@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 : Lmo1761: (2016-03-28 )
MQENREEWGSKVGFILASAGSAIGIGAIWKLPYVAATAGGGAFFLLFLVLTLLVVMPLLIAEFVIGRGSGGDAVQAYKTLAPGTKWSLLGKLGVVGASILFSFYSVVGGWIITYLIKTLAGGIAGENQASLLHDFQVTTANPWISVGATILFILLNVIVISRGVVSGIEKMSKFMMPALFILFIVLIIRSLTLPGAMEGVAFFLRPDFSHFTAQTVLITLGQAFFSLSVGISVMVTYSSYLNRSTSLPQSAISVSLMNVFVSLLAGLAIFPAAFSFNITPDAGPGLLFVILPSIFNQMPFGMLFFIIFLILFLFAALTSSFSMLEATVAPLMNAGVNRKKASLWMGLVIVLMAIPSALSFGVWSDVQIFGLSIFDAADYLVSNIILPVGALFIAIFVGYRLPRELLLKEFTTSSHFGKKVFIVWLFLIKYIAPIAIILVFLSATGLIDFLF
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
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MQE
N
R
E
E
W
GSKV
G
F
I
L
ASAGS
A
I
G
I
G
A
I
WKL
P
Y
V
A
A
TAG
G
G
A
F
F
L
L
F
L
V
L
T
L
L
V
V
M
P
L
L
I
A
E
F
V
IGRGSG----G
D
A
V
Q
A
----
Y
K
TLAPGTK
W
S
L
L
GK
L
G
V
V
G
A
S
I
L
F
S
F
Y
S
V
V
G
G
W
I
I
T
Y
L
I
K
T
L
AGGIA------------GE
N
Q
A
S
L
L
H
D
F
Q
--------V--TTA--NP
W
I
---
S
V
G
--
A
T
I
L
F
I
L
---
L
N
V
I
V
I
S
R
G
V
V
S
G
I
E
K
M
S
K
F
M
M
P
A
L
F
I
L
F
I
V
L
I
I
R
S--LTLP----
G
--
A
ME
G
V
A
F
F
LRPDF
S
H
F
-
T
A
Q
T
V
-
L
I
-
T
L
G
Q
A
F
F
S
LSV
G
I
S
V
M
V
T
Y
S
S
YLNRSTSL
P
Q
S
A
I
S
V
S
L
M
N
V
F
V
S
L
L
A
G
--
L
A
I-FP
A
A
F
S
F
----NI------TPDAGP
G
---
L
L
F
V
I
L
P
S
I
FNQM
P
F
G
M
L
F
F
I
I
F
L
I
L
F
L
F
A
A
L
T
S
S
F
S
M
L
E
A
T
V
A
P
L
M
NA-GVN
R
K
K
A
S
L
-
W
M
G
L
V
-
I
V
L
M
A
I
P
S
A
L
S
FGVWS
D
V
Q
I
F
-
G
L
S
I
F
D
A
A
D
Y
L
V
S
N
I
I
L
P
V
G
A
L
F
I
A
I
F
V
GYRL
P
R
E
L
L
L
K
E
F-T-TSSHFGK
K
V
F
I
V
W
L
F
L
I
K
Y
I
A
P
I
A
I
I
L
V
F
L
S
A
T
G
L
I
D
FLF
67
Fugue
99.43
41%
-168
- C7 -
4US3
13
?
