P50

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C56	C55	sing	1.53Å	1.53Å
C55	C54	sing	1.53Å	1.54Å
C54	C53	sing	1.53Å	1.53Å
C53	C52	sing	1.53Å	1.54Å
C52	C51	sing	1.53Å	1.54Å
C51	C50	sing	1.53Å	1.55Å
C50	C49	sing	1.53Å	1.54Å
N	CA	sing	1.47Å	1.44Å
C49	C48	sing	1.51Å	1.53Å
C48	C46	doub	1.31Å	1.34Å
C	CA	sing	1.51Å	1.53Å
C	O	doub	1.21Å	1.19Å
CA	CB	sing	1.53Å	1.53Å
C46	C45	sing	1.51Å	1.56Å
O15	P12	doub	1.48Å	1.66Å
CB	OG	sing	1.43Å	1.40Å
C45	C44	sing	1.53Å	1.55Å
OG	P12	sing	1.61Å	1.66Å
P12	O16	sing	1.61Å	1.68Å
P12	O13	sing	1.61Å	1.47Å
O16	C3	sing	1.43Å	1.41Å
C44	C43	sing	1.53Å	1.56Å
C43	C42	sing	1.53Å	1.55Å
C3	C2	sing	1.53Å	1.55Å
C39	C38	sing	1.51Å	1.56Å
C39	C40	sing	1.53Å	1.55Å
O37	C2	sing	1.45Å	1.41Å
O37	C38	sing	1.34Å	1.43Å
C42	C41	sing	1.53Å	1.56Å
C2	C1	sing	1.53Å	1.54Å
C38	O47	doub	1.21Å	1.20Å
C41	C40	sing	1.53Å	1.56Å
C1	O19	sing	1.45Å	1.43Å
O19	C17	sing	1.34Å	1.43Å
C34	C33	sing	1.53Å	1.52Å
C17	O18	doub	1.21Å	1.19Å
C17	C20	sing	1.51Å	1.56Å
C20	C21	sing	1.53Å	1.54Å
C33	C32	sing	1.53Å	1.52Å
C32	C31	sing	1.53Å	1.52Å
C29	C28	sing	1.53Å	1.54Å
C29	C30	sing	1.53Å	1.54Å
C27	C28	sing	1.53Å	1.57Å
C27	C26	sing	1.53Å	1.55Å
C21	C22	sing	1.53Å	1.53Å
C30	C31	sing	1.53Å	1.53Å
C22	C23	sing	1.53Å	1.52Å
C26	C25	sing	1.53Å	1.55Å
C24	C23	sing	1.53Å	1.53Å
C24	C25	sing	1.53Å	1.53Å
C39	H1	sing	1.09Å	1.10Å
C39	H2	sing	1.09Å	1.10Å
C40	H3	sing	1.09Å	1.10Å
C40	H4	sing	1.09Å	1.10Å
C41	H5	sing	1.09Å	1.10Å
C41	H6	sing	1.09Å	1.10Å
C42	H7	sing	1.09Å	1.10Å
C42	H8	sing	1.09Å	1.10Å
C43	H9	sing	1.09Å	1.10Å
C43	H10	sing	1.09Å	1.10Å
C44	H11	sing	1.09Å	1.10Å
C44	H12	sing	1.09Å	1.10Å
C45	H13	sing	1.09Å	1.10Å
C45	H14	sing	1.09Å	1.10Å
C46	H15	sing	1.08Å	1.08Å
C48	H16	sing	1.08Å	1.08Å
C49	H17	sing	1.09Å	1.10Å
C49	H18	sing	1.09Å	1.10Å
C50	H19	sing	1.09Å	1.10Å
C50	H20	sing	1.09Å	1.10Å
C51	H21	sing	1.09Å	1.10Å
C51	H22	sing	1.09Å	1.10Å
C52	H23	sing	1.09Å	1.10Å
C52	H24	sing	1.09Å	1.10Å
C53	H25	sing	1.09Å	1.10Å
C53	H26	sing	1.09Å	1.10Å
C54	H27	sing	1.09Å	1.10Å
C54	H28	sing	1.09Å	1.10Å
C55	H29	sing	1.09Å	1.10Å
C55	H30	sing	1.09Å	1.10Å
C56	H31	sing	1.09Å	1.10Å
C56	H32	sing	1.09Å	1.10Å
C56	H33	sing	1.09Å	1.10Å
C2	H34	sing	1.09Å	1.10Å
C3	H35	sing	1.09Å	1.10Å
C3	H36	sing	1.09Å	1.10Å
O13	H37	sing	0.97Å	0.95Å
CB	H38	sing	1.09Å	1.10Å
CB	H39	sing	1.09Å	1.10Å
CA	H40	sing	1.09Å	1.10Å
N	H41	sing	1.01Å	1.00Å
N	H42	sing	1.01Å	1.00Å
C	H44	sing	1.08Å	1.08Å
C1	H45	sing	1.09Å	1.10Å
C1	H46	sing	1.09Å	1.10Å
C20	H47	sing	1.09Å	1.10Å
C20	H48	sing	1.09Å	1.10Å
C21	H49	sing	1.09Å	1.10Å
C21	H50	sing	1.09Å	1.10Å
C22	H51	sing	1.09Å	1.10Å
C22	H52	sing	1.09Å	1.10Å
C23	H53	sing	1.09Å	1.10Å
C23	H54	sing	1.09Å	1.10Å
C24	H55	sing	1.09Å	1.10Å
C24	H56	sing	1.09Å	1.10Å
C25	H57	sing	1.09Å	1.10Å
C25	H58	sing	1.09Å	1.10Å
C26	H59	sing	1.09Å	1.10Å
C26	H60	sing	1.09Å	1.10Å
C27	H61	sing	1.09Å	1.10Å
C27	H62	sing	1.09Å	1.10Å
C28	H63	sing	1.09Å	1.10Å
C28	H64	sing	1.09Å	1.10Å
C29	H65	sing	1.09Å	1.10Å
C29	H66	sing	1.09Å	1.10Å
C30	H67	sing	1.09Å	1.10Å
