OLS

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O04	C13	doub	0.00Å	1.26Å
C13	N03	sing	0.00Å	1.30Å
C13	N02	sing	0.00Å	1.29Å
N03	C11	sing	0.00Å	1.45Å
C11	C10	sing	0.00Å	1.58Å
C11	C12	sing	0.00Å	1.60Å
C10	S01	sing	0.00Å	1.78Å
S01	C09	sing	0.00Å	1.76Å
N02	C12	sing	0.00Å	1.46Å
C12	C09	sing	0.00Å	1.52Å
C09	C08	sing	0.00Å	1.54Å
C08	C07	sing	0.00Å	1.51Å
C07	C06	sing	0.00Å	1.54Å
C06	C05	sing	0.00Å	1.54Å
C05	C01	sing	0.00Å	1.52Å
C01	O01	doub	0.00Å	1.28Å
C01	N01	sing	0.00Å	1.33Å
N01	C02	sing	0.00Å	1.45Å
C02	C37	sing	0.00Å	1.49Å
C37	C04	sing	0.00Å	1.46Å
C04	O14	sing	0.00Å	1.30Å
C04	O03	sing	0.00Å	1.34Å
O14	CO2	sing	0.00Å	2.12Å
O03	CO4	sing	0.00Å	1.99Å
CO4	O05	sing	0.00Å	1.85Å
CO4	O07	sing	0.00Å	2.15Å
CO4	N07	sing	0.00Å	2.27Å
CO4	O12	sing	0.00Å	2.03Å
CO4	O15	sing	0.00Å	2.27Å
O05	CO1	sing	0.00Å	2.11Å
O05	CO2	sing	0.00Å	2.20Å
O07	CO1	sing	0.00Å	1.91Å
O07	CO3	sing	0.00Å	1.98Å
N07	C44	doub	0.00Å	1.34Å	Aromatic
N07	C40	sing	0.00Å	1.39Å	Aromatic
C44	C43	sing	0.00Å	1.42Å	Aromatic
C43	C42	doub	0.00Å	1.41Å	Aromatic
C42	C41	sing	0.00Å	1.35Å	Aromatic
C41	C40	doub	0.00Å	1.34Å	Aromatic
CO1	N04	sing	0.00Å	2.36Å
CO1	O10	sing	0.00Å	2.31Å
CO1	O06	sing	0.00Å	1.91Å
CO1	O08	sing	0.00Å	1.82Å
N04	C22	doub	0.00Å	1.37Å	Aromatic
N04	C18	sing	0.00Å	1.38Å	Aromatic
C22	C21	sing	0.00Å	1.41Å	Aromatic
C21	C20	doub	0.00Å	1.42Å	Aromatic
C20	C19	sing	0.00Å	1.31Å	Aromatic
C19	C18	doub	0.00Å	1.31Å	Aromatic
O12	CO3	sing	0.00Å	1.94Å
O12	CO2	sing	0.00Å	1.68Å
CO3	N06	sing	0.00Å	2.19Å
CO3	O06	sing	0.00Å	2.03Å
N06	C34	doub	0.00Å	1.38Å	Aromatic
N06	C28	sing	0.00Å	1.35Å	Aromatic
C34	C35	sing	0.00Å	1.32Å	Aromatic
C35	C30	doub	0.00Å	1.31Å	Aromatic
C30	C29	sing	0.00Å	1.42Å	Aromatic
C29	C28	doub	0.00Å	1.41Å	Aromatic
O06	CO2	sing	0.00Å	2.06Å
CO2	O09	sing	0.00Å	1.99Å
CO2	N05	sing	0.00Å	2.13Å
N05	C32	doub	0.00Å	1.38Å	Aromatic
N05	C24	sing	0.00Å	1.36Å	Aromatic
C32	C33	sing	0.00Å	1.43Å	Aromatic
C33	C26	doub	0.00Å	1.42Å	Aromatic
C26	C25	sing	0.00Å	1.43Å	Aromatic
C25	C24	doub	0.00Å	1.41Å	Aromatic
N03	H1	sing	0.00Å	1.00Å
C11	H2	sing	0.00Å	1.10Å
C10	H3	sing	0.00Å	1.10Å
C10	H4	sing	0.00Å	1.10Å
N02	H5	sing	0.00Å	1.00Å
C12	H6	sing	0.00Å	1.10Å
C09	H7	sing	0.00Å	1.10Å
C08	H8	sing	0.00Å	1.10Å
C08	H9	sing	0.00Å	1.10Å
C07	H10	sing	0.00Å	1.10Å
C07	H11	sing	0.00Å	1.10Å
C06	H12	sing	0.00Å	1.10Å
C06	H13	sing	0.00Å	1.10Å
C05	H14	sing	0.00Å	1.10Å
C05	H15	sing	0.00Å	1.10Å
N01	H16	sing	0.00Å	1.00Å
C02	H17	sing	0.00Å	1.10Å
C02	H18	sing	0.00Å	1.10Å
C37	H19	sing	0.00Å	1.10Å
C37	H20	sing	0.00Å	1.10Å
C04	H21	sing	0.00Å	1.10Å
C44	H22	sing	0.00Å	1.08Å
C43	H23	sing	0.00Å	1.08Å
C42	H24	sing	0.00Å	1.08Å
C41	H25	sing	0.00Å	1.08Å
C40	H26	sing	0.00Å	1.08Å
C22	H27	sing	0.00Å	1.08Å
C21	H28	sing	0.00Å	1.08Å
C20	H29	sing	0.00Å	1.08Å
C19	H30	sing	0.00Å	1.08Å
C18	H31	sing	0.00Å	1.08Å
C34	H32	sing	0.00Å	1.08Å
C35	H33	sing	0.00Å	1.08Å
C30	H34	sing	0.00Å	1.08Å
C29	H35	sing	0.00Å	1.08Å
