A1IGU5_Q13588.1
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
LEU
A
231
L
-
PRO
V
193
R
H
LEU
A
231
L
H
ARG
V
209
R
H
ARG
A
234
L
-
PRO
V
193
R
H
LEU
A
235
L
-
HIS
V
194
R
H
GLU
A
285
L
-
GLU
V
152
R
H
ASN
A
288
L
-
LEU
V
155
R
H
ASN
A
289
L
-
GLU
V
152
R
-
PHE
A
303
L
S
ARG
V
54
R
-
PHE
A
303
L
-
LEU
V
6
R
H
PRO
A
305
L
-
LYS
V
21
R
-
TYR
A
308
L
-
LYS
V
21
R
-
LEU
A
310
L
-
LYS
V
21
R
H
TYR
A
320
L
-
GLY
V
22
R
H
PHE
A
456
L
-
ARG
V
42
R
H
ARG
A
457
L
-
ARG
V
42
R
H
ARG
A
457
L
-
GLY
V
43
R
H
ARG
A
457
L
S
VAL
V
44
R
H
VAL
A
460
L
-
ARG
V
42
R
H
GLU
A
461
L
S
VAL
V
44
R
H
LEU
A
464
L
-
ALA
V
18
R
H
THR
A
467
L
-
GLN
V
10
R
H
SER
A
468
L
-
ALA
V
11
R
H
SER
A
468
L
-
THR
V
12
R
H
LEU
A
471
L
-
GLN
V
10
R
H
LEU
A
471
L
-
THR
V
12
R
H
ARG
A
472
L
-
THR
V
12
R
H
ARG
A
472
L
-
GLU
V
13
R
H
GLN
A
475
L
-
THR
V
12
R
-
SER
A
518
L
S
TRP
V
36
R
-
GLY
A
519
L
S
TRP
V
36
R
-
THR
A
520
L
-
GLU
V
13
R
-
THR
A
520
L
-
ASP
V
15
R
-
THR
A
520
L
-
GLU
V
16
R
-
THR
A
520
L
S
PHE
V
47
R
-
GLY
A
521
L
-
ASP
V
15
R
-
GLY
A
521
L
-
ASP
V
33
R
-
GLY
A
521
L
S
PHE
V
47
R
-
THR
A
522
L
-
ASP
V
32
R
-
THR
A
522
L
S
PHE
V
47
R
-
LEU
A
523
L
-
ASP
V
32
R
-
LEU
A
523
L
-
ASP
V
33
R
-
ASP
A
524
L
-
ASP
V
33
R
-
THR
A
526
L
-
ASN
V
35
R
-
THR
A
526
L
S
TRP
V
36
R
-
HIS
A
555
L
-
GLN
V
34
R
-
THR
A
603
L
-
ASP
V
168
R
-
THR
A
603
L
-
SER
V
170
R
-
ASN
A
605
L
-
PHE
V
169
R
-
ASN
A
605
L
-
SER
V
170
R
-
ASN
A
605
L
-
GLN
V
172
R
-
GLN
A
606
L
-
GLN
V
172
R
S
VAL
A
607
L
-
GLN
V
172
R
S
ILE
A
631
L
-
GLN
V
172
R
S
ILE
A
631
L
-
ASP
V
173
R
S
ILE
A
631
L
-
GLN
V
176
R
S
LEU
A
632
L
-
GLN
V
172
R
S
LEU
A
632
L
-
ASP
V
173
R
S
LEU
A
632
L
-
PRO
V
174
R
S
GLU
A
633
L
-
ASP
V
173
R
S
GLU
A
633
L
-
PRO
V
174
R
-
ALA
A
634
L
-
ASP
V
173
R
-
ALA
A
634
L
-
SER
V
175
R
-
ALA
A
634
L
-
GLN
V
176
R
-
GLN
A
635
L
-
SER
V
175
R
-
GLN
A
635
L
S
PHE
V
206
R
-
PRO
A
641
L
-
PRO
V
191
R
S
ARG
A
662
L
-
PHE
V
169
R
S
ARG
A
662
L
S
TRP
V
195
R
S
ARG
A
662
L
S
PRO
V
208
R
S
ARG
A
662
L
H
TYR
V
211
A1IGU5_Q13588.1
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
CB
LEU
A
231
L
-
HB2
PRO
V
193
R
H
CB
LEU
A
231
L
-
HB3
PRO
V
193
R
H
CG
LEU
A
231
L
-
CB
PRO
V
193
R
H
CG
LEU
A
231
L
-
O
PRO
V
193
R
H
CG
LEU
A
231
L
-
HB2
PRO
V
193
R
H
CG
LEU
A
231
L
-
HB3
PRO
V
193
R
H
CD1
LEU
A
231
L
-
C
PRO
V
193
R
H
CD1
LEU
A
231
L
-
CB
PRO
V
193
R
H
CD1
LEU
A
231
L
-
O
PRO
V
193
R
H
CD1
LEU
A
231
L
-
HB2
PRO
V
193
R
H
CD1
LEU
A
231
L
-
HB3
PRO
V
193
R
H
CD1
LEU
A
231
L
H
CD
ARG
V
209
R
H
CD1
LEU
A
231
L
H
HD3
ARG
V
209
R
H
CD2
LEU
A
231
L
-
CA
PRO
V
193
R
H
CD2
LEU
A
231
L
-
C
PRO
V
193
R
H
CD2
LEU
A
231
L
-
CB
PRO
V
193
R
H
CD2
LEU
A
231
L
-
O
PRO
V
193
R
H
CD2
LEU
A
231
L
-
CG
PRO
V
193
R
H
CD2
LEU
A
231
L
-
HA
PRO
V
193
R
H
CD2
LEU
A
231
L
-
HB2
PRO
V
193
R
H
CD2
LEU
A
231
L
-
HB3
PRO
V
193
R
H
CD2
LEU
A
231
L