A:
[10-450]
---
G
R
E
Q
W
A
S
R
L
G
F
I
L
A
A
M
G
S
A
V
G
L
G
N
I
W
R
F
S
Y
V
T
G
E
N
G
G
A
A
F
L
L
V
Y
L
G
F
I
A
L
I
G
I
P
I
V
L
A
E
F
T
I
G
R
R
A
Q
----
S
D
A
V
G
S
----
F
E
K
L
A
P
G
K
P
W
K
V
A
G
L
M
G
V
A
A
G
F
L
I
L
S
F
Y
G
V
I
A
G
W
I
L
F
Y
L
F
N
Y
I
T
G
Q
L
W
------------
S
A
P
A
E
G
F
G
G
F
F
E
--------
G
--
F
I
A
--
N
P
T
L
---
P
L
F
--
W
Q
A
L
F
M
I
---
A
T
I
W
I
V
A
I
G
V
K
K
G
I
E
R
S
N
K
I
L
M
P
L
L
G
V
L
L
I
A
L
A
I
Y
S
--
L
T
L
G
----
G
--
A
K
E
G
L
A
F
L
F
S
P
D
W
S
A
L
K
D
P
G
V
Y
-
L
A
-
A
I
S
Q
A
F
F
T
L
S
L
G
M
G
A
L
I
T
Y
G
S
Y
V
S
K
D
S
R
L
P
G
A
A
V
S
V
A
G
L
D
T
A
F
A
I
I
A
G
--
I
M
I
-
F
P
A
V
F
A
L
----
G
L
------
S
P
S
G
G
P
G
---
L
V
F
V
V
L
P
D
I
F
D
S
I
R
L
G
P
I
V
G
I
A
F
F
I
L
L
G
A
A
A
L
S
S
A
V
S
L
L
E
V
P
V
A
Y
F
M
R
K
F
D
W
S
R
K
Q
A
A
I
-
T
L
G
V
I
-
I
T
L
L
G
I
P
S
S
L
S
F
G
V
L
G
E
V
T
I
I
P
G
L
N
I
F
D
S
V
D
F
I
A
S
S
V
F
L
P
L
G
G
M
I
I
A
L
F
I
G
W
G
W
K
T
S
D
A
L
A
E
S
D
L
-
T
D
S
V
W
G
K
L
----
W
I
L
S
L
R
F
I
A
P
I
A
I
L
I
V
F
L
S
A
F
-------
1
PsiBlast_PDB
99.17
41%
-170
- C7 -
4US3
13
?
A:
[10-449]
---
G
R
E
Q
W
A
S
R
L
G
F
I
L
A
A
M
G
S
A
V
G
L
G
N
I
W
R
F
S
Y
V
T
G
E
N
G
G
A
A
F
L
L
V
Y
L
G
F
I
A
L
I
G
I
P
I
V
L
A
E
F
T
I
G
R
R
A
Q
----
S
D
A
V
G
S
----
F
E
K
L
A
P
G
K
P
W
K
V
A
G
L
M
G
V
A
A
G
F
L
I
L
S
F
Y
G
V
I
A
G
W
I
L
F
Y
L
F
N
Y
I
T
G
Q
L
W
------------
S
A
P
A
E
G
F
G
G
F
F
E
--------
G
--
F
I
A
--
N
P
T
L
---
P
L
F
--
W
Q
A
L
F
M
I
---
A
T
I
W
I
V
A
I
G
V
K
K
G
I
E
R
S
N
K
I
L
M
P
L
L
G
V
L
L
I
A
L
A
I
Y
S
--
L
T
L
G
----
G
--
A
K
E
G
L
A
F
L
F
S
P
D
W
S
A
L
-
K
D
P
G
V
Y
L
A
-
A
I
S
Q
A
F
F
T
L
S
L
G
M
G
A
L
I
T
Y
G
S
Y
V
S
K
D
S
R
L
P
G
A
A
V
S
V
A
G
L
D
T
A
F
A
I
I
A
G
--
I
M
I
-
F
P
A
V
F
A
L
----
G
L
------
S
P
S
G
G
P
G
---
L
V
F
V
V
L
P
D
I
F
D
S
I
R
L
G
P
I
V
G
I
A
F
F
I
L
L
G
A
A
A
L
S
S
A
V
S
L
L
E
V
P
V
A
Y
F
M
R
K
F
D
W
S
R
K
Q
A
A
I
-
T
L
G
V
I
-
I
T
L
L
G
I
P
S
S
L
S
F
G
V
L
G
E
V
T
I
I
P
G
L
N
I
F
D
S
V
D
F
I
A
S
S
V
F
L
P
L
G
G
M
I
I
A
L
F
I
G
W
G
W
K
T
S
D
A
L
A
E
S
-
D
L
T
D
S
V
W
G
K
----
L
W
I
L
S
L
R
F
I
A
P
I
A
I
L
I
V
F
L
S
A
--------
2
PsiBlast_PDB
98.07
41%
-176
- C7 -
4US4
6
?
