@TOME V2.3
(Mar 2018)
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 : B0VMF0: (2017-11-07 )
MSNANRYTGLVDRYRDRLPVSATTRAISLGEGNTPLIKLENIPRIIGKDVEIYVKYEGLNPTGSFKDRGMTMAVTKAVEEGSKAIICASTGNTSAAAAAYAARAGIKAFVLIPEGKIAMGKMAQAMMYGAITMQIRGNFDDGMRLVKEVADQAPVTIVNSINPYRLQGQKTIAYEIVEALGRAPDYHCLPVGNAGNITAHWMGYTEAVANQPADQFEQVVYDAATDQFTGPKPEGLPTMVGYQASGAAPFLRGAPVEKPETVATAIRIGNPQSWNHAKAVVRDSKGWFDELQDSEILEAQRLLSMYEGVFVEPASAASIGGAIRDIKAGKIAEGSVIVCTVTGNGLKDPDTAIKQCADAVMLSIDATMDQVKDSILSNM
Atome Classification :
(21 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.......
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MSNA
N
R
Y
T
G
L
V
D
R
Y
R
DRLPVSA
T
T
R
A
I
S
LGEGNT
P
L
I
K
LENI
P
R
I
IGKD
V
E
I
Y
V
K
YEGLNPTGSFKDRGM
T
M
A
V
T
K
A
V
EEGS
K
A
I
I
C
ASTGNT
S
A
A
A
A
A
Y
A
ARAG
I
K
A
F
V
L
IPEG
K
I
A
M
G
K
M
A
Q
A
M
M
Y
G
A
I
T
M
Q
I
R
GN
F
D
D
G
M
R
L
V
K
E
V
ADQA
P
-
V
T
I
VNSIN
P
Y
R
LQGQ
K
T
I
A
Y
E
I
V
E
A
LGRAPDY
H
C
L
PVGNAG
N
I
T
A
H
WMG
Y
T
E
A
V
ANQ
P
A
D
Q
F
E
Q
V
V
Y
DAATDQFTGPKPEGLP
T
M
V
G
YQASGAAPFLRGAPVEKPE
T
V
A
T
A
I
RIGNPQSW
N
H
A
K
A
V
VRDSKG
W
F
D
ELQ
D
S
E
I
L
E
A
Q
R
L
L
S
M
YE
G
V
F
VEPASAASIGG
A
I
R
DIKAGKIAEG
S
V
I
V
C
T
VTGNGLKD
P
D
T
A
I
K
Q
C
A
D
A
V
M
L
S
I
D
A
T
M
D
Q
V
K
D
S
I
LSNM
66
HHSearch
91.66
57%
-73
- C3 -
-
2ZSJ
1
?
A:
[3-335]
-----
R
W
Q
G
I
I
K
Q
Y
K
K
Y
L
P
V
D
E
N
T
P
I
V
T
L
Y
E
G
N
T
P
L
I
E
A
D
N
L
A
R
A
I
G
F
K
G
K
I
Y
L
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
I
S
K
A
V
E
A
G
K
R
A
V
I
C
A
S
T
G
N
T
S
A
S
A
A
A
Y
A
A
R
A
G
L
R
A
Y
V
L
L
P
K
G
A
V
A
I
G
K
L
S
Q
A
M
I
Y
G
A
K
V
L
A
I
Q
G
T
F
D
D
A
L
N
I
V
R
K
I
G
E
N
F
P
-
V
E
I
V
N
S
V
N
P
Y
R
I
E
G
Q
K
T
A
A
F
E
I
C
D
T
L
G
E
A
P
D
Y
H
F
I
P
V
G
N
A
G
N
I
T
A
Y
W
K
G
F
K
I
Y
Y
E
E
--------------------
G
K
I
T
K
L
P
R
M
M
G
W
Q
A
E
G
A
A
P
I
V
K
G
Y
P
I
K
N
P
Q
T
I
A
T
A
I
K
I
G
N
P
Y
S
W
K
S
A
L
K
A
A
Q
E
S
G
G
K
I
D
A
V
S
D
S
E
I
L
Y
A
Y
K
L
I
A
S
T
E
G
V
F
C
E
P
A
S
A
A
S
V
A
G
L
I
K
L
V
R
E
G
F
F
K
G
G
E
V
V
T
C
T
L
T
G
N
G
L
K
D
P
D
T
A
I
K
V
C
E
E
---------------------
67
HHSearch
90.09
55%
-65
- C3 -
-
3AEY
-
?
