@TOME V2.3
(Nov 2016)
Ref.
-
-
Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
Core Structure Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
Core Structure 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 Struct. Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
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:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : PAR2_HUMAN: (2016-01-14 )
MRSPSAAWLLGAAILLAASLSCSGTIQGTNRSSKGRSLIGKVDGTSHVTGKGVTVETVFSVDEFSASVLTGKLTTVFLPIVYTIVFVVGLPSNGMALWVFLFRTKKKHPAVIYMANLALADLLSVIWFPLKIAYHIHGNNWIYGEALCNVLIGFFYGNMYCSILFMTCLSVQRYWVIVNPMGHSRKKANIAIGISLAIWLLILLVTIPLYVVKQTIFIPALNITTCHDVLPEQLLVGDMFNYFLSLAIGVFLFPAFLTASAYVLMIRMLRSSAMDENSEKKRKRAIKLIVTVLAMYLICFTPSNLLLVVHYFLIKSQGQSHVYALYIVALCLSTLNSCIDPFVYYFVSHDFRDHAKNALLCRSVRTVKQMQVSLTSKKHSRKSSSYSSSSTTVKTSY
Atome Classification :
(20 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.....
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MRSP
S
A
A
W
L
L
G
A
A
I
L
L
A
ASLSC
S
G
T
I
QGTNRSSKG
R
S
L
I
GKVDGTSHVTGK
G
V
T
V
E
T
V
F
S
V
D
E------F---------------S
A
S
VLTG
K
L
T
T
V
F
L
P
I
--------
V
Y
T
I
V
F
V
VGLPSN
G
M
A
L
W
V
F
L
F
RTKKKH
P
A
V
I
Y
M
A
N
L
A
L
A
D
L
L
S
V
I
W
-
F
P
L
K
I
A
Y
H
I
HGN
N
W
I
Y
G
E
A
L
C
N
V
L
I
G
F
F
Y
G
N
M
Y
C
S
I
L
F
M
T
C
L
SV
Q
R
Y
W
V
I
VNPMG----H-SR-K----K
A
N
I
A
I
G
I
S
L
A
I
W
L
L
I
L
L
V
T
I
P
L
Y
V
V
K
Q
T
I
F
I
-PA---LNI
T
T
C
-
H
DV
L
P
E
Q
L
L
V
G
D
M
F
N
Y
F
L
S
L
A
I
G
V
F
L
F
----
P
A
F
L
T
A
S
A
Y
V
L
M
I
R
M
L
-----------------------------------------------
R
S
-------------------------------------------SA----MD-------E---------------------------------------------------------------------------------------------------------------------------------------------------------------
N
S
-
E
K
K
R
---
K
R
A
I
K
L
I
V
T
V
L
A
M
Y
L
I
CFTP
S
N
L
L
L
V
V
H
Y
-----
F
-
L
I
K-----S-------Q-------G------QS
H
V
Y
A
L
Y
I
V
A
L
C
--
L
S
T
L
N
S
C
I
D
P
F
V
Y
Y
F
V
SH
D
F
R
D
HA
K
N
A
L
L
C
R
S
V
R
T
V
K
Q
M
Q
V
S
LTSKKHSRKSSSYSSSS
T
T
V
KTSY
52
Fugue
92.71
32%
-168
- C7 -
4XNV
15
P2RY1_HUMAN (first)
A:
[38-382]
------------------
S
F
K
C
A
L
T
K
T
G
-----------------------------------------------------------------
F
Q
F
Y
Y
L
P
A
--------
V
Y
I
L
V
F
I
I
G
F
L
G
N
S
V
A
I
W
M
F
V
F
H
M
K
P
W
S
G
I
S
V
Y
M
F
N
L
A
L
A
D
F
L
Y
V
L
T
-
L
P
A
L
I
F
Y
Y
F
N
K
T
D
W
I
F
G
D
A
M
C
K
L
Q
R
F
I
F
H
V
N
L
Y
G
S
I
L
F
L
T
C
I
S
A
H
R
Y
S
G
V
V
Y
P
K
S
----
L
-
G
R
-
L
----
K
K
K
N
A
I
C
I
S
V
L
V
W
L
I
V
V
V
A
I
S
P
I
L
F
Y
S
G
T
G
V
R
-
K
N
----
K
T
I
T
C
-
Y
D
T
T
S
D
E
Y
L
R
S
-
Y
F
I
Y
S
M
C
T
T
V
A
M
F
C
V
----
P
L
V
L
I
L
G
C
Y
G
L
I
V
R
A
L
-----------------------------------------------
I
Y
K
M
K
K
Y
T
C
TVCG
Y
I
Y
N
PEDGDPDNGVNPGTDFKDIVCPLCGVGK
D
Q
----
F
E
-------
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------
V
E
-
E
P
L
R
---
R
K
S
I
Y
L
V
I
I
V
L
T
V
F
A
V
S
Y
I
P
F
H
V
M
K
T
M
N
L
-----
R
-
A
R
L
-----
D
FQTPAM
C
A
-------
F
------
N
D
R
V
Y
A
T
Y
Q
V
T
R
G
--
L
A
