A1DMU

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CR5	OR8	sing	0.00Å	1.44Å
CR5	CR4	sing	0.00Å	1.48Å
OP4	P1	doub	0.00Å	1.48Å
N45	C43	sing	0.00Å	1.33Å
CR4	CR3	sing	0.00Å	1.51Å
CR4	OR6	sing	0.00Å	1.45Å
CR3	OP2	sing	0.00Å	1.42Å
CR3	CR2	sing	0.00Å	1.51Å
OR6	CR1	sing	0.00Å	1.40Å
P1	OP5	sing	0.00Å	1.49Å
P1	OP2	sing	0.00Å	1.61Å
P1	OP3	sing	0.00Å	1.61Å
C49	C50	sing	0.00Å	1.51Å
C49	C48	doub	0.00Å	1.53Å
CR1	CR2	sing	0.00Å	1.53Å
CR1	NB1	sing	0.00Å	1.45Å
C43	O44	doub	0.00Å	1.25Å
C43	C42	sing	0.00Å	1.47Å
CPR3	CPR2	sing	0.00Å	1.50Å
CB11	CB6	sing	0.00Å	1.51Å
O51	C50	doub	0.00Å	1.24Å
C50	N52	sing	0.00Å	1.33Å
CR2	OR7	sing	0.00Å	1.40Å
CB7	CB6	doub	0.00Å	1.39Å	Aromatic
CB7	CB8	sing	0.00Å	1.37Å	Aromatic
CPR2	OP3	sing	0.00Å	1.47Å
CPR2	CPR1	sing	0.00Å	1.50Å
C47	C12	sing	0.00Å	1.54Å
C42	C41	sing	0.00Å	1.50Å
C48	C13	sing	0.00Å	1.54Å
CB6	CB5	sing	0.00Å	1.40Å	Aromatic
NB1	CB8	sing	0.00Å	1.36Å	Aromatic
NB1	CB2	sing	0.00Å	1.37Å	Aromatic
CB8	CB9	doub	0.00Å	1.39Å	Aromatic
CPR1	N59	sing	0.00Å	1.45Å
C12	C13	sing	0.00Å	1.56Å
C12	C11	sing	0.00Å	1.51Å
C12	C46	sing	0.00Å	1.55Å
CB2	NB3	doub	0.00Å	1.34Å	Aromatic
C13	C14	sing	0.00Å	1.53Å
CB5	CB10	sing	0.00Å	1.50Å
CB5	CB4	doub	0.00Å	1.38Å	Aromatic
C41	C8	sing	0.00Å	1.55Å
CB9	CB4	sing	0.00Å	1.39Å	Aromatic
CB9	NB3	sing	0.00Å	1.40Å	Aromatic
C10	C11	sing	0.00Å	1.39Å
C10	C9	doub	0.00Å	1.40Å
C11	N23	doub	0.00Å	1.33Å
O58	C57	doub	0.00Å	1.24Å
N59	C57	sing	0.00Å	1.30Å
NB3	CO1	sing	0.00Å	2.07Å
C57	C56	sing	0.00Å	1.51Å
C8	C9	sing	0.00Å	1.53Å
C8	C7	sing	0.00Å	1.55Å
C14	N23	sing	0.00Å	1.41Å
C14	C15	doub	0.00Å	1.39Å
C9	N22	sing	0.00Å	1.35Å
N23	CO1	sing	0.00Å	1.91Å
C53	C15	sing	0.00Å	1.52Å
C56	C55	sing	0.00Å	1.53Å
C15	C16	sing	0.00Å	1.43Å
O39	C38	doub	0.00Å	1.25Å
N22	CO1	sing	0.00Å	1.92Å
N22	C6	doub	0.00Å	1.40Å
C7	C36	sing	0.00Å	1.53Å
C7	C6	sing	0.00Å	1.53Å
C7	C37	sing	0.00Å	1.53Å
CO1	N24	sing	0.00Å	1.91Å
CO1	N21	sing	0.00Å	1.85Å
CO1	C1L	sing	0.00Å	1.87Å
C16	N24	doub	0.00Å	1.32Å
C16	C17	sing	0.00Å	1.55Å
C38	C37	sing	0.00Å	1.50Å
C38	N40	sing	0.00Å	1.33Å
C6	C5	sing	0.00Å	1.37Å
C55	C17	sing	0.00Å	1.54Å
N24	C19	sing	0.00Å	1.48Å
C20	C1	sing	0.00Å	1.53Å
C17	C18	sing	0.00Å	1.55Å
C17	C54	sing	0.00Å	1.56Å
N21	C1	sing	0.00Å	1.49Å
N21	C4	sing	0.00Å	1.30Å
C1L	C2L	trip	0.00Å	1.22Å
O33	C32	doub	0.00Å	1.23Å
O62	C61	doub	0.00Å	1.25Å
C5	C4	doub	0.00Å	1.45Å
C5	C35	sing	0.00Å	1.52Å
C18	C19	sing	0.00Å	1.53Å
C18	C60	sing	0.00Å	1.55Å
C1	C19	sing	0.00Å	1.55Å
C1	C2	sing	0.00Å	1.58Å
C03	C02	sing	0.00Å	1.49Å
C03	C04	sing	0.00Å	1.50Å
C4	C3	sing	0.00Å	1.50Å
C30	C3	sing	0.00Å	1.56Å
C30	C31	sing	0.00Å	1.54Å
C02	C04	sing	0.00Å	1.50Å
C02	N01	sing	0.00Å	1.45Å
C32	N34	sing	0.00Å	1.35Å
C32	C31	sing	0.00Å	1.52Å
C2L	C01	sing	0.00Å	1.53Å
C61	C60	sing	0.00Å	1.52Å
C61	N63	sing	0.00Å	1.33Å
C3	C2	sing	0.00Å	1.54Å
C2	C25	sing	0.00Å	1.52Å
C2	C26	sing	0.00Å	1.54Å
N01	C01	sing	0.00Å	1.47Å
C01	O01	doub	0.00Å	1.43Å
C26	C27	sing	0.00Å	1.51Å
C27	N29	sing	0.00Å	1.33Å
C27	O28	doub	0.00Å	1.26Å
C3	H2	sing	0.00Å	1.10Å
CB2	H3	sing	0.00Å	1.08Å
C02	H4	sing	0.00Å	1.10Å
C03	H5	sing	0.00Å	1.10Å
C03	H6	sing	0.00Å	1.10Å
C04	H7	sing	0.00Å	1.10Å
C04	H8	sing	0.00Å	1.10Å
C10	H9	sing	0.00Å	1.08Å
C13	H11	sing	0.00Å	1.10Å
C18	H15	sing	0.00Å	1.10Å
C19	H16	sing	0.00Å	1.10Å
C20	H17	sing	0.00Å	1.10Å
C20	H18	sing	0.00Å	1.10Å
C20	H19	sing	0.00Å	1.10Å
C25	H20	sing	0.00Å	1.10Å
C25	H21	sing	0.00Å	1.10Å
C25	H22	sing	0.00Å	1.10Å
C26	H23	sing	0.00Å	1.10Å
C26	H24	sing	0.00Å	1.10Å
C30	H25	sing	0.00Å	1.10Å
C30	H26	sing	0.00Å	1.10Å
C31	H27	sing	0.00Å	1.10Å
C31	H28	sing	0.00Å	1.10Å
C35	H29	sing	0.00Å	1.10Å
C35	H30	sing	0.00Å	1.10Å
C35	H31	sing	0.00Å	1.10Å
C36	H32	sing	0.00Å	1.10Å
C36	H33	sing	0.00Å	1.10Å
C36	H34	sing	0.00Å	1.10Å
C37	H35	sing	0.00Å	1.10Å
C37	H36	sing	0.00Å	1.10Å
C41	H37	sing	0.00Å	1.10Å
C41	H38	sing	0.00Å	1.10Å
C42	H39	sing	0.00Å	1.10Å
C42	H40	sing	0.00Å	1.10Å
C46	H41	sing	0.00Å	1.10Å
C46	H42	sing	0.00Å	1.10Å
C46	H43	sing	0.00Å	1.10Å
C47	H44	sing	0.00Å	1.10Å
C47	H45	sing	0.00Å	1.10Å
C47	H46	sing	0.00Å	1.10Å
C48	H47	sing	0.00Å	1.08Å
C49	H48	sing	0.00Å	1.08Å
C53	H49	sing	0.00Å	1.10Å
C53	H50	sing	0.00Å	1.10Å
C53	H51	sing	0.00Å	1.10Å
C54	H52	sing	0.00Å	1.10Å
C54	H53	sing	0.00Å	1.10Å
C54	H54	sing	0.00Å	1.10Å
C55	H55	sing	0.00Å	1.10Å
C55	H56	sing	0.00Å	1.10Å
C56	H57	sing	0.00Å	1.10Å
C56	H58	sing	0.00Å	1.10Å
C60	H59	sing	0.00Å	1.10Å
C60	H60	sing	0.00Å	1.10Å
C8	H61	sing	0.00Å	1.10Å
CB4	H62	sing	0.00Å	1.08Å
CB7	H63	sing	0.00Å	1.08Å
CR1	H64	sing	0.00Å	1.10Å
CR2	H65	sing	0.00Å	1.10Å
CR3	H66	sing	0.00Å	1.10Å
CR4	H67	sing	0.00Å	1.10Å
CR5	H68	sing	0.00Å	1.10Å
CR5	H69	sing	0.00Å	1.10Å
N01	H70	sing	0.00Å	1.00Å
N29	H71	sing	0.00Å	1.00Å
N29	H72	sing	0.00Å	1.00Å
N34	H73	sing	0.00Å	1.00Å
N34	H74	sing	0.00Å	1.00Å
N40	H75	sing	0.00Å	1.00Å
N40	H76	sing	0.00Å	1.00Å
N45	H77	sing	0.00Å	1.00Å
N45	H78	sing	0.00Å	1.00Å
N52	H79	sing	0.00Å	1.00Å
N52	H80	sing	0.00Å	1.00Å
N59	H81	sing	0.00Å	1.00Å