B:
[2-333]
------
R
P
P
L
I
E
R
Y
R
N
L
L
P
V
S
E
K
T
P
V
I
S
L
L
E
G
S
T
P
L
I
P
L
K
G
P
E
E
A
R
K
K
G
I
R
L
Y
A
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
V
S
K
A
V
E
G
G
A
Q
A
V
A
C
A
S
T
G
N
T
A
A
S
A
A
A
Y
A
A
R
A
G
I
L
A
I
V
V
L
P
A
G
Y
-
A
L
G
K
V
A
Q
S
L
V
H
G
A
R
I
V
Q
V
E
G
N
F
D
D
A
L
R
L
T
Q
K
L
T
E
A
F
P
-
V
A
L
V
N
S
V
N
P
H
R
L
E
G
Q
K
T
L
A
F
E
V
V
D
E
L
G
D
A
P
H
Y
H
A
L
P
V
G
N
A
G
N
I
T
A
H
W
M
G
Y
K
A
Y
H
A
L
--------------------
G
K
A
K
R
L
P
R
M
L
G
F
Q
A
A
G
A
A
P
L
V
L
G
R
P
V
E
R
P
E
T
L
A
T
A
I
R
I
G
N
P
A
S
W
Q
G
A
V
R
A
K
E
E
S
G
G
V
I
E
A
V
T
D
E
E
I
L
F
A
Y
R
Y
L
A
R
E
E
G
I
F
C
E
P
A
S
A
A
A
M
A
G
V
F
K
L
L
R
E
G
R
L
E
P
E
S
T
V
V
L
T
L
T
G
H
G
L
K
D
P
A
T
A
E
R
V
A
E
L
---------------------
1
PsiBlast_PDB
89.15
52%
-74
- C3 -
-
2ZSJ
1
?
A:
[3-346]
-----
R
W
Q
G
I
I
K
Q
Y
K
K
Y
L
P
V
D
E
N
T
P
I
V
T
L
Y
E
G
N
T
P
L
I
E
A
D
N
L
A
R
A
I
G
F
K
G
K
I
Y
L
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
I
S
K
A
V
E
A
G
K
R
A
V
I
C
A
S
T
G
N
T
S
A
S
A
A
A
Y
A
A
R
A
G
L
R
A
Y
V
L
L
P
K
G
A
V
A
I
G
K
L
S
Q
A
M
I
Y
G
A
K
V
L
A
I
Q
G
T
F
D
D
A
L
N
I
V
R
K
I
G
E
N
F
P
-
V
E
I
V
N
S
V
N
P
Y
R
I
E
G
Q
K
T
A
A
F
E
I
C
D
T
L
G
E
A
P
D
Y
H
F
I
P
V
G
N
A
G
N
I
T
A
Y
W
K
G
F
-------------
K
I
Y
Y
E
E
G
-------
K
I
T
K
L
P
R
M
M
G
W
Q
A
E
G
A
A
P
I
V
K
G
Y
P
I
K
N
P
Q
T
I
A
T
A
I
K
I
G
N
P
Y
S
W
K
S
A
L
K
A
A
Q
E
S
G
G
K
I
D
A
V
S
D
S
E
I
L
Y
A
Y
K
L
I
A
S
T
E
G
V
F
C
E
P
A
S
A
A
S
V
A
G
L
I
K
L
V
R
E
G
F
F
K
G
G
E
V
V
T
C
T
L
T
G
N
G
L
K
D
P
D
T
A
I
K
V
C
E
E
P
I
T
V
P
P
D
--
F
D
E
V
--------
21
PsiBlast_CBE
88.83
52%
-69
- C3 -
-
2ZSJ
1
?
D:
[3-346]
-----
R
W
Q
G
I
I
K
Q
Y
K
K
Y
L
P
V
D
E
N
T
P
I
V
T
L
Y
E
G
N
T
P
L
I
E
A
D
N
L
A
R
A
I
G
F
K
G
K
I
Y
L
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
I
S
K
A
V
E
A
G
K
R
A
V
I
C
A
S
T
G
N
T
S
A
S
A
A
A
Y
A
A
R
A
G
L
R
A
Y
V
L
L
P
K
G
--
A
I
G
K
L
S
Q
A
M
I
Y
G
A
K
V
L
A
I
Q
G
T
F
D
D
A
L
N
I
V
R
K
I
G
E
N
F
P
-
V
E
I
V
N
S
V
N
P
Y
R
I
E
G
Q
K
T
A
A
F
E
I
C
D
T
L
G
E
A
P
D
Y
H
F
I
P
V
G
N
A
G
N
I
T
A
Y
W
K
G
F
-------------
K
I
Y
Y
E
E
G
-------
K
I
T
K
L
P
R
M
M
G
W
Q
A
E
G
A
A
P
I
V
K
G
Y
P
I
K
N
P
Q
T
I
A
T
A
I
K
I
G
N
P
Y
S
W
K
S
A
L
K
A
A
Q
E
S
G
G
K
I
D
A
V
S
D
S
E
I
L
Y
A
Y
K
L
I
A
S
T
E
G
V
F
C
E
P
A
S
A
A
S
V
A
G
L
I
K
L
V
R
E
G
F
F
K
G
G
E
V
V
T
C
T
L
T
G
N
G
L
K
D
P
D
T
A
I
K
V
C
E
E
P
I
T
V
P
P
D
--
F
D
E
V
--------
22
PsiBlast_CBE
88.75
52%
-74
- C3 -
-
2ZSJ
1
?
