73G

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C4	C3	doub	1.38Å	1.41Å	Aromatic
C4	C5	sing	1.38Å	1.38Å	Aromatic
C3	C2	sing	1.38Å	1.41Å	Aromatic
C5	C6	doub	1.39Å	1.32Å	Aromatic
C2	C1	doub	1.39Å	1.37Å	Aromatic
C6	C1	sing	1.41Å	1.36Å	Aromatic
C6	N7	sing	1.39Å	1.35Å
C1	C9	sing	1.47Å	1.41Å
N7	CA	sing	1.46Å	1.46Å
N7	C8	sing	1.34Å	1.32Å
O12	C	sing	1.34Å	1.38Å
O12	C13	sing	1.45Å	1.42Å
CA	C	sing	1.51Å	1.51Å
O11	C9	doub	1.21Å	1.42Å
C9	C8	sing	1.50Å	1.41Å
C	O	doub	1.21Å	1.22Å
C13	C14	sing	1.53Å	1.51Å
C8	O10	doub	1.21Å	1.23Å
C14	C15	sing	1.53Å	1.52Å
C15	C16	sing	1.53Å	1.55Å
C2	H3	sing	1.08Å	1.08Å
C3	H4	sing	1.08Å	1.08Å
C4	H5	sing	1.08Å	1.08Å
C5	H6	sing	1.08Å	1.08Å
CA	H7	sing	1.09Å	1.10Å
CA	H8	sing	1.09Å	1.10Å
C13	H9	sing	1.09Å	1.10Å
C13	H10	sing	1.09Å	1.10Å
C14	H11	sing	1.09Å	1.10Å
C14	H12	sing	1.09Å	1.10Å
C15	H13	sing	1.09Å	1.10Å
C15	H14	sing	1.09Å	1.10Å
C16	H15	sing	1.09Å	1.10Å
C16	H16	sing	1.09Å	1.10Å
C16	H17	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C3	C4	C5	121.7°	120.7°
C4	C3	C2	116.0°	120.0°
C4	C3	H4	122.0°	120.0°
C3	C4	H5	119.1°	119.6°
C4	C5	C6	120.1°	120.2°
C5	C4	H5	119.2°	119.6°
C4	C5	H6	119.9°	119.9°
C3	C2	C1	120.0°	119.7°
C3	C2	H3	120.0°	120.1°
C2	C3	H4	122.0°	119.9°
C5	C6	C1	120.6°	119.0°
C5	C6	N7	128.7°	131.4°
C6	C5	H6	119.9°	119.9°
C2	C1	C6	121.6°	120.3°
C2	C1	C9	132.5°	133.1°
C1	C2	H3	120.0°	120.2°
C1	C6	N7	110.7°	109.6°
C6	C1	C9	105.8°	106.6°
C6	N7	CA	130.7°	124.3°
C6	N7	C8	108.0°	111.4°
C1	C9	O11	117.1°	127.5°
C1	C9	C8	105.1°	104.9°
CA	N7	C8	118.7°	124.3°
N7	CA	C	111.7°	109.5°
N7	CA	H7	108.9°	109.5°
N7	CA	H8	108.9°	109.5°
N7	C8	C9	109.4°	107.5°
N7	C8	O10	123.8°	126.3°
C	O12	C13	111.5°	117.0°
O12	C	CA	113.8°	120.0°
O12	C	O	123.9°	120.0°
O12	C13	C14	102.9°	109.5°
O12	C13	H9	111.1°	109.5°
O12	C13	H10	111.1°	109.5°
CA	C	O	122.3°	120.0°
C	CA	H7	108.9°	109.5°
C	CA	H8	108.9°	109.4°
O11	C9	C8	112.9°	127.6°
C9	C8	O10	126.5°	126.2°
C13	C14	C15	106.3°	109.5°
C14	C13	H9	111.1°	109.5°
C14	C13	H10	111.1°	109.5°
C13	C14	H11	110.2°	109.5°
C13	C14	H12	110.3°	109.5°
C14	C15	C16	106.9°	109.5°
C15	C14	H11	110.3°	109.5°
C15	C14	H12	110.3°	109.5°
C14	C15	H13	110.1°	109.5°
C14	C15	H14	110.1°	109.5°
C16	C15	H13	110.1°	109.4°
C16	C15	H14	110.1°	109.4°
C15	C16	H15	109.5°	109.5°
C15	C16	H16	109.5°	109.4°
C15	C16	H17	109.5°	109.4°
H7	CA	H8	109.5°	109.5°
H9	C13	H10	109.5°	109.4°
H11	C14	H12	109.4°	109.4°
H13	C15	H14	109.5°	109.4°
H15	C16	H16	109.5°	109.5°
H15	C16	H17	109.5°	109.5°
H16	C16	H17	109.5°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C3	C4	C5	H5	180.0°	180.0°
C4	C3	C2	H4	180.0°	179.8°
C3	C4	C5	C6	0.8°	0.0°
C4	C3	C2	C1	1.4°	0.1°
C4	C3	C2	H3	178.6°	180.0°
C3	C4	C5	H6	179.2°	180.0°
C5	C4	C3	C2	0.9°	0.0°
C4	C5	C6	H6	180.0°	180.0°
C4	C5	C6	C1	1.3°	0.0°
C4	C5	C6	N7	178.0°	179.6°
C5	C4	C3	H4	179.1°	179.9°
C3	C2	C1	H3	180.0°	179.9°
C3	C2	C1	C6	2.0°	0.1°
