@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 : SA0240: (2016-03-13 )
MKALKLYGVEDLRYEDNEKPVIESANDVIVKVRATGICGSDTSRYKKMGPYIKGMPFGHEFSGVVDAIGSDVTHVNVGDKVTGCPAIPCYQCEYCLKGEYARCEKLFVIGSYEPGSFAEYVKLPAQNVLKVPDNVDYIEAAMVEPSAVVAHGFYKSNIQPGMTVAVMGCGSIGLLAIQWARIFGAAHIIAIDIDAHKLDIATSLGAHQTINSKEENLEKFIENHYANQIDLAIESSGAKVTIGQILTLPKKGGEVVLLGIPYDDIEIDRVHFEKILRNELTVCGSWNCLSSNFPGKEWTATLHYMKTKDINVKPIISHFLPLEKGPETFDKLVNKKERFDKVMFTIY
Atome Classification :
(23 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.....
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
M
K
A
L
-
K
L
YGV-EDLRYEDNEKPVIESA-N
D
-
V
I
V
K
V
R
A
TGICGSD
T
S
--
R
Y
K
----KMGP----YI--KGMP--F--G
H
E
F
S
G
V
V
D
A
IGSD
V
T
H
V
NVGDKVTGCPAI--
P
C
Y
Q
C
E
Y
C
LKG
E
Y
A
R
C
E
K
L
-
F
V
I
GS-Y-EP------G
S
F
A
E
Y
V
KL
P
A
Q
N
V--LKVPDN
V
D
Y
I
E
A
A
MVEP
S
A
V
V
AH-G
F
Y
K-SNIQPG
M
T
V
A
V
MGCGS
I
G
L
L
A
I
Q
W
A
R
I
FG
A
A
H
I
I
A
I
DIDA
H
K
L
D
I
A
TSLGAH---QTI-----N-
S
K
E
---
E
---
N
L
E
K
F
I
E
N
HYAN
Q
-
I
D
L
A
I
ESSG
A
K
V
T
I
G
Q
I
L
TLPKKG
G
E
V
V
L
L
GIPYDDI
E
I
D
R
V
H
F
-
E
K
I
L
R
NE
L
T
V-CGSWNCLSSNFP-GKE
W
T
A
T
L
H
Y
M
KTKDI
N
V
K
P
I
I
S
H
F
LPLEKG
P
E
T
F
D
K
L
V
N
K
K
E
R
F
D
K
V
M
F
T
IY
13
PsiBlast_PDB
89.95
31%
-101
- C1 -
4CPD
3
?
A:
[1-345]
M
R
A
V
-
V
F
E
N
K
-
E
R
V
A
V
K
E
V
N
A
P
R
L
Q
H
P
-
L
D
-
A
L
V
R
V
H
L
A
G
I
C
G
S
D
L
H
--
L
Y
H
----
G
K
I
P
----
V
L
--
P
G
S
V
--
L
--
G
H
E
F
V
G
Q
V
E
A
V
G
E
G
I
Q
D
L
Q
P
G
D
W
V
V
G
P
F
H
I
--
A
C
G
T
C
P
Y
C
R
R
H
Q
Y
N
L
C
E
R
G
-
G
V
Y
G
--
Y
-
G
P
MFGNLQ
G
A
Q
A
E
I
L
R
V
P
F
S
N
V
N
L
R
K
L
P
P
N
L
S
P
E
R
A
I
F
A
G
D
I
L
S
T
A
Y
G
G
L
I
Q
-
G
Q
L
R
P
G
D
S
V
A
V
I
G
A
G
P
V
G
L
M
A
I
E
V
A
Q
V
L
G
A
S
K
I
L
A
I
D
R
I
P
E
R
L
E
R
A
A
S
L
G
A
----
I
P
I
-----
N
-
A
E
Q
---
E
---
N
P
V
R
R
V
R
S
E
T
N
D
E
G
P
D
L
V
L
E
A
V
G
G
A
A
T
L
S
L
A
L
E
M
V
R
P
G
G
R
V
S
A
V
G
V
--
D
N
A
P
S
F
P
F
P
L
-
A
S
G
L
V
K
D
L
T
F
R
I
G
L
A
N
V
-------
H
L
Y
I
D
A
V
L
A
L
L
A
S
G
R
L
Q
P
E
R
I
V
S
H
Y
L
P
L
E
E
A
P
R
G
Y
E
-
L
F
D
R
K
E
A
L
-
K
V
L
L
V
V
-
28
PsiBlast_CBE
88.40
31%
-100
- C1 -
4CPD
2
?
B:
[1-345]
M
R
A
V
-
V
F
E
N
K
-
E
R
V
A
V
K
E
V
N
A
P
R
L
Q
H
P
-
L
D
-
A
L
V
R
V
H
L
A
G
I
C
G
S
D
L
H
--
L
Y
H
----
G
K
I
P
----
V
L
--
P
G
S
V
--
L
--
G
H
E
F
V
G
Q
V
E
A
V
G
E
G
I
Q
D
L
Q
P
G
D
W
V
V
G
P
F
H
I
--
A
C
G
T
C
P
Y
C
R
R
H
Q
Y
N
L
C
E
R
G
-
G
V
Y
G
--
Y
-
G
P
MFGNLQ
G
A
Q
A
E
I
L
R
V
P
F
S
N
V
NL
R
K
L
P
P
N
L
S
P
E
R
A
I
F
A
G
D
I
L
S
T
A
Y
G
G
L
I
Q
-
G
Q
L
R
P
G
D
S
V
A
V
I
G
A
G
P
V
G
L
M
A
I
E
V
A
Q
V
L
G
A
S
K
I
L
A
I
D
R
I
P
E
R
L
E
R
A
A
S
L
G
A
----
I
P
I
-----
N
-
A
E
Q
---
E
---
N
P
V
R
R
V
R
S
E
T
N
D
E
G
P
D
L
V
L
E
A
V
G
G
A
A
T
L
S
L
A
L
E
M
V
R
P
G
G
R
V
S
A
V
G
V
--
D
N
A
P
S
F
P
F
P
L
-
A
S
G
L
V
K
D
L
T
F
R
I
G
L
A
N
V
-------
H
L
Y
I
D
A
V
L
A
L
L
A
S
G
R
L
Q
P
E
R
I
V
S
H
Y
L
P
L
E
E
A
P
R
G
Y
E
-
L
F
D
R
K
E
A
L
-
K
V
L
L
V
V
-
27
PsiBlast_CBE
86.40
31%
-104
- C1 -
4CPD
3
?
