRALVTGAGKGIGRSTVLALQAAGAQVVAVSRTREDLDSLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVATLQPFLEVTKEACDTSFNVNFRAVVQVSQIVARGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTPMGRANWSDPHKAKVMLDRIPLGKFAEVENVVDTILFLLSNRSSMTTGSALPVDGGFLAT,./data/raw/alphafold//AF-Q920P0-F1-model_v4.pdb,1316,3874,6191,848
+272,16454,16682,MAAPVNKAPRDADLWSLHEKMLAQPLKDNDVEVYNIIKKESNRQRVGLELIASENFASRAVLEALGSCLNNKYSEGYPGQRYYGGTEFIDELEVLCQKRALQVYGLDPECWGVNVQPYSGSPANFAVYTALVEPHGRIMGLDLPDGGHLTHGFMTDKKKISATSIFFESMPYKVNPDTGYINYDQLEENARLFHPRLIIAGTSCYSRNLDYARLRKIADDNGAYLMADMAHISGLVAAGVVPSPFEHCHVVSTTTHKTLRGCRAGMIFYRKGVRSVDPKTGKETRYNLESLINSAVFPGLQGGPHNHAIAGVAVALKQAMTPEFRAYQRQVVANCRALAEALMGLGYRVVTGGSDNHLILVDLRSKGTDGGRAEKVLEACSIACNKNTCPGDKSALRPSGLRLGTPALTSRGLLEEDFRKVAHFIHRGIELTLQIQDAVGVKATLKEFMEKLAGAEEHQRAVTALRAEVESFATLFPLPGLPGF,sabio,P35623,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,4.3,0.0,37.0,7.4,2.1.2.1,9940.0,0.6334684555795865,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,0.6334684555795865,NC(CO)C(=O)O.Nc1nc2c(c(=O)[nH]1)NC(CNc1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1)CN2__MAAPVNKAPRDADLWSLHEKMLAQPLKDNDVEVYNIIKKESNRQRVGLELIASENFASRAVLEALGSCLNNKYSEGYPGQRYYGGTEFIDELEVLCQKRALQVYGLDPECWGVNVQPYSGSPANFAVYTALVEPHGRIMGLDLPDGGHLTHGFMTDKKKISATSIFFESMPYKVNPDTGYINYDQLEENARLFHPRLIIAGTSCYSRNLDYARLRKIADDNGAYLMADMAHISGLVAAGVVPSPFEHCHVVSTTTHKTLRGCRAGMIFYRKGVRSVDPKTGKETRYNLESLINSAVFPGLQGGPHNHAIAGVAVALKQAMTPEFRAYQRQVVANCRALAEALMGLGYRVVTGGSDNHLILVDLRSKGTDGGRAEKVLEACSIACNKNTCPGDKSALRPSGLRLGTPALTSRGLLEEDFRKVAHFIHRGIELTLQIQDAVGVKATLKEFMEKLAGAEEHQRAVTALRAEVESFATLFPLPGLPGF,./data/raw/alphafold//AF-P35623-F1-model_v4.pdb,2621,4869,4934,2286
+273,9874,10024,MNLEKFVDELPIPEVAEPVKKNPRQTYYEIAKEEVFLKVHRDLPPTKLWTYNGSLPGPTIKANRNEKVKVKWMNKLPLKHFLPVDHTIHPGHHDEPEVKTVVHLHGGVTPASSDGYPEAWFSRDFEATGPFFERETYVYPNHQQACTLWYHDHAMALTRLNVYAGLAGFYLISDAFEKSLELPKDDYDIPLMIMDRTFQEDGSLFYPSRPNDTPEDSDIPDPSIVPFFCGETILVNGKVWPYLEVEPRKYRFRILNASNTRTYELHLDNDATIMQIGSDGGFLPRPVRHQSFSIAPAERFDVIIDFSAYENKTITLKNTAGCGQDVNPETDANIMQFKVTRPLKGRVPKTLRPIFKPLPPLRPSRADRERTLTLTGTQDKYGRPILLLDNHFWNDPVTENPRLGSLEVWSIVNPTRGTHPIHLHLVQFRVLDRRPFDTEVYQSTGEIVYTGPNEAPPLHEQGYKDTIQAHAGEVIRIVARFVPYTGRYVWHCHILEHEDYDMMRPMDIIQ,brenda,K4PL78,COc1ccccc1O.O=O>>COC1=CCC=CC1=O.O,11.9,4.672041591628207,22.0,7.0,1.10.3.2,1408.0,1.0755469613925308,COc1ccccc1O.O=O,COC1=CCC=CC1=O.O,1.0755469613925308,COc1ccccc1O.O=O__MNLEKFVDELPIPEVAEPVKKNPRQTYYEIAKEEVFLKVHRDLPPTKLWTYNGSLPGPTIKANRNEKVKVKWMNKLPLKHFLPVDHTIHPGHHDEPEVKTVVHLHGGVTPASSDGYPEAWFSRDFEATGPFFERETYVYPNHQQACTLWYHDHAMALTRLNVYAGLAGFYLISDAFEKSLELPKDDYDIPLMIMDRTFQEDGSLFYPSRPNDTPEDSDIPDPSIVPFFCGETILVNGKVWPYLEVEPRKYRFRILNASNTRTYELHLDNDATIMQIGSDGGFLPRPVRHQSFSIAPAERFDVIIDFSAYENKTITLKNTAGCGQDVNPETDANIMQFKVTRPLKGRVPKTLRPIFKPLPPLRPSRADRERTLTLTGTQDKYGRPILLLDNHFWNDPVTENPRLGSLEVWSIVNPTRGTHPIHLHLVQFRVLDRRPFDTEVYQSTGEIVYTGPNEAPPLHEQGYKDTIQAHAGEVIRIVARFVPYTGRYVWHCHILEHEDYDMMRPMDIIQ,./data/raw/alphafold//AF-K4PL78-F1-model_v4.pdb,3403,2293,3997,2938
+274,322,336,MDYGMYFFEHVTPYETLVRRMERVIASGKTPFQDYFLFESKGFGKVLILDKDVQSTERDEYIYHETLVHPAMLTHPEPKRVLIVGGGEGATLREVLKHPTVEKAVMVDIDGELVEVAKRHMPEWHQGAFDDPRAVLVIDDARAYLERTEERYDVVIIDLTDPVGEDNPARLLYTVEFYRLVKAHLNPGGVMGMQAGMILLTHHRVHPVVHRTVREAFRYVRSYKNHIPGFFLNFGFLLASDAFDPAAFSEGVIEARIRERNLALRHLTAPYLEAMFVLPKDLLEALEKETMVSTDQNPFYVTPEGEARQAPYKG,sabio,Q5SK28,C(C[NH3+])CN(CCC[NH3+])CCC[NH3+].C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O>>CSCC1OC(n2cnc3c(N)ncnc32)C(O)C1O,0.29,29.515918909229026,37.0,9.0,2.5.1.79,274.0,-0.5376020021010439,C(C[NH3+])CN(CCC[NH3+])CCC[NH3+].C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O,CSCC1OC(n2cnc3c(N)ncnc32)C(O)C1O,-0.5376020021010439,C(C[NH3+])CN(CCC[NH3+])CCC[NH3+].C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O__MDYGMYFFEHVTPYETLVRRMERVIASGKTPFQDYFLFESKGFGKVLILDKDVQSTERDEYIYHETLVHPAMLTHPEPKRVLIVGGGEGATLREVLKHPTVEKAVMVDIDGELVEVAKRHMPEWHQGAFDDPRAVLVIDDARAYLERTEERYDVVIIDLTDPVGEDNPARLLYTVEFYRLVKAHLNPGGVMGMQAGMILLTHHRVHPVVHRTVREAFRYVRSYKNHIPGFFLNFGFLLASDAFDPAAFSEGVIEARIRERNLALRHLTAPYLEAMFVLPKDLLEALEKETMVSTDQNPFYVTPEGEARQAPYKG,./data/raw/alphafold//AF-Q5SK28-F1-model_v4.pdb,1017,558,219,237
+275,13308,13483,MKEQITICGAGLVGSLLAVYLIERGFSVRVFEKRKDPRKNEADAGRSINLAISHRGIHALKDAQTGLEKEALKLAVPMYGRAIHDLHGHVSFQAYGEASQHINSIGRGALNKLLITTAENLGVHFLFEHTCTDYHAAGEQWLFSDITGNTVATQSKEIVIGADGAFSIVRSFLSKQQQPQPQIETLEYGYKELEIASAHTETITNNQALHIWPRERFMLIALPNEDGSYTATLFLPLKGEISFEALQSDQDIQLFFKKYFPDTENLFPDLTEQFYRHPTSKLFTIHSSNWFNAHTLLIGDAAHALVPFYGQGMNAGFEDCRILAEIIDGKSKTNWSEIFAEFYNQRKENADAISDLALQNFIEMRDHVADASFLLRKKIEKHLHQELEDAFIPQYTMVSFTDISYKEAMETGLLHQKILDEIMAIPDIEAAWPTEELKNKVITVTKKYI,brenda,Q11PP7,N=C(O)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.Nc1ccc(Br)cc1C(=O)C[C@H](N)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.Nc1c(O)cc(Br)cc1C(=O)C[C@H](N)C(=O)O.O,0.6,0.0,30.0,8.0,1.14.13.9,985.0,-0.2218487496163563,N=C(O)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.Nc1ccc(Br)cc1C(=O)C[C@H](N)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.Nc1c(O)cc(Br)cc1C(=O)C[C@H](N)C(=O)O.O,-0.2218487496163563,N=C(O)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.Nc1ccc(Br)cc1C(=O)C[C@H](N)C(=O)O.O=O.[H+]__MKEQITICGAGLVGSLLAVYLIERGFSVRVFEKRKDPRKNEADAGRSINLAISHRGIHALKDAQTGLEKEALKLAVPMYGRAIHDLHGHVSFQAYGEASQHINSIGRGALNKLLITTAENLGVHFLFEHTCTDYHAAGEQWLFSDITGNTVATQSKEIVIGADGAFSIVRSFLSKQQQPQPQIETLEYGYKELEIASAHTETITNNQALHIWPRERFMLIALPNEDGSYTATLFLPLKGEISFEALQSDQDIQLFFKKYFPDTENLFPDLTEQFYRHPTSKLFTIHSSNWFNAHTLLIGDAAHALVPFYGQGMNAGFEDCRILAEIIDGKSKTNWSEIFAEFYNQRKENADAISDLALQNFIEMRDHVADASFLLRKKIEKHLHQELEDAFIPQYTMVSFTDISYKEAMETGLLHQKILDEIMAIPDIEAAWPTEELKNKVITVTKKYI,./data/raw/alphafold//AF-Q11PP7-F1-model_v4.pdb,2218,4455,4360,4246
+276,14855,15064,MDIKKIIEEKCNIVVDSIKLIGEGYDSKAYIVNNEYVFKIKFSANKKKGYEKEKAIYDFLNKKLNTNIKIPNIEYSYISEELSILGYKEIKGTFLTPEIYFALSKEKQELLKQDIAMFLRQMHDLDYSEISSYTIDNKQNVLEEYQLLKETIYDSLTDIEKQYVEEFMQRLNSTTIFDGKKCLCHNDFSCNHLLLDDENRLCGVIDFGDSGIIDEYCDFIYLLEDSEEEIGVSFGEDILRLYGNIDISKAKEYQDVVEQYYPIETIVYGIKNNRPDFIEKGRKEIYIRTRKDEKLRK,brenda,Q4VR94,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.NCC[C@@H](O)C(O)=N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)CC[C@@H]2N)[C@H](O)[C@H]1O[C@H]1O[C@H](CO)[C@H](O)[C@H](N)[C@H]1O>>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.NCC[C@H](O)C(O)=N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)CC[C@H]2N)[C@H](O)[C@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](N)[C@H]1OP(=O)(O)O,4.3,0.0,22.0,7.0,2.7.1.190,197.0,0.6334684555795865,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.NCC[C@@H](O)C(O)=N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)CC[C@@H]2N)[C@H](O)[C@H]1O[C@H]1O[C@H](CO)[C@H](O)[C@H](N)[C@H]1O,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.NCC[C@H](O)C(O)=N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)CC[C@H]2N)[C@H](O)[C@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](N)[C@H]1OP(=O)(O)O,0.6334684555795865,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.NCC[C@@H](O)C(O)=N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)CC[C@@H]2N)[C@H](O)[C@H]1O[C@H]1O[C@H](CO)[C@H](O)[C@H](N)[C@H]1O__MDIKKIIEEKCNIVVDSIKLIGEGYDSKAYIVNNEYVFKIKFSANKKKGYEKEKAIYDFLNKKLNTNIKIPNIEYSYISEELSILGYKEIKGTFLTPEIYFALSKEKQELLKQDIAMFLRQMHDLDYSEISSYTIDNKQNVLEEYQLLKETIYDSLTDIEKQYVEEFMQRLNSTTIFDGKKCLCHNDFSCNHLLLDDENRLCGVIDFGDSGIIDEYCDFIYLLEDSEEEIGVSFGEDILRLYGNIDISKAKEYQDVVEQYYPIETIVYGIKNNRPDFIEKGRKEIYIRTRKDEKLRK,./data/raw/alphafold//AF-Q4VR94-F1-model_v4.pdb,3351,2216,3904,2777
+277,7157,7278,MITTKTVNGVQIAFDDQGHEPGPVFVTLSGWAHDLRAYDGMLPYLRAAQRTVRVCWRGHGPDRNLVGDFGIDEMAADTIGLLDALEVDSFVPIAHAHGGWAALEIADRLGAQRVPAVMILDLIMTPAPREFVAALHGIQDPERWKEGRDGLVQSWLAGTTNQAVLDHVRYDSGGHGFDMWARAGRVIDEAYRTWGSPMRRMEALAEPCAIRHVFSHPKIGEYDALHDDFAARHPWFSYRRLGGETHFPGIELPQQVAAEAIDLLAGARI,sabio,B1MFK2,CCCCCCCC1=Nc2ccccc2C(=O)C1O.O=O>>CCCCCCCC(=O)Nc1ccccc1C(=O)O.[C-]#[O+].[H],97.8,0.1723955108756223,30.0,,1.13.11.-,36809.0,1.9903388547876013,CCCCCCCC1=Nc2ccccc2C(=O)C1O.O=O,CCCCCCCC(=O)Nc1ccccc1C(=O)O.[C-]#[O+].[H],1.9903388547876013,CCCCCCCC1=Nc2ccccc2C(=O)C1O.O=O__MITTKTVNGVQIAFDDQGHEPGPVFVTLSGWAHDLRAYDGMLPYLRAAQRTVRVCWRGHGPDRNLVGDFGIDEMAADTIGLLDALEVDSFVPIAHAHGGWAALEIADRLGAQRVPAVMILDLIMTPAPREFVAALHGIQDPERWKEGRDGLVQSWLAGTTNQAVLDHVRYDSGGHGFDMWARAGRVIDEAYRTWGSPMRRMEALAEPCAIRHVFSHPKIGEYDALHDDFAARHPWFSYRRLGGETHFPGIELPQQVAAEAIDLLAGARI,./data/raw/alphafold//AF-B1MFK2-F1-model_v4.pdb,3296,2134,3807,2671
+278,5392,5478,MKTVFILISMLFPVAVMAQKSVKISDDISITQLSDKVYTYVSLAEIEGWGMVPSNGMIVINNHQAALLDTPINDAQTEMLVNWVTDSLHAKVTTFIPNHWHGDCIGGLGYLQRKGVQSYANQMTIDLAKEKGLPVPEHGFTDSLTVSLDGMPLQCYYLGGGHATDNIVVWLPTENILFGGCMLKDNQATSIGNISDADVTAWPKTLDKVKAKFPSARYVVPGHGDYGGTELIEHTKQIVNQYIESTSKP,sabio,P25910,CC1(C)S[C@@H]2[C@H](N=C(O)C(C(=O)O)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O>>,190.0,99.74837766499506,25.0,7.2,3.5.2.6,817.0,2.278753600952829,CC1(C)S[C@@H]2[C@H](N=C(O)C(C(=O)O)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O,,2.414973347970818,CC1(C)S[C@@H]2[C@H](N=C(O)C(C(=O)O)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O__MKTVFILISMLFPVAVMAQKSVKISDDISITQLSDKVYTYVSLAEIEGWGMVPSNGMIVINNHQAALLDTPINDAQTEMLVNWVTDSLHAKVTTFIPNHWHGDCIGGLGYLQRKGVQSYANQMTIDLAKEKGLPVPEHGFTDSLTVSLDGMPLQCYYLGGGHATDNIVVWLPTENILFGGCMLKDNQATSIGNISDADVTAWPKTLDKVKAKFPSARYVVPGHGDYGGTELIEHTKQIVNQYIESTSKP,./data/raw/alphafold//AF-P25910-F1-model_v4.pdb,1190,811,517,591
+279,1829,1860,MSLQSRLSGRLAQLRAAGQLLVPPRPRPGHLAGATRTRSSTCGPPAFLGVFGRRARTSAGVGAWGAAAVGRTAGVRTWAPLAMAAKVDLSTSTDWKEAKSFLKGLSDKQREEHYFCKDFVRLKKIPTWKEMAKGVAVKVEEPRYKKDKQLNEKISLLRSDITKLEVDAIVNAANSSLLGGGGVDGCIHRAAGPLLTDECRTLQSCKTGKAKITGGYRLPAKYVIHTVGPIAYGEPSASQAAELRSCYLSSLDLLLEHRLRSVAFPCISTGVFGYPCEAAAEIVLATLREWLEQHKDKVDRLIICVFLEKDEDIYRSRLPHYFPVA,brenda,Q9BQ69,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.O>>CC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O,0.198,9.170216151904108e-15,23.0,7.3,3.1.1.106,9606.0,-0.7033348097384688,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.O,CC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O,-0.7033348097384688,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.O__MSLQSRLSGRLAQLRAAGQLLVPPRPRPGHLAGATRTRSSTCGPPAFLGVFGRRARTSAGVGAWGAAAVGRTAGVRTWAPLAMAAKVDLSTSTDWKEAKSFLKGLSDKQREEHYFCKDFVRLKKIPTWKEMAKGVAVKVEEPRYKKDKQLNEKISLLRSDITKLEVDAIVNAANSSLLGGGGVDGCIHRAAGPLLTDECRTLQSCKTGKAKITGGYRLPAKYVIHTVGPIAYGEPSASQAAELRSCYLSSLDLLLEHRLRSVAFPCISTGVFGYPCEAAAEIVLATLREWLEQHKDKVDRLIICVFLEKDEDIYRSRLPHYFPVA,./data/raw/alphafold//AF-Q9BQ69-F1-model_v4.pdb,1473,1013,834,1155
+280,15172,15384,SRLPPATRDKLADEITFFPA,sabio,P84468,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[Fe+3].[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.[Fe+2],14.0,0.1396526141223757,30.0,7.4,1.16.1.7,266.0,1.146128035678238,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[Fe+3].[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.[Fe+2],1.146128035678238,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[Fe+3].[H]__SRLPPATRDKLADEITFFPA,./data/raw/alphafold//AF-P84468-F1-model_v4.pdb,1978,4130,1995,3833
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+290,516,533,MARDARKRTSSNFPQLPPAPDDYPTFPDTSTWPVVFPELPAAPYGGPCRPPQHTSKAAAPRIPADRLPNHVAIVMDGNGRWATQRGLARTEGHKMGEAVVIDIACGAIELGIKWLSLYAFSTENWKRSPEEVRFLMGFNRDVVRRRRDTLKKLGVRIRWVGSRPRLWRSVINELAVAEEMTKSNDVITINYCVNYGGRTEITEATREIAREVAAGRLNPERITESTIARHLQRPDIPDVDLFLRTSGEQRSSNFMLWQAAYAEYIFQDKLWPDYDRRDLWAACEEYASRTRRFGSA,brenda,P9WFF7,C=C(C)CCOP(=O)(O)OP(=O)(O)O.CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O>>CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O.CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O.CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O.O=P(O)(O)OP(=O)(O)O,0.03,57.087291136061,37.0,7.9,2.5.1.86,1773.0,-1.5228787452803376,C=C(C)CCOP(=O)(O)OP(=O)(O)O.CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O,CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O.CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O.CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O.O=P(O)(O)OP(=O)(O)O,-1.5228787452803376,C=C(C)CCOP(=O)(O)OP(=O)(O)O.CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/COP(=O)(O)OP(=O)(O)O__MARDARKRTSSNFPQLPPAPDDYPTFPDTSTWPVVFPELPAAPYGGPCRPPQHTSKAAAPRIPADRLPNHVAIVMDGNGRWATQRGLARTEGHKMGEAVVIDIACGAIELGIKWLSLYAFSTENWKRSPEEVRFLMGFNRDVVRRRRDTLKKLGVRIRWVGSRPRLWRSVINELAVAEEMTKSNDVITINYCVNYGGRTEITEATREIAREVAAGRLNPERITESTIARHLQRPDIPDVDLFLRTSGEQRSSNFMLWQAAYAEYIFQDKLWPDYDRRDLWAACEEYASRTRRFGSA,./data/raw/alphafold//AF-P9WFF7-F1-model_v4.pdb,1097,670,352,396
+291,1091,1118,MKSTSFLQKGSSTSLAALPGFGVPQSCRFARTRRVSLSRGTARRPMQPRADAIVREEVNLQTSPDKITVDEIELWPAKGGPETPYLDKVKVPAHLKSFRKDELKTVCRELRAEIINAVSATGGHLGSSLGVVELTVAIHYVFDCPEDKLVWDVGHQAYGHKILTGRRDKMHTIRQRDGLSGFTNRSESEYDAFGAGHSSTSISAALGMAVGRDLLGKDNHCIAVIGDGAITGGMAYEALNHAGFLGSEKIQGKGNNIGRTIVILNDNQQVSLPTQFNGEKQKPVGALADALSQVASKQLSNSAKEIVKQLPEPLQAVGGQLEKVVSTIGGNNTFFDELGVAHVGPIDGHNVEDLVNVLEWIKSQKDGGPVIVHILTEKGYGYEFAEKASDRMHGVAKYDVTSGKQVKSSSKVASYTTYFADSLIAEAERDGRVIGIHAAMGGGTGMNRFAKRFPKRTFDVGIAEQHAVTFAAGLACEGLIPMCAIYSSFLQRAYDQVIHDVALQNLPVRFAMDRAGLVGADGATHSGFADVTYMACVPNMIVMAPSNEAELCNAVATSIAIDFAPSCFRFPRGNGIGVDLAEYGVQPNFKGTPWEIGKGKIRRNGSNNKPEGDVALLGYGTVVNDCLAAAEMLEAQGIKTTVADMRFCKPLDEELIVQLAKNHPVVITVEENTVGGFASHVLHFMTEQGFLDGKMKLRTLLLPDRFIEHGTQQQQLEEALLTANDIVETAVNALGIAPVPQIIIPPQQVVTPPQAVSPPQVATPTPAPLN,brenda,H5ZXI0,CC(=O)C(=O)O.COc1ccc2ccc(O)c(N=O)c2c1>>COc1ccc2ccc(O)c(N(O)C(C)=O)c2c1.O=C=O,2.4,0.0,32.0,7.8,2.2.1.7,38881.0,0.380211241711606,CC(=O)C(=O)O.COc1ccc2ccc(O)c(N=O)c2c1,COc1ccc2ccc(O)c(N(O)C(C)=O)c2c1.O=C=O,0.380211241711606,CC(=O)C(=O)O.COc1ccc2ccc(O)c(N=O)c2c1__MKSTSFLQKGSSTSLAALPGFGVPQSCRFARTRRVSLSRGTARRPMQPRADAIVREEVNLQTSPDKITVDEIELWPAKGGPETPYLDKVKVPAHLKSFRKDELKTVCRELRAEIINAVSATGGHLGSSLGVVELTVAIHYVFDCPEDKLVWDVGHQAYGHKILTGRRDKMHTIRQRDGLSGFTNRSESEYDAFGAGHSSTSISAALGMAVGRDLLGKDNHCIAVIGDGAITGGMAYEALNHAGFLGSEKIQGKGNNIGRTIVILNDNQQVSLPTQFNGEKQKPVGALADALSQVASKQLSNSAKEIVKQLPEPLQAVGGQLEKVVSTIGGNNTFFDELGVAHVGPIDGHNVEDLVNVLEWIKSQKDGGPVIVHILTEKGYGYEFAEKASDRMHGVAKYDVTSGKQVKSSSKVASYTTYFADSLIAEAERDGRVIGIHAAMGGGTGMNRFAKRFPKRTFDVGIAEQHAVTFAAGLACEGLIPMCAIYSSFLQRAYDQVIHDVALQNLPVRFAMDRAGLVGADGATHSGFADVTYMACVPNMIVMAPSNEAELCNAVATSIAIDFAPSCFRFPRGNGIGVDLAEYGVQPNFKGTPWEIGKGKIRRNGSNNKPEGDVALLGYGTVVNDCLAAAEMLEAQGIKTTVADMRFCKPLDEELIVQLAKNHPVVITVEENTVGGFASHVLHFMTEQGFLDGKMKLRTLLLPDRFIEHGTQQQQLEEALLTANDIVETAVNALGIAPVPQIIIPPQQVVTPPQAVSPPQVATPTPAPLN,./data/raw/alphafold//AF-H5ZXI0-F1-model_v4.pdb,1270,5217,1604,731
+292,5886,5979,MSKLISDAIAAEDASKWNTSYELYPPRSEKAEEDMMKVLVPNFMHQSPVFLDLTWGAGGRTSGTTMRLCKDLQHAHPDTPINMHITCTNTPKGLIKETLEFAKTHGIRNILALRGDPPSGEEFQVDPDGFACARDLVRYIRDTYGDYFCVSVAGYPEGHPSRIAENGTISHEDHQKELEYLKEKVDAGASFIITQLFYDASLYVKFVKRCREVGITVPILAGLLPITTYAGFVRMVSLCKTSVPSDVKKRVEELKENPDGLKEYGVEQCVQMIECIRASGLDYHHLHFYTLNNSAQIFKILKRLNALVE,sabio,Q4Q0B9,CC1=CC(=O)c2ccccc2C1=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]>>Cc1cc(O)c2ccccc2c1O.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,140.0,6.184575054814408e-15,37.0,7.2,1.6.5.2,5664.0,2.146128035678238,CC1=CC(=O)c2ccccc2C1=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],Cc1cc(O)c2ccccc2c1O.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,2.146128035678238,CC1=CC(=O)c2ccccc2C1=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]__MSKLISDAIAAEDASKWNTSYELYPPRSEKAEEDMMKVLVPNFMHQSPVFLDLTWGAGGRTSGTTMRLCKDLQHAHPDTPINMHITCTNTPKGLIKETLEFAKTHGIRNILALRGDPPSGEEFQVDPDGFACARDLVRYIRDTYGDYFCVSVAGYPEGHPSRIAENGTISHEDHQKELEYLKEKVDAGASFIITQLFYDASLYVKFVKRCREVGITVPILAGLLPITTYAGFVRMVSLCKTSVPSDVKKRVEELKENPDGLKEYGVEQCVQMIECIRASGLDYHHLHFYTLNNSAQIFKILKRLNALVE,./data/raw/alphafold//AF-Q4Q0B9-F1-model_v4.pdb,3172,1967,3611,2447
+293,14062,14244,MSEVIEIKSPSNLKVIGTVKRMSKDEVRGEIEEAYKGFETISRMPLYKRTAILRKVSEILEREQERLARLLAMEAGKPIKDSRVEVMRASRLFRQAAEEAAIVLEGKNYRVDAYEYPPGNENRIVISTREPIGVVTAILPFNFPINSFAHKVAPAIAVGNSVVVKPSISTPLSAIEMKKILVEAGLPDSAVRIVTGYSNEIGDELITHPLVGLITLTGSTQTGLAIASKAVSLGKRIIMELGGSDPIIVLEDANIDRASSIAVRARYEYAGQNCNAGKRIIVREEIYDKFVKAFKEKVKALKVGDPLDESTDIGPVINQESVEKLNKALEDAQSKGGNVEVLNKGPETGYFFPLSLVTNPSLDMLVLKTEIFGPIAPIVSVKSDEEAINIANSTEYGLQSAIFSNDVNRALKIAKELKFGAIIINDSTRLRWDSLPFGGFKKTGIGREGVRDTMLEMTENKLIAITLL,brenda,Q976X5,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+],30.0,7.240812448354101e-15,40.0,8.0,1.2.1.16,111955.0,1.4771212547196624,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+],1.4771212547196624,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__MSEVIEIKSPSNLKVIGTVKRMSKDEVRGEIEEAYKGFETISRMPLYKRTAILRKVSEILEREQERLARLLAMEAGKPIKDSRVEVMRASRLFRQAAEEAAIVLEGKNYRVDAYEYPPGNENRIVISTREPIGVVTAILPFNFPINSFAHKVAPAIAVGNSVVVKPSISTPLSAIEMKKILVEAGLPDSAVRIVTGYSNEIGDELITHPLVGLITLTGSTQTGLAIASKAVSLGKRIIMELGGSDPIIVLEDANIDRASSIAVRARYEYAGQNCNAGKRIIVREEIYDKFVKAFKEKVKALKVGDPLDESTDIGPVINQESVEKLNKALEDAQSKGGNVEVLNKGPETGYFFPLSLVTNPSLDMLVLKTEIFGPIAPIVSVKSDEEAINIANSTEYGLQSAIFSNDVNRALKIAKELKFGAIIINDSTRLRWDSLPFGGFKKTGIGREGVRDTMLEMTENKLIAITLL,./data/raw/alphafold//AF-Q976X5-F1-model_v4.pdb,3094,2010,3657,2505
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+324,3468,3517,MPALPIDQEFDCERFRADIRATAAAIGAPIAHRLTDTVLEAFRDNFAQGATLWKTTSQPGDQLSYRFFSRLKMDTVSRAIDAGLLDAAHPTLAVVDAWSSLYGGAPVQSGDFDAGRGMAKTWLYFGGLRPAEDILTVPALPASVQARLKDFLALGLAHVRFAAVDWRHHSANVYFRGKGPLDTVQFARIHALSGSTPPAAHVVEEVLAYMPEDYCVAITLDLHSGDIERVCFYALKVPKNALPRIPTRIARFLEVAPSHDVEECNVIGWSFGRSGDYVKAERSYTGNMAEILAGWNCFFHGEEGRDHDLRALHQHTESTMGGAR,brenda,Q8GHB2,CC(C)=CCOP(=O)(O)OP(=O)(O)O.O=C(O)C(=O)Cc1ccc(O)cc1>>CC(C)=CCc1cc(CC(=O)C(=O)O)ccc1O.O=P(O)(O)OP(=O)(O)O,0.253,0.0,30.0,7.5,2.5.1.111,149682.0,-0.5968794788241821,CC(C)=CCOP(=O)(O)OP(=O)(O)O.O=C(O)C(=O)Cc1ccc(O)cc1,CC(C)=CCc1cc(CC(=O)C(=O)O)ccc1O.O=P(O)(O)OP(=O)(O)O,-0.5968794788241821,CC(C)=CCOP(=O)(O)OP(=O)(O)O.O=C(O)C(=O)Cc1ccc(O)cc1__MPALPIDQEFDCERFRADIRATAAAIGAPIAHRLTDTVLEAFRDNFAQGATLWKTTSQPGDQLSYRFFSRLKMDTVSRAIDAGLLDAAHPTLAVVDAWSSLYGGAPVQSGDFDAGRGMAKTWLYFGGLRPAEDILTVPALPASVQARLKDFLALGLAHVRFAAVDWRHHSANVYFRGKGPLDTVQFARIHALSGSTPPAAHVVEEVLAYMPEDYCVAITLDLHSGDIERVCFYALKVPKNALPRIPTRIARFLEVAPSHDVEECNVIGWSFGRSGDYVKAERSYTGNMAEILAGWNCFFHGEEGRDHDLRALHQHTESTMGGAR,./data/raw/alphafold//AF-Q8GHB2-F1-model_v4.pdb,1777,1447,2499,1757
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+339,21665,21990,MSFARVRTALRCQRAAASPAPPKVQARRFANKAAPHASASSAGSRAFHLGLAAGAALAVGGAGLYLFSRSPVLLDAQLPVKQRGRARSISAAEVAKHNSRDSMWVCIDDEVWDITNFVELHPGGAKVLEQNAGKDVTKVFKSIHPPKTLEKFLTDDNFVGRIDVDEVTKIGGGKNAEDLRIEQARKELRNVETVVCLDEFEEISQKILSEMAMAYYGTGAETEQTLRDEREAWQRVRFRPRVLRKMRHIDTNTTFLGIPTPLPIFVAPAGLARLGHPDGEQNIVRGVAKHDILQVVSSGASCSIDEIFEVKEPDQNLAWQFYVHSDKKIAEEKLKRALALGAKAIFVTVDVPVLGKRERDLKLKARSQNYEHPIAAQWKAAGSKVEETIAKRGVSDIPDTAHIDANLNWDDIAWIKERAPGVPIVIKGVGCVEDVELAKQYGADGVVLSTHGARQLDGARAPLDVLIEVRRKNPALLKEIEVYVDGQARRGTDVLKALCLGARGVGFGRGFLYAQSAYGADGVDKAIRILENEIQNAMRLLGANTLADLKPEMVECSFPERWVPE,uniprot_search,P32953,O=C([O-])C(O)c1ccccc1.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[Fe-3]>>O.O=C(O)C(=O)c1ccccc1.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[Fe-4],94.0,2.285288130127185,25.0,7.5,1.1.99.31,29898.0,1.9731278535996988,O=C([O-])C(O)c1ccccc1.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[Fe-3],O.O=C(O)C(=O)c1ccccc1.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[Fe-4],1.9731278535996988,O=C([O-])C(O)c1ccccc1.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[Fe-3]__MSFARVRTALRCQRAAASPAPPKVQARRFANKAAPHASASSAGSRAFHLGLAAGAALAVGGAGLYLFSRSPVLLDAQLPVKQRGRARSISAAEVAKHNSRDSMWVCIDDEVWDITNFVELHPGGAKVLEQNAGKDVTKVFKSIHPPKTLEKFLTDDNFVGRIDVDEVTKIGGGKNAEDLRIEQARKELRNVETVVCLDEFEEISQKILSEMAMAYYGTGAETEQTLRDEREAWQRVRFRPRVLRKMRHIDTNTTFLGIPTPLPIFVAPAGLARLGHPDGEQNIVRGVAKHDILQVVSSGASCSIDEIFEVKEPDQNLAWQFYVHSDKKIAEEKLKRALALGAKAIFVTVDVPVLGKRERDLKLKARSQNYEHPIAAQWKAAGSKVEETIAKRGVSDIPDTAHIDANLNWDDIAWIKERAPGVPIVIKGVGCVEDVELAKQYGADGVVLSTHGARQLDGARAPLDVLIEVRRKNPALLKEIEVYVDGQARRGTDVLKALCLGARGVGFGRGFLYAQSAYGADGVDKAIRILENEIQNAMRLLGANTLADLKPEMVECSFPERWVPE,./data/raw/alphafold//AF-P32953-F1-model_v4.pdb,3557,3515,1287,3236
+340,17424,17661,MENFKHLPEPFRIRVIEPVKRTTRAYREEAIIKSGMNPFLLDSEDVFIDLLTDSGTGAVTQSMQAAMMRGDEAYSGSRSYYALAESVKNIFGYQYTIPTHQGRGAEQIYIPVLIKKREQEKGLDRSKMVAFSNYFFDTTQGHSQINGCTVRNVYIKEAFDTGVRYDFKGNFDLEGLERGIEEVGPNNVPYIVATITSNSAGGQPVSLANLKAMYSIAKKYDIPVVMDSARFAENAYFIKQREAEYKDWTIEQITRETYKYADMLAMSAKKDAMVPMGGLLCMKDDSFFDVYTECRTLCVVQEGFPTYGGLEGGAMERLAVGLYDGMNLDWLAYRIAQVQYLVDGLEEIGVVCQQAGGHAAFVDAGKLLPHIPADQFPAQALACELYKVAGIRAVEIGSFLLGRDPKTGKQLPCPAELLRLTIPRATYTQTHMDFIIEAFKHVKENAANIKGLTFTYEPKVLRHFTAKLKEV,brenda,P0A853,N[C@@H](CSc1ccccc1[N+](=O)[O-])C(=O)O.O>>CC(=O)C(=O)O.N.O=[N+]([O-])c1ccccc1S,38.0,0.0,22.0,7.8,4.1.99.1,562.0,1.57978359661681,N[C@@H](CSc1ccccc1[N+](=O)[O-])C(=O)O.O,CC(=O)C(=O)O.N.O=[N+]([O-])c1ccccc1S,1.57978359661681,N[C@@H](CSc1ccccc1[N+](=O)[O-])C(=O)O.O__MENFKHLPEPFRIRVIEPVKRTTRAYREEAIIKSGMNPFLLDSEDVFIDLLTDSGTGAVTQSMQAAMMRGDEAYSGSRSYYALAESVKNIFGYQYTIPTHQGRGAEQIYIPVLIKKREQEKGLDRSKMVAFSNYFFDTTQGHSQINGCTVRNVYIKEAFDTGVRYDFKGNFDLEGLERGIEEVGPNNVPYIVATITSNSAGGQPVSLANLKAMYSIAKKYDIPVVMDSARFAENAYFIKQREAEYKDWTIEQITRETYKYADMLAMSAKKDAMVPMGGLLCMKDDSFFDVYTECRTLCVVQEGFPTYGGLEGGAMERLAVGLYDGMNLDWLAYRIAQVQYLVDGLEEIGVVCQQAGGHAAFVDAGKLLPHIPADQFPAQALACELYKVAGIRAVEIGSFLLGRDPKTGKQLPCPAELLRLTIPRATYTQTHMDFIIEAFKHVKENAANIKGLTFTYEPKVLRHFTAKLKEV,./data/raw/alphafold//AF-P0A853-F1-model_v4.pdb,1307,2244,3936,2812
+341,5174,5260,MNTLIGKTGIVVRNIQRAELDSIDALGRLGVATVHEAQNRKGLLSSKMRPIQQGTSLAGSAVTVLVAPGDNWMFHVAVEQCRPGDVLVVSPSSPCTDGYFGDLLATSLQARGVRALIVDAGVRDTQTLRDMGFAVWARAINAQGTVKETLGSVNLPVICGGQLINPGDIVVADDDGVVVVRRDECESTLVAAAERAGLEEEKRLRLAAGELGLDIYKMRERLEAKGLRYVDNIEDLEG,sabio,A5W059,CC(O)CC(=O)C(=O)O>>CC(=O)C(=O)O.CC=O,0.048,1.0715872801117526e-14,25.0,8.0,4.1.3.17,303.0,-1.3187587626244128,CC(O)CC(=O)C(=O)O,CC(=O)C(=O)O.CC=O,-0.721246399047171,CC(O)CC(=O)C(=O)O__MNTLIGKTGIVVRNIQRAELDSIDALGRLGVATVHEAQNRKGLLSSKMRPIQQGTSLAGSAVTVLVAPGDNWMFHVAVEQCRPGDVLVVSPSSPCTDGYFGDLLATSLQARGVRALIVDAGVRDTQTLRDMGFAVWARAINAQGTVKETLGSVNLPVICGGQLINPGDIVVADDDGVVVVRRDECESTLVAAAERAGLEEEKRLRLAAGELGLDIYKMRERLEAKGLRYVDNIEDLEG,./data/raw/alphafold//AF-A5W059-F1-model_v4.pdb,1309,3866,6182,834
+342,16640,16869,MKTPWKVLLGLLGAAALVTIITVPVVLLNKGTDDATADSRKTYTLTDYLKNTYRLKLYSLRWISDHEYLYKQENNILVFNAEYGNSSVFLENSTFDEFGHSINDYSISPDGQFILLEYNYVKQWRHSYTASYDIYDLNKRQLITEERIPNNTQWVTWSPVGHKLAYVWNNDIYVKIEPNLPSYRITWTGKEDIIYNGITDWVYEEEVFSAYSALWWSPNGTFLAYAQFNDTEVPLIEYSFYSDESLQYPKTVRVPYPKAGAVNPTVKFFVVNTDSLSSVTNATSIQITAPASMLIGDHYLCDVTWATQERISLQWLRRIQNYSVMDICDYDESSGRWNCLVARQHIEMSTTGWVGRFRPSEPHFTLDGNSFYKIISNEEGYRHICYFQIDKKDCTFITKGTWEVIGIEALTSDYLYYISNEYKGMPGGRNLYKIQLSDYTKVTCLSCELNPERCQYYSVSFSKEAKYYQLRCSGPGLPLYTLHSSVNDKGLRVLEDNSALDKMLQNVQMPSKKLDFIILNETKFWYQMILPPHFDKSKKYPLLLDVYAGPCSQKADTVFRLNWATYLASTENIIVASFDGRGSGYQGDKIMHAINRRLGTFEVEDQIEAARQFSKMGFVDNKRIAIWGWSYGGYVTSMVLGSGSGVFKCGIAVAPVSRWEYYDSVYTERYMGLPTPEDNLDHYRNSTVMSRAENFKQVEYLLIHGTADDNVHFQQSAQISKALVDVGVDFQAMWYTDEDHGIASSTAHQHIYTHMSHFIKQCFSLP,brenda,P27487,NCC(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>NCC(=O)N1CCC[C@H]1C(=O)O.Nc1ccc([N+](=O)[O-])cc1,87.0,0.0,26.0,7.6,3.4.14.5,9606.0,1.9395192526186185,NCC(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1.O,NCC(=O)N1CCC[C@H]1C(=O)O.Nc1ccc([N+](=O)[O-])cc1,5.445604203273597,NCC(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MKTPWKVLLGLLGAAALVTIITVPVVLLNKGTDDATADSRKTYTLTDYLKNTYRLKLYSLRWISDHEYLYKQENNILVFNAEYGNSSVFLENSTFDEFGHSINDYSISPDGQFILLEYNYVKQWRHSYTASYDIYDLNKRQLITEERIPNNTQWVTWSPVGHKLAYVWNNDIYVKIEPNLPSYRITWTGKEDIIYNGITDWVYEEEVFSAYSALWWSPNGTFLAYAQFNDTEVPLIEYSFYSDESLQYPKTVRVPYPKAGAVNPTVKFFVVNTDSLSSVTNATSIQITAPASMLIGDHYLCDVTWATQERISLQWLRRIQNYSVMDICDYDESSGRWNCLVARQHIEMSTTGWVGRFRPSEPHFTLDGNSFYKIISNEEGYRHICYFQIDKKDCTFITKGTWEVIGIEALTSDYLYYISNEYKGMPGGRNLYKIQLSDYTKVTCLSCELNPERCQYYSVSFSKEAKYYQLRCSGPGLPLYTLHSSVNDKGLRVLEDNSALDKMLQNVQMPSKKLDFIILNETKFWYQMILPPHFDKSKKYPLLLDVYAGPCSQKADTVFRLNWATYLASTENIIVASFDGRGSGYQGDKIMHAINRRLGTFEVEDQIEAARQFSKMGFVDNKRIAIWGWSYGGYVTSMVLGSGSGVFKCGIAVAPVSRWEYYDSVYTERYMGLPTPEDNLDHYRNSTVMSRAENFKQVEYLLIHGTADDNVHFQQSAQISKALVDVGVDFQAMWYTDEDHGIASSTAHQHIYTHMSHFIKQCFSLP,./data/raw/alphafold//AF-P27487-F1-model_v4.pdb,3718,3729,1531,3501
+343,12455,12625,MSEKTVLSIQSFVTHGYVGNKAATFPLQLHGFDVDGINTVCLSNHSGYPVIRGHRMSLQEYDELMEGVRANNFLSNYRYILTGYINNVDIIGRIRDTLKEVRELREKEDKKLTFICDPVMGDDGIMYCKKEVLDAYRELVPLADIVTPNYFEASLLSGVTVNDLSSAILAADWFHNCGVAHVIIKSFREQENPTHLRFLYSVKEGSEAAVRRFSGVVPYHEGRYTGTGDVFAACLLAFSHSHPMDVAIGKSMAVLQELIIATRKEGGDGKSSLKSRELRVVASPQVVLQPSTVVDVKPIS,uniprot_search,O15927,Cc1ncc(CO)c(CO)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(CO)c1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,122.0,0.0,37.0,7.4,2.7.1.35,5691.0,2.0863598306747484,Cc1ncc(CO)c(CO)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(CO)c1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,2.0863598306747484,Cc1ncc(CO)c(CO)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
+344,2255,2288,MWELVALLLLTLAYLFWPKRRCPGAKYPKSLLSLPLVGSLPFLPRHGHMHNNFFKLQKKYGPIYSVRMGTKTTVIVGHHQLAKEVLIKKGKDFSGRPQMATLDIASNNRKGIAFADSGAHWQLHRRLAMATFALFKDGDQKLEKIICQEISTLCDMLATHNGQSIDISFPVFVAVTNVISLICFNTSYKNGDPELNVIQNYNEGIIDNLSKDSLVDLVPWLKIFPNKTLEKLKSHVKIRNDLLNKILENYKEKFRSDSITNMLDTLMQAKMNSDNGNAGPDQDSELLSDNHILTTIGDIFGAGVETTTSVVKWTLAFLLHNPQVKKKLYEEIDQNVGFSRTPTISDRNRLLLLEATIREVLRLRPVAPMLIPHKANVDSSIGEFAVDKGTEVIINLWALHHNEKEWHQPDQFMPERFLNPAGTQLISPSVSYLPFGAGPRSCIGEILARQELFLIMAWLLQRFDLEVPDDGQLPSLEGIPKVVFLIDSFKVKIKVRQAWREAQAEGST,brenda,P05093,CC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.O=O>>CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C.O,0.0037,10000000.0,37.0,7.4,1.14.14.32,9606.0,-2.431798275933005,CC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.O=O,CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C.O,-0.958607314841775,CC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.O=O__MWELVALLLLTLAYLFWPKRRCPGAKYPKSLLSLPLVGSLPFLPRHGHMHNNFFKLQKKYGPIYSVRMGTKTTVIVGHHQLAKEVLIKKGKDFSGRPQMATLDIASNNRKGIAFADSGAHWQLHRRLAMATFALFKDGDQKLEKIICQEISTLCDMLATHNGQSIDISFPVFVAVTNVISLICFNTSYKNGDPELNVIQNYNEGIIDNLSKDSLVDLVPWLKIFPNKTLEKLKSHVKIRNDLLNKILENYKEKFRSDSITNMLDTLMQAKMNSDNGNAGPDQDSELLSDNHILTTIGDIFGAGVETTTSVVKWTLAFLLHNPQVKKKLYEEIDQNVGFSRTPTISDRNRLLLLEATIREVLRLRPVAPMLIPHKANVDSSIGEFAVDKGTEVIINLWALHHNEKEWHQPDQFMPERFLNPAGTQLISPSVSYLPFGAGPRSCIGEILARQELFLIMAWLLQRFDLEVPDDGQLPSLEGIPKVVFLIDSFKVKIKVRQAWREAQAEGST,./data/raw/alphafold//AF-P05093-F1-model_v4.pdb,1225,3036,571,653
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+347,13899,14080,MNHNSNLVLPSHQTETQTQDETDISVWRFRGSDNAAKASSVTMRVIVYKLFDECSLDVKKPLLPLAHGDPSVYPCYRTSILVENAVVDVLRSGKGNSYGPAAGILPARQAVADYVNRDLTNKVKPNDVFITVGCNQGIEVVLQSLARPNANILLPRPSYPHYEARAVYSGLEVRKFDLLPEKEWEIDLPGIEAMADENTVAMVIINPNNPCGNVYSYDHLKKVAETAKKLGIMVITDEVYCQTIFGDKPFVPMGEFSSITPVITLGGISKGWIVPGWRIGWIALNDPRGILKSTGMVQSIQQNLDITPDATTIVQAALPEILGKANKELFAKKNSMLKQNVELVCDRLKEIPCLVCNKKPESCTYLLTKLKLPLLEDIEDDMDFCMKLAKEENLVLLPGVALGLKNWIRITIGVEAQMLEDALERLNGFCKRHLKKTESSFQALSNGKI,brenda,Q67Y55,N=C(O)C[C@H](N)C(=O)O.O=C(O)CCC(=O)C(=O)O>>N=C(O)CC(=O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O,48.0,0.0,30.0,8.5,2.6.1.5,3702.0,1.6812412373755872,N=C(O)C[C@H](N)C(=O)O.O=C(O)CCC(=O)C(=O)O,N=C(O)CC(=O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O,1.6812412373755872,N=C(O)C[C@H](N)C(=O)O.O=C(O)CCC(=O)C(=O)O__MNHNSNLVLPSHQTETQTQDETDISVWRFRGSDNAAKASSVTMRVIVYKLFDECSLDVKKPLLPLAHGDPSVYPCYRTSILVENAVVDVLRSGKGNSYGPAAGILPARQAVADYVNRDLTNKVKPNDVFITVGCNQGIEVVLQSLARPNANILLPRPSYPHYEARAVYSGLEVRKFDLLPEKEWEIDLPGIEAMADENTVAMVIINPNNPCGNVYSYDHLKKVAETAKKLGIMVITDEVYCQTIFGDKPFVPMGEFSSITPVITLGGISKGWIVPGWRIGWIALNDPRGILKSTGMVQSIQQNLDITPDATTIVQAALPEILGKANKELFAKKNSMLKQNVELVCDRLKEIPCLVCNKKPESCTYLLTKLKLPLLEDIEDDMDFCMKLAKEENLVLLPGVALGLKNWIRITIGVEAQMLEDALERLNGFCKRHLKKTESSFQALSNGKI,./data/raw/alphafold//AF-Q67Y55-F1-model_v4.pdb,3590,3554,1337,3294
+348,470,487,MENSEKTEVVLLACGSFNPITNMHLRLFELAKDYMNGTGRYTVVKGIISPVGDAYKKKGLIPAYHRVIMAELATKNSKWVEVDTWESLQKEWKETLKVLRHHQEKLEASDCDHQQNSPTLERPGRKRKWTETQDSSQKKSLEPKTKAVPKVKLLCGADLLESFAVPNLWKSEDITQIVANYGLICVTRAGNDAQKFIYESDVLWKHRSNIHVVNEWIANDISSTKIRRALRRGQSIRYLVPDLVQEYIEKHNLYSSESEDRNAGVILAPLQRNTAEAKT,sabio,Q9HAN9,C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=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=P(O)(O)OP(=O)(O)O.[H],18.6,0.0596857262296557,30.0,7.5,2.7.7.18,9606.0,1.2695129442179165,C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=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=P(O)(O)OP(=O)(O)O.[H],1.2695129442179165,C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MENSEKTEVVLLACGSFNPITNMHLRLFELAKDYMNGTGRYTVVKGIISPVGDAYKKKGLIPAYHRVIMAELATKNSKWVEVDTWESLQKEWKETLKVLRHHQEKLEASDCDHQQNSPTLERPGRKRKWTETQDSSQKKSLEPKTKAVPKVKLLCGADLLESFAVPNLWKSEDITQIVANYGLICVTRAGNDAQKFIYESDVLWKHRSNIHVVNEWIANDISSTKIRRALRRGQSIRYLVPDLVQEYIEKHNLYSSESEDRNAGVILAPLQRNTAEAKT,./data/raw/alphafold//AF-Q9HAN9-F1-model_v4.pdb,2318,644,321,358
+349,14365,14565,MGSVPFTTSDLQTSTSGFRSSPTLLCTPLMGTTVDQMLIEMRKAKEIGADLVEIRLDCLRNFNPHQDLQILIKQSPLPTLVTYRPVWEGGQYEGDESKRQDALRLAMQLGAHYIDVELEVAHDFNSSILGKKPDNFKIIVSSHNFHNTPSAEAIGNLVARIQATGADIAKIATTALDITDCARIFQITVHSQIPIIGIVMGERGLISRILSPKFGGYLTYGALEAGAISAPGQPTAKDLLDLYNFRLIRPDTKVYGIIGKPVGHSKSPLLFNASYKSVGLNAVYLHFLVDDVEKFFNTYSAVDFASGCSCTIPHKEAALKCMDEIDPIAKKIGAINNIVRRPDGTLTAFNTDYIGAISAIEDGLRGLNGVSSGASPLAGKLFVVLGAGGAGKSLAYGAAQKGARVVVANRTFERAKELADKVGGQAMTLAEVENFHPEEGMVLANTTSVGMKPKIDETPLAKHALKHYCLVFDAIYTPKDTRLLREARETGAVIVYGTEMLIRQGFEQYKNFTGLPAPEELFRTLMEKHA,brenda,A0A5H2WVH6,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)C1=C[C@@H](O)[C@@H](O)[C@H](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=C(O)C1=CC(=O)[C@@H](O)[C@H](O)C1.[H+],80.7,0.0,30.0,9.0,1.1.1.25,34316.0,1.9068735347220704,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)C1=C[C@@H](O)[C@@H](O)[C@H](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=C(O)C1=CC(=O)[C@@H](O)[C@H](O)C1.[H+],1.9068735347220704,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)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1__MGSVPFTTSDLQTSTSGFRSSPTLLCTPLMGTTVDQMLIEMRKAKEIGADLVEIRLDCLRNFNPHQDLQILIKQSPLPTLVTYRPVWEGGQYEGDESKRQDALRLAMQLGAHYIDVELEVAHDFNSSILGKKPDNFKIIVSSHNFHNTPSAEAIGNLVARIQATGADIAKIATTALDITDCARIFQITVHSQIPIIGIVMGERGLISRILSPKFGGYLTYGALEAGAISAPGQPTAKDLLDLYNFRLIRPDTKVYGIIGKPVGHSKSPLLFNASYKSVGLNAVYLHFLVDDVEKFFNTYSAVDFASGCSCTIPHKEAALKCMDEIDPIAKKIGAINNIVRRPDGTLTAFNTDYIGAISAIEDGLRGLNGVSSGASPLAGKLFVVLGAGGAGKSLAYGAAQKGARVVVANRTFERAKELADKVGGQAMTLAEVENFHPEEGMVLANTTSVGMKPKIDETPLAKHALKHYCLVFDAIYTPKDTRLLREARETGAVIVYGTEMLIRQGFEQYKNFTGLPAPEELFRTLMEKHA,./data/raw/alphafold//AF-A0A5H2WVH6-F1-model_v4.pdb,2390,4757,4488,4386
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+358,14161,14345,MSLPVVLIADKLAPSTVAALGDQVEVRWVDGPDRDKLLAAVPEADALLVRSATTVDAEVLAAAPKLKIVARAGVGLDNVDVDAATARGVLVVNAPTSNIHSAAEHALALLLAASRQIPAADASLREHTWKRSSFSGTEIFGKTVGVVGLGRIGQLVAQRIAAFGAYVVAYDPYVSPARAAQLGIELLSLDDLLARADFISVHLPKTPETAGLIDKEALAKTKPGVIIVNAARGGLVDEAALADAITGGHVRAAGLDVFATEPCTDSPLFELAQVVVTPHLGASTAEAQDRAGTDVAESVRLALAGEFVPDAVNVGGGVVNEEVAPWLDLVRKLGVLAGVLSDELPVSLSVQVRGELAAEEVEVLRLSALRGLFSAVIEDAVTFVNAPALAAERGVTAEICKASESPNHRSVVDVRAVGADGSVVTVSGTLYGPQLSQKIVQINGRHFDLRAQGINLIIHYVDRPGALGKIGTLLGTAGVNIQAAQLSEDAEGPGATILLRLDQDVPDDVRTAIAAAVDAYKLEVVDLS,brenda,P9WNX3,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)[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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=C(O)C(=O)COP(=O)(O)O.[H+],1.4,0.0,25.0,6.6,1.1.1.95,1773.0,0.1461280356782379,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)[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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=C(O)C(=O)COP(=O)(O)O.[H+],0.1461280356782379,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)[C@H](O)COP(=O)(O)O__MSLPVVLIADKLAPSTVAALGDQVEVRWVDGPDRDKLLAAVPEADALLVRSATTVDAEVLAAAPKLKIVARAGVGLDNVDVDAATARGVLVVNAPTSNIHSAAEHALALLLAASRQIPAADASLREHTWKRSSFSGTEIFGKTVGVVGLGRIGQLVAQRIAAFGAYVVAYDPYVSPARAAQLGIELLSLDDLLARADFISVHLPKTPETAGLIDKEALAKTKPGVIIVNAARGGLVDEAALADAITGGHVRAAGLDVFATEPCTDSPLFELAQVVVTPHLGASTAEAQDRAGTDVAESVRLALAGEFVPDAVNVGGGVVNEEVAPWLDLVRKLGVLAGVLSDELPVSLSVQVRGELAAEEVEVLRLSALRGLFSAVIEDAVTFVNAPALAAERGVTAEICKASESPNHRSVVDVRAVGADGSVVTVSGTLYGPQLSQKIVQINGRHFDLRAQGINLIIHYVDRPGALGKIGTLLGTAGVNIQAAQLSEDAEGPGATILLRLDQDVPDDVRTAIAAAVDAYKLEVVDLS,./data/raw/alphafold//AF-P9WNX3-F1-model_v4.pdb,2234,4479,4385,4274
+359,15437,15661,MDLGLAGRRALVTGAGKGIGRSTVLALQAAGAHVVAVSRTQADLDSLVSECPGVETVCVDLADWEATEQALSSVGPVDLLVNNAAVALLQPFLEVTKEAFDMSFNVNLRAVIQVSQIVARGMIARGAPGAIVNVSSQASQRALANHSVYCSTKGALDMLTKMMALELGPHKIRVNAVNPTVVMTSMGRTNWSDPHKAKVMLDRIPLGKFAEVENVVDAILFLLSHRSNMTTGSTLPVDGGFLVT,sabio,Q91XV4,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,22.0,0.0,25.0,7.0,1.1.1.10,10036.0,1.3424226808222062,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,1.3424226808222062,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]__MDLGLAGRRALVTGAGKGIGRSTVLALQAAGAHVVAVSRTQADLDSLVSECPGVETVCVDLADWEATEQALSSVGPVDLLVNNAAVALLQPFLEVTKEAFDMSFNVNLRAVIQVSQIVARGMIARGAPGAIVNVSSQASQRALANHSVYCSTKGALDMLTKMMALELGPHKIRVNAVNPTVVMTSMGRTNWSDPHKAKVMLDRIPLGKFAEVENVVDAILFLLSHRSNMTTGSTLPVDGGFLVT,./data/raw/alphafold//AF-Q91XV4-F1-model_v4.pdb,1316,3874,6191,847
+360,3709,3759,MKETSPIPQPKTFGPLGNLPLIDKDKPTLSLIKLAEEQGPIFQIHTPAGTTIVVSGHELVKEVCDEERFDKSIEGALEKVRAFSGDGLFTSWTHEPNWRKAHNILMPTFSQRAMKDYHEKMVDIAVQLIQKWARLNPNEAVDVPGDMTRLTLDTIGLCGFNYRFNSYYRETPHPFINSMVRALDEAMHQMQRLDVQDKLMVRTKRQFRYDIQTMFSLVDSIIAERRANGDQDEKDLLARMLNVEDPETGEKLDDENIRFQIITFLIAGHETTSGLLSFATYFLLKHPDKLKKAYEEVDRVLTDAAPTYKQVLELTYIRMILNESLRLWPTAPAFSLYPKEDTVIGGKFPITTNDRISVLIPQLHRDRDAWGKDAEEFRPERFEHQDQVPHHAYKPFGNGQRACIGMQFALHEATLVLGMILKYFTLIDHENYELDIKQTLTLKPGDFHISVQSRHQEAIHADVQAAEKAAPDEQKEKTEAKGASVIGLNNRPLLVLYGSDTGTAEGVARELADTASLHGVRTKTAPLNDRIGKLPKEGAVVIVTSSYNGKPPSNAGQFVQWLQEIKPGELEGVHYAVFGCGDHNWASTYQYVPRFIDEQLAEKGATRFSARGEGDVSGDFEGQLDEWKKSMWADAIKAFGLELNENADKERSTLSLQFVRGLGESPLARSYEASHASIAENRELQSADSDRSTRHIEIALPPDVEYQEGDHLGVLPKNSQTNVSRILHRFGLKGTDQVTLSASGRSAGHLPLGRPVSLHDLLSYSVEVQEAATRAQIRELASFTVCPPHRRELEELSAEGVYQEQILKKRISMLDLLEKYEACDMPFERFLELLRPLKPRYYSISSSPRVNPRQASITVGVVRGPAWSGRGEYRGVASNDLAERQAGDDVVMFIRTPESRFQLPKDPETPIIMVGPGTGVAPFRGFLQARDVLKREGKTLGEAHLYFGCRNDRDFIYRDELERFEKDGIVTVHTAFSRKEGMPKTYVQHLMADQADTLISILDRGGRLYVCGDGSKMAPDVEAALQKAYQAVHGTGEQEAQNWLRHLQDTGMYAKDVWAGI,sabio,O08394,CC(C)CCCCCCCCCCCC(=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,231900.0,14.433918143084169,30.0,7.4,1.14.14.1,1423.0,5.365300748637988,CC(C)CCCCCCCCCCCC(=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,5.365300748637988,CC(C)CCCCCCCCCCCC(=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]__MKETSPIPQPKTFGPLGNLPLIDKDKPTLSLIKLAEEQGPIFQIHTPAGTTIVVSGHELVKEVCDEERFDKSIEGALEKVRAFSGDGLFTSWTHEPNWRKAHNILMPTFSQRAMKDYHEKMVDIAVQLIQKWARLNPNEAVDVPGDMTRLTLDTIGLCGFNYRFNSYYRETPHPFINSMVRALDEAMHQMQRLDVQDKLMVRTKRQFRYDIQTMFSLVDSIIAERRANGDQDEKDLLARMLNVEDPETGEKLDDENIRFQIITFLIAGHETTSGLLSFATYFLLKHPDKLKKAYEEVDRVLTDAAPTYKQVLELTYIRMILNESLRLWPTAPAFSLYPKEDTVIGGKFPITTNDRISVLIPQLHRDRDAWGKDAEEFRPERFEHQDQVPHHAYKPFGNGQRACIGMQFALHEATLVLGMILKYFTLIDHENYELDIKQTLTLKPGDFHISVQSRHQEAIHADVQAAEKAAPDEQKEKTEAKGASVIGLNNRPLLVLYGSDTGTAEGVARELADTASLHGVRTKTAPLNDRIGKLPKEGAVVIVTSSYNGKPPSNAGQFVQWLQEIKPGELEGVHYAVFGCGDHNWASTYQYVPRFIDEQLAEKGATRFSARGEGDVSGDFEGQLDEWKKSMWADAIKAFGLELNENADKERSTLSLQFVRGLGESPLARSYEASHASIAENRELQSADSDRSTRHIEIALPPDVEYQEGDHLGVLPKNSQTNVSRILHRFGLKGTDQVTLSASGRSAGHLPLGRPVSLHDLLSYSVEVQEAATRAQIRELASFTVCPPHRRELEELSAEGVYQEQILKKRISMLDLLEKYEACDMPFERFLELLRPLKPRYYSISSSPRVNPRQASITVGVVRGPAWSGRGEYRGVASNDLAERQAGDDVVMFIRTPESRFQLPKDPETPIIMVGPGTGVAPFRGFLQARDVLKREGKTLGEAHLYFGCRNDRDFIYRDELERFEKDGIVTVHTAFSRKEGMPKTYVQHLMADQADTLISILDRGGRLYVCGDGSKMAPDVEAALQKAYQAVHGTGEQEAQNWLRHLQDTGMYAKDVWAGI,./data/raw/alphafold//AF-O08394-F1-model_v4.pdb,1826,1506,3079,1839
+361,4608,4664,MVKKQKRRKIKSMSWARKLLIAVLLILGLALLFNKPIRNTLIARNSNKYQVTKVSKKQIKKNKEAKSTFDFQAVEPVSTESVLQAQMAAQQLPVIGGIAIPELGINLPIFKGLGNTELIYGAGTMKEEQVMGGENNYSLASHHIFGITGSSQMLFSPLERAQNGMSIYLTDKEKIYEYIIKDVFTVAPERVDVIDDTAGLKEVTLVTCTDIEATERIIVKGELKTEYDFDKAPADVLKAFNHSYNQVST,sabio,Q99ZN4,CC(N)C(O)=NC(C)C(=O)O>>,0.0136,99.37954868371251,37.0,7.5,-.-.-.-,1314.0,-1.8664610916297824,CC(N)C(O)=NC(C)C(=O)O,,-1.8664610916297824,CC(N)C(O)=NC(C)C(=O)O__MVKKQKRRKIKSMSWARKLLIAVLLILGLALLFNKPIRNTLIARNSNKYQVTKVSKKQIKKNKEAKSTFDFQAVEPVSTESVLQAQMAAQQLPVIGGIAIPELGINLPIFKGLGNTELIYGAGTMKEEQVMGGENNYSLASHHIFGITGSSQMLFSPLERAQNGMSIYLTDKEKIYEYIIKDVFTVAPERVDVIDDTAGLKEVTLVTCTDIEATERIIVKGELKTEYDFDKAPADVLKAFNHSYNQVST,./data/raw/alphafold//AF-Q99ZN4-F1-model_v4.pdb,2947,1682,3292,2091
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+420,1587,1616,MPMSDAYRALYQRSIDDPAAFWGEQAQRIDWQTPYAAVLDDARLPFARWFVGGRTNLCHNAVDRHLATRGEQAALVYVSTETGIETTYTYRALHREVNRMAACLQALGVRRGDRVLIYLPMIPEAAFAMLACARIGAIHSVVFGGFASNSLATRIDDATPRVIVSADAGSRGGKVVEYKPLLDAAIDLAVHKPAHVLLVDRKLAPMQHRPHDIDYAALARQHTHADVPCEWMESSEPSYILYTSGTTGKPKGVQRDTGGYAVALAASMPLIFGAQAGDTMFTASDVGWVVGHSYIVYAPLLAGLATVMYEGTPVRPDGAIWWRIVEQYRVNVMFTAPTAIRVLKKQDPALLRRHDLSSLRRLFLAGEPLDEPTARWIGDALGKPIIDNYWQTETGWPMLAIPQGVAPSTPKLGSPGFPVYGYRLDILDEATGQPCAPGEKGLLAVAAPLPPGCMSTVWGDDARFLKTYWSAFPGRPLYSSFDWGVRDEAGYITILGRTDDVINVAGHRLGTREIEESLSSHPAIAEVAVVGVADPLKGQVAMGFAIVRDAARVAEPAGRMALEGELMRTVEGQLGAVARPSRVFFVNALPKTRSGKLLRRAMQAVAEGRDPGDLTTIEDPTALAQVREAMQA,sabio,Q8XZ86,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)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,6.8,8.514114150389701e-15,37.0,8.0,6.2.1.17,305.0,0.8325089127062363,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)O)C(O)C1O.O=P(O)(O)OP(=O)(O)O,0.8325089127062363,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
+421,17346,17579,MWFGEFGGQYVPETLIEPLKELEKAYKRFKDDEEFNRQLNYYLKTWAGRPTPLYYAKRLTEKIGGAKIYLKREDLVHGGAHKTNNAIGQALLAKFMGKTRLIAETGAGQHGVATAMAGALLGMKVDIYMGAEDVERQKMNVFRMKLLGANVIPVNSGSRTLKDAINEALRDWVATFEYTHYLIGSVVGPHPYPTIVRDFQSVIGREAKAQILEAEGQLPDVIVACVGGGSNAMGIFYPFVNDKKVKLVGVEAGGKGLESGKHSASLNAGQVGVFHGMLSYFLQDEEGQIKPTHSIAPGLDYPGVGPEHAYLKKIQRAEYVTVTDEEALKAFHELSRTEGIIPALESAHAVAYAMKLAKEMSRDEIIIVNLSGRGDKDLDIVLKVSGNV,brenda,Q8U093,N[C@@H](CO)C(=O)O.c1ccc2[nH]ccc2c1>>N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O,1.0,0.0,75.0,8.0,4.2.1.20,2261.0,0.0,N[C@@H](CO)C(=O)O.c1ccc2[nH]ccc2c1,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O,0.0,N[C@@H](CO)C(=O)O.c1ccc2[nH]ccc2c1__MWFGEFGGQYVPETLIEPLKELEKAYKRFKDDEEFNRQLNYYLKTWAGRPTPLYYAKRLTEKIGGAKIYLKREDLVHGGAHKTNNAIGQALLAKFMGKTRLIAETGAGQHGVATAMAGALLGMKVDIYMGAEDVERQKMNVFRMKLLGANVIPVNSGSRTLKDAINEALRDWVATFEYTHYLIGSVVGPHPYPTIVRDFQSVIGREAKAQILEAEGQLPDVIVACVGGGSNAMGIFYPFVNDKKVKLVGVEAGGKGLESGKHSASLNAGQVGVFHGMLSYFLQDEEGQIKPTHSIAPGLDYPGVGPEHAYLKKIQRAEYVTVTDEEALKAFHELSRTEGIIPALESAHAVAYAMKLAKEMSRDEIIIVNLSGRGDKDLDIVLKVSGNV,./data/raw/alphafold//AF-Q8U093-F1-model_v4.pdb,3669,3665,1465,3430
+422,21306,21630,MTNQLFDAYFTAPAMREIFSDRGRLQGMLDFEAALARAEAAAGLVPHSAVAAIEAACKAERYDVGALANAIATAGNSAIPLVKALGKVIASGVPEAERYVHLGATSQDAMDTGLVLQLRDALDLIEADLGKLADTLSQQALKHADTPMVGRTWLQHATPVTLGMKLAGVLGALTRHRQRLQELGPPCWCCSSGGASGSLAALGSKAMPVAEALAEQLKLSLPEQPWHTQRDRLVEFASVLGLVAGSLGKFGRDVSLLMQTEAGEVFEPSAPGKGGSSTMPHKRNPVGAAVLIGAATRVPGLVSTLFAAMPQEHERSLGLWHAEWETLPDICCLVSGALRQAQVIAEGIEVDAARMRRNLDLTQGLVLAEAVSIVLARTLGRDRAHHLLEQCCQRAVAEQRHLRAVLGDDPQVSAELSAEELD,sabio,P32427,O=C(O)C=CC(=CC(=O)O)C(=O)O>>O=C(O)CC1(C(=O)O)C=CC(=O)O1,460.0,0.0,25.0,7.5,5.5.1.2,303.0,2.6627578316815743,O=C(O)C=CC(=CC(=O)O)C(=O)O,O=C(O)CC1(C(=O)O)C=CC(=O)O1,2.778151250383644,O=C(O)C=CC(=CC(=O)O)C(=O)O__MTNQLFDAYFTAPAMREIFSDRGRLQGMLDFEAALARAEAAAGLVPHSAVAAIEAACKAERYDVGALANAIATAGNSAIPLVKALGKVIASGVPEAERYVHLGATSQDAMDTGLVLQLRDALDLIEADLGKLADTLSQQALKHADTPMVGRTWLQHATPVTLGMKLAGVLGALTRHRQRLQELGPPCWCCSSGGASGSLAALGSKAMPVAEALAEQLKLSLPEQPWHTQRDRLVEFASVLGLVAGSLGKFGRDVSLLMQTEAGEVFEPSAPGKGGSSTMPHKRNPVGAAVLIGAATRVPGLVSTLFAAMPQEHERSLGLWHAEWETLPDICCLVSGALRQAQVIAEGIEVDAARMRRNLDLTQGLVLAEAVSIVLARTLGRDRAHHLLEQCCQRAVAEQRHLRAVLGDDPQVSAELSAEELD,./data/raw/alphafold//AF-P32427-F1-model_v4.pdb,624,3363,5696,6596
+423,9485,9628,MGSEALVHVLLVSFPGQGHVNPLLRLGKRLASKGLLVTFTTPESIGKAMRKASNIGEELSPVGDGFIRFEFFEDGWDEDETRRQDLDQYLPQLEKVGKVLIPEMIRRNAEQGRPISCLINNPFIPWVSDVADSLGLPSAMLWVQSCACFTSYYYYYHGLVPFPSETAMEIDVQLPCMPLLKHDEVPSFLYPTTPYPFLRRAIMGQYKNLDKPFCILMDTFQELEHEIIEYMSKISPIKTVGPLFKNPKAPNATVKGDFMKADDCVGWLDSKPASSIVYVSFGSVVYLKQDQWDEIAYGLLNSGVNFLWVMKPPHKDSGYEVLKMPEGFLEKAGDRGKVVQWSPQEQVLAHPSVACFVTHCGWNSTMEALTSGMPVVAFPQWGDQVTDAKYLVDVFKVGVRMCRGEAENKLITRDVVEQCLREATSGPKAEEMKQNAKKWSAAAEAAVAEGGSSDRNIQAFVDEVKRRSLEVLAASGKSTANGGADLANKVAGNGVAELGEPKVNGELKVVS,brenda,A0A2Z5V6P3,COc1cc(C(=O)O)ccc1O.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>>COc1cc(C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,10.4,1.5468649257992522e-14,30.0,6.0,2.4.1.136,34316.0,1.0170333392987805,COc1cc(C(=O)O)ccc1O.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,COc1cc(C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,1.0170333392987805,COc1cc(C(=O)O)ccc1O.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__MGSEALVHVLLVSFPGQGHVNPLLRLGKRLASKGLLVTFTTPESIGKAMRKASNIGEELSPVGDGFIRFEFFEDGWDEDETRRQDLDQYLPQLEKVGKVLIPEMIRRNAEQGRPISCLINNPFIPWVSDVADSLGLPSAMLWVQSCACFTSYYYYYHGLVPFPSETAMEIDVQLPCMPLLKHDEVPSFLYPTTPYPFLRRAIMGQYKNLDKPFCILMDTFQELEHEIIEYMSKISPIKTVGPLFKNPKAPNATVKGDFMKADDCVGWLDSKPASSIVYVSFGSVVYLKQDQWDEIAYGLLNSGVNFLWVMKPPHKDSGYEVLKMPEGFLEKAGDRGKVVQWSPQEQVLAHPSVACFVTHCGWNSTMEALTSGMPVVAFPQWGDQVTDAKYLVDVFKVGVRMCRGEAENKLITRDVVEQCLREATSGPKAEEMKQNAKKWSAAAEAAVAEGGSSDRNIQAFVDEVKRRSLEVLAASGKSTANGGADLANKVAGNGVAELGEPKVNGELKVVS,./data/raw/alphafold//AF-A0A2Z5V6P3-F1-model_v4.pdb,3539,3480,1258,3201
+424,17664,17906,MGILALVTDAVSLPIDYDMPPLLEACRTVGITAEVCDWEDGTVDWSRFEAVVFRSPWTWAERQAEFLAFCERVSHVTRLITPMPLVRWALDKRYLADLAAHGVPVIPTTVVAPGSDALAAVRDFLAARPEAREFVVKPTDGCYSKDVQRYQRSLAEPASRHVARLLANGSHVILQPYVESVDRHGETDLTFFDGVYSHAIHKGAMLMPDGTVHVPTLDFRQARDADEDQRAVAAAALAASVAHLGLDLPLVCGRVDLVRGADGSPMVLEMELCEPSLNLTFSEDGALRFAQALAERLKP,brenda,D2Z030,N[C@H](CCS)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.O>>,860.0,99.84880213491388,30.0,8.0,6.3.3.5,1914.0,2.934498451243568,N[C@H](CCS)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.O,,2.934498451243568,N[C@H](CCS)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.O__MGILALVTDAVSLPIDYDMPPLLEACRTVGITAEVCDWEDGTVDWSRFEAVVFRSPWTWAERQAEFLAFCERVSHVTRLITPMPLVRWALDKRYLADLAAHGVPVIPTTVVAPGSDALAAVRDFLAARPEAREFVVKPTDGCYSKDVQRYQRSLAEPASRHVARLLANGSHVILQPYVESVDRHGETDLTFFDGVYSHAIHKGAMLMPDGTVHVPTLDFRQARDADEDQRAVAAAALAASVAHLGLDLPLVCGRVDLVRGADGSPMVLEMELCEPSLNLTFSEDGALRFAQALAERLKP,./data/raw/alphafold//AF-D2Z030-F1-model_v4.pdb,2300,4635,4663,4492
+425,16741,16971,MMEYWIRRALEVVKTPFLLFDLSVVEKKYLEMKAALKKADIYYAVKANSHPRIISLLARLGSNFDVASKGEIEKLLALGVDGKRMSFGNTIKREEDIAFAYKNGIRLFAVDSEMEVEKVAINAPGSFVFVRVETDGADADWPLSRKFGTNPEHALQLLSYASKMKLIPAGLSFHVGSQNLNPESWKKAIEIAGRVFKKAMRSGLNLFLLNVGGGFPVQHTKPIPSMEEIGKAIEEAIDENLWFVHNLKVIAEPGRYMVGEAGWLVTKVLLKSERSGEKWVYIDAGVFHGLAETIQNFEYEIRVLGKEREELEEYHLAGPTCDSVDVIYDRIFLPKSITLNDLVCFINAGAYTVEYNTRFNGIEPPKMVFIEELTEISIEEKIKTRVLD,sabio,Q9X2I6,NCCCC(N)C(=O)O>>NCCCCN.O=C=O,32.0,0.0,63.0,8.2,4.1.1.17,2336.0,1.505149978319906,NCCCC(N)C(=O)O,NCCCCN.O=C=O,1.977723605288848,NCCCC(N)C(=O)O__MMEYWIRRALEVVKTPFLLFDLSVVEKKYLEMKAALKKADIYYAVKANSHPRIISLLARLGSNFDVASKGEIEKLLALGVDGKRMSFGNTIKREEDIAFAYKNGIRLFAVDSEMEVEKVAINAPGSFVFVRVETDGADADWPLSRKFGTNPEHALQLLSYASKMKLIPAGLSFHVGSQNLNPESWKKAIEIAGRVFKKAMRSGLNLFLLNVGGGFPVQHTKPIPSMEEIGKAIEEAIDENLWFVHNLKVIAEPGRYMVGEAGWLVTKVLLKSERSGEKWVYIDAGVFHGLAETIQNFEYEIRVLGKEREELEEYHLAGPTCDSVDVIYDRIFLPKSITLNDLVCFINAGAYTVEYNTRFNGIEPPKMVFIEELTEISIEEKIKTRVLD,./data/raw/alphafold//AF-Q9X2I6-F1-model_v4.pdb,2706,3809,2390,5292
+426,8729,8866,MKKLFVLCIFLFLSITASGEVLPDLKIEKLEEGVYLHTSFEEVSGWGVVTKHGLVVLVNNDAYLIDTPFTNKDTEKLVAWFVGRGFTIKGSVSSHFHSDSTGGIEWLNSQSIPTYASELTNELLKKNGKVQATNSFSGVSYWLVKNKIEIFYPGPGHTQDNVVVWLPENKILFGGCFVKPDGLGNLDDANLKAWPKSAKILMSKYGKAKLVVSGHSEIGNASLLKLTWEQAVKGLKESKKPLLPSN,brenda,Q8GIW8,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1ccco1.O>>,61.0,99.77447305629605,30.0,7.2,3.5.2.6,303.0,1.7853298350107671,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1ccco1.O,,1.7853298350107671,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1ccco1.O__MKKLFVLCIFLFLSITASGEVLPDLKIEKLEEGVYLHTSFEEVSGWGVVTKHGLVVLVNNDAYLIDTPFTNKDTEKLVAWFVGRGFTIKGSVSSHFHSDSTGGIEWLNSQSIPTYASELTNELLKKNGKVQATNSFSGVSYWLVKNKIEIFYPGPGHTQDNVVVWLPENKILFGGCFVKPDGLGNLDDANLKAWPKSAKILMSKYGKAKLVVSGHSEIGNASLLKLTWEQAVKGLKESKKPLLPSN,./data/raw/alphafold//AF-Q8GIW8-F1-model_v4.pdb,1448,985,796,1107
+427,2294,2327,MDPKHQRVTLNDGHSIPVLGFGTYAPDEVPKSEAGEAAKIAIDVGFRHIDTAHAYQNEEEVGLAIRSKIADGTVKREDVFCTTKLWCTFFRPELVRKGLEQSLRKLQLDYVDLYLMHYPIAMKPGEEMFPTDEHGKTISDTVDICATWEAMEKCKDAGLAKSIGVSNFNHKQLEKILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAYSALGSSRDPKWVDQSSPVLLEDPVIGALAKKHKQSPALIALRYQLQRGVVVLAKSFIEREIKENIKVFGFQLSSEDMKALDGLNQNLRYCPAHFYIGHPHYPFSDEY,brenda,J7M9D0,CC(=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.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]3CC[C@H]4CC(=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+],0.0012,0.0,25.0,7.4,1.1.1.239,9986.0,-2.920818753952376,CC(=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.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]3CC[C@H]4CC(=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+],-2.920818753952376,CC(=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.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
+428,11910,12070,MGRPRPRAAKTWMFLLLLGGAWAGHSRAQEDKVLGGHECQPHSQPWQAALFQGQQLLCGGVLVGGNWVLTAAHCKKPKYTVRLGDHSLQNKDGPEQEIPVVQSIPHPCYNSSDVEDHNHDLMLLQLRDQASLGSKVKPISLADHCTQPGQKCTVSGWGTVTSPRENFPDTLNCAEVKIFPQKKCEDAYPGQITDGMVCAGSSKGADTCQGDSGGPLVCDGALQGITSWGSDPCGRSDKPGVYTNICRYLDWIKKIIGSKG,uniprot_search,O60259,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCC(=N)O)N=C(O)OC(C)(C)C)ccc12.O>>CC(C)(C)OC(O)=NC(CCC(=N)O)C(O)=NC(CCCNC(=N)N)C(O)=NC(CCCNC(=N)N)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,3.39,1.5481751713350986e-14,37.0,8.5,3.4.21.118,9606.0,0.5301996982030822,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCC(=N)O)N=C(O)OC(C)(C)C)ccc12.O,CC(C)(C)OC(O)=NC(CCC(=N)O)C(O)=NC(CCCNC(=N)N)C(O)=NC(CCCNC(=N)N)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,0.5301996982030822,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCC(=N)O)N=C(O)OC(C)(C)C)ccc12.O__MGRPRPRAAKTWMFLLLLGGAWAGHSRAQEDKVLGGHECQPHSQPWQAALFQGQQLLCGGVLVGGNWVLTAAHCKKPKYTVRLGDHSLQNKDGPEQEIPVVQSIPHPCYNSSDVEDHNHDLMLLQLRDQASLGSKVKPISLADHCTQPGQKCTVSGWGTVTSPRENFPDTLNCAEVKIFPQKKCEDAYPGQITDGMVCAGSSKGADTCQGDSGGPLVCDGALQGITSWGSDPCGRSDKPGVYTNICRYLDWIKKIIGSKG,./data/raw/alphafold//AF-O60259-F1-model_v4.pdb,3744,4078,3615,2452
+429,888,913,MKLLMLAFVFLLALATCKGDEFVCEENEPFTCNQTKLFNSGNFEKGFIFGVASSAYQVEGGRGRGLNVWDSFTHRFPEKGGADLGNGDTTCDSYTLWQKDIDVMDELNSTGYRFSIAWSRLLPKGKRSRGVNPGAIKYYNGLIDGLVAKNMTPFVTLFHWDLPQTLQDEYNGFLNKTIVDDFKDYADLCFELFGDRVKNWITINQLYTVPTRGYALGTDAPGRCSPKIDVRCPGGNSSTEPYIVAHNQLLAHAAAVDVYRTKYKDDQKGMIGPVMITRWFLPFDHSQESKDATERAKIFFHGWFMGPLTEGKYPDIMREYVGDRLPEFSETEAALVKGSYDFLGLNYYVTQYAQNNQTIVPSDVHTALMDSRTTLTSKNATGHAPGPPFNAASYYYPKGIYYVMDYFKTTYGDPLIYVTENGFSTPGDEDFEKATADYKRIDYLCSHLCFLSKVIKEKNVNVKGYFAWSLGDNYEFCNGFTVRFGLSYVDFANITGDRDLKASGKWFQKFINVTDEDSTNQDLLRSSVSSKNRDRKSLADA,sabio,P37702,C=CCC(=NOS(=O)(=O)[O-])SC1OC(CO)C(O)C(O)C1O.O>>C=CCN=C=S.O=S(=O)(O)O.OCC1OC(O)C(O)C(O)C1O,2.3,0.133549202546964,37.0,4.5,3.2.1.147,3702.0,0.3617278360175928,C=CCC(=NOS(=O)(=O)[O-])SC1OC(CO)C(O)C(O)C1O.O,C=CCN=C=S.O=S(=O)(O)O.OCC1OC(O)C(O)C(O)C1O,0.3617278360175928,C=CCC(=NOS(=O)(=O)[O-])SC1OC(CO)C(O)C(O)C1O.O__MKLLMLAFVFLLALATCKGDEFVCEENEPFTCNQTKLFNSGNFEKGFIFGVASSAYQVEGGRGRGLNVWDSFTHRFPEKGGADLGNGDTTCDSYTLWQKDIDVMDELNSTGYRFSIAWSRLLPKGKRSRGVNPGAIKYYNGLIDGLVAKNMTPFVTLFHWDLPQTLQDEYNGFLNKTIVDDFKDYADLCFELFGDRVKNWITINQLYTVPTRGYALGTDAPGRCSPKIDVRCPGGNSSTEPYIVAHNQLLAHAAAVDVYRTKYKDDQKGMIGPVMITRWFLPFDHSQESKDATERAKIFFHGWFMGPLTEGKYPDIMREYVGDRLPEFSETEAALVKGSYDFLGLNYYVTQYAQNNQTIVPSDVHTALMDSRTTLTSKNATGHAPGPPFNAASYYYPKGIYYVMDYFKTTYGDPLIYVTENGFSTPGDEDFEKATADYKRIDYLCSHLCFLSKVIKEKNVNVKGYFAWSLGDNYEFCNGFTVRFGLSYVDFANITGDRDLKASGKWFQKFINVTDEDSTNQDLLRSSVSSKNRDRKSLADA,./data/raw/alphafold//AF-P37702-F1-model_v4.pdb,481,810,514,587
+430,14911,15120,MQGRVLANNCKTMSNATERIACIDVGTNTALLLVADLDAAASNIVTVDHRQTIVRLGQNVDEYRMIHPEALDRLIACMTEYRNLCDGLGVQRILAVGTSALRDAANRDEVIAAVKGETGIEIRCISGDEEAALTFFGAVAGLPEVPEPFTVIDIGGGSTEIIMGTVEQVDSAVSINIGSVRMTERFCAAQPPSPEAFEAAKKEINRKLARSLPPFFAGRQQVFGVAGTLTTIAQVCLGDRHFDAAKVQGYRLEYDAVHELLDRLRAMKLNEIVALGIPEGRADVFTMGVLILHQFMRMLGVGSLTVSIQGLRYGVAQQELQKLLMLRNRT,brenda,Q8KG69,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=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)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.O=P(O)(O)O,308.0,0.0,25.0,6.5,3.6.1.11,1097.0,2.4885507165004443,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=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)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.O=P(O)(O)O,2.4885507165004443,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.O__MQGRVLANNCKTMSNATERIACIDVGTNTALLLVADLDAAASNIVTVDHRQTIVRLGQNVDEYRMIHPEALDRLIACMTEYRNLCDGLGVQRILAVGTSALRDAANRDEVIAAVKGETGIEIRCISGDEEAALTFFGAVAGLPEVPEPFTVIDIGGGSTEIIMGTVEQVDSAVSINIGSVRMTERFCAAQPPSPEAFEAAKKEINRKLARSLPPFFAGRQQVFGVAGTLTTIAQVCLGDRHFDAAKVQGYRLEYDAVHELLDRLRAMKLNEIVALGIPEGRADVFTMGVLILHQFMRMLGVGSLTVSIQGLRYGVAQQELQKLLMLRNRT,./data/raw/alphafold//AF-Q8KG69-F1-model_v4.pdb,2521,4957,2033,4887
+431,5909,6002,MLRRVLSRGPLPRSLSVGPAAKLTANRGKLAKSRGVHVHFLTTAECAAAAGDASAPIPPGFTGKAGEVDFQTLWATAQDPATAESALTKSGRKAAGARRIAEKPAELVAGMGAHSTVRDYRLAVTAAVRKAKMCNAAWVSLHPPKQDVFTMTDPYHPPQRLKGHEMVEKTAIFAVTGAYQYDRLKSGTLASKDLAKTGSTRARRAESRAKPPAAPQPPMELVVASSNAQAVRAGEVIGHCVNDARNLGNLREDEGVPEFYAEWAKKYMIPEGIKVRKVLRGQQLEGAGLHLMYNVGRGSRYEPYLMVLEYIGNPRSSATTAIVGKGVTFDCGGLNIKPYNSMETMHSDMMGAATAFCTLKAIAKLQLPINVVAAVGLVENAIGPESYHPSSIITSLKGLTVEVLNTDAEGRLVLADVLTYVQKYAPLDKKPTRIIDLATLTGAIIVGLGSRRAGLFSPSAILANSLMATGAQCGEELWPMPIGDEHKDMMKGGIADLINAAPGRQAGSCTAAAFLSNFVEPEVQWAHLDIAGVADVGDKPKGYEPAGVTGFGVQLLVDFLRHNKP,brenda,Q95V75,CC1=CCOc2cc(N=C(O)[C@@H](N)Cc3c[nH]c4ccccc34)ccc21.O>>Cc1cc(=O)oc2cc(N)ccc12.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,0.21,1.8747762616829804,37.0,8.0,3.4.11.1,5661.0,-0.6777807052660807,CC1=CCOc2cc(N=C(O)[C@@H](N)Cc3c[nH]c4ccccc34)ccc21.O,Cc1cc(=O)oc2cc(N)ccc12.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,-0.6777807052660807,CC1=CCOc2cc(N=C(O)[C@@H](N)Cc3c[nH]c4ccccc34)ccc21.O__MLRRVLSRGPLPRSLSVGPAAKLTANRGKLAKSRGVHVHFLTTAECAAAAGDASAPIPPGFTGKAGEVDFQTLWATAQDPATAESALTKSGRKAAGARRIAEKPAELVAGMGAHSTVRDYRLAVTAAVRKAKMCNAAWVSLHPPKQDVFTMTDPYHPPQRLKGHEMVEKTAIFAVTGAYQYDRLKSGTLASKDLAKTGSTRARRAESRAKPPAAPQPPMELVVASSNAQAVRAGEVIGHCVNDARNLGNLREDEGVPEFYAEWAKKYMIPEGIKVRKVLRGQQLEGAGLHLMYNVGRGSRYEPYLMVLEYIGNPRSSATTAIVGKGVTFDCGGLNIKPYNSMETMHSDMMGAATAFCTLKAIAKLQLPINVVAAVGLVENAIGPESYHPSSIITSLKGLTVEVLNTDAEGRLVLADVLTYVQKYAPLDKKPTRIIDLATLTGAIIVGLGSRRAGLFSPSAILANSLMATGAQCGEELWPMPIGDEHKDMMKGGIADLINAAPGRQAGSCTAAAFLSNFVEPEVQWAHLDIAGVADVGDKPKGYEPAGVTGFGVQLLVDFLRHNKP,./data/raw/alphafold//AF-Q95V75-F1-model_v4.pdb,3177,1972,3617,2455
+432,16548,16777,MPHAHPADIDGHHLTPDTVAAIARGQRAAIVPEPVLGKVADARARFEQVAAANVPIYGVSTGFGELVHNWVDIEHGRALQENLLRSHCAGVGPLFSRDEVRAMMVARANALARGYSAVRPAVIEQLLKYLEAGITPAVPQVGSLGASGDLAPLSHVAITLIGEGKVLTEDGGTAPTAEVLRERGITPLALAYKEGLALINGTSAMTGVSCLLLETLRAQVQQAEIIAALALEGLSASADAFMAHGHDIAKPHPGQIRSAANMRALLADSARLSGHGELSAEMKTRAGEAKNTGTGVFIQKAYTLRCIPQVLGAVRDTLDHCATVVERELNSSNDNPLFFEDGELFHGGNFHGQQVAFAMDFLAIAATQLGVVSERRLNRLLSPHLNNNLPAFLAAANEGLSCGFAGAQYPATALIAENRTICSPASIQSVPSNGDNQDVVSMGLIAARNARRILDNNQYILALELLASCQAAELAGAVEQLAPAGRAVFAFVRERVPFLSIDRYMTDDIEAMAALLRQGALVEVVRGAGIELA,sabio,Q1LRV9,NC(Cc1ccc(O)cc1)C(=O)O>>N.O=C(O)C=Cc1ccc(O)cc1,0.011,7.821441191474541e-15,30.0,8.8,4.3.1.23,119219.0,-1.958607314841775,NC(Cc1ccc(O)cc1)C(=O)O,N.O=C(O)C=Cc1ccc(O)cc1,-1.958607314841775,NC(Cc1ccc(O)cc1)C(=O)O__MPHAHPADIDGHHLTPDTVAAIARGQRAAIVPEPVLGKVADARARFEQVAAANVPIYGVSTGFGELVHNWVDIEHGRALQENLLRSHCAGVGPLFSRDEVRAMMVARANALARGYSAVRPAVIEQLLKYLEAGITPAVPQVGSLGASGDLAPLSHVAITLIGEGKVLTEDGGTAPTAEVLRERGITPLALAYKEGLALINGTSAMTGVSCLLLETLRAQVQQAEIIAALALEGLSASADAFMAHGHDIAKPHPGQIRSAANMRALLADSARLSGHGELSAEMKTRAGEAKNTGTGVFIQKAYTLRCIPQVLGAVRDTLDHCATVVERELNSSNDNPLFFEDGELFHGGNFHGQQVAFAMDFLAIAATQLGVVSERRLNRLLSPHLNNNLPAFLAAANEGLSCGFAGAQYPATALIAENRTICSPASIQSVPSNGDNQDVVSMGLIAARNARRILDNNQYILALELLASCQAAELAGAVEQLAPAGRAVFAFVRERVPFLSIDRYMTDDIEAMAALLRQGALVEVVRGAGIELA,./data/raw/alphafold//AF-Q1LRV9-F1-model_v4.pdb,2682,3780,2353,5251
+433,7229,7351,MTSMTQSLREVIKAMTKARNFERVLGKITLVSAAPGKVICEMKVEEEHTNAIGTLHGGLTATLVDNISTMALLCTERGAPGVSVDMNITYMSPAKLGEDIVITAHVLKQGKTLAFTSVDLTNKATGKLIAQGRHTKHLGN,brenda,Q9NPJ3,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.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.CCCCCCCCCC(=O)O,0.016,6.0451850254339816e-15,37.0,7.5,3.1.2.20,9606.0,-1.7958800173440752,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.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.CCCCCCCCCC(=O)O,-1.7958800173440752,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.O__MTSMTQSLREVIKAMTKARNFERVLGKITLVSAAPGKVICEMKVEEEHTNAIGTLHGGLTATLVDNISTMALLCTERGAPGVSVDMNITYMSPAKLGEDIVITAHVLKQGKTLAFTSVDLTNKATGKLIAQGRHTKHLGN,./data/raw/alphafold//AF-Q9NPJ3-F1-model_v4.pdb,1636,1238,1720,275
+434,17474,17711,MTPEQFRQYGHQLIDLIADYRQTVGERPVMAQVEPGYLKAALPATAPQQGEPFAAILDDVNNLVMPGLSHWQHPDFYGYFPSNGTLSSVLGDFLSTGLGVLGLSWQSSPALSELEETTLDWLRQLLGLSGQWSGVIQDTASTSTLVALISARERATDYALVRGGLQAEPKPLIVYVSAHAHSSVDKAALLAGFGRDNIRLIPTDERYALRPEALQAAIEQDLAAGNQPCAVVATTGTTTTTALDPLRPVGEIAQANGLWLHVDSAMAGSAMILPECRWMWDGIELADSVVVNAHKWLGVAFDCSIYYVRDPQHLIRVMSTNPSYLQSAVDGEVKNLRDWGIPLGRRFRALKLWFMLRSEGVDALQARLRRDLDNAQWLAGQVEAAAEWEVLAPVQLQTLCIRHRPAGLEGEALDAHTKGWAERLNASGAAYVTPATLDGRWMVRVSIGALPTERGDVQRLWARLQDVIKG,brenda,Q88JU5,N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O>>NCCc1ccc(O)c(O)c1.O=C=O,1.8,7.188454001316206e-15,25.0,7.5,4.1.1.28,303.0,0.255272505103306,N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O,NCCc1ccc(O)c(O)c1.O=C=O,0.255272505103306,N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O__MTPEQFRQYGHQLIDLIADYRQTVGERPVMAQVEPGYLKAALPATAPQQGEPFAAILDDVNNLVMPGLSHWQHPDFYGYFPSNGTLSSVLGDFLSTGLGVLGLSWQSSPALSELEETTLDWLRQLLGLSGQWSGVIQDTASTSTLVALISARERATDYALVRGGLQAEPKPLIVYVSAHAHSSVDKAALLAGFGRDNIRLIPTDERYALRPEALQAAIEQDLAAGNQPCAVVATTGTTTTTALDPLRPVGEIAQANGLWLHVDSAMAGSAMILPECRWMWDGIELADSVVVNAHKWLGVAFDCSIYYVRDPQHLIRVMSTNPSYLQSAVDGEVKNLRDWGIPLGRRFRALKLWFMLRSEGVDALQARLRRDLDNAQWLAGQVEAAAEWEVLAPVQLQTLCIRHRPAGLEGEALDAHTKGWAERLNASGAAYVTPATLDGRWMVRVSIGALPTERGDVQRLWARLQDVIKG,./data/raw/alphafold//AF-Q88JU5-F1-model_v4.pdb,2797,2368,2640,5468
+435,5039,5124,MKNRRLNFKLFFLIIFSLFSTLSWSKTITLYLDPASLPALNQLMDFTQNNEDKTHPRIFGLSRFKIPDNIITQYQNIHFVELKDNRPTEALFTILDQYPGNIELNIHLNIAHSVQLIRPILAYRFKHLDRVSIQQLNLYDDGSMEYVDLEKEENKDISAEIKQAEKQLSHYLLTGKIKFDNPTIARYVWQSAFPVKYHFLSTDYFEKAEFLQPLKEYLAENYQKMDWTAYQQLTPEQQAFYLTLVGFNDEVKQSLEVQQAKFIFTGTTTWEGNTDVREYYAQQQLNLLNHFTQAEGDLFIGDHYKIYFKGHPRGGEINDYILNNAKNITNIPANISFEVLMMTGLLPDKVGGVASSLYFSLPKEKISHIIFTSNKQVKSKEDALNNPYVKVMRRLGIIDESQVIFWDSLKQL,brenda,Q15KI8,CC(O)=N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O.CC(O)=N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=N)nc3O)[C@H](O)[C@@H]2O)(C(=O)O)C[C@@H]1O>>N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1,6.7,60.19209247986228,37.0,8.5,2.4.99.6,747.0,0.8260748027008264,CC(O)=N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O.CC(O)=N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=N)nc3O)[C@H](O)[C@@H]2O)(C(=O)O)C[C@@H]1O,N=c1ccn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(O)n1,0.8260748027008264,CC(O)=N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O.CC(O)=N[C@H]1[C@H]([C@H](O)[C@H](O)CO)O[C@](OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=N)nc3O)[C@H](O)[C@@H]2O)(C(=O)O)C[C@@H]1O__MKNRRLNFKLFFLIIFSLFSTLSWSKTITLYLDPASLPALNQLMDFTQNNEDKTHPRIFGLSRFKIPDNIITQYQNIHFVELKDNRPTEALFTILDQYPGNIELNIHLNIAHSVQLIRPILAYRFKHLDRVSIQQLNLYDDGSMEYVDLEKEENKDISAEIKQAEKQLSHYLLTGKIKFDNPTIARYVWQSAFPVKYHFLSTDYFEKAEFLQPLKEYLAENYQKMDWTAYQQLTPEQQAFYLTLVGFNDEVKQSLEVQQAKFIFTGTTTWEGNTDVREYYAQQQLNLLNHFTQAEGDLFIGDHYKIYFKGHPRGGEINDYILNNAKNITNIPANISFEVLMMTGLLPDKVGGVASSLYFSLPKEKISHIIFTSNKQVKSKEDALNNPYVKVMRRLGIIDESQVIFWDSLKQL,./data/raw/alphafold//AF-Q15KI8-F1-model_v4.pdb,3077,1832,3459,2267
+436,21845,22171,MAHLLLLHGPNLNLLGTREPEIYGRITLPQIDAALAERATAAGHGLSSLQSNAEHVLIERIHATPEDGTAFILINPGAFTHTSVALRDALLAVALPFVEIHLSNPYTREPFRHHSYLADKALGVVCGFGVDSYRIALEGVIARLGSDV,brenda,Q9PH97,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O>>O.O=C(O)C1=CC(=O)[C@@H](O)[C@H](O)C1,7.15,7.453857947349876e-15,25.0,8.0,4.2.1.10,2371.0,0.8543060418010806,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O,O.O=C(O)C1=CC(=O)[C@@H](O)[C@H](O)C1,0.8543060418010806,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O__MAHLLLLHGPNLNLLGTREPEIYGRITLPQIDAALAERATAAGHGLSSLQSNAEHVLIERIHATPEDGTAFILINPGAFTHTSVALRDALLAVALPFVEIHLSNPYTREPFRHHSYLADKALGVVCGFGVDSYRIALEGVIARLGSDV,./data/raw/alphafold//AF-Q9PH97-F1-model_v4.pdb,721,113,5834,6743
+437,12885,13057,MKLTKGCAYKYIIFTVLILANILYDNKKRCMIKKNLRISSCGIISRLLKSNSNYNSFNKNYNFTSAISELQFSNFWNLDILQKDIFSNIHNNKNKPQSYIIHKRLMSEKGDNNNNNHQNNNGNDNKKRLGSVVNNEENTCSDKRMKPFEEGHGITQVDKMNNNSDHLQQNGVMNLNSNNVENNNNNNSVVVKKNEPKIHYRKDYKPSGFIINNVTLNINIHDNETIVRSVLDMDISKHNVGEDLVFDGVGLKINEISINNKKLVEGEEYTYDNEFLTIFSKFVPKSKFAFSSEVIIHPETNYALTGLYKSKNIIVSQCEATGFRRITFFIDRPDMMAKYDVTVTADKEKYPVLLSNGDKVNEFEIPGGRHGARFNDPHLKPCYLFAVVAGDLKHLSATYITKYTKKKVELYVFSEEKYVSKLQWALECLKKSMAFDEDYFGLEYDLSRLNLVAVSDFNVGAMENKGLNIFNANSLLASKKNSIDFSYARILTVVGHEYFHNYTGNRVTLRDWFQLTLKEGLTVHRENLFSEEMTKTVTTRLSHVDLLRSVQFLEDSSPLSHPIRPESYVSMENFYTTTVYDKGSEVMRMYLTILGEEYYKKGFDIYIKKNDGNTATCEDFNYAMEQAYKMKKADNSANLNQYLLWFSQSGTPHVSFKYNYDAEKKQYSIHVNQYTKPDENQKEKKPLFIPISVGLINPENGKEMISQTTLELTKESDTFVFNNIAVKPIPSLFRGFSAPVYIEDNLTDEERILLLKYDSDAFVRYNSCTNIYMKQILMNYNEFLKAKNEKLESFNLTPVNAQFIDAIKYLLEDPHADAGFKSYIVSLPQDRYIINFVSNLDTDVLADTKEYIYKQIGDKLNDVYYKMFKSLEAKADDLTYFNDESHVDFDQMNMRTLRNTLLSLLSKAQYPNILNEIIEHSKSPYPSNWLTSLSVSAYFDKYFELYDKTYKLSKDDELLLQEWLKTVSRSDRKDIYEILKKLENEVLKDSKNPNDIRAVYLPFTNNLRRFHDISGKGYKLIAEVITKTDKFNPMVATQLCEPFKLWNKLDTKRQELMLNEMNTMLQEPNISNNLKEYLLRLTNKL,brenda,Q8IEK1,N=C(N)NCCC[C@H](N)C(O)=Nc1ccc2ccccc2c1.O>>N=C(N)NCCC[C@H](N)C(=O)O.Nc1ccc2ccccc2c1,21.0,0.0,37.0,7.5,3.4.11.20,5833.0,1.3222192947339193,N=C(N)NCCC[C@H](N)C(O)=Nc1ccc2ccccc2c1.O,N=C(N)NCCC[C@H](N)C(=O)O.Nc1ccc2ccccc2c1,1.3222192947339193,N=C(N)NCCC[C@H](N)C(O)=Nc1ccc2ccccc2c1.O__MKLTKGCAYKYIIFTVLILANILYDNKKRCMIKKNLRISSCGIISRLLKSNSNYNSFNKNYNFTSAISELQFSNFWNLDILQKDIFSNIHNNKNKPQSYIIHKRLMSEKGDNNNNNHQNNNGNDNKKRLGSVVNNEENTCSDKRMKPFEEGHGITQVDKMNNNSDHLQQNGVMNLNSNNVENNNNNNSVVVKKNEPKIHYRKDYKPSGFIINNVTLNINIHDNETIVRSVLDMDISKHNVGEDLVFDGVGLKINEISINNKKLVEGEEYTYDNEFLTIFSKFVPKSKFAFSSEVIIHPETNYALTGLYKSKNIIVSQCEATGFRRITFFIDRPDMMAKYDVTVTADKEKYPVLLSNGDKVNEFEIPGGRHGARFNDPHLKPCYLFAVVAGDLKHLSATYITKYTKKKVELYVFSEEKYVSKLQWALECLKKSMAFDEDYFGLEYDLSRLNLVAVSDFNVGAMENKGLNIFNANSLLASKKNSIDFSYARILTVVGHEYFHNYTGNRVTLRDWFQLTLKEGLTVHRENLFSEEMTKTVTTRLSHVDLLRSVQFLEDSSPLSHPIRPESYVSMENFYTTTVYDKGSEVMRMYLTILGEEYYKKGFDIYIKKNDGNTATCEDFNYAMEQAYKMKKADNSANLNQYLLWFSQSGTPHVSFKYNYDAEKKQYSIHVNQYTKPDENQKEKKPLFIPISVGLINPENGKEMISQTTLELTKESDTFVFNNIAVKPIPSLFRGFSAPVYIEDNLTDEERILLLKYDSDAFVRYNSCTNIYMKQILMNYNEFLKAKNEKLESFNLTPVNAQFIDAIKYLLEDPHADAGFKSYIVSLPQDRYIINFVSNLDTDVLADTKEYIYKQIGDKLNDVYYKMFKSLEAKADDLTYFNDESHVDFDQMNMRTLRNTLLSLLSKAQYPNILNEIIEHSKSPYPSNWLTSLSVSAYFDKYFELYDKTYKLSKDDELLLQEWLKTVSRSDRKDIYEILKKLENEVLKDSKNPNDIRAVYLPFTNNLRRFHDISGKGYKLIAEVITKTDKFNPMVATQLCEPFKLWNKLDTKRQELMLNEMNTMLQEPNISNNLKEYLLRLTNKL,./data/raw/alphafold//AF-Q8IEK1-F1-model_v4.pdb,1845,1536,3117,1883
+438,2617,2652,MTTTTTILETCHIPPPPAANDLSIPLSFFDIKWLHYHPVRRLLFYHHPSSKSQFLHTIVPHLKQSLSLALTHYLPVAGNLLYPSNTEKFPQLRYAAGDSVPVTIAESNSDFESLTGNHTRDADQFYDLLPPIPPIEEESDWKLINIFAVQITLFPGEGICIGFSNHHCLGDARSIVGFISAWGEINGIGGYEGFLSNHSDSLSLPIFDRSFINDPNKIDAIFWKVLRNIPLKTASFPLPTNRVRSTFLLRRSDIEKLKTATKSPASSFVAAAAFVWSCMVKSGDKSDENAPELFIIPADARGRVDPPIPENYFGNCIVSSVAQVERGKLAAEDGFAVAAEAIGGEIEGKLKNRDEILRGAENWMSDIFKCFGMSVLGVSGSPKFDLLKADFGWGKARKLEVLSIDGENHSMSLCSSSDFNGGLEVGLSLPRERMAAFEEVFRASIMAASGPARRSPALVEPL,sabio,Q8W1W9,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)CC(=O)O.O=C(C=Cc1ccc(O)cc1)OCC1OC(Oc2cc3c(OC4OC(CO)C(O)C(O)C4O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)C(O)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.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,8.7,2.4204225596002744,30.0,7.0,2.3.1.172,180675.0,0.9395192526186184,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)CC(=O)O.O=C(C=Cc1ccc(O)cc1)OCC1OC(Oc2cc3c(OC4OC(CO)C(O)C(O)C4O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)C(O)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.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,0.9395192526186184,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)CC(=O)O.O=C(C=Cc1ccc(O)cc1)OCC1OC(Oc2cc3c(OC4OC(CO)C(O)C(O)C4O)cc(O)cc3[o+]c2-c2ccc(O)c(O)c2)C(O)C(O)C1O__MTTTTTILETCHIPPPPAANDLSIPLSFFDIKWLHYHPVRRLLFYHHPSSKSQFLHTIVPHLKQSLSLALTHYLPVAGNLLYPSNTEKFPQLRYAAGDSVPVTIAESNSDFESLTGNHTRDADQFYDLLPPIPPIEEESDWKLINIFAVQITLFPGEGICIGFSNHHCLGDARSIVGFISAWGEINGIGGYEGFLSNHSDSLSLPIFDRSFINDPNKIDAIFWKVLRNIPLKTASFPLPTNRVRSTFLLRRSDIEKLKTATKSPASSFVAAAAFVWSCMVKSGDKSDENAPELFIIPADARGRVDPPIPENYFGNCIVSSVAQVERGKLAAEDGFAVAAEAIGGEIEGKLKNRDEILRGAENWMSDIFKCFGMSVLGVSGSPKFDLLKADFGWGKARKLEVLSIDGENHSMSLCSSSDFNGGLEVGLSLPRERMAAFEEVFRASIMAASGPARRSPALVEPL,./data/raw/alphafold//AF-Q8W1W9-F1-model_v4.pdb,1589,1171,3016,1365
+439,18969,19254,MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVEYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDRWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,sabio,Q6SJ61,O>>,285.0,94.74099395214304,30.0,7.0,3.5.2.6,562.0,2.45484486000851,O,,2.45484486000851,O__MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVEYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDRWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,./data/raw/alphafold//AF-Q6SJ61-F1-model_v4.pdb,1458,402,35,2356
+440,22728,23068,MSASDALNSCPHVALLLSSGMGHLTPCLRFAATLVQHHCRVTIITNYPTVSVAESRAISLLLSDFPQITEKQFHLLPFDPSTANTTDPFFLRWEAIRRSAHLLNPLLSSISPPLSALVIDSSLVSSFVPVAANLDLPSYVLFTSSTRMCSLEETFPAFVASKTNFDSIQLDDVIEIPGFSPVPVSSVPPVFLNLNHLFTTMLIQNGQSFRKANGILINTFEALEGGILPGINDKRAADGLPPYCSVGPLLPCKFEKTECSAPVKWLDDQPEGSVVYVSFGSRFALSSEQIKELGDGLIRSGCRFLWVVKCKKVDQEDEESLDELLGRDVLEKIKKYGFVIKNWVNQQEILDHRAVGGFVTHGGWNSSMEAVWHGVPMLVWPQFGDQKINAEVIERSGLGMWVKRWGWGTQQLVKGEEIGERIKDLMGNNPLRVRAKTLREEARKAIEVGGSSEKTLKELIENWKKTSRKT,sabio,A0A0M4KE44,O=c1c2cc(O)c(O)cc2oc2cc(O)cc(O)c12.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1>>O=c1c2cc(O)c(O)cc2oc2cc(O)c(C3OC(CO)C(O)C(O)C3O)c(O)c12.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,0.8,0.0,45.0,9.0,2.4.1.-,29780.0,-0.0969100130080563,O=c1c2cc(O)c(O)cc2oc2cc(O)cc(O)c12.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1,O=c1c2cc(O)c(O)cc2oc2cc(O)c(C3OC(CO)C(O)C(O)C3O)c(O)c12.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,-0.0969100130080563,O=c1c2cc(O)c(O)cc2oc2cc(O)cc(O)c12.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1__MSASDALNSCPHVALLLSSGMGHLTPCLRFAATLVQHHCRVTIITNYPTVSVAESRAISLLLSDFPQITEKQFHLLPFDPSTANTTDPFFLRWEAIRRSAHLLNPLLSSISPPLSALVIDSSLVSSFVPVAANLDLPSYVLFTSSTRMCSLEETFPAFVASKTNFDSIQLDDVIEIPGFSPVPVSSVPPVFLNLNHLFTTMLIQNGQSFRKANGILINTFEALEGGILPGINDKRAADGLPPYCSVGPLLPCKFEKTECSAPVKWLDDQPEGSVVYVSFGSRFALSSEQIKELGDGLIRSGCRFLWVVKCKKVDQEDEESLDELLGRDVLEKIKKYGFVIKNWVNQQEILDHRAVGGFVTHGGWNSSMEAVWHGVPMLVWPQFGDQKINAEVIERSGLGMWVKRWGWGTQQLVKGEEIGERIKDLMGNNPLRVRAKTLREEARKAIEVGGSSEKTLKELIENWKKTSRKT,./data/raw/alphafold//AF-A0A0M4KE44-F1-model_v4.pdb,546,104,5817,6724
+441,17386,17622,MVSIMNKNELITEILKNEVVKALGCTEVGLIGYTVAKAKPEDLYSIKEIKLILDKGTFKNAFSVGVPNTNKFGILPAVVGGLLGREENKLEVFKDIKYDEKLEEFIENKLKIEVIDSDVYCKVIIKANKVYEAETKGSHSGKSLSDDLKNAYKSLTLKDFIDYIEDIPEEVIKIIKETIETNKNLSTPEVPEDFISLDLKDEILNHMLKKTVSAVYNRMIGINKPAMAIAGSGNMGLTATLPIIAYDEIKGHDEEKLTKSITLSALTTIYSAYHSSYISAMCGCVNRGGIGAVSGLSYYIFGFDRIEESIKSFTANLPGIVCDGGKIGCALKIASGVFAIYLSLFSKVPYTNGIVGKDFKECIENIGKIGKAMKPVDDEIIEILKNKK,brenda,Q58431,N[C@@H](CS)C(=O)O.O>>CC(=O)C(=O)O.N.[S-2],39.6,0.7269160873453212,65.0,6.6,4.4.1.28,2190.0,1.5976951859255124,N[C@@H](CS)C(=O)O.O,CC(=O)C(=O)O.N.[S-2],1.5976951859255124,N[C@@H](CS)C(=O)O.O__MVSIMNKNELITEILKNEVVKALGCTEVGLIGYTVAKAKPEDLYSIKEIKLILDKGTFKNAFSVGVPNTNKFGILPAVVGGLLGREENKLEVFKDIKYDEKLEEFIENKLKIEVIDSDVYCKVIIKANKVYEAETKGSHSGKSLSDDLKNAYKSLTLKDFIDYIEDIPEEVIKIIKETIETNKNLSTPEVPEDFISLDLKDEILNHMLKKTVSAVYNRMIGINKPAMAIAGSGNMGLTATLPIIAYDEIKGHDEEKLTKSITLSALTTIYSAYHSSYISAMCGCVNRGGIGAVSGLSYYIFGFDRIEESIKSFTANLPGIVCDGGKIGCALKIASGVFAIYLSLFSKVPYTNGIVGKDFKECIENIGKIGKAMKPVDDEIIEILKNKK,./data/raw/alphafold//AF-Q58431-F1-model_v4.pdb,2794,5361,2631,5458
+442,15728,15955,MTAPSQVLKIRRPDDWHLHLRDGDMLKTVVPYTSEIYGRAIVMPNLAPPVTTVEAAVAYRQRILDAVPAGHDFTPLMTCYLTDSLDPNELERGFNEGVFTAAKLYPANATTNSSHGVTSIDAIMPVLERMEKIGMPLLVHGEVTHADIDIFDREARFIESVMEPLRQRLTALKVVFEHITTKDAADYVRDGNERLAATITPQHLMFNRNHMLVGGVRPHLYCLPILKRNIHQQALRELVASGFNRVFLGTDSAPHARHRKESSCGCAGCFNAPTALGSYATVFEEMNALQHFEAFCSVNGPQFYGLPVNDTFIELVREEQQVAESIALTDDTLVPFLAGETVRWSVKQ,sabio,P05020,NC(=O)NC(CC(=O)O)C(=O)O>>O.O=C1CC(C(=O)O)NC(=O)N1,25.0,0.0,,5.8,3.5.2.3,562.0,1.3979400086720375,NC(=O)NC(CC(=O)O)C(=O)O,O.O=C1CC(C(=O)O)NC(=O)N1,2.2579184503140586,NC(=O)NC(CC(=O)O)C(=O)O__MTAPSQVLKIRRPDDWHLHLRDGDMLKTVVPYTSEIYGRAIVMPNLAPPVTTVEAAVAYRQRILDAVPAGHDFTPLMTCYLTDSLDPNELERGFNEGVFTAAKLYPANATTNSSHGVTSIDAIMPVLERMEKIGMPLLVHGEVTHADIDIFDREARFIESVMEPLRQRLTALKVVFEHITTKDAADYVRDGNERLAATITPQHLMFNRNHMLVGGVRPHLYCLPILKRNIHQQALRELVASGFNRVFLGTDSAPHARHRKESSCGCAGCFNAPTALGSYATVFEEMNALQHFEAFCSVNGPQFYGLPVNDTFIELVREEQQVAESIALTDDTLVPFLAGETVRWSVKQ,./data/raw/alphafold//AF-P05020-F1-model_v4.pdb,2303,4640,4668,4497
+443,335,349,MAIGTVESVAVVAVPFPAQGHLNQLMHLSLLLASRGLDVHYAAPPAHLRQARLRLHGWDPDALRSIRFHDLDVPAYESPPPDPTAPPFPSHLMPMLESFAVAARVPLAALLERLSASYRRVVVVYDRLNSFAAAQAARLPNGEAFGLQCVAMSYNIGWLDPEHRLVREHGLQFHPVEACMTKEFVELISRAEQDEENAASSGILMNTSRALEAEFIDEIATHPMFKELKLFAAGPLNPLLDATARTPGQTRHECMDWLDKQPLASVLYVSFGTTSSLRGDQVAELAAALKGSKQRFIWVLRDADRANIFADSGESRHAELLSRFTAETEGVGLVITGWAPQLEILAHGATAAFMSHCGWNSTMESLSYGKPILAWPMHSDQPWDAELVCKYLKAGLLVRPWEKHSEVVPAEAIQEVIEEAMLPEKGMTIRRRAKELGEAVRASVADGGSSRKGLDDFVGYITR,brenda,Q7XU03,C/C(=C/CNc1nc[nH]c2ncnc1-2)CO.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O>>C/C(=C/CNc1nc[nH]c2ncnc1-2)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.53,7.231527111609697e-15,30.0,6.0,2.4.1.215,39947.0,-0.2757241303992109,C/C(=C/CNc1nc[nH]c2ncnc1-2)CO.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O,C/C(=C/CNc1nc[nH]c2ncnc1-2)CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-0.2757241303992109,C/C(=C/CNc1nc[nH]c2ncnc1-2)CO.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O__MAIGTVESVAVVAVPFPAQGHLNQLMHLSLLLASRGLDVHYAAPPAHLRQARLRLHGWDPDALRSIRFHDLDVPAYESPPPDPTAPPFPSHLMPMLESFAVAARVPLAALLERLSASYRRVVVVYDRLNSFAAAQAARLPNGEAFGLQCVAMSYNIGWLDPEHRLVREHGLQFHPVEACMTKEFVELISRAEQDEENAASSGILMNTSRALEAEFIDEIATHPMFKELKLFAAGPLNPLLDATARTPGQTRHECMDWLDKQPLASVLYVSFGTTSSLRGDQVAELAAALKGSKQRFIWVLRDADRANIFADSGESRHAELLSRFTAETEGVGLVITGWAPQLEILAHGATAAFMSHCGWNSTMESLSYGKPILAWPMHSDQPWDAELVCKYLKAGLLVRPWEKHSEVVPAEAIQEVIEEAMLPEKGMTIRRRAKELGEAVRASVADGGSSRKGLDDFVGYITR,./data/raw/alphafold//AF-Q7XU03-F1-model_v4.pdb,1024,566,228,248
+444,2092,2123,MTLDLDAYFARIGWTGNPRPTLEVLRSLHRAHLIGIPFENLEPVLGSAPSLALDDLEAKLVHGGRGGYCYEHNTLFSAVLRQIGFSVTPLTARVVLGAAPGDIRPRTHMLMRVDVAGEPHPYLADVGFGAVGALLEPIELVEDAELSDAPRRHRLVHAPHHGPLPLWELQAGQGGSWEPQYDFTLDPYEKPDYEVINWFIATHPRSPFRQAVYAQRTRIGSHLALSGLDLVETADDGTIRERRLEDGDEALRVLTDDFGIRLPEGVRLPE,brenda,A2V7M5,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.Nc1cc(Cl)ccc1O>>CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.CC(O)=Nc1cc(Cl)ccc1O,0.27,0.0,30.0,7.0,2.3.1.5,1911.0,-0.5686362358410126,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.Nc1cc(Cl)ccc1O,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.CC(O)=Nc1cc(Cl)ccc1O,-0.5686362358410126,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.Nc1cc(Cl)ccc1O__MTLDLDAYFARIGWTGNPRPTLEVLRSLHRAHLIGIPFENLEPVLGSAPSLALDDLEAKLVHGGRGGYCYEHNTLFSAVLRQIGFSVTPLTARVVLGAAPGDIRPRTHMLMRVDVAGEPHPYLADVGFGAVGALLEPIELVEDAELSDAPRRHRLVHAPHHGPLPLWELQAGQGGSWEPQYDFTLDPYEKPDYEVINWFIATHPRSPFRQAVYAQRTRIGSHLALSGLDLVETADDGTIRERRLEDGDEALRVLTDDFGIRLPEGVRLPE,./data/raw/alphafold//AF-A2V7M5-F1-model_v4.pdb,1531,1086,914,1251
+445,12920,13092,MKALLVLVFVGAAWSYRFDFHDDYFSEAFVNYHNSRDDVSWKATTENFKNVPYKGRMDYVKSLCGANPAPPEMKFPVKEIEVPKDLPDTFDARTQWPDCPSLKEVRDQGACGSCWAFGCVEAATDRLCIQSKGIVNAHLSAEDLTSCCRTCGNGCNGGFLEGAWNYLKRDGIVTGGPYNSHQGCLPYEIKACDHHVVGKLQPCKGDGPTPRCKKECESGYNNTYSKDEHHAKTVHAVEGVEQIMTEIMTNGPVEAAFTVYSDFPTYKSGVYEHKSGGPLGGHAIKTLGWGNEDGKDYWLVANSWNPDWGDNGFFKILRGRDECGIESNIVAGMMVLE,brenda,B6CPA2,N=C(N)NCCC[C@H](N=C(O)OCc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(O)=Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1.O>>N=C(N)NCCC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)OCc1ccccc1)C(=O)O.Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,277.6,8.188523339749695e-15,37.0,7.3,3.4.22.1,291251.0,2.4434194617828173,N=C(N)NCCC[C@H](N=C(O)OCc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(O)=Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1.O,N=C(N)NCCC[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)OCc1ccccc1)C(=O)O.Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,2.4434194617828173,N=C(N)NCCC[C@H](N=C(O)OCc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(O)=Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1.O__MKALLVLVFVGAAWSYRFDFHDDYFSEAFVNYHNSRDDVSWKATTENFKNVPYKGRMDYVKSLCGANPAPPEMKFPVKEIEVPKDLPDTFDARTQWPDCPSLKEVRDQGACGSCWAFGCVEAATDRLCIQSKGIVNAHLSAEDLTSCCRTCGNGCNGGFLEGAWNYLKRDGIVTGGPYNSHQGCLPYEIKACDHHVVGKLQPCKGDGPTPRCKKECESGYNNTYSKDEHHAKTVHAVEGVEQIMTEIMTNGPVEAAFTVYSDFPTYKSGVYEHKSGGPLGGHAIKTLGWGNEDGKDYWLVANSWNPDWGDNGFFKILRGRDECGIESNIVAGMMVLE,./data/raw/alphafold//AF-B6CPA2-F1-model_v4.pdb,1935,4439,4340,4223
+446,15952,16179,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>>CCC/C=C\C=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],13680.0,7.004084509701497,25.0,10.0,1.1.1.1,9606.0,4.136086097384098,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,CCC/C=C\C=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],4.136086097384098,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
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+455,15522,15746,MSSGIHVALVTGGNKGIGLAIVRDLCRLFSGDVVLTARDVTRGQAAVQQLQAEGLSPRFHQLDIDDLQSIRALRDFLRKEYGGLDVLVNNAGIAFKVADPTPFHIQAEVTMKTNFFGTRDVCTELLPLIKPQGRVVNVSSIMSVRALKSCSPELQQKFRSETITEEELVGLMNKFVEDTKKGVHQKEGWPSSAYGVTKIGVTVLSRIHARKLSEQRKGDKILLNACCPGWVRTDMAGPKATKSPEEGAETPVYLALLPPDAEGPHGQFVSEKRVEQW,sabio,P16152,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=Cc1ccc([N+](=O)[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.O=[N+]([O-])c1ccc(CO)cc1,4.4,6.329621477194912e-15,,7.0,1.1.1.184,9606.0,0.6434526764861874,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=Cc1ccc([N+](=O)[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.O=[N+]([O-])c1ccc(CO)cc1,4.056904851336473,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=Cc1ccc([N+](=O)[O-])cc1.[H]__MSSGIHVALVTGGNKGIGLAIVRDLCRLFSGDVVLTARDVTRGQAAVQQLQAEGLSPRFHQLDIDDLQSIRALRDFLRKEYGGLDVLVNNAGIAFKVADPTPFHIQAEVTMKTNFFGTRDVCTELLPLIKPQGRVVNVSSIMSVRALKSCSPELQQKFRSETITEEELVGLMNKFVEDTKKGVHQKEGWPSSAYGVTKIGVTVLSRIHARKLSEQRKGDKILLNACCPGWVRTDMAGPKATKSPEEGAETPVYLALLPPDAEGPHGQFVSEKRVEQW,./data/raw/alphafold//AF-P16152-F1-model_v4.pdb,1319,3880,4509,857
+456,8415,8546,MTGITRRRLLSLGAGAAFLTAIRPFDSIAQDAHMGHGAASSATATAGRPLPLPPLIEPDASGVVKLKVQTGRHSFEEGSEAASAGINGAYLGPLVRLKNGETVTLSVENGMDEETTLHWHGLFVPSVLDGGPHNLIEAGAEWKPKVTVNQPASFNWFHPHLHGNTARQAHMGIAGLMVVTDGKDAERGLPEDYGVDDIPLVLQDRRVIEGDKVYQPDIMDLMHGFRGDKLIVNGVVSPEARVPVSIVRLRILNGANARNFHVRLSDNRPLLVIASDGGFIGKPEAVERLTISPGERYEVLVDFSKGEAADLLTYGDDSGGDDLHLMRFVVDSTLRGKITAVPDRLDGPDAADEKLSVKRRSFFFDERMAENMKLMMAKPPVDPHAGHNMGNMDMSSMSGAMDHDMHGARTSADAGPALEALTSGVEMAIAGKPFDMDRIDVEAKLGSWEIWDLTTKEMPHPFHIHGASFRILSLNGKAPPAHQSGWKDTALINGKAEILVHFDREGAKSHPFMFHCHVLEHEDVGMMAQFVTV,sabio,A6X5N0,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,0.93,1.4837780463171737,,4.0,1.10.3.2,42190.0,-0.0315170514460648,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,-0.0315170514460648,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O__MTGITRRRLLSLGAGAAFLTAIRPFDSIAQDAHMGHGAASSATATAGRPLPLPPLIEPDASGVVKLKVQTGRHSFEEGSEAASAGINGAYLGPLVRLKNGETVTLSVENGMDEETTLHWHGLFVPSVLDGGPHNLIEAGAEWKPKVTVNQPASFNWFHPHLHGNTARQAHMGIAGLMVVTDGKDAERGLPEDYGVDDIPLVLQDRRVIEGDKVYQPDIMDLMHGFRGDKLIVNGVVSPEARVPVSIVRLRILNGANARNFHVRLSDNRPLLVIASDGGFIGKPEAVERLTISPGERYEVLVDFSKGEAADLLTYGDDSGGDDLHLMRFVVDSTLRGKITAVPDRLDGPDAADEKLSVKRRSFFFDERMAENMKLMMAKPPVDPHAGHNMGNMDMSSMSGAMDHDMHGARTSADAGPALEALTSGVEMAIAGKPFDMDRIDVEAKLGSWEIWDLTTKEMPHPFHIHGASFRILSLNGKAPPAHQSGWKDTALINGKAEILVHFDREGAKSHPFMFHCHVLEHEDVGMMAQFVTV,./data/raw/alphafold//AF-A6X5N0-F1-model_v4.pdb,3416,2308,1018,2914
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+459,21946,22277,MLRGAGVLLHITSLPGGCFVGDLGPEAYKFADSLAYAEQTYWQTLPINHTVPEYENSPYSAVSSYAGDPVLISLELMKRDGLIDSVPQCPPAERADYIKAWEVKRKALEKALKRAGRLSDYRHFKDVTPWLDDYAYYMAMRERFGPWPVWPKEEPPPASLELYKFAQFVFWTQWERFKEYVNSLGIFLIGDLPFYPSLDSVDVWRNKKYFKVGEDGRPLYVAGVPPDYFSATGQLWGNPVYNWEALERDGFKWWVNRLKHAVTVFDYVRLDHFRGYVAYWEVPGGETTAVRGRWAPSPGRRLFEAAAAAVDLGRLIAEDLGYITPEVEALREELGLPGMRVLQFAWDGNPANPHKPHNHVKNAVVYTGTHDNNTAVGWYKEEATARARREFKKYSNCAGEVHWCFIKLAHMSVANVAIVPVQDLLGLGSEARMNRPGTVGGNWKWRLGAQPEPRVWKRLRDVTRTYGR,sabio,Q8ZXM0,O=C[C@H](O)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O[C@H]5O[C@H](CO)[C@@H](O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)CO.O=C[C@H](O)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O[C@H]5O[C@H](CO)[C@@H](O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)CO>>OCC1OC(O)C(O)C(O)C1O,8.7,85.47290885990449,80.0,6.7,2.4.1.25,13773.0,0.9395192526186184,O=C[C@H](O)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O[C@H]5O[C@H](CO)[C@@H](O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)CO.O=C[C@H](O)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O[C@H]5O[C@H](CO)[C@@H](O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)CO,OCC1OC(O)C(O)C(O)C1O,0.9395192526186184,O=C[C@H](O)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O[C@H]5O[C@H](CO)[C@@H](O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)CO.O=C[C@H](O)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O[C@H]5O[C@H](CO)[C@@H](O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)CO__MLRGAGVLLHITSLPGGCFVGDLGPEAYKFADSLAYAEQTYWQTLPINHTVPEYENSPYSAVSSYAGDPVLISLELMKRDGLIDSVPQCPPAERADYIKAWEVKRKALEKALKRAGRLSDYRHFKDVTPWLDDYAYYMAMRERFGPWPVWPKEEPPPASLELYKFAQFVFWTQWERFKEYVNSLGIFLIGDLPFYPSLDSVDVWRNKKYFKVGEDGRPLYVAGVPPDYFSATGQLWGNPVYNWEALERDGFKWWVNRLKHAVTVFDYVRLDHFRGYVAYWEVPGGETTAVRGRWAPSPGRRLFEAAAAAVDLGRLIAEDLGYITPEVEALREELGLPGMRVLQFAWDGNPANPHKPHNHVKNAVVYTGTHDNNTAVGWYKEEATARARREFKKYSNCAGEVHWCFIKLAHMSVANVAIVPVQDLLGLGSEARMNRPGTVGGNWKWRLGAQPEPRVWKRLRDVTRTYGR,./data/raw/alphafold//AF-Q8ZXM0-F1-model_v4.pdb,733,149,5882,6795
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+472,8179,8307,MWFLVLCLALSLGGTGAAPPIQSRIVGGWECEQHSQPWQAALYHFSTFQCGGILVHRQWVLTAAHCISDNYQLWLGRHNLFDDENTAQFVHVSESFPHPGFNMSLLENHTRQADEDYSHDLMLLRLTEPADTITDAVKVVELPTEEPEVGSTCLASGWGSIEPENFSFPDDLQCVDLKILPNDECKKAHVQKVTDFMLCVGHLEGGKDTCVGDSGGPLMCDGVLQGVTSWGYVPCGTPNKPSVAVRVLSYVKWIEDTIAENS,brenda,P06870,CC[C@H](C)[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](CO)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)=N[C@@H](CCC(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O.O>>CC[C@H](C)[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H](N)CO)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].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)O,4.6,0.0297491277822035,37.0,7.5,3.4.21.35,9606.0,0.6627578316815741,CC[C@H](C)[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](CO)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)=N[C@@H](CCC(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O.O,CC[C@H](C)[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H](N)CO)C(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].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)O,0.6627578316815741,CC[C@H](C)[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CC(C)C)N=C(O)[C@H](CO)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)=N[C@@H](CCC(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O.O__MWFLVLCLALSLGGTGAAPPIQSRIVGGWECEQHSQPWQAALYHFSTFQCGGILVHRQWVLTAAHCISDNYQLWLGRHNLFDDENTAQFVHVSESFPHPGFNMSLLENHTRQADEDYSHDLMLLRLTEPADTITDAVKVVELPTEEPEVGSTCLASGWGSIEPENFSFPDDLQCVDLKILPNDECKKAHVQKVTDFMLCVGHLEGGKDTCVGDSGGPLMCDGVLQGVTSWGYVPCGTPNKPSVAVRVLSYVKWIEDTIAENS,./data/raw/alphafold//AF-P06870-F1-model_v4.pdb,3382,2262,3954,2834
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+497,8711,8848,MTVKLKKPKKYAVAKNATLLAAFGLIGSLSLAKANDELIKLEKEPGQWVMQNKNYANTRYSELNQINTKNVSRLRLAWSFSTGALRGHEGGPLVVGTTMYVHSAYPNHVYALDLTQKPYAIKWQYTPVQNSQAVAVACCDVVNRGLAYANGKIFMTTLDGQIIALDANTGKELWKMKHADVTKGETITGAPLVVKDKVLVGVSGGEFGVRGRVGAYDINTGNRVWLAYSQGPDEEVLLDSDFNKEFPQHGGPGDGTKTWPGEQWKLGGGTTWGWYSYDPALDLFYYGTSNPGTWNAEQRKGGDNKWSCTIFARRPDTGKARWAYQMTPWDSWDYDGVNEMILPDLTVKGKKTPCLVHFDRNGFGYVLDRRTGQLIEAQPFVYVNWAKEISKENDRPVEIPEKRTKQGVDTKGICPNSMGGKDQQPAAFSPQTGLFYVPTNNMCMNYEGVEATYTAGAPYVGANVLMYSGHEGKDDYYGAFICYDALKGKRVWEIHEHFPVWSGPVVTAGGLAFYGTMDGWFKAVDIKTGKVLWQQKLGSGIIGNPITFLGPDKKQYVAVYSGVGGWFGIAVAQNLPPDDPYAGLGAVGVAYQAGLPKATTVGGELYVFALE,sabio,I0JWN7,CO.CO>>C=O.C=O,0.2,3.2220943613348707,45.0,7.2,1.1.2.8,591154.0,-0.6989700043360187,CO.CO,C=O.C=O,-0.6989700043360187,CO.CO__MTVKLKKPKKYAVAKNATLLAAFGLIGSLSLAKANDELIKLEKEPGQWVMQNKNYANTRYSELNQINTKNVSRLRLAWSFSTGALRGHEGGPLVVGTTMYVHSAYPNHVYALDLTQKPYAIKWQYTPVQNSQAVAVACCDVVNRGLAYANGKIFMTTLDGQIIALDANTGKELWKMKHADVTKGETITGAPLVVKDKVLVGVSGGEFGVRGRVGAYDINTGNRVWLAYSQGPDEEVLLDSDFNKEFPQHGGPGDGTKTWPGEQWKLGGGTTWGWYSYDPALDLFYYGTSNPGTWNAEQRKGGDNKWSCTIFARRPDTGKARWAYQMTPWDSWDYDGVNEMILPDLTVKGKKTPCLVHFDRNGFGYVLDRRTGQLIEAQPFVYVNWAKEISKENDRPVEIPEKRTKQGVDTKGICPNSMGGKDQQPAAFSPQTGLFYVPTNNMCMNYEGVEATYTAGAPYVGANVLMYSGHEGKDDYYGAFICYDALKGKRVWEIHEHFPVWSGPVVTAGGLAFYGTMDGWFKAVDIKTGKVLWQQKLGSGIIGNPITFLGPDKKQYVAVYSGVGGWFGIAVAQNLPPDDPYAGLGAVGVAYQAGLPKATTVGGELYVFALE,./data/raw/alphafold//AF-I0JWN7-F1-model_v4.pdb,3497,3414,1152,3071
+498,21853,22179,MKKILIINGPNLNLLGTREKEVYGTETLDDIAKKVAEEAAKLNVNIEFFQSNHEGDIIDKIHAARGNTDAIIINPGAYTHYSIAIRDAIKAVEIPTIEIHLSNIHAREEFRSHSVIAPVCVGQICGFGSNSYILGLNAAALL,brenda,G8M0G7,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)C1,59.61,7.453857947349876e-15,60.0,6.5,4.2.1.10,288965.0,1.7753191218294777,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)C1,1.7753191218294777,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O__MKKILIINGPNLNLLGTREKEVYGTETLDDIAKKVAEEAAKLNVNIEFFQSNHEGDIIDKIHAARGNTDAIIINPGAYTHYSIAIRDAIKAVEIPTIEIHLSNIHAREEFRSHSVIAPVCVGQICGFGSNSYILGLNAAALL,./data/raw/alphafold//AF-G8M0G7-F1-model_v4.pdb,721,119,5842,6751
+499,22654,22993,MSQCCCLSPQEERLQGTKKVNRQGRERVYKILDRIQFTVPHVDIERARYFTESMRQTEGELLTLRWAKALKNVAEKMTVYITPDQLLAGRVGQLGRYGILYPEIDGDFYIEVMKDLPNREKSPFQIDPTDMQILMEEIAPYWEGKTYHEHLNKVLPAEIRGVTYHDERGLKSKFVVSETSSYRSALQWVPDYEKAMKRGFIDIQNEAKAKLAGLDLTNSVDIWEKKPFLEAMIIVCDAIMIWAKRHAQLARDTAAATSDPVRKQELLRMADICEHVPAYPARNFREAVQCQWFVQMFSRIEQKASAIISNGRMDQYLYPYYKKDIEEGTLTSEEAKELLECMWVDMAQFIDLYINPTGNEFQEGYAHWEAVTVGGQTPEGEDATNELSYLFLESKREFPMTYPDLAVRIHSRTPDRFLYEIALTVQDGSGFPKLINDEEVVPLNAIKGCPINEALDYAISGCTETRMPNRDTYTSGCVYINFATALEMLMNNGRLHYYGDELIGLETGDPTRFQTWEEFYEAYKAQHINLLQKAFQQQHIVDRLRPQHFAAPLSSVLHNLCMKNMQDLHSEKIEGGVDYSYFEFLGYATVVDSLAAIKKLVFEEKRLTMREVLDAMNANFVGYEPIQEMLKNAPCYGNNDPYADSIAKDVDRFTQVEAEKSSRDRGIHVDVRYVPITSHVPFGKIIAATPNGRVAGFPLADGSSASHGADHNGPTAVLLSNYHSKNYGMINRASRLLNIKLSPKCVAGEQGAKKIMSIIRTWCDLKLWHLQFNIVNRDTLLAAQKDPNSYRNLIVRVAGYSAYFCDMSPDLQNDIIDRTEHADL,brenda,E5Y7I4,O=S(=O)(O)C[C@@H](O)CO>>CC(=O)CO.O=S([O-])[O-],26.0,0.6476026495171865,23.0,7.5,4.4.1.41,35833.0,1.414973347970818,O=S(=O)(O)C[C@@H](O)CO,CC(=O)CO.O=S([O-])[O-],1.414973347970818,O=S(=O)(O)C[C@@H](O)CO__MSQCCCLSPQEERLQGTKKVNRQGRERVYKILDRIQFTVPHVDIERARYFTESMRQTEGELLTLRWAKALKNVAEKMTVYITPDQLLAGRVGQLGRYGILYPEIDGDFYIEVMKDLPNREKSPFQIDPTDMQILMEEIAPYWEGKTYHEHLNKVLPAEIRGVTYHDERGLKSKFVVSETSSYRSALQWVPDYEKAMKRGFIDIQNEAKAKLAGLDLTNSVDIWEKKPFLEAMIIVCDAIMIWAKRHAQLARDTAAATSDPVRKQELLRMADICEHVPAYPARNFREAVQCQWFVQMFSRIEQKASAIISNGRMDQYLYPYYKKDIEEGTLTSEEAKELLECMWVDMAQFIDLYINPTGNEFQEGYAHWEAVTVGGQTPEGEDATNELSYLFLESKREFPMTYPDLAVRIHSRTPDRFLYEIALTVQDGSGFPKLINDEEVVPLNAIKGCPINEALDYAISGCTETRMPNRDTYTSGCVYINFATALEMLMNNGRLHYYGDELIGLETGDPTRFQTWEEFYEAYKAQHINLLQKAFQQQHIVDRLRPQHFAAPLSSVLHNLCMKNMQDLHSEKIEGGVDYSYFEFLGYATVVDSLAAIKKLVFEEKRLTMREVLDAMNANFVGYEPIQEMLKNAPCYGNNDPYADSIAKDVDRFTQVEAEKSSRDRGIHVDVRYVPITSHVPFGKIIAATPNGRVAGFPLADGSSASHGADHNGPTAVLLSNYHSKNYGMINRASRLLNIKLSPKCVAGEQGAKKIMSIIRTWCDLKLWHLQFNIVNRDTLLAAQKDPNSYRNLIVRVAGYSAYFCDMSPDLQNDIIDRTEHADL,./data/raw/alphafold//AF-E5Y7I4-F1-model_v4.pdb,817,263,6015,6944
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+546,9423,9565,MTTGKGKILILGATGYLGKYMVKASISLGHPTYAYVMPLKKNSDDSKLQLLKEFESLGVTIFYGELSEHDKLVAVFKEVDIVISTLAVPQYLEQLKVIEAIKEAGNIKRFVPSEFGNEVDRVRALPRFQAVLDNKKKIRRATEAAGIPFTFVSANSLTAYFVDYLLHPRQKSEQVTIYGSGDAKAVLNYEEDVAAYTIKAADDPRAANRVLIIKPPKNIVSQLDLVSSWEKTTGSTLKMTHISEQEIIKLSESINFPENIHASILHNIFIAGAQLSFELTQDHDLEASELYPNYNYTSVDEYLKICLVNPPKPKLATYAQPST,sabio,Q15GI3,COc1cc(/C=C/COC(C)=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>>CC(=O)O.CC=Cc1ccc(O)c(OC)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)c1,0.3,0.0520301568440779,28.0,6.5,1.-.-.-,4102.0,-0.5228787452803376,COc1cc(/C=C/COC(C)=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,CC(=O)O.CC=Cc1ccc(O)c(OC)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,-0.5228787452803376,COc1cc(/C=C/COC(C)=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__MTTGKGKILILGATGYLGKYMVKASISLGHPTYAYVMPLKKNSDDSKLQLLKEFESLGVTIFYGELSEHDKLVAVFKEVDIVISTLAVPQYLEQLKVIEAIKEAGNIKRFVPSEFGNEVDRVRALPRFQAVLDNKKKIRRATEAAGIPFTFVSANSLTAYFVDYLLHPRQKSEQVTIYGSGDAKAVLNYEEDVAAYTIKAADDPRAANRVLIIKPPKNIVSQLDLVSSWEKTTGSTLKMTHISEQEIIKLSESINFPENIHASILHNIFIAGAQLSFELTQDHDLEASELYPNYNYTSVDEYLKICLVNPPKPKLATYAQPST,./data/raw/alphafold//AF-Q15GI3-F1-model_v4.pdb,3545,3492,1254,3197
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+565,12807,12979,MSSTHQLVSSMISSSSSTFLAPSNFNLRTRNACLPMAKRVNTCKCVATPQEKIEYKTKVSRNSNMSKLQAGYLFPEIARRRSAHLLKYPDAQVISLGIGDTTEPIPEVITSAMAKKAHELSTIEGYSGYGAEQGAKPLRAAIAKTFYGGLGIGDDDVFVSDGAKCDISRLQVMFGSNVTIAVQDPSYPAYVDSSVIMGQTGQFNTDVQKYGNIEYMRCTPENGFFPDLSTVGRTDIIFFCSPNNPTGAAATREQLTQLVEFAKKNGSIIVYDSAYAMYMSDDNPRSIFEIPGAEEVAMETASFSKYAGFTGVRLGWTVIPKKLLYSDGFPVAKDFNRIICTCFNGASNISQAGALACLTPEGLEAMHKVIGFYKENTNIIIDTFTSLGYDVYGGKNAPYVWVHFPNQSSWDVFAEILEKTHVVTTPGSGFGPGGEGFVRVSAFGHRENILEACRRFKQLYK,sabio,Q93ZN9,N=C(N)NCCCC(N)C(=O)O.O=C(O)CCC(=O)C(=O)O>>N=C(N)NCCCC(=O)C(=O)O.NC(CCC(=O)O)C(=O)O,0.69,0.0,37.0,8.0,2.6.1.-,3702.0,-0.1611509092627447,N=C(N)NCCCC(N)C(=O)O.O=C(O)CCC(=O)C(=O)O,N=C(N)NCCCC(=O)C(=O)O.NC(CCC(=O)O)C(=O)O,-0.1611509092627447,N=C(N)NCCCC(N)C(=O)O.O=C(O)CCC(=O)C(=O)O__MSSTHQLVSSMISSSSSTFLAPSNFNLRTRNACLPMAKRVNTCKCVATPQEKIEYKTKVSRNSNMSKLQAGYLFPEIARRRSAHLLKYPDAQVISLGIGDTTEPIPEVITSAMAKKAHELSTIEGYSGYGAEQGAKPLRAAIAKTFYGGLGIGDDDVFVSDGAKCDISRLQVMFGSNVTIAVQDPSYPAYVDSSVIMGQTGQFNTDVQKYGNIEYMRCTPENGFFPDLSTVGRTDIIFFCSPNNPTGAAATREQLTQLVEFAKKNGSIIVYDSAYAMYMSDDNPRSIFEIPGAEEVAMETASFSKYAGFTGVRLGWTVIPKKLLYSDGFPVAKDFNRIICTCFNGASNISQAGALACLTPEGLEAMHKVIGFYKENTNIIIDTFTSLGYDVYGGKNAPYVWVHFPNQSSWDVFAEILEKTHVVTTPGSGFGPGGEGFVRVSAFGHRENILEACRRFKQLYK,./data/raw/alphafold//AF-Q93ZN9-F1-model_v4.pdb,2763,3831,1648,794
+566,9009,9151,MRDTRFPCLCGIAASTLLFATTPAIAGEAPADRLKALVDAAVQPVMKANDIPGLAVAISLKGEPHYFSYGLASKEDGRRVTPETLFEIGSVSKTFTATLAGYALTQDKMRLDDRASQHWPALQGSRFDGISLLDLATYTAGGLPLQFPDSVQKDQAQIRDYYRQWQPTYAPGSQRLYSNPSIGLFGYLAARSLGQPFERLMEQQVFPALGLEQTHLDVPEAALAQYAQGYGKDDRPLRVGPGPLDAEGYGVKTSAADLLRFVDANLHPERLDRPWAQALDATHRGYYKVGDMTQGLGWEAYDWPISLKRLQAGNSTPMALQPHRIARLPAPQALEGQRLLNKTGSTNGFGAYVAFVPGRDLGLVILANRNYPNAERVKIAYAILSGLEQQGKVPLKR,sabio,P24735,COC1(NC(=O)Cc2cccs2)C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC21.O>>,0.12,99.77602329357748,,8.2,3.5.2.6,287.0,-0.9208187539523752,COC1(NC(=O)Cc2cccs2)C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC21.O,,-0.9208187539523752,COC1(NC(=O)Cc2cccs2)C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC21.O__MRDTRFPCLCGIAASTLLFATTPAIAGEAPADRLKALVDAAVQPVMKANDIPGLAVAISLKGEPHYFSYGLASKEDGRRVTPETLFEIGSVSKTFTATLAGYALTQDKMRLDDRASQHWPALQGSRFDGISLLDLATYTAGGLPLQFPDSVQKDQAQIRDYYRQWQPTYAPGSQRLYSNPSIGLFGYLAARSLGQPFERLMEQQVFPALGLEQTHLDVPEAALAQYAQGYGKDDRPLRVGPGPLDAEGYGVKTSAADLLRFVDANLHPERLDRPWAQALDATHRGYYKVGDMTQGLGWEAYDWPISLKRLQAGNSTPMALQPHRIARLPAPQALEGQRLLNKTGSTNGFGAYVAFVPGRDLGLVILANRNYPNAERVKIAYAILSGLEQQGKVPLKR,./data/raw/alphafold//AF-P24735-F1-model_v4.pdb,1456,976,783,1089
+567,19544,19830,MPFHAEPLKPSDEIDMDLGHSVAAQKFKEIREVLEGNRYWARKVTSEEPEFMAEQVKGQAPNFLWIGCADSRVPEVTIMARKPGDVFVQRNVANQFKPEDDSSQALLNYAIMNVGVTHVMVVGHTGCGGCIAAFDQPLPTEENPGGTPLVRYLEPIIRLKHSLPEGSDVNDLIKENVKMAVKNVVNSPTIQGAWEQARKGEFREVFVHGWLYDLSTGNIVDLNVTQGPHPFVDDRVPRA,sabio,Q3I4V7,O.O=C=O>>O=C(O)O,390000.0,5.682159936665122e-15,25.0,,4.2.1.1,5207.0,5.5910646070265,O.O=C=O,O=C(O)O,5.832508912706237,O.O=C=O__MPFHAEPLKPSDEIDMDLGHSVAAQKFKEIREVLEGNRYWARKVTSEEPEFMAEQVKGQAPNFLWIGCADSRVPEVTIMARKPGDVFVQRNVANQFKPEDDSSQALLNYAIMNVGVTHVMVVGHTGCGGCIAAFDQPLPTEENPGGTPLVRYLEPIIRLKHSLPEGSDVNDLIKENVKMAVKNVVNSPTIQGAWEQARKGEFREVFVHGWLYDLSTGNIVDLNVTQGPHPFVDDRVPRA,./data/raw/alphafold//AF-Q3I4V7-F1-model_v4.pdb,299,2839,5161,6024
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+585,11964,12124,MKRFIVLALCMLMVLETTKGLDFHNKDVESENSLWELYERWRSHHTVARSLEEKAKRFNVFKHNVKHIHETNKKDKSYKLKLNKFGDMTSEEFRRTYAGSNIKHHRMFQGEKKATKSFMYANVNTLPTSVDWRKNGAVTPVKNQGQCGSCWAFSTVVAVEGINQIRTKKLTSLSEQELVDCDTNQNQGCNGGLMDLAFEFIKEKGGLTSELVYPYKASDETCDTNKENAPVVSIDGHEDVPKNSEDDLMKAVANQPVSVAIDAGGSDFQFYSEGVFTGRCGTELNHGVAVVGYGTTIDGTKYWIVKNSWGEEWGEKGYIRMQRGIRHKEGLCGIAMEASYPLKNSNTNPSRLSLDSLKDEL,sabio,Q9FGR9,Cc1cc(=O)oc2cc(NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc3ccccc3)NC(=O)OCc3ccccc3)ccc12.O>>Cc1cc(=O)oc2cc(N)ccc12,0.00611,56.45324201965823,25.0,,3.4.22.-,3702.0,-2.213958789757446,Cc1cc(=O)oc2cc(NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc3ccccc3)NC(=O)OCc3ccccc3)ccc12.O,Cc1cc(=O)oc2cc(N)ccc12,-2.213958789757446,Cc1cc(=O)oc2cc(NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc3ccccc3)NC(=O)OCc3ccccc3)ccc12.O__MKRFIVLALCMLMVLETTKGLDFHNKDVESENSLWELYERWRSHHTVARSLEEKAKRFNVFKHNVKHIHETNKKDKSYKLKLNKFGDMTSEEFRRTYAGSNIKHHRMFQGEKKATKSFMYANVNTLPTSVDWRKNGAVTPVKNQGQCGSCWAFSTVVAVEGINQIRTKKLTSLSEQELVDCDTNQNQGCNGGLMDLAFEFIKEKGGLTSELVYPYKASDETCDTNKENAPVVSIDGHEDVPKNSEDDLMKAVANQPVSVAIDAGGSDFQFYSEGVFTGRCGTELNHGVAVVGYGTTIDGTKYWIVKNSWGEEWGEKGYIRMQRGIRHKEGLCGIAMEASYPLKNSNTNPSRLSLDSLKDEL,./data/raw/alphafold//AF-Q9FGR9-F1-model_v4.pdb,1940,4088,1944,3780
+586,18090,18344,MGQEKLYIEKELSWLSFNERVLQEAADKSNPLIERMRFLGIYSNNLDEFYKVRFAELKRRIIISEEQGSNSHSRHLLGKIQSRVLKADQEFDGLYNELLLEMARNQIFLINERQLSVNQQNWLRHYFKQYLRQHITPILINPDTDLVQFLKDDYTYLAVEIIRGDTIRYALLEIPSDKVPRFVNLPPEAPRRRKPMILLDNILRYCLDDIFKGFFDYDALNAYSMKMTRDAEYDLVHEMEASLMELMSSSLKQRLTAEPVRFVYQRDMPNALVEVLREKLTISRYDSIVPGGRYHNFKDFINFPNVGKANLVNKPLPRLRHIWFDKAQFRNGFDAIRERDVLLYYPYHTFEHVLELLRQASFDPSVLAIKINIYRVAKDSRIIDSMIHAAHNGKKVTVVVELQARFDEEANIHWAKRLTEAGVHVIFSAPGLKIHAKLFLISRKENGEVVRYAHIGTGNFNEKTARLYTDYSLLTADARITNEVRRVFNFIENPYRPVTFDYLMVSPQNSRRLLYEMVDREIANAQQGLPSGITLKLNNLVDKGLVDRLYAASSSGVPVNLLVRGMCSLIPNLEGISDNIRAISIVDRYLEHDRVYIFENGGDKKVYLSSADWMTRNIDYRIEVATPLLDPRLKQRVLDIIDILFSDTVKARYIDKELSNRYVPRGNRRKVRAQLAIYDYIKSLEQPE,sabio,P0A7B1,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,37800.0,8.550382997375417,37.0,,2.7.4.1,562.0,4.577491799837225,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,4.577491799837225,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O__MGQEKLYIEKELSWLSFNERVLQEAADKSNPLIERMRFLGIYSNNLDEFYKVRFAELKRRIIISEEQGSNSHSRHLLGKIQSRVLKADQEFDGLYNELLLEMARNQIFLINERQLSVNQQNWLRHYFKQYLRQHITPILINPDTDLVQFLKDDYTYLAVEIIRGDTIRYALLEIPSDKVPRFVNLPPEAPRRRKPMILLDNILRYCLDDIFKGFFDYDALNAYSMKMTRDAEYDLVHEMEASLMELMSSSLKQRLTAEPVRFVYQRDMPNALVEVLREKLTISRYDSIVPGGRYHNFKDFINFPNVGKANLVNKPLPRLRHIWFDKAQFRNGFDAIRERDVLLYYPYHTFEHVLELLRQASFDPSVLAIKINIYRVAKDSRIIDSMIHAAHNGKKVTVVVELQARFDEEANIHWAKRLTEAGVHVIFSAPGLKIHAKLFLISRKENGEVVRYAHIGTGNFNEKTARLYTDYSLLTADARITNEVRRVFNFIENPYRPVTFDYLMVSPQNSRRLLYEMVDREIANAQQGLPSGITLKLNNLVDKGLVDRLYAASSSGVPVNLLVRGMCSLIPNLEGISDNIRAISIVDRYLEHDRVYIFENGGDKKVYLSSADWMTRNIDYRIEVATPLLDPRLKQRVLDIIDILFSDTVKARYIDKELSNRYVPRGNRRKVRAQLAIYDYIKSLEQPE,./data/raw/alphafold//AF-P0A7B1-F1-model_v4.pdb,2848,2428,2707,5548
+587,22738,23078,MMARNVLVSGGAGYIGSHTVLQLLLGGYSVVVVDNLDNSSAVSLQRVKKLAAEHGERLSFHQVDLRDRSALEKIFSETKFDAVIHFAGLKAVGESVEKPLLYYNNNLVGTITLLEVMAQHGCKNLVFSSSATVYGSPKEVPCTEEFPISALNPYGRTKLFIEEICRDVYGSDPEWKIILLRYFNPVGAHPSGDIGEDPRGIPNNLMPFVQQVAVGRRPHLTVFGNDYNTKDGTGVRDYIHVIDLADGHIAALRKLEDCKIGCEVYNLGTGNGTSVLEMVDAFEKASGKKIPLVIAGRRPGDAEVVYASTERAESELNWKAKYGIEEMCRDLWNWASNNPYGYDSSSEDNSH,sabio,Q9SN58,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1>>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,33.0,1.0028796451107796e-14,25.0,7.4,5.1.3.2,3702.0,1.5185139398778875,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1,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,1.5185139398778875,O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1__MMARNVLVSGGAGYIGSHTVLQLLLGGYSVVVVDNLDNSSAVSLQRVKKLAAEHGERLSFHQVDLRDRSALEKIFSETKFDAVIHFAGLKAVGESVEKPLLYYNNNLVGTITLLEVMAQHGCKNLVFSSSATVYGSPKEVPCTEEFPISALNPYGRTKLFIEEICRDVYGSDPEWKIILLRYFNPVGAHPSGDIGEDPRGIPNNLMPFVQQVAVGRRPHLTVFGNDYNTKDGTGVRDYIHVIDLADGHIAALRKLEDCKIGCEVYNLGTGNGTSVLEMVDAFEKASGKKIPLVIAGRRPGDAEVVYASTERAESELNWKAKYGIEEMCRDLWNWASNNPYGYDSSSEDNSH,./data/raw/alphafold//AF-Q9SN58-F1-model_v4.pdb,2955,278,6030,6963
+588,7938,8066,MAKLIALTLLGMGLALFRNHQSSYQTRLNALREVQPVELPNCNLVKGIETGSEDLEILPNGLAFISSGLKYPGIKSFNPNSPGKILLMDLNEEDPTVLELGITGSKFDVSSFNPHGISTFTDEDNAMYLLVVNHPDAKSTVELFKFQEEEKSLLHLKTIRHKLLPNLNDIVAVGPEHFYGTNDHYFLDPYLQSWEMYLGLAWSYVVYYSPSEVRVVAEGFDFANGINISPDGKYVYIAELLAHKIHVYEKHANWTLTPLKSLDFNTLVDNISVDPETGDLWVGCHPNGMKIFFYDSENPPASEVLRIQNILTEEPKVTQVYAENGTVLQGSTVASVYKGKLLIGTVFHKALYCEL,brenda,P27169,CCOP(=O)(OCC)Oc1ccc([N+](=O)[O-])cc1.O>>CCOP(=O)(O)OCC.O=[N+]([O-])c1ccc(O)cc1,3.3,0.0,37.25,7.9125,3.1.8.1,9606.0,0.5185139398778875,CCOP(=O)(OCC)Oc1ccc([N+](=O)[O-])cc1.O,CCOP(=O)(O)OCC.O=[N+]([O-])c1ccc(O)cc1,0.7634279935629373,CCOP(=O)(OCC)Oc1ccc([N+](=O)[O-])cc1.O__MAKLIALTLLGMGLALFRNHQSSYQTRLNALREVQPVELPNCNLVKGIETGSEDLEILPNGLAFISSGLKYPGIKSFNPNSPGKILLMDLNEEDPTVLELGITGSKFDVSSFNPHGISTFTDEDNAMYLLVVNHPDAKSTVELFKFQEEEKSLLHLKTIRHKLLPNLNDIVAVGPEHFYGTNDHYFLDPYLQSWEMYLGLAWSYVVYYSPSEVRVVAEGFDFANGINISPDGKYVYIAELLAHKIHVYEKHANWTLTPLKSLDFNTLVDNISVDPETGDLWVGCHPNGMKIFFYDSENPPASEVLRIQNILTEEPKVTQVYAENGTVLQGSTVASVYKGKLLIGTVFHKALYCEL,./data/raw/alphafold//AF-P27169-F1-model_v4.pdb,1506,1056,381,432
+589,12286,12455,MAARRGALIVLEGVDRAGKSTQSRKLVEALCAAGHRAELLRFPERSTEIGKLLSSYLQKKSDVEDHSVHLLFSANRWEQVPLIKEKLSQGVTLVVDRYAFSGVAFTGAKENFSLDWCKQPDVGLPKPDLVLFLQLQLADAAKRGAFGHERYENGAFQERALRCFHQLMKDTTLNWKMVDASKSIEAVHEDIRVLSEDAIRTATEKPLGELWK,brenda,P23919,Cc1cn([C@H]2C[C@H](F)[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]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](F)[C@H]2O)c(=O)nc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.03,0.9524546588362076,25.0,7.5,2.7.4.9,9606.0,-1.5228787452803376,Cc1cn([C@H]2C[C@H](F)[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]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](F)[C@H]2O)c(=O)nc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-1.5228787452803376,Cc1cn([C@H]2C[C@H](F)[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__MAARRGALIVLEGVDRAGKSTQSRKLVEALCAAGHRAELLRFPERSTEIGKLLSSYLQKKSDVEDHSVHLLFSANRWEQVPLIKEKLSQGVTLVVDRYAFSGVAFTGAKENFSLDWCKQPDVGLPKPDLVLFLQLQLADAAKRGAFGHERYENGAFQERALRCFHQLMKDTTLNWKMVDASKSIEAVHEDIRVLSEDAIRTATEKPLGELWK,./data/raw/alphafold//AF-P23919-F1-model_v4.pdb,143,4175,4043,3890
+590,21409,21733,MEANGLGPQGFPELKNDTFLRAAWGEETDYTPVWCMRQAGRYLPEFRETRAAQDFFSTCRSPEACCELTLQPLRRFPLDAAIIFSDILVVPQALGMEVTMVPGKGPSFPEPLREEQDLERLRDPEVVASELGYVFQAITLTRQRLAGRVPLIGFAGAPWTLMTYMVEGGGSSTMAQAKRWLYQRPQASHQLLRILTDALVPYLVGQVVAGAQALQLFESHAGHLGPQLFNKFALPYIRDVAKQVKARLREAGLAPVPMIIFAKDGHFALEELAQAGYEVVGLDWTVAPKKARECVGKTVTLQGNLDPCALYASEEEIGQLVKQMLDDFGPHRYIANLGHGLYPDMDPEHVGAFVDAVHKHSRLLRQN,brenda,P06132,O=C(O)CCc1c2[nH]c(c1CC(=O)O)Cc1[nH]c(c(CC(=O)O)c1CCC(=O)O)Cc1[nH]c(c(CC(=O)O)c1CCC(=O)O)Cc1[nH]c(c(CCC(=O)O)c1CC(=O)O)C2>>Cc1c2[nH]c(c1CCC(=O)O)Cc1[nH]c(c(CC(=O)O)c1CCC(=O)O)Cc1[nH]c(c(CCC(=O)O)c1CC(=O)O)Cc1[nH]c(c(CCC(=O)O)c1CC(=O)O)C2.O=C=O,0.317,6.788862690349984e-15,37.0,6.133333333333333,4.1.1.37,9606.0,-0.4989407377822485,O=C(O)CCc1c2[nH]c(c1CC(=O)O)Cc1[nH]c(c(CC(=O)O)c1CCC(=O)O)Cc1[nH]c(c(CC(=O)O)c1CCC(=O)O)Cc1[nH]c(c(CCC(=O)O)c1CC(=O)O)C2,Cc1c2[nH]c(c1CCC(=O)O)Cc1[nH]c(c(CC(=O)O)c1CCC(=O)O)Cc1[nH]c(c(CCC(=O)O)c1CC(=O)O)Cc1[nH]c(c(CCC(=O)O)c1CC(=O)O)C2.O=C=O,-0.4989407377822485,O=C(O)CCc1c2[nH]c(c1CC(=O)O)Cc1[nH]c(c(CC(=O)O)c1CCC(=O)O)Cc1[nH]c(c(CC(=O)O)c1CCC(=O)O)Cc1[nH]c(c(CCC(=O)O)c1CC(=O)O)C2__MEANGLGPQGFPELKNDTFLRAAWGEETDYTPVWCMRQAGRYLPEFRETRAAQDFFSTCRSPEACCELTLQPLRRFPLDAAIIFSDILVVPQALGMEVTMVPGKGPSFPEPLREEQDLERLRDPEVVASELGYVFQAITLTRQRLAGRVPLIGFAGAPWTLMTYMVEGGGSSTMAQAKRWLYQRPQASHQLLRILTDALVPYLVGQVVAGAQALQLFESHAGHLGPQLFNKFALPYIRDVAKQVKARLREAGLAPVPMIIFAKDGHFALEELAQAGYEVVGLDWTVAPKKARECVGKTVTLQGNLDPCALYASEEEIGQLVKQMLDDFGPHRYIANLGHGLYPDMDPEHVGAFVDAVHKHSRLLRQN,./data/raw/alphafold//AF-P06132-F1-model_v4.pdb,643,19,5725,6627
+591,13162,13337,MSYQSLKNKVVIVTGAGSGIGRAIAKKFALNDSIVVAVELLEDRLNQIVQELRGMGKEVLGVKADVSKKKDVEEFVRRTFETYSRIDVLCNNAGIMDGVTPVAEVSDELWERVLAVNLYSAFYSSRAVIPIMLKQGKGVIVNTASIAGIRGGFAGAPYTVAKHGLIGLTRSIAAHYGDQGIRAVAVLPGTVKTNIGLGSSKPSELGMRTLTKLMSLSSRLAEPEDIANVIVFLASDEASFVNGDAVVVDGGLTVL,brenda,Q4J9F2,N=C(O)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(c1ccccc1)C(Cl)Cl.[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.OC(c1ccccc1)C(Cl)Cl,0.65,0.0,65.0,5.0,1.1.1.1,2285.0,-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=C(c1ccccc1)C(Cl)Cl.[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.OC(c1ccccc1)C(Cl)Cl,-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=C(c1ccccc1)C(Cl)Cl.[H+]__MSYQSLKNKVVIVTGAGSGIGRAIAKKFALNDSIVVAVELLEDRLNQIVQELRGMGKEVLGVKADVSKKKDVEEFVRRTFETYSRIDVLCNNAGIMDGVTPVAEVSDELWERVLAVNLYSAFYSSRAVIPIMLKQGKGVIVNTASIAGIRGGFAGAPYTVAKHGLIGLTRSIAAHYGDQGIRAVAVLPGTVKTNIGLGSSKPSELGMRTLTKLMSLSSRLAEPEDIANVIVFLASDEASFVNGDAVVVDGGLTVL,./data/raw/alphafold//AF-Q4J9F2-F1-model_v4.pdb,1315,3873,6190,844
+592,1885,1916,MNNIWWQTKGQGNVHLVLLHGWGLNAEVWRCIDEELSSHFTLHLVDLPGFGRSRGFGALSLADMAEAVLQQAPDKAIWLGWSLGGLVASQIALTHPERVQALVTVASSPCFSARDEWPGIKPDVLAGFQQQLSDDFQRTVERFLALQTMGTETARQDARALKKTVLALPMPEVDVLNGGLEILKTVDLRQPLQNVSMPFLRLYGYLDGLVPRKVVPMLDKLWPHSESYIFAKAAHAPFISHPAEFCHLLVALKQRV,brenda,P13001,CC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CC(=O)O.O=[N+]([O-])c1ccc(O)cc1,18.5,0.0,37.0,7.5,3.1.1.1,562.0,1.2671717284030135,CC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CC(=O)O.O=[N+]([O-])c1ccc(O)cc1,1.2671717284030135,CC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MNNIWWQTKGQGNVHLVLLHGWGLNAEVWRCIDEELSSHFTLHLVDLPGFGRSRGFGALSLADMAEAVLQQAPDKAIWLGWSLGGLVASQIALTHPERVQALVTVASSPCFSARDEWPGIKPDVLAGFQQQLSDDFQRTVERFLALQTMGTETARQDARALKKTVLALPMPEVDVLNGGLEILKTVDLRQPLQNVSMPFLRLYGYLDGLVPRKVVPMLDKLWPHSESYIFAKAAHAPFISHPAEFCHLLVALKQRV,./data/raw/alphafold//AF-P13001-F1-model_v4.pdb,1491,1039,865,1195
+593,6333,6443,MDIPIPTRQLFINGDWKAPVLNKRIPVINPATQNIIGDIPAATKEDVDVAVAAAKTALTRNKGADWATASGAVRARYLRAIAAKVTEKKPELAKLESIDCGKPLDEAAWDIDDVAGCFEYYADLAEKLDARQKAPVSLPMDTFKSHVLREPIGVVGLITPWNYPMLMATWKVAPALAAGCAAILKPSELASLTCLELGEICKEVGLPPGVLNILTGLGPEAGAPLATHPDVDKVAFTGSSATGSKIMTAAAQLVKPVSLELGGKSPLVVFEDVDLDKAAEWAIFGCFWTNGQICSATSRLILHESIATEFLNRIVKWIKNIKISDPLEEGCRLGPVVSEGQYEKILKFVSNAKSEGATILTGGSRPEHLKKGFFIEPTIITDVTTNMQIWREEVFGPVLCVKTFSTEEEAIDLANDTVYGLGAAVISNDLERCERVTKAFKAGIVWVNCSQPCFTQAPWGGVKRSGFGRELGEWGLDNYLSVKQVTQYISEEPWGWYQPPAKL,brenda,Q93YB2,CCC(O)=NCCCC=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>>CCC(O)=NCCCC(=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+],1.63,6.880611962491541e-15,30.0,9.0,1.2.1.19,3888.0,0.2121876044039577,CCC(O)=NCCCC=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,CCC(O)=NCCCC(=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+],0.2121876044039577,CCC(O)=NCCCC=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__MDIPIPTRQLFINGDWKAPVLNKRIPVINPATQNIIGDIPAATKEDVDVAVAAAKTALTRNKGADWATASGAVRARYLRAIAAKVTEKKPELAKLESIDCGKPLDEAAWDIDDVAGCFEYYADLAEKLDARQKAPVSLPMDTFKSHVLREPIGVVGLITPWNYPMLMATWKVAPALAAGCAAILKPSELASLTCLELGEICKEVGLPPGVLNILTGLGPEAGAPLATHPDVDKVAFTGSSATGSKIMTAAAQLVKPVSLELGGKSPLVVFEDVDLDKAAEWAIFGCFWTNGQICSATSRLILHESIATEFLNRIVKWIKNIKISDPLEEGCRLGPVVSEGQYEKILKFVSNAKSEGATILTGGSRPEHLKKGFFIEPTIITDVTTNMQIWREEVFGPVLCVKTFSTEEEAIDLANDTVYGLGAAVISNDLERCERVTKAFKAGIVWVNCSQPCFTQAPWGGVKRSGFGRELGEWGLDNYLSVKQVTQYISEEPWGWYQPPAKL,./data/raw/alphafold//AF-Q93YB2-F1-model_v4.pdb,1760,4665,1650,1376
+594,21559,21884,MKKVMLATALFLGLTPAGANAADLGHQTLGSNDGWGAYSTGTTGGSKASSSNVYTVSNRNQLVSALGKETNTTPKIIYIKGTIDMNVDDNLKPLGLNDYKDPEYDLDKYLKAYDPSTWGKKEPSGTQEEARARSQKNQKARVMVDIPANTTIVGSGTNAKVVGGNFQIKSDNVIIRNIEFQDAYDYFPQWDPTDGSSGNWNSQYDNITINGGTHIWIDHCTFNDGSRPDSTSPKYYGRKYQHHDGQTDASNGANYITMSYNYYHDHDKSSIFGSSDSKTSDDGKLKITLHHNRYKNIVQRAPRVRFGQVHVYNNYYEGSTSSSSYPFSYAWGIGKSSKIYAQNNVIDVPGLSAAKTISVFSGGTALYDSGTLLNGTQINASAANGLSSSVGWTPSLHGSIDASANVKSNVINQAGAGKLN,brenda,P39116,O=C(O)[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]3C(=O)O)O[C@@H]2C(=O)O)[C@H](O)[C@@H](O)[C@H]1O>>O=C(O)C1=C[C@H](O)[C@@H](O)[C@@H](O[C@@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2C(=O)O)O1.O=C(O)[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O,340.0,1.0393997089125908e-14,55.0,9.5,4.2.2.2,1423.0,2.531478917042256,O=C(O)[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]3C(=O)O)O[C@@H]2C(=O)O)[C@H](O)[C@@H](O)[C@H]1O,O=C(O)C1=C[C@H](O)[C@@H](O)[C@@H](O[C@@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2C(=O)O)O1.O=C(O)[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O,2.531478917042256,O=C(O)[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]3C(=O)O)O[C@@H]2C(=O)O)[C@H](O)[C@@H](O)[C@H]1O__MKKVMLATALFLGLTPAGANAADLGHQTLGSNDGWGAYSTGTTGGSKASSSNVYTVSNRNQLVSALGKETNTTPKIIYIKGTIDMNVDDNLKPLGLNDYKDPEYDLDKYLKAYDPSTWGKKEPSGTQEEARARSQKNQKARVMVDIPANTTIVGSGTNAKVVGGNFQIKSDNVIIRNIEFQDAYDYFPQWDPTDGSSGNWNSQYDNITINGGTHIWIDHCTFNDGSRPDSTSPKYYGRKYQHHDGQTDASNGANYITMSYNYYHDHDKSSIFGSSDSKTSDDGKLKITLHHNRYKNIVQRAPRVRFGQVHVYNNYYEGSTSSSSYPFSYAWGIGKSSKIYAQNNVIDVPGLSAAKTISVFSGGTALYDSGTLLNGTQINASAANGLSSSVGWTPSLHGSIDASANVKSNVINQAGAGKLN,./data/raw/alphafold//AF-P39116-F1-model_v4.pdb,684,73,5785,6691
+595,16545,16774,MKITGSNLSIYDVADVCMKRATVELDPSQLERVAVAHERTQAWGEAQHPIYGVNTGFGELVPVMIPRQHKRELQENLIRSHAAGGGEPFADDVVRAIMLARLNCLMKGYSGASVETVKLLAEFINRGIHPVIPQQGSLGASGDLSPLSHIALALIGEGTVSFKGQVRKTGDVLREEGLKPLELGFKGGLTLINGTSAMTGAACVALGRAYHLFRLALLATADFVQCLGGSTGPFEERGHLPKNHSGQVIVAREIRKLLAGSQLTSDHQDLMKEMVARSGVGNDVVDTGVYLQDAYTLRAVPQILGPVLDTLDFARKLIEEELNSTNDNPLIFDVPEQTFHGANFHGQYVAMACDYLNIAVTEIGVLAERQLNRLVDPNINGKLPPFLASAHSGLLCGFEGGQYLATSIASENLDLAAPSSIKSLPSNGSNQDVVSMGTTSARKSLRLCENVGTIVSTLIAACNQAGHILGNERFSPPIRELHGELSRSVPLYQDDSPIFELFQTVRAFVGGDGFRAHLVTHLDLAATTASS,sabio,Q0VZ68,NC(Cc1ccc(O)cc1)C(=O)O>>N.O=C(O)C=Cc1ccc(O)cc1,0.0005,7.821441191474541e-15,30.0,8.8,4.3.1.23,52.0,-3.3010299956639813,NC(Cc1ccc(O)cc1)C(=O)O,N.O=C(O)C=Cc1ccc(O)cc1,-2.1426675035687315,NC(Cc1ccc(O)cc1)C(=O)O__MKITGSNLSIYDVADVCMKRATVELDPSQLERVAVAHERTQAWGEAQHPIYGVNTGFGELVPVMIPRQHKRELQENLIRSHAAGGGEPFADDVVRAIMLARLNCLMKGYSGASVETVKLLAEFINRGIHPVIPQQGSLGASGDLSPLSHIALALIGEGTVSFKGQVRKTGDVLREEGLKPLELGFKGGLTLINGTSAMTGAACVALGRAYHLFRLALLATADFVQCLGGSTGPFEERGHLPKNHSGQVIVAREIRKLLAGSQLTSDHQDLMKEMVARSGVGNDVVDTGVYLQDAYTLRAVPQILGPVLDTLDFARKLIEEELNSTNDNPLIFDVPEQTFHGANFHGQYVAMACDYLNIAVTEIGVLAERQLNRLVDPNINGKLPPFLASAHSGLLCGFEGGQYLATSIASENLDLAAPSSIKSLPSNGSNQDVVSMGTTSARKSLRLCENVGTIVSTLIAACNQAGHILGNERFSPPIRELHGELSRSVPLYQDDSPIFELFQTVRAFVGGDGFRAHLVTHLDLAATTASS,./data/raw/alphafold//AF-Q0VZ68-F1-model_v4.pdb,2682,3778,2351,5249
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+602,19649,19935,MNVFSIFSLVFLAAFGSCADDRRSALEECFREADYEEFLEIARNGLKKTSNPKHVVVVGAGMAGLSAAYVLAGAGHRVTLLEASDRVGGRVNTYRDEKEGWYVNMGPMRLPERHRIVRTYIAKFGLKLNEFFQENENAWYFIRNIRKRVWEVKKDPGVFKYPVKPSEEGKSASQLYRESLKKVIEELKRTNCSYILDKYDTYSTKEYLIKEGNLSRGAVDMIGDLLNEDSSYYLSFIESLKNDDLFSYEKRFDEISDGFDQLPKSMHQAIAEMVHLNAQVIKIQRDAEKVRVAYQTPAKTLSYVTADYVIVCATSRAVRRISFEPPLPPKKAHALRSIHYKSATKIFLTCTRKFWEADGIHGGKSTTDLPSRFIYYPNHNFTSGVGVIVAYVLADDSDFFQALDIKTSADIVINDLSLIHQLPKNEIQALCYPSLIKKWSLDKYTMGALTSFTPYQFQDYIETVAAPVGRIYFAGEYTATVHGWLDSTIKSGLTAARNVNRASQKPSRIHLINDNQL,sabio,A8QL52,O.O=O.OO>>N.O=C(O)C(=O)Cc1c[nH]c2ccccc12.OO,98.82,50.17110316592439,25.0,8.5,1.4.3.2,8613.0,1.994844849553398,O.O=O.OO,N.O=C(O)C(=O)Cc1c[nH]c2ccccc12.OO,1.994844849553398,O.O=O.OO__MNVFSIFSLVFLAAFGSCADDRRSALEECFREADYEEFLEIARNGLKKTSNPKHVVVVGAGMAGLSAAYVLAGAGHRVTLLEASDRVGGRVNTYRDEKEGWYVNMGPMRLPERHRIVRTYIAKFGLKLNEFFQENENAWYFIRNIRKRVWEVKKDPGVFKYPVKPSEEGKSASQLYRESLKKVIEELKRTNCSYILDKYDTYSTKEYLIKEGNLSRGAVDMIGDLLNEDSSYYLSFIESLKNDDLFSYEKRFDEISDGFDQLPKSMHQAIAEMVHLNAQVIKIQRDAEKVRVAYQTPAKTLSYVTADYVIVCATSRAVRRISFEPPLPPKKAHALRSIHYKSATKIFLTCTRKFWEADGIHGGKSTTDLPSRFIYYPNHNFTSGVGVIVAYVLADDSDFFQALDIKTSADIVINDLSLIHQLPKNEIQALCYPSLIKKWSLDKYTMGALTSFTPYQFQDYIETVAAPVGRIYFAGEYTATVHGWLDSTIKSGLTAARNVNRASQKPSRIHLINDNQL,./data/raw/alphafold//AF-A8QL52-F1-model_v4.pdb,1381,1496,3067,1822
+603,13451,13628,MGSIPEVLNVDALVVGAGVAGIYSTYRLSRAGLNVQCIDTAGDVGGTWYWNTYPGAMSDTETYLYRYSWDKEDLRSYPWSNHYVYQPEILQYLRHVVERHDLRKYIRFDTEMQKAVWDDQRSIWVISCSGDLVIHTRYLVNCLGLLSKPNYPDIKGISSFAGDLIHTAKWDHSVELQGKTVGIIGNGSTGVQVMTAIAPKVSRLVSFQRHPQYSVPSGQGPIATGYRDKINQNYDQIWKDVWASSTAFGVPETTRKTMEATPEERQQAFQEVWDQGNGFRFMFSAFGDLTTSLEANEEACKFLRGKIDEIVKDPRKAKALKPCDLYARRPLCDTGYYQIFNRDNVDIVDLRETAIERIAPEGIVTADGTLHRLDVLIFATGFDAIEGSYLRIQITGRDGKSIQKHWETGPTAYGAVACSGFPNMFLVSGPQGAFANFPVVIESEVDFITECILHSEKKESHRVEVSAKAEQQWSELCDQLVEGSLFKTTASWIFGSNVEGRKSSTKFYFGGLNRYREWTRKEAAAGFPGFS,brenda,G8H1L8,N=C(O)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=C1CCCC1.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=C1CCCCO1,5.9,1.3172697925797491e-14,25.0,8.0,1.14.13.22,64609.0,0.7708520116421442,N=C(O)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=C1CCCC1.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=C1CCCCO1,0.7708520116421442,N=C(O)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=C1CCCC1.O=O.[H+]__MGSIPEVLNVDALVVGAGVAGIYSTYRLSRAGLNVQCIDTAGDVGGTWYWNTYPGAMSDTETYLYRYSWDKEDLRSYPWSNHYVYQPEILQYLRHVVERHDLRKYIRFDTEMQKAVWDDQRSIWVISCSGDLVIHTRYLVNCLGLLSKPNYPDIKGISSFAGDLIHTAKWDHSVELQGKTVGIIGNGSTGVQVMTAIAPKVSRLVSFQRHPQYSVPSGQGPIATGYRDKINQNYDQIWKDVWASSTAFGVPETTRKTMEATPEERQQAFQEVWDQGNGFRFMFSAFGDLTTSLEANEEACKFLRGKIDEIVKDPRKAKALKPCDLYARRPLCDTGYYQIFNRDNVDIVDLRETAIERIAPEGIVTADGTLHRLDVLIFATGFDAIEGSYLRIQITGRDGKSIQKHWETGPTAYGAVACSGFPNMFLVSGPQGAFANFPVVIESEVDFITECILHSEKKESHRVEVSAKAEQQWSELCDQLVEGSLFKTTASWIFGSNVEGRKSSTKFYFGGLNRYREWTRKEAAAGFPGFS,./data/raw/alphafold//AF-G8H1L8-F1-model_v4.pdb,3183,4580,4515,4418
+604,8509,8640,MPALGWAVAAILMLQTAMAEPSPGTLPRKAGVFSDLSNQELKAVHSFLWSKKELRLQPSSTTTMAKNTVFLIEMLLPKKYHVLRFLDKGERHPVREARAVIFFGDQEHPNVTEFAVGPLPGPCYMRALSPRPGYQSSWASRPISTAEYALLYHTLQEATKPLHQFFLNTTGFSFQDCHDRCLAFTDVAPRGVASGQRRSWLIIQRYVEGYFLHPTGLELLVDHGSTDAGHWAVEQVWYNGKFYGSPEELARKYADGEVDVVVLEDPLPGGKGHDSTEEPPLFSSHKPRGDFPSPIHVSGPRLVQPHGPRFRLEGNAVLYGGWSFAFRLRSSSGLQVLNVHFGGERIAYEVSVQEAVALYGGHTPAGMQTKYLDVGWGLGSVTHELAPGIDCPETATFLDTFHYYDADDPVHYPRALCLFEMPTGVPLRRHFNSNFKGGFNFYAGLKGQVLVLRTTSTVYNYDYIWDFIFYPNGVMEAKMHATGYVHATFYTPEGLRHGTRLHTHLIGNIHTHLVHYRVDLDVAGTKNSFQTLQMKLENITNPWSPRHRVVQPTLEQTQYSWERQAAFRFKRKLPKYLLFTSPQENPWGHKRTYRLQIHSMADQVLPPGWQEEQAITWARYPLAVTKYRESELCSSSIYHQNDPWHPPVVFEQFLHNNENIENEDLVAWVTVGFLHIPHSEDIPNTATPGNSVGFLLRPFNFFPEDPSLASRDTVIVWPRDNGPNYVQRWIPEDRDCSMPPPFSYNGTYRPV,uniprot_search,P19801,CN(C)Cc1ccc(CN)cc1.O.O=O>>CN(C)Cc1ccc(C=O)cc1.N.OO,32880.0,0.0,37.0,7.2,1.4.3.22,9606.0,4.516931808868013,CN(C)Cc1ccc(CN)cc1.O.O=O,CN(C)Cc1ccc(C=O)cc1.N.OO,4.516931808868013,CN(C)Cc1ccc(CN)cc1.O.O=O__MPALGWAVAAILMLQTAMAEPSPGTLPRKAGVFSDLSNQELKAVHSFLWSKKELRLQPSSTTTMAKNTVFLIEMLLPKKYHVLRFLDKGERHPVREARAVIFFGDQEHPNVTEFAVGPLPGPCYMRALSPRPGYQSSWASRPISTAEYALLYHTLQEATKPLHQFFLNTTGFSFQDCHDRCLAFTDVAPRGVASGQRRSWLIIQRYVEGYFLHPTGLELLVDHGSTDAGHWAVEQVWYNGKFYGSPEELARKYADGEVDVVVLEDPLPGGKGHDSTEEPPLFSSHKPRGDFPSPIHVSGPRLVQPHGPRFRLEGNAVLYGGWSFAFRLRSSSGLQVLNVHFGGERIAYEVSVQEAVALYGGHTPAGMQTKYLDVGWGLGSVTHELAPGIDCPETATFLDTFHYYDADDPVHYPRALCLFEMPTGVPLRRHFNSNFKGGFNFYAGLKGQVLVLRTTSTVYNYDYIWDFIFYPNGVMEAKMHATGYVHATFYTPEGLRHGTRLHTHLIGNIHTHLVHYRVDLDVAGTKNSFQTLQMKLENITNPWSPRHRVVQPTLEQTQYSWERQAAFRFKRKLPKYLLFTSPQENPWGHKRTYRLQIHSMADQVLPPGWQEEQAITWARYPLAVTKYRESELCSSSIYHQNDPWHPPVVFEQFLHNNENIENEDLVAWVTVGFLHIPHSEDIPNTATPGNSVGFLLRPFNFFPEDPSLASRDTVIVWPRDNGPNYVQRWIPEDRDCSMPPPFSYNGTYRPV,./data/raw/alphafold//AF-P19801-F1-model_v4.pdb,3439,2344,1064,2970
+605,4357,4412,MLEISKVTPKAPPRYGWMNGQCIPWDQCSLHVSTQAAFFGASLFEGVRAYWNAEREQLYVFRLDEHLRRLEQSAKMLRMKLSMPIADIRQGVLELLRANEFRSDVHLYVASYFGINHDPDPLFPTDDTGVYVTGTAVSRLPLVHTGISACMSSWRRISDDSVPPRIKIGANYQNSRLAQTEARVNGYHTSVLLNSRGKVSETPGACLLMVRDGRVISPPVTADILESVTRKTLMSLSEAELDSPVIERDMDRTELYIAEEVFLCGTIAEILPVTTIDRIQVGDGEVGPVTRRLQELYFGVTSGQLEAYKSWLLPVYE,brenda,D0LR31,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,0.29,0.0,25.0,10.0,2.6.1.42,80816.0,-0.5376020021010439,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,-0.5376020021010439,CC(C)[C@H](N)C(=O)O.CCC(=O)C(=O)O__MLEISKVTPKAPPRYGWMNGQCIPWDQCSLHVSTQAAFFGASLFEGVRAYWNAEREQLYVFRLDEHLRRLEQSAKMLRMKLSMPIADIRQGVLELLRANEFRSDVHLYVASYFGINHDPDPLFPTDDTGVYVTGTAVSRLPLVHTGISACMSSWRRISDDSVPPRIKIGANYQNSRLAQTEARVNGYHTSVLLNSRGKVSETPGACLLMVRDGRVISPPVTADILESVTRKTLMSLSEAELDSPVIERDMDRTELYIAEEVFLCGTIAEILPVTTIDRIQVGDGEVGPVTRRLQELYFGVTSGQLEAYKSWLLPVYE,./data/raw/alphafold//AF-D0LR31-F1-model_v4.pdb,1807,1485,3055,1805
+606,18542,18808,MSIPFTRWPEEFARRYREKGYWQDLPLTDILTRHAASDSIAVIDGERQLSYRELNQAADNLACSLRRQGIKPGETALVQLGNVAELYITFFALLKLGVAPVLALFSHQRSELNAYASQIEPALLIADRQHALFSGDDFLNTFVTEHSSIRVVQLLNDSGEHNLQDAINHPAEDFTATPSPADEVAYFQLSGGTTGTPKLIPRTHNDYYYSVRRSVEICQFTQQTRYLCAIPAAHNYAMSSPGSLGVFLAGGTVVLAADPSATLCFPLIEKHQVNVTALVPPAVSLWLQALIEGESRAQLASLKLLQVGGARLSATLAARIPAEIGCQLQQVFGMAEGLVNYTRLDDSAEKIIHTQGYPMCPDDEVWVADAEGNPLPQGEVGRLMTRGPYTFRGYYKSPQHNASAFDANGFYCSGDLISIDPEGYITVQGREKDQINRGGEKIAAEEIENLLLRHPAVIYAALVSMEDELMGEKSCAYLVVKEPLRAVQVRRFLREQGIAEFKLPDRVECVDSLPLTAVGKVDKKQLRQWLASRASA,brenda,P10378,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)c1ccccc1O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OC(=O)c2ccccc2O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.8,0.0,25.0,7.8,6.2.1.71,562.0,-0.0969100130080563,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)c1ccccc1O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OC(=O)c2ccccc2O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.3324384599156053,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)c1ccccc1O__MSIPFTRWPEEFARRYREKGYWQDLPLTDILTRHAASDSIAVIDGERQLSYRELNQAADNLACSLRRQGIKPGETALVQLGNVAELYITFFALLKLGVAPVLALFSHQRSELNAYASQIEPALLIADRQHALFSGDDFLNTFVTEHSSIRVVQLLNDSGEHNLQDAINHPAEDFTATPSPADEVAYFQLSGGTTGTPKLIPRTHNDYYYSVRRSVEICQFTQQTRYLCAIPAAHNYAMSSPGSLGVFLAGGTVVLAADPSATLCFPLIEKHQVNVTALVPPAVSLWLQALIEGESRAQLASLKLLQVGGARLSATLAARIPAEIGCQLQQVFGMAEGLVNYTRLDDSAEKIIHTQGYPMCPDDEVWVADAEGNPLPQGEVGRLMTRGPYTFRGYYKSPQHNASAFDANGFYCSGDLISIDPEGYITVQGREKDQINRGGEKIAAEEIENLLLRHPAVIYAALVSMEDELMGEKSCAYLVVKEPLRAVQVRRFLREQGIAEFKLPDRVECVDSLPLTAVGKVDKKQLRQWLASRASA,./data/raw/alphafold//AF-P10378-F1-model_v4.pdb,132,2623,2923,5771
+607,10090,10241,MARLWGALSLWPLWAAVPWGGAAAVGVRACSSTAAPDGVEGPALRRSYWRHLRRLVLGPPEPPFSHVCQVGDPVLRGVAAPVERAQLGGPELQRLTQRLVQVMRRRRCVGLSAPQLGVPRQVLALELPEALCRECPPRQRALRQMEPFPLRVFVNPSLRVLDSRLVTFPEGCESVAGFLACVPRFQAVQISGLDPNGEQVVWQASGWAARIIQHEMDHLQGCLFIDKMDSRTFTNVYWMKVND,brenda,Q9HBH1,CSCC[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N=C(O)[C@H](CCSC)N=CO)[C@@H](C)O)C(=O)O.O>>CSCC[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N=C(O)[C@@H](N)CCSC)[C@@H](C)O)C(=O)O.O=CO,0.0174,0.0,37.5,6.6,3.5.1.88,9606.0,-1.7594507517174005,CSCC[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N=C(O)[C@H](CCSC)N=CO)[C@@H](C)O)C(=O)O.O,CSCC[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N=C(O)[C@@H](N)CCSC)[C@@H](C)O)C(=O)O.O=CO,-1.7594507517174005,CSCC[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N=C(O)[C@H](CCSC)N=CO)[C@@H](C)O)C(=O)O.O__MARLWGALSLWPLWAAVPWGGAAAVGVRACSSTAAPDGVEGPALRRSYWRHLRRLVLGPPEPPFSHVCQVGDPVLRGVAAPVERAQLGGPELQRLTQRLVQVMRRRRCVGLSAPQLGVPRQVLALELPEALCRECPPRQRALRQMEPFPLRVFVNPSLRVLDSRLVTFPEGCESVAGFLACVPRFQAVQISGLDPNGEQVVWQASGWAARIIQHEMDHLQGCLFIDKMDSRTFTNVYWMKVND,./data/raw/alphafold//AF-Q9HBH1-F1-model_v4.pdb,3614,3588,1375,3333
+608,4367,4422,MGLTPDFLSFCLEFSWTFLLVVIFFFIIFKVTKSHSVNKSKKYKLPPGPKPWPIVGNLPEMLANRPATIWIHKLMKEMNTEIACIRLANTIVIPVTCPTIACEFLKKHDASFASRPKIMSTDIASDGFLTTVLVPYGEQWKKMKRVLVNNLLSPQKHQWLLGKRNEEADNLMFYIYNKCCKDVNDGPGLVNIRIAAQHYGGNVFRKLIFNTRYFGKVMEDGGPGFEEVEHINATFTILKYVYAFSISDFIPFLRRLDLDGHRSKIMKAMGIMKKYHDPIIHDRIKQWNDGLKTVEEDLLDVLIKLKDASNKPLLTLKEIKAQITELAIEMVDNPSNAFEWALAEMLNQPELLKRATEELDNVVGKERLVQESDIPKLQFVKACAREALRLHPMEYFNVPHLCMNDTMVGDYLFPKGTQVLLSRVALGRNPKFWTDPLKFNPERHLKEGIDVVLTEPDLRFISFTTGRRSCPGVTLGTTMTIMLFARMLHGFSWSAPPNVSSIDLTQSSDDLFMAKPLCVVAKPRLAAELYSTNEFK,brenda,Q6J540,CC(C)[C@H](N)C(=O)O.O=O>>CC(C)/C=N/O.O.O=C=O,0.73,10000000.0,28.0,7.5,1.14.14.39,34305.0,-0.1366771398795441,CC(C)[C@H](N)C(=O)O.O=O,CC(C)/C=N/O.O.O=C=O,-0.1366771398795441,CC(C)[C@H](N)C(=O)O.O=O__MGLTPDFLSFCLEFSWTFLLVVIFFFIIFKVTKSHSVNKSKKYKLPPGPKPWPIVGNLPEMLANRPATIWIHKLMKEMNTEIACIRLANTIVIPVTCPTIACEFLKKHDASFASRPKIMSTDIASDGFLTTVLVPYGEQWKKMKRVLVNNLLSPQKHQWLLGKRNEEADNLMFYIYNKCCKDVNDGPGLVNIRIAAQHYGGNVFRKLIFNTRYFGKVMEDGGPGFEEVEHINATFTILKYVYAFSISDFIPFLRRLDLDGHRSKIMKAMGIMKKYHDPIIHDRIKQWNDGLKTVEEDLLDVLIKLKDASNKPLLTLKEIKAQITELAIEMVDNPSNAFEWALAEMLNQPELLKRATEELDNVVGKERLVQESDIPKLQFVKACAREALRLHPMEYFNVPHLCMNDTMVGDYLFPKGTQVLLSRVALGRNPKFWTDPLKFNPERHLKEGIDVVLTEPDLRFISFTTGRRSCPGVTLGTTMTIMLFARMLHGFSWSAPPNVSSIDLTQSSDDLFMAKPLCVVAKPRLAAELYSTNEFK,./data/raw/alphafold//AF-Q6J540-F1-model_v4.pdb,2915,1635,3240,2027
+609,14163,14347,MTGRKIAFLGTGLMGAPMARRLLGAGFAVTVWNRDRNKADALVADGATVAATAAEAAKGASVLFTMLTNGGAVSEVLFGSGVTDALAPGAVVIDNSSIAPPMAREHAAKLAERGFRHIDAPVSGGVVGAAAGALAIMAGGDADVIDSVRDVLAPLGRVTHVGPSGTGQLAKLGNQQIVAVTIGAIAEAMLLVEAGGGSREAFRAAIRGGFAESRILELHGQRMIDRNFEPGGTSRNQLKDLDAVLAAARSLSLHLPLTETVRTEFAEFVENGGAESDHSGLLLHLENKNGRGKA,brenda,B9J8U1,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)[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.[H+],15.2,10.95532038602929,25.0,8.0,1.1.1.411,358.0,1.1818435879447726,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)[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.[H+],1.1818435879447726,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)[C@H](O)[C@@H](O)[C@H](O)CO__MTGRKIAFLGTGLMGAPMARRLLGAGFAVTVWNRDRNKADALVADGATVAATAAEAAKGASVLFTMLTNGGAVSEVLFGSGVTDALAPGAVVIDNSSIAPPMAREHAAKLAERGFRHIDAPVSGGVVGAAAGALAIMAGGDADVIDSVRDVLAPLGRVTHVGPSGTGQLAKLGNQQIVAVTIGAIAEAMLLVEAGGGSREAFRAAIRGGFAESRILELHGQRMIDRNFEPGGTSRNQLKDLDAVLAAARSLSLHLPLTETVRTEFAEFVENGGAESDHSGLLLHLENKNGRGKA,./data/raw/alphafold//AF-B9J8U1-F1-model_v4.pdb,2348,4713,4758,4594
+610,4523,4578,MGTSLSPNDPWPLNPLSIQQTTLLLLLSVLATVHVGQRLLRQRRRQLRSAPPGPFAWPLIGNAAAVGQAAHLSFARLARRYGDVFQIRLGSCPIVVLNGERAIHQALVQQGSAFADRPAFASFRVVSGGRSMAFGHYSEHWKVQRRAAHSMMRNFFTRQPRSRQVLEGHVLSEARELVALLVRGSADGAFLDPRPLTVVAVANVMSAVCFGCRYSHDDPEFRELLSHNEEFGRTVGAGSLVDVMPWLQYFPNPVRTVFREFEQLNRNFSNFILDKFLRHCESLRPGAAPRDMMDAFILSAEKKAAGDSHGGGARLDLENVPATITDIFGASQDTLSTALQWLLLLFTRYPDVQTRVQAELDQVVGRDRLPCMGDQPNLPYVLAFLYEAMRFSSFVPVTIPHATTANTSVLGYHIPKDTVVFVNQWSVNHDPLKWPNPENFDPARFLDKDGLINKDLTSRVMIFSVGKRRCIGEELSKMQLFLFISILAHQCDFRANPNEPAKMNFSYGLTIKPKSFKVNVTLRESMELLDSAVQNLQAKETCQ,sabio,Q16678,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.O=O.[H]>>CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CC(=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,46.2,0.0,37.0,7.4,1.14.14.1,9606.0,1.6646419755561257,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.O=O.[H],CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CC(=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,1.6646419755561257,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.O=O.[H]__MGTSLSPNDPWPLNPLSIQQTTLLLLLSVLATVHVGQRLLRQRRRQLRSAPPGPFAWPLIGNAAAVGQAAHLSFARLARRYGDVFQIRLGSCPIVVLNGERAIHQALVQQGSAFADRPAFASFRVVSGGRSMAFGHYSEHWKVQRRAAHSMMRNFFTRQPRSRQVLEGHVLSEARELVALLVRGSADGAFLDPRPLTVVAVANVMSAVCFGCRYSHDDPEFRELLSHNEEFGRTVGAGSLVDVMPWLQYFPNPVRTVFREFEQLNRNFSNFILDKFLRHCESLRPGAAPRDMMDAFILSAEKKAAGDSHGGGARLDLENVPATITDIFGASQDTLSTALQWLLLLFTRYPDVQTRVQAELDQVVGRDRLPCMGDQPNLPYVLAFLYEAMRFSSFVPVTIPHATTANTSVLGYHIPKDTVVFVNQWSVNHDPLKWPNPENFDPARFLDKDGLINKDLTSRVMIFSVGKRRCIGEELSKMQLFLFISILAHQCDFRANPNEPAKMNFSYGLTIKPKSFKVNVTLRESMELLDSAVQNLQAKETCQ,./data/raw/alphafold//AF-Q16678-F1-model_v4.pdb,3282,1659,3264,2056
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+618,7539,7661,MNNFNLHTPTRILFGKGAIAGLREQIPHDARVLITYGGGSVKKTGVLDQVLDALKGMDVLEFGGIEPNPAYETLMNAVKLVREQKVTFLLAVGGGSVLDGTKFIAAAANYPENIDPWHILQTGGKEIKSAIPMGCVLTLPATGSESNAGAVISRKTTGDKQAFHSAHVQPVFAVLDPVYTYTLPPRQVANGVVDAFVHTVEQYVTKPVDAKIQDRFAEGILLTLIEDGPKALKEPENYDVRANVMWAATQALNGLIGAGVPQDWATHMLGHELTAMHGLDHAQTLAIVLPALWNEKRDTKRAKLLQYAERVWNITEGSDDERIDAAIAATRNFFEQLGVPTHLSDYGLDGSSIPALLKKLEEHGMTQLGENHDITLDVSRRIYEAAR,sabio,Q46856,CCCCCO.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>>CCCCC=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],10.8,6.823391019066652e-15,22.0,7.7,1.1.1.2,562.0,1.0334237554869496,CCCCCO.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,CCCCC=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],1.0334237554869496,CCCCCO.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__MNNFNLHTPTRILFGKGAIAGLREQIPHDARVLITYGGGSVKKTGVLDQVLDALKGMDVLEFGGIEPNPAYETLMNAVKLVREQKVTFLLAVGGGSVLDGTKFIAAAANYPENIDPWHILQTGGKEIKSAIPMGCVLTLPATGSESNAGAVISRKTTGDKQAFHSAHVQPVFAVLDPVYTYTLPPRQVANGVVDAFVHTVEQYVTKPVDAKIQDRFAEGILLTLIEDGPKALKEPENYDVRANVMWAATQALNGLIGAGVPQDWATHMLGHELTAMHGLDHAQTLAIVLPALWNEKRDTKRAKLLQYAERVWNITEGSDDERIDAAIAATRNFFEQLGVPTHLSDYGLDGSSIPALLKKLEEHGMTQLGENHDITLDVSRRIYEAAR,./data/raw/alphafold//AF-Q46856-F1-model_v4.pdb,3259,2087,3096,1856
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+620,3695,3745,MNLSTANHHIPLNDGNSIPIIGLGTYSDPRPVPGKTFIAVKTAIDEGYRHIDGAYVYRNEHEVGEAIREKVAEGKVKREEIFYCGKLWSTDHDPEMVRPALERTLQTLKLDYIDLYIIEMPMAFKPGEEFYPKDENGRVIYHKSNLCATWEALEACKDAGLVKSLGVSNFNRRQLEVILNKPGLKYKPVTNQVECHPYFTQTKLLEVSASSMTSFIVAYSPLGTCRNPLWVNVSSPPLLKDELLTSLGKKYNKTQAQIVLRFDIQRGLVVIPKSTTPERIKENFQIFDFSLTKEEMKDIEALNKNVRFVEMLMWSDHPEYPFHDEY,sabio,P31210,CC(C)CCCC(C)C1CCC2C3C(O)CC4=CC(=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.[H]>>CC(C)CCCC(C)C1CCC2C3C(O)CC4CC(=O)CCC4(C)C3CCC12C.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,36.0,0.0,25.0,7.4,1.3.1.3,10116.0,1.5563025007672873,CC(C)CCCC(C)C1CCC2C3C(O)CC4=CC(=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.[H],CC(C)CCCC(C)C1CCC2C3C(O)CC4CC(=O)CCC4(C)C3CCC12C.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,1.5563025007672873,CC(C)CCCC(C)C1CCC2C3C(O)CC4=CC(=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.[H]__MNLSTANHHIPLNDGNSIPIIGLGTYSDPRPVPGKTFIAVKTAIDEGYRHIDGAYVYRNEHEVGEAIREKVAEGKVKREEIFYCGKLWSTDHDPEMVRPALERTLQTLKLDYIDLYIIEMPMAFKPGEEFYPKDENGRVIYHKSNLCATWEALEACKDAGLVKSLGVSNFNRRQLEVILNKPGLKYKPVTNQVECHPYFTQTKLLEVSASSMTSFIVAYSPLGTCRNPLWVNVSSPPLLKDELLTSLGKKYNKTQAQIVLRFDIQRGLVVIPKSTTPERIKENFQIFDFSLTKEEMKDIEALNKNVRFVEMLMWSDHPEYPFHDEY,./data/raw/alphafold//AF-P31210-F1-model_v4.pdb,1329,3893,6212,875
