@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 : Rv1496: (2016-05-02 )
MMAASHDDDTVDGLATAVRGGDRAALPRAITLVESTRPDHREQAQQLLLRLLPDSGNAHRVGITGVPGVGKSTAIEALGMHLIERGHRVAVLAVDPSSTRTGGSILGDKTRMARLAVHPNAYIRPSPTSGTLGGVTRATRETVVLLEAAGFDVILIETVGVGQSEVAVANMVDTFVLLTLARTGDQLQGIKKGVLELADIVVVNKADGEHHKEARLAARELSAAIRLIYPREALWRPPVLTMSAVEGRGLAELWDTVERHRQVLTGAGEFDARRRDQQVDWTWQLVRDAVLDRVWSNPTVRKVRSELERRVRAGELTPALAAQQILEIANLTDR
Atome Classification :
(22 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..
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MMAASHDD
D
T
V
D
G
L
A
T
A
VRGG
D
R
A
AL
P
R
A
I
T
L
VESTRP
D
H
R
E
Q
A
Q
Q
L
L
L
R
L----------L--------PDSGN--A
H
R
V
GITGVPGV
G
K
S
T
A
I
E
A
L
G
M
H
L
I
ERG
H
R
V
A
V
L
A
VDPSSTRTGGSILGDK
T
R
M
A
R
L
A
VHPN
A
Y
I
RPSPTSGTLGGVTRAT
R
E
T
V
V
L
L
EAAG
F
D
V
I
L
I
E
T
VGVG
Q
S
E
V
A
V
A
N
M
V
D
T
F
V
L
L
T
L
ART
G
D
Q
L
Q
G
I
K
K
G
V
L
E
L
A
D
I
V
V
V
NKA-DG
E
H
H
K
E
-
A
R
L
A
A
R
E
L
S
A
A
I
R
L
IYP
R
E
ALWRPP
V
L
T
M
SAVEGR
G
L
A
E
L
W
D
T
V
E
R
H
R
Q
V
LTGAGEFDARRRDQQV
D
W
T
W
Q
L
V
R
D
A
V
L
D
R
VWSNP
T
V
R
K
V
R
S
E
L
E
R
R
V
RAGEL
T
P
A
L
A
A
Q
Q
I
L
E
I
ANLTDR
115
HHSearch
98.23
100%
-125
- C6 -
3P32
3
Y1496_MYCTU
A:
[31-354]
---------
T
V
D
G
L
A
T
A
V
R
G
G
D
R
A
A
L
P
R
A
I
T
L
V
E
S
T
R
P
D
H
R
E
Q
A
Q
Q
L
L
L
R
L
----------
L
--------
P
D
S
G
N
--
A
H
R
V
G
I
T
G
V
P
G
V
G
K
S
T
A
I
E
A
L
G
M
H
L
I
E
R
G
H
R
V
A
V
L
A
V
D
----------------
M
A
R
L
A
V
H
P
N
A
Y
I
R
P
S
P
--
G
T
L
G
G
V
T
R
A
T
R
E
T
V
V
L
L
E
A
A
G
F
D
V
I
L
I
E
T
V
G
V
G
Q
S
E
V
A
V
A
N
M
V
D
T
F
V
L
L
T
L
A
R
T
G
D
Q
L
Q
G
I
K
K
G
V
L
E
L
A
D
I
V
V
V
N
K
A
-
D
G
E
H
H
K
E
-
A
R
L
A
A
R
E
L
S
A
A
I
R
L
I
Y
P
R
E
A
L
W
R
P
P
V
L
T
M
S
A
V
E
G
R
G
L
A
E
L
W
D
T
V
E
R
H
R
Q
V
L
T
G
A
G
E
F
D
A
R
R
R
D
Q
Q
V
D
W
T
W
Q
L
V
R
D
A
V
L
D
R
V
W
S
N
P
T
V
R
K
V
R
S
E
L
E
R
R
V
R
A
G
E
L
T
P
A
L
A
A
Q
Q
I
L
E
I
A
N
L
T
D
-
2
PsiBlast_PDB
98.23
100%
-125
- C6 -
3P32
3
Y1496_MYCTU
A:
[31-354]
---------
T
V
D
G
L
A
T
A
V
R
G
G
D
R
A
A
L
P
R
A
I
T
L
V
E
S
T
R
P
D
H
R
E
Q
A
Q
Q
L
L
L
R
L
----------
L
--------
P
D
S
G
N
--
