A1IGU5_Q9Y3L5.3
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
292
L
H
GLU
V
155
R
H
TYR
A
293
L
-
LYS
V
150
R
H
TYR
A
293
L
-
MET
V
152
R
H
TYR
A
293
L
H
GLU
V
155
R
H
ASN
A
296
L
H
ASP
V
154
R
H
ASN
A
296
L
H
GLU
V
155
R
H
ASN
A
296
L
H
ALA
V
158
R
H
ASN
A
296
L
H
ARG
V
162
R
H
LEU
A
297
L
-
LYS
V
150
R
H
LEU
A
297
L
H
ASP
V
154
R
H
ALA
A
299
L
S
LYS
V
42
R
H
ALA
A
299
L
S
GLU
V
43
R
H
ALA
A
299
L
S
ILE
V
44
R
H
ALA
A
299
L
S
GLU
V
45
R
H
PHE
A
300
L
-
LYS
V
150
R
H
PHE
A
300
L
H
ASP
V
154
R
H
PHE
A
300
L
H
GLN
V
22
R
H
PHE
A
300
L
H
PHE
V
23
R
H
PHE
A
300
L
H
VAL
V
24
R
H
PHE
A
300
L
H
THR
V
25
R
H
PHE
A
300
L
-
GLY
V
26
R
H
PHE
A
300
L
S
LYS
V
42
R
H
PHE
A
300
L
S
ILE
V
44
R
H
TYR
A
302
L
-
MET
V
1
R
H
TYR
A
302
L
S
GLU
V
43
R
-
PHE
A
303
L
H
VAL
V
24
R
-
PHE
A
303
L
S
ARG
V
41
R
-
PHE
A
303
L
S
LYS
V
42
R
-
PHE
A
303
L
S
GLU
V
43
R
-
TYR
A
308
L
S
GLU
V
43
R
H
TYR
A
320
L
H
VAL
V
21
R
H
TYR
A
320
L
H
THR
V
25
R
H
LEU
A
323
L
-
THR
V
27
R
H
ALA
A
324
L
H
THR
V
25
R
H
LEU
A
327
L
-
THR
V
27
R
H
PHE
A
332
L
-
LYS
V
150
R
H
PHE
A
332
L
H
THR
V
25
R
H
PHE
A
332
L
-
GLY
V
26
R
H
GLN
A
428
L
-
SER
V
149
R
H
GLN
A
428
L
-
LYS
V
150
R
H
LEU
A
431
L
-
LYS
V
150
R
H
ALA
A
432
L
-
LYS
V
148
R
H
ALA
A
432
L
-
SER
V
149
R
H
VAL
A
435
L
-
GLY
V
26
R
H
VAL
A
435
L
-
THR
V
27
R
H
VAL
A
435
L
-
PHE
V
28
R
H
LEU
A
436
L
-
GLU
V
30
R
H
MET
A
443
L
-
ILE
V
29
R
H
GLU
A
453
L
-
LYS
V
31
R
H
GLU
A
453
L
-
TYR
V
32
R
H
PHE
A
456
L
-
LYS
V
31
R
H
PHE
A
456
L
-
ASP
V
33
R
H
ARG
A
457
L
-
PRO
V
34
R
H
LEU
A
464
L
-
ILE
V
36
R
-
GLY
A
519
L
H
LEU
V
70
R
-
THR
A
520
L
H
MET
V
67
R
-
THR
A
520
L
H
LEU
V
70
R
-
GLY
A
521
L
H
LEU
V
70
R
-
THR
A
522
L
H
VAL
V
103
R
-
THR
A
522
L
H
SER
V
66
R
-
THR
A
522
L
H
ASP
V
69
R
-
THR
A
522
L
H
LEU
V
70
R
-
LEU
A
523
L
H
ASP
V
69
R
-
LEU
A
523
L
H
LYS
V
73
R
-
ASP
A
524
L
H
LEU
V
70
R
-
ASP
A
524
L
H
LYS
V
73
R
-
LEU
A
525
L
H
LYS
V
73
R
S
ARG
A
556
L
H
LYS
V
73
A1IGU5_Q9Y3L5.3
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
O
ALA
A
292
L
H
HG3
GLU
V
155
R
H
CA
TYR
A
293
L
H
OE1
GLU
V
155
R
H
CA
TYR
A
293
L
H
HG3
GLU
V
155
R
H
CB
TYR
A
293
L
H
OE1
GLU
V
155
R
H
CG
TYR
A
293
L
H
CD
GLU
V
155
R
H
CG
TYR
A
293
L
H
OE1
GLU
V
155
R
H
CD2
TYR
A
293
L
H
CD
GLU
V
155
R
H
CD2
TYR
A
293
L
H
OE1
GLU
V
155
R
H
CD2
TYR
A
293
L
H
OE2
GLU
V
155
R
H
CE2
TYR
A
293
L
-
H
MET
V
152
R
H
CE2
TYR
A
293
L
H
CD
GLU
V
155
R
H
CE2
TYR
A
293
L
H
OE1
GLU
V
155
R
H
CE2
TYR
A
293
L
H
OE2
GLU
V
155
R
H
OH
TYR
A
293
L
-
HD3
LYS
V
150
R
H
CA
ASN
A
296
L
H
HB3
ASP
V
154
R
H
C
ASN
A
296
L
H
CB
ASP
V
154
R
H
C
ASN
A
296
L
H
HB3
ASP
V
154
R
H
CB
ASN
A
296
L
H
C
ASP
V
154
R
H
CB
ASN
A
296
L
H
CB
ASP
V
154
R
H
CB
ASN
A
296
L
H
O
ASP
V
154
R
H
CB
ASN
A
296
L
H
HB2
