@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 : OR4S2_HUMAN: (2016-01-13 )
MEKINNVTEFIFWGLSQSPEIEKVCFVVFSFFYIIILLGNLLIMLTVCLSNLFKSPMYFFLSFLSFVDICYSSVTAPKMIVDLLAKDKTISYVGCMLQLFGVHFFGCTEIFILTVMAYDRYVAICKPLHYMTIMNRETCNKMLLGTWVGGFLHSIIQVALVVQLPFCGPNEIDHYFCDVHPVLKLACTETYIVGVVVTANSGTIALGSFVILLISYSIILVSLRKQSAEGRRKALSTCGSHIAMVVIFFGPCTFMYMRPDTTFSEDKMVAVFYTIITPMLNPLIYTLRNAEVKNAMKKLWGRNVFLEAKGK
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------------------------------------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
---------------------------MEK
I
N
N
V
T
E
F
I
F
WGLSQSP------------
E
I
-------------
E
K
V
C
F
V
V
F
S
F
F
Y
I
I
I
L
L
G
N
L
L
I
M
L
T
----------
V
C
L
S
N
-----
L
FK---
S
--------------------
P
M
Y
F
F
----------------
L
S
F
L
S
F
V
------
D
I
C
Y
SSVT-
A
P
K
M
I
V
D
L
L
-AKDK
T
I
S
Y
V
G
C
M
L
Q
L
F
G
V
H
F
FG
C
T
-------------
E
I
F
I
L
T
V
M
AYD
R
Y
V
A
I
C-------KPL
H
Y
M
T
I---M
N
R
E
T
C
N
K
M
L
L
-----------
G
T
W
V
G
G
F
L
H
S
-
I
I
Q
V
A
L
-
V
V
QLP-----F---------------CGP
N
E
I
D
H
Y
FC
D
V
---
H
P
V
L
----
K
LACT
E
T
--
Y
I
V
G
V
V
V
TANS
G
T
---
I
A
L
G
--------
S
F
V
I
L
L
I
S
Y
S
I
I
L
V
S
L
R
K
QSAE
G
------------
R
---------------------
R
K
A
L
S
T
------
C
G
S
---
H
I
A
M
V
V
---
I
F
FGP
C
--------
T
--
F
M
Y
MRP-----------DT--------T-----F---S--E----D
K
---------
M
--
V
A
V
F
Y
T
I
I
T
-
P
M
L
-----------
N
P
L
I
Y
T
LR
N
A
E
V
-
K
N
A
M
K
K
L
W--GR
N
V
F
L
E
AKGK-------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
92.31
21%
-159
- C4 -
3VGA
1
AA2AR_HUMAN
A:
[18-308]
-------------------------------------------------------------------------------------
V
L
A
I
L
G
N
V
L
V
C
W
A
----------
V
W
L
N
S
-----
N
L
Q
---
N
--------------------
V
T
N
Y
F
----------------
V
V
S
L
A
A
A
------
D
I
A
V
G
V
L
A
-
I
P
F
A
I
T
--
I
-
S
T
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
L
T
Q
S
-------------
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
R
-------
I
P
L
R
Y
N
G
L
---
V
T
G
T
R
A
K
G
I
I
A
-----------
I
C
W
V
L
S
F
------
A
I
G
L
-
T
P
M
L
G
-----
W
NNCGQSQG-------
C
G
E
G
Q
V
A
C
L
F
E
D
V
---
V
P
-
M
----
N
Y
M
V
Y
F
N
--
F
F
A
C
V
L
V
P
L
---
L
---
L
M
L
G
--------
V
Y
L
R
I
F
L
A
A
R
R
Q
L
K
Q
M
E
S
Q
P
L
P
G
------------
E
---------------------
R
-
A
R
S
T
L
Q
K
E
V
H
A
A
K
---
S
L
A
I
I
V
---
G
L
F
A
L
C
W
L
P
L
H
I
I
N
C
--
F
T
F
F
C
P
-----------
D
C
--------
S
-----
H
---
A
--
P
----
L
W
---------
L
M
Y
L
A
I
V
L
S
H
T
N
-
S
V
V
-----------
N
P
F
I
Y
A
Y
R
I
R
E
F
-
R
Q
T
F
R
K
I
I
--
R
S
H
V
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
90.50
20%
-163
- C4 -
2YDO
3
?
