@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 : Lmo0847: (2016-03-19 )
MKKFSRFILMMAIACVAAFIFTGNGLNAKAAEEIYLIGTDTTFAPFEFEKDGEHVGIDMDILKAIAKDQNFKYEIKAMGFNAAVQALEANQVDGVIAGMSITDERKQKFDFSDPYFDSGVVMGILKDNDEIKTYDDLKGKKVAVKTGTEGYAFAEKIKDKYDFDIVVFDDSAQMYDDVKTRNSVACFDDYPVLAYGVQTGNGLKIVTEKEKGNSYGFAVNKGKNQELLEKFNAGLVNIKASGEYEKILKNYLGKNAIKENTTEKGFMGIIKSSWPALLSGLWLTIRLAVVSLIIAFIIGITFGFMKVSNSKILRGIATVYVDIFRGTPLIVQAFFFYFGIPAALDFRMPVFLAGVIALSLNAGAYMVEIVRGGIQSVDKGQMEAARSLGLPHKKAMMKVVLPQAIRMMIPSFINQFVITLKDTSIMSAIGLVELTQSGKIIMARTFESTWTWLIIGIMYLIVITILTKISDRLERRLRND
Atome Classification :
(26 SA)
.........10---........20.....-----...30...--.....40.......-.-50-----.-.-..--.....60........70........80........90......-..100.......110.......120......-...-130..--.....140......--.150...-....160-.......170.......180........190....-...-200------.--.-...-...------.-----210---.-......220.......230.......240--.......250....--...260.......270.......280.......290.......300.......310.......320.......330.......340.......350.......360.....--..370.......380.......390.......400.......410.......420.......430.......440.......450.......460.......470.......480
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
M
K
K
F
S
R
F
I
L
M
M
---
A
I
A
C
V
A
A
F
I
FTGNGL-----NAKA
A
E
E
I
--
Y
L
I
GTDTTFAP
F
E
F-E-K------D-G-EH--VGI
D
M
D
I
L
K
A
I
AKDQN
F
K
Y
E
I
K
AM
G
F
N
A
A
V
Q
A
L
EANQVD
G
V
IA-GMSI
T
D
E
R
K
QKFDFSDPYFDS
G
V
--
V
M
G
I
LK-DND-EIKTY--DDLKG
K
K
V
A
V
KTGT--E
G
Y
A
F
A
E
-
K
IKDKYD-
F
D
I
V
V
FDDS
A
Q
M
Y
D
D
V
KT-RNS
V
A
CFDDY
P
V
L
A
Y
G
-VQT-G--------N--
G
-
L
K
I
-
V
T
E------K-----EKG---N-SY
G
F
A
VNKGK
N
Q
E
L
L
E
K
FNA
G
L
V
N
I
KASG--
E
Y
E
K
I
L
K
N
Y
LG
K
N
A
--IKENTTE
K
G
F
M
G
I
I
KSS
W
P
A
L
L
S
G
L
W
L
T
I
R
L
A
V
V
S
L
I
I
A
F
I
I
G
I
T
F
G
F
MKVS
N
S
K
I
L
R
G
I
A
T
V
Y
V
D
I
FRG
T
P
L
I
V
Q
A
F
F
F
Y
FGI
P
A
A
L
DFR
M
P
V
F
L
A
G
V
I
A
LSLNA
G
A
Y
M
V
--
E
I
V
R
G
G
I
Q
SVD
K
G
Q
M
E
A
A
R
SLGL
P
H
K
K
A
M
M
K
V
V
L
P
Q
A
I
R
M
M
I
P
S
F
I
N
Q
F
V
I
T
LKD
T
S
I
M
S
A
I
G
L
V
E
LTQS
G
K
I
I
M
A
R
TFES
T
W
T
W
L
I
I
G
I
M
Y
L
I
V
I
T
I
L
T
K
I
S
D
R
L
E
R
R
LRND
1
PsiBlast_PDB
77.02
58%
-74
- C4 -
4G4P
2
?
A:
[25-243]
--------------------------------------------
Y
T
I
G
T
D
L
T
F
A
P
F
E
F
-
Q
-
D
------
S
K
G
-
K
Y
--
I
G
I
D
V
D
L
L
D
A
I
A
K
D
Q
D
F
E
V
D
L
K
P
L
G
F
D
S
A
V
Q
A
I
Q
S
K
Q
I
D
G
M
I
A
-
G
M
S
I
T
D
E
R
K
K
S
F
D
F
S
D
P
Y
F
D
S
G
L
--
Q
L
A
V
K
K
-
G
N
D
-
K
I
K
S
Y
--
D
D
L
K
G
K
T
V
A
A
K
V
G
T
--
E
S
A
N
F
L
E
-
K
N
K
E
K
Y
D
-
Y
T
I
K
N
F
D
D
A
T
G
L
Y
K
A
L
E
N
-
G
E
A
D
A
I
V
D
D
Y
P
V
L
G
Y
A
-
V
K
N
-
G
--------
Q
--
K
-
L
Q
L
-
V
G
D
------
K
-----
E
T
G
---
S
-
S
Y
G
F
A
V
K
K
G
Q
N
P
E
L
I
K
K
F
N
A
G
L
K
N
L
K
D
N
G
--
T
Y
D
K
I
L
N
N
Y
L
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
69.64
40%
-77
- C4 -
4KPT
10
?
