@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 : bsu07340: (2016-06-11 )
MSSLFRKKPLETLSAQSKSKSLARTLSAFDLTLLGIGCVIGTGIFVITGTVAATGAGPALIISFILAGLACALAAFCYAEFSSSIPISGSVYSYSYVTLGELLAFLIGWDLMLEYVIALSAVATGWSSYFQSLLAGFNLHIPAALTGAPGSMAGAVFNLPAAVIILLITAIVSRGVKESTRFNNVIVLMKIAIILLFIIVGIGYVKPDNWSPFMPFGMKGVILSAATVFFAYLGFDAVSNASEEVKNPQKNMPVGIISALAVCTVLYIAVSLVLTGMMPYAKLNVGDPVSFALKFVGQDAVAGIISVGAIIGITTVMLALLYAQVRLTFAMSRDGLLPGLFAKVHPSFKTPFRNTWLTGIVAAGIAGFINLGTLAHLVNMGTLAAFTVISIAVIVLRKKHPEIKASFRVPFVPVVPIISAGICLWFMYSLPGVTWLSFVIWIAVGTLVYFLYSRKHSLLNK
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--------.......390----.........400.......410--..----.......420.......430.....-----------.------..440.......450.......460----------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
--------MS
S
L
F
RKK
P
L
E
T
L
S
A
Q
S
K
S
K
S
L
A
R
T
L
S
A
-
F
D
L
T
L
L
G
I
G
-
C
V
IGT
G
I
F
V
I
T
G
T
VAA-TGA
G
P
A
L
I
I
S
F
I
L
A
G
L
A
-
C
A
L
A
-
A
--------
F
C
Y
A
E
F
SSSIP-I--SG
S
V
Y
S
Y
S
Y
V
T
L
G
E
-
L
L
-----------
A
F
---
L
I
G
W
D
-
L
M
L
E
Y
V
I
A
L
S
A
---
V
A
T
-
G
W
S
S
Y
F
-
Q
S
L
L
A----------------GFNLHIPAALT-GAPGSM
A
G
A
V
FN
L
----
P
A
A
V
I
--
I
L
-----
L
--
I
T
A
I
V
SRGVKESTRFNN
V
------
I
V
L
M
----
K
I
A
I
I
L
L
F
I
I
V
-GI---GYVKPD-------NWSP-FM-P-FGMK
G
V
I
L
S
A
A
T
V
F
F
A
Y
L
G
F
D
AV-SN
A
S
E
E
V-KNPQKNM
P
V
G
----
I
I
--------------------------------
S
A
L
A
V
C
T
V
L
Y
I
A
V
---
S
L
V
L
T
----GM---MP
Y
A
KL--NV--G----
D
P
V
S
F
A
L
-----------
K
---
F
-
V
------
G
Q
--
D
A
--
V
A
G
I
I
S
V
---------
G
A
I
I
G
I
T
T
V
M
L
A
L
--------
L
Y
A
Q
V
R
L
T
F
-
A
MS-RDGL
L
P
G
L
F
--
A
KVHP------SFKTPF
R
N
T
W
L
T
G
I
V
A
A
G
I
A
G
-
F
---
I
--------
N
L
G
---
T
L
-
A
--
H
L
V
N
M
G
T
--------
L
A
A
F
T
V
I
S
------
I
A
V
I
V
L
RKKHPE
I
K
A
SFRV
P
----
F
V
----
P
V
V
P
I
I
S
A
G
I
C
L
W
F
M
Y
SL-P
G
V
T
W
L
-----------
S
------
F
V
I
W
I
A
V
G
T
L
V
Y
F
L
Y
S
R
K
H
S
LLNK-----------------
17
HHSearch
81.01
20%
-172
- C3 -
3L1L
2
ADIC_ECO57
A:
[7-430]
------------------------------
A
H
K
V
G
L
-
I
P
V
T
L
M
V
S
G
-
A
I
M
G
S
G
V
F
L
L
P
A
N
L
A
S
---
T
G
G
I
A
I
Y
G
W
L
V
T
I
I
G
-
A
L
G
L
-
S
--------
M
V
Y
A
K
M
S
F
L
D
P
-
S
--
P
G
G
S
Y
A
Y
A
R
R
C
F
G
P
-
F
L
-----------
G
Y
---
Q
T
N
V
L
-
Y
W
L
A
C
W
I
G
N
I
A
---
M
V
V
-
I
G
V
G
Y
L
-
S
Y
F
F
P
----------------
I
L
---
K
D
------------
P
W
V
L
T
I
----
T
C
V
V
V
--
L
W
-----
I
--
F
V
L
L
N
I
V
G
P
K
M
I
T
R
V
Q
A
V
------
A
T
V
L
----
A
L
I
P
I
V
G
I
A
V
F
-
G
W
---
F
W
F
R
G
E
-------
T
Y
M
A
----------
A
I
Q
S
T
L
N
V
T
L
W
S
F
I
G
V
E
S
A
-
S
V
A
A
G
V
V
-
K
N
P
K
R
N
V
P
I
A
----
T
I
--------------------------------
G
G
V
L
I
A
A
V
C
Y
V
L
S
---
T
T
A
I
M
----
G
M
---
I
P
N
A
A
L
R-
V
S
--
A
----
S
P
F
G
D
A
A
-----------
R
---
M
-
A
------
L
G
--
D
T
--
A
G
A
I
V
S
F
---------
C
A
A
A
G
C
L
G
S
L
G
G
W
--------
T
L
L
A
G
Q
T
A
K
-
A
A
A
-
D
D
G
L
F
P
P
I
F
--
A
R
V
N
-------
K
A
G
T
P
V
A
G
L
I
I
V
G
I
L
M
T
I
F
Q
L
-
S
---
S
ISPNATK-
E
F
G
---
L
V
-
S
--
S
V
S
V
I
F
T
--------
L
V
P
Y
L
Y
T
C
------
A
A
L
L
L
L
G
H
G
H
F
G
K
A
R
P
A
Y
------------
L
A
V
T
T
I
A
F
L
Y
C
I
W
A
V
V
G
S
-
G
A
K
E
V
M
-----------
W
------
S
F
V
T
L
M
V
I
T
A
M
Y
A
L
N
Y
N
R
-----------------------
25
Fugue
78.23
23%
-177
- C3 -
3GIA
7
Y609_METJA
A:
[3-435]
----------------------------
L
K
N
K
K
L
S
L
-
W
E
A
V
S
M
A
V
G
-
V
M
I
G
A
S
I
F
S
I
F
G
V
G
A
K
-
I
A
-
G
R
N
L
P
E
T
F
I
L
S
G
I
Y
-
A
L
L
V
-
A
--------
Y
S
Y
T
K
L
G
A
K
I
V
-
S
--
N
A
G
P
I
A
F
I
H
K
A
I
G
D
N
I
I
-----------
T
G
---
A
L
S
I
L
-
L
W
M
S
Y
V
I
S
I
A
L
---
F
A
K
-
G
F
A
G
Y
F
-
L
P
L
I
-----------------------------
N
A
P
I
N
--
T
F
N
I
A
I
----
T
E
I
G
I
--
V
A
-----
F
--
F
T
A
L
N
F
F
G
S
K
A
V
G
R
A
E
F
F
------
I
V
L
V
----
K
L
L
I
L
G
L
F
I
F
A
-
G
L
---
I
T
I
H
P
S
-------
Y
V
I
P
-
D
L
A
P
-
S
A
V
S
G
M
I
F
A
S
A
I
F
F
L
S
Y
M
G
F
G
V
I
-
T
N
A
S
E
H
I
-
E
N
P
K
K
N
V
P
R
A
----
I
F
--------------------------------
I
S
I
L
I
V
M
F
V
Y
V
G
V
---
A
I
S
A
I
----
G
N
---
L
P
I
D
E
L
--
I
K
A
S
E
----
N
A
L
A
V
A
A
-----------
K
---
P
-
F
------
L
G
--
N
L
--
G
F
L
L
I
S
I
---------
G
A
L
F
S
I
S
S
A
M
N
A
T
--------
I
Y
G
G
A
N
V
A
Y
-
S
L
A
-
K
D
G
E
L
P
E
F
F
--
E
R
K
V
W
------
F
K
S
T
E
G
--
L
Y
I
T
S
A
L
G
V
L
F
A
L
-
L
---
F
--------
N
M
E
---
G
V
-
A
--
S
I
T
S
A
V
F
--------
M
V
I
Y
L
F
V
I
------
L
S
H
Y
I
L
I
D
E
V
G
G
---
R
K
E
I
V
----
I
F
----
S
F
I
V
V
L
G
V
F
L
L
L
L
Y
Y
Q
W
I
-
T
N
R
F
V
F
-----------
Y
------
G
I
I
A
T
F
I
G
V
L
I
F
E
I
I
Y
R
K
V
T
K
R
T
F
S
NNMYVKS---------
15
HHSearch
72.74
26%
-168
- C3 -
3GIA
6
Y609_METJA
A:
[3-370]
----------------------------
L
K
N
K
K
L
S
L
-
W
E
A
V
S
M
A
V
G
-
V
M
I
G
A
S
I
F
S
I
F
G
V
G
A
K
--
I
A
G
R
N
L
P
E
T
F
I
L
S
G
I
Y
-
A
L
L
V
-
A
--------
Y
S
Y
T
K
L
G
A
K
I
V
-
S
--
N
A
G
P
I
A
F
I
H
K
A
I
G
D
-
N
I
I
----------
T
G
---
A
L
S
I
L
-
L
W
M
S
Y
V
I
S
I
A
L
---
F
A
K
-
G
F
A
G
Y
F
-
L
P
L
I
N
----------------
A
P
---
I
N
------------
T
F
N
I
A
I
----
T
E
I
G
I
--
V
A
-----
F
--
F
T
A
L
N
F
F
G
S
K
A
V
G
R
A
E
F
F
------
I
V
L
V
----
K
L
L
I
L
G
L
F
I
F
A
-
G
L
---
I
T
I
H
P
S
-------
Y
V
I
P
D
L
A
-
P
-
S
A
V
S
G
M
I
F
A
S
A
I
F
F
L
S
Y
M
G
F
G
V
I
-
T
N
A
S
E
H
I
-
E
N
P
K
K
N
V
P
R
A
----
I
F
--------------------------------
I
S
I
L
I
V
M
F
V
Y
V
G
V
---
A
I
S
A
I
----
G
N
---
L
P
I
D
E
L
I
K
A
S
--
E
----
N
A
L
A
V
A
A
-----------
K
---
P
-
F
------
L
G
--
N
L
--
G
F
L
L
I
S
I
---------
G
A
L
F
S
I
S
S
A
M
N
A
T
--------
I
Y
G
G
A
N
V
A
Y
-
S
L
A
-
K
D
G
E
L
P
E
F
F
--
E
R
K
V
-------
W
F
K
S
T
-
E
G
L
Y
I
T
S
A
L
G
V
L
F
A
L
-
L
---
F
--------
N
M
E
---
G
V
-
A
--
S
I
T
S
A
V
F
--------
M
V
I
Y
L
F
V
I
------
L
S
H
Y
I
L
I
D
E
V
G
-------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
72.74
28%
-165
- C3 -
3GI9
-
Y609_METJA
C:
[6-356]
-------------------------------
K
K
L
S
L
-
W
E
A
V
S
M
A
V
G
-
V
M
I
G
A
S
I
F
S
I
F
G
-
V
G
A
-
K
I
A
G
R
N
L
P
E
T
F
I
L
S
G
I
Y
-
A
L
L
V
-
A
--------
Y
S
Y
T
K
L
G
A
K
I
V
-
S
--
N
A
G
P
I
A
F
I
H
K
A
I
G
D
N
I
I
-----------
T
G
---
A
L
S
I
L
-
L
W
M
S
Y
V
I
S
I
A
L
---
F
A
K
-
G
F
A
G
Y
F
-
L
P
L
I
------------------------------
A
P
I
N
----
T
F
N
I
----
A
I
T
E
I
G
I
V
A
-----
F
--
F
T
A
L
N
F
F
G
S
K
A
V
G
R
A
E
F
F
------
I
V
L
V
----
K
L
L
I
L
G
L
F
I
F
A
-
G
L
---
I
T
I
H
P
S
-------
Y
V
I
P
-
D
L
A
P
-
S
A
V
S
G
M
I
F
A
S
A
I
F
F
L
S
Y
M
G
F
G
V
I
-
T
N
A
S
E
H
I
-
E
N
P
K
K
N
V
P
R
A
----
I
F
--------------------------------
I
S
I
L
I
V
M
F
V
Y
V
G
V
---
A
I
S
A
I
----
G
N
---
L
P
I
D
E
L
--
I
K
--
A
----
S
E
N
A
L
A
V
-----------
A
A
KP
F
-
L
------
G
N
--
L
G
--
F
L
-
L
I
S
I
---------
G
A
L
F
S
I
S
S
A
M
N
A
T
--------
I
Y
G
G
A
N
V
A
Y
-
S
L
A
-
K
D
G
E
L
P
E
F
F
--
E
R
-----------
K
V
W
F
K
S
T
E
G
L
Y
I
T
S
A
-------------------
L
G
---
V
L
F
A
--
L
L
F
N
M
E
G
--------
V
A
S
I
T
S
A
V
------
F
M
V
I
Y
L
------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
72.46
28%
-164
- C3 -
3GI8
-
Y609_METJA
C:
[6-356]
-------------------------------
K
K
L
S
L
-
W
E
A
V
S
M
A
V
G
-
V
M
I
G
A
S
I
F
S
I
F
G
-
V
G
A
-
K
I
A
G
R
N
L
P
E
T
F
I
L
S
G
I
Y
-
A
L
L
V
-
A
--------
Y
S
Y
T
K
L
G
A
K
I
V
-
S
--
N
A
G
P
I
A
F
I
H
K
A
I
G
D
N
I
I
-----------
T
G
---
A
L
S
I
L
-
L
W
M
S
Y
V
I
S
I
A
L
---
F
A
K
-
G
F
A
G
Y
F
-
L
P
L
I
-----------------------------
N
A
P
I
N
----
T
F
N
I
----
A
I
T
E
I
GI
V
A
-----
F
--
F
T
A
L
N
F
F
G
S
K
A
V
G
R
A
E
F
F
------
I
V
L
V
----
A
L
L
I
L
G
L
F
I
F
A
-
G
L
---
I
T
I
H
P
S
-------
Y
V
I
P
-
D
L
A
P
-
S
A
V
S
G
M
I
F
A
S
A
I
F
F
L
S
Y
M
G
F
G
V
I
-
T
N
A
S
E
H
I
-
E
N
P
K
K
N
V
P
R
A
----
I
F
--------------------------------
I
S
I
L
I
V
M
F
V
Y
V
G
V
---
A
I
S
A
I
----
G
N
---
L
P
I
D
E
L
--
I
K
--
A
----
S
E
N
A
L
A
V
-----------
A
AKP
F
-
L
------
G
N
--
L
G
--
F
L
-
L
I
S
I
---------
G
A
L
F
S
I
S
S
A
M
N
A
T
--------
I
Y
G
G
A
N
V
A
Y
-
S
L
A
-
K
D
G
E
L
P
E
F
F
--
E
R
-----------
K
V
W
F
K
S
T
E
G
L
Y
I
T
S
A
-------------------
L
G
---
V
L
F
A
--
L
L
F
N
M
E
G
--------
V
A
S
I
T
S
A
V
------
F
M
V
I
Y
L
------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
72.22
28%
-168
- C3 -
3GIA
6
Y609_METJA
A:
[6-356]
-------------------------------
K
K
L
S
L
-
W
E
A
V
S
M
A
V
G
-
V
M
I
G
A
S
I
F
S
I
F
G
-
V
G
A
-
K
I
A
G
R
N
L
P
E
T
F
I
L
S
G
I
Y
-
A
L
L
V
-
A
--------
Y
S
Y
T
K
L
G
A
K
I
V
-
S
--
N
A
G
P
I
A
F
I
H
K
A
I
G
D
N
I
I
-----------
T
G
---
A
L
S
I
L
-
L
W
M
S
Y
V
I
S
I
A
L
---
F
A
K
-
G
F
A
G
Y
F
-
L
P
L
I
-----------------------------
N
A
P
I
N
----
T
F
N
I
----
A
I
T
E
I
G
I
V
A
-----
F
--
F
T
A
L
N
F
F
G
S
K
A
V
G
R
A
E
F
F
------
I
V
L
V
----
K
L
L
I
L
G
L
F
I
F
A
-
G
L
---
I
T
I
H
P
S
-------
Y
V
I
P
-
D
L
A
P
-
S
A
V
S
G
M
I
F
A
S
A
I
F
F
L
S
Y
M
G
F
G
V
I
-
T
N
A
S
E
H
I
-
E
N
P
K
K
N
V
P
R
A
----
I
F
--------------------------------
I
S
I
L
I
V
M
F
V
Y
V
G
V
---
A
I
S
A
I
----
G
N
---
L
P
I
D
E
L
--
I
K
--
A
----
S
E
N
A
L
A
V
-----------
A
A
KP
F
-
L
------
G
N
--
L
G
--
F
L
-
L
I
S
I
---------
G
A
L
F
S
I
S
S
A
M
N
A
T
--------
I
Y
G
G
A
N
V
A
Y
-
S
L
A
-
K
D
G
E
L
P
E
F
F
--
E
R
-----------
K
V
W
F
K
S
T
E
G
L
Y
I
T
S
A
-------------------
L
G
---
V
L
F
A
--
L
L
F
N
M
E
G
--------
V
A
S
I
T
S
A
V
------
F
M
V
I
Y
L
------------------------------------------------------------------------------------------------------------
27
Fugue
69.45
18%
-197
- C3 -
4DJK
-
GADC_ECOLI
A:
[12-501]
--------------------------------
Q
L
T
L
-
L
G
F
F
A
I
T
A
S
-
M
V
M
A
-----
V
Y
E
Y
P
T
F
-
A
T
S
G
F
S
L
V
F
F
L
L
L
G
G
I
L
W
F
I
P
V
-
G
--------
L
C
A
A
E
M
A
T
V
D
-----
G
W
G
V
F
A
W
V
S
N
T
L
G
P
-
R
W
-----------
G
F
---
A
A
I
S
F
-
G
Y
L
Q
I
A
I
G
F
-----------------
I
P
M
L
----------------
Y
F
V
L
G
A
L
S
Y
I
L
-
K
W
P
A
L
N
E
D
P
I
T
K
T
----
I
A
A
L
I
--
I
L
-----
W
--
A
L
A
L
T
Q
F
G
G
T
K
Y
T
A
R
I
A
K
------
V
G
F
F
----
A
G
I
L
L
P
A
F
I
L
I
-
A
L
---
A
A
I
Y
L
H
-------
T
F
F
P
----
D
-
F
S
K
V
G
T
L
V
V
F
V
A
F
I
L
S
Y
M
G
V
E
A
S
-
A
T
H
V
N
E
M
-
S
N
P
G
R
D
Y
P
L
A
----
M
L
--------------------------------
L
L
M
V
A
A
I
C
L
S
S
V
G
---
G
L
S
I
A
----
M
V
---
I
P
G
N
E
I
--
N
L
--
S
----
A
G
V
M
Q
T
F
-----------
T
---
V
-
L
M
SHVAP
E
I
--
E
W
--
T
V
R
V
I
S
A
---------
L
L
L
L
G
V
L
A
E
I
A
S
W
--------
I
V
G
P
S
R
G
M
Y
-
V
T
A
-
Q
K
N
L
L
P
A
A
F
--
A
K
M
N
K
------
N
G
V
P
V
T
L
V
I
S
Q
L
V
I
T
S
I
A
L
I
I
-
L
---
T
N
TGGG
N
N
M
S
F
L
---
I
A
-
L
--
A
L
T
V
V
I
Y
--------
L
C
A
Y
F
M
L
F
------
I
G
Y
I
V
L
V
L
K
H
P
D
L
K
R
T
F
N
I
P
----
G
G
----
K
G
V
K
L
V
V
A
I
V
G
L
L
T
S
I
M
A
-
F
I
V
S
F
L
PPDNIQGDSTD
M
------
Y
V
E
L
L
V
V
S
F
L
V
V
L
A
L
P
F
I
L
Y
A
V
H
F
FLHPRARSP--------
6
PsiBlast_PDB
69.13
24%
-153
- C3 -
3L1L
2
ADIC_ECO57
A:
[7-333]
------------------------------
A
H
K
V
G
L
-
I
P
V
T
L
M
V
S
G
-
A
I
M
G
S
G
V
F
L
L
P
A
N
L
A
S
-
T
G
G
--
I
A
I
Y
G
W
L
V
T
I
I
G
-
A
L
G
L
-
S
--------
M
V
Y
A
K
M
S
F
L
D
P
-
S
--
P
G
G
S
Y
A
Y
A
R
R
C
F
G
P
-
F
L
-----------
G
Y
Q
T
N
V
L
Y
W
L
-
A
C
W
I
G
N
I
A
M
V
V
---
I
G
V
-
G
Y
L
S
Y
F
-
F
P
I
L
K
----------------
D
-----
P
W
V
L
T
-------------
I
----
T
C
V
V
V
--
L
W
-----
I
--
F
V
L
L
N
I
V
G
P
K
M
I
T
R
V
Q
A
V
A
T
V
L
A
L
I
P
I
V
----
G
I
A
V
F
G
W
F
W
F
R
-
G
E
---
T
Y
M
A
---------------------
A
I
Q
S
T
L
N
--
V
T
L
W
S
F
I
G
V
E
S
A
-
S
V
A
A
G
V
V
-
K
N
P
K
R
N
V
P
I
A
----
T
I
--------------------------------
G
G
V
L
I
A
A
V
C
Y
V
L
S
---
T
T
A
I
M
----
G
M
---
I
P
N
A
A
L
--
R
V
S-
A
----
S
P
F
G
D
A
A
-----------
R
---
M
-
A
------
L
G
--
D
T
--
A
G
A
I
V
S
F
---------
C
A
A
A
G
C
L
G
S
L
G
G
W
--------
T
L
L
A
G
Q
T
A
K
-
A
A
A
-
D
D
G
L
F
P
P
I
F
--
A
R
V
N
K
------
A
-
G
T
P
V
A
G
L
I
I
V
G
I
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
68.58
24%
-149
- C3 -
3OB6
1
ADIC_ECOLI
A:
[5-339]
----------------------------
A
D
A
H
K
V
G
L
-
I
P
V
T
L
M
V
S
G
-
N
I
M
G
S
G
V
F
L
L
P
A
N
L
A
S
-
T
G
G
--
I
A
I
Y
G
W
L
V
T
I
I
G
-
A
L
G
L
-
S
--------
M
V
Y
A
K
M
S
F
L
D
P
-
S
--
P
G
G
S
Y
A
Y
A
R
R
C
F
G
P
-
F
L
-----------
G
Y
Q
T
N
V
L
Y
W
L
-
A
C
W
I
G
A
I
A
M
V
V
---
I
G
V
-
G
Y
L
S
Y
F
-
F
P
I
L
K
----------------
D
-----
P
L
V
L
T
-------------
I
----
T
C
V
V
V
--
L
W
-----
I
--
F
V
L
L
N
I
V
G
P
K
M
I
T
R
V
Q
A
V
A
T
V
L
A
L
I
P
I
V
----
G
I
A
V
F
G
W
F
W
F
R
-
G
E
---
T
Y
M
A
A
W
-------
N
V
S
G
-
L
G
-
T
-
F
G
A
I
Q
S
T
L
N
--
V
T
L
W
S
F
I
G
V
E
S
A
-
S
V
A
A
G
V
V
-
K
N
P
K
R
N
V
P
I
A
----
T
I
--------------------------------
G
G
V
L
I
A
A
V
C
Y
V
L
S
---
T
T
A
I
M
----
G
M
---
I
P
N
A
A
L
--
R
V
S-
A
----
S
P
F
G
D
A
A
-----------
R
---
M
-
A
------
L
G
--
D
T
--
A
G
A
I
V
S
F
---------
C
A
A
A
G
C
L
G
S
L
G
G
W
--------
T
L
L
A
G
Q
T
A
K
-
A
A
A
-
D
D
G
L
F
P
P
I
F
--
A
R
V
N
K
------
A
-
G
T
P
V
A
G
L
I
I
V
G
I
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
63.44
26%
-152
- C3 -
3NCY
-
ADIC_SALTY
A:
[10-333]
---------------------------------
V
G
L
-
I
P
V
T
L
M
V
S
G
-
N
I
M
G
S
G
V
F
L
L
P
A
N
L
A
A
-
T
G
G
---
I
A
I
Y
G
W
L
V
T
I
I
-
G
A
L
A
L
S
--------
M
V
Y
A
K
M
S
S
L
D
P
-
S
--
P
G
G
S
Y
A
Y
A
R
R
C
F
G
P
-
F
L
-----------
G
Y
Q
T
N
V
L
Y
W
L
-
A
C
W
I
G
N
I
A
M
V
V
---
I
G
V
-
G
Y
L
S
Y
F
-
F
P
I
L
K
----------------
D
-----
P
L
V
L
T
-----------
L
T
C
----
V
A
V
L
W
--
I
F
-----
V
--
L
L
N
I
V
--
G
P
K
M
I
T
R
V
Q
A
V
A
T
V
L
A
L
V
P
I
V
----
G
I
A
V
F
G
W
F
W
F
K
-
G
E
--------
W
-------
N
V
S
G
-
M
N
-
T
-
F
G
A
I
Q
S
T
L
N
--
V
T
L
W
S
F
I
G
V
E
S
A
-
S
V
A
A
G
V
V
-
K
N
P
K
R
N
V
P
I
A
----
T
I
--------------------------------
G
G
V
L
I
A
A
V
C
Y
V
L
S
---
T
T
A
I
M
----
G
M
---
I
P
N
A
A
L
--
R
V
S-
A
----
S
P
F
G
D
A
A
-----------
R
---
M
-
A
------
L
G
--
D
T
--
A
G
A
I
V
S
F
---------
C
A
A
A
G
C
L
G
S
L
G
G
W
--------
T
L
L
A
G
Q
T
A
K
-
A
A
A
-
D
D
G
L
F
P
P
I
F
--
A
R
------------
T
P
V
A
G
L
L
I
V
G
V
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
HHSearch
62.26
19%
-193
- C3 -
4DJK
-
GADC_ECOLI
A:
[12-450]
--------------------------------
Q
L
T
L
-
L
G
F
F
A
I
T
A
S
-
M
V
M
A
--
V
Y
E
Y
P
T
--
F
--
A
T
S
G
F
S
L
V
F
F
L
L
L
G
G
I
L
W
F
I
P
V
-
G
--------
L
C
A
A
E
M
A
T
V
D
G
W-----
G
V
F
A
W
V
S
N
T
L
G
P
-
R
W
-----------
G
F
---
A
A
I
S
F
-
G
Y
L
Q
I
A
I
G
F
I
P
M
L
Y
F
V
L
-
G
A
L
S
Y
I
-
L
K
W
-
P
----------------
A
L
---
N
-----------
E
D
P
I
T
K
T
I
----
A
A
L
I
I
--
L
W
-----
A
--
L
A
L
T
Q
F
G
G
T
K
Y
T
A
R
I
A
K
V
------
G
F
F
A
----
G
I
L
L
P
A
F
I
L
I
A
L
A
A
---
I
Y
L
H
------------
T
-
F
F
-
P
D
F
S
K
V
G
T
L
V
V
F
V
A
F
I
L
S
Y
M
G
V
E
A
S
-
A
T
H
V
N
E
M
-
S
N
P
G
R
D
Y
P
L
A
----
M
L
--------------------------------
L
L
M
V
A
A
I
C
L
S
S
V
G
---
G
L
S
I
A
----
M
V
---
I
P
G
N
E
I
--
N
L
--
S
A
G
V
M
Q
T
F
T
V
L
M
-----------
S
---
H
-
V
------
A
P
EI
E
W
--
T
V
R
V
I
S
A
---------
L
L
L
L
G
V
L
A
E
I
A
S
W
--------
I
V
G
P
S
R
G
M
Y
-
V
T
A
-
Q
K
N
L
L
P
A
A
F
--
A
K
M
N
-------
K
N
G
V
P
V
T
L
V
I
S
Q
L
V
I
T
S
I
A
L
I
-
I
---
L
T
N
TGGG
N
-
N
M
S
---
F
L
-
I
A
L
A
L
T
V
V
I
Y
--------
L
C
A
Y
F
M
L
F
------
I
G
Y
I
V
L
V
L
K
H
P
D
L
K
R
T
F
N
I
P
----
G
G
K
G
V
K
L
V
V
A
I
V
G
L
L
T
S
I
M
A
----------------------------------------------------------------------
8
PsiBlast_PDB
62.22
24%
-135
- C3 -
3LRC
-
ADIC_ECO57
A:
[6-333]
-----------------------------
D
A
H
K
V
G
L
-
I
P
V
T
L
M
V
S
G
-
N
I
M
G
S
G
V
F
L
L
P
A
N
L
A
S
-
T
G
G
--
I
A
I
Y
G
W
L
V
T
I
I
G
-
A
L
G
L
-
S
--------
M
V
Y
A
K
M
S
F
L
D
P
-
S
--
P
G
G
S
Y
A
Y
A
R
R
C
F
G
P
-
F
L
-----------
G
Y
Q
T
N
V
L
Y
W
L
-
A
C
W
I
G
N
I
A
M
V
V
---
I
G
V
-
G
Y
L
S
Y
F
-
F
P
I
L
K
----------------
D
-----
P
L
V
L
T
-------------
I
----
T
C
V
V
V
--
L
W
-----
I
--
F
V
L
L
N
I
V
G
P
K
M
I
T
R
V
Q
A
V
A
T
V
L
A
L
I
P
I
V
----
G
I
A
V
F
G
W
F
W
F
R
-
G
E
---
T
Y
M
A
A
W
-------
N
V
S
G
-
L
G
-
T
-
F
G
A
I
Q
S
T
L
N
--
V
T
L
W
S
F
I
G
V
E
S
A
-
S
V
A
A
G
V
V
-
K
N
P
K
R
N
V
P
I
A
----
T
I
--------------------------------
G
G
V
L
I
A
A
V
C
Y
V
L
S
---
T
T
A
I
M
----
G
M
---
I
P
N
--------------------------------------------------
T
--
A
G
A
I
V
S
F
---------
C
A
A
A
G
C
L
G
S
L
G
G
W
--------
T
L
L
A
G
Q
T
A
K
-
A
A
A
-
D
D
G
L
F
P
P
I
F
--
A
R
V
N
K
------
A
-
G
T
P
V
A
G
L
I
I
V
G
I
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
60.72
24%
-137
- C3 -
3LRB
-
ADIC_ECO57
A:
[6-333]
-----------------------------
D
A
H
K
V
G
L
-
I
P
V
T
L
M
V
S
G
-
N
I
M
G
S
G
V
F
L
L
P
A
N
L
A
S
-
T
G
G
--
I
A
I
Y
G
W
L
V
T
I
I
G
-
A
L
G
L
-
S
--------
M
V
Y
A
K
M
S
F
L
D
P
-
S
--
P
G
G
S
Y
A
Y
A
R
R
C
F
G
P
-
F
L
-----------
G
Y
Q
T
N
V
L
Y
W
L
-
A
C
W
I
G
N
I
A
M
V
V
---
I
G
V
-
G
Y
L
S
Y
F
-
F
P
I
L
K
----------------
D
-----
P
L
V
L
T
-------------
I
----
T
C
V
V
V
--
L
W
-----
I
--
F
V
L
L
N
I
V
G
P
K
M
I
T
R
V
Q
A
V
A
T
V
L
A
L
I
P
I
V
----
G
I
A
V
F
G
W
F
W
F
R
-
G
E
---
T
Y
M
A
A
W
-------
N
V
S
G
-
L
G
-
T
-
F
G
A
I
Q
S
T
L
N
--
V
T
L
W
S
F
I
G
V
E
S
A
-
S
V
A
A
G
V
V
-
K
N
P
K
R
N
V
P
I
A
----
T
I
--------------------------------
G
G
V
L
I
A
A
V
C
Y
V
L
S
---
T
T
A
I
M
----
G
M
---
I
P
N
--------------------------------------------------
T
--
A
G
A
I
V
S
F
---------
C
A
A
A
G
C
L
G
S
L
G
G
W
--------
T
L
L
A
G
Q
T
A
K
-
A
A
A
-
D
D
G
L
F
P
P
I
F
--
A
R
V
N
K
------
A
-
G
T
P
V
A
G
L
I
I
V
G
I
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
30
Fugue
53.59
12%
-175
- C3 -
2JLN
2
?
A:
[8-470]
--------
E
A
R
S
L
L
N
P
S
N
A
P
T
R
Y
A
E
------
R
S
V
G
P
-
F
S
L
A
A
I
W
F
A
-
M
A
I
Q
V
A
I
F
I
A
A
G
Q
M
T
S
-
S
F
Q
V
W
Q
V
I
V
A
I
A
A
G
C
T
I
-
A
V
I
L
-
L
--------
F
F
T
Q
S
A
A
I
R
W
G
-
I
--
N
F
T
V
A
A
R
M
-------------------------
P
F
G
I
R
-
G
S
L
I
P
I
T
L
K
A
L
---
L
S
L
-
F
W
F
G
F
Q
-
T
W
L
G
A
----------------
L
A
L
D
E
I
T
R
L
L
T
-
G
F
T
N
L
P
L
W
I
V
I
F
G
----
A
I
Q
V
V
--
T
T
-----
F
--
Y
G
---
I
T
F
I
R
W
M
N
V
F
A
S
P
------
V
L
L
A
----
M
G
V
Y
M
V
Y
L
M
L
D
-
G
A
---
D
V
S
L
G
E
VMSMGGE
N
P
G
M
-
P
F
-
S
-
T
A
I
M
I
F
V
G
G
W
I
A
V
V
V
S
I
H
D
I
V
K
E
-
C
K
V
D
P
N
A
-
S
R
E
G
Q
T
K
A
D
A
----
R
Y
--------------------------------
A
T
A
Q
W
L
G
M
V
P
A
S
I
---
I
F
G
F
I
----
G
A
---
A
S
M
V
L
V
--
G
E
--
W
----
N
P
V
I
A
I
T
-----------
E
---
V
-
V
------
G
G
--
V
S
--
I
P
M
A
I
L
F
---------
Q
V
F
V
L
L
A
T
W
--
S
T
--------
N
P
A
A
N
L
L
S
P
-
A
Y
T
-
L
C
S
T
F
P
R
-------
V
F
------
T
F
K
T
G
V
I
V
S
A
V
V
G
L
L
M
M
P
W
Q
F
-
A
---
G
--------
V
L
N
---
T
F
-
L
--
N
L
L
A
S
A
L
--------
G
P
L
A
G
I
M
I
------
S
D
Y
F
L
V
R
R
R
R
I
S
L
H
D
L
Y
R
T
K
GIYT
Y
W
----
R
G
V
N
W
V
A
L
A
V
Y
A
V
A
L
A
V
S
-
F
L
T
P
D
L
-----------
M
------
F
V
T
G
L
I
A
A
L
L
L
H
I
P
A
M
R
W
V
A
K
T
F
P
LFSEAESR
N
E
D
Y
L
RPIG
29
Fugue
46.20
18%
-166
- C3 -
4C4A
4
ANM7_MOUSE
A:
[27-688]
H
Q
E
I
A
R
SS
Y
A
D
M
L
H
D
K
D
R
N
I
K
Y
Y
Q
G
I
R
A
A
V
S
R
V
K
D
R
G
Q
K
A
L
V
L
D
I
G
-
T
--
G
T
G
L
L
S
M
M
A
V
T
A
G
-
A
D
F
C
Y
A
I
E
V
F
K
P
M
A
E
A
A
-
V
K
I
V
-
E
R
N
GFSDK
I
K
V
I
N
K
H
S
T
E
V
T
-
V
GP
D
G
D
L
P
C
R
A
N
I
L
I
T
E
-
L
F
DTELIGEG
A
L
P
S
Y
---
E
H
A
H
K
H
L
V
Q
E
D
C
E
A
V
P
H
---
R
A
T
-
V
Y
A
Q
L
V
-
E
S
R
R
M
W
S
W
N
KL
F
P
V
R
V
R
T
SL
G
E
Q
V
I
V
P
P
S
E
L
E
-
R
C
P
G
A
P
S
V
C
D
I
Q
L
NQVS
P
A
D
F
T
--
V
L
SDVLP
M
--
F
S
V
D
F
S
K
Q
V
S
S
S
A
A
C
H
S
R
------
Q
F
V
P
LASG
Q
A
Q
V
V
L
S
W
W
D
I
-
E
M
DPE
G
K
I
K
C
T
MAP----
F
W
A
Q
-
T
D
-
P
-
Q
E
L
Q
W
R
D
H
W
M
Q
C
V
Y
F
L
P
Q
E
E
P
V
V
-
Q
G
S
P
R
C
L
-
V
A
H
H
D
D
Y
C
V
W
----
Y
S
L
Q
R
TSPQVRPVCDCQAHLLWN
R
P
R
F
G
E
I
N
D
Q
D
R
T
D
H
Y
A
Q
A
L
R
T
V
L
LPG
S
V
C
L
C
V
S
D
G
S
L
---
L
S
M
L
A
H
--
H
L
--
G
----
A
E
Q
V
F
T
V
E
SS
V
A
S
Y
R
L
M
K
R
---
I
-
F
------
K
V
--
N
H
--
L
E
D
K
I
S
V
I
NKRPELLT
A
A
D
L
E
G
K
K
V
S
L
L
L
G
EPFFTTS
L
L
P
W
H
N
L
Y
F
-
W
Y
V
-
R
T
S
V
D
Q
H
L
A
PG
A
V
V
M
P
Q
A
A
S
L
H
A
V
I
V
E
F
R
D
L
W
R
I
R
S
P
C
G
D
C
E
G
-
F
DV
H
I
--------
M
D
D
---
M
I
-
K
--
H
S
L
D
F
R
E
S
R
E
A
E
P
H
P
L
W
E
Y
P
C
R
S
LSK
P
Q
E
I
L
T
F
D
F
Q
Q
P
I
P
Q
Q
P
M
Q
S
K
G
T
----
M
E
----
L
T
R
P
G
K
S
H
G
A
V
L
W
M
E
Y
Q
L
T
P
D
S
T
I
S
-----------
T
GLINPG
D
C
C
W
N
P
H
C
K
Q
A
V
Y
F
L
S
T
P
R
S
V
S
Y
V
V
E
F
H
PLTG
D
I
T
M
E
F
R
L
A
31
Fugue
44.93
15%
-148
- C3 -
4DIM
-
?
