@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 : bsu22890: (2016-07-05 )
MEKKLSIAIDGPAAAGKSTVAKIVAEKKSYIYIDTGAMYRAITYAALQENVDLTDEEKLAELLKRTDIELITTKDGQKVFVNGTDVTEAIRTDEISNQVSIAAKHRSVREEMVKRQQQLGEKGGVVMDGRDIGTHVLPNAEVKIFLLASVEERAKRRYEENVKKGFDVNYETLIEEIARRDKLDSEREVSPLRKAEDALEIDTTSLSIQEVADKILEAVEQKSR
Atome Classification :
(29 SA)
.........10........20........30........40........50........60........70-....-.-...80........90........100.......110.......120.-..-.....130.......140.......150.......160.......170.......180.......190.......200.......210.......220..--
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MEK
K
L
S
I
A
IDGPAAA
G
K
S
T
V
A
K
I
V
AEKK
S
Y
I
Y
IDTG
A
M
Y
R
A
I
T
Y
A
A
L
QENVDLT
D
E
E
K
L
A
E
L
L
K
RTD
I
E
L
I
-TTKD-G-
Q
K
V
F
VNGTD
V
T
E
A
I
R
T
D
EISN
Q
V
S
I
A
A
K
H
R
S
V
R
E
E
M
V
K
R
Q
Q
QLG-EK-G
G
-
V
V
MDGRDIGTHVLPNA
E
V
K
I
F
L
L
A
S
V
E
E
R
A
K
R
R
Y
E
E
N
V
K
KGFDV
N
Y
E
T
L
I
E
E
I
A
R
RDKLDSEREVS
P
L
R
KAED
A
L
E
IDTTSL
S
I
Q
E
V
A
D
K
I
L
E
A
V
E
QKSR--
90
Fugue
81.79
43%
-106
- C2 -
1CKE
1
KCY_ECOLI
A:
[3-227]
-
A
I
A
P
V
I
T
I
D
G
P
S
G
A
G
K
G
T
L
C
K
A
M
A
E
A
L
Q
W
H
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
H
V
D
V
A
S
E
D
A
L
V
P
L
A
S
H
L
D
V
R
F
V
-
S
T
N
G
-
N
-
L
E
V
I
L
E
G
E
D
V
S
G
E
I
R
T
Q
E
V
A
N
A
A
S
Q
V
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
L
-
P
G
-
L
I
A
D
G
R
D
M
G
T
V
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
E
E
R
A
H
R
R
M
L
Q
L
Q
V
K
G
F
S
V
N
F
E
R
L
L
A
E
I
-------------
K
L
V
P
A
A
D
A
L
V
L
D
S
T
T
L
S
I
E
Q
V
I
E
K
A
L
Q
Y
A
R
Q
K
L
A
LA
100
HHSearch
81.08
44%
-107
- C2 -
1CKE
1
KCY_ECOLI
A:
[3-223]
-
A
I
A
P
V
I
T
I
D
G
P
S
G
A
G
K
G
T
L
C
K
A
M
A
E
A
L
Q
W
H
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
H
V
D
V
A
S
E
D
A
L
V
P
L
A
S
H
L
D
V
R
F
V
-
S
T
N
G
-
N
-
L
E
V
I
L
E
G
E
D
V
S
G
E
I
R
T
Q
E
V
A
N
A
A
S
Q
V
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
L
-
P
G
-
L
I
A
D
G
R
D
M
G
T
V
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
E
E
R
A
H
R
R
M
L
Q
L
Q
V
K
G
F
S
V
N
F
E
R
L
L
A
E
I
K
-------------
L
V
P
A
A
D
A
L
V
L
D
S
T
T
L
S
I
E
Q
V
I
E
K
A
L
Q
Y
A
R
Q
K
----
103
HHSearch
79.84
41%
-115
- C2 -
4E22
2
KCY_YERPY
A:
[25-246]
-
A
I
A
P
V
I
T
V
D
G
P
S
G
A
G
K
G
T
L
C
K
A
L
A
E
S
L
N
W
R
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
Q
V
D
I
S
T
E
E
A
L
V
P
L
A
A
H
L
D
V
R
F
V
-
S
Q
N
G
-
Q
-
L
Q
V
I
L
E
G
E
D
V
S
N
