3ZZ

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CMB	C2B	sing	0.00Å	1.53Å
CMA	C3A	sing	0.00Å	1.55Å
O1A	CGA	doub	0.00Å	1.28Å
CBB	CAB	doub	0.00Å	1.33Å
C2B	C1B	doub	0.00Å	1.46Å	Aromatic
C2B	C3B	sing	0.00Å	1.35Å	Aromatic
CHB	C1B	sing	0.00Å	1.39Å
CHB	C4A	doub	0.00Å	1.38Å
C3A	C4A	sing	0.00Å	1.46Å
C3A	C2A	doub	0.00Å	1.38Å
CGA	O2A	sing	0.00Å	1.29Å
CGA	CBA	sing	0.00Å	1.53Å
C1B	NB	sing	0.00Å	1.37Å	Aromatic
C4A	NA	sing	0.00Å	1.37Å
C3B	CAB	sing	0.00Å	1.56Å
C3B	C4B	doub	0.00Å	1.44Å	Aromatic
CAA	C2A	sing	0.00Å	1.59Å
CAA	CBA	sing	0.00Å	1.55Å
C2A	C1A	sing	0.00Å	1.46Å
NB	C4B	sing	0.00Å	1.37Å	Aromatic
NB	IN	sing	0.00Å	2.03Å
C4B	CHC	sing	0.00Å	1.36Å
NA	C1A	doub	0.00Å	1.40Å
NA	IN	sing	0.00Å	2.03Å
C1A	CHA	sing	0.00Å	1.37Å
CHC	C1C	doub	0.00Å	1.34Å
IN	ND	sing	0.00Å	2.10Å
CHA	C4D	doub	0.00Å	1.38Å
C1C	NC	sing	0.00Å	1.35Å
C1C	C2C	sing	0.00Å	1.45Å
NC	C4C	sing	0.00Å	1.37Å
C4D	ND	sing	0.00Å	1.41Å	Aromatic
C4D	C3D	sing	0.00Å	1.44Å	Aromatic
ND	C1D	sing	0.00Å	1.39Å	Aromatic
C2C	CMC	sing	0.00Å	1.56Å
C2C	C3C	doub	0.00Å	1.34Å
C4C	C3C	sing	0.00Å	1.45Å
C4C	CHD	sing	0.00Å	1.38Å
C3D	CAD	sing	0.00Å	1.54Å
C3D	C2D	doub	0.00Å	1.53Å	Aromatic
C1D	CHD	doub	0.00Å	1.38Å
C1D	C2D	sing	0.00Å	1.45Å	Aromatic
CAD	CBD	sing	0.00Å	1.52Å
C3C	CAC	sing	0.00Å	1.55Å
CBD	CGD	sing	0.00Å	1.50Å
C2D	CMD	sing	0.00Å	1.54Å
O2D	CGD	doub	0.00Å	1.26Å
CGD	O1D	sing	0.00Å	1.26Å
CAC	CBC	doub	0.00Å	1.33Å
CHA	H1	sing	0.00Å	1.08Å
CAA	H2	sing	0.00Å	1.10Å
CAA	H3	sing	0.00Å	1.10Å
CBA	H4	sing	0.00Å	1.10Å
CBA	H5	sing	0.00Å	1.10Å
O2A	H6	sing	0.00Å	0.95Å
CMA	H7	sing	0.00Å	1.10Å
CMA	H8	sing	0.00Å	1.10Å
CMA	H9	sing	0.00Å	1.10Å
CHB	H10	sing	0.00Å	1.08Å
CMB	H11	sing	0.00Å	1.10Å
CMB	H12	sing	0.00Å	1.10Å
CMB	H13	sing	0.00Å	1.10Å
CAB	H14	sing	0.00Å	1.08Å
CBB	H15	sing	0.00Å	1.08Å
CBB	H16	sing	0.00Å	1.08Å
CHC	H17	sing	0.00Å	1.08Å
CMC	H18	sing	0.00Å	1.10Å
CMC	H19	sing	0.00Å	1.10Å
CMC	H20	sing	0.00Å	1.10Å
CAC	H21	sing	0.00Å	1.08Å
CBC	H22	sing	0.00Å	1.08Å
CBC	H23	sing	0.00Å	1.08Å
