@TOME V2.3
(Nov 2016)
Ref.
-
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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 : LPAR6_HUMAN: (2016-01-11 )
MVSVNSSHCFYNDSFKYTLYGCMFSMVFVLGLISNCVAIYIFICVLKVRNETTTYMINLAMSDLLFVFTLPFRIFYFTTRNWPFGDLLCKISVMLFYTNMYGSILFLTCISVDRFLAIVYPFKSKTLRTKRNAKIVCTGVWLTVIGGSAPAVFVQSTHSQGNNASEACFENFPEATWKTYLSRIVIFIEIVGFFIPLILNVTCSSMVLKTLTKPVTLSRSKINKTKVLKMIFVHLIIFCFCFVPYNINLILYSLVRTQTFVNCSVVAAVRTMYPITLCIAVSNCCFDPIVYYFTSDTIQNSIKMKNWSVRRSDFRFSEVHGAENFIQHNLQTLKSKIFDNESAA
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..--------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MVSVNSS
H
C
F
Y--------------------NDS-
F
K
Y
T
L
Y
G
C
M
F
S
M
V
F
V
L
G
L
I
S
N
C
V
A
I
Y
I
F
I
C
V
L
KVRNET
T
T
Y
M
I
N
L
A
M
S
D
L
L
F
V
F
-TL-
P
F
R
I
F
Y
-
F
T
-TR-N-WP
F
G
D
L
L
C
K
I
S
V
M
L
F
Y
TNMYG
S
I
L
F
L
T
CISV
D
R
F
L
A
I
V
YPFKSK
T
L
---RTKRN-
A
K
I
V
C
T
G
V
W
--
L
T
V
IGGSA
P
-
A
V
F
-
V
Q
-----ST-H-S-QGNN--
A
S
E
A
C
F
E
NF
P
--
E
--
A
T
--
W
K
-
T
Y
L
S
R
I
-
V
I
F
I
E
I
V
G
F
F
-
I
P
L
I
L
N
V
T
C
S
S
M
V
L
K
T
L--------------------------T-------------------------------------------K-------------------------PV--T----------------------LS---------------------------------------------------------------------------------------------------------------------------------------------------------------R---------------------------------------------------------------------------------------------------------------------------------------------------------------SKI---
N
------
K
---
T
K
V
L
K
M
I
-----
F
V
H
L
I
I
F
C
F
C
FVPY
N
I
----
N
L
I
L
Y
S
L
V
R
--
T
--------------
Q
T
F-V-
N
C
S
V
V
A
A
V
R
TMY------
P
I
T
L
C
I
-
A
V
--
S
--NCCF
D
P
I
V
Y
YFT
S
D
T
I
---
Q
NSIKM---KN
W
S
VRRSD
F
R
F
S
E
VHG
A
-
E
N
F
I
Q
H
N
L
Q
T
L
K
S
K
IFDNESAA--------------------------------------------------------------------------------------------------
40
Fugue
93.78
30%
-145
- C2 -
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
PEDGDPDNGVNPGTDFKDIVCPLCGVG
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
DF------------
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
-------------------------------------------------------------------------------------------------------------------------------------------------
25
HHSearch
91.50
27%
-144
- C2 -
3ODU
6
CXCR4_HUMAN (first)
A:
[46-490]
-----------------------------------
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
------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
90.92
26%
-149
- C2 -
4XNW
2
RUBR_CLOPA
A:
[47-382]
---------------------------------
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
PEDGDPDNG
V
-------------------------------------------
N
-------------------------
P
G
--
T
DFKDIPDDWVCPLCG-------
V
G
---------------------------------------------------------------------------------------------------------------------------------------------------------------
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------
D
Q
F
---
E
E
V
EE
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
-------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
90.23
26%
-154
- C2 -
4XNV
15
P2RY1_HUMAN (first)
A:
[47-382]
---------------------------------
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
PEDGDPDNG
V
-------------------------------------------
N
-------------------------
P
G
--
T
DFKDIVCPLCG-----------
V
G
---------------------------------------------------------------------------------------------------------------------------------------------------------------
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------
D
Q
F
---
E
E
V
EE
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
-------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
84.83
24%
-155
- C2 -
4MBS
8
CCR5_HUMAN (first)
A:
[38-359]
-------------------------------------------
L
Y
S
L
V
F
I
F
G
F
V
G
N
M
L
V
I
L
I
L
I
N
Y
K
R
L
K
S
M
T
D
I
Y
L
L
N
L
A
I
S
D
L
F
F
L
L
-
T
V
-
P
F
W
A
H
Y
--
A
-
A
A
-
Q
-
W
D
F
G
N
T
M
C
Q
L
L
T
G
L
Y
F
I
G
F
F
S
G
I
F
F
I
I
L
L
T
I
D
R
Y
L
A
V
V
H
A
V
F
A
L
K
A
---
R
T
V
T
F
-
G
V
V
T
S
V
I
T
W
--
V
V
A
V
F
A
S
L
P
-
N
I
I
-
F
-------
T
-
R
-
S
-
Q
K
E
G
--
L
H
Y
T
C
S
S
H
F
P
--
Y
--
S
Q
--
Y
Q
-
F
W
K
N
F
Q
-
T
L
K
I
V
I
L
G
L
V
-
L
P
L
L
V
M
V
I
C
Y
S
G
I
L
K
T
L
--------------------------
L
-------------------------------------------
R
M
K
K
Y
T
C
TVCG
Y
I
Y
N
PEDGDPDNGVN
P
G
--
T
DFKDIPDDWVCPLCGVGKDQ
F
E
E
V
---------------------------------------------------------------------------------------------------------------------------------------------------------------
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------
E
E
K
---
K
------
R
---
H
R
D
V
R
L
I
-----
F
T
I
M
I
V
Y
F
L
F
W
A
P
Y
N
I
----
V
L
L
L
N
T
F
Q
E
--
F
--------------
F
G
L
-
N
-
N
C
S
S
S
N
R
L
D
Q
A
M
------
Q
V
T
E
T
L
-
G
M
--
T
--
H
C
C
I
N
P
I
I
Y
A
F
V
G
E
E
F
---
R
N
Y
L
L
V
---
F
F
Q
----------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
83.67
29%
-147
- C2 -
4RWD
6
C562_ECOLX (first)
A:
[128-400]
-------------------------------------------
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
A
F
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
-----------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
82.84
30%
-160
- C2 -
5C1M
7
?