+621,21433,21757,MSVVGTPKSAEQIQQEWDTNPRWKDVTRTYSAEDVVALQGSVVEEHTLARRGAEVLWEQLHDLEWVNALGALTGNMAVQQVRAGLKAIYLSGWQVAGDANLSGHTYPDQSLYPANSVPQVVRRINNALQRADQIAKIEGDTSVENWLAPIVADGEAGFGGALNVYELQKALIAAGVAGSHWEDQLASEKKCGHLGGKVLIPTQQHIRTLTSARLAADVADVPTVVIARTDAEAATLITSDVDERDQPFITGERTREGFYRTKNGIEPCIARAKAYAPFADLIWMETGTPDLEAARQFSEAVKAEYPDQMLAYNCSPSFNWKKHLDDATIAKFQKELAAMGFKFQFITLAGFHALNYSMFDLAYGYAQNQMSAYVELQEREFAAEERGYTATKHQREVGAGYFDRIATTVDPNSSTTALTGSTEEGQFH,brenda,P9WKK7,O=C(O)C[C@H](C(=O)O)[C@H](O)C(=O)O>>O=C(O)CCC(=O)O.O=CC(=O)O,9.78,0.0,30.0,7.5,4.1.3.1,1773.0,0.9903388547876014,O=C(O)C[C@H](C(=O)O)[C@H](O)C(=O)O,O=C(O)CCC(=O)O.O=CC(=O)O,0.9903388547876014,O=C(O)C[C@H](C(=O)O)[C@H](O)C(=O)O__MSVVGTPKSAEQIQQEWDTNPRWKDVTRTYSAEDVVALQGSVVEEHTLARRGAEVLWEQLHDLEWVNALGALTGNMAVQQVRAGLKAIYLSGWQVAGDANLSGHTYPDQSLYPANSVPQVVRRINNALQRADQIAKIEGDTSVENWLAPIVADGEAGFGGALNVYELQKALIAAGVAGSHWEDQLASEKKCGHLGGKVLIPTQQHIRTLTSARLAADVADVPTVVIARTDAEAATLITSDVDERDQPFITGERTREGFYRTKNGIEPCIARAKAYAPFADLIWMETGTPDLEAARQFSEAVKAEYPDQMLAYNCSPSFNWKKHLDDATIAKFQKELAAMGFKFQFITLAGFHALNYSMFDLAYGYAQNQMSAYVELQEREFAAEERGYTATKHQREVGAGYFDRIATTVDPNSSTTALTGSTEEGQFH,./data/raw/alphafold//AF-P9WKK7-F1-model_v4.pdb,3810,3929,1768,3576
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+663,7283,7405,MESQVRGGTRWKRFAVVMVPSVAATAAIGVALAQGALAASFSVSGQSFKVTAQELNGTGFSQYGAIDQGYTLSGEKTAHPVAVSVFDTARIQKMCQSVVTPNIPLLGSVSLTLTAGDSADPEKQVNAKNLYIDVEDLGADAEFTNIDIGVAGKDISQGPGMKAGEVQKKQANPYGFAQQAEKAKLTDVKQTAWATTAGTFKLPGLKMKLQTGTHECY,sabio,Q2AAT6,CCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCCCCCCCCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,1.4,8.360998502760556e-15,37.0,7.0,3.1.1.13,1931.0,0.1461280356782379,CCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCCCCCCCCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,0.1461280356782379,CCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MESQVRGGTRWKRFAVVMVPSVAATAAIGVALAQGALAASFSVSGQSFKVTAQELNGTGFSQYGAIDQGYTLSGEKTAHPVAVSVFDTARIQKMCQSVVTPNIPLLGSVSLTLTAGDSADPEKQVNAKNLYIDVEDLGADAEFTNIDIGVAGKDISQGPGMKAGEVQKKQANPYGFAQQAEKAKLTDVKQTAWATTAGTFKLPGLKMKLQTGTHECY,./data/raw/alphafold//AF-Q2AAT6-F1-model_v4.pdb,3268,2100,839,1162
+664,19833,20119,MKKLTVYLATTNPHKVEEIKMIAPEWMEILPSPEKIEVVEDGETFLENSVKKAVVYGKKLKHPVMADDSGLVIYSLGGFPGVMSARFMEEHSYKEKMRTILKMLEGKDRRAAFVCSATFFDPVENTLISVEDRVEGRIANEIRGTGGFGYDPFFIPDGYDKTFGEIPHLKEKISHRSKAFRKLFSVLEKILESENR,brenda,Q9WY06,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)C[C@@H]1O>>O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)C[C@@H]1O.O=P(O)(O)OP(=O)(O)O,5.46,1.669632536318335e-14,50.0,9.0,3.6.1.66,2336.0,0.7371926427047373,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)C[C@@H]1O,O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)C[C@@H]1O.O=P(O)(O)OP(=O)(O)O,1.2713768718940746,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)C[C@@H]1O__MKKLTVYLATTNPHKVEEIKMIAPEWMEILPSPEKIEVVEDGETFLENSVKKAVVYGKKLKHPVMADDSGLVIYSLGGFPGVMSARFMEEHSYKEKMRTILKMLEGKDRRAAFVCSATFFDPVENTLISVEDRVEGRIANEIRGTGGFGYDPFFIPDGYDKTFGEIPHLKEKISHRSKAFRKLFSVLEKILESENR,./data/raw/alphafold//AF-Q9WY06-F1-model_v4.pdb,366,2931,5266,6133
+665,2411,2445,MTTKKADYIWFNGEMVRWEDAKVHVMSHALHYGTSVFEGIRCYDSHKGPVVFRHREHMQRLHDSAKIYRFPVSQSIDELMEACRDVIRKNNLTSAYIRPLIFVGDVGMGVNPPAGYSTDVIIAAFPWGAYLGAEALEQGIDAMVSSWNRAAPNTIPTAAKAGGNYLSSLLVGSEARRHGYQEGIALDVNGYISEGAGENLFEVKDGVLFTPPFTSSALPGITRDAIIKLAKELGIEVREQVLSRESLYLADEVFMSGTAAEITPVRSVDGIQVGEGRCGPVTKRIQQAFFGLFTGETEDKWGWLDQVNQ,brenda,P0AB80,CC(C)(C)CC(=O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O>>CC(C)(C)C[C@H](N)C(=O)O.O=C(O)CCC(=O)C(=O)O,0.08,9.7401334579863e-15,25.0,8.0,2.6.1.42,562.0,-1.0969100130080565,CC(C)(C)CC(=O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O,CC(C)(C)C[C@H](N)C(=O)O.O=C(O)CCC(=O)C(=O)O,1.0934216851622351,CC(C)(C)CC(=O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O__MTTKKADYIWFNGEMVRWEDAKVHVMSHALHYGTSVFEGIRCYDSHKGPVVFRHREHMQRLHDSAKIYRFPVSQSIDELMEACRDVIRKNNLTSAYIRPLIFVGDVGMGVNPPAGYSTDVIIAAFPWGAYLGAEALEQGIDAMVSSWNRAAPNTIPTAAKAGGNYLSSLLVGSEARRHGYQEGIALDVNGYISEGAGENLFEVKDGVLFTPPFTSSALPGITRDAIIKLAKELGIEVREQVLSRESLYLADEVFMSGTAAEITPVRSVDGIQVGEGRCGPVTKRIQQAFFGLFTGETEDKWGWLDQVNQ,./data/raw/alphafold//AF-P0AB80-F1-model_v4.pdb,1271,5222,1609,736
+666,1369,1397,MDPKYQRVELNDGHFMPVLGFGTYAPPEVPRNRAVEVTKLAIEAGFRHIDSAYLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCTFFQPQMVQPALESSLKKLQLDYVDLYLLHFPMALKPGETPLPKDENGKVIFDTVDLSATWEVMEKCKDAGLAKSIGVSNFNCRQLEMILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAHSALGTQRHKLWVDPNSPVLLEDPVLCALAKKHKQTPALIALRYQLQRGVVVLAKSYNEQRIRENIQVFEFQLTSEDMKVLDGLNRNYRYVVMDFLMDHPDYPFSDEY,sabio,P17516,CC(=O)C1CCC2C3CCC4CC(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.[H]>>CC(O)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,43.8,0.0,25.0,7.0,1.1.1.149,9606.0,1.6414741105040995,CC(=O)C1CCC2C3CCC4CC(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.[H],CC(O)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,1.6414741105040995,CC(=O)C1CCC2C3CCC4CC(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.[H]__MDPKYQRVELNDGHFMPVLGFGTYAPPEVPRNRAVEVTKLAIEAGFRHIDSAYLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWCTFFQPQMVQPALESSLKKLQLDYVDLYLLHFPMALKPGETPLPKDENGKVIFDTVDLSATWEVMEKCKDAGLAKSIGVSNFNCRQLEMILNKPGLKYKPVCNQVECHPYLNQSKLLDFCKSKDIVLVAHSALGTQRHKLWVDPNSPVLLEDPVLCALAKKHKQTPALIALRYQLQRGVVVLAKSYNEQRIRENIQVFEFQLTSEDMKVLDGLNRNYRYVVMDFLMDHPDYPFSDEY,./data/raw/alphafold//AF-P17516-F1-model_v4.pdb,1329,1150,197,212
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+668,15807,16034,MQIGLVGLGRMGLNLALNMLDHGHEVIGYARTRATVDKAAAQGVKGTCSLEEMVGKLVAPRLVWLMIPAGKAVDEVIEQLVPSLAPGDIIVDGGNSHYRDTLRRYKFLKARGIRFADSGTSGGVEGARHGACCMVGAEDEVFAYLEPLFKDITVPGGYLHTGPPGSGHYVKMVHNGIEYGMMQAIGEGMEVLASAPFKLDLKEVARVWRHGSVIRGWLMDLMENALAKDNTLDGIKDIAYSSGEGLWTVEEALRLKVPAPVITAALVMRYRSEQEESFATKVVAALRHEFGGHDVARK,uniprot_search,A0A1J5NX54,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)C(O)C(O)C(O)C(O)COP(=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.O=C(CO)C(O)C(O)COP(=O)(O)O.O=C=O.[H],8.73,0.0,50.0,7.5,1.1.1.44,1525.0,0.9410142437055696,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)C(O)C(O)C(O)C(O)COP(=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.O=C(CO)C(O)C(O)COP(=O)(O)O.O=C=O.[H],0.9410142437055696,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)C(O)C(O)C(O)C(O)COP(=O)(O)O__MQIGLVGLGRMGLNLALNMLDHGHEVIGYARTRATVDKAAAQGVKGTCSLEEMVGKLVAPRLVWLMIPAGKAVDEVIEQLVPSLAPGDIIVDGGNSHYRDTLRRYKFLKARGIRFADSGTSGGVEGARHGACCMVGAEDEVFAYLEPLFKDITVPGGYLHTGPPGSGHYVKMVHNGIEYGMMQAIGEGMEVLASAPFKLDLKEVARVWRHGSVIRGWLMDLMENALAKDNTLDGIKDIAYSSGEGLWTVEEALRLKVPAPVITAALVMRYRSEQEESFATKVVAALRHEFGGHDVARK,./data/raw/alphafold//AF-A0A1J5NX54-F1-model_v4.pdb,2591,5059,2162,5034
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+671,12077,12240,MSQNLFNVEDYRKLRQKRLPKMVYDYLEGGAEDEYGVKHNRDVFQQWRFKPKRLVDVSRRSLQAEVLGKRQSMPLLIGPTGLNGALWPKGDLALARAATKAGIPFVLSTASNMSIEDLARQCDGDLWFQLYVIHREIAQGMVLKALHTGYTTLVLTTDVAVNGYRERDLHNRFKIPMSYSAKVVLDGCLHPRWSLDFVRHGMPQLANFVSSQTSSLEMQAALMSRQMDASFNWEALRWLRDLWPHKLLVKGLLSAEDADRCIAEGADGVILSNHGGRQLDCAISPMEVLAQSVAKTGKPVLIDSGFRRGSDIVKALALGAEAVLLGRATLYGLAARGETGVDEVLTLLKADIDRTLAQIGCPDITSLSPDYLQNEGVTNTAPVDHLIGKGTHA,sabio,P20932,Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(CC(O)C(O)C(O)COP(=O)(O)O)c2cc1C.O=C(O)C(O)c1ccc(Cl)cc1>>Cc1cc2c(cc1C)N(CC(O)C(O)C(O)COP(=O)(O)O)c1[nH]c(=O)[nH]c(=O)c1N2.O=C(O)C(=O)c1ccc(Cl)cc1,334.0,8.834272375879724e-15,20.0,7.5,1.1.99.31,303.0,2.523746466811565,Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(CC(O)C(O)C(O)COP(=O)(O)O)c2cc1C.O=C(O)C(O)c1ccc(Cl)cc1,Cc1cc2c(cc1C)N(CC(O)C(O)C(O)COP(=O)(O)O)c1[nH]c(=O)[nH]c(=O)c1N2.O=C(O)C(=O)c1ccc(Cl)cc1,2.523746466811565,Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(CC(O)C(O)C(O)COP(=O)(O)O)c2cc1C.O=C(O)C(O)c1ccc(Cl)cc1__MSQNLFNVEDYRKLRQKRLPKMVYDYLEGGAEDEYGVKHNRDVFQQWRFKPKRLVDVSRRSLQAEVLGKRQSMPLLIGPTGLNGALWPKGDLALARAATKAGIPFVLSTASNMSIEDLARQCDGDLWFQLYVIHREIAQGMVLKALHTGYTTLVLTTDVAVNGYRERDLHNRFKIPMSYSAKVVLDGCLHPRWSLDFVRHGMPQLANFVSSQTSSLEMQAALMSRQMDASFNWEALRWLRDLWPHKLLVKGLLSAEDADRCIAEGADGVILSNHGGRQLDCAISPMEVLAQSVAKTGKPVLIDSGFRRGSDIVKALALGAEAVLLGRATLYGLAARGETGVDEVLTLLKADIDRTLAQIGCPDITSLSPDYLQNEGVTNTAPVDHLIGKGTHA,./data/raw/alphafold//AF-P20932-F1-model_v4.pdb,1003,539,191,206
+672,19579,19865,MWLLPLVLTSLASSATWAGQPASPPVVDTAQGRVLGKYVSLEGLAQPVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTSYPPMCCQDPVVEQMTSDLFTNGKERLTLEFSEDCLYLNIYTPADLTKRGRLPVMVWIHGGGLVLGGAPMYDGVVLAAHENVVVVAIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQENIANFGGDPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTVALVRKDMKAAAKQIAVLAGCKTTTSAVFVHCLRQKSEDELLDLTLKMKFLTLDFHGDQRESHPFLPTVVDGVLLPKMPEEILAEKDFNTVPYIVGINKQEFGWLLPTMMGFPLSEGKLDQKTATSLLWKSYPIANIPEELTPVATDKYLGGTDDPVKKKDLFLDLMGDVVFGVPSVTVARQHRDAGAPTYMYEFQYRPSFSSDKKPKTVIGDHGDEIFSVFGFPLLKGDAPEEEVSLSKTVMKFWANFARSGNPNGEGLPHWPMYDQEEGYLQIGVNTQAAKRLKGEEVAFWNDLLSKEAAKKPPKIKHAEL,uniprot_search,Q29550,O.O=COc1ccccc1>>O=CO.Oc1ccccc1,660.0,1.010456257569221e-14,23.5,7.1,3.1.1.1,9823.0,2.8195439355418688,O.O=COc1ccccc1,O=CO.Oc1ccccc1,2.8195439355418688,O.O=COc1ccccc1__MWLLPLVLTSLASSATWAGQPASPPVVDTAQGRVLGKYVSLEGLAQPVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTSYPPMCCQDPVVEQMTSDLFTNGKERLTLEFSEDCLYLNIYTPADLTKRGRLPVMVWIHGGGLVLGGAPMYDGVVLAAHENVVVVAIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQENIANFGGDPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTVALVRKDMKAAAKQIAVLAGCKTTTSAVFVHCLRQKSEDELLDLTLKMKFLTLDFHGDQRESHPFLPTVVDGVLLPKMPEEILAEKDFNTVPYIVGINKQEFGWLLPTMMGFPLSEGKLDQKTATSLLWKSYPIANIPEELTPVATDKYLGGTDDPVKKKDLFLDLMGDVVFGVPSVTVARQHRDAGAPTYMYEFQYRPSFSSDKKPKTVIGDHGDEIFSVFGFPLLKGDAPEEEVSLSKTVMKFWANFARSGNPNGEGLPHWPMYDQEEGYLQIGVNTQAAKRLKGEEVAFWNDLLSKEAAKKPPKIKHAEL,./data/raw/alphafold//AF-Q29550-F1-model_v4.pdb,1494,2159,554,633
+673,8208,8336,MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,uniprot_search,P23946,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)CC(=O)O)C(C)C)C(O)=N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](Cc1cnc[nH]1)C(O)=N[C@@H](CC(C)C)C(=O)O.O>>,210.0,99.92740940875689,45.66666666666666,8.375,3.4.21.39,9606.0,2.322219294733919,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)CC(=O)O)C(C)C)C(O)=N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](Cc1cnc[nH]1)C(O)=N[C@@H](CC(C)C)C(=O)O.O,,2.322219294733919,CC[C@H](C)[C@H](N=C(O)[C@H](Cc1c[nH]c2ccccc12)N=C(O)[C@@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)CC(=O)O)C(C)C)C(O)=N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1c[nH]c2ccccc12)C(O)=N[C@@H](Cc1cnc[nH]1)C(O)=N[C@@H](CC(C)C)C(=O)O.O__MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,./data/raw/alphafold//AF-P23946-F1-model_v4.pdb,1858,1553,3136,1905
+674,21715,22040,MAASCGGRVVVFPFPFQGHFNPVMRLARALHARGVGITVFHTAGARAPDPADYPADYRFVPVPVEVAPELMASEDIAAIVTALNAACEAPFRDRLSALLSAADGEAGEAGGRVRCVLTDVSWDAVLSAARGLGVPALGVMTASAATFRVYMAYRTLVDKGYLPVREERKDDAVAELPPYRVKDLLRHETCDLEEFADLLGRVIAAARLSSGLIFHTFPFIEAGTLGEIRDDMSVPVYAVAPLNKLVPAATASLHGEVQADRGCLRWLDAQRARSVLYVSFGSMAAMDPHEFVELAWGLADAGRPFVWVVRPNLIRGFESGALPDGVEDRVRGRGVVVSWAPQEEVLAHPAVGGFFTHCGWNSTVEAVSEGVPMICHPRHGDQYGNARYVCHVWKVGTEVAGDQLERGEIKAAIDRLMGGSEEGEGIRKRMNELKIAADKGIDESAGSDLTNLVHLINSY,sabio,Q8W2B7,O=C1C(O)Oc2ccccc2N1O.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=C1C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)Oc2ccccc2N1O.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,12.5,1.5199811447253226e-14,37.0,8.2,2.4.1.202,4577.0,1.0969100130080565,O=C1C(O)Oc2ccccc2N1O.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=C1C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)Oc2ccccc2N1O.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,1.0969100130080565,O=C1C(O)Oc2ccccc2N1O.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__MAASCGGRVVVFPFPFQGHFNPVMRLARALHARGVGITVFHTAGARAPDPADYPADYRFVPVPVEVAPELMASEDIAAIVTALNAACEAPFRDRLSALLSAADGEAGEAGGRVRCVLTDVSWDAVLSAARGLGVPALGVMTASAATFRVYMAYRTLVDKGYLPVREERKDDAVAELPPYRVKDLLRHETCDLEEFADLLGRVIAAARLSSGLIFHTFPFIEAGTLGEIRDDMSVPVYAVAPLNKLVPAATASLHGEVQADRGCLRWLDAQRARSVLYVSFGSMAAMDPHEFVELAWGLADAGRPFVWVVRPNLIRGFESGALPDGVEDRVRGRGVVVSWAPQEEVLAHPAVGGFFTHCGWNSTVEAVSEGVPMICHPRHGDQYGNARYVCHVWKVGTEVAGDQLERGEIKAAIDRLMGGSEEGEGIRKRMNELKIAADKGIDESAGSDLTNLVHLINSY,./data/raw/alphafold//AF-Q8W2B7-F1-model_v4.pdb,3572,3532,1309,3260
+675,16126,16353,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.OC12CCC(CC1)C2>>NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C1CC2CCC1C2.[H],6.3,0.0,23.5,9.5,1.1.1.1,7225.0,0.7993405494535817,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.OC12CCC(CC1)C2,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=C1CC2CCC1C2.[H],0.7993405494535817,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.OC12CCC(CC1)C2__MDLTNKNVIFVAALGGIGLDTSRELVKRNLKNFVILDRVENPTALAELKAINPKVNITFHTYDVTVPVAESKKLLKKIFDQLKTVDILINGAGILDDHQIERTIAINFTGLVNTTTAILDFWDKRKGGPGGIIANICSVTGFNAIHQVPVYSASKAAVVSFTNSLAKLAPITGVTAYSINPGITRTPLVHTFNSWLDVEPRVAELLLSHPTQTSEQCGQNFVKAIEANKNGAIWKLDLGTLEAIEWTKHWDSHI,./data/raw/alphafold//AF-P10807-F1-model_v4.pdb,1827,1509,3084,1844
+676,3638,3687,MAEMATATRLLGWRVASWRLRPPLAGFVSQRAHSLLPVDDAINGLSEEQRQLRQTMAKFLQEHLAPKAQEIDRSNEFKNLREFWKQLGNLGVLGITAPVQYGGSGLGYLEHVLVMEEISRASGAVGLSYGAHSNLCINQLVRNGNEAQKEKYLPKLISGEYIGALAMSEPNAGSDVVSMKLKAEKKGNHYILNGNKFWITNGPDADVLIVYAKTDLAAVPASRGITAFIVEKGMPGFSTSKKLDKLGMRGSNTCELIFEDCKIPAANILGHENKGVYVLMSGLDLERLVLAGGPLGLMQAVLDHTIPYLHVREAFGQKIGHFQLMQGKMADMYTRLMACRQYVYNVAKACDEGHCTAKDCAGVILYSAECATQVALDGIQCFGGNGYINDFPMGRFLRDAKLYEIGAGTSEVRRLVIGRAFNADFH,sabio,P26440,CC(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.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>>CC(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.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)c1N2,8.9,0.0,32.0,8.0,1.3.8.4,9606.0,0.9493900066449128,CC(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.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,CC(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.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)c1N2,0.9493900066449128,CC(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.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__MAEMATATRLLGWRVASWRLRPPLAGFVSQRAHSLLPVDDAINGLSEEQRQLRQTMAKFLQEHLAPKAQEIDRSNEFKNLREFWKQLGNLGVLGITAPVQYGGSGLGYLEHVLVMEEISRASGAVGLSYGAHSNLCINQLVRNGNEAQKEKYLPKLISGEYIGALAMSEPNAGSDVVSMKLKAEKKGNHYILNGNKFWITNGPDADVLIVYAKTDLAAVPASRGITAFIVEKGMPGFSTSKKLDKLGMRGSNTCELIFEDCKIPAANILGHENKGVYVLMSGLDLERLVLAGGPLGLMQAVLDHTIPYLHVREAFGQKIGHFQLMQGKMADMYTRLMACRQYVYNVAKACDEGHCTAKDCAGVILYSAECATQVALDGIQCFGGNGYINDFPMGRFLRDAKLYEIGAGTSEVRRLVIGRAFNADFH,./data/raw/alphafold//AF-P26440-F1-model_v4.pdb,3217,2030,3057,1807
+677,17004,17234,KFALFSVLTLLSFHAVFSFTPLHTQHPLDPITKEEFLAVQTIVQNKYPISNNKLAFHYIGVDDPEKDLVLKYETSPTLISIPRKIFVVAIINSQTHEILIDLTIKSIVSDNIHNGYGFPVLSAAEQFLAIDLPLKYPPFIASVNKRGLNISEIVCSSFTMGWFGEEKNSRTVRVDCFMKESTVNIYVRPITGITIVADLDLMKIVEYHDRDTEAVPTAENTEYQVSKQSPPFGPKQHSLTSHQPQGPGFQINGTSVSWANWKFHIGFDVRAGIVISLASIYDLEKHKSRRVLYKGYISELFVPYQDPTEEFYFKTFFDSGEFGFGLSTVSLIPNRDCPPHAQFIDTYIHSADGTPIFLENAICVFEQYGNIMWRHTETGIPNESIEESRTEVDLAIRTVVTVGNYDNVLDWEFKTSGWMKPSIALSGILEIKGTNIKHKDEIKEEIHGKLVSANSIGIYHDHFYIYYLDFDIDGTQNSFEKTSLKTVRIVDGGSKRKSYWTTETQTAKTESDAKITIGLAPAELVVVNPNIKTAVGNEVGYRLIPAIPAHPLLTEDDYPQIRGAFTNYNVWVTPYNRTEKWAGGLYVDHSRGDDTLAVWTKKNREIVNKDIVMWHVVGIHHVPAQEDFPIMPLLSTSFELRPTNFFERNPVLKTLPPRDFTWPGCSN,uniprot_search,P49252,NCCc1ccccc1.O.O=O>>N.O=CCc1ccccc1.OO,15.14,0.0,37.0,7.0,1.4.3.21,3864.0,1.180125875164054,NCCc1ccccc1.O.O=O,N.O=CCc1ccccc1.OO,1.180125875164054,NCCc1ccccc1.O.O=O__KFALFSVLTLLSFHAVFSFTPLHTQHPLDPITKEEFLAVQTIVQNKYPISNNKLAFHYIGVDDPEKDLVLKYETSPTLISIPRKIFVVAIINSQTHEILIDLTIKSIVSDNIHNGYGFPVLSAAEQFLAIDLPLKYPPFIASVNKRGLNISEIVCSSFTMGWFGEEKNSRTVRVDCFMKESTVNIYVRPITGITIVADLDLMKIVEYHDRDTEAVPTAENTEYQVSKQSPPFGPKQHSLTSHQPQGPGFQINGTSVSWANWKFHIGFDVRAGIVISLASIYDLEKHKSRRVLYKGYISELFVPYQDPTEEFYFKTFFDSGEFGFGLSTVSLIPNRDCPPHAQFIDTYIHSADGTPIFLENAICVFEQYGNIMWRHTETGIPNESIEESRTEVDLAIRTVVTVGNYDNVLDWEFKTSGWMKPSIALSGILEIKGTNIKHKDEIKEEIHGKLVSANSIGIYHDHFYIYYLDFDIDGTQNSFEKTSLKTVRIVDGGSKRKSYWTTETQTAKTESDAKITIGLAPAELVVVNPNIKTAVGNEVGYRLIPAIPAHPLLTEDDYPQIRGAFTNYNVWVTPYNRTEKWAGGLYVDHSRGDDTLAVWTKKNREIVNKDIVMWHVVGIHHVPAQEDFPIMPLLSTSFELRPTNFFERNPVLKTLPPRDFTWPGCSN,./data/raw/alphafold//AF-P49252-F1-model_v4.pdb,3560,3518,1291,3241
+678,20421,20726,MKKFPEGFLWGVATASYQIEGSPLADGAGMSIWHTFSHTPGNVKNGDTGDVACDHYNRWKEDIEIIEKIGAKAYRFSISWPRILPEGTGKVNQKGLDFYNRIIDTLLEKNITPFITIYHWDLPFSLQLKGGWANRDIADWFAEYSRVLFENFGDRVKHWITLNEPWVVAIVGHLYGVHAPGMKDIYVAFHTVHNLLRAHAKSVKVFRETVKDGKIGIVFNNGYFEPASEREEDIRAARFMHQFNNYPLFLNPIYRGEYPDLVLEFAREYLPRNYEDDMEEIKQEIDFVGLNYYSGHMVKYDPNSPARVSFVERNLPKTAMGWEIVPEGIYWILKGVKEEYNPQEVYITENGAAFDDVVSEGGKVHDQNRIDYLRAHIEQVWRAIQDGVPLKGYFVWSLLDNFEWAEGYSKRFGIVYVDYNTQKRIIKDSGYWYSNVIKNNGLTD,sabio,B9K7M5,O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O>>OCC1OC(O)C(O)C(O)C1O,285.04,33.2717722930995,75.0,7.2,3.2.1.74,2337.0,2.4549058093429594,O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O,OCC1OC(O)C(O)C(O)C1O,2.4549058093429594,O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O__MKKFPEGFLWGVATASYQIEGSPLADGAGMSIWHTFSHTPGNVKNGDTGDVACDHYNRWKEDIEIIEKIGAKAYRFSISWPRILPEGTGKVNQKGLDFYNRIIDTLLEKNITPFITIYHWDLPFSLQLKGGWANRDIADWFAEYSRVLFENFGDRVKHWITLNEPWVVAIVGHLYGVHAPGMKDIYVAFHTVHNLLRAHAKSVKVFRETVKDGKIGIVFNNGYFEPASEREEDIRAARFMHQFNNYPLFLNPIYRGEYPDLVLEFAREYLPRNYEDDMEEIKQEIDFVGLNYYSGHMVKYDPNSPARVSFVERNLPKTAMGWEIVPEGIYWILKGVKEEYNPQEVYITENGAAFDDVVSEGGKVHDQNRIDYLRAHIEQVWRAIQDGVPLKGYFVWSLLDNFEWAEGYSKRFGIVYVDYNTQKRIIKDSGYWYSNVIKNNGLTD,./data/raw/alphafold//AF-B9K7M5-F1-model_v4.pdb,221,2811,5133,5994
+679,2692,2728,MPKIVVVGAVAGGATCASQIRRLDKESDIIIFEKDRDMSFANCALPYVIGEVVEDRRYALAYTPEKFYDRKQITVKTYHEVIAINDERQTVSVLNRKTNEQFEESYDKLILSPGASANSLGFESDITFTLRNLEDTDAIDQFIKANQVDKVLVVGAGYVSLEVLENLNERGLHPTLIHRSDKINKLMDADMNQPILDELDKREIPYRLNEEINAINGNEITFKSGKVEHYDMIIEGVGTHPNSKFIESSNIKLDRKGFIPVNDKFETNVPNIYAIGDIATSHYRHVDLPASVPLAWGAHRAASIVAEQIAGNDTIEFKGFLGNNIVKFFDYTFASVGVKPNELKQFDYKMVEVTQGAHANYYPGNSPLHLRVYYDTSNRQILRAAAVGKEGADKRIDVLSMAMMNQLTVDELTEFEVAYAPPYSHPKDLINMIGYKAK,sabio,O52582,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSSCCNC(=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]>>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.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,27.0,20.23862103116792,25.0,7.0,1.8.1.14,1280.0,1.4313637641589874,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSSCCNC(=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],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.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,3.008600171761917,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSSCCNC(=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]__MPKIVVVGAVAGGATCASQIRRLDKESDIIIFEKDRDMSFANCALPYVIGEVVEDRRYALAYTPEKFYDRKQITVKTYHEVIAINDERQTVSVLNRKTNEQFEESYDKLILSPGASANSLGFESDITFTLRNLEDTDAIDQFIKANQVDKVLVVGAGYVSLEVLENLNERGLHPTLIHRSDKINKLMDADMNQPILDELDKREIPYRLNEEINAINGNEITFKSGKVEHYDMIIEGVGTHPNSKFIESSNIKLDRKGFIPVNDKFETNVPNIYAIGDIATSHYRHVDLPASVPLAWGAHRAASIVAEQIAGNDTIEFKGFLGNNIVKFFDYTFASVGVKPNELKQFDYKMVEVTQGAHANYYPGNSPLHLRVYYDTSNRQILRAAAVGKEGADKRIDVLSMAMMNQLTVDELTEFEVAYAPPYSHPKDLINMIGYKAK,./data/raw/alphafold//AF-O52582-F1-model_v4.pdb,1709,1329,6254,1599
+680,11733,11891,MLPKANRIPYAMTVHGDTRIDNYYWLRDDTRSQPEVLDYLHQENEYGRKVMTSQQALQDRILKEIIDRIPPREVSAPYVKNGYRYRYIYEPGCEYAIYQRQSALSEEWDVWETLLDANQRAAHSEFYTLGGLAITPDNTIMALAEDYLSRRQYGLRFRNLESGNWYPELLDNVAPEFVWANDSLTLYYVRKHKKTLLPYQVWRHTIGTPSSQDELVYEEKDDTFYVSLHKTTSQHYVVIHLASATTSEVLLLDAELADAEPFSFLPRRKDHEYSLDHYQHKFYLRSNRNGKNFGLYRTRVRNENAWEELIPPREHIMLEGFTLFTDWLVVEERQRGLTSLRQINRKTREVIGIAFDDPAYVTWLAYNPEPETSRLRYGYSSMTTPDTLFELDMDTGERRVLKQTEVPGFDSGCYQSEHLWITARDGVEVPVSLVYHQKYFRKGQNPLLVYGYGSYGSSIDADFSSSRLSLLDRGFVYAIVHVRGGGELGQQWYEDGKFLKKRNTFNDYLDACDALLKLGYGSPSLCYGMGGSAGGMLMGVAINERPELFHGVIAQVPFVDVLTTMLDESIPLTTGEFEEWGNPQDIEYYDYMKSYSPYDNVKAQDYPHLLVTTGLHDSQVQYWEPAKWVAKLRELKTDQRLLLLCTDMDSGHGGKSGRFKSYEGVALEFAFLIGLAQGTLHSA,brenda,A0A0H3NCA6,Cc1cc(=O)oc2cc(N=C(O)C(CCCNC(=N)N)N=C(O)C(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,1260.0,0.0,37.0,8.0,3.4.21.83,28901.0,3.100370545117563,Cc1cc(=O)oc2cc(N=C(O)C(CCCNC(=N)N)N=C(O)C(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,3.100370545117563,Cc1cc(=O)oc2cc(N=C(O)C(CCCNC(=N)N)N=C(O)C(Cc3ccccc3)N=C(O)OCc3ccccc3)ccc12.O__MLPKANRIPYAMTVHGDTRIDNYYWLRDDTRSQPEVLDYLHQENEYGRKVMTSQQALQDRILKEIIDRIPPREVSAPYVKNGYRYRYIYEPGCEYAIYQRQSALSEEWDVWETLLDANQRAAHSEFYTLGGLAITPDNTIMALAEDYLSRRQYGLRFRNLESGNWYPELLDNVAPEFVWANDSLTLYYVRKHKKTLLPYQVWRHTIGTPSSQDELVYEEKDDTFYVSLHKTTSQHYVVIHLASATTSEVLLLDAELADAEPFSFLPRRKDHEYSLDHYQHKFYLRSNRNGKNFGLYRTRVRNENAWEELIPPREHIMLEGFTLFTDWLVVEERQRGLTSLRQINRKTREVIGIAFDDPAYVTWLAYNPEPETSRLRYGYSSMTTPDTLFELDMDTGERRVLKQTEVPGFDSGCYQSEHLWITARDGVEVPVSLVYHQKYFRKGQNPLLVYGYGSYGSSIDADFSSSRLSLLDRGFVYAIVHVRGGGELGQQWYEDGKFLKKRNTFNDYLDACDALLKLGYGSPSLCYGMGGSAGGMLMGVAINERPELFHGVIAQVPFVDVLTTMLDESIPLTTGEFEEWGNPQDIEYYDYMKSYSPYDNVKAQDYPHLLVTTGLHDSQVQYWEPAKWVAKLRELKTDQRLLLLCTDMDSGHGGKSGRFKSYEGVALEFAFLIGLAQGTLHSA,./data/raw/alphafold//AF-A0A0H3NCA6-F1-model_v4.pdb,2185,4406,1915,3744
+681,12459,12629,MKRINALTIAGTDPSGGAGIQADLKTFSALGAYGCSVITALVAQNTRGVQSVYRIEPDFVAAQLDSVFSDVRIDTTKIGMLAETDIVEAVAERLQRYQIQNVVLDTVMLAKSGDPLLSPSAVATLRSRLLPQVSLITPNLPEAAALLDAPHARTEQEMLEQGRSLLAMGCGAVLMKGGHLDDEQSPDWLFTREGEQRFTAPRIMTKNTHGTGCTLSAALAALRPRHTNWADTVQEAKSWLSSALAQADTLEVGHGIGPVHHFHAWW,brenda,P76422,Cc1ncc(COP(=O)(O)O)c(=N)[nH]1.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)OP(=O)(O)O)c(=N)[nH]1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.034,7.820849325734197e-15,25.0,8.0,2.7.4.7,562.0,-1.4685210829577449,Cc1ncc(COP(=O)(O)O)c(=N)[nH]1.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)OP(=O)(O)O)c(=N)[nH]1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-1.4685210829577449,Cc1ncc(COP(=O)(O)O)c(=N)[nH]1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MKRINALTIAGTDPSGGAGIQADLKTFSALGAYGCSVITALVAQNTRGVQSVYRIEPDFVAAQLDSVFSDVRIDTTKIGMLAETDIVEAVAERLQRYQIQNVVLDTVMLAKSGDPLLSPSAVATLRSRLLPQVSLITPNLPEAAALLDAPHARTEQEMLEQGRSLLAMGCGAVLMKGGHLDDEQSPDWLFTREGEQRFTAPRIMTKNTHGTGCTLSAALAALRPRHTNWADTVQEAKSWLSSALAQADTLEVGHGIGPVHHFHAWW,./data/raw/alphafold//AF-P76422-F1-model_v4.pdb,2099,4291,4175,4031
+682,17692,17934,MSSCQWSSFTRVSLSPFPLQPAQLNTALNLKKQCCFTKSSMEDSSSQGHQSAFQFLTKKPYEPPPWASLLSPIPSHTFSLGHFPTPIHKWNLPNLPKNTEVWLKRDDMSGMQLSGNKVRKLEFLLADAVAQGADCIVTIGGIQSNHCRATAVAAKYLNLDCYLILRTSKLLVDKDPGLTGNLLVDRLVGAHIDLVSKEEYAKVGGEALTKILKEKLLNEGRKPYVIPVGGSNSLGTWGYIEAIRELEQQLQHLSIEQKFDDIVVACGSGGTVAGLSIASMLSGLKAKINAFCVCDDPDYFYEYVQGLLDGITAGVSSRDIVSIKTAKGLGYALSTTDELKFVKQVAETTGVILDPVYSGKAAYGMMKDMGENPTKWEGRKILFIHTGGLLGLYDKADEIGSLMGKWRKMDINESIPRQDGIGKMF,brenda,B2MWN0,N[C@H](CS)C(=O)O.O>>CC(=O)C(=O)O.N.[S-2],13800.0,0.7269160873453212,30.0,7.6,4.4.1.15,4081.0,4.139879086401237,N[C@H](CS)C(=O)O.O,CC(=O)C(=O)O.N.[S-2],4.139879086401237,N[C@H](CS)C(=O)O.O__MSSCQWSSFTRVSLSPFPLQPAQLNTALNLKKQCCFTKSSMEDSSSQGHQSAFQFLTKKPYEPPPWASLLSPIPSHTFSLGHFPTPIHKWNLPNLPKNTEVWLKRDDMSGMQLSGNKVRKLEFLLADAVAQGADCIVTIGGIQSNHCRATAVAAKYLNLDCYLILRTSKLLVDKDPGLTGNLLVDRLVGAHIDLVSKEEYAKVGGEALTKILKEKLLNEGRKPYVIPVGGSNSLGTWGYIEAIRELEQQLQHLSIEQKFDDIVVACGSGGTVAGLSIASMLSGLKAKINAFCVCDDPDYFYEYVQGLLDGITAGVSSRDIVSIKTAKGLGYALSTTDELKFVKQVAETTGVILDPVYSGKAAYGMMKDMGENPTKWEGRKILFIHTGGLLGLYDKADEIGSLMGKWRKMDINESIPRQDGIGKMF,./data/raw/alphafold//AF-B2MWN0-F1-model_v4.pdb,2825,2400,2678,5519
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+691,11923,12083,MNKILFYLFVYGVVNSAAYDLLKAPNYFEEFVHRFNKDYGSEVEKLRRFKIFQHNLNEIINKNQNDSAKYEINKFSDLSKDETIAKYTGLSLPIQTQNFCKVIVLDQPPGKGPLEFDWRRLNKVTSVKNQGMCGACWAFATLASLESQFAIKHNQLINLSEQQMIDCDFVDAGCNGGLLHTAFEAIIKMGGVQLESDYPYEADNNNCRMNSNKFLVQVKDCYRYITVYEEKLKDLLRLVGPIPMAIDAADIVNYKQGIIKYCFNSGLNHAVLLVGYGVENNIPYWTFKNTWGTDWGEDGFFRVQQNINACGMRNELASTAVIY,brenda,P25783,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,0.95,0.0,,5.125,3.4.22.50,46015.0,-0.0222763947111522,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,-0.0222763947111522,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc3ccccc3)N=C(O)OCc3ccccc3)ccc12.O__MNKILFYLFVYGVVNSAAYDLLKAPNYFEEFVHRFNKDYGSEVEKLRRFKIFQHNLNEIINKNQNDSAKYEINKFSDLSKDETIAKYTGLSLPIQTQNFCKVIVLDQPPGKGPLEFDWRRLNKVTSVKNQGMCGACWAFATLASLESQFAIKHNQLINLSEQQMIDCDFVDAGCNGGLLHTAFEAIIKMGGVQLESDYPYEADNNNCRMNSNKFLVQVKDCYRYITVYEEKLKDLLRLVGPIPMAIDAADIVNYKQGIIKYCFNSGLNHAVLLVGYGVENNIPYWTFKNTWGTDWGEDGFFRVQQNINACGMRNELASTAVIY,./data/raw/esmfold//ESMFold-P25783-v1.pdb,1932,4076,1931,3764
+692,20768,21079,MKSLVVVVLLLAVGLGAGQNNKGWWKNAVFYQIYPRSFMDSNNDGIGDLQGIKDKLSHFTESGITAIWLSPIYRSPMVDFGYDISDFKDIDPIFGTTEDLQDLTAEAKKRNLKVILDLVPNHTSDEHNWFQLSVNKTGKYKDYYVWVDPKNGTDPFEKRYPNNWLSVFNGTGWTFNEIRQQFYFHQFYKKQPDLNYRNPEVRKEMKSVMEFWLNNGIDGFRIDAIPHIYEVENISLNEPPIGQNLNLSLHASLNHIYTKDQPETYDLVREWRNFVDEYAKNNNRDEIVLLTEAYTSLNNTLRYYQYGANVPFNFKFITDANSSSTPEQFKTIIDNWVQGTPQNDVPNWVKGNHDRVRVSTRYPGRADHMIMLEMILPGVAVTYYGEEIGMEDNTTIYKYDVRDGCRTPFQWDNSINAGFSKVNESTLEKEWLPVHSSYKNGLNLEQEKKDNISHYHLYTNLTALRKRDVLKEGKLVTEILNKNVLAIVRQNEKEAVSLLINFSKNNTVVNISKLVDEGNNKIYTSSINSKLTANELVNPMAIDIPGDSSVIITSGATIVNYSIMTFLFVVFISFFQR,brenda,A1IHL0,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,8.7,0.0,37.0,5.0,3.2.1.20,292787.0,0.9395192526186184,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,0.9395192526186184,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__MKSLVVVVLLLAVGLGAGQNNKGWWKNAVFYQIYPRSFMDSNNDGIGDLQGIKDKLSHFTESGITAIWLSPIYRSPMVDFGYDISDFKDIDPIFGTTEDLQDLTAEAKKRNLKVILDLVPNHTSDEHNWFQLSVNKTGKYKDYYVWVDPKNGTDPFEKRYPNNWLSVFNGTGWTFNEIRQQFYFHQFYKKQPDLNYRNPEVRKEMKSVMEFWLNNGIDGFRIDAIPHIYEVENISLNEPPIGQNLNLSLHASLNHIYTKDQPETYDLVREWRNFVDEYAKNNNRDEIVLLTEAYTSLNNTLRYYQYGANVPFNFKFITDANSSSTPEQFKTIIDNWVQGTPQNDVPNWVKGNHDRVRVSTRYPGRADHMIMLEMILPGVAVTYYGEEIGMEDNTTIYKYDVRDGCRTPFQWDNSINAGFSKVNESTLEKEWLPVHSSYKNGLNLEQEKKDNISHYHLYTNLTALRKRDVLKEGKLVTEILNKNVLAIVRQNEKEAVSLLINFSKNNTVVNISKLVDEGNNKIYTSSINSKLTANELVNPMAIDIPGDSSVIITSGATIVNYSIMTFLFVVFISFFQR,./data/raw/alphafold//AF-A1IHL0-F1-model_v4.pdb,450,3119,5406,6287
+693,10832,10987,MFNIKKRKESITGIPPINVNSPQSVPLSGTLQSPLITPNSPNFVSRQCPFKKFGCSSFLVSKAEFDNHLKDDAQFHLQLAVEKFDHQFDLHTQLMAHFTEQMEDQLEKTMKVVRNHTDSLGGNVQTKLDEGIEKCMAFAKKVEQQQQQLAKRLITQQIQEKKSTSSPLVKGGISGGGGSGGDDSFDGANISSMSTSKQELQQELQSLSIKMKKELTELSDELSQKLERSTGNIDIKIKRIEGEVNEKIDKRQLVSTIDDSIGKKTDSIGYTLESSIIKKVEEKEKKKSEQNQLLFDSKIESLKDKIKIIETQQLDTSSEVRKLKLESTSSGNLMAGLNGTSGRPSSSSHFIPSSVSAAANNINKNEIMEEVKKVEEKLQKKIREEIDNTKSELSKVERSVKDNRSEIEGLEKDCKNQFDKQDNKIKQVEDDLKKSDSLLLLMQNNLKKYNEFVDRERDRESERLKLQDSIKRLEQNQKKIEAEIQEGNEQVERVLREEASISPISSVPKSPITTKRSSIILNSPPMTSQQSSPKIQDLLSSSGSSSVSGINISSETGEMGILWEFDPIINKWIRLSMKLKVERKPFAEGALREAYHTVSLGVGTDENYPLGTTTKLFPPIEMISPISKNNEAMTQLKNGTKFVLKLYKKEAEQQASRELYFEDVKMQMVCRDWGNKFNQKKPPKKIEFLMSWVVELIDRSPSSNGQPILCSIEPLLVGEFKKNNSNYGAVLTNRSTPQAFSHFTYELSNKQMIVVDIQGVDDLYTDPQIHTPDGKGFGLGNLGKAGINKFITTHKCNAVCALLDLDVKLGGVLSGNNKKQLQQGTMVMPDILPELMPSDNTIKVGAKQLPKAEFSKKDLKCVSTIQSFRERVNSIAFFDNQKLLCAGYGDGTYRVFDVNDNWKCLYTVNGHRKSIESIACNSNYIFTSSPDNTIKVHIIRSGNTKCIETLVGHTGEVNCVVANEKYLFSCSYDKTIKVWDLSTFKEIKSFEGVHTKYIKTLALSGRYLFSGGNDQIIYVWDTETLSMLFNMQGHEDWVLSLHCTASYLFSTSKDNVIKIWDLSNFSCIDTLKGHWNSVSSCVVKDRYLYSGSEDNSIKVWDLDTLECVYTIPKSHSLGVKCLMVFNNQIISAAFDGSIKVWEWQSK,brenda,P42527,C[C@H](N=C(O)[C@@H](N)Cc1ccc(O)cc1)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@H](C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>,14.0,99.9435527025837,25.0,7.0,2.7.11.7,44689.0,1.146128035678238,C[C@H](N=C(O)[C@@H](N)Cc1ccc(O)cc1)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@H](C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,,1.146128035678238,C[C@H](N=C(O)[C@@H](N)Cc1ccc(O)cc1)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CC(=O)O)C(O)=N[C@H](C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](Cc1ccc(O)cc1)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MFNIKKRKESITGIPPINVNSPQSVPLSGTLQSPLITPNSPNFVSRQCPFKKFGCSSFLVSKAEFDNHLKDDAQFHLQLAVEKFDHQFDLHTQLMAHFTEQMEDQLEKTMKVVRNHTDSLGGNVQTKLDEGIEKCMAFAKKVEQQQQQLAKRLITQQIQEKKSTSSPLVKGGISGGGGSGGDDSFDGANISSMSTSKQELQQELQSLSIKMKKELTELSDELSQKLERSTGNIDIKIKRIEGEVNEKIDKRQLVSTIDDSIGKKTDSIGYTLESSIIKKVEEKEKKKSEQNQLLFDSKIESLKDKIKIIETQQLDTSSEVRKLKLESTSSGNLMAGLNGTSGRPSSSSHFIPSSVSAAANNINKNEIMEEVKKVEEKLQKKIREEIDNTKSELSKVERSVKDNRSEIEGLEKDCKNQFDKQDNKIKQVEDDLKKSDSLLLLMQNNLKKYNEFVDRERDRESERLKLQDSIKRLEQNQKKIEAEIQEGNEQVERVLREEASISPISSVPKSPITTKRSSIILNSPPMTSQQSSPKIQDLLSSSGSSSVSGINISSETGEMGILWEFDPIINKWIRLSMKLKVERKPFAEGALREAYHTVSLGVGTDENYPLGTTTKLFPPIEMISPISKNNEAMTQLKNGTKFVLKLYKKEAEQQASRELYFEDVKMQMVCRDWGNKFNQKKPPKKIEFLMSWVVELIDRSPSSNGQPILCSIEPLLVGEFKKNNSNYGAVLTNRSTPQAFSHFTYELSNKQMIVVDIQGVDDLYTDPQIHTPDGKGFGLGNLGKAGINKFITTHKCNAVCALLDLDVKLGGVLSGNNKKQLQQGTMVMPDILPELMPSDNTIKVGAKQLPKAEFSKKDLKCVSTIQSFRERVNSIAFFDNQKLLCAGYGDGTYRVFDVNDNWKCLYTVNGHRKSIESIACNSNYIFTSSPDNTIKVHIIRSGNTKCIETLVGHTGEVNCVVANEKYLFSCSYDKTIKVWDLSTFKEIKSFEGVHTKYIKTLALSGRYLFSGGNDQIIYVWDTETLSMLFNMQGHEDWVLSLHCTASYLFSTSKDNVIKIWDLSNFSCIDTLKGHWNSVSSCVVKDRYLYSGSEDNSIKVWDLDTLECVYTIPKSHSLGVKCLMVFNNQIISAAFDGSIKVWEWQSK,./data/raw/alphafold//AF-P42527-F1-model_v4.pdb,3671,3669,1466,3431
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+731,1916,1947,MESIRLSNAAGTISNDILAQVTFANEAIYPLLEKRRAEIENVTRKTFRYGALPGSEMDVYYPSSTPSGKAPVLAFVHGGAYVHGSKTHPPPGDLIYKNVGAFYASQGFVTVIPDYRKLPGMKWPDAPSDIASALTFLVAHSSDVNASAPTAADVQNIFLVGHSAGGAIASDVLLAPGLLPANVRRSVRGLIVFGGMMHYRGLEYPIPPFVLPGYYGTDEDVRAHEPLGLLESASDEIVRGLPDVLMVLSEHDVAAMRAAVTDFRSALAERTGKDVPLLVAQGHNHISPHYALSSGEGEEWGHDVIRWMRAKLASGNGVPATE,brenda,A0A1S5T4Z0,CC(=O)Oc1ccc2ccccc2c1.O>>CC(=O)O.Oc1ccc2ccccc2c1,5310.0,1.388287186733619e-14,45.0,3.5,3.1.1.79,5331.0,3.725094521081469,CC(=O)Oc1ccc2ccccc2c1.O,CC(=O)O.Oc1ccc2ccccc2c1,3.725094521081469,CC(=O)Oc1ccc2ccccc2c1.O__MESIRLSNAAGTISNDILAQVTFANEAIYPLLEKRRAEIENVTRKTFRYGALPGSEMDVYYPSSTPSGKAPVLAFVHGGAYVHGSKTHPPPGDLIYKNVGAFYASQGFVTVIPDYRKLPGMKWPDAPSDIASALTFLVAHSSDVNASAPTAADVQNIFLVGHSAGGAIASDVLLAPGLLPANVRRSVRGLIVFGGMMHYRGLEYPIPPFVLPGYYGTDEDVRAHEPLGLLESASDEIVRGLPDVLMVLSEHDVAAMRAAVTDFRSALAERTGKDVPLLVAQGHNHISPHYALSSGEGEEWGHDVIRWMRAKLASGNGVPATE,./data/raw/alphafold//AF-A0A1S5T4Z0-F1-model_v4.pdb,1505,1055,881,1215
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+747,9461,9603,MNRRNFLKFNALTLASMGVAYANPMHDMHSMHKNHSINHDLDTSFINFAPKNLKLLDPKQFPQGEILKALPLLKNESKEKNIFRATIEIKENHIELIKGKKTLFYTYNGLVPAPKIEVFEGDKLEILVKNKLKEATTIHWHGVPVPPDQDGSPHDPILAGEERIYRFEIPQDSAGTYWYHPHPHYTTSKQVFMGLAGAFVIKAKKDALSHLKERDLMISDLRLDENAQIPNNNLNDWLNGREGEFVLINGQFKPKIKLATNERIRIYNATAARYLNLRIQGAKFILVGTDGGLIEKAIYKEEFFLSPASRVEVLIDAPKDGEFRLESAYYDRDKMMVKEEPNTLFLANINLKKENVELPKNLKIFKPSEEPKEFKEIIMSEDHMQMHGMMGKSESELKIALASMFLINGKSYDLKRIDLSSKLGVVEDWIVINKSHMDHPFHIHGTQFELISSKLNGKVQKAEFRALRDTINVRPNEELRLRMKQDFKGLRMYHCHILEHEDLGMMGNLEVKE,sabio,A0A0H3PBA4,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O>>O,600.0,90.9985682302694,37.0,8.0,1.10.3.2,197.0,2.778151250383644,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O,O,2.778151250383644,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O__MNRRNFLKFNALTLASMGVAYANPMHDMHSMHKNHSINHDLDTSFINFAPKNLKLLDPKQFPQGEILKALPLLKNESKEKNIFRATIEIKENHIELIKGKKTLFYTYNGLVPAPKIEVFEGDKLEILVKNKLKEATTIHWHGVPVPPDQDGSPHDPILAGEERIYRFEIPQDSAGTYWYHPHPHYTTSKQVFMGLAGAFVIKAKKDALSHLKERDLMISDLRLDENAQIPNNNLNDWLNGREGEFVLINGQFKPKIKLATNERIRIYNATAARYLNLRIQGAKFILVGTDGGLIEKAIYKEEFFLSPASRVEVLIDAPKDGEFRLESAYYDRDKMMVKEEPNTLFLANINLKKENVELPKNLKIFKPSEEPKEFKEIIMSEDHMQMHGMMGKSESELKIALASMFLINGKSYDLKRIDLSSKLGVVEDWIVINKSHMDHPFHIHGTQFELISSKLNGKVQKAEFRALRDTINVRPNEELRLRMKQDFKGLRMYHCHILEHEDLGMMGNLEVKE,./data/raw/alphafold//AF-A0A0H3PBA4-F1-model_v4.pdb,3406,2296,1000,2892
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+751,13542,13719,MSSCSRVALVTGANKGIGFAITRELCRKFSGDVVLTARDEERGKAAVQQLQAEGLSPRFHQLDIDDLQSIRALRDFLRKEYGGLNVLVNNAGIAFRMDDPTPFDIQAEMTLKTNFFATRNVCNELLPIMKPHGRVVNVSSLQGSKALENCSEDLQERFRCNTLTEGDLVDLMKKFVEDTKNEVHEREGWPDSAYGVSKLGVTVLSRILAQQLGEKRKADRILLNACCPGWVKTDMARDQGSRTVEEGAETPVYLALLPPDATEPQGQLVCDKVVQTW,brenda,Q9JJN7,N=C(O)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=Cc1ccc([N+](=O)[O-])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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O=[N+]([O-])c1ccc(CO)cc1,0.0283,6.329621477194912e-15,25.0,6.5,1.1.1.184,10029.0,-1.5482135644757098,N=C(O)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=Cc1ccc([N+](=O)[O-])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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O=[N+]([O-])c1ccc(CO)cc1,-1.5482135644757098,N=C(O)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=Cc1ccc([N+](=O)[O-])cc1.[H+]__MSSCSRVALVTGANKGIGFAITRELCRKFSGDVVLTARDEERGKAAVQQLQAEGLSPRFHQLDIDDLQSIRALRDFLRKEYGGLNVLVNNAGIAFRMDDPTPFDIQAEMTLKTNFFATRNVCNELLPIMKPHGRVVNVSSLQGSKALENCSEDLQERFRCNTLTEGDLVDLMKKFVEDTKNEVHEREGWPDSAYGVSKLGVTVLSRILAQQLGEKRKADRILLNACCPGWVKTDMARDQGSRTVEEGAETPVYLALLPPDATEPQGQLVCDKVVQTW,./data/raw/alphafold//AF-Q9JJN7-F1-model_v4.pdb,1319,3880,4510,4413
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+753,7340,7462,MLIKSFAIESNILKDNPLKDPNVRKVYSIEVGDVTQAPIVIYLSGFFSSSITLLNYDPLSESINEKLDRLHKEGKIKNLIFILPDLFTKLGGNQYINSTAVGMYEDFIIKELIPYLFDIYGKKDVILMGKSSGGYGSIVLAMKYPEIIRGLINHSGDSYFEYVYLPYFPHAIRHIRREGGLNKWLEKYWSKENKKDKDDLNTLNIIAMAAFYSPEGTEIVLPFDLDTGEIIEDVWKRWLEKDPVRLVEKYSENLKKLRLIYLDVGNKDEFRINFGMRILHKKMLRYNVKHEFEEYEGGHFNTSYRYDISISLISKVFNGDNS,brenda,Q96Z02,CCCCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCCCCCCCCCCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,0.11,7.723584438104715e-15,80.0,9.0,3.1.1.1,111955.0,-0.958607314841775,CCCCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCCCCCCCCCCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,-0.958607314841775,CCCCCCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MLIKSFAIESNILKDNPLKDPNVRKVYSIEVGDVTQAPIVIYLSGFFSSSITLLNYDPLSESINEKLDRLHKEGKIKNLIFILPDLFTKLGGNQYINSTAVGMYEDFIIKELIPYLFDIYGKKDVILMGKSSGGYGSIVLAMKYPEIIRGLINHSGDSYFEYVYLPYFPHAIRHIRREGGLNKWLEKYWSKENKKDKDDLNTLNIIAMAAFYSPEGTEIVLPFDLDTGEIIEDVWKRWLEKDPVRLVEKYSENLKKLRLIYLDVGNKDEFRINFGMRILHKKMLRYNVKHEFEEYEGGHFNTSYRYDISISLISKVFNGDNS,./data/raw/alphafold//AF-Q96Z02-F1-model_v4.pdb,1490,1037,863,1192
+754,15266,15479,MDLGLAGRRALVTGAGKGIGRSTVLALQAAGAHVVAVSRTQADLDSLVSECPGVETVCVDLADWEATEQALSSVGPVDLLVNNAAVALLQPFLEVTKEAFDMSFNVNLRAVIQVSQIVARGMIARGAPGAIVNVSSQASQRALANHSVYCSTKGALDMLTKMMALELGPHKIRVNAVNPTVVMTSMGRTNWSDPHKAKVMLDRIPLGKFAEVENVVDAILFLLSHRSNMTTGSTLPVDGGFLVT,sabio,Q91XV4,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)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,8.7,0.0,25.0,7.0,1.1.1.10,10036.0,0.9395192526186184,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)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,0.9395192526186184,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)CO.[H]__MDLGLAGRRALVTGAGKGIGRSTVLALQAAGAHVVAVSRTQADLDSLVSECPGVETVCVDLADWEATEQALSSVGPVDLLVNNAAVALLQPFLEVTKEAFDMSFNVNLRAVIQVSQIVARGMIARGAPGAIVNVSSQASQRALANHSVYCSTKGALDMLTKMMALELGPHKIRVNAVNPTVVMTSMGRTNWSDPHKAKVMLDRIPLGKFAEVENVVDAILFLLSHRSNMTTGSTLPVDGGFLVT,./data/raw/alphafold//AF-Q91XV4-F1-model_v4.pdb,1316,3874,6191,847
+755,9602,9748,MTSKVYDPEQRKRMITGPQWWARCKQMNVLDSFINYYDSEKHAENAVIFLHGNAASSYLWRHVVPHIEPVARCIIPDLIGMGKSGKSGNGSYRLLDHYKYLTAWFELLNLPKKIIFVGHDWGACLAFHYSYEHQDKIKAIVHAESVVDVIESWDEWPDIEEDIALIKSEEGEKMVLENNFFVETMLPSKIMRKLEPEEFAAYLEPFKEKGEVRRPTLSWPREIPLVKGGKPDVVQIVRNYNAYLRASDDLPKMFIESDPGFFSNAIVEGAKKFPNTEFVKVKGLHFSQEDAPDEMGKYIKSFVERVLKNEQ,uniprot_search,P27652,COc1ccc(-c2cn3c(=O)c(Cc4ccccc4)nc-3c(Cc3ccccc3)[nH]2)cc1.O=O>>CC(C)[C@H](N=C(O)[C@@H](N)Cc1cnc[nH]1)C(=O)O.O=C=O,0.983,20.616314889671468,20.0,7.2,1.13.12.5,6136.0,-0.0074464821678643,COc1ccc(-c2cn3c(=O)c(Cc4ccccc4)nc-3c(Cc3ccccc3)[nH]2)cc1.O=O,CC(C)[C@H](N=C(O)[C@@H](N)Cc1cnc[nH]1)C(=O)O.O=C=O,-0.0074464821678643,COc1ccc(-c2cn3c(=O)c(Cc4ccccc4)nc-3c(Cc3ccccc3)[nH]2)cc1.O=O__MTSKVYDPEQRKRMITGPQWWARCKQMNVLDSFINYYDSEKHAENAVIFLHGNAASSYLWRHVVPHIEPVARCIIPDLIGMGKSGKSGNGSYRLLDHYKYLTAWFELLNLPKKIIFVGHDWGACLAFHYSYEHQDKIKAIVHAESVVDVIESWDEWPDIEEDIALIKSEEGEKMVLENNFFVETMLPSKIMRKLEPEEFAAYLEPFKEKGEVRRPTLSWPREIPLVKGGKPDVVQIVRNYNAYLRASDDLPKMFIESDPGFFSNAIVEGAKKFPNTEFVKVKGLHFSQEDAPDEMGKYIKSFVERVLKNEQ,./data/raw/alphafold//AF-P27652-F1-model_v4.pdb,2119,3431,1170,3093
+756,18627,18898,MASRPVTLGIDLGTTSVKAALLEAAPSLPSGFVVLASCARAARAETESAVAGPQGREQDVTRIIQALNECLDALPRQQLQRVRGIGVSGQMHGILFWKAGQGCEWMEGGPAFVFEPRAVSHLVTWQDGRCNSSFLASLPKPDSHLSVATGFGCATIFWLLKNSPEFLKSYDAAGTIQDYVVAMLCGLPRPLMSDQNAASWGYFNTQSQSWNLDTLEKAGFPIHLLPDIAEPGSMAGRTSHTWFEIPKGTQVGIALGDLQASVYSCMGQRTDAVLNISTSVQLAASMPVGFQPLQTPDPAAPVAFFPYFDRTYLGVAASLNGGNVLATFVHMLVQWMADLGLEVEESTVYSRMIQAAAQQKDTHLTITPTVLGERHLPDQLASVTRISSSDLSLGHVTRALCRGIVQNLHSMLPFQQLKEWGVARVVGSGSALSRNEVLKQEVQRAFPFPVCFGQDVDAAFGAALVMLQRDLSQKEP,brenda,Q9D5J6,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]1OC(O)(CO)[C@@H](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=C(CO)[C@@H](O)[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)O,115.0,0.0,37.0,7.5,2.7.1.14,10090.0,2.060697840353612,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]1OC(O)(CO)[C@@H](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=C(CO)[C@@H](O)[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)O,2.060697840353612,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]1OC(O)(CO)[C@@H](O)[C@H](O)[C@@H]1O__MASRPVTLGIDLGTTSVKAALLEAAPSLPSGFVVLASCARAARAETESAVAGPQGREQDVTRIIQALNECLDALPRQQLQRVRGIGVSGQMHGILFWKAGQGCEWMEGGPAFVFEPRAVSHLVTWQDGRCNSSFLASLPKPDSHLSVATGFGCATIFWLLKNSPEFLKSYDAAGTIQDYVVAMLCGLPRPLMSDQNAASWGYFNTQSQSWNLDTLEKAGFPIHLLPDIAEPGSMAGRTSHTWFEIPKGTQVGIALGDLQASVYSCMGQRTDAVLNISTSVQLAASMPVGFQPLQTPDPAAPVAFFPYFDRTYLGVAASLNGGNVLATFVHMLVQWMADLGLEVEESTVYSRMIQAAAQQKDTHLTITPTVLGERHLPDQLASVTRISSSDLSLGHVTRALCRGIVQNLHSMLPFQQLKEWGVARVVGSGSALSRNEVLKQEVQRAFPFPVCFGQDVDAAFGAALVMLQRDLSQKEP,./data/raw/alphafold//AF-Q9D5J6-F1-model_v4.pdb,60,2534,2826,5672
+757,10667,10822,MVRASTIIFKSMQDIRKMQDKSKKDPTGGHFDYGRQGTSTTHVLSQILKEMEECYHVFLTPTGFGSVFLSIFSIVRPGDEIIVADPTYSPTRILTQDFLKEFNVKSVFYDPHDLKTLEKAITKKTKLIFVENPGSNTFDFQDLGKIVSIAKRNKIFSVIDNTWGTPYFLKPIKLGFDMSIVSATKYYSGHSDVMGGSLAVNKKVFKQVDKANKITGLRLGPDDAYLITRGLRTLDVRLDKHEKSAKQVAEFLSNYKNIKLLYPHKKDSFNFRMWKKYYSGASGLMGLKIKSKNKNSVIKFVNSLKLFGYGYSWGGFESLALYQDKREQGNREYLKLAKDEHLVRLHIGLEDPKDLIDDLKKSLKYIK,brenda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data/raw/alphafold//AF-Q4FME3-F1-model_v4.pdb,3721,3733,1535,3505
+758,4112,4165,MKFTTAAVLSALVSAEIAFAAPGGNGFARRQARRQARAAGLKASPFRQVNAKEATVESNWGGAILIGSDFDTVSATANVPSASGGSSAAGTAWVGIDGDTCQTAILQTGFDWYGDGTYDAWYEWYPEVSDDFSGITISEGDSIQMSVTATSDTSGSATLENLTTGQKVSKSFSNESSGSLCRTNAEFIIEDFEECNSNGSDCEFVPFASFSPAVEFTDCSVTSDGESVSLDDAQITQVIINNQDVTDCSVSGTTVSCSYV,uniprot_search,P15369,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccc(O)cc1)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](Cc1ccc(O)cc1)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-],86.0,2.84500883935766e-14,37.0,4.5,3.4.23.32,5539.0,1.934498451243568,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccc(O)cc1)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](Cc1ccc(O)cc1)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-],1.934498451243568,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccc(O)cc1)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
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+768,11184,11340,MQDWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRFGGTSAYSGASIWLPGTQVQERAGLPDSTENARTYLRALLGDAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADIGDLAGKVRPELDQDRTGQDHAPGPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDGRVVGAEVESGGETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALLDQAWFCPGVEQPDGSAAFMVGVRGGLVVDSAGERYLNESLPYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTAPAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFCPPNGGANAALTAIENGPFYAARIVLSDLGTKGGLVTDVNGRVLRADGSAIDGLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK,brenda,Q9RA02,C[C@]12CCC(=O)C=C1CC[C@@H]1C2=CC[C@]2(C)C(=O)CC[C@@H]12>>,22.3,10000000.0,30.0,8.0,1.3.99.4,1833.0,1.3483048630481609,C[C@]12CCC(=O)C=C1CC[C@@H]1C2=CC[C@]2(C)C(=O)CC[C@@H]12,,1.3483048630481609,C[C@]12CCC(=O)C=C1CC[C@@H]1C2=CC[C@]2(C)C(=O)CC[C@@H]12__MQDWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRFGGTSAYSGASIWLPGTQVQERAGLPDSTENARTYLRALLGDAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADIGDLAGKVRPELDQDRTGQDHAPGPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDGRVVGAEVESGGETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALLDQAWFCPGVEQPDGSAAFMVGVRGGLVVDSAGERYLNESLPYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTAPAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFCPPNGGANAALTAIENGPFYAARIVLSDLGTKGGLVTDVNGRVLRADGSAIDGLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK,./data/raw/alphafold//AF-Q9RA02-F1-model_v4.pdb,1436,956,760,1058
+769,10296,10447,MTETPAAPTAPLRARAEIDLGALRANVRTLRARVGDAAVMAVVKADGYGHGALRCARAAVEAGATWIGAALPEEALALRAAGLTQRVLCWLWVPGGPWRQAVEADIDVSLSGMWALREVTEAARAAGRTARVQLKADTGLGRNGCQPGADWEELVAAAVRAEAEGLVRVTGLWSHFACADEPGHPSIAAQLTRFREMVAYAEARGVRPEVRHIANSPATLTLPETYFDLVRPGIAMYGLSPSPEVGTPADFGLRPVMRLSASLALVKRVPGGHGVSYGHHYVTPGDTTLGLVPLGYGDGIPRHASGAGPVLIDGKWRTVAGRVAMDQFVVDLGGDEPPVGAEAVLFGPGDRGEPTAEDWATACGTIGYEIVTRIGTRVPRVYVHEVEGSDAVDGIDAVNGDARG,uniprot_search,A0A5C8GWG9,C[C@@H](N)C(=O)O>>C[C@H](N)C(=O)O,63.3,0.0,37.0,8.2,5.1.1.1,1914.0,1.801403710017355,C[C@@H](N)C(=O)O,C[C@H](N)C(=O)O,1.801403710017355,C[C@@H](N)C(=O)O__MTETPAAPTAPLRARAEIDLGALRANVRTLRARVGDAAVMAVVKADGYGHGALRCARAAVEAGATWIGAALPEEALALRAAGLTQRVLCWLWVPGGPWRQAVEADIDVSLSGMWALREVTEAARAAGRTARVQLKADTGLGRNGCQPGADWEELVAAAVRAEAEGLVRVTGLWSHFACADEPGHPSIAAQLTRFREMVAYAEARGVRPEVRHIANSPATLTLPETYFDLVRPGIAMYGLSPSPEVGTPADFGLRPVMRLSASLALVKRVPGGHGVSYGHHYVTPGDTTLGLVPLGYGDGIPRHASGAGPVLIDGKWRTVAGRVAMDQFVVDLGGDEPPVGAEAVLFGPGDRGEPTAEDWATACGTIGYEIVTRIGTRVPRVYVHEVEGSDAVDGIDAVNGDARG,./data/raw/alphafold//AF-A0A5C8GWG9-F1-model_v4.pdb,3641,3627,1421,3383
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+772,8369,8500,MFVSPKIALFGVASVLSAAHVLSAVAQEARTVSNPPTYILEPITKSRAKLETFAQNRATFPGEVLLDMNVTYLDRQVYNPATARYDRVRLRGYQDARQARPSGADTPLVGPTIDVRPGETVRITLNNMLPQDSTCGIGGGSANTPHCFNGTNLHSHGLWVNPSGNGDNVLVSIRPGVEFQYEYNIPADHPAGTFWYHPHLHGSTALQVSSGMSGALIIRGDRMPTPTETGDLDRLLKQPDGSDIPERVLVLQQIQYACTDSDGGITYDCKPGQVGGIESYDQFGPGSWPASGRFTSINGQVLGQLAPAVAGSIERWRMIHAGVRDTINFEIRRKTGTAALRTLTAADTHRWIDQNCGKDAIPYGVVAQDGLTMAQVQMRQQAVLQPGYRVDALVVLPQAGDYCLVDAAAPAAASVNQIAPSRRLLGIVTAVEGNAVNGEIGTYLQDWLISAAERTMAQDVAGKVIDDLKGEMRLSSFIPHPDIAPGEVTGEQQLVFNIDVKQPGGTFFEIDGKPYDTSRIDRTLPLGGVDEWTLRSDFVSHPFHIHVNPFQIIKIVDAAGNDVSALGANDDGDPQYAGLKNVWKDTLWIKNPGTDPSTSYTITVRTRYQRYIGEFVLHCHILDHEDQGMMQNVRITLPDGHGGTVTGHH,sabio,A0A0D4CYE3,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,3.46,1.4837780463171737,30.0,5.5,1.10.3.2,382.0,0.5390760987927766,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,0.5390760987927766,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O__MFVSPKIALFGVASVLSAAHVLSAVAQEARTVSNPPTYILEPITKSRAKLETFAQNRATFPGEVLLDMNVTYLDRQVYNPATARYDRVRLRGYQDARQARPSGADTPLVGPTIDVRPGETVRITLNNMLPQDSTCGIGGGSANTPHCFNGTNLHSHGLWVNPSGNGDNVLVSIRPGVEFQYEYNIPADHPAGTFWYHPHLHGSTALQVSSGMSGALIIRGDRMPTPTETGDLDRLLKQPDGSDIPERVLVLQQIQYACTDSDGGITYDCKPGQVGGIESYDQFGPGSWPASGRFTSINGQVLGQLAPAVAGSIERWRMIHAGVRDTINFEIRRKTGTAALRTLTAADTHRWIDQNCGKDAIPYGVVAQDGLTMAQVQMRQQAVLQPGYRVDALVVLPQAGDYCLVDAAAPAAASVNQIAPSRRLLGIVTAVEGNAVNGEIGTYLQDWLISAAERTMAQDVAGKVIDDLKGEMRLSSFIPHPDIAPGEVTGEQQLVFNIDVKQPGGTFFEIDGKPYDTSRIDRTLPLGGVDEWTLRSDFVSHPFHIHVNPFQIIKIVDAAGNDVSALGANDDGDPQYAGLKNVWKDTLWIKNPGTDPSTSYTITVRTRYQRYIGEFVLHCHILDHEDQGMMQNVRITLPDGHGGTVTGHH,./data/raw/alphafold//AF-A0A0D4CYE3-F1-model_v4.pdb,3398,2285,3986,2875
+773,19081,19367,MATKIVLVGAGSAQFGYGTLGDIFQSRALYGSEIILHDINPVALAVTEKTAKDFLAKEDLPFIVSATTDRRTALRGAEFVIISIEVGDRFALWDLDWQIPQQYGIQQVYGENGGPGGLFHSLRIIPPILDICADVADICPDAWIFNYSNPMSRICTTVHRRFPELNFVGMCHEIASLERYLPEMLNTSFDNLSLRAGGLNHFSVLLDARYKDSGKDAYADVRAKAPDYFASLPGYSDILAYTRQHGKLVDTEGSTERHALGGKDSSYPWADRTLFKEILEKFHCMPITVDSHFGEYISWAGEVSDHRGILDFYTFYRNYLGGVQPKIELKLKERVVSIMEGILTDSGYEEAAVNIPNRGFIKQLPEFIAVEVPAIIDRKGVHGIQVDIPPGIGGLLSNQIAIHDLTAEAIIAGSRDLVIQALLVDSVNNQCRAIPELVDVMISRQQPWLNYLK,sabio,Q9AI65,O.O=C(CO)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO>>OCC1OC(O)(CO)C(O)C1O.OCC1OC(O)C(O)C(O)C1O,1620.0,7.877151932420211e-15,25.0,7.5,3.2.1.20,55212.0,3.2095150145426308,O.O=C(CO)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO,OCC1OC(O)(CO)C(O)C1O.OCC1OC(O)C(O)C(O)C1O,3.2095150145426308,O.O=C(CO)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO__MATKIVLVGAGSAQFGYGTLGDIFQSRALYGSEIILHDINPVALAVTEKTAKDFLAKEDLPFIVSATTDRRTALRGAEFVIISIEVGDRFALWDLDWQIPQQYGIQQVYGENGGPGGLFHSLRIIPPILDICADVADICPDAWIFNYSNPMSRICTTVHRRFPELNFVGMCHEIASLERYLPEMLNTSFDNLSLRAGGLNHFSVLLDARYKDSGKDAYADVRAKAPDYFASLPGYSDILAYTRQHGKLVDTEGSTERHALGGKDSSYPWADRTLFKEILEKFHCMPITVDSHFGEYISWAGEVSDHRGILDFYTFYRNYLGGVQPKIELKLKERVVSIMEGILTDSGYEEAAVNIPNRGFIKQLPEFIAVEVPAIIDRKGVHGIQVDIPPGIGGLLSNQIAIHDLTAEAIIAGSRDLVIQALLVDSVNNQCRAIPELVDVMISRQQPWLNYLK,./data/raw/alphafold//AF-Q9AI65-F1-model_v4.pdb,235,2755,5068,5928
+774,11803,11961,MIVFLWIFVTTVLITGKSVLALNLHDFLTPKAEPAGELHALLVAGSNGWWNYRHQADVAHAYHLLLSKGILPEHIIVMMYDDIANDASNPFRGKLFNRPNGTDVYKGLKIDYSGSSVNPKNFLNVLEGNSEAVKGGNGRVINSKATDRIFVYFSDHGGEGLICFPDDVLTKKDLNSALQRMHKSKKYDEFVFYLEACESGSMFKKTLEPSMNIYAVTASNPVESSWATYCDYMDLPCLGDEFSVNWMEDSEKHDIDAEQLDAQFEDVKKMTKLSHVMHYGNLKIAKESVGWFQGEHGKKLSVQTQYEDDYPKVSWDARDVELMYMKKLQKTTTISLHAQALEQRVTQINQDRRDIEALFMSLVDNLLPNTNDKKEIFDKRNDVEDLSCHDDVVKAFDTTCIDVNRFDYALKYIYVLNNLCVKFGDSKKIINAMHATCSTATKQFL,brenda,I6R478,Cc1cc(=O)oc2cc(N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(O)OCc3ccccc3)ccc12.O>>C[C@H](N=C(O)OCc1ccccc1)C(O)=N[C@@H](C)C(O)=N[C@@H](CC(=N)O)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,0.33,9.731829052797307e-15,39.0,5.5,3.4.22.34,29172.0,-0.4814860601221125,Cc1cc(=O)oc2cc(N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(O)OCc3ccccc3)ccc12.O,C[C@H](N=C(O)OCc1ccccc1)C(O)=N[C@@H](C)C(O)=N[C@@H](CC(=N)O)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,-0.4814860601221125,Cc1cc(=O)oc2cc(N=C(O)[C@H](CC(=N)O)N=C(O)[C@H](C)N=C(O)[C@H](C)N=C(O)OCc3ccccc3)ccc12.O__MIVFLWIFVTTVLITGKSVLALNLHDFLTPKAEPAGELHALLVAGSNGWWNYRHQADVAHAYHLLLSKGILPEHIIVMMYDDIANDASNPFRGKLFNRPNGTDVYKGLKIDYSGSSVNPKNFLNVLEGNSEAVKGGNGRVINSKATDRIFVYFSDHGGEGLICFPDDVLTKKDLNSALQRMHKSKKYDEFVFYLEACESGSMFKKTLEPSMNIYAVTASNPVESSWATYCDYMDLPCLGDEFSVNWMEDSEKHDIDAEQLDAQFEDVKKMTKLSHVMHYGNLKIAKESVGWFQGEHGKKLSVQTQYEDDYPKVSWDARDVELMYMKKLQKTTTISLHAQALEQRVTQINQDRRDIEALFMSLVDNLLPNTNDKKEIFDKRNDVEDLSCHDDVVKAFDTTCIDVNRFDYALKYIYVLNNLCVKFGDSKKIINAMHATCSTATKQFL,./data/raw/alphafold//AF-I6R478-F1-model_v4.pdb,229,4072,1926,3758
+775,14558,14763,MASGAPSFPFSRASGPEPPAEFAKLRATNPVSQVKLFDGSLAWLVTKHKDVCFVATSEKLSKVRTRQGFPELSASGKQAAKAKPTFVDMDPPEHMHQRSMVEPTFTPEAVKNLQPYIQRTVDDLLEQMKQKGCANGPVDLVKEFALPVPSYIIYTLLGVPFNDLEYLTQQNAIRTNGSSTAREASAANQELLDYLAILVEQRLVEPKDDIISKLCTEQVKPGNIDKSDAVQIAFLLLVAGNATMVNMIALGVATLAQHPDQLAQLKANPSLAPQFVEELCRYHTASALAIKRTAKEDVMIGDKLVRANEGIIASNQSANRDEEVFENPDEFNMNRKWPPQDPLGFGFGDHRCIAEHLAKAELTTVFSTLYQKFPDLKVAVPLGKINYTPLNRDVGIVDLPVIF,uniprot_search,P23295,N=O.[NH4+]>>[N-]=[N+]=O,1200.0,5.357940169668112,10.0,7.2,1.7.1.14,5507.0,3.0791812460476247,N=O.[NH4+],[N-]=[N+]=O,3.0791812460476247,N=O.[NH4+]__MASGAPSFPFSRASGPEPPAEFAKLRATNPVSQVKLFDGSLAWLVTKHKDVCFVATSEKLSKVRTRQGFPELSASGKQAAKAKPTFVDMDPPEHMHQRSMVEPTFTPEAVKNLQPYIQRTVDDLLEQMKQKGCANGPVDLVKEFALPVPSYIIYTLLGVPFNDLEYLTQQNAIRTNGSSTAREASAANQELLDYLAILVEQRLVEPKDDIISKLCTEQVKPGNIDKSDAVQIAFLLLVAGNATMVNMIALGVATLAQHPDQLAQLKANPSLAPQFVEELCRYHTASALAIKRTAKEDVMIGDKLVRANEGIIASNQSANRDEEVFENPDEFNMNRKWPPQDPLGFGFGDHRCIAEHLAKAELTTVFSTLYQKFPDLKVAVPLGKINYTPLNRDVGIVDLPVIF,./data/raw/alphafold//AF-P23295-F1-model_v4.pdb,2404,4804,4866,4714
+776,3413,3461,MAVVYYLLLAGLIACSHALAAGTPALGDDRGRPWPASLAALALDGKLRTDSNATAAASTDFGNITSALPAAVLYPSSTGDLVALLSAANSTPGWPYTIAFRGRGHSLMGQAFAPGGVVVNMASLGDAAAPPRINVSADGRYVDAGGEQVWIDVLRASLARGVAPRSWNDYLYLTVGGTLSNAGISGQAFRHGPQISNVLEMDVITGHGEMVTCSKQLNADLFDAVLGGLGQFGVITRARIAVEPAPARARWVRFVYTDFAAFSADQERLTAPRPGGGGASFGPMSYVEGSVFVNQSLATDLANTGFFTDADVARIVALAGERNATTVYSIEATLNYDNATAAAAAVDQELASVLGTLSYVEGFAFQRDVAYAAFLDRVHGEEVALNKLGLWRVPHPWLNMFVPRSRIADFDRGVFKGILQGTDIVGPLIVYPLNKSMWDDGMSAATPSEDVFYAVSLLFSSVAPNDLARLQEQNRRILRFCDLAGIQYKTYLARHTDRSDWVRHFGAAKWNRFVEMKNKYDPKRLLSPGQDIFN,brenda,Q9T0N8,CC(C)=CCNc1nc[nH]c2ncnc1-2.O=O>>CC(C)=CC=O.Nc1nc[nH]c2ncnc1-2.OO,0.1,3.680218341235806,22.0,7.2,1.5.99.12,4577.0,-1.0,CC(C)=CCNc1nc[nH]c2ncnc1-2.O=O,CC(C)=CC=O.Nc1nc[nH]c2ncnc1-2.OO,-0.2218487496163563,CC(C)=CCNc1nc[nH]c2ncnc1-2.O=O__MAVVYYLLLAGLIACSHALAAGTPALGDDRGRPWPASLAALALDGKLRTDSNATAAASTDFGNITSALPAAVLYPSSTGDLVALLSAANSTPGWPYTIAFRGRGHSLMGQAFAPGGVVVNMASLGDAAAPPRINVSADGRYVDAGGEQVWIDVLRASLARGVAPRSWNDYLYLTVGGTLSNAGISGQAFRHGPQISNVLEMDVITGHGEMVTCSKQLNADLFDAVLGGLGQFGVITRARIAVEPAPARARWVRFVYTDFAAFSADQERLTAPRPGGGGASFGPMSYVEGSVFVNQSLATDLANTGFFTDADVARIVALAGERNATTVYSIEATLNYDNATAAAAAVDQELASVLGTLSYVEGFAFQRDVAYAAFLDRVHGEEVALNKLGLWRVPHPWLNMFVPRSRIADFDRGVFKGILQGTDIVGPLIVYPLNKSMWDDGMSAATPSEDVFYAVSLLFSSVAPNDLARLQEQNRRILRFCDLAGIQYKTYLARHTDRSDWVRHFGAAKWNRFVEMKNKYDPKRLLSPGQDIFN,./data/raw/alphafold//AF-Q9T0N8-F1-model_v4.pdb,1034,580,242,262
+777,8867,9009,MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,uniprot_search,P08246,COC(=O)CCC(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C>>,10.0,99.80789734033868,25.0,7.4,3.4.21.37,9606.0,1.0,COC(=O)CCC(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C,,1.0,COC(=O)CCC(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C__MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,./data/raw/alphafold//AF-P08246-F1-model_v4.pdb,1869,1645,3250,2040
+778,88,94,MSRNPSNSDAAHAFWSTQPVPQTEDETEKIVFAGPMDEPKTVADIPEEPYPIASTFEWWTPNMEAADDIHAIYELLRDNYVEDDDSMFRFNYSEEFLQWALCPPNYIPDWHVAVRRKADKKLLAFIAGVPVTLRMGTPKYMKVKAQEKGEGEEAAKYDEPRHICEINFLCVHKQLREKRLAPILIKEATRRVNRTNVWQAVYTAGVLLPTPYASGQYFHRSLNPEKLVEIRFSGIPAQYQKFQNPMAMLKRNYQLPSAPKNSGLREMKPSDVPQVRRILMNYLDSFDVGPVFSDAEISHYLLPRDGVVFTYVVENDKKVTDFFSFYRIPSTVIGNSNYNLLNAAYVHYYAATSIPLHQLILDLLIVAHSRGFDVCNMVEILDNRSFVEQLKFGAGDGHLRYYFYNWAYPKIKPSQVALVML,sabio,Q4Q5S8,*C(NC(=O)CN)C(=O)O.CCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O>>*C(NC(=O)CNC(=O)CCCCCCCCCCCCC)C(=O)O.CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS,24.0,2.049310602428561e-14,30.0,7.4,2.3.1.97,5664.0,1.380211241711606,*C(NC(=O)CN)C(=O)O.CCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O,*C(NC(=O)CNC(=O)CCCCCCCCCCCCC)C(=O)O.CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS,1.380211241711606,*C(NC(=O)CN)C(=O)O.CCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O__MSRNPSNSDAAHAFWSTQPVPQTEDETEKIVFAGPMDEPKTVADIPEEPYPIASTFEWWTPNMEAADDIHAIYELLRDNYVEDDDSMFRFNYSEEFLQWALCPPNYIPDWHVAVRRKADKKLLAFIAGVPVTLRMGTPKYMKVKAQEKGEGEEAAKYDEPRHICEINFLCVHKQLREKRLAPILIKEATRRVNRTNVWQAVYTAGVLLPTPYASGQYFHRSLNPEKLVEIRFSGIPAQYQKFQNPMAMLKRNYQLPSAPKNSGLREMKPSDVPQVRRILMNYLDSFDVGPVFSDAEISHYLLPRDGVVFTYVVENDKKVTDFFSFYRIPSTVIGNSNYNLLNAAYVHYYAATSIPLHQLILDLLIVAHSRGFDVCNMVEILDNRSFVEQLKFGAGDGHLRYYFYNWAYPKIKPSQVALVML,./data/raw/alphafold//AF-Q4Q5S8-F1-model_v4.pdb,3310,1603,3198,1973
+779,11108,11263,MVRISIAGGNEIDPGSMGLTLFHEHLRLITEVVRWNWPHLYNEDEELKRAIDAVNAAKKYGVKTIIDLTVAGIGCDVRFNEKVAKATGVNIIMGTGFYTYTEIPFYFKNRGIDSLVDAFVHDITIGIQGTNTRAAFVKAVIDSSGLTKDVEMAIRAAAKAHIKTDVPIITHSFVGNKSSLDLIRIFKEEGVDLARTVIGHVGDTDDISFIEQILREGAFIGLDRFGLDIYLPLDKRVKTAIELIKRGWIDQLLLSHDYCPTIDWYPPEVVRSTVPDWTMTLIFEKVIPRMRSEGITEEQINRVLIDNPRRLFTGR,brenda,F0QXN6,C[C@H]1CCC(=O)O1.O>>CC(O)CCC(=O)O,2.68,0.0,60.0,8.3,3.1.1.25,985052.0,0.4281347940287888,C[C@H]1CCC(=O)O1.O,CC(O)CCC(=O)O,0.4281347940287888,C[C@H]1CCC(=O)O1.O__MVRISIAGGNEIDPGSMGLTLFHEHLRLITEVVRWNWPHLYNEDEELKRAIDAVNAAKKYGVKTIIDLTVAGIGCDVRFNEKVAKATGVNIIMGTGFYTYTEIPFYFKNRGIDSLVDAFVHDITIGIQGTNTRAAFVKAVIDSSGLTKDVEMAIRAAAKAHIKTDVPIITHSFVGNKSSLDLIRIFKEEGVDLARTVIGHVGDTDDISFIEQILREGAFIGLDRFGLDIYLPLDKRVKTAIELIKRGWIDQLLLSHDYCPTIDWYPPEVVRSTVPDWTMTLIFEKVIPRMRSEGITEEQINRVLIDNPRRLFTGR,./data/raw/alphafold//AF-F0QXN6-F1-model_v4.pdb,3234,1051,877,1209
+780,12190,12354,GSGSAATDKFKAERATADTSPERLAAIAKDALGALNDVILKHGVTYPEYRVFKQWLIDVGEGGEWPLFLDVFIEHSVEEVLARSRKGTMGSIEGPYYIENSPELPSKCTLPMREEDEKITPLVFSGQVTDLDGNGLAGAKVELWHADNDGYYSQFAPHLPEWNLRGTIIADEEGRYEITTIQPAPYQIPTDGPTGQFIEAQNGHPWRPAHLHLIVSAPGKESVTTQLYFKGGEWIDSDVASATKPELILDPKTGDDGKNYVTYNFVLDPA,brenda,P95607,Cc1cccc(O)c1O.O=O>>C/C(=C/C=C\C(=O)O)C(=O)O,10.62,9.072476308408618e-15,25.0,7.2,1.13.11.1,37919.0,1.0261245167454502,Cc1cccc(O)c1O.O=O,C/C(=C/C=C\C(=O)O)C(=O)O,1.0261245167454502,Cc1cccc(O)c1O.O=O__GSGSAATDKFKAERATADTSPERLAAIAKDALGALNDVILKHGVTYPEYRVFKQWLIDVGEGGEWPLFLDVFIEHSVEEVLARSRKGTMGSIEGPYYIENSPELPSKCTLPMREEDEKITPLVFSGQVTDLDGNGLAGAKVELWHADNDGYYSQFAPHLPEWNLRGTIIADEEGRYEITTIQPAPYQIPTDGPTGQFIEAQNGHPWRPAHLHLIVSAPGKESVTTQLYFKGGEWIDSDVASATKPELILDPKTGDDGKNYVTYNFVLDPA,./data/raw/alphafold//AF-P95607-F1-model_v4.pdb,1996,4152,4018,3861
+781,20038,20325,MPNNLFFNAHHSPVGAFSSFTLGFPGKSGGLDLELARPPRQNVFIGVESLHESGLYHVLPFWETSGEDESKRYDIENPDPNPQKPNILIPFAKEEIQREFHVATDTWKAGDLTFTIYSPVKAVPDPETADEEALKLALVPAVIVEMKIDNTNGTRARRAFFGFEGTDPYTSMRRIDETCPQLRGVGQGRIVGIVSKDEDVRSALHFSMEDILTAQLEENWTFGLGKVGALIVDVPAGEKKTYQFAVCFYRGGYVTAGMDTSYFYTRFFNNIEEVGLYALEKAEVLKEQSFRSNELIEKEWLSDDQKFMMAHAIRSFITAIHSCLSMKESRFGVNEGEYRMMNTFDLTVDQLFFELKMNPWTVKNVLDLYVERYSYEDGVRFPGEETEYPGGISFTHDMGVANTFLRPHHSSYELYGLSGCFSHMTHEQLVNWVLCAAVYIEQTKDWAWRDKRLAILEQCLESMVRRDHPDPEKRNGIMGLDSTRTMGGAEITTYDSLDVSLGQARNNLYLAGKCWAAYVALEKLFHDVGKEELAALAGEQAEKCAATIVSYVTDDGYIPAVMGEGNDSKIIPAIEGLVFPYFTNCHEALNKDGRFGEYIQALNAHLRYVLREGICLFPDGGWKISSTSNNSWLSKIYLCQFIARHLLGWEWDEQGKRADAAHVAWLTHPTLSIWSWSDQIIAGEIKASKYYPRGVTS,sabio,V5N4G7,O.O=[N+]([O-])c1ccc(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1>>O=[N+]([O-])c1ccc(O)cc1.OC1COC(O)C(O)C1O,262.0,9.809384078968736e-15,60.0,7.0,3.2.1.37,33940.0,2.4183012913197457,O.O=[N+]([O-])c1ccc(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1,O=[N+]([O-])c1ccc(O)cc1.OC1COC(O)C(O)C1O,2.4183012913197457,O.O=[N+]([O-])c1ccc(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1__MPNNLFFNAHHSPVGAFSSFTLGFPGKSGGLDLELARPPRQNVFIGVESLHESGLYHVLPFWETSGEDESKRYDIENPDPNPQKPNILIPFAKEEIQREFHVATDTWKAGDLTFTIYSPVKAVPDPETADEEALKLALVPAVIVEMKIDNTNGTRARRAFFGFEGTDPYTSMRRIDETCPQLRGVGQGRIVGIVSKDEDVRSALHFSMEDILTAQLEENWTFGLGKVGALIVDVPAGEKKTYQFAVCFYRGGYVTAGMDTSYFYTRFFNNIEEVGLYALEKAEVLKEQSFRSNELIEKEWLSDDQKFMMAHAIRSFITAIHSCLSMKESRFGVNEGEYRMMNTFDLTVDQLFFELKMNPWTVKNVLDLYVERYSYEDGVRFPGEETEYPGGISFTHDMGVANTFLRPHHSSYELYGLSGCFSHMTHEQLVNWVLCAAVYIEQTKDWAWRDKRLAILEQCLESMVRRDHPDPEKRNGIMGLDSTRTMGGAEITTYDSLDVSLGQARNNLYLAGKCWAAYVALEKLFHDVGKEELAALAGEQAEKCAATIVSYVTDDGYIPAVMGEGNDSKIIPAIEGLVFPYFTNCHEALNKDGRFGEYIQALNAHLRYVLREGICLFPDGGWKISSTSNNSWLSKIYLCQFIARHLLGWEWDEQGKRADAAHVAWLTHPTLSIWSWSDQIIAGEIKASKYYPRGVTS,./data/raw/alphafold//AF-V5N4G7-F1-model_v4.pdb,415,2988,5333,6212
+782,19921,20207,MIMNMKNIFYCLLPGLLLGACSNKVYEKTGDSVIVKVQHKETGGPRLVRLQVMGDKLIHVSATADSKFADPQSLIVVPQKKQTSFAVVQNGDTITVSTEEVKASVLASTGEVWFTDKNGELILQENKGGGKTFTPIEVEGTKGYTVCQVFESPEDEAFYGLGQHQADEFNYKGKNEELFQYNTKVSVPFVVSNKNYGILLDSYSFCRFGNPNDYSQLNRIFKLYDKTGQEGALTGTYVPKKGETLVRREDSIYFENLKTIENLPKKLPLMGAKVTYEGEIEPAQTGEFKFILYYAGYVKVYLNNEPVVPERWRTAWNPNSYKFAAHLEAGKRVPLKIEWQPDGGQSYCGLRALTPVNPEEQGKQSWWSEMTKQLDYYFMAGENMDDVISGYRSLTGKSPVMPKWAMGFWQSREKYNTQEEMLGALKGFRDRKIPLDNIVLDWNHWPENAWGSHEFDKARFPDPKAMVDSIHAMHARMMISVWPKFYVTTEHFKEFDENGWMYQQSVKDSLKDWVGPGYHYGFYDAYDPDARKLFWKQMYEHYYPLGIDAWWMDASEPNVRDCTDLEYRKALCGPTALGSSTEFFNAYALMNAEAIYDGQRGVDNNKRVFLLTRSGFAGLQRYSTATWSGDIGTRWEDMKAQISAGLNFAMSGIPYWTMDIGGFCVENRYVAGQKQWNATKTENADYKEWRELNTRWYQFGAFVPLYRAHGQYPFREIWEIAPEGHPAYQSVVYYTKLRYNMMPYIYSLAGMTWFDDYTIMRPLVMDFTADAEVNDIGDQFMFGPSFMVSPVYRYGDRSREIYFPQAEGWYDFYSGKFQAGGERKVIEAPYERIPLYVRAGAIIPFGDDIQYTDEKPAEHIRLYIYQGADGEFTLYEDEGVNYNYEQGMYAMIPMKYDEATKTLVIGERQGEFPGMLKERTFTVVTVNKEKAQPFDLNAKGVTVKYNGSEQTLKL,sabio,A7LXT0,O.O=[N+]([O-])c1ccc(OC2OCC(O)C(O)C2O)cc1>>O=[N+]([O-])c1ccc(O)cc1.OC1COC(O)C(O)C1O,1.6,9.809384078968736e-15,37.0,6.0,3.2.1.177,28116.0,0.2041199826559248,O.O=[N+]([O-])c1ccc(OC2OCC(O)C(O)C2O)cc1,O=[N+]([O-])c1ccc(O)cc1.OC1COC(O)C(O)C1O,0.2041199826559248,O.O=[N+]([O-])c1ccc(OC2OCC(O)C(O)C2O)cc1__MIMNMKNIFYCLLPGLLLGACSNKVYEKTGDSVIVKVQHKETGGPRLVRLQVMGDKLIHVSATADSKFADPQSLIVVPQKKQTSFAVVQNGDTITVSTEEVKASVLASTGEVWFTDKNGELILQENKGGGKTFTPIEVEGTKGYTVCQVFESPEDEAFYGLGQHQADEFNYKGKNEELFQYNTKVSVPFVVSNKNYGILLDSYSFCRFGNPNDYSQLNRIFKLYDKTGQEGALTGTYVPKKGETLVRREDSIYFENLKTIENLPKKLPLMGAKVTYEGEIEPAQTGEFKFILYYAGYVKVYLNNEPVVPERWRTAWNPNSYKFAAHLEAGKRVPLKIEWQPDGGQSYCGLRALTPVNPEEQGKQSWWSEMTKQLDYYFMAGENMDDVISGYRSLTGKSPVMPKWAMGFWQSREKYNTQEEMLGALKGFRDRKIPLDNIVLDWNHWPENAWGSHEFDKARFPDPKAMVDSIHAMHARMMISVWPKFYVTTEHFKEFDENGWMYQQSVKDSLKDWVGPGYHYGFYDAYDPDARKLFWKQMYEHYYPLGIDAWWMDASEPNVRDCTDLEYRKALCGPTALGSSTEFFNAYALMNAEAIYDGQRGVDNNKRVFLLTRSGFAGLQRYSTATWSGDIGTRWEDMKAQISAGLNFAMSGIPYWTMDIGGFCVENRYVAGQKQWNATKTENADYKEWRELNTRWYQFGAFVPLYRAHGQYPFREIWEIAPEGHPAYQSVVYYTKLRYNMMPYIYSLAGMTWFDDYTIMRPLVMDFTADAEVNDIGDQFMFGPSFMVSPVYRYGDRSREIYFPQAEGWYDFYSGKFQAGGERKVIEAPYERIPLYVRAGAIIPFGDDIQYTDEKPAEHIRLYIYQGADGEFTLYEDEGVNYNYEQGMYAMIPMKYDEATKTLVIGERQGEFPGMLKERTFTVVTVNKEKAQPFDLNAKGVTVKYNGSEQTLKL,./data/raw/alphafold//AF-A7LXT0-F1-model_v4.pdb,1075,643,320,357
+783,12163,12327,MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,uniprot_search,P08246,Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Oc2c[nH]c(-c3ccccc3)c2)cc1.O>>,110.0,99.7521513264861,22.0,7.975,3.4.21.37,9606.0,2.041392685158225,Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Oc2c[nH]c(-c3ccccc3)c2)cc1.O,,3.681241237375587,Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Oc2c[nH]c(-c3ccccc3)c2)cc1.O__MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,./data/raw/alphafold//AF-P08246-F1-model_v4.pdb,1869,1645,3250,2040
+784,12996,13168,MAQGTLIRVTPEQPTHAVCVLGTLTQLDICSSAPEDCTSFSINASPGVVVDIAHGPPAKKKSTGSSTWPLDPGVEVTLTMKVASGSTGDQKVQISYYGPKTPPVKALLYLTGVEISLCADITRTGKVKPTRAVKDQRTWTWGPCGQGAILLVNCDRDNLESSAMDCEDDEVLDSEDLQDMSLMTLSTKTPKDFFTNHTLVLHVARSEMDKVRVFQATRGKLSSKCSVVLGPKWPSHYLMVPGGKHNMDFYVEALAFPDTDFPGLITLTISLLDTSNLELPEAVVFQDSVVFRVAPWIMTPNTQPPQEVYACSIFENEDFLKSVTTLAMKAKCKLTICPEEENMDDQWMQDEMEIGYIQAPHKTLPVVFDSPRNRGLKEFPIKRVMGPDFGYVTRGPQTGGISGLDSFGNLEVSPPVTVRGKEYPLGRILFGDSCYPSNDSRQMHQALQDFLSAQQVQAPVKLYSDWLSVGHVDEFLSFVPAPDRKGFRLLLASPRSCYKLFQEQQNEGHGEALLFEGIKKKKQQKIKNILSNKTLREHNSFVERCIDWNRELLKRELGLAESDIIDIPQLFKLKEFSKAEAFFPNMVNMLVLGKHLGIPKPFGPVINGRCCLEEKVCSLLEPLGLQCTFINDFFTYHIRHGEVHCGTNVRRKPFSFKWWNMVP,brenda,Q9UM07,N=C(N)NCCC[C@H](N=C(O)c1ccccc1)C(=N)O.O>>N.N=C(O)NCCC[C@H](N=C(O)c1ccccc1)C(=N)O,2.76,0.0,37.0,7.6,3.5.3.15,9606.0,0.4409090820652177,N=C(N)NCCC[C@H](N=C(O)c1ccccc1)C(=N)O.O,N.N=C(O)NCCC[C@H](N=C(O)c1ccccc1)C(=N)O,0.4409090820652177,N=C(N)NCCC[C@H](N=C(O)c1ccccc1)C(=N)O.O__MAQGTLIRVTPEQPTHAVCVLGTLTQLDICSSAPEDCTSFSINASPGVVVDIAHGPPAKKKSTGSSTWPLDPGVEVTLTMKVASGSTGDQKVQISYYGPKTPPVKALLYLTGVEISLCADITRTGKVKPTRAVKDQRTWTWGPCGQGAILLVNCDRDNLESSAMDCEDDEVLDSEDLQDMSLMTLSTKTPKDFFTNHTLVLHVARSEMDKVRVFQATRGKLSSKCSVVLGPKWPSHYLMVPGGKHNMDFYVEALAFPDTDFPGLITLTISLLDTSNLELPEAVVFQDSVVFRVAPWIMTPNTQPPQEVYACSIFENEDFLKSVTTLAMKAKCKLTICPEEENMDDQWMQDEMEIGYIQAPHKTLPVVFDSPRNRGLKEFPIKRVMGPDFGYVTRGPQTGGISGLDSFGNLEVSPPVTVRGKEYPLGRILFGDSCYPSNDSRQMHQALQDFLSAQQVQAPVKLYSDWLSVGHVDEFLSFVPAPDRKGFRLLLASPRSCYKLFQEQQNEGHGEALLFEGIKKKKQQKIKNILSNKTLREHNSFVERCIDWNRELLKRELGLAESDIIDIPQLFKLKEFSKAEAFFPNMVNMLVLGKHLGIPKPFGPVINGRCCLEEKVCSLLEPLGLQCTFINDFFTYHIRHGEVHCGTNVRRKPFSFKWWNMVP,./data/raw/alphafold//AF-Q9UM07-F1-model_v4.pdb,3362,2229,3919,2793
+785,1560,1588,MNTQQLAKLRSIVPEMRRVRHIHFVGIGGAGMGGIAEVLANEGYQISGSDLAPNPVTQQLMNLGATIYFNHRPENVRDASVVVVSSAISADNPEIVAAHEARIPVIRRAEMLAELMRFRHGIAIAGTHGKTTTTAMVSSIYAEAGLDPTFVNGGLVKAAGVHARLGHGRYLIAEADESDASFLHLQPMVAIVTNIEADHMDTYQGDFENLKQTFINFLHNLPFYGRAVMCVDDPVIRELLPRVGRQTTTYGFSEDADVRVEDYQQIGPQGHFTLLRQDKEPMRVTLNAPGRHNALNAAAAVAVATEEGIDDEAILRALESFQGTGRRFDFLGEFPLEPVNGKSGTAMLVDDYGHHPTEVDATIKAARAGWPDKNLVMLFQPHRFTRTRDLYDDFANVLTQVDTLLMLEVYPAGEAPIPGADSRSLCRTIRGRGKIDPILVPDPARVAEMLAPVLTGNDLILVQGAGNIGKIARSLAEIKLKPQTPEEEQHD,sabio,P17952,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)O.CC(N)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)NC(C)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,6.85,0.0,37.0,,6.3.2.8,562.0,0.8356905714924255,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)O.CC(N)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)NC(C)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)O,0.8356905714924255,CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(C)C(=O)O.CC(N)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MNTQQLAKLRSIVPEMRRVRHIHFVGIGGAGMGGIAEVLANEGYQISGSDLAPNPVTQQLMNLGATIYFNHRPENVRDASVVVVSSAISADNPEIVAAHEARIPVIRRAEMLAELMRFRHGIAIAGTHGKTTTTAMVSSIYAEAGLDPTFVNGGLVKAAGVHARLGHGRYLIAEADESDASFLHLQPMVAIVTNIEADHMDTYQGDFENLKQTFINFLHNLPFYGRAVMCVDDPVIRELLPRVGRQTTTYGFSEDADVRVEDYQQIGPQGHFTLLRQDKEPMRVTLNAPGRHNALNAAAAVAVATEEGIDDEAILRALESFQGTGRRFDFLGEFPLEPVNGKSGTAMLVDDYGHHPTEVDATIKAARAGWPDKNLVMLFQPHRFTRTRDLYDDFANVLTQVDTLLMLEVYPAGEAPIPGADSRSLCRTIRGRGKIDPILVPDPARVAEMLAPVLTGNDLILVQGAGNIGKIARSLAEIKLKPQTPEEEQHD,./data/raw/alphafold//AF-P17952-F1-model_v4.pdb,1404,912,711,1004
+786,3544,3593,MSANFTDKNGRQSKGVLLLRTLAMPSDTNANGDIFGGWIMSQMDMGGAILAKEIAHGRVVTVAVESMNFIKPISVGDVVCCYGQCLKVGRSSIKIKVEVWVKKVASEPIGERYCVTDAVFTFVAVDNNGRSRTIPRENNQELEKALALISEQPL,brenda,P44886,CC(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.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)O,138.0,6.6394461302566056e-15,25.0,7.5,3.1.2.20,727.0,2.1398790864012365,CC(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.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)O,2.146128035678238,CC(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.O__MSANFTDKNGRQSKGVLLLRTLAMPSDTNANGDIFGGWIMSQMDMGGAILAKEIAHGRVVTVAVESMNFIKPISVGDVVCCYGQCLKVGRSSIKIKVEVWVKKVASEPIGERYCVTDAVFTFVAVDNNGRSRTIPRENNQELEKALALISEQPL,./data/raw/alphafold//AF-P44886-F1-model_v4.pdb,1541,1097,253,274
+787,18263,18523,MQKQHNVVAGVDMGATHIRFCLRTAEGETLHCEKKRTAEVIAPGLVSGIGEMIDEQLRRFNARCHGLVMGFPALVSKDKRTIISTPNLPLTAADLYDLADKLENTLNCPVEFSRDVNLQLSWDVVENRLTQQLVLAAYLGTGMGFAVWMNGAPWTGAHGVAGELGHIPLGDMTQHCACGNPGCLETNCSGMALRRWYEQQPRNYPLRDLFVHAENAPFVQSLLENAARAIATSINLFDPDAVILGGGVMDMPAFPRETLVAMTQKYLRRPLPHQVVRFIAASSSDFNGAQGAAILAHQRFLPQFCAKAP,sabio,P32718,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.OCC1OC(O)CC(O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)CC(O)C1O,1.5,0.0,25.0,7.6,2.7.1.55,562.0,0.1760912590556812,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.OCC1OC(O)CC(O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)CC(O)C1O,0.1760912590556812,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.OCC1OC(O)CC(O)C1O__MQKQHNVVAGVDMGATHIRFCLRTAEGETLHCEKKRTAEVIAPGLVSGIGEMIDEQLRRFNARCHGLVMGFPALVSKDKRTIISTPNLPLTAADLYDLADKLENTLNCPVEFSRDVNLQLSWDVVENRLTQQLVLAAYLGTGMGFAVWMNGAPWTGAHGVAGELGHIPLGDMTQHCACGNPGCLETNCSGMALRRWYEQQPRNYPLRDLFVHAENAPFVQSLLENAARAIATSINLFDPDAVILGGGVMDMPAFPRETLVAMTQKYLRRPLPHQVVRFIAASSSDFNGAQGAAILAHQRFLPQFCAKAP,./data/raw/alphafold//AF-P32718-F1-model_v4.pdb,65,2540,2832,5679
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+796,5078,5164,MATLKEKLIAPVAEEEATVPNNKITVVGVGQVGMACAISILGKSLADELALVDVLEDKLKGEMMDLQHGSLFLQTPKIVADKDYSVTANSKIVVVTAGVRQQEGESRLNLVQRNVNVFKFIIPQIVKYSPDCIIIVVSNPVDILTYVTWKLSGLPKHRVIGSGCNLDSARFRYLMAEKLGIHPSSCHGWILGEHGDSSVAVWSGVNVAGVSLQELNPEMGTDNDSENWKEVHKMVVESAYEVIKLKGYTNWAIGLSVADLIESMLKNLSRIHPVSTMVKGMYGIENEVFLSLPCILNARGLTSVINQKLKDDEVAQLKKSADTLWDIQKDLKDL,sabio,P07195,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>>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],180000.0,0.0,25.0,9.2,1.1.1.27,9606.0,5.2552725051033065,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,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],5.2552725051033065,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__MATLKEKLIAPVAEEEATVPNNKITVVGVGQVGMACAISILGKSLADELALVDVLEDKLKGEMMDLQHGSLFLQTPKIVADKDYSVTANSKIVVVTAGVRQQEGESRLNLVQRNVNVFKFIIPQIVKYSPDCIIIVVSNPVDILTYVTWKLSGLPKHRVIGSGCNLDSARFRYLMAEKLGIHPSSCHGWILGEHGDSSVAVWSGVNVAGVSLQELNPEMGTDNDSENWKEVHKMVVESAYEVIKLKGYTNWAIGLSVADLIESMLKNLSRIHPVSTMVKGMYGIENEVFLSLPCILNARGLTSVINQKLKDDEVAQLKKSADTLWDIQKDLKDL,./data/raw/alphafold//AF-P07195-F1-model_v4.pdb,1282,5245,1635,774
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+798,18027,18281,MVSVEFLQELPKCEHHLHLEGTLEPDLLFPLAKRNDIILPEGFPKSVEELNEKYKKFRDLQDFLDYYYIGTNVLISEQDFFDLAWAYFKKVHKQGLVHAEVFYDPQSHTSRGISIETVTKGFQRACDKAFSEFGITSKLIMCLLRHIEPEECLKTIEEATPFIKDGTISALGLDSAEKPFPPHLFVECYGKAASLNKDLKLTAHAGEEGPAQFVSDALDLLQVTRIDHGINSQYDEELLDRLSRDQTMLTICPLSNVKLQVVQSVSELPLQKFLDRDVPFSLNSDDPAYFGGYILDVYTQVSKDFPHWDHETWGRIAKNAIKGSWCDDKRKNGLLSRVDEVVTKYSH,brenda,P53909,Nc1nc[nH]c2ncnc1-2.O>>N.Oc1ncnc2[nH]cnc12,5.5,9.249148826972571e-15,33.0,7.0,3.5.4.2,4932.0,0.7403626894942439,Nc1nc[nH]c2ncnc1-2.O,N.Oc1ncnc2[nH]cnc12,0.7403626894942439,Nc1nc[nH]c2ncnc1-2.O__MVSVEFLQELPKCEHHLHLEGTLEPDLLFPLAKRNDIILPEGFPKSVEELNEKYKKFRDLQDFLDYYYIGTNVLISEQDFFDLAWAYFKKVHKQGLVHAEVFYDPQSHTSRGISIETVTKGFQRACDKAFSEFGITSKLIMCLLRHIEPEECLKTIEEATPFIKDGTISALGLDSAEKPFPPHLFVECYGKAASLNKDLKLTAHAGEEGPAQFVSDALDLLQVTRIDHGINSQYDEELLDRLSRDQTMLTICPLSNVKLQVVQSVSELPLQKFLDRDVPFSLNSDDPAYFGGYILDVYTQVSKDFPHWDHETWGRIAKNAIKGSWCDDKRKNGLLSRVDEVVTKYSH,./data/raw/alphafold//AF-P53909-F1-model_v4.pdb,3585,2463,2743,5586
+799,2566,2601,MAVAVEITRSEVLRPSETLAAGGGGKRSQLTVFDRAAMDWYIPAVFAWDGAAAPSNDEVKGGLAAVLARYPHLAGRFDVDERGRRCFNLNNAGVRVLEATVAADLADALAHDVAAHVNELYPKADMENADEPVFQVQLTRYACGGLVIGTACNHQVSDGQSMSFFYVAWAAAVRSAGATLPTPFVDRAAIAVPRGPPAPAFDHRNIEFKGEHSWTHSYGSLPLERIRNLAVHFPDEFVAGLKSHVGARCSTFQCLLAHAWKKITAARDLSPEEYTQVRVAVNCRGRASPAVPMDYFGNMVLWAFPRMRVRDLLSSSYAAVVGVIRNAVARVDEQYIQSFVDFGEVAAGDELTPTAAPPGTVFCPDLEVDSWLGFRFHDLDFGRGPPCAFLPPDVPVEGLLIFVPSCAAKGGVEMFMALDDVHVEAFRQICYSMD,sabio,Q8LMI4,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]c2ccccc12>>CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS,1.18,16.62815809627088,37.0,7.4,2.3.1.-,4530.0,0.0718820073061253,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]c2ccccc12,CC(C)(COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCS,0.0718820073061253,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]c2ccccc12__MAVAVEITRSEVLRPSETLAAGGGGKRSQLTVFDRAAMDWYIPAVFAWDGAAAPSNDEVKGGLAAVLARYPHLAGRFDVDERGRRCFNLNNAGVRVLEATVAADLADALAHDVAAHVNELYPKADMENADEPVFQVQLTRYACGGLVIGTACNHQVSDGQSMSFFYVAWAAAVRSAGATLPTPFVDRAAIAVPRGPPAPAFDHRNIEFKGEHSWTHSYGSLPLERIRNLAVHFPDEFVAGLKSHVGARCSTFQCLLAHAWKKITAARDLSPEEYTQVRVAVNCRGRASPAVPMDYFGNMVLWAFPRMRVRDLLSSSYAAVVGVIRNAVARVDEQYIQSFVDFGEVAAGDELTPTAAPPGTVFCPDLEVDSWLGFRFHDLDFGRGPPCAFLPPDVPVEGLLIFVPSCAAKGGVEMFMALDDVHVEAFRQICYSMD,./data/raw/alphafold//AF-Q8LMI4-F1-model_v4.pdb,1633,1234,1713,1443
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+808,22576,22913,MKTQIINGVSLPNIPWQDKPADCKDVIWRYDANPIIPRDQLPTSNSIFNSAVVPYESEKGKFAGVFRVDDKCRNMELHAGFSKDGIHWDINPDRIVFEQAEKSTEEVNQWGYGYDPRVCFIEDRFWVTWCNAYGWKPTIGVAYTFDFKTFYQCENAFLPFNRNGVLFPRKINGKYVMFSRPSDSGHTPFGDMFISQSPDMKYWGEHRHVMGPLRAWESKKIGAGPIPIETSEGWLCFYHGVLESCNGFVYSFSACILDKDEPWKVKYRCAEYLLSPQKIYECVGDVQNVTFPCATLVDADTGRIAIYYGCADTCVSMAFTTVDDVVDYVKSHSSV,brenda,E6UBR9,O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O.OC[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1O>>O=C[C@H](O)[C@@H](O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)C(O)CO.O=P(O)(O)O,20.7,1.8483496094539773,37.0,6.5,2.4.1.281,1264.0,1.3159703454569178,O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O.OC[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1O,O=C[C@H](O)[C@@H](O)[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)C(O)CO.O=P(O)(O)O,1.3159703454569178,O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O.OC[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1O__MKTQIINGVSLPNIPWQDKPADCKDVIWRYDANPIIPRDQLPTSNSIFNSAVVPYESEKGKFAGVFRVDDKCRNMELHAGFSKDGIHWDINPDRIVFEQAEKSTEEVNQWGYGYDPRVCFIEDRFWVTWCNAYGWKPTIGVAYTFDFKTFYQCENAFLPFNRNGVLFPRKINGKYVMFSRPSDSGHTPFGDMFISQSPDMKYWGEHRHVMGPLRAWESKKIGAGPIPIETSEGWLCFYHGVLESCNGFVYSFSACILDKDEPWKVKYRCAEYLLSPQKIYECVGDVQNVTFPCATLVDADTGRIAIYYGCADTCVSMAFTTVDDVVDYVKSHSSV,./data/raw/alphafold//AF-E6UBR9-F1-model_v4.pdb,1389,1748,3367,2174
+809,17490,17727,MAPSLDSISHSFANGVASAKQAVNGASTNLAVAGSHLPTTQVTQVDIVEKMLAAPTDSTLELDGYSLNLGDVVSAARKGRPVRVKDSDEIRSKIDKSVEFLRSQLSMSVYGVTTGFGGSADTRTEDAISLQKALLEHQLCGVLPSSFDSFRLGRGLENSLPLEVVRGAMTIRVNSLTRGHSAVRLVVLEALTNFLNHGITPIVPLRGTISASGDLSPLSYIAAAISGHPDSKVHVVHEGKEKILYAREAMALFNLEPVVLGPKEGLGLVNGTAVSASMATLALHDAHMLSLLSQSLTAMTVEAMVGHAGSFHPFLHDVTRPHPTQIEVAGNIRKLLEGSRFAVHHEEEVKVKDDEGILRQDRYPLRTSPQWLGPLVSDLIHAHAVLTIEAGQSTTDNPLIDVENKTSHHGGNFQAAAVANTMEKTRLGLAQIGKLNFTQLTEMLNAGMNRGLPSCLAAEDPSLSYHCKGLDIAAAAYTSELGHLANPVTTHVQPAEMANQAVNSLALISARRTTESNDVLSLLLATHLYCVLQAIDLRAIEFEFKKQFGPAIVSLIDQHFGSAMTGSNLRDELVEKVNKTLAKRLEQTNSYDLVPRWHDAFSFAAGTVVEVLSSTSLSLAAVNAWKVAAAESAISLTRQVRETFWSAASTSSPALSYLSPRTQILYAFVREELGVKARRGDVFLGKQEVTIGSNVSKIYEAIKSGRINNVLLKMLA,brenda,P11544,N[C@@H](Cc1ccc(O)cc1)C(=O)O>>N.O=C(O)/C=C/c1ccc(O)cc1,1.02,7.821441191474541e-15,30.0,8.8,4.3.1.25,5286.0,0.0086001717619175,N[C@@H](Cc1ccc(O)cc1)C(=O)O,N.O=C(O)/C=C/c1ccc(O)cc1,0.0086001717619175,N[C@@H](Cc1ccc(O)cc1)C(=O)O__MAPSLDSISHSFANGVASAKQAVNGASTNLAVAGSHLPTTQVTQVDIVEKMLAAPTDSTLELDGYSLNLGDVVSAARKGRPVRVKDSDEIRSKIDKSVEFLRSQLSMSVYGVTTGFGGSADTRTEDAISLQKALLEHQLCGVLPSSFDSFRLGRGLENSLPLEVVRGAMTIRVNSLTRGHSAVRLVVLEALTNFLNHGITPIVPLRGTISASGDLSPLSYIAAAISGHPDSKVHVVHEGKEKILYAREAMALFNLEPVVLGPKEGLGLVNGTAVSASMATLALHDAHMLSLLSQSLTAMTVEAMVGHAGSFHPFLHDVTRPHPTQIEVAGNIRKLLEGSRFAVHHEEEVKVKDDEGILRQDRYPLRTSPQWLGPLVSDLIHAHAVLTIEAGQSTTDNPLIDVENKTSHHGGNFQAAAVANTMEKTRLGLAQIGKLNFTQLTEMLNAGMNRGLPSCLAAEDPSLSYHCKGLDIAAAAYTSELGHLANPVTTHVQPAEMANQAVNSLALISARRTTESNDVLSLLLATHLYCVLQAIDLRAIEFEFKKQFGPAIVSLIDQHFGSAMTGSNLRDELVEKVNKTLAKRLEQTNSYDLVPRWHDAFSFAAGTVVEVLSSTSLSLAAVNAWKVAAAESAISLTRQVRETFWSAASTSSPALSYLSPRTQILYAFVREELGVKARRGDVFLGKQEVTIGSNVSKIYEAIKSGRINNVLLKMLA,./data/raw/alphafold//AF-P11544-F1-model_v4.pdb,2799,2372,2645,5474
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+811,4843,4913,MTESNEDLFGIASHFALEGAVTGIEPYGDGHINTTYLVTTDGPRYILQQMNTSIFPDTVNLMRNVELVTSTLKAQGKETLDIVPTTSGATWAEIDGGAWRVYKFIEHTVSYNLVPNPDVFREAGSAFGDFQNFLSEFDASQLTETIAHFHDTPHRFEDFKAALAADKLGRAAACQPEIDFYLSHADQYAVVMDGLRDGSIPLRVTHNDTKLNNILMDATTGKARAIIDLDTIMPGSMLFDFGDSIRFGASTALEDEKDLSKVHFSTELFRAYTEGFVGELRGSITAREAELLPFSGNLLTMECGMRFLADYLEGDIYFATKYPEHNLVRTRTQIKLVQEMEQKASETRAIVADIMEAAR,brenda,E8MF12,CC(O)=N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1O.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]1[C@@H](OP(=O)(O)O)O[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,6.08,0.0,30.0,8.5,2.7.1.162,216816.0,0.7839035792727349,CC(O)=N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1O.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]1[C@@H](OP(=O)(O)O)O[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,0.7839035792727349,CC(O)=N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MTESNEDLFGIASHFALEGAVTGIEPYGDGHINTTYLVTTDGPRYILQQMNTSIFPDTVNLMRNVELVTSTLKAQGKETLDIVPTTSGATWAEIDGGAWRVYKFIEHTVSYNLVPNPDVFREAGSAFGDFQNFLSEFDASQLTETIAHFHDTPHRFEDFKAALAADKLGRAAACQPEIDFYLSHADQYAVVMDGLRDGSIPLRVTHNDTKLNNILMDATTGKARAIIDLDTIMPGSMLFDFGDSIRFGASTALEDEKDLSKVHFSTELFRAYTEGFVGELRGSITAREAELLPFSGNLLTMECGMRFLADYLEGDIYFATKYPEHNLVRTRTQIKLVQEMEQKASETRAIVADIMEAAR,./data/raw/alphafold//AF-E8MF12-F1-model_v4.pdb,2999,1745,3364,2170
+812,16320,16547,MGKLTLYGIDGSPPVRSVLLTLRALNLDFDYKIVNLMEKEHLKPEFLKINPLHTVPALDDNGFYLADSHAINSYLVSKYGRNDSLYPKDLKKRAIVDQRLHYDSSVVTSTGRAITFPLFWENKTEIPQARIDALEGVYKSLNLFLENGNYLAGDNLTIADFHVIAGLTGFFVFLPVDATKYPELAAWIKRIKELPYYEEANGSRAAQIIEFIKSKKFTIV,sabio,A1ZB68,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,26.6,2.7843620188059523e-14,25.0,6.5,2.5.1.18,7227.0,1.424881636631067,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,1.424881636631067,NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1__MGKLTLYGIDGSPPVRSVLLTLRALNLDFDYKIVNLMEKEHLKPEFLKINPLHTVPALDDNGFYLADSHAINSYLVSKYGRNDSLYPKDLKKRAIVDQRLHYDSSVVTSTGRAITFPLFWENKTEIPQARIDALEGVYKSLNLFLENGNYLAGDNLTIADFHVIAGLTGFFVFLPVDATKYPELAAWIKRIKELPYYEEANGSRAAQIIEFIKSKKFTIV,./data/raw/alphafold//AF-A1ZB68-F1-model_v4.pdb,2647,5143,2280,5169
+813,9626,9772,MASSTSTTTSKEIDRELPPLLRVYKDGTVERFLGSSFVPPSPEDPETGVSTKDIVISENPTISARVYLPKLNNTTEKLPILVYYHGGAFCLESAFSFLHQRYLNIVASKANVLVVSIEYRLAPEHPLPAAYEDGWYALKWVTSHSTNNNKPTNADPWLIKHGDFNRFYIGGDTSGANIAHNAALRVGAEALPGGLRIAGVLSAFPLFWGSKPVLSEPVEGHEKSSPMQVWNFVYPDAPGGIDNPLINPLAPGAPNLATLGCPKMLVFVAGKDDLRDRGIWYYEAVKESGWKGDVELAQYEGEEHCFQIYHPETENSKDLIGRIASFLV,brenda,Q5NUF4,COc1ccc(C2C(=O)c3ccc(O)cc3OC2O)cc1>>COc1ccc(-c2coc3cc(O)ccc3c2=O)cc1.O,9.8,9.910527970766752e-15,30.0,7.5,4.2.1.105,46348.0,0.9912260756924948,COc1ccc(C2C(=O)c3ccc(O)cc3OC2O)cc1,COc1ccc(-c2coc3cc(O)ccc3c2=O)cc1.O,0.9912260756924948,COc1ccc(C2C(=O)c3ccc(O)cc3OC2O)cc1__MASSTSTTTSKEIDRELPPLLRVYKDGTVERFLGSSFVPPSPEDPETGVSTKDIVISENPTISARVYLPKLNNTTEKLPILVYYHGGAFCLESAFSFLHQRYLNIVASKANVLVVSIEYRLAPEHPLPAAYEDGWYALKWVTSHSTNNNKPTNADPWLIKHGDFNRFYIGGDTSGANIAHNAALRVGAEALPGGLRIAGVLSAFPLFWGSKPVLSEPVEGHEKSSPMQVWNFVYPDAPGGIDNPLINPLAPGAPNLATLGCPKMLVFVAGKDDLRDRGIWYYEAVKESGWKGDVELAQYEGEEHCFQIYHPETENSKDLIGRIASFLV,./data/raw/alphafold//AF-Q5NUF4-F1-model_v4.pdb,3558,3516,1289,3238
+814,1754,1785,MLKVISSLLFYMTASLMAVASPLAHSGESRGEYPTVSEIPVGEVRLYQIDDGVWSHIATHTFDGVVYPSNGLIVRDGDELLLIDTAWGTKNTVALLAEIEKQIGLPVTRSVSTHFHDDRVGGVDALRAAGVATYASPSTRRLAEAEGNEVPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVLELSRTSAGNVADADLAEWPGSVERIQQHYPEAEVVIPGHGLPGGLDLLQHTANVVKAHTNRSVAE,brenda,Q2HY42,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)Cc3cccs3)[C@H]2SC1.O>>,656.0,99.7593035206674,40.0,7.0,3.5.2.6,287.0,2.8169038393756605,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)Cc3cccs3)[C@H]2SC1.O,,2.8169038393756605,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)Cc3cccs3)[C@H]2SC1.O__MLKVISSLLFYMTASLMAVASPLAHSGESRGEYPTVSEIPVGEVRLYQIDDGVWSHIATHTFDGVVYPSNGLIVRDGDELLLIDTAWGTKNTVALLAEIEKQIGLPVTRSVSTHFHDDRVGGVDALRAAGVATYASPSTRRLAEAEGNEVPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVLELSRTSAGNVADADLAEWPGSVERIQQHYPEAEVVIPGHGLPGGLDLLQHTANVVKAHTNRSVAE,./data/raw/alphafold//AF-Q2HY42-F1-model_v4.pdb,1446,972,778,1081
+815,48,48,MDIGGLTTVVANSAYISARGSFDGTANPASNRDKKYHSKLKLPHITVCEDLRETLDLQFRSICVEQPIGKRLFQEYLETANEYKGPCRLWRDVEEYDTAEDKDRTQKAAKILQRYMEPSAKHFCPFLPENGITKVKERHQEAADDLFVEILACVFDFLKEVPFTFYLETMYFKRFLQWKWLEMQPVAEDWFLDFRVLGKGGFGEVSACQMRATGKLYACKKLNKKRLKKRKGYEGAMVEKRILARVHSRFIVSLAYAFQTKTELCLVMTIMNGGDLRYHIYNVDENNPGFSEPRACYYAAQIIQGLEHLHQKKIIYRDLKPENVLLDNEGNVRISDLGLAVELADGQEKTKGYAGTPGFMAPELLKGEEYDYSVDYFTLGVTLYEFIAAKGPFRTRGEKVENKEVKKRILNDPVTYSEKFSENAKSICEGLLAKEVDKRLGFKNGTCDEIRTHPFFSQLNWRKLDAGILPPPFVPDSKTVYAKDLDDVGAFSTVKGVCLEDDDKCFFDEFASGNISIPWQEEMIETGIYGELNVWGPGGAVPNDLRRESILEQPPKSSTCSVS,sabio,Q1XHM0,*=CC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C.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,102.0,28.94289803618288,25.0,7.5,2.7.11.14,7955.0,2.008600171761917,*=CC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C.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,2.008600171761917,*=CC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MDIGGLTTVVANSAYISARGSFDGTANPASNRDKKYHSKLKLPHITVCEDLRETLDLQFRSICVEQPIGKRLFQEYLETANEYKGPCRLWRDVEEYDTAEDKDRTQKAAKILQRYMEPSAKHFCPFLPENGITKVKERHQEAADDLFVEILACVFDFLKEVPFTFYLETMYFKRFLQWKWLEMQPVAEDWFLDFRVLGKGGFGEVSACQMRATGKLYACKKLNKKRLKKRKGYEGAMVEKRILARVHSRFIVSLAYAFQTKTELCLVMTIMNGGDLRYHIYNVDENNPGFSEPRACYYAAQIIQGLEHLHQKKIIYRDLKPENVLLDNEGNVRISDLGLAVELADGQEKTKGYAGTPGFMAPELLKGEEYDYSVDYFTLGVTLYEFIAAKGPFRTRGEKVENKEVKKRILNDPVTYSEKFSENAKSICEGLLAKEVDKRLGFKNGTCDEIRTHPFFSQLNWRKLDAGILPPPFVPDSKTVYAKDLDDVGAFSTVKGVCLEDDDKCFFDEFASGNISIPWQEEMIETGIYGELNVWGPGGAVPNDLRRESILEQPPKSSTCSVS,./data/raw/alphafold//AF-Q1XHM0-F1-model_v4.pdb,907,409,45,47
+816,15520,15744,MSQARPATVLGAMEMGRRMDVTSSSASVRAFLQRGHTEIDTAFVYANGQSETILGDLGLGLGRSGCKVKIATKAAPMFGKTLKPADVRFQLETSLKRLQCPRVDLFYLHFPDHGTPIEETLQACHQLHQEGKFVELGLSNYVSWEVAEICTLCKKNGWIMPTVYQGMYNAITRQVETELFPCLRHFGLRFYAFNPLAGGLLTGRYKYQDKDGKNPESRFFGNPFSQLYMDRYWKEEHFNGIALVEKALKTTYGPTAPSMISAAVRWMYHHSQLKGTQGDAVILGMSSLEQLEQNLALVEEGPLEPAVVDAFDQAWNLVAHECPNYFR,sabio,P38918,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=Cc1ccc([N+](=O)[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.O=[N+]([O-])c1ccc(CO)cc1,14820.0,6.329621477194912e-15,25.0,6.7,1.-.-.-,10116.0,4.17084820364331,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=Cc1ccc([N+](=O)[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.O=[N+]([O-])c1ccc(CO)cc1,4.17084820364331,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=Cc1ccc([N+](=O)[O-])cc1.[H]__MSQARPATVLGAMEMGRRMDVTSSSASVRAFLQRGHTEIDTAFVYANGQSETILGDLGLGLGRSGCKVKIATKAAPMFGKTLKPADVRFQLETSLKRLQCPRVDLFYLHFPDHGTPIEETLQACHQLHQEGKFVELGLSNYVSWEVAEICTLCKKNGWIMPTVYQGMYNAITRQVETELFPCLRHFGLRFYAFNPLAGGLLTGRYKYQDKDGKNPESRFFGNPFSQLYMDRYWKEEHFNGIALVEKALKTTYGPTAPSMISAAVRWMYHHSQLKGTQGDAVILGMSSLEQLEQNLALVEEGPLEPAVVDAFDQAWNLVAHECPNYFR,./data/raw/alphafold//AF-P38918-F1-model_v4.pdb,3137,1923,3566,2395
+817,10796,10951,MAQFINHLFWSFNLSSNAALFGEIVMCKFLTNQVVVKCTPKSYYCPLSPYMDSPLIGYTSTISAPHMHATALQELEPLESNVGKRVLELGTGTGYLVAAAMMVAPNGTVKGVEHIKELVDSKSRRNVLASDRDNVSVIVEGDGRKGYDDVPSSDVILAADVTYDSSVIPSLVDQLGGRQNLRTEQLNEGGRGKIKRRLMPVIYVDSGKILVIVEECKDPSQLAQTVWYPKVS,uniprot_search,A0A088T1F3,C[C@H](N=C(O)C[C@H](N=C(O)CN=C(O)CN=C(O)[C@H](C)N=C(O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)O)C(O)=N[C@@H](CO)C(O)=NCC(O)=N[C@@H](CCC(=O)O)C(=O)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,233.3,52.87761791521672,30.0,7.0,2.1.1.77,4903.0,2.3679147387937527,C[C@H](N=C(O)C[C@H](N=C(O)CN=C(O)CN=C(O)[C@H](C)N=C(O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)O)C(O)=N[C@@H](CO)C(O)=NCC(O)=N[C@@H](CCC(=O)O)C(=O)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,2.3679147387937527,C[C@H](N=C(O)C[C@H](N=C(O)CN=C(O)CN=C(O)[C@H](C)N=C(O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)O)C(O)=N[C@@H](CO)C(O)=NCC(O)=N[C@@H](CCC(=O)O)C(=O)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MAQFINHLFWSFNLSSNAALFGEIVMCKFLTNQVVVKCTPKSYYCPLSPYMDSPLIGYTSTISAPHMHATALQELEPLESNVGKRVLELGTGTGYLVAAAMMVAPNGTVKGVEHIKELVDSKSRRNVLASDRDNVSVIVEGDGRKGYDDVPSSDVILAADVTYDSSVIPSLVDQLGGRQNLRTEQLNEGGRGKIKRRLMPVIYVDSGKILVIVEECKDPSQLAQTVWYPKVS,./data/raw/alphafold//AF-A0A088T1F3-F1-model_v4.pdb,3740,3754,1559,3530
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+819,7118,7239,MRIPLVGKEPIEAEDMGFTLIHEHLRVFSEAVRYQWPHLYNEDEELRNAVNEVKRAMQFGVKTIVDPTVMGLGRDIRFMEKVVKTTGINLVAGTGIYIYVDLPFYFLNRSIDEIADLFIHDIKEGIQATSNKAGFVKIAADEPGITKDVEKVIRAAAITHKEAKVPIITHSNAHNNTGLEEQRILMEEGVDPGKILIGHLGDTDNTDYIKKIADKGSFIGLDRYGLDLFLPVDKRNETTLKLIKDGYSDRIMISHDYCCTIDWGTARPELKPKLAPRWSMALIFEDTIPFLKKNGVSEEVIDIIFKENPKKFFS,brenda,C4KKZ9,CCCCCCCC(O)=NC1CCOC1=O.O>>CCCCCCCC(O)=NC(CCO)C(=O)O,0.71,5.781023726889301e-15,25.0,8.3,3.1.1.25,43080.0,-0.1487416512809247,CCCCCCCC(O)=NC1CCOC1=O.O,CCCCCCCC(O)=NC(CCO)C(=O)O,-0.1487416512809247,CCCCCCCC(O)=NC1CCOC1=O.O__MRIPLVGKEPIEAEDMGFTLIHEHLRVFSEAVRYQWPHLYNEDEELRNAVNEVKRAMQFGVKTIVDPTVMGLGRDIRFMEKVVKTTGINLVAGTGIYIYVDLPFYFLNRSIDEIADLFIHDIKEGIQATSNKAGFVKIAADEPGITKDVEKVIRAAAITHKEAKVPIITHSNAHNNTGLEEQRILMEEGVDPGKILIGHLGDTDNTDYIKKIADKGSFIGLDRYGLDLFLPVDKRNETTLKLIKDGYSDRIMISHDYCCTIDWGTARPELKPKLAPRWSMALIFEDTIPFLKKNGVSEEVIDIIFKENPKKFFS,./data/raw/alphafold//AF-C4KKZ9-F1-model_v4.pdb,3234,2055,3706,1199
+820,20998,21319,MAASSSLSTLSHHQTLLSHPKTHLPTTPASSLLVPTTSSKVNGVLLKSTSSSRRLRVGSASAVVRAAAVEALESTDIDQLVEKSVNTIRFLAIDAVEKANSGHPGLPMGCAPMGHILYDEIMRYNPKNPYWFNRDRFVLSAGHGCMLQYALLHLAGYDSVLEEDLKTFRQWGSRIPGHPENFETPGVEVTTGPLGQGIANAVGLALAEKHLAARFNKPDAEIVDHYTYVILGDGCQMEGIAQEACSLAGHWGLGKLIAFYDDNHISIDGDTAIAFTESVDLRFEALGWHVIWVKNGNTGYDEIRAAIKEAKTVTDKPTLIKVTTTIGFGSPNKSNSYSVHGSALGSKEVEATRQNLGWPYEPFHVPEEVKKHWSRHTPEGASLEAEWNTKFAEYEKKYPEDATEFKSITTGEFPAGWEKALPTYTPETPGDATRNLSQQCLNALAKVIPGLLGGSADLASSNMTLLKMFGDFRRTHRKKETFRFGVREHGMGAICNGICLHSPGFVPYCATFFVFTDYMRGAMRISALSEAGVIYVMTHDSIGLGEDGPTHQPIEALSKFPAMPNILMLRPADGNETAGSYKVAVENRKTPSILALSRKKLPNLPGTSIEGVEKGGYTITDNSSGNKPDVILIGTGSELEIAAKAGDELRKEGKAVRVVSFVSWELFEKQSDEYKESVLPSDVTARVSIEAGSTFGWHKIVGSKGKAIGIDKFGASAPAGKIYQEYGITVEAVVEAAKSVC,sabio,O20250,O=C(CO)C(O)C(O)COP(=O)(O)O.O=P(O)(O)OCC1OC(O)C(O)C1O>>O=C(CO)C(O)C(O)C(O)C(O)COP(=O)(O)O.O=CC(O)COP(=O)(O)O,0.0148,6.169003475098437e-15,,7.5,2.2.1.1,3562.0,-1.8297382846050425,O=C(CO)C(O)C(O)COP(=O)(O)O.O=P(O)(O)OCC1OC(O)C(O)C1O,O=C(CO)C(O)C(O)C(O)C(O)COP(=O)(O)O.O=CC(O)COP(=O)(O)O,-1.7304870557820835,O=C(CO)C(O)C(O)COP(=O)(O)O.O=P(O)(O)OCC1OC(O)C(O)C1O__MAASSSLSTLSHHQTLLSHPKTHLPTTPASSLLVPTTSSKVNGVLLKSTSSSRRLRVGSASAVVRAAAVEALESTDIDQLVEKSVNTIRFLAIDAVEKANSGHPGLPMGCAPMGHILYDEIMRYNPKNPYWFNRDRFVLSAGHGCMLQYALLHLAGYDSVLEEDLKTFRQWGSRIPGHPENFETPGVEVTTGPLGQGIANAVGLALAEKHLAARFNKPDAEIVDHYTYVILGDGCQMEGIAQEACSLAGHWGLGKLIAFYDDNHISIDGDTAIAFTESVDLRFEALGWHVIWVKNGNTGYDEIRAAIKEAKTVTDKPTLIKVTTTIGFGSPNKSNSYSVHGSALGSKEVEATRQNLGWPYEPFHVPEEVKKHWSRHTPEGASLEAEWNTKFAEYEKKYPEDATEFKSITTGEFPAGWEKALPTYTPETPGDATRNLSQQCLNALAKVIPGLLGGSADLASSNMTLLKMFGDFRRTHRKKETFRFGVREHGMGAICNGICLHSPGFVPYCATFFVFTDYMRGAMRISALSEAGVIYVMTHDSIGLGEDGPTHQPIEALSKFPAMPNILMLRPADGNETAGSYKVAVENRKTPSILALSRKKLPNLPGTSIEGVEKGGYTITDNSSGNKPDVILIGTGSELEIAAKAGDELRKEGKAVRVVSFVSWELFEKQSDEYKESVLPSDVTARVSIEAGSTFGWHKIVGSKGKAIGIDKFGASAPAGKIYQEYGITVEAVVEAAKSVC,./data/raw/alphafold//AF-O20250-F1-model_v4.pdb,564,3254,5559,6444
+821,11959,12119,MLTSILCIASLITFLEAHISVKNEKFEPLSDDIISYINEHPNAGWRAEKSNRFHSLDDARIQMGARREEPDLRRKRRPTVDHNDWNVEIPSNFDSRKKWPGCKSIATIRDQSRCGSCWSFGAVEAMSDRSCIQSGGKQNVELSAVDLLTCCESCGLGCEGGILGPAWDYWVKEGIVTASSKENHTGCEPYPFPKCEHHTKGKYPPCGSKIYNTPRCKQTCQRKYKTPYTQDKHRGKSSYNVKNDEKAIQKEIMKYGPVEASFTVYEDFLNYKSGIYKHITGEALGGHAIRIIGWGVENKTPYWLIANSWNEDWGENGYFRIVRGRDECSIESEVIAGRIN,sabio,P25792,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,49.0,8.878815343120896e-15,25.0,5.9,3.4.22.1,6183.0,1.6901960800285136,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,1.6901960800285136,Cc1cc(=O)oc2cc(NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)OCc3ccccc3)ccc12.O__MLTSILCIASLITFLEAHISVKNEKFEPLSDDIISYINEHPNAGWRAEKSNRFHSLDDARIQMGARREEPDLRRKRRPTVDHNDWNVEIPSNFDSRKKWPGCKSIATIRDQSRCGSCWSFGAVEAMSDRSCIQSGGKQNVELSAVDLLTCCESCGLGCEGGILGPAWDYWVKEGIVTASSKENHTGCEPYPFPKCEHHTKGKYPPCGSKIYNTPRCKQTCQRKYKTPYTQDKHRGKSSYNVKNDEKAIQKEIMKYGPVEASFTVYEDFLNYKSGIYKHITGEALGGHAIRIIGWGVENKTPYWLIANSWNEDWGENGYFRIVRGRDECSIESEVIAGRIN,./data/raw/alphafold//AF-P25792-F1-model_v4.pdb,1935,4086,1941,3777
+822,14748,14957,MNIVVLISGNGSNLQAIIDACKTNKIKGTVRAVFSNKADAFGLERARQAGIATHTLIASAFDSREAYDRELIHEIDMYAPDVVVLAGFMRILSPAFVSHYAGRLLNIHPSLLPKYPGLHTHRQALENGDEEHGTSVHFVTDELDGGPVILQAKVPVFAGDSEDDITARVQTQEHAIYPLVISWFADGRLKMHENAAWLDGQRLPPQGYAADE,sabio,P08179,N=c1nc(O)c2cc(CN(C=O)c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)ccc2[nH]1.NCC(=O)NC1OC(COP(=O)(O)O)C(O)C1O>>O=CNCC(=O)NC1OC(COP(=O)(O)O)C(O)C1O,40.0,41.11406977157605,26.0,,2.1.2.2,562.0,1.6020599913279625,N=c1nc(O)c2cc(CN(C=O)c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)ccc2[nH]1.NCC(=O)NC1OC(COP(=O)(O)O)C(O)C1O,O=CNCC(=O)NC1OC(COP(=O)(O)O)C(O)C1O,1.6020599913279625,N=c1nc(O)c2cc(CN(C=O)c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)ccc2[nH]1.NCC(=O)NC1OC(COP(=O)(O)O)C(O)C1O__MNIVVLISGNGSNLQAIIDACKTNKIKGTVRAVFSNKADAFGLERARQAGIATHTLIASAFDSREAYDRELIHEIDMYAPDVVVLAGFMRILSPAFVSHYAGRLLNIHPSLLPKYPGLHTHRQALENGDEEHGTSVHFVTDELDGGPVILQAKVPVFAGDSEDDITARVQTQEHAIYPLVISWFADGRLKMHENAAWLDGQRLPPQGYAADE,./data/raw/alphafold//AF-P08179-F1-model_v4.pdb,2455,4874,4943,4797
+823,22916,23258,MTEEYWKGVDKIQYVGHQDKKSGLGFQYYNPEEEIMGKKMKDWLRFAVAYWHTFDQRLVDPFGDGTAQRPYDKYTDPMDLALAKVDAAFEFYQKLGVDYLCFHDRDLAPEGDTLRETNANLDKVVDKIVEYQKTSGMKVLWNTSNMFTNPRFVEGAATSPYADVFAYSAAQLKHSLEIGKRVGSENYVFWGGREGYESLWNTNMKQEQEHAAKIFHMAKDYANEIGFDAQMLLEPKPKEPTTHQYDFDAATTIAFMKEYDLDKDFKLNLEGNHANLAGHTYQHEIRVAREAGLLGSLDANQGDKLIGWDIDEYPSNLYETTAAMYEVVENGSIGPRGGLNFDAKPRRSAFAPEDLFLGHIVGMDSFAAGLRVAAAMKQDGFLDNLKADRYSSYKSGVGADIESGKADLKSLEAYAIDKPQSELIAATHSDHLEEIKDTINHYIIDTLSK,sabio,P29443,OCC1OC(O)(CO)C(O)C1O>>OCC1OC(O)C(O)C(O)C1O,0.253,0.0,35.0,6.5,5.3.1.5,1580.0,-0.5968794788241821,OCC1OC(O)(CO)C(O)C1O,OCC1OC(O)C(O)C(O)C1O,-0.1870866433571444,OCC1OC(O)(CO)C(O)C1O__MTEEYWKGVDKIQYVGHQDKKSGLGFQYYNPEEEIMGKKMKDWLRFAVAYWHTFDQRLVDPFGDGTAQRPYDKYTDPMDLALAKVDAAFEFYQKLGVDYLCFHDRDLAPEGDTLRETNANLDKVVDKIVEYQKTSGMKVLWNTSNMFTNPRFVEGAATSPYADVFAYSAAQLKHSLEIGKRVGSENYVFWGGREGYESLWNTNMKQEQEHAAKIFHMAKDYANEIGFDAQMLLEPKPKEPTTHQYDFDAATTIAFMKEYDLDKDFKLNLEGNHANLAGHTYQHEIRVAREAGLLGSLDANQGDKLIGWDIDEYPSNLYETTAAMYEVVENGSIGPRGGLNFDAKPRRSAFAPEDLFLGHIVGMDSFAAGLRVAAAMKQDGFLDNLKADRYSSYKSGVGADIESGKADLKSLEAYAIDKPQSELIAATHSDHLEEIKDTINHYIIDTLSK,./data/raw/alphafold//AF-P29443-F1-model_v4.pdb,844,3275,5584,6470
+824,14882,15091,MNPFHDLEPGPDVPEVVYAIIEIPKGSRNKYELDKKTGLLKLDRVLYSPFFYPVDYGIIPRTWYEDDDPFDIMVIMREPVYPLTIIEARPIGLFKMIDSGDKDYKVLAVPVEDPYFKDWKDIDDVPKAFLDEIAHFFKRYKELQGKEIIVEGWEGAEAAKREILRAIEMYKEKFGKKE,brenda,Q8U438,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>>,91.7,99.81556485108706,95.0,9.5,3.6.1.1,2261.0,1.9623693356700207,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,,1.9623693356700207,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__MNPFHDLEPGPDVPEVVYAIIEIPKGSRNKYELDKKTGLLKLDRVLYSPFFYPVDYGIIPRTWYEDDDPFDIMVIMREPVYPLTIIEARPIGLFKMIDSGDKDYKVLAVPVEDPYFKDWKDIDDVPKAFLDEIAHFFKRYKELQGKEIIVEGWEGAEAAKREILRAIEMYKEKFGKKE,./data/raw/alphafold//AF-Q8U438-F1-model_v4.pdb,350,2917,5250,4739
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+826,18664,18937,MERDGCAGGGSRGGEGGRAPREGPAGNGRDRGRSHAAEAPGDPQAAASLLAPMDVGEEPLEKAARARTAKDPNTYKVLSLVLSVCVLTTILGCIFGLKPSCAKEVKSCKGRCFERTFGNCRCDAACVELGNCCLDYQETCIEPEHIWTCNKFRCGEKRLTRSLCACSDDCKDKGDCCINYSSVCQGEKSWVEEPCESINEPQCPAGFETPPTLLFSLDGFRAEYLHTWGGLLPVISKLKKCGTYTKNMRPVYPTKTFPNHYSIVTGLYPESHGIIDNKMYDPKMNASFSLKSKEKFNPEWYKGEPIWVTAKYQGLKSGTFFWPGSDVEINGIFPDIYKMYNGSVPFEERILAVLQWLQLPKDERPHFYTLYLEEPDSSGHSYGPVSSEVIKALQRVDGMVGMLMDGLKELNLHRCLNLILISDHGMEQGSCKKYIYLNKYLGDVKNIKVIYGPAARLRPSDVPDKYYSFNYEGIARNLSCREPNQHFKPYLKHFLPKRLHFAKSDRIEPLTFYLDPQWQLALNPSERKYCGSGFHGSDNVFSNMQALFVGYGPGFKHGIEADTFENIEVYNLMCDLLNLTPAPNNGTHGSLNHLLKNPVYTPKHPKEVHPLVQCPFTRNPRDNLGCSCNPSILPIEDFQTQFNLTVAEEKIIKHETLPYGRPRVLQKENTICLLSQHQFMSGYSQDILMPLWTSYTVDRNDSFSTEDFSNCLYQDFRIPLSPVHKCSFYKNNTKVSYGFLSPPQLNKNSSGIYSEALLTTNIVPMYQSFQVIWRYFHDTLLRKYAEERNGVNVVSGPVFDFDYDGRCDSLENLRQKRRVIRNQEILIPTHFFIVLTSCKDTSQTPLHCENLDTLAFILPHRTDNSESCVHGKHDSSWVEELLMLHRARITDVEHITGLSFYQQRKEPVSDILKLKTHLPTFSQED,brenda,P22413,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O[C@H]2[C@@H](O)[C@H](n3cnc4c(N)ncnc43)O[C@@H]2CO)[C@@H](O)[C@H]1O.O>>,5.65,99.88309644776864,37.0,9.5,3.6.1.9,9606.0,0.7520484478194386,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O[C@H]2[C@@H](O)[C@H](n3cnc4c(N)ncnc43)O[C@@H]2CO)[C@@H](O)[C@H]1O.O,,0.7520484478194386,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O[C@H]2[C@@H](O)[C@H](n3cnc4c(N)ncnc43)O[C@@H]2CO)[C@@H](O)[C@H]1O.O__MERDGCAGGGSRGGEGGRAPREGPAGNGRDRGRSHAAEAPGDPQAAASLLAPMDVGEEPLEKAARARTAKDPNTYKVLSLVLSVCVLTTILGCIFGLKPSCAKEVKSCKGRCFERTFGNCRCDAACVELGNCCLDYQETCIEPEHIWTCNKFRCGEKRLTRSLCACSDDCKDKGDCCINYSSVCQGEKSWVEEPCESINEPQCPAGFETPPTLLFSLDGFRAEYLHTWGGLLPVISKLKKCGTYTKNMRPVYPTKTFPNHYSIVTGLYPESHGIIDNKMYDPKMNASFSLKSKEKFNPEWYKGEPIWVTAKYQGLKSGTFFWPGSDVEINGIFPDIYKMYNGSVPFEERILAVLQWLQLPKDERPHFYTLYLEEPDSSGHSYGPVSSEVIKALQRVDGMVGMLMDGLKELNLHRCLNLILISDHGMEQGSCKKYIYLNKYLGDVKNIKVIYGPAARLRPSDVPDKYYSFNYEGIARNLSCREPNQHFKPYLKHFLPKRLHFAKSDRIEPLTFYLDPQWQLALNPSERKYCGSGFHGSDNVFSNMQALFVGYGPGFKHGIEADTFENIEVYNLMCDLLNLTPAPNNGTHGSLNHLLKNPVYTPKHPKEVHPLVQCPFTRNPRDNLGCSCNPSILPIEDFQTQFNLTVAEEKIIKHETLPYGRPRVLQKENTICLLSQHQFMSGYSQDILMPLWTSYTVDRNDSFSTEDFSNCLYQDFRIPLSPVHKCSFYKNNTKVSYGFLSPPQLNKNSSGIYSEALLTTNIVPMYQSFQVIWRYFHDTLLRKYAEERNGVNVVSGPVFDFDYDGRCDSLENLRQKRRVIRNQEILIPTHFFIVLTSCKDTSQTPLHCENLDTLAFILPHRTDNSESCVHGKHDSSWVEELLMLHRARITDVEHITGLSFYQQRKEPVSDILKLKTHLPTFSQED,./data/raw/alphafold//AF-P22413-F1-model_v4.pdb,180,4835,4156,4012
+827,22026,22358,MEPQSQSMTLEVPLSLGRYHISEEYGFLLPNPLEALPDHYKPWMEIALRLPHLIENRQLRAHVYRMPLLDCRFLKSYREQRLAHMALAAITMGFVWQEGEGQPQKVLPRSLAIPFVEVSRNLGLPPILVHSDLVLTNWTKRNPEGPLEISNLETIISFPGGESLRGFILVTVLVEKAAVPGLKALVQGMEAIRQHSQDTLLEALQQLRLSIQDITRALAQMHDYVDPDIFYSVIRIFLSGWKDNPAMPVGLVYEGVATEPLKYSGGSAAQSSVLHAFDEFLGIEHCKESVGFLHRMRDYMPPSHKAFLEDLHVAPSLRDYILASGPGDCLMAYNQCVEALGELRSYHINVVARYIISAATRARSRGLTNPSPHALEDRGTGGTAMLSFLKSVREKTMEALLCPGA,sabio,Q8R0V5,O=O.O=O>>NC(CC(=O)c1ccccc1NC=O)C(=O)O,6612.0,57.17724078174639,37.0,6.5,1.13.11.52,10090.0,3.82033284489941,O=O.O=O,NC(CC(=O)c1ccccc1NC=O)C(=O)O,3.82033284489941,O=O.O=O__MEPQSQSMTLEVPLSLGRYHISEEYGFLLPNPLEALPDHYKPWMEIALRLPHLIENRQLRAHVYRMPLLDCRFLKSYREQRLAHMALAAITMGFVWQEGEGQPQKVLPRSLAIPFVEVSRNLGLPPILVHSDLVLTNWTKRNPEGPLEISNLETIISFPGGESLRGFILVTVLVEKAAVPGLKALVQGMEAIRQHSQDTLLEALQQLRLSIQDITRALAQMHDYVDPDIFYSVIRIFLSGWKDNPAMPVGLVYEGVATEPLKYSGGSAAQSSVLHAFDEFLGIEHCKESVGFLHRMRDYMPPSHKAFLEDLHVAPSLRDYILASGPGDCLMAYNQCVEALGELRSYHINVVARYIISAATRARSRGLTNPSPHALEDRGTGGTAMLSFLKSVREKTMEALLCPGA,./data/raw/alphafold//AF-Q8R0V5-F1-model_v4.pdb,2630,5367,2242,5126
+828,15497,15721,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=Cc1ccc(C(=O)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.O=C([O-])c1ccc(CO)cc1,26220.0,0.0562147403079849,30.0,6.2,1.1.1.21,9606.0,4.418632687354066,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=Cc1ccc(C(=O)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.O=C([O-])c1ccc(CO)cc1,4.418632687354066,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=Cc1ccc(C(=O)O)cc1.[H]__MASRLLLNNGAKMPILGLGTWKSPPGQVTEAVKVAIDVGYRHIDCAHVYQNENEVGVAIQEKLREQVVKREELFIVSKLWCTYHEKGLVKGACQKTLSDLKLDYLDLYLIHWPTGFKPGKEFFPLDESGNVVPSDTNILDTWAAMEELVDEGLVKAIGISNFNHLQVEMILNKPGLKYKPAVNQIECHPYLTQEKLIQYCQSKGIVVTAYSPLGSPDRPWAKPEDPSLLEDPRIKAIAAKHNKTTAQVLIRFPMQRNLVVIPKSVTPERIAENFKVFDFELSSQDMTTLLSYNRNWRVCALLSCTSHKDYPFHEEF,./data/raw/alphafold//AF-P15121-F1-model_v4.pdb,1329,607,3631,676
+829,709,728,MKNTYIIGEIGQNHNGSVDLAKLIIELISRPVHEDVFGMDFMPMNAVKMTKRDLSEELAVSQMNQIYDNPNSFGRTYGEHRAFLELDDQAHFEIYKYAKSLGLDFIETLCAKGCLSLLKLFTPDRLKVASRDLTNLPLLEALAETHIPIILSTGMAGQRELDNALDVITRYHSNIAILHCVSQYPTHPNNLNLRTITYLKKHYNKFEIGFSDHTIGISAATAAVAMGAEIIEKHVTIDRHMKGTDQLGSLGPDGVNRMIRDIRIAECWLGTEDLYIEKGVEKSKIKLERSIATRKYIPAGSIIQESDIHLLSPGDGYKWIDKKNVIGHFAKQDISANEIIYPDFIE,brenda,Q8A711,C=C(OP(=O)(O)O)C(=O)O.O.O=P(O)(O)OC[C@H]1OC(O)[C@@H](O)[C@@H](O)[C@@H]1O>>O=C(O)[C@]1(O)C[C@H](O)[C@@H](O)[C@H]([C@H](O)[C@H](O)COP(=O)(O)O)O1.O=P(O)(O)O,0.017,1.2725445299056402e-14,25.0,7.5,2.5.1.132,818.0,-1.769551078621726,C=C(OP(=O)(O)O)C(=O)O.O.O=P(O)(O)OC[C@H]1OC(O)[C@@H](O)[C@@H](O)[C@@H]1O,O=C(O)[C@]1(O)C[C@H](O)[C@@H](O)[C@H]([C@H](O)[C@H](O)COP(=O)(O)O)O1.O=P(O)(O)O,-1.769551078621726,C=C(OP(=O)(O)O)C(=O)O.O.O=P(O)(O)OC[C@H]1OC(O)[C@@H](O)[C@@H](O)[C@@H]1O__MKNTYIIGEIGQNHNGSVDLAKLIIELISRPVHEDVFGMDFMPMNAVKMTKRDLSEELAVSQMNQIYDNPNSFGRTYGEHRAFLELDDQAHFEIYKYAKSLGLDFIETLCAKGCLSLLKLFTPDRLKVASRDLTNLPLLEALAETHIPIILSTGMAGQRELDNALDVITRYHSNIAILHCVSQYPTHPNNLNLRTITYLKKHYNKFEIGFSDHTIGISAATAAVAMGAEIIEKHVTIDRHMKGTDQLGSLGPDGVNRMIRDIRIAECWLGTEDLYIEKGVEKSKIKLERSIATRKYIPAGSIIQESDIHLLSPGDGYKWIDKKNVIGHFAKQDISANEIIYPDFIE,./data/raw/alphafold//AF-Q8A711-F1-model_v4.pdb,1151,754,451,517
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+844,5129,5215,MTTSPTAPVALVTGAAKRLGSSIAEALHAEGYTVCLHYHRSAADASTLAATLNARRPNSAITVQADLSNVATASFSETDGSVPVTLFSRCSALVDACYMHWGRCDVLVNNASSFYPTPLLRKDAGEGGSSVGDKESLEVAAADLFGSNAIAPYFLIKAFAQRVADTRAEQRGTSYSIVNMVDAMTSQPLLGYTMYTMAKEALEGLTRSAALELASLQIRVNGVSPGLSVLPDDMPFSVQEDYRRKVPLYQRNSSAEEVSDVVIFLCSPKAKYITGTCIKVDGGYSLTRA,sabio,P42556,CC(O)C(O)c1cnc2nc(N)[nH]c(=O)c2n1.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)c1,0.23,0.1023184051321535,22.0,6.0,1.5.1.33,5689.0,-0.6382721639824072,CC(O)C(O)c1cnc2nc(N)[nH]c(=O)c2n1.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)c1,0.3617278360175928,CC(O)C(O)c1cnc2nc(N)[nH]c(=O)c2n1.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]__MTTSPTAPVALVTGAAKRLGSSIAEALHAEGYTVCLHYHRSAADASTLAATLNARRPNSAITVQADLSNVATASFSETDGSVPVTLFSRCSALVDACYMHWGRCDVLVNNASSFYPTPLLRKDAGEGGSSVGDKESLEVAAADLFGSNAIAPYFLIKAFAQRVADTRAEQRGTSYSIVNMVDAMTSQPLLGYTMYTMAKEALEGLTRSAALELASLQIRVNGVSPGLSVLPDDMPFSVQEDYRRKVPLYQRNSSAEEVSDVVIFLCSPKAKYITGTCIKVDGGYSLTRA,./data/raw/alphafold//AF-P42556-F1-model_v4.pdb,3093,1856,3487,2301
+845,4643,4699,MAAMRKALPRRLVGLASLRAVSTSSMGTLPKRVKIVEVGPRDGLQNEKNIVSTPVKIKLIDMLSEAGLSVIETTSFVSPKWVPQMGDHTEVLKGIQKFPGINYPVLTPNLKGFEAAVAAGAKEVVIFGAASELFTKKNINCSIEESFQRFDAILKAAQSANISVRGYVSCALGCPYEGKISPAKVAEVTKKFYSMGCYEISLGDTIGVGTPGIMKDMLSAVMQEVPLAALAVHCHDTYGQALANTLMALQMGVSVVDSSVAGLGGCPYAQGASGNLATEDLVYMLEGLGIHTGVNLQKLLEAGNFICQALNRKTSSKVAQATCKL,sabio,P35914,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>>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,108.0,6.2316899055554544e-15,30.0,8.2,4.1.3.4,9606.0,2.03342375548695,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,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,2.03342375548695,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__MAAMRKALPRRLVGLASLRAVSTSSMGTLPKRVKIVEVGPRDGLQNEKNIVSTPVKIKLIDMLSEAGLSVIETTSFVSPKWVPQMGDHTEVLKGIQKFPGINYPVLTPNLKGFEAAVAAGAKEVVIFGAASELFTKKNINCSIEESFQRFDAILKAAQSANISVRGYVSCALGCPYEGKISPAKVAEVTKKFYSMGCYEISLGDTIGVGTPGIMKDMLSAVMQEVPLAALAVHCHDTYGQALANTLMALQMGVSVVDSSVAGLGGCPYAQGASGNLATEDLVYMLEGLGIHTGVNLQKLLEAGNFICQALNRKTSSKVAQATCKL,./data/raw/alphafold//AF-P35914-F1-model_v4.pdb,2950,1685,3297,2096
+846,22662,23001,MVHQVLYRALVSTKWLAESIRSGKVGPSLRVLDASWYSPGTRQARKEYQERHVPGASFFDIEECRDTTSPYEMMLPSEAHFGDYVGNLGISNDTHVVVYDGDDLGSFYAPRVWWMFRVFGHRTVSVLNGGFRNWLKEGHPVTSEPSRPEPAVFKATLNRSLLKTYEQVLENLQSKRFQLVDSRAQGRYLGTQPEPDAVGLDSGHIRGSVNVPFMNFLTEDGFEKSPEELRAIFQDKKVDLSQPLIATCRKGVTACHIALAAYLCGKPDVAVYDGSWSEWFRRAPPETRVSQGKSGKA,sabio,P24329,O=S(=O)(O)[S-].[C-]#N>>N#CS.O=S(O)O,1000000.0,0.7165961682010522,25.0,5.0,2.8.1.1,10116.0,6.0,O=S(=O)(O)[S-].[C-]#N,N#CS.O=S(O)O,6.0,O=S(=O)(O)[S-].[C-]#N__MVHQVLYRALVSTKWLAESIRSGKVGPSLRVLDASWYSPGTRQARKEYQERHVPGASFFDIEECRDTTSPYEMMLPSEAHFGDYVGNLGISNDTHVVVYDGDDLGSFYAPRVWWMFRVFGHRTVSVLNGGFRNWLKEGHPVTSEPSRPEPAVFKATLNRSLLKTYEQVLENLQSKRFQLVDSRAQGRYLGTQPEPDAVGLDSGHIRGSVNVPFMNFLTEDGFEKSPEELRAIFQDKKVDLSQPLIATCRKGVTACHIALAAYLCGKPDVAVYDGSWSEWFRRAPPETRVSQGKSGKA,./data/raw/alphafold//AF-P24329-F1-model_v4.pdb,593,3318,5630,6522
+847,20968,21289,MATPASITNVTVEFLQFPALVTPPASTKSYFLGGAGVRGLNIQEEFVKFTGIGVYLEDKAVSSLGAKWKGKSAAELLDSLDFYRDIIKGPFEKLIRGSKLRTLDGREYVRKVSENCVAHMESVGTYSEAEEKAIEEFRNAFKDQNFPPGSTVFYKQSPTGTLGLSFSKDETIPEHEHAVIDNKPLSEAVLETMIGEIPVSPALKESLATRFHQFFKELEANPNIEN,brenda,Q53B70,O=C(/C=C/c1ccc(O)cc1)c1ccccc1O>>O=C1CC(c2ccc(O)cc2)Oc2ccccc21,22.6,0.0,30.0,7.85,5.5.1.6,3847.0,1.354108439147401,O=C(/C=C/c1ccc(O)cc1)c1ccccc1O,O=C1CC(c2ccc(O)cc2)Oc2ccccc21,1.354108439147401,O=C(/C=C/c1ccc(O)cc1)c1ccccc1O__MATPASITNVTVEFLQFPALVTPPASTKSYFLGGAGVRGLNIQEEFVKFTGIGVYLEDKAVSSLGAKWKGKSAAELLDSLDFYRDIIKGPFEKLIRGSKLRTLDGREYVRKVSENCVAHMESVGTYSEAEEKAIEEFRNAFKDQNFPPGSTVFYKQSPTGTLGLSFSKDETIPEHEHAVIDNKPLSEAVLETMIGEIPVSPALKESLATRFHQFFKELEANPNIEN,./data/raw/alphafold//AF-Q53B70-F1-model_v4.pdb,1991,4147,4013,3855
+848,17531,17769,MSIVNESGSQPVVSRDETLSQIERTSFHISSGKDISLEEIARAARDHQPVTLHDEVVNRVTRSRSILESMVSDERVIYGVNTSMGGFVNYIVPIAKASELQNNLINAVATNVGKYFDDTTVRATMLARIVSLSRGNSAISIVNFKKLIEIYNQGIVPCIPEKGSLGTSGDLGPLAAIALVCTGQWKARYQGEQMSGAMALEKAGISPMELSFKEGLALINGTSAMVGLGVLLYDEVKRLFDTYLTVTSLSIEGLHGKTKPFEPAVHRMKPHQGQLEVATTIWETLADSSLAVNEHEVEKLIAEEMDGLVKASNHQIEDAYSIRCTPQILGPVADTLKNIKQTLTNELNSSNDNPLIDQTTEEVFHNGHFHGQYVSMAMDHLNIALVTMMNLANRRIDRFMDKSNSNGLPPFLCAENAGLRLGLMGGQFMTASITAESRASCMPMSIQSLSTTGDFQDIVSFGLVAARRVREQLKNLKYVFSFELLCACQAVDIRGTAGLSKRTRALYDKTRTLVPYLEEDKTISDYIESIAQTVLTKNSDI,brenda,Q84FL5,N[C@@H](Cc1cccc(F)c1)C(=O)O>>N[C@@H](CC(=O)O)c1cccc(F)c1,0.031,7.736661575550142e-15,31.0,8.0,5.4.3.11,549.0,-1.5086383061657274,N[C@@H](Cc1cccc(F)c1)C(=O)O,N[C@@H](CC(=O)O)c1cccc(F)c1,-1.5086383061657274,N[C@@H](Cc1cccc(F)c1)C(=O)O__MSIVNESGSQPVVSRDETLSQIERTSFHISSGKDISLEEIARAARDHQPVTLHDEVVNRVTRSRSILESMVSDERVIYGVNTSMGGFVNYIVPIAKASELQNNLINAVATNVGKYFDDTTVRATMLARIVSLSRGNSAISIVNFKKLIEIYNQGIVPCIPEKGSLGTSGDLGPLAAIALVCTGQWKARYQGEQMSGAMALEKAGISPMELSFKEGLALINGTSAMVGLGVLLYDEVKRLFDTYLTVTSLSIEGLHGKTKPFEPAVHRMKPHQGQLEVATTIWETLADSSLAVNEHEVEKLIAEEMDGLVKASNHQIEDAYSIRCTPQILGPVADTLKNIKQTLTNELNSSNDNPLIDQTTEEVFHNGHFHGQYVSMAMDHLNIALVTMMNLANRRIDRFMDKSNSNGLPPFLCAENAGLRLGLMGGQFMTASITAESRASCMPMSIQSLSTTGDFQDIVSFGLVAARRVREQLKNLKYVFSFELLCACQAVDIRGTAGLSKRTRALYDKTRTLVPYLEEDKTISDYIESIAQTVLTKNSDI,./data/raw/alphafold//AF-Q84FL5-F1-model_v4.pdb,2803,2376,1300,3251
+849,2791,2829,MNAAAVTPPPEKFNFAEHLLQTNRVRPDKTAFVDDVSSLSFAQLEVKARQLASALRAIGVKREERVLLLMLDGTDWPVSFLGAIYAGIVPVAVNTLLTADDYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVVVSRPAAPLEPGEVDFAAFVGAQAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYWSPELYGRHTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATSLLMGERPTPDAVFKRWLGGVGGVKSTVFYGAPTGYAGMLAAPNLPSRDQVALRLAASAGEALPAEIGQRFQRHFGIDIVDGIGSTEMLHIFLSNLPDRVRYGTTGWPVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGGWTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLEAAVVGVADEHGLTKPKAYVVARPGQTLSETELKTFIKDRLAPYKYPRSAVFVAELPKTATGKIQRFKLREGVLG,brenda,Q3LB11,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.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>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.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.7,0.0357226645422009,31.0,8.0,6.2.1.25,1076.0,-0.1549019599857432,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.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,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.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,-0.1549019599857432,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.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MNAAAVTPPPEKFNFAEHLLQTNRVRPDKTAFVDDVSSLSFAQLEVKARQLASALRAIGVKREERVLLLMLDGTDWPVSFLGAIYAGIVPVAVNTLLTADDYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVVVSRPAAPLEPGEVDFAAFVGAQAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYWSPELYGRHTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATSLLMGERPTPDAVFKRWLGGVGGVKSTVFYGAPTGYAGMLAAPNLPSRDQVALRLAASAGEALPAEIGQRFQRHFGIDIVDGIGSTEMLHIFLSNLPDRVRYGTTGWPVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGGWTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLEAAVVGVADEHGLTKPKAYVVARPGQTLSETELKTFIKDRLAPYKYPRSAVFVAELPKTATGKIQRFKLREGVLG,./data/raw/alphafold//AF-Q3LB11-F1-model_v4.pdb,1671,1281,4576,1533
+850,3580,3629,MAITVSSRQLFIDGEWRVPILNKRIPNINPSTENIIGDIPAATKEDVDLAVDAAKRAISRKNGRDWSAASGSLRARYLRAIAAKIKEKKDELGKLESIDCGKPLEEALADLDDVVACFEYYAGLAEELDSKQKAPISLPMDTFKSYILKEPIGVVALITPWNYPFLMATWKIAPALAAGCAAILKPSELASVTCLELGEICKEVGLPRGVLNIVTGLGHEAGASLASHPDVDKISFTGSSATGSKIMTTAAQLVKPVSLELGGKSPIVVFEDVDLDKVAEWTVFGCFFTNGQICSATSRLIVHESIAVEFVDKLVKWAENIKISDPLEEGCRLGPIVSEAQYKKVLNCISSAKSEGATILTGGRRPEHLKKGYFVEPTIITDVTTSMQIWREEVFGPVLAVKTFSTEEEAINLANDTHYGLGSAVMSNDLERCERLSKALQAGIVWINCAQPSFIQAPWGGIKRSGFGRELGEWGLENYLSVKQVTRYTSDEPWGWYQPPSKL,brenda,Q8VWZ1,CC(C)C(O)=NCCCC=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>>CCC(O)=NCCC(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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],2.32,6.765736635475371e-15,30.0,9.0,1.2.1.19,3888.0,0.3654879848908996,CC(C)C(O)=NCCCC=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,CCC(O)=NCCC(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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],0.3654879848908996,CC(C)C(O)=NCCCC=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__MAITVSSRQLFIDGEWRVPILNKRIPNINPSTENIIGDIPAATKEDVDLAVDAAKRAISRKNGRDWSAASGSLRARYLRAIAAKIKEKKDELGKLESIDCGKPLEEALADLDDVVACFEYYAGLAEELDSKQKAPISLPMDTFKSYILKEPIGVVALITPWNYPFLMATWKIAPALAAGCAAILKPSELASVTCLELGEICKEVGLPRGVLNIVTGLGHEAGASLASHPDVDKISFTGSSATGSKIMTTAAQLVKPVSLELGGKSPIVVFEDVDLDKVAEWTVFGCFFTNGQICSATSRLIVHESIAVEFVDKLVKWAENIKISDPLEEGCRLGPIVSEAQYKKVLNCISSAKSEGATILTGGRRPEHLKKGYFVEPTIITDVTTSMQIWREEVFGPVLAVKTFSTEEEAINLANDTHYGLGSAVMSNDLERCERLSKALQAGIVWINCAQPSFIQAPWGGIKRSGFGRELGEWGLENYLSVKQVTRYTSDEPWGWYQPPSKL,./data/raw/alphafold//AF-Q8VWZ1-F1-model_v4.pdb,1760,4665,1650,1375
+851,23120,23462,MADNRDPASDQMKHWKEQRAAQKPDVLTTGGGNPVGDKLNSLTVGPRGPLLVQDVVFTDEMAHFDRERIPERVVHAKGAGAFGYFEVTHDITRYSKAKVFEHIGKRTPIAVRFSTVAGESGSADTVRDPRGFAVKFYTEDGNWDLVGNNTPIFFIRDALLFPSFIHSQKRNPQTHLKDPDMVWDFWSLRPESLHQVSFLFSDRGIPDGHRHMNGYGSHTFKLVNANGEAVYCKFHYKTDQGIKNLSVEDAARLAHEDPDYGLRDLFNAIATGNYPSWTLYIQVMTFSEAEIFPFNPFDLTKVWPHGDYPLIPVGKLVLNRNPVNYFAEVEQLAFDPSNMPPGIEPSPDKMLQGRLFAYPDTHRHRLGPNYLQIPVNCPYRARVANYQRDGPMCMMDNQGGAPNYYPNSFSAPEHQPSALEHRTHFSGDVQRFNSANDDNVTQVRTFYLKVLNEEQRKRLCENIAGHLKDAQLFIQKKAVKNFSDVHPEYGSRIQALLDKYNEEKPKNAVHTYVQHGSHLSAREKANL,sabio,P00432,OO>>O.O=O,181000.0,18.81637597469039,37.0,7.0,1.11.1.6,9913.0,5.2576785748691846,OO,O.O=O,5.326335860928752,OO__MADNRDPASDQMKHWKEQRAAQKPDVLTTGGGNPVGDKLNSLTVGPRGPLLVQDVVFTDEMAHFDRERIPERVVHAKGAGAFGYFEVTHDITRYSKAKVFEHIGKRTPIAVRFSTVAGESGSADTVRDPRGFAVKFYTEDGNWDLVGNNTPIFFIRDALLFPSFIHSQKRNPQTHLKDPDMVWDFWSLRPESLHQVSFLFSDRGIPDGHRHMNGYGSHTFKLVNANGEAVYCKFHYKTDQGIKNLSVEDAARLAHEDPDYGLRDLFNAIATGNYPSWTLYIQVMTFSEAEIFPFNPFDLTKVWPHGDYPLIPVGKLVLNRNPVNYFAEVEQLAFDPSNMPPGIEPSPDKMLQGRLFAYPDTHRHRLGPNYLQIPVNCPYRARVANYQRDGPMCMMDNQGGAPNYYPNSFSAPEHQPSALEHRTHFSGDVQRFNSANDDNVTQVRTFYLKVLNEEQRKRLCENIAGHLKDAQLFIQKKAVKNFSDVHPEYGSRIQALLDKYNEEKPKNAVHTYVQHGSHLSAREKANL,./data/raw/alphafold//AF-P00432-F1-model_v4.pdb,868,352,6124,7066
+852,11576,11734,MVDSVYRTRSLGVAAEGIPDQYADGEAARVWQLYIGDTRSRTAEYKAWLLGLLRQHGCHRVLDVACGTGVDSIMLVEEGFSVTSVDASDKMLKYALKERWNRRKEPAFDKWVIEEANWLTLDKDVPAGDGFDAVICLGNSFAHLPDSKGDQSEHRLALKNIASMVRPGGLLVIDHRNYDYILSTGCAPPGKNIYYKSDLTKDITTSVLTVNNKAHMVTLDYTVQVPGAGRDGAPGFSKFRLSYYPHCLASFTELVQEAFGGRCQHSVLGDFKPYRPGQAYVPCYFIHVLKKTG,brenda,P13255,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCC(=O)O>>CNCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,0.45,0.1062134891131273,37.0,7.4,2.1.1.20,10116.0,-0.3467874862246563,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCC(=O)O,CNCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,0.4635944021870002,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCC(=O)O__MVDSVYRTRSLGVAAEGIPDQYADGEAARVWQLYIGDTRSRTAEYKAWLLGLLRQHGCHRVLDVACGTGVDSIMLVEEGFSVTSVDASDKMLKYALKERWNRRKEPAFDKWVIEEANWLTLDKDVPAGDGFDAVICLGNSFAHLPDSKGDQSEHRLALKNIASMVRPGGLLVIDHRNYDYILSTGCAPPGKNIYYKSDLTKDITTSVLTVNNKAHMVTLDYTVQVPGAGRDGAPGFSKFRLSYYPHCLASFTELVQEAFGGRCQHSVLGDFKPYRPGQAYVPCYFIHVLKKTG,./data/raw/alphafold//AF-P13255-F1-model_v4.pdb,1889,4017,1863,3687
+853,13122,13297,MARSKIALIGAGQIGGTLAHLAGLKELGDVVLFDIVDGVPQGKALDIAESAPVDGFDAKYSGASDYSAIAGADVVIVTAGVPRKPGMSRDDLIGINLKVMEAVGAGIKEHAPDAFVICITNPLDAMVWALQKFSGLPTNKVVGMAGVLDSARFRHFLAEEFGVSVEDVTAFVLGGHGDDMVPLTRYSTVAGVPLTDLVKLGWTTQEKLDAMVERTRKGGGEIVNLLKTGSAFYAPAASAIAMAESYLRDKKRVLPCAAYLDGQYGIDGLYVGVPVVIGENGVERVLEVTFNDDEKAMFEKSVNSVKGLIEACKSVNDKLA,brenda,Q84FY8,N=C(O)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)C[C@H](O)C(=O)O,460.0,7.114097664129157e-15,30.0,8.1,1.1.1.37,408.0,2.6627578316815743,N=C(O)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)C[C@H](O)C(=O)O,2.6627578316815743,N=C(O)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+]__MARSKIALIGAGQIGGTLAHLAGLKELGDVVLFDIVDGVPQGKALDIAESAPVDGFDAKYSGASDYSAIAGADVVIVTAGVPRKPGMSRDDLIGINLKVMEAVGAGIKEHAPDAFVICITNPLDAMVWALQKFSGLPTNKVVGMAGVLDSARFRHFLAEEFGVSVEDVTAFVLGGHGDDMVPLTRYSTVAGVPLTDLVKLGWTTQEKLDAMVERTRKGGGEIVNLLKTGSAFYAPAASAIAMAESYLRDKKRVLPCAAYLDGQYGIDGLYVGVPVVIGENGVERVLEVTFNDDEKAMFEKSVNSVKGLIEACKSVNDKLA,./data/raw/alphafold//AF-Q84FY8-F1-model_v4.pdb,1258,4494,4404,4295
+854,18344,18604,MKTTLKMTALAALSAFVLAGCGSHQMKSEGHANMQLQQQAVLGLNWMQDSGEYKALAYQAYNAAKVAFDHAKVAKGKKKAVVADLDETMLDNSPYAGWQVQNNKPFDGKDWTRWVDARQSRAVPGAVEFNNYVNSHNGKVFYVTNRKDSTEKSGTIDDMKRLGFNGVEESAFYLKKDKSAKAARFAEIEKQGYEIVLYVGDNLDDFGNTVYGKLNADRRAFVDQNQGKFGKTFIMLPNANYGGWEGGLAEGYFKKDTQGQIKARLDAVQAWDGK,brenda,P26093,Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OP(=O)(O)O.O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O.O=P(O)(O)O,0.11,7.771036020332536e-15,25.0,5.5,3.1.3.2,727.0,-0.958607314841775,Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OP(=O)(O)O.O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O.O=P(O)(O)O,-0.958607314841775,Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OP(=O)(O)O.O__MKTTLKMTALAALSAFVLAGCGSHQMKSEGHANMQLQQQAVLGLNWMQDSGEYKALAYQAYNAAKVAFDHAKVAKGKKKAVVADLDETMLDNSPYAGWQVQNNKPFDGKDWTRWVDARQSRAVPGAVEFNNYVNSHNGKVFYVTNRKDSTEKSGTIDDMKRLGFNGVEESAFYLKKDKSAKAARFAEIEKQGYEIVLYVGDNLDDFGNTVYGKLNADRRAFVDQNQGKFGKTFIMLPNANYGGWEGGLAEGYFKKDTQGQIKARLDAVQAWDGK,./data/raw/alphafold//AF-P26093-F1-model_v4.pdb,2317,4656,4684,4513
+855,22948,23290,MVFDGEKILPEYERAKEAYAQFGVDTDGVLEKMKNIKISLHCWQGDDVTGFEEATKGMGGGGILATGNYFGKARNGDELRQDLEFAMSLIPGKHKVNLHAIYAETNGKKVDRDQLSVEHFEKWINWAKEKGIGLDFNPTFFAHPKASSGYTLSSKDESIRKFWVQHAIKSREIASVMGKETGQPCINNIWIPDGSKDFPVQRYEHRKILKESLDEIFDAKVDKQYLIDSVESKLFGIGSEAYVVGSHEFYMGYVFTSKHDIAICFDLGHFHPTETISDKISAVLAYSKKILLHLSRGMRWDSDHVVILNDEVLSVAQEVKRTNGFEKVYFALDFFDASINRITAWVTGARAALKAILFALLEPTHLLIETENEGNFGMRLALLEEFKTLPFSAVWNKYCYDSGVPVGSTWLEKVKEYEEKVLKNRV,brenda,A4XHV7,OC[C@@H]1OC(O)[C@H](O)[C@H](O)[C@H]1O>>O=C(CO)[C@H](O)[C@@H](O)[C@@H](O)CO,78.7,7.866251170845146e-15,65.0,7.0,5.3.1.14,44001.0,1.8959747323590648,OC[C@@H]1OC(O)[C@H](O)[C@H](O)[C@H]1O,O=C(CO)[C@H](O)[C@@H](O)[C@@H](O)CO,1.8959747323590648,OC[C@@H]1OC(O)[C@H](O)[C@H](O)[C@H]1O__MVFDGEKILPEYERAKEAYAQFGVDTDGVLEKMKNIKISLHCWQGDDVTGFEEATKGMGGGGILATGNYFGKARNGDELRQDLEFAMSLIPGKHKVNLHAIYAETNGKKVDRDQLSVEHFEKWINWAKEKGIGLDFNPTFFAHPKASSGYTLSSKDESIRKFWVQHAIKSREIASVMGKETGQPCINNIWIPDGSKDFPVQRYEHRKILKESLDEIFDAKVDKQYLIDSVESKLFGIGSEAYVVGSHEFYMGYVFTSKHDIAICFDLGHFHPTETISDKISAVLAYSKKILLHLSRGMRWDSDHVVILNDEVLSVAQEVKRTNGFEKVYFALDFFDASINRITAWVTGARAALKAILFALLEPTHLLIETENEGNFGMRLALLEEFKTLPFSAVWNKYCYDSGVPVGSTWLEKVKEYEEKVLKNRV,./data/raw/alphafold//AF-A4XHV7-F1-model_v4.pdb,3685,3686,1482,3448
+856,20550,20856,MVSTAKMVRGKKMEIVSLLVLVMMTAAATAASVTYDHRALVIDGKRKILISGSIHYPRSTPEMWPDLIQKSKDGGLDVIETYVFWNGHEPEKNKYNFEGRYDLVKFVKLAAKAGLYVHLRIGPYACAEWNYGGFPVWLHFVPGIKFRTDNEPFKAEMQRFTAKIVDLMKQEKLYASQGGPIILSQIENEYGNIDSSYGAAGKSYMKWSASMALSLDTGVPWNMCQQGDAPDPIINTCNGFYCDQFTPNSNNKPKMWTENWSGWFLGFGEPSPYRPVEDLAFAVARFFQRGGTFQNYYMYHGGTNFERTSGGPLISTSYDYDAPIDEYGLLRQPKWGHLRDLHKAIKLCEDALIATDPKITSLGSNLEAAVYKTSTGSCAAFLANIGTKSDATVTFNGKSYRLPAWSVSILPDCKNVAFNTAKINSATESTAFARQSLKPNADSSAELGSQWSYIKEPVGISKADAFVKPGLLEQINTTADKSDYLWYSLRMDIKGDETFLDEGSKAVLHVQSIGQLVYAFINGKLAGSGNGKQKISLDIPINLVTGKNTIDLLSVTVGLANYGPFFDLTGAGITGPVSLKSAKTGSSTDLSSQQWTYQVGLKGEDKGLGSGDSSEWVSNSPLPTSQPLIWYKTTFDAPSGSDPVAIDFTGTGKGIAWVNGQSIGRYWPTSIARTDGCVGSCDYRGSYRSNKCLKNCGKPSQTLYHVPRSWIKPSGNTLVLLEEMGGDPTKISFATKQTGSNLCLTVSQSHPAPVDTWISDSKFSNRTSPVLSLKCPVSTQVISSIRFASFGTPTGTCGSFSYGHCSSARSLSVVQKACVGSRSCKVEVSTRVFGEPCRGVVKSLAVEASCA,brenda,Q6L619,O.OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)O[C@H](CO)[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,28.6,33.2717722930995,37.0,4.0,3.2.1.145,3726.0,1.4563660331290431,O.OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)O[C@H](CO)[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,1.4563660331290431,O.OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)O[C@H](CO)[C@@H]2O)[C@H](O)[C@@H](O)[C@H]1O__MVSTAKMVRGKKMEIVSLLVLVMMTAAATAASVTYDHRALVIDGKRKILISGSIHYPRSTPEMWPDLIQKSKDGGLDVIETYVFWNGHEPEKNKYNFEGRYDLVKFVKLAAKAGLYVHLRIGPYACAEWNYGGFPVWLHFVPGIKFRTDNEPFKAEMQRFTAKIVDLMKQEKLYASQGGPIILSQIENEYGNIDSSYGAAGKSYMKWSASMALSLDTGVPWNMCQQGDAPDPIINTCNGFYCDQFTPNSNNKPKMWTENWSGWFLGFGEPSPYRPVEDLAFAVARFFQRGGTFQNYYMYHGGTNFERTSGGPLISTSYDYDAPIDEYGLLRQPKWGHLRDLHKAIKLCEDALIATDPKITSLGSNLEAAVYKTSTGSCAAFLANIGTKSDATVTFNGKSYRLPAWSVSILPDCKNVAFNTAKINSATESTAFARQSLKPNADSSAELGSQWSYIKEPVGISKADAFVKPGLLEQINTTADKSDYLWYSLRMDIKGDETFLDEGSKAVLHVQSIGQLVYAFINGKLAGSGNGKQKISLDIPINLVTGKNTIDLLSVTVGLANYGPFFDLTGAGITGPVSLKSAKTGSSTDLSSQQWTYQVGLKGEDKGLGSGDSSEWVSNSPLPTSQPLIWYKTTFDAPSGSDPVAIDFTGTGKGIAWVNGQSIGRYWPTSIARTDGCVGSCDYRGSYRSNKCLKNCGKPSQTLYHVPRSWIKPSGNTLVLLEEMGGDPTKISFATKQTGSNLCLTVSQSHPAPVDTWISDSKFSNRTSPVLSLKCPVSTQVISSIRFASFGTPTGTCGSFSYGHCSSARSLSVVQKACVGSRSCKVEVSTRVFGEPCRGVVKSLAVEASCA,./data/raw/alphafold//AF-Q6L619-F1-model_v4.pdb,442,3107,5393,6274
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+866,17234,17465,MAKSDVKLLGAWPSPFVMRPRIALNIKSVEYEFLEETLGSKSQLLLESNPVHKKIPVLIHGGKPICESLVIVEYIDEVWSPGPAILPSDPYDRALARFWAAYLDEKWFPTMRNIAAAKDEEARKALIDQVGEGLVLLEDAFSKCSKGKGFFGGDQIGYLDIAFGSFLGWLRAIEKMNGVKLMDETRTPGLLKWANSFSSHPAVKDVFPETEKLVEFAKVLAKLKATPPK,brenda,A0A4Y5R032,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1>>Cl.N[C@@H](CCC(O)=N[C@@H](CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=NCC(=O)O)C(=O)O,112.987,2.7843620188059523e-14,25.0,6.5,2.5.1.18,75706.0,2.053028477527228,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1,Cl.N[C@@H](CCC(O)=N[C@@H](CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=NCC(=O)O)C(=O)O,2.053028477527228,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1__MAKSDVKLLGAWPSPFVMRPRIALNIKSVEYEFLEETLGSKSQLLLESNPVHKKIPVLIHGGKPICESLVIVEYIDEVWSPGPAILPSDPYDRALARFWAAYLDEKWFPTMRNIAAAKDEEARKALIDQVGEGLVLLEDAFSKCSKGKGFFGGDQIGYLDIAFGSFLGWLRAIEKMNGVKLMDETRTPGLLKWANSFSSHPAVKDVFPETEKLVEFAKVLAKLKATPPK,./data/raw/alphafold//AF-A0A4Y5R032-F1-model_v4.pdb,3470,3382,1113,3029
+867,21154,21478,MPEIITPIITPFTKDNRIDKEKLKIHAENLIRKGIDKLFVNGTTGLGPSLSPEEKLENLKAVYDVTNKIIFQVGGLNLDDAIRLAKLSKDFDIVGIASYAPYYYPRMSEKHLVKYFKTLCEVSPHPVYLYNYPTATGKDIDAKVAKEIGCFTGVKDTIENIIHTLDYKRLNPNMLVYSGSDMLIATVASTGLDGNVAAGSNYLPEVTVTIKKLAMERKIDEALKLQFLHDEVIEASRIFGSLSSNYVLTKYFQGYDLGYPRPPIFPLDDEEERQLIKKVEGIRAKLVELKILKE,brenda,O54288,O=C(O)C(=O)C[C@H](O)[C@H](O)COP(=O)(O)O>>CC(=O)C(=O)O.O=C[C@H](O)COP(=O)(O)O,61.9,1.0989799446445934e-14,75.0,6.0,4.1.2.55,2287.0,1.791690649020118,O=C(O)C(=O)C[C@H](O)[C@H](O)COP(=O)(O)O,CC(=O)C(=O)O.O=C[C@H](O)COP(=O)(O)O,1.791690649020118,O=C(O)C(=O)C[C@H](O)[C@H](O)COP(=O)(O)O__MPEIITPIITPFTKDNRIDKEKLKIHAENLIRKGIDKLFVNGTTGLGPSLSPEEKLENLKAVYDVTNKIIFQVGGLNLDDAIRLAKLSKDFDIVGIASYAPYYYPRMSEKHLVKYFKTLCEVSPHPVYLYNYPTATGKDIDAKVAKEIGCFTGVKDTIENIIHTLDYKRLNPNMLVYSGSDMLIATVASTGLDGNVAAGSNYLPEVTVTIKKLAMERKIDEALKLQFLHDEVIEASRIFGSLSSNYVLTKYFQGYDLGYPRPPIFPLDDEEERQLIKKVEGIRAKLVELKILKE,./data/raw/alphafold//AF-O54288-F1-model_v4.pdb,1311,5210,1597,724
+868,998,1024,MKKRIGIVGAGTAGLHLGLFLRQHDVDVTVYTDRKPDEYSGLRLLNTVAHNAVTVQREVALDVNEWPSEEFGYFGHYYYVGGPQPMRFYGDLKAPSRAVDYRLYQPMLMRALEARGGKFCYDAVSAEDLEGLSEQYDLLVVCTGKYALGKVFEKQSENSPFEKPQRALCVGLFKGIKEAPIRAVTMSFSPGHGELIEIPTLSFNGMSTALVLENHIGSDLEVLAHTKYDDDPRAFLDLMLEKLGKHHPSVAERIDPAEFDLANSSLDILQGGVVPAFRDGHATLNNGKTIIGLGDIQATVDPVLGQGANMASYAAWILGEEILAHSVYDLRFSEHLERRRQDRVLCATRWTNFTLSALSALPPEFLAFLQILSQSREMADEFTDNFNYPERQWDRFSSPERIGQWCSQFAPTIAA,uniprot_search,O50214,C=Cc1ccccc1.Cc1cc2c(cc1C)N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]1O)c1nc(O)nc(O)c1N2.O=O>>Cc1cc2nc3c(O)nc(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)c2cc1C.O.c1ccc(C2CO2)cc1,1.6,6.150400808117525e-15,37.0,7.5,1.14.14.11,306.0,0.2041199826559248,C=Cc1ccccc1.Cc1cc2c(cc1C)N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]1O)c1nc(O)nc(O)c1N2.O=O,Cc1cc2nc3c(O)nc(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)c2cc1C.O.c1ccc(C2CO2)cc1,0.2041199826559248,C=Cc1ccccc1.Cc1cc2c(cc1C)N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]1O)c1nc(O)nc(O)c1N2.O=O__MKKRIGIVGAGTAGLHLGLFLRQHDVDVTVYTDRKPDEYSGLRLLNTVAHNAVTVQREVALDVNEWPSEEFGYFGHYYYVGGPQPMRFYGDLKAPSRAVDYRLYQPMLMRALEARGGKFCYDAVSAEDLEGLSEQYDLLVVCTGKYALGKVFEKQSENSPFEKPQRALCVGLFKGIKEAPIRAVTMSFSPGHGELIEIPTLSFNGMSTALVLENHIGSDLEVLAHTKYDDDPRAFLDLMLEKLGKHHPSVAERIDPAEFDLANSSLDILQGGVVPAFRDGHATLNNGKTIIGLGDIQATVDPVLGQGANMASYAAWILGEEILAHSVYDLRFSEHLERRRQDRVLCATRWTNFTLSALSALPPEFLAFLQILSQSREMADEFTDNFNYPERQWDRFSSPERIGQWCSQFAPTIAA,./data/raw/alphafold//AF-O50214-F1-model_v4.pdb,1237,3049,584,670
+869,6473,6586,MHLMNMVDPDFNSLIELSKSAGDMTKIEPAMLRNFLDESSLSSRGAPVEIKEIKDYKIKLDGRTLNARMYDDNNAKSAILYYHGGGFLFGNIETYDNYCRFLAKESGVKIISIEYRLAPEHKFPDAFNDAYDSFHYIAKKKKDFGIEGRIGVAGDSAGANLAAALCLKCRDGKTEMPAVQVLFYPSLAPDNFSRSFIEYSDNYVLTGKMIRYFGNMYSKNMQDLINPYFSPLVADDFSNLPPAIMVTNEYDPLRDPEETYVKKLREAGVRAVGIRGIGMIHGSATDFEVSDGARNIVKMVARIIPDYL,brenda,Q2PCE5,CCCC(=O)OCC(COC(=O)CCC)OC(=O)CCC.O>>CCCC(=O)O.OCC(O)CO,23.0,27.94797261464726,50.0,2.0,3.1.1.1,74969.0,1.3617278360175928,CCCC(=O)OCC(COC(=O)CCC)OC(=O)CCC.O,CCCC(=O)O.OCC(O)CO,1.3617278360175928,CCCC(=O)OCC(COC(=O)CCC)OC(=O)CCC.O__MHLMNMVDPDFNSLIELSKSAGDMTKIEPAMLRNFLDESSLSSRGAPVEIKEIKDYKIKLDGRTLNARMYDDNNAKSAILYYHGGGFLFGNIETYDNYCRFLAKESGVKIISIEYRLAPEHKFPDAFNDAYDSFHYIAKKKKDFGIEGRIGVAGDSAGANLAAALCLKCRDGKTEMPAVQVLFYPSLAPDNFSRSFIEYSDNYVLTGKMIRYFGNMYSKNMQDLINPYFSPLVADDFSNLPPAIMVTNEYDPLRDPEETYVKKLREAGVRAVGIRGIGMIHGSATDFEVSDGARNIVKMVARIIPDYL,./data/raw/alphafold//AF-Q2PCE5-F1-model_v4.pdb,1438,958,762,1060
+870,6940,7056,MAAKKVFGSAEASNLVTELRRSFDDGVTRGYEWRVTQLKKLMIICDNHEPEIVAALRDDLGKPELESSVYEVSLLRNSIKLALKQLKNWMAPEKAKTSLTTFPASAEIVSEPLGVVLVISAWNYPFLLSIDPVIGAISAGNAVVLKPSELAPASSALLTKLLEQYLDPSAVRVVEGAVTETSALLEQKWDKIFYTGSSKIGRVIMAAAAKHLTPVVLELGGKSPVVVDSDTDLKVTVRRIIVGKWGCNNGQACVSPDYILTTKEYAPKLIDAMKLELEKFYGKNPIESKDMSRIVNSNHFDRLSKLLDEKEVSDKIVYGGEKDRENLKIAPTILLDVPLDSLIMSEEIFGPLLPILTLNNLEESFDVIRSRPKPLAAYLFTHNKKLKERFAATVSAGGIVVNDIAVHLALHTLPFGGVGESGMGAYHGKFSFDAFSHKKAVLYRSLFGDSAVRYPPYSRGKLRLLKALVDSNIFDLFKVLLGLA,brenda,Q70DU8,CCCCCC/C=C/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.O>>CCCCCC/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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],2.7,6.905353375244994e-15,25.0,8.0,1.2.1.3,3702.0,0.4313637641589873,CCCCCC/C=C/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.O,CCCCCC/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](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],0.4313637641589873,CCCCCC/C=C/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.O__MAAKKVFGSAEASNLVTELRRSFDDGVTRGYEWRVTQLKKLMIICDNHEPEIVAALRDDLGKPELESSVYEVSLLRNSIKLALKQLKNWMAPEKAKTSLTTFPASAEIVSEPLGVVLVISAWNYPFLLSIDPVIGAISAGNAVVLKPSELAPASSALLTKLLEQYLDPSAVRVVEGAVTETSALLEQKWDKIFYTGSSKIGRVIMAAAAKHLTPVVLELGGKSPVVVDSDTDLKVTVRRIIVGKWGCNNGQACVSPDYILTTKEYAPKLIDAMKLELEKFYGKNPIESKDMSRIVNSNHFDRLSKLLDEKEVSDKIVYGGEKDRENLKIAPTILLDVPLDSLIMSEEIFGPLLPILTLNNLEESFDVIRSRPKPLAAYLFTHNKKLKERFAATVSAGGIVVNDIAVHLALHTLPFGGVGESGMGAYHGKFSFDAFSHKKAVLYRSLFGDSAVRYPPYSRGKLRLLKALVDSNIFDLFKVLLGLA,./data/raw/alphafold//AF-Q70DU8-F1-model_v4.pdb,1497,2040,3690,2543
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+886,45,45,MVSQALRLLCLLLGLQGCLAAGGVAKASGGETRDMPWKPGPHRVFVTQEEAHGVLHRRRRANAFLEELRPGSLERECKEEQCSFEEAREIFKDAERTKLFWISYSDGDQCASSPCQNGGSCKDQLQSYICFCLPAFEGRNCETHKDDQLICVNENGGCEQYCSDHTGTKRSCRCHEGYSLLADGVSCTPTVEYPCGKIPILEKRNASKPQGRIVGGKVCPKGECPWQVLLLVNGAQLCGGTLINTIWVVSAAHCFDKIKNWRNLIAVLGEHDLSEHDGDEQSRRVAQVIIPSTYVPGTTNHDIALLRLHQPVVLTDHVVPLCLPERTFSERTLAFVRFSLVSGWGQLLDRGATALELMVLNVPRLMTQDCLQQSRKVGDSPNITEYMFCAGYSDGSKDSCKGDSGGPHATHYRGTWYLTGIVSWGQGCATVGHFGVYTRVSQYIEWLQKLMRSEPRPGVLLRAPFP,sabio,P08709,>>,3120.0,0.0,37.0,,3.4.21.21,9606.0,3.494154594018443,,,3.494154594018443,__MVSQALRLLCLLLGLQGCLAAGGVAKASGGETRDMPWKPGPHRVFVTQEEAHGVLHRRRRANAFLEELRPGSLERECKEEQCSFEEAREIFKDAERTKLFWISYSDGDQCASSPCQNGGSCKDQLQSYICFCLPAFEGRNCETHKDDQLICVNENGGCEQYCSDHTGTKRSCRCHEGYSLLADGVSCTPTVEYPCGKIPILEKRNASKPQGRIVGGKVCPKGECPWQVLLLVNGAQLCGGTLINTIWVVSAAHCFDKIKNWRNLIAVLGEHDLSEHDGDEQSRRVAQVIIPSTYVPGTTNHDIALLRLHQPVVLTDHVVPLCLPERTFSERTLAFVRFSLVSGWGQLLDRGATALELMVLNVPRLMTQDCLQQSRKVGDSPNITEYMFCAGYSDGSKDSCKGDSGGPHATHYRGTWYLTGIVSWGQGCATVGHFGVYTRVSQYIEWLQKLMRSEPRPGVLLRAPFP,./data/raw/alphafold//AF-P08709-F1-model_v4.pdb,1839,4438,42,44
+887,19212,19498,MMKGWMKCGLAGAVVLMASFWGGSVRAAGMSLTQVSGPVYVVEDNYYVQENSMVYFGAKGVTVVGATWTPDTARELHKLIKRVSRKPVLEVINTNYHTDRAGGNAYWKSIGAKVVSTRQTRDLMKSDWAEIVAFTRKGLPEYPDLPLVLPNVVHDGDFTLQEGKVRAFYAGPAHTPDGIFVYFPDEQVLYGNCILKEKLGNLSFADVKAYPQTLERLKAMKLPIKTVIGGHDSPLHGPELIDHYEALIKAAPQS,brenda,P26918,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>>,0.008,99.8132684005318,30.0,6.5,3.5.2.6,644.0,-2.096910013008056,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,,-2.096910013008056,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__MMKGWMKCGLAGAVVLMASFWGGSVRAAGMSLTQVSGPVYVVEDNYYVQENSMVYFGAKGVTVVGATWTPDTARELHKLIKRVSRKPVLEVINTNYHTDRAGGNAYWKSIGAKVVSTRQTRDLMKSDWAEIVAFTRKGLPEYPDLPLVLPNVVHDGDFTLQEGKVRAFYAGPAHTPDGIFVYFPDEQVLYGNCILKEKLGNLSFADVKAYPQTLERLKAMKLPIKTVIGGHDSPLHGPELIDHYEALIKAAPQS,./data/raw/alphafold//AF-P26918-F1-model_v4.pdb,1463,1689,3301,2101
