A1IGU5_Q8N7F7.1
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
GLU
A
274
L
-
ARG
V
150
R
H
TRP
A
278
L
-
GLU
V
149
R
H
TRP
A
278
L
-
ARG
V
150
R
H
TRP
A
278
L
-
LEU
V
152
R
H
LEU
A
281
L
-
GLU
V
149
R
H
ALA
A
299
L
H
GLU
V
39
R
H
PHE
A
300
L
H
ARG
V
28
R
-
PHE
A
303
L
-
ASP
V
52
R
H
PRO
A
305
L
-
ASP
V
52
R
H
PRO
A
305
L
-
ASP
V
53
R
-
TYR
A
308
L
-
ASP
V
53
R
-
LEU
A
310
L
-
ASP
V
53
R
-
LEU
A
310
L
-
LYS
V
54
R
H
ALA
A
317
L
-
HIS
V
55
R
H
TYR
A
320
L
-
SER
V
22
R
H
TYR
A
320
L
H
ALA
V
24
R
H
TYR
A
320
L
H
THR
V
25
R
H
TYR
A
320
L
-
HIS
V
55
R
-
HIS
A
448
L
-
GLN
V
20
R
H
GLU
A
453
L
S
LYS
V
16
R
H
PHE
A
456
L
-
SER
V
18
R
H
PHE
A
456
L
-
GLN
V
20
R
H
ARG
A
457
L
-
MET
V
1
R
H
ARG
A
457
L
S
LYS
V
16
R
H
ARG
A
457
L
S
PHE
V
2
R
H
VAL
A
460
L
-
GLY
V
19
R
H
VAL
A
460
L
-
GLN
V
20
R
H
GLU
A
461
L
-
MET
V
1
R
H
GLU
A
461
L
-
PRO
V
63
R
H
LEU
A
464
L
-
MET
V
1
R
H
LEU
A
464
L
-
GLY
V
19
R
H
LEU
A
464
L
-
LEU
V
56
R
H
LEU
A
464
L
-
SER
V
57
R
H
LEU
A
464
L
-
CYS
V
60
R
H
LEU
A
464
L
-
ILE
V
61
R
H
LEU
A
464
L
-
GLY
V
62
R
H
THR
A
467
L
-
SER
V
57
R
H
THR
A
467
L
-
CYS
V
60
R
H
SER
A
468
L
-
ARG
V
46
R
H
SER
A
468
L
-
CYS
V
60
R
H
LEU
A
471
L
-
ARG
V
46
R
H
LEU
A
471
L
-
GLN
V
48
R
H
LEU
A
471
L
-
CYS
V
60
R
H
ARG
A
472
L
-
ARG
V
46
R
H
ALA
A
500
L
-
LYS
V
124
R
-
SER
A
518
L
-
ARG
V
46
R
-
GLY
A
519
L
S
ASN
V
68
R
-
THR
A
520
L
-
ARG
V
46
R
-
THR
A
520
L
S
LYS
V
6
R
-
THR
A
520
L
S
SER
V
66
R
-
GLY
A
521
L
S
LYS
V
6
R
-
THR
A
522
L
S
LYS
V
6
R
-
LEU
A
523
L
H
LEU
V
127
R
-
GLY
A
553
L
H
GLN
V
123
R
-
GLY
A
553
L
-
LYS
V
124
R
-
GLY
A
553
L
-
ILE
V
125
R
-
GLY
A
554
L
H
GLN
V
123
R
-
GLY
A
554
L
-
LYS
V
124
R
-
GLY
A
554
L
-
ILE
V
125
R
-
GLY
A
554
L
-
SER
V
126
R
-
GLY
A
554
L
H
LEU
V
127
R
-
HIS
A
555
L
-
ILE
V
125
R
-
HIS
A
555
L
-
SER
V
126
R
-
HIS
A
555
L
H
LEU
V
127
R
-
HIS
A
555
L
H
LEU
V
130
R
S
ARG
A
556
L
-
SER
V
126
R
S
ARG
A
556
L
H
LEU
V
127
R
-
PRO
A
593
L
H
LYS
V
108
R
-
SER
A
594
L
H
LYS
V
108
R
-
PRO
A
595
L
H
LYS
V
108
A1IGU5_Q8N7F7.1
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
CG
GLU
A
274
L
-
HH12
ARG
V
150
R
H
CD
GLU
A
274
L
-
NH1
ARG
V
150
R
H
CD
GLU
A
274
L
-
HH11
ARG
V
150
R
H
CD
GLU
A
274
L
-
