1UH

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N28	C27	sing	1.47Å	1.48Å
N28	C29	sing	1.47Å	1.47Å
C26	C27	sing	1.53Å	1.54Å
C26	C25	sing	1.53Å	1.53Å
N22	C21	doub	1.31Å	1.35Å	Aromatic
N22	N23	sing	1.40Å	1.26Å	Aromatic
C29	C30	sing	1.53Å	1.53Å
C30	C25	sing	1.53Å	1.54Å
C6	C5	doub	1.39Å	1.40Å	Aromatic
C6	C4	sing	1.37Å	1.39Å	Aromatic
C21	C20	sing	1.41Å	1.38Å	Aromatic
C5	C3	sing	1.39Å	1.40Å	Aromatic
C25	N23	sing	1.46Å	1.48Å
C4	C2	doub	1.41Å	1.38Å	Aromatic
N23	C24	sing	1.35Å	1.34Å	Aromatic
C20	C24	doub	1.36Å	1.37Å	Aromatic
C20	C15	sing	1.48Å	1.50Å
C3	C10	sing	1.48Å	1.48Å
C3	C1	doub	1.41Å	1.40Å	Aromatic
C14	C10	doub	1.36Å	1.38Å	Aromatic
C14	C13	sing	1.46Å	1.37Å	Aromatic
C2	C1	sing	1.40Å	1.39Å	Aromatic
C2	C7	sing	1.45Å	1.39Å	Aromatic
C10	O11	sing	1.35Å	1.22Å	Aromatic
C1	S9	sing	1.76Å	1.62Å	Aromatic
C13	C15	doub	1.41Å	1.40Å	Aromatic
C13	C12	sing	1.41Å	1.37Å	Aromatic
C15	C16	sing	1.39Å	1.40Å	Aromatic
C7	C8	doub	1.32Å	1.38Å	Aromatic
O11	C12	sing	1.35Å	1.22Å	Aromatic
C12	C18	doub	1.40Å	1.37Å	Aromatic
C16	N17	doub	1.32Å	1.39Å	Aromatic
S9	C8	sing	1.75Å	1.60Å	Aromatic
C18	N17	sing	1.32Å	1.38Å	Aromatic
C18	N19	sing	1.39Å	1.41Å
N19	H1	sing	0.97Å	1.00Å
N19	H2	sing	0.97Å	1.00Å
C16	H3	sing	1.08Å	1.08Å
C14	H4	sing	1.08Å	1.08Å
C5	H5	sing	1.08Å	1.08Å
C6	H6	sing	1.08Å	1.08Å
C4	H7	sing	1.08Å	1.08Å
C8	H8	sing	1.08Å	1.08Å
C7	H9	sing	1.08Å	1.08Å
C24	H10	sing	1.08Å	1.08Å
C21	H11	sing	1.08Å	1.08Å
C25	H12	sing	1.09Å	1.10Å
C30	H13	sing	1.09Å	1.10Å
C30	H14	sing	1.09Å	1.10Å
C29	H15	sing	1.09Å	1.10Å
C29	H16	sing	1.09Å	1.10Å
N28	H17	sing	1.01Å	1.00Å
C27	H19	sing	1.09Å	1.10Å
C27	H20	sing	1.09Å	1.10Å
C26	H21	sing	1.09Å	1.10Å
C26	H22	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C27	N28	C29	116.4°	111.2°
N28	C27	C26	112.4°	109.6°
C27	N28	H17	107.7°	111.0°
N28	C27	H19	108.7°	109.5°
N28	C27	H20	108.8°	109.5°
N28	C29	C30	110.9°	109.5°
N28	C29	H15	109.1°	109.5°
N28	C29	H16	109.1°	109.5°
C29	N28	H17	107.7°	111.0°
C27	C26	C25	109.2°	109.2°
C26	C27	H19	108.8°	109.4°
C26	C27	H20	108.7°	109.4°
C27	C26	H21	109.6°	109.5°
C27	C26	H22	109.5°	109.5°
C26	C25	C30	109.0°	109.3°
C26	C25	N23	113.5°	109.5°
C26	C25	H12	108.0°	109.5°
C25	C26	H21	109.5°	109.4°
C25	C26	H22	109.5°	109.6°
C21	N22	N23	108.2°	108.6°
N22	C21	C20	109.1°	108.1°
N22	C21	H11	125.4°	126.0°
N22	N23	C25	126.6°	125.9°
N22	N23	C24	110.9°	108.2°
C29	C30	C25	111.2°	109.2°
C29	C30	H13	109.0°	109.5°
C29	C30	H14	109.0°	109.5°
