@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 : PA3397: (2016-02-16 )
MSNLYTERVLSVHHWNDTLFSFKTTRNPGLRFKTGQFVMIGLEVDGRPLMRAYSIASPNYEEHLEFFSIKVPDGPLTSRLQHLKEGDELMVSRKPTGTLVHDDLLPGKHLYLLSTGTGMAPFLSVIQDPETYERYEKVILVHGVRWVSELAYADFITKVLPEHEYFGDQVKEKLIYYPLVTREPFRNQGRQTDLMRSGKLFEDIGLPPMNPQDDRAMICGSPSMLEETSAVLDSFGLKISPRMGEPGDYLIERAFVEK
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)
MSN
L
Y
T
E
R
V
L
S
V
HHWND
T
L
F
S
F
KTTRNPG
L
R
F
KTG
Q
F
V
M
I
G
L
-
E
VD-GRP
L
M
R
A
Y
SIASP
N
Y
E
E
H
L
E
F
F
S
I
---------KVPDG
P
L
T
S
R
L
Q
H
L
KEGD
E
L
M
VSRK-PTG
T
-
L
VHDDLLPG
K
H
L
Y
L
L
STGTG
M
A
P
F
L
S
V
IQD
P
E
T
Y
E
R
Y
E
K
V
I
L
V
H
G
V
R
W
V
S
E
L
A
Y
A
D
F
I
T
K
VLPE
H
E
Y
F
G
D
Q
V
K
E
K
L
I
YYPLVTRE--
P
F
--RNQ--GRQ
T
D
L
M
RSGK
L
F
E
DIGLPPMNPQDD
R
A
M
ICG
S
P
S
M
L
E
E
T
S
A
V
L
D
SFG-
L
K
ISPRMGEP
G
D
Y
L
I
E
R
A
FVEK
2
PsiBlast_PDB
99.52
100%
-115
- C4 -
3CRZ
2
?
A:
[1-257]
-
S
N
L
Y
T
E
R
V
L
S
V
H
H
W
N
D
T
L
F
S
F
K
T
T
R
N
P
G
L
R
F
K
T
G
Q
F
V
M
I
G
L
-
E
V
D
-
G
R
P
L
M
R
A
Y
S
I
A
S
P
N
Y
E
E
H
L
E
F
F
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
L
K
E
G
D
E
L
M
V
S
R
K
-
P
T
G
T
-
L
V
H
D
D
L
L
P
G
K
H
L
Y
L
L
S
T
G
T
G
M
A
P
F
L
S
V
I
Q
D
P
E
T
Y
E
R
Y
E
K
V
I
L
V
H
G
V
R
W
V
S
E
L
A
Y
A
D
F
I
T
K
V
L
P
E
H
E
Y
F
G
D
Q
V
K
E
K
L
I
Y
Y
P
L
V
T
R
E
--
P
F
--
R
N
Q
--
G
R
Q
T
D
L
M
R
S
G
K
L
F
E
D
I
G
L
P
P
M
N
P
Q
D
D
R
A
M
I
C
G
S
P
S
M
L
E
E
T
S
A
V
L
D
S
F
G
-
L
K
I
S
P
R
M
G
E
P
G
D
Y
L
I
E
R
A
F
V
E
K
1
PsiBlast_PDB
99.36
100%
-112
- C4 -
2QDX
2
?
A:
[1-257]
-
S
N
L
Y
T
E
R
V
L
S
V
H
H
W
N
D
T
L
F
S
F
K
T
T
R
N
P
G
L
R
F
K
T
G
Q
F
V
M
I
G
L
-
E
V
D
-
G
R
P
L
M
R
A
Y
S
I
A
S
P
N
Y
E
E
H
L
E
F
F
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
L
K
E
G
D
E
L
M
V
S
R
K
-
P
T
G
T
-
L
V
H
D
D
L
L
P
G
K
H
L
Y
L
L
S
T
G
T
G
M
A
P
F
L
S
V
I
Q
D
P
E
T
Y
E
R
Y
E
K
V
I
L
V
H
G
V
R
W
V
S
E
L
A
Y
A
D
F
I
T
K
V
L
P
E
H
E
Y
F
G
D
Q
V
K
E
K
L
I
Y
Y
P
L
V
T
R
E
--
P
F
--
R
N
Q
--
G
R
Q
T
D
L
M
R
S
G
K
L
F
E
D
I
G
L
P
P
M
N
P
Q
D
D
R
A
M
I
C
G
S
P
S
M
L
E
E
T
S
A
V
L
D
S
F
G
-
L
K
I
S
P
R
M
G
E
P
G
D
Y
L
I
E
R
A
F
V
E
K
45
HHSearch
99.06
100%
-113
- C4 -
2QDX
2
?
