NTE

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N	FE	sing	0.00Å	2.08Å
N	C1C	sing	0.00Å	1.34Å	Aromatic
N	C4C	sing	0.00Å	1.33Å	Aromatic
FE	NA	sing	0.00Å	2.08Å
FE	NB	sing	0.00Å	2.08Å
FE	ND	sing	0.00Å	2.08Å
O1	NC	sing	0.00Å	1.22Å
O2	NC	doub	0.00Å	1.22Å
NA	C1A	sing	0.00Å	1.33Å	Aromatic
NA	C4A	sing	0.00Å	1.33Å	Aromatic
NB	C1B	sing	0.00Å	1.33Å
NB	C4B	doub	0.00Å	1.33Å
NC	CBB	sing	0.00Å	1.27Å
ND	C1D	doub	0.00Å	1.33Å
ND	C4D	sing	0.00Å	1.34Å
C1A	C2A	doub	0.00Å	1.48Å	Aromatic
C1A	CHA	sing	0.00Å	1.47Å
O1A	CGA	sing	0.00Å	1.26Å
C1B	C2B	sing	0.00Å	1.49Å
C1B	CHB	doub	0.00Å	1.46Å
C1C	C2C	sing	0.00Å	1.48Å	Aromatic
C1C	CHC	doub	0.00Å	1.47Å
C1D	C2D	sing	0.00Å	1.48Å
C1D	CHD	sing	0.00Å	1.46Å
O1D	CGD	doub	0.00Å	1.24Å
C2A	C3A	sing	0.00Å	1.39Å	Aromatic
C2A	CAA	sing	0.00Å	1.51Å
O2A	CGA	doub	0.00Å	1.26Å
C2B	C3B	doub	0.00Å	1.38Å
C2B	CMB	sing	0.00Å	1.51Å
C2C	C3C	doub	0.00Å	1.38Å	Aromatic
C2C	CMC	sing	0.00Å	1.51Å
C2D	C3D	doub	0.00Å	1.38Å
C2D	CMD	sing	0.00Å	1.50Å
O2D	CGD	sing	0.00Å	1.25Å
C3A	C4A	doub	0.00Å	1.48Å	Aromatic
C3A	CMA	sing	0.00Å	1.51Å
C3B	C4B	sing	0.00Å	1.48Å
C3B	CAB	sing	0.00Å	1.49Å
C3C	C4C	sing	0.00Å	1.47Å	Aromatic
C3C	CAC	sing	0.00Å	1.49Å
C3D	C4D	sing	0.00Å	1.49Å
C3D	CAD	sing	0.00Å	1.51Å
C4A	CHB	sing	0.00Å	1.46Å
C4B	CHC	sing	0.00Å	1.46Å
C4C	CHD	doub	0.00Å	1.47Å
C4D	CHA	doub	0.00Å	1.47Å
CAA	CBA	sing	0.00Å	1.53Å
CAB	CBB	doub	0.00Å	1.33Å
CAC	CBC	doub	0.00Å	1.33Å
CAD	CBD	sing	0.00Å	1.53Å
CBA	CGA	sing	0.00Å	1.51Å
CBD	CGD	sing	0.00Å	1.51Å
O1A	H1	sing	0.00Å	0.95Å
O2D	H2	sing	0.00Å	0.95Å
CAA	HAA	sing	0.00Å	1.10Å
CAA	HAAA	sing	0.00Å	1.10Å
CAB	HAB	sing	0.00Å	1.08Å
CAC	HAC	sing	0.00Å	1.08Å
CAD	HAD	sing	0.00Å	1.10Å
CAD	HADA	sing	0.00Å	1.10Å
CBA	HBA	sing	0.00Å	1.10Å
CBA	HBAA	sing	0.00Å	1.10Å
CBB	HBB	sing	0.00Å	1.08Å
CBC	HBC	sing	0.00Å	1.08Å
CBC	HBCA	sing	0.00Å	1.08Å
