A1IGU5_Q96P48.1
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
-
ASP
A
1040
L
H
TYR
V
302
R
-
ARG
A
1045
L
H
TYR
V
302
R
-
ALA
A
1046
L
H
TYR
V
302
R
-
GLN
A
1047
L
-
TYR
V
308
R
H
ARG
A
1073
L
-
TYR
V
308
R
-
PRO
A
116
L
H
ARG
V
232
R
-
PRO
A
116
L
-
ARG
V
664
R
-
ILE
A
117
L
H
ARG
V
232
R
-
ILE
A
117
L
-
ARG
V
664
R
-
PRO
A
118
L
H
ARG
V
232
R
-
PRO
A
118
L
H
LEU
V
235
R
-
PRO
A
119
L
H
LEU
V
231
R
-
ARG
A
120
L
H
LEU
V
231
R
-
ARG
A
121
L
H
LEU
V
231
R
-
ARG
A
121
L
H
SER
V
657
R
-
THR
A
127
L
H
LEU
V
281
R
-
CYS
A
128
L
H
LEU
V
281
R
-
CYS
A
128
L
H
GLU
V
285
R
-
PHE
A
129
L
H
LEU
V
281
R
-
PHE
A
129
L
H
CYS
V
282
R
-
PHE
A
129
L
H
GLU
V
285
R
-
THR
A
130
L
H
TRP
V
278
R
-
THR
A
130
L
H
CYS
V
282
R
-
THR
A
130
L
H
GLU
V
285
R
-
THR
A
131
L
H
TRP
V
278
R
-
THR
A
131
L
H
CYS
V
282
R
-
THR
A
131
L
H
MET
V
414
R
-
PRO
A
132
L
H
MET
V
414
R
-
PRO
A
132
L
H
LEU
V
417
R
-
PRO
A
132
L
H
GLY
V
418
R
-
PRO
A
132
L
H
MET
V
421
R
-
SER
A
133
L
H
MET
V
414
R
-
SER
A
133
L
H
GLY
V
418
R
-
THR
A
134
L
H
GLN
V
415
R
-
THR
A
134
L
H
GLY
V
418
R
-
ALA
A
135
L
H
GLN
V
415
R
-
VAL
A
1420
L
-
SER
V
675
R
-
SER
A
1421
L
-
LEU
V
673
R
-
SER
A
1421
L
-
PRO
V
674
R
-
SER
A
1421
L
-
SER
V
675
R
-
LEU
A
1422
L
-
SER
V
675
R
-
LEU
A
144
L
H
ASP
V
76
R
-
LYS
A
147
L
H
ARG
V
57
R
-
LYS
A
147
L
H
SER
V
58
R
-
LYS
A
147
L
-
GLN
V
61
R
-
ARG
A
148
L
H
SER
V
58
R
-
ARG
A
148
L
-
GLN
V
61
R
-
HIS
A
149
L
-
GLN
V
61
R
-
HIS
A
149
L
-
GLN
V
62
R
-
LEU
A
150
L
-
GLN
V
61
R
-
LEU
A
150
L
-
GLN
V
62
R
-
ALA
A
151
L
-
GLN
V
62
R
-
VAL
A
169
L
H
GLN
V
298
R
-
SER
A
170
L
H
LEU
V
294
R
-
SER
A
170
L
H
ASP
V
295
R
-
SER
A
170
L
H
GLN
V
298
R
-
LEU
A
171
L
H
ASP
V
295
R
-
PRO
A
172
L
H
ASP
V
295
R
-
PRO
A
172
L
H
ALA
V
299
R
-
THR
A
173
L
H
ASP
V
295
R
-
THR
A
173
L
H
ASN
V
296
R
-
THR
A
173
L
H
ALA
V
299
R
-
GLU
A
815
L
H
GLN
V
337
R
-
GLU
A
815
L
H
ARG
V
338
R
-
GLU
A
815
L
H
GLY
V
341
R
-
GLU
A
815
L
H
LEU
V
342
R
S
HIS
A
816
L
H
ARG
V
338
R
-
GLU
A
833
L
H
LEU
V
342
R
H
ALA
A
835
L
H
LYS
V
334
R
H
ALA
A
835
L
H
ARG
V
338
R
H
GLU
A
836
L
H
LYS
V
334
R
H
GLU
A
836
L
H
ARG
V
338
R
H
GLU
A
836
L
H
ASP
V
430
A1IGU5_Q96P48.1
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
PRO
A
116
L
-
HH12
ARG
V
664
R
-
CA
PRO
A
116
L
-
HH22
ARG
V
664
R
-
C
PRO
A
116
L
H
NH2
ARG
V
232
R
-
C
PRO
A
116
L
H
HH21
ARG
V
232
R
-
C
PRO
A
116
L
H
HH22
ARG
V
232
R
-
C
PRO
A
116
L
-
HH22
ARG
V
664
R
-
CB
PRO
A
116
L
-
NH1
ARG
V
664
R
-
CB
PRO
A
116
L
-
NH2
ARG
V
664
R
-
CB
PRO
A
116
L
-
CZ
ARG
V
664
R
-
CB
PRO
A
116
L
-
HH11
ARG
V
664
R
-
CB
PRO
A
116
L
-
HH12
ARG
V
664
R
-
CB
PRO
A
116
L
-
HH22
ARG
V
664
R
-
O
PRO
A
116
L
H
NH2
ARG
V
232
R
-
O
PRO
A
116
L
H
HE
ARG
V
232
R
-
O
PRO
A
116
L
H
HH21
ARG
V
232
R
-
O
PRO
A
116
L
H
HH22
ARG
V
232
R
-
O
PRO
A
116
L
-
HH22
ARG
V