C28	H36	sing	0.00Å	1.08Å
C32	H41	sing	0.00Å	1.08Å
C33	H42	sing	0.00Å	1.08Å
C26	H43	sing	0.00Å	1.08Å
C25	H44	sing	0.00Å	1.08Å
C24	H45	sing	0.00Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O04	C13	N03	120.8°	90.0°
O04	C13	N02	124.5°	90.0°
N03	C13	N02	114.7°	90.0°
C13	N03	C11	109.9°	90.0°
C13	N03	H1	125.0°	90.0°
C13	N02	C12	112.0°	90.0°
C13	N02	H5	124.0°	90.0°
N03	C11	C10	111.4°	90.0°
N03	C11	C12	103.2°	90.0°
C11	N03	H1	125.0°	90.0°
N03	C11	H2	114.3°	90.0°
C10	C11	C12	102.7°	90.0°
C11	C10	S01	107.3°	90.0°
C10	C11	H2	112.2°	90.0°
C11	C10	H3	110.0°	90.0°
C11	C10	H4	110.0°	90.0°
C11	C12	N02	99.9°	90.0°
C11	C12	C09	111.3°	90.0°
C12	C11	H2	112.0°	90.0°
C11	C12	H6	109.3°	90.0°
C10	S01	C09	90.0°	90.0°
S01	C10	H3	110.0°	90.0°
S01	C10	H4	110.0°	90.0°
S01	C09	C12	105.1°	90.0°
S01	C09	C08	118.9°	90.0°
S01	C09	H7	105.3°	90.0°
N02	C12	C09	114.6°	90.0°
C12	N02	H5	124.0°	90.0°
N02	C12	H6	111.1°	90.0°
C12	C09	C08	111.7°	90.0°
C09	C12	H6	110.2°	90.0°
C12	C09	H7	107.7°	90.0°
C09	C08	C07	109.3°	90.0°
C08	C09	H7	107.5°	90.0°
C09	C08	H8	109.5°	90.0°
C09	C08	H9	109.5°	90.0°
C08	C07	C06	110.6°	90.0°
C07	C08	H8	109.5°	90.0°
C07	C08	H9	109.5°	90.0°
C08	C07	H10	109.2°	90.0°
C08	C07	H11	109.2°	90.0°
C07	C06	C05	113.0°	90.0°
C06	C07	H10	109.2°	90.0°
C06	C07	H11	109.2°	90.0°
C07	C06	H12	108.6°	90.0°
C07	C06	H13	108.6°	90.0°
C06	C05	C01	110.5°	90.0°
C05	C06	H12	108.6°	90.0°
C05	C06	H13	108.6°	90.0°
C06	C05	H14	109.2°	90.0°
C06	C05	H15	109.2°	90.0°
C05	C01	O01	119.7°	90.0°
C05	C01	N01	114.7°	90.0°
C01	C05	H14	109.2°	90.0°
C01	C05	H15	109.2°	90.0°
O01	C01	N01	125.7°	90.0°
C01	N01	C02	119.6°	90.0°
C01	N01	H16	120.2°	90.0°
N01	C02	C37	106.6°	90.0°
C02	N01	H16	120.2°	90.0°
N01	C02	H17	110.2°	90.0°
N01	C02	H18	110.2°	90.0°
C02	C37	C04	107.7°	90.0°
C37	C02	H17	110.2°	90.0°
C37	C02	H18	110.2°	90.0°
C02	C37	H19	109.9°	90.0°
C02	C37	H20	109.9°	90.0°
C37	C04	O14	109.2°	90.0°
C37	C04	O03	118.8°	90.0°
C04	C37	H19	109.9°	90.0°
C04	C37	H20	109.9°	90.0°
C37	C04	H21	92.2°	90.0°
O14	C04	O03	131.5°	90.0°
C04	O14	CO2	116.3°	90.0°
O14	C04	H21	92.5°	90.0°
C04	O03	CO4	120.4°	90.0°
O03	C04	H21	92.4°	90.0°
O14	CO2	O05	87.4°	90.0°
O14	CO2	O12	92.0°	90.0°
O14	CO2	O06	174.7°	90.0°
O14	CO2	O09	85.6°	90.0°
O14	CO2	N05	88.3°	90.0°
O03	CO4	O05	89.1°	90.0°
O03	CO4	O07	173.3°	90.0°
O03	CO4	N07	92.1°	90.0°
O03	CO4	O12	91.0°	90.0°
O03	CO4	O15	88.1°	90.0°
O05	CO4	O07	85.3°	90.0°
O05	CO4	N07	85.5°	90.0°
O05	CO4	O12	91.8°	90.0°
O05	CO4	O15	176.1°	90.0°
CO4	O05	CO1	94.9°	90.0°
CO4	O05	CO2	83.4°	90.0°
O07	CO4	N07	91.1°	90.0°
O07	CO4	O12	85.6°	90.0°
O07	CO4	O15	97.6°	90.0°
CO4	O07	CO1	92.1°	90.0°
CO4	O07	CO3	86.0°	90.0°
N07	CO4	O12	175.9°	90.0°
N07	CO4	O15	91.8°	90.0°
CO4	N07	C44	106.2°	90.0°
CO4	N07	C40	130.7°	90.0°
O12	CO4	O15	91.1°	90.0°
CO4	O12	CO3	90.4°	90.0°
CO4	O12	CO2	93.2°	90.0°
CO1	O05	CO2	79.7°	90.0°
O05	CO1	O07	85.2°	90.0°
O05	CO1	N04	84.2°	90.0°