+888,18110,18364,MAKVRTKDVMEQFNLELISGEEGINRPITMSDLSRPGIEIAGYFTYYPRERVQLLGKTELSFFEQLPEEEKKQRMDSLCTDVTPAIILSRDMPIPQELIDASEKNGVPVLRSPLKTTRLSSRLTNFLESRLAPTTAIHGVLVDIYGVGVLITGKSGVGKSETALELVKRGHRLVADDCVEIRQEDQDTLVGNAPELIEHLLEIRGLGIINVMTLFGAGAVRSNKRITIVMNLELWEQGKQYDRLGLEEETMKIIDTEITKLTIPVRPGRNLAVIIEVAAMNFRLKRMGLNAAEQFTNKLADVIEDGEQEE,sabio,O34483,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,0.3,8.550382997375417,37.0,8.0,2.7.11.-,1423.0,-0.5228787452803376,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,0.8750612633917001,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MAKVRTKDVMEQFNLELISGEEGINRPITMSDLSRPGIEIAGYFTYYPRERVQLLGKTELSFFEQLPEEEKKQRMDSLCTDVTPAIILSRDMPIPQELIDASEKNGVPVLRSPLKTTRLSSRLTNFLESRLAPTTAIHGVLVDIYGVGVLITGKSGVGKSETALELVKRGHRLVADDCVEIRQEDQDTLVGNAPELIEHLLEIRGLGIINVMTLFGAGAVRSNKRITIVMNLELWEQGKQYDRLGLEEETMKIIDTEITKLTIPVRPGRNLAVIIEVAAMNFRLKRMGLNAAEQFTNKLADVIEDGEQEE,./data/raw/alphafold//AF-O34483-F1-model_v4.pdb,7,2475,2760,5605
+889,10934,11089,MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,uniprot_search,P24155,C[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](CC(=N)O)N=C(O)c1ccccc1N)C(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)[C@H](CCCCN)N=C(O)[C@H](CC(=N)O)N=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]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],8.0,3.74334960649502e-14,37.0,8.0,3.4.24.15,10116.0,0.9030899869919436,C[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](CC(=N)O)N=C(O)c1ccccc1N)C(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)[C@H](CCCCN)N=C(O)[C@H](CC(=N)O)N=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]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],0.9030899869919436,C[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](CC(=N)O)N=C(O)c1ccccc1N)C(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
+890,7121,7242,MTFRNRLRLFAVSGLALFTVSASLPPAAASGAPEARHPSGGGLSATVRYTEYGIPHIVAKDYANLGFGTGWAQAADQVCTLADGFVTVRGERSKFFGPDAAPDFSLSSAAKNLSSDLYFRGVRDSGTVEKLLKVPAPAGPSRDAKESMRGFAAGYNAWLRQNRDRITDPACRGASWVRPVTALDVAVRGFALAVLGGQGRGIDGITAAQPPTAAPPAAGVTPKEAAAAAQRLLSTQNADMGSNAVAFRGSTTANGRGLLLGNPHYPWDGGRRFWQSQQTIPGELNVAGGSLLGSTTVSIGHNADVAWSHTVATGVTLNLHQLTLDPADPTVYLVDGKPQRMTQRTVAVPVKGAAPVTRTQWWTRYGPVVTSLGAALPLPWTASTAYALNDPNAVNLRSADTSLGFSKARSTAGIERALHRSQGLPWVNTIAADRSGNSFFSQSQVLPRITDELAARCSTPLGQATYPSAGLAVLDGSTSACALGSDRDAVQPGIFGPGRMPTLKNAPYVENSNDSAWLTNADRPLTGYERVFGTTATQRSIRTRGAIEDVAAMAERGRLRVTDLERQQLANRAPTGDLVAADVAKWCAALPGGTAVGSSGTPVDVSAACPVLRRWDRSVDSDSRGALLFDRFWRKAAAVPAAELWKVPFDAADPVRTPRGLNTAAPGVGKALADTVTELKAAGIALNAPLGEHQFVVRNGKRIPVGGGTESLGIWNKIEPVWNPAAGGYTEVSAGSSYIQAVGWDNSRCPVARTLLTYSQSSNPNSPHYSDQTRLFSGERWVTSRFCEKDIARSPQLKVVRVHERR,brenda,Q539C0,CCCCCCCC(O)=N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O.O>>CC1(C)S[C@@H]2[C@H](N)C(=O)N2[C@H]1C(=O)O.CCCCCCCC(=O)O,35.58,1.5747146309119726e-14,40.0,8.0,3.5.1.11,58340.0,1.5512059437479062,CCCCCCCC(O)=N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O.O,CC1(C)S[C@@H]2[C@H](N)C(=O)N2[C@H]1C(=O)O.CCCCCCCC(=O)O,1.5512059437479062,CCCCCCCC(O)=N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O.O__MTFRNRLRLFAVSGLALFTVSASLPPAAASGAPEARHPSGGGLSATVRYTEYGIPHIVAKDYANLGFGTGWAQAADQVCTLADGFVTVRGERSKFFGPDAAPDFSLSSAAKNLSSDLYFRGVRDSGTVEKLLKVPAPAGPSRDAKESMRGFAAGYNAWLRQNRDRITDPACRGASWVRPVTALDVAVRGFALAVLGGQGRGIDGITAAQPPTAAPPAAGVTPKEAAAAAQRLLSTQNADMGSNAVAFRGSTTANGRGLLLGNPHYPWDGGRRFWQSQQTIPGELNVAGGSLLGSTTVSIGHNADVAWSHTVATGVTLNLHQLTLDPADPTVYLVDGKPQRMTQRTVAVPVKGAAPVTRTQWWTRYGPVVTSLGAALPLPWTASTAYALNDPNAVNLRSADTSLGFSKARSTAGIERALHRSQGLPWVNTIAADRSGNSFFSQSQVLPRITDELAARCSTPLGQATYPSAGLAVLDGSTSACALGSDRDAVQPGIFGPGRMPTLKNAPYVENSNDSAWLTNADRPLTGYERVFGTTATQRSIRTRGAIEDVAAMAERGRLRVTDLERQQLANRAPTGDLVAADVAKWCAALPGGTAVGSSGTPVDVSAACPVLRRWDRSVDSDSRGALLFDRFWRKAAAVPAAELWKVPFDAADPVRTPRGLNTAAPGVGKALADTVTELKAAGIALNAPLGEHQFVVRNGKRIPVGGGTESLGIWNKIEPVWNPAAGGYTEVSAGSSYIQAVGWDNSRCPVARTLLTYSQSSNPNSPHYSDQTRLFSGERWVTSRFCEKDIARSPQLKVVRVHERR,./data/raw/alphafold//AF-Q539C0-F1-model_v4.pdb,3109,1876,3508,2327
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+906,21576,21901,MGSESLVHVFLVSFIGQGHVNPLLRLGKRLAAKGLLVTFCTAECVGKEMRKSNGITDEPKPVGDGFIRFEFFEDRWAEDEPMRQDLDLYLPQLELVGKEVIPEMIKKNSEQGRPVSCLINNPFIPWVCDVAESLGLPSAMLWVQSAACLAAYYHYYHGLVPFPSESDMFCDVQIPSMPLLKYDEVPSFLYPTSPYPFLRRAILGQYGNLEKPFCILMDTFQELESEIIEYMACLCPIKAVGPLFKNPKAQNAVRGDFMKADDSIIGWLDTKPKSSVVYISFGSVVYLKQEQVDEIAHGLLSSGVSFIWVMKPPHPDSGFELLVLPEGFLEKAGDRGKVVQWSPQEKILEHPSTACFVTHCGWNSTMESLTSGMPVVAFPQWGDQVTDAKYLVDEFKVGVRMCRGEAEDRVIPREEVEKCLLEATSGPKAAEMKQNALKWKAAAEAAFSEGGSSDRNLQAFVDEVRRISASLNSKSSAVGYVKSKINGVVEYVDSKLNGKAAPVEGAKTRTNGIAKVEEPKAANGKVEIAELTPINGKVEIAGLKPINGKVELVES,brenda,A0A2U9N624,O=C(O)c1cc(O)c(O)c(O)c1.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=C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1cc(O)c(O)c(O)c1.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,1.1,1.5427255221260327e-14,30.0,7.0,2.4.1.177,57918.0,0.041392685158225,O=C(O)c1cc(O)c(O)c(O)c1.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=C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1cc(O)c(O)c(O)c1.O=c1nc(O)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.041392685158225,O=C(O)c1cc(O)c(O)c(O)c1.O=c1nc(O)ccn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data/raw/alphafold//AF-A0A2U9N624-F1-model_v4.pdb,3539,3480,1232,3163
+907,5818,5907,MKIYTKNGDKGQTRIIGKQILYKNDPRVAAYGEVDELNSWVGYTKSLINSHTQVLSNELEEIQQLLFDCGHDLATPADDERHSFKFKQEQPTVWLEEKIDNYTQVVPAVKKFILPGGTQLASALHVARTITRRAERQIVQLMREEQINQDVLIFINRLSDYFFAAARYANYLEQQPDMLYRNSKDVFR,sabio,Q50EJ2,CC1=C2N=C(C=C3N=C(C(C)=C4N[C@@](C)([C@@H]5N=C1[C@](C)(CCC(O)=NC[C@@H](C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H]([n+]6c[nH]c7cc(C)c(C)cc76)O[C@@H]1CO)[C@H]5CC(=N)O)[C@@](C)(CC(=N)O)[C@@H]4CCC(=N)O)[C@@](C)(CC(=N)O)[C@@H]3CCC(=N)[O-])C(C)(C)[C@@H]2CCC(=N)[O-].Nc1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)n1.[Co+]>>O=P(O)(O)OP(=O)(O)OP(=O)(O)O,0.0086,75.05874587331351,37.0,8.0,2.5.1.17,1598.0,-2.065501548756432,CC1=C2N=C(C=C3N=C(C(C)=C4N[C@@](C)([C@@H]5N=C1[C@](C)(CCC(O)=NC[C@@H](C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H]([n+]6c[nH]c7cc(C)c(C)cc76)O[C@@H]1CO)[C@H]5CC(=N)O)[C@@](C)(CC(=N)O)[C@@H]4CCC(=N)O)[C@@](C)(CC(=N)O)[C@@H]3CCC(=N)[O-])C(C)(C)[C@@H]2CCC(=N)[O-].Nc1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)n1.[Co+],O=P(O)(O)OP(=O)(O)OP(=O)(O)O,-2.065501548756432,CC1=C2N=C(C=C3N=C(C(C)=C4N[C@@](C)([C@@H]5N=C1[C@](C)(CCC(O)=NC[C@@H](C)OP(=O)(O)O[C@H]1[C@@H](O)[C@@H]([n+]6c[nH]c7cc(C)c(C)cc76)O[C@@H]1CO)[C@H]5CC(=N)O)[C@@](C)(CC(=N)O)[C@@H]4CCC(=N)O)[C@@](C)(CC(=N)O)[C@@H]3CCC(=N)[O-])C(C)(C)[C@@H]2CCC(=N)[O-].Nc1ccn(C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)n1.[Co+]__MKIYTKNGDKGQTRIIGKQILYKNDPRVAAYGEVDELNSWVGYTKSLINSHTQVLSNELEEIQQLLFDCGHDLATPADDERHSFKFKQEQPTVWLEEKIDNYTQVVPAVKKFILPGGTQLASALHVARTITRRAERQIVQLMREEQINQDVLIFINRLSDYFFAAARYANYLEQQPDMLYRNSKDVFR,./data/raw/alphafold//AF-Q50EJ2-F1-model_v4.pdb,3151,1943,3587,2420
+908,3093,3135,MKKSLSATLISALLAFSAPGFSAADNVAAVVDSTIKPLMAQQDIPGMAVAVSVKGKPYYFNYGFADVQAKQPVTENTLFELGSVSKTFTGVLGAVSVAKKEMTLNDPAEKYQPELALPQWKGITLLDLATYTAGGLPLQVPDAVKSRADLLHFYQQWQPSRKPGDMRLYANSSIGLFGALTANAAGMPYDQLLTARILAPLGLSHTFITVPESAQSQYAYGYKNKKPVRVSPGQLDAESYGVKSASKDMLRWAEMNMEPSRAGNADLEMAMYLAQTRYYKTAAINQGLGWEMYDWPQQKDMIINGVTNEVALQPHPVTDNQVQPYNRASWVHKTGATTGFGAYVAFIPEKQVAIVILANKNYPNTERVKAAQAILSALE,brenda,Q704Z0,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>>,0.04,99.82319723056142,30.0,7.0,3.5.2.6,180434.0,-1.3979400086720375,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,,-1.3979400086720375,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__MKKSLSATLISALLAFSAPGFSAADNVAAVVDSTIKPLMAQQDIPGMAVAVSVKGKPYYFNYGFADVQAKQPVTENTLFELGSVSKTFTGVLGAVSVAKKEMTLNDPAEKYQPELALPQWKGITLLDLATYTAGGLPLQVPDAVKSRADLLHFYQQWQPSRKPGDMRLYANSSIGLFGALTANAAGMPYDQLLTARILAPLGLSHTFITVPESAQSQYAYGYKNKKPVRVSPGQLDAESYGVKSASKDMLRWAEMNMEPSRAGNADLEMAMYLAQTRYYKTAAINQGLGWEMYDWPQQKDMIINGVTNEVALQPHPVTDNQVQPYNRASWVHKTGATTGFGAYVAFIPEKQVAIVILANKNYPNTERVKAAQAILSALE,./data/raw/alphafold//AF-Q704Z0-F1-model_v4.pdb,1456,986,797,1111
+909,1187,1214,MGINRFFRSNLRTQLVSCTKYAAASRSPLDHVLLVPFLARSYSTGSPLRREESTAEEKGLGFKGHDMLAPFTAGWQSTDLHPLIIEKSEGCYVYDSNGKKYLDALAGLWCTALGGNEPRLVAAATKQLNTLPFYHSFWNRTTKPSLDLAKELLETFTASKMAKAFFTNSGSEANDTQVKLVWYYNNALGRPDKKKFIARHKSYHGSTLIAASLSGLPALHQKFDLPAPFVLHTDCPHYWRHHLPGETEEEYSTRLANNLENLILKEGPETIAAFIAEPVMGAGGVIPPPATYFEKVQAVVKKYDILFIADEVICAFGRLGYMYGCDKYNIKPDLVSVAKALSSAYMPIGAVLVSPEVSDVIHSQSSELGSFSHGFTYSGHPVACAVAIEALKIYKERNIVEQVRSIAPRFQEGVKAFSDSPIIGEIRGTGLIIGTEFADNKSPNDPFPAEWGVCAYFGAQCEKHGMLVRVAGDNTMMSPPFIMTPSEVEELISIYGKALKATEEYVKELKSKQT,brenda,J9XGP8,CC(=O)C(=O)O.NCCCC(=O)O>>C[C@H](N)C(=O)O.O=CCCC(=O)O,2.7,0.0,30.0,7.5,2.6.1.19,3750.0,0.4313637641589873,CC(=O)C(=O)O.NCCCC(=O)O,C[C@H](N)C(=O)O.O=CCCC(=O)O,0.4313637641589873,CC(=O)C(=O)O.NCCCC(=O)O__MGINRFFRSNLRTQLVSCTKYAAASRSPLDHVLLVPFLARSYSTGSPLRREESTAEEKGLGFKGHDMLAPFTAGWQSTDLHPLIIEKSEGCYVYDSNGKKYLDALAGLWCTALGGNEPRLVAAATKQLNTLPFYHSFWNRTTKPSLDLAKELLETFTASKMAKAFFTNSGSEANDTQVKLVWYYNNALGRPDKKKFIARHKSYHGSTLIAASLSGLPALHQKFDLPAPFVLHTDCPHYWRHHLPGETEEEYSTRLANNLENLILKEGPETIAAFIAEPVMGAGGVIPPPATYFEKVQAVVKKYDILFIADEVICAFGRLGYMYGCDKYNIKPDLVSVAKALSSAYMPIGAVLVSPEVSDVIHSQSSELGSFSHGFTYSGHPVACAVAIEALKIYKERNIVEQVRSIAPRFQEGVKAFSDSPIIGEIRGTGLIIGTEFADNKSPNDPFPAEWGVCAYFGAQCEKHGMLVRVAGDNTMMSPPFIMTPSEVEELISIYGKALKATEEYVKELKSKQT,./data/raw/alphafold//AF-J9XGP8-F1-model_v4.pdb,1266,3835,6150,800
+910,10783,10938,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](Cc1cnc[nH]1)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](Cc1cnc[nH]1)C(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(=O)O,26700.0,3.104484348026936e-14,30.0,8.5,3.4.21.4,6978.0,4.426511261364575,C[C@H](N=C(O)CN=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)[C@H](Cc1cnc[nH]1)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](Cc1cnc[nH]1)C(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(=O)O,4.426511261364575,C[C@H](N=C(O)CN=C(O)[C@H](CCCNC(=N)N)N=C(O)CN=C(O)[C@H](Cc1cnc[nH]1)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
+911,2226,2259,MTERIRNVALRSKVCPAETASELIKHGDVVGTSGFTGAGYPKEVPKALAQRMEAAHDRGEKYQISLITGASTGPQLDGELAKANGVYFRSPFNTDATMRNRINAGETEYFDNHLGQVAGRAVQGNYGKFNIALVEATAITEDGGIVPTSSVGNSQTFLNLAEKVIIEVNEWQNPMLEGIHDIWDGNVSGVPTRDIVPIVRADQRVGGPVLRVNPDKIAAIVRTNDRDRNAPFAAPDETAKAIAGYLLDFFGHEVKQNRLPPSLLPLQSGVGNVANAVLEGLKEGPFENLVGYSEVIQDGMLAMLDSGRMRIASASSFSLSPEAAEEINNRMDFFRSKIILRQQDVSNSPGIIRRLGCIAMNGMIEADIYGNVNSTRVMGSKMMNGIGGSGDFARSSYLSIFLSPSTAKGGKISAIVPMAAHVDHIMQDAQIFVTEQGLADLRGLSPVQRAREIISKCAHPDYRPMLQDYFDRALKNSFGKHTPHLLTEALSWHQRFIDTGTMLPS,sabio,B3EY95,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=CO>>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)NCCSC=O,1.9,0.0,25.0,8.0,2.8.3.18,435.0,0.2787536009528289,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=CO,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)NCCSC=O,0.2787536009528289,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=CO__MTERIRNVALRSKVCPAETASELIKHGDVVGTSGFTGAGYPKEVPKALAQRMEAAHDRGEKYQISLITGASTGPQLDGELAKANGVYFRSPFNTDATMRNRINAGETEYFDNHLGQVAGRAVQGNYGKFNIALVEATAITEDGGIVPTSSVGNSQTFLNLAEKVIIEVNEWQNPMLEGIHDIWDGNVSGVPTRDIVPIVRADQRVGGPVLRVNPDKIAAIVRTNDRDRNAPFAAPDETAKAIAGYLLDFFGHEVKQNRLPPSLLPLQSGVGNVANAVLEGLKEGPFENLVGYSEVIQDGMLAMLDSGRMRIASASSFSLSPEAAEEINNRMDFFRSKIILRQQDVSNSPGIIRRLGCIAMNGMIEADIYGNVNSTRVMGSKMMNGIGGSGDFARSSYLSIFLSPSTAKGGKISAIVPMAAHVDHIMQDAQIFVTEQGLADLRGLSPVQRAREIISKCAHPDYRPMLQDYFDRALKNSFGKHTPHLLTEALSWHQRFIDTGTMLPS,./data/raw/alphafold//AF-B3EY95-F1-model_v4.pdb,1346,836,628,916
+912,8782,8919,MASEKNLTLTHFKGPLYIVEDKEYVQENSMVYIGTDGITIIGATWTPETAETLYKEIRKVSPLPINEVINTNYHTDRAGGNAYWKTLGAKIVATQMTYDLQKSQWGSIVNFTRQGNNKYPNLEKSLPDTVFPGDFNLQNGSIRAMYLGEAHTKDGIFVYFPAERVLYGNCILKENLGNMSFANRTEYPKTLEKLKGLIEQGELKVDSIIAGHDTPIHDVGLIDHYLTLLEKAPK,brenda,Q9RMI1,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>>,0.64,99.799834663432,25.0,7.0,3.5.2.6,47917.0,-0.1938200260161128,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,,-0.1938200260161128,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__MASEKNLTLTHFKGPLYIVEDKEYVQENSMVYIGTDGITIIGATWTPETAETLYKEIRKVSPLPINEVINTNYHTDRAGGNAYWKTLGAKIVATQMTYDLQKSQWGSIVNFTRQGNNKYPNLEKSLPDTVFPGDFNLQNGSIRAMYLGEAHTKDGIFVYFPAERVLYGNCILKENLGNMSFANRTEYPKTLEKLKGLIEQGELKVDSIIAGHDTPIHDVGLIDHYLTLLEKAPK,./data/raw/alphafold//AF-Q9RMI1-F1-model_v4.pdb,1463,1902,3539,2362
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+914,15192,15404,MTQHFDLIAIGGGSGGLAVAEKAAAFGKRVALIESKALGGTCVNVGCVPKKVMWYASHLAEAVRDAPGFGVQASGGTLDWPRLVAGRDRYIGAINSFWDGYVERLGITRVDGHARFVDAHTIEVEGQRLSADHIVIATGGRPIVPRLPGAELGITSDGFFALQQQPKRVAIIGAGYIGIELAGLLRSFGSEVTVVALEDRLLFQFDPLLSATLAENMHAQGIETHLEFAVAALERDAQGTTLVAQDGTRLEGFDSVIWAVGRAPNTRDLGLEAAGIEVQSNGMVPTDAYQNTNVPGVYALGDITGRDQLTPVAIAAGRRLAERLFDGQSERKLDYDNIPTVVFAHPPLSKVGLSEPEARERLGDVLTVYETSFTPMRYALNEHGPKTAMKLVCAGPEQRVVGVHVIGDGADEMLQGFAVAVKMGATKADFDNTVAIHPGSAEELVTLKEPVRRPGDPLPEGAA,sabio,D0VWY5,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(=O)CNC(=O)[C@H](CSSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(N)=O)NC(=O)CC[C@H](N)C(=O)O.[H]>>NC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H](N)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)c1,48300.0,12.717353310644928,25.0,7.1,1.8.1.16,1048.0,4.683947130751513,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(=O)CNC(=O)[C@H](CSSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(N)=O)NC(=O)CC[C@H](N)C(=O)O.[H],NC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H](N)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)c1,4.683947130751513,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(=O)CNC(=O)[C@H](CSSC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(N)=O)NC(=O)CC[C@H](N)C(=O)O.[H]__MTQHFDLIAIGGGSGGLAVAEKAAAFGKRVALIESKALGGTCVNVGCVPKKVMWYASHLAEAVRDAPGFGVQASGGTLDWPRLVAGRDRYIGAINSFWDGYVERLGITRVDGHARFVDAHTIEVEGQRLSADHIVIATGGRPIVPRLPGAELGITSDGFFALQQQPKRVAIIGAGYIGIELAGLLRSFGSEVTVVALEDRLLFQFDPLLSATLAENMHAQGIETHLEFAVAALERDAQGTTLVAQDGTRLEGFDSVIWAVGRAPNTRDLGLEAAGIEVQSNGMVPTDAYQNTNVPGVYALGDITGRDQLTPVAIAAGRRLAERLFDGQSERKLDYDNIPTVVFAHPPLSKVGLSEPEARERLGDVLTVYETSFTPMRYALNEHGPKTAMKLVCAGPEQRVVGVHVIGDGADEMLQGFAVAVKMGATKADFDNTVAIHPGSAEELVTLKEPVRRPGDPLPEGAA,./data/raw/alphafold//AF-D0VWY5-F1-model_v4.pdb,2554,4453,4358,4244
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+947,1700,1731,MMKKSICCALLLTASFSTFAAAKTEQQIADIVNRTITPLMQEQAIPGMAVAIIYEGKPYYFTWGKADIANNHPVTQQTLFELGSVSKTFNGVLGGDRIARGEIKLSDPVTKYWPELTGKQWRGISLLHLATYTAGGLPLQIPGDVTDKAELLRFYQNWQPQWTPGAKRLYANSSIGLFGALAVKSSGMSYEEAMTRRVLQPLKLAHTWITVPQSEQKNYAWGYLEGKPVHVSPGQLDAEAYGVKSSVIDMARWVQANMDASHVQEKTLQQGIELAQSRYWRIGDMYQGLGWEMLNWPLKADSIINGSDSKVALAALPAVEVNPPAPAVKASWVHKTGSTGGFGSYVAFVPEKNLGIVMLANKSYPNPARVEAAWRILEKLQ,sabio,P05193,CC(=O)OCC1=C(C(=O)O)N2C(=O)C(NC(=O)Cc3cccs3)C2SC1.O>>,210.0,99.7593035206674,,8.2,3.5.2.6,546.0,2.322219294733919,CC(=O)OCC1=C(C(=O)O)N2C(=O)C(NC(=O)Cc3cccs3)C2SC1.O,,2.322219294733919,CC(=O)OCC1=C(C(=O)O)N2C(=O)C(NC(=O)Cc3cccs3)C2SC1.O__MMKKSICCALLLTASFSTFAAAKTEQQIADIVNRTITPLMQEQAIPGMAVAIIYEGKPYYFTWGKADIANNHPVTQQTLFELGSVSKTFNGVLGGDRIARGEIKLSDPVTKYWPELTGKQWRGISLLHLATYTAGGLPLQIPGDVTDKAELLRFYQNWQPQWTPGAKRLYANSSIGLFGALAVKSSGMSYEEAMTRRVLQPLKLAHTWITVPQSEQKNYAWGYLEGKPVHVSPGQLDAEAYGVKSSVIDMARWVQANMDASHVQEKTLQQGIELAQSRYWRIGDMYQGLGWEMLNWPLKADSIINGSDSKVALAALPAVEVNPPAPAVKASWVHKTGSTGGFGSYVAFVPEKNLGIVMLANKSYPNPARVEAAWRILEKLQ,./data/raw/alphafold//AF-P05193-F1-model_v4.pdb,1456,965,779,1082
+948,9093,9235,MLKVISSLLFYMTASLMAVASPLAHSGESRGEYPTVSEIPVGEVRLYQIDDGVWSHIATHTFDGVVYPSNGLIVRDGDELLLIDTAWGTKNTVALLAEIEKQIGLPVTRSVSTHFHDDRVGGVDALRAAGVATYASPSTRRLAEAEGNEVPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVLELSRTSAGNVADADLAEWPGSVERIQQHYPEAEVVIPGHGLPGGLDLLQHTANVVKAHTNRSVAE,sabio,Q2HY42,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1.O>>,612.0,99.78924695830672,25.0,7.5,3.5.2.6,287.0,2.7867514221455614,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1.O,,2.7867514221455614,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1.O__MLKVISSLLFYMTASLMAVASPLAHSGESRGEYPTVSEIPVGEVRLYQIDDGVWSHIATHTFDGVVYPSNGLIVRDGDELLLIDTAWGTKNTVALLAEIEKQIGLPVTRSVSTHFHDDRVGGVDALRAAGVATYASPSTRRLAEAEGNEVPTHSLEGLSSSGDAVRFGPVELFYPGAAHSTDNLVVYVPSANVLYGGCAVLELSRTSAGNVADADLAEWPGSVERIQQHYPEAEVVIPGHGLPGGLDLLQHTANVVKAHTNRSVAE,./data/raw/alphafold//AF-Q2HY42-F1-model_v4.pdb,1446,972,778,1081
+949,12514,12684,MKKSLSATLISALLAFSAPGFSAADNVAAVVDSTIKPLMAQQDIPGMAVAVSVKGKPYYFNYGFADVQAKQPVTENTLFELGSVSKTFTGVLGAVSVAKKEMTLNDPAEKYQPELALPQWKGITLLDLATYTAGGLPLQVPDAVKSRADLLHFYQQWQPSRKPGDMRLYANSSIGLFGALTANAAGMPYDQLLTARILAPLGLSHTFITVPESAQSQYAYGYKNKKPVRVSPGQLDAESYGVKSASKDMLRWAEMNMEPSRAGNADLEMAMYLAQTRYYKTAAINQGLGWEMYDWPQQKDMIINGVTNEVALQPHPVTDNQVQPYNRASWVHKTGATTGFGAYVAFIPEKQVAIVILANKNYPNTERVKAAQAILSALE,brenda,Q704Z0,Cc1onc(-c2ccccc2)c1C(O)=N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O.O>>,0.022,99.76216468193093,30.0,7.0,3.5.2.6,180434.0,-1.6575773191777938,Cc1onc(-c2ccccc2)c1C(O)=N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O.O,,-1.6575773191777938,Cc1onc(-c2ccccc2)c1C(O)=N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O.O__MKKSLSATLISALLAFSAPGFSAADNVAAVVDSTIKPLMAQQDIPGMAVAVSVKGKPYYFNYGFADVQAKQPVTENTLFELGSVSKTFTGVLGAVSVAKKEMTLNDPAEKYQPELALPQWKGITLLDLATYTAGGLPLQVPDAVKSRADLLHFYQQWQPSRKPGDMRLYANSSIGLFGALTANAAGMPYDQLLTARILAPLGLSHTFITVPESAQSQYAYGYKNKKPVRVSPGQLDAESYGVKSASKDMLRWAEMNMEPSRAGNADLEMAMYLAQTRYYKTAAINQGLGWEMYDWPQQKDMIINGVTNEVALQPHPVTDNQVQPYNRASWVHKTGATTGFGAYVAFIPEKQVAIVILANKNYPNTERVKAAQAILSALE,./data/raw/alphafold//AF-Q704Z0-F1-model_v4.pdb,1456,986,797,1111
+950,10046,10197,MTHSQRRDKLKAQIAASGLDAMLISDLINVRYLSGFSGSNGALLVFADERDAVLATDGRYRTQAASQAPDLEVAIERAVGRYLAGRAGEAGVGKLGFESHVVTVDGLDALAGALEGKNTELVRASGTVESLREVKDAGELALLRLACEAADAALTDLVARGGLRPGRTERQVSRELEALMLDHGADAVSFETIVAAGANSAIPHHRPTDAVLQVGDFVKIDFGALVAGYHSDMTRTFVLGKAADWQLEIYQLVAEAQQAGRQALLPGAELRGVDAAARQLIADAGYGEHFGHGLGHGVGLQIHEAPGIGVTSAGTLLAGSVVTVEPGVYLPGRGGVRIEDTLVVAGGTPKMPETAGQTPELLTRFPKELAIL,brenda,I6YDN6,CSCC[C@H](N)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)O.O>>CSCC[C@H](N)C(=O)O.C[C@H](N)C(O)=N[C@@H](C)C(=O)O,5.0,9.171606977489936e-15,55.0,8.0,3.4.11.9,1773.0,0.6989700043360189,CSCC[C@H](N)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)O.O,CSCC[C@H](N)C(=O)O.C[C@H](N)C(O)=N[C@@H](C)C(=O)O,0.6989700043360189,CSCC[C@H](N)C(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)O.O__MTHSQRRDKLKAQIAASGLDAMLISDLINVRYLSGFSGSNGALLVFADERDAVLATDGRYRTQAASQAPDLEVAIERAVGRYLAGRAGEAGVGKLGFESHVVTVDGLDALAGALEGKNTELVRASGTVESLREVKDAGELALLRLACEAADAALTDLVARGGLRPGRTERQVSRELEALMLDHGADAVSFETIVAAGANSAIPHHRPTDAVLQVGDFVKIDFGALVAGYHSDMTRTFVLGKAADWQLEIYQLVAEAQQAGRQALLPGAELRGVDAAARQLIADAGYGEHFGHGLGHGVGLQIHEAPGIGVTSAGTLLAGSVVTVEPGVYLPGRGGVRIEDTLVVAGGTPKMPETAGQTPELLTRFPKELAIL,./data/raw/alphafold//AF-I6YDN6-F1-model_v4.pdb,3600,3570,1353,3311
+951,17245,17476,MKLYYKVGACSLAPHIILSEAGLPYELEAVDLKAKKTADGGDYFAVNPRGAVPALEVKPGTVITQNAAILQYIGDHSDVAAFKPAYGSIERARLQEALGFCSDLHAAFSGLFAPNLSEEARAGVIANINRRLGQLEAMLSDKNAYWLGDDFTQPDAYASVIIGWGVGQKLDLSAYPKALKLRERVLARPNVQKAFKEEGLN,brenda,P81065,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1>>Cl.N[C@@H](CCC(O)=N[C@@H](CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=NCC(=O)O)C(=O)O,2.35,2.7843620188059523e-14,30.0,8.0,2.5.1.18,529.0,0.3710678622717362,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1,Cl.N[C@@H](CCC(O)=N[C@@H](CSc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(O)=NCC(=O)O)C(=O)O,0.3710678622717362,N[C@@H](CCC(O)=N[C@@H](CS)C(O)=NCC(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1__MKLYYKVGACSLAPHIILSEAGLPYELEAVDLKAKKTADGGDYFAVNPRGAVPALEVKPGTVITQNAAILQYIGDHSDVAAFKPAYGSIERARLQEALGFCSDLHAAFSGLFAPNLSEEARAGVIANINRRLGQLEAMLSDKNAYWLGDDFTQPDAYASVIIGWGVGQKLDLSAYPKALKLRERVLARPNVQKAFKEEGLN,./data/raw/alphafold//AF-P81065-F1-model_v4.pdb,3472,3386,1120,3036
+952,20283,20578,MAASLVGKKIVFVTGNAKKLEEVVQILGDKFPCTLVAQKIDLPEYQGEPDEISIQKCQEAVRQVQGPVLVEDTCLCFNALGGLPGPYIKWFLEKLKPEGLHQLLAGFEDKSAYALCTFALSTGDPSQPVRLFRGRTSGRIVAPRGCQDFGWDPCFQPDGYEQTYAEMPKAEKNAVSHRFRALLELQEYFGSLAA,sabio,Q9BY32,O.O=c1[nH]c(=O)c2ncn(C3OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C3O)c2[nH]1>>O=P(O)(O)OP(=O)(O)O.O=c1[nH]c(=O)c2ncn(C3OC(COP(=O)(O)O)C(O)C3O)c2[nH]1,640.0,0.0,37.0,8.5,3.6.1.9,9606.0,2.806179973983887,O.O=c1[nH]c(=O)c2ncn(C3OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C3O)c2[nH]1,O=P(O)(O)OP(=O)(O)O.O=c1[nH]c(=O)c2ncn(C3OC(COP(=O)(O)O)C(O)C3O)c2[nH]1,2.806179973983887,O.O=c1[nH]c(=O)c2ncn(C3OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C3O)c2[nH]1__MAASLVGKKIVFVTGNAKKLEEVVQILGDKFPCTLVAQKIDLPEYQGEPDEISIQKCQEAVRQVQGPVLVEDTCLCFNALGGLPGPYIKWFLEKLKPEGLHQLLAGFEDKSAYALCTFALSTGDPSQPVRLFRGRTSGRIVAPRGCQDFGWDPCFQPDGYEQTYAEMPKAEKNAVSHRFRALLELQEYFGSLAA,./data/raw/alphafold//AF-Q9BY32-F1-model_v4.pdb,365,2930,5265,6132
+953,21269,21593,MRWKRTLQLLDVHCEGEIGRVVTGGAPKIPGNTVAEQLHWMNTDPQGEALRRFLTLEPRGTPMGSVDLLLPPKHPDAHAAFVILQPDQAHASSGSNSICATTALLESGMVEMQEPETVIILETAAGLVKATATCRDGRCEKVKLTMVPSFVHELDVSIDTPEWGRVTMDISYGGIFYALVDVRQIGLTIEKANAAKLVAAGMTLKDLVNREMTVVHPEIPAISGVAYVMFRDVDADGSIRTCTTMWPGRADRSPCGTGNSANLATLYARGKVKVGDEYKSRSIIGSEFDVGLSAVTEVAGRPAVIPTIAGRGFTFGLHQVGLDPFDPLGDGFAMTDVWGPEAGNI,sabio,A9CKB4,O=C(O)C1CC(O)CN1>>O=C(O)C1CC(O)CN1,0.86,0.0,25.0,8.0,5.1.1.8,358.0,-0.0655015487564322,O=C(O)C1CC(O)CN1,O=C(O)C1CC(O)CN1,-0.0655015487564322,O=C(O)C1CC(O)CN1__MRWKRTLQLLDVHCEGEIGRVVTGGAPKIPGNTVAEQLHWMNTDPQGEALRRFLTLEPRGTPMGSVDLLLPPKHPDAHAAFVILQPDQAHASSGSNSICATTALLESGMVEMQEPETVIILETAAGLVKATATCRDGRCEKVKLTMVPSFVHELDVSIDTPEWGRVTMDISYGGIFYALVDVRQIGLTIEKANAAKLVAAGMTLKDLVNREMTVVHPEIPAISGVAYVMFRDVDADGSIRTCTTMWPGRADRSPCGTGNSANLATLYARGKVKVGDEYKSRSIIGSEFDVGLSAVTEVAGRPAVIPTIAGRGFTFGLHQVGLDPFDPLGDGFAMTDVWGPEAGNI,./data/raw/alphafold//AF-A9CKB4-F1-model_v4.pdb,617,3353,5681,6580
+954,6133,6239,MLLAQRRLISLGCRSKPIKTIYSSSKVLGLCTSAKMALKFKNAKRIEGLDSNVWVEFTKLAADPSVVNLGQGFPDISPPSYVKEELSKAAFIDNMNQYTRGFGHPALVKALSCLYGKIYQRQIDPNEEILVAVGAYGSLFNSIQGLVDPGDEVIIMVPFYDCYEPMVRMAGAVPVFIPLRSKPTDGMKWTSSDWTFDPRELESKFSSKTKAIILNTPHNPLGKVYTRQELQVIADLCVKHDTLCISDEVYEWLVYTGHTHVKIATLPGMWERTITIGSAGKTFSVTGWKLGWSIGPAHLIKHLQTVQQNSFYTCATPLQAALAEAFWIDIKRMDDPECYFNSLPKELEVKRDRMVRLLNSVGLKPIVPDGGYFIIADVSSLGADLSDMNSDEPYDYKFVKWMTKHKKLTAIPVSAFCDSKSKPHFEKLVRFCFIKKDSTLDAAEEIFRAWNSQKS,brenda,Q71RI9,CCC(=O)C(=O)[O-].N[C@@H](CO)C(=O)O>>CCC(N)C(=O)O.O=C(O)C(=O)CO,2.17,0.2432690729710638,45.0,9.0,2.6.1.7,10090.0,0.3364597338485295,CCC(=O)C(=O)[O-].N[C@@H](CO)C(=O)O,CCC(N)C(=O)O.O=C(O)C(=O)CO,0.3364597338485295,CCC(=O)C(=O)[O-].N[C@@H](CO)C(=O)O__MLLAQRRLISLGCRSKPIKTIYSSSKVLGLCTSAKMALKFKNAKRIEGLDSNVWVEFTKLAADPSVVNLGQGFPDISPPSYVKEELSKAAFIDNMNQYTRGFGHPALVKALSCLYGKIYQRQIDPNEEILVAVGAYGSLFNSIQGLVDPGDEVIIMVPFYDCYEPMVRMAGAVPVFIPLRSKPTDGMKWTSSDWTFDPRELESKFSSKTKAIILNTPHNPLGKVYTRQELQVIADLCVKHDTLCISDEVYEWLVYTGHTHVKIATLPGMWERTITIGSAGKTFSVTGWKLGWSIGPAHLIKHLQTVQQNSFYTCATPLQAALAEAFWIDIKRMDDPECYFNSLPKELEVKRDRMVRLLNSVGLKPIVPDGGYFIIADVSSLGADLSDMNSDEPYDYKFVKWMTKHKKLTAIPVSAFCDSKSKPHFEKLVRFCFIKKDSTLDAAEEIFRAWNSQKS,./data/raw/alphafold//AF-Q71RI9-F1-model_v4.pdb,1303,3859,6175,827
+955,6496,6609,MDGVLWRVRTAALMAALLALAAWALVWASPSVEAQSNPYQRGPNPTRSALTADGPFSVATYTVSRLSVSGFGGGVIYYPTGTSLTFGGIAMSPGYTADASSLAWLGRRLASHGFVVLVINTNSRFDYPDSRASQLSAALNYLRTSSPSAVRARLDANRLAVAGHSMGGGGTLRIAEQNPSLKAAVPLTPWHTDKTFNTSVPVLIVGAEADTVAPVSQHAIPFYQNLPSTTPKVYVELDNASHFAPNSNNAAISVYTISWMKLWVDNDTRYRQFLCNVNDPALSDFRTNNRHCQ,sabio,G9BY57,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,318.0,0.0,70.0,8.0,3.1.1.-,2725.0,2.502427119984433,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,2.55509444857832,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MDGVLWRVRTAALMAALLALAAWALVWASPSVEAQSNPYQRGPNPTRSALTADGPFSVATYTVSRLSVSGFGGGVIYYPTGTSLTFGGIAMSPGYTADASSLAWLGRRLASHGFVVLVINTNSRFDYPDSRASQLSAALNYLRTSSPSAVRARLDANRLAVAGHSMGGGGTLRIAEQNPSLKAAVPLTPWHTDKTFNTSVPVLIVGAEADTVAPVSQHAIPFYQNLPSTTPKVYVELDNASHFAPNSNNAAISVYTISWMKLWVDNDTRYRQFLCNVNDPALSDFRTNNRHCQ,./data/raw/alphafold//AF-G9BY57-F1-model_v4.pdb,3246,2062,3713,2567
+956,19087,19373,METSMACCSRSIVLPRVSPQHSSALVPSSINLKSLKSSSLFGESLRMTTKSSVRVNKAKNSSLVTKCELGDSLEEFLAKATTDKGLIRLMMCMGEALRTIGFKVRTASCGGTQCVNTFGDEQLAIDVLADKLLFEALNYSHFCKYACSEELPELQDMGGPVDGGFSVAFDPLDGSSIVDTNFSVGTIFGVWPGDKLTGVTGRDQVAAAMGIYGPRTTYVLALKDYPGTHEFLLLDEGKWQHVKETTEINEGKLFCPGNLRATSDNADYAKLIQYYIKEKYTLRYTGGMVPDVNQIIVKEKGIFTNVISPTAKAKLRLLFEVAPLGFLIEKAGGHSSEGTKSVLDIEVKNLDDRTQVAYGSLNEIIRFEKTLYGSSRLEEPVPVGAAA,sabio,O20252,O.O=C(COP(=O)(O)O)C(O)C(O)C(O)C(O)COP(=O)(O)O>>O=C(CO)C(O)C(O)C(O)C(O)COP(=O)(O)O.O=P(O)(O)O,81.0,1.4625675434719232e-14,30.0,8.2,3.1.3.37,3562.0,1.9084850188786493,O.O=C(COP(=O)(O)O)C(O)C(O)C(O)C(O)COP(=O)(O)O,O=C(CO)C(O)C(O)C(O)C(O)COP(=O)(O)O.O=P(O)(O)O,1.9084850188786493,O.O=C(COP(=O)(O)O)C(O)C(O)C(O)C(O)COP(=O)(O)O__METSMACCSRSIVLPRVSPQHSSALVPSSINLKSLKSSSLFGESLRMTTKSSVRVNKAKNSSLVTKCELGDSLEEFLAKATTDKGLIRLMMCMGEALRTIGFKVRTASCGGTQCVNTFGDEQLAIDVLADKLLFEALNYSHFCKYACSEELPELQDMGGPVDGGFSVAFDPLDGSSIVDTNFSVGTIFGVWPGDKLTGVTGRDQVAAAMGIYGPRTTYVLALKDYPGTHEFLLLDEGKWQHVKETTEINEGKLFCPGNLRATSDNADYAKLIQYYIKEKYTLRYTGGMVPDVNQIIVKEKGIFTNVISPTAKAKLRLLFEVAPLGFLIEKAGGHSSEGTKSVLDIEVKNLDDRTQVAYGSLNEIIRFEKTLYGSSRLEEPVPVGAAA,./data/raw/alphafold//AF-O20252-F1-model_v4.pdb,238,2759,5072,5932
+957,8822,8961,MLRAVLLPTLLAFGAFTPVHGANSPGCGKQPTLTNGVNQINGREYVLKIPDGYDPSKPHHLIFGLHWRGGNMYNVVNGDSIQPWYGLEARAQGSAIFVAPNGLNAGWANTNGEDVAFIDAIMEQVEDDLCVDQASRFATGFSWGGGMSYALACARAAEFRAVSVLSGGLISGCDGGNDPIAYLGIHGINDPVLPLDGGVTLANTFVSNNGCQPTDIGQPASGSGGSVRTDFSGCSHPVSFIAYDGGHDGAPLGVGSSLAPDATWEFFMAA,brenda,Q5B2G3,COC(=O)/C=C/c1ccc(O)c(OC)c1.O>>CO.COc1cc(/C=C/C(=O)O)ccc1O,10.1,1.2535597469392408e-14,37.0,7.0,3.1.1.73,162425.0,1.0043213737826426,COC(=O)/C=C/c1ccc(O)c(OC)c1.O,CO.COc1cc(/C=C/C(=O)O)ccc1O,1.0043213737826426,COC(=O)/C=C/c1ccc(O)c(OC)c1.O__MLRAVLLPTLLAFGAFTPVHGANSPGCGKQPTLTNGVNQINGREYVLKIPDGYDPSKPHHLIFGLHWRGGNMYNVVNGDSIQPWYGLEARAQGSAIFVAPNGLNAGWANTNGEDVAFIDAIMEQVEDDLCVDQASRFATGFSWGGGMSYALACARAAEFRAVSVLSGGLISGCDGGNDPIAYLGIHGINDPVLPLDGGVTLANTFVSNNGCQPTDIGQPASGSGGSVRTDFSGCSHPVSFIAYDGGHDGAPLGVGSSLAPDATWEFFMAA,./data/raw/alphafold//AF-Q5B2G3-F1-model_v4.pdb,3501,3421,1159,3079
+958,13858,14038,MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,uniprot_search,P23946,N=C(O)CC[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CC(=O)O)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>,3.9,99.84977586559148,45.66666666666666,8.375,3.4.21.39,9606.0,0.5910646070264992,N=C(O)CC[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CC(=O)O)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,,0.5910646070264992,N=C(O)CC[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CC(=O)O)C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,./data/raw/alphafold//AF-P23946-F1-model_v4.pdb,1858,1553,3136,1905
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+962,2285,2318,MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEAVKLAIEAGFHHIDSAHVYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWSNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEEVIPKDENGKILFDTVDLCATWEAMEKCKDAGLAKSIGVSNFNHRLLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRNVRYLTLDIFAGPPNYPFSDEY,brenda,P52895,CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=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+]>>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.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)c1,0.003,1.0690700902337182e-14,25.0,7.0,1.1.1.357,9606.0,-2.5228787452803374,CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=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+],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.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,-2.5228787452803374,CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=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+]__MDSKYQCVKLNDGHFMPVLGFGTYAPAEVPKSKALEAVKLAIEAGFHHIDSAHVYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWSNSHRPELVRPALERSLKNLQLDYVDLYLIHFPVSVKPGEEVIPKDENGKILFDTVDLCATWEAMEKCKDAGLAKSIGVSNFNHRLLEMILNKPGLKYKPVCNQVECHPYFNQRKLLDFCKSKDIVLVAYSALGSHREEPWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTSEEMKAIDGLNRNVRYLTLDIFAGPPNYPFSDEY,./data/raw/alphafold//AF-P52895-F1-model_v4.pdb,1329,1150,197,214
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+972,10718,10873,MTTIDFKAEVEKLKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFAGKNAGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEETAGKATVTLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,sabio,Q84BU9,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,717.0,1.0496042775783007e-14,37.0,7.5,3.4.13.-,203404.0,2.8555191556678,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,2.8555191556678,C[C@H](N)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=O)O.O__MTTIDFKAEVEKLKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFAGKNAGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEETAGKATVTLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,./data/raw/alphafold//AF-Q84BU9-F1-model_v4.pdb,1801,1476,3046,1794
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+977,8614,8748,MFKHIIARTPARSLVDGLTSSHLGKPDYAKALEQHNAYIRALQTCDVDITLLPPDERFPDSVFVEDPVLCTSRCAIITRPGAESRRGETEIIEETVQRFYPGKVERIEAPGTVEAGDIMMVGDHFYIGESARTNAEGARQMIAILEKHGLSGSVVRLEKVLHLKTGLAYLEHNNLLAAGEFVSKPEFQDFNIIEIPEEESYAANCIWVNERVIMPAGYPRTREKIARLGYRVIEVDTSEYRKIDGGVSCMSLRF,brenda,Q9I4E3,CNC(=N)NCCC[C@H](N)C(=O)O.O>>CN.N=C(O)NCCC[C@H](N)C(=O)O,0.31,0.0,30.0,7.6,3.5.3.18,287.0,-0.5086383061657274,CNC(=N)NCCC[C@H](N)C(=O)O.O,CN.N=C(O)NCCC[C@H](N)C(=O)O,-0.5086383061657274,CNC(=N)NCCC[C@H](N)C(=O)O.O__MFKHIIARTPARSLVDGLTSSHLGKPDYAKALEQHNAYIRALQTCDVDITLLPPDERFPDSVFVEDPVLCTSRCAIITRPGAESRRGETEIIEETVQRFYPGKVERIEAPGTVEAGDIMMVGDHFYIGESARTNAEGARQMIAILEKHGLSGSVVRLEKVLHLKTGLAYLEHNNLLAAGEFVSKPEFQDFNIIEIPEEESYAANCIWVNERVIMPAGYPRTREKIARLGYRVIEVDTSEYRKIDGGVSCMSLRF,./data/raw/alphafold//AF-Q9I4E3-F1-model_v4.pdb,3433,2338,1057,2959
+978,9706,9854,MEALMARGALTGPLRALCLLGCLLSHAAAAPSPIIKFPGDVAPKTDKELAVQYLNTFYGCPKESCNLFVLKDTLKKMQKFFGLPQTGDLDQNTIETMRKPRCGNPDVANYNFFPRKPKWDKNQITYRIIGYTPDLDPETVDDAFARAFQVWSDVTPLRFSRIHDGEADIMINFGRWEHGDGYPFDGKDGLLAHAFAPGTGVGGDSHFDDDELWTLGEGQVVRVKYGNADGEYCKFPFLFNGKEYNSCTDTGRSDGFLWCSTTYNFEKDGKYGFCPHEALFTMGGNAEGQPCKFPFRFQGTSYDSCTTEGRTDGYRWCGTTEDYDRDKKYGFCPETAMSTVGGNSEGAPCVFPFTFLGNKYESCTSAGRSDGKMWCATTANYDDDRKWGFCPDQGYSLFLVAAHEFGHAMGLEHSQDPGALMAPIYTYTKNFRLSQDDIKGIQELYGASPDIDLGTGPTPTLGPVTPEICKQDIVFDGIAQIRGEIFFFKDRFIWRTVTPRDKPMGPLLVATFWPELPEKIDAVYEAPQEEKAVFFAGNEYWIYSASTLERGYPKPLTSLGLPPDVQRVDAAFNWSKNKKTYIFAGDKFWRYNEVKKKMDPGFPKLIADAWNAIPDNLDAVVDLQGGGHSYFFKGAYYLKLENQSLKSVKFGSIKSDWLGC,uniprot_search,P08253,COc1ccc2c(C(=O)N3CCC[C@H]3C(O)=N[C@@H](CC(C)C)C(O)=NCC(O)=N[C@@H](CC(C)C)C(=O)OCC(=O)COP(=O)(O)ON[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(=N)O)cc(=O)oc2c1.O>>,1.7,99.90138154592316,37.0,7.5,3.4.24.24,9606.0,0.2304489213782739,COc1ccc2c(C(=O)N3CCC[C@H]3C(O)=N[C@@H](CC(C)C)C(O)=NCC(O)=N[C@@H](CC(C)C)C(=O)OCC(=O)COP(=O)(O)ON[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(=N)O)cc(=O)oc2c1.O,,0.2304489213782739,COc1ccc2c(C(=O)N3CCC[C@H]3C(O)=N[C@@H](CC(C)C)C(O)=NCC(O)=N[C@@H](CC(C)C)C(=O)OCC(=O)COP(=O)(O)ON[C@@H](C)C(O)=N[C@@H](CCCNC(=N)N)C(=N)O)cc(=O)oc2c1.O__MEALMARGALTGPLRALCLLGCLLSHAAAAPSPIIKFPGDVAPKTDKELAVQYLNTFYGCPKESCNLFVLKDTLKKMQKFFGLPQTGDLDQNTIETMRKPRCGNPDVANYNFFPRKPKWDKNQITYRIIGYTPDLDPETVDDAFARAFQVWSDVTPLRFSRIHDGEADIMINFGRWEHGDGYPFDGKDGLLAHAFAPGTGVGGDSHFDDDELWTLGEGQVVRVKYGNADGEYCKFPFLFNGKEYNSCTDTGRSDGFLWCSTTYNFEKDGKYGFCPHEALFTMGGNAEGQPCKFPFRFQGTSYDSCTTEGRTDGYRWCGTTEDYDRDKKYGFCPETAMSTVGGNSEGAPCVFPFTFLGNKYESCTSAGRSDGKMWCATTANYDDDRKWGFCPDQGYSLFLVAAHEFGHAMGLEHSQDPGALMAPIYTYTKNFRLSQDDIKGIQELYGASPDIDLGTGPTPTLGPVTPEICKQDIVFDGIAQIRGEIFFFKDRFIWRTVTPRDKPMGPLLVATFWPELPEKIDAVYEAPQEEKAVFFAGNEYWIYSASTLERGYPKPLTSLGLPPDVQRVDAAFNWSKNKKTYIFAGDKFWRYNEVKKKMDPGFPKLIADAWNAIPDNLDAVVDLQGGGHSYFFKGAYYLKLENQSLKSVKFGSIKSDWLGC,./data/raw/alphafold//AF-P08253-F1-model_v4.pdb,3360,2227,3917,2791
+979,5154,5240,MRSTLLAFALAVALPAAHTSAAEVPLPQLRAYTVDASWLQPMAPLQIADHTWQIGTEDLTALLVQTPDGAVLLDGGMPQMASHLLDNMKARGVTPRDLRLILLSHAHADHAGPVAELKRRTGAKVAANAESAVLLARGGSDDLHFGDGITYPPANADRIVMDGEVITVGGIVFTAHFMAGHTPGSTAWTWTDTRNGKPVRIAYADSLSAPGYQLQGNPRYPHLIEDYRRSFATVRALPCDVLLTPHPGASNWDYAAGARAGAKALTCKAYADAAEQKFDGQLAKETAGAR,sabio,P52700,CC(O)C1C(=O)N2C(C(=O)[O-])=C(SC3Cn4cnc[n+]4C3)C(C)C12.O>>,134.0,99.7293017338224,25.0,7.0,3.5.2.6,40324.0,2.127104798364808,CC(O)C1C(=O)N2C(C(=O)[O-])=C(SC3Cn4cnc[n+]4C3)C(C)C12.O,,2.127104798364808,CC(O)C1C(=O)N2C(C(=O)[O-])=C(SC3Cn4cnc[n+]4C3)C(C)C12.O__MRSTLLAFALAVALPAAHTSAAEVPLPQLRAYTVDASWLQPMAPLQIADHTWQIGTEDLTALLVQTPDGAVLLDGGMPQMASHLLDNMKARGVTPRDLRLILLSHAHADHAGPVAELKRRTGAKVAANAESAVLLARGGSDDLHFGDGITYPPANADRIVMDGEVITVGGIVFTAHFMAGHTPGSTAWTWTDTRNGKPVRIAYADSLSAPGYQLQGNPRYPHLIEDYRRSFATVRALPCDVLLTPHPGASNWDYAAGARAGAKALTCKAYADAAEQKFDGQLAKETAGAR,./data/raw/alphafold//AF-P52700-F1-model_v4.pdb,1443,3060,814,1074
+980,18529,18793,MEDAKNIKKGPAPFYPLEDGTAGEQLHKAMKRYALVPGTIAFTDAHIEVNITYAEYFEMSVRLAEAMKRYGLNTNHRIVVCSENSLQFFMPVLGALFIGVAVAPANDIYNERELLNSMNISQPTVVFVSKKGLQKILNVQKKLPIIQKIIIMDSKTDYQGFQSMYTFVTSHLPPGFNEYDFVPESFDRDKTIALIMNSSGSTGLPKGVALPHRTACVRFSHARDPIFGNQIIPDTAILSVVPFHHGFGMFTTLGYLICGFRVVLMYRFEEELFLRSLQDYKIQSALLVPTLFSFFAKSTLIDKYDLSNLHEIASGGAPLSKEVGEAVAKRFHLPGIRQGYGLTETTSAILITPEGDDKPGAVGKVVPFFEAKVVDLDTGKTLGVNQRGELCVRGPMIMSGYVNNPEATNALIDKDGWLHSGDIAYWDEDEHFFIVDRLKSLIKYKGYQVAPAELESILLQHPNIFDAGVAGLPDDDAGELPAAVVVLEHGKTMTEKEIVDYVASQVTTAKKLRGGVVFVDEVPKGLTGKLDARKIREILIKAKKGGKSKL,brenda,P08659,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)[C@H]1CSC(c2nc3ccc(O)cc3s2)=N1.O=O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=C1C=CC2=NC(C3=NC(=O)CS3)SC2=C1.O=C=O.O=P(O)(O)OP(=O)(O)O,0.167,6.932039714248367e-15,29.8,7.172222222222222,1.13.12.7,7054.0,-0.7772835288524167,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]1CSC(c2nc3ccc(O)cc3s2)=N1.O=O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=C1C=CC2=NC(C3=NC(=O)CS3)SC2=C1.O=C=O.O=P(O)(O)OP(=O)(O)O,-0.7772835288524167,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]1CSC(c2nc3ccc(O)cc3s2)=N1.O=O__MEDAKNIKKGPAPFYPLEDGTAGEQLHKAMKRYALVPGTIAFTDAHIEVNITYAEYFEMSVRLAEAMKRYGLNTNHRIVVCSENSLQFFMPVLGALFIGVAVAPANDIYNERELLNSMNISQPTVVFVSKKGLQKILNVQKKLPIIQKIIIMDSKTDYQGFQSMYTFVTSHLPPGFNEYDFVPESFDRDKTIALIMNSSGSTGLPKGVALPHRTACVRFSHARDPIFGNQIIPDTAILSVVPFHHGFGMFTTLGYLICGFRVVLMYRFEEELFLRSLQDYKIQSALLVPTLFSFFAKSTLIDKYDLSNLHEIASGGAPLSKEVGEAVAKRFHLPGIRQGYGLTETTSAILITPEGDDKPGAVGKVVPFFEAKVVDLDTGKTLGVNQRGELCVRGPMIMSGYVNNPEATNALIDKDGWLHSGDIAYWDEDEHFFIVDRLKSLIKYKGYQVAPAELESILLQHPNIFDAGVAGLPDDDAGELPAAVVVLEHGKTMTEKEIVDYVASQVTTAKKLRGGVVFVDEVPKGLTGKLDARKIREILIKAKKGGKSKL,./data/raw/alphafold//AF-P08659-F1-model_v4.pdb,1668,1277,4558,1512
+981,481,498,MSSKLHCVKLNDGHFIPALGFGTYKPKEVPKSKSLEAAHLAIDVGYRHIDTASAYQVEEEIGQAIQSKIKAGVVKREDMFITTKLWCSCFRTEMVRPALEKSLKNLQLDYVDLFLIHYPVPIKSSVDESPLDEKGKFLLDTVDFCDTWEMLEKCKDAGLVKSIGVSNFNHKQLERLLNKPGLKYKPVCNQVECHLYLNQSKLLDYCKSKDIVLVAYGALGTQRYKEWVDQNSPVLLDDPILCDVAKKNKRSPALIALRYLFQRGVVPLAQSFKENEMRENLQVFEFQLSPEDMKTLDGLNKNFRYLSAEFLADHPEYPFSEEY,sabio,Q2MHD9,C1C[C@@H](C2=CC=CC=C2C1)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],2700.0,9.87698779201632,25.0,7.4,1.1.1.51,10116.0,3.431363764158988,C1C[C@@H](C2=CC=CC=C2C1)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],3.431363764158988,C1C[C@@H](C2=CC=CC=C2C1)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__MSSKLHCVKLNDGHFIPALGFGTYKPKEVPKSKSLEAAHLAIDVGYRHIDTASAYQVEEEIGQAIQSKIKAGVVKREDMFITTKLWCSCFRTEMVRPALEKSLKNLQLDYVDLFLIHYPVPIKSSVDESPLDEKGKFLLDTVDFCDTWEMLEKCKDAGLVKSIGVSNFNHKQLERLLNKPGLKYKPVCNQVECHLYLNQSKLLDYCKSKDIVLVAYGALGTQRYKEWVDQNSPVLLDDPILCDVAKKNKRSPALIALRYLFQRGVVPLAQSFKENEMRENLQVFEFQLSPEDMKTLDGLNKNFRYLSAEFLADHPEYPFSEEY,./data/raw/alphafold//AF-Q2MHD9-F1-model_v4.pdb,1329,1150,6276,367
+982,22936,23278,MLRGAGVLLHITSLPGGCFVGDLGPEAYKFADSLAYAEQTYWQTLPINHTVPEYENSPYSAVSSYAGDPVLISLELMKRDGLIDSVPQCPPAERADYIKAWEVKRKALEKALKRAGRLSDYRHFKDVTPWLDDYAYYMAMRERFGPWPVWPKEEPPPASLELYKFAQFVFWTQWERFKEYVNSLGIFLIGDLPFYPSLDSVDVWRNKKYFKVGEDGRPLYVAGVPPDYFSATGQLWGNPVYNWEALERDGFKWWVNRLKHAVTVFDYVRLDHFRGYVAYWEVPGGETTAVRGRWAPSPGRRLFEAAAAAVDLGRLIAEDLGYITPEVEALREELGLPGMRVLQFAWDGNPANPHKPHNHVKNAVVYTGTHDNNTAVGWYKEEATARARREFKKYSNCAGEVHWCFIKLAHMSVANVAIVPVQDLLGLGSEARMNRPGTVGGNWKWRLGAQPEPRVWKRLRDVTRTYGR,sabio,Q8ZXM0,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(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O>>O=C[C@H](O)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O[C@H]5O[C@H](CO)[C@@H](O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)CO.OCC1OC(O)C(O)C(O)C1O,51.2,8.524437128680363e-15,80.0,6.7,2.4.1.25,13773.0,1.7092699609758308,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(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1O,O=C[C@H](O)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O[C@H]5O[C@H](CO)[C@@H](O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)CO.OCC1OC(O)C(O)C(O)C1O,1.7092699609758308,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(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(O)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
+983,7311,7433,MPSIRLADLAQQLDAELHGDGDIVITGVASMQSAQTGHITFMVNPKYREHLGLCQASAVVMTQDDLPFAKSAALVVKNPYLTYARMAQILDTTPQPAQNIAPSAVIDATAKLGNNVSIGANAVIESGVELGDNVIIGAGCFVGKNSKIGAGSRLWANVTIYHEIQIGQNCLIQSGTVVGADGFGYANDRGNWVKIPQIGRVIIGDRVEIGACTTIDRGALDDTIIGNGVIIDNQCQIAHNVVIGDNTAVAGGVIMAGSLKIGRYCMIGGASVINGHMEICDKVTVTGMGMVMRPITEPGVYSSGIPLQPNKVWRKTAALVMNIDDMSKRLKSLERKVNQQD,sabio,P21645,CCCCCCCCCCCC(O)CC(=O)OC1C(N)C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C1O>>*S.CCCCCCCCCCCC(O)CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(=O)CC(O)CCCCCCCCCCC,23.0,14.07073795240346,30.0,7.5,2.3.1.191,562.0,1.3617278360175928,CCCCCCCCCCCC(O)CC(=O)OC1C(N)C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C1O,*S.CCCCCCCCCCCC(O)CC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C(O)C1OC(=O)CC(O)CCCCCCCCCCC,1.3617278360175928,CCCCCCCCCCCC(O)CC(=O)OC1C(N)C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)OC(CO)C1O__MPSIRLADLAQQLDAELHGDGDIVITGVASMQSAQTGHITFMVNPKYREHLGLCQASAVVMTQDDLPFAKSAALVVKNPYLTYARMAQILDTTPQPAQNIAPSAVIDATAKLGNNVSIGANAVIESGVELGDNVIIGAGCFVGKNSKIGAGSRLWANVTIYHEIQIGQNCLIQSGTVVGADGFGYANDRGNWVKIPQIGRVIIGDRVEIGACTTIDRGALDDTIIGNGVIIDNQCQIAHNVVIGDNTAVAGGVIMAGSLKIGRYCMIGGASVINGHMEICDKVTVTGMGMVMRPITEPGVYSSGIPLQPNKVWRKTAALVMNIDDMSKRLKSLERKVNQQD,./data/raw/alphafold//AF-P21645-F1-model_v4.pdb,3304,2148,3825,2690
+984,4057,4110,MRGFVVLLAVFALSQASGIVRIPLHKGKSLRRALKERGLLEDFLKNHQHAVSRKHSNSREVASEFLTNYLDCQYFGKIYIGTPPQEFTVVFDTGSSDLWVPSVYCNSVACQNHHRFDPSKSSTFQNMDKSLSIQYGTGSMQGLLGYDTVTVSSIVDPHQTVGLSTQEPGDVFTYSEFDGILGLAYPSLASEYSVPVFDNMMDRHLVAQDLFSVYMSRNEQGSMLTLGAIDPSYYTGSLHWIPVTVQEYWQFTVDSVTVDGVVVACDGGCQAILDTGTSMLVGPGSDIFNIQQAIGATEGQYGEFDIDCGTLSSMPTVVFEINGKKYPLPPSAYTNQDQGFCTSGFQGDDSSQQWILGDVFIREYYSVFDRASNLVGLAKAI,uniprot_search,Q9N2D2,CC(C)C[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N=C(O)[C@H](C)N)C(=O)O.O>>CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N=C(O)[C@H](C)N)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](Cc1ccccc1)C(=O)O.CC(C)C[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)CCCCN)C(=O)O,63.0,1.7931762724684187e-14,25.0,4.0,3.4.23.4,9483.0,1.7993405494535817,CC(C)C[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N=C(O)[C@H](C)N)C(=O)O.O,CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N=C(O)[C@H](C)N)C(O)=N[C@@H](CCC(=O)O)C(O)=N[C@@H](Cc1ccccc1)C(=O)O.CC(C)C[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@@H](N)CCCCN)C(=O)O,2.3404441148401185,CC(C)C[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CCCCN)N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H](CC(C)C)N=C(O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N=C(O)[C@H](C)N)C(=O)O.O__MRGFVVLLAVFALSQASGIVRIPLHKGKSLRRALKERGLLEDFLKNHQHAVSRKHSNSREVASEFLTNYLDCQYFGKIYIGTPPQEFTVVFDTGSSDLWVPSVYCNSVACQNHHRFDPSKSSTFQNMDKSLSIQYGTGSMQGLLGYDTVTVSSIVDPHQTVGLSTQEPGDVFTYSEFDGILGLAYPSLASEYSVPVFDNMMDRHLVAQDLFSVYMSRNEQGSMLTLGAIDPSYYTGSLHWIPVTVQEYWQFTVDSVTVDGVVVACDGGCQAILDTGTSMLVGPGSDIFNIQQAIGATEGQYGEFDIDCGTLSSMPTVVFEINGKKYPLPPSAYTNQDQGFCTSGFQGDDSSQQWILGDVFIREYYSVFDRASNLVGLAKAI,./data/raw/alphafold//AF-Q9N2D2-F1-model_v4.pdb,2973,1591,3185,1957
+985,21909,22238,MAPSRKFFVGGNWKMNGRKKCLGELICTLNAAKLPADTEVVCAPPTAYIDFARQKLDPKIAVAAQNCYKVTNGAFTGEISPGMIKDLGATWVVLGHSERRHIFGESDELIGQKVNHALSEGLGVIACIGEKLDEREAGITEKVVFEQTKAIADNVKDWCKVVLAYEPVWAIGTGKTATPQQAQEVHEKLRGWLKCNVSEGVAQCTRIIYGGSVTGATCKELASQPDVDGFLVGGASLKPEFVDIINAKQ,sabio,P48500,O=CC(O)COP(=O)(O)O>>O=C(CO)COP(=O)(O)O,1000000.0,0.0,38.0,7.0,5.3.1.1,10116.0,6.0,O=CC(O)COP(=O)(O)O,O=C(CO)COP(=O)(O)O,6.0,O=CC(O)COP(=O)(O)O__MAPSRKFFVGGNWKMNGRKKCLGELICTLNAAKLPADTEVVCAPPTAYIDFARQKLDPKIAVAAQNCYKVTNGAFTGEISPGMIKDLGATWVVLGHSERRHIFGESDELIGQKVNHALSEGLGVIACIGEKLDEREAGITEKVVFEQTKAIADNVKDWCKVVLAYEPVWAIGTGKTATPQQAQEVHEKLRGWLKCNVSEGVAQCTRIIYGGSVTGATCKELASQPDVDGFLVGGASLKPEFVDIINAKQ,./data/raw/alphafold//AF-P48500-F1-model_v4.pdb,728,3257,5563,6774
+986,15580,15804,MEPFVVLVLCLSFMLLFSLWRQSCRRRKLPPGPTPLPIIGNMLQIDVKDICKSFTNFSKVYGPVFTVYFGMNPIVVFHGYEAVKEALIDNGEEFSGRGNSPISQRITKGLGIISSNGKRWKEIRRFSLTTLRNFGMGKRSIEDRVQEEAHCLVEELRKTKASPCDPTFILGCAPCNVICSVVFQKRFDYKDQNFLTLMKRFNENFRILNSPWIQVCNNFPLLIDCFPGTHNKVLKNVALTRSYIREKVKEHQASLDVNNPRDFIDCFLIKMEQEKDNQKSEFNIENLVGTVADLFVAGTETTSTTLRYGLLLLLKHPEVTAKVQEEIDHVIGRHRSPCMQDRSHMPYTDAVVHEIQRYSDLVPTGVPHAVTTDTKFRNYLIPKGTTIMALLTSVLHDDKEFPNPNIFDPGHFLDKNGNFKKSDYFMPFSAGKRICAGEGLARMELFLFLTTILQNFNLKSVDDLKNLNTTAVTKGIVSLPPSYQICFIPV,sabio,P10632,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.O=O>>NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1.O,240.0,0.972901408633524,28.0,7.4,1.14.14.1,9606.0,2.380211241711606,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.O=O,NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1.O,2.380211241711606,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.O=O__MEPFVVLVLCLSFMLLFSLWRQSCRRRKLPPGPTPLPIIGNMLQIDVKDICKSFTNFSKVYGPVFTVYFGMNPIVVFHGYEAVKEALIDNGEEFSGRGNSPISQRITKGLGIISSNGKRWKEIRRFSLTTLRNFGMGKRSIEDRVQEEAHCLVEELRKTKASPCDPTFILGCAPCNVICSVVFQKRFDYKDQNFLTLMKRFNENFRILNSPWIQVCNNFPLLIDCFPGTHNKVLKNVALTRSYIREKVKEHQASLDVNNPRDFIDCFLIKMEQEKDNQKSEFNIENLVGTVADLFVAGTETTSTTLRYGLLLLLKHPEVTAKVQEEIDHVIGRHRSPCMQDRSHMPYTDAVVHEIQRYSDLVPTGVPHAVTTDTKFRNYLIPKGTTIMALLTSVLHDDKEFPNPNIFDPGHFLDKNGNFKKSDYFMPFSAGKRICAGEGLARMELFLFLTTILQNFNLKSVDDLKNLNTTAVTKGIVSLPPSYQICFIPV,./data/raw/alphafold//AF-P10632-F1-model_v4.pdb,1176,3892,3238,2024
+987,4707,4765,MNTVSPAKKKVIIIGAGIAGLKAASTLHQNGIQDCLVLEARDRVGGRLQTVTGYQGRKYDIGASWHHDTLTNPLFLEEAQLSLNDGRTRFVFDDDNFIYIDEERGRVDHDKELLLEIVDNEMSKFAELEFHQHLGVSDCSFFQLVMKYLLQRRQFLTNDQIRYLPQLCRYLELWHGLDWKLLSAKDTYFGHQGRNAFALNYDSVVQRIAQSFPQNWLKLSCEVKSITREPSKNVTVNCEDGTVYNADYVIITVPQSVLNLSVQPEKNLRGRIEFQPPLKPVIQDAFDKIHFGALGKVIFEFEECCWSNESSKIVTLANSTNEFVEIVRNAENLDELDSMLEREDSQKHTSVTCWSQPLFFVNLSKSTGVASFMMLMQAPLTNHIESIREDKERLFSFFQPVLNKIMKCLDSEDVIDGMRPIENIANANKPVLRNIIVSNWTRDPYSRGAYSACFPGDDPVDMVVAMSNGQDSRIRFAGEHTIMDGAGCAYGAWESGRREATRISDLLK,brenda,P50264,CC(O)=NCCCNCCCCNCCCN.O.O=O>>CC(O)=NCCC=O.NCCCCNCCCN.OO,15.1,1.9275751065056168e-14,25.0,9.0,1.5.3.17,4932.0,1.1789769472931697,CC(O)=NCCCNCCCCNCCCN.O.O=O,CC(O)=NCCC=O.NCCCCNCCCN.OO,1.1789769472931697,CC(O)=NCCCNCCCCNCCCN.O.O=O__MNTVSPAKKKVIIIGAGIAGLKAASTLHQNGIQDCLVLEARDRVGGRLQTVTGYQGRKYDIGASWHHDTLTNPLFLEEAQLSLNDGRTRFVFDDDNFIYIDEERGRVDHDKELLLEIVDNEMSKFAELEFHQHLGVSDCSFFQLVMKYLLQRRQFLTNDQIRYLPQLCRYLELWHGLDWKLLSAKDTYFGHQGRNAFALNYDSVVQRIAQSFPQNWLKLSCEVKSITREPSKNVTVNCEDGTVYNADYVIITVPQSVLNLSVQPEKNLRGRIEFQPPLKPVIQDAFDKIHFGALGKVIFEFEECCWSNESSKIVTLANSTNEFVEIVRNAENLDELDSMLEREDSQKHTSVTCWSQPLFFVNLSKSTGVASFMMLMQAPLTNHIESIREDKERLFSFFQPVLNKIMKCLDSEDVIDGMRPIENIANANKPVLRNIIVSNWTRDPYSRGAYSACFPGDDPVDMVVAMSNGQDSRIRFAGEHTIMDGAGCAYGAWESGRREATRISDLLK,./data/raw/alphafold//AF-P50264-F1-model_v4.pdb,2966,1708,3321,2124
+988,22389,22723,MTFSQKDRKETIQETAKTTYDVLIIGGGITGAGVAVQTAAAGMKTVLLEMQDFAEGTSSRSTKLVHGGIRYLKTFDVEVVADTVRERAIVQQIAPHIPKPDPMLLPIYDEPGATFSLFSVKVAMDLYDRLANVTGSKYENYLLTKEEVLAREPQLQAENLVGGGVYLDFRNNDARLVIENIKRAQADGAAMISKAKVVGILHDEQGIINGVEVEDQLTNERFEVHAKVVINTTGPWSDIVRQLDKNDELPPQMRPTKGVHLVVDREKLKVPQPTYFDTGKNDGRMVFVVPRENKTYFGTTDTDYTGDFAHPTVTQEDVDYLLTIVNERFPHAQITLDDIEASWAGLRPLITNNGGSDYNGGGKGKLSDESFEQIVESVKEYLADERQRPVVEKAVKQAQERVEASKVDPSQVSRGSSLERSKDGLLTLAGGKITDYRLMAEGAVKRINELLQESGASFELVDSTTYPVSGGELDAANVEEELAKLADQAQTAGFNEAAATYLAHLYGSNLPQVLNYKTKFEGLDEKESTALNYSLHEEMVLTPVDYLLRRTNHILFMRDTLDDVKAGVVAAMTDFFGWSEEEKAAHVLELNQVIAESDLTALKGGKKDE,sabio,O86963,O=P(O)(O)OCC(O)CO>>O=C(CO)COP(=O)(O)O,48.0,0.5875324221140567,5.0,7.0,1.1.3.21,37734.0,1.6812412373755872,O=P(O)(O)OCC(O)CO,O=C(CO)COP(=O)(O)O,1.6812412373755872,O=P(O)(O)OCC(O)CO__MTFSQKDRKETIQETAKTTYDVLIIGGGITGAGVAVQTAAAGMKTVLLEMQDFAEGTSSRSTKLVHGGIRYLKTFDVEVVADTVRERAIVQQIAPHIPKPDPMLLPIYDEPGATFSLFSVKVAMDLYDRLANVTGSKYENYLLTKEEVLAREPQLQAENLVGGGVYLDFRNNDARLVIENIKRAQADGAAMISKAKVVGILHDEQGIINGVEVEDQLTNERFEVHAKVVINTTGPWSDIVRQLDKNDELPPQMRPTKGVHLVVDREKLKVPQPTYFDTGKNDGRMVFVVPRENKTYFGTTDTDYTGDFAHPTVTQEDVDYLLTIVNERFPHAQITLDDIEASWAGLRPLITNNGGSDYNGGGKGKLSDESFEQIVESVKEYLADERQRPVVEKAVKQAQERVEASKVDPSQVSRGSSLERSKDGLLTLAGGKITDYRLMAEGAVKRINELLQESGASFELVDSTTYPVSGGELDAANVEEELAKLADQAQTAGFNEAAATYLAHLYGSNLPQVLNYKTKFEGLDEKESTALNYSLHEEMVLTPVDYLLRRTNHILFMRDTLDDVKAGVVAAMTDFFGWSEEEKAAHVLELNQVIAESDLTALKGGKKDE,./data/raw/alphafold//AF-O86963-F1-model_v4.pdb,742,162,5900,6814
+989,1624,1654,MKFSRVVCGLTEAGGALAAPVKEKGIKKRASPFQWFGSNESGAEFGNNNIPGVEGTDYTFPNTSAIQILIDQGMNIFRVPFLMERMVPNQMTGPVDSAYFQGYSQVINYITSHGASAVIDPHNFGRYYNNIISSPSDFQTFWHTIASNFADNDNVIFDTNNEYHDMDESLVVQLNQAAIDGIRAAGATSQYIFVEGNSWTGAWTWTQVNDAMANLTDPQNKIVYEMHQYLDSDGSGTSDQCVNSTIGQDRVESATAWLKQNGKKAILGEYAGGANSVCETAVTGMLDYLANNTDVWTGAIWWAAGPWWGDYIFSMEPPSGIAYEQVLPLLKPYLE,brenda,X4YXV3,CC(=O)O.O.O=CC(O)C(O)C(O)C(O)CO>>OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,51.6,17.76757651139449,90.0,4.5,3.2.1.4,68825.0,1.7126497016272113,CC(=O)O.O.O=CC(O)C(O)C(O)C(O)CO,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,1.7126497016272113,CC(=O)O.O.O=CC(O)C(O)C(O)C(O)CO__MKFSRVVCGLTEAGGALAAPVKEKGIKKRASPFQWFGSNESGAEFGNNNIPGVEGTDYTFPNTSAIQILIDQGMNIFRVPFLMERMVPNQMTGPVDSAYFQGYSQVINYITSHGASAVIDPHNFGRYYNNIISSPSDFQTFWHTIASNFADNDNVIFDTNNEYHDMDESLVVQLNQAAIDGIRAAGATSQYIFVEGNSWTGAWTWTQVNDAMANLTDPQNKIVYEMHQYLDSDGSGTSDQCVNSTIGQDRVESATAWLKQNGKKAILGEYAGGANSVCETAVTGMLDYLANNTDVWTGAIWWAAGPWWGDYIFSMEPPSGIAYEQVLPLLKPYLE,./data/raw/alphafold//AF-X4YXV3-F1-model_v4.pdb,1424,942,744,1040
+990,1070,1096,MKDFSKYRGVFPAFYACYDDNGEVSPERVQQLTEYHLKKGVKGVYVNGSSGECIYLSVAERKMVLENVMKVAKGKLTVIAHVACNNTKDSVELAKHAESMGVDAIAAIPPIYFKLPDYSIAKYWNAISAAAPHTDFVIYNIPQLAGTALSASLYQQMLDNQQLIGVKNSSMPVQDIQIFKSLGGDDHLVFNGPDEQFISGRVMGAIGGIGGTYGAMPDLFLKLNSFLKAGDLKNANKLQFMINEVIYKLAGGHGNMYALIKEVLRENEDLDIGSVRLPLEPLAPEDQQLVAEAIALINKTRAAFN,brenda,C8P490,CC(=O)C(=O)O.CC(O)=N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O>>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,5.4,9.175071078443114e-15,37.0,7.0,4.1.3.3,227943.0,0.7323937598229685,CC(=O)C(=O)O.CC(O)=N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,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,0.7323937598229685,CC(=O)C(=O)O.CC(O)=N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O__MKDFSKYRGVFPAFYACYDDNGEVSPERVQQLTEYHLKKGVKGVYVNGSSGECIYLSVAERKMVLENVMKVAKGKLTVIAHVACNNTKDSVELAKHAESMGVDAIAAIPPIYFKLPDYSIAKYWNAISAAAPHTDFVIYNIPQLAGTALSASLYQQMLDNQQLIGVKNSSMPVQDIQIFKSLGGDDHLVFNGPDEQFISGRVMGAIGGIGGTYGAMPDLFLKLNSFLKAGDLKNANKLQFMINEVIYKLAGGHGNMYALIKEVLRENEDLDIGSVRLPLEPLAPEDQQLVAEAIALINKTRAAFN,./data/raw/alphafold//AF-C8P490-F1-model_v4.pdb,1265,5208,1594,721
+991,6086,6180,MKISGLQTAGTPGDVAANLRELDAACRRARAEGAELLITTELFITGYDIGDAVRDLARTDLLSPAQEIAAAHGIALVLGAPEHDDGACYNSAFFIDPAGAILGRHRKNHLFGDLDRRYFTPGDRTAPVIDYAGVRIAMLICYDVEFPENVRAAALAGADLVAVPTAQMQPYEFIAEHLLRVRAWENQIYIAYVNHDGDEGSLRYVGRSSIVSPSATVLDSVEHGNRLLFATVEPHTVRTARKANPYLADLRPDLFTPSARATKDPSC,brenda,A0A088BHP3,CCC(=N)O.O>>CCC(=O)O.N,28.6,0.0,35.0,8.0,3.5.1.4,1931.0,1.4563660331290431,CCC(=N)O.O,CCC(=O)O.N,1.4563660331290431,CCC(=N)O.O__MKISGLQTAGTPGDVAANLRELDAACRRARAEGAELLITTELFITGYDIGDAVRDLARTDLLSPAQEIAAAHGIALVLGAPEHDDGACYNSAFFIDPAGAILGRHRKNHLFGDLDRRYFTPGDRTAPVIDYAGVRIAMLICYDVEFPENVRAAALAGADLVAVPTAQMQPYEFIAEHLLRVRAWENQIYIAYVNHDGDEGSLRYVGRSSIVSPSATVLDSVEHGNRLLFATVEPHTVRTARKANPYLADLRPDLFTPSARATKDPSC,./data/raw/alphafold//AF-A0A088BHP3-F1-model_v4.pdb,1246,3063,600,687
+992,640,659,MHSSHLLLEEPIRMASILEPSKSSFFPALTKIVGTLGPKSRSVEALSGCLKAGMSVARFDFSWGDADYHQETLDNLKVAVRSTKKLCAVMLDTVGPELQVINKSEKAITLKADGLVTLTPNQDQEASSEVLPINFNGLAKAVKKGDTIFVGQYLFTGSETTSVWLEVDEVKGDDVICLSRNAATLAGSLFTLHSSQVHIDLPTLTEKDKEVISTWGVQNKIDFLSLSYCRHAEDVRQTREMLKKLGDLSQTQIFAKIENVEGLTHFDEILQEADGIILSRGNLGIDLPPEKVFLFQKAALYKCNMAGKPAVLTRVVDSMTDNLRPTRAEATDVANAVLDGSDAILLGAETLRGLYPVETISTVGRICAEAEKVFNQDLYFKKTVKYVGEPMTHLESIASSAVRAAIKVKASVIICFTSSGRAARLIAKYRPTMPVISVVIPRVKTNQLKWSFSGAFEARQSLIVRGLFPMLADPRHPAESTSATNESVLKVALDHGKHAGVIKSHDRVVVCQKVGDASVVKIIELED,brenda,Q94KE3,C=C(OP(=O)(O)O)C(=O)O.N=c1ccn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O2)c(O)n1>>CC(=O)C(=O)O.N=c1ccn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(O)n1,6.68,0.0,25.0,7.5,2.7.1.40,3702.0,0.8247764624755457,C=C(OP(=O)(O)O)C(=O)O.N=c1ccn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O2)c(O)n1,CC(=O)C(=O)O.N=c1ccn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(O)n1,0.8247764624755457,C=C(OP(=O)(O)O)C(=O)O.N=c1ccn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O2)c(O)n1__MHSSHLLLEEPIRMASILEPSKSSFFPALTKIVGTLGPKSRSVEALSGCLKAGMSVARFDFSWGDADYHQETLDNLKVAVRSTKKLCAVMLDTVGPELQVINKSEKAITLKADGLVTLTPNQDQEASSEVLPINFNGLAKAVKKGDTIFVGQYLFTGSETTSVWLEVDEVKGDDVICLSRNAATLAGSLFTLHSSQVHIDLPTLTEKDKEVISTWGVQNKIDFLSLSYCRHAEDVRQTREMLKKLGDLSQTQIFAKIENVEGLTHFDEILQEADGIILSRGNLGIDLPPEKVFLFQKAALYKCNMAGKPAVLTRVVDSMTDNLRPTRAEATDVANAVLDGSDAILLGAETLRGLYPVETISTVGRICAEAEKVFNQDLYFKKTVKYVGEPMTHLESIASSAVRAAIKVKASVIICFTSSGRAARLIAKYRPTMPVISVVIPRVKTNQLKWSFSGAFEARQSLIVRGLFPMLADPRHPAESTSATNESVLKVALDHGKHAGVIKSHDRVVVCQKVGDASVVKIIELED,./data/raw/alphafold//AF-Q94KE3-F1-model_v4.pdb,1130,719,410,462
+993,1043,1069,MSAPTKPHSPTFKPEPHSAANEPKHPAARPKHVALQQLTGAQAVIRSLEELGVDVIFGIPGGAVLPVYDPLFDSKKLRHVLVRHEQGAGHAASGYAHVTGRVGVCMATSGPGATNLVTPLADAQMDSIPVVAITGQVGRGLIGTDAFQEADISGITMPITKHNFLVRSGDDIPRVLAEAFHIAASGRPGAVLVDIPKDVLQGQCTFSWPPRMELPGYKPNTKPHSRQVREAAKLIAAARKPVLYVGGGVIRGEATEQLRELAELTGIPVVTTLMARGAFPDSHRQNLGMPGMHGTVAAVAALQRSDLLIALGTRFDDRVTGKLDSFAPEAKVIHADIDPAEIGKNRHADVPIVGDVKAVITELIAMLRHHHIPGTIEMADWWAYLNGVRKTYPLSYGPQSDGSLSPEYVIEKLGEIAGPDAVFVAGVGQHQMWAAQFIRYEKPRSWLNSGGLGTMGFAIPAAMGAKIALPGTEVWAIDGDGCFQMTNQELATCAVEGIPVKVALINNGNLGMVRQWQSLFYAERYSQTDLATHSHRIPDFVKLAEALGCVGLRCEREEDVVDVINQARAINDCPVVIDFIVGADAQVWPMVAAGTSNDEIQAARGIRPLFDDITEGHA,brenda,P9WG41,CC(=O)C(=O)O.CC(=O)C(C)=O>>CC(=O)OC(C)C(C)=O.O=C=O,3.2,0.0,37.0,7.5,2.2.1.6,1773.0,0.505149978319906,CC(=O)C(=O)O.CC(=O)C(C)=O,CC(=O)OC(C)C(C)=O.O=C=O,0.505149978319906,CC(=O)C(=O)O.CC(=O)C(C)=O__MSAPTKPHSPTFKPEPHSAANEPKHPAARPKHVALQQLTGAQAVIRSLEELGVDVIFGIPGGAVLPVYDPLFDSKKLRHVLVRHEQGAGHAASGYAHVTGRVGVCMATSGPGATNLVTPLADAQMDSIPVVAITGQVGRGLIGTDAFQEADISGITMPITKHNFLVRSGDDIPRVLAEAFHIAASGRPGAVLVDIPKDVLQGQCTFSWPPRMELPGYKPNTKPHSRQVREAAKLIAAARKPVLYVGGGVIRGEATEQLRELAELTGIPVVTTLMARGAFPDSHRQNLGMPGMHGTVAAVAALQRSDLLIALGTRFDDRVTGKLDSFAPEAKVIHADIDPAEIGKNRHADVPIVGDVKAVITELIAMLRHHHIPGTIEMADWWAYLNGVRKTYPLSYGPQSDGSLSPEYVIEKLGEIAGPDAVFVAGVGQHQMWAAQFIRYEKPRSWLNSGGLGTMGFAIPAAMGAKIALPGTEVWAIDGDGCFQMTNQELATCAVEGIPVKVALINNGNLGMVRQWQSLFYAERYSQTDLATHSHRIPDFVKLAEALGCVGLRCEREEDVVDVINQARAINDCPVVIDFIVGADAQVWPMVAAGTSNDEIQAARGIRPLFDDITEGHA,./data/raw/alphafold//AF-P9WG41-F1-model_v4.pdb,1253,5189,1573,699
+994,3549,3598,MSASQRHDRGAERILVINPGSTTTKVALFEGEVPLFDETVEHGKESLRAFPAVTDQFAFRLRAVKDVLEHHGVLDTPLDAVAGRGGLLAPMQGGTWRVGPAMLATLAEARHGEHPCNLGAALARHFADLHGVEAYIVDPVVTDEMDDVARYTGLPQIRRRSVFHALSHRAAARVAASRCGVAYEEGRFLVAHMGGGVSVAAHRCGRIVDVVNALDGDGPITAERTGRLPVLPVLDLIERGLQTFESMRRIVLREGGLWAHCGTNDLREVERRMETGDAAAAAIFDALAYTIAKELASLAPAVLGTARGGVTTVTAVVLTGGMARSVRLTSRLEAHLGWLGPMVVLPDVEEMRALTQGVLRVLRGEEVAKEYV,brenda,Q72EF0,CC(C)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(=O)OP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,2.94,0.084665470598901,44.0,7.4,2.7.2.7,881.0,0.4683473304121572,CC(C)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(=O)OP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.4683473304121572,CC(C)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__MSASQRHDRGAERILVINPGSTTTKVALFEGEVPLFDETVEHGKESLRAFPAVTDQFAFRLRAVKDVLEHHGVLDTPLDAVAGRGGLLAPMQGGTWRVGPAMLATLAEARHGEHPCNLGAALARHFADLHGVEAYIVDPVVTDEMDDVARYTGLPQIRRRSVFHALSHRAAARVAASRCGVAYEEGRFLVAHMGGGVSVAAHRCGRIVDVVNALDGDGPITAERTGRLPVLPVLDLIERGLQTFESMRRIVLREGGLWAHCGTNDLREVERRMETGDAAAAAIFDALAYTIAKELASLAPAVLGTARGGVTTVTAVVLTGGMARSVRLTSRLEAHLGWLGPMVVLPDVEEMRALTQGVLRVLRGEEVAKEYV,./data/raw/alphafold//AF-Q72EF0-F1-model_v4.pdb,1793,1466,3034,1782
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+1011,6366,6476,MRVLLTSFALDAHFNGSVPLAWALRAAGHEVRVASQPALTASITAAGLTAVPVGADPRLDEMVKGVGDAVLSHHADQSLDADTPGQLTPAFLQGWDTMMTATFYTLINDDPMVDDLVAFARGWEPDLILWEPFTFAGAVAAKVTGAAHARLLSFPDLFMSMRRAYLAQLGAAPAGPAGGNGTTHPDDSLGQWLEWTLGRYGVPFDEEAVTGQWSVDQVPRSFRPPSDRPVVGMRYVPYNGPGPAVVPDWLRVPPTRPRVCVTLGMTARTSEFPNAVPVDLVLKAVEGLDIEVVATLDAEERALLTHVPDNVRLVDHVPLHALLPTCAAIVHHGGAGTWSTALVEGVPQIAMGWIWDAIDRAQRQQALGAGLHLPSHEVTVEGLRGRLVRLLDEPSFTAAAARLRAEAESEPTPAQVVPVLERLTAQHRAREPRRPGGTSPCVS,sabio,Q9L4U6,CCC1(O)CC(O)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)C1C(=O)OC>>Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O,0.3,1.2512521717593472,25.0,7.5,2.4.1.326,33899.0,-0.5228787452803376,CCC1(O)CC(O)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)C1C(=O)OC,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O,1.1205739312058498,CCC1(O)CC(O)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)C1C(=O)OC__MRVLLTSFALDAHFNGSVPLAWALRAAGHEVRVASQPALTASITAAGLTAVPVGADPRLDEMVKGVGDAVLSHHADQSLDADTPGQLTPAFLQGWDTMMTATFYTLINDDPMVDDLVAFARGWEPDLILWEPFTFAGAVAAKVTGAAHARLLSFPDLFMSMRRAYLAQLGAAPAGPAGGNGTTHPDDSLGQWLEWTLGRYGVPFDEEAVTGQWSVDQVPRSFRPPSDRPVVGMRYVPYNGPGPAVVPDWLRVPPTRPRVCVTLGMTARTSEFPNAVPVDLVLKAVEGLDIEVVATLDAEERALLTHVPDNVRLVDHVPLHALLPTCAAIVHHGGAGTWSTALVEGVPQIAMGWIWDAIDRAQRQQALGAGLHLPSHEVTVEGLRGRLVRLLDEPSFTAAAARLRAEAESEPTPAQVVPVLERLTAQHRAREPRRPGGTSPCVS,./data/raw/alphafold//AF-Q9L4U6-F1-model_v4.pdb,3225,2041,3691,2544
+1012,1057,1083,MTQTNRVIIFDTTLRDGEQSPGAAMTKEEKIRVARQLEKLGVDIIEAGFAAASPGDFEAVNAIAKTITKSTVCSLSRAIERDIRQAGEAVAPAPKKRIHTFIATSPIHMEYKLKMKPKQVIEAAVKAVKIAREYTDDVEFSCEDALRSEIDFLAEICGAVIEAGATTINIPDTVGYSIPYKTEEFFRELIAKTPNGGKVVWSAHCHNDLGLAVANSLAALKGGARQVECTVNGLGERAGNASVEEIVMALKVRHDLFGLETGIDTTQIVPSSKLVSTITGYPVQPNKAIVGANAFSHESGIHQDGVLKHRETYEIMSAESVGWATNRLSLGKLSGRNAFKTKLADLGIELESEEALNAAFARFKELADKKREIFDEDLHALVSDEMGSMNAESYKFISQKISTETGEEPRADIVFSIKGEEKRASATGSGPVDAIFKAIESVAQSGAALQIYSVNAVTQGTESQGETSVRLARGNRVVNGQGADTDVLVATAKAYLSALSKLEFSAAKPKAQGSGTI,brenda,Q9JZG1,CC(=O)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)=NCCS.CC(O)(CC(=O)O)C(=O)O,1.5,0.0,25.0,7.5,2.3.3.13,487.0,0.1760912590556812,CC(=O)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)=NCCS.CC(O)(CC(=O)O)C(=O)O,0.1760912590556812,CC(=O)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__MTQTNRVIIFDTTLRDGEQSPGAAMTKEEKIRVARQLEKLGVDIIEAGFAAASPGDFEAVNAIAKTITKSTVCSLSRAIERDIRQAGEAVAPAPKKRIHTFIATSPIHMEYKLKMKPKQVIEAAVKAVKIAREYTDDVEFSCEDALRSEIDFLAEICGAVIEAGATTINIPDTVGYSIPYKTEEFFRELIAKTPNGGKVVWSAHCHNDLGLAVANSLAALKGGARQVECTVNGLGERAGNASVEEIVMALKVRHDLFGLETGIDTTQIVPSSKLVSTITGYPVQPNKAIVGANAFSHESGIHQDGVLKHRETYEIMSAESVGWATNRLSLGKLSGRNAFKTKLADLGIELESEEALNAAFARFKELADKKREIFDEDLHALVSDEMGSMNAESYKFISQKISTETGEEPRADIVFSIKGEEKRASATGSGPVDAIFKAIESVAQSGAALQIYSVNAVTQGTESQGETSVRLARGNRVVNGQGADTDVLVATAKAYLSALSKLEFSAAKPKAQGSGTI,./data/raw/alphafold//AF-Q9JZG1-F1-model_v4.pdb,1685,5201,1586,713
+1013,11061,11216,MSPVSFARQRYTTKAYDASRQVDQAIIDELLELLRLSPSSVNSQPWHFVVASTAEGKARLAKGAQGGFAYNQPKILDASHVILICARRDLDEAYLAEVLQQEAEDGRFRDDAARTTQHNTRSSYVELHRGLGDMQHWTEKQAYLALGTLLLGAAAKGIDATPMEGIDRQALDEELGLAAQGLSSVVAVALGYRSDSDFNAALPKSRLPAERVLTRL,uniprot_search,A0A5N7Y8W0,C[C@H](O)[C@H](O)[C@H]1CN=c2[nH]c(=N)nc(O)c2=N1.N=C(O)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)[C@H](O)[C@H]1CNc2[nH]c(=N)nc(O)c2N1.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)c1,20.0,0.0,37.0,7.8,1.5.1.34,306.0,1.3010299956639813,C[C@H](O)[C@H](O)[C@H]1CN=c2[nH]c(=N)nc(O)c2=N1.N=C(O)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)[C@H](O)[C@H]1CNc2[nH]c(=N)nc(O)c2N1.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)c1,1.3010299956639813,C[C@H](O)[C@H](O)[C@H]1CN=c2[nH]c(=N)nc(O)c2=N1.N=C(O)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+]__MSPVSFARQRYTTKAYDASRQVDQAIIDELLELLRLSPSSVNSQPWHFVVASTAEGKARLAKGAQGGFAYNQPKILDASHVILICARRDLDEAYLAEVLQQEAEDGRFRDDAARTTQHNTRSSYVELHRGLGDMQHWTEKQAYLALGTLLLGAAAKGIDATPMEGIDRQALDEELGLAAQGLSSVVAVALGYRSDSDFNAALPKSRLPAERVLTRL,./data/raw/alphafold//AF-A0A5N7Y8W0-F1-model_v4.pdb,3799,3912,1748,3555
+1014,7267,7389,MYQRSLFRGVAQGLKRSSVRFQSTSSGSSNGNFFLRHWKLLSVIGSFTAGVAIYDMSDVRSFIHGRIEMPLFHAFTTPEFSHRVAILAASWGITPKDRVADDPSLAVEVWGKKFCNPIGLAAGFDKQADAISGLLNFGFSYLEIGSVTPKPQPGNPKPRYFRLKPDLSVINRYGFNSIGHDAILAKIQKRVRKYIAKTSPQLLKQFDANPASCTDPAVLGVPRSLIPNKFLGINLGKNKNGNEIEDYVEGVRTFGNFADILVINVSSPNTPGLRNLQKKSALSTLLTAVVSERNKLNSPHPPVLVKIAPDLNEEELTDIADVLKKCKIDGVIVGNTTVQRPKTLKSTSHVEETGGLSGPPLKPIALNTLRTLRKHLSSDIPIIGCGGISSGKDAIEYARAGATMVQVYTALGYDGPVIAHKIKQEILAELKGKRWVDIIGKEE,sabio,P32747,CCCCCCCCCCC1=C(C)C(=O)C(OC)=C(OC)C1=O.O=C1CC(C(=O)O)NC(=O)N1>>CCCCCCCCCCc1c(C)c(O)c(OC)c(OC)c1O.O=C(O)c1cc(=O)[nH]c(=O)[nH]1,1.0,5.908166880169129e-15,30.0,8.0,1.3.5.2,4896.0,0.0,CCCCCCCCCCC1=C(C)C(=O)C(OC)=C(OC)C1=O.O=C1CC(C(=O)O)NC(=O)N1,CCCCCCCCCCc1c(C)c(O)c(OC)c(OC)c1O.O=C(O)c1cc(=O)[nH]c(=O)[nH]1,0.2304489213782739,CCCCCCCCCCC1=C(C)C(=O)C(OC)=C(OC)C1=O.O=C1CC(C(=O)O)NC(=O)N1__MYQRSLFRGVAQGLKRSSVRFQSTSSGSSNGNFFLRHWKLLSVIGSFTAGVAIYDMSDVRSFIHGRIEMPLFHAFTTPEFSHRVAILAASWGITPKDRVADDPSLAVEVWGKKFCNPIGLAAGFDKQADAISGLLNFGFSYLEIGSVTPKPQPGNPKPRYFRLKPDLSVINRYGFNSIGHDAILAKIQKRVRKYIAKTSPQLLKQFDANPASCTDPAVLGVPRSLIPNKFLGINLGKNKNGNEIEDYVEGVRTFGNFADILVINVSSPNTPGLRNLQKKSALSTLLTAVVSERNKLNSPHPPVLVKIAPDLNEEELTDIADVLKKCKIDGVIVGNTTVQRPKTLKSTSHVEETGGLSGPPLKPIALNTLRTLRKHLSSDIPIIGCGGISSGKDAIEYARAGATMVQVYTALGYDGPVIAHKIKQEILAELKGKRWVDIIGKEE,./data/raw/alphafold//AF-P32747-F1-model_v4.pdb,3175,2146,3822,2686
+1015,8747,8884,MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVKYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDHWEPELNEAIPNDERDTTTPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGASERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,brenda,Q8KQ59,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1ccco1.O>>,2.0,99.77447305629605,30.0,7.0,3.5.2.6,573.0,0.3010299956639812,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1ccco1.O,,0.3010299956639812,CO/N=C(/C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1ccco1.O__MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVKYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDHWEPELNEAIPNDERDTTTPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGASERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,./data/raw/alphafold//AF-Q8KQ59-F1-model_v4.pdb,1458,402,35,1126
+1016,20251,20543,MLSNARIIAAGCIAAGSLVAAGPCDIYSSGGTPCVAAHSTTRALFSAYTGPLYQVKRGSDGATTAISPLSSGVANAAAQDAFCAGTTCLITIIYDQSGRGNHLREAPPGGFSGPESNGYDNLASAIGAPVTLNGQKAYGVFVSPGTGYRNNAASGTAKGDAAEGMYAVLDGTHYNGACCFDYGNAETNSRDTGNGHMEAIYFGDSTVWGTGSGKGPWIMADLENGLFSGSSPGNNAGDPSISYRFVTAAIKGQPNQWAIRGGNAASGSLSTFYSGARPQVSGYNPMSKEGAIILGIGGDNSNGGQGTFYEGVMTSGYPSDATENSVQANIVAARYAVAPLTSGPALTVGSSISLRATTACCTTRYIAHSGSTVNTQVVSSSSATALKQQASWTVRAGLANNACFSFESQDTSGSYIRHSNFGLVLNANDGSKLFAEDATFCTQAGINGQGSSIRSWSYPTRYFRHYNNTLYIASNGGVHVFDATAAFNDDVSFVVSGGFA,uniprot_search,P48792,O.O=[N+]([O-])c1ccc([N+](=O)[O-])c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)c1>>O=[N+]([O-])c1ccc([N+](=O)[O-])c(O)c1.OC[C@@H]1O[C@@H](O)[C@H](O)[C@H]1O,8.25,0.0,25.0,3.0,3.2.1.55,97093.0,0.9164539485499252,O.O=[N+]([O-])c1ccc([N+](=O)[O-])c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)c1,O=[N+]([O-])c1ccc([N+](=O)[O-])c(O)c1.OC[C@@H]1O[C@@H](O)[C@H](O)[C@H]1O,0.9164539485499252,O.O=[N+]([O-])c1ccc([N+](=O)[O-])c(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
+1017,18936,19220,MPIKKPCLKLNLDSLNVVRSEIPQMLSANERLKNNFNILYNQIRQYPAYYFKVASNVPTYSDICQSFSVMYQGFQIVNHSGDVFIHACRENPQSKGDFVGDKFHISIAREQVPLAFQILSGLLFSEDSPIDKWKITDMNRVSQQSRVGIGAQFTLYVKSDQECSQYSALLLHKIRQFIMCLESNLLRSKIAPGEYPASDVRPEDWKYVSYRNELRSDRDGSERQEQMLREEPFYRLMIE,sabio,Q8VSP9,O>>*C(N)C(=O)NC(*)C(=O)O.O=P(O)(O)O,0.7,85.01489203276248,30.0,7.4,4.2.3.-,623.0,-0.1549019599857432,O,*C(N)C(=O)NC(*)C(=O)O.O=P(O)(O)O,0.1072099696478683,O__MPIKKPCLKLNLDSLNVVRSEIPQMLSANERLKNNFNILYNQIRQYPAYYFKVASNVPTYSDICQSFSVMYQGFQIVNHSGDVFIHACRENPQSKGDFVGDKFHISIAREQVPLAFQILSGLLFSEDSPIDKWKITDMNRVSQQSRVGIGAQFTLYVKSDQECSQYSALLLHKIRQFIMCLESNLLRSKIAPGEYPASDVRPEDWKYVSYRNELRSDRDGSERQEQMLREEPFYRLMIE,./data/raw/alphafold//AF-Q8VSP9-F1-model_v4.pdb,210,2726,5037,5889
+1018,4507,4562,MGTKGKVIKCKAAIAWEAGKPLCIEEVEVAPPKAHEVRIQIIATSLCHTDATVIDSKFEGLAFPVIVGHEAAGIVESIGPGVTNVKPGDKVIPLYAPLCRKCKFCLSPLTNLCGKISNLKSPASDQQLMEDKTSRFTCKGKPVYHFFGTSTFSQYTVVSDINLAKIDDDANLERVCLLGCGFSTGYGAAINNAKVTPGSTCAVFGLGGVGLSAVMGCKAAGASRIIGIDINSEKFVKAKALGATDCLNPRDLHKPIQEVIIELTKGGVDFALDCAGGSETMKAALDCTTAGWGSCTFIGVAAGSKGLTIFPEELIIGRTINGTFFGGWKSVDSIPKLVTDYKNKKFNLDALVTHTLPFDKISEAFDLMNQGKSVRTILIF,sabio,P08319,CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CCO.NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1>>CC(C=CC=C(C)C=CC1=C(C)CCCC1(C)C)=CC=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,11400.0,0.0530028089385531,25.0,7.5,1.1.1.1,9606.0,4.056904851336473,CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CCO.NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,CC(C=CC=C(C)C=CC1=C(C)CCCC1(C)C)=CC=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,4.056904851336473,CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CCO.NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1__MGTKGKVIKCKAAIAWEAGKPLCIEEVEVAPPKAHEVRIQIIATSLCHTDATVIDSKFEGLAFPVIVGHEAAGIVESIGPGVTNVKPGDKVIPLYAPLCRKCKFCLSPLTNLCGKISNLKSPASDQQLMEDKTSRFTCKGKPVYHFFGTSTFSQYTVVSDINLAKIDDDANLERVCLLGCGFSTGYGAAINNAKVTPGSTCAVFGLGGVGLSAVMGCKAAGASRIIGIDINSEKFVKAKALGATDCLNPRDLHKPIQEVIIELTKGGVDFALDCAGGSETMKAALDCTTAGWGSCTFIGVAAGSKGLTIFPEELIIGRTINGTFFGGWKSVDSIPKLVTDYKNKKFNLDALVTHTLPFDKISEAFDLMNQGKSVRTILIF,./data/raw/alphafold//AF-P08319-F1-model_v4.pdb,1323,1999,3215,1992
+1019,9609,9755,MGILSYLCYSLFYLSIFFIIRLLFQSRKFKNLPPGPTSLPIIGNLHHLKRPLNRTFKALTEKYGNVISLWFGSRLVVVVSSLSEFQECFTKNDVVLANRPRFLSGKYIFYNYTTLGSTSYGEHWRNLRRITSLDVLSNHRINNFAPIRRDETQRLIKKLAEDSSTKFAEVELTFRFFDMTFNNIMRMISGKRYYGDDCDISEVQEASQFRDMVSELLQLSGANNKTDFMPLLKFLDFENLEKRVKRIGEKNDVFLSGLLQEQRSKKERTNTMIDHLLNMQESQPEYYTDTIIKGLCLAMLLAGTDSSAVTLEWTMSNILNYPEVLKKVRDEVDTHVGQDRLVDESDLPKLTYLRNVIYETLRLYTPAPLLLPHSTADECIMGGYKVPRDTIVLINAWAIHRDPETWSEATTFKPERFDKKGELEKMIAFGMGRRACPGEGLALRAISMTLALLVQCFDWKRINDEKIDMSERDGFTMTKLLPLKAMCKTRPVVNKVFK,brenda,Q6WNR0,COc1ccc(-c2coc3cc(O)ccc3c2=O)cc1.O=O>>COc1ccc(-c2coc3cc(O)ccc3c2=O)c(O)c1.O,0.015,10000000.0,24.0,8.0,1.14.14.90,3880.0,-1.8239087409443189,COc1ccc(-c2coc3cc(O)ccc3c2=O)cc1.O=O,COc1ccc(-c2coc3cc(O)ccc3c2=O)c(O)c1.O,-1.8239087409443189,COc1ccc(-c2coc3cc(O)ccc3c2=O)cc1.O=O__MGILSYLCYSLFYLSIFFIIRLLFQSRKFKNLPPGPTSLPIIGNLHHLKRPLNRTFKALTEKYGNVISLWFGSRLVVVVSSLSEFQECFTKNDVVLANRPRFLSGKYIFYNYTTLGSTSYGEHWRNLRRITSLDVLSNHRINNFAPIRRDETQRLIKKLAEDSSTKFAEVELTFRFFDMTFNNIMRMISGKRYYGDDCDISEVQEASQFRDMVSELLQLSGANNKTDFMPLLKFLDFENLEKRVKRIGEKNDVFLSGLLQEQRSKKERTNTMIDHLLNMQESQPEYYTDTIIKGLCLAMLLAGTDSSAVTLEWTMSNILNYPEVLKKVRDEVDTHVGQDRLVDESDLPKLTYLRNVIYETLRLYTPAPLLLPHSTADECIMGGYKVPRDTIVLINAWAIHRDPETWSEATTFKPERFDKKGELEKMIAFGMGRRACPGEGLALRAISMTLALLVQCFDWKRINDEKIDMSERDGFTMTKLLPLKAMCKTRPVVNKVFK,./data/raw/alphafold//AF-Q6WNR0-F1-model_v4.pdb,3555,3511,1283,3232
+1020,18215,18475,MPLELTQSRVQKIWVPVDHRPSLPRSCGPKLTNSPTVIVMVGLPARGKTYISKKLTRYLNWIGVPTKVFNVGEYRREAVKQYSSYNFFRPDNEEAMKVRKQCALAALRDVKSYLAKEGGQIAVFDATNTTRERRHMILHFAKENDFKAFFIESVCDDPTVVASNIMEVKISSPDYKDCNSAEAMDDFMKRISCYEASYQPLDPDKCDRDLSLIKVIDVGRRFLVNRVQDHIQSRIVYYLMNIHVQPRTIYLCRHGENEHNLQGRIGGDSGLSSRGKKFASALSKFVEEQNLKDLRVWTSQLKSTIQTAEALRLPYEQWKALNEIDAGVCEELTYEEIRDTYPEEYALREQDKYYYRYPTGESYQDLVQRLEPVIMELERQENVLVICHQAVLRCLLAYFLDKSAEEMPYLKCPLHTVLKLTPVAYGCRVESIYLNVESVCTHRERSEDAKKGPNPLMRRNSVTPLASPEPTKKPRINSFEEHVASTSAALPSCLPPEVPTQLPGQNMKGSRSSADSSRKH,sabio,Q16875,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)(CO)C(O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(CO)(OP(=O)(O)O)C(O)C1O,0.14,0.0,25.0,8.5,2.7.1.105,9606.0,-0.8538719643217619,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)(CO)C(O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(CO)(OP(=O)(O)O)C(O)C1O,-0.8538719643217619,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)(CO)C(O)C1O__MPLELTQSRVQKIWVPVDHRPSLPRSCGPKLTNSPTVIVMVGLPARGKTYISKKLTRYLNWIGVPTKVFNVGEYRREAVKQYSSYNFFRPDNEEAMKVRKQCALAALRDVKSYLAKEGGQIAVFDATNTTRERRHMILHFAKENDFKAFFIESVCDDPTVVASNIMEVKISSPDYKDCNSAEAMDDFMKRISCYEASYQPLDPDKCDRDLSLIKVIDVGRRFLVNRVQDHIQSRIVYYLMNIHVQPRTIYLCRHGENEHNLQGRIGGDSGLSSRGKKFASALSKFVEEQNLKDLRVWTSQLKSTIQTAEALRLPYEQWKALNEIDAGVCEELTYEEIRDTYPEEYALREQDKYYYRYPTGESYQDLVQRLEPVIMELERQENVLVICHQAVLRCLLAYFLDKSAEEMPYLKCPLHTVLKLTPVAYGCRVESIYLNVESVCTHRERSEDAKKGPNPLMRRNSVTPLASPEPTKKPRINSFEEHVASTSAALPSCLPPEVPTQLPGQNMKGSRSSADSSRKH,./data/raw/alphafold//AF-Q16875-F1-model_v4.pdb,51,2523,2815,5661
+1021,8494,8625,MASTPRIVIIGAGIVGTNLADELVTRGWNNITVLDQGPLNMPGGSTSHAPGLVFQTNPSKTMASFAKYTVEKLLSLTEDGVSCFNQVGGLEVATTETRLADLKRKLGYAAAWGIEGRLLSPAECQELYPLLDGENILGGLHVPSDGLASAARAVQLLIKRTESAGVTYRGSTTVTGIEQSGGRVTGVQTADGVIPADIVVSCAGFWGAKIGAMIGMAVPLLPLAHQYVKTTPVPAQQGRNDQPNGARLPILRHQDQDLYYREHGDRYGIGSYAHRPMPVDVDTLGAYAPETVSEHHMPSRLDFTLEDFLPAWEATKQLLPALADSEIEDGFNGIFSFTPDGGPLLGESKELDGFYVAEAVWVTHSAGVAKAMAELLTTGRSETDLGECDITRFEDVQLTPEYVSETSQQNFVEIYDVLHPLQPRLSPRNLRVSPFHARHKELGAFFLEAGGWERPYWFEANAALLKEMPAEWLPPARDAWSGMFSSPIAAAEAWKTRTAVAMYDMTPLKRLEVSGPGALKLLQELTTADLAKKPGAVTYTLLLDHAGGVRSDITVARLSEDTFQLGANGNIDTAYFERAARHQTQSGSATDWVQVRDTTGGTCCIGLWGPLARDLVSKVSDDDFTNDGLKYFRAKNVVIGGIPVTAMRLSYVGELGWELYTSADNGQRLWDALWQAGQPFGVIAAGRAAFSSLRLEKGYRSWGTDMTTEHDPFEAGLGFAVKMAKESFIGKGALEGRTEEASARRLRCLTIDDGRSIVLGKEPVFYKEQAVGYVTSAAYGYTVAKPIAYSYLPGTVSVGDSVDIEYFGRRITATVTEDPLYDPKMTRLRG,uniprot_search,Q9AGP8,CN(C)CC(=O)O.O.O=O>>C=O.CNCC(=O)O.OO,10.6,0.0,25.0,8.5,1.5.3.10,1665.0,1.0253058652647702,CN(C)CC(=O)O.O.O=O,C=O.CNCC(=O)O.OO,1.0253058652647702,CN(C)CC(=O)O.O.O=O__MASTPRIVIIGAGIVGTNLADELVTRGWNNITVLDQGPLNMPGGSTSHAPGLVFQTNPSKTMASFAKYTVEKLLSLTEDGVSCFNQVGGLEVATTETRLADLKRKLGYAAAWGIEGRLLSPAECQELYPLLDGENILGGLHVPSDGLASAARAVQLLIKRTESAGVTYRGSTTVTGIEQSGGRVTGVQTADGVIPADIVVSCAGFWGAKIGAMIGMAVPLLPLAHQYVKTTPVPAQQGRNDQPNGARLPILRHQDQDLYYREHGDRYGIGSYAHRPMPVDVDTLGAYAPETVSEHHMPSRLDFTLEDFLPAWEATKQLLPALADSEIEDGFNGIFSFTPDGGPLLGESKELDGFYVAEAVWVTHSAGVAKAMAELLTTGRSETDLGECDITRFEDVQLTPEYVSETSQQNFVEIYDVLHPLQPRLSPRNLRVSPFHARHKELGAFFLEAGGWERPYWFEANAALLKEMPAEWLPPARDAWSGMFSSPIAAAEAWKTRTAVAMYDMTPLKRLEVSGPGALKLLQELTTADLAKKPGAVTYTLLLDHAGGVRSDITVARLSEDTFQLGANGNIDTAYFERAARHQTQSGSATDWVQVRDTTGGTCCIGLWGPLARDLVSKVSDDDFTNDGLKYFRAKNVVIGGIPVTAMRLSYVGELGWELYTSADNGQRLWDALWQAGQPFGVIAAGRAAFSSLRLEKGYRSWGTDMTTEHDPFEAGLGFAVKMAKESFIGKGALEGRTEEASARRLRCLTIDDGRSIVLGKEPVFYKEQAVGYVTSAAYGYTVAKPIAYSYLPGTVSVGDSVDIEYFGRRITATVTEDPLYDPKMTRLRG,./data/raw/alphafold//AF-Q9AGP8-F1-model_v4.pdb,3435,2340,1059,2962
+1022,14258,14450,MKAIVVNPPNKGVHVKEINDIHRSLTADEVLVKTIANGICGTDRGIVSGLLKFSRPPNGKNDLVLGHENLGQVIDKGPEVHGLGKGDYVVSIVRRGCGKCSNCLAGRQDFCETGEFVEAGIRGLDGFMREFYIDNASYLVKIPDEIVDIAVLLEPLSNVVKAYSELMLVQRRMTWWCKDGSYNCRNVAIVGSGPIGLMFSLMFSIQGFNAFVLNKRDPFPIEAEIVEKSNAKFINTNKDRLPNTIDLLIDTSGYPSAFIPLMSRLNKNSAIILFGTTGGEKFEVNADLITYLVENNILLFGSVNASKKDFENGVNYLTIWKYRYPSVLNRMITRVIKPEQAPEVLYTKPKGEIKTVISWV,brenda,Q97U21,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]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=C1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.[H+],68.23,0.0,70.0,6.5,1.1.1.47,2287.0,1.8339753712799065,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]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=C1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.[H+],1.8339753712799065,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]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O__MKAIVVNPPNKGVHVKEINDIHRSLTADEVLVKTIANGICGTDRGIVSGLLKFSRPPNGKNDLVLGHENLGQVIDKGPEVHGLGKGDYVVSIVRRGCGKCSNCLAGRQDFCETGEFVEAGIRGLDGFMREFYIDNASYLVKIPDEIVDIAVLLEPLSNVVKAYSELMLVQRRMTWWCKDGSYNCRNVAIVGSGPIGLMFSLMFSIQGFNAFVLNKRDPFPIEAEIVEKSNAKFINTNKDRLPNTIDLLIDTSGYPSAFIPLMSRLNKNSAIILFGTTGGEKFEVNADLITYLVENNILLFGSVNASKKDFENGVNYLTIWKYRYPSVLNRMITRVIKPEQAPEVLYTKPKGEIKTVISWV,./data/raw/alphafold//AF-Q97U21-F1-model_v4.pdb,2361,4732,4779,4619
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+1024,20199,20488,MATITTLASSVPLFRPYSFPGGSSRKPKKDNLSIKPPATSSLKVNAKLASADDTSSNFNKDNWLASADELSRSFPPGFLFGGGSASYQYEGAVKEGGRTPSIWDTFAHEFPDKIADGSNGDVAVDFYHRYKDDVKLMKKIGVNGFRFSISWTRILPSGKLCGGVNKEGVAFYNSLINELLANGIEPFVTIFHWDLPQGLENEYDGFLSGQIVNDYRDYAEVCFQEFGDRVKFWTTLNEPWTFCYNGYVNGSFAPGRCSTCTAGNSGTEPYLVAHNLLLSHAAVAQLYKNKYQASQKGQIGIVLVCFWMVPYSDCPYDCEAAQRALDFMLGWFLHPLTYGDYPESMRHLVGERLPQFTEMQAMMMKGSIDFLGLNYYTSIYAANNESPNPHDISYTTDSRVNLFQKRDGILIGPATGTPAFCFCPEGIRDLLVYTKEKYNNPIIYITECGLAEANINTVDQGVKDVERVEFYYEHLKFLRSAIKKGVNVKGFFTWSLLDDWEWNSGFNVRFGIVYIDHEDGLKRYLKYSALWFKKLFGK,uniprot_search,Q75W17,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc1>>O=[N+]([O-])c1ccc(O)cc1.O[C@@H]1[C@@H](O)[C@H](O)O[C@H](CO[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,0.098,0.0,37.0,5.0,3.2.1.161,237940.0,-1.0087739243075051,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc1,O=[N+]([O-])c1ccc(O)cc1.O[C@@H]1[C@@H](O)[C@H](O)O[C@H](CO[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O,-1.0087739243075051,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc1__MATITTLASSVPLFRPYSFPGGSSRKPKKDNLSIKPPATSSLKVNAKLASADDTSSNFNKDNWLASADELSRSFPPGFLFGGGSASYQYEGAVKEGGRTPSIWDTFAHEFPDKIADGSNGDVAVDFYHRYKDDVKLMKKIGVNGFRFSISWTRILPSGKLCGGVNKEGVAFYNSLINELLANGIEPFVTIFHWDLPQGLENEYDGFLSGQIVNDYRDYAEVCFQEFGDRVKFWTTLNEPWTFCYNGYVNGSFAPGRCSTCTAGNSGTEPYLVAHNLLLSHAAVAQLYKNKYQASQKGQIGIVLVCFWMVPYSDCPYDCEAAQRALDFMLGWFLHPLTYGDYPESMRHLVGERLPQFTEMQAMMMKGSIDFLGLNYYTSIYAANNESPNPHDISYTTDSRVNLFQKRDGILIGPATGTPAFCFCPEGIRDLLVYTKEKYNNPIIYITECGLAEANINTVDQGVKDVERVEFYYEHLKFLRSAIKKGVNVKGFFTWSLLDDWEWNSGFNVRFGIVYIDHEDGLKRYLKYSALWFKKLFGK,./data/raw/alphafold//AF-Q75W17-F1-model_v4.pdb,1219,3229,5397,6278
+1025,15463,15687,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=Cc1ccccc1.[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=Cc1ccccc1,4920.0,6.466129242096472e-15,25.0,7.0,1.1.1.-,3702.0,3.691965102767361,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=Cc1ccccc1.[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=Cc1ccccc1,3.691965102767361,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=Cc1ccccc1.[H]__MANAITFFKLNTGAKFPSVGLGTWQASPGLVGDAVAAAVKIGYRHIDCAQIYGNEKEIGAVLKKLFEDRVVKREDLFITSKLWCTDHDPQDVPEALNRTLKDLQLEYVDLYLIHWPARIKKGSVGIKPENLLPVDIPSTWKAMEALYDSGKARAIGVSNFSTKKLADLLELARVPPAVNQVECHPSWRQTKLQEFCKSKGVHLSAYSPLGSPGTTWLKSDVLKNPILNMVAEKLGKSPAQVALRWGLQMGHSVLPKSTNEGRIKENFNVFDWSIPDYMFAKFAEIEQARLVTGSFLVHETLSPYKSIEELWDGEI,./data/raw/alphafold//AF-Q0PGJ6-F1-model_v4.pdb,1329,3901,224,242
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+1039,21699,22024,MPSSGDAAGRRPHVVLIPSAGMGHLVPFGRLAVALSSGHGCDVSLVTVLPTVSTAESKHLDALFDAFPAVRRLDFELAPFDASEFPGADPFFLRFEAMRRSAPLLGPLLTGAGASALATDIALTSVVIPVAKEQGLPCHILFTASAAMLSLCAYFPTYLDANAGGGGGVGDVDIPGVYRIPKASIPQALHDPNHLFTRQFVANGRSLTSAAGILVNTFDALEPEAVAALQQGKVASGFPPVFAVGPLLPASNQAKDPQANYMEWLDAQPARSVVYVSFGSRKAISREQLRELAAGLEGSGHRFLWVVKSTVVDRDDAAELGELLDEGFLERVEKRGLVTKAWVDQEEVLKHESVALFVSHCGWNSVTEAAASGVPVLALPRFGDQRVNSGVVARAGLGVWADTWSWEGEAGVIGAEEISEKVKAAMADEALRMKAASLAEAAAKAVAGGGSSHRCLAEFARLCQGGTCRTN,brenda,C3W7B0,O=C(c1ccccc1)c1c(O)cc(O)cc1O.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,0.11,32.6509009871164,25.0,7.8,2.4.1.360,39946.0,-0.958607314841775,O=C(c1ccccc1)c1c(O)cc(O)cc1O.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,-0.958607314841775,O=C(c1ccccc1)c1c(O)cc(O)cc1O.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
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+1054,10928,11083,MSRRNFVVLLILAYGLVLTTCSRPSSRVYIVEVLNEFPHDPYAFTQGLVYAENDTLFESTGLYGRSSVRQVALQTGKVENIHKMDDSYFGEGLTLLNEKLYQVVWLKNIGFIYDRRTLSNIKNFTHQMKDGWGLATDGKILYGSDGTSILYEIDPHTFKLIKKHNVKYNGHRVIRLNELEYINGEVWANIWQTDCIARISAKDGTLLGWILLPNLRKKLIDEGFRDIDVLNGIAWDQENKRIFVTGKLWPKLFEIKLHLVRHRIPDGYIERHCLNLRDNTLSLKTDID,uniprot_search,O81226,C[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N)CCC(=N)O)C(O)=N[C@@H](Cc1ccccc1)C(=N)O>>C[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H]1CCC(O)=N1)C(O)=N[C@@H](Cc1ccccc1)C(=N)O.N,48.5,0.0,30.0,8.0,2.3.2.5,3649.0,1.6857417386022635,C[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N)CCC(=N)O)C(O)=N[C@@H](Cc1ccccc1)C(=N)O,C[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@H]1CCC(O)=N1)C(O)=N[C@@H](Cc1ccccc1)C(=N)O.N,1.6857417386022635,C[C@H](N=C(O)[C@H](CCC(=O)O)N=C(O)[C@@H](N)CCC(=N)O)C(O)=N[C@@H](Cc1ccccc1)C(=N)O__MSRRNFVVLLILAYGLVLTTCSRPSSRVYIVEVLNEFPHDPYAFTQGLVYAENDTLFESTGLYGRSSVRQVALQTGKVENIHKMDDSYFGEGLTLLNEKLYQVVWLKNIGFIYDRRTLSNIKNFTHQMKDGWGLATDGKILYGSDGTSILYEIDPHTFKLIKKHNVKYNGHRVIRLNELEYINGEVWANIWQTDCIARISAKDGTLLGWILLPNLRKKLIDEGFRDIDVLNGIAWDQENKRIFVTGKLWPKLFEIKLHLVRHRIPDGYIERHCLNLRDNTLSLKTDID,./data/raw/alphafold//AF-O81226-F1-model_v4.pdb,1595,1182,1656,1382
+1055,2361,2394,MGIKLPTLEDLREISKQFNLDLEDEELKSFLQLLKLQLESYERLDSLPDYTPRVKYQRTLGRPPMKEENPYGALVWITSIKGKEEGKLKGKRICIKDNVMIAGIPMLNGSKMLEGFVPHMDATVVSRILDEAGEIVAKTTCEDLCFSGGSHTSYPWPVLNPRNPEYMAGGSSSGSAVAVASGYCDMAVGGDQGGSIRIPSSWVGIYGLKPTHGLVPYTGAFSIEPTLDHLGPMANTVKDVALLLEVIAGRDELDSRQPDSLPPPPVKPYSKLIDGDVKDMKVGIVKEGFNWSNSEKDVDELVLDSAKKLEDYGIKVEDTSIPLHRMGLDIWTPIAIEGATATMILGSGVGWGRKGLFETQIADFFGNSLKSRARDLPNTVKGVLMLGYLMIKMYNNRYYAKARNLSIVLKEAYDSALRKYDALIMPTTPMKAMRYKSEPGFDEYFIMALGMINNTAPFDVTGHPAMNIPVGYSNGLPVGLMIIGRHFEEDKVLKLANVFERIKK,brenda,P95896,CC(=O)c1ccccc1N.O>>Cc1ccccc1C(=O)O.N,0.3,2.7740946600819892e-14,70.0,7.5,3.5.1.4,2287.0,-0.5228787452803376,CC(=O)c1ccccc1N.O,Cc1ccccc1C(=O)O.N,-0.3979400086720376,CC(=O)c1ccccc1N.O__MGIKLPTLEDLREISKQFNLDLEDEELKSFLQLLKLQLESYERLDSLPDYTPRVKYQRTLGRPPMKEENPYGALVWITSIKGKEEGKLKGKRICIKDNVMIAGIPMLNGSKMLEGFVPHMDATVVSRILDEAGEIVAKTTCEDLCFSGGSHTSYPWPVLNPRNPEYMAGGSSSGSAVAVASGYCDMAVGGDQGGSIRIPSSWVGIYGLKPTHGLVPYTGAFSIEPTLDHLGPMANTVKDVALLLEVIAGRDELDSRQPDSLPPPPVKPYSKLIDGDVKDMKVGIVKEGFNWSNSEKDVDELVLDSAKKLEDYGIKVEDTSIPLHRMGLDIWTPIAIEGATATMILGSGVGWGRKGLFETQIADFFGNSLKSRARDLPNTVKGVLMLGYLMIKMYNNRYYAKARNLSIVLKEAYDSALRKYDALIMPTTPMKAMRYKSEPGFDEYFIMALGMINNTAPFDVTGHPAMNIPVGYSNGLPVGLMIIGRHFEEDKVLKLANVFERIKK,./data/raw/alphafold//AF-P95896-F1-model_v4.pdb,1085,655,336,378
+1056,18808,19085,MDTPRPQLLDFQFHQNNDSFTLHFQQRLILTHSKDNPCLWIGSGIADIDMFRGNFSIKDKLQEKIALTDAIVSQSPDGWLIHFSRGSDISATLNISADDQGRLLLELQNDNLNHNRIWLRLAAQPEDHIYGCGEQFSYFDLRGKPFPLWTSEQGVGRNKQTYVTWQADCKENAGGDYYWTFFPQPTFVSTQKYYCHVDNSCYMNFDFSAPEYHELALWEDKATLRFECADTYISLLEKLTALLGRQPELPDWIYDGVTLGIQGGTEVCQKKLDTMRNAGVKVNGIWAQDWSGIRMTSFGKRVMWNWKWNSENYPQLDSRIKQWNQEGVQFLAYINPYVASDKDLCEEAAQHGYLAKDASGGDYLVEFGEFYGGVVDLTNPEAYAWFKEVIKKNMIELGCGGWMADFGEYLPTDTYLHNGVSAEIMHNAWPALWAKCNYEALEETGKLGEILFFMRAGSTGSQKYSTMMWAGDQNVDWSLDDGLASVVPAALSLAMTGHGLHHSDIGGYTTLFEMKRSKELLLRWCDFSAFTPMMRTHEGNRPGDNWQFDGDAETIAHFARMTTVFTTLKPYLKEAVALNAKSGLPVMRPLFLHYEDDAHTYTLKYQYLLGRDILVAPVHEEGRSDWTLYLPEDNWVHAWTGEAFRGGEVTVNAPIGKPPVFYRADSEWAALFASLKSI,sabio,P32138,O>>C([C@@H]1[C@H]([C@@H]([C@H](C(O1)O)O)O)O)S(=O)(=O)O.O=[N+]([O-])c1ccc(O)cc1,14.3,90.7964786527019,23.0,7.2,3.2.1.199,562.0,1.155336037465062,O,C([C@@H]1[C@H]([C@@H]([C@H](C(O1)O)O)O)O)S(=O)(=O)O.O=[N+]([O-])c1ccc(O)cc1,1.155336037465062,O__MDTPRPQLLDFQFHQNNDSFTLHFQQRLILTHSKDNPCLWIGSGIADIDMFRGNFSIKDKLQEKIALTDAIVSQSPDGWLIHFSRGSDISATLNISADDQGRLLLELQNDNLNHNRIWLRLAAQPEDHIYGCGEQFSYFDLRGKPFPLWTSEQGVGRNKQTYVTWQADCKENAGGDYYWTFFPQPTFVSTQKYYCHVDNSCYMNFDFSAPEYHELALWEDKATLRFECADTYISLLEKLTALLGRQPELPDWIYDGVTLGIQGGTEVCQKKLDTMRNAGVKVNGIWAQDWSGIRMTSFGKRVMWNWKWNSENYPQLDSRIKQWNQEGVQFLAYINPYVASDKDLCEEAAQHGYLAKDASGGDYLVEFGEFYGGVVDLTNPEAYAWFKEVIKKNMIELGCGGWMADFGEYLPTDTYLHNGVSAEIMHNAWPALWAKCNYEALEETGKLGEILFFMRAGSTGSQKYSTMMWAGDQNVDWSLDDGLASVVPAALSLAMTGHGLHHSDIGGYTTLFEMKRSKELLLRWCDFSAFTPMMRTHEGNRPGDNWQFDGDAETIAHFARMTTVFTTLKPYLKEAVALNAKSGLPVMRPLFLHYEDDAHTYTLKYQYLLGRDILVAPVHEEGRSDWTLYLPEDNWVHAWTGEAFRGGEVTVNAPIGKPPVFYRADSEWAALFASLKSI,./data/raw/alphafold//AF-P32138-F1-model_v4.pdb,177,2684,2990,5840
+1057,2128,2159,MTNNESKGPFEGLLVIDMTHVLNGPFGTQLLCNMGARVIKVEPPGHGDDTRTFGPYVDGQSLYYSFINHGKESVVLDLKNDHDKSIFINMLKQADVLAENFRPGTMEKLGFSWETLQEINPRLIYASSSGFGHTGPLKDAPAYDTIIQAMSGIMMETGYPDAPPVRVGTSLADLCGGVYLFSGIVSALYGREKSQRGAHVDIAMFDATLSFLEHGLMAYIATGKSPQRLGNRHPYMAPFDVFNTQDKPITICCGNDKLFSALCQALELTELVNDPRFSSNILRVQNQAILKQYIERTLKTQAAEVWLARIHEVGVPVAPLLSVAEAIKLPQTQARNMLIEAGGIMMPGNPIKISGCADPHVMPGAATLDQHGEQIRQEFSS,brenda,P76518,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=C(O)C(=O)O>>CC(=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(O)C(O)=NCCC(O)=NCCSC(=O)C(=O)O,15.0,0.0,25.0,6.7,2.8.3.19,562.0,1.1760912590556811,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=C(O)C(=O)O,CC(=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(O)C(O)=NCCC(O)=NCCSC(=O)C(=O)O,1.1760912590556811,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=C(O)C(=O)O__MTNNESKGPFEGLLVIDMTHVLNGPFGTQLLCNMGARVIKVEPPGHGDDTRTFGPYVDGQSLYYSFINHGKESVVLDLKNDHDKSIFINMLKQADVLAENFRPGTMEKLGFSWETLQEINPRLIYASSSGFGHTGPLKDAPAYDTIIQAMSGIMMETGYPDAPPVRVGTSLADLCGGVYLFSGIVSALYGREKSQRGAHVDIAMFDATLSFLEHGLMAYIATGKSPQRLGNRHPYMAPFDVFNTQDKPITICCGNDKLFSALCQALELTELVNDPRFSSNILRVQNQAILKQYIERTLKTQAAEVWLARIHEVGVPVAPLLSVAEAIKLPQTQARNMLIEAGGIMMPGNPIKISGCADPHVMPGAATLDQHGEQIRQEFSS,./data/raw/alphafold//AF-P76518-F1-model_v4.pdb,1546,1109,943,1283
+1058,3841,3894,MFLLPLPAAARVAVRQLSVRRFWGPGPDAANMTKGLVLGIYSKEKEDDAPQFTSAGENFDKLVSGKLREILNISGPPLKAGKTRTFYGLHEDFSSVVVVGLGKKGAGVDDQENWHEGKENIRAAVAAGCRQIQDLEIPSVEVDPCGDAQAAAEGAVLGLYEYDELKQKKKVVVSAKLHGSGDQEAWQRGVLFASGQNLARHLMETPANEMTPTRFAEVIEKNLKSASSKTDVHIRPKSWIEEQEMGSFLSVAKGSEEPPVFLEIHYKGSPDASDPPLVFVGKGITFDSGGISIKASANMDLMRADMGGAATICSTIVSAAKLDLPINLVGLAPLCENMPSGKANKPGDVVRAKNGKTIQVDNTDAEGRLILADALCYAHTFNPKVIINAATLTGAMDIALGSGATGVFTNSSWLWNKLFEASIETGDRVWRMPLFEHYTKQIVDCQLADVNNIGKYRSAGACTAAAFLKEFVTHPKWAHLDIAGVMTNKDEVPYLRKGMAGRPTRTLIEFLLRFSQDSA,sabio,P28839,CC(C)C[C@H](N)C(O)=NCC(=O)O.O>>CC(C)CC(N)C(=O)O.NCC(=O)O,138000.0,1.3747428887407502e-14,22.0,8.0,3.4.11.1,9823.0,5.139879086401237,CC(C)C[C@H](N)C(O)=NCC(=O)O.O,CC(C)CC(N)C(=O)O.NCC(=O)O,5.139879086401237,CC(C)C[C@H](N)C(O)=NCC(=O)O.O__MFLLPLPAAARVAVRQLSVRRFWGPGPDAANMTKGLVLGIYSKEKEDDAPQFTSAGENFDKLVSGKLREILNISGPPLKAGKTRTFYGLHEDFSSVVVVGLGKKGAGVDDQENWHEGKENIRAAVAAGCRQIQDLEIPSVEVDPCGDAQAAAEGAVLGLYEYDELKQKKKVVVSAKLHGSGDQEAWQRGVLFASGQNLARHLMETPANEMTPTRFAEVIEKNLKSASSKTDVHIRPKSWIEEQEMGSFLSVAKGSEEPPVFLEIHYKGSPDASDPPLVFVGKGITFDSGGISIKASANMDLMRADMGGAATICSTIVSAAKLDLPINLVGLAPLCENMPSGKANKPGDVVRAKNGKTIQVDNTDAEGRLILADALCYAHTFNPKVIINAATLTGAMDIALGSGATGVFTNSSWLWNKLFEASIETGDRVWRMPLFEHYTKQIVDCQLADVNNIGKYRSAGACTAAAFLKEFVTHPKWAHLDIAGVMTNKDEVPYLRKGMAGRPTRTLIEFLLRFSQDSA,./data/raw/alphafold//AF-P28839-F1-model_v4.pdb,1854,1548,3130,1897
+1059,7060,7181,MRIPLVGKEPIEAEDMGFTLIHEHLRVFSEAVRYQWPHLYNEDEELRNAVNEVKRAMQFGVKTIVDPTVMGLGRDIRFMEKVVKTTGINLVAGTGIYIYVDLPFYFLNRSIDEIADLFIHDIKEGIQATSNKAGFVKIAADEPGITKDVEKVIRAAAITHKEAKVPIITHSNAHNNTGLEEQRILMEEGVDPGKILIGHLGDTDNTDYIKKIADKGSFIGLDRYGLDLFLPVDKRNETTLKLIKDGYSDRIMISHDYCCTIDWGTARPELKPKLAPRWSMALIFEDTIPFLKKNGVSEEVIDIIFKENPKKFFS,brenda,C4KKZ9,CCCCCCCC(=O)CC(O)=NC1CCOC1=O.O>>CCCCCCCC(=O)CC(O)=NC(CCO)C(=O)O,10.65,9.873585900729537e-15,25.0,8.3,3.1.1.25,43080.0,1.0273496077747566,CCCCCCCC(=O)CC(O)=NC1CCOC1=O.O,CCCCCCCC(=O)CC(O)=NC(CCO)C(=O)O,1.0273496077747566,CCCCCCCC(=O)CC(O)=NC1CCOC1=O.O__MRIPLVGKEPIEAEDMGFTLIHEHLRVFSEAVRYQWPHLYNEDEELRNAVNEVKRAMQFGVKTIVDPTVMGLGRDIRFMEKVVKTTGINLVAGTGIYIYVDLPFYFLNRSIDEIADLFIHDIKEGIQATSNKAGFVKIAADEPGITKDVEKVIRAAAITHKEAKVPIITHSNAHNNTGLEEQRILMEEGVDPGKILIGHLGDTDNTDYIKKIADKGSFIGLDRYGLDLFLPVDKRNETTLKLIKDGYSDRIMISHDYCCTIDWGTARPELKPKLAPRWSMALIFEDTIPFLKKNGVSEEVIDIIFKENPKKFFS,./data/raw/alphafold//AF-C4KKZ9-F1-model_v4.pdb,3234,2055,3706,1199
+1060,9195,9337,MNQPTSRSGLTTFTVIIIGLLALFLLIGGIWLATLGGSIYYIIAGVLLLIVAWQLYKRASTALWFYAALMLGTIIWSVWEVGTDFWALAPRLDILGILGLWLLVPAVTRGINNLGSSKVALSSTLAIAIVLMVYSIFNDPQEINGEIKTPQPETAQAVPGVAESDWPAYGRTQAGVRYSPLKQINDQNVKDLKVAWTLRTGDLKTDNDSGETTNQVTPIKIGNNMFICTAHQQLIAIDPATGKEKWRFDPKLKTDKSFQHLTCRGVMYYDANNTTEFATSLQSKKSSSTQCPRKVFVPVNDGRLVAVNADTGKACTDFGQNGQVNLQEFMPYAYPGGYNPTSPGIVTGSTVVIAGSVTDNYSNKEPSGVIRGYDVNTGKLLWVFDTGAADPNAMPGEGTTFVHNSPNAWAPLAYDAKLDIVYVPTGVGTPDIWGGDRTELKERYANSMLAINASTGKLVWNFQTTHHDLWDMDVPSQPSLADIKNKAGQTVPAIYVLTKTGNAFVLDRRNGQPIVPVTEKPVPQTVKRGPQTKGEFYSKTQPFSDLNLAPQDKLTDKDMWGATMLDQLMCRVSFKRLNYDGIYTPPSENGTLVFPGNLGVFEWGGMSVNPDRQVAVMNPIGLPFVSRLIPADPNRAQTAKGAGTEQGVQPMYGVPYGVEISAFLSPLGLPCKQPAWGYVAGVDLKTHEVVWKKRIGTIRDSLPNLFQLPAVKIGVPGLGGSISTAGNVMFVGATQDNYLRAFNVTNGKKLWEARLPAGGQATPMTYEINGKQYVVIMAGGHGSFGTKMGDYLVAYALPDNK,uniprot_search,P05465,COS(=O)(=O)[O-].C[n+]1c2ccccc2nc2ccccc21.OC1OC[C@@H](O)[C@H](O)[C@H]1O>>CN1c2ccccc2Nc2ccccc21.COS(=O)(=O)O.O=C1OC[C@@H](O)[C@H](O)[C@H]1O,669.0,0.0,25.0,6.75,1.1.99.35,471.0,2.825426117767824,COS(=O)(=O)[O-].C[n+]1c2ccccc2nc2ccccc21.OC1OC[C@@H](O)[C@H](O)[C@H]1O,CN1c2ccccc2Nc2ccccc21.COS(=O)(=O)O.O=C1OC[C@@H](O)[C@H](O)[C@H]1O,2.825426117767824,COS(=O)(=O)[O-].C[n+]1c2ccccc2nc2ccccc21.OC1OC[C@@H](O)[C@H](O)[C@H]1O__MNQPTSRSGLTTFTVIIIGLLALFLLIGGIWLATLGGSIYYIIAGVLLLIVAWQLYKRASTALWFYAALMLGTIIWSVWEVGTDFWALAPRLDILGILGLWLLVPAVTRGINNLGSSKVALSSTLAIAIVLMVYSIFNDPQEINGEIKTPQPETAQAVPGVAESDWPAYGRTQAGVRYSPLKQINDQNVKDLKVAWTLRTGDLKTDNDSGETTNQVTPIKIGNNMFICTAHQQLIAIDPATGKEKWRFDPKLKTDKSFQHLTCRGVMYYDANNTTEFATSLQSKKSSSTQCPRKVFVPVNDGRLVAVNADTGKACTDFGQNGQVNLQEFMPYAYPGGYNPTSPGIVTGSTVVIAGSVTDNYSNKEPSGVIRGYDVNTGKLLWVFDTGAADPNAMPGEGTTFVHNSPNAWAPLAYDAKLDIVYVPTGVGTPDIWGGDRTELKERYANSMLAINASTGKLVWNFQTTHHDLWDMDVPSQPSLADIKNKAGQTVPAIYVLTKTGNAFVLDRRNGQPIVPVTEKPVPQTVKRGPQTKGEFYSKTQPFSDLNLAPQDKLTDKDMWGATMLDQLMCRVSFKRLNYDGIYTPPSENGTLVFPGNLGVFEWGGMSVNPDRQVAVMNPIGLPFVSRLIPADPNRAQTAKGAGTEQGVQPMYGVPYGVEISAFLSPLGLPCKQPAWGYVAGVDLKTHEVVWKKRIGTIRDSLPNLFQLPAVKIGVPGLGGSISTAGNVMFVGATQDNYLRAFNVTNGKKLWEARLPAGGQATPMTYEINGKQYVVIMAGGHGSFGTKMGDYLVAYALPDNK,./data/raw/alphafold//AF-P05465-F1-model_v4.pdb,3521,3456,1201,3128
+1061,21159,21483,MGNKKLMKMATRSSMSLPMCKSNLNTNFAIFNSDVTGYRRTFDSGRRCPQLHKFFTINCKLKHRHARGALGSGDHNTQNYNAQAFGLQRISQNENGDLEFTVRDSNTLPKPLSLSDQSLPVSQGSQLRVAYQGVPGAYSEAAAAKAYPNCEAVPCEQFETAFEAVELWLVDRAVLPIENSLGGSIHRNYDLLLRHRLHIVGEVQFAVHHCLLGVRGVKREELHRVLSHPQALAQCEHTLSKLGVIREAVDDTAGAAQFVALNKLRDTGAVASARAAEIYDLDILAKDIQDDCDNVTRFLMLAREPIIPRVDRPFKTSIVFTLEEGPGVLFKALAVFAMRDINLTKIESRPQRKRPLRVTDDSSNGSAKYFDYLFYVDFEASMADAQAQNALGHLQEFATFIRVLGSYPMDVSPSD,brenda,A0A1I9WKA1,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,0.3539,0.0,37.0,8.0,4.2.1.51,71647.0,-0.4511194373624851,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,-0.4511194373624851,O=C(O)C(=O)C[C@]1(C(=O)O)C=C[C@@H](O)C=C1__MGNKKLMKMATRSSMSLPMCKSNLNTNFAIFNSDVTGYRRTFDSGRRCPQLHKFFTINCKLKHRHARGALGSGDHNTQNYNAQAFGLQRISQNENGDLEFTVRDSNTLPKPLSLSDQSLPVSQGSQLRVAYQGVPGAYSEAAAAKAYPNCEAVPCEQFETAFEAVELWLVDRAVLPIENSLGGSIHRNYDLLLRHRLHIVGEVQFAVHHCLLGVRGVKREELHRVLSHPQALAQCEHTLSKLGVIREAVDDTAGAAQFVALNKLRDTGAVASARAAEIYDLDILAKDIQDDCDNVTRFLMLAREPIIPRVDRPFKTSIVFTLEEGPGVLFKALAVFAMRDINLTKIESRPQRKRPLRVTDDSSNGSAKYFDYLFYVDFEASMADAQAQNALGHLQEFATFIRVLGSYPMDVSPSD,./data/raw/alphafold//AF-A0A1I9WKA1-F1-model_v4.pdb,2634,5126,5637,6529
+1062,14200,14388,MSYQSLKNKVVIVTGAGSGIGRAIAKKFALNDSIVVAVELLEDRLNQIVQELRGMGKEVLGVKADVSKKKDVEEFVRRTFETYSRIDVLCNNAGIMDGVTPVAEVSDELWERVLAVNLYSAFYSSRAVIPIMLKQGKGVIVNTASIAGIRGGFAGAPYTVAKHGLIGLTRSIAAHYGDQGIRAVAVLPGTVKTNIGLGSSKPSELGMRTLTKLMSLSSRLAEPEDIANVIVFLASDEASFVNGDAVVVDGGLTVL,brenda,Q4J9F2,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.OC1CCc2ccccc21>>N=C(O)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=C1CCc2ccccc21.[H+],6.2,0.0,78.0,5.5,1.1.1.1,2285.0,0.7923916894982539,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.OC1CCc2ccccc21,N=C(O)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=C1CCc2ccccc21.[H+],0.7923916894982539,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.OC1CCc2ccccc21__MSYQSLKNKVVIVTGAGSGIGRAIAKKFALNDSIVVAVELLEDRLNQIVQELRGMGKEVLGVKADVSKKKDVEEFVRRTFETYSRIDVLCNNAGIMDGVTPVAEVSDELWERVLAVNLYSAFYSSRAVIPIMLKQGKGVIVNTASIAGIRGGFAGAPYTVAKHGLIGLTRSIAAHYGDQGIRAVAVLPGTVKTNIGLGSSKPSELGMRTLTKLMSLSSRLAEPEDIANVIVFLASDEASFVNGDAVVVDGGLTVL,./data/raw/alphafold//AF-Q4J9F2-F1-model_v4.pdb,1315,3873,6190,844
+1063,13903,14084,MNFAEEEPSKKYCIKGKHVAIICGVVVAVGLIVGLSVGLTRSCEQDTTPAPSQPPPEASTALPPQDQNVCPDSEDESGEWKNFRLPDFINPVHYDLEVKALMEEDRYTGIVTISVNLSKPTRDLWLHIRETKITKLPELRRPSGEQVPIRRCFEYKKQEYVVIQAAEDLAATSGDSVYRLTMEFKGWLNGSLVGFYKTTYMEDGQIRSIAATDHEPTDARKSFPCFDEPNKKSTYSISIIHPKEYSALSNMPEEKSEMVDDNWKKTTFVKSVPMSTYLVCFAVHRFTAIERKSRSGKPLKVYVQPNQKETAEYAANITQAVFDYFEDYFAMEYALPKLDKIAIPDFGTGAMENWGLVTYRETNLLYDPLLSASSNQQRVASVVAHELVHQWFGNTVTMDWWDDLWLNEGFASFFEFLGVNHAEKDWQMLSQVLLEDVFPVQEDDSLMSSHPVVVTVSTPAEITSVFDGISYSKGASILRMLQDWITPEKFQKGCQIYLKKFQFANAKTSDFWDSLQEASNLPVKEVMDTWTSQMGYPVVTVSGRQNITQKRFLLDSKADPSQPPSELGYTWNIPVRWADNDNSRITVYNRLDKGGITLNANLSGDAFLKINPDHIGFYRVNYEGGTWDWIAEALSSNHTRFSAADRSSFIDDAFALARAQLLNYKIALNLTMYLKSEEDFLPWERVISSVSYIISMFEDDRELYPMIETYFQGQVKPVADLLGWQDTGSHITKLLRASILGFACKMGDREALGNASQLFDSWLKGSASIPVNLRLLVYRYGMQNSGNEAAWNYTLEQYQKTSLAQEKEKLLYGLASVKDVKLLARYLEMLKDPNIIKTQDVFTVIRYISYNSYGKTMAWNWIQLNWDYLVSRFTINDRYLGRIVTIAEPFNTELQLWQMQSFFAKYPNAGAGAKPREQVLETVKNNIEWLNVNRQSIREWFASLP,brenda,P16406,N=C(O)C[C@H](N)C(O)=Nc1ccc2ccccc2c1.O>>N[C@@H](CC(=O)O)C(=O)O.Nc1ccc2ccccc2c1,102.0,0.1780673181324612,37.0,7.4,3.4.11.7,10090.0,2.008600171761917,N=C(O)C[C@H](N)C(O)=Nc1ccc2ccccc2c1.O,N[C@@H](CC(=O)O)C(=O)O.Nc1ccc2ccccc2c1,2.008600171761917,N=C(O)C[C@H](N)C(O)=Nc1ccc2ccccc2c1.O__MNFAEEEPSKKYCIKGKHVAIICGVVVAVGLIVGLSVGLTRSCEQDTTPAPSQPPPEASTALPPQDQNVCPDSEDESGEWKNFRLPDFINPVHYDLEVKALMEEDRYTGIVTISVNLSKPTRDLWLHIRETKITKLPELRRPSGEQVPIRRCFEYKKQEYVVIQAAEDLAATSGDSVYRLTMEFKGWLNGSLVGFYKTTYMEDGQIRSIAATDHEPTDARKSFPCFDEPNKKSTYSISIIHPKEYSALSNMPEEKSEMVDDNWKKTTFVKSVPMSTYLVCFAVHRFTAIERKSRSGKPLKVYVQPNQKETAEYAANITQAVFDYFEDYFAMEYALPKLDKIAIPDFGTGAMENWGLVTYRETNLLYDPLLSASSNQQRVASVVAHELVHQWFGNTVTMDWWDDLWLNEGFASFFEFLGVNHAEKDWQMLSQVLLEDVFPVQEDDSLMSSHPVVVTVSTPAEITSVFDGISYSKGASILRMLQDWITPEKFQKGCQIYLKKFQFANAKTSDFWDSLQEASNLPVKEVMDTWTSQMGYPVVTVSGRQNITQKRFLLDSKADPSQPPSELGYTWNIPVRWADNDNSRITVYNRLDKGGITLNANLSGDAFLKINPDHIGFYRVNYEGGTWDWIAEALSSNHTRFSAADRSSFIDDAFALARAQLLNYKIALNLTMYLKSEEDFLPWERVISSVSYIISMFEDDRELYPMIETYFQGQVKPVADLLGWQDTGSHITKLLRASILGFACKMGDREALGNASQLFDSWLKGSASIPVNLRLLVYRYGMQNSGNEAAWNYTLEQYQKTSLAQEKEKLLYGLASVKDVKLLARYLEMLKDPNIIKTQDVFTVIRYISYNSYGKTMAWNWIQLNWDYLVSRFTINDRYLGRIVTIAEPFNTELQLWQMQSFFAKYPNAGAGAKPREQVLETVKNNIEWLNVNRQSIREWFASLP,./data/raw/alphafold//AF-P16406-F1-model_v4.pdb,3383,2263,3956,2836
+1064,14021,14203,MLLFETVREMGHEQVLFCHSKNPEIKAIIAIHDTTLGPAMGATRILPYINEEAALKDALRLSRGMTYKAACANIPAGGGKAVIIANPENKTDDLLRAYGRFVDSLNGRFITGQDVNITPDDVRTISQETKYVVGVSEKSGGPAPITSLGVFLGIKAAVESRWQSKRLDGMKVAVQGLGNVGKNLCRHLHEHDVQLFVSDVDPIKAEEVKRLFGATVVEPTEIYSLDVDIFAPCALGGILNSHTIPFLQASIIAGAANNQLENEQLHSQMLAKKGILYSPDYVINAGGLINVYNEMIGYDEEKAFKQVHNIYDTLLAIFEIAKEQGVTTNDAARRLAEDRINNSKRSKSKAIAA,uniprot_search,W8CV45,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>>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+],4.2,6.407188024645225e-15,45.0,9.25,1.4.1.19,272131.0,0.6232492903979004,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,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+],1.3010299956639813,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__MLLFETVREMGHEQVLFCHSKNPEIKAIIAIHDTTLGPAMGATRILPYINEEAALKDALRLSRGMTYKAACANIPAGGGKAVIIANPENKTDDLLRAYGRFVDSLNGRFITGQDVNITPDDVRTISQETKYVVGVSEKSGGPAPITSLGVFLGIKAAVESRWQSKRLDGMKVAVQGLGNVGKNLCRHLHEHDVQLFVSDVDPIKAEEVKRLFGATVVEPTEIYSLDVDIFAPCALGGILNSHTIPFLQASIIAGAANNQLENEQLHSQMLAKKGILYSPDYVINAGGLINVYNEMIGYDEEKAFKQVHNIYDTLLAIFEIAKEQGVTTNDAARRLAEDRINNSKRSKSKAIAA,./data/raw/alphafold//AF-W8CV45-F1-model_v4.pdb,1591,4352,4241,4105
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+1076,20396,20701,MSKVDLWQDATAQAELVRSGEISRTELLEATIAHVQAVNPEINAVIIPLFEKARRESELASGPFAGVPYLLKDLTVVSQGDINTSSIKGMKESGYRADHDAYFVQRMRAAGFVLLGKTNTPEMGNQVTTEPEAWGATRNPWNLGRSVGGSSGGSGAAVAAALSPVAHGNDAAGSVRIPASVCGVVGLKPTRGRISPGPLVTDSDNVAGAAHEGLFARSVRDIAALLDVVSGHRPGDTFCAPTASRPYAQGISENPGSLRVGVLTHNPVGDFALDPECAAAARGAAAALAALGHDVNDAYPEALGDRSFLKDYSTICDVAIAREIERNGELIGRPLTEDDVEWTSWEMVKRADQVTGRAFAACVDELRYYAGKVERWWEAGWDLLILPTVTRQTPEIGELMLAKGTDLEGRQSAFISGSLQMLAFTVPFNVSGQPAISLPIGMSSDGMPIGVQIVAAYGREDLLLQVAAQLEGALPWVARRPQLLNPSRKIPAA,uniprot_search,P13398,O.OC1=NCCCCCC(O)=NCCCCC1>>NCCCCCC(O)=NCCCCCC(=O)O,4.97,1.1608515706661233e-14,30.0,7.0,3.5.2.12,37931.0,0.6963563887333322,O.OC1=NCCCCCC(O)=NCCCCC1,NCCCCCC(O)=NCCCCCC(=O)O,0.6963563887333322,O.OC1=NCCCCCC(O)=NCCCCC1__MSKVDLWQDATAQAELVRSGEISRTELLEATIAHVQAVNPEINAVIIPLFEKARRESELASGPFAGVPYLLKDLTVVSQGDINTSSIKGMKESGYRADHDAYFVQRMRAAGFVLLGKTNTPEMGNQVTTEPEAWGATRNPWNLGRSVGGSSGGSGAAVAAALSPVAHGNDAAGSVRIPASVCGVVGLKPTRGRISPGPLVTDSDNVAGAAHEGLFARSVRDIAALLDVVSGHRPGDTFCAPTASRPYAQGISENPGSLRVGVLTHNPVGDFALDPECAAAARGAAAALAALGHDVNDAYPEALGDRSFLKDYSTICDVAIAREIERNGELIGRPLTEDDVEWTSWEMVKRADQVTGRAFAACVDELRYYAGKVERWWEAGWDLLILPTVTRQTPEIGELMLAKGTDLEGRQSAFISGSLQMLAFTVPFNVSGQPAISLPIGMSSDGMPIGVQIVAAYGREDLLLQVAAQLEGALPWVARRPQLLNPSRKIPAA,./data/raw/alphafold//AF-P13398-F1-model_v4.pdb,478,3151,5440,6323
+1077,348,362,MSQGFVIGRVLAQRLDIPFSQPIRMSFGTLDRLNLLLVRLIDENGIEGVGEATVMGGPYWGGESIEAVEAAVVKYLGPQLIGQRFRGLEEFSYRLSKTVKGNAAARSALEMAAFDLVGKQLGVSASALLGGRCRDRLQVAWTLSTGSEGGDIAEGERAIQARGHTRFKLKFGSGDPDAELLRVAGIAEAFRGRASIILDINQGWDLGTALRYFPVLEEAGVECIEQPLAALDLHGAARLKASTSMEIIADEVLTDLRSAFEVATANAASAVSLKPNRDGGMLAAKRVATVASASGLKIYGGTALESSLGTAASALIYASLPSLQLGTELFGPLRLQADIVKAPLLPIDGHLDVPTGEGLGVVLDEDLIRSLSVDVLH,brenda,C6YXG6,C/C(=C\C=C\C(=O)[O-])C(=O)[O-]>>,0.5,99.35534195885792,25.0,6.4,5.5.1.1,395598.0,-0.3010299956639812,C/C(=C\C=C\C(=O)[O-])C(=O)[O-],,-0.3010299956639812,C/C(=C\C=C\C(=O)[O-])C(=O)[O-]__MSQGFVIGRVLAQRLDIPFSQPIRMSFGTLDRLNLLLVRLIDENGIEGVGEATVMGGPYWGGESIEAVEAAVVKYLGPQLIGQRFRGLEEFSYRLSKTVKGNAAARSALEMAAFDLVGKQLGVSASALLGGRCRDRLQVAWTLSTGSEGGDIAEGERAIQARGHTRFKLKFGSGDPDAELLRVAGIAEAFRGRASIILDINQGWDLGTALRYFPVLEEAGVECIEQPLAALDLHGAARLKASTSMEIIADEVLTDLRSAFEVATANAASAVSLKPNRDGGMLAAKRVATVASASGLKIYGGTALESSLGTAASALIYASLPSLQLGTELFGPLRLQADIVKAPLLPIDGHLDVPTGEGLGVVLDEDLIRSLSVDVLH,./data/raw/alphafold//AF-C6YXG6-F1-model_v4.pdb,1033,579,241,261
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+1092,3337,3385,MERQSMALVGDKEEIIRKSFEYHPTVWGDYFIRNYSCLPLEKECMIKRVEELKDRVRNLFEETHDVLQIMILVDSIQLLGLDYHFEKEITAALRLIYEADVENYGLYEVSLRFRLLRQHGYNLSPDVFNKFKDDKGRFLPTLNGDAKGLLNLYNAAYLGTHEETILDEAISFTKCQLESLLGELEQPLAIEVSLFLETPLYRRTRRLLVRKYIPIYQEKVMRNDTILELAKLDFNLLQSLHQEEVKKITIWWNDLALTKSLKFARDRVVECYYWIVAVYFEPQYSRARVITSKAISLMSIMDDIYDNYSTLEESRLLTEAIERWEPQAVDCVPEYLKDFYLKLLKTYKDFEDELEPNEKYRIPYLQEEIKVLSRAYFQEAKWGVERYVPALEEHLLVSLITAGYFAVACASYVGLGEDATKETFEWVASSPKILKSCSIHCRLMDDITSHQREQERDHFASTVESYMKEHGTSAKVACEKLQVMVEQKWKDLNEECLRPTQVARPLIEIILNLSRAMEDIYKHKDTYTNSNTRMKDNVSLIFVESFLI,brenda,B1B1U3,CC(C)=CCC/C(C)=C\COP(=O)([O-])OP(=O)([O-])[O-]>>C=C(C)C1CC=C(C)CC1.O=P(O)(O)OP(=O)(O)O,4.26,0.4827601620694831,38.0,7.5,4.2.3.104,311405.0,0.6294095991027189,CC(C)=CCC/C(C)=C\COP(=O)([O-])OP(=O)([O-])[O-],C=C(C)C1CC=C(C)CC1.O=P(O)(O)OP(=O)(O)O,0.6294095991027189,CC(C)=CCC/C(C)=C\COP(=O)([O-])OP(=O)([O-])[O-]__MERQSMALVGDKEEIIRKSFEYHPTVWGDYFIRNYSCLPLEKECMIKRVEELKDRVRNLFEETHDVLQIMILVDSIQLLGLDYHFEKEITAALRLIYEADVENYGLYEVSLRFRLLRQHGYNLSPDVFNKFKDDKGRFLPTLNGDAKGLLNLYNAAYLGTHEETILDEAISFTKCQLESLLGELEQPLAIEVSLFLETPLYRRTRRLLVRKYIPIYQEKVMRNDTILELAKLDFNLLQSLHQEEVKKITIWWNDLALTKSLKFARDRVVECYYWIVAVYFEPQYSRARVITSKAISLMSIMDDIYDNYSTLEESRLLTEAIERWEPQAVDCVPEYLKDFYLKLLKTYKDFEDELEPNEKYRIPYLQEEIKVLSRAYFQEAKWGVERYVPALEEHLLVSLITAGYFAVACASYVGLGEDATKETFEWVASSPKILKSCSIHCRLMDDITSHQREQERDHFASTVESYMKEHGTSAKVACEKLQVMVEQKWKDLNEECLRPTQVARPLIEIILNLSRAMEDIYKHKDTYTNSNTRMKDNVSLIFVESFLI,./data/raw/alphafold//AF-B1B1U3-F1-model_v4.pdb,1734,1380,6315,1670
+1093,20393,20698,MSLLIRGATVITYDERYRADVLCAGGLIRAIGTGLDVPAGTEVLDGSGQYLMPGGIDPHTHMQLPFMGTVASEDFFSGTAAGLAGGTTSIIDFVIPNPQQSLMEAFHQWRGWAEKSASDYGFHVAITWWSEQVREEMAELVSHHGINSFKHFMAYKNAIMAADDTLVASFERCLELGAVPTVHAENGELVYHLQRKLMAQGITGPEAHPLSRPSQVEGEAASRAIRIAETIGTPLYLVHVSTKEALDEITYARGKGQPVYGEVLAGHLLLDDSVYQHPDWHTAAGYVMSPPFRPRGHQEALWHGLQSGNLHTTATDHCCFCAEQKAAGRDDFSKIPNGTAGIEDRMALLWHEGVNTGRLSMQEFVALTSTNTAKIFNLYPRKGAIRVGADADLVLWDPEGTRTISAKTHHQKVDFNIFEGKTVRGVPSHTISQGKLVWADGDLRAERGAGRYVERPAYPSVFEQLSKRAEHSRPTAVKR,brenda,S5MPT0,O.OC1=NC(c2ccc(O)cc2)C(O)=N1>>N=C(O)N[C@@H](C(=O)O)c1ccc(O)cc1,74.2,6.744943834372942e-15,45.0,9.0,3.5.2.2,294.0,1.8704039052790271,O.OC1=NC(c2ccc(O)cc2)C(O)=N1,N=C(O)N[C@@H](C(=O)O)c1ccc(O)cc1,1.8704039052790271,O.OC1=NC(c2ccc(O)cc2)C(O)=N1__MSLLIRGATVITYDERYRADVLCAGGLIRAIGTGLDVPAGTEVLDGSGQYLMPGGIDPHTHMQLPFMGTVASEDFFSGTAAGLAGGTTSIIDFVIPNPQQSLMEAFHQWRGWAEKSASDYGFHVAITWWSEQVREEMAELVSHHGINSFKHFMAYKNAIMAADDTLVASFERCLELGAVPTVHAENGELVYHLQRKLMAQGITGPEAHPLSRPSQVEGEAASRAIRIAETIGTPLYLVHVSTKEALDEITYARGKGQPVYGEVLAGHLLLDDSVYQHPDWHTAAGYVMSPPFRPRGHQEALWHGLQSGNLHTTATDHCCFCAEQKAAGRDDFSKIPNGTAGIEDRMALLWHEGVNTGRLSMQEFVALTSTNTAKIFNLYPRKGAIRVGADADLVLWDPEGTRTISAKTHHQKVDFNIFEGKTVRGVPSHTISQGKLVWADGDLRAERGAGRYVERPAYPSVFEQLSKRAEHSRPTAVKR,./data/raw/alphafold//AF-S5MPT0-F1-model_v4.pdb,477,1479,3049,1799
+1094,6029,6123,MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,brenda,O94219,CC=CC=CCO.O=O>>C/C=C/C=C/C=O.OO,89.0,0.0,18.5,7.0,1.1.3.7,5323.0,1.9493900066449128,CC=CC=CCO.O=O,C/C=C/C=C/C=O.OO,2.206825876031849,CC=CC=CCO.O=O__MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,./data/raw/alphafold//AF-O94219-F1-model_v4.pdb,1050,3522,1297,300
+1095,12969,13141,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)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)O.O>>N=C(N)NCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(O)=NCC(O)=N[C@@H](Cc1ccccc1)C(=O)O.N=C(N)NCCC[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N)CO)C(=O)O,33.8,6.323295041819007e-14,37.0,8.2,3.4.24.15,10116.0,1.5289167002776547,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)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)O.O,N=C(N)NCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(O)=NCC(O)=N[C@@H](Cc1ccccc1)C(=O)O.N=C(N)NCCC[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)[C@@H]1CCCN1C(=O)[C@@H](N)CO)C(=O)O,1.5289167002776547,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)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)O.O__MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,./data/raw/alphafold//AF-P24155-F1-model_v4.pdb,1820,1500,3134,1830
+1096,4879,4949,MSEKLTGRVTVPTDVDMIQETKEIAERWGADALRDCDGTDMPDELKKMPAKIYSTYYTTRKDNAWANANPDEVQQVYLMTEFYTAMSQGELRIPLMKHLYKDQLKPNTIHDIKRWWEVVDRTTGEPLVLDAWEYDENNQEVIILNPDHFHDYTVSFLAFIIWDPVHMYNFITNDWQDVEHQITYDVRQPKTQKYVIEKLKRWMKENPDSDVVRFTTFFHQFTLVFNEFAKEKFVDWFGYSASVSPYILEQFEKEVGYKFRPEYIIDQGYHNNTNRVPSKEFRDFQEFQQREVAKLMKVLVDICHDNDKEAMMFLGDHWIGTEPFGEYFKHVGLDAVVGSVGNGTTLRLISDIPGVKYTEGRFLPYFFPDVFHEGGDPIKEAKVNWVTARRAILRKPVDRIGYGGYLKLALDFPEFIQYIEEVCDEFRLLYDNMGGQSPYSHFKVGVLNSWGKIRSWGTHMVAHAIDYKQTYSYAGVLEALSGMPFDVEFISFEDVIKNPVILNECGVVINVGDAYTGPSGGAYWTNEKVSSAVKAFVAQGGGFIGVGEPSACEHQGRYFTLANVLGVNKEIGFSMSTDKYNWDEHSHFITEDSNESINFGEGMKNIYALDGAQILRKDGQDVQMAVNQFGDGRSVYISGIPYSFENSRMLYRAIFWAAGMEQEMKKWYSSNYNVEVNYYPATKKYCIVNNTYEPQETMIYDGLGREYSMKLKANDILWFTFLED,brenda,A9KQ75,CC(O)=N[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](CO)O[C@H]1O.O=P(O)(O)O>>CC(O)=N[C@H]1C(O)O[C@H](CO)[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,39.0,5.898529281345003e-15,30.0,6.5,2.4.1.211,66219.0,1.591064607026499,CC(O)=N[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](CO)O[C@H]1O.O=P(O)(O)O,CC(O)=N[C@H]1C(O)O[C@H](CO)[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,1.591064607026499,CC(O)=N[C@@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](CO)O[C@H]1O.O=P(O)(O)O__MSEKLTGRVTVPTDVDMIQETKEIAERWGADALRDCDGTDMPDELKKMPAKIYSTYYTTRKDNAWANANPDEVQQVYLMTEFYTAMSQGELRIPLMKHLYKDQLKPNTIHDIKRWWEVVDRTTGEPLVLDAWEYDENNQEVIILNPDHFHDYTVSFLAFIIWDPVHMYNFITNDWQDVEHQITYDVRQPKTQKYVIEKLKRWMKENPDSDVVRFTTFFHQFTLVFNEFAKEKFVDWFGYSASVSPYILEQFEKEVGYKFRPEYIIDQGYHNNTNRVPSKEFRDFQEFQQREVAKLMKVLVDICHDNDKEAMMFLGDHWIGTEPFGEYFKHVGLDAVVGSVGNGTTLRLISDIPGVKYTEGRFLPYFFPDVFHEGGDPIKEAKVNWVTARRAILRKPVDRIGYGGYLKLALDFPEFIQYIEEVCDEFRLLYDNMGGQSPYSHFKVGVLNSWGKIRSWGTHMVAHAIDYKQTYSYAGVLEALSGMPFDVEFISFEDVIKNPVILNECGVVINVGDAYTGPSGGAYWTNEKVSSAVKAFVAQGGGFIGVGEPSACEHQGRYFTLANVLGVNKEIGFSMSTDKYNWDEHSHFITEDSNESINFGEGMKNIYALDGAQILRKDGQDVQMAVNQFGDGRSVYISGIPYSFENSRMLYRAIFWAAGMEQEMKKWYSSNYNVEVNYYPATKKYCIVNNTYEPQETMIYDGLGREYSMKLKANDILWFTFLED,./data/raw/alphafold//AF-A9KQ75-F1-model_v4.pdb,3009,1757,3386,2193
+1097,17068,17298,MRQRTPFARPGLLASAALALVLGPLAASAQEQVAPPKDPAAALEDHKTRTDNRYEPSLDNLAQQDVAAPGAPEGVSALSDAQYNEANKIYFERCAGCHGVLRKGATGKALTPDLTRDLGFDYLQSFITYGSPAGMPNWGTSGELSAEQVDLMANYLLLDPAAPPEFGMKEMRESWKVHVAPEDRPTQQENDWDLENLFSVTLRDAGQIALIDGATYEIKSVLDTGYAVHISRLSASGRYLFVIGRDGKVNMIDLWMKEPTTVAEIKIGSEARSIETSKMEGWEDKYAIAGAYWPPQYVIMDGETLEPKKIQSTRGMTYDEQEYHPEPRVAAILASHYRPEFIVNVKETGKILLVDYTDLDNLKTTEISAERFLHDGGLDGSHRYFITAANARNKLVVIDTKEGKLVAIEDTGGQTPHPGRGANFVHPTFGPVWATSHMGDDSVALIGTDPEGHPDNAWKILDSFPALGGGSLFIKTHPNSQYLYVDATLNPEAEISGSVAVFDIKAMTGDGSDPEFKTLPIAEWAGITEGQPRVVQGEFNKDGTEVWFSVWNGKDQESALVVVDDKTLELKHVIKDERLVTPTGKFNVYNTMTDTY,uniprot_search,P72181,NO>>N.O,3.5,2.918524523713009,25.0,7.0,1.7.2.1,82367.0,0.5440680443502757,NO,N.O,0.8061799739838872,NO__MRQRTPFARPGLLASAALALVLGPLAASAQEQVAPPKDPAAALEDHKTRTDNRYEPSLDNLAQQDVAAPGAPEGVSALSDAQYNEANKIYFERCAGCHGVLRKGATGKALTPDLTRDLGFDYLQSFITYGSPAGMPNWGTSGELSAEQVDLMANYLLLDPAAPPEFGMKEMRESWKVHVAPEDRPTQQENDWDLENLFSVTLRDAGQIALIDGATYEIKSVLDTGYAVHISRLSASGRYLFVIGRDGKVNMIDLWMKEPTTVAEIKIGSEARSIETSKMEGWEDKYAIAGAYWPPQYVIMDGETLEPKKIQSTRGMTYDEQEYHPEPRVAAILASHYRPEFIVNVKETGKILLVDYTDLDNLKTTEISAERFLHDGGLDGSHRYFITAANARNKLVVIDTKEGKLVAIEDTGGQTPHPGRGANFVHPTFGPVWATSHMGDDSVALIGTDPEGHPDNAWKILDSFPALGGGSLFIKTHPNSQYLYVDATLNPEAEISGSVAVFDIKAMTGDGSDPEFKTLPIAEWAGITEGQPRVVQGEFNKDGTEVWFSVWNGKDQESALVVVDDKTLELKHVIKDERLVTPTGKFNVYNTMTDTY,./data/raw/alphafold//AF-P72181-F1-model_v4.pdb,1070,635,311,345
+1098,11927,12087,MQTERGPIAAHRPHEVVFGKVEGLDRGANPMDPPRRRVDPLFWLRDDNRADPEVLAHLHLEKDYYEKRAVDIKDLAETIYQEHISHIEETDMSAPYVYDRFLYYTRDVKGLSYKLHCRVPAGKTPGEGEDEEIVLDENKLAEGKSFCVVGCVAPAPPEHALVAYSVDYCGDEVYSIRFVRDVVADKVEGTNGSVVWGPNAECFFYITKDASKRDNKVWRHIIGQPQSEDVCLYTDDDPLFSVGVGRSGDGKTLIICSMSSETSESHLLDLRKGVKHNTLEMVRPREKGVRYTVEMHGTDTLIVLTNKDKCVNGKVVLTKRSAPTDWGTVLIPHDDKVTIDDVVVFAKFAVLSGRRDGLTRVWTVRLGPDNLFSSATLKELHFDEPVFTAHVVCSQMKTYDASLLRLRYSSMTTPTVWYDEDVLSGERKVVKARKVGGGFESKNYVCRRELATAPDGTKVPISLVYDTSIDLKKPNPTMLYGYGSYGICIEPEFNSRFLPYVDRGMIYAIAHVRGGGEMGRTWYEVGGKYLTKRNTFMDFIACAEHLISSGLTTPAQLSCEGRSAGGLLVGAVLNMRPDLFHVALAGVPFVDVMTTMCDPSIPLTTGEWEEWGNPNEYKFFDYMNSYSPIDNARAQDYPHLMIQAGLHDPRVAYWEPAKWASKLRELKTDSNEVLLKMDLESGHFSASDRYKYLRENAIQQAFVLKHLNVRQLLRK,brenda,Q6QDP1,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,59.0,0.0,37.0,8.0,3.4.21.83,5697.0,1.7708520116421442,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,1.8864907251724816,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc3ccccc3)N=C(O)OCc3ccccc3)ccc12.O__MQTERGPIAAHRPHEVVFGKVEGLDRGANPMDPPRRRVDPLFWLRDDNRADPEVLAHLHLEKDYYEKRAVDIKDLAETIYQEHISHIEETDMSAPYVYDRFLYYTRDVKGLSYKLHCRVPAGKTPGEGEDEEIVLDENKLAEGKSFCVVGCVAPAPPEHALVAYSVDYCGDEVYSIRFVRDVVADKVEGTNGSVVWGPNAECFFYITKDASKRDNKVWRHIIGQPQSEDVCLYTDDDPLFSVGVGRSGDGKTLIICSMSSETSESHLLDLRKGVKHNTLEMVRPREKGVRYTVEMHGTDTLIVLTNKDKCVNGKVVLTKRSAPTDWGTVLIPHDDKVTIDDVVVFAKFAVLSGRRDGLTRVWTVRLGPDNLFSSATLKELHFDEPVFTAHVVCSQMKTYDASLLRLRYSSMTTPTVWYDEDVLSGERKVVKARKVGGGFESKNYVCRRELATAPDGTKVPISLVYDTSIDLKKPNPTMLYGYGSYGICIEPEFNSRFLPYVDRGMIYAIAHVRGGGEMGRTWYEVGGKYLTKRNTFMDFIACAEHLISSGLTTPAQLSCEGRSAGGLLVGAVLNMRPDLFHVALAGVPFVDVMTTMCDPSIPLTTGEWEEWGNPNEYKFFDYMNSYSPIDNARAQDYPHLMIQAGLHDPRVAYWEPAKWASKLRELKTDSNEVLLKMDLESGHFSASDRYKYLRENAIQQAFVLKHLNVRQLLRK,./data/raw/alphafold//AF-Q6QDP1-F1-model_v4.pdb,2916,1636,3241,2028
+1099,7129,7250,MAEYLRLPHSLAMIRLCNPPVNAVSPTVIREVRNGLQKAGSDHTVKAIVICGANGNFCAGADIHGFSAFTPGLALGSLVDEIQRYQKPVLAAIQGVALGGGLELALGCHYRIANAKARVGLPEVTLGILPGARGTQLLPRVVGVPVALDLITSGKYLSADEALRLGILDAVVKSDPVEEAIKFAQKIIDKPIEPRRIFNKPVPSLPNMDSVFAEAIAKVRKQYPGVLAPETCVRSIQASVKHPYEVGIKEEEKLFMYLRASGQAKALQYAFFAEKSANKWSTPSGASWKTASAQPVSSVGVLGLGTMGRGIAISFARVGISVVAVESDPKQLDAAKKIITFTLEKEASRAHQNGQASAKPKLRFSSSTKELSTVDLVVEAVFEDMNLKKKVFAELSALCKPGAFLCTNTSALNVDDIASSTDRPQLVIGTHFFSPAHVMRLLEVIPSRYSSPTTIATVMSLSKKIGKIGVVVGNCYGFVGNRMLAPYYNQGFFLLEEGSKPEDVDGVLEEFGFKMGPFRVSDLAGLDVGWKIRKGQGLTGPSLPPGTPVRKRGNSRYSPLGDMLCEAGRFGQKTGKGWYQYDKPLGRIHKPDPWLSTFLSQYREVHHIEQRTISKEEILERCLYSLINEAFRILEEGMAARPEHIDVIYLHGYGWPRHKGGPMFYAASVGLPTVLEKLQKYYRQNPDIPQLEPSDYLRRLVAQGSPPLKEWQSLAGPHGSKL,sabio,P07896,CCCCCCCC/C=C\C/C=C/C(=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>>CCCCCCCC/C=C\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-],12.0,0.2073318976422245,25.0,8.0,5.3.3.8,10116.0,1.0791812460476249,CCCCCCCC/C=C\C/C=C/C(=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,CCCCCCCC/C=C\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-],1.0791812460476249,CCCCCCCC/C=C\C/C=C/C(=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
+1100,12782,12954,MDIVVNDDLSCRFLEGFNTRDALCKKISMNTCDEGDPFFVADLGDIVRKHETWKKCLPRVTPFYAVKCNDDWRVLGTLAALGTGFDCASNTEIQRVRGIGVPPEKIIYANPCKQISHIRYARDSGVDVMTFDCVDELEKVAKTHPKAKMVLRISTDDSLARCRLSVKFGAKVEDCRFILEQAKKLNIDVTGVSFHVGSGSTDASTFAQAISDSRFVFDMGTELGFNMHILDIGGGFPGTRDAPLKFEEIAGVINNALEKHFPPDLKLTIVAEPGRYYVASAFTLAVNVIAKKVTPGVQTDVGAHAESNAQSFMYYVNDGVYGSFNCILYDHAVVRPLPQREPIPNEKLYPSSVWGPTCDGLDQIVERYYLPEMQVGEWLLFEDMGAYTVVGTSSFNGFQSPTIYYVVSGLPDHVVRELKSQKS,sabio,P07805,N=C(N)NCCCC(N)C(=O)O>>N=C(N)NCCCCN.O=C=O,1.0,0.0,37.0,8.0,4.1.1.17,5691.0,0.0,N=C(N)NCCCC(N)C(=O)O,N=C(N)NCCCCN.O=C=O,0.0,N=C(N)NCCCC(N)C(=O)O__MDIVVNDDLSCRFLEGFNTRDALCKKISMNTCDEGDPFFVADLGDIVRKHETWKKCLPRVTPFYAVKCNDDWRVLGTLAALGTGFDCASNTEIQRVRGIGVPPEKIIYANPCKQISHIRYARDSGVDVMTFDCVDELEKVAKTHPKAKMVLRISTDDSLARCRLSVKFGAKVEDCRFILEQAKKLNIDVTGVSFHVGSGSTDASTFAQAISDSRFVFDMGTELGFNMHILDIGGGFPGTRDAPLKFEEIAGVINNALEKHFPPDLKLTIVAEPGRYYVASAFTLAVNVIAKKVTPGVQTDVGAHAESNAQSFMYYVNDGVYGSFNCILYDHAVVRPLPQREPIPNEKLYPSSVWGPTCDGLDQIVERYYLPEMQVGEWLLFEDMGAYTVVGTSSFNGFQSPTIYYVVSGLPDHVVRELKSQKS,./data/raw/alphafold//AF-P07805-F1-model_v4.pdb,2175,4395,4287,4162
+1101,16827,17057,MAKIVVIGAGVAGLTTALQLLRKGHEVTIVSEFTPGDLSIGYTSPWAGANWLTFYDGGKLADYDAVSYPILRELARSSPEAGIRLISQRSHVLKRDLPKLEVAMSAICQRNPWFKNTVDSFEIIEDRSRIVHDDVAYLVEFRSVCIHTGVYLNWLMSQCLSLGATVVKRRVNHIKDANLLHSSGSRPDVIVNCSGLFARFLGGVEDKKMYPIRGQVVLVRNSLPFMASFSSTPEKENEDEALYIMTRFDGTSIIGGCFQPNNWSSEPDPSLTHRILSRALDRFPELTKDGPLDIVRECVGHRPGREGGPRVELEKIPGVGFVVHNYGAAGAGYQSSYGMADEAVSYVERALTRPNL,uniprot_search,Q99042,NCCCC[C@@H](N)C(=O)O.O.O=O>>N.NCCCCC(=O)C(=O)O.OO,3.54,7.224523629635546e-15,30.0,8.0,1.4.3.3,34364.0,0.5490032620257879,NCCCC[C@@H](N)C(=O)O.O.O=O,N.NCCCCC(=O)C(=O)O.OO,0.5490032620257879,NCCCC[C@@H](N)C(=O)O.O.O=O__MAKIVVIGAGVAGLTTALQLLRKGHEVTIVSEFTPGDLSIGYTSPWAGANWLTFYDGGKLADYDAVSYPILRELARSSPEAGIRLISQRSHVLKRDLPKLEVAMSAICQRNPWFKNTVDSFEIIEDRSRIVHDDVAYLVEFRSVCIHTGVYLNWLMSQCLSLGATVVKRRVNHIKDANLLHSSGSRPDVIVNCSGLFARFLGGVEDKKMYPIRGQVVLVRNSLPFMASFSSTPEKENEDEALYIMTRFDGTSIIGGCFQPNNWSSEPDPSLTHRILSRALDRFPELTKDGPLDIVRECVGHRPGREGGPRVELEKIPGVGFVVHNYGAAGAGYQSSYGMADEAVSYVERALTRPNL,./data/raw/alphafold//AF-Q99042-F1-model_v4.pdb,1451,981,790,1100
+1102,20219,20509,MKISDGNWLIQPGLNLIHPLQVFEVEQQDNEMVVYAAPRDVRERTWQLDTPLFTLRFFSPQEGIVGVRIEHFQGALNNGPHYPLNILQDVKVTIENTERYAEFKSGNLSARVSKGEFWSLDFLRNGERITGSQVKNNGYVQDTNNQRNYMFERLDLGVGETVYGLGERFTALVRNGQTVETWNRDGGTSTEQAYKNIPFYMTNRGYGVLVNHPQCVSFEVGSEKVSKVQFSVESEYLEYFVIDGPTPKAVLDRYTRFTGRPALPPAWSFGLWLTTSFTTNYDEATVNSFIDGMAERNLPLHVFHFDCFWMKAFQWCDFEWDPLTFPDPEGMIRRLKAKGLKICVWINPYIGQKSPVFKELQEKGYLLKRPDGSLWQWDKWQPGLAIYDFTNPDACKWYADKLKGLVAMGVDCFKTDFGERIPTDVQWFDGSDPQKMHNHYAYIYNELVWNVLKDTVGEEEAVLFARSASVGAQKFPVHWGGDCYANYESMAESLRGGLSIGLSGFGFWSHDIGGFENTAPAHVYKRWCAFGLLSSHSRLHGSKSYRVPWAYDDESCDVVRFFTQLKCRMMPYLYREAARANARGTPMMRAMMMEFPDDPACDYLDRQYMLGDNVMVAPVFTEAGDVQFYLPEGRWTHLWHNDELDGSRWHKQQHGFLSLPVYVRDNTLLALGNNDQRPDYVWHEGTAFHLFNLQDGHEAVCEVPAADGSVIFTLKAARTGNTITVTGAGEAKNWTLCLRNVVKVNGLQDGSQAESEQGLVVKPQGNALTITL,brenda,P31434,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]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,0.046,0.0,37.0,7.0,3.2.1.177,562.0,-1.337242168318426,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]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,-1.337242168318426,O.O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1__MKISDGNWLIQPGLNLIHPLQVFEVEQQDNEMVVYAAPRDVRERTWQLDTPLFTLRFFSPQEGIVGVRIEHFQGALNNGPHYPLNILQDVKVTIENTERYAEFKSGNLSARVSKGEFWSLDFLRNGERITGSQVKNNGYVQDTNNQRNYMFERLDLGVGETVYGLGERFTALVRNGQTVETWNRDGGTSTEQAYKNIPFYMTNRGYGVLVNHPQCVSFEVGSEKVSKVQFSVESEYLEYFVIDGPTPKAVLDRYTRFTGRPALPPAWSFGLWLTTSFTTNYDEATVNSFIDGMAERNLPLHVFHFDCFWMKAFQWCDFEWDPLTFPDPEGMIRRLKAKGLKICVWINPYIGQKSPVFKELQEKGYLLKRPDGSLWQWDKWQPGLAIYDFTNPDACKWYADKLKGLVAMGVDCFKTDFGERIPTDVQWFDGSDPQKMHNHYAYIYNELVWNVLKDTVGEEEAVLFARSASVGAQKFPVHWGGDCYANYESMAESLRGGLSIGLSGFGFWSHDIGGFENTAPAHVYKRWCAFGLLSSHSRLHGSKSYRVPWAYDDESCDVVRFFTQLKCRMMPYLYREAARANARGTPMMRAMMMEFPDDPACDYLDRQYMLGDNVMVAPVFTEAGDVQFYLPEGRWTHLWHNDELDGSRWHKQQHGFLSLPVYVRDNTLLALGNNDQRPDYVWHEGTAFHLFNLQDGHEAVCEVPAADGSVIFTLKAARTGNTITVTGAGEAKNWTLCLRNVVKVNGLQDGSQAESEQGLVVKPQGNALTITL,./data/raw/alphafold//AF-P31434-F1-model_v4.pdb,381,2952,5291,6168
+1103,13045,13220,MASFSAAVAQFSRVSPTLTLLHSHSHDRLFHSQCRPFFLSRPSHSLRKGLTLPRGREAPSTTVRASFTDVSPSVSLEEKQLPKGETWSVHKFGGTCVGTSQRIKNVADIILKDDSERKLVVVSAMSKVTDMMYDLIHKAQSRDESYIAALDAVSEKHSATAHDILDGDNLASFLSKLHHDISNLKAMLRAIYIAGHATESFTDFVVGHGELWSAQMLSLVITKNGADCKWMDTRDVLIVNPTGSNQVDPDYLESEQRLEKWYSLNPCKVIIATGFIASTPQNIPTTLKRDGSDFSAAIMGALFKARQVTIWTDVDGVYSADPRKVSEAVILKTLSYQEAWEMSYFGANVLHPRTIIPVMRYGIPIMIRNIFNLSAPGTKICHPSVNDHEDRQNLQNFVKGFATIDNLALVNVEGTGMAGVPGTASAIFGAVKDVGANVIMISQASSEHSVCFAVPEKEVKAVAEALQSRFRQALDNGRLSQVAVIPNCSILAAVGQKMASTPGVSASLFNALAKANINVRAIAQGCSEYNITVVVKREDCIKALRAVHSRFYLSRTTIAMGIIGPGLIGSTLLDQLRDQASTLKEEFNIDLRVMGILGSKSMLLSDVGIDLARWRELREERGEVANVEKFVQHVHGNHFIPNTALVDCTADSAIAGYYYDWLRKGIHVVTPNKKANSGPLDQYLKLRALQRQSYTHYFYEATVGAGLPIVSTLRGLLETGDKILQIEGIFSGTLSYIFNNFKDGRAFSEVVSEAKEAGYTEPDPRDDLSGTDVARKVIILARESGLKLELSNIPVESLVPEPLRACASAQEFMQEPPKFDQEFTKKQEDAENAGEVLRYVGVVDVTNEKGVVELRRYKKDHPFAQLSGSDNIIAFTTRRYKDQPLIVRGPGAGAQVTAGGIFSDILRLA,brenda,O65027,N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.N[C@@H](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.N[C@@H](CCO)C(=O)O,19.3,0.0,25.0,8.0,1.1.1.3,3847.0,1.285557309007774,N=C(O)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.N[C@@H](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.N[C@@H](CCO)C(=O)O,1.285557309007774,N=C(O)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.N[C@@H](CC=O)C(=O)O.[H+]__MASFSAAVAQFSRVSPTLTLLHSHSHDRLFHSQCRPFFLSRPSHSLRKGLTLPRGREAPSTTVRASFTDVSPSVSLEEKQLPKGETWSVHKFGGTCVGTSQRIKNVADIILKDDSERKLVVVSAMSKVTDMMYDLIHKAQSRDESYIAALDAVSEKHSATAHDILDGDNLASFLSKLHHDISNLKAMLRAIYIAGHATESFTDFVVGHGELWSAQMLSLVITKNGADCKWMDTRDVLIVNPTGSNQVDPDYLESEQRLEKWYSLNPCKVIIATGFIASTPQNIPTTLKRDGSDFSAAIMGALFKARQVTIWTDVDGVYSADPRKVSEAVILKTLSYQEAWEMSYFGANVLHPRTIIPVMRYGIPIMIRNIFNLSAPGTKICHPSVNDHEDRQNLQNFVKGFATIDNLALVNVEGTGMAGVPGTASAIFGAVKDVGANVIMISQASSEHSVCFAVPEKEVKAVAEALQSRFRQALDNGRLSQVAVIPNCSILAAVGQKMASTPGVSASLFNALAKANINVRAIAQGCSEYNITVVVKREDCIKALRAVHSRFYLSRTTIAMGIIGPGLIGSTLLDQLRDQASTLKEEFNIDLRVMGILGSKSMLLSDVGIDLARWRELREERGEVANVEKFVQHVHGNHFIPNTALVDCTADSAIAGYYYDWLRKGIHVVTPNKKANSGPLDQYLKLRALQRQSYTHYFYEATVGAGLPIVSTLRGLLETGDKILQIEGIFSGTLSYIFNNFKDGRAFSEVVSEAKEAGYTEPDPRDDLSGTDVARKVIILARESGLKLELSNIPVESLVPEPLRACASAQEFMQEPPKFDQEFTKKQEDAENAGEVLRYVGVVDVTNEKGVVELRRYKKDHPFAQLSGSDNIIAFTTRRYKDQPLIVRGPGAGAQVTAGGIFSDILRLA,./data/raw/alphafold//AF-O65027-F1-model_v4.pdb,2215,4451,4356,4242
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+1134,9138,9280,MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVEYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDRWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,sabio,P62593,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC12)c1ccco1.O>>,3.0,99.77447305629605,37.0,7.0,3.5.2.6,562.0,0.4771212547196624,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC12)c1ccco1.O,,1.4471580313422192,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(N)=O)CSC12)c1ccco1.O__MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVEYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDRWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,./data/raw/alphafold//AF-P62593-F1-model_v4.pdb,1458,402,35,2356
+1135,7222,7344,MPLDPEVRNFLQVYYKANIIDFTKYQFQEIRQKVNELLAKAVPKDPVGETRDMKIKLEDYELPIRIYSPIKRTNNGLVMHFHGGAWILGSIETEDAISRILSNSCECTVISVDYRLAPEYKFPTAVYDCFNAIVWARDNAGELGIDKDKIATFGISAGGNLVAATSLLARDNKLKLTAQVPVVPFVYLDLASKSMNRYRKGYFLDINLPVDYGVKMYIRDEKDLYNPLFSPLIAEDLSNLPQAIVVTAEYDPLRDQGEAYAYRLMESGVPTLSFRVNGNVHAFLGSPRTSRQVTVMIGALLKDIFK,brenda,B5BLW5,CCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCCCCCCCC(=O)[O-].O=[N+]([O-])c1ccc(O)cc1,341.0,0.1618632255743866,60.0,7.0,3.1.1.2,2287.0,2.5327543789924976,CCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCCCCCCCC(=O)[O-].O=[N+]([O-])c1ccc(O)cc1,2.5327543789924976,CCCCCCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MPLDPEVRNFLQVYYKANIIDFTKYQFQEIRQKVNELLAKAVPKDPVGETRDMKIKLEDYELPIRIYSPIKRTNNGLVMHFHGGAWILGSIETEDAISRILSNSCECTVISVDYRLAPEYKFPTAVYDCFNAIVWARDNAGELGIDKDKIATFGISAGGNLVAATSLLARDNKLKLTAQVPVVPFVYLDLASKSMNRYRKGYFLDINLPVDYGVKMYIRDEKDLYNPLFSPLIAEDLSNLPQAIVVTAEYDPLRDQGEAYAYRLMESGVPTLSFRVNGNVHAFLGSPRTSRQVTVMIGALLKDIFK,./data/raw/alphafold//AF-B5BLW5-F1-model_v4.pdb,1438,2105,884,1219
+1136,20344,20648,MAKNVVLDHDGNLDDFVAMVLLASNTEKVRLIGALCTDADCFVENGFNVTGKIMCLMHNNMNLPLFPIGKSAATAVNPFPKEWRCLAKNMDDMPILNIPENVELWDKIKAENEKYEGQQLLADLVMNSEEKVTICVTGPLSNVAWCIDKYGEKFTSKVEECVIMGGAVDVRGNVFLPSTDGTAEWNIYWDPASAKTVFGCPGLRRIMFSLDSTNTVPVRSPYVQRFGEQTNFLLSILVGTMWAMCTHCELLRDGDGYYAWDALTAAYVVDQKVANVDPVPIDVVVDKQPNEGATVRTDAEKYPLTFVARNPEAEFFLDMLLRSARAC,brenda,Q9GPQ4,O.O=c1nc(O)ccn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O>>OC[C@H]1OC(O)[C@H](O)[C@@H]1O.Oc1ccnc(O)n1,0.022,0.0,35.0,7.2,3.2.2.1,5699.0,-1.6575773191777938,O.O=c1nc(O)ccn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,OC[C@H]1OC(O)[C@H](O)[C@@H]1O.Oc1ccnc(O)n1,-1.6575773191777938,O.O=c1nc(O)ccn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O__MAKNVVLDHDGNLDDFVAMVLLASNTEKVRLIGALCTDADCFVENGFNVTGKIMCLMHNNMNLPLFPIGKSAATAVNPFPKEWRCLAKNMDDMPILNIPENVELWDKIKAENEKYEGQQLLADLVMNSEEKVTICVTGPLSNVAWCIDKYGEKFTSKVEECVIMGGAVDVRGNVFLPSTDGTAEWNIYWDPASAKTVFGCPGLRRIMFSLDSTNTVPVRSPYVQRFGEQTNFLLSILVGTMWAMCTHCELLRDGDGYYAWDALTAAYVVDQKVANVDPVPIDVVVDKQPNEGATVRTDAEKYPLTFVARNPEAEFFLDMLLRSARAC,./data/raw/alphafold//AF-Q9GPQ4-F1-model_v4.pdb,1908,4043,1896,3724
+1137,10956,11111,MSGWARALLLAAVLVVMACLVPAATASLHAEETLTSQFAEFKQKHGRVYESAAEEAFRLSVFRENLFLARLHAAANPHATFGVTPFSDLTREEFRSRYHNGAAHFAAAQERARVPVKVEVVGAPAAVDWRARGAVTAVKDQGQCGSCWAFSAIGNVECQWFLAGHPLTNLSEQMLVSCDKTDSGCSGGLMNNAFEWIVQENNGAVYTEDSYPYASGEGISPPCTTSGHTVGATITGHVELPQDEAQIAAWLAVNGPVAVAVDASSWMTYTGGVMTSCVSEQLDHGVLLVGYNDSAAVPYWIIKNSWTTQWGEEGYIRIAKGSNQCLVKEEASSAVVGGPGPTPEPTTTTTTSAPGPSPSYFVQMSCTDAACIVGCENVTLPTGQCLLTTSGVSAIVTCGAETLTEEVFLTSTHCSGPSVRSSVPLNKCNRLLRGSVEFFCGSSSSGRLADVDRQRRHQPYHSRHRRL,uniprot_search,P25779,C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccccc1)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=N)O.O>>,4.2,99.87862324777488,37.0,5.5,3.4.22.51,5693.0,0.6232492903979004,C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccccc1)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=N)O.O,,0.6232492903979004,C[C@H](N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](Cc1ccccc1)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=N)O.O__MSGWARALLLAAVLVVMACLVPAATASLHAEETLTSQFAEFKQKHGRVYESAAEEAFRLSVFRENLFLARLHAAANPHATFGVTPFSDLTREEFRSRYHNGAAHFAAAQERARVPVKVEVVGAPAAVDWRARGAVTAVKDQGQCGSCWAFSAIGNVECQWFLAGHPLTNLSEQMLVSCDKTDSGCSGGLMNNAFEWIVQENNGAVYTEDSYPYASGEGISPPCTTSGHTVGATITGHVELPQDEAQIAAWLAVNGPVAVAVDASSWMTYTGGVMTSCVSEQLDHGVLLVGYNDSAAVPYWIIKNSWTTQWGEEGYIRIAKGSNQCLVKEEASSAVVGGPGPTPEPTTTTTTSAPGPSPSYFVQMSCTDAACIVGCENVTLPTGQCLLTTSGVSAIVTCGAETLTEEVFLTSTHCSGPSVRSSVPLNKCNRLLRGSVEFFCGSSSSGRLADVDRQRRHQPYHSRHRRL,./data/raw/alphafold//AF-P25779-F1-model_v4.pdb,1573,1145,984,1328
+1138,22227,22560,YFFSLFLVTIFLYKWLAKKTPSKNLPPSPPRLPIIGNLHQIGPDLHISLRDLARKYGPLMQLQLGRIPVLVVSSAEATREVLKTHDVVFSQRPITSAIDKLCYKGRDVAFSRYSEYWRQVRSTCVTQLLSNSRVHSFHNIREEEVALLIQNIENSASEVINLGEQLIQLTRNVVCRVSVGSEYLSGHKGKLYQKLLAEVTEMLAYTYSIGDFIPLLGWVDWLSGSKAKVEKTAKEVDAFLEGALRDHIKTMASNKGSANDDFLSILLEIREADAGSTLDEECIKAIVWDMILGGTETTSTTLEWIVAAIIKNPDVMFKLQKEVREIGKGKSKIEEVDLVKMNYLKAVMKESMRLYITAFLLPREAKQDVKLMGYDISSGTQVLINTWETARDPSLWDNPEEFRPERFLNSPIDYKGLHYEYLPFGGGRRGCPGIQFAMAVNELAVANVVYKFDFKMPDGERFEDLDMSGVPGISLYRK,brenda,C0SJS3,O=O.[2H][C@@H]1c2c(ccc3ccc(=O)oc23)O[C@@H]1C(C)(C)O>>O.[2H][C@]1(O)c2c(ccc3ccc(=O)oc23)O[C@@H]1C(C)(C)O,0.06,10000000.0,28.5,7.0,1.14.14.148,4041.0,-1.2218487496163564,O=O.[2H][C@@H]1c2c(ccc3ccc(=O)oc23)O[C@@H]1C(C)(C)O,O.[2H][C@]1(O)c2c(ccc3ccc(=O)oc23)O[C@@H]1C(C)(C)O,0.5910646070264992,O=O.[2H][C@@H]1c2c(ccc3ccc(=O)oc23)O[C@@H]1C(C)(C)O__YFFSLFLVTIFLYKWLAKKTPSKNLPPSPPRLPIIGNLHQIGPDLHISLRDLARKYGPLMQLQLGRIPVLVVSSAEATREVLKTHDVVFSQRPITSAIDKLCYKGRDVAFSRYSEYWRQVRSTCVTQLLSNSRVHSFHNIREEEVALLIQNIENSASEVINLGEQLIQLTRNVVCRVSVGSEYLSGHKGKLYQKLLAEVTEMLAYTYSIGDFIPLLGWVDWLSGSKAKVEKTAKEVDAFLEGALRDHIKTMASNKGSANDDFLSILLEIREADAGSTLDEECIKAIVWDMILGGTETTSTTLEWIVAAIIKNPDVMFKLQKEVREIGKGKSKIEEVDLVKMNYLKAVMKESMRLYITAFLLPREAKQDVKLMGYDISSGTQVLINTWETARDPSLWDNPEEFRPERFLNSPIDYKGLHYEYLPFGGGRRGCPGIQFAMAVNELAVANVVYKFDFKMPDGERFEDLDMSGVPGISLYRK,./data/raw/alphafold//AF-C0SJS3-F1-model_v4.pdb,2132,1333,6258,1603
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+1152,10627,10782,MTLEERVEALEKELQEMKDIEAIKELKGKYFRCLDGKMWDELETTLSPNIVTSYSNGKLVFHSPKEVTDYLKSSMPKEEISMHMGHTPEITIDSETTATGRWYLEDRLIFTDGKYKDVGINGGAFYTDKYEKIDGQWYILETGYVRIYEEHFMRDPKIHITMNMHK,brenda,P19412,C[C@H](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)[C@H]1CC[C@H]2[C@@H]3[C@H](O)CC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C>>C[C@H](CCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,98.0,1.4095796160411127,25.0,7.3,4.2.1.106,29347.0,1.9912260756924949,C[C@H](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)[C@H]1CC[C@H]2[C@@H]3[C@H](O)CC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,C[C@H](CCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C,1.9912260756924949,C[C@H](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)[C@H]1CC[C@H]2[C@@H]3[C@H](O)CC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C__MTLEERVEALEKELQEMKDIEAIKELKGKYFRCLDGKMWDELETTLSPNIVTSYSNGKLVFHSPKEVTDYLKSSMPKEEISMHMGHTPEITIDSETTATGRWYLEDRLIFTDGKYKDVGINGGAFYTDKYEKIDGQWYILETGYVRIYEEHFMRDPKIHITMNMHK,./data/raw/alphafold//AF-P19412-F1-model_v4.pdb,3710,3719,1521,3491
+1153,17689,17931,MSKYADDLALALELAELADSITLDRFEASDLEVSSKPDMTPVSDADLATEEALREKIATARPADSILGEEFGGDVEFSGRQWIIDPIDGTKNYVRGVPVWATLIALLDNGKPVAGVISAPALARRWWASEGAGAWRTFNGSSPRKLSVSQVSKLDDASLSFSSLSGWAERDLRDQFVSLTDTTWRLRGYGDFFSYCLVAEGAVDIAAEPEVSLWDLAPLSILVTEAGGKFTSLAGVDGPHGGDAVATNGILHDETLDRLK,brenda,Q8NS80,N[C@H](COP(=O)(O)O)Cc1cnc[nH]1.O>>N[C@H](CO)Cc1cnc[nH]1.O=P(O)(O)O,1.04,0.0,30.0,7.4,3.1.3.15,1718.0,0.0170333392987803,N[C@H](COP(=O)(O)O)Cc1cnc[nH]1.O,N[C@H](CO)Cc1cnc[nH]1.O=P(O)(O)O,0.0170333392987803,N[C@H](COP(=O)(O)O)Cc1cnc[nH]1.O__MSKYADDLALALELAELADSITLDRFEASDLEVSSKPDMTPVSDADLATEEALREKIATARPADSILGEEFGGDVEFSGRQWIIDPIDGTKNYVRGVPVWATLIALLDNGKPVAGVISAPALARRWWASEGAGAWRTFNGSSPRKLSVSQVSKLDDASLSFSSLSGWAERDLRDQFVSLTDTTWRLRGYGDFFSYCLVAEGAVDIAAEPEVSLWDLAPLSILVTEAGGKFTSLAGVDGPHGGDAVATNGILHDETLDRLK,./data/raw/alphafold//AF-Q8NS80-F1-model_v4.pdb,2824,2399,2677,5518
