@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 : PA4456: (2016-02-27 )
MSTDSAYAVELKGLTFKRGSRAIFDNIDVRIPRGKVTGIMGPSGCGKTTLLRLIASQLRPSKGEVWVNGQNLPQLSRGDLFDMRKQFGVLFQSGALFTDLDVFENVAFPLRVHTQLPEEMIRDIVLMKLQAVGLRGAVELMPDELSGGMKRRVALARAIALDPQILLYDEPFVGQDPIAMGVLVRLIRLLNDALGITSIVVSHDLAETASIADYIYIVGDGRVLGHGTPDVLKETDDPRIRQFVKGIPDGPVPFHYPARDYRADLLGER
Atome Classification :
(43 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.......----------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MSTD
S
A
Y
A
V
E
LK
G
L
T
--FK-RG----SRAI--F--DNI
D
V
R
IPR
G
K
V
T
G
IMGPSGC
G
K
T
T
L
L
R
L
I
A
S
QLRPSKG
E
V
W
VNGQNLP-------QLSR----------G
D
---
L
F
D
M
R
-
K
-
Q
F
G
V
L
FQSGA
L
F
T
D
L
D
V
F
ENV-
A
F
-
P
L
----
R
V
---
H
TQ
L
P
E
E
M
I
R
D
I
V
L
M
K
L
Q
AVGL-R
G
A
V
-
E
LM
P
D
ELSG
G
M
K
R
R
V
A
L
A
R
AIALD
P
Q
I
L
L
Y
DEPFVGQD
P
-
I
A
M
G
V
L
V
R
L
-
I
R
L
L
N
D
A
L
G
I
T
S
I
V
V
SH
D
L
A
E
TASI
A
D
Y
I
Y
I
VGD
G
R
V
LGHG-
T
-
P
-
D
-
V
LKETD-
D
P
R
I
R
Q
F
V
K
GIPDGPVPFHYP
A
R
D
Y
R
A
D
LLGER----------------------------------------------------------------------------------------
25
PsiBlast_CBE
90.74
32%
-135
- C1 -
3TUI
1
METN_ECOLI
H:
[23-279]
------
H
M
I
K
L
S
N
I
T
KV
F
H
-
Q
G
----
T
R
T
I
QA
L
--
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
-------
T
L
S
E
----------
S
E
---
L
T
K
A
R
-
R
-
Q
I
G
M
I
F
Q
H
F
N
L
L
S
S
R
T
V
F
G
N
V
-
A
L
-
P
L
----
E
L
---
D
N
T
P
K
D
E
V
K
R
R
V
T
E
L
-
L
S
L
V
G
L
-
G
D
K
H
-
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
-
A
T
T
R
S
I
L
E
L
-
L
K
D
I
N
R
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
-
E
-
V
F
S
H
P
K
-
T
P
L
A
Q
K
F
I
Q
S
T
L
H
L
D
I
P
E
D
Y
Q
E
R
--------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
89.18
32%
-136
- C1 -
3TUZ
1
METN_ECOLI
H:
[23-279]
------
H
M
I
K
L
S
N
I
T
KV
F
H
-
Q
G
----
T
R
T
I
QA
L
--
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
-------
T
L
S
E
----------
S
E
---
L
T
K
A
R
-
R
-
Q
I
G
M
I
F
Q
H
F
N
L
L
S
S
R
T
V
F
G
N
V
-
A
L
-
P
L
----
E
L
---
D
N
T
P
K
D
E
V
K
R
R
V
T
E
L
-
L
S
L
V
G
L
-
G
D
K
H
-
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
-
A
T
T
R
S
I
L
E
L
-
L
K
D
I
N
R
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
-
E
-
V
F
S
H
P
K
-
T
P
L
A
Q
K
F
I
Q
S
T
L
H
L
D
I
P
E
D
Y
Q
E
R
--------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
88.91
32%
-132
- C1 -
3TUI
1
METN_ECOLI
C:
[23-279]
------
H
M
I
K
L
S
N
I
T
KV
F
H
-
Q
G
----
T
R
T
I
QA
L
--
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
-------
T
L
S
E
----------
S
E
---
L
T
K
A
R
-
R
-
Q
I
G
M
I
F
Q
H
F
N
L
L
S
S
R
T
V
F
G
N
V
-
A
L
-
P
L
----
E
L
