A1IGU5_P49418.1
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
ALA
A
299
L
H
GLU
V
171
R
H
TYR
A
302
L
H
GLU
V
171
R
H
TYR
A
302
L
H
LYS
V
175
R
-
PHE
A
303
L
H
GLU
V
170
R
-
PHE
A
303
L
H
GLU
V
171
R
-
PHE
A
303
L
H
GLN
V
174
R
-
TYR
A
308
L
H
GLN
V
174
R
-
TYR
A
308
L
H
LYS
V
175
R
-
TYR
A
308
L
H
LYS
V
178
R
H
GLU
A
330
L
-
ALA
V
494
R
H
GLU
A
330
L
-
GLU
V
495
R
H
GLN
A
434
L
-
LYS
V
496
R
H
GLN
A
437
L
-
LYS
V
496
R
H
ARG
A
438
L
-
GLU
V
495
R
H
ARG
A
438
L
-
LYS
V
496
R
H
GLY
A
441
L
-
ALA
V
497
R
H
GLY
A
441
L
-
VAL
V
499
R
H
ALA
A
444
L
-
VAL
V
499
R
H
GLN
A
445
L
-
VAL
V
499
R
-
HIS
A
450
L
-
ALA
V
501
R
-
HIS
A
450
L
-
GLY
V
502
R
-
PRO
A
452
L
-
SER
V
506
R
-
PRO
A
452
L
-
LEU
V
507
R
H
PRO
A
454
L
-
LEU
V
507
R
H
ALA
A
455
L
-
LEU
V
507
R
H
PHE
A
478
L
H
GLU
V
37
R
-
LEU
A
491
L
H
GLN
V
26
R
-
LEU
A
491
L
H
LYS
V
27
R
-
LEU
A
491
L
-
GLY
V
29
R
-
PRO
A
492
L
H
LYS
V
27
R
-
PRO
A
492
L
-
LEU
V
28
R
-
GLY
A
493
L
-
LEU
V
28
R
H
SER
A
494
L
H
LYS
V
27
R
H
SER
A
494
L
-
LEU
V
28
R
H
GLN
A
497
L
-
LEU
V
28
R
H
GLN
A
497
L
-
LYS
V
30
R
H
GLN
A
499
L
-
ILE
V
321
R
H
LEU
A
502
L
-
ASN
V
319
R
H
SER
A
503
L
-
GLU
V
318
R
H
SER
A
503
L
-
ASN
V
319
R
H
SER
A
503
L
-
ILE
V
320
R
H
SER
A
503
L
-
ILE
V
321
R
H
ARG
A
504
L
-
GLU
V
318
R
H
ARG
A
504
L
-
ASN
V
319
R
H
TYR
A
505
L
-
GLN
V
316
R
H
TYR
A
505
L
-
GLN
V
317
R
H
TYR
A
505
L
-
GLU
V
318
R
-
GLY
A
506
L
-
GLN
V
317
R
-
GLY
A
506
L
-
GLU
V
318
R
H
GLY
A
508
L
-
GLU
V
314
R
H
GLY
A
508
L
-
LEU
V
315
R
H
LYS
A
509
L
-
LEU
V
315
R
H
LYS
A
509
L
-
GLN
V
316
R
S
TYR
A
511
L
-
GLU
V
314
R
-
PRO
A
528
L
-
GLY
V
29
R
-
GLN
A
531
L
-
GLY
V
29
R
S
LEU
A
566
L
-
LYS
V
313
R
-
HIS
A
568
L
-
PRO
V
311
R
-
HIS
A
568
L
-
THR
V
312
R
H
ARG
A
577
L
-
GLN
V
393
R
-
ASP
A
585
L
-
SER
V
396
R
-
GLU
A
592
L
-
HIS
V
373
R
-
PRO
A
593
L
-
HIS
V
373
R
-
SER
A
594
L
-
VAL
V
371
R
-
SER
A
594
L
-
HIS
V
373
R
S
GLU
A
633
L
-
VAL
V
342
R
S
GLU
A
633
L
-
PRO
V
343
R
S
GLU
A
647
L
-
LYS
V
347
R
S
ARG
A
652
L
-
VAL
V
345
R
S
ARG
A
652
L
-
LYS
V
347
R
-
SER
A
675
L
-
ASP
V
661
A1IGU5_P49418.1
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
CA
ALA
A
299
L
H
OE1
GLU
V
171
R
H
C
ALA
A
299
L
H
OE1
GLU
V
171
R
H
CB
ALA
A
299
L
H
OE1
GLU
V
171
R
H
O
ALA
A
299
L
H
OE1
GLU
V
171
R
H
CD1
TYR
A
302
L
H
CD
GLU
V
171
R
H
CD1
TYR
A
302
L
H
OE2
GLU
V
171
R
H
CD1
TYR
A
302
L
H
HG2
GLU
V
171
R
H
OH
TYR
A
302
L
H
NZ
LYS
V
175
R
H
OH
TYR
A
302
L
H
HD2
LYS
V
175
R
H
OH
TYR
A
302
L
H
HZ1
LYS
V
175
R
H
OH
TYR
A
302
L
H
HZ2
LYS
V
175
R
H
OH
TYR
A
302
L
H
HZ3
LYS
V
175
R
H
CZ
TYR
A
302
L
H
HZ2
LYS
V
175
R
-
CB