E
I
R
T
E
T
V
G
N
T
A
S
Q
A
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
A
-
P
G
-
L
I
A
D
G
R
D
M
G
T
I
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
Q
E
R
A
H
R
R
M
L
Q
L
Q
E
R
G
F
N
V
N
F
E
R
L
L
A
E
I
Q
------------
P
L
V
P
A
A
D
A
L
V
L
D
S
T
S
M
S
I
E
Q
V
I
E
Q
A
L
A
Y
A
Q
R
I
L
---
1
PsiBlast_PDB
78.62
54%
-20
- C2 -
1Q3T
-
KCY_STRPN
A:
[15-228]
--
K
T
I
Q
I
A
I
D
G
P
A
S
S
G
K
S
T
V
A
K
I
I
A
K
D
F
G
F
T
Y
L
D
T
G
A
M
Y
R
A
A
T
Y
M
A
L
K
N
Q
L
G
V
E
E
V
E
A
L
L
A
L
L
D
Q
H
P
I
S
F
G
-
R
S
E
T
-
G
D
Q
L
V
F
V
G
D
V
D
I
T
H
P
I
R
E
N
E
V
T
N
H
V
S
A
I
A
A
I
P
E
V
R
E
K
L
V
S
L
Q
Q
E
I
A
-
Q
Q
-
G
G
-
I
V
M
D
G
R
D
I
G
T
V
V
L
P
Q
A
E
L
K
I
F
L
V
A
S
V
D
E
R
A
E
R
R
Y
K
E
N
I
A
K
G
I
E
T
D
L
E
T
L
K
K
E
I
A
A
R
D
Y
K
D
S
H
R
E
T
S
P
L
K
Q
A
E
D
A
V
Y
L
D
T
T
G
L
N
I
Q
E
V
V
E
K
I
-----------
10
PsiBlast_PDB
77.91
44%
-113
- C2 -
1CKE
1
KCY_ECOLI
A:
[8-223]
------
I
T
I
D
G
P
S
G
A
G
K
G
T
L
C
K
A
M
A
E
A
L
Q
W
H
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
H
V
D
V
A
S
E
D
A
L
V
P
L
A
S
H
L
D
V
R
F
V
-
S
T
N
G
-
N
-
L
E
V
I
L
E
G
E
D
V
S
G
E
I
R
T
Q
E
V
A
N
A
A
S
Q
V
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
L
-
P
G
-
L
I
A
D
G
R
D
M
G
T
V
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
E
E
R
A
H
R
R
M
L
Q
L
Q
V
K
G
F
S
V
N
F
E
R
L
L
A
E
I
K
-------------
L
V
P
A
A
D
A
L
V
L
D
S
T
T
L
S
I
E
Q
V
I
E
K
A
L
Q
Y
A
R
Q
K
----
11
PsiBlast_PDB
77.35
44%
-116
- C2 -
2FEM
-
KCY_ECOLI
A:
[8-223]
------
I
T
I
D
G
P
S
G
A
G
K
G
T
L
C
K
A
M
A
E
A
L
Q
W
H
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
H
V
D
V
A
S
E
D
A
L
V
P
L
A
S
H
L
D
V
R
F
V
-
S
T
N
G
-
N
-
L
E
V
I
L
E
G
E
D
V
S
G
E
I
R
T
Q
E
V
A
N
A
A
S
Q
V
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
L
-
P
G
-
L
I
A
D
G
R
D
M
G
T
V
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
E
E
R
A
H
R
R
M
L
Q
L
Q
E
K
G
F
S
V
N
F
E
R
L
L
A
E
I
K
-------------
L
V
P
A
A
D
A
L
V
L
D
S
T
T
L
S
I
E
Q
V
I
E
K
A
L
Q
Y
A
R
Q
K
----
13
PsiBlast_PDB
76.81
43%
-119
- C2 -
4E22
2
KCY_YERPY
A:
[30-239]
------
I
T
V
D
G
P
S
G
A
G
K
G
T
L
C
K
A
L
A
E
S
L
N
W
R
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
Q
V
D
I
S
T
E
E
A
L
V
P
L
A
A
H
L
D
V
R
F
V
-
S
Q
N
G
-
Q
-
L
Q
V
I
L
E
G
E
D
V
S
N
E
I
R
T
E
T
V
G
N
T
A
S
Q
A
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
A
-
P
G
-
L
I
A
D
G
R
D
M
G
T
I
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
Q
E
R
A
H
R
R