+1154,17605,17847,MKVMECQTYEELSQIAARITADTIKEKPDAVLGLATGGTPEGTYRQLIRLHQTENLSFQNITTVNLDEYAGLSSDDPNSYHFYMNDRFFQHIDSKPSRHFIPNGNADDLEAECRRYEQLVDSLGDTDIQLLGIGRNGHIGFNEPGTSFKSRTHVVTLNEQTRQANARYFPSIDSVPKKALTMGIQTILSSKRILLLISGKSKAEAVRKLLEGNISEDFPASALHLHSDVTVLIDREAASLRP,brenda,O35000,N[C@@H]1[C@@H](O)[C@H](O)[C@@H](COP(=O)(O)O)O[C@@H]1O.O>>N.O=P(O)(O)OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,110.0,1.023593433492182e-14,37.0,7.4,3.5.99.6,1423.0,2.041392685158225,N[C@@H]1[C@@H](O)[C@H](O)[C@@H](COP(=O)(O)O)O[C@@H]1O.O,N.O=P(O)(O)OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,2.041392685158225,N[C@@H]1[C@@H](O)[C@H](O)[C@@H](COP(=O)(O)O)O[C@@H]1O.O__MKVMECQTYEELSQIAARITADTIKEKPDAVLGLATGGTPEGTYRQLIRLHQTENLSFQNITTVNLDEYAGLSSDDPNSYHFYMNDRFFQHIDSKPSRHFIPNGNADDLEAECRRYEQLVDSLGDTDIQLLGIGRNGHIGFNEPGTSFKSRTHVVTLNEQTRQANARYFPSIDSVPKKALTMGIQTILSSKRILLLISGKSKAEAVRKLLEGNISEDFPASALHLHSDVTVLIDREAASLRP,./data/raw/alphafold//AF-O35000-F1-model_v4.pdb,2690,3788,2367,5269
+1155,11021,11176,MKPPAACAGDVVDTVSPCSTVNHLRWDLSAQQIRALTTQLIEQTKCVYDRVGAQDFEDVSYESTLKALADVEVTYTVQRNILDFPQHVSPNKDIRAASTEADKKLSEFDVEMSMRQDVYQRVVWLQEKIPKDSLKPEAARYLERLIKLGRRNGLHLPQDTQEKIKNIKKRLSLLCIDFNKNLNEDTTFLPFTREELGGLPEDFLNSLEKTEDGKLKVTLKYPHYFPLLKKCHVPETRRLLEEAFNCRCKEENCAILKELVSLRAQKSNLLGFRTHADYVLEMNMAKTSQTVATFLDELARKLKPLGEQERAVILELKEAECAKRGLPFDGRIHAWDMRYYMNQVEETRYRVDQNLLKEYFPMQVVTRGLLAIYQELLGLTFTLEEGAAAWHEDVRLYSVRDAASGEEIGKFYLDLYPREGKYGHAACFGLQPGCLRQDGSRQLAIAAMVANFTKPTPDVPSLLQHDEVETYFHEFGHVMHQLCSQAEFAMFSGTHVERDFVEAPSQMLENWVWEKEPLMRMSQHYRTGGEAPEDLLEKLIKSRQANAGLFNLRQIVLAKVDQVLHTQTDVDPAEEYARLCQEILGVPATPGTNMPATFGHLAGGYDAQYYGYLWSEVYSMDMFHTRFKQEGVLSPKVGMDYRTSILRPGGSEDASTMLKQFLGRDPKQDAFLLSKGLQVEGCEPPAC,uniprot_search,P24155,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>>C[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(=O)O.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-],2.6,33.32405560624289,37.0,7.4,3.4.24.15,10116.0,0.414973347970818,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,C[C@H](N=C(O)c1ccccc1N)C(O)=N[C@@H](Cc1ccccc1)C(=O)O.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-],0.9912260756924948,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
+1156,19229,19515,MKRHYEAVVIGGGIIGSAIAYYLAKENKNTALFESGTMGGRTTSAAAGMLGAHAECEERDAFFDFAMHSQRLYKGLGEELYALSGVDIRQHNGGMFKLAFSEEDVLQLRQMDDLDSVSWYSKEEVLEKEPYASGDIFGASFIQDDVHVEPYFVCKAYVKAAKMLGAEIFEHTPVLHVERDGEALFIKTPSGDVWANHVVVASGVWSGMFFKQLGLNNAFLPVKGECLSVWNDDIPLTKTLYHDHCYIVPRKSGRLVVGATMKPGDWSETPDLGGLESVMKKAKTMLPAIQNMKVDRFWAGLRPGTKDGKPYIGRHPEDSRILFAAGHFRNGILLAPATGALISDLIMNKEVNQDWLHAFRIDRKEAVQI,sabio,O31616,O.O=C(O)C1CCCN1.O=O>>CCCC(=O)C(=O)O.N.OO,0.5,0.6048495976669975,25.0,8.5,1.4.3.19,1423.0,-0.3010299956639812,O.O=C(O)C1CCCN1.O=O,CCCC(=O)C(=O)O.N.OO,-0.3010299956639812,O.O=C(O)C1CCCN1.O=O__MKRHYEAVVIGGGIIGSAIAYYLAKENKNTALFESGTMGGRTTSAAAGMLGAHAECEERDAFFDFAMHSQRLYKGLGEELYALSGVDIRQHNGGMFKLAFSEEDVLQLRQMDDLDSVSWYSKEEVLEKEPYASGDIFGASFIQDDVHVEPYFVCKAYVKAAKMLGAEIFEHTPVLHVERDGEALFIKTPSGDVWANHVVVASGVWSGMFFKQLGLNNAFLPVKGECLSVWNDDIPLTKTLYHDHCYIVPRKSGRLVVGATMKPGDWSETPDLGGLESVMKKAKTMLPAIQNMKVDRFWAGLRPGTKDGKPYIGRHPEDSRILFAAGHFRNGILLAPATGALISDLIMNKEVNQDWLHAFRIDRKEAVQI,./data/raw/alphafold//AF-O31616-F1-model_v4.pdb,2942,1676,3286,2084
+1157,21169,21493,MTVTTLDSLSERRGADVLLEVLRSEGVRYIFGNPGTTELPLIDALTDAPDIAYVLALQEASAVAMADGYAQGARRPGFLNLHTAGGLGHGMGNLLNAQISGTPLVVTAGQQDSRHVITDPLLFGDLTTIAAPTVKWAREVTHADQLPVLLRRAFHDSAAAPSGPVFLSLPMDVMEAMTAAPLGEISTIDHHAVAGSLDRLADHLAGIAPGRLALIAGDEVDASDASTQAVRLADLLAAPVYGSSWPAHIPFPTAHPLWMGNLPTKASGIAEILGRYDAVFALGGKSLITVLYTEGSAVPPGTQVFQLSADARDLGRTYATQLSTVGNVRASLDVLLPLLEARLAPHAETYARLRREAVAAYDARRAALEAKADAAFADPVIHPLVAAREIGRAVGSDIAIIDEAPATLGHLRTILHSTWTRQYSSIRGGVLGWGMPASVGFSLGLDRAPVVCIVGDGAAMYSPQALWTAAHEGLPVTFVVINNAEYNILKQFMKSQTHYASVRANRFIAMDLTEPRIDFLALATSMGVPSRRVERAADIAGAVEAGIRSGAPNLVEVVVSAA,brenda,C5ARG4,O=C(O)C(=O)Cc1c[nH]c2ccccc12>>O=C=O.O=CCc1c[nH]c2ccccc12,0.64,0.0,30.0,7.5625,4.1.1.74,408.0,-0.1938200260161128,O=C(O)C(=O)Cc1c[nH]c2ccccc12,O=C=O.O=CCc1c[nH]c2ccccc12,-0.1938200260161128,O=C(O)C(=O)Cc1c[nH]c2ccccc12__MTVTTLDSLSERRGADVLLEVLRSEGVRYIFGNPGTTELPLIDALTDAPDIAYVLALQEASAVAMADGYAQGARRPGFLNLHTAGGLGHGMGNLLNAQISGTPLVVTAGQQDSRHVITDPLLFGDLTTIAAPTVKWAREVTHADQLPVLLRRAFHDSAAAPSGPVFLSLPMDVMEAMTAAPLGEISTIDHHAVAGSLDRLADHLAGIAPGRLALIAGDEVDASDASTQAVRLADLLAAPVYGSSWPAHIPFPTAHPLWMGNLPTKASGIAEILGRYDAVFALGGKSLITVLYTEGSAVPPGTQVFQLSADARDLGRTYATQLSTVGNVRASLDVLLPLLEARLAPHAETYARLRREAVAAYDARRAALEAKADAAFADPVIHPLVAAREIGRAVGSDIAIIDEAPATLGHLRTILHSTWTRQYSSIRGGVLGWGMPASVGFSLGLDRAPVVCIVGDGAAMYSPQALWTAAHEGLPVTFVVINNAEYNILKQFMKSQTHYASVRANRFIAMDLTEPRIDFLALATSMGVPSRRVERAADIAGAVEAGIRSGAPNLVEVVVSAA,./data/raw/alphafold//AF-C5ARG4-F1-model_v4.pdb,1252,5187,1571,697
+1158,10019,10169,MARNIVVEEIVRTPVEMQQVELVERKGIGHPDSIADGIAEAVSRALCREYIRRYGVILHHNTDQVEVVGGRAYPRFGGGEVVKPIYILLSGRAVELVDQELFPVHEVAIKAAKNYLKNAIRHLDVENHVIIDSRIGQGSVDLVSVFNKARENPIPLANDTSFGVGYAPLSETERLVLETEKLLNSEKFKKEYPAVGEDIKVMGLRRGNEIDLTIAAAIVDSEVATPKEYLEVKDKIKEAVEELAKEITSRKVNIYVNTADDPERGIYYITVTGTSAEAGDDGSVGRGNRVNGLITPNRHMSMEAAAGKNPVSHVGKIYNILAMLIAEDIAKTLPVEEVYVRILSQIGKPIDQPLVASIQVIPKPGHSVKEFEKDAYSIADEWLANITKVQKMILEDKISVF,brenda,Q8TZW1,CSCC[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.O>>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=P(O)(O)O.O=P(O)(O)OP(=O)(O)O,7.5,0.0746206782190559,80.0,8.0,2.5.1.6,2261.0,0.8750612633917001,CSCC[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.O,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=P(O)(O)O.O=P(O)(O)OP(=O)(O)O,0.8750612633917001,CSCC[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.O__MARNIVVEEIVRTPVEMQQVELVERKGIGHPDSIADGIAEAVSRALCREYIRRYGVILHHNTDQVEVVGGRAYPRFGGGEVVKPIYILLSGRAVELVDQELFPVHEVAIKAAKNYLKNAIRHLDVENHVIIDSRIGQGSVDLVSVFNKARENPIPLANDTSFGVGYAPLSETERLVLETEKLLNSEKFKKEYPAVGEDIKVMGLRRGNEIDLTIAAAIVDSEVATPKEYLEVKDKIKEAVEELAKEITSRKVNIYVNTADDPERGIYYITVTGTSAEAGDDGSVGRGNRVNGLITPNRHMSMEAAAGKNPVSHVGKIYNILAMLIAEDIAKTLPVEEVYVRILSQIGKPIDQPLVASIQVIPKPGHSVKEFEKDAYSIADEWLANITKVQKMILEDKISVF,./data/raw/alphafold//AF-Q8TZW1-F1-model_v4.pdb,3610,3580,1363,3321
+1159,15142,15354,MKLNFSGLRALVTGAGKGIGRDTVKALHASGAKVVAVTRTNSDLVSLAKECPGIEPVCVDLGDWDATEKALGGIGPVDLLVNNAALVIMQPFLEVTKEAFDRSFSVNLRSVFQVSQMVARDMINRGVPGSIVNVSSMVAHVTFPNLITYSSTKGAMTMLTKAMAMELGPHKIRVNSVNPTVVLTDMGKKVSADPEFARKLKERHPLRKFAEVEDVVNSILFLLSDRSASTSGGGILVDAGYLAS,sabio,P08074,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=Cc1cccnc1.[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.OCc1cccnc1,1.8,0.0,25.0,7.0,1.1.1.184,10090.0,0.255272505103306,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=Cc1cccnc1.[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.OCc1cccnc1,0.255272505103306,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=Cc1cccnc1.[H]__MKLNFSGLRALVTGAGKGIGRDTVKALHASGAKVVAVTRTNSDLVSLAKECPGIEPVCVDLGDWDATEKALGGIGPVDLLVNNAALVIMQPFLEVTKEAFDRSFSVNLRSVFQVSQMVARDMINRGVPGSIVNVSSMVAHVTFPNLITYSSTKGAMTMLTKAMAMELGPHKIRVNSVNPTVVLTDMGKKVSADPEFARKLKERHPLRKFAEVEDVVNSILFLLSDRSASTSGGGILVDAGYLAS,./data/raw/alphafold//AF-P08074-F1-model_v4.pdb,1316,3874,2079,4940
+1160,22296,22630,MRYGHFDDEAREYVITTPHTPYPWINYLGSEQFFSLLSHQAGGYSFYRDAKMRRLTRYRYNNIPADAGGRYLYVNDGGDVWTPSWLPVKADLDHFEARHGLGYSTITGERNGVRVETLFFVPVGENAEVQKVTVTNTSDSYKSLTLFSFVEFCLWNAQDDQTNYQRNLSIGEVEVEQESPHGSAIYHRTEYRERRDHYAVFAVNTQAEGFDTDRDTFVGAYNSLGEAAVPLKGESANSVASGWYPIGSHSVAVSLAPGESRELVYVLGYVENPDEEKWADDAKQVVNKERAHALLSRFATSEQTDAAFAALKDYWTDLLSTYSVSSNDEKLDRMVNIWNQYQCMVTFNMSRSASFFETGIGRGMGFRDSNQDLLGFVHLIPERARERIIDIASTQFADGSAYHQYQPLTKRGNNDIGSGFNDDPLWLIAGTAAYIKETGDFSILDEPVPFDNEPGSEVPLFEHLTRSFEFTVTHRGPHGLPLIGRADWNDCLNLNCFSTTPGESFQTTENQAGGVAESTFIAAQFVLYGEQYAELAARRGLADVADRARGHVAEMRDALLTDGWDGSWFLRAYDYYGNPIGTDAHDEGKIWIEPQGFAVMAGVGVGEGPQDTDAPAIKALDSVNEMLATDHGMVLQYPAYTTYQVHMGEVSTYPPGYKENGGIFCHNNPWVIIAETVVGRGGRAFDYYKRITPAYREDISDVHRLEPYVYAQMIAGKEAVRHGEAKNSWLTGTAAWNFVTVSQYLLGVRPEYDGLVVDPQIGPDVPSFTVTRVARGATYEITVTNSGTDGSRGRLVVDGTPVEGNLVPYAPAGSTVRVDVTL,brenda,Q7WTR6,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,13.2,0.0,37.0,6.6,2.4.1.20,1714.0,1.1205739312058498,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,1.4638929889859074,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__MRYGHFDDEAREYVITTPHTPYPWINYLGSEQFFSLLSHQAGGYSFYRDAKMRRLTRYRYNNIPADAGGRYLYVNDGGDVWTPSWLPVKADLDHFEARHGLGYSTITGERNGVRVETLFFVPVGENAEVQKVTVTNTSDSYKSLTLFSFVEFCLWNAQDDQTNYQRNLSIGEVEVEQESPHGSAIYHRTEYRERRDHYAVFAVNTQAEGFDTDRDTFVGAYNSLGEAAVPLKGESANSVASGWYPIGSHSVAVSLAPGESRELVYVLGYVENPDEEKWADDAKQVVNKERAHALLSRFATSEQTDAAFAALKDYWTDLLSTYSVSSNDEKLDRMVNIWNQYQCMVTFNMSRSASFFETGIGRGMGFRDSNQDLLGFVHLIPERARERIIDIASTQFADGSAYHQYQPLTKRGNNDIGSGFNDDPLWLIAGTAAYIKETGDFSILDEPVPFDNEPGSEVPLFEHLTRSFEFTVTHRGPHGLPLIGRADWNDCLNLNCFSTTPGESFQTTENQAGGVAESTFIAAQFVLYGEQYAELAARRGLADVADRARGHVAEMRDALLTDGWDGSWFLRAYDYYGNPIGTDAHDEGKIWIEPQGFAVMAGVGVGEGPQDTDAPAIKALDSVNEMLATDHGMVLQYPAYTTYQVHMGEVSTYPPGYKENGGIFCHNNPWVIIAETVVGRGGRAFDYYKRITPAYREDISDVHRLEPYVYAQMIAGKEAVRHGEAKNSWLTGTAAWNFVTVSQYLLGVRPEYDGLVVDPQIGPDVPSFTVTRVARGATYEITVTNSGTDGSRGRLVVDGTPVEGNLVPYAPAGSTVRVDVTL,./data/raw/alphafold//AF-Q7WTR6-F1-model_v4.pdb,770,196,1756,3563
+1161,20196,20485,MLAFPKEFWWGGATSGPQSEGRFAKQHRNLFDYWYEEEPDLFYDYVGPDTASDAYHQIESDLTLLASLGHNSYRTSIQWTRLIDDFEQATINPDGLAYYNRVIDACLANGIRPVINLHHFDLPIALYQAYGGWESKHVVDLFVAFSKVCFEQFGDRVKDWFVHNEPMVVVEGSYLMQFHYPAIVDGKKAVQVAYNLALATAKVIQAYRRGPAELSDGRIGTILNLTPAYPASQSEADMAAAHFAELWNNDLFMEAAVHGKFPEELVAVLKKDGVLWQSTPEELALIAENRVDYLGLNFYHPKRVKAPDAIPVISPSWSPEWYYDPYLMPGRRMNVDKGWEIYPEAVYDIAIKMRDHYDNIPWFLSENGVGISGEDRYRDETGQIQDDYRIQFLKEHLTYLHKGIEAGSNCFGYHVWTPIDGWSWLNAYKNRYGLVENNIHTQVRRPKASAYWFKKVATHNRLISLEVMEEFGGSASHLSD,brenda,Q99YP9,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O)[C@H]2O)cc1>>O=P(O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.O=[N+]([O-])c1ccc(O)cc1,0.24,7.109959957073639e-15,37.0,6.0,3.2.1.86,1314.0,-0.619788758288394,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O)[C@H]2O)cc1,O=P(O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.O=[N+]([O-])c1ccc(O)cc1,-0.619788758288394,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O)[C@H]2O)cc1__MLAFPKEFWWGGATSGPQSEGRFAKQHRNLFDYWYEEEPDLFYDYVGPDTASDAYHQIESDLTLLASLGHNSYRTSIQWTRLIDDFEQATINPDGLAYYNRVIDACLANGIRPVINLHHFDLPIALYQAYGGWESKHVVDLFVAFSKVCFEQFGDRVKDWFVHNEPMVVVEGSYLMQFHYPAIVDGKKAVQVAYNLALATAKVIQAYRRGPAELSDGRIGTILNLTPAYPASQSEADMAAAHFAELWNNDLFMEAAVHGKFPEELVAVLKKDGVLWQSTPEELALIAENRVDYLGLNFYHPKRVKAPDAIPVISPSWSPEWYYDPYLMPGRRMNVDKGWEIYPEAVYDIAIKMRDHYDNIPWFLSENGVGISGEDRYRDETGQIQDDYRIQFLKEHLTYLHKGIEAGSNCFGYHVWTPIDGWSWLNAYKNRYGLVENNIHTQVRRPKASAYWFKKVATHNRLISLEVMEEFGGSASHLSD,./data/raw/alphafold//AF-Q99YP9-F1-model_v4.pdb,444,3109,5395,6276
+1162,6214,6323,MKQFSAKHALAVVVTAGHALAASTQGISEDLYTRLVEMATISQAAYADLCNIPSTIIKGEKIYNSQTDINGWILRDDSSKEIITVFRGTGSDTNLQLDTNYTLTPFDTLPQCNGCEVHGGYYIGWVSVQDQVESLVKQQVSQYPDYALTVTGHSLGASLAALTAAQLSATYDNIRLYTFGEPRSGNQAFASYMNDAFQASSPDTTQYFRVTHANDGIPNLPPVEQGYAHGGVEYWSVDPYSAQNTFVCTGDEVQCCEAQGGQGVNNAHTTYFGMTSGACTW,sabio,Q9P979,CCC(C(=O)O)c1cccc2ccccc12.O>>CCCC(=O)O.Oc1cccc2ccccc12,2.33,1.2209739465503342e-14,37.0,5.0,3.1.1.73,105351.0,0.367355921026019,CCC(C(=O)O)c1cccc2ccccc12.O,CCCC(=O)O.Oc1cccc2ccccc12,0.367355921026019,CCC(C(=O)O)c1cccc2ccccc12.O__MKQFSAKHALAVVVTAGHALAASTQGISEDLYTRLVEMATISQAAYADLCNIPSTIIKGEKIYNSQTDINGWILRDDSSKEIITVFRGTGSDTNLQLDTNYTLTPFDTLPQCNGCEVHGGYYIGWVSVQDQVESLVKQQVSQYPDYALTVTGHSLGASLAALTAAQLSATYDNIRLYTFGEPRSGNQAFASYMNDAFQASSPDTTQYFRVTHANDGIPNLPPVEQGYAHGGVEYWSVDPYSAQNTFVCTGDEVQCCEAQGGQGVNNAHTTYFGMTSGACTW,./data/raw/alphafold//AF-Q9P979-F1-model_v4.pdb,1465,1001,817,2528
+1163,3448,3496,MKAANASSAEAYRVLSRAFRFDNEDQKLWWHSTAPMFAKMLETANYTTPCQYQYLITYKECVIPSLGCYPTNSAPRWLSILTRYGTPFELSLNCSNSIVRYTFEPINQHTGTDKDPFNTHAIWESLQHLLPLEKSIDLEWFRHFKHDLTLNSEESAFLAHNDRLVGGTIRTQNKLALDLKDGRFALKTYIYPALKAVVTGKTIHELVFGSVRRLAVREPRILPPLNMLEEYIRSRGSKSTASPRLVSCDLTSPAKSRIKIYLLEQMVSLEAMEDLWTLGGRRRDASTLEGLSLVRELWDLIQLSPGLKSYPAPYLPLGVIPDERLPLMANFTLHQNDPVPEPQVYFTTFGMNDMAVADALTTFFERRGWSEMARTYETTLKSYYPHADHDKLNYLHAYISFSYRDRTPYLSVYLQSFETGDWAVANLSESKVKCQDAACQPTSLPPDLSKTGVYYSGLH,brenda,Q50EL0,CC(C)=CCOP(=O)(O)OP(=O)(O)O.C[C@H]1C(O)=N[C@H](Cc2c[nH]c3ccccc23)c2nc3ccccc3c(=O)n21>>O=P(O)(O)OP(=O)(O)O,0.0016,54.440141627077615,37.0,7.5,2.5.1.34,746128.0,-2.7958800173440754,CC(C)=CCOP(=O)(O)OP(=O)(O)O.C[C@H]1C(O)=N[C@H](Cc2c[nH]c3ccccc23)c2nc3ccccc3c(=O)n21,O=P(O)(O)OP(=O)(O)O,-2.7958800173440754,CC(C)=CCOP(=O)(O)OP(=O)(O)O.C[C@H]1C(O)=N[C@H](Cc2c[nH]c3ccccc23)c2nc3ccccc3c(=O)n21__MKAANASSAEAYRVLSRAFRFDNEDQKLWWHSTAPMFAKMLETANYTTPCQYQYLITYKECVIPSLGCYPTNSAPRWLSILTRYGTPFELSLNCSNSIVRYTFEPINQHTGTDKDPFNTHAIWESLQHLLPLEKSIDLEWFRHFKHDLTLNSEESAFLAHNDRLVGGTIRTQNKLALDLKDGRFALKTYIYPALKAVVTGKTIHELVFGSVRRLAVREPRILPPLNMLEEYIRSRGSKSTASPRLVSCDLTSPAKSRIKIYLLEQMVSLEAMEDLWTLGGRRRDASTLEGLSLVRELWDLIQLSPGLKSYPAPYLPLGVIPDERLPLMANFTLHQNDPVPEPQVYFTTFGMNDMAVADALTTFFERRGWSEMARTYETTLKSYYPHADHDKLNYLHAYISFSYRDRTPYLSVYLQSFETGDWAVANLSESKVKCQDAACQPTSLPPDLSKTGVYYSGLH,./data/raw/alphafold//AF-Q50EL0-F1-model_v4.pdb,1053,612,281,308
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+1165,11182,11338,MQDWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRFGGTSAYSGASIWLPGTQVQERAGLPDSTENARTYLRALLGDAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADIGDLAGKVRPELDQDRTGQDHAPGPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDGRVVGAEVESGGETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALLDQAWFCPGVEQPDGSAAFMVGVRGGLVVDSAGERYLNESLPYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTAPAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFCPPNGGANAALTAIENGPFYAARIVLSDLGTKGGLVTDVNGRVLRADGSAIDGLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK,brenda,Q9RA02,C[C@]12CCC(=O)C=C1CC[C@@H]1C2=CC[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CCl>>,12.8,10000000.0,30.0,8.0,1.3.99.4,1833.0,1.1072099696478683,C[C@]12CCC(=O)C=C1CC[C@@H]1C2=CC[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CCl,,1.1072099696478683,C[C@]12CCC(=O)C=C1CC[C@@H]1C2=CC[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CCl__MQDWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRFGGTSAYSGASIWLPGTQVQERAGLPDSTENARTYLRALLGDAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADIGDLAGKVRPELDQDRTGQDHAPGPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDGRVVGAEVESGGETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALLDQAWFCPGVEQPDGSAAFMVGVRGGLVVDSAGERYLNESLPYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTAPAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFCPPNGGANAALTAIENGPFYAARIVLSDLGTKGGLVTDVNGRVLRADGSAIDGLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK,./data/raw/alphafold//AF-Q9RA02-F1-model_v4.pdb,1436,956,760,1058
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+1173,1844,1875,MAKLIALTLLGMGLALFRNHQSSYQTRLNALREVQPVELPNCNLVKGIETGSEDLEILPNGLAFISSGLKYPGIKSFNPNSPGKILLMDLNEEDPTVLELGITGSKFDVSSFNPHGISTFTDEDNAMYLLVVNHPDAKSTVELFKFQEEEKSLLHLKTIRHKLLPNLNDIVAVGPEHFYGTNDHYFLDPYLQSWEMYLGLAWSYVVYYSPSEVRVVAEGFDFANGINISPDGKYVYIAELLAHKIHVYEKHANWTLTPLKSLDFNTLVDNISVDPETGDLWVGCHPNGMKIFFYDSENPPASEVLRIQNILTEEPKVTQVYAENGTVLQGSTVASVYKGKLLIGTVFHKALYCEL,brenda,P27169,CC(=O)Oc1ccc(C)c(C)c1.O>>CC(=O)O.Cc1ccc(O)cc1C,51.0,0.0,25.0,8.0,3.1.1.2,9606.0,1.7075701760979365,CC(=O)Oc1ccc(C)c(C)c1.O,CC(=O)O.Cc1ccc(O)cc1C,1.7075701760979365,CC(=O)Oc1ccc(C)c(C)c1.O__MAKLIALTLLGMGLALFRNHQSSYQTRLNALREVQPVELPNCNLVKGIETGSEDLEILPNGLAFISSGLKYPGIKSFNPNSPGKILLMDLNEEDPTVLELGITGSKFDVSSFNPHGISTFTDEDNAMYLLVVNHPDAKSTVELFKFQEEEKSLLHLKTIRHKLLPNLNDIVAVGPEHFYGTNDHYFLDPYLQSWEMYLGLAWSYVVYYSPSEVRVVAEGFDFANGINISPDGKYVYIAELLAHKIHVYEKHANWTLTPLKSLDFNTLVDNISVDPETGDLWVGCHPNGMKIFFYDSENPPASEVLRIQNILTEEPKVTQVYAENGTVLQGSTVASVYKGKLLIGTVFHKALYCEL,./data/raw/alphafold//AF-P27169-F1-model_v4.pdb,1506,1056,381,432
+1174,22217,22550,MTDIRGLGYLRIQTTDIARWRELVVDGLGMAIGTGPEPDGLYLRVDERRARLIVLPGEVDKALAVGWEVRDEFALRSVREAVEKAGIAVEVLSEEESTYRDAEQVIAFDDPGGTRTEVFFGPVLDHSPLVTPFAGVFHTGEEGLGHVVLPTAAFAESYEFYTEVLGFLPRGATRLGGLSAPPPVRRVRFLGVNRRHHSLALCPAPPTAEPGLVHLMLEVETLDAVGQALYRVNKLGFSISSTLGRHTNDKMVSFYVRAPGGWDLEFGTESMLVDETFYTAEEITADSYWGHDWSGSEPLAAFSPPVG,brenda,Q6QF56,O=O.Oc1ccccc1O>>O=C/C=C\C=C(\O)C(=O)O,50.0,0.0,80.0,,1.13.11.39,103816.0,1.6989700043360187,O=O.Oc1ccccc1O,O=C/C=C\C=C(\O)C(=O)O,1.6989700043360187,O=O.Oc1ccccc1O__MTDIRGLGYLRIQTTDIARWRELVVDGLGMAIGTGPEPDGLYLRVDERRARLIVLPGEVDKALAVGWEVRDEFALRSVREAVEKAGIAVEVLSEEESTYRDAEQVIAFDDPGGTRTEVFFGPVLDHSPLVTPFAGVFHTGEEGLGHVVLPTAAFAESYEFYTEVLGFLPRGATRLGGLSAPPPVRRVRFLGVNRRHHSLALCPAPPTAEPGLVHLMLEVETLDAVGQALYRVNKLGFSISSTLGRHTNDKMVSFYVRAPGGWDLEFGTESMLVDETFYTAEEITADSYWGHDWSGSEPLAAFSPPVG,./data/raw/alphafold//AF-Q6QF56-F1-model_v4.pdb,2000,4158,4025,3870
+1175,12002,12165,MLRRALLLSSSAILAVKAQQAGTATAENHPPLTWQECTAPGSCTTQNGAVVLDANWRWVHDVNGYTNCYTGNTWDPTYCPDDETCAQNCALDGADYEGTYGVTSSGSSLKLNFVTGSNVGSRLYLLQDDSTYQIFKLLNREFSFDVDVSNLPCGLNGALYFVAMDADGGVSKYPNNKAGAKYGTGYCDSQCPRDLKFIDGEANVEGWQPSSNNANTGIGDHGSCCAEMDVWEANSISNAVTPHPCDTPGQTMCSGDDCGGTYSNDRYAGTCDPDGCDFNPYRMGNTSFYGPGKIIDTTKPFTVVTQFLTDDGTDTGTLSEIKRFYIQNSNVIPQPNSDISGVTGNSITTEFCTAQKQAFGDTDDFSQHGGLAKMGAAMQQGMVLVMSLWDDYAAQMLWLDSDYPTDADPTTPGIARGTCPTDSGVPSDVESQSPNSYVTYSNIKFGPINSTFTAS,brenda,Q8TFL9,Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)ccc12.O>>Cc1cc(=O)oc2cc(O)ccc12.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,0.65,1.0953164522823764e-14,22.0,5.0,3.2.1.176,68825.0,-0.1870866433571444,Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)ccc12.O,Cc1cc(=O)oc2cc(O)ccc12.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,0.1303337684950061,Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)ccc12.O__MLRRALLLSSSAILAVKAQQAGTATAENHPPLTWQECTAPGSCTTQNGAVVLDANWRWVHDVNGYTNCYTGNTWDPTYCPDDETCAQNCALDGADYEGTYGVTSSGSSLKLNFVTGSNVGSRLYLLQDDSTYQIFKLLNREFSFDVDVSNLPCGLNGALYFVAMDADGGVSKYPNNKAGAKYGTGYCDSQCPRDLKFIDGEANVEGWQPSSNNANTGIGDHGSCCAEMDVWEANSISNAVTPHPCDTPGQTMCSGDDCGGTYSNDRYAGTCDPDGCDFNPYRMGNTSFYGPGKIIDTTKPFTVVTQFLTDDGTDTGTLSEIKRFYIQNSNVIPQPNSDISGVTGNSITTEFCTAQKQAFGDTDDFSQHGGLAKMGAAMQQGMVLVMSLWDDYAAQMLWLDSDYPTDADPTTPGIARGTCPTDSGVPSDVESQSPNSYVTYSNIKFGPINSTFTAS,./data/raw/alphafold//AF-Q8TFL9-F1-model_v4.pdb,1951,3462,1208,3135
+1176,12437,12607,MHLKASEKRALGRTGLTVTALGLGTAPLGGLYAPVSRADADALLEAGWDSGIRYFDSAPMYGYGRCEHLLGDMLREKPERAVISTKVGRLMTNERAGRTLPPAPPKNPLDSGWHNGLNFREVFDYSYDGVMRSFDDSQQRLGFPEIDLLYVHDIGRVTHADRHEFHWNALTRGGGFRALTELRAAGNIKGFGLGVNEWQIIRDALEEADLDCSLLAGRYSLLDQVSEKEFLPLAQKRGMALVIAGVFNSGILAAPRGGEQKFDYADAPAEIIARTNRLHDICDEYHVPLAAAAMQFPLRHEAVSSILIGVRSPEQIRQNVVWFEQSIPDEFWTTLRSEGLIS,brenda,Q76KC2,Cc1ncc(CO)c(C=O)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>>Cc1ncc2c(c1O)C(=O)OC2.N=C(O)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+],59.2,0.0,30.0,8.0,1.1.1.107,69367.0,1.7723217067229198,Cc1ncc(CO)c(C=O)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,Cc1ncc2c(c1O)C(=O)OC2.N=C(O)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+],1.7723217067229198,Cc1ncc(CO)c(C=O)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__MHLKASEKRALGRTGLTVTALGLGTAPLGGLYAPVSRADADALLEAGWDSGIRYFDSAPMYGYGRCEHLLGDMLREKPERAVISTKVGRLMTNERAGRTLPPAPPKNPLDSGWHNGLNFREVFDYSYDGVMRSFDDSQQRLGFPEIDLLYVHDIGRVTHADRHEFHWNALTRGGGFRALTELRAAGNIKGFGLGVNEWQIIRDALEEADLDCSLLAGRYSLLDQVSEKEFLPLAQKRGMALVIAGVFNSGILAAPRGGEQKFDYADAPAEIIARTNRLHDICDEYHVPLAAAAMQFPLRHEAVSSILIGVRSPEQIRQNVVWFEQSIPDEFWTTLRSEGLIS,./data/raw/alphafold//AF-Q76KC2-F1-model_v4.pdb,3186,1986,3632,2474
+1177,3075,3117,MPPYTVVYFPVRGRCAALRMLLADQGQSWKEEVVTVETWQEGSLKASCLYGQLPKFQDGDLTLYQSNTILRHLGRTLGLYGKDQQEAALVDMVNDGVEDLRCKYISLIYTNYEAGKDDYVKALPGQLKPFETLLSQNQGGKTFIVGDQISFADYNLLDLLLIHEVLAPGCLDAFPLLSAYVGRLSARPKLKAFLASPEYVNLPINGNGKQ,brenda,P09211,CC(C)(N=C(O)[C@H](CS)N=C(O)CC[C@H](N)C(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1>>,1.91,99.81444886674646,25.0,7.4,2.5.1.18,9606.0,0.2810333672477275,CC(C)(N=C(O)[C@H](CS)N=C(O)CC[C@H](N)C(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1,,0.2810333672477275,CC(C)(N=C(O)[C@H](CS)N=C(O)CC[C@H](N)C(=O)O)C(=O)O.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1__MPPYTVVYFPVRGRCAALRMLLADQGQSWKEEVVTVETWQEGSLKASCLYGQLPKFQDGDLTLYQSNTILRHLGRTLGLYGKDQQEAALVDMVNDGVEDLRCKYISLIYTNYEAGKDDYVKALPGQLKPFETLLSQNQGGKTFIVGDQISFADYNLLDLLLIHEVLAPGCLDAFPLLSAYVGRLSARPKLKAFLASPEYVNLPINGNGKQ,./data/raw/alphafold//AF-P09211-F1-model_v4.pdb,3474,1331,6256,1601
+1178,12836,13008,MKKLLTVMTMAVLTAGTLLLPAQSVTPAAHAVQISNSERELPFKAKHAYSTISQLSEAIGPRIAGTAAEKKSALLIASSMRKLKLDVKVQRFNIPDRLEGTLSSAGRDILLQAASGSAPTEEQGLTAPLYNAGLGYQKDFTADAKGKIALISRGDLTYYEKAKNAEAAGAKAVIIYNNKESLVPMTPNLSGNKVGIPVVGIKKEDGEALTQQKEATLKLKAFTNQTSQNIIGIKKPKNIKHPDIVYVTAHYDSVPFSPGANDNGSGTSVMLEMARVLKSVPSDKEIRFIAFGAEELGLLGSSHYVDHLSEKELKRSEVNFNLDMVGTSWEKASELYVNTLDGQSNYVWESSRTAAEKIGFDSLSLTQGGSSDHVPFHEAGIDSANFIWGDPETEEVEPWYHTPEDSIEHISKERLQQAGDLVTAAVYEAVKKEKKPKTIKKQMKAKASDIFEDIK,brenda,P25152,N=C(N)NCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>N=C(N)NCCC[C@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,34.0,0.0,30.0,8.0,3.4.11.10,1423.0,1.5314789170422551,N=C(N)NCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,N=C(N)NCCC[C@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,1.5314789170422551,N=C(N)NCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MKKLLTVMTMAVLTAGTLLLPAQSVTPAAHAVQISNSERELPFKAKHAYSTISQLSEAIGPRIAGTAAEKKSALLIASSMRKLKLDVKVQRFNIPDRLEGTLSSAGRDILLQAASGSAPTEEQGLTAPLYNAGLGYQKDFTADAKGKIALISRGDLTYYEKAKNAEAAGAKAVIIYNNKESLVPMTPNLSGNKVGIPVVGIKKEDGEALTQQKEATLKLKAFTNQTSQNIIGIKKPKNIKHPDIVYVTAHYDSVPFSPGANDNGSGTSVMLEMARVLKSVPSDKEIRFIAFGAEELGLLGSSHYVDHLSEKELKRSEVNFNLDMVGTSWEKASELYVNTLDGQSNYVWESSRTAAEKIGFDSLSLTQGGSSDHVPFHEAGIDSANFIWGDPETEEVEPWYHTPEDSIEHISKERLQQAGDLVTAAVYEAVKKEKKPKTIKKQMKAKASDIFEDIK,./data/raw/alphafold//AF-P25152-F1-model_v4.pdb,1812,1490,3062,1814
+1179,4301,4356,MWLLPLVLTSLASSATWAGQPASPPVVDTAQGRVLGKYVSLEGLAQPVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTSYPPMCCQDPVVEQMTSDLFTNGKERLTLEFSEDCLYLNIYTPADLTKRGRLPVMVWIHGGGLVLGGAPMYDGVVLAAHENVVVVAIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQENIANFGGDPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTVALVRKDMKAAAKQIAVLAGCKTTTSAVFVHCLRQKSEDELLDLTLKMKFLTLDFHGDQRESHPFLPTVVDGVLLPKMPEEILAEKDFNTVPYIVGINKQEFGWLLPTMMGFPLSEGKLDQKTATSLLWKSYPIANIPEELTPVATDKYLGGTDDPVKKKDLFLDLMGDVVFGVPSVTVARQHRDAGAPTYMYEFQYRPSFSSDKKPKTVIGDHGDEIFSVFGFPLLKGDAPEEEVSLSKTVMKFWANFARSGNPNGEGLPHWPMYDQEEGYLQIGVNTQAAKRLKGEEVAFWNDLLSKEAAKKPPKIKHAEL,uniprot_search,Q29550,CC(C)[C@@H](N)C(=O)O[C@@H]1[C@@H](CO)O[C@@H](n2ccc(=N)nc2O)C1(F)F.O>>CC(C)[C@@H](N)C(=O)O.N=c1ccn([C@@H]2O[C@H](CO)[C@@H](O)C2(F)F)c(O)n1,1.1,7.462743517204771e-15,37.0,7.4,3.1.1.1,9823.0,0.041392685158225,CC(C)[C@@H](N)C(=O)O[C@@H]1[C@@H](CO)O[C@@H](n2ccc(=N)nc2O)C1(F)F.O,CC(C)[C@@H](N)C(=O)O.N=c1ccn([C@@H]2O[C@H](CO)[C@@H](O)C2(F)F)c(O)n1,0.041392685158225,CC(C)[C@@H](N)C(=O)O[C@@H]1[C@@H](CO)O[C@@H](n2ccc(=N)nc2O)C1(F)F.O__MWLLPLVLTSLASSATWAGQPASPPVVDTAQGRVLGKYVSLEGLAQPVAVFLGVPFAKPPLGSLRFAPPQPAEPWSFVKNTTSYPPMCCQDPVVEQMTSDLFTNGKERLTLEFSEDCLYLNIYTPADLTKRGRLPVMVWIHGGGLVLGGAPMYDGVVLAAHENVVVVAIQYRLGIWGFFSTGDEHSRGNWGHLDQVAALHWVQENIANFGGDPGSVTIFGESAGGESVSVLVLSPLAKNLFHRAISESGVALTVALVRKDMKAAAKQIAVLAGCKTTTSAVFVHCLRQKSEDELLDLTLKMKFLTLDFHGDQRESHPFLPTVVDGVLLPKMPEEILAEKDFNTVPYIVGINKQEFGWLLPTMMGFPLSEGKLDQKTATSLLWKSYPIANIPEELTPVATDKYLGGTDDPVKKKDLFLDLMGDVVFGVPSVTVARQHRDAGAPTYMYEFQYRPSFSSDKKPKTVIGDHGDEIFSVFGFPLLKGDAPEEEVSLSKTVMKFWANFARSGNPNGEGLPHWPMYDQEEGYLQIGVNTQAAKRLKGEEVAFWNDLLSKEAAKKPPKIKHAEL,./data/raw/alphafold//AF-Q29550-F1-model_v4.pdb,1494,2159,554,633
+1180,19154,19440,MKKLLTVMTMAVLTAGTLLLPAQSVTPAAHAVQISNSERELPFKAKHAYSTISQLSEAIGPRIAGTAAEKKSALLIASSMRKLKLDVKVQRFNIPDRLEGTLSSAGRDILLQAASGSAPTEEQGLTAPLYNAGLGYQKDFTADAKGKIALISRGDLTYYEKAKNAEAAGAKAVIIYNNKESLVPMTPNLSGNKVGIPVVGIKKEDGEALTQQKEATLKLKAFTNQTSQNIIGIKKPKNIKHPDIVYVTAHYDSVPFSPGANDNGSGTSVMLEMARVLKSVPSDKEIRFIAFGAEELGLLGSSHYVDHLSEKELKRSEVNFNLDMVGTSWEKASELYVNTLDGQSNYVWESSRTAAEKIGFDSLSLTQGGSSDHVPFHEAGIDSANFIWGDPETEEVEPWYHTPEDSIEHISKERLQQAGDLVTAAVYEAVKKEKKPKTIKKQMKAKASDIFEDIK,sabio,P25152,O.O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN1>>Nc1ccc([N+](=O)[O-])cc1.O=C(O)[C@@H]1CCCN1,0.00012,1.1200320553599892e-14,30.0,8.0,3.4.11.10,1423.0,-3.9208187539523753,O.O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN1,Nc1ccc([N+](=O)[O-])cc1.O=C(O)[C@@H]1CCCN1,-3.9208187539523753,O.O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN1__MKKLLTVMTMAVLTAGTLLLPAQSVTPAAHAVQISNSERELPFKAKHAYSTISQLSEAIGPRIAGTAAEKKSALLIASSMRKLKLDVKVQRFNIPDRLEGTLSSAGRDILLQAASGSAPTEEQGLTAPLYNAGLGYQKDFTADAKGKIALISRGDLTYYEKAKNAEAAGAKAVIIYNNKESLVPMTPNLSGNKVGIPVVGIKKEDGEALTQQKEATLKLKAFTNQTSQNIIGIKKPKNIKHPDIVYVTAHYDSVPFSPGANDNGSGTSVMLEMARVLKSVPSDKEIRFIAFGAEELGLLGSSHYVDHLSEKELKRSEVNFNLDMVGTSWEKASELYVNTLDGQSNYVWESSRTAAEKIGFDSLSLTQGGSSDHVPFHEAGIDSANFIWGDPETEEVEPWYHTPEDSIEHISKERLQQAGDLVTAAVYEAVKKEKKPKTIKKQMKAKASDIFEDIK,./data/raw/alphafold//AF-P25152-F1-model_v4.pdb,1812,1490,3062,1814
+1181,22079,22412,MSTSSSDPFFNFAKSSFRSAAAQKASASSLPPLPGPDKKVPGMDIKYDVVIVGSGPIGCTYARELVGAGYKVAMFDIGEIDSGLKIGAHKKNTVEYQKNIDKFVNVIQGQLMSVSVPVNTLVVDTLSPTSWQASTFFVRNGSNPEQDPLRNLSGQAVTRVVGGMSTHWTCATPRFDREQRPLLVKDDADADDAEWDRLYTKAESYFQTGTDQFKESIRHNLVLNKLTEEYKGQRDFQQIPLAATRRSPTFVEWSSANTVFDLQNRPNTDAPEERFNLFPAVACERVVRNALNSEIESLHIHDLISGDRFEIKADVYVLTAGAVHNTQLLVNSGFGQLGRPNPANPPELLPSLGSYITEQSLVFCQTVMSTELIDSVKSDMTIRGTPGELTYSVTYTPGASTNKHPDWWNEKVKNHMMQHQEDPLPIPFEDPEPQVTTLFQPSHPWHTQIHRDAFSYGAVQQSIDSRLIVDWRFFGRTEPKEENKLWFSDKITDAYNMPQPTFDFRFPAGRTSKEAEDMMTDMCVMSAKIGGFLPGSLPQFMEPGLVLHLGGTHRMGFDEKEDNCCVNTDSRVFGFKNLFLGGCGNIPTAYGANPTLTAMSLAIKSCEYIKQNFTPSPFTSEAQ,sabio,Q7ZA32,O=O.OCC1OC(O)C(O)C(O)C1O>>O=C1C(O)OC(CO)C(O)C1O.OO,54.0,6.682618109794317e-15,30.0,6.5,1.1.3.10,230624.0,1.7323937598229686,O=O.OCC1OC(O)C(O)C(O)C1O,O=C1C(O)OC(CO)C(O)C1O.OO,1.8512583487190752,O=O.OCC1OC(O)C(O)C(O)C1O__MSTSSSDPFFNFAKSSFRSAAAQKASASSLPPLPGPDKKVPGMDIKYDVVIVGSGPIGCTYARELVGAGYKVAMFDIGEIDSGLKIGAHKKNTVEYQKNIDKFVNVIQGQLMSVSVPVNTLVVDTLSPTSWQASTFFVRNGSNPEQDPLRNLSGQAVTRVVGGMSTHWTCATPRFDREQRPLLVKDDADADDAEWDRLYTKAESYFQTGTDQFKESIRHNLVLNKLTEEYKGQRDFQQIPLAATRRSPTFVEWSSANTVFDLQNRPNTDAPEERFNLFPAVACERVVRNALNSEIESLHIHDLISGDRFEIKADVYVLTAGAVHNTQLLVNSGFGQLGRPNPANPPELLPSLGSYITEQSLVFCQTVMSTELIDSVKSDMTIRGTPGELTYSVTYTPGASTNKHPDWWNEKVKNHMMQHQEDPLPIPFEDPEPQVTTLFQPSHPWHTQIHRDAFSYGAVQQSIDSRLIVDWRFFGRTEPKEENKLWFSDKITDAYNMPQPTFDFRFPAGRTSKEAEDMMTDMCVMSAKIGGFLPGSLPQFMEPGLVLHLGGTHRMGFDEKEDNCCVNTDSRVFGFKNLFLGGCGNIPTAYGANPTLTAMSLAIKSCEYIKQNFTPSPFTSEAQ,./data/raw/alphafold//AF-Q7ZA32-F1-model_v4.pdb,567,106,5819,335
+1182,6566,6679,MTSMTQSLREVIKAMTKARNFERVLGKITLVSAAPGKVICEMKVEEEHTNAIGTLHGGLTATLVDNISTMALLCTERGAPGVSVDMNITYMSPAKLGEDIVITAHVLKQGKTLAFTSVDLTNKATGKLIAQGRHTKHLGN,brenda,Q9NPJ3,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>>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)O,0.047,6.6394461302566056e-15,37.0,7.5,3.1.2.20,9606.0,-1.3279021420642825,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,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)O,-1.3279021420642825,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__MTSMTQSLREVIKAMTKARNFERVLGKITLVSAAPGKVICEMKVEEEHTNAIGTLHGGLTATLVDNISTMALLCTERGAPGVSVDMNITYMSPAKLGEDIVITAHVLKQGKTLAFTSVDLTNKATGKLIAQGRHTKHLGN,./data/raw/alphafold//AF-Q9NPJ3-F1-model_v4.pdb,1636,1238,1720,275
+1183,15153,15365,MLDAQTIATVKATIPLLVETGPKLTAHFYDRMFTHNPELKEIFNMSNQRNGDQREALFNAIAAYASNIENLPALLPAVEKIAQKHTSFQIKPEQYNIVGEHLLATLDEMFSPGQEVLDAWGKAYGVLANVFINREAEIYNENASKAGGWEGTRDFRIVAKTPRSALITSFELEPVDGGAVAEYRPGQYLGVWLKPEGFPHQEIRQYSLTRKPDGKGYRIAVKREEGGQVSNWLHNHANVGDVVKLVAPAGDFFMAVADDTPVTLISAGVGQTPMLAMLDTLAKAGHTAQVNWFHAAENGDVHAFADEVKELGQSLPRFTAHTWYRQPSEADRAKGQFDSEGLMDLSKLEGAFSDPTMQFYLCGPVGFMQFTAKQLVDLGVKQENIHYECFGPHKVL,sabio,P24232,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.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,0.171,1.1577496282306037,37.0,7.8,1.6.3.4,562.0,-0.7670038896078462,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.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,-0.7670038896078462,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=O.[H]__MLDAQTIATVKATIPLLVETGPKLTAHFYDRMFTHNPELKEIFNMSNQRNGDQREALFNAIAAYASNIENLPALLPAVEKIAQKHTSFQIKPEQYNIVGEHLLATLDEMFSPGQEVLDAWGKAYGVLANVFINREAEIYNENASKAGGWEGTRDFRIVAKTPRSALITSFELEPVDGGAVAEYRPGQYLGVWLKPEGFPHQEIRQYSLTRKPDGKGYRIAVKREEGGQVSNWLHNHANVGDVVKLVAPAGDFFMAVADDTPVTLISAGVGQTPMLAMLDTLAKAGHTAQVNWFHAAENGDVHAFADEVKELGQSLPRFTAHTWYRQPSEADRAKGQFDSEGLMDLSKLEGAFSDPTMQFYLCGPVGFMQFTAKQLVDLGVKQENIHYECFGPHKVL,./data/raw/alphafold//AF-P24232-F1-model_v4.pdb,1983,4135,4000,3838
+1184,11705,11863,MTVTDIILIHGALNRGACYDAVVPLLEARGYRVHAPDLTGHTPGDGGHLSVVDMEHYTRPVADILARAEGQSILLGHSLGGASISWLAQHHPDKVAGLIYLTAVLTAPGITPETFVLPGEPNRGTPHALDLIQPVDEGRGLQADFSRLERLREVFMGDYPGEGMPPAEQFIQTQSTVPFGTPNPMEGRALEIPRLYIEALDDVVIPIAVQRQMQKEFPGPVAVVSLPASHAPYYSMPERLAEAIADFADAPAEYRQTATKAGPDRPAGADGGRADRADLP,brenda,C0LA90,Cc1c(COC(=O)C2C(/C=C(\Cl)C(F)(F)F)C2(C)C)cccc1-c1ccccc1.O>>Cc1c(CO)cccc1-c1ccccc1,0.44,37.90088010072578,37.0,7.5,3.1.1.88,1912891.0,-0.3565473235138126,Cc1c(COC(=O)C2C(/C=C(\Cl)C(F)(F)F)C2(C)C)cccc1-c1ccccc1.O,Cc1c(CO)cccc1-c1ccccc1,-0.3565473235138126,Cc1c(COC(=O)C2C(/C=C(\Cl)C(F)(F)F)C2(C)C)cccc1-c1ccccc1.O__MTVTDIILIHGALNRGACYDAVVPLLEARGYRVHAPDLTGHTPGDGGHLSVVDMEHYTRPVADILARAEGQSILLGHSLGGASISWLAQHHPDKVAGLIYLTAVLTAPGITPETFVLPGEPNRGTPHALDLIQPVDEGRGLQADFSRLERLREVFMGDYPGEGMPPAEQFIQTQSTVPFGTPNPMEGRALEIPRLYIEALDDVVIPIAVQRQMQKEFPGPVAVVSLPASHAPYYSMPERLAEAIADFADAPAEYRQTATKAGPDRPAGADGGRADRADLP,./data/raw/alphafold//AF-C0LA90-F1-model_v4.pdb,1501,1050,876,1208
+1185,2190,2222,MNIVENEICIRTLIDDDFPLMLKWLTDERVLEFYGGRDKKYTLESLKKHYTEPWEDEVFRVIIEYNNVPIGYGQIYKMYDELYTDYHYPKTDEIVYGMDQFIGEPNYWSKGIGTRYIKLIFEFLKKERNANAVILDPHKNNPRAIRAYQKSGFRIIEDLPEHELHEGKKEDCYLMEYRYDDNATNVKAMKYLIEHYFDNFKVDSIEIIGSGYDSVAYLVNNEYIFKTKFSTNKKKGYAKEKAIYNFLNTNLETNVKIPNIEYSYISDELSILGYKEIKGTFLTPEIYSTMSEEEQNLLKRDIASFLRQMHGLDYTDISECTIDNKQNVLEEYILLRETIYNDLTDIEKDYIESFMERLNATTVFEGKKCLCHNDFSCNHLLLDGNNRLTGIIDFGDSGIIDEYCDFIYLLEDSEEEIGTNFGEDILRMYGNIDIEKAKEYQDIVEEYYPIETIVYGIKNIKQEFIENGRKEIYKRTYKD,sabio,P0A0C2,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.NCCC(O)C(=O)NC1CC(N)C(OC2OC(CN)C(O)C(O)C2O)C(O)C1OC1OC(CO)C(O)C(N)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,0.01,29.007587371234912,37.0,7.0,2.7.1.-,1351.0,-2.0,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.NCCC(O)C(=O)NC1CC(N)C(OC2OC(CN)C(O)C(O)C2O)C(O)C1OC1OC(CO)C(O)C(N)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,0.3242824552976926,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.NCCC(O)C(=O)NC1CC(N)C(OC2OC(CN)C(O)C(O)C2O)C(O)C1OC1OC(CO)C(O)C(N)C1O__MNIVENEICIRTLIDDDFPLMLKWLTDERVLEFYGGRDKKYTLESLKKHYTEPWEDEVFRVIIEYNNVPIGYGQIYKMYDELYTDYHYPKTDEIVYGMDQFIGEPNYWSKGIGTRYIKLIFEFLKKERNANAVILDPHKNNPRAIRAYQKSGFRIIEDLPEHELHEGKKEDCYLMEYRYDDNATNVKAMKYLIEHYFDNFKVDSIEIIGSGYDSVAYLVNNEYIFKTKFSTNKKKGYAKEKAIYNFLNTNLETNVKIPNIEYSYISDELSILGYKEIKGTFLTPEIYSTMSEEEQNLLKRDIASFLRQMHGLDYTDISECTIDNKQNVLEEYILLRETIYNDLTDIEKDYIESFMERLNATTVFEGKKCLCHNDFSCNHLLLDGNNRLTGIIDFGDSGIIDEYCDFIYLLEDSEEEIGTNFGEDILRMYGNIDIEKAKEYQDIVEEYYPIETIVYGIKNIKQEFIENGRKEIYKRTYKD,./data/raw/alphafold//AF-P0A0C2-F1-model_v4.pdb,964,490,131,139
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+1193,10287,10438,MTSQTPTRKPRARDLGLPFTGVTGPYNAITDVDGVGVGFQTIIENEPRPGRKRPARSGVTAILPHMQSETPVPVYAGVHRFNGNGEMTGTHWIEDGGYFLGPVVITNTHGIGMAHHATVRWMVDRYASTYQTDDFLWIMPVVAETYDGALNDINGFPVTEADVRKALDNVASGPVQEGNCGGGTGMITYGFKGGTGTASRVVEFGGRSFTIGALVQANHGQRDWLTIAGVPVGQHMRDGTPQSQLQERGSIIVVLATDLPLMPHQLKRLARRASIGIGRNGTPGGNNSGDIFIAFSTANQRPMQHRSAPFLDVEMVNDEPLDTVYLAAVDSVEEAVVNAMIAAEDMGGTPFDRLLVQAIDHERLRAVLRQYGRLA,brenda,Q59632,C[C@@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>C[C@@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,3.3,0.0,30.0,8.0,3.4.13.20,529.0,0.5185139398778875,C[C@@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,C[C@@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,0.6020599913279624,C[C@@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MTSQTPTRKPRARDLGLPFTGVTGPYNAITDVDGVGVGFQTIIENEPRPGRKRPARSGVTAILPHMQSETPVPVYAGVHRFNGNGEMTGTHWIEDGGYFLGPVVITNTHGIGMAHHATVRWMVDRYASTYQTDDFLWIMPVVAETYDGALNDINGFPVTEADVRKALDNVASGPVQEGNCGGGTGMITYGFKGGTGTASRVVEFGGRSFTIGALVQANHGQRDWLTIAGVPVGQHMRDGTPQSQLQERGSIIVVLATDLPLMPHQLKRLARRASIGIGRNGTPGGNNSGDIFIAFSTANQRPMQHRSAPFLDVEMVNDEPLDTVYLAAVDSVEEAVVNAMIAAEDMGGTPFDRLLVQAIDHERLRAVLRQYGRLA,./data/raw/alphafold//AF-Q59632-F1-model_v4.pdb,2700,3623,1414,3376
+1194,5044,5129,MASATFTGVIPPVMTPLHADGSVDVESLRKLVDHLINGGVDGLFALGSSGEAAFLTRAQRKLALTTIIEHTAGRVPVTAGVIETTTARVIELVEDALEAGAEGLVATAPFYTRTHDVEIEEHFRKIHAAAPELPLFAYNIPVSVHSNLNPVMLLTLAKDGVLAGTKDSSGNDGAIRSLIEARDDAGLTEQFKILTGSETTVDFAYLAGADGVVPGLGNVDPAAYAALAKLCLDGKWAEAAALQKRINHLFHIVFVGDTSHMSGSSAGLGGFKTALAHLGIIESNAMAVPHQSLSDEETARIHAIVDEFLYTA,brenda,Q8NMD2,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>>CC(=O)C(=O)O.CC(O)=N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,9.3,9.175071078443114e-15,37.0,7.5,4.1.3.3,1718.0,0.9684829485539352,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,CC(=O)C(=O)O.CC(O)=N[C@@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O,1.645422269349092,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__MASATFTGVIPPVMTPLHADGSVDVESLRKLVDHLINGGVDGLFALGSSGEAAFLTRAQRKLALTTIIEHTAGRVPVTAGVIETTTARVIELVEDALEAGAEGLVATAPFYTRTHDVEIEEHFRKIHAAAPELPLFAYNIPVSVHSNLNPVMLLTLAKDGVLAGTKDSSGNDGAIRSLIEARDDAGLTEQFKILTGSETTVDFAYLAGADGVVPGLGNVDPAAYAALAKLCLDGKWAEAAALQKRINHLFHIVFVGDTSHMSGSSAGLGGFKTALAHLGIIESNAMAVPHQSLSDEETARIHAIVDEFLYTA,./data/raw/alphafold//AF-Q8NMD2-F1-model_v4.pdb,1263,5207,1592,719
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+1211,17002,17232,MTVRKNQASLTAEEKRRFVAALLELKRTGRYDAFVTTHNAFILGDTDNGERTGHRSPSFLPWHRRFLLEFERALQSVDASVALPYWDWSADRSTRSSLWAPDFLGGTGRSRDGQVMDGPFAASAGNWPINVRVDGRTFLRRALGAGVSELPTRAEVDSVLAMATYDMAPWNSGSDGFRNHLEGWRGVNLHNRVHVWVGGQMATGVSPNDPVFWLHHAYIDKLWAEWQRRHPSSPYLPGGGTPNVVDLNETMKPWNDTTPAALLDHTRHYTFDV,uniprot_search,P07524,NCCc1ccc(O)cc1.O=O>>NCCC1=CC(=O)C(=O)C=C1.O,7.4,1.6750182361152766e-14,25.0,6.8,1.14.18.1,1890.0,0.8692317197309762,NCCc1ccc(O)cc1.O=O,NCCC1=CC(=O)C(=O)C=C1.O,0.8692317197309762,NCCc1ccc(O)cc1.O=O__MTVRKNQASLTAEEKRRFVAALLELKRTGRYDAFVTTHNAFILGDTDNGERTGHRSPSFLPWHRRFLLEFERALQSVDASVALPYWDWSADRSTRSSLWAPDFLGGTGRSRDGQVMDGPFAASAGNWPINVRVDGRTFLRRALGAGVSELPTRAEVDSVLAMATYDMAPWNSGSDGFRNHLEGWRGVNLHNRVHVWVGGQMATGVSPNDPVFWLHHAYIDKLWAEWQRRHPSSPYLPGGGTPNVVDLNETMKPWNDTTPAALLDHTRHYTFDV,./data/raw/alphafold//AF-P07524-F1-model_v4.pdb,1607,1196,1672,1400
+1212,5323,5409,QPANAKANIQQQLSELEKNSGGRLGVALIDTADNSQILYRGDERFPMCSTSKVMAVSALLKQSETDKNLLAKRMEIKQSDLVNYNPIAEKHLDTGMTLAEFSAATIQYSDNTAMNKILEHLGGPAKVTEFARTIGDKTFRLDRTEPTLNTAIPGDKRDTTSPQAMAISLQNLTLGKALAEPQRAQLVEWMKGNTTGGASIRAGLPTTWVVGDKTGSGDYGTTNDIAVIWPANHAPLVLVTYFTQPQQNAEARKDVLAAAAKIVTAGL,sabio,P80545,CC1(C)SC2C(NC(=O)C(NC(=O)N3CCN(S(C)(=O)=O)C3=O)c3ccccc3)C(=O)N2C1C(=O)O.O>>,255.0,99.820983267306,37.0,7.0,3.5.2.6,47917.0,2.406540180433955,CC1(C)SC2C(NC(=O)C(NC(=O)N3CCN(S(C)(=O)=O)C3=O)c3ccccc3)C(=O)N2C1C(=O)O.O,,2.406540180433955,CC1(C)SC2C(NC(=O)C(NC(=O)N3CCN(S(C)(=O)=O)C3=O)c3ccccc3)C(=O)N2C1C(=O)O.O__QPANAKANIQQQLSELEKNSGGRLGVALIDTADNSQILYRGDERFPMCSTSKVMAVSALLKQSETDKNLLAKRMEIKQSDLVNYNPIAEKHLDTGMTLAEFSAATIQYSDNTAMNKILEHLGGPAKVTEFARTIGDKTFRLDRTEPTLNTAIPGDKRDTTSPQAMAISLQNLTLGKALAEPQRAQLVEWMKGNTTGGASIRAGLPTTWVVGDKTGSGDYGTTNDIAVIWPANHAPLVLVTYFTQPQQNAEARKDVLAAAAKIVTAGL,./data/raw/alphafold//AF-P80545-F1-model_v4.pdb,1458,649,787,1096
+1213,6681,6795,MPCPAQISDDLEFFVNGRKVTEKNVDPEVTLLAFLRKNLCLTGTKDACGTGGCGACTVMVSQHDPVCKKTRHFSVMACLVPLCSLHGAAVTTVEGVGSIKTRLHPVQERIAKSHGTQCGFCTPGMVMSIYTLLRNHPQPSEEQLMEALGGNLCRCTGYRPILESGRTFCMEPDGCPQKGTGQCCLDQKESDSSGSKSDICTKLFVKDEFQPLDPTQELIFPPELLRMAENPEKQTLTFYGERITWIAPGTLQELLVLKAKYPEAPLISGNTALGPAMKSQGHFYPVLLSPARIPDLRMVTKTSGGLTIGACCSLAQVKDILAESISELPQEKTQTYRALLKHLRSLAGQQIRNMASLGGHVISRHCYSDLNPILSVGNTTLNLLSEEGPRQIPLSGHFLAGLASADLKPEEILGSVYIPHSQKREFVSAFRQAQCHQNALPDVNAGMRVLFREGTDVIEELSIAYGGVGPTTVSAQRSCQQLLGRRWNALMLDEACRLLLDEVSLPGSALGGKVEFRRTLIVSLFFKFYLEVLQELKADQKLPPESTDSQRYPEIADRFLSSLGDFQVTLPRGVQTYQRVDSHQPLQDPVGRPIMHLSGLKHATGEAVFCDDIPRVDKELFMALVTSTRAHARIISIDSSEVLDLPGVVDVITAEDIPGNNGEEDDKLLAVDKVLCVGQVICAVVAETDVQAKRATEKIKITYEDLKPVIFTIEDAIKHNSFLCPEKKLEQGNIEEAFENVDQVAEGTVHVGGQEHFYMETQRVLVIPKTEDKELDMYVSTQDPAHVQKTVSSTLNIPISRITCHVKRVGGGFGGKVGRPAVFGAIAAVGAVKTGHPIRLVLDREDDMLITGGRHPLFAKYKVGFMNSGRIKALDIECYINGGCTLDDSELVTEFLVLKLENAYKIRNLRLRGRACMTNLPSNTAFRGFGFPQGALVTESCITAVAAKCGLPPEKIREKNMYKTVDKTIYKQAFNPDPLIRCWNECLDKSSFHIRRTRVDEFNKKSYWKKRGIAIVPMKFSVGFAATSYHQAAALVHIYTDGSVLVAHGGNELGQGIHTKMLQVASRELKIPLSYLHICETSTTTVPNTIATAASVGADVNGRAVQNACQILLKRLEPVIKKNPEGTWRDWIEAAFEKRISLSATGYFRGYKAFMDWEKGEGDPFPYYVYGAACSEVEIDCLTGAHKKIRTDIVMDACCSLNPAIDIGQIEGAFIQGMGLYTTEELLYSPEGVLYSRSPDKYKIPTVTDVPEQFNVSLLPSSQTPLTLYSSKGLGESGMFLGSSVFFAIVDAVAAARRQRDIAEDFTVKSPATPEWVRMACADRFTDMIPRDDPKTFKPWSIPIA,brenda,Q5SGK3,CCCC=O.O.O=O>>CCCC(=O)O.OO,0.63,1.1589344899039316e-14,37.0,8.0,1.2.3.1,10090.0,-0.2006594505464183,CCCC=O.O.O=O,CCCC(=O)O.OO,-0.2006594505464183,CCCC=O.O.O=O__MPCPAQISDDLEFFVNGRKVTEKNVDPEVTLLAFLRKNLCLTGTKDACGTGGCGACTVMVSQHDPVCKKTRHFSVMACLVPLCSLHGAAVTTVEGVGSIKTRLHPVQERIAKSHGTQCGFCTPGMVMSIYTLLRNHPQPSEEQLMEALGGNLCRCTGYRPILESGRTFCMEPDGCPQKGTGQCCLDQKESDSSGSKSDICTKLFVKDEFQPLDPTQELIFPPELLRMAENPEKQTLTFYGERITWIAPGTLQELLVLKAKYPEAPLISGNTALGPAMKSQGHFYPVLLSPARIPDLRMVTKTSGGLTIGACCSLAQVKDILAESISELPQEKTQTYRALLKHLRSLAGQQIRNMASLGGHVISRHCYSDLNPILSVGNTTLNLLSEEGPRQIPLSGHFLAGLASADLKPEEILGSVYIPHSQKREFVSAFRQAQCHQNALPDVNAGMRVLFREGTDVIEELSIAYGGVGPTTVSAQRSCQQLLGRRWNALMLDEACRLLLDEVSLPGSALGGKVEFRRTLIVSLFFKFYLEVLQELKADQKLPPESTDSQRYPEIADRFLSSLGDFQVTLPRGVQTYQRVDSHQPLQDPVGRPIMHLSGLKHATGEAVFCDDIPRVDKELFMALVTSTRAHARIISIDSSEVLDLPGVVDVITAEDIPGNNGEEDDKLLAVDKVLCVGQVICAVVAETDVQAKRATEKIKITYEDLKPVIFTIEDAIKHNSFLCPEKKLEQGNIEEAFENVDQVAEGTVHVGGQEHFYMETQRVLVIPKTEDKELDMYVSTQDPAHVQKTVSSTLNIPISRITCHVKRVGGGFGGKVGRPAVFGAIAAVGAVKTGHPIRLVLDREDDMLITGGRHPLFAKYKVGFMNSGRIKALDIECYINGGCTLDDSELVTEFLVLKLENAYKIRNLRLRGRACMTNLPSNTAFRGFGFPQGALVTESCITAVAAKCGLPPEKIREKNMYKTVDKTIYKQAFNPDPLIRCWNECLDKSSFHIRRTRVDEFNKKSYWKKRGIAIVPMKFSVGFAATSYHQAAALVHIYTDGSVLVAHGGNELGQGIHTKMLQVASRELKIPLSYLHICETSTTTVPNTIATAASVGADVNGRAVQNACQILLKRLEPVIKKNPEGTWRDWIEAAFEKRISLSATGYFRGYKAFMDWEKGEGDPFPYYVYGAACSEVEIDCLTGAHKKIRTDIVMDACCSLNPAIDIGQIEGAFIQGMGLYTTEELLYSPEGVLYSRSPDKYKIPTVTDVPEQFNVSLLPSSQTPLTLYSSKGLGESGMFLGSSVFFAIVDAVAAARRQRDIAEDFTVKSPATPEWVRMACADRFTDMIPRDDPKTFKPWSIPIA,./data/raw/alphafold//AF-Q5SGK3-F1-model_v4.pdb,1051,609,277,304
+1214,4214,4267,MIVRCLSAARRLHRVGGSGILLRMTLGREAMSPLQAMSSYTVDGRNVLRWDLSPEQIKRRTEELIAQTKQVYDDIGMLDIEEVTYENCLQALADVEVKYIVERTMLDFPQHVSSDKEVRAASTEADKRLSRFDIEMSMREDIFLRIVRLKETCDLGKIKPEARRYLEKSVKMGKRNGLHLPEQVQNEIKAMKKRMSELCIDFNKNLNEDDTFLVFSKAELGALPDDFIDSLEKTDDNKYKITLKYPHYFPVMKKCCIPETRRKMEMAFNTRCKEENTIILQELLPLRAKVAKLLGYSTHADFVLEMNTAKSTHHVTAFLDDLSQKLKPLGEAEREFILNLKKKECEEKGFEYDGKINAWDLHYYMTQTEELKYSVDQEILKEYFPIEVVTEGLLNIYQELLGLSFEQVTDAHVWNKSVTLYTVKDKATGEVLGQFYLDLYPREGKYNHAACFGLQPGCLLPDGSRMMSVAALVVNFSQPRAGRPSLLRHDEVRTYFHEFGHVMHQICAQTDFARFSGTNVETDFVEVPSQMLENWVWDTDSLRRLSKHYKDGSPITDDLLEKLVASRLVNTGLLTLRQIVLSKVDQSLHTNTSLDAASEYAKYCTEILGVAATPGTNMPATFGHLAGGYDGQYYGYLWSEVFSMDMFYSCFKKEGIMNPEVGMKYRNLILKPGGSLDGMDMLQNFLKREPNQKAFLMSRGLHAP,uniprot_search,Q02038,CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)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)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)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-],0.24,2.8190710053771725e-14,37.0,7.4,3.4.24.16,9823.0,-0.619788758288394,CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)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)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)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-],-0.619788758288394,CC(C)C[C@H](N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)c1ccccc1N)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__MIVRCLSAARRLHRVGGSGILLRMTLGREAMSPLQAMSSYTVDGRNVLRWDLSPEQIKRRTEELIAQTKQVYDDIGMLDIEEVTYENCLQALADVEVKYIVERTMLDFPQHVSSDKEVRAASTEADKRLSRFDIEMSMREDIFLRIVRLKETCDLGKIKPEARRYLEKSVKMGKRNGLHLPEQVQNEIKAMKKRMSELCIDFNKNLNEDDTFLVFSKAELGALPDDFIDSLEKTDDNKYKITLKYPHYFPVMKKCCIPETRRKMEMAFNTRCKEENTIILQELLPLRAKVAKLLGYSTHADFVLEMNTAKSTHHVTAFLDDLSQKLKPLGEAEREFILNLKKKECEEKGFEYDGKINAWDLHYYMTQTEELKYSVDQEILKEYFPIEVVTEGLLNIYQELLGLSFEQVTDAHVWNKSVTLYTVKDKATGEVLGQFYLDLYPREGKYNHAACFGLQPGCLLPDGSRMMSVAALVVNFSQPRAGRPSLLRHDEVRTYFHEFGHVMHQICAQTDFARFSGTNVETDFVEVPSQMLENWVWDTDSLRRLSKHYKDGSPITDDLLEKLVASRLVNTGLLTLRQIVLSKVDQSLHTNTSLDAASEYAKYCTEILGVAATPGTNMPATFGHLAGGYDGQYYGYLWSEVFSMDMFYSCFKKEGIMNPEVGMKYRNLILKPGGSLDGMDMLQNFLKREPNQKAFLMSRGLHAP,./data/raw/alphafold//AF-Q02038-F1-model_v4.pdb,1820,1500,3201,1829
+1215,3171,3213,MASAAVANYEEEIVRPVADFSPSLWGDQFLSFSIKNQVAEKYAKEIEALKEQTRNMLLATGMKLADTLNLIDTIERLGISYHFEKEIDDILDQIYNQNSNCNDLCTSALQFRLLRQHGFNISPEIFSKFQDENGKFKESLASDVLGLLNLYEASHVRTHADDILEDALAFSTIHLESAAPHLKSPLREQVTHALEQCLHKGVPRVETRFFISSIYDKEQSKNNVLLRFAKLDFNLLQMLHKQELAQVSRWWKDLDFVTTLPYARDRVVECYFWALGVYFEPQYSQARVMLVKTISMISIVDDTFDAYGTVKELEAYTDAIQRWDINEIDRLPDYMKISYKAILDLYKDYEKELSSAGRSHIVCHAIERMKEVVRNYNVESTWFIEGYTPPVSEYLSNALATTTYYYLATTSYLGMKSATEQDFEWLSKNPKILEASVIICRVIDDTATYEVEKSRGQIATGIECCMRDYGISTKEAMAKFQNMAETAWKDINEGLLRPTPVSTEFLTPILNLARIVEVTYIHNLDGYTHPEKVLKPHIINLLVDSIKI,uniprot_search,Q40577,CC(C)=CCC/C(C)=C(\F)CC/C(C)=C/COP(=O)(O)OP(=O)(O)O>>C=C(C)[C@H]1C/C=C(\C)CC/C(F)=C(\C)CC1,0.11,28.536542738352384,22.0,7.0,4.2.3.61,4097.0,-0.958607314841775,CC(C)=CCC/C(C)=C(\F)CC/C(C)=C/COP(=O)(O)OP(=O)(O)O,C=C(C)[C@H]1C/C=C(\C)CC/C(F)=C(\C)CC1,-0.958607314841775,CC(C)=CCC/C(C)=C(\F)CC/C(C)=C/COP(=O)(O)OP(=O)(O)O__MASAAVANYEEEIVRPVADFSPSLWGDQFLSFSIKNQVAEKYAKEIEALKEQTRNMLLATGMKLADTLNLIDTIERLGISYHFEKEIDDILDQIYNQNSNCNDLCTSALQFRLLRQHGFNISPEIFSKFQDENGKFKESLASDVLGLLNLYEASHVRTHADDILEDALAFSTIHLESAAPHLKSPLREQVTHALEQCLHKGVPRVETRFFISSIYDKEQSKNNVLLRFAKLDFNLLQMLHKQELAQVSRWWKDLDFVTTLPYARDRVVECYFWALGVYFEPQYSQARVMLVKTISMISIVDDTFDAYGTVKELEAYTDAIQRWDINEIDRLPDYMKISYKAILDLYKDYEKELSSAGRSHIVCHAIERMKEVVRNYNVESTWFIEGYTPPVSEYLSNALATTTYYYLATTSYLGMKSATEQDFEWLSKNPKILEASVIICRVIDDTATYEVEKSRGQIATGIECCMRDYGISTKEAMAKFQNMAETAWKDINEGLLRPTPVSTEFLTPILNLARIVEVTYIHNLDGYTHPEKVLKPHIINLLVDSIKI,./data/raw/alphafold//AF-Q40577-F1-model_v4.pdb,1734,581,243,263
+1216,8001,8129,MDLTNKNVIFVAALGGIGLDTSRELVKRNLKNFVILDRVENPTALAELKAINPKVNITFHTYDVTVPVAESKKLLKKIFDQLKTVDILINGAGILDDHQIERTIAINFTGLVNTTTAILDFWDKRKGGPGGIIANICSVTGFNAIHQVPVYSASKAAVVSFTNSLAKLAPITGVTAYSINPGITRTPLVHTFNSWLDVEPRVAELLLSHPTQTSEQCGQNFVKAIEANKNGAIWKLDLGTLEAIEWTKHWDSHI,sabio,P10807,CC[C@@H](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>>CCC(C)=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],7.6,7.691302728842139e-15,23.5,9.5,1.1.1.1,7225.0,0.8808135922807914,CC[C@@H](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,CCC(C)=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],0.8808135922807914,CC[C@@H](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__MDLTNKNVIFVAALGGIGLDTSRELVKRNLKNFVILDRVENPTALAELKAINPKVNITFHTYDVTVPVAESKKLLKKIFDQLKTVDILINGAGILDDHQIERTIAINFTGLVNTTTAILDFWDKRKGGPGGIIANICSVTGFNAIHQVPVYSASKAAVVSFTNSLAKLAPITGVTAYSINPGITRTPLVHTFNSWLDVEPRVAELLLSHPTQTSEQCGQNFVKAIEANKNGAIWKLDLGTLEAIEWTKHWDSHI,./data/raw/alphafold//AF-P10807-F1-model_v4.pdb,1827,1509,3084,1844
+1217,19460,19746,MALLVGGTLNPTTHLSLRSRAGRNSENVWLRSAASSQTSKGRFCNLTVRAGTPSKPSEPIGPVFTKLKPWQIPKRDWFSKDFLFGASTSAYQIEGAWNEDGKGPSTWDHFCHTYPERISDGTNGDVAANSYHMYEEDVKALKDMGMKVYRFSISWSRILPNGTGKPNQKGIDYYNNLINSLIRHGIVPYVTIWHWDTPQALEDKYGGFLDKQIVNDYKYFAELCFQSFGDRVKNWFTFNEPHTYCCFSYGEGIHAPGRCSPGLDCAVPEGDSLREPYTAGHHILLAHAEAVELFKAHYNKHGDSKIGMAFDVMGYEPYQDSFLDDQARERSIDYNMGWFLEPVVRGDYPFSMRSLIGDRLPMFTKEEQEKLGSLCDIMGLNYYTSRFSKHVDISSDYTPTLNTDDAYASSETTGSDGNEIGPITGTYWIYMYPKGLTDLLLIMKEKYGNPPIFITENGIADVEGDPEMPDPLDDWKRLDYLQRHISAVKDAIDQGADVRGHFTWGLIDNFEWGSGYSSRFGLVYIDKEDGNKRKLKKSAKWFAKFNSVPKTLLKTTNNNATVTASVSV,sabio,Q9FYS3,O.O=C1C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)Oc2ccccc2N1O>>O=C1C(O)Oc2ccccc2N1O.OCC1OC(O)C(O)C(O)C1O,118.0,7.855575943373608e-15,30.0,5.5,3.2.1.182,4550.0,2.071882007306125,O.O=C1C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)Oc2ccccc2N1O,O=C1C(O)Oc2ccccc2N1O.OCC1OC(O)C(O)C(O)C1O,2.071882007306125,O.O=C1C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)Oc2ccccc2N1O__MALLVGGTLNPTTHLSLRSRAGRNSENVWLRSAASSQTSKGRFCNLTVRAGTPSKPSEPIGPVFTKLKPWQIPKRDWFSKDFLFGASTSAYQIEGAWNEDGKGPSTWDHFCHTYPERISDGTNGDVAANSYHMYEEDVKALKDMGMKVYRFSISWSRILPNGTGKPNQKGIDYYNNLINSLIRHGIVPYVTIWHWDTPQALEDKYGGFLDKQIVNDYKYFAELCFQSFGDRVKNWFTFNEPHTYCCFSYGEGIHAPGRCSPGLDCAVPEGDSLREPYTAGHHILLAHAEAVELFKAHYNKHGDSKIGMAFDVMGYEPYQDSFLDDQARERSIDYNMGWFLEPVVRGDYPFSMRSLIGDRLPMFTKEEQEKLGSLCDIMGLNYYTSRFSKHVDISSDYTPTLNTDDAYASSETTGSDGNEIGPITGTYWIYMYPKGLTDLLLIMKEKYGNPPIFITENGIADVEGDPEMPDPLDDWKRLDYLQRHISAVKDAIDQGADVRGHFTWGLIDNFEWGSGYSSRFGLVYIDKEDGNKRKLKKSAKWFAKFNSVPKTLLKTTNNNATVTASVSV,./data/raw/alphafold//AF-Q9FYS3-F1-model_v4.pdb,1219,3533,1311,3265
+1218,17064,17294,MAELKFKTKAQNLKNLQTKLKKAKVLPLVLTSLEELISNEDKVLQDIQTLKANRLIIRSSSLSEDSMKNSNAGAFLSLANIKADSKDELLKALYEVANSMPSKSDEILVQPMLENITLCGVGFSVDKDNFSPYFCLQYDENGSNSSITDGSSKSAKTYYHYRNYLEFKDIRLQKIIELIKELEVLYDCHFLDVEFAFAIQDDKEELFCLQVRPLVMHEKNNLFHSLPKEALYRFYKRFESLKESRSRVLGDKAIFGVMPDWNPAEIIGLRPKRLAFSLYKEIITDNIWAYQRDNYGYRDLRSHPLIHSFLGIPYVDVRLSFNSFIPKKLDENIAQKLVNFYLDKLNKNHELHDKIEFNIVYSCYDFNSSKKLEELLNHGFNENEIKRLEFSLLELTNKIINPRSGFYLKDIQKAYKLKERYDGIINSNFSLIDKIYWLIEECKRYGTLPFAGVARAAFVAMQLLNSLVEIDFITKEEKDDFLNSLNTVSKNLSKQTNHLNFHNKDQFLKDFGHLRAGTYNILSPRYDEDFELYFDADQKDSKVYLQDKAFVFSKEKTRALNALLKEHGLEINACEFFDFLKQAIEGRELVKFEFTRLLSKAIVYIEELGKYYDIEKEDLAHLDIKSILNLYSSLYSINPKEQFIEEINRNKKEYELTQAIKLPSLLCNADEIFSFYNHSIIPNFITQKSITAFTAKENDKDLEGKIVLIYAADPGYDYLFTKNIAGLITCYGGANSHMAIRASELGMPAVIGVGEENFEKYLKAKKINIECESEQIFCL,brenda,Q0P8J6,NN=C(O)CC[C@H]([NH3+])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.O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,0.41,21.36127538850232,30.0,8.0,2.7.3.13,197.0,-0.3872161432802645,NN=C(O)CC[C@H]([NH3+])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.O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,-0.3872161432802645,NN=C(O)CC[C@H]([NH3+])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.O__MAELKFKTKAQNLKNLQTKLKKAKVLPLVLTSLEELISNEDKVLQDIQTLKANRLIIRSSSLSEDSMKNSNAGAFLSLANIKADSKDELLKALYEVANSMPSKSDEILVQPMLENITLCGVGFSVDKDNFSPYFCLQYDENGSNSSITDGSSKSAKTYYHYRNYLEFKDIRLQKIIELIKELEVLYDCHFLDVEFAFAIQDDKEELFCLQVRPLVMHEKNNLFHSLPKEALYRFYKRFESLKESRSRVLGDKAIFGVMPDWNPAEIIGLRPKRLAFSLYKEIITDNIWAYQRDNYGYRDLRSHPLIHSFLGIPYVDVRLSFNSFIPKKLDENIAQKLVNFYLDKLNKNHELHDKIEFNIVYSCYDFNSSKKLEELLNHGFNENEIKRLEFSLLELTNKIINPRSGFYLKDIQKAYKLKERYDGIINSNFSLIDKIYWLIEECKRYGTLPFAGVARAAFVAMQLLNSLVEIDFITKEEKDDFLNSLNTVSKNLSKQTNHLNFHNKDQFLKDFGHLRAGTYNILSPRYDEDFELYFDADQKDSKVYLQDKAFVFSKEKTRALNALLKEHGLEINACEFFDFLKQAIEGRELVKFEFTRLLSKAIVYIEELGKYYDIEKEDLAHLDIKSILNLYSSLYSINPKEQFIEEINRNKKEYELTQAIKLPSLLCNADEIFSFYNHSIIPNFITQKSITAFTAKENDKDLEGKIVLIYAADPGYDYLFTKNIAGLITCYGGANSHMAIRASELGMPAVIGVGEENFEKYLKAKKINIECESEQIFCL,./data/raw/alphafold//AF-Q0P8J6-F1-model_v4.pdb,2279,4602,4626,4452
+1219,12501,12671,MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVKYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDSWEPELNEAIPNDERDTTTPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGVRGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,brenda,Q1KY81,Cc1nnc(SCC2=C(C(=O)O)N3C(=O)[C@@H](N=C(O)Cn4cnnn4)[C@H]3SC2)s1.O>>,2.2,99.78882192197392,25.0,7.0,3.5.2.6,548.0,0.3424226808222063,Cc1nnc(SCC2=C(C(=O)O)N3C(=O)[C@@H](N=C(O)Cn4cnnn4)[C@H]3SC2)s1.O,,0.3424226808222063,Cc1nnc(SCC2=C(C(=O)O)N3C(=O)[C@@H](N=C(O)Cn4cnnn4)[C@H]3SC2)s1.O__MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVKYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDSWEPELNEAIPNDERDTTTPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGVRGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,./data/raw/alphafold//AF-Q1KY81-F1-model_v4.pdb,1458,402,35,2370
+1220,3864,3917,MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,uniprot_search,P23946,CC(C)C[C@H](N=C(O)CC(=O)O)C(O)=N[C@H](C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C.O>>,79.0,99.85709671979812,45.66666666666666,8.375,3.4.21.39,9606.0,1.8976270912904407,CC(C)C[C@H](N=C(O)CC(=O)O)C(O)=N[C@H](C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C.O,,1.8976270912904407,CC(C)C[C@H](N=C(O)CC(=O)O)C(O)=N[C@H](C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C.O__MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,./data/raw/alphafold//AF-P23946-F1-model_v4.pdb,1858,1553,3136,1905
+1221,6721,6835,MAAALRRGYKVLRSVSHFECRAQHTKPSLKQEPGLGFSFELTEQQKEFQTIARKFAREEIIPVAPDYDKSGEYPFPLIKRAWELGLINTHIPESCGGLGLGTFDACLITEELAYGCTGVQTAIEANSLGQMPVIIAGNDQQKKKYLGRMTEQPMMCAYCVTEPSAGSDVAGIKTKAEKKGDEYVINGQKMWITNGGKANWYFVLTRSNPDPKVPASKAFTGFIVEADTPGIHIGKKELNMGQRCSDTRGITFEDVRVPKENVLIGEGAGFKIAMGAFDRTRPTVAAGAVGLAQRALDEATKYALDRKTFGKLLVEHQGVSFLLAEMAMKVELARLSYQRAAWEVDSGRRNTYFASIAKAFAGDIANQLATDAVQIFGGYGFNTEYPVEKLMRDAKIYQIYEGTAQIQRLIIAREHIEKYKN,sabio,P08503,CCCCC(=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>>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)c1N2,25.4,35.025428839853745,32.0,8.0,1.3.8.7,10116.0,1.404833716619938,CCCCC(=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,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)c1N2,1.404833716619938,CCCCC(=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__MAAALRRGYKVLRSVSHFECRAQHTKPSLKQEPGLGFSFELTEQQKEFQTIARKFAREEIIPVAPDYDKSGEYPFPLIKRAWELGLINTHIPESCGGLGLGTFDACLITEELAYGCTGVQTAIEANSLGQMPVIIAGNDQQKKKYLGRMTEQPMMCAYCVTEPSAGSDVAGIKTKAEKKGDEYVINGQKMWITNGGKANWYFVLTRSNPDPKVPASKAFTGFIVEADTPGIHIGKKELNMGQRCSDTRGITFEDVRVPKENVLIGEGAGFKIAMGAFDRTRPTVAAGAVGLAQRALDEATKYALDRKTFGKLLVEHQGVSFLLAEMAMKVELARLSYQRAAWEVDSGRRNTYFASIAKAFAGDIANQLATDAVQIFGGYGFNTEYPVEKLMRDAKIYQIYEGTAQIQRLIIAREHIEKYKN,./data/raw/alphafold//AF-P08503-F1-model_v4.pdb,3214,1249,1731,2326
+1222,7621,7744,MTHLNIANRVDSFFIPCVTLFGPGCARETGARARSLGARKALIVTDAGLHKMGLSEVVAGHIREAGLQAVIFPGAEPNPTDVNVHDGVKLFEREECDFIVSLGGGSSHDCAKGIGLVTAGGGHIRDYEGIDKSTVPMTPLISINTTAGTAAEMTRFCIITNSSNHVKMAIVDWRCTPLIAIDDPSLMVAMPPALTAATGMDALTHAIEAYVSTAATPITDACAEKAIVLIAEWLPKAVANGDSMEARAAMCYAQYLAGMAFNNASLGYVHAMAHQLGGFYNLPHGVCNAILLPHVSEFNLIAAPERYARIAELLGENIGGLSAHDAAKAAVSAIRTLSTSIGIPAGLAGLGVKADDHEVMASNAQKDACMLTNPRKATLAQVMAIFAAAM,brenda,F8GNE5,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+],6.5,7.691302728842139e-15,30.0,9.5,1.1.1.244,106590.0,0.8129133566428556,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+],0.8129133566428556,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__MTHLNIANRVDSFFIPCVTLFGPGCARETGARARSLGARKALIVTDAGLHKMGLSEVVAGHIREAGLQAVIFPGAEPNPTDVNVHDGVKLFEREECDFIVSLGGGSSHDCAKGIGLVTAGGGHIRDYEGIDKSTVPMTPLISINTTAGTAAEMTRFCIITNSSNHVKMAIVDWRCTPLIAIDDPSLMVAMPPALTAATGMDALTHAIEAYVSTAATPITDACAEKAIVLIAEWLPKAVANGDSMEARAAMCYAQYLAGMAFNNASLGYVHAMAHQLGGFYNLPHGVCNAILLPHVSEFNLIAAPERYARIAELLGENIGGLSAHDAAKAAVSAIRTLSTSIGIPAGLAGLGVKADDHEVMASNAQKDACMLTNPRKATLAQVMAIFAAAM,./data/raw/alphafold//AF-F8GNE5-F1-model_v4.pdb,1239,2203,3890,2761
+1223,18340,18600,MSKVKVGIIGGSGFDDPNLFKKVGVRQVTTPFGKPSDTLVEGFVGDVACVVLPRHGKGHLIPPSEVNYRANVWALKDLGCTHILATNACGSLQEDLVPGDFVVLNQFMDKTWGRENTFYGSKPDSLKGVLHMPMAEPFCERTRQILIQAARNKSINVYDKKTMDKSACIHPCVHAEGSAVTINGPRFSTRCESFIHKAMGLDIVNMTLVPEVSLAREAGLSYASIAIVTDFDCWKSEEEHVCVDMVLEQFRKSVVHVREILLEAVALIGAEDWTKTIEANKALVMSSRQDLLHQGSNDK,brenda,I0B503,Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O.O=P(O)(O)O>>Nc1nc[nH]c2ncnc1-2.O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H]1O,334.1,7.771036020332536e-15,25.0,7.4,2.4.2.28,6183.0,2.523876475638132,Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O.O=P(O)(O)O,Nc1nc[nH]c2ncnc1-2.O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H]1O,2.523876475638132,Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O.O=P(O)(O)O__MSKVKVGIIGGSGFDDPNLFKKVGVRQVTTPFGKPSDTLVEGFVGDVACVVLPRHGKGHLIPPSEVNYRANVWALKDLGCTHILATNACGSLQEDLVPGDFVVLNQFMDKTWGRENTFYGSKPDSLKGVLHMPMAEPFCERTRQILIQAARNKSINVYDKKTMDKSACIHPCVHAEGSAVTINGPRFSTRCESFIHKAMGLDIVNMTLVPEVSLAREAGLSYASIAIVTDFDCWKSEEEHVCVDMVLEQFRKSVVHVREILLEAVALIGAEDWTKTIEANKALVMSSRQDLLHQGSNDK,./data/raw/alphafold//AF-I0B503-F1-model_v4.pdb,3629,3610,1400,3361
+1224,5766,5852,MFKTTLCALLITASCSTFAAPQQINDIVHRTITPLIEQQKIPGMAVAVIYQGKPYYFTWGYADIAKKQPVTQQTLFELGSVSKTFTGVLGGDAIARGEIKLSDPTTKYWPELTAKQWNGITLLHLATYTAGGLPLQVPDEVKSSSDLLRFYQNWQPAWAPGTQRLYANSSIGLFGALAVKPSGLSFEQAMQTRVFQPLKLNHTWINVPPAEEKNYAWGYREGKAVHVSPGALDAEAYGVKSTIEDMARWVQSNLKPLDINEKTLQQGIQLAQSRYWQTGDMYQGLGWEMLDWPVNPDSIINGSDNKIALAARPVKAITPPTPAVRASWVHKTGATGGFGSYVAFIPEKELGIVMLANKNYPNPARVDAAWQILNALQ,sabio,P00811,CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(N)c3ccccc3)C2SC1.O>>,38.0,99.72708242929389,,8.2,3.5.2.6,562.0,1.57978359661681,CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(N)c3ccccc3)C2SC1.O,,1.57978359661681,CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(N)c3ccccc3)C2SC1.O__MFKTTLCALLITASCSTFAAPQQINDIVHRTITPLIEQQKIPGMAVAVIYQGKPYYFTWGYADIAKKQPVTQQTLFELGSVSKTFTGVLGGDAIARGEIKLSDPTTKYWPELTAKQWNGITLLHLATYTAGGLPLQVPDEVKSSSDLLRFYQNWQPAWAPGTQRLYANSSIGLFGALAVKPSGLSFEQAMQTRVFQPLKLNHTWINVPPAEEKNYAWGYREGKAVHVSPGALDAEAYGVKSTIEDMARWVQSNLKPLDINEKTLQQGIQLAQSRYWQTGDMYQGLGWEMLDWPVNPDSIINGSDNKIALAARPVKAITPPTPAVRASWVHKTGATGGFGSYVAFIPEKELGIVMLANKNYPNPARVDAAWQILNALQ,./data/raw/alphafold//AF-P00811-F1-model_v4.pdb,1456,965,6261,1070
+1225,16922,17152,MNKEQLKTPFFMIDEAKLIQNLEIAKQLKEISGVKLVLALKCFSTWGVFDIIKPYLDGTTSSGPFEVKLGYEKFGGETHAYSVGYSEDDVREVADLCDKIIFNSQSQLAAHRHIVEGKASIGLRLNPGVSYASQDLANPARQFSRLGVQADHIDPAVFDSINGVMFHMNCENKDVDAFIALLDSISERFGAYLNKLDWVSMGGGVFFTWPGYDVEKLGLALKAFSEKHGVQMYLEPGEAIITKTTDLVVTVVDLVENGMKTAIVDSATEAHRLDTLIYKEPASVLEASENGEHEYVIGSCSCLAGDQFCVAKFDQPLHVGQRLHILDSAGYTMVKLNWFNGLKMPSVYCERTNGEIQKLNEFGYEDFKRSLSLWSVQ,sabio,Q8D8D2,NCCCNCC[C@H](N)C(=O)O>>NCCCNCCCN.O=C=O,20.1,0.0,37.0,8.0,4.1.1.96,672.0,1.3031960574204888,NCCCNCC[C@H](N)C(=O)O,NCCCNCCCN.O=C=O,1.3031960574204888,NCCCNCC[C@H](N)C(=O)O__MNKEQLKTPFFMIDEAKLIQNLEIAKQLKEISGVKLVLALKCFSTWGVFDIIKPYLDGTTSSGPFEVKLGYEKFGGETHAYSVGYSEDDVREVADLCDKIIFNSQSQLAAHRHIVEGKASIGLRLNPGVSYASQDLANPARQFSRLGVQADHIDPAVFDSINGVMFHMNCENKDVDAFIALLDSISERFGAYLNKLDWVSMGGGVFFTWPGYDVEKLGLALKAFSEKHGVQMYLEPGEAIITKTTDLVVTVVDLVENGMKTAIVDSATEAHRLDTLIYKEPASVLEASENGEHEYVIGSCSCLAGDQFCVAKFDQPLHVGQRLHILDSAGYTMVKLNWFNGLKMPSVYCERTNGEIQKLNEFGYEDFKRSLSLWSVQ,./data/raw/alphafold//AF-Q8D8D2-F1-model_v4.pdb,2724,5258,2514,5332
+1226,6860,6976,MEICTKGSRKHLTSRASEPSYNVPENQYVLYVVSSTLSIVKQLVKVAESKKSRFSGAIEKLNERLDSLKDYRIINRDLVVKDLERLKKRFDTEVINAELSEQLAKINVNLSRSYSEKGYLRLEKATGSENEWWAKIKPSQNDDWQQFEPDGYTIFSSRDHYASLFKSYSDYEIEAKIPLPLRRGKAVVLYPEYISRICVLPESRSIQREQENFTKLRDKGIALSKKDWQAKLTTDELAEQEKERATINKRLGYFATEHEKVGIVHKALEPKLKPFQQIEKEWRQCKVKSKSTFPNSMTFVQNPAYQAVHSGFKKLKEQIGLADEDILLSLEKIEAIGLVNMPLLYERWCLLQIIKVLTQAFRYQPEDNWKRKLIANIQGNEEQISIQFFNPSVSRAITLQYEPFLANGKRPDFVLDVEAITKSGNQISKRLVVDAKYYSAAYLKQRGGIGGVIHELYNGKDYSECQENSVFVLHPVLDAVEKVVSPQEWAKDSYLGELSMFDWEPAHHQRQATNYGAVCANPMKSQRYLDEIQRMLGMFLQYGIEDNTSFRGASDDTHAVNFCVSCGSEKVVDVTKSMSSNNQKRWYRCNECTHFTVYTHCGTCNTRLIKNGEYWTYLSLMPMSSINIKCPNCESPV,brenda,Q52NW7,CCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,507.0,0.0,30.0,7.0,3.1.1.1,576.0,2.705007959333336,CCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,2.705007959333336,CCCCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MEICTKGSRKHLTSRASEPSYNVPENQYVLYVVSSTLSIVKQLVKVAESKKSRFSGAIEKLNERLDSLKDYRIINRDLVVKDLERLKKRFDTEVINAELSEQLAKINVNLSRSYSEKGYLRLEKATGSENEWWAKIKPSQNDDWQQFEPDGYTIFSSRDHYASLFKSYSDYEIEAKIPLPLRRGKAVVLYPEYISRICVLPESRSIQREQENFTKLRDKGIALSKKDWQAKLTTDELAEQEKERATINKRLGYFATEHEKVGIVHKALEPKLKPFQQIEKEWRQCKVKSKSTFPNSMTFVQNPAYQAVHSGFKKLKEQIGLADEDILLSLEKIEAIGLVNMPLLYERWCLLQIIKVLTQAFRYQPEDNWKRKLIANIQGNEEQISIQFFNPSVSRAITLQYEPFLANGKRPDFVLDVEAITKSGNQISKRLVVDAKYYSAAYLKQRGGIGGVIHELYNGKDYSECQENSVFVLHPVLDAVEKVVSPQEWAKDSYLGELSMFDWEPAHHQRQATNYGAVCANPMKSQRYLDEIQRMLGMFLQYGIEDNTSFRGASDDTHAVNFCVSCGSEKVVDVTKSMSSNNQKRWYRCNECTHFTVYTHCGTCNTRLIKNGEYWTYLSLMPMSSINIKCPNCESPV,./data/raw/alphafold//AF-Q52NW7-F1-model_v4.pdb,1484,1028,854,1183
+1227,6287,6396,MSGSYPSPKGIHPFLLLALVVGGAVQASKIVGGHEARPHSRPYVASLQLSRFPGSHFCGGTLIHPRFVLTAAHCLQDISWQLVTVVLGAHDLLSSEPEQQKFTISQVFQNNYNPEENLNDVLLLQLNRTASLGKEVAVASLPQQDQTLSQGTQCLAMGWGRLGTQAPTPRVLQELNVTVVTFLCREHNVCTLVPRRAAGICFGDSGGPLICNGILHGVDSFVIRECASLQFPDFFARVSMYVDWIQNVLRGAEP,brenda,Q61096,CCC(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>>CCC(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)O.Nc1ccc([N+](=O)[O-])cc1,7.2,8.318991428442978e-15,37.0,7.5,3.4.21.76,10090.0,0.8573324964312685,CCC(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,CCC(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)O.Nc1ccc([N+](=O)[O-])cc1,0.8573324964312685,CCC(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__MSGSYPSPKGIHPFLLLALVVGGAVQASKIVGGHEARPHSRPYVASLQLSRFPGSHFCGGTLIHPRFVLTAAHCLQDISWQLVTVVLGAHDLLSSEPEQQKFTISQVFQNNYNPEENLNDVLLLQLNRTASLGKEVAVASLPQQDQTLSQGTQCLAMGWGRLGTQAPTPRVLQELNVTVVTFLCREHNVCTLVPRRAAGICFGDSGGPLICNGILHGVDSFVIRECASLQFPDFFARVSMYVDWIQNVLRGAEP,./data/raw/alphafold//AF-Q61096-F1-model_v4.pdb,1869,1572,3160,1931
+1228,2107,2138,MTSMTQSLREVIKAMTKARNFERVLGKITLVSAAPGKVICEMKVEEEHTNAIGTLHGGLTATLVDNISTMALLCTERGAPGVSVDMNITYMSPAKLGEDIVITAHVLKQGKTLAFTSVDLTNKATGKLIAQGRHTKHLGN,brenda,Q9NPJ3,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(=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,0.054,0.0,37.0,7.5,3.1.2.20,9606.0,-1.2676062401770316,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(=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,-1.2676062401770316,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__MTSMTQSLREVIKAMTKARNFERVLGKITLVSAAPGKVICEMKVEEEHTNAIGTLHGGLTATLVDNISTMALLCTERGAPGVSVDMNITYMSPAKLGEDIVITAHVLKQGKTLAFTSVDLTNKATGKLIAQGRHTKHLGN,./data/raw/alphafold//AF-Q9NPJ3-F1-model_v4.pdb,1636,1238,1720,275
+1229,18308,18568,MEPPTVPSERSLSLSLPGPREGQATLKPPPQHLWRQPRTPIRIQQRGYSDSAERAERERQPHRPIERADAMDTSDRPGLRTTRMSWPSSFHGTGTGSGGAGGGSSRRFEAENGPTPSPGRSPLDSQASPGLVLHAGAATSQRRESFLYRSDSDYDMSPKTMSRNSSVTSEAHAEDLIVTPFAQVLASLRSVRSNFSLLTNVPVPSNKRSPLGGPTPVCKATLSEETCQQLARETLEELDWCLEQLETMQTYRSVSEMASHKFKRMLNRELTHLSEMSRSGNQVSEYISTTFLDKQNEVEIPSPTMKEREKQQAPRPRPSQPPPPPVPHLQPMSQITGLKKLMHSNSLNNSNIPRFGVKTDQEELLAQELENLNKWGLNIFCVSDYAGGRSLTCIMYMIFQERDLLKKFRIPVDTMVTYMLTLEDHYHADVAYHNSLHAADVLQSTHVLLATPALDAVFTDLEILAALFAAAIHDVDHPGVSNQFLINTNSELALMYNDESVLENHHLAVGFKLLQEDNCDIFQNLSKRQRQSLRKMVIDMVLATDMSKHMTLLADLKTMVETKKVTSSGVLLLDNYSDRIQVLRNMVHCADLSNPTKPLELYRQWTDRIMAEFFQQGDRERERGMEISPMCDKHTASVEKSQVGFIDYIVHPLWETWADLVHPDAQEILDTLEDNRDWYYSAIRQSPSPPPEEESRGPGHPPLPDKFQFELTLEEEEEEEISMAQIPCTAQEALTAQGLSGVEEALDATIAWEASPAQESLEVMAQEASLEAELEAVYLTQQAQSTGSAPVAPDEFSSREEFVVAVSHSSPSALALQSPLLPAWRTLSVSEHAPGLPGLPSTAAEVEAQREHQAAKRACSACAGTFGEDTSALPAPGGGGSGGDPT,brenda,P27815,Nc1ncnc2c1ncn2[C@@H]1O[C@@H]2COP(=O)(O)O[C@H]2[C@H]1O.O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O,6.7,0.0,25.0,7.5,3.1.4.53,9606.0,0.8260748027008264,Nc1ncnc2c1ncn2[C@@H]1O[C@@H]2COP(=O)(O)O[C@H]2[C@H]1O.O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O,0.8260748027008264,Nc1ncnc2c1ncn2[C@@H]1O[C@@H]2COP(=O)(O)O[C@H]2[C@H]1O.O__MEPPTVPSERSLSLSLPGPREGQATLKPPPQHLWRQPRTPIRIQQRGYSDSAERAERERQPHRPIERADAMDTSDRPGLRTTRMSWPSSFHGTGTGSGGAGGGSSRRFEAENGPTPSPGRSPLDSQASPGLVLHAGAATSQRRESFLYRSDSDYDMSPKTMSRNSSVTSEAHAEDLIVTPFAQVLASLRSVRSNFSLLTNVPVPSNKRSPLGGPTPVCKATLSEETCQQLARETLEELDWCLEQLETMQTYRSVSEMASHKFKRMLNRELTHLSEMSRSGNQVSEYISTTFLDKQNEVEIPSPTMKEREKQQAPRPRPSQPPPPPVPHLQPMSQITGLKKLMHSNSLNNSNIPRFGVKTDQEELLAQELENLNKWGLNIFCVSDYAGGRSLTCIMYMIFQERDLLKKFRIPVDTMVTYMLTLEDHYHADVAYHNSLHAADVLQSTHVLLATPALDAVFTDLEILAALFAAAIHDVDHPGVSNQFLINTNSELALMYNDESVLENHHLAVGFKLLQEDNCDIFQNLSKRQRQSLRKMVIDMVLATDMSKHMTLLADLKTMVETKKVTSSGVLLLDNYSDRIQVLRNMVHCADLSNPTKPLELYRQWTDRIMAEFFQQGDRERERGMEISPMCDKHTASVEKSQVGFIDYIVHPLWETWADLVHPDAQEILDTLEDNRDWYYSAIRQSPSPPPEEESRGPGHPPLPDKFQFELTLEEEEEEEISMAQIPCTAQEALTAQGLSGVEEALDATIAWEASPAQESLEVMAQEASLEAELEAVYLTQQAQSTGSAPVAPDEFSSREEFVVAVSHSSPSALALQSPLLPAWRTLSVSEHAPGLPGLPSTAAEVEAQREHQAAKRACSACAGTFGEDTSALPAPGGGGSGGDPT,./data/raw/alphafold//AF-P27815-F1-model_v4.pdb,78,4892,2853,5701
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+1237,17052,17282,MSQSPDVIEQQHTNRVPKDKQPFPSAQHRHPLDPLRWDEILLARSVLLNSSLLTEGHPTVHIITLETPEKEEVLNWKPGQLPAPLRRAYVETILFGKTHKIVVDVAAGALVSDEIHHAPGYPSLSSNDILIVATLPSTHPPFLQSLKARGVGVSDVVCLPISPGWFGIPEEEGKRLVKALCYNKNGSANVFMRPLEGIVILLDLDRKQILKYVDDRKVPIPKVEGTDYRLFAQKPPLMKPLNPISLEQPLGPSFKVEGNLVKWANWEFHVRPDFRAGMVISQAVIHDPETGEARSVLYEGFPSELFVPYMDPSEGWYFKTYMDSGEYGLGMLALPLQPLNDCPRNAHYFDAVFAGPDGNPYVTPNILCVFERYAGDVAWRHSEAFVQDFEVHEVRPKVTLVVRMVGSVGNYDYIFDWEFQTDGILRVNVGMTGLLMVKATSINSIAENIVDLHGTLVSENTIGVFHDHFINFHLDLDIDGLTNTFIKKILKRKNVVNNESPRKSYWTTENQIAETEDDAKIRLKAFEPSEFHIVNSKKRTRLGNPVGYRIVPGFTADSLLSSVDPPQHRAAFIDNQIWVTPLNKSERWAGGLFVYESHGEDTLAVWSKRNRAIQGRDIVLWYTMGFHHVPCQEDFPIMPTLSGSFELKPSNFLERNPILKTLPNYPSQLPKCSIGSHVDER,brenda,I6NC69,NCc1ccccc1.O.O=O>>N.O=Cc1ccccc1.OO,1.4,0.0,25.0,8.0,1.4.3.21,355589.0,0.1461280356782379,NCc1ccccc1.O.O=O,N.O=Cc1ccccc1.OO,0.1461280356782379,NCc1ccccc1.O.O=O__MSQSPDVIEQQHTNRVPKDKQPFPSAQHRHPLDPLRWDEILLARSVLLNSSLLTEGHPTVHIITLETPEKEEVLNWKPGQLPAPLRRAYVETILFGKTHKIVVDVAAGALVSDEIHHAPGYPSLSSNDILIVATLPSTHPPFLQSLKARGVGVSDVVCLPISPGWFGIPEEEGKRLVKALCYNKNGSANVFMRPLEGIVILLDLDRKQILKYVDDRKVPIPKVEGTDYRLFAQKPPLMKPLNPISLEQPLGPSFKVEGNLVKWANWEFHVRPDFRAGMVISQAVIHDPETGEARSVLYEGFPSELFVPYMDPSEGWYFKTYMDSGEYGLGMLALPLQPLNDCPRNAHYFDAVFAGPDGNPYVTPNILCVFERYAGDVAWRHSEAFVQDFEVHEVRPKVTLVVRMVGSVGNYDYIFDWEFQTDGILRVNVGMTGLLMVKATSINSIAENIVDLHGTLVSENTIGVFHDHFINFHLDLDIDGLTNTFIKKILKRKNVVNNESPRKSYWTTENQIAETEDDAKIRLKAFEPSEFHIVNSKKRTRLGNPVGYRIVPGFTADSLLSSVDPPQHRAAFIDNQIWVTPLNKSERWAGGLFVYESHGEDTLAVWSKRNRAIQGRDIVLWYTMGFHHVPCQEDFPIMPTLSGSFELKPSNFLERNPILKTLPNYPSQLPKCSIGSHVDER,./data/raw/alphafold//AF-I6NC69-F1-model_v4.pdb,3560,3815,2397,5300
+1238,12133,12296,GIASPYAPMGVATPVDGGYILNGRWSFSSGTDHCDWVMIGAAVGDKDGNRLNPPQSLHVLLPRSDYRIDHDSWNVVGLRGTGSKDLIVENAFLPEYRTLRAERVMGGVAWQDAGRDETLYKFPFSCIFPLGITSSLIGIAEGALNCYIESQRERVTVSGTAIKQDPYVLSNLGDAAAEIAASRAALLETVDRFWDLTERGIRGHLRATRDRTPDPGRRGHGGPCAPSNEIFFAGRRAGALQLSNPLQRFWRDAHAGLSHAIHVPGSIFHAATLTQLGEEPQGMNAGR,brenda,Q6QF57,Cc1ccc(O)c(O)c1.O=O>>CC(/C=C(\O)C(=O)O)=C\C=O,2.0,0.0,80.0,,1.13.11.39,103816.0,0.3010299956639812,Cc1ccc(O)c(O)c1.O=O,CC(/C=C(\O)C(=O)O)=C\C=O,0.3010299956639812,Cc1ccc(O)c(O)c1.O=O__GIASPYAPMGVATPVDGGYILNGRWSFSSGTDHCDWVMIGAAVGDKDGNRLNPPQSLHVLLPRSDYRIDHDSWNVVGLRGTGSKDLIVENAFLPEYRTLRAERVMGGVAWQDAGRDETLYKFPFSCIFPLGITSSLIGIAEGALNCYIESQRERVTVSGTAIKQDPYVLSNLGDAAAEIAASRAALLETVDRFWDLTERGIRGHLRATRDRTPDPGRRGHGGPCAPSNEIFFAGRRAGALQLSNPLQRFWRDAHAGLSHAIHVPGSIFHAATLTQLGEEPQGMNAGR,./data/raw/alphafold//AF-Q6QF57-F1-model_v4.pdb,1995,4151,4017,3860
+1239,16859,17089,MNIMKEKLAALETKLKAQEGKDGKKTNFQTEMNPHVVTWKLFAVSVLLLALYPSHAAAISLRDNLADCLEDRDYDKLLHIAEFGLPNINTSHHVVIAGAGMAGLTAAKLLKEAGHKVTILEASSRVGGRVETYRNEKEGWYAELGAMRIPSSHQIVRWYAKELGVKLNEFIMDDPNTFYLVNGVLEKTETVQKDPDVLKYHVEASEKGKSADELLQHALQKVQDEVEASGCRAALLKYDRYSVKDYLKEEGGLSSEAVRMLGDLLNQQSLMYTALSEMVYDQTDINDDVKYSEVTGGSDLLPKAFVDVLDELGVPILLNSTVKRISQSDKGVIVSYEKGQQSSLTDLTADVVLVTTTTKAALFMDFDPPLPIKKMEALRAAHYDSSTKILLTFSERFWEKDGIRGGKSITDGPSRYIYYPSHSFPTNKNIGVLLASYTWSDDSLLFLGASDEDLKELALRDLAKIHGEHVRSLCTGVLVKKWSMDPYSLGAFALFTPYQHLEFAKELFRSEGRVHFAGEHTAFPHAWIEASLKSAIRAATNINKESARSPHDEL,brenda,A1IGW6,NCCCC[C@H](N)C(=O)O.O.O=O>>N.NCCCCC(=O)C(=O)O.OO,20.4,7.224523629635546e-15,37.0,4.0,1.4.3.2,214486.0,1.3096301674258988,NCCCC[C@H](N)C(=O)O.O.O=O,N.NCCCCC(=O)C(=O)O.OO,1.3096301674258988,NCCCC[C@H](N)C(=O)O.O.O=O__MNIMKEKLAALETKLKAQEGKDGKKTNFQTEMNPHVVTWKLFAVSVLLLALYPSHAAAISLRDNLADCLEDRDYDKLLHIAEFGLPNINTSHHVVIAGAGMAGLTAAKLLKEAGHKVTILEASSRVGGRVETYRNEKEGWYAELGAMRIPSSHQIVRWYAKELGVKLNEFIMDDPNTFYLVNGVLEKTETVQKDPDVLKYHVEASEKGKSADELLQHALQKVQDEVEASGCRAALLKYDRYSVKDYLKEEGGLSSEAVRMLGDLLNQQSLMYTALSEMVYDQTDINDDVKYSEVTGGSDLLPKAFVDVLDELGVPILLNSTVKRISQSDKGVIVSYEKGQQSSLTDLTADVVLVTTTTKAALFMDFDPPLPIKKMEALRAAHYDSSTKILLTFSERFWEKDGIRGGKSITDGPSRYIYYPSHSFPTNKNIGVLLASYTWSDDSLLFLGASDEDLKELALRDLAKIHGEHVRSLCTGVLVKKWSMDPYSLGAFALFTPYQHLEFAKELFRSEGRVHFAGEHTAFPHAWIEASLKSAIRAATNINKESARSPHDEL,./data/raw/alphafold//AF-A1IGW6-F1-model_v4.pdb,1381,3828,2416,5325
+1240,21858,22184,MKTVTVRDLVVGEGAPKIIVSLMGKTITDVKSEALAYREADFDILEWRVDHFANVTTAESVLEAAGAIREIITDKPLLFTFRSAKEGGEQALTTGQYIDLNRAAVDSGLVDMIDLELFTGDDEVKATVGYAHQHNVAVIMSNHDFHKTPAAEEIVQRLRKMQELGADIPKIAVMPQTKADVLTLLTATVEMQERYADRPIITMSMSKTGVISRLAGEVFGSAATFGAVKKASAPGQISVADLRTVLTILHQA,brenda,P58687,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O>>O.O=C(O)C1=CC(=O)[C@@H](O)[C@H](O)C1,210.0,7.453857947349876e-15,37.0,7.5,4.2.1.10,28901.0,2.322219294733919,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O,O.O=C(O)C1=CC(=O)[C@@H](O)[C@H](O)C1,2.4913616938342726,O=C1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O__MKTVTVRDLVVGEGAPKIIVSLMGKTITDVKSEALAYREADFDILEWRVDHFANVTTAESVLEAAGAIREIITDKPLLFTFRSAKEGGEQALTTGQYIDLNRAAVDSGLVDMIDLELFTGDDEVKATVGYAHQHNVAVIMSNHDFHKTPAAEEIVQRLRKMQELGADIPKIAVMPQTKADVLTLLTATVEMQERYADRPIITMSMSKTGVISRLAGEVFGSAATFGAVKKASAPGQISVADLRTVLTILHQA,./data/raw/alphafold//AF-P58687-F1-model_v4.pdb,720,121,5845,6755
+1241,10297,10448,MTKFDFDTVINRYGTYSTQWDYVKDRFGEANLLPFTISDMDFKAPKGVSDVIIDAANRGVFGYTRWNNNEFKSAIVDWFLNRYQVRVDAEAIVYSPSVIFSLAKLIELFSKPHEKIVTFSPCYDAFINTVTANDRQLIQMDITNGLVIEKLEHVFKIEHPKILLLCNPQNPLGIVWSSELLQTIVRLCNAYNVAVISDEIHMDVVRKGVVVHTIAEYFSELTTQCAVITSASKSFNIPALGCSYALIPDELMRLKFLYELKQKNAVSSVPYLGMLATIECYNHQEDWLNQLNDYVDDNFKYLQTFLKEQLNLDYQIPDATYLAWIDIRPLGIPMTVLQEELIKCQKVAIMDGRLYGNGGSDHLRYNLGASRSKVEEGLNRLLKAVEAIQQR,brenda,A0A223K4L6,C[C@@H](N)C(=O)O>>C[C@H](N)C(=O)O,1830.0,0.0,45.0,10.0,5.1.1.10,1599.0,3.2624510897304293,C[C@@H](N)C(=O)O,C[C@H](N)C(=O)O,3.2624510897304293,C[C@@H](N)C(=O)O__MTKFDFDTVINRYGTYSTQWDYVKDRFGEANLLPFTISDMDFKAPKGVSDVIIDAANRGVFGYTRWNNNEFKSAIVDWFLNRYQVRVDAEAIVYSPSVIFSLAKLIELFSKPHEKIVTFSPCYDAFINTVTANDRQLIQMDITNGLVIEKLEHVFKIEHPKILLLCNPQNPLGIVWSSELLQTIVRLCNAYNVAVISDEIHMDVVRKGVVVHTIAEYFSELTTQCAVITSASKSFNIPALGCSYALIPDELMRLKFLYELKQKNAVSSVPYLGMLATIECYNHQEDWLNQLNDYVDDNFKYLQTFLKEQLNLDYQIPDATYLAWIDIRPLGIPMTVLQEELIKCQKVAIMDGRLYGNGGSDHLRYNLGASRSKVEEGLNRLLKAVEAIQQR,./data/raw/alphafold//AF-A0A223K4L6-F1-model_v4.pdb,3644,3630,1422,3384
+1242,19438,19724,MRFIHALLLAGIAHSAYASEKLTFKTDLEKLEREKAAQIGVAIVDPQGEIVAGHRMAQRFAMCSTFKFPLAALVFERIDSGTERGDRKLSYGPDMIVEWSPATERFLASGHMTVLEAAQAAVQLSDNGATNLLLREIGGPAAMTQYFRKIGDSVSRLDRKEPEMSDNTPGDLRDTTTPIAMARTVAKVLYGGALTSTSTHTIERWLIGNQTGDATLRAGFPKDWVVGEKTGTCANGGRNDIGFFKAQERDYAVAVYTTAPKLSAVERDELVASVGQVITQLILSTDK,brenda,Q09HD0,O.O=C([O-])C1=C(C[n+]2ccccc2)CS[C@@H]2[C@H](N=C(O)Cc3cccs3)C(=O)N12>>,190.0,99.76985622918636,30.0,7.0,3.5.2.6,573.0,2.278753600952829,O.O=C([O-])C1=C(C[n+]2ccccc2)CS[C@@H]2[C@H](N=C(O)Cc3cccs3)C(=O)N12,,2.278753600952829,O.O=C([O-])C1=C(C[n+]2ccccc2)CS[C@@H]2[C@H](N=C(O)Cc3cccs3)C(=O)N12__MRFIHALLLAGIAHSAYASEKLTFKTDLEKLEREKAAQIGVAIVDPQGEIVAGHRMAQRFAMCSTFKFPLAALVFERIDSGTERGDRKLSYGPDMIVEWSPATERFLASGHMTVLEAAQAAVQLSDNGATNLLLREIGGPAAMTQYFRKIGDSVSRLDRKEPEMSDNTPGDLRDTTTPIAMARTVAKVLYGGALTSTSTHTIERWLIGNQTGDATLRAGFPKDWVVGEKTGTCANGGRNDIGFFKAQERDYAVAVYTTAPKLSAVERDELVASVGQVITQLILSTDK,./data/raw/alphafold//AF-Q09HD0-F1-model_v4.pdb,1458,993,806,1121
+1243,19488,19774,MTNIAKAQPKLYVMDNGRMRMDKNWMIAMHNPATIANPNAPTEFIEFPIYTVLIDHPEGKILFDTSCNPDSMGAQGRWGEATQSMFPWTASEECYLHNRLEQLKVRPEDIKFVIASHLHLDHAGCLEMFTNATIIVHEDEFSGALQTYARNQTEGAYIWGDIDAWIKNNLNWRTIKRDEDNIVLAEGIKILNFGSGHAWGMLGLHVQLPEKGGIILASDAVYSAESYGPPIKPPGIIYDSLGFVRSVEKIKRIAKETNSEVWFGHDSEQFKRFRKSTEGYYE,brenda,T0BMH6,O.O=C1CCCCO1>>O=C(O)CCCCO,8.4,0.0,25.0,8.3,3.1.1.81,1450.0,0.9242792860618816,O.O=C1CCCCO1,O=C(O)CCCCO,0.9242792860618816,O.O=C1CCCCO1__MTNIAKAQPKLYVMDNGRMRMDKNWMIAMHNPATIANPNAPTEFIEFPIYTVLIDHPEGKILFDTSCNPDSMGAQGRWGEATQSMFPWTASEECYLHNRLEQLKVRPEDIKFVIASHLHLDHAGCLEMFTNATIIVHEDEFSGALQTYARNQTEGAYIWGDIDAWIKNNLNWRTIKRDEDNIVLAEGIKILNFGSGHAWGMLGLHVQLPEKGGIILASDAVYSAESYGPPIKPPGIIYDSLGFVRSVEKIKRIAKETNSEVWFGHDSEQFKRFRKSTEGYYE,./data/raw/alphafold//AF-T0BMH6-F1-model_v4.pdb,3255,2082,3740,2596
+1244,7150,7271,MAPHRLRRLIPASVALTTVCAALPTSSAYAADTPPTPHLDSIERSLRETSPGLEGSVWQRTNGNRLDAPGDDPAGWLLQTPGCWGDPACKDRAGSRRLLDKMTRNIADAKRTVDISSLAPFPNGGFEDAIVAGLKASVAAGHSPRVRILVGAAPLYHLNVIPSRYRDELLGKLGSAAGKVTLNVASMTTSKTSFSWNHSKLLVVDGTTAVTGGINGWKDDYLDTTHPVSDVDMALTGPAARSAGKYLDTLWDWTCQNSSNPAKVWLATSNGASCMPSLEKEEDSTPAAPAGDVPVLAVGGLGVGIKESDPSSGYHPELPTAPDTKCTVGLHDNTNADRDYDTVNPEETALRSLIASARSHVEISQQDMNATCWPLPRYDIRTYDTLAAKLAAGVKVRIVVGDPANRGAVGSGGYSQIKSLDEISDTLRKRLVARTGDNEKASRAMCSNLQLASFRSSDSPTWADGKPYALHHKLVSVDDSAFYIGSKNLYPAWLQDFGYIVESPSAAKQLKTELLDPEWKYSQGAASTPAGCSGNGAG,brenda,A0A0E4B8Q4,CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC[N+](C)(C)C.O>>CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)O.C[N+](C)(C)CCO,4000.0,2.1873678074332173e-14,37.0,5.0,3.1.4.3,936074.0,3.6020599913279625,CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC[N+](C)(C)C.O,CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)O.C[N+](C)(C)CCO,3.6020599913279625,CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC[N+](C)(C)C.O__MAPHRLRRLIPASVALTTVCAALPTSSAYAADTPPTPHLDSIERSLRETSPGLEGSVWQRTNGNRLDAPGDDPAGWLLQTPGCWGDPACKDRAGSRRLLDKMTRNIADAKRTVDISSLAPFPNGGFEDAIVAGLKASVAAGHSPRVRILVGAAPLYHLNVIPSRYRDELLGKLGSAAGKVTLNVASMTTSKTSFSWNHSKLLVVDGTTAVTGGINGWKDDYLDTTHPVSDVDMALTGPAARSAGKYLDTLWDWTCQNSSNPAKVWLATSNGASCMPSLEKEEDSTPAAPAGDVPVLAVGGLGVGIKESDPSSGYHPELPTAPDTKCTVGLHDNTNADRDYDTVNPEETALRSLIASARSHVEISQQDMNATCWPLPRYDIRTYDTLAAKLAAGVKVRIVVGDPANRGAVGSGGYSQIKSLDEISDTLRKRLVARTGDNEKASRAMCSNLQLASFRSSDSPTWADGKPYALHHKLVSVDDSAFYIGSKNLYPAWLQDFGYIVESPSAAKQLKTELLDPEWKYSQGAASTPAGCSGNGAG,./data/raw/alphafold//AF-A0A0E4B8Q4-F1-model_v4.pdb,3295,2133,3806,2670
+1245,3358,3406,MSIEYSVIVPAYHEKLNIKPLTTRLFAGMSPEMAKKTELIFVDDNSQDGSVEEVDALAHQGYNVRIIVRTNERGLSSAVLKGFYEAKGQYLVCMDADLQHPPETVPKLFESLHDHAFTLGTRYAPGVGIDKDWPMYRRVISSTARMMARPLTIASDPMSGFFGLQKKYLENCNPRDINSQGFKIALELLAKLPLPRDPRVAIGEVPFTFGVRTEGESKLSGKVIIQYLQQLKELYVFKFGANNLILFITFWSILFFYVCYQLYHLVF,sabio,P14020,CC(C)=CCCC(C)=CCCC(C)CCOP(=O)(O)O.Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1>>CC(C)=CCCC(C)=CCCC(C)CCOP(=O)(O)OC1OC(CO)C(O)C(O)C1O.Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,12.1,6.245088370904299e-15,37.0,7.0,2.4.1.83,4932.0,1.08278537031645,CC(C)=CCCC(C)=CCCC(C)CCOP(=O)(O)O.Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1,CC(C)=CCCC(C)=CCCC(C)CCOP(=O)(O)OC1OC(CO)C(O)C(O)C1O.Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,1.8506462351830664,CC(C)=CCCC(C)=CCCC(C)CCOP(=O)(O)O.Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1__MSIEYSVIVPAYHEKLNIKPLTTRLFAGMSPEMAKKTELIFVDDNSQDGSVEEVDALAHQGYNVRIIVRTNERGLSSAVLKGFYEAKGQYLVCMDADLQHPPETVPKLFESLHDHAFTLGTRYAPGVGIDKDWPMYRRVISSTARMMARPLTIASDPMSGFFGLQKKYLENCNPRDINSQGFKIALELLAKLPLPRDPRVAIGEVPFTFGVRTEGESKLSGKVIIQYLQQLKELYVFKFGANNLILFITFWSILFFYVCYQLYHLVF,./data/raw/alphafold//AF-P14020-F1-model_v4.pdb,1730,1359,6292,1641
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+1251,21380,21704,MSNNTVSTKPALHFLDINATEVKKYPTAIQDIIINRSFDGMIIRGVFPRDTMEQVARCLEEGNDGGMKSILNKNEEFGTKVAQIYGHAIVGQSPDLKDYFASSAIFRQACRTMFQGSPDFEEQVESIFHSLSGLPVEIPTGPEGQTYTPATIRLLLEGREIAVHVGNDFLLMPAANHLKTLLDLSDQLSYFIPLTVPEAGGELVVYSLEWNPQEASKYAQMQEYMDDVEFKIKSNQSQSVAYAPGPGDMLLFNGGRYYHRVSEVIGNSPRRTIGGFLAFSKQRDKIYYWS,brenda,A0A067YX61,O=C(O)CCC(=O)C(=O)O.O=O.[C-]#[N+][C@@H]1[C@H](c2c[nH]c3ccccc23)[C@@H](C(=C)C)CC[C@@]1(C)C=C.[Cl-]>>O.O=C(O)CCC(=O)O.O=C=O.[C-]#[N+][C@@H]1[C@H](c2c[nH]c3ccccc23)[C@@H](C(=C)C)C[C@@H](Cl)[C@@]1(C)C=C,0.73,0.0971116977205653,30.0,7.45,1.14.20.14,162986.0,-0.1366771398795441,O=C(O)CCC(=O)C(=O)O.O=O.[C-]#[N+][C@@H]1[C@H](c2c[nH]c3ccccc23)[C@@H](C(=C)C)CC[C@@]1(C)C=C.[Cl-],O.O=C(O)CCC(=O)O.O=C=O.[C-]#[N+][C@@H]1[C@H](c2c[nH]c3ccccc23)[C@@H](C(=C)C)C[C@@H](Cl)[C@@]1(C)C=C,-0.1366771398795441,O=C(O)CCC(=O)C(=O)O.O=O.[C-]#[N+][C@@H]1[C@H](c2c[nH]c3ccccc23)[C@@H](C(=C)C)CC[C@@]1(C)C=C.[Cl-]__MSNNTVSTKPALHFLDINATEVKKYPTAIQDIIINRSFDGMIIRGVFPRDTMEQVARCLEEGNDGGMKSILNKNEEFGTKVAQIYGHAIVGQSPDLKDYFASSAIFRQACRTMFQGSPDFEEQVESIFHSLSGLPVEIPTGPEGQTYTPATIRLLLEGREIAVHVGNDFLLMPAANHLKTLLDLSDQLSYFIPLTVPEAGGELVVYSLEWNPQEASKYAQMQEYMDDVEFKIKSNQSQSVAYAPGPGDMLLFNGGRYYHRVSEVIGNSPRRTIGGFLAFSKQRDKIYYWS,./data/raw/alphafold//AF-A0A067YX61-F1-model_v4.pdb,1221,3030,564,645
+1252,11534,11691,MERAFIEWYPRGYGVAFKIKKKIYEKLSKYQKIEVYETEGFGRLLALDGTVQLVTLGERSYHEPLVHPAMLAHPKPKRVLVIGGGDGGTVREVLQHDVDEVIMVEIDEDVIMVSKDLIKIDNGLLEAMLNGKHEKAKLTIGDGFEFIKNNRGFDVIIADSTDPVGPAKVLFSEEFYRYVYDALNNPGIYVTQAGSVYLFTDELISAYKEMKKVFDRVYYYSFPVIGYASPWAFLVGVKGDIDFTKIDRERAKKLQLEYYDPLMHETLFQMPKYIRETLQRL,brenda,Q8U4G1,C[S+](CCCN)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCCCCCN>>CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCCCCCNCCCN,2.09,0.1101348058764889,70.0,7.4,2.5.1.104,2261.0,0.320146286111054,C[S+](CCCN)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCCCCCN,CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCCCCCNCCCN,0.320146286111054,C[S+](CCCN)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.NCCCCCN__MERAFIEWYPRGYGVAFKIKKKIYEKLSKYQKIEVYETEGFGRLLALDGTVQLVTLGERSYHEPLVHPAMLAHPKPKRVLVIGGGDGGTVREVLQHDVDEVIMVEIDEDVIMVSKDLIKIDNGLLEAMLNGKHEKAKLTIGDGFEFIKNNRGFDVIIADSTDPVGPAKVLFSEEFYRYVYDALNNPGIYVTQAGSVYLFTDELISAYKEMKKVFDRVYYYSFPVIGYASPWAFLVGVKGDIDFTKIDRERAKKLQLEYYDPLMHETLFQMPKYIRETLQRL,./data/raw/alphafold//AF-Q8U4G1-F1-model_v4.pdb,3869,3996,1841,3665
+1253,9663,9809,ALLTDPSQLRGDRTYDYVIVGAGNAGNVIAERISAGPHPKSVLVLEAGVSDEGVLAAQVPFLGPTLTPGTFRRTPFDWNYTVAPQEGLDGRTFPFPRGKMLGGCSSVNYMVHHFGSSEDYNKLARDSGDNGWSWSSIKKYIFKHEKIVPPADNSDTDGKFLPQFHGTGGTVSVSLPGNSQSIDAKVIATTDELPEFPFNPDQGHGNGQVLGMGWTQNSIGEGARSSSSTTYLKEALKRPHVDVLINAHVTKLVTTRKKRGRPVFDKVQFASGPGAPVTTVTARREIILSAGAFGTPQILLLSGIGPKTDLDVLGIPTVIHNPSVGQNLSDHVLLPNIFNVRGQDTLDQIIRGDPNVVPGVLDQWTTSRSGPLANGVTNNLGFFRLPANSSIFNSVSDPATGPTASHWEMIVINFYLNPFGPPIPPAGTFMTLISALISPTSRGFVRLASADPFTAPIIDPKFLTTQFDIFALREAVRATKRFVTASVWNDYVISPWGGLAQTSDEGIDAYVRQQSTTVYHPVGTAAISPRGANYGVVDPDLKLKGAEGVRIADASVWPFLPNAHTQGPVYLLAERAADLILGRA,brenda,A0A2Z5WP81,COc1ccc(CO)cc1OC.O=O>>COc1ccc(C=O)cc1OC.OO,13.2,0.0,30.0,5.5,1.1.3.7,5346.0,1.1205739312058498,COc1ccc(CO)cc1OC.O=O,COc1ccc(C=O)cc1OC.OO,1.1205739312058498,COc1ccc(CO)cc1OC.O=O__ALLTDPSQLRGDRTYDYVIVGAGNAGNVIAERISAGPHPKSVLVLEAGVSDEGVLAAQVPFLGPTLTPGTFRRTPFDWNYTVAPQEGLDGRTFPFPRGKMLGGCSSVNYMVHHFGSSEDYNKLARDSGDNGWSWSSIKKYIFKHEKIVPPADNSDTDGKFLPQFHGTGGTVSVSLPGNSQSIDAKVIATTDELPEFPFNPDQGHGNGQVLGMGWTQNSIGEGARSSSSTTYLKEALKRPHVDVLINAHVTKLVTTRKKRGRPVFDKVQFASGPGAPVTTVTARREIILSAGAFGTPQILLLSGIGPKTDLDVLGIPTVIHNPSVGQNLSDHVLLPNIFNVRGQDTLDQIIRGDPNVVPGVLDQWTTSRSGPLANGVTNNLGFFRLPANSSIFNSVSDPATGPTASHWEMIVINFYLNPFGPPIPPAGTFMTLISALISPTSRGFVRLASADPFTAPIIDPKFLTTQFDIFALREAVRATKRFVTASVWNDYVISPWGGLAQTSDEGIDAYVRQQSTTVYHPVGTAAISPRGANYGVVDPDLKLKGAEGVRIADASVWPFLPNAHTQGPVYLLAERAADLILGRA,./data/raw/alphafold//AF-A0A2Z5WP81-F1-model_v4.pdb,1050,606,274,299
+1254,7977,8105,MALSQSVPFSATELLLASAIFCLVFWVLKGLRPRVPKGLKSPPEPWGWPLLGHVLTLGKNPHLALSRMSQRYGDVLQIRIGSTPVLVLSRLDTIRQALVRQGDDFKGRPDLYTSTLITDGQSLTFSTDSGPVWAARRRLAQNALNTFSIASDPASSSSCYLEEHVSKEAKALISRLQELMAGPGHFDPYNQVVVSVANVIGAMCFGQHFPESSDEMLSLVKNTHEFVETASSGNPLDFFPILRYLPNPALQRFKAFNQRFLWFLQKTVQEHYQDFDKNSVRDITGALFKHSKKGPRASGNLIPQEKIVNLVNDIFGAGFDTVTTAISWSLMYLVTKPEIQRKIQKELDTVIGRERRPRLSDRPQLPYLEAFILETFRHSSFLPFTIPHSTTRDTTLNGFYIPKKCCVFVNQWQVNHDPELWEDPSEFRPERFLTADGTAINKPLSEKMMLFGMGKRRCIGEVLAKWEIFLFLAILLQQLEFSVPPGVKVDLTPIYGLTMKHARCEHVQARLRFSIN,sabio,P05177,CCOc1ccc2nc3ccc(=O)cc-3oc2c1.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]>>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=c1ccc2nc3ccc(O)cc3oc-2c1,66.60000000000001,0.7903258074794203,37.0,7.4,1.14.14.1,9606.0,1.8234742291703008,CCOc1ccc2nc3ccc(=O)cc-3oc2c1.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],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=c1ccc2nc3ccc(O)cc3oc-2c1,1.8234742291703008,CCOc1ccc2nc3ccc(=O)cc-3oc2c1.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
+1255,8816,8955,MILIDHQTVSGIPFLHIVKEENRDRPAPLVFFVHGFTSAKEHNLHFAYLLAEKGFRAVLPEALYHGERAEQLSAEELAVHFWDIVLNEIEELDVLKKDFEARGLIEDGRIGLAGTSMGGITTFGAMAAYDWVKAGVSLMGSPNYTAFFQQQIDHIQKQDIDIDVTKEQVDELFARLKPFDLSLEPEKLRSRPLLFWHGVQDKVVPYAPTRGFYETIKPHYSSRPDHLQFLKDERADHKVPRYAVLETVAWFDKHL,brenda,A0A1B1WA13,COC(=O)/C=C/c1ccc(O)c(OC)c1.O>>CO.COc1cc(/C=C/C(=O)O)ccc1O,12.0,1.2535597469392408e-14,30.0,8.0,3.1.1.73,1390.0,1.0791812460476249,COC(=O)/C=C/c1ccc(O)c(OC)c1.O,CO.COc1cc(/C=C/C(=O)O)ccc1O,1.0791812460476249,COC(=O)/C=C/c1ccc(O)c(OC)c1.O__MILIDHQTVSGIPFLHIVKEENRDRPAPLVFFVHGFTSAKEHNLHFAYLLAEKGFRAVLPEALYHGERAEQLSAEELAVHFWDIVLNEIEELDVLKKDFEARGLIEDGRIGLAGTSMGGITTFGAMAAYDWVKAGVSLMGSPNYTAFFQQQIDHIQKQDIDIDVTKEQVDELFARLKPFDLSLEPEKLRSRPLLFWHGVQDKVVPYAPTRGFYETIKPHYSSRPDHLQFLKDERADHKVPRYAVLETVAWFDKHL,./data/raw/alphafold//AF-A0A1B1WA13-F1-model_v4.pdb,3357,2223,3912,2786
+1256,14332,14530,MQLTGEMLIGAEAVAGSAGTLRAFDPSKGEPIDAPVFGVAAQADVERACELARDAFDAYRAQPLAARAAFLEAIADEIVALGDALIERAHAETGLPVARLQGERGRTVGQLRLFARVVRDGRFLAASIDPAQPARTPLPRSDLRLQKVGLGPVVVFGASNFPLAFSVAGGDTASALAAGCPVIVKAHEAHLGTSELVGRAIRAAVAKTGMPAGVFSLLVGPGRVIGGALVSHPAVQAVGFTGSRQGGMALVQIANARPQPIPVYAEMSSINPVVLFPAALAARGDAIATGFVDSLTLGVGQFCTNPGLVLAIDGPDLDRFETVAAQALAKKPAGVMLTQGIADAYRNGRGKLAELPGVREIGAGEAAQTDCQAGGALYEVGAQAFLAEPAFSHEVFGPASLIVRCRDLDEVARVLEALEGQLTATLQMDADDKPLARRLLPVLERKAGRLLVNGYPTGVEVCDAMVHGGPFPATSNPAVTSVGATAIERFLRPVCYQDFPDDLLPEGLQESNPLAIPRLRDGKAE,brenda,Q08IC0,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=CCCC(=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.[H+],15.4,6.365223476095231e-15,25.0,8.0,1.2.1.26,192.0,1.187520720836463,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=CCCC(=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.[H+],1.7315887651867388,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=CCCC(=O)C(=O)O__MQLTGEMLIGAEAVAGSAGTLRAFDPSKGEPIDAPVFGVAAQADVERACELARDAFDAYRAQPLAARAAFLEAIADEIVALGDALIERAHAETGLPVARLQGERGRTVGQLRLFARVVRDGRFLAASIDPAQPARTPLPRSDLRLQKVGLGPVVVFGASNFPLAFSVAGGDTASALAAGCPVIVKAHEAHLGTSELVGRAIRAAVAKTGMPAGVFSLLVGPGRVIGGALVSHPAVQAVGFTGSRQGGMALVQIANARPQPIPVYAEMSSINPVVLFPAALAARGDAIATGFVDSLTLGVGQFCTNPGLVLAIDGPDLDRFETVAAQALAKKPAGVMLTQGIADAYRNGRGKLAELPGVREIGAGEAAQTDCQAGGALYEVGAQAFLAEPAFSHEVFGPASLIVRCRDLDEVARVLEALEGQLTATLQMDADDKPLARRLLPVLERKAGRLLVNGYPTGVEVCDAMVHGGPFPATSNPAVTSVGATAIERFLRPVCYQDFPDDLLPEGLQESNPLAIPRLRDGKAE,./data/raw/alphafold//AF-Q08IC0-F1-model_v4.pdb,2371,4745,4794,4634
+1257,5514,5600,MKKRIQFFMVSMMLAPMFNAQVKDFVIEPPIKNNLHIYKTFGVFGGKEYSANSVYLVTKKGVVLFDVPWEKAQYQSLMDTIKKRHNLPVIAVFATHSHDDRAGDLSFFNNKGIKTYATSKTNEFLKKDGKATSTEIIKTGKPYRIGGEEFTVDFLGEGHTADNVVVWFPKYNVLDGGCLVKSNSATDLGYIKEANVEQWPITIDKLKAKYSKATLIIPGHDDWKGGGHVEHTLELLNKK,brenda,Q6JE29,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O>>,10.3,99.72857581013334,30.0,6.5,3.5.2.6,253.0,1.0128372247051722,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O,,1.0128372247051722,CC1(C)S[C@@H]2[C@H](N=C(O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O__MKKRIQFFMVSMMLAPMFNAQVKDFVIEPPIKNNLHIYKTFGVFGGKEYSANSVYLVTKKGVVLFDVPWEKAQYQSLMDTIKKRHNLPVIAVFATHSHDDRAGDLSFFNNKGIKTYATSKTNEFLKKDGKATSTEIIKTGKPYRIGGEEFTVDFLGEGHTADNVVVWFPKYNVLDGGCLVKSNSATDLGYIKEANVEQWPITIDKLKAKYSKATLIIPGHDDWKGGGHVEHTLELLNKK,./data/raw/alphafold//AF-Q6JE29-F1-model_v4.pdb,3125,1903,3540,2363
+1258,23123,23465,MDPCKFRPSSSFDTKTTTTNAGAPVWNDNEALTVGPRGPILLEDYHLIEKVAHFARERIPERVVHARGASAKGFFECTHDVTDITCADFLRSPGAQTPVIVRFSTVIHERGSPETIRDPRGFAVKFYTREGNWDLLGNNFPVFFIRDGIKFPDVIHAFKPNPRSHVQEYWRVFDFLSHHPESLHTFFFLFDDVGIPTDYRHMDGFGVNTYTFVTRDAKARYVKFHWKPTCGVSCLMDDEATLVGGKNHSHATQDLYDSIAAGNFPEWKLFVQVIDPEEEERFDFDPLDDTKTWPEDEVPLRPVGRLVLNRNVDNFFNENEQLAFGPGLVVPGIYYSDDKMLQCRVFAYADTQRYRLGPNYLMLPVNAPKCAHHNNHYDGAMNFMHRDEEVDYYPSRHAPLRHAPPTPITPRPVVGRRQKATIRKQNDFKQPGERYRSWAPDRQERFIRRFAGELAHPKVSPELRAIWVNYLSQCDESLGVKIANRLNVKPSM,brenda,A3REN3,OO>>O,80000.0,30.17028418412567,25.0,7.0,1.11.1.6,4530.0,4.903089986991944,OO,O,4.903089986991944,OO__MDPCKFRPSSSFDTKTTTTNAGAPVWNDNEALTVGPRGPILLEDYHLIEKVAHFARERIPERVVHARGASAKGFFECTHDVTDITCADFLRSPGAQTPVIVRFSTVIHERGSPETIRDPRGFAVKFYTREGNWDLLGNNFPVFFIRDGIKFPDVIHAFKPNPRSHVQEYWRVFDFLSHHPESLHTFFFLFDDVGIPTDYRHMDGFGVNTYTFVTRDAKARYVKFHWKPTCGVSCLMDDEATLVGGKNHSHATQDLYDSIAAGNFPEWKLFVQVIDPEEEERFDFDPLDDTKTWPEDEVPLRPVGRLVLNRNVDNFFNENEQLAFGPGLVVPGIYYSDDKMLQCRVFAYADTQRYRLGPNYLMLPVNAPKCAHHNNHYDGAMNFMHRDEEVDYYPSRHAPLRHAPPTPITPRPVVGRRQKATIRKQNDFKQPGERYRSWAPDRQERFIRRFAGELAHPKVSPELRAIWVNYLSQCDESLGVKIANRLNVKPSM,./data/raw/alphafold//AF-A3REN3-F1-model_v4.pdb,868,354,6126,7069
+1259,10817,10972,MKYNKLSVAVAAFAFAAVSAQNSNVLKYPETKKVSHTDTYFGTQVSDPYRWLEDDRAEDTKAWVQQEVKFTQDYLAQIPFRDQLKKQLMDIWNYEKISAPFKKGKYTYFSKNDGLQAQSVLYRKDAAGKTEVFLDPNKFSEKGTTSLASVSFNKKGTLVAYSISEGGSDWNKIIILDAETKKQLDETLLDVKFSGISWLGDEGFFYSSYDKPKEGSVLSGMTDKHKVYFHKLGTKQSQDELIIGGDKFPRRYIGAYVTDDQRYLVVSAANATNGNELYIKDLKNKTDFIPIITGFDSNVNVADTDGDTLYLFTDKDAPNKRLVKTTIQNPKAETWKDVIAETSEPLEINTGGGYFFATYMKDAIDQVKQYDKNGKLVRAIKLPGSGNASGFGGEKTEKDLYYSFTNYITPPTIFKYNVTTGNSEVYQKPKVKFNPENYVSEQVFYTSSDGTKIPMMISYKKGLKKDGKNPTILYSYGGFNISLQPAFSVVNAIWMENGGIYAVPNIRGGGEYGKKWHDAGTKMQKKNVFNDFIAAGEYLQKNGYTSKEYMALSGRSNGGLLVGATMTMRPDLAKVAFPGVGVLDMLRYNKFTAGAGWAYDYGTAEDSKEMFEYLKSYSPVHNVKAGTCYPSTMVITSDHDDRVVPAHSFKFGSELQAKQSCKNPILIRIETNAGHGAGRSTEQVVAENADLLSFALYEMGIKSLK,uniprot_search,P27028,C[C@H](N=C(O)OCc1ccccc1)C(O)=N[C@@H](C)C(O)=Nc1ccc2ccccc2c1.O>>Nc1ccc2ccccc2c1,5.9,50.59559727343838,37.0,7.0,3.4.21.26,238.0,0.7708520116421442,C[C@H](N=C(O)OCc1ccccc1)C(O)=N[C@@H](C)C(O)=Nc1ccc2ccccc2c1.O,Nc1ccc2ccccc2c1,0.7708520116421442,C[C@H](N=C(O)OCc1ccccc1)C(O)=N[C@@H](C)C(O)=Nc1ccc2ccccc2c1.O__MKYNKLSVAVAAFAFAAVSAQNSNVLKYPETKKVSHTDTYFGTQVSDPYRWLEDDRAEDTKAWVQQEVKFTQDYLAQIPFRDQLKKQLMDIWNYEKISAPFKKGKYTYFSKNDGLQAQSVLYRKDAAGKTEVFLDPNKFSEKGTTSLASVSFNKKGTLVAYSISEGGSDWNKIIILDAETKKQLDETLLDVKFSGISWLGDEGFFYSSYDKPKEGSVLSGMTDKHKVYFHKLGTKQSQDELIIGGDKFPRRYIGAYVTDDQRYLVVSAANATNGNELYIKDLKNKTDFIPIITGFDSNVNVADTDGDTLYLFTDKDAPNKRLVKTTIQNPKAETWKDVIAETSEPLEINTGGGYFFATYMKDAIDQVKQYDKNGKLVRAIKLPGSGNASGFGGEKTEKDLYYSFTNYITPPTIFKYNVTTGNSEVYQKPKVKFNPENYVSEQVFYTSSDGTKIPMMISYKKGLKKDGKNPTILYSYGGFNISLQPAFSVVNAIWMENGGIYAVPNIRGGGEYGKKWHDAGTKMQKKNVFNDFIAAGEYLQKNGYTSKEYMALSGRSNGGLLVGATMTMRPDLAKVAFPGVGVLDMLRYNKFTAGAGWAYDYGTAEDSKEMFEYLKSYSPVHNVKAGTCYPSTMVITSDHDDRVVPAHSFKFGSELQAKQSCKNPILIRIETNAGHGAGRSTEQVVAENADLLSFALYEMGIKSLK,./data/raw/alphafold//AF-P27028-F1-model_v4.pdb,243,1552,3135,1904
+1260,18227,18487,MTAIAPVITIDGPSGAGKGTLCKAMAEALQWHLLDSGAIYRVLALAALHHHVDVASEDALVPLASHLDVRFVSTNGNLEVILEGEDVSGEIRTQEVANAASQVAAFPRVREALLRRQRAFRELPGLIADGRDMGTVVFPDAPVKIFLDASSEERAHRRMLQLQEKGFSVNFERLLAEIKERDDRDRNRAVAPLVPAADALVLDSTTLSIEQVIEKALQYARQKLALA,sabio,P0A6I0,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=c1ccn(C2OC(COP(=O)(O)O)C(O)C2O)c(=O)[nH]1>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,0.82,0.0,30.0,7.4,2.7.4.25,562.0,-0.0861861476162833,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=c1ccn(C2OC(COP(=O)(O)O)C(O)C2O)c(=O)[nH]1,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,-0.0861861476162833,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=c1ccn(C2OC(COP(=O)(O)O)C(O)C2O)c(=O)[nH]1__MTAIAPVITIDGPSGAGKGTLCKAMAEALQWHLLDSGAIYRVLALAALHHHVDVASEDALVPLASHLDVRFVSTNGNLEVILEGEDVSGEIRTQEVANAASQVAAFPRVREALLRRQRAFRELPGLIADGRDMGTVVFPDAPVKIFLDASSEERAHRRMLQLQEKGFSVNFERLLAEIKERDDRDRNRAVAPLVPAADALVLDSTTLSIEQVIEKALQYARQKLALA,./data/raw/alphafold//AF-P0A6I0-F1-model_v4.pdb,2415,4819,4882,4731
+1261,14042,14224,MRILLSNDDGVHAPGIQTLAKALREFADVQVVAPDRNRSGASNSLTLESSLRTFTFENGDIAVQMGTPTDCVYLGVNALMRPRPDIVVSGINAGPNLGDDVIYSGTVAAAMEGRHLGFPALAVSLDGHKHYDTAAAVTCSILRALCKEPLRTGRILNINVPDLPLDQIKGIRVTRCGTRHPADQVIPQQDPRGNTLYWIGPPGGKCDAGPGTDFAAVDEGYVSITPLHVDLTAHSAQDVVSDWLNSVGVGTQW,brenda,B1XCS0,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>>N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O,19.3,3.3292726650769823e-14,30.0,7.5,3.6.1.22,562.0,1.285557309007774,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,N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O,1.285557309007774,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__MRILLSNDDGVHAPGIQTLAKALREFADVQVVAPDRNRSGASNSLTLESSLRTFTFENGDIAVQMGTPTDCVYLGVNALMRPRPDIVVSGINAGPNLGDDVIYSGTVAAAMEGRHLGFPALAVSLDGHKHYDTAAAVTCSILRALCKEPLRTGRILNINVPDLPLDQIKGIRVTRCGTRHPADQVIPQQDPRGNTLYWIGPPGGKCDAGPGTDFAAVDEGYVSITPLHVDLTAHSAQDVVSDWLNSVGVGTQW,./data/raw/alphafold//AF-B1XCS0-F1-model_v4.pdb,2223,4461,4366,4252
+1262,5765,5851,MRSTLLAFALAVALPAAHTSAAEVPLPQLRAYTVDASWLQPMAPLQIADHTWQIGTEDLTALLVQTPDGAVLLDGGMPQMASHLLDNMKARGVTPRDLRLILLSHAHADHAGPVAELKRRTGAKVAANAESAVLLARGGSDDLHFGDGITYPPANADRIVMDGEVITVGGIVFTAHFMAGHTPGSTAWTWTDTRNGKPVRIAYADSLSAPGYQLQGNPRYPHLIEDYRRSFATVRALPCDVLLTPHPGASNWDYAAGARAGAKALTCKAYADAAEQKFDGQLAKETAGAR,sabio,P52700,CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(N)c3ccc(O)cc3)C2SC1.O>>,23.0,99.7385005622238,25.0,7.0,3.5.2.6,40324.0,1.3617278360175928,CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(N)c3ccc(O)cc3)C2SC1.O,,1.3617278360175928,CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(N)c3ccc(O)cc3)C2SC1.O__MRSTLLAFALAVALPAAHTSAAEVPLPQLRAYTVDASWLQPMAPLQIADHTWQIGTEDLTALLVQTPDGAVLLDGGMPQMASHLLDNMKARGVTPRDLRLILLSHAHADHAGPVAELKRRTGAKVAANAESAVLLARGGSDDLHFGDGITYPPANADRIVMDGEVITVGGIVFTAHFMAGHTPGSTAWTWTDTRNGKPVRIAYADSLSAPGYQLQGNPRYPHLIEDYRRSFATVRALPCDVLLTPHPGASNWDYAAGARAGAKALTCKAYADAAEQKFDGQLAKETAGAR,./data/raw/alphafold//AF-P52700-F1-model_v4.pdb,1443,3060,814,1074
+1263,12227,12395,MIVTQIAGKIQVIFGPMFSGKTTELIRRIKRFNFANKKCLLIKYSKDTRYNDNIDKSFLVTHDKQNYQAFPCSILEDVKEQAQNYDVIGIDEGQFFPDVVQFSEDLANQGKTVIIAALDGTFQRKPFQSVIDLVSKAEYITKLTAVCMVCYNEAAFSKRIVESDDIELIGGIDKYISVCRGCYNSDQNEGNSTKPSKTARHSHSQSAPSVAPLAVNINPDDHLNNDY,sabio,Q27564,Cc1cn(C2CC(O)C(CO)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>Cc1cn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,7.5,0.0,22.0,8.0,2.7.1.21,44689.0,0.8750612633917001,Cc1cn(C2CC(O)C(CO)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,Cc1cn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,0.8750612633917001,Cc1cn(C2CC(O)C(CO)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MIVTQIAGKIQVIFGPMFSGKTTELIRRIKRFNFANKKCLLIKYSKDTRYNDNIDKSFLVTHDKQNYQAFPCSILEDVKEQAQNYDVIGIDEGQFFPDVVQFSEDLANQGKTVIIAALDGTFQRKPFQSVIDLVSKAEYITKLTAVCMVCYNEAAFSKRIVESDDIELIGGIDKYISVCRGCYNSDQNEGNSTKPSKTARHSHSQSAPSVAPLAVNINPDDHLNNDY,./data/raw/alphafold//AF-Q27564-F1-model_v4.pdb,2017,4178,4047,3894
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+1272,13904,14085,MRALLLLGFLLVSLESTLSIPPWEAPKEHKYKAEEHTVVLTVTGEPCHFPFQYHRQLYHKCTHKGRPGPQPWCATTPNFDQDQRWGYCLEPKKVKDHCSKHSPCQKGGTCVNMPSGPHCLCPQHLTGNHCQKEKCFEPQLLRFFHKNEIWYRTEQAAVARCQCKGPDAHCQRLASQACRTNPCLHGGRCLEVEGHRLCHCPVGYTGAFCDVDTKASCYDGRGLSYRGLARTTLSGAPCQPWASEATYRNVTAEQARNWGLGGHAFCRNPDNDIRPWCFVLNRDRLSWEYCDLAQCQTPTQAAPPTPVSPRLHVPLMPAQPAPPKPQPTTRTPPQSQTPGALPAKREQPPSLTRNGPLSCGQRLRKSLSSMTRVVGGLVALRGAHPYIAALYWGHSFCAGSLIAPCWVLTAAHCLQDRPAPEDLTVVLGQERRNHSCEPCQTLAVRSYRLHEAFSPVSYQHDLALLRLQEDADGSCALLSPYVQPVCLPSGAARPSETTLCQVAGWGHQFEGAEEYASFLQEAQVPFLSLERCSAPDVHGSSILPGMLCAGFLEGGTDACQGDSGGPLVCEDQAAERRLTLQGIISWGSGCGDRNKPGVYTDVAYYLAWIREHTVS,uniprot_search,P00748,N=C(O)C[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>,18.0,99.8383498755294,37.0,7.4,3.4.21.38,9606.0,1.255272505103306,N=C(O)C[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,,1.3617278360175928,N=C(O)C[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MRALLLLGFLLVSLESTLSIPPWEAPKEHKYKAEEHTVVLTVTGEPCHFPFQYHRQLYHKCTHKGRPGPQPWCATTPNFDQDQRWGYCLEPKKVKDHCSKHSPCQKGGTCVNMPSGPHCLCPQHLTGNHCQKEKCFEPQLLRFFHKNEIWYRTEQAAVARCQCKGPDAHCQRLASQACRTNPCLHGGRCLEVEGHRLCHCPVGYTGAFCDVDTKASCYDGRGLSYRGLARTTLSGAPCQPWASEATYRNVTAEQARNWGLGGHAFCRNPDNDIRPWCFVLNRDRLSWEYCDLAQCQTPTQAAPPTPVSPRLHVPLMPAQPAPPKPQPTTRTPPQSQTPGALPAKREQPPSLTRNGPLSCGQRLRKSLSSMTRVVGGLVALRGAHPYIAALYWGHSFCAGSLIAPCWVLTAAHCLQDRPAPEDLTVVLGQERRNHSCEPCQTLAVRSYRLHEAFSPVSYQHDLALLRLQEDADGSCALLSPYVQPVCLPSGAARPSETTLCQVAGWGHQFEGAEEYASFLQEAQVPFLSLERCSAPDVHGSSILPGMLCAGFLEGGTDACQGDSGGPLVCEDQAAERRLTLQGIISWGSGCGDRNKPGVYTDVAYYLAWIREHTVS,./data/raw/alphafold//AF-P00748-F1-model_v4.pdb,1597,1184,1658,1386
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+1274,12484,12654,MTMSVADAHALIKTIPDFPTKGIAFKDLSDILSTPAALDAVRKEVTAHYKDVPITKVVGIESRGFILGGIVANSLGVGFVALRKAGKLPGDVCKCTFDMEYQKGVTIEVQKRQLGPHDVVLLHDDVLATGGTLLAAIELCETAGVKPENIYINVLYEIEALKGREKVGQKCTRLFSVIRE,brenda,Q967M2,Cc1ncnc2[nH]cnc12.O=P(O)(O)OC[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1O>>Cc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,2.8,0.0,45.0,8.0,2.4.2.7,5741.0,0.4471580313422192,Cc1ncnc2[nH]cnc12.O=P(O)(O)OC[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1O,Cc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.4471580313422192,Cc1ncnc2[nH]cnc12.O=P(O)(O)OC[C@H]1O[C@H](OP(=O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1O__MTMSVADAHALIKTIPDFPTKGIAFKDLSDILSTPAALDAVRKEVTAHYKDVPITKVVGIESRGFILGGIVANSLGVGFVALRKAGKLPGDVCKCTFDMEYQKGVTIEVQKRQLGPHDVVLLHDDVLATGGTLLAAIELCETAGVKPENIYINVLYEIEALKGREKVGQKCTRLFSVIRE,./data/raw/alphafold//AF-Q967M2-F1-model_v4.pdb,2118,4311,4197,4054
+1275,12869,13041,MKPISIIGVPMDLGQTRRGVDMGPSAIRYAGVIERLERLHYDIEDLGDIPIGKVERLHEQGASQLRNLKAVAEANEKLATAVDEVVKRGRFPLVLGGDHSIAIGTLAGVAKHYERLGVIWYDAHGDVNTEETSPSGNIHGMPLAASLGFGHPALTGIGGYSPKVKPEHVVLIGVRSLDDGEKKFIREKGIKIYTMHEVDRLGMTKVMEETIAYLKERTDGVHLSLDLDGLDPSDAPGVGTPVIGGLTYRESHLAMEMLAEAQIITSAEFVEVNPILDERNKTASVAVALMGSLFGEKLV,brenda,A4IJM8,N=C(N)NCCC[C@H](N)C(=O)O.O>>N=C(N)O.NCCC[C@H](N)C(=O)O,657.0,7.373873211879476e-15,80.0,9.0,3.5.3.1,33940.0,2.8175653695597807,N=C(N)NCCC[C@H](N)C(=O)O.O,N=C(N)O.NCCC[C@H](N)C(=O)O,2.8175653695597807,N=C(N)NCCC[C@H](N)C(=O)O.O__MKPISIIGVPMDLGQTRRGVDMGPSAIRYAGVIERLERLHYDIEDLGDIPIGKVERLHEQGASQLRNLKAVAEANEKLATAVDEVVKRGRFPLVLGGDHSIAIGTLAGVAKHYERLGVIWYDAHGDVNTEETSPSGNIHGMPLAASLGFGHPALTGIGGYSPKVKPEHVVLIGVRSLDDGEKKFIREKGIKIYTMHEVDRLGMTKVMEETIAYLKERTDGVHLSLDLDGLDPSDAPGVGTPVIGGLTYRESHLAMEMLAEAQIITSAEFVEVNPILDERNKTASVAVALMGSLFGEKLV,./data/raw/alphafold//AF-A4IJM8-F1-model_v4.pdb,2201,4427,4328,4210
+1276,6701,6815,MLLAQRRLISLGCRSKPIKTIYSSSKVLGLCTSAKMALKFKNAKRIEGLDSNVWVEFTKLAADPSVVNLGQGFPDISPPSYVKEELSKAAFIDNMNQYTRGFGHPALVKALSCLYGKIYQRQIDPNEEILVAVGAYGSLFNSIQGLVDPGDEVIIMVPFYDCYEPMVRMAGAVPVFIPLRSKPTDGMKWTSSDWTFDPRELESKFSSKTKAIILNTPHNPLGKVYTRQELQVIADLCVKHDTLCISDEVYEWLVYTGHTHVKIATLPGMWERTITIGSAGKTFSVTGWKLGWSIGPAHLIKHLQTVQQNSFYTCATPLQAALAEAFWIDIKRMDDPECYFNSLPKELEVKRDRMVRLLNSVGLKPIVPDGGYFIIADVSSLGADLSDMNSDEPYDYKFVKWMTKHKKLTAIPVSAFCDSKSKPHFEKLVRFCFIKKDSTLDAAEEIFRAWNSQKS,brenda,Q71RI9,CCCCC(=O)C(=O)O.Nc1ccccc1C(=O)C[C@H](N)C(=O)O>>CCCCC(N)C(=O)[O-].O=C(O)c1cc(=O)c2ccccc2[nH]1,2.59,2.8879742886334725,45.0,9.0,2.6.1.7,10090.0,0.4132997640812518,CCCCC(=O)C(=O)O.Nc1ccccc1C(=O)C[C@H](N)C(=O)O,CCCCC(N)C(=O)[O-].O=C(O)c1cc(=O)c2ccccc2[nH]1,0.4132997640812518,CCCCC(=O)C(=O)O.Nc1ccccc1C(=O)C[C@H](N)C(=O)O__MLLAQRRLISLGCRSKPIKTIYSSSKVLGLCTSAKMALKFKNAKRIEGLDSNVWVEFTKLAADPSVVNLGQGFPDISPPSYVKEELSKAAFIDNMNQYTRGFGHPALVKALSCLYGKIYQRQIDPNEEILVAVGAYGSLFNSIQGLVDPGDEVIIMVPFYDCYEPMVRMAGAVPVFIPLRSKPTDGMKWTSSDWTFDPRELESKFSSKTKAIILNTPHNPLGKVYTRQELQVIADLCVKHDTLCISDEVYEWLVYTGHTHVKIATLPGMWERTITIGSAGKTFSVTGWKLGWSIGPAHLIKHLQTVQQNSFYTCATPLQAALAEAFWIDIKRMDDPECYFNSLPKELEVKRDRMVRLLNSVGLKPIVPDGGYFIIADVSSLGADLSDMNSDEPYDYKFVKWMTKHKKLTAIPVSAFCDSKSKPHFEKLVRFCFIKKDSTLDAAEEIFRAWNSQKS,./data/raw/alphafold//AF-Q71RI9-F1-model_v4.pdb,1303,3859,6175,827
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+1296,10691,10846,MVVINSLRRLARTTQVHLHSKYATCMSGNSTSRRIFTTEAAPEKKNTVGSKGHDMLAPFTAGWQSADLDPLVIAKSEGSYVYDDTGKKYLDSLAGLWCTALGGNEPRLVSAAVEQLNTLPFYHSFWNRTTKPSLDLAKVLLEMFTANKMAKAFFTSGGSDANDTQVKLVWYYNNALGRPEKKKFIARKKSYHGSTLISASLSGLPPLHQNFDLPAPFVLHTDCPHYWRFHLPGETEEEFSTRLAKNLEDLIIKEGPETIGAFIAEPVMGAGGVIPPPATYFEKVQAVVKKYDILFIADEVICAFGRLGTMFGCDKYNIKPDLVTLAKALSSAYMPIGAILMSQEVADVINSHSSKLGVFSHGFTYSGHPVSCAVAIEALKIYKERNIPEYVAKVAPRFQDGVKAFASGSPIIGETRGTGLILGTEFVDNKSPNEPFPPEWGVGAFFGAECQKHGMLVRVAGDGILMSPPLIISPEEIDELISIYGKALKATEEKVKELKAQHKK,brenda,Q94CE5,C[C@H](N)C(=O)O.O=CC(=O)O>>,14.1,99.39072315069244,30.0,9.0,2.6.1.96,3702.0,1.14921911265538,C[C@H](N)C(=O)O.O=CC(=O)O,,1.187520720836463,C[C@H](N)C(=O)O.O=CC(=O)O__MVVINSLRRLARTTQVHLHSKYATCMSGNSTSRRIFTTEAAPEKKNTVGSKGHDMLAPFTAGWQSADLDPLVIAKSEGSYVYDDTGKKYLDSLAGLWCTALGGNEPRLVSAAVEQLNTLPFYHSFWNRTTKPSLDLAKVLLEMFTANKMAKAFFTSGGSDANDTQVKLVWYYNNALGRPEKKKFIARKKSYHGSTLISASLSGLPPLHQNFDLPAPFVLHTDCPHYWRFHLPGETEEEFSTRLAKNLEDLIIKEGPETIGAFIAEPVMGAGGVIPPPATYFEKVQAVVKKYDILFIADEVICAFGRLGTMFGCDKYNIKPDLVTLAKALSSAYMPIGAILMSQEVADVINSHSSKLGVFSHGFTYSGHPVSCAVAIEALKIYKERNIPEYVAKVAPRFQDGVKAFASGSPIIGETRGTGLILGTEFVDNKSPNEPFPPEWGVGAFFGAECQKHGMLVRVAGDGILMSPPLIISPEEIDELISIYGKALKATEEKVKELKAQHKK,./data/raw/alphafold//AF-Q94CE5-F1-model_v4.pdb,1266,3835,6151,802
+1297,15673,15900,MSKGEKMKIKVGVLGATGSVGQRFVQLLADHPMFELTALAASERSAGKKYKDACYWFQDRDIPENIKDMVVIPTDPKHEEFEDVDIVFSALPSDLAKKFEPEFAKEGKLIFSNASAYRMEEDVPLVIPEVNADHLELIEIQREKRGWDGAIITNPNCSTICAVITLKPIMDKFGLEAVFIATMQAVSGAGYNGVPSMAILDNLIPFIKNEEEKMQTESLKLLGTLKDGKVELANFKISASCNRVAVIDGHTESIFVKTKEGAEPEEIKEVMDKFDPLKDLNLPTYAKPIVIREEIDRPQPRLDRNEGNGMSIVVGRIRKDPIFDVKYTALEHNTIRGAAGASVLNAEYFVKKYI,sabio,Q57658,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=O)C(C(=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.O=P(O)(O)O,0.04,12.481985138178368,37.0,7.0,1.2.1.11,2190.0,-1.3979400086720375,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=O)C(C(=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.O=P(O)(O)O,-1.3979400086720375,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]__MSKGEKMKIKVGVLGATGSVGQRFVQLLADHPMFELTALAASERSAGKKYKDACYWFQDRDIPENIKDMVVIPTDPKHEEFEDVDIVFSALPSDLAKKFEPEFAKEGKLIFSNASAYRMEEDVPLVIPEVNADHLELIEIQREKRGWDGAIITNPNCSTICAVITLKPIMDKFGLEAVFIATMQAVSGAGYNGVPSMAILDNLIPFIKNEEEKMQTESLKLLGTLKDGKVELANFKISASCNRVAVIDGHTESIFVKTKEGAEPEEIKEVMDKFDPLKDLNLPTYAKPIVIREEIDRPQPRLDRNEGNGMSIVVGRIRKDPIFDVKYTALEHNTIRGAAGASVLNAEYFVKKYI,./data/raw/alphafold//AF-Q57658-F1-model_v4.pdb,2552,5003,2092,4954
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+1315,22078,22411,MKHLLTLALCFSSINAVAVTVPHKAVGTGIPEGSLQFLSLRASAPIGSAISRNNWAVTCDSAQSGNECNKAIDGNKDTFWHTFYGANGDPKPPHTYTIDMKTTQNVNGLSMLPRQDGNQNGWIGRHEVYLSSDGTNWGSPVASGSWFADSTTKYSNFETRPARYVRLVAITEANGQPWTSIAEINVFQASSYTAPQPGLGRWGPTIDLPIVPAAAAIEPTSGRVLMWSSYRNDAFGGSPGGITLTSSWDPSTGIVSDRTVTVTKHDMFCPGISMDGNGQIVVTGGNDAKKTSLYDSSSDSWIPGPDMQVARGYQSSATMSDGRVFTIGGSWSGGVFEKNGEVYSPSSKTWTSLPNAKVNPMLTADKQGLYRSDNHAWLFGWKKGSVFQAGPSTAMNWYYTSGSGDVKSAGKRQSNRGVAPDAMCGNAVMYDAVKGKILTFGGSPDYQDSDATTNAHIITLGEPGTSPNTVFASNGLYFARTFHTSVVLPDGSTFITGGQRRGIPFEDSTPVFTPEIYVPEQDTFYKQNPNSIVRVYHSISLLLPDGRVFNGGGGLCGDCTTNHFDAQIFTPNYLYNSNGNLATRPKITRTSTQSVKVGGRITISTDSSISKASLIRYGTATHTVNTDQRRIPLTLTNNGGNSYSFQVPSDSGVALPGYWMLFVMNSAGVPSVASTIRVTQ,sabio,P0CS93,O=O.OCC1OC(O)C(O)C(O)C1O>>O=CC1OC(O)C(O)C(O)C1O.OO,503.0,0.0,25.0,7.0,1.1.3.9,5518.0,2.701567985055928,O=O.OCC1OC(O)C(O)C(O)C1O,O=CC1OC(O)C(O)C(O)C1O.OO,3.4756711883244296,O=O.OCC1OC(O)C(O)C(O)C1O__MKHLLTLALCFSSINAVAVTVPHKAVGTGIPEGSLQFLSLRASAPIGSAISRNNWAVTCDSAQSGNECNKAIDGNKDTFWHTFYGANGDPKPPHTYTIDMKTTQNVNGLSMLPRQDGNQNGWIGRHEVYLSSDGTNWGSPVASGSWFADSTTKYSNFETRPARYVRLVAITEANGQPWTSIAEINVFQASSYTAPQPGLGRWGPTIDLPIVPAAAAIEPTSGRVLMWSSYRNDAFGGSPGGITLTSSWDPSTGIVSDRTVTVTKHDMFCPGISMDGNGQIVVTGGNDAKKTSLYDSSSDSWIPGPDMQVARGYQSSATMSDGRVFTIGGSWSGGVFEKNGEVYSPSSKTWTSLPNAKVNPMLTADKQGLYRSDNHAWLFGWKKGSVFQAGPSTAMNWYYTSGSGDVKSAGKRQSNRGVAPDAMCGNAVMYDAVKGKILTFGGSPDYQDSDATTNAHIITLGEPGTSPNTVFASNGLYFARTFHTSVVLPDGSTFITGGQRRGIPFEDSTPVFTPEIYVPEQDTFYKQNPNSIVRVYHSISLLLPDGRVFNGGGGLCGDCTTNHFDAQIFTPNYLYNSNGNLATRPKITRTSTQSVKVGGRITISTDSSISKASLIRYGTATHTVNTDQRRIPLTLTNNGGNSYSFQVPSDSGVALPGYWMLFVMNSAGVPSVASTIRVTQ,./data/raw/alphafold//AF-P0CS93-F1-model_v4.pdb,3562,3520,380,431
+1316,6504,6617,MIQIENQAVSGIPFLHIVKEENRHRAVPLVIFIHGFTSAKEHNLHIAYLLAEKGFRAVLPEALHHGERGEEMAVEELAGHFWDIVLNEIEEIGVLKNHFEKEGLVDGGRIGLAGTSMGGITTLGALTAYDWIKAGVSLMGSPNYVELFQQQIDHIQSQGIDIDVPEEKVQQLMKRLELRDLSLQPEKLQQRPLLFWHGAKDKVVPYAPTRKFYDTIKSHYSEQPERLQFIGDENADHKVPRAAVLKTIEWFETYL,brenda,A0A1B2BII0,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,1044.0,0.0,35.0,8.5,3.1.1.1,1502483.0,3.018700498666244,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,3.018700498666244,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MIQIENQAVSGIPFLHIVKEENRHRAVPLVIFIHGFTSAKEHNLHIAYLLAEKGFRAVLPEALHHGERGEEMAVEELAGHFWDIVLNEIEEIGVLKNHFEKEGLVDGGRIGLAGTSMGGITTLGALTAYDWIKAGVSLMGSPNYVELFQQQIDHIQSQGIDIDVPEEKVQQLMKRLELRDLSLQPEKLQQRPLLFWHGAKDKVVPYAPTRKFYDTIKSHYSEQPERLQFIGDENADHKVPRAAVLKTIEWFETYL,./data/raw/alphafold//AF-A0A1B2BII0-F1-model_v4.pdb,3357,2223,3716,2570
+1317,10720,10875,MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFVGKNDGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEESAGKATITLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,sabio,Q83U23,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,889.0,1.0496042775783007e-14,37.0,7.5,3.4.13.-,44688.0,2.9489017609702137,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,2.9489017609702137,C[C@H](N)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=O)O.O__MTTIDFKAEVEKRKDALMEDLFSLLRIDSAMDMEHADAENPFGPGPRKALDAFLKIAERDGYTTKNYDNYVGHFEYENGASDDAEVLGIIGHLDVVPAGSGWDSNPFEPEIRNGNLYARGASDDKGPTVACYYALKILKELNLPLSKKIRFIVGTNEETGWADMDYYFEHCELPLPDFGFSPDAEFPIINGEKGNITEYLHFVGKNDGEVVLHSFKAGLAENMVPESATAVISGAKDLQAALEKFVAEHASKNLRFDLEESAGKATITLYGKSAHGAMPEKGVNGATYLTLFLNQFNFADGAAAFIKVGAEKLLEDHEGEKLGTAYVDELMGNTSMNAGVWSFDENSEGKIALNFRFPQGNSPERMQEILAKLDGVVEVELSKHLHVPHYVPMSDPLVSTLIDVYEKHTGLKGYETIIGGGTFGRLLERGVAYGAMFEGEPDSMHQANEMKPVENIYKAAVIYAEAIYELTK,./data/raw/alphafold//AF-Q83U23-F1-model_v4.pdb,1801,1476,3046,1796
+1318,6671,6785,MANAITFFKLNTGAKFPSVGLGTWQASPGLVGDAVAAAVKIGYRHIDCAQIYGNEKEIGAVLKKLFEDRVVKREDLFITSKLWCTDHDPQDVPEALNRTLKDLQLEYVDLYLIHWPARIKKGSVGIKPENLLPVDIPSTWKAMEALYDSGKARAIGVSNFSTKKLADLLELARVPPAVNQVECHPSWRQTKLQEFCKSKGVHLSAYSPLGSPGTTWLKSDVLKNPILNMVAEKLGKSPAQVALRWGLQMGHSVLPKSTNEGRIKENFNVFDWSIPDYMFAKFAEIEQARLVTGSFLVHETLSPYKSIEELWDGEI,sabio,Q0PGJ6,CCCC=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]>>CCCCO.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,21.0,0.0,,7.0,1.1.1.-,3702.0,1.3222192947339193,CCCC=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],CCCCO.NC(=O)c1ccc[n+](C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)c1,1.3222192947339193,CCCC=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
+1319,17510,17747,MLLAQRRLISLGCRSKPIKTIYSSSKVLGLCTSAKMALKFKNAKRIEGLDSNVWVEFTKLAADPSVVNLGQGFPDISPPSYVKEELSKAAFIDNMNQYTRGFGHPALVKALSCLYGKIYQRQIDPNEEILVAVGAYGSLFNSIQGLVDPGDEVIIMVPFYDCYEPMVRMAGAVPVFIPLRSKPTDGMKWTSSDWTFDPRELESKFSSKTKAIILNTPHNPLGKVYTRQELQVIADLCVKHDTLCISDEVYEWLVYTGHTHVKIATLPGMWERTITIGSAGKTFSVTGWKLGWSIGPAHLIKHLQTVQQNSFYTCATPLQAALAEAFWIDIKRMDDPECYFNSLPKELEVKRDRMVRLLNSVGLKPIVPDGGYFIIADVSSLGADLSDMNSDEPYDYKFVKWMTKHKKLTAIPVSAFCDSKSKPHFEKLVRFCFIKKDSTLDAAEEIFRAWNSQKS,brenda,Q71RI9,N[C@@H](Cc1ccc(O)cc1)C(=O)O.O=C(O)CCC(=O)C(=O)O>>N[C@@H](CCC(=O)O)C(=O)O.O=C(O)C(=O)Cc1ccc(O)cc1,1.03,0.0,45.0,9.0,2.6.1.7,10090.0,0.0128372247051722,N[C@@H](Cc1ccc(O)cc1)C(=O)O.O=C(O)CCC(=O)C(=O)O,N[C@@H](CCC(=O)O)C(=O)O.O=C(O)C(=O)Cc1ccc(O)cc1,0.0128372247051722,N[C@@H](Cc1ccc(O)cc1)C(=O)O.O=C(O)CCC(=O)C(=O)O__MLLAQRRLISLGCRSKPIKTIYSSSKVLGLCTSAKMALKFKNAKRIEGLDSNVWVEFTKLAADPSVVNLGQGFPDISPPSYVKEELSKAAFIDNMNQYTRGFGHPALVKALSCLYGKIYQRQIDPNEEILVAVGAYGSLFNSIQGLVDPGDEVIIMVPFYDCYEPMVRMAGAVPVFIPLRSKPTDGMKWTSSDWTFDPRELESKFSSKTKAIILNTPHNPLGKVYTRQELQVIADLCVKHDTLCISDEVYEWLVYTGHTHVKIATLPGMWERTITIGSAGKTFSVTGWKLGWSIGPAHLIKHLQTVQQNSFYTCATPLQAALAEAFWIDIKRMDDPECYFNSLPKELEVKRDRMVRLLNSVGLKPIVPDGGYFIIADVSSLGADLSDMNSDEPYDYKFVKWMTKHKKLTAIPVSAFCDSKSKPHFEKLVRFCFIKKDSTLDAAEEIFRAWNSQKS,./data/raw/alphafold//AF-Q71RI9-F1-model_v4.pdb,1303,3859,6175,827
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+1323,5891,5984,MAWRQLKKRAQDAMVILGGGGLLFASYLTATGDEHFYAELLMPSLQRLLDPETAHRLAVRFTSLGLLPRTTFQDSDMLEVRVLGHKFRNPVGIAAGFDKHGEAVDGLYKMGFGFVEIGSVTPEPQEGNPRPRVFRLPEDQAIINRYGFNSHGLSVVEHRLRARQQTQARLTEDGLPLGINLGKNKTSVDAASDYAEGVRVLGPLADYLVVNVSSPNTAGLRSLQGKAELRRLLTKVLQERDALKVAHKPAVLVKIAPDLTAQDKEDIASVVRELGIDGLIVTNSTVSRPASLQGALRSEPGGLSGKPLRDLSTQTIREMYALTQGRVPIVGVGGVSSGQDALEKIRAGASLVQLYTALTYRGPPVVGGVKRELEALLKEQGFARVTDAIGADHRR,sabio,Q5E9W3,CC1=CC(=O)c2ccccc2C1=O.O=C1CC(C(=O)O)NC(=O)N1>>Cc1cc(O)c2ccccc2c1O.O=C(O)c1cc(=O)[nH]c(=O)[nH]1,18.3,8.591914482159403e-15,37.0,7.8,1.3.5.2,9913.0,1.2624510897304295,CC1=CC(=O)c2ccccc2C1=O.O=C1CC(C(=O)O)NC(=O)N1,Cc1cc(O)c2ccccc2c1O.O=C(O)c1cc(=O)[nH]c(=O)[nH]1,1.2624510897304295,CC1=CC(=O)c2ccccc2C1=O.O=C1CC(C(=O)O)NC(=O)N1__MAWRQLKKRAQDAMVILGGGGLLFASYLTATGDEHFYAELLMPSLQRLLDPETAHRLAVRFTSLGLLPRTTFQDSDMLEVRVLGHKFRNPVGIAAGFDKHGEAVDGLYKMGFGFVEIGSVTPEPQEGNPRPRVFRLPEDQAIINRYGFNSHGLSVVEHRLRARQQTQARLTEDGLPLGINLGKNKTSVDAASDYAEGVRVLGPLADYLVVNVSSPNTAGLRSLQGKAELRRLLTKVLQERDALKVAHKPAVLVKIAPDLTAQDKEDIASVVRELGIDGLIVTNSTVSRPASLQGALRSEPGGLSGKPLRDLSTQTIREMYALTQGRVPIVGVGGVSSGQDALEKIRAGASLVQLYTALTYRGPPVVGGVKRELEALLKEQGFARVTDAIGADHRR,./data/raw/alphafold//AF-Q5E9W3-F1-model_v4.pdb,3175,2140,3815,2449
+1324,3659,3709,MKPLSWSEAFGKGAGRIQASTIRELLKLTQRPGILSFAGGLPAPELFPKEEAAEAAARILREKGEVALQYSPTEGYAPLRAFVAEWIGVRPEEVLITTGSQQALDLVGKVFLDEGSPVLLEAPSYMGAIQAFRLQGPRFLTVPAGEEGPDLDALEEVLKRERPRFLYLIPSFQNPTGGLTPLPARKRLLQMVMERGLVVVEDDAYRELYFGEARLPSLFELAREAGYPGVIYLGSFSKVLSPGLRVAFAVAHPEALQKLVQAKQGADLHTPMLNQMLVHELLKEGFSERLERVRRVYREKAQAMLHALDREVPKEVRYTRPKGGMFVWMELPKGLSAEGLFRRALEENVAFVPGGPFFANGGGENTLRLSYATLDREGIAEGVRRLGRALKGLLALV,sabio,Q72LL6,CC(C)CC(N)C(=O)O.O=C(O)CCC(=O)C(=O)O>>CC(C)CC(=O)C(=O)O.NC(CCC(=O)O)C(=O)O,5.1,0.0,45.0,,2.6.1.39,274.0,0.7075701760979364,CC(C)CC(N)C(=O)O.O=C(O)CCC(=O)C(=O)O,CC(C)CC(=O)C(=O)O.NC(CCC(=O)O)C(=O)O,0.7075701760979364,CC(C)CC(N)C(=O)O.O=C(O)CCC(=O)C(=O)O__MKPLSWSEAFGKGAGRIQASTIRELLKLTQRPGILSFAGGLPAPELFPKEEAAEAAARILREKGEVALQYSPTEGYAPLRAFVAEWIGVRPEEVLITTGSQQALDLVGKVFLDEGSPVLLEAPSYMGAIQAFRLQGPRFLTVPAGEEGPDLDALEEVLKRERPRFLYLIPSFQNPTGGLTPLPARKRLLQMVMERGLVVVEDDAYRELYFGEARLPSLFELAREAGYPGVIYLGSFSKVLSPGLRVAFAVAHPEALQKLVQAKQGADLHTPMLNQMLVHELLKEGFSERLERVRRVYREKAQAMLHALDREVPKEVRYTRPKGGMFVWMELPKGLSAEGLFRRALEENVAFVPGGPFFANGGGENTLRLSYATLDREGIAEGVRRLGRALKGLLALV,./data/raw/alphafold//AF-Q72LL6-F1-model_v4.pdb,1805,1482,3052,1802
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+1336,3372,3420,MSVISIVPLASKSCLYKSLMSSTHELKALCRPIVTLGMCRRGKSVMASMSTGLTTAVSDDGVQRRIGDHHSNLWDDNFIQSLSSPYRASSYGETTNKLIGEVKEIFNSLSMADGGLMSPVDDLLQHLSMVDNVERLGIDRHFQTEIKVSLDYVYSYWSEKGIGSGRDIVCTDLNTTALGFRILRLHGYTVFPDVFEHLKDQMGRIACSANHTERQISSILNLFRASLIAFPGEKVMEEAEIFSATYLKEALQTIPVSSLSQEIQYVLQYRWHSNLPRLEARTYIDILQENTKNQMLDVNTEKVLELAKLEFNIFHSLQQNELKSVSRWWKDSGFPDLNFIRHRHVEFYTLVSGIDMEPKHSTFRLSFVKMCHLITVLDDMYDTFGTIDELRLFTAAVKRWDPSTTQCLPEYMKGVYIVLYETVNEMAKEAQKSQGRDTLNYVRQALEAYIGAYHKEAEWISTGYLPTFDEYFENGKASSGHRIATLQPTFMLDIPFPHHILQEIDFPSKFNDFACSILRLRGDTRCYQADMARGEEASCISCYMKDNPGSTQEDALNHINNMIEETIKKLNRELLKPDNNVPISSKKHAFDISRGLHHFYNYRDGYTVASNETKNLVIKTVLEPVPM,sabio,F1CKI8,CC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)O>>CC1=CCC2C(C1)C2(C)C.O=P(O)(O)OP(=O)(O)O,0.06,0.0,30.0,7.2,4.2.3.107,3332.0,-1.2218487496163564,CC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)O,CC1=CCC2C(C1)C2(C)C.O=P(O)(O)OP(=O)(O)O,-1.2218487496163564,CC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)O__MSVISIVPLASKSCLYKSLMSSTHELKALCRPIVTLGMCRRGKSVMASMSTGLTTAVSDDGVQRRIGDHHSNLWDDNFIQSLSSPYRASSYGETTNKLIGEVKEIFNSLSMADGGLMSPVDDLLQHLSMVDNVERLGIDRHFQTEIKVSLDYVYSYWSEKGIGSGRDIVCTDLNTTALGFRILRLHGYTVFPDVFEHLKDQMGRIACSANHTERQISSILNLFRASLIAFPGEKVMEEAEIFSATYLKEALQTIPVSSLSQEIQYVLQYRWHSNLPRLEARTYIDILQENTKNQMLDVNTEKVLELAKLEFNIFHSLQQNELKSVSRWWKDSGFPDLNFIRHRHVEFYTLVSGIDMEPKHSTFRLSFVKMCHLITVLDDMYDTFGTIDELRLFTAAVKRWDPSTTQCLPEYMKGVYIVLYETVNEMAKEAQKSQGRDTLNYVRQALEAYIGAYHKEAEWISTGYLPTFDEYFENGKASSGHRIATLQPTFMLDIPFPHHILQEIDFPSKFNDFACSILRLRGDTRCYQADMARGEEASCISCYMKDNPGSTQEDALNHINNMIEETIKKLNRELLKPDNNVPISSKKHAFDISRGLHHFYNYRDGYTVASNETKNLVIKTVLEPVPM,./data/raw/alphafold//AF-F1CKI8-F1-model_v4.pdb,1755,1413,2457,1710
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+1340,3361,3409,MAKSPETEHPVKALGWAATDNSGTFSPFNFSRRATGERDVQFRVLYCGVCHSDLHMVKNEWGVTHYPIVPGHEIVGIVTEVGSKVEKVKIGDKVGVGVLVGSCRQCDQCSNDLENYCYKQILTYGAPYLDGTIARGGYSDIMVADEHFIIRWPENFPLDAGAPLLCAGITTYSPLKYFGLDKPGLRVGVNGLGGLGHVAVKFAKAFGTKVTVISTSLSKKEEAMQHLGVDEFVVSTDPQQMQAAVGTLDGIIDTVSAPHPIVPLLSLLKPHGKLIVVGLPDKPLQLPVFPLIQGRRTIAGSGIGGLKETQEMIDFAAKNNIVADVEVIPIDYINTAMDRLLKSDVKYRFVIDVEKSLKPQ,sabio,Q2KNL6,CC(C)=CCCC(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)=CCCC(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],1.0,6.321765501607927e-15,25.0,9.5,1.1.1.183,39350.0,0.0,CC(C)=CCCC(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)=CCCC(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],0.1760912590556812,CC(C)=CCCC(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__MAKSPETEHPVKALGWAATDNSGTFSPFNFSRRATGERDVQFRVLYCGVCHSDLHMVKNEWGVTHYPIVPGHEIVGIVTEVGSKVEKVKIGDKVGVGVLVGSCRQCDQCSNDLENYCYKQILTYGAPYLDGTIARGGYSDIMVADEHFIIRWPENFPLDAGAPLLCAGITTYSPLKYFGLDKPGLRVGVNGLGGLGHVAVKFAKAFGTKVTVISTSLSKKEEAMQHLGVDEFVVSTDPQQMQAAVGTLDGIIDTVSAPHPIVPLLSLLKPHGKLIVVGLPDKPLQLPVFPLIQGRRTIAGSGIGGLKETQEMIDFAAKNNIVADVEVIPIDYINTAMDRLLKSDVKYRFVIDVEKSLKPQ,./data/raw/alphafold//AF-Q2KNL6-F1-model_v4.pdb,3542,3496,2479,1736
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+1342,15559,15783,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=Cc1ccccn1.[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.OCc1ccccn1,3600.0,6.655787325118465e-15,25.0,7.0,1.1.1.2,9606.0,3.556302500767288,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=Cc1ccccn1.[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.OCc1ccccn1,3.556302500767288,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=Cc1ccccn1.[H]__MLSAASRVVSRAAVHCALRSPPPEARALAMSRPPPPRVASVLGTMEMGRRMDAPASAAAVRAFLERGHTELDTAFMYSDGQSETILGGLGLGLGGGDCRVKIATKANPWDGKSLKPDSVRSQLETSLKRLQCPQVDLFYLHAPDHGTPVEETLHACQRLHQEGKFVELGLSNYASWEVAEICTLCKSNGWILPTVYQGMYNATTRQVETELFPCLRHFGLRFYAYNPLAGGLLTGKYKYEDKDGKQPVGRFFGNSWAETYRNRFWKEHHFEAIALVEKALQAAYGASAPSVTSAALRWMYHHSQLQGAHGDAVILGMSSLEQLEQNLAATEEGPLEPAVVDAFNQAWHLVAHECPNYFR,./data/raw/alphafold//AF-O43488-F1-model_v4.pdb,3137,1923,3565,2394
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+1351,560,579,MIILKLGGSVITRKDSEEPAIDRDNLERIASEIGNASPSSLMIVHGAGSFGHPFAGEYRIGSEIENEEDLRRRRFGFALTQNWVKKLNSHVCDALLAEGIPAVSMQPSAFIRAHAGRISHADISLIRSYLEEGMVPVVYGDVVLDSDRRLKFSVISGDQLINHFSLRLMPERVILGTDVDGVYTRNPKKHPDARLLDVIGSLDDLESLDGTLNTDVTGGMVGKIRELLLLAEKGVESEIINAAVPGNIERALLGEEVRGTRITGKH,brenda,O26153,C=C(C)CCSP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>C=C(C)CCSP(=O)(O)OP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,8.22,0.0,37.0,7.5,2.7.4.26,145262.0,0.9148718175400504,C=C(C)CCSP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,C=C(C)CCSP(=O)(O)OP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.9148718175400504,C=C(C)CCSP(=O)(O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MIILKLGGSVITRKDSEEPAIDRDNLERIASEIGNASPSSLMIVHGAGSFGHPFAGEYRIGSEIENEEDLRRRRFGFALTQNWVKKLNSHVCDALLAEGIPAVSMQPSAFIRAHAGRISHADISLIRSYLEEGMVPVVYGDVVLDSDRRLKFSVISGDQLINHFSLRLMPERVILGTDVDGVYTRNPKKHPDARLLDVIGSLDDLESLDGTLNTDVTGGMVGKIRELLLLAEKGVESEIINAAVPGNIERALLGEEVRGTRITGKH,./data/raw/alphafold//AF-O26153-F1-model_v4.pdb,1089,659,341,385
+1352,19892,20178,MTAVVNEFLKRGVRALAARQDSVLVMGNEGGDMDTVIGSIFLAMYLEKRDVFGVGSYVPVLNFEKDDLPLRQDVVKLLSRHNVSTDSIYSVKQSGNGVDFLDLHQMKLPIVLYDHNKLSPEQVYLGERIVGVVDHHEDEQLYVDQTKCLRRICKTGSACTLVAELFNEAGLEVPCPELLLAPIVVDTVNFEPSQKRVTERDILASRLLVGRDDCGDYLTGMFKELMAWKNDIHCLTVPQHLRRDYKNFEFPFISAENKILRVGISSISCRSDELLSVHGVSSVSSNCIEFIKQRSIDMLLLTFAGERTPGSYCRQLGVVAKDEGLAALQAYCKKSPSGLDFTLLEDVTVNEWAFSIYELSDPSVSRKKLVPSLTSFLSVWNNL,brenda,Q7Z032,O.O=P([O-])([O-])OP(=O)([O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+]>>O=P(O)(O)O.O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+],8.1,2.153436292751852,30.0,7.8,3.6.1.11,5691.0,0.9084850188786496,O.O=P([O-])([O-])OP(=O)([O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+],O=P(O)(O)O.O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+],0.9084850188786496,O.O=P([O-])([O-])OP(=O)([O-])OP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+]__MTAVVNEFLKRGVRALAARQDSVLVMGNEGGDMDTVIGSIFLAMYLEKRDVFGVGSYVPVLNFEKDDLPLRQDVVKLLSRHNVSTDSIYSVKQSGNGVDFLDLHQMKLPIVLYDHNKLSPEQVYLGERIVGVVDHHEDEQLYVDQTKCLRRICKTGSACTLVAELFNEAGLEVPCPELLLAPIVVDTVNFEPSQKRVTERDILASRLLVGRDDCGDYLTGMFKELMAWKNDIHCLTVPQHLRRDYKNFEFPFISAENKILRVGISSISCRSDELLSVHGVSSVSSNCIEFIKQRSIDMLLLTFAGERTPGSYCRQLGVVAKDEGLAALQAYCKKSPSGLDFTLLEDVTVNEWAFSIYELSDPSVSRKKLVPSLTSFLSVWNNL,./data/raw/alphafold//AF-Q7Z032-F1-model_v4.pdb,379,2949,5286,6163
+1353,1759,1790,MMKDILGNLDNVPFKIMTGCIAGLLSCGTVAQSTVQQSIQQSVDRHFKPLMAQYQISGMAIAVSINGQHYYQNYGVASKQTEQNVSEHTLFELGSVSKLFNATLTGYAQAQGQLKLSDHPAQYFPELKNTAVNQATLLNLGTYTAGGFPLQFPEQIKTTQDMTQYFQHWQPKAAPRRIREYSNPSIGLMGYVTALAMKNSYSNLIENTLFPALGMHHSYINVPAAQMSNYAWGYQADQAIRVSPGMFDAEAYGIKSNTADMLKFLDAQINPQNLKPTLRKAIQTTQMGYFRVGQMRQGLGWEQYTYPVSLTTLLAGNSAKMALQPQPVTGISKPITAPQQALLNKTGATNGFSAYVVVIPSQKIGLVMLANRNFPNDARVKAAYATLQQILNADIQK,brenda,Q0VJU2,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)Cc3cccs3)[C@H]2SC1.O>>,4.22,99.7593035206674,25.0,7.5,3.5.2.6,202950.0,0.6253124509616739,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)Cc3cccs3)[C@H]2SC1.O,,0.6253124509616739,CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](N=C(O)Cc3cccs3)[C@H]2SC1.O__MMKDILGNLDNVPFKIMTGCIAGLLSCGTVAQSTVQQSIQQSVDRHFKPLMAQYQISGMAIAVSINGQHYYQNYGVASKQTEQNVSEHTLFELGSVSKLFNATLTGYAQAQGQLKLSDHPAQYFPELKNTAVNQATLLNLGTYTAGGFPLQFPEQIKTTQDMTQYFQHWQPKAAPRRIREYSNPSIGLMGYVTALAMKNSYSNLIENTLFPALGMHHSYINVPAAQMSNYAWGYQADQAIRVSPGMFDAEAYGIKSNTADMLKFLDAQINPQNLKPTLRKAIQTTQMGYFRVGQMRQGLGWEQYTYPVSLTTLLAGNSAKMALQPQPVTGISKPITAPQQALLNKTGATNGFSAYVVVIPSQKIGLVMLANRNFPNDARVKAAYATLQQILNADIQK,./data/raw/alphafold//AF-Q0VJU2-F1-model_v4.pdb,1456,990,803,1118
+1354,2122,2153,MTDTTILQNNTHVIKPKKSVALSGVPAGNTALCTVGKSGNDLHYRGYDILDLAEHCEFEEVAHLLIHGKLPTRDELNAYKSKLKALRGLPANVRTVLEALPAASHPMDVMRTGVSALGCTLPEKEGHTVSGARDIADKLLASLSSILLYWYHYSHNGERIQPETDDDSIGGHFLHLLHGEKPTQSWEKAMHISLVLYAEHEFNASTFTSRVIAGTGSDVYSAIIGAIGALRGPKHGGANEVSLEIQQRYETPDEAEADIRKRVENKEVVIGFGHPVYTIADPRHQVIKRVAKQLSEEGGSLKMYHIADRLETVMWETKKMFPNLDWFSAVSYNMMGVPTEMFTPLFVIARVTGWAAHIIEQRQDNKIIRPSANYTGPEDRPFVSIDDRC,brenda,Q56063,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,1.87,0.0,30.0,8.0,2.3.3.5,90371.0,0.2718416065364989,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,0.2718416065364989,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__MTDTTILQNNTHVIKPKKSVALSGVPAGNTALCTVGKSGNDLHYRGYDILDLAEHCEFEEVAHLLIHGKLPTRDELNAYKSKLKALRGLPANVRTVLEALPAASHPMDVMRTGVSALGCTLPEKEGHTVSGARDIADKLLASLSSILLYWYHYSHNGERIQPETDDDSIGGHFLHLLHGEKPTQSWEKAMHISLVLYAEHEFNASTFTSRVIAGTGSDVYSAIIGAIGALRGPKHGGANEVSLEIQQRYETPDEAEADIRKRVENKEVVIGFGHPVYTIADPRHQVIKRVAKQLSEEGGSLKMYHIADRLETVMWETKKMFPNLDWFSAVSYNMMGVPTEMFTPLFVIARVTGWAAHIIEQRQDNKIIRPSANYTGPEDRPFVSIDDRC,./data/raw/alphafold//AF-Q56063-F1-model_v4.pdb,1567,1105,938,1278
+1355,16099,16326,MKEKIALFGAGGKMGVRLAKNLLKSDYRVSHVEVSEVGKKRLKDELGLECVSTEAALDNVDVVILAVPDTIIGKIAAQIAPQLRPGTMVMTLDAAAPFAGHLPDRPDLTYFVAHPCHPLIFNDETDPEARRDYFGGGAAKQSITSALMQGPEEAFDLGEAVAKVIYAPILRSYRLTVDQMALLEPGLSETICATLLQVMREAMDETVRRGVPKEAARDFLLGHMNILGAVIFNEIPGAFSDACNKAIEFGKPRLMRDDWIKVFDREEIAESIRRIT,sabio,F8GV06,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@H](O)C(O)(CO)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([O-])C(O)(CO)C(=O)CO.[H],0.49,0.060681730344359,25.0,,1.1.1.421,106590.0,-0.3098039199714864,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@H](O)C(O)(CO)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([O-])C(O)(CO)C(=O)CO.[H],-0.3098039199714864,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@H](O)C(O)(CO)CO__MKEKIALFGAGGKMGVRLAKNLLKSDYRVSHVEVSEVGKKRLKDELGLECVSTEAALDNVDVVILAVPDTIIGKIAAQIAPQLRPGTMVMTLDAAAPFAGHLPDRPDLTYFVAHPCHPLIFNDETDPEARRDYFGGGAAKQSITSALMQGPEEAFDLGEAVAKVIYAPILRSYRLTVDQMALLEPGLSETICATLLQVMREAMDETVRRGVPKEAARDFLLGHMNILGAVIFNEIPGAFSDACNKAIEFGKPRLMRDDWIKVFDREEIAESIRRIT,./data/raw/alphafold//AF-F8GV06-F1-model_v4.pdb,2610,5090,2204,5082
+1356,8037,8165,MVSQALRLLCLLLGLQGCLAAGGVAKASGGETRDMPWKPGPHRVFVTQEEAHGVLHRRRRANAFLEELRPGSLERECKEEQCSFEEAREIFKDAERTKLFWISYSDGDQCASSPCQNGGSCKDQLQSYICFCLPAFEGRNCETHKDDQLICVNENGGCEQYCSDHTGTKRSCRCHEGYSLLADGVSCTPTVEYPCGKIPILEKRNASKPQGRIVGGKVCPKGECPWQVLLLVNGAQLCGGTLINTIWVVSAAHCFDKIKNWRNLIAVLGEHDLSEHDGDEQSRRVAQVIIPSTYVPGTTNHDIALLRLHQPVVLTDHVVPLCLPERTFSERTLAFVRFSLVSGWGQLLDRGATALELMVLNVPRLMTQDCLQQSRKVGDSPNITEYMFCAGYSDGSKDSCKGDSGGPHATHYRGTWYLTGIVSWGQGCATVGHFGVYTRVSQYIEWLQKLMRSEPRPGVLLRAPFP,brenda,P08709,CC[C@H](C)[C@H](N)C(=O)N1CCC[C@@H]1C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>CCC(C)[C@@H](N)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,7.7,1.0866499370264211e-14,25.0,7.4,3.4.21.21,9606.0,0.8864907251724818,CC[C@H](C)[C@H](N)C(=O)N1CCC[C@@H]1C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,CCC(C)[C@@H](N)C(=O)N1CCC[C@H]1C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,1.5390760987927767,CC[C@H](C)[C@H](N)C(=O)N1CCC[C@@H]1C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MVSQALRLLCLLLGLQGCLAAGGVAKASGGETRDMPWKPGPHRVFVTQEEAHGVLHRRRRANAFLEELRPGSLERECKEEQCSFEEAREIFKDAERTKLFWISYSDGDQCASSPCQNGGSCKDQLQSYICFCLPAFEGRNCETHKDDQLICVNENGGCEQYCSDHTGTKRSCRCHEGYSLLADGVSCTPTVEYPCGKIPILEKRNASKPQGRIVGGKVCPKGECPWQVLLLVNGAQLCGGTLINTIWVVSAAHCFDKIKNWRNLIAVLGEHDLSEHDGDEQSRRVAQVIIPSTYVPGTTNHDIALLRLHQPVVLTDHVVPLCLPERTFSERTLAFVRFSLVSGWGQLLDRGATALELMVLNVPRLMTQDCLQQSRKVGDSPNITEYMFCAGYSDGSKDSCKGDSGGPHATHYRGTWYLTGIVSWGQGCATVGHFGVYTRVSQYIEWLQKLMRSEPRPGVLLRAPFP,./data/raw/alphafold//AF-P08709-F1-model_v4.pdb,1839,4438,42,44
+1357,6664,6777,MTVNEQLVQDIIKNVVASMQLTQTNKTELGVFDDMNQAIEAAKEAQLVVKKMSMDQREKIISAIRKKTIEHAETLARMAVEETGMGNVGHKILKHQLVAEKTPGTEDITTTAWSGDRGLTLVEMGPFGVIGAITPCTNPSETIICNTIGMLAGGNTVVFNPHPAAIKTSNFAVQLINEASLSAGGPVNIACSVRKPTLDSSKIMMSHQDIPLIAATGGPGVVTAVLQSGKRGIGAGAGNPPVLVDETADIRKAAEDIINGCTFDNNLPCIAEKEVVAIDAIANELMNYMVKEQGCYAITKEQQEKLTNLVITPKGLNRNCVGKDARTLLGMIGIDVPSNIRCIIFEGEKEHPLISEELMMPILGIVRAKSFDDAVEKAVWLEHGNRHSAHIHSKNVDRITTYAKAIDTAILVKNAPSYAAIGFGGEGFCTFTIASRTGEGLTSASTFTKRRRCVMSDSLCIR,brenda,A9KN57,CCCC=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>>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.[H+],3.44,7.528331372448283e-15,21.0,8.0,1.2.1.3,66219.0,0.5365584425715301,CCCC=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,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.[H+],0.5365584425715301,CCCC=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__MTVNEQLVQDIIKNVVASMQLTQTNKTELGVFDDMNQAIEAAKEAQLVVKKMSMDQREKIISAIRKKTIEHAETLARMAVEETGMGNVGHKILKHQLVAEKTPGTEDITTTAWSGDRGLTLVEMGPFGVIGAITPCTNPSETIICNTIGMLAGGNTVVFNPHPAAIKTSNFAVQLINEASLSAGGPVNIACSVRKPTLDSSKIMMSHQDIPLIAATGGPGVVTAVLQSGKRGIGAGAGNPPVLVDETADIRKAAEDIINGCTFDNNLPCIAEKEVVAIDAIANELMNYMVKEQGCYAITKEQQEKLTNLVITPKGLNRNCVGKDARTLLGMIGIDVPSNIRCIIFEGEKEHPLISEELMMPILGIVRAKSFDDAVEKAVWLEHGNRHSAHIHSKNVDRITTYAKAIDTAILVKNAPSYAAIGFGGEGFCTFTIASRTGEGLTSASTFTKRRRCVMSDSLCIR,./data/raw/alphafold//AF-A9KN57-F1-model_v4.pdb,3205,2011,3658,2506
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+1359,13957,14138,MNKTQRHINWLLAVSAATALPVTAAEMINVNDGSLLNQALKAQSQSVAPVETGFKQMKRVVLPNGKVKVRYQQTHHGLPVFNTSVVATESKSGSSEVFGVMAQGIADDVSTLTPSVEMKQAISIAKSRFQQQEKMVAEPATENEKAELMVRLDDNNQAQLVYLVDFFVAEDHPARPFFFIDAQTGEVLQTWDGLNHAQADGTGPGGNTKTGRYEYGSDFPPFVIDKVGTKCSMNNSAVRTVDLNGSTSGNTTYSYTCNDSTNYNDYKAINGAYSPLNDAHYFGKVVFDMYKDWMNTTPLTFQLTMRVHYGNNYENAFWNGSSMTFGDGYSTFYPLVDINVSAHEVSHGFTEQNSGLVYENMSGGMNEAFSDIAGEAAEFYMKGSVDWVVGADIFKSSGGLRYFDQPSRDGRSIDHASDYYNGLNVHYSSGVFNRAFYLLANKAGWDVRKGFEVFTLANQLYWTANSTFDEGGCGVVKAASDMGYSVADVEDAFNTVGVNASCGATPPPSGDVLEIGKPLANLSGNRNDMTYYTFTPSSSSSVVIKITGGTGDADLYVKAGSKPTTTSYDCRPYKYGNEEQCSISAQAGTTYHVMLRGYSNYAGVTLRAD,uniprot_search,Q00971,N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)OCc1ccccc1.O>>,0.4,99.7329124032809,31.0,8.0,3.4.24.25,671.0,-0.3979400086720376,N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)OCc1ccccc1.O,,2.7664128471124,N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)OCc1ccccc1.O__MNKTQRHINWLLAVSAATALPVTAAEMINVNDGSLLNQALKAQSQSVAPVETGFKQMKRVVLPNGKVKVRYQQTHHGLPVFNTSVVATESKSGSSEVFGVMAQGIADDVSTLTPSVEMKQAISIAKSRFQQQEKMVAEPATENEKAELMVRLDDNNQAQLVYLVDFFVAEDHPARPFFFIDAQTGEVLQTWDGLNHAQADGTGPGGNTKTGRYEYGSDFPPFVIDKVGTKCSMNNSAVRTVDLNGSTSGNTTYSYTCNDSTNYNDYKAINGAYSPLNDAHYFGKVVFDMYKDWMNTTPLTFQLTMRVHYGNNYENAFWNGSSMTFGDGYSTFYPLVDINVSAHEVSHGFTEQNSGLVYENMSGGMNEAFSDIAGEAAEFYMKGSVDWVVGADIFKSSGGLRYFDQPSRDGRSIDHASDYYNGLNVHYSSGVFNRAFYLLANKAGWDVRKGFEVFTLANQLYWTANSTFDEGGCGVVKAASDMGYSVADVEDAFNTVGVNASCGATPPPSGDVLEIGKPLANLSGNRNDMTYYTFTPSSSSSVVIKITGGTGDADLYVKAGSKPTTTSYDCRPYKYGNEEQCSISAQAGTTYHVMLRGYSNYAGVTLRAD,./data/raw/alphafold//AF-Q00971-F1-model_v4.pdb,1859,1557,3141,1912