PHE
A
303
L
H
HG2
GLU
V
171
R
-
CG
PHE
A
303
L
H
HG3
GLN
V
174
R
-
CD2
PHE
A
303
L
H
HA
GLU
V
171
R
-
CD2
PHE
A
303
L
H
CB
GLN
V
174
R
-
CD2
PHE
A
303
L
H
CG
GLN
V
174
R
-
CD2
PHE
A
303
L
H
HB2
GLN
V
174
R
-
CD2
PHE
A
303
L
H
HB3
GLN
V
174
R
-
CD2
PHE
A
303
L
H
HG3
GLN
V
174
R
-
CE1
PHE
A
303
L
H
HG3
GLN
V
174
R
-
CE2
PHE
A
303
L
H
HG3
GLU
V
170
R
-
CE2
PHE
A
303
L
H
CB
GLN
V
174
R
-
CE2
PHE
A
303
L
H
CG
GLN
V
174
R
-
CE2
PHE
A
303
L
H
CD
GLN
V
174
R
-
CE2
PHE
A
303
L
H
NE2
GLN
V
174
R
-
CE2
PHE
A
303
L
H
OE1
GLN
V
174
R
-
CE2
PHE
A
303
L
H
HB2
GLN
V
174
R
-
CE2
PHE
A
303
L
H
HB3
GLN
V
174
R
-
CE2
PHE
A
303
L
H
HG2
GLN
V
174
R
-
CE2
PHE
A
303
L
H
HG3
GLN
V
174
R
-
CZ
PHE
A
303
L
H
HG3
GLU
V
170
R
-
CZ
PHE
A
303
L
H
CG
GLN
V
174
R
-
CZ
PHE
A
303
L
H
CD
GLN
V
174
R
-
CZ
PHE
A
303
L
H
NE2
GLN
V
174
R
-
CZ
PHE
A
303
L
H
OE1
GLN
V
174
R
-
CZ
PHE
A
303
L
H
HG2
GLN
V
174
R
-
CZ
PHE
A
303
L
H
HG3
GLN
V
174
R
-
CZ
PHE
A
303
L
H
HE21
GLN
V
174
R
-
CD1
TYR
A
308
L
H
CB
LYS
V
178
R
-
CD1
TYR
A
308
L
H
HB3
LYS
V
178
R
-
CD1
TYR
A
308
L
H
HD2
LYS
V
178
R
-
CD2
TYR
A
308
L
H
OE1
GLN
V
174
R
-
CE1
TYR
A
308
L
H
O
GLN
V
174
R
-
CE1
TYR
A
308
L
H
HB2
GLN
V
174
R
-
CE1
TYR
A
308
L
H
N
LYS
V
178
R
-
CE1
TYR
A
308
L
H
CA
LYS
V
178
R
-
CE1
TYR
A
308
L
H
CB
LYS
V
178
R
-
CE1
TYR
A
308
L
H
CG
LYS
V
178
R
-
CE1
TYR
A
308
L
H
CD
LYS
V
178
R
-
CE1
TYR
A
308
L
H
H
LYS
V
178
R
-
CE1
TYR
A
308
L
H
HA
LYS
V
178
R
-
CE1
TYR
A
308
L
H
HB2
LYS
V
178
R
-
CE1
TYR
A
308
L
H
HB3
LYS
V
178
R
-
CE1
TYR
A
308
L
H
HD2
LYS
V
178
R
-
CE2
TYR
A
308
L
H
OE1
GLN
V
174
R
-
CE2
TYR
A
308
L
H
HB2
GLN
V
174
R
-
OH
TYR
A
308
L
H
CA
GLN
V
174
R
-
OH
TYR
A
308
L
H
C
GLN
V
174
R
-
OH
TYR
A
308
L
H
CB
GLN
V
174
R
-
OH
TYR
A
308
L
H
O
GLN
V
174
R
-
OH
TYR
A
308
L
H
HB2
GLN
V
174
R
-
OH
TYR
A
308
L
H
HB3
GLN
V
174
R
-
OH
TYR
A
308
L
H
N
LYS
V
175
R
-
OH
TYR
A
308
L
H
HA
LYS
V
175
R
-
OH
TYR
A
308
L
H
CB
LYS
V
178
R
-
OH
TYR
A
308
L
H
HB2
LYS
V
178
R
-
OH
TYR
A
308
L
H
HB3
LYS
V
178
R
-
OH
TYR
A
308
L
H
HD2
LYS
V
178
R
-
OH
TYR
A
308
L
H
HD3
LYS
V
178
R
-
CZ
TYR
A
308
L
H
C
GLN
V
174
R
-
CZ
TYR
A
308
L
H
CB
GLN
V
174
R
-
CZ
TYR
A
308
L
H
O
GLN
V
174
R
-
CZ
TYR
A
308
L
H
HB2
GLN
V
174
R
-
CZ
TYR
A
308
L
H
CB
LYS
V
178
R
-
CZ
TYR
A
308
L
H
HB2
LYS
V
178
R
-
CZ
TYR
A
308
L
H
HB3
LYS
V
178
R
-
CZ
TYR
A
308
L
H
HD2
LYS
V
178
R
H
CD
GLU
A
330
L
-
HB1
ALA
V
494
R
H
CD
GLU
A
330
L
-
HB2
ALA
V
494
R
H
CD
GLU
A
330
L
-
H
GLU
V
495
R
H
OE1
GLU
A
330
L
-
HA
ALA
V
494
R
H
OE1
GLU
A
330
L
-
HB1
ALA
V
494
R
H
OE1
GLU
A
330
L
-
HB2
ALA
V
494
R
H
OE1
GLU
A
330
L
-
H
GLU
V
495
R
H
OE2
GLU
A
330
L
-
HB1
