@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 : OXGR1_HUMAN: (2016-01-14 )
MNEPLDYLANASDFPDYAAAFGNCTDENIPLKMHYLPVIYGIIFLVGFPGNAVVISTYIFKMRPWKSSTIIMLNLACTDLLYLTSLPFLIHYYASGENWIFGDFMCKFIRFSFHFNLYSSILFLTCFSIFRYCVIIHPMSCFSIHKTRCAVVACAVVWIISLVAVIPMTFLITSTNRTNRSACLDLTSSDELNTIKWYNLILTATTFCLPLVIVTLCYTTIIHTLTHGLQTDSCLKQKARRLTILLLLAFYVCFLPFHILRVIRIESRLLSISCSIENQIHEAYIVSRPLAALNTFGNLLLYVVVSDNFQQAVCSTVRCKVSGNLEQAKKISYSNNP
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.....---------------------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MN--E
P
L
D
Y
LANASDF
P
D
Y
A
A
A
FGNC-TDENI--
P
L
K
M
H
Y
L
P
V
I
Y
G
I
I
F
L
VGFPG
N
A
V
V
I
S
T
Y
I
F
K
MRPWKS
S
T
I
I
M
L
NLA
C
T
D
L
L
Y
-
L
TS-
L
P
F
L
I
H
Y
YASGENW
I
F
G
D
F
M
C
K
F
I
R
F
S
F
H
F
N
L
Y
S
S
I
L
F
L
T
C
F
S
I
F
R
Y
C
V
I
IHP
M
S
C
F
S
I
---
H
K
T
R
C
A
V
V
A
C
A
V
V
W
I
I
S
L
V
A
V
I
P
M
T
F
----
L
-
I
-TSTNR---T-NR
S
-
A
C
L
-DLTSSDEL-
N
T
I
K
W
Y
N
-
L
I
L
T
A
T
-----
T
F
C
L
P
L
V
I
V
T
L
C
Y
T
T
I
I
H
T
L
----------------------
T
HGL-----------------------Q-----------------------------------------------------------------------------------------------------------------------------------------------------------------
T
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
D
S
C
-------------------------------------------------
L
K
Q
K
A
R
------
R
L
T
I
L
L
L
L
A
---
F
Y
V
C
F
L
P
F
H
I
L
R
V
----
I
R
I
E
S
--
R
L
---
L
S
--
I
-
S
C
SI---------EN
Q
I
H
E
A
Y
IVSR---
P
--
L
A
A
L
N
T
FG
N
L
L
L
Y
V
V
VS--D
N
F
Q
Q
A
V
C
S
T
V
R
C
K
-----VSG
N
L
E
Q
A
K
KISYSNNP---------------------------------------------------------------------------------------------------------------------------------------
41
Fugue
97.89
37%
-160
- C3 -
4XNV
15
P2RY1_HUMAN (first)
A:
[38-382]
----------------------
S
F
K
C
-
A
L
T
K
T
--
G
F
Q
F
Y
Y
L
P
A
V
Y
I
L
V
F
I
I
G
F
L
G
N
S
V
A
I
W
M
F
V
F
H
M
K
P
W
S
G
I
S
V
Y
M
F
N
L
A
L
A
D
F
L
Y
-
V
L
T
-
L
P
A
L
I
F
Y
Y
F
N
K
T
D
W
I
F
G
D
A
M
C
K
L
Q
R
F
I
F
H
V
N
L
Y
G
S
I
L
F
L
T
C
I
S
A
H
R
Y
S
G
V
V
Y
P
K
S
-
L
G
R
---
L
K
K
K
N
A
I
C
I
S
V
L
V
W
L
I
V
V
V
A
I
S
P
I
L
F
----
Y
-
S
G
T
G
V
R
K
---
N
-
K
T
I
-
T
C
Y
-
D
T
T
S
D
E
Y
L
-
R
S
Y
F
I
Y
S
-
M
C
T
T
V
A
-----
M
F
C
V
P
L
V
L
I
L
G
C
Y
G
L
I
V
R
A
L
----------------------
I
Y
K
M
-----------------------
K
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
K
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
Y
T
C
TVCG
Y
I
Y
N
PEDGDPDNGVNPGTDFKDIVCPLCGVGKDQ
F
E
E
V
EE
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
DFQ
T
P
--
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
L
A
G
--
D
T
F
R
R
R
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
95.40
31%
-160
- C3 -
4XNV
15
P2RY1_HUMAN (first)
A:
[40-382]
------------------------
K
C
-
A
L
T
K
T
--
G
F
Q
F
Y
Y
L
P
A
V
Y
I
L
V
F
I
I
G
F
L
G
N
S
V
A
I
W
M
F
V
F
H
M
K
P
W
S
G
I
S
V
Y
M
F
N
L
A
L
A
D
F
L
Y
-
V
L
T
-
L
P
A
L
I
F
Y
Y
F
N
K
T
D
W
I
F
G
D
A
M
C
K
L
Q
R
F
I
F
H
V
N
L
Y
G
S
I
L
F
L
T
C
I
S
A
H
R
Y
S
G
V
V
Y
P
-
K
S
L
G
R
---
L
K
K
K
N
A
I
C
I
S
V
L
V
W
L
I
V
V
V
A
I
S
P
I
L
F
----
Y
-
S
-
G
T
G
V
R
---
K
-
N
K
T
I
T
C
Y
-
D
T
T
S
D
E
Y
L
-
R
S
Y
F
I
Y
S
-
M
C
T
T
V
A
-----
M
F
C
V
P
L
V
L
I
L
G
C
Y
G
L
I
V
R
A
L
----------------------
I
Y
K
M
-----------------------
K
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
K
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
Y
T
C
TVCG
Y
I
Y
N
PEDGDPDNGVNPGTDFKDIVCPLCGVGKDQ
F
E
E
V
EE
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
DFQ
T
P
--
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
L
A
G
--
D
T
F
R
R
R
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
94.51
31%
-162
- C3 -
4XNW
2
RUBR_CLOPA
A:
[40-382]
------------------------
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
L
K
S
L
G
R
---
L
K
K
K
N
A
I
C
I
S
V
L
V
W
L
I
V
V
V
A
I
S
P
I
L
F
----
Y
-
S
-
G
T
G
V
R
---
K
-
N
K
T
I
T
C
Y
-
D
T
T
S
D
E
Y
L
-
R
S
Y
F
I
Y
S
-
M
C
T
T
V
A
-----
M
F
C
V
P
L
V
L
I
L
G
C
Y
G
L
I
V
R
A
L
----------------------
I
Y
K
M
-----------------------
K
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
K
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
Y
T
C
TVCG
Y
I
Y
N
PEDGDPDNGVNPGTDFKDIPDDWVCPLCGVGKDQ
F
E
E
V
EE
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
DFQ
T
P
--
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
L
A
G
--
D
T
F
R
R
R
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
94.47
31%
-160
- C3 -
4XNW
2
RUBR_CLOPA
C:
[40-386]
------------------------
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
L
K
S
L
G
R
---
L
K
K
K
N
A
I
C
I
S
V
L
V
W
L
I
V
V
V
A
I
S
P
I
L
F
----
Y
-
S
-
G
T
G
V
R
---
K
-
N
K
T
I
T
C
Y
-
D
T
T
S
D
E
Y
L
-
R
S
Y
F
I
Y
S
-
M
C
T
T
V
A
-----
M
F
C
V
P
L
V
L
I
L
G
C
Y
G
L
I
V
R
A
L
----------------------
I
Y
K
M
-----------------------
K
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
K
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
Y
T
C
TVCGYIYNPEDGDPDNGVNPGTDFKDIPDDWVCPLCGVGKDQFEEVEEP
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
DFQ
T
P
--
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
L
A
G
--
D
T
F
R
R
R
L
S
R
A
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
22
HHSearch
86.68
28%
-151
- C3 -
3ODU
6
CXCR4_HUMAN (first)
A:
[44-498]
-------------------------------
A
--
N
F
N
K
I
F
L
P
T
I
Y
S
I
I
F
L
T
G
I
V
G
N
G
L
V
I
L
V
M
G
Y
Q
K
K
L
R
S
M
T
D
K
Y
R
L
H
L
S
V
A
D
L
L
F
-
V
I
T
-
L
P
F
W
A
V
D
A
V
--
A
N
W
Y
F
G
N
F
L
C
K
A
V
H
V
I
Y
T
V
N
L
Y
S
S
V
W
I
L
A
F
I
S
L
D
R
Y
L
A
I
V
H
A
T
N
S
Q
R
P
---
R
K
L
L
A
E
K
V
V
Y
V
G
V
W
I
P
A
L
L
L
T
I
P
D
F
I
----
F
-
A
-
N
V
S
E
A
---
D
-
D
R
Y
-
I
C
D
-
R
F
Y
P
N
D
L
---
W
V
V
V
F
Q
-
F
Q
H
I
M
V
-----
G
L
I
L
P
G
I
V
I
L
S
C
Y
C
I
I
I
S
K
L
----------------------
S
H
S
G
-----------------------
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
TGTWDAYG
S
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
K
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
---
E
I
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
L
E
V
L
F
Q
------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
82.23
22%
-169
- C3 -
4MBS
8
CCR5_HUMAN (first)
A:
[35-358]
----------------------------------------
L
P
P
L
Y
S
L
V
F
I
F
G
F
V
G
N
M
L
V
I
L
I
L
I
N
Y
K
R
L
K
S
M
T
D
I
Y
L
L
N
L
A
I
S
D
L
F
F
-
L
L
T
-
V
P
F
W
A
H
Y
A
A
A
--
Q
W
D
F
G
N
T
M
C
Q
L
L
T
G
L
Y
F
I
G
F
F
S
G
I
F
F
I
I
L
L
T
I
D
R
Y
L
A
V
V
H
A
V
F
A
L
K
A
---
R
T
V
T
F
G
V
V
T
S
V
I
T
W
V
V
A
V
F
A
S
L
P
N
I
I
----
F
-
T
-
R
S
Q
K
E
---
G
-
L
H
Y
-
T
C
S
-
S
H
F
P
Y
S
Q
Y
-
Q
F
W
K
N
F
Q
T
L
K
I
V
I
L
-----
G
L
V
L
P
L
L
V
M
V
I
C
Y
S
G
I
L
K
T
L
L
R
M
K
K
Y
T
C
TVCG
Y
I
Y
N
PEDGDP
D
N
G
V
NPGTDFKDIPDDWVCPLCGVGKD
Q
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
F
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
E
E
V
-------------------------------------------------
E
E
E
K
K
R
H
R
D
V--
R
L
I
F
T
I
M
I
V
---
Y
F
L
F
W
A
P
Y
N
I
V
L
L
----
L
N
T
F
Q
--
E
F
---
F
G
--
L
N
N
C
S
S
---------
S
N
R
L
D
Q
A
M
Q
V
T
E
---
T
--
L
G
M
T
H
C
C
I
N
P
I
I
Y
A
F
V
G
--
E
E
F
R
N
Y
L
L
V
F
F
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
79.78
26%
-170
- C3 -
5C1M
7
?
