@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 : Rv0484c: (2016-04-23 )
MTTIGTRKRVAVVTGASSGIGEATARTLAAQGFHVVAVARRADRITALANQIGGTAIVADVTDDAAVEALARALSRVDVLVNNAGGAKGLQFVADADLEHWRWMWDTNVLGTLRVTRALLPKLIDSGDGLIVTVTSIAAIEVYDGGAGYTAAKHAQGALHRTLRGELLGKPVRLTEIAPGAVETEFSLVRFDGDQQRADAVYAGMTPLVAADVAEVIGFVATRPSHVNLDQIVIRPRDQASASRRATHPVR
Atome Classification :
(27 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
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MTTIGTR
K
R
V
A
V
V
TGASSGI
G
E
A
T
A
R
T
L
--
A
AQ
G
-
F
H
V
V
A
V
---
A
RR
A
D
R
I
-
T
A
L
A
N
QI---G-----G
T
A
-----
I
--
V
--
A
-------DVT
D
----
D
A
A
V
E
A
L
A
----
R
A
----
L
----
S
R
-------
V
D
V
LVNNAGGAKG
L
Q
F
V
ADADLE
H
---
W
R
W
M
WDTNV
L
G
T
L
R
V
T
R
A
L
L
P
K
L
IDSG--D
G
L
I
V
T
V
T
S
I
A
A
I
E
V
YDGGAG--Y
T
A
A
K
H
A
Q
G
A
L
H
R
T
L
R
G
E
L--LGKP
V
R
L
T
EIAPGAV-
E
T
E
F
-
S
-
L
V
R
FDGDQ
Q
R
A
D
A
V
YAGM
T
P
----
L
V
A
A
D
V
A
E
V
I
G
F
V
ATRPSHVNLD
Q
I
V
I
RPRDQASASRRATHPVR
24
PsiBlast_CBE
89.83
37%
-95
- C1 -
3ASV
2
?
C:
[2-241]
---------
I
V
L
V
T
G
A
T
A
G
F
G
E
C
I
T
R
R
F
--
I
Q
Q
G
-
H
K
V
I
A
T
---
G
R
R
Q
E
R
L
-
Q
E
L
K
D
E
L
---
G
-----
D
N
L
-----
Y
--
I
--
A
QL-----
D
V
R
N
----
R
A
A
I
E
E
M
L
----
A
S
----
L
PAEW
C
N
-------
I
D
I
L
V
N
N
A
G
L
A
L
G
M
E
P
A
H
K
A
S
V
E
D
---
W
E
T
M
I
D
T
N
N
K
G
L
V
Y
M
T
R
A
V
L
P
G
M
V
E
R
N
--
H
G
H
I
I
N
I
G
S
T
A
G
S
W
P
Y
A
G
G
N
V
--
Y
G
A
T
K
A
F
V
R
Q
F
S
L
N
L
R
T
D
L
--
H
G
T
A
V
R
V
T
D
I
E
P
G
L
V
G
G
T
E
F
-
S
-
N
V
R
F
K
G
D
D
G
K
A
E
K
T
Y
Q
N
T
V
A
----
L
T
P
E
D
V
S
E
A
V
W
W
V
S
T
L
P
A
H
V
N
I
N
T
L
E
M
M
P
V
T
Q
S
Y
A
---------
22
PsiBlast_CBE
89.73
37%
-92
- C1 -
3ASV
2
?
E:
[2-241]
---------
I
V
L
V
T
G
A
T
A
G
F
G
E
C
I
T
R
R
F
--
I
Q
Q
G
-
H
K
V
I
A
T
---
G
R
R
Q
E
R
L
-
Q
E
L
K
D
E
L
---
G
-----
D
N
L
-----
Y
--
I
--
A
QL-----
D
V
R
N
----
R
A
A
I
E
E
M
L
----
A
S
----
L
PAEW
C
N
-------
I
D
I
L
V
N
N
A
G
L
A
L
G
M
E
P
A
H
K
A
S
V
E
D
---
W
E
T
M
I
D
T
N
N
K
G
L
V
Y
M
T
R
A
V
L
P
G
M
V
E
R
N
--
H
G
H
I
I
N
I
G
S
T
A
G
S
W
P
Y
A
G
G
N
V
--
Y
G
A
T
K
A
F
V
R
Q
F
S
L
N
L
R
T
D
L
--
H
G
T
A
V
R
V
T
D
I
E
P
G
L
V
G
G
T
E
F
-
S
-
N
V
R
F
K
G
D
D
G
K
A
E
K
T
Y
Q
N
T
V
A
----
L
T
P
E
D
V
S
E
A
V
W
W
V
S
T
L
P
A
H
V
N
I
N
T
L
E
M
M
P
V
T
Q
S
Y
A
---------
21
PsiBlast_CBE
89.54
37%
-93
- C1 -
3ASV
2
?