D:
[1-345]
M
R
A
V
-
V
F
-------
A
V
K
E
V
N
A
P
R
L
Q
H
P
-
L
D
-
A
L
V
R
V
H
L
A
G
I
C
G
S
D
L
H
--
L
Y
H
----
G
K
I
P
----
V
L
--
P
-
S
V
--
L
--
G
H
E
F
V
G
Q
V
E
A
V
G
E
G
I
-
D
L
Q
P
G
D
W
V
V
G
P
F
H
I
--
A
C
G
T
C
P
Y
C
R
R
H
Q
Y
N
L
C
E
R
G
-
G
V
Y
G
--
Y
-
G
P
MFGNLQ
G
A
Q
A
E
I
L
R
V
P
F
S
N
V
NL
R
K
L
P
P
N
L
S
P
E
R
A
I
F
A
G
D
I
L
S
T
A
Y
G
G
L
I
Q
-
G
Q
L
R
P
G
D
S
V
A
V
I
G
A
G
P
V
G
L
M
A
I
E
V
A
Q
V
L
G
A
S
K
I
L
A
I
D
R
I
P
E
R
L
E
R
A
A
S
L
G
A
----
I
P
I
-----
N
-
A
E
Q
---
E
---
N
P
V
R
R
V
R
S
E
T
N
D
E
G
P
D
L
V
L
E
A
V
G
G
A
A
T
L
S
L
A
L
E
M
V
R
P
G
G
R
V
S
A
V
G
V
--
D
N
A
P
S
F
P
F
P
L
-
A
S
G
L
V
K
D
L
T
F
R
I
G
L
A
N
V
-------
H
L
Y
I
D
A
V
L
A
L
L
A
S
G
R
L
Q
P
E
R
I
V
S
H
Y
L
P
L
E
E
A
P
R
G
Y
E
-
L
F
D
R
K
E
A
L
-
K
V
L
L
V
V
-
5
PsiBlast_PDB
85.59
30%
-99
- C1 -
1PL7
1
DHSO_HUMAN
A:
[10-347]
--
S
L
-
V
V
H
G
P
-
G
D
L
R
L
E
N
--
Y
P
I
P
E
P
G
P
N
E
-
V
L
L
R
M
H
S
V
G
I
C
G
S
D
V
H
Y
W
E
Y
G
----
R
I
G
N
----
F
I
VK
K
P
M
V
--
L
--
G
H
E
A
S
G
T
V
E
K
V
G
S
S
V
K
H
L
K
P
G
D
R
V
A
I
E
P
G
A
--
P
R
E
N
D
E
F
C
K
M
G
R
Y
N
L
S
P
S
I
-
F
F
C
A
T
-
P
P
D
D
------
G
N
L
C
R
F
Y
K
H
N
A
A
F
C
--
Y
K
L
P
D
N
V
T
F
E
E
G
A
L
I
E
P
L
S
V
G
I
H
-
A
C
R
R
-
G
G
V
T
L
G
H
K
V
L
V
C
G
A
G
P
I
G
M
V
T
L
L
V
A
K
A
M
G
A
A
Q
V
V
V
T
D
L
S
A
T
R
L
S
K
A
K
E
I
G
A
D
---
L
V
L
-----
Q
I
S
K
E
S
P
-
Q
---
E
I
A
R
K
V
E
G
Q
L
G
C
K
-
P
E
V
T
I
E
C
T
G
A
E
A
S
I
Q
A
G
I
Y
A
T
R
S
G
G
T
L
V
L
V
G
L
G
S
E
M
T
T
V
P
L
L
H
---
A
A
I
R
-
E
V
D
I
-
K
G
V
F
R
Y
C
N
T
-------
W
P
V
A
I
S
M
L
A
S
K
S
V
N
V
K
P
L
V
T
H
R
F
P
L
E
K
A
L
E
A
F
E
T
F
--
K
K
G
L
G
L
K
I
M
L
---
6
PsiBlast_PDB
85.40
30%
-97
- C1 -
1PL8
2
DHSO_HUMAN
A:
[10-347]
--
S
L
-
V
V
H
G
P
-
G
D
L
R
L
E
N
--
Y
P
I
P
E
P
G
P
N
E
-
V
L
L
R
M
H
S
V
G
I
C
G
S
D
V
H
Y
W
E
Y
G
----
R
I
G
N
----
F
I
VK
K
P
M
V
--
L
--
G
H
E
A
S
G
T
V
E
K
V
G
S
S
V
K
H
L
K
P
G
D
R
V
A
I
E
P
G
A
--
P
R
E
N
D
E
F
C
K
M
G
R
Y
N
L
S
P
S
I
-
F
F
C
A
T
-
P
P
D
D
------
G
N
L
C
R
F
Y
K
H
N
A
A
F
C
--
Y
K
L
P
D
N
V
T
F
E
E
G
A
L
I
E
P
L
S
V
G
I
H
-
A
C
R
R
-
G
G
V
T
L
G
H
K
V
L
V
C
G
A
G
P
I
G
M
V
T
L
L
V
A
K
A
M
G
A
A
Q
V
V
V
T
D
L
S
A
T
R
L
S
K
A
K
E
I
G
A
D
---
L
V
L
-----
Q
I
S
K
E
S
P
-
Q
---
E
I
A
R
K
V
E
G
Q
L
G
C
K
-
P
E
V
T
I
E
C
T
G
A
E
A
S
I
Q
A
G
I
Y
A
T
R
S
G
G
T
L
V
L
V
G
L
G
S
E
M
T
T
V
P
L
L
H
---
A
A
I
R
-
E
V
D
I
-
K
G
V
F
R
Y
C
N
T
-------
W
P
V
A
I
S
M
L
A
S
K
S
V
N
V
K
P
L
V
T
H
R
F
P
L
E
K
A
L
E
A
F
E
T
F
--
K
K
G
L
G
L
K
I
M
L
---
9
PsiBlast_PDB
84.75
30%
-95
- C1 -
3QE3
4
