4HE

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CL1	C4	sing	0.00Å	1.80Å
O2D	CGD	doub	0.00Å	1.27Å
C4	C3	doub	0.00Å	1.40Å	Aromatic
C4	C5	sing	0.00Å	1.39Å	Aromatic
CGD	O1D	sing	0.00Å	1.25Å
CGD	CBD	sing	0.00Å	1.53Å
C3	C2	sing	0.00Å	1.35Å	Aromatic
CBD	CAD	sing	0.00Å	1.55Å
C5	C6	doub	0.00Å	1.38Å	Aromatic
C2	C1	doub	0.00Å	1.40Å	Aromatic
C6	C1	sing	0.00Å	1.42Å	Aromatic
CAD	C3D	sing	0.00Å	1.48Å
C1	FE	sing	0.00Å	2.01Å
CAA	C2A	sing	0.00Å	1.48Å
CAA	CBA	sing	0.00Å	1.55Å
CMA	C3A	sing	0.00Å	1.51Å
C2A	C3A	doub	0.00Å	1.47Å
C2A	C1A	sing	0.00Å	1.46Å
C3D	C2D	doub	0.00Å	1.46Å
C3D	C4D	sing	0.00Å	1.47Å
CMD	C2D	sing	0.00Å	1.49Å
C3A	C4A	sing	0.00Å	1.47Å
CHA	C4D	doub	0.00Å	1.43Å
CHA	C1A	sing	0.00Å	1.47Å
C2D	C1D	sing	0.00Å	1.45Å
C4D	ND	sing	0.00Å	1.35Å
C1A	NA	doub	0.00Å	1.33Å
C4A	NA	sing	0.00Å	1.35Å
C4A	CHB	doub	0.00Å	1.43Å
NA	FE	sing	0.00Å	2.10Å
CBA	CGA	sing	0.00Å	1.54Å
C1D	ND	sing	0.00Å	1.43Å
C1D	CHD	doub	0.00Å	1.47Å
ND	FE	sing	0.00Å	2.06Å
CHB	C1B	sing	0.00Å	1.43Å
CHD	C4C	sing	0.00Å	1.42Å
FE	NB	sing	0.00Å	2.08Å
FE	NC	sing	0.00Å	2.14Å
C1B	NB	sing	0.00Å	1.33Å	Aromatic
C1B	C2B	doub	0.00Å	1.48Å	Aromatic
C4C	NC	doub	0.00Å	1.33Å
C4C	C3C	sing	0.00Å	1.48Å
NB	C4B	sing	0.00Å	1.43Å	Aromatic
O2A	CGA	doub	0.00Å	1.29Å
NC	C1C	sing	0.00Å	1.33Å
CGA	O1A	sing	0.00Å	1.26Å
CMB	C2B	sing	0.00Å	1.51Å
CAC	CBC	doub	0.00Å	1.35Å
CAC	C3C	sing	0.00Å	1.48Å
C2B	C3B	sing	0.00Å	1.48Å	Aromatic
C3C	C2C	doub	0.00Å	1.47Å
C1C	C2C	sing	0.00Å	1.46Å
C1C	CHC	doub	0.00Å	1.45Å
C4B	C3B	doub	0.00Å	1.48Å	Aromatic
C4B	CHC	sing	0.00Å	1.45Å
C2C	CMC	sing	0.00Å	1.51Å
C3B	CAB	sing	0.00Å	1.45Å
CBB	CAB	doub	0.00Å	1.32Å
O1D	H1	sing	0.00Å	0.95Å
CBD	H2	sing	0.00Å	1.10Å
CBD	H3	sing	0.00Å	1.10Å
CAD	H4	sing	0.00Å	1.10Å
CAD	H5	sing	0.00Å	1.10Å
CMD	H6	sing	0.00Å	1.10Å
CMD	H7	sing	0.00Å	1.10Å
CMD	H8	sing	0.00Å	1.10Å
CHA	H9	sing	0.00Å	1.08Å
CHD	H10	sing	0.00Å	1.08Å
CAB	H11	sing	0.00Å	1.08Å
CBB	H12	sing	0.00Å	1.08Å
CBB	H13	sing	0.00Å	1.08Å
CMB	H14	sing	0.00Å	1.10Å
CMB	H15	sing	0.00Å	1.10Å
CMB	H16	sing	0.00Å	1.10Å
CHB	H17	sing	0.00Å	1.08Å
