Obsolete: 0SN

0SN was replaced with 88N on

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C23	C24	sing	1.38Å	1.38Å	Aromatic
C23	C22	doub	1.38Å	1.38Å	Aromatic
C27	C26	doub	1.38Å	1.38Å	Aromatic
C27	C22	sing	1.38Å	1.38Å	Aromatic
C24	C25	doub	1.38Å	1.38Å	Aromatic
C26	C25	sing	1.38Å	1.38Å	Aromatic
C5	C6	sing	1.36Å	1.38Å	Aromatic
C5	C4	doub	1.41Å	1.39Å	Aromatic
C6	C7	doub	1.39Å	1.39Å	Aromatic
C8	C7	sing	1.38Å	1.39Å	Aromatic
C8	C9	doub	1.39Å	1.38Å	Aromatic
C22	C21	sing	1.51Å	1.52Å
C25	C28	sing	1.51Å	1.50Å
C4	C9	sing	1.40Å	1.39Å	Aromatic
C4	N3	sing	1.35Å	1.39Å	Aromatic
C7	N11	sing	1.40Å	1.42Å
C9	S10	sing	1.76Å	1.74Å	Aromatic
C2	C1	sing	1.51Å	1.49Å
C2	N3	doub	1.28Å	1.31Å	Aromatic
C2	S10	sing	1.71Å	1.73Å	Aromatic
C12	C14	sing	1.51Å	1.51Å
C12	N11	sing	1.35Å	1.35Å
C12	O13	doub	1.21Å	1.23Å
C17	C19	sing	1.51Å	1.51Å
C17	N16	sing	1.35Å	1.33Å
C17	O18	doub	1.21Å	1.23Å
C30	C29	sing	1.51Å	1.50Å
C30	O31	doub	1.21Å	1.22Å
C30	O32	sing	1.34Å	1.29Å
C33	C29	sing	1.51Å	1.51Å
C33	O34	doub	1.21Å	1.22Å
C33	O35	sing	1.34Å	1.30Å
C21	C20	sing	1.53Å	1.52Å
C28	C29	sing	1.53Å	1.54Å
C14	C15	sing	1.53Å	1.51Å
C19	C20	sing	1.53Å	1.52Å
C15	N16	sing	1.47Å	1.46Å
C23	H23	sing	1.08Å	1.08Å
C24	H24	sing	1.08Å	1.08Å
C27	H27	sing	1.08Å	1.08Å
C26	H26	sing	1.08Å	1.08Å
C5	H5	sing	1.08Å	1.08Å
C6	H6	sing	1.08Å	1.08Å
C8	H8	sing	1.08Å	1.08Å
C21	H211	sing	1.09Å	1.10Å
C21	H212	sing	1.09Å	1.10Å
C28	H281	sing	1.09Å	1.10Å
C28	H282	sing	1.09Å	1.10Å
N11	H11	sing	0.97Å	1.00Å
C1	H11C	sing	1.09Å	1.10Å
C1	H12C	sing	1.09Å	1.10Å
C1	H13C	sing	1.09Å	1.10Å
C14	H141	sing	1.09Å	1.10Å
C14	H142	sing	1.09Å	1.10Å
C19	H191	sing	1.09Å	1.10Å
C19	H192	sing	1.09Å	1.10Å
N16	H16	sing	0.97Å	1.00Å
C29	H29	sing	1.09Å	1.10Å
O32	H32	sing	0.97Å	0.95Å
O35	H35	sing	0.97Å	0.95Å
C20	H201	sing	1.09Å	1.10Å
C20	H202	sing	1.09Å	1.10Å
C15	H151	sing	1.09Å	1.10Å
C15	H152	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C24	C23	C22	121.1°	120.0°
C23	C24	C25	120.9°	120.0°
C24	C23	H23	119.5°	120.0°
C23	C24	H24	119.6°	120.0°
C23	C22	C27	117.9°	120.0°
C23	C22	C21	121.2°	120.0°
C22	C23	H23	119.4°	120.0°
C26	C27	C22	121.1°	120.0°
C27	C26	C25	121.0°	120.0°
C26	C27	H27	119.5°	120.0°
C27	C26	H26	119.5°	119.9°
