PRJ

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O	C	doub	1.21Å	1.23Å
CA	N	sing	1.48Å	1.42Å
CD	N	sing	1.48Å	1.43Å
N	H	sing	1.01Å	1.00Å
C	CA	sing	1.51Å	1.44Å
CB	CA	sing	1.54Å	1.55Å
CA	HA	sing	1.09Å	1.10Å
CB	CG	sing	1.55Å	1.52Å
CB	HB2	sing	1.09Å	1.10Å
CB	HB3	sing	1.09Å	1.10Å
C11	CG	sing	1.53Å	1.52Å
CG	CD	sing	1.54Å	1.56Å
CG	HG2	sing	1.09Å	1.10Å
C12	C11	sing	1.53Å	1.59Å
C11	H11	sing	1.09Å	1.10Å
C11	H11A	sing	1.09Å	1.10Å
C12	C13	sing	1.53Å	1.54Å
C12	H12	sing	1.09Å	1.10Å
C12	H12A	sing	1.09Å	1.10Å
C13	O2	sing	1.43Å	1.42Å
C13	C14	sing	1.53Å	1.58Å
C13	H13	sing	1.09Å	1.10Å
C14	CD	sing	1.51Å	1.62Å
C14	H14	sing	1.09Å	1.10Å
C14	H14A	sing	1.09Å	1.10Å
CD	HD2	sing	1.09Å	1.10Å
O2	HO2	sing	0.97Å	0.95Å
C	OXT	sing	1.34Å	29.15Å
OXT	HXT	sing	0.97Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O	C	CA	117.2°	120.0°
O	C	OXT	69.8°	120.0°
CA	N	CD	107.0°	105.0°
CA	N	H	110.3°	111.0°
N	CA	C	124.2°	109.9°
N	CA	CB	105.1°	107.1°
N	CA	HA	104.9°	109.9°
CD	N	H	110.3°	111.1°
N	CD	CG	108.4°	104.1°
N	CD	C14	108.3°	112.9°
N	CD	HD2	109.9°	108.3°
C	CA	CB	116.0°	109.9°
C	CA	HA	90.0°	109.9°
CA	C	OXT	160.5°	120.0°
CB	CA	HA	115.8°	110.1°
CA	CB	CG	107.7°	104.9°
CA	CB	HB2	110.0°	110.4°
CA	CB	HB3	110.1°	110.4°
CG	CB	HB2	110.1°	110.3°
CG	CB	HB3	110.1°	110.4°
CB	CG	C11	114.8°	106.6°
CB	CG	CD	94.3°	101.7°
CB	CG	HG2	121.0°	112.3°
HB2	CB	HB3	108.9°	110.3°
C11	CG	CD	121.6°	110.7°
C11	CG	HG2	93.3°	112.6°
CG	C11	C12	112.1°	110.8°
CG	C11	H11	108.6°	109.2°
CG	C11	H11A	108.6°	109.3°
CD	CG	HG2	114.1°	112.2°
CG	CD	C14	106.0°	113.3°
CG	CD	HD2	112.0°	109.1°
C12	C11	H11	108.6°	109.2°
C12	C11	H11A	108.6°	109.1°
C11	C12	C13	107.1°	108.5°
C11	C12	H12	110.3°	109.6°
C11	C12	H12A	110.3°	109.6°
H11	C11	H11A	110.3°	109.2°
C13	C12	H12	110.3°	109.7°
C13	C12	H12A	110.2°	109.6°
C12	C13	O2	115.0°	109.7°
C12	C13	C14	114.7°	108.3°
C12	C13	H13	102.9°	109.7°
H12	C12	H12A	108.7°	109.8°
O2	C13	C14	113.9°	109.7°
O2	C13	H13	104.0°	109.7°
C13	O2	HO2	109.5°	114.0°
C14	C13	H13	104.5°	109.7°
C13	C14	CD	110.5°	111.4°
C13	C14	H14	109.1°	109.1°
C13	C14	H14A	109.1°	109.1°
CD	C14	H14	109.1°	109.1°
CD	C14	H14A	109.1°	109.1°
C14	CD	HD2	112.0°	109.1°
H14	C14	H14A	109.8°	109.0°
C	OXT	HXT	90.0°	117.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O	C	CA	N	43.3°	18.6°
O	C	CA	OXT	106.7°	180.0°
O	C	CA	CB	89.7°	99.0°
O	C	CA	HA	151.4°	139.7°
O	C	OXT	HXT	90.0°	0.0°
CA	N	CD	H	120.0°	120.1°
N	CA	C	CB	133.0°	117.6°
N	CA	C	HA	108.1°	121.1°
N	CA	CB	HA	115.2°	119.5°
N	CA	CB	CG	19.0°	0.4°
N	CA	CB	HB2	101.0°	119.3°
N	CA	CB	HB3	139.1°	118.5°
CA	N	CD	CG	32.9°	40.6°
CA	N	CD	C14	81.7°	163.8°
CA	N	CD	HD2	155.6°	75.3°
N	CA	C	OXT	150.0°	161.5°
CD	N	CA	C	128.7°	144.1°
CD	N	CA	CB	8.4°	24.7°
CD	N	CA	HA	130.9°	94.8°
N	CD	CG	CB	41.2°	39.7°
N	CD	CG	C11	163.8°	73.3°
N	CD	CG	C14	116.1°	122.9°
N	CD	CG	HD2	121.4°	115.4°
N	CD	CG	HG2	85.7°	160.0°
N	CD	C14	C13	165.5°	65.2°
N	CD	C14	HD2	121.4°	120.4°
N	CD	C14	H14	45.5°	55.4°
N	CD	C14	H14A	74.5°	174.3°