DHSO_SHEEP
A:
[9-346]
--
S
L
-
V
V
H
G
P
-
G
D
L
R
L
E
N
--
Y
P
I
P
E
P
G
P
N
E
-
V
L
L
K
M
H
S
V
G
I
C
G
S
D
V
H
--
Y
W
Q
HG--
R
I
G
D
----
F
V
VK
K
P
M
V
--
L
--
G
H
E
A
S
G
T
V
V
K
V
G
S
L
V
R
H
L
Q
P
G
D
R
V
A
I
Q
P
G
A
--
P
R
Q
T
D
E
F
C
K
I
G
R
Y
N
L
S
P
T
I
-
F
F
C
A
T
-
P
P
D
D
------
G
N
L
C
R
F
Y
K
H
N
A
N
F
C
--
Y
K
L
P
D
N
V
T
F
E
E
G
A
L
I
E
P
L
S
V
G
I
H
-
A
C
R
R
-
A
G
V
T
L
G
N
K
V
L
V
C
G
A
G
P
I
G
L
V
N
L
L
A
A
K
A
M
G
A
A
Q
V
V
V
T
D
L
S
A
S
R
L
S
K
A
K
E
V
G
A
D
F
I
L
E
I
S
-----
N
-
E
S
P
---
E
---
E
I
A
K
K
V
E
G
L
L
G
S
K
-
P
E
V
T
I
E
C
T
G
V
E
T
S
I
Q
A
G
I
Y
A
T
H
S
G
G
T
L
V
L
V
G
L
G
S
E
M
T
S
V
P
L
V
H
A
-
A
T
---
R
E
V
D
I
-
K
G
V
F
R
Y
C
N
T
-------
W
P
M
A
I
S
M
L
A
S
K
S
V
N
V
K
P
L
V
T
H
R
F
P
L
E
K
A
L
E
A
F
E
--
T
S
K
K
G
L
G
L
K
V
M
I
---
34
PsiBlast_CBE
83.31
31%
-104
- C1 -
3PII
5
ADH3_GEOSE
B:
[11-336]
-----------
E
P
L
K
I
K
E
V
E
K
P
T
I
-
S
Y
-
G
E
-
V
L
V
R
I
K
A
C
G
V
C
H
T
D
L
H
--
A
A
H
----
G
D
W
P
----
V
K
--
P
K
L
P
--
L
IP
G
H
E
G
V
G
I
V
E
E
V
G
P
G
V
T
H
L
K
V
G
D
R
V
-
G
I
P
W
L
YS
A
C
G
H
C
D
Y
C
L
S
G
Q
E
T
L
C
E
H
Q
-
K
N
A
G
Y
-
S
-
V
D
------
G
G
Y
A
E
Y
C
R
A
A
A
D
Y
V
--
V
K
I
P
D
N
L
S
F
E
E
A
A
P
I
F
C
A
G
V
T
T
Y
-
K
A
L
K
V
T
G
A
K
P
G
E
W
V
A
I
Y
G
I
G
G
F
G
H
V
A
V
Q
Y
A
K
A
M
G
-
L
N
V
V
A
V
D
I
G
D
E
K
L
E
L
A
K
E
L
G
A
D
---
L
V
V
-----
N
-
P
L
K
---
E
---
D
A
A
K
F
M
K
E
K
V
G
G
--
V
H
A
A
V
V
T
A
V
S
K
P
A
F
Q
S
A
Y
N
S
I
R
R
G
G
A
C
V
L
V
G
L
P
P
E
E
M
P
I
P
I
--
F
-
D
T
V
L
-
N
G
I
K
I
-
I
G
S
I
V
G
T
R
------
K
D
L
Q
E
A
L
Q
F
--
A
A
E
G
K
V
K
T
I
I
-
E
V
Q
P
L
E
K
I
N
E
V
F
D
R
M
L
-
K
G
Q
I
N
G
R
V
V
L
T
L
-
58
HHSearch
82.50
28%
-98
- C1 -
1E3J
4
?
A:
[5-350]
N
L
S
A
-
V
L
Y
K
Q
-
N
D
L
R
L
E
Q
R
P
I
P
E
P
K
-
E
-
D
E
-
V
L
L
Q
M
A
Y
V
G
I
C
G
S
D
V
H
--
Y
Y
E
----
H
G
R
I
ADFI
V
K
--
D
P
M
V
--
I
--
G
H
E
A
S
G
T
V
V
K
V
G
K
N
V
K
H
L
K
K
G
D
R
V
A
V
E
P
G
V
--
P
C
R
R
C
Q
F
C
K
E
G
K
Y
N
L
C
P
D
L
-
T
F
C
A
T
P
P
-
D
D
------
G
N
L
A
R
Y
Y
V
H
A
A
D
F
C
--
H
K
L
P
D
N
V
S
L
E
E
G
A
L
L
E
P
L
S
V
G
V
H
-
A
C
R
R
-
A
G
V
Q
L
G
T
T
V
L
V
I
G
A
G
P
I
G
L
V
S
V
L
A
A
K
A
Y
G
A
F
-
V
V
C
T
A
R
S
P
R
R
L
E
V
A
K
N
C
G
A
D
---
V
T
L
VV---
D
-
P
A
K
---
E
E
E
S
S
I
I
E
R
I
R
S
A
I
G
D
L
-
P
N
V
T
I
D
C
S
G
N
E
K
C
I
T
I
G
I
N
I
T
R
T
G
G
T
L
M
L
V
G
M
G
S
Q
M
---
V
T
V
P
L
-
V
N
A
C
A
R
E
I
D
I
-
K
S
V
F
R
------
Y
-
C
N
D
Y
P
I
A
L
E
M
V
A
S
G
R
C
N
V
K
Q
L
V
T
H
S
F
K
L
E
Q
T
V
D
A
F
E
A
A
R
K
K
A
D
N
T
I
K
V
M
I
S
C
R
4
PsiBlast_PDB
82.49
36%
-96
- C1 -
4UEO
3
?
