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J83

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CBHCBGdoub0.00Å1.38ÅAromatic
CBHCBIsing0.00Å1.39ÅAromatic
CBGCBFsing0.00Å1.40ÅAromatic
CBICBJdoub0.00Å1.39ÅAromatic
CBFCBEdoub0.00Å1.39ÅAromatic
CBJCBEsing0.00Å1.39ÅAromatic
CBECABsing0.00Å1.50Å
CAPCAQdoub0.00Å1.34Å
CAPCAOsing0.00Å1.37Å
CAQCARsing0.00Å1.37Å
CBNCBMdoub0.00Å1.38ÅAromatic
CBNCBOsing0.00Å1.39ÅAromatic
CBMCBLsing0.00Å1.39ÅAromatic
CBOCBPdoub0.00Å1.40ÅAromatic
CABCAOdoub0.00Å1.36Å
CABCAMsing0.00Å1.37Å
CAONASsing0.00Å1.36Å
CBLCBKdoub0.00Å1.39ÅAromatic
CBPCBKsing0.00Å1.40ÅAromatic
CARNASdoub0.00Å1.36Å
CARCACsing0.00Å1.37Å
CBKCACsing0.00Å1.49Å
CALCAMdoub0.00Å1.38ÅAromatic
CALCAKsing0.00Å1.34ÅAromatic
CAMNANsing0.00Å1.36ÅAromatic
NASCOsing0.00Å2.04Å
CACCATdoub0.00Å1.37Å
CAKCAJdoub0.00Å1.37ÅAromatic
NANCOsing0.00Å2.06Å
NANCAJsing0.00Å1.37ÅAromatic
CATNAXsing0.00Å1.36Å
CATCAUsing0.00Å1.37Å
CONAXsing0.00Å2.05Å
CONAIsing0.00Å2.04Å
CAJCAAsing0.00Å1.37Å
NAXCAWsing0.00Å1.36Å
CAUCAVdoub0.00Å1.34Å
CAACAYsing0.00Å1.50Å
CAACAHdoub0.00Å1.36Å
NAICAHsing0.00Å1.37Å
NAICAEdoub0.00Å1.36Å
CAWCAVsing0.00Å1.37Å
CAWCADdoub0.00Å1.37Å
CAYCAZdoub0.00Å1.40ÅAromatic
CAYCBDsing0.00Å1.39ÅAromatic
CAZCBAsing0.00Å1.39ÅAromatic
CAHCAGsing0.00Å1.37Å
CBDCBCdoub0.00Å1.40ÅAromatic
CBACBBdoub0.00Å1.40ÅAromatic
CAECADsing0.00Å1.36Å
CAECAFsing0.00Å1.36Å
CADCBQsing0.00Å1.50Å
CBCCBBsing0.00Å1.40ÅAromatic
CAGCAFdoub0.00Å1.34Å
CBQCBRdoub0.00Å1.38ÅAromatic
CBQCBVsing0.00Å1.38ÅAromatic
CBRCBSsing0.00Å1.39ÅAromatic
CBVCBUdoub0.00Å1.41ÅAromatic
CBSCBTdoub0.00Å1.38ÅAromatic
CBUCBTsing0.00Å1.38ÅAromatic
CALH1sing0.00Å1.08Å
CAKH2sing0.00Å1.08Å
CAUH3sing0.00Å1.08Å
CAVH4sing0.00Å1.08Å
CAZH5sing0.00Å1.08Å
CBAH6sing0.00Å1.08Å
CBBH7sing0.00Å1.08Å
CBCH8sing0.00Å1.08Å
CBDH9sing0.00Å1.08Å
CBVH10sing0.00Å1.08Å
CBUH11sing0.00Å1.08Å
CBTH12sing0.00Å1.08Å
CBSH13sing0.00Å1.08Å
CBRH14sing0.00Å1.08Å
CBPH15sing0.00Å1.08Å
CBOH16sing0.00Å1.08Å
CBNH17sing0.00Å1.08Å
CBMH18sing0.00Å1.08Å
CBLH19sing0.00Å1.08Å
CAGH20sing0.00Å1.08Å
CAFH21sing0.00Å1.08Å
CAQH22sing0.00Å1.08Å
