RBC

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N0	C11	sing	1.47Å	1.50Å
N0	C1D	sing	1.47Å	1.52Å
N0	HN0	sing	1.01Å	1.02Å
C11	C1	sing	1.53Å	1.55Å
C11	H111	sing	1.09Å	1.11Å
C11	H112	sing	1.09Å	1.11Å
C1	O0	sing	1.43Å	1.40Å
C1	C2	sing	1.53Å	1.57Å
C1	H1	sing	1.09Å	1.12Å
O0	C12	sing	1.43Å	1.39Å
C12	C13	sing	1.51Å	1.53Å
C12	H121	sing	1.09Å	1.12Å
C12	H122	sing	1.09Å	1.11Å
C13	C14	doub	1.39Å	1.41Å	Aromatic
C13	C19	sing	1.36Å	1.37Å	Aromatic
C14	C15	sing	1.36Å	1.37Å	Aromatic
C14	H14	sing	1.08Å	1.10Å
C15	C16	doub	1.41Å	1.42Å	Aromatic
C15	H15	sing	1.08Å	1.10Å
C16	C17	sing	1.40Å	1.45Å	Aromatic
C16	C18	sing	1.42Å	1.44Å	Aromatic
C17	C23	doub	1.36Å	1.37Å	Aromatic
C17	H17	sing	1.08Å	1.10Å
C23	C25	sing	1.39Å	1.43Å	Aromatic
C23	H23	sing	1.08Å	1.10Å
C25	C24	doub	1.36Å	1.37Å	Aromatic
C25	H25	sing	1.08Å	1.10Å
C24	C18	sing	1.40Å	1.47Å	Aromatic
C24	H24	sing	1.08Å	1.10Å
C18	C19	doub	1.41Å	1.46Å	Aromatic
C19	H19	sing	1.08Å	1.10Å
C2	C3	sing	1.51Å	1.58Å
C2	C1C	sing	1.53Å	1.54Å
C2	H2	sing	1.09Å	1.11Å
C3	C1B	doub	1.38Å	1.38Å	Aromatic
C3	C4	sing	1.38Å	1.41Å	Aromatic
C1B	C1A	sing	1.38Å	1.40Å	Aromatic
C1B	H1B	sing	1.08Å	1.10Å
C1A	C6	doub	1.38Å	1.38Å	Aromatic
C1A	H1A	sing	1.08Å	1.10Å
C6	C5	sing	1.38Å	1.38Å	Aromatic
C6	C7	sing	1.51Å	1.45Å
C5	C4	doub	1.38Å	1.41Å	Aromatic
C5	H5	sing	1.08Å	1.10Å
C4	H4	sing	1.08Å	1.10Å
C7	O8	sing	1.45Å	1.43Å
C7	H71	sing	1.09Å	1.11Å
C7	H72	sing	1.09Å	1.11Å
O8	C9	sing	1.35Å	1.38Å
C9	OI	doub	1.21Å	1.22Å
C9	CA	sing	1.48Å	1.42Å
CA	CB	doub	1.40Å	1.54Å	Aromatic
CA	CD	sing	1.40Å	1.38Å	Aromatic
CB	CC	sing	1.38Å	1.37Å	Aromatic
CB	HB	sing	1.08Å	1.10Å
CC	CH	doub	1.39Å	1.59Å	Aromatic
CC	HC	sing	1.08Å	1.10Å
CH	CE	sing	1.38Å	1.65Å	Aromatic
CH	HH	sing	1.08Å	1.10Å
CE	CD	doub	1.38Å	1.49Å	Aromatic
CE	HE	sing	1.08Å	1.10Å
CD	CL	sing	1.74Å	1.52Å
C1C	C21	sing	1.53Å	1.49Å
C1C	C1D	sing	1.53Å	1.52Å
C1C	H1C	sing	1.09Å	1.11Å
C21	O31	sing	1.43Å	1.41Å
C21	H211	sing	1.09Å	1.11Å
C21	H212	sing	1.09Å	1.11Å
O31	C41	sing	1.43Å	1.47Å
C41	H411	sing	1.09Å	1.11Å
C41	H412	sing	1.09Å	1.11Å
C41	H413	sing	1.09Å	1.11Å
C1D	H1D1	sing	1.09Å	1.12Å