+1360,21086,21408,MNDAPHATTVADPVPPQDLSGIVGHRFIYTYANGWQYEMYVKNDHTIDYRIHSGMVGGRWVKDQRVDLVQLDDDSYKVSWTEPTGTSVAVDVMPGKRRLHGVIFFPHWVEEHGERTVCFQNEHLDEMRAYRDKGPTYPIYVVPEFARITLFEYVGADDESVISVAPGDLPAGWSSRTN,brenda,F8JS69,O=C(O)/C=C/c1ccc(O)cc1>>C=Cc1ccc(O)cc1.O=C=O,0.19,8.630423123528491e-15,30.0,5.5,4.1.1.102,29303.0,-0.721246399047171,O=C(O)/C=C/c1ccc(O)cc1,C=Cc1ccc(O)cc1.O=C=O,-0.721246399047171,O=C(O)/C=C/c1ccc(O)cc1__MNDAPHATTVADPVPPQDLSGIVGHRFIYTYANGWQYEMYVKNDHTIDYRIHSGMVGGRWVKDQRVDLVQLDDDSYKVSWTEPTGTSVAVDVMPGKRRLHGVIFFPHWVEEHGERTVCFQNEHLDEMRAYRDKGPTYPIYVVPEFARITLFEYVGADDESVISVAPGDLPAGWSSRTN,./data/raw/alphafold//AF-F8JS69-F1-model_v4.pdb,3540,3305,5616,6506
+1361,22892,23234,MKNKVQLIAYVDRISGGGFRKLHALLTGPLAEIFGGAHLLPFFTPIDGADAGFDPSDHTQVDPRLGTWDDVRILGGAIELVADLIVNHVSSSSPQFIDYSKKGSDSLYAGMFLTYDRVFPEGAREADILRIYRPRPTLPFSPVTLSSRERKLLWTTFNPEQVDIDVRHPEAEAYLHSILKKFQAAGIRMIRLDAVGYAIKKPGASCFMIPETFDFIAELTEKARALGIEVLVEIHSHYRKQIEIARQVDWVYDFALPPLVLHALFASDPHPLAQWLSISPRNAVTVLDTHDGIGVIDVGADAEGNPGLLSPAAIDSLVETIHSRSQGQSREATGAAANNLDLYQVNCTFLDALGGREPDYLIARALQFFAPGIPQVYYVGLLGGTNDMDLLGRSGVGRDINRHYYTDAEIDAALARPLVRTLIALIRLRNTHPAFAGEFDVSVPAATQIRLRWQRQEHWIELHVDLSIPKASITGTGIHPITIPGAADAGAPS,brenda,B8Y3Y0,OCC(O)CO.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>>OCC(CO)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,31.19,0.0,37.0,6.5,2.4.1.7,77133.0,1.494015374757144,OCC(O)CO.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,OCC(CO)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O.OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O,1.494015374757144,OCC(O)CO.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__MKNKVQLIAYVDRISGGGFRKLHALLTGPLAEIFGGAHLLPFFTPIDGADAGFDPSDHTQVDPRLGTWDDVRILGGAIELVADLIVNHVSSSSPQFIDYSKKGSDSLYAGMFLTYDRVFPEGAREADILRIYRPRPTLPFSPVTLSSRERKLLWTTFNPEQVDIDVRHPEAEAYLHSILKKFQAAGIRMIRLDAVGYAIKKPGASCFMIPETFDFIAELTEKARALGIEVLVEIHSHYRKQIEIARQVDWVYDFALPPLVLHALFASDPHPLAQWLSISPRNAVTVLDTHDGIGVIDVGADAEGNPGLLSPAAIDSLVETIHSRSQGQSREATGAAANNLDLYQVNCTFLDALGGREPDYLIARALQFFAPGIPQVYYVGLLGGTNDMDLLGRSGVGRDINRHYYTDAEIDAALARPLVRTLIALIRLRNTHPAFAGEFDVSVPAATQIRLRWQRQEHWIELHVDLSIPKASITGTGIHPITIPGAADAGAPS,./data/raw/alphafold//AF-B8Y3Y0-F1-model_v4.pdb,846,308,6072,7008
+1362,18980,19265,MSTLGKRAGVRRRVRAVATAATATALVAVPLTTLATSASAAPVHVDNPYAGAVQYVNPTWAASVNAAAGRQSADPALAAKMRTVAGQPTAVWMDRISAITGNADGNGLKFHLDNAVAQQKAAGVPLVFNLVIYDLPGRDCFALASNGELPATDAGLARYKSEYIDPIADLLDNPEYESIRIAATIEPDSLPNLTTNISEPACQQAAPYYRQGVKYALDKLHAIPNVYNYIDIGHSGWLGWDSNAGPSATLFAEVAKSTTAGFASIDGFVSDVANTTPLEEPLLSDSSLTINNTPIRSSKFYEWNFDFDEIDYTAHMHRLLVAAGFPSSIGMLVDTSRNGWGGPNRPTSITASTDVNAYVDANRVDRRVHRGAWCNPLGAGIGRFPEATPSGYAASHLDAFVWIKPPGESDGASTDIPNDQGKRFDRMCDPTFVSPKLNNQLTGATPNAPLAGQWFEEQFVTLVKNAYPVIGGTTPVEDLVAPTVPTGLTAGTTTATSVPLSWTASTDNVAVTGYDVYRGTTLVGTTAATSYTVTGLTPATAYSFTVRAKDAAGNVSAASAAAAATTQSGTVTDTTAPSVPAGLTAGTTTTTTVPLSWTASTDNAGGSGVAGYEVLRGTTVVGTTTATSYTVTGLTAGTTYSFSVRAKDVAGNTSAASAAVSATTQTGTVVDTTAPSVPTGLTAGTTTTSSVPLTWTASTDNAGGSGVAGYEVFNGTTRVATVTSTSYTVTGLAADTAYSFTVKAKDVAGNVSAASAAVSARTQAATSGGCTVKYSASSWNTGFTGTVEVKNNGTAALNGWTLGFSFADGQKVSQGWSAEWSQSGTAVTAKNAPWNGTLAAGSSVSIGFNGTHNGTNTAPTAFTLNGVACTLG,sabio,P50401,O>>O=[N+]([O-])c1ccc(O)c([N+](=O)[O-])c1.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O,15.6,93.2107242321958,37.0,7.0,3.2.1.91,1708.0,1.1931245983544616,O,O=[N+]([O-])c1ccc(O)c([N+](=O)[O-])c1.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O,1.1931245983544616,O__MSTLGKRAGVRRRVRAVATAATATALVAVPLTTLATSASAAPVHVDNPYAGAVQYVNPTWAASVNAAAGRQSADPALAAKMRTVAGQPTAVWMDRISAITGNADGNGLKFHLDNAVAQQKAAGVPLVFNLVIYDLPGRDCFALASNGELPATDAGLARYKSEYIDPIADLLDNPEYESIRIAATIEPDSLPNLTTNISEPACQQAAPYYRQGVKYALDKLHAIPNVYNYIDIGHSGWLGWDSNAGPSATLFAEVAKSTTAGFASIDGFVSDVANTTPLEEPLLSDSSLTINNTPIRSSKFYEWNFDFDEIDYTAHMHRLLVAAGFPSSIGMLVDTSRNGWGGPNRPTSITASTDVNAYVDANRVDRRVHRGAWCNPLGAGIGRFPEATPSGYAASHLDAFVWIKPPGESDGASTDIPNDQGKRFDRMCDPTFVSPKLNNQLTGATPNAPLAGQWFEEQFVTLVKNAYPVIGGTTPVEDLVAPTVPTGLTAGTTTATSVPLSWTASTDNVAVTGYDVYRGTTLVGTTAATSYTVTGLTPATAYSFTVRAKDAAGNVSAASAAAAATTQSGTVTDTTAPSVPAGLTAGTTTTTTVPLSWTASTDNAGGSGVAGYEVLRGTTVVGTTTATSYTVTGLTAGTTYSFSVRAKDVAGNTSAASAAVSATTQTGTVVDTTAPSVPTGLTAGTTTTSSVPLTWTASTDNAGGSGVAGYEVFNGTTRVATVTSTSYTVTGLAADTAYSFTVKAKDVAGNVSAASAAVSARTQAATSGGCTVKYSASSWNTGFTGTVEVKNNGTAALNGWTLGFSFADGQKVSQGWSAEWSQSGTAVTAKNAPWNGTLAAGSSVSIGFNGTHNGTNTAPTAFTLNGVACTLG,./data/raw/alphafold//AF-P50401-F1-model_v4.pdb,216,2734,5046,5899
+1363,14434,14637,MNVLITGGAGFLGLQLARLLLQRGTLNLDGQPVAIKRLTLLDVVAPQGLDDARVRVVTGDLSDPAVLRQAIDTDTGAVFHLAAVVSGQAEADFDLGMRVNLDASRALLETCRELGHQPRVLFTSSVAVYGGQLPPVVQDDTALNPQSSYGVQKAIGELLLSDYSRRGFVDGRVLRLPTISVRPGKPNAAASSFASGIIREPLSGVAANCPVAPETPLWLLSPRAAVAALVNGIELAGERLGNRRVVNLPGLSVTAAGMIEALRRVAGNAVADRVTWEREARVENIVGTWPAAWNAERALALGFQSDASFDEVIRAYMEDAGLAK,brenda,Q0KBD2,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)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)[C@H](O)CO.[H+],3.0,0.0,25.0,8.0,1.1.1.410,106590.0,0.4771212547196624,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)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)[C@H](O)CO.[H+],1.2787536009528289,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)CO__MNVLITGGAGFLGLQLARLLLQRGTLNLDGQPVAIKRLTLLDVVAPQGLDDARVRVVTGDLSDPAVLRQAIDTDTGAVFHLAAVVSGQAEADFDLGMRVNLDASRALLETCRELGHQPRVLFTSSVAVYGGQLPPVVQDDTALNPQSSYGVQKAIGELLLSDYSRRGFVDGRVLRLPTISVRPGKPNAAASSFASGIIREPLSGVAANCPVAPETPLWLLSPRAAVAALVNGIELAGERLGNRRVVNLPGLSVTAAGMIEALRRVAGNAVADRVTWEREARVENIVGTWPAAWNAERALALGFQSDASFDEVIRAYMEDAGLAK,./data/raw/alphafold//AF-Q0KBD2-F1-model_v4.pdb,2389,4784,4841,4687
+1364,6498,6611,MEICTKGSRKHLTSRASEPSYNVPENQYVLYVVSSTLSIVKQLVKVAESKKSRFSGAIEKLNERLDSLKDYRIINRDLVVKDLERLKKRFDTEVINAELSEQLAKINVNLSRSYSEKGYLRLEKATGSENEWWAKIKPSQNDDWQQFEPDGYTIFSSRDHYASLFKSYSDYEIEAKIPLPLRRGKAVVLYPEYISRICVLPESRSIQREQENFTKLRDKGIALSKKDWQAKLTTDELAEQEKERATINKRLGYFATEHEKVGIVHKALEPKLKPFQQIEKEWRQCKVKSKSTFPNSMTFVQNPAYQAVHSGFKKLKEQIGLADEDILLSLEKIEAIGLVNMPLLYERWCLLQIIKVLTQAFRYQPEDNWKRKLIANIQGNEEQISIQFFNPSVSRAITLQYEPFLANGKRPDFVLDVEAITKSGNQISKRLVVDAKYYSAAYLKQRGGIGGVIHELYNGKDYSECQENSVFVLHPVLDAVEKVVSPQEWAKDSYLGELSMFDWEPAHHQRQATNYGAVCANPMKSQRYLDEIQRMLGMFLQYGIEDNTSFRGASDDTHAVNFCVSCGSEKVVDVTKSMSSNNQKRWYRCNECTHFTVYTHCGTCNTRLIKNGEYWTYLSLMPMSSINIKCPNCESPV,brenda,Q52NW7,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,314.0,0.0,30.0,7.0,3.1.1.1,576.0,2.496929648073215,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,2.496929648073215,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MEICTKGSRKHLTSRASEPSYNVPENQYVLYVVSSTLSIVKQLVKVAESKKSRFSGAIEKLNERLDSLKDYRIINRDLVVKDLERLKKRFDTEVINAELSEQLAKINVNLSRSYSEKGYLRLEKATGSENEWWAKIKPSQNDDWQQFEPDGYTIFSSRDHYASLFKSYSDYEIEAKIPLPLRRGKAVVLYPEYISRICVLPESRSIQREQENFTKLRDKGIALSKKDWQAKLTTDELAEQEKERATINKRLGYFATEHEKVGIVHKALEPKLKPFQQIEKEWRQCKVKSKSTFPNSMTFVQNPAYQAVHSGFKKLKEQIGLADEDILLSLEKIEAIGLVNMPLLYERWCLLQIIKVLTQAFRYQPEDNWKRKLIANIQGNEEQISIQFFNPSVSRAITLQYEPFLANGKRPDFVLDVEAITKSGNQISKRLVVDAKYYSAAYLKQRGGIGGVIHELYNGKDYSECQENSVFVLHPVLDAVEKVVSPQEWAKDSYLGELSMFDWEPAHHQRQATNYGAVCANPMKSQRYLDEIQRMLGMFLQYGIEDNTSFRGASDDTHAVNFCVSCGSEKVVDVTKSMSSNNQKRWYRCNECTHFTVYTHCGTCNTRLIKNGEYWTYLSLMPMSSINIKCPNCESPV,./data/raw/alphafold//AF-Q52NW7-F1-model_v4.pdb,1484,1028,854,1183
+1365,10411,10564,MMKGWMKCGLAGAVVLMASFWGGSVRAAGMSLTQVSGPVYVVEDNYYVQENSMVYFGAKGVTVVGATWTPDTARELHKLIKRVSRKPVLEVINTNYHTDRAGGNAYWKSIGAKVVSTRQTRDLMKSDWAEIVAFTRKGLPEYPDLPLVLPNVVHDGDFTLQEGKVRAFYAGPAHTPDGIFVYFPDEQVLYGNCILKEKLGNLSFADVKAYPQTLERLKAMKLPIKTVIGGHDSPLHGPELIDHYEALIKAAPQS,sabio,P26918,C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(Oc3ccc(C(N)=O)cc3)S[C@H]12.O>>,10.0,99.72926655602694,30.0,6.5,3.5.2.6,644.0,1.0,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__MMKGWMKCGLAGAVVLMASFWGGSVRAAGMSLTQVSGPVYVVEDNYYVQENSMVYFGAKGVTVVGATWTPDTARELHKLIKRVSRKPVLEVINTNYHTDRAGGNAYWKSIGAKVVSTRQTRDLMKSDWAEIVAFTRKGLPEYPDLPLVLPNVVHDGDFTLQEGKVRAFYAGPAHTPDGIFVYFPDEQVLYGNCILKEKLGNLSFADVKAYPQTLERLKAMKLPIKTVIGGHDSPLHGPELIDHYEALIKAAPQS,./data/raw/alphafold//AF-P26918-F1-model_v4.pdb,1463,1689,3301,2101
+1366,20075,20363,MSEHQAVIQTDIAKGTINKNIYGHFAEHLGRGIYEGIWVGTDSDIPNINGIRKDVLEALKQLHIPVLRWPGGCFADEYHWANGVGDRKTMLNTHWGGTIESNEFGTHEFMMLCELLECEPYICGNVGSGTVQEMSEWIEYMTFEEGTPMSDWRKQNGREEPWKLKYFGVGNENWGCGGNMHPEYYADLYRRFQTYVRNYSGNDIYKIAGGANVDDFNWTDVLMKKAAGLMDGLSLHYYTIPGDFWKGKGSATEFTEDEWFITMKKAKYIDELIQKHGTIMDRYDPEQRVGLIIDEWGTWFDPEPGTNPGFLYQQNTIRDALVAASHFHIFHQHCRRVQMANIAQTVNVLQAMILTEGERMLLTPTYHVFNMFKVHQDASLLATETMSADYEWNGETLPQISISASKQAEGDINITICNIDHQNKAEAEIELRGLHKAADHSGVILTAEKMNAHNTFDDPHHVKPESFRQYTLSKNKLKVKLPPMSVVLLTLRADS,sabio,P94552,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,295.0,9.809384078968736e-15,37.0,6.6,3.2.1.55,1423.0,2.469822015978163,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,2.469822015978163,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)cc1__MSEHQAVIQTDIAKGTINKNIYGHFAEHLGRGIYEGIWVGTDSDIPNINGIRKDVLEALKQLHIPVLRWPGGCFADEYHWANGVGDRKTMLNTHWGGTIESNEFGTHEFMMLCELLECEPYICGNVGSGTVQEMSEWIEYMTFEEGTPMSDWRKQNGREEPWKLKYFGVGNENWGCGGNMHPEYYADLYRRFQTYVRNYSGNDIYKIAGGANVDDFNWTDVLMKKAAGLMDGLSLHYYTIPGDFWKGKGSATEFTEDEWFITMKKAKYIDELIQKHGTIMDRYDPEQRVGLIIDEWGTWFDPEPGTNPGFLYQQNTIRDALVAASHFHIFHQHCRRVQMANIAQTVNVLQAMILTEGERMLLTPTYHVFNMFKVHQDASLLATETMSADYEWNGETLPQISISASKQAEGDINITICNIDHQNKAEAEIELRGLHKAADHSGVILTAEKMNAHNTFDDPHHVKPESFRQYTLSKNKLKVKLPPMSVVLLTLRADS,./data/raw/alphafold//AF-P94552-F1-model_v4.pdb,963,489,130,138
+1367,13446,13623,MSTTQTPDLDAIVIGAGFGGIYMLHKLRNDLGLSVRVFEKGGGVGGTWYWNKYPGAKSDTEGFVYRYSFDKELLREYDWTTRYLDQPDVLAYLEHVVERYDLARDIQLNTEVTDAIFDEETELWRVTTAGGETLTARFLVTALGLLSRSNIPDIPGRDSFAGRLVHTNAWPEDLDITGKRVGVIGTGSTGTQFIVAAAKMAEQLTVFQRTPQYCVPSGNGPMDPDEVARIKQNFDSIWDQVRSSTVAFGFEESTVEAMSVSESERQRVFQQAWDKGNGFRFMFGTFCDIATNPEANAAAAAFIRSKIAEIVKDPETARKLTPTDLYAKRPLCNEGYYETYNRDNVSLVSLKETPIEEIVPQGVRTSDGVVHELDVLVFATGFDAVDGNYRAMNLRGRDGRHINEHWTEGPTSYLGVTKAGFPNMFMILGPNGPFTNLPPSIEAQVEWISDLIDKATREGLTTVEPTADAEREWTETCAEIANMTLFPKADSWIFGANIPGKRHAVMFYLGGLGNYRRQLADVADGGYRGFQLRGERAQAVA,brenda,A0A1L1QK39,N=C(O)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=C1CC2C=CCC12.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=C1OCC2C=CCC12,2.0,6.407989761902711e-15,25.0,7.0,1.14.13.22,37926.0,0.3010299956639812,N=C(O)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=C1CC2C=CCC12.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=C1OCC2C=CCC12,0.3010299956639812,N=C(O)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=C1CC2C=CCC12.O=O.[H+]__MSTTQTPDLDAIVIGAGFGGIYMLHKLRNDLGLSVRVFEKGGGVGGTWYWNKYPGAKSDTEGFVYRYSFDKELLREYDWTTRYLDQPDVLAYLEHVVERYDLARDIQLNTEVTDAIFDEETELWRVTTAGGETLTARFLVTALGLLSRSNIPDIPGRDSFAGRLVHTNAWPEDLDITGKRVGVIGTGSTGTQFIVAAAKMAEQLTVFQRTPQYCVPSGNGPMDPDEVARIKQNFDSIWDQVRSSTVAFGFEESTVEAMSVSESERQRVFQQAWDKGNGFRFMFGTFCDIATNPEANAAAAAFIRSKIAEIVKDPETARKLTPTDLYAKRPLCNEGYYETYNRDNVSLVSLKETPIEEIVPQGVRTSDGVVHELDVLVFATGFDAVDGNYRAMNLRGRDGRHINEHWTEGPTSYLGVTKAGFPNMFMILGPNGPFTNLPPSIEAQVEWISDLIDKATREGLTTVEPTADAEREWTETCAEIANMTLFPKADSWIFGANIPGKRHAVMFYLGGLGNYRRQLADVADGGYRGFQLRGERAQAVA,./data/raw/alphafold//AF-A0A1L1QK39-F1-model_v4.pdb,3183,877,673,962
+1368,17393,17629,MSGDATRTLGKGSQPPGPVPEGLIRIYSMRFCPYSHRTRLVLKAKDIRHEVVNINLRNKPEWYYTKHPFGHIPVLETSQCQLIYESVIACEYLDDAYPGRKLFPYDPYERARQKMLLELFCKVPHLTKECLVALRCGRECTNLKAALRQEFSNLEEILEYQNTTFFGGTCISMIDYLLWPWFERLDVYGILDCVSHTPALRLWISAMKWDPTVCALLMDKSIFQGFLNLYFQNNPNAFDFGLC,brenda,Q9H4Y5,N[C@@H](CS)C(=O)O.O=C1O[C@H]([C@@H](O)CO)C(=O)C1=O>>O=C1O[C@H]([C@@H](O)CO)C(O)=C1O,0.011,25.22158457047416,30.0,6.9,1.8.5.1,9606.0,-1.958607314841775,N[C@@H](CS)C(=O)O.O=C1O[C@H]([C@@H](O)CO)C(=O)C1=O,O=C1O[C@H]([C@@H](O)CO)C(O)=C1O,-1.958607314841775,N[C@@H](CS)C(=O)O.O=C1O[C@H]([C@@H](O)CO)C(=O)C1=O__MSGDATRTLGKGSQPPGPVPEGLIRIYSMRFCPYSHRTRLVLKAKDIRHEVVNINLRNKPEWYYTKHPFGHIPVLETSQCQLIYESVIACEYLDDAYPGRKLFPYDPYERARQKMLLELFCKVPHLTKECLVALRCGRECTNLKAALRQEFSNLEEILEYQNTTFFGGTCISMIDYLLWPWFERLDVYGILDCVSHTPALRLWISAMKWDPTVCALLMDKSIFQGFLNLYFQNNPNAFDFGLC,./data/raw/alphafold//AF-Q9H4Y5-F1-model_v4.pdb,2768,5318,2584,5409
+1369,12733,12904,MTTSQEVLKRIQDEKIPLIHLKSIDTVGTWQHLTLYQNQIDESSFTDGVPFDGSSIRGWKAINESDMTMVLDPNTAWIDPFMEVPTLSIVCSIKEPRTGEWYNRCPRVIAQKAVDYLVATGIGDTAFFGPEAEFFIFDSARFAQTANEGYYFLDSVEGAWNSGKEGTADKPNLAYKPRFKEGYFPVSPTDSFQDIRTEMLLTMAKLGVPIEKHHHEVATGGQCELGLRFGKLIEAADWLMIYKYVIKNVAKKYGKTVTFMPKPIFGDNGSGMHCHQSIWKDGKPLFAGDQYAGLSEMGLYYIGGLLKHAPALLAITNPSTNSYKRLVPGYEAPVNLAYSQGNRSASIRIPLSGTNPKAKRLEFRCPDATSNPYLAFAAMLCAGIDGIKNKIHPGEPLDKNIYELSPEELAKVPSTPGSLELALEALENDHAFLTDTGVFTEDFIQNWIDYKLANEVKQMQLRPHPYEFSIYYDV,brenda,Q9RHZ1,N.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>>N=C(O)CC[C@H](N)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,42.0,0.0,30.0,7.0,6.3.1.2,1164.0,1.6232492903979006,N.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,N=C(O)CC[C@H](N)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,1.6232492903979006,N.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__MTTSQEVLKRIQDEKIPLIHLKSIDTVGTWQHLTLYQNQIDESSFTDGVPFDGSSIRGWKAINESDMTMVLDPNTAWIDPFMEVPTLSIVCSIKEPRTGEWYNRCPRVIAQKAVDYLVATGIGDTAFFGPEAEFFIFDSARFAQTANEGYYFLDSVEGAWNSGKEGTADKPNLAYKPRFKEGYFPVSPTDSFQDIRTEMLLTMAKLGVPIEKHHHEVATGGQCELGLRFGKLIEAADWLMIYKYVIKNVAKKYGKTVTFMPKPIFGDNGSGMHCHQSIWKDGKPLFAGDQYAGLSEMGLYYIGGLLKHAPALLAITNPSTNSYKRLVPGYEAPVNLAYSQGNRSASIRIPLSGTNPKAKRLEFRCPDATSNPYLAFAAMLCAGIDGIKNKIHPGEPLDKNIYELSPEELAKVPSTPGSLELALEALENDHAFLTDTGVFTEDFIQNWIDYKLANEVKQMQLRPHPYEFSIYYDV,./data/raw/alphafold//AF-Q9RHZ1-F1-model_v4.pdb,2155,4368,4258,4128
+1370,4435,4490,MAAIRFLVLAFLFACGASEPINEKEGRIIGGTTTTITSYPYIASLHKGTEHICGATIINSEWLVTAASCISIPNAREYLVRVGSTYSSSGGNVYQVSKIYRHEFDLNTMDNDIALVRLSTGVIFGTNVQSITLQESDVSDGTSATVLGWGTISEGGAQSNILKQVVVPVVGFHSCNTSYATYGGITDNMLCAGYNEGGVDACQGDTGGPLVASGHLIGIVSWGAGCGHSTFPGVYTKVSAYRDWIKDKTGV,uniprot_search,A0A059WCN6,CC(C)[C@H](N=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)=N[C@@H](C)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O>>CC(C)[C@H](N)C(O)=N[C@@H](C)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,133000.0,5.359568135758257e-14,30.0,8.5,3.4.21.4,6978.0,5.123851640967086,CC(C)[C@H](N=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)=N[C@@H](C)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O,CC(C)[C@H](N)C(O)=N[C@@H](C)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,5.123851640967086,CC(C)[C@H](N=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)=N[C@@H](C)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
+1371,8834,8974,MGCDRPRQALHSLQEFTVMFSKWLPISAILLYGASAKALDCAGLFKKSQTLIKGINPFVAEVHPANVTFVPVGNIAYPDPVPDLPEFCRFGAEYNTSSKSKFRFEVWLPTSKKWNGRFAFIGNGGDAGGVNYADMAIPLAKYGFVVASTNTGHDGTHGDGTFAISNPESQIDFGHRAVHLSTVFAKTIAKSYYGKPSTYNYWIGCSSGGKQGLKSAQAYPADFDGVIAGAPAQWWPHLNGFTTHVNMLNAKATTPGATIPTSFFTALNQEVVAQCGKLDGVDDGIITNPRLCKPDLTRVACGSTNASPYVNSSNCLSKLQLVTLKAIYTNWTSSNGEFLFPTFEPGSEFGWPNTVNGVPYGPGPDYFLYQVYNKTSVQKLQINEAELQRLVAIADVTNPGQSRAIDPNLNPFFKRGGKLLQYHGFADPLIPSGSSLWYYEHVRSYFKNADLSDRYRLFMIPGVAHCSGGPGADAFGRPGQRSVSLGGAGQSLSFTPQYDMILATINWVEKGVAPKSLIGTKYKNNNIREGAKFTRLFCPYPQEAIYRGGNVNVASSYSCGVRA,brenda,A0A1D0BQV8,COC(=O)/C=C/c1ccc(O)cc1.O>>CO.O=C(O)/C=C/c1ccc(O)cc1,33.1,0.0,37.0,6.0,3.1.1.42,456999.0,1.5198279937757189,COC(=O)/C=C/c1ccc(O)cc1.O,CO.O=C(O)/C=C/c1ccc(O)cc1,1.5198279937757189,COC(=O)/C=C/c1ccc(O)cc1.O__MGCDRPRQALHSLQEFTVMFSKWLPISAILLYGASAKALDCAGLFKKSQTLIKGINPFVAEVHPANVTFVPVGNIAYPDPVPDLPEFCRFGAEYNTSSKSKFRFEVWLPTSKKWNGRFAFIGNGGDAGGVNYADMAIPLAKYGFVVASTNTGHDGTHGDGTFAISNPESQIDFGHRAVHLSTVFAKTIAKSYYGKPSTYNYWIGCSSGGKQGLKSAQAYPADFDGVIAGAPAQWWPHLNGFTTHVNMLNAKATTPGATIPTSFFTALNQEVVAQCGKLDGVDDGIITNPRLCKPDLTRVACGSTNASPYVNSSNCLSKLQLVTLKAIYTNWTSSNGEFLFPTFEPGSEFGWPNTVNGVPYGPGPDYFLYQVYNKTSVQKLQINEAELQRLVAIADVTNPGQSRAIDPNLNPFFKRGGKLLQYHGFADPLIPSGSSLWYYEHVRSYFKNADLSDRYRLFMIPGVAHCSGGPGADAFGRPGQRSVSLGGAGQSLSFTPQYDMILATINWVEKGVAPKSLIGTKYKNNNIREGAKFTRLFCPYPQEAIYRGGNVNVASSYSCGVRA,./data/raw/alphafold//AF-A0A1D0BQV8-F1-model_v4.pdb,3338,2199,3885,2756
+1372,3960,4013,MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,uniprot_search,P23946,CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@H](C)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@H](C)N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,19.3,1.1165998566188155e-14,45.66666666666666,8.375,3.4.21.39,9606.0,1.285557309007774,CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@H](C)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@H](C)N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,1.285557309007774,CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@H](C)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,./data/raw/alphafold//AF-P23946-F1-model_v4.pdb,1858,1553,3136,1905
+1373,5559,5645,MQRRHFLQKTLLALPIIFSGNLLTGCKTNLSDDYLPDDKITNNPNLLQNKLKEILPIWENKFNAKIGMTIIADNGELSSHRGNEYFPVNSTIKAFIASHILLLVDKEKLDLNEKIIIKESDLIEYSPVCKKYFDENKPISISELCEATITLSDNGSANILLDKIGGLTAFNQFLKEIGADMVLANNEPLLNRSHYGETSDTAKPIPYTKSLKALIVGNILSNQSKEQLITWLINDKVADNLLRKYLPKNWRIGDKTGTGSESKNIIAVIWNENNKPYFISLFITQPHDGKSLDFKNQKDEIMAQIGKEIYPFL,sabio,Q59514,CC1(C)S[C@@H]2[C@H](N=CN3CCCCCC3)C(=O)N2[C@H]1C(=O)O.O>>,31.0,99.7096812590543,30.0,7.0,3.5.2.6,480.0,1.4913616938342726,CC1(C)S[C@@H]2[C@H](N=CN3CCCCCC3)C(=O)N2[C@H]1C(=O)O.O,,1.4913616938342726,CC1(C)S[C@@H]2[C@H](N=CN3CCCCCC3)C(=O)N2[C@H]1C(=O)O.O__MQRRHFLQKTLLALPIIFSGNLLTGCKTNLSDDYLPDDKITNNPNLLQNKLKEILPIWENKFNAKIGMTIIADNGELSSHRGNEYFPVNSTIKAFIASHILLLVDKEKLDLNEKIIIKESDLIEYSPVCKKYFDENKPISISELCEATITLSDNGSANILLDKIGGLTAFNQFLKEIGADMVLANNEPLLNRSHYGETSDTAKPIPYTKSLKALIVGNILSNQSKEQLITWLINDKVADNLLRKYLPKNWRIGDKTGTGSESKNIIAVIWNENNKPYFISLFITQPHDGKSLDFKNQKDEIMAQIGKEIYPFL,./data/raw/alphafold//AF-Q59514-F1-model_v4.pdb,1442,967,773,1073
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+1382,3144,3186,MSGTSRRAKGLFTGIAVGTFVSGAMFVSCASARVEEPPFDIRALRADIEDMISEKLELGPSLIRLAWHEAASYDCFKKDGSPNSASMRFKPECLYAGNKGLDIPRKALETLKKKYPQISYADLWVLAAYVAIEYMGGPTIPFCWGRVDAKDGSVCGPDGRLPDGSKTQSHVREVFRRLGFNDQETVALIGAHTCGECHIEFSGYHGPWTHDKNGFDNSFFTQLLDEDWVLNPKVEQMQLMDRATTKLMMLPSDVCLLLDPSYRKYVELYAKDNDRFNKDFANAFKKLTELGTRNLHKAPASES,uniprot_search,Q4Q3K2,CC(C)(OO)c1ccccc1.O=C1O[C@H]([C@@H](O)CO)C(O)=C1O>>CC(C)(O)c1ccccc1.O.O=C1O[C@H]([C@@H](O)CO)C(=O)C1=O,0.53,8.643625308425055e-15,30.0,7.5,1.11.1.11,5664.0,-0.2757241303992109,CC(C)(OO)c1ccccc1.O=C1O[C@H]([C@@H](O)CO)C(O)=C1O,CC(C)(O)c1ccccc1.O.O=C1O[C@H]([C@@H](O)CO)C(=O)C1=O,-0.2757241303992109,CC(C)(OO)c1ccccc1.O=C1O[C@H]([C@@H](O)CO)C(O)=C1O__MSGTSRRAKGLFTGIAVGTFVSGAMFVSCASARVEEPPFDIRALRADIEDMISEKLELGPSLIRLAWHEAASYDCFKKDGSPNSASMRFKPECLYAGNKGLDIPRKALETLKKKYPQISYADLWVLAAYVAIEYMGGPTIPFCWGRVDAKDGSVCGPDGRLPDGSKTQSHVREVFRRLGFNDQETVALIGAHTCGECHIEFSGYHGPWTHDKNGFDNSFFTQLLDEDWVLNPKVEQMQLMDRATTKLMMLPSDVCLLLDPSYRKYVELYAKDNDRFNKDFANAFKKLTELGTRNLHKAPASES,./data/raw/alphafold//AF-Q4Q3K2-F1-model_v4.pdb,722,1339,6267,1614
+1383,6082,6176,MQTARLFQGNLNLAAANIRDYEKKEQRNLGVWLSLNQWLRLYDEDTRFWWTTTAPMLGRMMELIGYDQDAQQKHLLFYYIYVLPSLGRRPSPEGYPTGWNSFMTDDYSPLELSWDWGVAEGESSVRFSIEPIGKYAGTQADPLNQKMVYQLVDGLRPAFHHTLDLTLFDVFSEALTTSREKFGTRKLSLEGRSQYFVAFDLDVGHPRLKAYFMPGLKSIESNTPVSELVVKAMDACELHFGSLFMQAFRRLNSDLEAFSATSYHRPEIEIVGIDCVSPVKSRAKIYIRHRGTSFDSVCRMLSMGAKAPLDAASVASLRELWALVLGLPKDFPSDQELPSVPHRTSGVLYYFEIKPTSDAIVPKVYIPVRHYASNDLSIAQGLATYFERRGQTVAAENYVDALSDIFSHRSLDSGLGLHTYISCTFKKTGLSVTSYFNPEIYHPNRYRQ,brenda,Q6Q874,CCC(=CCOP(=O)(O)OP(=O)(O)O)CC.N[C@@H](Cc1ccc(O)cc1)C(=O)O>>CCC(=CCOc1ccc(C[C@H](N)C(=O)O)cc1)CC.O=P(O)(O)OP(=O)(O)O,0.055,0.0,35.0,7.5,2.5.1.122,5022.0,-1.259637310505756,CCC(=CCOP(=O)(O)OP(=O)(O)O)CC.N[C@@H](Cc1ccc(O)cc1)C(=O)O,CCC(=CCOc1ccc(C[C@H](N)C(=O)O)cc1)CC.O=P(O)(O)OP(=O)(O)O,-1.259637310505756,CCC(=CCOP(=O)(O)OP(=O)(O)O)CC.N[C@@H](Cc1ccc(O)cc1)C(=O)O__MQTARLFQGNLNLAAANIRDYEKKEQRNLGVWLSLNQWLRLYDEDTRFWWTTTAPMLGRMMELIGYDQDAQQKHLLFYYIYVLPSLGRRPSPEGYPTGWNSFMTDDYSPLELSWDWGVAEGESSVRFSIEPIGKYAGTQADPLNQKMVYQLVDGLRPAFHHTLDLTLFDVFSEALTTSREKFGTRKLSLEGRSQYFVAFDLDVGHPRLKAYFMPGLKSIESNTPVSELVVKAMDACELHFGSLFMQAFRRLNSDLEAFSATSYHRPEIEIVGIDCVSPVKSRAKIYIRHRGTSFDSVCRMLSMGAKAPLDAASVASLRELWALVLGLPKDFPSDQELPSVPHRTSGVLYYFEIKPTSDAIVPKVYIPVRHYASNDLSIAQGLATYFERRGQTVAAENYVDALSDIFSHRSLDSGLGLHTYISCTFKKTGLSVTSYFNPEIYHPNRYRQ,./data/raw/alphafold//AF-Q6Q874-F1-model_v4.pdb,1038,586,249,270
+1384,9182,9324,MSEQNNAVLPKGVTQGEFNKAVQKFRALLGDDNVLVESDQLVPYNKIMMPVENAAHAPSAAVTATTVEQVQGVVKICNEHKIPIWTISTGRNFGYGSAAPVQRGQVILDLKKMNKIIKIDPEMCYALVEPGVTFGQMYDYIQENNLPVMLSFSAPSAIAGPVGNTMDRGVGYTPYGEHFMMQCGMEVVLANGDVYRTGMGGVPGSNTWQIFKWGYGPTLDGMFTQANYGICTKMGFWLMPKPPVFKPFEVIFEDEADIVEIVDALRPLRMSNTIPNSVVIASTLWEAGSAHLTRAQYTTEPGHTPDSVIKQMQKDTGMGAWNLYAALYGTQEQVDVNWKIVTDVFKKLGKGRIVTQEEAGDTQPFKYRAQLMSGVPNLQEFGLYNWRGGGGSMWFAPVSEARGSECKKQAAMAKRVLHKYGLDYVAEFIVAPRDMHHVIDVLYDRTNPEETKRADACFNELLDEFEKEGYAVYRVNTRFQDRVAQSYGPVKRKLEHAIKRAVDPNNILAPGRSGIDLNNDF,uniprot_search,P09788,COS(=O)(=O)[O-].C[n+]1c2ccccc2nc2ccccc21.Cc1ccc(O)cc1.O>>CN1c2ccccc2Nc2ccccc21.COS(=O)(=O)O.OCc1ccc(O)cc1,121.0,0.0,25.0,8.65,1.17.9.1,303.0,2.0827853703164503,COS(=O)(=O)[O-].C[n+]1c2ccccc2nc2ccccc21.Cc1ccc(O)cc1.O,CN1c2ccccc2Nc2ccccc21.COS(=O)(=O)O.OCc1ccc(O)cc1,2.0827853703164503,COS(=O)(=O)[O-].C[n+]1c2ccccc2nc2ccccc21.Cc1ccc(O)cc1.O__MSEQNNAVLPKGVTQGEFNKAVQKFRALLGDDNVLVESDQLVPYNKIMMPVENAAHAPSAAVTATTVEQVQGVVKICNEHKIPIWTISTGRNFGYGSAAPVQRGQVILDLKKMNKIIKIDPEMCYALVEPGVTFGQMYDYIQENNLPVMLSFSAPSAIAGPVGNTMDRGVGYTPYGEHFMMQCGMEVVLANGDVYRTGMGGVPGSNTWQIFKWGYGPTLDGMFTQANYGICTKMGFWLMPKPPVFKPFEVIFEDEADIVEIVDALRPLRMSNTIPNSVVIASTLWEAGSAHLTRAQYTTEPGHTPDSVIKQMQKDTGMGAWNLYAALYGTQEQVDVNWKIVTDVFKKLGKGRIVTQEEAGDTQPFKYRAQLMSGVPNLQEFGLYNWRGGGGSMWFAPVSEARGSECKKQAAMAKRVLHKYGLDYVAEFIVAPRDMHHVIDVLYDRTNPEETKRADACFNELLDEFEKEGYAVYRVNTRFQDRVAQSYGPVKRKLEHAIKRAVDPNNILAPGRSGIDLNNDF,./data/raw/alphafold//AF-P09788-F1-model_v4.pdb,3393,3459,1204,3131
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+1400,6319,6429,MAHRPPSPALASVLLALLLSGAARAAEIVGGHEAQPHSRPYMASLQMRGNPGSHFCGGTLIHPSFVLTAAHCLRDIPQRLVNVVLGAHNVRTQEPTQQHFSVAQVFLNNYDAENKLNDVLLIQLSSPANLSASVATVQLPQQDQPVPHGTQCLAMGWGRVGAHDPPAQVLQELNVTVVTFFCRPHNICTFVPRRKAGICFGDSGGPLICDGIIQGIDSFVIWGCATRLFPDFFTRVALYVDWIRSTLRRVEAKGRP,uniprot_search,P24158,CCC(N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>,30.0,99.82805904452412,25.0,7.4,3.4.21.76,9606.0,1.4771212547196624,CCC(N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,,1.4771212547196624,CCC(N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MAHRPPSPALASVLLALLLSGAARAAEIVGGHEAQPHSRPYMASLQMRGNPGSHFCGGTLIHPSFVLTAAHCLRDIPQRLVNVVLGAHNVRTQEPTQQHFSVAQVFLNNYDAENKLNDVLLIQLSSPANLSASVATVQLPQQDQPVPHGTQCLAMGWGRVGAHDPPAQVLQELNVTVVTFFCRPHNICTFVPRRKAGICFGDSGGPLICDGIIQGIDSFVIWGCATRLFPDFFTRVALYVDWIRSTLRRVEAKGRP,./data/raw/alphafold//AF-P24158-F1-model_v4.pdb,1869,1572,3137,1906
+1401,19165,19451,MLNKAEQISEKSERAFVERFVNAGGVETRYLEAGKGQPVILIHGGGAGAESEGNWRNVIPILARHYRVIAMDMLGFGKTAKPDIEYTQDRRIRHLHDFIKAMNFDGKVSIVGNSMGGATGLGVSVLHSELVNALVLMGSAGLVVEIHEDLRPIINYDFTREGMVHLVKALTNDGFKIDDAMINSRYTYATDEATRKAYVATMQWIREQGGLFYDPEFIRKVQVPTLVVQGKDDKVVPVETAYKFLDLIDDSWGYIIPHCGHWAMIEHPEDFANATLSFLSLRVDTTRAAA,brenda,Q84II3,O.O=C(O)/C(O)=C/C=C/C(=O)c1ccccc1>>,1.99,99.57845571466513,25.0,7.5,3.7.1.13,213804.0,0.2988530764097066,O.O=C(O)/C(O)=C/C=C/C(=O)c1ccccc1,,0.2988530764097066,O.O=C(O)/C(O)=C/C=C/C(=O)c1ccccc1__MLNKAEQISEKSERAFVERFVNAGGVETRYLEAGKGQPVILIHGGGAGAESEGNWRNVIPILARHYRVIAMDMLGFGKTAKPDIEYTQDRRIRHLHDFIKAMNFDGKVSIVGNSMGGATGLGVSVLHSELVNALVLMGSAGLVVEIHEDLRPIINYDFTREGMVHLVKALTNDGFKIDDAMINSRYTYATDEATRKAYVATMQWIREQGGLFYDPEFIRKVQVPTLVVQGKDDKVVPVETAYKFLDLIDDSWGYIIPHCGHWAMIEHPEDFANATLSFLSLRVDTTRAAA,./data/raw/alphafold//AF-Q84II3-F1-model_v4.pdb,244,2766,5079,5939
+1402,1641,1671,MQLSFILTSSVFILLLEFVKASVISNPFKPNGNLKFKRGGGHNVAWDYDNNVIRGVNLGGWFVLEPYMTPSLFEPFQNGNDQSGVPVDEYHWTQTLGKEAASRILQKHWSTWITEQDFKQISNLGLNFVRIPIGYWAFQLLDNDPYVQGQVQYLEKALGWARKNNIRVWIDLHGAPGSQNGFDNSGLRDSYNFQNGDNTQVTLNVLNTIFKKYGGNEYSDVVIGIELLNEPLGPVLNMDKLKQFFLDGYNSLRQTGSVTPVIIHDAFQVFGYWNNFLTVAEGQWNVVVDHHHYQVFSGGELSRNINDHISVACNWGWDAKKESHWNVAGEWSAALTDCAKWLNGVNRGARYEGAYDNAPYIGSCQPMLDISQWSDEHKTDTRRYIEAQLDAFEYTGGWVFWSWKTENAPEWSFQTLTYNGLFPQPVTDRQFPNQCGFH,sabio,P29717,CC(=O)OC1C(C(C(OC1OCC2C(C(C(C(O2)O)O)O)O)COC3C(C(C(C(O3)CO)O)O)O)O)O.O>>,13.0,99.82316221330174,30.0,5.6,3.2.1.58,5476.0,1.1139433523068367,CC(=O)OC1C(C(C(OC1OCC2C(C(C(C(O2)O)O)O)O)COC3C(C(C(C(O3)CO)O)O)O)O)O.O,,1.1139433523068367,CC(=O)OC1C(C(C(OC1OCC2C(C(C(C(O2)O)O)O)O)COC3C(C(C(C(O3)CO)O)O)O)O)O.O__MQLSFILTSSVFILLLEFVKASVISNPFKPNGNLKFKRGGGHNVAWDYDNNVIRGVNLGGWFVLEPYMTPSLFEPFQNGNDQSGVPVDEYHWTQTLGKEAASRILQKHWSTWITEQDFKQISNLGLNFVRIPIGYWAFQLLDNDPYVQGQVQYLEKALGWARKNNIRVWIDLHGAPGSQNGFDNSGLRDSYNFQNGDNTQVTLNVLNTIFKKYGGNEYSDVVIGIELLNEPLGPVLNMDKLKQFFLDGYNSLRQTGSVTPVIIHDAFQVFGYWNNFLTVAEGQWNVVVDHHHYQVFSGGELSRNINDHISVACNWGWDAKKESHWNVAGEWSAALTDCAKWLNGVNRGARYEGAYDNAPYIGSCQPMLDISQWSDEHKTDTRRYIEAQLDAFEYTGGWVFWSWKTENAPEWSFQTLTYNGLFPQPVTDRQFPNQCGFH,./data/raw/alphafold//AF-P29717-F1-model_v4.pdb,1013,554,214,232
+1403,18285,18545,MKGRRRRRREYCKFALLLVLYTLVLLLVPSVLDGGRDGDKGAEHCPGLQRSLGVWSLEAAAAGEREQGAEARAAEEGGANQSPRFPSNLSGAVGEAVSREKQHIYVHATWRTGSSFLGELFNQHPDVFYLYEPMWHLWQALYPGDAESLQGALRDMLRSLFRCDFSVLRLYAPPGDPAARAPDTANLTTAALFRWRTNKVICSPPLCPGAPRARAEVGLVEDTACERSCPPVAIRALEAECRKYPVVVIKDVRLLDLGVLVPLLRDPGLNLKVVQLFRDPRAVHNSRLKSRQGLLRESIQVLRTRQRGDRFHRVLLAHGVGARPGGQSRALPAAPRADFFLTGALEVICEAWLRDLLFARGAPAWLRRRYLRLRYEDLVRQPRAQLRRLLRFSGLRALAALDAFALNMTRGAAYGADRPFHLSARDAREAVHAWRERLSREQVRQVEAACAPAMRLLAYPRSGEEGDAEQPREGETPLEMDADGAT,sabio,Q9NS84,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(OP(=O)(O)O)C1O,0.6,8.558692421991093,22.0,7.0,2.8.2.-,9606.0,-0.2218487496163563,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C(OP(=O)(O)O)C1O,-0.2218487496163563,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OS(=O)(=O)O)C(OP(=O)(O)O)C1O__MKGRRRRRREYCKFALLLVLYTLVLLLVPSVLDGGRDGDKGAEHCPGLQRSLGVWSLEAAAAGEREQGAEARAAEEGGANQSPRFPSNLSGAVGEAVSREKQHIYVHATWRTGSSFLGELFNQHPDVFYLYEPMWHLWQALYPGDAESLQGALRDMLRSLFRCDFSVLRLYAPPGDPAARAPDTANLTTAALFRWRTNKVICSPPLCPGAPRARAEVGLVEDTACERSCPPVAIRALEAECRKYPVVVIKDVRLLDLGVLVPLLRDPGLNLKVVQLFRDPRAVHNSRLKSRQGLLRESIQVLRTRQRGDRFHRVLLAHGVGARPGGQSRALPAAPRADFFLTGALEVICEAWLRDLLFARGAPAWLRRRYLRLRYEDLVRQPRAQLRRLLRFSGLRALAALDAFALNMTRGAAYGADRPFHLSARDAREAVHAWRERLSREQVRQVEAACAPAMRLLAYPRSGEEGDAEQPREGETPLEMDADGAT,./data/raw/alphafold//AF-Q9NS84-F1-model_v4.pdb,73,2553,2847,5695
+1404,15032,15243,MATLKDQLIYNLLKEEQTPQNKITVVGVGAVGMACAISILMKDLADELALVDVIEDKLKGEMMDLQHGSLFLRTPKIVSGKDYNVTANSKLVIITAGARQQEGESRLNLVQRNVNIFKFIIPNVVKYSPNCKLLIVSNPVDILTYVAWKISGFPKNRVIGSGCNLDSARFRYLMGERLGVHPLSCHGWVLGEHGDSSVPVWSGMNVAGVSLKTLHPDLGTDKDKEQWKEVHKQVVESAYEVIKLKGYTSWAIGLSVADLAESIMKNLRRVHPVSTMIKGLYGIKDDVFLSVPCILGQNGISDLVKVTLTSEEEARLKKSADTLWGIQKELQF,sabio,P00338,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)CO.[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@H](O)CO,1000000.0,7.372543836476332e-15,25.0,7.5,1.1.1.27,9606.0,6.0,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)CO.[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@H](O)CO,6.0,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)CO.[H]__MATLKDQLIYNLLKEEQTPQNKITVVGVGAVGMACAISILMKDLADELALVDVIEDKLKGEMMDLQHGSLFLRTPKIVSGKDYNVTANSKLVIITAGARQQEGESRLNLVQRNVNIFKFIIPNVVKYSPNCKLLIVSNPVDILTYVAWKISGFPKNRVIGSGCNLDSARFRYLMGERLGVHPLSCHGWVLGEHGDSSVPVWSGMNVAGVSLKTLHPDLGTDKDKEQWKEVHKQVVESAYEVIKLKGYTSWAIGLSVADLAESIMKNLRRVHPVSTMIKGLYGIKDDVFLSVPCILGQNGISDLVKVTLTSEEEARLKKSADTLWGIQKELQF,./data/raw/alphafold//AF-P00338-F1-model_v4.pdb,1282,5245,1636,773
+1405,3382,3430,MTTNAGPLHPYWPQHLRLDNFVPNDRPTWHILAGLFSVTGVLVVTTWLLSGRAAVVPLGTWRRLSLCWFAVCGFIHLVIEGWFVLYYEDLLGDQAFLSQLWKEYAKGDSRYILGDNFTVCMETITACLWGPLSLWVVIAFLRQHPLRFILQLVVSVGQIYGDVLYFLTEHRDGFQHGELGHPLYFWFYFVFMNALWLVLPGVLVLDAVKHLTHAQSTLDAKATKAKSKKN,sabio,Q15125,CC(C)=CCCC(C)C1CCC2C3=C(CCC21C)C1(C)CCC(O)CC1CC3>>CC(C)=CCCC(C)C1CCC2C3=CCC4CC(O)CCC4(C)C3CCC21C,0.423,7.379425423578467e-15,37.0,7.5,5.3.3.5,9606.0,-0.3736596326249576,CC(C)=CCCC(C)C1CCC2C3=C(CCC21C)C1(C)CCC(O)CC1CC3,CC(C)=CCCC(C)C1CCC2C3=CCC4CC(O)CCC4(C)C3CCC21C,-0.3736596326249576,CC(C)=CCCC(C)C1CCC2C3=C(CCC21C)C1(C)CCC(O)CC1CC3__MTTNAGPLHPYWPQHLRLDNFVPNDRPTWHILAGLFSVTGVLVVTTWLLSGRAAVVPLGTWRRLSLCWFAVCGFIHLVIEGWFVLYYEDLLGDQAFLSQLWKEYAKGDSRYILGDNFTVCMETITACLWGPLSLWVVIAFLRQHPLRFILQLVVSVGQIYGDVLYFLTEHRDGFQHGELGHPLYFWFYFVFMNALWLVLPGVLVLDAVKHLTHAQSTLDAKATKAKSKKN,./data/raw/alphafold//AF-Q15125-F1-model_v4.pdb,1767,1432,2483,1740
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+1420,18978,19263,MSTFARLFLCLVFFASLQPAMAQTEDGYDMWLRYQPIADQTLLKTYQKQIRHLHVAGDSPTINAAAAELQRGLSGLLNKPIVARDEKLKDYSLVIGTPDNSPLIASLNLGERLQALGAEGYLLEQTRINKRHVVIVAANSDVGVLYGSFHLLRLIQTQHALEKLSLSSAPRLQHRVVNHWDNLNRVVERGYAGLSLWDWGSLPNYLAPRYTDYARINASLGINGTVINNVNADPRVLSDQFLQKIAALADAFRPYGIKMYLSINFNSPRAFGDVDTADPLDPRVQQWWKTRAQKIYSYIPDFGGFLVKADSEGQPGPQGYGRDHAEGANMLAAALKPFGGVVFWRAFVYHPDIEDRFRGAYDEFMPLDGKFADNVILQIKNGPIDFQPREPFSALFAGMSRTNMMMEFQITQEYFGFATHLAYQGPLFEESLKTETHARGEGSTIGNILEGKVFKTRHTGMAGVINPGTDRNWTGHPFVQSSWYAFGRMAWDHQISAATAADEWLRMTFSNQPAFIEPVKQMMLVSREAGVNYRSPLGLTHLYSQGDHYGPAPWTDDLPRADWTAVYYHRASKTGIGFNRTKTGSNALAQYPEPIAKAWGDLNSVPEDLILWFHHLSWDHRMQSGRNLWQELVHKYYQGVEQVRAMQRTWDQQEAYVDAARFAQVKALLQVQEREAVRWRNSCVLYFQSVAGRPIPANYEQPEHDLEYYKMLARTTYVPEPWHPASSSRVLK,sabio,B3PC73,O>>CO[C@@H]([C@H](O)[C@@H](O)C=O)[C@H](O)C(=O)O.O=[N+]([O-])c1ccc(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1,143.0,92.570314161547,37.0,7.0,3.2.1.131,155077.0,2.155336037465062,O,CO[C@@H]([C@H](O)[C@@H](O)C=O)[C@H](O)C(=O)O.O=[N+]([O-])c1ccc(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)cc1,2.155336037465062,O__MSTFARLFLCLVFFASLQPAMAQTEDGYDMWLRYQPIADQTLLKTYQKQIRHLHVAGDSPTINAAAAELQRGLSGLLNKPIVARDEKLKDYSLVIGTPDNSPLIASLNLGERLQALGAEGYLLEQTRINKRHVVIVAANSDVGVLYGSFHLLRLIQTQHALEKLSLSSAPRLQHRVVNHWDNLNRVVERGYAGLSLWDWGSLPNYLAPRYTDYARINASLGINGTVINNVNADPRVLSDQFLQKIAALADAFRPYGIKMYLSINFNSPRAFGDVDTADPLDPRVQQWWKTRAQKIYSYIPDFGGFLVKADSEGQPGPQGYGRDHAEGANMLAAALKPFGGVVFWRAFVYHPDIEDRFRGAYDEFMPLDGKFADNVILQIKNGPIDFQPREPFSALFAGMSRTNMMMEFQITQEYFGFATHLAYQGPLFEESLKTETHARGEGSTIGNILEGKVFKTRHTGMAGVINPGTDRNWTGHPFVQSSWYAFGRMAWDHQISAATAADEWLRMTFSNQPAFIEPVKQMMLVSREAGVNYRSPLGLTHLYSQGDHYGPAPWTDDLPRADWTAVYYHRASKTGIGFNRTKTGSNALAQYPEPIAKAWGDLNSVPEDLILWFHHLSWDHRMQSGRNLWQELVHKYYQGVEQVRAMQRTWDQQEAYVDAARFAQVKALLQVQEREAVRWRNSCVLYFQSVAGRPIPANYEQPEHDLEYYKMLARTTYVPEPWHPASSSRVLK,./data/raw/alphafold//AF-B3PC73-F1-model_v4.pdb,264,2733,5045,5898
+1421,12376,12546,MANNSLEQKAEQVLAPLRLSKEKLQDLSKTFSDELLRGLEMHKRHGLKWVPEECSLRMLDSCVSEIPTGNEKGVFYALDFGGTNVRAVRCELLGGGRIRSQQFLKNLYECGGEIDLMARETSASQLFDVLAGCVGELVEENNEKELLKKKAAKLGFTFSFPCAQRSLNNSVLESWTKGFATGHDTDDPVVGKDVVPLLAAAFARQGLGLECEAVVNDTVGTLLSCAYQKGPGGPPCTVGVILGTGANCCYWEPQAAAFGYRGAVVNVECGNFNKNLPTTPADEAIDNKSPNKKHQLFEKMISGFYLGELVRLLTLEIFGAAAPAKAREEFSFDAKQAAVLAASLMPGKEEDPALASSCKVLLKESWGWDLDAAALKVMRQIGFAVFDRSAALAAVSIAVLVQRTRSLETDGGVTVAVDGSLYVRNEWYGLRIRTFLKELLGEKVDKVFLRAADDGSGKGAAICVAALH,brenda,A0A172WCE4,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O.OC[C@H]1OC(O)[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)O2)c(=O)nc1O.O=P(O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,219.0,0.0,36.0,9.0,2.7.1.1,5802.0,2.3404441148401185,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O.OC[C@H]1OC(O)[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)O2)c(=O)nc1O.O=P(O)(O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,2.3404441148401185,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O__MANNSLEQKAEQVLAPLRLSKEKLQDLSKTFSDELLRGLEMHKRHGLKWVPEECSLRMLDSCVSEIPTGNEKGVFYALDFGGTNVRAVRCELLGGGRIRSQQFLKNLYECGGEIDLMARETSASQLFDVLAGCVGELVEENNEKELLKKKAAKLGFTFSFPCAQRSLNNSVLESWTKGFATGHDTDDPVVGKDVVPLLAAAFARQGLGLECEAVVNDTVGTLLSCAYQKGPGGPPCTVGVILGTGANCCYWEPQAAAFGYRGAVVNVECGNFNKNLPTTPADEAIDNKSPNKKHQLFEKMISGFYLGELVRLLTLEIFGAAAPAKAREEFSFDAKQAAVLAASLMPGKEEDPALASSCKVLLKESWGWDLDAAALKVMRQIGFAVFDRSAALAAVSIAVLVQRTRSLETDGGVTVAVDGSLYVRNEWYGLRIRTFLKELLGEKVDKVFLRAADDGSGKGAAICVAALH,./data/raw/alphafold//AF-A0A172WCE4-F1-model_v4.pdb,66,4258,4139,3993
+1422,4692,4750,MASGSALIFDEEMSRYKLLWTDPACEIEVPERLTVSYEALRTHGLAQRCKAVPVRQATEQEILLAHSEEYLEAVKQTPGMNVEELMAFSKKYNDVYFHQNIYHCAKLAAGATLQLVDSVMKREVRNGMALVRPPGHHSQRSAANGFCVFNNVAIAALYAKKNYNLNRILIVDWDVHHGQGIQYCFEEDPSVLYFSWHRYEHQSFWPNLPESDYSSVGKGKGSGFNINLPWNKVGMTNSDYLAAFFHVLLPVAYEFDPELVIVSAGFDSAIGDPEGEMCALPEIFAHLTHLLMPLAAGKMCVVLEGGYNLTSLGQSVCQTVHSLLGDPTPRISGLGTACDSALESIQNVRNVQSSYWSSFKHLAQSETNPKRPRLDATNGGPKESSEPASESNPKKTAQDIVWPEPLKRMPASVRTVVVPPPGVELTLPKNCQHSGDISESTAKEVQRIRDKHFHDLTDQNILRSLGNIISVLDRMMRSDEVCNGCVVVSDLSVSVQCALQHALTEPAERVLVVYVGDGELPVKTNDGKVFLVQICTKETEDKCVNRLSLCLREGESLTAGFMQALLGLILPVAYEFNPALVLGIVGETAAKTGLMTVWGHMTCLIQGLARGRTLTLLQGYDKDLLELTVSALSGASISPLGPLRALKPEDVEMMEKQRQRLQERWGLLRCTVSES,brenda,F1QCV2,CC(O)=NCCCC[C@H](N=C(O)[C@H](C)N=C(C)O)C(O)=N[C@@H](C)C(=N)O.O>>,0.013,99.7438872284244,22.0,8.0,3.5.1.48,7955.0,-1.8860566476931635,CC(O)=NCCCC[C@H](N=C(O)[C@H](C)N=C(C)O)C(O)=N[C@@H](C)C(=N)O.O,,-1.8860566476931635,CC(O)=NCCCC[C@H](N=C(O)[C@H](C)N=C(C)O)C(O)=N[C@@H](C)C(=N)O.O__MASGSALIFDEEMSRYKLLWTDPACEIEVPERLTVSYEALRTHGLAQRCKAVPVRQATEQEILLAHSEEYLEAVKQTPGMNVEELMAFSKKYNDVYFHQNIYHCAKLAAGATLQLVDSVMKREVRNGMALVRPPGHHSQRSAANGFCVFNNVAIAALYAKKNYNLNRILIVDWDVHHGQGIQYCFEEDPSVLYFSWHRYEHQSFWPNLPESDYSSVGKGKGSGFNINLPWNKVGMTNSDYLAAFFHVLLPVAYEFDPELVIVSAGFDSAIGDPEGEMCALPEIFAHLTHLLMPLAAGKMCVVLEGGYNLTSLGQSVCQTVHSLLGDPTPRISGLGTACDSALESIQNVRNVQSSYWSSFKHLAQSETNPKRPRLDATNGGPKESSEPASESNPKKTAQDIVWPEPLKRMPASVRTVVVPPPGVELTLPKNCQHSGDISESTAKEVQRIRDKHFHDLTDQNILRSLGNIISVLDRMMRSDEVCNGCVVVSDLSVSVQCALQHALTEPAERVLVVYVGDGELPVKTNDGKVFLVQICTKETEDKCVNRLSLCLREGESLTAGFMQALLGLILPVAYEFNPALVLGIVGETAAKTGLMTVWGHMTCLIQGLARGRTLTLLQGYDKDLLELTVSALSGASISPLGPLRALKPEDVEMMEKQRQRLQERWGLLRCTVSES,./data/raw/alphafold//AF-F1QCV2-F1-model_v4.pdb,2960,1699,3311,2112
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+1424,16762,16992,MDIVVNDDLSCRFLEGFNTRDALCKKISMNTCDEGDPFFVADLGDIVRKHETWKKCLPRVTPFYAVKCNDDWRVLGTLAALGTGFDCASNTEIQRVRGIGVPPEKIIYANPCKQISHIRYARDSGVDVMTFDCVDELEKVAKTHPKAKMVLRISTDDSLARCRLSVKFGAKVEDCRFILEQAKKLNIDVTGVSFHVGSGSTDASTFAQAISDSRFVFDMGTELGFNMHILDIGGGFPGTRDAPLKFEEIAGVINNALEKHFPPDLKLTIVAEPGRYYVASAFTLAVNVIAKKVTPGVQTDVGAHAESNAQSFMYYVNDGVYGSFNCILYDHAVVRPLPQREPIPNEKLYPSSVWGPTCDGLDQIVERYYLPEMQVGEWLLFEDMGAYTVVGTSSFNGFQSPTIYYVVSGLPDHVVRELKSQKS,sabio,P07805,NCCCCC(N)C(=O)O>>NCCCCCN.O=C=O,2.2,0.0,37.0,8.0,4.1.1.17,5691.0,0.3424226808222063,NCCCCC(N)C(=O)O,NCCCCCN.O=C=O,0.3424226808222063,NCCCCC(N)C(=O)O__MDIVVNDDLSCRFLEGFNTRDALCKKISMNTCDEGDPFFVADLGDIVRKHETWKKCLPRVTPFYAVKCNDDWRVLGTLAALGTGFDCASNTEIQRVRGIGVPPEKIIYANPCKQISHIRYARDSGVDVMTFDCVDELEKVAKTHPKAKMVLRISTDDSLARCRLSVKFGAKVEDCRFILEQAKKLNIDVTGVSFHVGSGSTDASTFAQAISDSRFVFDMGTELGFNMHILDIGGGFPGTRDAPLKFEEIAGVINNALEKHFPPDLKLTIVAEPGRYYVASAFTLAVNVIAKKVTPGVQTDVGAHAESNAQSFMYYVNDGVYGSFNCILYDHAVVRPLPQREPIPNEKLYPSSVWGPTCDGLDQIVERYYLPEMQVGEWLLFEDMGAYTVVGTSSFNGFQSPTIYYVVSGLPDHVVRELKSQKS,./data/raw/alphafold//AF-P07805-F1-model_v4.pdb,2175,4395,4287,4162
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+1426,16162,16389,MSDQVSLGVVGIGKIARDQHLPAIDAEPGFKLTACASRHAEVTGVRNYRDLRALLAAERELDAVSLCAPPQVRYAQARAALEAGKHVMLEKPPGATLGEVAVLEALARERGLTLFATWHSRCASAVEPAREWLATRAIRAVQVRWKEDVRRWHPGQQWIWEPGGLGVFDPGINALSIVTRILPRELVLREATLIVPSDVQTPIAAELDCADTDGVPVRAEFDWRHGPVEQWEIAVDTADGVLAISRGGAQLSIAGEPVELGPEREYPALYAHFHALIARGESDVDVRPLRLVADAFLFGRRVQTDAFGR,sabio,Q53TZ2,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.OCC1OC(O)C(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=C1OC(C(O)CO)C(O)C1O.[H],71400.0,0.0,30.0,9.0,1.1.1.376,192.0,4.853698211776174,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.OCC1OC(O)C(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=C1OC(C(O)CO)C(O)C1O.[H],4.853698211776174,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.OCC1OC(O)C(O)C(O)C1O__MSDQVSLGVVGIGKIARDQHLPAIDAEPGFKLTACASRHAEVTGVRNYRDLRALLAAERELDAVSLCAPPQVRYAQARAALEAGKHVMLEKPPGATLGEVAVLEALARERGLTLFATWHSRCASAVEPAREWLATRAIRAVQVRWKEDVRRWHPGQQWIWEPGGLGVFDPGINALSIVTRILPRELVLREATLIVPSDVQTPIAAELDCADTDGVPVRAEFDWRHGPVEQWEIAVDTADGVLAISRGGAQLSIAGEPVELGPEREYPALYAHFHALIARGESDVDVRPLRLVADAFLFGRRVQTDAFGR,./data/raw/alphafold//AF-Q53TZ2-F1-model_v4.pdb,3804,3917,1753,3560
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+1434,3388,3436,MGSNAPPPPTPHVVLVPFPGQGHVAPLMQLARLLHARGARVTFVYTQYNYRRLLRAKGEAAVRPPATSSARFRIEVIDDGLSLSVPQNDVGGLVDSLRKNCLHPFRALLRRLGQEVEGQDAPPVTCVVGDVVMTFAAAAAREAGIPEVQFFTASACGLLGYLHYGELVERGLVPFRDASLLADDDYLDTPLEWVPGMSHMRLRDMPTFCRTTDPDDVMVSATLQQMESAAGSKALILNTLYELEKDVVDALAAFFPPIYTVGPLAEVIASSDSASAGLAAMDISIWQEDTRCLSWLDGKPAGSVVYVNFGSMAVMTAAQAREFALGLASCGSPFLWVKRPDVVEGEEVLLPEALLDEVARGRGLVVPWCPQAAVLKHAAVGLFVSHCGWNSLLEATAAGQPVLAWPCHGEQTTNCRQLCEVWGNGAQLPREVESGAVARLVREMMVGDLGKEKRAKAAEWKAAAEAAARKGGASWRNVERVVNDLLLVGGKQ,sabio,Q9SBL1,CC(C)=CCCC(C)CCO.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]1,0.09,28.23454508695329,30.0,7.5,2.4.1.85,4558.0,-1.0457574905606752,CC(C)=CCCC(C)CCO.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,CC(C)=CCCC(C)CCO.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
+1435,7985,8113,MSDCRTYGFNTQIVHAGQQPDPSTGALSTPIFQTSTFVFDSAEQGAARFALEESGYIYTRLGNPTTDALEKKLAVLERGEAGLATASGISAITTTLLTLCQQGDHIVSASAIYGCTHAFLSHSMPKFGINVRLVDAGKPEEIRAAMRPETKVVYIETPANPTLSLVDIETVAGIAHQQGALLVVDNTFMSPYCQQPLQLGADIVVHSVTKYINGHGDVIGGIIVGKQEFIDQARFVGLKDITGGCMSPFNAWLTLRGVKTLGIRMERHCENALKIARFLEGHPSITRVYYPGLSSHPQYELGQRQMSLPGGIISFEIAGGLEAGRRMINSVELCLLAVSLGDTETLIQHPASMTHSPVAPEERLKAGITDGLIRLSVGLEDPEDIINDLEHAIRKATF,brenda,Q84AR1,CCSCC[C@H](N)C(=O)O.O>>CCC(=O)C(=O)[O-].CCS.N,6.2,0.2780643630726139,30.0,8.0,4.4.1.11,546.0,0.7923916894982539,CCSCC[C@H](N)C(=O)O.O,CCC(=O)C(=O)[O-].CCS.N,0.8312296938670634,CCSCC[C@H](N)C(=O)O.O__MSDCRTYGFNTQIVHAGQQPDPSTGALSTPIFQTSTFVFDSAEQGAARFALEESGYIYTRLGNPTTDALEKKLAVLERGEAGLATASGISAITTTLLTLCQQGDHIVSASAIYGCTHAFLSHSMPKFGINVRLVDAGKPEEIRAAMRPETKVVYIETPANPTLSLVDIETVAGIAHQQGALLVVDNTFMSPYCQQPLQLGADIVVHSVTKYINGHGDVIGGIIVGKQEFIDQARFVGLKDITGGCMSPFNAWLTLRGVKTLGIRMERHCENALKIARFLEGHPSITRVYYPGLSSHPQYELGQRQMSLPGGIISFEIAGGLEAGRRMINSVELCLLAVSLGDTETLIQHPASMTHSPVAPEERLKAGITDGLIRLSVGLEDPEDIINDLEHAIRKATF,./data/raw/alphafold//AF-Q84AR1-F1-model_v4.pdb,2662,2241,3933,2809
+1436,701,720,MKYSKEYKEKTVVKINDVKFGEGFTIIAGPCSIESRDQIMKVAEFLAEVGIKVLRGGAFKPRTSPYSFQGYGEKALRWMREAADEYGLVTVTEVMDTRHVELVAKYSDILQIGARNSQNFELLKEVGKVENPVLLKRGMGNTIQELLYSAEYIMAQGNENVILCERGIRTFETATRFTLDISAVPVVKELSHLPIIVDPSHPAGRRSLVIPLAKAAYAIGADGIMVEVHPEPEKALSDSQQQLTFDDFLQLLKELEALGWKG,brenda,Q8U0A9,C=C(OP(=O)(O)O)C(=O)O.O.O=C[C@H](O)[C@H](O)COP(=O)(O)O>>O=C(O)C(=O)C[C@@H](O)[C@H](O)[C@H](O)COP(=O)(O)O.O=P(O)(O)O,3.0,0.0,60.0,6.8,2.5.1.54,2261.0,0.4771212547196624,C=C(OP(=O)(O)O)C(=O)O.O.O=C[C@H](O)[C@H](O)COP(=O)(O)O,O=C(O)C(=O)C[C@@H](O)[C@H](O)[C@H](O)COP(=O)(O)O.O=P(O)(O)O,0.7403626894942439,C=C(OP(=O)(O)O)C(=O)O.O.O=C[C@H](O)[C@H](O)COP(=O)(O)O__MKYSKEYKEKTVVKINDVKFGEGFTIIAGPCSIESRDQIMKVAEFLAEVGIKVLRGGAFKPRTSPYSFQGYGEKALRWMREAADEYGLVTVTEVMDTRHVELVAKYSDILQIGARNSQNFELLKEVGKVENPVLLKRGMGNTIQELLYSAEYIMAQGNENVILCERGIRTFETATRFTLDISAVPVVKELSHLPIIVDPSHPAGRRSLVIPLAKAAYAIGADGIMVEVHPEPEKALSDSQQQLTFDDFLQLLKELEALGWKG,./data/raw/alphafold//AF-Q8U0A9-F1-model_v4.pdb,1148,750,446,512
+1437,16039,16266,MVKICCIGAGYVGGPTMAVIALKCPSVEVAVVDISVPRINAWNSDQLPIYEPGLDDVVKQCRGKNLFFSTDVEKHVREADIVFVSVNTPTKTRGLGAGKAADLTYWESAARMIADVSVSDKIVVEKSTVPVKTAEAIEKILTHNSKGIKFQILSNPEFLAEGTAIEDLFMPDRVLIGGRETTEGFAAVKALKDIYAQWVPEERILTTNLWSAELSKLAANAFLAQRISSVNAMSALCEATGANVSEVSYAVGKDSRIGPKFLNSSVGFGGSCFQKDILNLVYICECNGLPEVAEYWKQVIKINDYQKTRFVNRIVSSMFNTVSNKKIAVLGFAFKKDTGDTRETPAIDVCKGLLGDKARLSIYDPQVTEEQIQRDLTMNKFDWDHPLHLQPMSPTTVKQVSVAWDAYTATKDAHGICILTEWDEFKKLDFQRIFENMQKPAFVFDGRNVVDADKLREIGFIVYSIGKPLDQWLKDMPALA,sabio,Q9LF33,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=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1>>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)C1OC(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)C(O)C(O)C1O.[H],2.52,0.0807532483554876,22.0,8.7,1.1.1.22,3702.0,0.4014005407815441,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=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1,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)C1OC(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)C(O)C(O)C1O.[H],0.4014005407815441,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=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C(O)C3O)C(O)C2O)c(=O)[nH]1__MVKICCIGAGYVGGPTMAVIALKCPSVEVAVVDISVPRINAWNSDQLPIYEPGLDDVVKQCRGKNLFFSTDVEKHVREADIVFVSVNTPTKTRGLGAGKAADLTYWESAARMIADVSVSDKIVVEKSTVPVKTAEAIEKILTHNSKGIKFQILSNPEFLAEGTAIEDLFMPDRVLIGGRETTEGFAAVKALKDIYAQWVPEERILTTNLWSAELSKLAANAFLAQRISSVNAMSALCEATGANVSEVSYAVGKDSRIGPKFLNSSVGFGGSCFQKDILNLVYICECNGLPEVAEYWKQVIKINDYQKTRFVNRIVSSMFNTVSNKKIAVLGFAFKKDTGDTRETPAIDVCKGLLGDKARLSIYDPQVTEEQIQRDLTMNKFDWDHPLHLQPMSPTTVKQVSVAWDAYTATKDAHGICILTEWDEFKKLDFQRIFENMQKPAFVFDGRNVVDADKLREIGFIVYSIGKPLDQWLKDMPALA,./data/raw/alphafold//AF-Q9LF33-F1-model_v4.pdb,2338,5085,2199,5077
+1438,16588,16817,MPKIAVLGAGINGIASALAIQERLPNCEVTIIAEKFSPNTTSDVAAGLIEPFLCDDDVDRIINWTSATISRIHEYQADGNPGAEEQSGYWLQSVKSEPKWLKLMKNVHILTDAEMKQVARRPEHKFGIFYTTWYLEPTPYIKWCTDKFLKNGGKFKKQKIENIDDVARSYDVTVNCTGLGSRALIGDKEVYPTRGQILKVSCPRVKHFFIDDKYYALLNDSTITLGGTFEAHQWDLTINSELSQKILKENIHNIPSLRTAQILSSHVDMRPSRGTVRLQAELGRSLVHNYGHGGSGITLHWGCALECAEIVENVLKMKKSKL,sabio,Q95XG9,NC(Cc1ccccc1)C(=O)O.O.O=O>>N.O=C(O)C(=O)Cc1ccccc1.OO,25.1,1.9764291113143416e-14,37.0,8.3,1.4.3.3,6239.0,1.3996737214810382,NC(Cc1ccccc1)C(=O)O.O.O=O,N.O=C(O)C(=O)Cc1ccccc1.OO,1.3996737214810382,NC(Cc1ccccc1)C(=O)O.O.O=O__MPKIAVLGAGINGIASALAIQERLPNCEVTIIAEKFSPNTTSDVAAGLIEPFLCDDDVDRIINWTSATISRIHEYQADGNPGAEEQSGYWLQSVKSEPKWLKLMKNVHILTDAEMKQVARRPEHKFGIFYTTWYLEPTPYIKWCTDKFLKNGGKFKKQKIENIDDVARSYDVTVNCTGLGSRALIGDKEVYPTRGQILKVSCPRVKHFFIDDKYYALLNDSTITLGGTFEAHQWDLTINSELSQKILKENIHNIPSLRTAQILSSHVDMRPSRGTVRLQAELGRSLVHNYGHGGSGITLHWGCALECAEIVENVLKMKKSKL,./data/raw/alphafold//AF-Q95XG9-F1-model_v4.pdb,2943,1677,3287,2085
+1439,10992,11147,MVLIRVLANLLILQLSYAQKSSELVIGGDECNINEHRFLVALYDYWSQSFLCGGTLINEEWVLTAKHCDRTHILIYVGVHDRSVQFDKEQRRFPKEKYFFDCSNNFTKWDKDIMLIRLNKPVSYSEHIAPLSLPSSPPIVGSVCRAMGWGQTTSPQETLPDVPHCANINLLDYEVCRTAHPQFRLPATSRTLCAGVLEGGIDTCNRDSGGPLICNGQFQGIVFWGPDPCAQPDKPGLYTKVFDHLDWIQSIIAGEKTVNCPP,uniprot_search,F8S114,C[C@H](N=C(O)[C@H](N)CC1CCC(O)CC1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>C[C@H](N=C(O)[C@H](N)CC1CCC(O)CC1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,0.95,1.0276627657508775e-14,27.0,7.5,3.4.21.74,8729.0,-0.0222763947111522,C[C@H](N=C(O)[C@H](N)CC1CCC(O)CC1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,C[C@H](N=C(O)[C@H](N)CC1CCC(O)CC1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,-0.0222763947111522,C[C@H](N=C(O)[C@H](N)CC1CCC(O)CC1)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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+1442,166,174,MVRLKSRYILFEIIFPPTDTNVEESVSKADILLSHHRASPADVSIKSILQEIRRSLSLNLGDYGSAKCNSLLQLKYFSNKTSTGIIRCHREDCDLVIMALMLMSKIGDVDGLIVNPVKVSGTIKKIEQFAMRRNSKILNIIKCSQSSHLSDNDFIINDFKKIGRENENENEDD,uniprot_search,A0A6A5PUA5,*C1OC(COP(=O)(O)OC2C(COP(=O)(O)OC3C(CO)OC(*)C3O)OC(*)C2O)C(O)C1O.O>>*C1CC(O)C(COP(=O)(O)OC2CC(*)OC2COP(=O)(O)OC2CC(*)OC2CO)O1.*C1OC(COP(=O)(O)OC2C(COP(=O)(O)OC3C(CO)OC(*)C3O)OC(*)C2O)C(O)C1O,1.14,29.6763144351808,37.0,7.9,3.1.26.5,4932.0,0.0569048513364725,*C1OC(COP(=O)(O)OC2C(COP(=O)(O)OC3C(CO)OC(*)C3O)OC(*)C2O)C(O)C1O.O,*C1CC(O)C(COP(=O)(O)OC2CC(*)OC2COP(=O)(O)OC2CC(*)OC2CO)O1.*C1OC(COP(=O)(O)OC2C(COP(=O)(O)OC3C(CO)OC(*)C3O)OC(*)C2O)C(O)C1O,0.1139433523068367,*C1OC(COP(=O)(O)OC2C(COP(=O)(O)OC3C(CO)OC(*)C3O)OC(*)C2O)C(O)C1O.O__MVRLKSRYILFEIIFPPTDTNVEESVSKADILLSHHRASPADVSIKSILQEIRRSLSLNLGDYGSAKCNSLLQLKYFSNKTSTGIIRCHREDCDLVIMALMLMSKIGDVDGLIVNPVKVSGTIKKIEQFAMRRNSKILNIIKCSQSSHLSDNDFIINDFKKIGRENENENEDD,./data/raw/alphafold//AF-A0A6A5PUA5-F1-model_v4.pdb,959,484,125,133
+1443,18062,18316,MAQTPAFDKPKVELHVHLDGSIKPETILYYGRRRGIALPANTAEGLLNVIGMDKPLTLPDFLAKFDYYMPAIAGCREAIKRIAYEFVEMKAKEGVVYVEVRYSPHLLANSKVEPIPWNQAEGDLTPDEVVALVGQGLQEGERDFGVKARSILCCMRHQPNWSPKVVELCKKYQQQTVVAIDLAGDETIPGSSLLPGHVQAYQEAVKSGIHRTVHAGEVGSAEVVKEAVDILKTERLGHGYHTLEDQALYNRLRQENMHFEICPWSSYLTGAWKPDTEHAVIRLKNDQANYSLNTDDPLIFKSTLDTDYQMTKRDMGFTEEEFKRLNINAAKSSFLPEDEKRELLDLLYKAYGMPPSASAGQNL,sabio,P00813,Nc1ncnc2c1ncn2C1OC(CO)C(O)C1O.O>>N.O=c1[nH]cnc2c1ncn2C1OC(CO)C(O)C1O,80.04,0.0,,,3.5.4.4,9606.0,1.9033070799641736,Nc1ncnc2c1ncn2C1OC(CO)C(O)C1O.O,N.O=c1[nH]cnc2c1ncn2C1OC(CO)C(O)C1O,1.9033070799641736,Nc1ncnc2c1ncn2C1OC(CO)C(O)C1O.O__MAQTPAFDKPKVELHVHLDGSIKPETILYYGRRRGIALPANTAEGLLNVIGMDKPLTLPDFLAKFDYYMPAIAGCREAIKRIAYEFVEMKAKEGVVYVEVRYSPHLLANSKVEPIPWNQAEGDLTPDEVVALVGQGLQEGERDFGVKARSILCCMRHQPNWSPKVVELCKKYQQQTVVAIDLAGDETIPGSSLLPGHVQAYQEAVKSGIHRTVHAGEVGSAEVVKEAVDILKTERLGHGYHTLEDQALYNRLRQENMHFEICPWSSYLTGAWKPDTEHAVIRLKNDQANYSLNTDDPLIFKSTLDTDYQMTKRDMGFTEEEFKRLNINAAKSSFLPEDEKRELLDLLYKAYGMPPSASAGQNL,./data/raw/alphafold//AF-P00813-F1-model_v4.pdb,2,2468,2748,5592
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+1476,9382,9524,MAAKSCQDGHPAEAFGWAARDHSGVLSPFKFSRRATGEKDVAIKVLFCGICHSDLHMIKNEWGISSYPVVPGHEIVGQVTGVGSKVEKFKVGDKVGVGYMVGSCQSCDSCHDDLENYCPETIVTSGGKYHDGATTYGGFSDIMVADEHYVIRIPENLPLDAGAPLLCAGITVYSPLKYYGLDKPGMHVGVVGLGGLGHVAVKFAKAMGIKVTVISTSPKKKQEALEHLGAHSFLVSRDPDQMQAAMGTMDGIIDTVSTMHPLFPLIGLLKTQGKLVLVGAPEKPLELPVFPLITGRKIVGGSSIGGIKETQEMIDFAAKNDITADVEVIPMDYVNTALERLSKSDVRYRFVIDIGNTLKI,brenda,T1WW77,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)c1,8.68,6.1444373552412666e-15,30.0,6.0,1.1.1.195,118781.0,0.9385197251764918,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)c1,0.9385197251764918,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+]__MAAKSCQDGHPAEAFGWAARDHSGVLSPFKFSRRATGEKDVAIKVLFCGICHSDLHMIKNEWGISSYPVVPGHEIVGQVTGVGSKVEKFKVGDKVGVGYMVGSCQSCDSCHDDLENYCPETIVTSGGKYHDGATTYGGFSDIMVADEHYVIRIPENLPLDAGAPLLCAGITVYSPLKYYGLDKPGMHVGVVGLGGLGHVAVKFAKAMGIKVTVISTSPKKKQEALEHLGAHSFLVSRDPDQMQAAMGTMDGIIDTVSTMHPLFPLIGLLKTQGKLVLVGAPEKPLELPVFPLITGRKIVGGSSIGGIKETQEMIDFAAKNDITADVEVIPMDYVNTALERLSKSDVRYRFVIDIGNTLKI,./data/raw/alphafold//AF-T1WW77-F1-model_v4.pdb,3542,3496,1240,3173
+1477,16885,17115,MGSKRGISSRHHSLSSYEIMFAALFAILVVLCAGLIAVSCLTIKESQRGAALGQSHEARATFKITSGVTYNPNLQDKLSVDFKVLAFDLQQMIDEIFLSSNLKNEYKNSRVLQFENGSIIVVFDLFFAQWVSDENVKEELIQGLEANKSSQLVTFHIDLNSVDILDKLTTTSHLATPGNVSIECLPGSSPCTDALTCIKADLFCDGEVNCPDGSDEDNKMCATVCDGRFLLTGSSGSFQATHYPKPSETSVVCQWIIRVNQGLSIKLSFDDFNTYYTDILDIYEGVGSSKILRASIWETNPGTIRIFSNQVTATFLIESDESDYVGFNATYTAFNSSELNNYEKINCNFEDGFCFWVQDLNDDNEWERIQGSTFSPFTGPNFDHTFGNASGFYISTPTGPGGRQERVGLLSLPLDPTLEPACLSFWYHMYGENVHKLSINISNDQNMEKTVFQKEGNYGDNWNYGQVTLNETVKFKVAFNAFKNKILSDIALDDISLTYGICNGSLYPEPTLVPTPPPELPTDCGGPFELWEPNTTFSSTNFPNSYPNLAFCVWILNAQKGKNIQLHFQEFDLENINDVVEIRDGEEADSLLLAVYTGPGPVKDVFSTTNRMTVLLITNDVLARGGFKANFTTGYHLGIPEPCKADHFQCKNGECVPLVNLCDGHLHCEDGSDEADCVRFFNGTTNNNGLVRFRIQSIWHTACAENWTTQISNDVCQLLGLGSGNSSKPIFPTDGGPFVKLNTAPDGHLILTPSQQCLQDSLIRLQCNHKSCGKKLAAQDITPKIVGGSNAKEGAWPWVVGLYYGGRLLCGASLVSSDWLVSAAHCVYGRNLEPSKWTAILGLHMKSNLTSPQTVPRLIDEIVINPHYNRRRKDNDIAMMHLEFKVNYTDYIQPICLPEENQVFPPGRNCSIAGWGTVVYQGTTANILQEADVPLLSNERCQQQMPEYNITENMICAGYEEGGIDSCQGDSGGPLMCQENNRWFLAGVTSFGYKCALPNRPGVYARVSRFTEWIQSFLH,brenda,P98073,NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,45.0,7.085764361497845e-15,22.0,8.0,3.4.21.9,9606.0,1.6532125137753435,NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,2.130333768495006,NCCCC[C@H](N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)[C@H](CC(=O)O)N=C(O)CN)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MGSKRGISSRHHSLSSYEIMFAALFAILVVLCAGLIAVSCLTIKESQRGAALGQSHEARATFKITSGVTYNPNLQDKLSVDFKVLAFDLQQMIDEIFLSSNLKNEYKNSRVLQFENGSIIVVFDLFFAQWVSDENVKEELIQGLEANKSSQLVTFHIDLNSVDILDKLTTTSHLATPGNVSIECLPGSSPCTDALTCIKADLFCDGEVNCPDGSDEDNKMCATVCDGRFLLTGSSGSFQATHYPKPSETSVVCQWIIRVNQGLSIKLSFDDFNTYYTDILDIYEGVGSSKILRASIWETNPGTIRIFSNQVTATFLIESDESDYVGFNATYTAFNSSELNNYEKINCNFEDGFCFWVQDLNDDNEWERIQGSTFSPFTGPNFDHTFGNASGFYISTPTGPGGRQERVGLLSLPLDPTLEPACLSFWYHMYGENVHKLSINISNDQNMEKTVFQKEGNYGDNWNYGQVTLNETVKFKVAFNAFKNKILSDIALDDISLTYGICNGSLYPEPTLVPTPPPELPTDCGGPFELWEPNTTFSSTNFPNSYPNLAFCVWILNAQKGKNIQLHFQEFDLENINDVVEIRDGEEADSLLLAVYTGPGPVKDVFSTTNRMTVLLITNDVLARGGFKANFTTGYHLGIPEPCKADHFQCKNGECVPLVNLCDGHLHCEDGSDEADCVRFFNGTTNNNGLVRFRIQSIWHTACAENWTTQISNDVCQLLGLGSGNSSKPIFPTDGGPFVKLNTAPDGHLILTPSQQCLQDSLIRLQCNHKSCGKKLAAQDITPKIVGGSNAKEGAWPWVVGLYYGGRLLCGASLVSSDWLVSAAHCVYGRNLEPSKWTAILGLHMKSNLTSPQTVPRLIDEIVINPHYNRRRKDNDIAMMHLEFKVNYTDYIQPICLPEENQVFPPGRNCSIAGWGTVVYQGTTANILQEADVPLLSNERCQQQMPEYNITENMICAGYEEGGIDSCQGDSGGPLMCQENNRWFLAGVTSFGYKCALPNRPGVYARVSRFTEWIQSFLH,./data/raw/alphafold//AF-P98073-F1-model_v4.pdb,1919,5255,2511,5329
+1478,3415,3463,MAVVYYLLLAGLIACSHALAAGTPALGDDRGRPWPASLAALALDGKLRTDSNATAAASTDFGNITSALPAAVLYPSSTGDLVALLSAANSTPGWPYTIAFRGRGHSLMGQAFAPGGVVVNMASLGDAAAPPRINVSADGRYVDAGGEQVWIDVLRASLARGVAPRSWNDYLYLTVGGTLSNAGISGQAFRHGPQISNVLEMDVITGHGEMVTCSKQLNADLFDAVLGGLGQFGVITRARIAVEPAPARARWVRFVYTDFAAFSADQERLTAPRPGGGGASFGPMSYVEGSVFVNQSLATDLANTGFFTDADVARIVALAGERNATTVYSIEATLNYDNATAAAAAVDQELASVLGTLSYVEGFAFQRDVAYAAFLDRVHGEEVALNKLGLWRVPHPWLNMFVPRSRIADFDRGVFKGILQGTDIVGPLIVYPLNKSMWDDGMSAATPSEDVFYAVSLLFSSVAPNDLARLQEQNRRILRFCDLAGIQYKTYLARHTDRSDWVRHFGAAKWNRFVEMKNKYDPKRLLSPGQDIFN,brenda,Q9T0N8,CC(C)=CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O.COc1ccccc1O.O>>CC(C)=CC=O.COC1C=CCCC1=O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,62.0,0.0,30.0,7.4,1.5.99.12,4577.0,1.792391689498254,CC(C)=CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O.COc1ccccc1O.O,CC(C)=CC=O.COC1C=CCCC1=O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O,2.1132746924643504,CC(C)=CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O.COc1ccccc1O.O__MAVVYYLLLAGLIACSHALAAGTPALGDDRGRPWPASLAALALDGKLRTDSNATAAASTDFGNITSALPAAVLYPSSTGDLVALLSAANSTPGWPYTIAFRGRGHSLMGQAFAPGGVVVNMASLGDAAAPPRINVSADGRYVDAGGEQVWIDVLRASLARGVAPRSWNDYLYLTVGGTLSNAGISGQAFRHGPQISNVLEMDVITGHGEMVTCSKQLNADLFDAVLGGLGQFGVITRARIAVEPAPARARWVRFVYTDFAAFSADQERLTAPRPGGGGASFGPMSYVEGSVFVNQSLATDLANTGFFTDADVARIVALAGERNATTVYSIEATLNYDNATAAAAAVDQELASVLGTLSYVEGFAFQRDVAYAAFLDRVHGEEVALNKLGLWRVPHPWLNMFVPRSRIADFDRGVFKGILQGTDIVGPLIVYPLNKSMWDDGMSAATPSEDVFYAVSLLFSSVAPNDLARLQEQNRRILRFCDLAGIQYKTYLARHTDRSDWVRHFGAAKWNRFVEMKNKYDPKRLLSPGQDIFN,./data/raw/alphafold//AF-Q9T0N8-F1-model_v4.pdb,1034,580,242,262
+1479,18996,19281,MTNVNAEIGRMVLAGGIETNLHDVGAGNPVVLVHGSGPGVTAWANWRTVMPELSRHRRVIAPDMVGFGFTQRPHGIHYGVESWVAHLAGILDALELDRVDLVGNSFGGALSLAFAIRFPHRVRRLVLMGAVGVSFELTDGLDAVWGYEPSVPNMRKVMDYFAYDRSLVSDELAELRYKASTRPGFQEAFASMFPAPRQRWVDALASSDQDIRDIRHETLILHGRDDRVIPLETSLRLNQLIEPSQLHVFGRCGHWVQIEQNRGFIRLVNDFLAAED,sabio,P23133,O>>C=CC=C(O)C(=O)O.CC(=O)O,35.0,80.83005896452293,24.9,7.5,3.1.1.-,303.0,1.5440680443502757,O,C=CC=C(O)C(=O)O.CC(=O)O,1.5440680443502757,O__MTNVNAEIGRMVLAGGIETNLHDVGAGNPVVLVHGSGPGVTAWANWRTVMPELSRHRRVIAPDMVGFGFTQRPHGIHYGVESWVAHLAGILDALELDRVDLVGNSFGGALSLAFAIRFPHRVRRLVLMGAVGVSFELTDGLDAVWGYEPSVPNMRKVMDYFAYDRSLVSDELAELRYKASTRPGFQEAFASMFPAPRQRWVDALASSDQDIRDIRHETLILHGRDDRVIPLETSLRLNQLIEPSQLHVFGRCGHWVQIEQNRGFIRLVNDFLAAED,./data/raw/alphafold//AF-P23133-F1-model_v4.pdb,222,2740,5052,5909
+1480,6828,6943,MSPSKESDELIFFVNGKKVTERNADPEVNLLFYLRKVIRLTGTKYGCGGGDCGACTVMISRYDPISKRISHFSATACLVPICSLHGAAVTTVEGIGSTKTRIHPVQERIAKGHGTQCGFCTPGMVMSIYTLLRNHPEPSTEQIMETLGGNLCRCTGYRPIVESAKSFCPSSTCCQMNGEGKCCLDEEKNEPERKNSVCTKLYEKKEFQPLDPTQELIFPPELMRMAEESQNTVLTFRGERTTWIAPGTLNDLLELKMKHPSAPLVIGNTYLGLHMKFTDVSYPIIISPARILELFVVTNTKQGLTLGAGLSLTQVKNVLSDVVSRLPKEKTQIYCALLKQLKTLAGQQIRNVASLGGHIISRLPTSDLNPILGIGNCILNVASTEGIQQIPLNDHFLAGVPDAILKPEQVLISVFVPRSSKWEFVSAFRQAPRQQNAFATVNAGMKVVFKEDTNTITDLGILYGGIGATVISADKSCRQLIGRCWDEEMLDDAGKMICEEVSLLMAAPGGMEEYRKTLAISFLFMFYLDVLKQLKTRDPHKYPDISQKLLHILEDFPLTMPYGMQSFQDVDFQQPLQDPIGRPIMHQSGIKHATGEAVFCDDMSVLPGELFLAVVTSSKSHAKIISLDASEALASLGVVDVVTARDVPGDNGREEESLYAQDEVICVGQIVCAVAADSYAHAQQAAKKVKIVYQDIEPMIVTVQDALQYESFIGPERKLEQGNVEEAFQCADQILEGEVHLGGQEHFYMETQSVRVVPKGEDKEMDIYVSSQDAAFTQEMVARTLGIPKNRINCHVKRVGGAFGGKASKPGLLASVAAVAAQKTGRPIRFILERRDDMLITGGRHPLLGKYKIGFMNNGKIKAADIQLYINGGCTPDDSELVIEYALLKLENAYKIPNLRVRGRVCKTNLPSNTAFRGFGFPQGAFVTETCMSAVAAKCRLPPEKVRELNMYRTIDRTIHNQEFDPTNLLQCWEACVENSSYYNRKKAVDEFNQQRFWKKRGIAIIPMKFSVGFPKTFYYQAAALVQIYTDGSVLVAHGGVELGQGINTKMIQVASRELKIPMSYIHLDEMSTVTVPNTVTTGASTGADVNGRAVQNACQILMKRLEPIIKQNPSGTWEEWVKEAFVQSISLSATGYFRGYQADMDWEKGEGDIFPYFVFGAACSEVEIDCLTGAHKNIRTDIVMDGSFSINPAVDIGQIEGAFVQGLGLYTLEELKYSPEGVLYTRGPHQYKIASVTDIPEEFHVSLLTPTPNPKAIYSSKGLGEAGTFLGCSVFFAIAAAVAAAREERGLSPIWAINSPATAEVIRMACEDQFTNLVPQTDSKCCKPWSIPVA,brenda,G3X982,CCCCC=O.O.O=O>>CCCCC(=O)O.OO,1.53,0.0,37.0,8.0,1.2.3.1,10090.0,0.1846914308175988,CCCCC=O.O.O=O,CCCCC(=O)O.OO,0.1846914308175988,CCCCC=O.O.O=O__MSPSKESDELIFFVNGKKVTERNADPEVNLLFYLRKVIRLTGTKYGCGGGDCGACTVMISRYDPISKRISHFSATACLVPICSLHGAAVTTVEGIGSTKTRIHPVQERIAKGHGTQCGFCTPGMVMSIYTLLRNHPEPSTEQIMETLGGNLCRCTGYRPIVESAKSFCPSSTCCQMNGEGKCCLDEEKNEPERKNSVCTKLYEKKEFQPLDPTQELIFPPELMRMAEESQNTVLTFRGERTTWIAPGTLNDLLELKMKHPSAPLVIGNTYLGLHMKFTDVSYPIIISPARILELFVVTNTKQGLTLGAGLSLTQVKNVLSDVVSRLPKEKTQIYCALLKQLKTLAGQQIRNVASLGGHIISRLPTSDLNPILGIGNCILNVASTEGIQQIPLNDHFLAGVPDAILKPEQVLISVFVPRSSKWEFVSAFRQAPRQQNAFATVNAGMKVVFKEDTNTITDLGILYGGIGATVISADKSCRQLIGRCWDEEMLDDAGKMICEEVSLLMAAPGGMEEYRKTLAISFLFMFYLDVLKQLKTRDPHKYPDISQKLLHILEDFPLTMPYGMQSFQDVDFQQPLQDPIGRPIMHQSGIKHATGEAVFCDDMSVLPGELFLAVVTSSKSHAKIISLDASEALASLGVVDVVTARDVPGDNGREEESLYAQDEVICVGQIVCAVAADSYAHAQQAAKKVKIVYQDIEPMIVTVQDALQYESFIGPERKLEQGNVEEAFQCADQILEGEVHLGGQEHFYMETQSVRVVPKGEDKEMDIYVSSQDAAFTQEMVARTLGIPKNRINCHVKRVGGAFGGKASKPGLLASVAAVAAQKTGRPIRFILERRDDMLITGGRHPLLGKYKIGFMNNGKIKAADIQLYINGGCTPDDSELVIEYALLKLENAYKIPNLRVRGRVCKTNLPSNTAFRGFGFPQGAFVTETCMSAVAAKCRLPPEKVRELNMYRTIDRTIHNQEFDPTNLLQCWEACVENSSYYNRKKAVDEFNQQRFWKKRGIAIIPMKFSVGFPKTFYYQAAALVQIYTDGSVLVAHGGVELGQGINTKMIQVASRELKIPMSYIHLDEMSTVTVPNTVTTGASTGADVNGRAVQNACQILMKRLEPIIKQNPSGTWEEWVKEAFVQSISLSATGYFRGYQADMDWEKGEGDIFPYFVFGAACSEVEIDCLTGAHKNIRTDIVMDGSFSINPAVDIGQIEGAFVQGLGLYTLEELKYSPEGVLYTRGPHQYKIASVTDIPEEFHVSLLTPTPNPKAIYSSKGLGEAGTFLGCSVFFAIAAAVAAAREERGLSPIWAINSPATAEVIRMACEDQFTNLVPQTDSKCCKPWSIPVA,./data/raw/alphafold//AF-G3X982-F1-model_v4.pdb,1051,609,279,306
+1481,17612,17854,MHLSKISAFLTPVLNAAAVLSSQAPADDLSVLSSEVARANNQSLLWGPYKPNLYFGVRPRIPNSLFAGLMWAKVDNYATAQQNFRHTCEQNEGMAGYGWDEYDIRKGGRQTIHDAGNSLDLTIDFVKVPGGQHGGSWAARVKGVPREDADPDQPTAVVFYAGLEGLGNLGVEGEPEDTHGFAGDVKLGGFTTDLGDFSIDVTSGPESNESPEHGHPTYDEKPLDRTLVSSLTMHPEQLWQTKVIMFTQMKKEVDEMVEKYGSENPPPPYQLFTIKNEPGDGNMHLVQKVFKGSFEFDILFSSKSSPQPMTSELLTEQISSASLEFAERFESVHPPQAPFDTAEYTEFSKSMLSNLVGGIGYFHGTDIVDRSAAPEYDEENEGFWEETAEARGRAQPILEGPKDLFTCVPSRPFFPRGFLWDEGFHLIPVIDWDTDLALEIVRSWLNLMDEDGWIAREQILGSEARSKVPPEFTIQYPHYANPPTLFIILEAFIDKLDAKKNASMQTYADSGATDGLRSIFVDQPELGEAFIRSIYPLIPKHYYWYRSTQKGDIKSYDREAYSTREAYRWRGRSVQHILTSGLDDYPRPQPPHPGELHVDLMSWMGMMTRALRRIAVTIGETEDAEVFKTYETAIERNIDDLHWDDDASTYCDATIDEYEEHVHVCHKGYISIFPFLTGMLGPDSPRLKAILDLIGDPEELWSDYGIRSLSKKDQFYGTAENYWRSPIWVNINYLVLKNLYNIAIVSGPHREQARELYSNLRKNLVENVFQEWKKTGFAWEQYNPETGIGRRTQHFTGWTSMVVKMMSMPDLPASEQKGHDEL,brenda,G1UJA9,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]4O[C@H](CO[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H](O)[C@H](O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H]4O)[C@@H](O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O[C@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)[C@H]5O)[C@@H]4O)[C@@H]3O)[C@H](O)[C@H]2N)[C@@H](CO)O[C@H]1Nc1ccccn1.O>>CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CCC(C)CCOP(=O)(O)OP(=O)(O)O[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO[C@H]4O[C@H](CO[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H](O)[C@@H](O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H]4O)[C@@H](O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H]5O)[C@@H]4O)[C@@H]3O)[C@H](O)[C@H]2N=C(C)O)[C@H](O)[C@H]1N=C(C)O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,1450.0,24.347361018379942,25.0,7.0,3.2.1.106,319629.0,3.161368002234975,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]4O[C@H](CO[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H](O)[C@H](O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H]4O)[C@@H](O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O[C@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)[C@H]5O)[C@@H]4O)[C@@H]3O)[C@H](O)[C@H]2N)[C@@H](CO)O[C@H]1Nc1ccccn1.O,CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CCC(C)CCOP(=O)(O)OP(=O)(O)O[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO[C@H]4O[C@H](CO[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H](O)[C@@H](O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H]4O)[C@@H](O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H]5O)[C@@H]4O)[C@@H]3O)[C@H](O)[C@H]2N=C(C)O)[C@H](O)[C@H]1N=C(C)O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,3.161368002234975,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]4O[C@H](CO[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H](O)[C@H](O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H]4O)[C@@H](O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O[C@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)[C@H]5O)[C@@H]4O)[C@@H]3O)[C@H](O)[C@H]2N)[C@@H](CO)O[C@H]1Nc1ccccn1.O__MHLSKISAFLTPVLNAAAVLSSQAPADDLSVLSSEVARANNQSLLWGPYKPNLYFGVRPRIPNSLFAGLMWAKVDNYATAQQNFRHTCEQNEGMAGYGWDEYDIRKGGRQTIHDAGNSLDLTIDFVKVPGGQHGGSWAARVKGVPREDADPDQPTAVVFYAGLEGLGNLGVEGEPEDTHGFAGDVKLGGFTTDLGDFSIDVTSGPESNESPEHGHPTYDEKPLDRTLVSSLTMHPEQLWQTKVIMFTQMKKEVDEMVEKYGSENPPPPYQLFTIKNEPGDGNMHLVQKVFKGSFEFDILFSSKSSPQPMTSELLTEQISSASLEFAERFESVHPPQAPFDTAEYTEFSKSMLSNLVGGIGYFHGTDIVDRSAAPEYDEENEGFWEETAEARGRAQPILEGPKDLFTCVPSRPFFPRGFLWDEGFHLIPVIDWDTDLALEIVRSWLNLMDEDGWIAREQILGSEARSKVPPEFTIQYPHYANPPTLFIILEAFIDKLDAKKNASMQTYADSGATDGLRSIFVDQPELGEAFIRSIYPLIPKHYYWYRSTQKGDIKSYDREAYSTREAYRWRGRSVQHILTSGLDDYPRPQPPHPGELHVDLMSWMGMMTRALRRIAVTIGETEDAEVFKTYETAIERNIDDLHWDDDASTYCDATIDEYEEHVHVCHKGYISIFPFLTGMLGPDSPRLKAILDLIGDPEELWSDYGIRSLSKKDQFYGTAENYWRSPIWVNINYLVLKNLYNIAIVSGPHREQARELYSNLRKNLVENVFQEWKKTGFAWEQYNPETGIGRRTQHFTGWTSMVVKMMSMPDLPASEQKGHDEL,./data/raw/alphafold//AF-G1UJA9-F1-model_v4.pdb,2812,2386,2663,5502
+1482,3833,3886,MNVFFMFSLLFLAALGSCADDRNPLAECFQENDYEEFLEIARNGLKATSNPKHVVIVGAGMAGLSAAYVLAGAGHQVTVLEASERPGGRVRTYRNEEAGWYANLGPMRLPEKHRIVREYIRKFDLRLNEFSQENDNAWYFIKNIRKKVGEVKKDPGLLKYPVKPSEAGKSAGQLYEESLGKVVEELKRTNCSYILNKYDTYSTKEYLIKEGDLSPGAVDMIGDLLNEDSGYYVSFIESLKHDDIFAYEKRFDEIVDGMDKLPTAMYRDIQDKVHFNAQVIKIQQNDQKVTVVYETLSKETPSVTADYVIVCTTSRAVRLIKFNPPLLPKKAHALRSVHYRSGTKIFLTCTTKFWEDDGIHGGKSTTDLPSRFIYYPNHNFTNGVGVIIAYGIGDDANFFQALDFKDCADIVFNDLSLIHQLPKKDIQSFCYPSVIQKWSLDKYAMGGITTFTPYQFQHFSDPLTASQGRIYFAGEYTAQAHGWIDSTIKSGLRAARDVNLASENPSGIHLSNDNEL,uniprot_search,P81382,CC(C)C[C@H](N)C(=O)O.O.O=O>>CC(C)CC(=O)C(=O)O.N.OO,3.3,7.821570337722915e-15,,,1.4.3.2,8717.0,0.5185139398778875,CC(C)C[C@H](N)C(=O)O.O.O=O,CC(C)CC(=O)C(=O)O.N.OO,0.5185139398778875,CC(C)C[C@H](N)C(=O)O.O.O=O__MNVFFMFSLLFLAALGSCADDRNPLAECFQENDYEEFLEIARNGLKATSNPKHVVIVGAGMAGLSAAYVLAGAGHQVTVLEASERPGGRVRTYRNEEAGWYANLGPMRLPEKHRIVREYIRKFDLRLNEFSQENDNAWYFIKNIRKKVGEVKKDPGLLKYPVKPSEAGKSAGQLYEESLGKVVEELKRTNCSYILNKYDTYSTKEYLIKEGDLSPGAVDMIGDLLNEDSGYYVSFIESLKHDDIFAYEKRFDEIVDGMDKLPTAMYRDIQDKVHFNAQVIKIQQNDQKVTVVYETLSKETPSVTADYVIVCTTSRAVRLIKFNPPLLPKKAHALRSVHYRSGTKIFLTCTTKFWEDDGIHGGKSTTDLPSRFIYYPNHNFTNGVGVIIAYGIGDDANFFQALDFKDCADIVFNDLSLIHQLPKKDIQSFCYPSVIQKWSLDKYAMGGITTFTPYQFQHFSDPLTASQGRIYFAGEYTAQAHGWIDSTIKSGLRAARDVNLASENPSGIHLSNDNEL,./data/raw/alphafold//AF-P81382-F1-model_v4.pdb,1381,1496,3068,1821
+1483,11652,11810,MGSTAETQLTPVQVTDDEAALFAMQLASASVLPMALKSALELDLLEIMAKNGSPMSPTEIASKLPTKNPEAPVMLDRILRLLTSYSVLTCSNRKLSGDGVERIYGLGPVCKYLTKNEDGVSIAALCLMNQDKVLMESWYHLKDAILDGGIPFNKAYGMSAFEYHGTDPRFNKVFNNGMSNHSTITMKKILETYKGFEGLTSLVDVGGGIGATLKMIVSKYPNLKGINFDLPHVIEDAPSHPGIEHVGGDMFVSVPKGDAIFMKWICHDWSDEHCVKFLKNCYESLPEDGKVILAECILPETPDSSLSTKQVVHVDCIMLAHNPGGKERTEKEFEALAKASGFKGIKVVCDAFGVNLIELLKKL,uniprot_search,Q9FK25,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.OC/C=C/c1ccc(O)c(O)c1>>COc1cc(/C=C/CO)ccc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,1.52,0.0891049723756939,37.0,7.5,2.1.1.68,3702.0,0.1818435879447725,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.OC/C=C/c1ccc(O)c(O)c1,COc1cc(/C=C/CO)ccc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,0.1818435879447725,C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O.OC/C=C/c1ccc(O)c(O)c1__MGSTAETQLTPVQVTDDEAALFAMQLASASVLPMALKSALELDLLEIMAKNGSPMSPTEIASKLPTKNPEAPVMLDRILRLLTSYSVLTCSNRKLSGDGVERIYGLGPVCKYLTKNEDGVSIAALCLMNQDKVLMESWYHLKDAILDGGIPFNKAYGMSAFEYHGTDPRFNKVFNNGMSNHSTITMKKILETYKGFEGLTSLVDVGGGIGATLKMIVSKYPNLKGINFDLPHVIEDAPSHPGIEHVGGDMFVSVPKGDAIFMKWICHDWSDEHCVKFLKNCYESLPEDGKVILAECILPETPDSSLSTKQVVHVDCIMLAHNPGGKERTEKEFEALAKASGFKGIKVVCDAFGVNLIELLKKL,./data/raw/alphafold//AF-Q9FK25-F1-model_v4.pdb,3864,3990,3324,2128
+1484,11186,11342,MPDQRSESGRFDVEVDVLVAGSGGGVAGAYTAAREGLSVLLVEATDKFGGTTAFSGGGGMWFPCNPVLERAGTDDTLDEALKYFHAVVGDRTPQELQDAYVTGGAGFIAYLEQDHGFEFAVLPWPDYYGSVPGARNDGYRHIVPKPLPDSALGSYQGLVRGPLDTERLGAPAPDTLIGGRALVGRFLAALDKLPNADCWCEAPLTELITESGRVVGAIVERGGERLRVCARRGVLLASGGFEQNADMRGRYGVPGSATDTMGGPGSTGAAHRAAMAVGADVDLMDQAWWSPGLTHPDGRSAFALWFTGGIFVDQDGKRFVNESAPYDRLGRAVIERLESGRLTLPYWMVYDSRAGDVPPVGATNVSMVDPAEYRAAGLWRSAETISGLAEEIGVPADALEATIQRFNEMATAGHDDDFGRGDEAYDRVFTGGASPLVPIDTPPYHAAAFGLSDLGTKGGLRTDTRARVRGRDGEPIPGLYAAGNTMAAVSGTTYPGGGNPIGASMLFSHFAALDMAAEGTTA,brenda,A0QW99,C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO>>C[C@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO,52.2,10000000.0,25.0,8.0,1.3.99.4,1772.0,1.717670503002262,C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO,C[C@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO,1.717670503002262,C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO__MPDQRSESGRFDVEVDVLVAGSGGGVAGAYTAAREGLSVLLVEATDKFGGTTAFSGGGGMWFPCNPVLERAGTDDTLDEALKYFHAVVGDRTPQELQDAYVTGGAGFIAYLEQDHGFEFAVLPWPDYYGSVPGARNDGYRHIVPKPLPDSALGSYQGLVRGPLDTERLGAPAPDTLIGGRALVGRFLAALDKLPNADCWCEAPLTELITESGRVVGAIVERGGERLRVCARRGVLLASGGFEQNADMRGRYGVPGSATDTMGGPGSTGAAHRAAMAVGADVDLMDQAWWSPGLTHPDGRSAFALWFTGGIFVDQDGKRFVNESAPYDRLGRAVIERLESGRLTLPYWMVYDSRAGDVPPVGATNVSMVDPAEYRAAGLWRSAETISGLAEEIGVPADALEATIQRFNEMATAGHDDDFGRGDEAYDRVFTGGASPLVPIDTPPYHAAAFGLSDLGTKGGLRTDTRARVRGRDGEPIPGLYAAGNTMAAVSGTTYPGGGNPIGASMLFSHFAALDMAAEGTTA,./data/raw/alphafold//AF-A0QW99-F1-model_v4.pdb,1436,3891,6209,872
+1485,17760,18003,MSVQREDVDIKLIAIDMDGTLLNDEQLISDENRKAIREAEDKGVYVVISTGRTLMTCRELAESLKLSSFLITANGSEIWDSNFNLVERKLLHTDHIQMMWDLRNKHNTNFWASTVNKVWRGEFPENITDHEWLKFGFDIEDDDIRNEVLEELRKNKELEITNSSPTNIEVNALGINKAAALAKVTEKLGFTMENVMAMGDSLNDIAMIKEAGLGVAMGNAQDIVKETADYITDTNIEDGVAKAIRHWVL,sabio,P42962,Nc1c(NCC(O)C(O)C(O)COP(=O)(O)O)[nH]c(=O)[nH]c1=O.O>>Nc1c(NCC(O)C(O)C(O)CO)[nH]c(=O)[nH]c1=O.O=P(O)(O)O,20040.0,0.0,23.0,8.0,3.1.3.104,1423.0,4.301897717195208,Nc1c(NCC(O)C(O)C(O)COP(=O)(O)O)[nH]c(=O)[nH]c1=O.O,Nc1c(NCC(O)C(O)C(O)CO)[nH]c(=O)[nH]c1=O.O=P(O)(O)O,4.301897717195208,Nc1c(NCC(O)C(O)C(O)COP(=O)(O)O)[nH]c(=O)[nH]c1=O.O__MSVQREDVDIKLIAIDMDGTLLNDEQLISDENRKAIREAEDKGVYVVISTGRTLMTCRELAESLKLSSFLITANGSEIWDSNFNLVERKLLHTDHIQMMWDLRNKHNTNFWASTVNKVWRGEFPENITDHEWLKFGFDIEDDDIRNEVLEELRKNKELEITNSSPTNIEVNALGINKAAALAKVTEKLGFTMENVMAMGDSLNDIAMIKEAGLGVAMGNAQDIVKETADYITDTNIEDGVAKAIRHWVL,./data/raw/alphafold//AF-P42962-F1-model_v4.pdb,2835,2412,2690,5531
+1486,13285,13460,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.N[C@@H](CCC(O)=N[C@@H](CSC1=C(SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=O)O)C(=O)c2ccccc2C1=O)C(O)=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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.N[C@@H](CCC(O)=N[C@@H](CSc1c(SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=O)O)c(O)c2ccccc2c1O)C(O)=NCC(=O)O)C(=O)O,4.4,0.0332627380117285,25.0,8.5,1.6.5.2,10116.0,0.6434526764861874,N=C(O)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](CCC(O)=N[C@@H](CSC1=C(SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=O)O)C(=O)c2ccccc2C1=O)C(O)=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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.N[C@@H](CCC(O)=N[C@@H](CSc1c(SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=O)O)c(O)c2ccccc2c1O)C(O)=NCC(=O)O)C(=O)O,0.6434526764861874,N=C(O)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](CCC(O)=N[C@@H](CSC1=C(SC[C@H](N=C(O)CC[C@H](N)C(=O)O)C(O)=NCC(=O)O)C(=O)c2ccccc2C1=O)C(O)=NCC(=O)O)C(=O)O__MAVRRALIVLAHAERTSFNYAMKEAAVEALKKKGWEVVESDLYAMNFNPLISRNDITGEPKDSENFQYPVESSLAYKEGRLSPDIVAEQKKLEAADLVIFQFPLYWFGVPAILKGWFERVLVAGFAYTYATMYDKGPFQNKKTLLSITTGGSGSMYSLQGVHGDMNVILWPIQSGILRFCGFQVLEPQLVYSIGHTPPDARVQVLEGWKKRLETVWEESPLYFAPSSLFDLNFQAGFLLKKEVQEEQKKNKFGLSVGHHLGKSIPADNQIKARK,./data/raw/alphafold//AF-P05982-F1-model_v4.pdb,3169,1965,3609,2408
+1487,6022,6116,MHRTSNGSHATGGNLPDVASHYPVAYEQTLDGTVGFVIDEMTPERATASVEVTDTLRQRWGLVHGGAYCALAEMLATEATVAVVHEKGMMAVGQSNHTSFFRPVKEGHVRAEAVRIHAGSTTWFWDVSLRDDAGRLCAVSSMSIAVRPRRD,sabio,Q04416,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.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=CC(=O)O,0.075,6.655117172987285e-15,25.0,7.5,3.1.2.23,1667.0,-1.1249387366083,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.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=CC(=O)O,-1.1249387366083,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.O__MHRTSNGSHATGGNLPDVASHYPVAYEQTLDGTVGFVIDEMTPERATASVEVTDTLRQRWGLVHGGAYCALAEMLATEATVAVVHEKGMMAVGQSNHTSFFRPVKEGHVRAEAVRIHAGSTTWFWDVSLRDDAGRLCAVSSMSIAVRPRRD,./data/raw/alphafold//AF-Q04416-F1-model_v4.pdb,1563,1130,966,1308
+1488,1136,1163,MTKIFAYAIREDEKPFLKEWEDAHKDVEVEYTDKLLTPETVALAKGADGVVVYQQLDYTAETLQALADNGITKMSLRNVGVDNIDMAKAKELGFQITNVPVYSPNAIAEHAAIQAARILRQDKAMDEKVARHDLRWAPTIGREVRDQVVGVIGTGHIGQVFMQIMEGFGAKVIAYDIFRNPELEKKGYYVDSLDDLYKQADVISLHVPDVPANVHMINDESIAKMKQDVVIVNVSRGPLVDTDAVIRGLDSGKIFGYAMDVYEGEVGIFNEDWEGKEFPDARLADLIARPNVLVTPHTAFYTTHAVRNMVVKAFDNNLELVEGKEAETPVKVG,brenda,P26297,CC(=O)C(=O)O.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]>>C[C@@H](O)C(=O)O.N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,235.5,6.8076358374371095e-15,30.0,6.5,1.1.1.28,1585.0,2.371990911464915,CC(=O)C(=O)O.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],C[C@@H](O)C(=O)O.N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,2.371990911464915,CC(=O)C(=O)O.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]__MTKIFAYAIREDEKPFLKEWEDAHKDVEVEYTDKLLTPETVALAKGADGVVVYQQLDYTAETLQALADNGITKMSLRNVGVDNIDMAKAKELGFQITNVPVYSPNAIAEHAAIQAARILRQDKAMDEKVARHDLRWAPTIGREVRDQVVGVIGTGHIGQVFMQIMEGFGAKVIAYDIFRNPELEKKGYYVDSLDDLYKQADVISLHVPDVPANVHMINDESIAKMKQDVVIVNVSRGPLVDTDAVIRGLDSGKIFGYAMDVYEGEVGIFNEDWEGKEFPDARLADLIARPNVLVTPHTAFYTTHAVRNMVVKAFDNNLELVEGKEAETPVKVG,./data/raw/alphafold//AF-P26297-F1-model_v4.pdb,1277,5242,1630,766
+1489,8881,9023,MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,uniprot_search,P08246,COC(=O)CCC(O)=N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C>>COC(=O)CCC(O)=N[C@H](C(=O)O)C(C)C.Nc1ccc([N+](=O)[O-])cc1,0.06,2.496075418471918,25.0,7.4,3.4.21.37,9606.0,-1.2218487496163564,COC(=O)CCC(O)=N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C,COC(=O)CCC(O)=N[C@H](C(=O)O)C(C)C.Nc1ccc([N+](=O)[O-])cc1,-1.2218487496163564,COC(=O)CCC(O)=N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C__MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,./data/raw/alphafold//AF-P08246-F1-model_v4.pdb,1869,1645,3250,2040
+1490,10995,11150,MSDLLSVFLHLLLLFKLVAPVTFRHHRYDDLVRTLYKVQNECPGITRVYSIGRSVEGRHLYVLEFSDHPGIHEPLEPEVKYVGNMHGNEALGRELMLQLSEFLCEEFRNRNQRIVQLIQDTRIHILPSMNPDGYEVAAAQGPNKPGYLVGRNNANGVDLNRNFPDLNTYIYYNEKYGGPNHHLPLPDNWKSQVEPETRAVIRWMHSFNFVLSANLHGGAVVANYPYDKSFEHRVRGVRRTASTPTPDDKLFQKLAKVYSYAHGWMFQGWNCGDYFPDGITNGASWYSLSKGMQDFNYLHTNCFEITLELSCDKFPPEEELQREWLGNREALIQFLEQVHQGIKGMVLDENYNNLANAVISVSGINHDVTSGDHGDYFRLLLPGIYTVSATAPGYDPETVTVTVGPAEPTLVNFHLKRSIPQVSPVRRAPSRRHGVRAKVQPQARKKEMEMRQLQRGPA,uniprot_search,P15169,C[C@H](N=C(O)c1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.O>>C[C@H](N=C(O)c1ccccc1)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O,139.0,7.725263907194777e-15,30.0,7.975,3.4.17.3,9606.0,2.143014800254095,C[C@H](N=C(O)c1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.O,C[C@H](N=C(O)c1ccccc1)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O,2.143014800254095,C[C@H](N=C(O)c1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.O__MSDLLSVFLHLLLLFKLVAPVTFRHHRYDDLVRTLYKVQNECPGITRVYSIGRSVEGRHLYVLEFSDHPGIHEPLEPEVKYVGNMHGNEALGRELMLQLSEFLCEEFRNRNQRIVQLIQDTRIHILPSMNPDGYEVAAAQGPNKPGYLVGRNNANGVDLNRNFPDLNTYIYYNEKYGGPNHHLPLPDNWKSQVEPETRAVIRWMHSFNFVLSANLHGGAVVANYPYDKSFEHRVRGVRRTASTPTPDDKLFQKLAKVYSYAHGWMFQGWNCGDYFPDGITNGASWYSLSKGMQDFNYLHTNCFEITLELSCDKFPPEEELQREWLGNREALIQFLEQVHQGIKGMVLDENYNNLANAVISVSGINHDVTSGDHGDYFRLLLPGIYTVSATAPGYDPETVTVTVGPAEPTLVNFHLKRSIPQVSPVRRAPSRRHGVRAKVQPQARKKEMEMRQLQRGPA,./data/raw/alphafold//AF-P15169-F1-model_v4.pdb,1855,1561,3146,1917
+1491,3970,4023,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](CCCCN)NS(=O)(=O)c1cccc2c(N(C)C)cccc12)C(=O)O.O>>CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N)C(=O)O.CN(C)c1cccc2c(S(=O)(=O)N[C@@H](CCCCN)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O)cccc12,40.0,6.8031791173643e-15,25.0,6.0,3.4.24.21,6715.0,1.6020599913279625,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](CCCCN)NS(=O)(=O)c1cccc2c(N(C)C)cccc12)C(=O)O.O,CC(C)C[C@H](N=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N)C(=O)O.CN(C)c1cccc2c(S(=O)(=O)N[C@@H](CCCCN)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O)cccc12,1.6020599913279625,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](CCCCN)NS(=O)(=O)c1cccc2c(N(C)C)cccc12)C(=O)O.O__MQCAVLLVLLGVVAASPIIPEAARALYYNDGMFEGDIKLRAGRQPARVGAAILGDEYLWSGGVIPYTFAGVSGADQSAILSGMQELEEKTCIRFVPRTTESDYVEIFTSGSGCWSYVGRISGAQQVSLQANGCVYHGTIIHELMHAIGFYHEHTRMDRDNYVTINYQNVDPSMTSNFDIDTYSRYVGEDYQYYSIMHYGKYSFSIQWGVLETIVPLQNGIDLTDPYDKAHMLQTDANQINNLYTNECSLRH,./data/raw/alphafold//AF-P07584-F1-model_v4.pdb,1871,1575,3165,1936
+1492,13671,13850,MPVVHVIDVESGNLQSLTNAIEHLGYEVQLVKSPKDFNISGTSRLILPGVGNYGHFVDNLFNRGFEKPIREYIESGKPIMGICVGLQALFAGSVESPKSTGLNYIDFKLSRFDDSEKPVPEIGWNSCIPSENLFFGLDPYKRYYFVHSFAAILNSEKKKNLENDGWKIAKAKYGSEEFIAAVNKNNIFATQFHPEKSGKAGLNVIENFLKQQSPPIPNYSAEEKELLMNDYSNYGLTRRIIACLDVRTNDQGDLVVTKGDQYDVREKSDGKGVRNLGKPVQLAQKYYQQGADEVTFLNITSFRDCPLKDTPMLEVLKQAAKTVFVPLTVGGGIKDIVDVDGTKIPALEVASLYFRSGADKVSIGTDAVYAAEKYYELGNRGDGTSPIETISKAYGAQAVVISVDPKRVYVNSQADTKNKVFETEYPGPNGEKYCWYQCTIKGGRESRDLGVWELTRACEALGAGEILLNCIDKDGSNSGYDLELIEHVKDAVKIPVIASSGAGVPEHFEEAFLKTRADACLGAGMFHRGEFTVNDVKEYLLEHGLKVRMDEE,brenda,P33734,N=C(O)CC[C@H](N)C(=O)O.O>>N.N[C@@H](CCC(=O)O)C(=O)O,5.2,0.0,30.0,7.0,4.3.2.10,4932.0,0.7160033436347992,N=C(O)CC[C@H](N)C(=O)O.O,N.N[C@@H](CCC(=O)O)C(=O)O,0.7160033436347992,N=C(O)CC[C@H](N)C(=O)O.O__MPVVHVIDVESGNLQSLTNAIEHLGYEVQLVKSPKDFNISGTSRLILPGVGNYGHFVDNLFNRGFEKPIREYIESGKPIMGICVGLQALFAGSVESPKSTGLNYIDFKLSRFDDSEKPVPEIGWNSCIPSENLFFGLDPYKRYYFVHSFAAILNSEKKKNLENDGWKIAKAKYGSEEFIAAVNKNNIFATQFHPEKSGKAGLNVIENFLKQQSPPIPNYSAEEKELLMNDYSNYGLTRRIIACLDVRTNDQGDLVVTKGDQYDVREKSDGKGVRNLGKPVQLAQKYYQQGADEVTFLNITSFRDCPLKDTPMLEVLKQAAKTVFVPLTVGGGIKDIVDVDGTKIPALEVASLYFRSGADKVSIGTDAVYAAEKYYELGNRGDGTSPIETISKAYGAQAVVISVDPKRVYVNSQADTKNKVFETEYPGPNGEKYCWYQCTIKGGRESRDLGVWELTRACEALGAGEILLNCIDKDGSNSGYDLELIEHVKDAVKIPVIASSGAGVPEHFEEAFLKTRADACLGAGMFHRGEFTVNDVKEYLLEHGLKVRMDEE,./data/raw/alphafold//AF-P33734-F1-model_v4.pdb,2153,4365,4255,4124
+1493,5437,5523,MRIVRALVAAALVAAVSAGCSTSPDAAEEAFATTEPPALKTIDPAHLQSIVADTAKSLDVPGALVLLQTPQGRFAAGVGTTELGTQTPPRPDTHFRIASNTKTMTAAVIMLLAQDGKLSLDDPVAKYVPGVPNADAITLIDLLRMRSGLYCYTNDSEFAATLDSDPAKTWTPQEVLDIAFDHPSTVAPDTAYEYCNTNYALLGVVAEQVGGAPLAEQFQQRLFGPLGMRNTLLPSPAEASEIPAPYSHGYMYGETLYAMVDETYPAAITDAARAGTLKPNDYTHQNSSYATAAGGAISTADDLATWIRALVGGKVLDSEHQQQFLDSLLPEDPDNPDGGQSYGYGISFQRFGPEAAMYYHGGEMPGFNSFMGYDPDNDVALVIWTNLTLSPDNKTTANAMLPVVLKEIYSDLSF,brenda,A0R0P0,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O.O>>,27.6,99.71704412979751,30.0,8.0,3.5.2.6,1772.0,1.4409090820652175,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O.O,,1.4409090820652175,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O.O__MRIVRALVAAALVAAVSAGCSTSPDAAEEAFATTEPPALKTIDPAHLQSIVADTAKSLDVPGALVLLQTPQGRFAAGVGTTELGTQTPPRPDTHFRIASNTKTMTAAVIMLLAQDGKLSLDDPVAKYVPGVPNADAITLIDLLRMRSGLYCYTNDSEFAATLDSDPAKTWTPQEVLDIAFDHPSTVAPDTAYEYCNTNYALLGVVAEQVGGAPLAEQFQQRLFGPLGMRNTLLPSPAEASEIPAPYSHGYMYGETLYAMVDETYPAAITDAARAGTLKPNDYTHQNSSYATAAGGAISTADDLATWIRALVGGKVLDSEHQQQFLDSLLPEDPDNPDGGQSYGYGISFQRFGPEAAMYYHGGEMPGFNSFMGYDPDNDVALVIWTNLTLSPDNKTTANAMLPVVLKEIYSDLSF,./data/raw/alphafold//AF-A0R0P0-F1-model_v4.pdb,1459,994,807,1123
+1494,19564,19850,MASKRALVILAKGAEEMETVIPVDVMRRAGIKVTVAGLAGKDPVQCSRDVVICPDASLEDAKKEGPYDVVVLPGGNLGAQNLSESAAVKEILKEQENRKGLIAAICAGPTALLAHEIGFGSKVTTHPLAKDKMMNGGHYTYSENRVEKDGLILTSRGPGTSFEFALAIVEALNGKEVAAQVKAPLVLKD,brenda,Q99497,O.O=CC(=O)c1ccccc1>>,0.0272,99.34704111682088,30.0,7.416666666666667,4.2.1.130,9606.0,-1.565431095965801,O.O=CC(=O)c1ccccc1,,-1.565431095965801,O.O=CC(=O)c1ccccc1__MASKRALVILAKGAEEMETVIPVDVMRRAGIKVTVAGLAGKDPVQCSRDVVICPDASLEDAKKEGPYDVVVLPGGNLGAQNLSESAAVKEILKEQENRKGLIAAICAGPTALLAHEIGFGSKVTTHPLAKDKMMNGGHYTYSENRVEKDGLILTSRGPGTSFEFALAIVEALNGKEVAAQVKAPLVLKD,./data/raw/alphafold//AF-Q99497-F1-model_v4.pdb,1322,3888,6206,869
+1495,7184,7306,MPCPAQISDDLEFFVNGRKVTEKNVDPEVTLLAFLRKNLCLTGTKDACGTGGCGACTVMVSQHDPVCKKTRHFSVMACLVPLCSLHGAAVTTVEGVGSIKTRLHPVQERIAKSHGTQCGFCTPGMVMSIYTLLRNHPQPSEEQLMEALGGNLCRCTGYRPILESGRTFCMEPDGCPQKGTGQCCLDQKESDSSGSKSDICTKLFVKDEFQPLDPTQELIFPPELLRMAENPEKQTLTFYGERITWIAPGTLQELLVLKAKYPEAPLISGNTALGPAMKSQGHFYPVLLSPARIPDLRMVTKTSGGLTIGACCSLAQVKDILAESISELPQEKTQTYRALLKHLRSLAGQQIRNMASLGGHVISRHCYSDLNPILSVGNTTLNLLSEEGPRQIPLSGHFLAGLASADLKPEEILGSVYIPHSQKREFVSAFRQAQCHQNALPDVNAGMRVLFREGTDVIEELSIAYGGVGPTTVSAQRSCQQLLGRRWNALMLDEACRLLLDEVSLPGSALGGKVEFRRTLIVSLFFKFYLEVLQELKADQKLPPESTDSQRYPEIADRFLSSLGDFQVTLPRGVQTYQRVDSHQPLQDPVGRPIMHLSGLKHATGEAVFCDDIPRVDKELFMALVTSTRAHARIISIDSSEVLDLPGVVDVITAEDIPGNNGEEDDKLLAVDKVLCVGQVICAVVAETDVQAKRATEKIKITYEDLKPVIFTIEDAIKHNSFLCPEKKLEQGNIEEAFENVDQVAEGTVHVGGQEHFYMETQRVLVIPKTEDKELDMYVSTQDPAHVQKTVSSTLNIPISRITCHVKRVGGGFGGKVGRPAVFGAIAAVGAVKTGHPIRLVLDREDDMLITGGRHPLFAKYKVGFMNSGRIKALDIECYINGGCTLDDSELVTEFLVLKLENAYKIRNLRLRGRACMTNLPSNTAFRGFGFPQGALVTESCITAVAAKCGLPPEKIREKNMYKTVDKTIYKQAFNPDPLIRCWNECLDKSSFHIRRTRVDEFNKKSYWKKRGIAIVPMKFSVGFAATSYHQAAALVHIYTDGSVLVAHGGNELGQGIHTKMLQVASRELKIPLSYLHICETSTTTVPNTIATAASVGADVNGRAVQNACQILLKRLEPVIKKNPEGTWRDWIEAAFEKRISLSATGYFRGYKAFMDWEKGEGDPFPYYVYGAACSEVEIDCLTGAHKKIRTDIVMDACCSLNPAIDIGQIEGAFIQGMGLYTTEELLYSPEGVLYSRSPDKYKIPTVTDVPEQFNVSLLPSSQTPLTLYSSKGLGESGMFLGSSVFFAIVDAVAAARRQRDIAEDFTVKSPATPEWVRMACADRFTDMIPRDDPKTFKPWSIPIA,brenda,Q5SGK3,CCCCCCCC=O.O.O=O>>CCCCCCCC(=O)O.OO,0.46,0.0,37.0,8.0,1.2.3.1,10090.0,-0.3372421683184259,CCCCCCCC=O.O.O=O,CCCCCCCC(=O)O.OO,-0.3372421683184259,CCCCCCCC=O.O.O=O__MPCPAQISDDLEFFVNGRKVTEKNVDPEVTLLAFLRKNLCLTGTKDACGTGGCGACTVMVSQHDPVCKKTRHFSVMACLVPLCSLHGAAVTTVEGVGSIKTRLHPVQERIAKSHGTQCGFCTPGMVMSIYTLLRNHPQPSEEQLMEALGGNLCRCTGYRPILESGRTFCMEPDGCPQKGTGQCCLDQKESDSSGSKSDICTKLFVKDEFQPLDPTQELIFPPELLRMAENPEKQTLTFYGERITWIAPGTLQELLVLKAKYPEAPLISGNTALGPAMKSQGHFYPVLLSPARIPDLRMVTKTSGGLTIGACCSLAQVKDILAESISELPQEKTQTYRALLKHLRSLAGQQIRNMASLGGHVISRHCYSDLNPILSVGNTTLNLLSEEGPRQIPLSGHFLAGLASADLKPEEILGSVYIPHSQKREFVSAFRQAQCHQNALPDVNAGMRVLFREGTDVIEELSIAYGGVGPTTVSAQRSCQQLLGRRWNALMLDEACRLLLDEVSLPGSALGGKVEFRRTLIVSLFFKFYLEVLQELKADQKLPPESTDSQRYPEIADRFLSSLGDFQVTLPRGVQTYQRVDSHQPLQDPVGRPIMHLSGLKHATGEAVFCDDIPRVDKELFMALVTSTRAHARIISIDSSEVLDLPGVVDVITAEDIPGNNGEEDDKLLAVDKVLCVGQVICAVVAETDVQAKRATEKIKITYEDLKPVIFTIEDAIKHNSFLCPEKKLEQGNIEEAFENVDQVAEGTVHVGGQEHFYMETQRVLVIPKTEDKELDMYVSTQDPAHVQKTVSSTLNIPISRITCHVKRVGGGFGGKVGRPAVFGAIAAVGAVKTGHPIRLVLDREDDMLITGGRHPLFAKYKVGFMNSGRIKALDIECYINGGCTLDDSELVTEFLVLKLENAYKIRNLRLRGRACMTNLPSNTAFRGFGFPQGALVTESCITAVAAKCGLPPEKIREKNMYKTVDKTIYKQAFNPDPLIRCWNECLDKSSFHIRRTRVDEFNKKSYWKKRGIAIVPMKFSVGFAATSYHQAAALVHIYTDGSVLVAHGGNELGQGIHTKMLQVASRELKIPLSYLHICETSTTTVPNTIATAASVGADVNGRAVQNACQILLKRLEPVIKKNPEGTWRDWIEAAFEKRISLSATGYFRGYKAFMDWEKGEGDPFPYYVYGAACSEVEIDCLTGAHKKIRTDIVMDACCSLNPAIDIGQIEGAFIQGMGLYTTEELLYSPEGVLYSRSPDKYKIPTVTDVPEQFNVSLLPSSQTPLTLYSSKGLGESGMFLGSSVFFAIVDAVAAARRQRDIAEDFTVKSPATPEWVRMACADRFTDMIPRDDPKTFKPWSIPIA,./data/raw/alphafold//AF-Q5SGK3-F1-model_v4.pdb,1051,609,277,304
+1496,1190,1217,MVVINSLRRLARTTQVHLHSKYATCMSGNSTSRRIFTTEAAPEKKNTVGSKGHDMLAPFTAGWQSADLDPLVIAKSEGSYVYDDTGKKYLDSLAGLWCTALGGNEPRLVSAAVEQLNTLPFYHSFWNRTTKPSLDLAKVLLEMFTANKMAKAFFTSGGSDANDTQVKLVWYYNNALGRPEKKKFIARKKSYHGSTLISASLSGLPPLHQNFDLPAPFVLHTDCPHYWRFHLPGETEEEFSTRLAKNLEDLIIKEGPETIGAFIAEPVMGAGGVIPPPATYFEKVQAVVKKYDILFIADEVICAFGRLGTMFGCDKYNIKPDLVTLAKALSSAYMPIGAILMSQEVADVINSHSSKLGVFSHGFTYSGHPVSCAVAIEALKIYKERNIPEYVAKVAPRFQDGVKAFASGSPIIGETRGTGLILGTEFVDNKSPNEPFPPEWGVGAFFGAECQKHGMLVRVAGDGILMSPPLIISPEEIDELISIYGKALKATEEKVKELKAQHKK,brenda,Q94CE5,CC(=O)C(=O)O.NCCCC(=O)O>>C[C@H](N)C(=O)O.O=CCCC(=O)O,10.6,0.0,30.0,7.5,2.6.1.19,3702.0,1.0253058652647702,CC(=O)C(=O)O.NCCCC(=O)O,C[C@H](N)C(=O)O.O=CCCC(=O)O,1.0253058652647702,CC(=O)C(=O)O.NCCCC(=O)O__MVVINSLRRLARTTQVHLHSKYATCMSGNSTSRRIFTTEAAPEKKNTVGSKGHDMLAPFTAGWQSADLDPLVIAKSEGSYVYDDTGKKYLDSLAGLWCTALGGNEPRLVSAAVEQLNTLPFYHSFWNRTTKPSLDLAKVLLEMFTANKMAKAFFTSGGSDANDTQVKLVWYYNNALGRPEKKKFIARKKSYHGSTLISASLSGLPPLHQNFDLPAPFVLHTDCPHYWRFHLPGETEEEFSTRLAKNLEDLIIKEGPETIGAFIAEPVMGAGGVIPPPATYFEKVQAVVKKYDILFIADEVICAFGRLGTMFGCDKYNIKPDLVTLAKALSSAYMPIGAILMSQEVADVINSHSSKLGVFSHGFTYSGHPVSCAVAIEALKIYKERNIPEYVAKVAPRFQDGVKAFASGSPIIGETRGTGLILGTEFVDNKSPNEPFPPEWGVGAFFGAECQKHGMLVRVAGDGILMSPPLIISPEEIDELISIYGKALKATEEKVKELKAQHKK,./data/raw/alphafold//AF-Q94CE5-F1-model_v4.pdb,1266,3835,6151,802
+1497,11949,12109,MWGLKVLLLPVVSFALYPEEILDTHWELWKKTHRKQYNNKVDEISRRLIWEKNLKYISIHNLEASLGVHTYELAMNHLGDMTSEEVVQKMTGLKVPLSHSRSNDTLYIPEWEGRAPDSVDYRKKGYVTPVKNQGQCGSCWAFSSVGALEGQLKKKTGKLLNLSPQNLVDCVSENDGCGGGYMTNAFQYVQKNRGIDSEDAYPYVGQEESCMYNPTGKAAKCRGYREIPEGNEKALKRAVARVGPVSVAIDASLTSFQFYSKGVYYDESCNSDNLNHAVLAVGYGIQKGNKHWIIKNSWGENWGNKGYILMARNKNNACGIANLASFPKM,uniprot_search,P43235,Cc1cc(=O)oc2cc(N=C(O)[C@H](Cc3ccc(O)cc3)N=C(O)[C@H](CC(C)C)N=C(O)CCC(=O)O)ccc12.O>>CC(C)C[C@H](N=C(O)CCC(=O)O)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=N)O.Cc1cc(=O)oc2cc(N)ccc12,0.008,0.0863735233551079,26.0,5.53,3.4.22.38,9606.0,-2.096910013008056,Cc1cc(=O)oc2cc(N=C(O)[C@H](Cc3ccc(O)cc3)N=C(O)[C@H](CC(C)C)N=C(O)CCC(=O)O)ccc12.O,CC(C)C[C@H](N=C(O)CCC(=O)O)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=N)O.Cc1cc(=O)oc2cc(N)ccc12,-2.096910013008056,Cc1cc(=O)oc2cc(N=C(O)[C@H](Cc3ccc(O)cc3)N=C(O)[C@H](CC(C)C)N=C(O)CCC(=O)O)ccc12.O__MWGLKVLLLPVVSFALYPEEILDTHWELWKKTHRKQYNNKVDEISRRLIWEKNLKYISIHNLEASLGVHTYELAMNHLGDMTSEEVVQKMTGLKVPLSHSRSNDTLYIPEWEGRAPDSVDYRKKGYVTPVKNQGQCGSCWAFSSVGALEGQLKKKTGKLLNLSPQNLVDCVSENDGCGGGYMTNAFQYVQKNRGIDSEDAYPYVGQEESCMYNPTGKAAKCRGYREIPEGNEKALKRAVARVGPVSVAIDASLTSFQFYSKGVYYDESCNSDNLNHAVLAVGYGIQKGNKHWIIKNSWGENWGNKGYILMARNKNNACGIANLASFPKM,./data/raw/alphafold//AF-P43235-F1-model_v4.pdb,1940,4081,1936,2163
+1498,6683,6797,MSPSKESDELIFFVNGKKVTERNADPEVNLLFYLRKVIRLTGTKYGCGGGDCGACTVMISRYDPISKRISHFSATACLVPICSLHGAAVTTVEGIGSTKTRIHPVQERIAKGHGTQCGFCTPGMVMSIYTLLRNHPEPSTEQIMETLGGNLCRCTGYRPIVESAKSFCPSSTCCQMNGEGKCCLDEEKNEPERKNSVCTKLYEKKEFQPLDPTQELIFPPELMRMAEESQNTVLTFRGERTTWIAPGTLNDLLELKMKHPSAPLVIGNTYLGLHMKFTDVSYPIIISPARILELFVVTNTKQGLTLGAGLSLTQVKNVLSDVVSRLPKEKTQIYCALLKQLKTLAGQQIRNVASLGGHIISRLPTSDLNPILGIGNCILNVASTEGIQQIPLNDHFLAGVPDAILKPEQVLISVFVPRSSKWEFVSAFRQAPRQQNAFATVNAGMKVVFKEDTNTITDLGILYGGIGATVISADKSCRQLIGRCWDEEMLDDAGKMICEEVSLLMAAPGGMEEYRKTLAISFLFMFYLDVLKQLKTRDPHKYPDISQKLLHILEDFPLTMPYGMQSFQDVDFQQPLQDPIGRPIMHQSGIKHATGEAVFCDDMSVLPGELFLAVVTSSKSHAKIISLDASEALASLGVVDVVTARDVPGDNGREEESLYAQDEVICVGQIVCAVAADSYAHAQQAAKKVKIVYQDIEPMIVTVQDALQYESFIGPERKLEQGNVEEAFQCADQILEGEVHLGGQEHFYMETQSVRVVPKGEDKEMDIYVSSQDAAFTQEMVARTLGIPKNRINCHVKRVGGAFGGKASKPGLLASVAAVAAQKTGRPIRFILERRDDMLITGGRHPLLGKYKIGFMNNGKIKAADIQLYINGGCTPDDSELVIEYALLKLENAYKIPNLRVRGRVCKTNLPSNTAFRGFGFPQGAFVTETCMSAVAAKCRLPPEKVRELNMYRTIDRTIHNQEFDPTNLLQCWEACVENSSYYNRKKAVDEFNQQRFWKKRGIAIIPMKFSVGFPKTFYYQAAALVQIYTDGSVLVAHGGVELGQGINTKMIQVASRELKIPMSYIHLDEMSTVTVPNTVTTGASTGADVNGRAVQNACQILMKRLEPIIKQNPSGTWEEWVKEAFVQSISLSATGYFRGYQADMDWEKGEGDIFPYFVFGAACSEVEIDCLTGAHKNIRTDIVMDGSFSINPAVDIGQIEGAFVQGLGLYTLEELKYSPEGVLYTRGPHQYKIASVTDIPEEFHVSLLTPTPNPKAIYSSKGLGEAGTFLGCSVFFAIAAAVAAAREERGLSPIWAINSPATAEVIRMACEDQFTNLVPQTDSKCCKPWSIPVA,brenda,G3X982,CCCC=O.O.O=O>>CCCC(=O)O.OO,2.11,1.1589344899039316e-14,37.0,8.0,1.2.3.1,10090.0,0.3242824552976926,CCCC=O.O.O=O,CCCC(=O)O.OO,0.3242824552976926,CCCC=O.O.O=O__MSPSKESDELIFFVNGKKVTERNADPEVNLLFYLRKVIRLTGTKYGCGGGDCGACTVMISRYDPISKRISHFSATACLVPICSLHGAAVTTVEGIGSTKTRIHPVQERIAKGHGTQCGFCTPGMVMSIYTLLRNHPEPSTEQIMETLGGNLCRCTGYRPIVESAKSFCPSSTCCQMNGEGKCCLDEEKNEPERKNSVCTKLYEKKEFQPLDPTQELIFPPELMRMAEESQNTVLTFRGERTTWIAPGTLNDLLELKMKHPSAPLVIGNTYLGLHMKFTDVSYPIIISPARILELFVVTNTKQGLTLGAGLSLTQVKNVLSDVVSRLPKEKTQIYCALLKQLKTLAGQQIRNVASLGGHIISRLPTSDLNPILGIGNCILNVASTEGIQQIPLNDHFLAGVPDAILKPEQVLISVFVPRSSKWEFVSAFRQAPRQQNAFATVNAGMKVVFKEDTNTITDLGILYGGIGATVISADKSCRQLIGRCWDEEMLDDAGKMICEEVSLLMAAPGGMEEYRKTLAISFLFMFYLDVLKQLKTRDPHKYPDISQKLLHILEDFPLTMPYGMQSFQDVDFQQPLQDPIGRPIMHQSGIKHATGEAVFCDDMSVLPGELFLAVVTSSKSHAKIISLDASEALASLGVVDVVTARDVPGDNGREEESLYAQDEVICVGQIVCAVAADSYAHAQQAAKKVKIVYQDIEPMIVTVQDALQYESFIGPERKLEQGNVEEAFQCADQILEGEVHLGGQEHFYMETQSVRVVPKGEDKEMDIYVSSQDAAFTQEMVARTLGIPKNRINCHVKRVGGAFGGKASKPGLLASVAAVAAQKTGRPIRFILERRDDMLITGGRHPLLGKYKIGFMNNGKIKAADIQLYINGGCTPDDSELVIEYALLKLENAYKIPNLRVRGRVCKTNLPSNTAFRGFGFPQGAFVTETCMSAVAAKCRLPPEKVRELNMYRTIDRTIHNQEFDPTNLLQCWEACVENSSYYNRKKAVDEFNQQRFWKKRGIAIIPMKFSVGFPKTFYYQAAALVQIYTDGSVLVAHGGVELGQGINTKMIQVASRELKIPMSYIHLDEMSTVTVPNTVTTGASTGADVNGRAVQNACQILMKRLEPIIKQNPSGTWEEWVKEAFVQSISLSATGYFRGYQADMDWEKGEGDIFPYFVFGAACSEVEIDCLTGAHKNIRTDIVMDGSFSINPAVDIGQIEGAFVQGLGLYTLEELKYSPEGVLYTRGPHQYKIASVTDIPEEFHVSLLTPTPNPKAIYSSKGLGEAGTFLGCSVFFAIAAAVAAAREERGLSPIWAINSPATAEVIRMACEDQFTNLVPQTDSKCCKPWSIPVA,./data/raw/alphafold//AF-G3X982-F1-model_v4.pdb,1051,609,279,306
+1499,11396,11552,MDLQDFSHKLAEATKNLTPAERASLKKIFEGVSAEVFSQPAPVSAVATGAESGIPDGPTPRHVKLKENFLKQVPSITVQRAVAITKIAKENPGLPKPLLRAKTFRYCCETAPLVIQDHELIVGSPNGAPRAGAFSPEVAWRWLQDELDTIGSRPQDPFYISEEDKKVLREEVFPFWQNKSVDEFCEGQYREADLWEMSGESFVSDCSYHAVNGGGDSNPGYDVILMKKGMLDIQREAREKLEQLDYANPEDIDKIYFYKSVIETAEGVMIYARRLSAYAAELAARETDPRRKAELQKISEVNARVPAHAPSNFWEAIQAVWTVESLLVVEENQTGMSIGRVDQYMYPFYRADIDSGRLTEYEAFDLAGCMLVKMSEMMWITSEGASKFFAGYQPFVNMCVGGVTREGHDATNDLTYMLMDAVRHVRIYQPTLATRVHNKSPQKYLKKIVDVIRSGMGFPAVHFDDAHIKMMLAKGVSIEDARDYCLMGCVEPQKSGRLYQWTSTGYTQWPICIELVLNHGVPLWYGKKVTPDMGDLSQYDTYEKFEAAVKEQIRWITKNTSVATVISQRAHRELAPKPLMSLMYEGCMESGRDVSAGGAMYNFGPGVVWSGLATYVDSMAAIKKLVYDDRKYTLAQLNEALKADFAGYDQILADCLAAPKYGNDDDYADMIAADLVHFTETEHRKYKTLYSVLSHGTLSISNNTPFGQLLGASANGRRAWMPLSDGISPTQGADYKGPTAIIKSVSKMANDNMNIGMVHNFKLMSGLLDTPEGENGLITLIRTACMLGNGEMQFNYLDNELLLDAQKHPEKYRDLVVRVAGYSAFFVELCKDVQDEIISRTMLHGF,brenda,Q30W70,C[N+](C)(C)CCO>>CC=O.CN(C)C,157.0,0.483829162226764,21.0,8.0,4.3.99.4,58180.0,2.1958996524092336,C[N+](C)(C)CCO,CC=O.CN(C)C,2.1958996524092336,C[N+](C)(C)CCO__MDLQDFSHKLAEATKNLTPAERASLKKIFEGVSAEVFSQPAPVSAVATGAESGIPDGPTPRHVKLKENFLKQVPSITVQRAVAITKIAKENPGLPKPLLRAKTFRYCCETAPLVIQDHELIVGSPNGAPRAGAFSPEVAWRWLQDELDTIGSRPQDPFYISEEDKKVLREEVFPFWQNKSVDEFCEGQYREADLWEMSGESFVSDCSYHAVNGGGDSNPGYDVILMKKGMLDIQREAREKLEQLDYANPEDIDKIYFYKSVIETAEGVMIYARRLSAYAAELAARETDPRRKAELQKISEVNARVPAHAPSNFWEAIQAVWTVESLLVVEENQTGMSIGRVDQYMYPFYRADIDSGRLTEYEAFDLAGCMLVKMSEMMWITSEGASKFFAGYQPFVNMCVGGVTREGHDATNDLTYMLMDAVRHVRIYQPTLATRVHNKSPQKYLKKIVDVIRSGMGFPAVHFDDAHIKMMLAKGVSIEDARDYCLMGCVEPQKSGRLYQWTSTGYTQWPICIELVLNHGVPLWYGKKVTPDMGDLSQYDTYEKFEAAVKEQIRWITKNTSVATVISQRAHRELAPKPLMSLMYEGCMESGRDVSAGGAMYNFGPGVVWSGLATYVDSMAAIKKLVYDDRKYTLAQLNEALKADFAGYDQILADCLAAPKYGNDDDYADMIAADLVHFTETEHRKYKTLYSVLSHGTLSISNNTPFGQLLGASANGRRAWMPLSDGISPTQGADYKGPTAIIKSVSKMANDNMNIGMVHNFKLMSGLLDTPEGENGLITLIRTACMLGNGEMQFNYLDNELLLDAQKHPEKYRDLVVRVAGYSAFFVELCKDVQDEIISRTMLHGF,./data/raw/alphafold//AF-Q30W70-F1-model_v4.pdb,3827,3948,1791,3603
+1500,18379,18639,MFESAEVGHSIDKDTYEKAVIELREALLEAQFELKQQARFPVIILINGIEGAGKGETVKLLNEWMDPRLIEVQSFLRPSDEELERPPQWRFWRRLPPKGRTGIFFGNWYSQMLYARVEGHIKEAKLDQAIDAAERFERMLCDEGALLFKFWFHLSKKQLKERLKALEKDPQHSWKLSPLDWKQSEVYDRFVHYGERVLRRTSRDYAPWYVVEGADERYRALTVGRILLEGLQAALATKERAKRQPHAAPLVSSLDNRGLLDSLDLGQYLDKDAYKEQLAAEQARLAGLIRDKRFRQHSLVAVFEGNDAAGKGGAIRRVTDALDPRQYHIVPIAAPTEEERAQPYLWRFWRHIPARRQFTIFDRSWYGRVLVERIEGFCAPADWLRAYGEINDFEEQLSEYGIIVVKFWLAIDKQTQMERFKEREKTPYKRYKITEEDWRNRDKWDQYVDAVGDMVDRTSTEIAPWTLVEANDKRFARVKVLRTINDAIEAAYKKDK,brenda,Q9HYF1,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)OP(=O)(O)O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,3.4,9.385119909127655e-15,30.0,7.6,2.7.4.33,287.0,0.5314789170422551,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)OP(=O)(O)O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,1.649334858712142,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)OP(=O)(O)O__MFESAEVGHSIDKDTYEKAVIELREALLEAQFELKQQARFPVIILINGIEGAGKGETVKLLNEWMDPRLIEVQSFLRPSDEELERPPQWRFWRRLPPKGRTGIFFGNWYSQMLYARVEGHIKEAKLDQAIDAAERFERMLCDEGALLFKFWFHLSKKQLKERLKALEKDPQHSWKLSPLDWKQSEVYDRFVHYGERVLRRTSRDYAPWYVVEGADERYRALTVGRILLEGLQAALATKERAKRQPHAAPLVSSLDNRGLLDSLDLGQYLDKDAYKEQLAAEQARLAGLIRDKRFRQHSLVAVFEGNDAAGKGGAIRRVTDALDPRQYHIVPIAAPTEEERAQPYLWRFWRHIPARRQFTIFDRSWYGRVLVERIEGFCAPADWLRAYGEINDFEEQLSEYGIIVVKFWLAIDKQTQMERFKEREKTPYKRYKITEEDWRNRDKWDQYVDAVGDMVDRTSTEIAPWTLVEANDKRFARVKVLRTINDAIEAAYKKDK,./data/raw/alphafold//AF-Q9HYF1-F1-model_v4.pdb,2480,4910,4982,4836
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+1509,12252,12421,MDMWTALLILQALLLPSLADGATPALRFVAVGDWGGVPNAPFHTAREMANAKEIARTVQILGADFILSLGDNFYFTGVQDINDKRFQETFEDVFSDRSLRKVPWYVLAGNHDHLGNVSAQIAYSKISKRWNFPSPFYRLHFKIPQTNVSVAIFMLDTVTLCGNSDDFLSQQPERPRDVKLARTQLSWLKKQLAAAREDYVLVAGHYPVWSIAEHGPTHCLVKQLRPLLATYGVTAYLCGHDHNLQYLQDENGVGYVLSGAGNFMDPSKRHQRKVPNGYLRFHYGTEDSLGGFAYVEISSKEMTVTYIEASGKSLFKTRLPRRARP,sabio,P13686,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O.O>>Cc1cn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)nc1O.O=P(O)(O)O,107.0,1.572591940945473,25.0,5.7,3.1.3.2,9606.0,2.0293837776852097,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O.O,Cc1cn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)nc1O.O=P(O)(O)O,2.0293837776852097,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O.O__MDMWTALLILQALLLPSLADGATPALRFVAVGDWGGVPNAPFHTAREMANAKEIARTVQILGADFILSLGDNFYFTGVQDINDKRFQETFEDVFSDRSLRKVPWYVLAGNHDHLGNVSAQIAYSKISKRWNFPSPFYRLHFKIPQTNVSVAIFMLDTVTLCGNSDDFLSQQPERPRDVKLARTQLSWLKKQLAAAREDYVLVAGHYPVWSIAEHGPTHCLVKQLRPLLATYGVTAYLCGHDHNLQYLQDENGVGYVLSGAGNFMDPSKRHQRKVPNGYLRFHYGTEDSLGGFAYVEISSKEMTVTYIEASGKSLFKTRLPRRARP,./data/raw/alphafold//AF-P13686-F1-model_v4.pdb,1141,740,432,492
+1510,15816,16043,MKIISAEQVHQNLNFEELIPLLKQSFSRPFSMPQRQVYSLAPEQSENHDAFALLPSWNEEVIGNKAFTYFPDNAKKHDLPGLFSKIMLFKRQTGEPLALVDGTSVTYWRTAAISALASQLLSRKNSQHLMLFGTGNLASYLVKAHLTVRDIKQVTLWGRNAKKVSKLIADFSILYPAVTFKTSVDVNAEVASADIICCATGAKTPLFDGNSVSAGCHIDCLGNHMTDARECDTTTILRARVFVDSLTNTLNEAGELLIPMAEDAFNKDEIVGELADMCKTPSMLRQSSDEITLFKSVGTAISDLVAAHSVVEKLAD,sabio,Q485R8,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)C1CCCCN1>>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)C1=NCCCC1.[H],76.8,6.503258167574442e-15,30.0,10.5,1.5.1.49,28229.0,1.885361220031512,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)C1CCCCN1,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)C1=NCCCC1.[H],1.885361220031512,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)C1CCCCN1__MKIISAEQVHQNLNFEELIPLLKQSFSRPFSMPQRQVYSLAPEQSENHDAFALLPSWNEEVIGNKAFTYFPDNAKKHDLPGLFSKIMLFKRQTGEPLALVDGTSVTYWRTAAISALASQLLSRKNSQHLMLFGTGNLASYLVKAHLTVRDIKQVTLWGRNAKKVSKLIADFSILYPAVTFKTSVDVNAEVASADIICCATGAKTPLFDGNSVSAGCHIDCLGNHMTDARECDTTTILRARVFVDSLTNTLNEAGELLIPMAEDAFNKDEIVGELADMCKTPSMLRQSSDEITLFKSVGTAISDLVAAHSVVEKLAD,./data/raw/alphafold//AF-Q485R8-F1-model_v4.pdb,2537,4561,4491,4390
+1511,10752,10907,MTILVVTGTGTGVGKTVVCAALASAARQAGIDVAVCKPVQTGTARGDDDLAEVGRLAGVTQLAGLARYPQPMAPAAAAEHAGMALPARDQIVRLIADLDRPGRLTLVEGAGGLLVELAEPGVTLRDVAVDVAAAALVVVTADLGTLNHTKLTLEALAAQQVSCAGLVIGSWPDPPGLVAASNRSALARIAMVRAALPAGAASLDAGDFAAMSAAAFDRNWVAGLVG,brenda,P9WPQ5,C[C@H](N)[C@H](N)CCCCCC(=O)O.O=C([O-])O.O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O.[Na+]>>C[C@@H]1N=C(O)N[C@@H]1CCCCCC(=O)O.O=P(O)(O)O.O=P(O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O.[Na+].[OH-],10.2,7.278817898464807e-15,37.0,7.5,6.3.3.3,1773.0,1.0086001717619175,C[C@H](N)[C@H](N)CCCCCC(=O)O.O=C([O-])O.O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O.[Na+],C[C@@H]1N=C(O)N[C@@H]1CCCCCC(=O)O.O=P(O)(O)O.O=P(O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O.[Na+].[OH-],1.0086001717619175,C[C@H](N)[C@H](N)CCCCCC(=O)O.O=C([O-])O.O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O.[Na+]__MTILVVTGTGTGVGKTVVCAALASAARQAGIDVAVCKPVQTGTARGDDDLAEVGRLAGVTQLAGLARYPQPMAPAAAAEHAGMALPARDQIVRLIADLDRPGRLTLVEGAGGLLVELAEPGVTLRDVAVDVAAAALVVVTADLGTLNHTKLTLEALAAQQVSCAGLVIGSWPDPPGLVAASNRSALARIAMVRAALPAGAASLDAGDFAAMSAAAFDRNWVAGLVG,./data/raw/alphafold//AF-P9WPQ5-F1-model_v4.pdb,2946,1681,3291,2090
+1512,64,65,MLQPNMPAPNFSGQAVVGKEFETISLSDYKGKWVILAFYPLDFTFVCPTEIIAISDQMEQFAQRNCAVIFCSTDSVYSHLQWTKMDRKVGGIGQLNFPLLADKNMSVSRAFGVLDEEQGNTYRGNFLIDPKGVLRQITVNDDPVGRSVEEALRLLDAFIFHEEHGEVCPANWKPKSKTIVPTPDGSKAYFSSAN,sabio,P91883,*C(=O)C(CS)NC(=O)C(*)CS.OO>>*C(=O)C1CSSCC(*)C(=O)N1.O,15.8,4.155067152250981,22.0,7.0,1.11.1.15,6192.0,1.1986570869544226,*C(=O)C(CS)NC(=O)C(*)CS.OO,*C(=O)C1CSSCC(*)C(=O)N1.O,1.1986570869544226,*C(=O)C(CS)NC(=O)C(*)CS.OO__MLQPNMPAPNFSGQAVVGKEFETISLSDYKGKWVILAFYPLDFTFVCPTEIIAISDQMEQFAQRNCAVIFCSTDSVYSHLQWTKMDRKVGGIGQLNFPLLADKNMSVSRAFGVLDEEQGNTYRGNFLIDPKGVLRQITVNDDPVGRSVEEALRLLDAFIFHEEHGEVCPANWKPKSKTIVPTPDGSKAYFSSAN,./data/raw/alphafold//AF-P91883-F1-model_v4.pdb,1599,413,51,53
+1513,6529,6642,MSEKYVAVEGRRVRYLVGGSGRPVVLLHGWSFNADTWVESGVFNSLAGHFAVYAIDMPYGIRTKSERFQAPRREYAVFLRRVLDALDLADPPLVGPSASGEVVLWYVAKRLPTRAAVVVGPVGLAGELLEELRGAGVPILAVWGEGDEVSPPSRASLLRDVAKVVILRDAGHAAYLDKPGEFVEVVLDFLRGVY,brenda,G7VG08,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,9.12,0.0,80.0,8.0,3.1.1.1,2004705.0,0.959994838328416,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,0.959994838328416,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MSEKYVAVEGRRVRYLVGGSGRPVVLLHGWSFNADTWVESGVFNSLAGHFAVYAIDMPYGIRTKSERFQAPRREYAVFLRRVLDALDLADPPLVGPSASGEVVLWYVAKRLPTRAAVVVGPVGLAGELLEELRGAGVPILAVWGEGDEVSPPSRASLLRDVAKVVILRDAGHAAYLDKPGEFVEVVLDFLRGVY,./data/raw/alphafold//AF-G7VG08-F1-model_v4.pdb,1496,1045,870,1201
+1514,22006,22337,MGVPFFSSLRCMVDLGPCWAGGLTAEMKLLLALAGLLAILATPQPSEGAAPAVLGEVDTSLVLSSMEEAKQLVDKAYKERRESIKQRLRSGSASPMELLSYFKQPVAATRTAVRAADYLHVALDLLERKLRSLWRRPFNVTDVLTPAQLNVLSKSSGCAYQDVGVTCPEQDKYRTITGMCNNRRSPTLGASNRAFVRWLPAEYEDGFSLPYGWTPGVKRNGFPVALARAVSNEIVRFPTDQLTPDQERSLMFMQWGQLLDHDLDFTPEPAARASFVTGVNCETSCVQQPPCFPLKIPPNDPRIKNQADCIPFFRSCPACPGSNITIRNQINALTSFVDASMVYGSEEPLARNLRNMSNQLGLLAVNQRFQDNGRALLPFDNLHDDPCLLTNRSARIPCFLAGDTRSSEMPELTSMHTLLLREHNRLATELKSLNPRWDGERLYQEARKIVGAMVQIITYRDYLPLVLGPTAMRKYLPTYRSYNDSVDPRIANVFTNAFRYGHTLIQPFMFRLDNRYQPMEPNPRVPLSRVFFASWRVVLEGGIDPILRGLMATPAKLNRQNQIAVDEIRERLFEQVMRIGLDLPALNMQRSRDHGLPGYNAWRRFCGLPQPETVGQLGTVLRNLKLARKLMEQYGTPNNIDIWMGGVSEPLKRKGRVGPLLACIIGTQFRKLRDGDRFWWENEGVFSMQQRQALAQISLPRIICDNTGITTVSKNNIFMSNSYPRDFVNCSTLPALNLASWREAS,uniprot_search,P05164,O=N[O-].OO>>,0.7,98.76572162085436,21.0,7.4,1.11.2.2,9606.0,-0.1549019599857432,O=N[O-].OO,,-0.1549019599857432,O=N[O-].OO__MGVPFFSSLRCMVDLGPCWAGGLTAEMKLLLALAGLLAILATPQPSEGAAPAVLGEVDTSLVLSSMEEAKQLVDKAYKERRESIKQRLRSGSASPMELLSYFKQPVAATRTAVRAADYLHVALDLLERKLRSLWRRPFNVTDVLTPAQLNVLSKSSGCAYQDVGVTCPEQDKYRTITGMCNNRRSPTLGASNRAFVRWLPAEYEDGFSLPYGWTPGVKRNGFPVALARAVSNEIVRFPTDQLTPDQERSLMFMQWGQLLDHDLDFTPEPAARASFVTGVNCETSCVQQPPCFPLKIPPNDPRIKNQADCIPFFRSCPACPGSNITIRNQINALTSFVDASMVYGSEEPLARNLRNMSNQLGLLAVNQRFQDNGRALLPFDNLHDDPCLLTNRSARIPCFLAGDTRSSEMPELTSMHTLLLREHNRLATELKSLNPRWDGERLYQEARKIVGAMVQIITYRDYLPLVLGPTAMRKYLPTYRSYNDSVDPRIANVFTNAFRYGHTLIQPFMFRLDNRYQPMEPNPRVPLSRVFFASWRVVLEGGIDPILRGLMATPAKLNRQNQIAVDEIRERLFEQVMRIGLDLPALNMQRSRDHGLPGYNAWRRFCGLPQPETVGQLGTVLRNLKLARKLMEQYGTPNNIDIWMGGVSEPLKRKGRVGPLLACIIGTQFRKLRDGDRFWWENEGVFSMQQRQALAQISLPRIICDNTGITTVSKNNIFMSNSYPRDFVNCSTLPALNLASWREAS,./data/raw/alphafold//AF-P05164-F1-model_v4.pdb,1379,882,679,968
+1515,9095,9237,MMKGWIKCGLAGAVVLMASFWGGSVRAAGMSLTQVSGPVYVVEDNYYVQENSMVYFGAKGVTVVGATWTPDTARELHKLIKRVSSKPVLEVINNNYHTDRAGGNAYWKSIGAKVVSTRQTRELMKSDWAEIVAFTRKGLPEYPDLPLVLPNVVHDGDFTLQEGKLRAFYAGPAHTPDGIFVYFPDEQVLYGNCILKEKLGNLSFADVKAYPQTLERLKAMKLPIKTVVGGHDSPLHGPELIDHYEALIKAATHS,sabio,Q6X1Y9,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1.O>>,0.07,99.78924695830672,30.0,7.0,3.5.2.6,644.0,-1.154901959985743,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1.O,,-1.154901959985743,CON=C(C(=O)NC1C(=O)N2C(C(=O)O)=C(COC(C)=O)CSC12)c1csc(N)n1.O__MMKGWIKCGLAGAVVLMASFWGGSVRAAGMSLTQVSGPVYVVEDNYYVQENSMVYFGAKGVTVVGATWTPDTARELHKLIKRVSSKPVLEVINNNYHTDRAGGNAYWKSIGAKVVSTRQTRELMKSDWAEIVAFTRKGLPEYPDLPLVLPNVVHDGDFTLQEGKLRAFYAGPAHTPDGIFVYFPDEQVLYGNCILKEKLGNLSFADVKAYPQTLERLKAMKLPIKTVVGGHDSPLHGPELIDHYEALIKAATHS,./data/raw/alphafold//AF-Q6X1Y9-F1-model_v4.pdb,1463,1689,3301,1133
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+1528,7638,7761,MTMLGMTKRLLLSAAVLAGLSGAVAAHAAPKQDLKGTNVVLVHGAFADGSSWSRVIPLLEARGLHVVAVQNPLSSLADDTAATRRAIDAQTGPVVLVGHSWAGVVISEAGNDAKVKSLVYVAAFAPDDGQSIADVTQGLPAPAWAGELRKDAAGFTTLSDRAIAQDFAPDLSPAQQRVVAATQGPWYGGCISEKVTRAAWHAKPSSFVVATQDRMIDPKLQDAMAKRIGATVTHVRASHVAMLSQPKAVADAIIAAAERAQHDAR,brenda,A0A024CDT8,CCCCOC(=O)C(C)Oc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1.O>>CCCCO.C[C@@H](Oc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)C(=O)O,4.46,0.0,37.0,7.0,3.1.1.1,1497523.0,0.6493348587121419,CCCCOC(=O)C(C)Oc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1.O,CCCCO.C[C@@H](Oc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)C(=O)O,0.6493348587121419,CCCCOC(=O)C(C)Oc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1.O__MTMLGMTKRLLLSAAVLAGLSGAVAAHAAPKQDLKGTNVVLVHGAFADGSSWSRVIPLLEARGLHVVAVQNPLSSLADDTAATRRAIDAQTGPVVLVGHSWAGVVISEAGNDAKVKSLVYVAAFAPDDGQSIADVTQGLPAPAWAGELRKDAAGFTTLSDRAIAQDFAPDLSPAQQRVVAATQGPWYGGCISEKVTRAAWHAKPSSFVVATQDRMIDPKLQDAMAKRIGATVTHVRASHVAMLSQPKAVADAIIAAAERAQHDAR,./data/raw/alphafold//AF-A0A024CDT8-F1-model_v4.pdb,3341,2204,3891,2762
+1529,11874,12032,MSEEIITPVYCTGVSAQVQKQRARELGLGRHENAIKYLGQDYEQLRVRCLQSGTLFRDEAFPPVPQSLGYKDLGPNSSKTYGIKWKRPTELLSNPQFIVDGATRTDICQGALGDCWLLAAIASLTLNDTLLHRVVPHGQSFQNGYAGIFHFQLWQFGEWVDVVVDDLLPIKDGKLVFVHSAEGNEFWSALLEKAYAKVNGSYEALSGGSTSEGFEDFTGGVTEWYELRKAPSDLYQIILKALERGSLLGCSIDISSVLDMEAITFKKLVKGHAYSVTGAKQVNYRGQVVSLIRMRNPWGEVEWTGAWSDSSSEWNNVDPYERDQLRVKMEDGEFWMSFRDFMREFTRLEICNLTPDALKSRTIRKWNTTLYEGTWRRGSTAGGCRNYPATFWVNPQFKIRLDETDDPDDYGDRESGCSFVLALMQKHRRRERRFGRDMETIGFAVYEVPPELVGQPAVHLKRDFFLANASRARSEQFINLREVSTRFRLPPGEYVVVPSTFEPNKEGDFVLRFFSEKSAGTVELDDQIQANLPDEQVLSEEEIDENFKALFRQLAGEDMEISVKELRTILNRIISKHKDLRTKGFSLESCRSMVNLMDRDGNGKLGLVEFNILWNRIRNYLSIFRKFDLDKSGSMSAYEMRMAIESAGFKLNKKLYELIITRYSEPDLAVDFDNFVCCLVRLETMFRFFKTLDTDLDGVVTFDLFKWLQLTMFA,uniprot_search,P07384,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CC(C)C)N=C(O)OCc3ccccc3)ccc12.O>>CC(C)C[C@H](N=C(O)OCc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,0.02,9.51856105910363e-15,30.0,7.5,3.4.22.52,9606.0,-1.6989700043360187,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CC(C)C)N=C(O)OCc3ccccc3)ccc12.O,CC(C)C[C@H](N=C(O)OCc1ccccc1)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,-1.6989700043360187,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](CC(C)C)N=C(O)OCc3ccccc3)ccc12.O__MSEEIITPVYCTGVSAQVQKQRARELGLGRHENAIKYLGQDYEQLRVRCLQSGTLFRDEAFPPVPQSLGYKDLGPNSSKTYGIKWKRPTELLSNPQFIVDGATRTDICQGALGDCWLLAAIASLTLNDTLLHRVVPHGQSFQNGYAGIFHFQLWQFGEWVDVVVDDLLPIKDGKLVFVHSAEGNEFWSALLEKAYAKVNGSYEALSGGSTSEGFEDFTGGVTEWYELRKAPSDLYQIILKALERGSLLGCSIDISSVLDMEAITFKKLVKGHAYSVTGAKQVNYRGQVVSLIRMRNPWGEVEWTGAWSDSSSEWNNVDPYERDQLRVKMEDGEFWMSFRDFMREFTRLEICNLTPDALKSRTIRKWNTTLYEGTWRRGSTAGGCRNYPATFWVNPQFKIRLDETDDPDDYGDRESGCSFVLALMQKHRRRERRFGRDMETIGFAVYEVPPELVGQPAVHLKRDFFLANASRARSEQFINLREVSTRFRLPPGEYVVVPSTFEPNKEGDFVLRFFSEKSAGTVELDDQIQANLPDEQVLSEEEIDENFKALFRQLAGEDMEISVKELRTILNRIISKHKDLRTKGFSLESCRSMVNLMDRDGNGKLGLVEFNILWNRIRNYLSIFRKFDLDKSGSMSAYEMRMAIESAGFKLNKKLYELIITRYSEPDLAVDFDNFVCCLVRLETMFRFFKTLDTDLDGVVTFDLFKWLQLTMFA,./data/raw/alphafold//AF-P07384-F1-model_v4.pdb,3615,3589,3154,1925
+1530,18173,18429,MVDTHKLADDVLQLLDNRIEDNYRVCVILVGSPGSGKSTIAEELCQIINEKYHTFLSEHPNVIEVNDRLKPMVNLVDSLKTLQPNKVAEMIENQGLFKDHVEDVNFQPVKYSALTSNNEECTAVVARGGTANAIRIAAVDNPVNVNKLAQDSINIAQIVPMDGFHLSRRCLDLFKDPQTAHKRRGSPSTFDSNNFLQLCKILAKTSLCKVSSHHKFYSTSSVFEKLSKTFSQTIPDIFVPGFNHALKDPTPDQYCISKFTRIVILEGLYLLYDQENWKKIYKTLADTGALLVYKIDIDYEATEERVAKRHLQSGLVTTIAEGREKFRSNDLLNGRDIDNHLIKVDNIVHIRND,sabio,P43591,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,0.0237,1.0812962383427719e-14,25.0,8.0,2.7.1.-,4932.0,-1.6252516539898962,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,-1.6252516539898962,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O__MVDTHKLADDVLQLLDNRIEDNYRVCVILVGSPGSGKSTIAEELCQIINEKYHTFLSEHPNVIEVNDRLKPMVNLVDSLKTLQPNKVAEMIENQGLFKDHVEDVNFQPVKYSALTSNNEECTAVVARGGTANAIRIAAVDNPVNVNKLAQDSINIAQIVPMDGFHLSRRCLDLFKDPQTAHKRRGSPSTFDSNNFLQLCKILAKTSLCKVSSHHKFYSTSSVFEKLSKTFSQTIPDIFVPGFNHALKDPTPDQYCISKFTRIVILEGLYLLYDQENWKKIYKTLADTGALLVYKIDIDYEATEERVAKRHLQSGLVTTIAEGREKFRSNDLLNGRDIDNHLIKVDNIVHIRND,./data/raw/alphafold//AF-P43591-F1-model_v4.pdb,38,2507,2795,5641
+1531,5941,6035,MMRKSVRRAMLMTTACVSLLLASVPLCAQANDVQQKLAALEKSSGGRLGVALINTADNTQTLYRADERFAMCSTSKVMAAAAVLKQSETQKGLLSQRVEIKPSDLINYNPIAEKHVNGTMTFGELSAAALQYSDNTAMNKLIAHLGGPDKVTAFARTIGDDTFRLDRTEPTLNTAIPGDPRDTTTPLAMAQALRNLTLGNALGDTQRAQLVMWLKGNTTGAASIRAGLPTSWVVGDKTGSGDYGTTNDIAVIWPEGRAPLVLVTYFTQSEPKAESRRDVLAAAARIVTDGY,sabio,Q8GD10,CC1C(NC(=O)C(=NOC(C)(C)C(=O)O)c2csc([N+])n2)C(=O)N1S(=O)(=O)[O-].O>>,100.0,99.77848220436788,37.0,7.0,3.5.2.6,573.0,2.0,CC1C(NC(=O)C(=NOC(C)(C)C(=O)O)c2csc([N+])n2)C(=O)N1S(=O)(=O)[O-].O,,2.0,CC1C(NC(=O)C(=NOC(C)(C)C(=O)O)c2csc([N+])n2)C(=O)N1S(=O)(=O)[O-].O__MMRKSVRRAMLMTTACVSLLLASVPLCAQANDVQQKLAALEKSSGGRLGVALINTADNTQTLYRADERFAMCSTSKVMAAAAVLKQSETQKGLLSQRVEIKPSDLINYNPIAEKHVNGTMTFGELSAAALQYSDNTAMNKLIAHLGGPDKVTAFARTIGDDTFRLDRTEPTLNTAIPGDPRDTTTPLAMAQALRNLTLGNALGDTQRAQLVMWLKGNTTGAASIRAGLPTSWVVGDKTGSGDYGTTNDIAVIWPEGRAPLVLVTYFTQSEPKAESRRDVLAAAARIVTDGY,./data/raw/alphafold//AF-Q8GD10-F1-model_v4.pdb,1458,649,811,1083
+1532,604,623,MNHSLKPWNTFGIDHNAQHIVCAEDEQQLLNAWQYATAEGQPVLILGEGSNVLFLEDYRGTVIINRIKGIEIHDEPDAWYLHVGAGENWHRLVKYTLQEGMPGLENLALIPGCVGSSPIQNIGAYGVELQRVCAYVDSVELATGKQVRLTAKECRFGYRDSIFKHEYQDRFAIVAVGLRLPKEWQPVLTYGDLTRLDPTTVTPQQVFNAVCHMRTTKLPDPKVNGNAGSFFKNPVVSAETAKALLSQFPTAPNYPQADGSVKLAAGWLIDQCQLKGMQIGGAAVHRQQALVLINEDNAKSEDVVQLAHHVRQKVGEKFNVWLEPEVRFIGASGEVSAVETIS,sabio,P08373,C=C(OC1C(O)C(CO)OC(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)C1NC(C)=O)C(=O)O.[H]>>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,36.0,0.0741815741212223,37.0,8.0,1.3.1.98,562.0,1.5563025007672873,C=C(OC1C(O)C(CO)OC(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)C1NC(C)=O)C(=O)O.[H],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,1.5563025007672873,C=C(OC1C(O)C(CO)OC(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)C(O)C2O)C1NC(C)=O)C(=O)O.[H]__MNHSLKPWNTFGIDHNAQHIVCAEDEQQLLNAWQYATAEGQPVLILGEGSNVLFLEDYRGTVIINRIKGIEIHDEPDAWYLHVGAGENWHRLVKYTLQEGMPGLENLALIPGCVGSSPIQNIGAYGVELQRVCAYVDSVELATGKQVRLTAKECRFGYRDSIFKHEYQDRFAIVAVGLRLPKEWQPVLTYGDLTRLDPTTVTPQQVFNAVCHMRTTKLPDPKVNGNAGSFFKNPVVSAETAKALLSQFPTAPNYPQADGSVKLAAGWLIDQCQLKGMQIGGAAVHRQQALVLINEDNAKSEDVVQLAHHVRQKVGEKFNVWLEPEVRFIGASGEVSAVETIS,./data/raw/alphafold//AF-P08373-F1-model_v4.pdb,1110,693,382,433
+1533,21312,21636,MTQAKIESIETILVDLPTVRPHKLAMHTISQQTLVIIRLRCSDGIEGLGESTTVGGLSYANESPESIKTNIDVHLAPALIGMDASNFNAAMQRLDRIAKGNTFAKSGLESALLDAQGKRQGVAVSQLLGGRVRDSLEVGWVLASGNTARDIAEAEHFLDVRRHRIFKVKIGANPLEQDLKHVVAIKQALGDRASVRVDVNQYWDEAQAIRGCQVLGDNGIDLIEQPISRINRAGQVRLNQRSLAPIMADESIESVEDAFSLAADGAASVFALKIAKNGGPRAVLRTAQIAESAGIALYGATMLEGAIGTLASAHAFLTLKKLAWGTELFGPLLLTEEIVNEAPVYRDFELHVPNTPGLGVSLDEERLALFRRR,sabio,Q4KPK2,O=C(O)C=CC(Cl)=CC(=O)O>>C=C1C=CC(=O)O1.Cl.O=C=O,432000.0,0.0,25.0,7.5,5.5.1.1,395598.0,5.635483746814912,O=C(O)C=CC(Cl)=CC(=O)O,C=C1C=CC(=O)O1.Cl.O=C=O,5.635483746814912,O=C(O)C=CC(Cl)=CC(=O)O__MTQAKIESIETILVDLPTVRPHKLAMHTISQQTLVIIRLRCSDGIEGLGESTTVGGLSYANESPESIKTNIDVHLAPALIGMDASNFNAAMQRLDRIAKGNTFAKSGLESALLDAQGKRQGVAVSQLLGGRVRDSLEVGWVLASGNTARDIAEAEHFLDVRRHRIFKVKIGANPLEQDLKHVVAIKQALGDRASVRVDVNQYWDEAQAIRGCQVLGDNGIDLIEQPISRINRAGQVRLNQRSLAPIMADESIESVEDAFSLAADGAASVFALKIAKNGGPRAVLRTAQIAESAGIALYGATMLEGAIGTLASAHAFLTLKKLAWGTELFGPLLLTEEIVNEAPVYRDFELHVPNTPGLGVSLDEERLALFRRR,./data/raw/alphafold//AF-Q4KPK2-F1-model_v4.pdb,1022,3058,595,682
+1534,18384,18644,MLRLMKYFTFAVYFSLLAVLLSIFISNYKIIPSWAISISKIYPLKITNSSFKATMSTIPADHPYYKELEIASIAVIRTSILTKKLSDSIATTQKSGTHTKDDKSPVTIGDYASQAIINHAIKLNFPEDEIVGEEDAEVLRKDDAEGKDLSAKVLEIISDVQSQTSQYNNRLGKLEKETEIYDSIDLGNSQGGSKGRFWALDPIDGTKGFLRGDQFAVCLALIEDGKVVLGVIGCPNLPATVVSNEEMSGARGGLFSAVRGVGSFYSNLFDKQDFTPLSKQERIQMTQHTTPESLKVVEGVEKGHSSHSTQSQIKDKLGFNTETVSKQTINLDSQVKYCVLAKGQADIYLRLPISDTYREKIWDHAAGNILVYESGGLVGDIHGNELNFGNGRHLNSQGVVAGNKSVFKKVIEAVSDVLKA,uniprot_search,Q69FG3,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O.O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,2.94,6.376612438897244e-15,30.0,7.5,3.1.3.7,4959.0,0.4683473304121572,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O.O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)O,0.4683473304121572,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O.O__MLRLMKYFTFAVYFSLLAVLLSIFISNYKIIPSWAISISKIYPLKITNSSFKATMSTIPADHPYYKELEIASIAVIRTSILTKKLSDSIATTQKSGTHTKDDKSPVTIGDYASQAIINHAIKLNFPEDEIVGEEDAEVLRKDDAEGKDLSAKVLEIISDVQSQTSQYNNRLGKLEKETEIYDSIDLGNSQGGSKGRFWALDPIDGTKGFLRGDQFAVCLALIEDGKVVLGVIGCPNLPATVVSNEEMSGARGGLFSAVRGVGSFYSNLFDKQDFTPLSKQERIQMTQHTTPESLKVVEGVEKGHSSHSTQSQIKDKLGFNTETVSKQTINLDSQVKYCVLAKGQADIYLRLPISDTYREKIWDHAAGNILVYESGGLVGDIHGNELNFGNGRHLNSQGVVAGNKSVFKKVIEAVSDVLKA,./data/raw/alphafold//AF-Q69FG3-F1-model_v4.pdb,87,2568,2865,5713
+1535,17016,17246,MSQSPDVIEQQHTNRVPKDKQPFPSAQHRHPLDPLRWDEILLARSVLLNSSLLTEGHPTVHIITLETPEKEEVLNWKPGQLPAPLRRAYVETILFGKTHKIVVDVAAGALVSDEIHHAPGYPSLSSNDILIVATLPSTHPPFLQSLKARGVGVSDVVCLPISPGWFGIPEEEGKRLVKALCYNKNGSANVFMRPLEGIVILLDLDRKQILKYVDDRKVPIPKVEGTDYRLFAQKPPLMKPLNPISLEQPLGPSFKVEGNLVKWANWEFHVRPDFRAGMVISQAVIHDPETGEARSVLYEGFPSELFVPYMDPSEGWYFKTYMDSGEYGLGMLALPLQPLNDCPRNAHYFDAVFAGPDGNPYVTPNILCVFERYAGDVAWRHSEAFVQDFEVHEVRPKVTLVVRMVGSVGNYDYIFDWEFQTDGILRVNVGMTGLLMVKATSINSIAENIVDLHGTLVSENTIGVFHDHFINFHLDLDIDGLTNTFIKKILKRKNVVNNESPRKSYWTTENQIAETEDDAKIRLKAFEPSEFHIVNSKKRTRLGNPVGYRIVPGFTADSLLSSVDPPQHRAAFIDNQIWVTPLNKSERWAGGLFVYESHGEDTLAVWSKRNRAIQGRDIVLWYTMGFHHVPCQEDFPIMPTLSGSFELKPSNFLERNPILKTLPNYPSQLPKCSIGSHVDER,brenda,I6NC69,NCCc1ccccn1.O.O=O>>N.O=Cc1ccccn1.OO,2.9,4.233403050030026,25.0,8.0,1.4.3.21,355589.0,0.4623979978989561,NCCc1ccccn1.O.O=O,N.O=Cc1ccccn1.OO,0.4623979978989561,NCCc1ccccn1.O.O=O__MSQSPDVIEQQHTNRVPKDKQPFPSAQHRHPLDPLRWDEILLARSVLLNSSLLTEGHPTVHIITLETPEKEEVLNWKPGQLPAPLRRAYVETILFGKTHKIVVDVAAGALVSDEIHHAPGYPSLSSNDILIVATLPSTHPPFLQSLKARGVGVSDVVCLPISPGWFGIPEEEGKRLVKALCYNKNGSANVFMRPLEGIVILLDLDRKQILKYVDDRKVPIPKVEGTDYRLFAQKPPLMKPLNPISLEQPLGPSFKVEGNLVKWANWEFHVRPDFRAGMVISQAVIHDPETGEARSVLYEGFPSELFVPYMDPSEGWYFKTYMDSGEYGLGMLALPLQPLNDCPRNAHYFDAVFAGPDGNPYVTPNILCVFERYAGDVAWRHSEAFVQDFEVHEVRPKVTLVVRMVGSVGNYDYIFDWEFQTDGILRVNVGMTGLLMVKATSINSIAENIVDLHGTLVSENTIGVFHDHFINFHLDLDIDGLTNTFIKKILKRKNVVNNESPRKSYWTTENQIAETEDDAKIRLKAFEPSEFHIVNSKKRTRLGNPVGYRIVPGFTADSLLSSVDPPQHRAAFIDNQIWVTPLNKSERWAGGLFVYESHGEDTLAVWSKRNRAIQGRDIVLWYTMGFHHVPCQEDFPIMPTLSGSFELKPSNFLERNPILKTLPNYPSQLPKCSIGSHVDER,./data/raw/alphafold//AF-I6NC69-F1-model_v4.pdb,3560,3815,2397,5300
+1536,22186,22519,MSLLATVGPTGGVKNRLDIVDFVRDEKFFTLYVRALQAIQDKDQADYSSFFQLSGIHGLPFTPWAKPKDTPTVPYESGYCTHSQVLFPTWHRVYVSIYEQVLQEAAKGIAKKFTVHKKEWVQAAEDLRQPYWDTGFALVPPDEIIKLEQVKITNYDGTKITVRNPILRYSFHPIDPSFSGYPNFDTWRTTVRNPDADKKENIPALIAKLDLEADSTREKTYNMLKFNANWEAFSNHGEFDDTHANSLEAVHDDIHGFVGRGAIRGHMTHALFAAFDPIFWLHHSNVDRHLSLWQALYPGVWVTQGPEREGSMGFAPGTELNKDSALEPFYETEDKPWTSVPLTDTALLNYSYPDFDKVKGGTPDLVRDYINDHIDRRYGIKKSEGGKNPALDLLSDFKGVTHDHNEDLKMFDWTIQASWKKFELDDSFAIIFYFAADGSTNVTKENYIGSINIFRGTTPTNCANCRTQDNLVQEGFVHLDRFIARDLDTFDPQAVHRYLKEKKLSYKVVADDHSVTLKSLRIRVQGRPLHLPPGVSFPRLDKNIPIVNFDDVLDLVTGVVNIGLTAVGATAGVAIGVVGATAGTAIGVAGAATDAVTNIAKGGLGALGRIF,brenda,C7FF05,O=O.Oc1ccccc1>>O.O=C1C=CC=CC1=O,11.3,0.0,25.0,6.8,1.14.18.1,5341.0,1.0530784434834195,O=O.Oc1ccccc1,O.O=C1C=CC=CC1=O,1.0530784434834195,O=O.Oc1ccccc1__MSLLATVGPTGGVKNRLDIVDFVRDEKFFTLYVRALQAIQDKDQADYSSFFQLSGIHGLPFTPWAKPKDTPTVPYESGYCTHSQVLFPTWHRVYVSIYEQVLQEAAKGIAKKFTVHKKEWVQAAEDLRQPYWDTGFALVPPDEIIKLEQVKITNYDGTKITVRNPILRYSFHPIDPSFSGYPNFDTWRTTVRNPDADKKENIPALIAKLDLEADSTREKTYNMLKFNANWEAFSNHGEFDDTHANSLEAVHDDIHGFVGRGAIRGHMTHALFAAFDPIFWLHHSNVDRHLSLWQALYPGVWVTQGPEREGSMGFAPGTELNKDSALEPFYETEDKPWTSVPLTDTALLNYSYPDFDKVKGGTPDLVRDYINDHIDRRYGIKKSEGGKNPALDLLSDFKGVTHDHNEDLKMFDWTIQASWKKFELDDSFAIIFYFAADGSTNVTKENYIGSINIFRGTTPTNCANCRTQDNLVQEGFVHLDRFIARDLDTFDPQAVHRYLKEKKLSYKVVADDHSVTLKSLRIRVQGRPLHLPPGVSFPRLDKNIPIVNFDDVLDLVTGVVNIGLTAVGATAGVAIGVVGATAGTAIGVAGAATDAVTNIAKGGLGALGRIF,./data/raw/alphafold//AF-C7FF05-F1-model_v4.pdb,1606,1194,2526,5344
+1537,7274,7396,MKQASAIPQPKTYGPLKNLPHLEKEQLSQSLWRIADELGPIFRFDFPGVSSVFVSGHNLVAEVCDEKRFDKNLGKGLQKVREFGGDGLFTSWTHEPNWQKAHRILLPSFSQKAMKGYHSMMLDIATQLIQKWSRLNPNEEIDVADDMTRLTLDTIGLCGFNYRFNSFYRDSQHPFITSMLRALKEAMNQSKRLGLQDKMMVKTKLQFQKDIEVMNSLVDRMIAERKANPDENIKDLLSLMLYAKDPVTGETLDDENIRYQIITFLIAGHETTSGLLSFAIYCLLTHPEKLKKAQEEADRVLTDDTPEYKQIQQLKYIRMVLNETLRLYPTAPAFSLYAKEDTVLGGEYPISKGQPVTVLIPKLHRDQNAWGPDAEDFRPERFEDPSSIPHHAYKPFGNGQRACIGMQFALQEATMVLGLVLKHFELINHTGYELKIKEALTIKPDDFKITVKPRKTAAINVQRKEQADIKAETKPKETKPKHGTPLLVLFGSNLGTAEGIAGELAAQGRQMGFTAETAPLDDYIGKLPEEGAVVIVTASYNGAPPDNAAGFVEWLKELEEGQLKGVSYAVFGCGNRSWASTYQRIPRLIDDMMKAKGASRLTAIGEGDAADDFESHRESWENRFWKETMDAFDINEIAQKEDRPSLSITFLSEATETPVAKAYGAFEGIVLENRELQTAASTRSTRHIELEIPAGKTYKEGDHIGILPKNSRELVQRVLSRFGLQSNHVIKVSGSAHMAHLPMDRPIKVVDLLSSYVELQEPASRLQLRELASYTVCPPHQKELEQLVSDDGIYKEQVLAKRLTMLDFLEDYPACEMPFERFLALLPSLKPRYYSISSSPKVHANIVSMTVGVVKASAWSGRGEYRGVASNYLAELNTGDAAACFIRTPQSGFQMPNDPETPMIMVGPGTGIAPFRGFIQARSVLKKEGSTLGEALLYFGCRRPDHDDLYREELDQAEQDGLVTIRRCYSRVENEPKGYVQHLLKQDTQKLMTLIEKGAHIYVCGDGSQMAPDVERTLRLAYEAEKAASQEESAVWLQKLQDQRRYVKDVWTGM,sabio,O08336,CCCCCCCCCCCC(=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,6240.0,12.41664920774774,30.0,7.4,1.14.14.1,1423.0,3.795184589682424,CCCCCCCCCCCC(=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,3.795184589682424,CCCCCCCCCCCC(=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]__MKQASAIPQPKTYGPLKNLPHLEKEQLSQSLWRIADELGPIFRFDFPGVSSVFVSGHNLVAEVCDEKRFDKNLGKGLQKVREFGGDGLFTSWTHEPNWQKAHRILLPSFSQKAMKGYHSMMLDIATQLIQKWSRLNPNEEIDVADDMTRLTLDTIGLCGFNYRFNSFYRDSQHPFITSMLRALKEAMNQSKRLGLQDKMMVKTKLQFQKDIEVMNSLVDRMIAERKANPDENIKDLLSLMLYAKDPVTGETLDDENIRYQIITFLIAGHETTSGLLSFAIYCLLTHPEKLKKAQEEADRVLTDDTPEYKQIQQLKYIRMVLNETLRLYPTAPAFSLYAKEDTVLGGEYPISKGQPVTVLIPKLHRDQNAWGPDAEDFRPERFEDPSSIPHHAYKPFGNGQRACIGMQFALQEATMVLGLVLKHFELINHTGYELKIKEALTIKPDDFKITVKPRKTAAINVQRKEQADIKAETKPKETKPKHGTPLLVLFGSNLGTAEGIAGELAAQGRQMGFTAETAPLDDYIGKLPEEGAVVIVTASYNGAPPDNAAGFVEWLKELEEGQLKGVSYAVFGCGNRSWASTYQRIPRLIDDMMKAKGASRLTAIGEGDAADDFESHRESWENRFWKETMDAFDINEIAQKEDRPSLSITFLSEATETPVAKAYGAFEGIVLENRELQTAASTRSTRHIELEIPAGKTYKEGDHIGILPKNSRELVQRVLSRFGLQSNHVIKVSGSAHMAHLPMDRPIKVVDLLSSYVELQEPASRLQLRELASYTVCPPHQKELEQLVSDDGIYKEQVLAKRLTMLDFLEDYPACEMPFERFLALLPSLKPRYYSISSSPKVHANIVSMTVGVVKASAWSGRGEYRGVASNYLAELNTGDAAACFIRTPQSGFQMPNDPETPMIMVGPGTGIAPFRGFIQARSVLKKEGSTLGEALLYFGCRRPDHDDLYREELDQAEQDGLVTIRRCYSRVENEPKGYVQHLLKQDTQKLMTLIEKGAHIYVCGDGSQMAPDVERTLRLAYEAEKAASQEESAVWLQKLQDQRRYVKDVWTGM,./data/raw/alphafold//AF-O08336-F1-model_v4.pdb,1826,1506,3080,1840
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+1540,9369,9511,MGSLASERKVVGWAARDATGHLSPYTYTLRNTGPEDVVVKVLYCGICHTDIHQAKNHLGASKYPMVPGHEVVGEVVEVGPEVSKYGVGDVVGVGVIVGCCRECSPCKANVEQYCNKKIWSYNDVYTDGRPTQGGFASTMVVDQKFVVKIPAGLAPEQAAPLLCAGVTVYSPLKAFGLTAPGLRGGIVGLGGVGHMGVKVAKAMGHHVTVISSSSKKRAEAMDHLGADAYLVSTDAAAMAAAADSLDYIIDTVPVHHPLEPYLSLLRLDGKHVLLGVIGEPLSFVSPMVMLGRKAITGSFIGSIDETAEVLQFCVDKGLTSQIEVVKMGYVNEALERLERNDVRYRFVVDVAGSNVEEDAADAPSN,brenda,A1ILL4,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)c1,31.75,0.0,30.0,6.5,1.1.1.195,4558.0,1.5017437296279943,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)c1,1.5017437296279943,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+]__MGSLASERKVVGWAARDATGHLSPYTYTLRNTGPEDVVVKVLYCGICHTDIHQAKNHLGASKYPMVPGHEVVGEVVEVGPEVSKYGVGDVVGVGVIVGCCRECSPCKANVEQYCNKKIWSYNDVYTDGRPTQGGFASTMVVDQKFVVKIPAGLAPEQAAPLLCAGVTVYSPLKAFGLTAPGLRGGIVGLGGVGHMGVKVAKAMGHHVTVISSSSKKRAEAMDHLGADAYLVSTDAAAMAAAADSLDYIIDTVPVHHPLEPYLSLLRLDGKHVLLGVIGEPLSFVSPMVMLGRKAITGSFIGSIDETAEVLQFCVDKGLTSQIEVVKMGYVNEALERLERNDVRYRFVVDVAGSNVEEDAADAPSN,./data/raw/alphafold//AF-A1ILL4-F1-model_v4.pdb,3542,3485,1244,3178
+1541,6423,6534,MASVHGTTYELLRRQGIDTVFGNPGSNELPFLKDFPEDFRYILALQEACVVGIADGYAQASRKPAFINLHSAAGTGNAMGALSNAWNSHSPLIVTAGQQTRAMIGVEALLTNVDAANLPRPLVKWSYEPASAAEVPHAMSRAIHMASMAPQGPVYLSVPYDDWDKDADPQSHHLFDRHVSSSVRLNDQDLDILVKALNSASNPAIVLGPDVDAANANADCVMLAERLKAPVWVAPSAPRCPFPTRHPCFRGLMPAGIAAISQLLEGHDVVLVIGAPVFRYHQYDPGQYLKPGTRLISVTCDPLEAARAPMGDAIVADIGAMASALANLVEESSRQLPTAAPEPAKVDQDAGRLHPETVFDTLNDMAPENAIYLNESTSTTAQMWQRLNMRNPGSYYFCAAGGLGFALPAAIGVQLAEPERQVIAVIGDGSANYSISALWTAAQYNIPTIFVIMNNGTYGALRWFAGVLEAENVPGLDVPGIDFRALAKGYGVQALKADNLEQLKGSLQEALSAKGPVLIEVSTVSPVK,brenda,P20906,CCCC(=O)C(=O)O>>CCCC=O.O=C=O,44.3,1.2186024829527688e-14,30.0,6.0,4.1.1.7,303.0,1.6464037262230695,CCCC(=O)C(=O)O,CCCC=O.O=C=O,1.6464037262230695,CCCC(=O)C(=O)O__MASVHGTTYELLRRQGIDTVFGNPGSNELPFLKDFPEDFRYILALQEACVVGIADGYAQASRKPAFINLHSAAGTGNAMGALSNAWNSHSPLIVTAGQQTRAMIGVEALLTNVDAANLPRPLVKWSYEPASAAEVPHAMSRAIHMASMAPQGPVYLSVPYDDWDKDADPQSHHLFDRHVSSSVRLNDQDLDILVKALNSASNPAIVLGPDVDAANANADCVMLAERLKAPVWVAPSAPRCPFPTRHPCFRGLMPAGIAAISQLLEGHDVVLVIGAPVFRYHQYDPGQYLKPGTRLISVTCDPLEAARAPMGDAIVADIGAMASALANLVEESSRQLPTAAPEPAKVDQDAGRLHPETVFDTLNDMAPENAIYLNESTSTTAQMWQRLNMRNPGSYYFCAAGGLGFALPAAIGVQLAEPERQVIAVIGDGSANYSISALWTAAQYNIPTIFVIMNNGTYGALRWFAGVLEAENVPGLDVPGIDFRALAKGYGVQALKADNLEQLKGSLQEALSAKGPVLIEVSTVSPVK,./data/raw/alphafold//AF-P20906-F1-model_v4.pdb,1249,3066,603,691
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+1543,19281,19567,MKYLFIFCLFVAGVLAKHEIYDGHAVYQVDVASMDQVKLVHDFENDLMLDVWSDAVPGRPGKVLVPKFKREIFENFLKQSGVQYKLEVENVKEQLELEDQLLAAAAAKSNSTRSRLSFDKIHSYEEVDAYLQELAKEFPNVVTVVEGGKSFEGRSIKYLRISTTNFQDASKPVVMMQSLLHCREWVTLPATLYAIHKLVIDVTESDLINNIDWIILPVANPDGYVHTFGGDRYWRKNRATGYMAGNLCMGVDLNRNFGMNWGTASSSSVCSDTFHGRSAFSEPESSVIRDIIAEHRNRMALYLDIHSFGSMILYGYGNGVLPSNALQLHLIGVQMAQAIDRVKWSSNKDYIVGNIFHVLYAASGGASDYAMQAAAPFSYTYELPAYRNSVWFDGFLVDPDFIEQAGFETWEGIKVGARAAAAAAKELKKLNTA,sabio,O97389,O.O=C(O)CNC(=O)CNC(=O)OCc1ccccc1>>C1=CC=C(C=C1)COC(=O)NCC(=O)NCC(=O)O.CC(C)C(N)C(=O)O,0.3,14.825421845487073,25.0,8.0,3.4.17.1,29058.0,-0.5228787452803376,O.O=C(O)CNC(=O)CNC(=O)OCc1ccccc1,C1=CC=C(C=C1)COC(=O)NCC(=O)NCC(=O)O.CC(C)C(N)C(=O)O,-0.5228787452803376,O.O=C(O)CNC(=O)CNC(=O)OCc1ccccc1__MKYLFIFCLFVAGVLAKHEIYDGHAVYQVDVASMDQVKLVHDFENDLMLDVWSDAVPGRPGKVLVPKFKREIFENFLKQSGVQYKLEVENVKEQLELEDQLLAAAAAKSNSTRSRLSFDKIHSYEEVDAYLQELAKEFPNVVTVVEGGKSFEGRSIKYLRISTTNFQDASKPVVMMQSLLHCREWVTLPATLYAIHKLVIDVTESDLINNIDWIILPVANPDGYVHTFGGDRYWRKNRATGYMAGNLCMGVDLNRNFGMNWGTASSSSVCSDTFHGRSAFSEPESSVIRDIIAEHRNRMALYLDIHSFGSMILYGYGNGVLPSNALQLHLIGVQMAQAIDRVKWSSNKDYIVGNIFHVLYAASGGASDYAMQAAAPFSYTYELPAYRNSVWFDGFLVDPDFIEQAGFETWEGIKVGARAAAAAAKELKKLNTA,./data/raw/alphafold//AF-O97389-F1-model_v4.pdb,203,2719,5029,5881
+1544,15935,16162,MKSRIPVVLLACGSFNPITNMHLRMFEVARDHLHQTGMYQVIQGIISPVNDTYGKKDLAASHHRVAMARLALQTSDWIRVDPWESEQAQWMETVKVLRHHHSKLLRSPPQMEGPDHGKALFSTPAAVPELKLLCGADVLKTFQTPNLWKDAHIQEIVEKFGLVCVGRVGHDPKGYIAESPILRMHQHNIHLAKEPVQNEISATYIRRALGQGQSVKYLIPDAVITYIKDHGLYTKGSTWKGKSTQSTEGKTS,sabio,Q96T66,NC(=O)c1ccc[n+](C2OC(COP(=O)([O-])O)C(O)C2O)c1.Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1>>O=P(O)(O)OP(=O)(O)O,0.34,65.55821975636233,30.0,7.5,2.7.7.1,9606.0,-0.4685210829577448,NC(=O)c1ccc[n+](C2OC(COP(=O)([O-])O)C(O)C2O)c1.Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1,O=P(O)(O)OP(=O)(O)O,-0.4685210829577448,NC(=O)c1ccc[n+](C2OC(COP(=O)([O-])O)C(O)C2O)c1.Nc1nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C2O)c(=O)[nH]1__MKSRIPVVLLACGSFNPITNMHLRMFEVARDHLHQTGMYQVIQGIISPVNDTYGKKDLAASHHRVAMARLALQTSDWIRVDPWESEQAQWMETVKVLRHHHSKLLRSPPQMEGPDHGKALFSTPAAVPELKLLCGADVLKTFQTPNLWKDAHIQEIVEKFGLVCVGRVGHDPKGYIAESPILRMHQHNIHLAKEPVQNEISATYIRRALGQGQSVKYLIPDAVITYIKDHGLYTKGSTWKGKSTQSTEGKTS,./data/raw/alphafold//AF-Q96T66-F1-model_v4.pdb,2318,4659,4687,359
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+1557,2091,2122,MTLDLDAYFARIGWTGNPRPTLEVLRSLHRAHLIGIPFENLEPVLGSAPSLALDDLEAKLVHGGRGGYCYEHNTLFSAVLRQIGFSVTPLTARVVLGAAPGDIRPRTHMLMRVDVAGEPHPYLADVGFGAVGALLEPIELVEDAELSDAPRRHRLVHAPHHGPLPLWELQAGQGGSWEPQYDFTLDPYEKPDYEVINWFIATHPRSPFRQAVYAQRTRIGSHLALSGLDLVETADDGTIRERRLEDGDEALRVLTDDFGIRLPEGVRLPE,brenda,A2V7M5,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.Nc1cc(C=O)ccc1O>>CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.CC(O)=Nc1cc(C=O)ccc1O,0.29,0.0,30.0,7.0,2.3.1.5,1911.0,-0.5376020021010439,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.Nc1cc(C=O)ccc1O,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.CC(O)=Nc1cc(C=O)ccc1O,-0.5376020021010439,CC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.Nc1cc(C=O)ccc1O__MTLDLDAYFARIGWTGNPRPTLEVLRSLHRAHLIGIPFENLEPVLGSAPSLALDDLEAKLVHGGRGGYCYEHNTLFSAVLRQIGFSVTPLTARVVLGAAPGDIRPRTHMLMRVDVAGEPHPYLADVGFGAVGALLEPIELVEDAELSDAPRRHRLVHAPHHGPLPLWELQAGQGGSWEPQYDFTLDPYEKPDYEVINWFIATHPRSPFRQAVYAQRTRIGSHLALSGLDLVETADDGTIRERRLEDGDEALRVLTDDFGIRLPEGVRLPE,./data/raw/alphafold//AF-A2V7M5-F1-model_v4.pdb,1531,1086,914,1251
+1558,4763,4822,MNDLIKDLGSEVRANVLAEALPWLQHFRDKIVVVKYGGNAMVDDDLKAAFAADMVFLRTVGAKPVVVHGGGPQISEMLNRVGLQGEFKGGFRVTTPEVMDIVRMVLFGQVGRDLVGLINSHGPYAVGTSGEDAGLFTAQKRMVNIDGVPTDIGLVGDIINVDASSLMDIIEAGRIPVVSTIAPGEDGQIYNINADTAAGALAAAIGAERLLVLTNVEGLYTDWPDKSSLVSKIKATELEAILPGLDSGMIPKMESCLNAVRGGVSAAHVIDGRIAHSVLLELLTMGGIGTMVLPDVFDRENYPEGTVFRKDDKDGEL,uniprot_search,A0A0U4WTX4,CC(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](CCC(=O)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,31.4,8.157207495570493e-15,37.0,8.0,2.7.2.8,1718.0,1.4969296480732148,CC(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](CCC(=O)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,1.6541765418779606,CC(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__MNDLIKDLGSEVRANVLAEALPWLQHFRDKIVVVKYGGNAMVDDDLKAAFAADMVFLRTVGAKPVVVHGGGPQISEMLNRVGLQGEFKGGFRVTTPEVMDIVRMVLFGQVGRDLVGLINSHGPYAVGTSGEDAGLFTAQKRMVNIDGVPTDIGLVGDIINVDASSLMDIIEAGRIPVVSTIAPGEDGQIYNINADTAAGALAAAIGAERLLVLTNVEGLYTDWPDKSSLVSKIKATELEAILPGLDSGMIPKMESCLNAVRGGVSAAHVIDGRIAHSVLLELLTMGGIGTMVLPDVFDRENYPEGTVFRKDDKDGEL,./data/raw/alphafold//AF-A0A0U4WTX4-F1-model_v4.pdb,2981,1724,3340,2145
+1559,22074,22407,MSDITVTNWAGNITYTAKELLRPHSLDALRALVADSARVRVLGSGHSFNEIAEPGDGGVLLSLAGLPSVVDVDTAARTVRVGGGVRYAELARVVHARGLALPNMASLPHISVAGSVATGTHGSGVGNGSLASVVREVELVTADGSTVVIARGDERFGGAVTSLGALGVVTSLTLDLEPAYEMEQHVFTELPLAGLDPATFETVMAAAYSVSLFTDWRAPGFRQVWLKRRTDRPLDGFPYAAPAAEKMHPVPGMPAVNCTEQFGVPGPWHERLPHFRAEFTPSSGAELQSEYLMPREHALAALHAMDAIRETLAPVLQTCEIRTVAADAQWLSPAYGRDTVAAHFTWVEDTAAVLPVVRRLEEALVPFAARPHWGKVFTVPAGELRALYPRLADFGALAGALDPAGKFTNAFVRGVLAG,brenda,Q9ZBU1,O=O.OCC(O)c1ccccc1>>OO,0.36,66.3570168341635,30.0,7.5,1.1.3.41,1902.0,-0.4436974992327127,O=O.OCC(O)c1ccccc1,OO,-0.4436974992327127,O=O.OCC(O)c1ccccc1__MSDITVTNWAGNITYTAKELLRPHSLDALRALVADSARVRVLGSGHSFNEIAEPGDGGVLLSLAGLPSVVDVDTAARTVRVGGGVRYAELARVVHARGLALPNMASLPHISVAGSVATGTHGSGVGNGSLASVVREVELVTADGSTVVIARGDERFGGAVTSLGALGVVTSLTLDLEPAYEMEQHVFTELPLAGLDPATFETVMAAAYSVSLFTDWRAPGFRQVWLKRRTDRPLDGFPYAAPAAEKMHPVPGMPAVNCTEQFGVPGPWHERLPHFRAEFTPSSGAELQSEYLMPREHALAALHAMDAIRETLAPVLQTCEIRTVAADAQWLSPAYGRDTVAAHFTWVEDTAAVLPVVRRLEEALVPFAARPHWGKVFTVPAGELRALYPRLADFGALAGALDPAGKFTNAFVRGVLAG,./data/raw/alphafold//AF-Q9ZBU1-F1-model_v4.pdb,748,169,5907,6821