A
H
R
V
G
I
T
G
V
P
G
V
G
K
S
T
A
I
E
A
L
G
M
H
L
I
E
R
G
H
R
V
A
V
L
A
V
D
----------------
M
A
R
L
A
V
H
P
N
A
Y
I
R
P
S
P
--
G
T
L
G
G
V
T
R
A
T
R
E
T
V
V
L
L
E
A
A
G
F
D
V
I
L
I
E
T
V
G
V
G
Q
S
E
V
A
V
A
N
M
V
D
T
F
V
L
L
T
L
A
R
T
G
D
Q
L
Q
G
I
K
K
G
V
L
E
L
A
D
I
V
V
V
N
K
A
-
D
G
E
H
H
K
E
-
A
R
L
A
A
R
E
L
S
A
A
I
R
L
I
Y
P
R
E
A
L
W
R
P
P
V
L
T
M
S
A
V
E
G
R
G
L
A
E
L
W
D
T
V
E
R
H
R
Q
V
L
T
G
A
G
E
F
D
A
R
R
R
D
Q
Q
V
D
W
T
W
Q
L
V
R
D
A
V
L
D
R
V
W
S
N
P
T
V
R
K
V
R
S
E
L
E
R
R
V
R
A
G
E
L
T
P
A
L
A
A
Q
Q
I
L
E
I
A
N
L
T
D
-
1
PsiBlast_PDB
97.61
100%
-126
- C6 -
3MD0
4
Y1496_MYCTU
A:
[31-354]
---------
T
V
D
G
L
A
T
A
V
R
G
G
D
R
A
A
L
P
R
A
I
T
L
V
E
S
T
R
P
D
H
R
E
Q
A
Q
Q
L
L
L
R
L
----------
L
--------
P
D
S
G
N
--
A
H
R
V
G
I
T
G
V
P
G
V
G
K
S
T
A
I
E
A
L
G
M
H
L
I
E
R
G
H
R
V
A
V
L
A
V
----------------
R
M
A
R
L
A
V
H
P
N
A
Y
I
R
P
S
----
T
L
G
G
V
T
R
A
T
R
E
T
V
V
L
L
E
A
A
G
F
D
V
I
L
I
E
T
---
G
Q
S
E
V
A
V
A
N
M
V
D
T
F
V
L
L
T
L
A
R
T
G
D
Q
L
Q
G
I
K
K
G
V
L
E
L
A
D
I
V
V
V
N
K
A
-
D
G
E
H
H
K
E
-
A
R
L
A
A
R
E
L
S
A
A
I
R
L
I
Y
P
R
E
A
L
W
R
P
P
V
L
T
M
S
A
V
E
G
R
G
L
A
E
L
W
D
T
V
E
R
H
R
Q
V
L
T
G
A
G
E
F
D
A
R
R
R
D
Q
Q
V
D
W
T
W
Q
L
V
R
D
A
V
L
D
R
V
W
S
N
P
T
V
R
K
V
R
S
E
L
E
R
R
V
R
A
G
E
L
T
P
A
L
A
A
Q
Q
I
L
E
I
A
N
L
T
D
-
3
PsiBlast_PDB
97.53
100%
-125
- C6 -
4GT1
4
Y1496_MYCTU
A:
[31-354]
---------
T
V
D
G
L
A
T
A
V
R
G
G
D
R
A
A
L
P
R
A
I
T
L
V
E
S
T
R
P
D
H
R
E
Q
A
Q
Q
L
L
L
R
L
----------
L
--------
P
D
S
G
N
--
A
H
R
V
G
I
T
G
V
P
G
V
G
K
S
T
A
I
E
A
L
G
M
H
L
I
E
R
G
H
R
V
A
V
L
A
V
D
----------------
M
A
R
L
A
V
H
P
N
A
Y
I
R
------
T
L
G
G
V
T
R
A
T
R
E
T
V
V
L
L
E
A
A
G
F
D
V
I
L
I
E
T
V
G
V
G
Q
S
E
V
A
V
A
N
M
V
D
T
F
V
L
L
T
L
A
R
T
G
D
Q
L
Q
G
I
K
K
G
V
L
E
L
A
D
I
V
V
V
N
K
A
-
D
G
E
H
H
K
E
-
A
R
L
A
A
R
E
L
S
A
A
I
R
L
I
Y
P
R
E
A
L
W
R
P
P
V
L
T
M
S
A
V
E
G
R
G
L
A
E
L
W
D
T
V
E
R
H
R
Q
V
L
T
G
A
G
E
F
D
A
R
R
R
D
Q
Q
V
D
W
T
W
Q
L
V
R
D
A
V
L
D
R
V
W
S
N
P
T
V
R
K
V
R
S
E
L
E
R
R
V
R
A
G
E
L
T
P
A
L
A
A
Q
Q
I
L
E
I
A
N
L
T
D
-
4
PsiBlast_PDB
93.24
80%
-116
- C6 -
3NXS
1
?