CAC	H18	sing	0.00Å	1.08Å
CBC	H19	sing	0.00Å	1.08Å
CBC	H20	sing	0.00Å	1.08Å
CMC	H21	sing	0.00Å	1.10Å
CMC	H22	sing	0.00Å	1.10Å
CMC	H23	sing	0.00Å	1.10Å
CHC	H24	sing	0.00Å	1.08Å
CMA	H25	sing	0.00Å	1.10Å
CMA	H26	sing	0.00Å	1.10Å
CMA	H27	sing	0.00Å	1.10Å
CAA	H28	sing	0.00Å	1.10Å
CAA	H29	sing	0.00Å	1.10Å
CBA	H30	sing	0.00Å	1.10Å
CBA	H31	sing	0.00Å	1.10Å
O1A	H32	sing	0.00Å	0.95Å
C2	H33	sing	0.00Å	1.08Å
C3	H34	sing	0.00Å	1.08Å
C5	H35	sing	0.00Å	1.08Å
C6	H36	sing	0.00Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CL1	C4	C3	119.9°	90.0°
CL1	C4	C5	117.4°	90.0°
O2D	CGD	O1D	117.3°	90.0°
O2D	CGD	CBD	123.5°	90.0°
C3	C4	C5	122.7°	90.0°
C4	C3	C2	119.2°	90.0°
C4	C3	H34	120.4°	90.0°
C4	C5	C6	118.2°	90.0°
C4	C5	H35	120.9°	90.0°
O1D	CGD	CBD	119.0°	90.0°
CGD	O1D	H1	109.5°	90.0°
CGD	CBD	CAD	111.2°	90.0°
CGD	CBD	H2	109.0°	90.0°
CGD	CBD	H3	109.0°	90.0°
C3	C2	C1	119.6°	90.0°
C3	C2	H33	120.2°	90.0°
C2	C3	H34	120.4°	90.0°
CBD	CAD	C3D	100.3°	90.0°
CAD	CBD	H2	109.0°	90.0°
CAD	CBD	H3	109.0°	90.0°
CBD	CAD	H4	111.7°	90.0°
CBD	CAD	H5	111.7°	90.0°
C5	C6	C1	119.3°	90.0°
C6	C5	H35	120.9°	90.0°
C5	C6	H36	120.4°	90.0°
C2	C1	C6	120.9°	90.0°
C2	C1	FE	118.5°	90.0°
C1	C2	H33	120.2°	90.0°
C6	C1	FE	120.4°	90.0°
C1	C6	H36	120.3°	90.0°
CAD	C3D	C2D	122.4°	90.0°
CAD	C3D	C4D	130.4°	90.0°
C3D	CAD	H4	111.7°	90.0°
C3D	CAD	H5	111.7°	90.0°
C1	FE	NA	92.7°	90.0°
C1	FE	ND	85.6°	90.0°
C1	FE	NB	93.6°	90.0°
C1	FE	NC	86.3°	90.0°
C2A	CAA	CBA	106.4°	90.0°
CAA	C2A	C3A	127.8°	90.0°
CAA	C2A	C1A	123.8°	90.0°
C2A	CAA	H28	110.2°	90.0°
C2A	CAA	H29	110.2°	90.0°
CAA	CBA	CGA	114.3°	90.0°
CBA	CAA	H28	110.2°	90.0°
CBA	CAA	H29	110.2°	90.0°
CAA	CBA	H30	108.2°	90.0°
CAA	CBA	H31	108.2°	90.0°
CMA	C3A	C2A	128.3°	90.0°
CMA	C3A	C4A	131.8°	90.0°
C3A	CMA	H25	109.5°	90.0°
C3A	CMA	H26	109.5°	90.0°
C3A	CMA	H27	109.5°	90.0°
C3A	C2A	C1A	108.3°	90.0°
C2A	C3A	C4A	99.9°	90.0°
C2A	C1A	CHA	121.3°	90.0°
C2A	C1A	NA	108.9°	90.0°
C2D	C3D	C4D	107.1°	90.0°
C3D	C2D	CMD	132.3°	90.0°
C3D	C2D	C1D	104.5°	90.0°
C3D	C4D	CHA	122.3°	90.0°
C3D	C4D	ND	109.8°	90.0°
