@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 : gbs0668: (2015-12-02 )
MKLKVFNVREEEATLAQDWANRNHVELSMSEGPLTLETVNEVEGFDGIANAQIGPLDDAIYPLLKEMGIKQIAQRSAGVDMYNLELAKQHGIIISNVPSYSPESIAEFTVTIALNLIRKVELIRANVREQNFSWTLPIRGRVLGNMTVAIIGTGRIGLATAKIFKGFGCRVIGYDIYHNPMADGILEYVNSVEEAVEKADLVSLHMPPTAENTHLFNLDMFKQFKKGAILMNMARGALVETKDLLEALDQGLLEGAGIDTYEFEGPYIPKNCQGQDISDKDFLRLINHPKVIYTPHAAYYTDEAVKNLVEGALNACVEVVETGTTTTRVN
Atome Classification :
(24 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
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
M
K
L
K
V
F
N
VR
E
E
E
A
T
L
A
Q
D
WAN-R
N
-
H
V
E
L
SMSEG
P
L
-
T
L
E
T
V
N
EVEGFDGI-------ANAQIGPL
D
D
-
A
I
-
Y
P
L
L
K
E
M
---
G
I
K
Q
I
A
Q
R
SAGV
D
M
Y
N
L
E
L
A
K
QH
G
I
I
I
SNVPSYS
P
E
S
I
A
E
F
T
V
T
I
A
L
N
L
I
R
K
V
E
L
I
R
A
N
V-REQNF
S
W
T
L
PIR
G
R
V
LG
N
M
T
V
A
I
I
GTGRI
G
L
A
T
A
K
I
F
K
GFG
C
R
V
I
G
YDIYHN-
P
M
A
-
D
-
G
I
---
L
E
Y
V
N
--
S
V
E
E
A
V
E
KA
D
L
V
S
LHMP--PTAEN
T
H
L
F
N
L
D
M
F
K
Q
F
KKG
A
I
L
M
NMARGALV
E
T
K
D
L
L
E
A
L
D
Q
G
L
LEGAGIDTYEFEGPYIPKNCQGQDI
S
D
-
K
D
F
L
R
L
IN-HP
K
V
I
YTPH
A
A
Y
Y
T
D
E
A
V
K
N
L
V
E
G
A
L
N
A
C
V
E
V
V
ETGTTTTRVN
10
PsiBlast_PDB
95.25
34%
-115
- C1 -
1XDW
-
?
A:
[1-331]
M
K
V
L
C
Y
G
V
R
D
V
E
L
P
I
F
E
A
C
N
K
-
E
F
-
G
Y
D
I
K
C
V
P
D
Y
L
N
T
K
E
T
A
E
M
A
A
G
F
D
A
V
I
L
R
G
NCF
A
N
K
Q
--
N
L
D
-------
I
Y
K
K
L
---
G
V
K
Y
I
L
T
R
T
A
G
T
D
H
I
D
K
E
Y
A
K
E
L
G
F
P
M
A
F
V
P
R
Y
S
P
N
A
I
A
E
L
A
V
T
Q
A
M
M
L
L
R
H
T
A
Y
T
T
S
R
T
-
A
K
K
N
F
K
V
D
A
F
M
F
S
K
E
V
R
N
C
T
V
G
V
V
G
L
G
R
I
G
R
V
A
A
Q
I
F
H
G
M
G
A
T
V
I
G
E
D
V
F
E
----
I
-
K
-
G
I
---
E
D
Y
C
T
Q
V
S
L
D
E
V
L
E
K
S
D
I
I
T
I
H
A
P
--
Y
I
K
E
N
G
A
V
V
T
R
D
F
L
K
K
M
K
D
G
A
I
L
V
N
C
A
R
G
Q
L
V
D
T
E
A
V
I
E
A
V
E
S
G
K
L
G
G
Y
G
C
D
V
L
D
G
E
A
S
V
F
G
K
D
L
E
G
Q
K
L
E
N
-
P
L
F
E
K
L
V
D
L
Y
P
R
V
L
I
T
P
H
L
G
S
Y
T
D
E
A
V
K
N
M
V
E
V
S
Y
Q
N
L
K
D
L
A
E
T
G
D
C
P
N
K
I
K
22
PsiBlast_CBE
93.50
35%
-114
- C1 -
2YQ5
1
?
