BW9

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CMC	C2C	sing	0.00Å	1.51Å
CBC	CAC	doub	0.00Å	1.29Å
CAC	C3C	sing	0.00Å	1.47Å
C2C	C3C	doub	0.00Å	1.40Å
C2C	C1C	sing	0.00Å	1.43Å
C3C	C4C	sing	0.00Å	1.42Å
CBB	CAB	doub	0.00Å	1.30Å
C1C	CHC	doub	0.00Å	1.38Å
C1C	NC	sing	0.00Å	1.38Å
CHC	C4B	sing	0.00Å	1.40Å
CAB	C3B	sing	0.00Å	1.43Å
C4C	NC	doub	0.00Å	1.38Å
C4C	CHD	sing	0.00Å	1.39Å
NC	CR	sing	0.00Å	2.08Å
CHD	C1D	doub	0.00Å	1.39Å
C4B	C3B	doub	0.00Å	1.39Å	Aromatic
C4B	NB	sing	0.00Å	1.38Å	Aromatic
C3B	C2B	sing	0.00Å	1.38Å	Aromatic
O1D	CGD	doub	0.00Å	1.25Å
NB	CR	sing	0.00Å	2.03Å
NB	C1B	sing	0.00Å	1.37Å	Aromatic
C1D	ND	sing	0.00Å	1.37Å
C1D	C2D	sing	0.00Å	1.46Å
CBD	CGD	sing	0.00Å	1.53Å
CBD	CAD	sing	0.00Å	1.53Å
C2B	CMB	sing	0.00Å	1.52Å
C2B	C1B	doub	0.00Å	1.45Å	Aromatic
CR	ND	sing	0.00Å	1.96Å
CR	NA	sing	0.00Å	2.11Å
CMD	C2D	sing	0.00Å	1.50Å
ND	C4D	sing	0.00Å	1.37Å
C2D	C3D	doub	0.00Å	1.36Å
C1B	CHB	sing	0.00Å	1.37Å
CGD	O2D	sing	0.00Å	1.25Å
C3D	C4D	sing	0.00Å	1.46Å
C3D	CAD	sing	0.00Å	1.51Å
C4D	CHA	doub	0.00Å	1.39Å
CHB	C4A	doub	0.00Å	1.39Å
NA	C4A	sing	0.00Å	1.37Å
NA	C1A	doub	0.00Å	1.38Å
C4A	C3A	sing	0.00Å	1.43Å
CHA	C1A	sing	0.00Å	1.37Å
C1A	C2A	sing	0.00Å	1.44Å
C3A	C2A	doub	0.00Å	1.38Å
C3A	CMA	sing	0.00Å	1.51Å
C2A	CAA	sing	0.00Å	1.51Å
CAA	CBA	sing	0.00Å	1.53Å
CBA	CGA	sing	0.00Å	1.52Å
O2A	CGA	doub	0.00Å	1.27Å
CGA	O1A	sing	0.00Å	1.25Å
CHA	H1	sing	0.00Å	1.08Å
CHB	H2	sing	0.00Å	1.08Å
CHC	H3	sing	0.00Å	1.08Å
CHD	H4	sing	0.00Å	1.08Å
CMA	H5	sing	0.00Å	1.10Å
CMA	H6	sing	0.00Å	1.10Å
CMA	H7	sing	0.00Å	1.10Å
CAA	H8	sing	0.00Å	1.10Å
CAA	H9	sing	0.00Å	1.10Å
CBA	H10	sing	0.00Å	1.10Å
CBA	H11	sing	0.00Å	1.10Å
O1A	H12	sing	0.00Å	0.95Å
CMB	H13	sing	0.00Å	1.10Å
CMB	H14	sing	0.00Å	1.10Å
CMB	H15	sing	0.00Å	1.10Å
CAB	H16	sing	0.00Å	1.08Å
CBB	H17	sing	0.00Å	1.08Å
CBB	H18	sing	0.00Å	1.08Å
CMC	H19	sing	0.00Å	1.10Å
CMC	H20	sing	0.00Å	1.10Å
CMC	H21	sing	0.00Å	1.10Å
CAC	H22	sing	0.00Å	1.08Å
CBC	H23	sing	0.00Å	1.08Å
CBC	H24	sing	0.00Å	1.08Å
CMD	H25	sing	0.00Å	1.10Å
CMD	H26	sing	0.00Å	1.10Å
