A1IGU5_Q8WYP3.1
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
-
LEU
A
368
L
H
GLU
V
150
R
-
LEU
A
368
L
H
ALA
V
151
R
-
LEU
A
368
L
H
PRO
V
154
R
-
GLU
A
369
L
H
GLU
V
150
R
-
GLU
A
369
L
H
ALA
V
151
R
-
GLU
A
369
L
H
PRO
V
154
R
-
ALA
A
370
L
H
GLY
V
147
R
-
ALA
A
370
L
H
GLU
V
150
R
-
ALA
A
370
L
H
ALA
V
151
R
-
ALA
A
370
L
H
PRO
V
154
R
-
GLU
A
371
L
H
GLU
V
150
R
-
GLY
A
372
L
H
GLN
V
146
R
-
GLY
A
372
L
H
GLU
V
150
R
-
GLY
A
373
L
H
ARG
V
143
R
-
ALA
A
374
L
H
ARG
V
143
R
-
LYS
A
375
L
H
PRO
V
139
R
-
LYS
A
375
L
H
ARG
V
143
R
-
THR
A
376
L
H
PRO
V
139
R
-
LEU
A
377
L
H
LYS
V
137
R
-
LEU
A
377
L
H
PRO
V
139
R
-
SER
A
378
L
H
LYS
V
137
R
-
GLY
A
379
L
H
LYS
V
137
R
-
LEU
A
429
L
-
PRO
V
313
R
-
LEU
A
429
L
-
GLU
V
314
R
-
SER
A
430
L
-
ILE
V
312
R
-
SER
A
430
L
-
PRO
V
313
R
-
SER
A
430
L
-
GLU
V
314
R
-
ASP
A
431
L
-
ILE
V
312
R
-
ASP
A
431
L
-
PRO
V
313
R
-
ASP
A
431
L
-
GLU
V
314
R
-
ASP
A
431
L
-
GLY
V
315
R
-
MET
A
432
L
-
ILE
V
312
R
-
MET
A
432
L
-
GLU
V
314
R
-
MET
A
432
L
-
GLY
V
315
R
-
MET
A
432
L
H
PRO
V
316
R
-
MET
A
432
L
H
ALA
V
317
R
-
SER
A
433
L
H
PRO
V
316
R
-
SER
A
433
L
-
HIS
V
448
R
-
ILE
A
434
L
H
PRO
V
316
R
-
ILE
A
434
L
-
HIS
V
448
R
-
ILE
A
434
L
H
PHE
V
456
R
-
ILE
A
434
L
H
LEU
V
459
R
-
ILE
A
434
L
H
VAL
V
460
R
-
ILE
A
434
L
H
ALA
V
463
R
-
SER
A
435
L
H
PHE
V
456
R
-
SER
A
435
L
H
VAL
V
460
R
-
THR
A
436
L
H
PHE
V
456
R
-
PHE
A
444
L
H
ASN
V
289
R
-
ASP
A
445
L
H
ASN
V
289
R
-
GLN
A
470
L
H
ARG
V
338
R
-
GLN
A
470
L
H
THR
V
426
R
-
ALA
A
474
L
H
ARG
V
338
R
-
ILE
A
477
L
H
GLU
V
340
R
-
ILE
A
477
L
H
GLY
V
341
R
-
ILE
A
477
L
H
GLN
V
345
R
-
SER
A
485
L
H
TYR
V
302
R
-
SER
A
486
L
H
TYR
V
302
R
-
PHE
A
487
L
H
TYR
V
302
R
-
PHE
A
487
L
-
TYR
V
308
R
-
VAL
A
488
L
H
TYR
V
302
R
-
VAL
A
488
L
-
TYR
V
308
R
-
LEU
A
489
L
H
GLU
V
307
R
-
LEU
A
489
L
-
TYR
V
308
R
-
PRO
A
490
L
-
ARG
V
304
R
-
PRO
A
490
L
H
GLU
V
307
R
-
LYS
A
491
L
-
ARG
V
304
R
-
LYS
A
491
L
H
GLU
V
307
R
-
LEU
A
492
L
H
HIS
V
306
R
-
LEU
A
492
L
H
ARG
V
325
R
-
LEU
A
492
L
H
LEU
V
329
R
-
VAL
A
493
L
H
ARG
V
325
R
-
VAL
A
493
L
H
LEU
V
329
R
-
LYS
A
494
L
H
LEU
V
329
R
-
LYS
A
494
L
H
GLU
V
330
R
-
LYS
A
494
L
H
LEU
V
333
R
-
SER
A
495
L
H
ARG
V
325
R
-
GLN
A
496
L
H
ASP
V
326
R
-
LEU
A
497
L
H
ASP
V
326
R
-
LEU
A
497
L
H
GLU
V
330
R
-
LEU
A
497
L
H
ARG
V
438
R
-
VAL
A
500
L
H
GLY
V
441
R
H
PHE
A
504
L
H
GLN
V
437
R
H
PHE
A
504
L
H
GLU
V
440
A1IGU5_Q8WYP3.1
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
-
CA
LEU
A
368
L
H
HG2
PRO
V
154
R
-
C
LEU
A
368
L
H
O
ALA
V
151
R
-
C
LEU
A
368
L
H
HA
ALA
V
151
R
-
C
LEU
A
368
L
H
HG2
PRO
V
154
R
-
C
LEU
A
368
L
H
HG3
PRO
V
154
R
-
CB
LEU
A
368
L
H
CG
PRO
V
154
R
-
CB
LEU
A
368
L
H
HG2
PRO
V
154
R
-
CB
LEU
A
368
L
H
HG3
PRO
V
154
R
-
O
LEU
A
368
L
H
O
GLU
V
150
R
-
O
LEU
A
368
L
H
CA
ALA
V
151
R
-
O
LEU
A
368
L
H
C
ALA
V
151
R
-
O
LEU
A
368
L
H
O
ALA
V
151
R
-
O
LEU
A
368
L
H