A:
[9-329]
---------
N
V
H
E
L
A
Q
S
I
R
D
G
D
R
S
A
L
A
R
A
I
T
L
V
E
S
T
R
A
D
H
R
E
Q
A
Q
Q
L
L
L
D
L
----------
M
--------
P
E
A
G
S
--
A
M
H
V
G
I
T
G
V
P
G
V
G
K
S
T
T
I
E
A
L
G
M
H
L
I
E
A
G
H
R
V
A
V
L
A
V
D
---------------
R
M
A
R
L
A
V
H
P
D
A
Y
I
R
P
S
P
T
S
G
T
L
G
G
V
A
K
A
T
R
E
T
I
V
L
L
E
A
A
G
Y
D
V
I
L
V
E
T
V
G
V
G
Q
S
E
V
T
V
A
G
M
V
D
T
F
V
F
L
T
L
A
R
T
G
D
Q
L
Q
G
I
K
K
G
V
L
E
L
A
D
V
I
V
V
N
K
A
-
D
G
E
H
A
V
E
-
A
K
A
A
A
R
E
L
S
G
A
I
R
L
I
Y
P
R
E
S
L
W
R
P
P
V
L
T
M
S
A
V
E
G
T
G
L
P
E
L
W
E
T
V
L
R
H
R
E
V
L
E
E
A
G
E
F
E
A
R
R
R
T
Q
Q
V
E
W
T
W
S
M
V
R
D
A
V
L
D
R
V
M
N
H
P
E
V
R
R
I
R
D
D
V
E
Q
R
V
R
L
G
E
L
T
P
A
L
A
A
Q
E
I
L
D
A
A
Q
----
21
PsiBlast_CBE
92.43
78%
-115
- C6 -
3TK1
2
?
B:
[8-329]
---------
T
V
K
D
L
A
A
A
I
R
S
G
D
R
A
A
L
P
R
A
I
T
L
V
E
S
T
R
A
D
H
R
E
R
A
Q
E
L
L
L
E
L
----------
M
--------
P
D
A
G
R
--
A
M
H
V
G
I
T
G
V
P
G
V
G
K
S
T
S
I
E
A
L
G
M
H
L
I
E
Q
G
H
R
V
A
V
L
A
V
D
P
S
S
V
R
---
S
I
L
G
D
K
T
R
M
A
R
L
A
V
H
P
D
A
Y
V
R
P
S
P
S
S
G
T
L
G
G
V
A
K
A
T
R
E
T
I
V
L
L
E
A
A
G
F
D
V
V
L
V
E
T
V
--
G
Q
S
E
V
T
V
A
D
M
V
D
T
F
V
F
L
T
L
A
R
T
G
D
Q
L
Q
G
I
K
K
G
V
L
E
L
A
D
I
V
V
V
N
K
A
-
D
G
E
H
A
V
E
-
A
R
K
A
A
R
E
L
A
G
A
M
R
L
I
Y
P
R
E
T
L
W
R
P
P
V
L
T
M
S
A
L
E
G
T
G
V
A
E
L
W
E
T
V
L
K
H
R
Q
V
L
I
D
A
G
E
F
E
K
R
R
R
D
Q
E
V
N
W
M
W
T
M
V
R
D
A
V
I
D
R
V
M
T
S
P
G
V
R
E
I
R
A
E
V
E
R
Q
V
R
E
G
E
L
T
A
A
L
A
A
Q
R
L
L
D
A
A
E
L
---
5
PsiBlast_PDB
89.16
78%
-127
- C6 -
3TK1
1
?
A:
[8-329]
---------
T
V
K
D
L
A
A
A
I
R
S
G
D
R
A
A
L
P
R
A
I
T
L
V
E
S
T
R
A
D
H
R
E
R
A
Q
E
L
L
L
E
L
----------
M
--------
P
D
A
G
R
--
A
M
H
V
G
I
T
G
V
P
G
V
G
K
S
T
S
I
E
A
L
G
M
H
L
I
E
Q
G
H
R
V
A
V
L
A
V
D
-------------
K
T
R
M
A
R
L
A
V
H
P
------------
L
G
G
V
A
K
A
T
R
E
T
I
V
L
L
E
A
A
G
F
D
V
V
L
V
E
T
V
G
V
G
Q
S
E
V
T
V
A
D
M
V
D
T
F
V
F
L
T
L
A
R
T
G
D
Q
L
Q
G
I
K
K
G
V
L
E
L
A
D
I
V
V
V
N
K
A
-
D
G
E
H
A
V
E
-
A
R
K
A
A
R
E
L
A
G
A
M
R
L
I
----
T
L
W
R
P
P
V
L
T
M
S
A
L
E
G
T
G
V
A
E
L
W
E
T
V
L
K
H
R
Q
V
L
I
D
A
G
E
F
E
K
R
R
R
D
Q
E
V
N
W
M
W
T
M
V
R
D
A
V
I
D
R
V
M
T
S
P
G
V
R
E
I
R
A
E
V
E
R
Q
V
R
E
G
E
L
T
A
A
L
A
A
Q
R
L
L
D
A
A
E
L
---
22
PsiBlast_CBE
83.23
58%
-103
- C6 -
4LC1
1
?
