Obsolete: TNY

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C	O	doub	1.21Å	1.23Å
C	CA	sing	1.51Å	1.52Å
C	OXT	sing	1.34Å	1.43Å
N	CA	sing	1.47Å	1.47Å
N	H	sing	1.01Å	1.00Å
N	H2	sing	1.01Å	1.00Å
C1	C2	sing	1.53Å	1.53Å
C1	O5	sing	1.43Å	1.44Å
C1	OG1	sing	1.43Å	1.44Å
C1	H1	sing	1.09Å	1.10Å
C2	N2	sing	1.47Å	1.45Å
C2	C3	sing	1.53Å	1.52Å
C2	H9	sing	1.09Å	1.10Å
N2	C7	sing	1.35Å	1.33Å
N2	HN2	sing	0.97Å	1.00Å
C3	O3	sing	1.43Å	1.43Å
C3	C4	sing	1.53Å	1.51Å
C3	H3	sing	1.09Å	1.10Å
O3	HO3	sing	0.97Å	0.95Å
C4	O4	sing	1.43Å	1.44Å
C4	C5	sing	1.53Å	1.53Å
C4	H4	sing	1.09Å	1.10Å
O4	HO4	sing	0.97Å	0.95Å
C5	O5	sing	1.43Å	1.45Å
C5	C6	sing	1.53Å	1.52Å
C5	H5	sing	1.09Å	1.10Å
C6	O6	sing	1.43Å	1.43Å
C6	H6	sing	1.09Å	1.10Å
C6	H6A	sing	1.09Å	1.10Å
O6	HO6	sing	0.97Å	0.95Å
C7	O7	doub	1.21Å	1.23Å
C7	C8	sing	1.51Å	1.52Å
C8	H8	sing	1.09Å	1.10Å
C8	H8A	sing	1.09Å	1.10Å
C8	H8B	sing	1.09Å	1.10Å
CA	CB	sing	1.53Å	1.54Å
CA	HA	sing	1.09Å	1.10Å
CB	OG1	sing	1.43Å	1.45Å
CB	CG2	sing	1.53Å	1.54Å
CB	HB	sing	1.09Å	1.10Å
CG2	HG21	sing	1.09Å	1.10Å
CG2	HG22	sing	1.09Å	1.10Å
CG2	HG23	sing	1.09Å	1.10Å
OXT	HXT	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O	C	CA	120.4°	120.0°
O	C	OXT	119.8°	120.1°
CA	C	OXT	119.8°	120.0°
C	CA	N	109.1°	109.5°
C	CA	CB	112.0°	109.5°
C	CA	HA	107.1°	109.4°
C	OXT	HXT	109.5°	117.0°
CA	N	H	109.5°	111.0°
CA	N	H2	109.5°	111.0°
N	CA	CB	106.8°	109.5°
N	CA	HA	112.4°	109.4°
H	N	H2	109.5°	111.0°
C2	C1	O5	109.5°	109.4°
C2	C1	OG1	108.5°	109.5°
C2	C1	H1	109.8°	109.5°
C1	C2	N2	108.9°	109.6°
C1	C2	C3	109.8°	109.1°
C1	C2	H9	109.3°	109.5°
O5	C1	OG1	108.8°	109.5°
O5	C1	H1	109.6°	109.5°
C1	O5	C5	111.3°	114.1°
OG1	C1	H1	110.5°	109.4°
C1	OG1	CB	119.6°	114.0°
N2	C2	C3	108.4°	109.5°
N2	C2	H9	110.7°	109.5°
C2	N2	C7	118.5°	120.0°
C2	N2	HN2	120.8°	119.9°
C3	C2	H9	109.8°	109.5°
C2	C3	O3	110.1°	109.5°
C2	C3	C4	107.5°	109.1°
C2	C3	H3	110.9°	109.5°
C7	N2	HN2	120.8°	120.1°
N2	C7	O7	122.9°	120.0°
N2	C7	C8	115.3°	120.0°
O3	C3	C4	111.1°	109.5°
O3	C3	H3	107.3°	109.5°
C3	O3	HO3	109.5°	113.9°
C4	C3	H3	109.9°	109.6°
C3	C4	O4	109.1°	109.5°
C3	C4	C5	108.1°	109.2°
C3	C4	H4	110.9°	109.5°
O4	C4	C5	110.5°	109.5°
O4	C4	H4	108.6°	109.5°
C4	O4	HO4	109.5°	114.0°
C5	C4	H4	109.6°	109.6°
C4	C5	O5	112.1°	109.4°
C4	C5	C6	109.9°	109.5°
C4	C5	H5	107.4°	109.4°
O5	C5	C6	109.6°	109.5°
O5	C5	H5	107.7°	109.5°
C6	C5	H5	110.1°	109.5°
C5	C6	O6	110.1°	109.5°
C5	C6	H6	109.3°	109.5°
C5	C6	H6A	109.2°	109.5°
O6	C6	H6	109.3°	109.5°
