O00299etQ99650_P00533vIIIJ.1
compound to ligand contacts only (residues)
Receptor
R: Residue
R: Chain
R: Residue number
Ligand
L: Residue
L: Chain
L: Residue Number
R
GLU
H
160
L
HIS
G
895
R
GLU
H
160
L
ILE
G
897
R
GLY
H
161
L
GLN
G
896
R
GLY
H
161
L
ILE
G
897
R
LYS
H
184
L
LYS
G
892
R
SER
H
202
L
HIS
G
895
R
SER
H
202
L
GLN
G
896
R
PRO
H
204
L
HIS
G
895
R
VAL
H
236
L
ILE
G
897
R
PHE
H
281
L
GLY
G
941
R
PHE
H
281
L
ALA
G
942
R
GLN
H
303
L
ALA
G
942
R
ARG
H
317
L
SER
G
898
R
ARG
H
319
L
LEU
G
899
R
ASN
H
348
L
ASN
G
371
R
PHE
H
390
L
ASN
G
371
R
PHE
H
390
L
LYS
G
374
R
SER
H
392
L
ASN
G
371
R
GLU
H
393
L
TYR
G
358
R
GLU
H
393
L
PRO
G
369
R
GLU
H
395
L
THR
G
361
R
SER
H
431
L
GLY
G
362
R
SER
H
431
L
PRO
G
363
R
SER
H
431
L
GLU
G
366
R
GLU
H
432
L
PRO
G
363
R
SER
H
457
L
ALA
G
345
R
LEU
H
459
L
ALA
G
343
R
LEU
H
459
L
THR
G
361
R
HIS
H
460
L
TYR
G
342
R
HIS
H
460
L
ASP
G
344
R
HIS
H
460
L
THR
G
361
R
HIS
H
460
L
GLY
G
362
R
HIS
H
460
L
PRO
G
363
R
ASN
H
862
L
ALA
G
298
R
ASN
H
862
L
MET
G
299
R
GLN
H
863
L
MET
G
299
R
ALA
H
864
L
ALA
G
298
R
ALA
H
864
L
MET
G
299
R
ALA
H
864
L
ASN
G
300
R
ALA
H
865
L
LEU
G
274
R
ALA
H
865
L
GLU
G
275
R
ALA
H
865
L
MET
G
299
R
ALA
H
865
L
ASN
G
300
R
SER
H
866
L
LEU
G
274
R
SER
H
866
L
MET
G
299
R
MET
H
883
L
GLN
G
8
R
LEU
H
884
L
ASP
G
309
R
LEU
H
884
L
HIS
G
322
R
LEU
H
884
L
THR
G
6
R
LEU
H
884
L
GLN
G
8
R
GLY
H
885
L
HIS
G
322
R
GLY
H
885
L
TYR
G
7
R
GLY
H
885
L
GLN
G
8
R
GLY
H
885
L
MET
G
9
R
LEU
H
886
L
HIS
G
322
R
LEU
H
886
L
TYR
G
7
R
LEU
H
886
L
GLN
G
8
R
LEU
H
886
L
MET
G
9
R
MET
H
887
L
ASP
G
319
R
MET
H
887
L
HIS
G
322
R
MET
H
887
L
VAL
G
324
R
MET
H
887
L
PRO
G
328
R
MET
H
887
L
LYS
G
341
R
MET
H
887
L
TYR
G
7
R
THR
H
888
L
PRO
G
308
R
THR
H
888
L
VAL
G
324
R
SER
H
889
L
VAL
G
324
R
SER
H
889
L
LYS
G
325
R
SER
H
889
L
THR
G
326
R
PRO
H
890
L
VAL
G
331
R
GLU
H
891
L
LYS
G
325
R
LYS
H
899
L
ARG
G
718
R
ASN
H
900
L
ARG
G
718
R
TYR
H
901
L
ARG
G
718
R
THR
H
961
L
THR
G
178
R
THR
H
961
L
ARG
G
226
R
THR
H
961
L
GLN
G
236
R
GLU
H
962
L
ARG
G
226
R
GLU
H
962
L
THR
G
234
R
ASN
H
963
L
SER
G
230
R
SER
H
964
L
ARG
G
226
R
SER
H
964
L
GLY
G
227
R
LEU
H
966
L
LYS
G
199
R
SER
H
967
L
SER
G
224
R
SER
H
968
L
ILE
G
223
R
SER
H
968
L
SER
G
224
R
ILE
H
969
L
ILE
G
223
R
ILE
H
969
L
SER
G
224
R
THR
H
970
L
LYS
G
221
R
THR
H
970
L
ILE
G
223
R
LEU
H
971
L
LYS
G
221
R
LEU
H
972
L
GLN
G
167
R
LEU
H
972
L
LYS
G
221
R
ASP
H
973
L
GLN
G
167
R
ASP
H
973
L
ASP
G
192
R
PRO
H
974
L
GLY
G
166
R
PRO
H
974
L
GLN
G
167
R
GLY
H
975
L
GLN
G
167
R
GLU
H
976
L
THR
G
215
R
GLU
H
976
L
SER
G
216
R
HIS
H
977
L
LYS
G
163
R
HIS
H
977
L
ASP
G
190
R
TYR
H
978
L
THR
G
215
- Title of columns started by 'R:' means Receptor, 'L:' means Ligand
O00299etQ99650_P00533vIIIJ.1
compound to ligand contacts only (residues & atoms)
Receptor
R: Atom
R: Residue
R: Chain
R: Residue number
Ligand
L: Atom
L: Residue
L: Chain
L: Residue Number
R
C
GLU
H
160
L
HD12
ILE
G
897
R
C
GLU
H
160
L
HD13
ILE
G
897
R
O
GLU
H
160
L
CD1
ILE
G
897
R
O
GLU
H
160
L
HB
ILE
G
897
R
O
GLU
H
160
L
HG21
ILE
G
897
R
O
GLU
H
160
L
HD11
ILE
G
897
R
O
GLU
H
160
L
HD12
ILE
G
897
R
O
GLU
H
160
L
HD13
ILE
G
897
R
CG
GLU
H
160
L
HD12
ILE
G
897
R
OE1
GLU
H
160
L
HE1
HIS
G
895
R
N
GLY
H
161
L
HD12
ILE
G
897
R
CA
GLY
H
161
L
O
GLN
G
896
R
CA
GLY
H
161
L
HB
ILE
G
897
R
CA
GLY
H
161
L
HD12
ILE
G
897
R
C
GLY
H
161
L
O
GLN
G
896
R
C
GLY
H
161
L
HB
ILE
G
897
R
O
GLY
H
161
L
O
GLN
G
896
R
O
GLY
H
161
L
HB
ILE
G
897
R
CE
LYS
H
184
L
HZ2
LYS
G
892
R
NZ
LYS
H
184
L
HD2
LYS
G
892
R
NZ
LYS
H
184
L
HZ2
LYS
G
892
R
CA
SER
H
202
L
HB2
HIS
G
895
R
C
SER
H
202
L
HB2
HIS
G
895
R
CB
SER
H
202
L
C
HIS
G
895
R
CB
SER
H
202
L
O
HIS
G
895
R
CB
SER
H
202
L
CB
HIS
G
895
R
CB
SER
H
202
L
HB2
HIS
G
895
R
CB
SER
H
202
L
HB3
HIS
G
895
R
CB
SER
H
202
L
O
GLN
G
896
R
O
SER
H
202
L
CB
HIS
G
895
R
O
SER
H
202
L
CG
HIS
G
895
R
O
SER
H
202
L
CD2
HIS
G
895
R
O
SER
H
202
L
HB2
HIS
G
895
R
O
SER
H
202
L
HB3
HIS
G
895
R
O
SER
H
202
L
HD2
HIS
G
895
R
OG
SER
H
202
L
C
HIS
G
895
R
OG
SER
H
202
L
O
HIS
G
895
R
OG
SER
H
202
L
HB2
HIS
G
895
R
OG
SER
H
202
L
O
GLN
G
896
R
CB
PRO
H
204
L
CD2
HIS
G
895
R
CB
PRO
H
204
L
CE1
HIS
G
895
R
CB
PRO
H
204
L
NE2
HIS
G
895
R
CB
PRO
H
204
L
HD2
HIS
G
895
R
CB
PRO
H
204
L
HE1
HIS
G
895
R
CB
PRO
H
204
L
HE2
HIS
G
895
R
CG
PRO
H
204
L
NE2
HIS
G
895
R
CG
PRO
H
204
L
HE2
HIS
G
895
R
CG2
VAL
H
236
L
CD1
ILE
G
897
R
CG2
VAL
H
236
L
HD11
ILE
G
897
R
CG2
VAL
H
236
L
HD12
ILE
G
897
R
CG2
VAL
H
236
L
HD13
ILE
G
897
R
CG
PHE
H
281
L
HA
ALA
G
942
R
CD1
PHE
H
281
L
CA
ALA
G
942
R
CD1
PHE
H
281
L
HA
ALA
G
942
R
CE1
PHE
H
281
L
C
GLY
G
941
R
CE1
PHE
H
281
L
O
GLY
G
941
R
CE1
PHE
H
281
L
HA3
GLY
G
941
R
CE1
PHE
H
281
L
N
ALA
G
942
R
CE1
PHE
H
281
L
CA
ALA
G
942
R
CE1
PHE
H
281
L
OXT
ALA
G
942
R
CE1
PHE
H
281
L
HA
ALA
G
942
R
CZ
PHE
H
281
L
HA3
GLY
G
941
R
CZ
PHE
H
281
L
OXT
ALA
G
942
R
CZ
PHE
H
281
L
HA
ALA
G
942
R
OE1
GLN
H
303
L
OXT
ALA
G
942
R
NH2
ARG
H
317
L
HG
SER
G
898
R
NH2
ARG
H
319
L
HD13
LEU
G
899
R
CB
ASN
H
348
L
HD21
ASN
G
371
R
CG
ASN
H
348
L
ND2
ASN
G
371
R
CG
ASN
H
348
L
HD21
ASN
G
371
R
CG
ASN
H
348
L
HD22
ASN
G
371
R
ND2
ASN
H
348
L
ND2
ASN
G
371
R
ND2
ASN
H
348
L
HD21
ASN
G
371
R
ND2
ASN
H
348
L
HD22
ASN
G
371
R
CB
PHE
H
390
L
HD2
LYS
G
374
R
CG
PHE
H
390
L
HD2
LYS
G
374
R
CD1
PHE
H
390
L
H
LYS
G
374
R
CD1
PHE
H
390
L
HG2
LYS
G
374
R
CD1
PHE
H
390
L
HD2
LYS
G
374
R
CD2
PHE
H
390
L
HD2
LYS
G
374
R
CD2
PHE
H
390
L
HZ3
LYS
G
374
R
CE1
PHE
H
390
L
ND2
ASN
G
371
R
CE1
PHE
H
390
L
HB3
ASN
G
371
R
CE1
PHE
H
390
L
HD21
ASN
G
371
R
CE1
PHE
H
390
L
HG2
LYS
G
374
R
CE1
PHE
H
390
L
HD2
LYS
G
374
R
CE1
PHE
H
390
L
HE3
LYS
G
374
R
CE2
PHE
H
390
L
NZ
LYS
G
374
R
CE2
PHE
H
390
L
HD2
LYS
G
374
R
CE2
PHE
H
390
L
HE3
LYS
G
374
R
CE2