M
L
Q
L
Q
E
R
G
F
N
V
N
F
E
R
L
L
A
E
I
Q
------------
P
L
V
P
A
A
D
A
L
V
L
D
S
T
S
M
S
I
E
Q
V
I
E
Q
A
L
----------
9
PsiBlast_PDB
76.68
44%
-99
- C2 -
1KDT
3
KCY_ECOLI
A:
[8-223]
------
I
T
I
D
G
P
S
G
A
G
K
G
T
L
C
K
A
M
A
E
A
L
Q
W
H
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
H
V
D
V
A
S
E
D
A
L
V
P
L
A
S
H
L
D
V
R
F
V
-
S
T
N
G
-
N
-
L
E
V
I
L
E
G
E
D
V
S
G
E
I
R
T
Q
E
V
A
N
A
A
S
Q
V
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
L
-
P
G
-
L
I
A
D
G
R
D
M
G
T
V
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
E
E
R
A
H
R
R
M
L
Q
L
Q
E
K
G
F
S
V
N
F
E
R
L
L
A
E
I
K
E
R
D
D
R
D
R
N
R
A
V
A
P
L
V
P
A
A
D
A
L
V
L
D
S
T
T
L
S
I
E
Q
V
I
E
K
A
L
Q
Y
A
R
Q
K
----
101
HHSearch
76.56
43%
-47
* C2 *
3R20
4
?
A:
[9-225]
---
S
L
V
V
A
V
D
G
P
A
G
T
G
K
S
S
V
S
R
G
L
A
R
A
L
G
A
R
Y
L
D
T
G
A
M
Y
R
I
A
T
L
A
V
L
R
A
G
A
D
L
T
D
P
A
A
I
E
K
A
A
A
D
A
E
I
G
V
G
-
S
D
P
D
-
V
-
D
A
A
F
L
A
G
E
D
V
S
S
E
I
R
G
D
A
V
T
G
A
V
S
A
V
S
A
V
P
A
V
R
T
R
L
V
D
I
Q
R
K
L
A
T
E
G
-
G
R
-
V
V
V
E
G
R
D
I
G
T
V
V
L
P
D
A
D
V
K
I
F
L
T
A
S
A
E
E
R
A
R
R
R
N
A
Q
N
V
A
N
G
L
P
D
D
Y
A
T
V
L
A
D
V
Q
R
R
D
H
L
D
S
T
R
P
V
S
P
L
R
A
A
D
D
A
L
V
V
D
T
S
D
M
D
Q
A
Q
V
I
A
H
L
L
D
L
V
-------
8
PsiBlast_PDB
76.41
44%
-94
- C2 -
1KDR
2
KCY_ECOLI
A:
[8-223]
------
I
T
I
D
G
P
S
G
A
G
K
G
T
L
C
K
A
M
A
E
A
L
Q
W
H
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
H
V
D
V
A
S
E
D
A
L
V
P
L
A
S
H
L
D
V
R
F
V
-
S
T
N
G
-
N
-
L
E
V
I
L
E
G
E
D
V
S
G
E
I
R
T
Q
E
V
A
N
A
A
S
Q
V
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
L
-
P
G
-
L
I
A
D
G
R
D
M
G
T
V
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
E
E
R
A
H
R
R
M
L
Q
L
Q
E
K
G
F
S
V
N
F
E
R
L
L
A
E
I
K
E
R
D
D
R
D
R
N
R
A
V
A
P
L
V
P
A
A
D
A
L
V
L
D
S
T
T
L
S
I
E
Q
V
I
E
K
A
L
Q
Y
A
R
Q
K
----
5
PsiBlast_PDB
76.35
44%
-108
- C2 -
2CMK
3
KCY_ECOLI
A:
[8-223]
------
I
T
I
D
G
P
S
G
A
G
K
G
T
L
C
K
A
M
A
E
A
L
Q
W
H
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
H
V
D
V
A
S
E
D
A
L
V
P
L
A
S
H
L
D
V
R
F
V
-
S
T
N
G
-
N
-
L
E
V
I
L
E
G
E
D
V
S
G
E
I
R
T
Q
E
V
A
N
A
A
S
Q
V
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
L
-
P
G
-
L
I
A
D
G
R
D
M
G
T
V
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
E
E
R
A
H
R
R
M
L
Q
L
Q
E
K
G
F
S
V
N
F
E
R
L
L
A
E
I
K
E
R
D
D
R
D
R
N
R
A
V
A
P
L
V
P
A
A
D
A
L
V
L
D
S
T
T
L
S
I
E
Q
V
I
E
K
A
L
Q
Y
A
R
Q
K
----
24
PsiBlast_CBE
76.25
43%
-46
- C2 -
4DIE
2
?