C:
[3-346]
-----
R
W
Q
G
I
I
K
Q
Y
K
K
Y
L
P
V
D
E
N
T
P
I
V
T
L
Y
E
G
N
T
P
L
I
E
A
D
N
L
A
R
A
I
G
F
K
G
K
I
Y
L
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
I
S
K
A
V
E
A
G
K
R
A
V
I
C
A
S
T
G
N
T
S
A
S
A
A
A
Y
A
A
R
A
G
L
R
A
Y
V
L
L
P
K
G
A
V
A
I
G
K
L
S
Q
A
M
I
Y
G
A
K
V
L
A
I
Q
G
T
F
D
D
A
L
N
I
V
R
K
I
G
E
N
F
P
-
V
E
I
V
N
S
V
N
P
Y
R
I
E
G
Q
K
T
A
A
F
E
I
C
D
T
L
G
E
A
P
D
Y
H
F
I
P
V
G
N
A
G
N
I
T
A
Y
W
K
G
F
-------------
K
I
Y
Y
E
E
G
-------
K
I
T
K
L
P
R
M
M
G
W
Q
A
E
G
A
A
P
I
V
K
G
Y
P
I
K
N
P
Q
T
I
A
T
A
I
K
I
G
N
P
Y
S
W
K
S
A
L
K
A
A
Q
E
S
G
G
K
I
D
A
V
S
D
S
E
I
L
Y
A
Y
K
L
I
A
S
T
E
G
V
F
C
E
P
A
S
A
A
S
V
A
G
L
I
K
L
V
R
E
G
F
F
K
G
G
E
V
V
T
C
T
L
T
G
N
G
L
K
D
P
D
T
A
I
K
V
C
E
E
P
I
T
V
P
P
D
--
F
D
E
V
--------
69
HHSearch
88.47
59%
-48
- C3 -
-
2D1F
1
THRC_MYCTU
A:
[11-340]
-----
P
W
P
G
V
I
A
A
Y
R
D
R
L
P
V
G
D
D
W
T
P
V
T
L
L
E
G
G
T
P
L
I
A
A
T
N
L
S
K
Q
T
--
G
C
T
I
H
L
K
V
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
M
A
V
T
D
A
L
A
H
G
Q
R
A
V
L
C
A
S
T
G
N
T
S
A
S
A
A
A
Y
A
A
R
A
G
I
T
C
A
V
L
I
P
Q
G
K
I
A
M
G
K
L
A
Q
A
V
M
H
G
A
K
I
I
Q
I
D
G
N
F
D
D
C
L
E
L
A
R
K
M
A
A
D
F
P
T
I
S
L
V
N
S
V
N
P
V
R
I
E
G
Q
K
T
A
A
F
E
I
V
D
V
L
G
T
A
P
D
V
H
A
L
P
V
G
N
A
G
N
I
T
A
Y
W
K
G
Y
T
E
Y
H
Q
L
--------------------
G
L
I
D
K
L
P
R
M
L
G
T
Q
A
A
G
A
A
P
L
V
L
G
E
P
V
S
H
P
E
T
I
A
T
A
I
R
I
G
S
P
A
S
W
T
S
A
V
E
A
Q
Q
Q
S
K
G
R
F
L
A
A
S
D
E
E
I
L
A
A
Y
H
L
V
A
R
V
E
G
V
F
V
E
P
A
S
A
A
S
I
A
G
L
L
K
A
I
D
D
G
W
V
A
R
G
S
T
V
V
C
T
V
T
G
N
G
L
K
D
P
D
T
A
L
K
D
M
-----------------------
3
PsiBlast_PDB
88.38
53%
-67
- C3 -
-
1UIM
1
?
A:
[5-327]
---------
L
I
E
R
Y
R
N
L
L
P
V
S
E
K
T
P
V
I
S
L
L
E
G
S
T
P
L
I
P
L
K
G
P
E
E
A
R
K
K
G
I
R
L
Y
A
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
V
S
K
A
V
E
G
G
A
Q
A
V
A
C
A
S
T
G
N
T
A
A
S
A
A
A
Y
A
A
R
A
G
I
L
A
I
V
V
L
P
A
G
Y
V
A
L
G
K
V
A
Q
S
L
V
H
G
A
R
I
V
Q
V
E
G
N
F
D
D
A
L
R
L
T
Q
K
L
T
E
A
F
P
-
V
A
L
V
N
S
V
N
P
H
R
L
E
G
Q
K
T
L
A
F
E
V
V
D
E
L
G
D
A
P
H
Y
H
A
L
P
V
G
N
A
G
N
I
T
A
H
W
M
G
Y
K
--------------
A
Y
H
A
L
G
------
K
A
K
R
L
P
R
M
L
G
F
Q
A
A
G
A
A
P
L
V
L
G
R
P
V
E
R
P
E
T
L
A
T
A
I
R
I
G
N
P
A
S
W
Q
G
A
V
R
A
K
E
E
S
G
G
V
I
E
A
V
T
D
E
E
I
L
F
A
Y
R
Y
L
A
R
E
E
G
I
F
C
E
P
A
S
A
A
A
M
A
G
V
F
K
L
L
R
E
G
R
L
E
P
E
S
T
V
V
L
T
L
T
G
H
G
L
K
D
P
A
T
A
---------------------------
68
HHSearch
88.36
55%
-53
- C3 -
-
1V7C
1
?