HA
ALA
V
151
R
-
O
LEU
A
368
L
H
CG
PRO
V
154
R
-
O
LEU
A
368
L
H
HG2
PRO
V
154
R
-
O
LEU
A
368
L
H
HG3
PRO
V
154
R
-
O
LEU
A
368
L
H
HD2
PRO
V
154
R
-
CG
LEU
A
368
L
H
HG2
PRO
V
154
R
-
CD1
LEU
A
368
L
H
HG2
PRO
V
154
R
-
N
GLU
A
369
L
H
HA
ALA
V
151
R
-
N
GLU
A
369
L
H
HG3
PRO
V
154
R
-
CA
GLU
A
369
L
H
HA
ALA
V
151
R
-
CA
GLU
A
369
L
H
HG3
PRO
V
154
R
-
C
GLU
A
369
L
H
O
GLU
V
150
R
-
C
GLU
A
369
L
H
HA
ALA
V
151
R
-
C
GLU
A
369
L
H
CG
PRO
V
154
R
-
C
GLU
A
369
L
H
HB3
PRO
V
154
R
-
C
GLU
A
369
L
H
HG3
PRO
V
154
R
-
O
GLU
A
369
L
H
O
GLU
V
150
R
-
O
GLU
A
369
L
H
CB
PRO
V
154
R
-
O
GLU
A
369
L
H
CG
PRO
V
154
R
-
O
GLU
A
369
L
H
HB3
PRO
V
154
R
-
O
GLU
A
369
L
H
HG2
PRO
V
154
R
-
O
GLU
A
369
L
H
HG3
PRO
V
154
R
-
N
ALA
A
370
L
H
C
GLU
V
150
R
-
N
ALA
A
370
L
H
O
GLU
V
150
R
-
N
ALA
A
370
L
H
HB3
GLU
V
150
R
-
N
ALA
A
370
L
H
N
ALA
V
151
R
-
N
ALA
A
370
L
H
CA
ALA
V
151
R
-
N
ALA
A
370
L
H
HA
ALA
V
151
R
-
N
ALA
A
370
L
H
HG3
PRO
V
154
R
-
CA
ALA
A
370
L
H
C
GLU
V
150
R
-
CA
ALA
A
370
L
H
CB
GLU
V
150
R
-
CA
ALA
A
370
L
H
O
GLU
V
150
R
-
CA
ALA
A
370
L
H
HB3
GLU
V
150
R
-
CA
ALA
A
370
L
H
HA
PRO
V
154
R
-
CA
ALA
A
370
L
H
HB3
PRO
V
154
R
-
C
ALA
A
370
L
H
CB
GLU
V
150
R
-
C
ALA
A
370
L
H
CD
GLU
V
150
R
-
C
ALA
A
370
L
H
OE2
GLU
V
150
R
-
C
ALA
A
370
L
H
HB2
GLU
V
150
R
-
C
ALA
A
370
L
H
HB3
GLU
V
150
R
-
CB
ALA
A
370
L
H
CA
GLU
V
150
R
-
CB
ALA
A
370
L
H
C
GLU
V
150
R
-
CB
ALA
A
370
L
H
CB
GLU
V
150
R
-
CB
ALA
A
370
L
H
O
GLU
V
150
R
-
CB
ALA
A
370
L
H
CG
GLU
V
150
R
-
CB
ALA
A
370
L
H
HA
GLU
V
150
R
-
CB
ALA
A
370
L
H
HB2
GLU
V
150
R
-
CB
ALA
A
370
L
H
HB3
GLU
V
150
R
-
CB
ALA
A
370
L
H
HG3
GLU
V
150
R
-
CB
ALA
A
370
L
H
CA
PRO
V
154
R
-
CB
ALA
A
370
L
H
CB
PRO
V
154
R
-
CB
ALA
A
370
L
H
HA
PRO
V
154
R
-
CB
ALA
A
370
L
H
HB3
PRO
V
154
R
-
CB
ALA
A
370
L
H
HG3
PRO
V
154
R
-
O
ALA
A
370
L
H
HA2
GLY
V
147
R
-
O
ALA
A
370
L
H
CA
GLU
V
150
R
-
O
ALA
A
370
L
H
C
GLU
V
150
R
-
O
ALA
A
370
L
H
CB
GLU
V
150
R
-
O
ALA
A
370
L
H
CG
GLU
V
150
R
-
O
ALA
A
370
L
H
CD
GLU
V
150
R
-
O
ALA
A
370
L
H
OE2
GLU
V
150
R
-
O
ALA
A
370
L
H
HB2
GLU
V
150
R
-
O
ALA
A
370
L
H
HB3
GLU
V
150
R
-
O
ALA
A
370
L
H
HG3
GLU
V
150
R
-
N
GLU
A
371
L
H
OE2
GLU
V
150
R
-
N
GLU
A
371
L
H
HB3
GLU
V
150
R
-
CA
GLU
A
371
L
H
OE2
GLU
V
150
R
-
C
GLU
A
371
L
H
CD
GLU
V
150
R
-
C
GLU
A
371
L
H
OE2
GLU
V
150
R
-
O
GLU
A
371
L
H
CD
GLU
V
150
R
-
O
GLU
A
371
L
H
OE1
GLU
V
150
R
-
O
GLU
A
371
L
H
OE2
GLU
V
150
R
-
N
GLY
A
372
L
H
OE2
GLU
V
150
R
-
CA
GLY
A
372
L
H
OE2
GLU
V
150
R
-
C
GLY
A
372
L
H
HG2
GLN
V
146
R
-
C
GLY
A
372
L
H
OE2
GLU
V
150
R
-
O
GLY
A
372
L
H
CG
GLN
V
146
R
-
O
GLY
A
372
L
H
HB3
GLN
V
146
R
-
O
GLY
A
372
L
H
HG2
GLN
V
146
R
-
O
GLY
A
372
L
H
HG3
GLN
V
146
R
-
O
GLY
A
372
L
H
CD
GLU
V
150
R
-
O
GLY
A
372
L
H
OE1
GLU
V
150
R
-
O
GLY
A
372
L
H
OE2
GLU
V
150
R
-
N
GLY
A
373
L
H
HG3
ARG
V
143
R
-
N
ALA
A
374
L
H
NE
ARG
V
143
R
-
N
ALA
A
374
L
H
HG3
ARG
V
143
R