S
L
N
S
C
V
N
P
I
L
Y
F
L
A
G
D
T
F
R
R
R
-------------------------------------------
1
PsiBlast_PDB
86.42
25%
-162
- C7 -
4XNV
15
P2RY1_HUMAN (first)
A:
[38-382]
--------------------------------------------------------------
S
------
F
---------------
K
C
A
L
T
K
T
G
F
Q
F
Y
Y
L
P
A
--------
V
Y
I
L
V
F
I
I
G
F
L
G
N
S
V
A
I
W
M
F
V
F
H
M
K
P
W
S
G
I
S
V
Y
M
F
N
L
A
L
A
D
F
L
Y
V
L
T
-
L
P
A
L
I
F
Y
Y
F
N
K
T
D
W
I
F
G
D
A
M
C
K
L
Q
R
F
I
F
H
V
N
L
Y
G
S
I
L
F
L
T
C
I
S
A
H
R
Y
S
G
V
V
Y
P
-
K
----
S
L
G
R
-
L
----
K
K
K
N
A
I
C
I
S
V
L
V
W
L
I
V
V
V
A
I
S
P
I
L
F
Y
S
G
T
-
G
V
-
R
K
---
N
K
T
I
T
C
-
Y
D
T
T
S
D
E
Y
L
-
R
S
Y
F
I
Y
S
M
C
T
T
V
A
M
F
C
V
----
P
L
V
L
I
L
G
C
Y
G
L
I
V
R
A
L
I
Y
K
M
K
K
Y
T
C
TVCG
Y
I
Y
N
PEDGDPDNGVNPGTDFKDIVCPLCGV----
G
K
-------------------------------------------
D
Q
----
F
E
-------
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------
V
E
-
E
P
L
R
---
R
K
S
I
Y
L
V
I
I
V
L
T
V
F
A
V
S
Y
I
P
F
H
V
M
K
T
M
N
L
R
A
R
L
D
F
-
Q
T
P
-----
A
-------
M
-------
C
A
F
----
N
D
R
V
Y
A
T
Y
Q
V
T
R
G
--
L
A
S
L
N
S
C
V
N
P
I
L
Y
F
L
A
G
D
T
F
R
R
R
-------------------------------------------
2
PsiBlast_PDB
82.31
25%
-161
- C7 -
4XNW
2
RUBR_CLOPA
A:
[37-382]
-------------------------------------------------------------
S
S
------
F
---------------
K
C
A
L
T
K
T
G
F
Q
F
Y
Y
L
P
A
--------
V
Y
I
L
V
F
I
I
G
F
L
G
N
S
V
A
I
W
M
F
V
F
H
M
K
P
W
S
G
I
S
V
Y
M
F
N
L
A
L
A
D
F
L
Y
V
L
T
-
L
P
A
L
I
F
Y
Y
F
N
K
T
D
W
I
F
G
D
A
M
C
K
L
Q
R
F
I
F
H
V
N
L
Y
G
S
I
L
F
L
T
C
I
S
A
H
R
Y
S
G
V
V
Y
P
L
K
----
S
L
G
R
-
L
----
K
K
K
N
A
I
C
I
S
V
L
V
W
L
I
V
V
V
A
I
S
P
I
L
F
Y
S
G
T
-
G
V
-
R
K
---
N
K
T
I
T
C
-
Y
D
T
T
S
D
E
Y
L
-
R
S
Y
F
I
Y
S
M
C
T
T
V
A
M
F
C
V
----
P
L
V
L
I
L
G
C
Y
G
L
I
V
R
A
L
I
Y
K
M
K
K
Y
T
C
TVCG
Y
I
Y
N
PEDGDPDNGVNPGTDFKDIPDDWVCPLCGV
G
K
-------------------------------------------
D
Q
----
F
E
-------
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------
V
E
-
E
P
L
R
---
R
K
S
I
Y
L
V
I
I
V
L
T
V
F
A
V
S
Y
I
P
F
H
V
M
K
T
M
N
L
R
A
R
L
D
F
-
Q
T
P
-----
A
-------
M
-------
C
A
F
----
N
D
R
V
Y
A
T
Y
Q
V
T
R
G
--
L
A
S
L
N
S
C
V
N
P
I
L
Y
F
L
A
G
D
T
F
R
R
R
-------------------------------------------
8
PsiBlast_PDB
81.70
25%
-142
- C7 -
4RWD
7
C562_ECOLX (first)
A:
[73-406]
-------------------------------------
L
V
G
Q
I
D
D
A
L
K
L
A
N
E
G
K
V
K
E
A
Q
A
A
A
E
Q
------
L
K
T
T
R
N
A
YIQKYLGAR
S
A
S
S
L
A
---
L
A
I
A
I
T
A
--------
L
Y
S
A
V
C
A
V
G
L
L
G
N
V
L
V
M
F
G
I
V
R
Y
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
A
L
A
T
S
T
-
L
P
F
Q
S
A
K
Y
L
M
-
E
T
W
P
F
G
E
L
L
C
K
A
V
L
S
I
D
Y
Y
N
M
F
T
S
I
F
T
L
T
M
M
S
V
D
R
Y
I
A
V
C
H
P
V
K
A
L
D
F
R
-
T
P
-
A
----
K
A
K
L
---
I
N
I
C
I
W
V
L
A
S
G
V
G
V
P
I
M
V
M
A
V
T
--
R
-
P
R
---
D
G
A
V
V
C
-
M
L
Q
F
P
S
P
S
W
Y
W
D
T
V
T
-----
K
I
C
V
F
L
F
AF
V
V
P
I
L
I
I
T
V
C
Y
G
L
M
L
L
R
L
-----------------------------------------------
R
S
-------------------------------------------
V
R
----
L
L
-------
S