A:
[12-319]
-------------
V
R
V
A
E
S
V
I
P
E
I
K
H
Q
-
D
E
-
V
R
V
K
I
A
S
S
G
L
C
G
S
D
L
P
--
R
I
F
----
K
N
G
A
----
H
Y
--
Y
P
I
T
--
L
--
G
H
E
F
S
G
Y
I
D
A
V
G
S
G
V
D
D
L
H
P
G
D
A
V
A
C
V
P
L
L
--
P
C
F
T
C
P
E
C
L
K
G
F
Y
S
Q
C
A
K
Y
-
D
F
I
G
S
-
R
-
R
D
------
G
G
F
A
E
Y
I
V
V
K
R
K
N
V
--
F
A
L
P
T
D
M
P
I
E
D
G
A
F
I
E
P
I
T
V
G
L
H
-
A
F
H
L
-
A
Q
G
C
E
N
K
N
V
I
I
I
G
A
G
T
I
G
L
L
A
I
Q
C
A
V
A
L
G
A
K
S
V
T
A
I
D
I
S
S
E
K
L
A
L
A
K
S
F
G
A
M
---
Q
T
F
-----
N
-
S
S
E
MS
A
P
---
Q
M
Q
S
V
L
R
E
L
R
F
N
Q
---
L
I
L
E
T
A
G
V
P
Q
T
V
E
L
A
V
E
I
A
G
P
H
A
Q
L
A
L
V
G
T
L
H
Q
D
L
H
L
T
S
A
T
F
-
G
K
I
L
R
K
E
L
T
V
-
I
G
S
W
M
N
Y
S
S
P
W
P
-
G
Q
E
W
E
T
A
S
R
L
L
T
E
R
K
L
S
L
E
P
L
I
A
H
-----------------------------
22
PsiBlast_CBE
81.75
36%
-98
- C1 -
4UEK
4
?
B:
[12-319]
-------------
V
R
V
A
E
S
V
I
P
E
I
K
H
Q
-
D
E
-
V
R
V
K
I
A
S
S
G
L
C
G
S
D
L
P
--
R
I
F
----
K
N
G
A
----
H
Y
--
Y
P
I
T
--
L
--
G
H
E
F
S
G
Y
I
D
A
V
G
S
G
V
D
D
L
H
P
G
D
A
V
A
C
V
P
L
L
--
P
C
F
T
C
P
E
C
L
K
G
F
Y
S
Q
C
A
K
Y
-
D
F
I
G
S
-
R
-
R
D
------
G
G
F
A
E
Y
I
V
V
K
R
K
N
V
--
F
A
L
P
T
D
M
P
I
E
D
G
A
F
I
E
P
I
T
V
G
L
H
-
A
F
H
L
-
A
Q
G
C
E
N
K
N
V
I
I
I
G
A
G
T
I
G
L
L
A
I
Q
C
A
V
A
L
G
A
K
S
V
T
A
I
D
I
S
S
E
K
L
A
L
A
K
S
F
G
A
M
---
Q
T
F
-----
N
-
S
S
E
MSA
P
---
Q
M
Q
S
V
L
R
E
L
R
F
N
Q
---
L
I
L
E
T
A
G
V
P
Q
T
V
E
L
A
V
E
I
A
G
P
H
A
Q
L
A
L
V
G
T
L
H
Q
D
L
H
L
T
S
A
T
F
-
G
K
I
L
R
K
E
L
T
V
-
I
G
S
W
M
N
Y
S
S
P
W
P
-
G
Q
E
W
E
T
A
S
R
L
L
T
E
R
K
L
S
L
E
P
L
I
A
H
-----------------------------
14
PsiBlast_PDB
81.57
31%
-99
- C1 -
1RJW
4
ADH3_GEOSE
A:
[11-336]
-----------
E
P
L
K
I
K
E
V
E
K
P
T
I
-
S
Y
-
G
E
-
V
L
V
R
I
K
A
C
G
V
C
H
T
D
L
H
--
A
A
H
----
G
D
W
P
----
V
K
--
P
K
L
P
--
L
IP
G
H
E
G
V
G
I
V
E
E
V
G
P
G
V
T
H
L
K
V
G
D
R
V
-
G
I
P
W
L
YS
A
C
G
H
C
D
Y
C
L
S
G
Q
E
T
L
C
E
H
Q
-
K
N
A
G
Y
-
S
-
V
D
------
G
G
Y
A
E
Y
C
R
A
A
A
D
Y
V
--
V
K
I
P
D
N
L
S
F
E
E
A
A
P
I
F
C
A
G
V
T
T
Y
-
K
A
L
K
V
T
G
A
K
P
G
E
W
V
A
I
Y
G
I
G
G
L
G
H
V
A
V
Q
Y
A
K
A
M
G
-
L
N
V
V
A
V
D
I
G
D
E
K
L
E
L
A
K
E
L
G
A
D
---
L
V
V
-----
N
-
P
L
K
---
E
---
D
A
A
K
F
M
K
E
K
V
G
G
--
V
H
A
A
V
V
T
A
V
S
K
P
A
F
Q
S
A
Y
N
S
I
R
R
G
G
A
C
V
L
V
G
L
P
P
E
E
M
P
I
P
I
--
F
-
D
T
V
L
-
N
G
I
K
I
-
I
G
S
I
V
G
T
R
------
K
D
L
Q
E
A
L
Q
F
--
A
A
E
G
K
V
K
T
I
I
-
E
V
Q
P
L
E
K
I
N
E
V
F
D
R
M
L
-
K
G
Q
I
N
G
R
V
V
L
T
L
-
21
PsiBlast_CBE
81.40
36%
-96
- C1 -
4UEO
3
?
