SR3

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O	C	doub	1.21Å	1.24Å
C	CA	sing	1.51Å	1.54Å
C	OXT	sing	1.34Å	1.24Å
CA	N	sing	1.47Å	1.47Å
N	CAL	sing	1.36Å	1.47Å
N	HN	sing	0.97Å	1.00Å
CB	CA	sing	1.53Å	1.55Å
CA	HA	sing	1.09Å	1.10Å
SAT	CB	sing	1.81Å	1.83Å
CG	CB	sing	1.51Å	1.56Å
CB	CAA	sing	1.53Å	1.54Å
OD1	CG	doub	1.21Å	1.23Å
CG	OD2	sing	1.34Å	1.37Å
CAA	HAA	sing	1.09Å	1.10Å
CAA	HAAA	sing	1.09Å	1.10Å
CAA	HAAB	sing	1.09Å	1.10Å
NAB	CAP	sing	1.35Å	1.34Å
NAB	HNAB	sing	0.97Å	1.00Å
NAB	HNAA	sing	0.97Å	1.00Å
CAJ	OAC	doub	1.22Å	1.22Å
OAD	CAP	doub	1.21Å	1.23Å
SAT	OAG	sing	1.66Å	1.49Å
OAG	HOAG	sing	0.97Å	0.95Å
OAH	SAT	sing	1.66Å	1.50Å
OAH	HOAH	sing	0.97Å	0.95Å
CAK	CAJ	sing	1.40Å	1.50Å
CAJ	HAJ	sing	1.08Å	1.08Å
CAL	CAK	doub	1.36Å	1.33Å
CAK	HAK	sing	1.08Å	1.08Å
CAL	HAL	sing	1.08Å	1.08Å
CAP	CAM	sing	1.51Å	1.53Å
CAM	OD2	sing	1.45Å	1.47Å
CAM	HAM	sing	1.09Å	1.10Å
CAM	HAMA	sing	1.09Å	1.10Å
OXT	HOXT	sing	0.97Å	0.95Å
SAT	HSAT	sing	1.41Å	1.30Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O	C	CA	118.0°	120.0°
O	C	OXT	125.1°	120.0°
CA	C	OXT	116.8°	120.0°
C	CA	N	108.8°	109.5°
C	CA	CB	114.7°	109.5°
C	CA	HA	106.1°	109.5°
C	OXT	HOXT	109.5°	117.0°
CA	N	CAL	115.7°	120.0°
CA	N	HN	107.4°	120.0°
N	CA	CB	108.5°	109.5°
N	CA	HA	112.5°	109.5°
CAL	N	HN	107.5°	120.0°
N	CAL	CAK	124.7°	120.0°
N	CAL	HAL	117.7°	120.0°
CB	CA	HA	106.3°	109.5°
CA	CB	SAT	112.5°	109.4°
CA	CB	CG	113.2°	109.5°
CA	CB	CAA	109.1°	109.5°
SAT	CB	CG	106.7°	109.5°
SAT	CB	CAA	106.3°	109.5°
CB	SAT	OAG	109.7°	90.0°
CB	SAT	OAH	109.8°	179.9°
CB	SAT	HSAT	108.8°	90.0°
CG	CB	CAA	108.8°	109.5°
CB	CG	OD1	119.3°	120.0°
CB	CG	OD2	123.4°	120.0°
CB	CAA	HAA	109.5°	109.5°
CB	CAA	HAAA	109.5°	109.5°
CB	CAA	HAAB	109.5°	109.5°
OD1	CG	OD2	117.3°	120.0°
CG	OD2	CAM	115.6°	117.0°
HAA	CAA	HAAA	109.4°	109.4°
HAA	CAA	HAAB	109.5°	109.5°
HAAA	CAA	HAAB	109.5°	109.4°
CAP	NAB	HNAB	120.0°	120.0°
CAP	NAB	HNAA	120.0°	119.9°