664
R
-
CG
PRO
A
116
L
-
NH1
ARG
V
664
R
-
CG
PRO
A
116
L
-
NH2
ARG
V
664
R
-
CG
PRO
A
116
L
-
CZ
ARG
V
664
R
-
CG
PRO
A
116
L
-
HH11
ARG
V
664
R
-
CG
PRO
A
116
L
-
HH12
ARG
V
664
R
-
CG
PRO
A
116
L
-
HH22
ARG
V
664
R
-
CD
PRO
A
116
L
-
HH12
ARG
V
664
R
-
CD
PRO
A
116
L
-
HH22
ARG
V
664
R
-
N
ILE
A
117
L
H
NH2
ARG
V
232
R
-
N
ILE
A
117
L
H
CZ
ARG
V
232
R
-
N
ILE
A
117
L
H
HH21
ARG
V
232
R
-
N
ILE
A
117
L
H
HH22
ARG
V
232
R
-
N
ILE
A
117
L
-
HH22
ARG
V
664
R
-
CA
ILE
A
117
L
H
NE
ARG
V
232
R
-
CA
ILE
A
117
L
H
NH2
ARG
V
232
R
-
CA
ILE
A
117
L
H
CZ
ARG
V
232
R
-
CA
ILE
A
117
L
H
HE
ARG
V
232
R
-
CA
ILE
A
117
L
H
HH21
ARG
V
232
R
-
CA
ILE
A
117
L
H
HH22
ARG
V
232
R
-
C
ILE
A
117
L
H
NH2
ARG
V
232
R
-
C
ILE
A
117
L
H
HE
ARG
V
232
R
-
C
ILE
A
117
L
H
HH21
ARG
V
232
R
-
C
ILE
A
117
L
H
HH22
ARG
V
232
R
-
C
ILE
A
117
L
-
HH21
ARG
V
664
R
-
C
ILE
A
117
L
-
HH22
ARG
V
664
R
-
CB
ILE
A
117
L
H
NH2
ARG
V
232
R
-
CB
ILE
A
117
L
H
CZ
ARG
V
232
R
-
CB
ILE
A
117
L
H
HH21
ARG
V
232
R
-
CB
ILE
A
117
L
H
HH22
ARG
V
232
R
-
O
ILE
A
117
L
H
HH21
ARG
V
232
R
-
O
ILE
A
117
L
-
NH2
ARG
V
664
R
-
O
ILE
A
117
L
-
HH21
ARG
V
664
R
-
O
ILE
A
117
L
-
HH22
ARG
V
664
R
-
CG1
ILE
A
117
L
H
NH2
ARG
V
232
R
-
CG1
ILE
A
117
L
H
CZ
ARG
V
232
R
-
CG1
ILE
A
117
L
H
HH12
ARG
V
232
R
-
CG1
ILE
A
117
L
H
HH21
ARG
V
232
R
-
CG1
ILE
A
117
L
H
HH22
ARG
V
232
R
-
CG2
ILE
A
117
L
H
NH2
ARG
V
232
R
-
CG2
ILE
A
117
L
H
HH21
ARG
V
232
R
-
CG2
ILE
A
117
L
H
HH22
ARG
V
232
R
-
CD1
ILE
A
117
L
H
HH22
ARG
V
232
R
-
N
PRO
A
118
L
H
NE
ARG
V
232
R
-
N
PRO
A
118
L
H
NH2
ARG
V
232
R
-
N
PRO
A
118
L
H
HE
ARG
V
232
R
-
N
PRO
A
118
L
H
HH21
ARG
V
232
R
-
CA
PRO
A
118
L
H
HE
ARG
V
232
R
-
CB
PRO
A
118
L
H
HE
ARG
V
232
R
-
CB
PRO
A
118
L
H
HD11
LEU
V
235
R
-
CB
PRO
A
118
L
H
HD13
LEU
V
235
R
-
CG
PRO
A
118
L
H
CG
ARG
V
232
R
-
CG
PRO
A
118
L
H
NE
ARG
V
232
R
-
CG
PRO
A
118
L
H
HA
ARG
V
232
R
-
CG
PRO
A
118
L
H
HG2
ARG
V
232
R
-
CG
PRO
A
118
L
H
HG3
ARG
V
232
R
-
CG
PRO
A
118
L
H
HE
ARG
V
232
R
-
CG
PRO
A
118
L
H
HD11
LEU
V
235
R
-
CG
PRO
A
118
L
H
HD13
LEU
V
235
R
-
CD
PRO
A
118
L
H
CG
ARG
V
232
R
-
CD
PRO
A
118
L
H
CD
ARG
V
232
R
-
CD
PRO
A
118
L
H
NE
ARG
V
232
R
-
CD
PRO
A
118
L
H
NH2
ARG
V
232
R
-
CD
PRO
A
118
L
H
CZ
ARG
V
232
R
-
CD
PRO
A
118
L
H
HG2
ARG
V
232
R
-
CD
PRO
A
118
L
H
HG3
ARG
V
232
R
-
CD
PRO
A
118
L
H
HE
ARG
V
232
R
-
CD
PRO
A
118
L
H
HH21
ARG
V
232
R
-
O
PRO
A
119
L
H
HD13
LEU
V
231
R
-
CA
ARG
A
120
L
H
HD13
LEU
V
231
R
-
C
ARG
A
120
L
H
HD13
LEU
V
231
R
-
N
ARG
A
121
L
H
HD13
LEU
V
231
R
-
NH1
ARG
A
121
L
H
HB2
SER
V
657
R
-
C
THR
A
127
L
H
HD22
LEU
V
281
R
-
O
THR
A
127
L
H
CD2
LEU
V
281
R
-
O
THR
A
127
L
H
HD21
LEU
V
281
R
-
O
THR
A
127
L
H
HD22
LEU
V
281
R
-
O
THR
A
127
L
H
HD23
LEU
V
281
R
-
N
CYS
A
128
L
H
HD22
LEU
V
281
R
-
CA
CYS
A
128
L
H
HD22
LEU
