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Obsolete: SOY

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OCdoub1.22Å1.23Å
CCAsing1.51Å1.52Å
COXTsing1.36Å86.68Å
CANsing1.44Å1.49Å
CACBsing1.52Å1.54Å
CAHAsing1.10Å1.11Å
NHN1sing1.01Å1.02Å
NHN2sing1.01Å1.02Å
CBOGsing1.43Å1.41Å
CBHBC1sing1.10Å1.12Å
CBHBC2sing1.10Å1.11Å
OGC1sing1.36Å1.45Å
C1O2doub1.23Å1.23Å
C1C3sing1.52Å1.49Å
C3C4sing1.53Å1.54Å
C3N14sing1.44Å1.46Å
C3H3sing1.09Å1.11Å
C4S5sing1.82Å1.78Å
C4N13sing1.47Å1.45Å
C4H4sing1.09Å1.12Å
S5C6sing1.83Å1.79Å
C6C7sing1.53Å1.53Å
C6C8sing1.54Å1.53Å
C6C9sing1.54Å1.53Å
C7H7C1sing1.09Å1.12Å
C7H7C2sing1.09Å1.11Å
C7H7C3sing1.09Å1.11Å
C8H8C1sing1.09Å1.12Å
C8H8C2sing1.09Å1.11Å
C8H8C3sing1.09Å1.11Å
C9C10sing1.50Å1.51Å
C9N13sing1.47Å1.44Å
C9H9sing1.10Å1.12Å
C10O12doub1.22Å1.26Å
C10O11sing1.36Å1.26Å
O11H11sing0.98Å0.95Å
N13H13sing1.02Å1.02Å
N14C15sing1.39Å1.34Å
N14H14sing1.02Å1.02Å
C15O16doub1.23Å1.22Å
C15C17sing1.48Å1.50Å
C17C18doub1.34Å1.47ÅAromatic
C17C22sing1.37Å1.41ÅAromatic
C18C19sing1.47Å1.51Å
C18O20sing1.36Å1.35ÅAromatic
C19H191sing1.10Å1.11Å
C19H192sing1.11Å1.11Å
C19H193sing1.11Å1.12Å
O20N21sing1.39Å1.43ÅAromatic
N21C22doub1.34Å1.37ÅAromatic
C22C23sing1.44Å1.39ÅAromatic
C23C28sing1.39Å1.38ÅAromatic
C23C24doub1.39Å1.39ÅAromatic
C28C27doub1.40Å1.39ÅAromatic
C28H28sing1.09Å1.10Å
C24C25sing1.40Å1.40ÅAromatic
C24H24sing1.09Å1.10Å
C25C26doub1.40Å1.38ÅAromatic
C25H25sing1.09Å1.10Å
C26C27sing1.39Å1.39ÅAromatic
C26H26sing1.09Å1.10Å
C27H27sing1.09Å1.10Å
OXTHXTsing0.98Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OCCA124.7°125.1°
OCOXT74.4°122.9°
CACOXT61.5°112.0°
CCAN109.3°107.3°
CCACB107.3°110.6°
CCAHA108.2°110.0°
COXTHXT74.4°115.3°
NCACB115.3°111.7°
NCAHA108.2°105.3°
CANHN1142.0°119.0°
CANHN2142.0°119.0°
CBCAHA108.2°111.8°
CACBOG106.6°109.2°
CACBHBC1113.3°111.0°
CACBHBC2113.3°111.6°
HN1NHN260.4°120.7°
OGCBHBC1113.3°107.9°
OGCBHBC2113.3°108.7°
CBOGC1119.5°115.8°
HBC1CBHBC297.2°108.4°
OGC1O2119.2°125.1°
OGC1C3118.9°112.2°
O2C1C3121.9°122.7°
C1C3C4106.6°110.2°
C1C3N14105.3°112.1°
C1C3H3109.8°107.5°
C4C3N14115.3°109.9°
C4C3H3109.8°110.4°
C3C4S5114.9°110.0°
C3C4N13108.6°112.0°
C3C4H4109.0°108.3°
