C66

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C8'	C7'	sing	1.52Å	1.55Å
C8'	N1	sing	1.43Å	1.47Å
C8'	H8'1	sing	1.09Å	1.10Å
C8'	H8'2	sing	1.09Å	1.10Å
C7'	O7'	doub	1.23Å	1.23Å
C7'	N4'	sing	1.41Å	1.36Å
C5'	C'	sing	1.52Å	1.53Å
C5'	N4'	sing	1.44Å	1.53Å
C5'	CB	sing	1.53Å	1.56Å
C5'	H5'1	sing	1.09Å	1.10Å
C'	O1'	doub	1.22Å	1.24Å
C'	OXT	sing	1.36Å	32.62Å
OXT	HXT	sing	0.98Å	0.95Å
N4'	C3'	sing	1.47Å	1.48Å
C3'	C2'	sing	1.52Å	1.50Å
C3'	H3'1	sing	1.09Å	1.10Å
C3'	H3'2	sing	1.09Å	1.10Å
C2'	N1'	sing	1.44Å	1.48Å
C2'	H2'1	sing	1.09Å	1.10Å
C2'	H2'2	sing	1.10Å	1.10Å
N1'	H1'1	sing	1.01Å	1.00Å
N1'	H1'2	sing	1.01Å	1.00Å
N1	C2	sing	1.42Å	1.38Å
N1	C6	sing	1.39Å	1.38Å
C2	N3	sing	1.38Å	1.36Å
C2	O2	doub	1.23Å	1.24Å
N3	C4	doub	1.31Å	1.33Å
C4	C5	sing	1.49Å	1.42Å
C4	N4	sing	1.38Å	1.30Å
C5	C6	doub	1.33Å	1.35Å
C5	H5	sing	1.08Å	1.08Å
C6	H6	sing	1.08Å	1.08Å
N4	HN41	sing	0.99Å	1.00Å
N4	HN42	sing	0.99Å	1.00Å
CB	CG	sing	1.53Å	1.53Å
CB	HB1	sing	1.10Å	1.10Å
CB	HB2	sing	1.10Å	1.10Å
CG	CD	sing	1.53Å	1.54Å
CG	HG1	sing	1.10Å	1.10Å
CG	HG2	sing	1.10Å	1.10Å
CD	CE	sing	1.53Å	1.53Å
CD	HD1	sing	1.10Å	1.10Å
CD	HD2	sing	1.10Å	1.10Å
CE	NZ	sing	1.46Å	1.49Å
CE	HE1	sing	1.10Å	1.10Å
CE	HE2	sing	1.10Å	1.10Å
NZ	HZ1	sing	1.00Å	1.00Å
NZ	HZ2	sing	1.00Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C7'	C8'	N1	107.0°	110.0°
C7'	C8'	H8'1	110.9°	110.4°
C7'	C8'	H8'2	110.3°	110.4°
C8'	C7'	O7'	119.9°	120.8°
C8'	C7'	N4'	121.4°	116.4°
N1	C8'	H8'1	110.8°	107.6°
N1	C8'	H8'2	110.3°	107.6°
C8'	N1	C2	118.5°	122.1°
C8'	N1	C6	121.0°	118.8°
H8'1	C8'	H8'2	107.6°	110.9°
O7'	C7'	N4'	118.7°	122.8°
C7'	N4'	C5'	118.9°	122.1°
C7'	N4'	C3'	122.3°	122.1°
C'	C5'	N4'	114.1°	106.4°
C'	C5'	CB	111.7°	110.2°
C'	C5'	H5'1	108.7°	109.0°
C5'	C'	O1'	120.3°	125.2°
C5'	C'	OXT	70.3°	111.9°
N4'	C5'	CB	118.7°	112.4°
N4'	C5'	H5'1	99.2°	106.2°
C5'	N4'	C3'	118.8°	115.8°
CB	C5'	H5'1	102.4°	112.3°
C5'	CB	CG	117.6°	114.6°
C5'	CB	HB1	104.9°	109.3°
C5'	CB	HB2	106.8°	109.6°
O1'	C'	OXT	168.2°	122.8°
C'	OXT	HXT	70.3°	115.3°
N4'	C3'	C2'	119.3°	112.0°