CBD	HBD	sing	0.00Å	1.10Å
CBD	HBDA	sing	0.00Å	1.10Å
CHA	HHA	sing	0.00Å	1.08Å
CHB	HHB	sing	0.00Å	1.08Å
CHC	HHC	sing	0.00Å	1.08Å
CHD	HHD	sing	0.00Å	1.08Å
CMA	HMA	sing	0.00Å	1.10Å
CMA	HMAA	sing	0.00Å	1.10Å
CMA	HMAB	sing	0.00Å	1.10Å
CMB	HMB	sing	0.00Å	1.10Å
CMB	HMBA	sing	0.00Å	1.10Å
CMB	HMBB	sing	0.00Å	1.10Å
CMC	HMC	sing	0.00Å	1.10Å
CMC	HMCA	sing	0.00Å	1.10Å
CMC	HMCB	sing	0.00Å	1.10Å
CMD	HMD	sing	0.00Å	1.10Å
CMD	HMDA	sing	0.00Å	1.10Å
CMD	HMDB	sing	0.00Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
FE	N	C1C	125.8°	90.0°
FE	N	C4C	126.4°	90.0°
N	FE	NA	175.3°	90.0°
N	FE	NB	90.7°	90.0°
N	FE	ND	89.4°	90.0°
C1C	N	C4C	107.7°	90.0°
N	C1C	C2C	111.0°	90.0°
N	C1C	CHC	128.6°	90.0°
N	C4C	C3C	110.7°	90.0°
N	C4C	CHD	129.9°	90.0°
NA	FE	NB	89.7°	90.0°
NA	FE	ND	89.9°	90.0°
FE	NA	C1A	126.5°	90.0°
FE	NA	C4A	125.2°	90.0°
NB	FE	ND	176.3°	90.0°
FE	NB	C1B	127.3°	90.0°
FE	NB	C4B	125.1°	90.0°
FE	ND	C1D	126.1°	90.0°
FE	ND	C4D	125.9°	90.0°
O1	NC	O2	119.7°	90.0°
O1	NC	CBB	121.2°	90.0°
O2	NC	CBB	119.0°	90.0°
C1A	NA	C4A	108.3°	90.0°
NA	C1A	C2A	110.7°	90.0°
NA	C1A	CHA	128.6°	90.0°
NA	C4A	C3A	110.9°	90.0°
NA	C4A	CHB	130.7°	90.0°
C1B	NB	C4B	107.5°	90.0°
NB	C1B	C2B	112.0°	90.0°
NB	C1B	CHB	127.9°	90.0°
NB	C4B	C3B	110.3°	90.0°
NB	C4B	CHC	129.7°	90.0°
NC	CBB	CAB	116.2°	90.0°
NC	CBB	HBB	121.9°	90.0°
C1D	ND	C4D	108.0°	90.0°
ND	C1D	C2D	110.8°	90.0°
ND	C1D	CHD	130.3°	90.0°
ND	C4D	C3D	110.6°	90.0°
ND	C4D	CHA	129.2°	90.0°
C2A	C1A	CHA	120.7°	90.0°
C1A	C2A	C3A	105.3°	90.0°
C1A	C2A	CAA	126.3°	90.0°
C1A	CHA	C4D	119.1°	90.0°
C1A	CHA	HHA	120.5°	90.0°
O1A	CGA	O2A	124.5°	90.0°
O1A	CGA	CBA	117.9°	90.0°
CGA	O1A	H1	109.5°	90.0°
C2B	C1B	CHB	120.1°	90.0°
C1B	C2B	C3B	103.5°	90.0°
C1B	C2B	CMB	127.7°	90.0°
C1B	CHB	C4A	119.2°	90.0°
C1B	CHB	HHB	120.4°	90.0°
C2C	C1C	CHC	120.4°	90.0°
C1C	C2C	C3C	104.6°	90.0°