C27	C22	C21	120.8°	120.0°
C22	C27	H27	119.5°	120.0°
C24	C25	C26	118.0°	120.0°
C24	C25	C28	121.3°	120.0°
C25	C24	H24	119.5°	120.0°
C26	C25	C28	120.6°	120.0°
C25	C26	H26	119.5°	120.1°
C6	C5	C4	119.9°	120.6°
C5	C6	C7	120.8°	120.7°
C6	C5	H5	120.1°	119.7°
C5	C6	H6	119.6°	119.7°
C5	C4	C9	118.6°	118.6°
C5	C4	N3	126.5°	129.6°
C4	C5	H5	120.1°	119.7°
C6	C7	C8	120.0°	119.9°
C6	C7	N11	120.4°	120.1°
C7	C6	H6	119.6°	119.6°
C7	C8	C9	118.8°	119.9°
C8	C7	N11	119.6°	120.0°
C7	C8	H8	120.6°	120.1°
C8	C9	C4	121.9°	120.3°
C8	C9	S10	128.7°	131.7°
C9	C8	H8	120.6°	120.0°
C22	C21	C20	116.1°	109.5°
C22	C21	H211	107.8°	109.5°
C22	C21	H212	107.8°	109.5°
C25	C28	C29	112.8°	109.5°
C25	C28	H281	108.6°	109.5°
C25	C28	H282	108.6°	109.5°
C9	C4	N3	114.8°	111.7°
C4	C9	S10	109.4°	108.0°
C4	N3	C2	110.7°	117.9°
C7	N11	C12	127.4°	120.0°
C7	N11	H11	116.3°	120.0°
C9	S10	C2	89.6°	90.8°
C1	C2	N3	123.5°	124.2°
C1	C2	S10	121.0°	124.2°
C2	C1	H11C	109.5°	109.5°
C2	C1	H12C	109.5°	109.4°
C2	C1	H13C	109.5°	109.4°
N3	C2	S10	115.5°	111.6°
C14	C12	N11	114.8°	120.0°
C14	C12	O13	121.7°	120.0°
C12	C14	C15	112.5°	109.5°
C12	C14	H141	108.7°	109.5°
C12	C14	H142	108.7°	109.4°
N11	C12	O13	123.5°	120.0°
C12	N11	H11	116.3°	120.0°
C19	C17	N16	116.2°	120.0°
C19	C17	O18	121.2°	120.0°
C17	C19	C20	113.2°	109.4°
C17	C19	H191	108.5°	109.5°
C17	C19	H192	108.5°	109.5°
N16	C17	O18	122.6°	120.0°
C17	N16	C15	124.0°	119.9°
C17	N16	H16	118.1°	120.0°
C29	C30	O31	121.8°	120.0°
C29	C30	O32	113.9°	120.0°
C30	C29	C33	109.7°	109.5°
C30	C29	C28	111.0°	109.4°
C30	C29	H29	108.2°	109.5°
O31	C30	O32	124.3°	120.0°
C30	O32	H32	109.5°	117.1°
C29	C33	O34	121.4°	120.0°
C29	C33	O35	114.6°	120.0°
C33	C29	C28	112.0°	109.5°
C33	C29	H29	108.1°	109.5°
O34	C33	O35	124.0°	120.0°
C33	O35	H35	109.5°	117.0°
C21	C20	C19	114.5°	109.5°
C20	C21	H211	107.8°	109.4°
C20	C21	H212	107.8°	109.5°
C21	C20	H201	108.2°	109.5°
C21	C20	H202	108.2°	109.5°
C29	C28	H281	108.6°	109.5°
C29	C28	H282	108.6°	109.4°
C28	C29	H29	107.7°	109.5°
C14	C15	N16	112.2°	109.4°
C15	C14	H141	108.7°	109.5°
C15	C14	H142	108.7°	109.5°
C14	C15	H151	108.8°	109.4°
C14	C15	H152	108.8°	109.5°
C20	C19	H191	108.5°	109.5°
C20	C19	H192	108.5°	109.4°
