@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 : OR1M1_HUMAN: (2016-01-12 )
MEPRNQTSASQFILLGLSEKPEQETLLFSLFFCMYLVMVVGNLLIILAISIDSHLHTPMYFFLANLSLVDFCLATNTIPKMLVSLQTGSKAISYPCCLIQMYFFHFFGIVDSVIIAMMAYDRFVAICHPLHYAKIMSLRLCRLLVGALWAFSCFISLTHILLMARLVFCGSHEVPHYFCDLTPILRLSCTDTSVNRIFILIVAGMVIATPFVCILASYARILVAIMKVPSAGGRKKAFSTCSSHLSVVALFYGTTIGVYLCPSSVLTTVKEKASAVMYTAVTPMLNPFIYSLRNRDLKGALRKLVNRKITSSS
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)
MEPRNQTSA
S
Q
F
I
L
L
GLSE---------------K----------------P
E
Q
E
T
L
L
F
S
L
F
F
C
M
Y
L
V
M
V
VGN
L
L
I
I
L
A
I
SIDSHLH
T
P
M
Y
F
F
L
A
N
L
S
L
V
D
F
C
L
A-TN
T
-
I
P
K
M
L
V
S
LQTGSKAISY
P
C
C
L
I
Q
M
Y
F
F
H
F
F
G
I
V
D
S
V
I
I
A
M
M
--
A
Y
--
D
R
F
V
A
I
CH
P
L
H
Y
A
K
I
M
S
L
R
L
C
R
L
L
V
G
A
L
W
A
F
S
C
F
I
S
L
T
H
I
L
L
M
----------
A
R
L
---
V
F
CGSHEV
P
H
Y
F
CD--LT
P
I
L
R
L
SC-------T-------DTSV
N
R
I
F
I
L
I
VA
G
M
V
I
A
T
P
F
-----
V
C
I
L
A
S
Y
A
R
I
L
V
A
I
M
K-------VPSA----G-----------G--------------------R-----
K
K
A
------------------
F
S
T
C
S
S
H
--
L
S
V
V
A
L
F-------YG
T
T
I
G
V
Y
LC
P
S
S
V
---------
L
---
T
------
T
-------
V
K
E
K
A
S
-----------
A
--
V
M
Y
-----
T
A
V
T
P
M
L
N
P
F
I
Y
S
L
RNR
D
L
K
G
A
L
R
K
L
V
---------
N
R
KITSSS---------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
89.00
21%
-180
- C3 -
3VGA
1
AA2AR_HUMAN
A:
[21-307]
---------------------------------------------------------------------
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
GQS
Q
G
C
G
E
G
Q
V
A
C
L
F
E
D
--
V
V
P
M
N
Y
M
-----------------------
V
Y
F
N
F
F
A
C
V
L
V
--
P
L
-----
L
L
M
L
G
V
Y
L
R
I
F
L
A
A
R
R
Q
L
K
Q
M
E
S
Q
P
L
P
----
G
-----------
E
--------------------
R
A
R
S
T
L
Q
K
E
------------------
V
H
A
A
K
S
L
--
A
I
I
V
G
L
F
A
L
C
W
L
P
L
H
I
I
N
C
F
T
F
F
C
P
D
C
S
---------
H
---
A
------
P
-------
L
W
L
M
Y
L
-----------
A
--
I
V
L
-----
S
H
T
N
S
V
V
N
P
F
I
Y
A
Y
R
I
R
E
F
R
Q
T
F
R
K
I
I
---------
R
S
H
V
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
39
Fugue
88.53
15%
-152
- 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
GVVRSPFEAPQYYLAE
P
W
Q
F
S
M
L
A
A
Y
M
F
L
L
I
M
L
G
F
P
I
N
F
L
T
L
Y
V
T
V
Q
H
K
K
L
R
T
P
L
N
Y
I
L
L
N
L
A
V
A
D
L
F
M
V
-
F
G
G
-
F
T
T
T
L
Y
T
S
L
H
G
Y
F
V
F
G
P
T
G
C
N
L
E
G
F
F
A
T
L
G
G
E
I
A
L
W
S
L
V
V
L
--
A
I
--
E
R
Y
V
V
V
C
K
P
M
S
N
F
R
-
F
G
E
N
H
A
I
M
G
V
A
F
T
W
V
M
A
L
A
C
A
A
P
P
L
V
G
W
----------
S
R
Y
---
I
P
E
G
----------------
M
Q
C
S
C
-------
G
I
DYYTPH
E
E
T
N
N
E
S
F
V
I
Y
M
F
V
V
H
F
I
I
P
L
-----
I
V
I
F
F
C
Y
G
Q
L
V
F
T
V
K
E
-------
A
A
A
S
----
A
-----------
T
--------------------
T
-----
Q
K
A
------------------
E
K
E
V
T
R
M
--
V
I
I
M
V
I
A
-------
F
L
I
C
W
L
P
Y
A
G
V
A
F
Y
---------
I
---
F
------
T
H
QGSDFG
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
TVSKTETS
Q
V
A
P
A--------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
87.98
21%
-183
- C3 -
3VG9
8
?
