TCO

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N	CA	sing	1.46Å	1.51Å
N	C1	sing	1.35Å	1.38Å
N	HN	sing	0.97Å	1.03Å
CA	C	sing	1.51Å	1.57Å
CA	CB	sing	1.53Å	1.59Å
CA	HA	sing	1.09Å	1.11Å
C	O	doub	1.21Å	1.25Å
C	HC	sing	1.08Å	1.10Å
CG2	CD2	sing	1.53Å	1.54Å
CG2	CB	sing	1.53Å	1.53Å
CG2	HG21	sing	1.09Å	1.11Å
CG2	HG22	sing	1.09Å	1.11Å
CD2	CE	sing	1.53Å	1.54Å
CD2	HD21	sing	1.09Å	1.11Å
CD2	HD22	sing	1.09Å	1.11Å
CE	CD1	sing	1.53Å	1.53Å
CE	HE1	sing	1.09Å	1.12Å
CE	HE2	sing	1.09Å	1.12Å
CD1	CG1	sing	1.53Å	1.55Å
CD1	HD11	sing	1.09Å	1.12Å
CD1	HD12	sing	1.09Å	1.12Å
CG1	CB	sing	1.53Å	1.57Å
CG1	HG11	sing	1.09Å	1.12Å
CG1	HG12	sing	1.09Å	1.12Å
CB	HB	sing	1.09Å	1.11Å
C1	O1	doub	1.22Å	1.24Å
C1	O2	sing	1.35Å	1.41Å
O2	C3	sing	1.45Å	1.46Å
C4	C3	sing	1.53Å	1.56Å
C4	H41	sing	1.09Å	1.12Å
C4	H42	sing	1.09Å	1.12Å
C4	H43	sing	1.09Å	1.12Å
C3	C6	sing	1.53Å	1.54Å
C3	C5	sing	1.53Å	1.55Å
C6	H61	sing	1.09Å	1.12Å
C6	H62	sing	1.09Å	1.11Å
C6	H63	sing	1.09Å	1.12Å
C5	H51	sing	1.09Å	1.12Å
C5	H52	sing	1.09Å	1.12Å
C5	H53	sing	1.09Å	1.11Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CA	N	C1	127.3°	120.1°
CA	N	HN	119.0°	119.9°
N	CA	C	109.6°	109.5°
N	CA	CB	107.7°	109.5°
N	CA	HA	108.7°	109.4°
C1	N	HN	109.9°	120.0°
N	C1	O1	125.1°	119.9°
N	C1	O2	112.6°	120.1°
C	CA	CB	110.4°	109.5°
C	CA	HA	108.6°	109.5°
CA	C	O	127.2°	120.0°
CA	C	HC	117.0°	120.0°
CB	CA	HA	111.9°	109.4°
CA	CB	CG2	113.3°	109.5°
CA	CB	CG1	118.0°	109.5°
CA	CB	HB	107.2°	109.4°
O	C	HC	115.7°	120.1°
CD2	CG2	CB	117.4°	109.5°
CD2	CG2	HG21	109.3°	109.5°
CD2	CG2	HG22	109.3°	109.5°
CG2	CD2	CE	111.9°	109.5°
CG2	CD2	HD21	111.3°	109.5°
CG2	CD2	HD22	111.3°	109.5°
CB	CG2	HG21	109.3°	109.5°
CB	CG2	HG22	109.3°	109.5°
CG2	CB	CG1	113.6°	109.5°
CG2	CB	HB	101.1°	109.5°
HG21	CG2	HG22	100.8°	109.4°
CE	CD2	HD21	111.3°	109.5°
CE	CD2	HD22	111.3°	109.4°
CD2	CE	CD1	111.1°	109.5°
CD2	CE	HE1	111.7°	109.5°
CD2	CE	HE2	111.6°	109.4°
HD21	CD2	HD22	99.1°	109.4°
CD1	CE	HE1	111.6°	109.5°
CD1	CE	HE2	111.6°	109.4°
CE	CD1	CG1	114.9°	109.5°
CE	CD1	HD11	110.2°	109.4°
CE	CD1	HD12	110.2°	109.5°
HE1	CE	HE2	98.7°	109.5°
CG1	CD1	HD11	110.2°	109.4°
CG1	CD1	HD12	110.2°	109.5°
CD1	CG1	CB	116.7°	109.5°
CD1	CG1	HG11	109.5°	109.5°
CD1	CG1	HG12	109.6°	109.5°
HD11	CD1	HD12	100.0°	109.5°
CB	CG1	HG11	109.6°	109.5°
CB	CG1	HG12	109.6°	109.5°
CG1	CB	HB	101.0°	109.4°
HG11	CG1	HG12	100.6°	109.4°
O1	C1	O2	122.3°	120.0°
C1	O2	C3	128.0°	120.0°
O2	C3	C4	104.9°	109.5°
O2	C3	C6	110.6°	109.5°
O2	C3	C5	110.3°	109.5°
C3	C4	H41	104.9°	109.5°
