GYS

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N1	CA1	sing	1.47Å	1.45Å
N1	H	sing	1.01Å	1.00Å
N1	H2	sing	1.01Å	1.00Å
OG1	CB1	sing	1.43Å	1.49Å
OG1	HG1	sing	0.97Å	0.95Å
CB1	CA1	sing	1.53Å	1.51Å
CB1	HB11	sing	1.09Å	1.10Å
CB1	HB12	sing	1.09Å	1.10Å
CA1	C1	sing	1.51Å	1.51Å
CA1	HA1	sing	1.09Å	1.10Å
C1	N2	doub	1.30Å	1.29Å
C1	N3	sing	1.37Å	1.40Å
N2	CA2	sing	1.37Å	1.38Å
N3	C2	sing	1.35Å	1.40Å
N3	CA3	sing	1.47Å	1.48Å
C2	CA2	sing	1.47Å	1.43Å
C2	O2	doub	1.22Å	1.26Å
CA2	CB2	doub	1.38Å	1.39Å
CA3	C3	sing	1.51Å	1.48Å
CA3	HA31	sing	1.09Å	1.10Å
CA3	HA32	sing	1.09Å	1.10Å
CB2	CG2	sing	1.46Å	1.39Å
CB2	HB2	sing	1.08Å	1.08Å
CG2	CD2	doub	1.40Å	1.45Å	Aromatic
CG2	CD1	sing	1.40Å	1.45Å	Aromatic
CD1	CE1	doub	1.37Å	1.42Å	Aromatic
CD1	HD1	sing	1.08Å	1.08Å
CD2	CE2	sing	1.37Å	1.43Å	Aromatic
CD2	HD2	sing	1.08Å	1.08Å
CE1	CZ	sing	1.39Å	1.43Å	Aromatic
CE1	HE1	sing	1.08Å	1.08Å
CE2	CZ	doub	1.39Å	1.44Å	Aromatic
CE2	HE2	sing	1.08Å	1.08Å
CZ	OH	sing	1.36Å	1.34Å
OH	HOH	sing	0.97Å	0.95Å
C3	O3	doub	1.21Å	1.21Å
C3	OXT	sing	1.34Å	1.29Å
OXT	HXT	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CA1	N1	H	109.5°	111.0°
CA1	N1	H2	109.5°	111.0°
N1	CA1	CB1	111.0°	109.5°
N1	CA1	C1	108.2°	109.5°
N1	CA1	HA1	108.6°	109.5°
H	N1	H2	109.5°	111.1°
CB1	OG1	HG1	109.5°	114.0°
OG1	CB1	CA1	113.9°	109.5°
OG1	CB1	HB11	108.4°	109.4°
OG1	CB1	HB12	108.4°	109.5°
CA1	CB1	HB11	108.4°	109.5°
CA1	CB1	HB12	108.4°	109.5°
CB1	CA1	C1	113.1°	109.5°
CB1	CA1	HA1	107.9°	109.5°
HB11	CB1	HB12	109.5°	109.5°
C1	CA1	HA1	107.9°	109.4°
CA1	C1	N2	126.9°	124.3°
CA1	C1	N3	123.8°	124.4°
N2	C1	N3	109.3°	111.3°
C1	N2	CA2	108.8°	109.4°
C1	N3	C2	110.0°	108.4°
C1	N3	CA3	128.8°	125.8°
N2	CA2	C2	109.9°	105.7°
N2	CA2	CB2	129.0°	127.1°
C2	N3	CA3	121.2°	125.8°
N3	C2	CA2	102.0°	105.2°
N3	C2	O2	122.9°	127.4°
N3	CA3	C3	123.8°	109.5°
N3	CA3	HA31	105.8°	109.4°
N3	CA3	HA32	105.8°	109.5°
CA2	C2	O2	135.1°	127.4°
C2	CA2	CB2	121.1°	127.1°
CA2	CB2	CG2	131.6°	120.0°
CA2	CB2	HB2	114.3°	120.0°
C3	CA3	HA31	105.8°	109.5°
