6CO

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O1D	CGD	doub	0.00Å	1.25Å
O2D	CGD	sing	0.00Å	1.25Å
CGD	CBD	sing	0.00Å	1.51Å
C4	C3	doub	0.00Å	1.39Å	Aromatic
C4	C5	sing	0.00Å	1.39Å	Aromatic
C3	C2	sing	0.00Å	1.39Å	Aromatic
CBD	CAD	sing	0.00Å	1.53Å
C5	C6	doub	0.00Å	1.38Å	Aromatic
C2	C1	doub	0.00Å	1.40Å	Aromatic
C6	C1	sing	0.00Å	1.41Å	Aromatic
CAD	C3D	sing	0.00Å	1.49Å
CAA	C2A	sing	0.00Å	1.49Å
CAA	CBA	sing	0.00Å	1.52Å
C1	FE	sing	0.00Å	1.85Å
C2A	C3A	doub	0.00Å	1.46Å
C2A	C1A	sing	0.00Å	1.46Å
C3D	C2D	doub	0.00Å	1.46Å
C3D	C4D	sing	0.00Å	1.48Å
CMD	C2D	sing	0.00Å	1.50Å
CMA	C3A	sing	0.00Å	1.51Å
CHA	C4D	doub	0.00Å	1.44Å
CHA	C1A	sing	0.00Å	1.44Å
C2D	C1D	sing	0.00Å	1.46Å
C3A	C4A	sing	0.00Å	1.47Å
C4D	ND	sing	0.00Å	1.32Å
C1A	NA	doub	0.00Å	1.32Å
CBA	CGA	sing	0.00Å	1.52Å
C1D	ND	sing	0.00Å	1.44Å
C1D	CHD	doub	0.00Å	1.47Å
C4A	NA	sing	0.00Å	1.33Å
C4A	CHB	doub	0.00Å	1.45Å
ND	FE	sing	0.00Å	2.09Å
NA	FE	sing	0.00Å	2.09Å
CHD	C4C	sing	0.00Å	1.45Å
CHB	C1B	sing	0.00Å	1.45Å
FE	NC	sing	0.00Å	2.11Å
FE	NB	sing	0.00Å	2.08Å
C4C	NC	doub	0.00Å	1.34Å
C4C	C3C	sing	0.00Å	1.47Å
O2A	CGA	doub	0.00Å	1.25Å
C1B	NB	sing	0.00Å	1.32Å	Aromatic
C1B	C2B	doub	0.00Å	1.48Å	Aromatic
CGA	O1A	sing	0.00Å	1.25Å
NC	C1C	sing	0.00Å	1.33Å
NB	C4B	sing	0.00Å	1.45Å	Aromatic
CAC	C3C	sing	0.00Å	1.47Å
CAC	CBC	doub	0.00Å	1.31Å
C3C	C2C	doub	0.00Å	1.45Å
C2B	CMB	sing	0.00Å	1.49Å
C2B	C3B	sing	0.00Å	1.47Å	Aromatic
C1C	C2C	sing	0.00Å	1.46Å
C1C	CHC	doub	0.00Å	1.45Å
C4B	CHC	sing	0.00Å	1.46Å
C4B	C3B	doub	0.00Å	1.43Å	Aromatic
C2C	CMC	sing	0.00Å	1.50Å
C3B	CAB	sing	0.00Å	1.45Å
CBB	CAB	doub	0.00Å	1.27Å
C4	H1	sing	0.00Å	1.08Å
C5	H2	sing	0.00Å	1.08Å
C6	H3	sing	0.00Å	1.08Å
CAB	H4	sing	0.00Å	1.08Å
CAC	H5	sing	0.00Å	1.08Å
C2	H6	sing	0.00Å	1.08Å
CAA	H7	sing	0.00Å	1.10Å
CAA	H8	sing	0.00Å	1.10Å
O2D	H9	sing	0.00Å	0.95Å
CBD	H10	sing	0.00Å	1.10Å
CBD	H11	sing	0.00Å	1.10Å
CAD	H12	sing	0.00Å	1.10Å
CAD	H13	sing	0.00Å	1.10Å
CMD	H14	sing	0.00Å	1.10Å
CMD	H15	sing	0.00Å	1.10Å
CMD	H16	sing	0.00Å	1.10Å
CHA	H17	sing	0.00Å	1.08Å
CHD	H18	sing	0.00Å	1.08Å