C3	C4	H42	113.9°	109.5°
C3	C4	H43	114.0°	109.5°
C4	C3	C6	105.8°	109.5°
C4	C3	C5	109.9°	109.4°
H41	C4	H42	113.9°	109.4°
H41	C4	H43	113.9°	109.5°
H42	C4	H43	96.5°	109.5°
C6	C3	C5	114.9°	109.5°
C3	C6	H61	110.5°	109.5°
C3	C6	H62	111.8°	109.5°
C3	C6	H63	111.8°	109.5°
C3	C5	H51	110.3°	109.5°
C3	C5	H52	111.9°	109.4°
C3	C5	H53	111.9°	109.5°
H61	C6	H62	111.9°	109.4°
H61	C6	H63	111.8°	109.4°
H62	C6	H63	98.6°	109.5°
H51	C5	H52	111.9°	109.4°
H51	C5	H53	112.0°	109.5°
H52	C5	H53	98.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CA	N	C1	HN	157.4°	179.8°
N	CA	C	CB	118.4°	120.1°
N	CA	C	HA	118.6°	119.9°
N	CA	CB	HA	119.3°	119.9°
N	CA	C	O	120.1°	0.0°
N	CA	C	HC	58.3°	180.0°
N	CA	CB	CG2	133.6°	180.0°
N	CA	CB	CG1	90.1°	59.9°
N	CA	CB	HB	22.9°	60.0°
CA	N	C1	O1	15.8°	0.2°
CA	N	C1	O2	163.7°	179.9°
C1	N	CA	C	139.9°	89.9°
C1	N	CA	CB	100.0°	150.0°
C1	N	CA	HA	21.3°	30.1°
N	C1	O1	O2	179.4°	179.9°
N	C1	O2	C3	164.4°	179.9°
HN	N	CA	C	64.5°	89.9°
HN	N	CA	CB	55.6°	30.1°
HN	N	CA	HA	177.0°	150.1°
HN	N	C1	O1	173.2°	180.0°
HN	N	C1	O2	6.2°	0.1°
C	CA	CB	HA	121.1°	120.0°
CA	C	O	HC	178.4°	180.0°
C	CA	CB	CG2	106.9°	60.0°
C	CA	CB	CG1	29.5°	180.0°
C	CA	CB	HB	142.5°	60.1°
CB	CA	C	O	121.5°	120.1°
CB	CA	C	HC	60.1°	60.0°
CA	CB	CG2	CD2	158.6°	180.0°
CA	CB	CG2	CG1	138.3°	120.0°
CA	CB	CG2	HB	114.4°	120.0°
CA	CB	CG2	HG21	76.2°	60.0°
CA	CB	CG2	HG22	33.3°	60.0°
CA	CB	CG1	CD1	176.6°	180.0°
CA	CB	CG1	HB	116.5°	119.9°
CA	CB	CG1	HG11	51.3°	60.0°
CA	CB	CG1	HG12	58.2°	59.9°
HA	CA	C	O	1.5°	120.0°
HA	CA	C	HC	176.9°	60.0°
HA	CA	CB	CG2	14.2°	60.1°
HA	CA	CB	CG1	150.5°	60.0°
HA	CA	CB	HB	96.4°	179.9°
CD2	CG2	CB	HG21	125.2°	120.0°
CD2	CG2	CB	HG22	125.2°	120.0°
CD2	CG2	HG21	HG22	115.1°	120.0°
CG2	CD2	CE	HD21	125.3°	120.0°
CG2	CD2	CE	HD22	125.3°	120.0°
CG2	CD2	HD21	HD22	117.2°	120.0°
CG2	CD2	CE	CD1	60.8°	59.9°
CG2	CD2	CE	HE1	173.9°	180.0°
CG2	CD2	CE	HE2	64.5°	60.0°
CD2	CG2	CB	CG1	20.3°	60.0°
CD2	CG2	CB	HB	87.1°	60.0°
CB	CG2	HG21	HG22	115.1°	120.0°
CB	CG2	CD2	CE	29.0°	60.0°
CB	CG2	CD2	HD21	96.2°	60.0°
CB	CG2	CD2	HD22	154.2°	180.0°
CG2	CB	CG1	CD1	40.4°	60.0°
CG2	CB	CG1	HB	107.4°	120.0°
CG2	CB	CG1	HG11	84.9°	60.0°
CG2	CB	CG1	HG12	165.7°	180.0°
HG21	CG2	CD2	CE	96.2°	180.0°
HG21	CG2	CD2	HD21	138.5°	60.0°
HG21	CG2	CD2	HD22	29.0°	60.0°
HG21	CG2	CB	CG1	145.5°	180.0°
HG21	CG2	CB	HB	38.2°	60.0°
HG22	CG2	CD2	CE	154.3°	60.0°
HG22	CG2	CD2	HD21	29.0°	180.0°
HG22	CG2	CD2	HD22	80.5°	60.0°
HG22	CG2	CB	CG1	105.0°	60.0°
HG22	CG2	CB	HB	147.7°	180.0°
CE	CD2	HD21	HD22	117.2°	119.9°
CD2	CE	CD1	HE1	125.3°	120.1°