CHD	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
O1D	H32	sing	0.00Å	0.95Å
IN	NC	sing	0.00Å	2.18Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CMB	C2B	C1B	124.0°	90.0°
CMB	C2B	C3B	128.3°	90.0°
C2B	CMB	H11	109.5°	90.0°
C2B	CMB	H12	109.5°	90.0°
C2B	CMB	H13	109.5°	90.0°
CMA	C3A	C4A	124.0°	90.0°
CMA	C3A	C2A	126.0°	90.0°
C3A	CMA	H7	109.5°	90.0°
C3A	CMA	H8	109.5°	90.0°
C3A	CMA	H9	109.5°	90.0°
O1A	CGA	O2A	121.6°	90.0°
O1A	CGA	CBA	118.6°	90.0°
CBB	CAB	C3B	127.3°	90.0°
CBB	CAB	H14	116.3°	90.0°
CAB	CBB	H15	120.0°	90.0°
CAB	CBB	H16	120.0°	90.0°
C1B	C2B	C3B	107.8°	90.0°
C2B	C1B	CHB	128.8°	90.0°
C2B	C1B	NB	108.1°	90.0°
C2B	C3B	CAB	134.2°	90.0°
C2B	C3B	C4B	106.8°	90.0°
C1B	CHB	C4A	126.9°	90.0°
CHB	C1B	NB	123.1°	90.0°
C1B	CHB	H10	116.6°	90.0°
CHB	C4A	C3A	127.6°	90.0°
CHB	C4A	NA	126.1°	90.0°
C4A	CHB	H10	116.6°	90.0°
C4A	C3A	C2A	110.0°	90.0°
C3A	C4A	NA	106.1°	90.0°
C3A	C2A	CAA	126.4°	90.0°
C3A	C2A	C1A	105.8°	90.0°
O2A	CGA	CBA	119.8°	90.0°
CGA	O2A	H6	109.5°	90.0°
CGA	CBA	CAA	113.0°	90.0°
CGA	CBA	H4	108.6°	90.0°
CGA	CBA	H5	108.6°	90.0°
C1B	NB	C4B	107.5°	90.0°
C1B	NB	IN	126.2°	90.0°
C4A	NA	C1A	110.0°	90.0°
C4A	NA	IN	124.4°	90.0°
CAB	C3B	C4B	119.0°	90.0°
C3B	CAB	H14	116.4°	90.0°
C3B	C4B	NB	109.7°	90.0°
C3B	C4B	CHC	123.0°	90.0°
C2A	CAA	CBA	120.0°	90.0°
CAA	C2A	C1A	127.8°	90.0°
C2A	CAA	H2	106.8°	90.0°
C2A	CAA	H3	106.8°	90.0°
CBA	CAA	H2	106.8°	90.0°
CBA	CAA	H3	106.8°	90.0°
CAA	CBA	H4	108.6°	90.0°
CAA	CBA	H5	108.6°	90.0°
C2A	C1A	NA	108.1°	90.0°
C2A	C1A	CHA	126.3°	90.0°
C4B	NB	IN	123.1°	90.0°
NB	C4B	CHC	127.2°	90.0°
NB	IN	NA	90.9°	90.0°
NB	IN	ND	175.9°	90.0°
NB	IN	NC	89.5°	90.0°
C4B	CHC	C1C	127.9°	90.0°
C4B	CHC	H17	116.1°	90.0°
C1A	NA	IN	125.3°	90.0°
NA	C1A	CHA	125.6°	90.0°
NA	IN	ND	91.8°	90.0°
NA	IN	NC	176.6°	90.0°
C1A	CHA	C4D	126.9°	90.0°
C1A	CHA	H1	116.6°	90.0°
CHC	C1C	NC	123.0°	90.0°
CHC	C1C	C2C	127.4°	90.0°
C1C	CHC	H17	116.0°	90.0°
IN	ND	C4D	121.9°	90.0°
IN	ND	C1D	125.3°	90.0°
ND	IN	NC	87.6°	90.0°
CHA	C4D	ND	126.9°	90.0°
CHA	C4D	C3D	125.1°	90.0°