-
HG2
PRO
V
193
R
H
CD2
LEU
A
231
L
-
HG3
PRO
V
193
R
H
CD
ARG
A
234
L
-
HG3
PRO
V
193
R
H
NE
ARG
A
234
L
-
HG3
PRO
V
193
R
H
NH1
ARG
A
234
L
-
CG
PRO
V
193
R
H
NH1
ARG
A
234
L
-
CD
PRO
V
193
R
H
NH1
ARG
A
234
L
-
HG2
PRO
V
193
R
H
NH1
ARG
A
234
L
-
HG3
PRO
V
193
R
H
NH1
ARG
A
234
L
-
HD3
PRO
V
193
R
H
CZ
ARG
A
234
L
-
HG2
PRO
V
193
R
H
CZ
ARG
A
234
L
-
HG3
PRO
V
193
R
H
CG
LEU
A
235
L
-
CE1
HIS
V
194
R
H
CG
LEU
A
235
L
-
NE2
HIS
V
194
R
H
CG
LEU
A
235
L
-
HE1
HIS
V
194
R
H
CD1
LEU
A
235
L
-
NE2
HIS
V
194
R
H
CD2
LEU
A
235
L
-
CE1
HIS
V
194
R
H
CD2
LEU
A
235
L
-
NE2
HIS
V
194
R
H
CD2
LEU
A
235
L
-
HE1
HIS
V
194
R
H
CG
GLU
A
285
L
-
OE2
GLU
V
152
R
H
CD
GLU
A
285
L
-
CG
GLU
V
152
R
H
CD
GLU
A
285
L
-
CD
GLU
V
152
R
H
CD
GLU
A
285
L
-
OE1
GLU
V
152
R
H
CD
GLU
A
285
L
-
OE2
GLU
V
152
R
H
CD
GLU
A
285
L
-
HG2
GLU
V
152
R
H
OE1
GLU
A
285
L
-
CG
GLU
V
152
R
H
OE1
GLU
A
285
L
-
CD
GLU
V
152
R
H
OE1
GLU
A
285
L
-
OE1
GLU
V
152
R
H
OE1
GLU
A
285
L
-
OE2
GLU
V
152
R
H
OE1
GLU
A
285
L
-
HB2
GLU
V
152
R
H
OE1
GLU
A
285
L
-
HG2
GLU
V
152
R
H
OE1
GLU
A
285
L
-
HG3
GLU
V
152
R
H
OE2
GLU
A
285
L
-
CG
GLU
V
152
R
H
OE2
GLU
A
285
L
-
CD
GLU
V
152
R
H
OE2
GLU
A
285
L
-
OE1
GLU
V
152
R
H
OE2
GLU
A
285
L
-
OE2
GLU
V
152
R
H
OE2
GLU
A
285
L
-
HG2
GLU
V
152
R
H
CB
ASN
A
288
L
-
HD12
LEU
V
155
R
H
CB
ASN
A
288
L
-
HD22
LEU
V
155
R
H
CG
ASN
A
288
L
-
HD12
LEU
V
155
R
H
ND2
ASN
A
288
L
-
CD1
LEU
V
155
R
H
ND2
ASN
A
288
L
-
HD12
LEU
V
155
R
H
ND2
ASN
A
288
L
-
HD13
LEU
V
155
R
H
CB
ASN
A
289
L
-
OE1
GLU
V
152
R
H
CG
ASN
A
289
L
-
CD
GLU
V
152
R
H
CG
ASN
A
289
L
-
OE1
GLU
V
152
R
H
ND2
ASN
A
289
L
-
CD
GLU
V
152
R
H
ND2
ASN
A
289
L
-
OE1
GLU
V
152
R
H
ND2
ASN
A
289
L
-
OE2
GLU
V
152
R
H
OD1
ASN
A
289
L
-
CG
GLU
V
152
R
H
OD1
ASN
A
289
L
-
CD
GLU
V
152
R
H
OD1
ASN
A
289
L
-
OE1
GLU
V
152
R
H
OD1
ASN
A
289
L
-
HG3
GLU
V
152
R
-
CB
PHE
A
303
L
S
HH12
ARG
V
54
R
-
CB
PHE
A
303
L
S
HH22
ARG
V
54
R
-
CG
PHE
A
303
L
S
HH12
ARG
V
54
R
-
CG
PHE
A
303
L
S
HH22
ARG
V
54
R
-
CD1
PHE
A
303
L
S
NH2
ARG
V
54
R
-
CD1
PHE
A
303
L
S
HH12
ARG
V
54
R
-
CD1
PHE
A
303
L
S
HH22
ARG
V
54
R
-
CZ
PHE
A
303
L
-
HD23
LEU
V
6
R
H
CB
PRO
A
305
L
-
HE2
LYS
V
21
R
H
O
PRO
A
305
L
-
HE2
LYS
V
21
R
H
O
PRO
A
305
L
-
HZ1
LYS
V
21
R
H
O
PRO
A
305
L
-
HZ3
LYS
V
21
R
-
CB
TYR
A
308
L
-
NZ
LYS
V
21
R
-
CB
TYR
A
308
L
-
HZ1
LYS
V
21
R
-
CB
TYR
A
308
L
-
HZ2
LYS
V
21
R
-
CB
TYR
A
308
L
-
HZ3
LYS
V
21
R
-
O
TYR
A
308
L
-
HZ3
LYS
V
21
R
-
CG
TYR
A
308
L
-
HZ1
LYS
V
21
R
-
CD2
TYR
A
308
L
-
HZ1
LYS
V
21
R
-
CG
LEU
A
310
L
-
HD3
LYS
V
21
R
-
CG
LEU
A
310
L
-
HZ3
LYS
V
21
R
-
CD1
LEU
A
310
L
-
CD
LYS
V
21
R
-
CD1
LEU
A
310
L
-
HB3
LYS
V
21
R
-
CD1
LEU
A
310
L
-
HD3
LYS
V
21
R
-
CD2
LEU
A
310
L
-
HD2
LYS
V
21
R
-
CD2
LEU
A
310
L
-
HD3
LYS
V
21
R
-
CD2
LEU
A
310
L
-
HZ2
LYS
V
21
R
-
CD2
LEU
A
310
L
-
HZ3
LYS
V
21
R
H
CE1
TYR
A
320