H	N	CA	C	111.4°	95.8°
H	N	CA	CB	111.5°	144.9°
H	N	CA	HA	11.0°	25.3°
H	N	CD	CG	87.1°	160.7°
H	N	CD	C14	158.3°	76.1°
H	N	CD	HD2	35.6°	44.7°
C	CA	CB	HA	103.6°	121.2°
C	CA	CB	CG	160.2°	118.9°
C	CA	CB	HB2	40.2°	0.1°
C	CA	CB	HB3	79.8°	122.1°
CA	C	OXT	HXT	90.0°	180.0°
CA	CB	CG	HB2	120.0°	118.8°
CA	CB	CG	HB3	120.0°	118.9°
CA	CB	HB2	HB3	120.7°	122.3°
CA	CB	CG	C11	162.4°	92.1°
CA	CB	CG	CD	34.7°	24.0°
CA	CB	CG	HG2	86.9°	144.2°
CB	CA	C	OXT	17.0°	80.9°
HA	CA	CB	CG	96.2°	119.9°
HA	CA	CB	HB2	143.8°	121.3°
HA	CA	CB	HB3	23.9°	1.0°
HA	CA	C	OXT	101.9°	40.4°
CG	CB	HB2	HB3	120.7°	122.3°
CB	CG	C11	CD	112.3°	109.9°
CB	CG	C11	HG2	126.6°	123.6°
CB	CG	CD	HG2	126.9°	120.3°
CB	CG	C11	C12	62.7°	164.1°
CB	CG	C11	H11	57.3°	43.8°
CB	CG	C11	H11A	177.2°	75.6°
CB	CG	CD	C14	74.9°	162.7°
CB	CG	CD	HD2	162.6°	75.7°
HB2	CB	CG	C11	42.4°	26.8°
HB2	CB	CG	CD	85.3°	142.8°
HB2	CB	CG	HG2	153.1°	97.0°
HB3	CB	CG	C11	77.6°	149.0°
HB3	CB	CG	CD	154.7°	94.9°
HB3	CB	CG	HG2	33.1°	25.3°
C11	CG	CD	HG2	110.5°	126.7°
CG	C11	C12	H11	120.0°	120.4°
CG	C11	C12	H11A	120.0°	120.3°
CG	C11	H11	H11A	118.9°	119.4°
CG	C11	C12	C13	49.7°	62.1°
CG	C11	C12	H12	70.3°	178.1°
CG	C11	C12	H12A	169.7°	57.6°
C11	CG	CD	C14	47.7°	49.6°
C11	CG	CD	HD2	74.8°	171.3°
CD	CG	C11	C12	49.6°	54.3°
CD	CG	C11	H11	169.6°	66.1°
CD	CG	C11	H11A	70.5°	174.5°
CG	CD	C14	C13	49.4°	52.7°
CG	CD	C14	HD2	122.5°	121.7°
CG	CD	C14	H14	70.6°	173.3°
CG	CD	C14	H14A	169.4°	67.8°
HG2	CG	C11	C12	170.7°	72.3°
HG2	CG	C11	H11	69.3°	167.4°
HG2	CG	C11	H11A	50.7°	48.0°
HG2	CG	CD	C14	158.2°	77.1°
HG2	CG	CD	HD2	35.7°	44.6°
C12	C11	H11	H11A	118.9°	119.2°
C11	C12	C13	H12	120.0°	119.8°
C11	C12	C13	H12A	120.0°	119.7°
C11	C12	H12	H12A	120.9°	120.5°
C11	C12	C13	O2	75.7°	176.8°
C11	C12	C13	C14	59.1°	63.5°
C11	C12	C13	H13	171.9°	56.3°
H11	C11	C12	C13	169.7°	58.3°
H11	C11	C12	H12	49.7°	61.5°
H11	C11	C12	H12A	70.3°	177.9°
H11A	C11	C12	C13	70.3°	177.6°
H11A	C11	C12	H12	169.6°	57.8°
H11A	C11	C12	H12A	49.7°	62.8°
C13	C12	H12	H12A	120.9°	120.4°
C12	C13	O2	C14	135.2°	118.9°
C12	C13	O2	H13	111.7°	120.6°
C12	C13	C14	H13	111.8°	119.7°
C12	C13	C14	CD	61.7°	59.1°
C12	C13	C14	H14	58.3°	179.6°
C12	C13	C14	H14A	178.3°	61.4°
C12	C13	O2	HO2	180.0°	60.0°
H12	C12	C13	O2	164.2°	57.1°
H12	C12	C13	C14	60.9°	176.8°
H12	C12	C13	H13	51.9°	63.5°
H12A	C12	C13	O2	44.3°	63.5°
H12A	C12	C13	C14	179.1°	56.2°
H12A	C12	C13	H13	68.1°	175.9°
O2	C13	C14	H13	112.7°	120.6°
O2	C13	C14	CD	73.7°	178.8°
O2	C13	C14	H14	166.3°	60.6°
O2	C13	C14	H14A	46.3°	58.3°
C13	C14	CD	H14	120.0°	120.6°
C13	C14	CD	H14A	120.0°	120.5°
C13	C14	H14	H14A	119.6°	119.0°
C13	C14	CD	HD2	73.1°	174.4°
C14	C13	O2	HO2	44.8°	178.8°
H13	C13	C14	CD	173.6°	60.6°
H13	C13	C14	H14	53.6°	59.9°
H13	C13	C14	H14A	66.4°	178.9°
H13	C13	O2	HO2	68.3°	60.6°
CD	C14	H14	H14A	119.6°	119.0°
H14	C14	CD	HD2	166.9°	65.0°
H14A	C14	CD	HD2	46.9°	53.9°

Definition date:	2010-11-05
Last modified:	2023-11-03
Release status:	REL
Processing site:	RCSB
Derived from:	1A2C