C4D	CHA	H1	116.6°	90.0°
NC	C1C	C2C	109.5°	90.0°
C1C	NC	C4C	107.8°	90.0°
C1C	NC	IN	124.3°	90.0°
C1C	C2C	CMC	125.2°	90.0°
C1C	C2C	C3C	106.9°	90.0°
NC	C4C	C3C	108.1°	90.0°
NC	C4C	CHD	124.5°	90.0°
C4C	NC	IN	126.3°	90.0°
ND	C4D	C3D	108.0°	90.0°
C4D	ND	C1D	112.3°	90.0°
C4D	C3D	CAD	128.7°	90.0°
C4D	C3D	C2D	105.4°	90.0°
ND	C1D	CHD	127.9°	90.0°
ND	C1D	C2D	107.9°	90.0°
CMC	C2C	C3C	127.9°	90.0°
C2C	CMC	H18	109.5°	90.0°
C2C	CMC	H19	109.5°	90.0°
C2C	CMC	H20	109.5°	90.0°
C2C	C3C	C4C	107.5°	90.0°
C2C	C3C	CAC	128.3°	90.0°
C3C	C4C	CHD	127.3°	90.0°
C4C	C3C	CAC	124.1°	90.0°
C4C	CHD	C1D	127.1°	90.0°
C4C	CHD	H24	116.4°	90.0°
CAD	C3D	C2D	125.9°	90.0°
C3D	CAD	CBD	105.7°	90.0°
C3D	CAD	H28	110.4°	90.0°
C3D	CAD	H29	110.4°	90.0°
C3D	C2D	C1D	106.3°	90.0°
C3D	C2D	CMD	125.9°	90.0°
CHD	C1D	C2D	124.1°	90.0°
C1D	CHD	H24	116.5°	90.0°
C1D	C2D	CMD	127.8°	90.0°
CAD	CBD	CGD	111.8°	90.0°
CBD	CAD	H28	110.4°	90.0°
CBD	CAD	H29	110.4°	90.0°
CAD	CBD	H30	108.9°	90.0°
CAD	CBD	H31	108.9°	90.0°
C3C	CAC	CBC	122.2°	90.0°
C3C	CAC	H21	118.9°	90.0°
CBD	CGD	O2D	117.8°	90.0°
CBD	CGD	O1D	119.2°	90.0°
CGD	CBD	H30	108.9°	90.0°
CGD	CBD	H31	108.9°	90.0°
C2D	CMD	H25	109.5°	90.0°
C2D	CMD	H26	109.5°	90.0°
C2D	CMD	H27	109.5°	90.0°
O2D	CGD	O1D	123.0°	90.0°
CGD	O1D	H32	109.5°	90.0°
CBC	CAC	H21	118.9°	90.0°
CAC	CBC	H22	120.0°	90.0°
CAC	CBC	H23	120.0°	90.0°
H2	CAA	H3	109.5°	90.0°
H4	CBA	H5	109.4°	90.0°
H7	CMA	H8	109.5°	90.0°
H7	CMA	H9	109.4°	90.0°
H8	CMA	H9	109.5°	90.0°
H11	CMB	H12	109.4°	90.0°
H11	CMB	H13	109.5°	90.0°
H12	CMB	H13	109.5°	90.0°
H15	CBB	H16	120.0°	90.0°
H18	CMC	H19	109.5°	90.0°
H18	CMC	H20	109.5°	90.0°
H19	CMC	H20	109.4°	90.0°
H22	CBC	H23	120.0°	90.0°
H25	CMD	H26	109.5°	90.0°
H25	CMD	H27	109.5°	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)
CMB	C2B	C1B	C3B	179.2°	90.0°
CMB	C2B	C1B	CHB	0.9°	90.0°
CMB	C2B	C1B	NB	177.3°	90.0°
CMB	C2B	C3B	CAB	2.1°	90.0°
CMB	C2B	C3B	C4B	179.3°	90.0°
C2B	CMB	H11	H12	120.0°	90.0°
C2B	CMB	H11	H13	120.0°	90.0°
C2B	CMB	H12	H13	120.0°	90.0°