ALA
V
494
R
H
OE2
GLU
A
330
L
-
H
GLU
V
495
R
H
OE2
GLU
A
330
L
-
HG2
GLU
V
495
R
H
CG
GLN
A
434
L
-
HZ2
LYS
V
496
R
H
CG
GLN
A
437
L
-
HE2
LYS
V
496
R
H
CG
GLN
A
437
L
-
HE3
LYS
V
496
R
H
CD
GLN
A
437
L
-
CE
LYS
V
496
R
H
CD
GLN
A
437
L
-
NZ
LYS
V
496
R
H
CD
GLN
A
437
L
-
HE2
LYS
V
496
R
H
CD
GLN
A
437
L
-
HE3
LYS
V
496
R
H
CD
GLN
A
437
L
-
HZ2
LYS
V
496
R
H
CD
GLN
A
437
L
-
HZ3
LYS
V
496
R
H
NE2
GLN
A
437
L
-
CE
LYS
V
496
R
H
NE2
GLN
A
437
L
-
HE2
LYS
V
496
R
H
NE2
GLN
A
437
L
-
HE3
LYS
V
496
R
H
NE2
GLN
A
437
L
-
HZ3
LYS
V
496
R
H
OE1
GLN
A
437
L
-
CE
LYS
V
496
R
H
OE1
GLN
A
437
L
-
NZ
LYS
V
496
R
H
OE1
GLN
A
437
L
-
HE2
LYS
V
496
R
H
OE1
GLN
A
437
L
-
HE3
LYS
V
496
R
H
OE1
GLN
A
437
L
-
HZ2
LYS
V
496
R
H
OE1
GLN
A
437
L
-
HZ3
LYS
V
496
R
H
CG
ARG
A
438
L
-
HE3
LYS
V
496
R
H
NE
ARG
A
438
L
-
HD2
LYS
V
496
R
H
NH2
ARG
A
438
L
-
OE1
GLU
V
495
R
H
NH2
ARG
A
438
L
-
HG2
GLU
V
495
R
H
CA
GLY
A
441
L
-
HB1
ALA
V
497
R
H
CA
GLY
A
441
L
-
HG21
VAL
V
499
R
H
C
GLY
A
441
L
-
HG21
VAL
V
499
R
H
O
GLY
A
441
L
-
CG2
VAL
V
499
R
H
O
GLY
A
441
L
-
HG21
VAL
V
499
R
H
O
GLY
A
441
L
-
HG22
VAL
V
499
R
H
O
GLY
A
441
L
-
HG23
VAL
V
499
R
H
N
ALA
A
444
L
-
HG22
VAL
V
499
R
H
CA
ALA
A
444
L
-
HG13
VAL
V
499
R
H
CA
ALA
A
444
L
-
HG22
VAL
V
499
R
H
C
ALA
A
444
L
-
CG2
VAL
V
499
R
H
C
ALA
A
444
L
-
HG13
VAL
V
499
R
H
C
ALA
A
444
L
-
HG22
VAL
V
499
R
H
CB
ALA
A
444
L
-
CB
VAL
V
499
R
H
CB
ALA
A
444
L
-
CG2
VAL
V
499
R
H
CB
ALA
A
444
L
-
HB
VAL
V
499
R
H
CB
ALA
A
444
L
-
HG13
VAL
V
499
R
H
CB
ALA
A
444
L
-
HG21
VAL
V
499
R
H
CB
ALA
A
444
L
-
HG22
VAL
V
499
R
H
CB
ALA
A
444
L
-
HG23
VAL
V
499
R
H
O
ALA
A
444
L
-
CG1
VAL
V
499
R
H
O
ALA
A
444
L
-
HG13
VAL
V
499
R
H
O
ALA
A
444
L
-
HG22
VAL
V
499
R
H
N
GLN
A
445
L
-
HG13
VAL
V
499
R
H
N
GLN
A
445
L
-
HG22
VAL
V
499
R
H
CG
GLN
A
445
L
-
CG2
VAL
V
499
R
H
CG
GLN
A
445
L
-
HG22
VAL
V
499
R
H
CG
GLN
A
445
L
-
HG23
VAL
V
499
R
H
CD
GLN
A
445
L
-
HG23
VAL
V
499
R
H
NE2
GLN
A
445
L
-
HG23
VAL
V
499
R
-
CG
HIS
A
450
L
-
HA2
GLY
V
502
R
-
CD2
HIS
A
450
L
-
HA2
GLY
V
502
R
-
ND1
HIS
A
450
L
-
HA2
GLY
V
502
R
-
CE1
HIS
A
450
L
-
H
ALA
V
501
R
-
CE1
HIS
A
450
L
-
HA
ALA
V
501
R
-
CE1
HIS
A
450
L
-
CA
GLY
V
502
R
-
CE1
HIS
A
450
L
-
HA2
GLY
V
502
R
-
NE2
HIS
A
450
L
-
HA
ALA
V
501
R
-
NE2
HIS
A
450
L
-
CA
GLY
V
502
R
-
NE2
HIS
A
450
L
-
HA2
GLY
V
502
R
-
CB
PRO
A
452
L
-
CD1
LEU
V
507
R
-
CB
PRO
A
452
L
-
HD11
LEU
V
507
R
-
CB
PRO
A
452
L
-
HD12
LEU
V
507
R
-
CG
PRO
A
452
L
-
OG
SER
V
506
R
-
CG
PRO
A
452
L
-
HG
SER
V
506
R
-
CG
PRO
A
452
L
-
HD11
LEU
V
507
R
H
CB
PRO
A
454
L
-
HD12
LEU
V
507
R
H
CG
PRO
A
454
L