CMD	H27	sing	0.00Å	1.10Å
CAD	H28	sing	0.00Å	1.10Å
CAD	H29	sing	0.00Å	1.10Å
CBD	H30	sing	0.00Å	1.10Å
CBD	H31	sing	0.00Å	1.10Å
O2D	H32	sing	0.00Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CMC	C2C	C3C	128.2°	90.0°
CMC	C2C	C1C	124.9°	90.0°
C2C	CMC	H19	109.5°	90.0°
C2C	CMC	H20	109.5°	90.0°
C2C	CMC	H21	109.4°	90.0°
CBC	CAC	C3C	124.9°	90.0°
CBC	CAC	H22	117.5°	90.0°
CAC	CBC	H23	120.0°	90.0°
CAC	CBC	H24	120.0°	90.0°
CAC	C3C	C2C	130.6°	90.0°
CAC	C3C	C4C	121.5°	90.0°
C3C	CAC	H22	117.6°	90.0°
C3C	C2C	C1C	106.9°	90.0°
C2C	C3C	C4C	107.7°	90.0°
C2C	C1C	CHC	127.8°	90.0°
C2C	C1C	NC	107.9°	90.0°
C3C	C4C	NC	108.4°	90.0°
C3C	C4C	CHD	126.4°	90.0°
CBB	CAB	C3B	128.1°	90.0°
CBB	CAB	H16	116.0°	90.0°
CAB	CBB	H17	120.0°	90.0°
CAB	CBB	H18	120.0°	90.0°
CHC	C1C	NC	124.3°	90.0°
C1C	CHC	C4B	126.4°	90.0°
C1C	CHC	H3	116.8°	90.0°
C1C	NC	C4C	108.9°	90.0°
C1C	NC	CR	127.9°	90.0°
CHC	C4B	C3B	125.1°	90.0°
CHC	C4B	NB	124.2°	90.0°
C4B	CHC	H3	116.8°	90.0°
CAB	C3B	C4B	121.1°	90.0°
CAB	C3B	C2B	129.9°	90.0°
C3B	CAB	H16	116.0°	90.0°
NC	C4C	CHD	125.1°	90.0°
C4C	NC	CR	123.2°	90.0°
C4C	CHD	C1D	127.3°	90.0°
C4C	CHD	H4	116.4°	90.0°
NC	CR	NB	87.7°	90.0°
NC	CR	ND	92.6°	90.0°
NC	CR	NA	178.2°	90.0°
CHD	C1D	ND	125.7°	90.0°
CHD	C1D	C2D	123.5°	90.0°
C1D	CHD	H4	116.4°	90.0°
C3B	C4B	NB	110.8°	90.0°
C4B	C3B	C2B	108.9°	90.0°
C4B	NB	CR	129.5°	90.0°
C4B	NB	C1B	105.5°	90.0°
C3B	C2B	CMB	128.6°	90.0°
C3B	C2B	C1B	104.1°	90.0°
O1D	CGD	CBD	118.5°	90.0°
O1D	CGD	O2D	123.6°	90.0°
CR	NB	C1B	125.0°	90.0°
NB	CR	ND	179.3°	90.0°
NB	CR	NA	90.6°	90.0°
NB	C1B	C2B	110.7°	90.0°
NB	C1B	CHB	126.7°	90.0°
ND	C1D	C2D	110.6°	90.0°
C1D	ND	CR	125.7°	90.0°
C1D	ND	C4D	105.3°	90.0°
C1D	C2D	CMD	126.3°	90.0°
C1D	C2D	C3D	106.9°	90.0°
CGD	CBD	CAD	112.8°	90.0°
CBD	CGD	O2D	117.9°	90.0°
CGD	CBD	H30	108.6°	90.0°
CGD	CBD	H31	108.6°	90.0°
CBD	CAD	C3D	109.6°	90.0°
CBD	CAD	H28	109.4°	90.0°
CBD	CAD	H29	109.4°	90.0°
CAD	CBD	H30	108.6°	90.0°
CAD	CBD	H31	108.6°	90.0°
CMB	C2B	C1B	127.3°	90.0°
C2B	CMB	H13	109.5°	90.0°
C2B	CMB	H14	109.4°	90.0°