A:
[21-307]
---------------------------------------------------------------------
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
GQS
Q
G
C
G
E
G
Q
V
A
C
L
F
E
D
--
V
V
P
M
N
Y
M
-----------------------
V
Y
F
N
F
F
A
C
V
L
V
--
P
L
-----
L
L
M
L
G
V
Y
L
R
I
F
L
A
A
R
R
Q
L
K
Q
M
E
S
Q
P
L
P
----
G
-----------
E
--------------------
R
A
R
S
T
L
Q
K
E
------------------
V
H
A
A
K
S
L
--
A
I
I
V
G
L
F
A
L
C
W
L
P
L
H
I
I
N
C
F
T
F
F
C
P
D
C
S
---------
H
---
A
------
P
-------
L
W
L
M
Y
L
-----------
A
--
I
V
L
-----
S
H
T
N
S
V
V
N
P
F
I
Y
A
Y
R
I
R
E
F
R
Q
T
F
R
K
I
I
---------
R
S
H
V
L
R
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
86.11
21%
-176
- C3 -
2YDO
3
?
A:
[21-307]
---------------------------------------------------------------------
I
L
G
N
V
L
V
C
W
A
V
W
L
N
S
N
L
Q
N
V
T
N
Y
F
V
V
S
A
A
A
A
D
I
L
V
G
-
V
L
A
-
I
P
-
F
A
I
A
I
S
T
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
---
L
T
A
S
S
I
F
S
L
L
--
A
I
A
I
D
R
Y
I
A
I
R
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
K
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
P
M
L
G
W
NNCGQPK
E
G
K
A
H
S
---
Q
G
C
G
E
G
Q
V
A
C
L
F
E
D
--
V
V
P
M
N
Y
M
-----------------------
V
Y
F
N
F
F
A
C
V
L
V
--
P
L
-----
L
L
M
L
G
V
Y
L
R
I
F
L
A
A
R
R
Q
L
K
Q
M
E
S------------------------------------------T
L
---
Q
K
E
------------------
V
H
A
A
K
S
L
--
A
I
I
V
G
L
F
A
L
C
W
L
P
L
H
I
I
N
C
F
T
F
F
C
P
D
C
S
---------
H
---
A
------
P
-------
L
W
L
M
Y
L
-----------
A
--
I
V
L
-----
S
H
T
N
S
V
V
N
P
F
I
Y
A
Y
R
I
R
E
F
R
Q
T
F
R
K
I
I
---------
R
S
H
V
L
R
Q
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
86.05
20%
-165
- C3 -
3PWH
1
?
A:
[21-305]
---------------------------------------------------------------------
I
L
G
N
V
L
V
C
W
A
V
W
L
N
S
N
L
Q
N
V
T
N
Y
F
V
V
S
L
A
A
A
D
I
L
V
G
-
V
L
A
-
I
P
-
F
A
I
T
I
S
T
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
---
L
A
Q
S
S
I
F
S
L
L
A
I
A
I
--
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
P
M
L
G
W
----------
N
N
C
GQP-
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
A
A
A
R
R
Q
L
K
Q
M
E
S
-------
Q
P
L
P
----
G
-----------
E
--------------------
R
-----
A
R
S
T
L
Q
K
E
V
H
A
A
K
S
A
A
I
I
A
G
L
F
A
L
C
W
L
P
--
L
H
I
I
N
C
F
-------------
T
F
F
C
P
D
C
S
---------
H
---
A
------
P
-------
L
W
L
M
Y
L
-----------
A
--
I
V
L
-----
A
H
T
N
S
V
V
N
P
F
I
Y
A
Y
R
I
R
E
F
R
Q
T
F
R
K
I
I
---------
R
S
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
85.80
21%
-178
- C3 -
2YDV
6
?
