A1IGU5_Q8IW93.1
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
-
ALA
A
128
L
-
PRO
V
452
R
-
HIS
A
130
L
-
HIS
V
449
R
-
HIS
A
130
L
-
HIS
V
450
R
-
HIS
A
130
L
-
VAL
V
451
R
-
HIS
A
130
L
-
PRO
V
452
R
-
HIS
A
130
L
H
GLU
V
453
R
-
SER
A
132
L
-
HIS
V
449
R
-
GLU
A
133
L
H
GLU
V
440
R
-
PRO
A
45
L
H
VAL
V
425
R
-
PRO
A
45
L
H
ARG
V
429
R
-
VAL
A
46
L
H
ALA
V
432
R
-
CYS
A
47
L
H
GLN
V
428
R
-
CYS
A
47
L
H
LEU
V
431
R
-
CYS
A
47
L
H
ALA
V
432
R
-
LEU
A
48
L
H
ALA
V
432
R
-
LEU
A
48
L
H
VAL
V
435
R
-
LEU
A
48
L
H
LEU
V
436
R
-
ASP
A
49
L
H
PHE
V
332
R
-
ASP
A
49
L
H
LEU
V
431
R
-
ASP
A
49
L
H
VAL
V
435
R
-
LEU
A
50
L
H
LEU
V
327
R
-
LEU
A
50
L
H
PHE
V
332
R
-
LEU
A
50
L
H
VAL
V
435
R
-
LEU
A
50
L
H
LEU
V
436
R
-
LEU
A
50
L
H
ALA
V
439
R
-
PHE
A
51
L
H
PHE
V
300
R
-
PHE
A
51
L
H
TYR
V
320
R
-
PHE
A
51
L
H
LEU
V
323
R
-
PHE
A
51
L
H
LEU
V
327
R
-
PHE
A
51
L
H
PHE
V
332
R
-
PRO
A
52
L
H
PHE
V
300
R
-
VAL
A
53
L
H
PHE
V
300
R
-
VAL
A
53
L
-
PHE
V
303
R
-
VAL
A
53
L
H
HIS
V
328
R
-
ALA
A
54
L
H
ALA
V
299
R
-
ALA
A
54
L
H
PHE
V
300
R
-
ALA
A
54
L
-
PHE
V
303
R
-
PRO
A
55
L
H
ASN
V
296
R
-
PRO
A
55
L
H
ALA
V
299
R
-
PRO
A
55
L
H
PHE
V
300
R
-
GLU
A
56
L
H
ALA
V
299
R
-
GLU
A
56
L
H
TYR
V
302
R
-
GLU
A
57
L
H
GLN
V
298
R
-
GLU
A
57
L
H
ALA
V
299
R
-
GLU
A
57
L
H
TYR
V
302
R
-
LEU
A
58
L
H
ASP
V
295
R
-
LEU
A
58
L
H
GLN
V
298
R
-
LEU
A
58
L
H
ALA
V
299
R
S
GLU
A
601
L
H
LEU
V
412
R
-
LEU
A
605
L
H
GLU
V
405
R
-
LEU
A
605
L
H
GLN
V
408
R
-
LEU
A
605
L
H
PHE
V
409
R
-
LEU
A
605
L
H
LEU
V
412
R
-
PRO
A
606
L
H
TYR
V
213
R
-
PRO
A
606
L
H
GLU
V
405
R
-
PRO
A
606
L
H
GLN
V
408
R
-
ALA
A
607
L
H
ARG
V
216
R
-
ALA
A
607
L
H
LYS
V
217
R
-
ALA
A
607
L
H
ALA
V
220
R
-
ALA
A
607
L
H
LEU
V
401
R
-
ALA
A
607
L
H
GLU
V
405
R
-
ALA
A
608
L
H
LYS
V
217
R
-
PRO
A
609
L
H
ALA
V
220
R
-
PRO
A
609
L
H
SER
V
221
R
-
PRO
A
609
L
H
THR
V
224
R
-
PRO
A
610
L
H
GLN
V
127
R
-
LYS
A
614
L
H
ALA
V
353
R
-
LYS
A
614
L
H
GLY
V
356
R
-
LYS
A
614
L
H
PRO
V
357
R
-
LYS
A
614
L
H
PHE
V
409
R
S
LEU
A
615
L
H
LEU
V
412
R
S
SER
A
616
L
H
GLN
V
408
R
S
SER
A
616
L
H
LEU
V
412
R
S
SER
A
617
L
H
GLN
V
411
R
S
SER
A
617
L
H
LEU
V
412
R
S
SER
A
617
L
H
GLN
V
415
R
S
SER
A
617
L
H
TRP
V
416
R
S
LYS
A
618
L
H
GLN
V
408
R
S
LYS
A
618
L
H
GLN
V
411
R
S
LYS
A
618
L
H
LEU
V
412
R
S
LYS
A
618
L
H
GLN
V
415
R
S
ALA
A
619
L
H
GLN
V
415
R
-
TRP
A
65
L
H
GLN
V
337
R
S
HIS
A
677
L
H
ARG
V
84
R
S
MET
A
678
L
H
LYS
V
80
R
S
ARG
A
685
L
H
TRP
V
416
R
-
ARG
A
687
L
H
GLN
V
419
A1IGU5_Q8IW93.1
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
-
CB
PRO
A
45
L
H
CB
ARG
V
429
R
-
CB
PRO
A
45
L
H
HA
ARG
V
429
R
-
CB
PRO
A
45
L
H
HB2
ARG
V
429
R
-
CB
PRO
A
45
L
H
HG3
ARG
V
429
R
-
CB
PRO
A
45
L
H
HD3
ARG
V
429
R
-
CG
PRO
A
45
L
H
CG1
VAL
V
425
R
-
CG
PRO
A
45
L
H
HG11
VAL
V
425
R
-
CG
PRO
A
45
L
H
HG12
VAL
V
425
R
-
CG
PRO
A
45
L
H
HG13
VAL
V
425
R
-
CG
PRO
A
45
L
H
HB2
ARG
V
429
R
-
CD
PRO
A
45
L
H
CG1
VAL
V
425
R
-
CD
PRO
A
45
L
H
HG11
VAL
V
425
R
-
CD
PRO
A
45
L
H
HG12
VAL
V
425
R
-
CD
PRO
A
45
L
H
HG13
VAL
V
425
R
-
O
VAL
A
46
L
H
CB
ALA
V
432
R
-
O
VAL
A
46
L
H
HB1
ALA
V
432
R
-
O
VAL
A
46
L
H
HB2
ALA
V
432
R
-
O
VAL
A
46
L
H
HB3
ALA
V
432
R
-
N
CYS
A
47
L
H
HB3
ALA
V
432
R
-
CA
CYS
A
47
L
H
CB
ALA
V
432
R
-
CA
CYS
A
47
L
H
HB1
ALA
V
432
R
-
CA
CYS
A
47
L
H
HB3
ALA
V
432
R
-
C
CYS
A
47
L
H
HB1
ALA
V
432
R
-
C
CYS
A
47
L
H
HB3
ALA
V
432
R
-
CB
CYS
A
47
L
H
OE1
GLN
V
428
R
-
CB
CYS
A
47
L
H
HB2
GLN
V
428
R
-
CB
CYS
A
47
L
H
HB3
ALA
V
432
R
-
SG
CYS
A
47
L
H
C
GLN
V
428
R
-
SG
CYS
A
47
L
H
CB
GLN
V
428
R
-
SG
CYS
A
47