ASP
V
154
R
H
CB
ASN
A
296
L
H
HB3
ASP
V
154
R
H
CB
ASN
A
296
L
H
HA
GLU
V
155
R
H
CB
ASN
A
296
L
H
HG3
GLU
V
155
R
H
CB
ASN
A
296
L
H
HB2
ALA
V
158
R
H
O
ASN
A
296
L
H
CB
ASP
V
154
R
H
O
ASN
A
296
L
H
HB3
ASP
V
154
R
H
CG
ASN
A
296
L
H
C
ASP
V
154
R
H
CG
ASN
A
296
L
H
O
ASP
V
154
R
H
CG
ASN
A
296
L
H
HB3
ASP
V
154
R
H
CG
ASN
A
296
L
H
N
GLU
V
155
R
H
CG
ASN
A
296
L
H
CA
GLU
V
155
R
H
CG
ASN
A
296
L
H
HA
GLU
V
155
R
H
CG
ASN
A
296
L
H
HG3
GLU
V
155
R
H
CG
ASN
A
296
L
H
CB
ALA
V
158
R
H
CG
ASN
A
296
L
H
HB1
ALA
V
158
R
H
CG
ASN
A
296
L
H
HB2
ALA
V
158
R
H
CG
ASN
A
296
L
H
HB3
ALA
V
158
R
H
ND2
ASN
A
296
L
H
N
GLU
V
155
R
H
ND2
ASN
A
296
L
H
CA
GLU
V
155
R
H
ND2
ASN
A
296
L
H
CB
GLU
V
155
R
H
ND2
ASN
A
296
L
H
CG
GLU
V
155
R
H
ND2
ASN
A
296
L
H
HA
GLU
V
155
R
H
ND2
ASN
A
296
L
H
HB3
GLU
V
155
R
H
ND2
ASN
A
296
L
H
HG2
GLU
V
155
R
H
ND2
ASN
A
296
L
H
HG3
GLU
V
155
R
H
ND2
ASN
A
296
L
H
CB
ALA
V
158
R
H
ND2
ASN
A
296
L
H
HB1
ALA
V
158
R
H
ND2
ASN
A
296
L
H
HB2
ALA
V
158
R
H
ND2
ASN
A
296
L
H
HB3
ALA
V
158
R
H
ND2
ASN
A
296
L
H
HH22
ARG
V
162
R
H
OD1
ASN
A
296
L
H
O
ASP
V
154
R
H
OD1
ASN
A
296
L
H
HA
GLU
V
155
R
H
OD1
ASN
A
296
L
H
CB
ALA
V
158
R
H
OD1
ASN
A
296
L
H
HB1
ALA
V
158
R
H
OD1
ASN
A
296
L
H
HB2
ALA
V
158
R
H
OD1
ASN
A
296
L
H
HB3
ALA
V
158
R
H
OD1
ASN
A
296
L
H
HH22
ARG
V
162
R
H
N
LEU
A
297
L
H
HB3
ASP
V
154
R
H
CA
LEU
A
297
L
H
OD2
ASP
V
154
R
H
CD1
LEU
A
297
L
-
NZ
LYS
V
150
R
H
CD1
LEU
A
297
L
-
HZ1
LYS
V
150
R
H
CD1
LEU
A
297
L
-
HZ2
LYS
V
150
R
H
CD1
LEU
A
297
L
-
HZ3
LYS
V
150
R
H
CD1
LEU
A
297
L
H
OD2
ASP
V
154
R
H
N
ALA
A
299
L
S
H
GLU
V
45
R
H
N
ALA
A
299
L
S
HB3
GLU
V
45
R
H
CA
ALA
A
299
L
S
HA
ILE
V
44
R
H
CA
ALA
A
299
L
S
HG13
ILE
V
44
R
H
CA
ALA
A
299
L
S
N
GLU
V
45
R
H
CA
ALA
A
299
L
S
H
GLU
V
45
R
H
CA
ALA
A
299
L
S
HB3
GLU
V
45
R
H
C
ALA
A
299
L
S
HE2
LYS
V
42
R
H
C
ALA
A
299
L
S
HA
ILE
V
44
R
H
C
ALA
A
299
L
S
HG13
ILE
V
44
R
H
C
ALA
A
299
L
S
H
GLU
V
45
R
H
CB
ALA
A
299
L
S
CA
ILE
V
44
R
H
CB
ALA
A
299
L
S
C
ILE
V
44
R
H
CB
ALA
A
299
L
S
CG1
ILE
V
44
R
H
CB
ALA
A
299
L
S
HA
ILE
V
44
R
H
CB
ALA
A
299
L
S
HG12
ILE
V
44
R
H
CB
ALA
A
299
L
S
HG13
ILE
V
44
R
H
CB
ALA
A
299
L
S
N
GLU
V
45
R
H
CB
ALA
A
299
L
S
CA
GLU
V
45
R
H
CB
ALA
A
299
L
S
C
GLU
V
45
R
H
CB
ALA
A
299
L
S
CB
GLU
V
45
R
H
CB
ALA
A
299
L
S
O
GLU
V
45
R
H
CB
ALA
A
299
L
S
H
GLU
V
45
R
H
CB
ALA
A
299
L
S
HB3
GLU
V
45
R
H
O
ALA
A
299
L
S
HE2
LYS
V
42
R
H
O
ALA
A
299
L
S
O
GLU
V
43
R
H
O
ALA
A
299
L
S
CA
ILE
V
44
R
H
O
ALA
A
299
L
S
HA
ILE
V
44
R
H
O
ALA
A
299
L
S
HG13
ILE
V
44
R
H
O
ALA
A
299
L
S
H
GLU
V
45
R
H
N
PHE
A
300
L
S
HE2
LYS
V
42
R
H
N
PHE
A
300
L
S
HZ2
LYS
V
42
R
H
N
PHE
A
300
L
S
HG13
ILE
V
44
R
H
CA
PHE
A
300
L
S
CE
LYS
V
42
R
H
CA
PHE
A
300
L
S
NZ
LYS
V