C30	H68	sing	1.09Å	1.10Å
C31	H69	sing	1.09Å	1.10Å
C31	H70	sing	1.09Å	1.10Å
C32	H71	sing	1.09Å	1.10Å
C32	H72	sing	1.09Å	1.10Å
C33	H73	sing	1.09Å	1.10Å
C33	H74	sing	1.09Å	1.10Å
C34	H75	sing	1.09Å	1.10Å
C34	H76	sing	1.09Å	1.10Å
C34	H77	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C56	C55	C54	111.4°	109.4°
C56	C55	H29	109.0°	109.5°
C56	C55	H30	109.0°	109.5°
C55	C56	H31	109.5°	109.5°
C55	C56	H32	109.5°	109.5°
C55	C56	H33	109.5°	109.5°
C55	C54	C53	113.3°	109.4°
C55	C54	H27	108.5°	109.5°
C55	C54	H28	108.5°	109.4°
C54	C55	H29	109.0°	109.5°
C54	C55	H30	109.0°	109.5°
C54	C53	C52	110.9°	109.5°
C54	C53	H25	109.1°	109.5°
C54	C53	H26	109.1°	109.5°
C53	C54	H27	108.5°	109.5°
C53	C54	H28	108.5°	109.5°
C53	C52	C51	108.7°	109.5°
C53	C52	H23	109.6°	109.5°
C53	C52	H24	109.6°	109.4°
C52	C53	H25	109.1°	109.5°
C52	C53	H26	109.1°	109.5°
C52	C51	C50	112.5°	109.5°
C52	C51	H21	108.7°	109.5°
C52	C51	H22	108.7°	109.4°
C51	C52	H23	109.7°	109.5°
C51	C52	H24	109.6°	109.5°
C51	C50	C49	102.4°	109.5°
C51	C50	H19	111.2°	109.5°
C51	C50	H20	111.2°	109.5°
C50	C51	H21	108.7°	109.5°
C50	C51	H22	108.7°	109.4°
C50	C49	C48	114.4°	109.5°
C50	C49	H17	108.2°	109.5°
C50	C49	H18	108.2°	109.5°
C49	C50	H19	111.2°	109.5°
C49	C50	H20	111.2°	109.4°
N	CA	C	107.4°	109.5°
N	CA	CB	105.9°	109.5°
N	CA	H40	112.4°	109.5°
CA	N	H41	109.5°	111.0°
CA	N	H42	109.5°	111.0°
C49	C48	C46	121.6°	120.0°
C49	C48	H16	119.2°	120.0°
C48	C49	H17	108.2°	109.5°
C48	C49	H18	108.2°	109.4°
C48	C46	C45	121.5°	120.0°
C48	C46	H15	119.2°	120.0°
C46	C48	H16	119.2°	120.0°
CA	C	O	121.2°	119.9°
C	CA	CB	108.8°	109.5°
C	CA	H40	111.0°	109.4°
CA	C	H44	119.4°	120.0°
O	C	H44	119.4°	120.0°
CA	CB	OG	108.6°	109.5°
CA	CB	H38	109.7°	109.5°
CA	CB	H39	109.7°	109.5°
CB	CA	H40	111.0°	109.4°
C46	C45	C44	113.4°	109.4°
C46	C45	H13	108.5°	109.5°
C46	C45	H14	108.5°	109.5°
C45	C46	H15	119.3°	120.0°
O15	P12	OG	111.2°	109.4°
O15	P12	O16	108.5°	109.4°
O15	P12	O13	109.1°	109.5°
CB	OG	P12	109.8°	123.1°
OG	CB	H38	109.7°	109.4°
OG	CB	H39	109.7°	109.5°
C45	C44	C43	105.0°	109.5°
C45	C44	H11	110.6°	109.5°
C45	C44	H12	110.6°	109.5°
C44	C45	H13	108.5°	109.5°
C44	C45	H14	108.5°	109.5°
OG	P12	O16	106.9°	109.5°
OG	P12	O13	109.0°	109.5°
O16	P12	O13	112.1°	109.5°
P12	O16	C3	112.2°	123.0°
P12	O13	H37	109.5°	114.0°
O16	C3	C2	110.2°	109.5°
O16	C3	H35	109.3°	109.5°
O16	C3	H36	109.3°	109.5°
C44	C43	C42	114.6°	109.5°
C44	C43	H9	108.2°	109.5°
C44	C43	H10	108.1°	109.5°
C43	C44	H11	110.6°	109.5°
C43	C44	H12	110.6°	109.5°
C43	C42	C41	108.0°	109.5°
C43	C42	H7	109.8°	109.4°
C43	C42	H8	109.9°	109.5°
C42	C43	H9	108.2°	109.5°
C42	C43	H10	108.2°	109.5°
C3	C2	O37	107.6°	109.5°
C3	C2	C1	109.9°	109.4°
C3	C2	H34	108.5°	109.5°
C2	C3	H35	109.3°	109.4°
C2	C3	H36	109.3°	109.5°
C38	C39	C40	113.7°	109.5°
C39	C38	O37	116.6°	120.0°
C39	C38	O47	120.1°	120.0°
C38	C39	H1	108.4°	109.5°
C38	C39	H2	108.4°	109.5°
C39	C40	C41	110.6°	109.5°
C40	C39	H1	108.4°	109.5°
C40	C39	H2	108.4°	109.5°
C39	C40	H3	109.2°	109.5°