C19	C20	H201	108.2°	109.4°
C19	C20	H202	108.2°	109.5°
C15	N16	H16	118.0°	120.1°
N16	C15	H151	108.8°	109.5°
N16	C15	H152	108.8°	109.5°
H211	C21	H212	109.5°	109.5°
H281	C28	H282	109.5°	109.4°
H11C	C1	H12C	109.5°	109.5°
H11C	C1	H13C	109.5°	109.5°
H12C	C1	H13C	109.4°	109.5°
H141	C14	H142	109.4°	109.5°
H191	C19	H192	109.5°	109.5°
H201	C20	H202	109.5°	109.5°
H151	C15	H152	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C24	C23	C22	H23	180.0°	179.7°
C24	C23	C22	C27	0.5°	0.1°
C23	C24	C25	H24	180.0°	179.9°
C23	C24	C25	C26	0.5°	0.0°
C24	C23	C22	C21	179.4°	180.0°
C23	C24	C25	C28	179.9°	179.9°
C23	C22	C27	C26	0.9°	0.1°
C23	C22	C27	C21	179.0°	180.0°
C22	C23	C24	C25	0.3°	0.0°
C23	C22	C21	C20	121.6°	90.0°
C22	C23	C24	H24	179.8°	180.0°
C23	C22	C27	H27	179.1°	180.0°
C23	C22	C21	H211	0.7°	150.1°
C23	C22	C21	H212	117.4°	30.0°
C26	C27	C22	H27	180.0°	179.9°
C27	C26	C25	C24	0.1°	0.1°
C27	C26	C25	H26	180.0°	180.0°
C26	C27	C22	C21	179.9°	179.9°
C27	C26	C25	C28	179.7°	179.9°
C22	C27	C26	C25	0.7°	0.1°
C27	C22	C21	C20	59.4°	90.0°
C27	C22	C23	H23	179.6°	179.7°
C22	C27	C26	H26	179.3°	179.9°
C27	C22	C21	H211	179.6°	30.0°
C27	C22	C21	H212	61.6°	150.0°
C24	C25	C26	C28	179.6°	180.0°
C24	C25	C28	C29	121.4°	90.0°
C25	C24	C23	H23	179.7°	179.7°
C24	C25	C26	H26	179.9°	180.0°
C24	C25	C28	H281	0.9°	150.0°
C24	C25	C28	H282	118.1°	30.0°
C26	C25	C28	C29	58.2°	90.1°
C26	C25	C24	H24	179.5°	180.0°
C25	C26	C27	H27	179.3°	180.0°
C26	C25	C28	H281	178.7°	30.0°
C26	C25	C28	H282	62.3°	150.0°
C6	C5	C4	H5	180.0°	179.7°
C5	C6	C7	H6	180.0°	179.9°
C5	C6	C7	C8	0.0°	0.1°
C6	C5	C4	C9	0.1°	0.1°
C6	C5	C4	N3	179.7°	180.0°
C5	C6	C7	N11	179.7°	180.0°
C4	C5	C6	C7	0.1°	0.1°
C5	C4	C9	C8	0.0°	0.1°
C5	C4	C9	N3	179.8°	179.9°
C5	C4	C9	S10	179.8°	180.0°
C5	C4	N3	C2	179.9°	180.0°
C4	C5	C6	H6	179.9°	180.0°
C6	C7	C8	N11	179.7°	180.0°
C6	C7	C8	C9	0.1°	0.1°
C6	C7	N11	C12	145.5°	144.8°
C7	C6	C5	H5	179.9°	179.8°
C6	C7	C8	H8	179.9°	180.0°
C6	C7	N11	H11	34.5°	35.1°
C7	C8	C9	H8	180.0°	179.9°
C7	C8	C9	C4	0.1°	0.1°
C7	C8	C9	S10	179.9°	180.0°
C8	C7	N11	C12	34.8°	35.1°
C8	C7	C6	H6	180.0°	180.0°
C8	C7	N11	H11	145.2°	144.9°
C8	C9	C4	S10	179.8°	180.0°
C8	C9	C4	N3	179.8°	180.0°
C9	C8	C7	N11	179.8°	180.0°
