@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 : OR5T3_HUMAN: (2016-01-13 )
MDSTFTGYNLYNLQVKTEMDKLSSGLDIYRNPLKNKTEVTMFILTGFTDDFELQVFLFLLFFAIYLFTLIGNLGLVVLVIEDSWLHNPMYYFLSVLSFLDACYSTVVTPKMLVNFLAKNKSISFIGCATQMLLFVTFGTTECFLLAAMAYDHYVAIYNPLLYSVSMSPRVYVPLITASYVAGILHATIHIVATFSLSFCGSNEIRHVFCDMPPLLAISCSDTHTNQLLLFYFVGSIEIVTILIVLISCDFILLSILKMHSAKGRQKAFSTCGSHLTGVTIYHGTILVSYMRPSSSYASDHDIIVSIFYTIVIPKLNPIIYSLRNKEVKKAVKKMLKLVYK
Atome Classification :
(20 SA)
-----.........10........20........30........40........50........60........70......---------------..80........90...------------.....100.....-..---110....-...120.......130....-----------...140.......150--.........---160...---....170.......180.......------190...-----------------...---------------------.200.......210-------....-.....--------220-----...--......230--------------------------------.......240.......250---.......260----------------------------------------------------------------------------------------------------------------------------------------------------------------.-------------------------------------------------------------------------------------------------------------------------------------------------------------------...----.....270...---..-..280.......290----------....------------.---.-------..-------300.....----..310....-----------...320--........330.......340--------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
-----MDSTFTG
Y
N
L
Y
N
L
Q
V
K
T
E
M
D
K
L
S
S
G
L
D
I
Y
RNPLKNK
T
E
V
T
M
F
I
L
TGFTD
D
F
E
L
Q
V
F
L
F
L
L
F
F
A
I
Y
L
F
T
L
IGNL
G
L
V
V
---------------
L
V
I
EDSWLH
N
P
M
Y
Y
F
L
S
------------
V
L
S
F
L
D
A
C
Y
S
TVV-
T
P
---
K
M
L
V
N
F
L
-AKNK
S
I
S
F
I
G
C
A
T
Q
M
L
L
F
V
T
-----------FGT
T
E
C
F
L
L
A
A
M
A
Y
----
D
H
Y
V
A
I
Y
N
P
---
L
L
Y
SVS---MS
P
R
V
Y
V
P
L
I
T
A
S
Y
V
A
G
I
L
H
A
T
I
H
------
I
V
A
T
F
S
-----------------
L
S
F---------------------CGSNE
I
R
H
VFCD---------MP
P
L
-
L
A
I
SC--------S-------DTH--T
N
Q
L
L
L
F
Y
F
--------------------------------VG
S
I
E
I
V
T
I
L
I
V
L
I
S
C
D
F
I
L
---
L
S
I
L
K
M
HS------------------------------------------------------------------------------------------------------------------------------------------------------------------A-------------------------------------------------------------------------------------------------------------------------------------------------------------------K
G
R
----
Q
K
A
F
S
T
CGSH
L
---
T
G
-
V
T
I
YH
G
T
I
L
V
S
Y
MR-----------PSSS------------Y---A-------SD-------
H
D
I
I
V
S
I
F
----
Y
T
I
VIPKL
N
-----------
P
I
I
Y
S
---
L
R
N
K
E
V
K
K
A
V
K
K
M
L
K
L
VYK----------------------
23
HHSearch
88.46
18%
-134
- C3 -
2RH1
16
ADRB2_HUMAN (first)
A:
[40-477]
----------------------------------------------------------
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
TEGYYTIGIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYKF-
C
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
K
E
----
H
K
A
L
K
T
L
G
I
I
M
---
G
T
-
F
T
L
C
W
L
P
F
F
I
V
N
I
V
-----------
H
V
I
Q
------------
D
NL-
I
-------
R
K
-------
E
V
Y
I
L
L
N
W
----
I
G
Y
V
N
S
G
F
N
-----------
P
L
I
Y
C
----
R
S
P
D
F
R
I
A
F
Q
E
L
L
C
L
-------------------------
8
PsiBlast_PDB
85.03
19%
-152
- C3 -
3VG9
8
?
