@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 : Q3XZY0: (2018-01-17 )
MRIAVFASGNGSNFQALADYLSKKGLESSIDWLFCDQPEAYVLKRATALSVPADCFSPKEFDSKKEYEEAILHKLKEKKIDLIVLAGYMRIIGPVLLKNYDKRIINIHPSLLPAFPGLHGIRDAFEAGVKETGVTIHYIDQGVDTGPIIRQEKVRIEQEDTFDSLEEKIHRVEHRIYPEVISEIIENGGYLK
Atome Classification :
(37 SA)
.........10........20........30........40........50........60........70........80........90........100.......110.......120.......130.......140.......150.......160.......170.......180.......190
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
M
R
I
A
V
F
ASGNGS
N
F
Q
A
L
A
D
Y
L
S
KKGLESSI
D
W
L
F
CDQP
E
A
Y
V
L
K
RATALSVPADCFSPKEFD
S
K
K
E
Y
E
E
A
I
L
H
K
L
K
EKKI
D
L
I
V
L
A
G
Y
M
R
I
I
G
P
V
L
L
K
NYDK
R
I
I
NIHP
S
L
L
P
AFPG
L
H
G
I
R
D
A
F
E
AG
V
K
ET
G
V
T
I
H
Y
IDQGVDTGP
I
I
R
Q
E
K
V
RIEQED
T
F
D
S
L
E
E
K
I
H
R
V
E
H
R
I
Y
P
E
V
I
S
E
I
I
ENGGYLK
125
HHSearch
94.85
53%
-160
- C5 -
-
4S1N
-
?
A:
[5-183]
K
K
I
A
V
F
A
S
G
N
G
S
N
F
Q
V
I
A
E
----
E
-
F
--
P
V
E
F
V
F
S
D
H
R
D
A
Y
V
L
E
R
A
K
Q
L
G
V
L
S
Y
A
F
E
L
K
E
F
E
S
K
A
D
Y
E
A
A
L
V
E
L
L
E
E
H
Q
I
D
L
V
C
L
A
G
Y
M
K
I
V
G
P
T
L
L
S
A
Y
E
G
R
I
V
N
I
H
P
A
Y
L
P
E
F
P
G
A
H
G
I
E
D
A
W
N
A
G
V
G
Q
S
G
V
T
I
H
W
V
D
S
G
V
D
T
G
Q
V
I
K
Q
V
R
V
P
R
L
A
D
D
T
I
D
R
F
E
A
R
I
H
E
A
E
Y
R
L
Y
P
E
V
V
K
A
L
F
T
------
115
HHSearch
94.65
49%
-155
- C5 -
-
3P9X
2
?
B:
[3-192]
K
R
V
A
I
F
A
S
G
S
G
T
N
A
E
A
I
I
Q
S
Q
K
A
G
Q
L
P
C
E
V
A
L
L
I
T
D
K
P
G
A
K
V
V
E
R
V
K
V
H
E
I
P
V
C
A
L
D
P
K
T
Y
P
S
K
E
A
Y
E
I
E
V
V
Q
Q
L
K
E
K
Q
I
D
F
V
V
L
A
G
Y
M
R
L
V
G
P
T
L
L
G
A
Y
E
G
R
I
V
N
I
H
P
S
L
L
P
A
F
P
G
L
H
A
I
E
Q
A
I
R
A
N
V
K
V
T
G
V
T
I
H
Y
V
D
E
G
M
D
T
G
P
I
I
A
Q
E
A
V
S
I
E
E
E
D
T
L
E
T
L
T
T
K
I
Q
A
V
E
H
R
L
Y
P
A
T
L
H
K
L
L
S
K
A
E
N
--
114
HHSearch
94.31
49%
-154
- C5 -
-
3P9X
1
?