N4'	C3'	H3'1	104.0°	107.1°
N4'	C3'	H3'2	106.3°	107.5°
C2'	C3'	H3'1	104.1°	110.3°
C2'	C3'	H3'2	106.3°	111.3°
C3'	C2'	N1'	111.3°	112.1°
C3'	C2'	H2'1	108.4°	111.4°
C3'	C2'	H2'2	108.9°	110.1°
H3'1	C3'	H3'2	117.5°	108.5°
N1'	C2'	H2'1	108.5°	107.4°
N1'	C2'	H2'2	108.9°	107.0°
C2'	N1'	H1'1	109.4°	119.2°
C2'	N1'	H1'2	109.5°	119.1°
H2'1	C2'	H2'2	110.9°	108.6°
H1'1	N1'	H1'2	109.5°	120.3°
C2	N1	C6	120.5°	119.2°
N1	C2	N3	120.3°	118.9°
N1	C2	O2	121.0°	120.8°
N1	C6	C5	121.2°	122.8°
N1	C6	H6	119.4°	115.9°
N3	C2	O2	118.7°	120.3°
C2	N3	C4	117.5°	121.1°
N3	C4	C5	125.6°	121.6°
N3	C4	N4	113.4°	120.2°
C5	C4	N4	121.0°	118.2°
C4	C5	C6	114.8°	116.4°
C4	C5	H5	122.6°	120.5°
C4	N4	HN41	124.7°	118.0°
C4	N4	HN42	110.6°	118.1°
C6	C5	H5	122.6°	123.1°
C5	C6	H6	119.4°	121.3°
HN41	N4	HN42	124.7°	123.9°
CG	CB	HB1	105.0°	108.1°
CG	CB	HB2	106.9°	108.9°
CB	CG	CD	111.2°	113.3°
CB	CG	HG1	108.5°	107.9°
CB	CG	HG2	108.9°	109.7°
HB1	CB	HB2	116.1°	105.9°
CD	CG	HG1	108.5°	108.9°
CD	CG	HG2	108.9°	110.2°
CG	CD	CE	110.8°	113.0°
CG	CD	HD1	108.7°	110.1°
CG	CD	HD2	109.0°	109.1°
HG1	CG	HG2	110.8°	106.6°
CE	CD	HD1	108.7°	109.2°
CE	CD	HD2	109.0°	108.3°
CD	CE	NZ	112.3°	111.9°
CD	CE	HE1	107.9°	110.0°
CD	CE	HE2	108.5°	109.2°
HD1	CD	HD2	110.5°	106.8°
NZ	CE	HE1	107.9°	109.2°
NZ	CE	HE2	108.5°	109.0°
CE	NZ	HZ1	109.5°	118.3°
CE	NZ	HZ2	109.5°	118.2°
HE1	CE	HE2	111.7°	107.3°
HZ1	NZ	HZ2	109.5°	122.2°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C7'	C8'	N1	H8'1	121.0°	120.2°
C7'	C8'	N1	H8'2	120.0°	120.2°
C7'	C8'	H8'1	H8'2	120.7°	122.6°
C8'	C7'	O7'	N4'	179.8°	179.8°
C8'	C7'	N4'	C5'	179.9°	179.9°
C8'	C7'	N4'	C3'	1.9°	0.2°
C7'	C8'	N1	C2	92.6°	90.0°
C7'	C8'	N1	C6	87.3°	90.1°
N1	C8'	H8'1	H8'2	120.7°	117.4°
N1	C8'	C7'	O7'	0.3°	1.3°
N1	C8'	C7'	N4'	179.9°	178.5°
C8'	N1	C2	C6	179.9°	179.9°
C8'	N1	C2	N3	179.5°	179.9°
C8'	N1	C2	O2	0.4°	0.0°
C8'	N1	C6	C5	179.9°	180.0°
C8'	N1	C6	H6	0.1°	0.1°
H8'1	C8'	C7'	O7'	121.3°	119.8°
H8'1	C8'	C7'	N4'	59.0°	60.0°
H8'1	C8'	N1	C2	146.5°	149.7°
H8'1	C8'	N1	C6	33.7°	30.2°