PHE
H
390
L
HZ1
LYS
G
374
R
CE2
PHE
H
390
L
HZ3
LYS
G
374
R
CZ
PHE
H
390
L
CG
ASN
G
371
R
CZ
PHE
H
390
L
ND2
ASN
G
371
R
CZ
PHE
H
390
L
HB3
ASN
G
371
R
CZ
PHE
H
390
L
HD21
ASN
G
371
R
CZ
PHE
H
390
L
HD22
ASN
G
371
R
CZ
PHE
H
390
L
HD2
LYS
G
374
R
CZ
PHE
H
390
L
HE3
LYS
G
374
R
CZ
PHE
H
390
L
HZ3
LYS
G
374
R
CB
SER
H
392
L
HB2
ASN
G
371
R
CB
SER
H
392
L
HB3
ASN
G
371
R
CA
GLU
H
393
L
HB2
PRO
G
369
R
CA
GLU
H
393
L
HB3
PRO
G
369
R
CB
GLU
H
393
L
HB2
PRO
G
369
R
CB
GLU
H
393
L
HB3
PRO
G
369
R
CG
GLU
H
393
L
CB
PRO
G
369
R
CG
GLU
H
393
L
HB2
PRO
G
369
R
CG
GLU
H
393
L
HB3
PRO
G
369
R
CG
GLU
H
393
L
HG3
PRO
G
369
R
CD
GLU
H
393
L
HB2
PRO
G
369
R
CD
GLU
H
393
L
HG3
PRO
G
369
R
OE1
GLU
H
393
L
HB3
TYR
G
358
R
OE1
GLU
H
393
L
HB2
PRO
G
369
R
OE2
GLU
H
393
L
HG3
PRO
G
369
R
CG
GLU
H
395
L
CG2
THR
G
361
R
CG
GLU
H
395
L
HG21
THR
G
361
R
CG
GLU
H
395
L
HG22
THR
G
361
R
CD
GLU
H
395
L
HG21
THR
G
361
R
CD
GLU
H
395
L
HG22
THR
G
361
R
OE1
GLU
H
395
L
HG21
THR
G
361
R
OE1
GLU
H
395
L
HG22
THR
G
361
R
CA
SER
H
431
L
OE2
GLU
G
366
R
C
SER
H
431
L
OE2
GLU
G
366
R
CB
SER
H
431
L
OE2
GLU
G
366
R
CB
SER
H
431
L
HB2
GLU
G
366
R
CB
SER
H
431
L
HB3
GLU
G
366
R
O
SER
H
431
L
HG2
PRO
G
363
R
O
SER
H
431
L
OE2
GLU
G
366
R
OG
SER
H
431
L
HA3
GLY
G
362
R
OG
SER
H
431
L
HD3
PRO
G
363
R
CA
GLU
H
432
L
HG2
PRO
G
363
R
CB
GLU
H
432
L
CG
PRO
G
363
R
CB
GLU
H
432
L
HG2
PRO
G
363
R
CB
GLU
H
432
L
HG3
PRO
G
363
R
CG
GLU
H
432
L
CG
PRO
G
363
R
CG
GLU
H
432
L
HG2
PRO
G
363
R
CG
GLU
H
432
L
HG3
PRO
G
363
R
CD
GLU
H
432
L
CG
PRO
G
363
R
CD
GLU
H
432
L
HG2
PRO
G
363
R
CD
GLU
H
432
L
HG3
PRO
G
363
R
OE1
GLU
H
432
L
HG3
PRO
G
363
R
OE2
GLU
H
432
L
CG
PRO
G
363
R
OE2
GLU
H
432
L
HG3
PRO
G
363
R
OE2
GLU
H
432
L
HD2
PRO
G
363
R
N
SER
H
457
L
HB3
ALA
G
345
R
CA
SER
H
457
L
CB
ALA
G
345
R
CA
SER
H
457
L
HB1
ALA
G
345
R
CA
SER
H
457
L
HB2
ALA
G
345
R
CA
SER
H
457
L
HB3
ALA
G
345
R
C
SER
H
457
L
HB3
ALA
G
345
R
CB
SER
H
457
L
N
ALA
G
345
R
CB
SER
H
457
L
CA
ALA
G
345
R
CB
SER
H
457
L
CB
ALA
G
345
R
CB
SER
H
457
L
H
ALA
G
345
R
CB
SER
H
457
L
HA
ALA
G
345
R
CB
SER
H
457
L
HB1
ALA
G
345
R
CB
SER
H
457
L
HB2
ALA
G
345
R
CB
SER
H
457
L
HB3
ALA
G
345
R
OG
SER
H
457
L
N
ALA
G
345
R
OG
SER
H
457
L
CB
ALA
G
345
R
OG
SER
H
457
L
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G
345
R
OG
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H
457
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G
345
R
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H
457
L
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345
R
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H
459
L
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G
361
R
O
LEU
H
459
L
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G
361
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CD1
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H
459
L
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G
343
R
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459
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343
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459
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343
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460
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363
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460
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363
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460
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342
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460
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G
361
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460
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G
362
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460
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362
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460
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362
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460
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363
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460
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363
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460
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363
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460
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342
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460
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363
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H
460
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G
363
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H
460
L
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G
342
R
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H
460
L
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342
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460
L
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344
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460
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344
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460
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362
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460
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363
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460
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363
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460
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363
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460
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363
