@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 : Rv2121c: (2016-05-07 )
MLRVAVPNKGALSEPATEILAEAGYRRRTDSKDLTVIDPVNNVEFFFLRPKDIAIYVGSGELDFGITGRDLVCDSGAQVRERLALGFGSSSFRYAAPAGRNWTTADLAGMRIATAYPNLVRKDLATKGIEATVIRLDGAVEISVQLGVADAIADVVGSGRTLSQHDLVAFGEPLCDSEAVLIERAGTDGQDQTEARDQLVARVQGVVFGQQYLMLDYDCPRSALKKATAITPGLESPTIAPLADPDWVAIRALVPRRDVNGIMDELAAIGAKAILASDIRFCRF
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..
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
M
L
R
V
AVPNKGALSE
P
A
T
E
I
L
A
E
AGY-R---RR---T--D-SKD
L
T
V
I
D-PVNN
V
E
F
F
F
LRP
K
D
I
A
I
Y
VGSG
E
L
D
F
GITGRDLVCDS
G
---------
A
---------
Q
-
V
R
E
R
---------
L
A
----------LGFGSSS
F
---
R
Y
AAPAGRNWT-T-AD--L-AG
M
R
I
A
T
A
Y
P
N
L
V
R
K
D
L
A
TKGI
E
A
T
V
I
R
LD
G
A
V
E
I
S
V
QLG
V
A
D
A
I
A
D
V
VGSGRTLS
Q
H
D
L
V
A
FGEP-LCDS
E
A
V
L
I
E
RAGTDGQ
D
-
Q
T
E
A
R
D
Q
---
L
V
A
R
V
Q
G
V
V--FG
Q
Q
--
Y
L
M
L
DYDC
P
R
S
A
L
K
K
A
T
AITPGLESPTIAP-LA-D-P
D
W
V
A
I
R
ALVPRR
D
V
N
G
I
M
D
E
L
A
A
I
G
A
K
A
I
L
A
S
D
I
R
FCRF
1
PsiBlast_PDB
99.34
100%
-135
- C5 -
1NH8
5
HIS1_MYCTU
A:
[21-304]
M
L
R
V
A
V
P
N
K
G
A
L
S
E
P
A
T
E
I
L
A
E
A
G
Y
-
R
---
R
R
---
T
--
D
-
S
K
D
L
T
V
I
D
-
P
V
N
N
V
E
F
F
F
L
R
P
K
D
I
A
I
Y
V
G
S
G
E
L
D
F
G
I
T
G
R
D
L
V
C
D
S
G
---------
A
---------
Q
-
V
R
E
R
---------
L
A
----------
L
G
F
G
S
S
S
F
---
R
Y
A
A
P
A
G
R
N
W
T
-
T
-
A
D
--
L
-
A
G
M
R
I
A
T
A
Y
P
N
L
V
R
K
D
L
A
T
K
G
I
E
A
T
V
I
R
L
D
G
A
V
E
I
S
V
Q
L
G
V
A
D
A
I
A
D
V
V
G
S
G
R
T
L
S
Q
H
D
L
V
A
F
G
E
P
-
L
C
D
S
E
A
V
L
I
E
R
A
---------
E
A
R
D
Q
---
L
V
A
R
V
Q
G
V
V
--
F
G
Q
Q
--
Y
L
M
L
D
Y
D
C
P
R
S
A
L
K
K
A
T
A
I
T
P
G
L
E
S
P
T
I
A
P
-
L
A
-
D
-
P
D
W
V
A
I
R
A
L
V
P
R
R
D
V
N
G
I
M
D
E
L
A
A
I
G
A
K
A
I
L
A
S
D
I
R
F
C
R
F
20
HHSearch
99.11
100%
-136
- C5 -
1NH8
5
HIS1_MYCTU
A:
[21-304]
M
L
R
V
A
V
P
N
K
G
A
L
S
E
P
A
T
E
I
L
A
E
A
G
Y
-
R
---
R
R
---
T
--
D
-
S
K
D
L
T
V
I
D
-