A:
[3-192]
K
R
V
A
I
F
A
S
G
S
G
T
N
A
E
A
I
I
Q
S
Q
K
A
G
Q
L
P
C
E
V
A
L
L
I
T
D
K
P
G
A
K
V
V
E
R
V
K
V
H
E
I
P
V
C
A
L
D
P
K
T
Y
P
S
K
E
A
Y
E
I
E
V
V
Q
Q
L
K
E
K
Q
I
D
F
V
V
L
A
G
Y
M
R
L
V
G
P
T
L
L
G
A
Y
E
G
R
I
V
N
I
H
P
S
L
L
P
A
F
P
G
L
H
A
I
E
Q
A
I
R
A
N
V
K
V
T
G
V
T
I
H
Y
V
D
E
G
M
D
T
G
P
I
I
A
Q
E
A
V
S
I
E
E
E
D
T
L
E
T
L
T
T
K
I
Q
A
V
E
H
R
L
Y
P
A
T
L
H
K
L
L
S
K
A
E
N
--
21
PsiBlast_CBE
93.98
50%
-158
- C5 -
-
3P9X
2
?
B:
[4-190]
-
R
V
A
I
F
A
S
G
S
G
T
N
A
E
A
I
I
Q
S
Q
K
A
G
Q
L
P
C
E
V
A
L
L
I
T
D
K
P
G
A
K
V
V
E
R
V
K
V
H
E
I
P
V
C
A
L
D
P
K
T
Y
P
S
K
E
A
Y
E
I
E
V
V
Q
Q
L
K
E
K
Q
I
D
F
V
V
L
A
G
Y
M
R
L
V
G
P
T
L
L
G
A
Y
E
G
R
I
V
N
I
H
P
S
L
L
P
A
F
P
G
L
H
A
I
E
Q
A
I
R
A
N
V
K
V
T
G
V
T
I
H
Y
V
D
E
G
M
D
T
G
P
I
I
A
Q
E
A
V
S
I
E
E
E
D
T
L
E
T
L
T
T
K
I
Q
A
V
E
H
R
L
Y
P
A
T
L
H
K
L
L
S
K
A
----
2
PsiBlast_PDB
93.63
50%
-158
- C5 -
-
3P9X
1
?
A:
[4-190]
-
R
V
A
I
F
A
S
G
S
G
T
N
A
E
A
I
I
Q
S
Q
K
A
G
Q
L
P
C
E
V
A
L
L
I
T
D
K
P
G
A
K
V
V
E
R
V
K
V
H
E
I
P
V
C
A
L
D
P
K
T
Y
P
S
K
E
A
Y
E
I
E
V
V
Q
Q
L
K
E
K
Q
I
D
F
V
V
L
A
G
Y
M
R
L
V
G
P
T
L
L
G
A
Y
E
G
R
I
V
N
I
H
P
S
L
L
P
A
F
P
G
L
H
A
I
E
Q
A
I
R
A
N
V
K
V
T
G
V
T
I
H
Y
V
D
E
G
M
D
T
G
P
I
I
A
Q
E
A
V
S
I
E
E
E
D
T
L
E
T
L
T
T
K
I
Q
A
V
E
H
R
L
Y
P
A
T
L
H
K
L
L
S
K
A
----
3
PsiBlast_PDB
92.53
50%
-158
- C5 -
-
4S1N
-
?
A:
[6-183]
-
K
I
A
V
F
A
S
G
N
G
S
N
F
Q
V
I
A
E
-------
E
F
P
V
E
F
V
F
S
D
H
R
D
A
Y
V
L
E
R
A
K
Q
L
G
V
L
S
Y
A
F
E
L
K
E
F
E
S
K
A
D
Y
E
A
A
L
V
E
L
L
E
E
H
Q
I
D
L
V
C
L
A
G
Y
M
K
I
V
G
P
T
L
L
S
A
Y
E
G
R
I
V
N
I
H
P
A
Y
L
P
E
F
P
G
A
H
G
I
E
D
A
W
N
A
G
V
G
Q
S
G
V
T
I
H
W
V
D
S
G
V
D
T
G
Q
V
I
K
Q
V
R
V
P
R
L
A
D
D
T
I
D
R
F
E
A
R
I
H
E
A
E
Y
R
L
Y
P
E
V
V
K
A
L
F
T
------
123
HHSearch
90.64
38%
-176
- C5 -
-
3KCQ
1
?