CAPH23sing0.00Å1.08Å
CBJH24sing0.00Å1.08Å
CBIH25sing0.00Å1.08Å
CBHH26sing0.00Å1.08Å
CBGH27sing0.00Å1.08Å
CBFH28sing0.00Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CBGCBHCBI119.0°90.0°
CBHCBGCBF119.8°90.0°
CBGCBHH26120.5°90.0°
CBHCBGH27120.1°90.0°
CBHCBICBJ120.8°90.0°
CBHCBIH25119.6°90.0°
CBICBHH26120.5°90.0°
CBGCBFCBE121.9°90.0°
CBFCBGH27120.1°90.0°
CBGCBFH28119.1°90.0°
CBICBJCBE121.1°90.0°
CBICBJH24119.5°90.0°
CBJCBIH25119.6°90.0°
CBFCBECBJ117.5°90.0°
CBFCBECAB120.3°90.0°
CBECBFH28119.1°90.0°
CBJCBECAB122.3°90.0°
CBECBJH24119.4°90.0°
CBECABCAO114.7°90.0°
CBECABCAM118.1°90.0°
CAQCAPCAO108.4°90.0°
CAPCAQCAR109.3°90.0°
CAPCAQH22125.3°90.0°
CAQCAPH23125.8°90.0°
CAPCAOCAB126.8°90.0°
CAPCAONAS106.5°90.0°
CAOCAPH23125.8°90.0°
CAQCARNAS106.2°90.0°
CAQCARCAC127.9°90.0°
CARCAQH22125.3°90.0°
CBMCBNCBO120.6°90.0°
CBNCBMCBL119.5°90.0°
CBMCBNH17119.7°90.0°
CBNCBMH18120.2°90.0°
CBNCBOCBP119.9°90.0°
CBNCBOH16120.0°90.0°
CBOCBNH17119.7°90.0°
CBMCBLCBK121.1°90.0°
CBLCBMH18120.2°90.0°
CBMCBLH19119.5°90.0°
CBOCBPCBK120.2°90.0°
CBOCBPH15119.9°90.0°
CBPCBOH16120.1°90.0°
CAOCABCAM127.2°90.0°
CABCAONAS126.6°90.0°
CABCAMCAL127.5°90.0°
CABCAMNAN125.2°90.0°
CAONASCAR109.5°90.0°
CAONASCO125.1°90.0°
CBLCBKCBP118.7°90.0°
CBLCBKCAC121.9°90.0°
CBKCBLH19119.4°90.0°
CBPCBKCAC119.3°90.0°
CBKCBPH15119.9°90.0°
NASCARCAC125.9°90.0°
CARNASCO125.3°90.0°
CARCACCBK116.1°90.0°
CARCACCAT127.6°90.0°
CBKCACCAT116.3°90.0°
CAMCALCAK108.1°90.0°
CALCAMNAN107.2°90.0°
CAMCALH1126.0°90.0°
CALCAKCAJ109.3°90.0°
CAKCALH1125.9°90.0°
CALCAKH2125.4°90.0°
CAMNANCO125.7°90.0°
CAMNANCAJ108.8°90.0°
NASCONAN90.0°90.0°
NASCONAX90.4°90.0°
NASCONAI177.0°90.0°
CACCATNAX125.3°90.0°
CACCATCAU127.6°90.0°
CAKCAJNAN106.7°90.0°
CAKCAJCAA127.0°90.0°
CAJCAKH2125.4°90.0°
CONANCAJ125.4°90.0°
NANCONAX177.9°90.0°
NANCONAI89.5°90.0°
NANCAJCAA126.3°90.0°
NAXCATCAU107.0°90.0°
CATNAXCO125.2°90.0°
CATNAXCAW109.1°90.0°
CATCAUCAV108.2°90.0°
CATCAUH3125.9°90.0°
NAXCONAI89.9°90.0°
CONAXCAW125.7°90.0°
CONAICAH126.2°90.0°
CONAICAE125.8°90.0°
CAJCAACAY118.4°90.0°
CAJCAACAH126.6°90.0°
NAXCAWCAV106.7°90.0°