L
-
HA3
GLY
V
22
R
H
OH
TYR
A
320
L
-
O
GLY
V
22
R
H
OH
TYR
A
320
L
-
HA3
GLY
V
22
R
H
CZ
TYR
A
320
L
-
HA3
GLY
V
22
R
H
CE1
PHE
A
456
L
-
NH1
ARG
V
42
R
H
CE1
PHE
A
456
L
-
HH11
ARG
V
42
R
H
CE1
PHE
A
456
L
-
HH12
ARG
V
42
R
H
CZ
PHE
A
456
L
-
HH12
ARG
V
42
R
H
NH1
ARG
A
457
L
-
HA3
GLY
V
43
R
H
NH2
ARG
A
457
L
-
O
ARG
V
42
R
H
NH2
ARG
A
457
L
-
O
GLY
V
43
R
H
NH2
ARG
A
457
L
-
HA3
GLY
V
43
R
H
NH2
ARG
A
457
L
S
HG21
VAL
V
44
R
H
NH2
ARG
A
457
L
S
HG22
VAL
V
44
R
H
CZ
ARG
A
457
L
-
O
ARG
V
42
R
H
CB
VAL
A
460
L
-
HH11
ARG
V
42
R
H
CG1
VAL
A
460
L
-
HH11
ARG
V
42
R
H
CG2
VAL
A
460
L
-
NH1
ARG
V
42
R
H
CG2
VAL
A
460
L
-
HH11
ARG
V
42
R
H
CG2
VAL
A
460
L
-
HH12
ARG
V
42
R
H
CG
GLU
A
461
L
S
HG23
VAL
V
44
R
H
OE1
GLU
A
461
L
S
HG22
VAL
V
44
R
H
OE1
GLU
A
461
L
S
HG23
VAL
V
44
R
H
CB
LEU
A
464
L
-
HB1
ALA
V
18
R
H
CG
LEU
A
464
L
-
CB
ALA
V
18
R
H
CG
LEU
A
464
L
-
HB1
ALA
V
18
R
H
CD1
LEU
A
464
L
-
HB1
ALA
V
18
R
H
CD2
LEU
A
464
L
-
CB
ALA
V
18
R
H
CD2
LEU
A
464
L
-
HB1
ALA
V
18
R
H
CD2
LEU
A
464
L
-
HB2
ALA
V
18
R
H
CD2
LEU
A
464
L
-
HB3
ALA
V
18
R
H
CB
THR
A
467
L
-
HG3
GLN
V
10
R
H
O
THR
A
467
L
-
OE1
GLN
V
10
R
H
O
THR
A
467
L
-
HB3
GLN
V
10
R
H
OG1
THR
A
467
L
-
HG3
GLN
V
10
R
H
N
SER
A
468
L
-
O
ALA
V
11
R
H
CA
SER
A
468
L
-
C
ALA
V
11
R
H
CA
SER
A
468
L
-
O
ALA
V
11
R
H
C
SER
A
468
L
-
O
ALA
V
11
R
H
CB
SER
A
468
L
-
C
ALA
V
11
R
H
CB
SER
A
468
L
-
O
ALA
V
11
R
H
CB
SER
A
468
L
-
HB2
ALA
V
11
R
H
O
SER
A
468
L
-
O
ALA
V
11
R
H
O
SER
A
468
L
-
HA
THR
V
12
R
H
OG
SER
A
468
L
-
CA
ALA
V
11
R
H
OG
SER
A
468
L
-
C
ALA
V
11
R
H
OG
SER
A
468
L
-
CB
ALA
V
11
R
H
OG
SER
A
468
L
-
O
ALA
V
11
R
H
OG
SER
A
468
L
-
HB1
ALA
V
11
R
H
OG
SER
A
468
L
-
HB2
ALA
V
11
R
H
OG
SER
A
468
L
-
N
THR
V
12
R
H
OG
SER
A
468
L
-
CA
THR
V
12
R
H
OG
SER
A
468
L
-
C
THR
V
12
R
H
OG
SER
A
468
L
-
HA
THR
V
12
R
H
C
LEU
A
471
L
-
HG22
THR
V
12
R
H
CB
LEU
A
471
L
-
OE1
GLN
V
10
R
H
CB
LEU
A
471
L
-
HB3
GLN
V
10
R
H
CB
LEU
A
471
L
-
HG22
THR
V
12
R
H
O
LEU
A
471
L
-
HG22
THR
V
12
R
H
CG
LEU
A
471
L
-
HB2
GLN
V
10
R
H
CG
LEU
A
471
L
-
CG2
THR
V
12
R
H
CG
LEU
A
471
L
-
HG21
THR
V
12
R
H
CG
LEU
A
471
L
-
HG22
THR
V
12
R
H
CG
LEU
A
471
L
-
HG23
THR
V
12
R
H
CD1
LEU
A
471
L
-
HG22
THR
V
12
R
H
CD2
LEU
A
471
L
-
C
GLN
V
10
R
H
CD2
LEU
A
471
L
-
CB
GLN
V
10
R
H
CD2
LEU
A
471
L
-
O
GLN
V
10
R
H
CD2
LEU
A
471
L
-
OE1
GLN
V
10
R
H
CD2
LEU
A
471
L
-
HB2
GLN
V
10
R
H
CD2
LEU
A
471
L
-
HB3
GLN
V
10
R
H
CD2
LEU
A
471
L
-
CG2
THR
V
12
R
H
CD2
LEU
A
471
L
-
HG21
THR
V
12
R
H
CD2
LEU
A
471
L
-
HG22
THR
V
12
R
H
CD2
LEU
A
471
L
-
HG23
THR
V
12
R
H
N
ARG
A
472
L
-
HG22
THR
V
12
R
H
NE
ARG
A
472
L
-
O
THR
V
12
R
H
NH2
ARG
A
472
L
-
C
THR
V
12
R
H
NH2
ARG
A
472
L
-
O
THR
V
12
R
H
NH2
ARG
A
472
L
-
HA
GLU
V
13
R
H
CZ
ARG
A
472
L
-
O
THR
V
12
R
H
CZ
ARG
A
472
L
-
HA
GLU
V
13
R
H
CD
GLN
A
475
L
-
CB
THR
V
12
R
H
CD