B:
[3-332]
-
K
I
A
M
Y
N
V
S
P
I
E
V
P
Y
I
E
D
W
A
K
-
K
N
-
D
V
E
I
K
T
T
D
Q
A
L
-
T
S
A
T
V
D
L
A
E
G
C
S
S
V
-------
S
L
K
P
L
G
P
V
D
E
E
V
V
-
Y
Q
K
L
S
E
Y
---
G
V
K
C
I
G
L
R
I
V
G
F
N
T
I
N
F
D
W
T
K
---
L
L
V
T
N
V
P
V
Y
S
P
R
A
I
A
E
M
T
V
T
Q
A
M
Y
L
L
R
K
I
G
E
F
R
Y
R
M
D
H
D
H
D
F
T
W
P
S
N
L
I
S
N
E
I
Y
N
L
T
V
G
L
I
G
V
G
H
I
G
S
A
V
A
E
I
F
S
A
M
G
A
K
V
I
A
Y
D
V
A
Y
N
-
P
E
F
-
E
-
P
F
---
L
T
Y
T
D
---
F
D
T
V
L
K
E
A
D
I
V
S
L
H
T
P
L
F
P
S
T
E
N
--
M
I
G
E
K
Q
L
K
E
M
K
K
S
A
Y
L
I
N
C
A
R
G
E
L
V
D
T
G
A
L
I
K
A
L
Q
D
G
E
I
A
G
A
G
L
D
T
L
A
G
E
S
S
Y
F
G
H
T
G
L
T
D
S
E
I
P
-
E
D
Y
K
T
L
A
K
-
M
P
N
V
V
I
T
P
H
S
A
F
Y
T
E
T
S
I
R
N
M
V
Q
I
C
L
T
D
Q
L
T
I
A
K
G
G
R
P
R
S
I
V
N
5
PsiBlast_PDB
91.23
35%
-111
- C1 -
4PRK
-
?
A:
[1-316]
M
K
I
A
V
F
S
P
S
E
S
E
R
K
L
V
A
A
T
E
K
-
K
F
-
G
C
E
L
K
L
I
D
E
S
L
-
S
A
E
N
V
D
Q
V
A
D
C
D
G
V
-------
L
L
K
P
L
G
N
L
D
D
-
E
I
V
Y
K
K
L
A
D
Y
---
G
I
K
S
I
G
L
R
I
V
G
T
N
T
I
D
F
D
L
A
K
K
Y
H
L
T
V
T
N
V
P
V
Y
S
P
R
A
I
A
E
M
A
V
T
Q
A
M
Y
L
N
R
K
I
G
E
F
K
A
N
M
-
D
K
G
D
F
T
N
P
D
S
L
I
S
N
E
I
Y
N
K
T
I
G
L
I
G
V
G
H
I
G
S
A
V
A
Q
I
F
S
A
M
G
A
K
V
L
A
Y
D
V
I
Y
N
-
P
E
V
-
E
-
P
Y
---
L
T
Y
A
D
---
F
D
T
V
L
K
E
A
D
I
I
S
L
H
T
P
--
L
L
K
S
T
E
N
M
I
G
K
K
Q
F
A
E
M
K
N
D
A
I
L
I
N
A
A
R
G
E
L
V
D
T
A
A
L
I
E
A
L
E
K
H
E
I
A
A
A
G
L
D
T
L
A
H
E
S
S
Y
F
F
K
K
V
D
D
A
Q
I
P
--
A
D
Y
K
K
L
A
A
-
M
P
N
V
I
V
T
P
H
S
A
Y
F
T
K
T
S
V
R
N
M
I
E
I
S
L
R
D
T
I
A
L
A
N
G
E
R
A
H
F
V
V
S
24
PsiBlast_CBE
90.69
35%
-112
- C1 -
4PRL
1
?
B:
[1-316]
M
K
I
A
V
F
S
P
S
E
S
E
R
K
L
V
A
A
T
E
K
-
K
F
-
G
C
E
L
K
L
I
D
E
S
L
-
S
A
E
N
V
D
Q
V
A
D
C
D
G
V
-------
L
L
K
P
L
G
N
L
D
D
-
E
I
V
Y
K
K
L
A
D
Y
---
G
I
K
S
I
G
L
R
I
V
G
T
N
T
I
D
F
D
L
A
K
K
Y
H
L
T
V
T
N
V
P
V
Y
S
P
R
A
I
A
E
M
A
V
T
Q
A
M
Y
L
N
R
K
I
G
E
F
K
A
N
M
-
D
K
G
D
F
T
N
P
D
S
L
I
S
N
E
I
Y
N
K
T
I
G
L
I
G
V
G
H
I
G
S
A
V
A
Q
I
F
S
A
M
G
A
K
V
L
A
Y
D
V
I
Y
N
-
P
E
V
-
E
-
P
Y
---
L
T
Y
A
D
---
F
D
T
V
L
K
E
A
D
I
I
S
L
H
T
P
--
L
L
K
S
T
E
N
M
I
G
K
K
Q
F
A
E
M
K
N
D
A
I
L
I
N
A
A
R
G
E
L
V
D
T
A
A
L
I
E
A
L
E
K
H
E
I
A
A
A
G
L
D
T
L
A
H
E
S
S
Y
F
F
K
K
V
D
D
A
Q
I
P
--
A
D
Y
K
K
L
A
A
-
M
P
N
V
I
V
T
P
H
S
A
Y
F
T
K
T
S
V
R
N
M
I
E
I
S
L
R
D
T
I
A
L
A
N
G
E
R
A
H
F
V
V
S
6
PsiBlast_PDB
90.15
35%
-110
- C1 -
4PRL
1
?