+1560,18729,19002,MESQEPTESSQNGKQYIISEELISEGKWVKLEKTTYMDPTGKTRTWESVKRTTRKEQTADGVAVIPVLQRTLHYECIVLVKQFRPPMGGYCIEFPAGLIDDGETPEAAALRELEEETGYKGDIAECSPAVCMDPGLSNCTIHIVTVTINGDDAENARPKPKPGDGEFVEVISLPKNDLLQRLDALVAEEHLTVDARVYSYALALKHANAKPFEVPFLKF,brenda,Q9UKK9,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,0.006,6.6140220540409e-15,30.0,8.0,3.6.1.58,9606.0,-2.2218487496163566,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,-2.2218487496163566,Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O1.O__MESQEPTESSQNGKQYIISEELISEGKWVKLEKTTYMDPTGKTRTWESVKRTTRKEQTADGVAVIPVLQRTLHYECIVLVKQFRPPMGGYCIEFPAGLIDDGETPEAAALRELEEETGYKGDIAECSPAVCMDPGLSNCTIHIVTVTINGDDAENARPKPKPGDGEFVEVISLPKNDLLQRLDALVAEEHLTVDARVYSYALALKHANAKPFEVPFLKF,./data/raw/alphafold//AF-Q9UKK9-F1-model_v4.pdb,2458,4877,4947,4801
+1561,4092,4145,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)N1CCC[C@H]1C(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]1CCCN1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],3.5,2.905508609469665e-14,37.0,4.5,3.4.23.32,5539.0,0.5440680443502757,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(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]1CCCN1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],0.5440680443502757,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(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
+1562,7650,7773,MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,brenda,A0A077JBW9,CCCCOP(=O)(OCCCC)SCCCC.O>>CCCCOP(=O)(O)OCCCC,0.42,17.628823461575305,25.0,9.0,3.1.8.1,453246.0,-0.3767507096020995,CCCCOP(=O)(OCCCC)SCCCC.O,CCCCOP(=O)(O)OCCCC,-0.3767507096020995,CCCCOP(=O)(OCCCC)SCCCC.O__MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,./data/raw/alphafold//AF-A0A077JBW9-F1-model_v4.pdb,3110,1877,3509,2328
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+1565,12896,13068,MKRILLVLLTLVFLGAIACQKKEENKTEMVKLKRMIAQFAPTEIKYDHSLLDERKQKVVENLYRAAKIMDEIFLDQVYSKNFEIREQLRASSDPLDQLRLEYFTIMFGPFDRLNHDKPFIGNTPKPKGANFYPPDMTREEFENWLKAHPEDEAAFTSEFTVIRRQDGKLVAIPYSEYYKEYLTRAADYLKKAAEFADNPSLKKYLQLRAEAFLNNDYYESDLAWMDLNDHTIEVVIGPYEVYEDKLFNYKAAFEAFITLRDPVESAKLKKFVGYLDEMEKNLPIPDAYKNFNRGSESPMVVVQEVFSAGDTKAGVQTLAFNLPNDERVREAKGSKKVMLKNIHEAKFDKLLKPIAEKVLFAEQLPLVTFEGFFNHTLMHEISHGLGPGKIVLNGRQTEVKKELKETYSSIEECKADVLGMYNNLFMIEKGVYPPEFEKQIYVTFLAGIFRTIRFGINEAHGAGNAVIFNYLLEKGAYQFDPAAHRVKVNFEKIKDGVRDLANKVLTIQAQGDYMAAKNLLETYAVESEPIMIMRARLQELPVDIKPIFQIEKELGNSN,brenda,H1XW48,N=C(N)NCCC[C@H](N=C(O)CN)C(O)=Nc1ccc2ccccc2c1.O>>N=C(N)NCCC[C@H](N=C(O)CN)C(=O)O.Nc1ccc2ccccc2c1,2.53,7.580234282469166e-15,50.0,7.0,3.4.14.4,187145.0,0.4031205211758178,N=C(N)NCCC[C@H](N=C(O)CN)C(O)=Nc1ccc2ccccc2c1.O,N=C(N)NCCC[C@H](N=C(O)CN)C(=O)O.Nc1ccc2ccccc2c1,0.4031205211758178,N=C(N)NCCC[C@H](N=C(O)CN)C(O)=Nc1ccc2ccccc2c1.O__MKRILLVLLTLVFLGAIACQKKEENKTEMVKLKRMIAQFAPTEIKYDHSLLDERKQKVVENLYRAAKIMDEIFLDQVYSKNFEIREQLRASSDPLDQLRLEYFTIMFGPFDRLNHDKPFIGNTPKPKGANFYPPDMTREEFENWLKAHPEDEAAFTSEFTVIRRQDGKLVAIPYSEYYKEYLTRAADYLKKAAEFADNPSLKKYLQLRAEAFLNNDYYESDLAWMDLNDHTIEVVIGPYEVYEDKLFNYKAAFEAFITLRDPVESAKLKKFVGYLDEMEKNLPIPDAYKNFNRGSESPMVVVQEVFSAGDTKAGVQTLAFNLPNDERVREAKGSKKVMLKNIHEAKFDKLLKPIAEKVLFAEQLPLVTFEGFFNHTLMHEISHGLGPGKIVLNGRQTEVKKELKETYSSIEECKADVLGMYNNLFMIEKGVYPPEFEKQIYVTFLAGIFRTIRFGINEAHGAGNAVIFNYLLEKGAYQFDPAAHRVKVNFEKIKDGVRDLANKVLTIQAQGDYMAAKNLLETYAVESEPIMIMRARLQELPVDIKPIFQIEKELGNSN,./data/raw/alphafold//AF-H1XW48-F1-model_v4.pdb,2207,4434,4335,4217
+1566,1801,1832,MPLFNSILDTIGRTPIVRLQRMAPEHTSVYVKVESFNPGGSVKDRLALSVVLDAEAKGLLKPGDTIVECTSGNVGIALAMVAAARGYRFVAVMGDTYSVERRKLIRAYGGKLVLFPGHLGSKGGNLIADELAEKYGWFRARQFDNPANPSYHRETTASEILADFAGKRLDHFVTGFGTTGTLTGVGQMLRVARPEVRVVALEPSNAAMLARGEWSPHQIQGLAPNFVPGVLDRSVIDDLVTMDEVTARDTSRRLAAEEGIFAGISAGATVATALSIAEHAPEGTVLLAMLPDTGERYLSTFLFDGVDEGSDDAWLASLDTGSGL,brenda,D2Z027,CC(=O)OC[C@H](N)C(=O)O.O=S([O-])([O-])=S>>CC(=O)O.N[C@@H](CSS(=O)(=O)O)C(=O)O,0.72,0.3865490146451385,30.0,8.0,2.5.1.47,1914.0,-0.1426675035687315,CC(=O)OC[C@H](N)C(=O)O.O=S([O-])([O-])=S,CC(=O)O.N[C@@H](CSS(=O)(=O)O)C(=O)O,-0.1426675035687315,CC(=O)OC[C@H](N)C(=O)O.O=S([O-])([O-])=S__MPLFNSILDTIGRTPIVRLQRMAPEHTSVYVKVESFNPGGSVKDRLALSVVLDAEAKGLLKPGDTIVECTSGNVGIALAMVAAARGYRFVAVMGDTYSVERRKLIRAYGGKLVLFPGHLGSKGGNLIADELAEKYGWFRARQFDNPANPSYHRETTASEILADFAGKRLDHFVTGFGTTGTLTGVGQMLRVARPEVRVVALEPSNAAMLARGEWSPHQIQGLAPNFVPGVLDRSVIDDLVTMDEVTARDTSRRLAAEEGIFAGISAGATVATALSIAEHAPEGTVLLAMLPDTGERYLSTFLFDGVDEGSDDAWLASLDTGSGL,./data/raw/alphafold//AF-D2Z027-F1-model_v4.pdb,1440,1002,818,1139
+1567,9879,10029,MSFAWKALATLAVAIASRSAFAQSIIGNQDTMTISNINAGPDGFTRPVIAVNGEFPSPLVRANKGDDFRINVVNNLDDDTMLRQTSVHWHGVFQHQSAWADGPDGVTQCPIPQSGQEFEYAFNAGQEAGTFWYHSHYGTQYCDGLRGPLVIYDPEDPHQDLYDVDDENTIITLADWYHLQAPSIQGPAVSQATLINGKGRRPGNTEGDIAVVNVEKDSRYRFRIVSLSCDPDYTFSIDNHTMTIIEADGQNTKPLEVESIRVFAGQRYSVVVNADQAIGNYWIRAEPNIGDTGLVGTSGGGVNSAILRYATADEVEPDTPRLTNRPALQESNLRALTSGVPGGDGPADITFTFNLGLNFATGTFSMNPGESWVHPDTPVMVQIMNGVPAEDLVPAESLHTITRGQVVEVVIPPFGIAGPHAFSVIKSAGGSPNFVDPVRRDVVAVGTEAGQGDTIIRFVADNPGPWFFHCHIEFHLVTGLAAVFMEAPDEIASSNPPPPSWDALCPAFSALPPSATSIRIVPTPTP,brenda,A8N3P5,COc1ccccc1O.O=O>>COC1=CCC=CC1=O.O,0.211,4.672041591628207,30.0,3.0,1.10.3.2,5346.0,-0.6757175447023074,COc1ccccc1O.O=O,COC1=CCC=CC1=O.O,-0.6757175447023074,COc1ccccc1O.O=O__MSFAWKALATLAVAIASRSAFAQSIIGNQDTMTISNINAGPDGFTRPVIAVNGEFPSPLVRANKGDDFRINVVNNLDDDTMLRQTSVHWHGVFQHQSAWADGPDGVTQCPIPQSGQEFEYAFNAGQEAGTFWYHSHYGTQYCDGLRGPLVIYDPEDPHQDLYDVDDENTIITLADWYHLQAPSIQGPAVSQATLINGKGRRPGNTEGDIAVVNVEKDSRYRFRIVSLSCDPDYTFSIDNHTMTIIEADGQNTKPLEVESIRVFAGQRYSVVVNADQAIGNYWIRAEPNIGDTGLVGTSGGGVNSAILRYATADEVEPDTPRLTNRPALQESNLRALTSGVPGGDGPADITFTFNLGLNFATGTFSMNPGESWVHPDTPVMVQIMNGVPAEDLVPAESLHTITRGQVVEVVIPPFGIAGPHAFSVIKSAGGSPNFVDPVRRDVVAVGTEAGQGDTIIRFVADNPGPWFFHCHIEFHLVTGLAAVFMEAPDEIASSNPPPPSWDALCPAFSALPPSATSIRIVPTPTP,./data/raw/alphafold//AF-A8N3P5-F1-model_v4.pdb,3424,2324,1040,2939
+1568,16690,16920,MSELEKAVVALIDVFHQYSGREGDKHKLKKSELKELINNELSHFLEEIKEQEVVDKVMETLDSDGDGECDFQEFMAFVAMITTACHEFFEHE,sabio,P02638,NCC(O)c1ccc(O)c(O)c1.O=O>>OO,1e-06,70.77462403468363,20.0,7.2,1.14.18.1,9913.0,-6.0,NCC(O)c1ccc(O)c(O)c1.O=O,OO,-6.0,NCC(O)c1ccc(O)c(O)c1.O=O__MSELEKAVVALIDVFHQYSGREGDKHKLKKSELKELINNELSHFLEEIKEQEVVDKVMETLDSDGDGECDFQEFMAFVAMITTACHEFFEHE,./data/raw/alphafold//AF-P02638-F1-model_v4.pdb,3481,3397,1131,3048
+1569,19151,19437,MKPTKPLLYITGYGPFLEITENPSATIAQSVAEQVRQSGEADVHHETLDVNLEAVSKYFNRLNESVTAHLEATHPENRVLLVNVGLHSREKEKVLRLEVRAFNELEGNPIDDELPLSTCKDSAFVKGCKLETTTALIEELNAIERNGSDHHEKPRWIISYDAGRYYCNYALYRGVKMQEALNSRVFAVFLHIVASTVVCMEEQVAQVRMLVSHLLKHMEAVE,brenda,Q4U338,O.O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC(O)=N1>>Nc1ccc([N+](=O)[O-])cc1.O=C(O)[C@@H]1CCC(O)=N1,52.0,0.0,37.0,7.4,3.4.19.3,5702.0,1.7160033436347992,O.O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC(O)=N1,Nc1ccc([N+](=O)[O-])cc1.O=C(O)[C@@H]1CCC(O)=N1,1.806179973983887,O.O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC(O)=N1__MKPTKPLLYITGYGPFLEITENPSATIAQSVAEQVRQSGEADVHHETLDVNLEAVSKYFNRLNESVTAHLEATHPENRVLLVNVGLHSREKEKVLRLEVRAFNELEGNPIDDELPLSTCKDSAFVKGCKLETTTALIEELNAIERNGSDHHEKPRWIISYDAGRYYCNYALYRGVKMQEALNSRVFAVFLHIVASTVVCMEEQVAQVRMLVSHLLKHMEAVE,./data/raw/alphafold//AF-Q4U338-F1-model_v4.pdb,1864,1564,3149,1920
+1570,11430,11587,MKIAEIQLFQHDLPVVNGPYRIASGDVWSLTTTIVKIIAEDGTIGWGETCPVGPTYAEAHAGGALAALEVLASGLAGAEALPLPLHTRMDSLLCGHNYAKSALDIAVHDLWGKRLGVPVHELLGGALTDSVSSYYSLGVMEPDEAARQALEKQREGYSRLQVKLGARPIEIDIEAIRKVWEAVRGTGIALAADGNRGWTTRDALRFSRECPDIPFVMEQPCNSFEDLEAIRPLCHHALYMDEDGTSLNTVITAAATSLVDGFGMKVSRIGGLQHMRAFRDFCAARNLPHTCDDAWGGDIVSAACTHIASTVLPRLMEGAWLAQPYVAEHYDAENGVRIEGGRIRVPQGPGLGLTIDPERFGPPLFSA,brenda,Q0FPQ4,C[N+]1(C)[C@H](O)CC[C@H]1C(=O)[O-]>>C[N+]1(C)[C@H](O)CC[C@@H]1C(=O)[O-],330.0,0.0,,,5.1.1.22,344736.0,2.5185139398778875,C[N+]1(C)[C@H](O)CC[C@H]1C(=O)[O-],C[N+]1(C)[C@H](O)CC[C@@H]1C(=O)[O-],2.5185139398778875,C[N+]1(C)[C@H](O)CC[C@H]1C(=O)[O-]__MKIAEIQLFQHDLPVVNGPYRIASGDVWSLTTTIVKIIAEDGTIGWGETCPVGPTYAEAHAGGALAALEVLASGLAGAEALPLPLHTRMDSLLCGHNYAKSALDIAVHDLWGKRLGVPVHELLGGALTDSVSSYYSLGVMEPDEAARQALEKQREGYSRLQVKLGARPIEIDIEAIRKVWEAVRGTGIALAADGNRGWTTRDALRFSRECPDIPFVMEQPCNSFEDLEAIRPLCHHALYMDEDGTSLNTVITAAATSLVDGFGMKVSRIGGLQHMRAFRDFCAARNLPHTCDDAWGGDIVSAACTHIASTVLPRLMEGAWLAQPYVAEHYDAENGVRIEGGRIRVPQGPGLGLTIDPERFGPPLFSA,./data/raw/alphafold//AF-Q0FPQ4-F1-model_v4.pdb,3843,3965,1809,3622
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+1572,1444,1472,MSTENPQPLWQPDAQRIAQARITRFQAWAAEHHGAPAEGGYAALHRWSVDELDTFWKAVTEWFDVRFSTPYARVLGDRTMPGAQWFPGATLNYAEHALRAAGTRPDEPALLYVDETHEPAPVTWAELRRQVASLAAELRALGVRPGDRVSGYLPNIPQAVVALLATAAVGGVWTSCAPDFGARSVLDRFQQVEPVVLFTVDGYRYGGKEHDRRDTVAELRRELPTLRAVIHIPLLGTEAPDGTLDWETLTAADAEPVYEQVPFDHPLWVLYSSGTTGLPKAIVQSQGGILVEHLKQLGLHCDLGPGDRFFWYTSTGWMMWNFLVSGLLTGTTIVLYDGSPGFPATDAQWRIAERTGATLFGTSAAYVMACRKAGVHPARDLDLSAIQCVATTGSPLPPDGFRWLHDEFAAGGADLWIASVSGGTDVCSCFAGAVPTLPVHIGELQAPGLGTDLQSWDPSGDPLTDEVGELVVTNPMPSMPIRFWNDPDGSRYHDSYFDTYPGVWRHGDWITLTSRGSVVIHGRSDSTLNRQGVRMGSADIYEAVERLPEIRESLVIGIEQPDGGYWMPLFVHLAPGATLDDALLDRIKRTIRVNLSPRHVPDEVIEVPGIPHTLTGKRIEVPVKRLLQGTPLDKAVNPGSIDNLDLLHFYEELARKRS,brenda,D6EQU8,CC(=O)CC(=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.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>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.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,5.89,1.6508508997469862e-14,30.0,7.5,6.2.1.16,1916.0,0.7701152947871016,CC(=O)CC(=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.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,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.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.7701152947871016,CC(=O)CC(=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.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MSTENPQPLWQPDAQRIAQARITRFQAWAAEHHGAPAEGGYAALHRWSVDELDTFWKAVTEWFDVRFSTPYARVLGDRTMPGAQWFPGATLNYAEHALRAAGTRPDEPALLYVDETHEPAPVTWAELRRQVASLAAELRALGVRPGDRVSGYLPNIPQAVVALLATAAVGGVWTSCAPDFGARSVLDRFQQVEPVVLFTVDGYRYGGKEHDRRDTVAELRRELPTLRAVIHIPLLGTEAPDGTLDWETLTAADAEPVYEQVPFDHPLWVLYSSGTTGLPKAIVQSQGGILVEHLKQLGLHCDLGPGDRFFWYTSTGWMMWNFLVSGLLTGTTIVLYDGSPGFPATDAQWRIAERTGATLFGTSAAYVMACRKAGVHPARDLDLSAIQCVATTGSPLPPDGFRWLHDEFAAGGADLWIASVSGGTDVCSCFAGAVPTLPVHIGELQAPGLGTDLQSWDPSGDPLTDEVGELVVTNPMPSMPIRFWNDPDGSRYHDSYFDTYPGVWRHGDWITLTSRGSVVIHGRSDSTLNRQGVRMGSADIYEAVERLPEIRESLVIGIEQPDGGYWMPLFVHLAPGATLDDALLDRIKRTIRVNLSPRHVPDEVIEVPGIPHTLTGKRIEVPVKRLLQGTPLDKAVNPGSIDNLDLLHFYEELARKRS,./data/raw/alphafold//AF-D6EQU8-F1-model_v4.pdb,1347,837,629,917
+1573,16853,17083,MVEAIHRSTRIEFSKSSLAYNVQYTKQVSGAKTLWLAVKSNAYGHGLLQVSKIARECGVDGLAVSVLDEGIAIRQAGIDDFILILGPIDVKYAPIASKYHFLTTVSSLDWLKSADKILGKEKLSVNLAVDTGMNRIGVRSKKDLKDEIEFLQEHSDHFSYDGIFTHFASSDNPDDHYFQRQKNRWYELIDGLIMPRYVHVMNSGAAMYHSKELPGCNSIARVGTVVYGVEPSEGVLGPIDKLKPVFELKSALTFVKKIPAGEGISYGSKFVTSRDTWIGTLPIGYGDGWLAEYQDFQLLIDGQKCRQVGQIAMDQMMVALPHEYPIGTEVTLIGKSGKYENTLYDLHKHSGVPPWKITVAFSDRLKRMVVD,brenda,Q04HB7,NCCCC[C@H](N)C(=O)O>>NCCCC[C@@H](N)C(=O)O,3.5,0.0,30.0,8.0,5.1.1.5,1247.0,0.5440680443502757,NCCCC[C@H](N)C(=O)O,NCCCC[C@@H](N)C(=O)O,0.5440680443502757,NCCCC[C@H](N)C(=O)O__MVEAIHRSTRIEFSKSSLAYNVQYTKQVSGAKTLWLAVKSNAYGHGLLQVSKIARECGVDGLAVSVLDEGIAIRQAGIDDFILILGPIDVKYAPIASKYHFLTTVSSLDWLKSADKILGKEKLSVNLAVDTGMNRIGVRSKKDLKDEIEFLQEHSDHFSYDGIFTHFASSDNPDDHYFQRQKNRWYELIDGLIMPRYVHVMNSGAAMYHSKELPGCNSIARVGTVVYGVEPSEGVLGPIDKLKPVFELKSALTFVKKIPAGEGISYGSKFVTSRDTWIGTLPIGYGDGWLAEYQDFQLLIDGQKCRQVGQIAMDQMMVALPHEYPIGTEVTLIGKSGKYENTLYDLHKHSGVPPWKITVAFSDRLKRMVVD,./data/raw/alphafold//AF-Q04HB7-F1-model_v4.pdb,2715,3821,2406,5313
+1574,8339,8468,MGKKVAIIGAGVSGLASIRSCLEEGLEPTCFEKSNDIGGLWKFSDHAEEGRASIYKSVFSNSSKEMMCFPDFPFPDDFPNFMHNSKIQEYIIAFAKEKNLLKYIQFKTFVSSVNKHPDFATTGQWDVTTERDGKKESAVFDAVMVCSGHHVYPNLPKESFPGLNHFKGKCFHSRDYKEPGVFNGKRVLVVGLGNSGCDIATELSRTAEQVMISSRSGSWVMSRVWDNGYPWDMLLVTRFGTFLKNNLPTAISDWLYVKQMNARFKHENYGLMPLNGVLRKEPVFNDELPASILCGIVSVKPNVKEFTETSAIFEDGTIFEGIDCVIFATGYSFAYPFLDESIIKSRNNEIILFKGVFPPLLEKSTIAVIGFVQSLGAAIPTVDLQSRWAAQVIKGTCTLPSMEDMMNDINEKMEKKRKWFGKSETIQTDYIVYMDELSSFIGAKPNIPWLFLTDPKLAMEVYFGPCSPYQFRLVGPGQWPGARNAILTQWDRSLKPMQTRVVGRLQKPCFFFHWLKLFAIPILLIAVFLVLT,brenda,P31513,CCc1cc(C(=N)S)ccn1.N=C(O)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+]>>CCc1cc(C(N)=S=O)ccn1.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,0.973,6.014031069299815e-15,37.0,9.5,1.14.13.148,9606.0,-0.0118871597316481,CCc1cc(C(=N)S)ccn1.N=C(O)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+],CCc1cc(C(N)=S=O)ccn1.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,-0.0118871597316481,CCc1cc(C(=N)S)ccn1.N=C(O)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+]__MGKKVAIIGAGVSGLASIRSCLEEGLEPTCFEKSNDIGGLWKFSDHAEEGRASIYKSVFSNSSKEMMCFPDFPFPDDFPNFMHNSKIQEYIIAFAKEKNLLKYIQFKTFVSSVNKHPDFATTGQWDVTTERDGKKESAVFDAVMVCSGHHVYPNLPKESFPGLNHFKGKCFHSRDYKEPGVFNGKRVLVVGLGNSGCDIATELSRTAEQVMISSRSGSWVMSRVWDNGYPWDMLLVTRFGTFLKNNLPTAISDWLYVKQMNARFKHENYGLMPLNGVLRKEPVFNDELPASILCGIVSVKPNVKEFTETSAIFEDGTIFEGIDCVIFATGYSFAYPFLDESIIKSRNNEIILFKGVFPPLLEKSTIAVIGFVQSLGAAIPTVDLQSRWAAQVIKGTCTLPSMEDMMNDINEKMEKKRKWFGKSETIQTDYIVYMDELSSFIGAKPNIPWLFLTDPKLAMEVYFGPCSPYQFRLVGPGQWPGARNAILTQWDRSLKPMQTRVVGRLQKPCFFFHWLKLFAIPILLIAVFLVLT,./data/raw/alphafold//AF-P31513-F1-model_v4.pdb,3144,1936,3580,2413
+1575,11336,11492,MDPKFQRVALSDGHFIPVLGFGTYAPEEVPKSKAMEATKIAIDAGFRHIDSAYFYKNEKEVGLAIRSKIADGTVKREDIFYTSKLWCTFHRPELVRPSLEDSLKNLQLDYVDLYIIHFPTALKPGVEIIPTDEHGKAIFDTVDICATWEAMEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYLNQGKLLEFCKSKGIVLVAYSALGSHREPEWVDQSAPVLLEDPLIGALAKKHQQTPALIALRYQLQRGIVVLAKSFTEKRIKENIQVFEFQLPSEDMKVIDSLNRNFRYVTADFAIGHPNYPFSDEY,uniprot_search,P80508,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.N=C(O)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+]>>,0.045,99.90364974756233,37.0,7.4,1.1.1.149,9986.0,-1.3467874862246565,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.N=C(O)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+],,-1.3467874862246565,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.N=C(O)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
+1576,8719,8856,MRAVRLVEIGKPLSLQEIGVPKPKGPQVLIKVEAAGVCHSDVHMRQGRFGNLRIVEDLGVKLPVTLGHEIAGKIEEVGDEVVGYSKGDLVAVNPWQGEGNCYYCRIGEEHLCDSPRWLGINFDGAYAEYVIVPHYKYMYKLRRLNAVEAAPLTCSGITTYRAVRKASLDPTKTLLVVGAGGGLGTMAVQIAKAVSGATIIGVDVREEAVEAAKRAGADYVINASMQDPLAEIRRITESKGVDAVIDLNNSEKTLSVYPKALAKQGKYVMVGLFGADLHYHAPLITLSEIQFVGSLVGNQSDFLGIMRLAEAGKVKPMITKTMKLEEANEAIDNLENFKAIGRQVLIP,sabio,P39462,CO.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=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,11160.0,0.0723643025746786,65.0,8.0,1.1.1.1,2287.0,4.04766419460156,CO.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=O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1,4.04766419460156,CO.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__MRAVRLVEIGKPLSLQEIGVPKPKGPQVLIKVEAAGVCHSDVHMRQGRFGNLRIVEDLGVKLPVTLGHEIAGKIEEVGDEVVGYSKGDLVAVNPWQGEGNCYYCRIGEEHLCDSPRWLGINFDGAYAEYVIVPHYKYMYKLRRLNAVEAAPLTCSGITTYRAVRKASLDPTKTLLVVGAGGGLGTMAVQIAKAVSGATIIGVDVREEAVEAAKRAGADYVINASMQDPLAEIRRITESKGVDAVIDLNNSEKTLSVYPKALAKQGKYVMVGLFGADLHYHAPLITLSEIQFVGSLVGNQSDFLGIMRLAEAGKVKPMITKTMKLEEANEAIDNLENFKAIGRQVLIP,./data/raw/alphafold//AF-P39462-F1-model_v4.pdb,1321,3885,6202,863
+1577,4109,4162,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)N1CCC[C@H]1C(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]1CCCN1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],0.03,3.0109231491391533e-14,37.0,4.5,3.4.23.32,5539.0,-1.5228787452803376,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(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]1CCCN1)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],-1.5228787452803376,CC(C)C[C@H](N=C(O)[C@H](CCCCN)N=C(O)c1ccccc1N)C(O)=N[C@@H](CO)C(=O)N1CCC[C@H]1C(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
+1578,20316,20619,MRKITQAISAVCLLFALNSSAVALASSPSPLNPGTNVARLAEQAPIHWVSVAQIENSLAGRPPMAVGFDIDDTVLFSSPGFWRGKKTFSPESEDYLKNPVFWEKMNNGWDEFSIPKEVARQLIDMHVRRGDAIFFVTGRSPTKTETVSKTLADNFHIPATNMNPVIFAGDKPGQNTKSQWLQDKNIRIFYGDSDNDITAARDVGARGIRILRASNSTYKPLPQAGAFGEEVIVNSEY,sabio,P0AE22,O.O=c1ccn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]1>>O=P(O)(O)O.O=c1ccn(C2CC(O)C(CO)O2)c(=O)[nH]1,24.0,0.0,37.0,6.0,3.1.3.2,562.0,1.380211241711606,O.O=c1ccn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]1,O=P(O)(O)O.O=c1ccn(C2CC(O)C(CO)O2)c(=O)[nH]1,1.380211241711606,O.O=c1ccn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]1__MRKITQAISAVCLLFALNSSAVALASSPSPLNPGTNVARLAEQAPIHWVSVAQIENSLAGRPPMAVGFDIDDTVLFSSPGFWRGKKTFSPESEDYLKNPVFWEKMNNGWDEFSIPKEVARQLIDMHVRRGDAIFFVTGRSPTKTETVSKTLADNFHIPATNMNPVIFAGDKPGQNTKSQWLQDKNIRIFYGDSDNDITAARDVGARGIRILRASNSTYKPLPQAGAFGEEVIVNSEY,./data/raw/alphafold//AF-P0AE22-F1-model_v4.pdb,392,2964,5306,4775
+1579,9563,9709,MGVILRLRHSLRALAVGGLVLLTGAGALPAVAASDAARGERPSADGLSAVIRYTEYGVPHILADDYADLGFGDGWAQAADAVCTLADGFVTVRGERARYFGPDAAPDRSFSEASTNLSSDLFFRGVRDARTVEKLLDRPAPEGPSRQAKELMRGWAAGYNAWLRQHKVTDPACRGKGWVRPVTATDVARRGYALTVLGGQGALADAITEARPPAARTVGGGKAVADPAAAARAYFAARHDTGMGSNAVAFSGAATANRRGLLLGNPHYPWHGNRRFWQSQQTIPGELNVSGASLLGSPTVQIGHNASMAWSHTVATGVPMNLYELKPAPGDPRSYLVDGRPERMTERKVTVAVRGADGRLANVTRSQWWTRYGPVVTGLGDDLPLPWTPGSAYALADPNAAQFRFFDSSLGLSKARDVRGVREALRRTQGLPWVNTVAADSAGHSLYTQSQVLPRVTDEVQRSCATALGRRTYPESGLAVLDGSRGACALGRDRDALQPGVFGPSAMPTLVDAPYAENSNDSAWLANADRPLTGYPRIFGDIGTERSFRTRGGVEDVAAMAKRGRLTVADLERQQFAGRAPTGDLAAADAAAACAKLPGGRATGPDGRPVDVSGACGVLARWDRRLTTGSRGALLFDRFVRALVREVPADRLWRVPFDPAKPVTTPNTLNTAEPGVARALAAAVHDLRSAGIALDAPLGEHQFVVRKGKRIPVPGGTEALGAWNKVESRWDGSRGGYPEVSMGTSYVQAVGFDGGPCPVTARTLLTYSQSDDPASAHSSDQTELFSKGRMTRGRFCERDILASPGLRVVRVAQR,brenda,Q0R3W5,COc1cc(CN=C(O)CCCC/C=C/C(C)C)ccc1O.O>>,9.5,99.69176994941944,37.0,6.25,3.5.1.11,35621.0,0.9777236052888478,COc1cc(CN=C(O)CCCC/C=C/C(C)C)ccc1O.O,,0.9777236052888478,COc1cc(CN=C(O)CCCC/C=C/C(C)C)ccc1O.O__MGVILRLRHSLRALAVGGLVLLTGAGALPAVAASDAARGERPSADGLSAVIRYTEYGVPHILADDYADLGFGDGWAQAADAVCTLADGFVTVRGERARYFGPDAAPDRSFSEASTNLSSDLFFRGVRDARTVEKLLDRPAPEGPSRQAKELMRGWAAGYNAWLRQHKVTDPACRGKGWVRPVTATDVARRGYALTVLGGQGALADAITEARPPAARTVGGGKAVADPAAAARAYFAARHDTGMGSNAVAFSGAATANRRGLLLGNPHYPWHGNRRFWQSQQTIPGELNVSGASLLGSPTVQIGHNASMAWSHTVATGVPMNLYELKPAPGDPRSYLVDGRPERMTERKVTVAVRGADGRLANVTRSQWWTRYGPVVTGLGDDLPLPWTPGSAYALADPNAAQFRFFDSSLGLSKARDVRGVREALRRTQGLPWVNTVAADSAGHSLYTQSQVLPRVTDEVQRSCATALGRRTYPESGLAVLDGSRGACALGRDRDALQPGVFGPSAMPTLVDAPYAENSNDSAWLANADRPLTGYPRIFGDIGTERSFRTRGGVEDVAAMAKRGRLTVADLERQQFAGRAPTGDLAAADAAAACAKLPGGRATGPDGRPVDVSGACGVLARWDRRLTTGSRGALLFDRFVRALVREVPADRLWRVPFDPAKPVTTPNTLNTAEPGVARALAAAVHDLRSAGIALDAPLGEHQFVVRKGKRIPVPGGTEALGAWNKVESRWDGSRGGYPEVSMGTSYVQAVGFDGGPCPVTARTLLTYSQSDDPASAHSSDQTELFSKGRMTRGRFCERDILASPGLRVVRVAQR,./data/raw/alphafold//AF-Q0R3W5-F1-model_v4.pdb,3109,1876,3542,2365
+1580,13472,13649,MSSCSRVALVTGANKGIGFAITRELCRKFSGDVVLTARDEERGKAAVQQLQAEGLSPRFHQLDIDDLQSIRALRDFLRKEYGGLNVLVNNAGIAFRMDDPTPFDIQAEMTLKTNFFATRNVCNELLPIMKPHGRVVNVSSLQGSKALENCSEDLQERFRCNTLTEGDLVDLMKKFVEDTKNEVHEREGWPDSAYGVSKLGVTVLSRILAQQLGEKRKADRILLNACCPGWVKTDMARDQGSRTVEEGAETPVYLALLPPDATEPQGQLVCDKVVQTW,brenda,Q9JJN7,N=C(O)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=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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O=C1Nc2ccccc2C1=O,0.5167,0.1128706086278872,25.0,6.5,1.1.1.184,10029.0,-0.2867615384543382,N=C(O)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=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](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1.O=C1Nc2ccccc2C1=O,-0.2867615384543382,N=C(O)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=C1Nc2ccccc2C1=O.[H+]__MSSCSRVALVTGANKGIGFAITRELCRKFSGDVVLTARDEERGKAAVQQLQAEGLSPRFHQLDIDDLQSIRALRDFLRKEYGGLNVLVNNAGIAFRMDDPTPFDIQAEMTLKTNFFATRNVCNELLPIMKPHGRVVNVSSLQGSKALENCSEDLQERFRCNTLTEGDLVDLMKKFVEDTKNEVHEREGWPDSAYGVSKLGVTVLSRILAQQLGEKRKADRILLNACCPGWVKTDMARDQGSRTVEEGAETPVYLALLPPDATEPQGQLVCDKVVQTW,./data/raw/alphafold//AF-Q9JJN7-F1-model_v4.pdb,1319,3880,4510,4413
+1581,5224,5310,MVTKRVQRMMFAAAACIPLLLGSAPLYAQTSAVQQKLAALEKSSGGRLGVALIDTADNTQVLYRGDERFPMCSTSKVMAAAAVLKQSETQKQLLNQPVEIKPADLVNYNPIAEKHVNGTMTLAELSAAALQYSDNTAMNKLIAQLGGPGGVTAFARAIGDETFRLDRTEPTLNTAIPGDPRDTTTPRAMAQTLRQLTLGHALGETQRAQLVTWLKGNTTGAASIRAGLPTSWTVGDKTGSGDYGTTNDIAVIWPQGRAPLVLVTYFTQPQQNAESRRDVLASAARIIAEGL,sabio,Q9L5C7,CC/C=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1csc(=N)[nH]1.O>>,110.0,99.78836740265427,30.0,7.0,3.5.2.6,562.0,2.041392685158225,CC/C=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1csc(=N)[nH]1.O,,2.041392685158225,CC/C=C(\C(O)=N[C@@H]1C(=O)N2C(C(=O)O)=C(COC(=N)O)CS[C@H]12)c1csc(=N)[nH]1.O__MVTKRVQRMMFAAAACIPLLLGSAPLYAQTSAVQQKLAALEKSSGGRLGVALIDTADNTQVLYRGDERFPMCSTSKVMAAAAVLKQSETQKQLLNQPVEIKPADLVNYNPIAEKHVNGTMTLAELSAAALQYSDNTAMNKLIAQLGGPGGVTAFARAIGDETFRLDRTEPTLNTAIPGDPRDTTTPRAMAQTLRQLTLGHALGETQRAQLVTWLKGNTTGAASIRAGLPTSWTVGDKTGSGDYGTTNDIAVIWPQGRAPLVLVTYFTQPQQNAESRRDVLASAARIIAEGL,./data/raw/alphafold//AF-Q9L5C7-F1-model_v4.pdb,1458,649,811,590
+1582,17537,17775,MKKLLTVMTMAVLTAGTLLLPAQSVTPAAHAVQISNSERELPFKAKHAYSTISQLSEAIGPRIAGTAAEKKSALLIASSMRKLKLDVKVQRFNIPDRLEGTLSSAGRDILLQAASGSAPTEEQGLTAPLYNAGLGYQKDFTADAKGKIALISRGDLTYYEKAKNAEAAGAKAVIIYNNKESLVPMTPNLSGNKVGIPVVGIKKEDGEALTQQKEATLKLKAFTNQTSQNIIGIKKPKNIKHPDIVYVTAHYDSVPFSPGANDNGSGTSVMLEMARVLKSVPSDKEIRFIAFGAEELGLLGSSHYVDHLSEKELKRSEVNFNLDMVGTSWEKASELYVNTLDGQSNYVWESSRTAAEKIGFDSLSLTQGGSSDHVPFHEAGIDSANFIWGDPETEEVEPWYHTPEDSIEHISKERLQQAGDLVTAAVYEAVKKEKKPKTIKKQMKAKASDIFEDIK,sabio,P25152,N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>NC(Cc1ccccc1)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,0.00028,0.0,30.0,8.0,3.4.11.10,1423.0,-3.552841968657781,N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,NC(Cc1ccccc1)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,-3.552841968657781,N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MKKLLTVMTMAVLTAGTLLLPAQSVTPAAHAVQISNSERELPFKAKHAYSTISQLSEAIGPRIAGTAAEKKSALLIASSMRKLKLDVKVQRFNIPDRLEGTLSSAGRDILLQAASGSAPTEEQGLTAPLYNAGLGYQKDFTADAKGKIALISRGDLTYYEKAKNAEAAGAKAVIIYNNKESLVPMTPNLSGNKVGIPVVGIKKEDGEALTQQKEATLKLKAFTNQTSQNIIGIKKPKNIKHPDIVYVTAHYDSVPFSPGANDNGSGTSVMLEMARVLKSVPSDKEIRFIAFGAEELGLLGSSHYVDHLSEKELKRSEVNFNLDMVGTSWEKASELYVNTLDGQSNYVWESSRTAAEKIGFDSLSLTQGGSSDHVPFHEAGIDSANFIWGDPETEEVEPWYHTPEDSIEHISKERLQQAGDLVTAAVYEAVKKEKKPKTIKKQMKAKASDIFEDIK,./data/raw/alphafold//AF-P25152-F1-model_v4.pdb,1812,1490,3062,1814
+1583,5167,5253,MAASCVLLHTGQKMPLIGLGTWKSEPGQVKAAVKYALSVGYRHIDCAAIYGNEPEIGEALKEDVGPGKAVPREELFVTSKLWNTKHHPEDVEPALRKTLADLQLEYLDLYLMHWPYAFERGDNPFPKNADGTICYDSTHYKETWKALEALVAKGLVQALGLSNFNSRQIDDILSVASVRPAVLQVECHPYLAQNELIAHCQARGLEVTAYSPLGSSDRAWRDPDEPVLLEEPVVLALAEKYGRSPAQILLRWQVQRKVICIPKSITPSRILQNIKVFDFTFSPEEMKQLNALNKNWRYIVPMLTVDGKRVPRDAGHPLYPFNDPY,sabio,P14550,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)c1,30480.0,0.0,25.0,7.0,1.1.1.2,9606.0,4.484014962667563,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)c1,4.484014962667563,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]__MAASCVLLHTGQKMPLIGLGTWKSEPGQVKAAVKYALSVGYRHIDCAAIYGNEPEIGEALKEDVGPGKAVPREELFVTSKLWNTKHHPEDVEPALRKTLADLQLEYLDLYLMHWPYAFERGDNPFPKNADGTICYDSTHYKETWKALEALVAKGLVQALGLSNFNSRQIDDILSVASVRPAVLQVECHPYLAQNELIAHCQARGLEVTAYSPLGSSDRAWRDPDEPVLLEEPVVLALAEKYGRSPAQILLRWQVQRKVICIPKSITPSRILQNIKVFDFTFSPEEMKQLNALNKNWRYIVPMLTVDGKRVPRDAGHPLYPFNDPY,./data/raw/alphafold//AF-P14550-F1-model_v4.pdb,1329,3902,6226,892
+1584,11069,11224,MTTSPTAPVALVTGAAKRLGSSIAEALHAEGYTVCLHYHRSAADASTLAATLNARRPNSAITVQADLSNVATASFSETDGSVPVTLFSRCSALVDACYMHWGRCDVLVNNASSFYPTPLLRKDAGEGGSSVGDKESLEVAAADLFGSNAIAPYFLIKAFAQRVADTRAEQRGTSYSIVNMVDAMTSQPLLGYTMYTMAKEALEGLTRSAALELASLQIRVNGVSPGLSVLPDDMPFSVQEDYRRKVPLYQRNSSAEEVSDVVIFLCSPKAKYITGTCIKVDGGYSLTRA,uniprot_search,P42556,C[C@H](O)[C@H](O)c1cnc2[nH]c(=N)nc(O)c2n1.N=C(O)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@H](O)C1=Nc2c(O)nc(=N)[nH]c2NC1.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)c1,0.23,5.775878000634861e-15,,6.0,1.5.1.33,5689.0,-0.6382721639824072,C[C@H](O)[C@H](O)c1cnc2[nH]c(=N)nc(O)c2n1.N=C(O)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@H](O)C1=Nc2c(O)nc(=N)[nH]c2NC1.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,-0.6382721639824072,C[C@H](O)[C@H](O)c1cnc2[nH]c(=N)nc(O)c2n1.N=C(O)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+]__MTTSPTAPVALVTGAAKRLGSSIAEALHAEGYTVCLHYHRSAADASTLAATLNARRPNSAITVQADLSNVATASFSETDGSVPVTLFSRCSALVDACYMHWGRCDVLVNNASSFYPTPLLRKDAGEGGSSVGDKESLEVAAADLFGSNAIAPYFLIKAFAQRVADTRAEQRGTSYSIVNMVDAMTSQPLLGYTMYTMAKEALEGLTRSAALELASLQIRVNGVSPGLSVLPDDMPFSVQEDYRRKVPLYQRNSSAEEVSDVVIFLCSPKAKYITGTCIKVDGGYSLTRA,./data/raw/alphafold//AF-P42556-F1-model_v4.pdb,3093,1856,3487,2301
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+1604,19391,19677,MQTTVTTMLLASVALAACAGGGSTPLPLPQQQPPQQEPPPPPVPLASRAACEALKDGNGDMVWPNAATVVEVAAWRDAAPATASAAALPEHCEVSGAIAKRTGIDGYPYEIKFRLRMPAEWNGRFFMEGGSGTNGSLSAATGSIGGGQIASALSRNFATIATDGGHDNAVNDNPDALGTVAFGLDPQARLDMGYNSYDQVTQAGKAAVARFYGRAADKSYFIGCSEGGREGMMLSQRFPSHYDGIVAGAPGYQLPKAGISGAWTTQSLAPAAVGLDAQGVPLINKSFSDADLHLLSQAILGTCDALDGLADGIVDNYRACQAAFDPATAANPANGQALQCVGAKTADCLSPVQVTAIKRAMAGPVNSAGTPLYNRWAWDAGMSGLSGTTYNQGWRSWWLGSFNSSANNAQRVSGFSARSWLVDFATPPEPMPMTQVAARMMKFDFDIDPLKIWATSGQFTQSSMDWHGATSTDLAAFRDRGGKMILYHGMSDAAFSALDTADYYERLGAAMPGAAGFARLFLVPGMNHCSGGPGTDRFDMLTPLVAWVERGEAPDQISAWSGTPGYFGVAARTRPLCPYPQIARYKGSGDINTEANFACAAPP,sabio,A0A0K8P8E7,O.O=C(OCCO)c1ccc(C(=O)OCCO)cc1>>O=C([O-])c1ccc(C(=O)OCCO)cc1.OCCO,0.1,0.185124646922483,30.0,7.0,3.1.1.102,1547922.0,-1.0,O.O=C(OCCO)c1ccc(C(=O)OCCO)cc1,O=C([O-])c1ccc(C(=O)OCCO)cc1.OCCO,-1.0,O.O=C(OCCO)c1ccc(C(=O)OCCO)cc1__MQTTVTTMLLASVALAACAGGGSTPLPLPQQQPPQQEPPPPPVPLASRAACEALKDGNGDMVWPNAATVVEVAAWRDAAPATASAAALPEHCEVSGAIAKRTGIDGYPYEIKFRLRMPAEWNGRFFMEGGSGTNGSLSAATGSIGGGQIASALSRNFATIATDGGHDNAVNDNPDALGTVAFGLDPQARLDMGYNSYDQVTQAGKAAVARFYGRAADKSYFIGCSEGGREGMMLSQRFPSHYDGIVAGAPGYQLPKAGISGAWTTQSLAPAAVGLDAQGVPLINKSFSDADLHLLSQAILGTCDALDGLADGIVDNYRACQAAFDPATAANPANGQALQCVGAKTADCLSPVQVTAIKRAMAGPVNSAGTPLYNRWAWDAGMSGLSGTTYNQGWRSWWLGSFNSSANNAQRVSGFSARSWLVDFATPPEPMPMTQVAARMMKFDFDIDPLKIWATSGQFTQSSMDWHGATSTDLAAFRDRGGKMILYHGMSDAAFSALDTADYYERLGAAMPGAAGFARLFLVPGMNHCSGGPGTDRFDMLTPLVAWVERGEAPDQISAWSGTPGYFGVAARTRPLCPYPQIARYKGSGDINTEANFACAAPP,./data/raw/alphafold//AF-A0A0K8P8E7-F1-model_v4.pdb,270,2800,5122,5983
+1605,2571,2606,MATVDVLTSEVVVPAGETPAGAVWLSNLDLAARRGYTPTVFFYRHNGEPGFFAADAMRDSLARALVAFYPVAGRLGLDGDGRVQVDCTGEGVVFATARSGHYALDDLMGEFVPCDEMRDLFVPAAPAAASCCPRGGALLLVQVTYLRCGGVVLGMALHHSIADGRSAAHFVETWASIARGAPAADAPVPPCFDHRLLAARPARAVLYDHPEYKPEPAPPARAATASTYASAIITLTKQQVGALRAACAGASTFRAVVALVWQCACRARALPPEAETRLHSMIDTRQRLSPPLPPGYFGNAVIRTSTAATAGEVVSSPVGHAARRARAATSQGEDYARSVVDYLEGVDAMNLPRSGVSRADLRAISWLGMSLADADFGWGSPAFMGPAIMYYSGFVYVMNAPGKDGAVALALSLEPESMPEFRKVFADEVARLA,sabio,Q5SMM6,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.OCC(O)CO>>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)OC(CO)CO,0.037,0.0,37.0,7.5,2.3.1.-,4530.0,-1.431798275933005,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.OCC(O)CO,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)OC(CO)CO,-1.431798275933005,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.OCC(O)CO__MATVDVLTSEVVVPAGETPAGAVWLSNLDLAARRGYTPTVFFYRHNGEPGFFAADAMRDSLARALVAFYPVAGRLGLDGDGRVQVDCTGEGVVFATARSGHYALDDLMGEFVPCDEMRDLFVPAAPAAASCCPRGGALLLVQVTYLRCGGVVLGMALHHSIADGRSAAHFVETWASIARGAPAADAPVPPCFDHRLLAARPARAVLYDHPEYKPEPAPPARAATASTYASAIITLTKQQVGALRAACAGASTFRAVVALVWQCACRARALPPEAETRLHSMIDTRQRLSPPLPPGYFGNAVIRTSTAATAGEVVSSPVGHAARRARAATSQGEDYARSVVDYLEGVDAMNLPRSGVSRADLRAISWLGMSLADADFGWGSPAFMGPAIMYYSGFVYVMNAPGKDGAVALALSLEPESMPEFRKVFADEVARLA,./data/raw/alphafold//AF-Q5SMM6-F1-model_v4.pdb,1634,1236,1715,1445
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+1607,18258,18518,MYYGFDIGGTKIALGVFDSGRQLQWEKRVPTPRDSYDAFLDAVCELVAEADQRFGCKGSVGIGIPGMPETEDGTLYAANVPAASGKPLRADLSARLDRDVRLDNDANCFALSEAWDDEFTQYPLVMGLILGTGVGGGLIFNGKPITGKSYITGEFGHMRLPVDALTMMGLDFPLRRCGCGQHGCIENYLSGRGFAWLYQHYYHQPLQAPEIIALYDQGDEQARAHVERYLDLLAVCLGNILTIVDPDLVVIGGGLSNFPAITTQLADRLPRHLLPVARVPRIERARHGDAGGMRGAAFLHLTD,sabio,P75959,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,9.2,8.264070734796279e-15,25.0,7.6,2.7.1.59,562.0,0.9637878273455552,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,0.9637878273455552,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O__MYYGFDIGGTKIALGVFDSGRQLQWEKRVPTPRDSYDAFLDAVCELVAEADQRFGCKGSVGIGIPGMPETEDGTLYAANVPAASGKPLRADLSARLDRDVRLDNDANCFALSEAWDDEFTQYPLVMGLILGTGVGGGLIFNGKPITGKSYITGEFGHMRLPVDALTMMGLDFPLRRCGCGQHGCIENYLSGRGFAWLYQHYYHQPLQAPEIIALYDQGDEQARAHVERYLDLLAVCLGNILTIVDPDLVVIGGGLSNFPAITTQLADRLPRHLLPVARVPRIERARHGDAGGMRGAAFLHLTD,./data/raw/alphafold//AF-P75959-F1-model_v4.pdb,69,2544,2839,5686
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+1616,21235,21559,MPKLVLVRHGQSEWNEKNLFTGWVDVKLSAKGQQEAARAGELLKEKKVYPDVLYTSKLSRAIQTANIALEKADRLWIPVNRSWRLNERHYGDLQGKDKAETLKKFGEEKFNTYRRSFDVPPPPIDASSPFSQKGDERYKYVDPNVLPETESLALVIDRLLPYWQDVIAKDLLSGKTVMIAAHGNSLRGLVKHLEGISDADIAKLNIPTGIPLVFELDENLKPSKPSYYLDPEAAAAGAAAVANQGKK,brenda,P00950,O=C(O)C(O)COP(=O)(O)O>>O=C(O)C(CO)OP(=O)(O)O,530.0,0.0,30.0,7.45,5.4.2.11,4932.0,2.724275869600789,O=C(O)C(O)COP(=O)(O)O,O=C(O)C(CO)OP(=O)(O)O,2.724275869600789,O=C(O)C(O)COP(=O)(O)O__MPKLVLVRHGQSEWNEKNLFTGWVDVKLSAKGQQEAARAGELLKEKKVYPDVLYTSKLSRAIQTANIALEKADRLWIPVNRSWRLNERHYGDLQGKDKAETLKKFGEEKFNTYRRSFDVPPPPIDASSPFSQKGDERYKYVDPNVLPETESLALVIDRLLPYWQDVIAKDLLSGKTVMIAAHGNSLRGLVKHLEGISDADIAKLNIPTGIPLVFELDENLKPSKPSYYLDPEAAAAGAAAVANQGKK,./data/raw/alphafold//AF-P00950-F1-model_v4.pdb,274,2807,5129,5990
+1617,16912,17142,MTKPTTMAIFLSIVLLSMAQLPSLVAGTGRPRVIIIGAGISGISAGKRLSEAGITDILILEATDHIGGRMHKQRFAGVNVEIGANWVEGVNGEKMNPIWPIVNSTLKLRNFLSDFDSLAQNVYKDGGLCDAAYVQKRIDLADEADKSGENLSATLHPSGRDDMSILSMQRLNNHLPNGPSSPVDMVVDYFTYDYEFAEPPRVTSLRNTVPLPTFTDFGDDNYFVADQRGYEAVVYYLAGQYLEADKSGNIVDARLQLNKVVREISYSSTGVTVKTEDNSTYQADYVMVSASLGVLQSDLIQFKPQLPSWKILAIYQFDMAVYTKIFVKFPKKFWPEGAGREFFLYASTRRGYYGVWQEFEKQYPDANVLLVTVTDEESRRIEQQPDSQTKAEIMEVVRSMFPDEDVPDATDILVPRWWSDRFFQGSFSNWPIGVSRYEHDQLRAPVGRVYFTGEHTSERYNGYVHGAYLAGIYA,brenda,Q0J290,NCCCNCCCCNCCCN.O.O=O>>NCCCC(=O)CCCN.NCCCN.OO,32.6,1.1240141513809682e-14,30.0,6.5,1.5.3.14,4530.0,1.513217600067939,NCCCNCCCCNCCCN.O.O=O,NCCCC(=O)CCCN.NCCCN.OO,1.513217600067939,NCCCNCCCCNCCCN.O.O=O__MTKPTTMAIFLSIVLLSMAQLPSLVAGTGRPRVIIIGAGISGISAGKRLSEAGITDILILEATDHIGGRMHKQRFAGVNVEIGANWVEGVNGEKMNPIWPIVNSTLKLRNFLSDFDSLAQNVYKDGGLCDAAYVQKRIDLADEADKSGENLSATLHPSGRDDMSILSMQRLNNHLPNGPSSPVDMVVDYFTYDYEFAEPPRVTSLRNTVPLPTFTDFGDDNYFVADQRGYEAVVYYLAGQYLEADKSGNIVDARLQLNKVVREISYSSTGVTVKTEDNSTYQADYVMVSASLGVLQSDLIQFKPQLPSWKILAIYQFDMAVYTKIFVKFPKKFWPEGAGREFFLYASTRRGYYGVWQEFEKQYPDANVLLVTVTDEESRRIEQQPDSQTKAEIMEVVRSMFPDEDVPDATDILVPRWWSDRFFQGSFSNWPIGVSRYEHDQLRAPVGRVYFTGEHTSERYNGYVHGAYLAGIYA,./data/raw/alphafold//AF-Q0J290-F1-model_v4.pdb,2967,1706,3318,2120
+1618,11880,12038,MWCIVLFSLLAWVYAEPTMYGEILSPNYPQAYPSEVEKSWDIEVPEGYGIHLYFTHLDIELSENCAYDSVQIISGDTEEGRLCGQRSSNNPHSPIVEEFQVPYNKLQVIFKSDFSNEERFTGFAAYYVATDINECTDFVDVPCSHFCNNFIGGYFCSCPPEYFLHDDMKNCGVNCSGDVFTALIGEIASPNYPKPYPENSRCEYQIRLEKGFQVVVTLRREDFDVEAADSAGNCLDSLVFVAGDRQFGPYCGHGFPGPLNIETKSNALDIIFQTDLTGQKKGWKLRYHGDPMPCPKEDTPNSVWEPAKAKYVFRDVVQITCLDGFEVVEGRVGATSFYSTCQSNGKWSNSKLKCQPVDCGIPESIENGKVEDPESTLFGSVIRYTCEEPYYYMENGGGGEYHCAGNGSWVNEVLGPELPKCVPVCGVPREPFEEKQRIIGGSDADIKNFPWQVFFDNPWAGGALINEYWVLTAAHVVEGNREPTMYVGSTSVQTSRLAKSKMLTPEHVFIHPGWKLLEVPEGRTNFDNDIALVRLKDPVKMGPTVSPICLPGTSSDYNLMDGDLGLISGWGRTEKRDRAVRLKAARLPVAPLRKCKEVKVEKPTADAEAYVFTPNMICAGGEKGMDSCKGDSGGAFAVQDPNDKTKFYAAGLVSWGPQCGTYGLYTRVKNYVDWIMKTMQENSTPRED,brenda,P09871,Cc1cc(=O)oc2cc(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(O)[C@H](C)N=C(O)OCc3ccccc3)ccc12.O>>CC(C)C[C@H](N=C(O)CN=C(O)[C@H](C)N=C(O)OCc1ccccc1)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,35.3,0.0,37.0,7.4,3.4.21.42,9606.0,1.5477747053878226,Cc1cc(=O)oc2cc(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(O)[C@H](C)N=C(O)OCc3ccccc3)ccc12.O,CC(C)C[C@H](N=C(O)CN=C(O)[C@H](C)N=C(O)OCc1ccccc1)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,1.5477747053878226,Cc1cc(=O)oc2cc(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(O)[C@H](C)N=C(O)OCc3ccccc3)ccc12.O__MWCIVLFSLLAWVYAEPTMYGEILSPNYPQAYPSEVEKSWDIEVPEGYGIHLYFTHLDIELSENCAYDSVQIISGDTEEGRLCGQRSSNNPHSPIVEEFQVPYNKLQVIFKSDFSNEERFTGFAAYYVATDINECTDFVDVPCSHFCNNFIGGYFCSCPPEYFLHDDMKNCGVNCSGDVFTALIGEIASPNYPKPYPENSRCEYQIRLEKGFQVVVTLRREDFDVEAADSAGNCLDSLVFVAGDRQFGPYCGHGFPGPLNIETKSNALDIIFQTDLTGQKKGWKLRYHGDPMPCPKEDTPNSVWEPAKAKYVFRDVVQITCLDGFEVVEGRVGATSFYSTCQSNGKWSNSKLKCQPVDCGIPESIENGKVEDPESTLFGSVIRYTCEEPYYYMENGGGGEYHCAGNGSWVNEVLGPELPKCVPVCGVPREPFEEKQRIIGGSDADIKNFPWQVFFDNPWAGGALINEYWVLTAAHVVEGNREPTMYVGSTSVQTSRLAKSKMLTPEHVFIHPGWKLLEVPEGRTNFDNDIALVRLKDPVKMGPTVSPICLPGTSSDYNLMDGDLGLISGWGRTEKRDRAVRLKAARLPVAPLRKCKEVKVEKPTADAEAYVFTPNMICAGGEKGMDSCKGDSGGAFAVQDPNDKTKFYAAGLVSWGPQCGTYGLYTRVKNYVDWIMKTMQENSTPRED,./data/raw/alphafold//AF-P09871-F1-model_v4.pdb,1419,932,731,1026
+1619,16981,17211,MKTFTSALALVVGMLAPGAVVAAPPSTPAQRDLVELREARQEGGKDLRPREPTCNTPSNRACWSDGFDINTDYEVSTPDTGVTQSYVFNLTEVDNWMGPDGVVKEKVMLINGNIMGPNIVANWGDTVEVTVINNLVTNGTSIHWHGIHQKDTNLHDGANGVTECPIPPKGGQRTYRWRARQYGTSWYHSHFSAQYGNGVVGTIQINGPASLPYDIDLGVFPITDYYYRAADDLVHFTQNNAPPFSDNVLINGTAVNPNTGEGQYANVTLTPGKRHRLRILNTSTENHFQVSLVNHTMTVIAADMVPVNAMTVDSLFLAVGQRYDVVIDASRAPDNYWFNVTFGGQAACGGSLNPHPAAIFHYAGAPGGLPTDEGTPPVDHQCLDTLDVRPVVPRSVPVNSFVKRPDNTLPVALDLTGTPLFVWKVNGSDINVDWGKPIIDYILTGNTSYPVSDNIVQVDAVDQWTYWLIENDPEGPFSLPHPMHLHGHDFLVLGRSPDVPAASQQRFVFDPAVDLARLNGDNPPRRDTTMLPAGGWLLLAFRTDNPGAWLFHCHIAWHVSGGLSVDFLERPADLRQRISQEDEDDFNRVCDEWRAYWPTNPYPKIDSGLKRRRWVEESEWLVR,uniprot_search,Q70KY3,NCCc1ccc(O)c(O)c1.O=O>>,116.0,99.4628824948034,25.0,5.0,1.10.3.2,204285.0,2.0644579892269186,NCCc1ccc(O)c(O)c1.O=O,,2.0644579892269186,NCCc1ccc(O)c(O)c1.O=O__MKTFTSALALVVGMLAPGAVVAAPPSTPAQRDLVELREARQEGGKDLRPREPTCNTPSNRACWSDGFDINTDYEVSTPDTGVTQSYVFNLTEVDNWMGPDGVVKEKVMLINGNIMGPNIVANWGDTVEVTVINNLVTNGTSIHWHGIHQKDTNLHDGANGVTECPIPPKGGQRTYRWRARQYGTSWYHSHFSAQYGNGVVGTIQINGPASLPYDIDLGVFPITDYYYRAADDLVHFTQNNAPPFSDNVLINGTAVNPNTGEGQYANVTLTPGKRHRLRILNTSTENHFQVSLVNHTMTVIAADMVPVNAMTVDSLFLAVGQRYDVVIDASRAPDNYWFNVTFGGQAACGGSLNPHPAAIFHYAGAPGGLPTDEGTPPVDHQCLDTLDVRPVVPRSVPVNSFVKRPDNTLPVALDLTGTPLFVWKVNGSDINVDWGKPIIDYILTGNTSYPVSDNIVQVDAVDQWTYWLIENDPEGPFSLPHPMHLHGHDFLVLGRSPDVPAASQQRFVFDPAVDLARLNGDNPPRRDTTMLPAGGWLLLAFRTDNPGAWLFHCHIAWHVSGGLSVDFLERPADLRQRISQEDEDDFNRVCDEWRAYWPTNPYPKIDSGLKRRRWVEESEWLVR,./data/raw/alphafold//AF-Q70KY3-F1-model_v4.pdb,3423,2323,1035,2933
+1620,7544,7666,MSATEGKVITCKAAVAWEAKKPLVIEDIEVAPPKAHEVRIKITATGVCHTDAFTLSGADPEGLFPVVLGHEGAGIVESVGEGVTNFKAGDHVIALYIPQCNECKFCKSGKTNLCQKIRLTQGAGVMPEGTSRLSCKGQQLFHFMGTSTFAEYTVVADISLTKINEKAPLEKVCLLGCGISTGYGAALNTAKVEAGSTCAVWGLGAVGLAVGLGCKKAGAGKIYGIDINPDKFELAKKFGFTDFVNPKDVADKGSIQNYLIDLTDGGFDYTFECIGNVNTMRSALEATHKGWGTSVVIGVAGAGQEISTRPFQLVVGRVWKGSAFGGWRSVSDVPKLVEDYLKKDLLVDEFITHELPLSQINEAFDLMHKGESIRSIIKY,sabio,P46415,CCCCCO.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>>CCCCC=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],50400.0,7.548044698734811e-15,,10.0,1.1.1.284,7227.0,4.702430536445525,CCCCCO.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,CCCCC=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],4.702430536445525,CCCCCO.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__MSATEGKVITCKAAVAWEAKKPLVIEDIEVAPPKAHEVRIKITATGVCHTDAFTLSGADPEGLFPVVLGHEGAGIVESVGEGVTNFKAGDHVIALYIPQCNECKFCKSGKTNLCQKIRLTQGAGVMPEGTSRLSCKGQQLFHFMGTSTFAEYTVVADISLTKINEKAPLEKVCLLGCGISTGYGAALNTAKVEAGSTCAVWGLGAVGLAVGLGCKKAGAGKIYGIDINPDKFELAKKFGFTDFVNPKDVADKGSIQNYLIDLTDGGFDYTFECIGNVNTMRSALEATHKGWGTSVVIGVAGAGQEISTRPFQLVVGRVWKGSAFGGWRSVSDVPKLVEDYLKKDLLVDEFITHELPLSQINEAFDLMHKGESIRSIIKY,./data/raw/alphafold//AF-P46415-F1-model_v4.pdb,1323,2177,3857,2723
+1621,16926,17156,GSVLCVKCNNDEVVIKFLHGLNCNFDCASIGEISKVIKLLPNLSRDRIIFANTIKSINSLIYARKENINLCTFDNLDVLKKIYKYHPKCSLILRINVDFKNYKSYMSSKYGANEYEWEEMLLYAKKHNLNIVGVSFHVGSNTKNLFDFCLAIKLCRDVFDMSSNMGFNFYIINLGGGYPEELEYDNAKKHDKIHYCTLSLQEIKKDIQKFLNEETFLKTKYGYYSFEKISLAINMSIDHYFTHMKDNLRVICE,uniprot_search,O15869,NCCC[C@H](N)C(=O)O>>NCCCCN.O=C=O,0.003,0.0,37.0,7.833333333333333,4.1.1.17,5833.0,-2.5228787452803374,NCCC[C@H](N)C(=O)O,NCCCCN.O=C=O,-2.2218487496163566,NCCC[C@H](N)C(=O)O__GSVLCVKCNNDEVVIKFLHGLNCNFDCASIGEISKVIKLLPNLSRDRIIFANTIKSINSLIYARKENINLCTFDNLDVLKKIYKYHPKCSLILRINVDFKNYKSYMSSKYGANEYEWEEMLLYAKKHNLNIVGVSFHVGSNTKNLFDFCLAIKLCRDVFDMSSNMGFNFYIINLGGGYPEELEYDNAKKHDKIHYCTLSLQEIKKDIQKFLNEETFLKTKYGYYSFEKISLAINMSIDHYFTHMKDNLRVICE,./data/raw/alphafold//AF-O15869-F1-model_v4.pdb,2725,5259,2515,5333
+1622,20167,20456,MMYKKFAALAALVAGASAQQACSLTAENHPSLTWKRCTSGGSCSTVNGAVTIDANWRWTHTVSGSTNCYTGNQWDTSLCTDGKSCAQTCCVDGADYSSTYGITTSGDSLNLKFVTKHQYGTNVGSRVYLMENDTKYQMFELLGNEFTFDVDVSNLGCGLNGALYFVSMDADGGMSKYSGNKAGAKYGTGYCDAQCPRDLKFINGEANVGNWTPSTNDANAGFGRYGSCCSEMDVWEANNMATAFTPHPCTTVGQSRCEADTCGGTYSSDRYAGVCDPDGCDFNAYRQGDKTFYGKGMTVDTNKKMTVVTQFHKNSAGVLSEIKRFYVQDGKIIANAESKIPGNPGNSITQEYCDAQKVAFSNTDDFNRKGGMAQMSKALAGPMVLVMSVWDDHYANMLWLDSTYPIDQAGAPGAERGACPTTSGVPAEIEAQVPNSNVIFSNIRFGPIGSTVPGLDGSNPGNPTTTVVPPASTSTSRPTSSTSSPVSTPTGQPGGCTTQKWGQCGGIGYTGCTNCVAGTTCTQLNPWYSQCL,brenda,A7WNU1,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(Cl)c1>>O=[N+]([O-])c1ccc(O)c(Cl)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,0.3167,1.1008656664602446e-14,22.0,5.7,3.2.1.176,209285.0,-0.4993519366280881,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(Cl)c1,O=[N+]([O-])c1ccc(O)c(Cl)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,-0.4993519366280881,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(Cl)c1__MMYKKFAALAALVAGASAQQACSLTAENHPSLTWKRCTSGGSCSTVNGAVTIDANWRWTHTVSGSTNCYTGNQWDTSLCTDGKSCAQTCCVDGADYSSTYGITTSGDSLNLKFVTKHQYGTNVGSRVYLMENDTKYQMFELLGNEFTFDVDVSNLGCGLNGALYFVSMDADGGMSKYSGNKAGAKYGTGYCDAQCPRDLKFINGEANVGNWTPSTNDANAGFGRYGSCCSEMDVWEANNMATAFTPHPCTTVGQSRCEADTCGGTYSSDRYAGVCDPDGCDFNAYRQGDKTFYGKGMTVDTNKKMTVVTQFHKNSAGVLSEIKRFYVQDGKIIANAESKIPGNPGNSITQEYCDAQKVAFSNTDDFNRKGGMAQMSKALAGPMVLVMSVWDDHYANMLWLDSTYPIDQAGAPGAERGACPTTSGVPAEIEAQVPNSNVIFSNIRFGPIGSTVPGLDGSNPGNPTTTVVPPASTSTSRPTSSTSSPVSTPTGQPGGCTTQKWGQCGGIGYTGCTNCVAGTTCTQLNPWYSQCL,./data/raw/alphafold//AF-A7WNU1-F1-model_v4.pdb,1951,3462,1958,3796
+1623,6712,6826,MELFLAGRRVLVTGAGKGIGRGTVQALHATGARVVAVSRTQADLDSLVRECPGIEPVCVDLGDWEATERALGSVGPVDLLVNNAAVALLQPFLEVTKEAFDRSFEVNLRAVIQVSQIVARGLIARGVPGAIVNVSSQCSQRAVTNHSVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTSMGQATWSDPHKAKTMLNRIPLGKFAEVEHVVNAILFLLSDRSGMTTGSTLPVEGGFWAC,sabio,Q7Z4W1,CCCCC(=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]>>CCCCC(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)c1,1.8,6.495618676272533e-15,25.0,7.0,1.1.1.10,9606.0,0.255272505103306,CCCCC(=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],CCCCC(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)c1,0.255272505103306,CCCCC(=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]__MELFLAGRRVLVTGAGKGIGRGTVQALHATGARVVAVSRTQADLDSLVRECPGIEPVCVDLGDWEATERALGSVGPVDLLVNNAAVALLQPFLEVTKEAFDRSFEVNLRAVIQVSQIVARGLIARGVPGAIVNVSSQCSQRAVTNHSVYCSTKGALDMLTKVMALELGPHKIRVNAVNPTVVMTSMGQATWSDPHKAKTMLNRIPLGKFAEVEHVVNAILFLLSDRSGMTTGSTLPVEGGFWAC,./data/raw/alphafold//AF-Q7Z4W1-F1-model_v4.pdb,1316,3874,6191,849
+1624,6518,6631,MNTRSLVLPELLPLLGEIPTVDLSAESLPAFRAGLEQTAGQSFLQAEDYPVTLERLNIPGTENAPPIRLLTVRPRKEATGPRRALLHLHGGGYFAGQPELTTTQLCQFAQELDCVVISPDYRLTPEHPFPAAIEDAYTTLCWITRNADTLGIDPARIGLTGESAGGGLAAGLALLTRDREGPALLFQNLIYPVLDDRTITGQPDASPVGGEFLWTRASNTFMWTALLNPVAPGSADVSPYAAPARATDLSDLPPVYLCVGALDLFLDEDLAYARRLIHQGISVELEIVPGACHIFDQTDTPVATRSIARRIDAMKRGFGL,brenda,Q5FSJ2,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,97.2,0.0,25.0,7.0,3.1.1.2,442.0,1.9876662649262744,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CCCC(=O)O.O=[N+]([O-])c1ccc(O)cc1,1.9876662649262744,CCCC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MNTRSLVLPELLPLLGEIPTVDLSAESLPAFRAGLEQTAGQSFLQAEDYPVTLERLNIPGTENAPPIRLLTVRPRKEATGPRRALLHLHGGGYFAGQPELTTTQLCQFAQELDCVVISPDYRLTPEHPFPAAIEDAYTTLCWITRNADTLGIDPARIGLTGESAGGGLAAGLALLTRDREGPALLFQNLIYPVLDDRTITGQPDASPVGGEFLWTRASNTFMWTALLNPVAPGSADVSPYAAPARATDLSDLPPVYLCVGALDLFLDEDLAYARRLIHQGISVELEIVPGACHIFDQTDTPVATRSIARRIDAMKRGFGL,./data/raw/alphafold//AF-Q5FSJ2-F1-model_v4.pdb,1492,1040,866,1196
+1625,5187,5273,MSRVAIVTGASSGNGLAIATRFLARGDRVAALDLSAETLEETARTHWHAYADKVLRVRADVADEGDVNAAIAATMEQFGAIDVLVNNAGITGNSEAGVLHTTPVEQFDKVMAVNVRGIFLGCRAVLPHMLLQGAGVIVNIASVASLVAFPGRSAYTTSKGAVLQLTKSVAVDYAGSGIRCNAVCPGMIETPMTQWRLDQPELRDQVLARIPQKEIGTAAQVADAVMFLAGEDATYVNGAALVMDGAYTAI,brenda,Q56840,CC(O)CSC(C)S(=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>>N=C(O)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=CCSCCS(=O)(=O)O.[H+],0.29,0.8172285076243349,,8.016666666666667,1.1.1.268,35809.0,-0.5376020021010439,CC(O)CSC(C)S(=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,N=C(O)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=CCSCCS(=O)(=O)O.[H+],-0.2596373105057561,CC(O)CSC(C)S(=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__MSRVAIVTGASSGNGLAIATRFLARGDRVAALDLSAETLEETARTHWHAYADKVLRVRADVADEGDVNAAIAATMEQFGAIDVLVNNAGITGNSEAGVLHTTPVEQFDKVMAVNVRGIFLGCRAVLPHMLLQGAGVIVNIASVASLVAFPGRSAYTTSKGAVLQLTKSVAVDYAGSGIRCNAVCPGMIETPMTQWRLDQPELRDQVLARIPQKEIGTAAQVADAVMFLAGEDATYVNGAALVMDGAYTAI,./data/raw/alphafold//AF-Q56840-F1-model_v4.pdb,1373,874,670,959
+1626,15066,15277,MFATRQAFNLFQKRAFSASARQSSKVAILGAAGGIGQPLSLLMKLNPRVTELALYDIRGGPGVAADLSHINTNSTVTGYQPTPEGLRDALKGSEIVLIPAGVPRKRGMTRDDLFNTNASIVRDLAKAAADACPNANILVISNPVNSTVPIVAEVFKSKGVYNPKRLFGVTTLDVVRASRFISEVKNTDPANEEVTVVGGHSGVTIVPLISQSNHPDIEGETRDKLVNRIQFGGDEGVKAKDGAGSAALSMAFAGARSPSLCSSGQGVKGVVKPSFVDSPLYKDQGIDFFASRVELGPNGAEKVLPVGKVSPYEEKLLEAAFADLKKNIQKGIDFVKNNP,sabio,Q8X1C8,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]>>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,110000.0,7.114097664129157e-15,30.0,7.4,1.1.1.37,68825.0,5.041392685158225,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],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,5.041392685158225,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]__MFATRQAFNLFQKRAFSASARQSSKVAILGAAGGIGQPLSLLMKLNPRVTELALYDIRGGPGVAADLSHINTNSTVTGYQPTPEGLRDALKGSEIVLIPAGVPRKRGMTRDDLFNTNASIVRDLAKAAADACPNANILVISNPVNSTVPIVAEVFKSKGVYNPKRLFGVTTLDVVRASRFISEVKNTDPANEEVTVVGGHSGVTIVPLISQSNHPDIEGETRDKLVNRIQFGGDEGVKAKDGAGSAALSMAFAGARSPSLCSSGQGVKGVVKPSFVDSPLYKDQGIDFFASRVELGPNGAEKVLPVGKVSPYEEKLLEAAFADLKKNIQKGIDFVKNNP,./data/raw/alphafold//AF-Q8X1C8-F1-model_v4.pdb,2247,4985,2068,4928
+1627,19640,19926,MNVFFMFSLLFLAALGSCADDRNPLAECFQENDYEEFLEIARNGLKATSNPKHVVIVGAGMAGLSAAYVLAGAGHQVTVLEASERPGGRVRTYRNEEAGWYANLGPMRLPEKHRIVREYIRKFDLRLNEFSQENDNAWYFIKNIRKKVGEVKKDPGLLKYPVKPSEAGKSAGQLYEESLGKVVEELKRTNCSYILNKYDTYSTKEYLIKEGDLSPGAVDMIGDLLNEDSGYYVSFIESLKHDDIFAYEKRFDEIVDGMDKLPTAMYRDIQDKVHFNAQVIKIQQNDQKVTVVYETLSKETPSVTADYVIVCTTSRAVRLIKFNPPLLPKKAHALRSVHYRSGTKIFLTCTTKFWEDDGIHGGKSTTDLPSRFIYYPNHNFTNGVGVIIAYGIGDDANFFQALDFKDCADIVFNDLSLIHQLPKKDIQSFCYPSVIQKWSLDKYAMGGITTFTPYQFQHFSDPLTASQGRIYFAGEYTAQAHGWIDSTIKSGLRAARDVNLASENPSGIHLSNDNEL,sabio,P81382,O.O=O.O=O>>N.OO,0.82,23.09930178432894,25.0,8.5,1.4.3.2,8717.0,-0.0861861476162833,O.O=O.O=O,N.OO,-0.0861861476162833,O.O=O.O=O__MNVFFMFSLLFLAALGSCADDRNPLAECFQENDYEEFLEIARNGLKATSNPKHVVIVGAGMAGLSAAYVLAGAGHQVTVLEASERPGGRVRTYRNEEAGWYANLGPMRLPEKHRIVREYIRKFDLRLNEFSQENDNAWYFIKNIRKKVGEVKKDPGLLKYPVKPSEAGKSAGQLYEESLGKVVEELKRTNCSYILNKYDTYSTKEYLIKEGDLSPGAVDMIGDLLNEDSGYYVSFIESLKHDDIFAYEKRFDEIVDGMDKLPTAMYRDIQDKVHFNAQVIKIQQNDQKVTVVYETLSKETPSVTADYVIVCTTSRAVRLIKFNPPLLPKKAHALRSVHYRSGTKIFLTCTTKFWEDDGIHGGKSTTDLPSRFIYYPNHNFTNGVGVIIAYGIGDDANFFQALDFKDCADIVFNDLSLIHQLPKKDIQSFCYPSVIQKWSLDKYAMGGITTFTPYQFQHFSDPLTASQGRIYFAGEYTAQAHGWIDSTIKSGLRAARDVNLASENPSGIHLSNDNEL,./data/raw/alphafold//AF-P81382-F1-model_v4.pdb,1381,1496,3068,1821
+1628,22033,22365,MNNTSITGPQVLHRTKMRPLPVLEKYCISPHHGFLDDRLPLTRLSSKKYMKWEEIVADLPSLLQEDNKVRSVIDGLDVLDLDETILGDVRELRRAYSILGFMAHAYIWASGTPRDVLPECIARPLLETAHILGVPPLATYSSLVLWNFKVTDECKKTETGCLDLENITTINTFTGTVDESWFYLVSVRFEKIGSACLNHGLQILRAIRSGDKGDANVIDGLEGLAATIERLSKALMEMELKCEPNVFYFKIRPFLAGWTNMSHMGLPQGVRYGAEGQYRIFSGGSNAQSSLIQTLDILLGVKHTANAAHSSQGDSKINYLDEMKKYMPREHREFLYHLESVCNIREYVSRNASNRALQEAYGRCISMLKIFRDNHIQIVTKYIILPSNSKQHGSNKPNVLSPIEPNTKASGCLGHKVASSKTIGTGGTRLMPFLKQCRDETVATADIKNEDKN,sabio,P47125,O=O.O=O>>N[C@H](CC(=O)c1ccccc1N=CO)C(=O)O,6060.0,57.17724078174639,37.0,6.5,1.13.11.52,4932.0,3.782472624166286,O=O.O=O,N[C@H](CC(=O)c1ccccc1N=CO)C(=O)O,3.782472624166286,O=O.O=O__MNNTSITGPQVLHRTKMRPLPVLEKYCISPHHGFLDDRLPLTRLSSKKYMKWEEIVADLPSLLQEDNKVRSVIDGLDVLDLDETILGDVRELRRAYSILGFMAHAYIWASGTPRDVLPECIARPLLETAHILGVPPLATYSSLVLWNFKVTDECKKTETGCLDLENITTINTFTGTVDESWFYLVSVRFEKIGSACLNHGLQILRAIRSGDKGDANVIDGLEGLAATIERLSKALMEMELKCEPNVFYFKIRPFLAGWTNMSHMGLPQGVRYGAEGQYRIFSGGSNAQSSLIQTLDILLGVKHTANAAHSSQGDSKINYLDEMKKYMPREHREFLYHLESVCNIREYVSRNASNRALQEAYGRCISMLKIFRDNHIQIVTKYIILPSNSKQHGSNKPNVLSPIEPNTKASGCLGHKVASSKTIGTGGTRLMPFLKQCRDETVATADIKNEDKN,./data/raw/alphafold//AF-P47125-F1-model_v4.pdb,2818,5121,2247,5131
+1629,3020,3062,MSANFTDKNGRQSKGVLLLRTLAMPSDTNANGDIFGGWIMSQMDMGGAILAKEIAHGRVVTVAVESMNFIKPISVGDVVCCYGQCLKVGRSSIKIKVEVWVKKVASEPIGERYCVTDAVFTFVAVDNNGRSRTIPRENNQELEKALALISEQPL,brenda,P44886,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)Cc1ccccc1.O>>CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.O=C(O)Cc1ccccc1,130.0,6.286660546367751e-15,25.0,7.5,3.1.2.20,727.0,2.113943352306837,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)Cc1ccccc1.O,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.O=C(O)Cc1ccccc1,2.113943352306837,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCSC(=O)Cc1ccccc1.O__MSANFTDKNGRQSKGVLLLRTLAMPSDTNANGDIFGGWIMSQMDMGGAILAKEIAHGRVVTVAVESMNFIKPISVGDVVCCYGQCLKVGRSSIKIKVEVWVKKVASEPIGERYCVTDAVFTFVAVDNNGRSRTIPRENNQELEKALALISEQPL,./data/raw/alphafold//AF-P44886-F1-model_v4.pdb,1541,1097,253,274
+1630,15451,15675,MGKVLEKEAFGLAAKDESGILSPFSFSRRATGEKDVRFKVLFCGICHTDLSMAKNEWGLTTYPLVPGHEIVGVVTEVGAKVKKFNAGDKVGVGYMAGSCRSCDSCNDGDENYCPKMILTSGAKNFDDTMTHGGYSDHMVCAEDFIIRIPDNLPLDGAAPLLCAGVTVYSPMKYHGLDKPGMHIGVVGLGGLGHVAVKFAKAMGTKVTVISTSERKRDEAVTRLGADAFLVSRDPKQMKDAMGTMDGIIDTVSATHPLLPLLGLLKNKGKLVMVGAPAEPLELPVFPLIFGRKMVVGSMVGGIKETQEMVDLAGKHNITADIELISADYVNTAMERLAKADVKYRFVIDVANTMKPTP,sabio,Q02971,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)c(O)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.OCC=Cc1ccc(O)c(O)c1,6.04,6.239035846045135e-15,30.0,6.25,1.1.1.195,3702.0,0.7810369386211319,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)c(O)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.OCC=Cc1ccc(O)c(O)c1,0.7810369386211319,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)c(O)c1.[H]__MGKVLEKEAFGLAAKDESGILSPFSFSRRATGEKDVRFKVLFCGICHTDLSMAKNEWGLTTYPLVPGHEIVGVVTEVGAKVKKFNAGDKVGVGYMAGSCRSCDSCNDGDENYCPKMILTSGAKNFDDTMTHGGYSDHMVCAEDFIIRIPDNLPLDGAAPLLCAGVTVYSPMKYHGLDKPGMHIGVVGLGGLGHVAVKFAKAMGTKVTVISTSERKRDEAVTRLGADAFLVSRDPKQMKDAMGTMDGIIDTVSATHPLLPLLGLLKNKGKLVMVGAPAEPLELPVFPLIFGRKMVVGSMVGGIKETQEMVDLAGKHNITADIELISADYVNTAMERLAKADVKYRFVIDVANTMKPTP,./data/raw/alphafold//AF-Q02971-F1-model_v4.pdb,3542,3496,1260,3207
+1631,14433,14636,MRIGIIGLGRMGGNIAVRLTRHGHDVVVHDRTSEVTTSVVGRCEAGRATPADTLADMAKLLEGDEHRVVWVMLPAGAITEDCVQQLGGLLGRGDIIIDGGNTYYKDDVRRSAELAEKGISYVDVGTSGGVWGLERGYCMMFGGTKETAEYIDPILSALAPGIGDVPRTPGRDEAGHDPRAEQGYLHCGPAGSGHFVKMVHNGIEYGMMQAFAEGFDIMKSKNSPILAEKDRFELNMGDIAEVWRRGSVVSSWLLDLTAEALTRSETLNEFSGEVADSGEGRWTIEAAIEEDVPAPVMTAALFTRFRSRSGNNFAEKILSAQRFGFGGHVEKK,brenda,G5EBD7,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+],23.0,0.0,25.0,7.0,1.1.1.343,442.0,1.3617278360175928,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+],1.3617278360175928,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__MRIGIIGLGRMGGNIAVRLTRHGHDVVVHDRTSEVTTSVVGRCEAGRATPADTLADMAKLLEGDEHRVVWVMLPAGAITEDCVQQLGGLLGRGDIIIDGGNTYYKDDVRRSAELAEKGISYVDVGTSGGVWGLERGYCMMFGGTKETAEYIDPILSALAPGIGDVPRTPGRDEAGHDPRAEQGYLHCGPAGSGHFVKMVHNGIEYGMMQAFAEGFDIMKSKNSPILAEKDRFELNMGDIAEVWRRGSVVSSWLLDLTAEALTRSETLNEFSGEVADSGEGRWTIEAAIEEDVPAPVMTAALFTRFRSRSGNNFAEKILSAQRFGFGGHVEKK,./data/raw/alphafold//AF-G5EBD7-F1-model_v4.pdb,2591,4783,4840,4686
+1632,9847,9996,MSSCSRVALVTGANKGIGFAITRDLCRKFSGDVVLTARDEARGRAAVQQLQAEGLSPRFHQLDIDDPQSIRALRDFLRKEYGGLNVLVNNAGIAFRMDDPTPFDIQAEVTLKTNFFATRNVCTELLPIMKPHGRVVNISSLQGLKALENCREDLQEKFRCDTLTEVDLVDLMKKFVEDTKNEVHEREGWPDSAYGVSKLGVTVLTRILARQLDEKRKADRILLNACCPGWVKTDMARDQGSRTVEEGAETPVYLALLPPDATEPHGQLVRDKVVQTW,brenda,Q8K354,COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]>>COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)([C@@H](O)CO)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1.N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.0014,0.0,37.0,7.0,1.1.1.184,10090.0,-2.853871964321762,COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+],COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)([C@@H](O)CO)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1.N=C(O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,-2.853871964321762,COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1.N=C(O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OP(=O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.[H+]__MSSCSRVALVTGANKGIGFAITRDLCRKFSGDVVLTARDEARGRAAVQQLQAEGLSPRFHQLDIDDPQSIRALRDFLRKEYGGLNVLVNNAGIAFRMDDPTPFDIQAEVTLKTNFFATRNVCTELLPIMKPHGRVVNISSLQGLKALENCREDLQEKFRCDTLTEVDLVDLMKKFVEDTKNEVHEREGWPDSAYGVSKLGVTVLTRILARQLDEKRKADRILLNACCPGWVKTDMARDQGSRTVEEGAETPVYLALLPPDATEPHGQLVRDKVVQTW,./data/raw/alphafold//AF-Q8K354-F1-model_v4.pdb,1319,3880,4510,3275
+1633,9468,9610,MRKSPGVTFSVLNLDLWIAHCSSDDHSEMRAGNNDKVIQTAQVFEPGKGVKGLEVTEDHWKLQCNVMVEVWTYNGRNDGPEIEVRRGDRVIILNKNDLNHPKTLHVHGEPVPNDMDGLPGNTQEAIDPGNNETYEEANNLPGTYWYHSHQDPNTWIDRGLYGHDIVEPWDKEDYDTDFNPVGDERNHMNRGIQDDLSEMDHGDMRHTGNDGMEHASMDNEMYDPFLINGKWPDGLEAIRVRRGEDVELREVNAGPETQHNHILAHELKVSNPDGQPLNTPDFVRDTAQPIAPHERYDYEGLNDRPGRWVYRDSNEPRQYDIPAILDEVGSKLPREDDPLTDNLSREEDNTTYGRDKDPSTLNATDEYEMTLSPEEDNGVETINGKLFPNDELNEVDDRDKLKANFINHGDFDHPMHLHGPFFRVPSDDGKNIPGSPWKKDTLNIDPGESYEWLFDRTNPGIWMFHCHDIHHASNTMVDETDYDEFDILHNPRPEIPNMPD,sabio,C9E886,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O>>O,0.031,90.9985682302694,55.0,7.5,1.10.3.2,2725.0,-1.5086383061657274,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O,O,-1.494850021680094,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O=O__MRKSPGVTFSVLNLDLWIAHCSSDDHSEMRAGNNDKVIQTAQVFEPGKGVKGLEVTEDHWKLQCNVMVEVWTYNGRNDGPEIEVRRGDRVIILNKNDLNHPKTLHVHGEPVPNDMDGLPGNTQEAIDPGNNETYEEANNLPGTYWYHSHQDPNTWIDRGLYGHDIVEPWDKEDYDTDFNPVGDERNHMNRGIQDDLSEMDHGDMRHTGNDGMEHASMDNEMYDPFLINGKWPDGLEAIRVRRGEDVELREVNAGPETQHNHILAHELKVSNPDGQPLNTPDFVRDTAQPIAPHERYDYEGLNDRPGRWVYRDSNEPRQYDIPAILDEVGSKLPREDDPLTDNLSREEDNTTYGRDKDPSTLNATDEYEMTLSPEEDNGVETINGKLFPNDELNEVDDRDKLKANFINHGDFDHPMHLHGPFFRVPSDDGKNIPGSPWKKDTLNIDPGESYEWLFDRTNPGIWMFHCHDIHHASNTMVDETDYDEFDILHNPRPEIPNMPD,./data/raw/alphafold//AF-C9E886-F1-model_v4.pdb,3579,2302,1010,2905
+1634,7926,8054,MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,brenda,A0A077JBW9,CCOP(=O)(OCC)Oc1ccc(C(C)=O)cc1.O>>CC(=O)c1ccc(O)cc1.CCOP(=O)([O-])OCC,0.6,0.1736446073702555,30.0,9.5,3.1.8.1,453246.0,-0.2218487496163563,CCOP(=O)(OCC)Oc1ccc(C(C)=O)cc1.O,CC(=O)c1ccc(O)cc1.CCOP(=O)([O-])OCC,-0.2218487496163563,CCOP(=O)(OCC)Oc1ccc(C(C)=O)cc1.O__MLRMLSEAHGNVVLADDLPAKPVGVMKPGMVEIGAATHDRASRRSPTIRTTEALSRLTAVTATKIRRLAVVAPLGLACLCSGWPASSQVVIGPGDRPETGLQGQTTIEDVVSGRSKLPYHAGVRLVGRTDIWNRGGNLQLSWVDQCAYVSTFKQAGPITANSRSALFLREPAGVAVIDVRDPRAPKPVRLLRDRGSIDAVETMHAIAAPGRKVLVAGAYSGGIAGRGEEDAAWLSIYDASNCLNPKLQSEFKWPANIHMVTISPNGRRVYGTEVVPGLGSGKGGLHVLDISDMKRPRYLGRFGVTRPNGLTAGFTPHEVSISHDERRIYAAVLASETGDVPVGASILASDGDVPVENGSVYILDNSDIVDGRSQPKMRLVGEAKQGGFHSVVPASINGVPHLVGAAELGACPGTWPRIINIADEKNPKIVGEFKLQMNIKENCDAIRFTPRKEDPYASFIPIPDITARLGAVGSHFNDVDDARNTRLGLFPFFAGGVRIVDLRDPTKPVEVGYYKPGANPDTPLSGNGLNWTGLNDQVTDGCMSHVRYVPESGHIWFACVTTGFHVVELNPDLRARLGFPTVK,./data/raw/alphafold//AF-A0A077JBW9-F1-model_v4.pdb,3110,1877,3509,2328
+1635,17636,17878,MPPSDPIIVLGAGVIGLTTAVRLLEAHLGANVHILADHWPSDALDAQYASTIAGAHHLSFADDGDARQRRWDMRTFDVLYDEWKAVGERTGLMALTQTEMWEGATSHLAVYEGNPDFRVLDPRTAPCSNITHMVSFTSLTIAPTVYLAALEARVRDLGAKLHRAHVPSLGALRTDPALLALYTRPPAAVFVCAGLGARHLVPAPEAAALFPTRGQVVVVRAPWMRAGFTRQVGSLGGGEGGTRTYIIPRCNGEVVLGGTMEQGDWTPYPRDETVTDILTRALQICPDIAPPYARSWPKDDQVAALRSIVVRDAVGFRPSRAGGARVALASAAGMRVVYNYGHGGAGWQSCWGCAEDAVALWAGGAGGARL,uniprot_search,Q75WF1,N[C@H](CC(=O)O)C(=O)O.O.O=O>>N.O=C(O)CC(=O)C(=O)O.OO,27.9,7.739442486058953e-15,35.0,7.5,1.4.3.1,5417.0,1.4456042032735976,N[C@H](CC(=O)O)C(=O)O.O.O=O,N.O=C(O)CC(=O)C(=O)O.OO,1.9169800473203824,N[C@H](CC(=O)O)C(=O)O.O.O=O__MPPSDPIIVLGAGVIGLTTAVRLLEAHLGANVHILADHWPSDALDAQYASTIAGAHHLSFADDGDARQRRWDMRTFDVLYDEWKAVGERTGLMALTQTEMWEGATSHLAVYEGNPDFRVLDPRTAPCSNITHMVSFTSLTIAPTVYLAALEARVRDLGAKLHRAHVPSLGALRTDPALLALYTRPPAAVFVCAGLGARHLVPAPEAAALFPTRGQVVVVRAPWMRAGFTRQVGSLGGGEGGTRTYIIPRCNGEVVLGGTMEQGDWTPYPRDETVTDILTRALQICPDIAPPYARSWPKDDQVAALRSIVVRDAVGFRPSRAGGARVALASAAGMRVVYNYGHGGAGWQSCWGCAEDAVALWAGGAGGARL,./data/raw/alphafold//AF-Q75WF1-F1-model_v4.pdb,3489,3405,1141,3059
+1636,13963,14144,MSEVLITGLRTRAVNVPLAYPVHTAVGTVGTAPLVLIDLATSAGVVGHSYLFAYTPVALKSLKQLLDDMAAMIVNEPLAPVSLEAMLAKRFCLAGYTGLIRMAAAGIDMAAWDALGKVHETPLVKLLGANARPVQAYDSHSLDGVKLATERAVTAAELGFRAVKTKIGYPALDQDLAVVRSIRQAVGDDFGIMVDYNQSLDVPAAIKRSQALQQEGVTWIEEPTLQHDYEGHQRIQSKLNVPVQMGENWLGPEEMFKALSIGACRLAMPDAMKIGGVTGWIRASALAQQFGIPMSSHLFQEISAHLLAATPTAHWLERLDLAGSVIEPTLTFEGGNAVIPDLPGVGIIWREKEIGKYLV,brenda,P11444,N=C(O)[C@H](O)c1ccccc1>>N=C(O)[C@@H](O)c1ccccc1,11.03,0.0,25.0,7.5,5.1.2.2,303.0,1.0425755124401903,N=C(O)[C@H](O)c1ccccc1,N=C(O)[C@@H](O)c1ccccc1,1.0425755124401903,N=C(O)[C@H](O)c1ccccc1__MSEVLITGLRTRAVNVPLAYPVHTAVGTVGTAPLVLIDLATSAGVVGHSYLFAYTPVALKSLKQLLDDMAAMIVNEPLAPVSLEAMLAKRFCLAGYTGLIRMAAAGIDMAAWDALGKVHETPLVKLLGANARPVQAYDSHSLDGVKLATERAVTAAELGFRAVKTKIGYPALDQDLAVVRSIRQAVGDDFGIMVDYNQSLDVPAAIKRSQALQQEGVTWIEEPTLQHDYEGHQRIQSKLNVPVQMGENWLGPEEMFKALSIGACRLAMPDAMKIGGVTGWIRASALAQQFGIPMSSHLFQEISAHLLAATPTAHWLERLDLAGSVIEPTLTFEGGNAVIPDLPGVGIIWREKEIGKYLV,./data/raw/alphafold//AF-P11444-F1-model_v4.pdb,2313,4650,4678,4507
+1637,19346,19632,MIMEELAKKIEEEILNHVREPQIPDREVNLLDFGARGDGRTDCSESFKRAIEELSKQGGGRLIVPEGVFLTGPIHLKSNIELHVKGTIKFIPDPERYLPVVLTRFEGIELYNYSPLVYALDCENVAITGSGVLDGSADNEHWWPWKGKKDFGWKEGLPNQQEDVKKLKEMAERGTPVEERVFGKGHYLRPSFVQFYRCRNVLVEGVKIINSPMWCVHPVLSENVIIRNIEISSTGPNNDGIDPESCKYMLIEKCRFDTGDDSVVIKSGRDADGRRIGVPSEYILVRDNLVISQASHGGLVIGSEMSGGVRNVVARNNVYMNVERALRLKTNSRRGGYMENIFFIDNVAVNVSEEVIRINLRYDNEEGEYLPVVRSVFVKNLKATGGKYAVRIEGLENDYVKDILISDTIIEGAKISVLLEFGQLGMENVIMNGSRFEKLYIEGKALLK,brenda,Q9WYR8,O.O=C(O)[C@H]1O[C@H](O[C@@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2C(=O)O)[C@H](O)[C@@H](O)[C@H]1O>>O=C(O)[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O,182.0,33.27619867093348,80.0,6.5,3.2.1.67,2336.0,2.2600713879850747,O.O=C(O)[C@H]1O[C@H](O[C@@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2C(=O)O)[C@H](O)[C@@H](O)[C@H]1O,O=C(O)[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O,2.2600713879850747,O.O=C(O)[C@H]1O[C@H](O[C@@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2C(=O)O)[C@H](O)[C@@H](O)[C@H]1O__MIMEELAKKIEEEILNHVREPQIPDREVNLLDFGARGDGRTDCSESFKRAIEELSKQGGGRLIVPEGVFLTGPIHLKSNIELHVKGTIKFIPDPERYLPVVLTRFEGIELYNYSPLVYALDCENVAITGSGVLDGSADNEHWWPWKGKKDFGWKEGLPNQQEDVKKLKEMAERGTPVEERVFGKGHYLRPSFVQFYRCRNVLVEGVKIINSPMWCVHPVLSENVIIRNIEISSTGPNNDGIDPESCKYMLIEKCRFDTGDDSVVIKSGRDADGRRIGVPSEYILVRDNLVISQASHGGLVIGSEMSGGVRNVVARNNVYMNVERALRLKTNSRRGGYMENIFFIDNVAVNVSEEVIRINLRYDNEEGEYLPVVRSVFVKNLKATGGKYAVRIEGLENDYVKDILISDTIIEGAKISVLLEFGQLGMENVIMNGSRFEKLYIEGKALLK,./data/raw/alphafold//AF-Q9WYR8-F1-model_v4.pdb,267,2796,5118,5979
+1638,11527,11684,MDYGMYFFEHVTPYETLVRRMERVIASGKTPFQDYFLFESKGFGKVLILDKDVQSTERDEYIYHETLVHPAMLTHPEPKRVLIVGGGEGATLREVLKHPTVEKAVMVDIDGELVEVAKRHMPEWHQGAFDDPRAVLVIDDARAYLERTEERYDVVIIDLTDPVGEDNPARLLYTVEFYRLVKAHLNPGGVMGMQAGMILLTHHRVHPVVHRTVREAFRYVRSYKNHIPGFFLNFGFLLASDAFDPAAFSEGVIEARIRERNLALRHLTAPYLEAMFVLPKDLLEALEKETMVSTDQNPFYVTPEGEARQAPYKG,sabio,Q5SK28,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCNCCCN>>CSCC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCNCCCNCCCN,0.53,0.1035624241004594,37.0,9.0,2.5.1.126,274.0,-0.2757241303992109,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCNCCCN,CSCC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCNCCCNCCCN,-0.2757241303992109,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCNCCCN__MDYGMYFFEHVTPYETLVRRMERVIASGKTPFQDYFLFESKGFGKVLILDKDVQSTERDEYIYHETLVHPAMLTHPEPKRVLIVGGGEGATLREVLKHPTVEKAVMVDIDGELVEVAKRHMPEWHQGAFDDPRAVLVIDDARAYLERTEERYDVVIIDLTDPVGEDNPARLLYTVEFYRLVKAHLNPGGVMGMQAGMILLTHHRVHPVVHRTVREAFRYVRSYKNHIPGFFLNFGFLLASDAFDPAAFSEGVIEARIRERNLALRHLTAPYLEAMFVLPKDLLEALEKETMVSTDQNPFYVTPEGEARQAPYKG,./data/raw/alphafold//AF-Q5SK28-F1-model_v4.pdb,1017,558,219,237
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+1651,4683,4741,MTSTGQDSTTTRQRRSRQNPQSPPQDSSVTSKRNIKKGAVPRSIPNLAEVKKKGKMKKLGQAMEEDLIVGLQGMDLNLEAEALAGTGLVLDEQLNEFHCLWDDSFPEGPERLHAIKEQLIQEGLLDRCVSFQARFAEKEELMLVHSLEYIDLMETTQYMNEGELRVLADTYDSVYLHPNSYSCACLASGSVLRLVDAVLGAEIRNGMAIIRPPGHHAQHSLMDGYCMFNHVAVAARYAQQKHRIRRVLIVDWDVHHGQGTQFTFDQDPSVLYFSIHRYEQGRFWPHLKASNWSTTGFGQGQGYTINVPWNQVGMRDADYIAAFLHVLLPVALEFQPQLVLVAAGFDALQGDPKGEMAATPAGFAQLTHLLMGLAGGKLILSLEGGYNLRALAEGVSASLHTLLGDPCPMLESPGAPCRSAQASVSCALEALEPFWEVLVRSTETVERDNMEEDNVEESEEEGPWEPPVLPILTWPVLQSRTGLVYDQNMMNHCNLWDSHHPEVPQRILRIMCRLEELGLAGRCLTLTPRPATEAELLTCHSAEYVGHLRATEKMKTRELHRESSNFDSIYICPSTFACAQLATGAACRLVEAVLSGEVLNGAAVVRPPGHHAEQDAACGFCFFNSVAVAARHAQTISGHALRILIVDWDVHHGNGTQHMFEDDPSVLYVSLHRYDHGTFFPMGDEGASSQIGRAAGTGFTVNVAWNGPRMGDADYLAAWHRLVLPIAYEFNPELVLVSAGFDAARGDPLGGCQVSPEGYAHLTHLLMGLASGRIILILEGGYNLTSISESMAACTRSLLGDPPPLLTLPRPPLSGALASITETIQVHRRYWRSLRVMKVEDREGPSSSKLVTKKAPQPAKPRLAERMTTREKKVLEAGMGKVTSASFGEESTPGQTNSETAVVALTQDQPSEAATGGATLAQTISEAAIGGAMLGQTTSEEAVGGATPDQTTSEETVGGAILDQTTSEDAVGGATLGQTTSEEAVGGATLAQTTSEAAMEGATLDQTTSEEAPGGTELIQTPLASSTDHQTPPTSPVQGTTPQISPSTLIGSLRTLELGSESQGASESQAPGEENLLGEAAGGQDMADSMLMQGSRGLTDQAIFYAVTPLPWCPHLVAVCPIPAAGLDVTQPCGDCGTIQENWVCLSCYQVYCGRYINGHMLQHHGNSGHPLVLSYIDLSAWCYYCQAYVHHQALLDVKNIAHQNKFGEDMPHPH,brenda,Q9UBN7,CC(O)=NCCCC[C@H](N=C(O)CN)C(O)=N[C@@H](Cc1ccccc1)C(=O)O.O>>CC(=O)O.NCCCC[C@H](N=C(O)CN)C(O)=N[C@@H](Cc1ccccc1)C(=O)O,1.88,6.915745741281991e-15,37.0,7.4,3.5.1.98,9606.0,0.2741578492636798,CC(O)=NCCCC[C@H](N=C(O)CN)C(O)=N[C@@H](Cc1ccccc1)C(=O)O.O,CC(=O)O.NCCCC[C@H](N=C(O)CN)C(O)=N[C@@H](Cc1ccccc1)C(=O)O,0.2741578492636798,CC(O)=NCCCC[C@H](N=C(O)CN)C(O)=N[C@@H](Cc1ccccc1)C(=O)O.O__MTSTGQDSTTTRQRRSRQNPQSPPQDSSVTSKRNIKKGAVPRSIPNLAEVKKKGKMKKLGQAMEEDLIVGLQGMDLNLEAEALAGTGLVLDEQLNEFHCLWDDSFPEGPERLHAIKEQLIQEGLLDRCVSFQARFAEKEELMLVHSLEYIDLMETTQYMNEGELRVLADTYDSVYLHPNSYSCACLASGSVLRLVDAVLGAEIRNGMAIIRPPGHHAQHSLMDGYCMFNHVAVAARYAQQKHRIRRVLIVDWDVHHGQGTQFTFDQDPSVLYFSIHRYEQGRFWPHLKASNWSTTGFGQGQGYTINVPWNQVGMRDADYIAAFLHVLLPVALEFQPQLVLVAAGFDALQGDPKGEMAATPAGFAQLTHLLMGLAGGKLILSLEGGYNLRALAEGVSASLHTLLGDPCPMLESPGAPCRSAQASVSCALEALEPFWEVLVRSTETVERDNMEEDNVEESEEEGPWEPPVLPILTWPVLQSRTGLVYDQNMMNHCNLWDSHHPEVPQRILRIMCRLEELGLAGRCLTLTPRPATEAELLTCHSAEYVGHLRATEKMKTRELHRESSNFDSIYICPSTFACAQLATGAACRLVEAVLSGEVLNGAAVVRPPGHHAEQDAACGFCFFNSVAVAARHAQTISGHALRILIVDWDVHHGNGTQHMFEDDPSVLYVSLHRYDHGTFFPMGDEGASSQIGRAAGTGFTVNVAWNGPRMGDADYLAAWHRLVLPIAYEFNPELVLVSAGFDAARGDPLGGCQVSPEGYAHLTHLLMGLASGRIILILEGGYNLTSISESMAACTRSLLGDPPPLLTLPRPPLSGALASITETIQVHRRYWRSLRVMKVEDREGPSSSKLVTKKAPQPAKPRLAERMTTREKKVLEAGMGKVTSASFGEESTPGQTNSETAVVALTQDQPSEAATGGATLAQTISEAAIGGAMLGQTTSEEAVGGATPDQTTSEETVGGAILDQTTSEDAVGGATLGQTTSEEAVGGATLAQTTSEAAMEGATLDQTTSEEAPGGTELIQTPLASSTDHQTPPTSPVQGTTPQISPSTLIGSLRTLELGSESQGASESQAPGEENLLGEAAGGQDMADSMLMQGSRGLTDQAIFYAVTPLPWCPHLVAVCPIPAAGLDVTQPCGDCGTIQENWVCLSCYQVYCGRYINGHMLQHHGNSGHPLVLSYIDLSAWCYYCQAYVHHQALLDVKNIAHQNKFGEDMPHPH,./data/raw/alphafold//AF-Q9UBN7-F1-model_v4.pdb,2963,1703,3315,2116
+1652,10673,10828,MIIGIPKEIKNNENRVAITPAGVVALTKAGHQILIEQGAGIGSGFEDVDYTAAGATIIPEAKDVWAKAEMVMKVKEPLSSEYGYFRKGLILFTYLHLAAEPELAKALVDSGVIAIAYETVEVNRTLPLLTPMSEVAGRMASQIGAQFLEKSKGGKGILLSGVPGVKRGKVTIIGGGVVGTNAAKIAVGLGADVTLIDLSADRLRQLDDQFGNDIQTLMSNPLNIAEAVKESDLVIGAVLIPGAKAPKLVTEEMIKSMTPGSVVVDVAIDQGGIIETVDQITTHDNPTYTKHGVVHYAVANMPGAVPRTSTIGLTNVTIPYAMQIANKGVEKAVAENPALALGVNVANGDVTYNAVARDLGYELVSVEDALKKTPVQA,brenda,D3FSP2,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>>CC(=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+],10.0,0.0,40.0,7.0,1.4.1.1,79885.0,1.0,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,CC(=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+],1.0,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__MIIGIPKEIKNNENRVAITPAGVVALTKAGHQILIEQGAGIGSGFEDVDYTAAGATIIPEAKDVWAKAEMVMKVKEPLSSEYGYFRKGLILFTYLHLAAEPELAKALVDSGVIAIAYETVEVNRTLPLLTPMSEVAGRMASQIGAQFLEKSKGGKGILLSGVPGVKRGKVTIIGGGVVGTNAAKIAVGLGADVTLIDLSADRLRQLDDQFGNDIQTLMSNPLNIAEAVKESDLVIGAVLIPGAKAPKLVTEEMIKSMTPGSVVVDVAIDQGGIIETVDQITTHDNPTYTKHGVVHYAVANMPGAVPRTSTIGLTNVTIPYAMQIANKGVEKAVAENPALALGVNVANGDVTYNAVARDLGYELVSVEDALKKTPVQA,./data/raw/alphafold//AF-D3FSP2-F1-model_v4.pdb,3722,3735,1537,3507
+1653,21360,21684,MANISSPFGQNEWLVEEMYRKFRDDPSSVDPSWHEFLVDYSPEPTSQPAAEPTRVTSPLVAERAAAAAPQAPPKPADTAAAGNGVVAALAAKTAVPPPAEGDEVAVLRGAAAAVVKNMSASLEVPTATSVRAVPAKLLIDNRIVINNQLKRTRGGKISFTHLLGYALVQAVKKFPNMNRHYTEVDGKPTAVTPAHTNLGLAIDLQGKDGKRSLVVAGIKRCETMRFAQFVTAYEDIVRRARDGKLTTEDFAGVTISLTNPGTIGTVHSVPRLMPGQGAIIGVGAMEYPAEFQGASEERIAELGIGKLITLTSTYDHRIIQGAESGDFLRTIHELLLSDGFWDEVFRELSIPYLPVRWSTDNPDSIVDKNARVMNLIAAYRNRGHLMADTDPLRLDKARFRSHPDLEVLTHGLTLWDLDRVFKVDGFAGAQYKKLRDVLGLLRDAYCRHIGVEYAHILDPEQKEWLEQRVETKHVKPTVAQQKYILSKLNAAEAFETFLQTKYVGQKRFSLEGAESVIPMMDAAIDQCAEHGLDEVVIGMPHRGRLNVLANIVGKPYSQIFTEFEGNLNPSQAHGSGDVKYHLGATGLYLQMFGDNDIQVSLTANPSHLEAVDPVLEGLVRAKQDLLDHGSIDSDGQRAFSVVPLMLHGDAAFAGQGVVAETLNLANLPGYRVGGTIHIIVNNQIGFTTAPEYSRSSEYCTDVAKMIGAPIFHVNGDDPEACVWVARLAVDFRQRFKKDVVIDMLCYRRRGHNEGDDPSMTNPYVYDVVDTKRGARKSYTEALIGRGDISMKEAEDALRDYQGQLERVFNEVRELEKHGVQPSESVESDQMIPAGLATAVDKSLLARIGDAFLALPNGFTAHPRVQPVLEKRREMAYEGKIDWAFGELLALGSLVAEGKLVRLSGQDSRRGTFSQRHSVLIDRHTGEEFTPLQLLATNSDGSPTGGKFLVYDSPLSEYAAVGFEYGYTVGNPDAVVLWEAQFGDFVNGAQSIIDEFISSGEAKWGQLSNVVLLLPHGHEGQGPDHTSARIERFLQLWAEGSMTIAMPSTPSNYFHLLRRHALDGIQRPLIVFTPKSMLRHKAAVSEIKDFTEIKFRSVLEEPTYEDGIGDRNKVSRILLTSGKLYYELAARKAKDNRNDLAIVRLEQLAPLPRRRLRETLDRYENVKEFFWVQEEPANQGAWPRFGLELPELLPDKLAGIKRISRRAMSAPSSGSSKVHAVEQQEILDEAFG,sabio,P9WIS5,O=C(O)CCC(=O)C(=O)O>>O=C=O.O=CCCC(=O)O,6540.0,9.693757565043184e-15,22.0,7.0,4.1.1.71,1773.0,3.815577748324267,O=C(O)CCC(=O)C(=O)O,O=C=O.O=CCCC(=O)O,3.815577748324267,O=C(O)CCC(=O)C(=O)O__MANISSPFGQNEWLVEEMYRKFRDDPSSVDPSWHEFLVDYSPEPTSQPAAEPTRVTSPLVAERAAAAAPQAPPKPADTAAAGNGVVAALAAKTAVPPPAEGDEVAVLRGAAAAVVKNMSASLEVPTATSVRAVPAKLLIDNRIVINNQLKRTRGGKISFTHLLGYALVQAVKKFPNMNRHYTEVDGKPTAVTPAHTNLGLAIDLQGKDGKRSLVVAGIKRCETMRFAQFVTAYEDIVRRARDGKLTTEDFAGVTISLTNPGTIGTVHSVPRLMPGQGAIIGVGAMEYPAEFQGASEERIAELGIGKLITLTSTYDHRIIQGAESGDFLRTIHELLLSDGFWDEVFRELSIPYLPVRWSTDNPDSIVDKNARVMNLIAAYRNRGHLMADTDPLRLDKARFRSHPDLEVLTHGLTLWDLDRVFKVDGFAGAQYKKLRDVLGLLRDAYCRHIGVEYAHILDPEQKEWLEQRVETKHVKPTVAQQKYILSKLNAAEAFETFLQTKYVGQKRFSLEGAESVIPMMDAAIDQCAEHGLDEVVIGMPHRGRLNVLANIVGKPYSQIFTEFEGNLNPSQAHGSGDVKYHLGATGLYLQMFGDNDIQVSLTANPSHLEAVDPVLEGLVRAKQDLLDHGSIDSDGQRAFSVVPLMLHGDAAFAGQGVVAETLNLANLPGYRVGGTIHIIVNNQIGFTTAPEYSRSSEYCTDVAKMIGAPIFHVNGDDPEACVWVARLAVDFRQRFKKDVVIDMLCYRRRGHNEGDDPSMTNPYVYDVVDTKRGARKSYTEALIGRGDISMKEAEDALRDYQGQLERVFNEVRELEKHGVQPSESVESDQMIPAGLATAVDKSLLARIGDAFLALPNGFTAHPRVQPVLEKRREMAYEGKIDWAFGELLALGSLVAEGKLVRLSGQDSRRGTFSQRHSVLIDRHTGEEFTPLQLLATNSDGSPTGGKFLVYDSPLSEYAAVGFEYGYTVGNPDAVVLWEAQFGDFVNGAQSIIDEFISSGEAKWGQLSNVVLLLPHGHEGQGPDHTSARIERFLQLWAEGSMTIAMPSTPSNYFHLLRRHALDGIQRPLIVFTPKSMLRHKAAVSEIKDFTEIKFRSVLEEPTYEDGIGDRNKVSRILLTSGKLYYELAARKAKDNRNDLAIVRLEQLAPLPRRRLRETLDRYENVKEFFWVQEEPANQGAWPRFGLELPELLPDKLAGIKRISRRAMSAPSSGSSKVHAVEQQEILDEAFG,./data/raw/alphafold//AF-P9WIS5-F1-model_v4.pdb,2143,4346,4234,6610
+1654,3176,3218,MHKATLYETNNSMQQLDAAKLLSQYIDQFKWTDNESVLDVGCGPGNVTSKLLLPNLPKSVVKLVGLDVSPNMIKHAKNHHTNPKLEFVVANIADQNLESIFLAKFNKIFSFYCLHWVQDQRQAISNIYNLLMPGGEVLLLLNAFNPIYDLYEKLSRKPKWTEYTQDVARFISPYHHSKHPISEMTALLQSVGFNIHHCDSNTSSYSYRTVSDLRQALTSVNPFLERIPSTLQDDFMNDCIDVVFNGNLREVFPLDEQTVRFNYTQIIVFARK,brenda,A0A075W3Z0,CC(C)=CCC/C(C)=C/CC/C(C)=C/C(=O)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O>>COC(=O)/C=C(\C)CC/C=C(\C)CCC=C(C)C.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,0.00075,0.0792697120496283,25.0,7.9,2.1.1.325,121845.0,-3.1249387366083,CC(C)=CCC/C(C)=C/CC/C(C)=C/C(=O)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,COC(=O)/C=C(\C)CC/C=C(\C)CCC=C(C)C.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,-3.1249387366083,CC(C)=CCC/C(C)=C/CC/C(C)=C/C(=O)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MHKATLYETNNSMQQLDAAKLLSQYIDQFKWTDNESVLDVGCGPGNVTSKLLLPNLPKSVVKLVGLDVSPNMIKHAKNHHTNPKLEFVVANIADQNLESIFLAKFNKIFSFYCLHWVQDQRQAISNIYNLLMPGGEVLLLLNAFNPIYDLYEKLSRKPKWTEYTQDVARFISPYHHSKHPISEMTALLQSVGFNIHHCDSNTSSYSYRTVSDLRQALTSVNPFLERIPSTLQDDFMNDCIDVVFNGNLREVFPLDEQTVRFNYTQIIVFARK,./data/raw/alphafold//AF-A0A075W3Z0-F1-model_v4.pdb,1030,574,236,256
+1655,12639,12810,MEIKRVGSQASGKGPADWFTGTVRIDPLFQAPDPALVAGASVTFEPGARTAWHTHPLGQTLIVTAGCGWAQREGGAVEEIHPGDVVWFSPGEKHWHGAAPTTAMTHLAIQERLDGKAVDWMEHVTDEQYRR,brenda,E8WYN5,N#C[C@H](O)c1ccccc1>>C#N.O=Cc1ccccc1,0.03,0.0,25.0,4.5,4.1.2.10,940615.0,-1.5228787452803376,N#C[C@H](O)c1ccccc1,C#N.O=Cc1ccccc1,-1.5228787452803376,N#C[C@H](O)c1ccccc1__MEIKRVGSQASGKGPADWFTGTVRIDPLFQAPDPALVAGASVTFEPGARTAWHTHPLGQTLIVTAGCGWAQREGGAVEEIHPGDVVWFSPGEKHWHGAAPTTAMTHLAIQERLDGKAVDWMEHVTDEQYRR,./data/raw/alphafold//AF-E8WYN5-F1-model_v4.pdb,2136,4336,4223,4084
+1656,8871,9013,MAHRPPSPALASVLLALLLSGAARAAEIVGGHEAQPHSRPYMASLQMRGNPGSHFCGGTLIHPSFVLTAAHCLRDIPQRLVNVVLGAHNVRTQEPTQQHFSVAQVFLNNYDAENKLNDVLLIQLSSPANLSASVATVQLPQQDQPVPHGTQCLAMGWGRVGAHDPPAQVLQELNVTVVTFFCRPHNICTFVPRRKAGICFGDSGGPLICDGIIQGIDSFVIWGCATRLFPDFFTRVALYVDWIRSTLRRVEAKGRP,brenda,P24158,COC(=O)CCC(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C.O>>COC(=O)CCC(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(=O)O)C(C)C.Nc1ccc([N+](=O)[O-])cc1,0.59,9.331611618964816e-15,33.5,7.633333333333333,3.4.21.76,9606.0,-0.2291479883578558,COC(=O)CCC(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C.O,COC(=O)CCC(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(=O)O)C(C)C.Nc1ccc([N+](=O)[O-])cc1,-0.2291479883578558,COC(=O)CCC(O)=N[C@@H](C)C(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C.O__MAHRPPSPALASVLLALLLSGAARAAEIVGGHEAQPHSRPYMASLQMRGNPGSHFCGGTLIHPSFVLTAAHCLRDIPQRLVNVVLGAHNVRTQEPTQQHFSVAQVFLNNYDAENKLNDVLLIQLSSPANLSASVATVQLPQQDQPVPHGTQCLAMGWGRVGAHDPPAQVLQELNVTVVTFFCRPHNICTFVPRRKAGICFGDSGGPLICDGIIQGIDSFVIWGCATRLFPDFFTRVALYVDWIRSTLRRVEAKGRP,./data/raw/alphafold//AF-P24158-F1-model_v4.pdb,1869,1572,3137,1906
+1657,16904,17134,MESGGKTNRQLRKAICVSTDEKMKKKRSPSVIVIGGGMAGISAARTLQDASFQVVVLESRDRIGGRVHTDYSFGFPVDLGASWLHGVCKENPLAAVIGRLGLPLYRTSGDNSVLYDHDLESYALFDKAGNQVSQELVTKVGENFEHILEEICKVRDEQDEDMSIAQAFSIVFKRNPELRLEGLAHNVLQWYLCRMEGWFAADAETISAKCWDQEELLPGGHGLMVRGYRPVINTLSKGLDIRLSHRITKISRRYSGVKVTTEKGDTFVADAAVIALPLGVLKSGMITFEPKLPQWKQEAINDLGVGIENKIILNFDNVFWPNVEFLGVVAETSYGCSYFLNLHKATSHPVLVYMPAGQLARDIEKKSDEAAANFAFSQLQKILPDASSPINYLVSRWGSDINSLGSYSYDIVNKPHDLYERLRVPLDNLFFAGEATSSSYPGSVHGAYSTGVLAAEDCRMRVLERYGELEHEMEEEAPASVPLLISRM,brenda,Q9LYT1,NCCCNCCCCNCCCN.O.O=O>>NCCC=O.NCCCCNCCCN.OO,1.7,1.6860212270714514e-14,25.0,7.5,1.5.3.17,3702.0,0.2304489213782739,NCCCNCCCCNCCCN.O.O=O,NCCC=O.NCCCCNCCCN.OO,0.2304489213782739,NCCCNCCCCNCCCN.O.O=O__MESGGKTNRQLRKAICVSTDEKMKKKRSPSVIVIGGGMAGISAARTLQDASFQVVVLESRDRIGGRVHTDYSFGFPVDLGASWLHGVCKENPLAAVIGRLGLPLYRTSGDNSVLYDHDLESYALFDKAGNQVSQELVTKVGENFEHILEEICKVRDEQDEDMSIAQAFSIVFKRNPELRLEGLAHNVLQWYLCRMEGWFAADAETISAKCWDQEELLPGGHGLMVRGYRPVINTLSKGLDIRLSHRITKISRRYSGVKVTTEKGDTFVADAAVIALPLGVLKSGMITFEPKLPQWKQEAINDLGVGIENKIILNFDNVFWPNVEFLGVVAETSYGCSYFLNLHKATSHPVLVYMPAGQLARDIEKKSDEAAANFAFSQLQKILPDASSPINYLVSRWGSDINSLGSYSYDIVNKPHDLYERLRVPLDNLFFAGEATSSSYPGSVHGAYSTGVLAAEDCRMRVLERYGELEHEMEEEAPASVPLLISRM,./data/raw/alphafold//AF-Q9LYT1-F1-model_v4.pdb,2964,1705,3317,2118
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+1660,1628,1658,MNVLRSGIVTMLLLAAFSVQAACTWPAWEQFKKDYISQEGRVIDPSDARKITTSEGQSYGMFSALAANDRAAFDNILDWTQNNLAQGSLKERLPAWLWGKKENSKWEVLDSNSASDGDVWMAWSLLEAGRLWKEQRYTDIGSALLKRIAREEVVTVPGLGSMLLPGKVGFAEDNSWRFNPSYLPPTLAQYFTRFGAPWTTLRETNQRLLLETAPKGFSPDWVRYEKDKGWQLKAEKTLISSYDAIRVYMWVGMMPDSDPQKARMLNRFKPMATFTEKNGYPPEKVDVATGKAQGKGPVGFSAAMLPFLQNRDAQAVQRQRVADNFPGSDAYYNYVLTLFGQGWDQHRFRFSTKGELLPDWGQECANSH,brenda,P37651,CC(=O)O.O.O=CC(O)C(O)C(O)C(O)CO>>OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,0.16,17.76757651139449,40.0,7.0,3.2.1.4,562.0,-0.7958800173440752,CC(=O)O.O.O=CC(O)C(O)C(O)C(O)CO,OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,-0.7958800173440752,CC(=O)O.O.O=CC(O)C(O)C(O)C(O)CO__MNVLRSGIVTMLLLAAFSVQAACTWPAWEQFKKDYISQEGRVIDPSDARKITTSEGQSYGMFSALAANDRAAFDNILDWTQNNLAQGSLKERLPAWLWGKKENSKWEVLDSNSASDGDVWMAWSLLEAGRLWKEQRYTDIGSALLKRIAREEVVTVPGLGSMLLPGKVGFAEDNSWRFNPSYLPPTLAQYFTRFGAPWTTLRETNQRLLLETAPKGFSPDWVRYEKDKGWQLKAEKTLISSYDAIRVYMWVGMMPDSDPQKARMLNRFKPMATFTEKNGYPPEKVDVATGKAQGKGPVGFSAAMLPFLQNRDAQAVQRQRVADNFPGSDAYYNYVLTLFGQGWDQHRFRFSTKGELLPDWGQECANSH,./data/raw/alphafold//AF-P37651-F1-model_v4.pdb,1427,945,748,1044
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+1663,3069,3111,MTSMTQSLREVIKAMTKARNFERVLGKITLVSAAPGKVICEMKVEEEHTNAIGTLHGGLTATLVDNISTMALLCTERGAPGVSVDMNITYMSPAKLGEDIVITAHVLKQGKTLAFTSVDLTNKATGKLIAQGRHTKHLGN,sabio,Q9NPJ3,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)Cc1cccc([O-])c1.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)Cc1cccc(O)c1,1.43,0.2195662260094637,25.0,7.5,3.1.2.20,9606.0,0.1553360374650617,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)Cc1cccc([O-])c1.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)Cc1cccc(O)c1,0.1760912590556812,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)Cc1cccc([O-])c1.O__MTSMTQSLREVIKAMTKARNFERVLGKITLVSAAPGKVICEMKVEEEHTNAIGTLHGGLTATLVDNISTMALLCTERGAPGVSVDMNITYMSPAKLGEDIVITAHVLKQGKTLAFTSVDLTNKATGKLIAQGRHTKHLGN,./data/raw/alphafold//AF-Q9NPJ3-F1-model_v4.pdb,1636,1238,1720,275
+1664,14492,14695,MALRWGIVSAGLISSDFTTVLRLLPRSEHQVVAVAARDLSRAKEFARKHDIPKAYGSYEELAKDPNVEVAYIGTQHPQHKATVLLCLAAGKAVLCEKPMGVNAAEVREMVAEARSRGLFLMEAIWTRFFPAVEALRSVLAQETLGDLRVVQANFGKSIANVPRSVDWAQAGGSLLDLGIYCLQFISMVYGGQKPEKISAVGRRYETGVDDTVSVLLQYPGGVQGSFTCSITSQLSNTVSVSGTKGMAQILDPCWCPTELVVKGEHKEFPLPSAPGEEFNYTNGMGMCYEAKHVRECLKKGLKESPMITLAESELLADILEEVRKAIGVTFPQDKC,uniprot_search,Q9TV69,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+],40.0,6.350886474208392e-15,37.0,8.0,1.1.1.179,9823.0,1.6020599913279625,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+],1.6020599913279625,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__MALRWGIVSAGLISSDFTTVLRLLPRSEHQVVAVAARDLSRAKEFARKHDIPKAYGSYEELAKDPNVEVAYIGTQHPQHKATVLLCLAAGKAVLCEKPMGVNAAEVREMVAEARSRGLFLMEAIWTRFFPAVEALRSVLAQETLGDLRVVQANFGKSIANVPRSVDWAQAGGSLLDLGIYCLQFISMVYGGQKPEKISAVGRRYETGVDDTVSVLLQYPGGVQGSFTCSITSQLSNTVSVSGTKGMAQILDPCWCPTELVVKGEHKEFPLPSAPGEEFNYTNGMGMCYEAKHVRECLKKGLKESPMITLAESELLADILEEVRKAIGVTFPQDKC,./data/raw/alphafold//AF-Q9TV69-F1-model_v4.pdb,3135,1920,3561,4601
+1665,1182,1209,MSSWDVSMSNHAGLVFNPIRTVSDNAKPSPSPKPIIKLSVGDPTLDKNLLTSAAQIKKLKEAIDSQECNGYFPTVGSPEAREAVATWWRNSFVHKEELKSTIVKDNVVLCSGGSHGILMAITAICDAGDYALVPQPGFPHYETVCKAYGIGMHFYNCRPENDWEADLDEIRRLKDDKTKLLIVTNPSNPCGSNFSRKHVEDIVRLAEELRLPLFSDEIYAGMVFKGKDPNATFTSVADFETTVPRVILGGTAKNLVVPGWRLGWLLYVDPHGNGPSFLEGLKRVGMLVCGPCTVVQAALGEALLNTPQEHLDQIVAKIEESAMYLYNHIGECIGLAPTMPRGAMYLMSRIDLEKYRDIKTDVEFFEKLLEEENVQVLPGTIFHAPGFTRLTTTRPVEVYREAVERIKAFCQRHAAV,sabio,P33447,CC(=O)C(=O)O.NC(Cc1ccc(O)cc1)C(=O)O>>CC(N)C(=O)O.O=C(O)C(=O)Cc1ccc(O)cc1,44.6,1.0536197718062087e-14,37.0,7.5,2.6.1.12,5693.0,1.649334858712142,CC(=O)C(=O)O.NC(Cc1ccc(O)cc1)C(=O)O,CC(N)C(=O)O.O=C(O)C(=O)Cc1ccc(O)cc1,1.675778341674085,CC(=O)C(=O)O.NC(Cc1ccc(O)cc1)C(=O)O__MSSWDVSMSNHAGLVFNPIRTVSDNAKPSPSPKPIIKLSVGDPTLDKNLLTSAAQIKKLKEAIDSQECNGYFPTVGSPEAREAVATWWRNSFVHKEELKSTIVKDNVVLCSGGSHGILMAITAICDAGDYALVPQPGFPHYETVCKAYGIGMHFYNCRPENDWEADLDEIRRLKDDKTKLLIVTNPSNPCGSNFSRKHVEDIVRLAEELRLPLFSDEIYAGMVFKGKDPNATFTSVADFETTVPRVILGGTAKNLVVPGWRLGWLLYVDPHGNGPSFLEGLKRVGMLVCGPCTVVQAALGEALLNTPQEHLDQIVAKIEESAMYLYNHIGECIGLAPTMPRGAMYLMSRIDLEKYRDIKTDVEFFEKLLEEENVQVLPGTIFHAPGFTRLTTTRPVEVYREAVERIKAFCQRHAAV,./data/raw/alphafold//AF-P33447-F1-model_v4.pdb,1289,3832,6147,796
+1666,20234,20526,MFAFYFLTACISLKGVFGVSPSYNGLGLTPQMGWDNWNTFACDVSEQLLLDTADRISDLGLKDMGYKYIILDDCWSSGRDSDGFLVADEQKFPNGMGHVADHLHNNSFLFGMYSSAGEYTCAGYPGSLGREEEDAQFFANNRVDYLKYDNCYNKGQFGTPEISYHRYKAMSDALNKTGRPIFYSLCNWGQDLTFYWGSGIANSWRMSGDVTAEFTRPDSRCPCDGDEYDCKYAGFHCSIMNILNKAAPMGQNAGVGGWNDLDNLEVGVGNLTDDEEKAHFSMWAMVKSPLIIGANVNNLKASSYSIYSQASVIAINQDSNGIPATRVWRYYVSDTDEYGQGEIQMWSGPLDNGDQVVALLNGGSVSRPMNTTLEEIFFDSNLGSKKLTSTWDIYDLWANRVDNSTASAILGRNKTATGILYNATEQSYKDGLSKNDTRLFGQKIGSLSPNAILNTTVPAHGIAFYRLRPSS,brenda,P04824,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]1OC(O)[C@H](O)[C@@H](O)[C@H]1O,286.0,0.0,30.0,7.4,3.2.1.22,4932.0,2.456366033129043,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]1OC(O)[C@H](O)[C@@H](O)[C@H]1O,2.456366033129043,O.O=[N+]([O-])c1ccc(O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1__MFAFYFLTACISLKGVFGVSPSYNGLGLTPQMGWDNWNTFACDVSEQLLLDTADRISDLGLKDMGYKYIILDDCWSSGRDSDGFLVADEQKFPNGMGHVADHLHNNSFLFGMYSSAGEYTCAGYPGSLGREEEDAQFFANNRVDYLKYDNCYNKGQFGTPEISYHRYKAMSDALNKTGRPIFYSLCNWGQDLTFYWGSGIANSWRMSGDVTAEFTRPDSRCPCDGDEYDCKYAGFHCSIMNILNKAAPMGQNAGVGGWNDLDNLEVGVGNLTDDEEKAHFSMWAMVKSPLIIGANVNNLKASSYSIYSQASVIAINQDSNGIPATRVWRYYVSDTDEYGQGEIQMWSGPLDNGDQVVALLNGGSVSRPMNTTLEEIFFDSNLGSKKLTSTWDIYDLWANRVDNSTASAILGRNKTATGILYNATEQSYKDGLSKNDTRLFGQKIGSLSPNAILNTTVPAHGIAFYRLRPSS,./data/raw/alphafold//AF-P04824-F1-model_v4.pdb,459,1779,3405,2212
+1667,2795,2833,MNAAAVTPPPEKFNFAEHLLQTNRVRPDKTAFVDDVSSLSFAQLEVKARQLASALRAIGVKREERVLLLMLDGTDWPVSFLGAIYAGIVPVAVNTLLTADDYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVVVSRPAAPLEPGEVDFAAFVGAQAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYWSPELYGRHTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATSLLMGERPTPDAVFKRWLGGVGGVKSTVFYGAPTGYAGMLAAPNLPSRDQVALRLAASAGEALPAEIGQRFQRHFGIDIVDGIGSTEMLHIFLSNLPDRVRYGTTGWPVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGGWTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLEAAVVGVADEHGLTKPKAYVVARPGQTLSETELKTFIKDRLAPYKYPRSAVFVAELPKTATGKIQRFKLREGVLG,brenda,Q3LB11,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#Cc1ccccc1C(=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)(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)c1ccccc1C#N.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.11,7.992853949476505e-15,31.0,8.0,6.2.1.25,1076.0,-0.958607314841775,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#Cc1ccccc1C(=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)(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)c1ccccc1C#N.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,-0.958607314841775,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#Cc1ccccc1C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MNAAAVTPPPEKFNFAEHLLQTNRVRPDKTAFVDDVSSLSFAQLEVKARQLASALRAIGVKREERVLLLMLDGTDWPVSFLGAIYAGIVPVAVNTLLTADDYAYMLEHSRAQAVLVSGALHPVLKAALTKSDHEVQRVVVSRPAAPLEPGEVDFAAFVGAQAPLEKPAATQADDPAFWLYSSGSTGRPKGVVHTHANPYWSPELYGRHTLHLREDDVCFSAAKLFFAYGLGNALTFPMTVGATSLLMGERPTPDAVFKRWLGGVGGVKSTVFYGAPTGYAGMLAAPNLPSRDQVALRLAASAGEALPAEIGQRFQRHFGIDIVDGIGSTEMLHIFLSNLPDRVRYGTTGWPVPGYQIELRGDGGGPVADGEPGDLYIHGPSSATMYWGNRAKSRDTFQGGWTKSGDKYVRNDDGSYTYAGRTDDMLKVSGIYVSPFEIEATLVQHPGVLEAAVVGVADEHGLTKPKAYVVARPGQTLSETELKTFIKDRLAPYKYPRSAVFVAELPKTATGKIQRFKLREGVLG,./data/raw/alphafold//AF-Q3LB11-F1-model_v4.pdb,1671,1281,4576,1533
+1668,8308,8437,MAPPNGTTNGETEVATQGSYTAVSTGRKTTMHRLIEEHGSVLMPGVQDALSAAVVEKTGFHAAFVSGYSVSAAMLGLPDFGLLTTTEVVEATRRITAAAPNLCVVVDGDTGGGGPLNVQRFIRELISAGAKGVFLEDQVWPKKCGHMRGKAVVPAEEHALKIAAAREAIGDSDFFLVARTDARAPHGLEEGIRRANLYKEAGADATFVEAPANVDELKEVSAKTKGLRIANMIEGGKTPLHTPEEFKEMGFHLIAHSLTAVYATARALVNIMKILKEKGTTRDDLDQMATFSEFNELISLESWYEMESKFKNFTPKAT,uniprot_search,Q05957,CC[C@](O)(C(=O)O)[C@H](C)C(=O)O.O>>,8.4,99.48766029828415,25.0,7.5,3.7.1.1,3570.0,0.9242792860618816,CC[C@](O)(C(=O)O)[C@H](C)C(=O)O.O,,0.9242792860618816,CC[C@](O)(C(=O)O)[C@H](C)C(=O)O.O__MAPPNGTTNGETEVATQGSYTAVSTGRKTTMHRLIEEHGSVLMPGVQDALSAAVVEKTGFHAAFVSGYSVSAAMLGLPDFGLLTTTEVVEATRRITAAAPNLCVVVDGDTGGGGPLNVQRFIRELISAGAKGVFLEDQVWPKKCGHMRGKAVVPAEEHALKIAAAREAIGDSDFFLVARTDARAPHGLEEGIRRANLYKEAGADATFVEAPANVDELKEVSAKTKGLRIANMIEGGKTPLHTPEEFKEMGFHLIAHSLTAVYATARALVNIMKILKEKGTTRDDLDQMATFSEFNELISLESWYEMESKFKNFTPKAT,./data/raw/alphafold//AF-Q05957-F1-model_v4.pdb,3390,2273,3968,2848
+1669,17438,17675,MENFKHLPEPFRIRVIEPVKRTTREYRDEAILKAGMNPFLLDSEDVFIDLLTDSGTGAITQEMQAAMFRGDEAYSGSRSYYALANAVKDIFGYELTIPTHQGRGAEQIYIPVLIKKREIEKGLDRTKMVALSNYFFDTTQGHTQVNCCVAKNVYTEDAFDTSVNADFKGNFDLVKLEEAILAADPVNVPYIVSTITCNSAGGQPVSIANLKAVYEIAQKYDIPVIMDSARYAENAYFIQQREDTYKDWTIEEITRESYKYADGLAMSAKKDAMVQMGGLLCFKDESMMDAYTECRTLCVIQEGFPTYGGLEGGAMERLAVGLYDGMRQEWLAYRIGQVQYLVDGLESIGVVCQQAGGHAAFVDAGKLLPHISTEQFPAHALACELYKVAGIRAVEIGSLLLGRDPATGKQHPCPAELLRLTIPRATYTQTHMDFVIEAFQKVKANAANVKGLDFTYEPAVLRHFTARLKEVEPVQAAVKTETKILEEA,brenda,Q6LP64,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O>>CC(=O)C(=O)O.N.c1ccc2[nH]ccc2c1,2.5,0.0,25.0,8.0,4.1.99.1,74109.0,0.3979400086720376,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O,CC(=O)C(=O)O.N.c1ccc2[nH]ccc2c1,0.3979400086720376,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O__MENFKHLPEPFRIRVIEPVKRTTREYRDEAILKAGMNPFLLDSEDVFIDLLTDSGTGAITQEMQAAMFRGDEAYSGSRSYYALANAVKDIFGYELTIPTHQGRGAEQIYIPVLIKKREIEKGLDRTKMVALSNYFFDTTQGHTQVNCCVAKNVYTEDAFDTSVNADFKGNFDLVKLEEAILAADPVNVPYIVSTITCNSAGGQPVSIANLKAVYEIAQKYDIPVIMDSARYAENAYFIQQREDTYKDWTIEEITRESYKYADGLAMSAKKDAMVQMGGLLCFKDESMMDAYTECRTLCVIQEGFPTYGGLEGGAMERLAVGLYDGMRQEWLAYRIGQVQYLVDGLESIGVVCQQAGGHAAFVDAGKLLPHISTEQFPAHALACELYKVAGIRAVEIGSLLLGRDPATGKQHPCPAELLRLTIPRATYTQTHMDFVIEAFQKVKANAANVKGLDFTYEPAVLRHFTARLKEVEPVQAAVKTETKILEEA,./data/raw/alphafold//AF-Q6LP64-F1-model_v4.pdb,1307,2244,3936,2813
+1670,18844,19124,MGLSRKEQVFLALLGASGVSGLTALILLLVEATSVLLPTDIKFGIVFDAGSSHTSLFLYQWLANKENGTGVVSQALACQVEGPGISSYTSNAAQAGESLQGCLEEALVLIPEAQHRKTPTFLGATAGMRLLSRKNSSQARDIFAAVTQVLGRSPVDFWGAELLAGQAEGAFGWITVNYGLGTLVKYSFTGEWIQPPEEMLVGALDMGGASTQITFVPGGPILDKSTQADFRLYGSDYSVYTHSYLCFGRDQMLSRLLVGLVQSRPAALLRHPCYLSGYQTTLALGPLYESPCVHATPPLSLPQNLTVEGTGNPGACVSAIRELFNFSSCQGQEDCAFDGVYQPPLRGQFYAFSNFYYTFHFLNLTSRQPLSTVNATIWEFCQRPWKLVEASYPGQDRWLRDYCASGLYILTLLHEGYGFSEETWPSLEFRKQAGGVDIGWTLGYMLNLTGMIPADAPAQWRAESYGVWVAKVVFMVLALVAVVGAALVQLFWLQD,sabio,Q5MY95,O>>O=P(O)(O)O,0.0387,68.35286174567767,37.0,7.4,3.6.1.5,9606.0,-1.4122890349810886,O,O=P(O)(O)O,-1.4122890349810886,O__MGLSRKEQVFLALLGASGVSGLTALILLLVEATSVLLPTDIKFGIVFDAGSSHTSLFLYQWLANKENGTGVVSQALACQVEGPGISSYTSNAAQAGESLQGCLEEALVLIPEAQHRKTPTFLGATAGMRLLSRKNSSQARDIFAAVTQVLGRSPVDFWGAELLAGQAEGAFGWITVNYGLGTLVKYSFTGEWIQPPEEMLVGALDMGGASTQITFVPGGPILDKSTQADFRLYGSDYSVYTHSYLCFGRDQMLSRLLVGLVQSRPAALLRHPCYLSGYQTTLALGPLYESPCVHATPPLSLPQNLTVEGTGNPGACVSAIRELFNFSSCQGQEDCAFDGVYQPPLRGQFYAFSNFYYTFHFLNLTSRQPLSTVNATIWEFCQRPWKLVEASYPGQDRWLRDYCASGLYILTLLHEGYGFSEETWPSLEFRKQAGGVDIGWTLGYMLNLTGMIPADAPAQWRAESYGVWVAKVVFMVLALVAVVGAALVQLFWLQD,./data/raw/alphafold//AF-Q5MY95-F1-model_v4.pdb,182,2695,5004,5854
+1671,8383,8514,MLARRSFLQAAAGSLVLGLARAQGPSFPEPKVVRSQGGLLSLKLSATPTPLALAGQRATLLTYGGSFPGPTLRVRPRDTVRLTLENRLPEPTNLHWHGLPISPKVDDPFLEIPPGESWTYEFTVPKELAGTFWYHPHLHGRVAPQLFAGLLGALVVESSLDAIPELREAEEHLLVLKDLALQGGRPAPHTPMDWMNGKEGDLVLVNGALRPTLVAQKATLRLRLLNASNARYYRLALQDHPLYLIAADGGFLEEPLEVSELLLAPGERAEVLVRLRKEGRFLLQALPYDRGAMGMMDMGGMAHAMPQGPSRPETLLYLIAPKNPKPLPLPKALSPFPTLPAPVVTRRLVLTEDMMAARFFINGQVFDHRRVDLKGQAQTVEVWEVENQGDMDHPFHLHVHPFQVLSVGGRPFPYRAWKDVVNLKAGEVARLLVPLREKGRTVFHCHIVEHEDRGMMGVLEVG,sabio,Q72HW2,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O>>CCn1/c(=N/N=C2/Sc3cc(S(=O)(=O)[O-])ccc3[N+]2CC)sc2cc(S(=O)(=O)[O-])ccc21.O,3.33,1.4837780463171737,55.0,6.0,1.10.3.2,274.0,0.5224442335063199,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O,CCn1/c(=N/N=C2/Sc3cc(S(=O)(=O)[O-])ccc3[N+]2CC)sc2cc(S(=O)(=O)[O-])ccc21.O,1.390935107103379,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O__MLARRSFLQAAAGSLVLGLARAQGPSFPEPKVVRSQGGLLSLKLSATPTPLALAGQRATLLTYGGSFPGPTLRVRPRDTVRLTLENRLPEPTNLHWHGLPISPKVDDPFLEIPPGESWTYEFTVPKELAGTFWYHPHLHGRVAPQLFAGLLGALVVESSLDAIPELREAEEHLLVLKDLALQGGRPAPHTPMDWMNGKEGDLVLVNGALRPTLVAQKATLRLRLLNASNARYYRLALQDHPLYLIAADGGFLEEPLEVSELLLAPGERAEVLVRLRKEGRFLLQALPYDRGAMGMMDMGGMAHAMPQGPSRPETLLYLIAPKNPKPLPLPKALSPFPTLPAPVVTRRLVLTEDMMAARFFINGQVFDHRRVDLKGQAQTVEVWEVENQGDMDHPFHLHVHPFQVLSVGGRPFPYRAWKDVVNLKAGEVARLLVPLREKGRTVFHCHIVEHEDRGMMGVLEVG,./data/raw/alphafold//AF-Q72HW2-F1-model_v4.pdb,3407,2292,3996,2887
+1672,21651,21976,MQQASTPTIGMIVPPAAGLVPADGARLYPDLPFIASGLGLGSVTPEGYDAVIESVVDHARRLQKQGAAVVSLMGTSLSFYRGAAFNAALTVAMREATGLPCTTMSTAVLNGLRALGVRRVALATAYIDDVNERLAAFLAEESLVPTGCRSLGITGVEAMARVDTATLVDLCVRAFEAAPDSDGILLSCGGLLTLDAIPEVERRLGVPVVSSSPAGFWDAVRLAGGGAKARPGYGRLFDES,uniprot_search,Q05115,O=C([O-])C(C(=O)[O-])c1ccc2ccccc2c1>>,1730.0,99.56370553614045,45.0,8.5,4.1.1.76,518.0,3.2380461031287955,O=C([O-])C(C(=O)[O-])c1ccc2ccccc2c1,,3.2380461031287955,O=C([O-])C(C(=O)[O-])c1ccc2ccccc2c1__MQQASTPTIGMIVPPAAGLVPADGARLYPDLPFIASGLGLGSVTPEGYDAVIESVVDHARRLQKQGAAVVSLMGTSLSFYRGAAFNAALTVAMREATGLPCTTMSTAVLNGLRALGVRRVALATAYIDDVNERLAAFLAEESLVPTGCRSLGITGVEAMARVDTATLVDLCVRAFEAAPDSDGILLSCGGLLTLDAIPEVERRLGVPVVSSSPAGFWDAVRLAGGGAKARPGYGRLFDES,./data/raw/alphafold//AF-Q05115-F1-model_v4.pdb,1049,605,272,296
+1673,8039,8167,MGKLDKASKLIDEENKYYARSARINYYNLVIDHAHGATLVDVDGNKYIDLLASASAINVGHTHEKVVKAIADQAQKLIHYTPAYFHHVPGMELSEKLAKIAPGNSPKMVSFGNSGSDANDAIIKFARAYTGRQYIVSYMGSYHGSTYGSQTLSGSSLNMTRKIGPMLPSVVHVPYPDSYRTYPGETEHDVSLRYFNEFKKPFESFLPADETACVLIEPIQGDGGIIKAPEEYMQLVYKFCHEHGILFAIDEVNQGLGRTGKMWAIQQFKDIEPDLMSVGKSLASGMPLSAVIGKKEVMQSLDAPAHLFTTAGNPVCSAASLATLDVIEYEGLVEKSATDGAYAKQRFLEMQQRHPMIGDVRMWGLNGGIELVKDPKTKEPDSDAATKVIYYAFAHGVVIITLAGNILRFQPPLVIPREQLDQALQVLDDAFTAVENGEVTIPKDTGKIGW,brenda,M1GRN3,CC[C@H](C)[C@H](N)C(=O)O>>CCC(C)[C@@H](N)C(=O)O,502.0,0.0,37.0,5.5,5.1.1.21,1581.0,2.7007037171450192,CC[C@H](C)[C@H](N)C(=O)O,CCC(C)[C@@H](N)C(=O)O,2.7007037171450192,CC[C@H](C)[C@H](N)C(=O)O__MGKLDKASKLIDEENKYYARSARINYYNLVIDHAHGATLVDVDGNKYIDLLASASAINVGHTHEKVVKAIADQAQKLIHYTPAYFHHVPGMELSEKLAKIAPGNSPKMVSFGNSGSDANDAIIKFARAYTGRQYIVSYMGSYHGSTYGSQTLSGSSLNMTRKIGPMLPSVVHVPYPDSYRTYPGETEHDVSLRYFNEFKKPFESFLPADETACVLIEPIQGDGGIIKAPEEYMQLVYKFCHEHGILFAIDEVNQGLGRTGKMWAIQQFKDIEPDLMSVGKSLASGMPLSAVIGKKEVMQSLDAPAHLFTTAGNPVCSAASLATLDVIEYEGLVEKSATDGAYAKQRFLEMQQRHPMIGDVRMWGLNGGIELVKDPKTKEPDSDAATKVIYYAFAHGVVIITLAGNILRFQPPLVIPREQLDQALQVLDDAFTAVENGEVTIPKDTGKIGW,./data/raw/alphafold//AF-M1GRN3-F1-model_v4.pdb,3371,2248,3940,2817
+1674,3665,3715,MGKSESQMDITDINTPKPKKKQRWTPLEISLSVLVLLLTIIAVTMIALYATYDDGICKSSDCIKSAARLIQNMDATTEPCTDFFKYACGGWLKRNVIPETSSRYGNFDILRDELEVVLKDVLQEPKTEDIVAVQKAKALYRSCINESAIDSRGGEPLLKLLPDIYGWPVATENWEQKYGASWTAEKAIAQLNSKYGKKVLINLFVGTDDKNSVNHVIHIDQPRLGLPSRDYYECTGIYKEACTAYVDFMISVARLIRQEERLPIDENQLALEMNKVMELEKEIANATAKPEDRNDPMLLYNKMTLAQIQNNFSLEINGKPFSWLNFTNEIMSTVNISITNEEDVVVYAPEYLTKLKPILTKYSARDLQNLMSWRFIMDLVSSLSRTYKESRNAFRKALYGTTSETATWRRCANYVNGNMENAVGRLYVEAAFAGESKHVVEDLIAQIREVFIQTLDDLTWMDAETKKRAEEKALAIKERIGYPDDIVSNDNKLNNEYLELNYKEDEYFENIIQNLKFSQSKQLKKLREKVDKDEWISGAAVVNAFYSSGRNQIVFPAGILQPPFFSAQQSNSLNYGGIGMVIGHEITHGFDDNGRNFNKDGDLVDWWTQQSASNFKEQSQCMVYQYGNFSWDLAGGQHLNGINTLGENIADNGGLGQAYRAYQNYIKKNGEEKLLPGLDLNHKQLFFLNFAQVWCGTYRPEYAVNSIKTDVHSPGNFRIIGTLQNSAEFSEAFHCRKNSYMNPEKKCRVW,brenda,P08473,CC(C)CC(N=C(O)C(CCCCN)N=C(O)C(CCCNC(=N)N)N=C(O)C(C)N=C(O)C(CO)N=C(O)C(CCCCN)N=C(O)C(CCCNC(=N)N)N=C(O)C(C)N=C(O)CN=C(O)C(N=C(O)C(Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)C(N)Cc1ccccc1)C(C)O)C(O)=NC(C)C(O)=NC(CC(=N)O)C(O)=NC(CCC(=N)O)C(=O)O.O>>,11.0,99.9452978885532,30.0,6.55,3.4.24.11,9606.0,1.0413926851582251,CC(C)CC(N=C(O)C(CCCCN)N=C(O)C(CCCNC(=N)N)N=C(O)C(C)N=C(O)C(CO)N=C(O)C(CCCCN)N=C(O)C(CCCNC(=N)N)N=C(O)C(C)N=C(O)CN=C(O)C(N=C(O)C(Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)C(N)Cc1ccccc1)C(C)O)C(O)=NC(C)C(O)=NC(CC(=N)O)C(O)=NC(CCC(=N)O)C(=O)O.O,,1.0413926851582251,CC(C)CC(N=C(O)C(CCCCN)N=C(O)C(CCCNC(=N)N)N=C(O)C(C)N=C(O)C(CO)N=C(O)C(CCCCN)N=C(O)C(CCCNC(=N)N)N=C(O)C(C)N=C(O)CN=C(O)C(N=C(O)C(Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)C(N)Cc1ccccc1)C(C)O)C(O)=NC(C)C(O)=NC(CC(=N)O)C(O)=NC(CCC(=N)O)C(=O)O.O__MGKSESQMDITDINTPKPKKKQRWTPLEISLSVLVLLLTIIAVTMIALYATYDDGICKSSDCIKSAARLIQNMDATTEPCTDFFKYACGGWLKRNVIPETSSRYGNFDILRDELEVVLKDVLQEPKTEDIVAVQKAKALYRSCINESAIDSRGGEPLLKLLPDIYGWPVATENWEQKYGASWTAEKAIAQLNSKYGKKVLINLFVGTDDKNSVNHVIHIDQPRLGLPSRDYYECTGIYKEACTAYVDFMISVARLIRQEERLPIDENQLALEMNKVMELEKEIANATAKPEDRNDPMLLYNKMTLAQIQNNFSLEINGKPFSWLNFTNEIMSTVNISITNEEDVVVYAPEYLTKLKPILTKYSARDLQNLMSWRFIMDLVSSLSRTYKESRNAFRKALYGTTSETATWRRCANYVNGNMENAVGRLYVEAAFAGESKHVVEDLIAQIREVFIQTLDDLTWMDAETKKRAEEKALAIKERIGYPDDIVSNDNKLNNEYLELNYKEDEYFENIIQNLKFSQSKQLKKLREKVDKDEWISGAAVVNAFYSSGRNQIVFPAGILQPPFFSAQQSNSLNYGGIGMVIGHEITHGFDDNGRNFNKDGDLVDWWTQQSASNFKEQSQCMVYQYGNFSWDLAGGQHLNGINTLGENIADNGGLGQAYRAYQNYIKKNGEEKLLPGLDLNHKQLFFLNFAQVWCGTYRPEYAVNSIKTDVHSPGNFRIIGTLQNSAEFSEAFHCRKNSYMNPEKKCRVW,./data/raw/alphafold//AF-P08473-F1-model_v4.pdb,2897,1609,3207,1825
+1675,15783,16010,MVIMEGFKIAMKVIDEIDKKIKPLIGWEKADEVVKIGADGTPTKRIDVIAENMAINILEKFSGGILISEEIGLKVVGDELEYIFILDPIDGTYNALKSIPIYSTSIAVAKIKGEDKKLIRENINNIDWIKSFIANKYTINDLYVGIVKNLATGDLYYAIKGEGSFLEKDGEKIKIETKNIKDLKEASVGLFVYGLSNDLLEFLKERKVRRVRLFGSMALEMCYVVSGALDAYINVNENSRLCDIAGAYVICREGNAIVTNKNGKPLNMKLHLMERTSLIVSNKYLHKKLIALFGNRWIIKPVKFGIVVREDKEEAINLAIEICKYLKDKNIPFCVEDFLRERVGGDKFDISAISHIIAIGGDGTILRASRLVNGETIPIIAVNMGKVGFLAEFCKDEVFEIIDKVIYGEYEIEKRSKLSCKIIKDNRVIKTPSALNEMVVITKNPAKILEFDVYVNDTLVENVRADGIIVSTPTGSTAYSLSAGGPIVEPNVDCFIISPICPFKLSSRPLVISASNRIKLKLKLEKPALLVIDGSVEYEINKDDELIFEKSDSYAYFVKGQSFYNKLSRCLGIK,sabio,Q58327,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,906.0,7.450653382058689e-15,85.0,8.5,3.1.3.-,2190.0,2.957128197676813,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,2.957128197676813,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__MVIMEGFKIAMKVIDEIDKKIKPLIGWEKADEVVKIGADGTPTKRIDVIAENMAINILEKFSGGILISEEIGLKVVGDELEYIFILDPIDGTYNALKSIPIYSTSIAVAKIKGEDKKLIRENINNIDWIKSFIANKYTINDLYVGIVKNLATGDLYYAIKGEGSFLEKDGEKIKIETKNIKDLKEASVGLFVYGLSNDLLEFLKERKVRRVRLFGSMALEMCYVVSGALDAYINVNENSRLCDIAGAYVICREGNAIVTNKNGKPLNMKLHLMERTSLIVSNKYLHKKLIALFGNRWIIKPVKFGIVVREDKEEAINLAIEICKYLKDKNIPFCVEDFLRERVGGDKFDISAISHIIAIGGDGTILRASRLVNGETIPIIAVNMGKVGFLAEFCKDEVFEIIDKVIYGEYEIEKRSKLSCKIIKDNRVIKTPSALNEMVVITKNPAKILEFDVYVNDTLVENVRADGIIVSTPTGSTAYSLSAGGPIVEPNVDCFIISPICPFKLSSRPLVISASNRIKLKLKLEKPALLVIDGSVEYEINKDDELIFEKSDSYAYFVKGQSFYNKLSRCLGIK,./data/raw/alphafold//AF-Q58327-F1-model_v4.pdb,2220,4457,4362,4248
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+1677,10948,11103,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](CCC(=O)O)N=C(O)[C@H](Cc1ccccc1)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](Cc1ccccc1)C(O)=N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)O,2.4,3.391760510253512e-14,33.5,7.666666666666667,3.4.21.26,9823.0,0.380211241711606,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](CCC(=O)O)N=C(O)[C@H](Cc1ccccc1)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](Cc1ccccc1)C(O)=N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)O,0.380211241711606,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](CCC(=O)O)N=C(O)[C@H](Cc1ccccc1)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
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+1709,13885,14066,MEREMTPSEDFVVTDRGGIVENSHRVHAAVVDAKGRLLYALGNPTRMTLARSAAKPAQALAILETEGVAGYGFDDADIALMCASHSSEDRHIARTRAMLSKIKAEEADLRCGGHPSLSEMVNRSWIKQDFIPTAVCSNCSGKHVGMLAGARAIGAGTDGYHLPDHPMQGRVKRTVAELCDLDAGDVEWGTDGCNLPTPAFPLDRLGRIYAKLASAADGSDAGEGQSTRCAALAHIFRAMARHPEMVAGEGRYCTMLMRAFDGALVGKLGADASYAIGVRASDATRQLGTDGALGISVKIEDGNLEMLYAVVTELLERLGIGSPDVRSQLASFHHPQRVNTMGVTTGGVSFPFKLRGSKSNVDDPRLAAVAR,brenda,Q9RFN5,N=C(O)C[C@H](N)C(=O)O.O>>N.N[C@@H](CC(=O)O)C(=O)O,106.0,9.434028649044713e-15,37.0,7.5,3.5.1.1,29449.0,2.0253058652647704,N=C(O)C[C@H](N)C(=O)O.O,N.N[C@@H](CC(=O)O)C(=O)O,2.0253058652647704,N=C(O)C[C@H](N)C(=O)O.O__MEREMTPSEDFVVTDRGGIVENSHRVHAAVVDAKGRLLYALGNPTRMTLARSAAKPAQALAILETEGVAGYGFDDADIALMCASHSSEDRHIARTRAMLSKIKAEEADLRCGGHPSLSEMVNRSWIKQDFIPTAVCSNCSGKHVGMLAGARAIGAGTDGYHLPDHPMQGRVKRTVAELCDLDAGDVEWGTDGCNLPTPAFPLDRLGRIYAKLASAADGSDAGEGQSTRCAALAHIFRAMARHPEMVAGEGRYCTMLMRAFDGALVGKLGADASYAIGVRASDATRQLGTDGALGISVKIEDGNLEMLYAVVTELLERLGIGSPDVRSQLASFHHPQRVNTMGVTTGGVSFPFKLRGSKSNVDDPRLAAVAR,./data/raw/alphafold//AF-Q9RFN5-F1-model_v4.pdb,2291,4621,4647,4475
+1710,18585,18855,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(F)cn1C/C=C/CP(=O)(O)O>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,0.73,28.688474024079344,37.0,7.4,2.7.4.9,9606.0,-0.1366771398795441,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(F)cn1C/C=C/CP(=O)(O)O,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,-0.1366771398795441,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(F)cn1C/C=C/CP(=O)(O)O__MAARRGALIVLEGVDRAGKSTQSRKLVEALCAAGHRAELLRFPERSTEIGKLLSSYLQKKSDVEDHSVHLLFSANRWEQVPLIKEKLSQGVTLVVDRYAFSGVAFTGAKENFSLDWCKQPDVGLPKPDLVLFLQLQLADAAKRGAFGHERYENGAFQERALRCFHQLMKDTTLNWKMVDASKSIEAVHEDIRVLSEDAIRTATEKPLGELWK,./data/raw/alphafold//AF-P23919-F1-model_v4.pdb,143,4175,4043,3890
+1711,19245,19531,MDSNGYLVVGVVAFALPCSFRVSLTDSVPLFSPVHDAASLTRNSFPAGFIFGAGSSAYQFEGAAKEGGRGPSIWDTFTHNHPEKIRDGANGDVAVDQYHRYKEDVKIMKDMNLDSYRFSISWPRILPKGKLSGGVNQEGINYYNNLINELLANGVLPYATLFHWDLPQALEDEYGGFLSSHIVDDFQDYADLCFKEFGDRVKFWTTLNEPWLFSQGGYATGATAPGRCTGPQCLGGDAGTEPYIVTHNQILAHAAAVHVYKTKYQAHQKGKIGITLVSNWFIPLAENSTSDIKAARRAIDFQYGWYMEPLTKGEYPKNMRALVGSRLPKFTKWQAKLVNGSFDFIGLNYYSSGYINGVPPSNDKPNFLTDSRTNTSFERNGRPLGLRAASVWIYFYPRGLLDLLLYTKEKYNNPLIYITENGMNEFNDPTLSVEEALMDIYRIDYYYRHFFYLRSAIKAGANVKGFFAWSFLDCNEWFAGFTVRFGLNFVDYKDGLKRYPKLFAQWYKNFLKRN,brenda,Q08IT7,O.O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(-c4ccc(O)cc4)coc3c2)[C@H](O)[C@@H](O)[C@@H]1O>>O=C(O)CC(=O)OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O.O=c1c(-c2ccc(O)cc2)coc2cc(O)cc(O)c12,98.0,2.117302012537965e-14,30.0,7.0,3.2.1.21,3847.0,1.9912260756924949,O.O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(-c4ccc(O)cc4)coc3c2)[C@H](O)[C@@H](O)[C@@H]1O,O=C(O)CC(=O)OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O.O=c1c(-c2ccc(O)cc2)coc2cc(O)cc(O)c12,1.9912260756924949,O.O=C(O)CC(=O)OC[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(-c4ccc(O)cc4)coc3c2)[C@H](O)[C@@H](O)[C@@H]1O__MDSNGYLVVGVVAFALPCSFRVSLTDSVPLFSPVHDAASLTRNSFPAGFIFGAGSSAYQFEGAAKEGGRGPSIWDTFTHNHPEKIRDGANGDVAVDQYHRYKEDVKIMKDMNLDSYRFSISWPRILPKGKLSGGVNQEGINYYNNLINELLANGVLPYATLFHWDLPQALEDEYGGFLSSHIVDDFQDYADLCFKEFGDRVKFWTTLNEPWLFSQGGYATGATAPGRCTGPQCLGGDAGTEPYIVTHNQILAHAAAVHVYKTKYQAHQKGKIGITLVSNWFIPLAENSTSDIKAARRAIDFQYGWYMEPLTKGEYPKNMRALVGSRLPKFTKWQAKLVNGSFDFIGLNYYSSGYINGVPPSNDKPNFLTDSRTNTSFERNGRPLGLRAASVWIYFYPRGLLDLLLYTKEKYNNPLIYITENGMNEFNDPTLSVEEALMDIYRIDYYYRHFFYLRSAIKAGANVKGFFAWSFLDCNEWFAGFTVRFGLNFVDYKDGLKRYPKLFAQWYKNFLKRN,./data/raw/alphafold//AF-Q08IT7-F1-model_v4.pdb,1219,2779,5096,5957
+1712,21790,22115,MSTSSSDPFFNFAKSSFRSAAAQKASASSLPPLPGPDKKVPGMDIKYDVVIVGSGPIGCTYARELVGAGYKVAMFDIGEIDSGLKIGAHKKNTVEYQKNIDKFVNVIQGQLMSVSVPVNTLVVDTLSPTSWQASTFFVRNGSNPEQDPLRNLSGQAVTRVVGGMSTHWTCATPRFDREQRPLLVKDDADADDAEWDRLYTKAESYFQTGTDQFKESIRHNLVLNKLTEEYKGQRDFQQIPLAATRRSPTFVEWSSANTVFDLQNRPNTDAPEERFNLFPAVACERVVRNALNSEIESLHIHDLISGDRFEIKADVYVLTAGAVHNTQLLVNSGFGQLGRPNPANPPELLPSLGSYITEQSLVFCQTVMSTELIDSVKSDMTIRGTPGELTYSVTYTPGASTNKHPDWWNEKVKNHMMQHQEDPLPIPFEDPEPQVTTLFQPSHPWHTQIHRDAFSYGAVQQSIDSRLIVDWRFFGRTEPKEENKLWFSDKITDAYNMPQPTFDFRFPAGRTSKEAEDMMTDMCVMSAKIGGFLPGSLPQFMEPGLVLHLGGTHRMGFDEKEDNCCVNTDSRVFGFKNLFLGGCGNIPTAYGANPTLTAMSLAIKSCEYIKQNFTPSPFTSEAQ,sabio,Q7ZA32,O=C1C=CC(=O)C=C1.OCC1OC(O)C(O)C(O)C1O>>O=C1C(O)OC(CO)C(O)C1O.Oc1ccc(O)cc1,210.0,0.0,30.0,6.5,1.1.3.10,230624.0,2.322219294733919,O=C1C=CC(=O)C=C1.OCC1OC(O)C(O)C(O)C1O,O=C1C(O)OC(CO)C(O)C1O.Oc1ccc(O)cc1,2.431363764158988,O=C1C=CC(=O)C=C1.OCC1OC(O)C(O)C(O)C1O__MSTSSSDPFFNFAKSSFRSAAAQKASASSLPPLPGPDKKVPGMDIKYDVVIVGSGPIGCTYARELVGAGYKVAMFDIGEIDSGLKIGAHKKNTVEYQKNIDKFVNVIQGQLMSVSVPVNTLVVDTLSPTSWQASTFFVRNGSNPEQDPLRNLSGQAVTRVVGGMSTHWTCATPRFDREQRPLLVKDDADADDAEWDRLYTKAESYFQTGTDQFKESIRHNLVLNKLTEEYKGQRDFQQIPLAATRRSPTFVEWSSANTVFDLQNRPNTDAPEERFNLFPAVACERVVRNALNSEIESLHIHDLISGDRFEIKADVYVLTAGAVHNTQLLVNSGFGQLGRPNPANPPELLPSLGSYITEQSLVFCQTVMSTELIDSVKSDMTIRGTPGELTYSVTYTPGASTNKHPDWWNEKVKNHMMQHQEDPLPIPFEDPEPQVTTLFQPSHPWHTQIHRDAFSYGAVQQSIDSRLIVDWRFFGRTEPKEENKLWFSDKITDAYNMPQPTFDFRFPAGRTSKEAEDMMTDMCVMSAKIGGFLPGSLPQFMEPGLVLHLGGTHRMGFDEKEDNCCVNTDSRVFGFKNLFLGGCGNIPTAYGANPTLTAMSLAIKSCEYIKQNFTPSPFTSEAQ,./data/raw/alphafold//AF-Q7ZA32-F1-model_v4.pdb,567,106,5819,335
+1713,14825,15034,MRAAPLLLARAASLSLGFLFLLFFWLDRSVLAKELKFVTLVFRHGDRSPIDTFPTDPIKESSWPQGFGQLTQLGMEQHYELGEYIRKRYRKFLNESYKHEQVYIRSTDVDRTLMSAMTNLAALFPPEGVSIWNPILLWQPIPVHTVPLSEDQLLYLPFRNCPRFQELESETLKSEEFQKRLHPYKDFIATLGKLSGLHGQDLFGIWSKVYDPLYCESVHNFTLPSWATEDTMTKLRELSELSLLSLYGIHKQKEKSRLQGGVLVNEILNHMKRATQIPSYKKLIMYSAHDTTVSGLQMALDVYNGLLPPYASCHLTELYFEKGEYFVEMYYRNETQHEPYPLMLPGCSPSCPLERFAELVGPVIPQDWSTECMTTNSHQGTEDSTD,brenda,P15309,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.O>>N=c1nc(O)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2[nH]1.O=P(O)(O)O,244.0,0.0,20.0,5.0,3.1.3.2,9606.0,2.3873898263387296,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.O,N=c1nc(O)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2[nH]1.O=P(O)(O)O,2.3873898263387296,N=c1nc(O)c2ncn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2[nH]1.O__MRAAPLLLARAASLSLGFLFLLFFWLDRSVLAKELKFVTLVFRHGDRSPIDTFPTDPIKESSWPQGFGQLTQLGMEQHYELGEYIRKRYRKFLNESYKHEQVYIRSTDVDRTLMSAMTNLAALFPPEGVSIWNPILLWQPIPVHTVPLSEDQLLYLPFRNCPRFQELESETLKSEEFQKRLHPYKDFIATLGKLSGLHGQDLFGIWSKVYDPLYCESVHNFTLPSWATEDTMTKLRELSELSLLSLYGIHKQKEKSRLQGGVLVNEILNHMKRATQIPSYKKLIMYSAHDTTVSGLQMALDVYNGLLPPYASCHLTELYFEKGEYFVEMYYRNETQHEPYPLMLPGCSPSCPLERFAELVGPVIPQDWSTECMTTNSHQGTEDSTD,./data/raw/alphafold//AF-P15309-F1-model_v4.pdb,2488,4919,4992,4846
+1714,18940,19224,MQGLLILSVLLGAALGKEDFVGHQVLRITAADEAEVQTVKELEDLEHLQLDFWRGPGQPGSPIDVRVPFPSLQAVKVFLEAHGIRYRIMIEDVQSLLDEEQEQMFASQSRARSTNTFNYATYHTLDEIYDFMDLLVAEHPQLVSKLQIGRSYEGRPIYVLKFSTGGSNRPAIWIDLGIHSREWITQATGVWFAKKFTEDYGQDPSFTAILDSMDIFLEIVTNPDGFAFTHSQNRLWRKTRSVTSSSLCVGVDANRNWDAGFGKAGASSSPCSETYHGKYANSEVEVKSIVDFVKDHGNFKAFLSIHSYSQLLLYPYGYTTQSIPDKTELNQVAKSAVEALKSLYGTSYKYGSIITTIYQASGGSIDWSYNQGIKYSFTFELRDTGRYGFLLPASQIIPTAQETWLGVLTIMEHTLNNLY,sabio,P00730,O>>NC(Cc1ccc(O)cc1)C(=O)O,16.0,81.50405082764752,25.0,7.5,3.4.17.1,9913.0,1.2041199826559248,O,NC(Cc1ccc(O)cc1)C(=O)O,2.1172712956557644,O__MQGLLILSVLLGAALGKEDFVGHQVLRITAADEAEVQTVKELEDLEHLQLDFWRGPGQPGSPIDVRVPFPSLQAVKVFLEAHGIRYRIMIEDVQSLLDEEQEQMFASQSRARSTNTFNYATYHTLDEIYDFMDLLVAEHPQLVSKLQIGRSYEGRPIYVLKFSTGGSNRPAIWIDLGIHSREWITQATGVWFAKKFTEDYGQDPSFTAILDSMDIFLEIVTNPDGFAFTHSQNRLWRKTRSVTSSSLCVGVDANRNWDAGFGKAGASSSPCSETYHGKYANSEVEVKSIVDFVKDHGNFKAFLSIHSYSQLLLYPYGYTTQSIPDKTELNQVAKSAVEALKSLYGTSYKYGSIITTIYQASGGSIDWSYNQGIKYSFTFELRDTGRYGFLLPASQIIPTAQETWLGVLTIMEHTLNNLY,./data/raw/alphafold//AF-P00730-F1-model_v4.pdb,3735,2714,3142,2100
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+1716,641,660,MHSSHLLLEEPIRMTSILEPSKSSFFPALTKIVGTLGPKSRSVEVIAGCLKAGMSVARFDFSWCDADYHQETLENLKIAVKSTKKLCAVMLDTVGPELQVINKTEKAISLKADGLVTLTPSQDQEASSEVLPINFDGLAKAVKKGDTIFVGQYLFTGSETTSVWLEVEEVKGDDVICISRNAATLGGPLFTLHVSQVHIDMPTLTEKDKEVISTWGVQNKIDFLSLSYCRHAEDVRQARELLNSCGDLSQTQIFAKIENEEGLTHFDEILQEADGIILSRGNLGIDLPPEKVFLFQKAALYKCNMAGKPAVLTRVVDSMTDNLRPTRAEATDVANAVLDGSDAILLGAETLRGLYPVETISTVGRICCEAEKVFNQDLFFKKTVKYVGEPMTHLESIASSAVRAAIKVKASVIICFTSSGRAARLIAKYRPTMPVLSVVIPRLTTNQLKWSFSGAFEARQSLIVRGLFPMLADPRHPAESTSATNESVLKVALDHGKQAGVIKSHDRVVVCQKVGDASVVKIIELED,brenda,Q9SJQ0,C=C(OP(=O)(O)O)C(=O)O.N=c1ccn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O2)c(O)n1>>CC(=O)C(=O)O.N=c1ccn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(O)n1,4.0,0.0,25.0,7.5,2.7.1.40,3702.0,0.6020599913279624,C=C(OP(=O)(O)O)C(=O)O.N=c1ccn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O2)c(O)n1,CC(=O)C(=O)O.N=c1ccn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(O)n1,0.6020599913279624,C=C(OP(=O)(O)O)C(=O)O.N=c1ccn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O2)c(O)n1__MHSSHLLLEEPIRMTSILEPSKSSFFPALTKIVGTLGPKSRSVEVIAGCLKAGMSVARFDFSWCDADYHQETLENLKIAVKSTKKLCAVMLDTVGPELQVINKTEKAISLKADGLVTLTPSQDQEASSEVLPINFDGLAKAVKKGDTIFVGQYLFTGSETTSVWLEVEEVKGDDVICISRNAATLGGPLFTLHVSQVHIDMPTLTEKDKEVISTWGVQNKIDFLSLSYCRHAEDVRQARELLNSCGDLSQTQIFAKIENEEGLTHFDEILQEADGIILSRGNLGIDLPPEKVFLFQKAALYKCNMAGKPAVLTRVVDSMTDNLRPTRAEATDVANAVLDGSDAILLGAETLRGLYPVETISTVGRICCEAEKVFNQDLFFKKTVKYVGEPMTHLESIASSAVRAAIKVKASVIICFTSSGRAARLIAKYRPTMPVLSVVIPRLTTNQLKWSFSGAFEARQSLIVRGLFPMLADPRHPAESTSATNESVLKVALDHGKQAGVIKSHDRVVVCQKVGDASVVKIIELED,./data/raw/alphafold//AF-Q9SJQ0-F1-model_v4.pdb,1130,719,410,463
+1717,9204,9346,MDRRRFLVGLLGLGLARGQGLRVEEVVGGLEVPWALAFLPDGGMLIAERPGRIRLFREGRLSTYAELPVYHRGESGLLGLALHPRFPEAPYVYAYRTVAEGGLRNQVVRLRHLGERGVLDRVVLDGIPARPHGLHSGGRIAFGPDGMLYVTTGEVYERELAQDLASLGGKILRLTPEGEPAPGNPFLGRRGARPEVYSLGHRNPQGLAWHPKTGELFSSEHGPSGEQGYGHDEVNLIVPGGNYGWPRVVGRGNDPRYRDPLYFWPQGFPPGNLAFFRGDLYVAGLRGQALLRLVLEGERGRWRVLRVETALSGFGRLREVQVGPDGALYVTTSNRDGRGQVRPGDDRVLRLL,brenda,I7A144,COS(=O)(=O)[O-].C[n+]1c2ccccc2nc2ccccc21.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>>CN1c2ccccc2Nc2ccccc21.COS(=O)(=O)O.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,1953.0,0.0,70.0,7.5,1.1.5.2,274.0,3.2907022432878543,COS(=O)(=O)[O-].C[n+]1c2ccccc2nc2ccccc21.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,CN1c2ccccc2Nc2ccccc21.COS(=O)(=O)O.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,3.2907022432878543,COS(=O)(=O)[O-].C[n+]1c2ccccc2nc2ccccc21.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__MDRRRFLVGLLGLGLARGQGLRVEEVVGGLEVPWALAFLPDGGMLIAERPGRIRLFREGRLSTYAELPVYHRGESGLLGLALHPRFPEAPYVYAYRTVAEGGLRNQVVRLRHLGERGVLDRVVLDGIPARPHGLHSGGRIAFGPDGMLYVTTGEVYERELAQDLASLGGKILRLTPEGEPAPGNPFLGRRGARPEVYSLGHRNPQGLAWHPKTGELFSSEHGPSGEQGYGHDEVNLIVPGGNYGWPRVVGRGNDPRYRDPLYFWPQGFPPGNLAFFRGDLYVAGLRGQALLRLVLEGERGRWRVLRVETALSGFGRLREVQVGPDGALYVTTSNRDGRGQVRPGDDRVLRLL,./data/raw/alphafold//AF-I7A144-F1-model_v4.pdb,3352,2217,3905,2778
+1718,3131,3173,MNIGDTLNHSLLNHPLMLSGSTCKTLSDYTNQWLVLYFYPKDNTPGCSTEGLEFNLLLPQFEQINATVLGVSRDSVKSHDSFCAKQGFTFPLVSDSDAILCKAFDVIKEKTMYGRQVIGIERSTFLIGPTHRIVEAWRQVKVPGHAEEVLNKLKAHAEQ,brenda,Q9PER7,CC(C)(OO)c1ccccc1>>CC(C)(O)c1ccccc1.O,0.41,0.6558187650047886,37.0,7.4,1.11.1.24,2371.0,-0.3872161432802645,CC(C)(OO)c1ccccc1,CC(C)(O)c1ccccc1.O,-0.3872161432802645,CC(C)(OO)c1ccccc1__MNIGDTLNHSLLNHPLMLSGSTCKTLSDYTNQWLVLYFYPKDNTPGCSTEGLEFNLLLPQFEQINATVLGVSRDSVKSHDSFCAKQGFTFPLVSDSDAILCKAFDVIKEKTMYGRQVIGIERSTFLIGPTHRIVEAWRQVKVPGHAEEVLNKLKAHAEQ,./data/raw/alphafold//AF-Q9PER7-F1-model_v4.pdb,1600,1187,1662,1390
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+1741,15689,15916,MHSQKRVVVLGSGVIGLSSALILARKGYSVHILARDLPEDVSSQTFASPWAGANWTPFMTLTDGPRQAKWEESTFKKWVELVPTGHAMWLKGTRRFAQNEDGLLGHWYKDITPNYRPLPSSECPPGAIGVTYDTLSVHAPKYCQYLARELQKLGATFERRTVTSLEQAFDGADLVVNATGLGAKSIAGIDDQAAEPIRGQTVLVKSPCKRCTMDSSDPASPAYIIPRPGGEVICGGTYGVGDWDLSVNPETVQRILKHCLRLDPTISSDGTIEGIEVLRHNVGLRPARRGGPRVEAERIVLPLDRTKSPLSLGRGSARAAKEKEVTLVHAYGFSSAGYQQSWGAAEDVAQLVDEAFQRYHGAARESKL,sabio,P80324,NC(=O)CC(N)C(=O)O.O.O=O>>N.NC(=O)CC(=O)C(=O)O.OO,78000.0,0.0,25.0,8.5,1.4.3.3,5286.0,4.892094602690481,NC(=O)CC(N)C(=O)O.O.O=O,N.NC(=O)CC(=O)C(=O)O.OO,4.892094602690481,NC(=O)CC(N)C(=O)O.O.O=O__MHSQKRVVVLGSGVIGLSSALILARKGYSVHILARDLPEDVSSQTFASPWAGANWTPFMTLTDGPRQAKWEESTFKKWVELVPTGHAMWLKGTRRFAQNEDGLLGHWYKDITPNYRPLPSSECPPGAIGVTYDTLSVHAPKYCQYLARELQKLGATFERRTVTSLEQAFDGADLVVNATGLGAKSIAGIDDQAAEPIRGQTVLVKSPCKRCTMDSSDPASPAYIIPRPGGEVICGGTYGVGDWDLSVNPETVQRILKHCLRLDPTISSDGTIEGIEVLRHNVGLRPARRGGPRVEAERIVLPLDRTKSPLSLGRGSARAAKEKEVTLVHAYGFSSAGYQQSWGAAEDVAQLVDEAFQRYHGAARESKL,./data/raw/alphafold//AF-P80324-F1-model_v4.pdb,1452,982,791,1101
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+1743,14845,15054,MLSFTMTEASFTMIDIGAKVFLTLVLVNSTVEQAQNQKVEAITAIAEELESQITNCDAILQKMMPEGVLEQLKNGQATEAKEYESVTVFFSDITNFTVISSRTSTKDMMATLNKLWLEYDAIAKRWGVYKVETIGDAYLGVTGAPEVVPDHADRAVNFALDIIEMIKTFKTATGESINIRIGLNSGPVTAGVLGDLNPHWCLVGDTVNTASRMESTSKAGHIHISDSTYQMIKGKFVTQPLDLMEVKGKGKMQTYWVTARK,brenda,A0A1Y2HEJ3,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>>N=c1nc(O)c2ncn([C@@H]3O[C@@H]4COP(=O)(O)O[C@H]4[C@H]3O)c2[nH]1.O=P(O)(O)OP(=O)(O)O,1.13,1.085458874024607e-14,22.0,7.5,4.6.1.2,109876.0,0.0530784434834196,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,N=c1nc(O)c2ncn([C@@H]3O[C@@H]4COP(=O)(O)O[C@H]4[C@H]3O)c2[nH]1.O=P(O)(O)OP(=O)(O)O,0.0530784434834196,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__MLSFTMTEASFTMIDIGAKVFLTLVLVNSTVEQAQNQKVEAITAIAEELESQITNCDAILQKMMPEGVLEQLKNGQATEAKEYESVTVFFSDITNFTVISSRTSTKDMMATLNKLWLEYDAIAKRWGVYKVETIGDAYLGVTGAPEVVPDHADRAVNFALDIIEMIKTFKTATGESINIRIGLNSGPVTAGVLGDLNPHWCLVGDTVNTASRMESTSKAGHIHISDSTYQMIKGKFVTQPLDLMEVKGKGKMQTYWVTARK,./data/raw/alphafold//AF-A0A1Y2HEJ3-F1-model_v4.pdb,2494,4925,4999,4853
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+1746,8603,8737,MDQPFKPDRRQLLAGATLLLGASHWPVFASTDAIEPQPYFASVKRAVEQLAAMGQPIADADMARLASLFSREDAEAVIAAEALLERYTLARVTLDKGGMGAAALGGAKRHLVEQGWTAFLVRVSNPSSLTQAFEIYSGSAMPARMFPQASKFAAEQKAYLADTVRKEALIERMWLMSQIEASPVLSGNVVEYKIATIYSRDRGRKTGRLGFGAGILQDNPTWGAVSRASVANPLVTDFVSQPSRDIQLQILDDDGVGCMASLMIHDANKHIYPPQVMRLAPDLAFQPHIYRADGETVRLPDGEYHIMVRRGPEYLVQRATVRVSASDARIAVRLKRWIDPAKWGWYSGDTHLHAAGCAHYMLPTEGVAPETMIRHIRGEALSVGEVLTWAGGYSYQKQFFSGAAISPEARLEHPQLQAANNADWKPMPTPKDRESMLRYDLEISGFPSSLSGHLILMRLKELSYPGTHAVEDWPSWNLPVAKWAKAQGALVGYTHCSFGMIVGTNALPNYEIPTFNSVGTNEAIVGVTHGAVDFLAGCNGPPAAELNAWYHLLNCGYTLMMAGETDYPCIVPSVDSRPGIGRTYVKLPQRPVDDAGYSAWVDGLENGHLYWGDGRTHFLHFTVNGRESGKQPLAFVRASNVRVSATIAAMLELTPSPETVQNASEEPWHIEHARIGNSRKVAVELIVNGVAVKRQEMLADGSLQQISFKEKIDRSSWIAMRVLGSGHTYPVFVTIGNKPIRASRRSAEWLRTCVDALWNEKHSLIRDTELADAAAAYDHARQTYDRIIAESDLT,brenda,Q8RR61,CN=C(O)Oc1cccc2c1OC(C)(C)C2.O>>CC1(C)Cc2cccc(O)c2O1.CN.O=C=O,0.7,0.0,45.0,9.0,3.5.1.137,168685.0,-0.1549019599857432,CN=C(O)Oc1cccc2c1OC(C)(C)C2.O,CC1(C)Cc2cccc(O)c2O1.CN.O=C=O,-0.1549019599857432,CN=C(O)Oc1cccc2c1OC(C)(C)C2.O__MDQPFKPDRRQLLAGATLLLGASHWPVFASTDAIEPQPYFASVKRAVEQLAAMGQPIADADMARLASLFSREDAEAVIAAEALLERYTLARVTLDKGGMGAAALGGAKRHLVEQGWTAFLVRVSNPSSLTQAFEIYSGSAMPARMFPQASKFAAEQKAYLADTVRKEALIERMWLMSQIEASPVLSGNVVEYKIATIYSRDRGRKTGRLGFGAGILQDNPTWGAVSRASVANPLVTDFVSQPSRDIQLQILDDDGVGCMASLMIHDANKHIYPPQVMRLAPDLAFQPHIYRADGETVRLPDGEYHIMVRRGPEYLVQRATVRVSASDARIAVRLKRWIDPAKWGWYSGDTHLHAAGCAHYMLPTEGVAPETMIRHIRGEALSVGEVLTWAGGYSYQKQFFSGAAISPEARLEHPQLQAANNADWKPMPTPKDRESMLRYDLEISGFPSSLSGHLILMRLKELSYPGTHAVEDWPSWNLPVAKWAKAQGALVGYTHCSFGMIVGTNALPNYEIPTFNSVGTNEAIVGVTHGAVDFLAGCNGPPAAELNAWYHLLNCGYTLMMAGETDYPCIVPSVDSRPGIGRTYVKLPQRPVDDAGYSAWVDGLENGHLYWGDGRTHFLHFTVNGRESGKQPLAFVRASNVRVSATIAAMLELTPSPETVQNASEEPWHIEHARIGNSRKVAVELIVNGVAVKRQEMLADGSLQQISFKEKIDRSSWIAMRVLGSGHTYPVFVTIGNKPIRASRRSAEWLRTCVDALWNEKHSLIRDTELADAAAAYDHARQTYDRIIAESDLT,./data/raw/alphafold//AF-Q8RR61-F1-model_v4.pdb,3463,3371,1092,3008
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+1748,8053,8181,MLEISKVTPKAPPRYGWMNGQCIPWDQCSLHVSTQAAFFGASLFEGVRAYWNAEREQLYVFRLDEHLRRLEQSAKMLRMKLSMPIADIRQGVLELLRANEFRSDVHLYVASYFGINHDPDPLFPTDDTGVYVTGTAVSRLPLVHTGISACMSSWRRISDDSVPPRIKIGANYQNSRLAQTEARVNGYHTSVLLNSRGKVSETPGACLLMVRDGRVISPPVTADILESVTRKTLMSLSEAELDSPVIERDMDRTELYIAEEVFLCGTIAEILPVTTIDRIQVGDGEVGPVTRRLQELYFGVTSGQLEAYKSWLLPVYE,brenda,D0LR31,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,0.24,0.0,25.0,10.0,2.6.1.42,80816.0,-0.619788758288394,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,-0.619788758288394,CC[C@H](C)[C@H](N)C(=O)O.O=C(O)CC(=O)C(=O)O__MLEISKVTPKAPPRYGWMNGQCIPWDQCSLHVSTQAAFFGASLFEGVRAYWNAEREQLYVFRLDEHLRRLEQSAKMLRMKLSMPIADIRQGVLELLRANEFRSDVHLYVASYFGINHDPDPLFPTDDTGVYVTGTAVSRLPLVHTGISACMSSWRRISDDSVPPRIKIGANYQNSRLAQTEARVNGYHTSVLLNSRGKVSETPGACLLMVRDGRVISPPVTADILESVTRKTLMSLSEAELDSPVIERDMDRTELYIAEEVFLCGTIAEILPVTTIDRIQVGDGEVGPVTRRLQELYFGVTSGQLEAYKSWLLPVYE,./data/raw/alphafold//AF-D0LR31-F1-model_v4.pdb,1807,1485,3055,1805
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+1767,15779,16006,MDERDALRISREIAGEVRKAIASMPLRERVKDVGMGKDGTPTKAADRVAEDAALEILRKERVTVVTEESGVLGEGDVFVALDPLDGTFNATRGIPVYSVSLCFSYSDKLKDAFFGYVYNLATGDEYYADSSGAYRNGERIEVSDAEELYCNAIIYYPDRKFPFKRMRIFGSAATELCFFADGSFDCFLDIRPGKMLRIYDAAAGVFIAEKAGGKVTELDGESLGNKKFDMQERLNIVAANEKLHPKLLELIK,sabio,O30298,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,26.3,7.450653382058689e-15,85.0,8.5,3.1.3.108,2234.0,1.4199557484897578,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,1.4199557484897578,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__MDERDALRISREIAGEVRKAIASMPLRERVKDVGMGKDGTPTKAADRVAEDAALEILRKERVTVVTEESGVLGEGDVFVALDPLDGTFNATRGIPVYSVSLCFSYSDKLKDAFFGYVYNLATGDEYYADSSGAYRNGERIEVSDAEELYCNAIIYYPDRKFPFKRMRIFGSAATELCFFADGSFDCFLDIRPGKMLRIYDAAAGVFIAEKAGGKVTELDGESLGNKKFDMQERLNIVAANEKLHPKLLELIK,./data/raw/alphafold//AF-O30298-F1-model_v4.pdb,3764,4551,4476,4373
+1768,17075,17305,MRIGEWMRGLLLCAGLMMCGAVHADISTVPDETYDALKLDRGKATPKETYEALVKRYKDPAHGAGKGTMGDYWEPIAISIYMDPNTFYKPPVSPKEVAERKDCVECHSDETPVWVRAWKRSTHANLDKIRNLKSDDPLYYKKGKLEEVENNLRSMGKLGEKETLKEVGCIDCHVDVNKKDKADHTKDIRMPTADTCGTCHLREFAERESERDTMVWPNGQWPAGRPSHALDYTANIETTVWAAMPQREVAEGCTMCHTNQNKCDNCHTRHEFSAAESRKPEACATCHSGVDHNNWEAYTMSKHGKLAEMNRDKWNWEVRLKDAFSKGGQNAPTCAACHMEYEGEYTHNITRKTRWANYPFVPGIAENITSDWSEARLDSWVLTCTQCHSERFARSYLDLMDKGTLEGLAKYQEANAIVHKMYEDGTLTGQKTNRPNPPEPEKPGFGIFTQLFWSKGNNPASLELKVLEMAENNLAKMHVGLAHVNPGGWTYTEGWGPMNRAYVEIQDEYTKMQELSALQARVNKLEGKQTSLLDLKGTGEKISLGGLGGGMLLAGALALIGWRKRKQTRA,uniprot_search,A0A837WZA5,NO.O=O>>O.O=N[O-],383.0,0.775098425196847,25.0,10.0,1.7.2.6,915.0,2.583198773968623,NO.O=O,O.O=N[O-],2.583198773968623,NO.O=O__MRIGEWMRGLLLCAGLMMCGAVHADISTVPDETYDALKLDRGKATPKETYEALVKRYKDPAHGAGKGTMGDYWEPIAISIYMDPNTFYKPPVSPKEVAERKDCVECHSDETPVWVRAWKRSTHANLDKIRNLKSDDPLYYKKGKLEEVENNLRSMGKLGEKETLKEVGCIDCHVDVNKKDKADHTKDIRMPTADTCGTCHLREFAERESERDTMVWPNGQWPAGRPSHALDYTANIETTVWAAMPQREVAEGCTMCHTNQNKCDNCHTRHEFSAAESRKPEACATCHSGVDHNNWEAYTMSKHGKLAEMNRDKWNWEVRLKDAFSKGGQNAPTCAACHMEYEGEYTHNITRKTRWANYPFVPGIAENITSDWSEARLDSWVLTCTQCHSERFARSYLDLMDKGTLEGLAKYQEANAIVHKMYEDGTLTGQKTNRPNPPEPEKPGFGIFTQLFWSKGNNPASLELKVLEMAENNLAKMHVGLAHVNPGGWTYTEGWGPMNRAYVEIQDEYTKMQELSALQARVNKLEGKQTSLLDLKGTGEKISLGGLGGGMLLAGALALIGWRKRKQTRA,./data/raw/alphafold//AF-A0A837WZA5-F1-model_v4.pdb,1071,636,312,346
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+1771,9812,9961,MRKSPGVTFSVLNLDLWIAHCSSDDHSEMRAGNNDKVIQTAQVFEPGKGVKGLEVTEDHWKLQCNVMVEVWTYNGRNDGPEIEVRRGDRVIILNKNDLNHPKTLHVHGEPVPNDMDGLPGNTQEAIDPGNNETYEEANNLPGTYWYHSHQDPNTWIDRGLYGHDIVEPWDKEDYDTDFNPVGDERNHMNRGIQDDLSEMDHGDMRHTGNDGMEHASMDNEMYDPFLINGKWPDGLEAIRVRRGEDVELREVNAGPETQHNHILAHELKVSNPDGQPLNTPDFVRDTAQPIAPHERYDYEGLNDRPGRWVYRDSNEPRQYDIPAILDEVGSKLPREDDPLTDNLSREEDNTTYGRDKDPSTLNATDEYEMTLSPEEDNGVETINGKLFPNDELNEVDDRDKLKANFINHGDFDHPMHLHGPFFRVPSDDGKNIPGSPWKKDTLNIDPGESYEWLFDRTNPGIWMFHCHDIHHASNTMVDETDYDEFDILHNPRPEIPNMPD,sabio,C9E886,COc1cccc(OC)c1O.O=O>>O,96.25,81.95225608983418,55.0,7.5,1.10.3.2,2725.0,1.9834007381805383,COc1cccc(OC)c1O.O=O,O,1.9836713828601968,COc1cccc(OC)c1O.O=O__MRKSPGVTFSVLNLDLWIAHCSSDDHSEMRAGNNDKVIQTAQVFEPGKGVKGLEVTEDHWKLQCNVMVEVWTYNGRNDGPEIEVRRGDRVIILNKNDLNHPKTLHVHGEPVPNDMDGLPGNTQEAIDPGNNETYEEANNLPGTYWYHSHQDPNTWIDRGLYGHDIVEPWDKEDYDTDFNPVGDERNHMNRGIQDDLSEMDHGDMRHTGNDGMEHASMDNEMYDPFLINGKWPDGLEAIRVRRGEDVELREVNAGPETQHNHILAHELKVSNPDGQPLNTPDFVRDTAQPIAPHERYDYEGLNDRPGRWVYRDSNEPRQYDIPAILDEVGSKLPREDDPLTDNLSREEDNTTYGRDKDPSTLNATDEYEMTLSPEEDNGVETINGKLFPNDELNEVDDRDKLKANFINHGDFDHPMHLHGPFFRVPSDDGKNIPGSPWKKDTLNIDPGESYEWLFDRTNPGIWMFHCHDIHHASNTMVDETDYDEFDILHNPRPEIPNMPD,./data/raw/alphafold//AF-C9E886-F1-model_v4.pdb,3579,2302,1010,2905
+1772,22107,22440,MKSFWTLAFYLGNANAVAISQPASKAETPEGSLQFLSLRASAPIGTAINRDKWKVTCDSQHQGDECSKAIDGDRNTFWHTNWAAGATNDPKPPHTITIDMGSSQNVNGLSVLPRQDGSDHGWIGRHNVFLSTDGKNWGNAVATGTWFADITEKYSNFETRPARYVRLVAVTEANDQPWTSIAEINVFNAASYTSPQPGLGLWGPTLDFPIVPVAAAVEPTSGKVLVWSSYKNDAFGGSPGGVTLTSTWDPSTGVISQRTVTVTKHDMFCPGISMDGNGQVVVTGGNNAEKTSLYDSSSDSWIPGPDMKVARGYQFSATLSNGRVFTIGGSWSGGTFEKNGEVYDPSSKTWTSLPGALVKPMLTADQQGIYRSDNHGWLFGWKKGSVFQAGPSTAMNWYYTSGKGNTKSAGKRQSSRGTDPDAMCGNAVMYDAVKGKILTFGGSPSYQDSDATTNAHIITIGEPGSTPKTVFASNGLYYPRTFHTSVILPDGNVFITGGQQRGIPFADSTPQLTPELYVPNDDTFYKQQPNSIVRVYHSISLLLPDGRVFNGGGGLCGDCSTNHFDAQIYTPNNLYDSNGKLATRPKITNVSAKSAKVGGKITISTDTSIKQASLIRYGTSTHTVNTDQRRIPLSLRSTGSGNSYSFQVPSDSGIALPGYWMLFVMNSAGVPSIASTLLVTQ,brenda,A0A0U1YLU5,O=O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O>>O=C[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O.OO,12243.0,0.0,,,1.1.3.9,42677.0,4.087887849492933,O=O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O,O=C[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O.OO,4.087887849492933,O=O.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O__MKSFWTLAFYLGNANAVAISQPASKAETPEGSLQFLSLRASAPIGTAINRDKWKVTCDSQHQGDECSKAIDGDRNTFWHTNWAAGATNDPKPPHTITIDMGSSQNVNGLSVLPRQDGSDHGWIGRHNVFLSTDGKNWGNAVATGTWFADITEKYSNFETRPARYVRLVAVTEANDQPWTSIAEINVFNAASYTSPQPGLGLWGPTLDFPIVPVAAAVEPTSGKVLVWSSYKNDAFGGSPGGVTLTSTWDPSTGVISQRTVTVTKHDMFCPGISMDGNGQVVVTGGNNAEKTSLYDSSSDSWIPGPDMKVARGYQFSATLSNGRVFTIGGSWSGGTFEKNGEVYDPSSKTWTSLPGALVKPMLTADQQGIYRSDNHGWLFGWKKGSVFQAGPSTAMNWYYTSGKGNTKSAGKRQSSRGTDPDAMCGNAVMYDAVKGKILTFGGSPSYQDSDATTNAHIITIGEPGSTPKTVFASNGLYYPRTFHTSVILPDGNVFITGGQQRGIPFADSTPQLTPELYVPNDDTFYKQQPNSIVRVYHSISLLLPDGRVFNGGGGLCGDCSTNHFDAQIYTPNNLYDSNGKLATRPKITNVSAKSAKVGGKITISTDTSIKQASLIRYGTSTHTVNTDQRRIPLSLRSTGSGNSYSFQVPSDSGIALPGYWMLFVMNSAGVPSIASTLLVTQ,./data/raw/alphafold//AF-A0A0U1YLU5-F1-model_v4.pdb,3562,3520,5908,6822
+1773,20273,20568,MTKTLPKDFIFGGATAAYQAEGATHTDGKGPVAWDKYLEDNYWYTAEPASDFYHKYPVDLELAEEYGVNGIRISIAWSRIFPTGYGEVNEKGVEFYHKLFAECHKRHVEPFVTLHHFDTPEALHSNGDFLNRENIEHFIDYAAFCFEEFPEVNYWTTFNEIGPIGDGQYLVGKFPPGIKYDLAKVFQSHHNMMVSHARAVKLYKDKGYKGEIGVVHALPTKYPYDPENPADVRAAELEDIIHNKFILDATYLGHYSDKTMEGVNHILAENGGELDLRDEDFQALDAAKDLNDFLGINYYMSDWMQAFDGETEIIHNGKGEKGSSKYQIKGVGRRVAPDYVPRTDWDWIIYPEGLYDQIMRVKNDYPNYKKIYITENGLGYKDEFVDNTVYDDGRIDYVKQHLEVLSDAIADGANVKGYFIWSLMDVFSWSNGYEKRYGLFYVDFDTQERYPKKSAHWYKKLAETQVIE,sabio,P11546,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,0.1596,0.0,22.0,7.5,3.2.1.85,1360.0,-0.7969671129852894,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,-0.7969671129852894,O.O=[N+]([O-])c1ccccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O__MTKTLPKDFIFGGATAAYQAEGATHTDGKGPVAWDKYLEDNYWYTAEPASDFYHKYPVDLELAEEYGVNGIRISIAWSRIFPTGYGEVNEKGVEFYHKLFAECHKRHVEPFVTLHHFDTPEALHSNGDFLNRENIEHFIDYAAFCFEEFPEVNYWTTFNEIGPIGDGQYLVGKFPPGIKYDLAKVFQSHHNMMVSHARAVKLYKDKGYKGEIGVVHALPTKYPYDPENPADVRAAELEDIIHNKFILDATYLGHYSDKTMEGVNHILAENGGELDLRDEDFQALDAAKDLNDFLGINYYMSDWMQAFDGETEIIHNGKGEKGSSKYQIKGVGRRVAPDYVPRTDWDWIIYPEGLYDQIMRVKNDYPNYKKIYITENGLGYKDEFVDNTVYDDGRIDYVKQHLEVLSDAIADGANVKGYFIWSLMDVFSWSNGYEKRYGLFYVDFDTQERYPKKSAHWYKKLAETQVIE,./data/raw/alphafold//AF-P11546-F1-model_v4.pdb,220,2738,5050,5907
+1774,579,598,MQTIPSTTETAADFDAVIXGAGFXGLYALHR,sabio,P82679,C=C(C)[C@H]1CC[C@@](C)(O)C(=O)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]>>C=C(C)C(CCC(C)=O)CC(=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,4.9,0.0532396428296045,30.0,9.5,1.14.13.105,1833.0,0.6901960800285137,C=C(C)[C@H]1CC[C@@](C)(O)C(=O)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],C=C(C)C(CCC(C)=O)CC(=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,0.6901960800285137,C=C(C)[C@H]1CC[C@@](C)(O)C(=O)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]__MQTIPSTTETAADFDAVIXGAGFXGLYALHR,./data/raw/esmfold//ESMFold-P82679-v1.pdb,1086,656,338,382
+1775,11840,11998,MKRLVCVLLVCSSAVAQLHKDPTLDHHWHLWKKTYGKQYKEKNEEAVRRLIWEKNLKFVMLHNLEHSMGMHSYDLGMNHLGDMTSEEVMSLMSSLRVPSQWQRNITYKSNPNRILPDSVDWREKGCVTEVKYQGSCGACWAFSAVGALEAQLKLKTGKLVSLSAQNLVDCSTEKYGNKGCNGGFMTTAFQYIIDNKGIDSDASYPYKAMDQKCQYDSKYRAATCSKYTELPYGREDVLKEAVANKGPVSVGVDARHPSFFLYRSGVYYEPSCTQNVNHGVLVVGYGDLNGKEYWLVKNSWGHNFGEEGYIRMARNKGNHCGIASFPSYPEI,uniprot_search,P25774,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)ccc12,21.0,1.6662514634022145e-14,25.0,5.75,3.4.22.27,9606.0,1.3222192947339193,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)ccc12,1.3222192947339193,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__MKRLVCVLLVCSSAVAQLHKDPTLDHHWHLWKKTYGKQYKEKNEEAVRRLIWEKNLKFVMLHNLEHSMGMHSYDLGMNHLGDMTSEEVMSLMSSLRVPSQWQRNITYKSNPNRILPDSVDWREKGCVTEVKYQGSCGACWAFSAVGALEAQLKLKTGKLVSLSAQNLVDCSTEKYGNKGCNGGFMTTAFQYIIDNKGIDSDASYPYKAMDQKCQYDSKYRAATCSKYTELPYGREDVLKEAVANKGPVSVGVDARHPSFFLYRSGVYYEPSCTQNVNHGVLVVGYGDLNGKEYWLVKNSWGHNFGEEGYIRMARNKGNHCGIASFPSYPEI,./data/raw/alphafold//AF-P25774-F1-model_v4.pdb,1940,2205,3892,1961
+1776,9765,9913,MSIVNESGSQPVVSRDETLSQIERTSFHISSGKDISLEEIARAARDHQPVTLHDEVVNRVTRSRSILESMVSDERVIYGVNTSMGGFVNYIVPIAKASELQNNLINAVATNVGKYFDDTTVRATMLARIVSLSRGNSAISIVNFKKLIEIYNQGIVPCIPEKGSLGTSGDLGPLAAIALVCTGQWKARYQGEQMSGAMALEKAGISPMELSFKEGLALINGTSAMVGLGVLLYDEVKRLFDTYLTVTSLSIEGLHGKTKPFEPAVHRMKPHQGQLEVATTIWETLADSSLAVNEHEVEKLIAEEMDGLVKASNHQIEDAYSIRCTPQILGPVADTLKNIKQTLTNELNSSNDNPLIDQTTEEVFHNGHFHGQYVSMAMDHLNIALVTMMNLANRRIDRFMDKSNSNGLPPFLCAENAGLRLGLMGGQFMTASITAESRASCMPMSIQSLSTTGDFQDIVSFGLVAARRVREQLKNLKYVFSFELLCACQAVDIRGTAGLSKRTRALYDKTRTLVPYLEEDKTISDYIESIAQTVLTKNSDI,brenda,Q84FL5,COc1cccc(C[C@H](N)C(=O)O)c1>>COc1cccc([C@@H](N)CC(=O)O)c1,0.209,7.260882859625589e-15,31.0,8.0,5.4.3.11,549.0,-0.679853713888946,COc1cccc(C[C@H](N)C(=O)O)c1,COc1cccc([C@@H](N)CC(=O)O)c1,-0.679853713888946,COc1cccc(C[C@H](N)C(=O)O)c1__MSIVNESGSQPVVSRDETLSQIERTSFHISSGKDISLEEIARAARDHQPVTLHDEVVNRVTRSRSILESMVSDERVIYGVNTSMGGFVNYIVPIAKASELQNNLINAVATNVGKYFDDTTVRATMLARIVSLSRGNSAISIVNFKKLIEIYNQGIVPCIPEKGSLGTSGDLGPLAAIALVCTGQWKARYQGEQMSGAMALEKAGISPMELSFKEGLALINGTSAMVGLGVLLYDEVKRLFDTYLTVTSLSIEGLHGKTKPFEPAVHRMKPHQGQLEVATTIWETLADSSLAVNEHEVEKLIAEEMDGLVKASNHQIEDAYSIRCTPQILGPVADTLKNIKQTLTNELNSSNDNPLIDQTTEEVFHNGHFHGQYVSMAMDHLNIALVTMMNLANRRIDRFMDKSNSNGLPPFLCAENAGLRLGLMGGQFMTASITAESRASCMPMSIQSLSTTGDFQDIVSFGLVAARRVREQLKNLKYVFSFELLCACQAVDIRGTAGLSKRTRALYDKTRTLVPYLEEDKTISDYIESIAQTVLTKNSDI,./data/raw/alphafold//AF-Q84FL5-F1-model_v4.pdb,2803,2376,1300,3251
+1777,18191,18447,MSLSNKLTLDKLDVKGKRVVMRVDFNVPMKNNQITNNQRIKAAVPSIKFCLDNGAKSVVLMSHLGRPDGVPMPDKYSLEPVAVELKSLLGKDVLFLKDCVGPEVEKACANPAAGSVILLENLRFHVEEEGKGKDASGNKVKAEPAKIEAFRASLSKLGDVYVNDAFGTAHRAHSSMVGVNLPQKAGGFLMKKELNYFAKALESPERPFLAILGGAKVADKIQLINNMLDKVNEMIIGGGMAFTFLKVLNNMEIGTSLFDEEGAKIVKDLMSKAEKNGVKITLPVDFVTADKFDENAKTGQATVASGIPAGWMGLDCGPESSKKYAEAVTRAKQIVWNGPVGVFEWEAFARGTKALMDEVVKATSRGCITIIGGGDTATCCAKWNTEDKVSHVSTGGGASLELLEGKVLPGVDALSNI,sabio,P00558,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=C(O)C(O)COP(=O)(O)O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=C(OP(=O)(O)O)C(O)COP(=O)(O)O,54.0,0.0,37.0,7.5,2.7.2.3,9606.0,1.7323937598229686,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=C(O)C(O)COP(=O)(O)O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=C(OP(=O)(O)O)C(O)COP(=O)(O)O,1.7323937598229686,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=C(O)C(O)COP(=O)(O)O__MSLSNKLTLDKLDVKGKRVVMRVDFNVPMKNNQITNNQRIKAAVPSIKFCLDNGAKSVVLMSHLGRPDGVPMPDKYSLEPVAVELKSLLGKDVLFLKDCVGPEVEKACANPAAGSVILLENLRFHVEEEGKGKDASGNKVKAEPAKIEAFRASLSKLGDVYVNDAFGTAHRAHSSMVGVNLPQKAGGFLMKKELNYFAKALESPERPFLAILGGAKVADKIQLINNMLDKVNEMIIGGGMAFTFLKVLNNMEIGTSLFDEEGAKIVKDLMSKAEKNGVKITLPVDFVTADKFDENAKTGQATVASGIPAGWMGLDCGPESSKKYAEAVTRAKQIVWNGPVGVFEWEAFARGTKALMDEVVKATSRGCITIIGGGDTATCCAKWNTEDKVSHVSTGGGASLELLEGKVLPGVDALSNI,./data/raw/alphafold//AF-P00558-F1-model_v4.pdb,46,2473,2756,3921
+1778,16474,16702,MNHIHEHLKLVPVDKIDLHETFEPLRLEKTKSSIEADDFIRHPILVTAMQHGRYMVIDGVHRYTSLKALGCKKVPVQEIHETQYSISTWQHKVPFGVWWETLQQEHRLPWTTETRQEAPFITMCHGDTEQYLYTKDLGEAHFQVWEKVVASYSGCCSVERIAQGTYPCLSQQDVLMKYQPLSYKEIEAVVHKGETVPAGVTRFNISGRCLNLQVPLALLKQDDDVEQLRNWKQFLADKFANMRCYTEKVYLVEQ,sabio,Q2G1M5,NC(CO)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>NC(COP(=O)(O)O)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,234.0,0.0,22.0,,2.7.1.225,1280.0,2.369215857410143,NC(CO)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,NC(COP(=O)(O)O)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,2.9334872878487053,NC(CO)C(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MNHIHEHLKLVPVDKIDLHETFEPLRLEKTKSSIEADDFIRHPILVTAMQHGRYMVIDGVHRYTSLKALGCKKVPVQEIHETQYSISTWQHKVPFGVWWETLQQEHRLPWTTETRQEAPFITMCHGDTEQYLYTKDLGEAHFQVWEKVVASYSGCCSVERIAQGTYPCLSQQDVLMKYQPLSYKEIEAVVHKGETVPAGVTRFNISGRCLNLQVPLALLKQDDDVEQLRNWKQFLADKFANMRCYTEKVYLVEQ,./data/raw/alphafold//AF-Q2G1M5-F1-model_v4.pdb,2669,5183,2330,5225
