A1IGU5_P20336.1
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
ASN
A
289
L
-
VAL
V
55
R
H
TYR
A
293
L
H
ILE
V
87
R
H
ASN
A
296
L
-
GLY
V
56
R
H
ASN
A
296
L
S
ILE
V
57
R
H
ASN
A
296
L
H
TYR
V
91
R
H
LEU
A
297
L
H
TYR
V
91
R
H
ALA
A
299
L
S
TRP
V
76
R
H
ALA
A
299
L
H
TYR
V
91
R
H
PHE
A
300
L
S
TRP
V
76
R
H
PHE
A
300
L
H
ALA
V
90
R
H
PHE
A
300
L
H
TYR
V
91
R
-
PHE
A
303
L
S
MET
V
22
R
-
PHE
A
303
L
S
LYS
V
24
R
-
PHE
A
303
L
S
GLN
V
74
R
-
PHE
A
303
L
S
TRP
V
76
R
H
PRO
A
305
L
-
GLY
V
94
R
-
TYR
A
308
L
-
PHE
V
19
R
-
TYR
A
308
L
S
MET
V
22
R
-
LEU
A
310
L
-
TRP
V
125
R
-
LEU
A
310
L
H
LEU
V
191
R
H
ALA
A
317
L
-
TRP
V
125
R
H
GLN
A
319
L
-
ARG
V
93
R
H
TYR
A
320
L
-
TRP
V
125
R
H
TYR
A
320
L
-
ARG
V
93
R
H
TYR
A
320
L
-
GLY
V
94
R
H
CYS
A
321
L
-
ARG
V
93
R
H
LEU
A
323
L
-
ARG
V
93
R
H
ALA
A
324
L
-
ARG
V
93
R
H
ARG
A
325
L
-
ARG
V
93
R
H
LEU
A
464
L
H
LYS
V
186
R
H
THR
A
467
L
H
LYS
V
186
R
H
THR
A
467
L
H
GLU
V
189
R
H
THR
A
467
L
-
THR
V
193
R
H
SER
A
468
L
H
GLU
V
189
R
H
GLN
A
470
L
-
THR
V
193
R
H
LEU
A
471
L
H
GLU
V
185
R
H
LEU
A
471
L
H
SER
V
188
R
H
LEU
A
471
L
H
GLU
V
189
R
H
GLN
A
475
L
H
GLU
V
185
R
-
SER
A
518
L
H
ARG
V
178
R
-
GLY
A
519
L
S
GLU
V
160
R
-
GLY
A
519
L
S
PHE
V
162
R
-
GLY
A
519
L
H
ARG
V
178
R
-
THR
A
520
L
S
GLU
V
160
R
-
THR
A
520
L
S
PHE
V
161
R
-
THR
A
520
L
H
ARG
V
178
R
-
GLY
A
521
L
H
ARG
V
151
R
-
GLY
A
521
L
S
PHE
V
161
R
-
THR
A
522
L
H
SER
V
147
R
-
THR
A
522
L
H
ARG
V
151
R
-
THR
A
522
L
S
PHE
V
161
R
-
THR
A
522
L
S
PHE
V
162
R
-
THR
A
522
L
S
GLU
V
163
R
-
LEU
A
523
L
-
ASN
V
171
R
-
ASP
A
524
L
S
PHE
V
162
R
-
LEU
A
525
L
H
GLN
V
174
R
-
THR
A
526
L
H
ARG
V
178
R
-
THR
A
526
L
H
ASP
V
181
R
-
THR
A
526
L
S
ARG
V
66
R
-
LYS
A
542
L
H
GLU
V
148
R
S
ARG
A
547
L
H
ARG
V
151
R
-
HIS
A
555
L
H
GLN
V
174
R
-
SER
A
675
L
-
SER
V
3
R
-
SER
A
675
L
-
ALA
V
4
A1IGU5_P20336.1
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
OD1
ASN
A
289
L
-
HG13
VAL
V
55
R
H
CD2
TYR
A
293
L
H
CD1
ILE
V
87
R
H
CD2
TYR
A
293
L
H
HD11
ILE
V
87
R
H
CD2
TYR
A
293
L
H
HD13
ILE
V
87
R
H
CE2
TYR
A
293
L
H
CD1
ILE
V
87
R
H
CE2
TYR
A
293
L
H
HG13
ILE
V
87
R
H
CE2
TYR
A
293
L
H
HD11
ILE
V
87
R
H
CE2
TYR
A
293
L
H
HD13
ILE
V
87
R
H
OH
TYR
A
293
L
H
HG13
ILE
V
87
R
H
CA
ASN
A
296
L
H
HH
TYR
V
91
R
H
C
ASN
A
296
L
H
OH
TYR
V
91
R
H
C
ASN
A
296
L
H
HH
TYR
V
91
R
H
CB
ASN
A
296
L
H
HH
TYR
V
91
R
H
O
ASN
A
296
L
H
OH
TYR
V
91
R
H
O
ASN
A
