NVP

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N1	CA	sing	1.47Å	1.50Å
N1	C2	sing	1.39Å	1.45Å
N1	C15	sing	1.38Å	1.47Å
CA	CB	sing	1.53Å	1.48Å
CA	CC	sing	1.53Å	1.49Å
CA	HCA	sing	1.09Å	1.11Å
CB	CC	sing	1.53Å	1.49Å
CB	HCB1	sing	1.09Å	1.11Å
CB	HCB2	sing	1.09Å	1.11Å
CC	HCC1	sing	1.09Å	1.11Å
CC	HCC2	sing	1.09Å	1.11Å
N3	C4	doub	1.32Å	1.37Å	Aromatic
N3	C2	sing	1.33Å	1.36Å	Aromatic
C4	C5	sing	1.38Å	1.43Å	Aromatic
C4	HC4	sing	1.08Å	1.10Å
C5	C6	doub	1.39Å	1.40Å	Aromatic
C5	HC5	sing	1.08Å	1.10Å
C6	CD	sing	1.51Å	1.51Å
C6	C7	sing	1.39Å	1.42Å	Aromatic
CD	HCD1	sing	1.09Å	1.11Å
CD	HCD2	sing	1.09Å	1.11Å
CD	HCD3	sing	1.09Å	1.12Å
C2	C7	doub	1.39Å	1.42Å	Aromatic
C7	N8	sing	1.39Å	1.44Å
N8	C9	sing	1.32Å	1.34Å
N8	HN8	sing	0.97Å	1.02Å
C9	OE	doub	1.22Å	1.24Å
C9	C10	sing	1.46Å	1.54Å
C10	C15	doub	1.40Å	1.43Å	Aromatic
C10	C11	sing	1.40Å	1.40Å	Aromatic
C15	N14	sing	1.32Å	1.36Å	Aromatic
C11	C12	doub	1.38Å	1.41Å	Aromatic
C11	H11	sing	1.08Å	1.10Å
C12	C13	sing	1.38Å	1.41Å	Aromatic
C12	H12	sing	1.08Å	1.10Å
C13	N14	doub	1.32Å	1.36Å	Aromatic
C13	H13	sing	1.08Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CA	N1	C2	114.5°	120.3°
CA	N1	C15	115.5°	120.3°
N1	CA	CB	117.0°	117.5°
N1	CA	CC	118.0°	117.5°
N1	CA	HCA	93.0°	115.6°
C2	N1	C15	114.9°	119.4°
N1	C2	N3	119.7°	118.8°
N1	C2	C7	118.2°	120.9°
N1	C15	C10	119.0°	119.8°
N1	C15	N14	119.0°	119.9°
CB	CA	CC	60.0°	60.0°
CB	CA	HCA	135.5°	117.5°
CA	CB	CC	60.2°	60.0°
CA	CB	HCB1	134.9°	117.5°
CA	CB	HCB2	134.9°	117.5°
CC	CA	HCA	134.6°	117.5°
CA	CC	CB	59.8°	60.0°
CA	CC	HCC1	135.1°	117.5°
CA	CC	HCC2	135.1°	117.5°
CC	CB	HCB1	134.9°	117.5°
CC	CB	HCB2	134.9°	117.5°
CB	CC	HCC1	135.1°	117.5°
CB	CC	HCC2	135.1°	117.5°
HCB1	CB	HCB2	70.7°	115.6°
HCC1	CC	HCC2	70.4°	115.6°
C4	N3	C2	118.9°	121.9°
N3	C4	C5	122.5°	120.9°
N3	C4	HC4	116.6°	119.6°
N3	C2	C7	122.1°	120.2°
C5	C4	HC4	120.9°	119.5°
C4	C5	C6	118.4°	119.2°
C4	C5	HC5	121.6°	120.4°
C6	C5	HC5	119.9°	120.4°
C5	C6	CD	119.9°	120.7°
C5	C6	C7	119.3°	118.6°
CD	C6	C7	120.7°	120.7°
