@TOME V3
(Feb 2022)
Ref.
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Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
3D Alignment Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
3D Alignment Cluster
Contacts with Ligands
Show alignment :
Atome selection
All alignments
Only Template with Ligand
Column output:
Score:
Atome Rank Value
Tools Score
Hide column
Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
Hide column
Structural Clustering:
Cluster Num
3D-Jury Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
PDB Ligands
Affinity Score
Binding Site Identity
Hide column
Screening
Virtual Screening Score
Hide column
Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
Hide column
Sequence & Result Tab:
Sequence Alignment
Tab of Complexes
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : JAK1_HUMAN: (2019-04-29 )
MQYLNIKEDCNAMAFCAKMRSSKKTEVNLEAPEPGVEVIFYLSDREPLRLGSGEYTAEELCIRAAQACRISPLCHNLFALYDENTKLWYAPNRTITVDDKMSLRLHYRMRFYFTNWHGTNDNEQSVWRHSPKKQKNGYEKKKIPDATPLLDASSLEYLFAQGQYDLVKCLAPIRDPKTEQDGHDIENECLGMAVLAISHYAMMKKMQLPELPKDISYKRYIPETLNKSIRQRNLLTRMRINNVFKDFLKEFNNKTICDSSVSTHDLKVKYLATLETLTKHYGAEIFETSMLLISSENEMNWFHSNDGGNVLYYEVMVTGNLGIQWRHKPNVVSVEKEKNKLKRKKLENKHKKDEEKNKIREEWNNFSYFPEITHIVIKESVVSINKQDNKKMELKLSSHEEALSFVSLVDGYFRLTADAHHYLCTDVAPPLIVHNIQNGCHGPICTEYAINKLRQEGSEEGMYVLRWSCTDFDNILMTVTCFEKSEQVQGAQKQFKNFQIEVQKGRYSLHGSDRSFPSLGDLMSHLKKQILRTDNISFMLKRCCQPKPREISNLLVATKKAQEWQPVYPMSQLSFDRILKKDLVQGEHLGRGTRTHIYSGTLMDYKDDEGTSEEKKIKVILKVLDPSHRDISLAFFEAASMMRQVSHKHIVYLYGVCVRDVENIMVEEFVEGGPLDLFMHRKSDVLTTPWKFKVAKQLASALSYLEDKDLVHGNVCTKNLLLAREGIDSECGPFIKLSDPGIPITVLSRQECIERIPWIAPECVEDSKNLSVAADKWSFGTTLWEICYNGEIPLKDKTLIEKERFYESRCRPVTPSCKELADLMTRCMNYDPNQRPFFRAIMRDINKLEEQNPDIVSEKKPATEVDPTHFEKRFLKRIRDLGEGHFGKVELCRYDPEGDNTGEQVAVKSLKPESGGNHIADLKKEIEILRNLYHENIVKYKGICTEDGGNGIKLIMEFLPSGSLKEYLPKNKNKINLKQQLKYAVQICKGMDYLGSRQYVHRDLAARNVLVESEHQVKIGDFGLTKAIETDKEYYTVKDDRDSPVFWYAPECLMQSKFYIASDVWSFGVTLHELLTYCDSDSSPMALFLKMIGPTHGQMTVTRLVNTLKEGKRLPCPPNCPDEVYQLMRKCWEFQPSNRTSFQNLIEGFEALLK
Atome Classification :
(32 SA)
.........10........20........30........40........50........60........70........80........90........100.......110.......120.......130.......140.......150.......160.......170.......180.......190.......200.......210.......220.......230.......240.......250.......260.......270.......280.......290.......300.......310.......320.......330.......340.......350.......360.......370.......380.......390.......400.......410.......420.......430.......440.......450.......460.......470.......480.......490.......500.......510.......520.......530.......540.......550.......560.......570.......580.......590.......600.......610.......620.......630.......640.......650.......660.......670.......680.......690.......700.......710.......720.......730.......740.......750.......760.......770.......780.......790.......800.......810.......820.......830.......840.......850.......860.......870.......880.......890.......900.......910.......920.......930.......940.......950.......960.......970.......980.......990.......1000......1010......1020......1030......1040......1050......1060......1070......1080......1090......1100......1110......1120......1130......1140......1150.