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460
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342
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460
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342
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460
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342
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460
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342
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460
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344
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460
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362
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460
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362
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363
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363
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363
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298
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298
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298
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862
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G
299
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862
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299
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862
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298
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862
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298
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862
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298
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298
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298
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298
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298
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298
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298
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862
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G
299
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G
299
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862
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G
299
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862
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298
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L
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298
R
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863
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G
299
R
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863
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G
299
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H
863
L
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G
299
R
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H
863
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G
299
R
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863
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G
299
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863
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299
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863
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299
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863
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G
299
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863
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G
299
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863
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299
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863
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299
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863
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G
299
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863
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299
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863
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G
299
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863
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299
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H
863
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G
299
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863
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G
299
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863
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G
299
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863
L
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G
299
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H
863
L
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MET
G
299
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H
863
L
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G
299
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H
863
L
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G
299
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H
863
L
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G
299
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H
863
L
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G
299
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H
863
L
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G
299
R
N
ALA
H
864
L
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G
298
R
N
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H
864
L
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MET
G
299
R
N
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H
864
L
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G
299
R
N
ALA
H
864
L
CG
MET
G
299
R
N
ALA
H
864
L
HB2
MET
G
299
R
N
ALA
H
864
L
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MET
G
299
R
N
ALA
H
864
L
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MET
G
299
R
N
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H
864
L
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MET
G
299
R
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H
864
L
O
ALA
G
298
R
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ALA
H
864
L
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G
299
R
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H
864
L
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G
299
R
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H
864
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G
299
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864
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G
299
R
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H
864
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G
299
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H
864
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G
299
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H
864
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G
299
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864
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G
299
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H
864
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G
299
R
C
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H
864
L
C
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G
298
R
C
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H
864
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G
298
R
C
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H
864
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N
MET
G
299
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H
864
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G
299
R
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ALA
H
864
L
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MET
G
299
R
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H
864
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G
299
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H
864
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G
299
R
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H
864
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G
299
R
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H
864
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G
299
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864
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G
299
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864
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G
299
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H
864
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MET
G
299
R
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H
864
L
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MET
G
299
R
C
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H
864
L
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MET
G
299
R
C
ALA
H
864
L
N
ASN
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300
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CB
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H
864
L
O
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G
298
R
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ALA
H
864
L
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G
299
R
CB
ALA
H
864
L
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MET
G
299
R
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ALA
H
864
L
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MET
G
299
R
O
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H
864
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C
ALA
G
298
R
O
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H
864
L
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G
298
R
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H
864
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N
MET
G
299
R
O
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H
864
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MET
G
299
R
O
ALA
H
864
L
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MET
G
299
R
O
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H
864
L
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MET
G
299
R
O
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H
864
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MET
G
299
R
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H
864
L
CG
MET
G
299
R
O
ALA
H
864
L
H
MET
G
299
R
O
ALA
H
864
L
HA
MET
G
299
R
O
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H
864
L
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MET
G
299
R
O
ALA
H
864
L
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MET
G
299
R
O
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H
864
L
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MET
G
299
R
O
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H
864
L
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MET
G
299
R
O
ALA
H
864
L
N
ASN
G
300
R
O
ALA
H
864
L
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ASN
G
300
R
O
ALA
H
864
L
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ASN
G
300
R
O
ALA
H
864
L
H
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G
300
R
O
ALA
H
864
L
HA