A:
[19-449]
------------
G
F
I
L
A
A
M
G
S
A
V
G
L
G
N
I
W
R
F
S
Y
V
T
G
E
N
G
G
A
A
F
L
L
V
Y
L
G
F
I
A
L
I
G
I
P
I
V
L
A
E
F
T
I
G
R
R
A
Q
----
S
D
A
V
G
S
----
F
E
K
L
A
P
G
K
P
W
K
V
A
G
L
M
G
V
A
A
G
F
L
I
L
S
F
Y
G
V
I
A
G
W
I
L
F
Y
L
F
N
Y
I
T
G
Q
L
W
------------
S
A
P
A
E
G
F
G
G
F
F
E
--------
G
--
F
I
A
--
N
P
T
L
---
P
L
F
--
W
Q
A
L
F
M
I
---
A
T
I
W
I
V
A
I
G
V
K
K
G
I
E
R
S
N
K
I
L
M
P
L
L
G
V
L
L
I
A
L
A
I
Y
S
--
L
T
L
G
----
G
--
A
K
E
G
L
A
F
L
F
S
P
D
W
S
A
L
-
K
D
P
G
V
Y
L
A
-
A
I
S
Q
A
F
F
T
L
S
L
G
M
G
A
L
I
T
Y
G
S
Y
V
S
K
D
S
R
L
P
G
A
A
V
S
V
A
G
L
D
T
A
F
A
I
I
A
G
--
I
M
I
-
F
P
A
V
F
A
L
----
G
L
------
S
P
S
G
G
P
G
---
L
V
F
V
V
L
P
D
I
F
D
S
I
R
L
G
P
I
V
G
I
A
F
F
I
L
L
G
A
A
A
L
S
S
A
V
S
L
L
E
V
P
V
A
Y
F
M
R
K
F
D
W
S
R
K
Q
A
A
I
-
T
L
G
V
I
-
I
T
L
L
G
I
P
S
S
L
S
F
G
V
L
G
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V
T
I
I
P
G
L
N
I
F
D
S
V
D
F
I
A
S
S
V
F
L
P
L
G
G
M
I
I
A
L
F
I
G
W
G
W
K
T
S
D
A
L
A
E
S
-
D
L
T
D
S
V
W
G
K
----
L
W
I
L
S
L
R
F
I
A
P
I
A
I
L
I
V
F
L
S
A
--------
58
HHSearch
88.08
26%
-158
- C7 -
2A65
9
?
A:
[5-468]
----
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
N
A
V
G
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
----
A
Q
G
H
G
T
T
P
A
I
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
I
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
E
P
PPTD
P
D
S
I
L
R
P
F
K
E
F
L
-
Y
S
Y
I
G
--------
V
PK
G
D
E
P
I
L
K
P
S
---
L
F
A
Y
I
V
F
L
I
T
M
F
---
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
--
F
L
L
E
TPNG
T
--
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
K
D
P
G
V
W
-
I
A
-
A
V
G
Q
I
F
F
T
L
S
L
G
F
G
A
I
I
T
Y
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
E
V
I
L
G
G
S
I
S
I
-
P
A
A
V
A
F
F
----
G
V
A
N
A
V
A
I
A
K
A
G
A
F
N
---
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
I
M
Q
P
M
I
A
F
L
E
D
E
-
L
K
L
S
R
K
H
A
V
L
W
T
A
A
I
V
F
F
S
A
H
L
V
M
F
L
N
---------
K
----
S
L
D
E
M
D
F
W
A
G
T
I
G
V
V
F
F
G
L
T
E
L
I
I
F
F
W
I
F
G
A
D
K
A
W
E
E
I
-
N
-
R
G
G
I
I
--
K
V
P
R
I
Y
Y
Y
V
M
R
Y
I
T
P
A
F
L
A
V
L
L
V
V
W
A
-------
42
PsiBlast_CBE
86.25
31%
-157
- C7 -
4MM9
3
?
