V8P

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O4A	C4A	sing	1.43Å	1.45Å
O3A	C3A	sing	1.43Å	1.42Å
C4A	C3A	sing	1.53Å	1.54Å
C4A	C5M	sing	1.53Å	1.55Å
C2A	C3A	sing	1.53Å	1.54Å
C2A	O2A	sing	1.43Å	1.44Å
C2A	C1A	sing	1.53Å	1.53Å
C6A	C5M	sing	1.53Å	1.53Å
C6A	O6A	sing	1.43Å	1.43Å
C5M	O5A	sing	1.43Å	1.46Å
O5A	C1A	sing	1.43Å	1.46Å
C1A	O1A	sing	1.43Å	1.43Å
O1A	C1	sing	1.43Å	1.43Å
C1	C2	sing	1.53Å	1.55Å
O3	C3	sing	1.43Å	1.43Å
N2	C2	sing	1.46Å	1.48Å
N2	CAA	sing	1.35Å	1.35Å
C2	C3	sing	1.53Å	1.56Å
C3	C4	sing	1.53Å	1.54Å
CAB	CAA	sing	1.51Å	1.53Å
CAB	CAC	sing	1.53Å	1.53Å
CAA	OAA	doub	1.21Å	1.23Å
O4	CAC	sing	1.43Å	1.43Å
CAC	CAD	sing	1.53Å	1.54Å
C4	C5	sing	1.53Å	1.54Å
C5	C6	sing	1.53Å	1.54Å
CAD	CAE	sing	1.53Å	1.54Å
C6	C7	sing	1.53Å	1.53Å
C7	C8	sing	1.53Å	1.53Å
CAE	CAF	sing	1.53Å	1.53Å
C8	C9	sing	1.53Å	1.54Å
CAF	CAG	sing	1.53Å	1.53Å
C10	C9	sing	1.53Å	1.54Å
C10	C11	sing	1.53Å	1.54Å
CAG	CAH	sing	1.53Å	1.53Å
C11	C12	sing	1.53Å	1.53Å
C21	C20	sing	1.53Å	1.53Å
C21	C22	sing	1.53Å	1.53Å
C20	C14	sing	1.53Å	1.54Å
C13	C12	sing	1.53Å	1.54Å
C13	C14	sing	1.53Å	1.53Å
CAH	CAI	sing	1.53Å	1.53Å
CAI	CAJ	sing	1.53Å	1.53Å
CAJ	CAK	sing	1.53Å	1.53Å
CAK	CAL	sing	1.53Å	1.53Å
C16	CAL	sing	1.53Å	1.54Å
C16	C15	sing	1.53Å	1.53Å
C17	C15	sing	1.53Å	1.53Å
C17	C18	sing	1.53Å	1.53Å
C18	C19	sing	1.53Å	1.53Å
C21	H1	sing	1.09Å	1.10Å
C21	H2	sing	1.09Å	1.10Å
C16	H3	sing	1.09Å	1.10Å
C16	H4	sing	1.09Å	1.10Å
C20	H5	sing	1.09Å	1.10Å
C20	H6	sing	1.09Å	1.10Å
C15	H7	sing	1.09Å	1.10Å
C15	H8	sing	1.09Å	1.10Å
C17	H9	sing	1.09Å	1.10Å
C17	H10	sing	1.09Å	1.10Å
C14	H11	sing	1.09Å	1.10Å
C14	H12	sing	1.09Å	1.10Å
C19	H13	sing	1.09Å	1.10Å
C19	H14	sing	1.09Å	1.10Å
C19	H15	sing	1.09Å	1.10Å
C13	H16	sing	1.09Å	1.10Å
C13	H17	sing	1.09Å	1.10Å
C9	H18	sing	1.09Å	1.10Å
C9	H19	sing	1.09Å	1.10Å
C11	H20	sing	1.09Å	1.10Å
C11	H21	sing	1.09Å	1.10Å
C8	H22	sing	1.09Å	1.10Å
C8	H23	sing	1.09Å	1.10Å
C7	H24	sing	1.09Å	1.10Å
C7	H25	sing	1.09Å	1.10Å
C5	H26	sing	1.09Å	1.10Å
C5	H27	sing	1.09Å	1.10Å
C6	H28	sing	1.09Å	1.10Å
C6	H29	sing	1.09Å	1.10Å
C4	H30	sing	1.09Å	1.10Å
C4	H31	sing	1.09Å	1.10Å
C1	H32	sing	1.09Å	1.10Å
C1	H33	sing	1.09Å	1.10Å
C3	H34	sing	1.09Å	1.10Å
C2	H35	sing	1.09Å	1.10Å
CAB	H36	sing	1.09Å	1.10Å
CAB	H37	sing	1.09Å	1.10Å
CAC	H38	sing	1.09Å	1.10Å
O4	H39	sing	0.97Å	0.95Å
CAD	H40	sing	1.09Å	1.10Å
CAD	H41	sing	1.09Å	1.10Å
CAE	H42	sing	1.09Å	1.10Å
CAE	H43	sing	1.09Å	1.10Å
CAF	H44	sing	1.09Å	1.10Å
CAF	H45	sing	1.09Å	1.10Å
CAG	H46	sing	1.09Å	1.10Å
CAG	H47	sing	1.09Å	1.10Å
CAH	H48	sing	1.09Å	1.10Å
CAH	H49	sing	1.09Å	1.10Å
CAI	H50	sing	1.09Å	1.10Å
CAI	H51	sing	1.09Å	1.10Å
CAJ	H52	sing	1.09Å	1.10Å
CAJ	H53	sing	1.09Å	1.10Å
CAK	H54	sing	1.09Å	1.10Å
CAK	H55	sing	1.09Å	1.10Å
CAL	H56	sing	1.09Å	1.10Å
CAL	H57	sing	1.09Å	1.10Å
N2	H58	sing	0.97Å	1.00Å
C1A	H59	sing	1.09Å	1.10Å
C2A	H60	sing	1.09Å	1.10Å
O2A	H61	sing	0.97Å	0.95Å
C3A	H62	sing	1.09Å	1.10Å
O3A	H63	sing	0.97Å	0.95Å
C4A	H64	sing	1.09Å	1.10Å
O4A	H65	sing	0.97Å	0.95Å
C5M	H66	sing	1.09Å	1.10Å
C6A	H67	sing	1.09Å	1.10Å
C6A	H68	sing	1.09Å	1.10Å
O6A	H69	sing	0.97Å	0.95Å
O3	H70	sing	0.97Å	0.95Å
C10	H71	sing	1.09Å	1.10Å
C10	H72	sing	1.09Å	1.10Å
C12	H73	sing	1.09Å	1.10Å
