@TOME V2.3
(Nov 2016)
Ref.
-
-
Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
Core Structure Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
Core Structure Cluster
Contacts with Ligands
Show alignment :
Atome selection
All alignments
Only Template with Ligand
Column output:
Score:
Atome Rank Value
Tools Score
Hide column
Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
Hide column
Structural Clustering:
Cluster Num
3D-Jury Struct. Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
Hide column
Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
Hide column
Sequence & Result Tab:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : SA0508: (2016-03-16 )
MVQSLHEFLEENINYLKENGLYNEIDTIEGANGPEIKINGKSYINLSSNNYLGLATNEDLKSAAKAAIDTHGVGAGAVRTINGTLDLHDELEETLAKFKGTEAAIAYQSGFNCNMAAISAVMNKNDAILSDELNHASIIDGCRLSKAKIIRVNHSDMDDLRAKAKEAVESGQYNKVMYITDGVFSMDGDVAKLPEIVEIAEEFGLLTYVDDAHGSGVMGKGAGTVKHFGLQDKIDFQIGTLSKAIGVVGGYVAGTKELIDWLKAQSRPFLFSTSLAPGDTKAITEAVKKLMDSTELHDKLWDNAQYLKNGLSKLGYDTGESETPITPVIIGDEKTTQEFSKRLKDEGVYVKSIVFPTVPRGTGRVRNMPTAAHTKDMLDEAIAAYEKVGKEMKLI
Atome Classification :
(28 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...
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
M
V
Q
S
L
H
E
F
L
E
E
N
I
N
Y
L
---
K
ENGLYNEIDTIEGANG--
P
-------
E
I
K
--I-N----G
K
S
Y
I
N
L-SSN
N
Y
L
G
L
AT
N
E
D
L
K
S
A
A
K
A
A
IDTHGVGAG
A
V
R
TINGTL
D
L
H
D
E
L
E
E
T
L
A
KFKGT
E
A
A
I
A
YQSGFN
C
N
M
A
A
I
S
A
--
V
M--N--KNDAILSDELNH
A
S
I
IDGCRLS
K
A
K
I
I
R
VNHS
D
M
D
D
L
R
A
K
----
A
K
E
A
V
ESGQY
N
K
V
M
Y
I
TDGVFSMDG
D
V
A
K
L
P
E
I
V
E
I
A
E
EFG
L
L
T
Y
VDDAHGSGVMG-K-GAGTVKHFGLQ
D
-
K
I
D
F
QI
G
T
L
S
K
A
I
-
G
V-VGGYVA
G
T
K
E
L
I
D
W
L
K
AQSR
P
F
L
F
STSLAP---G
D
T
K
A
I
--
T
E
A
V
--------
K
K
L
M
--
D
S
--
T
E
L
H
D
K
LWD
N
A
Q
Y
L
K
N
G
L
S
KLGYDTG--ESETP
I
T
P
V
I
IGDE
K
T
T
Q
E
F
S
K
R-L-K-DEG
V
Y
V
K
S
I
VFPTVPRGTGRVRNMPT
A
A
H
T
K
D
M
L
D
E
A
I
A
A
Y
E
K
V
G
K
EMKLI
2
PsiBlast_PDB
97.54
41%
-67
- C1 -
1FC4
2
KBL_ECOLI
A:
[7-400]
------
E
F
Y
Q
Q
L
T
N
D
L
E
T
A
R
A
E
G
L
F
K
E
E
R
I
I
T
S
A
Q
Q
--
A
-------
D
I
T
--
V
A
D
----
G
S
H
V
I
N
F
-
C
A
N
N
Y
L
G
L
A
N
H
P
D
L
I
A
A
A
K
A
G
M
D
S
H
G
F
G
M
A
S
V
R
F
I
C
G
T
Q
D
S
H
K
E
L
E
Q
K
L
A
A
F
L
G
M
E
D
A
I
L
Y
S
S
C
F
D
A
N
G
G
L
F
E
T
--
L
L
--
G
--
A
E
D
A
I
I
S
D
A
L
N
H
A
S
I
I
D
G
V
R
L
C
K
A
K
R
Y
R
Y
A
N
N
D
M
Q
E
L
E
A
R
----
L
K
E
A
R
E
A
G
A
R
H
-
V
L
I
A
T
D
G
V
F
S
M
D
G
V
I
A
N
L
K
G
V
C
D
L
A
D
K
Y
D
A
L
V
M
V
D
D
S
H
A
V
G
F
V
G
-
E
N
G
R
G
S
H
E
Y
C
D
V
M
G
-
R
V
D
I
I
T
G
T
L
G
K
A
L
G
G
A
-
S
G
G
Y
T
A
A
R
K
E
V
V
E
W
L
R
Q
R
S
R
P
Y
L
F
S
N
S
L
A
P
---
A
I
V
A
A
S
--
I
K
V
L
--------
E
M
V
E
--
A
G
--
S
E
L
R
D
R
L
W
A
N
A
R
Q
F
R
E
Q
M
S
A
A
G
F
T
L
A
--
G
A
D
H
A
I
I
P
V
M
L
G
D
A
V
V
A
Q
K
F
A
R
E
-
L
-
Q
-
K
E
G
I
Y
V
T
G
F
F
Y
P
V
V
P
K
G
Q
A
R
I
R
T
Q
M
S
A
A
H
T
P
E
Q
I
T
R
A
V
E
A
F
T
R
I
G
K
Q
L
G
V
I
45
HHSearch
94.86
41%
-64
- C1 -
1FC4
2
KBL_ECOLI
A:
[11-400]
-------
Q
L
T
N
D
L
E
T
A
---
R
A
E
G
L
F
K
E
E
R
I
I
T
S
A
Q
Q
A-
D
-------
I
T
V
--
A
-
D
----
G
S
H
V
I
N
F
-
C
A
N
N
Y
L
G
L
A
N
H
P
D
L
I
A
A
A
K
A
G
M
D
S
H
G
F
G
M
A
S
V
R
F
I
C
G
T
Q
D
S
H
K
E
L
E
Q
K
L
A
A
F
L
G
M
E
D
A
I
L
Y
S
S
C
F
D
A
N
G
G
L
F
E
T
--
L
L
--
G
--
A
E
D
A
I
I
S
D
A
L
N
H
A
S
I
I
D
G
V
R
L
C
K
A
K
R
Y
R
Y
A
N
N
D
M
Q
E
L
E
A
R
----
L
K
E
A
R
E
-
A
G
A
R
H
V
L
I
A
T
D
G
V
F
S
M
D
G
V
I
A
N
L
K
G
V
C
D
L
A
D
K
Y
D
A
L
V
M
V
D
D
S
H
A
V
G
F
V
G
E
N
-
G
R
G
S
H
E
Y
C
D
V
M
G
-
R
V
D
I
I
T
G
T
L
G
K
A
L
-
G
G
A
S
G
G
Y
T
A
A
R
K
E
V
V
E
W
L
R
Q
R
S
R
P
Y
L
F
S
N
S
L
A
P
---
A
I
V
A
A
S
--
I
K
V
L
--------
E
M
V
E
--
A
G
--
S
E
L
R
D
R
L
W
A
N
A
R
Q
F
R
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Q
M
S
A
A
G
F
T
L
A
--
G
A
D
H
A
I
I
P
V
M
L
G
D
A
V
V
A
Q
K
F
A
R
E
-
L
-
Q
-
K
E
G
I
Y
V
T
G
F
F
Y
P
V
V
P
K
G
Q
A
R
I
R
T
Q
M
S
A
A
H
T
P
E
Q
I
T
R
A
V
E
A
F
T
R
I
G
K
Q
L
G
V
I
40
HHSearch
93.45
40%
-69
* C1 *
3TQX
2
?