B:
[18-329]
--------------------
G
D
R
A
A
L
A
R
A
I
T
L
A
E
S
R
R
A
D
H
R
A
A
V
R
D
L
I
D
A
V
----------
L
--------
P
Q
T
G
R
--
A
I
R
V
G
I
T
G
V
P
G
V
G
K
S
T
T
I
D
A
L
G
S
L
L
T
A
A
G
H
K
V
A
V
L
A
V
D
P
S
S
------------
R
M
A
R
L
A
I
D
R
N
A
F
I
R
P
S
P
S
S
G
T
L
G
G
V
A
A
K
T
R
E
T
M
L
L
C
E
A
A
G
F
D
V
I
L
V
E
T
V
---
Q
S
E
T
A
V
A
D
L
T
D
F
F
L
V
L
M
L
P
G
---
E
L
Q
G
I
K
K
G
I
F
E
L
A
D
M
I
A
V
N
K
A
D
D
G
D
G
E
R
R
-
A
S
A
A
A
S
E
Y
R
A
A
L
H
I
L
T
P
P
S
A
T
W
T
P
P
V
V
T
I
S
G
L
H
G
K
G
L
D
S
L
W
S
R
I
E
D
H
R
S
K
L
T
A
T
G
E
I
A
G
K
R
R
E
Q
D
V
K
W
M
W
A
L
V
H
E
R
L
H
Q
R
L
V
G
S
A
E
V
R
Q
A
T
A
E
A
E
R
A
V
A
G
G
E
H
S
P
A
A
G
A
D
A
I
A
T
L
I
G
L
---
117
HHSearch
82.69
57%
-98
* C6 *
2QM8
3
?
A:
[4-326]
------
T
L
P
D
M
D
T
L
R
E
R
L
L
A
G
D
R
A
A
L
A
R
A
I
T
L
A
E
S
R
R
A
D
H
R
A
A
V
R
D
L
I
D
A
V
----------
L
--------
P
Q
T
G
R
--
A
I
R
V
G
I
T
G
V
P
G
V
G
K
S
T
T
I
D
A
L
G
S
L
L
T
A
A
G
H
K
V
A
V
L
A
V
D
P
S
S
T
R
T
G
G
S
I
L
G
D
K
T
R
M
A
R
L
A
I
D
R
N
A
F
I
R
P
S
P
S
S
G
T
L
G
G
V
A
A
K
T
R
E
T
M
L
L
C
E
A
A
G
F
D
V
I
L
V
E
T
V
G
V
G
Q
S
E
T
A
V
A
D
L
T
D
F
F
L
V
L
M
L
P
G
A
------
I
K
K
G
I
F
E
L
A
D
M
I
A
V
N
K
A
-
D
D
G
D
G
E
R
R
A
S
A
A
A
S
E
Y
R
A
A
L
H
I
L
T
P
P
S
A
T
W
T
P
P
V
V
T
I
S
G
L
H
G
K
G
L
D
S
L
W
S
R
I
E
D
H
R
S
K
L
T
A
T
G
E
I
A
G
K
R
R
E
Q
D
V
K
W
M
W
A
L
V
H
E
R
L
H
Q
R
L
V
G
S
A
E
V
R
Q
A
T
A
E
A
E
R
A
V
A
G
G
E
H
S
P
A
A
G
A
D
A
I
A
T
L
------
25
PsiBlast_CBE
82.50
58%
-108
- C6 -
2QM7
1
?
B:
[18-329]
--------------------
G
D
R
A
A
L
A
R
A
I
T
L
A
---
R
A
D
H
R
A
A
V
R
D
L
I
D
A
V
----------
L
--------
P
Q
T
G
R
--
A
I
R
V
G
I
T
G
V
P
G
V
G
K
S
T
T
I
D
A
L
G
S
L
L
T
A
A
G
H
K
V
A
V
L
A
V
D
P
S
S
T
R
----------
R
M
A
R
L
A
I
D
R
N
A
F
I
R
P
S
P
S
S
G
T
L
G
G
V
A
A
K
T
R
E
T
M
L
L
C
E
A
A
G
F
D
V
I
L
V
E
T
V
G
V
G
Q
S
E
T
A
V
A
D
L
T
D
F
F
L
V
L
M
L
P
G
A
G
D
E
L
Q
G
I
K
K
G
I
F
E
L
A
D
M
I
A
V
N
K
A
D
D
G
D
G
E
R
R
-
A
S
A
A
A
S
E
Y
R
A
A
L
H
I
L
T
P
P
S
A
T
W
T
P
P
V
V
T
I
S
G
L
H
G
K
G
L
D
S
L
W
S
R
I
E
D
H
R
S
K
L
T
A
T
G
E
I
A
G
K
R
R
E
Q
D
V
K
W
M
W
A
L
V
H
E
R
L
H
Q
R
L
V
G
S
A
E
V
R
Q
A
T
A
E
A
E
R
A
V
A
G
G
E
H
S
P
A
A
G
A
D
A
I
A
T
L
I
G
L
---
9
PsiBlast_PDB
81.85
58%
-98
- C6 -
4LC1
2
?