V
281
R
-
CA
CYS
A
128
L
H
OE2
GLU
V
285
R
-
CA
CYS
A
128
L
H
HB2
GLU
V
285
R
-
C
CYS
A
128
L
H
CD2
LEU
V
281
R
-
C
CYS
A
128
L
H
HB2
LEU
V
281
R
-
C
CYS
A
128
L
H
HD12
LEU
V
281
R
-
C
CYS
A
128
L
H
HD22
LEU
V
281
R
-
C
CYS
A
128
L
H
HB2
GLU
V
285
R
-
CB
CYS
A
128
L
H
CG
GLU
V
285
R
-
CB
CYS
A
128
L
H
CD
GLU
V
285
R
-
CB
CYS
A
128
L
H
OE2
GLU
V
285
R
-
CB
CYS
A
128
L
H
HB2
GLU
V
285
R
-
CB
CYS
A
128
L
H
HG3
GLU
V
285
R
-
O
CYS
A
128
L
H
CD2
LEU
V
281
R
-
O
CYS
A
128
L
H
HB2
LEU
V
281
R
-
O
CYS
A
128
L
H
HD12
LEU
V
281
R
-
O
CYS
A
128
L
H
HD22
LEU
V
281
R
-
SG
CYS
A
128
L
H
CD
GLU
V
285
R
-
SG
CYS
A
128
L
H
OE1
GLU
V
285
R
-
SG
CYS
A
128
L
H
OE2
GLU
V
285
R
-
N
PHE
A
129
L
H
CB
LEU
V
281
R
-
N
PHE
A
129
L
H
O
LEU
V
281
R
-
N
PHE
A
129
L
H
CD2
LEU
V
281
R
-
N
PHE
A
129
L
H
HB2
LEU
V
281
R
-
N
PHE
A
129
L
H
HD12
LEU
V
281
R
-
N
PHE
A
129
L
H
HD22
LEU
V
281
R
-
N
PHE
A
129
L
H
CB
GLU
V
285
R
-
N
PHE
A
129
L
H
HB2
GLU
V
285
R
-
N
PHE
A
129
L
H
HG3
GLU
V
285
R
-
CA
PHE
A
129
L
H
HB2
LEU
V
281
R
-
CA
PHE
A
129
L
H
HB2
GLU
V
285
R
-
CA
PHE
A
129
L
H
HG3
GLU
V
285
R
-
C
PHE
A
129
L
H
C
LEU
V
281
R
-
C
PHE
A
129
L
H
O
LEU
V
281
R
-
C
PHE
A
129
L
H
HB2
LEU
V
281
R
-
C
PHE
A
129
L
H
N
CYS
V
282
R
-
C
PHE
A
129
L
H
CA
CYS
V
282
R
-
C
PHE
A
129
L
H
HA
CYS
V
282
R
-
C
PHE
A
129
L
H
CB
GLU
V
285
R
-
C
PHE
A
129
L
H
HB2
GLU
V
285
R
-
C
PHE
A
129
L
H
HB3
GLU
V
285
R
-
C
PHE
A
129
L
H
HG3
GLU
V
285
R
-
CB
PHE
A
129
L
H
HB2
LEU
V
281
R
-
CB
PHE
A
129
L
H
HD12
LEU
V
281
R
-
O
PHE
A
129
L
H
CA
LEU
V
281
R
-
O
PHE
A
129
L
H
C
LEU
V
281
R
-
O
PHE
A
129
L
H
CB
LEU
V
281
R
-
O
PHE
A
129
L
H
O
LEU
V
281
R
-
O
PHE
A
129
L
H
HB2
LEU
V
281
R
-
O
PHE
A
129
L
H
HB3
LEU
V
281
R
-
O
PHE
A
129
L
H
N
CYS
V
282
R
-
O
PHE
A
129
L
H
CA
CYS
V
282
R
-
O
PHE
A
129
L
H
CB
CYS
V
282
R
-
O
PHE
A
129
L
H
SG
CYS
V
282
R
-
O
PHE
A
129
L
H
H
CYS
V
282
R
-
O
PHE
A
129
L
H
HA
CYS
V
282
R
-
O
PHE
A
129
L
H
HG
CYS
V
282
R
-
O
PHE
A
129
L
H
HB2
GLU
V
285
R
-
O
PHE
A
129
L
H
HB3
GLU
V
285
R
-
N
THR
A
130
L
H
HA
CYS
V
282
R
-
N
THR
A
130
L
H
CB
GLU
V
285
R
-
N
THR
A
130
L
H
CG
GLU
V
285
R
-
N
THR
A
130
L
H
HB2
GLU
V
285
R
-
N
THR
A
130
L
H
HB3
GLU
V
285
R
-
N
THR
A
130
L
H
HG2
GLU
V
285
R
-
N
THR
A
130
L
H
HG3
GLU
V
285
R
-
CA
THR
A
130
L
H
SG
CYS
V
282
R
-
CA
THR
A
130
L
H
HA
CYS
V
282
R
-
CA
THR
A
130
L
H
HB3
GLU
V
285
R
-
CA
THR
A
130
L
H
HG3
GLU
V
285
R
-
C
THR
A
130
L
H
CB
CYS
V
282
R
-
C
THR
A
130
L
H
SG
CYS
V
282
R
-
C
THR
A
130
L
H
HA
CYS
V
282
R
-
C
THR
A
130
L
H
HB3
CYS
V
282
R
-
C
THR
A
130
L
H
HG
CYS
V
282
R
-
CB
THR
A
130
L
H
HG3
GLU
V
285
R
-
O
THR
A
130
L
H
CE2
TRP
V
278
R
-
O
THR
A
130
L
H
NE1
TRP
V
278
R
-
O
THR
A
130
L
H
CZ2
TRP
V
278
R
-
O
THR
A
130
L
H
HZ2
TRP
V
278
R
-
O
THR
A
130
L
H
HE1
TRP
V
278
R
-
O
THR
A
130
L
H
SG
CYS
V
282
R
-
O
THR
A
130
L
