@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 : Rv3569c: (2016-05-21 )
MTATEELTFESTSRFAEVDVDGPLKLHYHEAGVGNDQTVVLLHGGGPGAASWTNFSRNIAVLARHFHVLAVDQPGYGHSDKRAEHGQFNRYAAMALKGLFDQLGLGRVPLVGNSLGGGTAVRFALDYPARAGRLVLMGPGGLSINLFAPDPTEGVKRLSKFSVAPTRENLEAFLRVMVYDKNLITPELVDQRFALASTPESLTATRAMGKSFAGADFEAGMMWREVYRLRQPVLLIWGREDRVNPLDGALVALKTIPRAQLHVFGQCGHWVQVEKFDEFNKLTIEFLGGGR
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
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MTAT
E
E
L
T
FESTS
R
F
A
E
VDVDG--
P
-
L
K
L
H
Y
H
EAGVGND
Q
T
V
V
L
L
HGGGPGAASWTNFS
R
N
I
-
A
V
L
A
RH-
F
H
V
L
A
VDQPGYGHSDKRAE-HGQ
F
N
R
Y
A
A
M
A
L
K
G
L
F
D
QLGLGRVPLVGNSLGG
G
T
A
V
R
F
A
LDYPARA
G
R
L
V
L
MGPG
G
L
S
I
N
L
FAPD
P
T
E
G
V
K
R
L
S
K
FSVAP
T
R
E
N
L
E
A
F
L
R
V
M
VYDKNLI
T
P
E
L
V
D
Q
R
F-AL-AST
P
E
S
L
----
T
A
T
R
A
M
G
K
SFAGA
D
F
E
A
G
M
-
M
W
--------
R
E
V
Y
R
L---RQ
P
V
L
L
I
WGREDRVNPLD
G
A
L
V
A
L
K
TI
P
R
A
Q
L
H
V
FGQCG
H
W
V
Q
V
E
KFDEF
N
K
L
T
I
E
F
LGGGR
22
PsiBlast_CBE
98.25
99%
-106
- C1 -
2WUG
2
HSAD_MYCTU
B:
[7-289]
------
L
T
F
E
S
T
S
R
F
A
E
V
D
V
D
G
--
P
-
L
K
L
H
Y
H
E
A
G
V
G
N
D
Q
T
V
V
L
L
H
G
G
G
P
G
A
A
S
W
T
N
F
S
R
N
I
-
A
V
L
A
R
H
-
F
H
V
L
A
V
D
Q
P
G
Y
G
H
S
D
K
R
A
E
-
H
G
Q
F
N
R
Y
A
A
M
A
L
K
G
L
F
D
Q
L
G
L
G
R
V
P
L
V
G
N
A
L
G
G
G
T
A
V
R
F
A
L
D
Y
P
A
R
A
G
R
L
V
L
M
G
P
G
G
L
S
I
N
L
F
A
P
D
P
T
E
G
V
K
R
L
S
K
F
S
V
A
P
T
R
E
N
L
E
A
F
L
R
V
M
V
Y
D
K
N
L
I
T
P
E
L
V
D
Q
R
F
-
A
L
-
A
S
T
P
E
S
L
----
T
A
T
R
A
M
G
K
S
F
A
G
A
D
F
E
A
G
M
-
M
W
--------
R
E
V
Y
R
L
---
R
Q
P
V
L
L
I
W
G
R
E
D
R
V
N
P
L
D
G
A
L
V
A
L
K
T
I
P
R
A
Q
L
H
V
F
G
Q
C
G
H
W
V
Q
V
E
K
F
D
E
F
N
K
L
T
I
E
F
L
G
G
--
23
PsiBlast_CBE
97.14
99%
-104
- C1 -
2WUF
3
HSAD_MYCTU
B:
[7-288]
------
L
T
F
E
S
T
S
R
F
A
E
V
D
V
D
G
--
P
-
L
K
L
H
Y
H
E
A
G
V
G
N
D
Q
T
V
V
L
L
H
G
G
G
P
G
A
A
S
W
T
N
F
S
R
N
I
-
A
V
L
A
R
H
-
F
H
V
L
A
V
D
Q
P
G
Y
G
H
S
D
K
R
A
E
-
H
G
Q
F
N
R
Y
A
A
M
A
L
K
G
L
F
D
Q
L
G
L
G
R
V
P
L
V
G
N
A
L
G
G
G
T
A
V
R
F
A
L
D
Y
P
A
R
A
G
R
L
V
L
M
G
P
G
G
L
S
I
N
L
F
A
P
D
P
T
E
G
V
K
R
L
S
K
F
S
V
A
P
T
R
E
N
L
E
A
F
L
R
V
M
V
Y
D
K
N
L
I
T
P
E
L
V
D
Q
R
F
-
A
L
-
A
S
T
P
E
S
L
----
T
A
T
R
A
M
G
K
S
F
A
G
A
D
F
E
A
G
M
-
M
W
--------
R
E
V
Y
R
L
---
R
Q
P
V
L
L
I
W
G
R
E
D
R
V
N
P
L
D
G
A
L
V
A
L
K
T
I
P
R
A
Q
L
H
V
F
G
Q
C
G
H
W
V
Q
V
E
K
F
D
E
F
N
K
L
T
I
E
F
L
G
---
5
PsiBlast_PDB
96.63
99%
-104
- C1 -
2WUG
2
HSAD_MYCTU
A:
[7-289]
------
L
T
F
E
S
T
S
R
F
A
E
V
D
V
D
G
--
P
-
L
K
L
H
Y