O05	CO1	O10	169.0°	90.0°
O05	CO1	O06	99.2°	90.0°
O05	CO1	O08	91.6°	90.0°
O05	CO2	O12	91.1°	90.0°
O05	CO2	O06	92.0°	90.0°
O05	CO2	O09	89.8°	90.0°
O05	CO2	N05	174.7°	90.0°
CO1	O07	CO3	95.8°	90.0°
O07	CO1	N04	95.1°	90.0°
O07	CO1	O10	84.8°	90.0°
O07	CO1	O06	87.7°	90.0°
O07	CO1	O08	173.4°	90.0°
O07	CO3	O12	93.1°	90.0°
O07	CO3	N06	178.5°	90.0°
O07	CO3	O06	82.5°	90.0°
C44	N07	C40	123.0°	90.0°
N07	C44	C43	116.9°	90.0°
N07	C44	H22	121.5°	90.0°
N07	C40	C41	116.4°	90.0°
N07	C40	H26	121.8°	90.0°
C44	C43	C42	122.6°	90.0°
C43	C44	H22	121.5°	90.0°
C44	C43	H23	118.7°	90.0°
C43	C42	C41	114.0°	90.0°
C42	C43	H23	118.7°	90.0°
C43	C42	H24	123.0°	90.0°
C42	C41	C40	127.1°	90.0°
C41	C42	H24	123.0°	90.0°
C42	C41	H25	116.5°	90.0°
C40	C41	H25	116.4°	90.0°
C41	C40	H26	121.8°	90.0°
N04	CO1	O10	92.0°	90.0°
N04	CO1	O06	175.7°	90.0°
N04	CO1	O08	90.3°	90.0°
CO1	N04	C22	106.4°	90.0°
CO1	N04	C18	130.7°	90.0°
O10	CO1	O06	85.1°	90.0°
O10	CO1	O08	98.8°	90.0°
O06	CO1	O08	87.1°	90.0°
CO1	O06	CO3	93.8°	90.0°
CO1	O06	CO2	87.9°	90.0°
C22	N04	C18	122.7°	90.0°
N04	C22	C21	115.2°	90.0°
N04	C22	H27	122.4°	90.0°
N04	C18	C19	121.2°	90.0°
N04	C18	H31	119.4°	90.0°
C22	C21	C20	118.8°	90.0°
C21	C22	H27	122.4°	90.0°
C22	C21	H28	120.6°	90.0°
C21	C20	C19	122.3°	90.0°
C20	C21	H28	120.6°	90.0°
C21	C20	H29	118.8°	90.0°
C20	C19	C18	119.6°	90.0°
C19	C20	H29	118.9°	90.0°
C20	C19	H30	120.2°	90.0°
C18	C19	H30	120.2°	90.0°
C19	C18	H31	119.4°	90.0°
CO3	O12	CO2	107.8°	90.0°
O12	CO3	N06	87.3°	90.0°
O12	CO3	O06	77.6°	90.0°
O12	CO2	O06	82.8°	90.0°
O12	CO2	O09	177.4°	90.0°
O12	CO2	N05	92.1°	90.0°
N06	CO3	O06	96.1°	90.0°
CO3	N06	C34	116.0°	90.0°
CO3	N06	C28	121.5°	90.0°
CO3	O06	CO2	91.3°	90.0°
C34	N06	C28	122.5°	90.0°
N06	C34	C35	121.1°	90.0°
N06	C34	H32	119.4°	90.0°
N06	C28	C29	115.8°	90.0°
N06	C28	H36	122.1°	90.0°
C34	C35	C30	120.3°	90.0°
C35	C34	H32	119.4°	90.0°
C34	C35	H33	119.9°	90.0°
C35	C30	C29	121.3°	90.0°
C30	C35	H33	119.8°	90.0°
C35	C30	H34	119.4°	90.0°
C30	C29	C28	118.9°	90.0°
C29	C30	H34	119.3°	90.0°
C30	C29	H35	120.5°	90.0°
C28	C29	H35	120.5°	90.0°
C29	C28	H36	122.1°	90.0°
O06	CO2	O09	99.6°	90.0°
O06	CO2	N05	92.6°	90.0°
O09	CO2	N05	86.8°	90.0°
CO2	N05	C32	113.6°	90.0°
CO2	N05	C24	122.2°	90.0°
C32	N05	C24	124.2°	90.0°
N05	C32	C33	118.7°	90.0°
N05	C32	H41	120.6°	90.0°
N05	C24	C25	118.3°	90.0°
N05	C24	H45	120.9°	90.0°
C32	C33	C26	119.0°	90.0°
C33	C32	H41	120.6°	90.0°
C32	C33	H42	120.6°	90.0°
C33	C26	C25	119.6°	90.0°
C26	C33	H42	120.5°	90.0°
C33	C26	H43	120.2°	90.0°
C26	C25	C24	120.2°	90.0°
C25	C26	H43	120.2°	90.0°
C26	C25	H44	119.9°	90.0°
C24	C25	H44	119.9°	90.0°
C25	C24	H45	120.9°	90.0°
H3	C10	H4	109.4°	90.0°
H8	C08	H9	109.5°	90.0°
H10	C07	H11	109.4°	90.0°
H12	C06	H13	109.5°	90.0°
H14	C05	H15	109.5°	90.0°
H17	C02	H18	109.5°	90.0°
H19	C37	H20	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O04	C13	N03	N02	179.1°	90.0°
O04	C13	N03	C11	178.5°	90.0°