42
R
H
CA
PHE
A
300
L
S
HE2
LYS
V
42
R
H
CA
PHE
A
300
L
S
HE3
LYS
V
42
R
H
CA
PHE
A
300
L
S
HZ1
LYS
V
42
R
H
CA
PHE
A
300
L
S
HZ2
LYS
V
42
R
H
CA
PHE
A
300
L
S
HZ3
LYS
V
42
R
H
C
PHE
A
300
L
S
CE
LYS
V
42
R
H
C
PHE
A
300
L
S
NZ
LYS
V
42
R
H
C
PHE
A
300
L
S
HE2
LYS
V
42
R
H
C
PHE
A
300
L
S
HE3
LYS
V
42
R
H
C
PHE
A
300
L
S
HZ2
LYS
V
42
R
H
CB
PHE
A
300
L
S
CE
LYS
V
42
R
H
CB
PHE
A
300
L
S
NZ
LYS
V
42
R
H
CB
PHE
A
300
L
S
HE2
LYS
V
42
R
H
CB
PHE
A
300
L
S
HE3
LYS
V
42
R
H
CB
PHE
A
300
L
S
HZ1
LYS
V
42
R
H
CB
PHE
A
300
L
S
HZ2
LYS
V
42
R
H
CB
PHE
A
300
L
S
HZ3
LYS
V
42
R
H
CB
PHE
A
300
L
H
CG
ASP
V
154
R
H
CB
PHE
A
300
L
H
OD1
ASP
V
154
R
H
O
PHE
A
300
L
S
CE
LYS
V
42
R
H
O
PHE
A
300
L
S
NZ
LYS
V
42
R
H
O
PHE
A
300
L
S
HE2
LYS
V
42
R
H
O
PHE
A
300
L
S
HE3
LYS
V
42
R
H
O
PHE
A
300
L
S
HZ2
LYS
V
42
R
H
CG
PHE
A
300
L
H
O
PHE
V
23
R
H
CG
PHE
A
300
L
S
CE
LYS
V
42
R
H
CG
PHE
A
300
L
S
NZ
LYS
V
42
R
H
CG
PHE
A
300
L
S
HE2
LYS
V
42
R
H
CG
PHE
A
300
L
S
HE3
LYS
V
42
R
H
CG
PHE
A
300
L
S
HZ1
LYS
V
42
R
H
CG
PHE
A
300
L
S
HZ2
LYS
V
42
R
H
CG
PHE
A
300
L
S
HZ3
LYS
V
42
R
H
CG
PHE
A
300
L
-
HZ1
LYS
V
150
R
H
CG
PHE
A
300
L
-
HZ3
LYS
V
150
R
H
CG
PHE
A
300
L
H
OD1
ASP
V
154
R
H
CD1
PHE
A
300
L
S
NZ
LYS
V
42
R
H
CD1
PHE
A
300
L
S
HZ1
LYS
V
42
R
H
CD1
PHE
A
300
L
S
HZ2
LYS
V
42
R
H
CD1
PHE
A
300
L
-
NZ
LYS
V
150
R
H
CD1
PHE
A
300
L
-
HZ1
LYS
V
150
R
H
CD1
PHE
A
300
L
-
HZ3
LYS
V
150
R
H
CD2
PHE
A
300
L
H
C
PHE
V
23
R
H
CD2
PHE
A
300
L
H
O
PHE
V
23
R
H
CD2
PHE
A
300
L
H
HA
PHE
V
23
R
H
CD2
PHE
A
300
L
S
CD
LYS
V
42
R
H
CD2
PHE
A
300
L
S
CE
LYS
V
42
R
H
CD2
PHE
A
300
L
S
NZ
LYS
V
42
R
H
CD2
PHE
A
300
L
S
HD2
LYS
V
42
R
H
CD2
PHE
A
300
L
S
HD3
LYS
V
42
R
H
CD2
PHE
A
300
L
S
HE2
LYS
V
42
R
H
CD2
PHE
A
300
L
S
HE3
LYS
V
42
R
H
CD2
PHE
A
300
L
S
HZ1
LYS
V
42
R
H
CD2
PHE
A
300
L
S
HZ2
LYS
V
42
R
H
CD2
PHE
A
300
L
S
HZ3
LYS
V
42
R
H
CD2
PHE
A
300
L
H
OD1
ASP
V
154
R
H
CE1
PHE
A
300
L
-
HA2
GLY
V
26
R
H
CE1
PHE
A
300
L
-
HA3
GLY
V
26
R
H
CE1
PHE
A
300
L
S
HZ2
LYS
V
42
R
H
CE1
PHE
A
300
L
-
NZ
LYS
V
150
R
H
CE1
PHE
A
300
L
-
HZ1
LYS
V
150
R
H
CE1
PHE
A
300
L
-
HZ3
LYS
V
150
R
H
CE2
PHE
A
300
L
H
O
GLN
V
22
R
H
CE2
PHE
A
300
L
H
CA
PHE
V
23
R
H
CE2
PHE
A
300
L
H
C
PHE
V
23
R
H
CE2
PHE
A
300
L
H
O
PHE
V
23
R
H
CE2
PHE
A
300
L
H
HA
PHE
V
23
R
H
CE2
PHE
A
300
L
H
N
VAL
V
24
R
H
CE2
PHE
A
300
L
H
CA
VAL
V
24
R
H
CE2
PHE
A
300
L
H
C
VAL
V
24
R
H
CE2
PHE
A
300
L
H
O
VAL
V
24
R
H
CE2
PHE
A
300
L
H
HA
VAL
V
24
R
H
CE2
PHE
A
300
L
H
N
THR
V
25
R
H
CE2
PHE
A
300
L
-
N
GLY
V
26
R
H
CE2
PHE
A
300
L
-
H
GLY
V
26
R
H
CE2
PHE
A
300
L
S
CE
LYS
V
42
R
H
CE2
PHE
A
300
L
S
NZ
LYS
V
42
R
H
CE2
PHE
A
300
L
S
HD2
LYS
V
42
R
H
CE2
PHE
A
300
L
S
HE3
LYS
V
42
R
H
CE2
PHE
A
300
L
S
HZ1
LYS
V
42
R
H
CE2