C1D	H1D2	sing	1.09Å	1.12Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C11	N0	C1D	113.8°	107.3°
C11	N0	HN0	110.6°	106.7°
N0	C11	C1	110.2°	109.8°
N0	C11	H111	111.9°	109.4°
N0	C11	H112	111.9°	109.5°
C1D	N0	HN0	110.6°	106.7°
N0	C1D	C1C	112.2°	109.8°
N0	C1D	H1D1	111.2°	109.4°
N0	C1D	H1D2	111.2°	109.4°
C1	C11	H111	111.9°	109.4°
C1	C11	H112	111.9°	109.4°
C11	C1	O0	110.1°	109.5°
C11	C1	C2	113.3°	109.3°
C11	C1	H1	105.2°	109.5°
H111	C11	H112	98.5°	109.4°
O0	C1	C2	105.5°	109.6°
O0	C1	H1	113.0°	109.5°
C1	O0	C12	122.3°	106.8°
C2	C1	H1	109.8°	109.4°
C1	C2	C3	107.1°	109.6°
C1	C2	C1C	107.8°	109.0°
C1	C2	H2	112.1°	109.5°
O0	C12	C13	113.1°	109.5°
O0	C12	H121	110.9°	109.5°
O0	C12	H122	110.9°	109.5°
C13	C12	H121	110.9°	109.5°
C13	C12	H122	110.9°	109.4°
C12	C13	C14	116.5°	119.5°
C12	C13	C19	126.2°	119.5°
H121	C12	H122	99.4°	109.5°
C14	C13	C19	117.3°	121.0°
C13	C14	C15	123.0°	121.0°
C13	C14	H14	120.0°	119.5°
C13	C19	C18	122.6°	119.6°
C13	C19	H19	115.2°	120.2°
C15	C14	H14	116.9°	119.5°
C14	C15	C16	121.3°	119.6°
C14	C15	H15	117.6°	120.2°
C16	C15	H15	121.1°	120.1°
C15	C16	C17	122.2°	121.3°
C15	C16	C18	117.8°	119.3°
C17	C16	C18	120.0°	119.3°
C16	C17	C23	119.9°	119.7°
C16	C17	H17	122.8°	120.1°
C16	C18	C24	117.6°	119.4°
C16	C18	C19	118.0°	119.3°
C23	C17	H17	117.3°	120.2°
C17	C23	C25	121.1°	121.0°
C17	C23	H23	117.2°	119.5°
C25	C23	H23	121.7°	119.5°
C23	C25	C24	120.7°	121.0°
C23	C25	H25	121.9°	119.5°
C24	C25	H25	117.4°	119.5°
C25	C24	C18	120.7°	119.7°
C25	C24	H24	116.2°	120.2°
C18	C24	H24	123.1°	120.2°
C24	C18	C19	124.4°	121.3°
C18	C19	H19	122.3°	120.2°
C3	C2	C1C	109.6°	109.7°
C3	C2	H2	110.4°	109.6°
C2	C3	C1B	120.0°	120.0°
C2	C3	C4	125.6°	120.0°
C1C	C2	H2	109.8°	109.5°
C2	C1C	C21	113.1°	109.5°
C2	C1C	C1D	115.0°	109.3°
C2	C1C	H1C	104.2°	109.5°
C1B	C3	C4	114.4°	120.0°
C3	C1B	C1A	122.7°	120.0°
C3	C1B	H1B	118.0°	120.0°
C3	C4	C5	123.3°	120.0°
C3	C4	H4	118.1°	120.0°
C1A	C1B	H1B	119.2°	120.0°
C1B	C1A	C6	122.0°	120.0°
C1B	C1A	H1A	119.9°	120.0°
C6	C1A	H1A	118.1°	120.0°
C1A	C6	C5	117.5°	120.0°
C1A	C6	C7	118.3°	120.0°
C5	C6	C7	124.1°	120.0°