B:
[12-319]
-------------
V
R
V
A
E
S
V
I
P
E
I
K
H
Q
-
D
E
-
V
R
V
K
I
A
S
S
G
L
C
G
S
D
L
P
--
R
I
F
----
K
N
G
A
----
H
Y
--
Y
P
I
T
--
L
--
G
H
E
F
S
G
Y
I
D
A
V
G
S
G
V
D
D
L
H
P
G
D
A
V
A
C
V
P
L
L
--
P
C
F
T
C
P
E
C
L
K
G
F
Y
S
Q
C
A
K
Y
-
D
F
I
G
S
-
R
-
R
D
------
G
G
F
A
E
Y
I
V
V
K
R
K
N
V
--
F
A
L
P
T
D
M
P
I
E
D
G
A
F
I
E
P
I
T
V
G
L
H
-
A
F
H
L
-
A
Q
G
C
E
N
K
N
V
I
I
I
G
A
G
T
I
G
L
L
A
I
Q
C
A
V
A
L
G
A
K
S
V
T
A
I
D
I
S
S
E
K
L
A
L
A
K
S
F
G
A
M
---
Q
T
F
-----
N
-
S
S
E
MSA
P
---
Q
M
Q
S
V
L
R
E
L
R
F
N
Q
---
L
I
L
E
T
A
G
V
P
Q
T
V
E
L
A
V
E
I
A
G
P
H
A
Q
L
A
L
V
G
T
L
H
Q
D
L
H
L
T
S
A
T
F
-
G
K
I
L
R
K
E
L
T
V
-
I
G
S
W
M
N
Y
S
S
P
W
P
-
G
Q
E
W
E
T
A
S
R
L
L
T
E
R
K
L
S
L
E
P
L
I
A
H
-----------------------------
32
PsiBlast_CBE
81.33
31%
-101
- C1 -
3PII
4
ADH3_GEOSE
D:
[11-336]
-----------
E
P
L
K
I
K
E
V
E
K
P
T
I
-
S
Y
-
G
E
-
V
L
V
R
I
K
A
C
G
V
C
H
T
D
L
H
--
A
A
H
----
G
D
W
P
----
V
K
--
P
K
L
P
--
L
IP
G
H
E
G
V
G
I
V
E
E
V
G
P
G
V
T
H
L
K
V
G
D
R
V
-
G
I
P
W
L
YS
A
C
G
H
C
D
Y
C
L
S
G
Q
E
T
L
C
E
H
Q
-
K
N
A
G
Y
-
S
-
V
D
------
G
G
Y
A
E
Y
C
R
A
A
A
D
Y
V
--
V
K
I
P
D
N
L
S
F
E
E
A
A
P
I
F
C
A
G
V
T
T
Y
-
K
A
L
K
V
T
G
A
K
P
G
E
W
V
A
I
Y
G
I
G
G
F
G
H
V
A
V
Q
Y
A
K
A
M
G
-
L
N
V
V
A
V
D
I
G
D
E
K
L
E
L
A
K
E
L
G
A
D
---
L
V
V
-----
N
-
P
L
K
---
E
---
D
A
A
K
F
M
K
E
K
V
G
G
--
V
H
A
A
V
V
T
A
V
S
K
P
A
F
Q
S
A
Y
N
S
I
R
R
G
G
A
C
V
L
V
G
L
P
P
E
E
M
P
I
P
I
--
F
-
D
T
V
L
-
N
G
I
K
I
-
I
G
S
I
V
G
T
R
------
K
D
L
Q
E
A
L
Q
F
--
A
A
E
G
K
V
K
T
I
I
-
E
V
Q
P
L
E
K
I
N
E
V
F
D
R
M
L
-
K
G
Q
I
N
G
R
V
V
L
T
L
-
10
PsiBlast_PDB
80.94
30%
-103
- C1 -
1PL6
3
DHSO_HUMAN
A:
[10-335]
--
S
L
-
V
V
H
G
P
-
G
D
L
R
L
E
N
--
Y
P
I
P
E
P
G
P
N
E
-
V
L
L
R
M
H
S
V
G
I
C
G
S
D
V
H
Y
W
E
Y
G
----
R
I
G
N
----
F
I
--
V
K
K
P
M
V
L
--
G
H
E
A
S
G
T
V
E
K
V
G
S
S
V
K
H
L
K
P
G
D
R
V
A
I
E
P
G
A
--
P
R
E
N
D
E
F
C
K
M
G
R
Y
N
L
S
P
S
I
-
F
F
C
A
T
-
P
P
D
D
------
G
N
L
C
R
F
Y
K
H
N
A
A
F
C
--
Y
K
L
P
D
N
V
T
F
E
E
G
A
L
I
E
P
L
S
V
G
I
H
-
A
C
R
R
-
G
G
V
T
L
G
H
K
V
L
V
C
G
A
G
P
I
G
M
V
T
L
L
V
A
K
A
M
G
A
A
Q
V
V
V
T
D
L
S
A
T
R
L
S
K
A
K
E
I
G
A
D
---
L
V
L
-----
Q
I
S
K
E
S
P
-
Q
---
E
I
A
R
K
V
E
G
Q
L
G
C
K
-
P
E
V
T
I
E
C
T
G
A
E
A
S
I
Q
A
G
I
Y
A
T
R
S
G
G
T
L
V
L
V
G
L
G
S
E
M
T
T
V
P
L
L
H
---
A
A
I
R
-
E
V
D
I
-
K
G
V
F
R
Y
C
N
T
-------
W
P
V
A
I
S
M
L
A
S
K
S
V
N
V
K
P
L
V
T
H
R
F
P
L
E
K
A
L
E
A
F
E
-----------------
16
PsiBlast_PDB
80.66
28%
-101
- C1 -
1E3J
4
?
