A1IGU5_Q7Z6J4.1
contacts (residues)
Receptor
R: Secondary Structure
R: Residue
R; Chain
R: Residue number
Ligand
L: Secondary Structure
L: Residue
L: Chain
L: Residue Number
R
H
TYR
A
302
L
H
GLN
V
170
R
H
TYR
A
302
L
H
ASP
V
174
R
-
PHE
A
303
L
H
GLN
V
108
R
-
PHE
A
303
L
H
GLN
V
170
R
-
PHE
A
303
L
H
LEU
V
173
R
-
TYR
A
308
L
H
LYS
V
104
R
-
TYR
A
308
L
H
LEU
V
173
R
-
TYR
A
308
L
H
ASP
V
174
R
-
TYR
A
308
L
-
ASP
V
175
R
-
TYR
A
308
L
-
TRP
V
176
R
-
TYR
A
308
L
-
THR
V
177
R
-
ASN
A
309
L
-
THR
V
177
R
-
LEU
A
310
L
-
GLN
V
100
R
-
LEU
A
310
L
H
LYS
V
104
R
-
ILE
A
312
L
-
THR
V
99
R
H
PRO
A
316
L
-
SER
V
97
R
H
PHE
A
478
L
-
ALA
V
265
R
-
LEU
A
491
L
H
GLN
V
274
R
-
PRO
A
492
L
H
ASP
V
278
R
-
GLY
A
493
L
H
PHE
V
281
R
-
GLY
A
493
L
H
GLN
V
285
R
H
SER
A
494
L
H
PHE
V
281
R
H
ARG
A
496
L
H
GLN
V
285
R
H
GLN
A
497
L
H
PHE
V
281
R
H
GLN
A
497
L
H
GLN
V
285
R
-
ASN
A
516
L
H
GLN
V
261
R
-
ILE
A
517
L
H
GLN
V
261
R
-
THR
A
522
L
H
LYS
V
87
R
-
LEU
A
523
L
H
GLU
V
83
R
-
ASP
A
524
L
H
GLU
V
83
R
-
ASP
A
524
L
H
ARG
V
86
R
-
LEU
A
525
L
H
GLU
V
83
R
-
LEU
A
525
L
H
ARG
V
86
R
-
THR
A
526
L
H
GLN
V
261
R
-
THR
A
526
L
H
ARG
V
86
R
-
LEU
A
527
L
H
GLN
V
261
R
-
PRO
A
528
L
H
GLN
V
261
R
-
GLN
A
531
L
H
LYS
V
257
R
-
GLY
A
554
L
H
SER
V
81
R
-
HIS
A
555
L
H
PRO
V
250
R
-
HIS
A
555
L
H
LEU
V
254
R
-
HIS
A
555
L
H
LEU
V
80
R
-
HIS
A
555
L
H
SER
V
81
R
S
ARG
A
556
L
H
SER
V
81
R
S
ARG
A
556
L
H
GLU
V
83
R
-
ASN
A
583
L
-
GLN
V
432
R
-
ASN
A
583
L
-
GLY
V
433
R
-
ASN
A
583
L
-
PRO
V
434
R
-
LYS
A
584
L
H
THR
V
426
R
-
LYS
A
584
L
H
ALA
V
429
R
-
LYS
A
584
L
H
ALA
V
430
R
-
VAL
A
598
L
-
ALA
V
27
R
-
PRO
A
599
L
-
ALA
V
27
R
-
SER
A
600
L
-
ALA
V
27
R
-
ILE
A
601
L
-
ALA
V
27
R
-
ILE
A
601
L
-
ALA
V
28
R
-
ILE
A
601
L
-
PRO
V
29
R
-
ILE
A
601
L
-
ARG
V
30
R
-
THR
A
603
L
-
ALA
V
28
R
-
GLN
A
606
L
-
ARG
V
30
R
S
ILE
A
631
L
-
LYS
V
140
R
S
LEU
A
632
L
-
LYS
V
140
R
S
GLU
A
633
L
-
LYS
V
140
R
-
GLN
A
635
L
H
SER
V
138
R
-
GLN
A
635
L
H
SER
V
139
R
-
LEU
A
668
L
-
GLY
V
31
A1IGU5_Q7Z6J4.1
contacts (residues & atoms)
Receptor
R: Secondary Structure
R: Atom
R: Residue
R; Chain
R: Residue number
Ligand
L: Secondary Structure
L; Atom
L: Residue
L: Chain
L: Residue Number
R
H
CD1
TYR
A
302
L
H
