Z89

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CA	C	sing	1.51Å	1.53Å
C	OXT	doub	1.21Å	1.27Å
C	O	sing	1.34Å	1.27Å
CAW	N	sing	1.34Å	1.37Å
N	CAM	sing	1.32Å	1.35Å
N	CA	sing	1.47Å	1.51Å
O	HO	sing	0.97Å	0.95Å
CA	CB	sing	1.53Å	1.54Å
CA	HA	sing	1.09Å	1.10Å
CB	CG	sing	1.51Å	1.53Å
CB	HB	sing	1.09Å	1.10Å
CB	HBA	sing	1.09Å	1.10Å
OD2	CG	doub	1.21Å	1.25Å
CG	OD1	sing	1.34Å	1.26Å
NAJ	CAA	sing	1.39Å	1.36Å
CAA	CAB	doub	1.40Å	1.39Å	Aromatic
CAA	CAG	sing	1.39Å	1.38Å	Aromatic
CAH	CAB	sing	1.48Å	1.39Å
CAB	CAC	sing	1.39Å	1.40Å	Aromatic
CAC	CAD	doub	1.38Å	1.40Å	Aromatic
CAC	HAC	sing	1.08Å	1.08Å
CAF	CAD	sing	1.39Å	1.39Å	Aromatic
CAD	BRAE	sing	1.89Å	1.92Å
CAG	CAF	doub	1.38Å	1.39Å	Aromatic
CAF	HAF	sing	1.08Å	1.08Å
CAG	HAG	sing	1.08Å	1.08Å
CAI	CAH	sing	1.48Å	1.38Å
CAL	CAH	doub	1.38Å	1.42Å
OAK	CAI	doub	1.22Å	1.28Å
CAI	NAJ	sing	1.34Å	1.34Å
NAJ	HNAJ	sing	0.97Å	1.00Å
SAY	CAL	sing	1.77Å	1.77Å
CAL	CAM	sing	1.48Å	1.43Å
CAM	OAZ	doub	1.22Å	1.31Å
SAY	CAW	sing	1.77Å	1.78Å
SAX	CAW	doub	1.71Å	1.78Å
OD1	HOD1	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CA	C	OXT	121.7°	120.0°
CA	C	O	117.9°	120.0°
C	CA	N	101.0°	109.5°
C	CA	CB	106.6°	109.4°
C	CA	HA	119.4°	109.5°
OXT	C	O	120.4°	120.0°
C	O	HO	109.5°	117.0°
CAW	N	CAM	106.0°	119.7°
CAW	N	CA	125.5°	120.2°
N	CAW	SAY	121.1°	107.1°
N	CAW	SAX	116.7°	126.4°
CAM	N	CA	128.3°	120.1°
N	CAM	CAL	116.2°	114.6°
N	CAM	OAZ	118.8°	122.7°
N	CA	CB	117.3°	109.5°
N	CA	HA	109.3°	109.5°
CB	CA	HA	103.9°	109.5°
CA	CB	CG	111.0°	109.4°
CA	CB	HB	109.0°	109.4°
CA	CB	HBA	109.0°	109.5°
CG	CB	HB	109.0°	109.4°
CG	CB	HBA	109.0°	109.5°
CB	CG	OD2	118.4°	120.0°
CB	CG	OD1	120.9°	120.0°
HB	CB	HBA	110.0°	109.5°
OD2	CG	OD1	120.7°	120.0°
CG	OD1	HOD1	109.5°	117.1°
NAJ	CAA	CAB	111.1°	109.3°
NAJ	CAA	CAG	132.1°	131.6°
CAA	NAJ	CAI	105.5°	111.4°
CAA	NAJ	HNAJ	127.2°	124.3°
CAB	CAA	CAG	116.8°	119.1°
CAA	CAB	CAH	105.2°	106.4°
CAA	CAB	CAC	121.6°	120.4°
CAA	CAG	CAF	122.2°	120.1°
CAA	CAG	HAG	118.9°	120.0°
CAH	CAB	CAC	133.2°	133.2°