P
V
N
N
V
E
F
F
F
L
R
P
K
D
I
A
I
Y
V
G
S
G
E
L
D
F
G
I
T
G
R
D
L
V
C
D
S
G
---------
A
---------
Q
-
V
R
E
R
---------
L
A
----------
L
G
F
G
S
S
S
F
---
R
Y
A
A
P
A
G
R
N
W
T
-
T
-
A
D
--
L
-
A
G
M
R
I
A
T
A
Y
P
N
L
V
R
K
D
L
A
T
K
G
I
E
A
T
V
I
R
L
D
G
A
V
E
I
S
V
Q
L
G
V
A
D
A
I
A
D
V
V
G
S
G
R
T
L
S
Q
H
D
L
V
A
F
G
-
E
P
L
C
D
S
E
A
V
L
I
E
R
A
---------
E
A
R
D
Q
---
L
V
A
R
V
Q
G
V
V
--
F
G
Q
Q
--
Y
L
M
L
D
Y
D
C
P
R
S
A
L
K
K
A
T
A
I
T
P
G
L
E
S
P
T
I
A
P
-
L
A
-
D
-
P
D
W
V
A
I
R
A
L
V
P
R
R
D
V
N
G
I
M
D
E
L
A
A
I
G
A
K
A
I
L
A
S
D
I
R
F
C
R
F
41
Fugue
98.93
99%
-134
- C5 -
1NH8
5
HIS1_MYCTU
A:
[21-304]
M
L
R
V
A
V
P
N
K
G
A
L
S
E
P
A
T
E
I
L
A
E
A
G
Y
-
R
---
R
R
---
T
--
D
-
S
K
D
L
T
V
I
D
-
P
V
N
N
V
E
F
F
F
L
R
P
K
D
I
A
I
Y
V
G
S
G
E
L
D
F
G
I
T
G
R
D
L
V
C
D
S
G
---------
A
---------
Q
-
V
R
E
R
---------
L
A
----------
L
G
F
G
S
S
S
F
---
R
Y
A
A
P
A
G
R
N
W
T
-
T
-
A
D
--
L
-
A
G
M
R
I
A
T
A
Y
P
N
L
V
R
K
D
L
A
T
K
G
I
E
A
T
V
I
R
L
D
G
A
V
E
I
S
V
Q
L
G
V
A
D
A
I
A
D
V
V
G
S
G
R
T
L
S
Q
H
D
L
V
A
F
G
E
P
-
L
C
D
S
E
A
V
L
I
E
R
---------
A
E
A
R
D
Q
---
L
V
A
R
V
Q
G
V
V
--
F
G
Q
Q
--
Y
L
M
L
D
Y
D
C
P
R
S
A
L
K
K
A
T
A
I
T
P
G
L
E
S
P
T
I
A
P
-
L
A
-
D
-
P
D
W
V
A
I
R
A
L
V
P
R
R
D
V
N
G
I
M
D
E
L
A
A
I
G
A
K
A
I
L
A
S
D
I
R
F
C
R
F
27
HHSearch
76.92
30%
-115
- C5 -
2VD3
15
HIS1_METTH
A:
[4-289]
K
I
R
I
A
V
P
S
K
G
R
I
S
E
P
A
I
R
L
L
E
N
A
G
V
-
G
---
L
K
---
D
--
T
V
N
R
K
L
F
S
K
T
-
Q
H
P
Q
I
E
V
M
F
S
R
A
A
D
I
P
E
F
V
A
D
G
A
A
D
L
G
I
T
G
Y
D
L
I
V
E
R
G
---------
S
---------
D
-
V
E
I
L
---------
E
D
----------
L
K
Y
G
R
A
S
L
---
V
L
A
A
P
E
D
S
T
I
R
G
P
-
E
D
--
I
P
R
G
A
V
I
A
T
E
F
P
G
I
T
E
N
Y
L
R
E
H
G
I
D
A
E
V
V
E
L
T
G
S
T
E
I
A
P
F
I
G
V
A
D
L
I
T
D
L
S
S
T
G
T
T
L
R
M
N
H
L
R
V
I
D
-
T
-
I
L
E
S
S
V
K
L
I
A
N
R
E
S
Y
A
-
T
-
K
S
G
I
I
E
E
---
L
R
T
G
I
R
G
V
I
--
D
A
E
G
--
K
R
L
V
M
L
N
I
D
R
K
N
L
D
R
V
R
A
L