N14C3H3109.8°106.6°
C3N14C15122.9°122.6°
C3N14H14118.5°117.4°
S5C4N13106.2°108.2°
S5C4H4109.0°108.7°
C4S5C694.2°93.6°
N13C4H4109.0°109.6°
C4N13C9112.8°107.7°
C4N13H13111.0°107.7°
S5C6C7111.9°110.0°
S5C6C8110.1°107.9°
S5C6C9103.6°101.4°
C7C6C8108.8°110.5°
C7C6C9109.2°111.9°
C6C7H7C1111.9°110.6°
C6C7H7C2111.3°110.6°
C6C7H7C3111.3°110.6°
C8C6C9113.2°114.7°
C6C8H8C1110.1°110.6°
C6C8H8C2112.0°110.5°
C6C8H8C3112.0°110.5°
C6C9C10116.6°113.0°
C6C9N13104.0°108.2°
C6C9H9106.7°111.6°
H7C1C7H7C2111.3°108.4°
H7C1C7H7C3111.3°108.3°
H7C2C7H7C399.0°108.3°
H8C1C8H8C2112.0°108.3°
H8C1C8H8C3112.0°108.4°
H8C2C8H8C398.4°108.4°
C10C9N13115.3°107.3°
C10C9H9106.8°106.7°
C9C10O12117.5°125.0°
C9C10O11119.3°110.7°
N13C9H9106.8°109.9°
C9N13H13111.0°108.4°
O12C10O11123.2°124.3°
C10O11H11119.3°111.9°
C15N14H14118.6°119.9°
N14C15O16122.5°124.7°
N14C15C17117.5°116.1°
O16C15C17120.0°119.2°
C15C17C18119.7°124.2°
C15C17C22132.0°128.5°
C18C17C22108.2°107.3°
C17C18C19135.7°135.9°
C17C18O20105.6°107.8°
C17C22N21107.4°110.6°
C17C22C23130.2°129.1°
C19C18O20118.8°116.3°
C18C19H191135.7°111.4°
C18C19H192103.2°112.3°
C18C19H193103.2°112.3°
C18O20N21110.0°109.3°
H191C19H192103.3°107.3°
H191C19H193103.2°107.3°
H192C19H193105.2°105.7°
O20N21C22108.8°105.0°
N21C22C23122.4°120.3°
C22C23C28122.8°119.9°
C22C23C24118.7°119.9°
C28C23C24118.6°120.2°
C23C28C27119.9°119.9°
C23C28H28120.0°121.0°
C23C24C25121.6°119.9°
C23C24H24119.2°121.0°
C27C28H28120.0°119.1°
C28C27C26121.4°120.0°
C28C27H27119.3°120.0°
C25C24H24119.2°119.1°
C24C25C26119.8°120.0°
C24C25H25120.1°120.0°
C26C25H25120.1°120.0°
C25C26C27118.8°120.0°
C25C26H26120.6°119.9°
C27C26H26120.6°120.0°
C26C27H27119.3°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OCCAOXT41.4°177.7°
OCCAN154.2°35.9°
OCCACB80.1°86.1°
OCCAHA36.5°150.0°
OCOXTHXT180.0°0.0°
CCANCB121.0°121.4°
CCANHA117.7°117.2°
CCACBHA116.6°122.9°
CCANHN136.4°130.5°
CCANHN273.1°36.1°
CCACBOG154.7°58.7°
CCACBHBC129.5°60.1°
CCACBHBC280.0°178.9°
CACOXTHXT34.4°177.8°
OXTCCAN164.4°146.4°
OXTCCACB38.7°91.6°
OXTCCAHA78.0°32.3°
NCACBHA121.3°117.7°
CANHN1HN2138.1°166.4°
NCACBOG83.2°178.2°
NCACBHBC1151.6°59.4°
NCACBHBC242.0°61.6°
