LLZ

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C	CA	sing	1.51Å	1.51Å
C	OXT	sing	1.34Å	1.43Å
N	HN	sing	1.01Å	1.00Å
N	HNA	sing	1.01Å	1.00Å
O	C	doub	1.21Å	1.23Å
C1	H1	sing	1.08Å	1.08Å
C2	C1	doub	1.36Å	1.39Å	Aromatic
C2	H2	sing	1.08Å	1.08Å
C3	C2	sing	1.40Å	1.39Å	Aromatic
O3	C3	sing	1.36Å	1.38Å
O3	C31	sing	1.43Å	1.43Å
C4	C3	doub	1.38Å	1.40Å	Aromatic
C4	C5	sing	1.40Å	1.40Å	Aromatic
C4	H4	sing	1.08Å	1.08Å
C5	C6	sing	1.42Å	1.40Å	Aromatic
C6	C1	sing	1.41Å	1.39Å	Aromatic
C6	C7	doub	1.40Å	1.39Å	Aromatic
C7	H7	sing	1.08Å	1.08Å
C8	C7	sing	1.39Å	1.40Å	Aromatic
C8	C11	sing	1.47Å	1.51Å
C9	C8	doub	1.41Å	1.40Å	Aromatic
C9	H9	sing	1.08Å	1.08Å
CA	N	sing	1.47Å	1.47Å
CA	CB	sing	1.53Å	1.53Å
CA	HA	sing	1.09Å	1.10Å
CB	CG	sing	1.53Å	1.53Å
CB	HB	sing	1.09Å	1.10Å
CB	HBA	sing	1.09Å	1.10Å
CD	CE	sing	1.53Å	1.52Å
CD	HD	sing	1.09Å	1.10Å
CD	HDA	sing	1.09Å	1.10Å
CE	NZ	sing	1.47Å	1.45Å
CE	HE	sing	1.09Å	1.10Å
CE	HEA	sing	1.09Å	1.10Å
CG	CD	sing	1.53Å	1.52Å
CG	HG	sing	1.09Å	1.10Å
CG	HGA	sing	1.09Å	1.10Å
NZ	C13	sing	1.47Å	1.45Å
NZ	HNZ	sing	1.01Å	1.00Å
C10	C5	doub	1.41Å	1.39Å	Aromatic
C10	C9	sing	1.36Å	1.40Å	Aromatic
C10	H10	sing	1.08Å	1.08Å
C11	O1	doub	1.21Å	1.23Å
C12	C11	sing	1.51Å	1.51Å
C12	H12	sing	1.09Å	1.10Å
C12	H12A	sing	1.09Å	1.10Å
C13	C12	sing	1.53Å	1.53Å
C13	C14	sing	1.53Å	1.53Å
C13	H13	sing	1.09Å	1.10Å
C14	H14	sing	1.09Å	1.10Å
C14	H14A	sing	1.09Å	1.10Å
C14	H14B	sing	1.09Å	1.10Å
C31	H31	sing	1.09Å	1.10Å
C31	H31A	sing	1.09Å	1.10Å
C31	H31B	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)
CA	C	OXT	119.8°	120.0°
CA	C	O	120.4°	120.0°
C	CA	N	110.3°	109.5°
C	CA	CB	108.6°	109.5°
C	CA	HA	110.4°	109.5°
OXT	C	O	119.8°	120.0°
C	OXT	HXT	109.5°	117.0°
HN	N	HNA	109.5°	111.0°
HN	N	CA	109.5°	111.0°
HNA	N	CA	109.4°	111.0°
H1	C1	C2	119.9°	120.0°
H1	C1	C6	119.9°	120.1°
C1	C2	H2	119.8°	119.6°
C1	C2	C3	120.3°	120.9°
C2	C1	C6	120.2°	119.9°
H2	C2	C3	119.9°	119.5°
C2	C3	O3	119.2°	119.6°
C2	C3	C4	119.8°	120.7°
C3	O3	C31	122.7°	117.0°
O3	C3	C4	121.0°	119.6°
O3	C31	H31	109.5°	109.4°
O3	C31	H31A	109.5°	109.5°
O3	C31	H31B	109.4°	109.4°
C3	C4	C5	119.9°	119.6°
C3	C4	H4	120.1°	120.2°
C5	C4	H4	120.1°	120.2°
C4	C5	C6	119.8°	119.4°
C4	C5	C10	120.9°	120.9°
C5	C6	C1	120.1°	119.5°
C5	C6	C7	120.8°	119.5°
C6	C5	C10	119.3°	119.8°
C1	C6	C7	119.1°	121.0°