C12	H74	sing	1.09Å	1.10Å
C18	H75	sing	1.09Å	1.10Å
C18	H76	sing	1.09Å	1.10Å
C22	H77	sing	1.09Å	1.10Å
C22	H78	sing	1.09Å	1.10Å
C22	H79	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O4A	C4A	C3A	110.2°	109.5°
O4A	C4A	C5M	111.6°	109.5°
O4A	C4A	H64	109.5°	109.6°
C4A	O4A	H65	109.5°	114.0°
O3A	C3A	C4A	110.8°	109.6°
O3A	C3A	C2A	109.4°	109.5°
O3A	C3A	H62	109.2°	109.6°
C3A	O3A	H63	109.5°	114.0°
C3A	C4A	C5M	109.0°	109.1°
C4A	C3A	C2A	111.8°	109.0°
C4A	C3A	H62	107.7°	109.5°
C3A	C4A	H64	108.4°	109.5°
C4A	C5M	C6A	112.0°	109.5°
C4A	C5M	O5A	110.8°	109.4°
C5M	C4A	H64	108.2°	109.5°
C4A	C5M	H66	107.6°	109.5°
C3A	C2A	O2A	110.0°	109.5°
C3A	C2A	C1A	109.9°	109.1°
C3A	C2A	H60	108.3°	109.6°
C2A	C3A	H62	107.8°	109.6°
O2A	C2A	C1A	110.5°	109.5°
O2A	C2A	H60	109.6°	109.6°
C2A	O2A	H61	109.5°	114.0°
C2A	C1A	O5A	109.3°	109.4°
C2A	C1A	O1A	109.4°	109.5°
C2A	C1A	H59	107.8°	109.5°
C1A	C2A	H60	108.4°	109.5°
C5M	C6A	O6A	109.1°	109.5°
C6A	C5M	O5A	109.8°	109.5°
C6A	C5M	H66	107.8°	109.5°
C5M	C6A	H67	109.5°	109.5°
C5M	C6A	H68	109.6°	109.5°
O6A	C6A	H67	109.6°	109.5°
O6A	C6A	H68	109.6°	109.5°
C6A	O6A	H69	109.5°	114.0°
C5M	O5A	C1A	117.4°	114.1°
O5A	C5M	H66	108.7°	109.5°
O5A	C1A	O1A	112.4°	109.5°
O5A	C1A	H59	108.7°	109.5°
C1A	O1A	C1	113.9°	114.0°
O1A	C1A	H59	109.1°	109.5°
O1A	C1	C2	109.8°	109.4°
O1A	C1	H32	109.4°	109.5°
O1A	C1	H33	109.4°	109.5°
C1	C2	N2	109.7°	109.5°
C1	C2	C3	111.6°	109.5°
C2	C1	H32	109.4°	109.5°
C2	C1	H33	109.4°	109.5°
C1	C2	H35	108.0°	109.5°
O3	C3	C2	110.0°	109.5°
O3	C3	C4	108.4°	109.5°
O3	C3	H34	110.2°	109.4°
C3	O3	H70	109.5°	113.9°
C2	N2	CAA	125.1°	120.1°
N2	C2	C3	110.8°	109.5°
N2	C2	H35	108.8°	109.4°
C2	N2	H58	117.5°	119.9°
N2	CAA	CAB	113.5°	120.0°
N2	CAA	OAA	125.4°	120.0°
CAA	N2	H58	117.4°	120.0°
C2	C3	C4	110.9°	109.5°
C2	C3	H34	108.6°	109.5°
C3	C2	H35	107.9°	109.5°
C3	C4	C5	112.1°	109.5°
C3	C4	H30	108.8°	109.5°
C3	C4	H31	108.8°	109.5°
C4	C3	H34	108.8°	109.5°
CAA	CAB	CAC	110.5°	109.4°
CAB	CAA	OAA	121.0°	120.0°
CAA	CAB	H36	109.2°	109.5°
CAA	CAB	H37	109.2°	109.5°
CAB	CAC	O4	108.2°	109.5°
CAB	CAC	CAD	110.2°	109.5°
CAC	CAB	H36	109.2°	109.4°
CAC	CAB	H37	109.2°	109.4°
CAB	CAC	H38	108.7°	109.5°
O4	CAC	CAD	111.0°	109.5°
O4	CAC	H38	110.0°	109.5°
CAC	O4	H39	109.5°	114.0°
CAC	CAD	CAE	111.6°	109.5°
CAD	CAC	H38	108.7°	109.4°
CAC	CAD	H40	108.9°	109.5°
CAC	CAD	H41	108.9°	109.5°
C4	C5	C6	109.8°	109.4°
C4	C5	H26	109.4°	109.5°
C4	C5	H27	109.4°	109.5°
C5	C4	H30	108.8°	109.5°
C5	C4	H31	108.8°	109.5°
C5	C6	C7	109.4°	109.4°
C6	C5	H26	109.4°	109.5°
C6	C5	H27	109.4°	109.5°
C5	C6	H28	109.5°	109.5°
C5	C6	H29	109.5°	109.5°
CAD	CAE	CAF	110.5°	109.5°
CAE	CAD	H40	108.9°	109.5°
CAE	CAD	H41	108.9°	109.5°
CAD	CAE	H42	109.2°	109.5°
CAD	CAE	H43	109.2°	109.5°
C6	C7	C8	110.2°	109.5°
C6	C7	H24	109.3°	109.5°
C6	C7	H25	109.3°	109.4°
C7	C6	H28	109.5°	109.5°
C7	C6	H29	109.5°	109.5°
C7	C8	C9	109.9°	109.5°
C7	C8	H22	109.4°	109.5°
C7	C8	H23	109.4°	109.5°
C8	C7	H24	109.3°	109.5°
C8	C7	H25	109.3°	109.5°
CAE	CAF	CAG	111.0°	109.5°
CAF	CAE	H42	109.2°	109.4°
CAF	CAE	H43	109.2°	109.5°
CAE	CAF	H44	109.1°	109.5°
CAE	CAF	H45	109.1°	109.5°
C8	C9	C10	111.5°	109.5°
C8	C9	H18	109.0°	109.5°
C8	C9	H19	109.0°	109.5°