---------------------------------------------------------------------------------------------------------------------------------------------------------------
G
S
-
K
E
K
D
R
S
L
R
R
I
T
R
M
V
L
V
V
V
G
A
F
V
V
C
W
A
P
I
H
I
F
V
I
V
W
T
-----
L
-
V
D
I
-----
D
-------
R
-------
R
------
D
P
L
V
V
A
A
L
H
L
C
I
A
--
L
G
Y
A
N
S
S
L
N
P
V
L
Y
A
F
L
D
E
N
F
K
R
C
F
R
Q
--
L
C
------------------------------------
32
HHSearch
79.76
23%
-160
- C7 -
3ODU
6
CXCR4_HUMAN (first)
A:
[41-498]
----------------------------------------------------------------------------------------
E
E
N
A
N
F
N
K
I
F
L
P
T
--------
I
Y
S
I
I
F
L
T
G
I
V
G
N
G
L
V
I
L
V
M
G
Y
Q
K
K
L
R
S
M
T
D
K
Y
R
L
H
L
S
V
A
D
L
L
F
V
I
T
-
L
P
F
W
A
V
D
A
V
--
A
N
W
Y
F
G
N
F
L
C
K
A
V
H
V
I
Y
T
V
N
L
Y
S
S
V
W
I
L
A
F
I
S
L
D
R
Y
L
A
I
V
H
A
T
N
----
S
-
Q
R
P
R
----
K
L
L
A
E
K
V
V
Y
V
G
V
W
I
P
A
L
L
L
T
I
P
D
F
I
F
A
N
V
S
E
---
A
---
D
D
R
Y
I
C
-
D
R
F
Y
P
N
D
L
---
W
V
V
V
F
Q
F
Q
H
I
M
V
G
L
I
L
----
P
G
I
V
I
L
S
C
Y
C
I
I
I
S
K
L
-----------------------------------------------
S
H
-------------------------------------------
S
G
----
S
N
-------
I
F
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
TEG
Y
Y
T
I
GIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
IGRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKLK
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KRW
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYG
S
K
-
G
H
Q
K
---
R
K
A
L
K
T
T
V
I
L
I
L
A
F
F
A
C
W
L
P
Y
Y
I
G
I
S
I
D
S
-----
F
-
I
L
L
-----
E
I
I
K
Q
G
C
-
E
-------
F
------
E
N
T
V
H
K
W
I
S
I
T
E
A
--
L
A
F
F
H
C
C
L
N
P
I
L
Y
A
F
L
G
A
K
F
K
T
S
A
Q
H
A
L
T
S
G
R
P
L
E
V
L
F
Q
---------------------------
7
PsiBlast_PDB
79.72
25%
-144
- C7 -
4RWA
2
C562_ECOLX (first)
A:
[73-406]
-------------------------------------
L
V
G
Q
I
D
D
A
L
K
L
A
N
E
G
K
V
K
E
A
Q
A
A
A
E
Q
------
L
K
T
T
R
N
A
YIQKYLGAR
S
A
S
S
L
A
---
L
A
I
A
I
T
A
--------
L
Y
S
A
V
C
A
V
G
L
L
G
N
V
L
V
M
F
G
I
V
R
Y
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
A
L
A
T
S
T
-
L
P
F
Q
S
A
K
Y
L
M
-
E
T
W
P
F
G
E
L
L
C
K
A
V
L
S
I
D
Y
Y
N
M
F
T
S
I
F
T
L
T
M
M
S
V
D
R
Y
I
A
V
C
H
P
V
K
A
L
D
F
R
-
T
P
-
A
----
K
A
K
L
---
I
N
I
C
I
W
V
L
A
S
G
V
G
V
P
I
M
V
M
A
V
T
--
R
-
P
R
---
D
G
A
V
V
C
-
M
L
Q
F
P
S
P
S
W
Y
W
D
T
V
T
-----
K
I
C
V
F
L
F
AF
V
V
P
I
L
I
I
T
V
C
Y
G
L
M
L
L
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
S
-
K
E
K
D
R
S
L
R
R
I
T
R
M
V
L
V
V
V
G
A
F
V
V
C
W
A
P
I
H
I
F
V
I
V
W
T
-----
L
-
V
D
I
-----
D
-------
R
-------
R
------
D
P
L
V
V
A
A
L
H
L
C
I
A
--
L
G
Y
A
N
S
S
L
N
P
V
L
Y
A
F
L
D
E
N
F
K
R
C
F
R
Q
--
L
C
------------------------------------
12
PsiBlast_PDB
78.19
27%
-153
- C7 -
4N6H
22
OPRD_HUMAN
A:
[131-411]
-------------------------------------------------------------------------------------------------------------
L
Y
S
A
V
C
A
V
G
L
L
G
N
V
L
V
M
F
G
I
V
R
Y
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
A
L
A
T
S
T
-
L
P
F
Q
S
A
K
Y
L
M
-
E