C39	C40	H4	109.2°	109.5°
C2	O37	C38	120.5°	117.0°
O37	C2	C1	112.0°	109.5°
O37	C2	H34	110.3°	109.5°
O37	C38	O47	123.3°	120.0°
C42	C41	C40	111.5°	109.5°
C42	C41	H5	108.9°	109.4°
C42	C41	H6	109.0°	109.5°
C41	C42	H7	109.8°	109.4°
C41	C42	H8	109.8°	109.5°
C2	C1	O19	114.1°	109.5°
C1	C2	H34	108.5°	109.5°
C2	C1	H45	108.3°	109.5°
C2	C1	H46	108.3°	109.4°
C41	C40	H3	109.2°	109.5°
C41	C40	H4	109.2°	109.5°
C40	C41	H5	108.9°	109.4°
C40	C41	H6	108.9°	109.5°
C1	O19	C17	110.9°	117.1°
O19	C1	H45	108.3°	109.5°
O19	C1	H46	108.3°	109.5°
O19	C17	O18	120.4°	119.9°
O19	C17	C20	120.2°	120.1°
C34	C33	C32	110.2°	109.4°
C34	C33	H73	109.3°	109.5°
C34	C33	H74	109.3°	109.5°
C33	C34	H75	109.5°	109.5°
C33	C34	H76	109.4°	109.5°
C33	C34	H77	109.5°	109.4°
O18	C17	C20	119.3°	120.0°
C17	C20	C21	110.8°	109.5°
C17	C20	H47	109.1°	109.5°
C17	C20	H48	109.2°	109.5°
C20	C21	C22	108.3°	109.5°
C21	C20	H47	109.2°	109.4°
C21	C20	H48	109.1°	109.4°
C20	C21	H49	109.8°	109.4°
C20	C21	H50	109.8°	109.5°
C33	C32	C31	113.9°	109.5°
C33	C32	H71	108.3°	109.5°
C33	C32	H72	108.4°	109.5°
C32	C33	H73	109.3°	109.5°
C32	C33	H74	109.3°	109.5°
C32	C31	C30	109.4°	109.5°
C32	C31	H69	109.5°	109.5°
C32	C31	H70	109.5°	109.4°
C31	C32	H71	108.4°	109.5°
C31	C32	H72	108.3°	109.4°
C28	C29	C30	109.1°	109.4°
C29	C28	C27	111.3°	109.4°
C29	C28	H63	109.0°	109.5°
C29	C28	H64	109.0°	109.5°
C28	C29	H65	109.6°	109.4°
C28	C29	H66	109.5°	109.5°
C29	C30	C31	110.9°	109.4°
C30	C29	H65	109.6°	109.5°
C30	C29	H66	109.6°	109.5°
C29	C30	H67	109.1°	109.5°
C29	C30	H68	109.1°	109.5°
C28	C27	C26	109.4°	109.4°
C28	C27	H61	109.5°	109.5°
C28	C27	H62	109.5°	109.5°
C27	C28	H63	109.0°	109.5°
C27	C28	H64	109.0°	109.5°
C27	C26	C25	111.5°	109.5°
C27	C26	H59	109.0°	109.5°
C27	C26	H60	109.0°	109.5°
C26	C27	H61	109.5°	109.5°
C26	C27	H62	109.5°	109.4°
C21	C22	C23	110.6°	109.5°
C22	C21	H49	109.7°	109.4°
C22	C21	H50	109.8°	109.5°
C21	C22	H51	109.2°	109.4°
C21	C22	H52	109.2°	109.5°
C31	C30	H67	109.1°	109.5°
C31	C30	H68	109.1°	109.5°
C30	C31	H69	109.5°	109.5°
C30	C31	H70	109.5°	109.5°
C22	C23	C24	108.2°	109.5°
C23	C22	H51	109.2°	109.5°
C23	C22	H52	109.2°	109.5°
C22	C23	H53	109.8°	109.5°
C22	C23	H54	109.8°	109.5°
C26	C25	C24	109.4°	109.5°
C26	C25	H57	109.5°	109.4°
C26	C25	H58	109.5°	109.4°
C25	C26	H59	109.0°	109.5°
C25	C26	H60	109.0°	109.5°
C23	C24	C25	110.8°	109.5°
C24	C23	H53	109.8°	109.4°
C24	C23	H54	109.8°	109.4°
C23	C24	H55	109.2°	109.5°
C23	C24	H56	109.1°	109.5°
C25	C24	H55	109.1°	109.5°
C25	C24	H56	109.2°	109.5°
C24	C25	H57	109.5°	109.5°
C24	C25	H58	109.5°	109.5°
H1	C39	H2	109.5°	109.4°
H3	C40	H4	109.5°	109.5°
H5	C41	H6	109.5°	109.5°
H7	C42	H8	109.4°	109.5°
H9	C43	H10	109.5°	109.5°
H11	C44	H12	109.5°	109.5°
H13	C45	H14	109.5°	109.5°
H17	C49	H18	109.5°	109.4°
H19	C50	H20	109.5°	109.5°
H21	C51	H22	109.4°	109.5°
H23	C52	H24	109.5°	109.5°
H25	C53	H26	109.5°	109.5°
H27	C54	H28	109.5°	109.5°
H29	C55	H30	109.5°	109.5°
H31	C56	H32	109.5°	109.5°
H31	C56	H33	109.5°	109.4°