C1C	C2C	CMC	128.4°	90.0°
C1C	CHC	C4B	119.5°	90.0°
C1C	CHC	HHC	120.2°	90.0°
C2D	C1D	CHD	118.9°	90.0°
C1D	C2D	C3D	105.3°	90.0°
C1D	C2D	CMD	126.6°	90.0°
C1D	CHD	C4C	117.8°	90.0°
C1D	CHD	HHD	121.1°	90.0°
O1D	CGD	O2D	122.1°	90.0°
O1D	CGD	CBD	118.0°	90.0°
C3A	C2A	CAA	128.5°	90.0°
C2A	C3A	C4A	104.8°	90.0°
C2A	C3A	CMA	130.8°	90.0°
C2A	CAA	CBA	107.1°	90.0°
C2A	CAA	HAA	110.1°	90.0°
C2A	CAA	HAAA	110.1°	90.0°
O2A	CGA	CBA	117.6°	90.0°
C3B	C2B	CMB	128.7°	90.0°
C2B	C3B	C4B	106.7°	90.0°
C2B	C3B	CAB	133.9°	90.0°
C2B	CMB	HMB	109.5°	90.0°
C2B	CMB	HMBA	109.4°	90.0°
C2B	CMB	HMBB	109.4°	90.0°
C3C	C2C	CMC	127.0°	90.0°
C2C	C3C	C4C	106.0°	90.0°
C2C	C3C	CAC	132.5°	90.0°
C2C	CMC	HMC	109.5°	90.0°
C2C	CMC	HMCA	109.4°	90.0°
C2C	CMC	HMCB	109.5°	90.0°
C3D	C2D	CMD	128.0°	90.0°
C2D	C3D	C4D	105.2°	90.0°
C2D	C3D	CAD	127.3°	90.0°
C2D	CMD	HMD	109.5°	90.0°
C2D	CMD	HMDA	109.5°	90.0°
C2D	CMD	HMDB	109.5°	90.0°
O2D	CGD	CBD	119.9°	90.0°
CGD	O2D	H2	109.5°	90.0°
C4A	C3A	CMA	124.3°	90.0°
C3A	C4A	CHB	118.4°	90.0°
C3A	CMA	HMA	109.5°	90.0°
C3A	CMA	HMAA	109.4°	90.0°
C3A	CMA	HMAB	109.5°	90.0°
C4B	C3B	CAB	119.4°	90.0°
C3B	C4B	CHC	120.0°	90.0°
C3B	CAB	CBB	122.9°	90.0°
C3B	CAB	HAB	118.6°	90.0°
C4C	C3C	CAC	121.6°	90.0°
C3C	C4C	CHD	119.4°	90.0°
C3C	CAC	CBC	119.7°	90.0°
C3C	CAC	HAC	120.1°	90.0°
C4D	C3D	CAD	127.4°	90.0°
C3D	C4D	CHA	120.2°	90.0°
C3D	CAD	CBD	103.9°	90.0°
C3D	CAD	HAD	110.9°	90.0°
C3D	CAD	HADA	110.8°	90.0°
C4A	CHB	HHB	120.4°	90.0°
C4B	CHC	HHC	120.3°	90.0°
C4C	CHD	HHD	121.1°	90.0°
C4D	CHA	HHA	120.4°	90.0°
CAA	CBA	CGA	109.3°	90.0°
CBA	CAA	HAA	110.0°	90.0°
CBA	CAA	HAAA	110.1°	90.0°
CAA	CBA	HBA	109.5°	90.0°
CAA	CBA	HBAA	109.5°	90.0°
CBB	CAB	HAB	118.5°	90.0°
CAB	CBB	HBB	121.9°	90.0°
CBC	CAC	HAC	120.2°	90.0°
CAC	CBC	HBC	120.0°	90.0°
CAC	CBC	HBCA	120.0°	90.0°
CAD	CBD	CGD	111.9°	90.0°
CBD	CAD	HAD	110.9°	90.0°