A:
[5-399]
--
Q
E
I
L
S
Q
L
N
K
E
I
E
G
L
---
K
K
A
G
L
Y
K
S
E
R
I
I
T
S
P
Q
N
--
A
-------
E
I
K
--
V
-
G
----
E
K
E
V
L
N
F
-
C
A
N
N
Y
L
G
L
A
D
H
P
A
L
I
K
T
A
Q
T
V
V
E
Q
Y
G
F
G
M
A
S
V
R
F
I
C
G
T
Q
T
I
H
K
E
L
E
K
D
I
S
E
F
L
G
T
D
D
T
I
L
Y
S
S
C
F
D
A
N
G
G
L
F
E
T
--
L
L
--
G
--
P
E
D
A
I
I
S
D
E
L
N
H
A
S
I
I
D
G
I
R
L
C
K
A
Q
R
Y
R
Y
K
N
N
A
M
G
D
L
E
A
K
----
L
K
E
A
D
E
-
K
G
A
R
F
K
L
I
A
T
D
G
V
F
S
M
D
G
I
I
A
D
L
K
S
I
C
D
L
A
D
K
Y
N
A
L
V
M
V
D
D
S
H
A
V
G
F
I
G
E
N
-
G
R
G
T
P
E
Y
C
G
V
A
D
-
R
V
D
I
L
T
G
T
L
G
K
A
L
-
G
G
A
S
G
G
Y
T
S
G
H
K
E
I
I
E
W
L
R
N
R
S
R
P
Y
L
F
S
N
T
V
A
P
---
V
I
V
A
T
S
--
L
K
V
L
--------
E
L
L
K
--
T
E
G
-
P
Q
L
R
K
Q
L
Q
E
N
S
R
Y
F
R
A
G
M
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K
L
G
F
Q
L
V
--
P
G
N
H
P
I
I
P
V
M
L
G
D
A
Q
L
A
T
N
M
A
D
H
-
L
-
L
-
Q
E
G
I
Y
V
V
G
F
S
Y
P
V
V
P
M
G
K
A
R
I
R
V
Q
M
S
A
V
H
T
Q
Q
Q
L
D
R
A
I
E
A
F
G
Q
V
G
K
K
L
G
A
I
1
PsiBlast_PDB
92.18
42%
-64
- C1 -
3A2B
2
?
A:
[15-391]
------------
V
E
E
L
---
K
A
K
G
L
Y
A
Y
F
R
P
I
Q
S
K
Q
D
--
T
-------
E
V
K
--
I
-
D
----
G
R
R
V
L
M
F
-
G
S
N
S
Y
L
G
L
T
T
D
T
R
I
I
K
A
A
Q
D
A
L
E
K
Y
G
T
G
C
A
G
S
R
F
L
N
G
T
L
D
I
H
V
E
L
E
E
K
L
S
A
Y
V
G
K
E
A
A
I
L
F
S
T
G
F
Q
S
N
L
G
P
L
S
C
--
L
M
--
G
--
R
N
D
Y
I
L
L
D
E
R
D
H
A
S
I
I
D
G
S
R
L
S
F
S
K
V
I
K
Y
G
H
N
N
M
E
D
L
R
A
K
----
L
S
R
L
P
E
D
---
S
A
K
L
I
C
T
D
G
I
F
S
M
E
G
D
I
V
N
L
P
E
L
T
S
I
A
N
E
F
D
A
A
V
M
V
D
D
A
H
S
L
G
V
I
G
H
K
-
G
A
G
T
A
S
H
F
G
L
N
D
-
D
V
D
L
I
M
G
T
F
S
K
S
L
-
A
S
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L
G
G
F
V
A
G
D
A
D
V
I
D
F
L
K
H
N
A
R
S
V
M
F
S
A
S
M
T
P
---
A
S
V
A
S
T
--
L
K
A
L
--------
E
I
I
Q
--
N
E
--
P
E
H
I
E
K
L
W
K
N
T
D
Y
A
K
A
Q
L
L
D
H
G
F
D
L
G
--
A
T
E
S
P
I
L
P
I
F
I
R
S
N
E
K
T
F
W
V
T
K
M
-
L
-
Q
-
D
D
G
V
F
V
N
P
V
V
S
P
A
V
P
A
E
E
S
L
I
R
F
S
L
M
A
T
H
T
Y
D
Q
I
D
E
A
I
E
K
M
V
K
V
F
K
Q
----
41
HHSearch
91.14
42%
-64
- C1 -
3A2B
2
?
A:
[12-392]
---------
F
K
I
V
E
E
L
---
K
A
K
G
L
Y
A
Y
F
R
P
I
Q
S
K
Q
D
--
T
-------
E
V
K
--
I
-
D
----
G
R
R
V
L
M
F
-
G
S
N
S
Y
L
G
L
T
T
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T
R
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A
A
Q
D
A
L
E
K
Y
G
T
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C
A
G
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R
F
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T
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H
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E
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A
Y
V
G
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E
A
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I
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F
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T
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F
Q
S
N
L
G
P
L
S
C
--
L
M
--
G
--
R
N
D
Y
I
L
L
D
E
R
D
H
A
S
I
I
D
G
S
R
L
S
F
S
K
V
I
K
Y
G
H
N
N
M
E
D
L
R
A
K
----
L
S
R
L
P
---
E
D
S
A
K
L
I
C
T
D
G
I
F
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M
E
G
D
I
V
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L
P
E
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I
A
N
E
F
D
A
A
V
M
V
D
D
A
H
S
L
G
V
I
G
H
K
-
G
A
G
T
A
S
H
F
G
L
N
D
-
D
V
D
L
I
M
G
T
F
S
K
S
L
-
A
S
-
L
G
G
F
V
A
G
D
A
D
V
I
D
F
L
K
H
N
A
R
S
V
M
F
S
A
S
M
T
P
---
A
S
V
A
S
T
--
L
K
A
L
--------
E
I
I
Q
--
N
E
--
P
E
H
I
E
K
L
W
K
N
T
D
Y
A
K
A
Q
L
L
D
H
G
F
D
L
G
--
A
T
E
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P
I
L
P
I
F
I
R
S
N
E
K
T
F
W
V
T
K
M
-
L
-
Q
-
D
D
G
V
F
V
N
P
V
V
S
P
A
V
P
A
E
E
S
L
I
R
F
S
L
M
A
T
H
T
Y
D
Q
I
D
E
A
I
E
K
M
V
K
V
F
K
Q
A
---
3
PsiBlast_PDB
88.04
39%
-64
- C1 -
3TQX
2
?
