@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 : spr0530: (2017-12-24 )
MAIVSAEKFVQAARDNGYAVGGFNTNNLEWTQAILRAAEAKKAPVLIQTSMGAAKYMGGYKVARNLIANLVESMGITVPVAIHLDHGHYEDALECIEVGYTSIMFDGSHLPVEENLKLAKEVVEKAHAKGISVEAEVGTIGGEEDGIIGKGELAPIEDAKAMVETGIDFLAAGIGNIHGPYPVNWEGLDLDHLQKLTEALPGFPIVLHGGSGIPDEQIQAAIKLGVAKVNVNTECQIAFANATRKFARDYEANEAEYDKKKLFDPRKFLADGVKAIQASVEERIDVFGSEGKA
Atome Classification :
(25 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.---
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MAIV
S
A
E
K
F
V
Q
---
A
ARDN
G
Y
A
VGGFNTN
N
L
E
W
T
Q
A
I
L
R
A
AEAKKA
P
V
L
I
Q
TSMG
A
A
K
Y
M
G
G
Y
--
K
V
A
-------
R
N
L
I
A
N
L
V
E
-SMG
I
T
--------
V
P
V
A
I
H
LDH------G-
H
-
Y
E
---
D
A
--------
L
E
---
C
----
I
E
V-----G---------Y
T
S
I
M
FDGS-----HL-------
P
V
--
E
E
N
L
K
L
A
K
E
V
V
E
K
AHAKG
I
S
V
E
A
E
VGTIG-------G-EEDGII-------------G----KGE------L-A------
P
I
E
D
---
A
K
A
M
V
-
E
-
T
------
G
I
D
F
L
A
A
G
IGNIHGPY----P--VN-WE----G-L
D
L
D
H
--
L
---
Q
K
L
T
E
A----L-P------G
F
P
-------
I
V
L
HGGS---------------------GI
P
---------------------
D
---------------------
E
Q
I
Q
A
A
I
KL
G
V
A
K
V
NVN
T
E
C
Q
I
A
FA
N
A
T
R
K
-
F
A
R
DYEAN-------
E
A
EY-------
D
K
K
KLF
D
P
R
K
F
L
A
D
G
V
K
A
I
Q
A
S
V
E
E
R
I
D
VFGSEGKA---
59
HHSearch
87.72
49%
-24
- C1 -
-
3Q94
1
?
A:
[4-288]
M
P
L
V
S
M
K
E
M
L
N
---
K
A
L
E
G
K
Y
A
V
G
Q
F
N
M
N
N
L
E
W
T
Q
A
I
L
A
A
A
E
E
E
K
S
P
V
I
L
G
V
S
E
G
A
A
R
H
M
T
G
F
--
K
T
V
-------
V
A
M
V
K
A
L
I
E
-
E
M
N
I
T
--------
V
P
V
A
I
H
L
D
H
------
G
-
S
S
F
E
---
K
C
--------
K
E
---
A
----
I
D
A
-----
G
---------
F
T
S
V
M
I
D
A
S
-----
H
H
-------
P
F
--
E
E
N
V
E
T
T
K
K
V
V
E
Y
A
H
A
R
N
V
S
V
E
A
E
L
G
T
V
G
-------
G
-
Q
E
D
D
V
I
-------------
A
E---
G
V
I
------
Y
-
A
------
D
P
A
E
---
C
K
H
L
V
E
A
-
T
------
G
I
D
C
L
A
P
A
L
G
S
V
H
G
P
Y
----
K
--
G
--
E
P
----
N
-
L
G
F
A
E
--
M
---
E
Q
V
R
D
F
----
T
--------
G
V
P
-------
L
V
L
H
G
G
T
---------------------
G
I
P
---------------------
T
---------------------
A
D
I
E
K
A
I
S
L
G
T
S
K
I
N
V
N
T
E
N
Q
I
E
F
T
K
A
V
R
E
-
V
L
N
K
---
D
-------
Q
E
-------------
V
Y
D
P
R
K
F
I
G
P
G
R
D
A
I
K
A
T
V
I
G
K
I
R
E
F
G
S
N
G
K
A
---
11
PsiBlast_PDB
86.42
34%
-41
- C1 -
-
5U7S
1
?
A:
[9-337]
M
A
L
I
S
M
R
Q
L
L
D
---
H
A
A
E
H
N
Y
G
V
P
A
F
N
V
N
N
L
E
Q
M
R
A
I
M
L
A
A
D
A
T
N
S
P
V
I
V
Q
A
S
A
G
------
A
---
P
F
L
-------
R
H
L
I
L
A
A
I
E
-
E
W
P
-
H
--------
I
P
V
V
M
H
Q
D
H
------
G
-
T
-
S
P
---
D
V
--------
C
Q
R
--
S
----
I
Q
L
-----
G
---------
F
S
S
V
M
M
D
G
S
LGADG
K
T
-------
P
T
T
Y
D
Y
N
V
D
V
T
R
Q
V
V
A
M
A
H
A
C
G
V
S
V
E
G
E
I
G
C
L
G
S
LET-------------------------------
V
LD
H
S
Q
L
L
-
T
------
S
V
E
E
---
A
K
Q
F
V
A
D
-
T
------
N
V
D
A
L
A
I
A
V
G
T
S
H
G
A
Y
KFTR
P
--
P
T
-
G
D
----
I
-
L
A
I
D
R
--
I
---
K
E
I
H
A
A
----
L
-
P
------
N
T
H
-------
L
V
M
H
G
S
S
SVP
Q
E
W
L
K
V
I
N
E
F
G
G
N
I
G
ETY
G
V
P
---------------------
V
---------------------
E
Q
L
V
E
A
I
K
H
G
V
R
K
I
N
I
D
T
D
L
R
L
A
S
T
G
A
I
R
R
-
F
M
A
E
---
N
-------
P
A
E
-------------
F
D
P
R
K
Y
F
A
K
T
V
D
S
M
K
Q
I
C
I
D
R
Y
E
A
F
G
T
A
G
N
A
---
31
PsiBlast_CBE
86.14
34%
-44
- C1 -
-
5U7S
1
?