H
E
A
G
V
G
N
D
Q
T
V
V
L
L
H
G
G
G
P
G
A
A
S
W
T
N
F
S
R
N
I
-
A
V
L
A
R
H
-
F
H
V
L
A
V
D
Q
P
G
Y
G
H
S
D
K
R
A
E
-
H
G
Q
F
N
R
Y
A
A
M
A
L
K
G
L
F
D
Q
L
G
L
G
R
V
P
L
V
G
N
A
L
G
G
G
T
A
V
R
F
A
L
D
Y
P
A
R
A
G
R
L
V
L
M
G
P
G
G
L
S
I
N
L
F
A
P
D
P
T
E
G
V
K
R
L
S
K
F
S
V
A
P
T
R
E
N
L
E
A
F
L
R
V
M
V
Y
D
K
N
L
I
T
P
E
L
V
D
Q
R
F
-
A
L
-
A
S
T
P
E
S
L
----
T
A
T
R
A
M
G
K
S
F
A
G
A
D
F
E
A
G
M
-
M
W
--------
R
E
V
Y
R
L
---
R
Q
P
V
L
L
I
W
G
R
E
D
R
V
N
P
L
D
G
A
L
V
A
L
K
T
I
P
R
A
Q
L
H
V
F
G
Q
C
G
H
W
V
Q
V
E
K
F
D
E
F
N
K
L
T
I
E
F
L
G
G
--
25
PsiBlast_CBE
96.36
99%
-104
- C1 -
2WUD
1
HSAD_MYCTU
B:
[7-288]
------
L
T
F
E
S
T
S
R
F
A
E
V
D
V
D
G
--
P
-
L
K
L
H
Y
H
E
A
G
V
G
N
D
Q
T
V
V
L
L
H
G
G
G
P
G
A
A
S
W
T
N
F
S
R
N
I
-
A
V
L
A
R
H
-
F
H
V
L
A
V
D
Q
P
G
Y
G
H
S
D
K
R
A
E
-
H
G
Q
F
N
R
Y
A
A
M
A
L
K
G
L
F
D
Q
L
G
L
G
R
V
P
L
V
G
N
A
L
G
G
G
T
A
V
R
F
A
L
D
Y
P
A
R
A
G
R
L
V
L
M
G
P
G
G
L
S
I
N
L
F
A
P
D
P
T
E
G
V
K
R
L
S
K
F
S
V
A
P
T
R
E
N
L
E
A
F
L
R
V
M
V
Y
D
K
N
L
I
T
P
E
L
V
D
Q
R
F
-
A
L
-
A
S
T
P
E
S
L
----
T
A
T
R
A
M
G
K
S
F
A
G
A
D
F
E
A
G
M
-
M
W
--------
R
E
V
Y
R
L
---
R
Q
P
V
L
L
I
W
G
R
E
D
R
V
N
P
L
D
G
A
L
V
A
L
K
T
I
P
R
A
Q
L
H
V
F
G
Q
C
G
H
W
V
Q
V
E
K
F
D
E
F
N
K
L
T
I
E
F
L
G
---
55
HHSearch
96.28
100%
-105
- C1 -
2WUE
2
HSAD_MYCTU
A:
[7-289]
------
L
T
F
E
S
T
S
R
F
A
E
V
D
V
D
G
--
P
-
L
K
L
H
Y
H
E
A
G
V
G
N
D
Q
T
V
V
L
L
H
G
G
G
P
G
A
A
S
W
T
N
F
S
R
N
I
-
A
V
L
A
R
H
-
F
H
V
L
A
V
D
Q
P
G
Y
G
H
S
D
K
R
A
E
-
H
G
Q
F
N
R
Y
A
A
M
A
L
K
G
L
F
D
Q
L
G
L
G
R
V
P
L
V
G
N
A
L
G
G
G
T
A
V
R
F
A
L
D
Y
P
A
R
A
G
R
L
V
L
M
G
P
G
G
L
S
I
N
L
F
A
P
D
P
T
E
G
V
K
R
L
S
K
F
S
V
A
P
T
R
E
N
L
E
A
F
L
R
V
M
V
Y
D
K
N
L
I
T
P
E
L
V
D
Q
R
F
-
A
L
-
A
S
T
P
E
S
L
----
T
A
T
R
A
M
G
K
S
F
A
G
A
D
F
E
A
G
M
-
M
W
--------
R
E
V
Y
R
L
---
R
Q
P
V
L
L
I
W
G
R
E
D
R
V
N
P
L
D
G
A
L
V
A
L
K
T
I
P
R
A
Q
L
H
V
F
G
Q
C
G
H
W
V
Q
V
E
K
F
D
E
F
N
K
L
T
I
E
F
L
G
G
--
24
PsiBlast_CBE
96.23
99%
-104
- C1 -
2WUE
1
HSAD_MYCTU
B:
[7-288]
------
L
T
F
E
S
T
S
R
F
A
E
V
D
V
D
G
--
P
-
L
K
L
H
Y
H
E
A
G
V
G
N
D
Q
T
V
V
L
L
H
G
G
G
P
G
A
A
S
W
T
N
F
S
R
N
I
-
A
V
L
A
R
H
-
F
H
V
L
A
V
D
Q
P
G
Y
G
H
S
D
K
R
A
E
-
H
G
Q
F
N
R
Y
A
A
M
A
L
K
G
L
F
D
Q
L
G
L
G
R
V
P
L
V
G
N
A
L
G
G
G
T
A
V
R
F
A
L
D
Y
P
A
R
A
G
R
L
V
L
M
G
P
G
G
L
S
I
N
L
F
A
P
D
P
T
E
G
V
K
R
L
S
K
F
S
V
A
P
T
R
E
N
L
E
A
F
L
R
V
M
V
Y
D
K
N
L
I
T
P
E
L
V
D
Q
R
F
-
A
L
-
A
S
T
P
E
S
L
----
T
A
T
R
A
M
G
K
S
F
A
G
A
D
F
E
A
G
M
-
M
W
--------
R