N63	H82	sing	0.00Å	1.00Å
N63	H83	sing	0.00Å	1.00Å
OP5	H84	sing	0.00Å	0.95Å
OR7	H85	sing	0.00Å	0.95Å
OR8	H86	sing	0.00Å	0.95Å
CB10	H87	sing	0.00Å	1.10Å
CB10	H88	sing	0.00Å	1.10Å
CB10	H89	sing	0.00Å	1.10Å
CB11	H90	sing	0.00Å	1.10Å
CB11	H91	sing	0.00Å	1.10Å
CB11	H92	sing	0.00Å	1.10Å
CPR1	H93	sing	0.00Å	1.10Å
CPR1	H94	sing	0.00Å	1.10Å
CPR2	H95	sing	0.00Å	1.10Å
CPR3	H96	sing	0.00Å	1.10Å
CPR3	H97	sing	0.00Å	1.10Å
CPR3	H98	sing	0.00Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
OR8	CR5	CR4	109.6°	90.0°
OR8	CR5	H68	109.5°	90.0°
OR8	CR5	H69	109.5°	90.0°
CR5	OR8	H86	109.5°	90.0°
CR5	CR4	CR3	117.5°	90.0°
CR5	CR4	OR6	107.2°	90.0°
CR5	CR4	H67	108.3°	90.0°
CR4	CR5	H68	109.4°	90.0°
CR4	CR5	H69	109.5°	90.0°
OP4	P1	OP5	122.4°	90.0°
OP4	P1	OP2	110.8°	90.0°
OP4	P1	OP3	107.1°	90.0°
N45	C43	O44	124.0°	90.0°
N45	C43	C42	117.1°	90.0°
C43	N45	H77	120.0°	90.0°
C43	N45	H78	120.0°	90.0°
CR3	CR4	OR6	107.1°	90.0°
CR4	CR3	OP2	105.1°	90.0°
CR4	CR3	CR2	101.1°	90.0°
CR4	CR3	H66	111.9°	90.0°
CR3	CR4	H67	107.9°	90.0°
CR4	OR6	CR1	110.5°	90.0°
OR6	CR4	H67	108.7°	90.0°
OP2	CR3	CR2	112.7°	90.0°
CR3	OP2	P1	123.8°	90.0°
OP2	CR3	H66	113.4°	90.0°
CR3	CR2	CR1	103.2°	90.0°
CR3	CR2	OR7	109.3°	90.0°
CR3	CR2	H65	111.7°	90.0°
CR2	CR3	H66	111.8°	90.0°
OR6	CR1	CR2	102.8°	90.0°
OR6	CR1	NB1	109.8°	90.0°
OR6	CR1	H64	113.3°	90.0°
OP5	P1	OP2	106.9°	90.0°
OP5	P1	OP3	104.6°	90.0°
P1	OP5	H84	109.5°	90.0°
OP2	P1	OP3	103.3°	90.0°
P1	OP3	CPR2	120.2°	90.0°
C50	C49	C48	115.2°	90.0°
C49	C50	O51	118.6°	90.0°
C49	C50	N52	119.0°	90.0°
C50	C49	H48	122.4°	90.0°
C49	C48	C13	118.4°	90.0°
C49	C48	H47	120.8°	90.0°
C48	C49	H48	122.4°	90.0°
CR2	CR1	NB1	106.3°	90.0°
CR1	CR2	OR7	106.9°	90.0°
CR2	CR1	H64	111.3°	90.0°
CR1	CR2	H65	111.5°	90.0°
CR1	NB1	CB8	124.9°	90.0°
CR1	NB1	CB2	129.4°	90.0°
NB1	CR1	H64	112.6°	90.0°
O44	C43	C42	118.8°	90.0°
C43	C42	C41	105.6°	90.0°
C43	C42	H39	110.5°	90.0°
C43	C42	H40	110.4°	90.0°
CPR3	CPR2	OP3	111.8°	90.0°
CPR3	CPR2	CPR1	110.5°	90.0°
CPR3	CPR2	H95	109.6°	90.0°
CPR2	CPR3	H96	109.5°	90.0°
CPR2	CPR3	H97	109.4°	90.0°
CPR2	CPR3	H98	109.5°	90.0°
CB11	CB6	CB7	118.9°	90.0°
CB11	CB6	CB5	119.4°	90.0°
CB6	CB11	H90	109.5°	90.0°
CB6	CB11	H91	109.5°	90.0°
CB6	CB11	H92	109.5°	90.0°
O51	C50	N52	122.4°	90.0°
C50	N52	H79	120.0°	90.0°
C50	N52	H80	120.0°	90.0°
OR7	CR2	H65	113.5°	90.0°
CR2	OR7	H85	109.5°	90.0°
CB6	CB7	CB8	116.2°	90.0°
CB7	CB6	CB5	121.6°	90.0°
CB6	CB7	H63	121.9°	90.0°
CB7	CB8	NB1	128.9°	90.0°
CB7	CB8	CB9	123.5°	90.0°
CB8	CB7	H63	121.9°	90.0°
OP3	CPR2	CPR1	105.2°	90.0°
OP3	CPR2	H95	110.0°	90.0°
CPR2	CPR1	N59	114.1°	90.0°
CPR2	CPR1	H93	108.3°	90.0°
CPR2	CPR1	H94	108.3°	90.0°
CPR1	CPR2	H95	109.6°	90.0°
C47	C12	C13	117.0°	90.0°
C47	C12	C11	116.8°	90.0°
C47	C12	C46	110.0°	90.0°
C12	C47	H44	109.5°	90.0°
C12	C47	H45	109.5°	90.0°
C12	C47	H46	109.5°	90.0°
C42	C41	C8	115.0°	90.0°
C42	C41	H37	108.1°	90.0°
C42	C41	H38	108.1°	90.0°
C41	C42	H39	110.4°	90.0°
C41	C42	H40	110.5°	90.0°
C48	C13	C12	117.0°	90.0°
C48	C13	C14	109.6°	90.0°
C48	C13	H11	109.2°	90.0°
C13	C48	H47	120.8°	90.0°
CB6	CB5	CB10	118.1°	90.0°
CB6	CB5	CB4	120.9°	90.0°
CB8	NB1	CB2	105.6°	90.0°
NB1	CB8	CB9	107.6°	90.0°
NB1	CB2	NB3	113.6°	90.0°
NB1	CB2	H3	123.2°	90.0°
CB8	CB9	CB4	119.8°	90.0°
CB8	CB9	NB3	109.3°	90.0°
CPR1	N59	C57	119.1°	90.0°
CPR1	N59	H81	120.5°	90.0°
N59	CPR1	H93	108.3°	90.0°
N59	CPR1	H94	108.3°	90.0°
C13	C12	C11	100.1°	90.0°
C13	C12	C46	107.2°	90.0°
C12	C13	C14	102.6°	90.0°
C12	C13	H11	108.9°	90.0°
C11	C12	C46	104.6°	90.0°
C12	C11	C10	124.2°	90.0°
C12	C11	N23	109.8°	90.0°
C12	C46	H41	109.5°	90.0°
C12	C46	H42	109.4°	90.0°
C12	C46	H43	109.5°	90.0°
CB2	NB3	CB9	103.9°	90.0°
CB2	NB3	CO1	123.8°	90.0°
NB3	CB2	H3	123.2°	90.0°
C13	C14	N23	108.3°	90.0°
C13	C14	C15	123.1°	90.0°
C14	C13	H11	109.3°	90.0°
CB10	CB5	CB4	120.9°	90.0°
CB5	CB10	H87	109.5°	90.0°
CB5	CB10	H88	109.4°	90.0°
CB5	CB10	H89	109.4°	90.0°
CB5	CB4	CB9	117.9°	90.0°
CB5	CB4	H62	121.0°	90.0°
C41	C8	C9	110.9°	90.0°
C41	C8	C7	114.8°	90.0°
C8	C41	H37	108.1°	90.0°
C8	C41	H38	108.1°	90.0°
C41	C8	H61	109.7°	90.0°
CB4	CB9	NB3	130.9°	90.0°
CB9	CB4	H62	121.0°	90.0°
CB9	NB3	CO1	132.3°	90.0°
C11	C10	C9	125.6°	90.0°
C10	C11	N23	125.4°	90.0°
C11	C10	H9	117.2°	90.0°
C10	C9	C8	124.8°	90.0°
C10	C9	N22	125.6°	90.0°
C9	C10	H9	117.2°	90.0°
C11	N23	C14	109.5°	90.0°
C11	N23	CO1	122.1°	90.0°
O58	C57	N59	121.8°	90.0°
O58	C57	C56	117.1°	90.0°
N59	C57	C56	120.9°	90.0°
C57	N59	H81	120.5°	90.0°
NB3	CO1	N23	87.5°	90.0°
NB3	CO1	N22	89.1°	90.0°
NB3	CO1	N24	94.7°	90.0°
NB3	CO1	N21	96.8°	90.0°
NB3	CO1	C1L	173.5°	90.0°
C57	C56	C55	105.6°	90.0°
C57	C56	H57	110.4°	90.0°
C57	C56	H58	110.4°	90.0°
C9	C8	C7	101.5°	90.0°
C8	C9	N22	109.6°	90.0°
C9	C8	H61	110.0°	90.0°
C8	C7	C36	108.8°	90.0°
C8	C7	C6	100.1°	90.0°
C8	C7	C37	109.7°	90.0°
C7	C8	H61	109.8°	90.0°
N23	C14	C15	128.0°	90.0°
C14	N23	CO1	124.5°	90.0°
C14	C15	C53	116.8°	90.0°
C14	C15	C16	120.0°	90.0°
C9	N22	CO1	120.9°	90.0°