C2B	CMB	H15	109.5°	90.0°
C2B	C1B	CHB	122.7°	90.0°
ND	CR	NA	89.2°	90.0°
CR	ND	C4D	129.0°	90.0°
CR	NA	C4A	125.3°	90.0°
CR	NA	C1A	125.5°	90.0°
CMD	C2D	C3D	126.8°	90.0°
C2D	CMD	H25	109.5°	90.0°
C2D	CMD	H26	109.5°	90.0°
C2D	CMD	H27	109.5°	90.0°
ND	C4D	C3D	111.2°	90.0°
ND	C4D	CHA	124.7°	90.0°
C2D	C3D	C4D	105.6°	90.0°
C2D	C3D	CAD	127.4°	90.0°
C1B	CHB	C4A	129.0°	90.0°
C1B	CHB	H2	115.5°	90.0°
CGD	O2D	H32	109.5°	90.0°
C4D	C3D	CAD	126.9°	90.0°
C3D	C4D	CHA	123.9°	90.0°
C3D	CAD	H28	109.5°	90.0°
C3D	CAD	H29	109.5°	90.0°
C4D	CHA	C1A	127.5°	90.0°
C4D	CHA	H1	116.3°	90.0°
CHB	C4A	NA	123.5°	90.0°
CHB	C4A	C3A	128.4°	90.0°
C4A	CHB	H2	115.5°	90.0°
C4A	NA	C1A	109.1°	90.0°
NA	C4A	C3A	108.1°	90.0°
NA	C1A	CHA	124.0°	90.0°
NA	C1A	C2A	107.9°	90.0°
C4A	C3A	C2A	107.8°	90.0°
C4A	C3A	CMA	124.2°	90.0°
CHA	C1A	C2A	128.1°	90.0°
C1A	CHA	H1	116.3°	90.0°
C1A	C2A	C3A	107.0°	90.0°
C1A	C2A	CAA	125.0°	90.0°
C2A	C3A	CMA	128.0°	90.0°
C3A	C2A	CAA	127.9°	90.0°
C3A	CMA	H5	109.5°	90.0°
C3A	CMA	H6	109.5°	90.0°
C3A	CMA	H7	109.5°	90.0°
C2A	CAA	CBA	110.2°	90.0°
C2A	CAA	H8	109.3°	90.0°
C2A	CAA	H9	109.3°	90.0°
CAA	CBA	CGA	114.5°	90.0°
CBA	CAA	H8	109.3°	90.0°
CBA	CAA	H9	109.3°	90.0°
CAA	CBA	H10	108.2°	90.0°
CAA	CBA	H11	108.2°	90.0°
CBA	CGA	O2A	118.8°	90.0°
CBA	CGA	O1A	117.3°	90.0°
CGA	CBA	H10	108.2°	90.0°
CGA	CBA	H11	108.2°	90.0°
O2A	CGA	O1A	123.9°	90.0°
CGA	O1A	H12	109.5°	90.0°
H5	CMA	H6	109.5°	90.0°
H5	CMA	H7	109.4°	90.0°
H6	CMA	H7	109.5°	90.0°
H8	CAA	H9	109.4°	90.0°
H10	CBA	H11	109.5°	90.0°
H13	CMB	H14	109.5°	90.0°
H13	CMB	H15	109.5°	90.0°
H14	CMB	H15	109.5°	90.0°
H17	CBB	H18	120.0°	90.0°
H19	CMC	H20	109.5°	90.0°
H19	CMC	H21	109.5°	90.0°
H20	CMC	H21	109.5°	90.0°
H23	CBC	H24	120.0°	90.0°
H25	CMD	H26	109.5°	90.0°
H25	CMD	H27	109.4°	90.0°
H26	CMD	H27	109.5°	90.0°
H28	CAD	H29	109.5°	90.0°
H30	CBD	H31	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CMC	C2C	C3C	CAC	4.2°	90.0°
CMC	C2C	C3C	C1C	177.7°	90.0°
CMC	C2C	C3C	C4C	178.7°	90.0°
CMC	C2C	C1C	CHC	0.2°	90.0°
CMC	C2C	C1C	NC	179.0°	90.0°