O04	C13	N02	C12	178.1°	90.0°
O04	C13	N03	H1	1.5°	90.0°
O04	C13	N02	H5	1.8°	90.0°
C13	N03	C11	H1	180.0°	90.0°
C13	N03	C11	C10	113.8°	90.0°
C13	N03	C11	C12	4.2°	90.0°
N03	C13	N02	C12	1.0°	90.0°
C13	N03	C11	H2	117.7°	90.0°
N03	C13	N02	H5	179.1°	90.0°
N02	C13	N03	C11	2.3°	90.0°
C13	N02	C12	C11	3.4°	90.0°
C13	N02	C12	H5	180.0°	90.0°
C13	N02	C12	C09	115.6°	90.0°
N02	C13	N03	H1	177.7°	90.0°
C13	N02	C12	H6	118.6°	90.0°
N03	C11	C10	C12	109.9°	90.0°
N03	C11	C10	H2	129.6°	90.0°
N03	C11	C12	H2	123.5°	90.0°
N03	C11	C10	S01	80.0°	90.0°
N03	C11	C12	N02	4.3°	90.0°
N03	C11	C12	C09	117.1°	90.0°
N03	C11	C10	H3	160.3°	90.0°
N03	C11	C10	H4	39.6°	90.0°
N03	C11	C12	H6	121.0°	90.0°
C10	C11	C12	H2	120.6°	90.0°
C11	C10	S01	H3	119.7°	90.0°
C11	C10	S01	H4	119.7°	90.0°
C11	C10	S01	C09	44.2°	90.0°
C10	C11	C12	N02	120.3°	90.0°
C10	C11	C12	C09	1.2°	90.0°
C10	C11	N03	H1	66.2°	90.0°
C11	C10	H3	H4	121.0°	90.0°
C10	C11	C12	H6	123.1°	90.0°
C12	C11	C10	S01	29.9°	90.0°
C11	C12	C09	S01	31.8°	90.0°
C11	C12	N02	C09	119.0°	90.0°
C11	C12	N02	H6	115.3°	90.0°
C11	C12	C09	H6	121.4°	90.0°
C11	C12	C09	C08	162.1°	90.0°
C12	C11	N03	H1	175.8°	90.0°
C12	C11	C10	H3	89.8°	90.0°
C12	C11	C10	H4	149.5°	90.0°
C11	C12	N02	H5	176.7°	90.0°
C11	C12	C09	H7	80.1°	90.0°
C10	S01	C09	C12	43.5°	90.0°
C10	S01	C09	C08	169.4°	90.0°
S01	C10	C11	H2	150.3°	90.0°
S01	C10	H3	H4	120.9°	90.0°
C10	S01	C09	H7	70.1°	90.0°
S01	C09	C12	N02	80.6°	90.0°
S01	C09	C12	C08	130.3°	90.0°
S01	C09	C12	H7	111.9°	90.0°
S01	C09	C08	H7	119.3°	90.0°
S01	C09	C08	C07	71.2°	90.0°
C09	S01	C10	H3	75.5°	90.0°
C09	S01	C10	H4	163.8°	90.0°
S01	C09	C12	H6	153.2°	90.0°
S01	C09	C08	H8	48.8°	90.0°
S01	C09	C08	H9	168.9°	90.0°
N02	C12	C09	H6	126.2°	90.0°
N02	C12	C09	C08	49.7°	90.0°
N02	C12	C11	H2	119.2°	90.0°
N02	C12	C09	H7	167.5°	90.0°
C12	C09	C08	H7	118.0°	90.0°
C12	C09	C08	C07	166.1°	90.0°
C09	C12	C11	H2	119.4°	90.0°
C09	C12	N02	H5	64.3°	90.0°
C12	C09	C08	H8	74.0°	90.0°
C12	C09	C08	H9	46.2°	90.0°
C09	C08	C07	H8	120.0°	90.0°
C09	C08	C07	H9	120.0°	90.0°
C09	C08	C07	C06	177.3°	90.0°
C08	C09	C12	H6	76.5°	90.0°
C09	C08	H8	H9	120.1°	90.0°
C09	C08	C07	H10	62.5°	90.0°
C09	C08	C07	H11	57.1°	90.0°
C08	C07	C06	H10	120.2°	90.0°
C08	C07	C06	H11	120.2°	90.0°
C08	C07	C06	C05	179.0°	90.0°
C07	C08	C09	H7	48.1°	90.0°
C07	C08	H8	H9	120.1°	90.0°
C08	C07	H10	H11	119.5°	90.0°
C08	C07	C06	H12	60.5°	90.0°
C08	C07	C06	H13	58.4°	90.0°
C07	C06	C05	H12	120.5°	90.0°
C07	C06	C05	H13	120.5°	90.0°
C07	C06	C05	C01	68.3°	90.0°
C06	C07	C08	H8	57.4°	90.0°
C06	C07	C08	H9	62.7°	90.0°
C06	C07	H10	H11	119.5°	90.0°
C07	C06	H12	H13	118.4°	90.0°
C07	C06	C05	H14	51.8°	90.0°
C07	C06	C05	H15	171.5°	90.0°
C06	C05	C01	H14	120.2°	90.0°
C06	C05	C01	H15	120.1°	90.0°
C06	C05	C01	O01	41.6°	90.0°
C06	C05	C01	N01	139.1°	90.0°
C05	C06	C07	H10	58.8°	90.0°
C05	C06	C07	H11	60.9°	90.0°
C05	C06	H12	H13	118.4°	90.0°
C06	C05	H14	H15	119.5°	90.0°
C05	C01	O01	N01	179.2°	90.0°