CG
GLN
V
170
R
H
CD1
TYR
A
302
L
H
CD
GLN
V
170
R
H
CD1
TYR
A
302
L
H
NE2
GLN
V
170
R
H
CD1
TYR
A
302
L
H
HG2
GLN
V
170
R
H
CD1
TYR
A
302
L
H
HE21
GLN
V
170
R
H
CE1
TYR
A
302
L
H
CG
GLN
V
170
R
H
CE1
TYR
A
302
L
H
CD
GLN
V
170
R
H
CE1
TYR
A
302
L
H
NE2
GLN
V
170
R
H
CE1
TYR
A
302
L
H
HG2
GLN
V
170
R
H
CE1
TYR
A
302
L
H
HG3
GLN
V
170
R
H
CE1
TYR
A
302
L
H
HE21
GLN
V
170
R
H
CE1
TYR
A
302
L
H
OD2
ASP
V
174
R
H
OH
TYR
A
302
L
H
CG
GLN
V
170
R
H
OH
TYR
A
302
L
H
HG2
GLN
V
170
R
H
OH
TYR
A
302
L
H
HG3
GLN
V
170
R
H
OH
TYR
A
302
L
H
OD2
ASP
V
174
R
H
CZ
TYR
A
302
L
H
CG
GLN
V
170
R
H
CZ
TYR
A
302
L
H
HG2
GLN
V
170
R
H
CZ
TYR
A
302
L
H
HG3
GLN
V
170
R
H
CZ
TYR
A
302
L
H
OD2
ASP
V
174
R
-
CD2
PHE
A
303
L
H
HE22
GLN
V
170
R
-
CD2
PHE
A
303
L
H
HD23
LEU
V
173
R
-
CE2
PHE
A
303
L
H
CD2
LEU
V
173
R
-
CE2
PHE
A
303
L
H
HD21
LEU
V
173
R
-
CE2
PHE
A
303
L
H
HD23
LEU
V
173
R
-
CZ
PHE
A
303
L
H
HE21
GLN
V
108
R
-
CZ
PHE
A
303
L
H
HD21
LEU
V
173
R
-
CA
TYR
A
308
L
H
HZ1
LYS
V
104
R
-
CA
TYR
A
308
L
-
OG1
THR
V
177
R
-
CA
TYR
A
308
L
-
HG1
THR
V
177
R
-
C
TYR
A
308
L
-
OG1
THR
V
177
R
-
C
TYR
A
308
L
-
HG1
THR
V
177
R
-
CB
TYR
A
308
L
H
NZ
LYS
V
104
R
-
CB
TYR
A
308
L
H
HZ1
LYS
V
104
R
-
CB
TYR
A
308
L
H
HZ2
LYS
V
104
R
-
CB
TYR
A
308
L
H
HZ3
LYS
V
104
R
-
CB
TYR
A
308
L
-
HG1
THR
V
177
R
-
CG
TYR
A
308
L
H
NZ
LYS
V
104
R
-
CG
TYR
A
308
L
H
HZ1
LYS
V
104
R
-
CG
TYR
A
308
L
H
HZ3
LYS
V
104
R
-
CG
TYR
A
308
L
H
O
LEU
V
173
R
-
CG
TYR
A
308
L
-
HB3
TRP
V
176
R
-
CG
TYR
A
308
L
-
HG1
THR
V
177
R
-
CD1
TYR
A
308
L
H
NZ
LYS
V
104
R
-
CD1
TYR
A
308
L
H
HZ1
LYS
V
104
R
-
CD1
TYR
A
308
L
H
HZ3
LYS
V
104
R
-
CD1
TYR
A
308
L
H
C
LEU
V
173
R
-
CD1
TYR
A
308
L
H
O
LEU
V
173
R
-
CD1
TYR
A
308
L
H
C
ASP
V
174
R
-
CD1
TYR
A
308
L
H
O
ASP
V
174
R
-
CD1
TYR
A
308
L
H
HA
ASP
V
174
R
-
CD1
TYR
A
308
L
-
N
TRP
V
176
R
-
CD1
TYR
A
308
L
-
CB
TRP
V
176
R
-
CD1
TYR
A
308
L
-
H
TRP
V
176
R
-
CD1
TYR
A
308
L
-
HB2
TRP
V
176
R
-
CD1
TYR
A
308
L
-
HB3
TRP
V
176
R
-
CD1
TYR
A
308
L
-
H
THR
V
177
R
-
CD1
TYR
A
308
L
-
HG1
THR
V
177
R
-
CD2
TYR
A
308
L
H
HZ1
LYS
V
104
R
-
CD2
TYR
A
308
L
H
O
LEU
V
173
R
-
CD2
TYR
A
308
L
H
HA
ASP
V
174
R
-
CE1
TYR
A
308
L
H
HZ1
LYS
V
104
R
-
CE1
TYR
A
308
L
H
CA
LEU
V
173
R
-
CE1
TYR
A
308
L
H
C
