DDH

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
FE	NA	sing	0.00Å	1.84Å
FE	NB	sing	0.00Å	2.04Å
FE	NC	sing	0.00Å	1.96Å
FE	ND	sing	0.00Å	2.06Å
NA	C1A	sing	0.00Å	1.41Å
NA	C4A	sing	0.00Å	1.40Å
NB	C1B	doub	0.00Å	1.36Å
NB	C4B	sing	0.00Å	1.39Å
NC	C1C	sing	0.00Å	1.40Å	Aromatic
NC	C4C	sing	0.00Å	1.39Å	Aromatic
ND	C4D	doub	0.00Å	1.37Å
ND	C1D	sing	0.00Å	1.38Å
C1A	CHA	doub	0.00Å	1.38Å
C1A	C2A	sing	0.00Å	1.44Å
CHA	C4D	sing	0.00Å	1.38Å
CHA	HHA	sing	0.00Å	1.08Å
C4D	C3D	sing	0.00Å	1.46Å
C1B	CHB	sing	0.00Å	1.38Å
C1B	C2B	sing	0.00Å	1.45Å
CHB	C4A	doub	0.00Å	1.38Å
CHB	HHB	sing	0.00Å	1.08Å
C4A	C3A	sing	0.00Å	1.43Å
C1C	CHC	sing	0.00Å	1.37Å
C1C	C2C	doub	0.00Å	1.45Å	Aromatic
CHC	C4B	doub	0.00Å	1.37Å
CHC	HHC	sing	0.00Å	1.08Å
C4B	C3B	sing	0.00Å	1.46Å
C1D	CHD	doub	0.00Å	1.38Å
C1D	C2D	sing	0.00Å	1.47Å
CHD	C4C	sing	0.00Å	1.39Å
CHD	HHD	sing	0.00Å	1.08Å
C4C	C3C	doub	0.00Å	1.46Å	Aromatic
C2A	CAA	sing	0.00Å	1.54Å
C2A	C3A	doub	0.00Å	1.34Å
CAA	CBA	sing	0.00Å	1.54Å
CAA	HAA1	sing	0.00Å	1.10Å
CAA	HAA2	sing	0.00Å	1.10Å
C3A	CMA	sing	0.00Å	1.54Å
CMA	HMA1	sing	0.00Å	1.10Å
CMA	HMA2	sing	0.00Å	1.10Å
CMA	HMA3	sing	0.00Å	1.10Å
CBA	CGA	sing	0.00Å	1.52Å
CBA	HBA1	sing	0.00Å	1.10Å
CBA	HBA2	sing	0.00Å	1.10Å
CGA	O1A	doub	0.00Å	1.25Å
CGA	O2A	sing	0.00Å	1.25Å
O2A	HO2A	sing	0.00Å	0.95Å
C2B	CMB	sing	0.00Å	1.53Å
C2B	C3B	doub	0.00Å	1.33Å
CMB	HMB1	sing	0.00Å	1.10Å
CMB	HMB2	sing	0.00Å	1.10Å
CMB	HMB3	sing	0.00Å	1.10Å
C3B	CAB	sing	0.00Å	1.53Å
CAB	OCB	sing	0.00Å	1.23Å
CAB	CBB	doub	0.00Å	1.35Å
OCB	HOCB	sing	0.00Å	0.95Å
CBB	HBB1	sing	0.00Å	1.08Å
CBB	HBB2	sing	0.00Å	1.08Å
C2C	CMC	sing	0.00Å	1.55Å
C2C	C3C	sing	0.00Å	1.32Å	Aromatic
CMC	HMC1	sing	0.00Å	1.10Å
CMC	HMC2	sing	0.00Å	1.10Å
CMC	HMC3	sing	0.00Å	1.10Å
C3C	CAC	sing	0.00Å	1.53Å
CAC	OCC	doub	0.00Å	1.21Å
CAC	CBC	sing	0.00Å	1.34Å
CBC	HBC1	sing	0.00Å	1.10Å
CBC	HBC2	sing	0.00Å	1.10Å