M
P
G
M
T
G
P
T
V
S
E
-
V
L
-
S
D
N
G
V
V
A
V
H
A
V
V
D
E
K
E
V
F
N
L
I
N
R
L
K
A
V
G
A
R
D
I
L
V
V
P
I
E
R
I
I
P
4
PsiBlast_PDB
75.97
32%
-106
- C5 -
2VD3
15
HIS1_METTH
A:
[5-284]
-
I
R
I
A
V
P
S
K
G
R
I
S
E
P
A
I
R
L
L
E
N
A
G
V
G
L
---
K
D
---
T
--
V
-
N
R
K
L
F
S
K
T
-
Q
H
P
Q
I
E
V
M
F
S
R
A
A
D
I
P
E
F
V
A
D
G
A
A
D
L
G
I
T
G
Y
D
L
I
V
E
R
G
---------
S
---------
D
-
V
E
I
L
---------
E
D
----------
L
K
Y
G
R
A
S
L
---
V
L
A
A
P
E
D
S
T
I
R
-
G
-
P
E
DI
P
-
R
G
A
V
I
A
T
E
F
P
G
I
T
E
N
Y
L
R
E
H
G
I
D
A
E
V
V
E
L
T
G
S
T
E
I
A
P
F
I
G
V
A
D
L
I
T
D
L
S
S
T
G
T
T
L
R
M
N
H
L
R
V
I
D
T
I
-
L
E
S
S
V
K
L
I
A
N
R
E
S
Y
--
A
T
-
K
S
G
I
I
E
E
---
L
R
T
G
I
R
G
V
I
D
A
E
G
K
R
--
L
V
M
L
N
I
D
--
R
K
N
L
D
R
V
R
A
L
M
P
G
M
T
G
P
T
V
S
E
V
L
S
-
D
-
N
G
V
V
A
V
H
A
V
V
D
E
K
E
V
F
N
L
I
N
R
L
K
A
V
G
A
R
D
I
L
V
V
P
I
-----
25
HHSearch
75.37
29%
-116
- C5 -
4YB6
5
?
A:
[7-299]
R
L
R
I
A
I
Q
K
S
G
R
L
S
K
E
S
I
E
L
L
S
E
C
G
V
-
K
---
M
H
---
I
--
H
-
E
Q
S
L
I
A
F
S
-
T
N
L
P
I
D
I
L
R
V
R
D
D
D
I
P
G
L
I
F
D
G
V
V
D
L
G
I
I
G
E
N
V
L
E
E
N
E
L
E
R
Q
S
L
G
E
N
P
---------
S
-
Y
K
L
L
---------
K
K
----------
L
D
F
G
Y
C
R
L
---
S
L
A
L
P
Q
E
N
K
F
Q
N
L
-
K
D
--
F
-
E
G
L
R
I
A
T
S
Y
P
Q
L
L
K
R
F
M
K
E
N
G
I
N
Y
K
N
C
T
L
T
G
S
V
E
V
A
P
R
A
N
L
A
D
A
I
C
D
L
V
S
S
G
A
T
L
Q
A
N
N
L
K
E
V
K
-
V
-
I
Y
E
S
R
A
C
L
I
Q
K
E
N
A
L
S
-
K
E
K
Q
A
L
V
D
K
I
M
L
R
V
A
G
V
---
M
--
Q
A
R
E
--
S
K
Y
I
M
L
H
A
P
K
E
K
L
D
K
I
Q
A
L
L
P
G
V
E
R
P
T
I
L
P
-
L
A
-
H
D
E
K
N
V
A
L
H
M
V
S
K
E
N
L
F
W
E
T
M
E
A
L
K
E
E
G
A
S
S
I
L
V
L
P
I
E
K
M
L
-
19
PsiBlast_CBE
74.99
32%
-104
- C5 -
2VD3
12
HIS1_METTH
B:
[5-284]
-
I
R
I
A
V
P
S
K
G
R
I
S
E
P
A
I
R
L
L
E
N
A
G
V
G
L
---
K
D
---
T
--
V
--
R
K
L
F
S
K
T
-
Q
H
P
Q
I
E
V
M
F
S
R
A
A
D
I
P
E
F
V
A
D
G
A
A
D
L
G
I
T
G
Y
D
L
I
V
E
R
G
---------
S
---------
D
-
V
E
I
L
---------
E
D
----------
L
K
Y
G
R
A
S
L
---
V
L
A
A
P