C30	C29	H15	109.1°	109.5°
C30	C29	H16	109.1°	109.4°
C30	C25	N23	109.5°	109.5°
C30	C25	H12	107.9°	109.5°
C25	C30	H13	109.0°	109.5°
C25	C30	H14	109.1°	109.5°
C5	C6	C4	120.5°	120.6°
C6	C5	C3	120.7°	120.0°
C6	C5	H5	119.6°	120.0°
C5	C6	H6	119.7°	119.7°
C6	C4	C2	118.9°	120.6°
C4	C6	H6	119.8°	119.7°
C6	C4	H7	120.6°	119.7°
C21	C20	C24	103.4°	107.6°
C21	C20	C15	130.5°	126.2°
C20	C21	H11	125.4°	126.0°
C5	C3	C10	121.2°	120.0°
C5	C3	C1	117.9°	120.0°
C3	C5	H5	119.7°	120.0°
C25	N23	C24	122.5°	125.9°
N23	C25	H12	108.7°	109.5°
C4	C2	C1	120.7°	118.9°
C4	C2	C7	127.7°	129.2°
C2	C4	H7	120.6°	119.7°
N23	C24	C20	108.4°	107.6°
N23	C24	H10	125.8°	126.2°
C24	C20	C15	126.1°	126.2°
C20	C24	H10	125.8°	126.2°
C20	C15	C13	126.0°	120.8°
C20	C15	C16	118.7°	120.7°
C10	C3	C1	120.8°	120.0°
C3	C10	C14	129.5°	125.1°
C3	C10	O11	123.0°	125.1°
C3	C1	C2	121.2°	119.8°
C3	C1	S9	129.9°	130.5°
C10	C14	C13	107.4°	106.1°
C14	C10	O11	107.5°	109.8°
C10	C14	H4	126.3°	127.0°
C14	C13	C15	136.9°	135.3°
C14	C13	C12	100.3°	105.9°
C13	C14	H4	126.3°	126.9°
C1	C2	C7	111.6°	111.8°
C2	C1	S9	108.9°	109.7°
C2	C7	C8	112.0°	114.9°
C2	C7	H9	124.0°	122.5°
C10	O11	C12	112.1°	110.8°
C1	S9	C8	97.5°	92.2°
C15	C13	C12	122.8°	118.8°
C13	C15	C16	115.4°	118.5°
C13	C12	O11	112.7°	107.4°
C13	C12	C18	121.3°	118.5°
C15	C16	N17	121.5°	120.9°
C15	C16	H3	119.2°	119.5°
C7	C8	S9	110.0°	111.4°
C7	C8	H8	125.0°	124.3°
C8	C7	H9	124.0°	122.6°
O11	C12	C18	125.9°	134.0°
C12	C18	N17	117.6°	120.6°
C12	C18	N19	120.6°	119.7°
C16	N17	C18	121.4°	122.7°
N17	C16	H3	119.3°	119.6°
S9	C8	H8	125.0°	124.3°
N17	C18	N19	121.8°	119.7°
C18	N19	H1	109.5°	120.0°
C18	N19	H2	109.5°	119.9°
H1	N19	H2	109.5°	120.1°
H13	C30	H14	109.5°	109.5°
H15	C29	H16	109.5°	109.4°
H19	C27	H20	109.5°	109.4°
H21	C26	H22	109.5°	109.6°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C27	N28	C29	H17	121.0°	124.1°
N28	C27	C26	H19	120.4°	120.1°
N28	C27	C26	H20	120.5°	120.1°
N28	C27	C26	C25	54.3°	59.1°
C27	N28	C29	C30	48.8°	61.8°
C27	N28	C29	H15	169.0°	58.3°
C27	N28	C29	H16	71.5°	178.3°
N28	C27	H19	H20	118.7°	120.0°
N28	C27	C26	H21	174.2°	60.7°
N28	C27	C26	H22	65.6°	179.1°
C29	N28	C27	C26	50.2°	61.7°
N28	C29	C30	H15	120.2°	120.1°
N28	C29	C30	H16	120.2°	120.0°
N28	C29	C30	C25	53.0°	59.2°
N28	C29	C30	H13	67.2°	179.1°
N28	C29	C30	H14	173.3°	60.7°
N28	C29	H15	H16	119.3°	120.0°
C29	N28	C27	H19	70.2°	58.2°
C29	N28	C27	H20	170.7°	178.2°
C27	C26	C25	H21	120.0°	119.8°
C27	C26	C25	H22	119.9°	120.0°