296
L
H
CZ
TYR
V
91
R
H
O
ASN
A
296
L
H
HE1
TYR
V
91
R
H
O
ASN
A
296
L
H
HH
TYR
V
91
R
H
CG
ASN
A
296
L
-
HA3
GLY
V
56
R
H
CG
ASN
A
296
L
S
O
ILE
V
57
R
H
CG
ASN
A
296
L
S
H
ILE
V
57
R
H
CG
ASN
A
296
L
S
HB
ILE
V
57
R
H
ND2
ASN
A
296
L
-
CA
GLY
V
56
R
H
ND2
ASN
A
296
L
-
HA3
GLY
V
56
R
H
ND2
ASN
A
296
L
S
N
ILE
V
57
R
H
ND2
ASN
A
296
L
S
H
ILE
V
57
R
H
OD1
ASN
A
296
L
S
N
ILE
V
57
R
H
OD1
ASN
A
296
L
S
C
ILE
V
57
R
H
OD1
ASN
A
296
L
S
O
ILE
V
57
R
H
OD1
ASN
A
296
L
S
H
ILE
V
57
R
H
OD1
ASN
A
296
L
S
HB
ILE
V
57
R
H
N
LEU
A
297
L
H
OH
TYR
V
91
R
H
N
LEU
A
297
L
H
HH
TYR
V
91
R
H
CA
LEU
A
297
L
H
OH
TYR
V
91
R
H
CA
ALA
A
299
L
S
HH2
TRP
V
76
R
H
C
ALA
A
299
L
S
CH2
TRP
V
76
R
H
C
ALA
A
299
L
S
HH2
TRP
V
76
R
H
C
ALA
A
299
L
S
HZ3
TRP
V
76
R
H
C
ALA
A
299
L
H
HE1
TYR
V
91
R
H
CB
ALA
A
299
L
S
HH2
TRP
V
76
R
H
CB
ALA
A
299
L
S
HZ3
TRP
V
76
R
H
O
ALA
A
299
L
S
CH2
TRP
V
76
R
H
O
ALA
A
299
L
S
HH2
TRP
V
76
R
H
N
PHE
A
300
L
S
CH2
TRP
V
76
R
H
N
PHE
A
300
L
S
HH2
TRP
V
76
R
H
N
PHE
A
300
L
S
HZ3
TRP
V
76
R
H
N
PHE
A
300
L
H
CE1
TYR
V
91
R
H
N
PHE
A
300
L
H
OH
TYR
V
91
R
H
N
PHE
A
300
L
H
HE1
TYR
V
91
R
H
N
PHE
A
300
L
H
HH
TYR
V
91
R
H
CA
PHE
A
300
L
S
CH2
TRP
V
76
R
H
CA
PHE
A
300
L
S
HH2
TRP
V
76
R
H
CA
PHE
A
300
L
S
HZ3
TRP
V
76
R
H
CA
PHE
A
300
L
H
CE1
TYR
V
91
R
H
CA
PHE
A
300
L
H
OH
TYR
V
91
R
H
CA
PHE
A
300
L
H
CZ
TYR
V
91
R
H
CA
PHE
A
300
L
H
HE1
TYR
V
91
R
H
C
PHE
A
300
L
S
HH2
TRP
V
76
R
H
CB
PHE
A
300
L
H
CD1
TYR
V
91
R
H
CB
PHE
A
300
L
H
CE1
TYR
V
91
R
H
CB
PHE
A
300
L
H
OH
TYR
V
91
R
H
CB
PHE
A
300
L
H
CZ
TYR
V
91
R
H
CB
PHE
A
300
L
H
HE1
TYR
V
91
R
H
CB
PHE
A
300
L
H
HH
TYR
V
91
R
H
CG
PHE
A
300
L
H
CD1
TYR
V
91
R
H
CG
PHE
A
300
L
H
CE1
TYR
V
91
R
H
CG
PHE
A
300
L
H
OH
TYR
V
91
R
H
CG
PHE
A
300
L
H
CZ
TYR
V
91
R
H
CG
PHE
A
300
L
H
HE1
TYR
V
91
R
H
CD2
PHE
A
300
L
H
CG
TYR
V
91
R
H
CD2
PHE
A
300
L
H
CD1
TYR
V
91
R
H
CD2
PHE
A
300
L
H
CD2
TYR
V
91
R
H
CD2
PHE
A
300
L
H
CE1
TYR
V
91
R
H
CD2
PHE
A
300
L
H
CE2
TYR
V
91
R
H
CD2
PHE
A
300
L
H
CZ
TYR
V
91
R
H
CD2
PHE
A
300
L
H
HA
TYR
V
91
R
H
CD2
PHE
A
300
L
H
HD1
TYR
V
91
R
H
CD2
PHE
A
300
L
H
HE1
TYR
V
91
R
H
CE2
PHE
A
300
L
H
C
ALA
V
90
R
H
CE2
PHE
A
300
L
H
O
ALA
V
90
R
H
CE2
PHE
A
300
L
H
CA
TYR
V
91
R
H
CE2
PHE
A
300
L
H
CG
TYR
V
91
R
H
CE2
PHE
A
300
L
H
CD1
TYR
V
91
R
H
CE2
PHE
A
300
L
H
HA
TYR
V
91
R
H
CZ
PHE
A
300
L
H
O
ALA
V
90
R
-
CA
PHE
A
303
L
S
HE22
GLN
V
74
R
-
CB
PHE
A
303
L
S
HE22
