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Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
NCAsing1.47Å1.49Å
NHsing1.01Å1.00Å
NH2sing1.01Å1.00Å
CACsing1.51Å1.53Å
CACBsing1.53Å1.53Å
CAHAsing1.09Å1.10Å
COdoub1.21Å1.25Å
COXTsing1.34Å1.25Å
CBCGsing1.53Å1.52Å
CBHB2sing1.09Å1.10Å
CBHB3sing1.09Å1.10Å
CGCDsing1.51Å1.51Å
CGHG2sing1.09Å1.10Å
CGHG3sing1.09Å1.10Å
CDOE1doub1.21Å1.23Å
OXTHXTsing0.97Å0.95Å
N1CA1sing1.47Å1.46Å
N1H1sing0.97Å1.00Å
CA1CB1sing1.53Å1.53Å
CA1C1sing1.51Å1.52Å
CA1HA1sing1.09Å1.10Å
CB1SGsing1.81Å1.79Å
CB1HB21sing1.09Å1.10Å
CB1HB31sing1.09Å1.10Å
SGCD1sing1.81Å1.81Å
CD1CEsing1.51Å1.51Å
CD1HD2sing1.09Å1.10Å
CD1HD3sing1.09Å1.10Å
CECZ1doub1.38Å1.39ÅAromatic
CECZ2sing1.38Å1.39ÅAromatic
CZ1CT1sing1.38Å1.39ÅAromatic
CZ1HZ1sing1.08Å1.08Å
CZ2CT2doub1.38Å1.40ÅAromatic
CZ2HZ2sing1.08Å1.08Å
CT1CHdoub1.38Å1.39ÅAromatic
CT1HT1sing1.08Å1.08Å
CT2CHsing1.38Å1.39ÅAromatic
CT2HT2sing1.08Å1.08Å
CHHHsing1.08Å1.08Å
C1O1doub1.21Å1.23Å
N2CA2sing1.47Å1.45Å
N2H3sing0.97Å1.00Å
CA2CB2sing1.51Å1.49Å
CA2C2sing1.51Å1.53Å
CA2HA2sing1.09Å1.10Å
CB2CG1sing1.38Å1.39ÅAromatic
CB2CG2doub1.38Å1.39ÅAromatic
CG1CD11doub1.38Å1.39ÅAromatic
CG1HG1sing1.08Å1.08Å
CD11CE1sing1.38Å1.39ÅAromatic
CD11HD1sing1.08Å1.08Å
CE1CD2doub1.38Å1.39ÅAromatic
CE1HEsing1.08Å1.08Å
CD2CG2sing1.38Å1.39ÅAromatic
CD2HD21sing1.08Å1.08Å
CG2HG21sing1.08Å1.08Å
C2O2doub1.21Å1.25Å
C2OXT1sing1.34Å1.25Å
OXT1HXT1sing0.97Å0.95Å
CDN1sing1.35Å1.33Å
C1N2sing1.35Å1.33Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CANH109.5°111.0°
CANH2109.5°111.0°
NCAC111.1°109.4°
NCACB110.2°109.5°
NCAHA108.1°109.5°
HNH2109.4°111.0°
CCACB110.3°109.5°
CCAHA108.0°109.5°
CACO118.8°120.0°
CACOXT117.9°120.0°
CBCAHA109.0°109.5°
CACBCG112.8°109.5°
CACBHB2108.4°109.5°
CACBHB3108.4°109.5°
OCOXT123.2°120.0°
COXTHXT109.5°117.0°
CGCBHB2108.4°109.4°
CGCBHB3108.4°109.5°
CBCGCD113.5°109.5°
CBCGHG2108.1°109.5°
CBCGHG3108.1°109.5°
HB2CBHB3110.5°109.5°
CDCGHG2108.1°109.4°
CDCGHG3108.1°109.5°
CGCDOE1121.2°120.0°
CGCDN1115.3°120.0°
HG2CGHG3110.8°109.4°
