EQQ

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C33	C32	doub	0.00Å	1.36Å	Aromatic
C33	C34	sing	0.00Å	1.49Å	Aromatic
C32	C31	sing	0.00Å	1.49Å	Aromatic
N35	C34	doub	0.00Å	1.30Å	Aromatic
N35	C36	sing	0.00Å	1.44Å	Aromatic
C34	C38	sing	0.00Å	1.44Å	Aromatic
C36	C37	doub	0.00Å	1.34Å	Aromatic
C31	N29	doub	0.00Å	1.30Å	Aromatic
C31	C30	sing	0.00Å	1.44Å	Aromatic
N29	C28	sing	0.00Å	1.45Å	Aromatic
C38	C30	sing	0.00Å	1.34Å	Aromatic
C38	N39	doub	0.00Å	1.40Å	Aromatic
C30	N26	doub	0.00Å	1.39Å	Aromatic
C37	N39	sing	0.00Å	1.41Å	Aromatic
N39	RU	sing	0.00Å	2.01Å
C28	C27	doub	0.00Å	1.34Å	Aromatic
C53	C52	doub	0.00Å	1.35Å	Aromatic
C53	N50	sing	0.00Å	1.42Å	Aromatic
C52	N51	sing	0.00Å	1.45Å	Aromatic
N26	C27	sing	0.00Å	1.41Å	Aromatic
N26	RU	sing	0.00Å	2.00Å
N50	RU	sing	0.00Å	2.03Å
N50	C49	doub	0.00Å	1.39Å	Aromatic
N51	C48	doub	0.00Å	1.30Å	Aromatic
RU	N22	sing	0.00Å	2.00Å
RU	N17	sing	0.00Å	2.00Å
RU	N40	sing	0.00Å	1.99Å
C23	N22	doub	0.00Å	1.41Å	Aromatic
C23	C24	sing	0.00Å	1.33Å	Aromatic
N22	C19	sing	0.00Å	1.40Å	Aromatic
C49	C48	sing	0.00Å	1.44Å	Aromatic
C49	C45	sing	0.00Å	1.34Å	Aromatic
C48	C47	sing	0.00Å	1.49Å	Aromatic
C24	C25	doub	0.00Å	1.50Å	Aromatic
N17	C16	doub	0.00Å	1.41Å	Aromatic
N17	C18	sing	0.00Å	1.40Å	Aromatic
C16	C15	sing	0.00Å	1.34Å	Aromatic
C19	C18	doub	0.00Å	1.40Å	Aromatic
C19	C20	sing	0.00Å	1.37Å	Aromatic
C18	C13	sing	0.00Å	1.37Å	Aromatic
N40	C45	doub	0.00Å	1.38Å	Aromatic
N40	C41	sing	0.00Å	1.41Å	Aromatic
C25	C20	sing	0.00Å	1.35Å	Aromatic
C45	C44	sing	0.00Å	1.44Å	Aromatic
C47	C46	doub	0.00Å	1.36Å	Aromatic
C20	C11	doub	0.00Å	1.39Å	Aromatic
C15	C14	doub	0.00Å	1.50Å	Aromatic
C13	C14	sing	0.00Å	1.35Å	Aromatic
C13	C10	doub	0.00Å	1.40Å	Aromatic
C41	C42	doub	0.00Å	1.34Å	Aromatic
C11	C10	sing	0.00Å	1.44Å	Aromatic
C11	N12	sing	0.00Å	1.35Å	Aromatic
C44	C46	sing	0.00Å	1.49Å	Aromatic
C44	N43	doub	0.00Å	1.30Å	Aromatic
C10	N09	sing	0.00Å	1.35Å	Aromatic
N12	C08	doub	0.00Å	1.35Å	Aromatic
C42	N43	sing	0.00Å	1.44Å	Aromatic
N09	C07	doub	0.00Å	1.35Å	Aromatic
C08	C07	sing	0.00Å	1.41Å	Aromatic