A:
[1-316]
M
K
I
A
V
F
S
P
S
E
S
E
R
K
L
V
A
A
T
E
K
-
K
F
-
G
C
E
L
K
L
I
D
E
S
L
-
S
A
E
N
V
D
Q
V
A
D
C
D
G
V
-------
L
L
K
P
L
G
N
L
D
D
-
E
I
V
Y
K
K
L
A
D
Y
---
G
I
K
S
I
G
L
R
I
V
G
T
N
T
I
D
F
D
L
A
K
K
Y
H
L
T
V
T
N
V
P
V
Y
S
P
R
A
I
A
E
M
A
V
T
Q
A
M
Y
L
N
R
K
I
G
E
F
K
A
N
M
-
D
K
G
D
F
T
N
P
D
S
L
I
S
N
E
I
Y
N
K
T
I
G
L
I
G
V
G
H
I
G
S
A
V
A
Q
I
F
S
A
M
G
A
K
V
L
A
Y
D
V
I
Y
N
-
P
E
V
-
E
-
P
Y
---
L
T
Y
A
D
---
F
D
T
V
L
K
E
A
D
I
I
S
L
H
T
P
--
L
L
K
S
T
E
N
M
I
G
K
K
Q
F
A
E
M
K
N
D
A
I
L
I
N
A
A
R
G
E
L
V
D
T
A
A
L
I
E
A
L
E
K
H
E
I
A
A
A
G
L
D
T
L
A
H
E
S
S
Y
F
F
K
K
V
D
D
A
Q
I
P
--
A
D
Y
K
K
L
A
A
-
M
P
N
V
I
V
T
P
H
S
A
Y
F
T
K
T
S
V
R
N
M
I
E
I
S
L
R
D
T
I
A
L
A
N
G
E
R
A
H
F
V
V
S
23
PsiBlast_CBE
89.76
35%
-111
- C1 -
4XKJ
1
?
B:
[1-329]
M
K
I
I
M
F
S
V
R
D
D
E
E
A
A
I
R
E
W
E
K
-
K
T
-
G
V
Q
V
D
I
N
R
L
E
L
-
D
A
E
T
A
Q
L
T
K
G
Y
D
G
I
-------
V
I
Q
Q
R
S
H
I
S
N
P
A
V
-
Y
E
T
L
Q
K
N
---
G
L
R
Q
L
T
S
R
T
A
G
Y
D
M
I
D
L
E
Q
A
S
E
R
G
L
V
V
T
N
V
P
A
Y
S
P
N
S
V
A
E
L
A
L
T
Q
T
M
R
L
I
R
N
L
P
L
F
D
A
R
G
-
A
E
Q
D
F
R
W
A
-
G
L
M
A
R
E
I
R
S
L
T
V
G
I
I
G
A
G
R
I
G
G
T
V
A
R
L
F
K
A
L
G
A
T
V
I
A
N
D
I
V
E
R
-
V
E
L
-
K
-
D
I
---
V
T
Y
V
---
S
K
E
E
L
L
Q
A
A
D
V
V
T
L
H
V
P
--
L
M
D
S
T
T
Q
L
I
D
A
D
A
L
A
L
M
K
N
D
A
V
L
I
N
A
S
R
G
P
V
V
D
T
D
A
L
I
A
A
L
Q
N
K
Q
I
A
G
A
A
L
D
T
L
N
G
E
E
H
F
F
N
Q
D
L
C
G
K
E
L
P
S
-
E
Q
L
K
V
L
R
T
-
L
P
N
V
L
I
T
P
H
I
G
F
Y
T
N
K
A
V
Q
N
M
V
E
I
S
L
N
D
V
L
A
I
L
K
T
G
T
S
E
H
Q
L
N
1
PsiBlast_PDB
89.61
35%
-111
- C1 -
2YQ4
-
?
