RR2

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CA1	NA1	doub	0.00Å	1.34Å	Aromatic
CA1	H1	sing	0.00Å	1.08Å
CA2	CA1	sing	0.00Å	1.40Å	Aromatic
CA2	H2	sing	0.00Å	1.08Å
CA3	CA2	doub	0.00Å	1.39Å	Aromatic
CA3	CA5	sing	0.00Å	1.38Å	Aromatic
CA3	H3	sing	0.00Å	1.08Å
NA1	RU1	sing	0.00Å	2.02Å
CA4	NA1	sing	0.00Å	1.34Å	Aromatic
CA4	CA8	doub	0.00Å	1.47Å	Aromatic
CA5	CA4	sing	0.00Å	1.48Å	Aromatic
CA6	CA5	doub	0.00Å	1.39Å	Aromatic
CA6	CA7	sing	0.00Å	1.40Å	Aromatic
CA6	H4	sing	0.00Å	1.08Å
CA7	CA9	doub	0.00Å	1.39Å	Aromatic
CA7	H5	sing	0.00Å	1.08Å
CA8	NA2	sing	0.00Å	1.35Å	Aromatic
NA2	CAB	doub	0.00Å	1.34Å	Aromatic
CA9	CA8	sing	0.00Å	1.48Å	Aromatic
CA9	CA0	sing	0.00Å	1.39Å	Aromatic
CA0	CAA	doub	0.00Å	1.39Å	Aromatic
CA0	H6	sing	0.00Å	1.08Å
CAA	CAB	sing	0.00Å	1.40Å	Aromatic
CAA	H7	sing	0.00Å	1.08Å
CAB	H8	sing	0.00Å	1.08Å
CB1	NB1	doub	0.00Å	1.34Å	Aromatic
CB1	CB2	sing	0.00Å	1.40Å	Aromatic
CB1	H9	sing	0.00Å	1.08Å
CB2	CB3	doub	0.00Å	1.39Å	Aromatic
CB2	H10	sing	0.00Å	1.08Å
CB3	CB5	sing	0.00Å	1.39Å	Aromatic
CB3	H11	sing	0.00Å	1.08Å
NB1	CB4	sing	0.00Å	1.34Å	Aromatic
CB4	CB8	doub	0.00Å	1.46Å	Aromatic
CB4	CB5	sing	0.00Å	1.48Å	Aromatic
CB5	CB6	doub	0.00Å	1.39Å	Aromatic
CB6	CB7	sing	0.00Å	1.39Å	Aromatic
CB6	H12	sing	0.00Å	1.08Å
CB7	H13	sing	0.00Å	1.08Å
CB8	CB9	sing	0.00Å	1.48Å	Aromatic
NB2	CBB	doub	0.00Å	1.33Å	Aromatic
NB2	CB8	sing	0.00Å	1.33Å	Aromatic
CB9	CB0	sing	0.00Å	1.38Å	Aromatic
CB9	CB7	doub	0.00Å	1.39Å	Aromatic
CB0	H14	sing	0.00Å	1.08Å
CBA	CB0	doub	0.00Å	1.39Å	Aromatic
CBA	H15	sing	0.00Å	1.08Å
CBB	CBA	sing	0.00Å	1.39Å	Aromatic
CBB	H16	sing	0.00Å	1.08Å
CC1	NC1	doub	0.00Å	1.34Å	Aromatic
CC1	H17	sing	0.00Å	1.08Å
CC2	CC3	doub	0.00Å	1.39Å	Aromatic
CC2	CC1	sing	0.00Å	1.38Å	Aromatic
CC2	H18	sing	0.00Å	1.08Å
CC3	CC5	sing	0.00Å	1.38Å	Aromatic
CC3	H19	sing	0.00Å	1.08Å
NC1	CC4	sing	0.00Å	1.34Å	Aromatic
NC1	RU2	sing	0.00Å	1.96Å
CC4	CC8	doub	0.00Å	1.48Å	Aromatic
CC5	CC6	doub	0.00Å	1.39Å	Aromatic
CC5	CC4	sing	0.00Å	1.47Å	Aromatic
CC6	CC7	sing	0.00Å	1.39Å	Aromatic
CC6	H20	sing	0.00Å	1.08Å
CC7	CC9	doub	0.00Å	1.39Å	Aromatic
CC7	H21	sing	0.00Å	1.08Å
CC8	CC9	sing	0.00Å	1.48Å	Aromatic
CC8	NC2	sing	0.00Å	1.35Å	Aromatic
NC2	CCB	doub	0.00Å	1.33Å	Aromatic
CC9	CC0	sing	0.00Å	1.38Å	Aromatic
CC0	CCA	doub	0.00Å	1.39Å	Aromatic
CC0	H22	sing	0.00Å	1.08Å
CCA	H23	sing	0.00Å	1.08Å
CCB	CCA	sing	0.00Å	1.39Å	Aromatic
CCB	H24	sing	0.00Å	1.08Å
CD1	ND1	doub	0.00Å	1.34Å	Aromatic
CD1	H25	sing	0.00Å	1.08Å
CD2	CD1	sing	0.00Å	1.40Å	Aromatic
CD2	H26	sing	0.00Å	1.08Å
CD3	CD2	doub	0.00Å	1.39Å	Aromatic
CD3	CD5	sing	0.00Å	1.39Å	Aromatic
CD3	H27	sing	0.00Å	1.08Å
ND1	RU2	sing	0.00Å	2.00Å
CD4	ND1	sing	0.00Å	1.35Å	Aromatic
CD4	CD8	doub	0.00Å	1.49Å	Aromatic
CD5	CD4	sing	0.00Å	1.48Å	Aromatic
CD6	CD5	doub	0.00Å	1.40Å	Aromatic
CD6	CD7	sing	0.00Å	1.40Å	Aromatic
CD6	H28	sing	0.00Å	1.08Å
CD7	CD9	doub	0.00Å	1.40Å	Aromatic
CD7	H29	sing	0.00Å	1.08Å
CD8	ND2	sing	0.00Å	1.35Å	Aromatic
ND2	CDB	doub	0.00Å	1.34Å	Aromatic
CD9	CD8	sing	0.00Å	1.49Å	Aromatic
CD9	CD0	sing	0.00Å	1.39Å	Aromatic
CD0	CDA	doub	0.00Å	1.40Å	Aromatic
CD0	H30	sing	0.00Å	1.08Å
CDA	CDB	sing	0.00Å	1.40Å	Aromatic
CDA	H31	sing	0.00Å	1.08Å
CDB	H32	sing	0.00Å	1.08Å
RU1	NA2	sing	0.00Å	1.93Å
RU1	NB1	sing	0.00Å	1.97Å
RU1	NB2	sing	0.00Å	1.91Å
RU2	ND2	sing	0.00Å	2.00Å
RU2	N4	sing	0.00Å	1.89Å
RU2	NC2	sing	0.00Å	1.96Å
RU2	N5	sing	0.00Å	1.96Å
C11	C31	sing	0.00Å	1.53Å
C10	C11	sing	0.00Å	1.39Å	Aromatic
C10	H33	sing	0.00Å	1.08Å
C12	C11	doub	0.00Å	1.39Å	Aromatic
C12	H34	sing	0.00Å	1.08Å
C13	C12	sing	0.00Å	1.40Å	Aromatic
C13	H35	sing	0.00Å	1.08Å
C9B	C13	doub	0.00Å	1.38Å	Aromatic
C9B	C9A	sing	0.00Å	1.38Å	Aromatic
C9A	C10	doub	0.00Å	1.40Å	Aromatic
N9	C9A	sing	0.00Å	1.34Å	Aromatic
N14	C9B	sing	0.00Å	1.38Å	Aromatic
C8C	N14	doub	0.00Å	1.37Å	Aromatic
C8C	C8B	sing	0.00Å	1.38Å	Aromatic
C8D	C8C	sing	0.00Å	1.51Å	Aromatic
C4A	C8D	sing	0.00Å	1.41Å	Aromatic
C4A	C4B	sing	0.00Å	1.38Å	Aromatic
N4	C4A	doub	0.00Å	1.35Å	Aromatic
C3	C2	doub	0.00Å	1.40Å	Aromatic
C3	N4	sing	0.00Å	1.32Å	Aromatic
C3	H36	sing	0.00Å	1.08Å
C2	C1	sing	0.00Å	1.39Å	Aromatic
C2	H37	sing	0.00Å	1.08Å
C1	C8D	doub	0.00Å	1.37Å	Aromatic
C1	H38	sing	0.00Å	1.08Å
C8B	N9	doub	0.00Å	1.34Å	Aromatic
C8A	C8B	sing	0.00Å	1.48Å	Aromatic
C8A	C8	doub	0.00Å	1.37Å	Aromatic
C4B	C8A	sing	0.00Å	1.39Å	Aromatic