CD2	CE	CD1	HE2	125.3°	119.9°
CD2	CE	HE1	HE2	117.5°	120.0°
CD2	CE	CD1	CG1	40.8°	60.0°
CD2	CE	CD1	HD11	84.5°	60.0°
CD2	CE	CD1	HD12	166.1°	180.0°
HD21	CD2	CE	CD1	64.5°	60.1°
HD21	CD2	CE	HE1	60.8°	60.0°
HD21	CD2	CE	HE2	170.2°	180.0°
HD22	CD2	CE	CD1	174.0°	180.0°
HD22	CD2	CE	HE1	48.7°	59.9°
HD22	CD2	CE	HE2	60.7°	60.1°
CD1	CE	HE1	HE2	117.5°	120.0°
CE	CD1	CG1	HD11	125.3°	120.0°
CE	CD1	CG1	HD12	125.3°	120.0°
CE	CD1	HD11	HD12	116.0°	120.0°
CE	CD1	CG1	CB	9.2°	60.0°
CE	CD1	CG1	HG11	116.1°	60.0°
CE	CD1	CG1	HG12	134.5°	180.0°
HE1	CE	CD1	CG1	166.1°	180.0°
HE1	CE	CD1	HD11	40.8°	60.1°
HE1	CE	CD1	HD12	68.6°	59.9°
HE2	CE	CD1	CG1	84.5°	60.0°
HE2	CE	CD1	HD11	150.2°	179.9°
HE2	CE	CD1	HD12	40.8°	60.1°
CG1	CD1	HD11	HD12	116.1°	120.0°
CD1	CG1	CB	HG11	125.3°	120.0°
CD1	CG1	CB	HG12	125.3°	120.0°
CD1	CG1	HG11	HG12	115.3°	120.0°
CD1	CG1	CB	HB	67.0°	60.0°
HD11	CD1	CG1	CB	134.5°	60.0°
HD11	CD1	CG1	HG11	9.2°	180.0°
HD11	CD1	CG1	HG12	100.2°	60.0°
HD12	CD1	CG1	CB	116.1°	180.0°
HD12	CD1	CG1	HG11	118.6°	60.0°
HD12	CD1	CG1	HG12	9.2°	60.0°
CB	CG1	HG11	HG12	115.4°	120.0°
HG11	CG1	CB	HB	167.8°	179.9°
HG12	CG1	CB	HB	58.3°	60.0°
O1	C1	O2	C3	16.2°	0.0°
C1	O2	C3	C4	176.8°	180.0°
C1	O2	C3	C6	63.1°	60.1°
C1	O2	C3	C5	65.0°	60.0°
O2	C3	C4	C6	116.9°	120.0°
O2	C3	C4	C5	118.5°	120.0°
O2	C3	C4	H41	180.0°	180.0°
O2	C3	C4	H42	54.7°	60.0°
O2	C3	C4	H43	54.7°	60.0°
O2	C3	C6	C5	125.6°	120.1°
O2	C3	C6	H61	180.0°	60.0°
O2	C3	C6	H62	54.7°	179.9°
O2	C3	C6	H63	54.8°	60.0°
O2	C3	C5	H51	179.9°	59.9°
O2	C3	C5	H52	54.8°	60.0°
O2	C3	C5	H53	54.7°	180.0°
C3	C4	H41	H42	125.3°	120.0°
C3	C4	H41	H43	125.3°	120.0°
C3	C4	H42	H43	119.8°	120.0°
C4	C3	C6	C5	121.4°	120.0°
C4	C3	C6	H61	66.9°	60.0°
C4	C3	C6	H62	167.8°	60.0°
C4	C3	C6	H63	58.3°	180.0°
C4	C3	C5	H51	64.8°	60.0°
C4	C3	C5	H52	60.4°	180.0°
C4	C3	C5	H53	169.8°	60.0°
H41	C4	H42	H43	119.8°	120.0°
H41	C4	C3	C6	63.1°	60.0°
H41	C4	C3	C5	61.5°	60.0°
H42	C4	C3	C6	62.2°	60.0°
H42	C4	C3	C5	173.2°	180.0°
H43	C4	C3	C6	171.7°	180.0°
H43	C4	C3	C5	63.8°	60.0°
C3	C6	H61	H62	125.3°	120.0°
C3	C6	H61	H63	125.2°	120.0°
C3	C6	H62	H63	117.7°	120.0°
C6	C3	C5	H51	54.4°	180.0°
C6	C3	C5	H52	179.5°	60.0°
C6	C3	C5	H53	71.0°	60.0°
C5	C3	C6	H61	54.5°	180.0°
C5	C3	C6	H62	70.8°	60.0°
C5	C3	C6	H63	179.7°	60.0°
C3	C5	H51	H52	125.2°	119.9°
C3	C5	H51	H53	125.3°	120.1°
C3	C5	H52	H53	117.8°	120.0°
H61	C6	H62	H63	117.7°	119.9°
H51	C5	H52	H53	117.9°	120.0°

Definition date:	2003-08-29
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB
Derived from:	1Q6K