I30

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CAA	CAP	sing	1.51Å	1.53Å
OAB	CAQ	doub	1.22Å	1.24Å
OAC	CAS	sing	1.36Å	1.36Å
BRAD	CAR	sing	1.89Å	1.88Å
CAE	CAF	doub	1.39Å	1.37Å	Aromatic
CAE	CAI	sing	1.38Å	1.37Å	Aromatic
CAF	CAJ	sing	1.37Å	1.39Å	Aromatic
CAG	CAH	doub	1.38Å	1.38Å	Aromatic
CAG	CAR	sing	1.39Å	1.38Å	Aromatic
CAH	CAS	sing	1.39Å	1.39Å	Aromatic
CAI	CAV	doub	1.39Å	1.39Å	Aromatic
CAJ	CAW	doub	1.40Å	1.38Å	Aromatic
CAK	CAR	doub	1.38Å	1.40Å	Aromatic
CAK	CAT	sing	1.40Å	1.40Å	Aromatic
NAL	NAN	sing	1.40Å	1.22Å
NAL	CAP	doub	1.30Å	1.33Å
NAM	CAU	sing	1.37Å	1.34Å	Aromatic
NAM	CAV	sing	1.38Å	1.33Å	Aromatic
NAN	CAQ	sing	1.35Å	1.34Å
NAO	CAU	doub	1.31Å	1.33Å	Aromatic
NAO	CAW	sing	1.35Å	1.33Å	Aromatic
CAP	CAU	sing	1.47Å	1.38Å
CAQ	CAT	sing	1.47Å	1.55Å
CAS	CAT	doub	1.40Å	1.39Å	Aromatic
CAV	CAW	sing	1.41Å	1.38Å	Aromatic
CAA	HAA	sing	1.09Å	1.10Å
CAA	HAAA	sing	1.09Å	1.10Å
CAA	HAAB	sing	1.09Å	1.10Å
OAC	HOAC	sing	0.97Å	0.95Å
CAE	HAE	sing	1.08Å	1.08Å
CAF	HAF	sing	1.08Å	1.08Å
CAG	HAG	sing	1.08Å	1.08Å
CAH	HAH	sing	1.08Å	1.08Å
CAI	HAI	sing	1.08Å	1.08Å
CAJ	HAJ	sing	1.08Å	1.08Å
CAK	HAK	sing	1.08Å	1.08Å
NAM	HNAM	sing	0.97Å	1.00Å
NAN	HNAN	sing	0.97Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CAA	CAP	NAL	124.3°	120.1°
CAA	CAP	CAU	122.1°	119.9°
CAP	CAA	HAA	109.5°	109.5°
CAP	CAA	HAAA	109.5°	109.5°
CAP	CAA	HAAB	109.4°	109.4°
OAB	CAQ	NAN	122.5°	120.0°
OAB	CAQ	CAT	122.9°	120.0°
OAC	CAS	CAH	119.4°	120.2°
OAC	CAS	CAT	118.7°	120.1°
CAS	OAC	HOAC	109.5°	114.0°
BRAD	CAR	CAG	115.3°	119.8°
BRAD	CAR	CAK	123.4°	119.9°
CAF	CAE	CAI	117.6°	120.5°
CAE	CAF	CAJ	120.9°	120.7°
CAF	CAE	HAE	121.2°	119.7°
CAE	CAF	HAF	119.5°	119.7°
CAE	CAI	CAV	122.1°	119.7°
CAI	CAE	HAE	121.2°	119.8°
CAE	CAI	HAI	118.9°	120.1°
CAF	CAJ	CAW	121.3°	119.9°
CAJ	CAF	HAF	119.5°	119.6°
CAF	CAJ	HAJ	119.4°	120.1°
CAH	CAG	CAR	119.4°	120.4°
CAG	CAH	CAS	119.6°	120.1°
CAH	CAG	HAG	120.3°	119.8°
CAG	CAH	HAH	120.2°	119.9°
CAG	CAR	CAK	121.4°	120.3°
CAR	CAG	HAG	120.3°	119.8°
CAH	CAS	CAT	121.9°	119.8°
CAS	CAH	HAH	120.2°	120.0°