GLN
V
74
R
-
CB
PHE
A
303
L
S
CZ2
TRP
V
76
R
-
CB
PHE
A
303
L
S
HH2
TRP
V
76
R
-
CB
PHE
A
303
L
S
HZ2
TRP
V
76
R
-
CG
PHE
A
303
L
S
HD2
LYS
V
24
R
-
CG
PHE
A
303
L
S
CD
GLN
V
74
R
-
CG
PHE
A
303
L
S
NE2
GLN
V
74
R
-
CG
PHE
A
303
L
S
OE1
GLN
V
74
R
-
CG
PHE
A
303
L
S
HE22
GLN
V
74
R
-
CG
PHE
A
303
L
S
HZ2
TRP
V
76
R
-
CD1
PHE
A
303
L
S
CD
LYS
V
24
R
-
CD1
PHE
A
303
L
S
CE
LYS
V
24
R
-
CD1
PHE
A
303
L
S
NZ
LYS
V
24
R
-
CD1
PHE
A
303
L
S
HB3
LYS
V
24
R
-
CD1
PHE
A
303
L
S
HD2
LYS
V
24
R
-
CD1
PHE
A
303
L
S
HD3
LYS
V
24
R
-
CD1
PHE
A
303
L
S
HE2
LYS
V
24
R
-
CD1
PHE
A
303
L
S
HZ2
LYS
V
24
R
-
CD1
PHE
A
303
L
S
HZ3
LYS
V
24
R
-
CD1
PHE
A
303
L
S
OE1
GLN
V
74
R
-
CD1
PHE
A
303
L
S
HZ2
TRP
V
76
R
-
CD2
PHE
A
303
L
S
HD2
LYS
V
24
R
-
CD2
PHE
A
303
L
S
CD
GLN
V
74
R
-
CD2
PHE
A
303
L
S
NE2
GLN
V
74
R
-
CD2
PHE
A
303
L
S
OE1
GLN
V
74
R
-
CD2
PHE
A
303
L
S
HE21
GLN
V
74
R
-
CD2
PHE
A
303
L
S
HE22
GLN
V
74
R
-
CD2
PHE
A
303
L
S
HZ2
TRP
V
76
R
-
CE1
PHE
A
303
L
S
CB
LYS
V
24
R
-
CE1
PHE
A
303
L
S
CG
LYS
V
24
R
-
CE1
PHE
A
303
L
S
CD
LYS
V
24
R
-
CE1
PHE
A
303
L
S
CE
LYS
V
24
R
-
CE1
PHE
A
303
L
S
NZ
LYS
V
24
R
-
CE1
PHE
A
303
L
S
HB2
LYS
V
24
R
-
CE1
PHE
A
303
L
S
HB3
LYS
V
24
R
-
CE1
PHE
A
303
L
S
HG3
LYS
V
24
R
-
CE1
PHE
A
303
L
S
HD2
LYS
V
24
R
-
CE1
PHE
A
303
L
S
HD3
LYS
V
24
R
-
CE1
PHE
A
303
L
S
HE2
LYS
V
24
R
-
CE1
PHE
A
303
L
S
HZ2
LYS
V
24
R
-
CE1
PHE
A
303
L
S
HZ3
LYS
V
24
R
-
CE1
PHE
A
303
L
S
OE1
GLN
V
74
R
-
CE2
PHE
A
303
L
S
SD
MET
V
22
R
-
CE2
PHE
A
303
L
S
HG3
MET
V
22
R
-
CE2
PHE
A
303
L
S
HB3
LYS
V
24
R
-
CE2
PHE
A
303
L
S
HD2
LYS
V
24
R
-
CE2
PHE
A
303
L
S
CD
GLN
V
74
R
-
CE2
PHE
A
303
L
S
NE2
GLN
V
74
R
-
CE2
PHE
A
303
L
S
OE1
GLN
V
74
R
-
CE2
PHE
A
303
L
S
HE22
GLN
V
74
R
-
CZ
PHE
A
303
L
S
CB
LYS
V
24
R
-
CZ
PHE
A
303
L
S
CG
LYS
V
24
R
-
CZ
PHE
A
303
L
S
CD
LYS
V
24
R
-
CZ
PHE
A
303
L
S
HB2
LYS
V
24
R
-
CZ
PHE
A
303
L
S
HB3
LYS
V
24
R
-
CZ
PHE
A
303
L
S
HG3
LYS
V
24
R
-
CZ
PHE
A
303
L
S
HD2
LYS
V
24
R
-
CZ
PHE
A
303
L
S
HD3
LYS
V
24
R
-
CZ
PHE
A
303
L
S
OE1
GLN
V
74
R
H
CB
PRO
A
305
L
-
HA2
GLY
V
94
R
H
CG
PRO
A
305
L
-
HA2
GLY
V
94
R
-
CD1
TYR
A
308
L
S
HB3
MET
V
22
R
-
CE1
TYR
A
308
L
-
CZ
PHE
V
19
R
-
CE1
TYR
A
308
L
-
HE2
PHE
V
19
R
-
CE1
TYR
A
308
L
-
HZ
PHE
V
19
R
-
CE1
TYR
A
308
L
S
HB2
MET
V
22
R
-
CE1
TYR
A
308
L
S
HB3
MET
V
22
R
-
CE1
TYR
A
308
L
S
HE2
MET
V
22
R
-
CE2
TYR
A
308
L
S
SD
MET
V
22
R
-
OH
TYR
A
308
L
-
HZ
PHE
V
19
R