T
W
P
F
G
E
L
L
C
K
A
V
L
S
I
D
Y
Y
N
M
F
T
S
I
F
T
L
T
M
M
S
V
D
R
Y
I
A
V
C
H
P
V
K
ALDF
R
-
T
P
-
A
----
K
A
K
L
---
I
N
I
C
I
W
V
L
A
S
G
V
G
V
P
I
M
V
M
A
V
T
--
R
-
P
R
---
D
G
A
V
V
C
-
M
L
Q
F
P
S
P
S
W
Y
W
D
T
V
T
-----
K
I
C
V
F
L
F
AF
V
V
P
I
L
I
I
T
V
C
Y
G
L
M
L
L
R
L
-----------------------------------------------
R
S
-------------------------------------------
V
R
----
L
L
-------
S
---------------------------------------------------------------------------------------------------------------------------------------------------------------
G
S
-
K
E
K
D
R
S
L
R
R
I
T
R
M
V
L
V
V
V
G
A
F
V
V
C
W
A
P
I
H
I
F
V
I
V
W
T
-----
L
-
V
D
I
-----
D
-------
R
-------
R
------
D
P
L
V
V
A
A
L
H
L
C
I
A
--
L
G
Y
A
N
S
S
L
N
P
V
L
Y
A
F
L
D
E
N
F
K
R
C
F
R
Q
--
L
C
R
K
P
C
G
-------------------------------
19
PsiBlast_PDB
77.08
24%
-167
- C7 -
4XT3
2
US28_HCMVA
A:
[26-309]
--------------------------------------------------------------
E
DATPCV
F
---------------
T
D
V
L
N
Q
S
K
P
V
T
L
F
L
-----------
Y
G
V
V
F
L
F
G
S
I
G
N
F
L
V
I
F
T
I
T
W
R
R
R
I
Q
C
S
G
D
V
Y
F
I
N
L
A
A
A
D
L
L
F
V
C
T
-
L
P
L
W
M
Q
Y
L
L
D
H
-----
A
S
V
P
C
T
L
L
T
A
C
F
Y
V
A
M
F
A
S
L
C
F
I
T
E
I
A
L
D
R
Y
Y
A
I
V
Y
M
R
Y
----
R
-
P
V
-
K
----
Q
A
C
L
---
F
S
I
F
W
W
I
F
A
V
I
I
A
I
P
H
F
M
V
V
T
K
----
K
D
---
N
Q
C
M
T
D
-
Y
D
Y
L
E
V
S
Y
P
I
--
I
L
N
--
V
E
L
M
L
G
A
F
V
I
----
P
L
S
V
I
S
Y
C
Y
Y
R
I
S
R
I
V
-----------------------------------------------
A
V
-------------------------------------------
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
-
S
R
H
K
---
G
R
I
V
R
V
L
I
A
V
V
L
V
F
I
I
F
W
L
P
Y
H
L
T
L
F
V
D
T
-----
L
K
L
L
K
W
I
S
S
S
C
-------
E
-------
F
------
E
R
S
L
K
R
A
L
I
L
T
E
S
--
L
A
F
C
H
C
C
L
N
P
L
L
Y
V
F
V
G
T
K
F
R
Q
E
L
H
C
L
L
A
E
------------------------------------
34
HHSearch
76.20
19%
-156
- C7 -
3UON
4
ACM2_HUMAN (first)
A:
[24-457]
------------------------------------------------------------------------------------------------
V
F
I
V
L
--------
V
A
G
S
L
S
L
V
T
I
I
G
N
I
L
V
M
V
S
I
K
V
N
R
H
L
Q
T
V
N
N
Y
F
L
F
S
L
A
C
A
D
L
I
I
G
V
F
S
M
N
L
Y
T
L
Y
-
T
V
I
G
Y
W
P
L
G
P
V
V
C
D
L
W
L
A
L
D
Y
V
V
S
N
A
S
V
M
N
L
L
I
I
S
F
D
R
Y
F
C
V
T
K
P
L
T
----
Y
-
P
V
K
R
----
T
T
K
M
A
G
M
M
I
A
A
A
W
V
L
S
F
I
L
W
A
P
A
I
L
F
W
Q
F
I
V
G
V
R
T
---
V
E
D
G
E
C
-
Y
I
Q
F
F
S
N
------
A
A
V
T
F
G
T
A
I
A
A
F
Y
L
----
P
V
I
I
M
T
V
L
Y
W
H
I
S
R
A
S
-----------------------------------------------
K
S
-------------------------------------------
R
I
----
N
I
-------
F
E
M
L
R
I
D
EGLRL
K
I
Y
K
D
TEG
Y
Y
T
I
GIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKL
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAY--
P
P
-
P
S
R
E
---
K
K
V
T
R
T
I
L
A
I
L
L
A
F
I
I
T
W
A
P
Y
N
V
M
V
L
I
N
T
-----
F
-
C
A
P
-----------------------------
C
I
P
N
T
V
W
T
I
G
Y
W
--
L
C
Y
I
N
S
T
I
N
P
A
C
Y
A
L
C
N
A
T
F
K
K
T
F
K
H
L
L
M
-------------------------------------
5
PsiBlast_PDB
75.75
26%
-166
- C7 -
5C1M
7
?