---
D
N
T
P
K
D
E
V
K
R
R
V
T
E
L
-
L
S
L
V
G
L
-
G
D
K
H
-
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
-
A
T
T
R
S
I
L
E
L
-
L
K
D
I
N
R
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
-
E
-
V
F
S
H
P
K
-
T
P
L
A
Q
K
F
I
Q
S
T
L
H
L
D
I
P
E
D
Y
Q
E
R
--------------------------------------------------------------------------------------------------
27
PsiBlast_CBE
88.62
32%
-129
- C1 -
3TUI
1
METN_ECOLI
D:
[24-279]
-------
M
I
K
L
S
N
I
T
KV
F
H
-
Q
G
----
T
R
T
I
QA
L
--
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
-------
T
L
S
E
----------
S
E
---
L
T
K
A
R
-
R
-
Q
I
G
M
I
F
Q
H
F
N
L
L
S
S
R
T
V
F
G
N
V
-
A
L
-
P
L
----
E
L
---
D
N
T
P
K
D
E
V
K
R
R
V
T
E
L
-
L
S
L
V
G
L
-
G
D
K
H
-
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
-
A
T
T
R
S
I
L
E
L
-
L
K
D
I
N
R
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
-
E
-
V
F
S
H
P
K
-
T
P
L
A
Q
K
F
I
Q
S
T
L
H
L
D
I
P
E
D
Y
Q
E
R
--------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
88.51
32%
-136
- C1 -
3TUZ
1
METN_ECOLI
C:
[23-279]
------
H
M
I
K
L
S
N
I
T
KV
F
H
-
Q
G
----
T
R
T
I
QA
L
--
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
-------
T
L
S
E
----------
S
E
---
L
T
K
A
R
-
R
-
Q
I
G
M
I
F
Q
H
F
N
L
L
S
S
R
T
V
F
G
N
V
-
A
L
-
P
L
----
E
L
---
D
N
T
P
K
D
E
V
K
R
R
V
T
E
L
-
L
S
L
V
G
L
-
G
D
K
H
-
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
-
A
T
T
R
S
I
L
E
L
-
L
K
D
I
N
R
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
-
E
-
V
F
S
H
P
K
-
T
P
L
A
Q
K
F
I
Q
S
T
L
H
L
D
I
P
E
D
Y
Q
E
R
--------------------------------------------------------------------------------------------------
127
Fugue
88.02
34%
-118
- C1 -
1Z47
1
?
A:
[11-355]
----
G
S
M
T
I
E
F
V
G
V
E
--
K
I
Y
P
G
----
G
A
R
S
--
V
--
R
G
V
S
F
Q
I
R
E
G
E
M
V
G
L
L
G
P
S
G
S
G
K
T
T
I
L
R
L
I
A
G
L
E
R
P
T
K
G
D
V
W
I
G
G
K
R
V
T
-------
D
L
P
------------------
P
Q
K
-
R
-
N
V
G
L
V
F
Q
N
Y
A
L
F
Q
H
M
T
V
Y
D
N
V
-
S
F
-
G
L
----
R
E
---
K
-
R
V
P
K
D
E
M
D
A
R
V
R
E
L
L
R
F
M
R
L
-
E
S
Y
A
-
N
R
F
P
H
E
L
S
G
G
Q
Q
Q
R
V
A
L
A
R
A
L
A
P
R
P
Q
V
L
L
F
D
E
P
F
A
A
I
D
T
-
Q
I
R
R
E
L
R
T
F
-
V
R
Q
V
H
D
E
M
G
V
T
S
V
F
V
T
H
D
Q
E
E
A
L
E
V
A
D
R
V
L
V
L
H
E
G
N
V
E
Q
F
G
-
T
-
P
-
E
-
E
V
Y
E
---
K
P
G
-
T
L
F
V
A
S
F
I
G
E
S
N
V
W
T
R
A
V
Q
N
G
R
I
E
V
A
G
A
A
L
P
V
DPAVSEG
S
E
V
A
V
V
V
R
PKD
V
E
L
Q
P
A
S
EREAHAQVV
R
S
A
F
KGS
Y
S
A
C
W
I
R
T
KD
G
E
V
W
E
V
H
V
P
SADRHRWSPG
A
W
V
H
M
N
V
T
R
W
F
I
F
P
R
24
PsiBlast_CBE
87.73
32%
-131
- C1 -
3TUZ
1
METN_ECOLI
D:
[24-279]
-------
M
I
K
L
S
N
I
T
KV
F
H
-
Q
G
----
T
R
T
I
QA
L
--
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