CBD	CAD	HADA	110.9°	90.0°
CAD	CBD	HBD	108.9°	90.0°
CAD	CBD	HBDA	108.8°	90.0°
CGA	CBA	HBA	109.5°	90.0°
CGA	CBA	HBAA	109.5°	90.0°
CGD	CBD	HBD	108.8°	90.0°
CGD	CBD	HBDA	108.9°	90.0°
HAA	CAA	HAAA	109.5°	90.0°
HAD	CAD	HADA	109.4°	90.0°
HBA	CBA	HBAA	109.4°	90.0°
HBC	CBC	HBCA	120.0°	90.0°
HBD	CBD	HBDA	109.5°	90.0°
HMA	CMA	HMAA	109.5°	90.0°
HMA	CMA	HMAB	109.5°	90.0°
HMAA	CMA	HMAB	109.5°	90.0°
HMB	CMB	HMBA	109.4°	90.0°
HMB	CMB	HMBB	109.5°	90.0°
HMBA	CMB	HMBB	109.5°	90.0°
HMC	CMC	HMCA	109.5°	90.0°
HMC	CMC	HMCB	109.5°	90.0°
HMCA	CMC	HMCB	109.5°	90.0°
HMD	CMD	HMDA	109.4°	90.0°
HMD	CMD	HMDB	109.5°	90.0°
HMDA	CMD	HMDB	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
FE	N	C1C	C4C	178.2°	90.0°
N	FE	NA	NB	94.7°	90.0°
N	FE	NA	ND	81.6°	90.0°
N	FE	NB	ND	91.4°	90.0°
N	FE	NA	C1A	87.1°	90.0°
N	FE	NA	C4A	92.7°	90.0°
N	FE	NB	C1B	173.5°	90.0°
N	FE	NB	C4B	4.5°	90.0°
N	FE	ND	C1D	2.0°	90.0°
N	FE	ND	C4D	179.1°	90.0°
FE	N	C1C	C2C	178.7°	90.0°
FE	N	C1C	CHC	1.1°	90.0°
FE	N	C4C	C3C	178.5°	90.0°
FE	N	C4C	CHD	1.3°	90.0°
C1C	N	FE	NA	99.0°	90.0°
C1C	N	FE	NB	4.4°	90.0°
C1C	N	FE	ND	179.3°	90.0°
N	C1C	C2C	CHC	179.8°	90.0°
N	C1C	C2C	C3C	0.5°	90.0°
N	C1C	C2C	CMC	179.1°	90.0°
C1C	N	C4C	C3C	0.4°	90.0°
N	C1C	CHC	C4B	8.2°	90.0°
C1C	N	C4C	CHD	179.4°	90.0°
N	C1C	CHC	HHC	171.8°	90.0°
C4C	N	FE	NA	78.8°	90.0°
C4C	N	FE	NB	173.4°	90.0°
C4C	N	FE	ND	2.8°	90.0°
C4C	N	C1C	C2C	0.6°	90.0°
C4C	N	C1C	CHC	179.3°	90.0°
N	C4C	CHD	C1D	2.1°	90.0°
N	C4C	C3C	C2C	0.1°	90.0°
N	C4C	C3C	CHD	179.8°	90.0°
N	C4C	C3C	CAC	179.8°	90.0°
N	C4C	CHD	HHD	177.9°	90.0°
NA	FE	NB	ND	83.8°	90.0°
FE	NA	C1A	C4A	179.8°	90.0°
NA	FE	NB	C1B	1.8°	90.0°
NA	FE	NB	C4B	179.8°	90.0°
NA	FE	ND	C1D	173.3°	90.0°
NA	FE	ND	C4D	5.5°	90.0°
FE	NA	C1A	C2A	179.2°	90.0°
FE	NA	C1A	CHA	0.5°	90.0°
FE	NA	C4A	C3A	179.5°	90.0°
FE	NA	C4A	CHB	0.9°	90.0°
NB	FE	NA	C1A	178.2°	90.0°