H
HA
CYS
V
282
R
-
O
THR
A
130
L
H
HG
CYS
V
282
R
-
CG2
THR
A
130
L
H
CG
GLU
V
285
R
-
CG2
THR
A
130
L
H
HG2
GLU
V
285
R
-
CG2
THR
A
130
L
H
HG3
GLU
V
285
R
-
N
THR
A
131
L
H
CZ2
TRP
V
278
R
-
N
THR
A
131
L
H
HZ2
TRP
V
278
R
-
N
THR
A
131
L
H
CB
CYS
V
282
R
-
N
THR
A
131
L
H
SG
CYS
V
282
R
-
N
THR
A
131
L
H
HA
CYS
V
282
R
-
N
THR
A
131
L
H
HB3
CYS
V
282
R
-
N
THR
A
131
L
H
HG
CYS
V
282
R
-
CA
THR
A
131
L
H
SG
CYS
V
282
R
-
CA
THR
A
131
L
H
HB3
CYS
V
282
R
-
C
THR
A
131
L
H
HH2
TRP
V
278
R
-
C
THR
A
131
L
H
HB3
CYS
V
282
R
-
C
THR
A
131
L
H
HE1
MET
V
414
R
-
O
THR
A
131
L
H
CH2
TRP
V
278
R
-
O
THR
A
131
L
H
CZ2
TRP
V
278
R
-
O
THR
A
131
L
H
CZ3
TRP
V
278
R
-
O
THR
A
131
L
H
HH2
TRP
V
278
R
-
O
THR
A
131
L
H
HZ2
TRP
V
278
R
-
O
THR
A
131
L
H
HZ3
TRP
V
278
R
-
O
THR
A
131
L
H
SG
CYS
V
282
R
-
O
THR
A
131
L
H
HB3
CYS
V
282
R
-
O
THR
A
131
L
H
CE
MET
V
414
R
-
O
THR
A
131
L
H
HE1
MET
V
414
R
-
O
THR
A
131
L
H
HE3
MET
V
414
R
-
N
PRO
A
132
L
H
HE1
MET
V
414
R
-
CA
PRO
A
132
L
H
CE
MET
V
414
R
-
CA
PRO
A
132
L
H
HE1
MET
V
414
R
-
CA
PRO
A
132
L
H
HE2
MET
V
414
R
-
C
PRO
A
132
L
H
CE
MET
V
414
R
-
C
PRO
A
132
L
H
HE1
MET
V
414
R
-
C
PRO
A
132
L
H
HE2
MET
V
414
R
-
C
PRO
A
132
L
H
HE3
MET
V
414
R
-
CB
PRO
A
132
L
H
HB3
LEU
V
417
R
-
CB
PRO
A
132
L
H
HA2
GLY
V
418
R
-
CB
PRO
A
132
L
H
SD
MET
V
421
R
-
O
PRO
A
132
L
H
HE1
MET
V
414
R
-
CG
PRO
A
132
L
H
SD
MET
V
421
R
-
CG
PRO
A
132
L
H
CE
MET
V
421
R
-
CG
PRO
A
132
L
H
HE1
MET
V
421
R
-
CG
PRO
A
132
L
H
HE3
MET
V
421
R
-
CD
PRO
A
132
L
H
SD
MET
V
421
R
-
CD
PRO
A
132
L
H
CE
MET
V
421
R
-
CD
PRO
A
132
L
H
HE1
MET
V
421
R
-
N
SER
A
133
L
H
CE
MET
V
414
R
-
N
SER
A
133
L
H
HE1
MET
V
414
R
-
N
SER
A
133
L
H
HE2
MET
V
414
R
-
N
SER
A
133
L
H
HE3
MET
V
414
R
-
CA
SER
A
133
L
H
HE2
MET
V
414
R
-
CA
SER
A
133
L
H
HA3
GLY
V
418
R
-
O
SER
A
133
L
H
HB3
MET
V
414
R
-
O
SER
A
133
L
H
HE2
MET
V
414
R
-
N
THR
A
134
L
H
HA
GLN
V
415
R
-
N
THR
A
134
L
H
HA3
GLY
V
418
R
-
C
THR
A
134
L
H
HG2
GLN
V
415
R
-
N
ALA
A
135
L
H
CG
GLN
V
415
R
-
N
ALA
A
135
L
H
HA
GLN
V
415
R
-
N
ALA
A
135
L
H
HG2
GLN
V
415
R
-
N
ALA
A
135
L
H
HG3
GLN
V
415
R
-
N
ALA
A
135
L
H
HE21
GLN
V
415
R
-
CA
ALA
A
135
L
H
HG2
GLN
V
415
R
-
C
ALA
A
135
L
H
CD
GLN
V
415
R
-
C
ALA
A
135
L
H
NE2
GLN
V
415
R
-
C
ALA
A
135
L
H
HG2
GLN
V
415
R
-
C
ALA
A
135
L
H
HE21
GLN
V
415
R
-
O
ALA
A
135
L
H
CG
GLN
V
415
R
-
O
ALA
A
135
L
H
CD
GLN
V
415
R
-
O
ALA
A
135
L
H
NE2
GLN
V
415
R
-
O
ALA
A
135
L
H
OE1
GLN
V
415
R
-
O
ALA
A
135
L
H
HG2
GLN
V
415
R
-
O
ALA
A
135
L
H
HG3
GLN
V
415
R
-
O
ALA
A
135
L
H
HE21
GLN
V
415
R
-
O
ALA
A
135
L
H
HE22
GLN
V
415
R
-
O
LEU
A
144
L
H
OD2
ASP
V
76
R
-
CA
LYS
A
147
L
-
HG3
GLN
V
61
R
-
C
LYS
A
147
L
H
HA
SER
V
58
R
-
C
LYS
A
147
L
-
CG
GLN
V
61
R
-
C
LYS
A
147
L
-
CD
GLN
V
61
R
-
C
LYS
A
147
L
-
NE2
GLN
V
