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EP2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CBOXTsing1.45Å1.48Å
CBHB1sing1.09Å1.10Å
CBHB2sing1.09Å1.10Å
CBHB3sing1.09Å1.10Å
OXTCsing1.34Å1.35Å
NCAsing1.47Å1.45Å
NHsing0.97Å1.00Å
NC1sing1.35Å1.33Å
CACsing1.51Å1.51Å
CAHA1sing1.09Å1.10Å
CAHA2sing1.09Å1.10Å
COdoub1.21Å1.21Å
N1CA1sing1.46Å1.45Å
N1H1sing0.97Å1.00Å
N1C2sing1.35Å1.33Å
CA1C1sing1.51Å1.52Å
CA1HA21sing1.09Å1.10Å
CA1HA3sing1.09Å1.10Å
C1O1doub1.21Å1.24Å
N2CA2sing1.47Å1.48Å
N2H2sing0.97Å1.00Å
N2C11sing1.35Å1.33Å
CA2C2sing1.51Å1.51Å
CA2CB1sing1.53Å1.51Å
CA2HAsing1.09Å1.10Å
C2O2doub1.21Å1.23Å
CB1CGsing1.53Å1.52Å
CB1HB21sing1.09Å1.10Å
CB1HB31sing1.09Å1.10Å
CGCD1sing1.53Å1.53Å
CGCD2sing1.53Å1.53Å
CGHGsing1.09Å1.10Å
CD1HD11sing1.09Å1.10Å
CD1HD12sing1.09Å1.10Å
CD1HD13sing1.09Å1.10Å
CD2HD21sing1.09Å1.10Å
CD2HD22sing1.09Å1.10Å
CD2HD23sing1.09Å1.10Å
N3CA3sing1.47Å1.45Å
N3H3sing0.97Å1.00Å
N3C41sing1.35Å1.33Å
CA3C3sing1.51Å1.51Å
CA3CB2sing1.53Å1.53Å
CA3HA4sing1.09Å1.10Å
C3O3doub1.21Å1.23Å
C3N4sing1.35Å1.33Å
CB2CG1sing1.53Å1.53Å
CB2HB22sing1.09Å1.10Å
CB2HB32sing1.09Å1.10Å
CG1CD11sing1.53Å1.53Å
CG1CD21sing1.53Å1.51Å
CG1HG1sing1.09Å1.10Å
CD11HD14sing1.09Å1.10Å
CD11HD15sing1.09Å1.10Å
CD11HD16sing1.09Å1.10Å
CD21HD24sing1.09Å1.10Å
CD21HD25sing1.09Å1.10Å
CD21HD26sing1.09Å1.10Å
N4CA4sing1.47Å1.47Å
N4CDsing1.47Å1.49Å
CA4C4sing1.51Å1.55Å
CA4CB3sing1.54Å1.53Å
CA4HA5sing1.09Å1.10Å
C4O4doub1.21Å1.23Å
C4OXT1sing1.34Å1.24Å
CB3CG2sing1.55Å1.49Å
CB3HB23sing1.09Å1.10Å
CB3HB33sing1.09Å1.10Å
CG2CDsing1.55Å1.52Å
CG2HG2sing1.09Å1.10Å
CG2HG3sing1.09Å1.10Å
CDHD2sing1.09Å1.10Å
CDHD3sing1.09Å1.10Å
OXT1HXTsing0.97Å0.95Å
O11C11doub1.21Å1.24Å
C11C21sing1.51Å1.53Å
C21O21sing1.43Å1.44Å
C21C31sing1.53Å1.55Å
C21H21sing1.09Å1.10Å
O21C31sing1.43Å2.45Å
C31C41sing1.51Å1.52Å
C31H31sing1.09Å1.10Å
C41O41doub1.21Å1.17Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OXTCBHB1109.5°109.5°
OXTCBHB2109.5°109.5°
OXTCBHB3109.4°109.4°
CBOXTC128.4°117.0°
HB1CBHB2109.5°109.5°
HB1CBHB3109.5°109.5°
HB2CBHB3109.5°109.5°