C6	C5	C4	120.1°	120.0°
C6	C5	H5	118.9°	120.0°
C6	C7	O8	99.9°	109.5°
C6	C7	H71	115.9°	109.4°
C6	C7	H72	115.9°	109.5°
C4	C5	H5	121.1°	120.0°
C5	C4	H4	118.5°	120.0°
O8	C7	H71	115.9°	109.5°
O8	C7	H72	115.9°	109.5°
C7	O8	C9	117.4°	120.0°
H71	C7	H72	94.5°	109.4°
O8	C9	OI	124.1°	120.0°
O8	C9	CA	124.2°	119.9°
OI	C9	CA	111.7°	120.0°
C9	CA	CB	107.5°	120.2°
C9	CA	CD	123.5°	120.1°
CB	CA	CD	129.0°	119.7°
CA	CB	CC	120.6°	119.9°
CA	CB	HB	125.5°	120.1°
CA	CD	CE	115.4°	119.8°
CA	CD	CL	136.3°	120.1°
CC	CB	HB	113.8°	120.0°
CB	CC	CH	117.7°	120.1°
CB	CC	HC	114.0°	119.9°
CH	CC	HC	128.3°	119.9°
CC	CH	CE	117.0°	120.3°
CC	CH	HH	119.8°	119.8°
CE	CH	HH	123.2°	119.9°
CH	CE	CD	119.3°	120.2°
CH	CE	HE	125.3°	119.9°
CD	CE	HE	115.4°	119.9°
CE	CD	CL	108.4°	120.1°
C21	C1C	C1D	113.5°	109.5°
C21	C1C	H1C	106.1°	109.5°
C1C	C21	O31	107.8°	109.5°
C1C	C21	H211	112.8°	109.5°
C1C	C21	H212	112.8°	109.5°
C1D	C1C	H1C	103.7°	109.5°
C1C	C1D	H1D1	111.2°	109.4°
C1C	C1D	H1D2	111.2°	109.4°
O31	C21	H211	112.8°	109.5°
O31	C21	H212	112.8°	109.4°
C21	O31	C41	111.1°	106.8°
H211	C21	H212	97.6°	109.5°
O31	C41	H411	111.6°	109.5°
O31	C41	H412	111.1°	109.5°
O31	C41	H413	111.6°	109.5°
H411	C41	H412	111.6°	109.5°
H411	C41	H413	98.8°	109.4°
H412	C41	H413	111.6°	109.5°
H1D1	C1D	H1D2	99.1°	109.3°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C11	N0	C1D	HN0	125.3°	114.0°
N0	C11	C1	H111	125.2°	120.1°
N0	C11	C1	H112	125.2°	120.2°
N0	C11	H111	H112	117.9°	119.9°
N0	C11	C1	O0	173.5°	178.7°
N0	C11	C1	C2	55.6°	61.3°
N0	C11	C1	H1	64.4°	58.5°
C11	N0	C1D	C1C	51.9°	65.6°
C11	N0	C1D	H1D1	73.3°	54.4°
C11	N0	C1D	H1D2	177.2°	174.2°
C1D	N0	C11	C1	53.7°	65.6°
C1D	N0	C11	H111	178.9°	54.4°
C1D	N0	C11	H112	71.6°	174.3°
N0	C1D	C1C	C2	51.7°	61.3°
N0	C1D	C1C	C21	175.9°	178.7°
N0	C1D	C1C	H1D1	125.3°	120.1°
N0	C1D	C1C	H1D2	125.3°	120.1°
N0	C1D	C1C	H1C	61.3°	58.6°
N0	C1D	H1D1	H1D2	117.1°	119.9°
HN0	N0	C11	C1	178.9°	179.7°
HN0	N0	C11	H111	55.8°	59.6°
HN0	N0	C11	H112	53.7°	60.2°
HN0	N0	C1D	C1C	177.2°	179.7°
HN0	N0	C1D	H1D1	51.9°	59.6°
HN0	N0	C1D	H1D2	57.5°	60.2°
C1	C11	H111	H112	117.8°	119.8°