61
R
-
C
LYS
A
147
L
-
OE1
GLN
V
61
R
-
C
LYS
A
147
L
-
HG2
GLN
V
61
R
-
C
LYS
A
147
L
-
HG3
GLN
V
61
R
-
C
LYS
A
147
L
-
HE21
GLN
V
61
R
-
C
LYS
A
147
L
-
HE22
GLN
V
61
R
-
CB
LYS
A
147
L
H
CB
SER
V
58
R
-
CB
LYS
A
147
L
H
HA
SER
V
58
R
-
CB
LYS
A
147
L
H
HB2
SER
V
58
R
-
CB
LYS
A
147
L
H
HB3
SER
V
58
R
-
O
LYS
A
147
L
H
O
ARG
V
57
R
-
O
LYS
A
147
L
H
CA
SER
V
58
R
-
O
LYS
A
147
L
H
HA
SER
V
58
R
-
O
LYS
A
147
L
-
CB
GLN
V
61
R
-
O
LYS
A
147
L
-
CG
GLN
V
61
R
-
O
LYS
A
147
L
-
CD
GLN
V
61
R
-
O
LYS
A
147
L
-
NE2
GLN
V
61
R
-
O
LYS
A
147
L
-
OE1
GLN
V
61
R
-
O
LYS
A
147
L
-
HG2
GLN
V
61
R
-
O
LYS
A
147
L
-
HG3
GLN
V
61
R
-
O
LYS
A
147
L
-
HE21
GLN
V
61
R
-
O
LYS
A
147
L
-
HE22
GLN
V
61
R
-
CG
LYS
A
147
L
H
HB3
SER
V
58
R
-
CD
LYS
A
147
L
H
HB2
SER
V
58
R
-
CD
LYS
A
147
L
H
HB3
SER
V
58
R
-
N
ARG
A
148
L
-
CB
GLN
V
61
R
-
N
ARG
A
148
L
-
CG
GLN
V
61
R
-
N
ARG
A
148
L
-
CD
GLN
V
61
R
-
N
ARG
A
148
L
-
NE2
GLN
V
61
R
-
N
ARG
A
148
L
-
OE1
GLN
V
61
R
-
N
ARG
A
148
L
-
HB3
GLN
V
61
R
-
N
ARG
A
148
L
-
HG2
GLN
V
61
R
-
N
ARG
A
148
L
-
HG3
GLN
V
61
R
-
N
ARG
A
148
L
-
HE22
GLN
V
61
R
-
CA
ARG
A
148
L
-
CB
GLN
V
61
R
-
CA
ARG
A
148
L
-
CG
GLN
V
61
R
-
CA
ARG
A
148
L
-
CD
GLN
V
61
R
-
CA
ARG
A
148
L
-
OE1
GLN
V
61
R
-
CA
ARG
A
148
L
-
HB2
GLN
V
61
R
-
CA
ARG
A
148
L
-
HB3
GLN
V
61
R
-
CA
ARG
A
148
L
-
HG3
GLN
V
61
R
-
C
ARG
A
148
L
H
O
SER
V
58
R
-
C
ARG
A
148
L
-
CB
GLN
V
61
R
-
C
ARG
A
148
L
-
CG
GLN
V
61
R
-
C
ARG
A
148
L
-
CD
GLN
V
61
R
-
C
ARG
A
148
L
-
OE1
GLN
V
61
R
-
C
ARG
A
148
L
-
HB2
GLN
V
61
R
-
C
ARG
A
148
L
-
HB3
GLN
V
61
R
-
C
ARG
A
148
L
-
HG2
GLN
V
61
R
-
C
ARG
A
148
L
-
HG3
GLN
V
61
R
-
CB
ARG
A
148
L
-
HG3
GLN
V
61
R
-
O
ARG
A
148
L
H
C
SER
V
58
R
-
O
ARG
A
148
L
H
O
SER
V
58
R
-
O
ARG
A
148
L
H
HA
SER
V
58
R
-
O
ARG
A
148
L
H
HB2
SER
V
58
R
-
O
ARG
A
148
L
-
CB
GLN
V
61
R
-
O
ARG
A
148
L
-
CG
GLN
V
61
R
-
O
ARG
A
148
L
-
CD
GLN
V
61
R
-
O
ARG
A
148
L
-
HB2
GLN
V
61
R
-
O
ARG
A
148
L
-
HB3
GLN
V
61
R
-
O
ARG
A
148
L
-
HG2
GLN
V
61
R
-
O
ARG
A
148
L
-
HG3
GLN
V
61
R
-
N
HIS
A
149
L
-
CB
GLN
V
61
R
-
N
HIS
A
149
L
-
CG
GLN
V
61
R
-
N
HIS
A
149
L
-
HB2
GLN
V
61
R
-
N
HIS
A
149
L
-
HB3
GLN
V
61
R
-
N
HIS
A
149
L
-
HG3
GLN
V
61
R
-
CA
HIS
A
149
L
-
CB
GLN
V
61
R
-
CA
HIS
A
149
L
-
HB2
GLN
V
61
R
-
CA
HIS
A
149
L
-
HB3
GLN
V
61
R
-
C
HIS
A
149
L
-
CB
GLN
V
61
R
-
C
HIS
A
149
L
-
HB2
GLN
V
61
R
-
C
HIS
A
149
L
-
HB3
GLN
V
61
R
-
O
HIS
A
149
L
-
CA
GLN
V
61
R
-
O
HIS
A
149
L
-
C
GLN
V
61
R
-
O
HIS
A
149
L
-
CB
GLN
V
61
R
-
O
HIS
A
149
L
-
H
GLN
V
61
R
-
O
HIS
A
149
L
-
HB2
GLN
V
61
R
-
O
HIS
A
149
L
-
HB3
GLN
V
61
R
-
O
HIS
A
149
L
-
N
GLN
V
62
R
-
O
HIS
A
149
L
-
OE1
GLN
V
62
R
-
O
HIS
A
149
L
-
H
GLN
V
62
R
-
O
HIS
A
149
L
-
HB3
GLN
V
62
R
-
N
LEU
A
150
L
-
HB2
GLN
V
61
R
-
N
LEU
A
150
L
-
HB3
GLN
V
62
R
-
CA
LEU
