@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 : OR8G1_HUMAN: (2016-01-14 )
MSGENNSSVTEFILAGLSEQPELQLPLFLLFLGIYVVTVVGNLGMTTLIWLSSHLHTPMYYFLSSLSFIDFCHSTVITPKMLVNFVTEKNIISYPECMTQLYFFLVFAIAECHMLAAMAYDRYMAICSPLLYSVIISNKACFSLILGVYIIGLVCASVHTGCMFRVQFCKFDLINHYFCDLLPLLKLSCSSIYVNKLLILCVGAFNILVPSLTILCSYIFIIASILHIRSTEGRSKAFSTCSSHMLAVVIFFGSAAFMYLQPSSISSMDQGKVSSVFYTIIVPMLNPLIYSLRNKDVHVSLKKMLQRRTLL
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)
MSGE-----------NN
S
S
V
T
--------------
E
F
I
L
AGLS--EQPELQ
L
P
L
F
L
L
F
L
G
I
Y
V
V
T
V
VGNLG
M
T
T
L
I
W
L
S
SHLH
T
P
M
Y
Y
F
L
S
S
L
S
F
I
D
F
C
H
STVI-
T
P
K
M
L
V
N
F
VTEKNII
S
Y
P
E
C
M
T
Q
L
Y
F
F
L
V
F
A
I
A
E
C
H
M
L
A
A
M
A
Y
D
R
Y
M
A
I
C
S
P
L
L
Y
S
V
I
ISN
K
A
C
F
S
L
I
L
G
V
Y
I
----
I
G
L
V
-------
C
A
S
VHT
G
C
M
F
R
V
---
Q
F
C
K
F
D
L
I
N
H
Y
F
C
D
L
---
L
P
L
-
L
K
L
S
C
-------
S
-------
S
I
Y
V
--
N
-
K
L
L
I
L
C
V
G
A
F
N
I
L
V
P
S
L
T
I
L
C
S
Y
I
F
I
-
I
A
----
S
I
---
L
H
IRST-----------E--------------------GR----
S
----
K
A
F
S
T
C
S
S
H
M
L
---
A
---
V
V
I
F
FG
S
A
A
F
M
Y
LQPS--S--I----------S-------S--MDQG
K
-------
V
S
S
V
F
Y
T
I
I
V
----
P
----
M
L
N
P
L
I
Y
S
LRNKD
V
H
V
S
L
K
K
M
L
Q
R
RTLL-----------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
91.88
22%
-169
- C3 -
4UHR
1
AA2AR_HUMAN
A:
[14-308]
----------------------------------------------------------
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
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
PMLGWNN
C
G
Q
P
K
E
G
-
K
A
------
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
PLPG
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
FCP
D
--
C
-
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
90.96
23%
-167
- C3 -
3REY
1
AA2AR_HUMAN
A:
[14-305]
----------------------------------------------------------
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
L
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
A
Q
S
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
PMLGWNN
C
G
Q
P
------------
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
A
----
A
A
R
--
R
Q
L
K
Q
M
-----------
E
--------------------
S
Q
PLPG
E
----
R
A
R
S
T
L
Q
K
E
V
H
---
A
A
K
S
A
A
I
I
A
G
L
F
A
L
C
W
L
P
L
H
--
I
--
I
----------
N
C
F
T
F
FCP
D
--
C
S
H
A
P
-------
L
W
L
M
Y
L
A
I
V
L
----
A
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
90.58
23%
-163
- C3 -
3PWH
1
?