A:
[5-399]
--
Q
E
I
L
S
Q
L
N
K
E
I
E
G
L
---
K
K
A
G
L
Y
K
S
E
R
I
I
T
S
P
Q
N
--
A
-------
E
I
K
--
V
-
G
----
E
K
E
V
L
N
F
-
C
A
N
N
Y
L
G
L
A
D
H
P
A
L
I
K
T
A
Q
T
V
V
E
Q
Y
G
F
G
M
A
S
V
R
F
I
C
G
T
Q
T
I
H
K
E
L
E
K
D
I
S
E
F
L
G
T
D
D
T
I
L
Y
S
S
C
F
D
A
N
G
G
L
F
E
T
--
L
L
--
G
--
P
E
D
A
I
I
S
D
E
L
N
H
A
S
I
I
D
G
I
R
L
C
K
A
Q
R
Y
R
Y
K
N
N
A
M
G
D
L
E
A
K
----
L
K
E
A
D
E
K
G
A
R
F
K
L
I
-
A
T
D
G
V
F
S
M
D
G
I
I
A
D
L
K
S
I
C
D
L
A
D
K
Y
N
A
L
V
M
V
D
D
S
H
A
V
G
F
I
G
-
E
N
G
R
G
T
P
E
Y
C
G
V
A
D
-
R
V
D
I
L
T
G
T
L
G
K
A
L
G
G
A
-
S
G
G
Y
T
S
G
H
K
E
I
I
E
W
L
R
N
R
S
R
P
Y
L
F
S
N
T
V
A
P
V
I
V
A
T
S
L
K
V
--
L
E
L
L
--------
K
--
T
--
E
G
--
P
Q
L
R
K
Q
L
Q
E
N
S
R
Y
F
R
A
G
M
E
K
L
G
F
Q
L
V
--
P
G
N
H
P
I
I
P
V
M
L
G
D
A
Q
L
A
T
N
M
A
D
H
-
L
-
L
-
Q
E
G
I
Y
V
V
G
F
S
Y
P
V
V
P
M
G
K
A
R
I
R
V
Q
M
S
A
V
H
T
Q
Q
Q
L
D
R
A
I
E
A
F
G
Q
V
G
K
K
L
G
A
I
32
Fugue
85.61
34%
-65
- C1 -
2BWN
4
HEM1_RHOCB
A:
[2-397]
---
D
Y
N
L
A
L
D
K
A
I
Q
K
L
---
H
D
E
G
R
Y
R
T
F
I
D
I
E
R
E
K
G
--
A
FP
K
A
Q
W
N
R
P
D
--
G
-
G
----
K
Q
D
I
T
V
W
-
C
G
N
D
Y
L
G
M
G
Q
H
P
V
V
L
A
A
M
H
E
A
L
E
A
V
G
A
G
S
G
G
T
R
N
I
S
G
T
T
A
Y
H
R
R
L
E
A
E
I
A
G
L
H
Q
K
E
A
A
L
V
F
S
S
A
Y
N
A
N
D
A
T
L
S
T
--
L
R
--
V
L
F
P
G
L
I
I
Y
S
D
S
L
N
H
A
S
M
I
E
G
I
K
R
N
A
G
P
K
R
I
F
R
H
N
D
V
A
H
L
R
E
L
----
I
A
A
D
D
P
A
---
A
P
K
L
I
A
F
E
S
V
Y
S
M
D
G
D
F
G
P
I
K
E
I
C
D
I
A
E
E
F
G
A
L
T
Y
I
D
E
V
H
A
V
G
M
Y
G
-
P
R
G
A
G
V
A
E
R
D
G
L
M
H
-
R
I
D
I
F
N
G
T
L
A
K
A
Y
-
G
V
-
F
G
G
Y
I
A
A
S
A
R
M
V
D
A
V
R
S
Y
A
P
G
F
I
F
S
T
S
L
P
P
---
A
I
A
A
G
A
--
Q
A
S
I
--------
A
F
L
K
T
A
E
G
--
Q
K
L
R
D
A
Q
Q
M
H
A
K
V
L
K
M
R
L
K
A
L
G
M
P
I
I
--
D
H
G
S
H
I
V
P
V
V
I
G
D
P
V
H
T
K
A
V
S
D
M
-
L
L
S
-
D
Y
G
V
Y
V
Q
P
I
N
F
P
T
V
P
R
G
T
E
R
L
R
F
T
P
S
P
V
H
D
L
K
Q
I
D
G
L
V
H
A
M
D
L
L
W
------
22
PsiBlast_CBE
85.02
35%
-60
- C1 -
2BWP
4
HEM1_RHOCB
E:
[7-394]
--------
L
D
K
A
I
Q
K
L
---
H
D
E
G
R
Y
R
T
F
I
D
I
E
R
E
K
G
AF
P
-------
K
A
Q
--
W
-
N
RPDG
G
K
Q
D
I
T
V
W
C
G
N
D
Y
L
G
M
G
Q
H
P
V
V
L
A
A
M
H
E
A
L
E
A
V
G
A
G
S
G
G
T
R
N
I
S
G
T
T
A
Y
H
R
R
L
E
A
E
I
A
G
L
H
Q
K
E
A
A
L
V
F
S
S
A
Y
N
A
N
D
A
T
L
S
T
LR
V
L
--
F
--
P
G
L
I
I
Y
S
D
S
L
N
H
A
S
M
I
E
G
I
K
R
N
A
G
P
K
R
I
F
R
H
N
D
V
A
H
L
R
E
L
----
I
--
A
A
D
D
P
A
A
P
K
L
I
A
F
-
E
S
V
Y
S
M
D
G
D
F
G
P
I
K
E
I
C
D
I
A
E
E
F
G
A
L
T
Y
I
D
E
V
H
A
V
G
M
Y
G
P
R
-
G
A
G
V
A
E
R
D
G
L
M
H
-
R
I
D
I
F
N
G
T
L
A
K
A
Y
-
G
V
-
F
G
G
Y
I
A
A
S
A
R
M
V
D
A
V
R
S
Y
A
P
G
F
I
F
S
T
S
L
P
P
---
A
I
A
A
G
A
--
Q
A
S
I
AFLKTAEG
Q
K
L
R
--
D
A
--
Q
Q
M
H
A
K
V
------
L
K
M
R
L
K
A
L
G
M
P
I
I
--
D
H
G
S
H
I
V
P
V
V
I
G
D
P
V
H
T
K
A
V
S
D
M
L
L
-
S
-
D
Y
G
V
Y
V
Q
P
I
N
F
P
T
V
P
R
G
T
E
R
L
R
F
T
P
S
P
V
H
D
L
K
Q
I
D
G
L
V
H
A
M
D
---------
14
PsiBlast_PDB
83.83
35%
-57
- C1 -
2BWO
4
HEM1_RHOCB
B:
[7-394]
--------
L
D
K
A
I
Q
K
L
---
H
D
E
G
R
Y
R
T
F
I
D
I
E
R
E
K
G
AF
P
-------
K
A
Q
--
W
-
N
RPDG
G
K
Q
D
I
T
V
W
C
G
N
D
Y
L
G
M
G
Q
H
P
V
V
L
A
A
M
H
E
A
L
E
A
V
G
A
G
S
G
G
T
R
N
I
S
G
T
T
A
Y
H
R
R
L
E
A
E
I
A
G
L
H
Q
K
E
A
A
L
V
F
S
S
A
Y
N
A
N
D
A
T
L
S
T
L
R
V
L
--
F
--
P
G
L
I
I
Y
S
D
S
L
N
H
A
S
M
I
E
G
I
K
R
N
A
G
P
K
R
I
F
R
H
N
D
V
A
H
L
R
E
L
----
I
--
A
A
D
D
P
A
A
P
K
L
I
A
F
-
E
S
V
Y
S
M
D
G
D
F
G
P
I
K
E
I
C
D
I
A
E
E
F
G
A
L
T
Y
I
D
E
V
H
A
V
G
M
Y
G
P
R
-
G
A
G
V
A
E
R
D
G
L
M
H
-
R
I
D
I
F
N
G
T
L
A
K
A
Y
-
G
V
-
F
G
G
Y
I
A
A
S
A
R
M
V
D
A
V
R
S
Y
A
P
G
F
I
F
S
T
S
L
P
P
---
A
I
A
A
G
A
--
Q
A
S
I
A
F
L
K
T
A
E
G
Q
K
L
R
--
D
A
--
Q
Q