-
OH
TYR
A
308
L
S
SD
MET
V
22
R
-
OH
TYR
A
308
L
S
CE
MET
V
22
R
-
OH
TYR
A
308
L
S
HE1
MET
V
22
R
-
OH
TYR
A
308
L
S
HE2
MET
V
22
R
-
OH
TYR
A
308
L
S
HE3
MET
V
22
R
-
CZ
TYR
A
308
L
-
HZ
PHE
V
19
R
-
CZ
TYR
A
308
L
S
SD
MET
V
22
R
-
CZ
TYR
A
308
L
S
CE
MET
V
22
R
-
CZ
TYR
A
308
L
S
HB3
MET
V
22
R
-
CZ
TYR
A
308
L
S
HE2
MET
V
22
R
-
O
LEU
A
310
L
H
HD22
LEU
V
191
R
-
CD1
LEU
A
310
L
-
HH2
TRP
V
125
R
H
CB
ALA
A
317
L
-
HZ2
TRP
V
125
R
H
O
GLN
A
319
L
-
HH22
ARG
V
93
R
H
CA
TYR
A
320
L
-
NH2
ARG
V
93
R
H
CA
TYR
A
320
L
-
HH22
ARG
V
93
R
H
C
TYR
A
320
L
-
NH2
ARG
V
93
R
H
C
TYR
A
320
L
-
HH21
ARG
V
93
R
H
C
TYR
A
320
L
-
HH22
ARG
V
93
R
H
O
TYR
A
320
L
-
NH1
ARG
V
93
R
H
O
TYR
A
320
L
-
NH2
ARG
V
93
R
H
O
TYR
A
320
L
-
CZ
ARG
V
93
R
H
O
TYR
A
320
L
-
HH12
ARG
V
93
R
H
O
TYR
A
320
L
-
HH21
ARG
V
93
R
H
O
TYR
A
320
L
-
HH22
ARG
V
93
R
H
CG
TYR
A
320
L
-
NH2
ARG
V
93
R
H
CG
TYR
A
320
L
-
HH22
ARG
V
93
R
H
CD2
TYR
A
320
L
-
NH1
ARG
V
93
R
H
CD2
TYR
A
320
L
-
NH2
ARG
V
93
R
H
CD2
TYR
A
320
L
-
CZ
ARG
V
93
R
H
CD2
TYR
A
320
L
-
HG2
ARG
V
93
R
H
CD2
TYR
A
320
L
-
HH11
ARG
V
93
R
H
CD2
TYR
A
320
L
-
HH12
ARG
V
93
R
H
CD2
TYR
A
320
L
-
HH22
ARG
V
93
R
H
CE1
TYR
A
320
L
-
CG
ARG
V
93
R
H
CE1
TYR
A
320
L
-
HG2
ARG
V
93
R
H
CE1
TYR
A
320
L
-
HG3
ARG
V
93
R
H
CE1
TYR
A
320
L
-
H
GLY
V
94
R
H
CE1
TYR
A
320
L
-
HA3
GLY
V
94
R
H
CE2
TYR
A
320
L
-
CG
ARG
V
93
R
H
CE2
TYR
A
320
L
-
NE
ARG
V
93
R
H
CE2
TYR
A
320
L
-
NH1
ARG
V
93
R
H
CE2
TYR
A
320
L
-
CZ
ARG
V
93
R
H
CE2
TYR
A
320
L
-
HG2
ARG
V
93
R
H
CE2
TYR
A
320
L
-
HG3
ARG
V
93
R
H
CE2
TYR
A
320
L
-
HH11
ARG
V
93
R
H
CE2
TYR
A
320
L
-
HH12
ARG
V
93
R
H
OH
TYR
A
320
L
-
CA
ARG
V
93
R
H
OH
TYR
A
320
L
-
C
ARG
V
93
R
H
OH
TYR
A
320
L
-
CB
ARG
V
93
R
H
OH
TYR
A
320
L
-
CG
ARG
V
93
R
H
OH
TYR
A
320
L
-
CD
ARG
V
93
R
H
OH
TYR
A
320
L
-
NE
ARG
V
93
R
H
OH
TYR
A
320
L
-
HA
ARG
V
93
R
H
OH
TYR
A
320
L
-
HB2
ARG
V
93
R
H
OH
TYR
A
320
L
-
HB3
ARG
V
93
R
H
OH
TYR
A
320
L
-
HG2
ARG
V
93
R
H
OH
TYR
A
320
L
-
HG3
ARG
V
93
R
H
OH
TYR
A
320
L
-
HD2
ARG
V
93
R
H
OH
TYR
A
320
L
-
N
GLY
V
94
R
H
OH
TYR
A
320
L
-
CA
GLY
V
94
R
H
OH
TYR
A
320
L
-
H
GLY
V
94
R
H
OH
TYR
A
320
L
-
HA2
GLY
V
94
R
H
OH
TYR
A
320
L
-
HA3
GLY
V
94
R
H
OH
TYR
A
320
L
-
HB2
TRP
V
125
R
H
CZ
TYR
A
320
L
-
CG
ARG
V
93
R
H
CZ
TYR
A
320
L
-
CD
ARG
V
93
R
H
CZ
TYR
A
320
L
-
NE
ARG
V
93
R
H
CZ
TYR
A
320
L
-
NH1
ARG
V
93
R
H
CZ
TYR
A
320
L
-
CZ
ARG
V
93
R
H
CZ
TYR
A