C9	C8	H22	109.4°	109.5°
C9	C8	H23	109.3°	109.5°
CAF	CAG	CAH	109.3°	109.5°
CAG	CAF	H44	109.1°	109.5°
CAG	CAF	H45	109.1°	109.5°
CAF	CAG	H46	109.5°	109.5°
CAF	CAG	H47	109.5°	109.5°
C9	C10	C11	109.0°	109.5°
C10	C9	H18	108.9°	109.4°
C10	C9	H19	109.0°	109.5°
C9	C10	H71	109.6°	109.4°
C9	C10	H72	109.6°	109.5°
C10	C11	C12	110.4°	109.4°
C10	C11	H20	109.2°	109.5°
C10	C11	H21	109.2°	109.5°
C11	C10	H71	109.6°	109.5°
C11	C10	H72	109.6°	109.5°
CAG	CAH	CAI	110.1°	109.5°
CAH	CAG	H46	109.5°	109.4°
CAH	CAG	H47	109.5°	109.5°
CAG	CAH	H48	109.3°	109.5°
CAG	CAH	H49	109.3°	109.5°
C11	C12	C13	111.0°	109.4°
C12	C11	H20	109.2°	109.5°
C12	C11	H21	109.2°	109.5°
C11	C12	H73	109.1°	109.5°
C11	C12	H74	109.1°	109.5°
C20	C21	C22	109.9°	109.5°
C21	C20	C14	110.6°	109.5°
C20	C21	H1	109.3°	109.5°
C20	C21	H2	109.3°	109.5°
C21	C20	H5	109.2°	109.5°
C21	C20	H6	109.2°	109.5°
C22	C21	H1	109.4°	109.5°
C22	C21	H2	109.4°	109.5°
C21	C22	H77	109.5°	109.5°
C21	C22	H78	109.4°	109.5°
C21	C22	H79	109.5°	109.5°
C20	C14	C13	109.2°	109.5°
C14	C20	H5	109.2°	109.4°
C14	C20	H6	109.2°	109.5°
C20	C14	H11	109.5°	109.5°
C20	C14	H12	109.5°	109.5°
C12	C13	C14	110.6°	109.5°
C12	C13	H16	109.2°	109.5°
C12	C13	H17	109.2°	109.5°
C13	C12	H73	109.1°	109.5°
C13	C12	H74	109.1°	109.4°
C13	C14	H11	109.6°	109.5°
C13	C14	H12	109.5°	109.5°
C14	C13	H16	109.2°	109.5°
C14	C13	H17	109.2°	109.5°
CAH	CAI	CAJ	108.3°	109.5°
CAI	CAH	H48	109.3°	109.5°
CAI	CAH	H49	109.3°	109.5°
CAH	CAI	H50	109.8°	109.4°
CAH	CAI	H51	109.8°	109.5°
CAI	CAJ	CAK	110.1°	109.5°
CAJ	CAI	H50	109.8°	109.5°
CAJ	CAI	H51	109.8°	109.5°
CAI	CAJ	H52	109.3°	109.5°
CAI	CAJ	H53	109.3°	109.5°
CAJ	CAK	CAL	110.1°	109.5°
CAK	CAJ	H52	109.3°	109.5°
CAK	CAJ	H53	109.3°	109.5°
CAJ	CAK	H54	109.3°	109.5°
CAJ	CAK	H55	109.3°	109.5°
CAK	CAL	C16	110.0°	109.5°
CAL	CAK	H54	109.3°	109.4°
CAL	CAK	H55	109.3°	109.5°
CAK	CAL	H56	109.3°	109.5°
CAK	CAL	H57	109.4°	109.5°
CAL	C16	C15	110.2°	109.5°
CAL	C16	H3	109.3°	109.5°
CAL	C16	H4	109.3°	109.5°
C16	CAL	H56	109.3°	109.5°
C16	CAL	H57	109.4°	109.5°
C16	C15	C17	110.6°	109.5°
C15	C16	H3	109.3°	109.4°
C15	C16	H4	109.3°	109.4°
C16	C15	H7	109.2°	109.4°
C16	C15	H8	109.2°	109.4°
C15	C17	C18	109.0°	109.4°
C17	C15	H7	109.2°	109.5°
C17	C15	H8	109.2°	109.5°
C15	C17	H9	109.6°	109.5°
C15	C17	H10	109.6°	109.5°
C17	C18	C19	109.9°	109.5°
C18	C17	H9	109.6°	109.5°
C18	C17	H10	109.6°	109.4°
C17	C18	H75	109.4°	109.5°
C17	C18	H76	109.3°	109.4°
C18	C19	H13	109.5°	109.5°
C18	C19	H14	109.5°	109.5°
C18	C19	H15	109.5°	109.5°
C19	C18	H75	109.4°	109.5°
C19	C18	H76	109.4°	109.5°
H1	C21	H2	109.5°	109.4°
H3	C16	H4	109.5°	109.5°
H5	C20	H6	109.4°	109.5°
H7	C15	H8	109.5°	109.5°
H9	C17	H10	109.5°	109.5°
H11	C14	H12	109.5°	109.4°
H13	C19	H14	109.5°	109.5°
H13	C19	H15	109.5°	109.4°
H14	C19	H15	109.5°	109.4°
H16	C13	H17	109.5°	109.4°
H18	C9	H19	109.5°	109.4°
H20	C11	H21	109.5°	109.4°
H22	C8	H23	109.5°	109.4°
H24	C7	H25	109.5°	109.5°
H26	C5	H27	109.5°	109.4°
H28	C6	H29	109.5°	109.4°
H30	C4	H31	109.5°	109.5°
H32	C1	H33	109.5°	109.5°
H36	CAB	H37	109.5°	109.5°
H40	CAD	H41	109.5°	109.5°
H42	CAE	H43	109.5°	109.5°
H44	CAF	H45	109.5°	109.5°
H46	CAG	H47	109.5°	109.5°