B:
[29-247]
-----------------------------------------
T
--
V
K
I
A
S
D
S
S
Y
A
P
F
E
F
-
Q
-
N
G-----
Q
-
K
-
K
W
--
V
G
I
D
V
D
I
M
Q
E
V
A
K
I
N
D
W
K
L
E
M
S
Y
P
G
F
D
A
A
L
Q
N
L
K
A
G
Q
V
D
G
I
I
A
-
G
M
T
I
T
D
E
R
K
E
T
F
D
F
S
N
P
Y
Y
T
S
A
L
--
T
I
A
T
T
K
-
D
S
--
K
L
S
D
Y
--
S
D
L
K
G
K
A
V
G
A
K
N
G
T
--
A
A
Q
T
W
L
Q
-
E
N
Q
K
K
Y
G
-
Y
T
I
K
T
Y
S
D
G
V
H
M
F
A
A
L
S
S
-
G
N
I
A
G
A
M
D
E
V
P
V
I
S
Y
A
-
M
K
Q
-
G
--------
Q
--
D
-
L
A
M
N
F
P
S
------
I
-----
S
L
P
---
G
-
G
Y
G
F
A
V
M
K
G
K
N
S
T
L
V
D
G
F
N
K
A
L
A
E
M
K
S
N
G
--
D
Y
D
K
I
L
K
K
Y
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
68.98
40%
-71
- C4 -
4KR5
7
?
B:
[3-232]
-----------------------------------
A
T
P
K
K
D
V
--
Y
T
I
A
S
D
N
S
F
A
P
F
E
F
-
Q
-
N
------
D
-
D
-
K
Q
F-
T
G
I
D
V
D
L
L
N
A
I
A
K
N
Q
G
F
K
L
K
W
N
F
I
G
F
Q
A
A
V
D
S
V
Q
S
G
H
A
D
G
M
M
S
-
G
M
S
I
T
D
A
R
K
Q
V
F
D
Y
G
S
P
Y
Y
S
S
N
L
--
T
I
A
T
S
S
-
T
D
D
-
S
I
K
S
W
--
K
D
L
K
G
K
T
L
G
A
K
N
G
T
--
A
S
F
D
Y
L
N
-
A
H
A
K
E
Y
G
-
Y
T
V
K
T
F
T
D
A
T
T
M
Y
S
S
L
N
N
-
G
S
I
N
A
L
M
D
D
E
P
V
I
K
Y
A
-
I
K
Q
-
G
--------
Q
--
K
-
F
A
T
-
P
I
K
------
P
-----
I
P
D
---
G
-
Q
Y
G
F
A
V
K
K
G
S
N
P
E
L
I
E
M
F
N
N
G
L
A
N
L
R
A
N
G
--
E
Y
D
K
I
I
D
K
Y
L
E
S
D
A
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
68.98
40%
-78
- C4 -
4LA9
7
?
A:
[29-250]
--------------------------------------
A
E
T
T
--
V
K
I
A
S
D
S
S
Y
A
P
F
E
F
-
Q
-
N
G-----
Q
-
K
-
K
W
--
V
G
I
D
V
D
I
M
Q
E
V
A
K
I
N
D
W
K
L
E
M
S
Y
P
G
F
D
A
A
L
Q
N
L
K
A
G
Q
V
D
G
I
I
A
-
G
M
T
I
T
D
E
R
K
E
T
F
D
F
S
N
P
Y
Y
T
S
A
L
--
T
I
A
T
T
K
-
D
S
--
K
L
S
D
Y
--
S
D
L
K
G
K
A
V
G
A
K
N
G
T
--
A
A
Q
T
W
L
Q
-
E
N
Q
K
K
Y
G
-
Y
T
I
K
T
Y
S
D
G
V
H
M
F
A
A
L
S
S
-
G
N
I
A
G
A
M
D
E
V
P
V
I
S
Y
A
-
M
K
Q
-
G
--------
Q
--
D
-
L
A
M
N
F
P
S
------
I
-----
S
L
P
---
G
-
G
Y
G
F
A
V
M
K
G
K
N
S
T
L
V
D
G
F
N
K
A
L
A
E
M
K
S
N
G
--
D
Y
D
K
I
L
K
K
Y
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
68.80
40%
-74
- C4 -
4KR5
6
?