HH12
ARG
V
150
R
H
CD
GLU
A
274
L
-
HH22
ARG
V
150
R
H
OE1
GLU
A
274
L
-
NH1
ARG
V
150
R
H
OE1
GLU
A
274
L
-
NH2
ARG
V
150
R
H
OE1
GLU
A
274
L
-
CZ
ARG
V
150
R
H
OE1
GLU
A
274
L
-
HH11
ARG
V
150
R
H
OE1
GLU
A
274
L
-
HH12
ARG
V
150
R
H
OE1
GLU
A
274
L
-
HH21
ARG
V
150
R
H
OE1
GLU
A
274
L
-
HH22
ARG
V
150
R
H
OE2
GLU
A
274
L
-
NH1
ARG
V
150
R
H
OE2
GLU
A
274
L
-
HH12
ARG
V
150
R
H
OE2
GLU
A
274
L
-
HH22
ARG
V
150
R
H
CD1
TRP
A
278
L
-
OE1
GLU
V
149
R
H
CD1
TRP
A
278
L
-
HB3
GLU
V
149
R
H
NE1
TRP
A
278
L
-
CB
GLU
V
149
R
H
NE1
TRP
A
278
L
-
HB3
GLU
V
149
R
H
NE1
TRP
A
278
L
-
HB2
ARG
V
150
R
H
CH2
TRP
A
278
L
-
HD11
LEU
V
152
R
H
CZ2
TRP
A
278
L
-
HD11
LEU
V
152
R
H
CB
LEU
A
281
L
-
CD
GLU
V
149
R
H
CB
LEU
A
281
L
-
OE1
GLU
V
149
R
H
CB
LEU
A
281
L
-
OE2
GLU
V
149
R
H
CG
LEU
A
281
L
-
OE1
GLU
V
149
R
H
CD1
LEU
A
281
L
-
CD
GLU
V
149
R
H
CD1
LEU
A
281
L
-
OE1
GLU
V
149
R
H
CD1
LEU
A
281
L
-
HG2
GLU
V
149
R
H
CA
ALA
A
299
L
H
OE1
GLU
V
39
R
H
C
ALA
A
299
L
H
OE1
GLU
V
39
R
H
CB
ALA
A
299
L
H
OE1
GLU
V
39
R
H
O
ALA
A
299
L
H
OE1
GLU
V
39
R
H
CE2
PHE
A
300
L
H
NH2
ARG
V
28
R
H
CE2
PHE
A
300
L
H
HH21
ARG
V
28
R
H
CE2
PHE
A
300
L
H
HH22
ARG
V
28
R
H
CZ
PHE
A
300
L
H
NH2
ARG
V
28
R
H
CZ
PHE
A
300
L
H
HH21
ARG
V
28
R
H
CZ
PHE
A
300
L
H
HH22
ARG
V
28
R
-
CE1
PHE
A
303
L
-
CB
ASP
V
52
R
-
CE1
PHE
A
303
L
-
CG
ASP
V
52
R
-
CE1
PHE
A
303
L
-
OD2
ASP
V
52
R
-
CE1
PHE
A
303
L
-
HB2
ASP
V
52
R
-
CE1
PHE
A
303
L
-
HB3
ASP
V
52
R
-
CE2
PHE
A
303
L
-
OD2
ASP
V
52
R
-
CZ
PHE
A
303
L
-
CB
ASP
V
52
R
-
CZ
PHE
A
303
L
-
CG
ASP
V
52
R
-
CZ
PHE
A
303
L
-
OD2
ASP
V
52
R
-
CZ
PHE
A
303
L
-
HB2
ASP
V
52
R
-
CZ
PHE
A
303
L
-
HB3
ASP
V
52
R
H
CA
PRO
A
305
L
-
OD1
ASP
V
53
R
H
C
PRO
A
305
L
-
CG
ASP
V
53
R
H
C
PRO
A
305
L
-
OD1
ASP
V
53
R
H
CB
PRO
A
305
L
-
HB3
ASP
V
52
R
H
CB
PRO
A
305
L
-
OD1
ASP
V
53
R
H
O
PRO
A
305
L
-
CG
ASP
V
53
R
H
O
PRO
A
305
L
-
OD1
ASP
V
53
R
H
O
PRO
A
305
L
-
OD2
ASP
V
53
R
H
O
PRO
A
305
L
-
HB3
ASP
V
53
R
-
CA
TYR
A
308
L
-
OD2
ASP
V
53
R
-
CB
TYR
A
308
L
-
CG
ASP
V
53
R
-
CB
TYR
A
308
L
-
OD1
ASP
V
53
R
-
CB
TYR
A
308
L
-
OD2
ASP
V
53
R
-
O
TYR
A
308
L
-
CB
ASP
V
53
R
-
O
TYR
A
308
L
-
CG
ASP
V
53
R
-
O
TYR
A
308
L
-
OD1
ASP
V
53