-
HD12
LEU
V
507
R
H
CD
PRO
A
454
L
-
HD12
LEU
V
507
R
H
N
ALA
A
455
L
-
HG
LEU
V
507
R
H
N
ALA
A
455
L
-
HD12
LEU
V
507
R
H
CA
ALA
A
455
L
-
HG
LEU
V
507
R
H
CB
ALA
A
455
L
-
HG
LEU
V
507
R
H
CB
ALA
A
455
L
-
HD11
LEU
V
507
R
H
CE2
PHE
A
478
L
H
OE2
GLU
V
37
R
H
CZ
PHE
A
478
L
H
OE1
GLU
V
37
R
H
CZ
PHE
A
478
L
H
OE2
GLU
V
37
R
-
CA
LEU
A
491
L
H
O
LYS
V
27
R
-
C
LEU
A
491
L
H
O
LYS
V
27
R
-
CB
LEU
A
491
L
H
C
LYS
V
27
R
-
CB
LEU
A
491
L
H
O
LYS
V
27
R
-
O
LEU
A
491
L
H
O
LYS
V
27
R
-
CG
LEU
A
491
L
H
O
LYS
V
27
R
-
CD2
LEU
A
491
L
H
O
GLN
V
26
R
-
CD2
LEU
A
491
L
H
C
LYS
V
27
R
-
CD2
LEU
A
491
L
H
O
LYS
V
27
R
-
CD2
LEU
A
491
L
H
HA
LYS
V
27
R
-
CD2
LEU
A
491
L
-
H
GLY
V
29
R
-
N
PRO
A
492
L
H
O
LYS
V
27
R
-
N
PRO
A
492
L
H
HB3
LYS
V
27
R
-
CA
PRO
A
492
L
H
HB3
LYS
V
27
R
-
CA
PRO
A
492
L
H
HD2
LYS
V
27
R
-
C
PRO
A
492
L
H
O
LYS
V
27
R
-
C
PRO
A
492
L
H
HB3
LYS
V
27
R
-
C
PRO
A
492
L
-
HD21
LEU
V
28
R
-
CB
PRO
A
492
L
H
CD
LYS
V
27
R
-
CB
PRO
A
492
L
H
HB3
LYS
V
27
R
-
CB
PRO
A
492
L
H
HD2
LYS
V
27
R
-
CB
PRO
A
492
L
H
HZ2
LYS
V
27
R
-
O
PRO
A
492
L
H
CA
LYS
V
27
R
-
O
PRO
A
492
L
H
C
LYS
V
27
R
-
O
PRO
A
492
L
H
CB
LYS
V
27
R
-
O
PRO
A
492
L
H
O
LYS
V
27
R
-
O
PRO
A
492
L
H
HB2
LYS
V
27
R
-
O
PRO
A
492
L
H
HB3
LYS
V
27
R
-
O
PRO
A
492
L
H
HD2
LYS
V
27
R
-
O
PRO
A
492
L
-
N
LEU
V
28
R
-
O
PRO
A
492
L
-
CD2
LEU
V
28
R
-
O
PRO
A
492
L
-
HA
LEU
V
28
R
-
O
PRO
A
492
L
-
HG
LEU
V
28
R
-
O
PRO
A
492
L
-
HD21
LEU
V
28
R
-
O
PRO
A
492
L
-
HD23
LEU
V
28
R
-
CG
PRO
A
492
L
H
CD
LYS
V
27
R
-
CG
PRO
A
492
L
H
HB3
LYS
V
27
R
-
CG
PRO
A
492
L
H
HG2
LYS
V
27
R
-
CG
PRO
A
492
L
H
HD2
LYS
V
27
R
-
CG
PRO
A
492
L
H
HZ2
LYS
V
27
R
-
CD
PRO
A
492
L
H
HB3
LYS
V
27
R
-
CD
PRO
A
492
L
H
HG2
LYS
V
27
R
-
CD
PRO
A
492
L
H
HD2
LYS
V
27
R
-
N
GLY
A
493
L
-
HD21
LEU
V
28
R
-
N
GLY
A
493
L
-
HD23
LEU
V
28
R
-
CA
GLY
A
493
L
-
CD2
LEU
V
28
R
-
CA
GLY
A
493
L
-
HG
LEU
V
28
R
-
CA
GLY
A
493
L
-
HD21
LEU
V
28
R
-
CA
GLY
A
493
L
-
HD22
LEU
V
28
R
-
CA
GLY
A
493
L
-
HD23
LEU
V
28
R
-
C
GLY
A
493
L
-
CG
LEU
V
28
R
-
C
GLY
A
493
L
-
CD2
LEU
V
28
R
-
C
GLY
A
493
L
-
HG
LEU
V
28
R
-
C
GLY
A
493
L
-
HD21
LEU
V
28
R
-
C
GLY
A
493
L
-
HD22
LEU
V
28
R
-
C
GLY
A
493
L
-
HD23
LEU
V
28
R
-
O
GLY
A
493
L
-
CG
LEU
V
28
R
-
O
GLY
A
493
L
-
CD2
LEU
V
28
R
-
O
GLY
A
493
L
-
HD21
LEU
V
28
R
-
O
GLY
A
493
L
-
HD22
LEU
V
28
R
-
O
GLY
A
493
L
-
HD23
LEU
V
28
R
H
N
SER
A
494
L
-
CD2
LEU
V
28
R
H
N
SER
A
494
L
-
HA
LEU
V
28
R
H
N
SER
A
494
L
-
HD21
LEU
V
28
R
H
N
SER
A
494
L
-
HD22
LEU
V
28
R
H
N
SER
A
494
L
-
HD23
LEU
V
28
R
H
CA
SER
A
494
L
-
CD2
LEU
V
28
R
H
CA
SER
A
494
L
-
HA
