A1LWG

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C	O	doub	1.21Å	1.25Å
CA	C	sing	1.51Å	1.52Å
CB	CA	sing	1.53Å	1.55Å
N	CA	sing	1.47Å	1.53Å
C06	N	sing	1.47Å	1.52Å
C07	C06	sing	1.53Å	1.54Å
C08	C07	sing	1.51Å	1.56Å
C09	C08	doub	1.34Å	1.40Å	Aromatic
N10	C09	sing	1.37Å	1.37Å	Aromatic
C11	N10	sing	1.38Å	1.37Å	Aromatic
C12	C11	doub	1.41Å	1.42Å	Aromatic
C13	C12	sing	1.40Å	1.41Å	Aromatic
C14	C13	doub	1.37Å	1.42Å	Aromatic
C15	C14	sing	1.39Å	1.42Å	Aromatic
C16	C15	doub	1.38Å	1.42Å	Aromatic
C08	C12	sing	1.46Å	1.42Å	Aromatic
C11	C16	sing	1.39Å	1.43Å	Aromatic
CA	H031	sing	1.09Å	1.10Å
CB	H043	sing	1.09Å	1.10Å
CB	H042	sing	1.09Å	1.10Å
CB	H041	sing	1.09Å	1.10Å
C06	H062	sing	1.09Å	1.10Å
C06	H061	sing	1.09Å	1.10Å
C07	H071	sing	1.09Å	1.10Å
C07	H072	sing	1.09Å	1.10Å
C09	H091	sing	1.08Å	1.08Å
C13	H131	sing	1.08Å	1.08Å
C14	H141	sing	1.08Å	1.08Å
C15	H151	sing	1.08Å	1.08Å
C16	H161	sing	1.08Å	1.08Å
N	H051	sing	1.01Å	1.00Å
N10	H101	sing	0.97Å	1.00Å
C	OXT	sing	1.34Å	73.98Å
OXT	H1	sing	0.97Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O	C	CA	120.6°	120.0°
O	C	OXT	129.7°	120.0°
C	CA	CB	106.7°	109.5°
C	CA	N	102.9°	109.5°
C	CA	H031	110.0°	109.5°
CA	C	OXT	47.4°	120.0°
CB	CA	N	117.6°	109.5°
CB	CA	H031	109.6°	109.4°
CA	CB	H043	109.5°	109.5°
CA	CB	H042	109.4°	109.5°
CA	CB	H041	109.5°	109.5°
CA	N	C06	116.4°	111.0°
N	CA	H031	109.8°	109.5°
CA	N	H051	107.7°	111.0°
N	C06	C07	113.8°	109.4°
N	C06	H062	108.4°	109.5°
N	C06	H061	108.4°	109.5°
C06	N	H051	107.7°	111.0°
C06	C07	C08	117.6°	109.5°
C07	C06	H062	108.4°	109.4°
C07	C06	H061	108.4°	109.4°
C06	C07	H071	107.4°	109.5°
C06	C07	H072	107.4°	109.4°
C07	C08	C09	125.2°	126.5°
C07	C08	C12	128.3°	126.5°
C08	C07	H071	107.4°	109.5°
C08	C07	H072	107.4°	109.4°
C08	C09	N10	109.0°	109.9°
C09	C08	C12	106.5°	107.0°
C08	C09	H091	125.5°	125.0°
C09	N10	C11	109.8°	109.8°
N10	C09	H091	125.5°	125.0°
C09	N10	H101	125.1°	125.1°
N10	C11	C12	107.7°	107.2°
N10	C11	C16	131.5°	133.5°
C11	N10	H101	125.1°	125.1°
C11	C12	C13	117.9°	119.9°
C11	C12	C08	107.1°	106.1°
C12	C11	C16	120.8°	119.4°
C12	C13	C14	122.7°	119.7°
C13	C12	C08	135.1°	134.0°
C12	C13	H131	118.6°	120.1°
C13	C14	C15	118.5°	120.6°
C14	C13	H131	118.7°	120.2°
C13	C14	H141	120.7°	119.7°
C14	C15	C16	120.3°	120.7°
C15	C14	H141	120.8°	119.7°
C14	C15	H151	119.9°	119.7°
C15	C16	C11	119.9°	119.7°
C16	C15	H151	119.9°	119.6°
C15	C16	H161	120.1°	120.2°
C11	C16	H161	120.0°	120.1°
H043	CB	H042	109.5°	109.5°
H043	CB	H041	109.5°	109.5°
H042	CB	H041	109.5°	109.4°
H062	C06	H061	109.5°	109.5°
H071	C07	H072	109.5°	109.5°
C	OXT	H1	90.0°	117.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O	C	CA	OXT	117.7°	179.7°
O	C	CA	CB	148.8°	120.0°
O	C	CA	N	24.4°	0.0°
O	C	CA	H031	92.5°	120.0°
O	C	OXT	H1	90.0°	0.0°
C	CA	CB	N	114.8°	120.0°
C	CA	CB	H031	119.0°	120.0°
C	CA	N	H031	117.0°	120.0°
C	CA	N	C06	171.8°	155.0°
C	CA	CB	H043	180.0°	60.0°
C	CA	CB	H042	60.0°	180.0°
C	CA	CB	H041	60.0°	60.0°
C	CA	N	H051	67.2°	81.1°
CA	C	OXT	H1	90.0°	179.7°