C08	C05	sing	0.00Å	1.48Å	Aromatic
C07	C06	sing	0.00Å	1.45Å	Aromatic
C05	C04	doub	0.00Å	1.34Å	Aromatic
C06	C03	doub	0.00Å	1.33Å	Aromatic
C04	C03	sing	0.00Å	1.49Å	Aromatic
C04	C54	sing	0.00Å	1.44Å
C03	C02	sing	0.00Å	1.43Å
C54	N55	trip	0.00Å	1.16Å
C02	N01	trip	0.00Å	1.15Å
C05	H1	sing	0.00Å	1.08Å
C06	H2	sing	0.00Å	1.08Å
C14	H3	sing	0.00Å	1.08Å
C15	H4	sing	0.00Å	1.08Å
C16	H5	sing	0.00Å	1.08Å
C23	H6	sing	0.00Å	1.08Å
C24	H7	sing	0.00Å	1.08Å
C25	H8	sing	0.00Å	1.08Å
C27	H9	sing	0.00Å	1.08Å
C28	H10	sing	0.00Å	1.08Å
C32	H11	sing	0.00Å	1.08Å
C33	H12	sing	0.00Å	1.08Å
C36	H13	sing	0.00Å	1.08Å
C37	H14	sing	0.00Å	1.08Å
C41	H15	sing	0.00Å	1.08Å
C42	H16	sing	0.00Å	1.08Å
C46	H17	sing	0.00Å	1.08Å
C47	H18	sing	0.00Å	1.08Å
C52	H19	sing	0.00Å	1.08Å
C53	H20	sing	0.00Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C32	C33	C34	121.5°	90.0°
C33	C32	C31	119.9°	90.0°
C33	C32	H11	120.0°	90.0°
C32	C33	H12	119.2°	90.0°
C33	C34	N35	124.5°	90.0°
C33	C34	C38	116.8°	90.0°
C34	C33	H12	119.2°	90.0°
C32	C31	N29	124.2°	90.0°
C32	C31	C30	116.8°	90.0°
C31	C32	H11	120.0°	90.0°
C34	N35	C36	122.0°	90.0°
N35	C34	C38	118.7°	90.0°
N35	C36	C37	121.5°	90.0°
N35	C36	H13	119.2°	90.0°
C34	C38	C30	121.6°	90.0°
C34	C38	N39	119.0°	90.0°
C36	C37	N39	117.1°	90.0°
C37	C36	H13	119.3°	90.0°
C36	C37	H14	121.5°	90.0°
N29	C31	C30	119.0°	90.0°
C31	N29	C28	122.2°	90.0°
C31	C30	C38	123.4°	90.0°
C31	C30	N26	117.8°	90.0°
N29	C28	C27	120.9°	90.0°
N29	C28	H10	119.5°	90.0°
C30	C38	N39	119.4°	90.0°
C38	C30	N26	118.8°	90.0°
C38	N39	C37	121.7°	90.0°
C38	N39	RU	108.2°	90.0°
C30	N26	C27	123.1°	90.0°
C30	N26	RU	109.2°	90.0°
C37	N39	RU	130.1°	90.0°
N39	C37	H14	121.5°	90.0°
N39	RU	N26	84.5°	90.0°
N39	RU	N50	92.9°	90.0°
N39	RU	N22	95.1°	90.0°
N39	RU	N17	95.5°	90.0°
N39	RU	N40	175.8°	90.0°
C28	C27	N26	116.9°	90.0°
C28	C27	H9	121.6°	90.0°
C27	C28	H10	119.5°	90.0°
C52	C53	N50	117.1°	90.0°
C53	C52	N51	121.2°	90.0°
C53	C52	H19	119.4°	90.0°
C52	C53	H20	121.4°	90.0°
C53	N50	RU	130.4°	90.0°
C53	N50	C49	121.7°	90.0°
N50	C53	H20	121.5°	90.0°
C52	N51	C48	122.0°	90.0°
