@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 : spr0776: (2017-12-29 )
MKKIFLTLLTVSLLGGVSTAVAQDFTIAAKHAIAVEANTGKILYEKDATQPVEIASITKLITVYLVYEALENGSITLSTPVDISDYPYQLTTNSEASNIPMEARNYTVEELLEATLVSSANSAAIALAEKIAGSEKDFVDMMRAKLLEWGIQDATVVNTTGLNNETLGDNIYPGSKKDEENKLSAYDVAIVARNLIKKYPQVLEITKKPSSTFAGMTITSTNYMLEGMPAYRGGFDGLKTGTTDKAGESFVGTTVEKGMRVITVVLNADHQDNNPYARFTATSSLMDYISSTFTLRKIVQQGDAYQDSKAPVQDGKEDTVIAVAPEDIYLIERVGNQSSQSVQFTPDSKAIPAPLEAGTVVGHLTYEDKDLIGQGYITTERPSFEMVADKKIEKAFFLKVWWNQFVRFVNEKL
Atome Classification :
(20 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.......380........390.......400.......410.
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
M
K
K
I
F
L
T
L
L
T
V
S
L
LGG
V
S
T
A
V
AQ
D
F
T
I
A
A
K
H
A
I
A
V
EANT
G
K
I
L
Y
EKDATQP
V
E
I
A
S
I
T
K
L
I
T
V
Y
L
V
Y
E
A
LENG
S
I
T
L
STPVDISDY
P
Y
Q
L
TT--NS--EASNIPM--EA-RN
Y
T
V
E
E
L
L
E
A
T
L
VSSAN
S
A
A
I
A
L
A
E
K
IAGS
E
K
D
F
V
D
M
M
R
A
K
L
L
E
WGIQ
D
A
T
V
V
N
TTGLNNETLGDNIYPGSKKDEENKL
S
A
Y
D
V
A
I
V
A
R
N
L
I
K
K
Y
P
Q
V
L
E
I
TKKPSSTFA
G
M
T
I
TSTN
Y
M
LEGMPAYRGG-FDGLKTGTTDKAG
E
S
F
V
G
T
T
V
-EKG
M
R
V
I
T
V
V
L
NADHQDNNP
Y
A
R
F
T
A
T
S
S
L
M
D
Y
I
S
S
T
F
T
L
R
K
I
V
QQGDAYQDS--KAPVQDGKED
T
V
I
A
VAPE
D
I
Y
L
I
ERVGNQSS
Q
S
V
Q
FTPDSKAIPAPLEA
G
T
V
V
G
H
L
T
YEDKDLIGQGYITTER-PS
F
E
M
V
A
DKK
I
E
K
A
F
F
L
K
V
W
W
N
Q
F
V
R
F
V
NEKL
1
PsiBlast_PDB
84.16
97%
-77
- C1 -
-
1XP4
-
?
A:
[10-378]
------------------------
F
T
I
A
A
K
H
A
I
A
V
E
A
N
T
G
K
I
L
Y
E
K
D
A
T
Q
P
V
E
I
A
S
I
T
K
L
I
T
V
Y
L
V
Y
E
A
L
E
N
G
S
I
T
L
S
T
P
V
D
I
S
D
Y
P
Y
Q
L
T
T
--
N
S
--
E
A
S
N
I
P
M
--
E
A
-
R
N
Y
T
V
E
E
L
L
E
A
T
L
V
S
S
A
N
S
A
A
I
A
L
A
E
K
I
A
G
S
E
K
D
F
V
D
M
M
R
A
K
L
L
E
W
G
I
Q
D
A
T
V
V
N
T
T
G
L
N
N
E
T
L
G
D
N
I
Y
P
G
S
K
K
D
E
E
N
K
L
S
A
Y
D
V
A
I
V
A
R
N
L
I
K
K
Y
P
Q
V
L
E
I
T
K
K
P
S
S
T
F
A
G
M
T
I
T
S
T
N
Y
M
L
E
G
M
P
A
Y
R
G
G
-
F
D
G
L
K
T
G
T
T
D
K
A
G
E
S
F
V
G
T
T
V
-
E
K
G
M
R
V
I
T
V
V
L
N
A
D
H
Q
D
N
N
P
Y
A
R
F
T
A
T
S
S
L
M
D
Y
I
S
S
T
F
T
L
R
K
I
V
Q
Q
G
D
A
Y
Q
D
S
--
K
A
P
V
Q
D
G
K
E
D
T
V
I
A
V
A
P
E
D
I
Y
L
I
E
R
V
G
N
Q
S
S
Q
S
V
Q
F
T
P
D
S
K
A
I
P
A
P
L
E
A
G
T
V
V
G
H
L
T
Y
E
D
K
D
L
I
G
Q
G
Y
I
T
T
E
R
-
P
S
F
E
M
V
A
D
K
K
I
E
--------------------
34
HHSearch
81.58
99%
-3
- C1 -
-
1XP4
-
?
A:
[10-378]
------------------------
F
T
I
A
A
K
H
A
I
A
V
E
A
N
T
G
K
I
L
Y
E
K
D
A
T
Q
P
V
E
I
A
S
I
T
K
L
I
T
V
Y
L
V
Y
E
A
L
E
N
G
S
I
T
L
S
T
P
V
D
I
S
D
Y
P
Y
Q
L
T
T
--
N
S
--
E
A
S
N
I
P
M
---
E
A
R
N
Y
T
V
E
E
L
L
E
A
T
L
V
S
S
A
N
S
A
A
I
A
L
A
E
K
I
A
G
S
E
K
D
F
V
D
M
M
R
A
K
L
L
E
W
G
I
Q
D
A
T
V
V
N
T
T
G
L
N
N
E
T
L
G
D
N
I
Y
P
G
S
K
K
D
E
E
N
K
L
S
A
Y
D
V
A
I
V
A
R
N
L
I
K
K
Y
P
Q
V
L
E
I
T
K
K
P
S
S
T
F
A
G
M
T
I
T
S
T
N
Y
M
L
E
G
M
P
A
Y
R
G
G
-
F
D
G
L
K
T
G
T
T
D
K
A
G
E
S
F
V
G
T
T
V
-
E
K
G
M
R
V
I
T
V
V
L
N
A
D
H
Q
D
N
N
P
Y
A
R
F
T
A
T
S
S
L
M
D
Y
I
S
S
T
F
T
L
R
K
I
V
Q
Q
G
D
A
--
Y
Q
D
S
K
A
P
V
Q
D
G
K
E
D
T
V
I
A
V
A
P
E
D
I
Y
L
I
E
R
V
G
N
Q
S
S
Q
S
V
Q
F
T
P
D
S
K
A
I
P
A
P
L
E
A
G
T
V
V
G
H
L
T
Y
E
D
K
D
L
I
G
Q
G
Y
I
T
T
E
R
-
P
S
F
E
M
V
A
D
K
K
I
E
--------------------
15
PsiBlast_PDB
56.60
25%
14
- C1 -
-
3MZF
2
DACA_ECOLI
A:
[15-335]
--------------------------
I
D
A
E
S
Y
I
L
I
D
Y
N
S
G
K
V
L
A
E
Q
N
A
D
V
R
R
D
P
A
S
L
T
K
M
M
T
S
Y
V
I
G
Q
A
M
K
A
G
K
F
K
E
T
D
L
V
T
I
G
N
D
A
W
A
-
T
G
--
N
P
VF
K
G
S
S
L
M
F
LK
P
G
-
M
Q
V
P
V
S
Q
L
I
R
G
I
N
L
Q
S
G
N
D
A
C
V
A
M
A
D
F
A
A
G
S
Q
D
A
F
V
G
L
M
N
S
Y
V
N
A
L
G
L
K
N
T
H
F
Q
T
V
H
G
L
D
----
A
D
G
Q
Y
S
----------
S
A
R
D
M
A
L
I
G
Q
A
L
I
R
D
V
P
N
E
Y
S
I
Y
K
E
K
E
F
T
F
N
G
I
R
Q
L
N
R
N
G
L
L
W
D
N
S
L
---
N
-
V
D
G
I
K
T
G
H
T
D
K
A
G
Y
N
L
V
A
S
A
T
-
E
G
Q
M
R
L
I
S
A
V
M
G
G
----
R
T
F
K
G
R
E
A
E
S
K
K
L
L
T
W
G
F
R
F
F
E
T
V
N
P
L
K
V
G
K
E
F
--
A
--
S
E
P
V
W
F
G
D
S
D
R
A
S
L
G
V
D
K
D
V
Y
L
T
I
P
R
G
R
M
K
D
L
K
A
S
Y
V
L
N
S
S
E
L
H
A
P
L
Q
K
N
Q
V
V
G
T
I
N
F
Q
-----------------------------------------------
46
Fugue
56.38
25%
-82
- C1 -
-
1HD8
-
DACA_ECOLI
A:
[3-356]
--------------
L
N
I
K
T
M
I
P
G
V
P
Q
I
D
A
E
S
Y
I
L
I
D
Y
N
S
G
K
V
L
A
E
Q
N
A
D
V
R
R
D
P
A
S
L
T
K
M
M
T
S
Y
V
I
G
Q
A
M
K
A
G
K
F
K
E
T
D
L
V
T
I
G
N
L
K
--------------------
P
G
-
M
Q
V
P
V
S
Q
L
I
R
D
I
N
L
Q
S
G
N
D
A
C
V
A
M
A
D
F
A
A
G
S
Q
D
A
F
V
G
L
M
N
S
Y
V
N
A
L
G
L
K
N
T
H
F
Q
T
V
H
G
L
D
--------------
A
D
G
Q
Y
S
S
A
R
D
M
A
L
I
G
Q
A
L
I
R
D
V
P
N
E
Y
S
I
Y
K
E
K
E
F
T
F
N
G
I
R
Q
L
N
R
N
G
L
L
W
D
N
S
L
---
N
-
V
D
G
I
K
T
G
H
T
D
K
A
G
Y
N
L
V
A
S
A
T
-
E
G
Q
M
R
L
I
S
A
V
M
G
G
----
R
T
F
K
G
R
E
A
E
S
K
K
L
L
T
W
G
F
R
F
F
E
T
V
N
P
L
K
V
G
K
E
F
--
A
--
S
E
P
V
W
F
G
D
S
D
R
A
S
L
G
V
D
K
D
V
Y
L
T
I
P
R
G
R
M
K
D
L
K
A
S
Y
V
L
N
S
S
E
L
H
A
P
L
Q
K
N
Q
V
V
G
T
I
N
F
Q
L
D
G
--------
K
T
I
-
E
Q
R
P
L
V
V
L
Q
E
I
P
E
G
N
-----------------
6
PsiBlast_PDB
56.23
28%
-62
- C1 -
-
4K91
2
?