CBC	HBC3	sing	0.00Å	1.10Å
C2D	CMD	sing	0.00Å	1.54Å
C2D	C3D	doub	0.00Å	1.34Å
CMD	HMD1	sing	0.00Å	1.10Å
CMD	HMD2	sing	0.00Å	1.10Å
CMD	HMD3	sing	0.00Å	1.10Å
C3D	CAD	sing	0.00Å	1.54Å
CAD	CBD	sing	0.00Å	1.53Å
CAD	HAD1	sing	0.00Å	1.10Å
CAD	HAD2	sing	0.00Å	1.10Å
CBD	CGD	sing	0.00Å	1.51Å
CBD	HBD1	sing	0.00Å	1.10Å
CBD	HBD2	sing	0.00Å	1.10Å
CGD	O1D	sing	0.00Å	1.26Å
CGD	O2D	doub	0.00Å	1.26Å
O1D	HO1D	sing	0.00Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
NA	FE	NB	83.6°	90.0°
NA	FE	NC	174.0°	90.0°
NA	FE	ND	94.2°	90.0°
FE	NA	C1A	120.8°	90.0°
FE	NA	C4A	133.7°	90.0°
NB	FE	NC	92.1°	90.0°
NB	FE	ND	172.2°	90.0°
FE	NB	C1B	130.2°	90.0°
FE	NB	C4B	122.9°	90.0°
NC	FE	ND	89.6°	90.0°
FE	NC	C1C	125.4°	90.0°
FE	NC	C4C	128.6°	90.0°
FE	ND	C4D	121.8°	90.0°
FE	ND	C1D	123.0°	90.0°
C1A	NA	C4A	105.4°	90.0°
NA	C1A	CHA	132.3°	90.0°
NA	C1A	C2A	108.6°	90.0°
NA	C4A	CHB	128.8°	90.0°
NA	C4A	C3A	109.3°	90.0°
C1B	NB	C4B	106.7°	90.0°
NB	C1B	CHB	127.8°	90.0°
NB	C1B	C2B	109.5°	90.0°
NB	C4B	CHC	126.8°	90.0°
NB	C4B	C3B	108.4°	90.0°
C1C	NC	C4C	105.3°	90.0°
NC	C1C	CHC	126.6°	90.0°
NC	C1C	C2C	109.4°	90.0°
NC	C4C	CHD	125.0°	90.0°
NC	C4C	C3C	108.8°	90.0°
C4D	ND	C1D	107.0°	90.0°
ND	C4D	CHA	124.2°	90.0°
ND	C4D	C3D	108.6°	90.0°
ND	C1D	CHD	125.9°	90.0°
ND	C1D	C2D	108.4°	90.0°
CHA	C1A	C2A	118.6°	90.0°
C1A	CHA	C4D	120.6°	90.0°
C1A	CHA	HHA	119.7°	90.0°
C1A	C2A	CAA	121.1°	90.0°
C1A	C2A	C3A	108.0°	90.0°
C4D	CHA	HHA	119.7°	90.0°
CHA	C4D	C3D	127.1°	90.0°
C4D	C3D	C2D	107.7°	90.0°
C4D	C3D	CAD	122.0°	90.0°
CHB	C1B	C2B	121.8°	90.0°
C1B	CHB	C4A	112.5°	90.0°
C1B	CHB	HHB	123.7°	90.0°
C1B	C2B	CMB	124.0°	90.0°
C1B	C2B	C3B	107.5°	90.0°
C4A	CHB	HHB	123.8°	90.0°
CHB	C4A	C3A	119.2°	90.0°
C4A	C3A	C2A	108.2°	90.0°
C4A	C3A	CMA	124.1°	90.0°
CHC	C1C	C2C	123.8°	90.0°
C1C	CHC	C4B	124.2°	90.0°
C1C	CHC	HHC	117.9°	90.0°
C1C	C2C	CMC	128.5°	90.0°
C1C	C2C	C3C	107.4°	90.0°