F:
[2-241]
---------
I
V
L
V
T
G
A
T
A
G
F
G
E
C
I
T
R
R
F
--
I
Q
Q
G
-
H
K
V
I
A
T
---
G
R
R
Q
E
R
L
-
Q
E
L
K
D
E
L
---
G
-----
D
N
L
-----
Y
--
I
--
A
QL-----
D
V
R
N
----
R
A
A
I
E
E
M
L
----
A
S
----
L
PAEW
C
N
-------
I
D
I
L
V
N
N
A
G
L
A
L
G
M
E
P
A
H
K
A
S
V
E
D
---
W
E
T
M
I
D
T
N
N
K
G
L
V
Y
M
T
R
A
V
L
P
G
M
V
E
R
N
--
H
G
H
I
I
N
I
G
S
T
A
G
S
W
P
Y
A
G
G
N
V
--
Y
G
A
T
K
A
F
V
R
Q
F
S
L
N
L
R
T
D
L
--
H
G
T
A
V
R
V
T
D
I
E
P
G
L
V
G
G
T
E
F
-
S
-
N
V
R
F
K
G
D
D
G
K
A
E
K
T
Y
Q
N
T
V
A
----
L
T
P
E
D
V
S
E
A
V
W
W
V
S
T
L
P
A
H
V
N
I
N
T
L
E
M
M
P
V
T
Q
S
Y
A
---------
3
PsiBlast_PDB
89.25
37%
-94
- C1 -
3ASV
2
?
A:
[2-241]
---------
I
V
L
V
T
G
A
T
A
G
F
G
E
C
I
T
R
R
F
--
I
Q
Q
G
-
H
K
V
I
A
T
---
G
R
R
Q
E
R
L
-
Q
E
L
K
D
E
L
---
G
-----
D
N
L
-----
Y
--
I
--
A
Q
L
-----
D
V
R
N
----
R
A
A
I
E
E
M
L
----
A
S
----
L
PAEW
C
N
-------
I
D
I
L
V
N
N
A
G
L
A
L
G
M
E
P
A
H
K
A
S
V
E
D
---
W
E
T
M
I
D
T
N
N
K
G
L
V
Y
M
T
R
A
V
L
P
G
M
V
E
R
N
--
H
G
H
I
I
N
I
G
S
T
A
G
S
W
P
Y
A
G
G
N
V
--
Y
G
A
T
K
A
F
V
R
Q
F
S
L
N
L
R
T
D
L
--
H
G
T
A
V
R
V
T
D
I
E
P
G
L
V
G
G
T
E
F
-
S
-
N
V
R
F
K
G
D
D
G
K
A
E
K
T
Y
Q
N
T
V
A
----
L
T
P
E
D
V
S
E
A
V
W
W
V
S
T
L
P
A
H
V
N
I
N
T
L
E
M
M
P
V
T
Q
S
Y
A
---------
25
PsiBlast_CBE
89.16
37%
-94
- C1 -
3ASV
2
?
B:
[2-241]
---------
I
V
L
V
T
G
A
T
A
G
F
G
E
C
I
T
R
R
F
--
I
Q
Q
G
-
H
K
V
I
A
T
---
G
R
R
Q
E
R
L
-
Q
E
L
K
D
E
L
---
G
-----
D
N
L
-----
Y
--
I
--
A
QL-----
D
V
R
N
----
R
A
A
I
E
E
M
L
----
A
S
----
L
PAEW
C
N
-------
I
D
I
L
V
N
N
A
G
L
A
L
G
M
E
P
A
H
K
A
S
V
E
D
---
W
E
T
M
I
D
T
N
N
K
G
L
V
Y
M
T
R
A
V
L
P
G
M
V
E
R
N
--
H
G
H
I
I
N
I
G
S
T
A
G
S
W
P
Y
A
G
G
N
V
--
Y
G
A
T
K
A
F
V
R
Q
F
S
L
N
L
R
T
D
L
--
H
G
T
A
V
R
V
T
D
I
E
P
G
L
V
G
G
T
E
F
-
S
-
N
V
R
F
K
G
D
D
G
K
A
E
K
T
Y
Q
N
T
V
A
----
L
T
P
E
D
V
S
E
A
V
W
W
V
S
T
L
P
A
H
V
N
I
N
T
L
E
M
M
P
V
T
Q
S
Y
A
---------
23
PsiBlast_CBE
88.47
37%
-94
- C1 -
3ASV
2
?