E
D
S
T
I
R
-
G
-
P
E
DI
P
-
R
G
A
V
I
A
T
E
F
P
G
I
T
E
N
Y
L
R
E
H
G
I
D
A
E
V
V
E
L
T
G
S
T
E
I
A
P
F
I
G
V
A
D
L
I
T
D
L
S
S
T
G
T
T
L
R
M
N
H
L
R
V
I
D
T
I
-
L
E
S
S
V
K
L
I
A
N
R
E
S
Y
--
A
T
-
K
S
G
I
I
E
E
---
L
R
T
G
I
R
G
V
I
D
A
E
G
K
R
--
L
V
M
L
N
I
D
--
R
K
N
L
D
R
V
R
A
L
M
P
G
M
T
G
P
T
V
S
E
V
L
S
-
D
-
N
G
V
V
A
V
H
A
V
V
D
E
K
E
V
F
N
L
I
N
R
L
K
A
V
G
A
R
D
I
L
V
V
P
I
-----
6
PsiBlast_PDB
74.87
29%
-107
- C5 -
4YB6
5
?
A:
[8-291]
-
L
R
I
A
I
Q
K
S
G
R
L
S
K
E
S
I
E
L
L
S
E
C
G
V
-
K
---
M
H
---
I
--
H
-
E
Q
S
L
I
A
F
S
-
T
N
L
P
I
D
I
L
R
V
R
D
D
D
I
P
G
L
I
F
D
G
V
V
D
L
G
I
I
G
E
N
V
L
-
E
E
N
---------
E
---------
L
-
E
R
Q
S
---------
L
G
E
N
P
S
Y
K
L
LKK
L
D
F
G
Y
C
R
L
---
S
L
A
L
P
Q
E
N
K
F
Q
-
N
L
K
D
--
F
-
E
G
L
R
I
A
T
S
Y
P
Q
L
L
K
R
F
M
K
E
N
G
I
N
Y
K
N
C
T
L
T
G
S
V
E
V
A
P
R
A
N
L
A
D
A
I
C
D
L
V
S
S
G
A
T
L
Q
A
N
N
L
K
E
V
-
K
V
-
I
Y
E
S
R
A
C
L
I
Q
K
E
N
A
L
S
K
E
-
K
Q
A
L
V
D
K
---
I
M
L
R
V
A
G
V
M
--
Q
A
R
E
S
K
Y
I
M
L
--
H
A
P
K
E
K
L
D
K
I
Q
A
L
L
P
G
V
E
R
P
T
I
L
P
-
L
A
H
D
-
E
K
N
V
A
L
H
M
V
S
K
E
N
L
F
W
E
T
M
E
A
L
K
E
E
G
A
S
S
I
L
---------
26
HHSearch
74.12
31%
-104
- C5 -
1H3D
3
HIS1_ECOLI
A:
[6-299]
R
L
R
I
A
M
Q
K
S
G
R
L
S
D
D
S
R
E
L
L
A
R
C
G
I
-
K
---
I
N
---
L
--
H
-
T
Q
R
L
I
A
M
A
-
E
N
M
P
I
D
I
L
R
V
R
D
D
D
I
P
G
L
V
M
D
G
V
V
D
L
G
I
I
G
E
N
V
L
E
E
E
L
---------
L
N
R
R
A
Q
G
E
D
P
R
-
Y
F
T
L
---------
R
R
----------
L
D
F
G
G
C
R
L
---
S
L
A
T
P
V
D
E
A
W
D
G
P
-
L
S
--
L
-
N
G
K
R
I
A
T
S
Y
P
H
L
L
K
R
Y
L
D
Q
K
G
I
S
F
K
S
C
L
L
N
G
S
V
E
V
A
P
R
A
G
L
A
D
A
I
C
D
L
V
S
T
G
A
T
L
E
A
N
G
L
R
E
V
E
-
V
-
I
Y
R
S
K
A
C
L
I
Q
R
D
G
E
M
E
E
S
-
K
Q
Q
L
I
D
K
---
L
L
T
R
I
Q
G
V
I
--
Q
A
R
E
--
S
K
Y
I
M
M
H
A
P
T
E
R
L
D
E
V
I
A
L
L
P
G
A
E
R
P
T
I
L
P
-
L
A
--------
M
H
M
V
S
S
E
T
L
F
W
E
T
M
E
K
L
K
A
L
G
A
S
S
I
L
V
L
P
I
E
K
M
M
E
5
PsiBlast_PDB
74.03
29%
-106
- C5 -
4YB5
6
?