C:
[4-223]
---
S
M
V
V
A
V
D
G
P
S
G
T
G
K
S
S
V
A
K
E
L
A
R
Q
L
G
A
S
Y
L
D
T
G
A
M
Y
R
I
V
T
L
W
V
L
R
A
G
V
D
L
T
D
P
A
A
I
A
A
A
T
D
Q
V
P
M
S
V
S
-
S
D
P
D
-
A
-
Q
T
A
L
L
A
G
E
D
V
S
V
P
I
R
G
N
E
V
T
G
A
V
S
A
V
S
A
V
P
A
V
R
E
R
L
V
R
Q
Q
R
E
L
A
-
E
S
S
G
A
-
V
V
V
E
G
R
D
I
G
T
V
V
L
P
D
A
D
V
K
I
Y
L
T
A
S
A
Q
A
R
A
Q
R
R
N
A
Q
N
V
S
-------
E
K
V
L
A
D
V
Q
R
R
D
H
L
D
S
T
R
A
V
S
P
L
R
P
A
E
D
A
L
E
V
D
T
S
D
M
T
Q
E
Q
V
V
A
H
L
L
D
L
V
R
T
R
----
27
PsiBlast_CBE
76.09
44%
-98
- C2 -
1KDR
3
KCY_ECOLI
B:
[8-223]
------
I
T
I
D
G
P
S
G
A
G
K
G
T
L
C
K
A
M
A
E
A
L
Q
W
H
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
H
V
D
V
A
S
E
D
A
L
V
P
L
A
S
H
L
D
V
R
F
V
-
S
T
N
G
-
N
-
L
E
V
I
L
E
G
E
D
V
S
G
E
I
R
T
Q
E
V
A
N
A
A
S
Q
V
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
L
-
P
G
-
L
I
A
D
G
R
D
M
G
T
V
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
E
E
R
A
H
R
R
M
L
Q
L
Q
E
K
G
F
S
V
N
F
E
R
L
L
A
E
I
K
E
R
D
D
R
D
R
N
R
A
V
A
P
L
V
P
A
A
D
A
L
V
L
D
S
T
T
L
S
I
E
Q
V
I
E
K
A
L
Q
Y
A
R
Q
K
----
28
PsiBlast_CBE
76.06
44%
-103
- C2 -
1KDP
2
KCY_ECOLI
B:
[8-223]
------
I
T
I
D
G
P
S
G
A
G
K
G
T
L
C
K
A
M
A
E
A
L
Q
W
H
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
H
V
D
V
A
S
E
D
A
L
V
P
L
A
S
H
L
D
V
R
F
V
-
S
T
N
G
-
N
-
L
E
V
I
L
E
G
E
D
V
S
G
E
I
R
T
Q
E
V
A
N
A
A
S
Q
V
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
L
-
P
G
-
L
I
A
D
G
R
D
M
G
T
V
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
E
E
R
A
H
R
R
M
L
Q
L
Q
E
K
G
F
S
V
N
F
E
R
L
L
A
E
I
K
E
R
D
D
R
D
R
N
R
A
V
A
P
L
V
P
A
A
D
A
L
V
L
D
S
T
T
L
S
I
E
Q
V
I
E
K
A
L
Q
Y
A
R
Q
K
----
29
PsiBlast_CBE
74.86
44%
-100
- C2 -
1KDO
3
KCY_ECOLI
B:
[8-223]
------
I
T
I
D
G
P
S
G
A
G
K
G
T
L
C
K
A
M
A
E
A
L
Q
W
H
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
H
V
D
V
A
S
E
D
A
L
V
P
L
A
S
H
L
D
V
R
F
V
-
S
T
N
G
-
N
-
L
E
V
I
L
E
G
E
D
V
S
G
E
I
R
T
Q
E
V
A
N
A
A
S
Q
V
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
L
-
P
G
-
L
I
A
D
G
R
D
M
G
T
V
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
E
E
R
A
H
R
R
M
L
Q
L
Q
E
K
G
F
S
V
N
F
E
R
L
L
A
E
I
K
E
R
D
D
R
D
R
N
R
A
V
A
P
L
V
P
A
A
D
A
L
V
L
D
S
T
T
L
S
I
E
Q
V
I
E
K
A
L
Q
Y
A
R
Q
K
----
14
PsiBlast_PDB
74.75
42%
-48
- C2 -
3R20
4
?