B:
[9-337]
M
A
L
I
S
M
R
Q
L
L
D
---
H
A
A
E
H
N
Y
G
V
P
A
F
N
V
N
N
L
E
Q
M
R
A
I
M
L
A
A
D
A
T
N
S
P
V
I
V
Q
A
S
A
G
A
R
K
Y
A
G
A
---
P
F
L
-------
R
H
L
I
L
A
A
I
E
-
E
W
P
-
H
--------
I
P
V
V
M
H
Q
D
H
------
G
-
T
-
S
P
---
D
V
--------
C
Q
R
--
S
----
I
Q
L
-----
G
---------
F
S
S
V
M
M
D
G
S
LGADG
K
T
-------
P
T
T
Y
D
Y
N
V
D
V
T
R
Q
V
V
A
M
A
H
A
C
G
V
S
V
E
G
E
I
G
C
--------------------------------------QL----
L
-
T
------
S
V
E
E
---
A
K
Q
F
V
A
D
-
T
------
N
V
D
A
L
A
I
A
V
G
T
S
H
G
A
Y
KFTR
P
--
P
T
-
G
D
----
I
-
L
A
I
D
R
--
I
---
K
E
I
H
A
A
----
L
-
P
------
N
T
H
-------
L
V
M
H
G
S
S
SVP
Q
E
W
L
K
V
I
N
E
F
G
G
N
I
G
ETY
G
V
P
---------------------
V
---------------------
E
Q
L
V
E
A
I
K
H
G
V
R
K
I
N
I
D
T
D
L
R
L
A
S
T
G
A
I
R
R
-
F
M
A
E
---
N
-------
P
A
E
-------------
F
D
P
R
K
Y
F
A
K
T
V
D
S
M
K
Q
I
C
I
D
R
Y
E
A
F
G
T
A
G
N
A
---
60
HHSearch
85.06
46%
-15
- C1 -
-
4TO8
-
?
A:
[2-285]
-
P
L
V
S
M
K
E
M
L
I
---
D
A
K
E
N
G
Y
A
V
G
Q
Y
N
I
N
N
L
E
F
T
Q
A
I
L
E
A
S
Q
E
E
N
A
P
V
I
L
G
V
S
E
G
A
A
R
Y
M
S
G
F
--
Y
T
I
-------
V
K
M
V
E
G
L
M
H
-
D
L
N
I
T
--------
I
P
V
A
I
H
L
D
H
------
G
-
S
S
F
E
---
K
C
--------
K
E
---
A
----
I
D
A
-----
G
---------
F
T
S
V
M
I
D
A
S
-----
H
S
-------
P
F
--
E
E
N
V
A
T
T
K
K
V
V
E
Y
A
H
E
K
G
V
S
V
E
A
E
L
G
T
V
G
-------
G
---
D
D
V
V
-------------
A
D---
G
I
I
------
Y
-
A
------
D
P
K
E
---
C
Q
E
L
V
E
K
-
T
------
G
I
D
A
L
A
P
A
L
G
S
V
H
G
-------------
P
----
K
-
L
G
F
K
E
--
M
---
E
E
I
G
L
S
----
T
--------
G
L
P
-------
L
V
L
H
G
G
T
---------------------
G
I
P
---------------------
T
---------------------
K
D
I
Q
K
A
I
P
F
G
T
A
K
I
N
V
N
T
E
N
Q
I
A
S
A
K
A
V
R
D
-
V
L
N
N
---
D
-------
K
E
-------------
V
Y
D
P
R
K
Y
L
G
P
A
R
E
A
I
K
E
T
V
K
G
K
I
K
E
F
G
T
S
N
R
A
---
64
HHSearch
84.92
40%
-30
- C1 -
-
1RVG
-
?
A:
[1-305]
-
M
L
V
T
G
L
E
I
L
K
---
K
A
R
E
E
G
Y
G
V
G
A
F
N
V
N
N
M
E
F
L
Q
A
V
L
E
A
A
E
E
Q
R
S
P
V
I
L
A
L
S
E
G
A
M
K
Y
G
-
G
---
R
A
L
-------
T
L
M
A
V
E
L
A
K
-
E
--
A
R
--------
V
P
V
A
V
H
L
D
H
------
G
-
S
S
Y
E
---
S
V
--------
L
R
---
A
----
L
R
A
-----
G
---------
F
T
S
V
M
I
D
K
S
-----
H
E
-------
D
F
--
E
T
N
V
R
E
T
R
R
V
V
E
A
A
H
A
V
G
V
T
V
E
A
E
L
G
R
L
A
-------
G
-
I
E
E
-----------------K---
D
A
L
------
L
-
T
------
N
P
E
E
---
A
R
I
F
M
E
R
-
T
------
G
A
D
Y
L
A
V
A
I
G
T
S
H
G
A
Y
----
K
--
G
K
G
R
P
----
F
-
I
D
H
A
R
--
L
---
E
R
I
A
R
L
----
V
--------
P
A
P
-------
L
V
L
H
G
A
S
---------------------
A
V
P
P
E
L
V
E
R
F
R
A
S
G
G
E
I
G
EAAGIH
P
---------------------
E
D
I
K
K
A
I
S
L
G
I
A
K
I
N
T
D
T
D
L
R
L
A
F
T
A
L
I
R
E
-
A
L
N
K
---
N
-------
P
K
-------------
E
F
D
P
R
K
Y
L
G
P
A
R
E
A
V
K
E
V
V
K
S
R
M
E
L
F
G
S
V
G
R
A
---
68
HHSearch
84.74
40%
-33
- C1 -
-
5U4N
1
?