-------
T
L
S
E
----------
S
E
---
L
T
K
A
R
-
R
-
Q
I
G
M
I
F
Q
H
F
N
L
L
S
S
R
T
V
F
G
N
V
-
A
L
-
P
L
----
E
L
---
D
N
T
P
K
D
E
V
K
R
R
V
T
E
L
-
L
S
L
V
G
L
-
G
D
K
H
-
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
-
A
T
T
R
S
I
L
E
L
-
L
K
D
I
N
R
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
-
E
-
V
F
S
H
P
K
-
T
P
L
A
Q
K
F
I
Q
S
T
L
H
L
D
I
P
E
D
Y
Q
E
R
--------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
87.54
32%
-128
- C1 -
3TUI
1
METN_ECOLI
G:
[24-279]
-------
M
I
K
L
S
N
I
T
KV
F
H
-
Q
G
----
T
R
T
I
QA
L
--
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
-------
T
L
S
E
----------
S
E
---
L
T
K
A
R
-
R
-
Q
I
G
M
I
F
Q
H
F
N
L
L
S
S
R
T
V
F
G
N
V
-
A
L
-
P
L
----
E
L
---
D
N
T
P
K
D
E
V
K
R
R
V
T
E
L
-
L
S
L
V
G
L
-
G
D
K
H
-
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
-
A
T
T
R
S
I
L
E
L
-
L
K
D
I
N
R
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
-
E
-
V
F
S
H
P
K
-
T
P
L
A
Q
K
F
I
Q
S
T
L
H
L
D
I
P
E
D
Y
Q
E
R
--------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
86.96
32%
-132
- C1 -
3TUZ
1
METN_ECOLI
G:
[24-279]
-------
M
I
K
L
S
N
I
T
KV
F
H
-
Q
G
----
T
R
T
I
QA
L
--
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
-------
T
L
S
E
----------
S
E
---
L
T
K
A
R
-
R
-
Q
I
G
M
I
F
Q
H
F
N
L
L
S
S
R
T
V
F
G
N
V
-
A
L
-
P
L
----
E
L
---
D
N
T
P
K
D
E
V
K
R
R
V
T
E
L
-
L
S
L
V
G
L
-
G
D
K
H
-
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
-
A
T
T
R
S
I
L
E
L
-
L
K
D
I
N
R
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
-
E
-
V
F
S
H
P
K
-
T
P
L
A
Q
K
F
I
Q
S
T
L
H
L
D
I
P
E
D
Y
Q
E
R
--------------------------------------------------------------------------------------------------
123
Fugue
86.74
29%
-126
- C1 -
3TUZ
3
METN_ECOLI
H:
[23-362]
------
H
M
I
K
L
S
N
I
T
--
K
V
-
F
H
QGTR
T
I
Q
A
--
L
--
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
-------
T
L
S
E
----------
S
E
---
L
T
K
A
R
-
R
-
Q
I
G
M
I
F
Q
H
F
N
L
L
S
S
R
T
V
F
G
N
V
-
A
L
-
P
L
----
E
L
---
D
-
N
T
P
K
D
E
V
K
R
R
V
T
E
L
L
S
L
V
G
L
-
G
D
K
H
-
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
-
A
T
T
R
S
I
L
E
L
-
L
K
D
I
N
R
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
T
V
-
S
-
E
-
V
F
S
H
P
K
-
T
P
L
A
Q
K
F
I
Q
S
T
L
H
L
D
I
P
E
D
Y
Q
E
R
L
Q
A
E
P
F
T
D
C
V
PMLRLEFTGQSVDAPLLSETARRFNVNNNIISAQMDYAGGVKFGIMLTEMHGTQQDTQAAIAWLQEHHVKVEV---------------
90
PsiBlast_CBE
84.63
31%
-120
- C1 -
1B0U
4
HISP_SALTY
A:
[5-255]
---
N
K
L
H
V
I
D
L
H
K
-----
R
-
Y
G
----
G
H
E
V
--
L
--
K
G
V
S
L
Q
A
R
A
G
D
V
I
S
I
I
G
S
S
G
S
G
K
S
T
F
L
R
C
I
N
F
L
E
K
P
S
E
G
A
I
I
V
N
G
Q
N
I
N
L
V