GLN
A
475
L
-
CG2
THR
V
12
R
H
CD
GLN
A
475
L
-
HB
THR
V
12
R
H
CD
GLN
A
475
L
-
HG21
THR
V
12
R
H
CD
GLN
A
475
L
-
HG22
THR
V
12
R
H
NE2
GLN
A
475
L
-
CB
THR
V
12
R
H
NE2
GLN
A
475
L
-
CG2
THR
V
12
R
H
NE2
GLN
A
475
L
-
OG1
THR
V
12
R
H
NE2
GLN
A
475
L
-
HB
THR
V
12
R
H
NE2
GLN
A
475
L
-
HG21
THR
V
12
R
H
NE2
GLN
A
475
L
-
HG22
THR
V
12
R
H
NE2
GLN
A
475
L
-
HG23
THR
V
12
R
H
OE1
GLN
A
475
L
-
CB
THR
V
12
R
H
OE1
GLN
A
475
L
-
CG2
THR
V
12
R
H
OE1
GLN
A
475
L
-
HB
THR
V
12
R
H
OE1
GLN
A
475
L
-
HG21
THR
V
12
R
H
OE1
GLN
A
475
L
-
HG22
THR
V
12
R
-
C
SER
A
518
L
S
HE1
TRP
V
36
R
-
CB
SER
A
518
L
S
HZ2
TRP
V
36
R
-
N
GLY
A
519
L
S
NE1
TRP
V
36
R
-
N
GLY
A
519
L
S
HE1
TRP
V
36
R
-
CA
GLY
A
519
L
S
HE1
TRP
V
36
R
-
C
GLY
A
519
L
S
CD1
TRP
V
36
R
-
C
GLY
A
519
L
S
CE2
TRP
V
36
R
-
C
GLY
A
519
L
S
NE1
TRP
V
36
R
-
C
GLY
A
519
L
S
HD1
TRP
V
36
R
-
C
GLY
A
519
L
S
HE1
TRP
V
36
R
-
O
GLY
A
519
L
S
CG
TRP
V
36
R
-
O
GLY
A
519
L
S
CD1
TRP
V
36
R
-
O
GLY
A
519
L
S
CD2
TRP
V
36
R
-
O
GLY
A
519
L
S
CE2
TRP
V
36
R
-
O
GLY
A
519
L
S
NE1
TRP
V
36
R
-
O
GLY
A
519
L
S
CZ2
TRP
V
36
R
-
O
GLY
A
519
L
S
HB2
TRP
V
36
R
-
O
GLY
A
519
L
S
HD1
TRP
V
36
R
-
O
GLY
A
519
L
S
HZ2
TRP
V
36
R
-
O
GLY
A
519
L
S
HE1
TRP
V
36
R
-
CA
THR
A
520
L
-
OD2
ASP
V
15
R
-
C
THR
A
520
L
-
OD2
ASP
V
15
R
-
C
THR
A
520
L
S
CG
PHE
V
47
R
-
C
THR
A
520
L
S
CD2
PHE
V
47
R
-
C
THR
A
520
L
S
CE2
PHE
V
47
R
-
C
THR
A
520
L
S
HD2
PHE
V
47
R
-
CB
THR
A
520
L
-
CG
ASP
V
15
R
-
CB
THR
A
520
L
-
OD1
ASP
V
15
R
-
CB
THR
A
520
L
-
OD2
ASP
V
15
R
-
CB
THR
A
520
L
-
HG2
GLU
V
16
R
-
CB
THR
A
520
L
S
HD2
PHE
V
47
R
-
O
THR
A
520
L
-
OD2
ASP
V
15
R
-
O
THR
A
520
L
S
CB
PHE
V
47
R
-
O
THR
A
520
L
S
CG
PHE
V
47
R
-
O
THR
A
520
L
S
CD1
PHE
V
47
R
-
O
THR
A
520
L
S
CD2
PHE
V
47
R
-
O
THR
A
520
L
S
CE1
PHE
V
47
R
-
O
THR
A
520
L
S
CE2
PHE
V
47
R
-
O
THR
A
520
L
S
CZ
PHE
V
47
R
-
O
THR
A
520
L
S
HB2
PHE
V
47
R
-
O
THR
A
520
L
S
HB3
PHE
V
47
R
-
O
THR
A
520
L
S
HD1
PHE
V
47
R
-
O
THR
A
520
L
S
HD2
PHE
V
47
R
-
O
THR
A
520
L
S
HE2
PHE
V
47
R
-
O
THR
A
520
L
S
HZ
PHE
V
47
R
-
CG2
THR
A
520
L
-
HB2
GLU
V
13
R
-
CG2
THR
A
520
L
-
HG3
GLU
V
13
R
-
CG2
THR
A
520
L
-
OD1
ASP
V
15
R
-
CG2
THR
A
520
L
-
CG
GLU
V
16
R
-
CG2
THR
A
520
L
-
CD
GLU
V
16
R
-
CG2
THR
A
520
L
-
OE1
GLU
V
16
R
-
CG2
THR
A
520
L
-
HG2
GLU
V
16
R
-
CG2
THR
A
520
L
-
HG3
GLU
V
16
R
-
OG1
THR
A
520
L
-
HG3
GLU
V
13
R
-
OG1
THR
A
520
L
-
CG
ASP
V
15
R
-
OG1
THR
A
520
L
-
OD1
ASP
V
15
R
-
OG1
THR
A
520
L
-
OD2
ASP
V
15
R
-
N
GLY
A
521
L
-
OD2
ASP
V
15
R
-
CA
GLY
A
521
L
S
CZ
PHE
V
47
R
-
CA
GLY
A
521
L
S
HZ
PHE
V
47
R
-
O
GLY
A
521
L
-
OD2
ASP
V
33
R
-
O
GLY
A
521
L
-
HB2
ASP
V
33
R
-
N
THR
A
522
L
-
HB3
ASP
V
32
R
-
N
THR
A
522
L
S
HZ
PHE
V
47
R
-
CA
THR
A
522
L
-
CB
ASP
V
32
R
-
CA
THR
A
522
L
-
O
ASP
V
32
R
-
CA
THR
A
522
L
-
HB3
ASP
V
32
R
-
C
THR
A
522
L
-
O
