FHV

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C01	C02	sing	1.51Å	1.48Å
C02	C03	sing	1.38Å	1.39Å	Aromatic
C02	C15	doub	1.38Å	1.42Å	Aromatic
C03	C04	doub	1.38Å	1.35Å	Aromatic
C04	C05	sing	1.38Å	1.46Å	Aromatic
C05	C06	doub	1.39Å	1.37Å	Aromatic
C06	N07	sing	1.40Å	1.49Å
C06	C15	sing	1.39Å	1.40Å	Aromatic
N07	C08	sing	1.35Å	1.45Å
C08	O09	doub	1.22Å	1.27Å
C08	N10	sing	1.35Å	1.51Å
N10	C11	sing	1.47Å	1.41Å
N10	C14	sing	1.47Å	1.46Å
C11	C12	sing	1.54Å	1.50Å
C12	C13	sing	1.55Å	1.49Å
C13	C14	sing	1.55Å	1.45Å
C01	H011	sing	1.09Å	1.10Å
C01	H012	sing	1.09Å	1.10Å
C01	H013	sing	1.09Å	1.10Å
C03	H03	sing	1.08Å	1.08Å
C15	H15	sing	1.08Å	1.08Å
C04	H04	sing	1.08Å	1.08Å
C05	H05	sing	1.08Å	1.08Å
N07	H07	sing	0.97Å	1.00Å
C11	H111	sing	1.09Å	1.10Å
C11	H112	sing	1.09Å	1.10Å
C14	H141	sing	1.09Å	1.10Å
C14	H142	sing	1.09Å	1.10Å
C12	H121	sing	1.09Å	1.10Å
C12	H122	sing	1.09Å	1.10Å
C13	H131	sing	1.09Å	1.10Å
C13	H132	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C01	C02	C03	118.7°	120.0°
C01	C02	C15	118.6°	119.9°
C02	C01	H011	109.5°	109.5°
C02	C01	H012	109.4°	109.5°
C02	C01	H013	109.5°	109.5°
C03	C02	C15	122.7°	120.1°
C02	C03	C04	118.5°	120.1°
C02	C03	H03	120.7°	120.0°
C02	C15	C06	119.3°	119.9°
C02	C15	H15	120.3°	120.0°
C03	C04	C05	119.5°	120.1°
C04	C03	H03	120.8°	119.9°
C03	C04	H04	120.2°	120.0°
C04	C05	C06	122.2°	119.9°
C05	C04	H04	120.3°	119.9°
C04	C05	H05	118.9°	120.0°
C05	C06	N07	123.1°	120.0°
C05	C06	C15	117.9°	119.9°
C06	C05	H05	118.9°	120.1°
N07	C06	C15	119.0°	120.1°
C06	N07	C08	124.4°	120.0°
C06	N07	H07	117.8°	120.0°
C06	C15	H15	120.4°	120.1°
N07	C08	O09	121.9°	120.0°
N07	C08	N10	122.1°	120.0°
C08	N07	H07	117.8°	119.9°
O09	C08	N10	116.0°	120.0°
C08	N10	C11	123.5°	125.6°
C08	N10	C14	127.1°	125.7°
C11	N10	C14	109.4°	108.7°
N10	C11	C12	107.4°	107.3°
N10	C11	H111	110.0°	109.9°
N10	C11	H112	110.0°	109.9°
N10	C14	C13	107.5°	104.7°
N10	C14	H141	109.9°	110.4°
N10	C14	H142	109.9°	110.3°
C11	C12	C13	106.6°	102.9°
C12	C11	H111	110.0°	109.9°
C12	C11	H112	110.0°	109.9°
C11	C12	H121	110.2°	110.7°
C11	C12	H122	110.2°	110.7°
C12	C13	C14	106.0°	101.5°
C13	C12	H121	110.2°	110.7°
C13	C12	H122	110.2°	110.7°
C12	C13	H131	110.3°	111.0°
C12	C13	H132	110.3°	111.0°
C13	C14	H141	110.0°	110.5°
C13	C14	H142	110.0°	110.4°
C14	C13	H131	110.3°	111.2°
C14	C13	H132	110.4°	110.9°
H011	C01	H012	109.5°	109.5°
H011	C01	H013	109.4°	109.4°
H012	C01	H013	109.5°	109.4°
H111	C11	H112	109.5°	110.0°
H141	C14	H142	109.5°	110.4°
H121	C12	H122	109.5°	110.8°
H131	C13	H132	109.5°	110.9°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C01	C02	C03	C15	179.4°	179.7°
C01	C02	C03	C04	179.8°	180.0°
C01	C02	C15	C06	179.6°	179.8°
C02	C01	H011	H012	120.0°	120.1°
C02	C01	H011	H013	120.0°	120.0°
C02	C01	H012	H013	120.0°	120.0°
C01	C02	C03	H03	0.2°	0.1°
C01	C02	C15	H15	0.4°	0.1°
C02	C03	C04	H03	180.0°	179.9°
C02	C03	C04	C05	0.7°	0.0°
C03	C02	C15	C06	0.2°	0.6°
C03	C02	C01	H011	89.7°	90.0°
C03	C02	C01	H012	150.3°	149.9°
C03	C02	C01	H013	30.3°	30.0°
C03	C02	C15	H15	179.8°	179.7°