A:
[15-304]
-------------------------------------------------------------------
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
TPMLGWNNCGQSQG-------
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
----------------------
9
PsiBlast_PDB
83.95
19%
-148
- C3 -
3VGA
1
AA2AR_HUMAN
A:
[15-304]
-------------------------------------------------------------------
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
PMLGWNNCGQSQG-------
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
----------------------
20
PsiBlast_PDB
83.83
19%
-152
- C3 -
2YDO
3
?
A:
[15-304]
-------------------------------------------------------------------
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
PMLGWNNCGQPK
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
----------------------
7
PsiBlast_PDB
83.65
19%
-149
- C3 -
3UZC
1
AA2AR_HUMAN
A:
[15-304]
-------------------------------------------------------------------
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
PMLGWNNCGQPG--------
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
FC
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
-------------------------
4
PsiBlast_PDB
83.50
19%
-149
- C3 -
3REY
1
AA2AR_HUMAN
A:
[15-304]
-------------------------------------------------------------------
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
PMLGWNNCGQPG--------
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
FC
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
-------------------------
6
PsiBlast_PDB
83.34
19%
-152
- C3 -
3UZA
1
AA2AR_HUMAN
A:
[15-304]
-------------------------------------------------------------------
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
PMLGWNNCGQPG--------
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
FC
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
82.89
19%
-148
- C3 -
3RFM
1
AA2AR_HUMAN
A:
[15-304]
-------------------------------------------------------------------
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
PMLGWNNCGQPG--------
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
FC
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
-------------------------
3
PsiBlast_PDB
82.87
19%
-142
- C3 -
3PWH
1
?
A:
[15-304]
-------------------------------------------------------------------
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
PMLGWNNCGQPG--------
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
FC
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
-------------------------
28
HHSearch
78.57
17%
-139
* C3 *
2Z73
5
OPSD_TODPA
A:
[31-332]
-------------------------------------------------------
D
A
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
------------
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
----------------------
22
HHSearch
78.02
18%
-133
- C3 -
3UON
4
ACM2_HUMAN (first)
A:
[25-457]
------------------------------------------------------------
F
I
V
L
V
A
G
S
L
S
L
V
T
I
I
G
N
I
L
V
M
V
---------------
S
I
K
V
N
R
H
L
Q
T
V
N
N
Y
F
L
F
------------
S
L
A
C
A
D
L
I
I
G
V
F
S
-
M
N
---
L
Y
T
L
Y
T
V
-
I
G
Y
W
P
L
G
P
V
V
C
D
L
W
L
A
L
D
Y
V
-----------
V
S
N
A
S
V
M
N
L
L
I
I
S
F
----
D
R
Y
F
C
V
T
K
P
---
L
T
Y
P
V
K
---
R
T
T
K
M
A
G
M
M
I
A
A
A
W
V
L
S
F
I
L
W
A
P
A
------
I
L
F
W
Q
F
-----------------
I
V
-----------------------
G
V
R
T
V