NB	FE	NA	C4A	2.0°	90.0°
FE	NB	C1B	C4B	178.3°	90.0°
NB	FE	ND	C1D	89.5°	90.0°
NB	FE	ND	C4D	89.4°	90.0°
FE	NB	C1B	C2B	178.3°	90.0°
FE	NB	C1B	CHB	0.4°	90.0°
FE	NB	C4B	C3B	178.7°	90.0°
FE	NB	C4B	CHC	0.8°	90.0°
ND	FE	NA	C1A	5.5°	90.0°
ND	FE	NA	C4A	174.3°	90.0°
ND	FE	NB	C1B	82.0°	90.0°
ND	FE	NB	C4B	96.0°	90.0°
FE	ND	C1D	C4D	179.0°	90.0°
FE	ND	C1D	C2D	178.6°	90.0°
FE	ND	C1D	CHD	0.5°	90.0°
FE	ND	C4D	C3D	179.1°	90.0°
FE	ND	C4D	CHA	0.3°	90.0°
O1	NC	O2	CBB	179.4°	90.0°
O1	NC	CBB	CAB	156.1°	90.0°
O1	NC	CBB	HBB	23.9°	90.0°
O2	NC	CBB	CAB	24.6°	90.0°
O2	NC	CBB	HBB	155.4°	90.0°
NA	C1A	C2A	CHA	179.7°	90.0°
NA	C1A	C2A	C3A	0.7°	90.0°
NA	C1A	C2A	CAA	179.5°	90.0°
C1A	NA	C4A	C3A	0.3°	90.0°
C1A	NA	C4A	CHB	179.3°	90.0°
NA	C1A	CHA	C4D	8.5°	90.0°
NA	C1A	CHA	HHA	171.4°	90.0°
C4A	NA	C1A	C2A	0.6°	90.0°
C4A	NA	C1A	CHA	179.7°	90.0°
NA	C4A	CHB	C1B	1.3°	90.0°
NA	C4A	C3A	C2A	0.2°	90.0°
NA	C4A	C3A	CHB	179.7°	90.0°
NA	C4A	C3A	CMA	179.3°	90.0°
NA	C4A	CHB	HHB	178.7°	90.0°
NB	C1B	C2B	CHB	178.8°	90.0°
NB	C1B	C2B	C3B	0.4°	90.0°
NB	C1B	C2B	CMB	178.4°	90.0°
C1B	NB	C4B	C3B	0.4°	90.0°
NB	C1B	CHB	C4A	1.6°	90.0°
C1B	NB	C4B	CHC	179.1°	90.0°
NB	C1B	CHB	HHB	178.5°	90.0°
C4B	NB	C1B	C2B	0.0°	90.0°
C4B	NB	C1B	CHB	178.7°	90.0°
NB	C4B	CHC	C1C	8.0°	90.0°
NB	C4B	C3B	C2B	0.6°	90.0°
NB	C4B	C3B	CHC	179.5°	90.0°
NB	C4B	C3B	CAB	179.6°	90.0°
NB	C4B	CHC	HHC	172.0°	90.0°
NC	CBB	CAB	C3B	179.0°	90.0°
NC	CBB	CAB	HBB	180.0°	90.0°
NC	CBB	CAB	HAB	1.0°	90.0°
ND	C1D	C2D	CHD	178.3°	90.0°
ND	C1D	C2D	C3D	0.8°	90.0°
ND	C1D	C2D	CMD	179.6°	90.0°
C1D	ND	C4D	C3D	0.1°	90.0°
ND	C1D	CHD	C4C	3.1°	90.0°
C1D	ND	C4D	CHA	179.3°	90.0°
ND	C1D	CHD	HHD	176.9°	90.0°
ND	C4D	CHA	C1A	8.4°	90.0°
C4D	ND	C1D	C2D	0.5°	90.0°
C4D	ND	C1D	CHD	178.5°	90.0°
ND	C4D	C3D	C2D	0.6°	90.0°
ND	C4D	C3D	CHA	179.4°	90.0°
ND	C4D	C3D	CAD	179.1°	90.0°