D:
[2-241]
---------
I
V
L
V
T
G
A
T
A
G
F
G
E
C
I
T
R
R
F
--
I
Q
Q
G
-
H
K
V
I
A
T
---
G
R
R
Q
E
R
L
-
Q
E
L
K
D
E
L
---
G
-----
D
N
L
-----
Y
--
I
--
A
QL-----
D
V
R
N
----
R
A
A
I
E
E
M
L
----
A
S
----
L
PAEW
C
N
-------
I
D
I
L
V
N
N
A
G
L
A
L
G
M
E
P
A
H
K
A
S
V
E
D
---
W
E
T
M
I
D
T
N
N
K
G
L
V
Y
M
T
R
A
V
L
P
G
M
V
E
R
N
--
H
G
H
I
I
N
I
G
S
T
A
G
S
W
P
Y
A
G
G
N
V
--
Y
G
A
T
K
A
F
V
R
Q
F
S
L
N
L
R
T
D
L
--
H
G
T
A
V
R
V
T
D
I
E
P
G
L
V
G
G
T
E
F
-
S
-
N
V
R
F
K
G
D
D
G
K
A
E
K
T
Y
Q
N
T
V
A
----
L
T
P
E
D
V
S
E
A
V
W
W
V
S
T
L
P
A
H
V
N
I
N
T
L
E
M
M
P
V
T
Q
S
Y
A
---------
32
PsiBlast_CBE
87.39
34%
-103
- C1 -
1XG5
2
DHR11_HUMAN
D:
[31-276]
------
R
D
R
L
A
L
V
T
G
A
S
G
G
I
G
A
A
V
A
R
A
L
--
V
Q
Q
G
-
L
K
V
V
G
C
---
A
R
T
V
G
N
I
-
E
E
L
A
A
E
C
---
K
SAGYP
G
T
L
-----
I
--
P
YR
C
-------
D
L
S
N
----
E
E
D
I
L
S
M
F
----
S
A
----
I
RSQH
S
G
-------
V
D
I
C
I
N
N
A
G
L
A
R
P
D
T
L
L
S
G
S
T
-
S
G
---
W
K
D
M
F
N
V
N
V
L
A
L
S
I
C
T
R
E
A
Y
Q
S
M
K
E
R
N
VD
D
G
H
I
I
N
I
N
S
M
S
G
H
R
V
L
P
L
S
V
T
HF
Y
S
A
T
K
Y
A
V
T
A
L
T
E
G
L
R
Q
E
L
RE
A
Q
T
H
I
R
A
T
C
I
S
P
G
V
V
-
E
T
Q
F
-
A
-
F
K
L
H
D
K
D
P
E
K
A
A
A
T
Y
E
Q
M
K
C
----
L
K
P
E
D
V
A
E
A
V
I
Y
V
L
S
T
P
A
H
I
Q
I
G
D
I
Q
M
R
P
---------------
6
PsiBlast_PDB
86.15
34%
-101
- C1 -
1XG5
2
DHR11_HUMAN
A:
[31-276]
------
R
D
R
L
A
L
V
T
G
A
S
G
G
I
G
A
A
V
A
R
A
L
--
V
Q
Q
G
-
L
K
V
V
G
C
---
A
R
T
V
G
N
I
-
E
E
L
A
A
E
C
---
K
S
A
GYP
G
T
L
-----
I
--
P
Y
R
C
-------
D
L
S
N
----
E
E
D
I
L
S
M
F
----
S
A
----
I
R
S
Q
H
S
G
-------
V
D
I
C
I
N
N
A
G
L
A
R
P
D
T
L
L
S
G
S
T
-
S
G
---
W
K
D
M
F
N
V
N
V
L
A
L
S
I
C
T
R
E
A
Y
Q
S
M
K
E
R
N
VD
D
G
H
I
I
N
I
N
S
M
S
G
H
R
V
L
P
L
S
V
T
H
F
Y
S
A
T
K
Y
A
V
T
A
L
T
E
G
L
R
Q
E
L
R
E
A
Q
T
H
I
R
A
T
C
I
S
P
G
V
V
-
E
T
Q
F
-
A
-
F
K
L
H
D
K
D
P
E
K
A
A
A
T
Y
E
---
C
----
L
K
P
E
D
V
A
E
A
V
I
Y
V
L
S
T
P
A
H
I
Q
I
G
D
I
Q
M
R
P
---------------
33
PsiBlast_CBE
86.13
34%
-102
- C1 -
1XG5
2
DHR11_HUMAN
C:
[31-276]
------
R
D
R
L
A
L
V
T
G
A
S
G
G
I
G
A
A
V
A
R
A
L
--
V
Q
Q
G
-
L
K
V
V
G
C
---
A
R
T
V
G
N
I
-
E
E
L
A
A
E
C
---
K
SAGYP
G
T
L
-----
I
--
P
YR
C
-------
D
L
S
N
----
E
E
D
I
L
S
M
F
----
S
A
----
I
RSQH
S
G
-------
V
D
I
C
I
N
N
A
G
L
A
R
P
D
T
L
L
S
G
S
T
-
S
G
---
W
K
D
M
F
N
V
N
V
L
A
L
S
I
C
T
R
E
A
Y
Q
S
M
K
E
R
N
VD
D
G
H
I
I
N
I
N
S
M
S
G
H
R
V
L
P
L
S
V
T
HF
Y
S
A
T
K
Y
A
V
T
A
L
T
E
G
L
R
Q
E
L
RE
A
Q
T
H
I
R
A
T
C
I
S
P
G
V
V
-
E
T
Q
F
-
A
-
F
K
L
H
D
K
D
P
E
K
A
A
A
T
Y
E
Q
M
K
C
----
L
K
P
E
D
V
A
E
A
V
I
Y
V
L
S
T
P
A
H
I
Q
I
G
D
I
Q
M
R
P
---------------
40
PsiBlast_CBE
84.97
37%
-114
- C1 -
3TFO
5
?