A:
[8-291]
-
L
R
I
A
I
Q
K
S
G
R
L
S
K
E
S
I
E
L
L
S
E
C
G
V
-
K
---
M
H
---
I
--
H
-
E
Q
S
L
I
A
F
S
-
T
N
L
P
I
D
I
L
R
V
R
D
D
D
I
P
G
L
I
F
D
G
V
V
D
L
G
I
I
G
E
N
V
L
-
E
E
N
---------
E
---------
L
-
E
R
Q
S
---------
L
G
E
N
P
S
Y
K
L
LKK
L
D
F
G
Y
C
R
L
---
S
L
A
L
P
Q
----
Q
-
N
L
K
D
--
F
-
E
G
L
R
I
A
T
S
Y
P
Q
L
L
K
R
F
M
K
E
N
G
I
N
Y
K
N
C
T
L
T
G
S
V
E
V
A
P
R
A
N
L
A
D
A
I
C
D
L
V
S
S
G
A
T
L
Q
A
N
N
L
K
E
V
-
K
V
-
I
Y
E
S
R
A
C
L
I
Q
K
E
N
A
L
S
K
E
-
K
Q
A
L
V
D
K
---
I
M
L
R
V
A
G
V
M
--
Q
A
R
E
S
K
Y
I
M
L
--
H
A
P
K
E
K
L
D
K
I
Q
A
L
L
P
G
V
E
R
P
T
I
L
P
-
L
A
H
D
-
E
K
N
V
A
L
H
M
V
S
K
E
N
L
F
W
E
T
M
E
A
L
K
E
E
G
A
S
S
I
L
---------
7
PsiBlast_PDB
73.01
29%
-104
- C5 -
4YB7
3
?