CMD	C2D	C1D	123.1°	90.0°
C2D	CMD	H6	109.5°	90.0°
C2D	CMD	H7	109.5°	90.0°
C2D	CMD	H8	109.5°	90.0°
C3A	C4A	NA	113.8°	90.0°
C3A	C4A	CHB	119.7°	90.0°
C4D	CHA	C1A	119.5°	90.0°
CHA	C4D	ND	127.9°	90.0°
C4D	CHA	H9	120.2°	90.0°
CHA	C1A	NA	129.6°	90.0°
C1A	CHA	H9	120.3°	90.0°
C2D	C1D	ND	109.9°	90.0°
C2D	C1D	CHD	123.0°	90.0°
C4D	ND	C1D	108.7°	90.0°
C4D	ND	FE	128.1°	90.0°
C1A	NA	C4A	109.1°	90.0°
C1A	NA	FE	125.2°	90.0°
NA	C4A	CHB	126.6°	90.0°
C4A	NA	FE	125.8°	90.0°
C4A	CHB	C1B	123.8°	90.0°
C4A	CHB	H17	118.1°	90.0°
NA	FE	ND	88.9°	90.0°
NA	FE	NB	89.6°	90.0°
NA	FE	NC	178.4°	90.0°
CBA	CGA	O2A	122.7°	90.0°
CBA	CGA	O1A	117.2°	90.0°
CGA	CBA	H30	108.3°	90.0°
CGA	CBA	H31	108.3°	90.0°
ND	C1D	CHD	127.2°	90.0°
C1D	ND	FE	122.9°	90.0°
C1D	CHD	C4C	124.6°	90.0°
C1D	CHD	H10	117.7°	90.0°
ND	FE	NB	178.3°	90.0°
ND	FE	NC	92.1°	90.0°
CHB	C1B	NB	127.7°	90.0°
CHB	C1B	C2B	119.7°	90.0°
C1B	CHB	H17	118.1°	90.0°
CHD	C4C	NC	127.4°	90.0°
CHD	C4C	C3C	120.4°	90.0°
C4C	CHD	H10	117.7°	90.0°
NB	FE	NC	89.3°	90.0°
FE	NB	C1B	126.0°	90.0°
FE	NB	C4B	125.8°	90.0°
FE	NC	C4C	125.3°	90.0°
FE	NC	C1C	127.6°	90.0°
NB	C1B	C2B	112.6°	90.0°
C1B	NB	C4B	108.1°	90.0°
C1B	C2B	CMB	126.3°	90.0°
C1B	C2B	C3B	104.5°	90.0°
NC	C4C	C3C	112.2°	90.0°
C4C	NC	C1C	106.8°	90.0°
C4C	C3C	CAC	126.7°	90.0°
C4C	C3C	C2C	104.3°	90.0°
NB	C4B	C3B	109.4°	90.0°
NB	C4B	CHC	126.5°	90.0°
O2A	CGA	O1A	120.1°	90.0°
NC	C1C	C2C	115.0°	90.0°
NC	C1C	CHC	127.2°	90.0°
CGA	O1A	H32	109.5°	90.0°
CMB	C2B	C3B	129.1°	90.0°
C2B	CMB	H14	109.5°	90.0°
C2B	CMB	H15	109.5°	90.0°
C2B	CMB	H16	109.5°	90.0°
CBC	CAC	C3C	120.4°	90.0°
CBC	CAC	H18	119.8°	90.0°
CAC	CBC	H19	120.0°	90.0°
CAC	CBC	H20	120.0°	90.0°
CAC	C3C	C2C	128.9°	90.0°
C3C	CAC	H18	119.8°	90.0°
C2B	C3B	C4B	105.3°	90.0°
C2B	C3B	CAB	134.5°	90.0°
C3C	C2C	C1C	101.7°	90.0°
C3C	C2C	CMC	132.4°	90.0°
C2C	C1C	CHC	117.7°	90.0°
C1C	C2C	CMC	125.9°	90.0°
C1C	CHC	C4B	123.1°	90.0°
C1C	CHC	H24	118.5°	90.0°
C3B	C4B	CHC	123.8°	90.0°
C4B	C3B	CAB	120.1°	90.0°
C4B	CHC	H24	118.4°	90.0°
C2C	CMC	H21	109.5°	90.0°
C2C	CMC	H22	109.5°	90.0°