C11	C1	O0	C2	122.6°	119.8°
C11	C1	O0	H1	117.3°	120.1°
C11	C1	C2	H1	117.3°	119.9°
C11	C1	O0	C12	114.3°	90.0°
C11	C1	C2	C3	171.4°	175.5°
C11	C1	C2	C1C	53.6°	55.5°
C11	C1	C2	H2	67.3°	64.3°
H111	C11	C1	O0	61.2°	61.3°
H111	C11	C1	C2	179.1°	58.8°
H111	C11	C1	H1	60.9°	178.6°
H112	C11	C1	O0	48.3°	58.5°
H112	C11	C1	C2	69.6°	178.5°
H112	C11	C1	H1	170.4°	61.6°
O0	C1	C2	H1	122.1°	120.1°
C1	O0	C12	C13	176.9°	180.0°
C1	O0	C12	H121	51.7°	60.0°
C1	O0	C12	H122	57.8°	60.0°
O0	C1	C2	C3	68.1°	64.5°
O0	C1	C2	C1C	174.1°	175.5°
O0	C1	C2	H2	53.2°	55.7°
C2	C1	O0	C12	123.0°	150.2°
C1	C2	C3	C1C	116.6°	119.6°
C1	C2	C3	H2	122.4°	120.2°
C1	C2	C1C	H2	122.4°	119.8°
C1	C2	C3	C1B	121.5°	120.0°
C1	C2	C3	C4	57.8°	59.7°
C1	C2	C1C	C21	175.8°	175.5°
C1	C2	C1C	C1D	51.7°	55.5°
C1	C2	C1C	H1C	61.1°	64.4°
H1	C1	O0	C12	3.0°	30.1°
H1	C1	C2	C3	54.0°	55.7°
H1	C1	C2	C1C	63.8°	64.4°
H1	C1	C2	H2	175.3°	175.9°
O0	C12	C13	H121	125.2°	120.1°
O0	C12	C13	H122	125.2°	120.0°
O0	C12	H121	H122	116.7°	120.1°
O0	C12	C13	C14	85.3°	90.0°
O0	C12	C13	C19	95.9°	90.2°
C13	C12	H121	H122	116.8°	119.9°
C12	C13	C14	C19	178.9°	179.8°
C12	C13	C14	C15	178.4°	180.0°
C12	C13	C14	H14	1.5°	0.0°
C12	C13	C19	C18	178.2°	179.7°
C12	C13	C19	H19	1.8°	0.1°
H121	C12	C13	C14	39.9°	30.1°
H121	C12	C13	C19	138.8°	149.7°
H122	C12	C13	C14	149.4°	150.0°
H122	C12	C13	C19	29.3°	29.8°
C13	C14	C15	H14	180.0°	179.9°
C13	C14	C15	C16	0.1°	0.0°
C13	C14	C15	H15	179.9°	180.0°
C14	C13	C19	C18	0.5°	0.5°
C14	C13	C19	H19	179.5°	179.7°
C19	C13	C14	C15	0.4°	0.2°
C19	C13	C14	H14	179.6°	179.7°
C13	C19	C18	C16	0.4°	0.6°
C13	C19	C18	C24	179.6°	179.8°
C13	C19	C18	H19	180.0°	179.8°
C14	C15	C16	H15	180.0°	180.0°
C14	C15	C16	C17	179.8°	179.9°
C14	C15	C16	C18	0.0°	0.0°
H14	C14	C15	C16	179.9°	180.0°
H14	C14	C15	H15	0.1°	0.1°
C15	C16	C17	C18	179.8°	179.9°
C15	C16	C17	C23	180.0°	180.0°
C15	C16	C17	H17	0.1°	0.1°
C15	C16	C18	C24	179.9°	180.0°
C15	C16	C18	C19	0.1°	0.3°
H15	C15	C16	C17	0.2°	0.0°
H15	C15	C16	C18	180.0°	179.9°
C16	C17	C23	H17	180.0°	179.9°
C16	C17	C23	C25	0.3°	0.1°
C16	C17	C23	H23	179.7°	180.0°