A:
[9-337]
M
A
L
V
S
M
R
Q
L
L
D
---
H
A
A
E
N
S
Y
G
L
P
A
F
N
V
N
N
L
E
Q
M
R
A
I
M
E
A
A
D
Q
V
N
A
P
V
I
V
Q
A
S
A
G
A
R
K
Y
A
-
G
A
--
P
F
L
-------
R
H
L
I
L
A
A
V
E
-
E
-
F
P
H
--------
I
P
V
V
M
H
Q
D
H
------
G
-
A
S
P
D
---
V
C
--------
Q
R
---
S
----
I
Q
L
-----
G
---------
F
S
S
V
M
M
D
G
S
-----
L
L
EDGK
T
P
S
S
Y
--
E
Y
N
V
N
A
T
R
T
V
V
N
F
S
H
A
C
G
V
S
V
E
G
E
I
G
V
L
G
-------
N
-
L
E
T
G
E
A
G
E
EDG
V
G
A
A
G
KLS
H
----
D
Q
M
------
L
-
T
------
S
V
E
D
---
A
V
R
F
V
K
D
-
T
------
G
V
D
A
L
A
I
A
V
G
T
S
H
G
A
Y
----
K
--
F
T
-
R
P
PTGD
V
-
L
R
I
D
R
--
I
---
K
E
I
H
Q
A
----
L
-
P
------
N
T
H
-------
I
V
M
H
G
S
S
---------------------
S
V
P
---------------------
Q
E
W
L
K
V
I
N
E
Y
G
G
N
I
G
ETYGVP
V
E
E
I
V
E
G
I
K
H
G
V
R
K
V
N
I
D
T
D
L
R
L
A
S
T
G
A
V
R
R
-
Y
L
A
E
---
N
-------
P
S
-------------
D
F
D
P
R
K
Y
L
G
K
T
I
E
A
M
K
Q
I
C
L
D
R
Y
L
A
F
G
C
E
G
Q
A
---
1
PsiBlast_PDB
84.19
44%
-14
- C1 -
-
4TO8
-
?
A:
[2-285]
-
P
L
V
S
M
K
E
M
L
I
---
D
A
K
E
N
G
Y
A
V
G
Q
Y
N
I
N
N
L
E
F
T
Q
A
I
L
E
A
S
Q
E
E
N
A
P
V
I
L
G
V
S
E
G
A
A
R
Y
M
S
G
F
--
Y
T
I
-------
V
K
M
V
E
G
L
M
H
-
D
L
N
I
T
--------
I
P
V
A
I
H
L
D
H
------
G
S
S
-
F
E
---
K
C
--------
K
E
---
A
----
I
D
A
-----
G
---------
F
T
S
V
M
I
D
A
S
-----
H
S
-------
P
F
--
E
E
N
V
A
T
T
K
K
V
V
E
Y
A
H
E
K
G
V
S
V
E
A
E
L
G
T
V
G
-------
G
---
D
D
V
V
-------------
A
----
D
G
I
------
I
Y
A
------
D
P
K
E
---
C
Q
E
L
V
-
E
K
T
------
G
I
D
A
L
A
P
A
L
G
S
V
H
G
-------------
P
----
K
-
L
G
F
K
E
--
M
---
E
E
I
G
L
S
----
T
--------
G
L
P
-------
L
V
L
H
G
G
T
---------------------
G
I
P
---------------------
T
---------------------
K
D
I
Q
K
A
I
P
F
G
T
A
K
I
N
V
N
T
E
N
Q
I
A
S
A
K
A
V
R
D
-
V
L
N
-----------------------
N
D
K
E
V
Y
D
P
R
K
Y
L
G
P
A
R
E
A
I
K
E
T
V
K
G
K
I
K
E
F
G
T
S
N
R
A
---
2
PsiBlast_PDB
83.95
47%
-16
- C1 -
-
3Q94
1
?
A:
[6-288]
--
L
V
S
M
K
E
M
L
N
---
K
A
L
E
G
K
Y
A
V
G
Q
F
N
M
N
N
L
E
W
T
Q
A
I
L
A
A
A
E
E
E
K
S
P
V
I
L
G
V
S
E
G
A
A
R
H
M
T
G
F
--
K
T
V
-------
V
A
M
V
K
A
L
I
E
-
E
M
N
I
T
--------
V
P
V
A
I
H
L
D
H
------
G
S
S
-
F
E
---
K
C
--------
K
E
---
A
----
I
D
A
-----
G
---------
F
T
S
V
M
I
D
A
S
-----
H
H
-------
P
F
--
E
E
N
V
E
T
T
K
K
V
V
E
Y
A
H
A
R
N
V
S
V
E
A
E
L
G
T
V
G
-------
G
-
Q
E
D
D
V
I
-------------
A
----
E
G
V
------
I
Y
A
------
D
P
A
E
---
C
K
H
L
V
-
E
A
T
------
G
I
D
C
L
A
P
A
L
G
S
V
H
G
P
Y
----
K
GE
P
N
-
L
G
----
F
-
A
E
M
E
Q
--
V
---
R
D
F
T
---------------
G
V
P
-------
L
V
L
H
G
G
T
---------------------
G
I
P
---------------------
T
---------------------
A
D
I
E
K
A
I
S
L
G
T
S
K
I
N
V
N
T
E
N
Q
I
E
F
T
K
A
V
R
E
V
L
N
K
D
Q
E
------------------------
V
Y
D
P
R
K
F
I
G
P
G
R
D
A
I
K
A
T
V
I
G
K
I
R
E
F
G
S
N
G
K
A
---
63
HHSearch
82.72
39%
-26
* C1 *
-
1GVF
10
KBAY_ECOLI
B:
[2-284]
-
S
I
I
S
T
K
Y
L
L
Q
---
D
A
Q
A
N
G
Y
A
V
P
A
F
N
I
H
N
A
E
T
I
Q
A
I
L
E
V
C
S
E
M
R
S
P
V
I
L
A
G
T
P
G
T
F
K
H
I
-
A
L
--
E
E
I
-------
Y
A
L
C
S
A
Y
S
T
-
T
--
Y
N
--------
M
P
L
A
L
H
L
D
H
------
H
-
E
S
L
D
---
D
I
--------
R
R
---
K
----
V
H
A
-----
G
---------
V
R
S
A
M
I
D
G
S
-----
H
F
-------
P
F
--
A
E
N
V
K
L
V
K
S
V
V
D
F
C
H
S
Q
D
C
S
V
E
A
E
L
G
R
L
G
-------
G
-
V
E
----------------------
S
A
F
------
L
-
T
------
D
P
Q
E
---
A
K
R
F
V
E
L
-
T
------
G
V
D
S
L
A
V
A
I
G
T
A
H
G
L
Y
----
S
--
K
--
T
P
----
K
-
I
D
F
Q
R
--
L
---
A
E
I
R
E
V
----
V
--------
D
V
P
-------
L
V
L
H
G
A
S
---------------------
D
V
P
---------------------
D
---------------------
E
F
V
R
R
T
I
E
L
G
V
T
K
V
N
V
A
T
E
L
K
I
A
F
A
G
A
V
K
A
-
W
F
A
E
---
N
-------
P
Q
-------------
G
N
D
P
R
Y
Y
M
R
V
G
M
D
A
M
K
E
V
V
R
N
K
I
N
V
C
G
S
A
N
R
I
---
6
PsiBlast_PDB
82.44
37%
-61
- C1 -
-
3GAK
-
?