ASN
G
300
R
O
ALA
H
864
L
HB2
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G
300
R
N
ALA
H
865
L
N
MET
G
299
R
N
ALA
H
865
L
CA
MET
G
299
R
N
ALA
H
865
L
C
MET
G
299
R
N
ALA
H
865
L
O
MET
G
299
R
N
ALA
H
865
L
CB
MET
G
299
R
N
ALA
H
865
L
CG
MET
G
299
R
N
ALA
H
865
L
SD
MET
G
299
R
N
ALA
H
865
L
CE
MET
G
299
R
N
ALA
H
865
L
HA
MET
G
299
R
N
ALA
H
865
L
HB2
MET
G
299
R
N
ALA
H
865
L
HB3
MET
G
299
R
N
ALA
H
865
L
HG2
MET
G
299
R
N
ALA
H
865
L
HG3
MET
G
299
R
N
ALA
H
865
L
HE1
MET
G
299
R
N
ALA
H
865
L
HE2
MET
G
299
R
N
ALA
H
865
L
HE3
MET
G
299
R
CA
ALA
H
865
L
CD1
LEU
G
274
R
CA
ALA
H
865
L
HB2
LEU
G
274
R
CA
ALA
H
865
L
HD13
LEU
G
274
R
CA
ALA
H
865
L
HD22
LEU
G
274
R
CA
ALA
H
865
L
CA
MET
G
299
R
CA
ALA
H
865
L
C
MET
G
299
R
CA
ALA
H
865
L
O
MET
G
299
R
CA
ALA
H
865
L
CB
MET
G
299
R
CA
ALA
H
865
L
CG
MET
G
299
R
CA
ALA
H
865
L
SD
MET
G
299
R
CA
ALA
H
865
L
CE
MET
G
299
R
CA
ALA
H
865
L
HA
MET
G
299
R
CA
ALA
H
865
L
HB2
MET
G
299
R
CA
ALA
H
865
L
HB3
MET
G
299
R
CA
ALA
H
865
L
HG2
MET
G
299
R
CA
ALA
H
865
L
HE1
MET
G
299
R
CA
ALA
H
865
L
HE2
MET
G
299
R
CA
ALA
H
865
L
HE3
MET
G
299
R
C
ALA
H
865
L
CD1
LEU
G
274
R
C
ALA
H
865
L
HD13
LEU
G
274
R
C
ALA
H
865
L
O
MET
G
299
R
C
ALA
H
865
L
CB
MET
G
299
R
C
ALA
H
865
L
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MET
G
299
R
C
ALA
H
865
L
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MET
G
299
R
C
ALA
H
865
L
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MET
G
299
R
C
ALA
H
865
L
HE2
MET
G
299
R
C
ALA
H
865
L
HE3
MET
G
299
R
CB
ALA
H
865
L
CB
LEU
G
274
R
CB
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H
865
L
CG
LEU
G
274
R
CB
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H
865
L
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G
274
R
CB
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H
865
L
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G
274
R
CB
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H
865
L
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G
274
R
CB
ALA
H
865
L
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G
274
R
CB
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H
865
L
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G
274
R
CB
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H
865
L
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G
274
R
CB
ALA
H
865
L
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G
275
R
CB
ALA
H
865
L
N
MET
G
299
R
CB
ALA
H
865
L
CA
MET
G
299
R
CB
ALA
H
865
L
C
MET
G
299
R
CB
ALA
H
865
L
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MET
G
299
R
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H
865
L
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MET
G
299
R
CB
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H
865
L
CG
MET
G
299
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CB
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H
865
L
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MET
G
299
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H
865
L
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MET
G
299
R
CB
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H
865
L
H
MET
G
299
R
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H
865
L
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MET
G
299
R
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H
865
L
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MET
G
299
R
CB
ALA
H
865
L
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MET
G
299
R
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H
865
L
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MET
G
299
R
CB
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H
865
L
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MET
G
299
R
CB
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H
865
L
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MET
G
299
R
CB
ALA
H
865
L
N
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G
300
R
O
ALA
H
865
L
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G
274
R
O
ALA
H
865
L
HD13
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G
274
R
O
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H
865
L
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MET
G
299
R
O
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H
865
L
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MET
G
299
R
O
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H
865
L
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MET
G
299
R
O
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H
865
L
HE2
MET
G
299
R
O
ALA
H
865
L
HE3
MET
G
299
R
N
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H
866
L
HD13
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G
274
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N
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H
866
L
O
MET
G
299
R
N
SER
H
866
L
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MET
G
299
R
N
SER
H
866
L
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MET
G
299
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C
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H
866
L
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G
274
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SER
H
866
L
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G
274
R
O
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H
866
L
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G
274
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H
883
L
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G
8
R
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883
L
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G