A:
[3-229]
-----------------------------------
A
T
P
K
K
D
V
--
Y
T
I
A
S
D
N
S
F
A
P
F
E
F
-
Q
-
N
------
D
-
D
-
K
Q
F
-
T
G
I
D
V
D
L
L
N
A
I
A
K
N
Q
G
F
K
L
K
W
N
F
I
G
F
Q
A
A
V
D
S
V
Q
S
G
H
A
D
G
M
M
S
-
G
M
S
I
T
D
A
R
K
Q
V
F
D
Y
G
S
P
Y
Y
S
S
N
L
--
T
I
A
T
S
S
-
T
D
D
-
S
I
K
S
W
--
K
D
L
K
G
K
T
L
G
A
K
N
G
T
--
A
S
F
D
Y
L
N
-
A
H
A
K
E
Y
G
-
Y
T
V
K
T
F
T
D
A
T
T
M
Y
S
S
L
N
N
-
G
S
I
N
A
L
M
D
D
E
P
V
I
K
Y
A
-
I
K
Q
-
G
--------
Q
--
K
-
F
A
T
-
P
I
K
------
P
-----
I
P
D
---
G
-
Q
Y
G
F
A
V
K
K
G
S
N
P
E
L
I
E
M
F
N
N
G
L
A
N
L
R
A
N
G
--
E
Y
D
K
I
I
D
K
Y
L
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
68.65
40%
-80
- C4 -
4KPT
13
?
A:
[29-247]
-----------------------------------------
T
--
V
K
I
A
S
D
S
S
Y
A
P
F
E
F
-
Q
-
N
G-----
Q
-
K
-
K
W
--
V
G
I
D
V
D
I
M
Q
E
V
A
K
I
N
D
W
K
L
E
M
S
Y
P
G
F
D
A
A
L
Q
N
L
K
A
G
Q
V
D
G
I
I
A
-
G
M
T
I
T
D
E
R
K
E
T
F
D
F
S
N
P
Y
Y
T
S
A
L
--
T
I
A
T
T
K
-
D
S
--
K
L
S
D
Y
--
S
D
L
K
G
K
A
V
G
A
K
N
G
T
--
A
A
Q
T
W
L
Q
-
E
N
Q
K
K
Y
G
-
Y
T
I
K
T
Y
S
D
G
V
H
M
F
A
A
L
S
S
-
G
N
I
A
G
A
M
D
E
V
P
V
I
S
Y
A
-
M
K
Q
-
G
--------
Q
--
D
-
L
A
M
N
F
P
S
------
I
-----
S
L
P
---
G
-
G
Y
G
F
A
V
M
K
G
K
N
S
T
L
V
D
G
F
N
K
A
L
A
E
M
K
S
N
G
--
D
Y
D
K
I
L
K
K
Y
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
67.82
46%
-83
- C4 -
4OEN
7
?
A:
[5-222]
--------------------------------------------
Y
I
I
A
S
D
S
S
F
A
P
F
V
F
-
Q
-
N
------
S
-
S
N
Q
Y
--
T
G
I
D
M
E
L
I
K
A
I
A
K
D
Q
G
F
E
I
E
I
T
N
P
G
F
D
A
A
I
S
A
V
Q
A
G
Q
A
D
G
I
I
A
-
G
M
S
V
T
D
A
R
K
A
T
F
D
F
S
E
S
Y
Y
T
A
N
T
--
I
L
G
V
-
K
-
E
S
S
-
N
I
A
S
Y
--
E
D
L
K
G
K
T
V
G
V
K
N
G
T
--
A
S
Q
T
F
L
T
-
E
N
Q
S
K
Y
G
-
Y
K
I
K
T
F
A
D
G
S
S
M
Y
D
S
L
N
T
-
G
A
I
D
A
V
M
D
D
E
P
V
L
K
Y
S
-
I
S
Q
-
G
--------
Q
--
K
-
L
K
T
-
P
I
S
------
G
-----
T
P
I
---
G
-
E
T
A
F
A
V
K
K
G
A
N
P
E
L
I
E
M
F
N
N
G
L
A
N
L
K
A
N
G
--
E
F
Q
K
I
L
D
K
Y
L
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
67.51
46%
-79
- C4 -
4OEN
9
?