+1779,21421,21745,MPPYTVVYFPVRGRCAALRMLLADQGQSWKEEVVTVETWQEGSLKASCLYGQLPKFQDGDLTLYQSNTILRHLGRTLGLYGKDQQEAALVDMVNDGVEDLRCKYISLIYTNYEAGKDDYVKALPGQLKPFETLLSQNQGGKTFIVGDQISFADYNLLDLLLIHEVLAPGCLDAFPLLSAYVGRLSARPKLKAFLASPEYVNLPINGNGKQ,brenda,P09211,O=C(O)CN=C(O)[C@H](CS)N=C(O)[C@@H]1Cc2ccccc2CN1.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1>>,0.31,99.8151413983444,25.0,7.4,2.5.1.18,9606.0,-0.5086383061657274,O=C(O)CN=C(O)[C@H](CS)N=C(O)[C@@H]1Cc2ccccc2CN1.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1,,-0.5086383061657274,O=C(O)CN=C(O)[C@H](CS)N=C(O)[C@@H]1Cc2ccccc2CN1.O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1__MPPYTVVYFPVRGRCAALRMLLADQGQSWKEEVVTVETWQEGSLKASCLYGQLPKFQDGDLTLYQSNTILRHLGRTLGLYGKDQQEAALVDMVNDGVEDLRCKYISLIYTNYEAGKDDYVKALPGQLKPFETLLSQNQGGKTFIVGDQISFADYNLLDLLLIHEVLAPGCLDAFPLLSAYVGRLSARPKLKAFLASPEYVNLPINGNGKQ,./data/raw/alphafold//AF-P09211-F1-model_v4.pdb,3474,1331,6256,1601
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+1787,7375,7497,MESQVRGGTRWKRFAVVMVPSVAATAAIGVALAQGALAASFSVSGQSFKVTAQELNGTGFSQYGAIDQGYTLSGEKTAHPVAVSVFDTARIQKMCQSVVTPNIPLLGSVSLTLTAGDSADPEKQVNAKNLYIDVEDLGADAEFTNIDIGVAGKDISQGPGMKAGEVQKKQANPYGFAQQAEKAKLTDVKQTAWATTAGTFKLPGLKMKLQTGTHECY,sabio,Q2AAT6,CCCCCCCCCCCCCCCC(=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.CCCCCCCCCCCCCCCC(=O)O,96.7,0.0,37.0,7.0,3.1.1.13,1931.0,1.9854264740830017,CCCCCCCCCCCCCCCC(=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.CCCCCCCCCCCCCCCC(=O)O,1.9854264740830017,CCCCCCCCCCCCCCCC(=O)OC1CCC2(C)C(=CCC3C2CCC2(C)C(C(C)CCCC(C)C)CCC32)C1.O__MESQVRGGTRWKRFAVVMVPSVAATAAIGVALAQGALAASFSVSGQSFKVTAQELNGTGFSQYGAIDQGYTLSGEKTAHPVAVSVFDTARIQKMCQSVVTPNIPLLGSVSLTLTAGDSADPEKQVNAKNLYIDVEDLGADAEFTNIDIGVAGKDISQGPGMKAGEVQKKQANPYGFAQQAEKAKLTDVKQTAWATTAGTFKLPGLKMKLQTGTHECY,./data/raw/alphafold//AF-Q2AAT6-F1-model_v4.pdb,3268,2100,839,1162
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+1789,22807,23149,MNILVTGGAGYIGSHTSLCLLNKGYNVVIIDNLINSSCESIRRIELIAKKKVTFYELNINNEKEVNQILKKHKFDCIMHFAGAKSVAESLIKPIFYYDNNVSGTLQLINCAIKNDVANFIFSSSATVYGESKIMPVTEDCHIGGTLNPYGTSKYISELMIRDIAKKYSDTNFLCLRYFNPTGAHESGMIGESPADIPSNLVPYILQVAMGKLEKLMVFGGDYPTKDGTGVRDYIHVMDLAEGHVAALSYLFRDNNTNYHVFNLGTGKGYSVLELVSTFEKISGVRIPYEIVSRRDGDIAESWSSPEKANKYLNWKAKRELETMLEDAWRWQMKNPNGYI,brenda,Q8L0V2,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,3.335,0.0,37.0,7.0,5.1.3.7,562.0,0.5230958382525678,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,0.5230958382525678,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__MNILVTGGAGYIGSHTSLCLLNKGYNVVIIDNLINSSCESIRRIELIAKKKVTFYELNINNEKEVNQILKKHKFDCIMHFAGAKSVAESLIKPIFYYDNNVSGTLQLINCAIKNDVANFIFSSSATVYGESKIMPVTEDCHIGGTLNPYGTSKYISELMIRDIAKKYSDTNFLCLRYFNPTGAHESGMIGESPADIPSNLVPYILQVAMGKLEKLMVFGGDYPTKDGTGVRDYIHVMDLAEGHVAALSYLFRDNNTNYHVFNLGTGKGYSVLELVSTFEKISGVRIPYEIVSRRDGDIAESWSSPEKANKYLNWKAKRELETMLEDAWRWQMKNPNGYI,./data/raw/alphafold//AF-Q8L0V2-F1-model_v4.pdb,2955,1793,3419,2226
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+1798,7355,7477,MSSMTQNLREVMKVMFKVPGFDRVLEKVTLVSAAPEKLICEMKVEEQHTNKLGTLHGGLTATLVDSISTMALMCTERGAPGVSVDMNITYMSPAKIGEEIVITAHILKQGKTLAFASVDLTNKTTGKLIAQGRHTKHLGN,sabio,Q9CQR4,CCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O.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.CCCCCCCCCCCCCC(=O)O,0.031,1.7114346361254774e-14,25.0,7.2,3.1.2.-,10090.0,-1.5086383061657274,CCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O.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.CCCCCCCCCCCCCC(=O)O,-1.0655015487564323,CCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(O)O.O__MSSMTQNLREVMKVMFKVPGFDRVLEKVTLVSAAPEKLICEMKVEEQHTNKLGTLHGGLTATLVDSISTMALMCTERGAPGVSVDMNITYMSPAKIGEEIVITAHILKQGKTLAFASVDLTNKTTGKLIAQGRHTKHLGN,./data/raw/alphafold//AF-Q9CQR4-F1-model_v4.pdb,1636,1238,1720,1453
+1799,1649,1679,MQDWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRFGGTSAYSGASIWLPGTQVQERAGLPDSTENARTYLRALLGDAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADIGDLAGKVRPELDQDRTGQDHAPGPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDGRVVGAEVESGGETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALLDQAWFCPGVEQPDGSAAFMVGVRGGLVVDSAGERYLNESLPYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTAPAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFCPPNGGANAALTAIENGPFYAARIVLSDLGTKGGLVTDVNGRVLRADGSAIDGLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK,brenda,Q9RA02,CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C>>,20.3,10000000.0,30.0,8.0,1.3.99.4,1833.0,1.307496037913213,CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C,,1.307496037913213,CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C__MQDWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRFGGTSAYSGASIWLPGTQVQERAGLPDSTENARTYLRALLGDAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADIGDLAGKVRPELDQDRTGQDHAPGPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDGRVVGAEVESGGETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALLDQAWFCPGVEQPDGSAAFMVGVRGGLVVDSAGERYLNESLPYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTAPAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFCPPNGGANAALTAIENGPFYAARIVLSDLGTKGGLVTDVNGRVLRADGSAIDGLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK,./data/raw/alphafold//AF-Q9RA02-F1-model_v4.pdb,1436,956,760,1058
+1800,19966,20252,MKSRYLLFFLPLIVAKYTSAATMQPFHSPEESVNSQFYLPPPPGNDDPAFRYDKEAYFKGYAIKGSPRWKQAAEDADISVENIARIFSPVVGAKINPKDTPETWNMLQNLLKMGGYYATASAKKYYMRTRPFVLFNHSTCRPEDENTLRKDGSYPSGHTAYSTLLALVLSQARPERAQELARRGWEFGQSRVICGAHWQSDVDAGRYVGAVEFARLQTIPAFQKSLAKVREELNDKNNLLSKEERPELNY,brenda,Q71EB8,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1>>O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,3.8,0.0,37.0,8.5,3.1.3.2,90371.0,0.5797835966168101,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,1.3473300153169503,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MKSRYLLFFLPLIVAKYTSAATMQPFHSPEESVNSQFYLPPPPGNDDPAFRYDKEAYFKGYAIKGSPRWKQAAEDADISVENIARIFSPVVGAKINPKDTPETWNMLQNLLKMGGYYATASAKKYYMRTRPFVLFNHSTCRPEDENTLRKDGSYPSGHTAYSTLLALVLSQARPERAQELARRGWEFGQSRVICGAHWQSDVDAGRYVGAVEFARLQTIPAFQKSLAKVREELNDKNNLLSKEERPELNY,./data/raw/alphafold//AF-Q71EB8-F1-model_v4.pdb,395,2967,5309,6186
+1801,5110,5196,MVPFSLLRTTRPLQRCGQLVCMAARAQHSEVAQKQAGEAAGGWTGQESLSDSDPEIWELLQREKDRQCRGLELIASENFCSRAALEALGSCLNNKYSEGYPGKRYYGGAEVVDEIELLCQRRALEAFDLDPAQWGVNVQPYSGSPANLAAYTALLQPHDRIMGLDLPDGGHLTHGYMSDVKRISATSIFFESMPYKLNPQTGLIDYDQLALTARLFRPRLIIAGTSAYARLIDYARMREVCDEVKAHLLADMAHISGLVAAKVIPSPFKYADIVTTTTHKTLRGARSGLIFYRKGVRTVDPKTGQEIPYTFEDRINFAVFPSLQGGPHNHAIAAVAVALKQACTPMFREYSLQVLRNAQAMADALLKRGYSLVSGGTDTHLVLVDLRPKGLDGARAERVLELVSITANKNTCPGDRSAITPGGLRLGAPALTSRQFREDDFRRVVDFIDEGVNIGLEVKRKTAKLQDFKSFLLKDPETSQRLANLRQQVEQFARGFPMPGFDER,sabio,Q5U3Z7,CC(O)C(N)C(=O)O>>CC=O.NCC(=O)O,216.0,0.0,37.0,7.2,2.1.2.1,10116.0,2.334453751150931,CC(O)C(N)C(=O)O,CC=O.NCC(=O)O,2.334453751150931,CC(O)C(N)C(=O)O__MVPFSLLRTTRPLQRCGQLVCMAARAQHSEVAQKQAGEAAGGWTGQESLSDSDPEIWELLQREKDRQCRGLELIASENFCSRAALEALGSCLNNKYSEGYPGKRYYGGAEVVDEIELLCQRRALEAFDLDPAQWGVNVQPYSGSPANLAAYTALLQPHDRIMGLDLPDGGHLTHGYMSDVKRISATSIFFESMPYKLNPQTGLIDYDQLALTARLFRPRLIIAGTSAYARLIDYARMREVCDEVKAHLLADMAHISGLVAAKVIPSPFKYADIVTTTTHKTLRGARSGLIFYRKGVRTVDPKTGQEIPYTFEDRINFAVFPSLQGGPHNHAIAAVAVALKQACTPMFREYSLQVLRNAQAMADALLKRGYSLVSGGTDTHLVLVDLRPKGLDGARAERVLELVSITANKNTCPGDRSAITPGGLRLGAPALTSRQFREDDFRRVVDFIDEGVNIGLEVKRKTAKLQDFKSFLLKDPETSQRLANLRQQVEQFARGFPMPGFDER,./data/raw/alphafold//AF-Q5U3Z7-F1-model_v4.pdb,2621,4869,2328,2294
+1802,276,288,MVPLVAVVSGPRAQLFACLLRLGTQQVGPLQLHTGASHAARNHYEVLVLGGGSGGITMAARMKRKVGAENVAIVEPSERHFYQPIWTLVGAGAKQLSSSGRPTASVIPSGVEWIKARVTELNPDKNCIHTDDDEKISYRYLIIALGIQLDYEKIKGLPEGFAHPKIGSNYSVKTVEKTWKALQDFKEGNAIFTFPNTPVKCAGAPQKIMYLSEAYFRKTGKRSKANIIFNTSLGAIFGVKKYADALQEIIQERNLTVNYKKNLIEVRADKQEAVFENLDKPGETQVISYEMLHVTPPMSPPDVLKTSPVADAAGWVDVDKETLQHRRYPNVFGIGDCTNLPTSKTAAAVAAQSGILDRTISVIMKNQTPTKKYDGYTSCPLVTGYNRVILAEFDYKAEPLETFPFDQSKERLSMYLMKADLMPFLYWNMMLRGYWGGPAFLRKLFHLGMS,brenda,Q9Y6N5,C#N.COC1=C(OC)C(=O)C(CC=C(C)C)=C(C)C1=O.[S-2]>>COc1c(O)c(C)c(CC=C(C)C)c(O)c1OC.N#C[S-],360.0,0.1623758420830562,25.0,8.5,1.8.5.4,9606.0,2.556302500767288,C#N.COC1=C(OC)C(=O)C(CC=C(C)C)=C(C)C1=O.[S-2],COc1c(O)c(C)c(CC=C(C)C)c(O)c1OC.N#C[S-],2.561101383649056,C#N.COC1=C(OC)C(=O)C(CC=C(C)C)=C(C)C1=O.[S-2]__MVPLVAVVSGPRAQLFACLLRLGTQQVGPLQLHTGASHAARNHYEVLVLGGGSGGITMAARMKRKVGAENVAIVEPSERHFYQPIWTLVGAGAKQLSSSGRPTASVIPSGVEWIKARVTELNPDKNCIHTDDDEKISYRYLIIALGIQLDYEKIKGLPEGFAHPKIGSNYSVKTVEKTWKALQDFKEGNAIFTFPNTPVKCAGAPQKIMYLSEAYFRKTGKRSKANIIFNTSLGAIFGVKKYADALQEIIQERNLTVNYKKNLIEVRADKQEAVFENLDKPGETQVISYEMLHVTPPMSPPDVLKTSPVADAAGWVDVDKETLQHRRYPNVFGIGDCTNLPTSKTAAAVAAQSGILDRTISVIMKNQTPTKKYDGYTSCPLVTGYNRVILAEFDYKAEPLETFPFDQSKERLSMYLMKADLMPFLYWNMMLRGYWGGPAFLRKLFHLGMS,./data/raw/alphafold//AF-Q9Y6N5-F1-model_v4.pdb,1008,544,200,217
+1803,3148,3190,MQTARLFQGNLNLAAANIRDYEKKEQRNLGVWLSLNQWLRLYDEDTRFWWTTTAPMLGRMMELIGYDQDAQQKHLLFYYIYVLPSLGRRPSPEGYPTGWNSFMTDDYSPLELSWDWGVAEGESSVRFSIEPIGKYAGTQADPLNQKMVYQLVDGLRPAFHHTLDLTLFDVFSEALTTSREKFGTRKLSLEGRSQYFVAFDLDVGHPRLKAYFMPGLKSIESNTPVSELVVKAMDACELHFGSLFMQAFRRLNSDLEAFSATSYHRPEIEIVGIDCVSPVKSRAKIYIRHRGTSFDSVCRMLSMGAKAPLDAASVASLRELWALVLGLPKDFPSDQELPSVPHRTSGVLYYFEIKPTSDAIVPKVYIPVRHYASNDLSIAQGLATYFERRGQTVAAENYVDALSDIFSHRSLDSGLGLHTYISCTFKKTGLSVTSYFNPEIYHPNRYRQ,brenda,Q6Q874,CC(C)=C/C=C/COP(=O)(O)OP(=O)(O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O>>CC(C)=C/C=C/COc1ccc(C[C@H](N)C(=O)O)cc1.O=P(O)(O)OP(=O)(O)O,0.00167,6.262757657843956e-15,35.0,7.5,2.5.1.122,5022.0,-2.7772835288524167,CC(C)=C/C=C/COP(=O)(O)OP(=O)(O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)=C/C=C/COc1ccc(C[C@H](N)C(=O)O)cc1.O=P(O)(O)OP(=O)(O)O,-2.7772835288524167,CC(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
+1804,14986,15197,MEAFLKEFGDYYGYPDGPKNIQEIRDTEFKRLDKGVVYLDHAGSTLYSELQMEYIFKDFTSNVFGNPHSQSDISSATSDLIADARHQVLEYFNASPEDYSCLFTSGATAALKLVGETFPWTQDSNFLYTMENHNSVLGIREYALAQGASACAVDIEEAANQPGQLTNSGPSIKVKHRAVQMRNTSKLQKEESRGNAYNLFAFPSECNFSGLRFNLDLVKLMKENTETVLQGSPFSKSKRWMVLIDAAKGCATLPPDLSEYPADFVVLSFYKLFGYPTGLGALLVRNDAAKLLKKTYFSGGTVAASIADIDFVKRRERVEEFFEDGSASFLSIAAIRHGFKLLKSLTPSAIWMHTTSLSIYVKKKLQALRHGNGAAVCVLYGSENLELSSHKSGPTVTFNLKRPDGSWFGYLEVEKLASLSGIQLRTGCFCNPGACAKYLELSHSELRSNVEAGHICWDDNDVINGKPTGAVRVSFGYMSTFEDAKKFIDFIISSFASPPKKTGNGTVVSGRFPQLPSEDLESKESFPSHYLKSITVYPIKSCAGFSVIRWPLCRTGLLHDREWMVQGLTGEILTQKKVPEMSLIKTFIDLEEGLLSVESSRCEDKLHIRIKSDSYNPRNDEFDSHANILENRNEETRINRWFTNAIGRQCKLLRYSSSTSKDCLNRNKSPGLCRDLESNINFANEAQFLLISEESVADLNRRLEAKDEDYKRAHEKLNPHRFRPNLVISGGEPYGEDKWKTVKIGDNHFTSLGGCNRCQMINISNEAGLVKKSNEPLTTLASYRRVKGKILFGTLLRYEIDEKRQCWIGVGEEVNPDIE,brenda,Q9C5X8,N=c1nc([O-])c2c([nH]1)N[C@@H]1O[C@H](COP(=O)([O-])O)C(S)=C(S)[C@@H]1N2.N[C@@H](CS)C(=O)O.[H+].[Mo+2].[O].[O]>>C[C@H](N)C(=O)O.N=c1nc([O-])c2c([nH]1)N[C@@H]1O[C@H](COP(=O)([O-])O)C(S)=C(S)[C@@H]1N2.O.[Mo+2].[O].[S],0.03,0.0782057369494117,37.0,9.3,2.8.1.9,3702.0,-1.5228787452803376,N=c1nc([O-])c2c([nH]1)N[C@@H]1O[C@H](COP(=O)([O-])O)C(S)=C(S)[C@@H]1N2.N[C@@H](CS)C(=O)O.[H+].[Mo+2].[O].[O],C[C@H](N)C(=O)O.N=c1nc([O-])c2c([nH]1)N[C@@H]1O[C@H](COP(=O)([O-])O)C(S)=C(S)[C@@H]1N2.O.[Mo+2].[O].[S],-1.5228787452803376,N=c1nc([O-])c2c([nH]1)N[C@@H]1O[C@H](COP(=O)([O-])O)C(S)=C(S)[C@@H]1N2.N[C@@H](CS)C(=O)O.[H+].[Mo+2].[O].[O]__MEAFLKEFGDYYGYPDGPKNIQEIRDTEFKRLDKGVVYLDHAGSTLYSELQMEYIFKDFTSNVFGNPHSQSDISSATSDLIADARHQVLEYFNASPEDYSCLFTSGATAALKLVGETFPWTQDSNFLYTMENHNSVLGIREYALAQGASACAVDIEEAANQPGQLTNSGPSIKVKHRAVQMRNTSKLQKEESRGNAYNLFAFPSECNFSGLRFNLDLVKLMKENTETVLQGSPFSKSKRWMVLIDAAKGCATLPPDLSEYPADFVVLSFYKLFGYPTGLGALLVRNDAAKLLKKTYFSGGTVAASIADIDFVKRRERVEEFFEDGSASFLSIAAIRHGFKLLKSLTPSAIWMHTTSLSIYVKKKLQALRHGNGAAVCVLYGSENLELSSHKSGPTVTFNLKRPDGSWFGYLEVEKLASLSGIQLRTGCFCNPGACAKYLELSHSELRSNVEAGHICWDDNDVINGKPTGAVRVSFGYMSTFEDAKKFIDFIISSFASPPKKTGNGTVVSGRFPQLPSEDLESKESFPSHYLKSITVYPIKSCAGFSVIRWPLCRTGLLHDREWMVQGLTGEILTQKKVPEMSLIKTFIDLEEGLLSVESSRCEDKLHIRIKSDSYNPRNDEFDSHANILENRNEETRINRWFTNAIGRQCKLLRYSSSTSKDCLNRNKSPGLCRDLESNINFANEAQFLLISEESVADLNRRLEAKDEDYKRAHEKLNPHRFRPNLVISGGEPYGEDKWKTVKIGDNHFTSLGGCNRCQMINISNEAGLVKKSNEPLTTLASYRRVKGKILFGTLLRYEIDEKRQCWIGVGEEVNPDIE,./data/raw/alphafold//AF-Q9C5X8-F1-model_v4.pdb,2530,4969,2046,4901
+1805,18533,18797,MHKNICIYGGSFDPITYAHEMVLDKISNLNWIHEIWVVICRCRNDKSLTEFHHRHNMFTIIINNSSKIIKSKIFLKDLESHSEMTPTYDLLKTQKELHPNYTFYFGLGSDLICDIFSWDEGEKLVLENAFIIIERGHFKIDESILKKFPKYYLINIPKLSFINFISSSEARKFLTKENDINDIKKYIHPLTIDYIIKYNLYDFN,brenda,Q8IE38,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)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c1>>Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H]([n+]3cccc(C(=O)O)c3)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.082,2.694336089717701e-14,37.0,7.4,2.7.7.1,5833.0,-1.0861861476162833,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)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c1,Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H]([n+]3cccc(C(=O)O)c3)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,-1.0861861476162833,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)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c1__MHKNICIYGGSFDPITYAHEMVLDKISNLNWIHEIWVVICRCRNDKSLTEFHHRHNMFTIIINNSSKIIKSKIFLKDLESHSEMTPTYDLLKTQKELHPNYTFYFGLGSDLICDIFSWDEGEKLVLENAFIIIERGHFKIDESILKKFPKYYLINIPKLSFINFISSSEARKFLTKENDINDIKKYIHPLTIDYIIKYNLYDFN,./data/raw/alphafold//AF-Q8IE38-F1-model_v4.pdb,2319,4657,4685,4515
+1806,18970,19255,MSKCLQQLKRQLQHFGIDGCSLADGDIDYFFTVTGIDRGWGCGWRNIQMLISWLQYTNPNWFKRNFSSGNYEINSLQSLLLSAWMKGIDAEGYAQLGDNLHGKWIGATEVYSLFTGLFVNVALVDFDFRSEASASNALFLYVKKHFESSNDTSNVSPCYLQFQGHSIIIIGFCSSLETLVVLDPDRYQSVQKKFVNIADFNHCYMRKKRSLKFSQFQLVHFKQNIFLNDFSSKLEVRSTRISDF,sabio,O13979,O>>Cc1cc(=O)oc2cc(N)ccc12,7.2,80.93222520880319,30.0,,3.4.19.12,4896.0,0.8573324964312685,O,Cc1cc(=O)oc2cc(N)ccc12,0.8573324964312685,O__MSKCLQQLKRQLQHFGIDGCSLADGDIDYFFTVTGIDRGWGCGWRNIQMLISWLQYTNPNWFKRNFSSGNYEINSLQSLLLSAWMKGIDAEGYAQLGDNLHGKWIGATEVYSLFTGLFVNVALVDFDFRSEASASNALFLYVKKHFESSNDTSNVSPCYLQFQGHSIIIIGFCSSLETLVVLDPDRYQSVQKKFVNIADFNHCYMRKKRSLKFSQFQLVHFKQNIFLNDFSSKLEVRSTRISDF,./data/raw/alphafold//AF-O13979-F1-model_v4.pdb,214,2730,5042,5895
+1807,7685,7809,MSQKLLMSRRATFAAGTAGLVAVAAGVPVAGRAQSQPPLQLPISSEFPFAKRTVEVEGATIAYVDEGSGQPVLFLHGNPTSSYLWRNIIPYVVAAGYRAVAPDLIGMGDSAKPDIEYRLQDHVAYMDGFIDALGLDDMVLVIHDWGSVIGMRHARLNPDRVAAVAFMEALVPPALPMPSYEAMGPQLGPLFRDLRTADVGEKMVLDGNFFVETILPEMGVVRSLSEAEMAAYRAPFPTRQSRLPTLQWPREVPIGGEPAFAEAEVLKNGEWLMASPIPKLLFHAEPGALAPKPVVDYLSENVPNLEVRFVGAGTHFLQEDHPHLIGQGIADWLRRNKPHAS,brenda,Q6DND9,CCCI.O>>CCCO.[I-],0.43,0.2680794025658979,37.0,8.6,3.8.1.5,158786.0,-0.3665315444204134,CCCI.O,CCCO.[I-],-0.3665315444204134,CCCI.O__MSQKLLMSRRATFAAGTAGLVAVAAGVPVAGRAQSQPPLQLPISSEFPFAKRTVEVEGATIAYVDEGSGQPVLFLHGNPTSSYLWRNIIPYVVAAGYRAVAPDLIGMGDSAKPDIEYRLQDHVAYMDGFIDALGLDDMVLVIHDWGSVIGMRHARLNPDRVAAVAFMEALVPPALPMPSYEAMGPQLGPLFRDLRTADVGEKMVLDGNFFVETILPEMGVVRSLSEAEMAAYRAPFPTRQSRLPTLQWPREVPIGGEPAFAEAEVLKNGEWLMASPIPKLLFHAEPGALAPKPVVDYLSENVPNLEVRFVGAGTHFLQEDHPHLIGQGIADWLRRNKPHAS,./data/raw/alphafold//AF-Q6DND9-F1-model_v4.pdb,2119,536,187,202
+1808,19882,20168,MRRSVYLDNTIEFLRGRVYLGAYDYTPEDTDELVFFTVEDAIFYNSFHLDFGPMNIGHLYRFAVIFHEILNDPENANKAVVFYSSASTRQRANAACMLCCYMILVQAWTPHQVLQPLAQVDPPFMPFRDAGYSNADFEITIQDVVYGVWRAKEKGLIDLHSFNLESYEKYEHVEFGDFNVLTPDFIAFASPQEDHPKGYLATKSSHLNQPFKSVLNFFANNNVQLVVRLNSHLYNKKHFEDIGIQHLDLIFEDGTCPDLSIVKNFVGAAETIIKRGGKIAVHCKAGLGRTGCLIGAHLIYTYGFTANECIGFLRFIRPGMVVGPQQHWLYLHQNDFREWKYTTRISLKPSEAIGGLYPLISLEEYRLQKKKLKDDKRVAQNNIEGELRDLTMTPPSNGHGALSARNSSQPSTANNGSNSFKSSAVPQTSPGQPRKGQNGSNTIEDINNNRNPTSHANRKVVIESNNSDDESMQDTNGTSNHYPKVSRKKNDISSASSSRMEDNEPSATNINNAADDTILRQLLPKNRRVTSGRRTTSAAGGIRKISGSIKK,sabio,Q00684,O.O=P(O)(O)Oc1ccc2ccccc2c1>>O=P(O)(O)O.Oc1ccc2ccccc2c1,4.2,1.1712226808920871e-14,30.0,7.0,3.1.3.48,4932.0,0.6232492903979004,O.O=P(O)(O)Oc1ccc2ccccc2c1,O=P(O)(O)O.Oc1ccc2ccccc2c1,0.6232492903979004,O.O=P(O)(O)Oc1ccc2ccccc2c1__MRRSVYLDNTIEFLRGRVYLGAYDYTPEDTDELVFFTVEDAIFYNSFHLDFGPMNIGHLYRFAVIFHEILNDPENANKAVVFYSSASTRQRANAACMLCCYMILVQAWTPHQVLQPLAQVDPPFMPFRDAGYSNADFEITIQDVVYGVWRAKEKGLIDLHSFNLESYEKYEHVEFGDFNVLTPDFIAFASPQEDHPKGYLATKSSHLNQPFKSVLNFFANNNVQLVVRLNSHLYNKKHFEDIGIQHLDLIFEDGTCPDLSIVKNFVGAAETIIKRGGKIAVHCKAGLGRTGCLIGAHLIYTYGFTANECIGFLRFIRPGMVVGPQQHWLYLHQNDFREWKYTTRISLKPSEAIGGLYPLISLEEYRLQKKKLKDDKRVAQNNIEGELRDLTMTPPSNGHGALSARNSSQPSTANNGSNSFKSSAVPQTSPGQPRKGQNGSNTIEDINNNRNPTSHANRKVVIESNNSDDESMQDTNGTSNHYPKVSRKKNDISSASSSRMEDNEPSATNINNAADDTILRQLLPKNRRVTSGRRTTSAAGGIRKISGSIKK,./data/raw/alphafold//AF-Q00684-F1-model_v4.pdb,3163,1957,3601,2435
+1809,11524,11681,MRTLKELERELQPRQHLWYFEYYTGNNVGLFMKMNRVIYSGQSDIQRIDIFENPDLGVVFALDGITMTTEKDEFMYHEMLAHVPMFLHPNPKKVLIIGGGDGGTLREVLKHDSVEKAILCEVDGLVIEAARKYLKQTSCGFDDPRAEIVIANGAEYVRKFKNEFDVIIIDSTDPTAGQGGHLFTEEFYQACYDALKEDGVFSAETEDPFYDIGWFKLAYRRISKVFPITRVYLGFMTTYPSGMWSYTFASKGIDPIKDFDPEKVRKFNKELKYYNEEVHVASFALPNFVKKELGLM,sabio,Q9WZC2,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCN>>CSCC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCNCCCN,0.77,0.1136174069081229,37.0,7.5,2.5.1.16,2336.0,-0.1135092748275181,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCN,CSCC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCNCCCN,1.3560258571931227,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCN__MRTLKELERELQPRQHLWYFEYYTGNNVGLFMKMNRVIYSGQSDIQRIDIFENPDLGVVFALDGITMTTEKDEFMYHEMLAHVPMFLHPNPKKVLIIGGGDGGTLREVLKHDSVEKAILCEVDGLVIEAARKYLKQTSCGFDDPRAEIVIANGAEYVRKFKNEFDVIIIDSTDPTAGQGGHLFTEEFYQACYDALKEDGVFSAETEDPFYDIGWFKLAYRRISKVFPITRVYLGFMTTYPSGMWSYTFASKGIDPIKDFDPEKVRKFNKELKYYNEEVHVASFALPNFVKKELGLM,./data/raw/alphafold//AF-Q9WZC2-F1-model_v4.pdb,3871,3998,1843,3667
+1810,231,243,MSTLEQTIGNTPLVKLQRMGPDNGSEVWLKLEGNNPAGSVKDRAALSMIVEAEKRGEIKPGDVLIEATSGNTGIALAMIAALKGYRMKLLMPDNMSQERRAAMRAYGAELILVTKEQGMEGARDLALEMANRGEGKLLDQFNNPDNPYAHYTTTGPEIWQQTGGRITHFVSSMGTTGTITGVSRFMREQSKPVTIVGLQPEEGSSIPGIRRWPTEYLPGIFNASLVDEVLDIHQRDAENTMRELAVREGIFCGVSSGGAVAGALRVAKANPDAVVVAIICDRGDRYLSTGVFGEEHFSQGAGI,sabio,P16703,*S*.CC(=O)OCC(N)C(=O)O>>CC(=O)O.NC(CS)C(=O)O,353.0,0.5578152237071288,25.0,7.5,2.5.1.47,562.0,2.5477747053878224,*S*.CC(=O)OCC(N)C(=O)O,CC(=O)O.NC(CS)C(=O)O,2.5477747053878224,*S*.CC(=O)OCC(N)C(=O)O__MSTLEQTIGNTPLVKLQRMGPDNGSEVWLKLEGNNPAGSVKDRAALSMIVEAEKRGEIKPGDVLIEATSGNTGIALAMIAALKGYRMKLLMPDNMSQERRAAMRAYGAELILVTKEQGMEGARDLALEMANRGEGKLLDQFNNPDNPYAHYTTTGPEIWQQTGGRITHFVSSMGTTGTITGVSRFMREQSKPVTIVGLQPEEGSSIPGIRRWPTEYLPGIFNASLVDEVLDIHQRDAENTMRELAVREGIFCGVSSGGAVAGALRVAKANPDAVVVAIICDRGDRYLSTGVFGEEHFSQGAGI,./data/raw/alphafold//AF-P16703-F1-model_v4.pdb,1440,960,764,184
+1811,19879,20165,MVTLTFLLSVAYLLSGRVSGAPSSAGSKSCDTVELGYQCSPATSHLWGQYSPFFSLDDELSVSSELPKDCRVTFVQMLSRHGARYPTSSKSKKYKQLVTALQRNATSFKGKFAFLKTYNYTLGADDLTPFGEQQMVNSGIKFYQKYKALARSVVPFIRSSGSDRVIASGEKFIEGFQQAKLADSGATNRAAPVISVIIPESETFNNTLDHSVCTNFEASELGDEVAANFTALFAPAIRARAEKHLPGVKLTDDDVVSLMDMCSFDTVARTSDASQLSPFCALFTHNEWKKYDYLQSLGKYYGYGAGNALGPAQGIGFTNELIARLTRSPVQDHTSTNSTLDSNPATFPLNATIYVDFSHDNGMIPIFFAMGLYNGTEPLSLTSVESTKDSDGYSASWAVPFAARAYFETMQCKSEKEPLVRALINDRVVPLHGCAVDKLGRCKLNDFVEGLSWARSGGNWGECFS,brenda,Q5XNQ9,O.O=P(O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O>>O=P(O)(O)O.O=P(O)(O)OC1C(O)C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1OP(=O)(O)O,102.0,8.377251156637806e-15,58.0,6.375,3.1.3.8,746128.0,2.008600171761917,O.O=P(O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O,O=P(O)(O)O.O=P(O)(O)OC1C(O)C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1OP(=O)(O)O,2.008600171761917,O.O=P(O)(O)O[C@H]1[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1OP(=O)(O)O__MVTLTFLLSVAYLLSGRVSGAPSSAGSKSCDTVELGYQCSPATSHLWGQYSPFFSLDDELSVSSELPKDCRVTFVQMLSRHGARYPTSSKSKKYKQLVTALQRNATSFKGKFAFLKTYNYTLGADDLTPFGEQQMVNSGIKFYQKYKALARSVVPFIRSSGSDRVIASGEKFIEGFQQAKLADSGATNRAAPVISVIIPESETFNNTLDHSVCTNFEASELGDEVAANFTALFAPAIRARAEKHLPGVKLTDDDVVSLMDMCSFDTVARTSDASQLSPFCALFTHNEWKKYDYLQSLGKYYGYGAGNALGPAQGIGFTNELIARLTRSPVQDHTSTNSTLDSNPATFPLNATIYVDFSHDNGMIPIFFAMGLYNGTEPLSLTSVESTKDSDGYSASWAVPFAARAYFETMQCKSEKEPLVRALINDRVVPLHGCAVDKLGRCKLNDFVEGLSWARSGGNWGECFS,./data/raw/alphafold//AF-Q5XNQ9-F1-model_v4.pdb,375,2946,5283,6160
+1812,7194,7316,MIVKPMVRNNICLNAHPQGCKKGVEDQIEYTKKRITAEVKAGAKAPKNVLVLGCSNGYGLASRITAAFGYGAATIGVSFEKAGSETKYGTPGWYNNLAFDEAAKREGLYSVTIDGDAFSDEIKAQVIEEAKKKGIKFDLIVYSLASPVRTDPDTGIMHKSVLKPFGKTFTGKTVDPFTGELKEISAEPANDEEAAATVKVMGGEDWERWIKQLSKEGLLEEGCITLAYSYIGPEATQALYRKGTIGKAKEHLEATAHRLNKENPSIRAFVSVNKGLVTRASAVIPVIPLYLASLFKVMKEKGNHEGCIEQITRLYAERLYRKDGTIPVDEENRIRIDDWELEEDVQKAVSALMEKVTGENAESLTDLAGYRHDFLASNGFDVEGINYEAEVERFDRI,brenda,Q73Q47,CCCCCCCCC/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+]>>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.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)c1,90.0,0.0,27.5,6.2,1.3.1.44,158.0,1.954242509439325,CCCCCCCCC/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+],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.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)c1,1.954242509439325,CCCCCCCCC/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+]__MIVKPMVRNNICLNAHPQGCKKGVEDQIEYTKKRITAEVKAGAKAPKNVLVLGCSNGYGLASRITAAFGYGAATIGVSFEKAGSETKYGTPGWYNNLAFDEAAKREGLYSVTIDGDAFSDEIKAQVIEEAKKKGIKFDLIVYSLASPVRTDPDTGIMHKSVLKPFGKTFTGKTVDPFTGELKEISAEPANDEEAAATVKVMGGEDWERWIKQLSKEGLLEEGCITLAYSYIGPEATQALYRKGTIGKAKEHLEATAHRLNKENPSIRAFVSVNKGLVTRASAVIPVIPLYLASLFKVMKEKGNHEGCIEQITRLYAERLYRKDGTIPVDEENRIRIDDWELEEDVQKAVSALMEKVTGENAESLTDLAGYRHDFLASNGFDVEGINYEAEVERFDRI,./data/raw/alphafold//AF-Q73Q47-F1-model_v4.pdb,3298,596,263,286
+1813,2084,2115,MNIKPASEASLKDWLELRNKLWSDSEASHLQEMHQLLAEKYALQLLAYSDHQAIAMLEASIRFEYVNGTETSPVGFLEGIYVLPAHRRSGVATMLIRQAEVWAKQFSCTEFASDAALDNVISHAMHRSLGFQETEKVVYFSKKID,brenda,Q44057,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]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>>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,0.057,1.5959093626519028e-14,37.0,8.0,2.3.1.82,29430.0,-1.2441251443275083,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]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,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,-1.2441251443275083,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]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__MNIKPASEASLKDWLELRNKLWSDSEASHLQEMHQLLAEKYALQLLAYSDHQAIAMLEASIRFEYVNGTETSPVGFLEGIYVLPAHRRSGVATMLIRQAEVWAKQFSCTEFASDAALDNVISHAMHRSLGFQETEKVVYFSKKID,./data/raw/alphafold//AF-Q44057-F1-model_v4.pdb,1516,1068,895,1230
+1814,11279,11435,MSIIVISGCATGIGAATRKVLEAAGHQIVGIDIRDAEVIADLSTAEGRKQAIADVLAKCSKGMDGLVLCAGLGPQTKVLGNVVSVNYFGATELMDAFLPALKKGHQPAAVVISSVASAHLAFDKNPLALALEAGEEAKARAIVEHAGEQGGNLAYAGSKNALTVAVRKRAAAWGEAGVRLNTIAPGATETPLLQAGLQDPRYGESIAKFVPPMGRRAEPSEMASVIAFLMSPAASYVHGAQIVIDGGIDAVMRPTQF,brenda,P80702,C[C@]12CC[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C=CC[C@@H]12.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[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C=CC[C@@H]12.N=C(O)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+],230.0,6.051124762430781e-15,25.0,10.416666666666666,1.1.1.357,285.0,2.361727836017593,C[C@]12CC[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C=CC[C@@H]12.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[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C=CC[C@@H]12.N=C(O)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+],2.361727836017593,C[C@]12CC[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C=CC[C@@H]12.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__MSIIVISGCATGIGAATRKVLEAAGHQIVGIDIRDAEVIADLSTAEGRKQAIADVLAKCSKGMDGLVLCAGLGPQTKVLGNVVSVNYFGATELMDAFLPALKKGHQPAAVVISSVASAHLAFDKNPLALALEAGEEAKARAIVEHAGEQGGNLAYAGSKNALTVAVRKRAAAWGEAGVRLNTIAPGATETPLLQAGLQDPRYGESIAKFVPPMGRRAEPSEMASVIAFLMSPAASYVHGAQIVIDGGIDAVMRPTQF,./data/raw/alphafold//AF-P80702-F1-model_v4.pdb,2931,1922,3564,2393
+1815,18628,18899,MANNSLEQKAEQVLAPLRLSKEKLQDLSKTFSDELLRGLEMHKRHGLKWVPEECSLRMLDSCVSEIPTGNEKGVFYALDFGGTNVRAVRCELLGGGRIRSQQFLKNLYECGGEIDLMARETSASQLFDVLAGCVGELVEENNEKELLKKKAAKLGFTFSFPCAQRSLNNSVLESWTKGFATGHDTDDPVVGKDVVPLLAAAFARQGLGLECEAVVNDTVGTLLSCAYQKGPGGPPCTVGVILGTGANCCYWEPQAAAFGYRGAVVNVECGNFNKNLPTTPADEAIDNKSPNKKHQLFEKMISGFYLGELVRLLTLEIFGAAAPAKAREEFSFDAKQAAVLAASLMPGKEEDPALASSCKVLLKESWGWDLDAAALKVMRQIGFAVFDRSAALAAVSIAVLVQRTRSLETDGGVTVAVDGSLYVRNEWYGLRIRTFLKELLGEKVDKVFLRAADDGSGKGAAICVAALH,brenda,A0A172WCE4,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]1OC(O)[C@@H](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)OC[C@H]1OC(O)[C@@H](O)[C@@H](O)[C@@H]1O,0.025,8.264070734796279e-15,36.0,9.0,2.7.1.1,5802.0,-1.6020599913279625,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]1OC(O)[C@@H](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)OC[C@H]1OC(O)[C@@H](O)[C@@H](O)[C@@H]1O,-1.6020599913279625,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]1OC(O)[C@@H](O)[C@@H](O)[C@@H]1O__MANNSLEQKAEQVLAPLRLSKEKLQDLSKTFSDELLRGLEMHKRHGLKWVPEECSLRMLDSCVSEIPTGNEKGVFYALDFGGTNVRAVRCELLGGGRIRSQQFLKNLYECGGEIDLMARETSASQLFDVLAGCVGELVEENNEKELLKKKAAKLGFTFSFPCAQRSLNNSVLESWTKGFATGHDTDDPVVGKDVVPLLAAAFARQGLGLECEAVVNDTVGTLLSCAYQKGPGGPPCTVGVILGTGANCCYWEPQAAAFGYRGAVVNVECGNFNKNLPTTPADEAIDNKSPNKKHQLFEKMISGFYLGELVRLLTLEIFGAAAPAKAREEFSFDAKQAAVLAASLMPGKEEDPALASSCKVLLKESWGWDLDAAALKVMRQIGFAVFDRSAALAAVSIAVLVQRTRSLETDGGVTVAVDGSLYVRNEWYGLRIRTFLKELLGEKVDKVFLRAADDGSGKGAAICVAALH,./data/raw/alphafold//AF-A0A172WCE4-F1-model_v4.pdb,66,4258,4139,3993
+1816,22085,22418,MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,sabio,O94219,O=O.OCC=Cc1ccccc1>>O=CC=Cc1ccccc1.OO,65.0,0.0,24.0,6.0,1.1.3.7,5323.0,1.812913356642856,O=O.OCC=Cc1ccccc1,O=CC=Cc1ccccc1.OO,1.812913356642856,O=O.OCC=Cc1ccccc1__MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,./data/raw/alphafold//AF-O94219-F1-model_v4.pdb,1050,3522,1297,300
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+1847,4653,4710,MASKGREGEHPSVTLFRQYLRIRTVQPEPDYGAAVAFLEERARQLGLGCQKVEVVPGHVVTVLTWPGTNPTLSSILLNSHTDVVPVFKEHWSHDPFEGFKDADGYIYGRGAQDMKCVSIQYLEAVRRLKVEGHHFPRTIHMTFVPDEEVGGHQGMELFVKRPEFQALRAGFALDEGLASPTDAFTVFYSERSPWWLRVTSTGKPGHGSRFIEDTAAEKLHKVINSILAFREKEKQRLQSNQLKPGAVTSVNLTMLEGGVAYNVVPATMSACFDFRVAPDVDLKAFEEQLQSWCQAAGEGVTFEFVQKWMETQVTSTDDSDPWWAAFSGVFKDMKLALELEICPASTDARYIRAAGVPALGFSPMNHTPVLLHDHDERLHEAVFLRGVDIYTQLLSALASVPALPSES,brenda,P37111,CC(O)=NC(CCCNC(=N)N)C(=O)O.O>>CC(=O)O.N=C(N)NCCC[C@H](N)C(=O)O,8.53,0.0,25.0,7.4,3.5.1.14,9823.0,0.930949031167523,CC(O)=NC(CCCNC(=N)N)C(=O)O.O,CC(=O)O.N=C(N)NCCC[C@H](N)C(=O)O,0.930949031167523,CC(O)=NC(CCCNC(=N)N)C(=O)O.O__MASKGREGEHPSVTLFRQYLRIRTVQPEPDYGAAVAFLEERARQLGLGCQKVEVVPGHVVTVLTWPGTNPTLSSILLNSHTDVVPVFKEHWSHDPFEGFKDADGYIYGRGAQDMKCVSIQYLEAVRRLKVEGHHFPRTIHMTFVPDEEVGGHQGMELFVKRPEFQALRAGFALDEGLASPTDAFTVFYSERSPWWLRVTSTGKPGHGSRFIEDTAAEKLHKVINSILAFREKEKQRLQSNQLKPGAVTSVNLTMLEGGVAYNVVPATMSACFDFRVAPDVDLKAFEEQLQSWCQAAGEGVTFEFVQKWMETQVTSTDDSDPWWAAFSGVFKDMKLALELEICPASTDARYIRAAGVPALGFSPMNHTPVLLHDHDERLHEAVFLRGVDIYTQLLSALASVPALPSES,./data/raw/alphafold//AF-P37111-F1-model_v4.pdb,2954,1690,3302,2102
+1848,16152,16379,MDLGLAGRRALVTGAGKGIGRSTVLALKAAGAQVVAVSRTREDLDDLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVALLQPFLEVTKEACDTSFNVNLRAVIQVSQIVAKGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKMMALELGPHKIRVNAVNPTVVMTPMGRTNWSDPHKAKAMLDRIPLGKFAEVENVVDTILFLLSNRSGMTTGSTLPVDGGFLAT,sabio,Q91X52,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],55.0,6.956863536773207e-15,25.0,7.0,1.1.1.10,10090.0,1.740362689494244,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],1.740362689494244,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__MDLGLAGRRALVTGAGKGIGRSTVLALKAAGAQVVAVSRTREDLDDLVRECPGVEPVCVDLADWEATEQALSNVGPVDLLVNNAAVALLQPFLEVTKEACDTSFNVNLRAVIQVSQIVAKGMIARGVPGAIVNVSSQASQRALTNHTVYCSTKGALDMLTKMMALELGPHKIRVNAVNPTVVMTPMGRTNWSDPHKAKAMLDRIPLGKFAEVENVVDTILFLLSNRSGMTTGSTLPVDGGFLAT,./data/raw/alphafold//AF-Q91X52-F1-model_v4.pdb,1316,3874,6191,846
+1849,2777,2815,MISIASNSVETQKAADTATNLMPPLINSTSQQNLTKLQPPACTNNIIDSTTATATINHVFRSKLPDIAIPNHLPLHTYCFQNLPEFSDRPCLIVGSTGKSYSFSETHLISQKTGAGLSNLGIQKGDVIMILLQNCAEFVFAFMGASLIGAVTTTANPFYTTAEIFKQVKAANAKLIITQSQYVNKLREHPSSADGADQNNYPKLGEDFKVVTIDDPPENCLHFSVLSEANEKELPDVVIDAEDPVALPFSSGTTGLPKGVILTHKNLVTSVAQQVDGENPNLYLKEDDVVLCVLPLFHIFSFNSVLLCSLRAGAGVLLMHKFEIGTLLELIQRYRVSVAAVVPPLVIALAKNPMVAEFDLSSIRVVLSGAAPLGKELEEALKSRVPQAVLGQGYGMTEAGPVLSMCMAFAKEPMPTKSGSCGTVVRNAELKVLDPETGLSLGYNQPGEICIRGFQIMKGYLNDAAATATTIDTEGWLHTGDVGYVDDDDEVFIVDRVKELIKFKGFQVPPAELESLLISHPSIADAAVVPQRDDAAGEVPVAFVVRSDGLELTEEAVKEFIAKQVVFYKRLHKVHFVHAIPKSASGKILRKDLRAKLATATPPLP,brenda,D5LNB6,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.COc1cc(/C=C/C(=O)O)ccc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>COc1cc(/C=C/C(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2OP(=O)(O)O)ccc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.38,0.0,22.0,7.5,6.2.1.12,36599.0,-0.4202164033831898,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.COc1cc(/C=C/C(=O)O)ccc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O,COc1cc(/C=C/C(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2OP(=O)(O)O)ccc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,-0.4202164033831898,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.COc1cc(/C=C/C(=O)O)ccc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O__MISIASNSVETQKAADTATNLMPPLINSTSQQNLTKLQPPACTNNIIDSTTATATINHVFRSKLPDIAIPNHLPLHTYCFQNLPEFSDRPCLIVGSTGKSYSFSETHLISQKTGAGLSNLGIQKGDVIMILLQNCAEFVFAFMGASLIGAVTTTANPFYTTAEIFKQVKAANAKLIITQSQYVNKLREHPSSADGADQNNYPKLGEDFKVVTIDDPPENCLHFSVLSEANEKELPDVVIDAEDPVALPFSSGTTGLPKGVILTHKNLVTSVAQQVDGENPNLYLKEDDVVLCVLPLFHIFSFNSVLLCSLRAGAGVLLMHKFEIGTLLELIQRYRVSVAAVVPPLVIALAKNPMVAEFDLSSIRVVLSGAAPLGKELEEALKSRVPQAVLGQGYGMTEAGPVLSMCMAFAKEPMPTKSGSCGTVVRNAELKVLDPETGLSLGYNQPGEICIRGFQIMKGYLNDAAATATTIDTEGWLHTGDVGYVDDDDEVFIVDRVKELIKFKGFQVPPAELESLLISHPSIADAAVVPQRDDAAGEVPVAFVVRSDGLELTEEAVKEFIAKQVVFYKRLHKVHFVHAIPKSASGKILRKDLRAKLATATPPLP,./data/raw/alphafold//AF-D5LNB6-F1-model_v4.pdb,1669,1278,4569,1526
+1850,8868,9010,MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,uniprot_search,P08246,COC(=O)CCC(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(=O)SCc1ccccc1)C(C)C>>,13.0,99.80262002183022,25.0,7.4,3.4.21.37,9606.0,1.1139433523068367,COC(=O)CCC(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(=O)SCc1ccccc1)C(C)C,,1.1139433523068367,COC(=O)CCC(O)=N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=N[C@H](C(=O)SCc1ccccc1)C(C)C__MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH,./data/raw/alphafold//AF-P08246-F1-model_v4.pdb,1869,1645,3250,2040
+1851,8681,8817,MNIVENEICIRTLIDDDFPLMLKWLTDERVLEFYGGRDKKYTLESLKKHYTEPWEDEVFRVIIEYNNVPIGYGQIYKMYDELYTDYHYPKTDEIVYGMDQFIGEPNYWSKGIGTRYIKLIFEFLKKERNANAVILDPHKNNPRAIRAYQKSGFRIIEDLPEHELHEGKKEDCYLMEYRYDDNATNVKAMKYLIEHYFDNFKVDSIEIIGSGYDSVAYLVNNEYIFKTKFSTNKKKGYAKEKAIYNFLNTNLETNVKIPNIEYSYISDELSILGYKEIKGTFLTPEIYSTMSEEEQNLLKRDIASFLRQMHGLDYTDISECTIDNKQNVLEEYILLRETIYNDLTDIEKDYIESFMERLNATTVFEGKKCLCHNDFSCNHLLLDGNNRLTGIIDFGDSGIIDEYCDFIYLLEDSEEEIGTNFGEDILRMYGNIDIEKAKEYQDIVEEYYPIETIVYGIKNIKQEFIENGRKEIYKRTYKD,sabio,P0A0C2,CN[C@@H]1[C@@H](O)[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3OC(CN)=CC[C@H]3N)[C@@H](N)C[C@H]2N)OC[C@]1(C)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,0.4,38.14485023696273,,8.0,2.7.1.-,1351.0,-0.3979400086720376,CN[C@@H]1[C@@H](O)[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3OC(CN)=CC[C@H]3N)[C@@H](N)C[C@H]2N)OC[C@]1(C)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,-0.3979400086720376,CN[C@@H]1[C@@H](O)[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3OC(CN)=CC[C@H]3N)[C@@H](N)C[C@H]2N)OC[C@]1(C)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MNIVENEICIRTLIDDDFPLMLKWLTDERVLEFYGGRDKKYTLESLKKHYTEPWEDEVFRVIIEYNNVPIGYGQIYKMYDELYTDYHYPKTDEIVYGMDQFIGEPNYWSKGIGTRYIKLIFEFLKKERNANAVILDPHKNNPRAIRAYQKSGFRIIEDLPEHELHEGKKEDCYLMEYRYDDNATNVKAMKYLIEHYFDNFKVDSIEIIGSGYDSVAYLVNNEYIFKTKFSTNKKKGYAKEKAIYNFLNTNLETNVKIPNIEYSYISDELSILGYKEIKGTFLTPEIYSTMSEEEQNLLKRDIASFLRQMHGLDYTDISECTIDNKQNVLEEYILLRETIYNDLTDIEKDYIESFMERLNATTVFEGKKCLCHNDFSCNHLLLDGNNRLTGIIDFGDSGIIDEYCDFIYLLEDSEEEIGTNFGEDILRMYGNIDIEKAKEYQDIVEEYYPIETIVYGIKNIKQEFIENGRKEIYKRTYKD,./data/raw/alphafold//AF-P0A0C2-F1-model_v4.pdb,964,490,131,139
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+1867,4040,4093,MAQKEGGRTVPCCSRPKVAALTAGTLLLLTAIGAASWAIVAVLLRSDQEPLYPVQVSSADARLMVFDKTEGTWRLLCSSRSNARVAGLSCEEMGFLRALTHSELDVRTAGANGTSGFFCVDEGRLPHTQRLLEVISVCDCPRGRFLAAICQDCGRRKLPVDRIVGGRDTSLGRWPWQVSLRYDGAHLCGGSLLSGDWVLTAAHCFPERNRVLSRWRVFAGAVAQASPHGLQLGVQAVVYHGGYLPFRDPNSEENSNDIALVHLSSPLPLTEYIQPVCLPAAGQALVDGKICTVTGWGNTQYYGQQAGVLQEARVPIISNDVCNGADFYGNQIKPKMFCAGYPEGGIDACQGDSGGPFVCEDSISRTPRWRLCGIVSWGTGCALAQKPGVYTKVSDFREWIFQAIKTHSEASGMVTQL,uniprot_search,P05981,CC(C)C[C@H](N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@H](C(O)=N[C@H](C(O)=NCC(O)=NCC(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O)C(C)C)C(C)C.O>>CC(C)C[C@H](N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.CC(C)[C@H](N)C(O)=N[C@H](C(O)=NCC(O)=NCC(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O)C(C)C,1.5,4.621923451826666e-14,37.0,7.833333333333333,3.4.21.106,9606.0,0.1760912590556812,CC(C)C[C@H](N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@H](C(O)=N[C@H](C(O)=NCC(O)=NCC(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O)C(C)C)C(C)C.O,CC(C)C[C@H](N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O.CC(C)[C@H](N)C(O)=N[C@H](C(O)=NCC(O)=NCC(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O)C(C)C,0.1760912590556812,CC(C)C[C@H](N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CCCNC(=N)N)N=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(O)=N[C@H](C(O)=N[C@H](C(O)=NCC(O)=NCC(O)=N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O)C(C)C)C(C)C.O__MAQKEGGRTVPCCSRPKVAALTAGTLLLLTAIGAASWAIVAVLLRSDQEPLYPVQVSSADARLMVFDKTEGTWRLLCSSRSNARVAGLSCEEMGFLRALTHSELDVRTAGANGTSGFFCVDEGRLPHTQRLLEVISVCDCPRGRFLAAICQDCGRRKLPVDRIVGGRDTSLGRWPWQVSLRYDGAHLCGGSLLSGDWVLTAAHCFPERNRVLSRWRVFAGAVAQASPHGLQLGVQAVVYHGGYLPFRDPNSEENSNDIALVHLSSPLPLTEYIQPVCLPAAGQALVDGKICTVTGWGNTQYYGQQAGVLQEARVPIISNDVCNGADFYGNQIKPKMFCAGYPEGGIDACQGDSGGPFVCEDSISRTPRWRLCGIVSWGTGCALAQKPGVYTKVSDFREWIFQAIKTHSEASGMVTQL,./data/raw/alphafold//AF-P05981-F1-model_v4.pdb,2877,1581,3171,1943
+1868,18600,18871,MAKLYFYYSAMNAGKSTVLLQSSFNYQERGMKTILFTISKDCRFEEGSICSRIGLSEKAHTFTPDLKLLDIINQENNKEKIDCVLVDESQFLTKFQVRELCIVVDKLNIPVLCYGLRTDFKGNLFEGSKYLLAWADKLTEIKTICRCGKKATMTIRLNSNGEPVFSGEQILIGDNSIYTSVCRKHHIINCEEYNF,uniprot_search,Q6S4W6,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]1C[C@H](O)[C@@H](CO)O1>>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]1C[C@H](O)[C@@H](COP(=O)(O)O)O1,0.53,0.0,25.0,7.8,2.7.1.21,5807.0,-0.2757241303992109,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]1C[C@H](O)[C@@H](CO)O1,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]1C[C@H](O)[C@@H](COP(=O)(O)O)O1,-0.2757241303992109,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]1C[C@H](O)[C@@H](CO)O1__MAKLYFYYSAMNAGKSTVLLQSSFNYQERGMKTILFTISKDCRFEEGSICSRIGLSEKAHTFTPDLKLLDIINQENNKEKIDCVLVDESQFLTKFQVRELCIVVDKLNIPVLCYGLRTDFKGNLFEGSKYLLAWADKLTEIKTICRCGKKATMTIRLNSNGEPVFSGEQILIGDNSIYTSVCRKHHIINCEEYNF,./data/raw/alphafold//AF-Q6S4W6-F1-model_v4.pdb,2042,4205,4076,3924
+1869,321,335,MTNEKVWIEKLDNPTLSVLPHDFLRPQQEPYTKQATYSLQLPQLDVPHDSFSNKYAVALSVWAALIYRVTGDDDIVLYIANNKILRFNIQPTWSFNELYSTINNELNKLNSIEANFSFDELAEKIQSCQDLERTPQLFRLAFLENQDFKLDEFKHHLVDFALNLDTSNNAHVLNLIYNSLLYSNERVTIVADQFTQYLTAALSDPSNCITKISLITASSKDSLPDPTKNLGWCDFVGCIHDIFQDNAEAFPERTCVVETPTLNSDKSRSFTYRDINRTSNIVAHYLIKTGIKRGDVVMIYSSRGVDLMVCVMGVLKAGATFSVIDPAYPPARQTIYLGVAKPRGLIVIRAAGQLDQLVEDYINDELEIVSRINSIAIQENGTIEGGKLDNGEDVLAPYDHYKDTRTGVVVGPDSNPTLSFTSGSEGIPKGVLGRHFSLAYYFNWMSKRFNLTENDKFTMLSGIAHDPIQRDMFTPLFLGAQLYVPTQDDIGTPGRLAEWMSKYGCTVTHLTPAMGQLLTAQATTPFPKLHHAFFVGDILTKRDCLRLQTLAENCRIVNMYGTTETQRAVSYFEVKSKNDDPNFLKKLKDVMPAGKGMLNVQLLVVNRNDRTQICGIGEIGEIYVRAGGLAEGYRGLPELNKEKFVNNWFVEKDHWNYLDKDNGEPWRQFWLGPRDRLYRTGDLGRYLPNGDCECCGRADDQVKIRGFRIELGEIDTHISQHPLVRENITLVRKNADNEPTLITFMVPRFDKPDDLSKFQSDVPKEVETDPIVKGLIGYHLLSKDIRTFLKKRLASYAMPSLIVVMDKLPLNPNGKVDKPKLQFPTPKQLNLVAENTVSETDDSQFTNVEREVRDLWLSILPTKPASVSPDDSFFDLGGHSILATKMIFTLKKKLQVDLPLGTIFKYPTIKAFAAEIDRIKSSGGSSQGEVVENVTANYAEDAKKLVETLPSSYPSREYFVEPNSAEGKTTINVFVTGVTGFLGSYILADLLGRSPKNYSFKVFAHVRAKDEEAAFARLQKAGITYGTWNEKFASNIKVVLGDLSKSQFGLSDEKWMDLANTVDIIIHNGALVHWVYPYAKLRDPNVISTINVMSLAAVGKPKFFDFVSSTSTLDTEYYFNLSDKLVSEGKPGILESDDLMNSASGLTGGYGQSKWAAEYIIRRAGERGLRGCIVRPGYVTGASANGSSNTDDFLLRFLKGSVQLGKIPDIENSVNMVPVDHVARVVVATSLNPPKENELAVAQVTGHPRILFKDYLYTLHDYGYDVEIESYSKWKKSLEASVIDRNEENALYPLLHMVLDNLPESTKAPELDDRNAVASLKKDTAWTGVDWSNGIGVTPEEVGIYIAFLNKVGFLPPPTHNDKLPLPSIELTQAQISLVASGAGARGSSAAA,sabio,P07702,C(C[C@H](C(=O)O)N)CC(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>O=P(O)(O)OP(=O)(O)O,2280.0,57.87313291916082,37.0,8.8,1.2.1.95,4932.0,3.357934847000454,C(C[C@H](C(=O)O)N)CC(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,O=P(O)(O)OP(=O)(O)O,3.357934847000454,C(C[C@H](C(=O)O)N)CC(=O)O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MTNEKVWIEKLDNPTLSVLPHDFLRPQQEPYTKQATYSLQLPQLDVPHDSFSNKYAVALSVWAALIYRVTGDDDIVLYIANNKILRFNIQPTWSFNELYSTINNELNKLNSIEANFSFDELAEKIQSCQDLERTPQLFRLAFLENQDFKLDEFKHHLVDFALNLDTSNNAHVLNLIYNSLLYSNERVTIVADQFTQYLTAALSDPSNCITKISLITASSKDSLPDPTKNLGWCDFVGCIHDIFQDNAEAFPERTCVVETPTLNSDKSRSFTYRDINRTSNIVAHYLIKTGIKRGDVVMIYSSRGVDLMVCVMGVLKAGATFSVIDPAYPPARQTIYLGVAKPRGLIVIRAAGQLDQLVEDYINDELEIVSRINSIAIQENGTIEGGKLDNGEDVLAPYDHYKDTRTGVVVGPDSNPTLSFTSGSEGIPKGVLGRHFSLAYYFNWMSKRFNLTENDKFTMLSGIAHDPIQRDMFTPLFLGAQLYVPTQDDIGTPGRLAEWMSKYGCTVTHLTPAMGQLLTAQATTPFPKLHHAFFVGDILTKRDCLRLQTLAENCRIVNMYGTTETQRAVSYFEVKSKNDDPNFLKKLKDVMPAGKGMLNVQLLVVNRNDRTQICGIGEIGEIYVRAGGLAEGYRGLPELNKEKFVNNWFVEKDHWNYLDKDNGEPWRQFWLGPRDRLYRTGDLGRYLPNGDCECCGRADDQVKIRGFRIELGEIDTHISQHPLVRENITLVRKNADNEPTLITFMVPRFDKPDDLSKFQSDVPKEVETDPIVKGLIGYHLLSKDIRTFLKKRLASYAMPSLIVVMDKLPLNPNGKVDKPKLQFPTPKQLNLVAENTVSETDDSQFTNVEREVRDLWLSILPTKPASVSPDDSFFDLGGHSILATKMIFTLKKKLQVDLPLGTIFKYPTIKAFAAEIDRIKSSGGSSQGEVVENVTANYAEDAKKLVETLPSSYPSREYFVEPNSAEGKTTINVFVTGVTGFLGSYILADLLGRSPKNYSFKVFAHVRAKDEEAAFARLQKAGITYGTWNEKFASNIKVVLGDLSKSQFGLSDEKWMDLANTVDIIIHNGALVHWVYPYAKLRDPNVISTINVMSLAAVGKPKFFDFVSSTSTLDTEYYFNLSDKLVSEGKPGILESDDLMNSASGLTGGYGQSKWAAEYIIRRAGERGLRGCIVRPGYVTGASANGSSNTDDFLLRFLKGSVQLGKIPDIENSVNMVPVDHVARVVVATSLNPPKENELAVAQVTGHPRILFKDYLYTLHDYGYDVEIESYSKWKKSLEASVIDRNEENALYPLLHMVLDNLPESTKAPELDDRNAVASLKKDTAWTGVDWSNGIGVTPEEVGIYIAFLNKVGFLPPPTHNDKLPLPSIELTQAQISLVASGAGARGSSAAA,./data/raw/alphafold//AF-P07702-F1-model_v4.pdb,1016,557,218,236
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+1884,11290,11446,MDSKHQCVKLNDGHFMPVLGFGTYAPPEVPRSKALEVTKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWSTFHRPELVRPALENSLKKAQLDYVDLYLIHSPMSLKPGEELSPTDENGKVIFDIVDLCTTWEAMEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNRSKLLDFCKSKDIVLVAYSALGSQRDKRWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTAEDMKAIDGLDRNLHYFNSDSFASHPNYPYSDEY,sabio,P42330,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>>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],12.6,0.0,25.0,7.0,1.1.1.239,9606.0,1.100370545117563,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,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],1.541579243946581,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__MDSKHQCVKLNDGHFMPVLGFGTYAPPEVPRSKALEVTKLAIEAGFRHIDSAHLYNNEEQVGLAIRSKIADGSVKREDIFYTSKLWSTFHRPELVRPALENSLKKAQLDYVDLYLIHSPMSLKPGEELSPTDENGKVIFDIVDLCTTWEAMEKCKDAGLAKSIGVSNFNRRQLEMILNKPGLKYKPVCNQVECHPYFNRSKLLDFCKSKDIVLVAYSALGSQRDKRWVDPNSPVLLEDPVLCALAKKHKRTPALIALRYQLQRGVVVLAKSYNEQRIRQNVQVFEFQLTAEDMKAIDGLDRNLHYFNSDSFASHPNYPYSDEY,./data/raw/alphafold//AF-P42330-F1-model_v4.pdb,1329,1150,197,877
+1885,6551,6664,MNTRSLVLPELLPLLGEIPTVDLSAESLPAFRAGLEQTAGQSFLQAEDYPVTLERLNIPGTENAPPIRLLTVRPRKEATGPRRALLHLHGGGYFAGQPELTTTQLCQFAQELDCVVISPDYRLTPEHPFPAAIEDAYTTLCWITRNADTLGIDPARIGLTGESAGGGLAAGLALLTRDREGPALLFQNLIYPVLDDRTITGQPDASPVGGEFLWTRASNTFMWTALLNPVAPGSADVSPYAAPARATDLSDLPPVYLCVGALDLFLDEDLAYARRLIHQGISVELEIVPGACHIFDQTDTPVATRSIARRIDAMKRGFGL,brenda,Q5FSJ2,CCCC(=O)SC.O>>CCCC(=O)S.CO,20.0,0.0,25.0,7.0,3.1.1.2,442.0,1.3010299956639813,CCCC(=O)SC.O,CCCC(=O)S.CO,1.3010299956639813,CCCC(=O)SC.O__MNTRSLVLPELLPLLGEIPTVDLSAESLPAFRAGLEQTAGQSFLQAEDYPVTLERLNIPGTENAPPIRLLTVRPRKEATGPRRALLHLHGGGYFAGQPELTTTQLCQFAQELDCVVISPDYRLTPEHPFPAAIEDAYTTLCWITRNADTLGIDPARIGLTGESAGGGLAAGLALLTRDREGPALLFQNLIYPVLDDRTITGQPDASPVGGEFLWTRASNTFMWTALLNPVAPGSADVSPYAAPARATDLSDLPPVYLCVGALDLFLDEDLAYARRLIHQGISVELEIVPGACHIFDQTDTPVATRSIARRIDAMKRGFGL,./data/raw/alphafold//AF-Q5FSJ2-F1-model_v4.pdb,1492,1040,866,1196
+1886,7869,7997,MRIRRRALVFATMSAVLCTAGFMPSAGEAAADNGAGEETKSYAETYRLTADDVANINALNESAPAASSAGPSFRAPDSDDRVTPPAEPLDRMPDPYRPSYGRAETVVNNYIRKWQQVYSHRDGRKQQMTEEQREWLSYGCVGVTWVNSGQYPTNRLAFASFDEDRFKNELKNGRPRSGETRAEFEGRVAKESFDEEKGFQRAREVASVMNRALENAHDESAYLDNLKKELANGNDALRNEDARSPFYSALRNTPSFKERNGGNHDPSRMKAVIYSKHFWSGQDRSSSADKRKYGDPDAFRPAPGTGLVDMSRDRNIPRSPTSPGEGFVNFDYGWFGAQTEADADKTVWTHGNHYHAPNGSLGAMHVYESKFRNWSEGYSDFDRGAYVITFIPKSWNTAPDKVKQGWP,brenda,P81453,CCOC(=O)CN.O=C(O)CC[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)O>>CCOC(=O)CN=C(O)CC[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)O.N,1.83,0.1114521627835834,37.0,6.0,2.3.2.13,35621.0,0.2624510897304295,CCOC(=O)CN.O=C(O)CC[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)O,CCOC(=O)CN=C(O)CC[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)O.N,0.2624510897304295,CCOC(=O)CN.O=C(O)CC[C@H](N=C(O)OCc1ccccc1)C(O)=NCC(=O)O__MRIRRRALVFATMSAVLCTAGFMPSAGEAAADNGAGEETKSYAETYRLTADDVANINALNESAPAASSAGPSFRAPDSDDRVTPPAEPLDRMPDPYRPSYGRAETVVNNYIRKWQQVYSHRDGRKQQMTEEQREWLSYGCVGVTWVNSGQYPTNRLAFASFDEDRFKNELKNGRPRSGETRAEFEGRVAKESFDEEKGFQRAREVASVMNRALENAHDESAYLDNLKKELANGNDALRNEDARSPFYSALRNTPSFKERNGGNHDPSRMKAVIYSKHFWSGQDRSSSADKRKYGDPDAFRPAPGTGLVDMSRDRNIPRSPTSPGEGFVNFDYGWFGAQTEADADKTVWTHGNHYHAPNGSLGAMHVYESKFRNWSEGYSDFDRGAYVITFIPKSWNTAPDKVKQGWP,./data/raw/alphafold//AF-P81453-F1-model_v4.pdb,1005,541,194,209
+1887,9997,10147,MTHSQRRDKLKAQIAASGLDAMLISDLINVRYLSGFSGSNGALLVFADERDAVLATDGRYRTQAASQAPDLEVAIERAVGRYLAGRAGEAGVGKLGFESHVVTVDGLDALAGALEGKNTELVRASGTVESLREVKDAGELALLRLACEAADAALTDLVARGGLRPGRTERQVSRELEALMLDHGADAVSFETIVAAGANSAIPHHRPTDAVLQVGDFVKIDFGALVAGYHSDMTRTFVLGKAADWQLEIYQLVAEAQQAGRQALLPGAELRGVDAAARQLIADAGYGEHFGHGLGHGVGLQIHEAPGIGVTSAGTLLAGSVVTVEPGVYLPGRGGVRIEDTLVVAGGTPKMPETAGQTPELLTRFPKELAIL,brenda,I6YDN6,CSCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)O.O>>CSCC[C@H](N)C(=O)O.O=C(O)[C@@H]1CCCN1,18.0,1.0731369217096672e-14,55.0,8.0,3.4.11.9,1773.0,1.255272505103306,CSCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)O.O,CSCC[C@H](N)C(=O)O.O=C(O)[C@@H]1CCCN1,1.255272505103306,CSCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)O.O__MTHSQRRDKLKAQIAASGLDAMLISDLINVRYLSGFSGSNGALLVFADERDAVLATDGRYRTQAASQAPDLEVAIERAVGRYLAGRAGEAGVGKLGFESHVVTVDGLDALAGALEGKNTELVRASGTVESLREVKDAGELALLRLACEAADAALTDLVARGGLRPGRTERQVSRELEALMLDHGADAVSFETIVAAGANSAIPHHRPTDAVLQVGDFVKIDFGALVAGYHSDMTRTFVLGKAADWQLEIYQLVAEAQQAGRQALLPGAELRGVDAAARQLIADAGYGEHFGHGLGHGVGLQIHEAPGIGVTSAGTLLAGSVVTVEPGVYLPGRGGVRIEDTLVVAGGTPKMPETAGQTPELLTRFPKELAIL,./data/raw/alphafold//AF-I6YDN6-F1-model_v4.pdb,3600,3570,1353,3311
+1888,9828,9977,MTSSFSRRQFLLGGLVLAGTGAVAACTSDPGPAASAPGPSLRPTPTPTALGEPTVRRTLTARPLSLDIGGIEAKTWGYVSDTGDAAIEATAGDVLQVDITNELPESTSIHWHGIALHNAADGVPGMTQDPIEPGESFSYVFEVPHGGTYFYHSHTGLQLDRGLHAPLIIRDPQDAEDQDVEWTIVLDDWVDGIQGTPDDELDKLTGMGSGDHNGRMGMGGHGQMMHGTPDRVLGGDVGDVMYPHYLINGRIPRAHRTFEARPGDKARLRFINSGGDTIFKVALGGHRMTVTHTDGFPVQPWETESIYLSMGERVDVEVILGDGIFPLTALAVGKDDRAFAVIRTAGGQAPRPDVDFPELSSTGLLLSSLKPADRALLPEGTPDREVSIDLGGQMMPYEWSILTDGQSSSATVQEGQRLRMVMRNRTMMPHPMHIHGHTWALPGSGGLRKDTVLLRHGETMIADLIADNPGEWAFHCHNAYHMETGMVSSLRYE,sabio,Q8NLH5,COc1cccc(OC)c1O.O=O>>O,6912.0,81.95225608983418,25.0,7.5,1.10.3.2,1718.0,3.839603729470837,COc1cccc(OC)c1O.O=O,O,3.839603729470837,COc1cccc(OC)c1O.O=O__MTSSFSRRQFLLGGLVLAGTGAVAACTSDPGPAASAPGPSLRPTPTPTALGEPTVRRTLTARPLSLDIGGIEAKTWGYVSDTGDAAIEATAGDVLQVDITNELPESTSIHWHGIALHNAADGVPGMTQDPIEPGESFSYVFEVPHGGTYFYHSHTGLQLDRGLHAPLIIRDPQDAEDQDVEWTIVLDDWVDGIQGTPDDELDKLTGMGSGDHNGRMGMGGHGQMMHGTPDRVLGGDVGDVMYPHYLINGRIPRAHRTFEARPGDKARLRFINSGGDTIFKVALGGHRMTVTHTDGFPVQPWETESIYLSMGERVDVEVILGDGIFPLTALAVGKDDRAFAVIRTAGGQAPRPDVDFPELSSTGLLLSSLKPADRALLPEGTPDREVSIDLGGQMMPYEWSILTDGQSSSATVQEGQRLRMVMRNRTMMPHPMHIHGHTWALPGSGGLRKDTVLLRHGETMIADLIADNPGEWAFHCHNAYHMETGMVSSLRYE,./data/raw/alphafold//AF-Q8NLH5-F1-model_v4.pdb,3418,2311,1022,2919
+1889,19844,20130,MDERDALRISREIAGEVRKAIASMPLRERVKDVGMGKDGTPTKAADRVAEDAALEILRKERVTVVTEESGVLGEGDVFVALDPLDGTFNATRGIPVYSVSLCFSYSDKLKDAFFGYVYNLATGDEYYADSSGAYRNGERIEVSDAEELYCNAIIYYPDRKFPFKRMRIFGSAATELCFFADGSFDCFLDIRPGKMLRIYDAAAGVFIAEKAGGKVTELDGESLGNKKFDMQERLNIVAANEKLHPKLLELIK,brenda,O30298,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,28.7,0.0,85.0,8.0,3.1.3.25,2234.0,1.4578818967339924,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,1.4578818967339924,O.O=P(O)(O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@@H]1O__MDERDALRISREIAGEVRKAIASMPLRERVKDVGMGKDGTPTKAADRVAEDAALEILRKERVTVVTEESGVLGEGDVFVALDPLDGTFNATRGIPVYSVSLCFSYSDKLKDAFFGYVYNLATGDEYYADSSGAYRNGERIEVSDAEELYCNAIIYYPDRKFPFKRMRIFGSAATELCFFADGSFDCFLDIRPGKMLRIYDAAAGVFIAEKAGGKVTELDGESLGNKKFDMQERLNIVAANEKLHPKLLELIK,./data/raw/alphafold//AF-O30298-F1-model_v4.pdb,3764,4551,4476,4373
+1890,20615,20922,MYRKLAVISAFLATARAQSACTLQSETHPPLTWQKCSSGGTCTQQTGSVVIDANWRWTHATNSSTNCYDGNTWSSTLCPDNETCAKNCCLDGAAYASTYGVTTSGNSLSIGFVTQSAQKNVGARLYLMASDTTYQEFTLLGNEFSFDVDVSQLPCGLNGALYFVSMDADGGVSKYPTNTAGAKYGTGYCDSQCPRDLKFINGQANVEGWEPSSNNANTGIGGHGSCCSEMDIWEANSISEALTPHPCTTVGQEICEGDGCGGTYSDNRYGGTCDPDGCDWNPYRLGNTSFYGPGSSFTLDTTKKLTVVTQFETSGAINRYYVQNGVTFQQPNAELGSYSGNELNDDYCTAEEAEFGGSSFSDKGGLTQFKKATSGGMVLVMSLWDDYYANMLWLDSTYPTNETSSTPGAVRGSCSTSSGVPAQVESQSPNAKVTFSNIKFGPIGSTGNPSGGNPPGGNRGTTTTRRPATTTGSSPGPTQSHYGQCGGIGYSGPTVCASGTTCQVLNPYYSQCL,brenda,P62694,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)O[C@@H]2CO)[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,0.5,19.988321065585943,44.0,5.75,3.2.1.91,51453.0,-0.3010299956639812,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)O[C@@H]2CO)[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,-0.3010299956639812,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__MYRKLAVISAFLATARAQSACTLQSETHPPLTWQKCSSGGTCTQQTGSVVIDANWRWTHATNSSTNCYDGNTWSSTLCPDNETCAKNCCLDGAAYASTYGVTTSGNSLSIGFVTQSAQKNVGARLYLMASDTTYQEFTLLGNEFSFDVDVSQLPCGLNGALYFVSMDADGGVSKYPTNTAGAKYGTGYCDSQCPRDLKFINGQANVEGWEPSSNNANTGIGGHGSCCSEMDIWEANSISEALTPHPCTTVGQEICEGDGCGGTYSDNRYGGTCDPDGCDWNPYRLGNTSFYGPGSSFTLDTTKKLTVVTQFETSGAINRYYVQNGVTFQQPNAELGSYSGNELNDDYCTAEEAEFGGSSFSDKGGLTQFKKATSGGMVLVMSLWDDYYANMLWLDSTYPTNETSSTPGAVRGSCSTSSGVPAQVESQSPNAKVTFSNIKFGPIGSTGNPSGGNPPGGNRGTTTTRRPATTTGSSPGPTQSHYGQCGGIGYSGPTVCASGTTCQVLNPYYSQCL,./data/raw/alphafold//AF-P62694-F1-model_v4.pdb,1951,3462,5385,6266
+1891,22870,23212,MLKKSKVKEIQEKVYEALKKANIAITPEEKENIEVADFGLGDLENTGLQLLVYVNTDRYCAKELVLFPGQTCPEHRHPPVNGKPGKQETFRCRYGKVYLYVEGEKTENPHCRPPKGSEQYYTVWHEIELNPGEQYTIEPNTLHWFQAGEEGAIVSEFSSHSDDESDIFTDPRIKRIPEIED,brenda,D9RZ53,OC1OC[C@@H](O)[C@H](O)[C@@H]1O>>O=C(CO)[C@@H](O)[C@H](O)CO,51.8,9.434279170950016e-15,65.0,6.5,5.3.1.15,291990.0,1.714329759745233,OC1OC[C@@H](O)[C@H](O)[C@@H]1O,O=C(CO)[C@@H](O)[C@H](O)CO,1.714329759745233,OC1OC[C@@H](O)[C@H](O)[C@@H]1O__MLKKSKVKEIQEKVYEALKKANIAITPEEKENIEVADFGLGDLENTGLQLLVYVNTDRYCAKELVLFPGQTCPEHRHPPVNGKPGKQETFRCRYGKVYLYVEGEKTENPHCRPPKGSEQYYTVWHEIELNPGEQYTIEPNTLHWFQAGEEGAIVSEFSSHSDDESDIFTDPRIKRIPEIED,./data/raw/alphafold//AF-D9RZ53-F1-model_v4.pdb,843,303,6067,7002
+1892,7841,7968,ASLQQVSNFGSNPTNINMHIYVPDRLASKPPIIVALHPCGGNAQQWFSGTRLPQYADSHGFILIYPSTPHMSNCWDVQNPASLTHGAGGDALGIVSMVNYAINRYGADRDRVYAMGFSSGGMMTNVLAGSYPDVFEAGAAYSGVPHACFLGAPAATPFSPNQTCAQGLQKTPEEWGNLVRNSYPGYNGRRPRMQITHGLNDWLVRPQCAYETLKQWSNVLGLELTRQVTSGQWTQHIYGDGTKLVGYFGQGVGHEPSVNEEQLLRFFGIIN,brenda,A0A1B1LML0,CCOC(=O)/C=C(\C)c1ccc(O)c(OC)c1.O>>CCO.COc1cc(/C=C/C(=O)O)ccc1O,4.1,2.830666529441795,55.0,6.0,3.1.1.73,2588329.0,0.6127838567197355,CCOC(=O)/C=C(\C)c1ccc(O)c(OC)c1.O,CCO.COc1cc(/C=C/C(=O)O)ccc1O,0.6127838567197355,CCOC(=O)/C=C(\C)c1ccc(O)c(OC)c1.O__ASLQQVSNFGSNPTNINMHIYVPDRLASKPPIIVALHPCGGNAQQWFSGTRLPQYADSHGFILIYPSTPHMSNCWDVQNPASLTHGAGGDALGIVSMVNYAINRYGADRDRVYAMGFSSGGMMTNVLAGSYPDVFEAGAAYSGVPHACFLGAPAATPFSPNQTCAQGLQKTPEEWGNLVRNSYPGYNGRRPRMQITHGLNDWLVRPQCAYETLKQWSNVLGLELTRQVTSGQWTQHIYGDGTKLVGYFGQGVGHEPSVNEEQLLRFFGIIN,./data/raw/alphafold//AF-A0A1B1LML0-F1-model_v4.pdb,1482,1023,849,1174
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+1915,10000,10150,MLHRINPVRFSMQSCQRYFSKLVSPLEQHKSNTFTNRVRIPIEAGQPLHETRPFLIKSGELTPGISALEYYERRIRLAETLPPKSCVILAGNDIQFASGAVFYPFQQENDLFYLSGWNEPNSVMILEKPTDSLSDTIFHMLVPPKDAFAEKWEGFRSGVYGVQEIFNADESASINDLSKYLPKIINRNDFIYFDMLSTSNPSSSNFKHIKSLLDGSGNSNRSLNSIANKTIKPISKRIAEFRKIKSPQELRIMRRAGQISGRSFNQAFAKRFRNERTLDSFLHYKFISGGCDKDAYIPVVATGSNSLCIHYTRNDDVMFDDEMVLVDAAGSLGGYCADISRTWPNSGKFTDAQRDLYEAVLNVQRDCIKLCKASNNYSLHDIHEKSITLMKQELKNLGIDKVSGWNVEKLYPHYIGHNLGLDVHDVPKVSRYEPLKVGQVITIEPGLYIPNEESFPSYFRNVGIRIEDDIAIGEDTYTNLTVEAVKEIDDLENVMQNGLSTKFEEDQVAPL,brenda,P40051,CSCC[C@H](N)C(=O)N1CCC[C@H]1C(O)=N[C@@H](C)C(=O)O.O>>CSCC[C@H](N)C(=O)O.C[C@H](N=C(O)[C@@H]1CCCN1)C(=O)O,25.7,8.460705462037476e-15,40.0,7.5,3.4.11.26,4932.0,1.4099331233312946,CSCC[C@H](N)C(=O)N1CCC[C@H]1C(O)=N[C@@H](C)C(=O)O.O,CSCC[C@H](N)C(=O)O.C[C@H](N=C(O)[C@@H]1CCCN1)C(=O)O,1.4099331233312946,CSCC[C@H](N)C(=O)N1CCC[C@H]1C(O)=N[C@@H](C)C(=O)O.O__MLHRINPVRFSMQSCQRYFSKLVSPLEQHKSNTFTNRVRIPIEAGQPLHETRPFLIKSGELTPGISALEYYERRIRLAETLPPKSCVILAGNDIQFASGAVFYPFQQENDLFYLSGWNEPNSVMILEKPTDSLSDTIFHMLVPPKDAFAEKWEGFRSGVYGVQEIFNADESASINDLSKYLPKIINRNDFIYFDMLSTSNPSSSNFKHIKSLLDGSGNSNRSLNSIANKTIKPISKRIAEFRKIKSPQELRIMRRAGQISGRSFNQAFAKRFRNERTLDSFLHYKFISGGCDKDAYIPVVATGSNSLCIHYTRNDDVMFDDEMVLVDAAGSLGGYCADISRTWPNSGKFTDAQRDLYEAVLNVQRDCIKLCKASNNYSLHDIHEKSITLMKQELKNLGIDKVSGWNVEKLYPHYIGHNLGLDVHDVPKVSRYEPLKVGQVITIEPGLYIPNEESFPSYFRNVGIRIEDDIAIGEDTYTNLTVEAVKEIDDLENVMQNGLSTKFEEDQVAPL,./data/raw/alphafold//AF-P40051-F1-model_v4.pdb,3602,3572,1355,3313
+1916,23151,23493,MTDRRNLTTNQGVPIGDNQNSMTAGLKGPTLLEDYVLIEKLAHFDRERVPERVVHARGAGAHGKFVTKKSMKKYTKAQFLQEEGTETEVFARFSTVIHGQHSPETLRDPRGFSVKFYTEEGNYDFVGNNLPVFFIRDAIKFPDVIHSLKPDPRTNIQDGNRYWDFFSLTPEATTMITYLFSDEGTPASYREIRGSSVHAFKWINEEGKTVYVKLRWVPKAGIVNLSTDQAAQIQAKEFNHASRDLYEAIENGDYPEWDLYVQVLDPKDLDNYDFNPLDATKDWFEDVFPYEHVGTMTLNRNPDNIFAETESVGFNPGVLVPGMLPSEDRVLQGRLFSYSDTQRHRVGPNYLQLPINSPKTPVDNNQRDGQMPFKQQTSSINYEPNSYDTEPKENPAYIEPEQEIRGDISGRLVAEKPNNFGHAKEVWKRYSDAERAALVKNIVDDWEGVREDIKIRNLRNFYQVEPEFAERVAAGTGINLAEHVIDLK,sabio,P24168,OO>>O.O=O,133000.0,18.81637597469039,37.0,7.0,1.11.1.6,1640.0,5.123851640967086,OO,O.O=O,5.330413773349191,OO__MTDRRNLTTNQGVPIGDNQNSMTAGLKGPTLLEDYVLIEKLAHFDRERVPERVVHARGAGAHGKFVTKKSMKKYTKAQFLQEEGTETEVFARFSTVIHGQHSPETLRDPRGFSVKFYTEEGNYDFVGNNLPVFFIRDAIKFPDVIHSLKPDPRTNIQDGNRYWDFFSLTPEATTMITYLFSDEGTPASYREIRGSSVHAFKWINEEGKTVYVKLRWVPKAGIVNLSTDQAAQIQAKEFNHASRDLYEAIENGDYPEWDLYVQVLDPKDLDNYDFNPLDATKDWFEDVFPYEHVGTMTLNRNPDNIFAETESVGFNPGVLVPGMLPSEDRVLQGRLFSYSDTQRHRVGPNYLQLPINSPKTPVDNNQRDGQMPFKQQTSSINYEPNSYDTEPKENPAYIEPEQEIRGDISGRLVAEKPNNFGHAKEVWKRYSDAERAALVKNIVDDWEGVREDIKIRNLRNFYQVEPEFAERVAAGTGINLAEHVIDLK,./data/raw/alphafold//AF-P24168-F1-model_v4.pdb,868,363,6140,7084
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+1958,4874,4944,MSKEVASARIQHRGMTKQEWESSSDILMEREIGIDMTTGYPKVGDGKNKFKDLKDLRGPMGPQGPSGERGLTGPIGPRGPAGKPGTTDYNQLQNKPNLDAFAQKKETNSKITKLESSKADKSAVYSKAESKIELDKKLSLTGGIVTGQLQFKPNKSGIKPSSSVGGAINIDMSKSEGAGVVVYSNNDTSDGPLMSLRTGKETFNKSALFVDYKGTTNAVNIVMRQPTTPNFSSALNITSDNENGSAMQLRGSEKALGTLKITHENPNVEAKYDENATALSIDIVKKQKGGKGTAAQGIYINSTSGTTGKLLRIRNLSDDKFYVKSDGGFYAKETSQIDGNLKLKDPTANDHAATKAYVDKAISELKKLILKK,brenda,C0M9W4,CC(O)=N[C@@H]1[C@@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](CO)O[C@H]1O>>CC(O)=N[C@@H]1[C@@H](O[C@H]2OC(C(=O)O)=C[C@H](O)[C@H]2O)[C@H](O)[C@@H](CO)O[C@@H]1O,7.61,2.316591890192384,,7.0,4.2.2.1,553482.0,0.8813846567705729,CC(O)=N[C@@H]1[C@@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](CO)O[C@H]1O,CC(O)=N[C@@H]1[C@@H](O[C@H]2OC(C(=O)O)=C[C@H](O)[C@H]2O)[C@H](O)[C@@H](CO)O[C@@H]1O,0.8813846567705729,CC(O)=N[C@@H]1[C@@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](CO)O[C@H]1O__MSKEVASARIQHRGMTKQEWESSSDILMEREIGIDMTTGYPKVGDGKNKFKDLKDLRGPMGPQGPSGERGLTGPIGPRGPAGKPGTTDYNQLQNKPNLDAFAQKKETNSKITKLESSKADKSAVYSKAESKIELDKKLSLTGGIVTGQLQFKPNKSGIKPSSSVGGAINIDMSKSEGAGVVVYSNNDTSDGPLMSLRTGKETFNKSALFVDYKGTTNAVNIVMRQPTTPNFSSALNITSDNENGSAMQLRGSEKALGTLKITHENPNVEAKYDENATALSIDIVKKQKGGKGTAAQGIYINSTSGTTGKLLRIRNLSDDKFYVKSDGGFYAKETSQIDGNLKLKDPTANDHAATKAYVDKAISELKKLILKK,./data/raw/alphafold//AF-C0M9W4-F1-model_v4.pdb,984,512,3384,2191
+1959,7566,7688,MDLTNKNVIFVAALGGIGLDTSRELVKRNLKNFVILDRVENPTALAELKAINPKVNITFHTYDVTVPVAESKKLLKKIFDQLKTVDILINGAGILDDHQIERTIAINFTGLVNTTTAILDFWDKRKGGPGGIIANICSVTGFNAIHQVPVYSASKAAVVSFTNSLAKLAPITGVTAYSINPGITRTPLVHTFNSWLDVEPRVAELLLSHPTQTSEQCGQNFVKAIEANKNGAIWKLDLGTLEAIEWTKHWDSHI,sabio,P10807,CCCCC[C@H](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>>CCCCCC(C)=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],1.7,7.276963581628948e-15,23.5,9.5,1.1.1.1,7225.0,0.2304489213782739,CCCCC[C@H](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,CCCCCC(C)=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],0.2304489213782739,CCCCC[C@H](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__MDLTNKNVIFVAALGGIGLDTSRELVKRNLKNFVILDRVENPTALAELKAINPKVNITFHTYDVTVPVAESKKLLKKIFDQLKTVDILINGAGILDDHQIERTIAINFTGLVNTTTAILDFWDKRKGGPGGIIANICSVTGFNAIHQVPVYSASKAAVVSFTNSLAKLAPITGVTAYSINPGITRTPLVHTFNSWLDVEPRVAELLLSHPTQTSEQCGQNFVKAIEANKNGAIWKLDLGTLEAIEWTKHWDSHI,./data/raw/alphafold//AF-P10807-F1-model_v4.pdb,1827,1509,3084,1844
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+1961,21928,22257,MSNERLNVFIGEKRFVEDYPKVGIRPTIDGRYGGVRESLEEQTWRLAKSVAEFIEKNVYLPNGGKVKCVLPPRCIGGVVEARMADELFKKEGVGLSITVTPCWCYGSETMDMTLDIPKAVWGFNGTERPGAVYLAAVSAAHNQKGLPVFKIYGKDVQDKDDFSIPQDVQEKILKFVKSALAVSIMKNKSYLSIGNVSMGIAGSIVDPDFFEDYLGMRVEYVDMSEIIRRIEEKIYDQEEFERAIQWVRNNCKEGEDPNPPEKRVDRKKKDEVWEFVVKMAIITRDLMIGNKKLEALGYPEEALGHNAILAGFQGQRQWTDHFPNGDFMETILNSSFDWNGLRQPYILATENDSLNGVCMLFGHLLTNTAQIFADVRTYWSEGAIYRVTGWKPEGLAQNGVIHLINSGSAALDGTGQQEIDGKPAIKPFWEITEEEVRKCLETTRFCYANLGYFRGGGFSTKFVTRGGMPVTISRLNIVKGLGPVLQIAEGWTVELPPNVHEILDRRTDPTWPTTWFVPKLTGKGAFKSAYSVMENWGANHCAITYGHVGDLFITLATMLRIPVCMHNVEEERIFRPSAWSAFGTEDLEGADFRACKNFGPLYKK,brenda,A4XJ56,O=C[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO>>O=C(CO)[C@H](O)[C@H](O)[C@H](O)CO,0.0287,0.0,80.0,7.0,5.3.1.3,44001.0,-1.5421181032660076,O=C[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO,O=C(CO)[C@H](O)[C@H](O)[C@H](O)CO,-1.5421181032660076,O=C[C@@H](O)[C@H](O)[C@H](O)[C@H](O)CO__MSNERLNVFIGEKRFVEDYPKVGIRPTIDGRYGGVRESLEEQTWRLAKSVAEFIEKNVYLPNGGKVKCVLPPRCIGGVVEARMADELFKKEGVGLSITVTPCWCYGSETMDMTLDIPKAVWGFNGTERPGAVYLAAVSAAHNQKGLPVFKIYGKDVQDKDDFSIPQDVQEKILKFVKSALAVSIMKNKSYLSIGNVSMGIAGSIVDPDFFEDYLGMRVEYVDMSEIIRRIEEKIYDQEEFERAIQWVRNNCKEGEDPNPPEKRVDRKKKDEVWEFVVKMAIITRDLMIGNKKLEALGYPEEALGHNAILAGFQGQRQWTDHFPNGDFMETILNSSFDWNGLRQPYILATENDSLNGVCMLFGHLLTNTAQIFADVRTYWSEGAIYRVTGWKPEGLAQNGVIHLINSGSAALDGTGQQEIDGKPAIKPFWEITEEEVRKCLETTRFCYANLGYFRGGGFSTKFVTRGGMPVTISRLNIVKGLGPVLQIAEGWTVELPPNVHEILDRRTDPTWPTTWFVPKLTGKGAFKSAYSVMENWGANHCAITYGHVGDLFITLATMLRIPVCMHNVEEERIFRPSAWSAFGTEDLEGADFRACKNFGPLYKK,./data/raw/alphafold//AF-A4XJ56-F1-model_v4.pdb,3680,3678,1475,3440
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+1963,15129,15341,MSSKLHCVKLNDGHFIPALGFGTYKPKEVPKSKSLEAAHLAIDVGYRHIDTASAYQVEEEIGQAIQSKIKAGVVKREDMFITTKLWCSCFRTEMVRPALEKSLKNLQLDYVDLFLIHYPVPIKSSVDESPLDEKGKFLLDTVDFCDTWEMLEKCKDAGLVKSIGVSNFNHKQLERLLNKPGLKYKPVCNQVECHLYLNQSKLLDYCKSKDIVLVAYGALGTQRYKEWVDQNSPVLLDDPILCDVAKKNKRSPALIALRYLFQRGVVPLAQSFKENEMRENLQVFEFQLSPEDMKTLDGLNKNFRYLSAEFLADHPEYPFSEEY,sabio,Q2MHD9,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=Cc1ccc(Cl)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.OCc1ccc(Cl)cc1,780.0,0.0,25.0,7.4,1.1.1.51,10116.0,2.8920946026904804,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=Cc1ccc(Cl)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.OCc1ccc(Cl)cc1,2.8920946026904804,NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.O=Cc1ccc(Cl)cc1.[H]__MSSKLHCVKLNDGHFIPALGFGTYKPKEVPKSKSLEAAHLAIDVGYRHIDTASAYQVEEEIGQAIQSKIKAGVVKREDMFITTKLWCSCFRTEMVRPALEKSLKNLQLDYVDLFLIHYPVPIKSSVDESPLDEKGKFLLDTVDFCDTWEMLEKCKDAGLVKSIGVSNFNHKQLERLLNKPGLKYKPVCNQVECHLYLNQSKLLDYCKSKDIVLVAYGALGTQRYKEWVDQNSPVLLDDPILCDVAKKNKRSPALIALRYLFQRGVVPLAQSFKENEMRENLQVFEFQLSPEDMKTLDGLNKNFRYLSAEFLADHPEYPFSEEY,./data/raw/alphafold//AF-Q2MHD9-F1-model_v4.pdb,1329,1150,6276,367
+1964,23183,23526,MSTAIVTNVKHFGGMGSALRLSEAGHTVACHDESFKQKDELEAFAETYPQLKPMSEQEPAELIEAVTSAYGQVDVLVSNDIFAPEFQPIDKYAVEDYRGAVEALQIRPFALVNAVASQMKKRKSGHIIFITSATPFGPWKELSTYTSARAGACTLANALSKELGEYNIPVFAIGPNYLHSEDSPYFYPTEPWKTNPEHVAHVKKVTALQRLGTQKELGELVAFLASGSCDYLTGQVFWLAGGFPMIERWPGMPE,sabio,Q93D82,O[C@@H](CCl)c1ccccc1>>Cl.c1ccc(C2CO2)cc1,12.1,9.045047300780341e-15,30.0,7.5,3.8.1.-,358.0,1.08278537031645,O[C@@H](CCl)c1ccccc1,Cl.c1ccc(C2CO2)cc1,1.08278537031645,O[C@@H](CCl)c1ccccc1__MSTAIVTNVKHFGGMGSALRLSEAGHTVACHDESFKQKDELEAFAETYPQLKPMSEQEPAELIEAVTSAYGQVDVLVSNDIFAPEFQPIDKYAVEDYRGAVEALQIRPFALVNAVASQMKKRKSGHIIFITSATPFGPWKELSTYTSARAGACTLANALSKELGEYNIPVFAIGPNYLHSEDSPYFYPTEPWKTNPEHVAHVKKVTALQRLGTQKELGELVAFLASGSCDYLTGQVFWLAGGFPMIERWPGMPE,./data/raw/alphafold//AF-Q93D82-F1-model_v4.pdb,825,272,6023,6952
+1965,17808,18052,MNYARFITAASAARNPSPIRTMTDILSRGPKSMISLAGGLPNPNMFPFKTAVITVENGKTIQFGEEMMKRALQYSPSAGIPELLSWLKQLQIKLHNPPTIHYPPSQGQMDLCVTSGSQQGLCKVFEMIINPGDNVLLDEPAYSGTLQSLHPLGCNIINVASDESGIVPDSLRDILSRWKPEDAKNPQKNTPKFLYTVPNGNNPTGNSLTSERKKEIYELARKYDFLIIEDDPYYFLQFNKFRVPTFLSMDVDGRVIRADSFSKIISSGLRIGFLTGPKPLIERVILHIQVSTLHPSTFNQLMISQLLHEWGEEGFMAHVDRVIDFYSNQKDAILAAADKWLTGLAEWHVPAAGMFLWIKVKGINDVKELIEEKAVKMGVLMLPGNAFYVDSSAPSPYLRASFSSASPEQMDVAFQVLAQLIKESL,sabio,Q8N5Z0,Nc1ccccc1C(=O)CC(N)C(=O)O.O=C(O)C(=O)CS>>Nc1ccccc1C(=O)CC(=O)C(=O)O,12930.0,22.582292542276225,37.0,7.4,2.6.1.7,9606.0,4.111598524880394,Nc1ccccc1C(=O)CC(N)C(=O)O.O=C(O)C(=O)CS,Nc1ccccc1C(=O)CC(=O)C(=O)O,4.111598524880394,Nc1ccccc1C(=O)CC(N)C(=O)O.O=C(O)C(=O)CS__MNYARFITAASAARNPSPIRTMTDILSRGPKSMISLAGGLPNPNMFPFKTAVITVENGKTIQFGEEMMKRALQYSPSAGIPELLSWLKQLQIKLHNPPTIHYPPSQGQMDLCVTSGSQQGLCKVFEMIINPGDNVLLDEPAYSGTLQSLHPLGCNIINVASDESGIVPDSLRDILSRWKPEDAKNPQKNTPKFLYTVPNGNNPTGNSLTSERKKEIYELARKYDFLIIEDDPYYFLQFNKFRVPTFLSMDVDGRVIRADSFSKIISSGLRIGFLTGPKPLIERVILHIQVSTLHPSTFNQLMISQLLHEWGEEGFMAHVDRVIDFYSNQKDAILAAADKWLTGLAEWHVPAAGMFLWIKVKGINDVKELIEEKAVKMGVLMLPGNAFYVDSSAPSPYLRASFSSASPEQMDVAFQVLAQLIKESL,./data/raw/alphafold//AF-Q8N5Z0-F1-model_v4.pdb,1302,3856,6172,824
+1966,1831,1862,MHSKVTIICIRFLFWFLLLCMLIGKSHTEDDIIIATKNGKVRGMNLTVFGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSDIWNATKYANSCCQNIDQSFPGFHGSEMWNPNTDLSEDCLYLNVWIPAPKPKNATVLIWIYGGGFQTGTSSLHVYDGKFLARVERVIVVSMNYRVGALGFLALPGNPEAPGNMGLFDQQLALQWVQKNIAAFGGNPKSVTLFGESAGAASVSLHLLSPGSHSLFTRAILQSGSFNAPWAVTSLYEARNRTLNLAKLTGCSRENETEIIKCLRNKDPQEILLNEAFVVPYGTPLSVNFGPTVDGDFLTDMPDILLELGQFKKTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPGVSEFGKESILFHYTDWVDDQRPENYREALGDVVGDYNFICPALEFTKKFSEWGNNAFFYYFEHRSSKLPWPEWMGVMHGYEIEFVFGLPLERRDNYTKAEEILSRSIVKRWANFAKYGNPNETQNNSTSWPVFKSTEQKYLTLNTESTRIMTKLRAQQCRFWTSFFPKVLEMTGNIDEAEWEWKAGFHRWNNYMMDWKNQFNDYTSKKESCVGL,brenda,P06276,CC(=O)O[C@H]1C=C[C@H]2[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3C)[C@H]1O5.O>>CC(=O)O.CN1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5,0.0042,0.0,37.0,7.4,3.1.1.8,9606.0,-2.3767507096021,CC(=O)O[C@H]1C=C[C@H]2[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3C)[C@H]1O5.O,CC(=O)O.CN1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5,-2.3767507096021,CC(=O)O[C@H]1C=C[C@H]2[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3C)[C@H]1O5.O__MHSKVTIICIRFLFWFLLLCMLIGKSHTEDDIIIATKNGKVRGMNLTVFGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSDIWNATKYANSCCQNIDQSFPGFHGSEMWNPNTDLSEDCLYLNVWIPAPKPKNATVLIWIYGGGFQTGTSSLHVYDGKFLARVERVIVVSMNYRVGALGFLALPGNPEAPGNMGLFDQQLALQWVQKNIAAFGGNPKSVTLFGESAGAASVSLHLLSPGSHSLFTRAILQSGSFNAPWAVTSLYEARNRTLNLAKLTGCSRENETEIIKCLRNKDPQEILLNEAFVVPYGTPLSVNFGPTVDGDFLTDMPDILLELGQFKKTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPGVSEFGKESILFHYTDWVDDQRPENYREALGDVVGDYNFICPALEFTKKFSEWGNNAFFYYFEHRSSKLPWPEWMGVMHGYEIEFVFGLPLERRDNYTKAEEILSRSIVKRWANFAKYGNPNETQNNSTSWPVFKSTEQKYLTLNTESTRIMTKLRAQQCRFWTSFFPKVLEMTGNIDEAEWEWKAGFHRWNNYMMDWKNQFNDYTSKKESCVGL,./data/raw/alphafold//AF-P06276-F1-model_v4.pdb,1568,1137,973,1159
+1967,1178,1205,MFTGSIVAIVTPMDEKGNVCRASLKKLIDYHVASGTSAIVSVGTTGESATLNHDEHADVVMMTLDLADGRIPVIAGTGANATAEAISLTQRFNDSGIVGCLTVTPYYNRPSQEGLYQHFKAIAEHTDLPQILYNVPSRTGCDLLPETVGRLAKVKNIIGIKEATGNLTRVNQIKELVSDDFVLLSGDDASALDFMQLGGHGVISVTANVAARDMAQMCKLAAEGHFAEARVINQRLMPLHNKLFVEPNPIPVKWACKELGLVATDTLRLPMTPITDSGRETVRAALKHAGLL,sabio,P0A6L2,CC(=O)C(=O)O.NC(CC=O)C(=O)O>>O.O=C(O)C1=N[C@H](C(=O)O)C[C@H](O)C1,124.0,6.9096762300049625e-15,30.0,,4.3.3.7,562.0,2.093421685162235,CC(=O)C(=O)O.NC(CC=O)C(=O)O,O.O=C(O)C1=N[C@H](C(=O)O)C[C@H](O)C1,2.093421685162235,CC(=O)C(=O)O.NC(CC=O)C(=O)O__MFTGSIVAIVTPMDEKGNVCRASLKKLIDYHVASGTSAIVSVGTTGESATLNHDEHADVVMMTLDLADGRIPVIAGTGANATAEAISLTQRFNDSGIVGCLTVTPYYNRPSQEGLYQHFKAIAEHTDLPQILYNVPSRTGCDLLPETVGRLAKVKNIIGIKEATGNLTRVNQIKELVSDDFVLLSGDDASALDFMQLGGHGVISVTANVAARDMAQMCKLAAEGHFAEARVINQRLMPLHNKLFVEPNPIPVKWACKELGLVATDTLRLPMTPITDSGRETVRAALKHAGLL,./data/raw/alphafold//AF-P0A6L2-F1-model_v4.pdb,1296,5253,1646,792
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+1969,4633,4689,MKYEKLLPRFLEYVKVNTRSDENSTTTPSTQALVEFAHKMGEDMKALGLKDVHYLESNGYVIGTIPANTDKKVRKIGLLAHLDTADFNAEGVNPQILENYDGESVIKLGDTEFTLDPKDFPNLKNYKGQTLVHTDGTTLLGSDDKSGVAEIMTLADYLLNINPDFEHGEIRVGFGPDEEIGVGADKFDVADFDVDFAYTVDGGPLGELQYETFSAAGAVIEFQGKNVHPGTAKNTMVNALQLAIDYHNALPEFDRPEKTEGREGFFHLLKLDGTPEEARAQYIIRDHEEGKFNERKALMQEIADKMNAELGQNRVKPVIKDQYYNMAQIIEKDMSIIDIAKKAMENLDIVPIIEPIRGGTDGSKISFMGLPTPNLFAGGENMHGRFEFVSVQTMEKAVDTLLEIIRLNNEVVK,sabio,Q76HM5,CC(N=C(O)CN=C(O)CN)C(=O)O.O>>CC(N=C(O)CN)C(=O)O.NCC(=O)O,507.0,1.281914431287476e-14,37.0,7.5,3.4.11.-,44688.0,2.705007959333336,CC(N=C(O)CN=C(O)CN)C(=O)O.O,CC(N=C(O)CN)C(=O)O.NCC(=O)O,2.705007959333336,CC(N=C(O)CN=C(O)CN)C(=O)O.O__MKYEKLLPRFLEYVKVNTRSDENSTTTPSTQALVEFAHKMGEDMKALGLKDVHYLESNGYVIGTIPANTDKKVRKIGLLAHLDTADFNAEGVNPQILENYDGESVIKLGDTEFTLDPKDFPNLKNYKGQTLVHTDGTTLLGSDDKSGVAEIMTLADYLLNINPDFEHGEIRVGFGPDEEIGVGADKFDVADFDVDFAYTVDGGPLGELQYETFSAAGAVIEFQGKNVHPGTAKNTMVNALQLAIDYHNALPEFDRPEKTEGREGFFHLLKLDGTPEEARAQYIIRDHEEGKFNERKALMQEIADKMNAELGQNRVKPVIKDQYYNMAQIIEKDMSIIDIAKKAMENLDIVPIIEPIRGGTDGSKISFMGLPTPNLFAGGENMHGRFEFVSVQTMEKAVDTLLEIIRLNNEVVK,./data/raw/alphafold//AF-Q76HM5-F1-model_v4.pdb,1818,1497,3069,2077
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+1986,8554,8686,MRPSIHRTAIAAVLATAFVAGTALAQKRDNVLFQAATDEQPAVIKTLEKLVNIETGTGDAEGIAAAGNFLEAELKNLGFTVTRSKSAGLVVGDNIVGKIKGRGGKNLLLMSHMDTVYLKGILAKAPFRVEGDKAYGPGIADDKGGNAVILHTLKLLKEYGVRDYGTITVLFNTDEEKGSFGSRDLIQEEAKLADYVLSFEPTSAGDEKLSLGTSGIAYVQVNITGKASHAGAAPELGVNALVEASDLVLRTMNIDDKAKNLRFNWTIAKAGNVSNIIPASATLNADVRYARNEDFDAAMKTLEERAQQKKLPEADVKVIVTRGRPAFNAGEGGKKLVDKAVAYYKEAGGTLGVEERTGGGTDAAYAALSGKPVIESLGLPGFGYHSDKAEYVDISAIPRRLYMAARLIMDLGAGK,brenda,P06621,CN(Cc1cnc2nc(=N)[nH]c(N)c2n1)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1.O>>CN(Cc1cnc2nc(=N)[nH]c(N)c2n1)c1ccc(C(=O)O)cc1.N[C@@H](CCC(=O)O)C(=O)O,24.83,1.8027902514623164e-14,37.0,7.3,3.4.17.11,312.0,1.3949767195545644,CN(Cc1cnc2nc(=N)[nH]c(N)c2n1)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1.O,CN(Cc1cnc2nc(=N)[nH]c(N)c2n1)c1ccc(C(=O)O)cc1.N[C@@H](CCC(=O)O)C(=O)O,1.3949767195545644,CN(Cc1cnc2nc(=N)[nH]c(N)c2n1)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1.O__MRPSIHRTAIAAVLATAFVAGTALAQKRDNVLFQAATDEQPAVIKTLEKLVNIETGTGDAEGIAAAGNFLEAELKNLGFTVTRSKSAGLVVGDNIVGKIKGRGGKNLLLMSHMDTVYLKGILAKAPFRVEGDKAYGPGIADDKGGNAVILHTLKLLKEYGVRDYGTITVLFNTDEEKGSFGSRDLIQEEAKLADYVLSFEPTSAGDEKLSLGTSGIAYVQVNITGKASHAGAAPELGVNALVEASDLVLRTMNIDDKAKNLRFNWTIAKAGNVSNIIPASATLNADVRYARNEDFDAAMKTLEERAQQKKLPEADVKVIVTRGRPAFNAGEGGKKLVDKAVAYYKEAGGTLGVEERTGGGTDAAYAALSGKPVIESLGLPGFGYHSDKAEYVDISAIPRRLYMAARLIMDLGAGK,./data/raw/alphafold//AF-P06621-F1-model_v4.pdb,3451,2358,1079,2989
+1987,477,494,NTLANHGFLPRNGRNISVPMIVKAGFEGYNVQSDILITAGKVGMLTSREADTISLEDLKLHGTIEHD,uniprot_search,A0A023H437,C1CCCCC1.OO>>O.OC1CCCCC1,43.0,5.9872487761645155e-15,22.0,7.0,1.11.2.1,182057.0,1.6334684555795866,C1CCCCC1.OO,O.OC1CCCCC1,1.6334684555795866,C1CCCCC1.OO__NTLANHGFLPRNGRNISVPMIVKAGFEGYNVQSDILITAGKVGMLTSREADTISLEDLKLHGTIEHD,./data/raw/alphafold//AF-A0A023H437-F1-model_v4.pdb,1078,647,324,363
+1988,21510,21834,RGKIIRLHILTDGRDVLDGSSVGFVETIENDLAQLREQGVDARIASGGGRMYVTMDRYENDWSVVKRGWDAQVLGEAPHKFQNALEAVKTLRAEPKANDQYLPPFVIVDESGKSVGPIVDGDAVVTFNFRADRMVMLAKALEFPDFDKFDRVRVPKIKYAGMLQYDGELKLPSKYLVSPPLIERTSGEYLVKNGVRTFACSETVKFGHVTFFWNGNRSGYFDETREEYVEIPSDSGITFNEQPKMXALEIAERTRDAILSGKV,sabio,Q7XYD2,O=C(O)[C@H](O)COP(=O)(O)O>>O=C(O)C(CO)OP(=O)(O)O,950.0,0.0,30.0,7.0,5.4.2.12,4565.0,2.977723605288848,O=C(O)[C@H](O)COP(=O)(O)O,O=C(O)C(CO)OP(=O)(O)O,2.977723605288848,O=C(O)[C@H](O)COP(=O)(O)O__RGKIIRLHILTDGRDVLDGSSVGFVETIENDLAQLREQGVDARIASGGGRMYVTMDRYENDWSVVKRGWDAQVLGEAPHKFQNALEAVKTLRAEPKANDQYLPPFVIVDESGKSVGPIVDGDAVVTFNFRADRMVMLAKALEFPDFDKFDRVRVPKIKYAGMLQYDGELKLPSKYLVSPPLIERTSGEYLVKNGVRTFACSETVKFGHVTFFWNGNRSGYFDETREEYVEIPSDSGITFNEQPKMXALEIAERTRDAILSGKV,./data/raw/esmfold//ESMFold-Q7XYD2-v1.pdb,669,53,5764,6667
+1989,3336,3384,MIVGYRSTIITLSHPKLGNGKTISSNAIFQRSCRVRCSHSTTSSMNGFEDARDRIRESFGKLELSPSSYDTAWVAMVPSRHSLNEPCFPQCLDWIIENQREDGSWGLNPTHPLLLKDSLSSTLACLLALTKWRVGDEQIKRGLGFIETYGWAVDNKDQISPLGFEVIFSSMIKSAEKLDLNLPLNLHLVNLVKCKRDSTIKRNVEYMGEGVGELCDWKEMIKLHQRQNGSLFDSPATTAAALIYHQHDQKCYQYLNSIFQQHKNWVPTMYPTKVHSLLCLVDTLQNLGVHRHFKSEIKKALDEIYRLWQQKNEQIFSNVTHCAMAFRLLRMSYYDVSSDELAEFVDEEHFFATNGKYKSHVEILELHKASQLAIDHEKDDILDKINNWTRAFMEQKLLNNGFIDRMSKKEVELALRKFYTTSHLAENRRYIKSYEENNFKILKAAYRSPNINNKDLLAFSIHDFELCQAQHREELQQLKRWFEDYRLDQLGLAERYIHASYLFGVTVIPEPELSDARLMYAKYVMLLTIVDDHFESFASKDECFNIIELVERWDDYASVGYKSEKVKVFFSVFYKSIEELATIAEIKQGRSVKNHLINLWLELMKLMLMERVEWCSGKTIPSIEEYLYVTSITFCAKLIPLSTQYFLGIKISKDLLESDEICGLWNCSGRVMRILNDLQDSKREQKEVSINLVTLLMKSMSEEEAIMKIKEILEMNRRELLKMVLVQKKGSQLPQLCKDIFWRTSKWAHFTYSQTDGYRIAEEMKNHIDEVFYKPLNH,brenda,C1K5M3,CC(C)=CCC/C(C)=C\COP(=O)(O)OP(=O)(O)O>>C=C1C=CC(C(C)C)CC1.O=P(O)(O)OP(=O)(O)O,4.1,0.0,30.0,8.0,4.2.3.51,4081.0,0.6127838567197355,CC(C)=CCC/C(C)=C\COP(=O)(O)OP(=O)(O)O,C=C1C=CC(C(C)C)CC1.O=P(O)(O)OP(=O)(O)O,0.6127838567197355,CC(C)=CCC/C(C)=C\COP(=O)(O)OP(=O)(O)O__MIVGYRSTIITLSHPKLGNGKTISSNAIFQRSCRVRCSHSTTSSMNGFEDARDRIRESFGKLELSPSSYDTAWVAMVPSRHSLNEPCFPQCLDWIIENQREDGSWGLNPTHPLLLKDSLSSTLACLLALTKWRVGDEQIKRGLGFIETYGWAVDNKDQISPLGFEVIFSSMIKSAEKLDLNLPLNLHLVNLVKCKRDSTIKRNVEYMGEGVGELCDWKEMIKLHQRQNGSLFDSPATTAAALIYHQHDQKCYQYLNSIFQQHKNWVPTMYPTKVHSLLCLVDTLQNLGVHRHFKSEIKKALDEIYRLWQQKNEQIFSNVTHCAMAFRLLRMSYYDVSSDELAEFVDEEHFFATNGKYKSHVEILELHKASQLAIDHEKDDILDKINNWTRAFMEQKLLNNGFIDRMSKKEVELALRKFYTTSHLAENRRYIKSYEENNFKILKAAYRSPNINNKDLLAFSIHDFELCQAQHREELQQLKRWFEDYRLDQLGLAERYIHASYLFGVTVIPEPELSDARLMYAKYVMLLTIVDDHFESFASKDECFNIIELVERWDDYASVGYKSEKVKVFFSVFYKSIEELATIAEIKQGRSVKNHLINLWLELMKLMLMERVEWCSGKTIPSIEEYLYVTSITFCAKLIPLSTQYFLGIKISKDLLESDEICGLWNCSGRVMRILNDLQDSKREQKEVSINLVTLLMKSMSEEEAIMKIKEILEMNRRELLKMVLVQKKGSQLPQLCKDIFWRTSKWAHFTYSQTDGYRIAEEMKNHIDEVFYKPLNH,./data/raw/alphafold//AF-C1K5M3-F1-model_v4.pdb,1759,1421,2468,1724
+1990,12315,12484,MARGQLILIEGLDRSGKSTQASILSTKLSPSKLIKFPDRSTPIGKLINEYLTNKSFTLSDQAAHLLFSANRWELSQQIQDLLNQGYFIILDRYIYSGIAYTLAKNDFHDETISQGKNKQQLNNIDWLLSPDKGLPKPDLTLFLTLDLEEISKRKGWGDERYELQQFQAKVKQCFLEILDTNKDPTIRIVDVGGKTIDQVTTQLWEIIETNKNHELINDSIQFIT,brenda,Q59TV7,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,8.7,0.0,30.0,7.5,2.7.4.9,5476.0,0.9395192526186184,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,0.9395192526186184,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__MARGQLILIEGLDRSGKSTQASILSTKLSPSKLIKFPDRSTPIGKLINEYLTNKSFTLSDQAAHLLFSANRWELSQQIQDLLNQGYFIILDRYIYSGIAYTLAKNDFHDETISQGKNKQQLNNIDWLLSPDKGLPKPDLTLFLTLDLEEISKRKGWGDERYELQQFQAKVKQCFLEILDTNKDPTIRIVDVGGKTIDQVTTQLWEIIETNKNHELINDSIQFIT,./data/raw/alphafold//AF-Q59TV7-F1-model_v4.pdb,2048,4216,4087,3935
+1991,12362,12532,MPSDSLMPKSDSFNARVRGASHIDFKTSTTGVAAKAMRNELSGLVNTVKDPETRKAFDTEMQSFFYLFTRYLSERARRQELDWDRIKSPSEDKIVPYAKLSSGSPINLNKLAVLKVNGGLGTSMGMTGAKSALEVKDDMTFLDLTVRQIEHLNTTHRVDVPLILMTSFNTHEDTLRIIKKYANQQLRITTFNQSRYPRIFKETLLPCPHTAEDEKKHWYPPGHGDLYNALLHSGVLDQLLAEGKEYLFVSNSDNLGAVVDDKILQHMIDSQAEFIMEVTDKTKADIKGGTLIDYEGSIRLLEVAQVPNEHVEDFKSVRKFKIFNTNNLWINLRALKRIMESEGMELDIIVNPKTTDDGQAVIQLETAAGDAIKHFNNAHGVNVPRSRFLPVKSCSDLLLIKSDIYSLQHGQLVINPQRMFETTPVIKLGDHFKKIAQFQKRFKKIPTIIELDHLTVTGDVYFGRNVTLRGTVIVVANEGQSIHIPDGCVLENRLLSGNLNLIEL,uniprot_search,A0A097RN49,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,33.11,0.0,20.0,5.4,2.7.7.9,5315.0,1.5199591807520685,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,1.5199591807520685,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__MPSDSLMPKSDSFNARVRGASHIDFKTSTTGVAAKAMRNELSGLVNTVKDPETRKAFDTEMQSFFYLFTRYLSERARRQELDWDRIKSPSEDKIVPYAKLSSGSPINLNKLAVLKVNGGLGTSMGMTGAKSALEVKDDMTFLDLTVRQIEHLNTTHRVDVPLILMTSFNTHEDTLRIIKKYANQQLRITTFNQSRYPRIFKETLLPCPHTAEDEKKHWYPPGHGDLYNALLHSGVLDQLLAEGKEYLFVSNSDNLGAVVDDKILQHMIDSQAEFIMEVTDKTKADIKGGTLIDYEGSIRLLEVAQVPNEHVEDFKSVRKFKIFNTNNLWINLRALKRIMESEGMELDIIVNPKTTDDGQAVIQLETAAGDAIKHFNNAHGVNVPRSRFLPVKSCSDLLLIKSDIYSLQHGQLVINPQRMFETTPVIKLGDHFKKIAQFQKRFKKIPTIIELDHLTVTGDVYFGRNVTLRGTVIVVANEGQSIHIPDGCVLENRLLSGNLNLIEL,./data/raw/alphafold//AF-A0A097RN49-F1-model_v4.pdb,2072,4251,4128,3979
+1992,6859,6975,MIRIFQTVLLAIVSAIVGFMIISITFVEYWSHTEAGKVPPKTAVLLHAIHHNLVTPDMRPPKFLTQSNGHSRFKTELIQIPVSDGASIPARVYQPKASGPHPIILYYHGGAFLEGYGDINTHDNIVRALAVRTGSIVVAVGYRVAPGHPFPTAIEDSYDALDWISKNAELFNGDPANVAVVGDSAGGNIATVVSLMARDREGPEISAQVLLYPLTTFQDVAFPSRDHYDSGYYLLSRAVMVQAREKYTPQQESWLNPYTSPLNADLEGVPPAFVVTAEFDPLRDEGEMYAQSLADAGVPVQAIRYNGVMHGFVSFYEVMERGDDALHQASMFLKKSFYDDMDAKPYELVIDDVPSAQVAIKDRLEAYAIGGFLIGKQSLSLFSGW,brenda,Q9KAN9,CCCCCC(=O)OCC(COC(=O)CCCCC)OC(=O)CCCCC.O>>CCCCCC(=O)OCC(CO)OC(=O)CCCCC.CCCCCCCCCC(=O)[O-],2763.0,6.368558047499478,60.0,9.0,3.1.1.79,86665.0,3.441380884916512,CCCCCC(=O)OCC(COC(=O)CCCCC)OC(=O)CCCCC.O,CCCCCC(=O)OCC(CO)OC(=O)CCCCC.CCCCCCCCCC(=O)[O-],3.441380884916512,CCCCCC(=O)OCC(COC(=O)CCCCC)OC(=O)CCCCC.O__MIRIFQTVLLAIVSAIVGFMIISITFVEYWSHTEAGKVPPKTAVLLHAIHHNLVTPDMRPPKFLTQSNGHSRFKTELIQIPVSDGASIPARVYQPKASGPHPIILYYHGGAFLEGYGDINTHDNIVRALAVRTGSIVVAVGYRVAPGHPFPTAIEDSYDALDWISKNAELFNGDPANVAVVGDSAGGNIATVVSLMARDREGPEISAQVLLYPLTTFQDVAFPSRDHYDSGYYLLSRAVMVQAREKYTPQQESWLNPYTSPLNADLEGVPPAFVVTAEFDPLRDEGEMYAQSLADAGVPVQAIRYNGVMHGFVSFYEVMERGDDALHQASMFLKKSFYDDMDAKPYELVIDDVPSAQVAIKDRLEAYAIGGFLIGKQSLSLFSGW,./data/raw/alphafold//AF-Q9KAN9-F1-model_v4.pdb,3271,2103,3768,2627
+1993,8026,8154,MDLTNKNVIFVAALGGIGLDTSRELVKRNLKNFVILDRVENPTALAELKAINPKVNITFHTYDVTVPVAESKKLLKKIFDQLKTVDILINGAGILDDHQIERTIAINFTGLVNTTTAILDFWDKRKGGPGGIIANICSVTGFNAIHQVPVYSASKAAVVSFTNSLAKLAPITGVTAYSINPGITRTPLVHTFNSWLDVEPRVAELLLSHPTQTSEQCGQNFVKAIEANKNGAIWKLDLGTLEAIEWTKHWDSHI,sabio,P10807,CC[C@H](C)CO.NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1>>CC[C@H](C)C=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],2.0,0.0,23.5,9.5,1.1.1.1,7225.0,0.3010299956639812,CC[C@H](C)CO.NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,CC[C@H](C)C=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],0.3010299956639812,CC[C@H](C)CO.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
+1994,5653,5739,MKLNFTGLRALVTGAGRGIGRGTAKALHASGAKVVAVSLINEDLVSLAKECPGIEPVCVDLGDWEATEKALGRIGPVDLLVNNAAVALVQPFIQSTKEVFDRSFNVNVRSVLQVSQMVAKGMINRGVAGSIVNISSMVAYVTFPGLATYSSTKGAITMLTKAMAMELGPYKIRVNSVNPTVVLTDMGKKVSADPEFAKKLKERHPLRKFAEVEDVVNSILFLLSDSSASTSGSGILVDAGYLAS,sabio,Q9Z245,CC12CCC3C(CCC4CC(=O)CCC43C)C1CCC2O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(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+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)c1,0.85,5.937263368307324e-15,25.0,7.0,1.1.1.184,10036.0,-0.0705810742857072,CC12CCC3C(CCC4CC(=O)CCC43C)C1CCC2O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(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+]([C@@H]2O[C@H](COP(=O)(O)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,-0.0705810742857072,CC12CCC3C(CCC4CC(=O)CCC43C)C1CCC2O.NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1.[H]__MKLNFTGLRALVTGAGRGIGRGTAKALHASGAKVVAVSLINEDLVSLAKECPGIEPVCVDLGDWEATEKALGRIGPVDLLVNNAAVALVQPFIQSTKEVFDRSFNVNVRSVLQVSQMVAKGMINRGVAGSIVNISSMVAYVTFPGLATYSSTKGAITMLTKAMAMELGPYKIRVNSVNPTVVLTDMGKKVSADPEFAKKLKERHPLRKFAEVEDVVNSILFLLSDSSASTSGSGILVDAGYLAS,./data/raw/alphafold//AF-Q9Z245-F1-model_v4.pdb,1316,3874,2079,2392
+1995,13094,13269,MAESSEPPVVLLHRPPSLTFMDEILTREFRTLITDTSSSESLPSFFPRHASSARAFVISGRLPVTDELLSHLPSLQILVCTSVGIDHIDLAACKRRGIVITNAGNAFSDDVADCAVGLLISVLRRIPAADRYVRAGNWAKFGDFQLGSKVSGKRVGIVGLGSIGSFVAKRLESFGCVISYNSRSQKQSSPYRYYSDILSLAENNDVLVLCCSLTDETHHIVNREVMESLGKDGVVINVGRGKLIDEKEMVKCLVEGVIGGAGLDVFENEPAVPEELFGLDNVVLSPHFAVATPGSLDNVAQIALANLKAFFSNRPLLSPVQLD,brenda,A0A178WMD4,N=C(O)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)Cc1ccccc1.[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)C(O)Cc1ccccc1,0.61,0.0,30.0,7.0,1.1.1.237,3702.0,-0.2146701649892329,N=C(O)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)Cc1ccccc1.[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)C(O)Cc1ccccc1,-0.2146701649892329,N=C(O)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)Cc1ccccc1.[H+]__MAESSEPPVVLLHRPPSLTFMDEILTREFRTLITDTSSSESLPSFFPRHASSARAFVISGRLPVTDELLSHLPSLQILVCTSVGIDHIDLAACKRRGIVITNAGNAFSDDVADCAVGLLISVLRRIPAADRYVRAGNWAKFGDFQLGSKVSGKRVGIVGLGSIGSFVAKRLESFGCVISYNSRSQKQSSPYRYYSDILSLAENNDVLVLCCSLTDETHHIVNREVMESLGKDGVVINVGRGKLIDEKEMVKCLVEGVIGGAGLDVFENEPAVPEELFGLDNVVLSPHFAVATPGSLDNVAQIALANLKAFFSNRPLLSPVQLD,./data/raw/alphafold//AF-A0A178WMD4-F1-model_v4.pdb,2237,4482,4388,4267
+1996,20169,20458,MYRKLAVISAFLAAARAQQVCTQQAETHPPLTWQKCTASGCTPQQGSVVLDANWRWTHDTKSTTNCYDGNTWSSTLCPDDATCAKNCCLDGANYSGTYGVTTSGDALTLQFVTASNVGSRLYLMANDSTYQEFTLSGNEFSFDVDVSQLPCGLNGALYFVSMDADGGQSKYPGNAAGAKYGTGYCDSQCPRDLKFINGQANVEGWEPSSNNANTGVGGHGSCCSEMDIWEANSISEALTPHPCETVGQTMCSGDSCGGTYSNDRYGGTCDPDGCDWNPYRLGNTSFYGPGSSFALDTTKKLTVVTQFATDGSISRYYVQNGVKFQQPNAQVGSYSGNTINTDYCAAEQTAFGGTSFTDKGGLAQINKAFQGGMVLVMSLWDDYAVNMLWLDSTYPTNATASTPGAKRGSCSTSSGVPAQVEAQSPNSKVIYSNIRFGPIGSTGGNTGSNPPGTSTTRAPPSSTGSSPTATQTHYGQCGGTGWTGPTRCASGYTCQVLNPFYSQCL,brenda,Q9P8P3,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(Cl)c1>>O=[N+]([O-])c1ccc(O)c(Cl)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,0.74,1.1008656664602446e-14,50.0,5.0,3.2.1.176,5544.0,-0.1307682802690238,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(Cl)c1,O=[N+]([O-])c1ccc(O)c(Cl)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,-0.1307682802690238,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c(Cl)c1__MYRKLAVISAFLAAARAQQVCTQQAETHPPLTWQKCTASGCTPQQGSVVLDANWRWTHDTKSTTNCYDGNTWSSTLCPDDATCAKNCCLDGANYSGTYGVTTSGDALTLQFVTASNVGSRLYLMANDSTYQEFTLSGNEFSFDVDVSQLPCGLNGALYFVSMDADGGQSKYPGNAAGAKYGTGYCDSQCPRDLKFINGQANVEGWEPSSNNANTGVGGHGSCCSEMDIWEANSISEALTPHPCETVGQTMCSGDSCGGTYSNDRYGGTCDPDGCDWNPYRLGNTSFYGPGSSFALDTTKKLTVVTQFATDGSISRYYVQNGVKFQQPNAQVGSYSGNTINTDYCAAEQTAFGGTSFTDKGGLAQINKAFQGGMVLVMSLWDDYAVNMLWLDSTYPTNATASTPGAKRGSCSTSSGVPAQVEAQSPNSKVIYSNIRFGPIGSTGGNTGSNPPGTSTTRAPPSSTGSSPTATQTHYGQCGGTGWTGPTRCASGYTCQVLNPFYSQCL,./data/raw/alphafold//AF-Q9P8P3-F1-model_v4.pdb,1951,3462,5385,6265
+1997,413,429,MASHDQEAFLTAMQIVNSSAVDGVLICLIELNVFDIMMQKAGMDGYLHPDEIALNLPTKNPQAPEMLDRMLRILASHSIIKCKLVKKMSGNALLTRAYGLTLISQYFVNAQDGPCLAPYLKLIHHKQMQNSWEKVNEAVLEGGYAFNKAHAGSTFFEYLGKDKSVAELLSQTMAKSIPTSMNILLKSYKGFEGVKEVVDVGGAYAATLSCIISFNPHVKGINFDVPHVIKNAPSLPGITHVGGDMFESVPRGEAIVLQRVLHDWTDEESVKILKKCYEAIPDHGKVVIIEMIQTEMPEDDIIAKNISEMDIRMLLYTPGGKERTVNEFLMLGKQAGFPSSKYICGADLYGVVELYKKK,brenda,B8RCD3,C/C=C/c1ccc(O)c(OC)c1.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/C=C/c1ccc(OC)c(OC)c1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,0.015,0.0894167156034077,25.0,7.5,2.1.1.279,271192.0,-1.8239087409443189,C/C=C/c1ccc(O)c(OC)c1.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/C=C/c1ccc(OC)c(OC)c1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,-1.8239087409443189,C/C=C/c1ccc(O)c(OC)c1.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MASHDQEAFLTAMQIVNSSAVDGVLICLIELNVFDIMMQKAGMDGYLHPDEIALNLPTKNPQAPEMLDRMLRILASHSIIKCKLVKKMSGNALLTRAYGLTLISQYFVNAQDGPCLAPYLKLIHHKQMQNSWEKVNEAVLEGGYAFNKAHAGSTFFEYLGKDKSVAELLSQTMAKSIPTSMNILLKSYKGFEGVKEVVDVGGAYAATLSCIISFNPHVKGINFDVPHVIKNAPSLPGITHVGGDMFESVPRGEAIVLQRVLHDWTDEESVKILKKCYEAIPDHGKVVIIEMIQTEMPEDDIIAKNISEMDIRMLLYTPGGKERTVNEFLMLGKQAGFPSSKYICGADLYGVVELYKKK,./data/raw/alphafold//AF-B8RCD3-F1-model_v4.pdb,3864,613,284,311
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+2014,18962,19247,MRSTLLAFALAVALPAAHTSAAEVPLPQLRAYTVDASWLQPMAPLQIADHTWQIGTEDLTALLVQTPDGAVLLDGGMPQMASHLLDNMKARGVTPRDLRLILLSHAHADHAGPVAELKRRTGAKVAANAESAVLLARGGSDDLHFGDGITYPPANADRIVMDGEVITVGGIVFTAHFMAGHTPGSTAWTWTDTRNGKPVRIAYADSLSAPGYQLQGNPRYPHLIEDYRRSFATVRALPCDVLLTPHPGASNWDYAAGARAGAKALTCKAYADAAEQKFDGQLAKETAGAR,sabio,P52700,O>>,10.0,94.74099395214304,30.0,6.5,3.5.2.6,40324.0,1.0,O,,1.8750612633917,O__MRSTLLAFALAVALPAAHTSAAEVPLPQLRAYTVDASWLQPMAPLQIADHTWQIGTEDLTALLVQTPDGAVLLDGGMPQMASHLLDNMKARGVTPRDLRLILLSHAHADHAGPVAELKRRTGAKVAANAESAVLLARGGSDDLHFGDGITYPPANADRIVMDGEVITVGGIVFTAHFMAGHTPGSTAWTWTDTRNGKPVRIAYADSLSAPGYQLQGNPRYPHLIEDYRRSFATVRALPCDVLLTPHPGASNWDYAAGARAGAKALTCKAYADAAEQKFDGQLAKETAGAR,./data/raw/alphafold//AF-P52700-F1-model_v4.pdb,1443,3060,814,1074
+2015,6190,6299,MSFRLQPAPPARPNRCQLFGPGSRPALFEKMAASAADVINLDLEDSVAPDDKAQARANIIEAINGLDWGRKYLSVRINGLDTPFWYRDVVDLLEQAGDRLDQIMIPKVGCAADVYAVDALVTAIERAKGRTKPLSFEVIIESAAGIAHVEEIAASSPRLQAMSLGAADFAASMGMQTTGIGGTQENYYMLHDGQKHWSDPWHWAQAAIVAACRTHGILPVDGPFGDFSDDEGFRAQARRSATLGMVGKWAIHPKQVALANEVFTPSETAVTEAREILAAMDAAKARGEGATVYKGRLVDIASIKQAEVIVRQAEMISA,brenda,Q3J5L6,CCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.O=CC(=O)O>>C[C@@H](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)[C@H](O)C(=O)O,12.0,6.329015394126529e-15,35.0,7.833333333333333,4.1.3.24,1063.0,1.0791812460476249,CCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.O=CC(=O)O,C[C@@H](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)[C@H](O)C(=O)O,1.0791812460476249,CCC(=O)SCCN=C(O)CCN=C(O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O.O=CC(=O)O__MSFRLQPAPPARPNRCQLFGPGSRPALFEKMAASAADVINLDLEDSVAPDDKAQARANIIEAINGLDWGRKYLSVRINGLDTPFWYRDVVDLLEQAGDRLDQIMIPKVGCAADVYAVDALVTAIERAKGRTKPLSFEVIIESAAGIAHVEEIAASSPRLQAMSLGAADFAASMGMQTTGIGGTQENYYMLHDGQKHWSDPWHWAQAAIVAACRTHGILPVDGPFGDFSDDEGFRAQARRSATLGMVGKWAIHPKQVALANEVFTPSETAVTEAREILAAMDAAKARGEGATVYKGRLVDIASIKQAEVIVRQAEMISA,./data/raw/alphafold//AF-Q3J5L6-F1-model_v4.pdb,1548,1111,945,1285
+2016,10031,10181,MLLAQRRLISLGCRSKPIKTIYSSSKVLGLCTSAKMALKFKNAKRIEGLDSNVWVEFTKLAADPSVVNLGQGFPDISPPSYVKEELSKAAFIDNMNQYTRGFGHPALVKALSCLYGKIYQRQIDPNEEILVAVGAYGSLFNSIQGLVDPGDEVIIMVPFYDCYEPMVRMAGAVPVFIPLRSKPTDGMKWTSSDWTFDPRELESKFSSKTKAIILNTPHNPLGKVYTRQELQVIADLCVKHDTLCISDEVYEWLVYTGHTHVKIATLPGMWERTITIGSAGKTFSVTGWKLGWSIGPAHLIKHLQTVQQNSFYTCATPLQAALAEAFWIDIKRMDDPECYFNSLPKELEVKRDRMVRLLNSVGLKPIVPDGGYFIIADVSSLGADLSDMNSDEPYDYKFVKWMTKHKKLTAIPVSAFCDSKSKPHFEKLVRFCFIKKDSTLDAAEEIFRAWNSQKS,brenda,Q71RI9,CSCC[C@H](N)C(=O)O.O=C(O)CCC(=O)C(=O)O>>CSCCC(=O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O,2.43,0.0,45.0,9.0,2.6.1.7,10090.0,0.3856062735983122,CSCC[C@H](N)C(=O)O.O=C(O)CCC(=O)C(=O)O,CSCCC(=O)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O,0.3856062735983122,CSCC[C@H](N)C(=O)O.O=C(O)CCC(=O)C(=O)O__MLLAQRRLISLGCRSKPIKTIYSSSKVLGLCTSAKMALKFKNAKRIEGLDSNVWVEFTKLAADPSVVNLGQGFPDISPPSYVKEELSKAAFIDNMNQYTRGFGHPALVKALSCLYGKIYQRQIDPNEEILVAVGAYGSLFNSIQGLVDPGDEVIIMVPFYDCYEPMVRMAGAVPVFIPLRSKPTDGMKWTSSDWTFDPRELESKFSSKTKAIILNTPHNPLGKVYTRQELQVIADLCVKHDTLCISDEVYEWLVYTGHTHVKIATLPGMWERTITIGSAGKTFSVTGWKLGWSIGPAHLIKHLQTVQQNSFYTCATPLQAALAEAFWIDIKRMDDPECYFNSLPKELEVKRDRMVRLLNSVGLKPIVPDGGYFIIADVSSLGADLSDMNSDEPYDYKFVKWMTKHKKLTAIPVSAFCDSKSKPHFEKLVRFCFIKKDSTLDAAEEIFRAWNSQKS,./data/raw/alphafold//AF-Q71RI9-F1-model_v4.pdb,1303,3859,6175,827
+2017,8020,8148,MNAGILGVGKYVPEKIVTNFDLEKIMDTSDEWIRTRTGIEERRIARDDEYTHDLAYEAAKVAIKNAGLTPDDIDLFIVATVTQEATFPSVANIIQDRLGAKNAAGMDVEAACAGFTFGVVTAAQFIKTGAYKNIVVVGADKLSKITNWDDRTTAVLFGDGAGAVVMGPVSDDHGLLSFDLGSDGSGGKYLNLDENKKIYMNGREVFRFAVRQMGEASLRVLERAGLEKEDLDLLIPHQANIRIMEASRERLNLPEEKLMKTVHKYGNTSSSSIALALVDAVEEGRIKDNDNVLLVGFGGGLTWGALIIRWGK,brenda,C0LNR0,CC[C@H](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>>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,0.047,10000000.0,30.0,7.4,2.3.1.300,1906951.0,-1.3279021420642825,CC[C@H](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,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,-0.3372421683184259,CC[C@H](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__MNAGILGVGKYVPEKIVTNFDLEKIMDTSDEWIRTRTGIEERRIARDDEYTHDLAYEAAKVAIKNAGLTPDDIDLFIVATVTQEATFPSVANIIQDRLGAKNAAGMDVEAACAGFTFGVVTAAQFIKTGAYKNIVVVGADKLSKITNWDDRTTAVLFGDGAGAVVMGPVSDDHGLLSFDLGSDGSGGKYLNLDENKKIYMNGREVFRFAVRQMGEASLRVLERAGLEKEDLDLLIPHQANIRIMEASRERLNLPEEKLMKTVHKYGNTSSSSIALALVDAVEEGRIKDNDNVLLVGFGGGLTWGALIIRWGK,./data/raw/alphafold//AF-C0LNR0-F1-model_v4.pdb,1792,1465,3032,1780
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+2029,13840,14020,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](CO)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](CO)C(=O)O,8.8,1.937218631514648e-14,37.0,7.4,3.4.24.15,10116.0,0.9444826721501688,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](CO)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](CO)C(=O)O,0.9444826721501688,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](CO)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
+2030,2181,2213,MSLPDGFYIRRMEEGDLEQVTETLKVLTTVGTITPESFSKLIKYWNEATVWNDNEDKKIMQYNPMVIVDKRTETVAATGNIIIERKIIHELGLCGHIEDIAVNSKYQGQGLGKLLIDQLVTIGFDYGCYKIILDCDEKNVKFYEKCGFSNAGVEMQIRK,sabio,P43577,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.NC1C(O)OC(COP(=O)(O)O)C(O)C1O>>CC(=O)NC1C(O)OC(COP(=O)(O)O)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,747.0,0.0,30.0,7.5,2.3.1.4,4932.0,2.873320601815399,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.NC1C(O)OC(COP(=O)(O)O)C(O)C1O,CC(=O)NC1C(O)OC(COP(=O)(O)O)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,2.873320601815399,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.NC1C(O)OC(COP(=O)(O)O)C(O)C1O__MSLPDGFYIRRMEEGDLEQVTETLKVLTTVGTITPESFSKLIKYWNEATVWNDNEDKKIMQYNPMVIVDKRTETVAATGNIIIERKIIHELGLCGHIEDIAVNSKYQGQGLGKLLIDQLVTIGFDYGCYKIILDCDEKNVKFYEKCGFSNAGVEMQIRK,./data/raw/alphafold//AF-P43577-F1-model_v4.pdb,1558,1125,961,1303
+2031,1797,1828,MPSETPQAEVGPTGCPHRSGPHSAKGSLEKGSPEDKEAKEPLWIRPDAPSRCTWQLGRPASESPHHHTAPAKSPKILPDILKKIGDTPMVRINKIGKKFGLKCELLAKCEFFNAGGSVKDRISLRMIEDAERDGTLKPGDTIIEPTSGNTGIGLALAAAVRGYRCIIVMPEKMSSEKVDVLRALGAEIVRTPTNARFDSPESHVGVAWRLKNEIPNSHILDQYRNASNPLAHYDTTADEILQQCDGKLDMLVASVGTGGTITGIARKLKEKCPGCRIIGVDPEGSILAEPEELNQTEQTTYEVEGIGYDFIPTVLDRTVVDKWFKSNDEEAFTFARMLIAQEGLLCGGSAGSTVAVAVKAAQELQEGQRCVVILPDSVRNYMTKFLSDRWMLQKGFLKEEDLTEKKPWWWHLRVQELGLSAPLTVLPTITCGHTIEILREKGFDQAPVVDEAGVILGMVTLGNMLSSLLAGKVQPSDQVGKVIYKQFKQIRLTDTLGRLSHILEMDHFALVVHEQIQYHSTGKSSQRQMVFGVVTAIDLLNFVAAQERDQK,brenda,P35520,CC(=O)OC[C@H](N)C(=O)O.N[C@@H](CCS)C(=O)O>>CC(=O)O.N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O,8.17,0.0,37.0,7.4,4.2.1.22,9606.0,0.9122220565324156,CC(=O)OC[C@H](N)C(=O)O.N[C@@H](CCS)C(=O)O,CC(=O)O.N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O,1.4278105726759902,CC(=O)OC[C@H](N)C(=O)O.N[C@@H](CCS)C(=O)O__MPSETPQAEVGPTGCPHRSGPHSAKGSLEKGSPEDKEAKEPLWIRPDAPSRCTWQLGRPASESPHHHTAPAKSPKILPDILKKIGDTPMVRINKIGKKFGLKCELLAKCEFFNAGGSVKDRISLRMIEDAERDGTLKPGDTIIEPTSGNTGIGLALAAAVRGYRCIIVMPEKMSSEKVDVLRALGAEIVRTPTNARFDSPESHVGVAWRLKNEIPNSHILDQYRNASNPLAHYDTTADEILQQCDGKLDMLVASVGTGGTITGIARKLKEKCPGCRIIGVDPEGSILAEPEELNQTEQTTYEVEGIGYDFIPTVLDRTVVDKWFKSNDEEAFTFARMLIAQEGLLCGGSAGSTVAVAVKAAQELQEGQRCVVILPDSVRNYMTKFLSDRWMLQKGFLKEEDLTEKKPWWWHLRVQELGLSAPLTVLPTITCGHTIEILREKGFDQAPVVDEAGVILGMVTLGNMLSSLLAGKVQPSDQVGKVIYKQFKQIRLTDTLGRLSHILEMDHFALVVHEQIQYHSTGKSSQRQMVFGVVTAIDLLNFVAAQERDQK,./data/raw/alphafold//AF-P35520-F1-model_v4.pdb,1467,1005,822,1143
+2032,13994,14176,MAITVSSRQLFIDGEWRVPILNKRIPNINPSTENIIGDIPAATKEDVDLAVDAAKRAISRKNGRDWSAASGSLRARYLRAIAAKIKEKKDELGKLESIDCGKPLEEALADLDDVVACFEYYAGLAEELDSKQKAPISLPMDTFKSYILKEPIGVVALITPWNYPFLMATWKIAPALAAGCAAILKPSELASVTCLELGEICKEVGLPRGVLNIVTGLGHEAGASLASHPDVDKISFTGSSATGSKIMTTAAQLVKPVSLELGGKSPIVVFEDVDLDKVAEWTVFGCFFTNGQICSATSRLIVHESIAVEFVDKLVKWAENIKISDPLEEGCRLGPIVSEAQYKKVLNCISSAKSEGATILTGGRRPEHLKKGYFVEPTIITDVTTSMQIWREEVFGPVLAVKTFSTEEEAINLANDTHYGLGSAVMSNDLERCERLSKALQAGIVWINCAQPSFIQAPWGGIKRSGFGRELGEWGLENYLSVKQVTRYTSDEPWGWYQPPSKL,brenda,Q8VWZ1,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.NCCCC=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.NCCCC(=O)O.[H+],3.1,7.381543208234003e-15,30.0,9.0,1.2.1.19,3888.0,0.4913616938342727,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.NCCCC=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.NCCCC(=O)O.[H+],0.4913616938342727,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.NCCCC=O.O__MAITVSSRQLFIDGEWRVPILNKRIPNINPSTENIIGDIPAATKEDVDLAVDAAKRAISRKNGRDWSAASGSLRARYLRAIAAKIKEKKDELGKLESIDCGKPLEEALADLDDVVACFEYYAGLAEELDSKQKAPISLPMDTFKSYILKEPIGVVALITPWNYPFLMATWKIAPALAAGCAAILKPSELASVTCLELGEICKEVGLPRGVLNIVTGLGHEAGASLASHPDVDKISFTGSSATGSKIMTTAAQLVKPVSLELGGKSPIVVFEDVDLDKVAEWTVFGCFFTNGQICSATSRLIVHESIAVEFVDKLVKWAENIKISDPLEEGCRLGPIVSEAQYKKVLNCISSAKSEGATILTGGRRPEHLKKGYFVEPTIITDVTTSMQIWREEVFGPVLAVKTFSTEEEAINLANDTHYGLGSAVMSNDLERCERLSKALQAGIVWINCAQPSFIQAPWGGIKRSGFGRELGEWGLENYLSVKQVTRYTSDEPWGWYQPPSKL,./data/raw/alphafold//AF-Q8VWZ1-F1-model_v4.pdb,1760,4665,1650,1375
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+2047,6427,6538,MKNNGGARVVVIGAGFVGASYVFALMNQGIADEIVLIDANESKAIGDAMDFNHGKVFAPKPVDIWHGDYDDCRDADLVVICAGANQKPGETRLDLVDKNIAIFRSIVESVMASGFQGLFLVATNPVDILTYATWKFSGLPHERVIGSGTILDTARFRFLLGEYFSVAPQNVHAYIIGEHGDTELPVWSQAYIGVMPIRKLVESKGEEAQKDLERIFVNVRDAAYQIIEKKGATYYGIAMGLARVTRAILHNENAILTVSAYLDGLYGERDVYIGVPAVINRNGIREVIEIELNDDEKNRFHHSAATLKSVLARAFTR,sabio,P00344,CCCC(=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]>>CCCC(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)c1,17.0,0.0644035135694649,25.0,6.0,1.1.1.27,1422.0,1.230448921378274,CCCC(=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],CCCC(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)c1,1.230448921378274,CCCC(=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]__MKNNGGARVVVIGAGFVGASYVFALMNQGIADEIVLIDANESKAIGDAMDFNHGKVFAPKPVDIWHGDYDDCRDADLVVICAGANQKPGETRLDLVDKNIAIFRSIVESVMASGFQGLFLVATNPVDILTYATWKFSGLPHERVIGSGTILDTARFRFLLGEYFSVAPQNVHAYIIGEHGDTELPVWSQAYIGVMPIRKLVESKGEEAQKDLERIFVNVRDAAYQIIEKKGATYYGIAMGLARVTRAILHNENAILTVSAYLDGLYGERDVYIGVPAVINRNGIREVIEIELNDDEKNRFHHSAATLKSVLARAFTR,./data/raw/alphafold//AF-P00344-F1-model_v4.pdb,1256,5193,1577,704
+2048,10324,10476,MKYNKLSVAVAAFAFAAVSAQNSNVLKYPETKKVSHTDTYFGTQVSDPYRWLEDDRAEDTKAWVQQEVKFTQDYLAQIPFRDQLKKQLMDIWNYEKISAPFKKGKYTYFSKNDGLQAQSVLYRKDAAGKTEVFLDPNKFSEKGTTSLASVSFNKKGTLVAYSISEGGSDWNKIIILDAETKKQLDETLLDVKFSGISWLGDEGFFYSSYDKPKEGSVLSGMTDKHKVYFHKLGTKQSQDELIIGGDKFPRRYIGAYVTDDQRYLVVSAANATNGNELYIKDLKNKTDFIPIITGFDSNVNVADTDGDTLYLFTDKDAPNKRLVKTTIQNPKAETWKDVIAETSEPLEINTGGGYFFATYMKDAIDQVKQYDKNGKLVRAIKLPGSGNASGFGGEKTEKDLYYSFTNYITPPTIFKYNVTTGNSEVYQKPKVKFNPENYVSEQVFYTSSDGTKIPMMISYKKGLKKDGKNPTILYSYGGFNISLQPAFSVVNAIWMENGGIYAVPNIRGGGEYGKKWHDAGTKMQKKNVFNDFIAAGEYLQKNGYTSKEYMALSGRSNGGLLVGATMTMRPDLAKVAFPGVGVLDMLRYNKFTAGAGWAYDYGTAEDSKEMFEYLKSYSPVHNVKAGTCYPSTMVITSDHDDRVVPAHSFKFGSELQAKQSCKNPILIRIETNAGHGAGRSTEQVVAENADLLSFALYEMGIKSLK,uniprot_search,P27028,C[C@@H](N=C(O)OCc1ccccc1)C(=O)N1CCC[C@H]1C(O)=Nc1ccc2ccccc2c1.O>>C[C@@H](N=C(O)OCc1ccccc1)C(=O)N1CCC[C@H]1C(=O)O.Nc1ccc2ccccc2c1,0.147,6.124919602960992e-15,37.0,7.0,3.4.21.26,238.0,-0.8326826652518239,C[C@@H](N=C(O)OCc1ccccc1)C(=O)N1CCC[C@H]1C(O)=Nc1ccc2ccccc2c1.O,C[C@@H](N=C(O)OCc1ccccc1)C(=O)N1CCC[C@H]1C(=O)O.Nc1ccc2ccccc2c1,-0.8326826652518239,C[C@@H](N=C(O)OCc1ccccc1)C(=O)N1CCC[C@H]1C(O)=Nc1ccc2ccccc2c1.O__MKYNKLSVAVAAFAFAAVSAQNSNVLKYPETKKVSHTDTYFGTQVSDPYRWLEDDRAEDTKAWVQQEVKFTQDYLAQIPFRDQLKKQLMDIWNYEKISAPFKKGKYTYFSKNDGLQAQSVLYRKDAAGKTEVFLDPNKFSEKGTTSLASVSFNKKGTLVAYSISEGGSDWNKIIILDAETKKQLDETLLDVKFSGISWLGDEGFFYSSYDKPKEGSVLSGMTDKHKVYFHKLGTKQSQDELIIGGDKFPRRYIGAYVTDDQRYLVVSAANATNGNELYIKDLKNKTDFIPIITGFDSNVNVADTDGDTLYLFTDKDAPNKRLVKTTIQNPKAETWKDVIAETSEPLEINTGGGYFFATYMKDAIDQVKQYDKNGKLVRAIKLPGSGNASGFGGEKTEKDLYYSFTNYITPPTIFKYNVTTGNSEVYQKPKVKFNPENYVSEQVFYTSSDGTKIPMMISYKKGLKKDGKNPTILYSYGGFNISLQPAFSVVNAIWMENGGIYAVPNIRGGGEYGKKWHDAGTKMQKKNVFNDFIAAGEYLQKNGYTSKEYMALSGRSNGGLLVGATMTMRPDLAKVAFPGVGVLDMLRYNKFTAGAGWAYDYGTAEDSKEMFEYLKSYSPVHNVKAGTCYPSTMVITSDHDDRVVPAHSFKFGSELQAKQSCKNPILIRIETNAGHGAGRSTEQVVAENADLLSFALYEMGIKSLK,./data/raw/alphafold//AF-P27028-F1-model_v4.pdb,243,1552,3135,1904
+2049,8285,8414,MAHRPPSPALASVLLALLLSGAARAAEIVGGHEAQPHSRPYMASLQMRGNPGSHFCGGTLIHPSFVLTAAHCLRDIPQRLVNVVLGAHNVRTQEPTQQHFSVAQVFLNNYDAENKLNDVLLIQLSSPANLSASVATVQLPQQDQPVPHGTQCLAMGWGRVGAHDPPAQVLQELNVTVVTFFCRPHNICTFVPRRKAGICFGDSGGPLICDGIIQGIDSFVIWGCATRLFPDFFTRVALYVDWIRSTLRRVEAKGRP,uniprot_search,P24158,CC[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)c1ccccc1N)C(O)=Nc1ccc([N+](=O)[O-])c(C(O)=N[C@@H](CC(=O)O)C(=N)O)c1.O>>CC[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)c1ccccc1N)C(=O)O.N=C(O)[C@H](CC(=O)O)N=C(O)c1cc(N)ccc1[N+](=O)[O-],4.8,1.3448731889915363e-14,25.0,7.5,3.4.21.76,9606.0,0.6812412373755872,CC[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)c1ccccc1N)C(O)=Nc1ccc([N+](=O)[O-])c(C(O)=N[C@@H](CC(=O)O)C(=N)O)c1.O,CC[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)c1ccccc1N)C(=O)O.N=C(O)[C@H](CC(=O)O)N=C(O)c1cc(N)ccc1[N+](=O)[O-],0.6812412373755872,CC[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)c1ccccc1N)C(O)=Nc1ccc([N+](=O)[O-])c(C(O)=N[C@@H](CC(=O)O)C(=N)O)c1.O__MAHRPPSPALASVLLALLLSGAARAAEIVGGHEAQPHSRPYMASLQMRGNPGSHFCGGTLIHPSFVLTAAHCLRDIPQRLVNVVLGAHNVRTQEPTQQHFSVAQVFLNNYDAENKLNDVLLIQLSSPANLSASVATVQLPQQDQPVPHGTQCLAMGWGRVGAHDPPAQVLQELNVTVVTFFCRPHNICTFVPRRKAGICFGDSGGPLICDGIIQGIDSFVIWGCATRLFPDFFTRVALYVDWIRSTLRRVEAKGRP,./data/raw/alphafold//AF-P24158-F1-model_v4.pdb,1869,1572,3137,1906
+2050,8283,8412,MAHRPPSPALASVLLALLLSGAARAAEIVGGHEAQPHSRPYMASLQMRGNPGSHFCGGTLIHPSFVLTAAHCLRDIPQRLVNVVLGAHNVRTQEPTQQHFSVAQVFLNNYDAENKLNDVLLIQLSSPANLSASVATVQLPQQDQPVPHGTQCLAMGWGRVGAHDPPAQVLQELNVTVVTFFCRPHNICTFVPRRKAGICFGDSGGPLICDGIIQGIDSFVIWGCATRLFPDFFTRVALYVDWIRSTLRRVEAKGRP,uniprot_search,P24158,CC[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)c1ccccc1N)C(O)=Nc1ccc([N+](=O)[O-])c(C(O)=N[C@@H](C)C(=N)O)c1.O>>CC[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)c1ccccc1N)C(=O)O.C[C@H](N=C(O)c1cc(N)ccc1[N+](=O)[O-])C(=N)O,2.1,1.4187339200477212e-14,25.0,7.5,3.4.21.76,9606.0,0.3222192947339193,CC[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)c1ccccc1N)C(O)=Nc1ccc([N+](=O)[O-])c(C(O)=N[C@@H](C)C(=N)O)c1.O,CC[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)c1ccccc1N)C(=O)O.C[C@H](N=C(O)c1cc(N)ccc1[N+](=O)[O-])C(=N)O,0.3222192947339193,CC[C@H](N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)c1ccccc1N)C(O)=Nc1ccc([N+](=O)[O-])c(C(O)=N[C@@H](C)C(=N)O)c1.O__MAHRPPSPALASVLLALLLSGAARAAEIVGGHEAQPHSRPYMASLQMRGNPGSHFCGGTLIHPSFVLTAAHCLRDIPQRLVNVVLGAHNVRTQEPTQQHFSVAQVFLNNYDAENKLNDVLLIQLSSPANLSASVATVQLPQQDQPVPHGTQCLAMGWGRVGAHDPPAQVLQELNVTVVTFFCRPHNICTFVPRRKAGICFGDSGGPLICDGIIQGIDSFVIWGCATRLFPDFFTRVALYVDWIRSTLRRVEAKGRP,./data/raw/alphafold//AF-P24158-F1-model_v4.pdb,1869,1572,3137,1906
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+2058,7454,7576,MKLNALSTATHGSRSSPVKLWKFSTSFLLAASIIVSGQSWAAETAKPATDATKAANDALLKELPFDDKTSFDLAHKGFIAPLPAEPIKGEKGNMIWDPSKYGFIKEGEAAPDTTNPSLWRQSQLINISGLFEVTDGIYQVRNYDLSNMTIVEGKDGITIFDPLISQETAKAALDLYYKHRPKKPVVAVIYTHSHVDHYGGVRGVVDEADVKAGKVKIYAPLGFLEHAVAENVMAGTAMSRRASYMYGNLLPPDAKGQLGAGLGTTTSAGTVTLIPPTDIIKETGETHVIDGLTYEFMYAPGSEAPAEMLYYIKEKKALNAAEDSTHTLHNTYSLRGAKIRDPLAWSKYLNEALKLWGDDVQVMYAMHHWPVWGNKEVREQLSLQRDMYRYINDETLRLANKGYTMTEIAEQVKLPKKIATKFSNRGYYGSLNHNVKATYVLYLGWFIGNPATLWELPPADKAKRYVEMMGGADAVLKKAKEYYDKGDFRWVAEVVNHVVFAEPNNQAAKNMQADALEQLGYQAESGPWRNFYLTGAQELRNGVQQLPTPDTASPDTVKAMDLDLFFDFLAMRLKGPDVADKHITLNLDFTDLKQKYTLEMVNGVLNHTEGMQAKNADATVTLTRETLNNVMLKQTTLKDAESSGDIKIEGDKGKLEELMSYMDNFDFWFNIVTP,brenda,F2WP51,CCCCCCCCCCCCOS(=O)(=O)[O-].O.[Na+]>>CCCCCCCCCCCCO.O=S(=O)([O-])[O-].[Na+],4.88,0.1644930090471217,25.0,7.1,3.1.6.21,686578.0,0.6884198220027107,CCCCCCCCCCCCOS(=O)(=O)[O-].O.[Na+],CCCCCCCCCCCCO.O=S(=O)([O-])[O-].[Na+],0.6884198220027107,CCCCCCCCCCCCOS(=O)(=O)[O-].O.[Na+]__MKLNALSTATHGSRSSPVKLWKFSTSFLLAASIIVSGQSWAAETAKPATDATKAANDALLKELPFDDKTSFDLAHKGFIAPLPAEPIKGEKGNMIWDPSKYGFIKEGEAAPDTTNPSLWRQSQLINISGLFEVTDGIYQVRNYDLSNMTIVEGKDGITIFDPLISQETAKAALDLYYKHRPKKPVVAVIYTHSHVDHYGGVRGVVDEADVKAGKVKIYAPLGFLEHAVAENVMAGTAMSRRASYMYGNLLPPDAKGQLGAGLGTTTSAGTVTLIPPTDIIKETGETHVIDGLTYEFMYAPGSEAPAEMLYYIKEKKALNAAEDSTHTLHNTYSLRGAKIRDPLAWSKYLNEALKLWGDDVQVMYAMHHWPVWGNKEVREQLSLQRDMYRYINDETLRLANKGYTMTEIAEQVKLPKKIATKFSNRGYYGSLNHNVKATYVLYLGWFIGNPATLWELPPADKAKRYVEMMGGADAVLKKAKEYYDKGDFRWVAEVVNHVVFAEPNNQAAKNMQADALEQLGYQAESGPWRNFYLTGAQELRNGVQQLPTPDTASPDTVKAMDLDLFFDFLAMRLKGPDVADKHITLNLDFTDLKQKYTLEMVNGVLNHTEGMQAKNADATVTLTRETLNNVMLKQTTLKDAESSGDIKIEGDKGKLEELMSYMDNFDFWFNIVTP,./data/raw/alphafold//AF-F2WP51-F1-model_v4.pdb,3333,2174,3853,2718
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+2061,18213,18473,MIKKIGVLTSGGDAPGMNAAIRGVVRSALTEGLEVMGIYDGYLGLYEDRMVQLDRYSVSDMINRGGTFLGSARFPEFRDENIRAVAIENLKKRGIDALVVIGGDGSYMGAMRLTEMGFPCIGLPGTIDNDIKGTDYTIGFFTALSTVVEAIDRLRDTSSSHQRISVVEVMGRYCGDLTLAAAIAGGCEFVVVPEVEFSREDLVNEIKAGIAKGKKHAIVAITEHMCDVDELAHFIEKETGRETRATVLGHIQRGGSPVPYDRILASRMGAYAIDLLLAGYGGRCVGIQNEQLVHHDIIDAIENMKRPFKGDWLDCAKKLY,sabio,P0A796,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)(CO)C(O)C1O>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)(COP(=O)(O)O)C(O)C1O,120.0,0.0,,8.2,2.7.1.11,562.0,2.0791812460476247,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)(CO)C(O)C1O,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=P(O)(O)OCC1OC(O)(COP(=O)(O)O)C(O)C1O,2.146128035678238,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)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
+2062,8403,8534,MQTCKQWIMPIKGLTIGSLTLLLAACSNHQTDHASHDMMSMDSEWTPNYIKLADYSPPTAVPEGVGEGCEYKIIPPEFKNVATADVLESGNGELNFTMSVAYQQRDIAGCNTWLRNYAYAQGDDAPKAALVGPTLKLKPGDILRFRLENRMPDCDAAPNFLCSGLTHHNHADSSSTPLTDEEAAQMNTPHNFNVTNFHTHGLWVSPSKNSDNVLLELQPGYAFDYEIRIPEDHPQGTFWYHAHVHGSTALQVSSGMAGAIIIEGGDPAKDVGQQPQIKGKVDHTFVMQQVAYDCNGVIEYYDANDVPNNVDVCEIDGKPANIFGPGEWQKTERRTLVNGQVVPRITLKPGEIQRWRFIHAGVRESLKLVTVRNSSTINLLKGIIGESNAIGTLNQIAVDGLNTGQLDEWCSGQPQLNCDIEALQPGYRADYLYQAPTTPGTYWLIDDQASDAKSLQGVFEDKAALMQVVVEGELQTDALPTSSSLASYQAHPTPTATQIAEMDHDTDNTQDMMFYLGSRTSISSITDPMCLTTSDNDLNNGQPGSDLIFSINGLPFGQNPDRDLTLGQWQRWNLCTRGLAPMHPYHIHVNPFYAYRTGPDGEQQGVWRDTLAIEIGDKNAPSNTVAYSENRYPTTLPGIDDPLTVKQMYTGAFVLHCHILDHEDQGMMQKVVLKE,sabio,Q9KJB8,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,2.0,1.4837780463171737,25.0,5.0,1.10.3.2,119864.0,0.3010299956639812,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,1.4583356259919475,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O__MQTCKQWIMPIKGLTIGSLTLLLAACSNHQTDHASHDMMSMDSEWTPNYIKLADYSPPTAVPEGVGEGCEYKIIPPEFKNVATADVLESGNGELNFTMSVAYQQRDIAGCNTWLRNYAYAQGDDAPKAALVGPTLKLKPGDILRFRLENRMPDCDAAPNFLCSGLTHHNHADSSSTPLTDEEAAQMNTPHNFNVTNFHTHGLWVSPSKNSDNVLLELQPGYAFDYEIRIPEDHPQGTFWYHAHVHGSTALQVSSGMAGAIIIEGGDPAKDVGQQPQIKGKVDHTFVMQQVAYDCNGVIEYYDANDVPNNVDVCEIDGKPANIFGPGEWQKTERRTLVNGQVVPRITLKPGEIQRWRFIHAGVRESLKLVTVRNSSTINLLKGIIGESNAIGTLNQIAVDGLNTGQLDEWCSGQPQLNCDIEALQPGYRADYLYQAPTTPGTYWLIDDQASDAKSLQGVFEDKAALMQVVVEGELQTDALPTSSSLASYQAHPTPTATQIAEMDHDTDNTQDMMFYLGSRTSISSITDPMCLTTSDNDLNNGQPGSDLIFSINGLPFGQNPDRDLTLGQWQRWNLCTRGLAPMHPYHIHVNPFYAYRTGPDGEQQGVWRDTLAIEIGDKNAPSNTVAYSENRYPTTLPGIDDPLTVKQMYTGAFVLHCHILDHEDQGMMQKVVLKE,./data/raw/alphafold//AF-Q9KJB8-F1-model_v4.pdb,3411,2301,1009,2904
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+2071,6938,7054,MATFVELSTKAKMPIVGLGTWKSPLGKVKEAVKVAIDAGYRHIDCAYVYQNEHEVGEAIQEKIQEKAVKREDLFIVSKLWPTFFERPLVRKAFEKTLKDLKLSYLDVYLIHWPQGFKSGDDLFPKDDKGNAIGGKATFLDAWEAMEELVDEGLVKALGVSNFSHFQIEKLLNKPGLKYKPVTNQVECHPYLTQEKLIQYCHSKGITVTAYSPLGSPDRPWAKPEDPSLLEDPKIKEIAAKHKKTAAQVLIRFHIQRNVIVIPKSVTPARIVENIQVFDFKLSDEEMATILSFNRNWRACNVLQSSHLEDYPFNAEY,brenda,O60218,CCCCCC/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+]>>,1.34,99.88734412651704,25.0,7.4,1.1.1.21,9606.0,0.1271047983648076,CCCCCC/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+],,0.1271047983648076,CCCCCC/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+]__MATFVELSTKAKMPIVGLGTWKSPLGKVKEAVKVAIDAGYRHIDCAYVYQNEHEVGEAIQEKIQEKAVKREDLFIVSKLWPTFFERPLVRKAFEKTLKDLKLSYLDVYLIHWPQGFKSGDDLFPKDDKGNAIGGKATFLDAWEAMEELVDEGLVKALGVSNFSHFQIEKLLNKPGLKYKPVTNQVECHPYLTQEKLIQYCHSKGITVTAYSPLGSPDRPWAKPEDPSLLEDPKIKEIAAKHKKTAAQVLIRFHIQRNVIVIPKSVTPARIVENIQVFDFKLSDEEMATILSFNRNWRACNVLQSSHLEDYPFNAEY,./data/raw/alphafold//AF-O60218-F1-model_v4.pdb,1329,607,647,301
+2072,19902,20188,MNHSKPRAPVDRRRFLNLVGLAGAGAGAVAAGVRPAAAGATPDPDIVNIPGWTQSLGAGVNNHPYGIPSPFEKDVVRREVTWLTASSESSVSFTPLYALDGIITPNGLCFVRHHGGEAEIDPARHRFMIHGMVDKPLVFTMEDIKRMPGRTNRAYFLECAANSGMEWRGAQLNGCQYTHGMIHNVVYTGVPLRAFLEAAGVKPKGKWVLAEGADASAMTRSIPIEKAMDDCLVAWAMNGEALRPEQGYPLRLVVPGWEGNMWIKWLRRVEIGDQPWGQREETSKYTDLLADGRSRRFTFFMDAKSVVTNPSPQAPLRAKGPNVVSGIAWSGRGTITRVDVSLDGGKNWTTARIEGPALPRSMTRFYLDFDWNGQELLLQSRAMDDSGYLQPTKAELRAVRGENSIYHNNGIQTWLVRSNGEAENVEVS,uniprot_search,Q9LAH5,O.O=S(O)O.O=S(O)O>>O=S(=O)(O)O.[H],33.51,29.43648099992205,25.0,6.0,1.8.2.1,921.0,1.5251744278352717,O.O=S(O)O.O=S(O)O,O=S(=O)(O)O.[H],1.5251744278352717,O.O=S(O)O.O=S(O)O__MNHSKPRAPVDRRRFLNLVGLAGAGAGAVAAGVRPAAAGATPDPDIVNIPGWTQSLGAGVNNHPYGIPSPFEKDVVRREVTWLTASSESSVSFTPLYALDGIITPNGLCFVRHHGGEAEIDPARHRFMIHGMVDKPLVFTMEDIKRMPGRTNRAYFLECAANSGMEWRGAQLNGCQYTHGMIHNVVYTGVPLRAFLEAAGVKPKGKWVLAEGADASAMTRSIPIEKAMDDCLVAWAMNGEALRPEQGYPLRLVVPGWEGNMWIKWLRRVEIGDQPWGQREETSKYTDLLADGRSRRFTFFMDAKSVVTNPSPQAPLRAKGPNVVSGIAWSGRGTITRVDVSLDGGKNWTTARIEGPALPRSMTRFYLDFDWNGQELLLQSRAMDDSGYLQPTKAELRAVRGENSIYHNNGIQTWLVRSNGEAENVEVS,./data/raw/alphafold//AF-Q9LAH5-F1-model_v4.pdb,1203,3006,534,609
+2073,9214,9356,MASKLALISTLIAAIKAQQIGTLTTETHPPLTWQTCTSGGSCTTNNGKVVLDANWRWLHSTSGSTNCYTGNTWNTTLCPDDTTCAQNCALDGADYEGTYGITASGNSLRLNFVTNGSQKNVGSRTYLMKDDTHYQTFNLLNQEFTFDVDVSGLPCGLNGALYMVPMAADGGVSNEPNNKAGAQYGVGYCDSQCPRDLKFIAGSANVQGWEPASNSANSGLGGNGSCCAELDIWEANSISAALTPHSADTVTQTVCNGDDCGGTYSNDRYSGTTDPDGCDFNSYRQGDTSFYGPGKTVDTNSKFTVVTQFLTDSSGNLNEIKRFYVQNGVVIPNSQSTIAGISGNSITQDYCTAQKQVFGDTNTWEDHGGFQSMTNAFKAGMVLVMSLWDDYYADMLWLDSVAYPTDADPSTPGVARGTCSTTSGVPSDIESSAASAYVIYSNIKVGPINSTFSGTPSTGGSSSSSTTLHTTTTSKVSSTPSHTTTTTHTTTTSSNGATQTEWGQCGGQGWTGPTNCVSGTTCKVSNPYYSQCLPN,brenda,A0A088T0J9,CO[C@@H]1[C@@H](O)[C@@H](O)O[C@H](CO)[C@H]1O[C@@H]1O[C@H](COc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@H](O)[C@H]1O>>O=[N+]([O-])c1ccc(O)cc1.OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O,0.19,0.4154919745870485,37.0,5.0,3.2.1.176,1173061.0,-0.721246399047171,CO[C@@H]1[C@@H](O)[C@@H](O)O[C@H](CO)[C@H]1O[C@@H]1O[C@H](COc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@H](O)[C@H]1O,O=[N+]([O-])c1ccc(O)cc1.OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@H]1O,-0.721246399047171,CO[C@@H]1[C@@H](O)[C@@H](O)O[C@H](CO)[C@H]1O[C@@H]1O[C@H](COc2ccc([N+](=O)[O-])cc2)[C@H](O)[C@H](O)[C@H]1O__MASKLALISTLIAAIKAQQIGTLTTETHPPLTWQTCTSGGSCTTNNGKVVLDANWRWLHSTSGSTNCYTGNTWNTTLCPDDTTCAQNCALDGADYEGTYGITASGNSLRLNFVTNGSQKNVGSRTYLMKDDTHYQTFNLLNQEFTFDVDVSGLPCGLNGALYMVPMAADGGVSNEPNNKAGAQYGVGYCDSQCPRDLKFIAGSANVQGWEPASNSANSGLGGNGSCCAELDIWEANSISAALTPHSADTVTQTVCNGDDCGGTYSNDRYSGTTDPDGCDFNSYRQGDTSFYGPGKTVDTNSKFTVVTQFLTDSSGNLNEIKRFYVQNGVVIPNSQSTIAGISGNSITQDYCTAQKQVFGDTNTWEDHGGFQSMTNAFKAGMVLVMSLWDDYYADMLWLDSVAYPTDADPSTPGVARGTCSTTSGVPSDIESSAASAYVIYSNIKVGPINSTFSGTPSTGGSSSSSTTLHTTTTSKVSSTPSHTTTTTHTTTTSSNGATQTEWGQCGGQGWTGPTNCVSGTTCKVSNPYYSQCLPN,./data/raw/alphafold//AF-A0A088T0J9-F1-model_v4.pdb,1951,3462,1207,3134
+2074,22129,22462,MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,brenda,O94219,O=O.OCc1ccccc1>>O=Cc1ccccc1.OO,23.4,0.0,18.5,7.0,1.1.3.7,5323.0,1.3692158574101427,O=O.OCc1ccccc1,O=Cc1ccccc1.OO,1.5365584425715302,O=O.OCc1ccccc1__MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,./data/raw/alphafold//AF-O94219-F1-model_v4.pdb,1050,3522,1297,300
+2075,19826,20112,MHQVVCATTNPAKIQAILQAFHEIFGEGSCHIASVAVESGVPEQPFGSEETRAGARNRVANARRLLPEADFWVAIEAGIDGDSTFSWVVIENASQRGEARSATLPLPAVILEKVREGEALGPVMSRYTGIDEIGRKEGAIGVFTAGKLTRASVYHQAVILALSPFHNAVY,brenda,P39411,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O>>O=P(O)(O)O.O=P([O-])(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c([O-])nc([O-])nc32)[C@H](O)[C@@H]1O,2625.0,0.2793956774975712,25.0,6.7,3.6.1.73,562.0,3.419129307741976,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O,O=P(O)(O)O.O=P([O-])(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c([O-])nc([O-])nc32)[C@H](O)[C@@H]1O,3.419129307741976,O.O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O__MHQVVCATTNPAKIQAILQAFHEIFGEGSCHIASVAVESGVPEQPFGSEETRAGARNRVANARRLLPEADFWVAIEAGIDGDSTFSWVVIENASQRGEARSATLPLPAVILEKVREGEALGPVMSRYTGIDEIGRKEGAIGVFTAGKLTRASVYHQAVILALSPFHNAVY,./data/raw/alphafold//AF-P39411-F1-model_v4.pdb,2507,4940,2014,4868
+2076,5389,5475,MKKLFVLCIFLFLSITASGEVLPDLKIEKLEEGVYLHTSFEEVSGWGVVTKHGLVVLVNNDAYLIDTPFTNKDTEKLVAWFVGRGFTIKGSVSSHFHSDSTGGIEWLNSQSIPTYASELTNELLKKNGKVQATNSFSGVSYWLVKNKIEIFYPGPGHTQDNVVVWLPENKILFGGCFVKPDGLGNLDDANLKAWPKSAKILMSKYGKAKLVVSGHSEIGNASLLKLTWEQAVKGLKESKKPLLPSN,brenda,Q8GIW8,CC1(C)S[C@@H]2[C@H](N=C(O)C(C(=O)O)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O>>,3.7,99.74837766499506,30.0,7.2,3.5.2.6,303.0,0.568201724066995,CC1(C)S[C@@H]2[C@H](N=C(O)C(C(=O)O)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O,,0.568201724066995,CC1(C)S[C@@H]2[C@H](N=C(O)C(C(=O)O)c3ccccc3)C(=O)N2[C@H]1C(=O)O.O__MKKLFVLCIFLFLSITASGEVLPDLKIEKLEEGVYLHTSFEEVSGWGVVTKHGLVVLVNNDAYLIDTPFTNKDTEKLVAWFVGRGFTIKGSVSSHFHSDSTGGIEWLNSQSIPTYASELTNELLKKNGKVQATNSFSGVSYWLVKNKIEIFYPGPGHTQDNVVVWLPENKILFGGCFVKPDGLGNLDDANLKAWPKSAKILMSKYGKAKLVVSGHSEIGNASLLKLTWEQAVKGLKESKKPLLPSN,./data/raw/alphafold//AF-Q8GIW8-F1-model_v4.pdb,1448,985,796,1107
+2077,17306,17537,MPIKRLDTVVVNTGSQNDQHSASVPPVYLSTTFKVDLNNEDAQNYDYSRSGNPTRSVLQHQIGKLYRVPQENVLAVSSGMTTLDVILRGLVLLNGTDNHTPTIIAGDDLYGGTQRLLNFFKQQSHAVSVHVDTSDFEKFKTVFQSLDKVDCVLLESPTNPLCKVVDIPRILRFVKCISPDTTVVVDNTMMSGLNCNPLQLNPGCDVVYESATKYLNGHHDLMGGVIISKTPEIASKLYFVINSTGAGLSPMDSWLLVRGLKTLGVRLYQQQRNAMILAHWLENSCGFKPTRTNKATKTRFVGLRSNPDFKLHKSFNNGPGAVLSFETGSFEHSKRLVSSKKLSIWAVTVSFGCVNSLLSMPCKMSHASIDPELRKERDFPEDLVRLCCGIENIVDLKKDLLAAMVDADIIEVRENGKYLFNKLNKNLAVNTTIDDLHKPLSIYEEFYNQDLIRKDSELNIKSSKL,brenda,E3VL26,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O.O>>CC(=O)C(=O)O.N.N[C@@H](CCS)C(=O)O,0.91,5.901983426932362e-15,37.0,8.5,4.4.1.13,4932.0,-0.0409586076789063,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O.O,CC(=O)C(=O)O.N.N[C@@H](CCS)C(=O)O,-0.0409586076789063,N[C@@H](CCSC[C@H](N)C(=O)O)C(=O)O.O__MPIKRLDTVVVNTGSQNDQHSASVPPVYLSTTFKVDLNNEDAQNYDYSRSGNPTRSVLQHQIGKLYRVPQENVLAVSSGMTTLDVILRGLVLLNGTDNHTPTIIAGDDLYGGTQRLLNFFKQQSHAVSVHVDTSDFEKFKTVFQSLDKVDCVLLESPTNPLCKVVDIPRILRFVKCISPDTTVVVDNTMMSGLNCNPLQLNPGCDVVYESATKYLNGHHDLMGGVIISKTPEIASKLYFVINSTGAGLSPMDSWLLVRGLKTLGVRLYQQQRNAMILAHWLENSCGFKPTRTNKATKTRFVGLRSNPDFKLHKSFNNGPGAVLSFETGSFEHSKRLVSSKKLSIWAVTVSFGCVNSLLSMPCKMSHASIDPELRKERDFPEDLVRLCCGIENIVDLKKDLLAAMVDADIIEVRENGKYLFNKLNKNLAVNTTIDDLHKPLSIYEEFYNQDLIRKDSELNIKSSKL,./data/raw/alphafold//AF-E3VL26-F1-model_v4.pdb,2777,5337,2605,5430
+2078,11522,11679,MEPGPDGPAASGPAAIREGWFRETCSLWPGQALSLQVEQLLHHRRSRYQDILVFRSKTYGNVLVLDGVIQCTERDEFSYQEMIANLPLCSHPNPRKVLIIGGGDGGVLREVVKHPSVESVVQCEIDEDVIQVSKKFLPGMAIGYSSSKLTLHVGDGFEFMKQNQDAFDVIITDSSDPMGPAESLFKESYYQLMKTALKEDGVLCCQGECQWLHLDLIKEMRQFCQSLFPVVAYAYCTIPTYPSGQIGFMLCSKNPSTNFQEPVQPLTQQQVAQMQLKYYNSDVHRAAFVLPEFARKALNDVS,sabio,P19623,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCN>>CSCC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCNCCCN,1.9,0.1136174069081229,37.0,7.5,2.5.1.16,9606.0,0.2787536009528289,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCN,CSCC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCNCCCN,0.2787536009528289,C[S+](CCCN)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O.NCCCCN__MEPGPDGPAASGPAAIREGWFRETCSLWPGQALSLQVEQLLHHRRSRYQDILVFRSKTYGNVLVLDGVIQCTERDEFSYQEMIANLPLCSHPNPRKVLIIGGGDGGVLREVVKHPSVESVVQCEIDEDVIQVSKKFLPGMAIGYSSSKLTLHVGDGFEFMKQNQDAFDVIITDSSDPMGPAESLFKESYYQLMKTALKEDGVLCCQGECQWLHLDLIKEMRQFCQSLFPVVAYAYCTIPTYPSGQIGFMLCSKNPSTNFQEPVQPLTQQQVAQMQLKYYNSDVHRAAFVLPEFARKALNDVS,./data/raw/alphafold//AF-P19623-F1-model_v4.pdb,3870,3997,1842,3666
+2079,15377,15601,MLAVHFDKPGGPENLYVKEVAKPSPGEGEVLLKVAASALNRADLMQRQGQYDPPPGASNILGLEASGHVAELGPGCQGHWKIGDTAMALLPGGGQAQYVTVPEGLLMPIPEGLTLTQAAAIPEAWLTAFQLLHLVGNVQAGDYVLIHAGLSGVGTAAIQLTRMAGAIPLVTAGSQKKLQMAEKLGAAAGFNYKKEDFSEATLKFTKGAGVNLILDCIGGSYWEKNVNCLALDGRWVLYGLMGGGDINGPLFSKLLFKRGSLITSLLRSRDNKYKQMLVNAFTEQILPHFSTEGPQRLLPVLDRIYPVTEIQEAHKYMEANKNIGKIVLELPQ,sabio,Q53FA7,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=C1C=Cc2ccccc2C1=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.Oc1ccc2ccccc2c1O,942.0,0.0,25.0,,1.6.5.5,9606.0,2.974050902792877,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=C1C=Cc2ccccc2C1=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.Oc1ccc2ccccc2c1O,2.974050902792877,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=C1C=Cc2ccccc2C1=O.[H]__MLAVHFDKPGGPENLYVKEVAKPSPGEGEVLLKVAASALNRADLMQRQGQYDPPPGASNILGLEASGHVAELGPGCQGHWKIGDTAMALLPGGGQAQYVTVPEGLLMPIPEGLTLTQAAAIPEAWLTAFQLLHLVGNVQAGDYVLIHAGLSGVGTAAIQLTRMAGAIPLVTAGSQKKLQMAEKLGAAAGFNYKKEDFSEATLKFTKGAGVNLILDCIGGSYWEKNVNCLALDGRWVLYGLMGGGDINGPLFSKLLFKRGSLITSLLRSRDNKYKQMLVNAFTEQILPHFSTEGPQRLLPVLDRIYPVTEIQEAHKYMEANKNIGKIVLELPQ,./data/raw/alphafold//AF-Q53FA7-F1-model_v4.pdb,2571,5029,2126,4992
+2080,16497,16725,DDRRSPLEECFQQNDYEEFLEIAKNGLKKTXNPKHVXV,sabio,P0C2D4,NC(CS)C(=O)O.O.O=O>>N.OO,3.04,53.8166553922381,25.0,8.5,1.4.3.2,8649.0,0.4828735836087537,NC(CS)C(=O)O.O.O=O,N.OO,0.4828735836087537,NC(CS)C(=O)O.O.O=O__DDRRSPLEECFQQNDYEEFLEIAKNGLKKTXNPKHVXV,./data/raw/esmfold//ESMFold-P0C2D4-v1.pdb,1799,1474,3043,1791
+2081,17327,17558,MTSRIKIALSDIKKAHERISPYIHFTPYFTSSTLDSIVGRNVFFKAENLQKTGSFKARGALNAVISLKSSNPDVRGVVTHSSGNHGQALAWAAKTANIKCSVVVPNNSPKIKSQAIEGYGAELVFCEPTPADRQGTCERVAKERGYTIIPPYDHNDVIGGQGTIAVEFLKQVPDLDAILVPVSGGGMTSGIAIAAKTIKPDIKVFMVEVEGKMCEECLRAGERLWPNPPRFLNTIADGIRLQQLGELTWPIILELVEKEVFSVKDEDIVKAMKFVFERMKLVIEPASGAGVAAVMSERLAAMDPTLRNVGVILCGGNVDINHLPWY,brenda,A0A0U5AKI6,N[C@@H](CO)C(=O)O>>N[C@H](CO)C(=O)O,0.00178,0.0,30.0,8.0,5.1.1.18,29159.0,-2.749579997691106,N[C@@H](CO)C(=O)O,N[C@H](CO)C(=O)O,-2.749579997691106,N[C@@H](CO)C(=O)O__MTSRIKIALSDIKKAHERISPYIHFTPYFTSSTLDSIVGRNVFFKAENLQKTGSFKARGALNAVISLKSSNPDVRGVVTHSSGNHGQALAWAAKTANIKCSVVVPNNSPKIKSQAIEGYGAELVFCEPTPADRQGTCERVAKERGYTIIPPYDHNDVIGGQGTIAVEFLKQVPDLDAILVPVSGGGMTSGIAIAAKTIKPDIKVFMVEVEGKMCEECLRAGERLWPNPPRFLNTIADGIRLQQLGELTWPIILELVEKEVFSVKDEDIVKAMKFVFERMKLVIEPASGAGVAAVMSERLAAMDPTLRNVGVILCGGNVDINHLPWY,./data/raw/alphafold//AF-A0A0U5AKI6-F1-model_v4.pdb,2779,5342,2610,5436
+2082,17450,17687,MRGLSRRVQAMKPSATVAVNAKALELRRQGVDLVALTAGEPDFDTPEHVKEAARRALAQGKTKYAPPAGIPELREALAEKFRRENGLSVTPEETIVTVGGKQALFNLFQAILDPGDEVIVLSPYWVSYPEMVRFAGGVVVEVETLPEEGFVPDPERVRRAITPRTKALVVNSPNNPTGAVYPKEVLEALARLAVEHDFYLVSDEIYEHLLYEGEHFSPGRVAPEHTLTVNGAAKAFAMTGWRIGYACGPKEVIKAMASVSSQSTTSPDTIAQWATLEALTNQEASRAFVEMAREAYRRRRDLLLEGLTALGLKAVRPSGAFYVLMDTSPIAPDEVRAAERLLEAGVAVVPGTDFAAFGHVRLSYATSEENLRKALERFARVLGRA,brenda,Q56232,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O=C(O)CCC(=O)C(=O)O>>N[C@@H](CCC(=O)O)C(=O)O.O=C(O)C(=O)Cc1c[nH]c2ccccc12,120.0,0.0,25.0,8.0,2.6.1.1,274.0,2.0791812460476247,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O=C(O)CCC(=O)C(=O)O,N[C@@H](CCC(=O)O)C(=O)O.O=C(O)C(=O)Cc1c[nH]c2ccccc12,2.0791812460476247,N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.O=C(O)CCC(=O)C(=O)O__MRGLSRRVQAMKPSATVAVNAKALELRRQGVDLVALTAGEPDFDTPEHVKEAARRALAQGKTKYAPPAGIPELREALAEKFRRENGLSVTPEETIVTVGGKQALFNLFQAILDPGDEVIVLSPYWVSYPEMVRFAGGVVVEVETLPEEGFVPDPERVRRAITPRTKALVVNSPNNPTGAVYPKEVLEALARLAVEHDFYLVSDEIYEHLLYEGEHFSPGRVAPEHTLTVNGAAKAFAMTGWRIGYACGPKEVIKAMASVSSQSTTSPDTIAQWATLEALTNQEASRAFVEMAREAYRRRRDLLLEGLTALGLKAVRPSGAFYVLMDTSPIAPDEVRAAERLLEAGVAVVPGTDFAAFGHVRLSYATSEENLRKALERFARVLGRA,./data/raw/alphafold//AF-Q56232-F1-model_v4.pdb,1293,3842,6158,809
+2083,17106,17336,MLGNLKPQAPDKILALMGEFRADPRQGKIDLGVGVYKDATGHTPIMRAVHAAEQRMLETETTKTYAGLSGEPEFQKAMGELILGDGLKSETTATLATVGGTGALRQALELARMANPDLRVFVSDPTWPNHVSIMNFMGLPVQTYRYFDAETRGVDFEGMKADLAAAKKGDMVLLHGCCHNPTGANLTLDQWAEIASILEKTGALPLIDLAYQGFGDGLEEDAAGTRLIASRIPEVLIAASCSKNFGIYRERTGCLLALCADAATRELAQGAMAFLNRQTYSFPPFHGAKIVSTVLTTPELRADWMAELEAVRSGMLRLREQLAGELRDLSGSDRFGFVAEHRGMFSRLGATPEQVKRIKEEFGIYMVGDSRINIAGLNDNTIPILARAIIEVGV,brenda,P95468,N[C@@H](CC(=O)O)C(=O)O.O=C(O)CCC(=O)C(=O)O>>N[C@@H](CCC(=O)O)C(=O)O.O=C(O)CC(=O)C(=O)O,16.9,0.0,30.0,7.4,2.6.1.57,266.0,1.2278867046136734,N[C@@H](CC(=O)O)C(=O)O.O=C(O)CCC(=O)C(=O)O,N[C@@H](CCC(=O)O)C(=O)O.O=C(O)CC(=O)C(=O)O,1.2278867046136734,N[C@@H](CC(=O)O)C(=O)O.O=C(O)CCC(=O)C(=O)O__MLGNLKPQAPDKILALMGEFRADPRQGKIDLGVGVYKDATGHTPIMRAVHAAEQRMLETETTKTYAGLSGEPEFQKAMGELILGDGLKSETTATLATVGGTGALRQALELARMANPDLRVFVSDPTWPNHVSIMNFMGLPVQTYRYFDAETRGVDFEGMKADLAAAKKGDMVLLHGCCHNPTGANLTLDQWAEIASILEKTGALPLIDLAYQGFGDGLEEDAAGTRLIASRIPEVLIAASCSKNFGIYRERTGCLLALCADAATRELAQGAMAFLNRQTYSFPPFHGAKIVSTVLTTPELRADWMAELEAVRSGMLRLREQLAGELRDLSGSDRFGFVAEHRGMFSRLGATPEQVKRIKEEFGIYMVGDSRINIAGLNDNTIPILARAIIEVGV,./data/raw/alphafold//AF-P95468-F1-model_v4.pdb,1291,3555,1338,3295
+2084,21176,21500,MGHQNAAVSENQNHDDGAASSPGFKLVGFSKFVRKNPKSDKFKVKRFHHIEFWCGDATNVARRFSWGLGMRFSAKSDLSTGNMVHASYLLTSGDLRFLFTAPYSPSLSAGEIKPTTTASIPSFDHGSCRSFFSSHGLGVRAVAIEVEDAESAFSISVANGAIPSSPPIVLNEAVTIAEVKLYGDVVLRYVSYKAEDTEKSEFLPGFERVEDASSFPLDYGIRRLDHAVGNVPELGPALTYVAGFTGFHQFAEFTADDVGTAESGLNSAVLASNDEMVLLPINEPVHGTKRKSQIQTYLEHNEGAGLQHLALMSEDIFRTLREMRKRSSIGGFDFMPSPPPTYYQNLKKRVGDVLSDDQIKECEELGILVDRDDQGTLLQIFTKPLGDRPTIFIEIIQRVGCMMKDEEGKAYQSGGCGGFGKGNFSELFKSIEEYEKTLEAKQLVG,uniprot_search,P93836,O=C(O)C(=O)Cc1ccc(O)cc1.O=O>>O=C(O)Cc1cc(O)ccc1O.O=C=O,0.065,0.0,30.0,7.0,1.13.11.27,3702.0,-1.1870866433571443,O=C(O)C(=O)Cc1ccc(O)cc1.O=O,O=C(O)Cc1cc(O)ccc1O.O=C=O,0.255272505103306,O=C(O)C(=O)Cc1ccc(O)cc1.O=O__MGHQNAAVSENQNHDDGAASSPGFKLVGFSKFVRKNPKSDKFKVKRFHHIEFWCGDATNVARRFSWGLGMRFSAKSDLSTGNMVHASYLLTSGDLRFLFTAPYSPSLSAGEIKPTTTASIPSFDHGSCRSFFSSHGLGVRAVAIEVEDAESAFSISVANGAIPSSPPIVLNEAVTIAEVKLYGDVVLRYVSYKAEDTEKSEFLPGFERVEDASSFPLDYGIRRLDHAVGNVPELGPALTYVAGFTGFHQFAEFTADDVGTAESGLNSAVLASNDEMVLLPINEPVHGTKRKSQIQTYLEHNEGAGLQHLALMSEDIFRTLREMRKRSSIGGFDFMPSPPPTYYQNLKKRVGDVLSDDQIKECEELGILVDRDDQGTLLQIFTKPLGDRPTIFIEIIQRVGCMMKDEEGKAYQSGGCGGFGKGNFSELFKSIEEYEKTLEAKQLVG,./data/raw/alphafold//AF-P93836-F1-model_v4.pdb,600,3327,5642,6535
+2085,16534,16763,MQTCKQWIMPIKGLTIGSLTLLLAACSNHQTDHASHDMMSMDSEWTPNYIKLADYSPPTAVPEGVGEGCEYKIIPPEFKNVATADVLESGNGELNFTMSVAYQQRDIAGCNTWLRNYAYAQGDDAPKAALVGPTLKLKPGDILRFRLENRMPDCDAAPNFLCSGLTHHNHADSSSTPLTDEEAAQMNTPHNFNVTNFHTHGLWVSPSKNSDNVLLELQPGYAFDYEIRIPEDHPQGTFWYHAHVHGSTALQVSSGMAGAIIIEGGDPAKDVGQQPQIKGKVDHTFVMQQVAYDCNGVIEYYDANDVPNNVDVCEIDGKPANIFGPGEWQKTERRTLVNGQVVPRITLKPGEIQRWRFIHAGVRESLKLVTVRNSSTINLLKGIIGESNAIGTLNQIAVDGLNTGQLDEWCSGQPQLNCDIEALQPGYRADYLYQAPTTPGTYWLIDDQASDAKSLQGVFEDKAALMQVVVEGELQTDALPTSSSLASYQAHPTPTATQIAEMDHDTDNTQDMMFYLGSRTSISSITDPMCLTTSDNDLNNGQPGSDLIFSINGLPFGQNPDRDLTLGQWQRWNLCTRGLAPMHPYHIHVNPFYAYRTGPDGEQQGVWRDTLAIEIGDKNAPSNTVAYSENRYPTTLPGIDDPLTVKQMYTGAFVLHCHILDHEDQGMMQKVVLKE,sabio,Q9KJB8,NC(Cc1ccc(O)c(O)c1)C(=O)O.O=O>>O.O=C1C=C2NC(C(=O)O)C=C2CC1=O,20.71,4.081692763973259,,,1.10.3.1,119864.0,1.3161800988934529,NC(Cc1ccc(O)c(O)c1)C(=O)O.O=O,O.O=C1C=C2NC(C(=O)O)C=C2CC1=O,1.3161800988934529,NC(Cc1ccc(O)c(O)c1)C(=O)O.O=O__MQTCKQWIMPIKGLTIGSLTLLLAACSNHQTDHASHDMMSMDSEWTPNYIKLADYSPPTAVPEGVGEGCEYKIIPPEFKNVATADVLESGNGELNFTMSVAYQQRDIAGCNTWLRNYAYAQGDDAPKAALVGPTLKLKPGDILRFRLENRMPDCDAAPNFLCSGLTHHNHADSSSTPLTDEEAAQMNTPHNFNVTNFHTHGLWVSPSKNSDNVLLELQPGYAFDYEIRIPEDHPQGTFWYHAHVHGSTALQVSSGMAGAIIIEGGDPAKDVGQQPQIKGKVDHTFVMQQVAYDCNGVIEYYDANDVPNNVDVCEIDGKPANIFGPGEWQKTERRTLVNGQVVPRITLKPGEIQRWRFIHAGVRESLKLVTVRNSSTINLLKGIIGESNAIGTLNQIAVDGLNTGQLDEWCSGQPQLNCDIEALQPGYRADYLYQAPTTPGTYWLIDDQASDAKSLQGVFEDKAALMQVVVEGELQTDALPTSSSLASYQAHPTPTATQIAEMDHDTDNTQDMMFYLGSRTSISSITDPMCLTTSDNDLNNGQPGSDLIFSINGLPFGQNPDRDLTLGQWQRWNLCTRGLAPMHPYHIHVNPFYAYRTGPDGEQQGVWRDTLAIEIGDKNAPSNTVAYSENRYPTTLPGIDDPLTVKQMYTGAFVLHCHILDHEDQGMMQKVVLKE,./data/raw/alphafold//AF-Q9KJB8-F1-model_v4.pdb,3411,2301,1009,2904
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+2098,18018,18272,MSYSFMSPPNAARFVLSNATVPAVTVVGFTGPSSEGLMKADIVVADGLIKDILPAGTAPAELAKADMRDGMVWPTFADMHTHLDKGHIWERRANPDGSFMGALDAVRSDREANWSAADVRKRMEFSLRAAYAHGTSLIRTHLDSLAPQHRISFEVFSEVREAWKDKIALQAVALFPLDFMVDDAFFADLTTVVREAGGLLGGVTQMNPDIDAQLDKLIRAAAANGLDIDLHVDETEDREVLTLKAIAAAVLRNGFTGKVTAGHCCSLARQDENVAAATIDLVAKAGISIVALPMCNMYLQDRHPGRTPRWRGVTLLHELAAAGVPTAVASDNTRDPFYAYGDLDPVEVFREAVRILHLDHPLDTAARVVTTSPASILGRPDIGRIAVGGPADLVLFSARRWSEFLSRPQSDRVVLRKGKVIDRSLPDYRELDTVIGA,sabio,B9J8S0,Nc1nc2ncc(C(O)C(O)CO)nc2c(=O)[nH]1.O>>N,19.0,87.87889263786714,,7.7,3.5.4.11,358.0,1.2787536009528289,Nc1nc2ncc(C(O)C(O)CO)nc2c(=O)[nH]1.O,N,1.2787536009528289,Nc1nc2ncc(C(O)C(O)CO)nc2c(=O)[nH]1.O__MSYSFMSPPNAARFVLSNATVPAVTVVGFTGPSSEGLMKADIVVADGLIKDILPAGTAPAELAKADMRDGMVWPTFADMHTHLDKGHIWERRANPDGSFMGALDAVRSDREANWSAADVRKRMEFSLRAAYAHGTSLIRTHLDSLAPQHRISFEVFSEVREAWKDKIALQAVALFPLDFMVDDAFFADLTTVVREAGGLLGGVTQMNPDIDAQLDKLIRAAAANGLDIDLHVDETEDREVLTLKAIAAAVLRNGFTGKVTAGHCCSLARQDENVAAATIDLVAKAGISIVALPMCNMYLQDRHPGRTPRWRGVTLLHELAAAGVPTAVASDNTRDPFYAYGDLDPVEVFREAVRILHLDHPLDTAARVVTTSPASILGRPDIGRIAVGGPADLVLFSARRWSEFLSRPQSDRVVLRKGKVIDRSLPDYRELDTVIGA,./data/raw/alphafold//AF-B9J8S0-F1-model_v4.pdb,3081,1838,3466,2274
+2099,8946,9088,MRLLTLLGLLCGSVATPLGPKWPEPVFGRLASPGFPGEYANDQERRWTLTAPPGYRLRLYFTHFDLELSHLCEYDFVKLSSGAKVLATLCGQESTDTERAPGKDTFYSLGSSLDITFRSDYSNEKPFTGFEAFYAAEDIDECQVAPGEAPTCDHHCHNHLGGFYCSCRAGYVLHRNKRTCSALCSGQVFTQRSGELSSPEYPRPYPKLSSCTYSISLEEGFSVILDFVESFDVETHPETLCPYDFLKIQTDREEHGPFCGKTLPHRIETKSNTVTITFVTDESGDHTGWKIHYTSTAQPCPYPMAPPNGHVSPVQAKYILKDSFSIFCETGYELLQGHLPLKSFTAVCQKDGSWDRPMPACSIVDCGPPDDLPSGRVEYITGPGVTTYKAVIQYSCEETFYTMKVNDGKYVCEADGFWTSSKGEKSLPVCEPVCGLSARTTGGRIYGGQKAKPGDFPWQVLILGGTTAAGALLYDNWVLTAAHAVYEQKHDASALDIRMGTLKRLSPHYTQAWSEAVFIHEGYTHDAGFDNDIALIKLNNKVVINSNITPICLPRKEAESFMRTDDIGTASGWGLTQRGFLARNLMYVDIPIVDHQKCTAAYEKPPYPRGSVTANMLCAGLESGGKDSCRGDSGGALVFLDSETERWFVGGIVSWGSMNCGEAGQYGVYTKVINYIPWIENIISDF,uniprot_search,O00187,COC(=O)[C@H](CCCNC(=N)N)NS(=O)(=O)c1ccc(C)cc1.O>>,7.1,99.7233258446862,30.0,7.4,3.4.21.104,9606.0,0.8512583487190752,COC(=O)[C@H](CCCNC(=N)N)NS(=O)(=O)c1ccc(C)cc1.O,,0.8512583487190752,COC(=O)[C@H](CCCNC(=N)N)NS(=O)(=O)c1ccc(C)cc1.O__MRLLTLLGLLCGSVATPLGPKWPEPVFGRLASPGFPGEYANDQERRWTLTAPPGYRLRLYFTHFDLELSHLCEYDFVKLSSGAKVLATLCGQESTDTERAPGKDTFYSLGSSLDITFRSDYSNEKPFTGFEAFYAAEDIDECQVAPGEAPTCDHHCHNHLGGFYCSCRAGYVLHRNKRTCSALCSGQVFTQRSGELSSPEYPRPYPKLSSCTYSISLEEGFSVILDFVESFDVETHPETLCPYDFLKIQTDREEHGPFCGKTLPHRIETKSNTVTITFVTDESGDHTGWKIHYTSTAQPCPYPMAPPNGHVSPVQAKYILKDSFSIFCETGYELLQGHLPLKSFTAVCQKDGSWDRPMPACSIVDCGPPDDLPSGRVEYITGPGVTTYKAVIQYSCEETFYTMKVNDGKYVCEADGFWTSSKGEKSLPVCEPVCGLSARTTGGRIYGGQKAKPGDFPWQVLILGGTTAAGALLYDNWVLTAAHAVYEQKHDASALDIRMGTLKRLSPHYTQAWSEAVFIHEGYTHDAGFDNDIALIKLNNKVVINSNITPICLPRKEAESFMRTDDIGTASGWGLTQRGFLARNLMYVDIPIVDHQKCTAAYEKPPYPRGSVTANMLCAGLESGGKDSCRGDSGGALVFLDSETERWFVGGIVSWGSMNCGEAGQYGVYTKVINYIPWIENIISDF,./data/raw/alphafold//AF-O00187-F1-model_v4.pdb,1418,931,730,1025