LEU
V
173
R
-
CE1
TYR
A
308
L
H
O
LEU
V
173
R
-
CE1
TYR
A
308
L
H
HA
LEU
V
173
R
-
CE1
TYR
A
308
L
H
HG
LEU
V
173
R
-
CE1
TYR
A
308
L
H
N
ASP
V
174
R
-
CE1
TYR
A
308
L
H
CA
ASP
V
174
R
-
CE1
TYR
A
308
L
H
C
ASP
V
174
R
-
CE1
TYR
A
308
L
H
O
ASP
V
174
R
-
CE1
TYR
A
308
L
H
HA
ASP
V
174
R
-
CE1
TYR
A
308
L
-
N
ASP
V
175
R
-
CE1
TYR
A
308
L
-
N
TRP
V
176
R
-
CE1
TYR
A
308
L
-
CB
TRP
V
176
R
-
CE1
TYR
A
308
L
-
H
TRP
V
176
R
-
CE1
TYR
A
308
L
-
HB2
TRP
V
176
R
-
CE1
TYR
A
308
L
-
HB3
TRP
V
176
R
-
CE2
TYR
A
308
L
H
C
LEU
V
173
R
-
CE2
TYR
A
308
L
H
O
LEU
V
173
R
-
CE2
TYR
A
308
L
H
HG
LEU
V
173
R
-
CE2
TYR
A
308
L
H
CA
ASP
V
174
R
-
CE2
TYR
A
308
L
H
HA
ASP
V
174
R
-
OH
TYR
A
308
L
H
CA
LEU
V
173
R
-
OH
TYR
A
308
L
H
C
LEU
V
173
R
-
OH
TYR
A
308
L
H
CB
LEU
V
173
R
-
OH
TYR
A
308
L
H
O
LEU
V
173
R
-
OH
TYR
A
308
L
H
HB2
LEU
V
173
R
-
OH
TYR
A
308
L
H
HG
LEU
V
173
R
-
OH
TYR
A
308
L
H
N
ASP
V
174
R
-
OH
TYR
A
308
L
H
CA
ASP
V
174
R
-
OH
TYR
A
308
L
H
C
ASP
V
174
R
-
OH
TYR
A
308
L
H
CB
ASP
V
174
R
-
OH
TYR
A
308
L
H
O
ASP
V
174
R
-
OH
TYR
A
308
L
H
CG
ASP
V
174
R
-
OH
TYR
A
308
L
H
OD1
ASP
V
174
R
-
OH
TYR
A
308
L
H
H
ASP
V
174
R
-
OH
TYR
A
308
L
H
HA
ASP
V
174
R
-
OH
TYR
A
308
L
H
HB2
ASP
V
174
R
-
OH
TYR
A
308
L
H
HB3
ASP
V
174
R
-
OH
TYR
A
308
L
-
N
ASP
V
175
R
-
OH
TYR
A
308
L
-
H
ASP
V
175
R
-
CZ
TYR
A
308
L
H
C
LEU
V
173
R
-
CZ
TYR
A
308
L
H
O
LEU
V
173
R
-
CZ
TYR
A
308
L
H
HG
LEU
V
173
R
-
CZ
TYR
A
308
L
H
N
ASP
V
174
R
-
CZ
TYR
A
308
L
H
CA
ASP
V
174
R
-
CZ
TYR
A
308
L
H
C
ASP
V
174
R
-
CZ
TYR
A
308
L
H
CB
ASP
V
174
R
-
CZ
TYR
A
308
L
H
O
ASP
V
174
R
-
CZ
TYR
A
308
L
H
OD1
ASP
V
174
R
-
CZ
TYR
A
308
L
H
H
ASP
V
174
R
-
CZ
TYR
A
308
L
H
HA
ASP
V
174
R
-
CZ
TYR
A
308
L
-
H
TRP
V
176
R
-
N
ASN
A
309
L
-
CB
THR
V
177
R
-
N
ASN
A
309
L
-
CG2
THR
V
177
R
-
N
ASN
A
309
L
-
OG1
THR
V
177
R
-
N
ASN
A
309
L
-
HG1
THR
V
177
R
-
N
ASN
A
309
L
-
HG21
THR
V
177
R
-
CA
ASN
A
309
L
-
CG2
THR
V
177
R
-
CA
ASN
A
309
L
-
OG1
THR
V
177
R
-
CA
ASN
A
309
L
-
HG21
THR
V
177
R
-
CA
ASN
A
309
L
-
HG23
THR
V
177
R
-
C
ASN
A
309
L
-
CG2
THR
V
177
R
-
C
ASN
A
309
L
-
OG1
THR
V
177
R
-
C
ASN
A
309
L
-
HG21
THR
V
177
R
-
C
ASN
A
309
L
-
HG23
THR
V
177
R
-
CB
ASN
A
309
L
-
CG2
THR
V
177
R
-
CB
ASN
A
309
L
-
