@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 : O10G2_HUMAN: (2016-01-11 )
MGKTKNTSLDAVVTDFILLGLSHPPNLRSLLFLVFFIIYILTQLGNLLILLTMWADPKLCARPMYILLGVLSFLDMWLSSVTVPRLILDFTPSIKAIPFGGCVAQLYFFHFLGSTQCFLYTLMAYDRYLAICQPLHYPVLMNGRLCTVLVAGAWVAGSMHGSIQATLTFRLPYCGPNQVDYFICDIRAVLRLACADTTVNELVTFVDVRVVAASCFMLILLSYANIVHAILKIRTADGRRRAFSTCGSHLIVVTVYYVPCIFIYLRAGSKDPLDGAAAVFYTVVTPLLNPLIYTLRNQEVKSALKRITAG
Atome Classification :
(20 SA)
---.......-..10------........-.-20..--..---....30.------.-......40........-50........60-........70........80.-.......90.--.......100.......110..-.....120------.---------------........130-----.....------------------------..140.......150......--------.160--.........170-----.-----......-180.......190...-.-...--200.......210.....---..-220.-....-...230....--------------------..--.240--..-..----.-...250.---.-.....260...-...----.----270-------.---.---...-------....-280.-----.---.....290........300.------......310-------------------------------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
---MGKTKNT-
S
L
D
-------
A
V
V
T
D
F
I
L
-L-GLSH--PP---
N
L
R
S
L
L
F
------
L
-
V
F
F
I
I
Y
I
L
T
QLG
N
L
L
I
-
L
L
T
MWAD
P
K
L
CA-
R
P
M
Y
I
L
L
G
V
L
S
F
L
D
M
W
L
S
SVT-V
P
R
L
I
LDFTP--SIKAIPF
G
G
C
V
A
Q
L
Y
F
F
H
F
LGS-
T
Q
C
F
L
Y
--------
T
---------------
L
M
A
Y
D
R
Y
L
A
I
C-----QPLHY------------------------
P
V
LMNG
R
L
C
T
V
L
VA
G
A
W
V
AGS--------MH----G
S
I
Q
A
T
L
T
F
RLP-----Y-----CGPN
Q
V
-
D
Y
F
I
C
D
I
R
A
V
L
R
L
ACA-D-
T
T
V
--
N
E
L
V
T
F
V
D
V
R
V
V
A
A
S
C
F
M
---
L
I
-
L
L
-
S
-
Y
A
N
I
-
V
H
A
I
L
K
IRTA--------------------DG--
R
R
R
---
A
F
-
S
T----C-GS
H
L
I
V
V
---
T
-
V
Y
Y
V
P
C
I
F
I
Y
L
-RAG----S----K---------D---P---L
D
G
-------
A
A
A
V
-
F
Y
T
V
-----
V
---
T
P
L
L
N
P
L
-
I
Y
T
L
R
N
Q
E
V
K
S
A
------
L
K
R
ITAG---------------------------------------------------------------------------------------------------------------------------------------------------
38
HHSearch
85.72
15%
-149
- C5 -
2Z73
5
OPSD_TODPA
A:
[32-331]
-------------------------------------------
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
PLEW-----
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
---------------------------------------------------------------------------------------------------------------------------------------------------
44
Fugue
83.66
17%
-140
- C5 -
1F88
8
OPSD_BOVIN
A:
[1-348]
---
M
N
G
T
E
G
P
-
N
F
Y
VPFSNKT
G
V
V
R
S
P
F
E
-
A
-
P
Q
Y
Y
LA
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
GMQC
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
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
GKNPSTTVSKTETS
Q
V
A
P
A--------------------------------------------------------------------------------------------------------------------------------
35
HHSearch
78.13
17%
-134
- C5 -
1U19
14
OPSD_BOVIN
A:
[41-324]
----------------------------------------------
S