C:
[1-333]
-----
M
R
P
P
L
I
E
R
Y
R
N
L
L
P
V
S
E
K
T
P
V
I
S
L
L
E
G
S
T
P
L
I
P
L
K
G
P
E
E
A
R
K
K
G
I
R
L
Y
A
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
V
S
K
A
V
E
G
G
A
Q
A
V
A
C
A
S
T
G
N
T
A
A
S
A
A
A
Y
A
A
R
A
G
I
L
A
I
V
V
L
P
A
G
Y
V
A
L
G
K
V
A
Q
S
L
V
H
G
A
R
I
V
Q
V
E
G
N
F
D
D
A
L
R
L
T
Q
K
L
T
E
A
F
P
-
V
A
L
V
N
S
V
N
P
H
R
L
E
G
Q
K
T
L
A
F
E
V
V
D
E
L
G
D
A
P
H
Y
H
A
L
P
V
G
N
A
G
N
I
T
A
H
W
M
G
Y
K
A
Y
H
A
L
--------------------
G
K
A
K
R
L
P
R
M
L
G
F
Q
A
A
G
A
A
P
L
V
L
G
R
P
V
E
R
P
E
T
L
A
T
A
I
R
I
G
N
P
A
S
W
Q
G
A
V
R
A
K
E
E
S
G
G
V
I
E
A
V
T
D
E
E
I
L
F
A
Y
R
Y
L
A
R
E
E
G
I
F
C
E
P
A
S
A
A
A
M
A
G
V
F
K
L
L
R
E
G
R
L
E
P
E
S
T
V
V
L
T
L
T
G
H
G
L
K
D
P
A
T
A
E
R
V
A
E
L
---------------------
7
PsiBlast_PDB
87.76
53%
-67
- C3 -
-
3AEY
-
?
A:
[5-327]
---------
L
I
E
R
Y
R
N
L
L
P
V
S
E
K
T
P
V
I
S
L
L
E
G
S
T
P
L
I
P
L
K
G
P
E
E
A
R
K
K
G
I
R
L
Y
A
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
V
S
K
A
V
E
G
G
A
Q
A
V
A
C
A
S
T
G
N
T
A
A
S
A
A
A
Y
A
A
R
A
G
I
L
A
I
V
V
L
P
A
G
Y
V
A
L
G
K
V
A
Q
S
L
V
H
G
A
R
I
V
Q
V
E
G
N
F
D
D
A
L
R
L
T
Q
K
L
T
E
A
F
P
-
V
A
L
V
N
S
V
N
P
H
R
L
E
G
Q
K
T
L
A
F
E
V
V
D
E
L
G
D
A
P
H
Y
H
A
L
P
V
G
N
A
G
N
I
T
A
H
W
M
G
Y
K
--------------
A
Y
H
A
L
G
------
K
A
K
R
L
P
R
M
L
G
F
Q
A
A
G
A
A
P
L
V
L
G
R
P
V
E
R
P
E
T
L
A
T
A
I
R
I
G
N
P
A
S
W
Q
G
A
V
R
A
K
E
E
S
G
G
V
I
E
A
V
T
D
E
E
I
L
F
A
Y
R
Y
L
A
R
E
E
G
I
F
C
E
P
A
S
A
A
A
M
A
G
V
F
K
L
L
R
E
G
R
L
E
P
E
S
T
V
V
L
T
L
T
G
H
G
L
K
D
P
A
T
A
---------------------------
27
PsiBlast_CBE
87.63
53%
-54
- C3 -
-
1V7C
1
?
D:
[5-327]
---------
L
I
E
R
Y
R
N
L
L
P
V
S
E
K
T
P
V
I
S
L
L
E
G
S
T
P
L
I
P
L
K
G
P
E
E
A
R
K
K
G
I
R
L
Y
A
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
V
S
K
A
V
E
G
G
A
Q
A
V
A
C
A
S
T
G
N
T
A
A
S
A
A
A
Y
A
A
R
A
G
I
L
A
I
V
V
L
P
A
G
Y
V
A
L
G
K
V
A
Q
S
L
V
H
G
A
R
I
V
Q
V
E
G
N
F
D
D
A
L
R
L
T
Q
K
L
T
E
A
F
P
-
V
A
L
V
N
S
V
N
P
H
R
L
E
G
Q
K
T
L
A
F
E
V
V
D
E
L
G
D
A
P
H
Y
H
A
L
P
V
G
N
A
G
N
I
T
A
H
W
M
G
Y
K
--------------
A
Y
H
A
L
G
------
K
A
K
R
L
P
R
M
L
G
F
Q
A
A
G
A
A
P
L
V
L
G
R
P
V
E
R
P
E
T
L
A
T
A
I
R
I
G
N
P
A
S
W
Q
G
A
V
R
A
K
E
E
S
G
G
V
I
E
A
V
T
D
E
E
I
L
F
A
Y
R
Y
L
A
R
E
E
G
I
F
C
E
P
A
S
A
A
A
M
A
G
V
F
K
L
L
R
E
G
R
L
E
P
E
S
T
V
V
L
T
L
T
G
H
G
L
K
D
P
A
T
A
---------------------------
4
PsiBlast_PDB
87.31
53%
-64
- C3 -
-
1UIN
1
?