-
N
ALA
A
374
L
H
HE
ARG
V
143
R
-
CA
ALA
A
374
L
H
NE
ARG
V
143
R
-
CA
ALA
A
374
L
H
NH2
ARG
V
143
R
-
CA
ALA
A
374
L
H
HE
ARG
V
143
R
-
CA
ALA
A
374
L
H
HH21
ARG
V
143
R
-
C
ALA
A
374
L
H
HE
ARG
V
143
R
-
C
ALA
A
374
L
H
HH21
ARG
V
143
R
-
CB
ALA
A
374
L
H
NE
ARG
V
143
R
-
CB
ALA
A
374
L
H
NH2
ARG
V
143
R
-
CB
ALA
A
374
L
H
HE
ARG
V
143
R
-
CB
ALA
A
374
L
H
HH21
ARG
V
143
R
-
N
LYS
A
375
L
H
NH2
ARG
V
143
R
-
N
LYS
A
375
L
H
HH21
ARG
V
143
R
-
C
LYS
A
375
L
H
HB3
PRO
V
139
R
-
N
THR
A
376
L
H
HB3
PRO
V
139
R
-
N
THR
A
376
L
H
HG3
PRO
V
139
R
-
CA
THR
A
376
L
H
HB3
PRO
V
139
R
-
CA
THR
A
376
L
H
HG3
PRO
V
139
R
-
C
THR
A
376
L
H
HG3
PRO
V
139
R
-
N
LEU
A
377
L
H
HG3
PRO
V
139
R
-
C
LEU
A
377
L
H
HA
LYS
V
137
R
-
O
LEU
A
377
L
H
O
LYS
V
137
R
-
O
LEU
A
377
L
H
HA
LYS
V
137
R
-
O
LEU
A
377
L
H
HG3
PRO
V
139
R
-
N
SER
A
378
L
H
HA
LYS
V
137
R
-
O
SER
A
378
L
H
HB3
LYS
V
137
R
-
O
SER
A
378
L
H
HG2
LYS
V
137
R
-
O
SER
A
378
L
H
HD3
LYS
V
137
R
-
O
GLY
A
379
L
H
HB3
LYS
V
137
R
-
O
GLY
A
379
L
H
HD3
LYS
V
137
R
-
N
LEU
A
429
L
-
HB2
PRO
V
313
R
-
CA
LEU
A
429
L
-
CB
PRO
V
313
R
-
CA
LEU
A
429
L
-
CG
PRO
V
313
R
-
CA
LEU
A
429
L
-
HB2
PRO
V
313
R
-
CA
LEU
A
429
L
-
HB3
PRO
V
313
R
-
CA
LEU
A
429
L
-
HG2
PRO
V
313
R
-
CA
LEU
A
429
L
-
HG3
PRO
V
313
R
-
C
LEU
A
429
L
-
CB
PRO
V
313
R
-
C
LEU
A
429
L
-
CG
PRO
V
313
R
-
C
LEU
A
429
L
-
HB2
PRO
V
313
R
-
C
LEU
A
429
L
-
HB3
PRO
V
313
R
-
C
LEU
A
429
L
-
HG2
PRO
V
313
R
-
C
LEU
A
429
L
-
HG3
PRO
V
313
R
-
C
LEU
A
429
L
-
CG
GLU
V
314
R
-
C
LEU
A
429
L
-
CD
GLU
V
314
R
-
C
LEU
A
429
L
-
OE1
GLU
V
314
R
-
C
LEU
A
429
L
-
HB2
GLU
V
314
R
-
C
LEU
A
429
L
-
HG3
GLU
V
314
R
-
CB
LEU
A
429
L
-
CB
PRO
V
313
R
-
CB
LEU
A
429
L
-
CG
PRO
V
313
R
-
CB
LEU
A
429
L
-
HB2
PRO
V
313
R
-
CB
LEU
A
429
L
-
HB3
PRO
V
313
R
-
CB
LEU
A
429
L
-
HG2
PRO
V
313
R
-
CB
LEU
A
429
L
-
HG3
PRO
V
313
R
-
O
LEU
A
429
L
-
CA
PRO
V
313
R
-
O
LEU
A
429
L
-
C
PRO
V
313
R
-
O
LEU
A
429
L
-
CB
PRO
V
313
R
-
O
LEU
A
429
L
-
O
PRO
V
313
R
-
O
LEU
A
429
L
-
CG
PRO
V
313
R
-
O
LEU
A
429
L
-
HB2
PRO
V
313
R
-
O
LEU
A
429
L
-
HB3
PRO
V
313
R
-
O
LEU
A
429
L
-
HG2
PRO
V
313
R
-
O
LEU
A
429
L
-
HG3
PRO
V
313
R
-
O
LEU
A
429
L
-
N
GLU
V
314
R
-
O
LEU
A
429
L
-
CB
GLU
V
314
R
-
O
LEU
A
429
L
-
CG
GLU
V
314
R
-
O
LEU
A
429
L
-
CD
GLU
V
314
R
-
O
LEU
A
429
L
-
OE1
GLU
V
314
R
-
O
LEU
A
429
L
-
OE2
GLU
V
314
R
-
O
LEU
A
429
L
-
HB2
GLU
V
314
R
-
O
LEU
A
429
L
-
HG2
GLU
V
314
R
-
O
LEU
A
429
L
-
HG3
GLU
V
314
R
-
CG
LEU
A
429
L
-
HG3
PRO
V
313
R
-
N
SER
A
430
L
-
CB
PRO
V
313
R
-
N
SER
A
430
L
-
CG
PRO
V
313
R
-
N
SER
A
430
L
-
CD
PRO
V
313
R
-
N
SER
A
430
L
-
HB2
PRO
V
313
R
-
N
SER
A
430
L
-
HB3
PRO
V
313
R
-
N
SER
A
430
L
-
HG2
PRO
V
313
R
-
N
SER
A
430
L
-
HG3
PRO
V
313
R
-
N
SER
A
430
L
-
HD3
PRO
V
313
R
-
N
SER
A
430
L
-
CG
GLU
V
314
R
-
N
SER
A
430
L
-
H
GLU
V
314
R
-
N
SER
A
430
L
-
HB2
GLU
V
314
R
-
N
SER
A
430
L
-
HG3
GLU
V
314
R
-