A:
[14-305]
----------------------------------------------------------
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
L
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
A
Q
S
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
PMLGWNN
C
G
Q
P
------------
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
A
----
A
A
R
--
R
Q
L
K
Q
M
-----------
E
--------------------
S
Q
PLPG
E
----
R
A
R
S
T
L
Q
K
E
V
H
---
A
A
K
S
A
A
I
I
A
G
L
F
A
L
C
W
L
P
L
H
--
I
--
I
----------
N
C
F
T
F
FCP
D
--
C
S
H
A
P
-------
L
W
L
M
Y
L
A
I
V
L
----
A
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
90.57
22%
-159
- C3 -
3VGA
1
AA2AR_HUMAN
A:
[14-308]
----------------------------------------------------------
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
PMLGWNN
C
G
Q
--------
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
PLPG
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
90.57
23%
-165
- C3 -
3RFM
1
AA2AR_HUMAN
A:
[14-305]
----------------------------------------------------------
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
L
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
A
Q
S
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
PMLGWNN
C
G
Q
P
------------
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
A
----
A
A
R
--
R
Q
L
K
Q
M
-----------
E
--------------------
S
Q
PLPG
E
----
R
A
R
S
T
L
Q
K
E
V
H
---
A
A
K
S
A
A
I
I
A
G
L
F
A
L
C
W
L
P
L
H
--
I
--
I
----------
N
C
F
T
F
FCP
D
--
C
S
H
A
P
-------
L
W
L
M
Y
L
A
I
V
L
----
A
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
90.47
23%
-166
- C3 -
3UZC
1
AA2AR_HUMAN
A:
[14-305]
----------------------------------------------------------
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
L
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
A
Q
S
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
PMLGWNN
C
G
Q
P
------------
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
A
----
A
A
R
--
R
Q
L
K
Q
M
-----------
E
--------------------
S
Q
PLPG
E
----
R
A
R
S
T
L
Q
K
E
V
H
---
A
A
K
S
A
A
I
I
A
G
L
F
A
L
C
W
L
P
L
H
--
I
--
I
----------
N
C
F
T
F
FCP
D
--
C
S
H
A
P
-------
L
W
L
M
Y
L
A
I
V
L
----
A
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
90.23
23%
-167
- C3 -
3UZA
1
AA2AR_HUMAN
A:
[14-305]
----------------------------------------------------------
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
L
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
A
Q
S
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
PMLGWNN
C
G
Q
P
------------
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
A
----
A
A
R
--
R
Q
L
K
Q
M
-----------
E
--------------------
S
Q
PLPG
E
----
R
A
R
S
T
L
Q
K
E
V
H
---
A
A
K
S
A
A
I
I
A
G
L
F
A
L
C
W
L
P
L
H
--
I
--
I
----------
N
C
F
T
F
FCP
D
--
C
S
H
A
P
-------
L
W
L
M
Y
L
A
I
V
L
----
A
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
89.51
22%
-166
- C3 -
3VG9
8
?
A:
[14-308]
----------------------------------------------------------
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
PMLGWNN
C
G
Q
--------
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
PLPG
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
85.00
22%
-166
- C3 -
2YDO
3
?
A:
[14-308]
----------------------------------------------------------
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
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
PMLGWNN
C
G
Q
P
K
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
84.68
22%
-168
- C3 -
2YDV
6
?
A:
[14-308]
----------------------------------------------------------
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
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
PMLGWNN
C
G
Q
P
K
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
84.01
22%
-167
- C3 -
4UG2
3
?
A:
[14-308]
----------------------------------------------------------
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
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
PMLGWNN
C
G
Q
P
K
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
83.29
19%
-158
- C3 -
2Z73
5
OPSD_TODPA
A:
[34-332]
--------------------------------------------------
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
-------
V
--
T
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
29
HHSearch
82.13
19%
-153
- C3 -
2KS9
1
NK1R_HUMAN
A:
[34-324]
----------------------------------------------------
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
GDSSDRYH
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
DLYL---
K
KF
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
40
Fugue
78.15
17%
-142
- C3 -
1F88
8
OPSD_BOVIN
A:
[1-348]
M
N
G
T
-----------
E
G
P
N
F
Y
VPFSNKTGVVRSPF
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
DYYTPH
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
DFGPIFM
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
STTVSKTETS
Q
V
A
P
A--------------------------------------------------------------------------------------------------------------------------------------------------
41
Fugue
72.49
17%
-126
- C3 -
1U19
15
OPSD_BOVIN
A:
[4-349]
M
N
G
T
E
G
PNFYVPFSN
K
T
G
V
V
R
--------------
S
P
F
E
A
P
Q
Y
YL
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
DYYTP
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
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
LGDDEA
S
T
T
V
S
K
TETSQVAPA--------------------------------------------------------------------------------------------------------------------------------------------
45
Fugue
71.92
15%
-136
- 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
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
ATH
Q
E
A
I
N
C
Y
A
E
E
T
C
C
D
F
FTN
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
P
V
Y
D
S
L
D
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---------------------
42
Fugue
68.98
14%
-134
- 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
GL
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
TKS
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
L
D
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
31
HHSearch
66.37
14%
-139
* C3 *
1U19
14
OPSD_BOVIN
A:
[42-326]
----------------------------------------------------
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
QESA
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
27
HHSearch
65.74
14%
-124
- C3 -
2LNL
-
CXCR1_HUMAN
A:
[39-323]
--------------------------------------------------
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
QVIQE
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
25
HHSearch
63.69
21%
-176
- C3 -
3EML
8
ENLYS_BPT4
A:
[23-221]
----------------------------------------------------
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
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
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------