B:
[5-222]
--------------------------------------------
Y
I
I
A
S
D
S
S
F
A
P
F
V
F
-
Q
-
N
------
S
-
S
N
Q
Y
--
T
G
I
D
M
E
L
I
K
A
I
A
K
D
Q
G
F
E
I
E
I
T
N
P
G
F
D
A
A
I
S
A
V
Q
A
G
Q
A
D
G
I
I
A
-
G
M
S
V
T
D
A
R
K
A
T
F
D
F
S
E
S
Y
Y
T
A
N
T
--
I
L
G
V
-
K
-
E
S
S
-
N
I
A
S
Y
--
E
D
L
K
G
K
T
V
G
V
K
N
G
T
--
A
S
Q
T
F
L
T
-
E
N
Q
S
K
Y
G
-
Y
K
I
K
T
F
A
D
G
S
S
M
Y
D
S
L
N
T
-
G
A
I
D
A
V
M
D
D
E
P
V
L
K
Y
S
-
I
S
Q
-
G
--------
Q
--
K
-
L
K
T
-
P
I
S
------
G
-----
T
P
I
---
G
-
E
T
A
F
A
V
K
K
G
A
N
P
E
L
I
E
M
F
N
N
G
L
A
N
L
K
A
N
G
--
E
F
Q
K
I
L
D
K
Y
L
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
34
PsiBlast_CBE
65.73
35%
-75
- C4 -
4YMX
1
?
B:
[37-258]
------------------------------------------GV
I
V
M
G
T
S
A
D
F
P
P
F
E
F
-
H
-
K
VEGG--
K
-
D
-
E
I
--
V
G
F
D
I
D
I
A
N
A
I
A
K
K
L
G
V
K
L
E
I
K
D
M
D
F
K
G
L
I
P
A
L
Q
A
G
R
V
D
M
V
I
A
-
G
M
T
P
T
A
E
R
K
K
S
V
D
F
S
D
L
Y
Y
D
S
R
Q
--
V
V
-
V
V
K
-
N
D
S
-
P
I
S
K
F
--
D
D
L
K
V
K
T
I
A
V
Q
I
G
T
--
T
S
E
E
A
A
K
-
K
I
P
---
N
-
V
K
L
K
Q
L
N
R
V
S
D
E
F
M
D
L
Q
N
G
R
C
D
A
I
V
V
E
D
T
V
A
K
A
Y
--
L
K
E
-
Y
--------
K
--
D
-
M
K
I
-
L
Y
M
------
D
-----
E
I
N
NVE
N
-
G
S
A
V
A
V
A
K
G
-
N
K
S
L
L
D
V
V
N
E
V
I
K
E
L
K
Q
S
G
--
E
Y
D
K
L
V
D
K
W
F
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
65.69
35%
-77
- C4 -
4YMX
1
?
A:
[37-258]
------------------------------------------G
V
I
V
M
G
T
S
A
D
F
P
P
F
E
F
-
H
-
K
VEGG--
K
-
D
-
E
I
--
V
G
F
D
I
D
I
A
N
A
I
A
K
K
L
G
V
K
L
E
I
K
D
M
D
F
K
G
L
I
P
A
L
Q
A
G
R
V
D
M
V
I
A
-
G
M
T
P
T
A
E
R
K
K
S
V
D
F
S
D
L
Y
Y
D
S
R
Q
--
V
V
-
V
V
K
-
N
D
S
-
P
I
S
K
F
--
D
D
L
K
V
K
T
I
A
V
Q
I
G
T
--
T
S
E
E
A
A
K
-
K
I
P
---
N
-
V
K
L
K
Q
L
N
R
V
S
D
E
F
M
D
L
Q
N
G
R
C
D
A
I
V
V
E
D
T
V
A
K
A
Y
--
L
K
E
-
Y
--------
K
--
D
-
M
K
I
-
L
Y
M
------
D
-----
E
I
N
N
V
E
N
-
G
S
A
V
A
V
A
K
G
-
N
K
S
L
L
D
V
V
N
E
V
I
K
E
L
K
Q
S
G
--
E
Y
D
K
L
V
D
K
W
F
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
63.44
38%
-70
- C4 -
1GGG
-
GLNH_ECOLI
A:
[5-222]
--------------------------------------------
L
V
V
A
T
D
T
A
F
V
P
F
E
F
-
K
-
Q
------
G
-
D
-
L
Y
--
V
G
F
D
V
D
L
W
A
A
I
A
K
E
L
K
L
D
Y
E
L
K
P
M
D
F
S
G
I
I
P
A
L
Q
T
K
N
V
D
L
A
L
A
-
G
I
T
I
T
D
E
R
K
K
A
I
D
F
S
D
G
Y
Y
K
S
G
L
--
L
V
M
V
K
A
-
N
N
N
-
D
V
K
S
V
--
K
D
L
D
G
K
V
V
A
V
K
S
G
T
--
G
S
V
D
Y
A
K
A
N
I
K
T
K
----
D
L
R
Q
F
P
N
I
D
N
A
Y
M
E
L
G
T
-
N
R
A
D
A
V
L
H
D
T
P
N
I
L
Y
F
-
I
K
T
A
G
--------
N
--
G
Q
F
K
A
-
V
G
D
------
S
-----
L
E
A
---
Q
-
Q
Y
G
I
A
F
P
K
G
S
D
-
E
L
R
D
K
V
N
G
A
L
K
T
L
R
E
N
G
--
T
Y
N
E
I
Y
K
K
W
F
G
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
61
HHSearch
61.98
34%
-65
- C4 -
2PVU
4
?