C05	C01	N01	C02	178.0°	90.0°
C01	C05	C06	H12	171.1°	90.0°
C01	C05	C06	H13	52.2°	90.0°
C01	C05	H14	H15	119.6°	90.0°
C05	C01	N01	H16	2.0°	90.0°
O01	C01	N01	C02	2.7°	90.0°
O01	C01	C05	H14	161.8°	90.0°
O01	C01	C05	H15	78.5°	90.0°
O01	C01	N01	H16	177.3°	90.0°
C01	N01	C02	H16	180.0°	90.0°
C01	N01	C02	C37	88.8°	90.0°
N01	C01	C05	H14	18.9°	90.0°
N01	C01	C05	H15	100.8°	90.0°
C01	N01	C02	H17	30.7°	90.0°
C01	N01	C02	H18	151.6°	90.0°
N01	C02	C37	H17	119.5°	90.0°
N01	C02	C37	H18	119.6°	90.0°
N01	C02	C37	C04	164.0°	90.0°
N01	C02	H17	H18	121.3°	90.0°
N01	C02	C37	H19	76.3°	90.0°
N01	C02	C37	H20	44.2°	90.0°
C02	C37	C04	H19	119.7°	90.0°
C02	C37	C04	H20	119.7°	90.0°
C02	C37	C04	O14	173.7°	90.0°
C02	C37	C04	O03	1.0°	90.0°
C37	C02	N01	H16	91.2°	90.0°
C37	C02	H17	H18	121.3°	90.0°
C02	C37	H19	H20	120.8°	90.0°
C02	C37	C04	H21	92.9°	90.0°
C37	C04	O14	O03	171.5°	90.0°
C37	C04	O14	H21	93.2°	90.0°
C37	C04	O03	H21	93.8°	90.0°
C37	C04	O14	CO2	175.6°	90.0°
C37	C04	O03	CO4	175.6°	90.0°
C04	C37	C02	H17	44.4°	90.0°
C04	C37	C02	H18	76.5°	90.0°
C04	C37	H19	H20	120.8°	90.0°
O14	C04	O03	H21	95.4°	90.0°
O14	C04	O03	CO4	4.8°	90.0°
C04	O14	CO2	O05	41.5°	90.0°
C04	O14	CO2	O12	49.5°	90.0°
C04	O14	CO2	O06	42.1°	90.0°
C04	O14	CO2	O09	131.5°	90.0°
C04	O14	CO2	N05	141.5°	90.0°
O14	C04	C37	H19	66.6°	90.0°
O14	C04	C37	H20	54.0°	90.0°
O03	C04	O14	CO2	4.1°	90.0°
C04	O03	CO4	O05	51.4°	90.0°
C04	O03	CO4	O07	18.2°	90.0°
C04	O03	CO4	N07	136.9°	90.0°
C04	O03	CO4	O12	40.4°	90.0°
C04	O03	CO4	O15	131.4°	90.0°
O03	C04	C37	H19	120.7°	90.0°
O03	C04	C37	H20	118.7°	90.0°
O14	CO2	O05	CO4	86.0°	90.0°
O14	CO2	O12	CO4	82.1°	90.0°
O14	CO2	O05	CO1	177.7°	90.0°
O14	CO2	O05	O12	91.9°	90.0°
O14	CO2	O05	O06	174.8°	90.0°
O14	CO2	O05	O09	85.6°	90.0°
O14	CO2	O05	N05	35.4°	90.0°
O14	CO2	O06	CO1	91.6°	90.0°
O14	CO2	O12	CO3	173.6°	90.0°
O14	CO2	O12	O06	179.3°	90.0°
O14	CO2	O12	O09	21.7°	90.0°
O14	CO2	O12	N05	88.3°	90.0°
O14	CO2	O06	CO3	2.2°	90.0°
O14	CO2	O06	O09	173.5°	90.0°
O14	CO2	O06	N05	99.3°	90.0°
O14	CO2	O09	N05	88.5°	90.0°
O14	CO2	N05	C32	43.4°	90.0°
O14	CO2	N05	C24	134.5°	90.0°
CO2	O14	C04	H21	91.3°	90.0°
O03	CO4	O05	O07	176.3°	90.0°
O03	CO4	O05	N07	92.2°	90.0°
O03	CO4	O05	O12	90.9°	90.0°
O03	CO4	O05	O15	45.2°	90.0°
O03	CO4	O07	N07	118.7°	90.0°
O03	CO4	O07	O12	58.8°	90.0°
O03	CO4	O07	O15	149.3°	90.0°
O03	CO4	N07	O12	137.9°	90.0°
O03	CO4	N07	O15	88.2°	90.0°
O03	CO4	O12	O15	88.2°	90.0°
O03	CO4	O05	CO1	165.0°	90.0°
O03	CO4	O05	CO2	86.1°	90.0°
O03	CO4	O07	CO1	20.9°	90.0°
O03	CO4	O07	CO3	74.8°	90.0°
O03	CO4	N07	C44	39.4°	90.0°
O03	CO4	N07	C40	145.9°	90.0°
O03	CO4	O12	CO3	169.4°	90.0°
O03	CO4	O12	CO2	82.8°	90.0°
CO4	O03	C04	H21	90.6°	90.0°
O05	CO4	O07	N07	85.4°	90.0°
O05	CO4	O07	O12	92.2°	90.0°
O05	CO4	O07	O15	177.4°	90.0°
O05	CO4	N07	O12	49.0°	90.0°
O05	CO4	N07	O15	177.1°	90.0°
O05	CO4	O12	O15	177.3°	90.0°
CO4	O05	CO1	CO2	82.3°	90.0°
O05	CO4	O07	CO1	12.5°	90.0°