E
D
G
E
C
Y
---------
I
Q
F
F
---------------------------
S
N
A
A
V
T
F
G
T
--------------------------------
A
I
A
A
F
Y
L
P
V
I
I
M
T
V
L
Y
W
H
I
S
---
R
A
S
K
S
R
I
N
I
F
E
M
L
R
I
D
EGLRL
K
I
Y
K
D
TEG
Y
Y
T
I
GIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKL
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYPP-
P
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
R
E
----
K
K
V
T
R
T
I
L
A
I
L
---
L
A
-
F
I
I
T
W
A
P
Y
N
V
M
V
L
I
-----------
N
T
F
C
------------
A
PC-
I
-------
P
N
-------
T
V
W
T
I
G
Y
W
----
L
C
Y
I
N
S
T
I
N
-----------
P
A
C
Y
A
---
L
C
N
A
T
F
K
K
T
F
K
H
L
L
M
--------------------------
40
Fugue
77.98
17%
-99
- 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
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
TVK
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
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
PLGDDEA
S
T
T
V
S
K
TETSQVAPA
24
HHSearch
77.53
18%
-133
- C3 -
3RZE
5
ENLYS_BPT4 (first)
A:
[10-443]
------------------------------------------------------------
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
TEG
Y
Y
T
I
G
IGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKL
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYLH-
M
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
R
E
----
R
K
A
A
K
Q
L
G
F
I
M
---
A
A
-
F
I
L
C
W
I
P
Y
F
I
F
F
M
V
-----------
I
A
F
C
------------
K
NC-
C
-------
N
E
-------
H
L
H
M
F
T
I
W
----
L
G
Y
I
N
S
T
L
N
-----------
P
L
I
Y
P
---
L
C
N
E
N
F
K
K
T
F
K
R
I
L
H
I
-------------------------
39
Fugue
77.34
15%
-112
- 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
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
PSTTVSKTETS
Q
V
A
P
A------
32
HHSearch
76.56
14%
-136
- C3 -
2KS9
1
NK1R_HUMAN
A:
[33-324]
-----------------------------------------------------------
V
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
PGDSSDRYH
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
LYLKKF-
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
----------------------
31
HHSearch
76.05
19%
-136
- C3 -
3PBL
2
DRD3_HUMAN (first)
A:
[41-472]
-------------------------------------------------------------
Y
A
L
S
Y
C
A
L
I
L
A
I
V
F
G
N
G
L
V
C
M
---------------
A
V
L
K
E
R
A
L
Q
T
T
T
N
Y
L
V
V
------------
S
L
A
V
A
D
L
L
V
A
T
L
V
-
M
P
---
W
V
V
Y
L
E
V
T
G
G
V
W
N
F
S
R
I
C
C
D
V
F
V
T
L
D
V
M
-----------
M
C
T
A
S
I
W
N
L
C
A
I
S
I
----
D
R
Y
T
A
V
V
M
P
---
V
H
Y
Q
H
G
T
G
Q
S
S
C
R
R
V
A
L
M
I
T
A
V
W
V
L
A
F
A
V
S
C
P
L
------
L
F
G
F
N
T
---------------------------------------------
T
G
D
P
T
V
C
S
---------
I
S
N
----------------------------
P
-
D
-
F
V
I
Y
S
--------------------------------
S
V
V
S
F
Y
L
P
F
G
V
T
V
L
V
Y
A
R
I
Y
---
V
V
L
K
Q
R
R
R
------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
N
I
F
E
M
L
R
I
D
E
GLRL
K
I
Y
K
D
TEG
Y
Y
T
I
G
IGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
T
GTWDAYGVP
L
R
E
----
K
K
A
T
Q
M
V
A
I
V
L
---
G
A
-
F
I
V
C
W
L
P
F
F
L
T
H
V
L
-----------
N
T
H
C
------------
Q
TCH
V
-------
S
P
-------
E
L
Y
S
A
T
T
W
----
L
G
Y
V
N
S
A
L
N
-----------
P
V
I
Y
T
---
T
F
N
I
E
F
R
K
A
F
L
K
I
L
S
C
-------------------------
29
HHSearch
75.21
16%
-130
- C3 -
3V2Y
1
ENLYS_BPT4
A:
[60-495]
-------------------------------------------------------
E
N