C3	CA3	HA32	105.8°	109.5°
CA3	C3	O3	120.2°	120.0°
CA3	C3	OXT	104.6°	120.0°
HA31	CA3	HA32	109.5°	109.4°
CG2	CB2	HB2	114.2°	120.0°
CB2	CG2	CD2	119.4°	120.2°
CB2	CG2	CD1	122.3°	120.1°
CD2	CG2	CD1	118.4°	119.7°
CG2	CD2	CE2	120.2°	119.9°
CG2	CD2	HD2	119.9°	120.0°
CG2	CD1	CE1	121.2°	119.9°
CG2	CD1	HD1	119.4°	120.1°
CE1	CD1	HD1	119.4°	120.0°
CD1	CE1	CZ	120.0°	120.1°
CD1	CE1	HE1	120.0°	120.0°
CE2	CD2	HD2	119.9°	120.1°
CD2	CE2	CZ	120.3°	120.2°
CD2	CE2	HE2	119.8°	120.0°
CZ	CE1	HE1	120.0°	119.9°
CE1	CZ	CE2	120.0°	120.2°
CE1	CZ	OH	120.7°	119.8°
CZ	CE2	HE2	119.9°	119.9°
CE2	CZ	OH	119.3°	119.9°
CZ	OH	HOH	109.5°	114.0°
O3	C3	OXT	126.7°	120.0°
C3	OXT	HXT	109.5°	117.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CA1	N1	H	H2	120.0°	124.0°
N1	CA1	CB1	OG1	83.8°	65.0°
N1	CA1	CB1	C1	121.8°	120.0°
N1	CA1	CB1	HA1	118.9°	120.0°
N1	CA1	CB1	HB11	155.5°	175.0°
N1	CA1	CB1	HB12	36.8°	55.0°
N1	CA1	C1	HA1	117.4°	120.0°
N1	CA1	C1	N2	121.9°	35.0°
N1	CA1	C1	N3	57.1°	144.8°
H	N1	CA1	CB1	180.0°	60.0°
H	N1	CA1	C1	55.4°	60.0°
H	N1	CA1	HA1	61.5°	179.9°
H2	N1	CA1	CB1	60.0°	64.0°
H2	N1	CA1	C1	64.6°	175.9°
H2	N1	CA1	HA1	178.5°	56.0°
OG1	CB1	CA1	HB11	120.7°	120.0°
OG1	CB1	CA1	HB12	120.7°	120.0°
OG1	CB1	HB11	HB12	118.0°	120.0°
OG1	CB1	CA1	C1	154.3°	175.0°
OG1	CB1	CA1	HA1	35.1°	55.0°
HG1	OG1	CB1	CA1	180.0°	180.0°
HG1	OG1	CB1	HB11	59.3°	60.0°
HG1	OG1	CB1	HB12	59.3°	60.0°
CA1	CB1	HB11	HB12	118.0°	120.0°
CB1	CA1	C1	HA1	119.3°	120.0°
CB1	CA1	C1	N2	1.4°	85.0°
CB1	CA1	C1	N3	179.5°	95.2°
HB11	CB1	CA1	C1	33.7°	55.0°
HB11	CB1	CA1	HA1	85.5°	65.0°
HB12	CB1	CA1	C1	85.0°	65.0°
HB12	CB1	CA1	HA1	155.8°	175.0°
CA1	C1	N2	N3	179.2°	179.8°
CA1	C1	N2	CA2	179.1°	179.9°
CA1	C1	N3	C2	179.6°	180.0°
CA1	C1	N3	CA3	0.1°	0.1°
HA1	CA1	C1	N2	120.7°	155.0°
HA1	CA1	C1	N3	60.3°	24.8°
N2	C1	N3	C2	0.4°	0.2°
N2	C1	N3	CA3	179.3°	179.7°
C1	N2	CA2	C2	0.5°	0.2°
C1	N2	CA2	CB2	179.5°	180.0°
N3	C1	N2	CA2	0.1°	0.2°
C1	N3	C2	CA3	179.7°	179.9°
C1	N3	C2	CA2	0.6°	0.1°
C1	N3	C2	O2	179.6°	180.0°
C1	N3	CA3	C3	133.4°	90.1°