CA
SER
A
430
L
-
CB
PRO
V
313
R
-
CA
SER
A
430
L
-
CG
PRO
V
313
R
-
CA
SER
A
430
L
-
CD
PRO
V
313
R
-
CA
SER
A
430
L
-
HB2
PRO
V
313
R
-
CA
SER
A
430
L
-
HG2
PRO
V
313
R
-
CA
SER
A
430
L
-
HG3
PRO
V
313
R
-
CA
SER
A
430
L
-
HD3
PRO
V
313
R
-
CA
SER
A
430
L
-
N
GLU
V
314
R
-
CA
SER
A
430
L
-
CA
GLU
V
314
R
-
CA
SER
A
430
L
-
CB
GLU
V
314
R
-
CA
SER
A
430
L
-
CG
GLU
V
314
R
-
CA
SER
A
430
L
-
CD
GLU
V
314
R
-
CA
SER
A
430
L
-
OE2
GLU
V
314
R
-
CA
SER
A
430
L
-
H
GLU
V
314
R
-
CA
SER
A
430
L
-
HB2
GLU
V
314
R
-
CA
SER
A
430
L
-
HB3
GLU
V
314
R
-
CA
SER
A
430
L
-
HG3
GLU
V
314
R
-
C
SER
A
430
L
-
CG
PRO
V
313
R
-
C
SER
A
430
L
-
CD
PRO
V
313
R
-
C
SER
A
430
L
-
HG2
PRO
V
313
R
-
C
SER
A
430
L
-
HG3
PRO
V
313
R
-
C
SER
A
430
L
-
HD3
PRO
V
313
R
-
C
SER
A
430
L
-
N
GLU
V
314
R
-
C
SER
A
430
L
-
CA
GLU
V
314
R
-
C
SER
A
430
L
-
CB
GLU
V
314
R
-
C
SER
A
430
L
-
O
GLU
V
314
R
-
C
SER
A
430
L
-
H
GLU
V
314
R
-
C
SER
A
430
L
-
HB2
GLU
V
314
R
-
CB
SER
A
430
L
-
HG2
PRO
V
313
R
-
CB
SER
A
430
L
-
CB
GLU
V
314
R
-
CB
SER
A
430
L
-
CG
GLU
V
314
R
-
CB
SER
A
430
L
-
CD
GLU
V
314
R
-
CB
SER
A
430
L
-
OE2
GLU
V
314
R
-
CB
SER
A
430
L
-
HB2
GLU
V
314
R
-
CB
SER
A
430
L
-
HB3
GLU
V
314
R
-
CB
SER
A
430
L
-
HG3
GLU
V
314
R
-
O
SER
A
430
L
-
HG23
ILE
V
312
R
-
O
SER
A
430
L
-
N
PRO
V
313
R
-
O
SER
A
430
L
-
CG
PRO
V
313
R
-
O
SER
A
430
L
-
CD
PRO
V
313
R
-
O
SER
A
430
L
-
HG2
PRO
V
313
R
-
O
SER
A
430
L
-
HG3
PRO
V
313
R
-
O
SER
A
430
L
-
HD2
PRO
V
313
R
-
O
SER
A
430
L
-
HD3
PRO
V
313
R
-
O
SER
A
430
L
-
H
GLU
V
314
R
-
O
SER
A
430
L
-
HB2
GLU
V
314
R
-
OG
SER
A
430
L
-
HB2
GLU
V
314
R
-
N
ASP
A
431
L
-
HG2
PRO
V
313
R
-
N
ASP
A
431
L
-
HD3
PRO
V
313
R
-
N
ASP
A
431
L
-
N
GLU
V
314
R
-
N
ASP
A
431
L
-
CA
GLU
V
314
R
-
N
ASP
A
431
L
-
C
GLU
V
314
R
-
N
ASP
A
431
L
-
CB
GLU
V
314
R
-
N
ASP
A
431
L
-
O
GLU
V
314
R
-
N
ASP
A
431
L
-
H
GLU
V
314
R
-
N
ASP
A
431
L
-
HB2
GLU
V
314
R
-
N
ASP
A
431
L
-
HB3
GLU
V
314
R
-
CA
ASP
A
431
L
-
HG23
ILE
V
312
R
-
CA
ASP
A
431
L
-
C
GLU
V
314
R
-
CA
ASP
A
431
L
-
O
GLU
V
314
R
-
CA
ASP
A
431
L
-
H
GLU
V
314
R
-
CA
ASP
A
431
L
-
HA3
GLY
V
315
R
-
C
ASP
A
431
L
-
CG2
ILE
V
312
R
-
C
ASP
A
431
L
-
HG21
ILE
V
312
R
-
C
ASP
A
431
L
-
HG22
ILE
V
312
R
-
C
ASP
A
431
L
-
HG23
ILE
V
312
R
-
C
ASP
A
431
L
-
O
GLU
V
314
R
-
O
ASP
A
431
L
-
CG2
ILE
V
312
R
-
O
ASP
A
431
L
-
HA
ILE
V
312
R
-
O
ASP
A
431
L
-
HG12
ILE
V
312
R
-
O
ASP
A
431
L
-
HG21
ILE
V
312
R
-
O
ASP
A
431
L
-
HG22
ILE
V
312
R
-
O
ASP
A
431
L
-
HG23
ILE
V
312
R
-
O
ASP
A
431
L
-
HD3
PRO
V
313
R
-
N
MET
A
432
L
-
CG2
ILE
V
312
R
-
N
MET
A
432
L
-
HG21
ILE
V
312
R
-
N
MET
A
432
L
-
HG22
ILE
V
312
R
-
N
MET
A
432
L
-
HG23
ILE
V
312
R
-
N
MET
A
432
L
-
O
GLU
V
314
R
-
N
MET
A
432
L
-
HA3
GLY
V
315
R
-
CA
MET
A
432
L
-
CG2
ILE
V
312
R
-
CA
MET
A
432
L
-
HG21
ILE
V
312
R
-
CA
MET
A
432
L
-
HG23
ILE
V
312
R
-
CA
MET
A
432
L
H
HD3
PRO
V
316
R
-
C
MET
A
432
L
-
HG21
ILE
V
312