NAXCAWCAD125.5°90.0°
CAUCAVCAW109.0°90.0°
CAVCAUH3125.9°90.0°
CAUCAVH4125.5°90.0°
CAYCAACAH115.0°90.0°
CAACAYCAZ121.3°90.0°
CAACAYCBD121.1°90.0°
CAACAHNAI125.8°90.0°
CAACAHCAG126.9°90.0°
CAHNAICAE108.0°90.0°
NAICAHCAG107.3°90.0°
NAICAECAD125.3°90.0°
NAICAECAF107.4°90.0°
CAVCAWCAD127.8°90.0°
CAWCAVH4125.5°90.0°
CAWCADCAE127.8°90.0°
CAWCADCBQ115.6°90.0°
CAZCAYCBD117.5°90.0°
CAYCAZCBA122.8°90.0°
CAYCAZH5118.6°90.0°
CAYCBDCBC120.8°90.0°
CAYCBDH9119.6°90.0°
CAZCBACBB119.3°90.0°
CBACAZH5118.6°90.0°
CAZCBAH6120.4°90.0°
CAHCAGCAF107.9°90.0°
CAHCAGH20126.0°90.0°
CBDCBCCBB121.0°90.0°
CBDCBCH8119.5°90.0°
CBCCBDH9119.6°90.0°
CBACBBCBC118.5°90.0°
CBBCBAH6120.4°90.0°
CBACBBH7120.7°90.0°
CADCAECAF127.3°90.0°
CAECADCBQ116.5°90.0°
CAECAFCAG109.4°90.0°
CAECAFH21125.3°90.0°
CADCBQCBR120.5°90.0°
CADCBQCBV121.8°90.0°
CBCCBBH7120.7°90.0°
CBBCBCH8119.5°90.0°
CAFCAGH20126.1°90.0°
CAGCAFH21125.3°90.0°
CBRCBQCBV117.7°90.0°
CBQCBRCBS121.6°90.0°
CBQCBRH14119.2°90.0°
CBQCBVCBU121.3°90.0°
CBQCBVH10119.3°90.0°
CBRCBSCBT120.4°90.0°
CBRCBSH13119.8°90.0°
CBSCBRH14119.2°90.0°
CBVCBUCBT119.7°90.0°
CBUCBVH10119.4°90.0°
CBVCBUH11120.1°90.0°
CBSCBTCBU119.1°90.0°
CBSCBTH12120.4°90.0°
CBTCBSH13119.8°90.0°
CBTCBUH11120.1°90.0°
CBUCBTH12120.5°90.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CBGCBHCBIH26180.0°90.0°
CBHCBGCBFH27180.0°90.0°
CBGCBHCBICBJ1.0°90.0°
CBHCBGCBFCBE0.7°90.0°
CBGCBHCBIH25179.0°90.0°
CBHCBGCBFH28179.3°90.0°
CBICBHCBGCBF1.1°90.0°
CBHCBICBJH25180.0°90.0°
CBHCBICBJCBE0.4°90.0°
CBHCBICBJH24179.6°90.0°
CBICBHCBGH27178.9°90.0°
CBGCBFCBEH28180.0°90.0°
CBGCBFCBECBJ0.1°90.0°
CBGCBFCBECAB179.4°90.0°
CBFCBGCBHH26178.9°90.0°
CBICBJCBECBF0.0°90.0°
CBICBJCBEH24180.0°90.0°
CBICBJCBECAB179.2°90.0°
CBJCBICBHH26179.0°90.0°
CBFCBECBJCAB179.3°90.0°
CBFCBECABCAO58.9°90.0°
CBFCBECABCAM118.7°90.0°
CBFCBECBJH24179.9°90.0°
CBECBFCBGH27179.3°90.0°
CBJCBECABCAO120.3°90.0°
CBJCBECABCAM62.1°90.0°
CBECBJCBIH25179.6°90.0°
CBJCBECBFH28179.9°90.0°
CBECABCAOCAP3.8°90.0°
CBECABCAOCAM177.4°90.0°
CBECABCAONAS175.4°90.0°
CBECABCAMCAL1.2°90.0°
CBECABCAMNAN177.0°90.0°
CABCBECBJH240.8°90.0°