OXTCCA119.7°120.0°
OXTCO120.0°120.0°
CANH119.5°120.0°
CANC1121.1°120.0°
NCAC112.0°109.4°
NCAHA1108.6°109.4°
NCAHA2108.1°109.5°
HNC1119.5°120.0°
NC1CA1116.0°120.0°
NC1O1122.8°120.0°
CCAHA1108.6°109.5°
CCAHA2108.0°109.4°
CACO120.3°120.0°
HA1CAHA2111.5°109.5°
CA1N1H1119.5°120.0°
CA1N1C2121.0°120.0°
N1CA1C1113.3°109.5°
N1CA1HA21108.2°109.5°
N1CA1HA3107.4°109.5°
H1N1C2119.5°120.0°
N1C2CA2115.6°120.0°
N1C2O2123.2°120.0°
C1CA1HA21108.2°109.5°
C1CA1HA3107.3°109.5°
CA1C1O1120.9°120.0°
HA21CA1HA3112.5°109.4°
CA2N2H2119.0°120.0°
CA2N2C11122.0°120.0°
N2CA2C2111.5°109.5°
N2CA2CB1111.5°109.4°
N2CA2HA106.0°109.5°
H2N2C11119.0°120.0°
N2C11O11121.8°120.0°
N2C11C21116.6°120.0°
C2CA2CB1107.2°109.5°
C2CA2HA110.3°109.4°
CA2C2O2121.1°120.0°
CB1CA2HA110.3°109.5°
CA2CB1CG119.4°109.4°
CA2CB1HB21106.3°109.5°
CA2CB1HB31104.0°109.5°
CGCB1HB21106.3°109.5°
CGCB1HB31104.0°109.5°
CB1CGCD1106.8°109.5°
CB1CGCD2111.3°109.4°
CB1CGHG109.9°109.5°
HB21CB1HB31117.6°109.5°
CD1CGCD2109.1°109.5°
CD1CGHG112.1°109.5°
CGCD1HD11109.5°109.5°
CGCD1HD12109.4°109.4°
CGCD1HD13109.4°109.4°
CD2CGHG107.7°109.4°
CGCD2HD21109.5°109.5°
CGCD2HD22109.5°109.4°
CGCD2HD23109.4°109.4°
HD11CD1HD12109.5°109.5°
HD11CD1HD13109.5°109.5°
HD12CD1HD13109.5°109.5°
HD21CD2HD22109.5°109.5°
HD21CD2HD23109.5°109.4°
HD22CD2HD23109.5°109.5°
CA3N3H3118.7°120.0°
CA3N3C41122.6°120.0°
N3CA3C3119.4°109.5°
N3CA3CB2109.9°109.5°
N3CA3HA4101.7°109.4°
H3N3C41118.7°120.0°
N3C41C31115.0°120.0°
N3C41O4191.0°120.0°
C3CA3CB2108.9°109.5°
C3CA3HA4102.9°109.5°
CA3C3O3121.6°120.0°
CA3C3N4115.9°120.0°
CB2CA3HA4113.8°109.5°
CA3CB2CG1116.9°109.5°
CA3CB2HB22107.1°109.5°
CA3CB2HB32105.4°109.5°
O3C3N4122.5°120.0°
C3N4CA4122.9°125.6°
C3N4CD123.3°125.7°
CG1CB2HB22107.0°109.4°
CG1CB2HB32105.3°109.5°
CB2CG1CD11110.7°109.5°
CB2CG1CD21110.5°109.4°
CB2CG1HG1108.1°109.5°
HB22CB2HB32115.5°109.5°
CD11CG1CD21110.0°109.4°
CD11CG1HG1108.6°109.5°
CG1CD11HD14109.5°109.5°
CG1CD11HD15109.5°109.5°
CG1CD11HD16109.5°109.5°
CD21CG1HG1108.8°109.5°
CG1CD21HD24109.5°109.5°
CG1CD21HD25109.4°109.5°
CG1CD21HD26109.5°109.5°