L
H
O
GLN
V
428
R
-
SG
CYS
A
47
L
H
CD
GLN
V
428
R
-
SG
CYS
A
47
L
H
OE1
GLN
V
428
R
-
SG
CYS
A
47
L
H
HA
GLN
V
428
R
-
SG
CYS
A
47
L
H
HB2
GLN
V
428
R
-
SG
CYS
A
47
L
H
HD21
LEU
V
431
R
-
SG
CYS
A
47
L
H
HB3
ALA
V
432
R
-
N
LEU
A
48
L
H
CB
ALA
V
432
R
-
N
LEU
A
48
L
H
HA
ALA
V
432
R
-
N
LEU
A
48
L
H
HB1
ALA
V
432
R
-
N
LEU
A
48
L
H
HB3
ALA
V
432
R
-
CA
LEU
A
48
L
H
HB1
ALA
V
432
R
-
C
LEU
A
48
L
H
HA
ALA
V
432
R
-
CB
LEU
A
48
L
H
HB1
ALA
V
432
R
-
O
LEU
A
48
L
H
HA
ALA
V
432
R
-
O
LEU
A
48
L
H
CB
VAL
V
435
R
-
O
LEU
A
48
L
H
CG1
VAL
V
435
R
-
O
LEU
A
48
L
H
HB
VAL
V
435
R
-
O
LEU
A
48
L
H
HG11
VAL
V
435
R
-
O
LEU
A
48
L
H
HG13
VAL
V
435
R
-
O
LEU
A
48
L
H
HG22
VAL
V
435
R
-
CD1
LEU
A
48
L
H
HB2
LEU
V
436
R
-
CD1
LEU
A
48
L
H
HD12
LEU
V
436
R
-
CD1
LEU
A
48
L
H
HD23
LEU
V
436
R
-
C
ASP
A
49
L
H
HG13
VAL
V
435
R
-
OD1
ASP
A
49
L
H
HE1
PHE
V
332
R
-
OD1
ASP
A
49
L
H
CD2
LEU
V
431
R
-
OD1
ASP
A
49
L
H
HG
LEU
V
431
R
-
OD1
ASP
A
49
L
H
HD21
LEU
V
431
R
-
OD1
ASP
A
49
L
H
HD23
LEU
V
431
R
-
N
LEU
A
50
L
H
CG1
VAL
V
435
R
-
N
LEU
A
50
L
H
HG13
VAL
V
435
R
-
CA
LEU
A
50
L
H
HG13
VAL
V
435
R
-
C
LEU
A
50
L
H
HG13
VAL
V
435
R
-
CB
LEU
A
50
L
H
CG1
VAL
V
435
R
-
CB
LEU
A
50
L
H
HG11
VAL
V
435
R
-
CB
LEU
A
50
L
H
HG12
VAL
V
435
R
-
CB
LEU
A
50
L
H
HG13
VAL
V
435
R
-
O
LEU
A
50
L
H
HD12
LEU
V
327
R
-
O
LEU
A
50
L
H
HZ
PHE
V
332
R
-
O
LEU
A
50
L
H
CG1
VAL
V
435
R
-
O
LEU
A
50
L
H
HG12
VAL
V
435
R
-
O
LEU
A
50
L
H
HG13
VAL
V
435
R
-
CG
LEU
A
50
L
H
HG11
VAL
V
435
R
-
CG
LEU
A
50
L
H
HG13
VAL
V
435
R
-
CD1
LEU
A
50
L
H
CG1
VAL
V
435
R
-
CD1
LEU
A
50
L
H
HG11
VAL
V
435
R
-
CD1
LEU
A
50
L
H
HG13
VAL
V
435
R
-
CD1
LEU
A
50
L
H
HA
LEU
V
436
R
-
CD1
LEU
A
50
L
H
HD11
LEU
V
436
R
-
CD1
LEU
A
50
L
H
HD12
LEU
V
436
R
-
CD1
LEU
A
50
L
H
CB
ALA
V
439
R
-
CD1
LEU
A
50
L
H
HB1
ALA
V
439
R
-
CD1
LEU
A
50
L
H
HB2
ALA
V
439
R
-
CD1
LEU
A
50
L
H
HB3
ALA
V
439
R
-
C
PHE
A
51
L
H
HE2
PHE
V
300
R
-
C
PHE
A
51
L
H
HZ
PHE
V
300
R
-
CB
PHE
A
51
L
H
HZ
PHE
V
300
R
-
O
PHE
A
51
L
H
CE2
PHE
V
300
R
-
O
PHE
A
51
L
H
CZ
PHE
V
300
R
-
O
PHE
A
51
L
H
HE2
PHE
V
300
R
-
O
PHE
A
51
L
H
HZ
PHE
V
300
R
-
O
PHE
A
51
L
H
HZ
PHE
V
332
R
-
CG
PHE
A
51
L
H
HD11
LEU
V
327
R
-
CD1
PHE
A
51
L
H
CE2
TYR
V
320
R
-
CD1
PHE
A
51
L
H
OH
TYR
V
320
R
-
CD1
PHE
A
51
L
H
CZ
TYR
V
320
R
-
CD1
PHE
A
51
L
H
HE2
TYR
V
320
R
-
CD1
PHE
A
51
L
H
HH
TYR
V
320
R
-
CD2
PHE
A
51
L
H
HG
LEU
V
323
R
-
CD2
PHE
A
51
L
H
CD1
LEU
V
327
R
-
CD2
PHE
A
51
L
H
HD11
LEU
V
327
R
-
CD2
PHE
A
51
L
H
HD12
LEU
V
327
R
-
CD2
PHE
A
51
L
H
HD13
LEU
V
327
R
-
CE1
PHE
A
51
L
H
CD2
TYR
V
320
R
-
CE1
PHE
A
51
L
H
CE2
TYR
V
320
R
-
CE1
PHE
A
51
L
H
OH
TYR
V
320
R
-
CE1
PHE
A
51
L
H
CZ
TYR
V
320
R
-
CE1
PHE
A
51
L
H
HD2
TYR
V
320
R
-
CE1
PHE
A
51
L
H
HE2
TYR
V
320
R
-
CE1
PHE
A
51
L
H
HH
TYR
V
320
R
-
CE1
PHE
A
51
L
H
HD21
LEU
V
323
R
-
CE2
PHE
A
51
L
H
CG
LEU
V
323
R
-
CE2
PHE
A
51
L
H
CD2
LEU
V
323
R
-
CE2
PHE
A
51
L
H
HG
LEU
V
323
R
-
CE2
PHE
A
51
L
H
HD21
LEU
V
323
R
-
CE2
PHE
A
51
L
H
HD23
LEU
V
323
R
-
CE2
PHE
A
51
L
H
CD1
LEU
V
327
R
-
CE2
PHE
A
51
L
H
HD11
LEU
V
327
R
-
CE2
PHE
A
51
L
H
HD12
LEU
V
327
R
-
CE2
PHE
A
51
L
H
HD13
LEU
V
327
R
-
CZ
PHE
A
51
L
H
CE2
TYR
V
320
R
-
CZ
PHE
A
51
L
H
HD2
TYR
V
320
R
-
CZ
PHE
A
51
L
H
HE2
TYR
V
320
R
-
CZ
PHE
A
51
L
H
CG
LEU
V
323
R
-
CZ
PHE
A
51
L
H
CD2
LEU
V
323
R
-
CZ
PHE
A
51
L
H
HG
LEU
V
323
R
-
CZ
PHE
A
51
L
H
HD21
LEU
V
323
R
-
CZ
PHE
A
51
L
H
HD23
LEU
V
323
R
-
CZ
PHE
A
51
L
H
HD11
LEU
V
327
R
-
N
PRO
A
52
L
H
HE2
PHE
V
300
R
-
CA
PRO
A
52
L
H
CE2
PHE
V
300
R
-
CA
PRO
A
52
L
H
HE2
PHE
V
300
R
-
C
PRO
A