A:
[18-312]
-------------------------------------------------------------------------------------
V
L
A
I
L
G
N
V
L
V
C
W
A
----------
V
W
L
N
S
-----
N
L
Q
---
N
--------------------
V
T
N
Y
F
----------------
V
V
S
A
A
A
A
------
D
I
L
V
G
V
L
A
-
I
P
F
A
I
A
--
I
-
S
T
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
L
T
A
S
-------------
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
R
-------
I
P
L
R
Y
N
G
L
---
V
T
G
T
R
A
K
G
I
I
A
-----------
I
C
W
V
L
S
F
------
A
I
G
L
-
T
P
M
L
G
-----
W
NNCGQPK
E
G
K
A
H
S
Q
G
C
G
E
G
Q
V
A
C
L
F
E
D
V
---
V
P
-
M
----
N
Y
M
V
Y
F
N
--
F
F
A
C
V
L
V
P
L
---
L
---
L
M
L
G
--------
V
Y
L
R
I
F
L
A
A
R
R
Q
L
K
Q
M
E
S
--------------------------------------------
T
L
Q
K
E
V
H
A
A
K
---
S
L
A
I
I
V
---
G
L
F
A
L
C
W
L
P
L
H
I
I
N
C
--
F
T
F
F
C
P
-----------
D
C
--------
S
-----
H
---
A
--
P
----
L
W
---------
L
M
Y
L
A
I
V
L
S
H
T
N
-
S
V
V
-----------
N
P
F
I
Y
A
Y
R
I
R
E
F
-
R
Q
T
F
R
K
I
I
--
R
S
H
V
L
R
Q
Q
E
P
F
-------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
90.19
21%
-156
- C4 -
3VG9
8
?
A:
[18-309]
-------------------------------------------------------------------------------------
V
L
A
I
L
G
N
V
L
V
C
W
A
----------
V
W
L
N
S
-----
N
L
Q
---
N
--------------------
V
T
N
Y
F
----------------
V
V
S
L
A
A
A
------
D
I
A
V
G
V
L
A
-
I
P
F
A
I
T
--
I
-
S
T
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
L
T
Q
S
-------------
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
R
-------
I
P
L
R
Y
N
G
L
---
V
T
G
T
R
A
K
G
I
I
A
-----------
I
C
W
V
L
S
F
------
A
I
G
L
-
T
P
M
L
G
-----
W
NNCGQSQG-------
C
G
E
G
Q
V
A
C
L
F
E
D
V
---
V
P
-
M
----
N
Y
M
V
Y
F
N
--
F
F
A
C
V
L
V
P
L
---
L
---
L
M
L
G
--------
V
Y
L
R
I
F
L
A
A
R
R
Q
L
K
Q
M
E
S
Q
P
L
P
G
------------
E
---------------------
R
-
A
R
S
T
L
Q
K
E
V
H
A
A
K
---
S
L
A
I
I
V
---
G
L
F
A
L
C
W
L
P
L
H
I
I
N
C
--
F
T
F
F
C
P
-----------
D
C
--------
S
-----
H
---
A
--
P
----
L
W
---------
L
M
Y
L
A
I
V
L
S
H
T
N
-
S
V
V
-----------
N
P
F
I
Y
A
Y
R
I
R
E
F
-
R
Q
T
F
R
K
I
I
--
R
S
H
V
L
R
------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
89.82
20%
-167
- C4 -
4UG2
3
?