E
V
Y
R
L
---
R
Q
P
V
L
L
I
W
G
R
E
D
R
V
N
P
L
D
G
A
L
V
A
L
K
T
I
P
R
A
Q
L
H
V
F
G
Q
C
G
H
W
V
Q
V
E
K
F
D
E
F
N
K
L
T
I
E
F
L
G
---
4
PsiBlast_PDB
96.10
99%
-105
- C1 -
2WUF
2
HSAD_MYCTU
A:
[7-288]
------
L
T
F
E
S
T
S
R
F
A
E
V
D
V
D
G
--
P
-
L
K
L
H
Y
H
E
A
G
V
G
N
D
Q
T
V
V
L
L
H
G
G
G
P
G
A
A
S
W
T
N
F
S
R
N
I
-
A
V
L
A
R
H
-
F
H
V
L
A
V
D
Q
P
G
Y
G
H
S
D
K
R
A
E
-
H
G
Q
F
N
R
Y
A
A
M
A
L
K
G
L
F
D
Q
L
G
L
G
R
V
P
L
V
G
N
A
L
G
G
G
T
A
V
R
F
A
L
D
Y
P
A
R
A
G
R
L
V
L
M
G
P
G
G
L
S
I
N
L
F
A
P
D
P
T
E
G
V
K
R
L
S
K
F
S
V
A
P
T
R
E
N
L
E
A
F
L
R
V
M
V
Y
D
K
N
L
I
T
P
E
L
V
D
Q
R
F
-
A
L
-
A
S
T
P
E
S
L
----
T
A
T
R
A
M
G
K
S
F
A
G
A
D
F
E
A
G
M
-
M
W
--------
R
E
V
Y
R
L
---
R
Q
P
V
L
L
I
W
G
R
E
D
R
V
N
P
L
D
G
A
L
V
A
L
K
T
I
P
R
A
Q
L
H
V
F
G
Q
C
G
H
W
V
Q
V
E
K
F
D
E
F
N
K
L
T
I
E
F
L
G
---
3
PsiBlast_PDB
96.06
99%
-105
- C1 -
2WUE
2
HSAD_MYCTU
A:
[7-289]
------
L
T
F
E
S
T
S
R
F
A
E
V
D
V
D
G
--
P
-
L
K
L
H
Y
H
E
A
G
V
G
N
D
Q
T
V
V
L
L
H
G
G
G
P
G
A
A
S
W
T
N
F
S
R
N
I
-
A
V
L
A
R
H
-
F
H
V
L
A
V
D
Q
P
G
Y
G
H
S
D
K
R
A
E
-
H
G
Q
F
N
R
Y
A
A
M
A
L
K
G
L
F
D
Q
L
G
L
G
R
V
P
L
V
G
N
A
L
G
G
G
T
A
V
R
F
A
L
D
Y
P
A
R
A
G
R
L
V
L
M
G
P
G
G
L
S
I
N
L
F
A
P
D
P
T
E
G
V
K
R
L
S
K
F
S
V
A
P
T
R
E
N
L
E
A
F
L
R
V
M
V
Y
D
K
N
L
I
T
P
E
L
V
D
Q
R
F
-
A
L
-
A
S
T
P
E
S
L
----
T
A
T
R
A
M
G
K
S
F
A
G
A
D
F
E
A
G
M
-
M
W
--------
R
E
V
Y
R
L
---
R
Q
P
V
L
L
I
W
G
R
E
D
R
V
N
P
L
D
G
A
L
V
A
L
K
T
I
P
R
A
Q
L
H
V
F
G
Q
C
G
H
W
V
Q
V
E
K
F
D
E
F
N
K
L
T
I
E
F
L
G
G
--
2
PsiBlast_PDB
96.00
99%
-105
- C1 -
2WUD
1
HSAD_MYCTU
A:
[7-288]
------
L
T
F
E
S
T
S
R
F
A
E
V
D
V
D
G
--
P
-
L
K
L
H
Y
H
E
A
G
V
G
N
D
Q
T
V
V
L
L
H
G
G
G
P
G
A
A
S
W
T
N
F
S
R
N
I
-
A
V
L
A
R
H
-
F
H
V
L
A
V
D
Q
P
G
Y
G
H
S
D
K
R
A
E
-
H
G
Q
F
N
R
Y
A
A
M
A
L
K
G
L
F
D
Q
L
G
L
G
R
V
P
L
V
G
N
A
L
G
G
G
T
A
V
R
F
A
L
D
Y
P
A
R
A
G
R
L
V
L
M
G
P
G
G
L
S
I
N
L
F
A
P
D
P
T
E
G
V
K
R
L
S
K
F
S
V
A
P
T
R
E
N
L
E
A
F
L
R
V
M
V
Y
D
K
N
L
I
T
P
E
L
V
D
Q
R
F
-
A
L
-
A
S
T
P
E
S
L
----
T
A
T
R
A
M
G
K
S
F
A
G
A
D
F
E
A
G
M
-
M
W
--------
R
E
V
Y
R
L
---
R
Q
P
V
L
L
I
W
G
R
E
D
R
V
N
P
L
D
G
A
L
V
A
L
K
T
I
P
R
A
Q
L
H
V
F
G
Q
C
G
H
W
V
Q
V
E
K
F
D
E
F
N
K
L
T
I
E
F
L
G
---
1
PsiBlast_PDB
95.65
100%
-102
- C1 -
2VF2
3
HSAD_MYCTU
A:
[27-310]
------
L
T
F
E
S
T
S
R
F
A
E
V
D
V
D
G
--
P
-
L
K
L
H
Y
H
E
A
G
V
G
N
D
Q
T
V
V
L
L
H
G
G
G
P
G
A
A
S
W
T
N
F
S
R
N
I
-
A
V
L
A
R
H
-
F
H
V
L
A
V
D
Q
P
G
Y
G
H
S
D
K
R
A
E
-
H
G
Q
F
N
R
Y
A
A
M
A
L
K
G
L
F
D
Q
L
G
L