OG1
THR
V
177
R
-
CB
ASN
A
309
L
-
HG21
THR
V
177
R
-
CB
ASN
A
309
L
-
HG23
THR
V
177
R
-
O
ASN
A
309
L
-
CB
THR
V
177
R
-
O
ASN
A
309
L
-
CG2
THR
V
177
R
-
O
ASN
A
309
L
-
OG1
THR
V
177
R
-
O
ASN
A
309
L
-
HA
THR
V
177
R
-
O
ASN
A
309
L
-
HG1
THR
V
177
R
-
O
ASN
A
309
L
-
HG21
THR
V
177
R
-
O
ASN
A
309
L
-
HG23
THR
V
177
R
-
CG
ASN
A
309
L
-
HG21
THR
V
177
R
-
ND2
ASN
A
309
L
-
HG21
THR
V
177
R
-
CD1
LEU
A
310
L
-
HA
GLN
V
100
R
-
CD1
LEU
A
310
L
-
HG2
GLN
V
100
R
-
CD2
LEU
A
310
L
-
HA
GLN
V
100
R
-
CD2
LEU
A
310
L
-
HG2
GLN
V
100
R
-
CD2
LEU
A
310
L
H
HZ2
LYS
V
104
R
-
CD2
LEU
A
310
L
H
HZ3
LYS
V
104
R
-
CD1
ILE
A
312
L
-
H
THR
V
99
R
H
CB
PRO
A
316
L
-
HG
SER
V
97
R
H
CE1
PHE
A
478
L
-
HB2
ALA
V
265
R
H
CE2
PHE
A
478
L
-
CB
ALA
V
265
R
H
CE2
PHE
A
478
L
-
HB2
ALA
V
265
R
H
CE2
PHE
A
478
L
-
HB3
ALA
V
265
R
H
CZ
PHE
A
478
L
-
CB
ALA
V
265
R
H
CZ
PHE
A
478
L
-
HB1
ALA
V
265
R
H
CZ
PHE
A
478
L
-
HB2
ALA
V
265
R
H
CZ
PHE
A
478
L
-
HB3
ALA
V
265
R
-
CD2
LEU
A
491
L
H
NE2
GLN
V
274
R
-
CD2
LEU
A
491
L
H
HE22
GLN
V
274
R
-
O
PRO
A
492
L
H
CG
ASP
V
278
R
-
O
PRO
A
492
L
H
OD1
ASP
V
278
R
-
O
PRO
A
492
L
H
HB3
ASP
V
278
R
-
CA
GLY
A
493
L
H
HD1
PHE
V
281
R
-
CA
GLY
A
493
L
H
HE1
PHE
V
281
R
-
C
GLY
A
493
L
H
CE1
PHE
V
281
R
-
C
GLY
A
493
L
H
HD1
PHE
V
281
R
-
C
GLY
A
493
L
H
HE1
PHE
V
281
R
-
O
GLY
A
493
L
H
CD1
PHE
V
281
R
-
O
GLY
A
493
L
H
CE1
PHE
V
281
R
-
O
GLY
A
493
L
H
CZ
PHE
V
281
R
-
O
GLY
A
493
L
H
HD1
PHE
V
281
R
-
O
GLY
A
493
L
H
HE1
PHE
V
281
R
-
O
GLY
A
493
L
H
HE22
GLN
V
285
R
H
N
SER
A
494
L
H
HE1
PHE
V
281
R
H
N
ARG
A
496
L
H
HE22
GLN
V
285
R
H
CA
ARG
A
496
L
H
HE22
GLN
V
285
R
H
C
ARG
A
496
L
H
HE22
GLN
V
285
R
H
CB
ARG
A
496
L
H
CD
GLN
V
285
R
H
CB
ARG
A
496
L
H
NE2
GLN
V
285
R
H
CB
ARG
A
496
L
H
OE1
GLN
V
285
R
H
CB
ARG
A
496
L
H
HE21
GLN
V
285
R
H
CB
ARG
A
496
L
H
HE22
GLN
V
285
R
H
CG
ARG
A
496
L
H
OE1
GLN
V
285
R
H
CG
ARG
A
496
L
H
HE22
GLN
V
285
R
H
CD
ARG
A
496
L
H
CD
GLN
V
285
R
H
CD
ARG
A
496
L
H
NE2
GLN
V
285
R
H
CD
ARG
A
496
L
H
OE1
GLN
V
285
R
H
CD
ARG
A
496
L
H
HB3
GLN
V
285
R
H
CD
ARG
A
496
L
H
HE22
GLN
V
285
R
H
NH1
ARG
A
496
L
H
OE1
GLN
V
285
R
H
NH1
ARG
A
496
L
H
HB2
GLN
V
285
R
H
NH1
ARG
A
496
L
H
HB3
GLN
V
285
R
H
N
GLN
A
497
L
H
HZ
PHE
V
281
R
H
N