320
L
-
HA
ARG
V
93
R
H
CZ
TYR
A
320
L
-
HG2
ARG
V
93
R
H
CZ
TYR
A
320
L
-
HG3
ARG
V
93
R
H
CZ
TYR
A
320
L
-
HH11
ARG
V
93
R
H
CZ
TYR
A
320
L
-
N
GLY
V
94
R
H
CZ
TYR
A
320
L
-
H
GLY
V
94
R
H
CZ
TYR
A
320
L
-
HB2
TRP
V
125
R
H
N
CYS
A
321
L
-
HH21
ARG
V
93
R
H
N
CYS
A
321
L
-
HH22
ARG
V
93
R
H
CA
CYS
A
321
L
-
HH21
ARG
V
93
R
H
C
CYS
A
321
L
-
HH21
ARG
V
93
R
H
O
CYS
A
321
L
-
HH21
ARG
V
93
R
H
N
LEU
A
323
L
-
NH2
ARG
V
93
R
H
N
LEU
A
323
L
-
HH21
ARG
V
93
R
H
N
LEU
A
323
L
-
HH22
ARG
V
93
R
H
CA
LEU
A
323
L
-
NH2
ARG
V
93
R
H
CA
LEU
A
323
L
-
HH21
ARG
V
93
R
H
CA
LEU
A
323
L
-
HH22
ARG
V
93
R
H
C
LEU
A
323
L
-
NH2
ARG
V
93
R
H
C
LEU
A
323
L
-
CZ
ARG
V
93
R
H
C
LEU
A
323
L
-
HH21
ARG
V
93
R
H
C
LEU
A
323
L
-
HH22
ARG
V
93
R
H
CB
LEU
A
323
L
-
NH1
ARG
V
93
R
H
CB
LEU
A
323
L
-
NH2
ARG
V
93
R
H
CB
LEU
A
323
L
-
HH12
ARG
V
93
R
H
CB
LEU
A
323
L
-
HH22
ARG
V
93
R
H
O
LEU
A
323
L
-
NH2
ARG
V
93
R
H
O
LEU
A
323
L
-
HH21
ARG
V
93
R
H
O
LEU
A
323
L
-
HH22
ARG
V
93
R
H
CG
LEU
A
323
L
-
NH1
ARG
V
93
R
H
CG
LEU
A
323
L
-
NH2
ARG
V
93
R
H
CG
LEU
A
323
L
-
HH12
ARG
V
93
R
H
CG
LEU
A
323
L
-
HH22
ARG
V
93
R
H
CD2
LEU
A
323
L
-
NH1
ARG
V
93
R
H
CD2
LEU
A
323
L
-
HH11
ARG
V
93
R
H
CD2
LEU
A
323
L
-
HH12
ARG
V
93
R
H
CD2
LEU
A
323
L
-
HH22
ARG
V
93
R
H
N
ALA
A
324
L
-
NE
ARG
V
93
R
H
N
ALA
A
324
L
-
NH1
ARG
V
93
R
H
N
ALA
A
324
L
-
NH2
ARG
V
93
R
H
N
ALA
A
324
L
-
CZ
ARG
V
93
R
H
N
ALA
A
324
L
-
HE
ARG
V
93
R
H
N
ALA
A
324
L
-
HH12
ARG
V
93
R
H
N
ALA
A
324
L
-
HH21
ARG
V
93
R
H
N
ALA
A
324
L
-
HH22
ARG
V
93
R
H
CA
ALA
A
324
L
-
CD
ARG
V
93
R
H
CA
ALA
A
324
L
-
NE
ARG
V
93
R
H
CA
ALA
A
324
L
-
NH1
ARG
V
93
R
H
CA
ALA
A
324
L
-
NH2
ARG
V
93
R
H
CA
ALA
A
324
L
-
CZ
ARG
V
93
R
H
CA
ALA
A
324
L
-
HD3
ARG
V
93
R
H
CA
ALA
A
324
L
-
HE
ARG
V
93
R
H
CA
ALA
A
324
L
-
HH21
ARG
V
93
R
H
CA
ALA
A
324
L
-
HH22
ARG
V
93
R
H
C
ALA
A
324
L
-
NH2
ARG
V
93
R
H
C
ALA
A
324
L
-
HE
ARG
V
93
R
H
C
ALA
A
324
L
-
HH21
ARG
V
93
R
H
CB
ALA
A
324
L
-
CD
ARG
V
93
R
H
CB
ALA
A
324
L
-
NE
ARG
V
93
R
H
CB
ALA
A
324
L
-
NH1
ARG
V
93
R
H
CB
ALA
A
324
L
-
NH2
ARG
V
93
R
H
CB
ALA
A
324
L
-
CZ
ARG
V
93
R
H
CB
ALA
A
324
L
-
HD3
ARG
V
93
R
H
CB
ALA
A
324
L
-
HE
ARG
V
93
R
H
CB
ALA
A
324
L
-
HH21
ARG
V
93
R
H
CB
ALA
A
324
L
-
HH22
ARG
V
93
R
H
O
ALA
A
324
L
-
HE
ARG
V
93
R
H
N
ARG
A
325
L
-
HH21
ARG
V
93
R
H
CA
LEU
A
464
L
H
HZ3
LYS
V
186
R
H
CB
LEU
A
464
L
H
HZ3
LYS
V
186
R
H
CG
LEU
A
464
L
H
HZ3
LYS
V