A:
[5-327]
---------
L
I
E
R
Y
R
N
L
L
P
V
S
E
K
T
P
V
I
S
L
L
E
G
S
T
P
L
I
P
L
K
G
P
E
E
A
R
K
K
G
I
R
L
Y
A
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
V
S
K
A
V
E
G
G
A
Q
A
V
A
C
A
S
T
G
N
T
A
A
S
A
A
A
Y
A
A
R
A
G
I
L
A
I
V
V
L
P
A
G
Y
V
A
L
G
K
V
A
Q
S
L
V
H
G
A
R
I
V
Q
V
E
G
N
F
D
D
A
L
R
L
T
Q
K
L
T
E
A
F
P
-
V
A
L
V
N
S
V
N
P
H
R
L
E
G
Q
K
T
L
A
F
E
V
V
D
E
L
G
D
A
P
H
Y
H
A
L
P
V
G
N
A
G
N
I
T
A
H
W
M
G
Y
K
--------------
A
Y
H
A
L
G
------
K
A
K
R
L
P
R
M
L
G
F
Q
A
A
G
A
A
P
L
V
L
G
R
P
V
E
R
P
E
T
L
A
T
A
I
R
I
G
N
P
A
S
W
Q
G
A
V
R
A
K
E
E
S
G
G
V
I
E
A
V
T
D
E
E
I
L
F
A
Y
R
Y
L
A
R
E
E
G
I
F
C
E
P
A
S
A
A
A
M
A
G
V
F
K
L
L
R
E
G
R
L
E
P
E
S
T
V
V
L
T
L
T
G
H
G
L
K
D
P
A
T
A
---------------------------
24
PsiBlast_CBE
87.24
56%
-46
- C3 -
-
2D1F
1
THRC_MYCTU
B:
[12-338]
------
W
P
G
V
I
A
A
Y
R
D
R
L
P
V
G
D
D
W
T
P
V
T
L
L
E
G
G
T
P
L
I
A
A
T
N
L
S
K
Q
T
G
--
C
T
I
H
L
K
V
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
M
A
V
T
D
A
L
A
H
G
Q
R
A
V
L
C
A
S
T
G
N
T
S
A
S
A
A
A
Y
A
A
R
A
G
I
T
C
A
V
L
I
P
Q
G
K
I
A
M
G
K
L
A
Q
A
V
M
H
G
A
K
I
I
Q
I
D
G
N
F
D
D
C
L
E
L
A
R
K
M
A
A
D
F
P
T
I
S
L
V
N
S
V
N
P
V
R
I
E
G
Q
K
T
A
A
F
E
I
V
D
V
L
G
T
A
P
D
V
H
A
L
P
V
G
N
A
G
N
I
T
A
Y
W
K
G
Y
T
E
---------
Y
H
Q
L
---
G
L
I
D
K
--------
L
P
R
M
L
G
T
Q
A
A
G
A
A
P
L
V
L
G
E
P
V
S
H
P
E
T
I
A
T
A
I
R
I
G
S
P
A
S
W
T
S
A
V
E
A
Q
Q
Q
S
K
G
R
F
L
A
A
S
D
E
E
I
L
A
A
Y
H
L
V
A
R
V
E
G
V
F
V
E
P
A
S
A
A
S
I
A
G
L
L
K
A
I
D
D
G
W
V
A
R
G
S
T
V
V
C
T
V
T
G
N
G
L
K
D
P
D
T
A
L
K
-------------------------
23
PsiBlast_CBE
87.18
52%
-71
- C3 -
-
2ZSJ
1
?