C4B	CHC	HHC	117.9°	90.0°
CHC	C4B	C3B	121.1°	90.0°
C4B	C3B	C2B	107.1°	90.0°
C4B	C3B	CAB	123.1°	90.0°
CHD	C1D	C2D	124.9°	90.0°
C1D	CHD	C4C	123.1°	90.0°
C1D	CHD	HHD	118.5°	90.0°
C1D	C2D	CMD	123.0°	90.0°
C1D	C2D	C3D	106.9°	90.0°
C4C	CHD	HHD	118.5°	90.0°
CHD	C4C	C3C	125.9°	90.0°
C4C	C3C	C2C	108.4°	90.0°
C4C	C3C	CAC	123.6°	90.0°
CAA	C2A	C3A	129.4°	90.0°
C2A	CAA	CBA	113.4°	90.0°
C2A	CAA	HAA1	108.5°	90.0°
C2A	CAA	HAA2	108.4°	90.0°
C2A	C3A	CMA	127.0°	90.0°
CBA	CAA	HAA1	108.5°	90.0°
CBA	CAA	HAA2	108.5°	90.0°
CAA	CBA	CGA	116.9°	90.0°
CAA	CBA	HBA1	107.6°	90.0°
CAA	CBA	HBA2	107.6°	90.0°
HAA1	CAA	HAA2	109.5°	90.0°
C3A	CMA	HMA1	109.5°	90.0°
C3A	CMA	HMA2	109.5°	90.0°
C3A	CMA	HMA3	109.5°	90.0°
HMA1	CMA	HMA2	109.4°	90.0°
HMA1	CMA	HMA3	109.4°	90.0°
HMA2	CMA	HMA3	109.5°	90.0°
CGA	CBA	HBA1	107.6°	90.0°
CGA	CBA	HBA2	107.6°	90.0°
CBA	CGA	O1A	119.5°	90.0°
CBA	CGA	O2A	118.0°	90.0°
HBA1	CBA	HBA2	109.5°	90.0°
O1A	CGA	O2A	122.2°	90.0°
CGA	O2A	HO2A	109.5°	90.0°
CMB	C2B	C3B	128.2°	90.0°
C2B	CMB	HMB1	109.5°	90.0°
C2B	CMB	HMB2	109.5°	90.0°
C2B	CMB	HMB3	109.4°	90.0°
C2B	C3B	CAB	127.9°	90.0°
HMB1	CMB	HMB2	109.5°	90.0°
HMB1	CMB	HMB3	109.5°	90.0°
HMB2	CMB	HMB3	109.5°	90.0°
C3B	CAB	OCB	119.5°	90.0°
C3B	CAB	CBB	118.6°	90.0°
OCB	CAB	CBB	119.4°	90.0°
CAB	OCB	HOCB	109.5°	90.0°
CAB	CBB	HBB1	120.0°	90.0°
CAB	CBB	HBB2	120.0°	90.0°
HBB1	CBB	HBB2	120.0°	90.0°
CMC	C2C	C3C	124.0°	90.0°
C2C	CMC	HMC1	109.5°	90.0°
C2C	CMC	HMC2	109.5°	90.0°
C2C	CMC	HMC3	109.5°	90.0°
C2C	C3C	CAC	128.0°	90.0°
HMC1	CMC	HMC2	109.5°	90.0°
HMC1	CMC	HMC3	109.4°	90.0°
HMC2	CMC	HMC3	109.5°	90.0°
C3C	CAC	OCC	114.6°	90.0°
C3C	CAC	CBC	123.7°	90.0°
OCC	CAC	CBC	120.4°	90.0°
CAC	CBC	HBC1	109.5°	90.0°
CAC	CBC	HBC2	109.5°	90.0°
CAC	CBC	HBC3	109.5°	90.0°
HBC1	CBC	HBC2	109.4°	90.0°
HBC1	CBC	HBC3	109.5°	90.0°
HBC2	CBC	HBC3	109.5°	90.0°
CMD	C2D	C3D	128.8°	90.0°
C2D	CMD	HMD1	109.5°	90.0°