G
R
V
P
L
V
G
N
S
L
G
G
G
T
A
V
R
F
A
L
D
Y
P
A
R
A
G
R
L
V
L
M
G
P
G
G
L
S
I
N
L
F
A
P
D
P
T
E
G
V
K
R
L
S
K
F
S
V
A
P
T
R
E
N
L
E
A
F
L
R
V
M
V
Y
D
K
N
L
I
T
P
E
L
V
D
Q
R
F
-
A
L
-
A
S
T
P
E
S
L
----
T
A
T
R
A
M
G
K
S
F
A
G
A
D
F
E
A
G
M
-
M
W
--------
R
E
V
Y
R
L
---
R
Q
P
V
L
L
I
W
G
R
E
D
R
V
N
P
L
D
G
A
L
V
A
L
K
T
I
P
R
A
Q
L
H
V
F
G
Q
C
G
H
W
V
Q
V
E
K
F
D
E
F
N
K
L
T
I
E
F
L
G
G
G
-
21
PsiBlast_CBE
95.42
100%
-98
- C1 -
2VF2
4
HSAD_MYCTU
B:
[27-310]
------
L
T
F
E
S
T
S
R
F
A
E
V
D
V
D
G
--
P
-
L
K
L
H
Y
H
E
A
G
V
G
N
D
Q
T
V
V
L
L
H
G
G
G
P
G
A
A
S
W
T
N
F
S
R
N
I
-
A
V
L
A
R
H
-
F
H
V
L
A
V
D
Q
P
G
Y
G
H
S
D
K
R
A
E
-
H
G
Q
F
N
R
Y
A
A
M
A
L
K
G
L
F
D
Q
L
G
L
G
R
V
P
L
V
G
N
S
L
G
G
G
T
A
V
R
F
A
L
D
Y
P
A
R
A
G
R
L
V
L
M
G
P
G
G
L
S
I
N
L
F
A
P
D
P
T
E
G
V
K
R
L
S
K
F
S
V
A
P
T
R
E
N
L
E
A
F
L
R
V
M
V
Y
D
K
N
L
I
T
P
E
L
V
D
Q
R
F
-
A
L
-
A
S
T
P
E
S
L
----
T
A
T
R
A
M
G
K
S
F
A
G
A
D
F
E
A
G
M
-
M
W
--------
R
E
V
Y
R
L
---
R
Q
P
V
L
L
I
W
G
R
E
D
R
V
N
P
L
D
G
A
L
V
A
L
K
T
I
P
R
A
Q
L
H
V
F
G
Q
C
G
H
W
V
Q
V
E
K
F
D
E
F
N
K
L
T
I
E
F
L
G
G
G
-
29
PsiBlast_CBE
76.09
39%
-97
- C1 -
1U2E
1
MHPC_ECOLI
C:
[4-286]
---
Y
Q
P
Q
T
E
A
A
T
S
R
F
L
N
V
E
E
A
G
--
K
T
L
R
I
H
F
N
D
C
G
Q
G
-
D
E
T
V
V
L
L
H
G
S
G
P
G
A
T
G
W
A
N
F
S
R
N
I
-
D
P
L
V
E
A
G
Y
R
V
I
L
L
D
C
P
G
W
G
K
S
D
S
V
V
N
-
S
G
S
R
S
D
L
N
A
R
I
L
K
S
V
V
D
Q
L
D
I
A
K
I
H
L
L
G
N
S
M
G
G
H
S
S
V
A
F
T
L
K
W
P
E
R
V
G
K
L
V
L
M
G
G
G
T
G
G
M
S
L
F
T
P
M
P
T
E
G
I
K
R
L
N
Q
L
Y
R
Q
P
T
I
E
N
L
K
L
M
M
D
I
F
V
F
D
T
S
D
L
T
D
A
L
F
E
A
R
L
N
N
M
-
L
S
R
R
D
H
L
ENFV
K
S
L
E
A
N
P
K
Q
F
--
P
D
F
G
P
--------------
R
L
A
E
I
---
K
A
Q
T
L
I
V
W
G
R
N
D
R
F
V
P
M
D
A
G
L
R
L
L
S
G
I
A
G
S
E
L
H
I
F
R
D
C
G
H
W
A
Q
W
E
H
A
D
A
F
N
Q
L
V
L
N
F
L
----
10
PsiBlast_PDB
75.86
43%
-92
- C1 -
2RHW
2
BPHD_BURXL
A:
[1-280]
------
L
T
E
S
S
T
S
K
F
V
K
I
N
E
K
G
FS
D
-
F
N
I
H
Y
N
E
A
G
--
N
G
E
T
V
I
M
L
H
G
G
G
P
G
A
G
G
W
S
N
Y
Y
R
N
V
-
G
P
F
V
D
A
G
Y
R
V
I
L
K
D
S
P
G
F
N
K
S
D
A
V
V
M
-
D
E
Q
R
G
L
V
N
A
R
A
V
K
G
L
M
D
A
L
D
I
D
R
A
H
L
V
G
N
A
M
G
G
A
T
A
L
N
F
A
L
E
Y
P
D
R
I
G
K
L
I
L
M
G
P
G
G
L
G
P
S
M
F
A
P
M
P
M
E
G
I
K
L
L
F
K
L
Y
A
E
P
S
Y
E
T
L
K
Q
M
L
Q
V
F
L
Y
D
Q
S
L
I
T
E
E
L
L
Q
G
R
W
E
A
I
-
Q
R
Q
P
E
H
L
-----------
K
N
F
L
I
S
A
Q
K
A
P
L
S
T
W
--------
D
V
T
A
R
L
GEI
K
A
K
T
F
I
T
W
G
R
D
D
R
F
V
P
L
D
H
G
L
K
L
L
W
N
I
D
D
A
R
L
H
V
F
S
K
C
G
H
W
A
Q
W
E
H
A
D
E
F
N
R
L
V
I
D
F
L
----
11
PsiBlast_PDB
75.80
43%
-91
- C1 -