A
150
L
-
HB3
GLN
V
62
R
-
C
LEU
A
150
L
-
CB
GLN
V
62
R
-
C
LEU
A
150
L
-
HA
GLN
V
62
R
-
C
LEU
A
150
L
-
HB2
GLN
V
62
R
-
C
LEU
A
150
L
-
HB3
GLN
V
62
R
-
O
LEU
A
150
L
-
N
GLN
V
62
R
-
O
LEU
A
150
L
-
CA
GLN
V
62
R
-
O
LEU
A
150
L
-
CB
GLN
V
62
R
-
O
LEU
A
150
L
-
CG
GLN
V
62
R
-
O
LEU
A
150
L
-
CD
GLN
V
62
R
-
O
LEU
A
150
L
-
OE1
GLN
V
62
R
-
O
LEU
A
150
L
-
H
GLN
V
62
R
-
O
LEU
A
150
L
-
HA
GLN
V
62
R
-
O
LEU
A
150
L
-
HB2
GLN
V
62
R
-
O
LEU
A
150
L
-
HB3
GLN
V
62
R
-
O
LEU
A
150
L
-
HG2
GLN
V
62
R
-
N
ALA
A
151
L
-
HB3
GLN
V
62
R
-
C
ALA
A
151
L
-
HB2
GLN
V
62
R
-
CG1
VAL
A
169
L
H
HG2
GLN
V
298
R
-
CA
SER
A
170
L
H
CG
ASP
V
295
R
-
CA
SER
A
170
L
H
OD1
ASP
V
295
R
-
C
SER
A
170
L
H
CG
ASP
V
295
R
-
C
SER
A
170
L
H
OD1
ASP
V
295
R
-
C
SER
A
170
L
H
HA
ASP
V
295
R
-
CB
SER
A
170
L
H
HB3
LEU
V
294
R
-
CB
SER
A
170
L
H
CG
ASP
V
295
R
-
CB
SER
A
170
L
H
OD1
ASP
V
295
R
-
CB
SER
A
170
L
H
HA
ASP
V
295
R
-
O
SER
A
170
L
H
OD1
ASP
V
295
R
-
O
SER
A
170
L
H
HA
ASP
V
295
R
-
O
SER
A
170
L
H
CG
GLN
V
298
R
-
O
SER
A
170
L
H
HB3
GLN
V
298
R
-
O
SER
A
170
L
H
HG2
GLN
V
298
R
-
OG
SER
A
170
L
H
HB3
LEU
V
294
R
-
OG
SER
A
170
L
H
HD13
LEU
V
294
R
-
OG
SER
A
170
L
H
OD1
ASP
V
295
R
-
N
LEU
A
171
L
H
CB
ASP
V
295
R
-
N
LEU
A
171
L
H
CG
ASP
V
295
R
-
N
LEU
A
171
L
H
OD1
ASP
V
295
R
-
N
LEU
A
171
L
H
OD2
ASP
V
295
R
-
N
LEU
A
171
L
H
HA
ASP
V
295
R
-
N
LEU
A
171
L
H
HB3
ASP
V
295
R
-
CA
LEU
A
171
L
H
CB
ASP
V
295
R
-
CA
LEU
A
171
L
H
CG
ASP
V
295
R
-
CA
LEU
A
171
L
H
OD1
ASP
V
295
R
-
CA
LEU
A
171
L
H
OD2
ASP
V
295
R
-
CA
LEU
A
171
L
H
HB3
ASP
V
295
R
-
C
LEU
A
171
L
H
CA
ASP
V
295
R
-
C
LEU
A
171
L
H
CB
ASP
V
295
R
-
C
LEU
A
171
L
H
CG
ASP
V
295
R
-
C
LEU
A
171
L
H
OD1
ASP
V
295
R
-
C
LEU
A
171
L
H
OD2
ASP
V
295
R
-
C
LEU
A
171
L
H
HA
ASP
V
295
R
-
C
LEU
A
171
L
H
HB3
ASP
V
295
R
-
CB
LEU
A
171
L
H
CG
ASP
V
295
R
-
CB
LEU
A
171
L
H
OD1
ASP
V
295
R
-
CB
LEU
A
171
L
H
OD2
ASP
V
295
R
-
CB
LEU
A
171
L
H
HB3
ASP
V
295
R
-
O
LEU
A
171
L
H
N
ASP
V
295
R
-
O
LEU
A
171
L
H
CA
ASP
V
295
R
-
O
LEU
A
171
L
H
C
ASP
V
295
R
-
O
LEU
A
171
L
H
CB
ASP
V
295
R
-
O
LEU
A
171
L
H
O
ASP
V
295
R
-
O
LEU
A
171
L
H
CG
ASP
V
295
R
-
O
LEU
A
171
L
H
OD1
ASP
V
295
R
-
O
LEU
A
171
L
H
OD2
ASP
V
295
R
-
O
LEU
A
171
L
H
HA
ASP
V
295
R
-
O
LEU
A
171
L
H
HB2
ASP
V
295
R
-
O
LEU
A
171
L
H
HB3
ASP
V
295
R
-
N
PRO
A
172
L
H
O
ASP
V
295
R
-
N
PRO
A
172
L
H
HA
ASP
V
295
R
-
N
PRO
A
172
L
H
HB3
ASP
V
295
R
-
N
PRO
A
172
L
H
HB3
ALA
V
299
R
-
CA
PRO
A
172
L
H
C
ASP
V
295
R
-
CA
PRO
A
172
L
H
O
ASP
V
295
R
-
CA
PRO
A
172
L
H
HB3
ASP
V
295
R
-
CA
PRO
A
172
L
H
CB
ALA
V
299
R
-
CA
PRO
A
172
L
H
HB3
ALA
V
299
R
-
C
PRO
A
172
L
H
HB3
ASP
V
295
R
-
C
PRO
A
172
L
H
HB3
ALA
V
299
R
-
CB
PRO
A
172
L
H
O
ASP
V
295
R
-
CB
PRO
A
172
L
H
N
ALA
V
299
R
-
CB
PRO
A
172
L
H
CA