C2D	CMD	HMD2	109.5°	90.0°
C2D	CMD	HMD3	109.5°	90.0°
C2D	C3D	CAD	129.9°	90.0°
HMD1	CMD	HMD2	109.5°	90.0°
HMD1	CMD	HMD3	109.5°	90.0°
HMD2	CMD	HMD3	109.5°	90.0°
C3D	CAD	CBD	110.5°	90.0°
C3D	CAD	HAD1	109.2°	90.0°
C3D	CAD	HAD2	109.2°	90.0°
CBD	CAD	HAD1	109.2°	90.0°
CBD	CAD	HAD2	109.2°	90.0°
CAD	CBD	CGD	115.7°	90.0°
CAD	CBD	HBD1	107.9°	90.0°
CAD	CBD	HBD2	107.9°	90.0°
HAD1	CAD	HAD2	109.5°	90.0°
CGD	CBD	HBD1	107.9°	90.0°
CGD	CBD	HBD2	107.9°	90.0°
CBD	CGD	O1D	111.2°	90.0°
CBD	CGD	O2D	116.6°	90.0°
HBD1	CBD	HBD2	109.5°	90.0°
O1D	CGD	O2D	132.2°	90.0°
CGD	O1D	HO1D	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
NA	FE	NB	NC	175.9°	90.0°
NA	FE	NB	ND	73.9°	90.0°
NA	FE	NC	ND	129.7°	90.0°
FE	NA	C1A	C4A	176.1°	90.0°
NA	FE	NB	C1B	1.4°	90.0°
NA	FE	NB	C4B	175.8°	90.0°
NA	FE	NC	C1C	38.4°	90.0°
NA	FE	NC	C4C	130.4°	90.0°
NA	FE	ND	C4D	23.9°	90.0°
NA	FE	ND	C1D	168.0°	90.0°
FE	NA	C1A	CHA	10.8°	90.0°
FE	NA	C1A	C2A	177.1°	90.0°
FE	NA	C4A	CHB	17.4°	90.0°
FE	NA	C4A	C3A	178.0°	90.0°
NB	FE	NC	ND	172.3°	90.0°
NB	FE	NA	C1A	179.3°	90.0°
NB	FE	NA	C4A	4.6°	90.0°
FE	NB	C1B	C4B	175.2°	90.0°
NB	FE	NC	C1C	4.2°	90.0°
NB	FE	NC	C4C	173.1°	90.0°
NB	FE	ND	C4D	97.1°	90.0°
NB	FE	ND	C1D	118.7°	90.0°
FE	NB	C1B	CHB	10.0°	90.0°
FE	NB	C1B	C2B	179.8°	90.0°
FE	NB	C4B	CHC	17.7°	90.0°
FE	NB	C4B	C3B	175.6°	90.0°
NC	FE	NA	C1A	137.7°	90.0°
NC	FE	NA	C4A	47.5°	90.0°
NC	FE	NB	C1B	177.3°	90.0°
NC	FE	NB	C4B	8.2°	90.0°
FE	NC	C1C	C4C	171.0°	90.0°
NC	FE	ND	C4D	160.7°	90.0°
NC	FE	ND	C1D	16.6°	90.0°
FE	NC	C1C	CHC	10.3°	90.0°
FE	NC	C1C	C2C	174.1°	90.0°
FE	NC	C4C	CHD	6.1°	90.0°
FE	NC	C4C	C3C	168.6°	90.0°
ND	FE	NA	C1A	8.2°	90.0°
ND	FE	NA	C4A	177.0°	90.0°
ND	FE	NB	C1B	75.3°	90.0°
ND	FE	NB	C4B	110.2°	90.0°
ND	FE	NC	C1C	168.1°	90.0°
ND	FE	NC	C4C	0.7°	90.0°
FE	ND	C4D	C1D	149.1°	90.0°
FE	ND	C4D	CHA	23.4°	90.0°
FE	ND	C4D	C3D	160.1°	90.0°
FE	ND	C1D	CHD	29.2°	90.0°