C1	N3	CA3	HA31	104.6°	149.9°
C1	N3	CA3	HA32	11.5°	30.0°
N2	CA2	C2	N3	0.6°	0.0°
N2	CA2	C2	CB2	179.9°	179.8°
N2	CA2	C2	O2	179.4°	179.9°
N2	CA2	CB2	CG2	1.5°	5.2°
N2	CA2	CB2	HB2	178.5°	174.8°
N3	C2	CA2	O2	178.8°	179.9°
N3	C2	CA2	CB2	179.3°	179.8°
C2	N3	CA3	C3	46.9°	90.0°
C2	N3	CA3	HA31	75.1°	30.0°
C2	N3	CA3	HA32	168.9°	149.9°
CA3	N3	C2	CA2	179.1°	179.8°
CA3	N3	C2	O2	0.1°	0.0°
N3	CA3	C3	HA31	122.0°	120.0°
N3	CA3	C3	HA32	121.9°	120.1°
N3	CA3	HA31	HA32	113.5°	120.0°
N3	CA3	C3	O3	153.4°	0.0°
N3	CA3	C3	OXT	56.4°	180.0°
C2	CA2	CB2	CG2	178.4°	175.1°
C2	CA2	CB2	HB2	1.6°	5.0°
O2	C2	CA2	CB2	0.5°	0.0°
CA2	CB2	CG2	HB2	180.0°	180.0°
CA2	CB2	CG2	CD2	177.6°	6.0°
CA2	CB2	CG2	CD1	1.1°	173.7°
C3	CA3	HA31	HA32	113.5°	120.0°
CA3	C3	O3	OXT	143.1°	180.0°
CA3	C3	OXT	HXT	147.6°	180.0°
HA31	CA3	C3	O3	31.4°	120.0°
HA31	CA3	C3	OXT	178.4°	60.0°
HA32	CA3	C3	O3	84.7°	120.0°
HA32	CA3	C3	OXT	65.5°	59.9°
CB2	CG2	CD2	CD1	178.8°	179.7°
CB2	CG2	CD1	CE1	178.6°	180.0°
CB2	CG2	CD1	HD1	1.4°	0.1°
CB2	CG2	CD2	CE2	178.4°	180.0°
CB2	CG2	CD2	HD2	1.6°	0.0°
HB2	CB2	CG2	CD2	2.4°	174.0°
HB2	CB2	CG2	CD1	178.8°	6.3°
CD2	CG2	CD1	CE1	0.1°	0.3°
CD2	CG2	CD1	HD1	179.9°	179.8°
CG2	CD2	CE2	HD2	180.0°	180.0°
CG2	CD2	CE2	CZ	0.2°	0.0°
CG2	CD2	CE2	HE2	179.8°	180.0°
CG2	CD1	CE1	HD1	180.0°	179.9°
CD1	CG2	CD2	CE2	0.4°	0.3°
CD1	CG2	CD2	HD2	179.7°	179.7°
CG2	CD1	CE1	CZ	0.3°	0.0°
CG2	CD1	CE1	HE1	179.7°	180.0°
CD1	CE1	CZ	HE1	180.0°	180.0°
CD1	CE1	CZ	CE2	0.5°	0.3°
CD1	CE1	CZ	OH	179.8°	180.0°
HD1	CD1	CE1	CZ	179.7°	179.9°
HD1	CD1	CE1	HE1	0.3°	0.1°
CD2	CE2	CZ	CE1	0.2°	0.3°
CD2	CE2	CZ	HE2	180.0°	180.0°
CD2	CE2	CZ	OH	179.9°	180.0°
HD2	CD2	CE2	CZ	179.8°	180.0°
HD2	CD2	CE2	HE2	0.2°	0.0°
CE1	CZ	CE2	OH	179.7°	179.7°
CE1	CZ	CE2	HE2	179.8°	179.7°
CE1	CZ	OH	HOH	180.0°	90.1°
HE1	CE1	CZ	CE2	179.5°	179.7°
HE1	CE1	CZ	OH	0.1°	0.0°
CE2	CZ	OH	HOH	0.3°	89.6°
HE2	CE2	CZ	OH	0.1°	0.0°
O3	C3	OXT	HXT	0.0°	0.0°

Definition date:	2006-05-30
Last modified:	2023-11-03
Release status:	REL
Processing site:	RCSB
Replaces:	CSY