C27	C26	C25	C30	59.3°	57.5°
C27	C26	C25	N23	178.3°	177.5°
C27	C26	C25	H12	57.7°	62.4°
C26	C27	N28	H17	70.8°	62.3°
C26	C27	H19	H20	118.7°	119.9°
C27	C26	H21	H22	120.1°	120.1°
C26	C25	N23	N22	20.1°	145.1°
C26	C25	C30	C29	59.8°	57.6°
C26	C25	C30	N23	124.7°	120.0°
C26	C25	C30	H12	117.1°	120.0°
C26	C25	N23	H12	120.3°	120.1°
C26	C25	N23	C24	159.8°	34.9°
C26	C25	C30	H13	60.5°	177.6°
C26	C25	C30	H14	180.0°	62.3°
C25	C26	C27	H19	66.1°	61.0°
C25	C26	C27	H20	174.8°	179.1°
C25	C26	H21	H22	120.1°	120.2°
N22	C21	C20	H11	180.0°	179.6°
C21	N22	N23	C25	179.9°	179.8°
C21	N22	N23	C24	0.0°	0.2°
N22	C21	C20	C24	0.2°	0.4°
N22	C21	C20	C15	179.5°	179.8°
N22	N23	C25	C30	102.0°	95.1°
N23	N22	C21	C20	0.1°	0.4°
N22	N23	C25	C24	179.9°	180.0°
N22	N23	C24	C20	0.2°	0.0°
N22	N23	C24	H10	179.8°	180.0°
N23	N22	C21	H11	179.9°	180.0°
N22	N23	C25	H12	140.3°	25.0°
C29	C30	C25	H13	120.3°	119.9°
C29	C30	C25	H14	120.3°	119.9°
C29	C30	C25	N23	175.5°	177.6°
C29	C30	C25	H12	57.3°	62.4°
C29	C30	H13	H14	119.2°	120.1°
C30	C29	H15	H16	119.3°	119.9°
C30	C29	N28	H17	72.3°	62.3°
C30	C25	N23	H12	117.7°	120.1°
C30	C25	N23	C24	78.1°	84.9°
C25	C30	H13	H14	119.2°	120.1°
C25	C30	C29	H15	173.3°	60.9°
C25	C30	C29	H16	67.2°	179.2°
C30	C25	C26	H21	179.3°	62.3°
C30	C25	C26	H22	60.6°	177.5°
C5	C6	C4	H6	180.0°	179.9°
C6	C5	C3	H5	180.0°	180.0°
C5	C6	C4	C2	0.0°	0.1°
C6	C5	C3	C10	179.0°	180.0°
C6	C5	C3	C1	1.3°	0.3°
C5	C6	C4	H7	180.0°	180.0°
C4	C6	C5	C3	0.6°	0.0°
C6	C4	C2	H7	180.0°	179.9°
C6	C4	C2	C1	0.1°	0.2°
C6	C4	C2	C7	179.9°	179.4°
C4	C6	C5	H5	179.4°	180.0°
C21	C20	C24	N23	0.2°	0.3°
C21	C20	C24	C15	179.3°	179.8°
C21	C20	C15	C13	12.1°	50.9°
C21	C20	C15	C16	167.6°	129.7°
C21	C20	C24	H10	179.8°	179.8°
C5	C3	C10	C1	177.6°	179.7°
C5	C3	C10	C14	7.1°	49.7°
C5	C3	C1	C2	1.4°	0.6°
C5	C3	C10	O11	170.7°	130.4°
C5	C3	C1	S9	179.6°	179.8°
C3	C5	C6	H6	179.4°	179.9°
C25	N23	C24	C20	179.7°	180.0°
C25	N23	C24	H10	0.3°	0.0°
N23	C25	C30	H13	64.2°	62.5°
N23	C25	C30	H14	55.2°	57.7°
N23	C25	C26	H21	58.4°	57.6°
N23	C25	C26	H22	61.7°	62.5°
C4	C2	C1	C3	0.9°	0.5°
C4	C2	C1	C7	179.8°	179.3°
C4	C2	C1	S9	179.9°	179.7°
C4	C2	C7	C8	179.8°	179.7°
C2	C4	C6	H6	180.0°	180.0°
C4	C2	C7	H9	0.2°	0.6°
N23	C24	C20	H10	180.0°	180.0°
N23	C24	C20	C15	179.5°	180.0°
C24	N23	C25	H12	39.6°	155.0°
C24	C20	C15	C13	168.8°	129.4°
C24	C20	C15	C16	11.5°	50.0°
C24	C20	C21	H11	179.8°	180.0°
C20	C15	C13	C14	0.4°	0.6°
C20	C15	C13	C16	179.7°	179.4°
C20	C15	C13	C12	179.7°	179.7°