C9	N22	C6	110.2°	90.0°
N23	CO1	N22	97.7°	90.0°
N23	CO1	N24	88.9°	90.0°
N23	CO1	N21	172.5°	90.0°
N23	CO1	C1L	93.1°	90.0°
C53	C15	C16	118.7°	90.0°
C15	C53	H49	109.5°	90.0°
C15	C53	H50	109.5°	90.0°
C15	C53	H51	109.5°	90.0°
C56	C55	C17	114.3°	90.0°
C56	C55	H55	108.3°	90.0°
C56	C55	H56	108.3°	90.0°
C55	C56	H57	110.4°	90.0°
C55	C56	H58	110.4°	90.0°
C15	C16	N24	120.7°	90.0°
C15	C16	C17	127.7°	90.0°
O39	C38	C37	120.5°	90.0°
O39	C38	N40	121.7°	90.0°
CO1	N22	C6	128.3°	90.0°
N22	CO1	N24	172.6°	90.0°
N22	CO1	N21	88.6°	90.0°
N22	CO1	C1L	84.4°	90.0°
N22	C6	C7	108.6°	90.0°
N22	C6	C5	121.8°	90.0°
C36	C7	C6	121.8°	90.0°
C36	C7	C37	109.7°	90.0°
C7	C36	H32	109.5°	90.0°
C7	C36	H33	109.5°	90.0°
C7	C36	H34	109.5°	90.0°
C6	C7	C37	106.0°	90.0°
C7	C6	C5	128.1°	90.0°
C7	C37	C38	111.5°	90.0°
C7	C37	H35	109.0°	90.0°
C7	C37	H36	109.0°	90.0°
N24	CO1	N21	84.6°	90.0°
N24	CO1	C1L	91.7°	90.0°
CO1	N24	C16	135.3°	90.0°
CO1	N24	C19	113.5°	90.0°
N21	CO1	C1L	83.4°	90.0°
CO1	N21	C1	115.2°	90.0°
CO1	N21	C4	129.4°	90.0°
CO1	C1L	C2L	172.0°	90.0°
N24	C16	C17	111.6°	90.0°
C16	N24	C19	110.3°	90.0°
C16	C17	C55	118.7°	90.0°
C16	C17	C18	97.7°	90.0°
C16	C17	C54	112.4°	90.0°
C37	C38	N40	117.8°	90.0°
C38	C37	H35	109.0°	90.0°
C38	C37	H36	108.9°	90.0°
C38	N40	H75	120.0°	90.0°
C38	N40	H76	120.0°	90.0°
C6	C5	C4	121.2°	90.0°
C6	C5	C35	124.9°	90.0°
C55	C17	C18	107.5°	90.0°
C55	C17	C54	108.9°	90.0°
C17	C55	H55	108.3°	90.0°
C17	C55	H56	108.2°	90.0°
N24	C19	C18	100.0°	90.0°
N24	C19	C1	105.1°	90.0°
N24	C19	H16	111.4°	90.0°
C20	C1	N21	111.9°	90.0°
C20	C1	C19	106.2°	90.0°
C20	C1	C2	115.8°	90.0°
C1	C20	H17	109.5°	90.0°
C1	C20	H18	109.5°	90.0°
C1	C20	H19	109.5°	90.0°
C18	C17	C54	111.0°	90.0°
C17	C18	C19	103.2°	90.0°
C17	C18	C60	116.8°	90.0°
C17	C18	H15	106.5°	90.0°
C17	C54	H52	109.5°	90.0°
C17	C54	H53	109.5°	90.0°
C17	C54	H54	109.5°	90.0°
C1	N21	C4	113.3°	90.0°
N21	C1	C19	104.2°	90.0°
N21	C1	C2	97.7°	90.0°
N21	C4	C5	124.1°	90.0°
N21	C4	C3	111.0°	90.0°
C1L	C2L	C01	171.5°	90.0°
O33	C32	N34	125.2°	90.0°
O33	C32	C31	122.5°	90.0°
O62	C61	C60	125.1°	90.0°
O62	C61	N63	121.4°	90.0°
C4	C5	C35	113.9°	90.0°
C5	C4	C3	119.0°	90.0°
C5	C35	H29	109.5°	90.0°
C5	C35	H30	109.5°	90.0°
C5	C35	H31	109.5°	90.0°
C19	C18	C60	116.5°	90.0°
C18	C19	C1	118.8°	90.0°
C19	C18	H15	106.7°	90.0°
C18	C19	H16	110.7°	90.0°
C18	C60	C61	116.4°	90.0°
C60	C18	H15	106.5°	90.0°
C18	C60	H59	107.7°	90.0°
C18	C60	H60	107.7°	90.0°
C19	C1	C2	120.1°	90.0°
C1	C19	H16	110.3°	90.0°
C1	C2	C3	105.3°	90.0°
C1	C2	C25	111.4°	90.0°
C1	C2	C26	111.3°	90.0°
C02	C03	C04	60.2°	90.0°
C03	C02	C04	60.1°	90.0°
C03	C02	N01	114.2°	90.0°
C03	C02	H4	117.8°	90.0°
C02	C03	H5	120.0°	90.0°
C02	C03	H6	120.0°	90.0°
C03	C04	C02	59.7°	90.0°
C04	C03	H5	120.0°	90.0°
C04	C03	H6	120.0°	90.0°
C03	C04	H7	120.0°	90.0°
C03	C04	H8	120.0°	90.0°
C4	C3	C30	115.6°	90.0°
C4	C3	C2	95.5°	90.0°
C4	C3	H2	109.1°	90.0°
C3	C30	C31	111.1°	90.0°
C30	C3	C2	118.9°	90.0°
C30	C3	H2	108.3°	90.0°
C3	C30	H25	109.1°	90.0°
C3	C30	H26	109.1°	90.0°
C30	C31	C32	118.9°	90.0°
C31	C30	H25	109.0°	90.0°
C31	C30	H26	109.1°	90.0°
C30	C31	H27	107.1°	90.0°
C30	C31	H28	107.1°	90.0°
C04	C02	N01	115.2°	90.0°
C04	C02	H4	117.6°	90.0°
C02	C04	H7	120.1°	90.0°
C02	C04	H8	120.1°	90.0°
C02	N01	C01	118.4°	90.0°
N01	C02	H4	118.7°	90.0°
C02	N01	H70	120.8°	90.0°
N34	C32	C31	112.3°	90.0°
C32	N34	H73	120.0°	90.0°
C32	N34	H74	120.0°	90.0°
C32	C31	H27	107.0°	90.0°
C32	C31	H28	107.0°	90.0°
C2L	C01	N01	129.4°	90.0°
C2L	C01	O01	110.0°	90.0°
C60	C61	N63	113.5°	90.0°
C61	C60	H59	107.7°	90.0°
C61	C60	H60	107.7°	90.0°
C61	N63	H82	120.0°	90.0°
C61	N63	H83	120.0°	90.0°
C3	C2	C25	113.6°	90.0°
C3	C2	C26	101.1°	90.0°
C2	C3	H2	108.6°	90.0°
C25	C2	C26	113.5°	90.0°
C2	C25	H20	109.5°	90.0°
C2	C25	H21	109.5°	90.0°
C2	C25	H22	109.4°	90.0°
C2	C26	C27	117.5°	90.0°
C2	C26	H23	107.4°	90.0°
C2	C26	H24	107.4°	90.0°
N01	C01	O01	120.5°	90.0°
C01	N01	H70	120.8°	90.0°
C26	C27	N29	114.8°	90.0°
C26	C27	O28	122.7°	90.0°
C27	C26	H23	107.5°	90.0°
C27	C26	H24	107.4°	90.0°
N29	C27	O28	122.4°	90.0°
C27	N29	H71	120.0°	90.0°
C27	N29	H72	120.0°	90.0°
H5	C03	H6	109.4°	90.0°
H7	C04	H8	109.5°	90.0°
H17	C20	H18	109.5°	90.0°
H17	C20	H19	109.5°	90.0°
H18	C20	H19	109.5°	90.0°
H20	C25	H21	109.4°	90.0°
H20	C25	H22	109.5°	90.0°
H21	C25	H22	109.5°	90.0°
H23	C26	H24	109.5°	90.0°
H25	C30	H26	109.5°	90.0°
H27	C31	H28	109.5°	90.0°
H29	C35	H30	109.5°	90.0°
H29	C35	H31	109.5°	90.0°
H30	C35	H31	109.4°	90.0°
H32	C36	H33	109.5°	90.0°
H32	C36	H34	109.4°	90.0°
H33	C36	H34	109.5°	90.0°
H35	C37	H36	109.5°	90.0°
H37	C41	H38	109.5°	90.0°
H39	C42	H40	109.5°	90.0°
H41	C46	H42	109.5°	90.0°
H41	C46	H43	109.5°	90.0°
H42	C46	H43	109.5°	90.0°
H44	C47	H45	109.5°	90.0°
H44	C47	H46	109.4°	90.0°
H45	C47	H46	109.5°	90.0°
H49	C53	H50	109.4°	90.0°
H49	C53	H51	109.5°	90.0°
H50	C53	H51	109.5°	90.0°
H52	C54	H53	109.4°	90.0°
H52	C54	H54	109.5°	90.0°
H53	C54	H54	109.5°	90.0°
H55	C55	H56	109.4°	90.0°
