@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 : NPY6R_HUMAN: (2016-01-11 )
MEVSLNHPASNTTSTKNNNSAFFYFESCQPPSPALLLLCIAYTVVLIVGLFGNLSLIIIIFKKQRKAQNFTSILIANLSLSDTLVCVMCIHFTIIYTLMDHWIFGDTMCRLTSYVQSVSISVSIFSLVFTAVERYQLIVNPRGWKPSVTHAYWGITLIWLFSLLLSIPFFLSYHLTDEPFRNLSLPTDLYTHQVACVENWPSKKDRLLFTTSLFLLQYFVPLGFILICYLKIVICLRRRNAKVDKKKENEGRLNENKRINTMLISIVVTFGACWLPRISSMSSLTGIMRC
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---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
M--EVSLNHPASNTTSTKNN
N
-
S
A
F
F
Y
F
ESCQPP
S
P
A
L
L
L
L
C
I
A
Y
T
V
V
L
I
V
G
L
FGN
L
S
L
I
I
I
I
F
KKQRKAQNF
T
S
I
L
I
ANLSL
S
D
T
L
V
C
V
M
C
-
I
H
F
T
I
I
Y
T
L
M
D
H
WIF
G
D
T
M
C
R
L
T
S
Y
V
Q
S
V
S
I
S
V
S
I
F
S
L
V
F
T
A
V
E
R
Y
Q
L
I
VNP-RG-W--KPSV--
T
H
A
Y
--
W
G
I
T
L
I
W
L
F
S
L
L
L
S
I
P
F
F
L
S
YHLTDEPFRNLSLPTDL
Y
T
H
Q
V
A
C
V
ENWPSKK---
D
R
L
---
L
F
T
T
S
L
F
L
L
Q
Y
F
--
V
P
L
G
F
I
L
I
C
Y
L
K
I
V
I
C
L
R
RRN----AKVD------------------------------------KK---------KENEGRLNENK
R
-
I
N
T
M
L
I
S
I
V
V
T
F
G
A
C
W
L
P
-
R
I
S
S
M
S
S
L
T
-------
G
IMRC-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
90.03
22%
-141
- C3 -
3PQR
7
OPSD_BOVIN
A:
[42-267]
-------------------------------------------
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
---------------------------------------
Q
Q
---------
Q
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
45
Fugue
90.01
21%
-134
- C3 -
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
QGSDF
G
P
I
F
M
T
I
P
A
F
F
A
K
TSAVY
N
P
V
I
Y
I
M
MN
K
Q
F
R
N
C
M
V
T
T
L
C
CGKNPSTTVSKTETS
Q
V
A
P
A-----------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
89.71
22%
-144
- C3 -
3DQB
3
GNAT1_BOVIN (first)
A:
[42-267]
-------------------------------------------
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
---------------------------------------
Q
Q
---------
Q
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
HHSearch
89.57
24%
-128
* C3 *
2KS9
1
NK1R_HUMAN
A:
[34-271]
---------------------------------------
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
NKI
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
D
------------------------------------
S
S
---------
D
R
Y
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
47
Fugue
89.32
23%
-140
- C3 -
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
D
F
QTPAM
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
LAGDTFRRR---------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
88.41
22%
-144
- C3 -
3PXO
3
OPSD_BOVIN
A:
[42-267]
-------------------------------------------
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
---------------------------------------
Q
Q
---------
Q
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
87.60
22%
-143
- C3 -
4J4Q
7
GNAT1_BOVIN (first)
A:
[42-267]
-------------------------------------------
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
---------------------------------------
Q
Q
---------
Q
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
87.59
22%
-138
- C3 -
1F88
4
OPSD_BOVIN
A:
[42-267]
-------------------------------------------
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
87.29
22%
-138
- C3 -
2I35
3
OPSD_BOVIN
A:
[42-267]
-------------------------------------------
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
---------------------------------------
Q
Q
---------
Q
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
34
HHSearch
87.17
22%
-142
- C3 -
2Z73
5
OPSD_TODPA
A:
[34-284]
-------------------------------------
Y
Y
S
L
G
I
F
I
G
I
C
G
I
I
G
C
G
G
N
G
I
V
I
Y
L
F
T
-
K
T
K
S
L
Q
T
P
A
N
M
F
I
I
N
L
A
F
S
D
F
T
F
S
L
V
N
G
F
P
L
M
T
I
S
C
F
L
K
K
W
I
F
G
F
A
A
C
K
V
Y
G
F
I
G
G
I
F
G
F
M
S
I
M
T
M
A
M
I
S
I
D
R
Y
N
V
I
G
R
P
-
M
A
-
A
--
S
K
K
M
S
H
R
R
A
F
--
I
M
I
I
F
V
W
L
W
S
V
L
W
A
I
G
P
I
F
G
W
G
A
Y
T
L
E
-----------
G
V
L
C
N