H48	CAH	H49	109.5°	109.5°
H50	CAI	H51	109.4°	109.5°
H52	CAJ	H53	109.5°	109.5°
H54	CAK	H55	109.4°	109.5°
H56	CAL	H57	109.5°	109.5°
H67	C6A	H68	109.5°	109.4°
H71	C10	H72	109.5°	109.4°
H73	C12	H74	109.5°	109.5°
H75	C18	H76	109.5°	109.5°
H77	C22	H78	109.5°	109.5°
H77	C22	H79	109.5°	109.4°
H78	C22	H79	109.5°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O4A	C4A	C3A	O3A	54.8°	56.9°
O4A	C4A	C3A	C5M	122.7°	119.9°
O4A	C4A	C3A	H64	119.8°	120.2°
O4A	C4A	C5M	H64	120.5°	120.2°
O4A	C4A	C3A	C2A	67.5°	62.9°
O4A	C4A	C5M	C6A	52.7°	57.7°
O4A	C4A	C5M	O5A	70.3°	62.3°
O4A	C4A	C3A	H62	174.2°	177.2°
O4A	C4A	C5M	H66	171.0°	177.7°
O3A	C3A	C4A	C2A	122.3°	119.8°
O3A	C3A	C4A	H62	119.4°	120.3°
O3A	C3A	C4A	C5M	177.5°	176.9°
O3A	C3A	C2A	H62	118.7°	120.2°
O3A	C3A	C2A	O2A	57.3°	63.2°
O3A	C3A	C2A	C1A	179.2°	176.9°
O3A	C3A	C2A	H60	62.5°	57.0°
O3A	C3A	C4A	H64	65.0°	63.2°
C3A	C4A	C5M	H64	117.6°	119.9°
C4A	C3A	C2A	H62	118.2°	119.9°
C4A	C3A	C2A	O2A	179.6°	176.8°
C4A	C3A	C2A	C1A	57.7°	57.0°
C3A	C4A	C5M	C6A	174.5°	177.6°
C3A	C4A	C5M	O5A	51.5°	57.6°
C4A	C3A	C2A	H60	60.6°	62.9°
C4A	C3A	O3A	H63	180.0°	179.6°
C3A	C4A	O4A	H65	180.0°	60.0°
C3A	C4A	C5M	H66	67.2°	62.4°
C5M	C4A	C3A	C2A	55.1°	57.0°
C4A	C5M	C6A	O5A	123.6°	119.9°
C4A	C5M	C6A	H66	118.2°	120.0°
C4A	C5M	C6A	O6A	81.7°	175.0°
C4A	C5M	O5A	H66	118.0°	120.0°
C4A	C5M	O5A	C1A	54.9°	61.2°
C5M	C4A	C3A	H62	63.1°	62.8°
C5M	C4A	O4A	H65	58.8°	179.7°
C4A	C5M	C6A	H67	38.3°	55.0°
C4A	C5M	C6A	H68	158.3°	65.0°
C3A	C2A	O2A	C1A	121.5°	119.6°
C3A	C2A	O2A	H60	119.0°	120.2°
C3A	C2A	C1A	H60	118.2°	119.9°
C3A	C2A	C1A	O5A	55.0°	57.6°
C3A	C2A	C1A	O1A	68.5°	62.4°
C3A	C2A	C1A	H59	172.9°	177.6°
C3A	C2A	O2A	H61	180.0°	180.0°
C2A	C3A	O3A	H63	56.3°	60.0°
C2A	C3A	C4A	H64	172.7°	176.9°
O2A	C2A	C1A	H60	120.2°	120.2°
O2A	C2A	C1A	O5A	176.6°	177.5°
O2A	C2A	C1A	O1A	53.0°	57.5°
O2A	C2A	C1A	H59	65.5°	62.5°
O2A	C2A	C3A	H62	61.4°	57.0°
C2A	C1A	O5A	C5M	56.2°	61.1°
C2A	C1A	O5A	O1A	121.7°	120.0°
C2A	C1A	O5A	H59	117.4°	120.0°
C2A	C1A	O1A	H59	117.7°	120.0°
C2A	C1A	O1A	C1	165.8°	170.0°
C1A	C2A	O2A	H61	58.5°	60.4°
C1A	C2A	C3A	H62	60.5°	62.9°
C5M	C6A	O6A	H67	119.9°	120.0°
C5M	C6A	O6A	H68	120.0°	120.0°
C6A	C5M	O5A	H66	117.7°	120.0°
C6A	C5M	O5A	C1A	179.2°	178.9°
C6A	C5M	C4A	H64	67.8°	62.5°
C5M	C6A	H67	H68	120.2°	120.0°
C5M	C6A	O6A	H69	180.0°	180.0°
O6A	C6A	C5M	O5A	154.7°	65.1°
O6A	C6A	C5M	H66	36.5°	54.9°
O6A	C6A	H67	H68	120.2°	120.0°
C5M	O5A	C1A	O1A	65.6°	58.8°
C5M	O5A	C1A	H59	173.6°	178.9°
O5A	C5M	C4A	H64	169.1°	177.5°
O5A	C5M	C6A	H67	85.4°	175.0°
O5A	C5M	C6A	H68	34.7°	55.0°
O5A	C1A	O1A	H59	120.6°	120.1°
O5A	C1A	O1A	C1	72.6°	70.0°
O5A	C1A	C2A	H60	63.2°	62.3°
C1A	O5A	C5M	H66	63.1°	58.8°
C1A	O1A	C1	C2	171.6°	180.0°
C1A	O1A	C1	H32	51.5°	60.0°
C1A	O1A	C1	H33	68.4°	60.0°
O1A	C1A	C2A	H60	173.2°	177.7°
O1A	C1	C2	H32	120.0°	120.0°
O1A	C1	C2	H33	120.1°	120.0°
O1A	C1	C2	N2	46.0°	64.5°
O1A	C1	C2	C3	77.2°	55.6°
O1A	C1	H32	H33	119.9°	120.0°
O1A	C1	C2	H35	164.4°	175.6°
C1	O1A	C1A	H59	48.0°	50.0°
C1	C2	C3	O3	48.4°	57.9°
C1	C2	N2	C3	123.6°	120.1°
C1	C2	N2	H35	117.9°	120.0°
C1	C2	N2	CAA	82.0°	85.0°
C1	C2	C3	H35	118.4°	120.0°
C1	C2	C3	C4	168.2°	178.0°
C2	C1	H32	H33	119.9°	120.0°