H32	C56	H33	109.5°	109.5°
H35	C3	H36	109.5°	109.5°
H38	CB	H39	109.4°	109.5°
H41	N	H42	109.4°	111.0°
H45	C1	H46	109.4°	109.4°
H47	C20	H48	109.4°	109.5°
H49	C21	H50	109.5°	109.5°
H51	C22	H52	109.5°	109.5°
H53	C23	H54	109.5°	109.5°
H55	C24	H56	109.4°	109.5°
H57	C25	H58	109.4°	109.5°
H59	C26	H60	109.5°	109.5°
H61	C27	H62	109.5°	109.5°
H63	C28	H64	109.5°	109.5°
H65	C29	H66	109.5°	109.5°
H67	C30	H68	109.5°	109.5°
H69	C31	H70	109.4°	109.5°
H71	C32	H72	109.5°	109.5°
H73	C33	H74	109.4°	109.5°
H75	C34	H76	109.5°	109.5°
H75	C34	H77	109.5°	109.4°
H76	C34	H77	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C56	C55	C54	H29	120.3°	120.0°
C56	C55	C54	H30	120.3°	120.0°
C56	C55	C54	C53	76.5°	180.0°
C56	C55	C54	H27	162.9°	60.0°
C56	C55	C54	H28	44.1°	60.0°
C56	C55	H29	H30	119.1°	120.0°
C55	C56	H31	H32	120.0°	120.0°
C55	C56	H31	H33	120.0°	120.0°
C55	C56	H32	H33	120.0°	120.0°
C55	C54	C53	H27	120.6°	120.0°
C55	C54	C53	H28	120.5°	120.0°
C55	C54	C53	C52	134.0°	180.0°
C55	C54	C53	H25	13.8°	60.0°
C55	C54	C53	H26	105.8°	60.0°
C55	C54	H27	H28	118.2°	120.0°
C54	C55	H29	H30	119.1°	120.1°
C54	C55	C56	H31	180.0°	60.0°
C54	C55	C56	H32	60.0°	60.0°
C54	C55	C56	H33	60.0°	180.0°
C54	C53	C52	H25	120.2°	120.0°
C54	C53	C52	H26	120.2°	120.0°
C54	C53	C52	C51	96.4°	180.0°
C54	C53	C52	H23	23.5°	60.0°
C54	C53	C52	H24	143.8°	60.0°
C54	C53	H25	H26	119.4°	120.0°
C53	C54	H27	H28	118.3°	120.1°
C53	C54	C55	H29	43.8°	60.0°
C53	C54	C55	H30	163.2°	60.0°
C53	C52	C51	H23	119.9°	120.0°
C53	C52	C51	H24	119.9°	119.9°
C53	C52	C51	C50	136.8°	180.0°
C53	C52	C51	H21	16.3°	59.9°
C53	C52	C51	H22	102.8°	60.1°
C53	C52	H23	H24	120.3°	119.9°
C52	C53	H25	H26	119.3°	120.0°
C52	C53	C54	H27	105.5°	60.0°
C52	C53	C54	H28	13.4°	60.1°
C52	C51	C50	H21	120.5°	120.0°
C52	C51	C50	H22	120.5°	119.9°
C52	C51	C50	C49	168.5°	180.0°
C52	C51	C50	H19	49.6°	60.0°
C52	C51	C50	H20	72.7°	60.1°
C52	C51	H21	H22	118.6°	120.0°
C51	C52	H23	H24	120.3°	120.1°
C51	C52	C53	H25	143.4°	60.0°
C51	C52	C53	H26	23.9°	60.0°
C51	C50	C49	H19	118.9°	120.0°
C51	C50	C49	H20	118.9°	120.0°
C51	C50	C49	C48	151.2°	180.0°
C51	C50	C49	H17	30.5°	60.0°
C51	C50	C49	H18	88.1°	60.0°
C51	C50	H19	H20	123.3°	120.0°
C50	C51	H21	H22	118.6°	120.0°
C50	C51	C52	H23	103.4°	60.0°
C50	C51	C52	H24	16.9°	60.1°
C50	C49	C48	H17	120.7°	120.0°
C50	C49	C48	H18	120.7°	120.1°
C50	C49	C48	C46	161.4°	126.3°
C50	C49	C48	H16	18.6°	53.7°
C50	C49	H17	H18	117.8°	120.0°
C49	C50	H19	H20	123.3°	120.0°
C49	C50	C51	H21	71.1°	60.0°
C49	C50	C51	H22	48.0°	60.1°
N	CA	C	CB	114.3°	120.0°
N	CA	C	H40	123.3°	120.0°
N	CA	C	O	142.8°	0.0°
N	CA	CB	H40	122.3°	120.0°
N	CA	CB	OG	114.1°	64.9°
N	CA	CB	H38	126.1°	55.0°
N	CA	CB	H39	5.8°	175.0°
CA	N	H41	H42	120.0°	124.0°
N	CA	C	H44	37.2°	180.0°
C49	C48	C46	H16	180.0°	180.0°
C49	C48	C46	C45	1.1°	7.6°
C49	C48	C46	H15	178.9°	172.4°
C48	C49	H17	H18	117.8°	119.9°
C48	C49	C50	H19	89.9°	60.0°
C48	C49	C50	H20	32.4°	60.0°
C48	C46	C45	H15	180.0°	180.0°
C48	C46	C45	C44	152.3°	127.6°