CBB	H19	sing	0.00Å	1.08Å
CBB	H20	sing	0.00Å	1.08Å
CMB	H21	sing	0.00Å	1.10Å
CMB	H22	sing	0.00Å	1.10Å
CMB	H23	sing	0.00Å	1.10Å
CHB	H24	sing	0.00Å	1.08Å
CBC	H25	sing	0.00Å	1.08Å
CBC	H26	sing	0.00Å	1.08Å
CMC	H27	sing	0.00Å	1.10Å
CMC	H28	sing	0.00Å	1.10Å
CMC	H29	sing	0.00Å	1.10Å
CHC	H30	sing	0.00Å	1.08Å
CMA	H31	sing	0.00Å	1.10Å
CMA	H32	sing	0.00Å	1.10Å
CMA	H33	sing	0.00Å	1.10Å
CBA	H34	sing	0.00Å	1.10Å
CBA	H35	sing	0.00Å	1.10Å
O1A	H36	sing	0.00Å	0.95Å
C3	H37	sing	0.00Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1D	CGD	O2D	118.7°	90.0°
O1D	CGD	CBD	120.5°	90.0°
O2D	CGD	CBD	120.7°	90.0°
CGD	O2D	H9	109.5°	90.0°
CGD	CBD	CAD	114.7°	90.0°
CGD	CBD	H10	108.1°	90.0°
CGD	CBD	H11	108.2°	90.0°
C3	C4	C5	118.8°	90.0°
C4	C3	C2	120.5°	90.0°
C3	C4	H1	120.6°	90.0°
C4	C3	H37	119.8°	90.0°
C4	C5	C6	121.0°	90.0°
C5	C4	H1	120.6°	90.0°
C4	C5	H2	119.5°	90.0°
C3	C2	C1	121.6°	90.0°
C3	C2	H6	119.2°	90.0°
C2	C3	H37	119.8°	90.0°
CBD	CAD	C3D	96.9°	90.0°
CAD	CBD	H10	108.2°	90.0°
CAD	CBD	H11	108.2°	90.0°
CBD	CAD	H12	112.5°	90.0°
CBD	CAD	H13	112.5°	90.0°
C5	C6	C1	121.0°	90.0°
C6	C5	H2	119.5°	90.0°
C5	C6	H3	119.5°	90.0°
C2	C1	C6	117.1°	90.0°
C2	C1	FE	122.8°	90.0°
C1	C2	H6	119.2°	90.0°
C6	C1	FE	120.1°	90.0°
C1	C6	H3	119.5°	90.0°
CAD	C3D	C2D	125.3°	90.0°
CAD	C3D	C4D	127.6°	90.0°
C3D	CAD	H12	112.5°	90.0°
C3D	CAD	H13	112.5°	90.0°
C2A	CAA	CBA	105.0°	90.0°
CAA	C2A	C3A	126.8°	90.0°
CAA	C2A	C1A	127.5°	90.0°
C2A	CAA	H7	110.6°	90.0°
C2A	CAA	H8	110.6°	90.0°
CAA	CBA	CGA	114.5°	90.0°
CBA	CAA	H7	110.6°	90.0°
CBA	CAA	H8	110.6°	90.0°
CAA	CBA	H34	108.2°	90.0°
CAA	CBA	H35	108.2°	90.0°
C1	FE	ND	83.8°	90.0°
C1	FE	NA	92.1°	90.0°
C1	FE	NC	86.5°	90.0°
C1	FE	NB	95.4°	90.0°
C3A	C2A	C1A	105.7°	90.0°
C2A	C3A	CMA	128.7°	90.0°
C2A	C3A	C4A	103.1°	90.0°
C2A	C1A	CHA	118.9°	90.0°
C2A	C1A	NA	109.7°	90.0°
C2D	C3D	C4D	106.9°	90.0°
C3D	C2D	CMD	129.1°	90.0°
C3D	C2D	C1D	103.5°	90.0°
C3D	C4D	CHA	122.1°	90.0°
C3D	C4D	ND	111.0°	90.0°
CMD	C2D	C1D	127.4°	90.0°
C2D	CMD	H14	109.5°	90.0°
C2D	CMD	H15	109.5°	90.0°
C2D	CMD	H16	109.5°	90.0°