B:
[8-291]
-
L
R
I
A
I
Q
K
S
G
R
L
S
K
E
S
I
E
L
L
S
E
C
G
V
-
K
---
M
H
---
I
--
H
-
E
Q
S
L
I
A
F
S
-
T
N
L
P
I
D
I
L
R
V
R
D
D
D
I
P
G
L
I
F
D
G
V
V
D
L
G
I
I
G
E
N
V
L
-
E
E
N
---------
E
---------
L
-
E
R
Q
S
---------
L
G
E
N
P
S
Y
K
LLKK
L
D
F
G
Y
C
R
L
---
S
L
A
L
P
Q
E
N
K
F
Q
-
N
L
K
D
--
F
-
E
G
L
R
I
A
T
S
Y
P
Q
L
L
K
R
F
M
K
E
N
G
I
N
Y
K
N
C
T
L
T
G
S
V
E
V
A
P
R
A
N
L
A
D
A
I
C
D
L
V
S
S
G
A
T
L
Q
A
N
N
L
K
E
V
-
K
V
-
I
Y
E
S
R
A
C
L
I
Q
K
E
N
A
L
S
K
E
-
K
Q
A
L
V
D
K
---
I
M
L
R
V
A
G
V
M
--
Q
A
R
E
S
K
Y
I
M
L
--
H
A
P
K
E
K
L
D
K
I
Q
A
L
L
P
G
V
E
R
P
T
I
L
P
-
L
A
H
D
-
E
K
N
V
A
L
H
M
V
S
K
E
N
L
F
W
E
T
M
E
A
L
K
E
E
G
A
S
S
I
L
---------
2
PsiBlast_PDB
71.93
31%
-101
- C5 -
1H3D
3
HIS1_ECOLI
A:
[7-290]
-
L
R
I
A
M
Q
K
S
G
R
L
S
D
D
S
R
E
L
L
A
R
C
G
I
-
K
---
I
N
---
L
--
H
-
T
Q
R
L
I
A
M
A
-
E
N
M
P
I
D
I
L
R
V
R
D
D
D
I
P
G
L
V
M
D
G
V
V
D
L
G
I
I
G
E
N
V
L
E
E
E
L
---------
L
---------
N
-
R
R
A
Q
G
E
D
P
R
Y
F
TL
R
R
----------
L
D
F
G
G
C
R
L
---
S
L
A
T
P
V
D
E
A
W
D
G
P
-
L
S
--
L
-
N
G
K
R
I
A
T
S
Y
P
H
L
L
K
R
Y
L
D
Q
K
G
I
S
F
K
S
C
L
L
N
G
S
V
E
V
A
P
R
A
G
L
A
D
A
I
C
D
L
V
S
T
G
A
T
L
E
A
N
G
L
R
E
V
-
E
V
-
I
Y
R
S
K
A
C
L
I
Q
R
D
G
E
M
E
E
S
-
K
Q
Q
L
I
D
K
---
L
L
T
R
I
Q
G
V
I
--
Q
A
R
E
--
S
K
Y
I
M
M
H
A
P
T
E
R
L
D
E
V
I
A
L
L
P
G
A
E
R
P
T
I
L
P
-
L
A
--------
M
H
M
V
S
S
E
T
L
F
W
E
T
M
E
K
L
K
A
L
G
A
S
S
I
L
---------
3
PsiBlast_PDB
71.33
31%
-103
- C5 -
1Q1K
3
HIS1_ECOLI
A:
[7-290]
-
L
R
I
A
M
Q
K
S
G
R
L
S
D
D
S
R
E
L
L
A
R
C
G
I
-
K
---
I
N
---
L
--
H
-
T
Q
R
L
I
A
M
A
-
E
N
M
P
I
D
I
L
R
V
R
D
D
D
I
P
G
L
V
M
D
G
V
V
D
L
G
I
I
G
E
N
V
L
E
E
E
L
---------
L
---------
N
-
R
R
A
Q
GED
P
R
Y
F
TL
R
R
----------
L
D
F
G
G
C
R
L
---
S
L
A
T
P
V
D
E
A
W
D
G
P
-
L
S
--
L
-
N
G
K
R
I
A
T
S
Y
P
H
L
L
K
R
Y
L
D
Q
K
G
I
S
F
K
S
C
L
L
N
G
S
V
E
V
A
P
R
A
G
L
A
D
A
I
C
D
L
V
S
T
G
A
T
L
E
A
N
G
L
R
E
V
-
E
V
-
I
Y
R
S
K
A
C
L
I
Q
R
D
G
E
M
E
E
S
-
K
Q
Q
L
I
D
K
---
L
L
T
R
I
Q
G
V
I
--
Q
A
R
E
--
S
K
Y
I
M
M
H
A
P
T
E
R
L
D
E
V
I
A
L
L
P
G
A
E
R
P
T
I
L
P
-
L
A
--------
M
H
M
V
S
S
E
T
L
F
W
E