R
D
KDG
Q
L
K
V
----------
A
D
K
N
Q
L
R
L
L
R
-
T
-
R
L
T
M
V
F
Q
H
F
N
L
W
S
H
M
T
V
L
E
N
V
M
E
A
-
P
I
----
Q
V
----
L
G
L
S
K
H
D
A
R
E
R
A
L
K
Y
L
A
K
V
G
I
D
E
R
A
Q
-
G
K
Y
P
V
H
L
S
G
G
Q
Q
Q
R
V
S
I
A
R
A
L
A
M
E
P
D
V
L
L
F
D
E
P
T
S
A
L
D
P
-
E
L
V
G
E
V
L
R
I
-
M
Q
Q
L
A
E
E
-
G
K
T
M
V
V
V
T
H
E
M
G
F
A
R
H
V
S
S
H
V
I
F
L
H
Q
G
K
I
E
E
E
G
-
D
-
P
-
E
Q
V
F
G
N
P
Q
-
S
P
R
L
Q
Q
F
L
K
G
---------------------------------------------------------------------------------------------------------------
118
HHSearch
83.68
30%
-125
- C1 -
1B0U
4
HISP_SALTY
A:
[5-256]
------
N
K
L
H
V
I
D
L
H
--
K
R
-
Y
G
----
G
H
E
V
--
L
--
K
G
V
S
L
Q
A
R
A
G
D
V
I
S
I
I
G
S
S
G
S
G
K
S
T
F
L
R
C
I
N
F
L
E
K
P
S
E
G
A
I
I
V
N
G
Q
N
I
N
-------
L
V
R
D
KDGQLKVAD
K
N
Q
---
L
R
L
L
R
-
T
-
R
L
T
M
V
F
Q
H
F
N
L
W
S
H
M
T
V
L
E
N
V
-
M
E
-
A
P
----
I
Q
---
V
L
G
L
S
K
H
D
A
R
E
R
A
L
K
Y
L
A
K
V
G
I
-
D
E
R
A
Q
G
K
Y
P
V
H
L
S
G
G
Q
Q
Q
R
V
S
I
A
R
A
L
A
M
E
P
D
V
L
L
F
D
E
P
T
S
A
L
D
P
-
E
L
V
G
E
V
L
R
I
-
M
Q
Q
L
A
E
-
E
G
K
T
M
V
V
V
T
H
E
M
G
F
A
R
H
V
S
S
H
V
I
F
L
H
Q
G
K
I
E
E
E
G
-
D
-
P
-
E
-
Q
V
F
G
N
P
Q
S
P
R
L
Q
Q
F
L
K
G
S
--------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
82.95
32%
-124
- C1 -
3DHW
-
METN_ECOLI
C:
[2-256]
--------
I
K
L
S
N
I
T
KV
F
H
-
Q
G
----
T
R
T
I
QA
L
--
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
-------
T
L
S
E
----------
S
E
---
L
T
K
A
R
-
R
-
Q
I
G
M
I
F
Q
H
F
N
L
L
S
S
R
T
V
F
G
N
V
-
A
L
-
P
L
----
E
L
---
D
N
T
P
K
D
E
V
K
R
R
V
T
E
L
-
L
S
L
V
G
L
-
G
D
K
H
-
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
E
A
T
S
A
L
D
P
-
A
T
T
R
S
I
L
E
L
-
L
K
D
I
N
R
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
-
E
-
V
F
S
H
P
K
-
T
P
L
A
Q
K
F
I
Q
S
T
L
H
L
D
I
P
E
D
Y
Q
E
R
--------------------------------------------------------------------------------------------------
54
PsiBlast_CBE
82.34
32%
-132
- C1 -
4U02
1
?
B:
[5-241]
--------
I
R
I
R
N
L
H
--
K
W
-
F
G
----
P
L
H
V
--
L
--
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
Q
E
G
E
V
V
V
D
G
------------
L
S
V
----------
K
D
DRA
L
R
E
I
R
-
R
-
E
V
G
M
V
F
Q
Q
F
N
L
F
P
H
M
T
V
L
E
N
V
-
T
L
A
P
M
----
R
V
---
R
-
R
W
P
R
E
K
A
E
K
K
A
L
E
L
L
E
R
V
G
I
-
L
D
Q
A
-
R
K
Y
P
A
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
D
V
-
M
R
D
L
A
Q
G
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
A
D
R
V
V
F
M
D
G
G
Q
I
V
E
E
G
-
R
-
P
E
E
-
I
F
T
R
P
K
-
E
E
R
T
R
S
F
L
Q
R
V
--------------------------------------------------------------------------------------------------------------
55
PsiBlast_CBE
81.86
32%
-130
- C1 -
4U02
1
?