8
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C
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883
L
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8
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L
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8
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L
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8
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L
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G
8
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N
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884
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8
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884
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8
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884
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8
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884
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8
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884
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8
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884
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8
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884
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884
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8
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884
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884
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8
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884
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8
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884
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884
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8
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884
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8
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884
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G
8
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884
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G
8
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884
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322
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884
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8
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884
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8
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884
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8
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884
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8
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884
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8
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884
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8
R
CB
LEU
H
884
L
HE21
GLN
G
8
R
CB
LEU
H
884
L
HE22
GLN
G
8
R
O
LEU
H
884
L
NE2
GLN
G
8
R
O
LEU
H
884
L
HE21
GLN
G
8
R
O
LEU
H
884
L
OD2
ASP
G
309
R
O
LEU
H
884
L
HE1
HIS
G
322
R
CG
LEU
H
884
L
CG
GLN
G
8
R
CG
LEU
H
884
L
CD
GLN
G
8
R
CG
LEU
H
884
L
OE1
GLN
G
8
R
CG
LEU
H
884
L
NE2
GLN
G
8
R
CG
LEU
H
884
L
HG2
GLN
G
8
R
CG
LEU
H
884
L
HG3
GLN
G
8
R
CG
LEU
H
884
L
HE21
GLN
G
8
R
CG
LEU
H
884
L
HE22
GLN
G
8
R
CD1
LEU
H
884
L
CG
GLN
G
8
R
CD1
LEU
H
884
L
CD
GLN
G
8
R
CD1
LEU
H
884
L
OE1
GLN
G
8
R
CD1
LEU
H
884
L
NE2
GLN
G
8
R
CD1
LEU
H
884
L
HG3
GLN
G
8
R
CD1
LEU
H
884
L
HE21
GLN
G
8
R
CD1
LEU
H
884
L
HE22
GLN
G
8
R
CD2
LEU
H
884
L
HG23
THR
G
6
R
CD2
LEU
H
884
L
CG
GLN
G
8
R
CD2
LEU
H
884
L
CD
GLN
G
8
R
CD2
LEU
H
884
L
OE1
GLN
G
8
R
CD2
LEU
H
884
L
NE2
GLN
G
8
R
CD2
LEU
H
884
L
HG2
GLN
G
8
R
CD2
LEU
H
884
L
HG3
GLN
G
8
R
CD2
LEU
H
884
L
HE21
GLN
G
8
R
CD2
LEU
H
884
L
HE22
GLN
G
8
R
N
GLY
H
885
L
CG
GLN
G
8
R
N
GLY
H
885
L
CD
GLN
G
8
R
N
GLY
H
885
L
NE2
GLN
G
8
R
N
GLY
H
885
L
HG2
GLN
G
8
R
N
GLY
H
885
L
HE21
GLN
G
8
R
N
GLY
H
885
L
HE1
HIS
G
322
R
CA
GLY
H
885
L
CB
GLN
G
8
R
CA
GLY
H
885
L
CG
GLN
G
8
R
CA
GLY
H
885
L
CD
GLN
G
8
R
CA
GLY
H
885
L
NE2
GLN
G
8
R
CA
GLY
H
885
L
HA
GLN
G
8
R
CA
GLY
H
885
L
HB3
GLN
G
8
R
CA
GLY
H
885
L
HG2
GLN
G
8
R
CA
GLY
H
885
L
HG3
GLN
G
8
R
CA
GLY
H
885
L
HE21
GLN
G
8
R
CA
GLY
H
885
L
H
MET
G
9
R
C
GLY
H
885
L
O
TYR
G
7
R
C
GLY
H
885
L
CA
GLN
G
8
R
C
GLY
H
885
L
CB
GLN
G
8
R
C
GLY
H
885
L
CG
GLN
G
8
R
C
GLY
H
885
L
HA
GLN
G
8
R
C
GLY
H
885
L
HB3
GLN
G
8
R
C
GLY
H
885
L
HG2
GLN
G
8
R
C
GLY
H
885
L
HG3
GLN
G
8
R
C
GLY
H
885
L
HE21
GLN
G
8
R
C
GLY
H
885
L
N
MET
G
9
R
C
GLY
H
885
L
H
MET
G
9
R
C
GLY
H
885
L
CE1
HIS
G
322
R
C
GLY
H
885
L
NE2
HIS
G
322
R
C
GLY
H
885
L
HE1
HIS
G
322
R
O
GLY
H
885
L
C
TYR
G
7
R
O
GLY
H
885
L
O
TYR
G
7
R
O
GLY
H
885
L
N
GLN
G
8
R
O
GLY
H
885
L
CA
GLN
G
8
R
O
GLY
H
885
L
C
GLN
G
8
R
O
GLY
H
885
L
CB
GLN
G
8
R
O
GLY
H
885
L
CG
GLN
G
8
R
O
GLY
H
885
L
CD
GLN
G
8
R
O
GLY
H
885
L
H
GLN
G
8
R
O
GLY
H
885
L
HA
GLN
G
8
R
O
GLY
H
885
L
HB2
GLN
G
8
R
O
GLY
H
885
L
HB3
GLN
G
8
R
O
GLY
H
885
L
HG2
GLN
G
8
R
O
GLY
H
885
L
HG3
GLN
G
8
R
O
GLY
H
885
L
HE21
GLN
G
8
R
O
GLY
H
885
L
N
MET
G
9
R
O
GLY
H
885
L
H
MET
G
9
R
O
GLY
H
885
L
CE1
HIS
G
322
R
O
GLY
H
885
L
NE2
HIS
G
322
R
O
GLY
H
885
L
HE1
HIS
G
322
R
N
LEU
H
886
L
HA
GLN
G
8
R
N
LEU
H
886
L
HG2
GLN
G
8
R
N
LEU
H
886
L
H
MET
G
9
R
N
LEU
H
886
L
CE1
HIS
G
322
R
N
LEU
H
886
L
NE2
HIS
G
322
R
N
LEU
H
886
L
HE1
HIS
G
322
R
CA
LEU
H
886
L
O
TYR
G
7
R
CA
LEU
H
886
L
HA
GLN
G
8
R
CA
LEU
H
886
L
H
MET
G
9
R
CA
LEU
H
886
L
HG3
MET
G
9
R
C
LEU
H
886
L
C
TYR
G
7
R
C
LEU
H
886
L
O
TYR
G
7
R
C
LEU
H
886
L
HA
GLN
G
8
R
C
LEU
H
886
L
H
MET
G
9
R
C
LEU
