@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 : BKRB1_HUMAN: (2016-01-09 )
MASSWPPLELQSSNQSQLFPQNATACDNAPEAWDLLHRVLPTFIISICFFGLLGNLFVLLVFLLPRRQLNVAEIYLANLAASDLVFVLGLPFWAENIWNQFNWPFGALLCRVINGVIKANLFISIFLVVAISQDRYRVLVHPMASRRQQRRRQARVTCVLIWVVGGLLSIPTFLLRSIQAVPDLNITACILLLPHEAWHFARIVELNILGFLLPLAAIVFFNYHILASLRTREEVSRTRCGGRKDSKTTALILTLVVAFLVCWAPYHFFAFLEFLFQVQAVRGCFWEDFIDLGLQLANFFAFTNSSLNPVIYVFVGRLFRTKVWELYKQCTPKSLAPISSSHRKEIFQLFWRN
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.--------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MASSWPP
L
E
LQSSNQSQLFPQNATACDNA
P
E
A
W
D
L
L
H
R
V
L
P
T
--
F
I
I
S
I
C
F
-
F
G
L
L
G
N
L
F
V
L
L
V
F
L
LPRRQL
N
V
A
E
I
Y
L
A
N
LAAS
D
L
V
F
V
L-G-L
P
F
W
A
E
N
I
W
N
QFNW
P
F
G
A
L
L
C
R
V
I
N
G
V
I
K
A
N
L
F
I
S
I
F
L
V
V
A
ISQD
R
Y
R
V
L
VH
P
M
A
S
R
R
Q
---
Q
R
R
R
Q
AR
V
T
C
V
L
I
W
V
V
G
G
L
L
S
I
P
T
F
L
L
---
R
S
I
---
Q
AV-PDLN
I
T
A
C
I
---
L
L-LP--HE-A---W--
H
F
A
R
---
I
V
E
L
N
--
I
--
L
G
-
F
L
L
P
L
A
A
I
V
-
F
F
N
Y
H
I
L
A
S
L
R
T
R
------------------------------------------------
E
E
V
S
-------------
R
----------------------------------------------------------------------------------------------------------------------------------------------------------T------------------------------------------------------------------------------------------------------------------------------------------------------------RCG--------------------------------------------GRKD----------S------------------------------------K
T
T
A
L
I
L
T
L
V
V
A
F
L
V
C
------
W
A
P
Y
H
-------
F
F
A
F
L
E
F
L
----
F
Q
V
--
Q
A
-
V
-
R
G
C
F
W
E
D
F
I
D
L
G
L
Q
L
A
N
F
F
A
FTN------SSLN
P
V
I
Y
V
F
V
G
R
L
F
R
T
K
V
W
E
L
Y
K
QCTPKSLAPI
S
S
S
H
R
-
K
E
I
F
Q
L
F
WRN--------------------------------------------------------------------------
22
HHSearch
89.93
27%
-137
- C2 -
3ODU
6
CXCR4_HUMAN (first)
A:
[42-498]
------------------------------
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
TGTWDAY
G
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
------------------------------------------------------------------------------------------
44
Fugue
89.31
24%
-151
* C2 *
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
PEDGDPDNGVNPGTDF------------------
K
D
I
V
-------------
C
----------------------------------------------------------------------------------------------------------------------------------------------------------
P
------------------------------------------------------------------------------------------------------------------------------------------------------------
L
C
G
--------------------------------------------
V
G
K
D
Q
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
DF
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
----------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
88.19
25%
-152
- C2 -
4MBS
8
CCR5_HUMAN (first)
A:
[33-366]
-------------------------------------
R
L
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
----------------------------------------------------------------------------------------------------------------------------------------------------------
T
------------------------------------------------------------------------------------------------------------------------------------------------------------
V
C
G
Y
I
Y
N
PEDGDPDNGVNPGTDFKDIPDDWVCPLCGVGKDQ
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
----------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
86.82
21%
-161
- C2 -
4XNV
15
P2RY1_HUMAN (first)
A:
[53-382]
---------------------------------------
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
----------------------------------------------------------------------------------------------------------------------------------------------------------
T
------------------------------------------------------------------------------------------------------------------------------------------------------------
V
C
G
Y
I
Y
N
PED-------------------------------------
G
D
P
D
----------
N
GVNPGTDFKDIVCPLCGVGKDQ
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
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
----------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
86.72
21%
-157
- C2 -
4XNW
2
RUBR_CLOPA
A:
[53-382]
---------------------------------------
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
----------------------------------------------------------------------------------------------------------------------------------------------------------
T
------------------------------------------------------------------------------------------------------------------------------------------------------------
V
C
G
Y
I
Y
N
PED-------------------------------------
G
D
P
D
----------
N
GVNPGTDFKDIPDDWVCPLCGVGKDQ
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
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
----------------------------------------------------------------------------------------------------------
33
HHSearch
85.58
22%
-146
- C2 -