R
-
O
TYR
A
308
L
-
OD2
ASP
V
53
R
-
O
TYR
A
308
L
-
HB3
ASP
V
53
R
-
CG
TYR
A
308
L
-
CG
ASP
V
53
R
-
CG
TYR
A
308
L
-
OD2
ASP
V
53
R
-
CD1
TYR
A
308
L
-
OD2
ASP
V
53
R
-
CD2
TYR
A
308
L
-
OD1
ASP
V
53
R
-
CD2
TYR
A
308
L
-
OD2
ASP
V
53
R
-
CG
LEU
A
310
L
-
C
ASP
V
53
R
-
CG
LEU
A
310
L
-
CB
ASP
V
53
R
-
CG
LEU
A
310
L
-
O
ASP
V
53
R
-
CG
LEU
A
310
L
-
HB2
ASP
V
53
R
-
CG
LEU
A
310
L
-
HB3
ASP
V
53
R
-
CG
LEU
A
310
L
-
HG3
LYS
V
54
R
-
CD1
LEU
A
310
L
-
CA
ASP
V
53
R
-
CD1
LEU
A
310
L
-
C
ASP
V
53
R
-
CD1
LEU
A
310
L
-
CB
ASP
V
53
R
-
CD1
LEU
A
310
L
-
O
ASP
V
53
R
-
CD1
LEU
A
310
L
-
HB2
ASP
V
53
R
-
CD1
LEU
A
310
L
-
HB3
ASP
V
53
R
-
CD1
LEU
A
310
L
-
N
LYS
V
54
R
-
CD1
LEU
A
310
L
-
CA
LYS
V
54
R
-
CD1
LEU
A
310
L
-
CG
LYS
V
54
R
-
CD1
LEU
A
310
L
-
HA
LYS
V
54
R
-
CD1
LEU
A
310
L
-
HG2
LYS
V
54
R
-
CD1
LEU
A
310
L
-
HG3
LYS
V
54
R
-
CD2
LEU
A
310
L
-
CB
ASP
V
53
R
-
CD2
LEU
A
310
L
-
HB2
ASP
V
53
R
-
CD2
LEU
A
310
L
-
HB3
ASP
V
53
R
-
CD2
LEU
A
310
L
-
CG
LYS
V
54
R
-
CD2
LEU
A
310
L
-
CE
LYS
V
54
R
-
CD2
LEU
A
310
L
-
HG2
LYS
V
54
R
-
CD2
LEU
A
310
L
-
HG3
LYS
V
54
R
-
CD2
LEU
A
310
L
-
HE2
LYS
V
54
R
H
N
ALA
A
317
L
-
HE1
HIS
V
55
R
H
CA
ALA
A
317
L
-
CE1
HIS
V
55
R
H
CA
ALA
A
317
L
-
NE2
HIS
V
55
R
H
CA
ALA
A
317
L
-
HE1
HIS
V
55
R
H
CA
ALA
A
317
L
-
HE2
HIS
V
55
R
H
C
ALA
A
317
L
-
HE1
HIS
V
55
R
H
CB
ALA
A
317
L
-
ND1
HIS
V
55
R
H
CB
ALA
A
317
L
-
CE1
HIS
V
55
R
H
CB
ALA
A
317
L
-
HE1
HIS
V
55
R
H
O
ALA
A
317
L
-
HE1
HIS
V
55
R
H
CB
TYR
A
320
L
-
HE2
HIS
V
55
R
H
CG
TYR
A
320
L
-
HE2
HIS
V
55
R
H
CD1
TYR
A
320
L
-
HB2
SER
V
22
R
H
CD1
TYR
A
320
L
-
HE2
HIS
V
55
R
H
CE1
TYR
A
320
L
-
CB
SER
V
22
R
H
CE1
TYR
A
320
L
-
OG
SER
V
22
R
H
CE1
TYR
A
320
L
-
HB2
SER
V
22
R
H
CE1
TYR
A
320
L
-
HB3
SER
V
22
R
H
CE2
TYR
A
320
L
-
OG
SER
V
22
R
H
CE2
TYR
A
320
L
-
HG
SER
V
22
R
H
OH
TYR
A
320
L
-
CB
SER
V
22
R
H
OH
TYR
A
320
L
-
OG
SER
V
22
R
H
OH
TYR
A
320
L
-
HB2
SER
V
22
R
H
OH
TYR
A
320
L
-
HG
SER
V
22
R
H
OH
TYR
A
320
L
H
HB2
ALA
V
24
R
H
OH
TYR
A
320
L
H
OG1
THR
V
25
R
H
OH
TYR
A
320
L
H
HG1
THR
V
25
R
H
CZ
TYR
A
320
L
-
CB
SER
V
22
R
H
CZ
TYR
A
320
L
-
OG
SER
V
22
R
H
CZ
TYR
A
320
L
-
HB2
SER
V
22
R
H
CZ
TYR
A
320
L
-
HG
SER