C2C	CMC	H19	H20	120.0°	90.0°
C2C	CMC	H19	H21	120.0°	90.0°
C2C	CMC	H20	H21	120.0°	90.0°
CBC	CAC	C3C	H22	180.0°	90.0°
CBC	CAC	C3C	C2C	15.1°	90.0°
CBC	CAC	C3C	C4C	158.8°	90.0°
CAC	CBC	H23	H24	180.0°	90.0°
CAC	C3C	C2C	C4C	174.5°	90.0°
CAC	C3C	C2C	C1C	178.1°	90.0°
CAC	C3C	C4C	NC	179.8°	90.0°
CAC	C3C	C4C	CHD	3.7°	90.0°
C3C	CAC	CBC	H23	180.0°	90.0°
C3C	CAC	CBC	H24	0.0°	90.0°
C3C	C2C	C1C	CHC	178.0°	90.0°
C3C	C2C	C1C	NC	1.2°	90.0°
C2C	C3C	C4C	NC	4.7°	90.0°
C2C	C3C	C4C	CHD	178.8°	90.0°
C3C	C2C	CMC	H19	180.0°	90.0°
C3C	C2C	CMC	H20	60.0°	90.0°
C3C	C2C	CMC	H21	60.0°	90.0°
C2C	C3C	CAC	H22	165.0°	90.0°
C1C	C2C	C3C	C4C	3.6°	90.0°
C2C	C1C	CHC	NC	179.1°	90.0°
C2C	C1C	CHC	C4B	179.2°	90.0°
C2C	C1C	NC	C4C	1.7°	90.0°
C2C	C1C	NC	CR	179.0°	90.0°
C2C	C1C	CHC	H3	0.8°	90.0°
C1C	C2C	CMC	H19	2.7°	90.0°
C1C	C2C	CMC	H20	117.3°	90.0°
C1C	C2C	CMC	H21	122.7°	90.0°
C3C	C4C	NC	C1C	4.0°	90.0°
C3C	C4C	NC	CHD	176.5°	90.0°
C3C	C4C	NC	CR	176.7°	90.0°
C3C	C4C	CHD	C1D	177.6°	90.0°
C3C	C4C	CHD	H4	2.4°	90.0°
C4C	C3C	CAC	H22	21.2°	90.0°
CBB	CAB	C3B	H16	180.0°	90.0°
CBB	CAB	C3B	C4B	146.1°	90.0°
CBB	CAB	C3B	C2B	35.9°	90.0°
CAB	CBB	H17	H18	180.0°	90.0°
C1C	CHC	C4B	H3	180.0°	90.0°
CHC	C1C	NC	C4C	179.0°	90.0°
CHC	C1C	NC	CR	0.2°	90.0°
C1C	CHC	C4B	C3B	179.3°	90.0°
C1C	CHC	C4B	NB	1.5°	90.0°
NC	C1C	CHC	C4B	1.7°	90.0°
C1C	NC	C4C	CR	179.3°	90.0°
C1C	NC	C4C	CHD	179.5°	90.0°
C1C	NC	CR	NB	1.5°	90.0°
C1C	NC	CR	ND	179.1°	90.0°
C1C	NC	CR	NA	4.2°	90.0°
NC	C1C	CHC	H3	178.3°	90.0°
CHC	C4B	C3B	CAB	2.5°	90.0°
CHC	C4B	C3B	NB	179.3°	90.0°
CHC	C4B	C3B	C2B	179.1°	90.0°
CHC	C4B	NB	CR	0.8°	90.0°
CHC	C4B	NB	C1B	178.7°	90.0°
CAB	C3B	C4B	C2B	178.4°	90.0°
CAB	C3B	C4B	NB	178.2°	90.0°
CAB	C3B	C2B	CMB	3.0°	90.0°
CAB	C3B	C2B	C1B	178.5°	90.0°
C3B	CAB	CBB	H17	180.0°	90.0°
C3B	CAB	CBB	H18	0.0°	90.0°
NC	C4C	CHD	C1D	1.8°	90.0°
C4C	NC	CR	NB	177.6°	90.0°
C4C	NC	CR	ND	1.7°	90.0°
C4C	NC	CR	NA	175.0°	90.0°
NC	C4C	CHD	H4	178.2°	90.0°
CHD	C4C	NC	CR	0.2°	90.0°
C4C	CHD	C1D	H4	180.0°	90.0°
C4C	CHD	C1D	ND	6.2°	90.0°
C4C	CHD	C1D	C2D	177.9°	90.0°