M
H
A
K
V
------
L
K
M
R
L
K
A
L
G
M
P
I
I
--
D
H
G
S
H
I
V
P
V
V
I
G
D
P
V
H
T
K
A
V
S
D
M
L
L
-
S
-
D
Y
G
V
Y
V
Q
P
I
N
F
P
T
V
P
R
G
T
E
R
L
R
F
T
P
S
P
V
H
D
L
K
Q
I
D
G
L
V
H
A
M
D
---------
43
HHSearch
83.67
35%
-63
- C1 -
2BWN
4
HEM1_RHOCB
A:
[2-397]
---
D
Y
N
L
A
L
D
K
A
I
Q
K
L
---
H
D
E
G
R
Y
R
T
F
I
D
I
E
R
E
K
G
A-
F
P
K
A
----
Q
W
N
RP
D
-
G
----
G
K
Q
D
I
T
V
W
C
G
N
D
Y
L
G
M
G
Q
H
P
V
V
L
A
A
M
H
E
A
L
E
A
V
G
A
G
S
G
G
T
R
N
I
S
G
T
T
A
Y
H
R
R
L
E
A
E
I
A
G
L
H
Q
K
E
A
A
L
V
F
S
S
A
Y
N
A
N
D
A
T
L
S
T
--
L
R
V
L
F
--
P
G
L
I
I
Y
S
D
S
L
N
H
A
S
M
I
E
G
I
K
R
N
A
G
P
K
R
I
F
R
H
N
D
V
A
H
L
R
E
L
----
I
A
A
D
D
---
P
A
A
P
K
L
I
A
F
E
S
V
Y
S
M
D
G
D
F
G
P
I
K
E
I
C
D
I
A
E
E
F
G
A
L
T
Y
I
D
E
V
H
A
V
G
M
Y
G
P
R
-
G
A
G
V
A
E
R
D
G
L
M
H
-
R
I
D
I
F
N
G
T
L
A
K
A
Y
-
G
V
-
F
G
G
Y
I
A
A
S
A
R
M
V
D
A
V
R
S
Y
A
P
G
F
I
F
S
T
S
L
P
P
---
A
I
A
A
G
A
--
Q
A
S
I
--------
A
F
L
K
--
T
A
E
G
Q
K
L
R
D
A
Q
Q
M
H
A
K
V
L
K
M
R
L
K
A
L
G
M
P
I
I
--
D
H
G
S
H
I
V
P
V
V
I
G
D
P
V
H
T
K
A
V
S
D
M
-
L
-
L
S
D
Y
G
V
Y
V
Q
P
I
N
F
P
T
V
P
R
G
T
E
R
L
R
F
T
P
S
P
V
H
D
L
K
Q
I
D
G
L
V
H
A
M
D
L
L
W
------
23
PsiBlast_CBE
83.23
35%
-59
- C1 -
2BWP
4
HEM1_RHOCB
D:
[7-394]
--------
L
D
K
A
I
Q
K
L
---
H
D
E
G
R
Y
R
T
F
I
D
I
E
R
E
K
G
AF
P
-------
K
A
Q
--
W
-
N
RPDG
G
K
Q
D
I
T
V
W
C
G
N
D
Y
L
G
M
G
Q
H
P
V
V
L
A
A
M
H
E
A
L
E
A
V
G
A
G
S
G
G
T
R
N
I
S
G
T
T
A
Y
H
R
R
L
E
A
E
I
A
G
L
H
Q
K
E
A
A
L
V
F
S
S
A
Y
N
A
N
D
A
T
L
S
T
LR
V
L
--
F
--
P
G
L
I
I
Y
S
D
S
L
N
H
A
S
M
I
E
G
I
K
R
N
A
G
P
K
R
I
F
R
H
N
D
V
A
H
L
R
E
L
----
I
--
A
A
D
D
P
A
A
P
K
L
I
A
F
-
E
S
V
Y
S
M
D
G
D
F
G
P
I
K
E
I
C
D
I
A
E
E
F
G
A
L
T
Y
I
D
E
V
H
A
V
G
M
Y
G
P
R
-
G
A
G
V
A
E
R
D
G
L
M
H
-
R
I
D
I
F
N
G
T
L
A
K
A
Y
-
G
V
-
F
G
G
Y
I
A
A
S
A
R
M
V
D
A
V
R
S
Y
A
P
G
F
I
F
S
T
S
L
P
P
---
A
I
A
A
G
A
--
Q
A
S
I
AFLKTAEG
Q
K
L
R
--
D
A
--
Q
Q
M
H
A
K
V
------
L
K
M
R
L
K
A
L
G
M
P
I
I
--
D
H
G
S
H
I
V
P
V
V
I
G
D
P
V
H
T
K
A
V
S
D
M
L
L
-
S
-
D
Y
G
V
Y
V
Q
P
I
N
F
P
T
V
P
R
G
T
E
R
L
R
F
T
P
S
P
V
H
D
L
K
Q
I
D
G
L
V
H
A
M
D
---------
30
PsiBlast_CBE
83.12
35%
-63
- C1 -
2BWN
2
HEM1_RHOCB
B:
[7-394]
--------
L
D
K
A
I
Q
K
L
---
H
D
E
G
R
Y
R
T
F
I
D
I
E
R
E
K
G
AF
P
-------
K
A
Q
--
W
-
N
RPDG
G
K
Q
D
I
T
V
W
C
G
N
D
Y
L
G
M
G
Q
H
P
V
V
L
A
A
M
H
E
A
L
E
A
V
G
A
G
S
G
G
T
R
N
I
S
G
T
T
A
Y
H
R
R
L
E
A
E
I
A
G
L
H
Q
K
E
A
A
L
V
F
S
S
A
Y
N
A
N
D
A
T
L
S
T
L
R
V
L
--
F
--
P
G
L
I
I
Y
S
D
S
L
N
H
A
S
M
I
E
G
I
K
R
N
A
G
P
K
R
I
F
R
H
N
D
V
A
H
L
R
E
L
----
I
--
A
A
D
D
P
A
A
P
K
L
I
A
F
-
E
S
V
Y
S
M
D
G
D
F
G
P
I
K
E
I
C
D
I
A
E
E
F
G
A
L
T
Y
I
D
E
V
H
A
V
G
M
Y
G
P
R
-
G
A
G
V
A
E
R
D
G
L
M
H
-
R
I
D
I
F
N
G
T
L
A
K
A
Y
-
G
V
-
F
G
G
Y
I
A
A
S
A
R
M
V
D
A
V
R
S
Y
A
P
G
F
I
F
S
T
S
L
P
P
---
A
I
A
A
G
A
--
Q
A
S
I
A
F
L
K
T
A
E
G
Q
K
L
R
--
D
A
--
Q
Q
M
H
A
K
V
------
L
K
M
R
L
K
A
L
G
M
P
I
I
--
D
H
G
S
H
I
V
P
V
V
I
G
D
P
V
H
T
K
A
V
S
D
M
L
L
-
S
-
D
Y
G
V
Y
V
Q
P
I
N
F
P
T
V
P
R
G
T
E
R
L
R
F
T
P
S
P
V
H
D
L
K
Q
I
D
G
L
V
H
A
M
D
---------
25
PsiBlast_CBE
82.98
35%
-58
- C1 -
2BWO
5
HEM1_RHOCB
E:
[7-394]
--------
L
D
K
A
I
Q
K
L
---
H
D
E
G
R
Y
R
T
F
I
D
I
E
R
E
K
G
AF
P
-------
K
A
Q
--
W
-
N
RPDG
G
K
Q
D
I
T
V
W
C
G
N
D
Y
L
G
M
G
Q
H
P
V
V
L
A
A
M
H
E
A
L
E
A
V
G
A
G
S
G
G
T
R
N
I
S
G
T
T
A
Y
H
R
R
L
E
A
E
I
A
G
L
H
Q
K
E
A
A
L
V
F
S
S
A
Y
N
A
N
D
A
T
L
S
T
LR
V
L
--
F
--
P
G
L
I
I
Y
S
D
S
L
N
H
A
S
M
I
E
G
I
K
R
N
A
G
P
K
R
I
F
R
H
N
D
V
A
H
L
R
E
L
----
I
--
A
A
D
D
P
A
A
P
K
L
I
A
F
-
E
S
V
Y
S
M
D
G
D
F
G
P
I
K
E