A:
[2-257]
--
N
L
Y
T
E
R
V
L
S
V
H
H
W
N
D
T
L
F
S
F
K
T
T
R
N
P
G
L
R
F
K
T
G
Q
F
V
M
I
G
L
-
E
V
D
-
G
R
P
L
M
R
A
Y
S
I
A
S
P
N
Y
E
E
H
L
E
F
F
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
L
K
E
G
D
E
L
M
V
S
R
K
-
P
T
G
T
-
L
V
H
D
D
L
L
P
G
K
H
L
Y
L
L
S
T
G
T
G
M
A
P
F
L
S
V
I
Q
D
P
E
T
Y
E
R
Y
E
K
V
I
L
V
H
G
V
R
W
V
S
E
L
A
Y
A
D
F
I
T
K
V
L
P
E
H
E
Y
F
G
D
Q
V
K
E
K
L
I
Y
Y
P
L
V
T
R
E
--
P
F
--
R
N
Q
--
G
R
Q
T
D
L
M
R
S
G
K
L
F
E
D
I
G
L
P
P
M
N
P
Q
D
D
R
A
M
I
C
G
S
P
S
M
L
E
E
T
S
A
V
L
D
S
F
G
-
L
K
I
S
P
R
M
G
E
P
G
D
Y
L
I
E
R
A
F
V
E
K
3
PsiBlast_PDB
95.04
85%
-115
- C4 -
1A8P
1
FENR_AZOVI
A:
[2-258]
-
S
N
L
N
V
E
R
V
L
S
V
H
H
W
N
D
T
L
F
S
F
K
T
T
R
N
P
S
L
R
F
E
N
G
Q
F
V
M
I
G
L
-
E
V
D
-
G
R
P
L
M
R
A
Y
S
I
A
S
P
N
Y
E
E
H
L
E
F
F
S
I
---------
K
V
Q
N
G
P
L
T
S
R
L
Q
H
L
K
E
G
D
E
L
M
V
S
R
K
-
P
T
G
T
-
L
V
T
S
D
L
L
P
G
K
H
L
Y
M
L
S
T
G
T
G
L
A
P
F
M
S
L
I
Q
D
P
E
V
Y
E
R
F
E
K
V
V
L
I
H
G
V
R
Q
V
N
E
L
A
Y
Q
Q
F
I
T
E
H
L
P
Q
S
E
Y
F
G
E
A
V
K
E
K
L
I
Y
Y
P
T
V
T
R
E
--
S
F
--
H
N
Q
--
G
R
L
T
D
L
M
R
S
G
K
L
F
E
D
I
G
L
P
P
I
N
P
Q
D
D
R
A
M
I
C
G
S
P
S
M
L
D
E
S
C
E
V
L
D
G
F
G
-
L
K
I
S
P
R
M
G
E
P
G
D
Y
L
I
E
R
A
F
V
E
K
4
PsiBlast_PDB
86.27
62%
-114
- C4 -
4B4D
2
?
A:
[7-262]
--
A
F
G
A
E
T
V
L
E
V
R
H
W
T
D
A
Y
F
S
F
T
T
T
R
D
A
G
F
R
F
E
N
G
Q
F
V
M
I
G
L
-
E
T
E
-
T
R
P
L
L
R
A
Y
S
I
A
S
A
N
W
E
E
H
L
E
F
F
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
Q
P
G
D
K
V
L
V
G
K
K
-
P
T
G
T
-
L
L
I
S
D
L
H
P
G
R
N
L
Y
L
L
G
T
G
T
G
L
A
P
W
L
S
I
I
K
D
P
E
T
Y
E
R
F
D
K
V
I
L
T
Q
G
V
R
F
V
Q
D
L
A
Y
R
D
Y
F
E
R
E
L
P
Q
H
E
F
L
G
D
L
L
R
E
K
L
L
Y
Y
P
A
V
T
R
E
--
T
F
--
A
N
Q
--
G
R
L
T
E
L
M
A
D
G
R
M
Q
Q
T
L
G
L
P
T
L
D
P
A
N
D
R
F
M
I
C
G
S
P
Q
M
L
A
D
L
R
S
L
L
D
S
R
G
-
F
Q
T
S
P
R
I
G
T
P
G
H
Y
V
F
E
R
A
F
V
E
K
5
PsiBlast_PDB
85.32
62%
-116
- C4 -
4F7D
-
?
A:
[17-270]
-
S
K
F
D
T
A
T
V
L
S
V
H
H
W
T
D
T
L
F
S
F
T
C
T
R
D
Q
A
L
R
F
N
N
G
E
F
T
M
V
G
L
-
E
V
D
-
G
K
P
L
T
R
A
Y
S
I
V
S
P
N
Y
E
E
H
L
E
F
F
S
I
---------
K
V
Q
N
G
P
L
T
S
R
L
Q
H
L
K
V
G
D
P
V
L
I
G
K
K
-
P
T
G
T
-
L
V
A
D
N
L
L
P
G
K
T
L
W
M
L
S
T
G
T
G
L
A
P
F
M
S
I
I
R
D
P
D
I
Y
E
R
F
D
K
V
V
L
T
H
T
C
R
L
K
G
E
L
A
Y
M
D
Y
I
K
H
D
L
P
G
H
E
Y
L
G
D
V
I
R
E
K
L
V
Y
Y
P
T
V
T
--------------
R
I
T
D
L
I
A
S
G
K
L
F
T
D
L
D
M
P
P
F
S
P
E
Q
D
R
V
M
L
C
G
S
T
A
M
L
K
D
T
T
E
L
L
K
K
A
G
-
L
-
V
E
G
K
N
S
A
P
G
H
Y
V
I
E
R
A
F
V
--
21
PsiBlast_CBE
84.83
62%
-114
- C4 -
4FK8
1
?