CBCANHN184.6°9.2°
CBCANHN2165.9°157.4°
CACBOGHBC1125.2°120.7°
CACBOGHBC2125.3°121.9°
CACBHBC1HBC2119.2°122.9°
CACBOGC1103.4°90.0°
HACANHN1154.1°112.3°
HACANHN244.6°81.1°
HACACBOG38.1°64.1°
HACACBHBC187.1°177.1°
HACACBHBC2163.3°56.0°
OGCBHBC1HBC2119.2°117.5°
CBOGC1O224.4°0.0°
CBOGC1C3153.9°179.4°
HBC1CBOGC1131.4°149.3°
HBC2CBOGC121.9°31.9°
OGC1O2C3178.3°179.4°
OGC1C3C470.9°89.1°
OGC1C3N14166.1°33.7°
OGC1C3H348.0°150.5°
O2C1C3C4107.4°90.3°
O2C1C3N1415.6°146.9°
O2C1C3H3133.7°30.0°
C1C3C4N14116.5°124.1°
C1C3C4H3118.9°118.6°
C1C3N14H3118.1°117.3°
C1C3C4S5139.2°58.7°
C1C3C4N1320.5°179.1°
C1C3C4H498.2°60.0°
C1C3N14C15137.2°87.4°
C1C3N14H1442.7°96.8°
C4C3N14H3124.6°119.7°
C3C4S5N13120.0°122.6°
C3C4S5H4122.7°118.4°
C3C4N13H4118.7°120.2°
C3C4S5C6122.2°120.9°
C3C4N13C999.0°93.2°
C3C4N13H13135.8°150.1°
C4C3N14C15105.5°149.6°
C4C3N14H1474.5°26.2°
N14C3C4S522.7°177.2°
N14C3C4N1396.0°56.8°
N14C3C4H4145.3°64.1°
C3N14C15H14180.0°175.7°
C3N14C15O161.0°0.0°
C3N14C15C17176.7°178.8°
H3C3C4S5102.0°59.9°
H3C3C4N13139.3°60.5°
H3C3C4H420.7°178.5°
H3C3N14C1519.1°29.9°
H3C3N14H14160.9°145.9°
S5C4N13H4117.3°118.4°
C4S5C6C7143.3°141.8°
C4S5C6C895.6°97.7°
C4S5C6C925.8°23.2°
S5C4N13C925.1°28.2°
S5C4N13H13100.2°88.5°
N13C4S5C62.1°1.7°
C4N13C9C644.8°48.2°
C4N13C9C10173.7°170.5°
C4N13C9H13125.2°116.2°
C4N13C9H967.9°73.8°
H4C4S5C6115.2°120.6°
H4C4N13C9142.3°146.6°
H4C4N13H1317.1°29.9°
S5C6C7C8121.9°119.0°
S5C6C7C9114.2°111.9°
S5C6C8C9115.5°112.2°
S5C6C7H7C1180.0°83.5°
S5C6C7H7C254.7°36.5°
S5C6C7H7C354.7°156.5°
S5C6C8H8C1180.0°81.4°
S5C6C8H8C254.7°158.6°
S5C6C8H8C354.7°38.6°
S5C6C9C10170.5°162.8°
S5C6C9N1342.4°44.1°
S5C6C9H970.3°77.0°
C7C6C8C9121.6°127.6°
C6C7H7C1H7C2125.3°121.4°
C6C7H7C1H7C3125.3°121.3°
C6C7H7C2H7C3117.2°121.3°
C7C6C8H8C157.1°38.8°
C7C6C8H8C268.2°81.2°
C7C6C8H8C3177.7°158.8°
C7C6C9C1070.1°80.0°
C7C6C9N13161.8°161.3°
C7C6C9H949.1°40.2°
C8C6C7H7C158.1°35.5°
C8C6C7H7C2176.6°155.5°
C8C6C7H7C367.1°84.5°
C6C8H8C1H8C2125.3°121.3°
C6C8H8C1H8C3125.3°121.3°
C6C8H8C2H8C3117.9°121.3°
C8C6C9C1051.2°46.8°
C8C6C9N1376.9°71.9°
C8C6C9H9170.4°167.0°
C9C6C7H7C165.8°164.5°
C9C6C7H7C259.4°75.4°
C9C6C7H7C3168.9°44.5°