CAI	CAV	NAM	132.9°	133.9°
CAI	CAV	CAW	120.2°	119.8°
CAV	CAI	HAI	119.0°	120.1°
CAJ	CAW	NAO	134.2°	133.3°
CAJ	CAW	CAV	117.8°	119.4°
CAW	CAJ	HAJ	119.3°	120.0°
CAR	CAK	CAT	119.2°	119.9°
CAR	CAK	HAK	120.4°	120.0°
CAK	CAT	CAQ	124.7°	120.2°
CAK	CAT	CAS	118.5°	119.6°
CAT	CAK	HAK	120.4°	120.1°
NAN	NAL	CAP	125.1°	120.0°
NAL	NAN	CAQ	117.8°	120.0°
NAL	NAN	HNAN	121.1°	120.0°
NAL	CAP	CAU	113.5°	120.0°
CAU	NAM	CAV	108.3°	107.0°
NAM	CAU	NAO	109.0°	109.6°
NAM	CAU	CAP	123.5°	125.1°
CAU	NAM	HNAM	125.9°	126.5°
NAM	CAV	CAW	106.9°	106.3°
CAV	NAM	HNAM	125.8°	126.5°
NAN	CAQ	CAT	114.4°	120.0°
CAQ	NAN	HNAN	121.1°	120.0°
CAU	NAO	CAW	107.8°	109.8°
NAO	CAU	CAP	127.4°	125.2°
NAO	CAW	CAV	108.0°	107.3°
CAQ	CAT	CAS	116.7°	120.2°
HAA	CAA	HAAA	109.4°	109.5°
HAA	CAA	HAAB	109.5°	109.4°
HAAA	CAA	HAAB	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CAA	CAP	NAL	NAN	0.6°	0.0°
CAA	CAP	NAL	CAU	178.5°	180.0°
CAA	CAP	CAU	NAM	170.1°	179.9°
CAA	CAP	CAU	NAO	13.0°	0.0°
CAP	CAA	HAA	HAAA	120.0°	120.1°
CAP	CAA	HAA	HAAB	120.0°	119.9°
CAP	CAA	HAAA	HAAB	120.0°	120.0°
OAB	CAQ	CAT	CAK	3.9°	180.0°
OAB	CAQ	NAN	NAL	1.9°	0.0°
OAB	CAQ	NAN	CAT	174.7°	180.0°
OAB	CAQ	CAT	CAS	172.6°	0.0°
OAB	CAQ	NAN	HNAN	178.1°	180.0°
OAC	CAS	CAH	CAG	179.9°	179.9°
OAC	CAS	CAH	CAT	179.3°	180.0°
OAC	CAS	CAT	CAK	178.7°	179.9°
OAC	CAS	CAT	CAQ	1.9°	0.0°
OAC	CAS	CAH	HAH	0.1°	0.0°
BRAD	CAR	CAG	CAH	179.4°	179.9°
BRAD	CAR	CAG	CAK	179.7°	179.9°
BRAD	CAR	CAK	CAT	179.5°	179.9°
BRAD	CAR	CAG	HAG	0.6°	0.2°
BRAD	CAR	CAK	HAK	0.5°	0.0°
CAF	CAE	CAI	HAE	180.0°	179.7°
CAE	CAF	CAJ	HAF	180.0°	180.0°
CAF	CAE	CAI	CAV	0.7°	0.0°
CAE	CAF	CAJ	CAW	1.4°	0.0°
CAF	CAE	CAI	HAI	179.3°	179.9°
CAE	CAF	CAJ	HAJ	178.6°	179.9°
CAI	CAE	CAF	CAJ	0.4°	0.0°
CAE	CAI	CAV	HAI	180.0°	179.9°
CAE	CAI	CAV	NAM	179.3°	179.9°
CAE	CAI	CAV	CAW	0.9°	0.0°
CAI	CAE	CAF	HAF	179.6°	180.0°
CAF	CAJ	CAW	HAJ	180.0°	179.9°
CAF	CAJ	CAW	NAO	178.9°	179.9°
CAF	CAJ	CAW	CAV	1.2°	0.0°
CAJ	CAF	CAE	HAE	179.6°	179.7°
CAH	CAG	CAR	HAG	180.0°	179.8°
CAG	CAH	CAS	HAH	180.0°	179.9°
CAH	CAG	CAR	CAK	0.3°	0.0°