B:
[17-271]
-
S
K
F
D
T
A
T
V
L
S
V
H
H
W
T
D
T
L
F
S
F
T
C
T
R
D
Q
A
L
R
F
N
N
G
E
F
T
M
V
G
L
-
E
V
D
-
G
K
P
L
T
R
A
Y
S
I
V
S
P
N
Y
E
E
H
L
E
F
F
S
I
---------
K
V
Q
N
G
P
L
T
S
R
L
Q
H
L
K
V
G
D
P
V
L
I
G
K
K
-
P
T
G
T
-
L
V
A
D
N
L
L
P
G
K
T
L
W
M
L
S
T
G
T
G
L
A
P
F
M
S
I
I
R
D
P
D
I
Y
E
R
F
D
K
V
V
L
T
H
T
C
R
L
K
G
E
L
A
Y
M
D
Y
I
K
H
D
L
P
G
H
E
Y
L
G
D
V
I
R
E
K
L
V
Y
Y
P
T
V
---------------
R
I
T
D
L
I
A
S
G
K
L
F
T
D
L
D
M
P
P
F
S
P
E
Q
D
R
V
M
L
C
G
S
T
A
M
L
K
D
T
T
E
L
L
K
K
A
G
-
L
-
V
E
G
K
N
S
A
P
G
H
Y
V
I
E
R
A
F
V
D
-
6
PsiBlast_PDB
84.34
62%
-105
- C4 -
4FK8
1
?
A:
[18-271]
--
K
F
D
T
A
T
V
L
S
V
H
H
W
T
D
T
L
F
S
F
T
C
T
R
D
Q
A
L
R
F
N
N
G
E
F
T
M
V
G
L
-
E
V
D
-
G
K
P
L
T
R
A
Y
S
I
V
S
P
N
Y
E
E
H
L
E
F
F
S
I
---------
K
V
Q
N
G
P
L
T
S
R
L
Q
H
L
K
V
G
D
P
V
L
I
G
K
K
-
P
T
G
T
-
L
V
A
D
N
L
L
P
G
K
T
L
W
M
L
S
T
G
T
G
L
A
P
F
M
S
I
I
R
D
P
D
I
Y
E
R
F
D
K
V
V
L
T
H
T
C
R
L
K
G
E
L
A
Y
M
D
Y
I
K
H
D
L
P
G
H
E
Y
L
G
D
V
I
R
E
K
L
V
Y
Y
P
T
V
-----------
E
--
G
R
I
T
D
L
I
A
S
G
K
L
F
T
D
L
D
M
P
P
F
S
P
E
Q
D
R
V
M
L
C
G
S
T
A
M
L
K
D
T
T
E
L
L
K
K
A
G
-
L
-
V
E
G
K
N
S
A
P
G
H
Y
V
I
E
R
A
F
V
D
-
47
HHSearch
82.34
54%
-105
- C4 -
2BGI
7
?
A:
[16-269]
---
P
D
A
Q
T
V
T
S
V
R
H
W
T
D
T
L
F
S
F
R
V
T
R
P
Q
T
L
R
F
R
S
G
E
F
V
M
I
G
L
-
L
D
D
N
G
K
P
I
M
R
A
Y
S
I
A
S
P
A
W
D
E
E
L
E
F
Y
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
K
V
G
E
Q
I
I
L
R
-
P
K
P
V
G
T
-
L
V
I
D
A
L
L
P
G
K
R
L
W
F
L
A
T
G
T
G
I
A
P
F
A
S
L
M
R
E
P
E
A
Y
E
K
F
D
E
V
I
M
M
H
A
C
R
T
V
A
E
L
E
Y
G
R
Q
L
V
E
A
L
Q
E
D
P
L
I
G
E
L
V
E
G
K
L
K
Y
Y
P
T
T
T
R
E
--
E
F
--
H
H
M
--
G
R
I
T
D
N
L
A
S
G
K
V
F
E
D
L
G
I
A
P
M
N
P
E
T
D
R
A
M
V
C
G
S
L
A
F
N
V
D
V
M
K
V
L
E
S
Y
G
-
L
R
E
G
A
-
N
S
E
P
R
E
F
V
V
E
K
A
F
V
G
-
7
PsiBlast_PDB
81.75
53%
-104
- C4 -
2BGI
7
?