FE	ND	C1D	C2D	160.5°	90.0°
NA	C1A	CHA	C2A	171.5°	90.0°
NA	C1A	CHA	C4D	18.5°	90.0°
NA	C1A	CHA	HHA	161.5°	90.0°
C1A	NA	C4A	CHB	167.3°	90.0°
C1A	NA	C4A	C3A	6.7°	90.0°
NA	C1A	C2A	CAA	171.7°	90.0°
NA	C1A	C2A	C3A	4.6°	90.0°
C4A	NA	C1A	CHA	165.3°	90.0°
C4A	NA	C1A	C2A	6.9°	90.0°
NA	C4A	CHB	C1B	22.5°	90.0°
NA	C4A	CHB	C3A	159.0°	90.0°
NA	C4A	CHB	HHB	157.5°	90.0°
NA	C4A	C3A	C2A	4.1°	90.0°
NA	C4A	C3A	CMA	174.7°	90.0°
NB	C1B	CHB	C2B	168.6°	90.0°
NB	C1B	CHB	C4A	19.0°	90.0°
NB	C1B	CHB	HHB	161.1°	90.0°
C1B	NB	C4B	CHC	166.7°	90.0°
C1B	NB	C4B	C3B	8.8°	90.0°
NB	C1B	C2B	CMB	174.8°	90.0°
NB	C1B	C2B	C3B	1.0°	90.0°
C4B	NB	C1B	CHB	174.8°	90.0°
C4B	NB	C1B	C2B	5.1°	90.0°
NB	C4B	CHC	C1C	12.6°	90.0°
NB	C4B	CHC	C3B	155.4°	90.0°
NB	C4B	CHC	HHC	167.4°	90.0°
NB	C4B	C3B	C2B	9.6°	90.0°
NB	C4B	C3B	CAB	174.8°	90.0°
NC	C1C	CHC	C2C	174.9°	90.0°
NC	C1C	CHC	C4B	2.8°	90.0°
NC	C1C	CHC	HHC	177.2°	90.0°
C1C	NC	C4C	CHD	176.7°	90.0°
C1C	NC	C4C	C3C	2.0°	90.0°
NC	C1C	C2C	CMC	176.7°	90.0°
NC	C1C	C2C	C3C	7.7°	90.0°
C4C	NC	C1C	CHC	178.7°	90.0°
C4C	NC	C1C	C2C	3.2°	90.0°
NC	C4C	CHD	C1D	1.8°	90.0°
NC	C4C	CHD	C3C	173.8°	90.0°
NC	C4C	CHD	HHD	178.2°	90.0°
NC	C4C	C3C	C2C	7.0°	90.0°
NC	C4C	C3C	CAC	176.1°	90.0°
ND	C4D	CHA	C1A	1.7°	90.0°
ND	C4D	CHA	C3D	175.9°	90.0°
ND	C4D	CHA	HHA	178.2°	90.0°
C4D	ND	C1D	CHD	177.8°	90.0°
C4D	ND	C1D	C2D	11.8°	90.0°
ND	C4D	C3D	C2D	5.8°	90.0°
ND	C4D	C3D	CAD	179.0°	90.0°
C1D	ND	C4D	CHA	172.4°	90.0°
C1D	ND	C4D	C3D	11.0°	90.0°
ND	C1D	CHD	C2D	168.8°	90.0°
ND	C1D	CHD	C4C	21.1°	90.0°
ND	C1D	CHD	HHD	158.9°	90.0°
ND	C1D	C2D	CMD	176.2°	90.0°
ND	C1D	C2D	C3D	8.3°	90.0°
C1A	CHA	C4D	HHA	180.0°	90.0°
C1A	CHA	C4D	C3D	177.7°	90.0°
CHA	C1A	C2A	CAA	1.6°	90.0°
CHA	C1A	C2A	C3A	168.8°	90.0°
C2A	C1A	CHA	C4D	170.0°	90.0°
C2A	C1A	CHA	HHA	10.0°	90.0°
C1A	C2A	C3A	C4A	0.3°	90.0°
C1A	C2A	CAA	C3A	164.2°	90.0°
C1A	C2A	CAA	CBA	104.2°	90.0°
C1A	C2A	CAA	HAA1	135.2°	90.0°
C1A	C2A	CAA	HAA2	16.3°	90.0°
C1A	C2A	C3A	CMA	169.9°	90.0°
CHA	C4D	C3D	C2D	177.7°	90.0°
CHA	C4D	C3D	CAD	4.5°	90.0°
HHA	CHA	C4D	C3D	2.3°	90.0°
C4D	C3D	C2D	C1D	1.5°	90.0°
C4D	C3D	C2D	CMD	168.5°	90.0°
C4D	C3D	C2D	CAD	172.5°	90.0°
C4D	C3D	CAD	CBD	88.9°	90.0°
C4D	C3D	CAD	HAD1	31.3°	90.0°
C4D	C3D	CAD	HAD2	150.9°	90.0°
C1B	CHB	C4A	HHB	180.0°	90.0°
C1B	CHB	C4A	C3A	178.5°	90.0°
CHB	C1B	C2B	CMB	4.3°	90.0°
CHB	C1B	C2B	C3B	169.5°	90.0°
C2B	C1B	CHB	C4A	172.4°	90.0°
C2B	C1B	CHB	HHB	7.5°	90.0°
C1B	C2B	C3B	C4B	6.3°	90.0°
C1B	C2B	CMB	C3B	172.6°	90.0°
C1B	C2B	CMB	HMB1	180.0°	90.0°
C1B	C2B	CMB	HMB2	60.0°	90.0°
C1B	C2B	CMB	HMB3	60.0°	90.0°
C1B	C2B	C3B	CAB	170.6°	90.0°
CHB	C4A	C3A	C2A	166.8°	90.0°
CHB	C4A	C3A	CMA	22.5°	90.0°
HHB	CHB	C4A	C3A	1.5°	90.0°
C4A	C3A	C2A	CAA	166.1°	90.0°
C4A	C3A	C2A	CMA	170.3°	90.0°
C4A	C3A	CMA	HMA1	180.0°	90.0°
C4A	C3A	CMA	HMA2	60.0°	90.0°
C4A	C3A	CMA	HMA3	60.0°	90.0°
C1C	CHC	C4B	HHC	180.0°	90.0°
C1C	CHC	C4B	C3B	168.0°	90.0°
CHC	C1C	C2C	CMC	1.1°	90.0°
CHC	C1C	C2C	C3C	176.6°	90.0°
C2C	C1C	CHC	C4B	177.7°	90.0°
C2C	C1C	CHC	HHC	2.3°	90.0°
C1C	C2C	C3C	C4C	8.7°	90.0°
C1C	C2C	CMC	C3C	174.9°	90.0°
C1C	C2C	CMC	HMC1	87.2°	90.0°
C1C	C2C	CMC	HMC2	152.7°	90.0°
C1C	C2C	CMC	HMC3	32.7°	90.0°
C1C	C2C	C3C	CAC	174.6°	90.0°
CHC	C4B	C3B	C2B	169.0°	90.0°
CHC	C4B	C3B	CAB	25.8°	90.0°
HHC	CHC	C4B	C3B	12.0°	90.0°
C4B	C3B	C2B	CMB	179.8°	90.0°
C4B	C3B	C2B	CAB	164.3°	90.0°
C4B	C3B	CAB	OCB	52.8°	90.0°
C4B	C3B	CAB	CBB	145.3°	90.0°
C1D	CHD	C4C	HHD	180.0°	90.0°
C1D	CHD	C4C	C3C	175.6°	90.0°
CHD	C1D	C2D	CMD	13.3°	90.0°
CHD	C1D	C2D	C3D	178.7°	90.0°
C2D	C1D	CHD	C4C	170.2°	90.0°
C2D	C1D	CHD	HHD	9.8°	90.0°
C1D	C2D	CMD	C3D	165.1°	90.0°
C1D	C2D	CMD	HMD1	180.0°	90.0°
C1D	C2D	CMD	HMD2	60.0°	90.0°
C1D	C2D	CMD	HMD3	60.0°	90.0°
C1D	C2D	C3D	CAD	171.0°	90.0°
CHD	C4C	C3C	C2C	178.4°	90.0°
CHD	C4C	C3C	CAC	1.5°	90.0°
HHD	CHD	C4C	C3C	4.4°	90.0°
C4C	C3C	C2C	CMC	175.5°	90.0°
C4C	C3C	C2C	CAC	176.8°	90.0°
C4C	C3C	CAC	OCC	35.0°	90.0°
C4C	C3C	CAC	CBC	157.5°	90.0°
C2A	CAA	CBA	HAA1	120.6°	90.0°
C2A	CAA	CBA	HAA2	120.5°	90.0°
C2A	CAA	HAA1	HAA2	118.2°	90.0°
CAA	C2A	C3A	CMA	4.2°	90.0°
C2A	CAA	CBA	CGA	178.2°	90.0°
C2A	CAA	CBA	HBA1	60.7°	90.0°
C2A	CAA	CBA	HBA2	57.2°	90.0°
C3A	C2A	CAA	CBA	91.6°	90.0°
C3A	C2A	CAA	HAA1	28.9°	90.0°
C3A	C2A	CAA	HAA2	147.8°	90.0°
C2A	C3A	CMA	HMA1	11.2°	90.0°
C2A	C3A	CMA	HMA2	131.2°	90.0°
C2A	C3A	CMA	HMA3	108.8°	90.0°
CBA	CAA	HAA1	HAA2	118.2°	90.0°
CAA	CBA	CGA	HBA1	121.1°	90.0°
CAA	CBA	CGA	HBA2	121.1°	90.0°
CAA	CBA	HBA1	HBA2	116.6°	90.0°
CAA	CBA	CGA	O1A	80.9°	90.0°
CAA	CBA	CGA	O2A	105.2°	90.0°
HAA1	CAA	CBA	CGA	57.6°	90.0°
HAA1	CAA	CBA	HBA1	178.7°	90.0°
HAA1	CAA	CBA	HBA2	63.4°	90.0°
HAA2	CAA	CBA	CGA	61.2°	90.0°
HAA2	CAA	CBA	HBA1	59.9°	90.0°
HAA2	CAA	CBA	HBA2	177.7°	90.0°
C3A	CMA	HMA1	HMA2	120.0°	90.0°
C3A	CMA	HMA1	HMA3	120.0°	90.0°
C3A	CMA	HMA2	HMA3	120.0°	90.0°
HMA1	CMA	HMA2	HMA3	120.0°	90.0°
CGA	CBA	HBA1	HBA2	116.6°	90.0°
CBA	CGA	O1A	O2A	173.6°	90.0°
CBA	CGA	O2A	HO2A	173.7°	90.0°
HBA1	CBA	CGA	O1A	158.0°	90.0°
HBA1	CBA	CGA	O2A	15.9°	90.0°
HBA2	CBA	CGA	O1A	40.1°	90.0°
HBA2	CBA	CGA	O2A	133.8°	90.0°
O1A	CGA	O2A	HO2A	0.0°	90.0°
C2B	CMB	HMB1	HMB2	120.0°	90.0°
C2B	CMB	HMB1	HMB3	120.0°	90.0°
C2B	CMB	HMB2	HMB3	119.9°	90.0°
CMB	C2B	C3B	CAB	15.9°	90.0°
C3B	C2B	CMB	HMB1	7.4°	90.0°
C3B	C2B	CMB	HMB2	127.5°	90.0°
C3B	C2B	CMB	HMB3	112.6°	90.0°
C2B	C3B	CAB	OCB	145.2°	90.0°
C2B	C3B	CAB	CBB	16.7°	90.0°
HMB1	CMB	HMB2	HMB3	120.0°	90.0°
C3B	CAB	OCB	CBB	161.7°	90.0°
C3B	CAB	OCB	HOCB	180.0°	90.0°
C3B	CAB	CBB	HBB1	161.9°	90.0°
C3B	CAB	CBB	HBB2	18.1°	90.0°
OCB	CAB	CBB	HBB1	0.0°	90.0°
OCB	CAB	CBB	HBB2	180.0°	90.0°
CBB	CAB	OCB	HOCB	18.3°	90.0°
CAB	CBB	HBB1	HBB2	180.0°	90.0°
C2C	CMC	HMC1	HMC2	120.0°	90.0°
