BV1

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N9	C38	sing	1.40Å	1.33Å
N9	C32	sing	1.44Å	22.27Å
N9	HN9	sing	1.02Å	1.00Å
C38	O12	doub	1.24Å	1.23Å
C38	C39	sing	1.45Å	1.54Å
C39	C44	doub	1.39Å	1.39Å	Aromatic
C39	C40	sing	1.40Å	1.39Å	Aromatic
C44	C43	sing	1.39Å	1.39Å	Aromatic
C44	H44	sing	1.09Å	1.08Å
C40	C41	doub	1.39Å	1.39Å	Aromatic
C40	H40	sing	1.09Å	1.08Å
C41	N10	sing	1.42Å	1.34Å
C41	C42	sing	1.39Å	1.39Å	Aromatic
N10	O15	sing	1.25Å	1.42Å
N10	O14	doub	1.25Å	1.47Å
C42	C43	doub	1.39Å	1.39Å	Aromatic
C42	H42	sing	1.09Å	1.08Å
C43	O13	sing	1.37Å	1.36Å
O13	C45	sing	1.43Å	1.41Å
C45	O16	sing	1.43Å	1.45Å
C45	C49	sing	1.53Å	1.52Å
C45	H45	sing	1.09Å	1.10Å
O16	C46	sing	1.44Å	1.41Å
C46	C50	sing	1.53Å	1.56Å
C46	C47	sing	1.53Å	1.52Å
C46	H46	sing	1.10Å	1.10Å
C50	O20	sing	1.42Å	1.44Å
C50	H501	sing	1.09Å	1.10Å
C50	H502	sing	1.09Å	1.10Å
O20	H20	sing	0.97Å	0.95Å
C47	O17	sing	1.43Å	1.44Å
C47	C48	sing	1.53Å	1.54Å
C47	H47	sing	1.10Å	1.10Å
O17	H17	sing	0.97Å	0.95Å
C48	O18	sing	1.42Å	1.41Å
C48	C49	sing	1.53Å	1.54Å
C48	H48	sing	1.10Å	1.10Å
O18	H18	sing	0.97Å	0.95Å
C49	O19	sing	1.42Å	1.44Å
C49	H49	sing	1.10Å	1.10Å
O19	H19	sing	0.97Å	0.95Å
O1	C1	sing	1.42Å	0.00Å
O1	HO1	sing	0.97Å	0.00Å
C1	C2	sing	1.52Å	0.00Å
C1	H11A	sing	1.09Å	0.00Å
C1	H12	sing	1.09Å	0.00Å
C2	O2	sing	1.44Å	0.00Å
C2	C37	sing	1.54Å	0.00Å
C2	H2	sing	1.10Å	0.00Å
O2	C3	sing	1.43Å	0.00Å
C3	O3	sing	1.43Å	0.00Å
C3	C35	sing	1.53Å	0.00Å
C3	H3	sing	1.10Å	0.00Å
O3	C4	sing	1.36Å	0.00Å
C4	C5	doub	1.39Å	0.00Å	Aromatic
C4	C9	sing	1.39Å	0.00Å	Aromatic
C5	C6	sing	1.38Å	0.00Å	Aromatic
C5	H5	sing	1.09Å	0.00Å
C6	C7	doub	1.38Å	0.00Å	Aromatic
C6	C10	sing	1.49Å	0.00Å
C7	C8	sing	1.39Å	0.00Å	Aromatic
C7	H7	sing	1.09Å	0.00Å
C8	C9	doub	1.39Å	0.00Å	Aromatic
C8	N1	sing	1.42Å	0.00Å
C9	H9	sing	1.09Å	0.00Å
N1	O4	sing	1.25Å	0.00Å
N1	O5	doub	1.25Å	0.00Å
C10	O6	doub	1.23Å	0.00Å
C10	N2	sing	1.39Å	0.00Å
N2	C11	sing	1.44Å	0.00Å
N2	HN2	sing	1.02Å	0.00Å
C11	C12	sing	1.53Å	0.00Å
C11	H111	sing	1.09Å	0.00Å
C11	H112	sing	1.09Å	0.00Å
C12	C13	sing	1.53Å	0.00Å
C12	H121	sing	1.10Å	0.00Å
C12	H122	sing	1.10Å	0.00Å
C13	N3	sing	1.46Å	0.00Å
C13	H131	sing	1.09Å	0.00Å
C13	H132	sing	1.09Å	0.00Å
N3	C14	sing	1.47Å	0.00Å
N3	C17	sing	1.47Å	0.00Å
C14	C15	sing	1.53Å	0.00Å
C14	H141	sing	1.10Å	0.00Å
C14	H142	sing	1.10Å	0.00Å
C15	N4	sing	1.47Å	0.00Å
C15	H151	sing	1.10Å	0.00Å
C15	H152	sing	1.10Å	0.00Å
N4	C16	sing	1.47Å	0.00Å
N4	C18	sing	1.46Å	0.00Å
C16	C17	sing	1.53Å	0.00Å
C16	H161	sing	1.10Å	0.00Å
C16	H162	sing	1.10Å	0.00Å
C17	H171	sing	1.10Å	0.00Å
C17	H172	sing	1.10Å	0.00Å
C18	C19	sing	1.53Å	0.00Å
C18	H181	sing	1.09Å	0.00Å
C18	H182	sing	1.10Å	0.00Å
C19	C20	sing	1.53Å	0.00Å
C19	H191	sing	1.10Å	0.00Å
C19	H192	sing	1.10Å	0.00Å
C20	N5	sing	1.47Å	0.00Å
C20	H201	sing	1.09Å	0.00Å
C20	H202	sing	1.09Å	0.00Å
N5	C21	sing	1.31Å	0.00Å
N5	HN5	sing	1.02Å	0.00Å
C21	C22	doub	1.34Å	0.00Å	Aromatic
C21	C34	sing	1.46Å	0.00Å	Aromatic
C22	N6	sing	1.33Å	0.00Å
C22	C33	sing	1.44Å	0.00Å	Aromatic
N6	C23	sing	1.44Å	0.00Å
N6	HN6	sing	1.02Å	0.00Å
C23	C24	sing	1.53Å	0.00Å
C23	H231	sing	1.09Å	0.00Å
C23	H232	sing	1.09Å	0.00Å
C24	C25	sing	1.53Å	0.00Å
C24	H241	sing	1.10Å	0.00Å
C24	H242	sing	1.10Å	0.00Å
C25	N7	sing	1.46Å	0.00Å
C25	H251	sing	1.09Å	0.00Å
C25	H252	sing	1.09Å	0.00Å
N7	C26	sing	1.47Å	0.00Å
N7	C29	sing	1.47Å	0.00Å
C26	C27	sing	1.53Å	0.00Å
C26	H261	sing	1.10Å	0.00Å
C26	H262	sing	1.10Å	0.00Å
C27	N8	sing	1.47Å	0.00Å
C27	H271	sing	1.10Å	0.00Å
C27	H272	sing	1.10Å	0.00Å
N8	C28	sing	1.47Å	0.00Å
N8	C30	sing	1.46Å	0.00Å
C28	C29	sing	1.53Å	0.00Å
C28	H281	sing	1.10Å	0.00Å
C28	H282	sing	1.10Å	0.00Å