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(pKd)
(pKd)
(Uniprot)
MQYL
N
I
K
E
D
C
N
A
M
A
F
C
A
K
MRSSKK
T
E
V
N
L
EAPEPG
V
E
V
I
F
Y
LSDRE
P
L
RLGSGEY
T
A
E
E
L
C
I
R
A
A
Q
ACR
I
S
P
L
C
H
N
L
F
A
L
YDEN
T
K
L
W
YAPN
R
T
I
T
VDD
K
M
S
L
R
L
H
Y
R
M
R
F
Y
F
T
NWHGTNDNE
Q
S
V
WRHSPKKQKNGYEKKKIPDATPLLDA
S
S
L
E
Y
L
F
AQG
Q
Y
D
L
V
K
C
LAPIRDPKTEQDGH
D
I
E
N
E
C
L
G
M
A
V
L
A
I
S
H
Y
A
M
M
K
K
MQLPELPKDI
S
Y
K
RY
I
P
E
T
L
N
K
S
I
R
Q
R
N
L
L
T
R
M
R
I
N
N
V
F
K
D
F
L
K
E
FNN
K
T
ICDSSVSTH
D
L
K
V
K
Y
L
A
T
L
E
T
L
T
K
H
Y
G
A
E
I
F
E
T
S
M
L
L
I
SSENE
M
N
W
F
HSNDGG
N
V
L
Y
Y
E
V
M
V
TGNL
G
I
Q
WRHKPN
V
V
S
V
E
K
E
K
N
K
L
K
R
K
K
L
ENKHK
K
D
E
E
K
N
K
I
R
E
E
WNNFSYF
P
E
I
T
H
I
V
I
K
E
S
V
VSINKQDN
K
K
M
E
L
K
LS
S
H
E
E
A
L
S
F
V
S
L
V
D
G
Y
F
R
LTADA
H
H
Y
LCTDVA
P
P
L
I
V
H
N
IQNGCHGPI
C
T
E
Y
A
I
N
K
L
R
QEGSEE
G
M
Y
V
L
R
W
SCTDFD
N
I
L
M
T
V
T
CFE
K
S
E
Q
V
Q
G
A
Q
K
Q
FKN
F
Q
I
E
V
QK
G
R
Y
S
LHGSDRSFP
S
L
G
D
L
M
S
H
L
K
K
Q
I
LRTD
N
I
S
F
M
L
K
R
CCQP
K
P
R
E
I
S
N
L
L
V
ATKKAQEWQPVY
P
M
S
Q
L
S
F
D
R
I
L
K
K
D
L
VQGEHLGRGT
R
T
H
I
YS
G
T
LMDYKDDEGT
S
E
E
K
K
I
K
V
I
L
KVLDPSHRD
I
S
L
A
F
F
E
A
A
S
M
M
R
Q
VSHK
H
I
V
Y
L
Y
G
V
C
V
R
D
V
E
N
I
M
V
E
E
F
VEGGP
L
D
L
F
M
HRKSDVLTT
P
W
K
F
K
V
A
K
Q
L
A
S
A
L
S
Y
LEDKDLVHGNVC
T
K
N
L
L
L
AREGIDSECG
P
F
I
K
LSDPGI
P
I
T
V
L
S
R
Q
E
C
I
E
RIPWI
A
P
E
C
VEDSKN
L
S
VAADKWSFGT
T
L
W
E
I
C
YNGEIPLK
D
K
T
L
I
E
K
E
R
F
Y
E
SRCRPVTP
S
C
K
E
L
A
D
L
M
T
R
CMNYDPNQ
R
P
F
F
R
A
I
M
R
D
I
N
K
L
EEQNPDIVSEKKPATEV
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
LGEGHFGK
V
E
L
C
R
YDPEGDNTGE
Q
V
A
V
K
SLKPESGG
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
YK
G
I
CTEDGG
N
G
I
K
L
I
M
E
FLPSG
S
L
K
E
Y
LPKNKNKI
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
KG
M
D
Y
LGS
R
Q
Y
V
H
R
D
L
A
ARN
V
L
VESEH
Q
V
K
IGDFGLTKAIETDK
E
Y
Y
T
VKDDRDS
P
V
F
W
Y
A
P
E
C
L
M
QSK
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
CDSDS
S
P
M
A
L
F
L
K
M
IGPTHG
Q
M
T
V
T
R
L
V
N
T
L
KEGKRLPCPPNC
P
D
E
V
Y
Q
L
M
R
K
C
WEFQPSN
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
LK
8
PsiBlast_PDB
52.53
99%
-117
- C1 -
-
4E4N
7.1
-
JAK1_HUMAN
A:
[2-302]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
I
V
S
E
K
K
P
A
T
E
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
-----
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
E
----
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
10
PsiBlast_PDB
52.43
99%
-115
- C1 -
-
4EI4
5.9
-
JAK1_HUMAN
A:
[2-302]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
I
V
S
E
K
K
P
A
T
E
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
------
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
-----
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
15
PsiBlast_PDB
52.12
99%
-116
- C1 -
-
4IVD
6.9
-
JAK1_HUMAN
A:
[2-302]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
I
V
S
E
K
K
P
A
T
E
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
-----
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
-----
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
11
PsiBlast_PDB
52.08
99%
-112
- C1 -
-
4FK6
7.2
-
JAK1_HUMAN
A:
[11-302]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
T
E
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
--
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
E
---
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
E
D
G
G
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
13
PsiBlast_PDB
51.81
99%
-113
- C1 -
-
4IVB
6.7
-
JAK1_HUMAN
A:
[2-302]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
I
V
S