186
R
H
CD2
LEU
A
464
L
H
CE
LYS
V
186
R
H
CD2
LEU
A
464
L
H
NZ
LYS
V
186
R
H
CD2
LEU
A
464
L
H
HE2
LYS
V
186
R
H
CD2
LEU
A
464
L
H
HZ2
LYS
V
186
R
H
CD2
LEU
A
464
L
H
HZ3
LYS
V
186
R
H
C
THR
A
467
L
H
CD
GLU
V
189
R
H
C
THR
A
467
L
H
OE1
GLU
V
189
R
H
C
THR
A
467
L
H
OE2
GLU
V
189
R
H
C
THR
A
467
L
H
HG2
GLU
V
189
R
H
CB
THR
A
467
L
H
HZ1
LYS
V
186
R
H
CB
THR
A
467
L
H
HZ2
LYS
V
186
R
H
CB
THR
A
467
L
H
CD
GLU
V
189
R
H
CB
THR
A
467
L
H
OE2
GLU
V
189
R
H
CB
THR
A
467
L
H
HB3
GLU
V
189
R
H
O
THR
A
467
L
H
CG
GLU
V
189
R
H
O
THR
A
467
L
H
CD
GLU
V
189
R
H
O
THR
A
467
L
H
OE1
GLU
V
189
R
H
O
THR
A
467
L
H
OE2
GLU
V
189
R
H
O
THR
A
467
L
H
HG2
GLU
V
189
R
H
CG2
THR
A
467
L
H
HZ2
LYS
V
186
R
H
CG2
THR
A
467
L
H
HB3
GLU
V
189
R
H
CG2
THR
A
467
L
-
HG21
THR
V
193
R
H
OG1
THR
A
467
L
H
NZ
LYS
V
186
R
H
OG1
THR
A
467
L
H
HZ1
LYS
V
186
R
H
OG1
THR
A
467
L
H
HZ2
LYS
V
186
R
H
OG1
THR
A
467
L
H
HZ3
LYS
V
186
R
H
OG1
THR
A
467
L
H
OE2
GLU
V
189
R
H
N
SER
A
468
L
H
OE1
GLU
V
189
R
H
CA
SER
A
468
L
H
OE1
GLU
V
189
R
H
OE1
GLN
A
470
L
-
CG2
THR
V
193
R
H
OE1
GLN
A
470
L
-
HG21
THR
V
193
R
H
OE1
GLN
A
470
L
-
HG22
THR
V
193
R
H
OE1
GLN
A
470
L
-
HG23
THR
V
193
R
H
N
LEU
A
471
L
H
HG2
GLU
V
189
R
H
CA
LEU
A
471
L
H
HG2
GLU
V
189
R
H
CB
LEU
A
471
L
H
CG
GLU
V
189
R
H
CB
LEU
A
471
L
H
CD
GLU
V
189
R
H
CB
LEU
A
471
L
H
OE1
GLU
V
189
R
H
CB
LEU
A
471
L
H
HG2
GLU
V
189
R
H
CB
LEU
A
471
L
H
HG3
GLU
V
189
R
H
CG
LEU
A
471
L
H
HB3
GLU
V
185
R
H
CG
LEU
A
471
L
H
OE1
GLU
V
189
R
H
CG
LEU
A
471
L
H
HG2
GLU
V
189
R
H
CG
LEU
A
471
L
H
HG3
GLU
V
189
R
H
CD1
LEU
A
471
L
H
HG
SER
V
188
R
H
CD1
LEU
A
471
L
H
HG2
GLU
V
189
R
H
CD1
LEU
A
471
L
H
HG3
GLU
V
189
R
H
CD2
LEU
A
471
L
H
CB
GLU
V
185
R
H
CD2
LEU
A
471
L
H
O
GLU
V
185
R
H
CD2
LEU
A
471
L
H
HA
GLU
V
185
R
H
CD2
LEU
A
471
L
H
HB3
GLU
V
185
R
H
CD2
LEU
A
471
L
H
HG2
GLU
V
185
R
H
CD2
LEU
A
471
L
H
CG
GLU
V
189
R
H
CD2
LEU
A
471
L
H
CD
GLU
V
189
R
H
CD2
LEU
A
471
L
H
OE1
GLU
V
189
R
H
CD2
LEU
A
471
L
H
HG3
GLU
V
189
R
H
NE2
GLN
A
475
L
H
HG2
GLU
V
185
R
-
CB
SER
A
518
L
H
NH1
ARG
V
178
R
-
CB
SER
A
518
L
H
CZ
ARG
V
178
R
-
CB
SER
A
518
L
H
HH11
ARG
V
178
R
-
CB
SER
A
518
L
H
HH12
ARG
V
178
R
-
OG
SER
A
518
L
H
NH1
ARG
V
178
R
-
OG
SER
A
518
L
H
HH11
ARG
V
178
R
-
OG
SER
A
518
L
H
HH12
ARG
V
178
R
-
N
GLY
A
519
L
H
HD3
ARG
V
178
R
-
C
GLY
A
519
L
S
HZ
PHE
V
162
R
-
C
GLY
A
519
L
H
HD3
ARG
V
178
R
-
C
GLY
A
519
L
H
HE
ARG
V
178