PHE
A
300
L
S
HZ2
LYS
V
42
R
H
CE2
PHE
A
300
L
S
HZ3
LYS
V
42
R
H
CZ
PHE
A
300
L
H
O
PHE
V
23
R
H
CZ
PHE
A
300
L
H
O
VAL
V
24
R
H
CZ
PHE
A
300
L
H
C
THR
V
25
R
H
CZ
PHE
A
300
L
-
N
GLY
V
26
R
H
CZ
PHE
A
300
L
-
CA
GLY
V
26
R
H
CZ
PHE
A
300
L
-
H
GLY
V
26
R
H
CZ
PHE
A
300
L
-
HA2
GLY
V
26
R
H
CZ
PHE
A
300
L
-
HA3
GLY
V
26
R
H
CZ
PHE
A
300
L
S
NZ
LYS
V
42
R
H
CZ
PHE
A
300
L
S
HZ1
LYS
V
42
R
H
CZ
PHE
A
300
L
S
HZ2
LYS
V
42
R
H
CZ
PHE
A
300
L
-
HE3
LYS
V
150
R
H
CZ
PHE
A
300
L
-
HZ3
LYS
V
150
R
H
C
TYR
A
302
L
S
HB3
GLU
V
43
R
H
O
TYR
A
302
L
S
HB3
GLU
V
43
R
H
CD1
TYR
A
302
L
S
CB
GLU
V
43
R
H
CD1
TYR
A
302
L
S
OE2
GLU
V
43
R
H
CD1
TYR
A
302
L
S
HB2
GLU
V
43
R
H
CD1
TYR
A
302
L
S
HB3
GLU
V
43
R
H
CE1
TYR
A
302
L
-
HE1
MET
V
1
R
H
CE1
TYR
A
302
L
S
OE2
GLU
V
43
R
H
CE1
TYR
A
302
L
S
HB2
GLU
V
43
R
H
CZ
TYR
A
302
L
S
OE2
GLU
V
43
R
-
N
PHE
A
303
L
S
O
GLU
V
43
R
-
N
PHE
A
303
L
S
HB3
GLU
V
43
R
-
CA
PHE
A
303
L
S
HG3
LYS
V
42
R
-
CA
PHE
A
303
L
S
CB
GLU
V
43
R
-
CA
PHE
A
303
L
S
O
GLU
V
43
R
-
CA
PHE
A
303
L
S
H
GLU
V
43
R
-
CA
PHE
A
303
L
S
HB3
GLU
V
43
R
-
CB
PHE
A
303
L
S
C
LYS
V
42
R
-
CB
PHE
A
303
L
S
CG
LYS
V
42
R
-
CB
PHE
A
303
L
S
CD
LYS
V
42
R
-
CB
PHE
A
303
L
S
CE
LYS
V
42
R
-
CB
PHE
A
303
L
S
HA
LYS
V
42
R
-
CB
PHE
A
303
L
S
HG2
LYS
V
42
R
-
CB
PHE
A
303
L
S
HG3
LYS
V
42
R
-
CB
PHE
A
303
L
S
HE2
LYS
V
42
R
-
CB
PHE
A
303
L
S
HE3
LYS
V
42
R
-
CB
PHE
A
303
L
S
N
GLU
V
43
R
-
CB
PHE
A
303
L
S
CA
GLU
V
43
R
-
CB
PHE
A
303
L
S
C
GLU
V
43
R
-
CB
PHE
A
303
L
S
CB
GLU
V
43
R
-
CB
PHE
A
303
L
S
O
GLU
V
43
R
-
CB
PHE
A
303
L
S
H
GLU
V
43
R
-
CB
PHE
A
303
L
S
HB3
GLU
V
43
R
-
O
PHE
A
303
L
S
HE3
LYS
V
42
R
-
CG
PHE
A
303
L
S
CA
LYS
V
42
R
-
CG
PHE
A
303
L
S
C
LYS
V
42
R
-
CG
PHE
A
303
L
S
CB
LYS
V
42
R
-
CG
PHE
A
303
L
S
CG
LYS
V
42
R
-
CG
PHE
A
303
L
S
CD
LYS
V
42
R
-
CG
PHE
A
303
L
S
HA
LYS
V
42
R
-
CG
PHE
A
303
L
S
HB3
LYS
V
42
R
-
CG
PHE
A
303
L
S
HG2
LYS
V
42
R
-
CG
PHE
A
303
L
S
HG3
LYS
V
42
R
-
CG
PHE
A
303
L
S
HD2
LYS
V
42
R
-
CG
PHE
A
303
L
S
HE3
LYS
V
42
R
-
CG
PHE
A
303
L
S
N
GLU
V
43
R
-
CG
PHE
A
303
L
S
CA
GLU
V
43
R
-
CG
PHE
A
303
L
S
CB
GLU
V
43
R
-
CG
PHE
A
303
L
S
O
GLU
V
43
R
-
CG
PHE
A
303
L
S
H
GLU
V
43
R
-
CG
PHE
A
303
L
S
HB3
GLU
V
43
R
-
CG
PHE
A
303
L
S
HG3
GLU
V
43
R
-
CD1
PHE
A
303
L
H
HG13
VAL
V
24
R
-
CD1
PHE
A
303
L
S
O
ARG
V
41
R
-
CD1
PHE
A
303
L
S
CA
LYS
V
42
R
-
CD1
PHE
A
303
L
S
C
LYS
V
42
R
-
CD1
PHE
A
303
L
S
CB
LYS
V
42
R
-
CD1
PHE
A
303
L
S
CG
LYS
V
42
R
-
CD1
PHE
A
303
L
S
CD
LYS
V
42
R
-
CD1
PHE
A
303
L
S
HA
LYS
V
42
R
-
CD1
PHE
A
303
L
S
HB2
LYS
V
42
R
-
CD1
PHE
A
303
L
S
HB3
LYS
V
42
R
-
CD1
PHE
A
303
L
S
HG2
LYS
V
42
R
-
CD1
PHE
A
303
L
S
HG3
LYS
V
42
R
-
CD1
PHE
A
303
L
S
HD2
LYS
V
42
R
-
CD1
PHE
A
303
L
S
HE3
LYS