CAG	CAH	CAS	CAT	0.8°	0.0°
CAR	CAG	CAH	CAS	0.3°	0.0°
CAG	CAR	CAK	CAT	0.8°	0.0°
CAR	CAG	CAH	HAH	179.7°	179.9°
CAG	CAR	CAK	HAK	179.2°	179.9°
CAH	CAS	CAT	CAK	2.0°	0.0°
CAH	CAS	CAT	CAQ	178.8°	180.0°
CAH	CAS	OAC	HOAC	180.0°	90.0°
CAS	CAH	CAG	HAG	179.6°	179.8°
CAI	CAV	CAW	CAJ	0.1°	0.0°
CAI	CAV	NAM	CAU	178.9°	180.0°
CAI	CAV	NAM	CAW	179.9°	179.9°
CAI	CAV	CAW	NAO	180.0°	180.0°
CAV	CAI	CAE	HAE	179.3°	179.7°
CAI	CAV	NAM	HNAM	1.2°	0.1°
CAJ	CAW	CAV	NAM	179.8°	180.0°
CAJ	CAW	NAO	CAU	178.7°	180.0°
CAJ	CAW	NAO	CAV	179.9°	180.0°
CAW	CAJ	CAF	HAF	178.6°	180.0°
CAR	CAK	CAT	HAK	180.0°	180.0°
CAR	CAK	CAT	CAQ	178.5°	180.0°
CAR	CAK	CAT	CAS	2.0°	0.0°
CAK	CAR	CAG	HAG	179.7°	179.7°
CAK	CAT	CAQ	NAN	178.7°	0.0°
CAK	CAT	CAQ	CAS	176.6°	180.0°
NAL	NAN	CAQ	HNAN	180.0°	180.0°
NAN	NAL	CAP	CAU	179.1°	180.0°
NAL	NAN	CAQ	CAT	176.6°	180.0°
NAL	CAP	CAU	NAM	11.4°	0.1°
CAP	NAL	NAN	CAQ	177.8°	180.0°
NAL	CAP	CAU	NAO	165.5°	180.0°
NAL	CAP	CAA	HAA	180.0°	89.9°
NAL	CAP	CAA	HAAA	60.0°	150.0°
NAL	CAP	CAA	HAAB	60.0°	30.0°
CAP	NAL	NAN	HNAN	2.2°	0.0°
CAU	NAM	CAV	HNAM	180.0°	179.9°
NAM	CAU	NAO	CAP	177.3°	179.9°
NAM	CAU	NAO	CAW	1.8°	0.1°
CAU	NAM	CAV	CAW	1.0°	0.1°
CAV	NAM	CAU	NAO	1.8°	0.1°
NAM	CAV	CAW	NAO	0.1°	0.0°
CAV	NAM	CAU	CAP	179.2°	180.0°
NAM	CAV	CAI	HAI	0.7°	0.1°
NAN	CAQ	CAT	CAS	2.1°	180.0°
CAU	NAO	CAW	CAV	1.2°	0.0°
NAO	CAU	NAM	HNAM	178.2°	180.0°
CAW	NAO	CAU	CAP	179.1°	180.0°
NAO	CAW	CAJ	HAJ	1.1°	0.0°
CAU	CAP	CAA	HAA	1.6°	90.0°
CAU	CAP	CAA	HAAA	118.3°	30.0°
CAU	CAP	CAA	HAAB	121.7°	150.0°
CAP	CAU	NAM	HNAM	0.8°	0.1°
CAQ	CAT	CAK	HAK	1.6°	0.1°
CAT	CAQ	NAN	HNAN	3.4°	0.0°
CAT	CAS	OAC	HOAC	0.7°	90.0°
CAT	CAS	CAH	HAH	179.2°	180.0°
CAS	CAT	CAK	HAK	178.1°	180.0°
CAW	CAV	CAI	HAI	179.1°	179.9°
CAV	CAW	CAJ	HAJ	178.8°	179.9°
CAW	CAV	NAM	HNAM	179.0°	180.0°
HAA	CAA	HAAA	HAAB	120.0°	119.9°
HAE	CAE	CAF	HAF	0.4°	0.2°
HAE	CAE	CAI	HAI	0.7°	0.2°
HAF	CAF	CAJ	HAJ	1.4°	0.1°
HAG	CAG	CAH	HAH	0.3°	0.3°

Definition date:	2011-07-26
Last modified:	2012-06-01
Release status:	REL
Processing site:	RCSB
Derived from:	3T0T