A:
[18-268]
-----
A
Q
T
V
T
S
V
R
H
W
T
D
T
L
F
S
F
R
V
T
R
P
Q
T
L
R
F
R
S
G
E
F
V
M
I
G
L
L
D
D
N
-
G
K
P
I
M
R
A
Y
S
I
A
S
P
A
W
D
E
E
L
E
F
Y
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
K
V
G
E
Q
I
I
L
R
P
K
-
P
V
G
T
-
L
V
I
D
A
L
L
P
G
K
R
L
W
F
L
A
T
G
T
G
I
A
P
F
A
S
L
M
R
E
P
E
A
Y
E
K
F
D
E
V
I
M
M
H
A
C
R
T
V
A
E
L
E
Y
G
R
Q
L
V
E
A
L
Q
E
D
P
L
I
G
E
L
V
E
G
K
L
K
Y
Y
P
T
T
T
R
E
--
E
F
--
H
H
M
--
G
R
I
T
D
N
L
A
S
G
K
V
F
E
D
L
G
I
A
P
M
N
P
E
T
D
R
A
M
V
C
G
S
L
A
F
N
V
D
V
M
K
V
L
E
S
Y
G
-
L
R
E
G
A
N
-
S
E
P
R
E
F
V
V
E
K
A
F
V
--
22
PsiBlast_CBE
81.68
53%
-109
- C4 -
2VNK
2
?
D:
[18-268]
-----
A
Q
T
V
T
S
V
R
H
W
T
D
T
L
F
S
F
R
V
T
R
P
Q
T
L
R
F
R
S
G
E
F
V
M
I
G
L
L
D
D
N
-
G
K
P
I
M
R
A
Y
S
I
A
S
P
A
W
D
E
E
L
E
F
Y
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
K
V
G
E
Q
I
I
L
R
P
K
-
P
V
G
T
-
L
V
I
D
A
L
L
P
G
K
R
L
W
F
L
A
T
G
T
G
I
A
P
F
A
S
L
M
R
E
P
E
A
Y
E
K
F
D
E
V
I
M
M
H
A
C
R
T
V
A
E
L
E
Y
G
R
Q
L
V
E
A
L
Q
E
D
P
L
I
G
E
L
V
E
G
K
L
K
Y
Y
P
T
T
T
R
E
--
E
F
--
H
H
M
--
G
R
I
T
D
N
L
A
S
G
K
V
F
E
D
L
G
I
A
P
M
N
P
E
T
D
R
A
M
V
C
G
S
L
A
F
N
V
D
V
M
K
V
L
E
S
Y
G
-
L
R
E
G
A
N
-
S
E
P
R
E
F
V
V
E
K
A
F
V
--
25
PsiBlast_CBE
81.54
53%
-109
- C4 -
2BGJ
1
?
D:
[18-268]
-----
A
Q
T
V
T
S
V
R
H
W
T
D
T
L
F
S
F
R
V
T
R
P
Q
T
L
R
F
R
S
G
E
F
V
M
I
G
L
L
D
D
N
-
G
K
P
I
M
R
A
Y
S
I
A
S
P
A
W
D
E
E
L
E
F
Y
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
K
V
G
E
Q
I
I
L
R
P
K
-
P
V
G
T
-
L
V
I
D
A
L
L
P
G
K
R
L
W
F
L
A
T
G
T
G
I
A
P
F
A
S
L
M
R
E
P
E
A
Y
E
K
F
D
E
V
I
M
M
H
A
C
R
T
V
A
E
L
E
Y
G
R
Q
L
V
E
A
L
Q
E
D
P
L
I
G
E
L
V
E
G
K
L
K
Y
Y
P
T
T
T
R
E
--
E
F
--
H
H
M
--
G
R
I
T
D
N
L
A
S
G
K
V
F
E
D
L
G
I
A
P
M
N
P
E
T
D
R
A
M
V
C
G
S
L
A
F
N
V
D
V
M
K
V
L
E
S
Y
G
-
L
R
E
G
A
N
-
S
E
P
R
E
F
V
V
E
K
A
F
V
--
24
PsiBlast_CBE
81.38
53%
-108
- C4 -
2VNK
2
?
B:
[18-268]
-----
A
Q
T
V
T
S
V
R
H
W
T
D
T
L
F
S
F
R
V
T
R
P
Q
T
L
R
F
R
S
G
E
F
V
M
I
G
L
L
D
D
N
-
G
K
P
I
M
R
A
Y
S
I
A
S
P
A
W
D
E
E
L
E
F
Y
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
K
V
G
E
Q
I
I
L
R
P
K
-
P
V
G
T
-
L
V
I
D
A
L
L
P
G
K
R
L
W
F
L
A
T
G
T
G
I
A
P
F
A
S
L
M
R
E
P
E
A
Y
E
K
F
D
E
V
I
M
M
H
A
C
R
T
V
A
E
L
E
Y
G
R
Q
L
V
E
A
L
Q
E
D
P
L
I
G
E
L
V
E
G
K
L
K
Y
Y
P
T
T
T
R
E
--
E
F
--
H
H
M
--
G
R
I
T
D
N
L
A
S
G
K
V
F
E
D
L
G
I
A
P
M
N
P
E
T
D
R
A
M
V
C
G
S
L
A
F
N
V
D
V
M
K
V
L
E
S
Y
G
-
L
R
E
G
A
N
-
S
E
P
R
E
F
V
V
E
K
A
F
V
--
8
PsiBlast_PDB
80.94
53%
-108
- C4 -
2BGJ
1
?