HD14CD11HD15109.5°109.5°
HD14CD11HD16109.4°109.5°
HD15CD11HD16109.5°109.4°
HD24CD21HD25109.5°109.5°
HD24CD21HD26109.4°109.5°
HD25CD21HD26109.5°109.5°
CA4N4CD111.9°108.7°
N4CA4C4108.6°109.9°
N4CA4CB3102.1°107.3°
N4CA4HA5115.7°109.9°
N4CDCG2102.9°105.0°
N4CDHD2111.7°110.4°
N4CDHD3113.1°110.4°
C4CA4CB3112.5°109.9°
C4CA4HA5105.9°109.8°
CA4C4O4119.7°120.0°
CA4C4OXT1118.8°120.0°
CB3CA4HA5112.1°110.0°
CA4CB3CG2103.9°102.9°
CA4CB3HB23111.4°110.7°
CA4CB3HB33112.5°110.7°
O4C4OXT1121.5°120.0°
C4OXT1HXT109.5°117.0°
CG2CB3HB23111.4°110.7°
CG2CB3HB33112.6°110.8°
CB3CG2CD104.3°101.7°
CB3CG2HG2111.3°111.0°
CB3CG2HG3112.4°111.0°
HB23CB3HB33105.3°110.7°
CDCG2HG2111.2°111.1°
CDCG2HG3112.3°110.8°
CG2CDHD2111.7°110.4°
CG2CDHD3113.1°110.2°
HG2CG2HG3105.5°110.9°
HD2CDHD3104.6°110.4°
O11C11C21120.4°120.1°
C11C21O21116.6°117.8°
C11C21C31113.4°117.8°
C11C21H21101.4°115.7°
O21C21C31110.1°57.6°
O21C21H21105.3°117.8°
C21O21C3136.4°64.7°
C31C21H21109.2°117.8°
C21C31O2133.5°57.6°
C21C31C41105.4°117.8°
C21C31H31138.7°117.7°
O21C31C4183.7°117.8°
O21C31H31158.6°117.7°
C41C31H31113.9°115.8°
C31C41O4170.1°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OXTCBHB1HB2120.0°120.0°
OXTCBHB1HB3120.0°120.0°
OXTCBHB2HB3120.0°120.0°
CBOXTCCA165.6°180.0°
CBOXTCO12.1°0.1°
HB1CBHB2HB3120.0°120.0°
HB1CBOXTC85.1°59.9°
HB2CBOXTC34.9°60.1°
HB3CBOXTC154.9°179.9°
OXTCCAN68.1°179.9°
OXTCCAO177.7°179.9°
OXTCCAHA151.9°60.0°
OXTCCAHA2173.0°60.0°
CANHC1180.0°179.9°
NCACHA1120.0°119.9°
NCACHA2118.9°120.0°
NCAHA1HA2119.0°120.1°
NCACO109.7°0.0°
CANC1CA1179.0°180.0°
CANC1O16.9°0.1°
HNCAC72.0°0.0°
HNCAHA148.0°120.0°
HNCAHA2169.1°119.9°
HNC1CA11.0°0.1°
HNC1O1173.2°180.0°
C1NCAC108.0°180.0°
C1NCAHA1132.0°60.1°
C1NCAHA210.9°60.0°
NC1CA1N150.1°180.0°
NC1CA1O1174.2°179.9°
NC1CA1HA21170.2°60.0°
NC1CA1HA368.2°59.9°
CCAHA1HA2118.9°120.0°
HA1CACO130.4°119.9°
HA2CACO9.3°120.0°
CA1N1H1C2180.0°180.0°
N1CA1C1HA21120.0°120.0°
N1CA1C1HA3118.3°120.0°
N1CA1HA21HA3118.5°120.0°
N1CA1C1O1124.1°0.1°
CA1N1C2CA2179.1°175.8°
CA1N1C2O23.1°4.1°
H1N1CA1C1101.6°0.0°