52
L
H
CD2
PHE
V
300
R
-
C
PRO
A
52
L
H
CE2
PHE
V
300
R
-
C
PRO
A
52
L
H
CZ
PHE
V
300
R
-
C
PRO
A
52
L
H
HD2
PHE
V
300
R
-
C
PRO
A
52
L
H
HE2
PHE
V
300
R
-
O
PRO
A
52
L
H
CE2
PHE
V
300
R
-
O
PRO
A
52
L
H
HE2
PHE
V
300
R
-
N
VAL
A
53
L
H
CG
PHE
V
300
R
-
N
VAL
A
53
L
H
CD2
PHE
V
300
R
-
N
VAL
A
53
L
H
CE2
PHE
V
300
R
-
N
VAL
A
53
L
H
CZ
PHE
V
300
R
-
N
VAL
A
53
L
H
HD2
PHE
V
300
R
-
N
VAL
A
53
L
H
HE2
PHE
V
300
R
-
N
VAL
A
53
L
H
HZ
PHE
V
300
R
-
CA
VAL
A
53
L
H
CG
PHE
V
300
R
-
CA
VAL
A
53
L
H
CD2
PHE
V
300
R
-
CA
VAL
A
53
L
H
CE2
PHE
V
300
R
-
CA
VAL
A
53
L
H
CZ
PHE
V
300
R
-
CA
VAL
A
53
L
H
HD2
PHE
V
300
R
-
CA
VAL
A
53
L
H
HE2
PHE
V
300
R
-
CA
VAL
A
53
L
H
HZ
PHE
V
300
R
-
CA
VAL
A
53
L
-
HD1
PHE
V
303
R
-
C
VAL
A
53
L
H
CA
PHE
V
300
R
-
C
VAL
A
53
L
H
CB
PHE
V
300
R
-
C
VAL
A
53
L
H
CG
PHE
V
300
R
-
C
VAL
A
53
L
H
CD2
PHE
V
300
R
-
C
VAL
A
53
L
H
CE2
PHE
V
300
R
-
C
VAL
A
53
L
H
HA
PHE
V
300
R
-
C
VAL
A
53
L
H
HB2
PHE
V
300
R
-
C
VAL
A
53
L
H
HD2
PHE
V
300
R
-
C
VAL
A
53
L
H
HE2
PHE
V
300
R
-
CB
VAL
A
53
L
H
C
PHE
V
300
R
-
CB
VAL
A
53
L
H
O
PHE
V
300
R
-
CB
VAL
A
53
L
H
CG
PHE
V
300
R
-
CB
VAL
A
53
L
H
CD1
PHE
V
300
R
-
CB
VAL
A
53
L
H
CD2
PHE
V
300
R
-
CB
VAL
A
53
L
H
CE1
PHE
V
300
R
-
CB
VAL
A
53
L
H
CE2
PHE
V
300
R
-
CB
VAL
A
53
L
H
CZ
PHE
V
300
R
-
CB
VAL
A
53
L
H
HA
PHE
V
300
R
-
CB
VAL
A
53
L
H
HD2
PHE
V
300
R
-
CB
VAL
A
53
L
H
HE1
PHE
V
300
R
-
CB
VAL
A
53
L
H
HE2
PHE
V
300
R
-
CB
VAL
A
53
L
H
HZ
PHE
V
300
R
-
O
VAL
A
53
L
H
CA
PHE
V
300
R
-
O
VAL
A
53
L
H
CB
PHE
V
300
R
-
O
VAL
A
53
L
H
CG
PHE
V
300
R
-
O
VAL
A
53
L
H
CD1
PHE
V
300
R
-
O
VAL
A
53
L
H
CD2
PHE
V
300
R
-
O
VAL
A
53
L
H
CE2
PHE
V
300
R
-
O
VAL
A
53
L
H
HA
PHE
V
300
R
-
O
VAL
A
53
L
H
HB2
PHE
V
300
R
-
O
VAL
A
53
L
H
HB3
PHE
V
300
R
-
O
VAL
A
53
L
H
HD2
PHE
V
300
R
-
O
VAL
A
53
L
H
HE2
PHE
V
300
R
-
CG1
VAL
A
53
L
H
CA
PHE
V
300
R
-
CG1
VAL
A
53
L
H
C
PHE
V
300
R
-
CG1
VAL
A
53
L
H
O
PHE
V
300
R
-
CG1
VAL
A
53
L
H
CG
PHE
V
300
R
-
CG1
VAL
A
53
L
H
CD1
PHE
V
300
R
-
CG1
VAL
A
53
L
H
CD2
PHE
V
300
R
-
CG1
VAL
A
53
L
H
CE2
PHE
V
300
R
-
CG1
VAL
A
53
L
H
CZ
PHE
V
300
R
-
CG1
VAL
A
53
L
H
HA
PHE
V
300
R
-
CG1
VAL
A
53
L
H
HD2
PHE
V
300
R
-
CG1
VAL
A
53
L
H
HE2
PHE
V
300
R
-
CG1
VAL
A
53
L
-
CB
PHE
V
303
R
-
CG1
VAL
A
53
L
-
O
PHE
V
303
R
-
CG1
VAL
A
53
L
-
HB3
PHE
V
303
R
-
CG1
VAL
A
53
L
-
HD1
PHE
V
303
R
-
CG1
VAL
A
53
L
H
HE1
HIS
V
328
R
-
CG1
VAL
A
53
L
H
HD1
HIS
V
328
R
-
CG2
VAL
A
53
L
H
CD2
PHE
V
300
R
-
CG2
VAL
A
53
L
H
CE1
PHE
V
300
R
-
CG2
VAL
A
53
L
H
CE2
PHE
V
300
R
-
CG2
VAL
A
53
L
H
CZ
PHE
V
300
R
-
CG2
VAL
A
53
L
H
HD2
PHE
V
300
R
-
CG2
VAL
A
53
L
H
HE1
PHE
V
300
R
-
CG2
VAL
A
53
L
H
HE2
PHE
V
300
R
-
CG2
VAL
A
53
L
H
HZ
PHE
V
300
R
-
CG2
VAL
A
53
L
H
HD1
HIS
V
328
R
-
N
ALA
A
54
L
H
CD2
PHE
V
300
R
-
N
ALA
A
54
L
H
CE2
PHE
V
300
R
-
N
ALA
A
54
L
H
HA
PHE
V
300
R
-
N
ALA
A
54
L
H
HD2
PHE
V
300
R
-
N
ALA
A
54
L
H
HE2
PHE
V
300
R
-
N
ALA
A
54
L
-
HB3
PHE
V
303
R
-
N
ALA
A
54
L
-
HD1
PHE
V
303
R
-
CA
ALA
A
54
L
H
HA
PHE
V
300
R
-
CA
ALA
A
54
L
H
HD2
PHE
V
300
R
-
C
ALA
A
54
L
H
N
PHE
V
300
R
-
C
ALA
A
54
L
H
CA
PHE
V
300
R
-
C
ALA
A
54
L
H
HA
PHE
V
300
R
-
C
ALA
A
54
L
H
HB2
PHE
V
300
R
-
C
ALA
A
54
L
H
HD2
PHE
V
300
R
-
O
ALA
A
54
L
H
C
ALA
V
299
R
-
O
ALA
A
54
L
H
O
ALA
V
299
R
-
O
ALA
A
54
L
H
N
PHE
V
300
R
-
O
ALA
A
54
L
H
CA
PHE
V
300
R
-
O
ALA
A
54
L
H
C
PHE
V
300
R
-
O
ALA
A
54
L
H
CB
PHE
V
300
R
-
O
ALA
A
54
L
H
O
PHE
V
300
R
-
O
ALA
A
54
L
H
HA
PHE
V
300
R
-
O
ALA
A
54
L
H
HB2
PHE
V
300
R
-
O
ALA
A
54
L
H
HD2
PHE
V
300
R
-
O
ALA
A
54
L
-
CB
PHE
V
303
R
-
O
ALA
A
54
L
-