OE1CDN1123.4°120.0°
CA1N1H1118.6°120.0°
N1CA1CB1110.1°109.5°
N1CA1C1110.9°109.5°
N1CA1HA1107.4°109.4°
CA1N1CD122.8°120.0°
H1N1CD118.6°120.0°
CB1CA1C1107.3°109.5°
CB1CA1HA1111.0°109.5°
CA1CB1SG115.8°109.5°
CA1CB1HB21107.4°109.4°
CA1CB1HB31107.4°109.5°
C1CA1HA1110.2°109.4°
CA1C1O1121.1°120.0°
CA1C1N2115.2°120.0°
SGCB1HB21107.4°109.5°
SGCB1HB31107.4°109.5°
CB1SGCD1100.3°103.0°
HB21CB1HB31111.4°109.5°
SGCD1CE113.8°109.5°
SGCD1HD2108.0°109.5°
SGCD1HD3108.0°109.5°
CECD1HD2108.0°109.5°
CECD1HD3108.1°109.4°
CD1CECZ1120.4°120.0°
CD1CECZ2120.8°120.0°
HD2CD1HD3110.9°109.4°
CZ1CECZ2118.8°120.0°
CECZ1CT1120.9°120.0°
CECZ1HZ1119.6°120.0°
CECZ2CT2120.8°120.0°
CECZ2HZ2119.6°120.0°
CT1CZ1HZ1119.5°120.0°
CZ1CT1CH119.9°120.0°
CZ1CT1HT1120.1°120.0°
CT2CZ2HZ2119.6°120.0°
CZ2CT2CH119.9°120.0°
CZ2CT2HT2120.0°120.0°
CHCT1HT1120.0°120.0°
CT1CHCT2119.8°120.0°
CT1CHHH120.1°119.9°
CHCT2HT2120.1°120.0°
CT2CHHH120.1°120.1°
O1C1N2123.7°120.0°
CA2N2H3118.7°120.0°
N2CA2CB2112.0°109.5°
N2CA2C2114.1°109.5°
N2CA2HA2106.4°109.4°
CA2N2C1122.7°120.0°
H3N2C1118.7°120.0°
CB2CA2C2115.1°109.5°
CB2CA2HA2105.3°109.5°
CA2CB2CG1121.0°120.0°
CA2CB2CG2120.1°120.0°
C2CA2HA2102.6°109.5°
CA2C2O2117.2°120.0°
CA2C2OXT1119.2°120.0°
CG1CB2CG2118.8°120.0°
CB2CG1CD11120.8°120.0°
CB2CG1HG1119.6°120.0°
CB2CG2CD2120.8°120.0°
CB2CG2HG21119.6°120.0°
CD11CG1HG1119.6°120.0°
CG1CD11CE1119.8°120.0°
CG1CD11HD1120.1°120.0°
CE1CD11HD1120.1°120.0°
CD11CE1CD2119.8°120.0°
CD11CE1HE120.1°120.0°
CD2CE1HE120.1°120.0°
CE1CD2CG2120.0°120.0°
CE1CD2HD21120.0°120.0°
CG2CD2HD21120.0°120.0°
CD2CG2HG21119.6°120.0°
O2C2OXT1123.6°120.0°
C2OXT1HXT1109.5°117.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CANHH2120.0°123.9°
NCACCB122.6°120.0°
NCACHA118.4°120.0°
NCACBHA118.5°120.0°
NCACO153.3°20.0°
NCACOXT25.7°160.0°
NCACBCG169.0°65.0°
NCACBHB249.0°55.0°
NCACBHB371.0°175.0°
HNCAC180.0°60.0°
HNCACB57.4°60.0°
HNCAHA61.6°180.0°
H2NCAC60.0°176.1°
H2NCACB177.4°63.9°
H2NCAHA58.3°56.0°
CCACBHA118.4°120.0°
CACOOXT179.0°179.9°
CCACBCG67.9°175.0°
CCACBHB2172.1°65.0°