B:
[3-346]
-----
R
W
Q
G
I
I
K
Q
Y
K
K
Y
L
P
V
D
E
N
T
P
I
V
T
L
Y
E
G
N
T
P
L
I
E
A
D
N
L
A
R
A
I
G
F
K
G
K
I
Y
L
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
I
S
K
A
V
E
A
G
K
R
A
V
I
C
A
S
T
G
N
T
S
A
S
A
A
A
Y
A
A
R
A
G
L
R
A
Y
V
L
L
P
K
G
A
V
A
I
G
K
L
S
Q
A
M
I
Y
G
A
K
V
L
A
I
Q
G
T
F
D
D
A
L
N
I
V
R
K
I
G
E
N
F
P
-
V
E
I
V
N
S
V
N
P
Y
R
I
E
G
Q
K
T
A
A
F
E
I
C
D
T
L
G
E
A
P
D
Y
H
F
I
P
V
G
N
A
G
N
I
T
A
Y
W
K
G
F
-------------
K
I
Y
Y
E
E
G
-------
K
I
T
K
L
P
R
M
M
G
W
Q
A
E
G
A
A
P
I
V
K
G
Y
P
I
K
N
P
Q
T
I
A
T
A
I
K
I
G
N
P
Y
S
W
K
S
A
L
K
A
A
Q
E
S
G
G
K
I
D
A
V
S
D
S
E
I
L
Y
A
Y
K
L
I
A
S
T
E
G
V
F
C
E
P
A
S
A
A
S
V
A
G
L
I
K
L
V
R
E
G
F
F
K
G
G
E
V
V
T
C
T
L
T
G
N
G
L
K
D
P
D
T
A
I
K
V
C
E
E
P
I
T
V
P
P
D
--
F
D
E
V
--------
26
PsiBlast_CBE
87.14
53%
-56
- C3 -
-
3AEX
1
?
B:
[5-327]
---------
L
I
E
R
Y
R
N
L
L
P
V
S
E
K
T
P
V
I
S
L
L
E
G
S
T
P
L
I
P
L
K
G
P
E
E
A
R
K
K
G
I
R
L
Y
A
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
V
S
K
A
V
E
G
G
A
Q
A
V
A
C
A
S
T
G
N
T
A
A
S
A
A
A
Y
A
A
R
A
G
I
L
A
I
V
V
L
P
A
G
Y
V
A
L
G
K
V
A
Q
S
L
V
H
G
A
R
I
V
Q
V
E
G
N
F
D
D
A
L
R
L
T
Q
K
L
T
E
A
F
P
-
V
A
L
V
N
S
V
N
P
H
R
L
E
G
Q
K
T
L
A
F
E
V
V
D
E
L
G
D
A
P
H
Y
H
A
L
P
V
G
N
A
G
N
I
T
A
H
W
M
G
Y
K
--------------
A
Y
H
A
L
G
------
K
A
K
R
L
P
R
M
L
G
F
Q
A
A
G
A
A
P
L
V
L
G
R
P
V
E
R
P
E
T
L
A
T
A
I
R
I
G
N
P
A
S
W
Q
G
A
V
R
A
K
E
E
S
G
G
V
I
E
A
V
T
D
E
E
I
L
F
A
Y
R
Y
L
A
R
E
E
G
I
F
C
E
P
A
S
A
A
A
M
A
G
V
F
K
L
L
R
E
G
R
L
E
P
E
S
T
V
V
L
T
L
T
G
H
G
L
K
D
P
A
T
A
---------------------------
5
PsiBlast_PDB
86.40
53%
-57
- C3 -
-
1V7C
1
?
A:
[5-327]
---------
L
I
E
R
Y
R
N
L
L
P
V
S
E
K
T
P
V
I
S
L
L
E
G
S
T
P
L
I
P
L
K
G
P
E
E
A
R
K
K
G
I
R
L
Y
A
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
V
S
K
A
V
E
G
G
A
Q
A
V
A
C
A
S
T
G
N
T
A
A
S
A
A
A
Y
A
A
R
A
G
I
L
A
I
V
V
L
P
A
G
Y
V
A
L
G
K
V
A
Q
S
L
V
H
G
A
R
I
V
Q
V
E
G
N
F
D
D
A
L
R
L
T
Q
K
L
T
E
A
F
P
-
V
A
L
V
N
S
V
N
P
H
R
L
E
G
Q
K
T
L
A
F
E
V
V
D
E
L
G
D
A
P
H
Y
H
A
L
P
V
G
N
A
G
N
I
T
A
H
W
M
G
Y
K
--------------
A
Y
H
A
L
G
------
K
A
K
R
L
P
R
M
L
G
F
Q
A
A
G
A
A
P
L
V
L
G
R
P
V
E
R
P
E
T
L
A
T
A
I
R
I
G
N
P
A
S
W
Q
G
A
V
R
A
K
E
E
S
G
G
V
I
E
A
V
T
D
E
E
I
L
F
A
Y
R
Y
L
A
R
E
E
G
I
F
C
E
P
A
S
A
A
A
M
A
G
V
F
K
L
L
R
E
G
R
L
E
P
E
S
T
V
V
L
T
L
T
G
H
G
L
K
D
P
A
T
A
---------------------------
29
PsiBlast_CBE
86.36
53%
-55
- C3 -
-
1V7C
1
?