H57	C56	H58	109.5°	90.0°
H59	C60	H60	109.5°	90.0°
H68	CR5	H69	109.4°	90.0°
H71	N29	H72	120.0°	90.0°
H73	N34	H74	120.0°	90.0°
H75	N40	H76	120.0°	90.0°
H77	N45	H78	120.0°	90.0°
H79	N52	H80	120.0°	90.0°
H82	N63	H83	120.0°	90.0°
H87	CB10	H88	109.5°	90.0°
H87	CB10	H89	109.5°	90.0°
H88	CB10	H89	109.5°	90.0°
H90	CB11	H91	109.5°	90.0°
H90	CB11	H92	109.4°	90.0°
H91	CB11	H92	109.5°	90.0°
H93	CPR1	H94	109.5°	90.0°
H96	CPR3	H97	109.5°	90.0°
H96	CPR3	H98	109.5°	90.0°
H97	CPR3	H98	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
OR8	CR5	CR4	H68	120.0°	90.0°
OR8	CR5	CR4	H69	120.0°	90.0°
OR8	CR5	CR4	CR3	177.8°	90.0°
OR8	CR5	CR4	OR6	57.3°	90.0°
OR8	CR5	CR4	H67	59.8°	90.0°
OR8	CR5	H68	H69	120.0°	90.0°
CR5	CR4	CR3	OR6	120.6°	90.0°
CR5	CR4	CR3	H67	122.6°	90.0°
CR5	CR4	OR6	H67	116.8°	90.0°
CR5	CR4	CR3	OP2	100.5°	90.0°
CR5	CR4	CR3	CR2	142.1°	90.0°
CR5	CR4	OR6	CR1	124.6°	90.0°
CR5	CR4	CR3	H66	22.9°	90.0°
CR4	CR5	H68	H69	119.9°	90.0°
CR4	CR5	OR8	H86	180.0°	90.0°
OP4	P1	OP2	CR3	48.1°	90.0°
OP4	P1	OP5	OP2	129.2°	90.0°
OP4	P1	OP5	OP3	121.7°	90.0°
OP4	P1	OP2	OP3	114.3°	90.0°
OP4	P1	OP3	CPR2	50.4°	90.0°
OP4	P1	OP5	H84	0.0°	90.0°
N45	C43	O44	C42	178.8°	90.0°
N45	C43	C42	C41	156.5°	90.0°
N45	C43	C42	H39	37.1°	90.0°
N45	C43	C42	H40	84.1°	90.0°
C43	N45	H77	H78	180.0°	90.0°
CR3	CR4	OR6	H67	116.3°	90.0°
CR4	CR3	OP2	CR2	109.2°	90.0°
CR4	CR3	OP2	H66	122.5°	90.0°
CR4	CR3	CR2	H66	119.2°	90.0°
CR3	CR4	OR6	CR1	2.4°	90.0°
CR4	CR3	OP2	P1	124.5°	90.0°
CR4	CR3	CR2	CR1	35.8°	90.0°
CR4	CR3	CR2	OR7	77.7°	90.0°
CR4	CR3	CR2	H65	155.8°	90.0°
CR3	CR4	CR5	H68	57.8°	90.0°
CR3	CR4	CR5	H69	62.2°	90.0°
OR6	CR4	CR3	OP2	138.9°	90.0°
OR6	CR4	CR3	CR2	21.5°	90.0°
CR4	OR6	CR1	CR2	25.1°	90.0°
CR4	OR6	CR1	NB1	138.0°	90.0°
CR4	OR6	CR1	H64	95.2°	90.0°
OR6	CR4	CR3	H66	97.7°	90.0°
OR6	CR4	CR5	H68	62.8°	90.0°
OR6	CR4	CR5	H69	177.3°	90.0°
OP2	CR3	CR2	H66	129.1°	90.0°
CR3	OP2	P1	OP5	87.5°	90.0°
CR3	OP2	P1	OP3	162.4°	90.0°
OP2	CR3	CR2	CR1	147.5°	90.0°
OP2	CR3	CR2	OR7	34.0°	90.0°
OP2	CR3	CR2	H65	92.5°	90.0°
OP2	CR3	CR4	H67	22.1°	90.0°
CR3	CR2	CR1	OR6	38.2°	90.0°
CR2	CR3	OP2	P1	126.3°	90.0°
CR3	CR2	CR1	OR7	115.3°	90.0°
CR3	CR2	CR1	H65	120.1°	90.0°
CR3	CR2	CR1	NB1	153.5°	90.0°
CR3	CR2	OR7	H65	125.5°	90.0°
CR3	CR2	CR1	H64	83.5°	90.0°
CR2	CR3	CR4	H67	95.3°	90.0°
CR3	CR2	OR7	H85	180.0°	90.0°
OR6	CR1	CR2	NB1	115.4°	90.0°
OR6	CR1	CR2	H64	121.7°	90.0°
OR6	CR1	NB1	H64	127.3°	90.0°
OR6	CR1	CR2	OR7	77.1°	90.0°
OR6	CR1	NB1	CB8	160.6°	90.0°
OR6	CR1	NB1	CB2	23.1°	90.0°
OR6	CR1	CR2	H65	158.2°	90.0°
CR1	OR6	CR4	H67	118.6°	90.0°
OP5	P1	OP2	OP3	110.1°	90.0°
OP5	P1	OP3	CPR2	178.4°	90.0°
OP2	P1	OP3	CPR2	66.6°	90.0°
P1	OP2	CR3	H66	1.9°	90.0°
OP2	P1	OP5	H84	129.1°	90.0°
P1	OP3	CPR2	CPR3	114.9°	90.0°
P1	OP3	CPR2	CPR1	125.1°	90.0°
OP3	P1	OP5	H84	121.7°	90.0°
P1	OP3	CPR2	H95	7.2°	90.0°
C50	C49	C48	H48	180.0°	90.0°
C49	C50	O51	N52	178.5°	90.0°
C50	C49	C48	C13	8.2°	90.0°
C50	C49	C48	H47	171.8°	90.0°
C49	C50	N52	H79	178.5°	90.0°
C49	C50	N52	H80	1.5°	90.0°
C48	C49	C50	O51	78.0°	90.0°
C48	C49	C50	N52	103.4°	90.0°
C49	C48	C13	H47	180.0°	90.0°
C49	C48	C13	C12	98.3°	90.0°
C49	C48	C13	C14	145.5°	90.0°
C49	C48	C13	H11	25.9°	90.0°
CR2	CR1	NB1	H64	122.2°	90.0°
CR1	CR2	OR7	H65	123.4°	90.0°
CR2	CR1	NB1	CB8	88.8°	90.0°
CR2	CR1	NB1	CB2	87.5°	90.0°
CR1	CR2	CR3	H66	83.4°	90.0°
CR1	CR2	OR7	H85	68.9°	90.0°
NB1	CR1	CR2	OR7	38.3°	90.0°
CR1	NB1	CB8	CB7	2.9°	90.0°
CR1	NB1	CB8	CB2	177.0°	90.0°
CR1	NB1	CB8	CB9	177.1°	90.0°
CR1	NB1	CB2	NB3	177.1°	90.0°
CR1	NB1	CB2	H3	2.9°	90.0°
NB1	CR1	CR2	H65	86.4°	90.0°
O44	C43	C42	C41	22.4°	90.0°
O44	C43	C42	H39	141.8°	90.0°
O44	C43	C42	H40	97.0°	90.0°
O44	C43	N45	H77	0.0°	90.0°
O44	C43	N45	H78	180.0°	90.0°
C43	C42	C41	H39	119.4°	90.0°
C43	C42	C41	H40	119.4°	90.0°
C43	C42	C41	C8	175.6°	90.0°
C43	C42	C41	H37	63.6°	90.0°
C43	C42	C41	H38	54.8°	90.0°
C43	C42	H39	H40	121.8°	90.0°
C42	C43	N45	H77	178.8°	90.0°
C42	C43	N45	H78	1.2°	90.0°
CPR3	CPR2	OP3	CPR1	120.0°	90.0°
CPR3	CPR2	OP3	H95	122.0°	90.0°
CPR3	CPR2	CPR1	H95	120.9°	90.0°
CPR3	CPR2	CPR1	N59	162.4°	90.0°
CPR3	CPR2	CPR1	H93	41.7°	90.0°
CPR3	CPR2	CPR1	H94	76.9°	90.0°
CPR2	CPR3	H96	H97	120.0°	90.0°
CPR2	CPR3	H96	H98	120.0°	90.0°
CPR2	CPR3	H97	H98	120.0°	90.0°
CB11	CB6	CB7	CB5	178.0°	90.0°
CB11	CB6	CB7	CB8	179.2°	90.0°
CB11	CB6	CB5	CB10	1.8°	90.0°
CB11	CB6	CB5	CB4	179.0°	90.0°
CB11	CB6	CB7	H63	0.8°	90.0°
CB6	CB11	H90	H91	120.0°	90.0°
CB6	CB11	H90	H92	120.0°	90.0°
CB6	CB11	H91	H92	120.0°	90.0°
O51	C50	C49	H48	102.0°	90.0°
O51	C50	N52	H79	0.0°	90.0°
O51	C50	N52	H80	180.0°	90.0°
N52	C50	C49	H48	76.6°	90.0°
C50	N52	H79	H80	180.0°	90.0°
OR7	CR2	CR1	H64	161.2°	90.0°
OR7	CR2	CR3	H66	163.1°	90.0°
CB6	CB7	CB8	H63	180.0°	90.0°
CB6	CB7	CB8	NB1	179.8°	90.0°
CB6	CB7	CB8	CB9	0.3°	90.0°
CB7	CB6	CB5	CB10	179.8°	90.0°
CB7	CB6	CB5	CB4	1.0°	90.0°
CB7	CB6	CB11	H90	89.1°	90.0°
CB7	CB6	CB11	H91	150.9°	90.0°
CB7	CB6	CB11	H92	30.9°	90.0°
CB8	CB7	CB6	CB5	1.2°	90.0°