E
K
K
P
A
T
E
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
-----
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
E
----
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
27
Blastp_CBE
51.72
99%
-115
- C1 -
-
4I5C
6.6
-
B:
[2-302]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
I
V
S
E
K
K
P
A
T
E
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
-----
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
E
----
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
14
PsiBlast_PDB
51.62
99%
-109
- C1 -
-
4IVC
6.9
-
JAK1_HUMAN
A:
[2-302]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
I
V
S
E
K
K
P
A
T
E
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
-----
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
E
----
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
9
PsiBlast_PDB
51.48
99%
-110
- C1 -
-
4EHZ
5.7
-
JAK1_HUMAN
A:
[6-302]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
K
K
P
A
T
E
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
-----
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
E
D
G
G
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
28
Blastp_CBE
51.02
99%
-110
- C1 -
-
4FK6
7.2
-
B:
[12-302]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
E
---
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
E
--
G
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
33
Blastp_CBE
50.79
99%
-118
- C1 -
-
4E4N
7.1
-
B:
[13-302]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
----
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
4
PsiBlast_PDB
50.78
99%
-126
- C1 -
-
5KHX
5.9
-
A:
[29-316]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
-----
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
-----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
E
D
G
G
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
18
PsiBlast_PDB
50.75
99%
-110
- C1 -
-
3EYH
7.9
-
A:
[1-290]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
E
---
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
E
D
G
G
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
19
PsiBlast_PDB
50.58
99%
-119
- C1 -
-
5E1E
7.4
-
JAK1_HUMAN
A:
[1-290]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
-----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
----
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
16
PsiBlast_PDB
50.41
99%
-114
- C1 -
-
4K77
5.0
-
JAK1_HUMAN
A:
[12-302]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
---
G
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
E
----
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
32
Blastp_CBE
50.19
99%
-115
* C1 *
-
4EHZ
5.6
-
JAK1_HUMAN
B:
[13-302]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
----
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
34
Blastp_CBE
49.96
99%
-116
- C1 -
-
4E4L
6.1
-
E:
[12-302]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
-----
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
37
Blastp_CBE
49.88
99%
-106
- C1 -
-
6AAH
6.4
-
B:
[1-290]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
E
D
G
G
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
30
Blastp_CBE
49.88
99%
-115
- C1 -
-
4EHZ
5.9
-
D:
[13-302]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
----
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
36
Blastp_CBE
49.81
99%
-114
- C1 -
-
4E4L
6.1
-
JAK1_HUMAN
B:
[12-302]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
-----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
-----
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
35
Blastp_CBE