C29	H291	sing	1.10Å	0.00Å
C29	H292	sing	1.10Å	0.00Å
C30	C31	sing	1.53Å	0.00Å
C30	H301	sing	1.09Å	0.00Å
C30	H302	sing	1.09Å	0.00Å
C31	C32	sing	1.53Å	0.00Å
C31	H311	sing	1.10Å	0.00Å
C31	H312	sing	1.10Å	0.00Å
C32	H321	sing	1.09Å	0.00Å
C32	H322	sing	1.09Å	0.00Å
C33	O7	doub	1.20Å	0.00Å
C33	C34	sing	1.48Å	0.00Å	Aromatic
C34	O8	doub	1.20Å	0.00Å
C35	O9	sing	1.43Å	0.00Å
C35	C36	sing	1.53Å	0.00Å
C35	H35	sing	1.10Å	0.00Å
O9	HO9	sing	0.97Å	0.00Å
C36	O10	sing	1.42Å	0.00Å
C36	C37	sing	1.53Å	0.00Å
C36	H36	sing	1.10Å	0.00Å
O10	H10	sing	0.97Å	0.00Å
C37	O11	sing	1.43Å	0.00Å
C37	H37	sing	1.10Å	0.00Å
O11	H11	sing	0.97Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C38	N9	C32	108.8°	123.6°
C38	N9	HN9	125.6°	119.3°
N9	C38	O12	123.3°	122.5°
N9	C38	C39	115.2°	117.0°
C32	N9	HN9	125.6°	117.0°
N9	C32	C31	90.0°	112.6°
N9	C32	H321	90.0°	106.9°
N9	C32	H322	90.0°	107.8°
O12	C38	C39	121.2°	120.5°
C38	C39	C44	120.1°	120.0°
C38	C39	C40	119.8°	120.0°
C44	C39	C40	120.0°	120.0°
C39	C44	C43	119.9°	119.8°
C39	C44	H44	120.0°	120.2°
C39	C40	C41	120.2°	120.0°
C39	C40	H40	119.9°	119.9°
C43	C44	H44	120.0°	120.0°
C44	C43	C42	119.2°	120.4°
C44	C43	O13	122.1°	119.8°
C41	C40	H40	119.9°	120.1°
C40	C41	N10	122.2°	120.0°
C40	C41	C42	119.1°	120.0°
N10	C41	C42	118.7°	120.0°
C41	N10	O15	117.1°	119.0°
C41	N10	O14	117.4°	119.0°
C41	C42	C43	121.5°	119.8°
C41	C42	H42	119.2°	120.4°
O15	N10	O14	117.0°	122.1°
C43	C42	H42	119.2°	119.8°
C42	C43	O13	118.7°	119.8°
C43	O13	C45	114.3°	116.6°
O13	C45	O16	108.7°	111.8°
O13	C45	C49	105.6°	110.2°
O13	C45	H45	114.1°	106.5°
O16	C45	C49	113.9°	110.5°
O16	C45	H45	105.9°	108.0°
C45	O16	C46	113.7°	113.6°
C49	C45	H45	109.0°	109.8°
C45	C49	C48	110.6°	110.7°
C45	C49	O19	109.6°	109.3°
C45	C49	H49	108.7°	109.9°
O16	C46	C50	103.3°	107.2°
O16	C46	C47	111.6°	110.7°
O16	C46	H46	114.3°	108.7°
C50	C46	C47	115.1°	112.4°
C50	C46	H46	110.7°	107.7°
C46	C50	O20	110.3°	108.6°
C46	C50	H501	109.2°	110.0°
C46	C50	H502	109.0°	110.0°
C47	C46	H46	102.2°	110.0°
C46	C47	O17	111.5°	108.9°
C46	C47	C48	110.8°	110.3°
C46	C47	H47	106.8°	111.1°
O20	C50	H501	109.2°	109.2°
O20	C50	H502	109.0°	109.3°
C50	O20	H20	109.5°	107.1°
H501	C50	H502	110.1°	109.7°
O17	C47	C48	108.2°	109.5°
O17	C47	H47	109.4°	106.6°
C47	O17	H17	109.5°	106.2°
C48	C47	H47	110.1°	110.3°
C47	C48	O18	109.1°	110.0°
C47	C48	C49	109.8°	110.2°
C47	C48	H48	109.7°	110.3°
O18	C48	C49	109.9°	109.3°
O18	C48	H48	109.5°	106.8°
C48	O18	H18	109.5°	106.6°
C49	C48	H48	108.8°	110.2°
C48	C49	O19	109.9°	110.3°
C48	C49	H49	108.5°	109.4°
O19	C49	H49	109.5°	107.1°
C49	O19	H19	109.5°	106.6°
C1	O1	HO1	90.0°	107.0°
O1	C1	C2	90.0°	108.6°
O1	C1	H11A	90.0°	109.2°
O1	C1	H12	90.0°	109.2°
C2	C1	H11A	90.0°	110.0°
C2	C1	H12	90.0°	110.1°
C1	C2	O2	90.0°	107.2°
C1	C2	C37	90.0°	113.0°
C1	C2	H2	90.0°	108.1°
H11A	C1	H12	90.0°	109.6°
O2	C2	C37	90.0°	110.6°
O2	C2	H2	90.0°	108.2°
C2	O2	C3	90.0°	112.9°
C37	C2	H2	90.0°	109.5°
C2	C37	C36	90.0°	109.8°
C2	C37	O11	90.0°	110.4°
C2	C37	H37	90.0°	111.0°
O2	C3	O3	90.0°	110.7°
O2	C3	C35	90.0°	111.1°
O2	C3	H3	90.0°	108.9°
O3	C3	C35	90.0°	108.7°
O3	C3	H3	90.0°	107.5°
C3	O3	C4	90.0°	117.1°
C35	C3	H3	90.0°	109.9°
C3	C35	O9	90.0°	109.5°
C3	C35	C36	90.0°	109.5°
C3	C35	H35	90.0°	110.7°
O3	C4	C5	90.0°	120.0°
O3	C4	C9	90.0°	120.0°
C5	C4	C9	90.0°	120.0°
C4	C5	C6	90.0°	118.8°
C4	C5	H5	90.0°	119.8°
C4	C9	C8	90.0°	120.0°
C4	C9	H9	90.0°	119.6°
C6	C5	H5	90.0°	121.4°
C5	C6	C7	90.0°	122.2°
C5	C6	C10	90.0°	118.8°
C7	C6	C10	90.0°	118.9°
C6	C7	C8	90.0°	118.9°
C6	C7	H7	90.0°	121.0°
C6	C10	O6	90.0°	119.2°
C6	C10	N2	90.0°	116.1°
C8	C7	H7	90.0°	120.1°
C7	C8	C9	90.0°	120.0°