C:
[9-194]
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
K
A
F
S
T
E
E
S
S
V
V
I
S
C
V
I
S
N
N
A
E
A
R
G
L
L
I
A
Q
S
Y
G
I
P
T
F
V
V
K
R
K
P
L
-----
D
I
E
H
I
S
T
V
L
R
E
H
D
V
D
L
V
C
L
A
G
F
M
S
I
L
P
E
K
F
V
T
D
W
H
H
K
I
I
N
I
H
P
S
L
L
P
S
F
K
G
L
N
A
Q
E
Q
A
Y
K
A
G
V
K
I
A
G
C
T
L
H
Y
V
Y
Q
E
L
D
A
G
P
I
I
M
Q
A
A
V
P
V
L
R
E
D
T
A
E
S
L
A
S
R
I
L
A
A
E
H
V
C
Y
P
K
G
V
K
L
I
A
Q
D
K
I
K
L
-
127
HHSearch
90.57
41%
-165
- C5 -
-
3AUF
-
?
A:
[2-191]
I
R
I
G
V
L
I
S
G
S
G
T
N
L
Q
A
I
L
D
G
C
R
E
G
R
I
P
G
R
V
A
V
V
I
S
D
R
A
D
A
Y
G
L
E
R
A
R
R
A
G
V
D
A
L
H
M
D
P
A
A
Y
P
S
R
T
A
F
D
A
A
L
A
E
R
L
Q
A
Y
G
V
D
L
V
C
L
A
G
Y
M
R
L
V
R
G
P
M
L
T
A
F
P
N
R
I
L
N
I
H
P
S
L
L
P
A
F
P
G
L
E
A
Q
R
Q
A
L
E
H
G
V
K
V
A
G
C
T
V
H
F
V
T
A
G
V
D
E
G
P
I
I
L
Q
A
A
V
P
V
L
E
G
D
T
V
E
D
L
R
R
R
I
L
A
E
E
H
R
I
Y
P
E
A
I
R
L
F
A
E
G
R
L
V
--
5
PsiBlast_PDB
90.32
41%
-166
- C5 -
-
3AUF
-
?
A:
[2-188]
I
R
I
G
V
L
I
S
G
S
G
T
N
L
Q
A
I
L
D
G
C
R
E
G
R
I
P
G
R
V
A
V
V
I
S
D
R
A
D
A
Y
G
L
E
R
A
R
R
A
G
V
D
A
L
H
M
D
P
A
A
Y
P
S
R
T
A
F
D
A
A
L
A
E
R
L
Q
A
Y
G
V
D
L
V
C
L
A
G
Y
M
R
L
V
R
G
P
M
L
T
A
F
P
N
R
I
L
N
I
H
P
S
L
L
P
A
F
P
G
L
E
A
Q
R
Q
A
L
E
H
G
V
K
V
A
G
C
T
V
H
F
V
T
A
G
V
D
E
G
P
I
I
L
Q
A
A
V
P
V
L
E
G
D
T
V
E
D
L
R
R
R
I
L
A
E
E
H
R
I
Y
P
E
A
I
R
L
F
A
E
G
-----
71
PsiBlast_CBE
89.47
37%
-176
- C5 -
-
3KCQ
1
?
C:
[9-190]
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
K
A
F
S
T
E
E
S
S
V
V
I
S
C
V
I
S
N
N
A
E
A
R
G
L
L
I
A
Q
S
Y
G
I
P
T
F
V
V
K
R
K
P
L
D
I
-----
E
H
I
S
T
V
L
R
E
H
D
V
D
L
V
C
L
A
G
F
M
S
I
L
P
E
K
F
V
T
D
W
H
H
K
I
I
N
I
H
P
S
L
L
P
S
F
K
G
L
N
A
Q
E
Q
A
Y
K
A
G
V
K
I
A
G
C
T
L
H
Y
V
Y
Q
E
L
D
A
G
P
I
I
M
Q
A
A
V
P
V
L
R
E
D
T
A
E
S
L
A
S
R
I
L
A
A
E
H
V
C
Y
P
K
G
V
K
L
I
A
Q
D
-----
128
HHSearch
88.74
41%
-146
- C5 -
-
2YWR
-
?