ND	C4D	CHA	HHA	171.6°	90.0°
C1A	C2A	C3A	CAA	178.7°	90.0°
C1A	C2A	C3A	C4A	0.5°	90.0°
C1A	C2A	C3A	CMA	179.6°	90.0°
C2A	C1A	CHA	C4D	171.1°	90.0°
C1A	C2A	CAA	CBA	123.2°	90.0°
C1A	C2A	CAA	HAA	117.2°	90.0°
C1A	C2A	CAA	HAAA	3.6°	90.0°
C2A	C1A	CHA	HHA	8.9°	90.0°
CHA	C1A	C2A	C3A	179.6°	90.0°
CHA	C1A	C2A	CAA	0.8°	90.0°
C1A	CHA	C4D	C3D	170.9°	90.0°
C1A	CHA	C4D	HHA	180.0°	90.0°
O1A	CGA	O2A	CBA	179.8°	90.0°
O1A	CGA	CBA	CAA	29.8°	90.0°
O1A	CGA	CBA	HBA	149.8°	90.0°
O1A	CGA	CBA	HBAA	90.2°	90.0°
C1B	C2B	C3B	CMB	178.0°	90.0°
C1B	C2B	C3B	C4B	0.6°	90.0°
C1B	C2B	C3B	CAB	179.4°	90.0°
C2B	C1B	CHB	C4A	179.9°	90.0°
C2B	C1B	CHB	HHB	0.1°	90.0°
C1B	C2B	CMB	HMB	180.0°	90.0°
C1B	C2B	CMB	HMBA	60.0°	90.0°
C1B	C2B	CMB	HMBB	60.0°	90.0°
CHB	C1B	C2B	C3B	179.2°	90.0°
CHB	C1B	C2B	CMB	2.8°	90.0°
C1B	CHB	C4A	C3A	178.3°	90.0°
C1B	CHB	C4A	HHB	180.0°	90.0°
C1C	C2C	C3C	CMC	179.6°	90.0°
C1C	C2C	C3C	C4C	0.3°	90.0°
C1C	C2C	C3C	CAC	179.9°	90.0°
C2C	C1C	CHC	C4B	171.6°	90.0°
C2C	C1C	CHC	HHC	8.4°	90.0°
C1C	C2C	CMC	HMC	180.0°	90.0°
C1C	C2C	CMC	HMCA	60.0°	90.0°
C1C	C2C	CMC	HMCB	60.0°	90.0°
CHC	C1C	C2C	C3C	179.3°	90.0°
CHC	C1C	C2C	CMC	1.1°	90.0°
C1C	CHC	C4B	C3B	171.4°	90.0°
C1C	CHC	C4B	HHC	180.0°	90.0°
C1D	C2D	C3D	CMD	178.7°	90.0°
C1D	C2D	C3D	C4D	0.8°	90.0°
C1D	C2D	C3D	CAD	179.3°	90.0°
C2D	C1D	CHD	C4C	179.0°	90.0°
C2D	C1D	CHD	HHD	1.0°	90.0°
C1D	C2D	CMD	HMD	180.0°	90.0°
C1D	C2D	CMD	HMDA	60.0°	90.0°
C1D	C2D	CMD	HMDB	60.0°	90.0°
CHD	C1D	C2D	C3D	179.1°	90.0°
CHD	C1D	C2D	CMD	2.1°	90.0°
C1D	CHD	C4C	C3C	178.1°	90.0°
C1D	CHD	C4C	HHD	180.0°	90.0°
O1D	CGD	O2D	CBD	179.0°	90.0°
O1D	CGD	CBD	CAD	119.3°	90.0°
O1D	CGD	O2D	H2	0.0°	90.0°
O1D	CGD	CBD	HBD	1.1°	90.0°
O1D	CGD	CBD	HBDA	120.4°	90.0°
C2A	C3A	C4A	CMA	179.1°	90.0°
C2A	C3A	C4A	CHB	179.8°	90.0°
C3A	C2A	CAA	CBA	55.2°	90.0°
C3A	C2A	CAA	HAA	64.3°	90.0°
C3A	C2A	CAA	HAAA	174.9°	90.0°