C48	C46	C45	H13	87.1°	7.7°
C48	C46	C45	H14	31.7°	112.4°
C46	C48	C49	H17	77.9°	113.7°
C46	C48	C49	H18	40.7°	6.3°
CA	C	O	H44	180.0°	180.0°
C	CA	CB	H40	122.5°	119.9°
C	CA	CB	OG	130.7°	175.0°
C	CA	CB	H38	10.8°	65.0°
C	CA	CB	H39	109.4°	55.0°
C	CA	N	H41	180.0°	60.0°
C	CA	N	H42	60.0°	63.9°
O	C	CA	CB	28.5°	120.0°
O	C	CA	H40	94.0°	120.0°
CA	CB	OG	H38	119.9°	120.0°
CA	CB	OG	H39	119.9°	120.0°
CA	CB	OG	P12	129.9°	180.0°
CA	CB	H38	H39	120.4°	120.0°
CB	CA	N	H41	63.8°	60.0°
CB	CA	N	H42	56.2°	176.0°
CB	CA	C	H44	151.5°	60.0°
C46	C45	C44	H13	120.6°	120.0°
C46	C45	C44	H14	120.6°	120.0°
C46	C45	C44	C43	170.0°	180.0°
C46	C45	C44	H11	50.7°	60.0°
C46	C45	C44	H12	70.8°	60.0°
C46	C45	H13	H14	118.2°	120.0°
C45	C46	C48	H16	178.9°	172.5°
O15	P12	OG	CB	34.5°	55.1°
O15	P12	OG	O16	118.3°	120.0°
O15	P12	OG	O13	120.4°	120.0°
O15	P12	O16	O13	120.6°	120.0°
O15	P12	O16	C3	159.4°	55.0°
O15	P12	O13	H37	0.0°	180.0°
CB	OG	P12	O16	152.8°	175.0°
CB	OG	P12	O13	85.8°	64.9°
OG	CB	H38	H39	120.4°	120.0°
OG	CB	CA	H40	8.2°	55.1°
C45	C44	C43	H11	119.3°	120.0°
C45	C44	C43	H12	119.3°	120.0°
C45	C44	C43	C42	137.7°	180.0°
C45	C44	C43	H9	16.9°	60.0°
C45	C44	C43	H10	101.6°	60.0°
C45	C44	H11	H12	122.1°	120.0°
C44	C45	H13	H14	118.2°	120.0°
C44	C45	C46	H15	27.7°	52.4°
OG	P12	O16	O13	119.4°	120.1°
OG	P12	O16	C3	80.6°	175.0°
OG	P12	O13	H37	121.7°	60.0°
P12	OG	CB	H38	110.3°	60.0°
P12	OG	CB	H39	9.9°	60.0°
P12	O16	C3	C2	119.0°	180.0°
P12	O16	C3	H35	120.9°	60.1°
P12	O16	C3	H36	1.1°	60.0°
O16	P12	O13	H37	120.2°	60.1°
O13	P12	O16	C3	38.8°	65.0°
O16	C3	C2	H35	120.1°	120.0°
O16	C3	C2	H36	120.1°	120.0°
O16	C3	C2	O37	78.7°	65.0°
O16	C3	C2	C1	159.1°	55.0°
O16	C3	C2	H34	40.5°	175.0°
O16	C3	H35	H36	119.7°	120.0°
C44	C43	C42	H9	120.8°	120.0°
C44	C43	C42	H10	120.7°	120.0°
C44	C43	C42	C41	160.9°	180.0°
C44	C43	C42	H7	79.3°	60.1°
C44	C43	C42	H8	41.1°	60.0°
C44	C43	H9	H10	117.6°	120.0°
C43	C44	H11	H12	122.0°	120.0°
C43	C44	C45	H13	69.5°	60.0°
C43	C44	C45	H14	49.4°	60.0°
C43	C42	C41	H7	119.8°	119.9°
C43	C42	C41	H8	119.8°	120.1°
C43	C42	C41	C40	105.0°	180.0°
C43	C42	C41	H5	134.7°	60.1°
C43	C42	C41	H6	15.3°	59.9°
C43	C42	H7	H8	120.7°	120.0°
C42	C43	H9	H10	117.7°	120.0°
C42	C43	C44	H11	103.0°	60.0°
C42	C43	C44	H12	18.4°	60.0°
C3	C2	O37	C1	120.9°	120.0°
C3	C2	O37	H34	118.1°	120.0°
C3	C2	O37	C38	171.3°	90.0°
C3	C2	C1	H34	118.5°	120.0°
C3	C2	C1	O19	13.7°	55.0°
C2	C3	H35	H36	119.7°	120.0°
C3	C2	C1	H45	107.0°	65.0°
C3	C2	C1	H46	134.4°	175.0°
C38	C39	C40	H1	120.6°	120.0°
C38	C39	C40	H2	120.6°	120.1°
C39	C38	O37	C2	174.5°	179.7°
C39	C38	O37	O47	179.5°	179.8°
C38	C39	C40	C41	163.2°	180.0°
C38	C39	H1	H2	118.1°	120.0°
C38	C39	C40	H3	43.0°	60.0°
C38	C39	C40	H4	76.6°	60.0°
C40	C39	C38	O37	137.2°	179.8°
C39	C40	C41	C42	107.6°	180.0°
C40	C39	C38	O47	43.3°	0.1°
C39	C40	C41	H3	120.2°	120.0°
C39	C40	C41	H4	120.2°	120.0°
C40	C39	H1	H2	118.0°	119.9°
C39	C40	H3	H4	119.5°	120.0°
C39	C40	C41	H5	132.1°	60.1°
C39	C40	C41	H6	12.7°	60.0°
O37	C2	C1	H34	122.0°	120.0°