M
L
A
------
A
-
Y
M
F
L
L
I
M
L
G
F
P
I
N
F
L
T
-
L
Y
V
T
V
Q
H
K
K
L
-
R
-
T
P
L
N
Y
I
L
L
N
L
A
V
A
D
L
F
M
V
F
G
G
-
F
T
T
T
L
Y
T
S
L
H
--
G
Y
F
V
F
G
P
T
G
C
N
L
E
G
F
F
A
T
L
G
G
E
-
I
A
L
W
S
L
--------
V
---------------
V
L
A
I
E
R
Y
V
V
V
C
-----
K
P
M
S
N
------------------------
F
R
-
F
G
E
N
H
A
I
M
G
V
A
F
T
W
V
M
A
L
--------
A
C
----
A
A
P
P
L
V
G
W
S
R
Y
I
-------------
P
-
E
G
-
M
Q
C
S
C
G
I
D
Y
Y
T
P
---
H
-
E
-
E
T
N
--
N
E
S
F
V
I
Y
M
F
V
V
H
F
I
I
P
L
I
---
V
I
-
F
F
-
C
-
Y
G
Q
L
-
V
F
T
V
K
E
A
A
A
Q
QQESA
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
FG-
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
---------------------------------------------------------------------------------------------------------------------------------------------------
45
Fugue
75.40
15%
-110
- C5 -
1U19
15
OPSD_BOVIN
A:
[4-349]
---
M
N
G
T
E
G
P
-
N
F
Y
VPFSNKT
G
V
V
R
S
P
F
E
-
A
-
P
Q
Y
Y
LA
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
GMQC
S
-----
C
G
I
----
D
Y
Y
T
P
H
E
E
T
-----
N
N
-
E
-
S
F
V
--
I
Y
M
F
V
V
H
F
I
I
P
L
I
V
I
F
F
C
Y
G
Q
L
V
-
F
T
-
V
-
K
E
A
A
-
A
Q
Q
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
GKNPLGDDEA
S
T
T
V
S
K
TETSQVAPA--------------------------------------------------------------------------------------------------------------------------
33
HHSearch
72.50
14%
-151
* C5 *
2KS9
1
NK1R_HUMAN
A:
[34-322]
-----------------------------------------------
L
W
A
------
A
-
A
Y
T
V
I
V
V
T
S
V
V
G
N
V
V
V
-
M
W
I
I
L
A
H
K
R
M
-
R
-
T
V
T
N
Y
F
L
V
N
L
A
F
A
E
A
S
M
A
A
F
N
-
T
V
V
N
F
T
Y
A
V
H
--
N
E
W
Y
Y
G
L
F
Y
C
K
F
H
N
F
F
P
I
A
A
V
F
-
A
S
I
Y
S
M
--------
T
---------------
A
V
A
F
D
R
Y
M
A
I
I
-----
H
P
L
Q
P
------------------------
R
L
--
S
A
T
A
T
K
V
V
I
C
V
I
W
V
L
A
L
--------
L
L
----
A
F
P
Q
G
Y
Y
S
T
T
E
------
T
---------
M
P
-
S
R
V
V
C
M
I
E
W
P
E
H
P
----
N
-
K
I
Y
--
E
K
V
Y
H
I
C
V
T
V
L
I
Y
F
L
P
L
L
---
V
I
-
G
Y
-
A
-
Y
T
V
V
-
G
I
T
L
W
A
S
E
I
P
GDSSDRYH
E
Q
V
---------
S
A
--
K
R
K
---
V
V
-
K
M
----
M
-
I
V
V
V
C
T
F
---
A
-
I
C
W
L
P
F
H
I
F
F
L
-
L
P
Y
I
NPD
L
----
Y
L--------
K
---
K
FI
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
---------------------------------------------------------------------------------------------------------------------------------------------------
32
HHSearch
71.27
15%
-130
- C5 -
2LNL
-
CXCR1_HUMAN
A:
[37-322]
-------------------------------------------
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
-
A
K
W
--
R
M
V
L
R
I
L
P
H
T
F
G
F
I
V
P
L
F
---
V
M
-
L
F
-
C
-
Y
G
F
T
-
L
R
T
L
F
K
A
H
-
M
--------------------
G
Q
--
K
H
R
---
A
M
-
R
V
----
I
-
F
A
V
V
L
I
F
---
L
-
L
C
W
L
P
Y
N
L
V
L
L
-
A
D
T
----
L
M
RTQ
V
IQE
S
C
----
E
R
R
N
N
I
G
-
R
A
L
-------
D
A
T
E
-
I
L
G
F
-----
L
---
H
S
C
L
N
P
I
-
I
Y
A
F
I
G
Q
N
F
R
H
G
------
F
L
K
I
L
A
M