A:
[18-329]
--------------------
G
D
R
A
A
L
A
R
A
I
T
L
A
E
S
R
R
A
D
H
R
A
A
V
R
D
L
I
D
A
V
----------
L
--------
P
Q
T
G
R
--
A
I
R
V
G
I
T
G
V
P
G
V
G
K
S
T
T
I
D
A
L
G
S
L
L
T
A
A
G
H
K
V
A
V
L
A
V
D
P
S
S
----------
K
T
R
M
A
R
L
A
I
D
R
N
A
F
I
R
P
S
P
S
S
G
T
L
G
G
V
A
A
K
T
R
E
T
M
L
L
C
E
A
A
G
F
D
V
I
L
V
E
T
V
G
-
G
Q
S
E
T
A
V
A
D
L
T
D
F
F
L
V
L
M
L
P
G
A
G
D
E
L
Q
G
I
K
K
G
I
F
E
L
A
D
M
I
A
V
N
K
A
D
D
G
D
G
E
R
R
-
A
S
A
A
A
S
E
Y
R
A
A
L
H
I
L
T
P
P
S
A
T
W
T
P
P
V
V
T
I
S
G
L
H
G
K
G
L
D
S
L
W
S
R
I
E
D
H
R
S
K
L
T
A
T
G
E
I
A
G
K
R
R
E
Q
D
V
K
W
M
W
A
L
V
H
E
R
L
H
Q
R
L
V
G
S
A
E
V
R
Q
A
T
A
E
A
E
R
A
V
A
G
G
E
H
S
P
A
A
G
A
D
A
I
A
T
L
I
G
L
---
6
PsiBlast_PDB
81.44
58%
-100
- C6 -
2QM7
3
?
A:
[18-327]
--------------------
G
D
R
A
A
L
A
R
A
I
T
L
A
E
S
R
R
A
D
H
R
A
A
V
R
D
L
I
D
A
V
----------
L
--------
P
Q
T
G
R
--
A
I
R
V
G
I
T
G
V
P
G
V
G
K
S
T
T
I
D
A
L
G
S
L
L
T
A
A
G
H
K
V
A
V
L
A
V
D
P
S
S
T
R
T
---------
R
M
A
R
L
A
I
D
R
N
A
F
I
R
P
S
P
S
S
G
T
L
G
G
V
A
A
K
T
R
E
T
M
L
L
C
E
A
A
G
F
D
V
I
L
V
E
T
V
G
V
G
Q
S
E
T
A
V
A
D
L
T
D
F
F
L
V
L
M
L
P
G
A
G
D
E
L
Q
G
I
K
K
G
I
F
E
L
A
D
M
I
A
V
N
K
A
D
D
G
D
G
E
R
R
-
A
S
A
A
A
S
E
Y
R
A
A
L
H
I
L
T
P
P
S
A
T
W
T
P
P
V
V
T
I
S
G
L
H
G
K
G
L
D
S
L
W
S
R
I
E
D
H
R
S
K
L
T
A
T
G
E
I
A
G
K
R
R
E
Q
D
V
K
W
M
W
A
L
V
H
E
R
L
H
Q
R
L
V
G
S
A
E
V
R
Q
A
T
A
E
A
E
R
A
V
A
G
G
E
H
S
P
A
A
G
A
D
A
I
A
T
L
I
-----
7
PsiBlast_PDB
81.43
58%
-90
- C6 -
4JYB
1
?
A:
[18-329]
--------------------
G
D
R
A
A
L
A
R
A
I
T
L
A
E
S
R
R
A
D
H
R
A
A
V
R
D
L
I
D
A
V
----------
L
--------
P
Q
T
G
R
--
A
I
R
V
G
I
T
G
V
P
G
V
G
K
S
T
T
I
D
A
L
G
S
L
L
T
A
A
G
H
K
V
A
V
L
A
V
D
P
S
S
T
R
T
G
G
S
I
L
G
D
K
T
R
M
A
R
L
A
I
D
R
N
A
F
I
R
P
S
P
S
S
G
T
L
G
G
V
A
A
K
T
R
E
T
M
L
L
C
E
A
A
G
F
D
V
I
L
V
E
T
V
G
V
G
Q
S
E
T
A
V
A
D
L
T
D
F
F
L
V
L
M
L
P
G
A
G
D
E
L
Q
G
I
K
K
G
I
F
E
L
A
D
M
I
A
V
N
K
A
D
D
G
D
G
E
R
R
-
A
S
A
A
A
S
E
Y
R
A
A
L
H
I
L
T
P
P
S
A
T
W
T
P
P
V
V
T
I
S
G
L
H
G
K
G
L
D
S
L
W
S
R
I
E
D
H
R
S
K
L
T
A
T
G
E
I
A
G
K
R
R
E
Q
D
V
K
W
M
W
A
L
V
H
E
R
L
H
Q
R
L
V
G
S
A
E
V
R
Q
A
T
A
E
A
E
R
A
V
A
G
G
E
H
S
P
A
A
G
A
D
A
I
A
T
L
I
G
L
---
10
PsiBlast_PDB
81.41
58%
-97
- C6 -
2QM8
3
?