C7	C8	N1	90.0°	120.0°
C9	C8	N1	90.0°	120.0°
C8	C9	H9	90.0°	120.4°
C8	N1	O4	90.0°	119.0°
C8	N1	O5	90.0°	119.0°
O4	N1	O5	90.0°	122.1°
O6	C10	N2	90.0°	124.6°
C10	N2	C11	90.0°	122.7°
C10	N2	HN2	90.0°	119.8°
C11	N2	HN2	90.0°	117.4°
N2	C11	C12	90.0°	112.6°
N2	C11	H111	90.0°	106.9°
N2	C11	H112	90.0°	107.8°
C12	C11	H111	90.0°	109.9°
C12	C11	H112	90.0°	111.5°
C11	C12	C13	90.0°	113.8°
C11	C12	H121	90.0°	109.3°
C11	C12	H122	90.0°	108.6°
H111	C11	H112	90.0°	108.0°
C13	C12	H121	90.0°	108.6°
C13	C12	H122	90.0°	109.3°
C12	C13	N3	90.0°	112.6°
C12	C13	H131	90.0°	111.5°
C12	C13	H132	90.0°	109.9°
H121	C12	H122	90.0°	107.0°
N3	C13	H131	90.0°	107.8°
N3	C13	H132	90.0°	106.9°
C13	N3	C14	90.0°	110.8°
C13	N3	C17	90.0°	110.8°
H131	C13	H132	90.0°	107.9°
C14	N3	C17	90.0°	110.4°
N3	C14	C15	90.0°	110.8°
N3	C14	H141	90.0°	110.7°
N3	C14	H142	90.0°	109.6°
N3	C17	C16	90.0°	110.8°
N3	C17	H171	90.0°	109.6°
N3	C17	H172	90.0°	110.8°
C15	C14	H141	90.0°	109.7°
C15	C14	H142	90.0°	108.5°
C14	C15	N4	90.0°	110.9°
C14	C15	H151	90.0°	109.8°
C14	C15	H152	90.0°	108.6°
H141	C14	H142	90.0°	107.3°
N4	C15	H151	90.0°	110.7°
N4	C15	H152	90.0°	109.6°
C15	N4	C16	90.0°	110.5°
C15	N4	C18	90.0°	110.8°
H151	C15	H152	90.0°	107.2°
C16	N4	C18	90.0°	110.8°
N4	C16	C17	90.0°	110.9°
N4	C16	H161	90.0°	109.6°
N4	C16	H162	90.0°	110.8°
N4	C18	C19	90.0°	112.6°
N4	C18	H181	90.0°	107.8°
N4	C18	H182	90.0°	106.8°
C17	C16	H161	90.0°	108.5°
C17	C16	H162	90.0°	109.7°
C16	C17	H171	90.0°	108.5°
C16	C17	H172	90.0°	109.7°
H161	C16	H162	90.0°	107.3°
H171	C17	H172	90.0°	107.3°
C19	C18	H181	90.0°	111.5°
C19	C18	H182	90.0°	109.9°
C18	C19	C20	90.0°	113.8°
C18	C19	H191	90.0°	108.6°
C18	C19	H192	90.0°	109.3°
H181	C18	H182	90.0°	108.0°
C20	C19	H191	90.0°	109.3°
C20	C19	H192	90.0°	108.6°
C19	C20	N5	90.0°	112.6°
C19	C20	H201	90.0°	109.9°
C19	C20	H202	90.0°	111.5°
H191	C19	H192	90.0°	107.0°
N5	C20	H201	90.0°	106.9°
N5	C20	H202	90.0°	107.8°
C20	N5	C21	90.0°	122.6°
C20	N5	HN5	90.0°	117.6°
H201	C20	H202	90.0°	108.0°
C21	N5	HN5	90.0°	119.8°
N5	C21	C22	90.0°	140.8°
N5	C21	C34	90.0°	127.6°
C22	C21	C34	90.0°	91.6°
C21	C22	N6	90.0°	139.3°
C21	C22	C33	90.0°	94.0°
C21	C34	C33	90.0°	87.7°
C21	C34	O8	90.0°	141.4°
N6	C22	C33	90.0°	126.7°
C22	N6	C23	90.0°	122.9°
C22	N6	HN6	90.0°	117.1°
C22	C33	O7	90.0°	142.3°
C22	C33	C34	90.0°	86.8°
C23	N6	HN6	90.0°	119.9°
N6	C23	C24	90.0°	112.6°
N6	C23	H231	90.0°	106.8°
N6	C23	H232	90.0°	107.8°
C24	C23	H231	90.0°	109.9°
C24	C23	H232	90.0°	111.5°
C23	C24	C25	90.0°	113.8°
C23	C24	H241	90.0°	109.3°
C23	C24	H242	90.0°	108.6°
H231	C23	H232	90.0°	108.0°
C25	C24	H241	90.0°	108.6°
C25	C24	H242	90.0°	109.3°
C24	C25	N7	90.0°	112.6°
C24	C25	H251	90.0°	111.5°
C24	C25	H252	90.0°	109.9°
H241	C24	H242	90.0°	107.0°
N7	C25	H251	90.0°	107.8°
N7	C25	H252	90.0°	106.9°
C25	N7	C26	90.0°	110.8°
C25	N7	C29	90.0°	110.8°
H251	C25	H252	90.0°	108.0°
C26	N7	C29	90.0°	110.5°
N7	C26	C27	90.0°	110.9°
N7	C26	H261	90.0°	110.7°
N7	C26	H262	90.0°	109.6°
N7	C29	C28	90.0°	110.8°
N7	C29	H291	90.0°	109.6°
N7	C29	H292	90.0°	110.8°
C27	C26	H261	90.0°	109.8°
C27	C26	H262	90.0°	108.6°
C26	C27	N8	90.0°	110.8°
C26	C27	H271	90.0°	109.8°
C26	C27	H272	90.0°	108.5°
H261	C26	H262	90.0°	107.2°
N8	C27	H271	90.0°	110.7°
N8	C27	H272	90.0°	109.5°
C27	N8	C28	90.0°	110.4°
C27	N8	C30	90.0°	110.8°
H271	C27	H272	90.0°	107.4°
C28	N8	C30	90.0°	110.7°
N8	C28	C29	90.0°	110.8°
N8	C28	H281	90.0°	109.6°
N8	C28	H282	90.0°	110.8°
N8	C30	C31	90.0°	112.5°
N8	C30	H301	90.0°	107.8°
N8	C30	H302	90.0°	106.9°
C29	C28	H281	90.0°	108.5°
C29	C28	H282	90.0°	109.7°
C28	C29	H291	90.0°	108.5°