ASP
V
32
R
-
C
THR
A
522
L
-
HB3
ASP
V
32
R
-
CB
THR
A
522
L
-
CB
ASP
V
32
R
-
CB
THR
A
522
L
-
CG
ASP
V
32
R
-
CB
THR
A
522
L
-
HB3
ASP
V
32
R
-
CG2
THR
A
522
L
-
CA
ASP
V
32
R
-
CG2
THR
A
522
L
-
CB
ASP
V
32
R
-
CG2
THR
A
522
L
-
O
ASP
V
32
R
-
CG2
THR
A
522
L
-
CG
ASP
V
32
R
-
CG2
THR
A
522
L
-
OD1
ASP
V
32
R
-
CG2
THR
A
522
L
-
OD2
ASP
V
32
R
-
CG2
THR
A
522
L
-
HA
ASP
V
32
R
-
CG2
THR
A
522
L
-
HB3
ASP
V
32
R
-
OG1
THR
A
522
L
-
CB
ASP
V
32
R
-
OG1
THR
A
522
L
-
CG
ASP
V
32
R
-
OG1
THR
A
522
L
-
OD2
ASP
V
32
R
-
OG1
THR
A
522
L
-
HB3
ASP
V
32
R
-
OG1
THR
A
522
L
S
HZ
PHE
V
47
R
-
N
LEU
A
523
L
-
C
ASP
V
32
R
-
N
LEU
A
523
L
-
O
ASP
V
32
R
-
N
LEU
A
523
L
-
HB3
ASP
V
32
R
-
N
LEU
A
523
L
-
HB2
ASP
V
33
R
-
CA
LEU
A
523
L
-
O
ASP
V
32
R
-
N
ASP
A
524
L
-
OD2
ASP
V
33
R
-
C
ASP
A
524
L
-
OD2
ASP
V
33
R
-
O
ASP
A
524
L
-
CG
ASP
V
33
R
-
O
ASP
A
524
L
-
OD2
ASP
V
33
R
-
N
THR
A
526
L
-
HD21
ASN
V
35
R
-
CB
THR
A
526
L
-
ND2
ASN
V
35
R
-
CB
THR
A
526
L
-
HD21
ASN
V
35
R
-
CB
THR
A
526
L
S
HE1
TRP
V
36
R
-
OG1
THR
A
526
L
-
HB2
ASN
V
35
R
-
OG1
THR
A
526
L
-
HD21
ASN
V
35
R
-
OG1
THR
A
526
L
S
CD1
TRP
V
36
R
-
OG1
THR
A
526
L
S
NE1
TRP
V
36
R
-
OG1
THR
A
526
L
S
HD1
TRP
V
36
R
-
OG1
THR
A
526
L
S
HE1
TRP
V
36
R
-
CB
HIS
A
555
L
-
HE22
GLN
V
34
R
-
CG
HIS
A
555
L
-
CD
GLN
V
34
R
-
CG
HIS
A
555
L
-
NE2
GLN
V
34
R
-
CG
HIS
A
555
L
-
OE1
GLN
V
34
R
-
CG
HIS
A
555
L
-
HE21
GLN
V
34
R
-
CG
HIS
A
555
L
-
HE22
GLN
V
34
R
-
CD2
HIS
A
555
L
-
CD
GLN
V
34
R
-
CD2
HIS
A
555
L
-
NE2
GLN
V
34
R
-
CD2
HIS
A
555
L
-
OE1
GLN
V
34
R
-
CD2
HIS
A
555
L
-
HE22
GLN
V
34
R
-
ND1
HIS
A
555
L
-
CD
GLN
V
34
R
-
ND1
HIS
A
555
L
-
NE2
GLN
V
34
R
-
ND1
HIS
A
555
L
-
OE1
GLN
V
34
R
-
ND1
HIS
A
555
L
-
HE21
GLN
V
34
R
-
ND1
HIS
A
555
L
-
HE22
GLN
V
34
R
-
CE1
HIS
A
555
L
-
CD
GLN
V
34
R
-
CE1
HIS
A
555
L
-
NE2
GLN
V
34
R
-
CE1
HIS
A
555
L
-
OE1
GLN
V
34
R
-
CE1
HIS
A
555
L
-
HE21
GLN
V
34
R
-
CE1
HIS
A
555
L
-
HE22
GLN
V
34
R
-
NE2
HIS
A
555
L
-
CD
GLN
V
34
R
-
NE2
HIS
A
555
L
-
NE2
GLN
V
34
R
-
NE2
HIS
A
555
L
-
OE1
GLN
V
34
R
-
NE2
HIS
A
555
L
-
HE22
GLN
V
34
R
-
N
THR
A
603
L
-
OG
SER
V
170
R
-
N
THR
A
603
L
-
HG
SER
V
170
R
-
CA
THR
A
603
L
-
OG
SER
V
170
R
-
CA
THR
A
603
L
-
HB2
SER
V
170
R
-
CA
THR
A
603
L
-
HG
SER
V
170
R
-
C
THR
A
603
L
-
CB
SER
V
170
R
-
C
THR
A
603
L
-
OG
SER
V
170
R
-
C
THR
A
603
L
-
HB2
SER
V
170
R
-
C
THR
A
603
L
-
HG
SER
V
170
R
-
CB
THR
A
603
L
-
CB
SER
V
170
R
-
CB
THR
A
603
L
-
OG
SER
V
170
R
-
CB
THR
A
603
L
-
HB2
SER
V
170
R
-
CB
THR
A
603
L
-
HG
SER
V
170
R
-
O
THR
A
603
L
-
CB
SER
V
170
R
-
O
THR
A
603
L
-
OG
SER
V
170
R
-
O
THR
A
603
L
-
H
SER
V
170
R
-
O
THR
A
603
L
-
HB2
SER
V
170
R
-
O
THR
A
603
L
-
HB3
SER
V
170
R
-
O
THR
A
603
L
-
HG
SER
V
170
R
-
CG2
THR
A
603
L
-
HB2
ASP
V
168
R
-
OG1
THR
A
603
L
-
HB3
ASP
V
168
R
-
OG1
THR
A
603
L
-
CB
SER
V
170