N51	C52	H19	119.4°	90.0°
C27	N26	RU	127.8°	90.0°
N26	C27	H9	121.5°	90.0°
N26	RU	N50	87.6°	90.0°
N26	RU	N22	94.2°	90.0°
N26	RU	N17	180.0°	90.0°
N26	RU	N40	92.4°	90.0°
RU	N50	C49	107.9°	90.0°
N50	RU	N22	171.9°	90.0°
N50	RU	N17	92.4°	90.0°
N50	RU	N40	84.1°	90.0°
N50	C49	C48	119.1°	90.0°
N50	C49	C45	119.5°	90.0°
N51	C48	C49	118.9°	90.0°
N51	C48	C47	124.0°	90.0°
N22	RU	N17	85.8°	90.0°
N22	RU	N40	88.0°	90.0°
RU	N22	C23	126.9°	90.0°
RU	N22	C19	108.8°	90.0°
N17	RU	N40	87.6°	90.0°
RU	N17	C16	127.5°	90.0°
RU	N17	C18	108.7°	90.0°
RU	N40	C45	109.7°	90.0°
RU	N40	C41	127.1°	90.0°
N22	C23	C24	116.6°	90.0°
C23	N22	C19	124.1°	90.0°
N22	C23	H6	121.7°	90.0°
C23	C24	C25	119.9°	90.0°
C24	C23	H6	121.7°	90.0°
C23	C24	H7	120.1°	90.0°
N22	C19	C18	118.3°	90.0°
N22	C19	C20	119.5°	90.0°
C48	C49	C45	121.4°	90.0°
C49	C48	C47	117.0°	90.0°
C49	C45	N40	118.8°	90.0°
C49	C45	C44	123.5°	90.0°
C48	C47	C46	121.3°	90.0°
C48	C47	H18	119.4°	90.0°
C24	C25	C20	121.2°	90.0°
C25	C24	H7	120.0°	90.0°
C24	C25	H8	119.4°	90.0°
C16	N17	C18	123.7°	90.0°
N17	C16	C15	116.7°	90.0°
N17	C16	H5	121.7°	90.0°
N17	C18	C19	118.1°	90.0°
N17	C18	C13	120.1°	90.0°
C16	C15	C14	119.8°	90.0°
C16	C15	H4	120.1°	90.0°
C15	C16	H5	121.6°	90.0°
C18	C19	C20	122.1°	90.0°
C19	C18	C13	121.8°	90.0°
C19	C20	C25	118.7°	90.0°
C19	C20	C11	117.5°	90.0°
C18	C13	C14	118.6°	90.0°
C18	C13	C10	117.4°	90.0°
C45	N40	C41	123.2°	90.0°
N40	C45	C44	117.7°	90.0°
N40	C41	C42	116.9°	90.0°
N40	C41	H15	121.5°	90.0°
C25	C20	C11	123.8°	90.0°
C20	C25	H8	119.4°	90.0°
C45	C44	C46	116.8°	90.0°
C45	C44	N43	119.2°	90.0°
C47	C46	C44	120.0°	90.0°
C47	C46	H17	120.0°	90.0°
C46	C47	H18	119.4°	90.0°
C20	C11	C10	120.5°	90.0°
C20	C11	N12	119.6°	90.0°
C15	C14	C13	121.0°	90.0°
C15	C14	H3	119.5°	90.0°
C14	C15	H4	120.1°	90.0°
C14	C13	C10	124.0°	90.0°
C13	C14	H3	119.5°	90.0°
C13	C10	C11	120.7°	90.0°
C13	C10	N09	120.3°	90.0°
C41	C42	N43	120.7°	90.0°
C42	C41	H15	121.6°	90.0°
C41	C42	H16	119.7°	90.0°
C10	C11	N12	119.9°	90.0°
C11	C10	N09	119.1°	90.0°
C11	N12	C08	120.4°	90.0°
C46	C44	N43	123.9°	90.0°
C44	C46	H17	120.0°	90.0°