A:
[9-225]
---
S
L
V
V
A
V
D
G
P
A
G
T
G
K
S
S
V
S
R
G
L
A
R
A
L
G
A
R
Y
L
D
T
G
A
M
Y
R
I
A
T
L
A
V
L
R
A
G
A
D
L
T
D
P
A
A
I
E
K
A
A
A
D
A
E
I
G
V
G
-
S
D
P
D
-
V
-
D
A
A
F
L
A
G
E
D
V
S
S
E
I
R
G
D
A
V
T
G
A
V
S
A
V
S
A
V
P
A
V
R
T
R
L
V
D
I
Q
R
K
L
A
-
T
E
-
G
G
R
V
V
V
E
G
R
D
I
G
T
V
V
L
P
D
A
D
V
K
I
F
L
T
A
S
A
E
E
R
A
R
R
R
N
A
Q
N
V
A
N
G
L
P
D
D
Y
A
T
V
L
A
D
V
Q
R
R
D
H
L
D
S
T
R
P
V
S
P
L
R
A
A
D
D
A
L
V
V
D
T
S
D
M
D
Q
A
Q
V
I
A
H
L
L
D
L
V
-------
26
PsiBlast_CBE
74.58
44%
-99
- C2 -
1KDT
2
KCY_ECOLI
B:
[8-223]
------
I
T
I
D
G
P
S
G
A
G
K
G
T
L
C
K
A
M
A
E
A
L
Q
W
H
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
H
V
D
V
A
S
E
D
A
L
V
P
L
A
S
H
L
D
V
R
F
V
-
S
T
N
G
-
N
-
L
E
V
I
L
E
G
E
D
V
S
G
E
I
R
T
Q
E
V
A
N
A
A
S
Q
V
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
L
-
P
G
-
L
I
A
D
G
R
D
M
G
T
V
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
E
E
R
A
H
R
R
M
L
Q
L
Q
E
K
G
F
S
V
N
F
E
R
L
L
A
E
I
K
E
R
D
D
R
D
R
N
R
A
V
A
P
L
V
P
A
A
D
A
L
V
L
D
S
T
T
L
S
I
E
Q
V
I
E
K
A
L
Q
Y
A
R
Q
K
----
6
PsiBlast_PDB
74.44
44%
-93
- C2 -
1KDO
4
KCY_ECOLI
A:
[8-223]
------
I
T
I
D
G
P
S
G
A
G
K
G
T
L
C
K
A
M
A
E
A
L
Q
W
H
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
H
V
D
V
A
S
E
D
A
L
V
P
L
A
S
H
L
D
V
R
F
V
-
S
T
N
G
-
N
-
L
E
V
I
L
E
G
E
D
V
S
G
E
I
R
T
Q
E
V
A
N
A
A
S
Q
V
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
L
-
P
G
-
L
I
A
D
G
R
D
M
G
T
V
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
E
E
R
A
H
R
R
M
L
Q
L
Q
E
K
G
F
S
V
N
F
E
R
L
L
A
E
I
K
E
R
D
D
R
D
R
N
R
A
V
A
P
L
V
P
A
A
D
A
L
V
L
D
S
T
T
L
S
I
E
Q
V
I
E
K
A
L
Q
Y
A
R
Q
K
----
7
PsiBlast_PDB