CB	CA	N	H031	126.1°	120.0°
CB	CA	N	C06	71.3°	85.0°
CA	CB	H043	H042	120.0°	120.0°
CA	CB	H043	H041	120.0°	120.0°
CA	CB	H042	H041	120.0°	120.0°
CB	CA	N	H051	49.7°	39.0°
CB	CA	C	OXT	93.6°	59.7°
CA	N	C06	H051	121.0°	124.0°
CA	N	C06	C07	176.0°	180.0°
N	CA	CB	H043	65.2°	60.0°
N	CA	CB	H042	174.8°	60.0°
N	CA	CB	H041	54.8°	180.0°
CA	N	C06	H062	63.3°	60.0°
CA	N	C06	H061	55.4°	60.1°
N	CA	C	OXT	142.1°	179.7°
N	C06	C07	H062	120.6°	120.0°
N	C06	C07	H061	120.7°	120.0°
N	C06	C07	C08	88.5°	180.0°
C06	N	CA	H031	54.8°	35.0°
N	C06	H062	H061	118.0°	120.0°
N	C06	C07	H071	32.7°	60.0°
N	C06	C07	H072	150.3°	60.0°
C06	C07	C08	H071	121.2°	120.1°
C06	C07	C08	H072	121.1°	120.0°
C06	C07	C08	C09	25.5°	94.7°
C06	C07	C08	C12	154.8°	85.0°
C07	C06	H062	H061	118.0°	120.0°
C06	C07	H071	H072	116.3°	120.0°
C07	C06	N	H051	55.0°	56.0°
C07	C08	C09	C12	179.7°	179.8°
C07	C08	C09	N10	179.7°	180.0°
C07	C08	C12	C11	179.7°	180.0°
C07	C08	C12	C13	0.1°	0.0°
C08	C07	C06	H062	150.8°	60.0°
C08	C07	C06	H061	32.1°	60.0°
C08	C07	H071	H072	116.3°	120.0°
C07	C08	C09	H091	0.3°	0.0°
C08	C09	N10	H091	180.0°	180.0°
C08	C09	N10	C11	0.4°	0.1°
C09	C08	C12	C11	0.5°	0.2°
C09	C08	C12	C13	179.8°	179.8°
C09	C08	C07	H071	146.7°	145.3°
C09	C08	C07	H072	95.6°	25.3°
C08	C09	N10	H101	179.6°	179.9°
C09	N10	C11	H101	180.0°	179.9°
C09	N10	C11	C12	0.0°	0.0°
N10	C09	C08	C12	0.6°	0.2°
C09	N10	C11	C16	178.9°	179.8°
N10	C11	C12	C16	179.0°	179.8°
N10	C11	C12	C13	180.0°	179.8°
N10	C11	C16	C15	179.1°	179.8°
N10	C11	C12	C08	0.3°	0.1°
C11	N10	C09	H091	179.7°	179.8°
N10	C11	C16	H161	0.9°	0.0°
C11	C12	C13	C08	179.6°	180.0°
C11	C12	C13	C14	0.5°	0.0°
C12	C11	C16	C15	2.2°	0.0°
C11	C12	C13	H131	179.5°	180.0°
C12	C11	C16	H161	177.8°	179.8°
C12	C11	N10	H101	180.0°	179.9°
C12	C13	C14	H131	180.0°	180.0°
C12	C13	C14	C15	0.9°	0.0°
C13	C12	C11	C16	1.0°	0.0°
C12	C13	C14	H141	179.0°	180.0°
C13	C14	C15	H141	180.0°	180.0°
C13	C14	C15	C16	0.2°	0.0°
C14	C13	C12	C08	179.9°	180.0°
C13	C14	C15	H151	179.8°	180.0°
C14	C15	C16	H151	180.0°	180.0°
C14	C15	C16	C11	1.7°	0.0°
C15	C14	C13	H131	179.1°	179.9°
C14	C15	C16	H161	178.3°	179.8°
C15	C16	C11	H161	180.0°	179.8°
C16	C15	C14	H141	179.8°	180.0°
C08	C12	C11	C16	178.7°	180.0°
C12	C08	C07	H071	33.6°	35.0°
C12	C08	C07	H072	84.0°	155.0°
C12	C08	C09	H091	179.5°	179.8°
C08	C12	C13	H131	0.1°	0.0°
C11	C16	C15	H151	178.3°	180.0°
C16	C11	N10	H101	1.1°	0.1°
H031	CA	CB	H043	61.0°	180.0°
H031	CA	CB	H042	59.0°	60.0°
H031	CA	CB	H041	179.0°	59.9°
H031	CA	N	H051	175.8°	158.9°
H031	CA	C	OXT	25.2°	60.3°
H043	CB	H042	H041	120.0°	120.0°
H062	C06	C07	H071	88.0°	60.0°
H062	C06	C07	H072	29.7°	180.0°
H062	C06	N	H051	175.7°	63.9°
H061	C06	C07	H071	153.3°	179.9°
H061	C06	C07	H072	89.0°	60.0°
H061	C06	N	H051	65.6°	176.0°
H091	C09	N10	H101	0.4°	0.1°
H131	C13	C14	H141	0.9°	0.0°
H141	C14	C15	H151	0.2°	0.0°
H151	C15	C16	H161	1.7°	0.2°

Release date:	2024-11-20
Definition date:	2024-01-15
Last modified:	2024-11-15
Release status:	REL
Processing site:	PDBJ
Derived from:	8X4S