O05	CO4	O07	CO3	108.2°	90.0°
O05	CO4	N07	C44	49.5°	90.0°
O05	CO4	N07	C40	125.2°	90.0°
CO4	O05	CO1	N04	108.4°	90.0°
CO4	O05	CO1	O10	38.2°	90.0°
CO4	O05	CO1	O06	74.1°	90.0°
CO4	O05	CO1	O08	161.5°	90.0°
O05	CO4	O12	CO3	101.5°	90.0°
O05	CO4	O12	CO2	6.4°	90.0°
CO4	O05	CO2	O06	88.7°	90.0°
CO4	O05	CO2	O09	171.6°	90.0°
CO4	O05	CO2	N05	121.4°	90.0°
O07	CO4	N07	O12	36.3°	90.0°
O07	CO4	N07	O15	97.7°	90.0°
O07	CO4	O12	O15	97.6°	90.0°
O07	CO4	O05	CO2	90.3°	90.0°
CO4	O07	CO1	CO3	86.2°	90.0°
O07	CO4	N07	C44	134.7°	90.0°
O07	CO4	N07	C40	40.0°	90.0°
CO4	O07	CO1	N04	94.7°	90.0°
CO4	O07	CO1	O10	173.8°	90.0°
CO4	O07	CO1	O06	88.5°	90.0°
CO4	O07	CO1	O08	50.3°	90.0°
O07	CO4	O12	CO3	16.3°	90.0°
O07	CO4	O12	CO2	91.5°	90.0°
CO4	O07	CO3	N06	121.3°	90.0°
CO4	O07	CO3	O06	93.9°	90.0°
N07	CO4	O12	O15	133.9°	90.0°
N07	CO4	O05	CO1	102.8°	90.0°
N07	CO4	O05	CO2	178.2°	90.0°
N07	CO4	O07	CO1	97.8°	90.0°
N07	CO4	O07	CO3	166.5°	90.0°
CO4	N07	C44	C40	175.2°	90.0°
CO4	N07	C44	C43	175.9°	90.0°
CO4	N07	C40	C41	176.1°	90.0°
N07	CO4	O12	CO3	52.7°	90.0°
N07	CO4	O12	CO2	55.2°	90.0°
CO4	N07	C44	H22	4.1°	90.0°
CO4	N07	C40	H26	3.9°	90.0°
O12	CO4	O05	CO1	74.1°	90.0°
O12	CO4	O07	CO1	79.7°	90.0°
O12	CO4	N07	C44	98.5°	90.0°
O12	CO4	N07	C40	76.2°	90.0°
CO4	O12	CO3	CO2	93.5°	90.0°
CO4	O12	CO3	N06	163.7°	90.0°
CO4	O12	CO3	O06	99.4°	90.0°
CO4	O12	CO2	O06	97.2°	90.0°
CO4	O12	CO2	O09	103.8°	90.0°
CO4	O12	CO2	N05	170.4°	90.0°
O15	CO4	O05	CO1	149.8°	90.0°
O15	CO4	O05	CO2	131.3°	90.0°
O15	CO4	O07	CO1	170.2°	90.0°
O15	CO4	O07	CO3	74.5°	90.0°
O15	CO4	N07	C44	127.6°	90.0°
O15	CO4	N07	C40	57.7°	90.0°
O15	CO4	O12	CO3	81.2°	90.0°
O15	CO4	O12	CO2	170.9°	90.0°
O05	CO1	O07	N04	83.8°	90.0°
O05	CO1	O07	O10	175.3°	90.0°
O05	CO1	O07	O06	99.5°	90.0°
O05	CO1	O07	O08	61.2°	90.0°
O05	CO1	O07	CO3	97.1°	90.0°
O05	CO1	N04	O10	169.6°	90.0°
O05	CO1	N04	O06	144.2°	90.0°
O05	CO1	N04	O08	91.6°	90.0°
O05	CO1	O10	O06	113.6°	90.0°
O05	CO1	O10	O08	160.1°	90.0°
O05	CO1	O06	O08	91.2°	90.0°
O05	CO1	N04	C22	127.2°	90.0°
O05	CO1	N04	C18	58.4°	90.0°
CO1	O05	CO2	O12	90.4°	90.0°
O05	CO1	O06	CO3	82.5°	90.0°
CO1	O05	CO2	O06	7.5°	90.0°
CO1	O05	CO2	O09	92.1°	90.0°
CO1	O05	CO2	N05	142.3°	90.0°
CO2	O05	CO1	O07	95.1°	90.0°
CO2	O05	CO1	N04	169.3°	90.0°
CO2	O05	CO1	O10	120.5°	90.0°
CO2	O05	CO1	O08	79.2°	90.0°
O05	CO2	O12	CO3	86.1°	90.0°
O05	CO2	O12	O06	91.9°	90.0°
O05	CO2	O12	O09	109.2°	90.0°
O05	CO2	O12	N05	175.8°	90.0°
O05	CO2	O06	CO3	85.6°	90.0°
O05	CO2	O06	O09	90.1°	90.0°
O05	CO2	O06	N05	177.3°	90.0°
O05	CO2	O09	N05	175.9°	90.0°
O05	CO2	N05	C32	78.7°	90.0°
O05	CO2	N05	C24	99.1°	90.0°
O07	CO1	N04	O10	85.0°	90.0°
O07	CO1	N04	O06	131.1°	90.0°
O07	CO1	N04	O08	176.2°	90.0°
O07	CO1	O10	O06	88.1°	90.0°
O07	CO1	O10	O08	174.5°	90.0°
O07	CO1	O06	O08	175.9°	90.0°
O07	CO1	N04	C22	42.6°	90.0°
O07	CO1	N04	C18	143.0°	90.0°
CO1	O07	CO3	O12	74.9°	90.0°
CO1	O07	CO3	N06	29.6°	90.0°
CO1	O07	CO3	O06	2.2°	90.0°
O07	CO1	O06	CO2	93.4°	90.0°