A:
[12-319]
--------------------------
L
A
A
K
S
Y
V
L
M
D
G
E
S
G
Q
V
L
V
E
N
N
G
D
Q
R
L
P
P
A
S
L
T
K
L
M
T
A
Y
I
A
T
K
E
I
E
A
G
R
I
G
E
N
D
L
V
T
V
S
E
H
A
W
R
--
T
--
G
G
--
S
R
M
F
I
K
V
--
G
S
-
Q
-
V
S
V
S
D
L
L
H
G
I
I
I
Q
S
G
N
D
A
S
V
A
L
A
E
H
I
A
G
S
E
D
A
F
A
D
M
M
N
T
T
A
Q
K
L
G
L
T
N
S
H
F
M
D
A
T
G
L
P
N
--------------
P
D
H
Y
S
S
A
R
D
M
A
V
L
A
R
A
I
I
Y
G
E
P
S
H
Y
A
I
Y
A
Q
K
E
F
L
W
N
N
I
K
Q
P
N
R
N
L
L
L
-----
W
R
D
K
T
V
D
G
L
K
T
G
H
T
D
E
A
G
Y
C
L
V
A
S
A
V
-
R
D
G
Q
R
M
I
A
V
V
F
G
T
----
N
S
E
Q
A
R
A
A
E
T
Q
K
L
L
T
Y
G
F
R
F
F
E
S
R
N
F
Y
K
K
G
T
E
L
--
T
--
K
G
L
V
W
K
G
S
E
H
E
V
K
A
G
L
A
E
D
L
T
M
T
L
P
R
G
Q
M
Q
K
L
Q
A
S
M
V
L
E
P
Q
L
M
-
A
P
I
Q
Q
G
Q
V
I
G
----------------------------------------------------
8
PsiBlast_PDB
55.23
25%
16
- C1 -
-
1NZO
2
DACA_ECOLI
A:
[15-335]
--------------------------
I
D
A
E
S
Y
I
L
I
D
Y
N
S
G
K
V
L
A
E
Q
N
A
D
V
R
R
D
P
A
S
L
T
K
M
M
T
S
Y
V
I
G
Q
A
M
K
A
G
K
F
K
E
T
D
L
V
T
I
G
N
D
A
W
A
-
T
G
--
N
P
VF
K
G
S
S
L
M
F
LK
P
G
-
M
Q
V
P
V
S
Q
L
I
R
G
I
N
L
Q
S
G
N
D
A
C
V
A
M
A
D
F
A
A
G
S
Q
D
A
F
V
G
L
M
N
S
Y
V
N
A
L
G
L
K
N
T
H
F
Q
T
V
H
G
L
D
----
A
D
G
Q
Y
S
----------
S
A
R
D
M
A
L
I
G
Q
A
L
I
R
D
V
P
N
E
Y
S
I
Y
K
E
K
E
F
T
F
N
G
I
R
Q
L
N
R
N
G
L
L
W
D
N
S
L
---
N
-
V
D
G
I
K
T
G
H
T
D
K
A
G
Y
N
L
V
A
S
A
T
-
E
G
Q
M
R
L
I
S
A
V
M
G
G
----
R
T
F
K
G
R
E
A
E
S
K
K
L
L
T
W
G
F
R
F
F
E
T
V
N
P
L
K
V
G
K
E
F
--
A
--
S
E
P
V
W
F
G
D
S
D
R
A
S
L
G
V
D
K
D
V
Y
L
T
I
P
R
G
R
M
K
D
L
K
A
S
Y
V
L
N
S
S
E
L
H
A
P
L
Q
K
N
Q
V
V
G
T
I
N
F
Q
-----------------------------------------------
10
PsiBlast_PDB
55.09
25%
17
- C1 -
-
1Z6F
2
DACA_ECOLI
A:
[15-335]
--------------------------
I
D
A
E
S
Y
I
L
I
D
Y
N
S
G
K
V
L
A
E
Q
N
A
D
V
R
R
D
P
A
S
L
T
K
M
M
T
S
Y
V
I
G
Q
A
M
K
A
G
K
F
K
E
T
D
L
V
T
I
G
N
D
A
W
A
-
T
G
--
N
P
VF
K
G
S
S
L
M
F
LK
P
G
-
M
Q
V
P
V
S
Q
L
I
R
G
I
N
L
Q
S
G
N
D
A
C
V
A
M
A
D
F
A
A
G
S
Q
D
A
F
V
G
L
M
N
S
Y
V
N
A
L
G
L
K
N
T
H
F
Q
T
V
H
G
L
D
----
A
D
G
Q
Y
S
----------
S
A
R
D
M
A
L
I
G
Q
A
L
I
R
D
V
P
N
E
Y
S
I
Y
K
E
K
E
F
T
F
N
G
I
R
Q
L
N
R
N
G
L
L
W
D
N
S
L
---
N
-
V
D
G
I
K
T
G
H
T
D
K
A
G
Y
N
L
V
A
S
A
T
-
E
G
Q
M
R
L
I
S
A
V
M
G
G
----
R
T
F
K
G
R
E
A
E
S
K
K
L
L