C44	N43	C42	122.2°	90.0°
C10	N09	C07	120.3°	90.0°
N12	C08	C07	119.7°	90.0°
N12	C08	C05	120.4°	90.0°
N43	C42	H16	119.6°	90.0°
N09	C07	C08	120.7°	90.0°
N09	C07	C06	119.5°	90.0°
C07	C08	C05	119.9°	90.0°
C08	C07	C06	119.8°	90.0°
C08	C05	C04	119.0°	90.0°
C08	C05	H1	120.5°	90.0°
C07	C06	C03	119.4°	90.0°
C07	C06	H2	120.3°	90.0°
C05	C04	C03	120.2°	90.0°
C05	C04	C54	121.6°	90.0°
C04	C05	H1	120.5°	90.0°
C06	C03	C04	121.7°	90.0°
C06	C03	C02	119.0°	90.0°
C03	C06	H2	120.3°	90.0°
C03	C04	C54	118.2°	90.0°
C04	C03	C02	119.2°	90.0°
C04	C54	N55	174.9°	90.0°
C03	C02	N01	177.8°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C32	C33	C34	H12	180.0°	90.0°
C33	C32	C31	H11	180.0°	90.0°
C32	C33	C34	N35	180.0°	90.0°
C32	C33	C34	C38	0.1°	90.0°
C33	C32	C31	N29	180.0°	90.0°
C33	C32	C31	C30	0.0°	90.0°
C34	C33	C32	C31	0.0°	90.0°
C33	C34	N35	C38	179.9°	90.0°
C33	C34	N35	C36	179.9°	90.0°
C33	C34	C38	C30	0.3°	90.0°
C33	C34	C38	N39	178.7°	90.0°
C34	C33	C32	H11	180.0°	90.0°
C32	C31	N29	C30	179.9°	90.0°
C32	C31	N29	C28	180.0°	90.0°
C32	C31	C30	C38	0.2°	90.0°
C32	C31	C30	N26	179.7°	90.0°
C31	C32	C33	H12	180.0°	90.0°
C34	N35	C36	C37	0.3°	90.0°
N35	C34	C38	C30	179.8°	90.0°
N35	C34	C38	N39	1.4°	90.0°
N35	C34	C33	H12	0.0°	90.0°
C34	N35	C36	H13	179.6°	90.0°
C36	N35	C34	C38	0.2°	90.0°
N35	C36	C37	H13	180.0°	90.0°
N35	C36	C37	N39	1.6°	90.0°
N35	C36	C37	H14	178.4°	90.0°
C34	C38	C30	C31	0.4°	90.0°
C34	C38	C30	N39	178.4°	90.0°
C34	C38	C30	N26	179.8°	90.0°
C34	C38	N39	C37	2.8°	90.0°
C34	C38	N39	RU	179.5°	90.0°
C38	C34	C33	H12	179.9°	90.0°
C36	C37	N39	C38	2.9°	90.0°
C36	C37	N39	H14	180.0°	90.0°
C36	C37	N39	RU	178.9°	90.0°
N29	C31	C30	C38	179.8°	90.0°
N29	C31	C30	N26	0.4°	90.0°
C31	N29	C28	C27	0.1°	90.0°
C31	N29	C28	H10	179.9°	90.0°
N29	C31	C32	H11	0.0°	90.0°
C30	C31	N29	C28	0.1°	90.0°
C31	C30	C38	N26	179.4°	90.0°
C31	C30	C38	N39	178.8°	90.0°
C31	C30	N26	C27	0.8°	90.0°
C31	C30	N26	RU	180.0°	90.0°
C30	C31	C32	H11	180.0°	90.0°
N29	C28	C27	H10	180.0°	90.0°
N29	C28	C27	N26	0.4°	90.0°
N29	C28	C27	H9	179.6°	90.0°