A:
[3-331]
-
K
I
A
M
Y
N
V
S
P
I
E
V
P
Y
I
E
D
W
A
K
-
K
N
-
D
V
E
I
K
T
T
D
Q
A
L
-
T
S
A
T
V
D
L
A
E
G
C
S
S
V
-------
S
L
K
P
L
G
P
V
D
E
E
V
V
-
Y
Q
K
L
S
E
Y
---
G
V
K
C
I
G
L
R
I
V
G
F
N
T
I
N
F
D
W
T
K
K
--
L
L
V
T
N
V
P
V
Y
S
P
R
A
I
A
E
M
T
V
T
Q
A
M
Y
L
L
R
K
I
G
E
F
R
Y
R
M
D
H
D
H
D
F
T
W
P
S
N
L
I
S
N
E
I
Y
N
L
T
V
G
L
I
G
V
G
H
I
G
S
A
V
A
E
I
F
S
A
M
G
A
K
V
I
A
Y
D
V
A
Y
N
-
P
E
F
-
E
-
P
F
---
L
T
Y
T
D
---
F
D
T
V
L
K
E
A
D
I
V
S
L
H
T
P
LF
P
S
T
E
N
--
M
I
G
E
K
Q
L
K
E
M
K
K
S
A
Y
L
I
N
C
A
R
G
E
L
V
D
T
G
A
L
I
K
A
L
Q
D
G
E
I
A
G
A
G
L
D
T
L
A
G
E
S
S
Y
F
G
H
T
G
L
T
D
S
E
I
P
-
E
D
Y
K
T
L
A
K
-
M
P
N
V
V
I
T
P
H
S
A
F
Y
T
E
T
S
I
R
N
M
V
Q
I
C
L
T
D
Q
L
T
I
A
K
G
G
R
P
R
S
I
V
-
16
PsiBlast_PDB
87.93
32%
-111
- C1 -
3WWY
8
?
A:
[28-346]
-
K
I
I
F
F
D
I
K
D
Y
D
K
E
F
F
K
K
Y
G
A
-
D
Y
-
N
F
E
M
T
F
L
K
V
R
L
-
T
E
E
T
A
N
L
T
K
G
Y
D
V
V
-------
C
G
F
A
N
D
N
I
N
K
-
E
T
-
I
D
I
M
A
E
N
---
G
I
K
L
L
A
M
R
C
A
G
F
N
N
V
S
L
K
D
V
N
E
R
F
K
V
V
R
-
V
P
A
Y
S
P
H
A
I
A
E
Y
T
V
G
L
I
L
A
V
N
R
K
I
N
K
A
Y
V
R
T
-
R
E
G
N
F
S
I
N
-
G
L
M
G
I
D
L
Y
E
K
T
A
G
I
I
G
T
G
K
I
G
Q
I
L
I
K
I
L
R
G
F
D
M
K
V
I
A
Y
D
L
F
P
N
Q
K
V
A
-
D
-
E
L
G--
F
E
Y
V
---
S
L
D
E
L
Y
A
N
S
D
I
I
S
L
N
C
P
--
L
T
K
D
T
K
Y
M
I
N
R
R
S
M
L
K
M
K
D
G
V
I
L
V
N
T
G
R
G
M
L
I
D
S
A
D
L
V
E
A
L
K
D
K
K
I
G
A
V
A
L
D
V
Y
E
E
E
E
N
Y
F
F
E
D
K
S
T
Q
V
I
E
D
-
D
I
L
G
R
L
L
S
-
F
Y
N
V
L
I
T
S
H
Q
A
Y
F
T
K
E
A
V
G
A
I
T
V
T
T
L
N
N
I
K
D
F
V
E
G
R
P
L
V
N
E
V
P
21
PsiBlast_CBE
87.63
35%
-111
- C1 -
2YQ5
1
?