H8'2	C8'	C7'	O7'	119.7°	117.2°
H8'2	C8'	C7'	N4'	60.1°	62.9°
H8'2	C8'	N1	C2	27.4°	30.2°
H8'2	C8'	N1	C6	152.7°	149.7°
O7'	C7'	N4'	C5'	0.3°	0.1°
O7'	C7'	N4'	C3'	177.9°	180.0°
C7'	N4'	C5'	C'	90.9°	64.0°
C7'	N4'	C5'	C3'	178.3°	180.0°
C7'	N4'	C5'	CB	44.1°	56.7°
C7'	N4'	C5'	H5'1	153.8°	180.0°
C7'	N4'	C3'	C2'	112.7°	90.0°
C7'	N4'	C3'	H3'1	132.0°	30.9°
C7'	N4'	C3'	H3'2	7.3°	147.3°
C'	C5'	N4'	CB	134.9°	120.7°
C'	C5'	N4'	H5'1	115.3°	116.0°
C'	C5'	CB	H5'1	116.1°	121.7°
C5'	C'	O1'	OXT	153.5°	177.4°
C5'	C'	OXT	HXT	180.0°	177.7°
C'	C5'	N4'	C3'	87.4°	116.1°
C'	C5'	CB	CG	177.6°	178.4°
C'	C5'	CB	HB1	61.4°	60.1°
C'	C5'	CB	HB2	62.4°	55.7°
N4'	C5'	CB	H5'1	108.0°	119.7°
N4'	C5'	C'	O1'	178.6°	24.2°
N4'	C5'	C'	OXT	4.2°	158.2°
C5'	N4'	C3'	C2'	69.0°	90.0°
C5'	N4'	C3'	H3'1	46.3°	149.0°
C5'	N4'	C3'	H3'2	170.9°	32.6°
N4'	C5'	CB	CG	41.7°	59.9°
N4'	C5'	CB	HB1	74.5°	178.6°
N4'	C5'	CB	HB2	161.7°	62.9°
CB	C5'	C'	O1'	40.6°	146.3°
CB	C5'	C'	OXT	133.9°	36.0°
CB	C5'	N4'	C3'	137.7°	123.2°
C5'	CB	CG	HB1	116.2°	122.2°
C5'	CB	CG	HB2	120.0°	123.2°
C5'	CB	HB1	HB2	117.7°	118.0°
C5'	CB	CG	CD	167.8°	177.8°
C5'	CB	CG	HG1	72.9°	61.5°
C5'	CB	CG	HG2	47.8°	54.2°
H5'1	C5'	C'	O1'	71.7°	90.0°
H5'1	C5'	C'	OXT	113.9°	87.7°
H5'1	C5'	N4'	C3'	27.9°	0.0°
H5'1	C5'	CB	CG	66.3°	59.8°
H5'1	C5'	CB	HB1	177.5°	61.7°
H5'1	C5'	CB	HB2	53.7°	177.4°
O1'	C'	OXT	HXT	24.2°	0.0°
N4'	C3'	C2'	H3'1	115.3°	119.1°
N4'	C3'	C2'	H3'2	120.0°	120.4°
N4'	C3'	H3'1	H3'2	117.2°	115.8°
N4'	C3'	C2'	N1'	71.5°	179.1°
N4'	C3'	C2'	H2'1	47.7°	60.5°
N4'	C3'	C2'	H2'2	168.5°	60.0°
C2'	C3'	H3'1	H3'2	117.2°	122.2°
C3'	C2'	N1'	H2'1	119.2°	122.7°
C3'	C2'	N1'	H2'2	120.0°	120.8°
C3'	C2'	H2'1	H2'2	119.5°	121.4°
C3'	C2'	N1'	H1'1	58.9°	124.1°
C3'	C2'	N1'	H1'2	178.9°	42.6°
H3'1	C3'	C2'	N1'	173.2°	60.0°
H3'1	C3'	C2'	H2'1	67.5°	179.6°
H3'1	C3'	C2'	H2'2	53.2°	59.1°
H3'2	C3'	C2'	N1'	48.5°	60.5°
H3'2	C3'	C2'	H2'1	167.7°	59.9°
H3'2	C3'	C2'	H2'2	71.5°	179.6°
N1'	C2'	H2'1	H2'2	119.5°	115.4°
C2'	N1'	H1'1	H1'2	120.0°	166.5°
H2'1	C2'	N1'	H1'1	60.4°	113.2°