T
M
E
K
L
K
A
L
G
A
S
S
I
L
---------
21
HHSearch
65.05
31%
-95
- C5 -
2VD2
-
HIS1_BACSU
A:
[4-211]
L
L
T
M
A
M
P
K
-
G
R
I
F
E
E
A
A
G
L
L
R
Q
A
G
Y
-
R
---
L
P
---
E
EF
E
D
S
R
K
L
I
I
D
V
-
P
E
E
N
L
R
F
I
L
A
K
P
M
D
V
T
T
Y
V
E
H
G
V
A
D
V
G
I
A
G
K
D
V
M
L
E
E
E
---------
R
---------
D
-
V
Y
E
V
---------
L
D
----------
L
N
I
S
K
C
H
L
---
A
V
A
G
L
P
N
T
D
W
S
----
G
----
V
A
P
R
I
A
T
K
Y
P
N
V
A
S
S
Y
F
R
E
Q
G
E
Q
V
E
I
I
K
L
N
G
S
I
E
L
A
P
L
I
G
L
A
D
R
I
V
D
I
V
S
T
G
Q
T
L
K
E
N
G
L
V
E
T
E
-
H
-
I
C
D
I
T
S
R
F
I
V
N
P
V
S
Y
R
-
M
-
K
D
D
V
I
D
E
---
M
A
S
R
L
S
L
V
V
--
E
G
E
T
------------------------------------------------------------------------------
8
PsiBlast_PDB
64.24
30%
-91
- C5 -
2VD2
-
HIS1_BACSU
A:
[4-210]
L
L
T
M
A
M
P
-
K
G
R
I
F
E
E
A
A
G
L
L
R
Q
A
G
Y
-
R
LPE
E
F
---
E
--
D
-
S
R
K
L
I
I
D
V
-
P
E
E
N
L
R
F
I
L
A
K
P
M
D
V
T
T
Y
V
E
H
G
V
A
D
V
G
I
A
G
K
D
V
M
L
E
E
E
---------
R
---------
D
-
V
Y
E
V
---------
L
D
----------
L
N
I
S
K
C
H
L
---
A
V
A
G
L
P
N
T
D
W
S
-
G
-
V
------
A
P
R
I
A
T
K
Y
P
N
V
A
S
S
Y
F
R
E
Q
G
E
Q
V
E
I
I
K
L
N
G
S
I
E
L
A
P
L
I
G
L
A
D
R
I
V
D
I
V
S
T
G
Q
T
L
K
E
N
G
L
V
E
-
T
E
H
-
I
C
D
I
T
S
R
F
I
V
N
P
-
V
S
Y
R
M
-
K
D
D
V
I
D
E
---
M
A
S
R
L
S
L
V
V
--
E
G
E
-------------------------------------------------------------------------------
24
HHSearch
60.34
32%
-106
- C5 -
1VE4
1
HIS1_THET2
A:
[5-204]
A
L
T
V
A
L
P
K
-
G
R
M
F
R
E
A
Y
E
V
L
K
R
A
G
L
-
D
---
L
P
---
E
--
V
----
L
L
H
G
--
K
E
G
G
V
A
L
L
E
L
R
N
K
D
V
P
I
Y
V
D
L
G
I
A
E
I
G
V
V
G
K
D
V
L
L
D
S
G
---------
R
---------
D
-
L
F
E
P
---------
V
D
----------
L
G
F
G
A
C
R
L
---
S
L
I
R
R
P
G
D
T
---------
G
-
P
I
R
R
V
A
T
K
Y
P
N
F
T
A
R
L
L
K
E
R
G
W
A
A
D
V
V
E
L
S
G
N
I
E
L
A
A
V
T
G
L
A
D
A
V
V
D
V
V
Q
T
G
A
T
L
R
A
A
G
L
V
E
V
E
-
V
-
L
A
H
S
T
A
R
L
V
V
N
R
Q
A
L
K
-
L
-
K
R
A
V
L
K
P
---
L
I
Q
R
L
R
E
L
S
------------------------------------------------------------------------------------
9
PsiBlast_PDB
54.93
34%
-108
- C5 -
1VE4
1
HIS1_THET2
A:
[6-180]
-
L
T
V
A
L
P
-
K
G
R
M
F
R
E
A
Y
E
V
L
K
R