CABCBECBFH280.6°90.0°
CAQCAPCAOH23180.0°90.0°
CAPCAQCARH22180.0°90.0°
CAQCAPCAOCAB178.2°90.0°
CAQCAPCAONAS1.1°90.0°
CAPCAQCARNAS1.0°90.0°
CAPCAQCARCAC179.8°90.0°
CAOCAPCAQCAR0.1°90.0°
CAPCAOCABNAS179.2°90.0°
CAPCAOCABCAM178.8°90.0°
CAPCAONASCAR1.8°90.0°
CAPCAONASCO179.9°90.0°
CAOCAPCAQH22179.9°90.0°
CAQCARNASCAO1.7°90.0°
CAQCARNASCAC179.2°90.0°
CAQCARCACCBK5.8°90.0°
CAQCARNASCO180.0°90.0°
CAQCARCACCAT175.5°90.0°
CARCAQCAPH23179.9°90.0°
CBMCBNCBOH17180.0°90.0°
CBNCBMCBLH18180.0°90.0°
CBMCBNCBOCBP0.7°90.0°
CBNCBMCBLCBK0.9°90.0°
CBMCBNCBOH16179.3°90.0°
CBNCBMCBLH19179.2°90.0°
CBOCBNCBMCBL0.3°90.0°
CBNCBOCBPH16180.0°90.0°
CBNCBOCBPCBK1.1°90.0°
CBNCBOCBPH15178.9°90.0°
CBOCBNCBMH18179.7°90.0°
CBMCBLCBKH19180.0°90.0°
CBMCBLCBKCBP0.4°90.0°
CBMCBLCBKCAC177.9°90.0°
CBLCBMCBNH17179.7°90.0°
CBOCBPCBKCBL0.6°90.0°
CBOCBPCBKH15180.0°90.0°
CBOCBPCBKCAC179.0°90.0°
CBPCBOCBNH17179.3°90.0°
CABCAONASCAR177.5°90.0°
CAOCABCAMCAL178.5°90.0°
CAOCABCAMNAN0.3°90.0°
CABCAONASCO0.8°90.0°
CABCAOCAPH231.8°90.0°
CAMCABCAONAS2.0°90.0°
CABCAMCALNAN178.4°90.0°
CABCAMCALCAK179.0°90.0°
CABCAMNANCO2.2°90.0°
CABCAMNANCAJ179.1°90.0°
CABCAMCALH11.0°90.0°
CAONASCARCO178.3°90.0°
CAONASCARCAC179.1°90.0°
CAONASCONAN1.1°90.0°
CAONASCONAX179.0°90.0°
CAONASCONAI82.2°90.0°
NASCAOCAPH23178.9°90.0°
CBLCBKCBPCAC178.4°90.0°
CBLCBKCACCAR57.6°90.0°
CBLCBKCACCAT123.6°90.0°
CBLCBKCBPH15179.5°90.0°
CBKCBLCBMH18179.1°90.0°
CBPCBKCACCAR120.8°90.0°
CBPCBKCACCAT58.1°90.0°
CBKCBPCBOH16178.9°90.0°
CBPCBKCBLH19179.6°90.0°
NASCARCACCBK175.2°90.0°
NASCARCACCAT3.5°90.0°
CARNASCONAN179.1°90.0°
CARNASCONAX2.9°90.0°
CARNASCONAI99.7°90.0°
NASCARCAQH22179.0°90.0°
CARCACCBKCAT178.8°90.0°
CACCARNASCO0.8°90.0°
CARCACCATNAX4.2°90.0°
CARCACCATCAU172.6°90.0°
CACCARCAQH220.1°90.0°
CBKCACCATNAX174.5°90.0°
CBKCACCATCAU8.7°90.0°
CACCBKCBPH151.1°90.0°
CACCBKCBLH192.1°90.0°
CAMCALCAKH1180.0°90.0°
CAMCALCAKCAJ0.3°90.0°
CALCAMNANCO176.2°90.0°
CALCAMNANCAJ0.6°90.0°
CAMCALCAKH2179.7°90.0°
CAKCALCAMNAN0.6°90.0°
CALCAKCAJH2180.0°90.0°
CALCAKCAJNAN0.0°90.0°
CALCAKCAJCAA179.4°90.0°
CAMNANCONAS2.4°90.0°