A:
[5-241]
--------
I
R
I
R
N
L
H
--
K
W
-
F
G
----
P
L
H
V
--
L
--
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
Q
E
G
E
V
V
V
D
G
------------
L
S
V
----------
K
D
DRA
L
R
E
I
R
-
R
-
E
V
G
M
V
F
Q
Q
F
N
L
F
P
H
M
T
V
L
E
N
V
-
T
L
A
P
M
----
R
V
---
R
-
R
W
P
R
E
K
A
E
K
K
A
L
E
L
L
E
R
V
G
I
-
L
D
Q
A
-
R
K
Y
P
A
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
D
V
-
M
R
D
L
A
Q
G
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
A
D
R
V
V
F
M
D
G
G
Q
I
V
E
E
G
-
R
-
P
E
E
-
I
F
T
R
P
K
-
E
E
R
T
R
S
F
L
Q
R
V
--------------------------------------------------------------------------------------------------------------
53
PsiBlast_CBE
81.77
32%
-130
- C1 -
4U02
1
?
C:
[5-241]
--------
I
R
I
R
N
L
H
--
K
W
-
F
G
----
P
L
H
V
--
L
--
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
Q
E
G
E
V
V
V
D
G
------------
L
S
V
----------
K
D
DRA
L
R
E
I
R
-
R
-
E
V
G
M
V
F
Q
Q
F
N
L
F
P
H
M
T
V
L
E
N
V
-
T
L
A
P
M
----
R
V
---
R
-
R
W
P
R
E
K
A
E
K
K
A
L
E
L
L
E
R
V
G
I
-
L
D
Q
A
-
R
K
Y
P
A
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
D
V
-
M
R
D
L
A
Q
G
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
A
D
R
V
V
F
M
D
G
G
Q
I
V
E
E
G
-
R
-
P
E
E
-
I
F
T
R
P
K
-
E
E
R
T
R
S
F
L
Q
R
V
--------------------------------------------------------------------------------------------------------------
62
PsiBlast_CBE
81.18
31%
-133
* C1 *
3PUZ
2
MALK_ECOLI
B:
[3-235]
-------
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
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
------------------------------------------------------------------------------------------
71
PsiBlast_CBE
80.23
31%
-133
- C1 -
3PUV
5
MALK_ECOLI
A:
[3-235]
-------
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
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
------------------------------------------------------------------------------------------
63
PsiBlast_CBE
80.21
31%
-130
- C1 -
3PUZ
2
MALK_ECOLI
A:
[3-235]
-------
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
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
------------------------------------------------------------------------------------------
56
PsiBlast_CBE
79.84
32%
-130
- C1 -
4U00
3
?
A:
[5-241]
--------
I
R
I
R
N
L
H
--
K
W
-
F
G
----
P
L
H
V
--
L
--
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
Q
E
G
E
V
V
V
D
G
------------
L
S
V
----------
K
D
DRA
L
R
E
I
R
-
R
-
E
V
G
M
V
F
Q
Q
F
N
L
F
P
H
M
T
V
L
E
N
V
-
T
L
A
P
M
----
R
V
---
R
-
R
W
P
R
E
K
A
E
K
K
A
L
E
L
L
E
R
V
G
I
-
L
D
Q
A
-
R
K
Y
P
A
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
D
V
-
M
R
D
L
A
Q
G
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
A
D
R
V
V
F
M
D
G
G
Q
I
V
E
E
G
-
R
-
P
E
E
-
I
F
T
R
P
K
-
E
E
R
T
R
S
F
L
Q
R
V
--------------------------------------------------------------------------------------------------------------
35
PsiBlast_CBE
77.45
31%
-133
- C1 -
3C4J
4
?
B:
[35-262]
---------------------
G
----
S
L
E
V
--
L
--
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
I
N
L
--------
K
A
K
D
----------
T
N
---
L
N
K
V
R
-
E
-
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
-
T
L
A
P
M
----
K
V
---
R
-
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
-
K
D
K
A
-
H
A
Y
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
S
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
G
Y
I
I
E
E
G
-
K
-
P
E
D
-
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
--------------------------------------------------------------------------------------------------------------
44
PsiBlast_CBE
77.30
31%
-133
- C1 -
2OLK
1
?