C1	C2	C3	H34	72.3°	62.0°
C1	C2	N2	H58	98.0°	95.1°
O3	C3	C2	N2	170.9°	178.0°
O3	C3	C2	C4	119.8°	120.0°
O3	C3	C2	H34	120.7°	120.0°
O3	C3	C4	H34	119.8°	120.0°
O3	C3	C4	C5	67.9°	65.0°
O3	C3	C4	H30	171.7°	55.0°
O3	C3	C4	H31	52.4°	175.0°
O3	C3	C2	H35	70.0°	62.1°
C2	N2	CAA	H58	180.0°	179.9°
N2	C2	C3	H35	119.1°	119.9°
N2	C2	C3	C4	69.2°	62.0°
C2	N2	CAA	CAB	179.4°	180.0°
C2	N2	CAA	OAA	2.3°	0.0°
N2	C2	C1	H32	74.0°	175.5°
N2	C2	C1	H33	166.1°	55.5°
N2	C2	C3	H34	50.2°	58.0°
CAA	N2	C2	C3	154.4°	155.0°
N2	CAA	CAB	OAA	178.4°	180.0°
N2	CAA	CAB	CAC	129.5°	180.0°
CAA	N2	C2	H35	35.9°	35.0°
N2	CAA	CAB	H36	9.4°	60.1°
N2	CAA	CAB	H37	110.3°	60.0°
C2	C3	C4	H34	119.4°	120.0°
C2	C3	C4	C5	171.3°	175.0°
C2	C3	C4	H30	50.9°	65.0°
C2	C3	C4	H31	68.3°	55.0°
C3	C2	C1	H32	162.8°	64.4°
C3	C2	C1	H33	42.9°	175.6°
C3	C2	N2	H58	25.6°	25.0°
C2	C3	O3	H70	180.0°	55.2°
C3	C4	C5	H30	120.4°	120.0°
C3	C4	C5	H31	120.4°	120.0°
C3	C4	C5	C6	146.2°	180.0°
C3	C4	C5	H26	93.7°	60.0°
C3	C4	C5	H27	26.2°	60.0°
C3	C4	H30	H31	118.8°	120.0°
C4	C3	C2	H35	49.8°	58.0°
C4	C3	O3	H70	58.7°	64.8°
CAA	CAB	CAC	H36	120.2°	120.0°
CAA	CAB	CAC	H37	120.1°	120.0°
CAA	CAB	CAC	O4	147.5°	65.0°
CAA	CAB	CAC	CAD	91.0°	175.0°
CAA	CAB	H36	H37	119.6°	120.1°
CAA	CAB	CAC	H38	28.0°	55.0°
CAB	CAA	N2	H58	0.6°	0.1°
CAC	CAB	CAA	OAA	52.1°	0.0°
CAB	CAC	O4	CAD	121.0°	120.0°
CAB	CAC	O4	H38	118.6°	120.1°
CAB	CAC	CAD	H38	119.0°	120.0°
CAB	CAC	CAD	CAE	172.6°	175.0°
CAC	CAB	H36	H37	119.5°	120.0°
CAB	CAC	O4	H39	180.0°	60.0°
CAB	CAC	CAD	H40	67.1°	55.0°
CAB	CAC	CAD	H41	52.3°	65.0°
OAA	CAA	CAB	H36	172.2°	120.0°
OAA	CAA	CAB	H37	68.1°	120.0°
OAA	CAA	N2	H58	177.7°	180.0°
O4	CAC	CAD	H38	121.1°	120.0°
O4	CAC	CAD	CAE	52.7°	65.0°
O4	CAC	CAB	H36	92.4°	175.0°
O4	CAC	CAB	H37	27.3°	55.0°
O4	CAC	CAD	H40	173.0°	175.0°
O4	CAC	CAD	H41	67.6°	55.0°
CAC	CAD	CAE	H40	120.3°	120.0°
CAC	CAD	CAE	H41	120.3°	120.0°
CAC	CAD	CAE	CAF	129.3°	180.0°
CAD	CAC	CAB	H36	29.2°	55.0°
CAD	CAC	CAB	H37	148.9°	65.0°
CAD	CAC	O4	H39	58.9°	60.0°
CAC	CAD	H40	H41	119.0°	120.0°
CAC	CAD	CAE	H42	110.6°	60.0°
CAC	CAD	CAE	H43	9.1°	60.0°
C4	C5	C6	H26	120.0°	120.1°
C4	C5	C6	H27	120.1°	120.0°
C4	C5	C6	C7	142.6°	180.0°
C4	C5	H26	H27	119.8°	120.0°
C4	C5	C6	H28	97.4°	59.9°
C4	C5	C6	H29	22.6°	60.0°
C5	C4	H30	H31	118.8°	120.0°
C5	C4	C3	H34	51.9°	55.0°
C5	C6	C7	H28	120.0°	120.0°
C5	C6	C7	H29	120.0°	120.0°
C5	C6	C7	C8	171.3°	180.0°
C5	C6	C7	H24	68.6°	60.0°
C5	C6	C7	H25	51.2°	60.0°
C6	C5	H26	H27	119.8°	120.0°
C5	C6	H28	H29	120.0°	120.0°
C6	C5	C4	H30	25.9°	60.0°
C6	C5	C4	H31	93.4°	60.1°
CAD	CAE	CAF	H42	120.2°	120.0°
CAD	CAE	CAF	H43	120.2°	120.0°
CAD	CAE	CAF	CAG	99.3°	180.0°
CAE	CAD	CAC	H38	68.4°	55.0°
CAE	CAD	H40	H41	119.0°	120.0°
CAD	CAE	H42	H43	119.5°	120.0°
CAD	CAE	CAF	H44	140.5°	60.0°
CAD	CAE	CAF	H45	21.0°	60.0°
C6	C7	C8	H24	120.1°	120.0°
C6	C7	C8	H25	120.1°	120.0°
C6	C7	C8	C9	160.9°	180.0°
C6	C7	C8	H22	79.0°	60.0°
C6	C7	C8	H23	40.9°	60.0°
C6	C7	H24	H25	119.7°	120.0°
C7	C6	C5	H26	22.6°	59.9°
C7	C6	C5	H27	97.3°	60.0°
C7	C6	H28	H29	120.0°	120.0°
C7	C8	C9	H22	120.1°	120.0°
C7	C8	C9	H23	120.1°	120.0°
C7	C8	C9	C10	122.7°	180.0°
C7	C8	C9	H18	117.0°	60.0°
C7	C8	C9	H19	2.4°	60.0°