C
S
F
D
Y
I
S
R
D
S
--
T
T
R
---
S
N
I
L
C
M
F
I
L
G
F
F
--
G
P
I
L
I
I
F
F
C
Y
F
N
I
V
M
S
V
S
N
H
E
----
K
E
M
A
------------------------------------
A
M
A
K
RLNAKE
L
R
K
A
Q
A
G
A
N
A
E
M
R
-
L
A
K
I
S
I
V
I
V
S
Q
F
L
L
S
W
S
P
-
Y
A
V
V
A
L
L
A
Q
-------
F
G
P
L
E
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
87.10
22%
-144
- C3 -
3CAP
3
OPSD_BOVIN
A:
[42-267]
-------------------------------------------
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
---------------------------------------
Q
Q
---------
Q
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
86.80
22%
-147
- C3 -
4PXF
5
OPSD_BOVIN
A:
[42-267]
-------------------------------------------
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
---------------------------------------
Q
Q
---------
Q
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
86.70
22%
-137
- C3 -
3C9L
10
OPSD_BOVIN
A:
[42-267]
-------------------------------------------
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
---------------------------------------
Q
Q
---------
Q
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
86.45
22%
-132
- C3 -
2I36
-
OPSD_BOVIN
A:
[42-267]
-------------------------------------------
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
---------------------------------------
Q
Q
---------
Q
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
44
Fugue
85.41
18%
-134
- C3 -
2RH1
16
ADRB2_HUMAN (first)
A:
[36-477]
---------------------------------
D
E
V
W
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
QS
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
T
E
G
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
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
TGTWDAYKFCL
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
QDNLIR
K
E
V
Y
I
L
L
N
W
I
G
Y
V
N
S
G
F
N
PLIYCRS
P
D
F
R
I
A
F
Q
E
L
L
CL-----------
2
PsiBlast_PDB
85.22
22%
-135
- C3 -
3C9M
1
OPSD_BOVIN
A:
[42-267]
-------------------------------------------
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
---------------------------------------
Q
Q
---------
Q
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
48
Fugue
84.89
19%
-140
- C3 -
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
T
E
G
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
I
-------
G
--
R
N
TNGVIT
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
TGTWDAYGSK
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
19
PsiBlast_PDB
83.30
22%
-139
- C3 -
2I37
-
OPSD_BOVIN
A:
[42-267]
-------------------------------------------
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
-------------------------------------------------------------
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
43
Fugue
80.63
21%
-98
- C3 -
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
----
A
Q
---------------------------------------
Q
---------
Q
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
DFGPIFM
T
I
P
A
F
F
A
KTSAV
Y
N
P
V
I
Y
I
M
M
N
K
Q
F
R
N
C
M
V
T
T
L
C
CGKNPLGDDEA
S
T
T
V
S
K
TETSQVAPA----------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
79.12
27%
-165
- C3 -
4S0V
1
OX2R_HUMAN
A:
[56-252]
---------------------------------
P
K
E
Y
E
W
V
L
I
A
G
Y
I
I
V
F
V
V
A
L
I
G
N
V
L
V
C
V
A
V
W
K
N
H
H
-
M
R
T
V
T
N
Y
F
I
V
N
L
S
L
A
D
V
L
V
T
I
T
C
-
L
P
A
T
L
V
V
D
I
T
E
T
W
F
F
G
Q
S
L
C
K
V
I
P
Y
L
Q
T
V
S
V
S
V
S
V
L
T
L
S
C
I
A
L
D
R
W
Y
A
I
C
H
P
--------
S
T
A
--
K
R
A
R
--
N
S
I
V
I
I
W
I
V
S
C
I
I
M
I
P
Q
A
I
V
M
E
C
S
T
-
V
F
-----
K
T
T
L
F
T
---
V
C
D
E
R
W
G
G
E
I
---
Y
P
K
---
M
Y
H
I
C
F
F
L
V
T
Y
M
--
A
P
L
C
L
M
V
L
A
Y
L
Q
I
F
R
K
L
W
C
R
Q
----
G
I
D
C
------------------------------------
S
F
---------
W
N
E
S
Y
L
T
G
S
R
D
E
-
R
K
K
S
L
L
S
K
F
G
M
D
E
G
V
T
F
M
-
F
I
G
R
F
D
R
G
Q
-------
K
G
V
D
V
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------