C17	C16	C18	C24	0.0°	0.1°
C17	C16	C18	C19	179.9°	179.8°
C18	C16	C17	C23	0.2°	0.1°
C18	C16	C17	H17	179.7°	180.0°
C16	C18	C24	C25	0.1°	0.1°
C16	C18	C24	C19	180.0°	179.6°
C16	C18	C24	H24	179.9°	180.0°
C16	C18	C19	H19	179.6°	179.6°
C17	C23	C25	H23	180.0°	179.9°
C17	C23	C25	C24	0.1°	0.1°
C17	C23	C25	H25	179.9°	180.0°
H17	C17	C23	C25	179.7°	180.0°
H17	C17	C23	H23	0.3°	0.1°
C23	C25	C24	H25	180.0°	180.0°
C23	C25	C24	C18	0.1°	0.1°
C23	C25	C24	H24	179.9°	180.0°
H23	C23	C25	C24	179.9°	180.0°
H23	C23	C25	H25	0.1°	0.1°
C25	C24	C18	H24	180.0°	179.9°
C25	C24	C18	C19	179.9°	179.7°
H25	C25	C24	C18	179.9°	179.9°
H25	C25	C24	H24	0.1°	0.0°
C24	C18	C19	H19	0.4°	0.0°
H24	C24	C18	C19	0.1°	0.3°
C3	C2	C1C	H2	121.4°	120.3°
C2	C3	C1B	C4	179.4°	179.8°
C2	C3	C1B	C1A	179.5°	180.0°
C2	C3	C1B	H1B	0.5°	0.1°
C2	C3	C4	C5	179.4°	179.8°
C2	C3	C4	H4	0.6°	0.2°
C3	C2	C1C	C21	59.6°	64.6°
C3	C2	C1C	C1D	167.9°	175.4°
C3	C2	C1C	H1C	55.1°	55.5°
C1C	C2	C3	C1B	121.9°	120.4°
C1C	C2	C3	C4	58.8°	59.8°
C2	C1C	C21	C1D	133.3°	119.8°
C2	C1C	C21	H1C	113.6°	120.1°
C2	C1C	C1D	H1C	113.1°	119.9°
C2	C1C	C21	O31	62.7°	175.1°
C2	C1C	C21	H211	172.1°	55.1°
C2	C1C	C21	H212	62.6°	64.9°
C2	C1C	C1D	H1D1	73.5°	58.8°
C2	C1C	C1D	H1D2	177.0°	178.5°
H2	C2	C3	C1B	0.8°	0.2°
H2	C2	C3	C4	179.8°	180.0°
H2	C2	C1C	C21	61.8°	55.7°
H2	C2	C1C	C1D	70.7°	64.3°
H2	C2	C1C	H1C	176.5°	175.8°
C3	C1B	C1A	H1B	180.0°	179.9°
C3	C1B	C1A	C6	0.2°	0.0°
C3	C1B	C1A	H1A	179.8°	180.0°
C1B	C3	C4	C5	0.0°	0.4°
C1B	C3	C4	H4	180.0°	180.0°
C4	C3	C1B	C1A	0.1°	0.2°
C4	C3	C1B	H1B	179.9°	179.7°
C3	C4	C5	C6	0.0°	0.4°
C3	C4	C5	H4	180.0°	179.6°
C3	C4	C5	H5	180.0°	179.8°
C1B	C1A	C6	H1A	180.0°	179.9°
C1B	C1A	C6	C5	0.2°	0.1°
C1B	C1A	C6	C7	177.8°	180.0°
H1B	C1B	C1A	C6	179.8°	180.0°
H1B	C1B	C1A	H1A	0.2°	0.1°
C1A	C6	C5	C7	177.9°	179.9°
C1A	C6	C5	C4	0.1°	0.1°
C1A	C6	C5	H5	179.9°	180.0°
C1A	C6	C7	O8	93.7°	90.0°
C1A	C6	C7	H71	31.6°	150.0°
C1A	C6	C7	H72	141.0°	30.0°
H1A	C1A	C6	C5	179.8°	180.0°
H1A	C1A	C6	C7	2.2°	0.0°
C6	C5	C4	H5	180.0°	179.9°
C6	C5	C4	H4	179.9°	180.0°
C5	C6	C7	O8	84.2°	89.9°
C5	C6	C7	H71	150.5°	30.1°
C5	C6	C7	H72	41.1°	150.0°