C28	C29	H292	90.0°	109.7°
H281	C28	H282	90.0°	107.3°
H291	C29	H292	90.0°	107.3°
C31	C30	H301	90.0°	111.5°
C31	C30	H302	90.0°	109.9°
C30	C31	C32	90.0°	113.8°
C30	C31	H311	90.0°	108.6°
C30	C31	H312	90.0°	109.3°
H301	C30	H302	90.0°	108.0°
C32	C31	H311	90.0°	109.3°
C32	C31	H312	90.0°	108.6°
C31	C32	H321	90.0°	109.9°
C31	C32	H322	90.0°	111.5°
H311	C31	H312	90.0°	107.1°
H321	C32	H322	90.0°	108.0°
O7	C33	C34	90.0°	130.9°
C33	C34	O8	90.0°	130.9°
O9	C35	C36	90.0°	110.5°
O9	C35	H35	90.0°	105.8°
C35	O9	HO9	90.0°	106.3°
C36	C35	H35	90.0°	110.8°
C35	C36	O10	90.0°	110.9°
C35	C36	C37	90.0°	111.7°
C35	C36	H36	90.0°	108.6°
O10	C36	C37	90.0°	110.1°
O10	C36	H36	90.0°	107.1°
C36	O10	H10	90.0°	106.7°
C37	C36	H36	90.0°	108.2°
C36	C37	O11	90.0°	109.3°
C36	C37	H37	90.0°	109.5°
O11	C37	H37	90.0°	106.7°
C37	O11	H11	90.0°	106.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C38	N9	C32	HN9	180.0°	176.0°
N9	C38	O12	C39	173.0°	178.8°
N9	C38	C39	C44	175.5°	27.0°
N9	C38	C39	C40	4.8°	153.1°
C38	N9	C32	C31	90.0°	90.0°
C38	N9	C32	H321	90.0°	149.2°
C38	N9	C32	H322	90.0°	33.4°
C32	N9	C38	O12	125.8°	0.1°
C32	N9	C38	C39	60.8°	178.9°
N9	C32	C31	C30	90.0°	59.0°
N9	C32	C31	H321	90.0°	119.0°
N9	C32	C31	H322	90.0°	121.3°
N9	C32	C31	H311	90.0°	179.5°
N9	C32	C31	H312	90.0°	63.0°
N9	C32	H321	H322	90.0°	115.8°
HN9	N9	C38	O12	54.2°	175.8°
HN9	N9	C38	C39	119.2°	3.0°
HN9	N9	C32	C31	90.0°	85.9°
HN9	N9	C32	H321	90.0°	34.8°
HN9	N9	C32	H322	90.0°	150.7°
O12	C38	C39	C44	1.9°	154.2°
O12	C38	C39	C40	178.4°	25.8°
C38	C39	C44	C40	179.7°	179.9°
C38	C39	C44	C43	177.9°	179.9°
C38	C39	C44	H44	2.1°	0.0°
C38	C39	C40	C41	178.9°	179.9°
C38	C39	C40	H40	1.0°	0.1°
C39	C44	C43	H44	180.0°	179.9°
C44	C39	C40	C41	0.8°	0.0°
C44	C39	C40	H40	179.3°	180.0°
C39	C44	C43	C42	1.9°	0.0°
C39	C44	C43	O13	178.8°	180.0°
C40	C39	C44	C43	1.8°	0.0°
C40	C39	C44	H44	178.2°	180.0°
C39	C40	C41	H40	180.0°	180.0°
C39	C40	C41	N10	178.4°	180.0°
C39	C40	C41	C42	0.1°	0.0°
C44	C43	C42	C41	1.1°	0.0°
C44	C43	C42	O13	177.0°	180.0°
C44	C43	C42	H42	178.9°	180.0°
C44	C43	O13	C45	79.7°	60.0°
H44	C44	C43	C42	178.1°	180.0°
H44	C44	C43	O13	1.2°	0.1°
C40	C41	N10	C42	178.3°	179.9°
C40	C41	N10	O15	9.5°	0.0°
C40	C41	N10	O14	156.5°	180.0°
C40	C41	C42	C43	0.1°	0.0°
C40	C41	C42	H42	179.9°	180.0°
H40	C40	C41	N10	1.6°	0.0°
H40	C40	C41	C42	179.9°	180.0°
C41	N10	O15	O14	147.2°	179.9°
N10	C41	C42	C43	178.3°	180.0°
N10	C41	C42	H42	1.7°	0.1°
C42	C41	N10	O15	168.9°	179.9°
C42	C41	N10	O14	21.8°	0.0°
C41	C42	C43	H42	180.0°	179.9°
C41	C42	C43	O13	178.1°	180.0°
C42	C43	O13	C45	103.4°	120.0°
H42	C42	C43	O13	1.9°	0.0°
C43	O13	C45	O16	65.3°	87.7°
C43	O13	C45	C49	172.2°	149.0°
C43	O13	C45	H45	52.5°	30.0°
O13	C45	O16	C49	117.3°	123.1°
O13	C45	O16	H45	123.0°	116.8°
O13	C45	C49	H45	123.0°	117.0°
O13	C45	O16	C46	62.3°	63.4°
O13	C45	C49	C48	68.0°	68.4°
O13	C45	C49	O19	53.3°	53.2°
O13	C45	C49	H49	172.9°	170.6°
O16	C45	C49	H45	117.9°	119.0°
C45	O16	C46	C50	178.7°	177.3°
C45	O16	C46	C47	57.0°	59.7°
C45	O16	C46	H46	58.4°	61.2°
O16	C45	C49	C48	51.1°	55.7°
O16	C45	C49	O19	172.4°	177.3°
O16	C45	C49	H49	67.9°	65.4°
C49	C45	O16	C46	55.0°	59.7°
C45	C49	C48	C47	50.4°	53.1°
C45	C49	C48	O18	170.3°	174.1°
C45	C49	C48	O19	121.1°	121.0°
C45	C49	C48	H49	119.2°	121.3°
C45	C49	C48	H48	69.7°	68.8°
C45	C49	O19	H49	119.2°	119.1°
C45	C49	O19	H19	20.9°	28.8°
H45	C45	O16	C46	174.7°	179.8°
H45	C45	C49	C48	169.0°	174.6°
H45	C45	C49	O19	69.7°	63.7°
H45	C45	C49	H49	50.0°	53.6°
O16	C46	C50	C47	121.9°	121.9°
O16	C46	C50	H46	122.8°	116.8°
O16	C46	C47	H46	122.6°	120.1°
O16	C46	C50	O20	62.6°	57.6°
O16	C46	C50	H501	177.4°	61.9°