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+2101,13940,14121,MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDKLGARVGYIELDPNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVKYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDSWEPELNEAIPNDERDTTMPAAMRTTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRCALPAGWLIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,sabio,O68473,N=C(O)OC[C@@H]1[C@H](N=C(O)/C(=N\OCC(=O)O)c2csc(=N)[nH]2)C(=O)N1S(=O)(=O)O.O>>,0.2,99.79399495287636,,,3.5.2.6,588.0,-0.6989700043360187,N=C(O)OC[C@@H]1[C@H](N=C(O)/C(=N\OCC(=O)O)c2csc(=N)[nH]2)C(=O)N1S(=O)(=O)O.O,,-0.6989700043360187,N=C(O)OC[C@@H]1[C@H](N=C(O)/C(=N\OCC(=O)O)c2csc(=N)[nH]2)C(=O)N1S(=O)(=O)O.O__MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDKLGARVGYIELDPNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVKYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDSWEPELNEAIPNDERDTTMPAAMRTTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRCALPAGWLIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW,./data/raw/alphafold//AF-O68473-F1-model_v4.pdb,1458,402,35,1090
+2102,5322,5408,MKTVFILISMLFPVAVMAQKSVKISDDISITQLSDKVYTYVSLAEIEGWGMVPSNGMIVINNHQAALLDTPINDAQTEMLVNWVTDSLHAKVTTFIPNHWHGDCIGGLGYLQRKGVQSYANQMTIDLAKEKGLPVPEHGFTDSLTVSLDGMPLQCYYLGGGHATDNIVVWLPTENILFGGCMLKDNQATSIGNISDADVTAWPKTLDKVKAKFPSARYVVPGHGDYGGTELIEHTKQIVNQYIESTSKP,sabio,P25910,CC1(C)SC2C(NC(=O)C(NC(=O)N3CCN(S(C)(=O)=O)C3=O)c3ccccc3)C(=O)N2C1C(=O)O.O>>,85.0,99.820983267306,25.0,7.2,3.5.2.6,817.0,1.9294189257142929,CC1(C)SC2C(NC(=O)C(NC(=O)N3CCN(S(C)(=O)=O)C3=O)c3ccccc3)C(=O)N2C1C(=O)O.O,,1.9294189257142929,CC1(C)SC2C(NC(=O)C(NC(=O)N3CCN(S(C)(=O)=O)C3=O)c3ccccc3)C(=O)N2C1C(=O)O.O__MKTVFILISMLFPVAVMAQKSVKISDDISITQLSDKVYTYVSLAEIEGWGMVPSNGMIVINNHQAALLDTPINDAQTEMLVNWVTDSLHAKVTTFIPNHWHGDCIGGLGYLQRKGVQSYANQMTIDLAKEKGLPVPEHGFTDSLTVSLDGMPLQCYYLGGGHATDNIVVWLPTENILFGGCMLKDNQATSIGNISDADVTAWPKTLDKVKAKFPSARYVVPGHGDYGGTELIEHTKQIVNQYIESTSKP,./data/raw/alphafold//AF-P25910-F1-model_v4.pdb,1190,811,517,591
+2103,1991,2022,MEVKILSKKLIKPSSPTPSHLRHLTLTPVDRLAPPIKASNIFYYPAKGSNPAVDVERRNRLETSLSEILTRFYPLAGRYVRESHSVDCNDEGVEYLEAEVEGKLSRLLSRRNEVIEQVIQLAGGEFTNSLASVQVTVFACGGVTIGVRIRHSVVDGFTAAHFSSAWATASRESMDKVIWPSFDLASFLPVKDLPMVKPRPPPKIFGADKVMTRRFIFDGANISSLKAAACDPSFKREPSRVEAVTALIWRALMVVSRAKHGRLRTSLASHAMNLREKIVPPLPGICCGNLYTEVPATFMADSGKTELPNLKDLVGLLREVKFKESVSREDVLLTVIKSTNELHEALGKEDIDVYNFTSWCRFPFYGNDFGWGNPAWMTRCHTPVEMISLQDTECGDGIEAWVTLEKKDMLQFQQDGDIVSFSSNGAP,brenda,D7TU67,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.COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O>>CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O[C@@H]2O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,14.2,0.0,30.0,6.5,2.3.1.215,29760.0,1.1522883443830565,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.COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O[C@@H]2O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O,1.1522883443830565,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.COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O__MEVKILSKKLIKPSSPTPSHLRHLTLTPVDRLAPPIKASNIFYYPAKGSNPAVDVERRNRLETSLSEILTRFYPLAGRYVRESHSVDCNDEGVEYLEAEVEGKLSRLLSRRNEVIEQVIQLAGGEFTNSLASVQVTVFACGGVTIGVRIRHSVVDGFTAAHFSSAWATASRESMDKVIWPSFDLASFLPVKDLPMVKPRPPPKIFGADKVMTRRFIFDGANISSLKAAACDPSFKREPSRVEAVTALIWRALMVVSRAKHGRLRTSLASHAMNLREKIVPPLPGICCGNLYTEVPATFMADSGKTELPNLKDLVGLLREVKFKESVSREDVLLTVIKSTNELHEALGKEDIDVYNFTSWCRFPFYGNDFGWGNPAWMTRCHTPVEMISLQDTECGDGIEAWVTLEKKDMLQFQQDGDIVSFSSNGAP,./data/raw/alphafold//AF-D7TU67-F1-model_v4.pdb,1523,1077,905,1240
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+2111,19997,20283,MTSRYRSSEAHQGLASFSPRRRTVVKAAAATAVLAGPLAAALPARATTGTPAFLHGVASGDPLPDGVLLWTRVTPTADATPGSGLGPDTEVGWTVATDKAFTNVVAKGSTTATAASDHTVKADIRGLAPATDHWFRFSAGGTDSPAGRARTAPAADAAVAGLRFGVVSCANWEAGYFAAYRHLAARGDLDAWLHLGDYIYEYGAGEYGTRGTSVRSHAPAHEILTLADYRVRHGRYKTDPDLQALHAAAPVVAIWDDHEIANDTWSGGAENHTEGVEGAWAARQAAAKQAYFEWMPVRPAIAGTTYRRLRFGKLADLSLLDLRSFRAQQVSLGDGDVDDPDRTLTGRAQLDWLKAGLKSSDTTWRLVGNSVMIAPFAIGSLSAELLKPLAKLLGLPQEGLAVNTDQWDGYTDDRRELLAHLRSNAIRNTVFLTGDIHMAWANDVPVNAGTYPLSASAATEFVVTSVTSDNLDDLVKVPEGTVSALASPVIRAANRHVHWVDTDRHGYGVLDITAERAQMDYYVLSDRTQAGATASWSRSYRTRSGTQRVERTYDPE,sabio,Q8KRU5,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1>>O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,0.7,0.0,,8.0,3.1.4.4,42881.0,-0.1549019599857432,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1,O=P(O)(O)O.O=[N+]([O-])c1ccc(O)cc1,-0.1549019599857432,O.O=[N+]([O-])c1ccc(OP(=O)(O)O)cc1__MTSRYRSSEAHQGLASFSPRRRTVVKAAAATAVLAGPLAAALPARATTGTPAFLHGVASGDPLPDGVLLWTRVTPTADATPGSGLGPDTEVGWTVATDKAFTNVVAKGSTTATAASDHTVKADIRGLAPATDHWFRFSAGGTDSPAGRARTAPAADAAVAGLRFGVVSCANWEAGYFAAYRHLAARGDLDAWLHLGDYIYEYGAGEYGTRGTSVRSHAPAHEILTLADYRVRHGRYKTDPDLQALHAAAPVVAIWDDHEIANDTWSGGAENHTEGVEGAWAARQAAAKQAYFEWMPVRPAIAGTTYRRLRFGKLADLSLLDLRSFRAQQVSLGDGDVDDPDRTLTGRAQLDWLKAGLKSSDTTWRLVGNSVMIAPFAIGSLSAELLKPLAKLLGLPQEGLAVNTDQWDGYTDDRRELLAHLRSNAIRNTVFLTGDIHMAWANDVPVNAGTYPLSASAATEFVVTSVTSDNLDDLVKVPEGTVSALASPVIRAANRHVHWVDTDRHGYGVLDITAERAQMDYYVLSDRTQAGATASWSRSYRTRSGTQRVERTYDPE,./data/raw/alphafold//AF-Q8KRU5-F1-model_v4.pdb,3839,3961,1805,3618
+2112,3745,3795,MGFTVALIQGDGIGPEIVSKSKRILAKINELYSLPIEYIEVEAGDRALARYGEALPKDSLKIIDKADIILKGPVGESAADVVVKLRQIYDMYANIRPAKSIPGIDTKYGNVDILIVRENTEDLYKGFEHIVSDGVAVGMKIITRFASERIAKVGLNFALRRRKKVTCVHKANVMRITDGLFAEACRSVLKGKVEYSEMYVDAAAANLVRNPQMFDVIVTENVYGDILSDEASQIAGSLGIAPSANIGDKKALFEPVHGAAFDIAGKNIGNPTAFLLSVSMMYERMYELSNDDRYIKASRALENAIYLVYKERKALTPDVGGNATTDDLINEIYNKLG,brenda,P50455,CC(C)CC[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)CC[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+],2.7,6.540040828018776e-15,97.0,7.5,1.1.1.85,111955.0,0.4313637641589873,CC(C)CC[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)CC[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+],0.4313637641589873,CC(C)CC[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__MGFTVALIQGDGIGPEIVSKSKRILAKINELYSLPIEYIEVEAGDRALARYGEALPKDSLKIIDKADIILKGPVGESAADVVVKLRQIYDMYANIRPAKSIPGIDTKYGNVDILIVRENTEDLYKGFEHIVSDGVAVGMKIITRFASERIAKVGLNFALRRRKKVTCVHKANVMRITDGLFAEACRSVLKGKVEYSEMYVDAAAANLVRNPQMFDVIVTENVYGDILSDEASQIAGSLGIAPSANIGDKKALFEPVHGAAFDIAGKNIGNPTAFLLSVSMMYERMYELSNDDRYIKASRALENAIYLVYKERKALTPDVGGNATTDDLINEIYNKLG,./data/raw/alphafold//AF-P50455-F1-model_v4.pdb,2912,1631,1668,1396
+2113,8050,8178,MNVFSIFSLVFLAAFGSCADDRRSALEECFREADYEEFLEIARNGLKKTSNPKHVVVVGAGMAGLSAAYVLAGAGHRVTLLEASDRVGGRVNTYRDEKEGWYVNMGPMRLPERHRIVRTYIAKFGLKLNEFFQENENAWYFIRNIRKRVWEVKKDPGVFKYPVKPSEEGKSASQLYRESLKKVIEELKRTNCSYILDKYDTYSTKEYLIKEGNLSRGAVDMIGDLLNEDSSYYLSFIESLKNDDLFSYEKRFDEISDGFDQLPKSMHQAIAEMVHLNAQVIKIQRDAEKVRVAYQTPAKTLSYVTADYVIVCATSRAVRRISFEPPLPPKKAHALRSIHYKSATKIFLTCTRKFWEADGIHGGKSTTDLPSRFIYYPNHNFTSGVGVIVAYVLADDSDFFQALDIKTSADIVINDLSLIHQLPKNEIQALCYPSLIKKWSLDKYTMGALTSFTPYQFQDYIETVAAPVGRIYFAGEYTATVHGWLDSTIKSGLTAARNVNRASQKPSRIHLINDNQL,uniprot_search,A8QL52,CC[C@H](C)[C@H](N)C(=O)O.O.O=O>>CCC(C)C(=O)C(=O)O.N.OO,66.7,7.821570337722915e-15,25.0,8.5,1.4.3.2,8613.0,1.824125833916549,CC[C@H](C)[C@H](N)C(=O)O.O.O=O,CCC(C)C(=O)C(=O)O.N.OO,1.824125833916549,CC[C@H](C)[C@H](N)C(=O)O.O.O=O__MNVFSIFSLVFLAAFGSCADDRRSALEECFREADYEEFLEIARNGLKKTSNPKHVVVVGAGMAGLSAAYVLAGAGHRVTLLEASDRVGGRVNTYRDEKEGWYVNMGPMRLPERHRIVRTYIAKFGLKLNEFFQENENAWYFIRNIRKRVWEVKKDPGVFKYPVKPSEEGKSASQLYRESLKKVIEELKRTNCSYILDKYDTYSTKEYLIKEGNLSRGAVDMIGDLLNEDSSYYLSFIESLKNDDLFSYEKRFDEISDGFDQLPKSMHQAIAEMVHLNAQVIKIQRDAEKVRVAYQTPAKTLSYVTADYVIVCATSRAVRRISFEPPLPPKKAHALRSIHYKSATKIFLTCTRKFWEADGIHGGKSTTDLPSRFIYYPNHNFTSGVGVIVAYVLADDSDFFQALDIKTSADIVINDLSLIHQLPKNEIQALCYPSLIKKWSLDKYTMGALTSFTPYQFQDYIETVAAPVGRIYFAGEYTATVHGWLDSTIKSGLTAARNVNRASQKPSRIHLINDNQL,./data/raw/alphafold//AF-A8QL52-F1-model_v4.pdb,1381,1496,3067,1822
+2114,22364,22698,MFKAVLFDLDGVITDTAEYHFRAWKALAEEIGINGVDRQFNEQLKGVSREDSLQKILDLADKKVSAEEFKELAKRKNDNYVKMIQDVSPADVYPGILQLLKDLRSNKIKIALASASKNGPFLLEKMNLTGYFDAIADPAEVAASKPAPDIFIAAAHAVGVAPSESIGLEDSQAGIQAIKDSGALPIGVGRPEDLGDDIVIVPDTSYYTLEFLKEVWLQKQK,sabio,P71447,O=P(O)(O)OC1OC(CO)C(O)C(O)C1O>>O=P(O)(O)OCC1OC(O)C(O)C(O)C1O,17.0,0.0,25.0,7.0,5.4.2.6,1360.0,1.230448921378274,O=P(O)(O)OC1OC(CO)C(O)C(O)C1O,O=P(O)(O)OCC1OC(O)C(O)C(O)C1O,2.247973266361807,O=P(O)(O)OC1OC(CO)C(O)C(O)C1O__MFKAVLFDLDGVITDTAEYHFRAWKALAEEIGINGVDRQFNEQLKGVSREDSLQKILDLADKKVSAEEFKELAKRKNDNYVKMIQDVSPADVYPGILQLLKDLRSNKIKIALASASKNGPFLLEKMNLTGYFDAIADPAEVAASKPAPDIFIAAAHAVGVAPSESIGLEDSQAGIQAIKDSGALPIGVGRPEDLGDDIVIVPDTSYYTLEFLKEVWLQKQK,./data/raw/alphafold//AF-P71447-F1-model_v4.pdb,890,2690,2999,5849
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+2165,8382,8513,MLAFDFFLQASAGSILPLQALAKADPLEVAEPVTAQILPEGEGTTAMLGFMGSTPGPELRARQGEQFDIDVQNRIEEGSAVHWHGARRDDNMDGVPVMTQDLIEPGDEKEYSFAAPDAATIWYHSHQGSAEQVARGTRGPLIVEMGPPDVDHGDLTVLPDWWIIHEDGVLSDEFTNMSGDAHRGYLGNFARASLSPVEEVAGDDRVRSRVINAATDRIFPLGRQGVDGTVVGLDGMTLVSPRQPSDLTLAPAQRADHIMDATSPDPVGFGLISRDGRYFLPAHDVFGSNTARWPFWIVPLLPNLADEPDAKGHVTLTMGTEDTPLHPLPQAGMMSANIWAFNFLEILPDAPFHSPKRGETHRIQLYNDTGFPHGIHLHGHHFAADGADGSLGFLRDTTLVPAGEQRDLNCVFDNPGRWLVHCHMLGMALGGMDTWVPDAPL,sabio,A0A0H4CVT8,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,34.39,1.4837780463171737,60.0,7.0,1.10.3.2,2725.0,1.5364321758220134,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,1.5364321758220134,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O__MLAFDFFLQASAGSILPLQALAKADPLEVAEPVTAQILPEGEGTTAMLGFMGSTPGPELRARQGEQFDIDVQNRIEEGSAVHWHGARRDDNMDGVPVMTQDLIEPGDEKEYSFAAPDAATIWYHSHQGSAEQVARGTRGPLIVEMGPPDVDHGDLTVLPDWWIIHEDGVLSDEFTNMSGDAHRGYLGNFARASLSPVEEVAGDDRVRSRVINAATDRIFPLGRQGVDGTVVGLDGMTLVSPRQPSDLTLAPAQRADHIMDATSPDPVGFGLISRDGRYFLPAHDVFGSNTARWPFWIVPLLPNLADEPDAKGHVTLTMGTEDTPLHPLPQAGMMSANIWAFNFLEILPDAPFHSPKRGETHRIQLYNDTGFPHGIHLHGHHFAADGADGSLGFLRDTTLVPAGEQRDLNCVFDNPGRWLVHCHMLGMALGGMDTWVPDAPL,./data/raw/alphafold//AF-A0A0H4CVT8-F1-model_v4.pdb,3546,2291,3995,2886
+2166,4682,4740,MVSGTVGRGTALGAVLLALLAVPAQAGTAAAADLPAPDDTGLQAVLHTALSQGAPGAMVRVDDNGTIHQLSEGVADRATGRAITTTDRFRVGSVTKSFSAVVLLQLVDEGKLDLDASVNTYLPGLLPDDRITVRQVMSHRSGLYDYTNDMFAQTVPGFESVRNKVFSYQDLITLSLKHGVTNAPGAAYSYSNTNFVVAGMLIEKLTGHSVATEYQNRIFTPLNLTDTFYVHPDTVIPGTHANGYLTPDEAGGALVDSTEQTVSWAQSAGAVISSTQDLDTFFSALMSGQLMSAAQLAQMQQWTTVNSTQGYGLGLRRRDLSCGISVYGHTGTVQGYYTYAFASKDGKRSVTALANTSNNVNVLNTMARTLESAFCGKPTTAKLRSATSSATTVERHEDIAPGIARD,uniprot_search,P15555,CC(O)=NCCCC[C@H](N=C(C)O)C(O)=N[C@H](C)C(O)=N[C@H](C)C(=O)O.O>>CC(O)=NCCCC[C@H](N=C(C)O)C(O)=N[C@H](C)C(=O)O.C[C@@H](N)C(=O)O,34.5,7.270150799336981e-15,25.0,7.5,3.4.16.4,31952.0,1.5378190950732742,CC(O)=NCCCC[C@H](N=C(C)O)C(O)=N[C@H](C)C(O)=N[C@H](C)C(=O)O.O,CC(O)=NCCCC[C@H](N=C(C)O)C(O)=N[C@H](C)C(=O)O.C[C@@H](N)C(=O)O,1.5378190950732742,CC(O)=NCCCC[C@H](N=C(C)O)C(O)=N[C@H](C)C(O)=N[C@H](C)C(=O)O.O__MVSGTVGRGTALGAVLLALLAVPAQAGTAAAADLPAPDDTGLQAVLHTALSQGAPGAMVRVDDNGTIHQLSEGVADRATGRAITTTDRFRVGSVTKSFSAVVLLQLVDEGKLDLDASVNTYLPGLLPDDRITVRQVMSHRSGLYDYTNDMFAQTVPGFESVRNKVFSYQDLITLSLKHGVTNAPGAAYSYSNTNFVVAGMLIEKLTGHSVATEYQNRIFTPLNLTDTFYVHPDTVIPGTHANGYLTPDEAGGALVDSTEQTVSWAQSAGAVISSTQDLDTFFSALMSGQLMSAAQLAQMQQWTTVNSTQGYGLGLRRRDLSCGISVYGHTGTVQGYYTYAFASKDGKRSVTALANTSNNVNVLNTMARTLESAFCGKPTTAKLRSATSSATTVERHEDIAPGIARD,./data/raw/alphafold//AF-P15555-F1-model_v4.pdb,2962,1702,3314,2115
+2167,841,863,MVTKRVQRMMFAAAACIPLLLGSAPLYAQTSAVQQKLAALEKSSGGRLGVALIDTADNTQVLYRGDERFPMCSTSKVMAAAAVLKQSETQKQLLNQPVEIKPADLVNYNPIAEKHVNGTMTLAELSAAALQYSDNTAMNKLIAQLGGPGGVTAFARAIGDETFRLDRTEPTLNTAIPGDPRDTTTPRAMAQTLRQLTLGHALGETQRAQLVTWLKGNTTGAASIRAGLPTSWTVGDKTGSGDYGTTNDIAVIWPQGRAPLVLVTYFTQPQQNAESRRDVLASAARIIAEGL,sabio,Q9L5C7,C=CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(=NO)c3csc(N)n3)C2SC1.O>>,83.0,99.75870880254416,30.0,7.0,3.5.2.6,562.0,1.919078092376074,C=CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(=NO)c3csc(N)n3)C2SC1.O,,1.919078092376074,C=CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(=NO)c3csc(N)n3)C2SC1.O__MVTKRVQRMMFAAAACIPLLLGSAPLYAQTSAVQQKLAALEKSSGGRLGVALIDTADNTQVLYRGDERFPMCSTSKVMAAAAVLKQSETQKQLLNQPVEIKPADLVNYNPIAEKHVNGTMTLAELSAAALQYSDNTAMNKLIAQLGGPGGVTAFARAIGDETFRLDRTEPTLNTAIPGDPRDTTTPRAMAQTLRQLTLGHALGETQRAQLVTWLKGNTTGAASIRAGLPTSWTVGDKTGSGDYGTTNDIAVIWPQGRAPLVLVTYFTQPQQNAESRRDVLASAARIIAEGL,./data/raw/alphafold//AF-Q9L5C7-F1-model_v4.pdb,1458,649,811,590
+2168,9521,9665,MVDQNKAFGWAANDESGVLSPFHFSRRENGENDVTVKILFCGVCHSDLHTIKNHWGFSRYPIIPGHEIVGIATKVGKNVTKFKEGDRVGVGVIIGSCQSCESCNQDLENYCPKVVFTYNSRSSDGTSRNQGGYSDVIVVDHRFVLSIPDGLPSDSGAPLLCAGITVYSPMKYYGMTKESGKRLGVNGLGGLGHIAVKIGKAFGLRVTVISRSSEKEREAIDRLGADSFLVTTDSQKMKEAVGTMDFIIDTVSAEHALLPLFSLLKVNGKLVALGLPEKPLDLPIFSLVLGRKMVGGSQIGGMKETQEMLEFCAKHKIVSDIELIKMSDINSAMDRLAKSDVRYRFVIDVANSLLPESSAEILTEQVDHGVSITSRF,sabio,Q9SJ25,COc1cc(C=CC=O)cc(O)c1O.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]>>COc1cc(C=CCO)cc(O)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)c1,1.34,0.0,30.0,6.25,1.1.1.195,3702.0,0.1271047983648076,COc1cc(C=CC=O)cc(O)c1O.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],COc1cc(C=CCO)cc(O)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)c1,0.1271047983648076,COc1cc(C=CC=O)cc(O)c1O.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]__MVDQNKAFGWAANDESGVLSPFHFSRRENGENDVTVKILFCGVCHSDLHTIKNHWGFSRYPIIPGHEIVGIATKVGKNVTKFKEGDRVGVGVIIGSCQSCESCNQDLENYCPKVVFTYNSRSSDGTSRNQGGYSDVIVVDHRFVLSIPDGLPSDSGAPLLCAGITVYSPMKYYGMTKESGKRLGVNGLGGLGHIAVKIGKAFGLRVTVISRSSEKEREAIDRLGADSFLVTTDSQKMKEAVGTMDFIIDTVSAEHALLPLFSLLKVNGKLVALGLPEKPLDLPIFSLVLGRKMVGGSQIGGMKETQEMLEFCAKHKIVSDIELIKMSDINSAMDRLAKSDVRYRFVIDVANSLLPESSAEILTEQVDHGVSITSRF,./data/raw/alphafold//AF-Q9SJ25-F1-model_v4.pdb,3542,3496,1262,3210
+2169,5463,5549,MPGVDISFLKKSGRRTMAAAAVIALLGGCGADAGSEPATTAASTTAPSAATDAATAEFAALEQRFGARLGVYAVDTTSGAVVAYRADERFGMASTFKGLACGALLREHPLSSGYFDQVVRYSREEVVSYSPVTETRVDTGMTVAELCHATITVSDNTAGNQILKLLGGPAGFTAFLRSLGDEVSRLDRWETELNEVPPGEERDTTTPAAVAANYRALVLGDVLAEPERAQLRDWLVANTTGDQRIRAGVPAGWTVGDKTGGGSHGGNNDVAVAWTETGDPIVIALLSHRTDPAAKADNALLAEATRAVVTALR,sabio,Q5YXD6,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>>,49.5,99.75213781137688,30.0,7.0,3.5.2.6,37329.0,1.6946051989335686,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,,1.6946051989335686,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__MPGVDISFLKKSGRRTMAAAAVIALLGGCGADAGSEPATTAASTTAPSAATDAATAEFAALEQRFGARLGVYAVDTTSGAVVAYRADERFGMASTFKGLACGALLREHPLSSGYFDQVVRYSREEVVSYSPVTETRVDTGMTVAELCHATITVSDNTAGNQILKLLGGPAGFTAFLRSLGDEVSRLDRWETELNEVPPGEERDTTTPAAVAANYRALVLGDVLAEPERAQLRDWLVANTTGDQRIRAGVPAGWTVGDKTGGGSHGGNNDVAVAWTETGDPIVIALLSHRTDPAAKADNALLAEATRAVVTALR,./data/raw/alphafold//AF-Q5YXD6-F1-model_v4.pdb,1458,975,782,1088
+2170,22426,22761,MSRVTVLQSQLPAYNRLKTPYESELIATVKKLTTPGKGLLAADESIGSCTKRFQPIGLSNTEEHRRQYRALMLEAEGFEQYISGVILHDETVGQKASNGQTFPEYLTARGVVPGIKTDMGLCPLLEGAEGEQMTEGLDGYVKRASAYYKKGCRFCKWRNVYKIQNGTVSESAVRFNAETLARYAILSQMSGLVPIVEPEVMIDGKHDIDTCQRVSEHVWREVVAALQRHGVIWEGCLLKPNMVVPGAESGKTAAPEQVAHYTVMTLARTMPAMLPGVMFLSGGLSEVQASEYLNAINNSPLPRPYFLSFSYARALQSSALKAWGGKESGLAAGRRAFLHRARMNSMAQLGKYKRSDDDASSSSLYVKGNTY,sabio,Q9U5N6,O=P(O)(O)OCC1OC(O)(COP(=O)(O)O)C(O)C1O>>O=C(CO)COP(=O)(O)O.O=CC(O)COP(=O)(O)O,8.2,8.344257555591964e-15,,7.6,4.1.2.13,5665.0,0.9138138523837168,O=P(O)(O)OCC1OC(O)(COP(=O)(O)O)C(O)C1O,O=C(CO)COP(=O)(O)O.O=CC(O)COP(=O)(O)O,0.9138138523837168,O=P(O)(O)OCC1OC(O)(COP(=O)(O)O)C(O)C1O__MSRVTVLQSQLPAYNRLKTPYESELIATVKKLTTPGKGLLAADESIGSCTKRFQPIGLSNTEEHRRQYRALMLEAEGFEQYISGVILHDETVGQKASNGQTFPEYLTARGVVPGIKTDMGLCPLLEGAEGEQMTEGLDGYVKRASAYYKKGCRFCKWRNVYKIQNGTVSESAVRFNAETLARYAILSQMSGLVPIVEPEVMIDGKHDIDTCQRVSEHVWREVVAALQRHGVIWEGCLLKPNMVVPGAESGKTAAPEQVAHYTVMTLARTMPAMLPGVMFLSGGLSEVQASEYLNAINNSPLPRPYFLSFSYARALQSSALKAWGGKESGLAAGRRAFLHRARMNSMAQLGKYKRSDDDASSSSLYVKGNTY,./data/raw/alphafold//AF-Q9U5N6-F1-model_v4.pdb,811,3268,5576,6896
+2171,20193,20482,MVLNFRDKSCIFLAILCCLSLSCIVKASVSYDRKAVIINGQRRILLSGSIHYPRSTPEMWPGLIQKAKEGGLDVIETYVFWNGHEPSPGQYYFGDRYDLVKFIKLVHQAGLYVNLRIGPYVCAEWNFGGFPVWLKFVPGMAFRTDNEPFKAAMKKFTEKIVWMMKAEKLFQTQGGPIILAQIENEYGPVEWEIGAPGKAYTKWVAQMALGLSTGVPWIMCKQEDAPGPIIDTCNGYYCEDFKPNSINKPKMWTENWTGWYTDFGGAVPYRPVEDIAYSVARFIQKGGSLVNYYMYHGGTNFDRTAGEFMASSYDYDAPLDEYGLPREPKYSHLKALHKAIKLSEPALLSADATVTSLGAKQEAYVFWSKSSCAAFLSNKDENSAARVLFRGFPYDLPPWSVSILPDCKTEVYNTAKVNAPSVHRNMVPTGTKFSWGSFNEATPTANEAGTFARNGLVEQISMTWDKSDYFWYITDITIGSGETFLKTGDSPLLTVMSAGHALHVFVNGQLSGTAYGGLDHPKLTFSQKIKLHAGVNKIALLSVAVGLPNVGTHFEQWNKGVLGPVTLKGVNSGTWDMSKWKWSYKIGVKGEALSLHTNTESSGVRWTQGSFVAKKQPLTWYKSTFATPAGNEPLALDMNTMGKGQVWINGRNIGRHWPAYKAQGSCGRCNYAGTFDAKKCLSNCGEASQRWYHVPRSWLKSQNLIVVFEELGGDPNGISLVKRT,sabio,Q9SCV8,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,33.0,0.0,37.0,4.5,3.2.1.23,3702.0,1.5185139398778875,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,1.812913356642856,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1__MVLNFRDKSCIFLAILCCLSLSCIVKASVSYDRKAVIINGQRRILLSGSIHYPRSTPEMWPGLIQKAKEGGLDVIETYVFWNGHEPSPGQYYFGDRYDLVKFIKLVHQAGLYVNLRIGPYVCAEWNFGGFPVWLKFVPGMAFRTDNEPFKAAMKKFTEKIVWMMKAEKLFQTQGGPIILAQIENEYGPVEWEIGAPGKAYTKWVAQMALGLSTGVPWIMCKQEDAPGPIIDTCNGYYCEDFKPNSINKPKMWTENWTGWYTDFGGAVPYRPVEDIAYSVARFIQKGGSLVNYYMYHGGTNFDRTAGEFMASSYDYDAPLDEYGLPREPKYSHLKALHKAIKLSEPALLSADATVTSLGAKQEAYVFWSKSSCAAFLSNKDENSAARVLFRGFPYDLPPWSVSILPDCKTEVYNTAKVNAPSVHRNMVPTGTKFSWGSFNEATPTANEAGTFARNGLVEQISMTWDKSDYFWYITDITIGSGETFLKTGDSPLLTVMSAGHALHVFVNGQLSGTAYGGLDHPKLTFSQKIKLHAGVNKIALLSVAVGLPNVGTHFEQWNKGVLGPVTLKGVNSGTWDMSKWKWSYKIGVKGEALSLHTNTESSGVRWTQGSFVAKKQPLTWYKSTFATPAGNEPLALDMNTMGKGQVWINGRNIGRHWPAYKAQGSCGRCNYAGTFDAKKCLSNCGEASQRWYHVPRSWLKSQNLIVVFEELGGDPNGISLVKRT,./data/raw/alphafold//AF-Q9SCV8-F1-model_v4.pdb,442,3106,5392,6273
+2172,254,266,MLREQLPYPKHEKVIHGKRLAYVDEGEGDPIVFLHGNPTSSFLWRNVMPELAGQGRLIAPDLIGQGDSEKLPAGEGANAYGFDTAYHYLEGLLEALGCHHQVTLVVHDWGSALGFHWARCHPDAVKGIAYMEAIVMPVTWEDWPESARGIFKGFRSDKGEDLILNRNLFVEAVLPGSVIRDLSEAEMAEYRRPFQKAEDRQPTLNWPRDIPIDGEPAEMVRVVRDYADWLAASPLPKLFVNADPGSILIGRQREFCRTWPNQTEVTVRGNHFLQEDSPVEIGQAVARWLEALSNS,brenda,K0CAI2,BrCCBr.O>>OCCBr.[Br-],17.95,0.2448111214195183,37.0,8.6,3.8.1.5,285091.0,1.254064452914338,BrCCBr.O,OCCBr.[Br-],1.254064452914338,BrCCBr.O__MLREQLPYPKHEKVIHGKRLAYVDEGEGDPIVFLHGNPTSSFLWRNVMPELAGQGRLIAPDLIGQGDSEKLPAGEGANAYGFDTAYHYLEGLLEALGCHHQVTLVVHDWGSALGFHWARCHPDAVKGIAYMEAIVMPVTWEDWPESARGIFKGFRSDKGEDLILNRNLFVEAVLPGSVIRDLSEAEMAEYRRPFQKAEDRQPTLNWPRDIPIDGEPAEMVRVVRDYADWLAASPLPKLFVNADPGSILIGRQREFCRTWPNQTEVTVRGNHFLQEDSPVEIGQAVARWLEALSNS,./data/raw/alphafold//AF-K0CAI2-F1-model_v4.pdb,2119,535,186,201
+2173,16022,16249,MLPKLVITHRVHDEILQLLAPHCELMTNQTDSTLTREEILRRCRDAQAMMAFMPDRVDADFLQACPELRVVGCALKGFDNFDVDACTARGVWLTFVPDLLTVPTAELAIGLAVGLGRHLRAADAFVRSGEFQGWQPQFYGTGLDNATVGILGMGAIGLAMADRLQGWGATLQYHEAKALDTQTEQRLGLRQVACSELFASSDFILLALPLNADTQHLVNAELLALVRPGALLVNPCRGSVVDEAAVLAALERGQLGGYAADVFEMEDWARADRPRLIDPALLAHPNTLFTPHIGSAVRAVRLEIERCAAQNIIQVLAGARPINAANRLPKAEPAAC,sabio,O69054,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=[PH](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=P(O)(O)O.[H],10548.0,0.0,25.0,7.25,1.20.1.1,316.0,4.023170121121397,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=[PH](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=P(O)(O)O.[H],4.023170121121397,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=[PH](O)O__MLPKLVITHRVHDEILQLLAPHCELMTNQTDSTLTREEILRRCRDAQAMMAFMPDRVDADFLQACPELRVVGCALKGFDNFDVDACTARGVWLTFVPDLLTVPTAELAIGLAVGLGRHLRAADAFVRSGEFQGWQPQFYGTGLDNATVGILGMGAIGLAMADRLQGWGATLQYHEAKALDTQTEQRLGLRQVACSELFASSDFILLALPLNADTQHLVNAELLALVRPGALLVNPCRGSVVDEAAVLAALERGQLGGYAADVFEMEDWARADRPRLIDPALLAHPNTLFTPHIGSAVRAVRLEIERCAAQNIIQVLAGARPINAANRLPKAEPAAC,./data/raw/alphafold//AF-O69054-F1-model_v4.pdb,2590,5058,2161,5033
+2174,13661,13839,MTENIHKHRILILDFGSQYTQLVARRVRELGVYCELWAWDVTEAQIRDFNPSGIILSGGPESTTEENSPRAPQYVFEAGVPVFGVCYGMQTMAMQLGGHVEASNEREFGYAQVEVVNDSALVRGIEDALTADGKPLLDVWMSHGDKVTAIPSDFITVASTESCPFAIMANEEKRFYGVQFHPEVTHTRQGMRMLERFVRDICQCEALWTPAKIIDDAVARIREQVGDDKVILGLSGGVDSSVTAMLLHRAIGKNLTCVFVDNGLLRLNEAEQVLDMFGDHFGLNIVHVPAEDRFLSALAGENDPEAKRKIIGRVFVEVFDEEALKLEDVKWLAQGTIYPDVIESAASATGKAHVIKSHHNVGGLPKEMKMGLVEPLKELFKDEVRKIGLELGLPYDMLYRHPFPGPGLGVRVLGEVKKEYCDLLRRADAIFIEELRKADLYDKVSQAFTVFLPVRSVGVMGDGRKYDWVVSLRAVETIDFMTAHWAHLPYDFLGRVSNRIINEVNGISRVVYDISGKPPATIEWE,brenda,P04079,N=C(O)CC[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.O.O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[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.N[C@@H](CCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,13.3,0.0,37.0,8.5,6.3.5.2,562.0,1.1238516409670858,N=C(O)CC[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.O.O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[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.N[C@@H](CCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,1.3617278360175928,N=C(O)CC[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.O.O=P(O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O__MTENIHKHRILILDFGSQYTQLVARRVRELGVYCELWAWDVTEAQIRDFNPSGIILSGGPESTTEENSPRAPQYVFEAGVPVFGVCYGMQTMAMQLGGHVEASNEREFGYAQVEVVNDSALVRGIEDALTADGKPLLDVWMSHGDKVTAIPSDFITVASTESCPFAIMANEEKRFYGVQFHPEVTHTRQGMRMLERFVRDICQCEALWTPAKIIDDAVARIREQVGDDKVILGLSGGVDSSVTAMLLHRAIGKNLTCVFVDNGLLRLNEAEQVLDMFGDHFGLNIVHVPAEDRFLSALAGENDPEAKRKIIGRVFVEVFDEEALKLEDVKWLAQGTIYPDVIESAASATGKAHVIKSHHNVGGLPKEMKMGLVEPLKELFKDEVRKIGLELGLPYDMLYRHPFPGPGLGVRVLGEVKKEYCDLLRRADAIFIEELRKADLYDKVSQAFTVFLPVRSVGVMGDGRKYDWVVSLRAVETIDFMTAHWAHLPYDFLGRVSNRIINEVNGISRVVYDISGKPPATIEWE,./data/raw/alphafold//AF-P04079-F1-model_v4.pdb,2281,4605,4629,4456
+2175,18857,19137,MIDIHCHILPAMDDGAGDSADSIEMARAAVRQGIRTIIATPHHNNGVYKNEPAAVREAADQLNKRLIKEDIPLHVLPGQEIRIYGEVEQDLAKRQLLSLNDTKYILIEFPFDHVPRYAEQLFYDLQLKGYIPVIAHPERNREIRENPSLLYHLVEKGAASQITSGSLAGIFGKQLKAFSLRLVEANLIHFVASDAHNVKTRNFHTQEALYVLEKEFGSELPYMLTENAELLLRNQTIFRQPPQPVKRRKLFGFF,sabio,P96717,O>>*NC(=O)C(Cc1ccc(O)cc1)NC(*)=O.O=P(O)(O)O,0.028,88.5430525045636,30.0,8.0,3.1.3.48,1423.0,-1.5528419686577808,O,*NC(=O)C(Cc1ccc(O)cc1)NC(*)=O.O=P(O)(O)O,-1.5528419686577808,O__MIDIHCHILPAMDDGAGDSADSIEMARAAVRQGIRTIIATPHHNNGVYKNEPAAVREAADQLNKRLIKEDIPLHVLPGQEIRIYGEVEQDLAKRQLLSLNDTKYILIEFPFDHVPRYAEQLFYDLQLKGYIPVIAHPERNREIRENPSLLYHLVEKGAASQITSGSLAGIFGKQLKAFSLRLVEANLIHFVASDAHNVKTRNFHTQEALYVLEKEFGSELPYMLTENAELLLRNQTIFRQPPQPVKRRKLFGFF,./data/raw/alphafold//AF-P96717-F1-model_v4.pdb,186,2697,5006,5856
+2176,21241,21565,MSFARVRTALRCQRAAASPAPPKVQARRFANKAAPHASASSAGSRAFHLGLAAGAALAVGGAGLYLFSRSPVLLDAQLPVKQRGRARSISAAEVAKHNSRDSMWVCIDDEVWDITNFVELHPGGAKVLEQNAGKDVTKVFKSIHPPKTLEKFLTDDNFVGRIDVDEVTKIGGGKNAEDLRIEQARKELRNVETVVCLDEFEEISQKILSEMAMAYYGTGAETEQTLRDEREAWQRVRFRPRVLRKMRHIDTNTTFLGIPTPLPIFVAPAGLARLGHPDGEQNIVRGVAKHDILQVVSSGASCSIDEIFEVKEPDQNLAWQFYVHSDKKIAEEKLKRALALGAKAIFVTVDVPVLGKRERDLKLKARSQNYEHPIAAQWKAAGSKVEETIAKRGVSDIPDTAHIDANLNWDDIAWIKERAPGVPIVIKGVGCVEDVELAKQYGADGVVLSTHGARQLDGARAPLDVLIEVRRKNPALLKEIEVYVDGQARRGTDVLKALCLGARGVGFGRGFLYAQSAYGADGVDKAIRILENEIQNAMRLLGANTLADLKPEMVECSFPERWVPE,uniprot_search,P32953,O=C(O)C(O)c1ccc(Cl)cc1.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[Fe-3]>>O.O=C(O)C(=O)c1ccc(Cl)cc1.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[Fe-4],68.0,1.965254583935731,25.0,7.5,1.1.99.31,29898.0,1.8325089127062364,O=C(O)C(O)c1ccc(Cl)cc1.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[Fe-3],O.O=C(O)C(=O)c1ccc(Cl)cc1.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[Fe-4],2.0644579892269186,O=C(O)C(O)c1ccc(Cl)cc1.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[C]#N.[Fe-3]__MSFARVRTALRCQRAAASPAPPKVQARRFANKAAPHASASSAGSRAFHLGLAAGAALAVGGAGLYLFSRSPVLLDAQLPVKQRGRARSISAAEVAKHNSRDSMWVCIDDEVWDITNFVELHPGGAKVLEQNAGKDVTKVFKSIHPPKTLEKFLTDDNFVGRIDVDEVTKIGGGKNAEDLRIEQARKELRNVETVVCLDEFEEISQKILSEMAMAYYGTGAETEQTLRDEREAWQRVRFRPRVLRKMRHIDTNTTFLGIPTPLPIFVAPAGLARLGHPDGEQNIVRGVAKHDILQVVSSGASCSIDEIFEVKEPDQNLAWQFYVHSDKKIAEEKLKRALALGAKAIFVTVDVPVLGKRERDLKLKARSQNYEHPIAAQWKAAGSKVEETIAKRGVSDIPDTAHIDANLNWDDIAWIKERAPGVPIVIKGVGCVEDVELAKQYGADGVVLSTHGARQLDGARAPLDVLIEVRRKNPALLKEIEVYVDGQARRGTDVLKALCLGARGVGFGRGFLYAQSAYGADGVDKAIRILENEIQNAMRLLGANTLADLKPEMVECSFPERWVPE,./data/raw/alphafold//AF-P32953-F1-model_v4.pdb,3557,3515,1287,3236
+2177,20507,20812,MATKIVLVGAGSAQFGYGTLGDIFQSRALYGSEIILHDINPVALAVTEKTAKDFLAKEDLPFIVSATTDRRTALRGAEFVIISIEVGDRFALWDLDWQIPQQYGIQQVYGENGGPGGLFHSLRIIPPILDICADVADICPDAWIFNYSNPMSRICTTVHRRFPELNFVGMCHEIASLERYLPEMLNTSFDNLSLRAGGLNHFSVLLDARYKDSGKDAYADVRAKAPDYFASLPGYSDILAYTRQHGKLVDTEGSTERHALGGKDSSYPWADRTLFKEILEKFHCMPITVDSHFGEYISWAGEVSDHRGILDFYTFYRNYLGGVQPKIELKLKERVVSIMEGILTDSGYEEAAVNIPNRGFIKQLPEFIAVEVPAIIDRKGVHGIQVDIPPGIGGLLSNQIAIHDLTAEAIIAGSRDLVIQALLVDSVNNQCRAIPELVDVMISRQQPWLNYLK,sabio,Q9AI65,O.OCC1OC(OCC2OC(O)(CO)C(O)C2O)C(O)C(O)C1O>>OCC1OC(O)(CO)C(O)C1O.OCC1OC(O)C(O)C(O)C1O,2100.0,0.0,25.0,7.5,3.2.1.20,55212.0,3.322219294733919,O.OCC1OC(OCC2OC(O)(CO)C(O)C2O)C(O)C(O)C1O,OCC1OC(O)(CO)C(O)C1O.OCC1OC(O)C(O)C(O)C1O,3.322219294733919,O.OCC1OC(OCC2OC(O)(CO)C(O)C2O)C(O)C(O)C1O__MATKIVLVGAGSAQFGYGTLGDIFQSRALYGSEIILHDINPVALAVTEKTAKDFLAKEDLPFIVSATTDRRTALRGAEFVIISIEVGDRFALWDLDWQIPQQYGIQQVYGENGGPGGLFHSLRIIPPILDICADVADICPDAWIFNYSNPMSRICTTVHRRFPELNFVGMCHEIASLERYLPEMLNTSFDNLSLRAGGLNHFSVLLDARYKDSGKDAYADVRAKAPDYFASLPGYSDILAYTRQHGKLVDTEGSTERHALGGKDSSYPWADRTLFKEILEKFHCMPITVDSHFGEYISWAGEVSDHRGILDFYTFYRNYLGGVQPKIELKLKERVVSIMEGILTDSGYEEAAVNIPNRGFIKQLPEFIAVEVPAIIDRKGVHGIQVDIPPGIGGLLSNQIAIHDLTAEAIIAGSRDLVIQALLVDSVNNQCRAIPELVDVMISRQQPWLNYLK,./data/raw/alphafold//AF-Q9AI65-F1-model_v4.pdb,235,2755,5068,5928
+2178,7709,7833,MRAVRLVEIGKPLSLQEIGVPKPKGPQVLIKVEAAGVCHSDVHMRQGRFGNLRIVEDLGVKLPVTLGHEIAGKIEEVGDEVVGYSKGDLVAVNPWQGEGNCYYCRIGEEHLCDSPRWLGINFDGAYAEYVIVPHYKYMYKLRRLNAVEAAPLTCSGITTYRAVRKASLDPTKTLLVVGAGGGLGTMAVQIAKAVSGATIIGVDVREEAVEAAKRAGADYVINASMQDPLAEIRRITESKGVDAVIDLNNSEKTLSVYPKALAKQGKYVMVGLFGADLHYHAPLITLSEIQFVGSLVGNQSDFLGIMRLAEAGKVKPMITKTMKLEEANEAIDNLENFKAIGRQVLIP,brenda,P39462,CCC[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>>CCCC(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+],1.1,7.548044698734811e-15,65.0,8.0,1.1.1.1,2287.0,0.041392685158225,CCC[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,CCCC(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+],0.041392685158225,CCC[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__MRAVRLVEIGKPLSLQEIGVPKPKGPQVLIKVEAAGVCHSDVHMRQGRFGNLRIVEDLGVKLPVTLGHEIAGKIEEVGDEVVGYSKGDLVAVNPWQGEGNCYYCRIGEEHLCDSPRWLGINFDGAYAEYVIVPHYKYMYKLRRLNAVEAAPLTCSGITTYRAVRKASLDPTKTLLVVGAGGGLGTMAVQIAKAVSGATIIGVDVREEAVEAAKRAGADYVINASMQDPLAEIRRITESKGVDAVIDLNNSEKTLSVYPKALAKQGKYVMVGLFGADLHYHAPLITLSEIQFVGSLVGNQSDFLGIMRLAEAGKVKPMITKTMKLEEANEAIDNLENFKAIGRQVLIP,./data/raw/alphafold//AF-P39462-F1-model_v4.pdb,1321,3885,6202,863
+2179,8357,8487,MALEKFADELPIIETLQPQKKSDGSTYYEVTMKECFHKLHRDLPPTRLWGYNGLFPGPTIDVNQDENVYIKWMNDLPDKHFLPVDHTIHHSESGHQEPDVKTVVHLHGGATPPDSDGYPEAWFTKDFKETGPYFEKEVYHYPNKQRGALLWYHDHAMAITRLNVYAGLAGMYIIRERKEKQLKLPSGEYDVPLMILDRTLNDDGSLSYPSGPANPSETLPDPSIVPFFCGNTILVNGKAWPYMEVEPRTYRFRILNASNTRTFSLSLNNGGKFIQIGSDGGLLPRSVKTQSISLAPAERYDVLIDFSAFDGEHIILTNGTGCGGDADPDTDANVMQFRVTKPLKGADTSRKPKYLSTMPNVTSKRIHNIRTLKLTNTQDKYGRPVLTLNNKRWHDPVTEAPKLGTTEIWSIINPMGGTHPIHLHLVSFQILDRRPFDLERYNKFGDIVYTGPAVPPPPSEKGWKDTVQAHSGEVIRIAATFAPYSGRYVWHCHILEHEDYDMMRPMDVTDKQ,sabio,A0A222C745,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,72.6,1.4837780463171737,40.0,4.6,1.10.3.2,1409.0,1.8609366207000937,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,1.8609366207000937,CCn1/c(=N/N=c2/sc3cc(S(=O)(=O)O)ccc3n2CC)sc2cc(S(=O)(=O)O)ccc21.O=O__MALEKFADELPIIETLQPQKKSDGSTYYEVTMKECFHKLHRDLPPTRLWGYNGLFPGPTIDVNQDENVYIKWMNDLPDKHFLPVDHTIHHSESGHQEPDVKTVVHLHGGATPPDSDGYPEAWFTKDFKETGPYFEKEVYHYPNKQRGALLWYHDHAMAITRLNVYAGLAGMYIIRERKEKQLKLPSGEYDVPLMILDRTLNDDGSLSYPSGPANPSETLPDPSIVPFFCGNTILVNGKAWPYMEVEPRTYRFRILNASNTRTFSLSLNNGGKFIQIGSDGGLLPRSVKTQSISLAPAERYDVLIDFSAFDGEHIILTNGTGCGGDADPDTDANVMQFRVTKPLKGADTSRKPKYLSTMPNVTSKRIHNIRTLKLTNTQDKYGRPVLTLNNKRWHDPVTEAPKLGTTEIWSIINPMGGTHPIHLHLVSFQILDRRPFDLERYNKFGDIVYTGPAVPPPPSEKGWKDTVQAHSGEVIRIAATFAPYSGRYVWHCHILEHEDYDMMRPMDVTDKQ,./data/raw/alphafold//AF-A0A222C745-F1-model_v4.pdb,3403,2293,3981,2865
+2180,21610,21935,MNSSNTGAPEAAQAATLEAFDRRAAEQYLRGQWIAEEHLMRAIGGPRPAGIPYRWEWKSVEVALDEATIALGPVDTARRHLTFVNPGLMDRGSATTHTISAGFQLVKPGEVCWSHRHTMSAVRFVTKGHPDAFTAVDGERLPMEDFDLLITPRFSWHDHHNSGDADVVWLDGLDIGLLQSLGAVFYEPYGDDSQNVRPSSSEGIGTRSHWLRPTWERGRESRLPIRYPWKEVNARLDVYDLDAGTPYDGLALRYANPVTGGPTMATMDCWVQRLAPGFDGKSHRRSSSAITYVISGSGTMVTEDETITFNRGDVISLPNWTNFRWTNDSEIEPVLLFSMHDIPALEAFGLLYEEPEAILNATPAPINPTPSLNPIYRPGAFYDQDEL,brenda,O24721,O=C(O)c1ccc2ccccc2c1O.O=O>>O=C(O)C(=O)/C=C\c1ccccc1C(=O)O,114.0,0.0,25.0,7.5,1.13.11.38,35761.0,2.0569048513364727,O=C(O)c1ccc2ccccc2c1O.O=O,O=C(O)C(=O)/C=C\c1ccccc1C(=O)O,2.0569048513364727,O=C(O)c1ccc2ccccc2c1O.O=O__MNSSNTGAPEAAQAATLEAFDRRAAEQYLRGQWIAEEHLMRAIGGPRPAGIPYRWEWKSVEVALDEATIALGPVDTARRHLTFVNPGLMDRGSATTHTISAGFQLVKPGEVCWSHRHTMSAVRFVTKGHPDAFTAVDGERLPMEDFDLLITPRFSWHDHHNSGDADVVWLDGLDIGLLQSLGAVFYEPYGDDSQNVRPSSSEGIGTRSHWLRPTWERGRESRLPIRYPWKEVNARLDVYDLDAGTPYDGLALRYANPVTGGPTMATMDCWVQRLAPGFDGKSHRRSSSAITYVISGSGTMVTEDETITFNRGDVISLPNWTNFRWTNDSEIEPVLLFSMHDIPALEAFGLLYEEPEAILNATPAPINPTPSLNPIYRPGAFYDQDEL,./data/raw/alphafold//AF-O24721-F1-model_v4.pdb,693,82,5795,6702
+2181,8522,8654,MIKEIYLAGGCFWGVEGYFRQIPGVKETDTGYANGKNDSANYKGLHQSDHAETVKIVYDSSVVSLQELLAHYFRIIDPTSLNKQGNDAGRQYRTGIYYVDDSMIKEINSFVKFMQKKYSRPIVVEVEKLKHFILAEDYHQDYLQKNPGGYCHIDLTLALKPLYDESKFKVPSKEELKKSLKPIQFSVTQEKATERPFTSEYDKFDAEGIYVDITTGKPLFSSLNKYDAGCGWPSFTKAITTQALQYLEDKSLGMNRTEVVSKTGGAHLGHVFDDGPADAGGLRYCINGAALRFIPYDKMEKEGYGDYLPYVKPTGNF,brenda,Q73PT7,CN(C)c1ccc(/N=N/c2ccc(S(=O)(=O)N[C@@H](CC[S@](C)=O)C(=O)O)cc2)cc1.O[C@H](CS)[C@H](O)CS>>CSCC[C@H](NS(=O)(=O)c1ccc(/N=N/c2ccc(N(C)C)cc2)cc1)C(=O)O.O.O[C@@H]1CSSC[C@H]1O,0.12,0.0,37.0,7.5,1.8.4.11,158.0,-0.9208187539523752,CN(C)c1ccc(/N=N/c2ccc(S(=O)(=O)N[C@@H](CC[S@](C)=O)C(=O)O)cc2)cc1.O[C@H](CS)[C@H](O)CS,CSCC[C@H](NS(=O)(=O)c1ccc(/N=N/c2ccc(N(C)C)cc2)cc1)C(=O)O.O.O[C@@H]1CSSC[C@H]1O,-0.9208187539523752,CN(C)c1ccc(/N=N/c2ccc(S(=O)(=O)N[C@@H](CC[S@](C)=O)C(=O)O)cc2)cc1.O[C@H](CS)[C@H](O)CS__MIKEIYLAGGCFWGVEGYFRQIPGVKETDTGYANGKNDSANYKGLHQSDHAETVKIVYDSSVVSLQELLAHYFRIIDPTSLNKQGNDAGRQYRTGIYYVDDSMIKEINSFVKFMQKKYSRPIVVEVEKLKHFILAEDYHQDYLQKNPGGYCHIDLTLALKPLYDESKFKVPSKEELKKSLKPIQFSVTQEKATERPFTSEYDKFDAEGIYVDITTGKPLFSSLNKYDAGCGWPSFTKAITTQALQYLEDKSLGMNRTEVVSKTGGAHLGHVFDDGPADAGGLRYCINGAALRFIPYDKMEKEGYGDYLPYVKPTGNF,./data/raw/alphafold//AF-Q73PT7-F1-model_v4.pdb,3443,2348,1068,2974
+2182,5036,5121,MRATLATLAVLALATAVQSDSRARIVCYFSNWAVYRPGVGRYGIEDIPVEKCTHIIYSFIGVTEGNSEVLIIDPELDVDKNGFRNFTSLRSSHPSVKFMVAVGGWAEGSSKYSHMVAQKSTRMSFIRSVVSFLKKYDFDGLDLDWEYPGAADRGGSFSDKDKFLYLVQELRRAFIRVGKGWELTAAVPLANFRLMEGYHVPELCQELDAIHVMSYDLRGNWAGFADVHSPLYKRPHDQWAYEKLNVNDGLHLWEEKGCPSNKLVVGIPFYGRSFTLSAGNNNYGLGTFINKEAGGGDPAPYTNATGFWAYYEICTEVDKDDSGWTKKWDEQGKCPYAYKGTQWVGYEDPRSVEIKMNWIKQKGYLGAMTWAIDMDDFQGLCGEKNPLIKILHKHMSSYTVPPPHTENTTPTPEWARPPSTPSDPSEGDPIPTTTTAKPASTTKTTVKTTTTTTAKPPQSVIDEENDINVRPEPKPEPQPEPEVEVPPTENEVDGSEICNSDQDYIPDKKHCDKYWRCVNGEAMQFSCQHGTVFNVELNVCDWPSNATRRECQQP,uniprot_search,P36362,CC(O)=N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3N=C(C)O)[C@H](O)[C@H]2N=C(C)O)[C@@H]1O.O>>CC(O)=N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3N=C(C)O)[C@H](O)[C@H]2N=C(C)O)[C@@H](CO)O[C@H]1O.Cc1cc(=O)oc2cc(O)ccc12,0.17,1.4135442131430816e-14,30.0,7.4,3.2.1.14,7130.0,-0.7695510786217261,CC(O)=N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3N=C(C)O)[C@H](O)[C@H]2N=C(C)O)[C@@H]1O.O,CC(O)=N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3N=C(C)O)[C@H](O)[C@H]2N=C(C)O)[C@@H](CO)O[C@H]1O.Cc1cc(=O)oc2cc(O)ccc12,-0.1191864077192086,CC(O)=N[C@H]1[C@H](Oc2ccc3c(C)cc(=O)oc3c2)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3N=C(C)O)[C@H](O)[C@H]2N=C(C)O)[C@@H]1O.O__MRATLATLAVLALATAVQSDSRARIVCYFSNWAVYRPGVGRYGIEDIPVEKCTHIIYSFIGVTEGNSEVLIIDPELDVDKNGFRNFTSLRSSHPSVKFMVAVGGWAEGSSKYSHMVAQKSTRMSFIRSVVSFLKKYDFDGLDLDWEYPGAADRGGSFSDKDKFLYLVQELRRAFIRVGKGWELTAAVPLANFRLMEGYHVPELCQELDAIHVMSYDLRGNWAGFADVHSPLYKRPHDQWAYEKLNVNDGLHLWEEKGCPSNKLVVGIPFYGRSFTLSAGNNNYGLGTFINKEAGGGDPAPYTNATGFWAYYEICTEVDKDDSGWTKKWDEQGKCPYAYKGTQWVGYEDPRSVEIKMNWIKQKGYLGAMTWAIDMDDFQGLCGEKNPLIKILHKHMSSYTVPPPHTENTTPTPEWARPPSTPSDPSEGDPIPTTTTAKPASTTKTTVKTTTTTTAKPPQSVIDEENDINVRPEPKPEPQPEPEVEVPPTENEVDGSEICNSDQDYIPDKKHCDKYWRCVNGEAMQFSCQHGTVFNVELNVCDWPSNATRRECQQP,./data/raw/alphafold//AF-P36362-F1-model_v4.pdb,3074,1829,3456,2264
+2183,5439,5525,MRSTLLAFALAVALPAAHTSAAEVPLPQLRAYTVDASWLQPMAPLQIADHTWQIGTEDLTALLVQTPDGAVLLDGGMPQMASHLLDNMKARGVTPRDLRLILLSHAHADHAGPVAELKRRTGAKVAANAESAVLLARGGSDDLHFGDGITYPPANADRIVMDGEVITVGGIVFTAHFMAGHTPGSTAWTWTDTRNGKPVRIAYADSLSAPGYQLQGNPRYPHLIEDYRRSFATVRALPCDVLLTPHPGASNWDYAAGARAGAKALTCKAYADAAEQKFDGQLAKETAGAR,brenda,P52700,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O.O>>,600.0,99.71704412979751,25.0,7.0,3.5.2.6,40324.0,2.778151250383644,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O.O,,2.778151250383644,CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O.O__MRSTLLAFALAVALPAAHTSAAEVPLPQLRAYTVDASWLQPMAPLQIADHTWQIGTEDLTALLVQTPDGAVLLDGGMPQMASHLLDNMKARGVTPRDLRLILLSHAHADHAGPVAELKRRTGAKVAANAESAVLLARGGSDDLHFGDGITYPPANADRIVMDGEVITVGGIVFTAHFMAGHTPGSTAWTWTDTRNGKPVRIAYADSLSAPGYQLQGNPRYPHLIEDYRRSFATVRALPCDVLLTPHPGASNWDYAAGARAGAKALTCKAYADAAEQKFDGQLAKETAGAR,./data/raw/alphafold//AF-P52700-F1-model_v4.pdb,1443,3060,814,1074
+2184,7597,7719,MTSRDGYQWTPETGLTQGVPSLGVISPPTNIEDTDKDGPWDVIVIGGGYCGLTATRDLTVAGFKTLLLEARDRIGGRSWSSNIDGYPYEMGGTWVHWHQSHVWREITRYKMHNALSPSFNFSRGVNHFQLRTNPTTSTYMTHEAEDELLRSALHKFTNVDGTNGRTVLPFPHDMFYVPEFRKYDEMSYSERIDQIRDELSLNERSSLEAFILLCSGGTLENSSFGEFLHWWAMSGYTYQGCMDCLISYKFKDGQSAFARRFWEEAAGTGRLGYVFGCPVRSVVNERDAARVTARDGREFAAKRLVCTIPLNVLSTIQFSPALSTERISAMQAGHVNMCTKVHAEVDNKDMRSWTGIAYPFNKLCYAIGDGTTPAGNTHLVCFGTDANHIQPDEDVRETLKAVGQLAPGTFGVKRLVFHNWVKDEFAKGAWFFSRPGMVSECLQGLREKHRGVVFANSDWALGWRSFIDGAIEEGTRAARVVLEELGTKREVKARL,uniprot_search,P46882,CCCCN.O.O=O>>CCCC=O.N.OO,18.0,5.746310094135963e-15,37.0,7.4,1.4.3.4,5061.0,1.255272505103306,CCCCN.O.O=O,CCCC=O.N.OO,1.255272505103306,CCCCN.O.O=O__MTSRDGYQWTPETGLTQGVPSLGVISPPTNIEDTDKDGPWDVIVIGGGYCGLTATRDLTVAGFKTLLLEARDRIGGRSWSSNIDGYPYEMGGTWVHWHQSHVWREITRYKMHNALSPSFNFSRGVNHFQLRTNPTTSTYMTHEAEDELLRSALHKFTNVDGTNGRTVLPFPHDMFYVPEFRKYDEMSYSERIDQIRDELSLNERSSLEAFILLCSGGTLENSSFGEFLHWWAMSGYTYQGCMDCLISYKFKDGQSAFARRFWEEAAGTGRLGYVFGCPVRSVVNERDAARVTARDGREFAAKRLVCTIPLNVLSTIQFSPALSTERISAMQAGHVNMCTKVHAEVDNKDMRSWTGIAYPFNKLCYAIGDGTTPAGNTHLVCFGTDANHIQPDEDVRETLKAVGQLAPGTFGVKRLVFHNWVKDEFAKGAWFFSRPGMVSECLQGLREKHRGVVFANSDWALGWRSFIDGAIEEGTRAARVVLEELGTKREVKARL,./data/raw/alphafold//AF-P46882-F1-model_v4.pdb,3336,2194,3879,2748
+2185,22050,22382,MLTSALFLLASLGLAQSATLEDLYLENAPSAPRPYVIPHYANSHAVAVGDQVYRFTVTGPSSDNAFTLMSTNAPSSSSLGVLPHVHQKHYENFFSFKGRFQLWAQKDAAEQQARLLTAGDYGSVPRNTTHTFQILDPDTEMVGVIVPGGFEDLFYALGTNYTSDTGTPYVPAHSNSSSSPDSSVISSLQKFDVYAKLGFEPRRDLVNGTAPVDNSEWHTGDNALGTPGQPYFVANGYGPKYLNSKFGYQVVQPFVTAKQAQDTNYTLSTISLNHQTKNNAPSYTLKGATAFEVIEGVLKIQIGDYPVATLYTGDVAFVPAGVSFTYYTEVAFTKALYIASGSNGVDSQLIQGGKTWNWVTFPTQ,brenda,A7Y9J1,O=O.O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)ccc12>>O=C(Oc1cc([O-])ccc1C(=O)O)c1ccc(O)c(O)c1.[C-]#[O+],56.7,0.1583745243265214,,,1.13.11.24,99116.0,1.7535830588929069,O=O.O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)ccc12,O=C(Oc1cc([O-])ccc1C(=O)O)c1ccc(O)c(O)c1.[C-]#[O+],1.7535830588929069,O=O.O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)ccc12__MLTSALFLLASLGLAQSATLEDLYLENAPSAPRPYVIPHYANSHAVAVGDQVYRFTVTGPSSDNAFTLMSTNAPSSSSLGVLPHVHQKHYENFFSFKGRFQLWAQKDAAEQQARLLTAGDYGSVPRNTTHTFQILDPDTEMVGVIVPGGFEDLFYALGTNYTSDTGTPYVPAHSNSSSSPDSSVISSLQKFDVYAKLGFEPRRDLVNGTAPVDNSEWHTGDNALGTPGQPYFVANGYGPKYLNSKFGYQVVQPFVTAKQAQDTNYTLSTISLNHQTKNNAPSYTLKGATAFEVIEGVLKIQIGDYPVATLYTGDVAFVPAGVSFTYYTEVAFTKALYIASGSNGVDSQLIQGGKTWNWVTFPTQ,./data/raw/alphafold//AF-A7Y9J1-F1-model_v4.pdb,744,164,5902,6816
+2186,15314,15527,MDLLLLEKSLIAVFVAVILATVISKLRGKKLKLPPGPIPIPIFGNWLQVGDDLNHRNLVDYAKKFGDLFLLRMGQRNLVVVSSPDLTKEVLLTQGVEFGSRTRNVVFDIFTGKGQDMVFTVYGEHWRKMRRIMTVPFFTNKVVQQNREGWEFEAASVVEDVKKNPDSATKGIVLRKRLQLMMYNNMFRIMFDRRFESEDDPLFLRLKALNGERSRLAQSFEYNYGDFIPILRPFLRGYLKICQDVKDRRIALFKKYFVDERKQIASSKPTGSEGLKCAIDHILEAEQKGEINEDNVLYIVENINVAAIETTLWSIEWGIAELVNHPEIQSKLRNELDTVLGPGVQVTEPDLHKLPYLQAVVKETLRLRMAIPLLVPHMNLHDAKLAGYDIPAESKILVNAWWLANNPNSWKKPEEFRPERFFEEESHVEANGNDFRYVPFGVGRRSCPGIILALPILGITIGRMVQNFELLPPPGQSKVDTSEKGGQFSLHILNHSIIVMKPRNC,sabio,P92994,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)C=Cc1ccccc1.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.O=C(O)C=Cc1ccc(O)cc1,6174.0,6.1313676378189e-15,30.0,,1.14.14.91,3702.0,3.790566625146077,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)C=Cc1ccccc1.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.O=C(O)C=Cc1ccc(O)cc1,3.790566625146077,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)C=Cc1ccccc1.O=O.[H]__MDLLLLEKSLIAVFVAVILATVISKLRGKKLKLPPGPIPIPIFGNWLQVGDDLNHRNLVDYAKKFGDLFLLRMGQRNLVVVSSPDLTKEVLLTQGVEFGSRTRNVVFDIFTGKGQDMVFTVYGEHWRKMRRIMTVPFFTNKVVQQNREGWEFEAASVVEDVKKNPDSATKGIVLRKRLQLMMYNNMFRIMFDRRFESEDDPLFLRLKALNGERSRLAQSFEYNYGDFIPILRPFLRGYLKICQDVKDRRIALFKKYFVDERKQIASSKPTGSEGLKCAIDHILEAEQKGEINEDNVLYIVENINVAAIETTLWSIEWGIAELVNHPEIQSKLRNELDTVLGPGVQVTEPDLHKLPYLQAVVKETLRLRMAIPLLVPHMNLHDAKLAGYDIPAESKILVNAWWLANNPNSWKKPEEFRPERFFEEESHVEANGNDFRYVPFGVGRRSCPGIILALPILGITIGRMVQNFELLPPPGQSKVDTSEKGGQFSLHILNHSIIVMKPRNC,./data/raw/alphafold//AF-P92994-F1-model_v4.pdb,3368,2239,3931,2807
+2187,13914,14095,MKNRNRMIVNCVTASLMYYWSLPALAEQSSSEIKIVRDEYGMPHIYANDTWHLFYGYGYVVAQDRLFQMEMARRSTQGTVAEVLGKDFVKFDKDIRRNYWPDAIRAQIAALSPEDMSILQGYADGMNAWIDKVNTNPETLLPKQFNTFGFTPKRWEPFDVAMIFVGTMANRFSDSTSEIDNLALLTALKDKYGVSQGMAVFNQLKWLVNPSAPTTIAVQESNYPLKFNQQNSQTAALLPRYDLPAPMLDRPAKGADGALLALTAGKNRETIAAQFAQGGANGLAGYPTTSNMWVIGKSKAQDAKAIMVNGPQFGWYAPAYTYGIGLHGAGYDVTGNTPFAYPGLVFGHNGVISWGSTAGFGDDVDIFAERLSAEKPGYYLHNGKWVKMLSREETITVKNGQAETFTVWRTVHGNILQTDQTTQTAYAKSRAWDGKEVASLLAWTHQMKAKNWQEWTQQAAKQALTINWYYADVNGNIGYVHTGAYPDRQSGHDPRLPVPGTGKWDWKGLLPFEMNPKVYNPQSGYIANWNNSPQKDYPASDLFAFLWGGADRVTEIDRLLEQKPRLTADQAWDVIRQTSRQDLNLRLFLPTLQAATSGLTQSDPRRQLVETLTRWDGINLLNDDGKTWQQPGSAILNVWLTSMLKRTVVAAVPMPFDKWYSASGYETTQDGPTGSLNISVGAKILYEAVQGDKSPIPQAVDLFAGKPQQEVVLAALEDTWETLSKRYGNNVSNWKTPAMALTFRANNFFGVPQAAAEETRHQAEYQNRGTENDMIVFSPTTSDRPVLAWDVVAPGQSGFIAPDGTVDKHYEDQLKMYENFGRKSLWLTKQDVEAHKESQEVLHVQR,brenda,P06875,N=C(O)Cc1ccccc1.O>>N.O=C(O)Cc1ccccc1,46.0,0.0,30.0,7.0,3.5.1.11,562.0,1.662757831681574,N=C(O)Cc1ccccc1.O,N.O=C(O)Cc1ccccc1,1.662757831681574,N=C(O)Cc1ccccc1.O__MKNRNRMIVNCVTASLMYYWSLPALAEQSSSEIKIVRDEYGMPHIYANDTWHLFYGYGYVVAQDRLFQMEMARRSTQGTVAEVLGKDFVKFDKDIRRNYWPDAIRAQIAALSPEDMSILQGYADGMNAWIDKVNTNPETLLPKQFNTFGFTPKRWEPFDVAMIFVGTMANRFSDSTSEIDNLALLTALKDKYGVSQGMAVFNQLKWLVNPSAPTTIAVQESNYPLKFNQQNSQTAALLPRYDLPAPMLDRPAKGADGALLALTAGKNRETIAAQFAQGGANGLAGYPTTSNMWVIGKSKAQDAKAIMVNGPQFGWYAPAYTYGIGLHGAGYDVTGNTPFAYPGLVFGHNGVISWGSTAGFGDDVDIFAERLSAEKPGYYLHNGKWVKMLSREETITVKNGQAETFTVWRTVHGNILQTDQTTQTAYAKSRAWDGKEVASLLAWTHQMKAKNWQEWTQQAAKQALTINWYYADVNGNIGYVHTGAYPDRQSGHDPRLPVPGTGKWDWKGLLPFEMNPKVYNPQSGYIANWNNSPQKDYPASDLFAFLWGGADRVTEIDRLLEQKPRLTADQAWDVIRQTSRQDLNLRLFLPTLQAATSGLTQSDPRRQLVETLTRWDGINLLNDDGKTWQQPGSAILNVWLTSMLKRTVVAAVPMPFDKWYSASGYETTQDGPTGSLNISVGAKILYEAVQGDKSPIPQAVDLFAGKPQQEVVLAALEDTWETLSKRYGNNVSNWKTPAMALTFRANNFFGVPQAAAEETRHQAEYQNRGTENDMIVFSPTTSDRPVLAWDVVAPGQSGFIAPDGTVDKHYEDQLKMYENFGRKSLWLTKQDVEAHKESQEVLHVQR,./data/raw/alphafold//AF-P06875-F1-model_v4.pdb,3127,1910,300,331
+2188,19042,19327,MAVVYYLLLAGLIACSHALAAGTPALGDDRGRPWPASLAALALDGKLRTDSNATAAASTDFGNITSALPAAVLYPSSTGDLVALLSAANSTPGWPYTIAFRGRGHSLMGQAFAPGGVVVNMASLGDAAAPPRINVSADGRYVDAGGEQVWIDVLRASLARGVAPRSWNDYLYLTVGGTLSNAGISGQAFRHGPQISNVLEMDVITGHGEMVTCSKQLNADLFDAVLGGLGQFGVITRARIAVEPAPARARWVRFVYTDFAAFSADQERLTAPRPGGGGASFGPMSYVEGSVFVNQSLATDLANTGFFTDADVARIVALAGERNATTVYSIEATLNYDNATAAAAAVDQELASVLGTLSYVEGFAFQRDVAYAAFLDRVHGEEVALNKLGLWRVPHPWLNMFVPRSRIADFDRGVFKGILQGTDIVGPLIVYPLNKSMWDDGMSAATPSEDVFYAVSLLFSSVAPNDLARLQEQNRRILRFCDLAGIQYKTYLARHTDRSDWVRHFGAAKWNRFVEMKNKYDPKRLLSPGQDIFN,sabio,Q9T0N8,O.O.O=C(O)C=Cc1ccc(O)c(O)c1>>CC(C)=CC=O.O,0.3,35.718177889403165,37.0,6.5,1.5.99.12,4577.0,-0.5228787452803376,O.O.O=C(O)C=Cc1ccc(O)c(O)c1,CC(C)=CC=O.O,-0.5228787452803376,O.O.O=C(O)C=Cc1ccc(O)c(O)c1__MAVVYYLLLAGLIACSHALAAGTPALGDDRGRPWPASLAALALDGKLRTDSNATAAASTDFGNITSALPAAVLYPSSTGDLVALLSAANSTPGWPYTIAFRGRGHSLMGQAFAPGGVVVNMASLGDAAAPPRINVSADGRYVDAGGEQVWIDVLRASLARGVAPRSWNDYLYLTVGGTLSNAGISGQAFRHGPQISNVLEMDVITGHGEMVTCSKQLNADLFDAVLGGLGQFGVITRARIAVEPAPARARWVRFVYTDFAAFSADQERLTAPRPGGGGASFGPMSYVEGSVFVNQSLATDLANTGFFTDADVARIVALAGERNATTVYSIEATLNYDNATAAAAAVDQELASVLGTLSYVEGFAFQRDVAYAAFLDRVHGEEVALNKLGLWRVPHPWLNMFVPRSRIADFDRGVFKGILQGTDIVGPLIVYPLNKSMWDDGMSAATPSEDVFYAVSLLFSSVAPNDLARLQEQNRRILRFCDLAGIQYKTYLARHTDRSDWVRHFGAAKWNRFVEMKNKYDPKRLLSPGQDIFN,./data/raw/alphafold//AF-Q9T0N8-F1-model_v4.pdb,1034,580,242,262
+2189,12811,12983,MMTPPKAEKRPYPITTHGDTRVDDYYWLRDDERTDPQVLDYLQAENAFTDAALKPQQALRETLYEEMVARIPQQEHSVPYVRHGYRYQTRFEPGNEYAIYVRQPQAESEHWDTLIDGNQRAEQREFYTLGGLEVSPDNQKLAVAEDFLSRRQYDIRFKNLSDDSWTDEVLENTSGSFEWANDSATVYYVRKHAKTLLPYQVYRHVVGTDPQLDELIYEEQDDTFYVGLEKTTSDRFILIHLSSTTTSEILLLDADRADSTPQMFVPRRKDHEYGIDHYHQHFYIRSNKDGKNFGLYQSEQADEAQWQTLIAPRIEVMLEGFSLFRDWLVVEERSEGLTQLRQIHWQSGEVKRIAFDDPTYTTWLAYNPEPETELLRYGYSSMTTPTTLYELNLDSDERVMLKQQEVKNFTPENYRSERVWVKARDGVEVPVSLVYRHDSFARGTNPLMVYGYGSYGSSMDPAFSASRLSLLDRGFVFVLAHIRGGGELGQLWYEDGKLFKKQNTFNDFIDVTEALIAQGYGDAKRVFAMGGSAGGLLMGAVINQAPELFNGIVAQVPFVDVVTTMLDESIPLTTGEYDEWGNPNQQAYYDYILQYSPYDQVKAQDYPHMLVTTGLHDSQVQYWEPAKWVAKLRELKTDDRQLLLYTDMDSGHGGKSGRFKAYEDIALEYAFILALAE,brenda,B3VI58,N=C(N)NCCCC(N=C(O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>N=C(N)NCCCC(N=C(O)c1ccccc1)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,14.35,6.8167711819033055e-15,25.0,8.0,3.4.21.83,28151.0,1.1568519010700111,N=C(N)NCCCC(N=C(O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,N=C(N)NCCCC(N=C(O)c1ccccc1)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,1.1568519010700111,N=C(N)NCCCC(N=C(O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MMTPPKAEKRPYPITTHGDTRVDDYYWLRDDERTDPQVLDYLQAENAFTDAALKPQQALRETLYEEMVARIPQQEHSVPYVRHGYRYQTRFEPGNEYAIYVRQPQAESEHWDTLIDGNQRAEQREFYTLGGLEVSPDNQKLAVAEDFLSRRQYDIRFKNLSDDSWTDEVLENTSGSFEWANDSATVYYVRKHAKTLLPYQVYRHVVGTDPQLDELIYEEQDDTFYVGLEKTTSDRFILIHLSSTTTSEILLLDADRADSTPQMFVPRRKDHEYGIDHYHQHFYIRSNKDGKNFGLYQSEQADEAQWQTLIAPRIEVMLEGFSLFRDWLVVEERSEGLTQLRQIHWQSGEVKRIAFDDPTYTTWLAYNPEPETELLRYGYSSMTTPTTLYELNLDSDERVMLKQQEVKNFTPENYRSERVWVKARDGVEVPVSLVYRHDSFARGTNPLMVYGYGSYGSSMDPAFSASRLSLLDRGFVFVLAHIRGGGELGQLWYEDGKLFKKQNTFNDFIDVTEALIAQGYGDAKRVFAMGGSAGGLLMGAVINQAPELFNGIVAQVPFVDVVTTMLDESIPLTTGEYDEWGNPNQQAYYDYILQYSPYDQVKAQDYPHMLVTTGLHDSQVQYWEPAKWVAKLRELKTDDRQLLLYTDMDSGHGGKSGRFKAYEDIALEYAFILALAE,./data/raw/alphafold//AF-B3VI58-F1-model_v4.pdb,2185,4406,4300,4178
+2190,3116,3158,MMRKSVRRAMLMTTACVSLLLASVPLCAQANDVQQKLAALEKSSGGRLGVALINTADNTQTLYRADERFAMCSTSKVMAAAAVLKQSETQKGLLSQRVEIKPSDLINYNPIAEKHVNGTMTFGELSAAALQYSDNTAMNKLIAHLGGPDKVTAFARTIGDDTFRLDRTEPTLNTAIPGDPRDTTTPLAMAQALRNLTLGNALGDTQRAQLVMWLKGNTTGAASIRAGLPTSWVVGDKTGSGDYGTTNDIAVIWPEGRAPLVLVTYFTQSEPKAESRRDVLAAAARIVTDGY,sabio,Q8GD10,CC(C)(ON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[n+]3ccccc3)CSC12)c1csc(N)n1)C(=O)O.O>>,0.015,99.82319723056142,37.0,7.0,3.5.2.6,573.0,-1.8239087409443189,CC(C)(ON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[n+]3ccccc3)CSC12)c1csc(N)n1)C(=O)O.O,,-1.8239087409443189,CC(C)(ON=C(C(=O)NC1C(=O)N2C(C(=O)[O-])=C(C[n+]3ccccc3)CSC12)c1csc(N)n1)C(=O)O.O__MMRKSVRRAMLMTTACVSLLLASVPLCAQANDVQQKLAALEKSSGGRLGVALINTADNTQTLYRADERFAMCSTSKVMAAAAVLKQSETQKGLLSQRVEIKPSDLINYNPIAEKHVNGTMTFGELSAAALQYSDNTAMNKLIAHLGGPDKVTAFARTIGDDTFRLDRTEPTLNTAIPGDPRDTTTPLAMAQALRNLTLGNALGDTQRAQLVMWLKGNTTGAASIRAGLPTSWVVGDKTGSGDYGTTNDIAVIWPEGRAPLVLVTYFTQSEPKAESRRDVLAAAARIVTDGY,./data/raw/alphafold//AF-Q8GD10-F1-model_v4.pdb,1458,649,811,1083
+2191,5105,5191,MELTVEAWVQIFLLPVEKSDPVSRLDPDRMGHVKGPVQMIQNCRISTTQGNNRITQRSPGYTPDSPTKSFSLWNSQNLLVQSMKLAASAVSIWFWGSWRIPRELLVFSLHWNLKEVGLSTSPSNSTNLPARVKGKQAEKQSFLLLSSFIWVAIRSYSSFCQVLPKFLLRARANGAWAAEGGLYLDPPTDWAALGVGRGQPRCAMAERDATVWASHEKMLTQPLKESDAEVYSIIKKESNRQRVGLELIASENFASRAVLEALGSCLNNKYSEGYPGQRYYGGTEFIDELETLCQKRALQAYHLDPQCWGVNVQPYSGSPANFAVYTALVEPHGRIMGLDLPDGGHLTHGFMTDKKKISATSIFFESMPYKVYPDTGYINYDQLEENASLFHPKLIIAGTSCYSRNLDYARLRKIADDNGAYLMADMAHISGLVAAGVVPSPFEHCHVVTTTTHKTLRGCRAGMIFYRKGVRSVDPKTGEETYYELESLINSAVFPGLQGGPHNHAIAGVAVALKQAMTTEFKIYQLQVLANCRALSDALTELGYKIVTGGSDNHLILMDLRPKGTDGGRAEKVLEACSIACNKNTCPGDKSALRPSGLRLGTPALTSRGLLEEDFQKIAHFIHRGIELTLQIQSHMTMRATLKEFKEKLTGDEKFQSAVAALREEVENFASNFSLPGLPDF,sabio,Q6TXG7,CC(O)C(N)C(=O)O>>CC=O.NCC(=O)O,732.0,0.0,37.0,7.2,2.1.2.1,10116.0,2.864511081058392,CC(O)C(N)C(=O)O,CC=O.NCC(=O)O,2.864511081058392,CC(O)C(N)C(=O)O__MELTVEAWVQIFLLPVEKSDPVSRLDPDRMGHVKGPVQMIQNCRISTTQGNNRITQRSPGYTPDSPTKSFSLWNSQNLLVQSMKLAASAVSIWFWGSWRIPRELLVFSLHWNLKEVGLSTSPSNSTNLPARVKGKQAEKQSFLLLSSFIWVAIRSYSSFCQVLPKFLLRARANGAWAAEGGLYLDPPTDWAALGVGRGQPRCAMAERDATVWASHEKMLTQPLKESDAEVYSIIKKESNRQRVGLELIASENFASRAVLEALGSCLNNKYSEGYPGQRYYGGTEFIDELETLCQKRALQAYHLDPQCWGVNVQPYSGSPANFAVYTALVEPHGRIMGLDLPDGGHLTHGFMTDKKKISATSIFFESMPYKVYPDTGYINYDQLEENASLFHPKLIIAGTSCYSRNLDYARLRKIADDNGAYLMADMAHISGLVAAGVVPSPFEHCHVVTTTTHKTLRGCRAGMIFYRKGVRSVDPKTGEETYYELESLINSAVFPGLQGGPHNHAIAGVAVALKQAMTTEFKIYQLQVLANCRALSDALTELGYKIVTGGSDNHLILMDLRPKGTDGGRAEKVLEACSIACNKNTCPGDKSALRPSGLRLGTPALTSRGLLEEDFQKIAHFIHRGIELTLQIQSHMTMRATLKEFKEKLTGDEKFQSAVAALREEVENFASNFSLPGLPDF,./data/raw/alphafold//AF-Q6TXG7-F1-model_v4.pdb,3088,1848,3478,2289
+2192,16761,16991,MATQRIRDFLAKHRSEGPCLIVDLDIIRENYLNFEKALPQSRIFYAIKANPAPEILNLLASLGSSFDAASVAEIEMALKAGATSDRISFGNTIKKERDIAQAYALGISLYAVDCVEEVEKIARAAPGVRVFCRVLTDGKGAEWPLSRKFGCVPAMAVDVLRRAHQLGLQAYGVSFHVGSQQTDLSAWDRALSDAATVFRHLEHEGISLKLVNMGGGFPTRYLKDVPTTQAYGTVVFDSLKKYFGNRIPETIIEPGRGMVGNAGVIRTEVVLISKKADNDNIRWVYLDVGKFNGLTETMDEAIRYPIETPHDDKAMEPCILAGPTCDSADVLYEKTPYLLPLSLTVGDELLIHGTGAYTATYASVAFNGFEPLPSYVI,sabio,A0A0R4J8C9,NCCCCC(N)C(=O)O>>NCCCCCN.O=C=O,0.3,0.0,37.0,8.0,4.1.1.18,38323.0,-0.5228787452803376,NCCCCC(N)C(=O)O,NCCCCCN.O=C=O,-0.5228787452803376,NCCCCC(N)C(=O)O__MATQRIRDFLAKHRSEGPCLIVDLDIIRENYLNFEKALPQSRIFYAIKANPAPEILNLLASLGSSFDAASVAEIEMALKAGATSDRISFGNTIKKERDIAQAYALGISLYAVDCVEEVEKIARAAPGVRVFCRVLTDGKGAEWPLSRKFGCVPAMAVDVLRRAHQLGLQAYGVSFHVGSQQTDLSAWDRALSDAATVFRHLEHEGISLKLVNMGGGFPTRYLKDVPTTQAYGTVVFDSLKKYFGNRIPETIIEPGRGMVGNAGVIRTEVVLISKKADNDNIRWVYLDVGKFNGLTETMDEAIRYPIETPHDDKAMEPCILAGPTCDSADVLYEKTPYLLPLSLTVGDELLIHGTGAYTATYASVAFNGFEPLPSYVI,./data/raw/alphafold//AF-A0A0R4J8C9-F1-model_v4.pdb,2706,3806,2387,5289
+2193,3986,4039,MEKPQIELPVGPAPEDLVISDIIVGEGAEARPGGEVEVHYVGVDFETGEEFDSSWDRGQTSQFPLNGLIAGWQEGIPGMKVGGRRQLTIPPEAAYGPEGSGHPLSGRTLVFIIDLISA,brenda,P42458,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1>>CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1,58.0,0.0,30.0,7.5,5.2.1.8,1718.0,1.7634279935629371,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1,1.7634279935629371,CC(C)C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1__MEKPQIELPVGPAPEDLVISDIIVGEGAEARPGGEVEVHYVGVDFETGEEFDSSWDRGQTSQFPLNGLIAGWQEGIPGMKVGGRRQLTIPPEAAYGPEGSGHPLSGRTLVFIIDLISA,./data/raw/alphafold//AF-P42458-F1-model_v4.pdb,1873,1577,3167,1939
+2194,11627,11785,MGSTAETQLTPVQVTDDEAALFAMQLASASVLPMALKSALELDLLEIMAKNGSPMSPTEIASKLPTKNPEAPVMLDRILRLLTSYSVLTCSNRKLSGDGVERIYGLGPVCKYLTKNEDGVSIAALCLMNQDKVLMESWYHLKDAILDGGIPFNKAYGMSAFEYHGTDPRFNKVFNNGMSNHSTITMKKILETYKGFEGLTSLVDVGGGIGATLKMIVSKYPNLKGINFDLPHVIEDAPSHPGIEHVGGDMFVSVPKGDAIFMKWICHDWSDEHCVKFLKNCYESLPEDGKVILAECILPETPDSSLSTKQVVHVDCIMLAHNPGGKERTEKEFEALAKASGFKGIKVVCDAFGVNLIELLKKL,uniprot_search,Q9FK25,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/C=C/c1ccc(O)c(O)c1>>COc1cc(/C=C/C=O)ccc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,1.55,0.0894236962149426,37.0,7.5,2.1.1.68,3702.0,0.1903316981702915,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/C=C/c1ccc(O)c(O)c1,COc1cc(/C=C/C=O)ccc1O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,0.1903316981702915,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/C=C/c1ccc(O)c(O)c1__MGSTAETQLTPVQVTDDEAALFAMQLASASVLPMALKSALELDLLEIMAKNGSPMSPTEIASKLPTKNPEAPVMLDRILRLLTSYSVLTCSNRKLSGDGVERIYGLGPVCKYLTKNEDGVSIAALCLMNQDKVLMESWYHLKDAILDGGIPFNKAYGMSAFEYHGTDPRFNKVFNNGMSNHSTITMKKILETYKGFEGLTSLVDVGGGIGATLKMIVSKYPNLKGINFDLPHVIEDAPSHPGIEHVGGDMFVSVPKGDAIFMKWICHDWSDEHCVKFLKNCYESLPEDGKVILAECILPETPDSSLSTKQVVHVDCIMLAHNPGGKERTEKEFEALAKASGFKGIKVVCDAFGVNLIELLKKL,./data/raw/alphafold//AF-Q9FK25-F1-model_v4.pdb,3864,3990,3324,2128
+2195,20246,20538,MRIAVIGGGSSYTPELVKGLLDISEDVRIDEVIFYDIDEEKQKIVVDFVKRLVKDRFKVLISDTFEGAVVDAKYVIFQFRPGGLKGRENDEGIPLKYGLIGQETTGVGGFSAALRAFPIVEEYVDTVRKTSNATIVNFTNPSGHITEFVRNYLEYEKFIGLCNVPINFIREIAEMFSARLEDVFLKYYGLNHLSFIEKVFVKGEDVTEKVFENLKLKLSNIPDEDFPTWFYDSVRLIVNPYLRYYLMEKKMFKKISTHELRAREVMKIEKELFEKYRTAVEIPEELTKRGGSMYSTAAAHLIRDLETDEGKIHIVNTRNNGSIENLPDDYVLEIPCYVRSGRVHTLSQGKGDHFALSFIHAVKMYERLTIEAYLKRSKKLALKALLSHPLGPDVEDAKDLLEEILEANREYVKLG,brenda,Q9X108,O.O=[N+]([O-])c1ccc(S[C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O)[C@H]2O)cc1>>O=P(O)(O)OC[C@H]1O[C@@H](S)[C@H](O)[C@@H](O)[C@@H]1O.O=[N+]([O-])c1ccc(O)cc1,1.6,0.0,50.0,7.5,3.2.1.86,2336.0,0.2041199826559248,O.O=[N+]([O-])c1ccc(S[C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O)[C@H]2O)cc1,O=P(O)(O)OC[C@H]1O[C@@H](S)[C@H](O)[C@@H](O)[C@@H]1O.O=[N+]([O-])c1ccc(O)cc1,0.2041199826559248,O.O=[N+]([O-])c1ccc(S[C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O)[C@H]2O)cc1__MRIAVIGGGSSYTPELVKGLLDISEDVRIDEVIFYDIDEEKQKIVVDFVKRLVKDRFKVLISDTFEGAVVDAKYVIFQFRPGGLKGRENDEGIPLKYGLIGQETTGVGGFSAALRAFPIVEEYVDTVRKTSNATIVNFTNPSGHITEFVRNYLEYEKFIGLCNVPINFIREIAEMFSARLEDVFLKYYGLNHLSFIEKVFVKGEDVTEKVFENLKLKLSNIPDEDFPTWFYDSVRLIVNPYLRYYLMEKKMFKKISTHELRAREVMKIEKELFEKYRTAVEIPEELTKRGGSMYSTAAAHLIRDLETDEGKIHIVNTRNNGSIENLPDDYVLEIPCYVRSGRVHTLSQGKGDHFALSFIHAVKMYERLTIEAYLKRSKKLALKALLSHPLGPDVEDAKDLLEEILEANREYVKLG,./data/raw/alphafold//AF-Q9X108-F1-model_v4.pdb,445,3110,5396,6277
+2196,21939,22268,MRTFFVGGNWKANPKTVQEAEKLVEMLNGAKVEGNVEVVVAAPFVFLPTLQQKLRKDWKVSAENVFTKPNGAFTGEVTVPMIKSFGIEWTILGHSERRDILKEDDEFLAAKAKFALENGMKIIYCCGEHLSEREAGKASEFVSAQIEKMIPAIPAGKWDDVVIAYEPIWAIGTGKVASTQDAQEMCKVIRDILAAKVGADIANKVRILYGGSVKPNNCNELAACPDVDGFLVGGASLEAGFINIVNSNVHSK,brenda,A2FT29,O=C[C@H](O)COP(=O)(O)O>>O=C(CO)COP(=O)(O)O,1373.0,0.0,25.0,7.4,5.3.1.1,5722.0,3.137670537236755,O=C[C@H](O)COP(=O)(O)O,O=C(CO)COP(=O)(O)O,3.137670537236755,O=C[C@H](O)COP(=O)(O)O__MRTFFVGGNWKANPKTVQEAEKLVEMLNGAKVEGNVEVVVAAPFVFLPTLQQKLRKDWKVSAENVFTKPNGAFTGEVTVPMIKSFGIEWTILGHSERRDILKEDDEFLAAKAKFALENGMKIIYCCGEHLSEREAGKASEFVSAQIEKMIPAIPAGKWDDVVIAYEPIWAIGTGKVASTQDAQEMCKVIRDILAAKVGADIANKVRILYGGSVKPNNCNELAACPDVDGFLVGGASLEAGFINIVNSNVHSK,./data/raw/alphafold//AF-A2FT29-F1-model_v4.pdb,728,146,5879,6792
+2197,18208,18468,MSQFFFNQRTHLVSDVIDGAIIASPWNNLARLESDPAIRIVVRRDLNKNNVAVISGGGSGHEPAHVGFIGKGMLTAAVCGDVFASPSVDAVLTAIQAVTGEAGCLLIVKNYTGDRLNFGLAAEKARRLGYNVEMLIVGDDISLPDNKHPRGIAGTILVHKIAGYFAERGYNLATVLREAQYAASNTFSLGVALSSCHLPQETDAAPRHHPGHAELGMGIHGEPGASVIDTQNSAQVVNLMVDKLLAALPETGRLAVMINNLGGVSVAEMAIITRELASSPLHSRIDWLIGPASLVTALDMKGFSLTAIVLEESIEKALLTEVETSNWPTPVPPREITCVVSSHASARVEFQPSANALVAGIVELVTATLSDLETHLNALDAKVGDGDTGSTFAAAAREIASLLHRQQLPLNNLATLFALIGERLTVVMGGSSGVLMSIFFTAAGQKLEQGANVVEALNTGLAQMKFYGGADEGDRTMIDALQPALTSLLAQPKNLQAAFDAAQAGAERTCLSSKANAGRASYLSSESLLGNMDPGAQRLAMVFKALAESELG,sabio,P45510,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=CC(O)CO>>Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=CC(O)COP(=O)(O)O,14280.0,9.509404921842883e-15,30.0,7.5,2.7.1.29,546.0,4.154728207440155,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=CC(O)CO,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O.O=CC(O)COP(=O)(O)O,4.269512944217916,Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O.O=CC(O)CO__MSQFFFNQRTHLVSDVIDGAIIASPWNNLARLESDPAIRIVVRRDLNKNNVAVISGGGSGHEPAHVGFIGKGMLTAAVCGDVFASPSVDAVLTAIQAVTGEAGCLLIVKNYTGDRLNFGLAAEKARRLGYNVEMLIVGDDISLPDNKHPRGIAGTILVHKIAGYFAERGYNLATVLREAQYAASNTFSLGVALSSCHLPQETDAAPRHHPGHAELGMGIHGEPGASVIDTQNSAQVVNLMVDKLLAALPETGRLAVMINNLGGVSVAEMAIITRELASSPLHSRIDWLIGPASLVTALDMKGFSLTAIVLEESIEKALLTEVETSNWPTPVPPREITCVVSSHASARVEFQPSANALVAGIVELVTATLSDLETHLNALDAKVGDGDTGSTFAAAAREIASLLHRQQLPLNNLATLFALIGERLTVVMGGSSGVLMSIFFTAAGQKLEQGANVVEALNTGLAQMKFYGGADEGDRTMIDALQPALTSLLAQPKNLQAAFDAAQAGAERTCLSSKANAGRASYLSSESLLGNMDPGAQRLAMVFKALAESELG,./data/raw/alphafold//AF-P45510-F1-model_v4.pdb,40,2510,2798,5644
+2198,21210,21534,MQQASTPTIGMIVPPAAGLVPADGARLYPDLPFIASGLGLGSVTPEGYDAVIESVVDHARRLQKQGAAVVSLMGTSLSFYRGAAFNAALTVAMREATGLPCTTMSTAVLNGLRALGVRRVALATAYIDDVNERLAAFLAEESLVPTGCRSLGITGVEAMARVDTATLVDLCVRAFEAAPDSDGILLSCGGLLTLDAIPEVERRLGVPVVSSSPAGFWDAVRLAGGGAKARPGYGRLFDES,brenda,Q05115,O=C(O)C(O)(C(=O)O)c1ccc2sccc2c1>>O=C(O)[C@H](O)c1ccc2sccc2c1.O=C=O,147.7,0.0,45.0,8.25,4.1.1.76,518.0,2.169380495311949,O=C(O)C(O)(C(=O)O)c1ccc2sccc2c1,O=C(O)[C@H](O)c1ccc2sccc2c1.O=C=O,2.169380495311949,O=C(O)C(O)(C(=O)O)c1ccc2sccc2c1__MQQASTPTIGMIVPPAAGLVPADGARLYPDLPFIASGLGLGSVTPEGYDAVIESVVDHARRLQKQGAAVVSLMGTSLSFYRGAAFNAALTVAMREATGLPCTTMSTAVLNGLRALGVRRVALATAYIDDVNERLAAFLAEESLVPTGCRSLGITGVEAMARVDTATLVDLCVRAFEAAPDSDGILLSCGGLLTLDAIPEVERRLGVPVVSSSPAGFWDAVRLAGGGAKARPGYGRLFDES,./data/raw/alphafold//AF-Q05115-F1-model_v4.pdb,1049,605,272,296
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+2200,1523,1551,MSKSALDPVEFLKGALEIPSPSGKERLVAEYLAEGMQKLGLKGFVDEADNARGQVGEGPVQVVLLGHIDTVPGQIPVRLEGGRLFGRGAVDAKGPFVAMIFAAAGLSEEARKRLTVHLVGATEEEAPSSKGARFVAPRLKPHYAVIGEPSGWEGITLGYKGRLLVKARREKDHFHSAHHEPNAAEELISYFVAIKAWAEAMNVGQRPFDQVQYTLRDFRVHPAELRQVAEMFFDLRLPPRLPPEEAIRHLTAYAPPTIELEFFGREVPYQGPKDTPLTRAFRQAIRKAGGRPVFKLKTGTSDMNVLAPHWPVPMVAYGPGDSTLDHTPYEHVEVAEFLKGIEVLRGALEALAQTHAGEKEG,sabio,Q8VUS5,CC(=O)NC(CCCN)C(=O)O.O>>CC(=O)O.NCCCC(N)C(=O)O,28.1,1.474805252855461e-14,60.0,7.0,3.5.1.17,274.0,1.44870631990508,CC(=O)NC(CCCN)C(=O)O.O,CC(=O)O.NCCCC(N)C(=O)O,1.44870631990508,CC(=O)NC(CCCN)C(=O)O.O__MSKSALDPVEFLKGALEIPSPSGKERLVAEYLAEGMQKLGLKGFVDEADNARGQVGEGPVQVVLLGHIDTVPGQIPVRLEGGRLFGRGAVDAKGPFVAMIFAAAGLSEEARKRLTVHLVGATEEEAPSSKGARFVAPRLKPHYAVIGEPSGWEGITLGYKGRLLVKARREKDHFHSAHHEPNAAEELISYFVAIKAWAEAMNVGQRPFDQVQYTLRDFRVHPAELRQVAEMFFDLRLPPRLPPEEAIRHLTAYAPPTIELEFFGREVPYQGPKDTPLTRAFRQAIRKAGGRPVFKLKTGTSDMNVLAPHWPVPMVAYGPGDSTLDHTPYEHVEVAEFLKGIEVLRGALEALAQTHAGEKEG,./data/raw/alphafold//AF-Q8VUS5-F1-model_v4.pdb,1382,887,684,973
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+2217,7338,7460,MESQVRGGTRWKRFAVVMVPSVAATAAIGVALAQGALAASFSVSGQSFKVTAQELNGTGFSQYGAIDQGYTLSGEKTAHPVAVSVFDTARIQKMCQSVVTPNIPLLGSVSLTLTAGDSADPEKQVNAKNLYIDVEDLGADAEFTNIDIGVAGKDISQGPGMKAGEVQKKQANPYGFAQQAEKAKLTDVKQTAWATTAGTFKLPGLKMKLQTGTHECY,sabio,Q2AAT6,CCCCCCCCCCCCCC(=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)CCCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C.CCCCCCCCCCCCCC(=O)O,23.5,9.234723797122532e-15,37.0,7.0,3.1.1.13,1931.0,1.3710678622717365,CCCCCCCCCCCCCC(=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)CCCC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C.CCCCCCCCCCCCCC(=O)O,1.3710678622717365,CCCCCCCCCCCCCC(=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__MESQVRGGTRWKRFAVVMVPSVAATAAIGVALAQGALAASFSVSGQSFKVTAQELNGTGFSQYGAIDQGYTLSGEKTAHPVAVSVFDTARIQKMCQSVVTPNIPLLGSVSLTLTAGDSADPEKQVNAKNLYIDVEDLGADAEFTNIDIGVAGKDISQGPGMKAGEVQKKQANPYGFAQQAEKAKLTDVKQTAWATTAGTFKLPGLKMKLQTGTHECY,./data/raw/alphafold//AF-Q2AAT6-F1-model_v4.pdb,3268,2100,839,1162
+2218,12250,12419,MKIAIFGTVGAGKSTISAEISKKLGYEIFKEPVEENPYFEQYYKDLKKTVFKMQIYMLTARSKQLKQAKNLENIIFDRTLLEDPIFMKVNYDLNNVDQTDYNTYIDFYNNVVLENLKIPENKLSFDIVIYLRVSTKTAISRIKKRGRSEELLIGEEYWETLNKNYEEFYKQNVYDFPFFVVDAELDVKTQIELIMNKLNSIKNPN,sabio,Q93IG4,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1CC(O)C(CO)O1>>Cc1cn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)nc1O.Nc1ncnc2c1ncn2C1CC(O)C(COP(=O)(O)O)O1,1.64,1.0782254265490456,37.0,7.4,2.7.1.76,2102.0,0.2148438480476978,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1CC(O)C(CO)O1,Cc1cn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)nc1O.Nc1ncnc2c1ncn2C1CC(O)C(COP(=O)(O)O)O1,0.2148438480476978,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1CC(O)C(CO)O1__MKIAIFGTVGAGKSTISAEISKKLGYEIFKEPVEENPYFEQYYKDLKKTVFKMQIYMLTARSKQLKQAKNLENIIFDRTLLEDPIFMKVNYDLNNVDQTDYNTYIDFYNNVVLENLKIPENKLSFDIVIYLRVSTKTAISRIKKRGRSEELLIGEEYWETLNKNYEEFYKQNVYDFPFFVVDAELDVKTQIELIMNKLNSIKNPN,./data/raw/alphafold//AF-Q93IG4-F1-model_v4.pdb,2034,4198,4067,3914
+2219,2606,2641,MNHLRAEGPASVLAIGTANPENILLQDEFPDYYFRVTKSEHMTQLKEKFRKICDKSMIRKRNCFLNEEHLKQNPRLVEHEMQTLDARQDMLVVEVPKLGKDACAKAIKEWGQPKSKITHLIFTSASTTDMPGADYHCAKLLGLSPSVKRVMMYQLGCYGGGTVLRIAKDIAENNKGARVLAVCCDIMACLFRGPSESDLELLVGQAIFGDGAAAVIVGAEPDESVGERPIFELVSTGQTILPNSEGTIGGHIREAGLIFDLHKDVPMLISNNIEKCLIEAFTPIGISDWNSIFWITHPGGKAILDKVEEKLHLKSDKFVDSRHVLSEHGNMSSSTVLFVMDELRKRSLEEGKSTTGDGFEWGVLFGFGPGLTVERVVVRSVPIKY,sabio,B1Q2B6,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)CC(=O)O.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>>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,31.5,36.55554544222242,30.0,5.5,2.3.1.206,3483.0,1.4983105537896004,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)CC(=O)O.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,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,1.4983105537896004,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)CC(=O)O.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__MNHLRAEGPASVLAIGTANPENILLQDEFPDYYFRVTKSEHMTQLKEKFRKICDKSMIRKRNCFLNEEHLKQNPRLVEHEMQTLDARQDMLVVEVPKLGKDACAKAIKEWGQPKSKITHLIFTSASTTDMPGADYHCAKLLGLSPSVKRVMMYQLGCYGGGTVLRIAKDIAENNKGARVLAVCCDIMACLFRGPSESDLELLVGQAIFGDGAAAVIVGAEPDESVGERPIFELVSTGQTILPNSEGTIGGHIREAGLIFDLHKDVPMLISNNIEKCLIEAFTPIGISDWNSIFWITHPGGKAILDKVEEKLHLKSDKFVDSRHVLSEHGNMSSSTVLFVMDELRKRSLEEGKSTTGDGFEWGVLFGFGPGLTVERVVVRSVPIKY,./data/raw/alphafold//AF-B1Q2B6-F1-model_v4.pdb,1656,1261,1719,1452
+2220,11274,11430,MSIIVISGCATGIGAATRKVLEAAGHQIVGIDIRDAEVIADLSTAEGRKQAIADVLAKCSKGMDGLVLCAGLGPQTKVLGNVVSVNYFGATELMDAFLPALKKGHQPAAVVISSVASAHLAFDKNPLALALEAGEEAKARAIVEHAGEQGGNLAYAGSKNALTVAVRKRAAAWGEAGVRLNTIAPGATETPLLQAGLQDPRYGESIAKFVPPMGRRAEPSEMASVIAFLMSPAASYVHGAQIVIDGGIDAVMRPTQF,brenda,P80702,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.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[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12.N=C(O)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+],500.0,5.949791849443733e-15,25.0,10.416666666666666,1.1.1.357,285.0,2.6989700043360187,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.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[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12.N=C(O)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+],2.6989700043360187,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.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__MSIIVISGCATGIGAATRKVLEAAGHQIVGIDIRDAEVIADLSTAEGRKQAIADVLAKCSKGMDGLVLCAGLGPQTKVLGNVVSVNYFGATELMDAFLPALKKGHQPAAVVISSVASAHLAFDKNPLALALEAGEEAKARAIVEHAGEQGGNLAYAGSKNALTVAVRKRAAAWGEAGVRLNTIAPGATETPLLQAGLQDPRYGESIAKFVPPMGRRAEPSEMASVIAFLMSPAASYVHGAQIVIDGGIDAVMRPTQF,./data/raw/alphafold//AF-P80702-F1-model_v4.pdb,2931,1922,3564,2393
+2221,12346,12516,MKRARSANIPGAILHSLAELQDGLNAMIDPSWRAVRSLDNWALAITMESTELLDSYPWKWWKNLNATPDLANVRIELVDIFHFSLSGAMQMRSTPDDEIPAASLKPLKEVMTTFLPAKECTSDPYGFVFFPLTDTQNAIASFRNIIQLANAYRFDVIIECIIYAAEDLGFNLVAYYIAKHTLNCIRQLSGYKDGSYVKVNNGVEDNSLLHNCIKDVSLDEVLDADKYVQAWNSIMANVYEAFQIKESDRKDAERWFALAKENRLAIKA,uniprot_search,O15826,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O.O>>Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)c(=O)nc1O.O=P(O)(O)OP(=O)(O)O,8.6,5.6765876673272326e-15,50.0,9.0,3.6.1.23,5664.0,0.9344984512435676,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O.O,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)c(=O)nc1O.O=P(O)(O)OP(=O)(O)O,0.9344984512435676,Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)nc1O.O__MKRARSANIPGAILHSLAELQDGLNAMIDPSWRAVRSLDNWALAITMESTELLDSYPWKWWKNLNATPDLANVRIELVDIFHFSLSGAMQMRSTPDDEIPAASLKPLKEVMTTFLPAKECTSDPYGFVFFPLTDTQNAIASFRNIIQLANAYRFDVIIECIIYAAEDLGFNLVAYYIAKHTLNCIRQLSGYKDGSYVKVNNGVEDNSLLHNCIKDVSLDEVLDADKYVQAWNSIMANVYEAFQIKESDRKDAERWFALAKENRLAIKA,./data/raw/alphafold//AF-O15826-F1-model_v4.pdb,2038,4202,4072,3919
+2222,12567,12737,MAKRVAIVGAGVSGLASIKCCLEEGLEPTCFERSDDLGGLWRFTEHVEEGRASLYKSVVSNSCKEMSCYSDFPFPEDYPNYVPNSQFLEYLKMYANHFDLLKHIQFKTKVCSVTKCSDSAVSGQWEVVTMHEEKQESAIFDAVMVCTGFLTNPYLPLDSFPGINAFKGQYFHSRQYKHPDIFKDKRVLVIGMGNSGTDIAVEASHLAEKVFLSTTGGGWVISRIFDSGYPWDMVFMTRFQNMLRNSLPTPIVTWLMERKINNWLNHANYGLIPEDRTQLKEFVLNDELPGRIITGKVFIRPSIKEVKENSVIFNNTSKEEPIDIIVFATGYTFAFPFLDESVVKVEDGQASLYKYIFPAHLQKPTLAIIGLIKPLGSMIPTGETQARWAVRVLKGVNKLPPPSVMIEEINARKENKPSWFGLCYCKALQSDYITYIDELLTYINAKPNLFSMLLTDPHLALTVFFGPCSPYQFRLTGPGKWEGARNAIMTQWDRTFKVIKARVVQESPSPFESFLKVFSFLALLVAIFLIFL,brenda,Q01740,Cn1ccnc1S.N=C(O)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+]>>Cn1cc[nH]c1=S=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,0.038,6.36470319926996e-15,3.0,9.5,1.14.13.8,9606.0,-1.42021640338319,Cn1ccnc1S.N=C(O)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+],Cn1cc[nH]c1=S=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,-0.2798406965940431,Cn1ccnc1S.N=C(O)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+]__MAKRVAIVGAGVSGLASIKCCLEEGLEPTCFERSDDLGGLWRFTEHVEEGRASLYKSVVSNSCKEMSCYSDFPFPEDYPNYVPNSQFLEYLKMYANHFDLLKHIQFKTKVCSVTKCSDSAVSGQWEVVTMHEEKQESAIFDAVMVCTGFLTNPYLPLDSFPGINAFKGQYFHSRQYKHPDIFKDKRVLVIGMGNSGTDIAVEASHLAEKVFLSTTGGGWVISRIFDSGYPWDMVFMTRFQNMLRNSLPTPIVTWLMERKINNWLNHANYGLIPEDRTQLKEFVLNDELPGRIITGKVFIRPSIKEVKENSVIFNNTSKEEPIDIIVFATGYTFAFPFLDESVVKVEDGQASLYKYIFPAHLQKPTLAIIGLIKPLGSMIPTGETQARWAVRVLKGVNKLPPPSVMIEEINARKENKPSWFGLCYCKALQSDYITYIDELLTYINAKPNLFSMLLTDPHLALTVFFGPCSPYQFRLTGPGKWEGARNAIMTQWDRTFKVIKARVVQESPSPFESFLKVFSFLALLVAIFLIFL,./data/raw/alphafold//AF-Q01740-F1-model_v4.pdb,3144,1836,3463,2271
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+2225,897,922,MVLKQRANYLGFLIVFFTAFLVEAVPIKRQSNSTVDSLPPLIPSRTSAPSSSPSTTDPEAPAMSRNGPLPSDVETKYGMALNATSYPDSVVQAMSIDGGIRAATSQEINELTYYTTLSANSYCRTVIPGATWDCIHCDATEDLKIIKTWSTLIYDTNAMVARGDSEKTIYIVFRGSSSIRNWIADLTFVPVSYPPVSGTKVHKGFLDSYGEVQNELVATVLDQFKQYPSYKVAVTGHSLGGATALLCALDLYQREEGLSSSNLFLYTQGQPRVGDPAFANYVVSTGIPYRRTVNERDIVPHLPPAAFGFLHAGEEYWITDNSPETVQVCTSDLETSDCSNSIVPFTSVLDHLSYFGINTGLCT,sabio,P19515,C=CCC(=O)O.O>>*CC(*)O.CC(=O)O,950.0,1.3585253778693184e-14,25.0,7.0,3.1.1.1,4839.0,2.977723605288848,C=CCC(=O)O.O,*CC(*)O.CC(=O)O,2.977723605288848,C=CCC(=O)O.O__MVLKQRANYLGFLIVFFTAFLVEAVPIKRQSNSTVDSLPPLIPSRTSAPSSSPSTTDPEAPAMSRNGPLPSDVETKYGMALNATSYPDSVVQAMSIDGGIRAATSQEINELTYYTTLSANSYCRTVIPGATWDCIHCDATEDLKIIKTWSTLIYDTNAMVARGDSEKTIYIVFRGSSSIRNWIADLTFVPVSYPPVSGTKVHKGFLDSYGEVQNELVATVLDQFKQYPSYKVAVTGHSLGGATALLCALDLYQREEGLSSSNLFLYTQGQPRVGDPAFANYVVSTGIPYRRTVNERDIVPHLPPAAFGFLHAGEEYWITDNSPETVQVCTSDLETSDCSNSIVPFTSVLDHLSYFGINTGLCT,./data/raw/alphafold//AF-P19515-F1-model_v4.pdb,3291,2127,3799,632
+2226,12167,12331,MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG,brenda,P14902,Cc1ccc2[nH]cc(CC(N)C(=O)O)c2c1.O=O>>Cc1ccc(N=CO)c(C(=O)CC(N)C(=O)O)c1,3.78,0.0,25.0,6.5,1.13.11.52,9606.0,0.5774917998372253,Cc1ccc2[nH]cc(CC(N)C(=O)O)c2c1.O=O,Cc1ccc(N=CO)c(C(=O)CC(N)C(=O)O)c1,0.5774917998372253,Cc1ccc2[nH]cc(CC(N)C(=O)O)c2c1.O=O__MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG,./data/raw/alphafold//AF-P14902-F1-model_v4.pdb,2630,3525,1301,3252
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+2233,5276,5362,MEVMRVLHMNKGNGETSYAKNSTAQSNIISLGRRVMDEALKKLMMSNSEISSIGIADLGCSSGPNSLLSISNIVDTIHNLCPDLDRPVPELRVSLNDLPSNDFNYICASLPEFYDRVNNNKEGLGFGRGGGESCFVSAVPGSFYGRLFPRRSLHFVHSSSSLHWLSQVPCREAEKEDRTITADLENMGKIYISKTSPKSAHKAYALQFQTDFWVFLRSRSEELVPGGRMVLSFLGRRSLDPTTEESCYQWELLAQALMSMAKEGIIEEEKIDAFNAPYYAASSEELKMVIEKEGSFSIDRLEISPIDWEGGSISEESYDLVIRSKPEALASGRRVSNTIRAVVEPMLEPTFGENVMDELFERYAKIVGEYFYVSSPRYAIVILSLVRAG,brenda,Q9AR07,CC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O>>CC/C=C\C[C@@H]1C(=O)CC[C@H]1CC(=O)OC.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,25.0,0.0826606223820067,20.0,7.5,2.1.1.141,3702.0,1.3979400086720375,CC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O,CC/C=C\C[C@@H]1C(=O)CC[C@H]1CC(=O)OC.Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O,1.3979400086720375,CC/C=C\C[C@H]1C(=O)CC[C@@H]1CC(=O)O.C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O__MEVMRVLHMNKGNGETSYAKNSTAQSNIISLGRRVMDEALKKLMMSNSEISSIGIADLGCSSGPNSLLSISNIVDTIHNLCPDLDRPVPELRVSLNDLPSNDFNYICASLPEFYDRVNNNKEGLGFGRGGGESCFVSAVPGSFYGRLFPRRSLHFVHSSSSLHWLSQVPCREAEKEDRTITADLENMGKIYISKTSPKSAHKAYALQFQTDFWVFLRSRSEELVPGGRMVLSFLGRRSLDPTTEESCYQWELLAQALMSMAKEGIIEEEKIDAFNAPYYAASSEELKMVIEKEGSFSIDRLEISPIDWEGGSISEESYDLVIRSKPEALASGRRVSNTIRAVVEPMLEPTFGENVMDELFERYAKIVGEYFYVSSPRYAIVILSLVRAG,./data/raw/alphafold//AF-Q9AR07-F1-model_v4.pdb,3866,1893,3530,2349
+2234,21974,22305,MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,brenda,O94219,O=Cc1ccc(Cl)cc1.O=O>>O=C(O)c1ccc(Cl)cc1.OO,1.05,4.947150754224236,24.0,6.0,1.1.3.7,5323.0,0.021189299069938,O=Cc1ccc(Cl)cc1.O=O,O=C(O)c1ccc(Cl)cc1.OO,0.021189299069938,O=Cc1ccc(Cl)cc1.O=O__MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,./data/raw/alphafold//AF-O94219-F1-model_v4.pdb,1050,3522,1297,300
+2235,4623,4679,MKYEKLLPRFLEYVKVNTRSDENSTTTPSTQALVEFAHKMGEDMKALGLKDVHYLESNGYVIGTIPANTDKKVRKIGLLAHLDTADFNAEGVNPQILENYDGESVIKLGDTEFTLDPKDFPNLKNYKGQTLVHTDGTTLLGSDDKSGVAEIMTLADYLLNINPDFEHGEIRVGFGPDEEIGVGADKFDVADFDVDFAYTVDGGPLGELQYETFSAAGAVIEFQGKNVHPGTAKNTMVNALQLAIDYHNALPEFDRPEKTEGREGFFHLLKLDGTPEEARAQYIIRDHEEGKFNERKALMQEIADKMNAELGQNRVKPVIKDQYYNMAQIIEKDMSIIDIAKKAMENLDIVPIIEPIRGGTDGSKISFMGLPTPNLFAGGENMHGRFEFVSVQTMEKAVDTLLEIIRLNNEVVK,sabio,Q76HM5,CC(N=C(O)C(C)N=C(O)CN)C(=O)O.O>>CC(N)C(O)=NC(C)C(=O)O.NCC(=O)O,616.0,0.0,37.0,7.5,3.4.11.-,44688.0,2.7895807121644256,CC(N=C(O)C(C)N=C(O)CN)C(=O)O.O,CC(N)C(O)=NC(C)C(=O)O.NCC(=O)O,2.7895807121644256,CC(N=C(O)C(C)N=C(O)CN)C(=O)O.O__MKYEKLLPRFLEYVKVNTRSDENSTTTPSTQALVEFAHKMGEDMKALGLKDVHYLESNGYVIGTIPANTDKKVRKIGLLAHLDTADFNAEGVNPQILENYDGESVIKLGDTEFTLDPKDFPNLKNYKGQTLVHTDGTTLLGSDDKSGVAEIMTLADYLLNINPDFEHGEIRVGFGPDEEIGVGADKFDVADFDVDFAYTVDGGPLGELQYETFSAAGAVIEFQGKNVHPGTAKNTMVNALQLAIDYHNALPEFDRPEKTEGREGFFHLLKLDGTPEEARAQYIIRDHEEGKFNERKALMQEIADKMNAELGQNRVKPVIKDQYYNMAQIIEKDMSIIDIAKKAMENLDIVPIIEPIRGGTDGSKISFMGLPTPNLFAGGENMHGRFEFVSVQTMEKAVDTLLEIIRLNNEVVK,./data/raw/alphafold//AF-Q76HM5-F1-model_v4.pdb,1818,1497,3069,2077
+2236,17785,18028,MTEPDTERKGSSRRGFLAGLGAAALTGAGIGMAAGEVLRPLLPDSDPAASPEAEQRLRMAAQRADATAAPQPGISGPAPAFVHVIALDLAEEARKNPDTARDSAAAALRSWTELAARLHEESPHDIAEGAASAGLLPASLMVTVGIGGSLLSAIDAEDRRPDALADLPEFSTDDLHPRWCGGDFMLQVGAEDPMVLTAAVEELVAAAADATAVRWSLRGFRRTAAAARDPDATPRNLMGQIDGTANPAQDHPLFDRTITARPADNPAHAWMDGGSYLVVRRIRMLLTEWRKLDVAARERVIGRRLDTGAPLGSRNETDPVVLSARDEEGEPLIPENAHVRLASPENNLGARMFRRGYSYDQGWRDDGVRDAGLLFMAWQGDPATGFIPVQRSLADQGDALNRYIRHEGSALFAVPAAREGRYLGQDLIEG,brenda,Q47KB1,Nc1c(S(=O)(=O)[O-])cc(Nc2cccc(S(=O)(=O)CCOS(=O)(=O)[O-])c2)c2c1C(=O)c1ccccc1C2=O.OO.[Na+].[Na+]>>O,10.0,94.55107028869176,25.0,3.5,1.11.1.19,269800.0,1.0,Nc1c(S(=O)(=O)[O-])cc(Nc2cccc(S(=O)(=O)CCOS(=O)(=O)[O-])c2)c2c1C(=O)c1ccccc1C2=O.OO.[Na+].[Na+],O,1.0,Nc1c(S(=O)(=O)[O-])cc(Nc2cccc(S(=O)(=O)CCOS(=O)(=O)[O-])c2)c2c1C(=O)c1ccccc1C2=O.OO.[Na+].[Na+]__MTEPDTERKGSSRRGFLAGLGAAALTGAGIGMAAGEVLRPLLPDSDPAASPEAEQRLRMAAQRADATAAPQPGISGPAPAFVHVIALDLAEEARKNPDTARDSAAAALRSWTELAARLHEESPHDIAEGAASAGLLPASLMVTVGIGGSLLSAIDAEDRRPDALADLPEFSTDDLHPRWCGGDFMLQVGAEDPMVLTAAVEELVAAAADATAVRWSLRGFRRTAAAARDPDATPRNLMGQIDGTANPAQDHPLFDRTITARPADNPAHAWMDGGSYLVVRRIRMLLTEWRKLDVAARERVIGRRLDTGAPLGSRNETDPVVLSARDEEGEPLIPENAHVRLASPENNLGARMFRRGYSYDQGWRDDGVRDAGLLFMAWQGDPATGFIPVQRSLADQGDALNRYIRHEGSALFAVPAAREGRYLGQDLIEG,./data/raw/alphafold//AF-Q47KB1-F1-model_v4.pdb,3428,2419,2697,5538
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+2241,4711,4769,MESTGSVGEAPGGPRVLVVGGGIAGLGAAQRLCGHSAFPHLRVLEATARAGGRIRSERCFGGVVEVGAHWIHGPSRGNPVFQLAAEYGLLGEKELSQENQLVETGGHVGLPSVSYASSGASVSLQLVAEMATLFYGLIDQTREFLHAAETPVPSVGEYLKKEIGQHVAGWTEDEETRKLKLAVLNSFFNLECCVSGTHSMDLVALAPFGEYTVLPGLDCTFSKGYQGLTNCMMAALPEDTVVFEKPVKTIHWNGSFQEAAFPGETFPVSVECEDGDRFPAHHVIVTVPLGFLREHLDTFFDPPLPAEKAEAIRKIGFGTNNKIFLEFEEPFWEPDCQLIQLVWEDTSPLEDAAPELQDAWFRKLIGFVVLPAFASVHVLCGFIAGLESEFMETLSDEEVLLCLTQVLRRVTGNPRLPAPKSVLRSRWHSAPYTRGSYSYVAVGSTGGDLDLLAQPLPADGAGAQLQILFAGEATHRTFYSTTHGALLSGWREADRLLSLWAPQVQQPRPRL,uniprot_search,Q6QHF9,CC(O)=NCCCNCCCNCCCN=C(C)O.O.O=O>>,19.0,99.69079114178464,37.0,9.0,1.5.3.13,9606.0,1.2787536009528289,CC(O)=NCCCNCCCNCCCN=C(C)O.O.O=O,,1.2787536009528289,CC(O)=NCCCNCCCNCCCN=C(C)O.O.O=O__MESTGSVGEAPGGPRVLVVGGGIAGLGAAQRLCGHSAFPHLRVLEATARAGGRIRSERCFGGVVEVGAHWIHGPSRGNPVFQLAAEYGLLGEKELSQENQLVETGGHVGLPSVSYASSGASVSLQLVAEMATLFYGLIDQTREFLHAAETPVPSVGEYLKKEIGQHVAGWTEDEETRKLKLAVLNSFFNLECCVSGTHSMDLVALAPFGEYTVLPGLDCTFSKGYQGLTNCMMAALPEDTVVFEKPVKTIHWNGSFQEAAFPGETFPVSVECEDGDRFPAHHVIVTVPLGFLREHLDTFFDPPLPAEKAEAIRKIGFGTNNKIFLEFEEPFWEPDCQLIQLVWEDTSPLEDAAPELQDAWFRKLIGFVVLPAFASVHVLCGFIAGLESEFMETLSDEEVLLCLTQVLRRVTGNPRLPAPKSVLRSRWHSAPYTRGSYSYVAVGSTGGDLDLLAQPLPADGAGAQLQILFAGEATHRTFYSTTHGALLSGWREADRLLSLWAPQVQQPRPRL,./data/raw/alphafold//AF-Q6QHF9-F1-model_v4.pdb,1405,914,713,2119
+2242,12234,12402,MRSKYIVIEGLEGAGKTTARNVVVETLEQLGIRDMVFTREPGGTQLAEKLRSLVLDIKSVGDEVITDKAEVLMFYAARVQLVETVIKPALANGTWVIGDRHDLSTQAYQGGGRGIDQHMLATLRDAVLGDFRPDLTLYLDVTPEVGLKRARARGELDRIEQESFDFFNRTRARYLELAAQDKSIHTIDATQPLEAVMDAIRTTVTHWVKELDA,sabio,P0A720,Cc1cn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,10.5,0.0,30.0,7.4,2.7.4.9,562.0,1.021189299069938,Cc1cn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O,1.021189299069938,Cc1cn(C2CC(O)C(COP(=O)(O)O)O2)c(=O)[nH]c1=O.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MRSKYIVIEGLEGAGKTTARNVVVETLEQLGIRDMVFTREPGGTQLAEKLRSLVLDIKSVGDEVITDKAEVLMFYAARVQLVETVIKPALANGTWVIGDRHDLSTQAYQGGGRGIDQHMLATLRDAVLGDFRPDLTLYLDVTPEVGLKRARARGELDRIEQESFDFFNRTRARYLELAAQDKSIHTIDATQPLEAVMDAIRTTVTHWVKELDA,./data/raw/alphafold//AF-P0A720-F1-model_v4.pdb,2023,4184,4053,3900
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+2244,13024,13198,MVDAATLEKLEAGFSKLQASDSKSLLKKYLTKEVFDSLKNKKTSFGSTLLDCIQSGVENLDSGVGIYAPDAEAYSVFAELFDPIIEDYHNGFKKSDKHPAKNWGDVETLGNLDPAGEFVVSTRVRCGRSMEGYPFNPCLTEAQYKEMEEKVSSTLSGLEGELKGTFYPLTGMSKETQQQLIDDHFLFKEGDRFLQAANACRFWPSGRGIYHNENKTFLVWCNEEDHLRIISMQMGGDLKQVYKRLVTAVNDIEKRIPFSHHDRLGFLTFCPTNLGTTVRASVHIKLPKLAADKAKLEEIASKYHLQVRGTRGEHTEAEGGVYDISNKRRMGLTEYDAVKEMYDGIAELIKIEKSL,uniprot_search,A0A922CD60,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,431.0,0.0,30.0,7.4,2.7.3.3,7130.0,2.6344772701607315,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,2.6344772701607315,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__MVDAATLEKLEAGFSKLQASDSKSLLKKYLTKEVFDSLKNKKTSFGSTLLDCIQSGVENLDSGVGIYAPDAEAYSVFAELFDPIIEDYHNGFKKSDKHPAKNWGDVETLGNLDPAGEFVVSTRVRCGRSMEGYPFNPCLTEAQYKEMEEKVSSTLSGLEGELKGTFYPLTGMSKETQQQLIDDHFLFKEGDRFLQAANACRFWPSGRGIYHNENKTFLVWCNEEDHLRIISMQMGGDLKQVYKRLVTAVNDIEKRIPFSHHDRLGFLTFCPTNLGTTVRASVHIKLPKLAADKAKLEEIASKYHLQVRGTRGEHTEAEGGVYDISNKRRMGLTEYDAVKEMYDGIAELIKIEKSL,./data/raw/esmfold//ESMFold-A0A922CD60-v1.pdb,2198,4425,4325,4205
+2245,20993,21314,MYQDLIRNELNEAAETLANFLKDDANIHAIQRAAVLLADSFKAGGKVLSCGNGGSHCDAMHFAEELTGRYRENRPGYPAIAISDVSHISCVGNDFGFNDIFSRYVEAVGREGDVLLGISTSGNSANVIKAIAAAREKGMKVITLTGKDGGKMAGTADIEIRVPHFGYADRIQEIHIKVIHILIQLIEKEMVK,sabio,P63224,O=C(CO)C(O)C(O)C(O)C(O)COP(=O)(O)O>>O=P(O)(O)OCC(O)C1OC(O)C(O)C(O)C1O,0.44,0.0,22.0,,5.3.1.28,562.0,-0.3565473235138126,O=C(CO)C(O)C(O)C(O)C(O)COP(=O)(O)O,O=P(O)(O)OCC(O)C1OC(O)C(O)C(O)C1O,-0.3565473235138126,O=C(CO)C(O)C(O)C(O)C(O)COP(=O)(O)O__MYQDLIRNELNEAAETLANFLKDDANIHAIQRAAVLLADSFKAGGKVLSCGNGGSHCDAMHFAEELTGRYRENRPGYPAIAISDVSHISCVGNDFGFNDIFSRYVEAVGREGDVLLGISTSGNSANVIKAIAAAREKGMKVITLTGKDGGKMAGTADIEIRVPHFGYADRIQEIHIKVIHILIQLIEKEMVK,./data/raw/alphafold//AF-P63224-F1-model_v4.pdb,547,3249,5554,6439
+2246,17877,18125,MRAPSMDRAAVARVGAVASASVCALVAGVVLAQYIFTLKRKTGRKTKIIEMMPEFQKSSVRIKNPTRVEEIICGLIKGGAAKLQIITDFDMTLSRFSYKGKRCPTCHNIIDNCKLVTDECRKKLLQLKEKYYAIEVDPVLTVEEKYPYMVEWYTKSHGLLVQQALPKAKLKEIVAESDVMLKEGYENFFDKLQQHSIPVFIFSAGIGDVLEEVIRQAGVYHPNVKVVSNFMDFDETGVLKGFKGELIHVFNKHDGALRNTEYFNQLKDNSNIILLGDSQGDLRMADGVANVEHILKIGYLNDRVDELLEKYMDSYDIVLVQDESLEVANSILQKIL,sabio,Q9H0P0,Nc1ccn(C2OC(COP(=O)(O)O)C(O)C2O)c(=O)n1.O>>Nc1ccn(C2OC(CO)C(O)C2O)c(=O)n1.O=P(O)(O)O,19.0,0.0,37.0,7.5,3.1.3.5,9606.0,1.2787536009528289,Nc1ccn(C2OC(COP(=O)(O)O)C(O)C2O)c(=O)n1.O,Nc1ccn(C2OC(CO)C(O)C2O)c(=O)n1.O=P(O)(O)O,1.2787536009528289,Nc1ccn(C2OC(COP(=O)(O)O)C(O)C2O)c(=O)n1.O__MRAPSMDRAAVARVGAVASASVCALVAGVVLAQYIFTLKRKTGRKTKIIEMMPEFQKSSVRIKNPTRVEEIICGLIKGGAAKLQIITDFDMTLSRFSYKGKRCPTCHNIIDNCKLVTDECRKKLLQLKEKYYAIEVDPVLTVEEKYPYMVEWYTKSHGLLVQQALPKAKLKEIVAESDVMLKEGYENFFDKLQQHSIPVFIFSAGIGDVLEEVIRQAGVYHPNVKVVSNFMDFDETGVLKGFKGELIHVFNKHDGALRNTEYFNQLKDNSNIILLGDSQGDLRMADGVANVEHILKIGYLNDRVDELLEKYMDSYDIVLVQDESLEVANSILQKIL,./data/raw/alphafold//AF-Q9H0P0-F1-model_v4.pdb,1906,3142,5431,3726
+2247,4422,4477,MLRRVAVAAVFATGRKLRCEAGRDVTAVGRIEARGLCEESAKPFPTLTMPGRNKAKSTCSCPDLQPNGQDLGESGRVARLGADESEEEGRSLSNVGDPEIIKSPSDPKQYRYIKLQNGLQALLISDLSNVEGKTGNATDEEEEEEEEEEEGEEEEEEEEDDDDDDDEDSGAEIQDDDEEGFDDEEEFDDDEHDDDDLDNEENELEELEERVEARKKTTEKQSAAALCVGVGSFADPDDLPGLAHFLEHMVFMGSLKYPDENGFDAFLKKHGGSDNASTDCERTVFQFDVQRKYFKEALDRWAQFFIHPLMIRDAIDREVEAVDSEYQLARPSDANRKEMLFGSLARPGHPMGKFFWGNAETLKHEPKKNNIDTHARLREFWMRYYSAHYMTLVVQSKETLDTLEKWVTEIFSQIPNNGLPKPNFSHLTDPFDTPAFNKLYRVVPIRKIHALTITWALPPQQQHYRVKPLHYISWLVGHEGKGSILSYLRKKCWALALFGGNGETGFEQNSTYSVFSISITLTDEGYEHFYEVAHTVFQYLKMLQKLGPEKRVFEEIQKIEDNEFHYQEQTDPVEYVENMCENMQLYPRQDFLTGDQLLFEYKPEVIAEALNQLVPQKANLVLLSGANEGRCDLKEKWFGTQYSIEDIENSWTELWKSNFDLNSDLHLPAENKYIATDFTLKAFDCPETEYPAKIVNTPQGCLWYKKDNKFKIPKAYIRFHLISPLIQKSAANVVLFDIFVNILTHNLAEPAYEADVAQLEYKLVAGEHGLIIRVKGFNHKLPLLFQLIIDYLTEFSSTPAVFTMITEQLKKTYFNILIKPETLAKDVRLLILEYSRWSMIDKYRALMDGLSLESLLNFVKDFKSQLFVEGLVQGNVTSTESMDFLRYVVDKLNFVPLEREMPVQFQVVELPSGHHLCKVRALNKGDANSEVTVYYQSGTRSLREYTLMELLVMHMEEPCFDFLRTKQTLGYHVYPTCRNTSGILGFSVTVGTQATKYNSETVDKKIEEFLSSFEEKIENLTEDAFNTQVTALIKLKECEDTHLGEEVDRNWNEVVTQQYLFDRLAHEIEALKSFSKSDLVSWFKAHRGPGSKMLSVHVVGYGKYELEEDGAPVCEDPNSREGMQLIYLPPSPLLAESTTPITDIRAFTATLSLFPYHKIVK,uniprot_search,P47245,CC(C)[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](C)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=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)[C@H](N=C(O)[C@@H](N)CCCCN)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)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O,1.08,8.988025466776511e-15,37.0,8.129999999999999,3.4.24.61,10116.0,0.0334237554869497,CC(C)[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](C)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=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)[C@H](N=C(O)[C@@H](N)CCCCN)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)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)c1ccccc1N)C(O)=N[C@@H](CCCNC(=N)N)C(=O)O,0.0334237554869497,CC(C)[C@H](N=C(O)[C@H](CCCCN)N=C(O)[C@H](CCCNC(=N)N)N=C(O)[C@H](C)N=C(O)[C@H](Cc1ccccc1)N=C(O)CN=C(O)CN=C(O)c1ccccc1N)C(O)=NCC(O)=N[C@@H](CCC(=N)O)C(O)=NCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].O__MLRRVAVAAVFATGRKLRCEAGRDVTAVGRIEARGLCEESAKPFPTLTMPGRNKAKSTCSCPDLQPNGQDLGESGRVARLGADESEEEGRSLSNVGDPEIIKSPSDPKQYRYIKLQNGLQALLISDLSNVEGKTGNATDEEEEEEEEEEEGEEEEEEEEDDDDDDDEDSGAEIQDDDEEGFDDEEEFDDDEHDDDDLDNEENELEELEERVEARKKTTEKQSAAALCVGVGSFADPDDLPGLAHFLEHMVFMGSLKYPDENGFDAFLKKHGGSDNASTDCERTVFQFDVQRKYFKEALDRWAQFFIHPLMIRDAIDREVEAVDSEYQLARPSDANRKEMLFGSLARPGHPMGKFFWGNAETLKHEPKKNNIDTHARLREFWMRYYSAHYMTLVVQSKETLDTLEKWVTEIFSQIPNNGLPKPNFSHLTDPFDTPAFNKLYRVVPIRKIHALTITWALPPQQQHYRVKPLHYISWLVGHEGKGSILSYLRKKCWALALFGGNGETGFEQNSTYSVFSISITLTDEGYEHFYEVAHTVFQYLKMLQKLGPEKRVFEEIQKIEDNEFHYQEQTDPVEYVENMCENMQLYPRQDFLTGDQLLFEYKPEVIAEALNQLVPQKANLVLLSGANEGRCDLKEKWFGTQYSIEDIENSWTELWKSNFDLNSDLHLPAENKYIATDFTLKAFDCPETEYPAKIVNTPQGCLWYKKDNKFKIPKAYIRFHLISPLIQKSAANVVLFDIFVNILTHNLAEPAYEADVAQLEYKLVAGEHGLIIRVKGFNHKLPLLFQLIIDYLTEFSSTPAVFTMITEQLKKTYFNILIKPETLAKDVRLLILEYSRWSMIDKYRALMDGLSLESLLNFVKDFKSQLFVEGLVQGNVTSTESMDFLRYVVDKLNFVPLEREMPVQFQVVELPSGHHLCKVRALNKGDANSEVTVYYQSGTRSLREYTLMELLVMHMEEPCFDFLRTKQTLGYHVYPTCRNTSGILGFSVTVGTQATKYNSETVDKKIEEFLSSFEEKIENLTEDAFNTQVTALIKLKECEDTHLGEEVDRNWNEVVTQQYLFDRLAHEIEALKSFSKSDLVSWFKAHRGPGSKMLSVHVVGYGKYELEEDGAPVCEDPNSREGMQLIYLPPSPLLAESTTPITDIRAFTATLSLFPYHKIVK,./data/raw/alphafold//AF-P47245-F1-model_v4.pdb,1860,1498,3070,1910
+2248,2910,2952,MAHDQSLSFEVCRRKPELIRPAKQTPHEFKKLSDVEDQEGLRFQIPVIQFYKHNNESMQERDPVQVIREGIARALVYYYPFAGRLREVDGRKLVVECTGEGVMFIEADADVTLEQFGDALQPPFPCFDQLLFDVPGSGGILDSPLLLIQVTRLKCGSFIFALRLNHTMADAAGIVLFMKAVGEMARGAATPSTLPVWDRHILNARVPPQVTFNHREYEEVKGTIFTPFDDLAHRSFFFGSTEISAMRKQIPPHLRSCSTTIEVLTACLWRCRTLAIKPNPDEEVRMICIVNARSKFNPPLPDGYYGNAFAIPAAVTTAGKLCNNPLGFALELIRKAKREVTEEYMHSVADLMVATGRPHFTVVNTYLVSDVTRAGFGEVDFGWGEAVYGGPAKGGVGVIPGVTSFYIPLRNRQGEKGIVLPICLPSAAMEIFAEALNNTLNGKEIEIAKHFTQSSL,brenda,Q8GT21,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/c1ccccc1.OCc1ccccc1O>>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(/C=C/c1ccccc1)OCc1ccccc1O,0.9,0.0,22.0,7.7,2.3.1.196,36903.0,-0.0457574905606751,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/c1ccccc1.OCc1ccccc1O,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(/C=C/c1ccccc1)OCc1ccccc1O,-0.0457574905606751,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/c1ccccc1.OCc1ccccc1O__MAHDQSLSFEVCRRKPELIRPAKQTPHEFKKLSDVEDQEGLRFQIPVIQFYKHNNESMQERDPVQVIREGIARALVYYYPFAGRLREVDGRKLVVECTGEGVMFIEADADVTLEQFGDALQPPFPCFDQLLFDVPGSGGILDSPLLLIQVTRLKCGSFIFALRLNHTMADAAGIVLFMKAVGEMARGAATPSTLPVWDRHILNARVPPQVTFNHREYEEVKGTIFTPFDDLAHRSFFFGSTEISAMRKQIPPHLRSCSTTIEVLTACLWRCRTLAIKPNPDEEVRMICIVNARSKFNPPLPDGYYGNAFAIPAAVTTAGKLCNNPLGFALELIRKAKREVTEEYMHSVADLMVATGRPHFTVVNTYLVSDVTRAGFGEVDFGWGEAVYGGPAKGGVGVIPGVTSFYIPLRNRQGEKGIVLPICLPSAAMEIFAEALNNTLNGKEIEIAKHFTQSSL,./data/raw/alphafold//AF-Q8GT21-F1-model_v4.pdb,1218,1112,947,1288
+2249,14519,14722,MGIKLPTLEDLREISKQFNLDLEDEELKSFLQLLKLQLESYERLDSLPDYTPRVKYQRTLGRPPMKEENPYGALVWITSIKGKEEGKLKGKRICIKDNVMIAGIPMLNGSKMLEGFVPHMDATVVSRILDEAGEIVAKTTCEDLCFSGGSHTSYPWPVLNPRNPEYMAGGSSSGSAVAVASGYCDMAVGGDQGGSIRIPSSWVGIYGLKPTHGLVPYTGAFSIEPTLDHLGPMANTVKDVALLLEVIAGRDELDSRQPDSLPPPPVKPYSKLIDGDVKDMKVGIVKEGFNWSNSEKDVDELVLDSAKKLEDYGIKVEDTSIPLHRMGLDIWTPIAIEGATATMILGSGVGWGRKGLFETQIADFFGNSLKSRARDLPNTVKGVLMLGYLMIKMYNNRYYAKARNLSIVLKEAYDSALRKYDALIMPTTPMKAMRYKSEPGFDEYFIMALGMINNTAPFDVTGHPAMNIPVGYSNGLPVGLMIIGRHFEEDKVLKLANVFERIKK,brenda,P95896,N=C(O)c1ccccc1O.O>>N.O=C(O)c1ccccc1O,1.3,9.129830273237272e-15,70.0,7.5,3.5.1.4,2287.0,0.1139433523068367,N=C(O)c1ccccc1O.O,N.O=C(O)c1ccccc1O,0.1139433523068367,N=C(O)c1ccccc1O.O__MGIKLPTLEDLREISKQFNLDLEDEELKSFLQLLKLQLESYERLDSLPDYTPRVKYQRTLGRPPMKEENPYGALVWITSIKGKEEGKLKGKRICIKDNVMIAGIPMLNGSKMLEGFVPHMDATVVSRILDEAGEIVAKTTCEDLCFSGGSHTSYPWPVLNPRNPEYMAGGSSSGSAVAVASGYCDMAVGGDQGGSIRIPSSWVGIYGLKPTHGLVPYTGAFSIEPTLDHLGPMANTVKDVALLLEVIAGRDELDSRQPDSLPPPPVKPYSKLIDGDVKDMKVGIVKEGFNWSNSEKDVDELVLDSAKKLEDYGIKVEDTSIPLHRMGLDIWTPIAIEGATATMILGSGVGWGRKGLFETQIADFFGNSLKSRARDLPNTVKGVLMLGYLMIKMYNNRYYAKARNLSIVLKEAYDSALRKYDALIMPTTPMKAMRYKSEPGFDEYFIMALGMINNTAPFDVTGHPAMNIPVGYSNGLPVGLMIIGRHFEEDKVLKLANVFERIKK,./data/raw/alphafold//AF-P95896-F1-model_v4.pdb,1085,655,336,378
+2250,1884,1915,MNFPRASRLMQAAVLGGLMAVSAAATAQTNPYARGPNPTAASLEASAGPFTVRSFTVSRPSGYGAGTVYYPTNAGGTVGAIAIVPGYTARQSSIKWWGPRLASHGFVVITIDTNSTLDQPSSRSSQQMAALRQVASLNGTSSSPIYGKVDTARMGVMGWSMGGGGSLISAANNPSLKAAAPQAPWDSSTNFSSVTVPTLIFACENDSIAPVNSSALPIYDSMSRNAKQFLEINGGSHSCANSGNSNQALIGKKGVAWMKRFMDNDTRYSTFACENPNSTRVSDFRTANCS,uniprot_search,A0A0K8P6T7,CC(=O)Oc1ccc([N+](=O)[O-])cc1.O>>CC(=O)O.O=[N+]([O-])c1ccc(O)cc1,27.0,0.0,30.0,7.0,3.1.1.101,1547922.0,1.4313637641589874,CC(=O)Oc1ccc([N+](=O)[O-])cc1.O,CC(=O)O.O=[N+]([O-])c1ccc(O)cc1,3.2012823898690708,CC(=O)Oc1ccc([N+](=O)[O-])cc1.O__MNFPRASRLMQAAVLGGLMAVSAAATAQTNPYARGPNPTAASLEASAGPFTVRSFTVSRPSGYGAGTVYYPTNAGGTVGAIAIVPGYTARQSSIKWWGPRLASHGFVVITIDTNSTLDQPSSRSSQQMAALRQVASLNGTSSSPIYGKVDTARMGVMGWSMGGGGSLISAANNPSLKAAAPQAPWDSSTNFSSVTVPTLIFACENDSIAPVNSSALPIYDSMSRNAKQFLEINGGSHSCANSGNSNQALIGKKGVAWMKRFMDNDTRYSTFACENPNSTRVSDFRTANCS,./data/raw/alphafold//AF-A0A0K8P6T7-F1-model_v4.pdb,3246,1038,864,1194
+2251,20301,20598,MDSNGYLVVGVVAFALPCSFRVSLTDSVPLFSPVHDAASLTRNSFPAGFIFGAGSSAYQFEGAAKEGGRGPSIWDTFTHNHPEKIRDGANGDVAVDQYHRYKEDVKIMKDMNLDSYRFSISWPRILPKGKLSGGVNQEGINYYNNLINELLANGVLPYATLFHWDLPQALEDEYGGFLSSHIVDDFQDYADLCFKEFGDRVKFWTTLNEPWLFSQGGYATGATAPGRCTGPQCLGGDAGTEPYIVTHNQILAHAAAVHVYKTKYQAHQKGKIGITLVSNWFIPLAENSTSDIKAARRAIDFQYGWYMEPLTKGEYPKNMRALVGSRLPKFTKWQAKLVNGSFDFIGLNYYSSGYINGVPPSNDKPNFLTDSRTNTSFERNGRPLGLRAASVWIYFYPRGLLDLLLYTKEKYNNPLIYITENGMNEFNDPTLSVEEALMDIYRIDYYYRHFFYLRSAIKAGANVKGFFAWSFLDCNEWFAGFTVRFGLNFVDYKDGLKRYPKLFAQWYKNFLKRN,brenda,Q08IT7,O.O=c1c(-c2ccc(O)cc2)coc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12>>O=c1c(-c2ccc(O)cc2)coc2cc(O)ccc12.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,22.0,6.535273738472331e-15,30.0,7.0,3.2.1.21,3847.0,1.3424226808222062,O.O=c1c(-c2ccc(O)cc2)coc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12,O=c1c(-c2ccc(O)cc2)coc2cc(O)ccc12.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O,1.3424226808222062,O.O=c1c(-c2ccc(O)cc2)coc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12__MDSNGYLVVGVVAFALPCSFRVSLTDSVPLFSPVHDAASLTRNSFPAGFIFGAGSSAYQFEGAAKEGGRGPSIWDTFTHNHPEKIRDGANGDVAVDQYHRYKEDVKIMKDMNLDSYRFSISWPRILPKGKLSGGVNQEGINYYNNLINELLANGVLPYATLFHWDLPQALEDEYGGFLSSHIVDDFQDYADLCFKEFGDRVKFWTTLNEPWLFSQGGYATGATAPGRCTGPQCLGGDAGTEPYIVTHNQILAHAAAVHVYKTKYQAHQKGKIGITLVSNWFIPLAENSTSDIKAARRAIDFQYGWYMEPLTKGEYPKNMRALVGSRLPKFTKWQAKLVNGSFDFIGLNYYSSGYINGVPPSNDKPNFLTDSRTNTSFERNGRPLGLRAASVWIYFYPRGLLDLLLYTKEKYNNPLIYITENGMNEFNDPTLSVEEALMDIYRIDYYYRHFFYLRSAIKAGANVKGFFAWSFLDCNEWFAGFTVRFGLNFVDYKDGLKRYPKLFAQWYKNFLKRN,./data/raw/alphafold//AF-Q08IT7-F1-model_v4.pdb,1219,2779,5096,5957
+2252,16989,17219,VDVHNYTFVLQEKNFTKWCSTKSMLVVNGSFPGPTITARKGDTIFVNVINQGKYGITIHWHGVKQPRNPWSDGPEYITQCPIKPGTNFIYEVILSTEEGTIWWHAHSDWTRATVHGALVILPANGTTYPFPPPYQEQTIVLASWFKGDVMEVIISSEETGVFPAAADGFTINGELGDLYNCSKETTYRLSVQPNKTYLLRIVNAVLNEEKFFGIAKHTLTVVAQDASYIKPINTSYIMITPGQTMDVLFTTDQTPSHYYMVASPFHDALDTFANFSTNAIIQYNGSYKAPKSPFVKPLPVYNDIKAADKFTGKLRSLANEKFPVNVPKVNVRRIFMAVSLNIVKCANKSCNNNIGHSTSASLNNISFALPQTDVLQAYYRGVFGRDFPTVQKKANFSLNTAQGTQVLMIEYGEAVEIVYQGTNLGAATSHPMHLHGFNFYLVGTGAGTFNNVTDPPKYNLVDPPELNTINLPRIGWAAIRFVADNPGVWFLHCHFERHTTEGMATVVIVKDGGTTNTSMLPSPAYMPPCS,brenda,Q8H979,NCCc1ccc(O)c(O)c1.O=O>>,4.4,99.4628824948034,25.0,5.0,1.10.3.2,4013.0,0.6434526764861874,NCCc1ccc(O)c(O)c1.O=O,,0.6434526764861874,NCCc1ccc(O)c(O)c1.O=O__VDVHNYTFVLQEKNFTKWCSTKSMLVVNGSFPGPTITARKGDTIFVNVINQGKYGITIHWHGVKQPRNPWSDGPEYITQCPIKPGTNFIYEVILSTEEGTIWWHAHSDWTRATVHGALVILPANGTTYPFPPPYQEQTIVLASWFKGDVMEVIISSEETGVFPAAADGFTINGELGDLYNCSKETTYRLSVQPNKTYLLRIVNAVLNEEKFFGIAKHTLTVVAQDASYIKPINTSYIMITPGQTMDVLFTTDQTPSHYYMVASPFHDALDTFANFSTNAIIQYNGSYKAPKSPFVKPLPVYNDIKAADKFTGKLRSLANEKFPVNVPKVNVRRIFMAVSLNIVKCANKSCNNNIGHSTSASLNNISFALPQTDVLQAYYRGVFGRDFPTVQKKANFSLNTAQGTQVLMIEYGEAVEIVYQGTNLGAATSHPMHLHGFNFYLVGTGAGTFNNVTDPPKYNLVDPPELNTINLPRIGWAAIRFVADNPGVWFLHCHFERHTTEGMATVVIVKDGGTTNTSMLPSPAYMPPCS,./data/raw/alphafold//AF-Q8H979-F1-model_v4.pdb,3427,2328,1046,2947
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+2254,6286,6395,MAHRPPSPALASVLLALLLSGAARAAEIVGGHEAQPHSRPYMASLQMRGNPGSHFCGGTLIHPSFVLTAAHCLRDIPQRLVNVVLGAHNVRTQEPTQQHFSVAQVFLNNYDAENKLNDVLLIQLSSPANLSASVATVQLPQQDQPVPHGTQCLAMGWGRVGAHDPPAQVLQELNVTVVTFFCRPHNICTFVPRRKAGICFGDSGGPLICDGIIQGIDSFVIWGCATRLFPDFFTRVALYVDWIRSTLRRVEAKGRP,brenda,P24158,CCC(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>>CCC(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)O.Nc1ccc([N+](=O)[O-])cc1,0.26,8.318991428442978e-15,33.5,7.633333333333333,3.4.21.76,9606.0,-0.585026652029182,CCC(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,CCC(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)O.Nc1ccc([N+](=O)[O-])cc1,-0.585026652029182,CCC(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__MAHRPPSPALASVLLALLLSGAARAAEIVGGHEAQPHSRPYMASLQMRGNPGSHFCGGTLIHPSFVLTAAHCLRDIPQRLVNVVLGAHNVRTQEPTQQHFSVAQVFLNNYDAENKLNDVLLIQLSSPANLSASVATVQLPQQDQPVPHGTQCLAMGWGRVGAHDPPAQVLQELNVTVVTFFCRPHNICTFVPRRKAGICFGDSGGPLICDGIIQGIDSFVIWGCATRLFPDFFTRVALYVDWIRSTLRRVEAKGRP,./data/raw/alphafold//AF-P24158-F1-model_v4.pdb,1869,1572,3137,1906
+2255,16095,16322,MAMANLARRKGYSLLSSETLRYSFSLRSRAFASGSDENDVVIIGGGPGGYVAAIKAAQLGFKTTCIEKRGALGGTCLNVGCIPSKALLHSSHMYHEAKHSFANHGVKVSNVEIDLAAMMGQKDKAVSNLTRGIEGLFKKNKVTYVKGYGKFVSPSEISVDTIEGENTVVKGKHIIIATGSDVKSLPGVTIDEKKIVSSTGALALSEIPKKLVVIGAGYIGLEMGSVWGRIGSEVTVVEFASEIVPTMDAEIRKQFQRSLEKQGMKFKLKTKVVGVDTSGDGVKLTVEPSAGGEQTIIEADVVLVSAGRTPFTSGLNLDKIGVETDKLGRILVNERFSTNVSGVYAIGDVIPGPMLAHKAEEDGVACVEYLAGKVGHVDYDKVPGVVYTNPEVASVGKTEEQVKETGVEYRVGKFPFMANSRAKAIDNAEGLVKIIAEKETDKILGVHIMAPNAGELIHEAAIALQYDASSEDIARVCHAHPTMSEAIKEAAMATYDKPIHI,sabio,P31023,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@@H](O)[C@H](O)[C@@H](O)[C@@H](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],190.0,13.496624579288332,30.0,7.5,1.8.1.4,3888.0,2.278753600952829,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@@H](O)[C@H](O)[C@@H](O)[C@@H](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],2.278753600952829,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@@H](O)[C@H](O)[C@@H](O)[C@@H](O)C(=O)O__MAMANLARRKGYSLLSSETLRYSFSLRSRAFASGSDENDVVIIGGGPGGYVAAIKAAQLGFKTTCIEKRGALGGTCLNVGCIPSKALLHSSHMYHEAKHSFANHGVKVSNVEIDLAAMMGQKDKAVSNLTRGIEGLFKKNKVTYVKGYGKFVSPSEISVDTIEGENTVVKGKHIIIATGSDVKSLPGVTIDEKKIVSSTGALALSEIPKKLVVIGAGYIGLEMGSVWGRIGSEVTVVEFASEIVPTMDAEIRKQFQRSLEKQGMKFKLKTKVVGVDTSGDGVKLTVEPSAGGEQTIIEADVVLVSAGRTPFTSGLNLDKIGVETDKLGRILVNERFSTNVSGVYAIGDVIPGPMLAHKAEEDGVACVEYLAGKVGHVDYDKVPGVVYTNPEVASVGKTEEQVKETGVEYRVGKFPFMANSRAKAIDNAEGLVKIIAEKETDKILGVHIMAPNAGELIHEAAIALQYDASSEDIARVCHAHPTMSEAIKEAAMATYDKPIHI,./data/raw/alphafold//AF-P31023-F1-model_v4.pdb,1227,3039,574,59
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+2257,12699,12870,MSQNGQFLEYTLQVIRRGVEMGGFPEDFYKLLSRPKRIIQVSIPVKMDNGSYEVFEGYRVQHNDALGPFKGGIRFHPEVTLADDIALAMLMTLKNSLAGLPYGGAKGAVRVDPRRLSRRELEELARGYARAVAPLIGEQLDIPAPDVGTDSQVMAWMVDEYSKLAGRNAPAVFTSKPPELWGNPVREYSTGFGVAVAAREVAKRLWGGIEGKTVAVHGAGNTGAWAAYWLEKMGAKVVAISDTRGTVVNKAGIPGEQILKVYMEKKRDKSATVLALEGEKIADSNASLYQDVDILVPAAIENVVREDNVGLVRARLVVEGANGPTTPGAERRLYERGVVVVPDILANAGGVIMSYLEWVENLQWLFWDEEETRRRLEAIMSNNVARVYARWEKEKSWTMRDAAVVTALERIYNAMKTRGWI,brenda,A3MWK6,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)CCC(=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.N[C@@H](CCC(=O)O)C(=O)O.O,100.0,6.847919890036056e-15,50.0,9.0,1.4.1.4,181486.0,2.0,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)CCC(=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.N[C@@H](CCC(=O)O)C(=O)O.O,2.0,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)CCC(=O)C(=O)O.[H+]__MSQNGQFLEYTLQVIRRGVEMGGFPEDFYKLLSRPKRIIQVSIPVKMDNGSYEVFEGYRVQHNDALGPFKGGIRFHPEVTLADDIALAMLMTLKNSLAGLPYGGAKGAVRVDPRRLSRRELEELARGYARAVAPLIGEQLDIPAPDVGTDSQVMAWMVDEYSKLAGRNAPAVFTSKPPELWGNPVREYSTGFGVAVAAREVAKRLWGGIEGKTVAVHGAGNTGAWAAYWLEKMGAKVVAISDTRGTVVNKAGIPGEQILKVYMEKKRDKSATVLALEGEKIADSNASLYQDVDILVPAAIENVVREDNVGLVRARLVVEGANGPTTPGAERRLYERGVVVVPDILANAGGVIMSYLEWVENLQWLFWDEEETRRRLEAIMSNNVARVYARWEKEKSWTMRDAAVVTALERIYNAMKTRGWI,./data/raw/alphafold//AF-A3MWK6-F1-model_v4.pdb,2148,4356,4246,4110
+2258,18753,19027,AQSVPWGISRVQAPAAHNRGLTGSGVKVAVLDTGISTHPDLNIRGGASFVPGEPSTQDGNGHGTHVAGTIAALNNSIGVLGVAPSAELYAVKVLGADGRGAISSIAQGLEWAGNNGMHVANLSLGSPSPSATLEQAVNSATSRGVLVVAASGNSGASSISYPARYANAMAVGATDQNNNRASFSQYGAGLDIVAPGVNVQSTYPGSTYASLNGTSMATPHVAGAAALVKQKNPSWSNVQIRNHLKNTATSLGSTNLYGSGLVNAEAATR,sabio,P29599,O>>*C(N)C(=O)NC(*)C(=O)O.SCc1ccccc1,1940.0,86.4520755434902,25.0,8.6,3.4.21.62,1467.0,3.287801729930226,O,*C(N)C(=O)NC(*)C(=O)O.SCc1ccccc1,3.287801729930226,O__AQSVPWGISRVQAPAAHNRGLTGSGVKVAVLDTGISTHPDLNIRGGASFVPGEPSTQDGNGHGTHVAGTIAALNNSIGVLGVAPSAELYAVKVLGADGRGAISSIAQGLEWAGNNGMHVANLSLGSPSPSATLEQAVNSATSRGVLVVAASGNSGASSISYPARYANAMAVGATDQNNNRASFSQYGAGLDIVAPGVNVQSTYPGSTYASLNGTSMATPHVAGAAALVKQKNPSWSNVQIRNHLKNTATSLGSTNLYGSGLVNAEAATR,./data/raw/alphafold//AF-P29599-F1-model_v4.pdb,165,2668,2971,5820
+2259,12107,12270,MRVLVLGSGVIGTASAYYLARAGFEVVVVDRQDGPALETSFANAGQVSPGYASPWAAPGIPLKAMKWLLEKHAPLAIKLTSDPSQYAWMLQMLRNCTAERYAVNKERMVRLSEYSRDCLDELRAETGIAYEGRTLGTTQLFRTQAQLDAAGKDIAVLERSGVPYEVLDRDGIARVEPALAKVADKLVGALRLPNDQTGDCQLFTTRLAEMAKGLGVEFRFGQNIERLDFAGDRINGVLVNGELLTADHYVLALGSYSPQLLKPLGIKAPVYPLKGYSLTVPITNPEMAPTSTILDETYKVAITRFDQRIRVGGMAEIAGFDLSLNPRRRETLEMITTDLYPEGGDISQATFWTGLRPATPDGTPIVGATRYRNLFLNTGHGTLGWTMACGSGRYLADLMAKKRPQISTEGLDISRYSNSPENAKNAHPAPAH,brenda,Q9HTQ0,Cc1cc2nc3c(O)nc(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)c2cc1C.N[C@H](Cc1ccc(O)cc1)C(=O)O.O>>Cc1cc2c(cc1C)N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]1O)c1nc(O)nc(O)c1N2.N.O=C(O)C(=O)Cc1ccc(O)cc1,1.1,0.0,37.0,8.7,1.4.99.6,287.0,0.041392685158225,Cc1cc2nc3c(O)nc(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)c2cc1C.N[C@H](Cc1ccc(O)cc1)C(=O)O.O,Cc1cc2c(cc1C)N(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]1O)c1nc(O)nc(O)c1N2.N.O=C(O)C(=O)Cc1ccc(O)cc1,0.041392685158225,Cc1cc2nc3c(O)nc(=O)nc-3n(C[C@H](O)[C@H](O)[C@H](O)COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)c2cc1C.N[C@H](Cc1ccc(O)cc1)C(=O)O.O__MRVLVLGSGVIGTASAYYLARAGFEVVVVDRQDGPALETSFANAGQVSPGYASPWAAPGIPLKAMKWLLEKHAPLAIKLTSDPSQYAWMLQMLRNCTAERYAVNKERMVRLSEYSRDCLDELRAETGIAYEGRTLGTTQLFRTQAQLDAAGKDIAVLERSGVPYEVLDRDGIARVEPALAKVADKLVGALRLPNDQTGDCQLFTTRLAEMAKGLGVEFRFGQNIERLDFAGDRINGVLVNGELLTADHYVLALGSYSPQLLKPLGIKAPVYPLKGYSLTVPITNPEMAPTSTILDETYKVAITRFDQRIRVGGMAEIAGFDLSLNPRRRETLEMITTDLYPEGGDISQATFWTGLRPATPDGTPIVGATRYRNLFLNTGHGTLGWTMACGSGRYLADLMAKKRPQISTEGLDISRYSNSPENAKNAHPAPAH,./data/raw/alphafold//AF-Q9HTQ0-F1-model_v4.pdb,2906,1621,3220,1997
+2260,18615,18886,MYIGIDLGTSGVKVILLNEQGEVVAAQTEKLTVSRPHPLWSEQDPEQWWQATDRAMKALGDQHSLQDVKALGIAGQMHGATLLDAQQRVLRPAILWNDGRCAQECTLLEARVPQSRVITGNLMMPGFTAPKLLWVQRHEPEIFRQIDKVLLPKDYLRLRMTGEFASDMSDAAGTMWLDVAKRDWSDVMLQACDLSRDQMPALYEGSEITGALLPEVAKAWGMATVPVVAGGGDNAAGAVGVGMVDANQAMLSLGTSGVYFAVSEGFLSKPESAVHSFCHALPQRWHLMSVMLSAASCLDWAAKLTGLSNVPALIAAAQQADESAEPVWFLPYLSGERTPHNNPQAKGVFFGLTHQHGPNELARAVLEGVGYALADGMDVVHACGIKPQSVTLIGGGARSEYWRQMLADISGQQLDYRTGGDVGPALGAARLAQIAANPEKSLIELLPQLPLEQSHLPDAQRYAAYQPRRETFRRLYQQLLPLMA,brenda,P09099,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](O)C(O)[C@H](O)CO>>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](O)[C@@H](O)[C@H](O)CO,105.0,8.61488431239778e-15,37.0,8.0,2.7.1.17,562.0,2.0211892990699383,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](O)C(O)[C@H](O)CO,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](O)[C@@H](O)[C@H](O)CO,2.0211892990699383,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](O)C(O)[C@H](O)CO__MYIGIDLGTSGVKVILLNEQGEVVAAQTEKLTVSRPHPLWSEQDPEQWWQATDRAMKALGDQHSLQDVKALGIAGQMHGATLLDAQQRVLRPAILWNDGRCAQECTLLEARVPQSRVITGNLMMPGFTAPKLLWVQRHEPEIFRQIDKVLLPKDYLRLRMTGEFASDMSDAAGTMWLDVAKRDWSDVMLQACDLSRDQMPALYEGSEITGALLPEVAKAWGMATVPVVAGGGDNAAGAVGVGMVDANQAMLSLGTSGVYFAVSEGFLSKPESAVHSFCHALPQRWHLMSVMLSAASCLDWAAKLTGLSNVPALIAAAQQADESAEPVWFLPYLSGERTPHNNPQAKGVFFGLTHQHGPNELARAVLEGVGYALADGMDVVHACGIKPQSVTLIGGGARSEYWRQMLADISGQQLDYRTGGDVGPALGAARLAQIAANPEKSLIELLPQLPLEQSHLPDAQRYAAYQPRRETFRRLYQQLLPLMA,./data/raw/alphafold//AF-P09099-F1-model_v4.pdb,124,2614,2914,5762
+2261,21968,22299,MKSFYNLALCLGALFNAATAIPPEQQGQQPGKFAAAPPVGSNPIDRKGWTVKCSSQASNYPCGRAIDGDKNTFWQTPYGTTNTPPPHTITIDMKQTQYVSGLQITPRQDGNTRNWIGRHEVYLSSDGTNWGKPVAFGTYWGDKYPWITNFEIQPARYLRFVALSNVNPDYPWIAIADFVVYNALKYSPPAKGLGKWGPTLDFPVIPVAGAVEPVSGKVVIWSAYRYDAFQGTTPRGGFTLTSIWDPKTNVISNRNVSNNHHDMFCPGISMDGEGQIVVTGGNDAKKTTILMPDGNWVPGPDMQIARGYQSSATCSDGRVFTIGGSWSGPRGGKNGEIYDPKAKTWTSLPKCLVGPMLTKDKEGVYKADNHAWLFGWKKNSVFQAGPSTAMNWYYTTRGTQGDTKAAGTRRKNGRIDPDSMNGNVAMFDALNGKILTFGGATSYQQAPATANAHVLTIDEPGAIAQTALVGNNGAGIHARVFATSVILPDGNVFITGGQSYSDPFTDTNAQLEPEMFISSSNTFTKQQTNTIPRTYHSMSLLLPDATVFNGGGGLCGGCKTNHFDAQIFTPQYLLDGNGNLATRPKITAVSATTAKVGSTITVTANSAIKSASLIRYGTATHVVNTDQRRIPLALTGAGTNKYSFKIPNDSGIALPGYWMLFVLNNAGVPSVASTIKVTI,brenda,E6PBN4,O=Cc1ccc(CO)o1.O=O>>O=Cc1ccc(C=O)o1.OO,26.0,0.0,25.0,7.5,1.1.3.47,59765.0,1.414973347970818,O=Cc1ccc(CO)o1.O=O,O=Cc1ccc(C=O)o1.OO,1.414973347970818,O=Cc1ccc(CO)o1.O=O__MKSFYNLALCLGALFNAATAIPPEQQGQQPGKFAAAPPVGSNPIDRKGWTVKCSSQASNYPCGRAIDGDKNTFWQTPYGTTNTPPPHTITIDMKQTQYVSGLQITPRQDGNTRNWIGRHEVYLSSDGTNWGKPVAFGTYWGDKYPWITNFEIQPARYLRFVALSNVNPDYPWIAIADFVVYNALKYSPPAKGLGKWGPTLDFPVIPVAGAVEPVSGKVVIWSAYRYDAFQGTTPRGGFTLTSIWDPKTNVISNRNVSNNHHDMFCPGISMDGEGQIVVTGGNDAKKTTILMPDGNWVPGPDMQIARGYQSSATCSDGRVFTIGGSWSGPRGGKNGEIYDPKAKTWTSLPKCLVGPMLTKDKEGVYKADNHAWLFGWKKNSVFQAGPSTAMNWYYTTRGTQGDTKAAGTRRKNGRIDPDSMNGNVAMFDALNGKILTFGGATSYQQAPATANAHVLTIDEPGAIAQTALVGNNGAGIHARVFATSVILPDGNVFITGGQSYSDPFTDTNAQLEPEMFISSSNTFTKQQTNTIPRTYHSMSLLLPDATVFNGGGGLCGGCKTNHFDAQIFTPQYLLDGNGNLATRPKITAVSATTAKVGSTITVTANSAIKSASLIRYGTATHVVNTDQRRIPLALTGAGTNKYSFKIPNDSGIALPGYWMLFVLNNAGVPSVASTIKVTI,./data/raw/alphafold//AF-E6PBN4-F1-model_v4.pdb,3562,3520,1294,3244
+2262,7059,7180,MTVKKLYFVPAGRCMLDHSSVNSTLTPGELLDLPVWCYLLETEEGPILVDTGMPESAVNNEGLFNGTFVEGQVLPKMTEEDRIVNILKRVGYEPEDLLYIISSHLHFDHAGGNGAFINTPIIVQRAEYEAAQHSEEYLKECILPNLNYKIIEGDYEVVPGVQLLHTPGHTPGHQSLLIETEKSGPVLLTIDASYTKENFENEVPFAGFDSELALSSIKRLKEVVMKEKPIVFFGHDIEQERGCKVFPEYI,sabio,Q9L8R8,CCCCCCCC(=O)CC(=O)N[C@H]1CCOC1=O.O>>CCCCCCCC(=O)CC(=O)N[C@@H](CCO)C(=O)O,20.22,9.873585900729537e-15,22.0,7.4,3.1.1.81,1409.0,1.3057811512549822,CCCCCCCC(=O)CC(=O)N[C@H]1CCOC1=O.O,CCCCCCCC(=O)CC(=O)N[C@@H](CCO)C(=O)O,1.3057811512549822,CCCCCCCC(=O)CC(=O)N[C@H]1CCOC1=O.O__MTVKKLYFVPAGRCMLDHSSVNSTLTPGELLDLPVWCYLLETEEGPILVDTGMPESAVNNEGLFNGTFVEGQVLPKMTEEDRIVNILKRVGYEPEDLLYIISSHLHFDHAGGNGAFINTPIIVQRAEYEAAQHSEEYLKECILPNLNYKIIEGDYEVVPGVQLLHTPGHTPGHQSLLIETEKSGPVLLTIDASYTKENFENEVPFAGFDSELALSSIKRLKEVVMKEKPIVFFGHDIEQERGCKVFPEYI,./data/raw/alphafold//AF-Q9L8R8-F1-model_v4.pdb,3256,2083,3741,913
+2263,20292,20587,MYVAVKGGEKAIDAAHALQESRRRGDTDLPELSVAQIEQQLNLAVDRVMTEGGIADRELAALALKQASGDNVEAIFLLRAYRTTLAKLAVSEPLDTTGMRLERRISAVYKDIPGGQLLGPTYDYTHRLLDFTLLANGEAPTLTTADSEQQPSPHVFSLLARQGLAKFEEDSGAQPDDITRTPPVYPCSRSSRLQQLMRGDEGYLLALAYSTQRGYGRNHPFAGEIRSGYIDVSIVPEELGFAVNVGELLMTECEMVNGFIDPPGEPPHFTRGYGLVFGMSERKAMAMALVDRALQAPEYGEHATGPAQDEEFVLAHADNVEAAGFVSHLKLPHYVDFQAELELLKRLQQEQNHG,sabio,P16687,O.O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O>>C([C@@H]1[C@H]([C@H]([C@@H](O1)O)O)O)OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-].C([C@@H]1[C@H]([C@H]([C@@H](O1)O)O)O)OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-],0.8,18.92544242798351,30.0,8.5,3.2.2.-,562.0,-0.0969100130080563,O.O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O,C([C@@H]1[C@H]([C@H]([C@@H](O1)O)O)O)OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-].C([C@@H]1[C@H]([C@H]([C@@H](O1)O)O)O)OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-],-0.0969100130080563,O.O=c1[nH]cnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)C1O__MYVAVKGGEKAIDAAHALQESRRRGDTDLPELSVAQIEQQLNLAVDRVMTEGGIADRELAALALKQASGDNVEAIFLLRAYRTTLAKLAVSEPLDTTGMRLERRISAVYKDIPGGQLLGPTYDYTHRLLDFTLLANGEAPTLTTADSEQQPSPHVFSLLARQGLAKFEEDSGAQPDDITRTPPVYPCSRSSRLQQLMRGDEGYLLALAYSTQRGYGRNHPFAGEIRSGYIDVSIVPEELGFAVNVGELLMTECEMVNGFIDPPGEPPHFTRGYGLVFGMSERKAMAMALVDRALQAPEYGEHATGPAQDEEFVLAHADNVEAAGFVSHLKLPHYVDFQAELELLKRLQQEQNHG,./data/raw/alphafold//AF-P16687-F1-model_v4.pdb,3586,3547,1328,3285
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+2274,21983,22314,MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,brenda,O94219,O=Cc1cccc(Cl)c1.O=O>>O=C(O)c1cccc(Cl)c1.OO,0.85,4.947150754224236,24.0,6.0,1.1.3.7,5323.0,-0.0705810742857072,O=Cc1cccc(Cl)c1.O=O,O=C(O)c1cccc(Cl)c1.OO,-0.0705810742857072,O=Cc1cccc(Cl)c1.O=O__MSFGALRQLLLIACLALPSLAATNLPTADFDYVVVGAGNAGNVVAARLTEDPDVSVLVLEAGVSDENVLGAEAPLLAPGLVPNSIFDWNYTTTAQAGYNGRSIAYPRGRMLGGSSSVHYMVMMRGSTEDFDRYAAVTGDEGWNWDNIQQFVRKNEMVVPPADNHNTSGEFIPAVHGTNGSVSISLPGFPTPLDDRVLATTQEQSEEFFFNPDMGTGHPLGISWSIASVGNGQRSSSSTAYLRPAQSRPNLSVLINAQVTKLVNSGTTNGLPAFRCVEYAEQEGAPTTTVCAKKEVVLSAGSVGTPILLQLSGIGDENDLSSVGIDTIVNNPSVGRNLSDHLLLPAAFFVNSNQTFDNIFRDSSEFNVDLDQWTNTRTGPLTALIANHLAWLRLPSNSSIFQTFPDPAAGPNSAHWETIFSNQWFHPAIPRPDTGSFMSVTNALISPVARGDIKLATSNPFDKPLINPQYLSTEFDIFTMIQAVKSNLRFLSGQAWADFVIRPFDPRLRDPTDDAAIESYIRDNANTIFHPVGTASMSPRGASWGVVDPDLKVKGVDGLRIVDGSILPFAPNAHTQGPIYLVGKQGADLIKADQ,./data/raw/alphafold//AF-O94219-F1-model_v4.pdb,1050,3522,1297,300
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+2293,11811,11969,MKRICGSLLLLGLSISAALAAPASRPAAFDYANLSSVDKVALRTMPAVDVAKAKAEDLQRDKRGDIPRFALAIDVDMTPQNSGAWEYTADGQFAVWRQRVRSEKALSLNFGFTDYYMPAGGRLLVYPATQAPAGDRGLISQYDASNNNSARQLWTAVVPGAEAVIEAVIPRDKVGEFKLRLTKVNHDYVGFGPLARRLAAASGEKGVSGSCNIDVVCPEGDGRRDIIRAVGAYSKSGTLACTGSLVNNTANDRKMYFLTAHHCGMGTASTAASIVVYWNYQNSTCRAPNTPASGANGDGSMSQTQSGSTVKATYATSDFTLLELNNAANPAFNLFWAGWDRRDQNYPGAIAIHHPNVAEKRISNSTSPTSFVAWGGGAGTTHLNVQWQPSGGVTEPGSSGSPIYSPEKRVLGQLHGGPSSCSATGTNRSDQYGRVFTSWTGGGAAASRLSDWLDPASTGAQFIDGLDSGGGTPNTPPVANFTSTTSGLTATFTDSSTDSDGSIASRSWNFGDGSTSTATNPSKTYAAAGTYTVTLTVTDNGGATNTKTGSVTVSGGPGAQTYTNDTDVAIPDNATVESPITVSGRTGNGSATTPIQVTIYHTYKSDLKVDLVAPDGTVYNLHNRTGGSAHNIIQTFTKDLSSEAAQRAPGSCG,uniprot_search,P15636,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCCCN)N=C(O)[C@H](C)N=C(O)OC(C)(C)C)ccc12.O>>C[C@H](N=C(O)OC(C)(C)C)C(O)=N[C@@H](CCCCCN)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,32.9,1.6814263121911258e-14,37.0,8.4,3.4.21.50,224.0,1.5171958979499742,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCCCN)N=C(O)[C@H](C)N=C(O)OC(C)(C)C)ccc12.O,C[C@H](N=C(O)OC(C)(C)C)C(O)=N[C@@H](CCCCCN)C(=O)O.Cc1cc(=O)oc2cc(N)ccc12,1.5171958979499742,Cc1cc(=O)oc2cc(N=C(O)[C@H](CCCCCN)N=C(O)[C@H](C)N=C(O)OC(C)(C)C)ccc12.O__MKRICGSLLLLGLSISAALAAPASRPAAFDYANLSSVDKVALRTMPAVDVAKAKAEDLQRDKRGDIPRFALAIDVDMTPQNSGAWEYTADGQFAVWRQRVRSEKALSLNFGFTDYYMPAGGRLLVYPATQAPAGDRGLISQYDASNNNSARQLWTAVVPGAEAVIEAVIPRDKVGEFKLRLTKVNHDYVGFGPLARRLAAASGEKGVSGSCNIDVVCPEGDGRRDIIRAVGAYSKSGTLACTGSLVNNTANDRKMYFLTAHHCGMGTASTAASIVVYWNYQNSTCRAPNTPASGANGDGSMSQTQSGSTVKATYATSDFTLLELNNAANPAFNLFWAGWDRRDQNYPGAIAIHHPNVAEKRISNSTSPTSFVAWGGGAGTTHLNVQWQPSGGVTEPGSSGSPIYSPEKRVLGQLHGGPSSCSATGTNRSDQYGRVFTSWTGGGAAASRLSDWLDPASTGAQFIDGLDSGGGTPNTPPVANFTSTTSGLTATFTDSSTDSDGSIASRSWNFGDGSTSTATNPSKTYAAAGTYTVTLTVTDNGGATNTKTGSVTVSGGPGAQTYTNDTDVAIPDNATVESPITVSGRTGNGSATTPIQVTIYHTYKSDLKVDLVAPDGTVYNLHNRTGGSAHNIIQTFTKDLSSEAAQRAPGSCG,./data/raw/alphafold//AF-P15636-F1-model_v4.pdb,3179,1974,3619,2458
+2294,20178,20467,MFPKGFKFGFSEAGFQFEMGISDPDPNTDWYVWTHDKYNIQNHVVSGDLPENGAGYWDLYHRDHDFAQHLGMNAARIGIEWSRIFPKSTEEVKVSVQNDRGDVLNVDITDRDLDKLDKIANKDAVNHYRSIFSDFKNRGNYLIINLYHWSTPVWINDPSKRDIEKDNAVGNCFTTRSIVEFAKFAAYVARAFDDLADRWSTMNEPNILFNGQCSNDWRPDSMAIRKKLFAEAHARAYDSIKKFSEKPVGIVYANGDMQPLTDEDREARDLAEYEIRYSFFDAITKGDLSWYANAAQNRSLDYSSDKREDMANHLDWVGVNYYSRDVVKKDGDRWAIVPGYGYATGENKRSLDGRSSSDTGWEVYPEGIYHLVMSYQKHIGLPMMISENGVADDSDRLRPRYVASHLKNLESAIRDGAKVEGYLHWALTDNYEWASGFSKKFGLLKVDFKTKKRYIRPGALVFKEIVENNGVDEDLEWLAADKF,brenda,Q9HIL6,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,27.0,0.0,90.0,6.0,3.2.1.21,2303.0,1.4313637641589874,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,1.4313637641589874,O.O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1__MFPKGFKFGFSEAGFQFEMGISDPDPNTDWYVWTHDKYNIQNHVVSGDLPENGAGYWDLYHRDHDFAQHLGMNAARIGIEWSRIFPKSTEEVKVSVQNDRGDVLNVDITDRDLDKLDKIANKDAVNHYRSIFSDFKNRGNYLIINLYHWSTPVWINDPSKRDIEKDNAVGNCFTTRSIVEFAKFAAYVARAFDDLADRWSTMNEPNILFNGQCSNDWRPDSMAIRKKLFAEAHARAYDSIKKFSEKPVGIVYANGDMQPLTDEDREARDLAEYEIRYSFFDAITKGDLSWYANAAQNRSLDYSSDKREDMANHLDWVGVNYYSRDVVKKDGDRWAIVPGYGYATGENKRSLDGRSSSDTGWEVYPEGIYHLVMSYQKHIGLPMMISENGVADDSDRLRPRYVASHLKNLESAIRDGAKVEGYLHWALTDNYEWASGFSKKFGLLKVDFKTKKRYIRPGALVFKEIVENNGVDEDLEWLAADKF,./data/raw/alphafold//AF-Q9HIL6-F1-model_v4.pdb,193,3922,1761,3568
+2295,13933,14114,MTAPSQVLKIRRPDDWHLHLRDGDMLKTVVPYTSEIYGRAIVMPNLAPPVTTVEAAVAYRQRILDAVPAGHDFTPLMTCYLTDSLDPNELERGFNEGVFTAAKLYPANATTNSSHGVTSIDAIMPVLERMEKIGMPLLVHGEVTHADIDIFDREARFIESVMEPLRQRLTALKVVFEHITTKDAADYVRDGNERLAATITPQHLMFNRNHMLVGGVRPHLYCLPILKRNIHQQALRELVASGFNRVFLGTDSAPHARHRKESSCGCAGCFNAPTALGSYATVFEEMNALQHFEAFCSVNGPQFYGLPVNDTFIELVREEQQVAESIALTDDTLVPFLAGETVRWSVKQ,brenda,P05020,N=C(O)N[C@@H](CC(=O)O)C(=O)O>>O.O=C(O)[C@@H]1CC(O)=NC(O)=N1,181.1,1.609128192042259e-14,30.0,7.5,3.5.2.3,562.0,2.2579184503140586,N=C(O)N[C@@H](CC(=O)O)C(=O)O,O.O=C(O)[C@@H]1CC(O)=NC(O)=N1,2.2579184503140586,N=C(O)N[C@@H](CC(=O)O)C(=O)O__MTAPSQVLKIRRPDDWHLHLRDGDMLKTVVPYTSEIYGRAIVMPNLAPPVTTVEAAVAYRQRILDAVPAGHDFTPLMTCYLTDSLDPNELERGFNEGVFTAAKLYPANATTNSSHGVTSIDAIMPVLERMEKIGMPLLVHGEVTHADIDIFDREARFIESVMEPLRQRLTALKVVFEHITTKDAADYVRDGNERLAATITPQHLMFNRNHMLVGGVRPHLYCLPILKRNIHQQALRELVASGFNRVFLGTDSAPHARHRKESSCGCAGCFNAPTALGSYATVFEEMNALQHFEAFCSVNGPQFYGLPVNDTFIELVREEQQVAESIALTDDTLVPFLAGETVRWSVKQ,./data/raw/alphafold//AF-P05020-F1-model_v4.pdb,2303,4640,4668,4497
+2296,8761,8898,MKRSFFMLKTKITSSILVGACLLIGCSNGNEQPVSNEPEPEESVETGEAVFKALEEEYAARLGVFALDTGTGQTVSYRSDERFTYASAHKPLAVAVLLQQKSIEELEQLITYSADDLVNYNPITENHVETGMTLRELSDASIRYSDNTAANFIFDEIGGPEGFKEGLRAIGDTVTEPERIEPELNHVEPGEIQDTSTPEALAKSLQEFALGEALPADKQELLIDWLIGNTTGDALIRAGVPEGWEVGDKTGAGSYGTRNDIAILWPPEKEPIILAVLSSKDEKDAEYDDELIAKATEEVINLLAQTE,brenda,A8RR46,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>>,22.0,99.78924695830672,30.0,6.4,3.5.2.6,79880.0,1.3424226808222062,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,,1.3424226808222062,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__MKRSFFMLKTKITSSILVGACLLIGCSNGNEQPVSNEPEPEESVETGEAVFKALEEEYAARLGVFALDTGTGQTVSYRSDERFTYASAHKPLAVAVLLQQKSIEELEQLITYSADDLVNYNPITENHVETGMTLRELSDASIRYSDNTAANFIFDEIGGPEGFKEGLRAIGDTVTEPERIEPELNHVEPGEIQDTSTPEALAKSLQEFALGEALPADKQELLIDWLIGNTTGDALIRAGVPEGWEVGDKTGAGSYGTRNDIAILWPPEKEPIILAVLSSKDEKDAEYDDELIAKATEEVINLLAQTE,./data/raw/alphafold//AF-A8RR46-F1-model_v4.pdb,1458,1898,800,1114
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+2300,9427,9569,MKSIFTLGVALLGLSSHVQGAAVKVERMEMTRIQPRNDLVERQSAACGSNGPNSRHCWTPGFTSSTDMYNSWPNTGQIVSYNLRIENTTCNPDGNGSRVCMLINGRMPGPTIVANWGDTIRVTVRNLLQHNGTSIHWHGFRMLNKVIQDGTNGVTECALAPGDIKTYEFQATEYGTTWYHSHFSHQYGDGVVGTVQINGPATANYDVDLGVMPMTDWYYITAFQAARRAATGGGGPPLPDNVLINGTSKNAAGGGAWNKVSIQSGKRYRLRLVNTAVDTNFMVNLDNHNFQVIATDFVPVEPYNTSYLQIGIGQRYDVIFTANQTAGNYWFRAVANSNCQSRAAREGRAVFTYQGQTVADPTSNAQGNPPTGCTDPVTTPKIVKTVPSSTFAAQAKSLPVAFGPVAVQNNLVLWTINGTSQVVDPGNPTIKYVAENNNNFPQALNVVEVSSTSATTWTYWVIQQAANAPPIAHPIHLHGHDSYILGQGTGQFNVTTHFSQLRFNNPPRRDVAQLQGGGWLVLAYPTDNPGAWLMHCHIAFHVGMGLSIQFLERKQSINLPAPGSQWFQNCNNWAAYKAGNTDVYPQDDSGLRKRWPALGAENSMAEW,brenda,B3TLA6,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O>>,1.5,99.73641273548226,65.0,5.0,1.10.3.2,1707701.0,0.1760912590556812,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O,,0.1760912590556812,COc1cc(/C=N/N=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1O.O__MKSIFTLGVALLGLSSHVQGAAVKVERMEMTRIQPRNDLVERQSAACGSNGPNSRHCWTPGFTSSTDMYNSWPNTGQIVSYNLRIENTTCNPDGNGSRVCMLINGRMPGPTIVANWGDTIRVTVRNLLQHNGTSIHWHGFRMLNKVIQDGTNGVTECALAPGDIKTYEFQATEYGTTWYHSHFSHQYGDGVVGTVQINGPATANYDVDLGVMPMTDWYYITAFQAARRAATGGGGPPLPDNVLINGTSKNAAGGGAWNKVSIQSGKRYRLRLVNTAVDTNFMVNLDNHNFQVIATDFVPVEPYNTSYLQIGIGQRYDVIFTANQTAGNYWFRAVANSNCQSRAAREGRAVFTYQGQTVADPTSNAQGNPPTGCTDPVTTPKIVKTVPSSTFAAQAKSLPVAFGPVAVQNNLVLWTINGTSQVVDPGNPTIKYVAENNNNFPQALNVVEVSSTSATTWTYWVIQQAANAPPIAHPIHLHGHDSYILGQGTGQFNVTTHFSQLRFNNPPRRDVAQLQGGGWLVLAYPTDNPGAWLMHCHIAFHVGMGLSIQFLERKQSINLPAPGSQWFQNCNNWAAYKAGNTDVYPQDDSGLRKRWPALGAENSMAEW,./data/raw/alphafold//AF-B3TLA6-F1-model_v4.pdb,3423,2321,1034,2932
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+2309,22192,22525,MATAPSPTTMGTYSSLISTNSFSTFLPNKSQLSLSGKSKHYVARRSSISCKATNNNNSNNQNEQQEESSRLLGKLDRRNILIGLGGLYGATTLDRKPFAFADPIAPPDLTTCKPAEITPGGSETVPCCPPVTTKIKTFKPDLSIPLRTSPAAHQVTDEYLAKFKKAQAAMRALPDDDPRSMVQQAKVHCAYCNGAYPQVGFTDNDIQVHFSWLFFPFHRMYLYFYERILGKLIDDPTFALPYWNWDSPVGFPIPDIYTDTSSPLYDQYRNADHQPPVLVDLSYGGKDDDVDEQTRIDENLAIMYRQMVSGAKTPDLFFGHAYRAGNLNTGKYPGTIENMPHNNIHIWVGDPSQTHQEDMGNFYSAGRDPLFYAHHANVDRMWNIWKTLGGKRKDITDTDWLDAEFLFYDENAELVRVKVRDSLEPEKQLRYNYEPVSLPWLFTKPTARKTKNKTKAKVAATQLTSKFPATLVEVTTVEVARPKPRKRSKKEKVDEEELLIIKDIEFEGTEAVKFDVFINDDAESLSRRDKSEFAGSFVHVPQGKTTKAKTKTNLKLGITDLLEDLGAEDDSSVLVTLVPRVSNSPITIGGFKIEYSS,sabio,O81103,O=O.Oc1ccccc1O>>O.O=C1C=CC=CC1=O,210.0,5.942701349448964,25.0,,1.10.3.1,36596.0,2.322219294733919,O=O.Oc1ccccc1O,O.O=C1C=CC=CC1=O,2.322219294733919,O=O.Oc1ccccc1O__MATAPSPTTMGTYSSLISTNSFSTFLPNKSQLSLSGKSKHYVARRSSISCKATNNNNSNNQNEQQEESSRLLGKLDRRNILIGLGGLYGATTLDRKPFAFADPIAPPDLTTCKPAEITPGGSETVPCCPPVTTKIKTFKPDLSIPLRTSPAAHQVTDEYLAKFKKAQAAMRALPDDDPRSMVQQAKVHCAYCNGAYPQVGFTDNDIQVHFSWLFFPFHRMYLYFYERILGKLIDDPTFALPYWNWDSPVGFPIPDIYTDTSSPLYDQYRNADHQPPVLVDLSYGGKDDDVDEQTRIDENLAIMYRQMVSGAKTPDLFFGHAYRAGNLNTGKYPGTIENMPHNNIHIWVGDPSQTHQEDMGNFYSAGRDPLFYAHHANVDRMWNIWKTLGGKRKDITDTDWLDAEFLFYDENAELVRVKVRDSLEPEKQLRYNYEPVSLPWLFTKPTARKTKNKTKAKVAATQLTSKFPATLVEVTTVEVARPKPRKRSKKEKVDEEELLIIKDIEFEGTEAVKFDVFINDDAESLSRRDKSEFAGSFVHVPQGKTTKAKTKTNLKLGITDLLEDLGAEDDSSVLVTLVPRVSNSPITIGGFKIEYSS,./data/raw/alphafold//AF-O81103-F1-model_v4.pdb,1997,4153,4019,3862
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+2311,21770,22095,MRRRTFLTLAVLVSLSASLGLLTALIRKGPSEEWKFKISEVASDLEVPWSIAPLGGGRYLVTERPGRLVLISPSGKKLVASFDVANVGEAGLLGLALHPEFPKKSWVYLYASYFAEGGHIRNRVIRGRLDGSTFKLKEVKTLIDGIPGAYIHNGGRIRFGPDGMLYITTGDAADPRLAQDLSSLAGKILRVDEEGRPPADNPFPNSPIWSYGHRNPQGIDWHRASGVMVATEHGPVGHDEVNIILKGGNYGWPLATGKAGRGEFVDPVIDTGSETWAPSGASFVHGDMFPGLRGWLLIACLRGSMLAAVNFGDNMEVRKISTFFKNVFGRLRDVVIDDDGGILISTSNRDGRGSLRAGDDKILKIVSEQHT,brenda,Q8ZUN8,O=C1C=CC(=Nc2cc(Cl)c(O)c(Cl)c2)C=C1.OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O>>O=C1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O.Oc1ccc(Nc2cc(Cl)c(O)c(Cl)c2)cc1,2.3,0.0,50.0,8.0,1.1.5.2,13773.0,0.3617278360175928,O=C1C=CC(=Nc2cc(Cl)c(O)c(Cl)c2)C=C1.OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O,O=C1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O.Oc1ccc(Nc2cc(Cl)c(O)c(Cl)c2)cc1,0.3617278360175928,O=C1C=CC(=Nc2cc(Cl)c(O)c(Cl)c2)C=C1.OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O__MRRRTFLTLAVLVSLSASLGLLTALIRKGPSEEWKFKISEVASDLEVPWSIAPLGGGRYLVTERPGRLVLISPSGKKLVASFDVANVGEAGLLGLALHPEFPKKSWVYLYASYFAEGGHIRNRVIRGRLDGSTFKLKEVKTLIDGIPGAYIHNGGRIRFGPDGMLYITTGDAADPRLAQDLSSLAGKILRVDEEGRPPADNPFPNSPIWSYGHRNPQGIDWHRASGVMVATEHGPVGHDEVNIILKGGNYGWPLATGKAGRGEFVDPVIDTGSETWAPSGASFVHGDMFPGLRGWLLIACLRGSMLAAVNFGDNMEVRKISTFFKNVFGRLRDVVIDDDGGILISTSNRDGRGSLRAGDDKILKIVSEQHT,./data/raw/alphafold//AF-Q8ZUN8-F1-model_v4.pdb,3352,3441,1180,3105
+2312,21957,22288,MVSAHFILIHTICHGAWLWYKLIPLLQSAGHNATAIDLVASGIDPRQLEQIGTWEQYSEPLFTLIESIPEGKKVILVGESGGGINIALAAEKYPEKVSALVFHNALMPDIDHSPAFVYKKFSEVFTDWKDSIFSNYTYGNDTVTAVELGDRTLAENIFSNSPIEDVELAKHLVRKGSFFEQDLDTLPNFTSEGYGSIRRVYVYGEEDQIFSRDFQLWQINNYKPDKVYCVPSADHKIQISKVNELAQILQEVANSASDLLAVA,sabio,D1MX73,O=Cc1c(Cl)cccc1Cl.[C-]#N>>,24.7,99.50502890631186,25.0,4.0,4.1.2.47,316758.0,1.3926969532596658,O=Cc1c(Cl)cccc1Cl.[C-]#N,,1.3926969532596658,O=Cc1c(Cl)cccc1Cl.[C-]#N__MVSAHFILIHTICHGAWLWYKLIPLLQSAGHNATAIDLVASGIDPRQLEQIGTWEQYSEPLFTLIESIPEGKKVILVGESGGGINIALAAEKYPEKVSALVFHNALMPDIDHSPAFVYKKFSEVFTDWKDSIFSNYTYGNDTVTAVELGDRTLAENIFSNSPIEDVELAKHLVRKGSFFEQDLDTLPNFTSEGYGSIRRVYVYGEEDQIFSRDFQLWQINNYKPDKVYCVPSADHKIQISKVNELAQILQEVANSASDLLAVA,./data/raw/alphafold//AF-D1MX73-F1-model_v4.pdb,1488,546,202,219
+2313,10876,11031,MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,uniprot_search,P23946,C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)SCc1ccccc1.O>>,12.6,99.84120632379936,37.0,7.4,3.4.21.39,9606.0,1.100370545117563,C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)SCc1ccccc1.O,,1.250420002308894,C[C@H](N=C(O)[C@H](C)N=C(O)CCC(=O)O)C(=O)N1CCC[C@H]1C(O)=N[C@@H](Cc1ccccc1)C(=O)SCc1ccccc1.O__MLLLPLPLLLFLLCSRAEAGEIIGGTECKPHSRPYMAYLEIVTSNGPSKFCGGFLIRRNFVLTAAHCAGRSITVTLGAHNITEEEDTWQKLEVIKQFRHPKYNTSTLHHDIMLLKLKEKASLTLAVGTLPFPSQFNFVPPGRMCRVAGWGRTGVLKPGSDTLQEVKLRLMDPQACSHFRDFDHNLQLCVGNPRKTKSAFKGDSGGPLLCAGVAQGIVSYGRSDAKPPAVFTRISHYRPWINQILQAN,./data/raw/alphafold//AF-P23946-F1-model_v4.pdb,1858,1553,3136,1905
+2314,1569,1597,MKNKLPPFIEIYRALIATPSISATEEALDQSNADLITLLADWFKDLGFNVEVQPVPGTRNKFNMLASIGQGAGGLLLAGHTDTVPFDDGRWTRDPFTLTEHDGKLYGLGTADMKGFFAFILDALRDVDVTKLKKPLYILATADEETSMAGARYFAETTALRPDCAIIGEPTSLQPVRAHKGHISNAIRIQGQSGHSSDPARGVNAIELMHDAIGHILQLRDNLKERYHYEAFTVPYPTLNLGHIHGGDASNRICACCELHMDIRPLPGMTLNELNGLLNDALAPVSERWPGRLTVDELHPPIPGYECPPNHQLVEVVEKLLGAKTEVVNYCTEAPFIQTLCPTLVLGPGSINQAHQPDEYLETRFIKPTRELITQVIHHFCWH,sabio,P23908,CC(=O)N[C@@H](CCC(=O)N)C(=O)O.O>>CC(=O)O.NC(=O)CCC(N)C(=O)O,260.0,1.3750355315679887e-14,25.0,7.0,3.5.1.16,562.0,2.414973347970818,CC(=O)N[C@@H](CCC(=O)N)C(=O)O.O,CC(=O)O.NC(=O)CCC(N)C(=O)O,2.414973347970818,CC(=O)N[C@@H](CCC(=O)N)C(=O)O.O__MKNKLPPFIEIYRALIATPSISATEEALDQSNADLITLLADWFKDLGFNVEVQPVPGTRNKFNMLASIGQGAGGLLLAGHTDTVPFDDGRWTRDPFTLTEHDGKLYGLGTADMKGFFAFILDALRDVDVTKLKKPLYILATADEETSMAGARYFAETTALRPDCAIIGEPTSLQPVRAHKGHISNAIRIQGQSGHSSDPARGVNAIELMHDAIGHILQLRDNLKERYHYEAFTVPYPTLNLGHIHGGDASNRICACCELHMDIRPLPGMTLNELNGLLNDALAPVSERWPGRLTVDELHPPIPGYECPPNHQLVEVVEKLLGAKTEVVNYCTEAPFIQTLCPTLVLGPGSINQAHQPDEYLETRFIKPTRELITQVIHHFCWH,./data/raw/alphafold//AF-P23908-F1-model_v4.pdb,1378,883,680,969
+2315,2834,2874,MITVAAPEAQPQVAAAVDEAPPEAVTVFRSKLPDIDIPSHLPLHEYCFARAAELPDAPCLIAAATGRTYTFAETRLLCRRAAAALHRLGVGHGDRVMVLLQNCVEFAVAFFAASFLGAVTTAANPFCTPQEIHKQFKASGVKLILTQSVYVDKLRQHEAFPRIDACTVGDDTLTVITIDDDEATPEGCLPFWDLIADADEGSVPEVAISPDDPVALPFSSGTTGLPKGVVLTHRSVVSGVAQQVDGENPNLHMGAGDVALCVLPLFHIFSLNSVLLCAVRAGAAVALMPRFEMGAMLGAIERWRVTVAAVVPPLVLALAKNPFVERHDLSSIRIVLSGAAPLGKELEDALRARLPQAIFGQGYGMTEAGPVLSMCPAFAKEPTPAKSGSCGTVVRNAELKVVDPDTGFSLGRNLPGEICIRGPQIMKGYLNDPEATAATIDVEGWLHTGDIGYVDDDDEVFIVDRVKELIKFKGFQVPPAELESLLIAHPSIADAAVVPQKDDVAGEVPVAFVVRAADSDITEESIKEFISKQVVFYKRLHKVHFIHAIPKSASGKILRRELRAKLAAC,brenda,Q42982,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)/C=C/c1ccc(O)cc1>>CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)C(O)C(O)=NCCC(O)=NCCSC(=O)/C=C/c1ccc(O)cc1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,0.0395,0.0,30.0,7.5,6.2.1.12,4530.0,-1.40340290437354,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)/C=C/c1ccc(O)cc1,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)C(O)C(O)=NCCC(O)=NCCSC(=O)/C=C/c1ccc(O)cc1.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)OP(=O)(O)O,-1.40340290437354,CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(O)=NCCC(O)=NCCS.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)/C=C/c1ccc(O)cc1__MITVAAPEAQPQVAAAVDEAPPEAVTVFRSKLPDIDIPSHLPLHEYCFARAAELPDAPCLIAAATGRTYTFAETRLLCRRAAAALHRLGVGHGDRVMVLLQNCVEFAVAFFAASFLGAVTTAANPFCTPQEIHKQFKASGVKLILTQSVYVDKLRQHEAFPRIDACTVGDDTLTVITIDDDEATPEGCLPFWDLIADADEGSVPEVAISPDDPVALPFSSGTTGLPKGVVLTHRSVVSGVAQQVDGENPNLHMGAGDVALCVLPLFHIFSLNSVLLCAVRAGAAVALMPRFEMGAMLGAIERWRVTVAAVVPPLVLALAKNPFVERHDLSSIRIVLSGAAPLGKELEDALRARLPQAIFGQGYGMTEAGPVLSMCPAFAKEPTPAKSGSCGTVVRNAELKVVDPDTGFSLGRNLPGEICIRGPQIMKGYLNDPEATAATIDVEGWLHTGDIGYVDDDDEVFIVDRVKELIKFKGFQVPPAELESLLIAHPSIADAAVVPQKDDVAGEVPVAFVVRAADSDITEESIKEFISKQVVFYKRLHKVHFIHAIPKSASGKILRRELRAKLAAC,./data/raw/alphafold//AF-Q42982-F1-model_v4.pdb,1669,1278,4570,1527
+2316,10702,10857,MAALTTLFKYIDENQDRYIKKLAKWVAIQSVSAWPEKRGEIRRMMEVAAADVKQLGGSVELVDIGKQKLPDGSEIPLPPILLGRLGSDPQKKTVCIYGHLDVQPAALEDGWDSEPFTLVERDGKLYGRGSTDDKGPVAGWINALEAYQKTGQEIPVNVRFCLEGMEESGSEGLDELIFARKDTFFKDVDYVCISDNYWLGKKKPCITYGLRGICYFFIEVECSNKDLHSGVYGGSVHEAMTDLILLMGSLVDKRGNILIPGINEAVAAVTEEEHKLYDDIDFDIEEFAKDVGAQILLHSHKKDILMHRWRYPSLSLHGIEGAFSGSGAKTVIPRKVVGKFSIRLVPNMTPEVVGEQVTSYLTKKFAELRSPNEFKVYMGHGGKPWVSDFSHPHYLAGRRAMKTVFGVEPDLTREGGSIPVTLTFQEATGKNVMLLPVGSADDGAHSQNEKLNRYNYIEGTKMLAAYLYEVSQLKD,uniprot_search,Q96KP4,C[C@H](N)C(O)=N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1.O>>C[C@H](N)C(O)=N[C@@H](C)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,0.7,0.0,37.0,7.875,3.4.13.18,9606.0,-0.1549019599857432,C[C@H](N)C(O)=N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1.O,C[C@H](N)C(O)=N[C@@H](C)C(=O)O.Nc1ccc([N+](=O)[O-])cc1,-0.1549019599857432,C[C@H](N)C(O)=N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1.O__MAALTTLFKYIDENQDRYIKKLAKWVAIQSVSAWPEKRGEIRRMMEVAAADVKQLGGSVELVDIGKQKLPDGSEIPLPPILLGRLGSDPQKKTVCIYGHLDVQPAALEDGWDSEPFTLVERDGKLYGRGSTDDKGPVAGWINALEAYQKTGQEIPVNVRFCLEGMEESGSEGLDELIFARKDTFFKDVDYVCISDNYWLGKKKPCITYGLRGICYFFIEVECSNKDLHSGVYGGSVHEAMTDLILLMGSLVDKRGNILIPGINEAVAAVTEEEHKLYDDIDFDIEEFAKDVGAQILLHSHKKDILMHRWRYPSLSLHGIEGAFSGSGAKTVIPRKVVGKFSIRLVPNMTPEVVGEQVTSYLTKKFAELRSPNEFKVYMGHGGKPWVSDFSHPHYLAGRRAMKTVFGVEPDLTREGGSIPVTLTFQEATGKNVMLLPVGSADDGAHSQNEKLNRYNYIEGTKMLAAYLYEVSQLKD,./data/raw/alphafold//AF-Q96KP4-F1-model_v4.pdb,3379,2259,3951,1876
+2317,22316,22650,MSSLDINEQRALIKSAHRYISEKLEDHFSSEFLPKALVICGSGLSGISTKIADEPKPLILSYSTIPGFKVSTVPGHSGELIFGYMNGAPVVLMNGRLHSYEGHSLAETVHPIRALHLLGSINVLIVTNAAGGINASFKAGDLMCVYDHINFPGLCGFHPLRGANFDEFGPRFLATSDAYDLELRKLLFSKKKELNIERKIHEGTYSYVHGPTFESRAESRFLRLAGTDAVGMSTVPEVVTARHCGWRVLALSLITNECVVDPPASAHDENPVPIQEGKATHEEVLENSAKASKDVQELIFSVVAEI,brenda,Q6CSZ6,O=P(O)(O)O.OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O>>O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H]1O.Oc1nc(O)c2nc[nH]c2n1,16.8,0.0,25.0,7.0,2.4.2.1,28985.0,1.2253092817258628,O=P(O)(O)O.OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O,O=P(O)(O)O[C@H]1O[C@H](CO)[C@@H](O)[C@H]1O.Oc1nc(O)c2nc[nH]c2n1,1.2253092817258628,O=P(O)(O)O.OC[C@H]1O[C@@H](n2cnc3c(O)nc(O)nc32)[C@H](O)[C@@H]1O__MSSLDINEQRALIKSAHRYISEKLEDHFSSEFLPKALVICGSGLSGISTKIADEPKPLILSYSTIPGFKVSTVPGHSGELIFGYMNGAPVVLMNGRLHSYEGHSLAETVHPIRALHLLGSINVLIVTNAAGGINASFKAGDLMCVYDHINFPGLCGFHPLRGANFDEFGPRFLATSDAYDLELRKLLFSKKKELNIERKIHEGTYSYVHGPTFESRAESRFLRLAGTDAVGMSTVPEVVTARHCGWRVLALSLITNECVVDPPASAHDENPVPIQEGKATHEEVLENSAKASKDVQELIFSVVAEI,./data/raw/alphafold//AF-Q6CSZ6-F1-model_v4.pdb,775,4906,4978,4832
+2318,22570,22907,MNIYRYEENPLITPLDVKPIHEGFEVIGAFNGGVAEYNGEVLLLLRVAEKPVSEDPEIVLAPVYNAKNKELELQSFRLDDENYDFEDPRMIRSKAKLEGFSYLTSLSYIRIARSKDGHHFTLDEKPFLYPFNEYQTFGIEDARVTQIGDTYHVNFSAVSEFGVADALVTTKDFENLEYQGNIFAPENKDVLIFPEKINGKYYALHRPSLKSIGNLDIWIASSPDLRSFGDHRHLLGIRPGEYDSGRVGGGCVPIKTEEGWLILYHGATEENRYVMGAALLDLNDPTIVLKRTKTPILEPVADYEKNGFFGDVVFACGAIQEGDTLHMYYGVADTSMAGCDMKISEILHQLEVEAK,brenda,Q92DF6,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]2C(O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,33.0,0.0,30.0,6.5,2.4.1.339,1642.0,1.5185139398778875,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]2C(O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O,1.5185139398778875,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__MNIYRYEENPLITPLDVKPIHEGFEVIGAFNGGVAEYNGEVLLLLRVAEKPVSEDPEIVLAPVYNAKNKELELQSFRLDDENYDFEDPRMIRSKAKLEGFSYLTSLSYIRIARSKDGHHFTLDEKPFLYPFNEYQTFGIEDARVTQIGDTYHVNFSAVSEFGVADALVTTKDFENLEYQGNIFAPENKDVLIFPEKINGKYYALHRPSLKSIGNLDIWIASSPDLRSFGDHRHLLGIRPGEYDSGRVGGGCVPIKTEEGWLILYHGATEENRYVMGAALLDLNDPTIVLKRTKTPILEPVADYEKNGFFGDVVFACGAIQEGDTLHMYYGVADTSMAGCDMKISEILHQLEVEAK,./data/raw/alphafold//AF-Q92DF6-F1-model_v4.pdb,764,189,5929,6846
+2319,5797,5884,MAHNEAVDVVLVGAGIMSATLAVLLKELDPGIKLEVVEQMDSGAAESSNPWNNAGTGHAGLCELNYTPQAADGSIDIKKAVHINAQFEVSKQFWAYLAQQGTFGSCKSFISPVPHLSYVQGEKGVSFLKKRFEVLSKHHAFSDMEYTEDKAKMAEWMPLMMPGRPADEVISATRVMHGTDVNFGALTQQLLKHLASAPDTQIKYSKKVTGLKRNGSGWTVSIKDTNSGNTRHIDAKFVFLGAGGAALPLLQASGIEESKGYGGFPVSGQWLRCDNPEVVKLHQAKVYSQAAVGSPPMSVPHLDTRVVDGKKSLLFGPYAGFTTKFLKHGSFMDLPMSIRLGNIGPMLAVARDNMDLTKYLVSEVRQSMEQRLDSLRRFYPQAKAEDWRLEIAGQRVQIIKKDPKKGGVLQFGTELVAAKDGSLAALLGASPGASVTVSIMLDLIERCFPQKAAGEWATKLKEIFPAREKTLETDAELYREISTRNSELLELVEPNTSIA,brenda,A0A0J6JSQ8,CC1=C(C)C(=O)c2ccccc2C1=O.O=C(O)C[C@H](O)C(=O)O>>Cc1c(C)c(O)c2ccccc2c1O.O=C(O)CC(=O)C(=O)O,7.35,0.0,30.0,5.5,1.1.5.4,47884.0,0.8662873390841949,CC1=C(C)C(=O)c2ccccc2C1=O.O=C(O)C[C@H](O)C(=O)O,Cc1c(C)c(O)c2ccccc2c1O.O=C(O)CC(=O)C(=O)O,0.8662873390841949,CC1=C(C)C(=O)c2ccccc2C1=O.O=C(O)C[C@H](O)C(=O)O__MAHNEAVDVVLVGAGIMSATLAVLLKELDPGIKLEVVEQMDSGAAESSNPWNNAGTGHAGLCELNYTPQAADGSIDIKKAVHINAQFEVSKQFWAYLAQQGTFGSCKSFISPVPHLSYVQGEKGVSFLKKRFEVLSKHHAFSDMEYTEDKAKMAEWMPLMMPGRPADEVISATRVMHGTDVNFGALTQQLLKHLASAPDTQIKYSKKVTGLKRNGSGWTVSIKDTNSGNTRHIDAKFVFLGAGGAALPLLQASGIEESKGYGGFPVSGQWLRCDNPEVVKLHQAKVYSQAAVGSPPMSVPHLDTRVVDGKKSLLFGPYAGFTTKFLKHGSFMDLPMSIRLGNIGPMLAVARDNMDLTKYLVSEVRQSMEQRLDSLRRFYPQAKAEDWRLEIAGQRVQIIKKDPKKGGVLQFGTELVAAKDGSLAALLGASPGASVTVSIMLDLIERCFPQKAAGEWATKLKEIFPAREKTLETDAELYREISTRNSELLELVEPNTSIA,./data/raw/alphafold//AF-A0A0J6JSQ8-F1-model_v4.pdb,3142,1933,3577,2410