C30	C38	N39	C37	178.7°	90.0°
C30	C38	N39	RU	2.0°	90.0°
C38	C30	N26	C27	179.8°	90.0°
C38	C30	N26	RU	0.5°	90.0°
N39	C38	C30	N26	1.8°	90.0°
C38	N39	C37	RU	176.0°	90.0°
C38	N39	RU	N26	1.3°	90.0°
C38	N39	RU	N50	86.0°	90.0°
C38	N39	RU	N22	95.0°	90.0°
C38	N39	RU	N17	178.7°	90.0°
C38	N39	RU	N40	41.7°	90.0°
C38	N39	C37	H14	177.1°	90.0°
C30	N26	RU	N39	0.5°	90.0°
C30	N26	C27	C28	0.8°	90.0°
C30	N26	C27	RU	179.1°	90.0°
C30	N26	RU	N50	92.7°	90.0°
C30	N26	RU	N22	95.2°	90.0°
C30	N26	RU	N17	34.1°	90.0°
C30	N26	RU	N40	176.7°	90.0°
C30	N26	C27	H9	179.2°	90.0°
C37	N39	RU	N26	177.7°	90.0°
C37	N39	RU	N50	90.4°	90.0°
C37	N39	RU	N22	88.6°	90.0°
C37	N39	RU	N17	2.4°	90.0°
C37	N39	RU	N40	134.6°	90.0°
N39	C37	C36	H13	178.3°	90.0°
N39	RU	N50	C53	3.3°	90.0°
N39	RU	N26	C27	178.7°	90.0°
N39	RU	N26	N50	93.2°	90.0°
N39	RU	N26	N22	94.7°	90.0°
N39	RU	N26	N17	33.6°	90.0°
N39	RU	N26	N40	177.1°	90.0°
N39	RU	N50	N22	172.8°	90.0°
N39	RU	N50	N17	95.7°	90.0°
N39	RU	N50	N40	177.0°	90.0°
N39	RU	N50	C49	177.9°	90.0°
N39	RU	N22	N17	95.2°	90.0°
N39	RU	N22	N40	177.1°	90.0°
N39	RU	N17	N40	177.1°	90.0°
N39	RU	N22	C23	86.2°	90.0°
N39	RU	N22	C19	98.4°	90.0°
N39	RU	N17	C16	85.7°	90.0°
N39	RU	N17	C18	97.8°	90.0°
N39	RU	N40	C45	45.4°	90.0°
N39	RU	N40	C41	135.8°	90.0°
RU	N39	C37	H14	1.1°	90.0°
C28	C27	N26	H9	180.0°	90.0°
C28	C27	N26	RU	179.9°	90.0°
C52	C53	N50	H20	180.0°	90.0°
C53	C52	N51	H19	180.0°	90.0°
C52	C53	N50	RU	179.3°	90.0°
C52	C53	N50	C49	0.7°	90.0°
C53	C52	N51	C48	0.1°	90.0°
N50	C53	C52	N51	0.5°	90.0°
C53	N50	RU	N26	87.6°	90.0°
C53	N50	RU	C49	178.8°	90.0°
C53	N50	RU	N22	169.5°	90.0°
C53	N50	RU	N17	92.4°	90.0°
C53	N50	RU	N40	179.7°	90.0°
C53	N50	C49	C48	0.6°	90.0°
C53	N50	C49	C45	179.6°	90.0°
N50	C53	C52	H19	179.6°	90.0°
C52	N51	C48	C49	0.0°	90.0°
C52	N51	C48	C47	180.0°	90.0°
N51	C52	C53	H20	179.5°	90.0°
C27	N26	RU	N50	88.1°	90.0°
C27	N26	RU	N22	84.0°	90.0°
C27	N26	RU	N17	145.1°	90.0°
C27	N26	RU	N40	4.2°	90.0°
N26	C27	C28	H10	179.5°	90.0°
N26	RU	N50	N22	102.9°	90.0°
N26	RU	N50	N17	180.0°	90.0°
N26	RU	N50	N40	92.7°	90.0°
N26	RU	N50	C49	93.6°	90.0°