I
C
D
I
A
E
E
F
G
A
L
T
Y
I
D
E
V
H
A
V
G
M
Y
G
P
R
-
G
A
G
V
A
E
R
D
G
L
M
H
-
R
I
D
I
F
N
G
T
L
A
K
A
Y
-
G
V
-
F
G
G
Y
I
A
A
S
A
R
M
V
D
A
V
R
S
Y
A
P
G
F
I
F
S
T
S
L
P
P
---
A
I
A
A
G
A
--
Q
A
S
I
AFLKTAEG
Q
K
L
R
--
D
A
--
Q
Q
M
H
A
K
V
------
L
K
M
R
L
K
A
L
G
M
P
I
I
--
D
H
G
S
H
I
V
P
V
V
I
G
D
P
V
H
T
K
A
V
S
D
M
L
L
-
S
-
D
Y
G
V
Y
V
Q
P
I
N
F
P
T
V
P
R
G
T
E
R
L
R
F
T
P
S
P
V
H
D
L
K
Q
I
D
G
L
V
H
A
M
D
---------
16
PsiBlast_PDB
82.50
35%
-60
- C1 -
2BWN
4
HEM1_RHOCB
A:
[7-394]
--------
L
D
K
A
I
Q
K
L
---
H
D
E
G
R
Y
R
T
F
I
D
I
E
R
E
K
G
AF
P
-------
K
A
Q
--
W
-
N
RPDG
G
K
Q
D
I
T
V
W
C
G
N
D
Y
L
G
M
G
Q
H
P
V
V
L
A
A
M
H
E
A
L
E
A
V
G
A
G
S
G
G
T
R
N
I
S
G
T
T
A
Y
H
R
R
L
E
A
E
I
A
G
L
H
Q
K
E
A
A
L
V
F
S
S
A
Y
N
A
N
D
A
T
L
S
T
L
R
V
L
--
F
--
P
G
L
I
I
Y
S
D
S
L
N
H
A
S
M
I
E
G
I
K
R
N
A
G
P
K
R
I
F
R
H
N
D
V
A
H
L
R
E
L
----
I
--
A
A
D
D
P
A
A
P
K
L
I
A
F
-
E
S
V
Y
S
M
D
G
D
F
G
P
I
K
E
I
C
D
I
A
E
E
F
G
A
L
T
Y
I
D
E
V
H
A
V
G
M
Y
G
P
R
-
G
A
G
V
A
E
R
D
G
L
M
H
-
R
I
D
I
F
N
G
T
L
A
K
A
Y
-
G
V
-
F
G
G
Y
I
A
A
S
A
R
M
V
D
A
V
R
S
Y
A
P
G
F
I
F
S
T
S
L
P
P
---
A
I
A
A
G
A
--
Q
A
S
I
A
F
L
K
T
A
E
G
Q
K
L
R
--
D
A
--
Q
Q
M
H
A
K
V
------
L
K
M
R
L
K
A
L
G
M
P
I
I
--
D
H
G
S
H
I
V
P
V
V
I
G
D
P
V
H
T
K
A
V
S
D
M
L
L
-
S
-
D
Y
G
V
Y
V
Q
P
I
N
F
P
T
V
P
R
G
T
E
R
L
R
F
T
P
S
P
V
H
D
L
K
Q
I
D
G
L
V
H
A
M
D
---------
28
PsiBlast_CBE
82.08
35%
-60
- C1 -
2BWN
5
HEM1_RHOCB
E:
[7-394]
--------
L
D
K
A
I
Q
K
L
---
H
D
E
G
R
Y
R
T
F
I
D
I
E
R
E
K
G
AF
P
-------
K
A
Q
--
W
-
N
RPDG
G
K
Q
D
I
T
V
W
C
G
N
D
Y
L
G
M
G
Q
H
P
V
V
L
A
A
M
H
E
A
L
E
A
V
G
A
G
S
G
G
T
R
N
I
S
G
T
T
A
Y
H
R
R
L
E
A
E
I
A
G
L
H
Q
K
E
A
A
L
V
F
S
S
A
Y
N
A
N
D
A
T
L
S
T
LR
V
L
--
F
--
P
G
L
I
I
Y
S
D
S
L
N
H
A
S
M
I
E
G
I
K
R
N
A
G
P
K
R
I
F
R
H
N
D
V
A
H
L
R
E
L
----
I
--
A
A
D
D
P
A
A
P
K
L
I
A
F
-
E
S
V
Y
S
M
D
G
D
F
G
P
I
K
E
I
C
D
I
A
E
E
F
G
A
L
T
Y
I
D
E
V
H
A
V
G
M
Y
G
P
R
-
G
A
G
V
A
E
R
D
G
L
M
H
-
R
I
D
I
F
N
G
T
L
A
K
A
Y
-
G
V
-
F
G
G
Y
I
A
A
S
A
R
M
V
D
A
V
R
S
Y
A
P
G
F
I
F
S
T
S
L
P
P
---
A
I
A
A
G
A
--
Q
A
S
I
AFLKTAEG
Q
K
L
R
--
D
A
--
Q
Q
M
H
A
K
V
------
L
K
M
R
L
K
A
L
G
M
P
I
I
--
D
H
G
S
H
I
V
P
V
V
I
G
D
P
V
H
T
K
A
V
S
D
M
L
L
-
S
-
D
Y
G
V
Y
V
Q
P
I
N
F
P
T
V
P
R
G
T
E
R
L
R
F
T
P
S
P
V
H
D
L
K
Q
I
D
G
L
V
H
A
M
D
---------
24
PsiBlast_CBE
81.97
35%
-58
- C1 -
2BWP
3
HEM1_RHOCB
B:
[7-394]
--------
L
D
K
A
I
Q
K
L
---
H
D
E
G
R
Y
R
T
F
I
D
I
E
R
E
K
G
AF
P
-------
K
A
Q
--
W
-
N
RPDG
G
K
Q
D
I
T
V
W
C
G
N
D
Y
L
G
M
G
Q
H
P
V
V
L
A
A
M
H
E
A
L
E
A
V
G
A
G
S
G
G
T
R
N
I
S
G
T
T
A
Y
H
R
R
L
E
A
E
I
A
G
L
H
Q
K
E
A
A
L
V
F
S
S
A
Y
N
A
N
D
A
T
L
S
T
LR
V
L
--
F
--
P
G
L
I
I
Y
S
D
S
L
N
H
A
S
M
I
E
G
I
K
R
N
A
G
P
K
R
I
F
R
H
N
D
V
A
H
L
R
E
L
----
I
--
A
A
D
D
P
A
A
P
K
L
I
A
F
-
E
S
V
Y
S
M
D
G
D
F
G
P
I
K
E
I
C
D
I
A
E
E
F
G
A
L
T
Y
I
D
E
V
H
A
V
G
M
Y
G
P
R
-
G
A
G
V
A
E
R
D
G
L
M
H
-
R
I
D
I
F
N
G
T
L
A
K
A
Y
-
G
V
-
F
G
G
Y
I
A
A
S
A
R
M
V
D
A
V
R
S
Y
A
P
G
F
I
F
S
T
S
L
P
P
---
A
I
A
A
G
A
--
Q
A
S
I
AFLKTAEG
Q
K
L
R
--
D
A
--
Q
Q
M
H
A
K
V
------
L
K
M
R
L
K
A
L
G
M
P
I
I
--
D
H
G
S
H
I
V
P
V
V
I
G
D
P
V
H
T
K
A
V
S
D
M
L
L
-
S
-
D
Y
G
V
Y
V
Q
P
I
N
F
P
T
V
P
R
G
T
E
R
L
R
F
T
P
S
P
V
H
D
L
K
Q
I
D
G
L
V
H
A
M
D
---------
27
PsiBlast_CBE
81.70
35%
-59
- C1 -
2BWO
4
HEM1_RHOCB
A:
[7-394]
--------
L
D
K
A
I
Q
K
L
---
H
D
E
G
R
Y
R
T
F
I
D
I
E
R
E
K
G
AF
P
-------
K
A
Q
--
W
-
N
RPDG
G
K
Q
D
I
T
V
W
C
G
N
D
Y
L
G
M
G
Q
H
P
V
V
L
A
A
M
H
E
A
L
E
A
V
G
A
G
S
G
G
T
R
N
I
S
G
T
T
A
Y
H
R
R
L
E
A