A:
[2-307]
-
P
L
C
T
L
R
Q
M
L
G
---
E
A
R
K
H
K
Y
G
V
G
A
F
N
V
N
N
M
E
Q
I
Q
G
I
M
K
A
V
V
Q
L
K
S
P
V
I
L
Q
C
S
R
G
A
L
K
Y
S
D
M
I
--
Y
L
K
-------
K
L
C
E
A
A
L
E
K
-
H
P
D
I
----------
P
I
C
I
H
L
D
H
------
G
--------
D
T
--------
L
E
---
S
V
K
M
A
I
D
L
-----
G
---------
F
S
S
V
M
I
D
A
S
-----
H
H
-------
P
F
--
D
E
N
V
R
I
T
K
E
V
V
A
Y
A
H
A
R
G
V
S
V
E
A
E
L
G
-----------------------------------------------
T
------
E
P
Q
D
---
A
K
K
F
V
-
E
L
T
------
G
V
D
A
L
A
V
A
I
-------------------------
L
A
I
D
R
--
V
---
K
T
I
S
D
-----
L
-
T
------
G
I
P
-------
L
V
M
H
G
S
S
SVP
K
D
V
K
D
M
I
N
K
Y
G
G
K
MPDA
V
G
V
P
---------------------
I
---------------------
E
S
I
V
H
A
I
G
E
G
V
C
K
I
N
V
D
S
D
S
R
M
A
M
T
G
A
I
R
K
-
V
F
--------------
V
E
H
-------
P
E
K
--
F
D
P
R
D
Y
L
G
P
G
R
D
A
I
T
E
M
L
I
P
K
I
K
A
F
G
S
A
G
H
A
---
10
PsiBlast_PDB
82.31
35%
-33
- C1 -
-
5U4N
1
?
A:
[9-337]
M
A
L
V
S
M
R
Q
L
L
D
---
H
A
A
E
N
S
Y
G
L
P
A
F
N
V
N
N
L
E
Q
M
R
A
I
M
E
A
A
D
Q
V
N
A
P
V
I
V
Q
A
S
A
G
A
R
K
Y
A
G
A
---
P
F
L
-------
R
H
L
I
L
A
A
V
E
-
E
F
P
-
H
--------
I
P
V
V
M
H
Q
D
H
------
G
-
A
-
S
P
---
D
V
--------
C
Q
R
--
S
----
I
Q
L
-----
G
---------
F
S
S
V
M
M
D
G
S
-----
L
L
EDGK
T
P
S
S
Y
--
E
Y
N
V
N
A
T
R
T
V
V
N
F
S
H
A
C
G
V
S
V
E
G
E
I
G
V
L
G
N
LETG
E
A
G
-
E
E
D
G
V
G
-------------
A
----
A
G
K
------
L
-
S
H
D
Q
M
L
T
S
V
E
D
---
A
V
R
F
V
K
D
-
T
------
G
V
D
A
L
A
I
A
V
G
T
S
H
G
A
Y
KFTR
P
--
P
T
-
G
D
----
V
-
L
R
I
D
R
--
I
---
K
E
I
H
Q
A
----
L
-
P
------
N
T
H
-------
I
V
M
H
G
S
S
SVP
Q
E
W
L
K
V
I
N
E
Y
G
G
N
I
G
ETY
G
V
P
---------------------
V
---------------------
E
E
I
V
E
G
I
K
H
G
V
R
K
V
N
I
D
T
D
L
R
L
A
S
T
G
A
V
R
R
-
Y
L
A
E
N
P
S
D
-----------------------
F
D
P
R
K
Y
L
G
K
T
I
E
A
M
K
Q
I
C
L
D
R
Y
L
A
F
G
C
E
G
Q
A
---
69
HHSearch
82.29
36%
-29
- C1 -
-
3PM6
-
ALF_COCIM
A:
[13-299]
---
N
R
A
L
P
L
L
T
---
F
A
R
T
H
S
F
A
I
P
A
I
C
V
Y
N
L
E
G
I
L
A
I
I
R
A
A
E
H
K
R
S
P
A
M
I
L
L
F
P
W
A
I
Q
Y
A
-
D
---
S
L
L
-------
V
R
T
A
A
S
A
C
R
-
A
--
A
S
--------
V
P
I
T
L
H
L
D
H
------
A
-
Q
D
P
E
---
I
I
--------
K
R
---
A
----
A
D
L
SP---
G
---------
F
D
S
I
M
V
D
M
S
-----
H
F
-------
S
K
--
E
E
N
L
R
L
T
R
E
L
V
A
Y
C
N
A
R
G
I
A
T
E
A
E
P
G
R
I
E
-------
G
-
G
E
D
G
V
Q
-------------
D
TVD
L
E
G
V
------
L
-
T
------
T
P
E
E
---
S
E
E
F
V
-
A
-
T
------
G
I
N
W
L
A
P
A
F
G
N
V
H
G
N
Y
----
G
--
P
R
-
G
V
----
Q
-
L
D
Y
E
R
--
L
---
Q
R
I
N
E
A
----
V
G
E
------
R
V
G
-------
L
V
L
H
G
A
D
---------------------
P
F
T
---------------------
K
---------------------
E
I
F
E
K
C
I
E
R
G
V
A
K
V
N
V
N
R
A
V
N
N
E
Y
V
K
V
M
R
E
-
K
A
G
S
---------------------------
L
P
I
T
R
L
H
E
E
V
T
N
A
M
Q
A
A
V
E
K
I
M
D
M
I
D
S
T
G
K
A
---
49
Fugue
81.35
35%
-25
- C1 -
-
3PM6
-
ALF_COCIM
A:
[10-302]
L
K
S
N
R
A
L
P
L
L
T
---
F
A
R
T
H
S
F
A
I
P
A
I
C
V
Y
N
L
E
G
I
L
A
I
I
R
A
A
E
H
K
R
S
P
A
M
I
L
L
F
P
W
A
I
Q
Y
A
D
S
L
--
L
V
R
-------
T
A
A
S
A
C
R
A
-----
A
S
--------
V
P
I
T
L
H
L
D
H
------
A
-
Q
D
P
E
---
I
I
--------
K
R
---
A
----
A
D
L
SP---
G
---------
F
D
S
I
M
V
D
M
S
-----
H
F
-------
S
K
--
E
E
N
L
R
L
T
R
E
L
V
A
Y
C
N
A
R
G
I
A
T
E
A
E
P
G
R
I
E
-------
G
-
G
E
D
G
V
Q
-------------
D
TVD
L
E
G
V
------