C2C	CMC	H23	109.4°	90.0°
C3B	CAB	CBB	121.8°	90.0°
C3B	CAB	H11	119.1°	90.0°
CBB	CAB	H11	119.1°	90.0°
CAB	CBB	H12	120.0°	90.0°
CAB	CBB	H13	120.0°	90.0°
H2	CBD	H3	109.5°	90.0°
H4	CAD	H5	109.5°	90.0°
H6	CMD	H7	109.5°	90.0°
H6	CMD	H8	109.5°	90.0°
H7	CMD	H8	109.5°	90.0°
H12	CBB	H13	120.0°	90.0°
H14	CMB	H15	109.5°	90.0°
H14	CMB	H16	109.5°	90.0°
H15	CMB	H16	109.5°	90.0°
H19	CBC	H20	120.0°	90.0°
H21	CMC	H22	109.5°	90.0°
H21	CMC	H23	109.5°	90.0°
H22	CMC	H23	109.4°	90.0°
H25	CMA	H26	109.5°	90.0°
H25	CMA	H27	109.5°	90.0°
H26	CMA	H27	109.4°	90.0°
H28	CAA	H29	109.5°	90.0°
H30	CBA	H31	109.4°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CL1	C4	C3	C5	179.3°	90.0°
CL1	C4	C3	C2	179.6°	90.0°
CL1	C4	C5	C6	177.4°	90.0°
CL1	C4	C3	H34	0.5°	90.0°
CL1	C4	C5	H35	2.6°	90.0°
O2D	CGD	O1D	CBD	175.5°	90.0°
O2D	CGD	CBD	CAD	127.8°	90.0°
O2D	CGD	O1D	H1	0.0°	90.0°
O2D	CGD	CBD	H2	7.6°	90.0°
O2D	CGD	CBD	H3	111.9°	90.0°
C4	C3	C2	H34	180.0°	90.0°
C3	C4	C5	C6	1.9°	90.0°
C4	C3	C2	C1	3.9°	90.0°
C4	C3	C2	H33	176.1°	90.0°
C3	C4	C5	H35	178.1°	90.0°
C5	C4	C3	C2	0.3°	90.0°
C4	C5	C6	H35	180.0°	90.0°
C4	C5	C6	C1	0.4°	90.0°
C5	C4	C3	H34	179.7°	90.0°
C4	C5	C6	H36	179.6°	90.0°
O1D	CGD	CBD	CAD	47.4°	90.0°
O1D	CGD	CBD	H2	167.6°	90.0°
O1D	CGD	CBD	H3	72.9°	90.0°
CGD	CBD	CAD	H2	120.3°	90.0°
CGD	CBD	CAD	H3	120.3°	90.0°
CGD	CBD	CAD	C3D	178.0°	90.0°
CBD	CGD	O1D	H1	175.5°	90.0°
CGD	CBD	H2	H3	119.2°	90.0°
CGD	CBD	CAD	H4	63.5°	90.0°
CGD	CBD	CAD	H5	59.5°	90.0°
C3	C2	C1	H33	180.0°	90.0°
C3	C2	C1	C6	5.4°	90.0°
C3	C2	C1	FE	179.5°	90.0°
CBD	CAD	C3D	H4	118.5°	90.0°
CBD	CAD	C3D	H5	118.5°	90.0°
CBD	CAD	C3D	C2D	82.6°	90.0°
CBD	CAD	C3D	C4D	93.0°	90.0°
CAD	CBD	H2	H3	119.2°	90.0°
CBD	CAD	H4	H5	124.3°	90.0°
C5	C6	C1	C2	3.2°	90.0°
C5	C6	C1	H36	180.0°	90.0°
C5	C6	C1	FE	177.2°	90.0°
C2	C1	C6	FE	174.0°	90.0°
C2	C1	FE	NA	44.3°	90.0°
C2	C1	FE	ND	44.4°	90.0°
C2	C1	FE	NB	134.1°	90.0°
C2	C1	FE	NC	136.9°	90.0°
C1	C2	C3	H34	176.1°	90.0°
C2	C1	C6	H36	176.8°	90.0°
C6	C1	FE	NA	141.5°	90.0°
C6	C1	FE	ND	129.8°	90.0°
C6	C1	FE	NB	51.7°	90.0°
C6	C1	FE	NC	37.3°	90.0°