A:
[38-266]
------------------------------------
G
A
T
K
K
K
--
V
V
V
G
T
D
A
A
F
A
P
F
E
Y
-
M
-
Q
------
K
-
G
-
K
I
--
V
G
F
D
V
D
L
L
D
A
V
M
K
A
A
G
L
D
Y
E
L
K
N
I
G
W
D
P
L
F
A
S
L
Q
S
K
E
V
D
M
G
I
S
-
G
I
T
I
T
D
E
R
K
Q
S
Y
D
F
S
D
P
Y
F
E
A
T
Q
--
V
I
L
V
K
Q
-
G
S
--
P
V
K
N
A
--
L
D
L
K
G
K
T
I
G
V
Q
N
A
T
--
T
G
Q
E
A
A
E
-
K
L
F
G
-
K
G
-
P
H
I
K
K
F
E
T
T
V
V
A
I
M
E
L
L
N
-
G
G
V
D
A
V
I
T
D
N
A
V
A
N
E
Y
-
V
K
N
-
N
--------
P
NK
K
-
L
Q
V
-
I
E
D
------
P
KN---
F
A
S
---
E
-
Y
Y
G
M
I
F
P
K
--
N
S
E
L
K
A
K
V
D
E
A
L
K
N
V
I
N
S
G
--
K
Y
T
E
I
Y
K
K
W
F
G
K
E
P
--
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
61.97
38%
-65
- C4 -
1WDN
1
GLNH_ECOLI
A:
[4-222]
-----------------------------------------
K
--
L
V
V
A
T
D
T
A
F
V
P
F
E
F
-
K
-
Q
------
G
-
D
-
L
Y
--
V
G
F
D
V
D
L
W
A
A
I
A
K
E
L
K
L
D
Y
E
L
K
P
M
D
F
S
G
I
I
P
A
L
Q
T
K
N
V
D
L
A
L
A
-
G
I
T
I
T
D
E
R
K
K
A
I
D
F
S
D
G
Y
Y
K
S
G
L
--
L
V
M
V
K
A
-
N
N
N
-
D
V
K
S
V
--
K
D
L
D
G
K
V
V
A
V
K
S
G
T
--
G
S
V
D
Y
A
K
A
N
I
K
T
K
----
D
L
R
Q
F
P
N
I
D
N
A
Y
M
E
L
G
T
-
N
R
A
D
A
V
L
H
D
T
P
N
I
L
Y
F
-
I
K
T
A
G
--------
N
--
G
Q
F
K
A
-
V
G
D
------
S
-----
L
E
A
---
Q
-
Q
Y
G
I
A
F
P
K
G
S
D
-
E
L
R
D
K
V
N
G
A
L
K
T
L
R
E
N
G
--
T
Y
N
E
I
Y
K
K
W
F
G
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
61.87
35%
-64
- C4 -
4PSH
1
?
A:
[12-226]
---------------------------------------------
L
V
G
L
S
A
D
F
P
P
F
E
F
V
D
-
E
------
N
-
G
-
N
I
--
V
G
F
D
V
D
L
A
K
E
I
A
R
R
L
G
V
E
L
K
I
V
D
M
T
F
D
G
L
I
P
S
L
L
T
K
K
I
D
V
I
I
S
-
G
M
T
I
T
E
E
R
K
K
V
V
A
F
S
D
P
Y
F
D
A
G
Q
--
V
I
V
V
R
K
-
D
S
D
F
R
P
K
T
Y
--
E
D
L
V
G
K
T
V
A
V
Q
I
G
T
--
T
G
D
I
E
V
S
-----
K
Y
D
G
I
K
V
V
R
F
D
K
F
T
D
A
F
L
E
L
K
R
-
G
R
A
D
A
V
V
L
D
S
A
T
A
R
A
F
-
V
A
K
-
N
--------
P
--
D
-
L
V
I
-
S
S
G
------
V
-----
L
S
S
---
E
-
Q
Y
G
I
A
V
R
K
-
E
D
T
D
L
L
E
F
I
N
S
V
L
R
E
L
K
K
S
---
P
Y
D
V
L
I
E
K
W
F
S
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
75
Fugue
61.51
19%
-78
- C1 -
4OPU
3
?