CMA	C3A	C4A	CHB	2.1°	90.0°
CMA	C3A	C4A	C2A	179.1°	90.0°
CMA	C3A	C4A	NA	177.5°	90.0°
CMA	C3A	C2A	CAA	2.2°	90.0°
CMA	C3A	C2A	C1A	179.3°	90.0°
C3A	CMA	H7	H8	120.0°	90.0°
C3A	CMA	H7	H9	120.0°	90.0°
C3A	CMA	H8	H9	120.0°	90.0°
O1A	CGA	O2A	CBA	179.9°	90.0°
O1A	CGA	CBA	CAA	38.4°	90.0°
O1A	CGA	CBA	H4	159.0°	90.0°
O1A	CGA	CBA	H5	82.1°	90.0°
O1A	CGA	O2A	H6	0.0°	90.0°
CBB	CAB	C3B	C2B	31.6°	90.0°
CBB	CAB	C3B	H14	180.0°	90.0°
CBB	CAB	C3B	C4B	149.9°	90.0°
CAB	CBB	H15	H16	180.0°	90.0°
C2B	C1B	CHB	NB	177.9°	90.0°
C2B	C1B	CHB	C4A	165.6°	90.0°
C1B	C2B	C3B	CAB	178.8°	90.0°
C1B	C2B	C3B	C4B	0.2°	90.0°
C2B	C1B	NB	C4B	3.2°	90.0°
C2B	C1B	NB	IN	163.6°	90.0°
C2B	C1B	CHB	H10	14.4°	90.0°
C1B	C2B	CMB	H11	89.5°	90.0°
C1B	C2B	CMB	H12	150.5°	90.0°
C1B	C2B	CMB	H13	30.5°	90.0°
C3B	C2B	C1B	CHB	180.0°	90.0°
C3B	C2B	C1B	NB	1.9°	90.0°
C2B	C3B	CAB	C4B	178.5°	90.0°
C2B	C3B	C4B	NB	2.2°	90.0°
C2B	C3B	C4B	CHC	178.9°	90.0°
C3B	C2B	CMB	H11	89.4°	90.0°
C3B	C2B	CMB	H12	30.5°	90.0°
C3B	C2B	CMB	H13	150.6°	90.0°
C2B	C3B	CAB	H14	148.4°	90.0°
C1B	CHB	C4A	H10	180.0°	90.0°
C1B	CHB	C4A	C3A	174.7°	90.0°
C1B	CHB	C4A	NA	10.9°	90.0°
CHB	C1B	NB	C4B	178.5°	90.0°
CHB	C1B	NB	IN	18.1°	90.0°
CHB	C4A	C3A	NA	175.4°	90.0°
CHB	C4A	C3A	C2A	177.0°	90.0°
C4A	CHB	C1B	NB	16.5°	90.0°
CHB	C4A	NA	C1A	178.4°	90.0°
CHB	C4A	NA	IN	7.1°	90.0°
C4A	C3A	C2A	CAA	178.7°	90.0°
C4A	C3A	C2A	C1A	0.3°	90.0°
C3A	C4A	NA	C1A	2.9°	90.0°
C3A	C4A	NA	IN	177.5°	90.0°
C4A	C3A	CMA	H7	180.0°	90.0°
C4A	C3A	CMA	H8	60.0°	90.0°
C4A	C3A	CMA	H9	60.0°	90.0°
C3A	C4A	CHB	H10	5.3°	90.0°
C2A	C3A	C4A	NA	1.6°	90.0°
C3A	C2A	CAA	C1A	178.1°	90.0°
C3A	C2A	CAA	CBA	144.1°	90.0°
C3A	C2A	C1A	NA	2.0°	90.0°
C3A	C2A	C1A	CHA	179.2°	90.0°
C3A	C2A	CAA	H2	22.6°	90.0°
C3A	C2A	CAA	H3	94.5°	90.0°
C2A	C3A	CMA	H7	1.1°	90.0°
C2A	C3A	CMA	H8	119.0°	90.0°
C2A	C3A	CMA	H9	121.1°	90.0°
O2A	CGA	CBA	CAA	141.5°	90.0°
O2A	CGA	CBA	H4	20.9°	90.0°
O2A	CGA	CBA	H5	98.0°	90.0°
CGA	CBA	CAA	C2A	91.7°	90.0°
CGA	CBA	CAA	H4	120.6°	90.0°
CGA	CBA	CAA	H5	120.5°	90.0°
CGA	CBA	CAA	H2	29.8°	90.0°