L
-
T
------
T
P
E
E
---
S
E
E
F
V
-
A
-
T
------
G
I
N
W
L
A
P
A
F
G
N
V
H
G
N
Y
----
G
--
P
R
-
G
V
----
Q
-
L
D
Y
E
R
--
L
---
Q
R
I
N
E
A
----
V
G
E
------
R
V
G
-------
L
V
L
H
G
A
D
---------------------
P
F
T
---------------------
K
---------------------
E
I
F
E
K
C
I
E
R
G
V
A
K
V
N
V
N
R
A
V
N
N
E
Y
V
K
V
M
R
E
-
K
A
G
S
---------------------------
L
P
I
T
R
L
H
E
E
V
T
N
A
M
Q
A
A
V
E
K
I
M
D
M
I
D
S
T
G
K
A
EFM
8
PsiBlast_PDB
80.77
37%
-43
- C1 -
-
2ISW
1
?
A:
[2-307]
-
P
L
C
T
L
R
Q
M
L
G
---
E
A
R
K
H
K
Y
G
V
G
A
F
N
V
N
N
M
E
Q
I
Q
G
I
M
K
A
V
V
Q
L
K
S
P
V
I
L
Q
C
S
R
G
A
L
K
Y
S
D
M
I
--
Y
L
K
-------
K
L
C
E
A
A
L
E
K
-
H
P
D
I
----------
P
I
C
I
H
L
D
H
------
G
--------
D
T
--------
L
E
---
S
V
K
M
A
I
D
L
-----
G
---------
F
S
S
V
M
I
D
A
S
-----
H
H
-------
P
F
--
D
E
N
V
R
I
T
K
E
V
V
A
Y
A
H
A
R
S
V
S
V
E
A
E
L
G
T
L
-----------------------------------
V
Q
------
L
-
T
------
E
P
Q
D
---
A
K
K
F
V
-
E
L
T
------
G
V
D
A
L
A
V
A
I
G
T
S
H
G
A
Y
----
K
--
F
K
-
S
------R
L
A
I
D
R
--
V
---
K
T
I
S
D
-----
L
-
T
------
G
I
P
-------
L
V
M
H
G
S
S
SVP
K
D
V
K
D
M
I
N
K
Y
GGKMPDAV
G
V
P
---------------------
I
---------------------
E
S
I
V
H
A
I
G
E
G
V
C
K
I
N
V
D
S
D
S
R
M
A
M
T
G
A
I
R
K
-
V
F
--------------
V
E
H
-------
P
E
K
--
F
D
P
R
D
Y
L
G
P
G
R
D
A
I
T
E
M
L
I
P
K
I
K
A
F
G
S
A
G
H
A
---
62
HHSearch
80.75
40%
-13
- C1 -
-
3N9S
2
?
A:
[1-307]
-
M
L
V
K
G
N
E
I
L
L
---
K
A
H
K
E
G
Y
G
V
G
A
F
N
F
V
N
F
E
M
L
N
A
I
F
E
A
G
N
E
E
N
S
P
L
F
I
Q
A
S
E
G
A
I
K
Y
M
-
G
I
--
D
M
A
-------
V
G
M
V
K
I
M
C
E
-
R
-
Y
P
H
--------
I
P
V
A
L
H
L
D
H
------
G
-
T
T
F
E
---
S
C
--------
E
K
---
A
----
V
K
A
-----
G
---------
F
T
S
V
M
I
D
A
S
-----
H
H
-------
A
F
--
E
E
N
L
E
L
T
S
K
V
V
K
M
A
H
N
A
G
V
S
V
E
A
E
L
G
R
L
M
-------
G
-
I
E
D
N
I
S
-------------
V
D
E
K
-
D
A
V
------
L
-
V
------
N
P
K
E
---
A
E
Q
F
V
K
E
-
S
------
Q
V
D
Y
L
A
P
A
I
G
T
S
H
G
A
F
----
K
--
F
K
G
E
P
----
K
-
L
D
F
E
R
--
L
---
Q
E
V
K
R
L
----
T
--------
N
I
P
-------
L
V
L
H
G
A
S
---------------------
A
I
P
---------------------
D
N
V
R
K
S
Y
L
D
A
GGDLKGSKGVP
F
E
F
L
Q
E
S
V
K
G
G
I
N
K
V
N
T
D
T
D
L
R
I
A
F
I
A
E
V
R
K
-
V
A
N
E
---
D
-------
K
S
-------------
Q
F
D
L
R
K
F
F
S
P
A
Q
L
A
L
K
N
V
V
K
E
R
M
K
L
L
G
S
A
N
K
I
---
70
HHSearch
80.27
36%
-37
- C1 -
-
3PM6
-
ALF_COCIM
B:
[13-299]
---
N
R
A
L
P
L
L
T
---
F
A
R
T
H
S
F
A
I
P
A
I
C
V
Y
N
L
E
G
I
L
A
I
I
R
A
A
E
H
K
R
S
P
A
M
I
L
L
F
P
W
A
I
Q
Y
A
-
D
---
S
L
L
-------
V
R
T
A
A
S
A
C
R
-
A
--
A
S
--------
V
P
I
T
L
H
L
D
H
------
A
-
Q
D
P
E
---
I
I
--------
K
R
---
A
----
A
D
L
S
R
SEP
G
---------
F
D
S
I
M
V
D
M
S
-----
H
F
-------
S
K
--
E
E
N
L
R
L
T
R
E
L
V
A
Y
C
N
A
R
G
I
A
T
E
A
E
P
G
--------------------------------------
V
------
L
-
T
------
T
P
E
E
---
S
E
E
F
V
-
A
-
T
------
G
I
N
W
L
A
P
A
F
G
N
-----------------------
L
D
Y
E
R
--
L
---
Q
R
I
N
E
A
----
V
G
E
------
R
V
G
-------
L
V
L
H
G
A
D
---------------------
P
F
T
---------------------
K
---------------------
E
I
F
E
K
C
I
E
R
G
V
A
K
V
N
V
N
R
A
V
N
N
E
Y
V
K
V
M
R
E
-
K
A
G
S
---------------------------
L
P
I
T
R
L
H
E
E
V
T
N
A
M
Q
A
A
V
E
K
I
M
D
M
I
D
S
T
G
K
A
---
61
HHSearch
79.83
40%
0
- C- -
-
3N9R
1
?