A:
[18-268]
-----
A
Q
T
V
T
S
V
R
H
W
T
D
T
L
F
S
F
R
V
T
R
P
Q
T
L
R
F
R
S
G
E
F
V
M
I
G
L
L
D
D
N
-
G
K
P
I
M
R
A
Y
S
I
A
S
P
A
W
D
E
E
L
E
F
Y
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
K
V
G
E
Q
I
I
L
R
P
K
-
P
V
G
T
-
L
V
I
D
A
L
L
P
G
K
R
L
W
F
L
A
T
G
T
G
I
A
P
F
A
S
L
M
R
E
P
E
A
Y
E
K
F
D
E
V
I
M
M
H
A
C
R
T
V
A
E
L
E
Y
G
R
Q
L
V
E
A
L
Q
E
D
P
L
I
G
E
L
V
E
G
K
L
K
Y
Y
P
T
T
T
R
E
--
E
F
--
H
H
M
--
G
R
I
T
D
N
L
A
S
G
K
V
F
E
D
L
G
I
A
P
M
N
P
E
T
D
R
A
M
V
C
G
S
L
A
F
N
V
D
V
M
K
V
L
E
S
Y
G
-
L
R
E
G
A
N
-
S
E
P
R
E
F
V
V
E
K
A
F
V
--
27
PsiBlast_CBE
80.92
53%
-108
- C4 -
2BGJ
1
?
B:
[18-268]
-----
A
Q
T
V
T
S
V
R
H
W
T
D
T
L
F
S
F
R
V
T
R
P
Q
T
L
R
F
R
S
G
E
F
V
M
I
G
L
L
D
D
N
-
G
K
P
I
M
R
A
Y
S
I
A
S
P
A
W
D
E
E
L
E
F
Y
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
K
V
G
E
Q
I
I
L
R
P
K
-
P
V
G
T
-
L
V
I
D
A
L
L
P
G
K
R
L
W
F
L
A
T
G
T
G
I
A
P
F
A
S
L
M
R
E
P
E
A
Y
E
K
F
D
E
V
I
M
M
H
A
C
R
T
V
A
E
L
E
Y
G
R
Q
L
V
E
A
L
Q
E
D
P
L
I
G
E
L
V
E
G
K
L
K
Y
Y
P
T
T
T
R
E
--
E
F
--
H
H
M
--
G
R
I
T
D
N
L
A
S
G
K
V
F
E
D
L
G
I
A
P
M
N
P
E
T
D
R
A
M
V
C
G
S
L
A
F
N
V
D
V
M
K
V
L
E
S
Y
G
-
L
R
E
G
A
N
-
S
E
P
R
E
F
V
V
E
K
A
F
V
--
23
PsiBlast_CBE
80.73
53%
-106
- C4 -
2VNK
2
?
C:
[18-268]
-----
A
Q
T
V
T
S
V
R
H
W
T
D
T
L
F
S
F
R
V
T
R
P
Q
T
L
R
F
R
S
G
E
F
V
M
I
G
L
L
D
D
N
-
G
K
P
I
M
R
A
Y
S
I
A
S
P
A
W
D
E
E
L
E
F
Y
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
K
V
G
E
Q
I
I
L
R
P
K
-
P
V
G
T
-
L
V
I
D
A
L
L
P
G
K
R
L
W
F
L
A
T
G
T
G
I
A
P
F
A
S
L
M
R
E
P
E
A
Y
E
K
F
D
E
V
I
M
M
H
A
C
R
T
V
A
E
L
E
Y
G
R
Q
L
V
E
A
L
Q
E
D
P
L
I
G
E
L
V
E
G
K
L
K
Y
Y
P
T
T
T
R
E
--
E
F
--
H
H
M
--
G
R
I
T
D
N
L
A
S
G
K
V
F
E
D
L
G
I
A
P
M
N
P
E
T
D
R
A
M
V
C
G
S
L
A
F
N
V
D
V
M
K
V
L
E
S
Y
G
-
L
R
E
G
A
N
-
S
E
P
R
E
F
V
V
E
K
A
F
V
--
28
PsiBlast_CBE
80.52
53%
-104
- C4 -
4K1X
1
?