CAB	CAH	CAI	106.9°	105.0°
CAB	CAH	CAL	125.5°	127.5°
CAB	CAC	CAD	120.7°	119.7°
CAB	CAC	HAC	119.6°	120.2°
CAD	CAC	HAC	119.6°	120.1°
CAC	CAD	CAF	117.0°	120.1°
CAC	CAD	BRAE	123.4°	120.0°
CAF	CAD	BRAE	119.6°	120.0°
CAD	CAF	CAG	121.6°	120.6°
CAD	CAF	HAF	119.2°	119.7°
CAG	CAF	HAF	119.2°	119.7°
CAF	CAG	HAG	118.9°	119.9°
CAI	CAH	CAL	127.6°	127.5°
CAH	CAI	OAK	126.3°	126.1°
CAH	CAI	NAJ	111.3°	107.9°
CAH	CAL	SAY	124.4°	128.0°
CAH	CAL	CAM	122.6°	128.0°
OAK	CAI	NAJ	122.4°	126.0°
CAI	NAJ	HNAJ	127.2°	124.4°
SAY	CAL	CAM	113.1°	104.0°
CAL	SAY	CAW	83.6°	94.6°
CAL	CAM	OAZ	124.9°	122.7°
SAY	CAW	SAX	122.1°	126.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CA	C	OXT	O	178.6°	179.7°
C	CA	N	CAW	61.9°	60.3°
C	CA	N	CAM	112.3°	120.0°
C	CA	N	CB	115.4°	120.0°
C	CA	N	HA	126.8°	120.0°
CA	C	O	HO	178.6°	179.8°
C	CA	CB	HA	127.1°	120.0°
C	CA	CB	CG	74.3°	175.0°
C	CA	CB	HB	45.7°	55.0°
C	CA	CB	HBA	165.7°	65.0°
OXT	C	CA	N	152.2°	0.0°
OXT	C	O	HO	0.0°	0.0°
OXT	C	CA	CB	84.7°	120.0°
OXT	C	CA	HA	32.5°	120.0°
O	C	CA	N	26.4°	179.7°
O	C	CA	CB	96.7°	59.7°
O	C	CA	HA	146.1°	60.3°
CAW	N	CAM	CA	175.1°	179.7°
CAW	N	CA	CB	177.3°	59.7°
CAW	N	CA	HA	64.9°	179.7°
N	CAW	SAY	CAL	1.4°	0.1°
CAW	N	CAM	CAL	1.6°	0.3°
CAW	N	CAM	OAZ	179.7°	179.7°
N	CAW	SAY	SAX	178.4°	179.9°
CAM	N	CA	CB	3.0°	120.0°
CAM	N	CA	HA	120.9°	0.0°
N	CAM	CAL	CAH	178.9°	180.0°
N	CAM	CAL	SAY	0.7°	0.4°
N	CAM	CAL	OAZ	177.9°	180.0°
CAM	N	CAW	SAY	2.0°	0.1°
CAM	N	CAW	SAX	179.5°	180.0°
N	CA	CB	HA	120.7°	120.0°
N	CA	CB	CG	173.5°	65.1°
N	CA	CB	HB	66.5°	175.0°
N	CA	CB	HBA	53.5°	54.9°
CA	N	CAM	CAL	176.7°	180.0°
CA	N	CAM	OAZ	5.2°	0.0°
CA	N	CAW	SAY	177.3°	179.7°
CA	N	CAW	SAX	4.2°	0.4°
CA	CB	CG	HB	120.0°	119.9°
CA	CB	CG	HBA	120.0°	120.0°
CA	CB	HB	HBA	119.4°	120.0°
CA	CB	CG	OD2	65.2°	0.0°
CA	CB	CG	OD1	113.5°	180.0°
HA	CA	CB	CG	52.8°	55.0°
HA	CA	CB	HB	172.8°	64.9°
HA	CA	CB	HBA	67.2°	175.0°
CG	CB	HB	HBA	119.4°	120.0°
CB	CG	OD2	OD1	178.8°	180.0°
CB	CG	OD1	HOD1	178.7°	179.9°