B:
[5-237]
--------
K
V
I
L
I
T
G
A
S
G
G
I
G
E
G
I
A
R
E
L
--
G
V
A
G
-
A
K
I
L
L
G
---
A
R
R
Q
A
R
I
-
E
A
I
A
T
E
I
R
D
A
G
-----
G
T
A
-----
L
A
Q
V
--
L
-------
D
V
T
D
----
R
H
S
V
A
A
F
A
----
Q
A
A
V
D
T
W
----
G
R
-------
I
D
V
L
V
N
N
A
G
-
V
M
P
L
S
P
L
A
A
V
K
V
D
E
---
W
E
R
M
I
D
V
N
I
K
G
V
L
W
G
I
G
A
V
L
P
I
M
E
A
Q
R
--
S
G
Q
I
I
N
I
G
S
I
G
A
L
S
V
V
P
T
A
A
V
--
Y
C
A
T
K
F
A
V
R
A
I
S
D
G
L
R
Q
E
----
S
T
N
I
R
V
T
C
V
N
P
G
V
V
-------------------------
I
A
-----
L
Q
P
A
D
I
A
R
A
V
R
Q
V
I
E
A
P
Q
S
V
D
T
T
E
I
T
I
R
P
---------------
39
PsiBlast_CBE
84.62
37%
-113
- C1 -
3TFO
5
?
D:
[5-237]
--------
K
V
I
L
I
T
G
A
S
G
G
I
G
E
G
I
A
R
E
L
--
G
V
A
G
-
A
K
I
L
L
G
---
A
R
R
Q
A
R
I
-
E
A
I
A
T
E
I
RDA
G
-----
G
T
A
-----
L
AQ
V
--
L
-------
D
V
T
D
----
R
H
S
V
A
A
F
A
----
Q
A
AVDT
W
----
G
R
-------
I
D
V
L
V
N
N
A
G
-
V
M
P
L
S
P
L
A
A
V
K
V
D
E
---
W
E
R
M
I
D
V
N
I
K
G
V
L
W
G
I
G
A
V
L
P
I
M
E
A
Q
R
--
S
G
Q
I
I
N
I
G
S
I
G
A
L
S
V
V
P
T
A
A
V
--
Y
C
A
T
K
F
A
V
R
A
I
S
D
G
L
R
Q
E
----
S
T
N
I
R
V
T
C
V
N
P
G
V
V
-
E
----------------------
A
I
A
-----
L
Q
P
A
D
I
A
R
A
V
R
Q
V
I
E
A
P
Q
S
V
D
T
T
E
I
T
I
R
P
---------------
29
PsiBlast_CBE
84.54
39%
-101
- C1 -
2JAP
2
?
D:
[8-246]
--------
K
V
A
L
I
T
G
A
S
S
G
I
G
E
A
T
A
R
A
L
--
A
A
E
G
-
A
A
V
A
I
A
---
A
R
R
V
E
K
L
-
R
A
L
G
D
E
L
---
T
-----
A
A
G
AKVHV
L
--
E
--
L
-------
D
V
A
D
RQGV
D
A
A
V
A
S
T
V
----
E
A
----
L
----
G
G
-------
L
D
I
L
V
N
N
A
-
G
I
M
L
L
G
P
V
E
D
A
D
T
T
D
---
W
T
R
M
I
D
T
N
L
L
G
L
M
Y
M
T
R
A
A
L
P
H
L
L
R
S
---
K
G
T
V
V
Q
M
S
S
I
A
G
R
V
N
V
R
N
A
A
V
--
Y
Q
A
T
K
F
G
V
N
A
F
S
E
T
L
R
Q
E
V
--
T
E
R
G
V
R
V
V
V
I
E
P
G
T
T
-
D
T
E
L
R
G
-
H
I
T
H
T
A
T
K
E
M
Y
E
Q
R
I
S
Q
I
R
K
----
L
Q
A
Q
D
I
A
E
A
V
R
Y
A
V
T
A
P
H
H
A
T
V
H
E
I
F
I
R
P
T
D
Q
------------
31
PsiBlast_CBE
83.57
39%
-103
- C1 -
2JAP
2
?
B:
[8-246]
--------
K
V
A
L
I
T
G
A
S
S
G
I
G
E
A
T
A
R
A
L
--
A
A
E
G
-
A
A
V
A
I
A
---
A
R
R
V
E
K
L
-
R
A
L
G
D
E
L
---
T
-----
A
A
G
A
K
V
H
V
L
--
E
--
L
-------
D
V
A
D
R
Q
G
V
D
A
A
V
A
S
T
V
----
E
A
----
L
----
G
G
-------
L
D
I
L
V
N
N
A
-
G
I
M
L
L
G
P
V
E
D
A
D
T
T
D
---
W
T
R
M
I
D
T
N
L
L
G
L
M
Y
M
T
R
A
A
L
P
H
L
L
R
S
---
K
G
T
V
V
Q
M
S
S
I
A
G
R
V
N
V
R
N
A
A
V
--
Y
Q
A
T
K
F
G
V
N
A
F
S
E
T
L
R
Q
E
V
--
T
E
R
G
V
R
V
V
V
I
E
P
G
T
T
-
D
T
E
L
R
G
-
H
I
T
H
T
A
T
K
E
M
Y
E
Q
R
I
S
Q
I
R
K
----
L
Q
A
Q
D
I
A
E
A
V
R
Y
A
V
T
A
P
H
H
A
T
V
H
E
I
F
I
R
P
T
D
Q
------------
30
PsiBlast_CBE
82.99
39%
-102
- C1 -
2JAP
2
?