CB7	CB8	NB1	CB9	179.9°	90.0°
CB7	CB8	NB1	CB2	179.9°	90.0°
CB7	CB8	CB9	CB4	0.7°	90.0°
CB7	CB8	CB9	NB3	179.9°	90.0°
OP3	CPR2	CPR1	H95	118.2°	90.0°
OP3	CPR2	CPR1	N59	41.5°	90.0°
OP3	CPR2	CPR1	H93	79.2°	90.0°
OP3	CPR2	CPR1	H94	162.2°	90.0°
OP3	CPR2	CPR3	H96	180.0°	90.0°
OP3	CPR2	CPR3	H97	60.0°	90.0°
OP3	CPR2	CPR3	H98	60.0°	90.0°
CPR2	CPR1	N59	H93	120.7°	90.0°
CPR2	CPR1	N59	H94	120.7°	90.0°
CPR2	CPR1	N59	C57	112.0°	90.0°
CPR2	CPR1	N59	H81	68.1°	90.0°
CPR2	CPR1	H93	H94	117.9°	90.0°
CPR1	CPR2	CPR3	H96	63.2°	90.0°
CPR1	CPR2	CPR3	H97	56.8°	90.0°
CPR1	CPR2	CPR3	H98	176.8°	90.0°
C47	C12	C13	C48	30.6°	90.0°
C47	C12	C13	C11	127.2°	90.0°
C47	C12	C13	C46	124.0°	90.0°
C47	C12	C11	C46	121.8°	90.0°
C47	C12	C13	C14	150.6°	90.0°
C47	C12	C11	C10	28.7°	90.0°
C47	C12	C11	N23	159.4°	90.0°
C47	C12	C13	H11	93.7°	90.0°
C47	C12	C46	H41	180.0°	90.0°
C47	C12	C46	H42	60.0°	90.0°
C47	C12	C46	H43	60.0°	90.0°
C12	C47	H44	H45	120.0°	90.0°
C12	C47	H44	H46	120.0°	90.0°
C12	C47	H45	H46	120.0°	90.0°
C42	C41	C8	H37	120.8°	90.0°
C42	C41	C8	H38	120.8°	90.0°
C42	C41	C8	C9	53.4°	90.0°
C42	C41	C8	C7	167.7°	90.0°
C42	C41	H37	H38	117.5°	90.0°
C41	C42	H39	H40	121.8°	90.0°
C42	C41	C8	H61	68.3°	90.0°
C48	C13	C12	C14	120.0°	90.0°
C48	C13	C12	H11	124.3°	90.0°
C48	C13	C12	C11	96.5°	90.0°
C48	C13	C12	C46	154.7°	90.0°
C48	C13	C14	H11	119.6°	90.0°
C48	C13	C14	N23	115.0°	90.0°
C48	C13	C14	C15	73.4°	90.0°
C13	C48	C49	H48	171.8°	90.0°
CB6	CB5	CB10	CB4	179.2°	90.0°
CB6	CB5	CB4	CB9	0.1°	90.0°
CB6	CB5	CB4	H62	180.0°	90.0°
CB5	CB6	CB7	H63	178.8°	90.0°
CB6	CB5	CB10	H87	90.4°	90.0°
CB6	CB5	CB10	H88	149.6°	90.0°
CB6	CB5	CB10	H89	29.6°	90.0°
CB5	CB6	CB11	H90	89.0°	90.0°
CB5	CB6	CB11	H91	31.0°	90.0°
CB5	CB6	CB11	H92	151.0°	90.0°
CB8	NB1	CB2	NB3	0.3°	90.0°
NB1	CB8	CB9	CB4	179.2°	90.0°
NB1	CB8	CB9	NB3	0.2°	90.0°
CB8	NB1	CB2	H3	179.7°	90.0°
NB1	CB8	CB7	H63	0.2°	90.0°
CB8	NB1	CR1	H64	33.4°	90.0°
CB2	NB1	CB8	CB9	0.0°	90.0°
NB1	CB2	NB3	H3	180.0°	90.0°
NB1	CB2	NB3	CB9	0.4°	90.0°
NB1	CB2	NB3	CO1	178.8°	90.0°
CB2	NB1	CR1	H64	150.3°	90.0°
CB8	CB9	NB3	CB2	0.3°	90.0°
CB8	CB9	CB4	CB5	0.9°	90.0°
CB8	CB9	CB4	NB3	179.3°	90.0°
CB8	CB9	NB3	CO1	178.8°	90.0°
CB8	CB9	CB4	H62	179.2°	90.0°
CB9	CB8	CB7	H63	179.7°	90.0°
CPR1	N59	C57	O58	1.4°	90.0°
CPR1	N59	C57	H81	180.0°	90.0°
CPR1	N59	C57	C56	177.3°	90.0°
N59	CPR1	H93	H94	117.9°	90.0°
N59	CPR1	CPR2	H95	76.7°	90.0°
C13	C12	C11	C46	110.9°	90.0°
C12	C13	C14	H11	115.5°	90.0°
C13	C12	C11	C10	156.0°	90.0°
C13	C12	C11	N23	32.0°	90.0°
C12	C13	C14	N23	10.0°	90.0°
C12	C13	C14	C15	161.6°	90.0°
C13	C12	C46	H41	51.8°	90.0°
C13	C12	C46	H42	68.2°	90.0°
C13	C12	C46	H43	171.8°	90.0°
C13	C12	C47	H44	180.0°	90.0°
C13	C12	C47	H45	60.0°	90.0°
C13	C12	C47	H46	60.0°	90.0°
C12	C13	C48	H47	81.7°	90.0°
C11	C12	C13	C14	23.4°	90.0°
C12	C11	C10	N23	170.7°	90.0°
C12	C11	C10	C9	158.6°	90.0°
C12	C11	N23	C14	27.5°	90.0°
C12	C11	N23	CO1	174.0°	90.0°
C12	C11	C10	H9	21.4°	90.0°
C11	C12	C13	H11	139.2°	90.0°
C11	C12	C46	H41	53.8°	90.0°
C11	C12	C46	H42	173.8°	90.0°
C11	C12	C46	H43	66.2°	90.0°
C11	C12	C47	H44	61.5°	90.0°
C11	C12	C47	H45	178.5°	90.0°
C11	C12	C47	H46	58.5°	90.0°
C46	C12	C13	C14	85.4°	90.0°
C46	C12	C11	C10	93.1°	90.0°
C46	C12	C11	N23	78.8°	90.0°
C46	C12	C13	H11	30.4°	90.0°
C12	C46	H41	H42	120.0°	90.0°
C12	C46	H41	H43	120.0°	90.0°
C12	C46	H42	H43	120.0°	90.0°
C46	C12	C47	H44	57.5°	90.0°
C46	C12	C47	H45	62.5°	90.0°
C46	C12	C47	H46	177.4°	90.0°
CB2	NB3	CB9	CB4	179.0°	90.0°
CB2	NB3	CB9	CO1	179.1°	90.0°
CB2	NB3	CO1	N23	42.1°	90.0°
CB2	NB3	CO1	N22	139.8°	90.0°
CB2	NB3	CO1	N24	46.6°	90.0°
CB2	NB3	CO1	N21	131.7°	90.0°
CB2	NB3	CO1	C1L	136.8°	90.0°
C13	C14	N23	C11	10.2°	90.0°
C13	C14	N23	C15	171.1°	90.0°
C13	C14	N23	CO1	168.0°	90.0°
C13	C14	C15	C53	23.2°	90.0°
C13	C14	C15	C16	179.1°	90.0°
C14	C13	C48	H47	34.5°	90.0°
CB10	CB5	CB4	CB9	179.1°	90.0°
CB10	CB5	CB4	H62	0.8°	90.0°
CB5	CB10	H87	H88	120.0°	90.0°
CB5	CB10	H87	H89	120.0°	90.0°
CB5	CB10	H88	H89	119.9°	90.0°
CB5	CB4	CB9	H62	180.0°	90.0°
CB5	CB4	CB9	NB3	179.9°	90.0°
CB4	CB5	CB10	H87	90.4°	90.0°
CB4	CB5	CB10	H88	29.6°	90.0°
CB4	CB5	CB10	H89	149.6°	90.0°
C41	C8	C9	C10	87.7°	90.0°
C41	C8	C9	C7	122.3°	90.0°
C41	C8	C9	H61	121.5°	90.0°
C41	C8	C7	H61	124.1°	90.0°
C41	C8	C9	N22	95.6°	90.0°
C41	C8	C7	C36	39.1°	90.0°
C41	C8	C7	C6	89.7°	90.0°
C41	C8	C7	C37	159.1°	90.0°
C8	C41	H37	H38	117.5°	90.0°
C8	C41	C42	H39	56.2°	90.0°
C8	C41	C42	H40	65.0°	90.0°
CB4	CB9	NB3	CO1	1.9°	90.0°
CB9	NB3	CO1	N23	136.8°	90.0°
CB9	NB3	CO1	N22	39.1°	90.0°
CB9	NB3	CO1	N24	134.5°	90.0°
CB9	NB3	CO1	N21	49.4°	90.0°
CB9	NB3	CO1	C1L	42.1°	90.0°
CB9	NB3	CB2	H3	179.6°	90.0°
NB3	CB9	CB4	H62	0.1°	90.0°
C11	C10	C9	H9	180.0°	90.0°
C11	C10	C9	C8	166.5°	90.0°
C10	C11	N23	C14	160.7°	90.0°
C11	C10	C9	N22	9.7°	90.0°
C10	C11	N23	CO1	2.2°	90.0°
C9	C10	C11	N23	12.1°	90.0°
C10	C9	C8	N22	176.7°	90.0°
C10	C9	C8	C7	150.0°	90.0°
C10	C9	N22	CO1	6.3°	90.0°
C10	C9	N22	C6	166.0°	90.0°