A
G
L
-
D
---
L
P
---
E
--
V
------
L
L
H
G
K
E
G
G
V
A
L
L
E
L
R
N
K
D
V
P
I
Y
V
D
L
G
I
A
E
I
G
V
V
G
K
D
V
L
L
D
S
G
---------
R
---------
D
-
L
F
E
P
---------
V
D
----------
L
G
F
G
A
C
R
L
---
S
L
I
R
R
P
G
D
T
G
P
-
I
---------
R
R
V
A
T
K
Y
P
N
F
T
A
R
L
L
K
E
R
G
W
A
A
D
V
V
E
L
S
G
N
I
E
L
A
A
V
T
G
L
A
D
A
V
V
D
V
V
Q
T
G
A
T
L
R
A
A
G
L
V
E
V
-
E
V
-
L
A
H
S
T
A
R
L
V
-----------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
54.87
28%
-97
- C5 -
1USY
3
HIS1_THEMA
E:
[1-165]
M
L
K
L
A
I
P
-
K
G
R
L
E
E
K
V
M
T
Y
L
K
K
T
G
V
-
I
---
F
E
---
R
--
E
-
S
---
S
I
L
R
-
E
G
K
D
I
V
C
F
M
V
R
P
F
D
V
P
T
Y
L
V
H
G
V
A
D
I
G
F
C
G
T
D
V
L
L
E
K
E
---------
T
---------
S
-
L
I
Q
P
---------
F
F
----------
I
P
T
N
I
S
R
M
---
V
L
A
G
P
K
G
R
G
I
P
-
E
-
G
E
------
K
R
I
A
T
K
F
P
N
V
T
Q
R
Y
C
E
S
K
G
W
H
C
R
I
I
P
L
K
G
S
V
E
L
A
P
I
A
G
L
S
D
L
I
V
D
I
T
E
T
G
R
T
L
K
E
N
N
L
E
I
L
D
E
----------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
53.73
28%
-95
- C5 -
1O64
2
HIS1_THEMA
A:
[3-161]
-
L
K
L
A
I
P
-
K
G
R
L
E
E
K
V
M
T
Y
L
K
K
T
G
V
-
I
---
F
E
---
R
--
E
-
S
---
S
I
L
R
-
E
G
K
D
I
V
C
F
M
V
R
P
F
D
V
P
T
Y
L
V
H
G
V
A
D
I
G
F
C
G
T
D
V
L
L
E
K
E
---------
T
---------
S
-
L
I
Q
P
---------
F
F
----------
I
P
T
N
I
S
R
M
---
V
L
A
G
P
K
G
R
G
I
P
-
E
-
G
E
------
K
R
I
A
T
K
F
P
N
V
T
Q
R
Y
C
E
S
K
G
W
H
C
R
I
I
P
L
K
G
S
V
E
L
A
P
I
A
G
L
S
D
L
I
V
D
I
T
E
T
G
R
T
L
K
E
N
N
L
---------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
48.03
28%
-96
- C5 -
1Z7N
1
HIS1_LACLA
E:
[1-168]
M
I
K
I
A
I
-
T
K
G
R
I
Q
K
Q
V
T
K
L
L
E
N
A
D
Y
-
D
---
V
E
PIL---
L
-
G
R
E
L
Q
-
I
K
-
T
K
D
D
L
Q
I
I
F
G
K
P
N
D
V
I
T
F
L
E
H
G
I
V
D
I
G
F
V
G
K
D
T
L
D
E
N
D
---------
F
---------
D
D
Y
Y
E
L
---------
L
Y
----------
L
K
I
G
Q
C
I
F
A
L
A
S
Y
P
D
F
S
N
K
N
F
Q
-
R
-
H
K
-------
R
I
A
S
K
Y
P
R
V
T
K
K
Y
F
A
Q
K
Q
E
D
I
E
I
I
K
L
E
G
S
V
E
L
G
P
V
V
G
L
A
D
A
I
V
D
I
V
E
T
G
N
T
L
S
A
N
G
L
---------------------------------------------------------------------------------------------------------------------------------