A:
[23-294]
-------------------------------------------
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
-----
S
I
D
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
------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
82.07
29%
-153
- C2 -
4N6H
22
OPRD_HUMAN
A:
[131-403]
-------------------------------------------
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
A
F
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
------------------------------------------------------------------------------------------------------------------------------------
44
Fugue
82.02
25%
-124
- C2 -
3ODU
6
CXCR4_HUMAN (first)
A:
[37-502]
-------
P
C
F
R
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
SN
I
----------------------
F
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------
M
---------------------------------------------------------------------------------------------------------------------------------------------------------------
L
R
I
---
D
------
E
---
G
L
R
L
K
I
Y
K
D
TEG
Y
Y
T
I
G
I
G
H
L
L
T
K
S
P
S
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
L
D
A
V
--
R
--
R
A
A
L
I
N
M
V
F
Q
M
G
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
K
R
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
G
T
W
D
A
Y
G
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
EI
I
K
Q
G
C
E
F
E
N
T
V
H
K
W
I
S
I
T
E
A
L
A
F
FHCC
L
N
P
I
L
Y
AFLGAKFKTS
A
Q
H
A
L
TSGRPLEVLFQ
4
PsiBlast_PDB
81.98
29%
-148
- C2 -
4RWA
2
C562_ECOLX (first)
A:
[128-400]
-------------------------------------------
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
A
F
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
-----------------------------------------------------------------------------------------------------------------------------------------
27
HHSearch
80.74
22%
-139
* C2 *
2RH1
16
ADRB2_HUMAN (first)
A:
[40-474]
-------------------------------------
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
CC
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
---------------------------------------------------------------------------------------------------------------------------------------
30
HHSearch
79.35
20%
-145
- C2 -
3PBL
2
DRD3_HUMAN (first)
A:
[41-469]
----------------------------------------
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
GTWDAYG
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
---------------------------------------------------------------------------------------------------------------------------------------
42
Fugue
77.84
16%
-125
- C2 -
1F88
8
OPSD_BOVIN
A:
[1-348]
M
N
G
T
E
G
P
N
F
Y
V
PFSNKTGVVRSPFEAPQYYL
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
--------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
77.75
28%
-154
- C2 -
4EA3
3
C562_ECOLX (first)
A:
[123-398]
---------------------------------
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
S
F
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
-----------------------------------------------------------------------------------------------------------------------------------------------
29
HHSearch
76.42
31%
-130
- C2 -
2LNL
-
CXCR1_HUMAN
A:
[37-318]
-----------------------------------
L
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
AK
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
Q
E
-
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
-------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
76.37
33%
-127
- C2 -
2LNL
-
CXCR1_HUMAN
A:
[46-315]
--------------------------------------------
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
DT
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
-
Q
E
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
-------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
75.89
23%
-145
- C2 -
4LDL
3
ADRB2_HUMAN
A:
[186-452]
-----------------------------------------
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
-
T
K
-
T
-
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
HWYR
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
--
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------
F
A
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
----------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
75.11
23%
-137
- C2 -
4LDE
3
A:
[186-452]
-----------------------------------------
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
-
T
K
-
T
-
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
MHWYR
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
--
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------
F
A
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
----------------------------------------------------------------------------------------------------------------------------------------
32
HHSearch
74.44
21%
-141
- C2 -
2KS9
1
NK1R_HUMAN
A:
[34-319]
---------------------------------------
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
G
DSSDRYH--------------------------------------------------------------------------------------------------------------------------------------------------------
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
--------------------------------------------------------------------------------------------------
23
HHSearch
74.06
18%
-138
- C2 -
3UON
4
ACM2_HUMAN (first)
A:
[24-455]
--------------------------------------
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
----------------------------------------------------------------------------------------------------------------------------------------