ALA
V
299
R
-
CB
PRO
A
172
L
H
CB
ALA
V
299
R
-
CB
PRO
A
172
L
H
H
ALA
V
299
R
-
CB
PRO
A
172
L
H
HA
ALA
V
299
R
-
CB
PRO
A
172
L
H
HB1
ALA
V
299
R
-
CB
PRO
A
172
L
H
HB2
ALA
V
299
R
-
CB
PRO
A
172
L
H
HB3
ALA
V
299
R
-
CG
PRO
A
172
L
H
HB3
ALA
V
299
R
-
N
THR
A
173
L
H
HB3
ASP
V
295
R
-
N
THR
A
173
L
H
HB3
ALA
V
299
R
-
O
THR
A
173
L
H
OD1
ASN
V
296
R
-
OG1
THR
A
173
L
H
CG
ASN
V
296
R
-
OG1
THR
A
173
L
H
OD1
ASN
V
296
R
-
OG1
THR
A
173
L
H
HD22
ASN
V
296
R
-
CG
GLU
A
815
L
H
HA3
GLY
V
341
R
-
CD
GLU
A
815
L
H
O
GLN
V
337
R
-
CD
GLU
A
815
L
H
N
GLY
V
341
R
-
CD
GLU
A
815
L
H
CA
GLY
V
341
R
-
CD
GLU
A
815
L
H
C
GLY
V
341
R
-
CD
GLU
A
815
L
H
H
GLY
V
341
R
-
CD
GLU
A
815
L
H
HA2
GLY
V
341
R
-
CD
GLU
A
815
L
H
HA3
GLY
V
341
R
-
OE1
GLU
A
815
L
H
C
GLN
V
337
R
-
OE1
GLU
A
815
L
H
O
GLN
V
337
R
-
OE1
GLU
A
815
L
H
HA
ARG
V
338
R
-
OE1
GLU
A
815
L
H
N
GLY
V
341
R
-
OE1
GLU
A
815
L
H
CA
GLY
V
341
R
-
OE1
GLU
A
815
L
H
H
GLY
V
341
R
-
OE1
GLU
A
815
L
H
HA2
GLY
V
341
R
-
OE1
GLU
A
815
L
H
HA3
GLY
V
341
R
-
OE2
GLU
A
815
L
H
N
GLY
V
341
R
-
OE2
GLU
A
815
L
H
CA
GLY
V
341
R
-
OE2
GLU
A
815
L
H
C
GLY
V
341
R
-
OE2
GLU
A
815
L
H
O
GLY
V
341
R
-
OE2
GLU
A
815
L
H
H
GLY
V
341
R
-
OE2
GLU
A
815
L
H
HA2
GLY
V
341
R
-
OE2
GLU
A
815
L
H
HA3
GLY
V
341
R
-
OE2
GLU
A
815
L
H
N
LEU
V
342
R
-
OE2
GLU
A
815
L
H
HG
LEU
V
342
R
-
OE2
GLU
A
815
L
H
HD21
LEU
V
342
R
S
NE2
HIS
A
816
L
H
HG2
ARG
V
338
R
-
C
GLU
A
833
L
H
HD22
LEU
V
342
R
-
O
GLU
A
833
L
H
CD2
LEU
V
342
R
-
O
GLU
A
833
L
H
HD12
LEU
V
342
R
-
O
GLU
A
833
L
H
HD21
LEU
V
342
R
-
O
GLU
A
833
L
H
HD22
LEU
V
342
R
-
O
GLU
A
833
L
H
HD23
LEU
V
342
R
H
C
ALA
A
835
L
H
HE3
LYS
V
334
R
H
C
ALA
A
835
L
H
HZ1
LYS
V
334
R
H
CB
ALA
A
835
L
H
HE2
LYS
V
334
R
H
CB
ALA
A
835
L
H
HE3
LYS
V
334
R
H
CB
ALA
A
835
L
H
CG
ARG
V
338
R
H
CB
ALA
A
835
L
H
HG2
ARG
V
338
R
H
CB
ALA
A
835
L
H
HG3
ARG
V
338
R
H
CB
ALA
A
835
L
H
HD2
ARG
V
338
R
H
O
ALA
A
835
L
H
HZ1
LYS
V
334
R
H
N
GLU
A
836
L
H
HZ1
LYS
V
334
R
H
CA
GLU
A
836
L
H
HZ1
LYS
V
334
R
H
CB
GLU
A
836
L
H
HZ1
LYS
V
334
R
H
CG
GLU
A
836
L
H
NZ
LYS
V
334
R
H
CG
GLU
A
836
L
H
HE2
LYS
V
334
R
H
CG
GLU
A
836
L
H
HZ1
LYS
V
334
R
H
CG
GLU
A
836
L
H
HZ3
LYS
V
334
R
H
CG
GLU
A
836
L
H
NH1
ARG
V
338
R
H
CD
GLU
A
836
L
H
NH1
ARG
V
338
R
H
CD
GLU
A
836
L
H
NH2
ARG
V
338
R
H
CD
GLU
A
836
L
H
CZ
ARG
V
338
R
H
CD
GLU
A
836
L
H
HH11
ARG
V
338
R
H
CD
GLU
A
836
L
H
HH12
ARG
V
338
R
H
CD
GLU
A
836
L
H
HH22
ARG
V
338
R
H
CD
GLU
A
836
L
H
OD2
ASP
V
430
R
H
OE1
GLU
A
836
L
H
NH1
ARG
V
338
R
H
OE1
GLU
A
836
L
H
NH2
ARG
V
338
R
H
OE1
GLU
A
836
L
H
CZ
ARG
V
338
R
H
OE1
GLU
A
836
L
H
HH11
ARG
V
338
R
H
OE1
GLU
A
836
L
H
HH12
ARG
V
338
R
H
OE1
GLU
A
836
L
H
HH22
ARG
V
338
R
H
OE1
GLU
A
836
L
H
CG
ASP
V
430
R
H
OE1
GLU
A
836
L
H
OD2
ASP
V
430
R
H
OE1
GLU
A
836
L
H
HB3
ASP
V
430
R