A:
[18-329]
--------------------
G
D
R
A
A
L
A
R
A
I
T
L
A
E
S
R
R
A
D
H
R
A
A
V
R
D
L
I
D
A
V
----------
L
--------
P
Q
T
G
R
--
A
I
R
V
G
I
T
G
V
P
G
V
G
K
S
T
T
I
D
A
L
G
S
L
L
T
A
A
G
H
K
V
A
V
L
A
V
D
P
S
S
T
R
T
G
G
S
I
L
G
D
K
T
R
M
A
R
L
A
I
D
R
N
A
F
I
R
P
S
P
S
S
G
T
L
G
G
V
A
A
K
T
R
E
T
M
L
L
C
E
A
A
G
F
D
V
I
L
V
E
T
V
G
V
G
Q
S
E
T
A
V
A
D
L
T
D
F
F
L
V
L
M
L
P
G
A
------
I
K
K
G
I
F
E
L
A
D
M
I
A
V
N
K
A
D
D
G
D
G
E
R
R
-
A
S
A
A
A
S
E
Y
R
A
A
L
H
I
L
T
P
P
S
A
T
W
T
P
P
V
V
T
I
S
G
L
H
G
K
G
L
D
S
L
W
S
R
I
E
D
H
R
S
K
L
T
A
T
G
E
I
A
G
K
R
R
E
Q
D
V
K
W
M
W
A
L
V
H
E
R
L
H
Q
R
L
V
G
S
A
E
V
R
Q
A
T
A
E
A
E
R
A
V
A
G
G
E
H
S
P
A
A
G
A
D
A
I
A
T
L
I
G
L
---
23
PsiBlast_CBE
80.82
58%
-98
- C6 -
4JYC
1
?
D:
[18-327]
--------------------
G
D
R
A
A
L
A
R
A
I
T
L
A
E
S
R
R
A
D
H
R
A
A
V
R
D
L
I
D
A
V
----------
L
--------
P
Q
T
G
R
--
A
I
R
V
G
I
T
G
V
P
G
V
G
K
S
T
T
I
D
A
L
G
S
L
L
T
A
A
G
H
K
V
A
V
L
A
V
D
P
S
S
T
R
T
--------
T
R
M
A
R
L
A
I
D
R
N
A
F
I
R
P
S
P
S
S
G
T
L
G
G
V
A
A
K
T
R
E
T
M
L
L
C
E
A
A
G
F
D
V
I
L
V
E
T
V
G
V
G
Q
S
E
T
A
V
A
D
L
T
D
F
F
L
V
L
M
L
P
G
A
G
D
E
L
Q
G
I
K
K
G
I
F
E
L
A
D
M
I
A
V
N
K
A
D
D
G
D
G
E
R
R
-
A
S
A
A
A
S
E
Y
R
A
A
L
H
I
L
T
P
P
S
A
T
W
T
P
P
V
V
T
I
S
G
L
H
G
K
G
L
D
S
L
W
S
R
I
E
D
H
R
S
K
L
T
A
T
G
E
I
A
G
K
R
R
E
Q
D
V
K
W
M
W
A
L
V
H
E
R
L
H
Q
R
L
V
G
S
A
E
V
R
Q
A
T
A
E
A
E
R
A
V
A
G
G
E
H
S
P
A
A
G
A
D
A
I
A
T
L
I
-----
11
PsiBlast_PDB
80.15
50%
-128
- C6 -
2WWW
2
MMAA_HUMAN
A:
[17-343]
----------
V
D
K
L
Y
T
G
L
I
Q
G
Q
R
A
C
L
A
E
A
I
T
L
V
E
S
T
H
S
R
K
K
E
L
A
Q
V
L
L
Q
K
V
----------
L
L
Y
H
R
E
Q
E
Q
S
N
K
G
K
PL
A
F
R
V
G
L
S
G
P
P
G
A
G
K
S
T
F
I
E
Y
F
G
K
M
L
T
E
R
G
H
K
L
S
V
L
A
V
D
P
----------------
T
E
L
S
R
D
M
N
A
Y
I
R
P
S
---------
T
R
T
T
N
E
A
I
L
L
C
E
G
A
G
Y
D
I
I
L
I
E
T
V
G
V
--
S
E
F
A
V
A
D
M
V
D
M
F
V
L
L
L
P
P
A
------------
I
E
M
A
D
L
V
A
V
T
K
S
-
D
G
D
L
I
V
P
-
A
R
R
I
Q
A
E
Y
V
S
A
L
K
L
L
R
-----
W
K
P
K
V
I
R
I
S
A
R
S
G
E
G
I
S
E
M
W
D
K
M
K
D
F
Q
D
L
M
L
A
S
G
E
L
T
A
K
R
R
K
Q
Q
K
V
W
M
W
N
L
I
Q
E
S
V
L
E
H
F
R
T
H
P
T
V
R
E
Q
I
P
L
L
E
Q
K
V
L
I
G
A
L
S
P
G
L
A
A
D
F
L
L
K
-------
24
PsiBlast_CBE
79.60
58%
-91
- C6 -
4JYB
1
?