LEU
V
28
R
H
CA
SER
A
494
L
-
HD21
LEU
V
28
R
H
CA
SER
A
494
L
-
HD22
LEU
V
28
R
H
CA
SER
A
494
L
-
HD23
LEU
V
28
R
H
CB
SER
A
494
L
-
HA
LEU
V
28
R
H
CB
SER
A
494
L
-
HD21
LEU
V
28
R
H
OG
SER
A
494
L
H
O
LYS
V
27
R
H
OG
SER
A
494
L
-
CA
LEU
V
28
R
H
OG
SER
A
494
L
-
C
LEU
V
28
R
H
OG
SER
A
494
L
-
O
LEU
V
28
R
H
OG
SER
A
494
L
-
CD2
LEU
V
28
R
H
OG
SER
A
494
L
-
HA
LEU
V
28
R
H
OG
SER
A
494
L
-
HD21
LEU
V
28
R
H
OG
SER
A
494
L
-
HD22
LEU
V
28
R
H
CD
GLN
A
497
L
-
CE
LYS
V
30
R
H
CD
GLN
A
497
L
-
HE2
LYS
V
30
R
H
CD
GLN
A
497
L
-
HE3
LYS
V
30
R
H
CD
GLN
A
497
L
-
HZ1
LYS
V
30
R
H
NE2
GLN
A
497
L
-
CE
LYS
V
30
R
H
NE2
GLN
A
497
L
-
HE2
LYS
V
30
R
H
NE2
GLN
A
497
L
-
HE3
LYS
V
30
R
H
NE2
GLN
A
497
L
-
HZ1
LYS
V
30
R
H
OE1
GLN
A
497
L
-
O
LEU
V
28
R
H
OE1
GLN
A
497
L
-
HB3
LEU
V
28
R
H
OE1
GLN
A
497
L
-
HD22
LEU
V
28
R
H
OE1
GLN
A
497
L
-
CE
LYS
V
30
R
H
OE1
GLN
A
497
L
-
HE2
LYS
V
30
R
H
OE1
GLN
A
497
L
-
HE3
LYS
V
30
R
H
CG
GLN
A
499
L
-
HD12
ILE
V
321
R
H
CD
GLN
A
499
L
-
HD12
ILE
V
321
R
H
NE2
GLN
A
499
L
-
CD1
ILE
V
321
R
H
NE2
GLN
A
499
L
-
HD11
ILE
V
321
R
H
NE2
GLN
A
499
L
-
HD12
ILE
V
321
R
H
NE2
GLN
A
499
L
-
HD13
ILE
V
321
R
H
C
LEU
A
502
L
-
H
ASN
V
319
R
H
O
LEU
A
502
L
-
H
ASN
V
319
R
H
N
SER
A
503
L
-
O
ASN
V
319
R
H
N
SER
A
503
L
-
H
ASN
V
319
R
H
CA
SER
A
503
L
-
N
ASN
V
319
R
H
CA
SER
A
503
L
-
CA
ASN
V
319
R
H
CA
SER
A
503
L
-
C
ASN
V
319
R
H
CA
SER
A
503
L
-
O
ASN
V
319
R
H
CA
SER
A
503
L
-
H
ASN
V
319
R
H
CA
SER
A
503
L
-
N
ILE
V
320
R
H
CA
SER
A
503
L
-
HA
ILE
V
320
R
H
C
SER
A
503
L
-
HA
GLU
V
318
R
H
C
SER
A
503
L
-
N
ASN
V
319
R
H
C
SER
A
503
L
-
C
ASN
V
319
R
H
C
SER
A
503
L
-
O
ASN
V
319
R
H
C
SER
A
503
L
-
H
ASN
V
319
R
H
C
SER
A
503
L
-
N
ILE
V
320
R
H
C
SER
A
503
L
-
HA
ILE
V
320
R
H
C
SER
A
503
L
-
HG12
ILE
V
320
R
H
C
SER
A
503
L
-
HG13
ILE
V
320
R
H
CB
SER
A
503
L
-
C
ASN
V
319
R
H
CB
SER
A
503
L
-
O
ASN
V
319
R
H
CB
SER
A
503
L
-
N
ILE
V
320
R
H
CB
SER
A
503
L
-
CA
ILE
V
320
R
H
CB
SER
A
503
L
-
C
ILE
V
320
R
H
CB
SER
A
503
L
-
HA
ILE
V
320
R
H
CB
SER
A
503
L
-
N
ILE
V
321
R
H
CB
SER
A
503
L
-
H
ILE
V
321
R
H
O
SER
A
503
L
-
N
GLU
V
318
R
H
O
SER
A
503
L
-
CA
GLU
V
318
R
H
O
SER
A
503
L
-
C
GLU
V
318
R
H
O
SER
A
503
L
-
H
GLU
V
318
R
H
O
SER
A
503
L
-
HA
GLU
V
318
R
H
O
SER
A
503
L
-
N
ASN
V
319
R
H
O
SER
A
503
L
-
CA
ASN
V
319
R
H
O
SER
A
503
L
-
C
ASN
V
319
R
H
O
SER
A
503
L
-
O
ASN
V
319
R
H
O
SER
A
503
L
-
H
ASN
V
319
R
H
O
SER
A
503
L
-
HA
ASN
V
319
R
H
O
SER
A
503
L
-
N
ILE
V
320
R
H
O
SER
A
503
L
-
CG1
ILE
V
320
R
H
O
SER
A
503
L
-
H
ILE
V
320
R
H
O
SER
A
503
L
-
HA
ILE
V
320
R
H
O
SER