B:
[5-327]
---------
L
I
E
R
Y
R
N
L
L
P
V
S
E
K
T
P
V
I
S
L
L
E
G
S
T
P
L
I
P
L
K
G
P
E
E
A
R
K
K
G
I
R
L
Y
A
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
V
S
K
A
V
E
G
G
A
Q
A
V
A
C
A
S
T
G
N
T
A
A
S
A
A
A
Y
A
A
R
A
G
I
L
A
I
V
V
L
P
A
G
Y
V
A
L
G
K
V
A
Q
S
L
V
H
G
A
R
I
V
Q
V
E
G
N
F
D
D
A
L
R
L
T
Q
K
L
T
E
A
F
P
-
V
A
L
V
N
S
V
N
P
H
R
L
E
G
Q
K
T
L
A
F
E
V
V
D
E
L
G
D
A
P
H
Y
H
A
L
P
V
G
N
A
G
N
I
T
A
H
W
M
G
Y
K
--------------
A
Y
H
A
L
G
------
K
A
K
R
L
P
R
M
L
G
F
Q
A
A
G
A
A
P
L
V
L
G
R
P
V
E
R
P
E
T
L
A
T
A
I
R
I
G
N
P
A
S
W
Q
G
A
V
R
A
K
E
E
S
G
G
V
I
E
A
V
T
D
E
E
I
L
F
A
Y
R
Y
L
A
R
E
E
G
I
F
C
E
P
A
S
A
A
A
M
A
G
V
F
K
L
L
R
E
G
R
L
E
P
E
S
T
V
V
L
T
L
T
G
H
G
L
K
D
P
A
T
A
---------------------------
2
PsiBlast_PDB
86.32
56%
-47
- C3 -
-
2D1F
1
THRC_MYCTU
A:
[12-338]
------
W
P
G
V
I
A
A
Y
R
D
R
L
P
V
G
D
D
W
T
P
V
T
L
L
E
G
G
T
P
L
I
A
A
T
N
L
S
K
Q
T
G
--
C
T
I
H
L
K
V
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
M
A
V
T
D
A
L
A
H
G
Q
R
A
V
L
C
A
S
T
G
N
T
S
A
S
A
A
A
Y
A
A
R
A
G
I
T
C
A
V
L
I
P
Q
G
K
I
A
M
G
K
L
A
Q
A
V
M
H
G
A
K
I
I
Q
I
D
G
N
F
D
D
C
L
E
L
A
R
K
M
A
A
D
F
P
T
I
S
L
V
N
S
V
N
P
V
R
I
E
G
Q
K
T
A
A
F
E
I
V
D
V
L
G
T
A
P
D
V
H
A
L
P
V
G
N
A
G
N
I
T
A
Y
W
K
G
Y
T
E
---------
Y
H
Q
L
---
G
L
I
D
K
--------
L
P
R
M
L
G
T
Q
A
A
G
A
A
P
L
V
L
G
E
P
V
S
H
P
E
T
I
A
T
A
I
R
I
G
S
P
A
S
W
T
S
A
V
E
A
Q
Q
Q
S
K
G
R
F
L
A
A
S
D
E
E
I
L
A
A
Y
H
L
V
A
R
V
E
G
V
F
V
E
P
A
S
A
A
S
I
A
G
L
L
K
A
I
D
D
G
W
V
A
R
G
S
T
V
V
C
T
V
T
G
N
G
L
K
D
P
D
T
A
L
K
-------------------------
31
PsiBlast_CBE
86.25
53%
-69
- C3 -
-
1UIM
1
?
B:
[5-327]
---------
L
I
E
R
Y
R
N
L
L
P
V
S
E
K
T
P
V
I
S
L
L
E
G
S
T
P
L
I
P
L
K
G
P
E
E
A
R
K
K
G
I
R
L
Y
A
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
V
S
K
A
V
E
G
G
A
Q
A
V
A
C
A
S
T
G
N
T
A
A
S
A
A
A
Y
A
A
R
A
G
I
L
A
I
V
V
L
P
A
G
Y
V
A
L
G
K
V
A
Q
S
L
V
H
G
A
R
I
V
Q
V
E
G
N
F
D
D
A
L
R
L
T
Q
K
L
T
E
A
F
P
-
V
A
L
V
N
S
V
N
P
H
R
L
E
G
Q
K
T
L
A
F
E
V
V
D
E
L
G
D
A
P
H
Y
H
A
L
P
V
G
N
A
G
N
I
T
A
H
W
M
G
Y
K
--------------
A
Y
H
A
L
G
------
K
A
K
R
L
P
R
M
L
G
F
Q
A
A
G
A
A
P
L
V
L
G
R
P
V
E
R
P
E
T
L
A
T
A
I
R
I
G
N
P
A
S
W
Q
G
A
V
R
A
K
E
E
S
G
G
V
I
E
A
V
T
D
E
E
I
L
F
A
Y
R
Y
L
A
R
E
E
G
I
F
C
E
P
A
S
A
A
A
M
A
G
V
F
K
L
L
R
E
G
R
L
E
P
E
S
T
V
V
L
T
L
T
G
H
G
L
K
D
P
A
T
A
---------------------------
30
PsiBlast_CBE
86.14
53%
-68
- C3 -
-
1UIN
1
?