B:
[3-250]
-----
A
Q
T
V
T
S
V
R
H
W
T
D
T
L
F
S
F
R
V
T
R
P
Q
T
L
R
F
R
S
G
E
F
V
M
I
G
L
L
D
D
N
-
G
K
P
I
M
R
A
Y
S
I
A
S
P
A
W
D
E
E
L
E
F
Y
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
K
V
G
E
Q
I
I
L
R
P
K
-
P
V
G
T
-
L
V
I
D
A
L
L
P
G
K
R
L
W
F
L
A
T
G
T
G
I
A
P
F
A
S
L
M
R
E
P
E
A
Y
E
K
F
D
E
V
I
M
M
H
A
C
R
T
V
A
E
L
E
Y
G
R
Q
L
V
E
A
L
Q
E
D
P
L
I
G
E
L
V
E
G
K
L
K
Y
Y
P
T
T
T
R
E
--
E
F
--
H
H
M
--
G
R
I
T
D
N
L
A
S
G
K
V
F
E
D
L
G
I
A
P
M
N
P
E
T
D
R
A
M
V
C
G
S
L
A
F
N
V
D
V
M
K
V
L
E
S
Y
G
-
L
R
E
G
A
N
-
S
E
P
R
E
F
V
V
E
K
-----
12
PsiBlast_PDB
80.40
53%
-105
- C4 -
2VNK
2
?
A:
[18-268]
-----
A
Q
T
V
T
S
V
R
H
W
T
D
T
L
F
S
F
R
V
T
R
P
Q
T
L
R
F
R
S
G
E
F
V
M
I
G
L
L
D
D
N
-
G
K
P
I
M
R
A
Y
S
I
A
S
P
A
W
D
E
E
L
E
F
Y
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
K
V
G
E
Q
I
I
L
R
P
K
-
P
V
G
T
-
L
V
I
D
A
L
L
P
G
K
R
L
W
F
L
A
T
G
T
G
I
A
P
F
A
S
L
M
R
E
P
E
A
Y
E
K
F
D
E
V
I
M
M
H
A
C
R
T
V
A
E
L
E
Y
G
R
Q
L
V
E
A
L
Q
E
D
P
L
I
G
E
L
V
E
G
K
L
K
Y
Y
P
T
T
T
R
E
--
E
F
--
H
H
M
--
G
R
I
T
D
N
L
A
S
G
K
V
F
E
D
L
G
I
A
P
M
N
P
E
T
D
R
A
M
V
C
G
S
L
A
F
N
V
D
V
M
K
V
L
E
S
Y
G
-
L
R
E
G
A
N
-
S
E
P
R
E
F
V
V
E
K
A
F
V
--
26
PsiBlast_CBE
80.35
53%
-106
- C4 -
2BGJ
1
?
C:
[18-268]
-----
A
Q
T
V
T
S
V
R
H
W
T
D
T
L
F
S
F
R
V
T
R
P
Q
T
L
R
F
R
S
G
E
F
V
M
I
G
L
L
D
D
N
-
G
K
P
I
M
R
A
Y
S
I
A
S
P
A
W
D
E
E
L
E
F
Y
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
K
V
G
E
Q
I
I
L
R
P
K
-
P
V
G
T
-
L
V
I
D
A
L
L
P
G
K
R
L
W
F
L
A
T
G
T
G
I
A
P
F
A
S
L
M
R
E
P
E
A
Y
E
K
F
D
E
V
I
M
M
H
A
C
R
T
V
A
E
L
E
Y
G
R
Q
L
V
E
A
L
Q
E
D
P
L
I
G
E
L
V
E
G
K
L
K
Y
Y
P
T
T
T
R
E
--
E
F
--
H
H
M
--
G
R
I
T
D
N
L
A
S
G
K
V
F
E
D
L
G
I
A
P
M
N
P
E
T
D
R
A
M
V
C
G
S
L
A
F
N
V
D
V
M
K
V
L
E
S
Y
G
-
L
R
E
G
A
N
-
S
E
P
R
E
F
V
V
E
K
A
F
V
--
11
PsiBlast_PDB
80.25
53%
-105
- C4 -
2VNJ
3
?
A:
[18-268]
-----
A
Q
T
V
T
S
V
R
H
W
T
D
T
L
F
S
F
R
V
T
R
P
Q
T
L
R
F
R
S
G
E
F
V
M
I
G
L
L
D
D
N
-
G
K
P
I
M
R
A
Y
S
I
A
S
P
A
W
D
E
E
L
E
F
Y
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
K
V
G
E
Q
I
I
L
R
P
K
-
P
V
G
T
-
L
V
I
D
A
L
L
P
G
K
R
L
W
F
L
A
T
G
T
G
I
A
P
F
A
S
L
M
R
E
P
E
A
Y
E
K
F
D
E
V
I
M
M
H
A
C
R
T
V
A
E
L
E
Y
G
R
Q
L
V
E
A
L
Q
E
D
P
L
I
G
E
L
V
E
G
K
L
K
Y
Y
P
T
T
T
R
E
--
E
F
--
H
H
M
--
G
R
I
T
D
N
L
A
S
G
K
V
F
E
D
L
G
I
A
P
M
N
P
E
T
D
R
A
M
V
C
G
S
L
A
F
N
V
D
V
M
K
V
L
E
S
Y
G
-
L
R
E
G
A
N
-
S
E
P
R
E
F
V
V
E
K
A
F
V
--
9
PsiBlast_PDB
80.19
53%
-103
- C4 -
2VNH
3
?