A
503
L
-
HG12
ILE
V
320
R
H
O
SER
A
503
L
-
HG13
ILE
V
320
R
H
OG
SER
A
503
L
-
O
ASN
V
319
R
H
OG
SER
A
503
L
-
CA
ILE
V
320
R
H
OG
SER
A
503
L
-
HA
ILE
V
320
R
H
OG
SER
A
503
L
-
HG12
ILE
V
320
R
H
OG
SER
A
503
L
-
HG22
ILE
V
320
R
H
OG
SER
A
503
L
-
H
ILE
V
321
R
H
N
ARG
A
504
L
-
O
ASN
V
319
R
H
N
ARG
A
504
L
-
H
ASN
V
319
R
H
C
ARG
A
504
L
-
H
GLU
V
318
R
H
O
ARG
A
504
L
-
H
GLU
V
318
R
H
N
TYR
A
505
L
-
H
GLU
V
318
R
H
CA
TYR
A
505
L
-
H
GLN
V
317
R
H
C
TYR
A
505
L
-
N
GLN
V
317
R
H
C
TYR
A
505
L
-
H
GLN
V
317
R
H
C
TYR
A
505
L
-
HA
GLN
V
317
R
H
C
TYR
A
505
L
-
H
GLU
V
318
R
H
O
TYR
A
505
L
-
C
GLN
V
316
R
H
O
TYR
A
505
L
-
N
GLN
V
317
R
H
O
TYR
A
505
L
-
CA
GLN
V
317
R
H
O
TYR
A
505
L
-
H
GLN
V
317
R
H
O
TYR
A
505
L
-
HA
GLN
V
317
R
-
N
GLY
A
506
L
-
N
GLN
V
317
R
-
N
GLY
A
506
L
-
H
GLN
V
317
R
-
N
GLY
A
506
L
-
H
GLU
V
318
R
-
CA
GLY
A
506
L
-
N
GLN
V
317
R
-
CA
GLY
A
506
L
-
H
GLN
V
317
R
H
N
GLY
A
508
L
-
H
LEU
V
315
R
H
CA
GLY
A
508
L
-
CA
GLU
V
314
R
H
CA
GLY
A
508
L
-
C
GLU
V
314
R
H
CA
GLY
A
508
L
-
HA
GLU
V
314
R
H
CA
GLY
A
508
L
-
N
LEU
V
315
R
H
CA
GLY
A
508
L
-
H
LEU
V
315
R
H
C
GLY
A
508
L
-
CA
GLU
V
314
R
H
C
GLY
A
508
L
-
HA
GLU
V
314
R
H
C
GLY
A
508
L
-
HB3
GLU
V
314
R
H
C
GLY
A
508
L
-
N
LEU
V
315
R
H
C
GLY
A
508
L
-
H
LEU
V
315
R
H
O
GLY
A
508
L
-
CA
GLU
V
314
R
H
O
GLY
A
508
L
-
C
GLU
V
314
R
H
O
GLY
A
508
L
-
CB
GLU
V
314
R
H
O
GLY
A
508
L
-
CG
GLU
V
314
R
H
O
GLY
A
508
L
-
HA
GLU
V
314
R
H
O
GLY
A
508
L
-
HB3
GLU
V
314
R
H
O
GLY
A
508
L
-
HG2
GLU
V
314
R
H
O
GLY
A
508
L
-
N
LEU
V
315
R
H
O
GLY
A
508
L
-
H
LEU
V
315
R
H
N
LYS
A
509
L
-
H
LEU
V
315
R
H
CG
LYS
A
509
L
-
HA
LEU
V
315
R
H
CG
LYS
A
509
L
-
H
GLN
V
316
R
H
CD
LYS
A
509
L
-
H
GLN
V
316
R
H
CE
LYS
A
509
L
-
HD21
LEU
V
315
R
H
CE
LYS
A
509
L
-
H
GLN
V
316
R
S
OH
TYR
A
511
L
-
CG
GLU
V
314
R
S
OH
TYR
A
511
L
-
OE1
GLU
V
314
R
S
OH
TYR
A
511
L
-
HG2
GLU
V
314
R
S
OH
TYR
A
511
L
-
HG3
GLU
V
314
R
S
CZ
TYR
A
511
L
-
HG2
GLU
V
314
R
-
CG
PRO
A
528
L
-
CA
GLY
V
29
R
-
CG
PRO
A
528
L
-
C
GLY
V
29
R
-
CG
PRO
A
528
L
-
O
GLY
V
29
R
-
CG
PRO
A
528
L
-
HA2
GLY
V
29
R
-
CG
PRO
A
528
L
-
HA3
GLY
V
29
R
-
CD
PRO
A
528
L
-
O
GLY
V
29
R
-
CD
GLN
A
531
L
-
O
GLY
V
29
R
-
NE2
GLN
A
531
L
-
O
GLY
V
29
R
-
OE1
GLN
A
531
L
-
O
GLY
V
29
R
S
CD2
LEU
A
566
L
-
O
LYS
V
313
R
S
CD2
LEU
A
566
L
-
H
LYS
V
313
R
-
CG
HIS
A
568
L
-
HB3
PRO
V
311
R
-
CD2
HIS
A
568
L
-
CB
PRO
V
311
R
-
CD2
HIS
A
568
L
-
HB2
PRO
V
311
R
-
CD2
HIS
A
568
L
-
HB3
PRO
V
311
R
-
ND1
HIS
A
568
L
-
HA
PRO
V
311
R
-
ND1
HIS
A
568
L
-
HB2
PRO
V
311
R
-
ND1
HIS
A
568
L
-
HB3
PRO
V
311
R
-
CE1
HIS