A:
[23-293]
-------------------------------------------------------------------------------------------------------------
L
Y
S
I
V
C
V
V
G
L
F
G
N
F
L
V
M
Y
V
I
V
R
Y
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
A
L
A
T
S
T
-
L
P
F
Q
S
V
N
Y
L
M
G
-
T
W
P
F
G
N
I
L
C
K
I
V
I
S
I
D
Y
Y
N
M
F
T
S
I
F
T
L
C
T
M
S
V
D
R
Y
I
A
V
C
H
P
V
K
A
L
--
D
-
F
R
-
T
----
P
R
N
A
K
I
-
V
N
V
C
N
W
I
L
S
S
A
I
G
L
P
V
M
F
M
A
T
T
K
Y
R
-
Q
G
SID
C
T
L
T
F
S
-
H
P
T
W
Y
W
E
N
L
L
K
------
I
C
V
F
I
F
A
F
I
M
----
P
V
L
I
I
T
V
C
Y
G
L
M
I
L
R
L
-----------------------------------------------
K
S
-------------------------------------------
V
R
----
M
L
-------
S
---------------------------------------------------------------------------------------------------------------------------------------------------------------
G
S
-
K
E
K
D
R
N
L
R
R
I
T
R
M
V
L
V
V
V
A
V
F
I
V
C
W
T
P
I
H
I
Y
V
I
I
K
A
-----
L
-
I
T
I
-----
P
-------
E
-------
T
------
T
F
Q
T
V
S
W
H
F
-
C
I
A
--
L
G
Y
T
N
S
C
L
N
P
V
L
Y
A
F
L
D
E
N
F
K
R
C
F
------------------------------------------
44
HHSearch
75.74
21%
-153
- C7 -
3PBL
2
DRD3_HUMAN (first)
A:
[41-472]
--------------------------------------------------------------------------------------------------
Y
A
L
--------
S
Y
C
A
L
I
L
A
I
V
F
G
N
G
L
V
C
M
A
V
L
K
E
R
A
L
Q
T
T
T
N
Y
L
V
V
S
L
A
V
A
D
L
L
V
A
T
L
V
M
P
W
V
V
Y
L
E
V
T
G
G
V
W
N
F
S
R
I
C
C
D
V
F
V
T
L
D
V
M
M
C
T
A
S
I
W
N
L
C
A
I
S
I
D
R
Y
T
A
V
V
M
P
V
H
----
Y
-
Q
H
-
G
T
G
Q
S
S
C
R
R
V
A
L
M
I
T
A
V
W
V
L
A
F
A
V
S
C
P
L
L
F
G
F
N
T
T
--------
G
D
P
T
V
C
-
S
I
S
N
P
---------
D
F
V
I
Y
S
S
V
V
S
F
Y
L
----
P
F
G
V
T
V
L
V
Y
A
R
I
Y
V
V
L
-----------------------------------------------
K
Q
-------------------------------------------
R
R
----
R
K
-------
N
I
F
E
M
L
R
I
D
E
GLRL
K
I
Y
K
D
TEG
Y
Y
T
I
G
IGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
T
GTWDAY
G
V
-
P
L
R
E
---
K
K
A
T
Q
M
V
A
I
V
L
G
A
F
I
V
C
W
L
P
F
F
L
T
H
V
L
N
T
-----
H
-
C
Q
T
-----
C
-----------------------
H
V
S
P
E
L
Y
S
A
T
T
W
--
L
G
Y
V
N
S
A
L
N
P
V
I
Y
T
T
F
N
I
E
F
R
K
A
F
L
K
I
L
S
C
------------------------------------
36
HHSearch
75.61
20%
-157
- C7 -
2KS9
1
NK1R_HUMAN
A:
[32-328]
-----------------------------------------------------------------------------------------------
I
V
L
W
A
A
--------
A
Y
T
V
I
V
V
T
S
V
V
G
N
V
V
V
M
W
I
I
L
A
H
K
R
M
R
T
V
T
N
Y
F
L
V
N
L
A
F
A
E
A
S
M
A
A
F
-
N
T
V
V
N
F
T
Y
A
V
H
N
E
W
Y
Y
G
L
F
Y
C
K
F
H
N
F
F
P
I
A
A
V
F
A
S
I
Y
S
M
T
A
V
A
F
D
R
Y
M
A
I
I
H
P
L
Q
----
P
-
R
L
-
S
-----
A
T
A
T
K
V
V
I
C
V
I
W
V
L
A
L
L
L
A
F
P
Q
G
Y
Y
S
T
T
E
T
---
M
---
P
S
R
V
V
C
-
M
I
E
W
P
E
H
P
N
K
I
Y
E
K
V
Y
H
I
C
V
T
V
L
I
Y
F
L
----
P
L
L
V
I
G
Y
A
Y
T
V
V
G
I
T
L
-----------------------------------------------
W
A
-------------------------------------------
S
E
----
I
P
GDSSDRY
H
---------------------------------------------------------------------------------------------------------------------------------------------------------------