74.19
44%
-93
- C2 -
1KDP
2
KCY_ECOLI
A:
[8-223]
------
I
T
I
D
G
P
S
G
A
G
K
G
T
L
C
K
A
M
A
E
A
L
Q
W
H
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
H
V
D
V
A
S
E
D
A
L
V
P
L
A
S
H
L
D
V
R
F
V
-
S
T
N
G
-
N
-
L
E
V
I
L
E
G
E
D
V
S
G
E
I
R
T
Q
E
V
A
N
A
A
S
Q
V
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
L
-
P
G
-
L
I
A
D
G
R
D
M
G
T
V
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
E
E
R
A
H
R
R
M
L
Q
L
Q
E
K
G
F
S
V
N
F
E
R
L
L
A
E
I
K
E
R
D
D
R
D
R
N
R
A
V
A
P
L
V
P
A
A
D
A
L
V
L
D
S
T
T
L
S
I
E
Q
V
I
E
K
A
L
Q
Y
A
R
Q
K
----
12
PsiBlast_PDB
71.44
44%
-101
- C2 -
2FEO
2
KCY_ECOLI
A:
[8-223]
------
I
T
I
D
G
P
S
G
A
G
K
G
T
L
C
K
A
M
A
E
A
L
Q
W
H
L
L
D
S
G
A
I
Y
R
V
L
A
L
A
A
L
H
H
H
V
D
V
A
S
E
D
A
L
V
P
L
A
S
H
L
D
V
R
F
V
-
S
T
N
G
-
N
-
L
E
V
I
L
E
G
E
D
V
S
G
E
I
R
T
Q
E
V
A
N
A
A
S
Q
V
A
A
F
P
R
V
R
E
A
L
L
R
R
Q
R
A
F
R
-
E
L
-
P
G
-
L
I
A
D
G
R
D
M
G
T
V
V
F
P
D
A
P
V
K
I
F
L
D
A
S
S
E
E
R
A
H
R
R
M
L
Q
L
Q
E
K
G
F
S
V
N
F
E
R
L
L
A
E
I
K
E
R
D
D
R
D
R
N
M
A
V
A
P
L
V
P
A
A
D
A
L
V
L
D
S
T
T
L
S
I
E
Q
V
I
E
K
A
L
Q
Y
A
R
Q
K
----
4
PsiBlast_PDB
71.05
43%
-55
- C2 -
4DIE
2
?
A:
[4-222]
---
S
M
V
V
A
V
D
G
P
S
G
T
G
K
S
S
V
A
K
E
L
A
R
Q
L
G
A
S
Y
L
D
T
G
A
M
Y
R
I
V
T
L
W
V
L
R
A
G
V
D
L
T
D
P
A
A
I
A
A
A
T
D
Q
V
P
M
S
V
S
-
S
D
P
D
-
A
-
Q
T
A
L
L
A
G
E
D
V
S
V
P
I
R
G
N
E
V
T
G
A
V
S
A
V
S
A
V
P
A
V
R
E
R
L
V
R
Q
Q
R
E
L
A
-
E
S
S
G
A
-
V
V
V
E
G
R
D
I
G
T
V
V
L
P
D
A
D
V
K
I
Y
L
T
A
S
A
Q
A
R
A
Q
R
R
N
A
Q
N
-----------
V
L
A
D
V
Q
R
R
D
H
L
D
S
T
R
----
L
R
P
A
E
D
A
L
E
V
D
T
S
D
M
T
Q
E
Q
V
V
A
H
L
L
D
L
V
R
T
-----
25
PsiBlast_CBE
70.05
43%
-53
- C2 -
4DIE
2
?