B:
[1-307]
-
M
L
V
K
G
N
E
I
L
L
---
K
A
H
K
E
G
Y
G
V
G
A
F
N
F
V
N
F
E
M
L
N
A
I
F
E
A
G
N
E
E
N
S
P
L
F
I
Q
A
S
E
G
A
I
K
Y
M
-
G
I
--
D
M
A
-------
V
G
M
V
K
I
M
C
E
-
R
-
Y
P
H
--------
I
P
V
A
L
H
L
D
H
------
G
-
T
T
F
E
---
S
C
--------
E
K
---
A
----
V
K
A
-----
G
---------
F
T
S
V
M
I
D
A
S
-----
H
H
-------
A
F
--
E
E
N
L
E
L
T
S
K
V
V
K
M
A
H
N
A
G
V
S
V
E
A
E
L
G
R
L
M
-------
G
-
I
------------------------
A
V
------
L
-
V
------
N
P
K
E
---
A
E
Q
F
V
K
E
-
S
------
Q
V
D
Y
L
A
P
A
I
G
T
S
H
G
A
F
----
K
--
F
K
G
E
P
----
K
-
L
D
F
E
R
--
L
---
Q
E
V
K
R
L
----
T
--------
N
I
P
-------
L
V
L
H
G
A
S
---------------------
A
I
P
---------------------
D
NVRKSYLDAGGDLKGSKGVPF
E
F
L
Q
E
S
V
K
G
G
I
N
K
V
N
T
D
T
D
L
R
I
A
F
I
A
E
V
R
K
-
V
A
N
E
---
D
-------
K
S
-------------
Q
F
D
L
R
K
F
F
S
P
A
Q
L
A
L
K
N
V
V
K
E
R
M
K
L
L
G
S
A
N
K
I
---
32
PsiBlast_CBE
79.73
35%
-15
- C1 -
-
3N9S
2
?
B:
[2-306]
--
L
V
K
G
N
E
I
L
L
---
K
A
H
K
E
G
Y
G
V
G
A
F
N
F
V
N
F
E
M
L
N
A
I
F
E
A
G
N
E
E
N
S
P
L
F
I
Q
A
S
E
G
A
I
K
Y
M
G
-
I
--
D
M
A
-------
V
G
M
V
K
I
M
C
E
-
R
Y
P
-
H
--------
I
P
V
A
L
H
L
D
H
------
G
-
T
T
F
E
---
S
C
--------
E
K
---
A
----
V
K
A
-----
G
---------
F
T
S
V
M
I
D
A
S
-----
H
H
-------
A
F
--
E
E
N
L
E
L
T
S
K
V
V
K
M
A
H
N
A
G
V
S
V
E
A
E
L
G
R
L
M
--------------------------------------------
A
VLVN--
P
K
E
A
---
E
Q
F
V
K
-
E
-
S
------
Q
V
D
Y
L
A
P
A
I
G
T
S
H
G
A
F
----
K
--
F
K
-
G
E
P
---
K
-
L
D
F
E
R
--
L
---
Q
E
V
K
R
-----
L
-
T
------
N
I
P
-------
L
V
L
H
G
A
S
---------------------
A
I
P
---------------------
D
N
V
R
K
S
Y
L
D
A
GGDLKGSKGVP
F
E
F
L
Q
E
S
V
K
G
G
I
N
K
V
N
T
D
T
D
L
R
I
A
F
I
A
E
V
R
K
-
V
A
N
-----------------------
E
D
K
S
Q
F
D
L
R
K
F
F
S
P
A
Q
L
A
L
K
N
V
V
K
E
R
M
K
L
L
G
S
A
N
K
----
3
PsiBlast_PDB
79.73
37%
-14
- C1 -
-
1RV8
-
?