C:
[35-262]
---------------------
G
----
S
L
E
V
--
L
--
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
I
N
L
--------
K
A
K
D
----------
T
N
---
L
N
K
V
R
-
E
-
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
-
T
L
A
P
M
----
K
V
---
R
-
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
-
K
D
K
A
-
H
A
Y
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
S
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
G
Y
I
I
E
E
G
-
K
-
P
E
D
-
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
--------------------------------------------------------------------------------------------------------------
43
PsiBlast_CBE
76.84
31%
-127
- C1 -
2OLK
1
?
D:
[35-262]
---------------------
G
----
S
L
E
V
--
L
--
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
I
N
L
--------
K
A
K
D
----------
T
N
---
L
N
K
V
R
-
E
-
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
-
T
L
A
P
M
----
K
V
---
R
-
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
-
K
D
K
A
-
H
A
Y
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
S
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
G
Y
I
I
E
E
G
-
K
-
P
E
D
-
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
--------------------------------------------------------------------------------------------------------------
46
PsiBlast_CBE
76.74
31%
-129
- C1 -
2OLK
1
?
A:
[35-262]
---------------------
G
----
S
L
E
V
--
L
--
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
I
N
L
--------
K
A
K
D
----------
T
N
---
L
N
K
V
R
-
E
-
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
-
T
L
A
P
M
----
K
V
---
R
-
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
-
K
D
K
A
-
H
A
Y
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
S
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
G
Y
I
I
E
E
G
-
K
-
P
E
D
-
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
--------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
76.48
32%
-133
- C1 -
4YMU
2
?
J:
[12-239]
---------------------
G
----
S
L
E
V
--
L
--
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
T
K
G
E
V
F
I
D
G
V
K
I
N
-------
N
-
G
K
----------
V
N
---
I
N
K
V
R
-
Q
-
K
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
-
T
L
A
P
V
----
K
V
KKM
N
K
K
E
A
E
E
L
A
V
D
L
----
L
A
K
V
G
L
-
L
D
K
K
-
D
Q
Y
P
I
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
K
E
V
L
N
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
D
D
G
V
I
V
E
E
G
-
T
-
P
E
E
-
I
F
Y
R
A
K
-
N
E
R
T
R
E
F
L
S
K
I
--------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
75.71
31%
-125
- C1 -
2OLJ
4
?
A:
[35-262]
---------------------
G
----
S
L
E
V
--
L
--
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
I
N
L
--------
K
A
K
D
----------
T
N
---
L
N
K
V
R
-
E
-
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
-
T
L
A
P
M
----
K
V
---
R
-
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
-
K
D
K
A
-
H
A
Y
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
S
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
G
Y
I
I
E
E
G
-
K
-
P
E
D
-
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
--------------------------------------------------------------------------------------------------------------
34
PsiBlast_CBE
75.68
32%
-136
- C1 -
4YMU
2
?
A:
[12-239]
---------------------
G
----
S
L
E
V
--
L
--
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
T
K
G
E
V
F
I
D
G
V
K
I
N
-------
N
-
G
K
----------
V
N
---
I
N
K
V
R
-
Q
-
K
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
-
T
L
A
P
V
----
K
V
KKM
N
K
K
E
A
E
E
L
A
V
D
L
----
L
A
K
V
G
L
-
L
D
K
K
-
D
Q
Y
P
I
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
K
E
V
L
N
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
D
D
G
V
I
V
E
E
G
-
T
-
P
E
E
-
I
F
Y
R
A
K
-
N
E
R
T
R
E
F
L
S
K
I
--------------------------------------------------------------------------------------------------------------
48
PsiBlast_CBE
75.60
31%
-131
- C1 -
3C41
3
?
K:
[14-241]
---------------------
G
----
S
L
E
V
--
L
--
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
I
N
L
--------
K
A
K
D
----------
T
N
---
L
N
K
V
R
-
E
-
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
-
T
L
A
P
M
----
K
V
---
R
-
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
-
K
D
K
A
-
H
A
Y
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
S
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
G
Y
I
I
E
E
G
-
K
-
P
E
D
-
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
--------------------------------------------------------------------------------------------------------------
45
PsiBlast_CBE
75.57
31%
-123
- C1 -
2OLK
2
?
B:
[35-262]
---------------------
G
----
S
L
E
V
--
L
--
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
I
N
L
--------
K
A
K
D
----------
T
N
---
L
N
K
V
R
-
E
-
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
-
T
L
A
P
M
----
K
V
---
R
-
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
-
K
D
K
A
-
H
A
Y
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
S
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
G
Y
I
I
E
E
G
-
K
-
P
E
D
-
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
--------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
75.50
32%
-131
- C1 -
4YMV
1
?