O16	C46	C50	H502	57.1°	177.2°
O16	C46	C47	O17	63.8°	65.0°
O16	C46	C47	C48	56.8°	55.2°
O16	C46	C47	H47	176.7°	177.9°
C50	C46	C47	H46	120.1°	120.0°
C46	C50	O20	H501	120.0°	120.0°
C46	C50	O20	H502	119.7°	120.0°
C46	C50	H501	H502	119.6°	121.1°
C46	C50	O20	H20	137.6°	13.4°
C50	C46	C47	O17	53.5°	54.9°
C50	C46	C47	C48	174.1°	175.1°
C50	C46	C47	H47	65.9°	62.3°
C47	C46	C50	O20	175.5°	179.5°
C47	C46	C50	H501	55.5°	60.0°
C47	C46	C50	H502	64.8°	60.9°
C46	C47	O17	C48	122.1°	120.7°
C46	C47	O17	H47	117.9°	120.0°
C46	C47	C48	H47	117.9°	123.1°
C46	C47	O17	H17	49.0°	80.6°
C46	C47	C48	O18	174.0°	173.3°
C46	C47	C48	C49	53.5°	52.8°
C46	C47	C48	H48	66.0°	69.1°
H46	C46	C50	O20	60.2°	59.2°
H46	C46	C50	H501	59.8°	178.7°
H46	C46	C50	H502	179.9°	60.4°
H46	C46	C47	O17	173.6°	174.9°
H46	C46	C47	C48	65.8°	64.9°
H46	C46	C47	H47	54.2°	57.8°
O20	C50	H501	H502	119.7°	119.8°
H501	C50	O20	H20	17.6°	106.5°
H502	C50	O20	H20	102.8°	133.4°
O17	C47	C48	H47	119.5°	117.1°
O17	C47	C48	O18	51.5°	53.5°
O17	C47	C48	C49	69.0°	67.0°
O17	C47	C48	H48	171.4°	171.1°
C48	C47	O17	H17	73.1°	40.1°
C47	C48	O18	C49	120.4°	121.1°
C47	C48	O18	H48	120.1°	119.7°
C47	C48	C49	H48	120.1°	121.9°
C47	C48	O18	H18	142.6°	150.9°
C47	C48	C49	O19	171.5°	174.2°
C47	C48	C49	H49	68.8°	68.2°
H47	C47	O17	H17	166.9°	159.4°
H47	C47	C48	O18	68.1°	63.6°
H47	C47	C48	C49	171.5°	175.9°
H47	C47	C48	H48	51.9°	54.0°
O18	C48	C49	H48	120.0°	117.1°
O18	C48	C49	O19	68.5°	64.8°
O18	C48	C49	H49	51.1°	52.8°
C49	C48	O18	H18	22.3°	29.8°
C48	C49	O19	H49	119.1°	119.0°
C48	C49	O19	H19	142.6°	150.6°
H48	C48	O18	H18	97.3°	89.4°
H48	C48	C49	O19	51.4°	52.2°
H48	C48	C49	H49	171.1°	169.9°
H49	C49	O19	H19	98.3°	90.3°
O1	C1	C2	H11A	90.0°	119.5°
O1	C1	C2	H12	90.0°	119.6°
O1	C1	H11A	H12	90.0°	119.7°
O1	C1	C2	O2	90.0°	58.3°
O1	C1	C2	C37	90.0°	179.5°
O1	C1	C2	H2	90.0°	58.2°
HO1	O1	C1	C2	90.0°	176.5°
HO1	O1	C1	H11A	90.0°	56.5°
HO1	O1	C1	H12	90.0°	63.4°
C2	C1	H11A	H12	90.0°	121.2°
C1	C2	O2	C37	90.0°	123.7°
C1	C2	O2	H2	90.0°	116.5°
C1	C2	C37	H2	90.0°	120.6°
C1	C2	O2	C3	90.0°	175.3°
C1	C2	C37	C36	90.0°	175.3°
C1	C2	C37	O11	90.0°	54.7°
C1	C2	C37	H37	90.0°	63.5°
H11A	C1	C2	O2	90.0°	177.8°
H11A	C1	C2	C37	90.0°	60.0°
H11A	C1	C2	H2	90.0°	61.3°
H12	C1	C2	O2	90.0°	61.2°
H12	C1	C2	C37	90.0°	60.9°
H12	C1	C2	H2	90.0°	177.7°
O2	C2	C37	H2	90.0°	119.1°
C2	O2	C3	O3	90.0°	177.7°
C2	O2	C3	C35	90.0°	61.5°
C2	O2	C3	H3	90.0°	59.7°
O2	C2	C37	C36	90.0°	55.0°
O2	C2	C37	O11	90.0°	65.5°
O2	C2	C37	H37	90.0°	176.3°
C37	C2	O2	C3	90.0°	61.0°
C2	C37	C36	C35	90.0°	51.9°
C2	C37	C36	O10	90.0°	175.6°
C2	C37	C36	O11	90.0°	121.2°
C2	C37	C36	H37	90.0°	122.2°
C2	C37	C36	H36	90.0°	67.7°
C2	C37	O11	H37	90.0°	120.8°
C2	C37	O11	H11	90.0°	77.1°
H2	C2	O2	C3	90.0°	58.9°
H2	C2	C37	C36	90.0°	64.1°
H2	C2	C37	O11	90.0°	175.3°
H2	C2	C37	H37	90.0°	57.1°
O2	C3	O3	C35	90.0°	122.2°
O2	C3	O3	H3	90.0°	118.9°
O2	C3	C35	H3	90.0°	120.6°
O2	C3	O3	C4	90.0°	58.8°
O2	C3	C35	O9	90.0°	65.8°
O2	C3	C35	C36	90.0°	55.5°
O2	C3	C35	H35	90.0°	177.9°
O3	C3	C35	H3	90.0°	117.4°
C3	O3	C4	C5	90.0°	60.0°
C3	O3	C4	C9	90.0°	119.9°
O3	C3	C35	O9	90.0°	56.2°
O3	C3	C35	C36	90.0°	177.5°
O3	C3	C35	H35	90.0°	60.1°
C35	C3	O3	C4	90.0°	179.0°
C3	C35	O9	C36	90.0°	120.7°
C3	C35	O9	H35	90.0°	119.4°
C3	C35	C36	H35	90.0°	122.4°
C3	C35	O9	HO9	90.0°	72.4°
C3	C35	C36	O10	90.0°	175.1°
C3	C35	C36	C37	90.0°	51.9°
C3	C35	C36	H36	90.0°	67.4°
H3	C3	O3	C4	90.0°	60.1°
H3	C3	C35	O9	90.0°	173.6°
H3	C3	C35	C36	90.0°	65.1°
H3	C3	C35	H35	90.0°	57.3°
O3	C4	C5	C9	90.0°	180.0°
O3	C4	C5	C6	90.0°	180.0°
O3	C4	C5	H5	90.0°	0.0°
O3	C4	C9	C8	90.0°	180.0°
O3	C4	C9	H9	90.0°	0.0°