R
-
C
MET
A
432
L
H
HB2
PRO
V
316
R
-
C
MET
A
432
L
H
HD3
PRO
V
316
R
-
C
MET
A
432
L
H
H
ALA
V
317
R
-
C
MET
A
432
L
H
HB3
ALA
V
317
R
-
CB
MET
A
432
L
-
HG21
ILE
V
312
R
-
CB
MET
A
432
L
-
HG23
ILE
V
312
R
-
CB
MET
A
432
L
-
HD12
ILE
V
312
R
-
O
MET
A
432
L
-
HG21
ILE
V
312
R
-
O
MET
A
432
L
-
HA3
GLY
V
315
R
-
O
MET
A
432
L
H
N
PRO
V
316
R
-
O
MET
A
432
L
H
CD
PRO
V
316
R
-
O
MET
A
432
L
H
HB2
PRO
V
316
R
-
O
MET
A
432
L
H
HD3
PRO
V
316
R
-
O
MET
A
432
L
H
N
ALA
V
317
R
-
O
MET
A
432
L
H
CA
ALA
V
317
R
-
O
MET
A
432
L
H
CB
ALA
V
317
R
-
O
MET
A
432
L
H
H
ALA
V
317
R
-
O
MET
A
432
L
H
HB2
ALA
V
317
R
-
O
MET
A
432
L
H
HB3
ALA
V
317
R
-
N
SER
A
433
L
H
HB2
PRO
V
316
R
-
N
SER
A
433
L
H
HG2
PRO
V
316
R
-
N
SER
A
433
L
H
HD3
PRO
V
316
R
-
CA
SER
A
433
L
H
CB
PRO
V
316
R
-
CA
SER
A
433
L
H
CG
PRO
V
316
R
-
CA
SER
A
433
L
H
CD
PRO
V
316
R
-
CA
SER
A
433
L
H
HB2
PRO
V
316
R
-
CA
SER
A
433
L
H
HG2
PRO
V
316
R
-
CA
SER
A
433
L
H
HD3
PRO
V
316
R
-
C
SER
A
433
L
H
HB2
PRO
V
316
R
-
C
SER
A
433
L
H
HG2
PRO
V
316
R
-
CB
SER
A
433
L
H
CB
PRO
V
316
R
-
CB
SER
A
433
L
H
CG
PRO
V
316
R
-
CB
SER
A
433
L
H
CD
PRO
V
316
R
-
CB
SER
A
433
L
H
HB2
PRO
V
316
R
-
CB
SER
A
433
L
H
HG2
PRO
V
316
R
-
CB
SER
A
433
L
H
HD3
PRO
V
316
R
-
CB
SER
A
433
L
-
HE2
HIS
V
448
R
-
OG
SER
A
433
L
H
CG
PRO
V
316
R
-
OG
SER
A
433
L
H
CD
PRO
V
316
R
-
OG
SER
A
433
L
H
HB2
PRO
V
316
R
-
OG
SER
A
433
L
H
HG2
PRO
V
316
R
-
OG
SER
A
433
L
H
HG3
PRO
V
316
R
-
OG
SER
A
433
L
H
HD2
PRO
V
316
R
-
OG
SER
A
433
L
H
HD3
PRO
V
316
R
-
OG
SER
A
433
L
-
HE2
HIS
V
448
R
-
N
ILE
A
434
L
H
HB2
PRO
V
316
R
-
N
ILE
A
434
L
H
HG2
PRO
V
316
R
-
CB
ILE
A
434
L
H
HG23
VAL
V
460
R
-
CG2
ILE
A
434
L
-
HE2
HIS
V
448
R
-
CG2
ILE
A
434
L
H
HE2
PHE
V
456
R
-
CG2
ILE
A
434
L
H
HD22
LEU
V
459
R
-
CG2
ILE
A
434
L
H
HG23
VAL
V
460
R
-
CD1
ILE
A
434
L
H
HA
VAL
V
460
R
-
CD1
ILE
A
434
L
H
HG12
VAL
V
460
R
-
CD1
ILE
A
434
L
H
HG23
VAL
V
460
R
-
CD1
ILE
A
434
L
H
CB
ALA
V
463
R
-
CD1
ILE
A
434
L
H
HB1
ALA
V
463
R
-
CD1
ILE
A
434
L
H
HB3
ALA
V
463
R
-
N
SER
A
435
L
H
HZ
PHE
V
456
R
-
CA
SER
A
435
L
H
HZ
PHE
V
456
R
-
CB
SER
A
435
L
H
CE1
PHE
V
456
R
-
CB
SER
A
435
L
H
CZ
PHE
V
456
R
-
CB
SER
A
435
L
H
HE1
PHE
V
456
R
-
CB
SER
A
435
L
H
HZ
PHE
V
456
R
-
CB
SER
A
435
L
H
CG2
VAL
V
460
R
-
CB
SER
A
435
L
H
HG13
VAL
V
460
R
-
CB
SER
A
435
L
H
HG22
VAL
V
460
R
-
CB
SER
A
435
L
H
HG23
VAL
V
460
R
-
OG
SER
A
435
L
H
CE1
PHE
V
456
R
-
OG
SER
A
435
L
H
CE2
PHE
V
456
R
-
OG
SER
A
435
L
H
CZ
PHE
V
456
R
-
OG
SER
A
435
L
H
HE1
PHE
V
456
R
-
OG
SER
A
435
L
H
HE2
PHE
V
456
R
-
OG
SER
A
435
L
H
HZ
PHE
V
456
R
-
OG
SER
A
435
L
H
CG2
VAL
V
460
R
-
OG
SER
A
435
L
H
HG21
VAL
V
460
R
-
OG
SER
A
435
L
H
HG22
VAL
V
460
R
-
OG
SER
A
435
L
H
HG23
VAL
V
460
R
-
CB
THR
A
436
L
H
HE1
PHE
V
456
R
-
CG2
THR
A
436
L
H
HE1
PHE
V
456
R
-
OG1
THR
A
436
L
H
HE1
PHE
V
456
R
-
CD1
PHE
A
444
L
H
CG
ASN
V
289
R
-
CD1
PHE
A
444
L
H
OD1
ASN
V
289