C7	C6	C5	C4	177.7°	179.8°
C7	C6	C5	H5	2.3°	0.1°
C6	C7	O8	H71	125.3°	120.0°
C6	C7	O8	H72	125.3°	120.0°
C6	C7	H71	H72	121.7°	119.9°
C6	C7	O8	C9	177.4°	180.0°
H5	C5	C4	H4	0.1°	0.2°
O8	C7	H71	H72	121.7°	120.0°
C7	O8	C9	OI	3.2°	0.1°
C7	O8	C9	CA	176.5°	180.0°
H71	C7	O8	C9	57.3°	60.0°
H72	C7	O8	C9	52.1°	60.0°
O8	C9	OI	CA	179.7°	179.9°
O8	C9	CA	CB	19.4°	0.0°
O8	C9	CA	CD	162.2°	179.7°
OI	C9	CA	CB	160.3°	179.9°
OI	C9	CA	CD	18.1°	0.2°
C9	CA	CB	CD	178.3°	179.7°
C9	CA	CB	CC	173.2°	180.0°
C9	CA	CB	HB	6.8°	0.1°
C9	CA	CD	CE	177.6°	179.8°
C9	CA	CD	CL	2.8°	0.3°
CA	CB	CC	HB	180.0°	179.9°
CA	CB	CC	CH	10.4°	0.1°
CA	CB	CC	HC	169.6°	179.9°
CB	CA	CD	CE	4.3°	0.6°
CB	CA	CD	CL	175.2°	180.0°
CD	CA	CB	CC	5.0°	0.3°
CD	CA	CB	HB	175.0°	179.8°
CA	CD	CE	CH	6.8°	0.5°
CA	CD	CE	CL	179.7°	179.5°
CA	CD	CE	HE	173.2°	179.7°
CB	CC	CH	HC	180.0°	180.0°
CB	CC	CH	CE	7.3°	0.0°
CB	CC	CH	HH	172.7°	180.0°
HB	CB	CC	CH	169.6°	179.9°
HB	CB	CC	HC	10.4°	0.1°
CC	CH	CE	HH	180.0°	180.0°
CC	CH	CE	CD	1.6°	0.2°
CC	CH	CE	HE	178.4°	180.0°
HC	CC	CH	CE	172.7°	180.0°
HC	CC	CH	HH	7.3°	0.0°
CH	CE	CD	HE	180.0°	179.8°
CH	CE	CD	CL	172.8°	180.0°
HH	CH	CE	CD	178.4°	179.7°
HH	CH	CE	HE	1.6°	0.0°
HE	CE	CD	CL	7.2°	0.2°
C21	C1C	C1D	H1C	114.6°	120.1°
C1C	C21	O31	H211	125.3°	120.1°
C1C	C21	O31	H212	125.3°	120.0°
C1C	C21	H211	H212	118.8°	120.0°
C1C	C21	O31	C41	173.2°	180.0°
C21	C1C	C1D	H1D1	58.8°	61.2°
C21	C1C	C1D	H1D2	50.7°	58.5°
C1D	C1C	C21	O31	70.6°	65.1°
C1D	C1C	C21	H211	54.7°	174.9°
C1D	C1C	C21	H212	164.1°	54.9°
C1C	C1D	H1D1	H1D2	117.1°	119.8°
H1C	C1C	C21	O31	176.3°	55.0°
H1C	C1C	C21	H211	58.5°	65.0°
H1C	C1C	C21	H212	51.0°	174.9°
H1C	C1C	C1D	H1D1	173.4°	178.7°
H1C	C1C	C1D	H1D2	63.9°	61.5°
O31	C21	H211	H212	118.7°	120.0°
C21	O31	C41	H411	54.8°	180.0°
C21	O31	C41	H412	180.0°	60.0°
C21	O31	C41	H413	54.7°	60.0°
H211	C21	O31	C41	61.5°	60.0°
H212	C21	O31	C41	47.9°	60.0°
O31	C41	H411	H412	125.0°	120.0°
O31	C41	H411	H413	117.5°	120.0°
O31	C41	H412	H413	125.3°	120.0°
H411	C41	H412	H413	109.5°	120.0°

Definition date:	2003-06-25
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB