182

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
OAC	CAJ	sing	0.00Å	1.43Å
OAC	HAC	sing	0.00Å	0.95Å
CAJ	CAK	sing	0.00Å	1.55Å
CAJ	HAJ1	sing	0.00Å	1.12Å
CAJ	HAJ2	sing	0.00Å	1.12Å
CAK	OAN	sing	0.00Å	1.44Å
CAK	HAK1	sing	0.00Å	1.11Å
CAK	HAK2	sing	0.00Å	1.12Å
OAN	CAL	sing	0.00Å	1.44Å
CAL	NAT	sing	0.00Å	1.41Å
CAL	HAL1	sing	0.00Å	1.11Å
CAL	HAL2	sing	0.00Å	1.12Å
NAT	CAS	sing	0.00Å	1.44Å	Aromatic
NAT	CAI	sing	0.00Å	1.42Å	Aromatic
CAS	OAB	doub	0.00Å	1.24Å
CAS	NAM	sing	0.00Å	1.42Å	Aromatic
NAM	CAR	sing	0.00Å	1.42Å	Aromatic
NAM	HAM	sing	0.00Å	1.02Å
CAR	OAA	doub	0.00Å	1.23Å
CAR	CAQ	sing	0.00Å	1.43Å	Aromatic
CAI	CAQ	doub	0.00Å	1.41Å	Aromatic
CAI	HAI	sing	0.00Å	1.10Å
CAQ	SE	sing	0.00Å	1.77Å
SE	CAP	sing	0.00Å	1.76Å
CAP	CAH	doub	0.00Å	1.44Å	Aromatic
CAP	CAG	sing	0.00Å	1.45Å	Aromatic
CAH	CAF	sing	0.00Å	1.45Å	Aromatic
CAH	HAH	sing	0.00Å	1.10Å
CAF	CAD	doub	0.00Å	1.45Å	Aromatic
CAF	HAF	sing	0.00Å	1.10Å
CAD	CAE	sing	0.00Å	1.44Å	Aromatic
CAD	HAD	sing	0.00Å	1.10Å
CAE	CAG	doub	0.00Å	1.45Å	Aromatic
CAE	HAE	sing	0.00Å	1.10Å
CAG	HAG	sing	0.00Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CAJ	OAC	HAC	109.1°	90.0°
OAC	CAJ	CAK	109.1°	90.0°
OAC	CAJ	HAJ1	112.4°	90.0°
OAC	CAJ	HAJ2	112.4°	90.0°
CAK	CAJ	HAJ1	112.4°	90.0°
CAK	CAJ	HAJ2	112.4°	90.0°
CAJ	CAK	OAN	107.8°	90.0°
CAJ	CAK	HAK1	112.8°	90.0°
CAJ	CAK	HAK2	112.8°	90.0°
HAJ1	CAJ	HAJ2	98.0°	90.0°
OAN	CAK	HAK1	112.8°	90.0°
OAN	CAK	HAK2	112.9°	90.0°
CAK	OAN	CAL	111.2°	90.0°
HAK1	CAK	HAK2	97.6°	90.0°
OAN	CAL	NAT	120.5°	90.0°
OAN	CAL	HAL1	108.2°	90.0°
OAN	CAL	HAL2	108.2°	90.0°
NAT	CAL	HAL1	108.3°	90.0°
NAT	CAL	HAL2	108.3°	90.0°
CAL	NAT	CAS	122.8°	90.0°
CAL	NAT	CAI	117.8°	90.0°
HAL1	CAL	HAL2	101.7°	90.0°
CAS	NAT	CAI	119.4°	90.0°
NAT	CAS	OAB	122.7°	90.0°
NAT	CAS	NAM	119.1°	90.0°
NAT	CAI	CAQ	121.6°	90.0°
NAT	CAI	HAI	119.7°	90.0°
OAB	CAS	NAM	118.0°	90.0°
CAS	NAM	CAR	120.3°	90.0°
CAS	NAM	HAM	119.9°	90.0°
CAR	NAM	HAM	119.8°	90.0°
NAM	CAR	OAA	118.3°	90.0°
NAM	CAR	CAQ	121.1°	90.0°
OAA	CAR	CAQ	120.6°	90.0°
CAR	CAQ	CAI	118.5°	90.0°
CAR	CAQ	SE	123.3°	90.0°
CAQ	CAI	HAI	118.7°	90.0°
CAI	CAQ	SE	118.2°	90.0°
CAQ	SE	CAP	103.4°	90.0°
SE	CAP	CAH	122.6°	90.0°
SE	CAP	CAG	117.9°	90.0°
CAH	CAP	CAG	119.5°	90.0°
CAP	CAH	CAF	120.5°	90.0°
CAP	CAH	HAH	119.5°	90.0°
CAP	CAG	CAE	120.7°	90.0°
CAP	CAG	HAG	119.6°	90.0°
CAF	CAH	HAH	120.0°	90.0°
CAH	CAF	CAD	119.0°	90.0°
CAH	CAF	HAF	120.6°	90.0°
CAD	CAF	HAF	120.4°	90.0°
CAF	CAD	CAE	121.6°	90.0°
CAF	CAD	HAD	119.6°	90.0°
CAE	CAD	HAD	118.8°	90.0°
CAD	CAE	CAG	118.7°	90.0°
CAD	CAE	HAE	120.1°	90.0°
CAG	CAE	HAE	121.2°	90.0°
CAE	CAG	HAG	119.7°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
OAC	CAJ	CAK	HAJ1	125.3°	90.0°
OAC	CAJ	CAK	HAJ2	125.3°	90.0°
OAC	CAJ	HAJ1	HAJ2	118.3°	90.0°
OAC	CAJ	CAK	OAN	50.1°	90.0°
OAC	CAJ	CAK	HAK1	75.2°	90.0°
OAC	CAJ	CAK	HAK2	175.3°	90.0°
HAC	OAC	CAJ	CAK	180.0°	90.0°
HAC	OAC	CAJ	HAJ1	54.7°	90.0°
HAC	OAC	CAJ	HAJ2	54.7°	90.0°
CAK	CAJ	HAJ1	HAJ2	118.3°	90.0°
CAJ	CAK	OAN	HAK1	125.3°	90.0°
CAJ	CAK	OAN	HAK2	125.2°	90.0°
CAJ	CAK	HAK1	HAK2	118.7°	90.0°
CAJ	CAK	OAN	CAL	156.5°	90.0°
HAJ1	CAJ	CAK	OAN	175.4°	90.0°
HAJ1	CAJ	CAK	HAK1	50.1°	90.0°
HAJ1	CAJ	CAK	HAK2	59.4°	90.0°
HAJ2	CAJ	CAK	OAN	75.2°	90.0°
HAJ2	CAJ	CAK	HAK1	159.5°	90.0°
HAJ2	CAJ	CAK	HAK2	50.0°	90.0°
OAN	CAK	HAK1	HAK2	118.8°	90.0°
CAK	OAN	CAL	NAT	72.4°	90.0°
CAK	OAN	CAL	HAL1	52.8°	90.0°
CAK	OAN	CAL	HAL2	162.3°	90.0°
HAK1	CAK	OAN	CAL	31.2°	90.0°
HAK2	CAK	OAN	CAL	78.3°	90.0°
OAN	CAL	NAT	HAL1	125.2°	90.0°
OAN	CAL	NAT	HAL2	125.2°	90.0°
OAN	CAL	HAL1	HAL2	113.8°	90.0°
OAN	CAL	NAT	CAS	108.6°	90.0°
OAN	CAL	NAT	CAI	71.1°	90.0°
NAT	CAL	HAL1	HAL2	114.0°	90.0°
CAL	NAT	CAS	CAI	179.7°	90.0°
CAL	NAT	CAS	OAB	4.0°	90.0°
CAL	NAT	CAS	NAM	179.8°	90.0°
CAL	NAT	CAI	CAQ	179.9°	90.0°
CAL	NAT	CAI	HAI	0.1°	90.0°