C8	C9	S10	C2	179.9°	180.0°
C22	C21	C20	H211	121.0°	120.0°
C22	C21	C20	H212	121.0°	120.0°
C22	C21	C20	C19	156.9°	180.0°
C21	C22	C23	H23	0.6°	0.3°
C21	C22	C27	H27	0.1°	0.1°
C22	C21	H211	H212	117.0°	120.0°
C22	C21	C20	H201	36.1°	60.0°
C22	C21	C20	H202	82.4°	60.0°
C25	C28	C29	C30	58.4°	65.1°
C25	C28	C29	C33	178.5°	175.0°
C25	C28	C29	H281	120.5°	120.1°
C25	C28	C29	H282	120.5°	120.0°
C28	C25	C24	H24	0.1°	0.0°
C28	C25	C26	H26	0.3°	0.1°
C25	C28	H281	H282	118.5°	120.0°
C25	C28	C29	H29	59.8°	55.0°
C9	C4	N3	C2	0.3°	0.1°
C4	C9	S10	C2	0.3°	0.0°
C9	C4	C5	H5	179.9°	179.8°
C4	C9	C8	H8	179.9°	180.0°
N3	C4	C9	S10	0.4°	0.0°
C4	N3	C2	C1	179.8°	180.0°
C4	N3	C2	S10	0.1°	0.0°
N3	C4	C5	H5	0.3°	0.3°
C7	N11	C12	C14	175.6°	175.4°
C7	N11	C12	H11	180.0°	180.0°
C7	N11	C12	O13	4.5°	4.7°
N11	C7	C6	H6	0.3°	0.0°
N11	C7	C8	H8	0.2°	0.0°
C9	S10	C2	C1	180.0°	179.9°
C9	S10	C2	N3	0.1°	0.0°
S10	C9	C8	H8	0.1°	0.0°
C1	C2	N3	S10	179.8°	179.9°
C2	C1	H11C	H12C	120.0°	120.0°
C2	C1	H11C	H13C	120.0°	120.0°
C2	C1	H12C	H13C	120.0°	119.9°
N3	C2	C1	H11C	0.0°	90.0°
N3	C2	C1	H12C	120.0°	150.0°
N3	C2	C1	H13C	120.0°	30.0°
S10	C2	C1	H11C	179.8°	89.9°
S10	C2	C1	H12C	60.1°	30.1°
S10	C2	C1	H13C	59.8°	150.1°
C14	C12	N11	O13	180.0°	179.9°
C12	C14	C15	H141	120.5°	120.0°
C12	C14	C15	H142	120.5°	120.0°
C12	C14	C15	N16	64.4°	180.0°
C14	C12	N11	H11	4.4°	4.6°
C12	C14	H141	H142	118.6°	119.9°
C12	C14	C15	H151	175.2°	60.0°
C12	C14	C15	H152	56.0°	60.0°
N11	C12	C14	C15	175.9°	180.0°
N11	C12	C14	H141	63.6°	60.0°
N11	C12	C14	H142	55.4°	60.0°
O13	C12	C14	C15	4.1°	0.0°
O13	C12	N11	H11	175.5°	175.3°
O13	C12	C14	H141	116.4°	119.9°
O13	C12	C14	H142	124.6°	120.1°
C19	C17	N16	O18	179.3°	180.0°
C17	C19	C20	C21	175.9°	180.0°
C17	C19	C20	H191	120.5°	120.0°
C17	C19	C20	H192	120.6°	119.9°
C19	C17	N16	C15	164.7°	180.0°
C17	C19	H191	H192	118.3°	120.0°
C19	C17	N16	H16	15.3°	0.0°
C17	C19	C20	H201	63.3°	60.0°
C17	C19	C20	H202	55.2°	60.0°
C17	N16	C15	C14	104.5°	180.0°
N16	C17	C19	C20	168.1°	180.0°
C17	N16	C15	H16	180.0°	180.0°
N16	C17	C19	H191	71.3°	60.0°
N16	C17	C19	H192	47.5°	60.1°
C17	N16	C15	H151	15.9°	60.0°
C17	N16	C15	H152	135.1°	60.1°
O18	C17	C19	C20	12.5°	0.0°
O18	C17	N16	C15	14.6°	0.0°