C6	C7	H7	120.1°	120.2°
C6	C7	C8	119.9°	119.5°
H7	C7	C8	120.1°	120.3°
C7	C8	C11	119.1°	119.8°
C7	C8	C9	119.4°	120.5°
C11	C8	C9	121.5°	119.8°
C8	C11	O1	118.7°	120.0°
C8	C11	C12	121.5°	120.0°
C8	C9	H9	119.6°	119.6°
C8	C9	C10	120.8°	120.8°
H9	C9	C10	119.6°	119.6°
N	CA	CB	111.9°	109.5°
N	CA	HA	107.0°	109.5°
CB	CA	HA	108.7°	109.4°
CA	CB	CG	112.5°	109.5°
CA	CB	HB	108.5°	109.5°
CA	CB	HBA	108.5°	109.5°
CG	CB	HB	108.5°	109.4°
CG	CB	HBA	108.5°	109.4°
CB	CG	CD	113.8°	109.5°
CB	CG	HG	108.1°	109.4°
CB	CG	HGA	108.1°	109.5°
HB	CB	HBA	110.5°	109.5°
CE	CD	HD	108.9°	109.5°
CE	CD	HDA	108.9°	109.5°
CD	CE	NZ	110.6°	109.5°
CD	CE	HE	109.1°	109.5°
CD	CE	HEA	109.1°	109.5°
CE	CD	CG	111.3°	109.5°
HD	CD	HDA	110.1°	109.4°
HD	CD	CG	108.9°	109.5°
HDA	CD	CG	108.8°	109.5°
NZ	CE	HE	109.1°	109.5°
NZ	CE	HEA	109.1°	109.5°
CE	NZ	C13	122.6°	111.0°
CE	NZ	HNZ	105.3°	111.0°
HE	CE	HEA	109.8°	109.5°
CD	CG	HG	108.1°	109.5°
CD	CG	HGA	108.1°	109.5°
HG	CG	HGA	110.8°	109.5°
C13	NZ	HNZ	105.3°	111.0°
NZ	C13	C12	111.5°	109.5°
NZ	C13	C14	108.2°	109.4°
NZ	C13	H13	109.8°	109.4°
C5	C10	C9	119.8°	120.0°
C5	C10	H10	120.1°	120.0°
C9	C10	H10	120.1°	120.0°
O1	C11	C12	119.8°	120.0°
C11	C12	H12	108.9°	109.5°
C11	C12	H12A	108.9°	109.5°
C11	C12	C13	111.2°	109.4°
H12	C12	H12A	110.0°	109.5°
H12	C12	C13	108.9°	109.5°
H12A	C12	C13	108.9°	109.5°
C12	C13	C14	111.8°	109.4°
C12	C13	H13	106.0°	109.5°
C14	C13	H13	109.5°	109.5°
C13	C14	H14	109.5°	109.5°
C13	C14	H14A	109.5°	109.5°
C13	C14	H14B	109.5°	109.6°
H14	C14	H14A	109.5°	109.4°
H14	C14	H14B	109.4°	109.5°
H14A	C14	H14B	109.5°	109.5°
H31	C31	H31A	109.5°	109.5°
H31	C31	H31B	109.5°	109.5°
H31A	C31	H31B	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CA	C	OXT	O	180.0°	179.7°
C	CA	N	HN	180.0°	64.0°
C	CA	N	HNA	60.0°	60.0°
C	CA	N	CB	121.0°	120.0°
C	CA	N	HA	120.0°	120.0°
C	CA	CB	HA	120.1°	120.0°
C	CA	CB	CG	179.0°	175.0°
C	CA	CB	HB	61.0°	65.0°
C	CA	CB	HBA	59.0°	55.0°
CA	C	OXT	HXT	180.0°	180.0°
OXT	C	CA	N	125.9°	160.0°
OXT	C	CA	CB	111.1°	80.0°
OXT	C	CA	HA	7.9°	40.0°
HN	N	HNA	CA	120.0°	124.0°
HN	N	CA	CB	59.0°	176.0°
HN	N	CA	HA	60.0°	56.1°
HNA	N	CA	CB	179.0°	60.0°
HNA	N	CA	HA	60.0°	179.9°
O	C	CA	N	54.0°	20.3°
O	C	CA	CB	68.9°	99.7°
O	C	CA	HA	172.0°	140.3°
O	C	OXT	HXT	0.0°	0.3°
H1	C1	C2	C6	180.0°	179.7°
H1	C1	C2	H2	0.5°	0.0°