V
42
R
-
CD1
PHE
A
303
L
S
N
GLU
V
43
R
-
CD1
PHE
A
303
L
S
H
GLU
V
43
R
-
CD2
PHE
A
303
L
S
CA
LYS
V
42
R
-
CD2
PHE
A
303
L
S
C
LYS
V
42
R
-
CD2
PHE
A
303
L
S
CG
LYS
V
42
R
-
CD2
PHE
A
303
L
S
HA
LYS
V
42
R
-
CD2
PHE
A
303
L
S
HG3
LYS
V
42
R
-
CD2
PHE
A
303
L
S
N
GLU
V
43
R
-
CD2
PHE
A
303
L
S
CA
GLU
V
43
R
-
CD2
PHE
A
303
L
S
CB
GLU
V
43
R
-
CD2
PHE
A
303
L
S
CG
GLU
V
43
R
-
CD2
PHE
A
303
L
S
H
GLU
V
43
R
-
CD2
PHE
A
303
L
S
HB3
GLU
V
43
R
-
CD2
PHE
A
303
L
S
HG3
GLU
V
43
R
-
CE1
PHE
A
303
L
H
HG13
VAL
V
24
R
-
CE1
PHE
A
303
L
S
C
ARG
V
41
R
-
CE1
PHE
A
303
L
S
O
ARG
V
41
R
-
CE1
PHE
A
303
L
S
N
LYS
V
42
R
-
CE1
PHE
A
303
L
S
CA
LYS
V
42
R
-
CE1
PHE
A
303
L
S
C
LYS
V
42
R
-
CE1
PHE
A
303
L
S
CB
LYS
V
42
R
-
CE1
PHE
A
303
L
S
CG
LYS
V
42
R
-
CE1
PHE
A
303
L
S
HA
LYS
V
42
R
-
CE1
PHE
A
303
L
S
HB3
LYS
V
42
R
-
CE1
PHE
A
303
L
S
HG3
LYS
V
42
R
-
CE1
PHE
A
303
L
S
HD2
LYS
V
42
R
-
CE1
PHE
A
303
L
S
N
GLU
V
43
R
-
CE1
PHE
A
303
L
S
H
GLU
V
43
R
-
CE2
PHE
A
303
L
S
C
ARG
V
41
R
-
CE2
PHE
A
303
L
S
O
ARG
V
41
R
-
CE2
PHE
A
303
L
S
N
LYS
V
42
R
-
CE2
PHE
A
303
L
S
CA
LYS
V
42
R
-
CE2
PHE
A
303
L
S
C
LYS
V
42
R
-
CE2
PHE
A
303
L
S
HA
LYS
V
42
R
-
CE2
PHE
A
303
L
S
HG3
LYS
V
42
R
-
CE2
PHE
A
303
L
S
N
GLU
V
43
R
-
CE2
PHE
A
303
L
S
CG
GLU
V
43
R
-
CE2
PHE
A
303
L
S
H
GLU
V
43
R
-
CE2
PHE
A
303
L
S
HB3
GLU
V
43
R
-
CE2
PHE
A
303
L
S
HG3
GLU
V
43
R
-
CZ
PHE
A
303
L
S
C
ARG
V
41
R
-
CZ
PHE
A
303
L
S
O
ARG
V
41
R
-
CZ
PHE
A
303
L
S
N
LYS
V
42
R
-
CZ
PHE
A
303
L
S
CA
LYS
V
42
R
-
CZ
PHE
A
303
L
S
C
LYS
V
42
R
-
CZ
PHE
A
303
L
S
CB
LYS
V
42
R
-
CZ
PHE
A
303
L
S
HA
LYS
V
42
R
-
CZ
PHE
A
303
L
S
HB3
LYS
V
42
R
-
CZ
PHE
A
303
L
S
HG3
LYS
V
42
R
-
CZ
PHE
A
303
L
S
N
GLU
V
43
R
-
CZ
PHE
A
303
L
S
H
GLU
V
43
R
-
OH
TYR
A
308
L
S
CD
GLU
V
43
R
-
OH
TYR
A
308
L
S
OE1
GLU
V
43
R
H
CE1
TYR
A
320
L
H
HG21
THR
V
25
R
H
CE1
TYR
A
320
L
H
HG22
THR
V
25
R
H
CE2
TYR
A
320
L
H
CG2
THR
V
25
R
H
CE2
TYR
A
320
L
H
HG21
THR
V
25
R
H
OH
TYR
A
320
L
H
HG13
VAL
V
21
R
H
OH
TYR
A
320
L
H
CB
THR
V
25
R
H
OH
TYR
A
320
L
H
CG2
THR
V
25
R
H
OH
TYR
A
320
L
H
OG1
THR
V
25
R
H
OH
TYR
A
320
L
H
HB
THR
V
25
R
H
OH
TYR
A
320
L
H
HG21
THR
V
25
R
H
OH
TYR
A
320
L
H
HG22
THR
V
25
R
H
OH
TYR
A
320
L
H
HG23
THR
V
25
R
H
CZ
TYR
A
320
L
H
CG2
THR
V
25
R
H
CZ
TYR
A
320
L
H
HB
THR
V
25
R
H
CZ
TYR
A
320
L
H
HG21
THR
V
25
R
H
CZ
TYR
A
320
L
H
HG22
THR
V
25
R
H
CZ
TYR
A
320
L
H
HG23
THR
V
25
R
H
CG
LEU
A
323
L
-
HG21
THR
V
27
R
H
CD1
LEU
A
323
L
-
HG21
THR
V
27
R
H
CD2
LEU
A
323
L
-
HG21
THR
V
27
R
H
CB
ALA
A
324
L
H
HB
THR
V
25
R
H
CB
LEU
A
327
L
-
HG22
THR
V
27
R
H
CB
LEU
A
327
L
-
HG23
THR
V
27
R
H
CG
LEU
A
327
L
-
CG2
THR
V
27
R
H
CG
LEU
A
327
L
-
HG21
THR
V
27
R
H
CG
LEU
A
327
L
-
HG22
THR
V
27
R
H
CG