C10	C9	C8	H61	33.8°	90.0°
C11	N23	CO1	NB3	75.6°	90.0°
C11	N23	C14	CO1	157.9°	90.0°
C11	N23	C14	C15	178.8°	90.0°
C11	N23	CO1	N22	13.1°	90.0°
C11	N23	CO1	N24	170.4°	90.0°
C11	N23	CO1	N21	159.8°	90.0°
C11	N23	CO1	C1L	97.9°	90.0°
N23	C11	C10	H9	167.9°	90.0°
O58	C57	N59	C56	175.8°	90.0°
O58	C57	C56	C55	57.7°	90.0°
O58	C57	C56	H57	61.7°	90.0°
O58	C57	C56	H58	177.1°	90.0°
O58	C57	N59	H81	178.5°	90.0°
N59	C57	C56	C55	118.3°	90.0°
N59	C57	C56	H57	122.3°	90.0°
N59	C57	C56	H58	1.1°	90.0°
C57	N59	CPR1	H93	127.3°	90.0°
C57	N59	CPR1	H94	8.7°	90.0°
NB3	CO1	N23	C14	79.6°	90.0°
NB3	CO1	N22	C9	72.4°	90.0°
NB3	CO1	N23	N22	88.8°	90.0°
NB3	CO1	N23	N24	94.8°	90.0°
NB3	CO1	N23	N21	124.5°	90.0°
NB3	CO1	N23	C1L	173.6°	90.0°
NB3	CO1	N22	N24	121.4°	90.0°
NB3	CO1	N22	N21	96.8°	90.0°
NB3	CO1	N22	C1L	179.7°	90.0°
NB3	CO1	N22	C6	116.8°	90.0°
NB3	CO1	N24	N21	96.4°	90.0°
NB3	CO1	N24	C1L	179.6°	90.0°
NB3	CO1	N21	C1L	173.5°	90.0°
NB3	CO1	N24	C16	82.9°	90.0°
NB3	CO1	N24	C19	109.6°	90.0°
NB3	CO1	N21	C1	79.8°	90.0°
NB3	CO1	N21	C4	117.6°	90.0°
NB3	CO1	C1L	C2L	29.9°	90.0°
CO1	NB3	CB2	H3	1.2°	90.0°
C57	C56	C55	H57	119.4°	90.0°
C57	C56	C55	H58	119.4°	90.0°
C57	C56	C55	C17	154.5°	90.0°
C57	C56	C55	H55	84.8°	90.0°
C57	C56	C55	H56	33.8°	90.0°
C57	C56	H57	H58	121.8°	90.0°
C56	C57	N59	H81	2.7°	90.0°
C9	C8	C7	H61	116.3°	90.0°
C8	C9	N22	CO1	177.1°	90.0°
C8	C9	N22	C6	10.6°	90.0°
C9	C8	C7	C36	158.7°	90.0°
C9	C8	C7	C6	30.0°	90.0°
C9	C8	C7	C37	81.3°	90.0°
C8	C9	C10	H9	13.5°	90.0°
C9	C8	C41	H37	174.2°	90.0°
C9	C8	C41	H38	67.4°	90.0°
C7	C8	C9	N22	26.7°	90.0°
C8	C7	C6	N22	26.1°	90.0°
C8	C7	C36	C6	115.4°	90.0°
C8	C7	C36	C37	120.0°	90.0°
C8	C7	C6	C37	114.0°	90.0°
C8	C7	C37	C38	67.7°	90.0°
C8	C7	C6	C5	167.9°	90.0°
C8	C7	C36	H32	180.0°	90.0°
C8	C7	C36	H33	60.0°	90.0°
C8	C7	C36	H34	60.0°	90.0°
C8	C7	C37	H35	172.0°	90.0°
C8	C7	C37	H36	52.6°	90.0°
C7	C8	C41	H37	71.6°	90.0°
C7	C8	C41	H38	46.8°	90.0°
N23	C14	C15	C53	146.6°	90.0°
N23	C14	C15	C16	9.3°	90.0°
C14	N23	CO1	N22	168.3°	90.0°
C14	N23	CO1	N24	15.2°	90.0°
C14	N23	CO1	N21	45.0°	90.0°
C14	N23	CO1	C1L	106.9°	90.0°
N23	C14	C13	H11	125.5°	90.0°
C15	C14	N23	CO1	20.9°	90.0°
C14	C15	C53	C16	156.2°	90.0°
C14	C15	C16	N24	3.6°	90.0°
C14	C15	C16	C17	175.8°	90.0°
C15	C14	C13	H11	46.1°	90.0°
C14	C15	C53	H49	180.0°	90.0°
C14	C15	C53	H50	60.0°	90.0°
C14	C15	C53	H51	60.0°	90.0°
C9	N22	CO1	N23	14.9°	90.0°
C9	N22	CO1	C6	170.8°	90.0°
C9	N22	C6	C7	10.6°	90.0°
C9	N22	CO1	N24	166.2°	90.0°
C9	N22	CO1	N21	169.2°	90.0°
C9	N22	CO1	C1L	107.2°	90.0°
C9	N22	C6	C5	177.6°	90.0°
N22	C9	C10	H9	170.3°	90.0°
N22	C9	C8	H61	142.9°	90.0°
N23	CO1	N22	N24	151.3°	90.0°
N23	CO1	N22	N21	175.9°	90.0°
N23	CO1	N22	C1L	92.3°	90.0°
N23	CO1	N22	C6	155.9°	90.0°
N23	CO1	N24	N21	176.3°	90.0°
N23	CO1	N24	C1L	93.0°	90.0°
N23	CO1	N21	C1L	62.5°	90.0°
N23	CO1	N24	C16	4.5°	90.0°
N23	CO1	N24	C19	163.0°	90.0°
N23	CO1	N21	C1	44.3°	90.0°
N23	CO1	N21	C4	118.4°	90.0°
N23	CO1	C1L	C2L	124.3°	90.0°
C53	C15	C16	N24	159.1°	90.0°
C53	C15	C16	C17	20.4°	90.0°
C15	C53	H49	H50	120.0°	90.0°
C15	C53	H49	H51	120.0°	90.0°
C15	C53	H50	H51	120.0°	90.0°
C56	C55	C17	C16	43.6°	90.0°
C56	C55	C17	H55	120.7°	90.0°
C56	C55	C17	H56	120.7°	90.0°
C56	C55	C17	C18	65.8°	90.0°
C56	C55	C17	C54	173.9°	90.0°
C56	C55	H55	H56	117.8°	90.0°
C55	C56	H57	H58	121.8°	90.0°
C15	C16	N24	CO1	4.0°	90.0°
C15	C16	N24	C17	179.5°	90.0°
C15	C16	C17	C55	47.6°	90.0°
C15	C16	N24	C19	171.8°	90.0°
C15	C16	C17	C18	162.3°	90.0°
C15	C16	C17	C54	81.2°	90.0°
C16	C15	C53	H49	23.8°	90.0°
C16	C15	C53	H50	143.7°	90.0°
C16	C15	C53	H51	96.2°	90.0°
O39	C38	C37	C7	74.0°	90.0°
O39	C38	C37	N40	177.6°	90.0°
O39	C38	C37	H35	165.7°	90.0°
O39	C38	C37	H36	46.3°	90.0°
O39	C38	N40	H75	0.0°	90.0°
O39	C38	N40	H76	180.0°	90.0°
CO1	N22	C6	C7	161.0°	90.0°
N22	CO1	N24	N21	24.7°	90.0°
N22	CO1	N24	C1L	58.5°	90.0°
N22	CO1	N21	C1L	84.5°	90.0°
N22	CO1	N24	C16	156.0°	90.0°
CO1	N22	C6	C5	6.0°	90.0°
N22	CO1	N24	C19	11.5°	90.0°
N22	CO1	N21	C1	168.7°	90.0°
N22	CO1	N21	C4	28.6°	90.0°
N22	CO1	C1L	C2L	26.9°	90.0°
N22	C6	C7	C36	145.8°	90.0°
N22	C6	C7	C5	165.9°	90.0°
N22	C6	C7	C37	87.9°	90.0°
C6	N22	CO1	N24	4.6°	90.0°
C6	N22	CO1	N21	20.0°	90.0°
C6	N22	CO1	C1L	63.5°	90.0°
N22	C6	C5	C4	9.3°	90.0°
N22	C6	C5	C35	172.1°	90.0°
C36	C7	C6	C37	126.3°	90.0°
C36	C7	C37	C38	51.8°	90.0°
C36	C7	C6	C5	48.3°	90.0°
C7	C36	H32	H33	120.0°	90.0°
C7	C36	H32	H34	120.0°	90.0°
C7	C36	H33	H34	120.0°	90.0°
C36	C7	C37	H35	68.6°	90.0°
C36	C7	C37	H36	172.0°	90.0°
C36	C7	C8	H61	85.0°	90.0°
C6	C7	C37	C38	174.9°	90.0°
C7	C6	C5	C4	173.6°	90.0°
C7	C6	C5	C35	7.9°	90.0°
C6	C7	C36	H32	64.6°	90.0°
C6	C7	C36	H33	175.4°	90.0°
C6	C7	C36	H34	55.4°	90.0°
C6	C7	C37	H35	64.7°	90.0°
C6	C7	C37	H36	54.7°	90.0°
C6	C7	C8	H61	146.3°	90.0°
C7	C37	C38	H35	120.3°	90.0°
C7	C37	C38	H36	120.3°	90.0°
C7	C37	C38	N40	108.4°	90.0°
C37	C7	C6	C5	78.0°	90.0°
C37	C7	C36	H32	60.0°	90.0°
C37	C7	C36	H33	60.0°	90.0°
C37	C7	C36	H34	180.0°	90.0°