H1	C1	C2	C3	179.5°	180.0°
H1	C1	C6	C5	180.0°	179.7°
H1	C1	C6	C7	0.1°	0.3°
C1	C2	H2	C3	180.0°	180.0°
C1	C2	C3	O3	179.7°	180.0°
C1	C2	C3	C4	0.6°	0.0°
C2	C1	C6	C5	0.0°	0.6°
C2	C1	C6	C7	179.9°	180.0°
H2	C2	C3	O3	0.3°	0.0°
H2	C2	C3	C4	179.4°	180.0°
H2	C2	C1	C6	179.5°	179.7°
C2	C3	O3	C4	179.1°	180.0°
C2	C3	O3	C31	57.3°	0.1°
C2	C3	C4	C5	0.4°	0.0°
C2	C3	C4	H4	179.7°	180.0°
C3	C2	C1	C6	0.5°	0.3°
O3	C3	C4	C5	179.4°	180.0°
O3	C3	C4	H4	0.6°	0.0°
C3	O3	C31	H31	180.0°	60.0°
C3	O3	C31	H31A	60.0°	60.0°
C3	O3	C31	H31B	60.0°	180.0°
C31	O3	C3	C4	123.6°	180.0°
O3	C31	H31	H31A	120.0°	120.0°
O3	C31	H31	H31B	120.0°	119.9°
O3	C31	H31A	H31B	120.0°	120.0°
C3	C4	C5	H4	180.0°	180.0°
C3	C4	C5	C6	0.1°	0.3°
C3	C4	C5	C10	180.0°	180.0°
C4	C5	C6	C10	179.9°	179.7°
C4	C5	C6	C1	0.2°	0.6°
C4	C5	C6	C7	179.9°	180.0°
C4	C5	C10	C9	179.9°	179.7°
C4	C5	C10	H10	0.1°	0.0°
H4	C4	C5	C6	179.9°	179.7°
H4	C4	C5	C10	0.0°	0.0°
C5	C6	C1	C7	179.9°	179.4°
C5	C6	C7	H7	179.7°	180.0°
C5	C6	C7	C8	0.3°	0.0°
C6	C5	C10	C9	0.0°	0.5°
C6	C5	C10	H10	180.0°	179.7°
C1	C6	C7	H7	0.4°	0.6°
C1	C6	C7	C8	179.6°	179.4°
C1	C6	C5	C10	179.9°	179.7°
C6	C7	H7	C8	180.0°	180.0°
C6	C7	C8	C11	179.1°	180.0°
C6	C7	C8	C9	0.5°	0.1°
C7	C6	C5	C10	0.1°	0.3°
H7	C7	C8	C11	0.9°	0.0°
H7	C7	C8	C9	179.5°	179.9°
C7	C8	C11	C9	178.6°	179.9°
C7	C8	C9	H9	179.6°	180.0°
C7	C8	C9	C10	0.4°	0.2°
C7	C8	C11	O1	41.5°	0.0°
C7	C8	C11	C12	139.6°	180.0°
C11	C8	C9	H9	1.0°	0.1°
C11	C8	C9	C10	179.0°	179.7°
C8	C11	O1	C12	178.9°	179.9°
C8	C11	C12	H12	5.0°	60.0°
C8	C11	C12	H12A	115.0°	60.0°
C8	C11	C12	C13	125.0°	180.0°
C8	C9	H9	C10	180.0°	179.8°
C8	C9	C10	C5	0.2°	0.5°
C8	C9	C10	H10	179.8°	179.8°
C9	C8	C11	O1	137.1°	179.9°
C9	C8	C11	C12	41.8°	0.0°
H9	C9	C10	C5	179.8°	179.7°
H9	C9	C10	H10	0.2°	0.0°
N	CA	CB	HA	117.9°	120.0°
N	CA	CB	CG	59.0°	65.0°
N	CA	CB	HB	61.0°	55.0°
N	CA	CB	HBA	179.0°	175.0°
CA	CB	CG	HB	120.0°	120.0°
CA	CB	CG	HBA	120.0°	120.0°
CA	CB	HB	HBA	118.8°	120.0°
CA	CB	CG	CD	48.3°	180.0°
CA	CB	CG	HG	71.7°	60.0°
CA	CB	CG	HGA	168.3°	59.9°
HA	CA	CB	CG	58.9°	55.0°
HA	CA	CB	HB	178.9°	175.0°
HA	CA	CB	HBA	61.0°	65.0°
CG	CB	HB	HBA	118.8°	120.0°
CB	CG	CD	CE	89.8°	180.0°
CB	CG	CD	HD	150.3°	59.9°
CB	CG	CD	HDA	30.3°	60.0°
CB	CG	CD	HG	120.0°	119.9°
CB	CG	CD	HGA	120.0°	120.0°
CB	CG	HG	HGA	118.2°	120.0°
HB	CB	CG	CD	168.3°	60.0°