H
PHE
V
303
R
-
O
ALA
A
54
L
-
HB2
PHE
V
303
R
-
O
ALA
A
54
L
-
HB3
PHE
V
303
R
-
N
PRO
A
55
L
H
HB1
ALA
V
299
R
-
N
PRO
A
55
L
H
HB2
ALA
V
299
R
-
N
PRO
A
55
L
H
N
PHE
V
300
R
-
N
PRO
A
55
L
H
CA
PHE
V
300
R
-
N
PRO
A
55
L
H
HA
PHE
V
300
R
-
N
PRO
A
55
L
H
HB2
PHE
V
300
R
-
CA
PRO
A
55
L
H
O
ASN
V
296
R
-
CA
PRO
A
55
L
H
CA
ALA
V
299
R
-
CA
PRO
A
55
L
H
C
ALA
V
299
R
-
CA
PRO
A
55
L
H
CB
ALA
V
299
R
-
CA
PRO
A
55
L
H
O
ALA
V
299
R
-
CA
PRO
A
55
L
H
HB1
ALA
V
299
R
-
CA
PRO
A
55
L
H
HB2
ALA
V
299
R
-
CA
PRO
A
55
L
H
HB3
ALA
V
299
R
-
CA
PRO
A
55
L
H
N
PHE
V
300
R
-
CA
PRO
A
55
L
H
CA
PHE
V
300
R
-
CA
PRO
A
55
L
H
H
PHE
V
300
R
-
CA
PRO
A
55
L
H
HA
PHE
V
300
R
-
CA
PRO
A
55
L
H
HB2
PHE
V
300
R
-
C
PRO
A
55
L
H
CA
ALA
V
299
R
-
C
PRO
A
55
L
H
C
ALA
V
299
R
-
C
PRO
A
55
L
H
CB
ALA
V
299
R
-
C
PRO
A
55
L
H
O
ALA
V
299
R
-
C
PRO
A
55
L
H
HB1
ALA
V
299
R
-
C
PRO
A
55
L
H
HB2
ALA
V
299
R
-
C
PRO
A
55
L
H
HB3
ALA
V
299
R
-
CB
PRO
A
55
L
H
O
ASN
V
296
R
-
CB
PRO
A
55
L
H
HA
ASN
V
296
R
-
CB
PRO
A
55
L
H
HB3
ASN
V
296
R
-
CB
PRO
A
55
L
H
CB
ALA
V
299
R
-
CB
PRO
A
55
L
H
HB1
ALA
V
299
R
-
CB
PRO
A
55
L
H
HB2
ALA
V
299
R
-
CB
PRO
A
55
L
H
N
PHE
V
300
R
-
CB
PRO
A
55
L
H
H
PHE
V
300
R
-
CB
PRO
A
55
L
H
HB2
PHE
V
300
R
-
O
PRO
A
55
L
H
CB
ALA
V
299
R
-
O
PRO
A
55
L
H
HB1
ALA
V
299
R
-
O
PRO
A
55
L
H
HB2
ALA
V
299
R
-
O
PRO
A
55
L
H
HB3
ALA
V
299
R
-
CG
PRO
A
55
L
H
HB2
ALA
V
299
R
-
N
GLU
A
56
L
H
CA
ALA
V
299
R
-
N
GLU
A
56
L
H
C
ALA
V
299
R
-
N
GLU
A
56
L
H
CB
ALA
V
299
R
-
N
GLU
A
56
L
H
O
ALA
V
299
R
-
N
GLU
A
56
L
H
HA
ALA
V
299
R
-
N
GLU
A
56
L
H
HB1
ALA
V
299
R
-
N
GLU
A
56
L
H
HB2
ALA
V
299
R
-
N
GLU
A
56
L
H
HB3
ALA
V
299
R
-
CA
GLU
A
56
L
H
CA
ALA
V
299
R
-
CA
GLU
A
56
L
H
CB
ALA
V
299
R
-
CA
GLU
A
56
L
H
O
ALA
V
299
R
-
CA
GLU
A
56
L
H
HA
ALA
V
299
R
-
CA
GLU
A
56
L
H
HB1
ALA
V
299
R
-
CA
GLU
A
56
L
H
HB3
ALA
V
299
R
-
C
GLU
A
56
L
H
CA
ALA
V
299
R
-
C
GLU
A
56
L
H
C
ALA
V
299
R
-
C
GLU
A
56
L
H
CB
ALA
V
299
R
-
C
GLU
A
56
L
H
O
ALA
V
299
R
-
C
GLU
A
56
L
H
HA
ALA
V
299
R
-
C
GLU
A
56
L
H
HB1
ALA
V
299
R
-
C
GLU
A
56
L
H
HB3
ALA
V
299
R
-
C
GLU
A
56
L
H
HB2
TYR
V
302
R
-
C
GLU
A
56
L
H
HD1
TYR
V
302
R
-
CB
GLU
A
56
L
H
HB1
ALA
V
299
R
-
O
GLU
A
56
L
H
CA
ALA
V
299
R
-
O
GLU
A
56
L
H
C
ALA
V
299
R
-
O
GLU
A
56
L
H
CB
ALA
V
299
R
-
O
GLU
A
56
L
H
O
ALA
V
299
R
-
O
GLU
A
56
L
H
HA
ALA
V
299
R
-
O
GLU
A
56
L
H
HB1
ALA
V
299
R
-
O
GLU
A
56
L
H
CB
TYR
V
302
R
-
O
GLU
A
56
L
H
CG
TYR
V
302
R
-
O
GLU
A
56
L
H
CD1
TYR
V
302
R
-
O
GLU
A
56
L
H
HB2
TYR
V
302
R
-
O
GLU
A
56
L
H
HB3
TYR
V
302
R
-
O
GLU
A
56
L
H
HD1
TYR
V
302
R
-
N
GLU
A
57
L
H
CA
ALA
V
299
R
-
N
GLU
A
57
L
H
CB
ALA
V
299
R
-
N
GLU
A
57
L
H
HA
ALA
V
299
R
-
N
GLU
A
57
L
H
HB1
ALA
V
299
R
-
N
GLU
A
57
L
H
HB3
ALA
V
299
R
-
CA
GLU
A
57
L
H
HA
ALA
V
299
R
-
C
GLU
A
57
L
H
HG3
GLN
V
298
R
-
C
GLU
A
57
L
H
HA
ALA
V
299
R
-
C
GLU
A
57
L
H
HB3
ALA
V
299
R
-
C
GLU
A
57
L
H
HB3
TYR
V
302
R
-
CB
GLU
A
57
L
H
CG
TYR
V
302
R
-
CB
GLU
A
57
L
H
CD1
TYR
V
302
R
-
CB
GLU
A
57
L
H
CE1
TYR
V
302
R
-
CB
GLU
A
57
L
H
HD1
TYR
V
302
R
-
O
GLU
A
57
L
H
HG3
GLN
V
298
R
-
O
GLU
A
57
L
H
HE21
GLN
V
298
R
-
O
GLU
A
57
L
H
HA
ALA
V
299
R
-
O
GLU
A
57
L
H
CB
TYR
V
302
R
-
O
GLU
A
57
L
H
CG
TYR
V
302
R
-
O
GLU
A
57
L
H
CD2
TYR
V
302
R
-
O
GLU
A
57
L
H
HB2
TYR
V
302
R
-
O
GLU
A
57
L
H
HB3
TYR
V
302
R
-
O
GLU
A
57
L
H
HD2
TYR
V
302
R
-
CG
GLU
A
57
L
H
HE1
TYR
V
302
R
-
CD
GLU
A
57
L
H
CE1
TYR
V
302
R
-
CD
GLU
A
57
L
H
HE1
TYR
V
302
R
-
OE2
GLU
A
57
L
H
CD1
TYR
V
302
R
-
OE2
GLU
A
57
L
H
CE1
TYR
V
302
R
-
OE2
GLU
A
57
L
H
OH
TYR
V
302
R
-