A:
[18-309]
-------------------------------------------------------------------------------------
V
L
A
I
L
G
N
V
L
V
C
W
A
----------
V
W
L
N
S
-----
N
L
Q
---
N
--------------------
V
T
N
Y
F
----------------
V
V
S
A
A
A
A
------
D
I
L
V
G
V
L
A
-
I
P
F
A
I
A
--
I
-
S
T
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
L
T
A
S
-------------
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
R
-------
I
P
L
R
Y
N
G
L
---
V
T
G
T
R
A
K
G
I
I
A
-----------
I
C
W
V
L
S
F
------
A
I
G
L
-
T
P
M
L
G
-----
W
NNCGQPK
E
G
K
A
H
S
Q
G
C
G
E
G
Q
V
A
C
L
F
E
D
V
---
V
P
-
M
----
N
Y
M
V
Y
F
N
--
F
F
A
C
V
L
V
P
L
---
L
---
L
M
L
G
--------
V
Y
L
R
I
F
L
A
A
R
R
Q
L
----------------------------------------------
A
R
S
T
L
Q
K
E
V
H
A
A
K
---
S
L
A
I
I
V
---
G
L
F
A
L
C
W
L
P
L
H
I
I
N
C
--
F
T
F
F
C
P
-----------
D
C
--------
S
-----
H
---
A
--
P
----
L
W
---------
L
M
Y
L
A
I
V
L
S
H
T
N
-
S
V
V
-----------
N
P
F
I
Y
A
Y
R
I
R
E
F
-
R
Q
T
F
R
K
I
I
--
R
S
H
V
L
R
------------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
89.70
20%
-165
- C4 -
2YDV
6
?
A:
[18-312]
-------------------------------------------------------------------------------------
V
L
A
I
L
G
N
V
L
V
C
W
A
----------
V
W
L
N
S
-----
N
L
Q
---
N
--------------------
V
T
N
Y
F
----------------
V
V
S
A
A
A
A
------
D
I
L
V
G
V
L
A
-
I
P
F
A
I
A
--
I
-
S
T
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
L
T
A
S
-------------
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
R
-------
I
P
L
R
Y
N
G
L
---
V
T
G
T
R
A
K
G
I
I
A
-----------
I
C
W
V
L
S
F
------
A
I
G
L
-
T
P
M
L
G
-----
W
NNCGQPK
E
G
K
A
H
S
Q
G
C
G
E
G
Q
V
A
C
L
F
E
D
V
---
V
P
-
M
----
N
Y
M
V
Y
F
N
--
F
F
A
C
V
L
V
P
L
---
L
---
L
M
L
G
--------
V
Y
L
R
I
F
L
A
A
R
R
Q
L
K
Q
M
E
S
Q
------------------------------------------
S
T
L
Q
K
E
V
H
A
A
K
---
S
L
A
I
I
V
---
G
L
F
A
L
C
W
L
P
L
H
I
I
N
C
--
F
T
F
F
C
P
-----------
D
C
--------
S
-----
H
---
A
--
P
----
L
W
---------
L
M
Y
L
A
I
V
L
S
H
T
N
-
S
V
V
-----------
N
P
F
I
Y
A
Y
R
I
R
E
F
-
R
Q
T
F
R
K
I
I
--
R
S
H
V
L
R
Q
Q
E
P
F
-------------------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
87.86
16%
-145
- C4 -
2Z73
5
OPSD_TODPA
A:
[33-332]
-----------------------------------------------------------
V
-------------
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
PLE--
W
VT-
P
--
Y
----
A
A
---------
Q
--
L
P
V
M
F
A
K
A
S
-
A
I
H
-----------
N
P
M
I
Y
S
V
S
H
P
K
F
-
R
E
A
I
S
Q
T
F
--
P
W
V
L
T
C
C
Q
F
D
D
-------------------------------------------------------------------------------------------------------------------------------------------------------
47
Fugue
84.26
21%
-152
- C1 -
4RNZ
9
?