C:
[8-246]
--------
K
V
A
L
I
T
G
A
S
S
G
I
G
E
A
T
A
R
A
L
--
A
A
E
G
-
A
A
V
A
I
A
---
A
R
R
V
E
K
L
-
R
A
L
G
D
E
L
---
T
-----
A
A
G
AKVHV
L
--
E
--
L
-------
D
V
A
D
RQGV
D
A
A
V
A
S
T
V
----
E
A
----
L
----
G
G
-------
L
D
I
L
V
N
N
A
-
G
I
M
L
L
G
P
V
E
D
A
D
T
T
D
---
W
T
R
M
I
D
T
N
L
L
G
L
M
Y
M
T
R
A
A
L
P
H
L
L
R
S
---
K
G
T
V
V
Q
M
S
S
I
A
G
R
V
N
V
R
N
A
A
V
--
Y
Q
A
T
K
F
G
V
N
A
F
S
E
T
L
R
Q
E
V
--
T
E
R
G
V
R
V
V
V
I
E
P
G
T
T
-
D
T
E
L
R
G
-
H
I
T
H
T
A
T
K
E
M
Y
E
Q
R
I
S
Q
I
R
K
----
L
Q
A
Q
D
I
A
E
A
V
R
Y
A
V
T
A
P
H
H
A
T
V
H
E
I
F
I
R
P
T
D
Q
------------
5
PsiBlast_PDB
82.89
39%
-100
- C1 -
2JAP
2
?
A:
[8-246]
--------
K
V
A
L
I
T
G
A
S
S
G
I
G
E
A
T
A
R
A
L
--
A
A
E
G
-
A
A
V
A
I
A
---
A
R
R
V
E
K
L
-
R
A
L
G
D
E
L
---
T
-----
A
A
G
A
K
V
H
V
L
--
E
--
L
-------
D
V
A
D
R
Q
G
V
D
A
A
V
A
S
T
V
----
E
A
----
L
----
G
G
-------
L
D
I
L
V
N
N
A
-
G
I
M
L
L
G
P
V
E
D
A
D
T
T
D
---
W
T
R
M
I
D
T
N
L
L
G
L
M
Y
M
T
R
A
A
L
P
H
L
L
R
S
---
K
G
T
V
V
Q
M
S
S
I
A
G
R
V
N
V
R
N
A
A
V
--
Y
Q
A
T
K
F
G
V
N
A
F
S
E
T
L
R
Q
E
V
--
T
E
R
G
V
R
V
V
V
I
E
P
G
T
T
-
D
T
E
L
R
G
-
H
I
T
H
T
A
T
K
E
M
Y
E
Q
R
I
S
Q
I
R
K
----
L
Q
A
Q
D
I
A
E
A
V
R
Y
A
V
T
A
P
H
H
A
T
V
H
E
I
F
I
R
P
T
D
Q
------------
2
PsiBlast_PDB
82.82
37%
-98
- C1 -
3ASU
-
?
A:
[2-240]
---------
I
V
L
V
T
G
A
T
A
G
F
G
E
C
I
T
R
R
F
--
I
Q
Q
G
-
H
K
V
I
A
T
---
G
R
R
Q
E
R
L
-
Q
E
L
K
D
E
L
---
G
-----
D
N
L
-----
Y
--
I
--
A
Q
L
-----
D
V
R
N
----
R
A
A
I
E
E
M
L
----
A
S
----
L
PAEW
C
N
-------
I
D
I
L
V
N
N
A
G
L
A
L
G
M
E
P
A
H
K
A
S
V
E
D
---
W
E
T
M
I
D
T
N
N
K
G
L
V
Y
M
T
R
A
V
L
P
G
M
V
E
R
N
--
H
G
H
I
I
N
I
G
S
T
A
G
S
W
P
Y
A
G
G
N
V
--
Y
G
A
T
K
A
F
V
R
Q
F
S
L
N
L
R
T
D
L
--
H
G
T
A
V
R
V
T
D
I
E
P
G
L
V
G
G
------------------------
V
A
----
L
T
P
E
D
V
S
E
A
V
W
W
V
S
T
L
P
A
H
V
N
I
N
T
L
E
M
M
P
V
T
Q
S
Y
----------
9
PsiBlast_PDB
82.35
39%
-101
- C1 -
2JAH
1
?