R
-
O
GLY
A
519
L
S
OE2
GLU
V
160
R
-
O
GLY
A
519
L
S
CZ
PHE
V
162
R
-
O
GLY
A
519
L
S
HZ
PHE
V
162
R
-
O
GLY
A
519
L
H
CG
ARG
V
178
R
-
O
GLY
A
519
L
H
CD
ARG
V
178
R
-
O
GLY
A
519
L
H
NE
ARG
V
178
R
-
O
GLY
A
519
L
H
HG2
ARG
V
178
R
-
O
GLY
A
519
L
H
HD3
ARG
V
178
R
-
O
GLY
A
519
L
H
HE
ARG
V
178
R
-
CA
THR
A
520
L
S
CD
GLU
V
160
R
-
CA
THR
A
520
L
S
OE2
GLU
V
160
R
-
CA
THR
A
520
L
S
HG2
GLU
V
160
R
-
C
THR
A
520
L
S
HB3
GLU
V
160
R
-
C
THR
A
520
L
S
HG2
GLU
V
160
R
-
C
THR
A
520
L
S
H
PHE
V
161
R
-
CB
THR
A
520
L
S
CG
GLU
V
160
R
-
CB
THR
A
520
L
S
CD
GLU
V
160
R
-
CB
THR
A
520
L
S
OE2
GLU
V
160
R
-
CB
THR
A
520
L
S
HG2
GLU
V
160
R
-
O
THR
A
520
L
S
CB
GLU
V
160
R
-
O
THR
A
520
L
S
CG
GLU
V
160
R
-
O
THR
A
520
L
S
HA
GLU
V
160
R
-
O
THR
A
520
L
S
HB3
GLU
V
160
R
-
O
THR
A
520
L
S
HG2
GLU
V
160
R
-
O
THR
A
520
L
S
N
PHE
V
161
R
-
O
THR
A
520
L
S
O
PHE
V
161
R
-
O
THR
A
520
L
S
H
PHE
V
161
R
-
CG2
THR
A
520
L
S
CD
GLU
V
160
R
-
CG2
THR
A
520
L
S
OE1
GLU
V
160
R
-
CG2
THR
A
520
L
S
OE2
GLU
V
160
R
-
CG2
THR
A
520
L
S
HG2
GLU
V
160
R
-
CG2
THR
A
520
L
H
NH2
ARG
V
178
R
-
CG2
THR
A
520
L
H
HE
ARG
V
178
R
-
CG2
THR
A
520
L
H
HH21
ARG
V
178
R
-
CA
GLY
A
521
L
S
O
PHE
V
161
R
-
C
GLY
A
521
L
H
HH21
ARG
V
151
R
-
C
GLY
A
521
L
S
O
PHE
V
161
R
-
O
GLY
A
521
L
S
O
PHE
V
161
R
-
N
THR
A
522
L
H
NH2
ARG
V
151
R
-
N
THR
A
522
L
H
HE
ARG
V
151
R
-
N
THR
A
522
L
H
HH21
ARG
V
151
R
-
N
THR
A
522
L
H
HH22
ARG
V
151
R
-
N
THR
A
522
L
S
O
PHE
V
161
R
-
N
THR
A
522
L
S
HD1
PHE
V
161
R
-
N
THR
A
522
L
S
HA
PHE
V
162
R
-
CA
THR
A
522
L
H
NH2
ARG
V
151
R
-
CA
THR
A
522
L
H
HH21
ARG
V
151
R
-
CA
THR
A
522
L
H
HH22
ARG
V
151
R
-
CA
THR
A
522
L
S
O
PHE
V
161
R
-
CA
THR
A
522
L
S
HD1
PHE
V
161
R
-
CA
THR
A
522
L
S
HA
PHE
V
162
R
-
CA
THR
A
522
L
S
H
GLU
V
163
R
-
C
THR
A
522
L
H
HH21
ARG
V
151
R
-
C
THR
A
522
L
H
HH22
ARG
V
151
R
-
CB
THR
A
522
L
H
NH2
ARG
V
151
R
-
CB
THR
A
522
L
H
HE
ARG
V
151
R
-
CB
THR
A
522
L
H
HH21
ARG
V
151
R
-
CB
THR
A
522
L
H
HH22
ARG
V
151
R
-
CB
THR
A
522
L
S
CD1
PHE
V
161
R
-
CB
THR
A
522
L
S
CE1
PHE
V
161
R
-
CB
THR
A
522
L
S
HD1
PHE
V
161
R
-
CB
THR
A
522
L
S
HE1
PHE
V
161
R
-
CB
THR
A
522
L
S
HA
PHE
V
162
R
-
CB
THR
A
522
L
S
H
GLU
V
163
R
-
CB
THR
A
522
L
S
HG3
GLU
V
163
R
-
O
THR
A
522
L
H
NH2
ARG
V
151
R
-
O
THR
A
522
L
H
HH21
ARG
V
151
R
-
O
THR
A
522
L
H
HH22
ARG
V
151
R
-
CG2
THR
A
522
L
H
HB3
SER
V
147
R
-
CG2
THR
A
522
L
H
HH21
ARG