R
-
OG1
THR
A
603
L
-
OG
SER
V
170
R
-
OG1
THR
A
603
L
-
HB2
SER
V
170
R
-
OG1
THR
A
603
L
-
HG
SER
V
170
R
-
N
ASN
A
605
L
-
NE2
GLN
V
172
R
-
N
ASN
A
605
L
-
HE21
GLN
V
172
R
-
CA
ASN
A
605
L
-
NE2
GLN
V
172
R
-
CA
ASN
A
605
L
-
HE21
GLN
V
172
R
-
CA
ASN
A
605
L
-
HE22
GLN
V
172
R
-
C
ASN
A
605
L
-
CD
GLN
V
172
R
-
C
ASN
A
605
L
-
NE2
GLN
V
172
R
-
C
ASN
A
605
L
-
HE21
GLN
V
172
R
-
C
ASN
A
605
L
-
HE22
GLN
V
172
R
-
CB
ASN
A
605
L
-
CG
GLN
V
172
R
-
CB
ASN
A
605
L
-
CD
GLN
V
172
R
-
CB
ASN
A
605
L
-
NE2
GLN
V
172
R
-
CB
ASN
A
605
L
-
HG2
GLN
V
172
R
-
CB
ASN
A
605
L
-
HG3
GLN
V
172
R
-
CB
ASN
A
605
L
-
HE21
GLN
V
172
R
-
CB
ASN
A
605
L
-
HE22
GLN
V
172
R
-
O
ASN
A
605
L
-
CG
GLN
V
172
R
-
O
ASN
A
605
L
-
CD
GLN
V
172
R
-
O
ASN
A
605
L
-
NE2
GLN
V
172
R
-
O
ASN
A
605
L
-
OE1
GLN
V
172
R
-
O
ASN
A
605
L
-
HG2
GLN
V
172
R
-
O
ASN
A
605
L
-
HE21
GLN
V
172
R
-
O
ASN
A
605
L
-
HE22
GLN
V
172
R
-
CG
ASN
A
605
L
-
HD2
PHE
V
169
R
-
CG
ASN
A
605
L
-
HE2
PHE
V
169
R
-
CG
ASN
A
605
L
-
O
SER
V
170
R
-
CG
ASN
A
605
L
-
H
SER
V
170
R
-
CG
ASN
A
605
L
-
HB2
SER
V
170
R
-
CG
ASN
A
605
L
-
NE2
GLN
V
172
R
-
CG
ASN
A
605
L
-
HE21
GLN
V
172
R
-
ND2
ASN
A
605
L
-
CG
PHE
V
169
R
-
ND2
ASN
A
605
L
-
CD2
PHE
V
169
R
-
ND2
ASN
A
605
L
-
CE2
PHE
V
169
R
-
ND2
ASN
A
605
L
-
CZ
PHE
V
169
R
-
ND2
ASN
A
605
L
-
HA
PHE
V
169
R
-
ND2
ASN
A
605
L
-
HD2
PHE
V
169
R
-
ND2
ASN
A
605
L
-
HE2
PHE
V
169
R
-
ND2
ASN
A
605
L
-
N
SER
V
170
R
-
ND2
ASN
A
605
L
-
CA
SER
V
170
R
-
ND2
ASN
A
605
L
-
C
SER
V
170
R
-
ND2
ASN
A
605
L
-
O
SER
V
170
R
-
ND2
ASN
A
605
L
-
H
SER
V
170
R
-
ND2
ASN
A
605
L
-
HB2
SER
V
170
R
-
ND2
ASN
A
605
L
-
NE2
GLN
V
172
R
-
ND2
ASN
A
605
L
-
HG3
GLN
V
172
R
-
ND2
ASN
A
605
L
-
HE21
GLN
V
172
R
-
OD1
ASN
A
605
L
-
HA
PHE
V
169
R
-
OD1
ASN
A
605
L
-
HD2
PHE
V
169
R
-
OD1
ASN
A
605
L
-
H
SER
V
170
R
-
OD1
ASN
A
605
L
-
HE21
GLN
V
172
R
-
N
GLN
A
606
L
-
HE21
GLN
V
172
R
-
N
GLN
A
606
L
-
HE22
GLN
V
172
R
-
CA
GLN
A
606
L
-
HE22
GLN
V
172
R
-
C
GLN
A
606
L
-
HE22
GLN
V
172
R
S
N
VAL
A
607
L
-
HE22
GLN
V
172
R
S
CB
VAL
A
607
L
-
HE22
GLN
V
172
R
S
CG2
VAL
A
607
L
-
CD
GLN
V
172
R
S
CG2
VAL
A
607
L
-
NE2
GLN
V
172
R
S
CG2
VAL
A
607
L
-
OE1
GLN
V
172
R
S
CG2
VAL
A
607
L
-
HE22
GLN
V
172
R
S
N
ILE
A
631
L
-
OE1
GLN
V
172
R
S
N
ILE
A
631
L
-
HB3
GLN
V
172
R
S
CA
ILE
A
631
L
-
HB3
GLN
V
172
R
S
C
ILE
A
631
L
-
O
GLN
V
172
R
S
C
ILE
A
631
L
-
HB3
GLN
V
172
R
S
C
ILE
A
631
L
-
HB2
ASP
V
173
R
S
CB
ILE
A
631
L
-
OE1
GLN
V
172
R
S
CB
ILE
A
631
L
-
HB2
GLN
V
172
R
S
CB
ILE
A
631
L
-
HB3
GLN
V
172
R
S
CB
ILE
A
631
L
-
HE22
GLN
V
176
R
S
O
ILE
A
631
L
-
CA
GLN
V
172
R
S
O
ILE
A
631
L
-
C
GLN
V
172
R
S
O
ILE
A
631
L
-
CB
GLN
V
172
R
S
O
ILE
A
631
L
-
O
GLN
V
172
R
S
O
ILE
A
631
L
-
HB2
GLN
V
172
R
S
O
ILE
A
631
L
-
HB3
GLN
V
172
R
S
O
ILE
A
631
L
-
N
ASP
V
173
R
S
O
ILE
A
631
L
-
CB
