@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 : O2T29_HUMAN: (2016-01-11 )
MANITRMANHTGRLDFILMGLFRQSKHPALLSVVIFVVFLKALSGNAVLILLIHCDAHLHSPMYFFISQLSLMDMAYISVTVPKMLLDQVMGVNKVSAPECGMQMFLYLTLAGSEFFLLATMAYDRYVAICHPLRYPVLMNHRVCLFLASGCWFLGSVDGFMLTPITMSFPFCRSWEIHHFFCEVPAVTILSCSDTSLYETLMYLCCVLMLLIPVTIISSSYLLILLTVHRMNSAEGRKKAFATCSSHLTVVILFYGAAVYTYMLPSSYHTPEKDMMVSVFYTILTPVLNPLIYSLRNKDVMGALKKMLTVRFVL
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)
----------------MA
N
I
T
R
------
M
ANHTG------
R
L
D
---
F
I
L
M
G
---
L
F
RQSK
H
P
A
L
L
--
S
V
V
I
F
V
V
F
L
K
A
LSG--------
N
A
V
L
I
L
L
I
HCDAHLH--
S
P
M
Y
F
F
I
S
Q
L
S
L
M
D
M
A
Y
I
S
VT-
V
P
K
M
L
L
D
Q
V
MGVN-KVSAPECG
M
Q
M
F
L
---
Y
L
T
LAGS
E
F
F
L
L
A
TMAYD
R
Y
V
A
I
CHPLRY
P
V
LMNH
R
V
C
L
F
LASG
C
W
F
LGSVDG--
F
M
L
T
P
I
TMSFPFC---RS
W
E
I
H
H
F
F
-----CEVP--
A
V
-----
T
I
L
SC-------S-------D
T
S
------
L
Y
------
E
T
L
M
Y
L
C
C
V
L
M
L
L
I
P
V
T
I
I-----SS
S
Y
L
L
I
L
L
T
-------------------------
V
-------------HR-MNSA-----------E--------------------G----
R
----
K
K
A
-
F
A
T
------CSS
H
L
T
V
V
I
L
F---------YG
A
A
--------
V
Y
T
Y
MLPSS----Y-----H---T-------P-
E
-------
K
D
--
M
--
M
V
S
V
F
Y
T
I
L
T
P
V
L
N
P
L
----
I
Y
S
LRN
K
D
-----
V
M
G
A
L
K
K
------
M
L
T
V
R
FVL--------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
91.29
21%
-150
- C4 -
2YDO
3
?
A:
[20-303]
-----------------------------------------------------------------------------
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
N
N
C
GQP
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
--------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
89.98
22%
-146
- C4 -
3PWH
1
?
A:
[20-303]
-----------------------------------------------------------------------------
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
P
M
-
L
G
W
N
N
C
GQP--------
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
QPLPGE
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
F
C
P
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
------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
89.80
21%
-156
- C4 -
3VGA
1
AA2AR_HUMAN
A:
[20-303]
-----------------------------------------------------------------------------
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
GQ-------
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
---------------------------------------------------------------------------------------------------------------------------------------------
40
HHSearch
89.77
17%
-151
- C4 -
2Z73
5
OPSD_TODPA
A:
[34-333]
-------------------------------------------------------------
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
LEW
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
--------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
89.40
22%
-143
- C4 -
3REY
1
AA2AR_HUMAN
A:
[20-303]
-----------------------------------------------------------------------------
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
P
M
-
L
G
W
N
N
C
GQP--------
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
QPLPGE
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
F
C
P
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
------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
89.39
22%
-144
- C4 -
3UZC
1
AA2AR_HUMAN
A:
[20-303]
-----------------------------------------------------------------------------
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
P
M
-
L
G
W
N
N
C
GQP--------
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
QPLPG
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
F
C
P
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
89.24
21%
-155
- C4 -
3VG9
8
?
A:
[20-303]
-----------------------------------------------------------------------------
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
CF
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
GQ-------
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
--------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
89.18
21%
-150
- C4 -
2YDV
6
?
A:
[20-303]
-----------------------------------------------------------------------------
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
N
N
C
GQP
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
--------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
88.65
22%
-142
- C4 -
3RFM
1
AA2AR_HUMAN
A:
[20-303]
-----------------------------------------------------------------------------
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
P
M
-
L
G
W
N
N
C
GQP--------
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
QPLPG
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
F
C
P
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
------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
87.90
22%
-144
- C4 -
3UZA
1
AA2AR_HUMAN
A:
[20-303]
-----------------------------------------------------------------------------
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
P
M
-
L
G
W
N
N
C
GQP--------
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
QPLPG
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
F
C
P
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
87.19
21%
-151
- C4 -
4UG2
3
?