NC	CR	NB	C4B	1.8°	90.0°
NC	CR	NB	ND	112.1°	90.0°
NC	CR	NB	NA	179.9°	90.0°
NC	CR	NB	C1B	179.3°	90.0°
NC	CR	ND	C1D	5.6°	90.0°
NC	CR	ND	NA	179.9°	90.0°
NC	CR	ND	C4D	176.1°	90.0°
NC	CR	NA	C4A	2.8°	90.0°
NC	CR	NA	C1A	179.6°	90.0°
CHD	C1D	ND	C2D	176.3°	90.0°
CHD	C1D	ND	CR	8.5°	90.0°
CHD	C1D	C2D	CMD	9.2°	90.0°
CHD	C1D	ND	C4D	172.8°	90.0°
CHD	C1D	C2D	C3D	170.7°	90.0°
C3B	C4B	NB	CR	178.5°	90.0°
C3B	C4B	NB	C1B	0.6°	90.0°
C4B	C3B	C2B	CMB	178.7°	90.0°
C4B	C3B	C2B	C1B	0.2°	90.0°
C3B	C4B	CHC	H3	0.7°	90.0°
C4B	C3B	CAB	H16	34.0°	90.0°
NB	C4B	C3B	C2B	0.2°	90.0°
C4B	NB	CR	C1B	177.5°	90.0°
C4B	NB	C1B	C2B	0.8°	90.0°
C4B	NB	CR	ND	113.9°	90.0°
C4B	NB	CR	NA	178.3°	90.0°
C4B	NB	C1B	CHB	179.5°	90.0°
NB	C4B	CHC	H3	178.5°	90.0°
C3B	C2B	C1B	NB	0.6°	90.0°
C3B	C2B	CMB	C1B	178.2°	90.0°
C3B	C2B	C1B	CHB	179.6°	90.0°
C3B	C2B	CMB	H13	90.9°	90.0°
C3B	C2B	CMB	H14	149.1°	90.0°
C3B	C2B	CMB	H15	29.1°	90.0°
C2B	C3B	CAB	H16	144.1°	90.0°
O1D	CGD	CBD	O2D	179.0°	90.0°
O1D	CGD	CBD	CAD	127.4°	90.0°
O1D	CGD	CBD	H30	112.1°	90.0°
O1D	CGD	CBD	H31	6.9°	90.0°
O1D	CGD	O2D	H32	0.0°	90.0°
NB	CR	ND	C1D	106.5°	90.0°
CR	NB	C1B	C2B	178.8°	90.0°
NB	CR	ND	NA	67.8°	90.0°
NB	CR	ND	C4D	71.8°	90.0°
CR	NB	C1B	CHB	1.4°	90.0°
NB	CR	NA	C4A	0.2°	90.0°
NB	CR	NA	C1A	177.8°	90.0°
NB	C1B	C2B	CMB	179.2°	90.0°
NB	C1B	C2B	CHB	179.8°	90.0°
C1B	NB	CR	ND	68.6°	90.0°
C1B	NB	CR	NA	0.7°	90.0°
NB	C1B	CHB	C4A	1.5°	90.0°
NB	C1B	CHB	H2	178.5°	90.0°
C1D	ND	CR	C4D	178.3°	90.0°
C1D	ND	CR	NA	174.3°	90.0°
ND	C1D	C2D	CMD	174.4°	90.0°
ND	C1D	C2D	C3D	5.8°	90.0°
C1D	ND	C4D	C3D	0.2°	90.0°
C1D	ND	C4D	CHA	174.8°	90.0°
ND	C1D	CHD	H4	173.8°	90.0°
C2D	C1D	ND	CR	175.1°	90.0°
C1D	C2D	CMD	C3D	179.8°	90.0°
C2D	C1D	ND	C4D	3.5°	90.0°
C1D	C2D	C3D	C4D	5.2°	90.0°
C1D	C2D	C3D	CAD	176.4°	90.0°
C2D	C1D	CHD	H4	2.1°	90.0°
C1D	C2D	CMD	H25	180.0°	90.0°
C1D	C2D	CMD	H26	60.0°	90.0°
C1D	C2D	CMD	H27	60.0°	90.0°
CGD	CBD	CAD	H30	120.5°	90.0°
CGD	CBD	CAD	H31	120.5°	90.0°
CGD	CBD	CAD	C3D	176.9°	90.0°
CGD	CBD	CAD	H28	56.9°	90.0°
CGD	CBD	CAD	H29	63.0°	90.0°
CGD	CBD	H30	H31	118.5°	90.0°