C7	C37	H35	H36	119.1°	90.0°
C37	C7	C8	H61	35.1°	90.0°
N24	CO1	N21	C1L	92.3°	90.0°
CO1	N24	C16	C19	167.8°	90.0°
CO1	N24	C16	C17	175.5°	90.0°
N24	CO1	N21	C1	14.4°	90.0°
N24	CO1	N21	C4	148.2°	90.0°
N24	CO1	C1L	C2L	146.7°	90.0°
CO1	N24	C19	C18	158.8°	90.0°
CO1	N24	C19	C1	35.1°	90.0°
CO1	N24	C19	H16	84.2°	90.0°
N21	CO1	N24	C16	179.3°	90.0°
N21	CO1	N24	C19	13.2°	90.0°
CO1	N21	C1	C20	78.3°	90.0°
CO1	N21	C1	C4	165.4°	90.0°
N21	CO1	C1L	C2L	62.3°	90.0°
CO1	N21	C4	C5	23.3°	90.0°
CO1	N21	C1	C19	36.1°	90.0°
CO1	N21	C1	C2	159.9°	90.0°
CO1	N21	C4	C3	175.7°	90.0°
C1L	CO1	N24	C16	97.5°	90.0°
C1L	CO1	N24	C19	70.0°	90.0°
C1L	CO1	N21	C1	106.7°	90.0°
C1L	CO1	N21	C4	55.9°	90.0°
CO1	C1L	C2L	C01	14.8°	90.0°
N24	C16	C17	C55	133.0°	90.0°
N24	C16	C17	C18	18.2°	90.0°
N24	C16	C17	C54	98.3°	90.0°
C16	N24	C19	C18	30.5°	90.0°
C16	N24	C19	C1	154.2°	90.0°
C16	N24	C19	H16	86.4°	90.0°
C16	C17	C55	C18	109.4°	90.0°
C16	C17	C55	C54	130.3°	90.0°
C17	C16	N24	C19	7.7°	90.0°
C16	C17	C18	C54	117.6°	90.0°
C16	C17	C18	C19	35.6°	90.0°
C16	C17	C18	C60	164.8°	90.0°
C16	C17	C18	H15	76.5°	90.0°
C16	C17	C54	H52	180.0°	90.0°
C16	C17	C54	H53	60.0°	90.0°
C16	C17	C54	H54	60.0°	90.0°
C16	C17	C55	H55	164.4°	90.0°
C16	C17	C55	H56	77.1°	90.0°
C38	C37	H35	H36	119.0°	90.0°
C37	C38	N40	H75	177.6°	90.0°
C37	C38	N40	H76	2.4°	90.0°
N40	C38	C37	H35	11.9°	90.0°
N40	C38	C37	H36	131.3°	90.0°
C38	N40	H75	H76	180.0°	90.0°
C6	C5	C4	N21	1.6°	90.0°
C6	C5	C4	C35	178.7°	90.0°
C6	C5	C4	C3	148.8°	90.0°
C6	C5	C35	H29	180.0°	90.0°
C6	C5	C35	H30	60.0°	90.0°
C6	C5	C35	H31	60.0°	90.0°
C55	C17	C18	C54	119.0°	90.0°
C55	C17	C18	C19	159.0°	90.0°
C55	C17	C18	C60	71.9°	90.0°
C55	C17	C18	H15	46.9°	90.0°
C55	C17	C54	H52	46.4°	90.0°
C55	C17	C54	H53	73.6°	90.0°
C55	C17	C54	H54	166.4°	90.0°
C17	C55	H55	H56	117.8°	90.0°
C17	C55	C56	H57	35.1°	90.0°
C17	C55	C56	H58	86.1°	90.0°
N24	C19	C1	C20	75.4°	90.0°
N24	C19	C18	C17	40.9°	90.0°
N24	C19	C1	N21	42.9°	90.0°
N24	C19	C18	C1	113.4°	90.0°
N24	C19	C18	H16	117.5°	90.0°
N24	C19	C18	C60	170.3°	90.0°
N24	C19	C1	H16	120.1°	90.0°
N24	C19	C1	C2	150.8°	90.0°
N24	C19	C18	H15	71.1°	90.0°
C20	C1	N21	C19	114.3°	90.0°
C20	C1	N21	C2	121.8°	90.0°
C20	C1	N21	C4	116.3°	90.0°
C20	C1	C19	C18	35.3°	90.0°
C20	C1	C19	C2	133.8°	90.0°
C20	C1	C2	C3	89.8°	90.0°
C20	C1	C2	C25	33.8°	90.0°
C20	C1	C2	C26	161.5°	90.0°
C20	C1	C19	H16	164.5°	90.0°
C1	C20	H17	H18	120.0°	90.0°
C1	C20	H17	H19	120.0°	90.0°
C1	C20	H18	H19	120.0°	90.0°
C17	C18	C19	C60	129.4°	90.0°
C17	C18	C19	H15	112.0°	90.0°
C17	C18	C60	H15	118.7°	90.0°
C17	C18	C19	C1	154.3°	90.0°
C17	C18	C60	C61	116.3°	90.0°
C17	C18	C19	H16	76.6°	90.0°
C18	C17	C54	H52	71.7°	90.0°
C18	C17	C54	H53	168.3°	90.0°
C18	C17	C54	H54	48.3°	90.0°
C18	C17	C55	H55	55.0°	90.0°
C18	C17	C55	H56	173.5°	90.0°
C17	C18	C60	H59	4.7°	90.0°
C17	C18	C60	H60	122.7°	90.0°
C54	C17	C18	C19	82.0°	90.0°
C54	C17	C18	C60	47.1°	90.0°
C54	C17	C18	H15	165.9°	90.0°
C17	C54	H52	H53	120.0°	90.0°
C17	C54	H52	H54	120.0°	90.0°
C17	C54	H53	H54	120.0°	90.0°
C54	C17	C55	H55	65.3°	90.0°
C54	C17	C55	H56	53.2°	90.0°
C1	N21	C4	C5	173.9°	90.0°
N21	C1	C19	C18	153.6°	90.0°
N21	C1	C19	C2	107.9°	90.0°
C1	N21	C4	C3	21.5°	90.0°
N21	C1	C2	C3	29.1°	90.0°
N21	C1	C2	C25	152.7°	90.0°
N21	C1	C2	C26	79.6°	90.0°
N21	C1	C19	H16	77.2°	90.0°
N21	C1	C20	H17	180.0°	90.0°
N21	C1	C20	H18	60.0°	90.0°
N21	C1	C20	H19	60.0°	90.0°
N21	C4	C5	C3	150.4°	90.0°
N21	C4	C5	C35	179.7°	90.0°
C4	N21	C1	C19	129.4°	90.0°
C4	N21	C1	C2	5.5°	90.0°
N21	C4	C3	C30	88.1°	90.0°
N21	C4	C3	C2	37.7°	90.0°
N21	C4	C3	H2	149.6°	90.0°
C1L	C2L	C01	N01	74.8°	90.0°
C1L	C2L	C01	O01	102.1°	90.0°
O33	C32	C31	C30	50.1°	90.0°
O33	C32	N34	C31	179.7°	90.0°
O33	C32	C31	H27	171.5°	90.0°
O33	C32	C31	H28	71.2°	90.0°
O33	C32	N34	H73	0.0°	90.0°
O33	C32	N34	H74	180.0°	90.0°
O62	C61	C60	C18	7.3°	90.0°
O62	C61	C60	N63	178.5°	90.0°
O62	C61	C60	H59	113.7°	90.0°
O62	C61	C60	H60	128.3°	90.0°
O62	C61	N63	H82	0.0°	90.0°
O62	C61	N63	H83	180.0°	90.0°
C5	C4	C3	C30	65.9°	90.0°
C5	C4	C3	C2	168.3°	90.0°
C5	C4	C3	H2	56.4°	90.0°
C4	C5	C35	H29	1.4°	90.0°
C4	C5	C35	H30	121.4°	90.0°
C4	C5	C35	H31	118.7°	90.0°
C35	C5	C4	C3	29.9°	90.0°
C5	C35	H29	H30	120.0°	90.0°
C5	C35	H29	H31	120.0°	90.0°
C5	C35	H30	H31	120.0°	90.0°
C19	C18	C60	H15	118.8°	90.0°
C18	C19	C1	H16	129.2°	90.0°
C18	C19	C1	C2	98.5°	90.0°
C19	C18	C60	C61	121.2°	90.0°
C19	C18	C60	H59	117.8°	90.0°
C19	C18	C60	H60	0.2°	90.0°
C60	C18	C19	C1	76.3°	90.0°
C18	C60	C61	H59	121.0°	90.0°
C18	C60	C61	H60	121.0°	90.0°
C18	C60	C61	N63	171.2°	90.0°
C60	C18	C19	H16	52.7°	90.0°
C18	C60	H59	H60	116.8°	90.0°
C19	C1	C2	C3	140.5°	90.0°
C19	C1	C2	C25	95.8°	90.0°
C19	C1	C2	C26	31.9°	90.0°
C1	C19	C18	H15	42.4°	90.0°
C19	C1	C20	H17	66.9°	90.0°
C19	C1	C20	H18	173.1°	90.0°
C19	C1	C20	H19	53.1°	90.0°
C1	C2	C3	C4	39.1°	90.0°
C1	C2	C3	C30	84.2°	90.0°
C1	C2	C3	C25	122.2°	90.0°
C1	C2	C3	C26	115.9°	90.0°
C1	C2	C25	C26	126.5°	90.0°
C1	C2	C26	C27	171.7°	90.0°