C8	H39	sing	0.00Å	1.08Å
C7	C8	sing	0.00Å	1.37Å	Aromatic
C7	H40	sing	0.00Å	1.08Å
C6	C7	doub	0.00Å	1.40Å	Aromatic
C6	H41	sing	0.00Å	1.08Å
N5	C4B	doub	0.00Å	1.34Å	Aromatic
N5	C6	sing	0.00Å	1.32Å	Aromatic
C31	C32	doub	0.00Å	1.40Å	Aromatic
C31	C30	sing	0.00Å	1.41Å	Aromatic
C30	C9C	doub	0.00Å	1.41Å	Aromatic
C30	H42	sing	0.00Å	1.08Å
C32	C33	sing	0.00Å	1.41Å	Aromatic
C32	H43	sing	0.00Å	1.08Å
C33	C9D	doub	0.00Å	1.41Å	Aromatic
C33	H44	sing	0.00Å	1.08Å
C9D	N	sing	0.00Å	1.37Å	Aromatic
C9C	C9D	sing	0.00Å	1.40Å	Aromatic
C9C	N29	sing	0.00Å	1.39Å	Aromatic
N29	C8F	doub	0.00Å	1.37Å	Aromatic
N	C8G	doub	0.00Å	1.38Å	Aromatic
C8G	C8H	sing	0.00Å	1.51Å	Aromatic
C8H	C21	doub	0.00Å	1.38Å	Aromatic
C8H	C4C	sing	0.00Å	1.39Å	Aromatic
C4C	N24	doub	0.00Å	1.33Å	Aromatic
N24	C23	sing	0.00Å	1.32Å	Aromatic
N24	RU1	sing	0.00Å	1.91Å
C23	H45	sing	0.00Å	1.08Å
C22	C23	doub	0.00Å	1.39Å	Aromatic
C22	H46	sing	0.00Å	1.08Å
C21	C22	sing	0.00Å	1.40Å	Aromatic
C21	H47	sing	0.00Å	1.08Å
C8F	C8G	sing	0.00Å	1.40Å	Aromatic
C8F	C8E	sing	0.00Å	1.52Å	Aromatic
C8E	C4D	sing	0.00Å	1.42Å	Aromatic
C4D	C4C	sing	0.00Å	1.37Å	Aromatic
C4D	N25	doub	0.00Å	1.35Å	Aromatic
C28	C8E	doub	0.00Å	1.38Å	Aromatic
C28	C27	sing	0.00Å	1.39Å	Aromatic
C28	H48	sing	0.00Å	1.08Å
C27	C26	doub	0.00Å	1.41Å	Aromatic
C26	N25	sing	0.00Å	1.33Å	Aromatic
N25	RU1	sing	0.00Å	1.99Å
C27	H49	sing	0.00Å	1.08Å
C26	H50	sing	0.00Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
NA1	CA1	H1	118.9°	90.0°
NA1	CA1	CA2	122.3°	90.0°
CA1	NA1	RU1	139.7°	90.0°
CA1	NA1	CA4	119.9°	90.0°
H1	CA1	CA2	118.8°	90.0°
CA1	CA2	H2	119.6°	90.0°
CA1	CA2	CA3	120.9°	90.0°
H2	CA2	CA3	119.6°	90.0°
CA2	CA3	CA5	117.7°	90.0°
CA2	CA3	H3	121.2°	90.0°
CA5	CA3	H3	121.1°	90.0°
CA3	CA5	CA4	118.9°	90.0°
CA3	CA5	CA6	120.8°	90.0°
RU1	NA1	CA4	100.4°	90.0°
NA1	RU1	NA2	93.9°	90.0°
NA1	RU1	NB1	93.6°	90.0°
NA1	RU1	NB2	171.0°	90.0°
NA1	RU1	N24	85.6°	90.0°
NA1	RU1	N25	82.9°	90.0°
NA1	CA4	CA8	121.6°	90.0°
NA1	CA4	CA5	120.4°	90.0°
CA8	CA4	CA5	118.0°	90.0°
CA4	CA8	NA2	122.0°	90.0°
CA4	CA8	CA9	117.9°	90.0°
CA4	CA5	CA6	120.3°	90.0°
CA5	CA6	CA7	121.9°	90.0°
CA5	CA6	H4	119.0°	90.0°
CA7	CA6	H4	119.1°	90.0°
CA6	CA7	CA9	121.6°	90.0°
CA6	CA7	H5	119.2°	90.0°
CA9	CA7	H5	119.2°	90.0°
CA7	CA9	CA8	120.2°	90.0°
CA7	CA9	CA0	121.4°	90.0°
CA8	NA2	CAB	120.4°	90.0°
NA2	CA8	CA9	120.1°	90.0°
CA8	NA2	RU1	102.1°	90.0°
NA2	CAB	CAA	121.7°	90.0°
NA2	CAB	H8	119.1°	90.0°
CAB	NA2	RU1	137.4°	90.0°
CA8	CA9	CA0	118.4°	90.0°
CA9	CA0	CAA	118.3°	90.0°
CA9	CA0	H6	120.9°	90.0°
CAA	CA0	H6	120.9°	90.0°
CA0	CAA	CAB	121.1°	90.0°
CA0	CAA	H7	119.4°	90.0°
CAB	CAA	H7	119.5°	90.0°
CAA	CAB	H8	119.2°	90.0°
NB1	CB1	CB2	121.6°	90.0°
NB1	CB1	H9	119.2°	90.0°
CB1	NB1	CB4	120.4°	90.0°
CB1	NB1	RU1	138.9°	90.0°
CB2	CB1	H9	119.2°	90.0°
CB1	CB2	CB3	120.8°	90.0°
CB1	CB2	H10	119.6°	90.0°
CB3	CB2	H10	119.6°	90.0°
CB2	CB3	CB5	118.6°	90.0°
CB2	CB3	H11	120.7°	90.0°
CB5	CB3	H11	120.7°	90.0°
CB3	CB5	CB4	117.9°	90.0°
CB3	CB5	CB6	121.7°	90.0°
NB1	CB4	CB8	121.4°	90.0°
NB1	CB4	CB5	120.7°	90.0°
CB4	NB1	RU1	100.5°	90.0°
CB8	CB4	CB5	117.9°	90.0°
CB4	CB8	CB9	118.0°	90.0°
CB4	CB8	NB2	121.1°	90.0°
CB4	CB5	CB6	120.4°	90.0°
CB5	CB6	CB7	121.6°	90.0°
CB5	CB6	H12	119.2°	90.0°
CB7	CB6	H12	119.2°	90.0°
CB6	CB7	H13	119.4°	90.0°
CB6	CB7	CB9	121.2°	90.0°
H13	CB7	CB9	119.4°	90.0°
CB9	CB8	NB2	120.9°	90.0°
CB8	CB9	CB0	117.9°	90.0°
CB8	CB9	CB7	120.8°	90.0°
CBB	NB2	CB8	120.4°	90.0°
NB2	CBB	CBA	121.3°	90.0°
NB2	CBB	H16	119.4°	90.0°
CBB	NB2	RU1	137.0°	90.0°
CB8	NB2	RU1	102.2°	90.0°
CB0	CB9	CB7	121.3°	90.0°
CB9	CB0	H14	120.8°	90.0°
CB9	CB0	CBA	118.3°	90.0°
H14	CB0	CBA	120.8°	90.0°
CB0	CBA	H15	119.4°	90.0°
CB0	CBA	CBB	121.2°	90.0°
H15	CBA	CBB	119.4°	90.0°
CBA	CBB	H16	119.3°	90.0°
NC1	CC1	H17	119.1°	90.0°
NC1	CC1	CC2	121.8°	90.0°
CC1	NC1	CC4	121.4°	90.0°
CC1	NC1	RU2	139.6°	90.0°
H17	CC1	CC2	119.1°	90.0°
CC3	CC2	CC1	119.7°	90.0°
CC3	CC2	H18	120.2°	90.0°
CC2	CC3	CC5	119.8°	90.0°
CC2	CC3	H19	120.1°	90.0°
CC1	CC2	H18	120.1°	90.0°
CC5	CC3	H19	120.1°	90.0°
CC3	CC5	CC6	121.7°	90.0°
CC3	CC5	CC4	117.8°	90.0°
CC4	NC1	RU2	98.9°	90.0°
NC1	CC4	CC8	122.9°	90.0°
NC1	CC4	CC5	119.4°	90.0°
NC1	RU2	ND1	83.4°	90.0°
NC1	RU2	ND2	94.3°	90.0°
NC1	RU2	N4	89.8°	90.0°
NC1	RU2	NC2	96.6°	90.0°
NC1	RU2	N5	173.7°	90.0°
CC8	CC4	CC5	117.7°	90.0°