CMA	C3A	C4A	128.2°	90.0°
C3A	CMA	H31	109.5°	90.0°
C3A	CMA	H32	109.5°	90.0°
C3A	CMA	H33	109.5°	90.0°
C4D	CHA	C1A	121.4°	90.0°
CHA	C4D	ND	126.8°	90.0°
C4D	CHA	H17	119.3°	90.0°
CHA	C1A	NA	131.4°	90.0°
C1A	CHA	H17	119.3°	90.0°
C2D	C1D	ND	110.6°	90.0°
C2D	C1D	CHD	123.8°	90.0°
C3A	C4A	NA	110.7°	90.0°
C3A	C4A	CHB	121.2°	90.0°
C4D	ND	C1D	108.0°	90.0°
C4D	ND	FE	126.6°	90.0°
C1A	NA	C4A	110.8°	90.0°
C1A	NA	FE	122.5°	90.0°
CBA	CGA	O2A	120.7°	90.0°
CBA	CGA	O1A	120.2°	90.0°
CGA	CBA	H34	108.2°	90.0°
CGA	CBA	H35	108.2°	90.0°
ND	C1D	CHD	125.6°	90.0°
C1D	ND	FE	125.4°	90.0°
C1D	CHD	C4C	122.6°	90.0°
C1D	CHD	H18	118.7°	90.0°
NA	C4A	CHB	128.1°	90.0°
C4A	NA	FE	126.6°	90.0°
C4A	CHB	C1B	121.0°	90.0°
C4A	CHB	H24	119.5°	90.0°
ND	FE	NA	90.7°	90.0°
ND	FE	NC	90.8°	90.0°
ND	FE	NB	178.9°	90.0°
NA	FE	NC	177.8°	90.0°
NA	FE	NB	88.6°	90.0°
CHD	C4C	NC	129.6°	90.0°
CHD	C4C	C3C	118.9°	90.0°
C4C	CHD	H18	118.7°	90.0°
CHB	C1B	NB	127.4°	90.0°
CHB	C1B	C2B	121.2°	90.0°
C1B	CHB	H24	119.5°	90.0°
NC	FE	NB	90.0°	90.0°
FE	NC	C4C	125.5°	90.0°
FE	NC	C1C	127.0°	90.0°
FE	NB	C1B	127.9°	90.0°
FE	NB	C4B	124.7°	90.0°
NC	C4C	C3C	111.4°	90.0°
C4C	NC	C1C	107.4°	90.0°
C4C	C3C	CAC	127.8°	90.0°
C4C	C3C	C2C	104.5°	90.0°
O2A	CGA	O1A	119.0°	90.0°
NB	C1B	C2B	111.4°	90.0°
C1B	NB	C4B	107.4°	90.0°
C1B	C2B	CMB	127.9°	90.0°
C1B	C2B	C3B	105.8°	90.0°
CGA	O1A	H36	109.5°	90.0°
NC	C1C	C2C	113.1°	90.0°
NC	C1C	CHC	129.4°	90.0°
NB	C4B	CHC	127.5°	90.0°
NB	C4B	C3B	110.7°	90.0°
C3C	CAC	CBC	121.6°	90.0°
CAC	C3C	C2C	127.5°	90.0°
C3C	CAC	H5	119.2°	90.0°
CBC	CAC	H5	119.2°	90.0°
CAC	CBC	H25	120.0°	90.0°
CAC	CBC	H26	120.0°	90.0°
C3C	C2C	C1C	103.5°	90.0°
C3C	C2C	CMC	129.3°	90.0°
CMB	C2B	C3B	126.3°	90.0°
C2B	CMB	H21	109.5°	90.0°
C2B	CMB	H22	109.5°	90.0°
C2B	CMB	H23	109.5°	90.0°
C2B	C3B	C4B	104.6°	90.0°
C2B	C3B	CAB	134.7°	90.0°
C2C	C1C	CHC	117.4°	90.0°
C1C	C2C	CMC	127.1°	90.0°
C1C	CHC	C4B	120.9°	90.0°
C1C	CHC	H30	119.6°	90.0°
CHC	C4B	C3B	121.6°	90.0°
C4B	CHC	H30	119.5°	90.0°
C4B	C3B	CAB	120.0°	90.0°
C2C	CMC	H27	109.5°	90.0°