C6	C1	C2	H33	174.6°	90.0°
C1	C6	C5	H35	179.5°	90.0°
CAD	C3D	C2D	C4D	176.5°	90.0°
CAD	C3D	C2D	CMD	4.8°	90.0°
CAD	C3D	C4D	CHA	3.2°	90.0°
CAD	C3D	C2D	C1D	179.3°	90.0°
CAD	C3D	C4D	ND	178.9°	90.0°
C3D	CAD	CBD	H2	57.7°	90.0°
C3D	CAD	CBD	H3	61.8°	90.0°
C3D	CAD	H4	H5	124.3°	90.0°
C1	FE	ND	C4D	93.4°	90.0°
C1	FE	NA	C1A	90.5°	90.0°
C1	FE	NA	C4A	87.8°	90.0°
C1	FE	NA	ND	85.5°	90.0°
C1	FE	NA	NB	93.6°	90.0°
C1	FE	NA	NC	46.9°	90.0°
C1	FE	ND	C1D	79.1°	90.0°
C1	FE	ND	NB	59.3°	90.0°
C1	FE	ND	NC	86.1°	90.0°
C1	FE	NB	NC	86.2°	90.0°
C1	FE	NB	C1B	87.5°	90.0°
C1	FE	NC	C4C	78.5°	90.0°
C1	FE	NB	C4B	92.1°	90.0°
C1	FE	NC	C1C	94.6°	90.0°
FE	C1	C2	H33	0.5°	90.0°
FE	C1	C6	H36	2.8°	90.0°
C2A	CAA	CBA	H28	119.5°	90.0°
C2A	CAA	CBA	H29	119.5°	90.0°
CAA	C2A	C3A	CMA	2.3°	90.0°
CAA	C2A	C3A	C1A	177.4°	90.0°
CAA	C2A	C3A	C4A	177.5°	90.0°
CAA	C2A	C1A	CHA	6.0°	90.0°
CAA	C2A	C1A	NA	177.7°	90.0°
C2A	CAA	CBA	CGA	69.4°	90.0°
C2A	CAA	H28	H29	121.4°	90.0°
C2A	CAA	CBA	H30	51.3°	90.0°
C2A	CAA	CBA	H31	169.8°	90.0°
CBA	CAA	C2A	C3A	72.9°	90.0°
CBA	CAA	C2A	C1A	104.2°	90.0°
CAA	CBA	CGA	H30	120.7°	90.0°
CAA	CBA	CGA	H31	120.7°	90.0°
CAA	CBA	CGA	O2A	49.0°	90.0°
CAA	CBA	CGA	O1A	129.2°	90.0°
CBA	CAA	H28	H29	121.4°	90.0°
CAA	CBA	H30	H31	117.8°	90.0°
CMA	C3A	C2A	C4A	179.7°	90.0°
CMA	C3A	C2A	C1A	179.7°	90.0°
CMA	C3A	C4A	NA	179.8°	90.0°
CMA	C3A	C4A	CHB	0.0°	90.0°
C3A	CMA	H25	H26	120.0°	90.0°
C3A	CMA	H25	H27	120.0°	90.0°
C3A	CMA	H26	H27	120.0°	90.0°
C3A	C2A	C1A	CHA	176.4°	90.0°
C3A	C2A	C1A	NA	0.1°	90.0°
C2A	C3A	C4A	NA	0.1°	90.0°
C2A	C3A	C4A	CHB	179.7°	90.0°
C2A	C3A	CMA	H25	180.0°	90.0°
C2A	C3A	CMA	H26	60.0°	90.0°
C2A	C3A	CMA	H27	60.0°	90.0°
C3A	C2A	CAA	H28	46.6°	90.0°
C3A	C2A	CAA	H29	167.6°	90.0°
C1A	C2A	C3A	C4A	0.0°	90.0°
C2A	C1A	CHA	C4D	169.2°	90.0°
C2A	C1A	CHA	NA	175.4°	90.0°
C2A	C1A	NA	C4A	0.2°	90.0°
C2A	C1A	NA	FE	178.3°	90.0°
C2A	C1A	CHA	H9	10.8°	90.0°
C1A	C2A	CAA	H28	136.3°	90.0°
C1A	C2A	CAA	H29	15.3°	90.0°
C3D	C2D	CMD	C1D	175.3°	90.0°
C2D	C3D	C4D	CHA	179.3°	90.0°
C2D	C3D	C4D	ND	2.7°	90.0°
C3D	C2D	C1D	ND	2.0°	90.0°