J:
[12-239]
---------------------
G
----
S
L
E
V
--
L
--
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
T
K
G
E
V
F
I
D
G
V
K
I
N
-------
N
-
G
K
----------
V
N
---
I
N
K
V
R
-
Q
-
K
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
-
T
L
A
P
V
----
K
V
KKM
N
K
K
E
A
E
E
L
A
V
D
L
----
L
A
K
V
G
L
-
L
D
K
K
-
D
Q
Y
P
I
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
K
E
V
L
N
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
D
D
G
V
I
V
E
E
G
-
T
-
P
E
E
-
I
F
Y
R
A
K
-
N
E
R
T
R
E
F
L
S
K
I
--------------------------------------------------------------------------------------------------------------
47
PsiBlast_CBE
75.19
31%
-127
- C1 -
2OLJ
3
?
B:
[35-262]
---------------------
G
----
S
L
E
V
--
L
--
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
I
N
L
--------
K
A
K
D
----------
T
N
---
L
N
K
V
R
-
E
-
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
-
T
L
A
P
M
----
K
V
---
R
-
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
-
K
D
K
A
-
H
A
Y
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
S
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
G
Y
I
I
E
E
G
-
K
-
P
E
D
-
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
--------------------------------------------------------------------------------------------------------------
49
PsiBlast_CBE
75.06
31%
-130
- C1 -
3C41
3
?
J:
[14-241]
---------------------
G
----
S
L
E
V
--
L
--
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
I
N
L
--------
K
A
K
D
----------
T
N
---
L
N
K
V
R
-
E
-
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
-
T
L
A
P
M
----
K
V
---
R
-
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
-
K
D
K
A
-
H
A
Y
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
S
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
G
Y
I
I
E
E
G
-
K
-
P
E
D
-
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
--------------------------------------------------------------------------------------------------------------
36
PsiBlast_CBE
74.45
31%
-126
- C1 -
3C4J
3
?
A:
[35-262]
---------------------
G
----
S
L
E
V
--
L
--
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
I
N
L
--------
K
A
K
D
----------
T
N
---
L
N
K
V
R
-
E
-
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
-
T
L
A
P
M
----
K
V
---
R
-
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
-
K
D
K
A
-
H
A
Y
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
S
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
G
Y
I
I
E
E
G
-
K
-
P
E
D
-
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
--------------------------------------------------------------------------------------------------------------
38
PsiBlast_CBE
74.43
31%
-126
- C1 -
2Q0H
4
?
A:
[35-262]
---------------------
G
----
S
L
E
V
--
L
--
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
I
N
L
--------
K
A
K
D
----------
T
N
---
L
N
K
V
R
-
E
-
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
-
T
L
A
P
M
----
K
V
---
R
-
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
-
K
D
K
A
-
H
A
Y
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
S
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
G
Y
I
I
E
E
G
-
K
-
P
E
D
-
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
--------------------------------------------------------------------------------------------------------------
33
PsiBlast_CBE
73.49
32%
-129
- C1 -
4YMV
1
?
A:
[12-239]
---------------------
G
----
S
L
E
V
--
L
--
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
T
K
G
E
V
F
I
D
G
V
K
I
N
-------
N
-
G
K
----------
V
N
---
I
N
K
V
R
-
Q
-
K
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
-
T
L
A
P
V
----
K
V
KKM
N
K
K
E
A
E
E
L
A
V
D
L
----
L
A
K
V
G
L
-
L
D
K
K
-
D
Q
Y
P
I
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
K
E
V
L
N
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
D
D
G
V
I
V
E
E
G
-
T
-
P
E
E
-
I
F
Y
R
A
K
-
N
E
R
T
R
E
F
L
S
K
I
--------------------------------------------------------------------------------------------------------------
83
PsiBlast_CBE
71.25
33%
-109
- C1 -
3TIF
7
Y796_METJA
A:
[2-223]
--------
V
K
L
K
N
V
T
K
T
Y
K
-
M
G
----
E
E
I
I
--
Y
AL
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
E
---
L
T
K
I
R
-
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
IFKY
R
G
---
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
-------------------------------------------------------------------------------------------------------------------------------------------
37
PsiBlast_CBE
71.01
31%
-128
- C1 -
2Q0H
4
?