A:
[18-268]
-----
A
Q
T
V
T
S
V
R
H
W
T
D
T
L
F
S
F
R
V
T
R
P
Q
T
L
R
F
R
S
G
E
F
V
M
I
G
L
L
D
D
N
-
G
K
P
I
M
R
A
Y
S
I
A
S
P
A
W
D
E
E
L
E
F
Y
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
K
V
G
E
Q
I
I
L
R
P
K
-
P
V
G
T
-
L
V
I
D
A
L
L
P
G
K
R
L
W
F
L
A
T
G
T
G
I
A
P
F
A
S
L
M
R
E
P
E
A
Y
E
K
F
D
E
V
I
M
M
H
A
C
R
T
V
A
E
L
E
Y
G
R
Q
L
V
E
A
L
Q
E
D
P
L
I
G
E
L
V
E
G
K
L
K
Y
Y
P
T
T
T
R
E
--
E
F
--
H
H
M
--
G
R
I
T
D
N
L
A
S
G
K
V
F
E
D
L
G
I
A
P
M
N
P
E
T
D
R
A
M
V
C
G
S
L
A
F
N
V
D
V
M
K
V
L
E
S
Y
G
-
L
R
E
G
A
N
-
S
E
P
R
E
F
V
V
E
K
A
F
V
--
10
PsiBlast_PDB
80.09
53%
-101
- C4 -
2VNI
3
?
A:
[18-268]
-----
A
Q
T
V
T
S
V
R
H
W
T
D
T
L
F
S
F
R
V
T
R
P
Q
T
L
R
F
R
S
G
E
F
V
M
I
G
L
L
D
D
N
-
G
K
P
I
M
R
A
Y
S
I
A
S
P
A
W
D
E
E
L
E
F
Y
S
I
---------
K
V
P
D
G
P
L
T
S
R
L
Q
H
I
K
V
G
E
Q
I
I
L
R
P
K
-
P
V
G
T
-
L
V
I
D
A
L
L
P
G
K
R
L
W
F
L
A
T
G
T
G
I
A
P
F
A
S
L
M
R
E
P
E
A
Y
E
K
F
D
E
V
I
M
M
H
A
C
R
T
V
A
E
L
E
Y
G
R
Q
L
V
E
A
L
Q
E
D
P
L
I
G
E
L
V
E
G
K
L
K
Y
Y
P
T
T
T
R
E
--
E
F
--
H
H
M
--
G
R
I
T
D
N
L
A
S
G
K
V
F
E
D
L
G
I
A
P
M
N
P
E
T
D
R
A
M
V
C
G
S
L
A
F
N
V
D
V
M
K
V
L
E
S
Y
G
-
L
R
E
G
A
N
-
S
E
P
R
E
F
V
V
E
K
A
F
V
--
46
HHSearch
69.43
34%
-105
- C4 -
1FDR
1
FENR_ECOLI
A:
[2-248]
-
A
D
W
V
T
G
K
V
T
K
V
Q
N
W
T
D
A
L
F
S
L
T
V
H
A
P
-
V
L
P
F
T
A
G
Q
F
T
K
L
G
L
-
E
I
----
R
V
Q
R
A
Y
S
Y
V
N
S
P
D
N
P
D
L
E
F
Y
L
V
---------
T
V
P
D
G
K
L
S
P
R
L
A
A
L
K
P
G
D
E
V
Q
V
V
-
S
-
E
A
A
G
F
F
V
L
D
E
V
P
H
C
E
T
L
W
M
L
A
T
G
T
A
I
G
P
Y
L
S
I
L
R
L
G
K
D
L
D
R
F
K
N
L
V
L
V
H
A
A
R
Y
A
A
D
L
S
Y
L
P
L
M
Q
E
L
E
K
R
Y
E
-------
G
K
L
R
I
Q
T
V
V
S
R
E
--
T
A
A
G
S
L
T
--
G
R
I
P
A
L
I
E
S
G
E
L
E
S
T
I
G
L
-
P
M
N
K
E
T
S
H
V
M
L
C
G
N
P
Q
M
V
R
D
T
Q
Q
L
L
K
E
T
R
Q
M
T
K
H
-
L
R
R
R
P
G
H
M
T
A
E
H
Y
W
---
13
PsiBlast_PDB
67.72
36%
-112
- C4 -
1FDR
1
FENR_ECOLI
A:
[2-225]
-
A
D
W
V
T
G
K
V
T
K
V
Q
N
W
T
D
A
L
F
S
L
-
T
V
H
A
P
V
L
P
F
T
A
G
Q
F
T
K
L
G
L
-
E
I
----
R
V
Q
R
A
Y
S
Y
V
N
S
P
D
N
P
D
L
E
F
Y
L
V
---------
T
V
P
D
G
K
L
S
P
R
L
A
A
L
K
P
G
D
E
V
Q
V
V
S
E
-
A
A
G
F
-
F
V
L
D
E
V
P
H
C
E
T
L
W
M
L
A
T
G
T
A
I
G
P
Y
L
S
I
L
R
L
G
K
D
L
D
R
F
K
N
L
V
L
V
H
A
A
R
Y
A
A
D
L
S
Y
L
P
L
M
Q
E
L
--
E
K
R
Y
E
G
-----
K
L
R
I
Q
T
V
V
S
R
E
--
T
A
--
A
G
S
LT
G
R
I
P
A
L
I
E
S
G
E
L
E
S
T
I
G
L
-
P
M
N
K
E
T
S
H
V
M
L
C
G
N
P
Q
M
V
R
D
T
Q
Q
L
L
---------------------------
14
PsiBlast_PDB
66.82
35%
-108
- C4 -
3FPK
2
?