H
886
L
HG3
MET
G
9
R
C
LEU
H
886
L
CD2
HIS
G
322
R
C
LEU
H
886
L
CE1
HIS
G
322
R
C
LEU
H
886
L
NE2
HIS
G
322
R
C
LEU
H
886
L
HD2
HIS
G
322
R
CB
LEU
H
886
L
HA
GLN
G
8
R
CB
LEU
H
886
L
N
MET
G
9
R
CB
LEU
H
886
L
CA
MET
G
9
R
CB
LEU
H
886
L
CB
MET
G
9
R
CB
LEU
H
886
L
CG
MET
G
9
R
CB
LEU
H
886
L
SD
MET
G
9
R
CB
LEU
H
886
L
H
MET
G
9
R
CB
LEU
H
886
L
HB2
MET
G
9
R
CB
LEU
H
886
L
HG2
MET
G
9
R
CB
LEU
H
886
L
HG3
MET
G
9
R
CB
LEU
H
886
L
HE2
MET
G
9
R
O
LEU
H
886
L
C
TYR
G
7
R
O
LEU
H
886
L
O
TYR
G
7
R
O
LEU
H
886
L
HB3
TYR
G
7
R
O
LEU
H
886
L
N
GLN
G
8
R
O
LEU
H
886
L
CA
GLN
G
8
R
O
LEU
H
886
L
C
GLN
G
8
R
O
LEU
H
886
L
HA
GLN
G
8
R
O
LEU
H
886
L
H
MET
G
9
R
O
LEU
H
886
L
CD2
HIS
G
322
R
O
LEU
H
886
L
NE2
HIS
G
322
R
O
LEU
H
886
L
HD2
HIS
G
322
R
CG
LEU
H
886
L
CB
MET
G
9
R
CG
LEU
H
886
L
CG
MET
G
9
R
CG
LEU
H
886
L
SD
MET
G
9
R
CG
LEU
H
886
L
CE
MET
G
9
R
CG
LEU
H
886
L
H
MET
G
9
R
CG
LEU
H
886
L
HB2
MET
G
9
R
CG
LEU
H
886
L
HG2
MET
G
9
R
CG
LEU
H
886
L
HG3
MET
G
9
R
CG
LEU
H
886
L
HE1
MET
G
9
R
CG
LEU
H
886
L
HE2
MET
G
9
R
CG
LEU
H
886
L
HE3
MET
G
9
R
CD1
LEU
H
886
L
CB
MET
G
9
R
CD1
LEU
H
886
L
CG
MET
G
9
R
CD1
LEU
H
886
L
SD
MET
G
9
R
CD1
LEU
H
886
L
H
MET
G
9
R
CD1
LEU
H
886
L
HB2
MET
G
9
R
CD1
LEU
H
886
L
HG3
MET
G
9
R
CD1
LEU
H
886
L
HE2
MET
G
9
R
CD2
LEU
H
886
L
CA
MET
G
9
R
CD2
LEU
H
886
L
CB
MET
G
9
R
CD2
LEU
H
886
L
CG
MET
G
9
R
CD2
LEU
H
886
L
SD
MET
G
9
R
CD2
LEU
H
886
L
CE
MET
G
9
R
CD2
LEU
H
886
L
H
MET
G
9
R
CD2
LEU
H
886
L
HB2
MET
G
9
R
CD2
LEU
H
886
L
HB3
MET
G
9
R
CD2
LEU
H
886
L
HG2
MET
G
9
R
CD2
LEU
H
886
L
HG3
MET
G
9
R
CD2
LEU
H
886
L
HE1
MET
G
9
R
CD2
LEU
H
886
L
HE2
MET
G
9
R
CD2
LEU
H
886
L
HE3
MET
G
9
R
N
MET
H
887
L
O
TYR
G
7
R
N
MET
H
887
L
CG
HIS
G
322
R
N
MET
H
887
L
CD2
HIS
G
322
R
N
MET
H
887
L
NE2
HIS
G
322
R
N
MET
H
887
L
HD2
HIS
G
322
R
CA
MET
H
887
L
HD2
HIS
G
322
R
CA
MET
H
887
L
HG12
VAL
G
324
R
C
MET
H
887
L
CG1
VAL
G
324
R
C
MET
H
887
L
HG11
VAL
G
324
R
C
MET
H
887
L
HG12
VAL
G
324
R
CB
MET
H
887
L
HB3
TYR
G
7
R
CB
MET
H
887
L
OD2
ASP
G
319
R
CB
MET
H
887
L
HB3
ASP
G
319
R
CB
MET
H
887
L
CD2
HIS
G
322
R
CB
MET
H
887
L
HB2
HIS
G
322
R
CB
MET
H
887
L
HD2
HIS
G
322
R
CB
MET
H
887
L
HG12
VAL
G
324
R
O
MET
H
887
L
HB2
HIS
G
322
R
O
MET
H
887
L
HB3
HIS
G
322
R
O
MET
H
887
L
CB
VAL
G
324
R
O
MET
H
887
L
CG1
VAL
G
324
R
O
MET
H
887
L
HB
VAL
G
324
R
O
MET
H
887
L
HG11
VAL
G
324
R
O
MET
H
887
L
HG12
VAL
G
324
R
O
MET
H
887
L
HG13
VAL
G
324
R
CG
MET
H
887
L
O
TYR
G
7
R
CG
MET
H
887
L
HB3
TYR
G
7
R
CG
MET
H
887
L
HD1
TYR
G
7
R
CG
MET
H
887
L
OD2
ASP
G
319
R
CG
MET
H
887
L
HD2
HIS
G
322
R
SD
MET
H
887
L
HD1
TYR
G
7
R
SD
MET
H
887
L
CG
ASP
G
319
R
SD
MET
H
887
L
OD2
ASP
G
319
R
SD
MET
H
887
L
CG
PRO
G
328
R
SD
MET
H
887
L
HG2
PRO
G
328
R
SD
MET
H
887
L
HG3
PRO
G
328
R
SD
MET
H
887
L
NZ
LYS
G
341
R
SD
MET
H
887
L
HZ3
LYS
G
341
R
CE
MET
H
887
L
HA
TYR
G
7
R
CE
MET
H
887
L
HD1
TYR
G
7
R
CE
MET
H
887
L
HZ3
LYS
G
341
R
N
THR
H
888
L
HG11
VAL
G
324
R
CA
THR
H
888
L
HG11
VAL
G
324
R
CG2
THR
H
888
L
HG3
PRO
G
308
R
N
SER
H
889
L
HB
VAL
G
324
R
CA
SER
H
889
L
HG1
THR
G
326
R
CB
SER
H
889
L
HB
VAL
G
324
R
CB
SER
H
889
L
H
LYS
G
325
R
CB
SER
H
889
L
HB2
LYS
G
325
R
CB
SER
H
889
L
O
THR
G
326
R
CB
SER
H
889
L
OG1
THR
G
326
R
CB
SER
H
889
L
H
THR
G
326
R
CB
SER
H
889
L
HG1
THR
G
326
R
OG
SER
H
889
L
HB2
LYS
G
325
R
OG
SER
H
889
L
O
THR
G
326
R
OG
SER
H
889
L
CB
THR
G
326
R
OG
SER
H
889
L
OG1
THR
G
326
R
OG
SER
H
889
L
H
THR
G
326
R
OG
SER
H
889
L
HG1
THR
G
326
R
CB
PRO
H
890
L
HG23
VAL
G
331
R
CG
PRO
H
890
L
HG23
VAL
G
331
R
CD
PRO
H
890
L
HG23
VAL
G
331
R
CD
GLU
H
891
L
HD2
LYS
G
325
R
CD
GLU
H
891
L
HZ3
LYS
G
325
R
OE1
GLU
H
891
L
HZ3
LYS
G
325
R
OE2
GLU
H
891
L
NZ
LYS
G
325
R
OE2
GLU
H
891
L
HD2
LYS
G
325
R
OE2
GLU
H
891
L
HZ3
LYS
G
325
R
CG
LYS
H
899
L
HH21
ARG
G
718
R
CA
ASN
H
900
L
HH12
ARG
G
718
R
CA
ASN
H
900
L
HH22
ARG
G
718
R
C
ASN
H
900
L
NH1
ARG
G
718
R
C
ASN
H
900
L
HH12
ARG
G
718
R
CB
ASN
H
900
L
CZ
ARG
G
718
R
CB
ASN
H
900
L
NH1
ARG
G
718
R
CB
ASN
H
900
L
NH2
ARG
G
718
R
CB
ASN
H
900
L
HH11
ARG
G
718
R
CB
ASN
H
900
L
HH12
ARG
G
718
R
CB
ASN
H
900
L
HH22
ARG
G
718
R
O
ASN
H
900
L
NH1
ARG
G
718
R
O
ASN
H
900
L
HH11
ARG
G
718
R
O
ASN
H
900
L
HH12
ARG
G
718
R
CG
ASN
H
900
L
NH2
ARG
G
718
R
CG
ASN
H
900
L
HH12
ARG
G
718
R
CG
ASN
H
900
L
HH22
ARG
G
718
R
ND2
ASN
H
900
L
CZ
ARG
G
718
R
ND2
ASN
H
900
L
NH2
ARG
G
718
R
ND2
ASN
H
900
L
HH12
ARG
G
718
R
ND2
ASN
H
900
L
HH21
ARG
G
718
R
ND2
ASN
H
900
L
HH22
ARG
G
718
R
OD1
ASN
H
900
L
HH22
ARG
G
718
R
CD2
TYR
H
901
L
HH11
ARG
G
718
R
CE2
TYR
H
901
L
HH11
ARG
G
718
R
CA
THR
H
961
L
HH12
ARG
G
226
R
C
THR
H
961
L
HH12
ARG
G
226
R
CB
THR
H
961
L
NH1
ARG
G
226
R
CB
THR
H
961
L
HH11
ARG
G
226
R
CB
THR
H
961
L
HH12
ARG
G
226
R
CB
THR
H
961
L
HE22
GLN
G
236
R
CG2
THR
H
961
L
HG21
THR
G
178
R
CG2
THR
H
961
L
NH1
ARG
G
226
R
CG2
THR
H
961
L
HH11
ARG
G
226
R
CG2
THR
H
961
L
HH12
ARG
G
226
R
CG2
THR
H
961
L
CD
GLN
G
236
R
CG2
THR
H
961
L
OE1
GLN
G
236
R
CG2
THR
H
961
L
NE2
GLN
G
236
R
CG2
THR
H
961
L
HE21
GLN
G
236
R
CG2
THR
H
961
L
HE22
GLN
G
236
R
OG1
THR
H
961
L
CG2
THR
G
178
R
OG1
THR
H
961
L
HG21
THR
G
178
R
OG1
THR
H
961
L
HG22
THR
G
178
R
N
GLU
H
962
L
NH1
ARG
G
226
R
N
GLU
H
962
L
NH2
ARG
G
226
R
N
GLU
H
962
L
HH12
ARG
G
226
R
N
GLU
H
962
L
HH22
ARG
G
226
R
CA
GLU
H
962
L
NH2
ARG
G
226
R
CA
GLU
H
962
L
HH22
ARG
G
226
R
C
GLU
H
962
L
NH2
ARG
G
226
R
C
GLU
H
962
L
HH21
ARG
G
226
R
C
GLU
H
962
L
HH22
ARG
G
226
R
CB
GLU
H
962
L
NH2
ARG
G
226
R
CB
GLU
H
962
L
HH21
ARG
G
226
R
CB
GLU
H
962
L
HH22
ARG
G
226
R
CB
GLU
H
962
L
HG22
THR
G
234
R
O
GLU
H
962
L
NE
ARG
G
226
R
O
GLU
H
962
L
CZ
ARG
G
226
R
O
GLU
H
962
L
NH1
ARG
G
226
R
O
GLU
H
962
L
NH2
ARG
G
226
R
O
GLU
H
962
L
HD2
ARG
G
226
R
O
GLU
H
962
L
HE