C2C	CMC	H28	109.5°	90.0°
C2C	CMC	H29	109.4°	90.0°
C3B	CAB	CBB	120.3°	90.0°
C3B	CAB	H4	119.9°	90.0°
CBB	CAB	H4	119.9°	90.0°
CAB	CBB	H19	120.0°	90.0°
CAB	CBB	H20	120.0°	90.0°
H7	CAA	H8	109.5°	90.0°
H10	CBD	H11	109.5°	90.0°
H12	CAD	H13	109.5°	90.0°
H14	CMD	H15	109.5°	90.0°
H14	CMD	H16	109.5°	90.0°
H15	CMD	H16	109.5°	90.0°
H19	CBB	H20	120.0°	90.0°
H21	CMB	H22	109.4°	90.0°
H21	CMB	H23	109.5°	90.0°
H22	CMB	H23	109.5°	90.0°
H25	CBC	H26	120.0°	90.0°
H27	CMC	H28	109.5°	90.0°
H27	CMC	H29	109.4°	90.0°
H28	CMC	H29	109.5°	90.0°
H31	CMA	H32	109.4°	90.0°
H31	CMA	H33	109.5°	90.0°
H32	CMA	H33	109.5°	90.0°
H34	CBA	H35	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1D	CGD	O2D	CBD	177.6°	90.0°
O1D	CGD	CBD	CAD	90.4°	90.0°
O1D	CGD	O2D	H9	0.0°	90.0°
O1D	CGD	CBD	H10	148.8°	90.0°
O1D	CGD	CBD	H11	30.4°	90.0°
O2D	CGD	CBD	CAD	92.1°	90.0°
O2D	CGD	CBD	H10	28.7°	90.0°
O2D	CGD	CBD	H11	147.2°	90.0°
CGD	CBD	CAD	H10	120.7°	90.0°
CGD	CBD	CAD	H11	120.8°	90.0°
CGD	CBD	CAD	C3D	178.4°	90.0°
CBD	CGD	O2D	H9	177.6°	90.0°
CGD	CBD	H10	H11	117.6°	90.0°
CGD	CBD	CAD	H12	63.7°	90.0°
CGD	CBD	CAD	H13	60.5°	90.0°
C3	C4	C5	H1	180.0°	90.0°
C4	C3	C2	H37	180.0°	90.0°
C3	C4	C5	C6	1.0°	90.0°
C4	C3	C2	C1	0.5°	90.0°
C3	C4	C5	H2	179.0°	90.0°
C4	C3	C2	H6	179.5°	90.0°
C5	C4	C3	C2	0.7°	90.0°
C4	C5	C6	H2	180.0°	90.0°
C4	C5	C6	C1	1.1°	90.0°
C4	C5	C6	H3	178.9°	90.0°
C5	C4	C3	H37	179.3°	90.0°
C3	C2	C1	H6	180.0°	90.0°
C3	C2	C1	C6	0.6°	90.0°
C3	C2	C1	FE	179.7°	90.0°
C2	C3	C4	H1	179.3°	90.0°
CBD	CAD	C3D	H12	117.9°	90.0°
CBD	CAD	C3D	H13	117.9°	90.0°
CBD	CAD	C3D	C2D	84.5°	90.0°
CBD	CAD	C3D	C4D	89.4°	90.0°
CAD	CBD	H10	H11	117.6°	90.0°
CBD	CAD	H12	H13	125.9°	90.0°
C5	C6	C1	C2	0.9°	90.0°
C5	C6	C1	H3	180.0°	90.0°
C5	C6	C1	FE	179.4°	90.0°
C6	C5	C4	H1	179.0°	90.0°
C2	C1	C6	FE	179.7°	90.0°
C2	C1	FE	ND	55.2°	90.0°
C2	C1	FE	NA	35.2°	90.0°
C2	C1	FE	NC	146.4°	90.0°
C2	C1	FE	NB	124.0°	90.0°
C2	C1	C6	H3	179.1°	90.0°
C1	C2	C3	H37	179.5°	90.0°
C6	C1	FE	ND	124.4°	90.0°
C6	C1	FE	NA	145.1°	90.0°
C6	C1	FE	NC	33.3°	90.0°
C6	C1	FE	NB	56.4°	90.0°