E
Q
-
V
S
A
K
---
R
K
V
V
K
M
M
I
V
V
V
C
T
F
A
I
C
W
L
P
F
H
I
F
F
L
L
P
Y
-----
I
-
N
P
D
-----
L
-------
Y
-------
L
------
K
K
F
I
Q
Q
V
Y
L
A
I
M
W
--
L
A
M
S
S
T
M
Y
N
P
I
I
Y
C
C
L
N
D
R
F
R
L
G
F
K
H
A
F
R
C
C
P
F
I
S
A
G
D
Y
E
G
L
E
M
K
S
T
R
Y
L
Q
T
Q
G
S
V
Y
K
V
S
R
L
E
T
T
I
3
PsiBlast_PDB
74.69
28%
-163
- C7 -
4EA3
3
C562_ECOLX (first)
A:
[121-401]
---------------------------------------------------------------------------------------------------
P
L
G
L
K
V
T
I
V
G
L
Y
L
A
V
C
V
G
G
L
L
G
N
C
L
V
M
Y
V
I
L
R
H
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
T
L
V
L
L
T
-
L
P
F
Q
-
G
T
D
I
L
L
G
F
W
P
F
G
N
A
L
C
K
T
V
I
A
I
D
Y
Y
N
M
F
T
S
T
F
T
L
T
A
M
S
V
D
R
Y
V
A
I
C
H
P
----------------
T
S
S
K
A
Q
A
V
N
V
A
I
W
A
L
A
S
V
V
G
V
P
V
A
I
M
G
-
S
A
Q
V
-
E
D
---
E
E
I
E
C
L
-
V
E
I
P
T
P
Q
D
Y
W
G
P
V
F
------
A
I
C
I
F
L
F
SF
I
V
P
V
L
V
I
S
V
C
Y
S
L
M
I
R
R
L
-----------------------------------------------
R
G
-------------------------------------------
V
R
----
L
L
-------
S
---------------------------------------------------------------------------------------------------------------------------------------------------------------
G
S
R
E
K
D
R
N
L
-
R
R
I
T
R
L
V
L
V
V
V
A
V
F
V
G
C
W
T
P
V
Q
V
F
V
L
A
Q
G
-----
L
-
G
V
Q
-----
P
-------
S
-------
S
------
E
T
---
A
V
A
I
L
R
F
C
T
A
L
G
Y
V
N
S
C
L
N
P
I
L
Y
A
F
L
D
E
N
F
K
A
C
F
R
-----------------------------------------
18
PsiBlast_PDB
73.86
24%
-172
- C7 -
4XT1
15
US28_HCMVA
A:
[23-309]
-----------------------------------------------------------
D
Y
D
E
DA
T
P
C
V
F
---------------
T
D
V
L
N
Q
S
K
P
V
T
L
F
L
-----------
Y
G
V
V
F
L
F
G
S
I
G
N
F
L
V
I
F
T
I
T
W
R
R
R
I
Q
C
S
G
D
V
Y
F
I
N
L
A
A
A
D
L
L
F
V
C
T
-
L
P
L
W
M
Q
Y
L
L
D
-------
S
V
P
C
T
L
L
T
A
C
F
Y
V
A
M
F
A
S
L
C
F
I
T
E
I
A
L
D
R
Y
Y
A
I
V
Y
M
R
Y
----
R
-
P
V
-
K
----
Q
A
C
L
---
F
S
I
F
W
W
I
F
A
V
I
I
A
I
P
H
F
M
V
V
T
K
----
K
D
---
N
Q
C
M
T
D
-
Y
D
Y
L
E
V
S
Y
P
I
--
I
L
N
--
V
E
L
M
L
G
A
F
V
I
----
P
L
S
V
I
S
Y
C
Y
Y
R
I
S
R
I
V
-----------------------------------------------
A
V
-------------------------------------------
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
-
S
R
H
K
---
G
R
I
V
R
V
L
I
A
V
V
L
V
F
I
I
F
W
L
P
Y
H
L
T
L
F
V
D
T
-----
L
K
L
L
K
W
I
S
S
S
C
-------
E
-------
F
------
E
R
S
L
K
R
A
L
I
L
T
E
S
--
L
A
F
C
H
C
C
L
N
P
L
L
Y
V
F
V
G
T
K
F
R
Q
E
L
H
C
L
L
A
E
F
R
----------------------------------
40
HHSearch
73.08
21%
-154
- C7 -
3RZE
5
ENLYS_BPT4 (first)
A:
[10-443]
-------------------------------------------------------------------------------------------------
P
L
V
V
--------
V
L
S
T
I
C
L
V
T
V
G
L
N
L
L
V
L
Y
A
V
R
S
E
R
K
L
H
T
V
G
N
L
Y
I
V
S
L
S
V
A
D
L
I
V
G
A
V
V
M
P
M
N
I
L
Y
L
L
-
M
S
K
W
S
L
G
R
P
L
C
L
F
W
L
S
M
D
Y
V
A
S
T
A
S
I
F
S
V
F
I
L
C
I
D
R
Y
R
S
V
Q
Q
P
L
R
----
Y
-
L
K
Y
R
----
T
K
T
R
A
S
A
T
I
L
G
A
W
F
L
S
F
L
W
V
I
P
I
L
G
W
N
H