A:
[8-246]
--------
K
V
A
L
I
T
G
A
S
S
G
I
G
E
A
T
A
R
A
L
--
A
A
E
G
-
A
A
V
A
I
A
---
A
R
R
V
E
K
L
-
R
A
L
G
D
E
L
---
T
-----
A
A
G
A
K
V
H
V
L
--
E
--
L
-------
D
V
A
D
R
Q
G
V
D
A
A
V
A
S
T
V
----
E
A
----
L
----
G
G
-------
L
D
I
L
V
N
N
A
-
G
I
M
L
L
G
P
V
E
D
A
D
T
T
D
---
W
T
R
M
I
D
T
N
L
L
G
L
M
Y
M
T
R
A
A
L
P
H
L
L
R
S
---
K
G
T
V
V
Q
M
S
S
I
A
G
R
V
N
V
R
N
A
A
V
--
Y
Q
A
T
K
F
G
V
N
A
F
S
E
T
L
R
Q
E
V
--
T
E
R
G
V
R
V
V
V
I
E
P
G
T
T
-
D
T
E
L
R
G
-
H
I
T
H
T
A
T
K
E
M
Y
E
Q
R
I
S
Q
I
R
K
----
L
Q
A
Q
D
I
A
E
A
V
R
Y
A
V
T
A
P
H
H
A
T
V
H
E
I
F
I
R
P
T
D
Q
------------
26
PsiBlast_CBE
80.95
37%
-92
- C1 -
3RKU
1
YM71_YEAST
D:
[33-280]
-------
K
K
T
V
L
I
T
G
A
S
A
G
I
G
K
A
T
A
L
E
Y
LE
A
S
N
G
D
M
K
L
I
L
A
---
A
R
R
L
E
K
L
-
E
E
L
K
K
T
I
---
D
-----
Q
E
F
-----
P
--
N
--
A
KVHVAQL
D
I
T
Q
AEKI
K
P
F
I
E
N
L
P
----
Q
E
----
F
----
K
D
-------
I
D
I
L
V
N
N
A
G
K
A
L
G
S
D
R
V
G
Q
I
A
T
E
D
---
I
Q
D
V
F
D
T
N
V
T
A
L
I
N
I
T
Q
A
V
L
P
I
F
Q
A
K
N
--
S
G
D
I
V
N
L
G
S
I
A
G
R
D
A
Y
P
T
G
S
I
--
Y
C
A
S
K
F
A
V
G
A
F
T
D
S
L
R
K
E
L
--
I
N
T
K
I
R
V
I
L
I
A
P
G
L
V
-
E
T
E
F
-
S
-
L
V
R
Y
R
G
N
E
E
Q
A
K
N
V
Y
K
D
T
T
P
----
L
M
A
D
D
V
A
D
L
I
V
Y
A
T
S
R
K
Q
N
T
V
I
A
D
T
L
I
F
P
T
N
Q
A
S
----------
28
PsiBlast_CBE
80.34
37%
-89
- C1 -
3RKU
1
YM71_YEAST
B:
[33-280]
-------
K
K
T
V
L
I
T
G
A
S
A
G
I
G
K
A
T
A
L
E
Y
LE
A
S
N
G
D
M
K
L
I
L
A
---
A
R
R
L
E
K
L
-
E
E
L
K
K
T
I
---
D
-----
Q
E
F
-----
P
--
N
--
A
KVHVAQL
D
I
T
Q
AEKI
K
P
F
I
E
N
L
P
----
Q
E
----
F
----
K
D
-------
I
D
I
L
V
N
N
A
G
K
A
L
G
S
D
R
V
G
Q
I
A
T
E
D
---
I
Q
D
V
F
D
T
N
V
T
A
L
I
N
I
T
Q
A
V
L
P
I
F
Q
A
K
N
--
S
G
D
I
V
N
L
G
S
I
A
G
R
D
A
Y
P
T
G
S
I
--
Y
C
A
S
K
F
A
V
G
A
F
T
D
S
L
R
K
E
L
--
I
N
T
K
I
R
V
I
L
I
A
P
G
L
V
-
E
T
E
F
-
S
-
L
V
R
Y
R
G
N
E
E
Q
A
K
N
V
Y
K
D
T
T
P
----
L
M
A
D
D
V
A
D
L
I
V
Y
A
T
S
R
K
Q
N
T
V
I
A
D
T
L
I
F
P
T
N
Q
A
S
----------
4
PsiBlast_PDB
80.02
37%
-89
- C1 -
3RKU
1
YM71_YEAST
A:
[33-280]
-------
K
K
T
V
L
I
T
G
A
S
A
G
I
G
K
A
T
A
L
E
Y
L
E
A
S
N
G
D
M
K
L
I
L
A
---
A
R
R
L
E
K
L
-
E
E
L
K
K
T
I
---
D
-----
Q
E
F
-----
P
--
N
--
A
K
V
H
V
A
QL
D
I
T
Q
AEK
I
K
P
F
I
E
N
L
P
----
Q
E
----
F
----
K
D
-------
I
D
I
L
V
N
N
A
G
K
A
L
G
S
D
R
V
G
Q
I
A
T
E
D
---
I
Q
D