C9C6C8H8C164.5°166.4°
C9C6C8H8C2170.2°46.4°
C9C6C8H8C360.7°73.6°
C6C9C10N13122.4°119.3°
C6C9C10H9119.2°123.0°
C6C9N13H9112.7°122.1°
C6C9C10O1285.7°87.0°
C6C9C10O1195.5°93.2°
C6C9N13H1380.5°68.0°
H7C1C7H7C2H7C3117.2°117.3°
H8C1C8H8C2H8C3117.9°117.4°
C10C9N13H9118.4°115.6°
C9C10O12O11178.8°179.8°
C9C10O11H11180.0°179.8°
C10C9N13H1348.4°54.3°
N13C9C10O12151.9°32.2°
N13C9C10O1127.0°147.6°
H9C9C10O1233.4°150.0°
H9C9C10O11145.4°29.8°
H9C9N13H13166.9°169.9°
O12C10O11H111.2°0.0°
N14C15O16C17177.7°178.8°
N14C15C17C1898.6°150.0°
N14C15C17C2279.5°30.0°
H14N14C15O16179.0°175.8°
H14N14C15C173.3°3.1°
O16C15C17C1879.2°29.0°
O16C15C17C22102.7°151.1°
C15C17C18C22178.5°179.9°
C15C17C18C190.7°0.1°
C15C17C18O20179.3°180.0°
C15C17C22N21179.0°180.0°
C15C17C22C231.8°0.0°
C17C18C19O20180.0°179.9°
C17C18C19H191180.0°95.3°
C17C18C19H19254.7°144.2°
C17C18C19H19354.7°25.2°
C17C18O20N210.6°0.1°
C18C17C22N210.7°0.0°
C18C17C22C23179.9°180.0°
C22C17C18C19179.2°180.0°
C22C17C18O200.8°0.0°
C17C22N21O200.3°0.0°
C17C22N21C23179.3°180.0°
C17C22C23C2834.4°89.9°
C17C22C23C24145.8°90.0°
C18C19H191H192125.3°123.3°
C18C19H191H193125.3°123.4°
C18C19H192H193107.9°122.8°
C19C18O20N21179.4°180.0°
O20C18C19H1910.0°84.6°
O20C18C19H192125.3°35.9°
O20C18C19H193125.3°154.9°
C18O20N21C220.2°0.0°
H191C19H192H193108.0°114.4°
O20N21C22C23179.6°180.0°
N21C22C23C28144.8°90.1°
N21C22C23C2435.1°90.0°
C22C23C28C24179.8°179.9°
C22C23C28C27179.7°180.0°
C22C23C28H280.3°0.1°
C22C23C24C25179.8°180.0°
C22C23C24H240.2°0.1°
C23C28C27H28180.0°179.9°
C28C23C24C250.0°0.0°
C28C23C24H24180.0°180.0°
C23C28C27C260.4°0.0°
C23C28C27H27179.6°180.0°
C24C23C28C270.1°0.0°
C24C23C28H28179.9°179.9°
C23C24C25H24180.0°180.0°
C23C24C25C260.2°0.0°
C23C24C25H25179.8°179.9°
C28C27C26C250.5°0.0°
C28C27C26H27180.0°180.0°
C28C27C26H26179.5°180.0°
H28C28C27C26179.6°179.9°
H28C28C27H270.4°0.1°
C24C25C26H25180.0°179.9°
C24C25C26C270.4°0.0°
C24C25C26H26179.6°180.0°
H24C24C25C26179.8°180.0°
H24C24C25H250.2°0.1°
C25C26C27H26180.0°179.9°
C25C26C27H27179.5°180.0°
H25C25C26C27179.6°179.9°
H25C25C26H260.4°0.1°
H26C26C27H270.5°0.0°

222415

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