V
22
R
-
CD2
HIS
A
448
L
-
HG3
GLN
V
20
R
H
OE1
GLU
A
453
L
S
HZ1
LYS
V
16
R
H
CD1
PHE
A
456
L
-
HG
SER
V
18
R
H
CE1
PHE
A
456
L
-
OG
SER
V
18
R
H
CE1
PHE
A
456
L
-
HG
SER
V
18
R
H
CE2
PHE
A
456
L
-
HG2
GLN
V
20
R
H
CE2
PHE
A
456
L
-
HG3
GLN
V
20
R
H
CZ
PHE
A
456
L
-
OG
SER
V
18
R
H
CZ
PHE
A
456
L
-
HG
SER
V
18
R
H
CZ
PHE
A
456
L
-
CG
GLN
V
20
R
H
CZ
PHE
A
456
L
-
HB2
GLN
V
20
R
H
CZ
PHE
A
456
L
-
HG2
GLN
V
20
R
H
CZ
PHE
A
456
L
-
HG3
GLN
V
20
R
H
CG
ARG
A
457
L
-
H3
MET
V
1
R
H
CD
ARG
A
457
L
-
H3
MET
V
1
R
H
NE
ARG
A
457
L
-
HA
MET
V
1
R
H
NE
ARG
A
457
L
-
H3
MET
V
1
R
H
NH1
ARG
A
457
L
S
HE2
PHE
V
2
R
H
NH1
ARG
A
457
L
S
HE2
LYS
V
16
R
H
NH2
ARG
A
457
L
-
HA
MET
V
1
R
H
NH2
ARG
A
457
L
S
CD2
PHE
V
2
R
H
NH2
ARG
A
457
L
S
CE2
PHE
V
2
R
H
NH2
ARG
A
457
L
S
HD2
PHE
V
2
R
H
NH2
ARG
A
457
L
S
HE2
PHE
V
2
R
H
CZ
ARG
A
457
L
-
HA
MET
V
1
R
H
CZ
ARG
A
457
L
S
HE2
PHE
V
2
R
H
CB
VAL
A
460
L
-
H
GLY
V
19
R
H
CB
VAL
A
460
L
-
HA3
GLY
V
19
R
H
CG1
VAL
A
460
L
-
N
GLY
V
19
R
H
CG1
VAL
A
460
L
-
CA
GLY
V
19
R
H
CG1
VAL
A
460
L
-
H
GLY
V
19
R
H
CG1
VAL
A
460
L
-
HA2
GLY
V
19
R
H
CG1
VAL
A
460
L
-
HA3
GLY
V
19
R
H
CG2
VAL
A
460
L
-
H
GLY
V
19
R
H
CG2
VAL
A
460
L
-
HA3
GLY
V
19
R
H
CG2
VAL
A
460
L
-
HG2
GLN
V
20
R
H
CG2
VAL
A
460
L
-
HE21
GLN
V
20
R
H
CA
GLU
A
461
L
-
HD2
PRO
V
63
R
H
CB
GLU
A
461
L
-
HG3
PRO
V
63
R
H
CB
GLU
A
461
L
-
HD2
PRO
V
63
R
H
CG
GLU
A
461
L
-
HB3
MET
V
1
R
H
CG
GLU
A
461
L
-
CG
PRO
V
63
R
H
CG
GLU
A
461
L
-
HB2
PRO
V
63
R
H
CG
GLU
A
461
L
-
HG3
PRO
V
63
R
H
CG
GLU
A
461
L
-
HD2
PRO
V
63
R
H
CD
GLU
A
461
L
-
HB2
PRO
V
63
R
H
CD
GLU
A
461
L
-
HG3
PRO
V
63
R
H
OE1
GLU
A
461
L
-
HA
MET
V
1
R
H
OE1
GLU
A
461
L
-
HB2
PRO
V
63
R
H
OE1
GLU
A
461
L
-
HG3
PRO
V
63
R
H
OE2
GLU
A
461
L
-
HG3
PRO
V
63
R
H
CA
LEU
A
464
L
-
HA
CYS
V
60
R
H
C
LEU
A
464
L
-
HB3
CYS
V
60
R
H
CB
LEU
A
464
L
-
C
ILE
V
61
R
H
CB
LEU
A
464
L
-
O
ILE
V
61
R
H
CB
LEU
A
464
L
-
CA
GLY
V
62
R
H
CB
LEU
A
464
L
-
HA3
GLY
V
62
R
H
O
LEU
A
464
L
-
CB
CYS
V
60
R
H
O
LEU
A
464
L
-
O
CYS
V
60
R
H
O
LEU
A
464
L
-
HA
CYS
V
60
R
H
O
LEU
A
464
L
-
HB3
CYS
V
60
R
H
CG
LEU
A
464
L
-
HA
SER
V
57
R
H
CG
LEU
A
464
L
-
C
ILE
V
61
R
H
CG
LEU
A
464
L
-
O
ILE
V
61
R
H
CG
LEU
A