2RI6
2
BPHD_BURXL
A:
[1-280]
------
L
T
E
S
S
T
S
K
F
V
K
I
N
E
K
G
FS
D
-
F
N
I
H
Y
N
E
A
G
--
N
G
E
T
V
I
M
L
H
G
G
G
P
G
A
G
G
W
S
N
Y
Y
R
N
V
-
G
P
F
V
D
A
G
Y
R
V
I
L
K
D
S
P
G
F
N
K
S
D
A
V
V
M
-
D
E
Q
R
G
L
V
N
A
R
A
V
K
G
L
M
D
A
L
D
I
D
R
A
H
L
V
G
N
A
M
G
G
A
T
A
L
N
F
A
L
E
Y
P
D
R
I
G
K
L
I
L
M
G
P
G
G
L
G
P
S
M
F
A
P
M
P
M
E
G
I
K
L
L
F
K
L
Y
A
E
P
S
Y
E
T
L
K
Q
M
L
Q
V
F
L
Y
D
Q
S
L
I
T
E
E
L
L
Q
G
R
W
E
A
I
-
Q
R
Q
P
E
H
L
-----------
K
N
F
L
I
S
A
Q
K
A
P
L
S
T
W
--------
D
V
T
A
R
L
GEI
K
A
K
T
F
I
T
W
G
R
D
D
R
F
V
P
L
D
H
G
L
K
L
L
W
N
I
D
D
A
R
L
H
V
F
S
K
C
G
H
W
A
Q
W
E
H
A
D
E
F
N
R
L
V
I
D
F
L
----
14
PsiBlast_PDB
75.79
43%
-92
- C1 -
3V1L
1
BPHD_BURXL
A:
[4-283]
------
L
T
E
S
S
T
S
K
F
V
K
I
N
E
K
G
FS
D
-
F
N
I
H
Y
N
E
A
G
--
N
G
E
T
V
I
M
L
H
G
G
G
P
G
A
G
G
W
S
N
Y
Y
R
N
V
-
G
P
F
V
D
A
G
Y
R
V
I
L
K
D
S
P
G
F
N
K
S
D
A
V
V
M
-
D
E
Q
R
G
L
V
N
A
R
A
V
K
G
L
M
D
A
L
D
I
D
R
A
H
L
V
G
N
A
M
G
G
A
T
A
L
N
F
A
L
E
Y
P
D
R
I
G
K
L
I
L
M
G
P
G
G
L
G
P
S
M
F
A
P
M
P
M
E
G
I
K
L
L
F
K
L
Y
A
E
P
S
Y
E
T
L
K
Q
M
L
Q
V
F
L
Y
D
Q
S
L
I
T
E
E
L
L
Q
G
R
W
E
A
I
-
Q
R
Q
P
E
H
L
-----------
K
N
F
L
I
S
A
Q
K
A
P
L
S
T
W
--------
D
V
T
A
R
L
GEI
K
A
K
T
F
I
T
W
G
R
D
D
R
F
V
P
L
D
H
G
L
K
L
L
W
N
I
D
D
A
R
L
H
V
F
S
K
C
G
Q
W
A
Q
W
E
H
A
D
E
F
N
R
L
V
I
D
F
L
----
18
PsiBlast_PDB
75.47
39%
-97
- C1 -
1U2E
1
MHPC_ECOLI
A:
[4-286]
---
Y
Q
P
Q
T
E
A
A
T
S
R
F
L
N
V
E
E
A
G
--
K
T
L
R
I
H
F
N
D
C
G
Q
G
-
D
E
T
V
V
L
L
H
G
S
G
P
G
A
T
G
W
A
N
F
S
R
N
I
-
D
P
L
V
E
A
G
Y
R
V
I
L
L
D
C
P
G
W
G
K
S
D
S
V
V
N
-
S
G
S
R
S
D
L
N
A
R
I
L
K
S
V
V
D
Q
L
D
I
A
K
I
H
L
L
G
N
S
M
G
G
H
S
S
V
A
F
T
L
K
W
P
E
R
V
G
K
L
V
L
M
G
G
G
T
G
G
M
S
L
F
T
P
M
P
T
E
G
I
K
R
L
N
Q
L
Y
R
Q
P
T
I
E
N
L
K
L
M
M
D
I
F
V
F
D
T
S
D
L
T
D
A
L
F
E
A
R
L
N
N
M
-
L
S
R
R
D
H
L
E
N
F
V
K
S
L
E
A
N
P
K
Q
F
--
P
D
F
G
P
--------------
R
L
A
E
I
---
K
A
Q
T
L
I
V
W
G
R
N
D
R
F
V
P
M
D
A
G
L
R
L
L
S
G
I
A
G
S
E
L
H
I
F
R
D
C
G
H
W
A
Q
W
E
H
A
D
A
F
N
Q
L
V
L
N
F
L
----
17
PsiBlast_PDB
75.44
43%
-92
- C1 -
2PUJ
3
BPHD_BURXL
A:
[4-283]
------
L
T
E
S
S
T
S
K
F
V
K
I
N
E
K
G
FS
D
-
F
N
I
H
Y
N
E
A
G
--
N
G
E
T
V
I
M
L
H
G
G
G
P
G
A
G
G
W
S
N
Y
Y
R
N
V
-
G
P
F
V
D
A
G
Y
R
V
I
L
K
D
S
P
G
F
N
K
S
D
A
V
V
M
-
D
E
Q
R
G
L
V
N
A
R
A
V
K
G
L
M
D
A
L
D
I
D
R
A
H
L
V
G
N
A
M
G
G
A
T
A
L
N
F
A
L
E
Y
P
D
R
I
G
K
L
I
L
M
G
P
G
G
L
G
P
S
M
F
A
P
M
P
M
E
G
I
K
L
L
F
K
L
Y
A
E
P
S
Y
E
T
L
K
Q
M
L
Q
V
F
L
Y
D
Q
S
L
I
T
E
E
L
L
Q
G
R
W
E
A
I
-
Q
R
Q
P
E
H