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
---------------------------------------------------------------------------------------------------
26
HHSearch
84.56
22%
-140
- C2 -
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
CC
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
---------------------------------------------------------------------------------------------------
25
HHSearch
84.34
24%
-135
- C2 -
2Z73
5
OPSD_TODPA
A:
[28-334]
------------------------------
Q
V
P
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
E
T
E
I
P
A
--------------------------------------------------------------------------
46
Fugue
83.53
24%
-124
- C2 -
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
GSN
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
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
NAK
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
----
F
Q
M
--
G
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
T
G
T
W
D
A
Y
G
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
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
81.85
26%
-150
- C2 -
4XT3
2
US28_HCMVA
A:
[26-310]
--------------------
E
D
A
T
P
C
V
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
---------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
80.63
27%
-138
- C2 -
4RWD
6
C562_ECOLX (first)
A:
[131-399]
-----------------------------------------------
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
-----------------------------------------------------------------------------------------------------
24
HHSearch
80.61
19%
-142
- C2 -
3UON
4
ACM2_HUMAN (first)
A:
[23-457]
------------------------------------
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
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
TGTWD
A
------------------------------------------------------------------------------------------------------------------------------------------------------------
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
----------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
80.61
26%
-156
- C2 -
4XT1
15
US28_HCMVA
A:
[24-310]
------------------
Y
D
E
D
A
T
P
C
V
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
-------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
79.76
28%
-146
- C2 -
4EA3
3
C562_ECOLX (first)
A:
[133-401]
----------------------------------------------
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
--------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
79.69
27%
-142
- C2 -
4N6H
22
OPRD_HUMAN
A:
[134-402]
-----------------------------------------------
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
------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
78.52
27%
-142
- C2 -
4RWA
2
C562_ECOLX (first)
A:
[131-399]
-----------------------------------------------
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
----------------------------------------------------------------------
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
-----------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
77.43
27%
-140
- C2 -
5C1M
7
?
A:
[27-293]
------------------------------------------------
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
---------------------------------------------------------------------------------------------------------
31
HHSearch
76.58
21%
-141
- C2 -
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
NKI
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
G
-------------
D
SSDR------------------------------------------------------------------------------------------------------------------------------------------------------
Y
------------------------------------------------------------------------------------------------------------------------------------------------------------
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
--------------------------------------------------------------------------
42
Fugue
76.41
20%
-108
- C2 -
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
DY
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
------------------------------------------------------------------------------------------------------------------------------------------------------------
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
-------------------------------------------------------------------------------
34
HHSearch
75.24
30%
-128
- C2 -
2LNL
-
CXCR1_HUMAN
A:
[36-322]
---------------------------------
T
L
N
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
AK-
W
--
R
M
V
L
---
R
I
L
P
H
--
T
--
F
G
-
F
I
V
P
L
F
V
M
L
-
F
C
Y
G
F
T
L
R
T
L
F
K
A
------------------------------------------------
H
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
G
Q
K
----------
H
------------------------------------
R
A
M
R
V
I
F
A
V
V
L
I
F
L
L
C
------
W
L
P
Y
N
-------
L
V
L
L
A
D
T
L
----
M
R
T
--
Q
V
-
I
Q
E
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
-------------------------------------------------------------------------------------------------