A:
[5-395]
----
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
Y
A
V
D
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
A
Q
GH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
S
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
E
P
P----------
T
D
P
D
S
I
L
R
P
F
K
E
F
L
Y
S
Y
I
G
V
--
P
K
G
--
D
E
P
I
L
K
P
S
L
F
--
A
Y
I
V
F
L
I
T
M
F
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
F
L
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
S
L
G
L
G
F
G
V
L
I
T
F
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
S
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FGVA
N
A
------
V
A
I
A
K
A
G
A
F
N
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
G
M
Q
G
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
48
PsiBlast_CBE
86.13
31%
-152
- C7 -
4MM4
3
?
A:
[5-397]
----
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
Y
A
V
D
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
A
Q
GH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
S
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
E
P
P----------
T
D
P
D
S
I
L
R
P
F
K
E
F
L
Y
S
Y
I
G
V
--
P
K
G
--
D
E
P
I
L
K
P
S
L
F
--
A
Y
I
V
F
L
I
T
M
F
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
F
L
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
S
L
G
L
G
F
G
V
L
I
T
F
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
S
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FGVA
N
A
------
V
A
I
A
K
A
G
A
F
N
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
G
M
Q
G
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
47
PsiBlast_CBE
86.12
31%
-153
- C7 -
4MM4
4
?
B:
[5-395]
----
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
Y
A
V
D
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
AQGH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
S
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
EPP----------
T
D
P
D
S
I
L
R
P
F
K
EFLYSYIG
V
--
P
K
G
--
D
E
P
I
LKP
S
L
F
--
A
Y
I
V
F
L
I
TMF
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
FL
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
S
L
G
L
G
F
G
V
L
I
T
F
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
S
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FGVA
N
A
------
V
A
I
A
K
A
G
AFN
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
G
M
Q
G
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
45
PsiBlast_CBE
86.04
31%
-156
- C7 -
4MM6
3
?
A:
[5-390]
----
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
Y
A
V
D
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
A
Q
GH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
S
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
E
P
P----------
T
D
P
D
S
I
L
R
P
F
K
E
F
L
Y
S
Y
I
G
V
--
P
K
G
--
D
E
P
I
L
K
P
S
L
F
--
A
Y
I
V
F
L
I
T
M
F
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
F
L
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
S
L
G
L
G
F
G
V
L
I
T
F
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
S
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FGVA
N
A
------
V
A
I
A
K
A
G
A
F
N
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
G
M
Q
G
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
44
PsiBlast_CBE
86.03
31%
-155
- C7 -
4MM7
3
?
A:
[5-395]
----
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
Y
A
V
D
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
A
Q
GH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
S
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
E
P
P----------
T
D
P
D
S
I
L
R
P
F
K
E
F
L
Y
S
Y
I
G
V
--
P
K
G
--
D
E
P
I
L
K
P
S
L
F
--
A
Y
I
V
F
L
I
T
M
F
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
F
L
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
S
L
G
L
G
F
G
V
L
I
T
F
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
S
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FGVA
N
A
------
V
A
I
A
K
A
G
A
F
N
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
G
M
Q
G
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
46
PsiBlast_CBE
85.88
31%
-154
- C7 -
4MM5
3
?
A:
[5-397]
----
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
Y
A
V
D
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
A
Q
GH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
S
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
E
P
P----------
T
D
P
D
S
I
L
R
P
F
K
E
F
L
Y
S
Y
I
G
V
--
P
K
G
--
D
E
P
I
L
K
P
S
L
F
--
A
Y
I
V
F
L
I
T
M
F
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
F
L
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
S
L
G
L
G
F
G
V
L
I
T
F
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
S
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FGVA
N
A
------
V
A
I
A
K
A
G
A
F
N
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
G
M
Q
G
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
85.61
31%
-156
- C7 -
3GJC
5
?