CC4	CC8	CC9	117.7°	90.0°
CC4	CC8	NC2	122.4°	90.0°
CC6	CC5	CC4	120.4°	90.0°
CC5	CC6	CC7	121.9°	90.0°
CC5	CC6	H20	119.0°	90.0°
CC7	CC6	H20	119.0°	90.0°
CC6	CC7	CC9	121.6°	90.0°
CC6	CC7	H21	119.2°	90.0°
CC9	CC7	H21	119.2°	90.0°
CC7	CC9	CC8	120.6°	90.0°
CC7	CC9	CC0	121.2°	90.0°
CC9	CC8	NC2	119.9°	90.0°
CC8	CC9	CC0	118.2°	90.0°
CC8	NC2	CCB	121.0°	90.0°
CC8	NC2	RU2	99.1°	90.0°
NC2	CCB	CCA	121.3°	90.0°
NC2	CCB	H24	119.4°	90.0°
CCB	NC2	RU2	140.0°	90.0°
CC9	CC0	CCA	118.7°	90.0°
CC9	CC0	H22	120.7°	90.0°
CCA	CC0	H22	120.6°	90.0°
CC0	CCA	H23	119.5°	90.0°
CC0	CCA	CCB	121.0°	90.0°
H23	CCA	CCB	119.5°	90.0°
CCA	CCB	H24	119.3°	90.0°
ND1	CD1	H25	119.3°	90.0°
ND1	CD1	CD2	121.3°	90.0°
CD1	ND1	RU2	138.6°	90.0°
CD1	ND1	CD4	121.2°	90.0°
H25	CD1	CD2	119.4°	90.0°
CD1	CD2	H26	119.6°	90.0°
CD1	CD2	CD3	120.8°	90.0°
H26	CD2	CD3	119.6°	90.0°
CD2	CD3	CD5	119.1°	90.0°
CD2	CD3	H27	120.4°	90.0°
CD5	CD3	H27	120.4°	90.0°
CD3	CD5	CD4	117.9°	90.0°
CD3	CD5	CD6	121.5°	90.0°
RU2	ND1	CD4	100.2°	90.0°
ND1	RU2	ND2	94.4°	90.0°
ND1	RU2	N4	89.5°	90.0°
ND1	RU2	NC2	179.8°	90.0°
ND1	RU2	N5	95.2°	90.0°
ND1	CD4	CD8	122.5°	90.0°
ND1	CD4	CD5	119.7°	90.0°
CD8	CD4	CD5	117.8°	90.0°
CD4	CD8	ND2	122.4°	90.0°
CD4	CD8	CD9	117.6°	90.0°
CD4	CD5	CD6	120.5°	90.0°
CD5	CD6	CD7	121.8°	90.0°
CD5	CD6	H28	119.1°	90.0°
CD7	CD6	H28	119.1°	90.0°
CD6	CD7	CD9	121.7°	90.0°
CD6	CD7	H29	119.1°	90.0°
CD9	CD7	H29	119.2°	90.0°
CD7	CD9	CD8	120.6°	90.0°
CD7	CD9	CD0	121.3°	90.0°
CD8	ND2	CDB	120.8°	90.0°
ND2	CD8	CD9	120.0°	90.0°
CD8	ND2	RU2	100.5°	90.0°
ND2	CDB	CDA	121.5°	90.0°
ND2	CDB	H32	119.2°	90.0°
CDB	ND2	RU2	138.7°	90.0°
CD8	CD9	CD0	118.1°	90.0°
CD9	CD0	CDA	118.5°	90.0°
CD9	CD0	H30	120.8°	90.0°
CDA	CD0	H30	120.7°	90.0°
CD0	CDA	CDB	121.1°	90.0°
CD0	CDA	H31	119.4°	90.0°
CDB	CDA	H31	119.4°	90.0°
CDA	CDB	H32	119.3°	90.0°
NA2	RU1	NB1	92.5°	90.0°
NA2	RU1	NB2	90.2°	90.0°
NA2	RU1	N24	170.1°	90.0°
NA2	RU1	N25	91.0°	90.0°
NB1	RU1	NB2	94.3°	90.0°
NB1	RU1	N24	97.4°	90.0°
NB1	RU1	N25	175.2°	90.0°
NB2	RU1	N24	89.0°	90.0°
NB2	RU1	N25	89.0°	90.0°
ND2	RU2	N4	174.6°	90.0°
ND2	RU2	NC2	85.8°	90.0°
ND2	RU2	N5	91.9°	90.0°
N4	RU2	NC2	90.3°	90.0°
N4	RU2	N5	84.1°	90.0°
RU2	N4	C4A	113.0°	90.0°
RU2	N4	C3	129.4°	90.0°
NC2	RU2	N5	84.8°	90.0°
RU2	N5	C4B	109.7°	90.0°
RU2	N5	C6	130.2°	90.0°
C31	C11	C10	124.8°	90.0°
C31	C11	C12	119.8°	90.0°
C11	C31	C32	123.4°	90.0°
C11	C31	C30	118.4°	90.0°
C11	C10	H33	119.3°	90.0°
C10	C11	C12	115.2°	90.0°
C11	C10	C9A	121.4°	90.0°
H33	C10	C9A	119.3°	90.0°
C11	C12	H34	118.8°	90.0°
C11	C12	C13	122.4°	90.0°
H34	C12	C13	118.8°	90.0°
C12	C13	H35	118.9°	90.0°
C12	C13	C9B	122.2°	90.0°
H35	C13	C9B	118.9°	90.0°
C13	C9B	C9A	115.6°	90.0°
C13	C9B	N14	122.5°	90.0°
C9B	C9A	C10	123.1°	90.0°
C9B	C9A	N9	117.4°	90.0°
C9A	C9B	N14	121.9°	90.0°
C10	C9A	N9	119.5°	90.0°
C9A	N9	C8B	121.7°	90.0°
C9B	N14	C8C	119.7°	90.0°
N14	C8C	C8B	117.3°	90.0°
N14	C8C	C8D	126.0°	90.0°
C8B	C8C	C8D	116.7°	90.0°
C8C	C8B	N9	122.0°	90.0°
C8C	C8B	C8A	120.0°	90.0°
C8C	C8D	C4A	121.3°	90.0°
C8C	C8D	C1	121.0°	90.0°
C8D	C4A	C4B	120.2°	90.0°
C8D	C4A	N4	124.7°	90.0°
C4A	C8D	C1	117.7°	90.0°
C4B	C4A	N4	115.2°	90.0°
C4A	C4B	C8A	120.6°	90.0°
C4A	C4B	N5	117.8°	90.0°
C4A	N4	C3	117.5°	90.0°
C2	C3	N4	120.8°	90.0°
C2	C3	H36	119.6°	90.0°
C3	C2	C1	122.0°	90.0°
C3	C2	H37	119.0°	90.0°
N4	C3	H36	119.6°	90.0°
C1	C2	H37	119.0°	90.0°
C2	C1	C8D	117.4°	90.0°
C2	C1	H38	121.3°	90.0°
C8D	C1	H38	121.3°	90.0°
N9	C8B	C8A	118.1°	90.0°
C8B	C8A	C8	118.9°	90.0°
C8B	C8A	C4B	121.3°	90.0°
C8	C8A	C4B	119.9°	90.0°
C8A	C8	H39	121.4°	90.0°
C8A	C8	C7	117.2°	90.0°
C8A	C4B	N5	121.6°	90.0°
H39	C8	C7	121.4°	90.0°
C8	C7	H40	119.4°	90.0°
C8	C7	C6	121.2°	90.0°
H40	C7	C6	119.4°	90.0°
C7	C6	H41	119.9°	90.0°
C7	C6	N5	120.1°	90.0°
H41	C6	N5	119.9°	90.0°
C4B	N5	C6	120.0°	90.0°
C32	C31	C30	117.4°	90.0°
C31	C32	C33	119.9°	90.0°
C31	C32	H43	120.1°	90.0°
C31	C30	C9C	123.1°	90.0°
C31	C30	H42	118.4°	90.0°
C9C	C30	H42	118.5°	90.0°
C30	C9C	C9D	118.3°	90.0°
C30	C9C	N29	121.8°	90.0°
C33	C32	H43	120.1°	90.0°
C32	C33	C9D	121.9°	90.0°
C32	C33	H44	119.1°	90.0°
C9D	C33	H44	119.1°	90.0°
C33	C9D	N	121.9°	90.0°
C33	C9D	C9C	119.1°	90.0°
N	C9D	C9C	119.0°	90.0°
C9D	N	C8G	121.0°	90.0°
C9D	C9C	N29	119.9°	90.0°
C9C	N29	C8F	121.3°	90.0°
N29	C8F	C8G	118.3°	90.0°
N29	C8F	C8E	123.8°	90.0°
N	C8G	C8H	122.5°	90.0°