A:
[2-190]
L
K
I
G
V
L
V
S
G
R
G
S
N
L
Q
A
I
I
D
A
I
E
S
G
K
V
N
A
S
I
E
L
V
I
S
D
N
P
K
A
Y
A
I
E
R
C
K
K
H
N
V
E
C
K
V
I
Q
R
K
E
F
P
S
K
K
E
F
E
E
R
M
A
L
E
L
K
K
K
G
V
E
L
V
V
L
A
G
F
M
R
I
L
S
H
N
F
L
K
Y
F
P
N
K
V
I
N
I
H
P
S
L
I
P
A
F
Q
G
L
H
A
Q
K
Q
A
V
E
F
G
V
K
F
S
G
C
T
V
H
I
V
D
E
S
V
D
A
G
P
V
I
V
Q
A
V
V
P
V
L
P
E
D
D
E
N
T
L
A
D
R
I
L
K
W
E
H
K
I
L
P
Q
T
V
Q
W
F
A
Q
D
R
I
---
124
HHSearch
88.50
38%
-173
- C5 -
-
3KCQ
1
?
B:
[9-194]
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
K
A
F
S
T
---
S
V
V
I
S
C
V
I
S
N
N
A
E
A
R
G
L
L
I
A
Q
S
Y
G
I
P
T
F
V
V
K
R
K
P
L
-----
D
I
E
H
I
S
T
V
L
R
E
H
D
V
D
L
V
C
L
A
G
F
M
S
I
L
P
E
K
F
V
T
D
W
H
H
K
I
I
N
I
H
P
S
L
L
P
S
F
K
G
L
N
A
Q
E
Q
A
Y
K
A
G
V
K
I
A
G
C
T
L
H
Y
V
Y
Q
E
L
D
A
G
P
I
I
M
Q
A
A
V
P
V
L
R
E
D
T
A
E
S
L
A
S
R
I
L
A
A
E
H
V
C
Y
P
K
G
V
K
L
I
A
Q
D
K
I
K
L
-
70
PsiBlast_CBE
88.34
37%
-174
- C5 -
-
3KCQ
1
?
D:
[9-190]
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
K
A
F
S
---
S
S
V
V
I
S
C
V
I
S
N
N
A
E
A
R
G
L
L
I
A
Q
S
Y
G
I
P
T
F
V
V
K
R
K
P
L
D
I
-----
E
H
I
S
T
V
L
R
E
H
D
V
D
L
V
C
L
A
G
F
M
S
I
L
P
E
K
F
V
T
D
W
H
H
K
I
I
N
I
H
P
S
L
L
P
S
F
K
G
L
N
A
Q
E
Q
A
Y
K
A
G
V
K
I
A
G
C
T
L
H
Y
V
Y
Q
E
L
D
A
G
P
I
I
M
Q
A
A
V
P
V
L
R
E
D
T
A
E
S
L
A
S
R
I
L
A
A
E
H
V
C
Y
P
K
G
V
K
L
I
A
Q
D
-----
72
PsiBlast_CBE
88.05
37%
-173
- C5 -
-
3KCQ
1
?
B:
[9-190]
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
K
A
F
S
T
---
S
V
V
I
S
C
V
I
S
N
N
A
E
A
R
G
L
L
I
A
Q
S
Y
G
I
P
T
F
V
V
K
R
K
P
L
D
I
-----
E
H
I
S
T
V
L
R
E
H
D
V
D
L
V
C
L
A
G
F
M
S
I
L
P
E
K
F
V
T
D
W
H
H
K
I
I
N
I
H
P
S
L
L
P
S
F
K
G
L
N
A
Q
E
Q
A
Y
K
A
G
V
K
I
A
G
C
T
L
H
Y
V
Y
Q
E
L
D
A
G
P
I
I
M
Q
A
A
V
P
V
L
R
E
D
T
A
E
S
L
A
S
R
I
L
A
A
E
H
V
C
Y
P
K
G
V
K
L
I
A
Q
D
-----
122
HHSearch
87.78
35%
-155
- C5 -
-
3DA8
-
PUR3_MYCTU
B:
[13-201]
A
R
L
V
V
L
A
S
G
T
G
S
L
L
R
S
L
L
D
A
A
V
G
-
D
Y
P
A
R
V
V
A
V
G
V
D
R
-
E
C
R
A
A
E
I
A
A
E
A
S
V
P
V
F
T
V
R
L
A
D
H
P
S
R
D
A
W
D
V
A
I
T
A
A
T
A
A
H
E
P
D
L
V
V
S
A
G
F
M
R
I
L
G
P
Q
F
L
S
R
F
Y
G
R
T
L
N
T
H
P
A
L
L
P
A
F
P
G
T
H
G
V
A
D
A
L
A
Y
G
V
K
V
T
G
A
T
V
H
L
V
D
A
--
D
T
G
P
I
L
A
Q
Q
P
V
P
V
L
D
G
D
D
E
E
T
L
H
E
R
I
K
V
T
E
R
R
L
L
V
A
A
V
A
A
L
A
T
H
G
V
T
V
-
73
PsiBlast_CBE
87.71
37%
-179
* C5 *
-
3KCQ
1
?