C6	CD	HCD1	119.9°	109.4°
C6	CD	HCD2	108.5°	109.5°
C6	CD	HCD3	108.4°	109.5°
C6	C7	C2	118.8°	119.1°
C6	C7	N8	120.4°	119.2°
HCD1	CD	HCD2	108.5°	109.4°
HCD1	CD	HCD3	108.4°	109.5°
HCD2	CD	HCD3	101.5°	109.5°
C2	C7	N8	120.8°	121.7°
C7	N8	C9	133.9°	126.6°
C7	N8	HN8	117.8°	116.8°
C9	N8	HN8	108.3°	116.6°
N8	C9	OE	120.5°	117.1°
N8	C9	C10	120.9°	125.7°
OE	C9	C10	118.6°	117.2°
C9	C10	C15	122.3°	121.2°
C9	C10	C11	119.4°	120.0°
C15	C10	C11	118.3°	118.8°
C10	C15	N14	121.9°	120.3°
C10	C11	C12	119.6°	118.4°
C10	C11	H11	119.9°	120.8°
C15	N14	C13	119.2°	121.9°
C12	C11	H11	120.5°	120.8°
C11	C12	C13	118.7°	119.5°
C11	C12	H12	120.8°	120.2°
C13	C12	H12	120.5°	120.3°
C12	C13	N14	122.2°	121.2°
C12	C13	H13	120.7°	119.4°
N14	C13	H13	117.1°	119.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CA	N1	C2	C15	137.1°	179.9°
N1	CA	CB	CC	108.3°	107.5°
N1	CA	CB	HCA	127.0°	145.0°
N1	CA	CC	HCA	127.4°	145.0°
N1	CA	CB	HCB1	126.4°	145.0°
N1	CA	CB	HCB2	17.0°	0.0°
N1	CA	CC	HCC1	18.6°	0.0°
N1	CA	CC	HCC2	128.1°	145.0°
CA	N1	C2	N3	25.7°	63.4°
CA	N1	C2	C7	151.5°	118.8°
CA	N1	C15	C10	155.1°	120.6°
CA	N1	C15	N14	22.7°	60.0°
C2	N1	CA	CB	93.4°	120.1°
C2	N1	CA	CC	162.0°	171.3°
C2	N1	CA	HCA	52.5°	25.6°
N1	C2	N3	C4	175.9°	177.0°
N1	C2	N3	C7	177.1°	177.8°
N1	C2	C7	C6	175.1°	176.2°
N1	C2	C7	N8	7.2°	5.3°
C2	N1	C15	C10	68.3°	59.3°
C2	N1	C15	N14	114.0°	120.1°
C15	N1	CA	CB	129.7°	60.1°
C15	N1	CA	CC	61.1°	8.5°
C15	N1	CA	HCA	84.4°	154.3°
C15	N1	C2	N3	111.4°	116.7°
C15	N1	C2	C7	71.4°	61.1°
N1	C15	C10	C9	0.4°	5.6°
N1	C15	C10	N14	177.7°	179.4°
N1	C15	C10	C11	177.6°	176.2°
N1	C15	N14	C13	177.5°	177.3°
CB	CA	CC	HCA	126.0°	107.5°
CA	CB	CC	HCB1	125.3°	107.4°
CA	CB	CC	HCB2	125.2°	107.4°
CA	CB	HCB1	HCB2	134.9°	145.6°
CB	CA	CC	HCC1	125.3°	107.5°
CB	CA	CC	HCC2	125.3°	107.5°
CA	CC	HCC1	HCC2	135.0°	145.7°
HCA	CA	CB	HCB1	0.6°	0.0°
HCA	CA	CB	HCB2	110.0°	145.0°
HCA	CA	CC	HCC1	108.8°	145.0°
HCA	CA	CC	HCC2	0.7°	0.0°
CC	CB	HCB1	HCB2	135.0°	145.8°
CB	CC	HCC1	HCC2	135.1°	145.7°
HCB1	CB	CC	HCC1	109.5°	145.1°