N	C8G	C8F	120.6°	90.0°
C8G	C8H	C21	121.1°	90.0°
C8G	C8H	C4C	122.4°	90.0°
C8H	C8G	C8F	117.0°	90.0°
C21	C8H	C4C	116.5°	90.0°
C8H	C21	C22	119.2°	90.0°
C8H	C21	H47	120.4°	90.0°
C8H	C4C	N24	123.4°	90.0°
C8H	C4C	C4D	121.4°	90.0°
C4C	N24	C23	121.1°	90.0°
C4C	N24	RU1	116.5°	90.0°
N24	C4C	C4D	115.2°	90.0°
C23	N24	RU1	121.8°	90.0°
N24	C23	H45	120.5°	90.0°
N24	C23	C22	118.9°	90.0°
N24	RU1	N25	79.1°	90.0°
H45	C23	C22	120.5°	90.0°
C23	C22	H46	119.5°	90.0°
C23	C22	C21	120.9°	90.0°
H46	C22	C21	119.5°	90.0°
C22	C21	H47	120.4°	90.0°
C8G	C8F	C8E	117.9°	90.0°
C8F	C8E	C4D	121.6°	90.0°
C8F	C8E	C28	120.8°	90.0°
C8E	C4D	C4C	119.7°	90.0°
C8E	C4D	N25	126.1°	90.0°
C4D	C8E	C28	117.6°	90.0°
C4C	C4D	N25	114.1°	90.0°
C4D	N25	C26	115.2°	90.0°
C4D	N25	RU1	113.6°	90.0°
C8E	C28	C27	116.8°	90.0°
C8E	C28	H48	121.6°	90.0°
C27	C28	H48	121.6°	90.0°
C28	C27	C26	121.6°	90.0°
C28	C27	H49	119.2°	90.0°
C27	C26	N25	122.6°	90.0°
C26	C27	H49	119.1°	90.0°
C27	C26	H50	118.7°	90.0°
C26	N25	RU1	130.5°	90.0°
N25	C26	H50	118.7°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
NA1	CA1	H1	CA2	180.0°	90.0°
NA1	CA1	CA2	H2	179.8°	90.0°
NA1	CA1	CA2	CA3	0.1°	90.0°
CA1	NA1	RU1	CA4	176.4°	90.0°
CA1	NA1	CA4	CA8	180.0°	90.0°
CA1	NA1	CA4	CA5	0.3°	90.0°
CA1	NA1	RU1	NA2	179.8°	90.0°
CA1	NA1	RU1	NB1	87.0°	90.0°
CA1	NA1	RU1	NB2	63.4°	90.0°
CA1	NA1	RU1	N24	10.1°	90.0°
CA1	NA1	RU1	N25	89.7°	90.0°
H1	CA1	CA2	H2	0.2°	90.0°
H1	CA1	CA2	CA3	179.8°	90.0°
H1	CA1	NA1	RU1	4.0°	90.0°
H1	CA1	NA1	CA4	180.0°	90.0°
CA1	CA2	H2	CA3	180.0°	90.0°
CA1	CA2	CA3	CA5	0.1°	90.0°
CA1	CA2	CA3	H3	179.9°	90.0°
CA2	CA1	NA1	RU1	176.0°	90.0°
CA2	CA1	NA1	CA4	0.0°	90.0°
H2	CA2	CA3	CA5	179.9°	90.0°
H2	CA2	CA3	H3	0.1°	90.0°
CA2	CA3	CA5	H3	180.0°	90.0°
CA2	CA3	CA5	CA4	0.5°	90.0°
CA2	CA3	CA5	CA6	179.8°	90.0°
CA3	CA5	CA4	NA1	0.6°	90.0°
CA3	CA5	CA4	CA8	179.7°	90.0°
CA3	CA5	CA4	CA6	179.7°	90.0°
CA3	CA5	CA6	CA7	179.7°	90.0°
CA3	CA5	CA6	H4	0.3°	90.0°
H3	CA3	CA5	CA4	179.5°	90.0°
H3	CA3	CA5	CA6	0.2°	90.0°
RU1	NA1	CA4	CA8	2.7°	90.0°
RU1	NA1	CA4	CA5	177.0°	90.0°
NA1	RU1	NA2	CA8	3.3°	90.0°
NA1	RU1	NA2	CAB	179.2°	90.0°
NA1	RU1	NB1	CB1	5.0°	90.0°
NA1	RU1	NB1	CB4	169.1°	90.0°
NA1	RU1	NB2	CBB	28.9°	90.0°
NA1	RU1	NB2	CB8	143.8°	90.0°
NA1	RU1	NA2	NB1	93.8°	90.0°
NA1	RU1	NA2	NB2	171.9°	90.0°
NA1	RU1	NA2	N24	86.4°	90.0°
NA1	RU1	NA2	N25	82.9°	90.0°
NA1	RU1	NB1	NB2	175.5°	90.0°
NA1	RU1	NB1	N24	86.0°	90.0°
NA1	RU1	NB1	N25	42.7°	90.0°
NA1	RU1	NB2	N24	53.1°	90.0°
NA1	RU1	NB2	N25	26.1°	90.0°
NA1	RU1	N24	C4C	73.4°	90.0°
NA1	RU1	N24	C23	97.8°	90.0°
NA1	RU1	N24	N25	83.6°	90.0°
NA1	RU1	N25	C4D	76.9°	90.0°
NA1	RU1	N25	C26	93.2°	90.0°
NA1	CA4	CA8	CA5	179.7°	90.0°
NA1	CA4	CA5	CA6	179.7°	90.0°
NA1	CA4	CA8	NA2	0.1°	90.0°
NA1	CA4	CA8	CA9	179.8°	90.0°
CA4	NA1	RU1	NA2	3.4°	90.0°
CA4	NA1	RU1	NB1	89.4°	90.0°
CA4	NA1	RU1	NB2	120.2°	90.0°
CA4	NA1	RU1	N24	173.5°	90.0°
CA4	NA1	RU1	N25	93.9°	90.0°
CA8	CA4	CA5	CA6	0.0°	90.0°
CA4	CA8	CA9	CA7	0.2°	90.0°
CA4	CA8	NA2	CA9	179.7°	90.0°
CA4	CA8	NA2	CAB	179.5°	90.0°
CA4	CA8	CA9	CA0	179.8°	90.0°
CA4	CA8	NA2	RU1	2.7°	90.0°
CA4	CA5	CA6	CA7	0.0°	90.0°
CA4	CA5	CA6	H4	180.0°	90.0°
CA5	CA4	CA8	NA2	179.6°	90.0°
CA5	CA4	CA8	CA9	0.1°	90.0°
CA5	CA6	CA7	H4	180.0°	90.0°
CA5	CA6	CA7	CA9	0.1°	90.0°
CA5	CA6	CA7	H5	179.9°	90.0°
CA6	CA7	CA9	H5	180.0°	90.0°
CA6	CA7	CA9	CA8	0.1°	90.0°
CA6	CA7	CA9	CA0	179.8°	90.0°
H4	CA6	CA7	CA9	179.9°	90.0°
H4	CA6	CA7	H5	0.1°	90.0°
CA7	CA9	CA8	NA2	179.5°	90.0°
CA7	CA9	CA8	CA0	179.6°	90.0°
CA7	CA9	CA0	CAA	179.4°	90.0°
CA7	CA9	CA0	H6	0.6°	90.0°
H5	CA7	CA9	CA8	179.8°	90.0°
H5	CA7	CA9	CA0	0.2°	90.0°
CA8	NA2	CAB	RU1	175.4°	90.0°
NA2	CA8	CA9	CA0	0.1°	90.0°
CA8	NA2	CAB	CAA	0.3°	90.0°
CA8	NA2	CAB	H8	179.7°	90.0°
CA8	NA2	RU1	NB1	90.5°	90.0°
CA8	NA2	RU1	NB2	175.2°	90.0°
CA8	NA2	RU1	N24	89.7°	90.0°
CA8	NA2	RU1	N25	86.2°	90.0°
CAB	NA2	CA8	CA9	0.2°	90.0°
NA2	CAB	CAA	CA0	0.2°	90.0°
NA2	CAB	CAA	H8	180.0°	90.0°
NA2	CAB	CAA	H7	179.9°	90.0°
CAB	NA2	RU1	NB1	85.5°	90.0°
CAB	NA2	RU1	NB2	8.8°	90.0°
CAB	NA2	RU1	N24	94.3°	90.0°
CAB	NA2	RU1	N25	97.8°	90.0°
CA8	CA9	CA0	CAA	0.3°	90.0°
CA8	CA9	CA0	H6	179.8°	90.0°
CA9	CA8	NA2	RU1	177.0°	90.0°
CA9	CA0	CAA	H6	180.0°	90.0°
CA9	CA0	CAA	CAB	0.1°	90.0°
CA9	CA0	CAA	H7	179.8°	90.0°
CA0	CAA	CAB	H7	180.0°	90.0°
CA0	CAA	CAB	H8	179.8°	90.0°
H6	CA0	CAA	CAB	179.9°	90.0°