CO3	O07	CO1	N04	179.1°	90.0°
CO3	O07	CO1	O10	87.6°	90.0°
CO3	O07	CO1	O08	35.9°	90.0°
O07	CO3	O12	N06	178.5°	90.0°
O07	CO3	O12	O06	81.7°	90.0°
O07	CO3	O12	CO2	75.8°	90.0°
O07	CO3	N06	O06	27.4°	90.0°
O07	CO3	N06	C34	10.4°	90.0°
O07	CO3	N06	C28	169.4°	90.0°
O07	CO3	O06	CO2	90.2°	90.0°
N07	C44	C43	H22	180.0°	90.0°
N07	C44	C43	C42	1.2°	90.0°
C44	N07	C40	C41	2.1°	90.0°
N07	C44	C43	H23	178.8°	90.0°
C44	N07	C40	H26	177.9°	90.0°
C40	N07	C44	C43	0.7°	90.0°
N07	C40	C41	C42	1.9°	90.0°
N07	C40	C41	H26	180.0°	90.0°
C40	N07	C44	H22	179.3°	90.0°
N07	C40	C41	H25	178.1°	90.0°
C44	C43	C42	H23	180.0°	90.0°
C44	C43	C42	C41	1.4°	90.0°
C44	C43	C42	H24	178.6°	90.0°
C43	C42	C41	H24	180.0°	90.0°
C43	C42	C41	C40	0.2°	90.0°
C42	C43	C44	H22	178.8°	90.0°
C43	C42	C41	H25	179.8°	90.0°
C42	C41	C40	H25	180.0°	90.0°
C41	C42	C43	H23	178.6°	90.0°
C42	C41	C40	H26	178.1°	90.0°
C40	C41	C42	H24	179.8°	90.0°
N04	CO1	O10	O06	176.9°	90.0°
N04	CO1	O10	O08	90.6°	90.0°
N04	CO1	O06	O08	52.7°	90.0°
CO1	N04	C22	C18	175.0°	90.0°
CO1	N04	C22	C21	179.2°	90.0°
CO1	N04	C18	C19	177.9°	90.0°
N04	CO1	O06	CO3	133.6°	90.0°
N04	CO1	O06	CO2	135.3°	90.0°
CO1	N04	C22	H27	0.8°	90.0°
CO1	N04	C18	H31	2.1°	90.0°
O10	CO1	O06	O08	99.0°	90.0°
O10	CO1	N04	C22	42.4°	90.0°
O10	CO1	N04	C18	132.0°	90.0°
O10	CO1	O06	CO3	87.3°	90.0°
O10	CO1	O06	CO2	178.4°	90.0°
O06	CO1	N04	C22	88.6°	90.0°
O06	CO1	N04	C18	85.8°	90.0°
CO1	O06	CO3	O12	92.6°	90.0°
CO1	O06	CO2	O12	99.0°	90.0°
CO1	O06	CO3	N06	178.5°	90.0°
CO1	O06	CO3	CO2	88.0°	90.0°
CO1	O06	CO2	O09	82.0°	90.0°
CO1	O06	CO2	N05	169.2°	90.0°
O08	CO1	N04	C22	141.2°	90.0°
O08	CO1	N04	C18	33.2°	90.0°
O08	CO1	O06	CO3	173.7°	90.0°
O08	CO1	O06	CO2	82.6°	90.0°
N04	C22	C21	H27	180.0°	90.0°
N04	C22	C21	C20	2.4°	90.0°
C22	N04	C18	C19	4.3°	90.0°
N04	C22	C21	H28	177.6°	90.0°
C22	N04	C18	H31	175.7°	90.0°
C18	N04	C22	C21	4.3°	90.0°
N04	C18	C19	C20	2.0°	90.0°
N04	C18	C19	H31	180.0°	90.0°
C18	N04	C22	H27	175.8°	90.0°
N04	C18	C19	H30	178.0°	90.0°
C22	C21	C20	H28	180.0°	90.0°
C22	C21	C20	C19	0.5°	90.0°
C22	C21	C20	H29	179.5°	90.0°
C21	C20	C19	H29	180.0°	90.0°
C21	C20	C19	C18	0.2°	90.0°
C20	C21	C22	H27	177.6°	90.0°
C21	C20	C19	H30	179.8°	90.0°
C20	C19	C18	H30	180.0°	90.0°
C19	C20	C21	H28	179.5°	90.0°
C20	C19	C18	H31	178.0°	90.0°
C18	C19	C20	H29	179.8°	90.0°
O12	CO3	N06	O06	77.2°	90.0°
O12	CO3	N06	C34	115.0°	90.0°
O12	CO3	N06	C28	64.8°	90.0°
CO3	O12	CO2	O06	5.8°	90.0°
CO3	O12	CO2	O09	164.7°	90.0°
CO3	O12	CO2	N05	98.1°	90.0°
CO2	O12	CO3	N06	102.8°	90.0°
O12	CO2	O06	O09	179.0°	90.0°
O12	CO2	O06	N05	91.8°	90.0°
O12	CO2	O09	N05	66.7°	90.0°
O12	CO2	N05	C32	48.5°	90.0°
O12	CO2	N05	C24	133.6°	90.0°
CO3	N06	C34	C28	179.9°	90.0°
CO3	N06	C34	C35	179.7°	90.0°
CO3	N06	C28	C29	180.0°	90.0°
N06	CO3	O06	CO2	90.5°	90.0°
CO3	N06	C34	H32	0.3°	90.0°
CO3	N06	C28	H36	0.1°	90.0°
O06	CO3	N06	C34	37.8°	90.0°
O06	CO3	N06	C28	142.1°	90.0°
CO3	O06	CO2	O09	175.7°	90.0°