GLN
A
497
L
H
NE2
GLN
V
285
R
H
N
GLN
A
497
L
H
HE21
GLN
V
285
R
H
N
GLN
A
497
L
H
HE22
GLN
V
285
R
H
CA
GLN
A
497
L
H
HZ
PHE
V
281
R
H
CB
GLN
A
497
L
H
CZ
PHE
V
281
R
H
CB
GLN
A
497
L
H
HZ
PHE
V
281
R
H
CG
GLN
A
497
L
H
HZ
PHE
V
281
R
H
CD
GLN
A
497
L
H
HE2
PHE
V
281
R
H
CD
GLN
A
497
L
H
HZ
PHE
V
281
R
H
OE1
GLN
A
497
L
H
CZ
PHE
V
281
R
H
OE1
GLN
A
497
L
H
HE2
PHE
V
281
R
H
OE1
GLN
A
497
L
H
HZ
PHE
V
281
R
-
CG
ASN
A
516
L
H
HG2
GLN
V
261
R
-
ND2
ASN
A
516
L
H
HG2
GLN
V
261
R
-
OD1
ASN
A
516
L
H
HG2
GLN
V
261
R
-
O
ILE
A
517
L
H
HE22
GLN
V
261
R
-
CB
THR
A
522
L
H
HZ1
LYS
V
87
R
-
CG2
THR
A
522
L
H
CE
LYS
V
87
R
-
CG2
THR
A
522
L
H
NZ
LYS
V
87
R
-
CG2
THR
A
522
L
H
HE3
LYS
V
87
R
-
CG2
THR
A
522
L
H
HZ1
LYS
V
87
R
-
CG2
THR
A
522
L
H
HZ2
LYS
V
87
R
-
OG1
THR
A
522
L
H
HZ1
LYS
V
87
R
-
N
LEU
A
523
L
H
OE2
GLU
V
83
R
-
N
LEU
A
523
L
H
HB2
GLU
V
83
R
-
CA
LEU
A
523
L
H
CD
GLU
V
83
R
-
CA
LEU
A
523
L
H
OE2
GLU
V
83
R
-
CA
LEU
A
523
L
H
HB2
GLU
V
83
R
-
C
LEU
A
523
L
H
CD
GLU
V
83
R
-
C
LEU
A
523
L
H
OE2
GLU
V
83
R
-
CB
LEU
A
523
L
H
OE2
GLU
V
83
R
-
O
LEU
A
523
L
H
CD
GLU
V
83
R
-
O
LEU
A
523
L
H
OE2
GLU
V
83
R
-
CG
LEU
A
523
L
H
HB2
GLU
V
83
R
-
CD2
LEU
A
523
L
H
CB
GLU
V
83
R
-
CD2
LEU
A
523
L
H
H
GLU
V
83
R
-
CD2
LEU
A
523
L
H
HB2
GLU
V
83
R
-
N
ASP
A
524
L
H
OE2
GLU
V
83
R
-
CA
ASP
A
524
L
H
OE2
GLU
V
83
R
-
C
ASP
A
524
L
H
CD
GLU
V
83
R
-
C
ASP
A
524
L
H
OE1
GLU
V
83
R
-
C
ASP
A
524
L
H
OE2
GLU
V
83
R
-
O
ASP
A
524
L
H
CD
GLU
V
83
R
-
O
ASP
A
524
L
H
OE1
GLU
V
83
R
-
O
ASP
A
524
L
H
OE2
GLU
V
83
R
-
O
ASP
A
524
L
H
NH2
ARG
V
86
R
-
O
ASP
A
524
L
H
CZ
ARG
V
86
R
-
O
ASP
A
524
L
H
HH21
ARG
V
86
R
-
O
ASP
A
524
L
H
HH22
ARG
V
86
R
-
N
LEU
A
525
L
H
OE1
GLU
V
83
R
-
N
LEU
A
525
L
H
OE2
GLU
V
83
R
-
CA
LEU
A
525
L
H
OE1
GLU
V
83
R
-
CA
LEU
A
525
L
H
HH21
ARG
V
86
R
-
CA
LEU
A
525
L
H
HH22
ARG
V
86
R
-
C
LEU
A
525
L
H
HH22
ARG
V
86
R
-
CB
LEU
A
525
L
H
OE1
GLU
V
83
R
-
CG
LEU
A
525
L
H
OE1
GLU
V
83
R
-
CD2
LEU
A
525
L
H
CG
GLU
V
83
R
-
CD2
LEU
A
525
L
H
CD
GLU
V
83
R
-
CD2
LEU
A
525
L
H
OE1
GLU
V
83
R
-
CD2
LEU
A
525
L
H
HG2
GLU
V
83
R
-
CD2
LEU
A
525
L
H
HG3
GLU
V
83
R
-
N
THR
A
526
L
H
NH2
ARG
V
86
R
-
N
THR
A
526
L
H
HH21
ARG
V
86
R
-
N
THR
A
526
L
H
HH22
ARG
V
86
R
-
CA
THR
A
526