C2C	CMC	HMC1	HMC3	120.0°	90.0°
C2C	CMC	HMC2	HMC3	120.0°	90.0°
CMC	C2C	C3C	CAC	1.3°	90.0°
C3C	C2C	CMC	HMC1	87.7°	90.0°
C3C	C2C	CMC	HMC2	32.4°	90.0°
C3C	C2C	CMC	HMC3	152.4°	90.0°
C2C	C3C	CAC	OCC	148.7°	90.0°
C2C	C3C	CAC	CBC	18.8°	90.0°
HMC1	CMC	HMC2	HMC3	120.0°	90.0°
C3C	CAC	OCC	CBC	168.0°	90.0°
C3C	CAC	CBC	HBC1	166.8°	90.0°
C3C	CAC	CBC	HBC2	73.2°	90.0°
C3C	CAC	CBC	HBC3	46.8°	90.0°
OCC	CAC	CBC	HBC1	0.0°	90.0°
OCC	CAC	CBC	HBC2	120.0°	90.0°
OCC	CAC	CBC	HBC3	120.0°	90.0°
CAC	CBC	HBC1	HBC2	120.0°	90.0°
CAC	CBC	HBC1	HBC3	120.0°	90.0°
CAC	CBC	HBC2	HBC3	120.0°	90.0°
HBC1	CBC	HBC2	HBC3	120.0°	90.0°
C2D	CMD	HMD1	HMD2	120.0°	90.0°
C2D	CMD	HMD1	HMD3	120.0°	90.0°
C2D	CMD	HMD2	HMD3	120.0°	90.0°
CMD	C2D	C3D	CAD	4.0°	90.0°
C3D	C2D	CMD	HMD1	14.8°	90.0°
C3D	C2D	CMD	HMD2	105.2°	90.0°
C3D	C2D	CMD	HMD3	134.9°	90.0°
C2D	C3D	CAD	CBD	99.6°	90.0°
C2D	C3D	CAD	HAD1	140.3°	90.0°
C2D	C3D	CAD	HAD2	20.6°	90.0°
HMD1	CMD	HMD2	HMD3	120.0°	90.0°
C3D	CAD	CBD	HAD1	120.2°	90.0°
C3D	CAD	CBD	HAD2	120.1°	90.0°
C3D	CAD	HAD1	HAD2	119.5°	90.0°
C3D	CAD	CBD	CGD	178.0°	90.0°
C3D	CAD	CBD	HBD1	61.1°	90.0°
C3D	CAD	CBD	HBD2	57.1°	90.0°
CBD	CAD	HAD1	HAD2	119.6°	90.0°
CAD	CBD	CGD	HBD1	120.9°	90.0°
CAD	CBD	CGD	HBD2	120.9°	90.0°
CAD	CBD	HBD1	HBD2	117.2°	90.0°
CAD	CBD	CGD	O1D	166.9°	90.0°
CAD	CBD	CGD	O2D	13.9°	90.0°
HAD1	CAD	CBD	CGD	57.9°	90.0°
HAD1	CAD	CBD	HBD1	178.8°	90.0°
HAD1	CAD	CBD	HBD2	63.0°	90.0°
HAD2	CAD	CBD	CGD	61.8°	90.0°
HAD2	CAD	CBD	HBD1	59.1°	90.0°
HAD2	CAD	CBD	HBD2	177.3°	90.0°
CGD	CBD	HBD1	HBD2	117.1°	90.0°
CBD	CGD	O1D	O2D	179.1°	90.0°
CBD	CGD	O1D	HO1D	179.1°	90.0°
HBD1	CBD	CGD	O1D	72.2°	90.0°
HBD1	CBD	CGD	O2D	107.0°	90.0°
HBD2	CBD	CGD	O1D	45.9°	90.0°
HBD2	CBD	CGD	O2D	134.8°	90.0°
O2D	CGD	O1D	HO1D	0.0°	90.0°

Definition date:	1999-07-08
Last modified:	2023-09-23
Release status:	REL
Processing site:	RCSB
Derived from:	1B86