----------
R
R
E
D
K
C
-
E
T
D
F
Y
D
V
------
T
W
F
K
V
M
T
A
I
I
N
F
Y
L
----
P
T
L
L
M
L
W
F
Y
A
K
I
Y
K
A
V
-----------------------------------------------
R
Q
-------------------------------------------
H
C
----
N
I
-------
F
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
TEG
Y
Y
T
I
G
IGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKL
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAY--
L
H
-
M
N
R
E
---
R
K
A
A
K
Q
L
G
F
I
M
A
A
F
I
L
C
W
I
P
Y
F
I
F
F
M
V
I
A
-----
F
-
C
K
N
-----
C
------------------------
C
N
E
H
L
H
M
F
T
I
W
--
L
G
Y
I
N
S
T
L
N
P
L
I
Y
P
L
C
N
E
N
F
K
K
T
F
K
R
I
L
H
I
------------------------------------
53
Fugue
71.95
17%
-129
- C7 -
1F88
8
OPSD_BOVIN
A:
[1-348]
M
N
G
T
E
G
P
N
F
---------------
Y
V
P
F
S
N
K
T
G
-----------------------
V
V
R
S
P
F
E
------
A
---------------
P
Q
Y
Y
L
A
E
P
W
Q
F
S
M
L
A
A
--------
Y
M
F
L
L
I
M
L
G
F
P
I
N
F
L
T
L
Y
V
T
V
Q
H
K
K
L
R
T
P
L
N
Y
I
L
L
N
L
A
V
A
D
L
F
M
V
F
G
-
G
F
T
T
T
L
Y
T
S
L
H
G
Y
F
V
F
G
P
T
G
C
N
L
E
G
F
F
A
T
L
G
G
E
I
A
L
W
S
L
V
V
L
A
I
E
R
Y
V
V
V
C
K
P
M
S
----
N
-
F
R
-
F
----
G
E
N
H
A
I
M
G
V
A
F
T
W
V
M
A
L
A
C
A
A
P
P
L
V
G
W
S
R
Y
I
P
-
E
G
---
M
Q
C
S
C
G
-
I
D
Y
Y
T
P
H
E
E
T
N
-
N
E
S
F
V
I
Y
M
F
V
V
H
F
I
I
----
P
L
I
V
I
F
F
C
Y
G
Q
L
V
F
T
V
-----------------------------------------------
K
E
-------------------------------------------
A
A
----
A
S
-------
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------
T
T
-
Q
K
A
E
---
K
E
V
T
R
M
V
I
I
M
V
I
A
F
L
I
C
W
L
P
---
Y
A
G
V
A
F
-----
Y
-
I
F
T
-----
H
-------
Q
-------
G
------
S
D
F
G
P
I
F
M
T
I
P
A
F
--
F
A
K
T
S
A
V
Y
N
P
V
I
Y
I
M
M
N
K
Q
F
R
N
C
M
V
T
T
L
C
C
G
K
N
P
S
T
T
V
S
K
T
E
T
S
Q
V
A
P
A
-----------------
37
HHSearch
71.90
19%
-152
- C7 -
2RH1
16
ADRB2_HUMAN (first)
A:
[40-477]
-----------------------------------------------------------------------------------------------
V
V
G
M
G
I
--------
V
M
S
L
I
V
L
A
I
V
F
G
N
V
L
V
I
T
A
I
A
K
F
E
R
L
Q
T
V
T
N
Y
F
I
T
S
L
A
C
A
D
L
V
M
G
L
A
V
V
P
F
G
A
A
-
H
I
L
M
K
M
W
T
F
G
N
F
W
C
E
F
W
T
S
I
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
V
D
R
Y
F
A
I
T
S
P
F
K
----
Y
-
Q
S
L
L
----
T
K
N
K
A
R
V
I
I
L
M
V
W
I
V
S
G
L
T
S
F
L
P
I
Q
M
H
W
Y
R
A
T
-
H
----
Q
E
A
I
N
C
-
Y
A
E
E
T
C
C
D
F
F
-
T
N
Q
A
Y
A
I
A
S
S
I
V
S
F
Y
V
----
P
L
V
I
M
V
F
V
Y
S
R
V
F
Q
E
A
-----------------------------------------------
K
R
-------------------------------------------
Q
L
----
N
I
-------
F
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
TEGYYTIGIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAY--
K
F
-
C
L
K
E
---
H
K
A
L
K
T
L
G
I
I
M
G
T
F
T
L
C
W
L
P
F
F
I
V
N
I
V
H
V
-----
I
-
Q
D
N
-----------------------------
L
I
R
K
E
V
Y
I
L
L
N
W
--
I
G
Y
V
N
S
G
F
N
P
L
I
Y
C
-
R
S
P
D
F
R
I
A
F
Q
E
L
L
C
L
------------------------------------
43
HHSearch
71.29
26%
-147
- C7 -
2LNL
-
CXCR1_HUMAN
A:
[38-322]
----------------------------------------------------------------------------------------------