N26	RU	N22	N17	180.0°	90.0°
N26	RU	N22	N40	92.3°	90.0°
N26	RU	N17	N40	149.3°	90.0°
N26	RU	N22	C23	1.4°	90.0°
N26	RU	N22	C19	176.8°	90.0°
N26	RU	N17	C16	119.3°	90.0°
N26	RU	N17	C18	64.1°	90.0°
N26	RU	N40	C45	88.3°	90.0°
N26	RU	N40	C41	92.9°	90.0°
RU	N26	C27	H9	0.1°	90.0°
N50	RU	N22	N17	77.6°	90.0°
N50	RU	N22	N40	10.1°	90.0°
N50	RU	N17	N40	83.9°	90.0°
N50	RU	N22	C23	101.0°	90.0°
N50	RU	N22	C19	74.4°	90.0°
RU	N50	C49	C48	179.5°	90.0°
RU	N50	C49	C45	0.8°	90.0°
N50	RU	N17	C16	7.5°	90.0°
N50	RU	N17	C18	169.1°	90.0°
N50	RU	N40	C45	0.9°	90.0°
N50	RU	N40	C41	179.7°	90.0°
RU	N50	C53	H20	0.7°	90.0°
N50	C49	C48	N51	0.2°	90.0°
C49	N50	RU	N22	9.3°	90.0°
C49	N50	RU	N17	86.4°	90.0°
C49	N50	RU	N40	0.9°	90.0°
N50	C49	C48	C45	179.7°	90.0°
N50	C49	C48	C47	179.8°	90.0°
N50	C49	C45	N40	0.0°	90.0°
N50	C49	C45	C44	179.7°	90.0°
C49	N50	C53	H20	179.3°	90.0°
N51	C48	C49	C47	180.0°	90.0°
N51	C48	C49	C45	180.0°	90.0°
N51	C48	C47	C46	179.8°	90.0°
N51	C48	C47	H18	0.2°	90.0°
C48	N51	C52	H19	179.9°	90.0°
N22	RU	N17	N40	88.2°	90.0°
RU	N22	C23	C19	174.7°	90.0°
RU	N22	C23	C24	177.6°	90.0°
N22	RU	N17	C16	179.6°	90.0°
N22	RU	N17	C18	3.0°	90.0°
RU	N22	C19	C18	2.8°	90.0°
RU	N22	C19	C20	178.2°	90.0°
N22	RU	N40	C45	177.6°	90.0°
N22	RU	N40	C41	1.2°	90.0°
RU	N22	C23	H6	2.4°	90.0°
N17	RU	N22	C23	178.6°	90.0°
N17	RU	N22	C19	3.2°	90.0°
RU	N17	C16	C18	176.1°	90.0°
RU	N17	C16	C15	177.8°	90.0°
RU	N17	C18	C19	2.4°	90.0°
RU	N17	C18	C13	178.5°	90.0°
N17	RU	N40	C45	91.8°	90.0°
N17	RU	N40	C41	87.0°	90.0°
RU	N17	C16	H5	2.2°	90.0°
N40	RU	N22	C23	90.9°	90.0°
N40	RU	N22	C19	84.5°	90.0°
RU	N40	C45	C49	0.8°	90.0°
N40	RU	N17	C16	91.5°	90.0°
N40	RU	N17	C18	85.1°	90.0°
RU	N40	C45	C41	178.9°	90.0°
RU	N40	C45	C44	179.5°	90.0°
RU	N40	C41	C42	179.2°	90.0°
RU	N40	C41	H15	0.8°	90.0°
N22	C23	C24	H6	180.0°	90.0°
N22	C23	C24	C25	1.8°	90.0°
C23	N22	C19	C18	178.4°	90.0°
C23	N22	C19	C20	2.6°	90.0°
N22	C23	C24	H7	178.2°	90.0°
C24	C23	N22	C19	2.9°	90.0°
C23	C24	C25	H7	180.0°	90.0°
C23	C24	C25	C20	0.5°	90.0°
C23	C24	C25	H8	179.5°	90.0°