A:
[1-369]
-------------M
E
R
L
V
W
D
KLT
L
L
G
F
L
E
K
-
N
H
I
P
Q
K
L
Y
Y
N
L
S
S
Q
D
------------
K
E
-------------
L
S
A
E
I
Q
S
N
V
T
Y
Y
T
L
R
D
A
N
N
T
L
I
Q
A
L
----------
I
P
I
S
Q
D
L
Q
I
H
I
Y
K
---
K
--------------------
G
E
D
Y
F
----------------
L
D
F
I
P
I
I
F
T
R
K
E
K
T
L
L
L
S
L
Q
T
-
S
P
Y
Q
D
I
I
K
A
-
T
N
D
P
L
L
A
N
Q
L
M
N
A
Y
K
K
S
V
P
F
K
R
L
V
KN
D
----------
K
I
A
I
V
Y
T
R
D
Y
R
V
G
Q
A
F
G
-------
Q
P
T
I
K
M
A
M
---
V
S
S
R
S
N
Q
Y
Y
L
F
S
H
SNG
H
Y
Y
D
SK
A
Q
E
V
A
G
F
L
L
E
-
T
P
V
K
Y
T
-
R
I
S
S
P
-----
F
S--------------
Y
G
R
F
H
R
P
H
Y
G
V
D
Y
A
A
K
H
G
S
L
----
I
H
S
A
S
D
G
--
R
V
G
F
M
G
V
K
A
G
Y
G
K
V
V
E
I
H
L
N
--------
E
L
R
L
V
Y
A
H
M
S
A
F
A
N
G
L
K
K
G
S
F
V
K
------------
K
---------------------
G
Q
I
I
G
R
------
V
G
S
TG
P
H
L
H
F
G
V
---
Y
K
N
S
R
P
--------
I
NP
L
G
Y
I
R
T
-----------
A
K
--------
S
-----
K
---
L
--
H
----
G
K
---------
Q
--
R
E
V
F
L
E
K
A
Q
-
R
S
K
-----------
Q
K
L
E
E
L
L
K
T
H
S
F
E
K
N
S
F
Y
L
L
E
--
G
---
F
L
E
H
H
H
H
-------------------------------------------------------------------------------------------------------------------------------------------------------
30
HHSearch
81.43
16%
-144
- C4 -
2KS9
1
NK1R_HUMAN
A:
[34-326]
---------------------------------------------------------------------------
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
PD---
L
YLK
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
-------------------------------------------------------------------------------------------------------------------------------------------------------
39
Fugue
81.34
15%
-120
- C4 -
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
RSPFEAPQYYLAE
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
KLR
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
GMQC
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
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
KTETS
Q
V
A
P
A---------------------------------------------------------------------------------------------------------------------------------------------
41
Fugue
78.37
17%
-109
- C4 -
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
VRSPFEAPQYYL
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
KLR
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
GMQC
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
GSDFGPIFM
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
TETSQVAPA-----------------------------------------------------------------------------------------------------------------------------------------
31
HHSearch
76.85
15%
-125
* C4 *
1U19
14
OPSD_BOVIN
A:
[40-329]
-------------------------------------------------------------------------
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
ESA
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
SD---
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
-------------------------------------------------------------------------------------------------------------------------------------------------------
42
Fugue
76.17
13%
-125
- C4 -
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
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
T
EGY
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
T
N
G
V
I
T
-----------
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
28
HHSearch
74.07
16%
-123
- C4 -
2LNL
-
CXCR1_HUMAN
A:
[38-323]
-----------------------------------------------------------
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
RTQVIQE
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
23
HHSearch
71.93
19%
-152
- C4 -
2RH1
6
ADRB2_HUMAN (first)
A:
[40-236]
-------------------------------------------------------------------------
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
---
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
T
-----------
N
G
V
I
T
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
-------------------------------------------------------------------------------------------------------------------------------------------------------
24
HHSearch
70.19
22%
-163
- C4 -
3EML
8
ENLYS_BPT4
A:
[21-222]