LEU
A
327
L
-
HG23
THR
V
27
R
H
CD1
LEU
A
327
L
-
CB
THR
V
27
R
H
CD1
LEU
A
327
L
-
CG2
THR
V
27
R
H
CD1
LEU
A
327
L
-
HA
THR
V
27
R
H
CD1
LEU
A
327
L
-
HB
THR
V
27
R
H
CD1
LEU
A
327
L
-
HG21
THR
V
27
R
H
CD1
LEU
A
327
L
-
HG22
THR
V
27
R
H
CD1
LEU
A
327
L
-
HG23
THR
V
27
R
H
CD2
LEU
A
327
L
-
HG22
THR
V
27
R
H
CG
PHE
A
332
L
-
HA3
GLY
V
26
R
H
CG
PHE
A
332
L
-
HZ3
LYS
V
150
R
H
CD1
PHE
A
332
L
-
HA3
GLY
V
26
R
H
CD1
PHE
A
332
L
-
NZ
LYS
V
150
R
H
CD1
PHE
A
332
L
-
HZ2
LYS
V
150
R
H
CD1
PHE
A
332
L
-
HZ3
LYS
V
150
R
H
CD2
PHE
A
332
L
-
HA3
GLY
V
26
R
H
CE1
PHE
A
332
L
-
CA
GLY
V
26
R
H
CE1
PHE
A
332
L
-
C
GLY
V
26
R
H
CE1
PHE
A
332
L
-
O
GLY
V
26
R
H
CE1
PHE
A
332
L
-
HA2
GLY
V
26
R
H
CE1
PHE
A
332
L
-
HA3
GLY
V
26
R
H
CE1
PHE
A
332
L
-
CD
LYS
V
150
R
H
CE1
PHE
A
332
L
-
CE
LYS
V
150
R
H
CE1
PHE
A
332
L
-
NZ
LYS
V
150
R
H
CE1
PHE
A
332
L
-
HD2
LYS
V
150
R
H
CE1
PHE
A
332
L
-
HD3
LYS
V
150
R
H
CE1
PHE
A
332
L
-
HE3
LYS
V
150
R
H
CE1
PHE
A
332
L
-
HZ2
LYS
V
150
R
H
CE1
PHE
A
332
L
-
HZ3
LYS
V
150
R
H
CE2
PHE
A
332
L
H
O
THR
V
25
R
H
CE2
PHE
A
332
L
-
N
GLY
V
26
R
H
CE2
PHE
A
332
L
-
CA
GLY
V
26
R
H
CE2
PHE
A
332
L
-
C
GLY
V
26
R
H
CE2
PHE
A
332
L
-
O
GLY
V
26
R
H
CE2
PHE
A
332
L
-
HA2
GLY
V
26
R
H
CE2
PHE
A
332
L
-
HA3
GLY
V
26
R
H
CZ
PHE
A
332
L
-
N
GLY
V
26
R
H
CZ
PHE
A
332
L
-
CA
GLY
V
26
R
H
CZ
PHE
A
332
L
-
C
GLY
V
26
R
H
CZ
PHE
A
332
L
-
O
GLY
V
26
R
H
CZ
PHE
A
332
L
-
HA2
GLY
V
26
R
H
CZ
PHE
A
332
L
-
HA3
GLY
V
26
R
H
CZ
PHE
A
332
L
-
HD2
LYS
V
150
R
H
CZ
PHE
A
332
L
-
HZ3
LYS
V
150
R
H
CB
GLN
A
428
L
-
HB2
SER
V
149
R
H
CD
GLN
A
428
L
-
O
SER
V
149
R
H
OE1
GLN
A
428
L
-
O
SER
V
149
R
H
OE1
GLN
A
428
L
-
HB3
LYS
V
150
R
H
CD2
LEU
A
431
L
-
HD3
LYS
V
150
R
H
CB
ALA
A
432
L
-
O
LYS
V
148
R
H
CB
ALA
A
432
L
-
HA
SER
V
149
R
H
CB
VAL
A
435
L
-
HA
THR
V
27
R
H
CG1
VAL
A
435
L
-
O
GLY
V
26
R
H
CG1
VAL
A
435
L
-
CA
THR
V
27
R
H
CG1
VAL
A
435
L
-
CB
THR
V
27
R
H
CG1
VAL
A
435
L
-
HA
THR
V
27
R
H
CG1
VAL
A
435
L
-
HB
THR
V
27
R
H
CG1
VAL
A
435
L
-
HG22
THR
V
27
R
H
CG1
VAL
A
435
L
-
N
PHE
V
28
R
H
CG1
VAL
A
435
L
-
H
PHE
V
28
R
H
CG2
VAL
A
435
L
-
O
GLY
V
26
R
H
CG2
VAL
A
435
L
-
HA
THR
V
27
R
H
CG
LEU
A
436
L
-
OE1
GLU
V
30
R
H
CD1
LEU
A
436
L
-
CG
GLU
V
30
R
H
CD1
LEU
A
436
L
-
CD
GLU
V
30
R
H
CD1
LEU
A
436
L
-
OE1
GLU
V
30
R
H
CD1
LEU
A
436
L
-
HG3
GLU
V
30
R
H
CD2
LEU
A
436
L
-
OE1
GLU
V
30
R
H
SD
MET
A
443
L
-
HG22
ILE
V
29
R
H
CA
GLU
A
453
L
-
HE3
LYS
V
31
R
H
CA
GLU
A
453
L
-
HZ1
LYS
V
31
R
H
CB
GLU
A
453
L
-
HE3
LYS
V
31
R
H
CB
GLU
A
453
L
-
HZ1
LYS
V
31
R
H
O
GLU
A
453
L
-
HZ1
LYS
V
31
R
H
CG
GLU
A
453
L
-
CE
LYS
V
31
R
H
CG
GLU
A
453
L
-
HE2
LYS
V
31
R
H
CG
GLU
A
453
L
-
HE3
LYS
V
31
R
H
CG
GLU
A
453
L
-
HZ1
LYS
V
31
R
H
OE1
GLU
A
453
L
-
O
TYR