C02	C03	C04	H04	179.2°	179.9°
C15	C02	C03	C04	0.8°	0.3°
C02	C15	C06	C05	0.5°	0.5°
C02	C15	C06	N07	179.8°	179.7°
C02	C15	C06	H15	180.0°	179.7°
C15	C02	C01	H011	89.7°	90.3°
C15	C02	C01	H012	30.3°	29.7°
C15	C02	C01	H013	150.3°	149.7°
C15	C02	C03	H03	179.2°	179.8°
C03	C04	C05	H04	180.0°	179.9°
C03	C04	C05	C06	0.1°	0.0°
C03	C04	C05	H05	179.9°	180.0°
C04	C05	C06	H05	180.0°	180.0°
C04	C05	C06	N07	179.7°	180.0°
C04	C05	C06	C15	0.5°	0.3°
C05	C04	C03	H03	179.3°	180.0°
C05	C06	N07	C15	179.7°	179.7°
C05	C06	N07	C08	19.6°	33.3°
C05	C06	C15	H15	179.5°	179.8°
C06	C05	C04	H04	179.9°	179.9°
C05	C06	N07	H07	160.4°	146.8°
C06	N07	C08	H07	180.0°	180.0°
C06	N07	C08	O09	0.5°	5.3°
C06	N07	C08	N10	179.6°	174.7°
N07	C06	C15	H15	0.2°	0.1°
N07	C06	C05	H05	0.3°	0.1°
C15	C06	N07	C08	160.1°	146.4°
C15	C06	C05	H05	179.4°	179.8°
C15	C06	N07	H07	19.9°	33.5°
N07	C08	O09	N10	179.2°	180.0°
N07	C08	N10	C11	178.9°	180.0°
N07	C08	N10	C14	0.0°	0.4°
O09	C08	N10	C11	0.2°	0.0°
O09	C08	N10	C14	179.2°	179.6°
O09	C08	N07	H07	179.5°	174.6°
C08	N10	C11	C14	179.1°	179.7°
C08	N10	C11	C12	171.6°	179.0°
C08	N10	C14	C13	163.9°	155.8°
N10	C08	N07	H07	0.4°	5.4°
C08	N10	C11	H111	52.0°	59.5°
C08	N10	C11	H112	68.7°	61.5°
C08	N10	C14	H141	76.4°	85.2°
C08	N10	C14	H142	44.2°	37.1°
N10	C11	C12	H111	119.7°	119.4°
N10	C11	C12	H112	119.7°	119.4°
N10	C11	C12	C13	1.7°	22.2°
C11	N10	C14	C13	17.0°	24.5°
N10	C11	H111	H112	121.0°	121.1°
C11	N10	C14	H141	102.7°	94.5°
C11	N10	C14	H142	136.7°	143.2°
N10	C11	C12	H121	121.3°	140.5°
N10	C11	C12	H122	117.8°	96.2°
C14	N10	C11	C12	9.2°	1.3°
N10	C14	C13	C12	17.5°	37.3°
N10	C14	C13	H141	119.7°	118.9°
N10	C14	C13	H142	119.7°	118.7°
C14	N10	C11	H111	128.9°	120.8°
C14	N10	C11	H112	110.4°	118.1°
N10	C14	H141	H142	120.9°	122.3°
N10	C14	C13	H131	102.0°	80.8°
N10	C14	C13	H132	136.9°	155.3°
C11	C12	C13	H121	119.5°	118.4°
C11	C12	C13	H122	119.6°	118.3°
C11	C12	C13	C14	11.9°	35.7°
C12	C11	H111	H112	120.9°	121.1°
C11	C12	H121	H122	121.3°	123.2°
C11	C12	C13	H131	107.6°	82.6°
C11	C12	C13	H132	131.3°	153.6°
C12	C13	C14	H131	119.5°	118.2°
C12	C13	C14	H132	119.4°	118.0°
C13	C12	C11	H111	118.0°	97.2°
C13	C12	C11	H112	121.4°	141.6°
C12	C13	C14	H141	102.2°	81.5°
C12	C13	C14	H142	137.2°	156.0°
C13	C12	H121	H122	121.3°	123.3°
C12	C13	H131	H132	121.6°	123.9°
C13	C14	H141	H142	120.9°	122.4°
C14	C13	C12	H121	131.4°	154.1°
C14	C13	C12	H122	107.7°	82.6°
C14	C13	H131	H132	121.6°	123.9°
H011	C01	H012	H013	120.0°	119.9°
H03	C03	C04	H04	0.7°	0.0°
H04	C04	C05	H05	0.1°	0.0°
H111	C11	C12	H121	1.6°	21.1°
H111	C11	C12	H122	122.5°	144.4°
H112	C11	C12	H121	119.0°	100.0°
H112	C11	C12	H122	1.9°	23.2°
H141	C14	C13	H131	138.3°	160.3°
H141	C14	C13	H132	17.2°	36.5°
H142	C14	C13	H131	17.7°	37.9°
H142	C14	C13	H132	103.4°	86.0°
H121	C12	C13	H131	12.0°	35.8°
H121	C12	C13	H132	109.1°	88.0°
H122	C12	C13	H131	132.9°	159.1°
H122	C12	C13	H132	11.8°	35.3°

Release date:	2015-05-06
Definition date:	2015-01-22
Last modified:	2015-05-01
Release status:	REL
Processing site:	EBI
Derived from:	5AFL