A:
[21-307]
---------------------------------------------------------------------
I
L
G
N
V
L
V
C
W
A
V
W
L
N
S
N
L
Q
N
V
T
N
Y
F
V
V
S
A
A
A
A
D
I
L
V
G
-
V
L
A
-
I
P
-
F
A
I
A
I
S
T
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
---
L
T
A
S
S
I
F
S
L
L
--
A
I
A
I
D
R
Y
I
A
I
R
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
K
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
P
M
L
G
W
NNCGQPK
E
G
K
A
H
S
---
Q
G
C
G
E
G
Q
V
A
C
L
F
E
D
--
V
V
P
M
N
Y
M
-----------------------
V
Y
F
N
F
F
A
C
V
L
V
--
P
L
-----
L
L
M
L
G
V
Y
L
R
I
F
L
A
A
R
R
Q
L
K
Q
M
ES
Q
-----------------------------------------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
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
85.22
20%
-167
- C3 -
3REY
1
AA2AR_HUMAN
A:
[21-305]
---------------------------------------------------------------------
I
L
G
N
V
L
V
C
W
A
V
W
L
N
S
N
L
Q
N
V
T
N
Y
F
V
V
S
L
A
A
A
D
I
L
V
G
-
V
L
A
-
I
P
-
F
A
I
T
I
S
T
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
---
L
A
Q
S
S
I
F
S
L
L
A
I
A
I
--
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
P
M
L
G
W
----------
N
N
C
GQP-
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
A
A
A
R
R
Q
L
K
Q
M
E
S
-------
Q
P
L
P
----
G
-----------
E
--------------------
R
-----
A
R
S
T
L
Q
K
E
V
H
A
A
K
S
A
A
I
I
A
G
L
F
A
L
C
W
L
P
--
L
H
I
I
N
C
F
-------------
T
F
F
C
P
D
C
S
---------
H
---
A
------
P
-------
L
W
L
M
Y
L
-----------
A
--
I
V
L
-----
A
H
T
N
S
V
V
N
P
F
I
Y
A
Y
R
I
R
E
F
R
Q
T
F
R
K
I
I
---------
R
S
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
85.19
20%
-161
- C3 -
3UZA
1
AA2AR_HUMAN
A:
[21-305]
---------------------------------------------------------------------
I
L
G
N
V
L
V
C
W
A
V
W
L
N
S
N
L
Q
N
V
T
N
Y
F
V
V
S
L
A
A
A
D
I
L
V
G
-
V
L
A
-
I
P
-
F
A
I
T
I
S
T
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
---
L
A
Q
S
S
I
F
S
L
L
A
I
A
I
--
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
P
M
L
G
W
----------
N
N
C
GQP-
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
A
A
A
R
R
Q
L
K
Q
M
E
S
-------
Q
P
L
P
----
G
-----------
E
--------------------
R
-----
A
R
S
T
L
Q
K
E
V
H
A
A
K
S
A
A
I
I
A
G
L
F
A
L
C
W
L
P
--
L
H
I
I
N
C
F
-------------
T
F
F
C
P
D
C
S
---------
H
---
A
------
P
-------
L
W
L
M
Y
L
-----------
A
--
I
V
L
-----
A
H
T
N
S
V
V
N
P
F
I
Y
A
Y
R
I
R
E
F
R
Q
T
F
R
K
I
I
---------
R
S
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
85.00
21%
-175
- C3 -
4UHR
1
AA2AR_HUMAN
A:
[21-307]
---------------------------------------------------------------------
I
L
G
N
V
L
V
C
W
A
V
W
L
N
S
N
L
Q
N
V
T
N
Y
F
V
V
S
A
A
A
A
D
I
L
V
G
-
V
L
A
-
I
P
-
F
A
I
A
I
S
T
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
---
L
T
A
S
S
I
F
S
L
L
--
A
I
A
I
D
R
Y
I
A
I
R
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
K
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
P
M
L
G
W
NNCGQPKEGK
A
------
G
C
G
E
G
Q
V
A
C
L
F
E
D
--
V
V
P
M
N
Y
M
-----------------------
V
Y
F
N
F
F
A
C
V
L
V
--
P
L
-----
L
L
M
L
G
V
Y
L
R
I
F
L
A
A
R
R
Q
L
K
Q
M
E
S
Q
P
L
P
----
G
-----------
E
--------------------
R
A
R
S
T
L
Q
K
E
------------------
V
H
A
A
K
S
L
--
A
I
I
V
G
L
F
A
L
C
W
L
P
L
H
I
I
N
C
F
T
F
F
C
P
D
C
----------
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
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
84.96
20%
-159
- C3 -
2Z73
5
OPSD_TODPA
A:
[34-332]
------------------------------------------------------
Y
Y
S
L
G
I
F
I
G
I
C
G
I
I
G
C
G
G
N
G
I
V
I
Y
L
F
T
K
T
K
S
L
Q
T
P
A
N
M
F
I
I
N
L
A
F
S
D
F
T
F
S
-
L
V
N
G
F
P
L
M
T
I
S
C
F
L
K
K
W
I
F
G
F
A
A
C
K
V
Y
G
F
I
G
G
I
F
G
F
M
S
I
M
T
M
A
M
I
--
S
I
--
D
R
Y
N
V
I
G
R
P
M
A
A
S
K
K
M
S
H
R
R
A
F
I
M
I
I
F
V
W
L
W
S
V
L
W
A
I
G
P
I
F
G
W
----------
G
A
Y
---
T
L
----
E
G
V
L
C
N
C
S
--
F
D
Y
I
S
-------------------
R
D
S
T
T
R
S
N
I
L
C
M
F
I
L
G
F
F
G
P
I
-----
L
I
I
F
F
C
Y
F
N
I
V
M
S
V
S
N
-------
H
E
K
E
----
M
-----------
A
A
M
A
K
RLNAKE
L
R
K
A
Q
A
G
A
N
A
E
-----
M
R
L
------------------
A
K
I
S
I
V
I
--
V
S
Q
F
L
L
S
-------
W
S
P
Y
A
V
V
A
L
L
A
Q
F
G
---------
P
LEW
V
------
T
-------
P
Y
A
A
Q
L
-----------
P
--
V
M
F
-----
A
K
A
S
A
I
H
N
P
M
I
Y
S
V
S
H
P
K
F
R
E
A
I
S
Q
T
F
---------
P
W
V
L
T
C
C
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
84.51
21%
-175
- C3 -
4UG2
3
?
A:
[21-307]
---------------------------------------------------------------------
I
L
G
N
V
L
V
C
W
A
V
W
L
N
S
N
L
Q
N
V
T
N
Y
F
V
V
S
A
A
A
A
D
I
L
V
G
-
V
L
A
-
I
P
-
F
A
I
A
I
S
T
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
---
L
T
A
S
S
I
F
S
L
L
--
A
I
A
I
D
R
Y
I
A
I
R
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
K
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
P
M
L
G
W
NNCGQPK
E
G
K
A
H
S
---
Q
G
C
G
E
G
Q
V
A
C
L
F
E
D
--
V
V
P
M
N
Y
M
-----------------------
V
Y
F
N
F
F
A
C
V
L
V
--
P
L
-----
L
L
M
L
G
V
Y
L
R
I
F
L
A
A
R
R
Q
L-----------------------------------------------A
R
S
T
L
Q
K
E
------------------
V
H
A
A
K
S
L
--
A
I
I
V
G
L
F
A
L
C
W
L
P
L
H
I
I
N
C
F
T
F
F
C
P
D
C
S
---------
H
---
A
------
P
-------
L
W
L
M
Y
L
-----------
A
--
I
V
L
-----
S
H
T
N
S
V
V
N
P
F
I
Y
A
Y
R
I
R
E
F
R
Q
T
F
R
K
I
I
---------
R
S
H
V
L
R
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
84.33
20%
-163
- C3 -
3RFM
1
AA2AR_HUMAN
A:
[21-305]
---------------------------------------------------------------------
I
L
G
N
V
L
V
C
W
A
V
W
L
N
S
N
L
Q
N
V
T
N
Y
F
V
V
S
L
A
A
A
D
I
L
V
G
-
V
L
A
-
I
P
-
F
A
I
T
I
S
T
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
---
L
A
Q
S
S
I
F
S
L
L
A
I
A
I
--
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
P
M
L
G
W
----------
N
N
C
GQP-
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
A
A
A
R
R
Q
L
K
Q
M
E
S
-------
Q
P
L
P
----
G
-----------
E
--------------------
R
-----
A
R
S
T
L
Q
K
E
V
H
A
A
K
S
A
A
I
I
A
G
L
F
A
L
C
W
L
P
--
L
H
I
I
N
C
F
-------------
T
F
F
C
P
D
C
S
---------
H
---
A
------
P
-------
L
W
L
M
Y
L
-----------
A
--
I
V
L
-----
A
H
T
N
S
V
V
N
P
F
I
Y
A
Y
R
I
R
E
F
R
Q
T
F
R
K
I
I
---------
R
S
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
84.26
20%
-163
- C3 -
3UZC
1
AA2AR_HUMAN
A:
[21-305]
---------------------------------------------------------------------
I
L
G
N
V
L
V
C
W
A
V
W
L
N
S
N
L
Q
N
V
T
N
Y
F
V
V
S
L
A
A
A
D
I
L
V
G
-
V
L
A
-
I
P
-
F
A
I
T
I
S
T
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
---
L
A
Q
S
S
I
F
S
L
L
A
I
A
I
--
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
P
M
L
G
W
----------
N
N
C
GQP-
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
A
A
A
R
R
Q
L
K
Q
M
E
S
-------
Q
P
L
P
----