CAMNANCAJCAK0.4°90.0°
CAMNANCOCAJ176.3°90.0°
CAMNANCONAX105.7°90.0°
CAMNANCONAI179.5°90.0°
CAMNANCAJCAA179.8°90.0°
NANCAMCALH1179.4°90.0°
NASCONANNAX103.2°90.0°
NASCONANNAI177.0°90.0°
NASCONANCAJ178.8°90.0°
NASCONAXCAT2.3°90.0°
NASCONAXNAI177.0°90.0°
NASCONAXCAW175.3°90.0°
NASCONAICAH84.4°90.0°
NASCONAICAE96.1°90.0°
CACCATNAXCAU177.4°90.0°
CACCATNAXCO0.6°90.0°
CACCATNAXCAW178.5°90.0°
CACCATCAUCAV178.0°90.0°
CACCATCAUH31.9°90.0°
CAKCAJNANCO176.5°90.0°
CAKCAJNANCAA179.4°90.0°
CAKCAJCAACAY0.3°90.0°
CAKCAJCAACAH179.5°90.0°
CAJCAKCALH1179.7°90.0°
NANCONAXCAT105.5°90.0°
NANCONAXNAI73.8°90.0°
CONANCAJCAA2.9°90.0°
NANCONAXCAW72.1°90.0°
NANCONAICAH3.2°90.0°
NANCONAICAE177.3°90.0°
CAJNANCONAX78.0°90.0°
CAJNANCONAI4.2°90.0°
NANCAJCAACAY179.6°90.0°
NANCAJCAACAH1.3°90.0°
NANCAJCAKH2180.0°90.0°
CATNAXCOCAW177.5°90.0°
CATNAXCONAI179.3°90.0°
NAXCATCAUCAV0.7°90.0°
CATNAXCAWCAV1.0°90.0°
CATNAXCAWCAD179.9°90.0°
NAXCATCAUH3179.2°90.0°
CAUCATNAXCO176.8°90.0°
CAUCATNAXCAW1.1°90.0°
CATCAUCAVH3180.0°90.0°
CATCAUCAVCAW0.1°90.0°
CATCAUCAVH4179.9°90.0°
NAXCONAICAH178.8°90.0°
NAXCONAICAE0.7°90.0°
CONAXCAWCAV176.9°90.0°
CONAXCAWCAD2.2°90.0°
NAICONAXCAW1.7°90.0°
CONAICAHCAA0.7°90.0°
CONAICAHCAE179.6°90.0°
CONAICAHCAG178.9°90.0°
CONAICAECAD0.1°90.0°
CONAICAECAF178.0°90.0°
CAJCAACAYCAH179.2°90.0°
CAJCAACAHNAI2.5°90.0°
CAJCAACAYCAZ100.9°90.0°
CAJCAACAYCBD79.1°90.0°
CAJCAACAHCAG178.0°90.0°
CAACAJCAKH20.6°90.0°
NAXCAWCAVCAU0.5°90.0°
NAXCAWCAVCAD179.1°90.0°
NAXCAWCADCAE1.2°90.0°
NAXCAWCADCBQ179.1°90.0°
NAXCAWCAVH4179.5°90.0°
CAUCAVCAWH4180.0°90.0°
CAUCAVCAWCAD179.6°90.0°
CAYCAACAHNAI178.4°90.0°
CAACAYCAZCBD180.0°90.0°
CAACAYCAZCBA178.5°90.0°
CAYCAACAHCAG1.2°90.0°
CAACAYCBDCBC179.1°90.0°
CAACAYCAZH51.5°90.0°
CAACAYCBDH90.9°90.0°
CAACAHNAICAG179.6°90.0°
CAACAHNAICAE179.7°90.0°
CAHCAACAYCAZ79.9°90.0°
CAHCAACAYCBD100.1°90.0°
CAACAHCAGCAF179.1°90.0°
CAACAHCAGH200.9°90.0°
CAHNAICAECAD179.5°90.0°
CAHNAICAECAF1.6°90.0°
NAICAHCAGCAF0.5°90.0°
NAICAHCAGH20179.5°90.0°
NAICAECADCAW0.0°90.0°
CAENAICAHCAG0.7°90.0°
NAICAECADCAF177.5°90.0°
NAICAECADCBQ177.9°90.0°