B:
[18-329]
--------------------
G
D
R
A
A
L
A
R
A
I
T
L
A
E
S
R
R
A
D
H
R
A
A
V
R
D
L
I
D
A
V
----------
L
--------
P
Q
T
G
R
--
A
I
R
V
G
I
T
G
V
P
G
V
G
K
S
T
T
I
D
A
L
G
S
L
L
T
A
A
G
H
K
V
A
V
L
A
V
D
P
S
S
T
R
T
G
G
S
I
L
G
D
K
T
R
M
A
R
L
A
I
D
R
N
A
F
I
R
P
S
P
S
S
G
T
L
G
G
V
A
A
K
T
R
E
T
M
L
L
C
E
A
A
G
F
D
V
I
L
V
E
T
V
G
V
G
Q
S
E
T
A
V
A
D
L
T
D
F
F
L
V
L
M
L
P
G
--------
K
K
G
I
F
E
L
A
D
M
I
A
V
N
K
A
D
D
G
D
G
E
R
R
-
A
S
A
A
A
S
E
Y
R
A
A
L
H
I
L
T
P
P
S
A
T
W
T
P
P
V
V
T
I
S
G
L
H
G
K
G
L
D
S
L
W
S
R
I
E
D
H
R
S
K
L
T
A
T
G
E
I
A
G
K
R
R
E
Q
D
V
K
W
M
W
A
L
V
H
E
R
L
H
Q
R
L
V
G
S
A
E
V
R
Q
A
T
A
E
A
E
R
A
V
A
G
G
E
H
S
P
A
A
G
A
D
A
I
A
T
L
I
G
L
---
8
PsiBlast_PDB
79.42
58%
-95
- C6 -
4JYC
-
?
A:
[18-327]
--------------------
G
D
R
A
A
L
A
R
A
I
T
L
A
E
S
R
R
A
D
H
R
A
A
V
R
D
L
I
D
A
V
----------
L
--------
P
Q
T
G
R
--
A
I
R
V
G
I
T
G
V
P
G
V
G
K
S
T
T
I
D
A
L
G
S
L
L
T
A
A
G
H
K
V
A
V
L
A
V
D
P
S
S
T
R
T
G
G
S
I
L
G
D
K
T
R
M
A
R
L
A
I
D
R
N
A
F
I
R
P
S
P
S
S
G
T
L
G
G
V
A
A
K
T
R
E
T
M
L
L
C
E
A
A
G
F
D
V
I
L
V
E
T
V
G
V
G
Q
S
E
T
A
V
A
D
L
T
D
F
F
L
V
L
M
L
P
---------
K
K
G
I
F
E
L
A
D
M
I
A
V
N
K
A
--
G
D
G
E
R
R
-
A
S
A
A
A
S
E
Y
R
A
A
L
H
I
L
T
P
P
S
A
T
W
T
P
P
V
V
T
I
S
G
L
H
G
K
G
L
D
S
L
W
S
R
I
E
D
H
R
S
K
L
T
A
T
G
E
I
A
G
K
R
R
E
Q
D
V
K
W
M
W
A
L
V
H
E
R
L
H
Q
R
L
V
G
S
A
E
V
R
Q
A
T
A
E
A
E
R
A
V
A
G
G
E
H
S
P
A
A
G
A
D
A
I
A
T
L
I
-----
116
HHSearch
79.37
50%
-121
- C6 -
2WWW
2
MMAA_HUMAN
A:
[13-347]
------
E
Q
R
F
V
D
K
L
Y
T
G
L
I
Q
G
Q
R
A
C
L
A
E
A
I
T
L
V
E
S
T
H
S
R
K
K
E
L
A
Q
V
L
L
Q
K
V
L
L
Y
H
R
E
Q
E
Q
S
N
--------
K
G
K
P
L
--
A
F
R
V
G
L
S
G
P
P
G
A
G
K
S
T
F
I
E
Y
F
G
K
M
L
T
E
R
G
H
K
L
S
V
L
A
V
D
P
----------------
T
E
L
S
R
D
M
N
A
Y
I
R
P
S
---------
T
R
T
T
N
E
A
I
L
L
C
E
G
A
G
Y
D
I
I
L
I
E
T
V
G
V
--
S
E
F
A
V
A
D
M
V
D
M
F
V
L
L
L
P
P
A
------------
I
E
M
A
D
L
V
A
V
T
K
S
-
D
G
D
L
I
V
P
-
A
R
R
I
Q
A
E
Y
V
S
A
L
K
L
L
R
-----
W
K
P
K
V
I
R
I
S
A
R
S
G
E
G
I
S
E
M
W
D
K
M
K
D
F
Q
D
L
M
L
A
S
G
E
L
T
A
K
R
R
K
Q
Q
K
V
W
M
W
N
L
I
Q
E
S
V
L
E
H
F
R
T
H
P
T
V
R
E
Q
I
P
L
L
E
Q
K
V
L
I
G
A
L
S
P
G
L
A
A
D
F
L
L
K
A
F
K
S
---
28
PsiBlast_CBE
79.04