ASP
V
173
R
S
O
ILE
A
631
L
-
HB2
ASP
V
173
R
S
CG1
ILE
A
631
L
-
OE1
GLN
V
172
R
S
CG2
ILE
A
631
L
-
OD2
ASP
V
173
R
S
CG2
ILE
A
631
L
-
HB2
ASP
V
173
R
S
CG2
ILE
A
631
L
-
NE2
GLN
V
176
R
S
CG2
ILE
A
631
L
-
HE21
GLN
V
176
R
S
CG2
ILE
A
631
L
-
HE22
GLN
V
176
R
S
CD1
ILE
A
631
L
-
OE1
GLN
V
172
R
S
CD1
ILE
A
631
L
-
HE22
GLN
V
176
R
S
N
LEU
A
632
L
-
HB2
ASP
V
173
R
S
CA
LEU
A
632
L
-
CB
ASP
V
173
R
S
CA
LEU
A
632
L
-
HA
ASP
V
173
R
S
CA
LEU
A
632
L
-
HB2
ASP
V
173
R
S
CA
LEU
A
632
L
-
HB3
ASP
V
173
R
S
C
LEU
A
632
L
-
CA
ASP
V
173
R
S
C
LEU
A
632
L
-
CB
ASP
V
173
R
S
C
LEU
A
632
L
-
CG
ASP
V
173
R
S
C
LEU
A
632
L
-
HA
ASP
V
173
R
S
C
LEU
A
632
L
-
HB2
ASP
V
173
R
S
C
LEU
A
632
L
-
HB3
ASP
V
173
R
S
C
LEU
A
632
L
-
HD2
PRO
V
174
R
S
C
LEU
A
632
L
-
HD3
PRO
V
174
R
S
O
LEU
A
632
L
-
O
GLN
V
172
R
S
O
LEU
A
632
L
-
N
ASP
V
173
R
S
O
LEU
A
632
L
-
CA
ASP
V
173
R
S
O
LEU
A
632
L
-
C
ASP
V
173
R
S
O
LEU
A
632
L
-
CB
ASP
V
173
R
S
O
LEU
A
632
L
-
CG
ASP
V
173
R
S
O
LEU
A
632
L
-
OD1
ASP
V
173
R
S
O
LEU
A
632
L
-
OD2
ASP
V
173
R
S
O
LEU
A
632
L
-
HA
ASP
V
173
R
S
O
LEU
A
632
L
-
HB2
ASP
V
173
R
S
O
LEU
A
632
L
-
HB3
ASP
V
173
R
S
O
LEU
A
632
L
-
N
PRO
V
174
R
S
O
LEU
A
632
L
-
CD
PRO
V
174
R
S
O
LEU
A
632
L
-
HD2
PRO
V
174
R
S
O
LEU
A
632
L
-
HD3
PRO
V
174
R
S
N
GLU
A
633
L
-
CB
ASP
V
173
R
S
N
GLU
A
633
L
-
CG
ASP
V
173
R
S
N
GLU
A
633
L
-
OD2
ASP
V
173
R
S
N
GLU
A
633
L
-
HB2
ASP
V
173
R
S
N
GLU
A
633
L
-
HB3
ASP
V
173
R
S
CA
GLU
A
633
L
-
CB
ASP
V
173
R
S
CA
GLU
A
633
L
-
CG
ASP
V
173
R
S
CA
GLU
A
633
L
-
OD1
ASP
V
173
R
S
CA
GLU
A
633
L
-
OD2
ASP
V
173
R
S
CA
GLU
A
633
L
-
HB2
ASP
V
173
R
S
CA
GLU
A
633
L
-
HB3
ASP
V
173
R
S
CA
GLU
A
633
L
-
HD3
PRO
V
174
R
S
C
GLU
A
633
L
-
CB
ASP
V
173
R
S
C
GLU
A
633
L
-
CG
ASP
V
173
R
S
C
GLU
A
633
L
-
OD1
ASP
V
173
R
S
C
GLU
A
633
L
-
OD2
ASP
V
173
R
S
C
GLU
A
633
L
-
HB2
ASP
V
173
R
S
C
GLU
A
633
L
-
HB3
ASP
V
173
R
S
CB
GLU
A
633
L
-
HB3
ASP
V
173
R
S
CG
GLU
A
633
L
-
HB3
ASP
V
173
R
S
CG
GLU
A
633
L
-
HD3
PRO
V
174
R
-
N
ALA
A
634
L
-
CG
ASP
V
173
R
-
N
ALA
A
634
L
-
OD1
ASP
V
173
R
-
N
ALA
A
634
L
-
OD2
ASP
V
173
R
-
N
ALA
A
634
L
-
OG
SER
V
175
R
-
N
ALA
A
634
L
-
HG
SER
V
175
R
-
CA
ALA
A
634
L
-
OD2
ASP
V
173
R
-
CA
ALA
A
634
L
-
OG
SER
V
175
R
-
CA
ALA
A
634
L
-
HG
SER
V
175
R
-
CA
ALA
A
634
L
-
HE21
GLN
V
176
R
-
CB
ALA
A
634
L
-
CG
ASP
V
173
R
-
CB
ALA
A
634
L
-
OD2
ASP
V
173
R
-
CB
ALA
A
634
L
-
OG
SER
V
175
R
-
CB
ALA
A
634
L
-
HG
SER
V
175
R
-
CB
ALA
A
634
L
-
NE2
GLN
V
176
R
-
CB
ALA
A
634
L
-
HG2
GLN
V
176
R
-
CB
ALA
A
634
L
-
HE21
GLN
V
176
R
-
CG
GLN
A
635
L
-
HB2
SER
V
175
R
-
CG
GLN
A
635
L
-
HB3
SER
V
175
R
-
CD
GLN
A
635
L
-
CB
SER
V
175
R
-
CD
GLN
A
635
L
-
HB2
SER
V
175
R
-
CD
GLN
A
635
L
-
HB3
SER
V
175
R
-
CD
GLN
A
635
L
S
CE2
PHE
V
206
R
-
CD
GLN
A
635
L
S
HE2
PHE
V
206
R
-
NE2
GLN
A
635
L
-
HB2