H6	CA0	CAA	H7	0.1°	90.0°
CAA	CAB	NA2	RU1	175.7°	90.0°
H7	CAA	CAB	H8	0.2°	90.0°
H8	CAB	NA2	RU1	4.3°	90.0°
NB1	CB1	CB2	H9	180.0°	90.0°
NB1	CB1	CB2	CB3	0.0°	90.0°
NB1	CB1	CB2	H10	180.0°	90.0°
CB1	NB1	CB4	RU1	175.5°	90.0°
CB1	NB1	CB4	CB8	179.6°	90.0°
CB1	NB1	CB4	CB5	0.3°	90.0°
CB1	NB1	RU1	NA2	89.0°	90.0°
CB1	NB1	RU1	NB2	179.5°	90.0°
CB1	NB1	RU1	N24	91.0°	90.0°
CB1	NB1	RU1	N25	47.7°	90.0°
CB1	CB2	CB3	H10	180.0°	90.0°
CB1	CB2	CB3	CB5	0.4°	90.0°
CB1	CB2	CB3	H11	179.6°	90.0°
CB2	CB1	NB1	CB4	0.3°	90.0°
CB2	CB1	NB1	RU1	172.9°	90.0°
H9	CB1	CB2	CB3	180.0°	90.0°
H9	CB1	CB2	H10	0.0°	90.0°
H9	CB1	NB1	CB4	179.7°	90.0°
H9	CB1	NB1	RU1	7.1°	90.0°
CB2	CB3	CB5	H11	180.0°	90.0°
CB2	CB3	CB5	CB4	0.4°	90.0°
CB2	CB3	CB5	CB6	179.7°	90.0°
H10	CB2	CB3	CB5	179.6°	90.0°
H10	CB2	CB3	H11	0.4°	90.0°
CB3	CB5	CB4	NB1	0.0°	90.0°
CB3	CB5	CB4	CB8	179.9°	90.0°
CB3	CB5	CB4	CB6	179.9°	90.0°
CB3	CB5	CB6	CB7	179.7°	90.0°
CB3	CB5	CB6	H12	0.3°	90.0°
H11	CB3	CB5	CB4	179.6°	90.0°
H11	CB3	CB5	CB6	0.3°	90.0°
NB1	CB4	CB8	CB5	179.9°	90.0°
NB1	CB4	CB5	CB6	179.9°	90.0°
NB1	CB4	CB8	CB9	179.6°	90.0°
NB1	CB4	CB8	NB2	0.3°	90.0°
CB4	NB1	RU1	NA2	96.9°	90.0°
CB4	NB1	RU1	NB2	6.4°	90.0°
CB4	NB1	RU1	N24	83.1°	90.0°
CB4	NB1	RU1	N25	126.4°	90.0°
CB8	CB4	CB5	CB6	0.2°	90.0°
CB4	CB8	CB9	NB2	179.9°	90.0°
CB4	CB8	NB2	CBB	179.6°	90.0°
CB4	CB8	CB9	CB0	179.9°	90.0°
CB4	CB8	CB9	CB7	0.4°	90.0°
CB8	CB4	NB1	RU1	4.9°	90.0°
CB4	CB8	NB2	RU1	5.4°	90.0°
CB4	CB5	CB6	CB7	0.2°	90.0°
CB4	CB5	CB6	H12	179.8°	90.0°
CB5	CB4	CB8	CB9	0.5°	90.0°
CB5	CB4	CB8	NB2	179.6°	90.0°
CB5	CB4	NB1	RU1	175.2°	90.0°
CB5	CB6	CB7	H12	180.0°	90.0°
CB5	CB6	CB7	H13	179.7°	90.0°
CB5	CB6	CB7	CB9	0.3°	90.0°
CB6	CB7	H13	CB9	180.0°	90.0°
CB6	CB7	CB9	CB8	0.0°	90.0°
CB6	CB7	CB9	CB0	179.7°	90.0°
H12	CB6	CB7	H13	0.3°	90.0°
H12	CB6	CB7	CB9	179.7°	90.0°
H13	CB7	CB9	CB8	180.0°	90.0°
H13	CB7	CB9	CB0	0.3°	90.0°
CB9	CB8	NB2	CBB	0.3°	90.0°
CB8	CB9	CB0	CB7	179.7°	90.0°
CB8	CB9	CB0	H14	179.7°	90.0°
CB8	CB9	CB0	CBA	0.3°	90.0°
CB9	CB8	NB2	RU1	174.5°	90.0°
CBB	NB2	CB8	RU1	174.2°	90.0°
NB2	CBB	CBA	CB0	0.1°	90.0°
NB2	CBB	CBA	H15	179.9°	90.0°
NB2	CBB	CBA	H16	180.0°	90.0°
CBB	NB2	RU1	NA2	88.2°	90.0°
CBB	NB2	RU1	NB1	179.3°	90.0°
CBB	NB2	RU1	N24	82.0°	90.0°
CBB	NB2	RU1	N25	2.8°	90.0°
NB2	CB8	CB9	CB0	0.0°	90.0°
NB2	CB8	CB9	CB7	179.7°	90.0°
CB8	NB2	CBB	CBA	0.3°	90.0°
CB8	NB2	CBB	H16	179.7°	90.0°
CB8	NB2	RU1	NA2	99.1°	90.0°
CB8	NB2	RU1	NB1	6.6°	90.0°
CB8	NB2	RU1	N24	90.7°	90.0°
CB8	NB2	RU1	N25	169.8°	90.0°
CB9	CB0	H14	CBA	180.0°	90.0°
CB9	CB0	CBA	H15	179.8°	90.0°
CB9	CB0	CBA	CBB	0.2°	90.0°
CB7	CB9	CB0	H14	0.1°	90.0°
CB7	CB9	CB0	CBA	179.9°	90.0°
H14	CB0	CBA	H15	0.2°	90.0°
H14	CB0	CBA	CBB	179.8°	90.0°
CB0	CBA	H15	CBB	180.0°	90.0°
CB0	CBA	CBB	H16	179.9°	90.0°
H15	CBA	CBB	H16	0.1°	90.0°
CBA	CBB	NB2	RU1	172.0°	90.0°
H16	CBB	NB2	RU1	8.0°	90.0°
NC1	CC1	H17	CC2	180.0°	90.0°
NC1	CC1	CC2	CC3	0.0°	90.0°
NC1	CC1	CC2	H18	180.0°	90.0°
CC1	NC1	CC4	RU2	178.9°	90.0°
CC1	NC1	CC4	CC8	179.8°	90.0°
CC1	NC1	CC4	CC5	0.4°	90.0°
CC1	NC1	RU2	ND1	0.6°	90.0°
CC1	NC1	RU2	ND2	93.3°	90.0°
CC1	NC1	RU2	N4	90.1°	90.0°
CC1	NC1	RU2	NC2	179.6°	90.0°
CC1	NC1	RU2	N5	77.5°	90.0°
H17	CC1	CC2	CC3	179.9°	90.0°
H17	CC1	CC2	H18	0.0°	90.0°
H17	CC1	NC1	CC4	179.7°	90.0°
H17	CC1	NC1	RU2	1.4°	90.0°
CC3	CC2	CC1	H18	180.0°	90.0°
CC2	CC3	CC5	H19	180.0°	90.0°
CC2	CC3	CC5	CC6	180.0°	90.0°
CC2	CC3	CC5	CC4	0.1°	90.0°
CC1	CC2	CC3	CC5	0.0°	90.0°
CC1	CC2	CC3	H19	179.9°	90.0°
CC2	CC1	NC1	CC4	0.3°	90.0°
CC2	CC1	NC1	RU2	178.6°	90.0°
H18	CC2	CC3	CC5	179.9°	90.0°
H18	CC2	CC3	H19	0.1°	90.0°
CC3	CC5	CC4	NC1	0.3°	90.0°
CC3	CC5	CC4	CC8	179.9°	90.0°
CC3	CC5	CC6	CC4	179.9°	90.0°
CC3	CC5	CC6	CC7	179.8°	90.0°
CC3	CC5	CC6	H20	0.2°	90.0°
H19	CC3	CC5	CC6	0.0°	90.0°
H19	CC3	CC5	CC4	179.9°	90.0°
NC1	CC4	CC8	CC5	179.8°	90.0°
NC1	CC4	CC5	CC6	179.8°	90.0°
NC1	CC4	CC8	CC9	179.7°	90.0°
NC1	CC4	CC8	NC2	0.2°	90.0°
CC4	NC1	RU2	ND1	179.1°	90.0°
CC4	NC1	RU2	ND2	85.2°	90.0°
CC4	NC1	RU2	N4	91.4°	90.0°
CC4	NC1	RU2	NC2	1.0°	90.0°
CC4	NC1	RU2	N5	104.0°	90.0°
RU2	NC1	CC4	CC8	0.9°	90.0°
RU2	NC1	CC4	CC5	179.3°	90.0°
NC1	RU2	NC2	CC8	1.0°	90.0°
NC1	RU2	NC2	CCB	179.4°	90.0°
NC1	RU2	ND1	CD1	85.7°	90.0°
NC1	RU2	ND1	ND2	93.8°	90.0°
NC1	RU2	ND1	N4	89.9°	90.0°
NC1	RU2	ND1	NC2	94.7°	90.0°
NC1	RU2	ND1	N5	173.9°	90.0°
NC1	RU2	ND1	CD4	93.5°	90.0°