464
L
-
HA3
GLY
V
62
R
H
CD1
LEU
A
464
L
-
SD
MET
V
1
R
H
CD1
LEU
A
464
L
-
CE
MET
V
1
R
H
CD1
LEU
A
464
L
-
HE2
MET
V
1
R
H
CD1
LEU
A
464
L
-
HA2
GLY
V
19
R
H
CD1
LEU
A
464
L
-
HA3
GLY
V
19
R
H
CD1
LEU
A
464
L
-
C
ILE
V
61
R
H
CD1
LEU
A
464
L
-
O
ILE
V
61
R
H
CD1
LEU
A
464
L
-
N
GLY
V
62
R
H
CD1
LEU
A
464
L
-
CA
GLY
V
62
R
H
CD1
LEU
A
464
L
-
HA3
GLY
V
62
R
H
CD2
LEU
A
464
L
-
O
LEU
V
56
R
H
CD2
LEU
A
464
L
-
N
SER
V
57
R
H
CD2
LEU
A
464
L
-
CA
SER
V
57
R
H
CD2
LEU
A
464
L
-
O
SER
V
57
R
H
CD2
LEU
A
464
L
-
HA
SER
V
57
R
H
CD2
LEU
A
464
L
-
HB3
SER
V
57
R
H
CD2
LEU
A
464
L
-
CA
CYS
V
60
R
H
CD2
LEU
A
464
L
-
C
CYS
V
60
R
H
CD2
LEU
A
464
L
-
HA
CYS
V
60
R
H
CD2
LEU
A
464
L
-
N
ILE
V
61
R
H
CD2
LEU
A
464
L
-
CA
ILE
V
61
R
H
CD2
LEU
A
464
L
-
C
ILE
V
61
R
H
CD2
LEU
A
464
L
-
O
ILE
V
61
R
H
CD2
LEU
A
464
L
-
H
ILE
V
61
R
H
CD2
LEU
A
464
L
-
HB
ILE
V
61
R
H
N
THR
A
467
L
-
SG
CYS
V
60
R
H
N
THR
A
467
L
-
HG
CYS
V
60
R
H
CA
THR
A
467
L
-
CB
CYS
V
60
R
H
CA
THR
A
467
L
-
SG
CYS
V
60
R
H
CA
THR
A
467
L
-
HB3
CYS
V
60
R
H
CA
THR
A
467
L
-
HG
CYS
V
60
R
H
C
THR
A
467
L
-
CB
CYS
V
60
R
H
C
THR
A
467
L
-
SG
CYS
V
60
R
H
C
THR
A
467
L
-
HB2
CYS
V
60
R
H
C
THR
A
467
L
-
HB3
CYS
V
60
R
H
C
THR
A
467
L
-
HG
CYS
V
60
R
H
CB
THR
A
467
L
-
CB
CYS
V
60
R
H
CB
THR
A
467
L
-
SG
CYS
V
60
R
H
CB
THR
A
467
L
-
HA
CYS
V
60
R
H
CB
THR
A
467
L
-
HB3
CYS
V
60
R
H
CB
THR
A
467
L
-
HG
CYS
V
60
R
H
O
THR
A
467
L
-
CB
CYS
V
60
R
H
O
THR
A
467
L
-
SG
CYS
V
60
R
H
O
THR
A
467
L
-
HB2
CYS
V
60
R
H
O
THR
A
467
L
-
HB3
CYS
V
60
R
H
O
THR
A
467
L
-
HG
CYS
V
60
R
H
CG2
THR
A
467
L
-
SG
CYS
V
60
R
H
CG2
THR
A
467
L
-
HG
CYS
V
60
R
H
OG1
THR
A
467
L
-
O
SER
V
57
R
H
OG1
THR
A
467
L
-
N
CYS
V
60
R
H
OG1
THR
A
467
L
-
CA
CYS
V
60
R
H
OG1
THR
A
467
L
-
CB
CYS
V
60
R
H
OG1
THR
A
467
L
-
SG
CYS
V
60
R
H
OG1
THR
A
467
L
-
H
CYS
V
60
R
H
OG1
THR
A
467
L
-
HA
CYS
V
60
R
H
OG1
THR
A
467
L
-
HB2
CYS
V
60
R
H
OG1
THR
A
467
L
-
HB3
CYS
V
60
R
H
OG1
THR
A
467
L
-
HG
CYS
V
60
R
H
N
SER
A
468
L
-
CB
CYS
V
60
R
H
N
SER
A
468
L
-
SG
CYS
V
60
R
H
N
SER
A
468
L
-
HB2
CYS
V
60
R
H
N
SER
A
468
L
-
HB3
CYS
V
60
R
H
N
SER
A
468
L
-
HG
CYS
V
60
R
H
CA
SER
A
468
L
-
HH12
ARG
V
46
R
H
CA
SER
A