O6	C6	H6A	109.2°	109.5°
C6	O6	HO6	109.5°	114.0°
H6	C6	H6A	109.7°	109.5°
O7	C7	C8	121.8°	120.0°
C7	C8	H8	109.5°	109.5°
C7	C8	H8A	109.5°	109.5°
C7	C8	H8B	109.5°	109.5°
H8	C8	H8A	109.4°	109.5°
H8	C8	H8B	109.5°	109.5°
H8A	C8	H8B	109.5°	109.4°
CB	CA	HA	109.5°	109.5°
CA	CB	OG1	115.8°	109.4°
CA	CB	CG2	111.5°	109.4°
CA	CB	HB	102.7°	109.5°
OG1	CB	CG2	106.8°	109.5°
OG1	CB	HB	107.8°	109.5°
CG2	CB	HB	112.4°	109.5°
CB	CG2	HG21	109.5°	109.5°
CB	CG2	HG22	109.5°	109.4°
CB	CG2	HG23	109.5°	109.5°
HG21	CG2	HG22	109.5°	109.5°
HG21	CG2	HG23	109.4°	109.5°
HG22	CG2	HG23	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O	C	CA	OXT	180.0°	179.7°
O	C	CA	N	14.6°	20.1°
O	C	CA	CB	103.5°	100.0°
O	C	CA	HA	136.4°	140.0°
O	C	OXT	HXT	0.0°	0.1°
C	CA	N	CB	121.3°	120.0°
C	CA	N	HA	118.6°	120.0°
C	CA	N	H	180.0°	63.9°
C	CA	N	H2	60.0°	60.0°
C	CA	CB	HA	118.7°	120.0°
C	CA	CB	OG1	58.1°	55.1°
C	CA	CB	CG2	179.6°	175.0°
C	CA	CB	HB	59.1°	65.0°
CA	C	OXT	HXT	180.0°	179.7°
OXT	C	CA	N	165.5°	160.3°
OXT	C	CA	CB	76.5°	79.7°
OXT	C	CA	HA	43.6°	40.3°
CA	N	H	H2	120.0°	123.9°
N	CA	CB	HA	121.9°	120.0°
N	CA	CB	OG1	61.3°	65.0°
N	CA	CB	CG2	61.0°	55.0°
N	CA	CB	HB	178.5°	175.0°
H	N	CA	CB	58.7°	176.1°
H	N	CA	HA	61.4°	56.1°
H2	N	CA	CB	178.7°	60.1°
H2	N	CA	HA	58.7°	179.9°
C2	C1	O5	OG1	118.5°	120.0°
C2	C1	O5	H1	120.5°	120.0°
C2	C1	OG1	H1	120.5°	120.0°
C1	C2	N2	C3	119.4°	119.7°
C1	C2	N2	H9	120.1°	120.2°
C1	C2	C3	H9	120.2°	119.9°
C1	C2	N2	C7	122.5°	85.0°
C1	C2	N2	HN2	57.5°	95.0°
C1	C2	C3	O3	177.9°	176.8°
C1	C2	C3	C4	60.9°	57.0°
C1	C2	C3	H3	59.2°	63.1°
C2	C1	O5	C5	58.4°	61.2°
C2	C1	OG1	CB	171.1°	170.0°
O5	C1	OG1	H1	120.4°	120.0°
O5	C1	C2	N2	178.9°	177.5°
O5	C1	C2	C3	60.4°	57.6°
O5	C1	C2	H9	60.1°	62.3°
C1	O5	C5	C4	58.8°	61.1°
C1	O5	C5	C6	178.9°	178.9°
C1	O5	C5	H5	59.2°	58.8°
O5	C1	OG1	CB	69.8°	70.1°
OG1	C1	C2	N2	60.2°	57.5°
OG1	C1	C2	C3	58.3°	62.4°
OG1	C1	C2	H9	178.8°	177.7°
OG1	C1	O5	C5	60.1°	58.8°
C1	OG1	CB	CA	86.6°	150.0°
C1	OG1	CB	CG2	148.6°	90.0°
C1	OG1	CB	HB	27.7°	30.0°
H1	C1	C2	N2	60.7°	62.5°
H1	C1	C2	C3	179.2°	177.6°
H1	C1	C2	H9	60.3°	57.7°
H1	C1	O5	C5	178.9°	178.8°
H1	C1	OG1	CB	50.6°	49.9°
N2	C2	C3	H9	121.0°	120.2°
C2	N2	C7	HN2	180.0°	179.9°
N2	C2	C3	O3	59.0°	63.2°
N2	C2	C3	C4	179.7°	176.9°
N2	C2	C3	H3	59.6°	56.9°
C2	N2	C7	O7	0.6°	0.0°
C2	N2	C7	C8	179.8°	180.0°
C3	C2	N2	C7	118.2°	155.3°
C3	C2	N2	HN2	61.8°	24.7°
C2	C3	O3	C4	119.0°	119.6°
C2	C3	O3	H3	120.8°	120.1°
C2	C3	C4	H3	120.8°	119.9°