NC1	RU2	ND2	CD8	83.1°	90.0°
NC1	RU2	ND2	CDB	96.1°	90.0°
NC1	RU2	ND2	N4	140.2°	90.0°
NC1	RU2	ND2	NC2	96.4°	90.0°
NC1	RU2	ND2	N5	179.0°	90.0°
NC1	RU2	N4	NC2	96.6°	90.0°
NC1	RU2	N4	N5	178.6°	90.0°
NC1	RU2	NC2	N5	173.9°	90.0°
NC1	RU2	N4	C4A	174.8°	90.0°
NC1	RU2	N4	C3	1.9°	90.0°
NC1	RU2	N5	C4B	8.7°	90.0°
NC1	RU2	N5	C6	167.5°	90.0°
CC8	CC4	CC5	CC6	0.0°	90.0°
CC4	CC8	CC9	CC7	0.2°	90.0°
CC4	CC8	CC9	NC2	179.9°	90.0°
CC4	CC8	NC2	CCB	179.6°	90.0°
CC4	CC8	CC9	CC0	179.8°	90.0°
CC4	CC8	NC2	RU2	0.7°	90.0°
CC5	CC6	CC7	H20	180.0°	90.0°
CC5	CC6	CC7	CC9	0.3°	90.0°
CC5	CC6	CC7	H21	179.7°	90.0°
CC4	CC5	CC6	CC7	0.1°	90.0°
CC4	CC5	CC6	H20	179.9°	90.0°
CC5	CC4	CC8	CC9	0.1°	90.0°
CC5	CC4	CC8	NC2	180.0°	90.0°
CC6	CC7	CC9	H21	180.0°	90.0°
CC6	CC7	CC9	CC8	0.3°	90.0°
CC6	CC7	CC9	CC0	179.7°	90.0°
H20	CC6	CC7	CC9	179.8°	90.0°
H20	CC6	CC7	H21	0.3°	90.0°
CC7	CC9	CC8	CC0	180.0°	90.0°
CC7	CC9	CC8	NC2	179.8°	90.0°
CC7	CC9	CC0	CCA	180.0°	90.0°
CC7	CC9	CC0	H22	0.0°	90.0°
H21	CC7	CC9	CC8	179.6°	90.0°
H21	CC7	CC9	CC0	0.3°	90.0°
CC9	CC8	NC2	CCB	0.3°	90.0°
CC8	CC9	CC0	CCA	0.0°	90.0°
CC8	CC9	CC0	H22	179.9°	90.0°
CC9	CC8	NC2	RU2	179.4°	90.0°
CC8	NC2	CCB	RU2	179.6°	90.0°
NC2	CC8	CC9	CC0	0.1°	90.0°
CC8	NC2	CCB	CCA	0.3°	90.0°
CC8	NC2	CCB	H24	179.7°	90.0°
CC8	NC2	RU2	ND1	95.7°	90.0°
CC8	NC2	RU2	ND2	92.9°	90.0°
CC8	NC2	RU2	N4	90.8°	90.0°
CC8	NC2	RU2	N5	174.8°	90.0°
NC2	CCB	CCA	CC0	0.1°	90.0°
NC2	CCB	CCA	H23	179.9°	90.0°
NC2	CCB	CCA	H24	180.0°	90.0°
CCB	NC2	RU2	ND1	84.7°	90.0°
CCB	NC2	RU2	ND2	86.7°	90.0°
CCB	NC2	RU2	N4	89.6°	90.0°
CCB	NC2	RU2	N5	5.5°	90.0°
CC9	CC0	CCA	H22	180.0°	90.0°
CC9	CC0	CCA	H23	180.0°	90.0°
CC9	CC0	CCA	CCB	0.0°	90.0°
CC0	CCA	H23	CCB	180.0°	90.0°
CC0	CCA	CCB	H24	179.9°	90.0°
H22	CC0	CCA	H23	0.1°	90.0°
H22	CC0	CCA	CCB	179.9°	90.0°
H23	CCA	CCB	H24	0.1°	90.0°
CCA	CCB	NC2	RU2	179.3°	90.0°
H24	CCB	NC2	RU2	0.7°	90.0°
ND1	CD1	H25	CD2	180.0°	90.0°
ND1	CD1	CD2	H26	179.9°	90.0°
ND1	CD1	CD2	CD3	0.1°	90.0°
CD1	ND1	RU2	CD4	179.2°	90.0°
CD1	ND1	CD4	CD8	179.5°	90.0°
CD1	ND1	CD4	CD5	0.6°	90.0°
CD1	ND1	RU2	ND2	179.5°	90.0°
CD1	ND1	RU2	N4	4.2°	90.0°
CD1	ND1	RU2	NC2	9.0°	90.0°
CD1	ND1	RU2	N5	88.2°	90.0°
H25	CD1	CD2	H26	0.1°	90.0°
H25	CD1	CD2	CD3	179.9°	90.0°
H25	CD1	ND1	RU2	0.5°	90.0°
H25	CD1	ND1	CD4	179.6°	90.0°
CD1	CD2	H26	CD3	180.0°	90.0°
CD1	CD2	CD3	CD5	0.0°	90.0°
CD1	CD2	CD3	H27	180.0°	90.0°
CD2	CD1	ND1	RU2	179.5°	90.0°
CD2	CD1	ND1	CD4	0.4°	90.0°
H26	CD2	CD3	CD5	180.0°	90.0°
H26	CD2	CD3	H27	0.0°	90.0°
CD2	CD3	CD5	H27	180.0°	90.0°
CD2	CD3	CD5	CD4	0.2°	90.0°
CD2	CD3	CD5	CD6	179.9°	90.0°
CD3	CD5	CD4	ND1	0.5°	90.0°
CD3	CD5	CD4	CD8	179.6°	90.0°
CD3	CD5	CD4	CD6	179.7°	90.0°
CD3	CD5	CD6	CD7	179.7°	90.0°
CD3	CD5	CD6	H28	0.4°	90.0°
H27	CD3	CD5	CD4	179.8°	90.0°
H27	CD3	CD5	CD6	0.1°	90.0°
RU2	ND1	CD4	CD8	0.1°	90.0°
RU2	ND1	CD4	CD5	180.0°	90.0°
ND1	RU2	ND2	CD8	0.5°	90.0°
ND1	RU2	ND2	CDB	179.8°	90.0°
ND1	RU2	ND2	N4	136.1°	90.0°
ND1	RU2	ND2	NC2	180.0°	90.0°
ND1	RU2	ND2	N5	95.3°	90.0°
ND1	RU2	N4	NC2	180.0°	90.0°
ND1	RU2	N4	N5	95.3°	90.0°
ND1	RU2	NC2	N5	79.2°	90.0°
ND1	RU2	N4	C4A	91.4°	90.0°
ND1	RU2	N4	C3	85.3°	90.0°
ND1	RU2	N5	C4B	85.0°	90.0°
ND1	RU2	N5	C6	91.3°	90.0°
ND1	CD4	CD8	CD5	179.9°	90.0°
ND1	CD4	CD5	CD6	179.7°	90.0°
ND1	CD4	CD8	ND2	0.4°	90.0°
ND1	CD4	CD8	CD9	179.9°	90.0°
CD4	ND1	RU2	ND2	0.4°	90.0°
CD4	ND1	RU2	N4	176.6°	90.0°
CD4	ND1	RU2	NC2	171.8°	90.0°
CD4	ND1	RU2	N5	92.6°	90.0°
CD8	CD4	CD5	CD6	0.2°	90.0°
CD4	CD8	CD9	CD7	0.3°	90.0°
CD4	CD8	ND2	CD9	179.5°	90.0°
CD4	CD8	ND2	CDB	180.0°	90.0°
CD4	CD8	CD9	CD0	179.9°	90.0°
CD4	CD8	ND2	RU2	0.6°	90.0°
CD4	CD5	CD6	CD7	0.1°	90.0°
CD4	CD5	CD6	H28	179.9°	90.0°
CD5	CD4	CD8	ND2	179.5°	90.0°
CD5	CD4	CD8	CD9	0.0°	90.0°
CD5	CD6	CD7	H28	180.0°	90.0°
CD5	CD6	CD7	CD9	0.2°	90.0°
CD5	CD6	CD7	H29	179.8°	90.0°
CD6	CD7	CD9	H29	180.0°	90.0°
CD6	CD7	CD9	CD8	0.4°	90.0°
CD6	CD7	CD9	CD0	180.0°	90.0°
H28	CD6	CD7	CD9	179.8°	90.0°
H28	CD6	CD7	H29	0.2°	90.0°
CD7	CD9	CD8	ND2	179.3°	90.0°
CD7	CD9	CD8	CD0	179.6°	90.0°
CD7	CD9	CD0	CDA	179.5°	90.0°
CD7	CD9	CD0	H30	0.5°	90.0°
H29	CD7	CD9	CD8	179.6°	90.0°
H29	CD7	CD9	CD0	0.0°	90.0°
CD8	ND2	CDB	RU2	179.2°	90.0°
ND2	CD8	CD9	CD0	0.4°	90.0°
CD8	ND2	CDB	CDA	0.3°	90.0°
CD8	ND2	CDB	H32	179.7°	90.0°
CD8	ND2	RU2	N4	136.6°	90.0°
CD8	ND2	RU2	NC2	179.5°	90.0°
CD8	ND2	RU2	N5	95.9°	90.0°