C1	C6	C5	H2	178.9°	90.0°
C6	C1	C2	H6	179.4°	90.0°
CAD	C3D	C2D	C4D	174.9°	90.0°
CAD	C3D	C2D	CMD	4.8°	90.0°
CAD	C3D	C4D	CHA	3.4°	90.0°
CAD	C3D	C2D	C1D	175.7°	90.0°
CAD	C3D	C4D	ND	176.0°	90.0°
C3D	CAD	CBD	H10	57.6°	90.0°
C3D	CAD	CBD	H11	60.9°	90.0°
C3D	CAD	H12	H13	125.9°	90.0°
C2A	CAA	CBA	H7	119.3°	90.0°
C2A	CAA	CBA	H8	119.3°	90.0°
CAA	C2A	C3A	C1A	176.9°	90.0°
CAA	C2A	C3A	CMA	2.8°	90.0°
CAA	C2A	C1A	CHA	3.2°	90.0°
CAA	C2A	C3A	C4A	178.6°	90.0°
CAA	C2A	C1A	NA	177.9°	90.0°
C2A	CAA	CBA	CGA	69.6°	90.0°
C2A	CAA	H7	H8	122.1°	90.0°
C2A	CAA	CBA	H34	51.1°	90.0°
C2A	CAA	CBA	H35	169.7°	90.0°
CBA	CAA	C2A	C3A	68.8°	90.0°
CBA	CAA	C2A	C1A	107.5°	90.0°
CAA	CBA	CGA	H34	120.8°	90.0°
CAA	CBA	CGA	H35	120.7°	90.0°
CAA	CBA	CGA	O2A	50.2°	90.0°
CAA	CBA	CGA	O1A	131.0°	90.0°
CBA	CAA	H7	H8	122.1°	90.0°
CAA	CBA	H34	H35	117.7°	90.0°
C1	FE	ND	C4D	97.5°	90.0°
C1	FE	NA	C1A	89.0°	90.0°
C1	FE	ND	C1D	82.0°	90.0°
C1	FE	NA	C4A	90.3°	90.0°
C1	FE	ND	NA	92.0°	90.0°
C1	FE	ND	NC	86.4°	90.0°
C1	FE	ND	NB	44.4°	90.0°
C1	FE	NA	NC	47.7°	90.0°
C1	FE	NA	NB	95.3°	90.0°
C1	FE	NC	NB	95.4°	90.0°
C1	FE	NC	C4C	76.1°	90.0°
C1	FE	NB	C1B	87.6°	90.0°
C1	FE	NC	C1C	98.5°	90.0°
C1	FE	NB	C4B	93.6°	90.0°
FE	C1	C6	H3	0.6°	90.0°
FE	C1	C2	H6	0.2°	90.0°
C2A	C3A	CMA	C4A	178.2°	90.0°
C3A	C2A	C1A	CHA	179.9°	90.0°
C3A	C2A	C1A	NA	1.0°	90.0°
C2A	C3A	C4A	NA	1.9°	90.0°
C2A	C3A	C4A	CHB	179.6°	90.0°
C3A	C2A	CAA	H7	50.5°	90.0°
C3A	C2A	CAA	H8	172.0°	90.0°
C2A	C3A	CMA	H31	180.0°	90.0°
C2A	C3A	CMA	H32	60.0°	90.0°
C2A	C3A	CMA	H33	60.0°	90.0°
C1A	C2A	C3A	CMA	179.8°	90.0°
C2A	C1A	CHA	C4D	172.9°	90.0°
C2A	C1A	CHA	NA	178.6°	90.0°
C1A	C2A	C3A	C4A	1.7°	90.0°
C2A	C1A	NA	C4A	0.2°	90.0°
C2A	C1A	NA	FE	179.5°	90.0°
C1A	C2A	CAA	H7	133.2°	90.0°
C1A	C2A	CAA	H8	11.8°	90.0°
C2A	C1A	CHA	H17	7.1°	90.0°
C3D	C2D	CMD	C1D	179.3°	90.0°
C2D	C3D	C4D	CHA	178.2°	90.0°
C2D	C3D	C4D	ND	1.2°	90.0°
C3D	C2D	C1D	ND	0.2°	90.0°
C3D	C2D	C1D	CHD	178.8°	90.0°
C2D	C3D	CAD	H12	157.6°	90.0°
C2D	C3D	CAD	H13	33.3°	90.0°
C3D	C2D	CMD	H14	180.0°	90.0°
C3D	C2D	CMD	H15	60.0°	90.0°