A:
[2-453]
M
K
E
L
K
Y
D
V
L
I
I
G
GG
F
A
G
S
S
A
A
Y
Q
L
S
R
R
G
L
K
I
L
L
V
D
S
K
P
W
N
R
I
--
G
D
K
P
C
G
D
A
V
S
K
A
H
F
-
D
-
K
L
GMPYP
K
-
G
-
E
E
--
L
E
N
K
I
N
G
I
K
L
Y
S
P
D
M
Q
T
V
W
T
V
N
H
E
G
F
E
L
N
A
P
L
Y
N
Q
R
V
L
K
E
A
Q
D
R
G
V
E
I
W
D
----
L
T
T
A
M
K
P
I
F
E
D
G
Y
--
V
K
G
A
V
L
-
F
N
R
-
R
T
N
E
E
--
L
T
V
Y
S
K
V
V
V
E
A
T
G
Y
--
S
R
-
S
F
R
S
-
K
L
P
P
E
L
P
-
I
T
----
E
D
L
D
D
K
D
A
D
V
A
Y
-
R
E
V
L
L
T
K
E
D
--------
I
E
D
-
H
--------
D
--
Y
-
L
R
I
-
F
I
D
------
Q
-----
E
T
S
---
P
G
G
Y
W
W
Y
F
P
K
G
K
N
-----
K
V
N
V
G
L
G
I
Q
G
G
M
G
YP
S
I
H
E
Y
Y
K
K
Y
L
D
K
Y
A
PD
V
D
K
S
K
L
L
V
K
G
G
A
L
V
P
T
R
R
P
-
L
Y
T
M
A
W
---
N
G
I
I
V
I
G
D
S
G
F
T
V
N
P
V
H
G
----------
G
G
K
G
S
A
M
I
S
G
Y
C
A
A
K
A
I
L
S
A
F
E
T
G
-------
D
F
S
A
S
G
L
W
D
M
N
I
C
Y
V
N
E
Y
G
A
K
Q
A
S
L
D
I
F
R
R
F
L
Q
K
L
S
N
D
D
I
N
Y
G
M
K
K
K
I
I
K
E
E
D
L
L
E
A
S
E
K
G
D
L
H
L
S
V
A
D
K
A
M
R
V
I
S
G
L
G
R
P
S
L
L
F
K
--
L
K
A
V
A
E
S
M
K
K
I
K
E
L
Y
L
N
Y
P
R
S
P
S
S
L
G
S
W
R
R
E
V
D
N
V
L
T
E
F
N
K
S
L
S
------
51
HHSearch
61.36
28%
-51
- C4 -
1LST
1
ARGT_SALTY
A:
[2-234]
--------------------------------------
L
P
Q
T
--
V
R
I
G
T
D
T
T
Y
A
P
F
S
S
-
K
-
D
A-----
K
-
G
-
E
F
--
I
G
F
D
I
D
L
G
N
E
M
C
K
R
M
Q
V
K
C
T
W
V
A
S
D
F
D
A
L
I
P
S
L
K
A
K
K
I
D
A
I
I
S
-
S
L
S
I
T
D
K
R
Q
Q
E
I
A
F
S
D
K
L
Y
A
A
D
S
--
R
L
I
A
A
K
-
G
S
P
-
I
Q
P
T
L
--
E
S
L
K
G
K
H
V
G
V
L
Q
G
S
--
T
Q
E
A
Y
A
N
-
D
N
W
R
T
K
G
-
V
D
V
V
A
Y
A
N
Q
D
L
I
Y
S
D
L
T
A
-
G
R
L
D
A
A
L
Q
D
E
V
A
A
S
E
G
F
L
K
Q
-
P
AG------
K
--
E
-
Y
A
F
-
A
G
P
------
S
VKDKK
Y
F
G
---
D
-
G
T
G
V
G
L
R
K
D
-
D
T
E
L
K
A
A
F
D
K
A
L
T
E
L
R
Q
D
G
--
T
Y
D
K
M
A
K
K
Y
F
D
F
N
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
61.04
29%
-58
- C4 -
1HSL
6
HISJ_ECOLI
A:
[8-231]
----------------------------------------------
I
G
T
D
P
T
Y
A
P
F
E
S
-
K
-
N
A-----
Q
-
G
-
E
L
--
V
G
F
D
I
D
L
A
K
E
L
C
K
R
I
N
T
Q
C
T
F
V
E
N
P
L
D
A
L
I
P
S
L
K
A
K
K
I
D
A
I
M
S
-
S
L
S
I
T
E
K
R
Q
Q
E
I
A
F
T
D
K
L
Y
A
A
D
S
--
R
L
V
V
A
K
-
N
S
D
-
I
Q
P
T
V
--
A
S
L
K
G
K
R
V
G
V
L
Q
G
T
--
T
Q
E
T
F
G
N
-
E
H
W
A
P
K
G
-
I
E
I
V
S
Y
Q
G
Q
D
N
I
Y
S
D
L
T
A
-
G
R
I
D
A
A
F
Q
D
E
V
A
A
S
E
G
-
F
L
K
-
Q
PVGKD
Y
K
F
G
--
G
-
P
A
V
-
K
D
E
------
K
-----
L
F
G
---
V
-
G
T
G
M
G
L
R
K
E
D
N
-
E
L
R
E
A
L
N
K
A
F
A
E
M
R
A
D
G
--
T
Y
E
K
L
A
K
K
Y
F
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
35
PsiBlast_CBE
60.99
35%
-64
- C4 -
4PSH
1
?