OE2
GLU
A
57
L
H
CZ
TYR
V
302
R
-
OE2
GLU
A
57
L
H
HE1
TYR
V
302
R
-
OE2
GLU
A
57
L
H
HH
TYR
V
302
R
-
N
LEU
A
58
L
H
HG3
GLN
V
298
R
-
N
LEU
A
58
L
H
HA
ALA
V
299
R
-
N
LEU
A
58
L
H
HB3
ALA
V
299
R
-
CA
LEU
A
58
L
H
HG2
GLN
V
298
R
-
CA
LEU
A
58
L
H
HG3
GLN
V
298
R
-
CG
LEU
A
58
L
H
CA
ASP
V
295
R
-
CG
LEU
A
58
L
H
C
ASP
V
295
R
-
CG
LEU
A
58
L
H
CB
ASP
V
295
R
-
CG
LEU
A
58
L
H
O
ASP
V
295
R
-
CG
LEU
A
58
L
H
CG
ASP
V
295
R
-
CG
LEU
A
58
L
H
OD1
ASP
V
295
R
-
CG
LEU
A
58
L
H
HA
ASP
V
295
R
-
CG
LEU
A
58
L
H
HB3
ASP
V
295
R
-
CG
LEU
A
58
L
H
HB3
GLN
V
298
R
-
CD1
LEU
A
58
L
H
CB
ASP
V
295
R
-
CD1
LEU
A
58
L
H
CG
ASP
V
295
R
-
CD1
LEU
A
58
L
H
OD1
ASP
V
295
R
-
CD1
LEU
A
58
L
H
OD2
ASP
V
295
R
-
CD1
LEU
A
58
L
H
HA
ASP
V
295
R
-
CD1
LEU
A
58
L
H
HB2
ASP
V
295
R
-
CD1
LEU
A
58
L
H
HB3
ASP
V
295
R
-
CD2
LEU
A
58
L
H
CA
ASP
V
295
R
-
CD2
LEU
A
58
L
H
C
ASP
V
295
R
-
CD2
LEU
A
58
L
H
CB
ASP
V
295
R
-
CD2
LEU
A
58
L
H
O
ASP
V
295
R
-
CD2
LEU
A
58
L
H
CG
ASP
V
295
R
-
CD2
LEU
A
58
L
H
OD1
ASP
V
295
R
-
CD2
LEU
A
58
L
H
OD2
ASP
V
295
R
-
CD2
LEU
A
58
L
H
HA
ASP
V
295
R
-
CD2
LEU
A
58
L
H
HB2
ASP
V
295
R
-
CD2
LEU
A
58
L
H
HB3
ASP
V
295
R
-
CD2
LEU
A
58
L
H
HB3
GLN
V
298
R
-
CD2
LEU
A
58
L
H
HG2
GLN
V
298
R
-
O
TRP
A
65
L
H
HE22
GLN
V
337
R
-
O
ALA
A
128
L
-
HA
PRO
V
452
R
-
O
ALA
A
128
L
-
HB2
PRO
V
452
R
-
CB
HIS
A
130
L
-
O
HIS
V
449
R
-
CB
HIS
A
130
L
-
HA
HIS
V
450
R
-
O
HIS
A
130
L
-
HA
HIS
V
450
R
-
CG
HIS
A
130
L
-
O
HIS
V
449
R
-
CG
HIS
A
130
L
-
HA
PRO
V
452
R
-
CD2
HIS
A
130
L
-
O
VAL
V
451
R
-
CD2
HIS
A
130
L
-
CA
PRO
V
452
R
-
CD2
HIS
A
130
L
-
HA
PRO
V
452
R
-
CD2
HIS
A
130
L
H
H
GLU
V
453
R
-
ND1
HIS
A
130
L
-
O
HIS
V
449
R
-
NE2
HIS
A
130
L
-
HA
PRO
V
452
R
-
NE2
HIS
A
130
L
H
H
GLU
V
453
R
-
NE2
HIS
A
130
L
H
HB2
GLU
V
453
R
-
N
SER
A
132
L
-
HE1
HIS
V
449
R
-
OE2
GLU
A
133
L
H
HB3
GLU
V
440
R
S
O
GLU
A
601
L
H
HD22
LEU
V
412
R
-
CB
LEU
A
605
L
H
OE2
GLU
V
405
R
-
CD1
LEU
A
605
L
H
HD2
PHE
V
409
R
-
CD2
LEU
A
605
L
H
OE2
GLU
V
405
R
-
CD2
LEU
A
605
L
H
HB2
GLN
V
408
R
-
CD2
LEU
A
605
L
H
HB3
GLN
V
408
R
-
CD2
LEU
A
605
L
H
HD11
LEU
V
412
R
-
N
PRO
A
606
L
H
OE1
GLU
V
405
R
-
CA
PRO
A
606
L
H
CE2
TYR
V
213
R
-
CA
PRO
A
606
L
H
OH
TYR
V
213
R
-
CA
PRO
A
606
L
H
HE2
TYR
V
213
R
-
C
PRO
A
606
L
H
CE2
TYR
V
213
R
-
C
PRO
A
606
L
H
OH
TYR
V
213
R
-
C
PRO
A
606
L
H
CZ
TYR
V
213
R
-
C
PRO
A
606
L
H
HE2
TYR
V
213
R
-
CB
PRO
A
606
L
H
CE2
TYR
V
213
R
-
CB
PRO
A
606
L
H
HE2
TYR
V
213
R
-
CB
PRO
A
606
L
H
OE1
GLU
V
405
R
-
O
PRO
A
606
L
H
CD2
TYR
V
213
R
-
O
PRO
A
606
L
H
CE1
TYR
V
213
R
-
O
PRO
A
606
L
H
CE2
TYR
V
213
R
-
O
PRO
A
606
L
H
OH
TYR
V
213
R
-
O
PRO
A
606
L
H
CZ
TYR
V
213
R
-
O
PRO
A
606
L
H
HE2
TYR
V
213
R
-
O
PRO
A
606
L
H
HH
TYR
V
213
R
-
CG
PRO
A
606
L
H
HE2
TYR
V
213
R
-
CG
PRO
A
606
L
H
CD
GLU
V
405
R
-
CG
PRO
A
606
L
H
OE1
GLU
V
405
R
-
CG
PRO
A
606
L
H
OE2
GLU
V
405
R
-
CG
PRO
A
606
L
H
HE22
GLN
V
408
R
-
CD
PRO
A
606
L
H
CD
GLU
V
405
R
-
CD
PRO
A
606
L
H
OE1
GLU
V
405
R
-
CD
PRO
A
606
L
H
OE2
GLU
V
405
R
-
CA
ALA
A
607
L
H
HA
LYS
V
217
R
-
CA
ALA
A
607
L
H
HD13
LEU
V
401
R
-
C
ALA
A
607
L
H
HG3
LYS
V
217
R
-
C
ALA
A
607
L
H
HB1
ALA
V
220
R
-
C
ALA
A
607
L
H
HB3
ALA
V
220
R
-
CB
ALA
A
607
L
H
HB3
ARG
V
216
R
-
CB
ALA
A
607
L
H
HB2
ALA
V
220
R
-
CB
ALA
A
607
L
H
CD1
LEU
V
401
R
-
CB
ALA
A
607
L
H
HD11
LEU
V
401
R
-
CB
ALA
A
607
L
H
HD12
LEU
V
401
R
-
CB
ALA
A
607
L
H
HD13
LEU
V
401
R
-
CB
ALA
A
607
L
H
CG
GLU
V
405
R
-
CB
ALA
A
607
L
H
CD
GLU
V
405
R
-
CB
ALA
A
607
L
H
OE1
GLU
V
405
R
-
CB
ALA
A
607
L
H
HG3
GLU
V
405
R
-
O
ALA
A
607
L
H
HA
LYS