E
I
A
G
L
H
Q
K
E
A
A
L
V
F
S
S
A
Y
N
A
N
D
A
T
L
S
T
L
R
V
L
--
F
--
P
G
L
I
I
Y
S
D
S
L
N
H
A
S
M
I
E
G
I
K
R
N
A
G
P
K
R
I
F
R
H
N
D
V
A
H
L
R
E
L
----
I
--
A
A
D
D
P
A
A
P
K
L
I
A
F
-
E
S
V
Y
S
M
D
G
D
F
G
P
I
K
E
I
C
D
I
A
E
E
F
G
A
L
T
Y
I
D
E
V
H
A
V
G
M
Y
G
P
R
-
G
A
G
V
A
E
R
D
G
L
M
H
-
R
I
D
I
F
N
G
T
L
A
K
A
Y
-
G
V
-
F
G
G
Y
I
A
A
S
A
R
M
V
D
A
V
R
S
Y
A
P
G
F
I
F
S
T
S
L
P
P
---
A
I
A
A
G
A
--
Q
A
S
I
A
F
L
K
T
A
E
G
Q
K
L
R
--
D
A
--
Q
Q
M
H
A
K
V
------
L
K
M
R
L
K
A
L
G
M
P
I
I
--
D
H
G
S
H
I
V
P
V
V
I
G
D
P
V
H
T
K
A
V
S
D
M
L
L
-
S
-
D
Y
G
V
Y
V
Q
P
I
N
F
P
T
V
P
R
G
T
E
R
L
R
F
T
P
S
P
V
H
D
L
K
Q
I
D
G
L
V
H
A
M
D
---------
26
PsiBlast_CBE
81.59
35%
-56
- C1 -
2BWO
5
HEM1_RHOCB
D:
[7-394]
--------
L
D
K
A
I
Q
K
L
---
H
D
E
G
R
Y
R
T
F
I
D
I
E
R
E
K
G
AF
P
-------
K
A
Q
--
W
-
N
RPDG
G
K
Q
D
I
T
V
W
C
G
N
D
Y
L
G
M
G
Q
H
P
V
V
L
A
A
M
H
E
A
L
E
A
V
G
A
G
S
G
G
T
R
N
I
S
G
T
T
A
Y
H
R
R
L
E
A
E
I
A
G
L
H
Q
K
E
A
A
L
V
F
S
S
A
Y
N
A
N
D
A
T
L
S
T
LR
V
L
--
F
--
P
G
L
I
I
Y
S
D
S
L
N
H
A
S
M
I
E
G
I
K
R
N
A
G
P
K
R
I
F
R
H
N
D
V
A
H
L
R
E
L
----
I
--
A
A
D
D
P
A
A
P
K
L
I
A
F
-
E
S
V
Y
S
M
D
G
D
F
G
P
I
K
E
I
C
D
I
A
E
E
F
G
A
L
T
Y
I
D
E
V
H
A
V
G
M
Y
G
P
R
-
G
A
G
V
A
E
R
D
G
L
M
H
-
R
I
D
I
F
N
G
T
L
A
K
A
Y
-
G
V
-
F
G
G
Y
I
A
A
S
A
R
M
V
D
A
V
R
S
Y
A
P
G
F
I
F
S
T
S
L
P
P
---
A
I
A
A
G
A
--
Q
A
S
I
AFLKTAEG
Q
K
L
R
--
D
A
--
Q
Q
M
H
A
K
V
------
L
K
M
R
L
K
A
L
G
M
P
I
I
--
D
H
G
S
H
I
V
P
V
V
I
G
D
P
V
H
T
K
A
V
S
D
M
L
L
-
S
-
D
Y
G
V
Y
V
Q
P
I
N
F
P
T
V
P
R
G
T
E
R
L
R
F
T
P
S
P
V
H
D
L
K
Q
I
D
G
L
V
H
A
M
D
---------
29
PsiBlast_CBE
81.43
35%
-58
- C1 -
2BWN
3
HEM1_RHOCB
D:
[7-394]
--------
L
D
K
A
I
Q
K
L
---
H
D
E
G
R
Y
R
T
F
I
D
I
E
R
E
K
G
AF
P
-------
K
A
Q
--
W
-
N
RPDG
G
K
Q
D
I
T
V
W
C
G
N
D
Y
L
G
M
G
Q
H
P
V
V
L
A
A
M
H
E
A
L
E
A
V
G
A
G
S
G
G
T
R
N
I
S
G
T
T
A
Y
H
R
R
L
E
A
E
I
A
G
L
H
Q
K
E
A
A
L
V
F
S
S
A
Y
N
A
N
D
A
T
L
S
T
LR
V
L
--
F
--
P
G
L
I
I
Y
S
D
S
L
N
H
A
S
M
I
E
G
I
K
R
N
A
G
P
K
R
I
F
R
H
N
D
V
A
H
L
R
E
L
----
I
--
A
A
D
D
P
A
A
P
K
L
I
A
F
-
E
S
V
Y
S
M
D
G
D
F
G
P
I
K
E
I
C
D
I
A
E
E
F
G
A
L
T
Y
I
D
E
V
H
A
V
G
M
Y
G
P
R
-
G
A
G
V
A
E
R
D
G
L
M
H
-
R
I
D
I
F
N
G
T
L
A
K
A
Y
-
G
V
-
F
G
G
Y
I
A
A
S
A
R
M
V
D
A
V
R
S
Y
A
P
G
F
I
F
S
T
S
L
P
P
---
A
I
A
A
G
A
--
Q
A
S
I
AFLKTAEG
Q
K
L
R
--
D
A
--
Q
Q
M
H
A
K
V
------
L
K
M
R
L
K
A
L
G
M
P
I
I
--
D
H
G
S
H
I
V
P
V
V
I
G
D
P
V
H
T
K
A
V
S
D
M
L
L
-
S
-
D
Y
G
V
Y
V
Q
P
I
N
F
P
T
V
P
R
G
T
E
R
L
R
F
T
P
S
P
V
H
D
L
K
Q
I
D
G
L
V
H
A
M
D
---------
15
PsiBlast_PDB
80.43
35%
-58
- C1 -
2BWP
3
HEM1_RHOCB
A:
[7-394]
--------
L
D
K
A
I
Q
K
L
---
H
D
E
G
R
Y
R
T
F
I
D
I
E
R
E
K
G
AF
P
-------
K
A
Q
--
W
-
N
RPDG
G
K
Q
D
I
T
V
W
C
G
N
D
Y
L
G
M
G
Q
H
P
V
V
L
A
A
M
H
E
A
L
E
A
V
G
A
G
S
G
G
T
R
N
I
S
G
T
T
A
Y
H
R
R
L
E
A
E
I
A
G
L
H
Q
K
E
A
A
L
V
F
S
S
A
Y
N
A
N
D
A
T
L
S
T
L
R
V
L
--
F
--
P
G
L
I
I
Y
S
D
S
L
N
H
A
S
M
I
E
G
I
K
R
N
A
G
P
K
R
I
F
R
H
N
D
V
A
H
L
R
E
L
----
I
--
A
A
D
D
P
A
A
P
K
L
I
A
F
-
E
S
V
Y
S
M
D
G
D
F
G
P
I
K
E
I
C
D
I
A
E
E
F
G
A
L
T
Y
I
D
E
V
H
A
V
G
M
Y
G
P
R
-
G
A
G
V
A
E
R
D
G
L
M
H
-
R
I
D
I
F
N
G
T
L
A
K
A
Y
-
G
V
-
F
G
G
Y
I
A
A
S
A
R
M
V
D
A
V
R
S
Y
A
P
G
F
I
F
S
T
S
L
P
P
---
A
I
A
A
G
A
--
Q
A
S
I
A
F
L
K
T
A
E
G
Q
K
L
R
--
D
A
--
Q
Q
M
H
A
K
V
------
L
K
M
R
L
K
A
L
G
M
P
I
I
--
D
H
G
S
H
I
V
P
V
V
I
G
D
P
V
H
T
K
A
V
S
D
M
L
L
-
S
-
D
Y
G
V
Y
V
Q
P
I
N
F
P
T
V
P
R
G
T
E
R
L
R
F
T
P
S
P
V
H
D
L
K
Q
I
D
G
L
V
H
A
M
D
---------
7
PsiBlast_PDB
76.83
32%
-62
- C1 -
2XBN
1
?