V
F
D
T
N
V
T
A
L
I
N
I
T
Q
A
V
L
P
I
F
Q
A
K
N
--
S
G
D
I
V
N
L
G
S
I
A
G
R
D
A
Y
P
T
G
S
I
--
Y
C
A
S
K
F
A
V
G
A
F
T
D
S
L
R
K
E
L
--
I
N
T
K
I
R
V
I
L
I
A
P
G
L
V
-
E
T
E
F
-
S
-
L
V
R
Y
R
G
N
E
E
Q
A
K
N
V
Y
K
D
T
T
P
----
L
M
A
D
D
V
A
D
L
I
V
Y
A
T
S
R
K
Q
N
T
V
I
A
D
T
L
I
F
P
T
N
Q
A
S
----------
27
PsiBlast_CBE
79.50
37%
-89
- C1 -
3RKU
1
YM71_YEAST
C:
[33-280]
-------
K
K
T
V
L
I
T
G
A
S
A
G
I
G
K
A
T
A
L
E
Y
LE
A
S
N
G
D
M
K
L
I
L
A
---
A
R
R
L
E
K
L
-
E
E
L
K
K
T
I
---
D
-----
Q
E
F
-----
P
--
N
--
A
KVHVAQL
D
I
T
Q
AEKI
K
P
F
I
E
N
L
P
----
Q
E
----
F
----
K
D
-------
I
D
I
L
V
N
N
A
G
K
A
L
G
S
D
R
V
G
Q
I
A
T
E
D
---
I
Q
D
V
F
D
T
N
V
T
A
L
I
N
I
T
Q
A
V
L
P
I
F
Q
A
K
N
--
S
G
D
I
V
N
L
G
S
I
A
G
R
D
A
Y
P
T
G
S
I
--
Y
C
A
S
K
F
A
V
G
A
F
T
D
S
L
R
K
E
L
--
I
N
T
K
I
R
V
I
L
I
A
P
G
L
V
-
E
T
E
F
-
S
-
L
V
R
Y
R
G
N
E
E
Q
A
K
N
V
Y
K
D
T
T
P
----
L
M
A
D
D
V
A
D
L
I
V
Y
A
T
S
R
K
Q
N
T
V
I
A
D
T
L
I
F
P
T
N
Q
A
S
----------
38
PsiBlast_CBE
78.07
33%
-106
- C1 -
3P19
1
?
B:
[16-251]
-------
K
K
L
V
V
I
T
G
A
S
S
G
I
G
E
A
I
A
R
R
F
--
S
E
E
G
-
H
P
L
L
L
L
---
A
R
R
V
E
R
L
-
K
A
L
-
N
L
P
---
N
-----
T
L
C
-----
A
--
Q
--
V
-------
D
V
T
D
K
Y
T
F
D
T
A
I
T
R
A
E
----
K
I
----
Y
----
G
P
-------
A
D
A
I
V
N
N
A
G
----
M
M
L
L
G
Q
I
D
T
Q
E
A
N
E
W
Q
R
M
F
D
V
N
V
L
G
L
L
N
G
M
Q
A
V
L
A
P
M
K
A
R
N
--
C
G
T
I
I
N
I
S
S
I
A
G
K
K
T
F
P
D
H
A
A
--
Y
C
G
T
K
F
A
V
H
A
I
S
E
N
V
R
E
E
V
--
A
A
S
N
V
R
V
M
T
I
A
P
S
A
V
-
K
T
E
----
L
L
S
-----------------GGV-
L
A
A
D
D
V
A
R
A
V
L
F
A
Y
Q
Q
P
Q
N
V
C
I
R
E
I
A
L
A
P
T
K
Q
------------
37
PsiBlast_CBE
76.60
33%
-105
- C1 -
3P19
1
?
C:
[16-251]
-------
K
K
L
V
V
I
T
G
A
S
S
G
I
G
E
A
I
A
R
R
F
--
S
E
E
G
-
H
P
L
L
L
L
---
A
R
R
V
E
R
L
-
K
A
L
-
N
L
P
---
N
-----
T
L
C
-----
A
--
Q
--
V
-------
D
V
T
D
KYTF
D
T
A
I
T
R
A
E
----
K
I
----
Y
----
G
P
-------
A
D
A
I
V
N
N
A
G
----
M
M
L
L
G
Q
I
D
T
Q
E
ANE
W
Q
R
M
F
D
V
N
V
L
G
L
L
N
G
M
Q
A
V
L
A
P
M
K
A
R
N
--
C
G
T
I
I
N
I
S
S
I
A
G
K
K
T
F
P
D
H
A
A
--
Y
C
G
T
K
F
A
V
H
A
I
S
E
N
V
R
E
E
V
--
A
A
S
N
V
R
V
M
T
I
A
P
S
A
V
-
K
T
E
----
L
L
S
-----------------GGV-
L
A
A
D
D
V
A
R
A
V
L
F
A
Y
Q
Q
P
Q
N
V
C
I
R
E
I
A
L
A
P
T
K
Q
------------
36
PsiBlast_CBE
75.78
33%
-102
- C1 -
3P19
1
?