B:
[12-226]
---------------------------------------------
L
V
G
L
S
A
D
F
P
P
F
E
F
V
D
-
E
------
N
-
G
-
N
I
--
V
G
F
D
V
D
L
A
K
E
I
A
R
R
L
G
V
E
L
K
I
V
D
M
T
F
D
G
L
I
P
S
L
L
T
K
K
I
D
V
I
I
S
-
G
M
T
I
T
E
E
R
K
K
V
V
A
F
S
D
P
Y
F
D
A
G
Q
--
V
I
V
V
R
K
-
D
S
D
F
R
P
K
T
Y
--
E
D
L
V
G
K
T
V
A
V
Q
I
G
T
--
T
G
D
I
E
V
S
-----
K
Y
D
G
I
K
V
V
R
F
D
K
F
T
D
A
F
L
E
L
K
R
-
G
R
A
D
A
V
V
L
D
S
A
T
A
R
A
F
-
V
A
K
-
N
--------
P
--
D
-
L
V
I
-
S
S
G
------
V
-----
L
S
S
---
E
-
Q
Y
G
I
A
V
R
K
-
E
D
T
D
L
L
E
F
I
N
S
V
L
R
E
L
K
K
S
---
P
Y
D
V
L
I
E
K
W
F
S
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
50
HHSearch
60.97
36%
-61
- C4 -
1WDN
1
GLNH_ECOLI
A:
[4-224]
-----------------------------------------
K
--
L
V
V
A
T
D
T
A
F
V
P
F
E
F
-
K
-
Q
------
G
-
D
-
L
Y
--
V
G
F
D
V
D
L
W
A
A
I
A
K
E
L
K
L
D
Y
E
L
K
P
M
D
F
S
G
I
I
P
A
L
Q
T
K
N
V
D
L
A
L
A
-
G
I
T
I
T
D
E
R
K
K
A
I
D
F
S
D
G
Y
Y
K
S
G
L
--
L
V
M
V
K
A
-
N
N
N
-
D
V
K
S
V
--
K
D
L
D
G
K
V
V
A
V
K
S
G
T
--
G
S
V
D
Y
A
K
-
A
N
I
--
K
T
-
K
D
L
R
Q
F
P
N
I
D
N
A
Y
M
E
L
G
T
-
N
R
A
D
A
V
L
H
D
T
P
N
I
L
Y
F
-
I
K
T
-
A
GN------
G
--
Q
-
F
K
A
-
V
G
D
------
S
-----
L
E
A
---
Q
-
Q
Y
G
I
A
F
P
K
G
-
S
D
E
L
R
D
K
V
N
G
A
L
K
T
L
R
E
N
G
--
T
Y
N
E
I
Y
K
K
W
F
G
T
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
68
Fugue
60.94
35%
-70
- C4 -
1GGG
-
GLNH_ECOLI
A:
[5-224]
--------------------------------------------
L
V
V
A
T
D
T
A
F
V
P
F
E
F
-
K
Q
G
--------
D
-
L
Y
--
V
G
F
D
V
D
L
W
A
A
I
A
K
E
L
K
L
D
Y
E
L
K
P
M
D
F
S
G
I
I
P
A
L
Q
T
K
N
V
D
L
A
L
A
-
G
I
T
I
T
D
E
R
K
K
A
I
D
F
S
D
G
Y
Y
K
S
G
L
--
L
V
M
V
K
A
-
N
N
N
-
D
V
K
S
V
KD
L
D
--
G
K
V
V
A
V
K
S
G
T
--
G
S
V
D
Y
A
K
-
A
N
I
K
T
K
---
D
L
R
Q
F
P
N
I
D
N
A
Y
M
E
L
G
T
-
N
R
A
D
A
V
L
H
D
T
P
N
I
L
-
Y
-
F
I
K
-
T
--------
A
--
G
-
N
G
Q
-
F
K
A
V
G
DSLE--------
A
---
Q
-
Q
Y
G
I
A
F
P
K
G
-
S
D
E
L
R
D
K
V
N
G
A
L
K
T
L
R
E
N
G
--
T
Y
N
E
I
Y
K
K
W
F
G
T
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
41
PsiBlast_CBE
40.28
36%
-36
- C4 -
4H5F
5
?