V
32
R
H
CB
PHE
A
456
L
-
NZ
LYS
V
31
R
H
CB
PHE
A
456
L
-
HZ1
LYS
V
31
R
H
CG
PHE
A
456
L
-
NZ
LYS
V
31
R
H
CG
PHE
A
456
L
-
HZ1
LYS
V
31
R
H
CG
PHE
A
456
L
-
HZ2
LYS
V
31
R
H
CG
PHE
A
456
L
-
HZ3
LYS
V
31
R
H
CD1
PHE
A
456
L
-
NZ
LYS
V
31
R
H
CD1
PHE
A
456
L
-
HZ1
LYS
V
31
R
H
CD1
PHE
A
456
L
-
HZ2
LYS
V
31
R
H
CD1
PHE
A
456
L
-
HZ3
LYS
V
31
R
H
CE1
PHE
A
456
L
-
NZ
LYS
V
31
R
H
CE1
PHE
A
456
L
-
HZ1
LYS
V
31
R
H
CE1
PHE
A
456
L
-
HZ3
LYS
V
31
R
H
CE1
PHE
A
456
L
-
OD2
ASP
V
33
R
H
CZ
PHE
A
456
L
-
HZ3
LYS
V
31
R
H
CD
ARG
A
457
L
-
HD3
PRO
V
34
R
H
NE
ARG
A
457
L
-
HG2
PRO
V
34
R
H
NE
ARG
A
457
L
-
HD3
PRO
V
34
R
H
NH1
ARG
A
457
L
-
CG
PRO
V
34
R
H
NH1
ARG
A
457
L
-
CD
PRO
V
34
R
H
NH1
ARG
A
457
L
-
HB2
PRO
V
34
R
H
NH1
ARG
A
457
L
-
HG2
PRO
V
34
R
H
NH1
ARG
A
457
L
-
HG3
PRO
V
34
R
H
NH1
ARG
A
457
L
-
HD2
PRO
V
34
R
H
NH1
ARG
A
457
L
-
HD3
PRO
V
34
R
H
NH2
ARG
A
457
L
-
CB
PRO
V
34
R
H
NH2
ARG
A
457
L
-
CG
PRO
V
34
R
H
NH2
ARG
A
457
L
-
HB2
PRO
V
34
R
H
NH2
ARG
A
457
L
-
HG2
PRO
V
34
R
H
CZ
ARG
A
457
L
-
CG
PRO
V
34
R
H
CZ
ARG
A
457
L
-
HB2
PRO
V
34
R
H
CZ
ARG
A
457
L
-
HG2
PRO
V
34
R
H
CZ
ARG
A
457
L
-
HD3
PRO
V
34
R
H
CD1
LEU
A
464
L
-
HD13
ILE
V
36
R
-
CA
GLY
A
519
L
H
HD13
LEU
V
70
R
-
C
GLY
A
519
L
H
CD1
LEU
V
70
R
-
C
GLY
A
519
L
H
CD2
LEU
V
70
R
-
C
GLY
A
519
L
H
HD12
LEU
V
70
R
-
C
GLY
A
519
L
H
HD13
LEU
V
70
R
-
C
GLY
A
519
L
H
HD22
LEU
V
70
R
-
C
GLY
A
519
L
H
HD23
LEU
V
70
R
-
O
GLY
A
519
L
H
CG
LEU
V
70
R
-
O
GLY
A
519
L
H
CD1
LEU
V
70
R
-
O
GLY
A
519
L
H
CD2
LEU
V
70
R
-
O
GLY
A
519
L
H
HD12
LEU
V
70
R
-
O
GLY
A
519
L
H
HD13
LEU
V
70
R
-
O
GLY
A
519
L
H
HD21
LEU
V
70
R
-
O
GLY
A
519
L
H
HD22
LEU
V
70
R
-
O
GLY
A
519
L
H
HD23
LEU
V
70
R
-
N
THR
A
520
L
H
CD2
LEU
V
70
R
-
N
THR
A
520
L
H
HD13
LEU
V
70
R
-
N
THR
A
520
L
H
HD22
LEU
V
70
R
-
N
THR
A
520
L
H
HD23
LEU
V
70
R
-
CA
THR
A
520
L
H
CD2
LEU
V
70
R
-
CA
THR
A
520
L
H
HD21
LEU
V
70
R
-
CA
THR
A
520
L
H
HD22
LEU
V
70
R
-
CA
THR
A
520
L
H
HD23
LEU
V
70
R
-
C
THR
A
520
L
H
CB
LEU
V
70
R
-
C
THR
A
520
L
H
CG
LEU
V
70
R
-
C
THR
A
520
L
H
CD2
LEU
V
70
R
-
C
THR
A
520
L
H
HB2
LEU
V
70
R
-
C
THR
A
520
L
H
HB3
LEU
V
70
R
-
C
THR
A
520
L
H
HD13
LEU
V
70
R
-
C
THR
A
520
L
H
HD21
LEU
V
70
R
-
C
THR
A
520
L
H
HD22
LEU
V
70
R
-
C
THR
A
520
L
H
HD23
LEU
V
70
R
-
CB
THR
A
520
L
H
HD22
LEU
V
70
R
-
O
THR
A
520
L
H
CA
MET
V
67
R
-
O
THR
A
520
L
H
HA
MET
V
67
R
-
O
THR
A
520
L
H
HB3
MET
V
67
R
-
O
THR
A
520
L
H
HG2
MET
V
67
R
-
O
THR
A
520
L
H
CB
LEU
V
70
R
-
O
THR
A
520
L
H
CG
LEU
V
70
R
-
O
THR
A
520
L
H
CD2
LEU
V
70
R
-
O
THR
A
520
L
H
HB2
LEU
V
70
R
-
O
THR
A
520
L
H
HB3
LEU
V
70
R
-
O
THR
A
520
L
H
HD21
LEU
V
70
R
-
O
THR
A
520
L
H
HD22
LEU
V
70
R
-
O
THR
A
520
L
H
HD23
LEU
V
70
R
-
N
GLY
A
521
L