D:
[16-251]
-------
K
K
L
V
V
I
T
G
A
S
S
G
I
G
E
A
I
A
R
R
F
--
S
E
E
G
-
H
P
L
L
L
L
---
A
R
R
V
E
R
L
-
K
A
L
-
N
L
P
---
N
-----
T
L
C
-----
A
--
Q
--
V
-------
D
V
T
D
KYTF
D
T
A
I
T
R
A
E
----
K
I
----
Y
----
G
P
-------
A
D
A
I
V
N
N
A
G
----
M
M
L
L
G
Q
I
D
T
Q
E
ANE
W
Q
R
M
F
D
V
N
V
L
G
L
L
N
G
M
Q
A
V
L
A
P
M
K
A
R
N
--
C
G
T
I
I
N
I
S
S
I
A
G
K
K
T
F
P
D
H
A
A
--
Y
C
G
T
K
F
A
V
H
A
I
S
E
N
V
R
E
E
V
--
A
A
S
N
V
R
V
M
T
I
A
P
S
A
V
-
K
T
E
----
L
L
S
H
T
T
S
Q
Q
I
K
D
G
Y
D
A
W
R
V
D
MGGV
L
A
A
D
D
V
A
R
A
V
L
F
A
Y
Q
Q
P
Q
N
V
C
I
R
E
I
A
L
A
P
T
K
Q
------------
8
PsiBlast_PDB
75.70
33%
-99
- C1 -
3P19
1
?
A:
[15-251]
------
M
K
K
L
V
V
I
T
G
A
S
S
G
I
G
E
A
I
A
R
R
F
--
S
E
E
G
-
H
P
L
L
L
L
---
A
R
R
V
E
R
L
-
K
A
L
-
N
L
P
---
N
-----
T
L
C
-----
A
--
Q
--
V
-------
D
V
T
D
K
Y
T
F
D
T
A
I
T
R
A
E
----
K
I
----
Y
----
G
P
-------
A
D
A
I
V
N
N
A
G
----
M
M
L
L
G
Q
I
D
T
Q
E
A
N
E
W
Q
R
M
F
D
V
N
V
L
G
L
L
N
G
M
Q
A
V
L
A
P
M
K
A
R
N
--
C
G
T
I
I
N
I
S
S
I
A
G
K
K
T
F
P
D
H
A
A
--
Y
C
G
T
K
F
A
V
H
A
I
S
E
N
V
R
E
E
V
--
A
A
S
N
V
R
V
M
T
I
A
P
S
A
V
-
K
T
E
----
L
L
S
H
T
T
S
Q
Q
I
K
D
G
Y
D
A
W
R
V
D
M
G
G
V
L
A
A
D
D
V
A
R
A
V
L
F
A
Y
Q
Q
P
Q
N
V
C
I
R
E
I
A
L
A
P
T
K
Q
------------
103
PsiBlast_CBE
61.15
33%
-99
- C1 -
1FMC
2
HDHA_ECOLI
B:
[12-195]
--------
K
C
A
I
I
T
G
A
G
A
G
I
G
K
E
I
A
I
T
F
--
A
T
A
G
-
A
S
V
V
V
S
DIN
A
D
A
A
N
H
V
-
V
D
E
I
Q
Q
L
---
G
-----
G
Q
A
-----
F
--
A
--
C
RC-----
D
I
T
S
----
E
Q
E
L
S
A
L
A
DFAI
S
K
----
L
----
G
K
-------
V
D
I
L
V
N
N
A
G
G
G
G
P
K
P
F
--
D
M
P
M
A
D
---
F
R
R
A
Y
E
L
N
V
F
S
F
F
H
L
S
Q
L
V
A
P
E
M
E
K
N
G
--
G
G
V
I
L
T
I
T
S
M
A
A
E
N
K
N
I
N
M
T
S
--
Y
A
S
S
K
A
A
A
S
H
L
V
R
N
M
A
F
D
L
--
G
E
K
N
I
R
V
N
G
I
A
P
G
A
I
-
L
T
D
------------------------------------------------------------------------
92
PsiBlast_CBE
57.96
31%
-85
- C1 -
3O4R
2
DHRS4_HUMAN
C:
[15-215]
-------
N
K
V
A
L
V
T
A
S
T
D
G
I
G
F
A
I
A
R
R
L
--
A
Q
D
G
-
A
H
V
V
V
S
---
S
R
K
Q
Q
N
V
D
Q
A
V
A
T
L
Q
---
G
E
----
G
L
S
-----
V
--
T
--
G
-------
T
V
C
H
----
V
G
K
A
E
D
R
E
----
R
L
----
V
----
A
T
A
V
K
L
HGG
I
D
I
L
V
S
N
A
A
V
N
P
F
F
G
S
I
M
D
V
T
E
E
V
---
W
D
K
T
L
D
I
N
V
K
A
P
A
L
M
T
K
A
V
V
P
E
M
E
K
R
G
--
G
G
S
V
V
I
V
S
S
I
A
A
F
S
P
S
P
G
F
S
P
--
Y
N
V
S
K
T
A
L
L
G
L
T
K
T
L
A
I
E
L
--
A
P
R
N
I
R
V
N
C
L
A
P
G
L
I
-
K
T
S
F
-
S
R
M
L
W
M
D
K
E
K
E
E
S
---------------------------------------------------------