C:
[3-332]
-
K
I
A
M
Y
N
V
S
P
I
E
V
P
Y
I
E
D
W
A
K
-
K
N
-
D
V
E
I
K
T
T
D
Q
A
L
-
T
S
A
T
V
D
L
A
E
G
C
S
S
V
-------
S
L
K
P
L
G
P
V
D
E
E
V
V
-
Y
Q
K
L
S
E
Y
---
G
V
K
C
I
G
L
R
I
V
G
F
N
T
I
N
F
D
W
T
K
K
Y
N
L
L
V
T
N
V
P
V
Y
S
P
R
A
I
A
E
M
T
V
T
Q
A
M
Y
L
L
R
K
I
G
E
F
R
Y
R
M
D
H
D
H
D
F
T
W
P
S
N
L
I
S
N
E
I
Y
N
L
T
V
G
L
I
G
V
G
H
I
G
S
A
V
A
E
I
F
S
A
M
G
A
K
V
I
A
Y
D
V
A
Y
N
-
P
E
F
-
E
-
P
F
---
L
T
Y
T
D
---
F
D
T
V
L
K
E
A
D
I
V
S
L
H
T
P
L
F
P
S
T
E
N
--
M
I
G
E
K
Q
L
K
E
M
K
K
S
A
Y
L
I
N
C
A
R
G
E
L
V
D
T
G
A
L
I
K
A
L
Q
D
G
E
I
A
G
A
G
L
D
T
L
A
G
E
S
S
Y
F
G
H
T
G
L
T
D
S
E
I
P
-
E
D
Y
K
T
L
A
K
-
M
P
N
V
V
I
T
P
H
S
A
F
Y
T
E
T
S
I
R
N
M
V
Q
I
C
L
T
D
Q
L
T
I
A
K
G
G
R
P
R
S
I
V
N
27
PsiBlast_CBE
87.28
32%
-107
- C1 -
1J4A
2
LDHD_LACDA
D:
[3-330]
-
K
I
F
A
Y
A
I
R
E
D
E
K
P
F
L
K
E
W
E
D
A
H
K
-
D
V
E
V
E
Y
T
D
K
L
L
-
T
P
E
T
V
A
L
A
K
G
A
D
G
V
-------
V
V
Y
Q
Q
L
D
Y
I
A
-
E
T
-
L
Q
A
L
A
D
N
---
G
I
T
K
M
S
L
R
N
V
G
V
D
N
I
D
M
A
K
A
K
E
L
G
F
Q
I
T
N
V
P
V
Y
S
P
N
A
I
A
E
H
A
A
I
Q
A
A
R
I
L
R
Q
D
K
A
M
D
E
K
V
-
A
R
H
D
L
R
W
A
-
P
T
I
G
R
E
V
R
D
Q
V
V
G
V
V
G
T
G
H
I
G
Q
V
F
M
Q
I
M
E
G
F
G
A
K
V
I
T
Y
D
I
F
R
N
-
P
E
L
-
E
-
K
K
---
G
Y
Y
V
D
--
S
L
D
D
L
Y
K
Q
A
D
V
I
S
L
H
V
P
--
D
V
P
A
N
V
H
M
I
N
D
E
S
I
A
K
M
K
Q
D
V
V
I
V
N
V
S
R
G
P
L
V
D
T
D
A
V
I
R
G
L
D
S
G
K
I
F
G
Y
A
M
D
V
Y
E
G
E
V
G
I
F
N
E
D
W
E
G
K
E
F
P
D
-
A
R
L
A
D
L
I
A
-
R
P
N
V
L
V
T
P
K
T
A
F
Y
T
T
H
A
V
R
N
M
V
V
K
A
F
D
N
N
L
E
L
V
E
G
K
E
A
E
T
P
V
K
4
PsiBlast_PDB
87.28
35%
-108
- C1 -
4XKJ
1
?
A:
[1-329]
M
K
I
I
M
F
S
V
R
D
D
E
E
A
A
I
R
E
W
E
K
-
K
T
-
G
V
Q
V
D
I
N
R
L
E
L
-
D
A
E
T
A
Q
L
T
K
G
Y
D
G
I
-------
V
I
Q
Q
R
S
H
I
S
N
P
A
V
-
Y
E
T
L
Q
K
N
---
G
L
R
Q
L
T
S
R
T
A
G
Y
D
M
I
D
L
E
Q
A
S
E
R
G
L
V
V
T
N
V
P
A
Y
S
P
N
S
V
A
E
L
A
L
T
Q
T
M
R
L
I
R
N
L
P
L
F
D
A
R
G
-
A
E
Q
D
F
R
W
A
-
G
L
M
A
R
E
I
R
S
L
T
V
G
I
I
G
A
G
R
I
G
G
T
V
A
R
L
F
K
A
L
G
A
T
V
I
A
N
D
I
V
E
R
-
V
E
L
-
K
-
D
I
---
V
T
Y
V
---
S
K
E
E
L
L
Q
A
A
D
V
V
T
L
H
V
P
--
L
M
D
S
T
T
Q
L
I
D
A
D
A
L
A
L
M
K
N
D
A
V
L
I
N
A
S
R
G
P
V
V
D
T
D
A
L
I
A
A
L
Q
N
K
Q
I
A
G
A
A
L
D
T
L
N
G
E
E
H
F
F
N
Q
D
L
C
G
K
E
L
P
S
-
E
Q
L
K
V
L
R
T
-
L
P
N
V
L
I
T
P
H
I
G
F
Y
T
N
K
A
V
Q
N
M
V
E
I
S
L
N
D
V
L
A
I
L
K
T
G
T
S
E
H
Q
L
N
11
PsiBlast_PDB
87.20
33%
-109
- C1 -
4CUJ
-
?