C4	C5	C6	H5	90.0°	180.0°
C4	C5	C6	C7	90.0°	0.0°
C4	C5	C6	C10	90.0°	179.9°
C5	C4	C9	C8	90.0°	0.0°
C5	C4	C9	H9	90.0°	180.0°
C9	C4	C5	C6	90.0°	0.0°
C9	C4	C5	H5	90.0°	180.0°
C4	C9	C8	C7	90.0°	0.1°
C4	C9	C8	H9	90.0°	179.9°
C4	C9	C8	N1	90.0°	180.0°
C5	C6	C7	C10	90.0°	179.9°
C5	C6	C7	C8	90.0°	0.0°
C5	C6	C7	H7	90.0°	180.0°
C5	C6	C10	O6	90.0°	154.1°
C5	C6	C10	N2	90.0°	27.0°
H5	C5	C6	C7	90.0°	180.0°
H5	C5	C6	C10	90.0°	0.1°
C6	C7	C8	H7	90.0°	179.9°
C6	C7	C8	C9	90.0°	0.1°
C6	C7	C8	N1	90.0°	180.0°
C7	C6	C10	O6	90.0°	25.8°
C7	C6	C10	N2	90.0°	153.1°
C10	C6	C7	C8	90.0°	179.9°
C10	C6	C7	H7	90.0°	0.1°
C6	C10	O6	N2	90.0°	178.9°
C6	C10	N2	C11	90.0°	178.9°
C6	C10	N2	HN2	90.0°	3.0°
C7	C8	C9	N1	90.0°	179.9°
C7	C8	C9	H9	90.0°	180.0°
C7	C8	N1	O4	90.0°	0.0°
C7	C8	N1	O5	90.0°	179.9°
H7	C7	C8	C9	90.0°	180.0°
H7	C7	C8	N1	90.0°	0.1°
C9	C8	N1	O4	90.0°	179.9°
C9	C8	N1	O5	90.0°	0.0°
N1	C8	C9	H9	90.0°	0.0°
C8	N1	O4	O5	90.0°	179.9°
O6	C10	N2	C11	90.0°	0.0°
O6	C10	N2	HN2	90.0°	175.9°
C10	N2	C11	HN2	90.0°	176.0°
C10	N2	C11	C12	90.0°	90.0°
C10	N2	C11	H111	90.0°	149.3°
C10	N2	C11	H112	90.0°	33.4°
N2	C11	C12	H111	90.0°	119.0°
N2	C11	C12	H112	90.0°	121.3°
N2	C11	H111	H112	90.0°	115.8°
N2	C11	C12	C13	90.0°	59.0°
N2	C11	C12	H121	90.0°	179.4°
N2	C11	C12	H122	90.0°	63.0°
HN2	N2	C11	C12	90.0°	86.0°
HN2	N2	C11	H111	90.0°	34.7°
HN2	N2	C11	H112	90.0°	150.6°
C12	C11	H111	H112	90.0°	121.8°
C11	C12	C13	H121	90.0°	122.0°
C11	C12	C13	H122	90.0°	121.6°
C11	C12	H121	H122	90.0°	117.4°
C11	C12	C13	N3	90.0°	58.7°
C11	C12	C13	H131	90.0°	180.0°
C11	C12	C13	H132	90.0°	60.3°
H111	C11	C12	C13	90.0°	60.0°
H111	C11	C12	H121	90.0°	61.6°
H111	C11	C12	H122	90.0°	178.0°
H112	C11	C12	C13	90.0°	179.7°
H112	C11	C12	H121	90.0°	58.1°
H112	C11	C12	H122	90.0°	58.3°
C13	C12	H121	H122	90.0°	117.9°
C12	C13	N3	H131	90.0°	123.4°
C12	C13	N3	H132	90.0°	120.8°
C12	C13	H131	H132	90.0°	120.8°
C12	C13	N3	C14	90.0°	63.4°
C12	C13	N3	C17	90.0°	173.7°
H121	C12	C13	N3	90.0°	63.3°
H121	C12	C13	H131	90.0°	58.0°
H121	C12	C13	H132	90.0°	177.7°
H122	C12	C13	N3	90.0°	179.7°
H122	C12	C13	H131	90.0°	58.4°
H122	C12	C13	H132	90.0°	61.3°
N3	C13	H131	H132	90.0°	115.1°
C13	N3	C14	C17	90.0°	123.1°
C13	N3	C14	C15	90.0°	179.9°
C13	N3	C14	H141	90.0°	57.9°
C13	N3	C14	H142	90.0°	60.3°
C13	N3	C17	C16	90.0°	179.9°
C13	N3	C17	H171	90.0°	60.4°
C13	N3	C17	H172	90.0°	57.9°
H131	C13	N3	C14	90.0°	60.0°
H131	C13	N3	C17	90.0°	62.9°
H132	C13	N3	C14	90.0°	175.8°
H132	C13	N3	C17	90.0°	52.9°
N3	C14	C15	H141	90.0°	122.6°
N3	C14	C15	H142	90.0°	120.4°
N3	C14	H141	H142	90.0°	119.6°
N3	C14	C15	N4	90.0°	56.9°
N3	C14	C15	H151	90.0°	65.8°
N3	C14	C15	H152	90.0°	177.3°
C14	N3	C17	C16	90.0°	56.8°
C14	N3	C17	H171	90.0°	176.5°
C14	N3	C17	H172	90.0°	65.2°
C17	N3	C14	C15	90.0°	56.8°
C17	N3	C14	H141	90.0°	65.3°
C17	N3	C14	H142	90.0°	176.6°
N3	C17	C16	N4	90.0°	57.0°
N3	C17	C16	H171	90.0°	120.3°
N3	C17	C16	H172	90.0°	122.7°
N3	C17	C16	H161	90.0°	177.4°
N3	C17	C16	H162	90.0°	65.7°
N3	C17	H171	H172	90.0°	120.4°
C15	C14	H141	H142	90.0°	117.7°
C14	C15	N4	H151	90.0°	122.1°
C14	C15	N4	H152	90.0°	119.8°
C14	C15	H151	H152	90.0°	117.7°
C14	C15	N4	C16	90.0°	56.6°
C14	C15	N4	C18	90.0°	179.9°
H141	C14	C15	N4	90.0°	65.7°
H141	C14	C15	H151	90.0°	171.6°
H141	C14	C15	H152	90.0°	54.7°
H142	C14	C15	N4	90.0°	177.3°
H142	C14	C15	H151	90.0°	54.7°
H142	C14	C15	H152	90.0°	62.3°
N4	C15	H151	H152	90.0°	119.5°
C15	N4	C16	C18	90.0°	123.2°
C15	N4	C16	C17	90.0°	56.7°
C15	N4	C16	H161	90.0°	176.4°
C15	N4	C16	H162	90.0°	65.4°
C15	N4	C18	C19	90.0°	63.4°
C15	N4	C18	H181	90.0°	60.0°
C15	N4	C18	H182	90.0°	175.9°
H151	C15	N4	C16	90.0°	65.4°