V
217
R
-
O
ALA
A
607
L
H
CB
ALA
V
220
R
-
O
ALA
A
607
L
H
HB1
ALA
V
220
R
-
O
ALA
A
607
L
H
HB2
ALA
V
220
R
-
O
ALA
A
607
L
H
HB3
ALA
V
220
R
-
O
ALA
A
607
L
H
HD13
LEU
V
401
R
-
O
ALA
A
608
L
H
HE3
LYS
V
217
R
-
CB
PRO
A
609
L
H
CB
SER
V
221
R
-
CB
PRO
A
609
L
H
OG
SER
V
221
R
-
CB
PRO
A
609
L
H
HA
SER
V
221
R
-
CB
PRO
A
609
L
H
HB2
SER
V
221
R
-
CG
PRO
A
609
L
H
HA
SER
V
221
R
-
CG
PRO
A
609
L
H
HB
THR
V
224
R
-
CG
PRO
A
609
L
H
HG21
THR
V
224
R
-
CD
PRO
A
609
L
H
HB1
ALA
V
220
R
-
CD
PRO
A
609
L
H
HA
SER
V
221
R
-
CD
PRO
A
609
L
H
HG21
THR
V
224
R
-
CB
PRO
A
610
L
H
HE22
GLN
V
127
R
-
CG
PRO
A
610
L
H
CD
GLN
V
127
R
-
CG
PRO
A
610
L
H
NE2
GLN
V
127
R
-
CG
PRO
A
610
L
H
OE1
GLN
V
127
R
-
CG
PRO
A
610
L
H
HE22
GLN
V
127
R
-
CD
PRO
A
610
L
H
NE2
GLN
V
127
R
-
CD
PRO
A
610
L
H
HE22
GLN
V
127
R
-
CG
LYS
A
614
L
H
HB1
ALA
V
353
R
-
CD
LYS
A
614
L
H
HB1
ALA
V
353
R
-
CD
LYS
A
614
L
H
HE2
PHE
V
409
R
-
CE
LYS
A
614
L
H
CA
ALA
V
353
R
-
CE
LYS
A
614
L
H
C
ALA
V
353
R
-
CE
LYS
A
614
L
H
CB
ALA
V
353
R
-
CE
LYS
A
614
L
H
O
ALA
V
353
R
-
CE
LYS
A
614
L
H
HA
ALA
V
353
R
-
CE
LYS
A
614
L
H
HB1
ALA
V
353
R
-
CE
LYS
A
614
L
H
HB3
ALA
V
353
R
-
CE
LYS
A
614
L
H
HD2
PRO
V
357
R
-
CE
LYS
A
614
L
H
HE2
PHE
V
409
R
-
NZ
LYS
A
614
L
H
CA
ALA
V
353
R
-
NZ
LYS
A
614
L
H
C
ALA
V
353
R
-
NZ
LYS
A
614
L
H
CB
ALA
V
353
R
-
NZ
LYS
A
614
L
H
O
ALA
V
353
R
-
NZ
LYS
A
614
L
H
HA
ALA
V
353
R
-
NZ
LYS
A
614
L
H
HB1
ALA
V
353
R
-
NZ
LYS
A
614
L
H
H
GLY
V
356
R
-
NZ
LYS
A
614
L
H
HA2
GLY
V
356
R
-
NZ
LYS
A
614
L
H
CD
PRO
V
357
R
-
NZ
LYS
A
614
L
H
HG2
PRO
V
357
R
-
NZ
LYS
A
614
L
H
HD2
PRO
V
357
R
-
NZ
LYS
A
614
L
H
HD3
PRO
V
357
R
-
NZ
LYS
A
614
L
H
HE2
PHE
V
409
R
S
CA
LEU
A
615
L
H
HD12
LEU
V
412
R
S
C
LEU
A
615
L
H
CD1
LEU
V
412
R
S
C
LEU
A
615
L
H
HD11
LEU
V
412
R
S
C
LEU
A
615
L
H
HD12
LEU
V
412
R
S
C
LEU
A
615
L
H
HD13
LEU
V
412
R
S
C
LEU
A
615
L
H
HD23
LEU
V
412
R
S
O
LEU
A
615
L
H
CD1
LEU
V
412
R
S
O
LEU
A
615
L
H
HB3
LEU
V
412
R
S
O
LEU
A
615
L
H
HD11
LEU
V
412
R
S
O
LEU
A
615
L
H
HD12
LEU
V
412
R
S
O
LEU
A
615
L
H
HD13
LEU
V
412
R
S
O
LEU
A
615
L
H
HD23
LEU
V
412
R
S
N
SER
A
616
L
H
CG
LEU
V
412
R
S
N
SER
A
616
L
H
CD1
LEU
V
412
R
S
N
SER
A
616
L
H
CD2
LEU
V
412
R
S
N
SER
A
616
L
H
HD11
LEU
V
412
R
S
N
SER
A
616
L
H
HD12
LEU
V
412
R
S
N
SER
A
616
L
H
HD13
LEU
V
412
R
S
N
SER
A
616
L
H
HD22
LEU
V
412
R
S
N
SER
A
616
L
H
HD23
LEU
V
412
R
S
CA
SER
A
616
L
H
CB
LEU
V
412
R
S
CA
SER
A
616
L
H
CG
LEU
V
412
R
S
CA
SER
A
616
L
H
CD1
LEU
V
412
R
S
CA
SER
A
616
L
H
CD2
LEU
V
412
R
S
CA
SER
A
616
L
H
HB2
LEU
V
412
R
S
CA
SER
A
616
L
H
HB3
LEU
V
412
R
S
CA
SER
A
616
L
H
HG
LEU
V
412
R
S
CA
SER
A
616
L
H
HD11
LEU
V
412
R
S
CA
SER
A
616
L
H
HD12
LEU
V
412
R
S
CA
SER
A
616
L
H
HD13
LEU
V
412
R
S
CA
SER
A
616
L
H
HD21
LEU
V
412
R
S
CA
SER
A
616
L
H
HD22
LEU
V
412
R
S
CA
SER
A
616
L
H
HD23
LEU
V
412
R
S
C
SER
A
616
L
H
CB
LEU
V
412
R
S
C
SER
A
616
L
H
CG
LEU
V
412
R
S
C
SER
A
616
L
H
CD1
LEU
V
412
R
S
C
SER
A
616
L
H
CD2
LEU
V
412
R
S
C
SER
A
616
L
H
HB3
LEU
V
412
R
S
C
SER
A
616
L
H
HG
LEU
V
412
R
S
C
SER
A
616
L
H
HD11
LEU
V
412
R
S
C
SER
A
616
L
H
HD12
LEU
V
412
R
S
C
SER
A
616
L
H
HD13
LEU
V
412
R
S
C
SER
A
616
L
H
HD21
LEU
V
412
R
S
C
SER
A
616
L
H
HD22
LEU
V
412
R
S
C
SER
A
616
L
H
HD23
LEU
V
412
R
S
CB
SER
A
616
L
H
HB3
GLN
V
408
R
S
CB
SER
A
616
L
H
CG
LEU
V
412
R
S
CB
SER
A
616
L
H
CD1
LEU
V
412
R
S
CB
SER
A
616
L
H
CD2
LEU
V
412
R
S
CB
SER
A
616
L
H
HG
LEU
V
412
R
S
CB
SER
A
616
L
H
HD11
LEU
V
412
R
S
CB
SER
A
616
L
H
HD12
LEU
V
412
R
S
CB
SER
A
616
L
H
HD13
LEU
V
412
R
S
CB
SER
A
616