CDB	ND2	CD8	CD9	0.4°	90.0°
ND2	CDB	CDA	CD0	0.0°	90.0°
ND2	CDB	CDA	H32	180.0°	90.0°
ND2	CDB	CDA	H31	180.0°	90.0°
CDB	ND2	RU2	N4	44.1°	90.0°
CDB	ND2	RU2	NC2	0.2°	90.0°
CDB	ND2	RU2	N5	84.9°	90.0°
CD8	CD9	CD0	CDA	0.1°	90.0°
CD8	CD9	CD0	H30	179.9°	90.0°
CD9	CD8	ND2	RU2	179.9°	90.0°
CD9	CD0	CDA	H30	180.0°	90.0°
CD9	CD0	CDA	CDB	0.1°	90.0°
CD9	CD0	CDA	H31	179.9°	90.0°
CD0	CDA	CDB	H31	180.0°	90.0°
CD0	CDA	CDB	H32	180.0°	90.0°
H30	CD0	CDA	CDB	179.9°	90.0°
H30	CD0	CDA	H31	0.1°	90.0°
CDA	CDB	ND2	RU2	179.4°	90.0°
H31	CDA	CDB	H32	0.0°	90.0°
H32	CDB	ND2	RU2	0.6°	90.0°
NA2	RU1	NB1	NB2	90.4°	90.0°
NA2	RU1	NB1	N24	180.0°	90.0°
NA2	RU1	NB1	N25	136.7°	90.0°
NA2	RU1	NB2	N24	170.2°	90.0°
NA2	RU1	NB2	N25	91.0°	90.0°
NA2	RU1	N24	C4C	13.8°	90.0°
NA2	RU1	N24	C23	175.0°	90.0°
NA2	RU1	N24	N25	3.6°	90.0°
NA2	RU1	N25	C4D	170.6°	90.0°
NA2	RU1	N25	C26	0.6°	90.0°
NB1	RU1	NB2	N24	97.3°	90.0°
NB1	RU1	NB2	N25	176.5°	90.0°
NB1	RU1	N24	C4C	166.4°	90.0°
NB1	RU1	N24	C23	4.8°	90.0°
NB1	RU1	N24	N25	176.6°	90.0°
NB1	RU1	N25	C4D	33.8°	90.0°
NB1	RU1	N25	C26	136.2°	90.0°
NB2	RU1	N24	C4C	99.4°	90.0°
NB2	RU1	N24	C23	89.4°	90.0°
NB2	RU1	N24	N25	89.2°	90.0°
NB2	RU1	N25	C4D	99.1°	90.0°
NB2	RU1	N25	C26	90.8°	90.0°
ND2	RU2	N4	NC2	43.7°	90.0°
ND2	RU2	N4	N5	41.0°	90.0°
ND2	RU2	NC2	N5	92.3°	90.0°
ND2	RU2	N4	C4A	44.8°	90.0°
ND2	RU2	N4	C3	138.5°	90.0°
ND2	RU2	N5	C4B	179.6°	90.0°
ND2	RU2	N5	C6	3.3°	90.0°
N4	RU2	NC2	N5	84.0°	90.0°
RU2	N4	C4A	C8D	177.0°	90.0°
RU2	N4	C4A	C4B	3.0°	90.0°
RU2	N4	C4A	C3	177.1°	90.0°
RU2	N4	C3	C2	176.3°	90.0°
RU2	N4	C3	H36	3.7°	90.0°
N4	RU2	N5	C4B	4.0°	90.0°
N4	RU2	N5	C6	179.8°	90.0°
NC2	RU2	N4	C4A	88.6°	90.0°
NC2	RU2	N4	C3	94.8°	90.0°
NC2	RU2	N5	C4B	94.8°	90.0°
NC2	RU2	N5	C6	88.9°	90.0°
RU2	N5	C4B	C4A	3.5°	90.0°
N5	RU2	N4	C4A	3.8°	90.0°
N5	RU2	N4	C3	179.5°	90.0°
RU2	N5	C4B	C8A	176.7°	90.0°
RU2	N5	C6	C7	175.9°	90.0°
RU2	N5	C6	H41	4.1°	90.0°
RU2	N5	C4B	C6	176.7°	90.0°
C31	C11	C10	C12	174.6°	90.0°
C31	C11	C10	H33	3.9°	90.0°
C31	C11	C12	H34	3.8°	90.0°
C31	C11	C12	C13	176.2°	90.0°
C31	C11	C10	C9A	176.2°	90.0°
C11	C31	C32	C30	169.1°	90.0°
C11	C31	C30	C9C	176.7°	90.0°
C11	C31	C30	H42	3.3°	90.0°
C11	C31	C32	C33	176.0°	90.0°
C11	C31	C32	H43	4.0°	90.0°
C11	C10	H33	C9A	180.0°	90.0°
C10	C11	C12	H34	178.7°	90.0°
C10	C11	C12	C13	1.3°	90.0°
C11	C10	C9A	C9B	1.0°	90.0°
C11	C10	C9A	N9	178.9°	90.0°
C10	C11	C31	C32	27.2°	90.0°
C10	C11	C31	C30	163.8°	90.0°
H33	C10	C11	C12	178.4°	90.0°
H33	C10	C9A	C9B	179.0°	90.0°
H33	C10	C9A	N9	1.1°	90.0°
C11	C12	H34	C13	180.0°	90.0°
C11	C12	C13	H35	179.5°	90.0°
C11	C12	C13	C9B	0.5°	90.0°
C12	C11	C10	C9A	1.6°	90.0°
C12	C11	C31	C32	147.2°	90.0°
C12	C11	C31	C30	21.8°	90.0°
H34	C12	C13	H35	0.5°	90.0°
H34	C12	C13	C9B	179.5°	90.0°
C12	C13	H35	C9B	180.0°	90.0°
C12	C13	C9B	C9A	0.1°	90.0°
C12	C13	C9B	N14	179.9°	90.0°
H35	C13	C9B	C9A	179.9°	90.0°
H35	C13	C9B	N14	0.1°	90.0°
C13	C9B	C9A	N14	180.0°	90.0°
C13	C9B	C9A	C10	0.1°	90.0°
C13	C9B	C9A	N9	179.8°	90.0°
C13	C9B	N14	C8C	179.8°	90.0°
C9B	C9A	C10	N9	180.0°	90.0°
C9A	C9B	N14	C8C	0.2°	90.0°
C9B	C9A	N9	C8B	0.4°	90.0°
C10	C9A	C9B	N14	179.9°	90.0°
C10	C9A	N9	C8B	179.6°	90.0°
N9	C9A	C9B	N14	0.2°	90.0°
C9A	N9	C8B	C8C	0.3°	90.0°
C9A	N9	C8B	C8A	179.7°	90.0°
C9B	N14	C8C	C8B	0.3°	90.0°
C9B	N14	C8C	C8D	179.8°	90.0°
N14	C8C	C8B	C8D	180.0°	90.0°
N14	C8C	C8D	C4A	180.0°	90.0°
N14	C8C	C8D	C1	0.3°	90.0°
N14	C8C	C8B	N9	0.0°	90.0°
N14	C8C	C8B	C8A	179.9°	90.0°
C8B	C8C	C8D	C4A	0.0°	90.0°
C8B	C8C	C8D	C1	179.7°	90.0°
C8C	C8B	N9	C8A	180.0°	90.0°
C8C	C8B	C8A	C8	179.5°	90.0°
C8C	C8B	C8A	C4B	0.0°	90.0°
C8C	C8D	C4A	C1	179.7°	90.0°
C8C	C8D	C4A	C4B	0.2°	90.0°
C8C	C8D	C4A	N4	179.8°	90.0°
C8C	C8D	C1	C2	179.8°	90.0°
C8C	C8D	C1	H38	0.2°	90.0°
C8D	C8C	C8B	N9	180.0°	90.0°
C8D	C8C	C8B	C8A	0.0°	90.0°
C8D	C4A	C4B	N4	179.9°	90.0°
C8D	C4A	N4	C3	0.1°	90.0°
C4A	C8D	C1	C2	0.2°	90.0°
C4A	C8D	C1	H38	179.8°	90.0°
C8D	C4A	C4B	C8A	0.2°	90.0°
C8D	C4A	C4B	N5	179.5°	90.0°
C4B	C4A	N4	C3	179.9°	90.0°
C4B	C4A	C8D	C1	179.8°	90.0°
C4A	C4B	C8A	C8B	0.2°	90.0°
C4A	C4B	C8A	C8	179.7°	90.0°
C4A	C4B	C8A	N5	179.8°	90.0°
C4A	C4B	N5	C6	179.8°	90.0°
C4A	N4	C3	C2	0.3°	90.0°
C4A	N4	C3	H36	179.7°	90.0°
N4	C4A	C8D	C1	0.1°	90.0°
N4	C4A	C4B	C8A	179.7°	90.0°
N4	C4A	C4B	N5	0.5°	90.0°
C2	C3	N4	H36	180.0°	90.0°
C3	C2	C1	H37	180.0°	90.0°