H
OE2
GLU
A
836
L
H
HH12
ARG
V
338
R
H
OE2
GLU
A
836
L
H
HH22
ARG
V
338
R
-
CG
ASP
A
1040
L
H
OH
TYR
V
302
R
-
CG
ASP
A
1040
L
H
HH
TYR
V
302
R
-
OD1
ASP
A
1040
L
H
OH
TYR
V
302
R
-
OD1
ASP
A
1040
L
H
CZ
TYR
V
302
R
-
OD1
ASP
A
1040
L
H
HE2
TYR
V
302
R
-
OD1
ASP
A
1040
L
H
HH
TYR
V
302
R
-
OD2
ASP
A
1040
L
H
OH
TYR
V
302
R
-
OD2
ASP
A
1040
L
H
HH
TYR
V
302
R
-
N
ARG
A
1045
L
H
HH
TYR
V
302
R
-
CB
ARG
A
1045
L
H
OH
TYR
V
302
R
-
CB
ARG
A
1045
L
H
HH
TYR
V
302
R
-
N
ALA
A
1046
L
H
OH
TYR
V
302
R
-
N
ALA
A
1046
L
H
HE1
TYR
V
302
R
-
N
ALA
A
1046
L
H
HH
TYR
V
302
R
-
CA
ALA
A
1046
L
H
HE1
TYR
V
302
R
-
CA
ALA
A
1046
L
H
HH
TYR
V
302
R
-
CB
ALA
A
1046
L
H
HE1
TYR
V
302
R
-
CB
ALA
A
1046
L
H
HH
TYR
V
302
R
-
CG
GLN
A
1047
L
-
HE1
TYR
V
308
R
-
CG
GLN
A
1047
L
-
HH
TYR
V
308
R
-
CD
GLN
A
1047
L
-
HE1
TYR
V
308
R
-
CD
GLN
A
1047
L
-
HH
TYR
V
308
R
-
NE2
GLN
A
1047
L
-
HE1
TYR
V
308
R
-
NE2
GLN
A
1047
L
-
HH
TYR
V
308
R
H
CB
ARG
A
1073
L
-
HD1
TYR
V
308
R
H
CB
ARG
A
1073
L
-
HE1
TYR
V
308
R
H
CG
ARG
A
1073
L
-
HD1
TYR
V
308
R
H
CD
ARG
A
1073
L
-
HD1
TYR
V
308
R
-
C
VAL
A
1420
L
-
OXT
SER
V
675
R
-
O
VAL
A
1420
L
-
OXT
SER
V
675
R
-
N
SER
A
1421
L
-
O
PRO
V
674
R
-
N
SER
A
1421
L
-
OXT
SER
V
675
R
-
CA
SER
A
1421
L
-
C
PRO
V
674
R
-
CA
SER
A
1421
L
-
O
PRO
V
674
R
-
CA
SER
A
1421
L
-
HB3
PRO
V
674
R
-
CA
SER
A
1421
L
-
CA
SER
V
675
R
-
CA
SER
A
1421
L
-
C
SER
V
675
R
-
CA
SER
A
1421
L
-
O
SER
V
675
R
-
CA
SER
A
1421
L
-
OXT
SER
V
675
R
-
CA
SER
A
1421
L
-
HA
SER
V
675
R
-
C
SER
A
1421
L
-
C
SER
V
675
R
-
C
SER
A
1421
L
-
O
SER
V
675
R
-
C
SER
A
1421
L
-
OXT
SER
V
675
R
-
CB
SER
A
1421
L
-
CA
PRO
V
674
R
-
CB
SER
A
1421
L
-
C
PRO
V
674
R
-
CB
SER
A
1421
L
-
CB
PRO
V
674
R
-
CB
SER
A
1421
L
-
O
PRO
V
674
R
-
CB
SER
A
1421
L
-
CG
PRO
V
674
R
-
CB
SER
A
1421
L
-
HB3
PRO
V
674
R
-
CB
SER
A
1421
L
-
HG2
PRO
V
674
R
-
CB
SER
A
1421
L
-
HD3
PRO
V
674
R
-
CB
SER
A
1421
L
-
N
SER
V
675
R
-
CB
SER
A
1421
L
-
C
SER
V
675
R
-
CB
SER
A
1421
L
-
O
SER
V
675
R
-
OG
SER
A
1421
L
-
HB3
LEU
V
673
R
-
OG
SER
A
1421
L
-
HD21
LEU
V
673
R
-
OG
SER
A
1421
L
-
N
PRO
V
674
R
-
OG
SER
A
1421
L
-
CA
PRO
V
674
R
-
OG
SER
A
1421
L
-
C
PRO
V
674
R
-
OG
SER
A
1421
L
-
CB
PRO
V
674
R
-
OG
SER
A
1421
L
-
O
PRO
V
674
R
-
OG
SER
A
1421
L
-
CG
PRO
V
674
R
-
OG
SER
A
1421
L
-
CD
PRO
V
674
R
-
OG
SER
A
1421
L
-
HB3
PRO
V
674
R
-
OG
SER
A
1421
L
-
HG2
PRO
V
674
R
-
OG
SER
A
1421
L
-
HD3
PRO
V
674
R
-
OG
SER
A
1421
L
-
N
SER
V
675
R
-
N
LEU
A
1422
L
-
C
SER
V
675
R
-
N
LEU
A
1422
L
-
O
SER
V
675
R
-
N
LEU
A
1422
L
-
OXT
SER
V
675
R
-
CA
LEU
A
1422
L
-
O
SER
V
675
R
-
CA
LEU
A
1422
L
-
OXT
SER
V
675
R
-
C
LEU
A
1422
L
-
O
SER
V
675
R
-
CB
LEU
A
1422
L
-
OXT
SER
V
675
R
-
O
LEU
A
1422
L
-
C
SER
V
675
R
-
O
LEU
A
1422
L
-
O
SER
V
675
R
-
O
LEU
A
1422
L
-
OXT
SER
V
675