L
H
HH22
ARG
V
86
R
-
C
THR
A
526
L
H
HE22
GLN
V
261
R
-
CB
THR
A
526
L
H
HH12
ARG
V
86
R
-
CB
THR
A
526
L
H
HH22
ARG
V
86
R
-
O
THR
A
526
L
H
HE22
GLN
V
261
R
-
CG2
THR
A
526
L
H
CD
GLN
V
261
R
-
CG2
THR
A
526
L
H
NE2
GLN
V
261
R
-
CG2
THR
A
526
L
H
OE1
GLN
V
261
R
-
CG2
THR
A
526
L
H
HE22
GLN
V
261
R
-
OG1
THR
A
526
L
H
HH12
ARG
V
86
R
-
OG1
THR
A
526
L
H
HH22
ARG
V
86
R
-
N
LEU
A
527
L
H
HE22
GLN
V
261
R
-
CA
LEU
A
527
L
H
HE22
GLN
V
261
R
-
C
LEU
A
527
L
H
NE2
GLN
V
261
R
-
C
LEU
A
527
L
H
HE21
GLN
V
261
R
-
C
LEU
A
527
L
H
HE22
GLN
V
261
R
-
O
LEU
A
527
L
H
NE2
GLN
V
261
R
-
O
LEU
A
527
L
H
HE22
GLN
V
261
R
-
N
PRO
A
528
L
H
NE2
GLN
V
261
R
-
N
PRO
A
528
L
H
HE21
GLN
V
261
R
-
N
PRO
A
528
L
H
HE22
GLN
V
261
R
-
CA
PRO
A
528
L
H
NE2
GLN
V
261
R
-
CA
PRO
A
528
L
H
HE21
GLN
V
261
R
-
CA
PRO
A
528
L
H
HE22
GLN
V
261
R
-
CB
PRO
A
528
L
H
NE2
GLN
V
261
R
-
CB
PRO
A
528
L
H
HE21
GLN
V
261
R
-
CG
PRO
A
528
L
H
HE21
GLN
V
261
R
-
CD
PRO
A
528
L
H
NE2
GLN
V
261
R
-
CD
PRO
A
528
L
H
HE21
GLN
V
261
R
-
CD
PRO
A
528
L
H
HE22
GLN
V
261
R
-
NE2
GLN
A
531
L
H
HZ2
LYS
V
257
R
-
NE2
GLN
A
531
L
H
HZ3
LYS
V
257
R
-
C
GLY
A
554
L
H
HA
SER
V
81
R
-
O
GLY
A
554
L
H
CA
SER
V
81
R
-
O
GLY
A
554
L
H
CB
SER
V
81
R
-
O
GLY
A
554
L
H
OG
SER
V
81
R
-
O
GLY
A
554
L
H
HA
SER
V
81
R
-
O
GLY
A
554
L
H
HB2
SER
V
81
R
-
CA
HIS
A
555
L
H
O
SER
V
81
R
-
CA
HIS
A
555
L
H
HA
SER
V
81
R
-
CA
HIS
A
555
L
H
HB2
SER
V
81
R
-
CB
HIS
A
555
L
H
O
SER
V
81
R
-
CB
HIS
A
555
L
H
HA
SER
V
81
R
-
CG
HIS
A
555
L
H
HA
SER
V
81
R
-
CD2
HIS
A
555
L
H
HD12
LEU
V
254
R
-
CD2
HIS
A
555
L
H
HD23
LEU
V
254
R
-
ND1
HIS
A
555
L
H
C
LEU
V
80
R
-
ND1
HIS
A
555
L
H
O
LEU
V
80
R
-
ND1
HIS
A
555
L
H
CA
SER
V
81
R
-
ND1
HIS
A
555
L
H
C
SER
V
81
R
-
ND1
HIS
A
555
L
H
O
SER
V
81
R
-
ND1
HIS
A
555
L
H
HA
SER
V
81
R
-
CE1
HIS
A
555
L
H
O
LEU
V
80
R
-
CE1
HIS
A
555
L
H
HA
SER
V
81
R
-
CE1
HIS
A
555
L
H
HB3
PRO
V
250
R
-
CE1
HIS
A
555
L
H
HD12
LEU
V
254
R
-
NE2
HIS
A
555
L
H
HB3
PRO
V
250
R
-
NE2
HIS
A
555
L
H
HD12
LEU
V
254
R
-
NE2
HIS
A
555
L
H
HD23
LEU
V
254
R
S
N
ARG
A
556
L
H
O
SER
V
81
R
S
N
ARG
A
556
L
H
HB2
SER
V
81
R
S
O
ARG
A
556
L
H
O
SER
V
81
R
S
O
ARG
A
556
L
H
HG2
GLU
V
83
R
-
CG
ASN
A
583
L
-
H
GLY
V
433
R
-
CG
ASN
A
583
L
-
HA2