C1	C2	C3	H2	151.4°	90.0°
C2	C1	C19	H16	30.7°	90.0°
C2	C1	C20	H17	69.2°	90.0°
C2	C1	C20	H18	50.7°	90.0°
C2	C1	C20	H19	170.8°	90.0°
C1	C2	C25	H20	180.0°	90.0°
C1	C2	C25	H21	60.0°	90.0°
C1	C2	C25	H22	60.0°	90.0°
C1	C2	C26	H23	67.2°	90.0°
C1	C2	C26	H24	50.5°	90.0°
C02	C03	C04	H5	109.5°	90.0°
C02	C03	C04	H6	109.5°	90.0°
C03	C02	C04	N01	104.6°	90.0°
C03	C02	C04	H4	107.8°	90.0°
C03	C02	N01	H4	145.9°	90.0°
C03	C02	N01	C01	138.0°	90.0°
C02	C03	H5	H6	144.6°	90.0°
C02	C03	C04	H7	109.4°	90.0°
C02	C03	C04	H8	109.4°	90.0°
C03	C02	N01	H70	42.1°	90.0°
C04	C03	H5	H6	144.7°	90.0°
C03	C04	H7	H8	144.9°	90.0°
C4	C3	C30	C2	112.7°	90.0°
C4	C3	C30	H2	122.7°	90.0°
C4	C3	C30	C31	151.8°	90.0°
C4	C3	C2	H2	112.2°	90.0°
C4	C3	C2	C25	161.3°	90.0°
C4	C3	C2	C26	76.8°	90.0°
C4	C3	C30	H25	31.6°	90.0°
C4	C3	C30	H26	87.9°	90.0°
C3	C30	C31	H25	120.3°	90.0°
C3	C30	C31	H26	120.3°	90.0°
C3	C30	C31	C32	173.7°	90.0°
C30	C3	C2	H2	124.4°	90.0°
C30	C3	C2	C25	38.0°	90.0°
C30	C3	C2	C26	159.9°	90.0°
C3	C30	H25	H26	119.3°	90.0°
C3	C30	C31	H27	65.0°	90.0°
C3	C30	C31	H28	52.3°	90.0°
C30	C31	C32	N34	130.2°	90.0°
C30	C31	C32	H27	121.4°	90.0°
C30	C31	C32	H28	121.3°	90.0°
C31	C30	C3	C2	95.4°	90.0°
C31	C30	C3	H2	29.1°	90.0°
C31	C30	H25	H26	119.3°	90.0°
C30	C31	H27	H28	115.7°	90.0°
C04	C02	N01	H4	147.2°	90.0°
C04	C02	N01	C01	155.1°	90.0°
C02	C04	H7	H8	144.9°	90.0°
C04	C02	N01	H70	24.9°	90.0°
C02	N01	C01	C2L	2.4°	90.0°
C02	N01	C01	H70	180.0°	90.0°
C02	N01	C01	O01	179.1°	90.0°
N01	C02	C03	H5	144.2°	90.0°
N01	C02	C03	H6	3.3°	90.0°
N01	C02	C04	H7	146.0°	90.0°
N01	C02	C04	H8	4.7°	90.0°
N34	C32	C31	H27	8.8°	90.0°
N34	C32	C31	H28	108.5°	90.0°
C32	N34	H73	H74	180.0°	90.0°
C32	C31	C30	H25	53.4°	90.0°
C32	C31	C30	H26	66.1°	90.0°
C32	C31	H27	H28	115.7°	90.0°
C31	C32	N34	H73	179.7°	90.0°
C31	C32	N34	H74	0.3°	90.0°
C2L	C01	N01	O01	176.6°	90.0°
C2L	C01	N01	H70	177.6°	90.0°
C61	C60	C18	H15	2.5°	90.0°
C61	C60	H59	H60	116.9°	90.0°
C60	C61	N63	H82	178.6°	90.0°
C60	C61	N63	H83	1.5°	90.0°
N63	C61	C60	H59	67.9°	90.0°
N63	C61	C60	H60	50.2°	90.0°
C61	N63	H82	H83	180.0°	90.0°
C3	C2	C25	C26	114.7°	90.0°
C3	C2	C26	C27	60.3°	90.0°
C3	C2	C25	H20	61.3°	90.0°
C3	C2	C25	H21	58.7°	90.0°
C3	C2	C25	H22	178.7°	90.0°
C3	C2	C26	H23	178.6°	90.0°
C3	C2	C26	H24	60.9°	90.0°
C2	C3	C30	H25	144.4°	90.0°
C2	C3	C30	H26	24.8°	90.0°
C25	C2	C26	C27	61.8°	90.0°
C25	C2	C3	H2	86.5°	90.0°
C2	C25	H20	H21	120.0°	90.0°
C2	C25	H20	H22	120.0°	90.0°
C2	C25	H21	H22	120.0°	90.0°
C25	C2	C26	H23	59.4°	90.0°
C25	C2	C26	H24	177.1°	90.0°
C2	C26	C27	H23	121.2°	90.0°
C2	C26	C27	H24	121.1°	90.0°
C2	C26	C27	N29	136.3°	90.0°
C2	C26	C27	O28	45.4°	90.0°
C26	C2	C3	H2	35.4°	90.0°
C26	C2	C25	H20	53.5°	90.0°
C26	C2	C25	H21	173.5°	90.0°
C26	C2	C25	H22	66.5°	90.0°
C2	C26	H23	H24	116.4°	90.0°
C01	N01	C02	H4	7.9°	90.0°
O01	C01	N01	H70	1.0°	90.0°
C26	C27	N29	O28	178.3°	90.0°
C27	C26	H23	H24	116.3°	90.0°
C26	C27	N29	H71	178.3°	90.0°
C26	C27	N29	H72	1.7°	90.0°
N29	C27	C26	H23	102.5°	90.0°
N29	C27	C26	H24	15.2°	90.0°
C27	N29	H71	H72	180.0°	90.0°
O28	C27	C26	H23	75.7°	90.0°
O28	C27	C26	H24	166.6°	90.0°
O28	C27	N29	H71	0.0°	90.0°
O28	C27	N29	H72	180.0°	90.0°
H2	C3	C30	H25	91.1°	90.0°
H2	C3	C30	H26	149.4°	90.0°
H4	C02	C03	H5	2.0°	90.0°
H4	C02	C03	H6	142.9°	90.0°
H4	C02	C04	H7	1.6°	90.0°
H4	C02	C04	H8	142.8°	90.0°
H4	C02	N01	H70	172.1°	90.0°
H5	C03	C04	H7	0.1°	90.0°
H5	C03	C04	H8	141.1°	90.0°
H6	C03	C04	H7	141.1°	90.0°
H6	C03	C04	H8	0.1°	90.0°
H11	C13	C48	H47	154.1°	90.0°
H15	C18	C19	H16	171.4°	90.0°
H15	C18	C60	H59	123.5°	90.0°
H15	C18	C60	H60	118.5°	90.0°
H17	C20	H18	H19	120.0°	90.0°
H20	C25	H21	H22	120.0°	90.0°
H25	C30	C31	H27	174.7°	90.0°
H25	C30	C31	H28	67.9°	90.0°
H26	C30	C31	H27	55.2°	90.0°
H26	C30	C31	H28	172.6°	90.0°
H29	C35	H30	H31	120.0°	90.0°
H32	C36	H33	H34	120.0°	90.0°
H37	C41	C42	H39	177.0°	90.0°
H37	C41	C42	H40	55.8°	90.0°
H37	C41	C8	H61	52.5°	90.0°
H38	C41	C42	H39	64.6°	90.0°
H38	C41	C42	H40	174.1°	90.0°
H38	C41	C8	H61	170.9°	90.0°
H41	C46	H42	H43	120.0°	90.0°
H44	C47	H45	H46	120.0°	90.0°
H47	C48	C49	H48	8.2°	90.0°
H49	C53	H50	H51	120.0°	90.0°
H52	C54	H53	H54	120.0°	90.0°
H55	C55	C56	H57	155.8°	90.0°
H55	C55	C56	H58	34.6°	90.0°
H56	C55	C56	H57	85.6°	90.0°
H56	C55	C56	H58	153.2°	90.0°
H64	CR1	CR2	H65	36.5°	90.0°
H65	CR2	CR3	H66	36.5°	90.0°
H65	CR2	OR7	H85	54.5°	90.0°
H66	CR3	CR4	H67	145.5°	90.0°
H67	CR4	CR5	H68	179.8°	90.0°
H67	CR4	CR5	H69	60.2°	90.0°
H68	CR5	OR8	H86	60.0°	90.0°
H69	CR5	OR8	H86	60.0°	90.0°
H81	N59	CPR1	H93	52.6°	90.0°
H81	N59	CPR1	H94	171.3°	90.0°
H87	CB10	H88	H89	120.0°	90.0°
H90	CB11	H91	H92	120.0°	90.0°
H93	CPR1	CPR2	H95	162.6°	90.0°
H94	CPR1	CPR2	H95	44.0°	90.0°
H95	CPR2	CPR3	H96	57.7°	90.0°
H95	CPR2	CPR3	H97	177.7°	90.0°
H95	CPR2	CPR3	H98	62.3°	90.0°
H96	CPR3	H97	H98	120.0°	90.0°

Release date:	2026-08-05
Definition date:	2026-07-14
Last modified:	2026-07-31
Release status:	REL
Processing site:	RCSB
Derived from:	37CM