A:
[9-190]
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
K
A
F
S
T
-
E
S
S
V
V
I
S
C
V
I
S
N
N
A
E
A
R
G
L
L
I
A
Q
S
Y
G
I
P
T
F
V
V
K
R
K
P
L
D
I
-----
E
H
I
S
T
V
L
R
E
H
D
V
D
L
V
C
L
A
G
F
M
S
I
L
P
E
K
F
V
T
D
W
H
H
K
I
I
N
I
H
P
S
L
L
P
S
F
K
G
L
N
A
Q
E
Q
A
Y
K
A
G
V
K
I
A
G
C
T
L
H
Y
V
Y
Q
E
L
D
A
G
P
I
I
M
Q
A
A
V
P
V
L
R
E
D
T
A
E
S
L
A
S
R
I
L
A
A
E
H
V
C
Y
P
K
G
V
K
L
I
A
Q
D
-----
121
HHSearch
87.23
35%
-154
- C5 -
-
3DA8
1
PUR3_MYCTU
A:
[13-201]
A
R
L
V
V
L
A
S
G
T
G
S
L
L
R
S
L
L
D
A
A
V
G
-
D
Y
P
A
R
V
V
A
V
G
V
D
R
-
E
C
R
A
A
E
I
A
A
E
A
S
V
P
V
F
T
V
R
L
A
D
H
P
S
R
D
A
W
D
V
A
I
T
A
A
T
A
A
H
E
P
D
L
V
V
S
A
G
F
M
R
I
L
G
P
Q
F
L
S
R
F
Y
G
R
T
L
N
T
H
P
A
L
L
P
A
F
P
G
T
H
G
V
A
D
A
L
A
Y
G
V
K
V
T
G
A
T
V
H
L
V
D
A
G
T
D
T
G
P
I
L
A
Q
Q
P
V
P
V
L
D
G
D
D
E
E
T
L
H
E
R
I
K
V
T
E
R
R
L
L
V
A
A
V
A
A
L
A
T
H
G
V
T
V
-
4
PsiBlast_PDB
86.32
41%
-144
- C5 -
-
2YWR
-
?
A:
[2-183]
L
K
I
G
V
L
V
S
G
R
G
S
N
L
Q
A
I
I
D
A
I
E
S
G
K
V
N
A
S
I
E
L
V
I
S
D
N
P
K
A
Y
A
I
E
R
C
K
K
H
N
V
E
C
K
V
I
Q
R
K
E
F
P
S
K
K
E
F
E
E
R
M
A
L
E
L
K
K
K
G
V
E
L
V
V
L
A
G
F
M
R
I
L
S
H
N
F
L
K
Y
F
P
N
K
V
I
N
I
H
P
S
L
I
P
A
F
Q
G
L
H
A
Q
K
Q
A
V
E
F
G
V
K
F
S
G
C
T
V
H
I
V
D
E
S
V
D
A
G
P
V
I
V
Q
A
V
V
P
V
L
P
E
D
D
E
N
T
L
A
D
R
I
L
K
W
E
H
K
I
L
P
Q
T
V
Q
----------
129
HHSearch
85.85
37%
-150
- C5 -
-
3TQR
1
?