C2	O37	C38	O47	4.9°	0.1°
O37	C2	C1	O19	105.8°	65.0°
O37	C2	C3	H35	41.4°	55.0°
O37	C2	C3	H36	161.2°	175.0°
O37	C2	C1	H45	133.5°	175.0°
O37	C2	C1	H46	14.9°	55.0°
C38	O37	C2	C1	67.8°	150.1°
O37	C38	C39	H1	102.2°	59.8°
O37	C38	C39	H2	16.6°	60.2°
C38	O37	C2	H34	53.2°	30.0°
C42	C41	C40	H5	120.3°	119.9°
C42	C41	C40	H6	120.3°	120.1°
C42	C41	C40	H3	132.2°	60.0°
C42	C41	C40	H4	12.6°	60.0°
C42	C41	H5	H6	119.1°	120.1°
C41	C42	H7	H8	120.6°	120.1°
C41	C42	C43	H9	40.1°	60.0°
C41	C42	C43	H10	78.4°	60.0°
C2	C1	O19	H45	120.7°	120.1°
C2	C1	O19	H46	120.7°	120.0°
C2	C1	O19	C17	161.8°	180.0°
C1	C2	C3	H35	80.8°	175.0°
C1	C2	C3	H36	39.0°	65.0°
C2	C1	H45	H46	117.9°	119.9°
O47	C38	C39	H1	77.3°	120.1°
O47	C38	C39	H2	163.9°	120.0°
C41	C40	C39	H1	76.2°	60.0°
C41	C40	C39	H2	42.6°	59.9°
C41	C40	H3	H4	119.5°	120.0°
C40	C41	H5	H6	119.1°	120.0°
C40	C41	C42	H7	14.8°	60.1°
C40	C41	C42	H8	135.2°	59.9°
C1	O19	C17	O18	73.3°	0.0°
C1	O19	C17	C20	108.6°	180.0°
O19	C1	C2	H34	132.2°	175.0°
O19	C1	H45	H46	117.9°	120.0°
O19	C17	O18	C20	178.1°	180.0°
O19	C17	C20	C21	113.4°	180.0°
C17	O19	C1	H45	41.1°	60.0°
C17	O19	C1	H46	77.5°	60.0°
O19	C17	C20	H47	6.8°	60.0°
O19	C17	C20	H48	126.4°	60.0°
C34	C33	C32	H73	120.1°	120.0°
C34	C33	C32	H74	120.1°	120.0°
C34	C33	C32	C31	140.0°	180.0°
C34	C33	C32	H71	99.3°	60.0°
C34	C33	C32	H72	19.4°	60.0°
C34	C33	H73	H74	119.6°	120.0°
C33	C34	H75	H76	120.0°	120.0°
C33	C34	H75	H77	120.0°	120.0°
C33	C34	H76	H77	120.0°	119.9°
O18	C17	C20	C21	68.5°	0.0°
O18	C17	C20	H47	171.3°	120.0°
O18	C17	C20	H48	51.7°	120.0°
C17	C20	C21	H47	120.2°	120.0°
C17	C20	C21	H48	120.2°	120.1°
C17	C20	C21	C22	114.9°	180.0°
C17	C20	H47	H48	119.4°	120.1°
C17	C20	C21	H49	125.3°	60.0°
C17	C20	C21	H50	4.9°	59.9°
C20	C21	C22	H49	119.8°	120.0°
C20	C21	C22	H50	119.8°	120.1°
C20	C21	C22	C23	156.8°	180.0°
C21	C20	H47	H48	119.4°	119.9°
C20	C21	H49	H50	120.6°	120.0°
C20	C21	C22	H51	83.0°	60.0°
C20	C21	C22	H52	36.6°	59.9°
C33	C32	C31	H71	120.6°	120.0°
C33	C32	C31	H72	120.7°	120.0°
C33	C32	C31	C30	175.0°	180.0°
C33	C32	C31	H69	55.0°	60.0°
C33	C32	C31	H70	65.0°	60.0°
C33	C32	H71	H72	118.0°	120.0°
C32	C33	H73	H74	119.7°	120.0°
C32	C33	C34	H75	180.0°	60.0°
C32	C33	C34	H76	60.0°	60.0°
C32	C33	C34	H77	60.0°	180.0°
C32	C31	C30	C29	98.9°	180.0°
C32	C31	C30	H69	120.0°	120.0°
C32	C31	C30	H70	120.0°	119.9°
C32	C31	C30	H67	21.3°	60.0°
C32	C31	C30	H68	140.9°	60.0°
C32	C31	H69	H70	120.0°	120.0°
C31	C32	H71	H72	118.0°	120.0°
C31	C32	C33	H73	19.9°	60.0°
C31	C32	C33	H74	99.9°	60.1°
C28	C29	C30	H65	119.9°	120.0°
C28	C29	C30	H66	119.9°	120.0°
C29	C28	C27	H63	120.3°	120.0°
C29	C28	C27	H64	120.3°	120.0°
C29	C28	C27	C26	84.4°	NaN°
C28	C29	C30	C31	146.1°	NaN°
C29	C28	C27	H61	155.6°	60.0°
C29	C28	C27	H62	35.6°	60.1°
C29	C28	H63	H64	119.1°	120.0°
C28	C29	H65	H66	120.2°	120.0°
C28	C29	C30	H67	93.7°	60.0°
C28	C29	C30	H68	25.9°	60.0°
C30	C29	C28	C27	145.0°	180.0°
C29	C30	C31	H67	120.2°	120.0°
C29	C30	C31	H68	120.2°	120.0°
C30	C29	C28	H63	24.7°	60.0°