H151	C15	N4	C18	90.0°	57.8°
H152	C15	N4	C16	90.0°	176.5°
H152	C15	N4	C18	90.0°	60.3°
N4	C16	C17	H161	90.0°	120.4°
N4	C16	C17	H162	90.0°	122.7°
N4	C16	H161	H162	90.0°	120.3°
N4	C16	C17	H171	90.0°	177.3°
N4	C16	C17	H172	90.0°	65.7°
C16	N4	C18	C19	90.0°	173.6°
C16	N4	C18	H181	90.0°	63.0°
C16	N4	C18	H182	90.0°	52.9°
C18	N4	C16	C17	90.0°	179.9°
C18	N4	C16	H161	90.0°	60.4°
C18	N4	C16	H162	90.0°	57.8°
N4	C18	C19	H181	90.0°	121.3°
N4	C18	C19	H182	90.0°	119.0°
N4	C18	H181	H182	90.0°	115.1°
N4	C18	C19	C20	90.0°	58.7°
N4	C18	C19	H191	90.0°	63.3°
N4	C18	C19	H192	90.0°	179.7°
C17	C16	H161	H162	90.0°	118.5°
C16	C17	H171	H172	90.0°	118.5°
H161	C16	C17	H171	90.0°	62.3°
H161	C16	C17	H172	90.0°	54.7°
H162	C16	C17	H171	90.0°	54.7°
H162	C16	C17	H172	90.0°	171.7°
C19	C18	H181	H182	90.0°	120.8°
C18	C19	C20	H191	90.0°	121.5°
C18	C19	C20	H192	90.0°	122.0°
C18	C19	H191	H192	90.0°	117.9°
C18	C19	C20	N5	90.0°	59.0°
C18	C19	C20	H201	90.0°	60.0°
C18	C19	C20	H202	90.0°	179.7°
H181	C18	C19	C20	90.0°	180.0°
H181	C18	C19	H191	90.0°	58.0°
H181	C18	C19	H192	90.0°	58.4°
H182	C18	C19	C20	90.0°	60.3°
H182	C18	C19	H191	90.0°	177.8°
H182	C18	C19	H192	90.0°	61.3°
C20	C19	H191	H192	90.0°	117.5°
C19	C20	N5	H201	90.0°	120.7°
C19	C20	N5	H202	90.0°	123.3°
C19	C20	H201	H202	90.0°	121.8°
C19	C20	N5	C21	90.0°	179.3°
C19	C20	N5	HN5	90.0°	0.7°
H191	C19	C20	N5	90.0°	179.4°
H191	C19	C20	H201	90.0°	61.6°
H191	C19	C20	H202	90.0°	58.2°
H192	C19	C20	N5	90.0°	63.0°
H192	C19	C20	H201	90.0°	178.0°
H192	C19	C20	H202	90.0°	58.3°
N5	C20	H201	H202	90.0°	115.8°
C20	N5	C21	HN5	90.0°	180.0°
C20	N5	C21	C22	90.0°	0.1°
C20	N5	C21	C34	90.0°	180.0°
H201	C20	N5	C21	90.0°	60.0°
H201	C20	N5	HN5	90.0°	120.0°
H202	C20	N5	C21	90.0°	55.9°
H202	C20	N5	HN5	90.0°	124.0°
N5	C21	C22	C34	90.0°	179.9°
N5	C21	C22	N6	90.0°	0.0°
N5	C21	C22	C33	90.0°	179.9°
N5	C21	C34	C33	90.0°	179.9°
N5	C21	C34	O8	90.0°	0.0°
HN5	N5	C21	C22	90.0°	179.9°
HN5	N5	C21	C34	90.0°	0.0°
C21	C22	N6	C33	90.0°	179.9°
C21	C22	N6	C23	90.0°	0.1°
C21	C22	N6	HN6	90.0°	179.9°
C21	C22	C33	O7	90.0°	179.9°
C22	C21	C34	C33	90.0°	0.0°
C22	C21	C34	O8	90.0°	180.0°
C34	C21	C22	N6	90.0°	180.0°
C21	C34	C33	O7	90.0°	179.9°
C21	C34	C33	O8	90.0°	180.0°
C22	N6	C23	HN6	90.0°	179.9°
C22	N6	C23	C24	90.0°	179.2°
C22	N6	C23	H231	90.0°	60.0°
C22	N6	C23	H232	90.0°	55.8°
N6	C22	C33	O7	90.0°	0.2°
N6	C22	C33	C34	90.0°	180.0°
C33	C22	N6	C23	90.0°	180.0°
C33	C22	N6	HN6	90.0°	0.2°
C22	C33	O7	C34	90.0°	179.8°
C22	C33	C34	O8	90.0°	180.0°
N6	C23	C24	H231	90.0°	119.0°
N6	C23	C24	H232	90.0°	121.3°
N6	C23	H231	H232	90.0°	115.7°
N6	C23	C24	C25	90.0°	58.9°
N6	C23	C24	H241	90.0°	179.4°
N6	C23	C24	H242	90.0°	63.0°
HN6	N6	C23	C24	90.0°	0.6°
HN6	N6	C23	H231	90.0°	120.1°
HN6	N6	C23	H232	90.0°	124.0°
C24	C23	H231	H232	90.0°	121.8°
C23	C24	C25	H241	90.0°	122.0°
C23	C24	C25	H242	90.0°	121.5°
C23	C24	H241	H242	90.0°	117.4°
C23	C24	C25	N7	90.0°	58.7°
C23	C24	C25	H251	90.0°	180.0°
C23	C24	C25	H252	90.0°	60.3°
H231	C23	C24	C25	90.0°	60.0°
H231	C23	C24	H241	90.0°	61.6°
H231	C23	C24	H242	90.0°	178.0°
H232	C23	C24	C25	90.0°	179.7°
H232	C23	C24	H241	90.0°	58.1°
H232	C23	C24	H242	90.0°	58.3°
C25	C24	H241	H242	90.0°	117.9°
C24	C25	N7	H251	90.0°	123.4°
C24	C25	N7	H252	90.0°	120.8°
C24	C25	H251	H252	90.0°	120.9°
C24	C25	N7	C26	90.0°	63.4°
C24	C25	N7	C29	90.0°	173.6°
H241	C24	C25	N7	90.0°	63.3°
H241	C24	C25	H251	90.0°	58.0°
H241	C24	C25	H252	90.0°	177.7°
H242	C24	C25	N7	90.0°	179.7°
H242	C24	C25	H251	90.0°	58.5°
H242	C24	C25	H252	90.0°	61.3°
N7	C25	H251	H252	90.0°	115.1°
C25	N7	C26	C29	90.0°	123.2°
C25	N7	C26	C27	90.0°	179.9°