L
H
HD22
LEU
V
412
R
S
CB
SER
A
616
L
H
HD23
LEU
V
412
R
S
O
SER
A
616
L
H
CG
LEU
V
412
R
S
O
SER
A
616
L
H
CD1
LEU
V
412
R
S
O
SER
A
616
L
H
CD2
LEU
V
412
R
S
O
SER
A
616
L
H
HD12
LEU
V
412
R
S
O
SER
A
616
L
H
HD13
LEU
V
412
R
S
O
SER
A
616
L
H
HD21
LEU
V
412
R
S
O
SER
A
616
L
H
HD22
LEU
V
412
R
S
O
SER
A
616
L
H
HD23
LEU
V
412
R
S
OG
SER
A
616
L
H
HB3
GLN
V
408
R
S
OG
SER
A
616
L
H
CG
LEU
V
412
R
S
OG
SER
A
616
L
H
CD1
LEU
V
412
R
S
OG
SER
A
616
L
H
HG
LEU
V
412
R
S
OG
SER
A
616
L
H
HD11
LEU
V
412
R
S
OG
SER
A
616
L
H
HD12
LEU
V
412
R
S
OG
SER
A
616
L
H
HD13
LEU
V
412
R
S
OG
SER
A
616
L
H
HD22
LEU
V
412
R
S
N
SER
A
617
L
H
CA
LEU
V
412
R
S
N
SER
A
617
L
H
CB
LEU
V
412
R
S
N
SER
A
617
L
H
CG
LEU
V
412
R
S
N
SER
A
617
L
H
CD1
LEU
V
412
R
S
N
SER
A
617
L
H
CD2
LEU
V
412
R
S
N
SER
A
617
L
H
HA
LEU
V
412
R
S
N
SER
A
617
L
H
HB2
LEU
V
412
R
S
N
SER
A
617
L
H
HB3
LEU
V
412
R
S
N
SER
A
617
L
H
HG
LEU
V
412
R
S
N
SER
A
617
L
H
HD11
LEU
V
412
R
S
N
SER
A
617
L
H
HD12
LEU
V
412
R
S
N
SER
A
617
L
H
HD13
LEU
V
412
R
S
N
SER
A
617
L
H
HD21
LEU
V
412
R
S
N
SER
A
617
L
H
HD22
LEU
V
412
R
S
N
SER
A
617
L
H
HD23
LEU
V
412
R
S
CA
SER
A
617
L
H
CB
LEU
V
412
R
S
CA
SER
A
617
L
H
CG
LEU
V
412
R
S
CA
SER
A
617
L
H
CD2
LEU
V
412
R
S
CA
SER
A
617
L
H
HA
LEU
V
412
R
S
CA
SER
A
617
L
H
HB3
LEU
V
412
R
S
CA
SER
A
617
L
H
HG
LEU
V
412
R
S
CA
SER
A
617
L
H
HD21
LEU
V
412
R
S
CA
SER
A
617
L
H
HD22
LEU
V
412
R
S
CA
SER
A
617
L
H
HD23
LEU
V
412
R
S
CA
SER
A
617
L
H
OE1
GLN
V
415
R
S
C
SER
A
617
L
H
CG
LEU
V
412
R
S
C
SER
A
617
L
H
CD2
LEU
V
412
R
S
C
SER
A
617
L
H
HA
LEU
V
412
R
S
C
SER
A
617
L
H
HG
LEU
V
412
R
S
C
SER
A
617
L
H
HD21
LEU
V
412
R
S
C
SER
A
617
L
H
HD22
LEU
V
412
R
S
C
SER
A
617
L
H
HD23
LEU
V
412
R
S
C
SER
A
617
L
H
CD
GLN
V
415
R
S
C
SER
A
617
L
H
NE2
GLN
V
415
R
S
C
SER
A
617
L
H
OE1
GLN
V
415
R
S
C
SER
A
617
L
H
HE22
GLN
V
415
R
S
CB
SER
A
617
L
H
CA
LEU
V
412
R
S
CB
SER
A
617
L
H
CG
LEU
V
412
R
S
CB
SER
A
617
L
H
CD2
LEU
V
412
R
S
CB
SER
A
617
L
H
HA
LEU
V
412
R
S
CB
SER
A
617
L
H
HB3
LEU
V
412
R
S
CB
SER
A
617
L
H
HD21
LEU
V
412
R
S
CB
SER
A
617
L
H
HD22
LEU
V
412
R
S
CB
SER
A
617
L
H
HD23
LEU
V
412
R
S
CB
SER
A
617
L
H
OE1
GLN
V
415
R
S
CB
SER
A
617
L
H
HB2
GLN
V
415
R
S
CB
SER
A
617
L
H
HB3
GLN
V
415
R
S
CB
SER
A
617
L
H
CD1
TRP
V
416
R
S
CB
SER
A
617
L
H
NE1
TRP
V
416
R
S
CB
SER
A
617
L
H
HD1
TRP
V
416
R
S
CB
SER
A
617
L
H
HE1
TRP
V
416
R
S
O
SER
A
617
L
H
C
GLN
V
411
R
S
O
SER
A
617
L
H
O
GLN
V
411
R
S
O
SER
A
617
L
H
HG2
GLN
V
411
R
S
O
SER
A
617
L
H
N
LEU
V
412
R
S
O
SER
A
617
L
H
CA
LEU
V
412
R
S
O
SER
A
617
L
H
CB
LEU
V
412
R
S
O
SER
A
617
L
H
CG
LEU
V
412
R
S
O
SER
A
617
L
H
CD2
LEU
V
412
R
S
O
SER
A
617
L
H
HA
LEU
V
412
R
S
O
SER
A
617
L
H
HG
LEU
V
412
R
S
O
SER
A
617
L
H
HD21
LEU
V
412
R
S
O
SER
A
617
L
H
HD22
LEU
V
412
R
S
O
SER
A
617
L
H
HD23
LEU
V
412
R
S
O
SER
A
617
L
H
CB
GLN
V
415
R
S
O
SER
A
617
L
H
CG
GLN
V
415
R
S
O
SER
A
617
L
H
CD
GLN
V
415
R
S
O
SER
A
617
L
H
NE2
GLN
V
415
R
S
O
SER
A
617
L
H
OE1
GLN
V
415
R
S
O
SER
A
617
L
H
HB2
GLN
V
415
R
S
O
SER
A
617
L
H
HG3
GLN
V
415
R
S
O
SER
A
617
L
H
HE21
GLN
V
415
R
S
O
SER
A
617
L
H
HE22
GLN
V
415
R
S
OG
SER
A
617
L
H
CA
LEU
V
412
R
S
OG
SER
A
617
L
H
C
LEU
V
412
R
S
OG
SER
A
617
L
H
CB
LEU
V
412
R
S
OG
SER
A
617
L
H
O
LEU
V
412
R
S
OG
SER
A
617
L
H
CG
LEU
V
412
R
S
OG
SER
A
617
L
H
CD2
LEU
V
412
R
S
OG
SER
A
617
L
H
HA
LEU
V
412
R
S
OG
SER
A
617
L
H
HB3
LEU
V
412
R
S
OG
SER
A
617
L
H
HD21
LEU
V
412
R
S
OG
SER
A
617
L
H
HD22
LEU
V
412
R
S
OG
SER
A
617
L
H
HD23
LEU
V
412
R
S
OG
SER
A
617
L
H
CB
GLN
V