C3D	C2D	C1D	CHD	179.0°	90.0°
C2D	C3D	CAD	H4	158.9°	90.0°
C2D	C3D	CAD	H5	35.8°	90.0°
C3D	C2D	CMD	H6	180.0°	90.0°
C3D	C2D	CMD	H7	60.0°	90.0°
C3D	C2D	CMD	H8	60.0°	90.0°
C4D	C3D	C2D	CMD	178.7°	90.0°
C3D	C4D	CHA	ND	177.6°	90.0°
C3D	C4D	CHA	C1A	171.0°	90.0°
C4D	C3D	C2D	C1D	2.8°	90.0°
C3D	C4D	ND	C1D	1.5°	90.0°
C3D	C4D	ND	FE	174.8°	90.0°
C4D	C3D	CAD	H4	25.5°	90.0°
C4D	C3D	CAD	H5	148.5°	90.0°
C3D	C4D	CHA	H9	9.0°	90.0°
CMD	C2D	C1D	ND	178.4°	90.0°
CMD	C2D	C1D	CHD	2.6°	90.0°
C2D	CMD	H6	H7	120.0°	90.0°
C2D	CMD	H6	H8	120.0°	90.0°
C2D	CMD	H7	H8	120.0°	90.0°
C3A	C4A	NA	C1A	0.2°	90.0°
C3A	C4A	NA	CHB	179.8°	90.0°
C3A	C4A	NA	FE	178.2°	90.0°
C3A	C4A	CHB	C1B	174.6°	90.0°
C3A	C4A	CHB	H17	5.4°	90.0°
C4A	C3A	CMA	H25	0.4°	90.0°
C4A	C3A	CMA	H26	120.4°	90.0°
C4A	C3A	CMA	H27	119.7°	90.0°
C4D	CHA	C1A	H9	180.0°	90.0°
C4D	CHA	C1A	NA	6.2°	90.0°
CHA	C4D	ND	C1D	179.3°	90.0°
CHA	C4D	ND	FE	7.3°	90.0°
C1A	CHA	C4D	ND	11.4°	90.0°
CHA	C1A	NA	C4A	176.1°	90.0°
CHA	C1A	NA	FE	2.4°	90.0°
C2D	C1D	ND	C4D	0.3°	90.0°
C2D	C1D	ND	CHD	179.0°	90.0°
C2D	C1D	ND	FE	173.4°	90.0°
C2D	C1D	CHD	C4C	178.1°	90.0°
C1D	C2D	CMD	H6	4.7°	90.0°
C1D	C2D	CMD	H7	115.3°	90.0°
C1D	C2D	CMD	H8	124.7°	90.0°
C2D	C1D	CHD	H10	1.9°	90.0°
C4D	ND	FE	NA	0.6°	90.0°
C4D	ND	C1D	FE	173.8°	90.0°
C4D	ND	C1D	CHD	179.3°	90.0°
C4D	ND	FE	NB	34.1°	90.0°
C4D	ND	FE	NC	179.5°	90.0°
ND	C4D	CHA	H9	168.6°	90.0°
C1A	NA	C4A	FE	178.5°	90.0°
C1A	NA	C4A	CHB	179.6°	90.0°
C1A	NA	FE	ND	5.0°	90.0°
C1A	NA	FE	NB	176.0°	90.0°
C1A	NA	FE	NC	137.4°	90.0°
NA	C1A	CHA	H9	173.8°	90.0°
C4A	NA	FE	ND	173.3°	90.0°
NA	C4A	CHB	C1B	5.1°	90.0°
C4A	NA	FE	NB	5.8°	90.0°
C4A	NA	FE	NC	40.8°	90.0°
NA	C4A	CHB	H17	174.9°	90.0°
CHB	C4A	NA	FE	2.0°	90.0°
C4A	CHB	C1B	H17	180.0°	90.0°
C4A	CHB	C1B	NB	5.9°	90.0°
C4A	CHB	C1B	C2B	171.3°	90.0°
NA	FE	ND	C1D	171.9°	90.0°
NA	FE	ND	NB	33.5°	90.0°
NA	FE	ND	NC	178.8°	90.0°
NA	FE	NB	NC	178.9°	90.0°
NA	FE	NB	C1B	5.2°	90.0°
NA	FE	NC	C4C	125.5°	90.0°
NA	FE	NB	C4B	175.2°	90.0°
NA	FE	NC	C1C	47.6°	90.0°
CBA	CGA	O2A	O1A	178.1°	90.0°
CGA	CBA	CAA	H28	171.1°	90.0°