A:
[1-312]
M
K
L
A
V
Y
S
T
K
Q
Y
D
K
K
Y
L
Q
Q
V
N
E
-
A
F
-
G
F
E
L
E
F
F
D
F
L
L
-
T
E
K
T
A
K
T
A
N
G
C
E
A
V
-------
C
---
I
F
V
N
D
D
-
G
S
-
R
P
V
L
E
E
L
K
K
H
G
V
K
Y
I
A
L
R
C
A
G
F
N
N
V
D
L
D
A
A
K
E
L
G
L
Q
V
V
R
V
P
A
Y
S
P
E
A
V
A
E
H
A
I
G
M
M
M
T
L
N
R
R
I
H
R
A
Y
Q
R
T
-
R
D
A
N
F
S
L
E
-
G
L
T
G
F
T
M
H
G
K
T
A
G
V
I
G
T
G
K
I
G
V
A
A
L
R
I
L
K
G
F
G
M
R
L
L
A
F
D
P
Y
P
S
-
T
A
A
L
D
-
L
G
---
V
E
Y
V
D
---
L
Q
T
L
F
A
E
S
D
V
I
S
L
H
C
P
--
L
T
P
E
N
Y
H
L
L
N
H
A
A
F
D
Q
M
K
N
G
V
M
I
I
N
T
S
R
G
A
L
I
D
S
Q
A
A
I
E
A
L
K
N
Q
K
I
G
S
L
G
M
D
V
Y
E
N
E
R
D
L
F
F
E
D
K
S
V
D
V
I
Q
D
-
D
V
F
R
R
L
S
A
-
C
H
N
V
L
F
T
G
H
Q
A
F
L
T
A
E
A
L
I
S
I
S
E
T
T
L
Q
N
L
S
Q
L
E
K
G
E
A
C
P
N
A
L
F
2
PsiBlast_PDB
87.17
35%
-111
- C1 -
2YQ5
1
?
A:
[3-331]
-
K
I
A
M
Y
N
V
S
P
I
E
V
P
Y
I
E
D
W
A
K
-
K
N
-
D
V
E
I
K
T
T
D
Q
A
L
-
T
S
A
T
V
D
L
A
E
G
C
S
S
V
-------
S
L
K
P
L
G
P
V
D
E
E
V
V
-
Y
Q
K
L
S
E
Y
---
G
V
K
C
I
G
L
R
I
V
G
F
N
T
I
N
F
D
W
T
K
K
--
L
L
V
T
N
V
P
V
Y
S
P
R
A
I
A
E
M
T
V
T
Q
A
M
Y
L
L
R
K
I
G
E
F
R
Y
R
M
D
H
D
H
D
F
T
W
P
S
N
L
I
S
N
E
I
Y
N
L
T
V
G
L
I
G
V
G
H
I
G
S
A
V
A
E
I
F
S
A
M
G
A
K
V
I
A
Y
D
V
A
Y
N
-
P
E
F
-
E
-
P
F
---
L
T
Y
T
D
---
F
D
T
V
L
K
E
A
D
I
V
S
L
H
T
P
LF
P
S
T
E
N
--
M
I
G
E
K
Q
L
K
E
M
K
K
S
A
Y
L
I
N
C
A
R
G
E
L
V
D
T
G
A
L
I
K
A
L
Q
D
G
E
I
A
G
A
G
L
D
T
L
A
G
E
S
S
Y
F
G
H
T
G
L
T
D
S
E
I
P
-
E
D
Y
K
T
L
A
K
-
M
P
N
V
V
I
T
P
H
S
A
F
Y
T
E
T
S
I
R
N
M
V
Q
I
C
L
T
D
Q
L
T
I
A
K
G
G
R
P
R
S
I
V
-
7
PsiBlast_PDB
86.95
33%
-108
- C1 -
1J49
1
LDHD_LACDA
A:
[3-330]
-
K
I
F
A
Y
A
I
R
E
D
E
K
P
F
L
K
E
W
E
D
A
H
K
-
D
V
E
V
E
Y
T
D
K
L
L
-
T
P
E
T
V
A
L
A
K
G
A
D
G
V
-------
V
V
Y
Q
Q
L
D
Y
I
A
-
E
T
-
L
Q
A
L
A
D
N
---
G
I
T
K
M
S
L
R
N
V
G
V
D
N
I
D
M
A
K
A
K
E
L
G
F
Q
I
T
N
V
P
V
Y
S
P
N
A
I
A
E
H
A
A
I
Q
A
A
R
I
L
R
Q
D
K
A
M
D
E
K
V
-
A
R
H
D
L
R
W
A
-
P
T
I
G
R
E
V
R
D
Q
V
V
G
V
V
G
T
G
H
I
G
Q
V
F
M
Q
I
M
E
G
F
G
A
K
V
I
T
Y
D
I
F
R
N
-
P
E
L
-
E
-
K
K
---
G
Y
Y
V
D
--
S
L
D
D
L
Y
K
Q
A
D
V
I
S
L
H
V
P
--
D
V
P
A
N
V
H
M
I
N
D
E
S
I
A
K
M
K
Q
D
V
V
I
V
N
V
S
R
G
P
L
V
D
T
D
A
V
I
R
G
L
D
S
G
K
I
F
G
Y
A
M
D
V
Y
E
G
E
V
G
I
F
N
E
D
W
E
G
K
E
F
P
D
-
A
R
L
A
D
L
I
A
-
R
P
N
V
L
V
T
P
H
T
A
F
Y
T
T
H
A
V
R
N
M
V
V
K
A
F
D
N
N
L
E
L
V
E
G
K
E
A
E
T
P
V
K
31
PsiBlast_CBE
86.31
32%
-108
- C1 -
3WWY
6
?