C30	C29	C28	H64	94.7°	60.0°
C30	C29	H65	H66	120.2°	120.0°
C29	C30	H67	H68	119.3°	120.0°
C29	C30	C31	H69	21.1°	60.0°
C29	C30	C31	H70	141.1°	60.0°
C28	C27	C26	H61	120.0°	120.0°
C28	C27	C26	H62	120.0°	120.0°
C28	C27	C26	C25	147.9°	180.0°
C28	C27	C26	H59	91.9°	60.0°
C28	C27	C26	H60	27.6°	60.0°
C28	C27	H61	H62	120.0°	120.1°
C27	C28	H63	H64	119.2°	120.0°
C27	C28	C29	H65	25.1°	60.0°
C27	C28	C29	H66	95.1°	60.0°
C27	C26	C25	H59	120.3°	120.0°
C27	C26	C25	H60	120.3°	120.0°
C27	C26	C25	C24	107.7°	180.0°
C27	C26	C25	H57	132.3°	60.0°
C27	C26	C25	H58	12.3°	60.0°
C27	C26	H59	H60	119.1°	120.0°
C26	C27	H61	H62	120.0°	120.0°
C26	C27	C28	H63	35.8°	60.0°
C26	C27	C28	H64	155.3°	60.0°
C21	C22	C23	H51	120.2°	119.9°
C21	C22	C23	H52	120.2°	120.1°
C21	C22	C23	C24	108.0°	179.9°
C22	C21	C20	H47	5.3°	60.0°
C22	C21	C20	H48	124.9°	59.9°
C22	C21	H49	H50	120.5°	120.0°
C21	C22	H51	H52	119.5°	120.0°
C21	C22	C23	H53	132.2°	60.1°
C21	C22	C23	H54	11.8°	60.0°
C31	C30	C29	H65	26.1°	60.0°
C31	C30	C29	H66	94.0°	60.0°
C31	C30	H67	H68	119.3°	120.0°
C30	C31	H69	H70	120.0°	120.0°
C30	C31	C32	H71	64.4°	60.0°
C30	C31	C32	H72	54.4°	60.0°
C22	C23	C24	H53	119.8°	120.0°
C22	C23	C24	H54	119.8°	120.0°
C22	C23	C24	C25	116.5°	180.0°
C23	C22	C21	H49	37.0°	60.0°
C23	C22	C21	H50	83.4°	60.0°
C23	C22	H51	H52	119.5°	120.0°
C22	C23	H53	H54	120.6°	120.0°
C22	C23	C24	H55	123.3°	60.0°
C22	C23	C24	H56	3.7°	60.0°
C26	C25	C24	C23	173.1°	180.0°
C26	C25	C24	H57	120.0°	120.0°
C26	C25	C24	H58	120.0°	120.0°
C26	C25	C24	H55	66.7°	60.0°
C26	C25	C24	H56	52.9°	60.0°
C26	C25	H57	H58	120.0°	120.0°
C25	C26	H59	H60	119.1°	120.0°
C25	C26	C27	H61	27.9°	60.0°
C25	C26	C27	H62	92.1°	60.0°
C23	C24	C25	H55	120.2°	120.0°
C23	C24	C25	H56	120.2°	120.0°
C24	C23	C22	H51	12.1°	60.0°
C24	C23	C22	H52	131.8°	60.0°
C24	C23	H53	H54	120.6°	119.9°
C23	C24	H55	H56	119.4°	120.0°
C23	C24	C25	H57	66.9°	60.0°
C23	C24	C25	H58	53.1°	60.1°
C25	C24	C23	H53	3.3°	60.0°
C25	C24	C23	H54	123.6°	60.0°
C25	C24	H55	H56	119.4°	120.0°
C24	C25	H57	H58	120.0°	120.0°
C24	C25	C26	H59	12.5°	60.0°
C24	C25	C26	H60	132.0°	60.0°
H1	C39	C40	H3	163.7°	180.0°
H1	C39	C40	H4	44.0°	60.0°
H2	C39	C40	H3	77.6°	60.1°
H2	C39	C40	H4	162.7°	180.0°
H3	C40	C41	H5	12.0°	179.9°
H3	C40	C41	H6	107.5°	60.0°
H4	C40	C41	H5	107.7°	60.0°
H4	C40	C41	H6	132.8°	180.0°
H5	C41	C42	H7	105.5°	180.0°
H5	C41	C42	H8	15.0°	60.0°
H6	C41	C42	H7	135.1°	60.0°
H6	C41	C42	H8	104.5°	180.0°
H7	C42	C43	H9	159.9°	179.9°
H7	C42	C43	H10	41.4°	60.0°
H8	C42	C43	H9	79.7°	60.0°
H8	C42	C43	H10	161.8°	180.0°
H9	C43	C44	H11	136.2°	180.0°
H9	C43	C44	H12	102.4°	60.0°
H10	C43	C44	H11	17.7°	60.0°
H10	C43	C44	H12	139.1°	180.0°
H11	C44	C45	H13	171.2°	180.0°
H11	C44	C45	H14	69.9°	60.0°
H12	C44	C45	H13	49.8°	60.0°
H12	C44	C45	H14	168.7°	NaN°
H13	C45	C46	H15	92.9°	172.4°
H14	C45	C46	H15	148.3°	67.6°
H15	C46	C48	H16	1.1°	7.5°
H16	C48	C49	H17	102.1°	66.4°
H16	C48	C49	H18	139.3°	173.7°
H17	C49	C50	H19	149.4°	180.0°
H17	C49	C50	H20	88.3°	60.0°
H18	C49	C50	H19	30.8°	60.0°