ARG
G
226
R
O
GLU
H
962
L
HH11
ARG
G
226
R
O
GLU
H
962
L
HH12
ARG
G
226
R
O
GLU
H
962
L
HH21
ARG
G
226
R
O
GLU
H
962
L
HH22
ARG
G
226
R
CG
GLU
H
962
L
HH22
ARG
G
226
R
CG
GLU
H
962
L
HG22
THR
G
234
R
CD
GLU
H
962
L
HG21
THR
G
234
R
CD
GLU
H
962
L
HG22
THR
G
234
R
OE2
GLU
H
962
L
HH21
ARG
G
226
R
OE2
GLU
H
962
L
HH22
ARG
G
226
R
OE2
GLU
H
962
L
CG2
THR
G
234
R
OE2
GLU
H
962
L
HG21
THR
G
234
R
OE2
GLU
H
962
L
HG22
THR
G
234
R
OE2
GLU
H
962
L
HG23
THR
G
234
R
O
ASN
H
963
L
OG
SER
G
230
R
O
ASN
H
963
L
HG
SER
G
230
R
O
SER
H
964
L
HA
ARG
G
226
R
O
SER
H
964
L
HG3
ARG
G
226
R
O
SER
H
964
L
H
GLY
G
227
R
CG
LEU
H
966
L
HE2
LYS
G
199
R
CD1
LEU
H
966
L
HE2
LYS
G
199
R
CD1
LEU
H
966
L
HZ2
LYS
G
199
R
N
SER
H
967
L
HB3
SER
G
224
R
CA
SER
H
967
L
OG
SER
G
224
R
CA
SER
H
967
L
HG
SER
G
224
R
C
SER
H
967
L
OG
SER
G
224
R
C
SER
H
967
L
HG
SER
G
224
R
N
SER
H
968
L
OG
SER
G
224
R
N
SER
H
968
L
HG
SER
G
224
R
CA
SER
H
968
L
OG
SER
G
224
R
CA
SER
H
968
L
HG
SER
G
224
R
C
SER
H
968
L
HB
ILE
G
223
R
C
SER
H
968
L
HD11
ILE
G
223
R
C
SER
H
968
L
OG
SER
G
224
R
C
SER
H
968
L
HG
SER
G
224
R
O
SER
H
968
L
CB
ILE
G
223
R
O
SER
H
968
L
CG1
ILE
G
223
R
O
SER
H
968
L
CD1
ILE
G
223
R
O
SER
H
968
L
HB
ILE
G
223
R
O
SER
H
968
L
HG21
ILE
G
223
R
O
SER
H
968
L
HD11
ILE
G
223
R
O
SER
H
968
L
HD12
ILE
G
223
R
O
SER
H
968
L
HD13
ILE
G
223
R
O
SER
H
968
L
OG
SER
G
224
R
O
SER
H
968
L
HG
SER
G
224
R
N
ILE
H
969
L
HD11
ILE
G
223
R
N
ILE
H
969
L
HG
SER
G
224
R
CA
ILE
H
969
L
CD1
ILE
G
223
R
CA
ILE
H
969
L
HD11
ILE
G
223
R
CA
ILE
H
969
L
HD13
ILE
G
223
R
C
ILE
H
969
L
HD11
ILE
G
223
R
N
THR
H
970
L
HE2
LYS
G
221
R
N
THR
H
970
L
HE3
LYS
G
221
R
N
THR
H
970
L
HZ1
LYS
G
221
R
N
THR
H
970
L
CD1
ILE
G
223
R
N
THR
H
970
L
HD11
ILE
G
223
R
N
THR
H
970
L
HD12
ILE
G
223
R
N
THR
H
970
L
HD13
ILE
G
223
R
CA
THR
H
970
L
HE2
LYS
G
221
R
CA
THR
H
970
L
HZ1
LYS
G
221
R
C
THR
H
970
L
CE
LYS
G
221
R
C
THR
H
970
L
NZ
LYS
G
221
R
C
THR
H
970
L
HE2
LYS
G
221
R
C
THR
H
970
L
HE3
LYS
G
221
R
C
THR
H
970
L
HZ1
LYS
G
221
R
C
THR
H
970
L
HZ2
LYS
G
221
R
C
THR
H
970
L
HZ3
LYS
G
221
R
CB
THR
H
970
L
HE2
LYS
G
221
R
O
THR
H
970
L
CD
LYS
G
221
R
O
THR
H
970
L
CE
LYS
G
221
R
O
THR
H
970
L
NZ
LYS
G
221
R
O
THR
H
970
L
HD3
LYS
G
221
R
O
THR
H
970
L
HE2
LYS
G
221
R
O
THR
H
970
L
HE3
LYS
G
221
R
O
THR
H
970
L
HZ1
LYS
G
221
R
O
THR
H
970
L
HZ2
LYS
G
221
R
O
THR
H
970
L
HZ3
LYS
G
221
R
O
THR
H
970
L
HD12
ILE
G
223
R
N
LEU
H
971
L
NZ
LYS
G
221
R
N
LEU
H
971
L
HE2
LYS
G
221
R
N
LEU
H
971
L
HZ1
LYS
G
221
R
N
LEU
H
971
L
HZ3
LYS
G
221
R
CA
LEU
H
971
L
NZ
LYS
G
221
R
CA
LEU
H
971
L
HZ1
LYS
G
221
R
CA
LEU
H
971
L
HZ2
LYS
G
221
R
CA
LEU
H
971
L
HZ3
LYS
G
221
R
C
LEU
H
971
L
NZ
LYS
G
221
R
C
LEU
H
971
L
HZ1
LYS
G
221
R
C
LEU
H
971
L
HZ3
LYS
G
221
R
O
LEU
H
971
L
HZ3
LYS
G
221
R
N
LEU
H
972
L
NZ
LYS
G
221
R
N
LEU
H
972
L
HZ1
LYS
G
221
R
N
LEU
H
972
L
HZ2
LYS
G
221
R
N
LEU
H
972
L
HZ3
LYS
G
221
R
C
LEU
H
972
L
HE22
GLN
G
167
R
N
ASP
H
973
L
OE1
GLN
G
167
R
N
ASP
H
973
L
NE2
GLN
G
167
R
N
ASP
H
973
L
HE22
GLN
G
167
R
CA
ASP
H
973
L
OE1
GLN
G
167
R
CA
ASP
H
973
L
NE2
GLN
G
167
R
CA
ASP
H
973
L
HE22
GLN
G
167
R
C
ASP
H
973
L
CD
GLN
G
167
R
C
ASP
H
973
L
OE1
GLN
G
167
R
C
ASP
H
973
L
NE2
GLN
G
167
R
C
ASP
H
973
L
HE21
GLN
G
167
R
C
ASP
H
973
L
HE22
GLN
G
167
R
O
ASP
H
973
L
CG
GLN
G
167
R
O
ASP
H
973
L
CD
GLN
G
167
R
O
ASP
H
973
L
OE1
GLN
G
167
R
O
ASP
H
973
L
NE2
GLN
G
167
R
O
ASP
H
973
L
HG3
GLN
G
167
R
O
ASP
H
973
L
HE21
GLN
G
167
R
O
ASP
H
973
L
HE22
GLN
G
167
R
O
ASP
H
973
L
OD2
ASP
G
192
R
N
PRO
H
974
L
CG
GLN
G
167
R
N
PRO
H
974
L
CD
GLN
G
167
R
N
PRO
H
974
L
OE1
GLN
G
167
R
N
PRO
H
974
L
NE2
GLN
G
167
R
N
PRO
H
974
L
HB3
GLN
G
167
R
N
PRO
H
974
L
HG3
GLN
G
167
R
N
PRO
H
974
L
HE21
GLN
G
167
R
N
PRO
H
974
L
HE22
GLN
G
167
R
CA
PRO
H
974
L
CB
GLN
G
167
R
CA
PRO
H
974
L
CG
GLN
G
167
R
CA
PRO
H
974
L
CD
GLN
G
167
R
CA
PRO
H
974
L
OE1
GLN
G
167
R
CA
PRO
H
974
L
NE2
GLN
G
167
R
CA
PRO
H
974
L
HA
GLN
G
167
R
CA
PRO
H
974
L
HB3
GLN
G
167
R
CA
PRO
H
974
L
HG3
GLN
G
167
R
CA
PRO
H
974
L
HE21
GLN
G
167
R
CA
PRO
H
974
L
HE22
GLN
G
167
R
C
PRO
H
974
L
HG3
GLN
G
167
R
CB
PRO
H
974
L
O
GLY
G
166
R
CB
PRO
H
974
L
N
GLN
G
167
R
CB
PRO
H
974
L
CA
GLN
G
167
R
CB
PRO
H
974
L
CB
GLN
G
167
R
CB
PRO
H
974
L
CG
GLN
G
167
R
CB
PRO
H
974
L
CD
GLN
G
167
R
CB
PRO
H
974
L
OE1
GLN
G
167
R
CB
PRO
H
974
L
NE2
GLN
G
167
R
CB
PRO
H
974
L
HA
GLN
G
167
R
CB
PRO
H
974
L
HB2
GLN
G
167
R
CB
PRO
H
974
L
HB3
GLN
G
167
R
CB
PRO
H
974
L
HG2
GLN
G
167
R
CB
PRO
H
974
L
HG3
GLN
G
167
R
CG
PRO
H
974
L
CB
GLN
G
167
R
CG
PRO
H
974
L
OE1
GLN
G
167
R
CG
PRO
H
974
L
HB3
GLN
G
167
R
CD
PRO
H
974
L
CD
GLN
G
167
R
CD
PRO
H
974
L
OE1
GLN
G
167
R
CD
PRO
H
974
L
HB3
GLN
G
167
R
N
GLY
H
975
L
HG3
GLN
G
167
R
O
GLU
H
976
L
HG22
THR
G
215
R
O
GLU
H
976
L
O
SER
G
216
R
CG
HIS
H
977
L
HZ1
LYS
G
163
R
CG
HIS
H
977
L
OD2
ASP
G
190
R
CD2
HIS
H
977
L
NZ
LYS
G
163
R
CD2
HIS
H
977
L
HZ1
LYS
G
163
R
CD2
HIS
H
977
L
HZ2
LYS
G
163
R
CD2
HIS
H
977
L
HZ3
LYS
G
163
R
CD2
HIS
H
977
L
OD2
ASP
G
190
R
ND1
HIS
H
977
L
HZ1
LYS
G
163
R
ND1
HIS
H
977
L
CG
ASP
G
190
R
ND1
HIS
H
977
L
OD2
ASP
G
190
R
CE1
HIS
H
977
L
NZ
LYS
G
163
R
CE1
HIS
H
977
L
HE3
LYS
G
163
R
CE1
HIS
H
977
L
HZ1
LYS
G
163
R
CE1
HIS
H
977
L
HZ3
LYS
G
163
R
CE1
HIS
H
977
L
CG
ASP
G
190
R
CE1
HIS
H
977
L
OD1
ASP
G
190
R
CE1
HIS
H
977
L
OD2
ASP
G
190
R
NE2
HIS
H
977
L
CE
LYS
G
163
R
NE2
HIS
H
977
L
NZ
LYS
G
163
R
NE2
HIS
H
977
L
HE3
LYS
G
163
R
NE2
HIS
H
977
L
HZ1
LYS
G
163
R
NE2
HIS
H
977
L
HZ2
LYS
G
163
R
NE2
HIS
H
977
L
HZ3
LYS
G
163
R
NE2
HIS
H
977
L
CG
ASP
G
190
R
NE2
HIS
H
977
L
OD2
ASP
G
190
R
O
TYR
H
978
L
HG23
THR
G
215
- Title of columns started by 'R:' means Receptor, 'L:' means Ligand
Krembil, Jurisica Lab. February 20, 2025 Database: 1.0.11.0