O18	C17	C19	H191	108.0°	120.0°
O18	C17	C19	H192	133.1°	119.9°
O18	C17	N16	H16	165.4°	180.0°
C29	C30	O31	O32	179.9°	180.0°
C30	C29	C33	C28	123.8°	120.0°
C30	C29	C33	H29	117.7°	120.0°
C30	C29	C33	O34	166.2°	120.0°
C30	C29	C33	O35	13.1°	60.0°
C30	C29	C28	H29	118.2°	120.0°
C30	C29	C28	H281	62.1°	55.0°
C30	C29	C28	H282	178.9°	175.0°
C29	C30	O32	H32	179.9°	180.0°
O31	C30	C29	C33	96.0°	0.0°
O31	C30	C29	C28	139.7°	120.0°
O31	C30	C29	H29	21.7°	120.0°
O31	C30	O32	H32	0.0°	0.0°
O32	C30	C29	C33	84.1°	180.0°
O32	C30	C29	C28	40.2°	60.0°
O32	C30	C29	H29	158.2°	60.0°
C29	C33	O34	O35	179.3°	180.0°
C33	C29	C28	H29	118.7°	120.0°
C33	C29	C28	H281	61.0°	64.9°
C33	C29	C28	H282	58.0°	55.0°
C29	C33	O35	H35	179.4°	180.0°
O34	C33	C29	C28	70.0°	0.0°
O34	C33	C29	H29	48.5°	120.0°
O34	C33	O35	H35	0.0°	0.0°
O35	C33	C29	C28	110.7°	180.0°
O35	C33	C29	H29	130.8°	60.0°
C21	C20	C19	H201	120.7°	120.0°
C21	C20	C19	H202	120.8°	120.0°
C20	C21	H211	H212	117.0°	120.0°
C21	C20	C19	H191	63.5°	60.0°
C21	C20	C19	H192	55.4°	60.1°
C21	C20	H201	H202	117.7°	120.0°
C29	C28	H281	H282	118.5°	119.9°
C14	C15	N16	H151	120.4°	120.0°
C14	C15	N16	H152	120.4°	120.0°
C15	C14	H141	H142	118.6°	120.1°
C14	C15	N16	H16	75.5°	0.0°
C14	C15	H151	H152	118.8°	120.0°
C19	C20	C21	H211	82.2°	60.0°
C19	C20	C21	H212	35.9°	59.9°
C20	C19	H191	H192	118.3°	120.0°
C19	C20	H201	H202	117.7°	120.1°
N16	C15	C14	H141	56.1°	60.0°
N16	C15	C14	H142	175.2°	60.0°
N16	C15	H151	H152	118.7°	120.1°
H23	C23	C24	H24	0.2°	0.4°
H27	C27	C26	H26	0.7°	0.1°
H5	C5	C6	H6	0.1°	0.3°
H211	C21	C20	H201	157.1°	180.0°
H211	C21	C20	H202	38.6°	60.0°
H212	C21	C20	H201	84.8°	60.0°
H212	C21	C20	H202	156.6°	NaN°
H281	C28	C29	H29	179.7°	175.1°
H282	C28	C29	H29	60.7°	65.0°
H11C	C1	H12C	H13C	120.0°	120.1°
H141	C14	C15	H151	64.3°	180.0°
H141	C14	C15	H152	176.5°	60.0°
H142	C14	C15	H151	54.8°	60.0°
H142	C14	C15	H152	64.4°	180.0°
H191	C19	C20	H201	57.2°	60.0°
H191	C19	C20	H202	175.7°	180.0°
H192	C19	C20	H201	176.1°	180.0°
H192	C19	C20	H202	65.4°	59.9°
H16	N16	C15	H151	164.1°	120.0°
H16	N16	C15	H152	44.9°	120.0°

Definition date:	2012-02-16
Last modified:	2014-09-14
Release status:	OBS
Processing site:	EBI
Replaced by:	88N
Derived from:	4AJP