468
L
-
CB
CYS
V
60
R
H
CA
SER
A
468
L
-
SG
CYS
V
60
R
H
CA
SER
A
468
L
-
HB2
CYS
V
60
R
H
CA
SER
A
468
L
-
HB3
CYS
V
60
R
H
CA
SER
A
468
L
-
HG
CYS
V
60
R
H
C
SER
A
468
L
-
HG
CYS
V
60
R
H
CB
SER
A
468
L
-
HH12
ARG
V
46
R
H
CB
SER
A
468
L
-
CB
CYS
V
60
R
H
CB
SER
A
468
L
-
O
CYS
V
60
R
H
CB
SER
A
468
L
-
HB2
CYS
V
60
R
H
CB
SER
A
468
L
-
HB3
CYS
V
60
R
H
O
SER
A
468
L
-
HH12
ARG
V
46
R
H
OG
SER
A
468
L
-
NH1
ARG
V
46
R
H
OG
SER
A
468
L
-
NH2
ARG
V
46
R
H
OG
SER
A
468
L
-
CZ
ARG
V
46
R
H
OG
SER
A
468
L
-
HH12
ARG
V
46
R
H
OG
SER
A
468
L
-
HH22
ARG
V
46
R
H
OG
SER
A
468
L
-
HB3
CYS
V
60
R
H
CB
LEU
A
471
L
-
HG
CYS
V
60
R
H
CD2
LEU
A
471
L
-
HH11
ARG
V
46
R
H
CD2
LEU
A
471
L
-
HE22
GLN
V
48
R
H
NH2
ARG
A
472
L
-
HH22
ARG
V
46
R
H
CA
ALA
A
500
L
-
HE3
LYS
V
124
R
H
CA
ALA
A
500
L
-
HZ2
LYS
V
124
R
H
CB
ALA
A
500
L
-
CE
LYS
V
124
R
H
CB
ALA
A
500
L
-
NZ
LYS
V
124
R
H
CB
ALA
A
500
L
-
HD3
LYS
V
124
R
H
CB
ALA
A
500
L
-
HE2
LYS
V
124
R
H
CB
ALA
A
500
L
-
HE3
LYS
V
124
R
H
CB
ALA
A
500
L
-
HZ1
LYS
V
124
R
H
CB
ALA
A
500
L
-
HZ2
LYS
V
124
R
-
CB
SER
A
518
L
-
HA
ARG
V
46
R
-
OG
SER
A
518
L
-
O
ARG
V
46
R
-
O
GLY
A
519
L
S
HD22
ASN
V
68
R
-
O
THR
A
520
L
S
NZ
LYS
V
6
R
-
O
THR
A
520
L
S
HZ1
LYS
V
6
R
-
O
THR
A
520
L
S
HZ2
LYS
V
6
R
-
O
THR
A
520
L
S
HB3
SER
V
66
R
-
CG2
THR
A
520
L
-
HG2
ARG
V
46
R
-
C
GLY
A
521
L
S
HZ2
LYS
V
6
R
-
N
THR
A
522
L
S
HZ2
LYS
V
6
R
-
N
THR
A
522
L
S
HZ3
LYS
V
6
R
-
OG1
THR
A
522
L
S
HZ2
LYS
V
6
R
-
OG1
THR
A
522
L
S
HZ3
LYS
V
6
R
-
CD2
LEU
A
523
L
H
CD2
LEU
V
127
R
-
CD2
LEU
A
523
L
H
HD22
LEU
V
127
R
-
CD2
LEU
A
523
L
H
HD23
LEU
V
127
R
-
CA
GLY
A
553
L
-
HA
LYS
V
124
R
-
CA
GLY
A
553
L
-
HG2
LYS
V
124
R
-
C
GLY
A
553
L
H
O
GLN
V
123
R
-
C
GLY
A
553
L
-
CA
LYS
V
124
R
-
C
GLY
A
553
L
-
C
LYS
V
124
R
-
C
GLY
A
553
L
-
O
LYS
V
124
R
-
C
GLY
A
553
L
-
HA
LYS
V
124
R
-
C
GLY
A
553
L
-
HB3
LYS
V
124
R
-
C
GLY
A
553
L
-
HG2
LYS
V
124
R
-
O
GLY
A
553
L
H
C
GLN
V
123
R
-
O
GLY
A
553
L
H
O
GLN
V
123
R
-
O
GLY
A
553
L
-
N
LYS
V
124
R
-
O
GLY
A
553
L
-
CA
LYS
V
124
R
-
O
GLY
A
553
L
-
C
LYS
V
124
R
-
O
GLY
A
553
L
-
CB
LYS
V
124
R
-
O
GLY
A
553
L
-
O
LYS
V
124
R
-
O
GLY
A
553
L
-
CG
LYS
V
124
R
-
O
GLY
A
553
L
-
HA
LYS