A:
[20-303]
-----------------------------------------------------------------------------
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
N
N
C
GQP
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
--------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
87.06
21%
-148
- C4 -
4UHR
1
AA2AR_HUMAN
A:
[20-303]
-----------------------------------------------------------------------------
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
N
N
C
GQP
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
F
C
P
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
--------------------------------------------------------------------------------------------------------------------------------------------
47
Fugue
85.80
16%
-112
- C4 -
1U19
15
OPSD_BOVIN
A:
[4-349]
----------------
M
N
G
T
E
G
PNFYVP
F
S
N
K
T
G
------
V
V
R
SPF
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
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
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
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
LGDDEA
S
T
T
V
S
K
TETSQVAPA-----------------------------------------------------------------------------------------------------------------------
46
Fugue
85.05
16%
-138
- C4 -
1F88
8
OPSD_BOVIN
A:
[1-348]
----------------
M
N
G
T
E
G
PNFYVP
F
S
N
K
T
G
------
V
V
R
---
S
P
F
E
A
PQY
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
QGSDFGP
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
STTVSKTETS
Q
V
A
P
A-----------------------------------------------------------------------------------------------------------------------------
39
HHSearch
83.26
15%
-157
- C4 -
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
---
D
LYL----
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
--------------------------------------------------------------------------------------------------------------------------------------------
48
Fugue
79.93
15%
-135
- 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
EETC
C
D
F
F
TN
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
LN
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
38
HHSearch
78.61
15%
-121
- C4 -
1U19
14
OPSD_BOVIN
A:
[41-326]
--------------------------------------------------------------
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
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
--------------------------------------------------------------------------------------------------------------------------------------------
35
HHSearch
75.87
18%
-126
- C4 -
2LNL
-
CXCR1_HUMAN
A:
[39-324]
-------------------------------------------------------------
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
RTQ
V
IQE
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
----------------------------------------------------------------------------------------------------------------------------------------------
50
Fugue
71.62
17%
-136
- C4 -
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
SDEY
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
P
E
-----------
D
--------------------
G
----
D
----
P
D
N
G
V
N
P
------
G
T
D
F
K
D
I
V
C
P
L
---------
C
G
V
G
--------
K
D
Q
F
E
E
V
E
E
----
P
-----
L
---
R
-------
R
-
K
-------
S
I
--
Y
--
L
V
I
I
V
L
T
V
F
A
V
S
Y
I
P
F
H
V
M
K
T
M
N
L
R
A
R
L
DFQTP
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
LAGDTFRRR------------------------------------------------------------------------------------------------------------------
54
Fugue
70.73
17%
-138
- C3 -
2BMF
-
?
A:
[169-618]
MASIED
N
P
E
I
E
D
DIFR
K
K
R
L
T
I
------
M
D
L
H
P
G
AGKTKR
Y
L
P
---
A
I
V
R
E
---
A
I
K
R
G
L
R
T
L
I
L
A
P
T
R
V
V
A
A
E
M
E
E
A
L
R
G
LPIRYQTG
R
E
I
V
D
L
M
C
H
A
T
F
T
M
R
L
L
S
P
I
R
V
P
N
Y
N
L
I
I
M
D
E
A
H
F
--
T
-
D
P
A
S
I
A
A
R
G
Y
I
S
T
-
R
V
E
M
G
E
A
-
A
G
I
F
M
---
T
A
T
P
P
G
S
R
D
P
F
P
Q
S
N
A
P
I
M
D
E
E
R
E
I
P
E
R
S
W
N
S
G
H
E
W
V
T
D
F
K
G
K
T
V
W
F
V
P
S
I
K
A
G
N
D
I
A
A
C
L
R
K
N
G
K
K
V
---
I
Q
L
S
R
K
T
F
D
-----
S
E
Y
I
--
K
T
RTNDW
D
F
V
V
T
-------
T
-------
D
I
S
------
E
M
GANFKA
E
R
V
I
D
P
R
R
C
M
K
P
V
I
L
T
D
G
E
-----
E
R
V
I
L
A
G
P
M
P
-------------------------
V
-------------
T
H
-
S
S
A
A
-----------
Q
--------------------
R
----
R
----
G
R
V
-
G
R
N
------
P
K
N
E
N
D
Q
Y
I
Y
M
G
E
P
L
E
NDED
C
A
H
W
--------
K
E
A
K
M
L
L
D
N
----
I
-----
N
---
T
-------
P
-
E
-------
G
I
--
I
P
S
M
F
E
P
E
R
E
K
V
D
A
I
D
G
E
Y
----
R
L
R
G
E
A
R
K
-----
T
F
V
D
L
M
R
RGDLP
V
W
L
A
Y
R
V
A
A
E
GINYADRRWCFDGVKNNQILEENV
E
V
E
I
WTKE
G
E
R
K
K
LKPRWLDARIYSD
P
L
A
L
K
E
F
K
E
F
A
A
GRK--------------------------------------------------------------------------