A:
[5-228]
-
A
D
W
V
T
G
K
V
T
K
V
Q
N
W
T
D
A
L
F
S
L
-
T
V
H
A
P
I
N
P
F
T
A
G
Q
F
T
K
L
G
L
-
E
I
D
-
G
E
R
V
Q
R
A
Y
S
Y
V
N
A
P
D
N
P
N
L
E
F
Y
L
V
---------
T
V
P
Q
G
K
L
S
P
R
L
A
A
L
K
P
G
D
E
V
Q
V
V
S
D
-
A
S
G
F
-
F
V
L
D
E
V
P
D
C
E
T
L
W
M
L
A
T
G
T
A
I
G
P
Y
L
S
I
L
Q
Y
G
Q
D
V
A
R
F
K
N
L
V
L
V
H
A
A
R
F
A
A
D
L
S
Y
L
P
L
M
L
E
L
--
Q
Q
R
Y
E
G
-----
K
L
R
I
Q
T
V
V
S
R
E
NV
P
G
--
S
L
T
--
G
R
V
P
A
L
I
E
N
G
E
L
E
K
A
V
G
L
-
P
M
D
K
E
T
S
H
V
M
L
C
G
N
P
Q
M
V
R
D
T
Q
Q
L
L
---------------------------
29
PsiBlast_CBE
66.51
35%
-108
- C4 -
3FPK
3
?
B:
[5-228]
-
A
D
W
V
T
G
K
V
T
K
V
Q
N
W
T
D
A
L
F
S
L
-
T
V
H
A
P
I
N
P
F
T
A
G
Q
F
T
K
L
G
L
-
E
I
D
-
G
E
R
V
Q
R
A
Y
S
Y
V
N
A
P
D
N
P
N
L
E
F
Y
L
V
---------
T
V
P
Q
G
K
L
S
P
R
L
A
A
L
K
P
G
D
E
V
Q
V
V
S
D
-
A
S
G
F
-
F
V
L
D
E
V
P
D
C
E
T
L
W
M
L
A
T
G
T
A
I
G
P
Y
L
S
I
L
Q
Y
G
Q
D
V
A
R
F
K
N
L
V
L
V
H
A
A
R
F
A
A
D
L
S
Y
L
P
L
M
L
E
L
--
Q
Q
R
Y
E
G
-----
K
L
R
I
Q
T
V
V
S
R
E
NV
P
G
--
S
L
T
--
G
R
V
P
A
L
I
E
N
G
E
L
E
K
A
V
G
L
-
P
M
D
K
E
T
S
H
V
M
L
C
G
N
P
Q
M
V
R
D
T
Q
Q
L
L
---------------------------
30
PsiBlast_CBE
66.37
33%
-106
- C4 -
2XNJ
13
FENR_ECOLI
B:
[12-249]
-
A
D
W
V
T
G
K
V
T
K
V
Q
N
W
T
D
A
L
F
S
L
-
T
V
H
A
P
V
L
P
F
T
A
G
Q
F
T
K
L
G
L
-
E
I
D
-
G
E
R
V
Q
R
A
Y
S
Y
V
N
S
P
D
N
P
D
L
E
F
Y
L
V
TVVYTNDAG
E
V
V
K
G
K
L
S
P
R
L
A
A
L
K
P
G
D
E
V
Q
V
V
S
E
-
A
A
G
F
-
F
V
L
D
E
V
P
H
C
E
T
L
W
M
L
A
T
G
T
A
I
G
P
Y
L
S
I
L
R
L
G
K
D
L
D
R
F
K
N
L
V
L
V
H
A
A
R
Y
A
A
D
L
S
Y
-------
L
P
L
M
Q
E
L
E
K
R
Y
E
G
K
L
R
I
Q
T
V
V
S
R
E
--
T
A
--
A
G
S
LT
G
R
I
P
A
L
I
E
S
G
E
L
E
S
T
I
G
L
-
P
M
N
K
E
T
S
H
V
M
L
C
G
N
P
Q
M
V
R
D
T
Q
Q
L
L
---------------------------