---------------------------------------------------------------------------------------------------------------------------------------------------
48
Fugue
69.56
11%
-128
- C5 -
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
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
-
T
E
G
Y
Y
T
I
GIG
H
-
L
L
T
K
S
P
S
L
N
A
A
-
K
S
E
----
L
----
D
---------
K
---
A
---
I
G
R
NTNGVIT
K
D
E
A
-
E
K
L
F
-----
N
---
Q
D
V
D
A
A
V
-
R
G
I
L
R
N
A
K
L
K
P
V
------
Y
D
S
L
D
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYKFCL
K
E
H
K
A
L
K
T
L
G
I
I
M
G
T
F
T
L
C
W
L
P
F
F
I
V
N
I
V
H
V
I
QDNLIR
K
E
V
Y
I
L
L
N
W
I
G
Y
V
N
S
G
F
N
PLIYCRS
P
D
F
R
I
A
F
Q
E
L
L
CL
53
Fugue
67.33
16%
-157
- C3 -
4F3V
6
ECCA1_MYCTU
A:
[1-275]
---------
G
-
H
M
T
-------
D
R
L
A
S
L
F
E
-
S
-
A
V
S
M
--
L
P
---
M
S
E
A
R
S
L
------
D
-
L
F
T
E
I
T
N
Y
D
E
------------------------------
S
A
C
D
A
W
I
G
R
I
R
-
C
G
D
---------
T
D
R
V
T
L
F
R
A
W
Y
S
R
R
N
F
G
Q
L
S
G
S
-
V
Q
I
S
M
S
--------
T
---------------
L
N
A
R
I
A
I
G
G
L
Y
-----
G
D
I
T
Y
------------------------
P
V
T
-
S
P
L
A
I
T
M
G
F
A
A
C
E
A
A
Q
G
--------
N
Y
----
A
D
A
M
E
A
L
E
A
A
-
P
-----
V
-----
A
G
S
----
E
H
L
V
A
W
M
K
A
V
V
Y
G
A
A
E
----
R
W
--
T
D
V
I
D
Q
V
K
S
A
G
K
W
P
D
K
F
L
---
A
G
-
A
A
-
G
-
V
A
H
G
-
V
A
A
A
N
L
A
L
F
T
--------------------
E
A
--
E
R
R
---
L
T
-
E
A
N
D
SP
A
-
G
E
A
C
A
R
A
---
I
-
A
W
Y
L
--
A
M
A
R
R
-
S
Q
G
----
N
----
E
---------
S
---
A
---
A
V
A
-------
L
L
E
W
-
L
Q
T
T
HPE
P
K
V
---
A
A
A
L
K
D
P
-
S
Y
R
L
K
T
T
T
A
E
Q
I
------
A
S
R
A
D
P
W
DPGSVV---------------------------------------------------------------------------------------------------------------------------------------------
31
HHSearch
66.18
22%
-167
- C5 -
3EML
8
ENLYS_BPT4
A:
[22-221]
----------------------------------------------
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
V
VP
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
G
----
L
-
R
L
K
I
Y
K
D
---
T
-
E
G
Y
Y
T
I
G
I
G
H
L
-
L
T
K
----
S
----
P
---------
S
---
L
---
N
A
A
-------
K
S
E
L
-
D
K
A
I
-----
G
---
R
N
T
N
G
V
I
-
T
K
D
E
A
E
K
L
F
N
Q
D
------
V
D
A
A
V
R
G
---------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
65.61
22%
-132
- C5 -
2VT4
8
ADRB1_MELGA
A:
[57-298]
--------------------------------------------------------------------------------------------------------------------
D
L
V
V
--
G
L
L
V
V
P
F
G
A
T
L
V
-
V
R
G
T
W
L
W
G
S
-
F
L
C
E
L
W
--------
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
-----
S
P
F
R
Y
------------------------
Q
S
L
M
T
R
A
R
A
K
V
I
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
H
WWRD
E
D
P
Q
A
L
K
C
Y
Q
D
P
-----
G
-----
C
----------
C
D
F
V
T
N
R
A
Y
A
I
A
-
S
-
S
I
I
--
S
F
Y
I
P
L
L
I
M
I
F
V
A
-----------
L
R
-
V
-
Y
R
E
A
-
K
E
Q
I
R
--------------------------------
E
H
K
A
L
-
K
T
----
L
-
G
I
I
M
G
V
F
---
T
-
L
C
W
L
P
F
F
L
V
N
I
V
N
V
F
----
N
----
R
---------
D
---
L
---
V
P
D
-------
W
L
F
V
-
A
F
N
W
-----
L
G
Y
A
N
S
A
M
N
P
I
-
I
Y
C
-
R
S
P
D
F
R
K
A
------
F
K
R
L
L
A
----------------------------------------------------------------------------------------------------------------------------------------------------
27
HHSearch
65.49
21%
-146
- C5 -
3RZE
2
ENLYS_BPT4 (first)
A:
[11-200]
------------------------------------------------
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
---
T
-
E
G
Y
Y
T
I
G
I
G
H
L
-
L
T
K
----
S
----
P
---------
S
---
L
---
N
A
A
-------
K
S
E
L
-
D
K
A
I
-----
G
---
R
N
T
N
G
V
I
-
T
K
D
E
A
E
K
L
F
N
Q
D
------
V
D
A
A
V
R
G
---------------------------------------------------------------------------------------------------------------------------------------------------
52
Fugue
63.11
14%
-142
* C4 *
3C24
4
?
A:
[6-285]
-----
K
N
D
V
G
-
P
K
T
-------
V
A
I
L
G
A
G
G
-
K
M
G
A
R
I
--
T
R
---
K
I
H
D
S
A
H
------
H
-
L
A
A
I
E
I
A
P
E
G
R
D
R
L
Q
G
M
G
I
P
L
T
D
G
D
G
W
I
D
-
E
A
D
V
V
V
L
--------
A
L
P
D
N
I
-
I
E
K
V
A
E
D
I
V
P
--
R
V
R
--
P
G
T
I
V
L
I
L
D
A
A
A
P
Y
A
G
V
M
P
E
------------------------------
R
A
D
I
T
Y
F
I
G
-----
H
P
C
H
P
------------------------
P
L
F
N
D
E
T
-------
D
P
A
A
R
T
D
--------
Y
H
----
G
G
I
-
A
K
Q
A
I
V
C
A
-----
L
M----
Q
G
P
E
E
-------
H
Y
A
I
G
A
D
I
C
E
T
M
W
-
S
P
V
--
T
R
T
H
R
V
T
T
E
Q
L
A
I
L
E
P
G
L
---
S
E
M
V
A
M
P
-
F
V
E
T
M
V
H
A
V
D
E
C
A
D
R
--------------------
Y
G
ID
R
Q
A
---
A
L
-
D
F
M
---
I
-
G
H
L
N
V
E
I
---
A
M
W
F
G
---------------------
Y
---------
S
---
P
---
K
V
A
-------
A
L
R
L
M
E
F
A
K
-----
D
---
I
V
V
K
E
D
W
-
R
E
A
L
N
P
A
K
V
K
Q
A
------
A
E
L
I
-
A
G
---------------------------------------------------------------------------------------------------------------------------------------------------
29
HHSearch
62.07
19%
-154
- C5 -
3ODU
6
CXCR4_HUMAN (first)
A:
[45-239]
---------------------------------------
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
-
T
E
G
Y
Y
T
I
G
I
G
H
-
L
L
T
----
K
----
S
---------
P
---
S
---
L
N
A
-------
A
K
S
E
-
L
D
K
A
-----
I
---
G
R
N
T
N
G
V
-
I
T
K
D
E
A
E
K
L
F
N
Q
------
D
V
D
A
A
V
R
---------------------------------------------------------------------------------------------------------------------------------------------------
26
HHSearch
61.10
18%
-151
- C5 -
3UON
2
ACM2_HUMAN (first)
A:
[24-215]
----------------------------------------------
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
-
E
G
----
L
-
R
L
K
I
Y
K
D
---
T
-
E
G
Y
Y
T
I
G
I
G
H
L
-
L
T
K
----
S
----
P
---------
S
---
L
---
N
A
A
-------
K
S
E
L
-
D
K
A
I
-----
G
---
R
N
T
N
G
V
I
-
T
K
D
E
A
E
K
L
F
N
Q
D
------
V
D
A
A
V
R
G
---------------------------------------------------------------------------------------------------------------------------------------------------
49
Fugue
60.71
16%
-121
- C4 -
4W4T
1
?