V
124
R
-
O
GLY
A
553
L
-
HB2
LYS
V
124
R
-
O
GLY
A
553
L
-
HB3
LYS
V
124
R
-
O
GLY
A
553
L
-
HG2
LYS
V
124
R
-
O
GLY
A
553
L
-
HG3
LYS
V
124
R
-
O
GLY
A
553
L
-
N
ILE
V
125
R
-
N
GLY
A
554
L
H
O
GLN
V
123
R
-
N
GLY
A
554
L
-
CA
LYS
V
124
R
-
N
GLY
A
554
L
-
C
LYS
V
124
R
-
N
GLY
A
554
L
-
O
LYS
V
124
R
-
N
GLY
A
554
L
-
HA
LYS
V
124
R
-
CA
GLY
A
554
L
H
O
GLN
V
123
R
-
CA
GLY
A
554
L
-
CA
LYS
V
124
R
-
CA
GLY
A
554
L
-
C
LYS
V
124
R
-
CA
GLY
A
554
L
-
O
LYS
V
124
R
-
CA
GLY
A
554
L
-
HA
LYS
V
124
R
-
CA
GLY
A
554
L
-
N
ILE
V
125
R
-
CA
GLY
A
554
L
-
C
ILE
V
125
R
-
CA
GLY
A
554
L
-
O
ILE
V
125
R
-
CA
GLY
A
554
L
-
H
ILE
V
125
R
-
CA
GLY
A
554
L
-
HA
SER
V
126
R
-
C
GLY
A
554
L
-
O
LYS
V
124
R
-
C
GLY
A
554
L
-
C
ILE
V
125
R
-
C
GLY
A
554
L
-
O
ILE
V
125
R
-
C
GLY
A
554
L
-
N
SER
V
126
R
-
C
GLY
A
554
L
-
CA
SER
V
126
R
-
C
GLY
A
554
L
-
HA
SER
V
126
R
-
C
GLY
A
554
L
H
H
LEU
V
127
R
-
O
GLY
A
554
L
-
C
LYS
V
124
R
-
O
GLY
A
554
L
-
O
LYS
V
124
R
-
O
GLY
A
554
L
-
N
ILE
V
125
R
-
O
GLY
A
554
L
-
CA
ILE
V
125
R
-
O
GLY
A
554
L
-
C
ILE
V
125
R
-
O
GLY
A
554
L
-
O
ILE
V
125
R
-
O
GLY
A
554
L
-
HG23
ILE
V
125
R
-
O
GLY
A
554
L
-
N
SER
V
126
R
-
O
GLY
A
554
L
-
CA
SER
V
126
R
-
O
GLY
A
554
L
-
C
SER
V
126
R
-
O
GLY
A
554
L
-
CB
SER
V
126
R
-
O
GLY
A
554
L
-
O
SER
V
126
R
-
O
GLY
A
554
L
-
H
SER
V
126
R
-
O
GLY
A
554
L
-
HA
SER
V
126
R
-
O
GLY
A
554
L
-
HB2
SER
V
126
R
-
O
GLY
A
554
L
-
HB3
SER
V
126
R
-
O
GLY
A
554
L
H
N
LEU
V
127
R
-
O
GLY
A
554
L
H
H
LEU
V
127
R
-
N
HIS
A
555
L
-
O
ILE
V
125
R
-
N
HIS
A
555
L
-
HA
SER
V
126
R
-
N
HIS
A
555
L
H
H
LEU
V
127
R
-
CA
HIS
A
555
L
-
O
ILE
V
125
R
-
CA
HIS
A
555
L
-
CA
SER
V
126
R
-
CA
HIS
A
555
L
-
HA
SER
V
126
R
-
CA
HIS
A
555
L
H
N
LEU
V
127
R
-
CA
HIS
A
555
L
H
H
LEU
V
127
R
-
CA
HIS
A
555
L
H
HB3
LEU
V
127
R
-
C
HIS
A
555
L
-
HA
SER
V
126
R
-
C
HIS
A
555
L
H
H
LEU
V
127
R
-
C
HIS
A
555
L
H
HB3
LEU
V
127
R
-
CB
HIS
A
555
L
H
N
LEU
V
127
R
-
CB
HIS
A
555
L
H
CB
LEU
V
127
R
-
CB
HIS
A
555
L
H
H
LEU
V
127
R
-
CB
HIS
A
555
L
H
HB3
LEU
V
127
R
-
CB
HIS
A
555
L
H
HD11
LEU
V
127
R
-
CG
HIS
A
555
L
H
N
LEU
V
127
R
-
CG
HIS
A
555
L
H
H
LEU
V
127
R
-
CG
HIS
A
555
L
H
HA
LEU
V
127
R
-
CG
HIS
A
555