R
-
CD1
PHE
A
444
L
H
HD22
ASN
V
289
R
-
CE1
PHE
A
444
L
H
OD1
ASN
V
289
R
-
CB
ASP
A
445
L
H
HD22
ASN
V
289
R
-
OD2
ASP
A
445
L
H
HD22
ASN
V
289
R
-
CD
GLN
A
470
L
H
HH21
ARG
V
338
R
-
OE1
GLN
A
470
L
H
NH2
ARG
V
338
R
-
OE1
GLN
A
470
L
H
HH21
ARG
V
338
R
-
OE1
GLN
A
470
L
H
HH22
ARG
V
338
R
-
OE1
GLN
A
470
L
H
HG21
THR
V
426
R
-
OE1
GLN
A
470
L
H
HG22
THR
V
426
R
-
CB
ALA
A
474
L
H
CG
ARG
V
338
R
-
CB
ALA
A
474
L
H
HA
ARG
V
338
R
-
CB
ALA
A
474
L
H
HG2
ARG
V
338
R
-
CB
ALA
A
474
L
H
HG3
ARG
V
338
R
-
CB
ILE
A
477
L
H
HE21
GLN
V
345
R
-
O
ILE
A
477
L
H
OE2
GLU
V
340
R
-
CG1
ILE
A
477
L
H
HG2
GLN
V
345
R
-
CG2
ILE
A
477
L
H
NE2
GLN
V
345
R
-
CG2
ILE
A
477
L
H
HG2
GLN
V
345
R
-
CG2
ILE
A
477
L
H
HE21
GLN
V
345
R
-
CG2
ILE
A
477
L
H
HE22
GLN
V
345
R
-
CD1
ILE
A
477
L
H
HA2
GLY
V
341
R
-
CD1
ILE
A
477
L
H
CG
GLN
V
345
R
-
CD1
ILE
A
477
L
H
CD
GLN
V
345
R
-
CD1
ILE
A
477
L
H
HG2
GLN
V
345
R
-
CD1
ILE
A
477
L
H
HG3
GLN
V
345
R
-
CD1
ILE
A
477
L
H
HE21
GLN
V
345
R
-
O
SER
A
485
L
H
HE1
TYR
V
302
R
-
CA
SER
A
486
L
H
HE1
TYR
V
302
R
-
CA
SER
A
486
L
H
HH
TYR
V
302
R
-
C
SER
A
486
L
H
CE1
TYR
V
302
R
-
C
SER
A
486
L
H
OH
TYR
V
302
R
-
C
SER
A
486
L
H
HE1
TYR
V
302
R
-
C
SER
A
486
L
H
HH
TYR
V
302
R
-
O
SER
A
486
L
H
HE1
TYR
V
302
R
-
N
PHE
A
487
L
H
CE1
TYR
V
302
R
-
N
PHE
A
487
L
H
OH
TYR
V
302
R
-
N
PHE
A
487
L
H
CZ
TYR
V
302
R
-
N
PHE
A
487
L
H
HE1
TYR
V
302
R
-
N
PHE
A
487
L
H
HH
TYR
V
302
R
-
CA
PHE
A
487
L
H
OH
TYR
V
302
R
-
CA
PHE
A
487
L
H
HE1
TYR
V
302
R
-
CA
PHE
A
487
L
H
HH
TYR
V
302
R
-
C
PHE
A
487
L
H
CE1
TYR
V
302
R
-
C
PHE
A
487
L
H
OH
TYR
V
302
R
-
C
PHE
A
487
L
H
CZ
TYR
V
302
R
-
C
PHE
A
487
L
H
HE1
TYR
V
302
R
-
C
PHE
A
487
L
H
HH
TYR
V
302
R
-
CB
PHE
A
487
L
-
OH
TYR
V
308
R
-
CB
PHE
A
487
L
-
HH
TYR
V
308
R
-
O
PHE
A
487
L
H
CD1
TYR
V
302
R
-
O
PHE
A
487
L
H
CE1
TYR
V
302
R
-
O
PHE
A
487
L
H
CE2
TYR
V
302
R
-
O
PHE
A
487
L
H
OH
TYR
V
302
R
-
O
PHE
A
487
L
H
CZ
TYR
V
302
R
-
O
PHE
A
487
L
H
HE1
TYR
V
302
R
-
O
PHE
A
487
L
H
HH
TYR
V
302
R
-
N
VAL
A
488
L
H
OH
TYR
V
302
R
-
N
VAL
A
488
L
H
HH
TYR
V
302
R
-
C
VAL
A
488
L
-
OH
TYR
V
308
R
-
C
VAL
A
488
L
-
HH
TYR
V
308
R
-
O
VAL
A
488
L
-
OH
TYR
V
308
R
-
O
VAL
A
488
L
-
CZ
TYR
V
308
R
-
O
VAL
A
488
L
-
HH
TYR
V
308
R
-
N
LEU
A
489
L
-
HH
TYR
V
308
R
-
C
LEU
A
489
L
H
OE2
GLU
V
307
R
-
C
LEU
A
489
L
H
HB2
GLU
V
307
R
-
C
LEU
A
489
L
H
HB3
GLU
V
307
R
-
O
LEU
A
489
L
H
CB
GLU
V
307
R
-
O
LEU
A
489
L
H
OE2
GLU
V
307
R
-
O
LEU
A
489
L
H
HB2
GLU
V
307
R
-
O
LEU
A
489
L
H
HB3
GLU
V
307
R
-
N
PRO
A
490
L
H
CB
GLU
V
307
R
-
N
PRO
A
490
L
H
CD
GLU
V
307
R
-
N
PRO
A
490
L
H
OE2
GLU
V
307
R
-
N
PRO
A
490
L
H
HB2
GLU
V
307
R
-
CA
PRO
A
490
L
H
CD
GLU
V
307
R
-
CA
PRO
A
490
L
H
OE2
GLU
V
307
R
-
CA
PRO
A
490
L
H
HB2
GLU
V
307
R
-
C
PRO
A
490
L
-
HH11
ARG
V
304
R
-
C
PRO
A
490
L
H
CG
GLU
V
307
R
-
C
PRO
A
490
L
H
CD
GLU
V
307
R
-
C
PRO
A
490
L
H
OE1
GLU
V
307
R
-
C
PRO
A
490
L
H
OE2