HB	CB	CG	OD2	174.8°	120.0°
HB	CB	CG	OD1	6.5°	60.1°
HBA	CB	CG	OD2	54.8°	120.0°
HBA	CB	CG	OD1	126.5°	60.0°
OD2	CG	OD1	HOD1	0.0°	0.0°
NAJ	CAA	CAB	CAG	179.8°	179.8°
NAJ	CAA	CAB	CAH	0.4°	0.2°
NAJ	CAA	CAB	CAC	179.2°	179.8°
NAJ	CAA	CAG	CAF	179.0°	179.7°
NAJ	CAA	CAG	HAG	1.0°	0.2°
CAA	NAJ	CAI	CAH	0.8°	0.4°
CAA	NAJ	CAI	OAK	179.7°	179.9°
CAA	NAJ	CAI	HNAJ	180.0°	179.7°
CAA	CAB	CAH	CAC	178.6°	180.0°
CAA	CAB	CAC	CAD	0.5°	0.1°
CAA	CAB	CAC	HAC	179.5°	180.0°
CAB	CAA	CAG	CAF	0.7°	0.0°
CAB	CAA	CAG	HAG	179.2°	180.0°
CAA	CAB	CAH	CAI	0.1°	0.0°
CAA	CAB	CAH	CAL	179.9°	180.0°
CAB	CAA	NAJ	CAI	0.8°	0.4°
CAB	CAA	NAJ	HNAJ	179.2°	179.9°
CAG	CAA	CAB	CAH	179.4°	180.0°
CAG	CAA	CAB	CAC	0.6°	0.0°
CAA	CAG	CAF	CAD	0.8°	0.0°
CAA	CAG	CAF	HAG	180.0°	180.0°
CAA	CAG	CAF	HAF	179.2°	180.0°
CAG	CAA	NAJ	CAI	179.0°	179.8°
CAG	CAA	NAJ	HNAJ	1.0°	0.1°
CAH	CAB	CAC	CAD	178.9°	180.0°
CAH	CAB	CAC	HAC	1.1°	0.1°
CAB	CAH	CAI	CAL	179.9°	179.9°
CAB	CAH	CAI	OAK	180.0°	180.0°
CAB	CAH	CAI	NAJ	0.6°	0.3°
CAB	CAH	CAL	SAY	179.8°	171.1°
CAB	CAH	CAL	CAM	0.3°	9.3°
CAB	CAC	CAD	HAC	180.0°	179.9°
CAB	CAC	CAD	CAF	0.6°	0.1°
CAB	CAC	CAD	BRAE	179.4°	180.0°
CAC	CAB	CAH	CAI	178.5°	179.9°
CAC	CAB	CAH	CAL	1.6°	0.0°
CAC	CAD	CAF	BRAE	180.0°	179.9°
CAC	CAD	CAF	CAG	0.7°	0.1°
CAC	CAD	CAF	HAF	179.3°	180.0°
HAC	CAC	CAD	CAF	179.5°	180.0°
HAC	CAC	CAD	BRAE	0.5°	0.1°
CAD	CAF	CAG	HAF	180.0°	180.0°
CAD	CAF	CAG	HAG	179.2°	180.0°
BRAE	CAD	CAF	CAG	179.3°	180.0°
BRAE	CAD	CAF	HAF	0.7°	0.1°
HAF	CAF	CAG	HAG	0.8°	0.0°
CAH	CAI	OAK	NAJ	179.4°	179.6°
CAH	CAI	NAJ	HNAJ	179.2°	179.9°
CAI	CAH	CAL	SAY	0.3°	8.9°
CAI	CAH	CAL	CAM	179.8°	170.6°
CAL	CAH	CAI	OAK	0.1°	0.1°
CAL	CAH	CAI	NAJ	179.4°	179.8°
CAH	CAL	SAY	CAM	179.6°	179.6°
CAH	CAL	CAM	OAZ	0.9°	0.0°
CAH	CAL	SAY	CAW	179.9°	179.9°
OAK	CAI	NAJ	HNAJ	0.3°	0.2°
SAY	CAL	CAM	OAZ	178.6°	179.7°
CAL	SAY	CAW	SAX	179.8°	179.8°
CAM	CAL	SAY	CAW	0.3°	0.3°

Definition date:	2010-01-24
Last modified:	2020-06-17
Release status:	REL
Processing site:	RCSB
Derived from:	3LBZ