A:
[58-418]
----------------------------------------------
E
A
V
--
I
-
R
----
G
K
D
T
I
L
L
-
G
T
Y
N
Y
M
G
M
T
F
D
P
D
V
I
A
A
G
K
E
A
L
E
K
F
G
S
G
T
N
G
S
R
M
L
N
G
T
F
H
D
H
M
E
V
E
Q
A
L
R
D
F
Y
G
T
T
G
A
I
V
F
S
T
G
Y
M
A
N
L
G
I
I
S
T
--
L
A
--
G
--
K
G
E
Y
V
I
L
D
A
D
S
H
A
S
I
Y
D
G
C
Q
Q
G
N
A
E
I
V
R
F
R
H
N
S
V
E
D
L
D
K
R
L
G
R
L
P
K
E
P
A
K
-------
L
V
V
L
E
G
V
Y
S
M
L
G
D
I
A
P
L
K
E
M
V
A
V
A
K
K
H
G
A
M
V
L
V
D
E
A
H
S
M
G
F
F
G
-
P
N
G
R
G
V
Y
E
A
Q
G
L
E
G
-
Q
I
D
F
V
V
G
T
F
S
K
S
V
-
G
T
-
V
G
G
F
V
V
S
N
H
P
K
F
E
A
V
R
L
A
C
R
P
Y
I
F
T
A
S
L
P
P
---
S
V
V
A
T
A
--
T
T
S
I
--------
R
K
L
M
--
T
A
--
H
E
K
R
E
R
L
W
S
N
A
R
A
L
H
G
G
L
K
A
M
G
F
R
L
G
TE
T
C
D
S
A
I
V
A
V
M
L
E
D
Q
E
Q
A
A
M
M
W
Q
A
-
L
-
L
-
D
G
G
L
Y
V
N
M
A
R
P
P
A
T
P
A
G
T
F
L
L
R
C
S
I
C
A
E
H
T
P
A
Q
I
Q
T
V
L
G
M
F
Q
A
A
G
R
A
V
G
V
I
12
PsiBlast_PDB
76.64
32%
-60
- C1 -
4BMK
6
?
A:
[80-440]
----------------------------------------------
E
A
V
--
I
-
R
----
G
K
D
T
I
L
L
-
G
T
Y
N
Y
M
G
M
T
F
D
P
D
V
I
A
A
G
K
E
A
L
E
K
F
G
S
G
T
N
G
S
R
M
L
N
G
T
F
H
D
H
M
E
V
E
Q
A
L
R
D
F
Y
G
T
T
G
A
I
V
F
S
T
G
Y
M
A
N
L
G
I
I
S
T
--
L
A
--
G
--
K
G
E
Y
V
I
L
D
A
D
S
H
A
S
I
Y
D
G
C
Q
Q
G
N
A
E
I
V
R
F
R
H
N
S
V
E
D
L
D
K
R
L
G
R
L
P
K
E
P
A
K
-------
L
V
V
L
E
G
V
Y
S
M
L
G
D
I
A
P
L
K
E
M
V
A
V
A
K
K
H
G
A
M
V
L
V
D
E
A
H
S
M
G
F
F
G
-
P
N
G
R
G
V
Y
E
A
Q
G
L
E
G
-
Q
I
D
F
V
V
G
T
F
S
A
S
V
-
G
T
-
V
G
G
F
V
V
S
N
H
P
K
F
E
A
V
R
L
A
C
R
P
Y
I
F
T
A
S
L
P
P
---
S
V
V
A
T
A
--
T
T
S
I
--------
R
K
L
M
--
T
A
--
H
E
K
R
E
R
L
W
S
N
A
R
A
L
H
G
G
L
K
A
M
G
F
R
L
G
TE
T
C
D
S
A
I
V
A
V
M
L
E
D
Q
E
Q
A
A
M
M
W
Q
A
-
L
-
L
-
D
G
G
L
Y
V
N
M
A
R
P
P
A
T
P
A
G
T
F
L
L
R
C
S
I
C
A
E
H
T
P
A
Q
I
Q
T
V
L
G
M
F
Q
A
A
G
R
A
V
G
V
I
6
PsiBlast_PDB
74.79
32%
-60
- C1 -
2W8J
1
?
A:
[58-418]
----------------------------------------------
E
A
V
--
I
-
R
----
G
K
D
T
I
L
L
-
G
T
Y
N
Y
M
G
M
T
F
D
P
D
V
I
A
A
G
K
E
A
L
E
K
F
G
S
G
T
N
G
S
R
M
L
N
G
T
F
H
D
H
M
E
V
E
Q
A
L
R
D
F
Y
G
T
T
G
A
I
V
F
S
T
G
Y
M
A
N
L
G
I
I
S
T
--
L
A
--
G
--
K
G
E
Y
V
I
L
D
A
D
S
H
A
S
I
Y
D
G
C
Q
Q
G
N
A
E
I
V
R
F
R
H
N
S
V
E
D
L
D
K
R
L
G
R
L
P
K
E
P
A
K
-------
L
V
V
L
E
G
V
Y
S
M
L
G
D
I
A
P
L
K
E
M
V
A
V
A
K
K
H
G
A
M
V
L
V
D
E
A
H
S
M
G
F
F
G
-
P
N
G
R
G
V
Y
E
A
Q
G
L
E
G
-
Q
I
D
F
V
V
G
T
F
S
K
S
V
-
G
T
-
V
G
G
F
V
V
S
N
H
P
K
F
E
A
V
R
L
A
C
R
P
Y
I
F
T
A
S
L
P
P
---
S
V
V
A
T
A
--
T
T
S
I
--------
R
K
L
M
--
T
A
--
H
E
K
R
E
R
L
W
S
N
A
R
A
L
H
G
G
L
K
A
M
G
F
R
L
G
TE
T
C
D
S
A
I
V
A
V
M
L
E
D
Q
E
Q
A
A
M
M
W
Q
A
-
L
-
L
-
D
G
G
L
Y
V
N
M
A
R
P
P
A
T
P
A
G
T
F
L
L
R
C
S
I
C
A
E
H
T
P
A
Q
I
Q
T
V
L
G
M
F
Q
A
A
G
R
A
V
G
V
I
21
PsiBlast_CBE
74.56
32%
-61
- C1 -
4BMK
4
?
B:
[80-438]
----------------------------------------------
E
A
V
--
I
-
R
----
G
K
D
T
I
L
L
-
G
T
Y
N
Y
M
G
M
T
F
D
P
D
V
I
A
A
G
K
E
A
L
E
K
F
G
S
G
T
N
G
S
R
M
L
N
G
T
F
H
D
H
M
E
V
E
Q
A
L
R
D
F
Y
G
T
T
G
A
I
V
F
S
T
G
Y
M
A
N
L
G
I
I
S
T
--
L
A
--
G
--
K
G
E
Y
V
I
L
D
A
D
S
H
A
S
I
Y
D
G
C
Q
Q
G
N
A
E
I
V
R
F
R
H
N
S
V
E
D
L
D
K
R
LGRL
P
K
E
P
A
K
-------
L
V
V
L
E
G
V
Y
S
M
L
G
D
I
A
P
L
K
E
M
V
A
V
A
K
K
H
G
A
M
V
L
V
D
E
A
H
S
M
G
F
F
G
-
P
N
G
R
G
V
Y
E
A
Q
G
L
E
G
-
Q
I
D
F
V
V
G
T
F
S
A
S
V
-
G
T
-
V
G
G
F
V
V
S
N
H
P
K
F
E
A
V
R
L
A
C
R
P
Y
I
F
T
A
S
L
P
P
---
S
V
V
A
T
A
--
T
T
S
I
--------
R
K
L
M
--
T
A
--
H
E
K
R
E
R
L
W
S
N
A
R
A
L
H
G
G
L
K
A
M
G
F
R
L
G
TE
T
C
D
S
A
I
V
A
V
M
L
E
D
Q
E
Q
A
A
M
M
W
Q
A
-
L
-
L
-
D
G
G
L
Y
V
N
M
A
----------
L
L
R
C
S
I
C
A
E
H
T
P
A
Q
I
Q
T
V
L
G
M
F
Q
A
A
G
R
A
V
G
--
8
PsiBlast_PDB
74.26
32%
-60
- C1 -
2W8W
1
?