B:
[3-396]
--
V
K
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
N
A
V
G
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
AQGH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
I
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
EPPPN-------
A
T
D
P
D
S
I
L
R
P
F
K
EFLYSYIG
V
--
P
K
G
--
D
E
P
I
LKP
S
L
F
--
A
Y
I
V
F
L
I
TMF
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
FL
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
T
L
S
L
G
F
G
A
I
I
T
Y
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
S
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FGVA
N
A
------
V
A
I
A
K
A
G
AFN
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
I
M
Q
P
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
43
PsiBlast_CBE
85.57
31%
-156
- C7 -
4MM8
3
?
A:
[5-396]
----
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
Y
A
V
D
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
A
Q
GH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
S
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
E
P
P----------
T
D
P
D
S
I
L
R
P
F
K
E
F
L
Y
S
Y
I
G
V
--
P
K
G
--
D
E
P
I
L
K
P
S
L
F
--
A
Y
I
V
F
L
I
T
M
F
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
F
L
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
S
L
G
L
G
F
G
V
L
I
T
F
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
S
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FGVA
N
A
------
V
A
I
A
K
A
G
A
F
N
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
G
M
Q
G
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
41
PsiBlast_CBE
85.42
31%
-157
- C7 -
4MMA
3
?
A:
[5-390]
----
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
Y
A
V
D
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
A
Q
GH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
S
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
E
P
P----------
T
D
P
D
S
I
L
R
P
F
K
E
F
L
Y
S
Y
I
G
V
--
P
K
G
--
D
E
P
I
L
K
P
S
L
F
--
A
Y
I
V
F
L
I
T
M
F
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
F
L
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
S
L
G
L
G
F
G
V
L
I
T
F
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
S
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FGVA
N
A
------
V
A
I
A
K
A
G
A
F
N
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
G
M
Q
G
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
85.07
31%
-157
- C7 -
3GJC
5
?
A:
[3-396]
--
V
K
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
N
A
V
G
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
A
Q
GH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
I
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
E
P
P
PN-------
A
T
D
P
D
S
I
L
R
P
F
K
E
F
L
Y
S
Y
I
G
V
--
P
K
G
--
D
E
P
I
L
K
P
S
L
F
--
A
Y
I
V
F
L
I
T
M
F
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
F
L
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
T
L
S
L
G
F
G
A
I
I
T
Y
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
S
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FGVA
N
A
------
V
A
I
A
K
A
G
A
F
N
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
I
M
Q
P
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
55
PsiBlast_CBE
84.91
31%
-154
- C7 -
3MPQ
8
?
A:
[1-399]
---
K
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
N
A
V
G
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
A
Q
GH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
I
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
EP------------
D
P
D
S
I
L
R
P
F
K
E
F
L
Y
S
Y
I
G
V
--
P
K
G
--
D
E
P
I
L
K
P
S
L
F
--
A
Y
I
V
F
L
I
T
M
F
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
C
L
A
V
F
L
V
I
R
V
F
L
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
T
L
S
L
G
F
G
A
I
I
T
Y
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
E
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FG
V
A
N
A
------
V
A
I
A
K
A
G
AFN
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
I
M
Q
P
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
54
PsiBlast_CBE
84.73
31%
-155
- C7 -
4FXZ
5
?
A:
[5-390]
----
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
N
A
V
G
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
A
Q
GH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
I
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
E
P
P----------
T
D
P
D
S
I
L
R
P
F
K
E
F
L
Y
S
Y
I
G
V
--
P
K
G
--
D
E
P
I
L
K
P
S
L
F
--
A
Y
I
V
F
L
I
T
M
F
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
F
L
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
A
T
L
S
L
G
F
G
A
I
I
T
Y
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
E
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FG
V
A
N
A
------
V
A
I
A
K
A
G
AFN
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
I
M
Q
P
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
31
PsiBlast_CBE
84.08
31%
-156
- C7 -
3USK
3
?