HAL1	CAL	NAT	CAS	16.7°	90.0°
HAL1	CAL	NAT	CAI	163.7°	90.0°
HAL2	CAL	NAT	CAS	126.2°	90.0°
HAL2	CAL	NAT	CAI	54.2°	90.0°
NAT	CAS	OAB	NAM	176.3°	90.0°
NAT	CAS	NAM	CAR	0.4°	90.0°
NAT	CAS	NAM	HAM	179.7°	90.0°
CAS	NAT	CAI	CAQ	0.2°	90.0°
CAS	NAT	CAI	HAI	179.8°	90.0°
CAI	NAT	CAS	OAB	175.7°	90.0°
CAI	NAT	CAS	NAM	0.6°	90.0°
NAT	CAI	CAQ	CAR	0.4°	90.0°
NAT	CAI	CAQ	HAI	180.0°	90.0°
NAT	CAI	CAQ	SE	179.4°	90.0°
OAB	CAS	NAM	CAR	176.1°	90.0°
OAB	CAS	NAM	HAM	3.9°	90.0°
CAS	NAM	CAR	HAM	180.0°	90.0°
CAS	NAM	CAR	OAA	178.5°	90.0°
CAS	NAM	CAR	CAQ	0.2°	90.0°
NAM	CAR	OAA	CAQ	178.7°	90.0°
NAM	CAR	CAQ	CAI	0.6°	90.0°
NAM	CAR	CAQ	SE	179.1°	90.0°
HAM	NAM	CAR	OAA	1.6°	90.0°
HAM	NAM	CAR	CAQ	179.7°	90.0°
OAA	CAR	CAQ	CAI	178.1°	90.0°
OAA	CAR	CAQ	SE	2.2°	90.0°
CAR	CAQ	CAI	SE	179.7°	90.0°
CAR	CAQ	CAI	HAI	179.6°	90.0°
CAR	CAQ	SE	CAP	82.6°	90.0°
CAI	CAQ	SE	CAP	97.1°	90.0°
HAI	CAI	CAQ	SE	0.6°	90.0°
CAQ	SE	CAP	CAH	108.7°	90.0°
CAQ	SE	CAP	CAG	72.0°	90.0°
SE	CAP	CAH	CAG	179.3°	90.0°
SE	CAP	CAH	CAF	179.2°	90.0°
SE	CAP	CAH	HAH	0.8°	90.0°
SE	CAP	CAG	CAE	179.3°	90.0°
SE	CAP	CAG	HAG	0.7°	90.0°
CAP	CAH	CAF	HAH	180.0°	90.0°
CAP	CAH	CAF	CAD	0.0°	90.0°
CAP	CAH	CAF	HAF	180.0°	90.0°
CAH	CAP	CAG	CAE	0.1°	90.0°
CAH	CAP	CAG	HAG	179.9°	90.0°
CAG	CAP	CAH	CAF	0.1°	90.0°
CAG	CAP	CAH	HAH	179.9°	90.0°
CAP	CAG	CAE	CAD	0.0°	90.0°
CAP	CAG	CAE	HAG	180.0°	90.0°
CAP	CAG	CAE	HAE	180.0°	90.0°
CAH	CAF	CAD	HAF	180.0°	90.0°
CAH	CAF	CAD	CAE	0.0°	90.0°
CAH	CAF	CAD	HAD	180.0°	90.0°
HAH	CAH	CAF	CAD	180.0°	90.0°
HAH	CAH	CAF	HAF	0.0°	90.0°
CAF	CAD	CAE	HAD	180.0°	90.0°
CAF	CAD	CAE	CAG	0.0°	90.0°
CAF	CAD	CAE	HAE	179.9°	90.0°
HAF	CAF	CAD	CAE	179.9°	90.0°
HAF	CAF	CAD	HAD	0.1°	90.0°
CAD	CAE	CAG	HAE	180.0°	90.0°
CAD	CAE	CAG	HAG	180.0°	90.0°
HAD	CAD	CAE	CAG	180.0°	90.0°
HAD	CAD	CAE	HAE	0.0°	90.0°
HAE	CAE	CAG	HAG	0.0°	90.0°

Definition date:	2004-08-09
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB