@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 : UR2R_HUMAN: (2016-01-15 )
MALTPESPSSFPGLAATGSSVPEPPGGPNATLNSSWASPTEPSSLEDLVATGTIGTLLSAMGVVGVVGNAYTLVVTCRSLRAVASMYVYVVNLALADLLYLLSIPFIVATYVTKEWHFGDVGCRVLFGLDFLTMHASIFTLTVMSSERYAAVLRPLDTVQRPKGYRKLLALGTWLLALLLTLPVMLAMRLVRRGPKSLCLPAWGPRAHRAYLTLLFATSIAGPGLLIGLLYARLARAYRRSQRASFKRARRPGARALRLVLGIVLLFWACFLPFWLWQLLAQYHQAPLAPRTARIVNYLTTCLTYGNSCANPFLYTLLTRNYRDHLRGRVRGPGSGGGRGPVPSLQPRARFQRCSGRSLSSCSPQPTDSLVLAPAAPARPAPEGPRAPA
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.......350.......360.......370.......380.......
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MALTPESPSSFP-GLAATGSSVPEPPGGPNATLNSSWASPTEP
S
S
L
E
-----
D
L
V
AT
G
T
I
G
T
L
L
S
A
M
----
G
V
VGVVGN
A
Y
T
L
V
V
T
C
R
-
S
L
R
A
V
A
S
M
Y
V
Y
V
V
N
L
A
L
A
D
L
L
Y
L
-
L
S
I
P
F
I
V
A
T
Y
----V-TK-EWHF--GD
V
G
C
R
V
L
F
G
L
D
F
L
T
M
H
A
S
I
F
T
L
T
V
MSSE
R
Y
A
A
V
LR
P
L
--
D
T
VQ----R
P
K
G
Y
R
K
L
-
L
A
L
G
T
W
L
L
A
L
L
L
T
L
P
V
M
-
L
A
-
M
-
R
L
-
V
R---RG
P
K
S------L-CL-------PAW-----GPR
A
----
H
-
R
A
Y
L
T
L
L
F
ATSIA---G---
P
G
L
L
I
G
L
L
Y
A
R
L
A
R
------
A
--
Y
R
--
R
S
Q
------------------------------------------
R
A
S
-
F
-------------------------------------------------------------------------------------------------------------------------------------------------------------
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------
R
AR-RP
G
-
A
R
-
A
L
R
---
L
V
L
-
G
I
V
L
L
F
W
A
C
F
L
P
F
W
L
----
W
Q
L
L
-----
A
-----
Q
Y
HQ-AP------LA
P
R
T
A
R
I
--
V
N
-
Y
------
L
T
T
C
--
L
TYG----NSC
A
N
P
F
L
Y
T
L
L
TR
N
Y
R
D
H
LRGRVRGPGSGGGRGPVPSL
Q
P
R
A
R
F
Q
RCSGRSLSSCSPQPTD
S
L
V
LAPAAPARPAPEGPRAPA
37
HHSearch
84.33
24%
-145
- 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
GTWDA
Y
-------------------------------------------------------------------------------------------------------------------------------------------------------------
G
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
---------------------------------------------------------
36
HHSearch
83.43
22%
-131
- C3 -
3EML
13
ENLYS_BPT4
A:
[20-472]
-------------------------------------------------------
G
S
S
V
Y
I
T
V
E
L
A
I
----
A
V
L
A
I
L
G
N
V
L
V
C
W
A
V
W
L
-
N
S
N
L
Q
N
V
T
N
Y
F
V
V
S
L
A
A
A
D
I
A
V
G
V
L
A
I
P
F
A
I
T
I
S
-------
T
-
G
F
C
A
--
A
C
H
G
C
L
F
I
A
C
F
V
L
V
L
T
Q
S
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
R
I
P
L
--
R
Y
N
G
L
---
V
T
G
T
R
A
K
G
-
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
P
M
-
L
G
-
W
-
N
N
-
C
G
---
Q
--
S
Q
------
G
-
C
G
-------
E
G
Q
VACLF
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
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
P
-
D
C
------
S
--
H
A
P
L
W
--
L
M
-
Y
------
L
A
I
V
--
L
S
H
T
----
N
S
V
V
N
P
F
I
Y
A
Y
R
I
R
E
F
R
Q
T
F
R
K
I
I
R
S
H
V
L
R
Q
----------------------------------------------------
34
HHSearch
81.35
21%
-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
TGTWDA--
Y
-------------------------------------------------------------------------------------------------------------------------------------------------------------
L
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
---------------------------------------------------------
31
HHSearch
81.14
22%
-127
- 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
-
A
T
---
H
Q
E
A
I
------
N
-
C
Y
-------
A
E
E
TCC--
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
TGTWDA--
Y
-------------------------------------------------------------------------------------------------------------------------------------------------------------
K
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
---------------------------------------------------------
1
PsiBlast_PDB
79.83
31%
-138
- C3 -
4N6H
22
OPRD_HUMAN
A:
[128-412]
-----------------------------------------------------------
I
T
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
------------------------------------------------------
21
PsiBlast_CBE
79.02
31%
-139
- C3 -
4RWD
5
C562_ECOLX (first)
B:
[125-405]
-----------------------------------------------------------
I
T
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
LQFPS--
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
FVIV
W
T
L
V
-----
D
-----
I
D
R
R
-
D
P
------
L
------
V
--
V
A
-
A
------
L
H
L
C
IA
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
------------------------------------------------------------
2
PsiBlast_PDB
78.80
30%
-147
- C3 -
4EA3
3
C562_ECOLX (first)
A:
[127-405]
----------------------------------------------------------
T
I
V
G
L
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
PQ
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
--------------------------------------------------------------
4
PsiBlast_PDB
78.75
31%
-138
- C3 -
4RWD
6
C562_ECOLX (first)
A:
[125-406]
-----------------------------------------------------------
I
T
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
-----------------------------------------------------------
5
PsiBlast_PDB
78.74
30%
-146
- C3 -
5C1M
7
?
A:
[13-293]
----------------------------------------------------
S
M
V
T
A
I
T
I
M
A
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
---------------------------------------------------------------
51
Fugue
78.71
25%
-147
- 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
MF
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
PEDGDPDNGVNPGTDFKDIVCPLCGVG--
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
-----
D
F
Q
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
----------------------------------------------------------------
3
PsiBlast_PDB
78.62
31%
-139
- C3 -
4RWA
2
C562_ECOLX (first)
A:
[125-406]
-----------------------------------------------------------
I
T
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
PS--
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
-------------------------------------------------------------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
-----------------------------------------------------------
22
PsiBlast_CBE
78.30
31%
-143
- C3 -
4RWA
1
C562_ECOLX (first)
B:
[125-403]
-----------------------------------------------------------
I
T
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
PS--
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
------------------------------------------------------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
--------------------------------------------------------------
29
HHSearch
78.19
20%
-133
- C3 -
3UON
4
ACM2_HUMAN (first)
A:
[24-457]
---------------------------------------------------------
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
GVR
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
TGTWDA--
Y
-------------------------------------------------------------------------------------------------------------------------------------------------------------
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
77.99
20%
-130
- C3 -
3ODU
6
CXCR4_HUMAN (first)
A:
[37-498]
----------------------------------------
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
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
------------------------------------------------
49
Fugue
76.70
19%
-103
- 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
D
Y
YTPH-
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
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
10
PsiBlast_PDB
76.46
23%
-142
- C3 -
4XNW
2
RUBR_CLOPA
A:
[37-382]
-----------------------------------------------SS
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
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
PEDGDPDNGVNPGTDFKDIPDDWVCPLCGVG
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
D
F
Q
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
----------------------------------------------------------------
9
PsiBlast_PDB
75.55
23%
-147
- C3 -
4XNV
15
P2RY1_HUMAN (first)
A:
[38-382]
-----------------------------------------------SFKC-
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
PEDGDPDNGVNPGTDFKDIVCPLCGVG----
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
D
F
Q
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
----------------------------------------------------------------
30
HHSearch
72.83
20%
-133
* C3 *
2KS9
1
NK1R_HUMAN
A:
[31-326]
-------------------------------------------------------
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
NKIY
E
-
K
V
Y
H
I
C
V
T
V
L
I
Y
F
---
L
---
P
L
L
V
I
G
Y
A
Y
T
V
V
G
I
------
T
--
L
W
--
A
S
E
------------------------------------------
I
P
G
-
D
SSDRY--------------------------------------------------------------------------------------------------------------------------------------------------------
H
-------------------------------------------------------------------------------------------------------------------------------------------------------------
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
Y
L
Q
T
Q
G
S
V
Y
K
V
S
R
L
E
T
T
I
S
T
V
V
G
A
---------------
48
Fugue
72.79
19%
-92
- 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
VF
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
YTPH-
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
EA
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
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
L
G
D
D
E
A
S
T
--------
T
V
S
K
T
E
T
S
Q
V
A
P
A
------------------------
16
PsiBlast_PDB
72.62
24%
-146
- C3 -
4XEE
4
?
A:
[18-345]
---------------------------
G
P
N
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