CGA	CBA	CAA	H3	146.8°	90.0°
CGA	CBA	H4	H5	118.4°	90.0°
CBA	CGA	O2A	H6	179.9°	90.0°
C1B	NB	C4B	C3B	3.4°	90.0°
C1B	NB	C4B	IN	161.1°	90.0°
C1B	NB	C4B	CHC	179.9°	90.0°
C1B	NB	IN	NA	11.9°	90.0°
C1B	NB	IN	ND	119.5°	90.0°
NB	C1B	CHB	H10	163.5°	90.0°
C1B	NB	IN	NC	164.7°	90.0°
C4A	NA	C1A	C2A	3.1°	90.0°
C4A	NA	IN	NB	6.4°	90.0°
C4A	NA	C1A	IN	174.5°	90.0°
C4A	NA	C1A	CHA	178.0°	90.0°
C4A	NA	IN	ND	170.5°	90.0°
NA	C4A	CHB	H10	169.1°	90.0°
C4A	NA	IN	NC	90.7°	90.0°
CAB	C3B	C4B	NB	178.9°	90.0°
CAB	C3B	C4B	CHC	2.2°	90.0°
C3B	CAB	CBB	H15	180.0°	90.0°
C3B	CAB	CBB	H16	0.0°	90.0°
C3B	C4B	NB	CHC	176.5°	90.0°
C3B	C4B	NB	IN	164.6°	90.0°
C3B	C4B	CHC	C1C	155.3°	90.0°
C4B	C3B	CAB	H14	30.1°	90.0°
C3B	C4B	CHC	H17	24.7°	90.0°
C2A	CAA	CBA	H2	121.5°	90.0°
C2A	CAA	CBA	H3	121.5°	90.0°
CAA	C2A	C1A	NA	179.6°	90.0°
CAA	C2A	C1A	CHA	0.8°	90.0°
C2A	CAA	H2	H3	115.2°	90.0°
C2A	CAA	CBA	H4	28.8°	90.0°
C2A	CAA	CBA	H5	147.8°	90.0°
CBA	CAA	C2A	C1A	37.9°	90.0°
CBA	CAA	H2	H3	115.2°	90.0°
CAA	CBA	H4	H5	118.4°	90.0°
C2A	C1A	NA	CHA	178.8°	90.0°
C2A	C1A	NA	IN	177.7°	90.0°
C2A	C1A	CHA	C4D	167.0°	90.0°
C2A	C1A	CHA	H1	12.9°	90.0°
C1A	C2A	CAA	H2	159.3°	90.0°
C1A	C2A	CAA	H3	83.6°	90.0°
C4B	NB	IN	NA	169.4°	90.0°
NB	C4B	CHC	C1C	28.7°	90.0°
C4B	NB	IN	ND	38.0°	90.0°
NB	C4B	CHC	H17	151.3°	90.0°
C4B	NB	IN	NC	7.2°	90.0°
IN	NB	C4B	CHC	19.0°	90.0°
NB	IN	NA	C1A	179.9°	90.0°
NB	IN	NA	ND	176.9°	90.0°
NB	IN	NA	NC	97.1°	90.0°
NB	IN	ND	NC	45.3°	90.0°
NB	IN	NC	C1C	5.2°	90.0°
NB	IN	NC	C4C	168.7°	90.0°
NB	IN	ND	C4D	133.2°	90.0°
NB	IN	ND	C1D	38.6°	90.0°
C4B	CHC	C1C	H17	180.0°	90.0°
C4B	CHC	C1C	NC	24.9°	90.0°
C4B	CHC	C1C	C2C	158.1°	90.0°
C1A	NA	IN	ND	3.3°	90.0°
NA	C1A	CHA	C4D	14.3°	90.0°
NA	C1A	CHA	H1	165.7°	90.0°
C1A	NA	IN	NC	83.0°	90.0°
IN	NA	C1A	CHA	3.5°	90.0°
NA	IN	ND	NC	176.6°	90.0°
NA	IN	NC	C1C	92.0°	90.0°
NA	IN	NC	C4C	71.5°	90.0°
NA	IN	ND	C4D	1.8°	90.0°
NA	IN	ND	C1D	169.9°	90.0°
C1A	CHA	C4D	H1	180.0°	90.0°
C1A	CHA	C4D	ND	16.2°	90.0°
C1A	CHA	C4D	C3D	164.7°	90.0°
CHC	C1C	NC	C2C	177.5°	90.0°