A:
[5-390]
----
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
N
A
V
G
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
A
Q
GH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
I
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
E
P
P----------
T
D
P
D
S
I
L
R
P
F
K
E
F
L
Y
S
Y
I
G
V
--
P
K
G
--
D
E
P
I
L
K
P
S
L
F
--
A
Y
I
V
F
L
I
T
M
F
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
F
L
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
T
L
S
L
G
F
G
A
I
I
T
Y
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
E
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FG
V
A
N
A
------
V
A
I
A
K
A
G
AFN
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
I
M
Q
P
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
29
PsiBlast_CBE
84.06
31%
-155
- C7 -
3USK
3
?
C:
[5-390]
----
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
N
A
V
G
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
AQGH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
I
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
EPP----------
T
D
P
D
S
I
L
R
P
F
K
EFLYSYIG
V
--
P
K
G
--
D
E
P
I
LKP
S
L
F
--
A
Y
I
V
F
L
I
TMF
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
FL
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
T
L
S
L
G
F
G
A
I
I
T
Y
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
E
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FGVA
N
A
------
V
A
I
A
K
A
G
AFN
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
I
M
Q
P
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
56
PsiBlast_CBE
83.98
31%
-154
* C7 *
4MMF
4
?
B:
[5-390]
----
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
Y
A
V
D
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
AQGH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
I
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
EPP----------
T
D
P
D
S
I
L
R
P
F
K
EFLYSYIG
V
--
P
K
G
--
D
E
P
I
LKP
S
L
F
--
A
Y
I
V
F
L
I
TMF
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
FL
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
S
L
G
L
G
F
G
A
I
I
T
Y
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
E
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FGVA
N
A
------
V
A
I
A
K
A
G
AFN
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
G
M
Q
P
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
83.98
31%
-154
- C7 -
3QS4
8
?
A:
[5-390]
----
R
E
H
W
A
T
R
L
G
L
I
L
A
M
A
G
N
A
V
G
L
G
N
F
L
R
F
P
V
Q
A
A
E
N
G
G
G
A
F
M
I
P
Y
I
I
A
F
L
L
V
G
I
P
L
M
W
I
E
W
A
M
G
R
Y
G
G
A
Q
GH
G
T
T
P
A
I
----
F
Y
L
L
W
R
N
R
F
A
K
I
L
G
V
F
G
L
W
I
P
L
V
V
A
I
Y
Y
V
Y
I
E
S
W
T
L
G
F
A
I
K
F
L
V
G
L
V
P
E
P
P----------
T
D
P
D
S
I
L
R
P
F
K
E
F
L
Y
S
Y
I
G
V
--
P
K
G
--
D
E
P
I
L
K
P
S
L
F
--
A
Y
I
V
F
L
I
T
M
F
I
N
V
S
I
L
I
R
G
I
S
K
G
I
E
R
F
A
K
I
A
M
P
T
L
F
I
L
A
V
F
L
V
I
R
V
F
L
L
E
T
P
----
N
GT
A
A
D
G
L
N
F
L
W
T
P
D
F
E
K
L
-
K
D
P
G
V
-
W
I
A
A
V
G
Q
I
F
F
T
L
S
L
G
V
G
A
I
I
T
Y
A
S
Y
V
R
K
D
Q
D
I
V
L
S
G
L
T
A
A
T
L
N
E
K
A
E
V
I
L
G
--
G
S
I
S
I
P
A
A
V
A
F
FGVA
N
A
------
V
A
I
A
K
A
G
A
F
N
L
G
F
I
T
L
P
A
I
F
S
Q
T
A
G
G
T
F
L
G
F
L
W
F
F
L
L
F
F
A
G
L
T
S
S
I
A
I
M
Q
P
M
I
A
F
L
E
D
E
L
K
L
S
R
K
H
A
V
L
-
W
T
A
A
I
-
V
F
F
S
A
-----------------------------------------------------------------------------------------------------