GLY
V
433
R
-
CG
ASN
A
583
L
-
HA3
GLY
V
433
R
-
ND2
ASN
A
583
L
-
N
GLY
V
433
R
-
ND2
ASN
A
583
L
-
CA
GLY
V
433
R
-
ND2
ASN
A
583
L
-
H
GLY
V
433
R
-
ND2
ASN
A
583
L
-
HA2
GLY
V
433
R
-
ND2
ASN
A
583
L
-
HA3
GLY
V
433
R
-
OD1
ASN
A
583
L
-
C
GLN
V
432
R
-
OD1
ASN
A
583
L
-
HA
GLN
V
432
R
-
OD1
ASN
A
583
L
-
N
GLY
V
433
R
-
OD1
ASN
A
583
L
-
CA
GLY
V
433
R
-
OD1
ASN
A
583
L
-
H
GLY
V
433
R
-
OD1
ASN
A
583
L
-
HA2
GLY
V
433
R
-
OD1
ASN
A
583
L
-
HA3
GLY
V
433
R
-
OD1
ASN
A
583
L
-
HD2
PRO
V
434
R
-
N
LYS
A
584
L
H
O
ALA
V
429
R
-
N
LYS
A
584
L
H
HA
ALA
V
430
R
-
CA
LYS
A
584
L
H
HA
ALA
V
430
R
-
CB
LYS
A
584
L
H
O
ALA
V
429
R
-
CB
LYS
A
584
L
H
CA
ALA
V
430
R
-
CB
LYS
A
584
L
H
C
ALA
V
430
R
-
CB
LYS
A
584
L
H
CB
ALA
V
430
R
-
CB
LYS
A
584
L
H
O
ALA
V
430
R
-
CB
LYS
A
584
L
H
HA
ALA
V
430
R
-
CB
LYS
A
584
L
H
HB1
ALA
V
430
R
-
CB
LYS
A
584
L
H
HB2
ALA
V
430
R
-
O
LYS
A
584
L
H
O
ALA
V
430
R
-
O
LYS
A
584
L
H
HA
ALA
V
430
R
-
CG
LYS
A
584
L
H
C
ALA
V
429
R
-
CG
LYS
A
584
L
H
O
ALA
V
429
R
-
CG
LYS
A
584
L
H
N
ALA
V
430
R
-
CG
LYS
A
584
L
H
CA
ALA
V
430
R
-
CG
LYS
A
584
L
H
HA
ALA
V
430
R
-
CG
LYS
A
584
L
H
HB2
ALA
V
430
R
-
CD
LYS
A
584
L
H
C
ALA
V
429
R
-
CD
LYS
A
584
L
H
O
ALA
V
429
R
-
CD
LYS
A
584
L
H
N
ALA
V
430
R
-
CD
LYS
A
584
L
H
CA
ALA
V
430
R
-
CD
LYS
A
584
L
H
CB
ALA
V
430
R
-
CD
LYS
A
584
L
H
H
ALA
V
430
R
-
CD
LYS
A
584
L
H
HA
ALA
V
430
R
-
CD
LYS
A
584
L
H
HB1
ALA
V
430
R
-
CD
LYS
A
584
L
H
HB2
ALA
V
430
R
-
CD
LYS
A
584
L
H
HB3
ALA
V
430
R
-
CE
LYS
A
584
L
H
HB2
ALA
V
429
R
-
CE
LYS
A
584
L
H
HA
ALA
V
430
R
-
CE
LYS
A
584
L
H
HB2
ALA
V
430
R
-
NZ
LYS
A
584
L
H
O
THR
V
426
R
-
NZ
LYS
A
584
L
H
CG2
THR
V
426
R
-
NZ
LYS
A
584
L
H
HA
THR
V
426
R
-
NZ
LYS
A
584
L
H
HG22
THR
V
426
R
-
NZ
LYS
A
584
L
H
HG23
THR
V
426
R
-
NZ
LYS
A
584
L
H
HB2
ALA
V
429
R
-
NZ
LYS
A
584
L
H
CB
ALA
V
430
R
-
NZ
LYS
A
584
L
H
HB2
ALA
V
430
R
-
CG1
VAL
A
598
L
-
HB2
ALA
V
27
R
-
CG1
VAL
A
598
L
-
HB3
ALA
V
27
R
-
C
PRO
A
599
L
-
HB1
ALA
V
27
R
-
C
PRO
A
599
L
-
HB3
ALA
V
27
R
-
O
PRO
A
599
L
-
CB
ALA
V
27
R
-
O
PRO
A
599
L
-
HB1
ALA
V
27
R
-
O
PRO
A
599
L
-
HB2
ALA
V
27
R
-
O
PRO
A
599
L
-
HB3
ALA
V
27
R
-
CA
SER
A
600
L
-
HB1
ALA
V
27
R
-
CA
SER
A
600
L
-
HB3
ALA
V
27
R
-
N
ILE
A
601
L
-
HB1
ALA