CBD	CGD	O2D	H32	178.9°	90.0°
CBD	CAD	C3D	C2D	90.6°	90.0°
CAD	CBD	CGD	O2D	51.6°	90.0°
CBD	CAD	C3D	C4D	91.4°	90.0°
CBD	CAD	C3D	H28	120.0°	90.0°
CBD	CAD	C3D	H29	120.0°	90.0°
CBD	CAD	H28	H29	119.9°	90.0°
CAD	CBD	H30	H31	118.5°	90.0°
CMB	C2B	C1B	CHB	1.1°	90.0°
C2B	CMB	H13	H14	120.0°	90.0°
C2B	CMB	H13	H15	120.0°	90.0°
C2B	CMB	H14	H15	120.0°	90.0°
C2B	C1B	CHB	C4A	178.8°	90.0°
C2B	C1B	CHB	H2	1.3°	90.0°
C1B	C2B	CMB	H13	90.9°	90.0°
C1B	C2B	CMB	H14	29.1°	90.0°
C1B	C2B	CMB	H15	149.1°	90.0°
CR	ND	C4D	C3D	178.4°	90.0°
CR	ND	C4D	CHA	3.7°	90.0°
ND	CR	NA	C4A	179.6°	90.0°
ND	CR	NA	C1A	2.9°	90.0°
NA	CR	ND	C4D	4.0°	90.0°
CR	NA	C4A	CHB	0.3°	90.0°
CR	NA	C4A	C1A	177.9°	90.0°
CR	NA	C4A	C3A	179.5°	90.0°
CR	NA	C1A	CHA	1.5°	90.0°
CR	NA	C1A	C2A	178.8°	90.0°
CMD	C2D	C3D	C4D	174.9°	90.0°
CMD	C2D	C3D	CAD	3.4°	90.0°
C2D	CMD	H25	H26	120.0°	90.0°
C2D	CMD	H25	H27	120.0°	90.0°
C2D	CMD	H26	H27	120.0°	90.0°
ND	C4D	C3D	C2D	3.4°	90.0°
ND	C4D	C3D	CHA	174.7°	90.0°
ND	C4D	C3D	CAD	178.2°	90.0°
ND	C4D	CHA	C1A	0.8°	90.0°
ND	C4D	CHA	H1	179.2°	90.0°
C2D	C3D	C4D	CAD	178.4°	90.0°
C2D	C3D	C4D	CHA	171.3°	90.0°
C3D	C2D	CMD	H25	0.2°	90.0°
C3D	C2D	CMD	H26	120.2°	90.0°
C3D	C2D	CMD	H27	119.8°	90.0°
C2D	C3D	CAD	H28	29.4°	90.0°
C2D	C3D	CAD	H29	149.4°	90.0°
C1B	CHB	C4A	H2	180.0°	90.0°
C1B	CHB	C4A	NA	0.9°	90.0°
C1B	CHB	C4A	C3A	178.9°	90.0°
O2D	CGD	CBD	H30	68.9°	90.0°
O2D	CGD	CBD	H31	172.1°	90.0°
C3D	C4D	CHA	C1A	174.8°	90.0°
C3D	C4D	CHA	H1	5.1°	90.0°
C4D	C3D	CAD	H28	148.6°	90.0°
C4D	C3D	CAD	H29	28.6°	90.0°
CAD	C3D	C4D	CHA	7.0°	90.0°
C3D	CAD	H28	H29	120.0°	90.0°
C3D	CAD	CBD	H30	62.6°	90.0°
C3D	CAD	CBD	H31	56.4°	90.0°
C4D	CHA	C1A	NA	0.2°	90.0°
C4D	CHA	C1A	H1	180.0°	90.0°
C4D	CHA	C1A	C2A	179.4°	90.0°
CHB	C4A	NA	C3A	179.8°	90.0°
CHB	C4A	NA	C1A	178.2°	90.0°
CHB	C4A	C3A	C2A	178.1°	90.0°
CHB	C4A	C3A	CMA	2.5°	90.0°
C4A	NA	C1A	CHA	179.4°	90.0°
C4A	NA	C1A	C2A	0.9°	90.0°
NA	C4A	C3A	C2A	1.7°	90.0°
NA	C4A	C3A	CMA	177.7°	90.0°
NA	C4A	CHB	H2	179.1°	90.0°
C1A	NA	C4A	C3A	1.6°	90.0°
NA	C1A	CHA	C2A	179.7°	90.0°