B:
[28-346]
-
K
I
I
F
F
D
I
K
D
Y
D
K
E
F
F
K
K
Y
G
A
-
D
Y
-
N
F
E
M
T
F
L
K
V
R
L
-
T
E
E
T
A
N
L
T
K
G
Y
D
V
V
-------
C
G
F
A
N
D
N
I
N
K
-
E
T
-
I
D
I
M
A
E
N
---
G
I
K
L
L
A
M
R
C
A
G
--
N
V
S
L
K
D
V
N
E
R
F
K
V
V
R
-
V
P
A
Y
S
P
H
A
I
A
E
Y
T
V
G
L
I
L
A
V
N
R
K
I
N
K
A
Y
V
R
T
-
R
E
G
N
F
S
I
N
-
G
L
M
G
I
D
L
Y
E
K
T
A
G
I
I
G
T
G
K
I
G
Q
I
L
I
K
I
L
R
G
F
D
M
K
V
I
A
Y
D
L
F
P
N
Q
K
V
A
-
D
-
E
L
G--
F
E
Y
V
---
S
L
D
E
L
Y
A
N
S
D
I
I
S
L
N
C
P
--
L
T
K
D
T
K
Y
M
I
N
R
R
S
M
L
K
M
K
D
G
V
I
L
V
N
T
G
R
G
M
L
I
D
S
A
D
L
V
E
A
L
K
D
K
K
I
G
A
V
A
L
D
V
Y
E
E
E
E
N
Y
F
F
E
D
K
S
T
Q
V
I
E
D
-
D
I
L
G
R
L
L
S
-
F
Y
N
V
L
I
T
S
H
Q
A
Y
F
T
K
E
A
V
G
A
I
T
V
T
T
L
N
N
I
K
D
F
V
E
G
R
P
L
V
N
E
V
P
14
PsiBlast_PDB
86.09
32%
-113
- C1 -
3WX0
-
?
A:
[18-328]
-
K
L
A
V
Y
S
T
K
Q
Y
D
K
K
Y
L
Q
Q
V
N
E
-
S
F
-
G
F
E
L
E
F
F
D
F
L
L
-
T
E
K
T
A
K
T
A
N
G
C
E
A
V
-------
C
---
I
F
V
N
D
D
-
G
S
-
R
P
V
L
E
E
L
K
K
H
G
V
K
Y
I
A
L
R
C
A
G
F
N
N
V
D
L
D
A
A
K
E
L
G
L
K
V
V
R
V
P
A
Y
D
P
E
A
V
A
E
H
A
I
G
M
M
M
T
L
N
R
R
I
H
R
A
Y
Q
R
T
-
R
D
A
N
F
S
L
E
-
G
L
T
G
F
T
M
Y
G
K
T
A
G
V
I
G
T
G
K
I
G
V
A
M
L
R
I
L
K
G
F
G
M
R
L
L
A
F
D
P
Y
---
P
S
A
-
A
-
A
L
E
L
G
V
E
Y
V
D
---
L
P
T
L
F
S
E
S
D
V
I
S
L
H
C
P
--
L
T
P
E
N
Y
H
L
L
N
E
A
A
F
D
Q
M
K
N
G
V
M
I
V
N
T
S
R
G
A
L
I
D
S
Q
A
A
I
E
A
L
K
N
Q
K
I
G
S
L
G
M
D
V
Y
E
------------------
D
V
F
R
R
L
S
A
-
C
H
N
V
L
F
T
G
H
Q
A
F
L
T
A
E
A
L
T
S
I
S
Q
T
T
L
Q
N
L
S
N
L
E
K
G
--------
26
PsiBlast_CBE
86.00
32%
-115
- C1 -
2DLD
2
LDHD_LACHE
B:
[3-321]
-
K
V
F
A
Y
A
I
R
K
D
E
E
P
F
L
N
E
W
K
E
A
H
K
-
D
I
D
V
D
Y
T
D
K
L
L
-
T
P
E
T
A
K
L
A
K
G
A
D
G
V
-------
V
V
Y
Q
Q
L
D
Y
T
A
-
D
T
-
L
Q
A
L
A
D
A
---
G
V
T
K
M
S
L
R
N
V
G
V
D
N
I
D
M
D
K
A
K
E
L