NAB	CAP	OAD	122.9°	120.0°
NAB	CAP	CAM	118.7°	120.0°
HNAB	NAB	HNAA	120.0°	120.0°
OAC	CAJ	CAK	122.1°	120.0°
OAC	CAJ	HAJ	118.9°	120.0°
OAD	CAP	CAM	118.4°	120.0°
SAT	OAG	HOAG	109.5°	114.0°
OAG	SAT	OAH	108.7°	90.0°
OAG	SAT	HSAT	110.0°	120.0°
SAT	OAH	HOAH	109.5°	113.9°
OAH	SAT	HSAT	109.9°	90.0°
CAK	CAJ	HAJ	118.9°	120.0°
CAJ	CAK	CAL	118.0°	120.0°
CAJ	CAK	HAK	121.0°	120.0°
CAL	CAK	HAK	121.0°	120.0°
CAK	CAL	HAL	117.6°	120.0°
CAP	CAM	OD2	117.0°	109.5°
CAP	CAM	HAM	107.1°	109.5°
CAP	CAM	HAMA	107.0°	109.5°
OD2	CAM	HAM	107.0°	109.5°
OD2	CAM	HAMA	107.0°	109.5°
HAM	CAM	HAMA	111.8°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O	C	CA	OXT	177.3°	179.7°
O	C	CA	N	58.1°	24.9°
O	C	CA	CB	63.6°	95.1°
O	C	CA	HA	179.4°	144.9°
O	C	OXT	HOXT	0.0°	0.3°
C	CA	N	CB	125.4°	120.0°
C	CA	N	HA	117.2°	120.0°
C	CA	N	CAL	69.3°	85.0°
C	CA	N	HN	170.7°	94.9°
C	CA	CB	HA	116.9°	120.0°
C	CA	CB	SAT	47.8°	60.7°
C	CA	CB	CG	73.3°	179.3°
C	CA	CB	CAA	165.4°	59.3°
CA	C	OXT	HOXT	177.1°	180.0°
OXT	C	CA	N	119.2°	154.8°
OXT	C	CA	CB	119.1°	85.2°
OXT	C	CA	HA	2.1°	34.8°
CA	N	CAL	HN	120.0°	179.9°
N	CA	CB	HA	121.3°	120.0°
N	CA	CB	SAT	169.6°	59.3°
N	CA	CB	CG	48.6°	60.7°
N	CA	CB	CAA	72.7°	179.3°
CA	N	CAL	CAK	16.9°	180.0°
CA	N	CAL	HAL	163.0°	0.1°
CAL	N	CA	CB	165.3°	155.0°
CAL	N	CA	HA	47.9°	35.0°
N	CAL	CAK	CAJ	179.9°	180.0°
N	CAL	CAK	HAL	180.0°	179.9°
N	CAL	CAK	HAK	0.1°	0.1°
HN	N	CA	CB	45.3°	25.1°
HN	N	CA	HA	72.1°	145.1°
HN	N	CAL	CAK	103.0°	0.1°
HN	N	CAL	HAL	77.0°	179.9°
CA	CB	SAT	CG	124.7°	120.0°
CA	CB	SAT	CAA	119.4°	120.0°
CA	CB	CG	CAA	121.5°	120.0°
CA	CB	CG	OD1	178.1°	11.7°
CA	CB	CG	OD2	0.7°	168.2°
CA	CB	CAA	HAA	180.0°	60.0°
CA	CB	CAA	HAAA	60.0°	180.0°
CA	CB	CAA	HAAB	60.0°	60.0°
CA	CB	SAT	OAG	33.6°	180.0°
CA	CB	SAT	OAH	153.0°	143.2°
CA	CB	SAT	HSAT	86.7°	60.0°
HA	CA	CB	SAT	69.1°	179.3°
HA	CA	CB	CG	169.8°	59.3°
HA	CA	CB	CAA	48.6°	60.7°
SAT	CB	CG	CAA	114.3°	120.0°