CCACBHB352.1°55.0°
CACOXTHXT178.9°180.0°
CBCACO84.1°99.9°
CBCACOXT96.9°80.0°
CACBCGHB2120.0°120.0°
CACBCGHB3120.0°120.0°
CACBHB2HB3118.7°120.0°
CACBCGCD179.7°180.0°
CACBCGHG259.7°60.0°
CACBCGHG360.3°60.0°
HACACO34.9°140.0°
HACACOXT144.1°40.0°
HACACBCG50.5°55.0°
HACACBHB269.5°175.0°
HACACBHB3170.5°65.0°
OCOXTHXT0.0°0.1°
CGCBHB2HB3118.6°120.0°
CBCGCDHG2120.0°120.0°
CBCGCDHG3120.0°120.0°
CBCGHG2HG3118.3°120.0°
CBCGCDOE16.1°0.0°
CBCGCDN1171.8°180.0°
HB2CBCGCD60.3°60.1°
HB2CBCGHG2179.7°180.0°
HB2CBCGHG359.7°60.0°
HB3CBCGCD59.7°60.0°
HB3CBCGHG260.3°60.0°
HB3CBCGHG3179.7°180.0°
CDCGHG2HG3118.3°120.0°
CGCDOE1N1177.7°180.0°
CGCDN1CA1179.1°180.0°
CGCDN1H10.9°0.0°
HG2CGCDOE1113.9°120.0°
HG2CGCDN168.2°60.0°
HG3CGCDOE1126.1°120.0°
HG3CGCDN151.8°60.0°
OE1CDN1CA13.1°0.0°
OE1CDN1H1176.9°180.0°
CA1N1H1CD180.0°180.0°
N1CA1CB1C1120.8°120.0°
N1CA1CB1HA1118.8°120.0°
N1CA1C1HA1118.8°119.9°
N1CA1CB1SG66.5°60.0°
N1CA1CB1HB2153.5°60.0°
N1CA1CB1HB31173.5°180.0°
N1CA1C1O130.5°20.0°
N1CA1C1N2151.6°159.9°
H1N1CA1CB172.9°120.0°
H1N1CA1C145.7°120.0°
H1N1CA1HA1166.1°0.1°
CB1CA1C1HA1121.0°120.0°
CA1CB1SGHB21120.0°119.9°
CA1CB1SGHB31120.0°120.0°
CA1CB1HB21HB31117.4°120.0°
CA1CB1SGCD197.2°180.0°
CB1CA1C1O189.7°100.0°
CB1CA1N1CD107.1°60.0°
CB1CA1C1N288.2°80.0°
C1CA1CB1SG172.7°180.0°
C1CA1CB1HB2167.3°60.0°
C1CA1CB1HB3152.7°60.0°
CA1C1O1N2177.7°180.0°
CA1C1N2CA2177.8°180.0°
CA1C1N2H32.1°0.0°
C1CA1N1CD134.3°60.0°
HA1CA1CB1SG52.3°60.0°
HA1CA1CB1HB21172.3°180.0°
HA1CA1CB1HB3167.8°60.0°
HA1CA1C1O1149.3°140.0°
HA1CA1N1CD13.8°180.0°
HA1CA1C1N232.8°40.0°
SGCB1HB21HB31117.4°120.0°
CB1SGCD1CE49.1°180.0°
CB1SGCD1HD270.8°60.0°
CB1SGCD1HD3169.1°60.0°
HB21CB1SGCD1142.8°60.0°
HB31CB1SGCD122.8°60.0°
SGCD1CEHD2120.0°120.1°
SGCD1CEHD3120.0°120.0°
SGCD1HD2HD3118.2°120.0°
SGCD1CECZ1121.3°90.0°
SGCD1CECZ258.7°90.2°
CECD1HD2HD3118.2°119.9°
CD1CECZ1CZ2180.0°179.8°
CD1CECZ1CT1179.9°180.0°
CD1CECZ1HZ10.1°0.0°
CD1CECZ2CT2179.9°180.0°
CD1CECZ2HZ20.1°0.1°
HD2CD1CECZ11.3°30.1°
HD2CD1CECZ2178.7°149.7°
HD3CD1CECZ1118.7°150.0°
HD3CD1CECZ261.3°29.8°