G
-----------
E
--------------------
R
-----
A
R
S
T
L
Q
K
E
V
H
A
A
K
S
A
A
I
I
A
G
L
F
A
L
C
W
L
P
--
L
H
I
I
N
C
F
-------------
T
F
F
C
P
D
C
S
---------
H
---
A
------
P
-------
L
W
L
M
Y
L
-----------
A
--
I
V
L
-----
A
H
T
N
S
V
V
N
P
F
I
Y
A
Y
R
I
R
E
F
R
Q
T
F
R
K
I
I
---------
R
S
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
40
Fugue
81.44
15%
-125
- 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
GVVRSPFEAPQYYLA
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
DYYTP
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
QQES
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
QGSDFG
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
CGKNPLGD
D
E
A
S
T
T
V
S
K
TETSQVAPA-----------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
81.00
21%
-132
- C3 -
2ZIY
2
OPSD_TODPA
A:
[64-327]
-------------------------------------------------------------------------------------
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
-------
R
L
N
A
----
K
-----------
E
--------------------
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
FGP
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------
30
HHSearch
80.00
15%
-157
* C3 *
2KS9
1
NK1R_HUMAN
A:
[34-324]
--------------------------------------------------------
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
----
G
DSSDRYH
E
Q
V
S
A
--------------------
K
-----
R
K
V
------------------
V
K
M
M
I
V
V
--
V
C
T
F
A
I
C
-------
W
L
P
F
H
I
F
F
L
L
P
Y
I
N
---------
P
---
D
LYLKKF
I
-------
Q
Q
V
Y
L
A
-----------
I
--
M
W
L
-----
A
M
S
S
T
M
Y
N
P
I
I
Y
C
C
L
N
D
R
F
R
L
G
F
K
H
A
F
---------
R
C
C
P
F
I
S
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
79.72
20%
-135
- C3 -
4WW3
5
OPSD_TODPA
A:
[57-320]
-------------------------------------------------------------------------------------
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
-------
R
L
N
A
----
K
-----------
E
--------------------
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
LEWVTPYAAQ
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
78.48
20%
-134
- C3 -
3AYN
3
OPSD_TODPA
A:
[65-328]
-------------------------------------------------------------------------------------
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
-------
R
L
N
A
----
K
-----------
E
--------------------
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
LEWVT
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------
42
Fugue
78.45
16%
-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
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
RNTNG
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
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KRW
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYGSK
G
H
Q
K
R
K
A
L
K
T
T
V
I
L
I
L
A
F
F
A
C
W
L
P
Y
Y
I
G
I
S
I
D
S
F
I
L
L
EI
I
K
Q
G
C
E
F
E
N
T
V
H
K
W
I
S
I
T
E
A
L
A
F
FHCC
L
N
P
I
L
Y
AFLGAKFKTS
A
Q
H
A
L
TSGRPLEVLFQ
15
PsiBlast_PDB
78.28
20%
-132
- C3 -
2Z73
5
OPSD_TODPA
A:
[65-328]
-------------------------------------------------------------------------------------
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
-------
R
L
N
A
----
K
-----------
E
--------------------
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
LEWVTPYA
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------