N22	C19	C18	N17	0.3°	90.0°
N22	C19	C18	C20	179.0°	90.0°
N22	C19	C18	C13	178.8°	90.0°
N22	C19	C20	C25	1.1°	90.0°
N22	C19	C20	C11	178.8°	90.0°
C19	N22	C23	H6	177.1°	90.0°
C48	C49	C45	N40	179.7°	90.0°
C48	C49	C45	C44	0.0°	90.0°
C49	C48	C47	C46	0.2°	90.0°
C49	C48	C47	H18	179.8°	90.0°
C45	C49	C48	C47	0.0°	90.0°
C49	C45	N40	C44	179.7°	90.0°
C49	C45	N40	C41	179.7°	90.0°
C49	C45	C44	C46	0.0°	90.0°
C49	C45	C44	N43	180.0°	90.0°
C48	C47	C46	H18	180.0°	90.0°
C48	C47	C46	C44	0.2°	90.0°
C48	C47	C46	H17	179.8°	90.0°
C24	C25	C20	C19	0.1°	90.0°
C24	C25	C20	H8	180.0°	90.0°
C24	C25	C20	C11	179.8°	90.0°
C25	C24	C23	H6	178.2°	90.0°
N17	C16	C15	H5	180.0°	90.0°
C16	N17	C18	C19	179.1°	90.0°
C16	N17	C18	C13	1.8°	90.0°
N17	C16	C15	C14	0.7°	90.0°
N17	C16	C15	H4	179.3°	90.0°
C18	N17	C16	C15	1.7°	90.0°
N17	C18	C19	C13	179.1°	90.0°
N17	C18	C19	C20	179.3°	90.0°
N17	C18	C13	C14	0.9°	90.0°
N17	C18	C13	C10	179.2°	90.0°
C18	N17	C16	H5	178.3°	90.0°
C16	C15	C14	H4	180.0°	90.0°
C16	C15	C14	C13	0.1°	90.0°
C16	C15	C14	H3	179.9°	90.0°
C18	C19	C20	C25	179.9°	90.0°
C18	C19	C20	C11	0.2°	90.0°
C19	C18	C13	C14	179.9°	90.0°
C19	C18	C13	C10	0.1°	90.0°
C20	C19	C18	C13	0.2°	90.0°
C19	C20	C25	C11	179.9°	90.0°
C19	C20	C11	C10	0.1°	90.0°
C19	C20	C11	N12	179.9°	90.0°
C19	C20	C25	H8	179.9°	90.0°
C18	C13	C14	C15	0.0°	90.0°
C18	C13	C14	C10	180.0°	90.0°
C18	C13	C10	C11	0.0°	90.0°
C18	C13	C10	N09	180.0°	90.0°
C18	C13	C14	H3	180.0°	90.0°
C45	N40	C41	C42	0.5°	90.0°
N40	C45	C44	C46	179.6°	90.0°
N40	C45	C44	N43	0.3°	90.0°
C45	N40	C41	H15	179.4°	90.0°
C41	N40	C45	C44	0.6°	90.0°
N40	C41	C42	H15	180.0°	90.0°
N40	C41	C42	N43	0.1°	90.0°
N40	C41	C42	H16	179.8°	90.0°
C25	C20	C11	C10	180.0°	90.0°
C25	C20	C11	N12	0.0°	90.0°
C20	C25	C24	H7	179.5°	90.0°
C45	C44	C46	C47	0.2°	90.0°
C45	C44	C46	N43	179.9°	90.0°
C45	C44	N43	C42	0.1°	90.0°
C45	C44	C46	H17	179.8°	90.0°
C47	C46	C44	H17	180.0°	90.0°
C47	C46	C44	N43	179.9°	90.0°
C20	C11	C10	C13	0.1°	90.0°
C20	C11	C10	N12	179.9°	90.0°
C20	C11	C10	N09	180.0°	90.0°
C20	C11	N12	C08	180.0°	90.0°
C11	C20	C25	H8	0.2°	90.0°