L
-----------
K
N
F
L
I
S
A
Q
K
A
P
L
S
T
W
--------
D
V
T
A
R
L
GEI
K
A
K
T
F
I
T
W
G
R
D
D
R
F
V
P
L
D
H
G
L
K
L
L
W
N
I
D
D
A
R
L
H
V
F
S
K
C
G
A
W
A
Q
W
E
H
A
D
E
F
N
R
L
V
I
D
F
L
----
30
PsiBlast_CBE
75.36
39%
-96
- C1 -
1U2E
1
MHPC_ECOLI
B:
[4-286]
---
Y
Q
P
Q
T
E
A
A
T
S
R
F
L
N
V
E
E
A
G
--
K
T
L
R
I
H
F
N
D
C
G
Q
G
-
D
E
T
V
V
L
L
H
G
S
G
P
G
A
T
G
W
A
N
F
S
R
N
I
-
D
P
L
V
E
A
G
Y
R
V
I
L
L
D
C
P
G
W
G
K
S
D
S
V
V
N
-
S
G
S
R
S
D
L
N
A
R
I
L
K
S
V
V
D
Q
L
D
I
A
K
I
H
L
L
G
N
S
M
G
G
H
S
S
V
A
F
T
L
K
W
P
E
R
V
G
K
L
V
L
M
G
G
G
T
G
G
M
S
L
F
T
P
M
P
T
E
G
I
K
R
L
N
Q
L
Y
R
Q
P
T
I
E
N
L
K
L
M
M
D
I
F
V
F
D
T
S
D
L
T
D
A
L
F
E
A
R
L
N
N
M
-
L
S
R
R
D
H
L
ENFV
K
S
L
E
A
N
P
K
Q
F
--
P
D
F
G
P
--------------
R
L
A
E
I
---
K
A
Q
T
L
I
V
W
G
R
N
D
R
F
V
P
M
D
A
G
L
R
L
L
S
G
I
A
G
S
E
L
H
I
F
R
D
C
G
H
W
A
Q
W
E
H
A
D
A
F
N
Q
L
V
L
N
F
L
----
9
PsiBlast_PDB
74.89
43%
-91
- C1 -
2RHT
3
BPHD_BURXL
A:
[1-280]
------
L
T
E
S
S
T
S
K
F
V
K
I
N
E
K
G
FS
D
-
F
N
I
H
Y
N
E
A
G
--
N
G
E
T
V
I
M
L
H
G
G
G
P
G
A
G
G
W
S
N
Y
Y
R
N
V
-
G
P
F
V
D
A
G
Y
R
V
I
L
K
D
S
P
G
F
N
K
S
D
A
V
V
M
-
D
E
Q
R
G
L
V
N
A
R
A
V
K
G
L
M
D
A
L
D
I
D
R
A
H
L
V
G
N
A
M
G
G
A
T
A
L
N
F
A
L
E
Y
P
D
R
I
G
K
L
I
L
M
G
P
G
G
L
G
P
S
M
F
A
P
M
P
M
E
G
I
K
L
L
F
K
L
Y
A
E
P
S
Y
E
T
L
K
Q
M
L
Q
V
F
L
Y
D
Q
S
L
I
T
E
E
L
L
Q
G
R
W
E
A
I
-
Q
R
Q
P
E
H
L
-----------
K
N
F
L
I
S
A
Q
K
A
P
L
S
T
W
--------
D
V
T
A
R
L
GEI
K
A
K
T
F
I
T
W
G
R
D
D
R
F
V
P
L
D
H
G
L
K
L
L
W
N
I
D
D
A
R
L
H
V
F
S
K
C
G
H
W
A
Q
W
E
H
A
D
E
F
N
R
L
V
I
D
F
L
----
12
PsiBlast_PDB
74.76
44%
-93
- C1 -
3V1K
1
BPHD_BURXL
A:
[2-283]
-
T
A
---
L
T
E
S
S
T
S
K
F
V
K
I
N
E
K
G
FS
D
-
F
N
I
H
Y
N
E
A
G
--
N
G
E
T
V
I
M
L
H
G
G
G
P
G
A
G
G
W
S
N
Y
Y
R
N
V
-
G
P
F
V
D
A
G
Y
R
V
I
L
K
D
S
P
G
F
N
K
S
D
A
V
V
M
-
D
E
Q
R
G
L
V
N
A
R
A
V
K
G
L
M
D
A
L
D
I
D
R
A
H
L
V
G
N
S
M
G
G
A
T
A
L
N
F
A
L
E
Y
P
D
R
I
G
K
L
I
L
M
G
P
G
G
L
G
P
S
M
F
A
P
M
P
M
E
G
I
K
L
L
F
K
L
Y
A
E
P
S
Y
E
T
L
K
Q
M
L
Q
V
F
L
Y
D
Q
S
L
I
T
E
E
L
L
Q
G
R
W
E
A
I
-
Q
R
Q
P
E
H
L
-----------
K
N
F
L
I
S
A
Q
K
A
P
L
S
T
W
--------
D
V
T
A
R
L
GEI
K
A
K
T
F
I
T
W
G
R
D
D
R
F
V
P
L
D
H
G
L
K
L
L
W
N
I
D
D
A
R
L
H
V
F
S
K
C
G
Q
W
A
Q
W
E
H
A
D
E
F
N
R
L
V
I
D
F
L
----
8
PsiBlast_PDB
74.72
44%
-90
- C1 -
2PUH
2
BPHD_BURXL
A:
[4-283]
------
L
T
E
S
S
T
S
K
F
V
K
I
N
E
K
G
FS
D
-
F
N
I
H
Y
N
E
A
G
--
N
G
E
T
V
I
M
L
H
G
G
G
P
G
A
G
G
W
S
N
Y
Y
R
N
V
-
G
P
F
V
D
A
G
Y
R
V
I
L
K
D
S
P
G
F
N
K
S
D
A
V
V
M
-
D
E
Q
R
G
L
V