CHC	C1C	NC	C4C	179.5°	90.0°
CHC	C1C	C2C	CMC	0.5°	90.0°
CHC	C1C	C2C	C3C	178.9°	90.0°
CHC	C1C	NC	IN	13.4°	90.0°
IN	ND	C4D	CHA	6.6°	90.0°
ND	IN	NC	C1C	171.9°	90.0°
ND	IN	NC	C4C	8.4°	90.0°
IN	ND	C4D	C1D	172.7°	90.0°
IN	ND	C4D	C3D	174.1°	90.0°
IN	ND	C1D	CHD	9.1°	90.0°
IN	ND	C1D	C2D	174.6°	90.0°
CHA	C4D	ND	C3D	179.2°	90.0°
CHA	C4D	ND	C1D	179.3°	90.0°
CHA	C4D	C3D	CAD	0.8°	90.0°
CHA	C4D	C3D	C2D	179.3°	90.0°
C1C	NC	C4C	IN	165.7°	90.0°
NC	C1C	C2C	CMC	177.9°	90.0°
NC	C1C	C2C	C3C	1.5°	90.0°
C1C	NC	C4C	C3C	3.3°	90.0°
C1C	NC	C4C	CHD	177.6°	90.0°
NC	C1C	CHC	H17	155.2°	90.0°
C2C	C1C	NC	C4C	3.0°	90.0°
C1C	C2C	CMC	C3C	179.3°	90.0°
C1C	C2C	C3C	C4C	0.6°	90.0°
C1C	C2C	C3C	CAC	177.8°	90.0°
C2C	C1C	CHC	H17	21.9°	90.0°
C1C	C2C	CMC	H18	180.0°	90.0°
C1C	C2C	CMC	H19	60.0°	90.0°
C1C	C2C	CMC	H20	60.0°	90.0°
C2C	C1C	NC	IN	169.1°	90.0°
NC	C4C	C3C	C2C	2.4°	90.0°
NC	C4C	C3C	CHD	179.0°	90.0°
NC	C4C	CHD	C1D	11.7°	90.0°
NC	C4C	C3C	CAC	179.8°	90.0°
NC	C4C	CHD	H24	168.3°	90.0°
ND	C4D	C3D	CAD	179.9°	90.0°
ND	C4D	C3D	C2D	0.1°	90.0°
C4D	ND	C1D	CHD	178.5°	90.0°
C4D	ND	C1D	C2D	2.2°	90.0°
ND	C4D	CHA	H1	163.9°	90.0°
C4D	ND	IN	NC	178.5°	90.0°
C3D	C4D	ND	C1D	1.4°	90.0°
C4D	C3D	CAD	C2D	179.8°	90.0°
C4D	C3D	C2D	C1D	1.2°	90.0°
C4D	C3D	CAD	CBD	71.8°	90.0°
C4D	C3D	C2D	CMD	179.5°	90.0°
C3D	C4D	CHA	H1	15.2°	90.0°
C4D	C3D	CAD	H28	168.8°	90.0°
C4D	C3D	CAD	H29	47.6°	90.0°
ND	C1D	CHD	C4C	10.3°	90.0°
ND	C1D	C2D	C3D	2.1°	90.0°
ND	C1D	CHD	C2D	175.7°	90.0°
ND	C1D	C2D	CMD	178.7°	90.0°
ND	C1D	CHD	H24	169.7°	90.0°
C1D	ND	IN	NC	6.7°	90.0°
CMC	C2C	C3C	C4C	179.9°	90.0°
CMC	C2C	C3C	CAC	2.8°	90.0°
C2C	CMC	H18	H19	120.0°	90.0°
C2C	CMC	H18	H20	120.0°	90.0°
C2C	CMC	H19	H20	120.0°	90.0°
C2C	C3C	C4C	CAC	177.4°	90.0°
C2C	C3C	C4C	CHD	178.6°	90.0°
C2C	C3C	CAC	CBC	43.7°	90.0°
C3C	C2C	CMC	H18	0.7°	90.0°
C3C	C2C	CMC	H19	120.7°	90.0°
C3C	C2C	CMC	H20	119.3°	90.0°
C2C	C3C	CAC	H21	136.3°	90.0°
C3C	C4C	CHD	C1D	169.4°	90.0°
C4C	C3C	CAC	CBC	139.4°	90.0°
C4C	C3C	CAC	H21	40.6°	90.0°