B:
[4-223]
---
S
M
V
V
A
V
D
G
P
S
G
T
G
K
S
S
V
A
K
E
L
A
R
Q
L
G
A
S
Y
L
D
T
G
A
M
Y
R
I
V
T
L
W
V
L
R
A
G
V
D
L
T
D
P
A
A
I
A
A
A
T
D
Q
V
P
M
S
V
S
-
S
D
P
D
-
A
-
Q
T
A
L
L
A
G
E
D
V
S
V
P
I
R
G
N
E
V
T
G
A
V
S
A
V
S
A
V
P
A
V
R
E
R
L
V
R
Q
Q
R
E
L
A
-
E
S
S
G
A
-
V
V
V
E
G
R
D
I
G
T
V
V
L
P
D
A
D
V
K
I
Y
L
T
A
S
A
Q
A
R
A
Q
R
R
N
-------------------
Q
R
R
D
H
L
D
S
T
R
A
V
S
P
L
R
P
A
E
D
A
L
E
V
D
T
S
D
M
T
Q
E
Q
V
V
A
H
L
L
D
L
V
R
T
R
----
104
HHSearch
69.79
50%
4
- C2 -
2H92
2
KCY_STAAW
A:
[3-218]
---
A
I
N
I
A
L
D
G
P
A
A
A
G
K
S
T
I
A
K
R
V
A
S
E
L
S
M
I
Y
V
D
T
G
A
M
Y
R
A
L
T
Y
K
Y
L
K
L
N
K
T
----
E
D
F
A
K
L
V
D
Q
T
T
L
D
L
T
Y
K
A
D
K
-
G
-
Q
C
V
I
L
D
N
E
D
V
T
D
F
L
R
N
N
D
V
T
Q
H
V
S
Y
V
A
S
K
E
P
V
R
S
F
A
V
K
K
Q
K
E
L
A
-
A
E
-
K
G
-
I
V
M
D
G
R
D
I
G
T
V
V
L
P
D
A
D
L
K
V
Y
M
I
A
S
V
E
E
R
A
E
R
R
Y
K
D
N
Q
L
R
G
I
E
S
N
F
E
D
L
K
R
D
I
E
A
R
D
Q
Y
D
M
N
R
E
I
S
P
L
R
K
A
D
D
A
V
T
L
D
T
T
G
K
S
I
E
E
V
T
D
E
I
L
A
M
V
S
Q
I
----
2
PsiBlast_PDB
69.62
50%
3
- C2 -
2H92
2
KCY_STAAW
A:
[3-217]
---
A
I
N
I
A
L
D
G
P
A
A
A
G
K
S
T
I
A
K
R
V
A
S
E
L
S
M
I
Y
V
D
T
G
A
M
Y
R
A
L
T
Y
K
Y
L
K
----
L
N
K
T
E
D
F
A
K
L
V
D
Q
T
T
L
D
L
T
-
Y
K
A
D
K
G
-
Q
C
V
I
L
D
N
E
D
V
T
D
F
L
R
N
N
D
V
T
Q
H
V
S
Y
V
A
S
K
E
P
V
R
S
F
A
V
K
K
Q
K
E
L
A
-
A
E
-
K
G
-
I
V
M
D
G
R
D
I
G
T
V
V
L
P
D
A
D
L
K
V
Y
M
I
A
S
V
E
E
R
A
E
R
R
Y
K
D
N
Q
L
R
G
I
E
S
N
F
E
D
L
K
R
D
I
E
A
R
D
Q
Y
D
M
N
R
E
I
S
P
L
R
K
A
D
D
A
V
T
L
D
T
T
G
K
S
I
E
E
V
T
D
E
I
L
A
M
V
S
Q
-----
21
PsiBlast_CBE
69.30
50%
5
- C2 -
2H92
2
KCY_STAAW
C:
[3-217]
---
A
I
N
I
A
L
D
G
P
A
A
A
G
K
S
T
I
A
K
R
V
A
S
E
L
S
M
I
Y
V
D
T
G
A
M
Y
R
A
L
T
Y
K
Y
L
K
----
L
N
K
T
E
D
F
A
K
L
V
D
Q
T
T
L
D
L
T
-
Y
K
A
D
K
G
-
Q
C
V
I
L
D
N
E
D
V
T
D
F
L
R
N
N
D
V
T
Q
H
V
S
Y
V
A
S
K
E
P
V
R
S
F
A
V
K
K
Q
K
E
L
A
-
A
E
-
K
G
-
I
V
M
D
G
R
D
I
G
T
V
V
L
P
D
A
D
L
K
V
Y
M
I
A
S
V
E
E
R
A
E
R
R
Y
K
D
N
Q
L
R
G
I
E
S
N
F
E
D
L
K
R
D
I
E
A
R
D
Q
Y
D
M
N
R
E
I
S
P
L
R
K
A
D
D
A
V
T
L
D
T
T
G
K
S
I
E
E
V
T
D
E
I
L
A
M
V
S
Q
-----
23
PsiBlast_CBE
69.19
43%
-55
- C2 -
4DIE
2
?