C15	C14	C13	H3	180.0°	90.0°
C15	C14	C13	C10	179.9°	90.0°
C14	C15	C16	H5	179.3°	90.0°
C14	C13	C10	C11	179.9°	90.0°
C14	C13	C10	N09	0.0°	90.0°
C13	C14	C15	H4	179.9°	90.0°
C13	C10	C11	N09	179.9°	90.0°
C13	C10	C11	N12	180.0°	90.0°
C13	C10	N09	C07	179.9°	90.0°
C10	C13	C14	H3	0.1°	90.0°
C41	C42	N43	C44	0.1°	90.0°
C41	C42	N43	H16	180.0°	90.0°
C10	C11	N12	C08	0.0°	90.0°
C11	C10	N09	C07	0.1°	90.0°
N12	C11	C10	N09	0.1°	90.0°
C11	N12	C08	C07	0.0°	90.0°
C11	N12	C08	C05	180.0°	90.0°
C46	C44	N43	C42	180.0°	90.0°
C44	C46	C47	H18	179.8°	90.0°
C44	N43	C42	H16	179.9°	90.0°
N43	C44	C46	H17	0.1°	90.0°
C10	N09	C07	C08	0.1°	90.0°
C10	N09	C07	C06	179.8°	90.0°
N12	C08	C07	N09	0.1°	90.0°
N12	C08	C07	C05	180.0°	90.0°
N12	C08	C07	C06	179.7°	90.0°
N12	C08	C05	C04	180.0°	90.0°
N12	C08	C05	H1	0.0°	90.0°
N43	C42	C41	H15	179.8°	90.0°
N09	C07	C08	C06	179.7°	90.0°
N09	C07	C08	C05	179.9°	90.0°
N09	C07	C06	C03	179.8°	90.0°
N09	C07	C06	H2	0.2°	90.0°
C07	C08	C05	C04	0.0°	90.0°
C08	C07	C06	C03	0.5°	90.0°
C07	C08	C05	H1	180.0°	90.0°
C08	C07	C06	H2	179.5°	90.0°
C05	C08	C07	C06	0.2°	90.0°
C08	C05	C04	H1	180.0°	90.0°
C08	C05	C04	C03	0.0°	90.0°
C08	C05	C04	C54	180.0°	90.0°
C07	C06	C03	H2	180.0°	90.0°
C07	C06	C03	C04	0.5°	90.0°
C07	C06	C03	C02	179.8°	90.0°
C05	C04	C03	C06	0.2°	90.0°
C05	C04	C03	C54	179.9°	90.0°
C05	C04	C03	C02	180.0°	90.0°
C05	C04	C54	N55	0.9°	90.0°
C06	C03	C04	C02	179.7°	90.0°
C06	C03	C04	C54	179.7°	90.0°
C06	C03	C02	N01	179.7°	90.0°
C03	C04	C54	N55	179.1°	90.0°
C04	C03	C02	N01	0.0°	90.0°
C03	C04	C05	H1	179.9°	90.0°
C04	C03	C06	H2	179.5°	90.0°
C54	C04	C03	C02	0.0°	90.0°
C54	C04	C05	H1	0.0°	90.0°
C02	C03	C06	H2	0.3°	90.0°
H3	C14	C15	H4	0.1°	90.0°
H4	C15	C16	H5	0.7°	90.0°
H6	C23	C24	H7	1.8°	90.0°
H7	C24	C25	H8	0.5°	90.0°
H9	C27	C28	H10	0.5°	90.0°
H11	C32	C33	H12	0.0°	90.0°
H13	C36	C37	H14	1.7°	90.0°
H15	C41	C42	H16	0.2°	90.0°
H17	C46	C47	H18	0.2°	90.0°
H19	C52	C53	H20	0.5°	90.0°

Release date:	2019-04-24
Definition date:	2018-04-10
Last modified:	2019-04-19
Release status:	REL
Processing site:	EBI
Derived from:	6G8S