GLU
V
307
R
-
C
PRO
A
490
L
H
HB2
GLU
V
307
R
-
C
PRO
A
490
L
H
HG2
GLU
V
307
R
-
O
PRO
A
490
L
-
HH11
ARG
V
304
R
-
O
PRO
A
490
L
H
CB
GLU
V
307
R
-
O
PRO
A
490
L
H
CG
GLU
V
307
R
-
O
PRO
A
490
L
H
CD
GLU
V
307
R
-
O
PRO
A
490
L
H
OE1
GLU
V
307
R
-
O
PRO
A
490
L
H
OE2
GLU
V
307
R
-
O
PRO
A
490
L
H
HB2
GLU
V
307
R
-
O
PRO
A
490
L
H
HB3
GLU
V
307
R
-
O
PRO
A
490
L
H
HG2
GLU
V
307
R
-
O
PRO
A
490
L
H
HG3
GLU
V
307
R
-
CG
PRO
A
490
L
H
HB2
GLU
V
307
R
-
CD
PRO
A
490
L
H
CB
GLU
V
307
R
-
CD
PRO
A
490
L
H
O
GLU
V
307
R
-
CD
PRO
A
490
L
H
OE2
GLU
V
307
R
-
CD
PRO
A
490
L
H
HB2
GLU
V
307
R
-
N
LYS
A
491
L
H
CD
GLU
V
307
R
-
N
LYS
A
491
L
H
OE1
GLU
V
307
R
-
CA
LYS
A
491
L
H
OE1
GLU
V
307
R
-
CB
LYS
A
491
L
-
HH12
ARG
V
304
R
-
CG
LYS
A
491
L
-
NH1
ARG
V
304
R
-
CG
LYS
A
491
L
-
HH11
ARG
V
304
R
-
CG
LYS
A
491
L
-
HH12
ARG
V
304
R
-
CD
LYS
A
491
L
-
HH12
ARG
V
304
R
-
CE
LYS
A
491
L
-
HH12
ARG
V
304
R
-
CE
LYS
A
491
L
-
HH22
ARG
V
304
R
-
C
LEU
A
492
L
H
CD
ARG
V
325
R
-
C
LEU
A
492
L
H
HD2
ARG
V
325
R
-
C
LEU
A
492
L
H
HD3
ARG
V
325
R
-
C
LEU
A
492
L
H
HH11
ARG
V
325
R
-
C
LEU
A
492
L
H
HD13
LEU
V
329
R
-
O
LEU
A
492
L
H
HD2
HIS
V
306
R
-
O
LEU
A
492
L
H
CD
ARG
V
325
R
-
O
LEU
A
492
L
H
HG3
ARG
V
325
R
-
O
LEU
A
492
L
H
HD2
ARG
V
325
R
-
O
LEU
A
492
L
H
HD3
ARG
V
325
R
-
O
LEU
A
492
L
H
HH11
ARG
V
325
R
-
O
LEU
A
492
L
H
HD13
LEU
V
329
R
-
N
VAL
A
493
L
H
CD
ARG
V
325
R
-
N
VAL
A
493
L
H
NE
ARG
V
325
R
-
N
VAL
A
493
L
H
NH1
ARG
V
325
R
-
N
VAL
A
493
L
H
CZ
ARG
V
325
R
-
N
VAL
A
493
L
H
HD2
ARG
V
325
R
-
N
VAL
A
493
L
H
HD3
ARG
V
325
R
-
N
VAL
A
493
L
H
HH11
ARG
V
325
R
-
N
VAL
A
493
L
H
HD13
LEU
V
329
R
-
CA
VAL
A
493
L
H
CD
ARG
V
325
R
-
CA
VAL
A
493
L
H
NE
ARG
V
325
R
-
CA
VAL
A
493
L
H
NH1
ARG
V
325
R
-
CA
VAL
A
493
L
H
CZ
ARG
V
325
R
-
CA
VAL
A
493
L
H
HD2
ARG
V
325
R
-
CA
VAL
A
493
L
H
HH11
ARG
V
325
R
-
C
VAL
A
493
L
H
CD
ARG
V
325
R
-
C
VAL
A
493
L
H
NE
ARG
V
325
R
-
C
VAL
A
493
L
H
CZ
ARG
V
325
R
-
C
VAL
A
493
L
H
HD2
ARG
V
325
R
-
C
VAL
A
493
L
H
HE
ARG
V
325
R
-
C
VAL
A
493
L
H
HD11
LEU
V
329
R
-
C
VAL
A
493
L
H
HD12
LEU
V
329
R
-
CB
VAL
A
493
L
H
NE
ARG
V
325
R
-
CB
VAL
A
493
L
H
NH1
ARG
V
325
R
-
CB
VAL
A
493
L
H
CZ
ARG
V
325
R
-
CB
VAL
A
493
L
H
HD2
ARG
V
325
R
-
CB
VAL
A
493
L
H
HH11
ARG
V
325
R
-
CB
VAL
A
493
L
H
HH12
ARG
V
325
R
-
O
VAL
A
493
L
H
CG
ARG
V
325
R
-
O
VAL
A
493
L
H
CD
ARG
V
325
R
-
O
VAL
A
493
L
H
NE
ARG
V
325
R
-
O
VAL
A
493
L
H
NH1
ARG
V
325
R
-
O
VAL
A
493
L
H
NH2
ARG
V
325
R
-
O
VAL
A
493
L
H
CZ
ARG
V
325
R
-
O
VAL
A
493
L
H
HG2
ARG
V
325
R
-
O
VAL
A
493
L
H
HG3
ARG
V
325
R
-
O
VAL
A
493
L
H
HD2
ARG
V
325
R
-
O
VAL
A
493
L
H
HD3
ARG
V
325
R
-
O
VAL
A
493
L
H
HE
ARG
V
325
R
-
O
VAL
A
493
L
H
HH11
ARG
V
325
R
-
O
VAL
A
493
L
H
HH21
ARG
V
325
R
-
O
VAL
A
493
L
H
CD1
LEU
V
329
R
-
O
VAL
A
493
L
H
HD11
LEU
V
329
R
-
O
VAL
A
493
L
H
HD12
LEU
V
329
R
-
O
VAL
A
493
L
H
HD13
LEU
V
329
R
-
CG2
VAL
A
493
L
H
NH1
ARG