N
A
R
A
V
K
G
L
M
D
A
L
D
I
D
R
A
H
L
V
G
N
A
M
G
G
A
T
A
L
N
F
A
L
E
Y
P
D
R
I
G
K
L
I
L
M
G
P
G
G
L
G
P
S
M
F
A
P
M
P
M
E
G
I
K
L
L
F
K
L
Y
A
E
P
S
Y
E
T
L
K
Q
M
L
Q
V
F
L
Y
D
Q
S
L
I
T
E
E
L
L
Q
G
R
W
E
A
I
-
Q
R
Q
P
E
H
L
-----------
K
N
F
L
I
S
A
Q
K
A
P
L
S
T
W
--------
D
V
T
A
R
L
GEI
K
A
K
T
F
I
T
W
G
R
D
D
R
F
V
P
L
D
H
G
L
K
L
L
W
N
I
D
D
A
R
L
H
V
F
S
K
C
G
H
W
A
Q
W
E
H
A
D
E
F
N
R
L
V
I
D
F
L
----
15
PsiBlast_PDB
74.55
43%
-93
- C1 -
3V1M
2
BPHD_BURXL
A:
[4-283]
------
L
T
E
S
S
T
S
K
F
V
K
I
N
E
K
G
FS
D
-
F
N
I
H
Y
N
E
A
G
--
N
G
E
T
V
I
M
L
H
G
G
G
P
G
A
G
G
W
S
N
Y
Y
R
N
V
-
G
P
F
V
D
A
G
Y
R
V
I
L
K
D
S
P
G
F
N
K
S
D
A
V
V
M
-
D
E
Q
R
G
L
V
N
A
R
A
V
K
G
L
M
D
A
L
D
I
D
R
A
H
L
V
G
N
A
M
G
G
A
T
A
L
N
F
A
L
E
Y
P
D
R
I
G
K
L
I
L
M
G
P
G
G
L
G
P
S
M
F
A
P
M
P
M
E
G
I
K
L
L
F
K
L
Y
A
E
P
S
Y
E
T
L
K
Q
M
L
Q
V
F
L
Y
D
Q
S
L
I
T
E
E
L
L
Q
G
R
W
E
A
I
-
Q
R
Q
P
E
H
L
-----------
K
N
F
L
I
S
A
Q
K
A
P
L
S
T
W
--------
D
V
T
A
R
L
GEI
K
A
K
T
F
I
T
W
G
R
D
D
R
F
V
P
L
D
H
G
L
K
L
L
W
N
I
D
D
A
R
L
H
V
F
S
K
C
G
Q
W
A
Q
W
E
H
A
D
E
F
N
R
L
V
I
D
F
L
----
13
PsiBlast_PDB
73.40
44%
-90
- C1 -
3V1N
3
BPHD_BURXL
A:
[4-283]
------
L
T
E
S
S
T
S
K
F
V
K
I
N
E
K
G
FS
D
-
F
N
I
H
Y
N
E
A
G
--
N
G
E
T
V
I
M
L
H
G
G
G
P
G
A
G
G
W
S
N
Y
Y
R
N
V
-
G
P
F
V
D
A
G
Y
R
V
I
L
K
D
S
P
G
F
N
K
S
D
A
V
V
M
-
D
E
Q
R
G
L
V
N
A
R
A
V
K
G
L
M
D
A
L
D
I
D
R
A
H
L
V
G
N
S
M
G
G
A
T
A
L
N
F
A
L
E
Y
P
D
R
I
G
K
L
I
L
M
G
P
G
G
L
G
P
S
M
F
A
P
M
P
M
E
G
I
K
L
L
F
K
L
Y
A
E
P
S
Y
E
T
L
K
Q
M
L
Q
V
F
L
Y
D
Q
S
L
I
T
E
E
L
L
Q
G
R
W
E
A
I
-
Q
R
Q
P
E
H
L
-----------
K
N
F
L
I
S
A
Q
K
A
P
L
S
T
W
--------
D
V
T
A
R
L
GEI
K
A
K
T
F
I
T
W
G
R
D
D
R
F
V
P
L
D
H
G
L
K
L
L
W
N
I
D
D
A
R
L
H
V
F
S
K
C
G
Q
W
A
Q
W
E
H
A
D
E
F
N
R
L
V
I
D
F
L
----
56
HHSearch
72.31
43%
-97
- C1 -
2PUJ
3
BPHD_BURXL
A:
[22-285]
------------------------
D
-
F
N
I
H
Y
N
E
A
G
--
N
G
E
T
V
I
M
L
H
G
G
G
P
G
A
G
G
W
S
N
Y
Y
R
N
V
G
P
F
V
D
A
G
-
Y
R
V
I
L
K
D
S
P
G
F
N
K
S
D
A
V
V
M
D
E
Q
R
G
L
V
N
-
A
R
A
V
K
G
L
M
D
A
L
D
I
D
R
A
H
L
V
G
N
A
M
G
G
A
T
A
L
N
F
A
L
E
Y
P
D
R
I
G
K
L
I
L
M
G
P
G
G
L
G
P
S
M
F
A
P
M
P
M
E
G
I
K
L
L
F
K
L
Y
A
E
P
S
Y
E
T
L
K
Q
M
L
Q
V
F
L
Y
D
Q
S
L
I
T
E
E
L
L
Q
G
R
W
-
E
A
I
Q
R
Q
P
E
H
L
-------
K
N
F
L
I
S
A
Q
K
A
P
L
S
T
W
D
-
V
T
--------
A
R
L
G
E
I
---
K
A
K
T
F
I
T
W
G
R
D
D
R
F
V
P
L
D
H
G
L
K
L
L
W
N
I
D
D
A
R
L
H
V
F
S
K
C
G
A
W
A
Q
W
E
H
A
D
E
F
N
R
L
V
I
D
F
L
R
H
--
35
PsiBlast_CBE
65.85
34%
-106
- C1 -
1UK7
1
?