A
568
L
-
CA
PRO
V
311
R
-
CE1
HIS
A
568
L
-
CB
PRO
V
311
R
-
CE1
HIS
A
568
L
-
HA
PRO
V
311
R
-
CE1
HIS
A
568
L
-
HB2
PRO
V
311
R
-
CE1
HIS
A
568
L
-
HB3
PRO
V
311
R
-
CE1
HIS
A
568
L
-
N
THR
V
312
R
-
CE1
HIS
A
568
L
-
H
THR
V
312
R
-
NE2
HIS
A
568
L
-
CA
PRO
V
311
R
-
NE2
HIS
A
568
L
-
CB
PRO
V
311
R
-
NE2
HIS
A
568
L
-
HA
PRO
V
311
R
-
NE2
HIS
A
568
L
-
HB2
PRO
V
311
R
-
NE2
HIS
A
568
L
-
HB3
PRO
V
311
R
H
CD
ARG
A
577
L
-
CD
GLN
V
393
R
H
CD
ARG
A
577
L
-
OE1
GLN
V
393
R
H
NE
ARG
A
577
L
-
CD
GLN
V
393
R
H
NE
ARG
A
577
L
-
OE1
GLN
V
393
R
H
NE
ARG
A
577
L
-
HG3
GLN
V
393
R
H
NH1
ARG
A
577
L
-
CB
GLN
V
393
R
H
NH1
ARG
A
577
L
-
CG
GLN
V
393
R
H
NH1
ARG
A
577
L
-
CD
GLN
V
393
R
H
NH1
ARG
A
577
L
-
NE2
GLN
V
393
R
H
NH1
ARG
A
577
L
-
OE1
GLN
V
393
R
H
NH1
ARG
A
577
L
-
H
GLN
V
393
R
H
NH1
ARG
A
577
L
-
HB2
GLN
V
393
R
H
NH1
ARG
A
577
L
-
HB3
GLN
V
393
R
H
NH1
ARG
A
577
L
-
HG2
GLN
V
393
R
H
NH1
ARG
A
577
L
-
HG3
GLN
V
393
R
H
NH1
ARG
A
577
L
-
HE21
GLN
V
393
R
H
NH1
ARG
A
577
L
-
HE22
GLN
V
393
R
H
NH2
ARG
A
577
L
-
N
GLN
V
393
R
H
NH2
ARG
A
577
L
-
CB
GLN
V
393
R
H
NH2
ARG
A
577
L
-
CG
GLN
V
393
R
H
NH2
ARG
A
577
L
-
CD
GLN
V
393
R
H
NH2
ARG
A
577
L
-
OE1
GLN
V
393
R
H
NH2
ARG
A
577
L
-
H
GLN
V
393
R
H
NH2
ARG
A
577
L
-
HB2
GLN
V
393
R
H
NH2
ARG
A
577
L
-
HG3
GLN
V
393
R
H
CZ
ARG
A
577
L
-
CB
GLN
V
393
R
H
CZ
ARG
A
577
L
-
CG
GLN
V
393
R
H
CZ
ARG
A
577
L
-
CD
GLN
V
393
R
H
CZ
ARG
A
577
L
-
NE2
GLN
V
393
R
H
CZ
ARG
A
577
L
-
OE1
GLN
V
393
R
H
CZ
ARG
A
577
L
-
H
GLN
V
393
R
H
CZ
ARG
A
577
L
-
HB2
GLN
V
393
R
H
CZ
ARG
A
577
L
-
HG3
GLN
V
393
R
H
CZ
ARG
A
577
L
-
HE22
GLN
V
393
R
-
OD2
ASP
A
585
L
-
HB2
SER
V
396
R
-
C
GLU
A
592
L
-
CE1
HIS
V
373
R
-
C
GLU
A
592
L
-
HE1
HIS
V
373
R
-
O
GLU
A
592
L
-
ND1
HIS
V
373
R
-
O
GLU
A
592
L
-
CE1
HIS
V
373
R
-
O
GLU
A
592
L
-
NE2
HIS
V
373
R
-
O
GLU
A
592
L
-
HE1
HIS
V
373
R
-
O
GLU
A
592
L
-
HE2
HIS
V
373
R
-
N
PRO
A
593
L
-
HE1
HIS
V
373
R
-
CA
PRO
A
593
L
-
ND1
HIS
V
373
R
-
CA
PRO
A
593
L
-
CE1
HIS
V
373
R
-
CA
PRO
A
593
L
-
HE1
HIS
V
373
R
-
C
PRO
A
593
L
-
ND1
HIS
V
373
R
-
C
PRO
A
593
L
-
CE1
HIS
V
373
R
-
CB
PRO
A
593
L
-
ND1
HIS
V
373
R
-
N
SER
A
594
L
-
CB
HIS
V
373
R
-
N
SER
A
594
L
-
CG
HIS
V
373
R
-
N
SER
A
594
L
-
CD2
HIS
V
373
R
-
N
SER
A
594
L
-
ND1
HIS
V
373
R
-
N
SER
A
594
L
-
CE1
HIS
V
373
R
-
N
SER
A
594
L
-
NE2
HIS
V
373
R
-
N
SER
A
594
L
-
HB2
HIS
V
373
R
-
N
SER
A
594
L
-
HB3
HIS
V
373
R
-
N
SER
A
594
L
-
HD2
HIS
V
373
R
-
N
SER
A
594
L
-
HE1
HIS
V
373
R
-
N
SER
A
594
L
-
HE2
HIS
V
373
R
-
CA
SER
A
594
L
-
CG
HIS
V
373
R
-
CA
SER
A
594
L
-
CD2
HIS
V
373
R
-
CA