H
CD2
LEU
V
70
R
-
N
GLY
A
521
L
H
HB2
LEU
V
70
R
-
N
GLY
A
521
L
H
HD13
LEU
V
70
R
-
N
GLY
A
521
L
H
HD22
LEU
V
70
R
-
CA
GLY
A
521
L
H
HB2
LEU
V
70
R
-
CA
GLY
A
521
L
H
HD22
LEU
V
70
R
-
C
GLY
A
521
L
H
CB
LEU
V
70
R
-
C
GLY
A
521
L
H
HB2
LEU
V
70
R
-
C
GLY
A
521
L
H
HD13
LEU
V
70
R
-
O
GLY
A
521
L
H
CB
LEU
V
70
R
-
O
GLY
A
521
L
H
CD1
LEU
V
70
R
-
O
GLY
A
521
L
H
HA
LEU
V
70
R
-
O
GLY
A
521
L
H
HB2
LEU
V
70
R
-
O
GLY
A
521
L
H
HD13
LEU
V
70
R
-
O
GLY
A
521
L
H
HD22
LEU
V
70
R
-
N
THR
A
522
L
H
O
SER
V
66
R
-
N
THR
A
522
L
H
CB
ASP
V
69
R
-
N
THR
A
522
L
H
HB2
ASP
V
69
R
-
N
THR
A
522
L
H
HB3
ASP
V
69
R
-
N
THR
A
522
L
H
H
LEU
V
70
R
-
N
THR
A
522
L
H
HB2
LEU
V
70
R
-
CA
THR
A
522
L
H
CB
ASP
V
69
R
-
CA
THR
A
522
L
H
OD2
ASP
V
69
R
-
CA
THR
A
522
L
H
HB2
ASP
V
69
R
-
CA
THR
A
522
L
H
HB3
ASP
V
69
R
-
CA
THR
A
522
L
H
H
LEU
V
70
R
-
C
THR
A
522
L
H
HB2
ASP
V
69
R
-
C
THR
A
522
L
H
HB3
ASP
V
69
R
-
CB
THR
A
522
L
H
CA
ASP
V
69
R
-
CB
THR
A
522
L
H
CB
ASP
V
69
R
-
CB
THR
A
522
L
H
CG
ASP
V
69
R
-
CB
THR
A
522
L
H
OD2
ASP
V
69
R
-
CB
THR
A
522
L
H
HB2
ASP
V
69
R
-
CB
THR
A
522
L
H
HB3
ASP
V
69
R
-
CG2
THR
A
522
L
H
CA
ASP
V
69
R
-
CG2
THR
A
522
L
H
CB
ASP
V
69
R
-
CG2
THR
A
522
L
H
CG
ASP
V
69
R
-
CG2
THR
A
522
L
H
OD1
ASP
V
69
R
-
CG2
THR
A
522
L
H
OD2
ASP
V
69
R
-
CG2
THR
A
522
L
H
HA
ASP
V
69
R
-
CG2
THR
A
522
L
H
HB2
ASP
V
69
R
-
CG2
THR
A
522
L
H
HB3
ASP
V
69
R
-
CG2
THR
A
522
L
H
HG22
VAL
V
103
R
-
OG1
THR
A
522
L
H
O
SER
V
66
R
-
OG1
THR
A
522
L
H
N
ASP
V
69
R
-
OG1
THR
A
522
L
H
CA
ASP
V
69
R
-
OG1
THR
A
522
L
H
CB
ASP
V
69
R
-
OG1
THR
A
522
L
H
CG
ASP
V
69
R
-
OG1
THR
A
522
L
H
OD1
ASP
V
69
R
-
OG1
THR
A
522
L
H
OD2
ASP
V
69
R
-
OG1
THR
A
522
L
H
H
ASP
V
69
R
-
OG1
THR
A
522
L
H
HB2
ASP
V
69
R
-
OG1
THR
A
522
L
H
HB3
ASP
V
69
R
-
OG1
THR
A
522
L
H
H
LEU
V
70
R
-
N
LEU
A
523
L
H
HB3
ASP
V
69
R
-
N
LEU
A
523
L
H
HD2
LYS
V
73
R
-
CA
LEU
A
523
L
H
HD2
LYS
V
73
R
-
CA
LEU
A
523
L
H
HZ2
LYS
V
73
R
-
C
LEU
A
523
L
H
NZ
LYS
V
73
R
-
C
LEU
A
523
L
H
HZ2
LYS
V
73
R
-
C
LEU
A
523
L
H
HZ3
LYS
V
73
R
-
CB
LEU
A
523
L
H
HZ2
LYS
V
73
R
-
O
LEU
A
523
L
H
NZ
LYS
V
73
R
-
O
LEU
A
523
L
H
HZ2
LYS
V
73
R
-
O
LEU
A
523
L
H
HZ3
LYS
V
73
R
-
CD2
LEU
A
523
L
H
HD2
LYS
V
73
R
-
N
ASP
A
524
L
H
HZ2
LYS
V
73
R
-
C
ASP
A
524
L
H
HZ3
LYS
V
73
R
-
O
ASP
A
524
L
H
HD13
LEU
V
70
R
-
O
ASP
A
524
L
H
NZ
LYS
V
73
R
-
O
ASP
A
524
L
H
HD3
LYS
V
73
R
-
O
ASP
A
524
L
H
HZ2
LYS
V
73
R
-
O
ASP
A
524
L
H
HZ3
LYS
V
73
R
-
N
LEU
A
525
L
H
HZ3
LYS
V
73
R
-
CA
LEU
A
525
L
H
HZ3
LYS
V
73
R
-
CG
LEU
A
525
L
H
HZ1
LYS
V
73
R
-
CD2
LEU
A
525
L
H
NZ
LYS
V
73
R
-
CD2
LEU
A
525
L
H
HZ1
LYS
V
73
R
-
CD2
LEU
A
525
L
H
HZ2
LYS
V
73
R
-
CD2
LEU
A
525
L
H
HZ3
LYS
V
73
R
S
O
ARG
A
556
L
H
HZ1
LYS
V
73