C3D	C2D	CMD	H16	60.0°	90.0°
C4D	C3D	C2D	CMD	179.8°	90.0°
C3D	C4D	CHA	ND	179.3°	90.0°
C3D	C4D	CHA	C1A	173.8°	90.0°
C4D	C3D	C2D	C1D	0.8°	90.0°
C3D	C4D	ND	C1D	1.0°	90.0°
C3D	C4D	ND	FE	179.4°	90.0°
C4D	C3D	CAD	H12	28.5°	90.0°
C4D	C3D	CAD	H13	152.8°	90.0°
C3D	C4D	CHA	H17	6.1°	90.0°
CMD	C2D	C1D	ND	179.7°	90.0°
CMD	C2D	C1D	CHD	1.7°	90.0°
C2D	CMD	H14	H15	120.0°	90.0°
C2D	CMD	H14	H16	120.0°	90.0°
C2D	CMD	H15	H16	120.0°	90.0°
CMA	C3A	C4A	NA	179.5°	90.0°
CMA	C3A	C4A	CHB	1.8°	90.0°
C3A	CMA	H31	H32	120.0°	90.0°
C3A	CMA	H31	H33	120.0°	90.0°
C3A	CMA	H32	H33	120.0°	90.0°
C4D	CHA	C1A	H17	180.0°	90.0°
C4D	CHA	C1A	NA	5.7°	90.0°
CHA	C4D	ND	C1D	178.3°	90.0°
CHA	C4D	ND	FE	1.2°	90.0°
C1A	CHA	C4D	ND	5.4°	90.0°
CHA	C1A	NA	C4A	178.5°	90.0°
CHA	C1A	NA	FE	0.8°	90.0°
C2D	C1D	ND	C4D	0.5°	90.0°
C2D	C1D	ND	CHD	178.6°	90.0°
C2D	C1D	ND	FE	180.0°	90.0°
C2D	C1D	CHD	C4C	174.9°	90.0°
C1D	C2D	CMD	H14	0.7°	90.0°
C1D	C2D	CMD	H15	119.3°	90.0°
C1D	C2D	CMD	H16	120.7°	90.0°
C2D	C1D	CHD	H18	5.1°	90.0°
C3A	C4A	NA	C1A	1.3°	90.0°
C3A	C4A	NA	CHB	177.5°	90.0°
C3A	C4A	NA	FE	179.4°	90.0°
C3A	C4A	CHB	C1B	172.9°	90.0°
C3A	C4A	CHB	H24	7.1°	90.0°
C4A	C3A	CMA	H31	1.7°	90.0°
C4A	C3A	CMA	H32	118.3°	90.0°
C4A	C3A	CMA	H33	121.8°	90.0°
C4D	ND	C1D	FE	179.5°	90.0°
C4D	ND	C1D	CHD	178.1°	90.0°
C4D	ND	FE	NA	5.5°	90.0°
C4D	ND	FE	NC	176.1°	90.0°
C4D	ND	FE	NB	53.1°	90.0°
ND	C4D	CHA	H17	174.6°	90.0°
C1A	NA	C4A	FE	179.3°	90.0°
C1A	NA	C4A	CHB	178.9°	90.0°
C1A	NA	FE	ND	5.1°	90.0°
C1A	NA	FE	NC	136.6°	90.0°
C1A	NA	FE	NB	175.7°	90.0°
NA	C1A	CHA	H17	174.3°	90.0°
CBA	CGA	O2A	O1A	178.7°	90.0°
CGA	CBA	CAA	H7	171.1°	90.0°
CGA	CBA	CAA	H8	49.7°	90.0°
CGA	CBA	H34	H35	117.7°	90.0°
CBA	CGA	O1A	H36	178.7°	90.0°
C1D	ND	FE	NA	174.0°	90.0°
ND	C1D	CHD	C4C	6.7°	90.0°
C1D	ND	FE	NC	4.4°	90.0°
C1D	ND	FE	NB	126.4°	90.0°
ND	C1D	CHD	H18	173.3°	90.0°
CHD	C1D	ND	FE	1.5°	90.0°
C1D	CHD	C4C	H18	180.0°	90.0°
C1D	CHD	C4C	NC	3.0°	90.0°
C1D	CHD	C4C	C3C	173.3°	90.0°
C4A	NA	FE	ND	174.1°	90.0°
NA	C4A	CHB	C1B	4.4°	90.0°
C4A	NA	FE	NC	42.6°	90.0°
C4A	NA	FE	NB	5.1°	90.0°