A:
[6-195]
L
P
I
V
V
L
I
S
G
N
G
T
N
L
Q
A
I
I
G
A
I
Q
K
G
-
L
A
I
E
I
R
A
V
I
S
N
R
A
D
A
Y
G
L
K
R
A
Q
Q
A
D
I
P
T
H
I
I
P
H
E
E
F
P
S
R
T
D
F
E
S
T
L
Q
K
T
I
D
H
Y
D
P
K
L
I
V
L
A
G
F
M
R
K
L
G
K
A
F
V
S
H
Y
S
G
R
M
I
N
I
H
P
S
L
L
P
K
Y
T
G
L
N
T
H
E
R
A
L
A
A
G
E
T
E
H
G
V
S
V
H
Y
V
T
-
D
L
D
A
G
P
L
I
C
Q
A
R
L
S
I
T
P
Q
D
T
P
E
T
L
K
T
R
V
H
A
L
E
H
I
I
Y
P
E
V
L
S
W
F
A
A
G
R
L
N
Y
-
67
PsiBlast_CBE
85.50
34%
-163
- C5 -
-
1MEJ
1
C:
[14-198]
--
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
E
P
N
S
S
A
Q
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
-
Q
L
V
A
S
G
----
118
HHSearch
85.14
36%
-150
- C5 -
-
1C3E
2
PUR3_ECOLI
B:
[1-191]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
I
K
G
T
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
18
PsiBlast_PDB
84.31
35%
-155
- C5 -
-
4ZZ2
2
A:
[3-188]
-
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
E
P
N
S
S
A
Q
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
-
Q
L
V
A
S
G
----
36
PsiBlast_CBE
84.10
35%
-151
- C5 -
-
4ZYX
2
A:
[3-188]
-
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
E
P
N
S
S
A
Q
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
-
Q
L
V
A
S
G
----
34
PsiBlast_CBE
83.99
35%
-152
- C5 -
-
4ZYZ
2
A:
[3-188]
-
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
E
P
N
S
S
A
Q
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
-
Q
L
V
A
S
G
----
20
PsiBlast_PDB
83.93
35%
-152
- C5 -
-
4ZYT
2
A:
[3-188]
-
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
E
P
N
S
S
A
Q
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
-
Q
L
V
A
S
G
----
33
PsiBlast_CBE
83.85
35%
-152
- C5 -
-
4ZZ0
2
A:
[3-188]
-
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
E
P
N
S
S
A
Q
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
-
Q
L
V
A
S
G
----
35
PsiBlast_CBE
83.79
35%
-152
- C5 -
-
4ZYY
2
A:
[3-188]
-
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
E
P
N
S
S
A
Q
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
-
Q
L
V
A
S
G
----
37
PsiBlast_CBE
83.39
35%
-152
- C5 -
-
4ZYW
2
A:
[3-188]
-
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
E
P
N
S
S
A
Q
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
-
Q
L
V
A
S
G
----
13
PsiBlast_PDB
83.23
37%
-146
- C5 -
-
1C2T
2
PUR3_ECOLI
A:
[1-182]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
I
K
G
T
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
----------
32
PsiBlast_CBE
83.14
37%
-147
- C5 -
-
1C2T
2
PUR3_ECOLI
B:
[1-182]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
I
K
G
T
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
----------
9
PsiBlast_PDB
83.09
37%
-147
- C5 -
-
1C3E
2
PUR3_ECOLI
A:
[1-182]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
I
K
G
T
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
----------
22
PsiBlast_CBE
82.80
37%
-147
- C5 -
-
1C3E
2
PUR3_ECOLI
B:
[1-182]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
I
K
G
T
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
----------
19
PsiBlast_PDB
82.55
35%
-148
- C5 -
-
4ZZ3
2
A:
[3-188]
-
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
E
P
N
S
S
A
Q
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
-
Q
L
V
A
S
G
----
30
PsiBlast_CBE
82.39
37%
-150
- C5 -
-
1CDE
2
PUR3_ECOLI
B:
[1-182]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
I
K
G
T
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
----------
15
PsiBlast_PDB
82.35
37%
-150
- C5 -
-
1CDE
2
PUR3_ECOLI
A:
[1-182]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
I
K
G
T
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
----------
29
PsiBlast_CBE
82.12
37%
-150
- C5 -
-
1CDE
2
PUR3_ECOLI
C:
[1-182]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
I
K
G
T
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
----------
28
PsiBlast_CBE
81.67
37%
-150
- C5 -
-
1CDE
2
PUR3_ECOLI
D:
[1-182]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
I
K
G
T
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
----------