A:
[23-294]
-------------------------------------------
L
Y
S
I
V
C
V
V
G
L
F
G
N
F
L
V
M
Y
V
I
V
R
Y
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
A
L
A
-
T
S
T
-
L
P
F
Q
S
V
N
Y
L
M
G
-
T
W
P
F
G
N
I
L
C
K
I
V
I
S
I
D
Y
Y
N
M
F
T
S
I
F
T
L
C
T
M
S
V
D
R
Y
I
A
V
C
H
P
V
K
A
L
D
F
---
R
T
P
R
N
A
K
I
V
N
V
C
N
W
I
L
S
S
A
I
G
L
P
V
M
F
----
M
-
A
-
T
T
------
K
-
Y
R
Q
-
G
S
I
-
D
C
T
L
T
F
S
H
-
P
T
W
Y
W
E
N
-
L
L
K
I
C
V
F
I
F
--
A
F
I
M
P
V
L
I
I
T
V
C
Y
G
L
M
I
L
R
L
-----------------------
K
S
V
-----------------------
R
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
M
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
L
S
G
-------------------------------------------------
S
K
E
K
D
R
N
L
R
R
I
T
R
M
V
L
V
V
V
A
V
---
F
I
V
C
W
T
P
I
H
I
Y
V
I
----
I
K
-----
A
L
---
I
T
--
I
-
P
E
T
T
---------
F
Q
T
V
S
W
H
F
C
I
A
-------
L
G
Y
T
N
S
C
L
N
P
V
L
Y
A
F
L
D
--
E
N
F
K
R
C
F
--------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
HHSearch
79.20
23%
-150
- C3 -
2RH1
16
ADRB2_HUMAN (first)
A:
[39-477]
------------------------------------
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
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
TGTWDAYK--
F
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
N
---
L
--------------------
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
78.62
24%
-159
- C3 -
4XT3
2
US28_HCMVA
A:
[33-310]
----------------------
F
T
D
V
-
L
N
Q
S
K
--
P
V
T
L
F
----
L
Y
G
V
V
F
L
F
G
S
I
G
N
F
L
V
I
F
T
I
T
W
R
R
R
I
Q
C
S
G
D
V
Y
F
I
N
L
A
A
A
D
L
L
F
-
V
C
T
-
L
P
L
W
M
Q
Y
L
L
D
H
-----
A
S
V
P
C
T
L
L
T
A
C
F
Y
V
A
M
F
A
S
L
C
F
I
T
E
I
A
L
D
R
Y
Y
A
I
V
Y
----
M
R
Y
---
R
P
V
K
Q
A
C
L
F
S
I
F
W
W
I
F
A
V
I
I
A
I
P
H
F
M
----
V
-
V
-
T
K
K
D
--------
N
-
Q
C
M
-
T
D
Y
D
Y
L
E
V
-
S
Y
P
I
I
L
N
-
V
E
L
M
L
G
-----
A
F
V
I
P
L
S
V
I
S
Y
C
Y
Y
R
I
S
R
I
V
----------------------
A
--------------------------
V
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
S
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
S
R
-------------------------------------------------
H
K
G
R
I
V
------
R
V
L
I
A
V
V
L
V
---
F
I
I
F
W
L
P
Y
H
L
T
L
F
----
V
D
T
L
K
L
L
K
W
---
I
S
--
S
-
S
C
E
F
---------
E
R
S
L
K
R
A
L
I
L
T
E
---
S
--
L
A
F
C
H
C
C
L
N
P
L
L
Y
V
F
V
G
--
T
K
F
R
Q
E
L
H
C
L
L
A
E
--------------------------------------------------------------------------------------------------------------------------------------------------------------
46
Fugue
78.40
23%
-143
- C3 -
3ODU
6
CXCR4_HUMAN (first)
A:
[37-502]
------------------------
P
C
F
R
E
E
N
A
--
N
F
N
K
I
F
L
P
T
I
Y
S
I
I
F
L
T
G
I
V
G
N
G
L
V
I
L
V
M
G
Y
Q
K
K
L
R
S
M
T
D
K
Y
R
L
H
L
S
V
A
D
L
L
F
-
V
I
T
-
L
P
F
W
A
V
D
A
V
A
N
--
W
Y
F
G
N
F
L
C
K
A
V
H
V
I
Y
T
V
N
L
Y
S
S
V
W
I
L
A
F
I
S
L
D
R
Y
L
A
I
V
H
A
T
N
S
Q
R
P
---
R
K
L
L
A
E
K
V
V
Y
V
G
V
W
I
P
A
L
L
L
T
I
P
D
F
I
----
F
-
A
-
N
V
S
E
A
---
D
-
D
R
Y
-
I
C
D
-
R
F
Y
P
N
D
L
W
-
V
V
V
F
Q
F
Q
-
H
I
M
V
G
-------
L
I
L
P
G
I
V
I
L
S
C
Y
C
I
I
I
S
K
L
----------------------
S
H
S
G
-----------------------
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
G
I
G
H
L
L
T
K
S
----
P
S
L
N
A
--
A
K
---
S
E
--
L
-
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
---
D
--
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
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
K
R
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
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
9
PsiBlast_PDB
77.42
24%
-167
- C3 -
4XT1
15
US28_HCMVA
A:
[33-310]
----------------------
F
T
D
V
-
L
N
Q
S
K
--
P
V
T
L
F
----
L
Y
G
V
V
F
L
F
G
S
I
G
N
F
L
V
I
F
T
I
T
W
R
R
R
I
Q
C
S
G
D
V
Y
F
I
N
L
A
A
A
D
L
L
F
-
V
C
T
-
L
P
L
W
M
Q
Y
L
L
D
-------
S
V
P
C
T
L
L
T
A
C
F
Y
V
A
M
F
A
S
L
C
F
I
T
E
I
A
L
D
R
Y
Y
A
I
V
Y
----
M
R
Y
---
R
P
V
K
Q
A
C
L
F
S
I
F
W
W
I
F
A
V
I
I
A
I
P
H
F
M
----
V
-
V
-
T
K
K
D
--------
N
-
Q
C
M
-
T
D
Y
D
Y
L
E
V
-
S
Y
P
I
I
L
N
-
V
E
L
M
L
G
-----
A
F
V
I
P
L
S
V
I
S
Y
C
Y
Y
R
I
S
R
I
V
----------------------
A
--------------------------
V
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
S
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
S
R
-------------------------------------------------
H
K
G
R
I
V
------
R
V
L
I
A
V
V
L
V
---
F
I
I
F
W
L
P
Y
H
L
T
L
F
----
V
D
T
L
K
L
L
K
W
---
I
S
--
S
-
S
C
E
F
---------
E
R
S
L
K
R
A
L
I
L
T
E
---
S
--
L
A
F
C
H
C
C
L
N
P
L
L
Y
V
F
V
G
--
T
K
F
R
Q
E
L
H
C
L
L
A
E
F
-----
R
-------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
76.46
23%
-160
- C3 -
4RWD
6
C562_ECOLX (first)
A:
[128-400]
-------------------------------------------
L
Y
S
A
V
C
A
V
G
L
L
G
N
V
L
V
M
F
G
I
V
R
Y
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
A
L
A
-
T
S
T
-
L
P
F
Q
S
A
K
Y
L
M
-
E
T
W
P
F
G
E
L
L
C
K
A
V
L
S
I
D
Y
Y
N
M
F
T
S
I
F
T
L
T
M
M
S
V
D
R
Y
I
A
V
C
H
P
V
K
A
L
D
F
---
R
T
P
A
K
A
K
L
I
N
I
C
I
W
V
L
A
S
G
V
G
V
P
I
M
V
----
M
-
A
-
V
T
R
P
R
---
D
-
G
A
V
-
V
C
M
------
L
Q
F
-
P
S
P
S
W
Y
W
-
D
T
V
T
K
I
C
V
F
L
F
A
F
V
V
P
I
L
I
I
T
V
C
Y
G
L
M
L
L
R
L
----------------------
R
S
V
R
-----------------------
L
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
L
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
S
G
S
--------------------------------------------------
K
E
K
D
R
S
L
R
R
I
T
R
M
V
L
V
V
V
G
A
---
F
V
V
C
W
A
P
I
H
I
F
V
I
V
W
T
L
V
D
I
D
R
--
R
D
---
P
L
--
V
-
V
A
A
L
---------
H
L
C
I
A
L
G
Y
A
-------------
N
S
S
L
N
P
V
L
Y
A
F
L
D
--
E
N
F
K
R
C
F
R
Q
L
C
----------------------------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
76.23
21%
-155
* 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
GTWDAYG
V
P
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
T
---
C
-------------------
H
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
44
Fugue
76.12
19%
-121
- 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
AE
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
GW
S
R
Y
-
I
-
P
E
G
M
Q
---
C
-----
S
C
G
I
D
Y
Y
T
P
H
E
E
-
T
N
N
E
S
F
V
-
I
Y
M
F
V
V
-----
H
F
I
I
P
L
I
V
I
F
F
C
Y
G
Q
L
V
F
T
V
----------------------
K
E
A
A
-----------------------
A
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
S
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
A
T
T
QK-----------------------------------------------
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
S
T
T
V
S
K
T
E
T
S
Q
V
A
P
A--------------------------------------------------------------------------------------------------------------------------------------
23
HHSearch
76.03
18%
-146
- C3 -
3UON
4
ACM2_HUMAN (first)
A:
[22-457]
------------------------------------
E
V
V
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
VRT
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
TGTWDAY--
P
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
P
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
P
---
C
--------------------
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------
26
HHSearch
75.30
21%
-141
- C3 -
2Z73
5
OPSD_TODPA
A:
[31-334]
----------------------------------
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
L
---
E
-------------------
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
C
Q
F
D
D
K
E
T
E
D
D
K
D
A
---------------------------------------------------------------------------------------------------------------------------------------
30
HHSearch
75.01
18%
-148
- 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
TGTWDAYL--
H
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
N
---
C
--------------------
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
29
HHSearch
74.24
23%
-138
- C3 -
2KS9
1
NK1R_HUMAN
A:
[31-327]
------------------------------------
Q
I
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
---
L
Y
-------
L
---------
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
S
A
G
D
Y
E
G
L
E
M
K
S
T
R
---------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
74.11
22%
-168
- C3 -
4EA3
3
C562_ECOLX (first)
A:
[132-401]
---------------------------------------
Y
L
A
V
C
V
G
-----
G
L
L
G
N
C
L
V
M
Y
V
I
L
R
H
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
T
L
V
-
L
L
T
-
L
P
F
Q
G
T
D
I
L
L
G
-
F
W
P
F
G
N
A
L
C
K
T
V
I
A
I
D
Y
Y
N
M
F
T
S
T
F
T
L
T
A
M
S
V
D
R
Y
V
A
I
C
H
P
----------
T
S
S
K
A
Q
A
V
N
V
A
I
W
A
L
A
S
V
V
G
V
P
V
A
I
----
M
-
G
-
S
A
Q
V
E
---
D
-
E
E
I
-
E
C
L
-
V
E
I
P
T
P
Q
D
-
Y
W
G
P
V
F
A
-
I
C
I
F
L
F
-----
S
F
I
V
P
V
L
V
I
S
V
C
Y
S
L
M
I
R
R
L
-----------------------
R
G
V
-----------------------
R
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
L
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
L
S
G
-------------------------------------------------
S
R
E
K
D
R
N
L
R
R
I
T
R
L
V
L
V
V
V
A
V
---
F
V
G
C
W
T
P
V
Q
V
F
--------------
V
---
L
A
--
Q
-
G
L
G
V
---------
Q
P
S
S
E
T
A
V
A
I
L
R
F
C
T
A
--
L
G
Y
V
N
S
C
L
N
P
I
L
Y
A
F
L
D
--
E
N
F
K
A
C
F
R
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
74.07
23%
-162
- C3 -
4N6H
22
OPRD_HUMAN
A:
[130-403]
------------------------------------------
A
L
Y
S
A
V
C
A
V
G
L
L
G
N
V
L
V
M
F
G
I
V
R
Y
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
A
L
A
-
T
S
T
-
L
P
F
Q
S
A
K
Y
L
M
-
E
T
W
P
F
G
E
L
L
C
K
A
V
L
S
I
D
Y
Y
N
M
F
T
S
I
F
T
L
T
M
M
S
V
D
R
Y
I
A
V
C
H
P
V
K
A
L
D
F
---
R
T
P
A
K
A
K
L
I
N
I
C
I
W
V
L
A
S
G
V
G
V
P
I
M
V
----
M
-
A
-
V
T
R
P
R
---
D
-
G
A
V
-
V
C
M
------
L
Q
F
-
P
S
P
S
W
Y
W
-
D
T
V
T
K
I
C
V
F
L
F
A
F
V
V
P
I
L
I
I
T
V
C
Y
G
L
M
L
L
R
L
----------------------
R
S
V
R
-----------------------
L
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
L
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
S
G
S
--------------------------------------------------
K
E
K
D
R
S
L
R
R
I
T
R
M
V
L
V
V
V
G
A
---
F
V
V
C
W
A
P
I
H
I
F
V
I
V
W
T
L
V
D
I
D
R
--
R
D
---
P
L
--
V
-
V
A
A
L
---------
H
L
C
I
A
L
G
Y
A
-------------
N
S
S
L
N
P
V
L
Y
A
F
L
D
--
E
N
F
K
R
C
F
R
Q
L
C
R
K
P
-----
C
G
------------------------------------------------------------------------------------------------------------------------------------------------------