H1N1CA1HA21138.4°120.1°
H1N1CA1HA316.7°120.0°
H1N1C2CA20.9°4.2°
H1N1C2O2176.9°175.9°
C2N1CA1C178.4°180.0°
C2N1CA1HA2141.7°60.0°
C2N1CA1HA3163.3°59.9°
N1C2CA2N2139.4°162.4°
N1C2CA2O2176.1°179.9°
N1C2CA2CB198.3°77.6°
N1C2CA2HA21.9°42.4°
C1CA1HA21HA3118.4°120.0°
HA21CA1C1O14.1°120.1°
HA3CA1C1O1117.6°120.0°
CA2N2H2C11180.0°179.9°
N2CA2C2CB1122.3°120.0°
N2CA2C2HA117.5°120.0°
N2CA2CB1HA117.5°120.0°
N2CA2C2O236.7°17.6°
N2CA2CB1CG80.2°173.9°
N2CA2CB1HB2139.8°53.9°
N2CA2CB1HB31164.6°66.1°
CA2N2C11O1111.7°5.0°
CA2N2C11C21179.2°175.0°
H2N2CA2C269.3°28.3°
H2N2CA2CB150.5°91.7°
H2N2CA2HA170.6°148.3°
H2N2C11O11168.3°174.9°
H2N2C11C210.8°5.1°
C11N2CA2C2110.7°151.6°
C11N2CA2CB1129.4°88.4°
C11N2CA2HA9.3°31.6°
N2C11O11C21167.0°180.0°
N2C11C21O2129.4°133.6°
N2C11C21C31100.0°67.6°
N2C11C21H21143.1°79.5°
C2CA2CB1HA120.1°120.0°
C2CA2CB1CG157.5°66.1°
C2CA2CB1HB2182.5°173.9°
C2CA2CB1HB3142.3°53.9°
CB1CA2C2O285.6°102.3°
CA2CB1CGHB21120.0°120.0°
CA2CB1CGHB31115.2°120.0°
CA2CB1HB21HB31115.9°120.0°
CA2CB1CGCD1175.4°67.1°
CA2CB1CGCD265.6°172.9°
CA2CB1CGHG53.6°52.9°
HACA2C2O2154.2°137.7°
HACA2CB1CG37.3°53.9°
HACA2CB1HB21157.3°66.1°
HACA2CB1HB3177.9°173.9°
CGCB1HB21HB31115.9°120.0°
CB1CGCD1CD2120.4°120.0°
CB1CGCD1HG120.4°120.0°
CB1CGCD2HG120.5°120.0°
CB1CGCD1HD11177.4°176.1°
CB1CGCD1HD1257.3°56.0°
CB1CGCD1HD1362.6°63.9°
CB1CGCD2HD2194.3°59.9°
CB1CGCD2HD2225.6°180.0°
CB1CGCD2HD23145.6°60.0°
HB21CB1CGCD155.4°52.9°
HB21CB1CGCD2174.3°67.1°
HB21CB1CGHG66.5°172.9°
HB31CB1CGCD169.4°172.9°
HB31CB1CGCD249.6°52.9°
HB31CB1CGHG168.8°67.1°
CD1CGCD2HG121.9°120.0°
CGCD1HD11HD12120.0°120.0°
CGCD1HD11HD13120.0°120.0°
CGCD1HD12HD13119.9°119.9°
CD1CGCD2HD2123.2°180.0°
CD1CGCD2HD22143.2°59.9°
CD1CGCD2HD2396.8°60.0°
CD2CGCD1HD1162.2°63.9°
CD2CGCD1HD12177.7°176.0°
CD2CGCD1HD1357.8°56.1°
CGCD2HD21HD22120.0°120.0°
CGCD2HD21HD23120.0°120.0°
CGCD2HD22HD23120.0°119.9°
HGCGCD1HD1156.9°56.1°
HGCGCD1HD1263.1°64.0°
HGCGCD1HD13176.9°176.1°
HGCGCD2HD21145.1°60.0°
HGCGCD2HD2294.9°60.1°
HGCGCD2HD2325.1°180.0°
HD11CD1HD12HD13120.0°120.1°
HD21CD2HD22HD23120.0°120.0°