T
W
G
F
R
F
F
E
T
V
N
P
L
K
V
G
K
E
F
--
A
--
S
E
P
V
W
F
G
D
S
D
R
A
S
L
G
V
D
K
D
V
Y
L
T
I
P
R
G
R
M
K
D
L
K
A
S
Y
V
L
N
S
S
E
L
H
A
P
L
Q
K
N
Q
V
V
G
T
I
N
F
Q
-----------------------------------------------
18
PsiBlast_PDB
55.08
25%
10
- C1 -
-
1NJ4
-
DACA_ECOLI
A:
[15-335]
--------------------------
I
D
A
E
S
Y
I
L
I
D
Y
N
S
G
K
V
L
A
E
Q
N
A
D
V
R
R
D
P
A
S
L
T
K
M
M
T
S
Y
V
I
G
Q
A
M
K
A
G
K
F
K
E
T
D
L
V
T
I
G
N
-------------
K
G
S
S
L
M
F
LK
P
G
-
M
Q
V
P
V
S
Q
L
I
R
D
I
N
L
Q
S
G
N
D
A
C
V
A
M
A
D
F
A
A
G
S
Q
D
A
F
V
G
L
M
N
S
Y
V
N
A
L
G
L
K
N
T
H
F
Q
T
V
H
G
L
D
----
A
D
G
Q
Y
S
----------
S
A
R
D
M
A
L
I
G
Q
A
L
I
R
D
V
P
N
E
Y
S
I
Y
K
E
K
E
F
T
F
N
G
I
R
Q
L
N
R
N
G
L
L
W
D
N
S
L
---
N
-
V
D
G
I
K
T
G
H
T
D
K
A
G
Y
N
L
V
A
S
A
T
-
E
G
Q
M
R
L
I
S
A
V
M
G
G
----
R
T
F
K
G
R
E
A
E
S
K
K
L
L
T
W
G
F
R
F
F
E
T
V
N
P
L
K
V
G
K
E
F
--
A
--
S
E
P
V
W
F
G
D
S
D
R
A
S
L
G
V
D
K
D
V
Y
L
T
I
P
R
G
R
M
K
D
L
K
A
S
Y
V
L
N
S
S
E
L
H
A
P
L
Q
K
N
Q
V
V
G
T
I
N
F
Q
-----------------------------------------------
33
HHSearch
55.02
30%
-13
- C1 -
-
4K91
2
?
B:
[7-345]
---------------------
P
A
P
P
Q
L
A
A
K
S
Y
V
L
M
D
G
E
S
G
Q
V
L
V
E
N
N
G
D
Q
R
L
P
P
A
S
L
T
K
L
M
T
A
Y
I
A
T
K
E
I
E
A
G
R
I
G
E
N
D
L
V
T
V
S
E
H
A
W
R
------
T
--
G
G
S
R
M
F
I
--
K
V
G
S
Q
V
S
V
S
D
L
L
H
G
I
I
I
Q
S
G
N
D
A
S
V
A
L
A
E
H
I
A
G
S
E
D
A
F
A
D
M
M
N
T
T
A
Q
K
L
G
L
T
N
S
H
F
M
D
A
T
G
L
P
N
P
D
--------------
H
Y
S
S
A
R
D
M
A
V
L
A
R
A
I
I
Y
G
E
P
S
H
Y
A
I
Y
A
Q
K
E
F
L
W
N
N
I
K
Q
P
N
R
N
L
L
L
W
R
D
----
K
T
-
V
D
G
L
K
T
G
H
T
D
E
A
G
Y
C
L
V
A
S
A
V
-
R
D
G
Q
R
M
I
A
V
V
F
G
T
N
S
----
E
Q
A
R
A
A
E
T
Q
K
L
L
T
Y
G
F
R
F
F
E
S
R
N
F
Y
K
K
G
T
E
--
L
T
--
K
G
L
V
W
K
G
S
E
H
E
V
K
A
G
L
A
E
D
L
T
M
T
L
P
R
G
Q
M
Q
K
L
Q
A
S
M
V
L
-
E
P
Q
L
M
A
P
I
Q
Q
G
Q
V
I
G
K
V
E
V
K
L
D
D
---------
K
V
I
R
S
A
D
L
V
A
L
N
A
V
E
E
G
G
-----------------
26
HHSearch
55.01
25%
13
- C1 -
-
3MZF
2
DACA_ECOLI
A:
[7-357]
------------------
T
M
I
P
G
V
P
Q
I
D
A
E
S
Y
I
L
I
D
Y
N
S
G
K
V
L
A
E
Q
N
A
D
V
R
R
D
P
A
S
L
T
K
M
M
T
S
Y
V
I
G
Q
A
M
K
A
G
K
F
K
E
T
D
L
V
T
I
G
N
D
A
W
A
T
G
N
PV
F
K
--
G
S
S
L
M
F
L
--
K
P
G
M
Q
V
P
V
S
Q
L
I
R
G
I
N
L
Q
S
G
N
D
A
C
V
A
M
A
D
F
A
A
G
S
Q
D
A
F
V
G
L
M
N
S
Y
V
N
A
L
G
L
K
N
T
H
F
Q
T
V
H
G
L
D
A
D
G
--------------
Q
Y
S
S
A
R
D
M
A
L
I
G
Q
A
L
I
R
D
V
P
N
E
Y
S
I
Y
K
E
K
E
F
T
F
N
G
I
R
Q
L
N
R
N
G
L
L
W
D
N
---
S
L
N
-
V
D
G
I
K
T
G
H
T
D
K
A
G
Y
N
L
V
A
S
A
T
-
E
G
Q
M
R
L
I
S
A
V
M
G
G
R
T
----
F
K
G
R
E
A
E
S
K
K
L
L
T
W
G
F
R
F
F
E
T
V
N
P
L
K
V
G
K
E
--
F
A
--
S
E
P
V
W
F
G
D
S
D
R
A
S
L
G
V
D
K
D
V
Y
L
T
I
P
R
G
R
M
K
D
L
K
A
S
Y
V
L
N
S
S
E
L
H
A
P
L
Q
K
N
Q
V
V
G
T
I
N
F
Q
L
D
G
---------
K
T
I
E
Q
R
P
L
V
V
L
Q
E
I
P
E
G
N
F
----------------
11
PsiBlast_PDB
55.00
25%
15
- C1 -
-
3BEB
2
DACA_ECOLI
A:
[15-335]
--------------------------
I
D
A
E
S
Y
I
L
I
D
Y
N
S
G
K
V
L
A
E
Q
N
A
D
V
R
R
D
P
A
S
L
T
K
M
M
T
S
Y
V
I
G
Q
A
M
K
A
G
K
F
K
E
T
D
L
V
T
I
G
N
D
A
W
A
-
T
G
--
N
P
VF
K
G
S
S
L
M
F
LK
P
G
-
M
Q
V
P
V
S
Q
L
I
R
G
I
N
L
Q
S
G
N
D
A
C
V
A
M
A
D
F
A
A
G
S
Q
D
A
F
V
G
L
M
N
S
Y
V
N
A
L
G
L
K
N
T
H
F
Q
T
V
H
G
L
D
----
A
D
G
Q
Y
S
----------
S
A
R
D
M
A
L
I
G
Q
A
L
I
R
D
V
P
N
E
Y
S
I
Y
K
E
K
E
F
T
F
N
G
I
R
Q
L
N
R
N
G
L
L
W
D
N
S
L
---
N
-
V
D
G
I
K
T
G
H
T
D
K
A
G
Y
N
L
V
A
S
A
T
-
E
G
Q
M
R
L
I
S
A
V
M
G
G
----
R
T
F
K
G
R
E
A
E
S
K
K
L
L
T
W
G
F
R
F
F
E
T
V
N
P
L
K
V
G
K
E
F
--
A
--
S
E
P
V
W
F
G
D
S
D
R
A
S
L
G
V
D
K
D
V
Y
L
T
I
P
R
G
R
M
K
D
L
K
A
S
Y
V
L
N
S
S
E
L
H
A
P
L
Q
K
N
Q
V
V
G
T
I
N
F
Q
-----------------------------------------------
14
PsiBlast_PDB
54.93
25%
15
- C1 -
-
3MZE
5
DACA_ECOLI
A:
[15-335]
--------------------------
I
D
A
E
S
Y
I
L
I
D
Y
N
S
G
K
V
L
A
E
Q
N
A
D
V
R
R
D
P
A
S
L
T
K
M
M
T
S
Y
V
I
G
Q
A
M
K
A
G
K
F
K
E
T
D
L
V
T
I
G
N
D
A
W
A
-
T
G
--
N
P
VF
K
G
S
S
L
M
F
LK
P
G
-
M
Q
V
P
V
S
Q
L
I
R
G
I
N
L
Q
S
G
N
D
A
C
V
A
M
A
D
F
A
A
G
S
Q
D
A
F
V
G
L
M
N
S
Y
V
N
A
L
G
L
K
N
T
H
F
Q
T
V
H
G
L
D
----
A
D
G
Q
Y
S
----------
S
A
R
D
M
A
L
I
G
Q
A
L
I
R
D
V
P
N
E
Y
S
I
Y
K
E
K
E
F
T
F
N
G
I
R
Q
L
N
R
N
G
L
L
W
D
N
S
L
---
N
-
V
D
G
I
K
T
G
H
T
D
K
A
G
Y
N
L
V
A
S
A
T
-
E
G
Q
M
R
L
I
S
A
V
M
G
G
----
R
T
F
K
G
R
E
A
E
S
K
K
L
L
T
W
G
F
R
F
F
E
T
V
N
P
L
K
V
G
K
E
F
--
A
--
S
E
P
V
W
F
G
D
S
D
R
A
S
L
G
V
D
K
D
V
Y
L
T
I
P
R
G
R
M
K
D
L
K
A
S
Y
V
L
N
S
S
E
L
H
A
P
L
Q
K
N
Q
V
V
G
T
I
N
F
Q
-----------------------------------------------
29
HHSearch
54.90
26%
-3
- C1 -
-
3A3J
-
DACA_HAEIN
A:
[3-344]
----------------------
T
P
P
Q
I
T
A
Q
T
Y
V
L
M
D
Y
N
S
G
A
I
L
T
A
L
N
P
D
Q
R
Q
Y
P
A
S
L
T
K
M
M
T
S
Y
V
V
G
V
A
L
K
Q
G
K
I
H
N
T
D
M
V
T
I
G
E
S
A
W
G
R
N
---
F
P
--
D
S
S
K
M
F
L
--
D
L
N
T
Q
V
S
V
A
D
L
N
R
G
V
I
V
V
S
G
N
D
A
T
V
A
L
A
E
H
I
S
G
N
V
P
N
F
V
E
T
M
N
K
Y
V
Q
Q
F
G
L
K
N
T
N
F
T
T
P
H
G
L
D
D
P
N
--------------
Q
Y
S
S
A
R
D
M
A
I
I
G
A
H
I
I
R
D
L
P
E
E
Y
K
I
Y
S
E
K
D
F
T
F
N
K
I
K
Q
P
N
R
N
G
L
L
W
D
-
K
--
T
I
N
-
V
D
G
M
K
T
G
H
T
S
Q
A
G
Y
N
L
V
A
S
A
T
T
S
N
N
M
R
L
I
S
V
V
M
G
V
P
T
----
Y
K
G
R
E
V
E
S
K
K
L
L
Q
W
G
F
A
N
F
E
T
F
K
T
L
E
A
G
K
E
--
I
S
--
E
Q
R
V
Y
Y
G
D
K
N
S
V
K
L
G
A
F
M
D
H
F
I
T
I
P
K
G
K
Q
S
E
V
K
A
R
Y
E
L
A
D
K
N
L
Q
A
P
L
A
K
G
Q
V
I
G
K
V
V
Y
A
L
D
G
---------
K
D
I
A
S
A
N
L
Q
V
M
N
D
V
G
E
-------------------
13
PsiBlast_PDB
54.66
25%
17
- C1 -
-
3MZD
2
DACA_ECOLI
A:
[15-335]
--------------------------
I
D
A
E
S
Y
I
L
I
D
Y
N
S
G
K
V
L
A
E
Q
N
A
D
V
R
R
D
P
A
S
L
T
K
M
M
T
S
Y
V
I
G
Q
A
M
K
A
G
K
F
K
E
T
D
L
V
T
I
G
N
D
A
W
A
-
T
G
--
N
P
VF
K
G
S
S
L
M
F
LK
P
G
-
M
Q
V
P
V
S
Q
L
I
R
G
I
N
L
Q
S
G
N
D
A
C
V
A
M
A
D
F
A
A
G
S
Q
D
A
F
V
G
L
M
N
S
Y
V
N
A
L
G
L
K
N
T
H
F
Q
T
V
H
G
L
D
----
A
D
G
Q
Y
S
----------
S
A
R
D
M
A
L
I
G
Q
A
L
I
R
D
V
P
N
E
Y
S
I
Y
K
E
K
E
F
T
F
N
G
I
R
Q
L
N
R
N
G
L
L
W
D
N
S
L
---
N
-
V
D
G
I
K
T
G
H
T
D
K
A
G
Y
N
L
V
A
S
A
T
-
E
G
Q
M
R
L
I
S
A
V
M
G
G
----
R
T
F
K
G
R
E
A
E
S
K
K
L
L
T
W
G
F
R
F
F
E
T
V
N
P
L
K
V
G
K
E
F
--
A
--
S
E
P
V
W
F
G
D
S
D
R
A
S
L
G
V
D
K
D
V
Y
L
T
I
P
R
G
R
M
K
D
L
K
A
S
Y
V
L
N
S
S
E
L
H
A
P
L
Q
K
N
Q
V
V
G
T
I
N
F
Q
-----------------------------------------------
12
PsiBlast_PDB
54.62
25%
16
- C1 -
-
3BEC
5
DACA_ECOLI
A:
[15-335]
--------------------------
I
D
A
E
S
Y
I
L
I
D
Y
N
S
G
K
V
L
A
E
Q
N
A
D
V
R
R
D
P
A
S
L
T
K
M
M
T
S
Y
V
I
G
Q
A
M
K
A
G
K
F
K
E
T
D
L
V
T
I
G
N
D
A
W
A
-
T
G
--
N
P
VF
K
G
S
S
L
M
F
LK
P
G
-
M
Q
V
P
V
S
Q
L
I
R
G
I
N
L
Q
S
G
N
D
A
C
V
A
M
A
D
F
A
A
G
S
Q
D
A
F
V
G
L
M
N
S
Y
V
N
A
L
G
L
K
N
T
H
F
Q
T
V
H
G
L
D
----
A
D
G
Q
Y
S
----------
S
A
R
D
M
A
L
I
G
Q
A
L
I
R
D
V
P
N
E
Y
S
I
Y
K
E
K
E
F
T
F
N
G
I
R
Q
L
N
R
N
G
L
L
W
D
N
S
L
---
N
-
V
D
G
I
K
T
G
H
T
D
K
A
G
Y
N
L
V
A
S
A
T
-
E
G
Q
M
R
L
I
S
A
V
M
G
G
----
R
T
F
K
G
R
E
A
E
S
K
K
L
L
T
W
G
F
R
F
F
E
T
V
N
P
L
K
V
G
K
E
F
--
A
--
S
E
P
V
W
F
G
D
S
D
R
A
S
L
G
V
D
K
D
V
Y
L
T
I
P
R
G
R
M
K
D
L
K
A
S
Y
V
L
N
S
S
E
L
H
A
P
L
Q
K
N
Q
V
V
G
T
I
N
F
Q
-----------------------------------------------
9
PsiBlast_PDB
54.58
25%
9
- C1 -
-
1NZU
1
DACA_ECOLI
A:
[15-335]
--------------------------
I
D
A
E
S
Y
I
L
I
D
Y
N
S
G
K
V
L
A
E
Q
N
A
D
V
R
R
D
P
A
S
L
T
K
M
M
T
S
Y
V
I
G
Q
A
M
K
A
G
K
F
K
E
T
D
L
V
T
I
G
N
D
A
W
A
-
T
G
--------
S
S
L
M
F
LK
P
G
-
M
Q
V
P
V
S
Q
L
I
R
G
I
N
L
Q
S
G
N
D
A
C
V
A
M
A
D
F
A
A
G
S
Q
D
A
F
V
G
L
M
N
S
Y
V
N
A
L
G
L
K
N
T
H
F
Q
T
V
H
G
L
D
----
A
D
G
Q
Y
S
----------
S
A
R
D
M
A
L
I
G
Q
A
L
I
R
D
V
P
N
E
Y
S
I
Y
K
E
K
E
F
T
F
N
G
I
R
Q
L
N
R
N
G
L
L
W
D
N
S
L
---
N
-
V
D
G
I
K
T
G
H
T
D
K
A
G
Y
N
L
V
A
S
A
T
-
E
G
Q
M
R
L
I
S
A
V
M
G
G
----
R
T
F
K
G
R
E
A
E
S
K
K
L
L
T
W
G
F
R
F
F
E
T
V
N
P
L
K
V
G
K
E
F
--
A
--
S
E
P
V
W
F
G
D
S
D
R
A
S
L
G
V
D
K
D
V
Y
L
T
I
P
R
G
R
M
K
D
L
K
A
S
Y
V
L
N
S
S
E
L
H
A
P
L
Q
K
N
Q
V
V
G
T
I
N
F
Q
-----------------------------------------------
16
PsiBlast_PDB
54.11
25%
10
- C1 -
-
5J8X
1
DACA_ECOLI
A:
[38-358]
--------------------------
I
D
A
E
S
Y
I
L
I
D
Y
N
S
G
K
V
L
A
E
Q
N
A
D
V
R
R
D
P
A
S
L
T
K
M
M
T
S
Y
V
I
G
Q
A
M
K
A
G
K
F
K
E
T
D
L
V
T
I
G
N
------------------
M
F
LK
P
G
-
M
Q
V
P
V
S
Q
L
I
R
G
I
N
L
Q
S
G
N
D
A
C
V
A
M
A
D
F
A
A
G
S
Q
D
A
F
V
G
L
M
N
S
Y
V
N
A
L
G
L
K
N
T
H
F
Q
T
V
H
G
L
D
----
A
D
G
Q
Y
S
----------
S
A
R
D
M
A
L
I
G
Q
A
L
I
R
D
V
P
N
E
Y
S
I
Y
K
E
K
E
F
T
F
N
G
I
R
Q
L
N
R
N
G
L
L
W
D
N
S
L
---
N
-
V
D
G
I
K
T
G
H
T
D
K
A
G
Y
N
L
V
A
S
A
T
-
E
G
Q
M
R
L
I
S
A
V
M
G
G
----
R
T
F
K
G
R
E
A
E
S
K
K
L
L
T
W
G
F
R
F
F
E
T
V
N
P
L
K
V
G
K
E
F
--
A
--
S
E
P
V
W
F
G
D
S
D
R
A
S
L
G
V
D
K
D
V
Y
L
T
I
P
R
G
R
M
K
D
L
K
A
S
Y
V
L
N
S
S
E
L
H
A
P
L
Q
K
N
Q
V
V
G
T
I
N
F
Q
-----------------------------------------------
17
PsiBlast_PDB
54.03
25%
13
- C1 -
-
1HD8
-
DACA_ECOLI
A:
[15-335]
--------------------------
I
D
A
E
S
Y
I
L
I
D
Y
N
S
G
K
V
L
A
E
Q
N
A
D
V
R
R
D
P
A
S
L
T
K
M
M
T
S
Y
V
I
G
Q
A
M
K
A
G
K
F
K
E
T
D
L
V
T
I
G
N
--------------------LK
P
G
-
M
Q
V
P
V
S
Q
L
I
R
D
I
N
L
Q
S
G
N
D
A
C
V
A
M
A
D
F
A
A
G
S
Q
D
A
F
V
G
L
M
N
S
Y
V
N
A
L
G
L
K
N
T
H
F
Q
T
V
H
G
L
D
----
A
D
G
Q
Y
S
----------
S
A
R
D
M
A
L
I
G
Q
A
L
I
R
D
V
P
N
E
Y
S
I
Y
K
E
K
E
F
T
F
N
G
I
R
Q
L
N
R
N
G
L
L
W
D
N
S
L
---
N
-
V
D
G
I
K
T
G
H
T
D
K
A
G
Y
N
L
V
A
S
A
T
-
E
G
Q
M
R
L
I
S
A
V
M
G
G
----
R
T
F
K
G
R
E
A
E
S
K
K
L
L
T
W
G
F
R
F
F
E
T
V
N
P
L
K
V
G
K
E
F
--
A
--
S
E
P
V
W
F
G
D
S
D
R
A
S
L
G
V
D
K
D
V
Y
L
T
I
P
R
G
R
M
K
D
L
K
A
S
Y
V
L
N
S
S
E
L
H
A
P
L
Q
K
N
Q
V
V
G
T
I
N
F
Q
-----------------------------------------------
28
HHSearch
53.93
25%
8
- C1 -
-
3ITB
-
DACC_ECOLI
B:
[7-352]
----------------------
E
A
P
S
V
D
A
R
A
W
I
L
M
D
Y
A
S
G
K
V
L
A
E
G
N
A
D
E
K
L
D
P
A
S
L
T
K
I
M
T
S
Y
V
V
G
Q
A
L
K
A
D
K
I
K
L
T
D
M
V
T
V
G
K
D
A
W
A
T
G
N
PA
L
R
--
G
S
S
V
M
F
L
--
K
P
G
D
Q
V
S
V
A
D
L
N
K
G
V
I
I
Q
S
G
N
D
A
C
I
A
L
A
D
Y
V
A
G
S
Q
E
S
F
I
G
L
M
N
G
Y
A
K
K
L
G
L
T
N
T
T
F
Q
T
V
H
G
L
D
A
P
G
--------------
Q
F
S
T
A
R
D
M
A
L
L
G
K
A
L
I
H
D
V
P
E
E
Y
A
I
H
K
E
K
E
F
T
F
N
K
I
R
Q
P
N
R
N
R
L
L
W
S
-
S
--
N
L
N
-
V
D
G
M
K
T
G
T
T
A
G
A
G
Y
N
L
V
A
S
A
T
-
Q
G
D
M
R
L
I
S
V
V
L
G
A
K
T
----
D
R
I
R
F
N
E
S
E
K
L
L
T
W
G
F
R
F
F
E
T
V
T
P
I
K
P
D
A
T
--
F
V
--
T
Q
R
V
W
F
G
D
K
S
E
V
N
L
G
A
G
E
A
G
S
V
T
I
P
R
G
Q
L
K
N
L
K
A
S
Y
T
L
T
E
P
Q
L
T
A
P
L
K
K
G
Q
V
V
G
T
I
D
F
Q
L
N
G
---------
K
S
I
E
Q
R
P
L
I
V
M
E
N
V
E
E
G
G
-----------------
27
HHSearch
53.54
25%
10
- C1 -
-
3ITB
-
DACC_ECOLI
D:
[5-352]
--------------------
T
V
E
A
P
S
V
D
A
R
A
W
I
L
M
D
Y
A
S
G
K
V
L
A
E
G
N
A
D
E
K
L
D
P
A
S
L
T
K
I
M
T
S
Y
V
V
G
Q
A
L
K
A
D
K
I
K
L
T
D
M
V
T
V
G
K
D
A
W
A
T
G
N
PA
L
R
--
G
S
S
V
M
F
L
--
K
P
G
D
Q
V
S
V
A
D
L
N
K
G
V
I
I
Q
S
G
N
D
A
C
I
A
L
A
D
Y
V
A
G
S
Q
E
S
F
I
G
L
M
N
G
Y
A
K
K
L
G
L
T
N
T
T
F
Q
T
V
H
G
L
D
A
P
G
--------------
Q
F
S
T
A
R
D
M
A
L
L
G
K
A
L
I
H
D
V
P
E
E
Y
A
I
H
K
E
K
E
F
T
F
N
K
I
R
Q
P
N
R
N
R
L
L
W
S
-
S
--
N
L
N
-
V
D
G
M
K
T
G
T
T
A
G
A
G
Y
N
L
V
A
S
A
T
-
Q
G
D
M
R
L
I
S
V
V
L
G
A
K
T
----
D
R
I
R
F
N
E
S
E
K
L
L
T
W
G
F
R
F
F
E
T
V
T
P
I
K
P
D
A
T
--
F
V
--
T
Q
R
V
W
F
G
D
K
S
E
V
N
L
G
A
G
E
A
G
S
V
T
I
P
R
G
Q
L
K
N
L
K
A
S
Y
T
L
T
E
P
Q
L
T
A
P
L
K
K
G
Q
V
V
G
T
I
D
F
Q
L
N
G
---------
K
S
I
E
Q
R
P
L
I
V
M
E
N
V
E
E
G
G
-----------------