A:
[2-305]
--
L
V
T
G
L
E
I
L
K
---
K
A
R
E
E
G
Y
G
V
G
A
F
N
V
N
N
M
E
F
L
Q
A
V
L
E
A
A
E
E
Q
R
S
P
V
I
L
A
L
S
E
G
A
M
K
Y
G
G
--------------
R
A
L
T
L
M
A
V
E
L
A
K
E
A
R
--------
V
P
V
A
V
H
L
D
H
------
G
S
S
-
Y
E
---
S
V
--------
L
R
---
A
----
L
R
A
-----
G
---------
F
T
S
V
M
I
D
K
S
-----
H
E
-------
D
F
--
E
T
N
V
R
E
T
R
R
V
V
E
A
A
H
A
V
G
V
T
V
E
A
E
L
G
R
L
A
-------
G
I-
K
D
A
L
L
-------------
T
----
N
P
E
------
E
-
A
------
R
I
-------
F
M
E
-
R
-
T
------
G
A
D
Y
L
A
V
A
I
G
T
S
H
G
A
Y
----
K
--
G
K
-
G
R
----
P
-
F
-
I
D
H
A
R
L
---
E
R
I
A
R
L
----
V
-
P
------
A
-
P
-------
L
V
L
H
G
A
S
---------------------
A
V
P
P
E
L
V
E
R
F
R
A
S
G
G
E
I
G
EAAGIH
P
---------------------
E
D
I
K
K
A
I
S
L
G
I
A
K
I
N
T
D
T
D
L
R
L
A
F
T
A
L
I
R
-----------------
E
A
L
N
-------
K
N
P
K
E
F
D
P
R
K
Y
L
G
P
A
R
E
A
V
K
E
V
V
K
S
R
M
E
L
F
G
S
V
G
R
A
---
30
PsiBlast_CBE
79.51
38%
-34
- C1 -
-
1GVF
10
KBAY_ECOLI
B:
[2-283]
-
S
I
I
S
T
K
Y
L
L
Q
---
D
A
Q
A
N
G
Y
A
V
P
A
F
N
I
H
N
A
E
T
I
Q
A
I
L
E
V
C
S
E
M
R
S
P
V
I
L
A
G
T
P
G
T
F
K
H
-------
I
A
-------
L
E
E
I
Y
A
L
C
S
-
A
Y
S
T
T
Y
N------
M
P
L
A
L
H
L
D
H
------
H
-
E
S
L
D
---
D
I
--------
R
R
---
K
----
V
H
A
-----
G
---------
V
R
S
A
M
I
D
G
S
-----
H
F
-------
P
F
--
A
E
N
V
K
L
V
K
S
V
V
D
F
C
H
S
Q
D
C
S
V
E
A
E
L
G
R
L
G
-------
G
-
V
E
-------------------------------
S
-
A
------
F
L
T
D
P
Q
E
A
K
R
F
V
-
E
L
T
------
G
V
D
S
L
A
V
A
I
G
T
A
H
G
L
Y
----
S
---
K
-
T
P
----
K
-
I
D
F
Q
R
--
L
---
A
E
I
R
E
V
----
V
--------
D
V
P
-------
L
V
L
H
G
A
S
---------------------
D
V
P
---------------------
D
---------------------
E
F
V
R
R
T
I
E
L
G
V
T
K
V
N
V
A
T
E
L
K
I
A
F
A
G
A
V
K
A
W
F
A
E
N
P
Q
G
N
------------------------
D
P
R
Y
Y
M
R
V
G
M
D
A
M
K
E
V
V
R
N
K
I
N
V
C
G
S
A
N
R
----
9
PsiBlast_PDB
79.10
38%
-40
- C1 -
-
1GVF
9
KBAY_ECOLI
A:
[2-283]
-
S
I
I
S
T
K
Y
L
L
Q
---
D
A
Q
A
N
G
Y
A
V
P
A
F
N
I
H
N
A
E
T
I
Q
A
I
L
E
V
C
S
E
M
R
S
P
V
I
L
A
G
T
P
G
T
F
K
H
-------
I
A
-------
L
E
E
I
Y
A
L
C
S
-
A
Y
S
T
T
Y
N------
M
P
L
A
L
H
L
D
H
------
H
-
E
S
L
D
---
D
I
--------
R
R
---
K
----
V
H
A
-----
G
---------
V
R
S
A
M
I
D
G
S
-----
H
F
-------
P
F
--
A
E
N
V
K
L
V
K
S
V
V
D
F
C
H
S
Q
D
C
S
V
E
A
E
L
G
R
L
G
------------------------------------------
S
-
A
------
F
L
T
D
P
Q
E
A
K
R
F
V
-
E
L
T
------
G
V
D
S
L
A
V
A
I
G
T
A
H
G
L
Y
----
S
---
K
-
T
P
----
K
-
I
D
F
Q
R
--
L
---
A
E
I
R
E
V
----
V
--------
D
V
P
-------
L
V
L
H
G
A
S
---------------------
D
V
P
---------------------
D
---------------------
E
F
V
R
R
T
I
E
L
G
V
T
K
V
N
V
A
T
E
L
K
I
A
F
A
G
A
V
K
A
W
F
A
E
N
P
Q
G
N
------------------------
D
P
R
Y
Y
M
R
V
G
M
D
A
M
K
E
V
V
R
N
K
I
N
V
C
G
S
A
N
R
----
20
PsiBlast_PDB
64.11
30%
-7
- C1 -
-
3ELF
1
ALF_MYCTU
A:
[2-328]
-
P
I
A
T
P
E
V
Y
A
E
M
L
G
Q
A
K
Q
N
S
Y
A
F
P
A
I
N
C
T
S
S
E
T
V
N
A
A
I
K
G
F
A
D
A
G
S
D
G
I
I
Q
F
S
T
G
G
A
E
F
G
S
G
L
--
G
V
--------
K
D
M
V
T
G
A
V
A
-
L
A
E
F
T
H
V
I
A
A
K
YP
V
N
V
A
L
H
T
D
H
CPKDKL
D
-
S
-
Y
V
---
R
P
--------
L
L
---
A
----
I
S
A
-----
Q
R
V
S
K
GGNPL
F
Q
S
H
M
W
D
G
S
-----
A
V
-------
P
I
--
D
E
N
L
A
I
A
Q
E
L
L
K
A
A
A
A
A
K
I
I
L
E
I
E
I
G
V
V
G
-------
G
----------------------------------
Y
-
T
------
S
P