H2'1	C2'	N1'	H1'2	59.7°	80.2°
H2'2	C2'	N1'	H1'1	178.9°	3.3°
H2'2	C2'	N1'	H1'2	61.1°	163.4°
N1	C2	N3	O2	179.9°	179.9°
N1	C2	N3	C4	0.5°	0.0°
C2	N1	C6	C5	0.2°	0.1°
C2	N1	C6	H6	179.7°	180.0°
C6	N1	C2	N3	0.6°	0.0°
C6	N1	C2	O2	179.5°	179.9°
N1	C6	C5	C4	0.2°	0.1°
N1	C6	C5	H6	180.0°	179.9°
N1	C6	C5	H5	179.8°	180.0°
C2	N3	C4	C5	0.0°	0.0°
C2	N3	C4	N4	179.8°	180.0°
O2	C2	N3	C4	179.6°	180.0°
N3	C4	C5	N4	179.7°	180.0°
N3	C4	C5	C6	0.4°	0.0°
N3	C4	C5	H5	179.6°	180.0°
N3	C4	N4	HN41	179.9°	74.6°
N3	C4	N4	HN42	0.1°	105.3°
C4	C5	C6	H5	180.0°	179.9°
C4	C5	C6	H6	179.8°	180.0°
C5	C4	N4	HN41	0.1°	105.4°
C5	C4	N4	HN42	179.9°	74.7°
N4	C4	C5	C6	179.9°	180.0°
N4	C4	C5	H5	0.1°	0.0°
C4	N4	HN41	HN42	180.0°	179.9°
H5	C5	C6	H6	0.2°	0.1°
CG	CB	HB1	HB2	117.7°	116.6°
CB	CG	CD	HG1	119.2°	120.1°
CB	CG	CD	HG2	120.0°	123.3°
CB	CG	HG1	HG2	119.5°	117.8°
CB	CG	CD	CE	139.7°	177.6°
CB	CG	CD	HD1	100.9°	60.0°
CB	CG	CD	HD2	19.7°	57.0°
HB1	CB	CG	CD	51.7°	60.0°
HB1	CB	CG	HG1	170.9°	60.7°
HB1	CB	CG	HG2	68.4°	176.4°
HB2	CB	CG	CD	72.2°	54.6°
HB2	CB	CG	HG1	47.1°	175.3°
HB2	CB	CG	HG2	167.8°	69.0°
CD	CG	HG1	HG2	119.5°	118.9°
CG	CD	CE	HD1	119.4°	122.9°
CG	CD	CE	HD2	120.0°	121.1°
CG	CD	HD1	HD2	119.6°	118.4°
CG	CD	CE	NZ	170.2°	178.3°
CG	CD	CE	HE1	51.4°	60.0°
CG	CD	CE	HE2	69.8°	57.6°
HG1	CG	CD	CE	20.4°	57.5°
HG1	CG	CD	HD1	139.9°	179.9°
HG1	CG	CD	HD2	99.6°	63.2°
HG2	CG	CD	CE	100.3°	59.1°
HG2	CG	CD	HD1	19.2°	63.3°
HG2	CG	CD	HD2	139.7°	179.7°
CE	CD	HD1	HD2	119.6°	117.0°
CD	CE	NZ	HE1	118.8°	122.1°
CD	CE	NZ	HE2	120.0°	120.9°
CD	CE	HE1	HE2	119.2°	118.7°
CD	CE	NZ	HZ1	0.2°	60.1°
CD	CE	NZ	HZ2	119.9°	133.2°
HD1	CD	CE	NZ	70.4°	58.7°
HD1	CD	CE	HE1	170.9°	62.9°
HD1	CD	CE	HE2	49.7°	179.5°
HD2	CD	CE	NZ	50.2°	57.3°
HD2	CD	CE	HE1	68.6°	178.9°
HD2	CD	CE	HE2	170.2°	63.5°
NZ	CE	HE1	HE2	119.2°	118.0°
CE	NZ	HZ1	HZ2	120.1°	166.1°
HE1	CE	NZ	HZ1	118.9°	177.7°
HE1	CE	NZ	HZ2	1.1°	11.1°
HE2	CE	NZ	HZ1	119.9°	60.7°
HE2	CE	NZ	HZ2	120.1°	105.9°

Definition date:	2003-02-19
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB