@TOME V2.3
(Mar 2018)
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 : spr1644: (2018-01-16 )
MIKFDNIQIKYGDFVAIDNLNLDIHEGEFFTFLGPSGCGKSTTLRALVGFLDPSSGSIEVNGTDVTHLEPEKRGIGIVFQSYALFPTMTVFDNIAFGLKVKKVAPDVIKAKVSAVAAKIKISDQQLQRNVSELSGGQQQRVALARALVLEPKILCLDEPLSNLDAKLRVDLRKELKRLQKELGITTLYVTHDQEEALTLSDRIAVFNNGYIEQVGTPVEIYHNSQTEFVCDFIGDINVLTDETVHEVLLKNTSVFLEDKKGYIRLEKVRFNRETKQDFILKGTIIDVEFSGVTIHYTIKVSESQILNVTSIDSQAAIRSVGESVELFITPSDVLQF
Atome Classification :
(24 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....
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MIKF
D
N
I
Q
I
K
Y--G
D
F
V
--
A
I
D
N
L
N
L
D
I
HEG
E
F
F
T
F
LGPSGCGK
S
T
T
L
R
A
L
V
G
FLD-PSS
G
S
I
E
VNGTDVTHL------E------PE------KR
G
I
G
I
V
F
QSYALF
P
T
M
T
V
F
DNIAFG
L
K
V
K---KVA
P
D
V
I
K
A
K
V
S
A
V
A
A
K
I
K
I
S
D
Q
Q
L
Q
R
N
V
S
E
LSGG
Q
Q
Q
R
V
A
L
A
R
A
LVLE
P
K
I
L
C
LDEPLSNL
D
A
K
L
R
V
D
L
R
K
E
L
K
R
L
Q
K
ELG
I
T
T
L
Y
V
THDQEEALTLS
D
R
I
A
VFNNG
Y
I
E
QVGT
P
V
E
I
Y
HNSQTE
F
V
C
D
F
IG--D--I--NVL
T
D
E
T
V
----
H
E
V
----
L
-------
L
--------K--N--------
T
-----
S
V
F
L
E-DKK
G
Y
----------
I
R
L
E
K
V
RFNRETK----Q
D
F
I
L
K
G
T
I
I
D
V
E
FS
G
V
T
I
H
Y
T
I
K
VSE
S
Q
-
I
L
N
V
TSI
D
S
Q
A
A
I
R
S
-VGE
S
V
E
L
F
I
T
P
S
D
V
LQF
4
PsiBlast_PDB
86.37
42%
-103
- C1 -
-
2YYZ
1
?
A:
[4-342]
-
I
R
V
V
N
L
K
K
Y
F
--
G
K
V
K
--
A
V
D
G
V
S
F
E
V
K
D
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E
F
V
A
L
L
G
P
S
G
C
G
K
T
T
T
L
L
M
L
A
G
I
Y
K
-
P
T
S
G
E
I
Y
F
D
D
V
L
V
N
D
I
------
P
------
P
K
------
Y
R
E
V
G
M
V
F
Q
N
Y
A
L
Y
P
H
M
T
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P
L
R
A
R
---
R
I
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R
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V
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I
A
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I
-
D
N
L
L
D
R
K
P
T
Q
L
S
G
G
Q
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V
A
L
A
R
A
L
V
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K
V
L
L
F
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L
S
N
L
D
A
N
L
R
M
I
M
R
A
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L
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Q
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L
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T
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D
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A
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A
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T
M
A
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F
N
Q
G
K
L
V
Q
Y
G
T
P
D
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V
Y
D
S
P
K
N
M
F
V
A
S
F
I
G
--
N
P
P
T
--
N
F
L
R
D
F
S
V
S
V
E
N
K
Q
T
----
I
-------
L
--------
K
--
R
--------
D
-----
D
V
I
I
K
-
L
P
E
P
V
D
V
KLK
E
V
V
V
G
I
R
P
E
H
C
R
I
S
R
E
R
V
----
E
N
S
I
-
P
G
V
V
Y
V
V
E
P
L
G
R
D
I
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V
N
V
K
T
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K
G
E
-
I
I
K
V
F
G
D
T
G
K
A
P
--
Q
-
P
G
E
N
V
--
F
L
V
P
------
136
HHSearch
84.28
44%
-103
- C1 -
-
2YYZ
1
?
A:
[3-350]
S
I
R
V
V
N
L
K
K
Y
F
--
G
K
V
K
--
A
V
D
G
V
S
F
E
V
K
D
G
E
F
V
A
L
L
G
P
S
G
C
G
K
T
T
T
L
L
M
L
A
G
I
Y
K
-
P
T
S
G
E
I
Y
F
D
D
V
L
V
N
D
I
------
P
------
P
K
------
Y
R
E
V
G
M
V
F
Q
N
Y
A
L
Y
P
H
M
T
V
F
E
N
I
A
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L
R
A
R
---
R
I
S
K
D
E
V
E
K
R
V
V
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I
A
R
K
L
L
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D
N
L
-
L
D
R
K
P
T
Q
L
S
G
G
Q
Q
Q
R
V
A
L
A
R
A
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Q
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V
L
L
F
D
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S
N
L
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A
N
L
R
M
I
M
R
A
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I
K
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Q
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L
G
I
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V
Y
V
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Q
A
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A
M
T
M
A
S
R
I
A
V
F
N
Q
G
K
L
V
Q
Y
G
T
P
D
E
V
Y
D
S
P
K
N
M
F
V
A
S
F
I
G
--
N
--
P
P
T
N
F
L
R
D
F
S
V
----
S
V
E
N---
K
Q
T
I
----
L
K
R
------
D
--
D
V
I
I
K
L
P
E
-
P
-----
V
D
V
K
L
K
E
V
V
V
G
----------
I
R
P
E
H
C
R
I
S
R
E
R
-----
V
E
N
S
I
P
G
V
V
Y
V
V
E
P
L
G
R
D
I
I
V
N
V
K
T
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K
G
E
-
I
I
K
V
-
F
G
D
--
T
G
K
A
P
Q
P
G
E
N
V
F
L
V
P
D
L
R
K
I
H
L
F
131
HHSearch
81.98
40%
-98
- C1 -
-
3RLF
2
MALK_ECOLI
A:
[3-355]
S
V
Q
L
Q
N
V
T
K
A
W
--
G
E
V
V
--
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
-
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
------
P
------
P
A
------
E
R
G
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
M
S
F
G
L
K
L
A
---
G
A
K
K
E
V
I
N
Q
R
V
N
Q
V
A
E
V
L
Q
L
A
H
L
-
L
D
R
K
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
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I
S
R
L
H
K
R
L
G
R
T
M
I
Y
V
T
H
D
Q
V
E
A
M
T
L
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
L
E
L
Y
H
Y
P
A
D
R
F
V
A
G
F
I
G
--
S
--
P
K
M
N
F
L
P
V
K
V
T
----
A
T
A
I---
D
Q
V
Q
----
V
E
L
PM----
P
NR
Q
Q
V
W
L
PVES
R
-----
D
V
Q
V
G
A
N
M
S
L
G
----------
I
R
P
E
H
L
L
P
S
D
I
A
------
D
V
I
L
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G
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Q
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V
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Q
L
G
N
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T
Q
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I
Q
I
P
S
I
R
Q
N
L
V
Y
-
R
Q
N
--
D
V
V
L
V
E
E
G
A
T
F
A
I
G
L
P
P
E
R
C
H
L
F
147
HHSearch
81.65
42%
-111
- C1 -
-
1V43
-
?
A:
[13-364]
-
V
K
L
E
N
L
T
K
R
F
--
G
N
F
T
--
A
V
N
K
L
N
L
T
I
K
D
G
E
F
L
V
L
L
G
P
S
G
C
G
K
T
T
T
L
R
M
I
A
G
L
E
E
-
P
T
E
G
R
I
Y
F
G
D
R
D
V
T
Y
L
------
P
------
P
K
------
D
R
N
I
S
M
V
F
Q
------
H
M
T
V
Y
E
N
I
A
F
P
L
--
K
---
K
F
P
K
D
E
I
D
K
R
V
R
W
A
A
E
L
L
Q
I
E
E
L
-
L
N
R
Y
P
A
Q
L
S
G
G
Q
R
Q
R
V
A
V
A
R
A
I
V
V
E
P
D
V
L
L
M
D
E
P
L
S
N
L
D
A
K
L
R
V
A
M
R
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K
K
L
Q
Q
K
L
K
V
T
T
I
Y
V
T
H
D
Q
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E
A
M
T
M
G
D
R
I
A
V
M
N
R
G
Q
L
L
Q
I
G
S
P
T
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V
Y
L
R
P
N
S
V
F
V
A
T
F
I
G
--
A
--
P
EM
N
I
L
E
V
S
V
G
----
D
G
Y
L
E
G
R
G
-------
F
R
I
E
L
----
P
--
Q
MDL-----
L
-----
K
D
Y
V
G
K
T
V
L
F
G
----------
I
R
P
E
H
M
T
V
E
G
V
--HMK-
R
T
A
R
L
I
G
K
V
D
F
V
E
A
L
G
T
D
T
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L
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K
F
G
D
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L
--
V
K
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K
L
P
--
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I
E
P
G
R
E
V
K
V
I
M
D
L
D
M
I
H
V
F
132
HHSearch
81.00
40%
-99
- C1 -
-
2AWN
1
MALK_ECOLI
B:
[3-355]
S
V
Q
L
Q
N
V
T
K
A
W
--
G
E
V
V
--
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
-
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
------
P
------
P
A
------
E
R
G
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
M
S
F
G
L
K
L
A
---
G
A
K
K
E
V
I
N
Q
R
V
N
Q
V
A
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V
L
Q
L
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L
-
L
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P
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A
L
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G
Q
R
Q
R
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A
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R
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P
S
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L
L
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L
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L
D
A
A
L
R
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Q
M
R
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S
R
L
H
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R
L
G
R
T
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T
H
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E
A
M
T
L
A
D
K
I
V
V
L
D
A
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R
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V
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K
P
L
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L
Y
H
Y
P
A
D
R
F
V
A
G
F
I
G
--
S
--
P
K
M
N
F
L
P
V
K
V
T
----
A
T
A
I---
D
Q
V
Q
----
V
E
L
P
M
----
P
NR
Q
Q
V
W
L
PVES
R
-----
D
V
Q
V
G
A
N
M
S
L
G
----------
I
R
P
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H
L
L
P
S
D
I
A
------
D
V
I
L
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G
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Q
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V
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Q
L
G
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Q
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Q
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Q
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--
D
V
V
L
V
E
E
G
A
T
F
A
I
G
L
P
P
E
R
C
H
L
F
142
HHSearch
77.24
44%
-94
- C1 -
-
2IT1
-
?
A:
[4-349]
-
I
K
L
E
N
I
V
K
K
F
--
G
N
F
T
--
A
L
N
N
I
N
L
K
I
K
D
G
E
F
M
A
L
L
G
P
S
G
S
G
K
S
T
L
L
Y
T
I
A
G
I
Y
K
-
P
T
S
G
K
I
Y
F
D
E
K
D
V
T
E
L
------
P
------
P
K
------
D
R
N
V
G
L
V
F
Q
N
W
A
L
Y
P
H
M
T
V
Y
K
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A
F
P
L
E
L
R
---
K
A
P
R
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E
I
D
K
K
V
R
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A
K
M
L
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K
L
-
L
N
R
Y
P
W
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
V
K
E
P
E
V
L
L
L
D
E
P
L
S
N
L
D
A
L
L
R
L
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V
R
A
E
L
K
R
L
Q
K
E
L
G
I
T
T
V
Y
V
T
H
D
Q
A
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A
L
A
M
A
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I
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E
I
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V
G
T
P
D
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V
Y
Y
K
P
K
Y
K
F
V
G
G
F
L
G
--
N
--
P
P
M
N
F
V
E
A
K
V
E
----
D
G
K
----
L
V------
I
TEK
S
K
L
P
I
P
--
K
--------
Q
Y
V
E
I
V
K
E
T
G
I
T
E
V
I
I
G
----------
F
R
P
H
D
A
E
I
V
K
G
E
G
------
E
G
I
V
G
E
V
Y
S
F
E
P
L
G
R
E
Q
I
V
T
V
S
V
N
D
S
I
-
V
-
K
V
-
F
A
P
--
E
G
E
H
F
S
F
G
E
K
V
T
I
K
V
K
E
E
L
L
V
L
F
14
PsiBlast_PDB
76.83
48%
-141
- C1 -
-
3PUV
2
MALK_ECOLI
A:
[4-235]
-
V
Q
L
Q
N
V
T
K
A
W
--
G
E
V
V
--
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
-
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
------
P
------
P
A
------
E
R
G
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
M
S
F
G
L
K
L
A
---
G
A
K
K
E
V
I
N
Q
R
V
N
Q
V
A
E
V
L
Q
L
A
-
H
L
L
D
R
K
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
G
R
T
M
I
Y
V
T
H
D
Q
V
E
A
M
T
L
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
L
E
L
Y
H
Y
P
A
D
R
F
V
A
G
F
I
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
76.67
52%
-133
- C1 -
-
1V43
-
?
A:
[13-257]
-
V
K
L
E
N
L
T
K
R
F
--
G
N
F
T
--
A
V
N
K
L
N
L
T
I
K
D
G
E
F
L
V
L
L
G
P
S
G
C
G
K
T
T
T
L
R
M
I
A
G
L
E
E
-
P
T
E
G
R
I
Y
F
G
D
R
D
V
T
Y
L
------
P
------
P
K
------
D
R
N
I
S
M
V
F
Q
------
H
M
T
V
Y
E
N
I
A
F
P
L
--
K
---
K
F
P
K
D
E
I
D
K
R
V
R
W
A
A
E
L
L
Q
I
-
E
E
L
L
N
R
Y
P
A
Q
L
S
G
G
Q
R
Q
R
V
A
V
A
R
A
I
V
V
E
P
D
V
L
L
M
D
E
P
L
S
N
L
D
A
K
L
R
V
A
M
R
A
E
I
K
K
L
Q
Q
K
L
K
V
T
T
I
Y
V
T
H
D
Q
V
E
A
M
T
M
G
D
R
I
A
V
M
N
R
G
Q
L
L
Q
I
G
S
P
T
E
V
Y
L
R
P
N
S
V
F
V
A
T
F
I
G
AP
E
--
M
--
N
I
L
--------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
76.17
56%
-130
- C1 -
-
2IT1
-
?
A:
[4-236]
-
I
K
L
E
N
I
V
K
K
F
--
G
N
F
T
--
A
L
N
N
I
N
L
K
I
K
D
G
E
F
M
A
L
L
G
P
S
G
S
G
K
S
T
L
L
Y
T
I
A
G
I
Y
K
-
P
T
S
G
K
I
Y
F
D
E
K
D
V
T
E
L
------
P
------
P
K
------
D
R
N
V
G
L
V
F
Q
N
W
A
L
Y
P
H
M
T
V
Y
K
N
I
A
F
P
L
E
L
R
---
K
A
P
R
E
E
I
D
K
K
V
R
E
V
A
K
M
L
H
I
-
D
K
L
L
N
R
Y
P
W
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
V
K
E
P
E
V
L
L
L
D
E
P
L
S
N
L
D
A
L
L
R
L
E
V
R
A
E
L
K
R
L
Q
K
E
L
G
I
T
T
V
Y
V
T
H
D
Q
A
E
A
L
A
M
A
D
R
I
A
V
I
R
E
G
E
I
L
Q
V
G
T
P
D
E
V
Y
Y
K
P
K
Y
K
F
V
G
G
F
L
G
--
N
----------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
75.79
48%
-143
- C1 -
-
3PUZ
1
MALK_ECOLI
A:
[4-235]
-
V
Q
L
Q
N
V
T
K
A
W
--
G
E
V
V
--
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
-
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
------
P
------
P
A
------
E
R
G
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
M
S
F
G
L
K
L
A
---
G
A
K
K
E
V
I
N
Q
R
V
N
Q
V
A
E
V
L
Q
L
A
-
H
L
L
D
R
K
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
G
R
T
M
I
Y
V
T
H
D
Q
V
E
A
M
T
L
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
L
E
L
Y
H
Y
P
A
D
R
F
V
A
G
F
I
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
75.66
52%
-129
- C1 -
-
1VCI
1
?
A:
[13-257]
-
V
K
L
E
N
L
T
K
R
F
--
G
N
F
T
--
A
V
N
K
L
N
L
T
I
K
D
G
E
F
L
V
L
L
G
P
S
G
C
G
K
T
T
T
L
R
M
I
A
G
L
E
E
-
P
T
E
G
R
I
Y
F
G
D
R
D
V
T
Y
L
------
P
------
P
K
------
D
R
N
I
S
M
V
F
Q
------
H
M
T
V
Y
E
N
I
A
F
P
L
--
K
---
K
F
P
K
D
E
I
D
K
R
V
R
W
A
A
E
L
L
Q
I
-
E
E
L
L
N
R
Y
P
A
Q
L
S
G
G
Q
R
Q
R
V
A
V
A
R
A
I
V
V
E
P
D
V
L
L
M
D
E
P
L
S
N
L
D
A
K
L
R
V
A
M
R
A
E
I
K
K
L
Q
Q
K
L
K
V
T
T
I
Y
V
T
H
D
Q
V
E
A
M
T
M
G
D
R
I
A
V
M
N
R
G
Q
L
L
Q
I
G
S
P
T
E
V
Y
L
R
P
N
S
V
F
V
A
T
F
I
G
AP
E
--
M
--
N
I
L
--------------------------------------------------------------------------------------------------------------------------------------------------------
37
PsiBlast_CBE
75.38
48%
-133
- C1 -
-
2R6G
2
MALK_ECOLI (first)
A:
[4-235]
-
V
Q
L
Q
N
V
T
K
A
W
--
G
E
V
V
--
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
-
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
------
P
------
P
A
------
E
R
G
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
M
S
F
G
L
K
L
A
---
G
A
K
K
E
V
I
N
Q
R
V
N
Q
V
A
E
V
L
Q
L
A
-
H
L
L
D
R
K
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
Q
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
G
R
T
M
I
Y
V
T
H
D
Q
V
E
A
M
T
L
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
L
E
L
Y
H
Y
P
A
D
R
F
V
A
G
F
I
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
75.36
48%
-139
- C1 -
-
3PUX
2
MALK_ECOLI
A:
[4-235]
-
V
Q
L
Q
N
V
T
K
A
W
--
G
E
V
V
--
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
-
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
------
P
------
P
A
------
E
R
G
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
M
S
F
G
L
K
L
A
---
G
A
K
K
E
V
I
N
Q
R
V
N
Q
V
A
E
V
L
Q
L
A
-
H
L
L
D
R
K
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
G
R
T
M
I
Y
V
T
H
D
Q
V
E
A
M
T
L
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
L
E
L
Y
H
Y
P
A
D
R
F
V
A
G
F
I
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
75.24
48%
-140
- C1 -
-
3PUY
2
MALK_ECOLI
A:
[4-235]
-
V
Q
L
Q
N
V
T
K
A
W
--
G
E
V
V
--
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
-
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
------
P
------
P
A
------
E
R
G
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
M
S
F
G
L
K
L
A
---
G
A
K
K
E
V
I
N
Q
R
V
N
Q
V
A
E
V
L
Q
L
A
-
H
L
L
D
R
K
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
G
R
T
M
I
Y
V
T
H
D
Q
V
E
A
M
T
L
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
L
E
L
Y
H
Y
P
A
D
R
F
V
A
G
F
I
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
74.89
48%
-141
- C1 -
-
3RLF
2
MALK_ECOLI
A:
[4-235]
-
V
Q
L
Q
N
V
T
K
A
W
--
G
E
V
V
--
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
-
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
------
P
------
P
A
------
E
R
G
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
M
S
F
G
L
K
L
A
---
G
A
K
K
E
V
I
N
Q
R
V
N
Q
V
A
E
V
L
Q
L
A
-
H
L
L
D
R
K
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
G
R
T
M
I
Y
V
T
H
D
Q
V
E
A
M
T
L
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
L
E
L
Y
H
Y
P
A
D
R
F
V
A
G
F
I
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
74.77
48%
-137
- C1 -
-
3PUW
2
MALK_ECOLI
A:
[4-235]
-
V
Q
L
Q
N
V
T
K
A
W
--
G
E
V
V
--
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
-
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
------
P
------
P
A
------
E
R
G
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
M
S
F
G
L
K
L
A
---
G
A
K
K
E
V
I
N
Q
R
V
N
Q
V
A
E
V
L
Q
L
A
-
H
L
L
D
R
K
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
G
R
T
M
I
Y
V
T
H
D
Q
V
E
A
M
T
L
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
L
E
L
Y
H
Y
P
A
D
R
F
V
A
G
F
I
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
74.76
48%
-138
- C1 -
-
4KI0
3
MALK_ECOLI
A:
[4-235]
-
V
Q
L
Q
N
V
T
K
A
W
--
G
E
V
V
--
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
-
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
------
P
------
P
A
------
E
R
G
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
M
S
F
G
L
K
L
A
---
G
A
K
K
E
V
I
N
Q
R
V
N
Q
V
A
E
V
L
Q
L
A
-
H
L
L
D
R
K
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
G
R
T
M
I
Y
V
T
H
D
Q
V
E
A
M
T
L
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
L
E
L
Y
H
Y
P
A
D
R
F
V
A
G
F
I
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
PsiBlast_CBE
74.74
48%
-144
- C1 -
-
3PUZ
1
MALK_ECOLI
B:
[4-235]
-
V
Q
L
Q
N
V
T
K
A
W
--
G
E
V
V
--
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
-
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
------
P
------
P
A
------
E
R
G
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
M
S
F
G
L
K
L
A
---
G
A
K
K
E
V
I
N
Q
R
V
N
Q
V
A
E
V
L
Q
L
A
-
H
L
L
D
R
K
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
G
R
T
M
I
Y
V
T
H
D
Q
V
E
A
M
T
L
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
L
E
L
Y
H
Y
P
A
D
R
F
V
A
G
F
I
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
74.33
48%
-135
- C1 -
-
4KI0
2
MALK_ECOLI
B:
[4-235]
-
V
Q
L
Q
N
V
T
K
A
W
--
G
E
V
V
--
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
-
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
------
P
------
P
A
------
E
R
G
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
M
S
F
G
L
K
L
A
---
G
A
K
K
E
V
I
N
Q
R
V
N
Q
V
A
E
V
L
Q
L
A
-
H
L
L
D
R
K
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
G
R
T
M
I
Y
V
T
H
D
Q
V
E
A
M
T
L
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
L
E
L
Y
H
Y
P
A
D
R
F
V
A
G
F
I
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
74.30
48%
-136
- C1 -
-
3RLF
2
MALK_ECOLI
B:
[4-236]
-
V
Q
L
Q
N
V
T
K
A
W
--
G
E
V
V
--
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
-
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
------
P
------
P
A
------
E
R
G
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
M
S
F
G
L
K
L
A
---
G
A
K
K
E
V
I
N
Q
R
V
N
Q
V
A
E
V
L
Q
L
A
-
H
L
L
D
R
K
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
G
R
T
M
I
Y
V
T
H
D
Q
V
E
A
M
T
L
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
L
E
L
Y
H
Y
P
A
D
R
F
V
A
G
F
I
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
143
HHSearch
71.64
42%
-9
- C1 -
-
2D62
1
?
A:
[7-366]
-
V
K
L
I
N
I
W
K
R
F
--
G
D
V
T
--
A
V
K
D
L
S
L
E
I
K
D
G
E
F
L
V
L
L
G
P
S
G
C
G
K
T
T
T
L
R
M
I
A
G
L
E
E
-
P
T
R
G
Q
I
Y
I
E
D
N
L
V
A
D
P
EKG
V
F
V
P
------
P
K
------
E
R
D
V
A
M
V
F
Q
S
Y
A
L
Y
P
H
M
T
V
Y
D
N
I
A
F
P
L
K
L
R
---
K
V
P
K
Q
E
I
D
K
R
V
R
E
V
A
E
M
L
G
L
T
E
L
-
L
N
R
K
P
R
E
L
S
G
G
Q
R
Q
R
V
A
L
G
R
A
I
I
R
R
P
K
V
F
L
M
D
E
P
L
S
N
L
D
A
K
L
R
V
K
M
R
A
E
L
K
K
L
Q
R
Q
L
G
V
T
T
I
Y
V
T
H
D
Q
V
E
A
M
T
M
G
D
R
I
A
V
M
N
K
G
E
L
Q
Q
V
G
T
P
D
E
V
Y
Y
K
P
V
N
T
F
V
A
G
F
I
G
--
S
--
P
P
M
N
F
L
D
A
T
I
T
----
D
D
G
----
F
LDFGE
F
K
L
K
L
L-----
Q
--
D
Q
F
E
V
L
E
--
E
-----
E
N
M
V
G
K
E
V
I
F
G
----------
I
R
P
E
D
V
H
D
A
S
F
T
H
IDVP
E
E
N
T
V
K
A
T
V
D
I
I
E
N
L
G
G
E
K
I
V
H
L
R
R
G
N
I
S
--
F
T
A
-
K
F
P
--
K
E
S
K
V
R
E
G
D
E
V
S
V
V
F
D
M
K
K
I
H
I
F
5
PsiBlast_PDB
65.62
51%
-12
- C1 -
-
2D62
1
?
A:
[7-244]
-
V
K
L
I
N
I
W
K
R
F
--
G
D
V
T
--
A
V
K
D
L
S
L
E
I
K
D
G
E
F
L
V
L
L
G
P
S
G
C
G
K
T
T
T
L
R
M
I
A
G
L
E
E
-
P
T
R
G
Q
I
Y
I
E
D
N
L
V
A
D
P
------
E
KG
V
F
V
P
P
K
------
E
R
D
V
A
M
V
F
Q
S
Y
A
L
Y
P
H
M
T
V
Y
D
N
I
A
F
P
L
K
L
R
---
K
V
P
K
Q
E
I
D
K
R
V
R
E
V
A
E
M
L
G
L
T
-
E
L
L
N
R
K
P
R
E
L
S
G
G
Q
R
Q
R
V
A
L
G
R
A
I
I
R
R
P
K
V
F
L
M
D
E
P
L
S
N
L
D
A
K
L
R
V
K
M
R
A
E
L
K
K
L
Q
R
Q
L
G
V
T
T
I
Y
V
T
H
D
Q
V
E
A
M
T
M
G
D
R
I
A
V
M
N
K
G
E
L
Q
Q
V
G
T
P
D
E
V
Y
Y
K
P
V
N
T
F
V
A
G
F
I
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
149
HHSearch
51.35
34%
-68
- C1 -
-
4YER
2
?
A:
[5-255]
I
I
V
V
E
N
L
V
K
K
F
--
G
D
F
E
--
A
V
K
G
V
S
F
S
V
K
K
G
E
I
F
A
F
L
G
P
N
G
A
G
K
T
T
T
I
H
M
L
T
T
L
L
K
-
P
T
S
G
K
A
W
V
A
G
H
D
V
L
K
E
P
-----
R
------
E
V
------
R
R
K
I
G
I
V
F
Q
D
Q
S
L
D
R
E
L
T
A
Y
E
N
M
Y
I
H
G
K
I
Y
---
G
Y
G
G
E
K
L
K
K
R
I
L
E
L
L
E
F
V
E
L
L
E
F
-
K
D
K
P
V
K
T
F
S
G
G
M
A
R
R
L
E
I
A
R
S
L
I
H
E
P
E
V
L
F
L
D
E
P
T
I
G
L
D
P
H
T
R
A
H
M
W
E
Y
I
S
K
M
K
K
E
H
N
M
T
I
F
L
T
T
H
Y
M
D
E
A
E
Q
L
A
D
R
V
A
I
I
D
H
G
K
I
I
A
L
G
T
P
T
E
L
K
R
M
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
95
PsiBlast_CBE
37.70
33%
31
- C1 -
-
3TIF
4
Y796_METJA
B:
[1-225]
M
V
K
L
K
N
V
T
K
T
Y
KM
G
E
E
I
IY
A
L
K
N
V
N
L
N
I
K
E
G
E
F
V
S
I
M
G
P
S
G
S
G
K
S
T
M
L
N
-
I
I
G
C
L
D
K
P
T
E
G
E
V
Y
I
D
N
I
K
T
N
D
L
------
D
------
D
D
ELTKIR
R
D
K
I
G
F
V
F
Q
Q
F
N
L
I
P
L
L
T
A
L
E
N
V
E
L
P
L
I
F
K
YRG
A
M
S
G
E
E
R
R
K
R
A
L
E
C
L
K
M
A
E
L
E
E
R
F
A
N
H
K
P
N
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
N
N
P
P
I
I
L
A
D
Q
P
T
W
A
L
D
S
K
T
G
E
K
I
M
Q
L
L
K
K
L
N
E
E
D
G
K
T
V
V
V
V
T
H
D
I
N
V
A
-
R
F
G
E
R
I
I
Y
L
K
D
G
E
V
E
R
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------