CA3N3H3C41180.0°180.0°
N3CA3C3CB2127.3°120.0°
N3CA3C3HA4111.6°120.0°
N3CA3CB2HA4113.3°120.0°
N3CA3C3O325.4°0.0°
N3CA3C3N4154.7°180.0°
N3CA3CB2CG183.9°65.0°
N3CA3CB2HB22156.1°55.0°
N3CA3CB2HB3232.6°175.0°
CA3N3C41C31172.7°180.0°
CA3N3C41O41118.9°0.0°
H3N3CA3C3118.1°25.0°
H3N3CA3CB28.7°95.0°
H3N3CA3HA4129.6°145.0°
H3N3C41C317.3°0.0°
H3N3C41O4161.1°180.0°
C41N3CA3C361.9°155.0°
C41N3CA3CB2171.3°85.0°
C41N3CA3HA450.3°35.0°
N3C41C31C2190.1°65.0°
N3C41C31O2164.4°131.0°
N3C41C31O4181.5°180.0°
N3C41C31H31102.9°82.0°
C3CA3CB2HA4114.2°120.1°
CA3C3O3N4179.9°180.0°
C3CA3CB2CG148.5°175.0°
C3CA3CB2HB2271.4°65.0°
C3CA3CB2HB32165.1°55.0°
CA3C3N4CA4179.1°180.0°
CA3C3N4CD17.7°0.3°
CB2CA3C3O3101.8°120.0°
CB2CA3C3N478.1°60.0°
CA3CB2CG1HB22120.0°120.0°
CA3CB2CG1HB32116.6°120.0°
CA3CB2HB22HB32117.0°120.0°
CA3CB2CG1CD11172.5°175.0°
CA3CB2CG1CD2165.3°65.0°
CA3CB2CG1HG153.7°55.0°
HA4CA3C3O3137.0°120.0°
HA4CA3C3N443.1°60.0°
HA4CA3CB2CG1162.7°55.0°
HA4CA3CB2HB2242.8°175.0°
HA4CA3CB2HB3280.7°65.1°
O3C3N4CA40.8°0.0°
O3C3N4CD162.4°179.7°
C3N4CA4CD164.9°179.8°
C3N4CA4C491.8°61.6°
C3N4CA4CB3149.1°178.9°
C3N4CA4HA527.1°59.3°
C3N4CDCG2172.3°155.9°
C3N4CDHD252.4°37.0°
C3N4CDHD365.3°85.3°
CG1CB2HB22HB32116.9°120.0°
CB2CG1CD11CD21122.4°120.0°
CB2CG1CD11HG1118.5°120.0°
CB2CG1CD21HG1118.5°120.0°
CB2CG1CD11HD1488.3°60.0°
CB2CG1CD11HD1531.7°180.0°
CB2CG1CD11HD16151.8°60.1°
CB2CG1CD21HD24144.5°60.0°
CB2CG1CD21HD2524.5°180.0°
CB2CG1CD21HD2695.5°60.0°
HB22CB2CG1CD1152.6°55.0°
HB22CB2CG1CD21174.7°175.0°
HB22CB2CG1HG166.3°65.0°
HB32CB2CG1CD1170.9°64.9°
HB32CB2CG1CD2151.3°55.0°
HB32CB2CG1HG1170.3°175.0°
CD11CG1CD21HG1118.9°120.0°
CG1CD11HD14HD15120.0°120.0°
CG1CD11HD14HD16120.0°120.0°
CG1CD11HD15HD16120.0°119.9°
CD11CG1CD21HD2422.0°180.0°
CD11CG1CD21HD2598.0°60.0°
CD11CG1CD21HD26141.9°60.0°
CD21CG1CD11HD14149.3°60.0°
CD21CG1CD11HD1590.7°60.0°
CD21CG1CD11HD1629.3°180.0°
CG1CD21HD24HD25120.0°120.0°
CG1CD21HD24HD26120.0°120.0°
CG1CD21HD25HD26120.0°120.0°
HG1CG1CD11HD1430.3°180.0°
HG1CG1CD11HD15150.3°60.0°
HG1CG1CD11HD1689.7°60.0°