SAT	CB	CG	OD1	57.6°	131.7°
SAT	CB	CG	OD2	123.6°	48.2°
SAT	CB	CAA	HAA	58.5°	60.0°
SAT	CB	CAA	HAAA	178.5°	60.0°
SAT	CB	CAA	HAAB	61.5°	180.0°
CB	SAT	OAG	OAH	120.0°	180.0°
CB	SAT	OAG	HSAT	119.7°	90.0°
CB	SAT	OAG	HOAG	180.0°	90.0°
CB	SAT	OAH	HSAT	119.7°	83.2°
CB	SAT	OAH	HOAH	180.0°	143.2°
CB	CG	OD1	OD2	178.9°	179.9°
CG	CB	CAA	HAA	56.0°	180.0°
CG	CB	CAA	HAAA	64.0°	60.0°
CG	CB	CAA	HAAB	176.1°	60.0°
CG	CB	SAT	OAG	158.3°	60.0°
CG	CB	SAT	OAH	82.3°	96.8°
CB	CG	OD2	CAM	106.6°	180.0°
CG	CB	SAT	HSAT	38.0°	180.0°
CAA	CB	CG	OD1	56.6°	108.3°
CAA	CB	CG	OD2	122.2°	71.8°
CB	CAA	HAA	HAAA	120.0°	120.0°
CB	CAA	HAA	HAAB	120.0°	120.0°
CB	CAA	HAAA	HAAB	120.0°	120.0°
CAA	CB	SAT	OAG	85.7°	60.0°
CAA	CB	SAT	OAH	33.6°	23.2°
CAA	CB	SAT	HSAT	153.9°	60.0°
OD1	CG	OD2	CAM	74.6°	0.1°
CG	OD2	CAM	CAP	77.3°	180.0°
CG	OD2	CAM	HAM	162.7°	60.0°
CG	OD2	CAM	HAMA	42.7°	60.0°
HAA	CAA	HAAA	HAAB	120.0°	120.0°
CAP	NAB	HNAB	HNAA	180.0°	180.0°
NAB	CAP	OAD	CAM	179.9°	179.9°
NAB	CAP	CAM	OD2	161.9°	180.0°
NAB	CAP	CAM	HAM	78.1°	60.0°
NAB	CAP	CAM	HAMA	41.9°	60.1°
HNAB	NAB	CAP	OAD	0.0°	0.0°
HNAB	NAB	CAP	CAM	179.9°	180.0°
HNAA	NAB	CAP	OAD	180.0°	180.0°
HNAA	NAB	CAP	CAM	0.1°	0.1°
OAC	CAJ	CAK	HAJ	180.0°	180.0°
OAC	CAJ	CAK	CAL	34.4°	180.0°
OAC	CAJ	CAK	HAK	145.6°	0.0°
OAD	CAP	CAM	OD2	18.2°	0.0°
OAD	CAP	CAM	HAM	101.7°	120.0°
OAD	CAP	CAM	HAMA	138.2°	120.0°
OAG	SAT	OAH	HSAT	120.4°	120.0°
OAG	SAT	OAH	HOAH	60.1°	180.0°
HOAG	OAG	SAT	OAH	60.0°	90.0°
HOAG	OAG	SAT	HSAT	60.3°	180.0°
HOAH	OAH	SAT	HSAT	60.3°	60.0°
CAJ	CAK	CAL	HAK	180.0°	180.0°
CAJ	CAK	CAL	HAL	0.1°	0.0°
HAJ	CAJ	CAK	CAL	145.6°	0.0°
HAJ	CAJ	CAK	HAK	34.3°	180.0°
HAK	CAK	CAL	HAL	179.9°	180.0°
CAP	CAM	OD2	HAM	120.0°	120.0°
CAP	CAM	OD2	HAMA	120.0°	120.0°
CAP	CAM	HAM	HAMA	116.9°	120.0°
OD2	CAM	HAM	HAMA	116.9°	120.0°

Definition date:	2011-05-12
Last modified:	2012-03-16
Release status:	REL
Processing site:	RCSB
Derived from:	3RXW