CGA	CBA	CAA	H29	50.1°	90.0°
CGA	CBA	H30	H31	117.8°	90.0°
CBA	CGA	O1A	H32	178.2°	90.0°
ND	C1D	CHD	C4C	0.7°	90.0°
C1D	ND	FE	NB	138.4°	90.0°
C1D	ND	FE	NC	7.0°	90.0°
ND	C1D	CHD	H10	179.3°	90.0°
CHD	C1D	ND	FE	5.5°	90.0°
C1D	CHD	C4C	H10	180.0°	90.0°
C1D	CHD	C4C	NC	0.3°	90.0°
C1D	CHD	C4C	C3C	178.5°	90.0°
ND	FE	NB	NC	145.4°	90.0°
ND	FE	NB	C1B	28.3°	90.0°
ND	FE	NC	C4C	6.9°	90.0°
ND	FE	NB	C4B	151.3°	90.0°
ND	FE	NC	C1C	180.0°	90.0°
CHB	C1B	NB	FE	0.6°	90.0°
CHB	C1B	NB	C2B	177.4°	90.0°
CHB	C1B	NB	C4B	179.7°	90.0°
CHB	C1B	C2B	CMB	2.2°	90.0°
CHB	C1B	C2B	C3B	179.7°	90.0°
CHD	C4C	NC	FE	4.7°	90.0°
CHD	C4C	NC	C3C	178.8°	90.0°
CHD	C4C	NC	C1C	179.0°	90.0°
CHD	C4C	C3C	CAC	2.1°	90.0°
CHD	C4C	C3C	C2C	178.4°	90.0°
FE	NB	C1B	C4B	179.7°	90.0°
FE	NB	C1B	C2B	178.0°	90.0°
NB	FE	NC	C4C	172.1°	90.0°
NB	FE	NC	C1C	1.0°	90.0°
FE	NB	C4B	C3B	178.7°	90.0°
FE	NB	C4B	CHC	6.6°	90.0°
NC	FE	NB	C1B	173.7°	90.0°
FE	NC	C4C	C1C	174.3°	90.0°
FE	NC	C4C	C3C	174.1°	90.0°
NC	FE	NB	C4B	5.9°	90.0°
FE	NC	C1C	C2C	173.4°	90.0°
FE	NC	C1C	CHC	4.3°	90.0°
NB	C1B	C2B	CMB	179.8°	90.0°
NB	C1B	C2B	C3B	2.0°	90.0°
C1B	NB	C4B	C3B	1.6°	90.0°
C1B	NB	C4B	CHC	173.1°	90.0°
NB	C1B	CHB	H17	174.0°	90.0°
C2B	C1B	NB	C4B	2.3°	90.0°
C1B	C2B	CMB	C3B	177.7°	90.0°
C1B	C2B	C3B	C4B	0.9°	90.0°
C1B	C2B	C3B	CAB	174.1°	90.0°
C1B	C2B	CMB	H14	91.1°	90.0°
C1B	C2B	CMB	H15	148.9°	90.0°
C1B	C2B	CMB	H16	28.9°	90.0°
C2B	C1B	CHB	H17	8.7°	90.0°
NC	C4C	C3C	CAC	176.8°	90.0°
NC	C4C	C3C	C2C	0.5°	90.0°
C4C	NC	C1C	C2C	0.8°	90.0°
C4C	NC	C1C	CHC	178.5°	90.0°
NC	C4C	CHD	H10	179.7°	90.0°
C3C	C4C	NC	C1C	0.2°	90.0°
C4C	C3C	CAC	CBC	163.6°	90.0°
C4C	C3C	CAC	C2C	175.4°	90.0°
C4C	C3C	C2C	C1C	0.8°	90.0°
C4C	C3C	C2C	CMC	179.4°	90.0°
C3C	C4C	CHD	H10	1.5°	90.0°
C4C	C3C	CAC	H18	16.4°	90.0°
NB	C4B	C3B	C2B	0.4°	90.0°
NB	C4B	CHC	C1C	0.2°	90.0°
NB	C4B	C3B	CHC	174.9°	90.0°
NB	C4B	C3B	CAB	176.3°	90.0°
NB	C4B	CHC	H24	179.8°	90.0°
O2A	CGA	CBA	H30	169.7°	90.0°
O2A	CGA	CBA	H31	71.7°	90.0°
O2A	CGA	O1A	H32	0.0°	90.0°
NC	C1C	C2C	C3C	1.1°	90.0°
NC	C1C	C2C	CHC	177.9°	90.0°
NC	C1C	CHC	C4B	5.7°	90.0°
NC	C1C	C2C	CMC	179.7°	90.0°
NC	C1C	CHC	H24	174.3°	90.0°
O1A	CGA	CBA	H30	8.4°	90.0°
O1A	CGA	CBA	H31	110.1°	90.0°
CMB	C2B	C3B	C4B	179.0°	90.0°
CMB	C2B	C3B	CAB	4.0°	90.0°
C2B	CMB	H14	H15	120.0°	90.0°
C2B	CMB	H14	H16	120.0°	90.0°
C2B	CMB	H15	H16	120.0°	90.0°
CBC	CAC	C3C	H18	180.0°	90.0°
CBC	CAC	C3C	C2C	11.8°	90.0°
CAC	CBC	H19	H20	180.0°	90.0°
CAC	C3C	C2C	C1C	177.0°	90.0°
CAC	C3C	C2C	CMC	4.4°	90.0°
C3C	CAC	CBC	H19	180.0°	90.0°
C3C	CAC	CBC	H20	0.0°	90.0°
C2B	C3B	C4B	CAB	175.9°	90.0°
C2B	C3B	C4B	CHC	174.5°	90.0°
C2B	C3B	CAB	CBB	21.9°	90.0°
C2B	C3B	CAB	H11	158.1°	90.0°
C3B	C2B	CMB	H14	91.2°	90.0°
C3B	C2B	CMB	H15	28.8°	90.0°
C3B	C2B	CMB	H16	148.8°	90.0°
C3C	C2C	C1C	CMC	178.7°	90.0°
C3C	C2C	C1C	CHC	179.0°	90.0°
C2C	C3C	CAC	H18	168.2°	90.0°
C3C	C2C	CMC	H21	180.0°	90.0°
C3C	C2C	CMC	H22	60.0°	90.0°
C3C	C2C	CMC	H23	60.0°	90.0°
C2C	C1C	CHC	C4B	171.9°	90.0°
C1C	C2C	CMC	H21	1.8°	90.0°
C1C	C2C	CMC	H22	118.2°	90.0°
C1C	C2C	CMC	H23	121.8°	90.0°
C2C	C1C	CHC	H24	8.0°	90.0°
C1C	CHC	C4B	C3B	174.2°	90.0°
C1C	CHC	C4B	H24	180.0°	90.0°
CHC	C1C	C2C	CMC	2.3°	90.0°
C4B	C3B	CAB	CBB	152.5°	90.0°
C4B	C3B	CAB	H11	27.5°	90.0°
C3B	C4B	CHC	H24	5.8°	90.0°
CHC	C4B	C3B	CAB	1.3°	90.0°
C2C	CMC	H21	H22	120.0°	90.0°
C2C	CMC	H21	H23	120.0°	90.0°
C2C	CMC	H22	H23	120.0°	90.0°
C3B	CAB	CBB	H11	180.0°	90.0°
C3B	CAB	CBB	H12	180.0°	90.0°
C3B	CAB	CBB	H13	0.0°	90.0°
CAB	CBB	H12	H13	179.9°	90.0°
H2	CBD	CAD	H4	176.2°	90.0°
H2	CBD	CAD	H5	60.8°	90.0°
H3	CBD	CAD	H4	56.7°	90.0°
H3	CBD	CAD	H5	179.8°	90.0°
H6	CMD	H7	H8	120.0°	90.0°
H11	CAB	CBB	H12	0.0°	90.0°
H11	CAB	CBB	H13	180.0°	90.0°
H14	CMB	H15	H16	120.0°	90.0°
H18	CAC	CBC	H19	0.0°	90.0°
H18	CAC	CBC	H20	180.0°	90.0°
H21	CMC	H22	H23	120.0°	90.0°
H25	CMA	H26	H27	120.0°	90.0°
H28	CAA	CBA	H30	68.2°	90.0°
H28	CAA	CBA	H31	50.3°	90.0°
H29	CAA	CBA	H30	170.8°	90.0°
H29	CAA	CBA	H31	70.6°	90.0°
H33	C2	C3	H34	3.9°	90.0°
H35	C5	C6	H36	0.4°	90.0°

Release date:	2016-09-21
Definition date:	2016-03-14
Last modified:	2016-09-16
Release status:	REL
Processing site:	RCSB
Derived from:	5ILR