C25	N7	C26	H261	90.0°	57.8°
C25	N7	C26	H262	90.0°	60.3°
C25	N7	C29	C28	90.0°	179.9°
C25	N7	C29	H291	90.0°	60.4°
C25	N7	C29	H292	90.0°	57.8°
H251	C25	N7	C26	90.0°	60.0°
H251	C25	N7	C29	90.0°	63.0°
H252	C25	N7	C26	90.0°	175.9°
H252	C25	N7	C29	90.0°	52.9°
N7	C26	C27	H261	90.0°	122.6°
N7	C26	C27	H262	90.0°	120.4°
N7	C26	H261	H262	90.0°	119.5°
N7	C26	C27	N8	90.0°	56.9°
N7	C26	C27	H271	90.0°	65.7°
N7	C26	C27	H272	90.0°	177.3°
C26	N7	C29	C28	90.0°	56.7°
C26	N7	C29	H291	90.0°	176.4°
C26	N7	C29	H292	90.0°	65.4°
C29	N7	C26	C27	90.0°	56.7°
C29	N7	C26	H261	90.0°	65.4°
C29	N7	C26	H262	90.0°	176.5°
N7	C29	C28	N8	90.0°	57.0°
N7	C29	C28	H291	90.0°	120.4°
N7	C29	C28	H292	90.0°	122.6°
N7	C29	C28	H281	90.0°	177.3°
N7	C29	C28	H282	90.0°	65.7°
N7	C29	H291	H292	90.0°	120.3°
C27	C26	H261	H262	90.0°	117.7°
C26	C27	N8	H271	90.0°	122.1°
C26	C27	N8	H272	90.0°	119.7°
C26	C27	H271	H272	90.0°	117.8°
C26	C27	N8	C28	90.0°	56.8°
C26	C27	N8	C30	90.0°	179.9°
H261	C26	C27	N8	90.0°	65.7°
H261	C26	C27	H271	90.0°	171.7°
H261	C26	C27	H272	90.0°	54.6°
H262	C26	C27	N8	90.0°	177.4°
H262	C26	C27	H271	90.0°	54.8°
H262	C26	C27	H272	90.0°	62.3°
N8	C27	H271	H272	90.0°	119.5°
C27	N8	C28	C30	90.0°	123.1°
C27	N8	C28	C29	90.0°	56.9°
C27	N8	C28	H281	90.0°	176.5°
C27	N8	C28	H282	90.0°	65.2°
C27	N8	C30	C31	90.0°	63.4°
C27	N8	C30	H301	90.0°	59.9°
C27	N8	C30	H302	90.0°	175.9°
H271	C27	N8	C28	90.0°	65.3°
H271	C27	N8	C30	90.0°	57.8°
H272	C27	N8	C28	90.0°	176.5°
H272	C27	N8	C30	90.0°	60.4°
N8	C28	C29	H281	90.0°	120.3°
N8	C28	C29	H282	90.0°	122.7°
N8	C28	H281	H282	90.0°	120.4°
N8	C28	C29	H291	90.0°	177.4°
N8	C28	C29	H292	90.0°	65.6°
C28	N8	C30	C31	90.0°	173.7°
C28	N8	C30	H301	90.0°	63.0°
C28	N8	C30	H302	90.0°	53.0°
C30	N8	C28	C29	90.0°	180.0°
C30	N8	C28	H281	90.0°	60.4°
C30	N8	C28	H282	90.0°	57.9°
N8	C30	C31	H301	90.0°	121.3°
N8	C30	C31	H302	90.0°	119.0°
N8	C30	H301	H302	90.0°	115.2°
N8	C30	C31	C32	90.0°	58.7°
N8	C30	C31	H311	90.0°	63.2°
N8	C30	C31	H312	90.0°	179.7°
C29	C28	H281	H282	90.0°	118.5°
C28	C29	H291	H292	90.0°	118.5°
H281	C28	C29	H291	90.0°	62.3°
H281	C28	C29	H292	90.0°	54.7°
H282	C28	C29	H291	90.0°	54.6°
H282	C28	C29	H292	90.0°	171.6°
C31	C30	H301	H302	90.0°	120.8°
C30	C31	C32	H311	90.0°	121.6°
C30	C31	C32	H312	90.0°	122.0°
C30	C31	H311	H312	90.0°	117.9°
C30	C31	C32	H321	90.0°	60.0°
C30	C31	C32	H322	90.0°	179.7°
H301	C30	C31	C32	90.0°	180.0°
H301	C30	C31	H311	90.0°	58.0°
H301	C30	C31	H312	90.0°	58.4°
H302	C30	C31	C32	90.0°	60.3°
H302	C30	C31	H311	90.0°	177.8°
H302	C30	C31	H312	90.0°	61.3°
C32	C31	H311	H312	90.0°	117.4°
C31	C32	H321	H322	90.0°	121.8°
H311	C31	C32	H321	90.0°	61.6°
H311	C31	C32	H322	90.0°	58.1°
H312	C31	C32	H321	90.0°	178.0°
H312	C31	C32	H322	90.0°	58.3°
O7	C33	C34	O8	90.0°	0.1°
O9	C35	C36	H35	90.0°	116.9°
O9	C35	C36	O10	90.0°	54.5°
O9	C35	C36	C37	90.0°	68.8°
O9	C35	C36	H36	90.0°	172.0°
C36	C35	O9	HO9	90.0°	48.3°
C35	C36	O10	C37	90.0°	124.2°
C35	C36	O10	H36	90.0°	118.4°
C35	C36	C37	H36	90.0°	119.5°
C35	C36	O10	H10	90.0°	105.9°
C35	C36	C37	O11	90.0°	69.4°
C35	C36	C37	H37	90.0°	174.0°
H35	C35	O9	HO9	90.0°	168.2°
H35	C35	C36	O10	90.0°	62.4°
H35	C35	C36	C37	90.0°	174.3°
H35	C35	C36	H36	90.0°	55.0°
O10	C36	C37	H36	90.0°	116.8°
O10	C36	C37	O11	90.0°	54.3°
O10	C36	C37	H37	90.0°	62.3°
C37	C36	O10	H10	90.0°	18.2°
C36	C37	O11	H37	90.0°	118.4°
C36	C37	O11	H11	90.0°	162.1°
H36	C36	O10	H10	90.0°	135.7°
H36	C36	C37	O11	90.0°	171.1°
H36	C36	C37	H37	90.0°	54.5°
H37	C37	O11	H11	90.0°	43.7°

Definition date:	2003-11-07
Last modified:	2021-03-01
Release status:	REL
Processing site:	RCSB
Derived from:	1RCV