V
27
R
-
CB
ILE
A
601
L
-
O
ALA
V
28
R
-
CB
ILE
A
601
L
-
HB3
ARG
V
30
R
-
O
ILE
A
601
L
-
H
ALA
V
28
R
-
O
ILE
A
601
L
-
HB2
ALA
V
28
R
-
CG1
ILE
A
601
L
-
O
ALA
V
28
R
-
CG1
ILE
A
601
L
-
H
ARG
V
30
R
-
CG1
ILE
A
601
L
-
HB3
ARG
V
30
R
-
CG2
ILE
A
601
L
-
O
ALA
V
28
R
-
CG2
ILE
A
601
L
-
CB
ARG
V
30
R
-
CG2
ILE
A
601
L
-
HB3
ARG
V
30
R
-
CG2
ILE
A
601
L
-
HD2
ARG
V
30
R
-
CD1
ILE
A
601
L
-
O
ALA
V
28
R
-
CD1
ILE
A
601
L
-
C
PRO
V
29
R
-
CD1
ILE
A
601
L
-
HA
PRO
V
29
R
-
CD1
ILE
A
601
L
-
N
ARG
V
30
R
-
CD1
ILE
A
601
L
-
CA
ARG
V
30
R
-
CD1
ILE
A
601
L
-
CB
ARG
V
30
R
-
CD1
ILE
A
601
L
-
H
ARG
V
30
R
-
CD1
ILE
A
601
L
-
HB3
ARG
V
30
R
-
CB
THR
A
603
L
-
HB2
ALA
V
28
R
-
CB
THR
A
603
L
-
HB3
ALA
V
28
R
-
CG2
THR
A
603
L
-
CB
ALA
V
28
R
-
CG2
THR
A
603
L
-
HB1
ALA
V
28
R
-
CG2
THR
A
603
L
-
HB2
ALA
V
28
R
-
CG2
THR
A
603
L
-
HB3
ALA
V
28
R
-
NE2
GLN
A
606
L
-
HH22
ARG
V
30
R
S
O
ILE
A
631
L
-
HZ1
LYS
V
140
R
S
CA
LEU
A
632
L
-
NZ
LYS
V
140
R
S
CA
LEU
A
632
L
-
HZ1
LYS
V
140
R
S
CA
LEU
A
632
L
-
HZ3
LYS
V
140
R
S
C
LEU
A
632
L
-
NZ
LYS
V
140
R
S
C
LEU
A
632
L
-
HE2
LYS
V
140
R
S
C
LEU
A
632
L
-
HZ1
LYS
V
140
R
S
C
LEU
A
632
L
-
HZ2
LYS
V
140
R
S
C
LEU
A
632
L
-
HZ3
LYS
V
140
R
S
O
LEU
A
632
L
-
CD
LYS
V
140
R
S
O
LEU
A
632
L
-
CE
LYS
V
140
R
S
O
LEU
A
632
L
-
NZ
LYS
V
140
R
S
O
LEU
A
632
L
-
HD2
LYS
V
140
R
S
O
LEU
A
632
L
-
HE2
LYS
V
140
R
S
O
LEU
A
632
L
-
HE3
LYS
V
140
R
S
O
LEU
A
632
L
-
HZ1
LYS
V
140
R
S
O
LEU
A
632
L
-
HZ2
LYS
V
140
R
S
O
LEU
A
632
L
-
HZ3
LYS
V
140
R
S
N
GLU
A
633
L
-
HZ3
LYS
V
140
R
S
CG
GLU
A
633
L
-
HD2
LYS
V
140
R
-
CG
GLN
A
635
L
H
O
SER
V
138
R
-
CD
GLN
A
635
L
H
C
SER
V
138
R
-
CD
GLN
A
635
L
H
O
SER
V
138
R
-
CD
GLN
A
635
L
H
HB2
SER
V
138
R
-
CD
GLN
A
635
L
H
HA
SER
V
139
R
-
NE2
GLN
A
635
L
H
C
SER
V
138
R
-
NE2
GLN
A
635
L
H
O
SER
V
138
R
-
NE2
GLN
A
635
L
H
HB2
SER
V
138
R
-
NE2
GLN
A
635
L
H
N
SER
V
139
R
-
NE2
GLN
A
635
L
H
CA
SER
V
139
R
-
NE2
GLN
A
635
L
H
CB
SER
V
139
R
-
NE2
GLN
A
635
L
H
HA
SER
V
139
R
-
NE2
GLN
A
635
L
H
HB3
SER
V
139
R
-
OE1
GLN
A
635
L
H
C
SER
V
138
R
-
OE1
GLN
A
635
L
H
CB
SER
V
138
R
-
OE1
GLN
A
635
L
H
O
SER
V
138
R
-
OE1
GLN
A
635
L
H
HB2
SER
V
138
R
-
CD1
LEU
A
668
L
-
H
GLY
V
31
R
-
CD1
LEU
A
668
L
-
HA3
GLY
V
31