H18	C49	C50	H20	153.1°	180.0°
H19	C50	C51	H21	170.1°	180.0°
H19	C50	C51	H22	70.9°	59.9°
H20	C50	C51	H21	47.8°	60.0°
H20	C50	C51	H22	166.9°	180.0°
H21	C51	C52	H23	136.2°	180.0°
H21	C51	C52	H24	103.6°	60.0°
H22	C51	C52	H23	17.1°	60.0°
H22	C51	C52	H24	137.4°	180.0°
H23	C52	C53	H25	96.7°	180.0°
H23	C52	C53	H26	143.8°	60.0°
H24	C52	C53	H25	23.6°	60.0°
H24	C52	C53	H26	96.0°	180.0°
H25	C53	C54	H27	134.3°	180.0°
H25	C53	C54	H28	106.8°	59.9°
H26	C53	C54	H27	14.7°	60.0°
H26	C53	C54	H28	133.6°	179.9°
H27	C54	C55	H29	76.8°	180.0°
H27	C54	C55	H30	42.6°	60.0°
H28	C54	C55	H29	164.3°	60.0°
H28	C54	C55	H30	76.2°	180.0°
H29	C55	C56	H31	59.7°	180.0°
H29	C55	C56	H32	60.3°	60.0°
H29	C55	C56	H33	179.7°	60.0°
H30	C55	C56	H31	59.7°	60.0°
H30	C55	C56	H32	179.7°	180.0°
H30	C55	C56	H33	60.3°	60.0°
H31	C56	H32	H33	120.0°	120.0°
H34	C2	C3	H35	160.7°	65.0°
H34	C2	C3	H36	79.6°	55.0°
H34	C2	C1	H45	11.5°	54.9°
H34	C2	C1	H46	107.1°	65.0°
H38	CB	CA	H40	111.7°	175.0°
H39	CB	CA	H40	128.1°	65.0°
H40	CA	N	H41	57.6°	180.0°
H40	CA	N	H42	177.6°	56.1°
H40	CA	C	H44	86.0°	59.9°
H47	C20	C21	H49	114.5°	180.0°
H47	C20	C21	H50	125.1°	60.1°
H48	C20	C21	H49	5.1°	60.0°
H48	C20	C21	H50	115.4°	180.0°
H49	C21	C22	H51	157.2°	180.0°
H49	C21	C22	H52	83.2°	60.0°
H50	C21	C22	H51	36.8°	60.0°
H50	C21	C22	H52	156.4°	NaN°
H51	C22	C23	H53	107.7°	180.0°
H51	C22	C23	H54	131.9°	60.0°
H52	C22	C23	H53	12.0°	60.0°
H52	C22	C23	H54	108.4°	179.9°
H53	C23	C24	H55	116.9°	180.0°
H53	C23	C24	H56	123.5°	60.0°
H54	C23	C24	H55	3.5°	60.0°
H54	C23	C24	H56	116.1°	180.0°
H55	C24	C25	H57	53.3°	180.0°
H55	C24	C25	H58	173.3°	59.9°
H56	C24	C25	H57	172.9°	60.0°
H56	C24	C25	H58	67.1°	179.9°
H57	C25	C26	H59	107.5°	180.0°
H57	C25	C26	H60	12.0°	60.0°
H58	C25	C26	H59	132.5°	60.0°
H58	C25	C26	H60	108.0°	180.0°
H59	C26	C27	H61	148.2°	180.0°
H59	C26	C27	H62	28.2°	60.0°
H60	C26	C27	H61	92.4°	60.0°
H60	C26	C27	H62	147.6°	179.9°
H61	C27	C28	H63	84.2°	180.0°
H61	C27	C28	H64	35.3°	60.0°
H62	C27	C28	H63	155.8°	59.9°
H62	C27	C28	H64	84.7°	179.9°
H63	C28	C29	H65	95.2°	180.0°
H63	C28	C29	H66	144.7°	60.0°
H64	C28	C29	H65	145.4°	60.0°
H64	C28	C29	H66	25.2°	179.9°
H65	C29	C30	H67	146.4°	180.0°
H65	C29	C30	H68	94.1°	60.0°
H66	C29	C30	H67	26.2°	60.0°
H66	C29	C30	H68	145.8°	180.0°
H67	C30	C31	H69	141.4°	180.0°
H67	C30	C31	H70	98.7°	60.0°
H68	C30	C31	H69	99.1°	60.0°
H68	C30	C31	H70	20.9°	179.9°
H69	C31	C32	H71	175.6°	180.0°
H69	C31	C32	H72	65.7°	60.0°
H70	C31	C32	H71	55.6°	60.0°
H70	C31	C32	H72	174.4°	180.0°
H71	C32	C33	H73	140.5°	180.0°
H71	C32	C33	H74	20.8°	60.0°
H72	C32	C33	H73	100.7°	60.0°
H72	C32	C33	H74	139.5°	180.0°
H73	C33	C34	H75	59.9°	180.0°
H73	C33	C34	H76	60.2°	60.0°
H73	C33	C34	H77	179.9°	60.0°
H74	C33	C34	H75	59.9°	59.9°
H74	C33	C34	H76	179.9°	NaN°
H74	C33	C34	H77	60.1°	60.0°
H75	C34	H76	H77	120.0°	120.0°

Release date:	2017-11-01
Definition date:	2017-10-18
Last modified:	2017-10-27
Release status:	REL
Processing site:	RCSB
Derived from:	5WKE