V
151
R
-
CG2
THR
A
522
L
S
CE1
PHE
V
161
R
-
CG2
THR
A
522
L
S
HE1
PHE
V
161
R
-
CG2
THR
A
522
L
S
HA
PHE
V
162
R
-
CG2
THR
A
522
L
S
N
GLU
V
163
R
-
CG2
THR
A
522
L
S
CB
GLU
V
163
R
-
CG2
THR
A
522
L
S
CG
GLU
V
163
R
-
CG2
THR
A
522
L
S
H
GLU
V
163
R
-
CG2
THR
A
522
L
S
HB2
GLU
V
163
R
-
CG2
THR
A
522
L
S
HG3
GLU
V
163
R
-
OG1
THR
A
522
L
H
HB3
SER
V
147
R
-
OG1
THR
A
522
L
H
NE
ARG
V
151
R
-
OG1
THR
A
522
L
H
NH2
ARG
V
151
R
-
OG1
THR
A
522
L
H
CZ
ARG
V
151
R
-
OG1
THR
A
522
L
H
HB3
ARG
V
151
R
-
OG1
THR
A
522
L
H
HE
ARG
V
151
R
-
OG1
THR
A
522
L
H
HH21
ARG
V
151
R
-
OG1
THR
A
522
L
H
HH22
ARG
V
151
R
-
OG1
THR
A
522
L
S
O
PHE
V
161
R
-
OG1
THR
A
522
L
S
CG
PHE
V
161
R
-
OG1
THR
A
522
L
S
CD1
PHE
V
161
R
-
OG1
THR
A
522
L
S
CE1
PHE
V
161
R
-
OG1
THR
A
522
L
S
CZ
PHE
V
161
R
-
OG1
THR
A
522
L
S
HB2
PHE
V
161
R
-
OG1
THR
A
522
L
S
HD1
PHE
V
161
R
-
OG1
THR
A
522
L
S
HE1
PHE
V
161
R
-
OG1
THR
A
522
L
S
H
GLU
V
163
R
-
OG1
THR
A
522
L
S
HG3
GLU
V
163
R
-
N
LEU
A
523
L
-
HD22
ASN
V
171
R
-
CA
LEU
A
523
L
-
ND2
ASN
V
171
R
-
CA
LEU
A
523
L
-
HD22
ASN
V
171
R
-
CB
LEU
A
523
L
-
HD22
ASN
V
171
R
-
CG
LEU
A
523
L
-
HD22
ASN
V
171
R
-
CD2
LEU
A
523
L
-
ND2
ASN
V
171
R
-
CD2
LEU
A
523
L
-
HD21
ASN
V
171
R
-
CD2
LEU
A
523
L
-
HD22
ASN
V
171
R
-
O
ASP
A
524
L
S
HE1
PHE
V
162
R
-
CD2
LEU
A
525
L
H
HE21
GLN
V
174
R
-
CG2
THR
A
526
L
S
NH2
ARG
V
66
R
-
CG2
THR
A
526
L
S
HH21
ARG
V
66
R
-
CG2
THR
A
526
L
S
HH22
ARG
V
66
R
-
CG2
THR
A
526
L
H
OD2
ASP
V
181
R
-
OG1
THR
A
526
L
H
HB3
ARG
V
178
R
-
OG1
THR
A
526
L
H
HD3
ARG
V
178
R
-
NZ
LYS
A
542
L
H
HG2
GLU
V
148
R
S
NH1
ARG
A
547
L
H
HH12
ARG
V
151
R
S
NH2
ARG
A
547
L
H
HH22
ARG
V
151
R
-
CB
HIS
A
555
L
H
NE2
GLN
V
174
R
-
CB
HIS
A
555
L
H
HE21
GLN
V
174
R
-
CB
HIS
A
555
L
H
HE22
GLN
V
174
R
-
CG
HIS
A
555
L
H
NE2
GLN
V
174
R
-
CG
HIS
A
555
L
H
HE21
GLN
V
174
R
-
CG
HIS
A
555
L
H
HE22
GLN
V
174
R
-
CD2
HIS
A
555
L
H
NE2
GLN
V
174
R
-
CD2
HIS
A
555
L
H
HE21
GLN
V
174
R
-
CD2
HIS
A
555
L
H
HE22
GLN
V
174
R
-
ND1
HIS
A
555
L
H
NE2
GLN
V
174
R
-
ND1
HIS
A
555
L
H
HE21
GLN
V
174
R
-
ND1
HIS
A
555
L
H
HE22
GLN
V
174
R
-
CE1
HIS
A
555
L
H
NE2
GLN
V
174
R
-
CE1
HIS
A
555
L
H
HE22
GLN
V
174
R
-
NE2
HIS
A
555
L
H
NE2
GLN
V
174
R
-
NE2
HIS
A
555
L
H
HE22
GLN
V
174
R
-
OXT
SER
A
675
L
-
HA
SER
V
3
R
-
OXT
SER
A
675
L
-
N
ALA
V
4
R
-
OXT
SER
A
675
L
-
O
ALA
V
4
R
-
OXT
SER
A
675
L
-
H
ALA
V
4
R
-
OXT
SER
A
675
L
-
HB2
ALA
V
4