N
K
Y
V
V
I
I
--------
A
Y
A
L
V
F
L
L
S
L
L
G
N
S
L
V
M
L
V
I
L
Y
S
R
V
G
R
S
V
T
D
V
Y
L
L
N
L
A
L
A
D
L
L
F
A
L
T
-
L
P
I
W
A
A
S
K
--
V
N
G
W
I
F
G
T
F
L
C
K
V
V
S
L
L
K
E
V
N
F
Y
S
G
I
L
L
L
A
C
I
S
V
D
R
Y
L
A
I
V
H
A
T
R
----
T
-
L
T
-
Q
----
K
R
H
L
V
K
F
V
C
L
G
C
W
G
L
S
M
N
L
S
L
P
F
F
L
F
R
Q
A
Y
-
H
-
P
N
---
N
S
S
P
V
C
-
Y
E
V
L
G
N
D
T
A
K
-
W
R
M
V
L
R
I
L
P
H
T
F
G
F
I
V
----
P
L
F
V
M
L
F
C
Y
G
F
T
L
R
T
L
-----------------------------------------------
F
K
-------------------------------------------
A
H
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
G
Q
K
---
H
R
A
M
R
V
I
F
A
V
V
L
I
F
L
L
C
W
L
P
Y
N
L
V
L
L
A
D
T
-----
L
-
M
R
T
-----
Q
-------
V
-------
I
QE
S
C
E
R
R
N
N
I
G
R
A
L
D
A
T
E
I
--
L
G
F
L
H
S
C
L
N
P
I
I
Y
A
F
I
G
Q
N
F
R
H
G
F
L
K
I
L
A
M
H
G
----------------------------------
54
Fugue
70.67
18%
-106
- C7 -
1U19
15
OPSD_BOVIN
A:
[4-349]
M
N
G
--------------------------------------
T
E
G
P
N
F
Y
V
P
F
S
N
K
T
G
V
V
R
S
P
F
E
------
A
---------------
P
Q
Y
Y
L
A
E
P
W
Q
F
S
M
L
A
A
--------
Y
M
F
L
L
I
M
L
G
F
P
I
N
F
L
T
L
Y
V
T
V
Q
H
K
K
L
R
T
P
L
N
Y
I
L
L
N
L
A
V
A
D
L
F
M
V
F
G
-
G
F
T
T
T
L
Y
T
S
L
H
G
Y
F
V
F
G
P
T
G
C
N
L
E
G
F
F
A
T
L
G
G
E
I
A
L
W
S
L
V
V
L
A
I
E
R
Y
V
V
V
C
K
P
M
S
----
N
-
F
R
-
F
----
G
E
N
H
A
I
M
G
V
A
F
T
W
V
M
A
L
A
C
A
A
P
P
L
V
-
G
W
S
R
Y
I
-
P
E
---
G
M
Q
C
S
C
G
I
D
Y
Y
T
P
H
E
E
T
N
-
N
E
S
F
V
I
Y
M
F
V
V
H
F
I
I
----
P
L
I
V
I
F
F
C
Y
G
Q
L
V
F
T
V
-----------------------------------------------
K
E
-------------------------------------------
A
A
AQQQ
E
S
-------
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------
T
T
-
Q
K
A
E
---
K
E
V
T
R
M
V
I
I
M
V
I
A
F
L
I
C
W
L
P
---
Y
A
G
V
A
F
-----
Y
-
I
F
T
-----
H
-------
Q
-------
G
------
S
D
F
G
P
I
F
M
T
I
P
A
F
--
F
A
K
T
S
A
V
Y
N
P
V
I
Y
I
M
M
N
K
Q
F
R
N
C
M
V
T
T
L
C
C
G
K
---------
N
P
L
G
D
D
E
A
S
T
T
V
S
K
T
E
T
S
Q
V
A
P
A
--
6
PsiBlast_PDB
70.62
27%
-147
- C7 -
2LNL
-
CXCR1_HUMAN
A:
[44-313]
----------------------------------------------------------------------------------------------------
I
--------
A
Y
A
L
V
F
L
L
S
L
L
G
N
S
L
V
M
L
V
I
L
Y
S
R
V
G
R
S
V
T
D
V
Y
L
L
N
L
A
L
A
D
L
L
F
A
L
T
-
L
P
I
W
A
A
S
K
V
N
G
--
W
I
F
G
T
F
L
C
K
V
V
S
L
L
K
E
V
N
F
Y
S
G
I
L
L
L
A
C
I
S
V
D
R
Y
L
A
I
V
H
A
T
R
----
T
-
L
T
-
Q
----
K
R
H
L
V
K
F
V
C
L
G
C
W
G
L
S
M
N
L
S
L
P
F
F
L
F
R
Q
A
-
Y
H
-
P
N
---
N
S
S
P
V
C
-
Y
E
V
L
G
N
D
T
A
K
W
R
M
V
L
R
I
L
P
H
T
F
G
-
F
I
V
----
P
L
F
V
M
L
F
C
Y
G
F
T
L
R
T
L
-----------------------------------------------
F
K
-------------------------------------------
A
H
----
M
G
-------
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
---
H
R
A
M
R
V
I
F
A
V
V
L
I
F
L
L
C
W
L
P
Y
N
L
V
L
L
A
D
T
-------
L
M
R
-----
T
-------
Q
VIQE
S
C
E
R
------
R
N
N
I
G
R
A
L
D
A
T
E
I
--
L
G
F
L
H
S
C
L
N
P
I
I
Y
A
F
I
G
Q
N
F
R
H
G
F
L
K
I
L
A
M
H
G
----------------------------------