C7	C8	H22	H23	119.8°	120.0°
C8	C7	H24	H25	119.7°	120.1°
C8	C7	C6	H28	51.3°	60.0°
C8	C7	C6	H29	68.7°	60.0°
CAE	CAF	CAG	H44	120.2°	120.0°
CAE	CAF	CAG	H45	120.2°	120.0°
CAE	CAF	CAG	CAH	118.3°	180.0°
CAF	CAE	CAD	H40	8.9°	60.0°
CAF	CAE	CAD	H41	110.4°	60.0°
CAF	CAE	H42	H43	119.5°	120.0°
CAE	CAF	H44	H45	119.3°	120.0°
CAE	CAF	CAG	H46	121.7°	60.0°
CAE	CAF	CAG	H47	1.6°	60.0°
C8	C9	C10	H18	120.3°	120.0°
C8	C9	C10	H19	120.3°	120.0°
C8	C9	C10	C11	129.2°	180.0°
C8	C9	H18	H19	119.1°	120.0°
C9	C8	H22	H23	119.8°	120.0°
C9	C8	C7	H24	40.8°	60.0°
C9	C8	C7	H25	78.9°	60.0°
C8	C9	C10	H71	9.3°	60.0°
C8	C9	C10	H72	110.8°	60.0°
CAF	CAG	CAH	H46	120.0°	120.0°
CAF	CAG	CAH	H47	120.0°	120.0°
CAF	CAG	CAH	CAI	108.0°	180.0°
CAG	CAF	CAE	H42	20.9°	60.0°
CAG	CAF	CAE	H43	140.6°	60.0°
CAG	CAF	H44	H45	119.3°	120.0°
CAF	CAG	H46	H47	120.1°	120.0°
CAF	CAG	CAH	H48	131.9°	60.0°
CAF	CAG	CAH	H49	12.1°	60.0°
C9	C10	C11	H71	119.9°	120.0°
C9	C10	C11	H72	119.9°	120.0°
C9	C10	C11	C12	133.7°	180.0°
C10	C9	H18	H19	119.1°	119.9°
C9	C10	C11	H20	13.6°	60.0°
C9	C10	C11	H21	106.1°	60.0°
C10	C9	C8	H22	2.7°	60.0°
C10	C9	C8	H23	117.2°	60.0°
C9	C10	H71	H72	120.2°	119.9°
C10	C11	C12	H20	120.1°	120.0°
C10	C11	C12	H21	120.1°	120.1°
C10	C11	C12	C13	146.1°	180.0°
C11	C10	C9	H18	110.4°	60.0°
C11	C10	C9	H19	8.9°	59.9°
C10	C11	H20	H21	119.6°	120.0°
C11	C10	H71	H72	120.2°	120.0°
C10	C11	C12	H73	25.8°	60.0°
C10	C11	C12	H74	93.7°	60.1°
CAG	CAH	CAI	H48	120.1°	120.0°
CAG	CAH	CAI	H49	120.1°	120.0°
CAG	CAH	CAI	CAJ	160.4°	180.0°
CAH	CAG	CAF	H44	1.9°	60.0°
CAH	CAG	CAF	H45	121.5°	60.0°
CAH	CAG	H46	H47	120.1°	120.0°
CAG	CAH	H48	H49	119.7°	120.0°
CAG	CAH	CAI	H50	40.6°	60.0°
CAG	CAH	CAI	H51	79.8°	60.0°
C11	C12	C13	H73	120.2°	120.0°
C11	C12	C13	H74	120.2°	120.0°
C11	C12	C13	C14	103.8°	180.0°
C11	C12	C13	H16	16.3°	60.0°
C11	C12	C13	H17	136.0°	60.0°
C12	C11	H20	H21	119.6°	120.0°
C12	C11	C10	H71	106.3°	60.0°
C12	C11	C10	H72	13.8°	60.0°
C11	C12	H73	H74	119.3°	120.0°
C20	C21	C22	H1	120.1°	120.0°
C20	C21	C22	H2	120.1°	120.0°
C21	C20	C14	H5	120.2°	120.0°
C21	C20	C14	H6	120.2°	120.0°
C21	C20	C14	C13	114.2°	180.0°
C20	C21	H1	H2	119.8°	120.0°
C21	C20	H5	H6	119.5°	120.1°
C21	C20	C14	H11	5.7°	60.0°
C21	C20	C14	H12	125.8°	60.0°
C20	C21	C22	H77	180.0°	60.0°
C20	C21	C22	H78	60.0°	180.0°
C20	C21	C22	H79	60.0°	60.0°
C22	C21	C20	C14	115.5°	179.9°
C22	C21	H1	H2	119.8°	120.0°
C22	C21	C20	H5	4.7°	60.0°
C22	C21	C20	H6	124.4°	60.1°
C21	C22	H77	H78	120.0°	120.0°
C21	C22	H77	H79	120.0°	120.0°
C21	C22	H78	H79	120.0°	120.0°
C20	C14	C13	C12	147.0°	180.0°
C20	C14	C13	H11	119.9°	120.0°
C20	C14	C13	H12	119.9°	120.0°
C14	C20	C21	H1	4.6°	60.0°
C14	C20	C21	H2	124.5°	60.0°
C14	C20	H5	H6	119.5°	120.0°
C20	C14	H11	H12	120.1°	120.0°
C20	C14	C13	H16	26.8°	60.0°
C20	C14	C13	H17	92.8°	60.0°
C12	C13	C14	H16	120.2°	120.0°
C12	C13	C14	H17	120.2°	120.0°
C12	C13	C14	H11	27.0°	60.0°
C12	C13	C14	H12	93.1°	60.0°
C12	C13	H16	H17	119.5°	120.0°
C13	C12	C11	H20	93.8°	60.0°
C13	C12	C11	H21	25.9°	59.9°
C13	C12	H73	H74	119.3°	120.0°
C13	C14	C20	H5	125.6°	60.0°
C13	C14	C20	H6	6.0°	60.0°
C13	C14	H11	H12	120.1°	120.0°
C14	C13	H16	H17	119.5°	120.0°
C14	C13	C12	H73	135.9°	60.0°