CECZ1CT1HZ1180.0°180.0°
CZ1CECZ2CT20.1°0.3°
CZ1CECZ2HZ2179.9°179.7°
CECZ1CT1CH0.1°0.0°
CECZ1CT1HT1179.9°179.9°
CZ2CECZ1CT10.1°0.3°
CZ2CECZ1HZ1180.0°179.8°
CECZ2CT2HZ2180.0°180.0°
CECZ2CT2CH0.1°0.0°
CECZ2CT2HT2179.9°179.9°
CZ1CT1CHHT1180.0°179.9°
CZ1CT1CHCT20.1°0.2°
CZ1CT1CHHH179.9°180.0°
HZ1CZ1CT1CH179.9°180.0°
HZ1CZ1CT1HT10.1°0.1°
CZ2CT2CHCT10.1°0.2°
CZ2CT2CHHT2180.0°179.9°
CZ2CT2CHHH179.9°180.0°
HZ2CZ2CT2CH179.9°180.0°
HZ2CZ2CT2HT20.1°0.1°
CT1CHCT2HH180.0°179.8°
CT1CHCT2HT2179.9°179.7°
HT1CT1CHCT2179.9°179.8°
HT1CT1CHHH0.1°0.1°
HT2CT2CHHH0.1°0.1°
O1C1N2CA20.0°0.0°
O1C1N2H3180.0°180.0°
CA2N2H3C1180.0°179.9°
N2CA2CB2C2132.6°120.0°
N2CA2CB2HA2115.2°120.0°
N2CA2C2HA2114.7°119.9°
N2CA2CB2CG189.5°140.0°
N2CA2CB2CG287.2°40.3°
N2CA2C2O2161.6°0.0°
N2CA2C2OXT118.0°180.0°
H3N2CA2CB236.0°25.0°
H3N2CA2C297.0°95.0°
H3N2CA2HA2150.5°145.0°
CB2CA2C2HA2113.7°120.1°
CA2CB2CG1CG2176.7°179.8°
CA2CB2CG1CD11176.4°180.0°
CA2CB2CG1HG13.6°0.0°
CA2CB2CG2CD2176.4°179.8°
CA2CB2CG2HG213.6°0.0°
CB2CA2C2O266.8°120.0°
CB2CA2C2OXT1113.6°60.0°
CB2CA2N2C1144.0°155.0°
C2CA2CB2CG143.1°100.0°
C2CA2CB2CG2140.3°79.7°
CA2C2O2OXT1179.6°180.0°
CA2C2OXT1HXT1179.6°179.9°
C2CA2N2C183.0°85.0°
HA2CA2CB2CG1155.3°20.0°
HA2CA2CB2CG228.1°160.2°
HA2CA2C2O246.9°120.0°
HA2CA2C2OXT1132.7°60.0°
HA2CA2N2C129.4°34.9°
CB2CG1CD11HG1180.0°180.0°
CB2CG1CD11CE10.1°0.0°
CB2CG1CD11HD1180.0°179.9°
CG1CB2CG2CD20.2°0.5°
CG1CB2CG2HG21179.8°179.7°
CG2CB2CG1CD110.3°0.2°
CG2CB2CG1HG1179.7°179.8°
CB2CG2CD2CE10.0°0.4°
CB2CG2CD2HG21180.0°179.8°
CB2CG2CD2HD21180.0°179.7°
CG1CD11CE1HD1180.0°179.9°
CG1CD11CE1CD20.2°0.1°
CG1CD11CE1HE179.9°179.9°
HG1CG1CD11CE1179.9°180.0°
HG1CG1CD11HD10.0°0.1°
CD11CE1CD2HE180.0°180.0°
CD11CE1CD2CG20.2°0.2°
CD11CE1CD2HD21179.8°180.0°
HD1CD11CE1CD2179.8°180.0°
HD1CD11CE1HE0.2°0.0°
CE1CD2CG2HD21180.0°179.8°
CE1CD2CG2HG21180.0°179.8°
HECE1CD2CG2179.8°179.8°
HECE1CD2HD210.2°0.0°
HD21CD2CG2HG210.0°0.1°
O2C2OXT1HXT10.0°0.1°

222415

PDB entries from 2024-07-10

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