D:
[4-223]
---
S
M
V
V
A
V
D
G
P
S
G
T
G
K
S
S
V
A
K
E
L
A
R
Q
L
G
A
S
Y
L
D
T
G
A
M
Y
R
I
V
T
L
W
V
L
R
A
G
V
D
L
T
D
P
A
A
I
A
A
A
T
D
Q
V
P
M
S
V
S
-
S
D
P
D
-
A
-
Q
T
A
L
L
A
G
E
D
V
S
V
P
I
R
G
N
E
V
T
G
A
V
S
A
V
S
A
V
P
A
V
R
E
R
L
V
R
Q
Q
R
E
L
A
-
E
S
S
G
A
-
V
V
V
E
G
R
D
I
G
T
V
V
L
P
D
A
D
V
K
I
Y
L
T
A
S
A
Q
A
R
A
Q
R
--------------------
V
Q
R
R
D
H
L
D
S
T
R
A
V
S
P
L
R
P
A
E
D
A
L
E
V
D
T
S
D
M
T
Q
E
Q
V
V
A
H
L
L
D
L
V
R
T
R
----
22
PsiBlast_CBE
68.61
50%
4
- C2 -
2H92
3
KCY_STAAW
B:
[3-217]
---
A
I
N
I
A
L
D
G
P
A
A
A
G
K
S
T
I
A
K
R
V
A
S
E
L
S
M
I
Y
V
D
T
G
A
M
Y
R
A
L
T
Y
K
Y
L
K
----
L
N
K
T
E
D
F
A
K
L
V
D
Q
T
T
L
D
L
T
-
Y
K
A
D
K
G
-
Q
C
V
I
L
D
N
E
D
V
T
D
F
L
R
N
N
D
V
T
Q
H
V
S
Y
V
A
S
K
E
P
V
R
S
F
A
V
K
K
Q
K
E
L
A
-
A
E
-
K
G
-
I
V
M
D
G
R
D
I
G
T
V
V
L
P
D
A
D
L
K
V
Y
M
I
A
S
V
E
E
R
A
E
R
R
Y
K
D
N
Q
L
R
G
I
E
S
N
F
E
D
L
K
R
D
I
E
A
R
D
Q
Y
D
M
N
R
E
I
S
P
L
R
K
A
D
D
A
V
T
L
D
T
T
G
K
S
I
E
E
V
T
D
E
I
L
A
M
V
S
Q
-----
16
PsiBlast_PDB
66.96
34%
-106
- C2 -
3AKD
1
KCY_THET8
A:
[5-208]
------
V
T
I
D
G
P
S
A
S
G
K
S
S
V
A
R
R
V
A
A
A
L
G
V
P
Y
L
S
S
G
L
L
Y
R
A
A
A
F
L
A
L
R
A
G
V
D
P
G
D
E
E
G
L
L
A
L
L
E
G
L
G
V
R
L
L
-
A
Q
A
E
-
G
-
N
R
V
L
A
D
G
E
D
L
T
S
F
L
H
T
P
E
V
D
R
V
V
S
A
V
A
R
L
P
G
V
R
A
W
V
N
R
R
L
K
E
V
P
-
P
P
----
F
V
A
E
G
R
D
M
G
T
A
V
F
P
E
A
A
H
K
F
Y
L
T
A
S
P
E
V
R
A
W
R
R
A
R
E
R
P
Q
A
-----
Y
E
E
V
L
R
D
L
L
R
R
D
------
S
A
----
P
A
P
D
A
L
V
L
D
T
G
G
M
T
L
D
E
V
V
A
W
V
L
A
H
I
R
R
-----
15
PsiBlast_PDB
65.60
34%
-87
- C2 -
3AKC
3
KCY_THET8
A:
[5-208]
------
V
T
I
D
G
P
S
A
S
G
K
S
S
V
A
R
R
V
A
A
A
L
G
V
P
Y
L
S
S
G
L
L
Y
R
A
A
A
F
L
A
L
R
A
G
V
D
P
G
D
E
E
G
L
L
A
L
L
E
G
L
G
V
R
L
L
-
A
Q
A
E
-
G
-
N
R
V
L
A
D
G
E
D
L
T
S
F
L
H
T
P
E
V
D
R
V
V
S
A
V
A
R
L
P
G
V
R
A
W
V
N
R
R
L
K
E
V
P
-
P
P
----
F
V
A
E
G
R
D
M
G
T
A
V
F
P
E
A
A
H
K
F
Y
L
T
A
S
P
E
V
R
A
W
R
R
A
R
E
R
P
Q
A
-----
Y
E
E
V
L
R
D
L
L
R
R
D
E
R
D
K
A
Q
S
A
----
P
A
P
D
A
L
V
L
D
T
G
G
M
T
L
D
E
V
V
A
W
V
L
A
H
I
R
R
-----