C14	C13	C12	H74	16.4°	60.0°
CAH	CAI	CAJ	H50	119.8°	120.0°
CAH	CAI	CAJ	H51	119.8°	120.0°
CAH	CAI	CAJ	CAK	166.5°	180.0°
CAI	CAH	CAG	H46	12.0°	60.0°
CAI	CAH	CAG	H47	132.0°	60.0°
CAI	CAH	H48	H49	119.7°	120.0°
CAH	CAI	H50	H51	120.5°	120.0°
CAH	CAI	CAJ	H52	73.4°	60.0°
CAH	CAI	CAJ	H53	46.4°	60.0°
CAI	CAJ	CAK	H52	120.1°	120.0°
CAI	CAJ	CAK	H53	120.1°	120.0°
CAI	CAJ	CAK	CAL	140.9°	NaN°
CAJ	CAI	CAH	H48	79.5°	60.0°
CAJ	CAI	CAH	H49	40.3°	60.0°
CAJ	CAI	H50	H51	120.6°	120.0°
CAI	CAJ	H52	H53	119.7°	120.0°
CAI	CAJ	CAK	H54	20.8°	60.0°
CAI	CAJ	CAK	H55	99.0°	60.0°
CAJ	CAK	CAL	H54	120.1°	120.0°
CAJ	CAK	CAL	H55	120.1°	120.0°
CAJ	CAK	CAL	C16	88.0°	180.0°
CAK	CAJ	CAI	H50	46.6°	60.0°
CAK	CAJ	CAI	H51	73.7°	60.0°
CAK	CAJ	H52	H53	119.8°	120.0°
CAJ	CAK	H54	H55	119.7°	120.0°
CAJ	CAK	CAL	H56	151.9°	60.0°
CAJ	CAK	CAL	H57	32.1°	60.0°
CAK	CAL	C16	H56	120.1°	120.0°
CAK	CAL	C16	H57	120.1°	120.0°
CAK	CAL	C16	C15	173.4°	180.0°
CAK	CAL	C16	H3	66.5°	60.0°
CAK	CAL	C16	H4	53.3°	60.0°
CAL	CAK	CAJ	H52	99.0°	60.0°
CAL	CAK	CAJ	H53	20.8°	60.0°
CAL	CAK	H54	H55	119.7°	120.0°
CAK	CAL	H56	H57	119.8°	120.0°
CAL	C16	C15	H3	120.1°	120.1°
CAL	C16	C15	H4	120.1°	120.0°
CAL	C16	C15	C17	106.4°	180.0°
CAL	C16	H3	H4	119.6°	120.0°
CAL	C16	C15	H7	133.5°	60.0°
CAL	C16	C15	H8	13.8°	60.0°
C16	CAL	CAK	H54	32.1°	60.0°
C16	CAL	CAK	H55	151.9°	60.0°
C16	CAL	H56	H57	119.8°	120.0°
C16	C15	C17	H7	120.2°	120.0°
C16	C15	C17	H8	120.2°	119.9°
C16	C15	C17	C18	114.3°	180.0°
C15	C16	H3	H4	119.7°	119.9°
C16	C15	H7	H8	119.5°	120.0°
C16	C15	C17	H9	5.6°	60.0°
C16	C15	C17	H10	125.8°	60.0°
C15	C16	CAL	H56	53.3°	60.0°
C15	C16	CAL	H57	66.5°	60.0°
C15	C17	C18	H9	119.9°	120.0°
C15	C17	C18	H10	119.9°	120.0°
C15	C17	C18	C19	110.8°	180.0°
C17	C15	C16	H3	13.7°	60.0°
C17	C15	C16	H4	133.5°	60.0°
C17	C15	H7	H8	119.5°	120.0°
C15	C17	H9	H10	120.2°	120.0°
C15	C17	C18	H75	9.2°	60.0°
C15	C17	C18	H76	129.1°	60.0°
C17	C18	C19	H75	120.1°	120.0°
C17	C18	C19	H76	120.0°	120.0°
C18	C17	C15	H7	125.5°	60.0°
C18	C17	C15	H8	5.8°	60.1°
C18	C17	H9	H10	120.2°	120.0°
C17	C18	C19	H13	180.0°	60.0°
C17	C18	C19	H14	60.0°	179.9°
C17	C18	C19	H15	60.0°	60.0°
C17	C18	H75	H76	119.8°	120.0°
C19	C18	C17	H9	129.2°	60.0°
C19	C18	C17	H10	9.1°	60.0°
C18	C19	H13	H14	120.0°	120.1°
C18	C19	H13	H15	120.0°	120.0°
C18	C19	H14	H15	120.0°	120.0°
C19	C18	H75	H76	119.8°	120.0°
H1	C21	C20	H5	124.8°	60.0°
H1	C21	C20	H6	115.6°	180.0°
H1	C21	C22	H77	59.9°	60.0°
H1	C21	C22	H78	179.9°	60.1°
H1	C21	C22	H79	60.1°	180.0°
H2	C21	C20	H5	115.4°	179.9°
H2	C21	C20	H6	4.3°	60.0°
H2	C21	C22	H77	60.0°	180.0°
H2	C21	C22	H78	60.1°	59.9°
H2	C21	C22	H79	180.0°	60.0°
H3	C16	C15	H7	106.4°	60.1°
H3	C16	C15	H8	133.9°	179.9°
H3	C16	CAL	H56	173.4°	179.9°
H3	C16	CAL	H57	53.6°	60.0°
H4	C16	C15	H7	13.4°	180.0°
H4	C16	C15	H8	106.3°	60.0°
H4	C16	CAL	H56	66.8°	60.0°
H4	C16	CAL	H57	173.4°	180.0°
H5	C20	C14	H11	114.4°	180.0°
H5	C20	C14	H12	5.7°	60.0°
H6	C20	C14	H11	125.9°	60.0°
H6	C20	C14	H12	114.0°	180.0°
H7	C15	C17	H9	114.6°	180.0°
H7	C15	C17	H10	5.6°	60.0°
H8	C15	C17	H9	125.8°	59.9°
H8	C15	C17	H10	114.1°	180.0°
H9	C17	C18	H75	110.7°	180.0°
H9	C17	C18	H76	9.2°	60.0°
H10	C17	C18	H75	129.1°	60.0°