C20	C15	C16	N17	179.6°	180.0°
C20	C15	C16	H3	0.4°	0.0°
C15	C20	C24	H10	0.5°	0.0°
C15	C20	C21	H11	0.6°	0.2°
C3	C10	C14	O11	178.1°	180.0°
C3	C10	C14	C13	178.6°	180.0°
C10	C3	C1	C2	179.1°	179.7°
C10	C3	C1	S9	1.9°	0.1°
C3	C10	O11	C12	178.8°	180.0°
C3	C10	C14	H4	1.4°	0.1°
C10	C3	C5	H5	1.0°	0.0°
C1	C3	C10	C14	175.2°	130.0°
C3	C1	C2	S9	179.2°	179.7°
C3	C1	C2	C7	179.3°	179.8°
C1	C3	C10	O11	6.9°	50.0°
C3	C1	S9	C8	179.2°	179.9°
C1	C3	C5	H5	178.7°	179.7°
C10	C14	C13	H4	180.0°	180.0°
C10	C14	C13	C15	179.6°	179.3°
C10	C14	C13	C12	0.3°	0.1°
C14	C10	O11	C12	0.5°	0.0°
C13	C14	C10	O11	0.5°	0.0°
C14	C13	C15	C12	179.9°	179.2°
C14	C13	C15	C16	179.9°	180.0°
C14	C13	C12	O11	0.0°	0.1°
C14	C13	C12	C18	179.9°	180.0°
C1	C2	C7	C8	0.0°	0.5°
C2	C1	S9	C8	0.1°	0.2°
C1	C2	C4	H7	179.9°	179.7°
C1	C2	C7	H9	180.0°	179.8°
C7	C2	C1	S9	0.1°	0.4°
C2	C7	C8	H9	180.0°	179.7°
C2	C7	C8	S9	0.1°	0.3°
C7	C2	C4	H7	0.1°	0.5°
C2	C7	C8	H8	179.9°	179.8°
C10	O11	C12	C13	0.3°	0.0°
C10	O11	C12	C18	179.8°	180.0°
O11	C10	C14	H4	179.5°	180.0°
C1	S9	C8	C7	0.2°	0.0°
C1	S9	C8	H8	179.9°	180.0°
C15	C13	C12	O11	179.9°	179.5°
C15	C13	C12	C18	0.2°	0.6°
C13	C15	C16	N17	0.2°	0.6°
C13	C15	C16	H3	179.8°	179.4°
C15	C13	C14	H4	0.4°	0.7°
C12	C13	C15	C16	0.0°	0.8°
C13	C12	O11	C18	179.9°	180.0°
C13	C12	C18	N17	0.2°	0.0°
C13	C12	C18	N19	180.0°	179.7°
C12	C13	C14	H4	179.7°	180.0°
C15	C16	N17	H3	180.0°	180.0°
C15	C16	N17	C18	0.1°	0.0°
C7	C8	S9	H8	180.0°	180.0°
O11	C12	C18	N17	179.9°	180.0°
O11	C12	C18	N19	0.1°	0.3°
C12	C18	N17	C16	0.1°	0.2°
C12	C18	N17	N19	179.8°	179.7°
C12	C18	N19	H1	179.8°	179.8°
C12	C18	N19	H2	59.7°	0.0°
C16	N17	C18	N19	179.9°	180.0°
S9	C8	C7	H9	179.9°	180.0°
N17	C18	N19	H1	0.0°	0.0°
N17	C18	N19	H2	120.0°	179.7°
C18	N17	C16	H3	179.9°	179.9°
C18	N19	H1	H2	120.0°	179.8°
H5	C5	C6	H6	0.6°	0.1°
H6	C6	C4	H7	0.0°	0.1°
H8	C8	C7	H9	0.1°	0.0°
H12	C25	C30	H13	177.6°	57.6°
H12	C25	C30	H14	62.9°	177.7°
H12	C25	C26	H21	62.2°	177.7°
H12	C25	C26	H22	177.7°	57.6°
H13	C30	C29	H15	53.0°	59.1°
H13	C30	C29	H16	172.6°	60.8°
H14	C30	C29	H15	66.5°	179.2°
H14	C30	C29	H16	53.1°	59.3°
H15	C29	N28	H17	47.9°	177.6°
H16	C29	N28	H17	167.5°	57.7°
H17	N28	C27	H19	168.7°	177.7°
H17	N28	C27	H20	49.6°	57.7°
H19	C27	C26	H21	53.8°	179.2°
H19	C27	C26	H22	173.9°	59.1°
H20	C27	C26	H21	65.3°	59.3°
H20	C27	C26	H22	54.8°	60.8°

Release date:	2013-06-19
Definition date:	2013-06-07
Last modified:	2013-06-14
Release status:	REL
Processing site:	RCSB
Derived from:	4L3P