HCB1	CB	CC	HCC2	0.1°	0.1°
HCB2	CB	CC	HCC1	0.0°	0.0°
HCB2	CB	CC	HCC2	109.6°	145.1°
N3	C4	C5	HC4	180.0°	180.0°
N3	C4	C5	C6	0.3°	1.0°
N3	C4	C5	HC5	179.7°	179.0°
C4	N3	C2	C7	1.2°	0.9°
C2	N3	C4	C5	0.0°	0.4°
C2	N3	C4	HC4	180.0°	179.6°
N3	C2	C7	C6	2.0°	1.5°
N3	C2	C7	N8	175.7°	176.9°
C4	C5	C6	HC5	179.9°	180.0°
C4	C5	C6	CD	178.8°	180.0°
C4	C5	C6	C7	0.5°	0.3°
HC4	C4	C5	C6	179.6°	179.0°
HC4	C4	C5	HC5	0.3°	1.0°
C5	C6	CD	C7	179.3°	179.6°
C5	C6	CD	HCD1	179.9°	90.1°
C5	C6	CD	HCD2	54.7°	150.0°
C5	C6	CD	HCD3	54.7°	30.0°
C5	C6	C7	C2	1.7°	0.9°
C5	C6	C7	N8	176.1°	177.6°
HC5	C5	C6	CD	1.3°	0.1°
HC5	C5	C6	C7	179.4°	179.7°
C6	CD	HCD1	HCD2	125.3°	119.9°
C6	CD	HCD1	HCD3	125.2°	120.1°
C6	CD	HCD2	HCD3	114.1°	120.1°
CD	C6	C7	C2	177.6°	178.7°
CD	C6	C7	N8	4.6°	2.8°
C7	C6	CD	HCD1	0.8°	90.3°
C7	C6	CD	HCD2	124.6°	29.6°
C7	C6	CD	HCD3	126.0°	149.7°
C6	C7	C2	N8	177.7°	178.4°
C6	C7	N8	C9	143.9°	140.6°
C6	C7	N8	HN8	36.1°	39.0°
HCD1	CD	HCD2	HCD3	114.1°	120.0°
C2	C7	N8	C9	33.8°	41.0°
C2	C7	N8	HN8	146.3°	139.4°
C7	N8	C9	HN8	180.0°	179.6°
C7	N8	C9	OE	178.3°	178.3°
C7	N8	C9	C10	1.2°	1.8°
N8	C9	OE	C10	179.6°	179.9°
N8	C9	C10	C15	35.2°	39.1°
N8	C9	C10	C11	146.8°	142.8°
HN8	N8	C9	OE	1.7°	1.4°
HN8	N8	C9	C10	178.8°	178.5°
OE	C9	C10	C15	145.2°	140.8°
OE	C9	C10	C11	32.8°	37.3°
C9	C10	C15	C11	178.0°	178.2°
C9	C10	C15	N14	178.1°	175.0°
C9	C10	C11	C12	177.9°	176.1°
C9	C10	C11	H11	2.2°	3.9°
C15	C10	C11	C12	0.2°	2.1°
C15	C10	C11	H11	179.7°	178.0°
C10	C15	N14	C13	0.2°	2.1°
C11	C10	C15	N14	0.1°	3.2°
C10	C11	C12	H11	179.9°	180.0°
C10	C11	C12	C13	0.4°	0.1°
C10	C11	C12	H12	179.6°	180.0°
C15	N14	C13	C12	0.0°	0.1°
C15	N14	C13	H13	179.9°	180.0°
C11	C12	C13	H12	179.9°	179.9°
C11	C12	C13	N14	0.4°	1.2°
C11	C12	C13	H13	179.6°	178.8°
H11	C11	C12	C13	179.5°	179.9°
H11	C11	C12	H12	0.4°	0.0°
C12	C13	N14	H13	180.0°	179.9°
H12	C12	C13	N14	179.7°	178.8°
H12	C12	C13	H13	0.3°	1.1°

Definition date:	2000-08-15
Last modified:	2020-06-17
Release status:	REL
Processing site:	RCSB
Replaces:	NEV
Derived from:	1JLF