B:
[15-132]
---------------------------------------------
V
V
A
T
S
P
D
Y
A
P
F
E
F
-
Q
-
S
LV----
D
-
G
-
K
N
QV
V
G
A
D
I
D
M
A
Q
A
I
A
D
E
L
G
V
K
L
E
I
L
S
M
S
F
D
N
V
L
T
S
L
Q
T
G
K
A
D
L
A
V
A
-
G
I
S
A
T
D
E
R
K
E
V
F
D
F
S
I
P
Y
Y
E
N
K
I
--
S
F
L
V
H
K
A
D
V
E
-
K
Y
K
D
L
--
T
S
L
E
S
A
N
I
A
A
Q
K
G
T
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
37
PsiBlast_CBE
40.26
36%
-40
- C4 -
4H5G
4
?
B:
[15-132]
---------------------------------------------
V
V
A
T
S
P
D
Y
A
P
F
E
F
-
Q
-
S
LV----
D
-
G
-
K
N
QV
V
G
A
D
I
D
M
A
Q
A
I
A
D
E
L
G
V
K
L
E
I
L
S
M
S
F
D
N
V
L
T
S
L
Q
T
G
K
A
D
L
A
V
A
-
G
I
S
A
T
D
E
R
K
E
V
F
D
F
S
I
P
Y
Y
E
N
K
I
--
S
F
L
V
H
K
A
D
V
E
-
K
Y
K
D
L
--
T
S
L
E
S
A
N
I
A
A
Q
K
G
T
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
42
PsiBlast_CBE
38.64
36%
-40
- C4 -
4H5F
11
?
A:
[15-132]
---------------------------------------------
V
V
A
T
S
P
D
Y
A
P
F
E
F
-
Q
-
S
LV----
D
-
G
-
K
N
Q
V
V
G
A
D
I
D
M
A
Q
A
I
A
D
E
L
G
V
K
L
E
I
L
S
M
S
F
D
N
V
L
T
S
L
Q
T
G
K
A
D
L
A
V
A
-
G
I
S
A
T
D
E
R
K
E
V
F
D
F
S
I
P
Y
Y
E
N
K
I
--
S
F
L
V
H
K
A
D
V
E
-
K
Y
K
D
L
--
T
S
L
E
S
A
N
I
A
A
Q
K
G
T
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
43
PsiBlast_CBE
37.03
33%
-51
- C4 -
3N26
1
ARTJ_CHLPN
A:
[11-136]
-----------------------------------------
I
--
W
I
V
G
T
N
A
T
Y
P
P
F
E
Y
V
D
-
A
------
Q
-
G
-
E
V
--
V
G
F
D
I
D
L
A
K
A
I
S
E
K
L
G
K
Q
L
E
V
R
E
F
A
F
D
A
L
I
L
N
L
K
K
H
R
I
D
A
I
L
A
-
G
M
S
I
T
P
S
R
Q
K
E
I
A
L
L
-
P
Y
Y
G
D
E
V
Q
E
L
M
V
V
S
K
-
R
S
L
-
E
T
P
V
L
--
P
L
T
Q
H
S
S
V
A
V
Q
T
G
T
F
Q
E
H
Y
L
L
S
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
45
PsiBlast_CBE
36.79
33%
-53
- C4 -
3QAX
1
ARTJ_CHLPN
A:
[32-157]
-----------------------------------------
I
--
W
I
V
G
T
N
A
T
Y
P
P
F
E
Y
V
D
-
A
------
Q
-
G
-
E
V
--
V
G
F
D
I
D
L
A
K
A
I
S
E
K
L
G
K
Q
L
E
V
R
E
F
A
F
D
A
L
I
L
N
L
K
K
H
R
I
D
A
I
L
A
-
G
M
S
I
T
P
S
R
Q
K
E
I
A
L
L
-
P
Y
Y
G
D
E
V
Q
E
L
M
V
V
S
K
-
R
S
L
-
E
T
P
V
L
--
P
L
T
Q
Y
S
S
V
A
V
Q
T
G
T
Y
Q
E
H
Y
L
L
S
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
44
PsiBlast_CBE
35.84
33%
-47
- C4 -
3QAX
1
ARTJ_CHLPN
B:
[32-157]
-----------------------------------------
I
--
W
I
V
G
T
N
A
T
Y
P
P
F
E
Y
V
D
-
A
------
Q
-
G
-
E
V
--
V
G
F
D
I
D
L
A
K
A
I
S
E
K
L
G
K
Q
L
E
V
R
E
F
A
F
D
A
L
I
L
N
L
K
K
H
R
I
D
A
I
L
A
-
G
M
S
I
T
P
S
R
Q
K
E
I
A
L
L
-
P
Y
Y
G
D
E
V
QE
L
M
V
V
S
K
-
R
S
L
-
E
T
P
V
L
--
P
L
T
Q
Y
S
S
V
A
V
Q
T
G
T
Y
Q
E
H
Y
L
L
S
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------