SER
A
594
L
-
HB2
HIS
V
373
R
-
CA
SER
A
594
L
-
HD2
HIS
V
373
R
-
C
SER
A
594
L
-
CB
HIS
V
373
R
-
C
SER
A
594
L
-
HB2
HIS
V
373
R
-
C
SER
A
594
L
-
HB3
HIS
V
373
R
-
CB
SER
A
594
L
-
CG
HIS
V
373
R
-
CB
SER
A
594
L
-
CD2
HIS
V
373
R
-
CB
SER
A
594
L
-
NE2
HIS
V
373
R
-
CB
SER
A
594
L
-
HB2
HIS
V
373
R
-
CB
SER
A
594
L
-
HD2
HIS
V
373
R
-
CB
SER
A
594
L
-
HE2
HIS
V
373
R
-
O
SER
A
594
L
-
CB
HIS
V
373
R
-
O
SER
A
594
L
-
CG
HIS
V
373
R
-
O
SER
A
594
L
-
CD2
HIS
V
373
R
-
O
SER
A
594
L
-
HB2
HIS
V
373
R
-
O
SER
A
594
L
-
HB3
HIS
V
373
R
-
O
SER
A
594
L
-
HD2
HIS
V
373
R
-
OG
SER
A
594
L
-
HG11
VAL
V
371
R
-
OG
SER
A
594
L
-
CB
HIS
V
373
R
-
OG
SER
A
594
L
-
CG
HIS
V
373
R
-
OG
SER
A
594
L
-
CD2
HIS
V
373
R
-
OG
SER
A
594
L
-
ND1
HIS
V
373
R
-
OG
SER
A
594
L
-
CE1
HIS
V
373
R
-
OG
SER
A
594
L
-
NE2
HIS
V
373
R
-
OG
SER
A
594
L
-
H
HIS
V
373
R
-
OG
SER
A
594
L
-
HB2
HIS
V
373
R
-
OG
SER
A
594
L
-
HB3
HIS
V
373
R
-
OG
SER
A
594
L
-
HD2
HIS
V
373
R
-
OG
SER
A
594
L
-
HE2
HIS
V
373
R
S
CD
GLU
A
633
L
-
HG12
VAL
V
342
R
S
OE1
GLU
A
633
L
-
CG1
VAL
V
342
R
S
OE1
GLU
A
633
L
-
HG12
VAL
V
342
R
S
OE1
GLU
A
633
L
-
HG13
VAL
V
342
R
S
OE1
GLU
A
633
L
-
HB3
PRO
V
343
R
S
CD
GLU
A
647
L
-
CE
LYS
V
347
R
S
CD
GLU
A
647
L
-
HE2
LYS
V
347
R
S
CD
GLU
A
647
L
-
HE3
LYS
V
347
R
S
OE1
GLU
A
647
L
-
CE
LYS
V
347
R
S
OE1
GLU
A
647
L
-
HE2
LYS
V
347
R
S
OE1
GLU
A
647
L
-
HE3
LYS
V
347
R
S
OE2
GLU
A
647
L
-
CE
LYS
V
347
R
S
OE2
GLU
A
647
L
-
HE2
LYS
V
347
R
S
OE2
GLU
A
647
L
-
HE3
LYS
V
347
R
S
OE2
GLU
A
647
L
-
HZ2
LYS
V
347
R
S
NE
ARG
A
652
L
-
HG12
VAL
V
345
R
S
NE
ARG
A
652
L
-
HG13
VAL
V
345
R
S
NH1
ARG
A
652
L
-
CB
VAL
V
345
R
S
NH1
ARG
A
652
L
-
CG1
VAL
V
345
R
S
NH1
ARG
A
652
L
-
CG2
VAL
V
345
R
S
NH1
ARG
A
652
L
-
HB
VAL
V
345
R
S
NH1
ARG
A
652
L
-
HG11
VAL
V
345
R
S
NH1
ARG
A
652
L
-
HG12
VAL
V
345
R
S
NH1
ARG
A
652
L
-
HG13
VAL
V
345
R
S
NH1
ARG
A
652
L
-
HG21
VAL
V
345
R
S
NH1
ARG
A
652
L
-
HG22
VAL
V
345
R
S
NH1
ARG
A
652
L
-
HG23
VAL
V
345
R
S
NH2
ARG
A
652
L
-
CG1
VAL
V
345
R
S
NH2
ARG
A
652
L
-
HG11
VAL
V
345
R
S
NH2
ARG
A
652
L
-
HG12
VAL
V
345
R
S
NH2
ARG
A
652
L
-
HG13
VAL
V
345
R
S
NH2
ARG
A
652
L
-
CD
LYS
V
347
R
S
NH2
ARG
A
652
L
-
CE
LYS
V
347
R
S
NH2
ARG
A
652
L
-
HG3
LYS
V
347
R
S
NH2
ARG
A
652
L
-
HD2
LYS
V
347
R
S
NH2
ARG
A
652
L
-
HE2
LYS
V
347
R
S
NH2
ARG
A
652
L
-
HE3
LYS
V
347
R
S
CZ
ARG
A
652
L
-
CG1
VAL
V
345
R
S
CZ
ARG
A
652
L
-
HG11
VAL
V
345
R
S
CZ
ARG
A
652
L
-
HG12
VAL
V
345
R
S
CZ
ARG
A
652
L
-
HG13
VAL
V
345
R
S
CZ
ARG
A
652
L
-
HG22
VAL
V
345
R
S
CZ
ARG
A
652
L
-
HG23
VAL
V
345
R
-
O
SER
A
675
L
-
HA
ASP
V
661