C3C	C4C	CHD	H24	10.6°	90.0°
C3C	C4C	NC	IN	169.1°	90.0°
C4C	CHD	C1D	H24	180.0°	90.0°
C4C	CHD	C1D	C2D	173.9°	90.0°
CHD	C4C	C3C	CAC	1.2°	90.0°
CHD	C4C	NC	IN	11.9°	90.0°
CAD	C3D	C2D	C1D	178.7°	90.0°
C3D	CAD	CBD	H28	119.4°	90.0°
C3D	CAD	CBD	H29	119.4°	90.0°
C3D	CAD	CBD	CGD	73.2°	90.0°
CAD	C3D	C2D	CMD	0.6°	90.0°
C3D	CAD	H28	H29	121.8°	90.0°
C3D	CAD	CBD	H30	166.5°	90.0°
C3D	CAD	CBD	H31	47.1°	90.0°
C3D	C2D	C1D	CHD	178.5°	90.0°
C3D	C2D	C1D	CMD	179.3°	90.0°
C2D	C3D	CAD	CBD	108.0°	90.0°
C3D	C2D	CMD	H25	180.0°	90.0°
C3D	C2D	CMD	H26	60.0°	90.0°
C3D	C2D	CMD	H27	60.0°	90.0°
C2D	C3D	CAD	H28	11.3°	90.0°
C2D	C3D	CAD	H29	132.6°	90.0°
CHD	C1D	C2D	CMD	2.2°	90.0°
C2D	C1D	CHD	H24	6.1°	90.0°
C1D	C2D	CMD	H25	0.8°	90.0°
C1D	C2D	CMD	H26	120.9°	90.0°
C1D	C2D	CMD	H27	119.2°	90.0°
CAD	CBD	CGD	H30	120.4°	90.0°
CAD	CBD	CGD	H31	120.3°	90.0°
CAD	CBD	CGD	O2D	151.9°	90.0°
CAD	CBD	CGD	O1D	30.0°	90.0°
CBD	CAD	H28	H29	121.7°	90.0°
CAD	CBD	H30	H31	118.9°	90.0°
C3C	CAC	CBC	H21	180.0°	90.0°
C3C	CAC	CBC	H22	180.0°	90.0°
C3C	CAC	CBC	H23	0.0°	90.0°
CBD	CGD	O2D	O1D	178.1°	90.0°
CGD	CBD	CAD	H28	46.2°	90.0°
CGD	CBD	CAD	H29	167.4°	90.0°
CGD	CBD	H30	H31	118.9°	90.0°
CBD	CGD	O1D	H32	178.0°	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°
O2D	CGD	CBD	H30	87.8°	90.0°
O2D	CGD	CBD	H31	31.6°	90.0°
O2D	CGD	O1D	H32	0.0°	90.0°
O1D	CGD	CBD	H30	90.4°	90.0°
O1D	CGD	CBD	H31	150.3°	90.0°
CAC	CBC	H22	H23	180.0°	90.0°
H2	CAA	CBA	H4	150.3°	90.0°
H2	CAA	CBA	H5	90.8°	90.0°
H3	CAA	CBA	H4	92.7°	90.0°
H3	CAA	CBA	H5	26.3°	90.0°
H7	CMA	H8	H9	120.0°	90.0°
H11	CMB	H12	H13	120.0°	90.0°
H14	CAB	CBB	H15	0.0°	90.0°
H14	CAB	CBB	H16	180.0°	90.0°
H18	CMC	H19	H20	120.0°	90.0°
H21	CAC	CBC	H22	0.0°	90.0°
H21	CAC	CBC	H23	180.0°	90.0°
H25	CMD	H26	H27	120.0°	90.0°
H28	CAD	CBD	H30	74.1°	90.0°
H28	CAD	CBD	H31	166.5°	90.0°
H29	CAD	CBD	H30	47.1°	90.0°
H29	CAD	CBD	H31	72.2°	90.0°

Release date:	2013-05-15
Definition date:	2012-06-08
Last modified:	2013-05-10
Release status:	REL
Processing site:	PDBJ
Derived from:	3VTM