CO3	O06	CO2	N05	97.0°	90.0°
N06	C34	C35	H32	180.0°	90.0°
N06	C34	C35	C30	0.2°	90.0°
C34	N06	C28	C29	0.2°	90.0°
N06	C34	C35	H33	179.8°	90.0°
C34	N06	C28	H36	179.8°	90.0°
C28	N06	C34	C35	0.4°	90.0°
N06	C28	C29	C30	0.3°	90.0°
N06	C28	C29	H36	180.0°	90.0°
C28	N06	C34	H32	179.6°	90.0°
N06	C28	C29	H35	179.8°	90.0°
C34	C35	C30	H33	180.0°	90.0°
C34	C35	C30	C29	0.3°	90.0°
C34	C35	C30	H34	179.7°	90.0°
C35	C30	C29	H34	180.0°	90.0°
C35	C30	C29	C28	0.5°	90.0°
C30	C35	C34	H32	179.8°	90.0°
C35	C30	C29	H35	179.5°	90.0°
C30	C29	C28	H35	180.0°	90.0°
C29	C30	C35	H33	179.7°	90.0°
C30	C29	C28	H36	179.8°	90.0°
C28	C29	C30	H34	179.5°	90.0°
O06	CO2	O09	N05	92.1°	90.0°
O06	CO2	N05	C32	131.4°	90.0°
O06	CO2	N05	C24	50.7°	90.0°
O09	CO2	N05	C32	129.1°	90.0°
O09	CO2	N05	C24	48.8°	90.0°
CO2	N05	C32	C24	177.8°	90.0°
CO2	N05	C32	C33	179.1°	90.0°
CO2	N05	C24	C25	179.5°	90.0°
CO2	N05	C32	H41	0.9°	90.0°
CO2	N05	C24	H45	0.5°	90.0°
N05	C32	C33	H41	180.0°	90.0°
N05	C32	C33	C26	0.9°	90.0°
C32	N05	C24	C25	1.9°	90.0°
N05	C32	C33	H42	179.1°	90.0°
C32	N05	C24	H45	178.1°	90.0°
C24	N05	C32	C33	1.3°	90.0°
N05	C24	C25	C26	2.2°	90.0°
N05	C24	C25	H45	180.0°	90.0°
C24	N05	C32	H41	178.7°	90.0°
N05	C24	C25	H44	177.7°	90.0°
C32	C33	C26	H42	180.0°	90.0°
C32	C33	C26	C25	1.3°	90.0°
C32	C33	C26	H43	178.7°	90.0°
C33	C26	C25	H43	180.0°	90.0°
C33	C26	C25	C24	2.0°	90.0°
C26	C33	C32	H41	179.1°	90.0°
C33	C26	C25	H44	178.0°	90.0°
C26	C25	C24	H44	180.0°	90.0°
C25	C26	C33	H42	178.7°	90.0°
C26	C25	C24	H45	177.8°	90.0°
C24	C25	C26	H43	178.0°	90.0°
H1	N03	C11	H2	62.3°	90.0°
H2	C11	C10	H3	30.6°	90.0°
H2	C11	C10	H4	90.0°	90.0°
H2	C11	C12	H6	2.5°	90.0°
H5	N02	C12	H6	61.4°	90.0°
H6	C12	C09	H7	41.3°	90.0°
H7	C09	C08	H8	168.1°	90.0°
H7	C09	C08	H9	71.8°	90.0°
H8	C08	C07	H10	177.5°	90.0°
H8	C08	C07	H11	62.8°	90.0°
H9	C08	C07	H10	57.5°	90.0°
H9	C08	C07	H11	177.1°	90.0°
H10	C07	C06	H12	179.3°	90.0°
H10	C07	C06	H13	61.8°	90.0°
H11	C07	C06	H12	59.6°	90.0°
H11	C07	C06	H13	178.6°	90.0°
H12	C06	C05	H14	68.7°	90.0°
H12	C06	C05	H15	51.0°	90.0°
H13	C06	C05	H14	172.3°	90.0°
H13	C06	C05	H15	68.0°	90.0°
H16	N01	C02	H17	149.3°	90.0°
H16	N01	C02	H18	28.4°	90.0°
H17	C02	C37	H19	164.2°	90.0°
H17	C02	C37	H20	75.3°	90.0°
H18	C02	C37	H19	43.3°	90.0°
H18	C02	C37	H20	163.8°	90.0°
H19	C37	C04	H21	26.8°	90.0°
H20	C37	C04	H21	147.4°	90.0°
H22	C44	C43	H23	1.2°	90.0°
H23	C43	C42	H24	1.4°	90.0°
H24	C42	C41	H25	0.2°	90.0°
H25	C41	C40	H26	1.9°	90.0°
H27	C22	C21	H28	2.4°	90.0°
H28	C21	C20	H29	0.5°	90.0°
H29	C20	C19	H30	0.2°	90.0°
H30	C19	C18	H31	2.0°	90.0°
H32	C34	C35	H33	0.2°	90.0°
H33	C35	C30	H34	0.3°	90.0°
H34	C30	C29	H35	0.5°	90.0°
H35	C29	C28	H36	0.2°	90.0°
H41	C32	C33	H42	0.9°	90.0°
H42	C33	C26	H43	1.3°	90.0°
H43	C26	C25	H44	2.0°	90.0°
H44	C25	C24	H45	2.3°	90.0°

Release date:	2018-02-28
Definition date:	2017-09-20
Last modified:	2018-02-23
Release status:	REL
Processing site:	RCSB
Derived from:	6AUC