A:
[27-420]
-----
D
V
T
V
E
M
E
A
D
-------
A
V
L
D
A
E
I
A
-
L
-
G
K
A
L
--
P
P
VTG
A
L
R
T
I
L
L
T
GATG
F
L
-
G
A
F
L
L
E
E
L
C
R
R
T
D
A
R
I
-
Y
C
L
V
R
S
K
T
E
Q
E
G
M
N
R
I
R
K
N
L
E
S
Y
S
L
W
N
E
A
L
A
P
R
I
-
V
P
V
R
G
D
I
G
Q
P
LL
G
L
S
E
K
E
F
Q
R
L
S
E
E
I
D
A
I
Y
H
N
G
A
-
L
V
N
F
L
Y
PYESMRAA
N
---------------
V
L
G
T
R
E
I
L
R
L
A
T
RT
R
I
K
P
L
H
Y
V
S
T
VSVLPLGRKAPIREDEPLEGP
S
S
L
V
G
G
Y
A
Q
S
K
W
V
A
E
K
L
V
R
E
A
--------
S
R
----
R
G
L
P
V
T
I
L
R
P
G
R
-----
V
-----
T
G
H
S
R
T
G
A
W
N
T
D
D
L
V
C
R
T
L
K
G
C
V
-
R
M
G
V
A
--
P
S
V
D
A
L
L
D
L
T
P
V
D
Y
V
S
S
A
---
I
V
-
D
L
-
S
M
R
P
E
S
-
I
G
Q
T
Y
H
L
V
N
P
--------------------
Q
F
--
V
R
A
---
D
E
M
W
N
----
Y
M
R
A
F
G
Y
G
L
---
R
-
V
L
P
Y
D
Q
W
L
S
E
L
-
G
S
A
----
A
----
S
---------
S
---
D
---
S
E
L
-------
G
D
L
L
M
F
L
Q
Q
-----
V
---
P
S
V
G
G
P
R
M
V
V
C
D
S
G
D
T
L
K
A
L
G
GTG
T
S
C
P
S
V
D
A
S
L
I
S
T
Y
L
S
S
L
V
H
R
GFLKAPE--------------------------------------------------------------------------------------------------------------------------------
51
Fugue
59.56
13%
-149
- C2 -
2A6T
-
DCP2_SCHPO
A:
[1-245]
MSF
T
N
A
T
F
S
Q
-
V
L
D
-------
D
L
S
A
R
F
I
L
N
L
-
P
A
E
E
--
Q
S
---
S
V
E
R
L
C
F
------
Q
-
I
E
Q
A
H
W
F
Y
E
D
F
-----------------
I
-
R
A
Q
N
D
Q
L
P
S
L
G
L
R
V
F
S
A
K
L
F
A
-
H
C
P
L
L
W
K
W
H
E
---------------------------------------
E
---------------
A
F
D
D
F
L
R
Y
K
T
R
-----
I
P
V
R
G
------------------------
A
I
M
L
D
M
S
M
Q
Q
C
V
L
V
K
G
W
K
A
S
S
--------
G
W
----
G
F
P
K
G
K
I
D
K
---------------
D
E
S
D
V
-
D
C
A
I
R
E
V
Y
E
E
T
G
F
D
C
S
-
S
-
R
I
N
--
P
N
E
F
I
D
M
T
I
R
G
Q
N
V
R
L
Y
I
---
I
------------------------------------------------
P
---
G
I
-
S
L
----
D
-
T
R
F
E
I
S
K
---
I
-
E
W
H
N
------
L
-
M
D
L
----
P
----
T
---------
F
---
K
---
M
K
N
-------
K
F
-----
Y
M
-----
V
---
I
P
F
L
A
P
L
-
K
K
W
I
K
K
R
N
I
A
N
N
------
T
T
K
E
------------------------------------------------------------------------------------------------------------------------------------------------------
37
HHSearch
59.01
19%
-148
- C5 -
3V2Y
1
ENLYS_BPT4
A:
[63-249]