B:
[5-327]
---------
L
I
E
R
Y
R
N
L
L
P
V
S
E
K
T
P
V
I
S
L
L
E
G
S
T
P
L
I
P
L
K
G
P
E
E
A
R
K
K
G
I
R
L
Y
A
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
V
S
K
A
V
E
G
G
A
Q
A
V
A
C
A
S
T
G
N
T
A
A
S
A
A
A
Y
A
A
R
A
G
I
L
A
I
V
V
L
P
A
G
-
V
A
L
G
K
V
A
Q
S
L
V
H
G
A
R
I
V
Q
V
E
G
N
F
D
D
A
L
R
L
T
Q
K
L
T
E
A
F
P
-
V
A
L
V
N
S
V
N
P
H
R
L
E
G
Q
K
T
L
A
F
E
V
V
D
E
L
G
D
A
P
H
Y
H
A
L
P
V
G
N
A
G
N
I
T
A
H
W
M
G
Y
K
--------------
A
Y
H
A
L
G
------
K
A
K
R
L
P
R
M
L
G
F
Q
A
A
G
A
A
P
L
V
L
G
R
P
V
E
R
P
E
T
L
A
T
A
I
R
I
G
N
P
A
S
W
Q
G
A
V
R
A
K
E
E
S
G
G
V
I
E
A
V
T
D
E
E
I
L
F
A
Y
R
Y
L
A
R
E
E
G
I
F
C
E
P
A
S
A
A
A
M
A
G
V
F
K
L
L
R
E
G
R
L
E
P
E
S
T
V
V
L
T
L
T
G
H
G
L
K
D
P
A
T
A
---------------------------
28
PsiBlast_CBE
85.96
53%
-55
- C3 -
-
1V7C
1
?
C:
[5-327]
---------
L
I
E
R
Y
R
N
L
L
P
V
S
E
K
T
P
V
I
S
L
L
E
G
S
T
P
L
I
P
L
K
G
P
E
E
A
R
K
K
G
I
R
L
Y
A
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
V
S
K
A
V
E
G
G
A
Q
A
V
A
C
A
S
T
G
N
T
A
A
S
A
A
A
Y
A
A
R
A
G
I
L
A
I
V
V
L
P
A
G
Y
V
A
L
G
K
V
A
Q
S
L
V
H
G
A
R
I
V
Q
V
E
G
N
F
D
D
A
L
R
L
T
Q
K
L
T
E
A
F
P
-
V
A
L
V
N
S
V
N
P
H
R
L
E
G
Q
K
T
L
A
F
E
V
V
D
E
L
G
D
A
P
H
Y
H
A
L
P
V
G
N
A
G
N
I
T
A
H
W
M
G
Y
K
--------------
A
Y
H
A
L
G
------
K
A
K
R
L
P
R
M
L
G
F
Q
A
A
G
A
A
P
L
V
L
G
R
P
V
E
R
P
E
T
L
A
T
A
I
R
I
G
N
P
A
S
W
Q
G
A
V
R
A
K
E
E
S
G
G
V
I
E
A
V
T
D
E
E
I
L
F
A
Y
R
Y
L
A
R
E
E
G
I
F
C
E
P
A
S
A
A
A
M
A
G
V
F
K
L
L
R
E
G
R
L
E
P
E
S
T
V
V
L
T
L
T
G
H
G
L
K
D
P
A
T
A
---------------------------
6
PsiBlast_PDB
85.75
53%
-54
- C3 -
-
3AEX
1
?
A:
[5-327]
---------
L
I
E
R
Y
R
N
L
L
P
V
S
E
K
T
P
V
I
S
L
L
E
G
S
T
P
L
I
P
L
K
G
P
E
E
A
R
K
K
G
I
R
L
Y
A
K
Y
E
G
L
N
P
T
G
S
F
K
D
R
G
M
T
L
A
V
S
K
A
V
E
G
G
A
Q
A
V
A
C
A
S
T
G
N
T
A
A
S
A
A
A
Y
A
A
R
A
G
I
L
A
I
V
V
L
P
A
G
Y
V
A
L
G
K
V
A
Q
S
L
V
H
G
A
R
I
V
Q
V
E
G
N
F
D
D
A
L
R
L
T
Q
K
L
T
E
A
F
P
-
V
A
L
V
N
S
V
N
P
H
R
L
E
G
Q
K
T
L
A
F
E
V
V
D
E
L
G
D
A
P
H
Y
H
A
L
P
V
G
N
A
G
N
I
T
A
H
W
M
G
Y
K
--------------
A
Y
H
A
L
G
------
K
A
K
R
L
P
R
M
L
G
F
Q
A
A
G
A
A
P
L
V
L
G
R
P
V
E
R
P
E
T
L
A
T
A
I
R
I
G
N
P
A
S
W
Q
G
A
V
R
A
K
E
E
S
G
G
V
I
E
A
V
T
D
E
E
I
L
F
A
Y
R
Y
L
A
R
E
E
G
I
F
C
E
P
A
S
A
A
A
M
A
G
V
F
K
L
L
R
E
G
R
L
E
P
E
S
T
V
V
L
T
L
T
G
H
G
L
K
D
P
A
T
A
---------------------------