C2A	C3A	CMA	HMA	90.6°	90.0°
C2A	C3A	CMA	HMAA	149.4°	90.0°
C2A	C3A	CMA	HMAB	29.4°	90.0°
CAA	C2A	C3A	C4A	179.2°	90.0°
CAA	C2A	C3A	CMA	1.7°	90.0°
C2A	CAA	CBA	HAA	119.6°	90.0°
C2A	CAA	CBA	HAAA	119.6°	90.0°
C2A	CAA	CBA	CGA	157.9°	90.0°
C2A	CAA	HAA	HAAA	121.1°	90.0°
C2A	CAA	CBA	HBA	37.9°	90.0°
C2A	CAA	CBA	HBAA	82.1°	90.0°
O2A	CGA	CBA	CAA	150.1°	90.0°
O2A	CGA	O1A	H1	0.0°	90.0°
O2A	CGA	CBA	HBA	30.1°	90.0°
O2A	CGA	CBA	HBAA	90.0°	90.0°
C2B	C3B	C4B	CAB	179.0°	90.0°
C2B	C3B	C4B	CHC	178.9°	90.0°
C2B	C3B	CAB	CBB	4.3°	90.0°
C2B	C3B	CAB	HAB	175.7°	90.0°
C3B	C2B	CMB	HMB	2.5°	90.0°
C3B	C2B	CMB	HMBA	122.4°	90.0°
C3B	C2B	CMB	HMBB	117.5°	90.0°
CMB	C2B	C3B	C4B	178.6°	90.0°
CMB	C2B	C3B	CAB	2.6°	90.0°
C2B	CMB	HMB	HMBA	120.0°	90.0°
C2B	CMB	HMB	HMBB	120.0°	90.0°
C2B	CMB	HMBA	HMBB	120.0°	90.0°
C2C	C3C	C4C	CAC	179.8°	90.0°
C2C	C3C	C4C	CHD	179.8°	90.0°
C2C	C3C	CAC	CBC	44.7°	90.0°
C2C	C3C	CAC	HAC	135.3°	90.0°
C3C	C2C	CMC	HMC	0.5°	90.0°
C3C	C2C	CMC	HMCA	120.5°	90.0°
C3C	C2C	CMC	HMCB	119.5°	90.0°
CMC	C2C	C3C	C4C	179.3°	90.0°
CMC	C2C	C3C	CAC	0.4°	90.0°
C2C	CMC	HMC	HMCA	120.0°	90.0°
C2C	CMC	HMC	HMCB	120.0°	90.0°
C2C	CMC	HMCA	HMCB	120.0°	90.0°
C2D	C3D	C4D	CAD	178.5°	90.0°
C2D	C3D	C4D	CHA	178.8°	90.0°
C2D	C3D	CAD	CBD	82.8°	90.0°
C2D	C3D	CAD	HAD	36.3°	90.0°
C2D	C3D	CAD	HADA	158.1°	90.0°
C3D	C2D	CMD	HMD	1.6°	90.0°
C3D	C2D	CMD	HMDA	121.5°	90.0°
C3D	C2D	CMD	HMDB	118.5°	90.0°
CMD	C2D	C3D	C4D	179.5°	90.0°
CMD	C2D	C3D	CAD	2.0°	90.0°
C2D	CMD	HMD	HMDA	120.0°	90.0°
C2D	CMD	HMD	HMDB	120.0°	90.0°
C2D	CMD	HMDA	HMDB	120.0°	90.0°
O2D	CGD	CBD	CAD	61.6°	90.0°
O2D	CGD	CBD	HBD	178.0°	90.0°
O2D	CGD	CBD	HBDA	58.7°	90.0°
C3A	C4A	CHB	HHB	1.7°	90.0°
C4A	C3A	CMA	HMA	90.5°	90.0°
C4A	C3A	CMA	HMAA	29.5°	90.0°
C4A	C3A	CMA	HMAB	149.5°	90.0°
CMA	C3A	C4A	CHB	1.1°	90.0°
C3A	CMA	HMA	HMAA	120.0°	90.0°
C3A	CMA	HMA	HMAB	120.0°	90.0°