A:
[58-418]
----------------------------------------------
E
A
V
--
I
-
R
----
G
K
D
T
I
L
L
-
G
T
Y
N
Y
M
G
M
T
F
D
P
D
V
I
A
A
G
K
E
A
L
E
K
F
G
S
G
T
Y
G
S
R
M
L
N
G
T
F
H
D
H
M
E
V
E
Q
A
L
R
D
F
Y
G
T
T
G
A
I
V
F
S
T
G
Y
M
A
N
L
G
I
I
S
T
--
L
A
--
G
--
K
G
E
Y
V
I
L
D
A
D
S
H
A
S
I
Y
D
G
C
Q
Q
G
N
A
E
I
V
R
F
R
H
N
S
V
E
D
L
D
K
R
L
G
R
L
P
K
E
P
A
K
-------
L
V
V
L
E
G
V
Y
S
M
L
G
D
I
A
P
L
K
E
M
V
A
V
A
K
K
H
G
A
M
V
L
V
D
E
A
H
S
M
G
F
F
G
-
P
N
G
R
G
V
Y
E
A
Q
G
L
E
G
-
Q
I
D
F
V
V
G
T
F
S
K
S
V
-
G
T
-
V
G
G
F
V
V
S
N
H
P
K
F
E
A
V
R
L
A
C
R
P
Y
I
F
T
A
S
L
P
P
---
S
V
V
A
T
A
--
T
T
S
I
--------
R
K
L
M
--
T
A
--
H
E
K
R
E
R
L
W
S
N
A
R
A
L
H
G
G
L
K
A
M
G
F
R
L
G
TE
T
C
D
S
A
I
V
A
V
M
L
E
D
Q
E
Q
A
A
M
M
W
Q
A
-
L
-
L
-
D
G
G
L
Y
V
N
M
A
R
P
P
A
T
P
A
G
T
F
L
L
R
C
S
I
C
A
E
H
T
P
A
Q
I
Q
T
V
L
G
M
F
Q
A
A
G
R
A
V
G
V
I
18
PsiBlast_PDB
69.05
34%
-59
- C1 -
2G6W
1
BIOF_ECOLI
A:
[39-377]
-----------------------------------------------------------
R
Q
Y
L
N
F
-
S
S
N
D
Y
L
G
L
S
H
H
P
Q
I
I
R
A
W
Q
Q
G
A
E
Q
F
G
I
G
S
G
G
S
G
H
V
S
G
Y
S
V
V
H
Q
A
L
E
E
E
L
A
E
W
L
G
Y
S
R
A
L
L
F
I
S
G
F
A
A
N
Q
A
V
I
A
A
--
M
M
--
A
--
K
E
D
R
I
A
A
D
R
L
S
H
A
S
L
L
E
A
A
S
L
S
P
S
Q
L
R
R
F
A
H
N
D
V
T
H
L
-
A
R
----
L
L
A
S
P
C
P
G
Q
Q
---
M
V
V
T
E
G
V
F
S
M
D
G
D
S
A
P
L
A
E
I
Q
Q
V
T
Q
Q
H
N
G
W
L
M
V
D
D
A
H
G
T
G
V
I
G
E
Q
-
G
R
G
S
C
---
W
L
Q
K
V
K
P
E
L
L
V
V
T
F
G
K
G
F
-
G
V
-
S
G
A
A
V
L
C
S
S
T
V
A
D
Y
L
L
Q
F
A
R
H
L
I
Y
S
T
S
M
P
P
---
A
Q
A
Q
A
L
R
A
S
L
A
V
--------
I
R
S
D
--
E
G
--
D
A
R
R
E
K
L
A
A
L
I
T
R
F
R
A
G
V
Q
D
L
P
F
T
L
A
--
D
S
C
S
A
I
Q
P
L
I
V
G
D
N
S
R
A
L
Q
L
A
E
K
-
L
-
R
-
Q
Q
G
C
W
V
T
A
I
R
P
P
T
V
P
A
G
T
A
R
L
R
L
T
L
T
A
A
H
E
M
Q
D
I
D
R
L
L
-------------
20
PsiBlast_PDB
67.28
32%
-54
- C1 -
1DJE
4
BIOF_ECOLI
A:
[18-377]
---------------------
D
A
L
R
R
R
Y
P
V
A
Q
G
A
-
G
--
R
-------
W
L
V
--
A
-
D
----
D
R
Q
Y
L
N
F
-
S
S
N
D
Y
L
G
L
S
H
H
P
Q
I
I
R
A
W
Q
Q
G
A
E
Q
F
G
I
G
S
G
G
S
G
H
V
S
G
Y
S
V
V
H
Q
A
L
E
E
E
L
A
E
W
L
G
Y
S
R
A
L
L
F
I
S
G
F
A
A
N
Q
A
V
I
A
A
--
M
M
--
A
--
K
E
D
R
I
A
A
D
R
L
S
H
A
S
L
L
E
A
A
S
L
S
P
S
Q
L
R
R
F
A
H
N
D
V
T
H
L
-
A
R
----
L
L
A
S
P
C
P
G
Q
Q
---
M
V
V
T
E
G
V
F
S
M
D
G
D
S
A
P
L
A
E
I
Q
Q
V
T
Q
Q
H
N
G
W
L
M
V
D
D
A
H
G
T
G
V
I
G
E
Q
-
G
R
G
S
C
---
W
L
Q
K
V
K
P
E
L
L
V
V
T
F
G
K
G
F
-
G
V
-
S
G
A
A
V
L
C
S
S
T
V
A
D
Y
L
L
Q
F
A
R
H
L
I
Y
S
T
S
M
P
P
---
A
Q
A
Q
A
L
R
A
S
L
A
V
--------
I
R
S
D
--
E
G
--
D
A
R
R
E
K
L
A
A
L
I
T
R
F
R
A
G
V
Q
D
L
P
F
T
L
A
--
D
S
C
S
A
I
Q
P
L
I
V
G
D
N
S
R
A
L
Q
L
A
E
K
-
L
-
R
-
Q
Q
G
C
W
V
T
G
I
R
P
P
T
V
P
A
G
I
A
R
L
R
L
T
L
T
A
A
H
E
M
Q
D
I
D
R
L
L
-------------
19
PsiBlast_PDB
65.30
32%
-50
- C1 -
1DJ9
4
BIOF_ECOLI
A:
[18-377]
---------------------
D
A
L
R
R
R
Y
P
V
A
Q
G
A
-
G
--
R
-------
W
L
V
--
A
-
D
----
D
R
Q
Y
L
N
F
-
S
S
N
D
Y
L
G
L
S
H
H
P
Q
I
I
R
A
W
Q
Q
G
A
E
Q
F
G
I
G
S
G
G
S
G
H
V
S
G
Y
S
V
V
H
Q
A
L
E
E
E
L
A
E
W
L
G
Y
S
R
A
L
L
F
I
S
G
F
A
A
N
Q
A
V
I
A
A
--
M
M
--
A
--
K
E
D
R
I
A
A
D
R
L
S
H
A
S
L
L
E
A
A
S
L
S
P
S
Q
L
R
R
F
A
H
N
D
V
T
H
L
-
A
R
----
L
L
A
S
P
C
P
G
Q
Q
---
M
V
V
T
E
G
V
F
S
M
D
G
D
S
A
P
L
A
E
I
Q
Q
V
T
Q
Q
H
N
G
W
L
M
V
D
D
A
H
G
T
G
V
I
G
E
Q
-
G
R
G
S
C
---
W
L
Q
K
V
K
P
E
L
L
V
V
T
F
G
K
G
F
-
G
V
-
S
G
A
A
V
L
C
S
S
T
V
A
D
Y
L
L
Q
F
A
R
H
L
I
Y
S
T
S
M
P
P
---
A
Q
A
Q
A
L
R
A
S
L
A
V
--------
I
R
S
D
--
E
G
--
D
A
R
R
E
K
L
A
A
L
I
T
R
F
R
A
G
V
Q
D
L
P
F
T
L
A
--
D
S
C
S
A
I
Q
P
L
I
V
G
D
N
S
R
A
L
Q
L
A
E
K
-
L
-
R
-
Q
Q
G
C
W
V
T
G
I
R
P
P
T
V
P
A
G
I
A
R
L
R
L
T
L
T
A
A
H
E
M
Q
D
I
D
R
L
L
-------------