A:
[3-400]
-------------
D
N
K
R
L
L
I
L
G
A
G
R
G
Q
L
G
L
Y
K
A
A
K
E
-
L
G
I
H
T
I
A
G
T
M
P
N
A
H
K
P
C
L
N
L
A
D
E
I
S
Y
M
D
I
S
N
P
D
E
V
E
Q
K
V
K
D
L
N
L
-
D
G
A
A
-
T
--------
C
C
L
D
T
-----------------
G
I
V
S
L
A
R
-
I
C
-----------
D
K
E
N-
L
V
G
L
N
----------
E
E
---
A
A
I
M
C
G
D
K
Y
K
M
K
E
A
F
K
----------------
K
Y
N
V
N
T
A
R
H
F
V
V
R
N
E
N
E
L
K
N
A
L
E
N
L
----
K
L
P
V
I
--
V
K
-----
A
TD
L
I
Y
I
A
K
K
E
E
E
A
I
D
G
F
N
E
T
M
-----
N
L
T
K
----
R
D
Y
C
I
V
E
E
F
I
E
-
G
-----------------------
Y
-
E
-
F
G
A
Q
A
F
V
Y
K
N
D
V
L
F
--------
V
M
P
H
G
D
E
T
Y
M
S
H
T
A
--
V
P
V
G
----
H
Y
--------------------------------
V
P
L
D
V
K
D
D
I
I
E
K
T
---
K
T
E
V
K
----
K
A
---
I
K
A
L
G
L
--
N
---------
N
C
A
V
N
V
-----------
D
M
--
I
-
L
------
K
D
--
N
E
--
V
Y
I
I
E
L
T
---------
G
R
V
G
A
N
C
L
P
E
L
V
E
--------
I
N
Y
G
I
E
Y
Y
K
M
I
A
S
M
A
I
S
E
N
P
L
V
F
--
W
S
Q
K
S
------
K
E
N
K
------------
A
G
L
A
R
M
I
---
I
--------
E
T
E
---
K
S
-
G
--
I
L
K
E
I
L
N
--------
S
N
A
K
D
D
D
I
------
V
E
I
T
F
F
K
E
E
N
D
E
I
K
K
---------
F
E
----
N
S
N
D
C
I
--
G
Q
I
I
V
K
E
E
T
L
-
D
K
C
K
D
K
-----------
L
------
D
V
I
I
N
N
I
N
I
I
L
K
-----------------------------
10
PsiBlast_PDB
35.28
28%
-216
- C3 -
4BWZ
-
?
A:
[175-259]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
E
V
G
----
A
I
--------------------------------
T
R
L
I
V
L
S
V
V
F
V
G
L
---
A
V
F
L
S
----
T
L
IAR
L
P
L
E
R
L
--
P
V
--
G
----
S
P
L
G
F
A
L
-----------
A
---
L
G
V
------
G
M
--
A
A
--
L
A
A
S
I
G
L
---------
A
P
I
V
G
--
A
F
L
G
G
M
--------
L
L
S
E
V
R
E
K
Y
-
R
L
E
-
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
34.58
28%
-221
- C3 -
5BZ3
4
?
A:
[174-258]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
E
V
G
----
A
I
--------------------------------
T
R
L
I
V
L
S
V
V
F
V
G
L
---
A
V
F
L
S
----
T
L
I
A
R
L
P
L
E
R
L
--
P
V
--
G
----
S
P
L
G
F
A
L
-----------
A
---
L
G
V
------
G
M
--
A
A
--
L
A
A
S
I
G
L
---------
A
P
I
V
G
--
A
F
L
G
G
M
--------
L
L
S
E
V
R
E
K
Y
-
R
L
E
-
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
33.10
21%
-132
- C3 -
4DJI
-
GADC_ECOLI
A:
[187-410]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
E
M
D
-------
S
K
T
F
-
F
P
-
D
-
F
S
K
V
G
T
L
V
V
F
V
A
F
I
L
S
Y
M
G
V
E
A
S
-
A
T
H
V
N
E
M
-
S
N
P
G
R
D
Y
P
L
A
M
L
L
L
M
V
--------------------------------
A
A
I
C
L
S
S
V
G
G
L
S
I
---
A
M
V
I
P
----
G
N
---
E
I
N
L
S
A
--
G
V
--
M
----
Q
T
F
T
V
L
M
-----------
S
---
H
-
V
------
A
P
--
E
I
EW
T
V
R
V
I
S
A
---------
L
L
L
L
G
V
L
A
E
I
A
S
W
--------
I
V
G
P
S
R
G
M
Y
-
V
T
A
-
Q
K
N
L
L
P
A
A
F
--
A
K
M
N
K
------
N
-
G
V
P
V
T
L
V
-
I
S
Q
L
V
I
T
S
I
A
L
-
I
---
I
LT------
N
T
G
GGN
N
M
-
S
--
F
L
I
A
L
A
L
T
V
V
I
Y
---
L
C
A
Y
F
M
L
F
------
I
G
Y
I
V
L
V
L
K
H
P
D
L
K
R
T
F
N
I
P
----------------------------------------------------------------------------------------------
11
PsiBlast_PDB
32.13
28%
-215
- C3 -
5BZ2
-
?
A:
[175-259]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
E
V
G
----
A
I
--------------------------------
T
R
L
I
V
L
S
V
V
F
V
G
L
---
A
V
F
L
S
----
T
L
IAR
L
P
L
E
R
L
--
P
V
--
G
----
S
P
L
G
F
A
L
-----------
A
---
L
G
V
------
G
M
--
A
A
--
L
A
A
S
I
G
L
---------
A
P
I
V
G
--
A
F
L
G
G
M
--------
L
L
S
E
V
R
E
K
Y
-
R
L
E
-
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------