NA	C1A	C2A	C3A	0.2°	90.0°
NA	C1A	C2A	CAA	177.6°	90.0°
NA	C1A	CHA	H1	179.8°	90.0°
C4A	C3A	C2A	C1A	1.1°	90.0°
C4A	C3A	C2A	CMA	179.4°	90.0°
C4A	C3A	C2A	CAA	178.4°	90.0°
C3A	C4A	CHB	H2	1.1°	90.0°
C4A	C3A	CMA	H5	180.0°	90.0°
C4A	C3A	CMA	H6	60.0°	90.0°
C4A	C3A	CMA	H7	60.0°	90.0°
CHA	C1A	C2A	C3A	179.5°	90.0°
CHA	C1A	C2A	CAA	2.2°	90.0°
C1A	C2A	C3A	CAA	177.3°	90.0°
C1A	C2A	C3A	CMA	178.3°	90.0°
C1A	C2A	CAA	CBA	93.5°	90.0°
C2A	C1A	CHA	H1	0.5°	90.0°
C1A	C2A	CAA	H8	26.6°	90.0°
C1A	C2A	CAA	H9	146.3°	90.0°
C3A	C2A	CAA	CBA	83.3°	90.0°
C2A	C3A	CMA	H5	0.7°	90.0°
C2A	C3A	CMA	H6	120.7°	90.0°
C2A	C3A	CMA	H7	119.3°	90.0°
C3A	C2A	CAA	H8	156.6°	90.0°
C3A	C2A	CAA	H9	36.8°	90.0°
CMA	C3A	C2A	CAA	1.0°	90.0°
C3A	CMA	H5	H6	120.0°	90.0°
C3A	CMA	H5	H7	120.0°	90.0°
C3A	CMA	H6	H7	120.0°	90.0°
C2A	CAA	CBA	H8	120.1°	90.0°
C2A	CAA	CBA	H9	120.1°	90.0°
C2A	CAA	CBA	CGA	175.6°	90.0°
C2A	CAA	H8	H9	119.6°	90.0°
C2A	CAA	CBA	H10	54.9°	90.0°
C2A	CAA	CBA	H11	63.6°	90.0°
CAA	CBA	CGA	H10	120.7°	90.0°
CAA	CBA	CGA	H11	120.7°	90.0°
CAA	CBA	CGA	O2A	17.1°	90.0°
CAA	CBA	CGA	O1A	163.4°	90.0°
CBA	CAA	H8	H9	119.7°	90.0°
CAA	CBA	H10	H11	117.7°	90.0°
CBA	CGA	O2A	O1A	179.5°	90.0°
CGA	CBA	CAA	H8	64.3°	90.0°
CGA	CBA	CAA	H9	55.5°	90.0°
CGA	CBA	H10	H11	117.7°	90.0°
CBA	CGA	O1A	H12	179.5°	90.0°
O2A	CGA	CBA	H10	103.6°	90.0°
O2A	CGA	CBA	H11	137.8°	90.0°
O2A	CGA	O1A	H12	0.0°	90.0°
O1A	CGA	CBA	H10	75.9°	90.0°
O1A	CGA	CBA	H11	42.6°	90.0°
H5	CMA	H6	H7	120.0°	90.0°
H8	CAA	CBA	H10	175.0°	90.0°
H8	CAA	CBA	H11	56.5°	90.0°
H9	CAA	CBA	H10	65.3°	90.0°
H9	CAA	CBA	H11	176.3°	90.0°
H13	CMB	H14	H15	120.0°	90.0°
H16	CAB	CBB	H17	0.0°	90.0°
H16	CAB	CBB	H18	180.0°	90.0°
H19	CMC	H20	H21	120.0°	90.0°
H22	CAC	CBC	H23	0.0°	90.0°
H22	CAC	CBC	H24	180.0°	90.0°
H25	CMD	H26	H27	120.0°	90.0°
H28	CAD	CBD	H30	177.4°	90.0°
H28	CAD	CBD	H31	63.6°	90.0°
H29	CAD	CBD	H30	57.4°	90.0°
H29	CAD	CBD	H31	176.4°	90.0°

Release date:	2020-03-18
Definition date:	2019-03-19
Last modified:	2020-03-13
Release status:	REL
Processing site:	PDBJ
Derived from:	6JMW