B:
[35-262]
---------------------
G
----
S
L
E
V
--
L
--
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
I
N
L
--------
K
A
K
D
----------
T
N
---
L
N
K
V
R
-
E
-
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
-
T
L
A
P
M
----
K
V
---
R
-
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
-
K
D
K
A
-
H
A
Y
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
-
E
M
V
G
E
V
L
S
V
-
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
G
Y
I
I
E
E
G
-
K
-
P
E
D
-
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
--------------------------------------------------------------------------------------------------------------
84
PsiBlast_CBE
69.91
33%
-112
- C1 -
1L2T
4
Y796_METJA
B:
[10-223]
--------------
T
--
Y
K
-
M
G
----
E
E
I
I
--
Y
AL
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
E
---
L
T
K
I
R
-
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
IFKY
R
G
---
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
G
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
-------------------------------------------------------------------------------------------------------------------------------------------
82
PsiBlast_CBE
69.77
33%
-115
- C1 -
3TIF
7
Y796_METJA
B:
[2-223]
--------
V
K
L
K
N
V
T
KT
Y
K
-
M
G
----
E
E
I
I
--
Y
AL
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
E
---
L
T
K
I
R
-
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
IFKY
R
G
---
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
-------------------------------------------------------------------------------------------------------------------------------------------
85
PsiBlast_CBE
69.54
33%
-109
- C1 -
1L2T
4
Y796_METJA
A:
[10-223]
--------------
T
--
Y
K
-
M
G
----
E
E
I
I
--
Y
AL
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
E
---
L
T
K
I
R
-
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
IFKY
R
G
---
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
G
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
-------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
69.31
32%
-137
- C1 -
1VCI
1
?
A:
[13-233]
--------
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
-----------------------------------------------------------------------------------------------------------------------------------
95
PsiBlast_CBE
68.18
34%
-138
- C1 -
3FVQ
3
FBPC_NEIG1
B:
[19-226]
-----------------------------
V
--
L
--
N
D
I
S
L
S
L
D
P
G
E
I
L
F
I
I
G
A
S
G
C
G
K
T
T
L
L
R
C
L
A
G
F
E
Q
P
D
S
G
E
I
S
L
S
G
K
T
I
---------
F
S
K
----------
N
T
---
N
L
P
V
R
E
R
-
R
L
G
Y
L
V
Q
E
G
V
L
F
P
H
L
T
V
Y
R
N
I
-
A
Y
-
G
L
----
G
N
---
G
K
G
R
T
A
Q
E
R
Q
R
I
E
A
M
-
L
E
L
T
G
I
-
S
E
L
A
-
G
R
Y
P
H
E
L
S
G
G
Q
Q
Q
R
A
A
L
A
R
A
L
A
P
D
P
E
L
I
L
L
D
E
P
F
S
A
L
D
E
Q
L
R
R
Q
I
R
E
D
M
-
I
A
A
L
R
-
A
N
G
K
S
A
V
F
V
S
H
D
R
E
E
A
L
Q
Y
A
D
R
I
A
V
M
K
Q
G
R
I
L
Q
T
A
-
S
-
P
-
H
-
E
L
------------------------------------------------------------------------------------------------------------------------------
96
PsiBlast_CBE
66.66
34%
-135
- C1 -
3FVQ
3
FBPC_NEIG1
A:
[19-231]
-----------------------------
V
--
L
--
N
D
I
S
L
S
L
D
P
G
E
I
L
F
I
I
G
A
S
G
C
G
K
T
T
L
L
R
C
L
A
G
F
E
Q
P
D
S
G
E
I
S
L
S
G
K
T
I
---------
F
S
K
----------
N
T
---
N
L
P
V
R
E
R
-
R
L
G
Y
L
V
Q
E
G
V
L
F
P
H
L
T
V
Y
R
N
I
-
A
Y
-
G
L
----
G
N
---
G
K
G
R
T
A
Q
E
R
Q
R
I
E
A
M
-
L
E
L
T
G
I
-
S
E
L
A
-
G
R
Y
P
H
E
L
S
G
G
Q
Q
Q
R
A
A
L
A
R
A
L
A
P
D
P
E
L
I
L
L
D
E
P
F
S
A
L
D
E
Q
L
R
R
Q
I
R
E
D
M
-
I
A
A
L
R
-
A
N
G
K
S
A
V
F
V
S
H
D
R
E
E
A
L
Q
Y
A
D
R
I
A
V
M
K
Q
G
R
I
L
Q
T
A
-
S
-
P
-
H
-
E
L
------------------------------------------------------------------------------------------------------------------------------