C3	C2	C1	C8D	0.0°	90.0°
C3	C2	C1	H38	180.0°	90.0°
N4	C3	C2	C1	0.2°	90.0°
N4	C3	C2	H37	179.8°	90.0°
H36	C3	C2	C1	179.8°	90.0°
H36	C3	C2	H37	0.2°	90.0°
C2	C1	C8D	H38	180.0°	90.0°
H37	C2	C1	C8D	179.9°	90.0°
H37	C2	C1	H38	0.0°	90.0°
N9	C8B	C8A	C8	0.4°	90.0°
N9	C8B	C8A	C4B	179.9°	90.0°
C8B	C8A	C8	C4B	179.5°	90.0°
C8B	C8A	C8	H39	0.2°	90.0°
C8B	C8A	C8	C7	179.8°	90.0°
C8B	C8A	C4B	N5	179.6°	90.0°
C8A	C8	H39	C7	180.0°	90.0°
C8A	C8	C7	H40	179.7°	90.0°
C8A	C8	C7	C6	0.3°	90.0°
C8	C8A	C4B	N5	0.1°	90.0°
C4B	C8A	C8	H39	179.7°	90.0°
C4B	C8A	C8	C7	0.3°	90.0°
C8A	C4B	N5	C6	0.0°	90.0°
H39	C8	C7	H40	0.3°	90.0°
H39	C8	C7	C6	179.7°	90.0°
C8	C7	H40	C6	180.0°	90.0°
C8	C7	C6	H41	179.8°	90.0°
C8	C7	C6	N5	0.2°	90.0°
H40	C7	C6	H41	0.2°	90.0°
H40	C7	C6	N5	179.8°	90.0°
C7	C6	H41	N5	180.0°	90.0°
C7	C6	N5	C4B	0.1°	90.0°
H41	C6	N5	C4B	179.9°	90.0°
C32	C31	C30	C9C	7.1°	90.0°
C32	C31	C30	H42	172.9°	90.0°
C31	C32	C33	H43	180.0°	90.0°
C31	C32	C33	C9D	3.6°	90.0°
C31	C32	C33	H44	176.4°	90.0°
C31	C30	C9C	H42	180.0°	90.0°
C30	C31	C32	C33	6.9°	90.0°
C30	C31	C32	H43	173.1°	90.0°
C31	C30	C9C	C9D	3.5°	90.0°
C31	C30	C9C	N29	176.5°	90.0°
C30	C9C	C9D	C33	0.2°	90.0°
C30	C9C	C9D	N	179.7°	90.0°
C30	C9C	C9D	N29	180.0°	90.0°
C30	C9C	N29	C8F	179.6°	90.0°
H42	C30	C9C	C9D	176.5°	90.0°
H42	C30	C9C	N29	3.5°	90.0°
C32	C33	C9D	H44	180.0°	90.0°
C32	C33	C9D	N	179.6°	90.0°
C32	C33	C9D	C9C	0.1°	90.0°
H43	C32	C33	C9D	176.4°	90.0°
H43	C32	C33	H44	3.6°	90.0°
C33	C9D	N	C9C	179.5°	90.0°
C33	C9D	C9C	N29	179.8°	90.0°
C33	C9D	N	C8G	179.5°	90.0°
H44	C33	C9D	N	0.4°	90.0°
H44	C33	C9D	C9C	179.9°	90.0°
N	C9D	C9C	N29	0.3°	90.0°
C9D	N	C8G	C8H	179.9°	90.0°
C9D	N	C8G	C8F	0.2°	90.0°
C9D	C9C	N29	C8F	0.3°	90.0°
C9C	C9D	N	C8G	0.0°	90.0°
C9C	N29	C8F	C8G	0.1°	90.0°
C9C	N29	C8F	C8E	179.9°	90.0°
N29	C8F	C8G	N	0.1°	90.0°
N29	C8F	C8G	C8H	180.0°	90.0°
N29	C8F	C8G	C8E	179.9°	90.0°
N29	C8F	C8E	C4D	179.9°	90.0°
N29	C8F	C8E	C28	0.1°	90.0°
N	C8G	C8H	C8F	179.9°	90.0°
N	C8G	C8H	C21	0.0°	90.0°
N	C8G	C8H	C4C	179.8°	90.0°
N	C8G	C8F	C8E	179.8°	90.0°
C8G	C8H	C21	C4C	179.8°	90.0°
C8G	C8H	C4C	N24	179.7°	90.0°
C8G	C8H	C21	C22	179.9°	90.0°
C8G	C8H	C21	H47	0.1°	90.0°
C8H	C8G	C8F	C8E	0.1°	90.0°
C8G	C8H	C4C	C4D	0.1°	90.0°
C21	C8H	C4C	N24	0.1°	90.0°
C8H	C21	C22	C23	0.1°	90.0°
C8H	C21	C22	H46	179.9°	90.0°
C8H	C21	C22	H47	180.0°	90.0°
C21	C8H	C8G	C8F	179.9°	90.0°
C21	C8H	C4C	C4D	179.8°	90.0°
C8H	C4C	N24	C4D	179.7°	90.0°
C8H	C4C	N24	C23	0.3°	90.0°
C8H	C4C	N24	RU1	171.5°	90.0°
C4C	C8H	C21	C22	0.1°	90.0°
C4C	C8H	C21	H47	179.9°	90.0°
C4C	C8H	C8G	C8F	0.1°	90.0°
C8H	C4C	C4D	C8E	0.1°	90.0°
C8H	C4C	C4D	N25	179.7°	90.0°
C4C	N24	C23	RU1	170.8°	90.0°
C4C	N24	C23	H45	179.8°	90.0°
C4C	N24	C23	C22	0.2°	90.0°
N24	C4C	C4D	C8E	179.8°	90.0°
N24	C4C	C4D	N25	0.0°	90.0°
C4C	N24	RU1	N25	10.2°	90.0°
N24	C23	H45	C22	180.0°	90.0°
N24	C23	C22	H46	180.0°	90.0°
N24	C23	C22	C21	0.0°	90.0°
C23	N24	C4C	C4D	179.9°	90.0°
C23	N24	RU1	N25	178.6°	90.0°
RU1	N24	C23	H45	9.0°	90.0°
RU1	N24	C23	C22	171.0°	90.0°
RU1	N24	C4C	C4D	8.8°	90.0°
N24	RU1	N25	C4D	10.0°	90.0°
N24	RU1	N25	C26	180.0°	90.0°
H45	C23	C22	H46	0.0°	90.0°
H45	C23	C22	C21	180.0°	90.0°
C23	C22	H46	C21	180.0°	90.0°
C23	C22	C21	H47	179.9°	90.0°
H46	C22	C21	H47	0.1°	90.0°
C8G	C8F	C8E	C4D	0.0°	90.0°
C8G	C8F	C8E	C28	179.8°	90.0°
C8F	C8E	C4D	C28	179.8°	90.0°
C8F	C8E	C4D	C4C	0.1°	90.0°
C8F	C8E	C4D	N25	179.7°	90.0°
C8F	C8E	C28	C27	179.8°	90.0°
C8F	C8E	C28	H48	0.2°	90.0°
C8E	C4D	C4C	N25	179.8°	90.0°
C4D	C8E	C28	C27	0.1°	90.0°
C4D	C8E	C28	H48	179.9°	90.0°
C8E	C4D	N25	C26	0.3°	90.0°
C8E	C4D	N25	RU1	171.9°	90.0°
C4C	C4D	C8E	C28	179.9°	90.0°
C4C	C4D	N25	C26	179.9°	90.0°
C4C	C4D	N25	RU1	8.3°	90.0°
N25	C4D	C8E	C28	0.2°	90.0°
C4D	N25	C26	C27	0.3°	90.0°
C4D	N25	C26	RU1	169.9°	90.0°
C4D	N25	C26	H50	179.7°	90.0°
C8E	C28	C27	H48	180.0°	90.0°
C8E	C28	C27	C26	0.1°	90.0°
C8E	C28	C27	H49	179.9°	90.0°
C28	C27	C26	H49	180.0°	90.0°
C28	C27	C26	N25	0.2°	90.0°
C28	C27	C26	H50	179.7°	90.0°
H48	C28	C27	C26	179.9°	90.0°
H48	C28	C27	H49	0.1°	90.0°
C27	C26	N25	H50	180.0°	90.0°
C27	C26	N25	RU1	170.2°	90.0°
N25	C26	C27	H49	179.8°	90.0°
RU1	N25	C26	H50	9.7°	90.0°
H49	C27	C26	H50	0.3°	90.0°

Release date:	2014-03-05
Definition date:	2012-10-05
Last modified:	2014-02-28
Release status:	REL
Processing site:	RCSB
Derived from:	4GQJ