49.81
99%
-108
- C1 -
-
4E4L
5.5
-
JAK1_HUMAN
D:
[12-302]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
------
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
--
G
G
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
24
Blastp_CBE
49.78
99%
-115
- C1 -
-
4IVD
6.6
-
B:
[13-302]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
----
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
12
PsiBlast_PDB
49.77
99%
-113
- C1 -
-
4I5C
6.6
-
JAK1_HUMAN
A:
[13-302]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
----
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
-
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
20
PsiBlast_PDB
49.72
99%
-108
- C1 -
-
6AAH
6.6
-
JAK1_HUMAN
A:
[1-290]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
-----
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
E
D
G
G
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
7
PsiBlast_PDB
49.65
99%
-116
- C1 -
-
4E4L
6.2
-
JAK1_HUMAN
A:
[13-302]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
------
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
-----
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
22
Blastp_CBE
49.40
99%
-115
- C1 -
-
5HX8
6.8
-
B:
[13-302]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
-
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
----
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
29
Blastp_CBE
49.39
99%
-112
- C1 -
-
4EI4
6.1
-
B:
[13-302]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
----
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
25
Blastp_CBE
49.35
99%
-111
- C1 -
-
4IVC
7.0
-
B:
[13-302]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
----
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
26
Blastp_CBE
49.18
99%
-112
- C1 -
-
4IVB
6.5
-
B:
[13-302]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
----
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
31
Blastp_CBE
49.00
99%
-115
- C1 -
-
4EHZ
5.6
-
JAK1_HUMAN
C:
[14-302]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
-----
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
23
Blastp_CBE
48.89
99%
-109
- C1 -
-
4K77
5.3
-
B:
[13-302]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
----
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
21
Blastp_CBE
48.73
99%
-111
- C1 -
-
5WO4
6.7
-
B:
[13-302]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
G
H
F
G
K
V
E
L
C
R
Y
D
P
E
G
D
N
T
G
E
Q
V
A
V
K
S
L
K
P
----
N
H
I
A
D
L
K
K
E
I
E
I
L
R
N
L
Y
H
E
N
I
V
K
Y
K
G
I
C
T
----
N
G
I
K
L
I
M
E
F
L
P
S
G
S
L
K
E
Y
L
P
K
N
K
N
K
I
N
L
K
Q
Q
L
K
Y
A
V
Q
I
C
K
G
M
D
Y
L
G
S
R
Q
Y
V
H
R
D
L
A
A
R
N
V
L
V
E
S
E
H
Q
V
K
I
G
D
F
G
L
T
K
A
I
E
T
D
K
E
Y
Y
T
V
K
D
D
R
D
S
P
V
F
W
Y
A
P
E
C
L
M
Q
S
K
F
Y
I
A
S
D
V
W
S
F
G
V
T
L
H
E
L
L
T
Y
C
D
S
D
S
S
P
M
A
L
F
L
K
M
I
G
P
T
H
G
Q
M
T
V
T
R
L
V
N
T
L
K
E
G
K
R
L
P
C
P
P
N
C
P
D
E
V
Y
Q
L
M
R
K
C
W
E
F
Q
P
S
N
R
T
S
F
Q
N
L
I
E
G
F
E
A
L
L
K
17
PsiBlast_PDB
48.54
99%
-119
- C1 -
-
4K6Z
6.4
-
A:
[13-302]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
D
P
T
H
F
E
K
R
F
L
K
R
I
R
D
L
G
E
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C
R
Y
D
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E
G
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N
T
G
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V
A
V
K
S
L
K
P
-----
H
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E
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L
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E
----
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