H10	C17	C18	H76	111.0°	180.0°
H11	C14	C13	H16	93.1°	180.0°
H11	C14	C13	H17	147.2°	60.0°
H12	C14	C13	H16	146.8°	60.0°
H12	C14	C13	H17	27.1°	180.0°
H13	C19	H14	H15	120.0°	119.9°
H13	C19	C18	H75	59.9°	60.0°
H13	C19	C18	H76	60.0°	180.0°
H14	C19	C18	H75	179.9°	60.1°
H14	C19	C18	H76	60.0°	60.0°
H15	C19	C18	H75	60.1°	180.0°
H15	C19	C18	H76	180.0°	60.0°
H16	C13	C12	H73	103.9°	180.0°
H16	C13	C12	H74	136.5°	60.0°
H17	C13	C12	H73	15.8°	60.0°
H17	C13	C12	H74	103.8°	180.0°
H18	C9	C8	H22	123.0°	60.0°
H18	C9	C8	H23	3.1°	180.0°
H18	C9	C10	H71	129.6°	180.0°
H18	C9	C10	H72	9.5°	60.1°
H19	C9	C8	H22	117.6°	180.0°
H19	C9	C8	H23	122.5°	60.0°
H19	C9	C10	H71	111.0°	60.1°
H19	C9	C10	H72	128.9°	NaN°
H20	C11	C10	H71	133.5°	180.0°
H20	C11	C10	H72	106.3°	60.0°
H20	C11	C12	H73	146.0°	60.0°
H20	C11	C12	H74	26.5°	180.0°
H21	C11	C10	H71	13.8°	60.0°
H21	C11	C10	H72	133.9°	180.0°
H21	C11	C12	H73	94.3°	179.9°
H21	C11	C12	H74	146.2°	60.0°
H22	C8	C7	H24	160.9°	179.9°
H22	C8	C7	H25	41.1°	60.0°
H23	C8	C7	H24	79.2°	60.0°
H23	C8	C7	H25	161.0°	180.0°
H24	C7	C6	H28	171.4°	180.0°
H24	C7	C6	H29	51.4°	60.0°
H25	C7	C6	H28	68.8°	60.0°
H25	C7	C6	H29	171.2°	180.0°
H26	C5	C6	H28	142.5°	180.0°
H26	C5	C6	H29	97.4°	60.0°
H26	C5	C4	H30	145.9°	180.0°
H26	C5	C4	H31	26.7°	60.0°
H27	C5	C6	H28	22.6°	60.0°
H27	C5	C6	H29	142.7°	180.0°
H27	C5	C4	H30	94.2°	60.0°
H27	C5	C4	H31	146.6°	180.0°
H30	C4	C3	H34	68.5°	174.9°
H31	C4	C3	H34	172.3°	65.0°
H32	C1	C2	H35	44.4°	55.6°
H33	C1	C2	H35	75.5°	64.4°
H34	C3	C2	H35	169.3°	177.9°
H34	C3	O3	H70	60.3°	175.2°
H35	C2	N2	H58	144.1°	145.0°
H36	CAB	CAC	H38	148.1°	64.9°
H37	CAB	CAC	H38	92.2°	175.1°
H38	CAC	O4	H39	61.4°	180.0°
H38	CAC	CAD	H40	51.9°	65.0°
H38	CAC	CAD	H41	171.2°	175.0°
H40	CAD	CAE	H42	129.1°	180.0°
H40	CAD	CAE	H43	111.2°	59.9°
H41	CAD	CAE	H42	9.7°	60.0°
H41	CAD	CAE	H43	129.4°	179.9°
H42	CAE	CAF	H44	99.3°	180.0°
H42	CAE	CAF	H45	141.1°	60.0°
H43	CAE	CAF	H44	20.3°	59.9°
H43	CAE	CAF	H45	99.2°	180.0°
H44	CAF	CAG	H46	118.1°	180.0°
H44	CAF	CAG	H47	121.8°	59.9°
H45	CAF	CAG	H46	1.5°	60.0°
H45	CAF	CAG	H47	118.6°	179.9°
H46	CAG	CAH	H48	108.1°	180.0°
H46	CAG	CAH	H49	132.1°	60.0°
H47	CAG	CAH	H48	12.0°	59.9°
H47	CAG	CAH	H49	107.9°	180.0°
H48	CAH	CAI	H50	160.6°	180.0°
H48	CAH	CAI	H51	40.3°	60.0°
H49	CAH	CAI	H50	79.5°	60.0°
H49	CAH	CAI	H51	160.2°	180.0°
H50	CAI	CAJ	H52	166.7°	180.0°
H50	CAI	CAJ	H53	73.4°	60.0°
H51	CAI	CAJ	H52	46.4°	60.0°
H51	CAI	CAJ	H53	166.2°	180.0°
H52	CAJ	CAK	H54	140.9°	180.0°
H52	CAJ	CAK	H55	21.1°	60.0°
H53	CAJ	CAK	H54	99.3°	60.0°
H53	CAJ	CAK	H55	140.9°	180.0°
H54	CAK	CAL	H56	87.9°	60.0°
H54	CAK	CAL	H57	152.2°	180.0°
H55	CAK	CAL	H56	31.9°	180.0°
H55	CAK	CAL	H57	88.0°	60.0°
H59	C1A	C2A	H60	54.7°	57.7°
H60	C2A	O2A	H61	61.0°	59.8°
H60	C2A	C3A	H62	178.8°	177.3°
H62	C3A	O3A	H63	61.5°	60.2°
H62	C3A	C4A	H64	54.4°	57.0°
H64	C4A	O4A	H65	60.9°	60.2°
H64	C4A	C5M	H66	50.5°	57.5°
H66	C5M	C6A	H67	156.4°	65.0°
H66	C5M	C6A	H68	83.5°	175.0°
H67	C6A	O6A	H69	60.1°	60.0°
H68	C6A	O6A	H69	60.0°	60.0°
H77	C22	H78	H79	120.0°	120.0°

Release date:	2021-11-10
Definition date:	2020-07-17
Last modified:	2021-11-05
Release status:	REL
Processing site:	RCSB
Derived from:	6XNG