HG1CG1CD21HD2497.0°60.0°
HG1CG1CD21HD25143.0°60.0°
HG1CG1CD21HD2623.0°180.0°
HD14CD11HD15HD16120.0°120.1°
HD24CD21HD25HD26120.0°120.0°
N4CA4C4CB3112.3°117.8°
N4CA4C4HA5124.9°121.0°
N4CA4CB3HA5124.5°119.5°
N4CA4C4O4161.3°0.1°
N4CA4C4OXT116.8°180.0°
N4CA4CB3CG233.4°22.2°
N4CA4CB3HB23153.4°96.2°
N4CA4CB3HB3388.6°140.6°
CA4N4CDCG27.5°23.8°
CA4N4CDHD2112.4°142.7°
CA4N4CDHD3129.9°94.9°
CDN4CA4C4103.3°118.6°
CDN4CA4CB315.8°0.8°
CDN4CA4HA5137.8°120.5°
N4CDCG2CB328.7°36.7°
N4CDCG2HD2120.0°118.9°
N4CDCG2HD3122.4°118.9°
N4CDCG2HG291.4°154.9°
N4CDCG2HG3150.6°81.3°
N4CDHD2HD3122.7°122.3°
C4CA4CB3HA5119.2°121.1°
CA4C4O4OXT1178.0°179.9°
C4CA4CB3CG282.9°141.6°
C4CA4CB3HB2337.1°23.2°
C4CA4CB3HB33155.1°100.0°
CA4C4OXT1HXT178.0°179.9°
CB3CA4C4O486.4°117.8°
CB3CA4C4OXT195.6°62.2°
CA4CB3CG2HB23120.0°118.4°
CA4CB3CG2HB33122.0°118.4°
CA4CB3HB23HB33122.3°123.2°
CA4CB3CG2CD39.0°35.3°
CA4CB3CG2HG281.0°153.6°
CA4CB3CG2HG3161.0°82.6°
HA5CA4C4O436.3°121.0°
HA5CA4C4OXT1141.7°59.0°
HA5CA4CB3CG2157.9°97.3°
HA5CA4CB3HB2382.1°144.3°
HA5CA4CB3HB3335.8°21.1°
O4C4OXT1HXT0.0°0.0°
CG2CB3HB23HB33122.3°123.3°
CB3CG2CDHG2120.0°118.1°
CB3CG2CDHG3121.9°118.1°
CB3CG2HG2HG3122.1°123.9°
CB3CG2CDHD291.3°155.6°
CB3CG2CDHD3151.0°82.1°
HB23CB3CG2CD159.1°83.0°
HB23CB3CG2HG239.1°35.2°
HB23CB3CG2HG379.0°159.0°
HB33CB3CG2CD83.0°153.7°
HB33CB3CG2HG2157.0°88.1°
HB33CB3CG2HG338.9°35.8°
CDCG2HG2HG3122.1°123.8°
CG2CDHD2HD3122.6°122.1°
HG2CG2CDHD2148.7°86.2°
HG2CG2CDHD331.0°36.0°
HG3CG2CDHD230.6°37.6°
HG3CG2CDHD387.0°159.8°
O11C11C21O21138.3°46.3°
O11C11C21C3192.3°112.4°
O11C11C21H2124.6°100.6°
C11C21O21C31130.9°106.9°
C11C21O21H21111.5°146.2°
C11C21C31H21112.2°146.4°
C11C21C31C41175.9°146.3°
C11C21C31H3114.1°0.0°
O21C21C31H21115.2°106.8°
O21C21C31C4151.5°106.9°
O21C21C31H31146.7°106.8°
C21C31C41H31166.9°147.0°
C21C31C41O41171.6°115.0°
H21C21C31C4163.6°0.0°
H21C21C31H3198.1°146.4°
O21C31C41H31167.3°147.0°
O21C31C41O41145.8°49.0°
H31C31C41O4121.5°98.0°

222415

PDB entries from 2024-07-10

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