---------------------------------------------
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
I
---
D
E
-
G
L
----
R
-
L
K
I
Y
K
D
T
---
E
-
G
Y
Y
T
I
G
I
G
H
L
L
-
T
K
S
----
P
----
S
---------
L
---
N
---
A
A
K
-------
S
E
L
D
-
K
A
I
G
-----
R
---
N
T
N
G
V
I
T
-
K
D
E
A
E
K
L
F
N
Q
D
V
------
D
A
A
V
R
G
I
---------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
58.58
26%
-161
- C5 -
3V2Y
1
ENLYS_BPT4
A:
[57-195]
----------------------------------
A
D
--
K
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
I
D
-
E
G
L
R
L
K
I
Y
K
D
--------------------
T
E
--
G
Y
Y
---
T
I
-
G
I
----
G
-
H
L
L
T
K
S
P
---
S
-
L
N
A
A
K
S
E
L
D
K
A
-
I
G
R
----
N
----
T
---------
N
---
G
---
V
I
T
-------
K
D
E
A
-
E
K
L
F
-----
N
---
Q
D
V
D
A
A
V
-
R
G
I
L
R
N
A
K
L
K
P
V
------
Y
D
S
L
D
A
V
---------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
57.92
28%
-172
- C5 -
4EIY
17
AA2AR_HUMAN (first)
A:
[26-155]
--------------------------------------
P
P
---
I
M
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
-----
P
K
E
G
K
N
-
H
S
Q
G
C
G
E
G
Q
V
A
C
L
F
E
D
-
V
-
V
P
M
--
N
Y
M
V
Y
F
N
F
F
A
C
V
L
V
P
L
L
L
---
M
L
-
G
V
-
Y
-
L
R
I
F
-
L
A
A
R
R
Q
L
A
D
L
--------------------
E
D
--
N
W
E
---
T
L
-
N
D
----
N
-
L
K
V
I
E
K
A
---
D
-
N
A
A
Q
V
K
D
A
L
T
K
-
M
R
A
----
A
----
A
---------
L
---
D
---
A
Q
K
-------
M
K
D
F
-
R
H
G
F
-----
D
---
I
L
V
G
Q
I
D
-
D
A
L
K
L
A
N
E
G
K
V
K
------
E
A
Q
A
A
A
E
---------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
57.71
28%
-176
- C5 -
3QAK
2
ENLYS_BPT4
A:
[18-145]
-------------------------------------------
I
M
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
-----
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
N
I
-
F
E
M
L
R
I
D
E
G
L
--------------------
R
L
--
K
I
Y
---
K
D
-
T
E
----
G
-
Y
Y
T
I
G
I
G
---
H
-
L
L
T
K
S
P
S
L
N
A
A
-
K
S
E
----
L
----
D
---------
K
---
A
---
I
G
R
-------
N
T
N
G
-
V
I
T
K
-----
D
---
E
A
E
K
L
F
N
-
Q
D
V
D
A
A
V
R
G
I
L
R
------
N
A
K
L
K
P
V
---------------------------------------------------------------------------------------------------------------------------------------------------