C3	C2	C1	C9	178.4°	179.9°
C2	C3	C4	H5	179.1°	179.9°
C5	C6	C1	C2	1.9°	0.1°
C5	C6	C1	N7	177.3°	179.7°
C5	C6	C1	C9	179.2°	180.0°
C5	C6	N7	CA	12.9°	0.0°
C5	C6	N7	C8	174.0°	179.9°
C6	C5	C4	H5	179.2°	180.0°
C2	C1	C6	C9	177.3°	180.0°
C2	C1	C6	N7	179.2°	179.8°
C2	C1	C9	O11	48.8°	0.1°
C2	C1	C9	C8	174.9°	180.0°
C1	C2	C3	H4	178.6°	179.9°
C1	C6	N7	CA	164.1°	179.7°
C1	C6	N7	C8	3.0°	0.4°
C6	C1	C9	O11	134.4°	180.0°
C6	C1	C9	C8	8.2°	0.1°
C6	C1	C2	H3	178.0°	180.0°
C1	C6	C5	H6	178.7°	180.0°
N7	C6	C1	C9	3.5°	0.3°
C6	N7	CA	C8	159.5°	179.9°
C6	N7	CA	C	74.9°	90.0°
C6	N7	C8	C9	8.4°	0.4°
C6	N7	C8	O10	177.3°	179.8°
N7	C6	C5	H6	2.0°	0.4°
C6	N7	CA	H7	45.5°	150.0°
C6	N7	CA	H8	164.8°	29.9°
C1	C9	C8	N7	10.4°	0.2°
C1	C9	O11	C8	122.2°	179.9°
C1	C9	C8	O10	175.5°	180.0°
C9	C1	C2	H3	1.5°	0.0°
N7	CA	C	O12	156.0°	180.0°
N7	CA	C	H7	120.3°	120.1°
N7	CA	C	H8	120.3°	120.0°
CA	N7	C8	C9	172.2°	179.7°
N7	CA	C	O	21.3°	0.1°
CA	N7	C8	O10	13.5°	0.1°
N7	CA	H7	H8	119.0°	120.0°
C8	N7	CA	C	125.7°	90.1°
N7	C8	C9	O11	139.1°	179.7°
N7	C8	C9	O10	174.2°	179.8°
C8	N7	CA	H7	114.0°	29.9°
C8	N7	CA	H8	5.3°	150.0°
O12	C	CA	O	177.3°	179.9°
C	O12	C13	C14	148.2°	180.0°
O12	C	CA	H7	35.7°	59.9°
O12	C	CA	H8	83.6°	60.0°
C	O12	C13	H9	29.3°	60.0°
C	O12	C13	H10	92.9°	60.0°
C13	O12	C	CA	164.5°	180.0°
C13	O12	C	O	18.3°	0.0°
O12	C13	C14	H9	118.9°	120.0°
O12	C13	C14	H10	119.0°	120.0°
O12	C13	C14	C15	128.4°	180.0°
O12	C13	H9	H10	123.1°	120.0°
O12	C13	C14	H11	112.1°	60.0°
O12	C13	C14	H12	8.8°	60.0°
C	CA	H7	H8	119.0°	119.9°
O11	C9	C8	O10	46.8°	0.1°
O	C	CA	H7	141.6°	120.0°
O	C	CA	H8	99.1°	120.0°
C13	C14	C15	H11	119.5°	120.0°
C13	C14	C15	H12	119.5°	120.0°
C13	C14	C15	C16	84.7°	180.0°
C14	C13	H9	H10	123.1°	120.0°
C13	C14	H11	H12	121.4°	120.0°
C13	C14	C15	H13	34.9°	60.0°
C13	C14	C15	H14	155.8°	60.0°
C14	C15	C16	H13	119.6°	120.0°
C14	C15	C16	H14	119.6°	120.0°
C15	C14	C13	H9	9.5°	60.0°
C15	C14	C13	H10	112.7°	60.0°
C15	C14	H11	H12	121.5°	120.0°
C14	C15	H13	H14	121.2°	120.1°
C14	C15	C16	H15	180.0°	180.0°
C14	C15	C16	H16	60.0°	60.0°
C14	C15	C16	H17	60.0°	60.0°
C16	C15	C14	H11	155.8°	60.0°
C16	C15	C14	H12	34.9°	60.0°
C16	C15	H13	H14	121.2°	119.9°
C15	C16	H15	H16	120.0°	120.0°
C15	C16	H15	H17	120.0°	120.0°
C15	C16	H16	H17	120.0°	119.9°
H3	C2	C3	H4	1.4°	0.2°
H4	C3	C4	H5	0.9°	0.1°
H5	C4	C5	H6	0.8°	0.0°
H9	C13	C14	H11	129.0°	180.0°
H9	C13	C14	H12	110.1°	60.0°
H10	C13	C14	H11	6.8°	60.0°
H10	C13	C14	H12	127.8°	NaN°
H11	C14	C15	H13	84.6°	180.0°
H11	C14	C15	H14	36.3°	60.0°
H12	C14	C15	H13	154.4°	60.0°
H12	C14	C15	H14	84.7°	180.0°
H13	C15	C16	H15	60.4°	60.0°
H13	C15	C16	H16	179.5°	180.0°
H13	C15	C16	H17	59.6°	60.1°
H14	C15	C16	H15	60.4°	59.9°
H14	C15	C16	H16	59.6°	60.1°
H14	C15	C16	H17	179.6°	180.0°
H15	C16	H16	H17	120.0°	120.1°

Release date:	2018-08-29
Definition date:	2016-08-19
Last modified:	2018-08-24
Release status:	REL
Processing site:	PDBJ
Derived from:	5GQ7