C3A	CMA	HMAA	HMAB	120.0°	90.0°
C4B	C3B	CAB	CBB	174.4°	90.0°
C4B	C3B	CAB	HAB	5.6°	90.0°
C3B	C4B	CHC	HHC	8.6°	90.0°
CAB	C3B	C4B	CHC	0.1°	90.0°
C3B	CAB	CBB	HAB	180.0°	90.0°
C3B	CAB	CBB	HBB	1.0°	90.0°
C4C	C3C	CAC	CBC	135.5°	90.0°
C4C	C3C	CAC	HAC	44.5°	90.0°
C3C	C4C	CHD	HHD	1.9°	90.0°
CAC	C3C	C4C	CHD	0.4°	90.0°
C3C	CAC	CBC	HAC	180.0°	90.0°
C3C	CAC	CBC	HBC	180.0°	90.0°
C3C	CAC	CBC	HBCA	0.0°	90.0°
C4D	C3D	CAD	CBD	95.4°	90.0°
C4D	C3D	CAD	HAD	145.5°	90.0°
C4D	C3D	CAD	HADA	23.7°	90.0°
C3D	C4D	CHA	HHA	9.1°	90.0°
CAD	C3D	C4D	CHA	0.3°	90.0°
C3D	CAD	CBD	HAD	119.1°	90.0°
C3D	CAD	CBD	HADA	119.1°	90.0°
C3D	CAD	CBD	CGD	175.5°	90.0°
C3D	CAD	HAD	HADA	122.6°	90.0°
C3D	CAD	CBD	HBD	64.2°	90.0°
C3D	CAD	CBD	HBDA	55.1°	90.0°
CAA	CBA	CGA	HBA	120.0°	90.0°
CAA	CBA	CGA	HBAA	120.0°	90.0°
CBA	CAA	HAA	HAAA	121.1°	90.0°
CAA	CBA	HBA	HBAA	120.1°	90.0°
CAC	CBC	HBC	HBCA	180.0°	90.0°
CAD	CBD	CGD	HBD	120.4°	90.0°
CAD	CBD	CGD	HBDA	120.3°	90.0°
CBD	CAD	HAD	HADA	122.6°	90.0°
CAD	CBD	HBD	HBDA	118.9°	90.0°
CBA	CGA	O1A	H1	179.8°	90.0°
CGA	CBA	CAA	HAA	82.5°	90.0°
CGA	CBA	CAA	HAAA	38.3°	90.0°
CGA	CBA	HBA	HBAA	120.1°	90.0°
CBD	CGD	O2D	H2	179.0°	90.0°
CGD	CBD	CAD	HAD	56.3°	90.0°
CGD	CBD	CAD	HADA	65.4°	90.0°
CGD	CBD	HBD	HBDA	118.9°	90.0°
HAA	CAA	CBA	HBA	157.5°	90.0°
HAA	CAA	CBA	HBAA	37.5°	90.0°
HAAA	CAA	CBA	HBA	81.7°	90.0°
HAAA	CAA	CBA	HBAA	158.2°	90.0°
HAB	CAB	CBB	HBB	179.0°	90.0°
HAC	CAC	CBC	HBC	0.0°	90.0°
HAC	CAC	CBC	HBCA	180.0°	90.0°
HAD	CAD	CBD	HBD	176.7°	90.0°
HAD	CAD	CBD	HBDA	64.0°	90.0°
HADA	CAD	CBD	HBD	54.9°	90.0°
HADA	CAD	CBD	HBDA	174.2°	90.0°
HMA	CMA	HMAA	HMAB	120.0°	90.0°
HMB	CMB	HMBA	HMBB	120.0°	90.0°
HMC	CMC	HMCA	HMCB	120.0°	90.0°
HMD	CMD	HMDA	HMDB	120.0°	90.0°

Definition date:	2011-03-02
Last modified:	2020-06-17
Release status:	REL
Processing site:	RCSB
Derived from:	3OO4