A:
[10-348]
------
L
Y
K
Q
-
N
D
L
R
L
E
--
Q
R
P
I
P
E
P
K
-
E
D
E
V
L
L
Q
M
A
Y
V
G
I
C
G
S
D
V
H
--
Y
Y
E
HG--
R
I
A
D
----
F
I
--
V
K
D
P
--
M
V
I
G
H
E
A
S
G
T
V
V
K
V
G
K
N
V
K
H
L
K
K
G
D
R
V
A
V
E
P
G
V
--
P
C
R
R
C
Q
F
C
K
E
G
K
Y
N
L
C
P
D
L
T
F
C
A
T
P
-
P
-
D
D
------
G
N
L
A
R
Y
Y
V
H
A
A
D
F
C
--
H
K
L
P
D
N
V
S
L
E
E
G
A
L
L
E
P
L
S
V
G
V
H
-
A
C
R
R
-
A
G
V
Q
L
G
T
T
V
L
V
I
G
A
G
P
I
G
L
V
S
V
L
A
A
K
A
Y
G
-
A
F
V
V
C
T
A
R
S
P
R
R
L
E
V
A
K
N
C
G
A
D
---
V
T
L
VVDPA
K
-
E
E
E
---
S
---
S
I
I
E
R
I
R
S
A
I
G
D
L
-
P
N
V
T
I
D
C
S
G
N
E
K
C
I
T
I
G
I
N
I
T
R
T
G
G
T
L
M
L
V
G
M
G
S
Q
M
V
T
V
P
L
V
N
-----------
A
-
C
A
R
E
I
D
I
K
S
V
F
R
Y
C
N
D
Y
P
I
A
L
E
M
V
A
S
G
R
C
N
V
K
Q
L
V
T
H
S
F
K
L
E
Q
T
V
D
A
F
E
A
A
R
K
K
A
D
N
T
I
K
V
M
I
S
--
29
PsiBlast_CBE
80.46
31%
-100
- C1 -
1RJW
6
ADH3_GEOSE
D:
[11-336]
-----------
E
P
L
K
I
K
E
V
E
K
P
T
I
-
S
Y
-
G
E
-
V
L
V
R
I
K
A
C
G
V
C
H
T
D
L
H
--
A
A
H
----
G
D
W
P
----
V
K
--
P
K
L
P
--
L
IP
G
H
E
G
V
G
I
V
E
E
V
G
P
G
V
T
H
L
K
V
G
D
R
V
-
G
I
P
W
L
YS
A
C
G
H
C
D
Y
C
L
S
G
Q
E
T
L
C
E
H
Q
-
K
N
A
G
Y
-
S
-
V
D
------
G
G
Y
A
E
Y
C
R
A
A
A
D
Y
V
--
V
K
I
P
D
N
L
S
F
E
E
A
A
P
I
F
C
A
G
V
T
T
Y
-
K
A
L
K
V
T
G
A
K
P
G
E
W
V
A
I
Y
G
I
G
G
L
G
H
V
A
V
Q
Y
A
K
A
M
G
-
L
N
V
V
A
V
D
I
G
D
E
K
L
E
L
A
K
E
L
G
A
D
---
L
V
V
-----
N
-
P
L
K
---
E
---
D
A
A
K
F
M
K
E
K
V
G
G
--
V
H
A
A
V
V
T
A
V
S
K
P
A
F
Q
S
A
Y
N
S
I
R
R
G
G
A
C
V
L
V
G
L
P
P
E
E
M
P
I
P
I
--
F
-
D
T
V
L
-
N
G
I
K
I
-
I
G
S
I
V
G
T
R
------
K
D
L
Q
E
A
L
Q
F
--
A
A
E
G
K
V
K
T
I
I
-
E
V
Q
P
L
E
K
I
N
E
V
F
D
R
M
L
-
K
G
Q
I
N
G
R
V
V
L
T
L
-
1
PsiBlast_PDB
80.40
36%
-99
- C1 -
4A2C
3
GATD_ECOLI
A:
[12-319]
-------------
V
R
V
A
E
S
V
I
P
E
I
K
H
Q
-
D
E
-
V
R
V
K
I
A
S
S
G
L
C
G
S
D
L
P
--
R
I
F
----
K
N
G
A
----
H
Y
--
Y
P
I
T
--
L
--
G
H
E
F
S
G
Y
I
D
A
V
G
S
G
V
D
D
L
H
P
G
D
A
V
A
C
V
P
L
L
--
P
C
F
T
C
P
E
C
L
K
G
F
Y
S
Q
C
A
K
Y
-
D
F
I
G
S
-
R
-
R
D
------
G
G
F
A
E
Y
I
V
V
K
R
K
N
V
--
F
A
L
P
T
D
M
P
I
E
D
G
A
F
I
E
P
I
T
V
G
L
H
-
A
F
H
L
-
A
Q
G
C
E
N
K
N
V
I
I
I
G
A
G
T
I
G
L
L
A
I
Q
C
A
V
A
L
G
A
K
S
V
T
A
I
D
I
S
S
E
K
L
A
L
A
K
S
F
G
A
M
---
Q
T
F
-----
N
-
S
S
E
MS
A
P
---
Q
M
Q
S
V
L
R
E
L
R
F
N
Q
---
L
I
L
E
T
A
G
V
P
Q
T
V
E
L
A
V
E
I
A
G
P
H
A
Q
L
A
L
V
G
T
L
H
Q
D
L
H
L
T
S
A
T
F
-
G
K
I
L
R
K
E
L
T
V
-
I
G
S
W
M
N
Y
S
S
P
W
P
-
G
Q
E
W
E
T
A
S
R
L
L
T
E
R
K
L
S
L
E
P
L
I
A
H
-----------------------------
23
PsiBlast_CBE
80.38
36%
-95
- C1 -
4UEJ
4
?