50%
-128
- C6 -
2WWW
1
MMAA_HUMAN
B:
[17-343]
----------
V
D
K
L
Y
T
G
L
I
Q
G
Q
R
A
C
L
A
E
A
I
T
L
V
E
S
T
H
S
R
K
K
E
L
A
Q
V
L
L
Q
K
V
----------
L
L
Y
H
R
E
Q
E
Q
S
N
K
G
K
PL
A
F
R
V
G
L
S
G
P
P
G
A
G
K
S
T
F
I
E
Y
F
G
K
M
L
T
E
R
G
H
K
L
S
V
L
A
V
D
-----------------
T
E
L
S
R
D
M
N
A
Y
I
R
P
----------
T
R
T
T
N
E
A
I
L
L
C
E
G
A
G
Y
D
I
I
L
I
E
T
V
--
G
Q
S
E
F
A
V
A
D
M
V
D
M
F
V
L
L
L
P
P
------------
I
I
E
M
A
D
L
V
A
V
T
K
S
-
D
G
D
L
I
V
P
-
A
R
R
I
Q
A
E
Y
V
S
A
L
K
L
L
R
K
R
S
Q
V
W
K
P
K
V
I
R
I
S
A
R
S
G
E
G
I
S
E
M
W
D
K
M
K
D
F
Q
D
L
M
L
A
S
G
E
L
T
A
K
R
R
K
Q
Q
K
V
W
M
W
N
L
I
Q
E
S
V
L
E
H
F
R
T
H
P
T
V
R
E
Q
I
P
L
L
E
Q
K
V
L
I
G
A
L
S
P
G
L
A
A
D
F
L
L
K
-------
27
PsiBlast_CBE
78.77
50%
-126
- C6 -
2WWW
2
MMAA_HUMAN
C:
[17-343]
----------
V
D
K
L
Y
T
G
L
I
Q
G
Q
R
A
C
L
A
E
A
I
T
L
V
E
S
T
H
S
R
K
K
E
L
A
Q
V
L
L
Q
K
V
----------
L
L
Y
H
R
E
Q
E
Q
S
N
K
G
K
PL
A
F
R
V
G
L
S
G
P
P
G
A
G
K
S
T
F
I
E
Y
F
G
K
M
L
T
E
R
G
H
K
L
S
V
L
A
V
D
P
S
---------------
T
E
L
S
R
D
M
N
A
Y
I
R
----------
V
T
R
T
T
N
E
A
I
L
L
C
E
G
A
G
Y
D
I
I
L
I
E
T
V
G
V
G
Q
S
E
F
A
V
A
D
M
V
D
M
F
V
L
L
L
P
P
A
------------
I
E
M
A
D
L
V
A
V
T
K
S
-
D
G
D
L
I
V
P
-
A
R
R
I
Q
A
E
Y
V
S
A
L
K
L
L
R
K
----
W
K
P
K
V
I
R
I
S
A
R
S
G
E
G
I
S
E
M
W
D
K
M
K
D
F
Q
D
L
M
L
A
S
G
E
L
T
A
K
R
R
K
Q
Q
K
V
W
M
W
N
L
I
Q
E
S
V
L
E
H
F
R
T
H
P
T
V
R
E
Q
I
P
L
L
E
Q
K
V
L
I
G
A
L
S
P
G
L
A
A
D
F
L
L
K
-------
26
PsiBlast_CBE
78.56
50%
-116
- C6 -
2WWW
2
MMAA_HUMAN
D:
[17-343]
----------
V
D
K
L
Y
T
G
L
I
Q
G
Q
R
A
C
L
A
E
A
I
T
L
V
E
S
T
H
S
R
K
K
E
L
A
Q
V
L
L
Q
K
V
----------
L
L
Y
H
R
E
Q
E
Q
S
N
K
G
K
PL
A
F
R
V
G
L
S
G
P
P
G
A
G
K
S
T
F
I
E
Y
F
G
K
M
L
T
E
R
G
H
K
L
S
V
L
A
V
D
P
S
---------------
T
E
L
S
R
D
M
N
A
Y
I
R
P
S
P
T
R
--------
T
T
N
E
A
I
L
L
C
E
G
A
G
Y
D
I
I
L
I
E
T
V
G
V
G
Q
S
E
F
A
V
A
D
M
V
D
M
F
V
L
L
L
P
P
A
-------
I
K
R
G
I
I
E
M
A
D
L
V
A
V
T
K
S
-
D
G
D
L
I
V
P
-
A
R
R
I
Q
A
E
Y
V
S
A
L
K
L
L
R
K
R
S
Q
V
W
K
P
K
V
I
R
I
S
A
R
S
G
E
G
I
S
E
M
W
D
K
M
K
D
F
Q
D
L
M
L
A
S
G
E
L
T
A
K
R
R
K
Q
Q
K
V
W
M
W
N
L
I
Q
E
S
V
L
E
H
F
R
T
H
P
T
V
R
E
Q
I
P
L
L
E
Q
K
V
L
I
G
A
L
S
P
G
L
A
A
D
F
L
L
K
-------