S
I
K
L
T
S
V
V
F
I
L
I
C
C
F
I
I
L
E
N
I
F
V
L
L
---------------
T
I
W
K
T
K
K
F
H
R
P
M
Y
Y
F
I
G
------------
N
L
A
L
S
D
L
L
A
G
V
A
Y
-
T
A
---
N
L
L
L
S
G
A
--
T
T
Y
K
L
T
P
A
Q
W
F
L
R
E
G
S
M
F
V
-----------
A
L
S
A
S
V
F
S
L
L
A
I
A
I
----
E
R
Y
I
T
M
L
K
--------------
N
N
F
R
L
F
L
L
I
S
A
C
W
V
I
S
L
I
L
G
G
L
P
------
I
M
G
W
N
C
---------------------------------------------
I
S
A
L
S
S
C
S
---------
T
V
L
P
-
L
-------------------------
Y
H
K
H
Y
-
I
L
F
--------------------------------
C
T
T
V
F
T
L
L
L
L
S
I
V
I
L
Y
C
R
I
Y
---
S
L
V
R
T
R
N
I
F
E
M
L
R
IDEGLRL
K
I
Y
K
D
TE
G
Y
Y
T
I
G
IGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYA
S
R
-
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
E
N
----
V
A
L
L
K
T
V
I
I
V
L
---
S
V
-
F
I
A
C
W
A
P
L
F
I
L
L
L
L
-----------
D
V
G
C
------------
K
---
V
KTC
D
---
I
L
-------
F
R
A
E
Y
F
L
V
----
L
A
V
L
N
S
G
T
N
-----------
P
I
I
Y
T
---
L
T
N
K
E
M
R
R
A
F
I
R
I
M
G
R
P
L
-----------------------
27
HHSearch
73.94
16%
-147
- C3 -
3EML
13
ENLYS_BPT4
A:
[22-468]
-----------------------------------------------------------
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
D
VV
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
GLRL
K
I
Y
K
D
TEGYYTIGIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTW
D
A
Y
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
PDCS--------
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
----------------------
46
Fugue
65.27
17%
-142
- C1 -
4MGR
3
GABR_BACSU
A:
[2-469]
D
I
T
I
T
L
D
R
S
E
Q
A
D
Y
I
Y
Q
Q
I
Y
Q
K
L
K
K
E
I
L
S
R
N
L
L
P
H
S
K
V
P
S
K
R
E
L
A
E
N
L
K
V
---
S
V
N
S
V
N
S
A
Y
Q
Q
L
L
A
E
G
Y
L
Y
A
-
I
E
R
K
G
F
F
V
E
ELDMFSA
E
E
H
P
P
F
A
L
P
D
D
L
K
E
I
H
I
D
Q
S
D
W
I
S
FSHMSSDTDHFP
I
K
S
W
F
R
C
E
Q
K
A
A
S
-
R
S
---
Y
R
T
L
G
D
M
-
S
H
P
Q
G
I
Y
E
V
R
A
A
I
T
R
L
I
S
L
T
RG
V
K
C
R
PEQ
M
I
I
G
A
G
T
Q
V
L
M
Q
L
L
T
E
L
L
PK
E
A
V
Y
A
M
E
E
P
GY
R
R
M
Y
Q
L
L
---
K
N
A
G
K
Q
V
K
T
I
M
L
D
E
-
K
G
M
S
I
A
E
I
T
R
QQPD
V
L
V
T
T
P
S
HQFPSG
T
I
M
P
V
S
R
R
I
Q
L
L
N
W
---------------------
A
A
E
E
P
R
R
Y
I
I
E
D
D
Y
DSEFTYD
V
D
S
I
-
P
A
L
Q
S
--------
L
-------
D
R
F
--
Q
N
V
I
Y
M
G
T
F
SKSLLPG
L
R
I
S
Y
M
V
L
P
P
E
L
L
R
A
Y
K
Q
R
GYDLQT
C
S
S
L
T
Q
L
T
L
Q
E
F
I
E
S
G
E
Y
Q
K
H
--
I
K
K
M
K
Q
H
Y
------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
K
R
----
E
R
L
I
T
A
L
E
A
E
F
---
S
G
E
V
T
V
K
G
A
N
A
G
L
H
F
V
T
-----------
E
F
D
T
------------
R
---
R
-------
T
E
-------
Q
D
I
L
S
H
A
A
G
L
Q
L
E
I
F
G
M
S
R
F
N
LKENKRQTGR
P
A
L
I
I
G
F
AR
L
K
E
E
D
I
Q
E
G
V
Q
R
L
F
K
A
V
Y
-----------------------
21
HHSearch
64.64
15%
-127
- C3 -
3ODU
6
CXCR4_HUMAN (first)
A:
[45-496]
-------------------------------------------------------
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
S
------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
I
F
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
TEG
Y
Y
T
I
GIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
IGRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKLK
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KRW
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
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
F
H
C
C
L
N
-----------
P
I
L
Y
A
---
F
L
G
A
K
F
K
T
S
A
Q
H
A
L
T
S
G
R
P
----------------------