HB	CB	CG	HG	48.3°	180.0°
HB	CB	CG	HGA	71.7°	60.1°
HBA	CB	CG	CD	71.7°	60.0°
HBA	CB	CG	HG	168.3°	60.0°
HBA	CB	CG	HGA	48.3°	180.0°
CE	CD	HD	HDA	119.3°	120.0°
CE	CD	HD	CG	121.5°	120.0°
CE	CD	HDA	CG	121.5°	120.0°
CD	CE	NZ	HE	120.0°	120.0°
CD	CE	NZ	HEA	120.0°	120.0°
CD	CE	HE	HEA	119.5°	120.0°
CE	CD	CG	HG	150.3°	60.1°
CE	CD	CG	HGA	30.3°	60.0°
CD	CE	NZ	C13	114.8°	180.0°
CD	CE	NZ	HNZ	125.2°	56.0°
HD	CD	HDA	CG	119.3°	120.0°
HD	CD	CE	NZ	29.6°	60.0°
HD	CD	CE	HE	90.4°	60.0°
HD	CD	CE	HEA	149.6°	180.0°
HD	CD	CG	HG	30.3°	60.0°
HD	CD	CG	HGA	89.7°	180.0°
HDA	CD	CE	NZ	90.4°	60.0°
HDA	CD	CE	HE	149.6°	180.0°
HDA	CD	CE	HEA	29.6°	60.0°
HDA	CD	CG	HG	89.7°	179.9°
HDA	CD	CG	HGA	150.3°	60.0°
NZ	CE	HE	HEA	119.5°	120.0°
NZ	CE	CD	CG	149.6°	180.0°
CE	NZ	C13	HNZ	120.0°	123.9°
CE	NZ	C13	C12	48.9°	155.0°
CE	NZ	C13	C14	172.3°	85.0°
CE	NZ	C13	H13	68.3°	35.0°
HE	CE	CD	CG	29.6°	60.0°
HE	CE	NZ	C13	5.2°	60.0°
HE	CE	NZ	HNZ	114.8°	176.0°
HEA	CE	CD	CG	90.4°	60.0°
HEA	CE	NZ	C13	125.2°	60.0°
HEA	CE	NZ	HNZ	5.2°	64.0°
CD	CG	HG	HGA	118.2°	120.1°
NZ	C13	C12	C11	155.6°	65.0°
NZ	C13	C12	H12	35.6°	55.0°
NZ	C13	C12	H12A	84.4°	175.0°
NZ	C13	C12	C14	121.2°	120.0°
NZ	C13	C12	H13	119.5°	120.0°
NZ	C13	C14	H13	119.6°	120.0°
NZ	C13	C14	H14	180.0°	179.9°
NZ	C13	C14	H14A	60.0°	60.1°
NZ	C13	C14	H14B	60.0°	60.0°
HNZ	NZ	C13	C12	168.9°	81.0°
HNZ	NZ	C13	C14	67.7°	38.9°
HNZ	NZ	C13	H13	51.7°	159.0°
C5	C10	C9	H10	180.0°	179.7°
O1	C11	C12	H12	176.1°	120.0°
O1	C11	C12	H12A	63.9°	119.9°
O1	C11	C12	C13	56.1°	0.0°
C11	C12	H12	H12A	119.3°	120.0°
C11	C12	H12	C13	121.4°	119.9°
C11	C12	H12A	C13	121.4°	120.0°
C11	C12	C13	C14	83.1°	175.1°
C11	C12	C13	H13	36.2°	55.0°
H12	C12	H12A	C13	119.3°	120.0°
H12	C12	C13	C14	156.9°	65.0°
H12	C12	C13	H13	83.9°	175.0°
H12A	C12	C13	C14	36.9°	55.1°
H12A	C12	C13	H13	156.2°	65.0°
C12	C13	C14	H13	117.2°	120.0°
C12	C13	C14	H14	56.8°	60.1°
C12	C13	C14	H14A	176.8°	180.0°
C12	C13	C14	H14B	63.1°	60.0°
C13	C14	H14	H14A	120.0°	119.9°
C13	C14	H14	H14B	120.0°	120.1°
C13	C14	H14A	H14B	120.0°	120.1°
H13	C13	C14	H14	60.4°	59.9°
H13	C13	C14	H14A	59.6°	59.9°
H13	C13	C14	H14B	179.6°	179.9°
H14	C14	H14A	H14B	119.9°	120.0°
H31	C31	H31A	H31B	120.0°	120.0°

Definition date:	2010-06-23
Last modified:	2011-06-24
Release status:	REL
Processing site:	RCSB
Derived from:	3NL8