C2	C3	O3	HO3	180.0°	179.9°
C2	C3	C4	O4	61.4°	62.9°
C2	C3	C4	C5	58.8°	57.0°
C2	C3	C4	H4	179.0°	177.0°
H9	C2	N2	C7	2.3°	35.2°
H9	C2	N2	HN2	177.7°	144.9°
H9	C2	C3	O3	62.0°	56.9°
H9	C2	C3	C4	59.2°	62.9°
H9	C2	C3	H3	179.4°	177.1°
N2	C7	O7	C8	179.6°	180.0°
N2	C7	C8	H8	179.6°	0.0°
N2	C7	C8	H8A	60.4°	120.0°
N2	C7	C8	H8B	59.6°	120.0°
HN2	N2	C7	O7	179.4°	180.0°
HN2	N2	C7	C8	0.2°	0.0°
O3	C3	C4	H3	118.6°	120.2°
O3	C3	C4	O4	59.2°	57.0°
O3	C3	C4	C5	179.4°	176.8°
O3	C3	C4	H4	60.4°	63.2°
C4	C3	O3	HO3	60.9°	60.5°
C3	C4	O4	C5	118.7°	119.7°
C3	C4	O4	H4	121.0°	120.1°
C3	C4	C5	H4	121.0°	120.0°
C3	C4	O4	HO4	180.0°	180.0°
C3	C4	C5	O5	58.7°	57.6°
C3	C4	C5	C6	179.2°	177.6°
C3	C4	C5	H5	59.5°	62.4°
H3	C3	O3	HO3	59.2°	59.8°
H3	C3	C4	O4	177.8°	177.2°
H3	C3	C4	C5	62.0°	63.0°
H3	C3	C4	H4	58.2°	57.0°
O4	C4	C5	H4	119.6°	120.2°
O4	C4	C5	O5	60.7°	62.3°
O4	C4	C5	C6	61.4°	57.7°
O4	C4	C5	H5	178.8°	177.7°
C5	C4	O4	HO4	61.3°	60.3°
C4	C5	O5	C6	122.3°	120.0°
C4	C5	O5	H5	118.0°	119.9°
C4	C5	C6	H5	118.1°	120.0°
C4	C5	C6	O6	59.7°	175.0°
C4	C5	C6	H6	60.3°	55.0°
C4	C5	C6	H6A	179.7°	65.0°
H4	C4	O4	HO4	59.0°	59.9°
H4	C4	C5	O5	179.7°	177.5°
H4	C4	C5	C6	58.2°	62.5°
H4	C4	C5	H5	61.5°	57.6°
O5	C5	C6	H5	118.3°	120.1°
O5	C5	C6	O6	176.7°	65.1°
O5	C5	C6	H6	63.3°	174.9°
O5	C5	C6	H6A	56.7°	54.9°
C5	C6	O6	H6	120.0°	120.0°
C5	C6	O6	H6A	120.0°	120.0°
C5	C6	H6	H6A	119.7°	120.0°
C5	C6	O6	HO6	180.0°	180.0°
H5	C5	C6	O6	58.4°	55.0°
H5	C5	C6	H6	178.4°	65.0°
H5	C5	C6	H6A	61.6°	175.0°
O6	C6	H6	H6A	119.7°	120.0°
H6	C6	O6	HO6	60.0°	60.0°
H6A	C6	O6	HO6	60.0°	60.0°
O7	C7	C8	H8	0.0°	180.0°
O7	C7	C8	H8A	120.0°	60.0°
O7	C7	C8	H8B	120.0°	60.0°
C7	C8	H8	H8A	120.0°	120.0°
C7	C8	H8	H8B	120.0°	120.0°
C7	C8	H8A	H8B	120.0°	120.0°
H8	C8	H8A	H8B	120.0°	120.0°
CA	CB	OG1	CG2	124.7°	119.9°
CA	CB	OG1	HB	114.3°	120.0°
CA	CB	CG2	HB	114.7°	120.0°
CA	CB	CG2	HG21	180.0°	60.0°
CA	CB	CG2	HG22	60.0°	179.9°
CA	CB	CG2	HG23	60.0°	60.0°
HA	CA	CB	OG1	176.8°	175.0°
HA	CA	CB	CG2	60.9°	65.0°
HA	CA	CB	HB	59.6°	55.0°
OG1	CB	CG2	HB	118.0°	120.0°
OG1	CB	CG2	HG21	52.7°	60.0°
OG1	CB	CG2	HG22	172.7°	60.0°
OG1	CB	CG2	HG23	67.3°	180.0°
CB	CG2	HG21	HG22	120.0°	119.9°
CB	CG2	HG21	HG23	120.0°	120.0°
CB	CG2	HG22	HG23	120.0°	120.0°
HB	CB	CG2	HG21	65.3°	180.0°
HB	CB	CG2	HG22	54.7°	60.1°
HB	CB	CG2	HG23	174.7°	59.9°
HG21	CG2	HG22	HG23	120.0°	120.0°

Definition date:	2009-07-25
Last modified:	2022-02-08
Release status:	OBS
Processing site:	RCSB
Derived from:	3IET