A:
[18-270]
-----------------------------
N
Y
H
D
V
G
E
G
--
Q
P
V
I
L
I
H
G
S
G
P
G
V
S
A
Y
A
N
W
R
L
T
I
-
P
A
L
S
K
F
-
Y
R
V
I
A
P
D
M
V
G
F
G
F
T
D
R
P
E
N
-
Y
N
Y
S
K
D
S
W
V
D
H
I
I
G
I
M
D
A
L
E
I
E
K
A
H
I
V
G
N
A
F
G
G
G
L
A
I
A
T
A
L
R
Y
S
E
R
V
D
R
M
V
L
M
G
A
A
G
T
R
F
-----
D
V
T
E
G
L
N
A
V
W
G
Y
T
--
P
S
I
E
N
M
R
N
L
L
D
I
F
A
Y
D
R
S
L
V
T
D
E
L
A
R
L
R
Y
-
E
A
-
S
I
Q
P
-----------
G
F
Q
E
S
F
S
S
M
F
P
E
P
R
Q
-
R
W
I
D
A
L
ASS
D
E
D
I
K
T
L
---
P
N
E
T
L
I
I
H
G
R
E
D
Q
V
V
P
L
S
S
S
L
R
L
G
E
L
I
D
R
A
Q
L
H
V
F
G
R
C
G
H
W
T
Q
I
E
Q
T
D
R
F
N
R
L
V
V
E
F
F
----
32
PsiBlast_CBE
65.84
34%
-107
- C1 -
1UKA
1
?
A:
[18-270]
-----------------------------
N
Y
H
D
V
G
E
G
--
Q
P
V
I
L
I
H
G
S
G
P
G
V
S
A
Y
A
N
W
R
L
T
I
-
P
A
L
S
K
F
-
Y
R
V
I
A
P
D
M
V
G
F
G
F
T
D
R
P
E
N
-
Y
N
Y
S
K
D
S
W
V
D
H
I
I
G
I
M
D
A
L
E
I
E
K
A
H
I
V
G
N
A
F
G
G
G
L
A
I
A
T
A
L
R
Y
S
E
R
V
D
R
M
V
L
M
G
A
A
G
T
R
F
-----
D
V
T
E
G
L
N
A
V
W
G
Y
T
--
P
S
I
E
N
M
R
N
L
L
D
I
F
A
Y
D
R
S
L
V
T
D
E
L
A
R
L
R
Y
-
E
A
-
S
I
Q
P
-----------
G
F
Q
E
S
F
S
S
M
F
P
E
P
R
Q
-
R
W
I
D
A
L
ASS
D
E
D
I
K
T
L
---
P
N
E
T
L
I
I
H
G
R
E
D
Q
V
V
P
L
S
S
S
L
R
L
G
E
L
I
D
R
A
Q
L
H
V
F
G
R
C
G
H
W
T
Q
I
E
Q
T
D
R
F
N
R
L
V
V
E
F
F
----
36
PsiBlast_CBE
65.38
34%
-108
- C1 -
1UK6
2
?
A:
[18-270]
-----------------------------
N
Y
H
D
V
G
E
G
--
Q
P
V
I
L
I
H
G
S
G
P
G
V
S
A
Y
A
N
W
R
L
T
I
-
P
A
L
S
K
F
-
Y
R
V
I
A
P
D
M
V
G
F
G
F
T
D
R
P
E
N
-
Y
N
Y
S
K
D
S
W
V
D
H
I
I
G
I
M
D
A
L
E
I
E
K
A
H
I
V
G
N
A
F
G
G
G
L
A
I
A
T
A
L
R
Y
S
E
R
V
D
R
M
V
L
M
G
A
A
G
T
R
F
-----
D
V
T
E
G
L
N
A
V
W
G
Y
T
--
P
S
I
E
N
M
R
N
L
L
D
I
F
A
Y
D
R
S
L
V
T
D
E
L
A
R
L
R
Y
-
E
A
-
S
I
Q
P
-----------
G
F
Q
E
S
F
S
S
M
F
P
E
P
R
Q
-
R
W
I
D
A
L
ASS
D
E
D
I
K
T
L
---
P
N
E
T
L
I
I
H
G
R
E
D
Q
V
V
P
L
S
S
S
L
R
L
G
E
L
I
D
R
A
Q
L
H
V
F
G
R
C
G
H
W
T
Q
I
E
Q
T
D
R
F
N
R
L
V
V
E
F
F
----
34
PsiBlast_CBE
64.89
34%
-106
- C1 -
1UK8
2
?
A:
[18-270]
-----------------------------
N
Y
H
D
V
G
E
G
--
Q
P
V
I
L
I
H
G
S
G
P
G
V
S
A
Y
A
N
W
R
L
T
I
-
P
A
L
S
K
F
-
Y
R
V
I
A
P
D
M
V
G
F
G
F
T
D
R
P
E
N
-
Y
N
Y
S
K
D
S
W
V
D
H
I
I
G
I
M
D
A
L
E
I
E
K
A
H
I
V
G
N
A
F
G
G
G
L
A
I
A
T
A
L
R
Y
S
E
R
V
D
R
M
V
L
M
G
A
A
G
T
R
F
-----
D
V
T
E
G
L
N
A
V
W
G
Y
T
--
P
S
I
E
N
M
R
N
L
L
D
I
F
A
Y
D
R
S
L
V
T
D
E
L
A
R
L
R
Y
-
E
A
-
S
I
Q
P
-----------
G
F
Q
E
S
F
S
S
M
F
P
E
P
R
Q
-
R
W
I
D
A
L
ASS
D
E
D
I
K
T
L
---
P
N
E
T
L
I
I
H
G
R
E
D
Q
V
V
P
L
S
S
S
L
R
L
G
E
L
I
D
R
A
Q
L
H
V
F
G
R
C
G
H
W
T
Q
I
E
Q
T
D
R
F
N
R
L
V
V
E
F
F
----