NAICAECAFCAG1.9°90.0°
NAICAECAFH21178.1°90.0°
CAVCAWCADCAE177.7°90.0°
CAVCAWCADCBQ0.2°90.0°
CAWCAVCAUH3179.8°90.0°
CAWCADCAECBQ177.9°90.0°
CAWCADCAECAF177.5°90.0°
CAWCADCBQCBR67.9°90.0°
CAWCADCBQCBV110.4°90.0°
CADCAWCAVH40.4°90.0°
CAYCAZCBAH5180.0°90.0°
CAZCAYCBDCBC0.9°90.0°
CAYCAZCBACBB1.4°90.0°
CAYCAZCBAH6178.6°90.0°
CAZCAYCBDH9179.1°90.0°
CBDCAYCAZCBA1.5°90.0°
CAYCBDCBCH9180.0°90.0°
CAYCBDCBCCBB0.3°90.0°
CBDCAYCAZH5178.5°90.0°
CAYCBDCBCH8179.7°90.0°
CAZCBACBBH6180.0°90.0°
CAZCBACBBCBC0.7°90.0°
CAZCBACBBH7179.3°90.0°
CAHCAGCAFCAE1.5°90.0°
CAHCAGCAFH20180.0°90.0°
CAHCAGCAFH21178.5°90.0°
CBDCBCCBBCBA0.2°90.0°
CBDCBCCBBH8180.0°90.0°
CBDCBCCBBH7179.8°90.0°
CBACBBCBCH7180.0°90.0°
CBBCBACAZH5178.6°90.0°
CBACBBCBCH8179.8°90.0°
CADCAECAFCAG179.8°90.0°
CAECADCBQCBR113.9°90.0°
CAECADCBQCBV67.7°90.0°
CADCAECAFH210.3°90.0°
CAFCAECADCBQ4.6°90.0°
CAECAFCAGH21180.0°90.0°
CAECAFCAGH20178.5°90.0°
CADCBQCBRCBV178.4°90.0°
CADCBQCBRCBS179.5°90.0°
CADCBQCBVCBU179.9°90.0°
CADCBQCBVH100.2°90.0°
CADCBQCBRH140.6°90.0°
CBCCBBCBAH6179.3°90.0°
CBBCBCCBDH9179.7°90.0°
CBQCBRCBSH14180.0°90.0°
CBRCBQCBVCBU1.7°90.0°
CBQCBRCBSCBT2.1°90.0°
CBRCBQCBVH10178.3°90.0°
CBQCBRCBSH13177.9°90.0°
CBVCBQCBRCBS2.1°90.0°
CBQCBVCBUH10180.0°90.0°
CBQCBVCBUCBT1.4°90.0°
CBQCBVCBUH11178.6°90.0°
CBVCBQCBRH14177.9°90.0°
CBRCBSCBTH13180.0°90.0°
CBRCBSCBTCBU1.7°90.0°
CBRCBSCBTH12178.3°90.0°
CBVCBUCBTCBS1.3°90.0°
CBVCBUCBTH11180.0°90.0°
CBVCBUCBTH12178.7°90.0°
CBSCBTCBUH12180.0°90.0°
CBSCBTCBUH11178.7°90.0°
CBTCBSCBRH14177.8°90.0°
CBTCBUCBVH10178.6°90.0°
CBUCBTCBSH13178.3°90.0°
H1CALCAKH20.3°90.0°
H3CAUCAVH40.1°90.0°
H5CAZCBAH61.4°90.0°
H6CBACBBH70.7°90.0°
H7CBBCBCH80.2°90.0°
H8CBCCBDH90.3°90.0°
H10CBVCBUH111.4°90.0°
H11CBUCBTH121.3°90.0°
H12CBTCBSH131.7°90.0°
H13CBSCBRH142.1°90.0°
H15CBPCBOH161.1°90.0°
H16CBOCBNH170.7°90.0°
H17CBNCBMH180.3°90.0°
H18CBMCBLH190.9°90.0°
H20CAGCAFH211.5°90.0°
H22CAQCAPH230.1°90.0°
H24CBJCBIH250.4°90.0°
H25CBICBHH261.0°90.0°
H26CBHCBGH271.1°90.0°
H27CBGCBFH280.7°90.0°

225946

PDB entries from 2024-10-09

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