-------------------------------------------------------------------------
S
S
V
Y
I
T
V
E
L
A
I
A
V
L
A
I
L
G
N
V
L
V
C
W
A
----------
V
W
L
N
S
-----
N
L
Q
---
N
--------------------
V
T
N
Y
F
----------------
V
V
S
L
A
A
A
------
D
I
A
V
G
V
L
A
-
I
P
F
A
I
T
I
S
T
---
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
L
T
Q
S
-------------
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
R
-------
I
P
L
R
Y
N
G
L
---
V
T
G
T
R
A
K
G
I
I
A
-----------
I
C
W
V
L
S
F
A
I
G
-
L
T
P
M
L
G
-
W
N
N
C
G
-----
Q
----------------------
S
Q
G
C
G
E
---
G
Q
V
-------
A
C
L
F
E
DV
V
P
M
N
Y
M
V
Y
F
N
F
F
A
---
C
V
L
V
--------
P
L
L
L
M
L
G
V
Y
L
R
I
F
L
A
A
R
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
G
-
R
N
T
-----------
N
G
V
I
T
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
-------------------------------------------------------------------------------------------------------------------------------------------------------
21
HHSearch
67.84
16%
-152
- C4 -
3UON
2
ACM2_HUMAN (first)
A:
[25-215]
---------------------------------------------------------------------------
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
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
T
-----------
N
G
V
I
T
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
-------------------------------------------------------------------------------------------------------------------------------------------------------
48
Fugue
65.48
19%
-135
- C2 -
4QIQ
1
XYLE_ECOLI
A:
[7-470]
S
Y
I
F
S
I
T
L
V
A
T
L
G
G
L
L
F
G
Y
D
T
A
VISGT
V
E
S
L
N
T
V
F
-
V
A
P
Q
N
L
S
E
S
A
------------
A
N
-------------
S
L
L
G
F
C
V
A
S
A
L
I
G
C
I
I
G
G
A
L
G
G
Y
C
S
N
RFG
R
R
D
S
L
K
I
A
A
V
L
-----
F
F
I
---
S
G
V
G
S
A
WPELGFTSINPDNTV
P
V
Y
L
A
GY
V
P
E
F
V
I
Y
R
I
I
G
G
I
G
V
G
L
A
S
M
L
------
S
P
M
Y
I
A
E
L
-
A
P
A
H
I
R
G
K
L
-
V
S
F
N
Q
F
A
I
I
F
G
Q
L
L
V
Y
C
V
N
Y
F
I
A
R
SGD
A
S
W
L
N
T
D
G
W
R
Y
M
F
A
S
E
C
I
P
A
L
L
F
L
M
L
L
Y
T
VPESP
R
W
L
M
T
L
A
T
---
Q
A
V
Q
E
I
K
H
S
L
D
-----------
R
L
L
M
F
G
V
G
V
I
-
V
I
G
V
M
L
-
S
I
F
Q
Q
-----
F
---------------
V
G
I
N
V
V
L
Y
Y
A
P
E
V
---
F
K
T
L
GAS
T
D
I
A
L
L
Q
T
--
I
I
V
G
V
I
N
L
T
F
T
V
L
---
A
I
M
T
V
DKFGRKP
L
Q
I
I
G
A
L
G
M
A
I
G
M
F
S
L
G
T
A
F
Y
T
Q
------------
A
P
G
-------------------
I
V
A
L
L
S
------
M
L
F
---
Y
V
A
A
F
A
---
M
S
W
G
P
V
--------
C
--
W
V
L
L
S
E
I
F
PNA
I
R
G
K
A
L
A
I
--------
A
-----
V
---
A
--
A
----
Q
W
---------
L
--
A
N
Y
F
V
S
W
T
F
-
P
M
M
DKN
S
W
L
V
A
H
FH
N
G
F
S
Y
W
I
Y
G
C
M
G
-
V
L
A
A
L
F
M
W
--
K
F
V
P
E
T
K
G
K
T
L
-------------------------------------------------------------------------------------------------------------------------------------------------------
22
HHSearch
64.83
19%
-142
- C4 -
3RZE
2
ENLYS_BPT4 (first)
A:
[10-201]
---------------------------------------------------------------------------
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
---
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
T
-----------
N
G
V
I
T
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
-------------------------------------------------------------------------------------------------------------------------------------------------------
29
HHSearch
64.09
18%
-143
- C4 -
3PBL
1
DRD3_HUMAN (first)
A:
[41-227]
----------------------------------------------------------------------------
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
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
T
N
G
V
I
T
K
D
E
A
E
-
K
L
F
N
Q
D
V
D
--
A
A
V
R
G
I
L
R
N
A
K
-------------------------------------------------------------------------------------------------------------------------------------------------------
25
HHSearch
63.70
19%
-135
- C4 -
3ODU
6
CXCR4_HUMAN (first)
A:
[47-240]
-----------------------------------------------------------
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
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
-----------
T
N
G
V
I
T
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
-------------------------------------------------------------------------------------------------------------------------------------------------------