NA	C4A	CHB	H24	175.6°	90.0°
CHB	C4A	NA	FE	1.8°	90.0°
C4A	CHB	C1B	H24	180.0°	90.0°
C4A	CHB	C1B	NB	5.3°	90.0°
C4A	CHB	C1B	C2B	172.8°	90.0°
ND	FE	NA	NC	131.5°	90.0°
ND	FE	NA	NB	179.2°	90.0°
ND	FE	NC	NB	179.1°	90.0°
ND	FE	NC	C4C	7.7°	90.0°
ND	FE	NB	C1B	43.3°	90.0°
ND	FE	NC	C1C	177.8°	90.0°
ND	FE	NB	C4B	138.0°	90.0°
NA	FE	NC	NB	47.6°	90.0°
NA	FE	NC	C4C	123.8°	90.0°
NA	FE	NB	C1B	4.3°	90.0°
NA	FE	NC	C1C	50.8°	90.0°
NA	FE	NB	C4B	174.4°	90.0°
CHD	C4C	NC	FE	5.4°	90.0°
CHD	C4C	NC	C3C	176.5°	90.0°
CHD	C4C	NC	C1C	179.1°	90.0°
CHD	C4C	C3C	CAC	4.5°	90.0°
CHD	C4C	C3C	C2C	179.7°	90.0°
CHB	C1B	NB	FE	0.2°	90.0°
CHB	C1B	NB	C2B	178.2°	90.0°
CHB	C1B	NB	C4B	178.7°	90.0°
CHB	C1B	C2B	CMB	2.1°	90.0°
CHB	C1B	C2B	C3B	177.7°	90.0°
FE	NC	C4C	C1C	175.5°	90.0°
FE	NC	C4C	C3C	178.1°	90.0°
NC	FE	NB	C1B	174.0°	90.0°
NC	FE	NB	C4B	7.2°	90.0°
FE	NC	C1C	C2C	176.8°	90.0°
FE	NC	C1C	CHC	1.8°	90.0°
NB	FE	NC	C4C	171.5°	90.0°
FE	NB	C1B	C4B	178.9°	90.0°
FE	NB	C1B	C2B	178.4°	90.0°
NB	FE	NC	C1C	3.1°	90.0°
FE	NB	C4B	CHC	7.6°	90.0°
FE	NB	C4B	C3B	177.4°	90.0°
NC	C4C	C3C	CAC	178.6°	90.0°
NC	C4C	C3C	C2C	2.7°	90.0°
C4C	NC	C1C	C2C	1.4°	90.0°
C4C	NC	C1C	CHC	177.2°	90.0°
NC	C4C	CHD	H18	177.0°	90.0°
C3C	C4C	NC	C1C	2.6°	90.0°
C4C	C3C	CAC	C2C	174.9°	90.0°
C4C	C3C	CAC	CBC	163.2°	90.0°
C4C	C3C	C2C	C1C	1.7°	90.0°
C4C	C3C	C2C	CMC	179.9°	90.0°
C4C	C3C	CAC	H5	16.8°	90.0°
C3C	C4C	CHD	H18	6.7°	90.0°
O2A	CGA	CBA	H34	171.0°	90.0°
O2A	CGA	CBA	H35	70.5°	90.0°
O2A	CGA	O1A	H36	0.0°	90.0°
NB	C1B	C2B	CMB	179.6°	90.0°
NB	C1B	C2B	C3B	0.6°	90.0°
C1B	NB	C4B	CHC	173.5°	90.0°
C1B	NB	C4B	C3B	1.6°	90.0°
NB	C1B	CHB	H24	174.8°	90.0°
C2B	C1B	NB	C4B	0.6°	90.0°
C1B	C2B	CMB	C3B	179.7°	90.0°
C1B	C2B	C3B	C4B	1.5°	90.0°
C1B	C2B	C3B	CAB	171.7°	90.0°
C1B	C2B	CMB	H21	89.9°	90.0°
C1B	C2B	CMB	H22	150.2°	90.0°
C1B	C2B	CMB	H23	30.2°	90.0°
C2B	C1B	CHB	H24	7.2°	90.0°
O1A	CGA	CBA	H34	10.3°	90.0°
O1A	CGA	CBA	H35	108.2°	90.0°
NC	C1C	C2C	C3C	0.3°	90.0°
NC	C1C	C2C	CHC	178.8°	90.0°
NC	C1C	CHC	C4B	4.1°	90.0°
NC	C1C	C2C	CMC	178.5°	90.0°
NC	C1C	CHC	H30	175.9°	90.0°