E
D
---
F
E
K
T
I
-
E
-
A
LGAGEH
G
K
Y
L
L
A
A
T
F
G
N
V
H
G
V
Y
----
K
--
P
G
-
N
V
----
K
-
L
R
P
D
I
--
L
A
Q
G
Q
Q
V
A
A
A
----
K
-
L
------
G
L
P
ADAKPFD
F
V
F
H
G
G
S
---------------------
G
S
L
---------------------
K
---------------------
S
E
I
E
E
A
L
R
Y
G
V
V
K
M
N
V
D
T
D
T
Q
Y
A
F
---
T
R
P
-
I
A
G
H
M
F
T
N
Y
DGVLKV
D
G
E
V
-------
G
V
K
K
V
Y
D
P
R
S
Y
L
----
K
K
A
E
A
S
M
S
Q
R
V
------------
19
PsiBlast_PDB
63.91
30%
-8
- C1 -
-
3EKZ
2
ALF_MYCTU
A:
[2-328]
-
P
I
A
T
P
E
V
Y
A
E
M
L
G
Q
A
K
Q
N
S
Y
A
F
P
A
I
N
C
T
S
S
E
T
V
N
A
A
I
K
G
F
A
D
A
G
S
D
G
I
I
Q
F
S
T
G
G
A
E
F
G
S
G
L
--
G
V
--------
K
D
M
V
T
G
A
V
A
-
L
A
E
F
T
H
V
I
A
A
K
YP
V
N
V
A
L
H
T
D
H
CPKDKL
D
-
S
-
Y
V
---
R
P
--------
L
L
---
A
----
I
S
A
-----
Q
R
V
S
K
GGNPL
F
Q
S
H
M
W
D
G
S
-----
A
V
-------
P
I
--
D
E
N
L
A
I
A
Q
E
L
L
K
A
A
A
A
A
K
I
I
L
E
I
E
I
G
V
V
G
-------
G
--------------------------
K
L
------
Y
-
T
------
S
P
E
D
---
F
E
K
T
I
-
E
-
A
LGAGEH
G
K
Y
L
L
A
A
T
F
G
N
V
H
G
V
Y
----
K
--
P
G
-
N
V
----
K
-
L
R
P
D
I
--
L
A
Q
G
Q
Q
V
A
A
A
----
K
-
L
------
G
L
P
ADAKPFD
F
V
F
H
G
G
S
---------------------
G
S
L
---------------------
K
---------------------
S
E
I
E
E
A
L
R
Y
G
V
V
K
M
N
V
D
T
D
T
Q
Y
A
F
---
T
R
P
-
I
A
G
H
M
F
T
N
Y
DGVLKV
D
G
E
V
-------
G
V
K
K
V
Y
D
P
R
S
Y
L
----
K
K
A
E
A
S
M
S
Q
R
V
------------
73
HHSearch
63.61
30%
13
- C1 -
-
4DEL
2
ALF_MYCTU
A:
[9-341]
-----
Y
A
E
M
L
G
---
Q
A
K
Q
N
S
Y
A
F
P
A
I
N
C
T
S
S
E
T
V
N
A
A
I
K
G
F
A
D
A
G
S
D
G
I
I
Q
F
S
T
G
G
A
E
F
G
S
G
L
GV
K
D
M
V
T
G
A
V
A
L
A
E
F
T
H
V
I
A
A
---
K
Y
P
--------
V
N
V
A
L
H
T
D
H
------
C
-
P
K
D
K
LDS
Y
V
R
P
L
L
A
I
S
A
Q
R
V
S
K
G
----
G
N
P
-----
L
---------
F
Q
S
H
M
W
D
G
S
-----
A
V
-------
P
I
--
D
E
N
L
A
I
A
Q
E
L
L
K
A
A
A
A
A
K
I
I
L
E
I
E
I
G
V
V
G
-------
G
-
E
E
D
G
V
A
-------------
N
E
IN-
E
K
L
------
Y
-
T
------
S
P
E
D
---
F
E
K
T
I
E
A
-
L
GAGEH-
G
K
Y
L
L
A
A
T
F
G
N
V
H
G
V
Y
----
K
--
P
G
-
N
V
----
K
-
L
R
P
D
I
--
L
---
A
Q
G
Q
Q
V
A
A
A
K
L
-
G
LPADAK
P
F
D
-------
F
V
F
H
G
G
S
---------------------
G
S
L
---------------------
K
---------------------
S
E
I
E
E
A
L
R
Y
G
V
V
K
M
N
V
D
T
D
T
Q
Y
A
F
T
R
P
I
A
G
-
H
M
F
T
---
N
-------
Y
D
G
V
LKVDGEV
G
V
K
K
V
Y
D
P
R
S
Y
L
K
K
A
E
A
S
M
S
Q
R
V
V
Q
A
C
N
D
L
H
C
A
G
K
S
---
18
PsiBlast_PDB
63.28
30%
-4
- C1 -
-
3EKL
1
ALF_MYCTU
A:
[2-328]
-
P
I
A
T
P
E
V
Y
A
E
M
L
G
Q
A
K
Q
N
S
Y
A
F
P
A
I
N
C
T
S
S
E
T
V
N
A
A
I
K
G
F
A
D
A
G
S
D
G
I
I
Q
F
S
T
G
G
A
E
F
G
S
G
L
--
G
V
--------
K
D
M
V
T
G
A
V
A
-
L
A
E
F
T
H
V
I
A
A
K
YP
V
N
V
A
L
H
T
D
H
CPKDKL
D
-
S
-
Y
V
---
R
P
--------
L
L
---
A
----
I
S
A
-----
Q
R
V
S
K
GGNPL
F
Q
S
H
M
W
D
G
S
-----
A
V
-------
P
I
--
D
E
N
L
A
I
A
Q
E
L
L
K
A
A
A
A
A
K
I
I
L
E
I
E
I
G
V
V
G
-------
G
---------------------------
L
------
Y
-
T
------
S
P
E
D
---
F
E
K
T
I
-
E
-
A
LGAGEH
G
K
Y
L
L
A
A
T
F
G
N
V
H
G
V
Y
----
K
--
P
G
-
N
V
----
K
-
L
R
P
D
I
--
L
A
Q
G
Q
Q
V
A
A
A
----
K
-
L
------
G
L
P
ADAKPFD
F
V
F
H
G
G
S
---------------------
G
S
L
---------------------
K
---------------------
S
E
I
E
E
A
L
R
Y
G
V
V
K
M
N
V
D
T
D
T
Q
Y
A
F
---
T
R
P
-
I
A
G
H
M
F
T
N
Y
DGVLKV
D
G
E
V
-------
G
V
K
K
V
Y
D
P
R
S
Y
L
----
K
K
A
E
A
S
M
S
Q
R
V
------------