SER
V
175
R
-
NE2
GLN
A
635
L
-
HB3
SER
V
175
R
-
NE2
GLN
A
635
L
S
HE2
PHE
V
206
R
-
OE1
GLN
A
635
L
-
HB2
SER
V
175
R
-
OE1
GLN
A
635
L
S
CD2
PHE
V
206
R
-
OE1
GLN
A
635
L
S
CE2
PHE
V
206
R
-
OE1
GLN
A
635
L
S
CZ
PHE
V
206
R
-
OE1
GLN
A
635
L
S
HE2
PHE
V
206
R
-
OE1
GLN
A
635
L
S
HZ
PHE
V
206
R
-
CG
PRO
A
641
L
-
HB2
PRO
V
191
R
S
CD
ARG
A
662
L
-
HE2
PHE
V
169
R
S
CD
ARG
A
662
L
S
HG3
PRO
V
208
R
S
CD
ARG
A
662
L
H
HE2
TYR
V
211
R
S
NE
ARG
A
662
L
-
CE2
PHE
V
169
R
S
NE
ARG
A
662
L
-
HE2
PHE
V
169
R
S
NE
ARG
A
662
L
S
CH2
TRP
V
195
R
S
NE
ARG
A
662
L
S
CZ2
TRP
V
195
R
S
NE
ARG
A
662
L
S
HH2
TRP
V
195
R
S
NE
ARG
A
662
L
S
HZ2
TRP
V
195
R
S
NE
ARG
A
662
L
S
HB3
PRO
V
208
R
S
NE
ARG
A
662
L
S
HG3
PRO
V
208
R
S
NH1
ARG
A
662
L
-
CD2
PHE
V
169
R
S
NH1
ARG
A
662
L
-
CE2
PHE
V
169
R
S
NH1
ARG
A
662
L
-
HD2
PHE
V
169
R
S
NH1
ARG
A
662
L
-
HE2
PHE
V
169
R
S
NH1
ARG
A
662
L
S
CA
PRO
V
208
R
S
NH1
ARG
A
662
L
S
CB
PRO
V
208
R
S
NH1
ARG
A
662
L
S
CG
PRO
V
208
R
S
NH1
ARG
A
662
L
S
CD
PRO
V
208
R
S
NH1
ARG
A
662
L
S
HB2
PRO
V
208
R
S
NH1
ARG
A
662
L
S
HB3
PRO
V
208
R
S
NH1
ARG
A
662
L
S
HG2
PRO
V
208
R
S
NH1
ARG
A
662
L
S
HG3
PRO
V
208
R
S
NH1
ARG
A
662
L
S
HD2
PRO
V
208
R
S
NH1
ARG
A
662
L
S
HD3
PRO
V
208
R
S
NH1
ARG
A
662
L
H
CD2
TYR
V
211
R
S
NH1
ARG
A
662
L
H
CE2
TYR
V
211
R
S
NH1
ARG
A
662
L
H
CZ
TYR
V
211
R
S
NH1
ARG
A
662
L
H
HD2
TYR
V
211
R
S
NH1
ARG
A
662
L
H
HE2
TYR
V
211
R
S
NH2
ARG
A
662
L
-
CE2
PHE
V
169
R
S
NH2
ARG
A
662
L
-
CZ
PHE
V
169
R
S
NH2
ARG
A
662
L
-
HE2
PHE
V
169
R
S
NH2
ARG
A
662
L
-
HZ
PHE
V
169
R
S
NH2
ARG
A
662
L
S
CD2
TRP
V
195
R
S
NH2
ARG
A
662
L
S
CE2
TRP
V
195
R
S
NH2
ARG
A
662
L
S
CE3
TRP
V
195
R
S
NH2
ARG
A
662
L
S
CH2
TRP
V
195
R
S
NH2
ARG
A
662
L
S
CZ2
TRP
V
195
R
S
NH2
ARG
A
662
L
S
CZ3
TRP
V
195
R
S
NH2
ARG
A
662
L
S
HH2
TRP
V
195
R
S
NH2
ARG
A
662
L
S
HZ2
TRP
V
195
R
S
NH2
ARG
A
662
L
S
HZ3
TRP
V
195
R
S
NH2
ARG
A
662
L
S
N
PRO
V
208
R
S
NH2
ARG
A
662
L
S
CA
PRO
V
208
R
S
NH2
ARG
A
662
L
S
CB
PRO
V
208
R
S
NH2
ARG
A
662
L
S
CG
PRO
V
208
R
S
NH2
ARG
A
662
L
S
CD
PRO
V
208
R
S
NH2
ARG
A
662
L
S
HA
PRO
V
208
R
S
NH2
ARG
A
662
L
S
HB2
PRO
V
208
R
S
NH2
ARG
A
662
L
S
HB3
PRO
V
208
R
S
NH2
ARG
A
662
L
S
HG2
PRO
V
208
R
S
NH2
ARG
A
662
L
S
HG3
PRO
V
208
R
S
NH2
ARG
A
662
L
S
HD2
PRO
V
208
R
S
NH2
ARG
A
662
L
S
HD3
PRO
V
208
R
S
CZ
ARG
A
662
L
-
CE2
PHE
V
169
R
S
CZ
ARG
A
662
L
-
HE2
PHE
V
169
R
S
CZ
ARG
A
662
L
-
HZ
PHE
V
169
R
S
CZ
ARG
A
662
L
S
CH2
TRP
V
195
R
S
CZ
ARG
A
662
L
S
CZ2
TRP
V
195
R
S
CZ
ARG
A
662
L
S
HH2
TRP
V
195
R
S
CZ
ARG
A
662
L
S
HZ2
TRP
V
195
R
S
CZ
ARG
A
662
L
S
CB
PRO
V
208
R
S
CZ
ARG
A
662
L
S
CG
PRO
V
208
R
S
CZ
ARG
A
662
L
S
CD
PRO
V
208
R
S
CZ
ARG
A
662
L
S
HB2
PRO
V
208
R
S
CZ
ARG
A
662
L
S
HB3
PRO
V
208
R
S
CZ
ARG
A
662
L
S
HG2
PRO
V
208
R
S
CZ
ARG
A
662
L
S
HG3
PRO
V
208
R
S
CZ
ARG
A
662
L
S
HD2
PRO
V
208