L
H
HB3
LEU
V
127
R
-
CG
HIS
A
555
L
H
HD11
LEU
V
127
R
-
ND1
HIS
A
555
L
-
O
ILE
V
125
R
-
ND1
HIS
A
555
L
-
HG23
ILE
V
125
R
-
ND1
HIS
A
555
L
-
C
SER
V
126
R
-
ND1
HIS
A
555
L
-
HA
SER
V
126
R
-
ND1
HIS
A
555
L
H
N
LEU
V
127
R
-
ND1
HIS
A
555
L
H
CA
LEU
V
127
R
-
ND1
HIS
A
555
L
H
CB
LEU
V
127
R
-
ND1
HIS
A
555
L
H
H
LEU
V
127
R
-
ND1
HIS
A
555
L
H
HA
LEU
V
127
R
-
ND1
HIS
A
555
L
H
HB3
LEU
V
127
R
-
ND1
HIS
A
555
L
H
HD11
LEU
V
127
R
-
CE1
HIS
A
555
L
-
O
ILE
V
125
R
-
CE1
HIS
A
555
L
-
HG23
ILE
V
125
R
-
CE1
HIS
A
555
L
H
HA
LEU
V
127
R
-
CE1
HIS
A
555
L
H
CD2
LEU
V
130
R
-
CE1
HIS
A
555
L
H
HB2
LEU
V
130
R
-
CE1
HIS
A
555
L
H
HD21
LEU
V
130
R
-
CE1
HIS
A
555
L
H
HD22
LEU
V
130
R
-
NE2
HIS
A
555
L
H
HD22
LEU
V
130
R
S
N
ARG
A
556
L
-
HA
SER
V
126
R
S
N
ARG
A
556
L
-
HB2
SER
V
126
R
S
N
ARG
A
556
L
H
N
LEU
V
127
R
S
N
ARG
A
556
L
H
H
LEU
V
127
R
S
N
ARG
A
556
L
H
HB2
LEU
V
127
R
S
N
ARG
A
556
L
H
HB3
LEU
V
127
R
S
CB
ARG
A
556
L
-
HB2
SER
V
126
R
S
O
ARG
A
556
L
H
CB
LEU
V
127
R
S
O
ARG
A
556
L
H
HB2
LEU
V
127
R
S
O
ARG
A
556
L
H
HB3
LEU
V
127
R
S
O
ARG
A
556
L
H
HD12
LEU
V
127
R
S
O
ARG
A
556
L
H
HD22
LEU
V
127
R
S
CG
ARG
A
556
L
-
HB2
SER
V
126
R
S
CD
ARG
A
556
L
-
HB2
SER
V
126
R
S
NE
ARG
A
556
L
-
HB3
SER
V
126
R
-
C
PRO
A
593
L
H
NZ
LYS
V
108
R
-
C
PRO
A
593
L
H
HZ1
LYS
V
108
R
-
O
PRO
A
593
L
H
NZ
LYS
V
108
R
-
O
PRO
A
593
L
H
HZ1
LYS
V
108
R
-
O
PRO
A
593
L
H
HZ2
LYS
V
108
R
-
O
PRO
A
593
L
H
HZ3
LYS
V
108
R
-
N
SER
A
594
L
H
NZ
LYS
V
108
R
-
N
SER
A
594
L
H
HZ1
LYS
V
108
R
-
N
SER
A
594
L
H
HZ3
LYS
V
108
R
-
CA
SER
A
594
L
H
NZ
LYS
V
108
R
-
CA
SER
A
594
L
H
HZ1
LYS
V
108
R
-
CA
SER
A
594
L
H
HZ2
LYS
V
108
R
-
CA
SER
A
594
L
H
HZ3
LYS
V
108
R
-
C
SER
A
594
L
H
HZ3
LYS
V
108
R
-
CB
SER
A
594
L
H
NZ
LYS
V
108
R
-
CB
SER
A
594
L
H
HZ1
LYS
V
108
R
-
CB
SER
A
594
L
H
HZ2
LYS
V
108
R
-
CB
SER
A
594
L
H
HZ3
LYS
V
108
R
-
N
PRO
A
595
L
H
HZ3
LYS
V
108
R
-
CG
PRO
A
595
L
H
HE2
LYS
V
108
R
-
CG
PRO
A
595
L
H
HZ3
LYS
V
108
R
-
CD
PRO
A
595
L
H
CE
LYS
V
108
R
-
CD
PRO
A
595
L
H
NZ
LYS
V
108
R
-
CD
PRO
A
595
L
H
HD2
LYS
V
108
R
-
CD
PRO
A
595
L
H
HE2
LYS
V
108
R
-
CD
PRO
A
595
L
H
HZ1
LYS
V
108
R
-
CD
PRO
A
595
L
H
HZ3
LYS
V
108