V
325
R
-
CG2
VAL
A
493
L
H
HH11
ARG
V
325
R
-
CG2
VAL
A
493
L
H
HH12
ARG
V
325
R
-
N
LYS
A
494
L
H
HD11
LEU
V
329
R
-
CG
LYS
A
494
L
H
CB
LEU
V
329
R
-
CG
LYS
A
494
L
H
CD1
LEU
V
329
R
-
CG
LYS
A
494
L
H
HB2
LEU
V
329
R
-
CG
LYS
A
494
L
H
HB3
LEU
V
329
R
-
CG
LYS
A
494
L
H
HD11
LEU
V
329
R
-
CG
LYS
A
494
L
H
HD12
LEU
V
329
R
-
CD
LYS
A
494
L
H
HB3
LEU
V
329
R
-
CD
LYS
A
494
L
H
HD12
LEU
V
329
R
-
CD
LYS
A
494
L
H
HG2
GLU
V
330
R
-
CE
LYS
A
494
L
H
C
LEU
V
329
R
-
CE
LYS
A
494
L
H
CB
LEU
V
329
R
-
CE
LYS
A
494
L
H
O
LEU
V
329
R
-
CE
LYS
A
494
L
H
HB2
LEU
V
329
R
-
CE
LYS
A
494
L
H
HB3
LEU
V
329
R
-
CE
LYS
A
494
L
H
HD12
LEU
V
329
R
-
CE
LYS
A
494
L
H
HG2
GLU
V
330
R
-
NZ
LYS
A
494
L
H
O
LEU
V
329
R
-
NZ
LYS
A
494
L
H
HB3
LEU
V
329
R
-
NZ
LYS
A
494
L
H
HG2
GLU
V
330
R
-
NZ
LYS
A
494
L
H
HD21
LEU
V
333
R
-
O
SER
A
495
L
H
HH21
ARG
V
325
R
-
C
GLN
A
496
L
H
OD2
ASP
V
326
R
-
O
GLN
A
496
L
H
OD2
ASP
V
326
R
-
CB
LEU
A
497
L
H
NE
ARG
V
438
R
-
CB
LEU
A
497
L
H
HD2
ARG
V
438
R
-
CB
LEU
A
497
L
H
HE
ARG
V
438
R
-
CG
LEU
A
497
L
H
OD2
ASP
V
326
R
-
CG
LEU
A
497
L
H
HB3
ASP
V
326
R
-
CG
LEU
A
497
L
H
CG
ARG
V
438
R
-
CG
LEU
A
497
L
H
CD
ARG
V
438
R
-
CG
LEU
A
497
L
H
NE
ARG
V
438
R
-
CG
LEU
A
497
L
H
HG2
ARG
V
438
R
-
CG
LEU
A
497
L
H
HD2
ARG
V
438
R
-
CG
LEU
A
497
L
H
HD3
ARG
V
438
R
-
CG
LEU
A
497
L
H
HE
ARG
V
438
R
-
CD1
LEU
A
497
L
H
CB
ASP
V
326
R
-
CD1
LEU
A
497
L
H
HB2
ASP
V
326
R
-
CD1
LEU
A
497
L
H
HB3
ASP
V
326
R
-
CD1
LEU
A
497
L
H
OE2
GLU
V
330
R
-
CD1
LEU
A
497
L
H
CG
ARG
V
438
R
-
CD1
LEU
A
497
L
H
CD
ARG
V
438
R
-
CD1
LEU
A
497
L
H
NE
ARG
V
438
R
-
CD1
LEU
A
497
L
H
NH1
ARG
V
438
R
-
CD1
LEU
A
497
L
H
NH2
ARG
V
438
R
-
CD1
LEU
A
497
L
H
CZ
ARG
V
438
R
-
CD1
LEU
A
497
L
H
HG2
ARG
V
438
R
-
CD1
LEU
A
497
L
H
HD2
ARG
V
438
R
-
CD1
LEU
A
497
L
H
HD3
ARG
V
438
R
-
CD1
LEU
A
497
L
H
HE
ARG
V
438
R
-
CD1
LEU
A
497
L
H
HH21
ARG
V
438
R
-
CD2
LEU
A
497
L
H
CA
ARG
V
438
R
-
CD2
LEU
A
497
L
H
CB
ARG
V
438
R
-
CD2
LEU
A
497
L
H
CG
ARG
V
438
R
-
CD2
LEU
A
497
L
H
CD
ARG
V
438
R
-
CD2
LEU
A
497
L
H
NE
ARG
V
438
R
-
CD2
LEU
A
497
L
H
HA
ARG
V
438
R
-
CD2
LEU
A
497
L
H
HB3
ARG
V
438
R
-
CD2
LEU
A
497
L
H
HG2
ARG
V
438
R
-
CD2
LEU
A
497
L
H
HG3
ARG
V
438
R
-
CD2
LEU
A
497
L
H
HD2
ARG
V
438
R
-
CD2
LEU
A
497
L
H
HD3
ARG
V
438
R
-
CD2
LEU
A
497
L
H
HE
ARG
V
438
R
-
CB
VAL
A
500
L
H
CA
GLY
V
441
R
-
CB
VAL
A
500
L
H
HA2
GLY
V
441
R
-
CB
VAL
A
500
L
H
HA3
GLY
V
441
R
-
CG1
VAL
A
500
L
H
N
GLY
V
441
R
-
CG1
VAL
A
500
L
H
CA
GLY
V
441
R
-
CG1
VAL
A
500
L
H
H
GLY
V
441
R
-
CG1
VAL
A
500
L
H
HA2
GLY
V
441
R
-
CG1
VAL
A
500
L
H
HA3
GLY
V
441
R
-
CG2
VAL
A
500
L
H
N
GLY
V
441
R
-
CG2
VAL
A
500
L
H
CA
GLY
V
441
R
-
CG2
VAL
A
500
L
H
C
GLY
V
441
R
-
CG2
VAL
A
500
L
H
O
GLY
V
441
R
-
CG2
VAL
A
500
L
H
HA2
GLY
V
441
R
-
CG2
VAL
A
500
L
H
HA3
GLY
V
441
R
H
CE2
PHE
A
504
L
H
HG3
GLN
V
437
R
H
CZ
PHE
A
504
L
H
HG3
GLN
V
437
R
H
CZ
PHE
A
504
L
H
OE2
GLU
V
440