415
R
S
OG
SER
A
617
L
H
CD
GLN
V
415
R
S
OG
SER
A
617
L
H
OE1
GLN
V
415
R
S
OG
SER
A
617
L
H
HB2
GLN
V
415
R
S
OG
SER
A
617
L
H
HB3
GLN
V
415
R
S
OG
SER
A
617
L
H
CD1
TRP
V
416
R
S
OG
SER
A
617
L
H
NE1
TRP
V
416
R
S
OG
SER
A
617
L
H
H
TRP
V
416
R
S
OG
SER
A
617
L
H
HD1
TRP
V
416
R
S
OG
SER
A
617
L
H
HE1
TRP
V
416
R
S
N
LYS
A
618
L
H
CD2
LEU
V
412
R
S
N
LYS
A
618
L
H
HD21
LEU
V
412
R
S
N
LYS
A
618
L
H
HD22
LEU
V
412
R
S
N
LYS
A
618
L
H
CD
GLN
V
415
R
S
N
LYS
A
618
L
H
NE2
GLN
V
415
R
S
N
LYS
A
618
L
H
OE1
GLN
V
415
R
S
N
LYS
A
618
L
H
HE22
GLN
V
415
R
S
CA
LYS
A
618
L
H
HD21
LEU
V
412
R
S
CA
LYS
A
618
L
H
CD
GLN
V
415
R
S
CA
LYS
A
618
L
H
NE2
GLN
V
415
R
S
CA
LYS
A
618
L
H
OE1
GLN
V
415
R
S
CA
LYS
A
618
L
H
HE21
GLN
V
415
R
S
CA
LYS
A
618
L
H
HE22
GLN
V
415
R
S
C
LYS
A
618
L
H
CD
GLN
V
415
R
S
C
LYS
A
618
L
H
NE2
GLN
V
415
R
S
C
LYS
A
618
L
H
OE1
GLN
V
415
R
S
C
LYS
A
618
L
H
HE21
GLN
V
415
R
S
C
LYS
A
618
L
H
HE22
GLN
V
415
R
S
CB
LYS
A
618
L
H
NE2
GLN
V
415
R
S
CB
LYS
A
618
L
H
HE22
GLN
V
415
R
S
O
LYS
A
618
L
H
OE1
GLN
V
415
R
S
O
LYS
A
618
L
H
HE22
GLN
V
415
R
S
CG
LYS
A
618
L
H
CD
GLN
V
411
R
S
CG
LYS
A
618
L
H
NE2
GLN
V
411
R
S
CG
LYS
A
618
L
H
OE1
GLN
V
411
R
S
CG
LYS
A
618
L
H
HE22
GLN
V
411
R
S
CG
LYS
A
618
L
H
HE22
GLN
V
415
R
S
CE
LYS
A
618
L
H
HG2
GLN
V
408
R
S
CE
LYS
A
618
L
H
OE1
GLN
V
411
R
S
NZ
LYS
A
618
L
H
HG2
GLN
V
408
R
S
N
ALA
A
619
L
H
CD
GLN
V
415
R
S
N
ALA
A
619
L
H
NE2
GLN
V
415
R
S
N
ALA
A
619
L
H
OE1
GLN
V
415
R
S
N
ALA
A
619
L
H
HE21
GLN
V
415
R
S
N
ALA
A
619
L
H
HE22
GLN
V
415
R
S
CA
ALA
A
619
L
H
NE2
GLN
V
415
R
S
CA
ALA
A
619
L
H
HE22
GLN
V
415
R
S
CB
HIS
A
677
L
H
HH11
ARG
V
84
R
S
CG
HIS
A
677
L
H
CD
ARG
V
84
R
S
CG
HIS
A
677
L
H
NH1
ARG
V
84
R
S
CG
HIS
A
677
L
H
HD2
ARG
V
84
R
S
CG
HIS
A
677
L
H
HD3
ARG
V
84
R
S
CG
HIS
A
677
L
H
HH11
ARG
V
84
R
S
CD2
HIS
A
677
L
H
HD2
ARG
V
84
R
S
CD2
HIS
A
677
L
H
HD3
ARG
V
84
R
S
CD2
HIS
A
677
L
H
HH11
ARG
V
84
R
S
ND1
HIS
A
677
L
H
CG
ARG
V
84
R
S
ND1
HIS
A
677
L
H
CD
ARG
V
84
R
S
ND1
HIS
A
677
L
H
NE
ARG
V
84
R
S
ND1
HIS
A
677
L
H
NH1
ARG
V
84
R
S
ND1
HIS
A
677
L
H
CZ
ARG
V
84
R
S
ND1
HIS
A
677
L
H
HD2
ARG
V
84
R
S
ND1
HIS
A
677
L
H
HD3
ARG
V
84
R
S
ND1
HIS
A
677
L
H
HE
ARG
V
84
R
S
ND1
HIS
A
677
L
H
HH11
ARG
V
84
R
S
ND1
HIS
A
677
L
H
HH12
ARG
V
84
R
S
CE1
HIS
A
677
L
H
CG
ARG
V
84
R
S
CE1
HIS
A
677
L
H
CD
ARG
V
84
R
S
CE1
HIS
A
677
L
H
NE
ARG
V
84
R
S
CE1
HIS
A
677
L
H
NH1
ARG
V
84
R
S
CE1
HIS
A
677
L
H
CZ
ARG
V
84
R
S
CE1
HIS
A
677
L
H
HG2
ARG
V
84
R
S
CE1
HIS
A
677
L
H
HG3
ARG
V
84
R
S
CE1
HIS
A
677
L
H
HD2
ARG
V
84
R
S
CE1
HIS
A
677
L
H
HD3
ARG
V
84
R
S
CE1
HIS
A
677
L
H
HE
ARG
V
84
R
S
CE1
HIS
A
677
L
H
HH11
ARG
V
84
R
S
NE2
HIS
A
677
L
H
CD
ARG
V
84
R
S
NE2
HIS
A
677
L
H
HG2
ARG
V
84
R
S
NE2
HIS
A
677
L
H
HD2
ARG
V
84
R
S
NE2
HIS
A
677
L
H
HD3
ARG
V
84
R
S
NE2
HIS
A
677
L
H
HH11
ARG
V
84
R
S
N
MET
A
678
L
H
HZ1
LYS
V
80
R
S
CB
MET
A
678
L
H
HZ1
LYS
V
80
R
S
CB
MET
A
678
L
H
HZ3
LYS
V
80
R
S
CG
MET
A
678
L
H
HZ1
LYS
V
80
R
S
NH1
ARG
A
685
L
H
CE2
TRP
V
416
R
S
NH1
ARG
A
685
L
H
CH2
TRP
V
416
R
S
NH1
ARG
A
685
L
H
CZ2
TRP
V
416
R
S
NH1
ARG
A
685
L
H
HZ2
TRP
V
416
R
S
NH1
ARG
A
685
L
H
HE1
TRP
V
416
R
S
NH2
ARG
A
685
L
H
CE2
TRP
V
416
R
S
NH2
ARG
A
685
L
H
NE1
TRP
V
416
R
S
NH2
ARG
A
685
L
H
HE1
TRP
V
416
R
S
CZ
ARG
A
685
L
H
HZ2
TRP
V
416
R
-
CA
ARG
A
687
L
H
HE21
GLN
V
419
R
-
CA
ARG
A
687
L
H
HE22
GLN
V
419
R
-
CB
ARG
A
687
L
H
NE2
GLN
V
419
R
-
CB
ARG
A
687
L
H
HE22
GLN
V
419
R
-
CG
ARG
A
687
L
H
NE2
GLN
V
419
R
-
CG
ARG
A
687
L
H
HE22
GLN
V
419
R
-
CD
ARG
A
687
L
H
HE22
GLN
V
419