B:
[12-319]
-------------
V
R
V
A
E
S
V
I
P
E
I
K
H
Q
-
D
E
-
V
R
V
K
I
A
S
S
G
L
C
G
S
D
L
P
--
R
I
F
----
K
N
G
A
----
H
Y
--
Y
P
I
T
--
L
--
G
H
E
F
S
G
Y
I
D
A
V
G
S
G
V
D
D
L
H
P
G
D
A
V
A
C
V
P
L
L
--
P
C
F
T
C
P
E
C
L
K
G
F
Y
S
Q
C
A
K
Y
-
D
F
I
G
S
-
R
-
R
D
------
G
G
F
A
E
Y
I
V
V
K
R
K
N
V
--
F
A
L
P
T
D
M
P
I
E
D
G
A
F
I
E
P
I
T
V
G
L
H
-
A
F
H
L
-
A
Q
G
C
E
N
K
N
V
I
I
I
G
A
G
T
I
G
L
L
A
I
Q
C
A
V
A
L
G
A
K
S
V
T
A
I
D
I
S
S
E
K
L
A
L
A
K
S
F
G
A
M
---
Q
T
F
-----
N
-
S
S
E
MSA
P
---
Q
M
Q
S
V
L
R
E
L
R
F
N
Q
---
L
I
L
E
T
A
G
V
P
Q
T
V
E
L
A
V
E
I
A
G
P
H
A
Q
L
A
L
V
G
T
L
H
Q
D
L
H
L
T
S
A
T
F
-
G
K
I
L
R
K
E
L
T
V
-
I
G
S
W
M
N
Y
S
S
P
W
P
-
G
Q
E
W
E
T
A
S
R
L
L
T
E
R
K
L
S
L
E
P
L
I
A
H
-----------------------------
24
PsiBlast_CBE
80.35
36%
-98
- C1 -
4A2C
3
GATD_ECOLI
B:
[12-319]
-------------
V
R
V
A
E
S
V
I
P
E
I
K
H
Q
-
D
E
-
V
R
V
K
I
A
S
S
G
L
C
G
S
D
L
P
--
R
I
F
----
K
N
G
A
----
H
Y
--
Y
P
I
T
--
L
--
G
H
E
F
S
G
Y
I
D
A
V
G
S
G
V
D
D
L
H
P
G
D
A
V
A
C
V
P
L
L
--
P
C
F
T
C
P
E
C
L
K
G
F
Y
S
Q
C
A
K
Y
-
D
F
I
G
S
-
R
-
R
D
------
G
G
F
A
E
Y
I
V
V
K
R
K
N
V
--
F
A
L
P
T
D
M
P
I
E
D
G
A
F
I
E
P
I
T
V
G
L
H
-
A
F
H
L
-
A
Q
G
C
E
N
K
N
V
I
I
I
G
A
G
T
I
G
L
L
A
I
Q
C
A
V
A
L
G
A
K
S
V
T
A
I
D
I
S
S
E
K
L
A
L
A
K
S
F
G
A
M
---
Q
T
F
-----
N
-
S
S
E
MSA
P
---
Q
M
Q
S
V
L
R
E
L
R
F
N
Q
---
L
I
L
E
T
A
G
V
P
Q
T
V
E
L
A
V
E
I
A
G
P
H
A
Q
L
A
L
V
G
T
L
H
Q
D
L
H
L
T
S
A
T
F
-
G
K
I
L
R
K
E
L
T
V
-
I
G
S
W
M
N
Y
S
S
P
W
P
-
G
Q
E
W
E
T
A
S
R
L
L
T
E
R
K
L
S
L
E
P
L
I
A
H
-----------------------------
3
PsiBlast_PDB
79.95
36%
-95
- C1 -
4UEK
4
?
A:
[12-319]
-------------
V
R
V
A
E
S
V
I
P
E
I
K
H
Q
-
D
E
-
V
R
V
K
I
A
S
S
G
L
C
G
S
D
L
P
--
R
I
F
----
K
N
G
A
----
H
Y
--
Y
P
I
T
--
L
--
G
H
E
F
S
G
Y
I
D
A
V
G
S
G
V
D
D
L
H
P
G
D
A
V
A
C
V
P
L
L
--
P
C
F
T
C
P
E
C
L
K
G
F
Y
S
Q
C
A
K
Y
-
D
F
I
G
S
-
R
-
R
D
------
G
G
F
A
E
Y
I
V
V
K
R
K
N
V
--
F
A
L
P
T
D
M
P
I
E
D
G
A
F
I
E
P
I
T
V
G
L
H
-
A
F
H
L
-
A
Q
G
C
E
N
K
N
V
I
I
I
G
A
G
T
I
G
L
L
A
I
Q
C
A
V
A
L
G
A
K
S
V
T
A
I
D
I
S
S
E
K
L
A
L
A
K
S
F
G
A
M
---
Q
T
F
-----
N
-
S
S
E
MS
A
P
---
Q
M
Q
S
V
L
R
E
L
R
F
N
Q
---
L
I
L
E
T
A
G
V
P
Q
T
V
E
L
A
V
E
I
A
G
P
H
A
Q
L
A
L
V
G
T
L
H
Q
D
L
H
L
T
S
A
T
F
-
G
K
I
L
R
K
E
L
T
V
-
I
G
S
W
M
N
Y
S
S
P
W
P
-
G
Q
E
W
E
T
A
S
R
L
L
T
E
R
K
L
S
L
E
P
L
I
A
H
-----------------------------
52
HHSearch
75.42
30%
-84
* C1 *
2DQ4
3
TDH_THET8
A:
[1-342]
M
R
A
L
-
A
K