NB	C4B	C3B	C2B	1.9°	90.0°
NB	C4B	CHC	C1C	1.1°	90.0°
NB	C4B	CHC	C3B	174.6°	90.0°
NB	C4B	C3B	CAB	173.9°	90.0°
NB	C4B	CHC	H30	178.9°	90.0°
C3C	CAC	CBC	H5	180.0°	90.0°
CAC	C3C	C2C	C1C	177.5°	90.0°
CAC	C3C	C2C	CMC	4.2°	90.0°
C3C	CAC	CBC	H25	180.0°	90.0°
C3C	CAC	CBC	H26	0.0°	90.0°
CBC	CAC	C3C	C2C	11.7°	90.0°
CAC	CBC	H25	H26	180.0°	90.0°
C3C	C2C	C1C	CMC	178.3°	90.0°
C3C	C2C	C1C	CHC	179.1°	90.0°
C2C	C3C	CAC	H5	168.3°	90.0°
C3C	C2C	CMC	H27	180.0°	90.0°
C3C	C2C	CMC	H28	60.0°	90.0°
C3C	C2C	CMC	H29	60.0°	90.0°
CMB	C2B	C3B	C4B	178.7°	90.0°
CMB	C2B	C3B	CAB	8.6°	90.0°
C2B	CMB	H21	H22	120.0°	90.0°
C2B	CMB	H21	H23	120.0°	90.0°
C2B	CMB	H22	H23	120.0°	90.0°
C2B	C3B	C4B	CHC	173.5°	90.0°
C2B	C3B	C4B	CAB	171.9°	90.0°
C2B	C3B	CAB	CBB	30.6°	90.0°
C2B	C3B	CAB	H4	149.4°	90.0°
C3B	C2B	CMB	H21	89.9°	90.0°
C3B	C2B	CMB	H22	30.1°	90.0°
C3B	C2B	CMB	H23	150.1°	90.0°
C2C	C1C	CHC	C4B	174.5°	90.0°
C1C	C2C	CMC	H27	2.2°	90.0°
C1C	C2C	CMC	H28	117.8°	90.0°
C1C	C2C	CMC	H29	122.2°	90.0°
C2C	C1C	CHC	H30	5.5°	90.0°
C1C	CHC	C4B	H30	180.0°	90.0°
C1C	CHC	C4B	C3B	175.7°	90.0°
CHC	C1C	C2C	CMC	2.6°	90.0°
CHC	C4B	C3B	CAB	1.5°	90.0°
C4B	C3B	CAB	CBB	138.4°	90.0°
C4B	C3B	CAB	H4	41.6°	90.0°
C3B	C4B	CHC	H30	4.4°	90.0°
C2C	CMC	H27	H28	120.0°	90.0°
C2C	CMC	H27	H29	120.0°	90.0°
C2C	CMC	H28	H29	120.0°	90.0°
C3B	CAB	CBB	H4	180.0°	90.0°
C3B	CAB	CBB	H19	180.0°	90.0°
C3B	CAB	CBB	H20	0.0°	90.0°
CAB	CBB	H19	H20	180.0°	90.0°
H1	C4	C5	H2	1.0°	90.0°
H1	C4	C3	H37	0.7°	90.0°
H2	C5	C6	H3	1.1°	90.0°
H4	CAB	CBB	H19	0.0°	90.0°
H4	CAB	CBB	H20	180.0°	90.0°
H5	CAC	CBC	H25	0.0°	90.0°
H5	CAC	CBC	H26	180.0°	90.0°
H6	C2	C3	H37	0.5°	90.0°
H7	CAA	CBA	H34	68.1°	90.0°
H7	CAA	CBA	H35	50.4°	90.0°
H8	CAA	CBA	H34	170.4°	90.0°
H8	CAA	CBA	H35	71.1°	90.0°
H10	CBD	CAD	H12	175.5°	90.0°
H10	CBD	CAD	H13	60.3°	90.0°
H11	CBD	CAD	H12	57.0°	90.0°
H11	CBD	CAD	H13	178.8°	90.0°
H14	CMD	H15	H16	120.0°	90.0°
H21	CMB	H22	H23	120.0°	90.0°
H27	CMC	H28	H29	120.0°	90.0°
H31	CMA	H32	H33	120.0°	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:	5IKS