L
A
P
E
E
G
L
T
L
V
D
R
P
V
P
E
P
G
-
P
-
G
E
-
I
L
V
R
V
E
A
A
S
I
C
G
T
D
L
H
--
I
W
K
----
W
D
A
W
A
R
G
R
I
R
--
P
P
L
V
--
T
--
G
H
E
F
S
G
V
V
E
A
V
G
P
G
V
R
R
P
Q
V
G
D
H
V
S
L
E
S
H
I
--
V
C
H
A
C
P
A
C
R
T
G
N
Y
H
V
C
L
N
T
-
Q
I
L
G
V
-
D
-
R
D
------
G
G
F
A
E
Y
V
V
V
P
A
E
N
A
--
W
V
N
P
K
D
L
P
F
E
V
A
A
I
L
E
P
F
G
N
A
V
H
-
T
V
Y
A
-
G
S
G
V
S
G
K
S
V
L
I
T
G
A
G
P
I
G
L
M
A
A
M
V
V
R
A
S
G
A
G
P
I
L
V
S
D
P
N
P
Y
R
L
A
F
A
R
P
Y
-
A
D
---
R
L
V
-----
N
-
P
L
E
---
E
---
D
L
L
E
V
V
R
R
V
T
G
S
G
-
V
E
V
L
L
E
F
S
G
N
E
A
A
I
H
Q
G
L
M
A
L
I
P
G
G
E
A
R
I
L
G
I
P
S
D
P
---
I
R
F
D
L
A
G
E
L
V
M
R
G
I
T
A
-
F
G
I
A
G
R
R
----
L
-
W
Q
T
W
M
Q
G
T
A
L
V
Y
S
G
R
V
D
L
S
P
L
L
T
H
R
L
P
L
S
R
Y
R
E
A
F
G
L
L
A
S
G
Q
-
A
-
V
K
V
I
L
D
P
K
11
PsiBlast_PDB
72.45
31%
-82
- C1 -
2DQ4
3
TDH_THET8
A:
[1-333]
M
R
A
L
A
K
L
A
P
E
-
E
G
L
T
L
V
D
--
R
P
V
P
E
P
G
P
G
E
-
I
L
V
R
V
E
A
A
S
I
C
G
T
D
L
H
--
I
W
K
WD
A
W
A
R
G
R
----
I
R
--
P
P
L
V
--
T
--
G
H
E
F
S
G
V
V
E
A
V
G
P
G
V
R
R
P
Q
V
G
D
H
V
S
L
E
S
H
I
--
V
C
H
A
C
P
A
C
R
T
G
N
Y
H
V
C
L
N
T
-
Q
I
L
G
V
-
D
-
R
D
------
G
G
F
A
E
Y
V
V
V
P
A
E
N
A
--
W
V
N
P
K
D
L
P
F
E
V
A
A
I
L
E
P
F
G
N
A
V
H
-
T
V
Y
A
-
G
S
G
V
S
G
K
S
V
L
I
T
G
A
G
P
I
G
L
M
A
A
M
V
V
R
A
S
G
A
G
P
I
L
V
S
D
P
N
P
Y
R
L
A
F
A
R
P
Y
-
A
D
---
R
L
V
-----
N
-
P
L
E
---
E
---
D
L
L
E
V
V
R
R
V
T
G
S
G
-
V
E
V
L
L
E
F
S
G
N
E
A
A
I
H
Q
G
L
M
A
L
I
P
G
G
E
A
R
I
L
G
I
P
S
D
P
I
R
F
D
-
L
A
G
-
E
L
V
M
R
G
-
I
T
A
-
F
G
----
I
A
G
R
R
L
-
W
Q
T
W
M
Q
G
T
A
L
V
Y
S
G
R
V
D
L
S
P
L
L
T
H
R
L
P
L
S
R
Y
R
E
A
F
G
L
L
A
S
G
Q
-----------
26
PsiBlast_CBE
71.24
31%
-79
- C1 -
2DQ4
3
TDH_THET8
B:
[1-333]
M
R
A
L
A
K
L
A
P
E
-
E
G
L
T
L
V
D
--
R
P
V
P
E
P
G
P
G
E
-
I
L
V
R
V
E
A
A
S
I
C
G
T
D
L
H
--
I
W
K
WDAW
A
R
G
R
----
I
R
--
P
P
L
V
--
T
--
G
H
E
F
S
G
V
V
E
A
V
G
P
G
V
R
R
P
Q
V
G
D
H
V
S
L
E
S
H
I
--
V
C
H
A
C
P
A
C
R
T
G
N
Y
H
V
C
L
N
T
-
Q
I
L
G
V
-
D
-
R
D
------
G
G
F
A
E
Y
V
V
V
P
A
E
N
A
--
W
V
N
P
K
D
L
P
F
E
V
A
A
I
L
E
P
F
G
N
A
V
H
-
T
V
Y
A
-
G
S
G
V
S
G
K
S
V
L
I
T
G
A
G
P
I
G
L
M
A
A
M
V
V
R
A
S
G
A
G
P
I
L
V
S
D
P
N
P
Y
R
L
A
F
A
R
P
Y
-
A
D
---
R
L
V
-----
N
-
P
L
E
---
E
---
D
L
L
E
V
V
R
R
V
T
G
S
G
-
V
E
V
L
L
E
F
S
G
N
E
A
A
I
H
Q
G
L
M
A
L
I
P
G
G
E
A
R
I
L
G
I
P
S
D
P
I
R
F
D
-
L
A
G
-
E
L
V
M
R
G
-
I
T
A
-
F
G
----
I
A
G
R
R
L
-
W
Q
T
W
M
Q
G
T
A
L
V
Y
S
G
R
V
D
L
S
P
L
L
T
H
R
L
P
L
S
R
Y
R
E
A
F
G
L
L
A
S
G
Q
-----------