G
F
Q
I
T
N
V
P
V
Y
S
P
N
A
I
A
E
H
A
A
I
Q
A
A
R
V
L
R
Q
D
K
R
M
D
E
K
M
-
A
K
R
D
L
R
W
A
-
P
T
I
G
R
E
V
R
D
Q
V
V
G
V
V
G
T
G
H
I
G
Q
V
F
M
R
I
M
E
G
F
G
A
K
V
I
A
Y
D
I
F
K
N
-
P
E
L
-
E
-
K
K
---
G
Y
Y
V
D
--
S
L
D
D
L
Y
K
Q
A
D
V
I
S
L
H
V
P
--
D
V
P
A
N
V
H
M
I
N
D
K
S
I
A
E
M
K
D
G
V
V
I
V
N
C
S
R
G
R
L
V
D
T
D
A
V
I
R
G
L
D
S
G
K
I
F
G
F
V
M
D
T
Y
E
D
E
V
G
V
F
N
K
D
W
E
G
K
E
F
P
D
-
K
R
L
A
D
L
I
D
-
R
P
N
V
L
V
T
P
H
T
A
F
Y
T
T
H
A
V
R
N
M
V
V
K
A
F
N
N
N
L
K
L
I
N
G
E
K
P
D
S
P
V
A
75
HHSearch
85.77
33%
-106
- C1 -
1J4A
4
LDHD_LACDA
A:
[2-331]
T
K
I
F
A
Y
A
I
R
E
D
E
K
P
F
L
K
E
W
E
D
-
A
H
K
D
V
E
V
E
Y
T
D
K
L
L
-
T
P
E
T
V
A
L
A
K
G
A
D
G
V
-------
V
V
Y
Q
Q
L
D
Y
I
A
-
E
T
-
L
Q
A
L
A
D
N
---
G
I
T
K
M
S
L
R
N
V
G
V
D
N
I
D
M
A
K
A
K
E
L
G
F
Q
I
T
N
V
P
V
Y
S
P
N
A
I
A
E
H
A
A
I
Q
A
A
R
I
L
R
Q
D
K
A
M
D
E
K
V
-
A
R
H
D
L
R
W
A
-
P
T
I
G
R
E
V
R
D
Q
V
V
G
V
V
G
T
G
H
I
G
Q
V
F
M
Q
I
M
E
G
F
G
A
K
V
I
T
Y
D
I
F
R
N
-
P
E
L
-
E
-
K
K
---
G
Y
Y
V
D
--
S
L
D
D
L
Y
K
Q
A
D
V
I
S
L
H
V
P
--
D
V
P
A
N
V
H
M
I
N
D
E
S
I
A
K
M
K
Q
D
V
V
I
V
N
V
S
R
G
P
L
V
D
T
D
A
V
I
R
G
L
D
S
G
K
I
F
G
Y
A
M
D
V
Y
E
G
E
V
G
I
F
N
E
D
W
E
G
K
E
F
P
D
-
A
R
L
A
D
L
I
A
-
R
P
N
V
L
V
T
P
K
T
A
F
Y
T
T
H
A
V
R
N
M
V
V
K
A
F
D
N
N
L
E
L
V
E
G
K
E
A
E
T
P
V
K
3
PsiBlast_PDB
85.60
35%
-103
- C1 -
1DXY
4
DHD2_LACPA
A:
[1-328]
M
K
I
I
A
Y
G
A
R
V
D
E
I
Q
Y
F
K
Q
W
A
K
-
D
T
-
G
N
T
L
E
Y
H
T
E
F
L
-
D
E
N
T
V
E
W
A
K
G
F
D
G
I
-------
N
S
L
Q
T
T
P
Y
A
A
-
G
V
-
F
E
K
M
H
A
Y
---
G
I
K
F
L
T
I
R
N
V
G
T
D
N
I
D
M
T
A
M
K
Q
Y
G
I
R
L
S
N
V
P
A
Y
S
P
A
A
I
A
E
F
A
L
T
D
T
L
Y
L
L
R
N
M
G
K
V
Q
A
Q
L
-
Q
A
G
D
Y
E
K
A
G
T
F
I
G
K
E
L
G
Q
Q
T
V
G
V
M
G
T
G
H
I
G
Q
V
A
I
K
L
F
K
G
F
G
A
K
V
I
A
Y
D
P
Y
P
M
-
K
G
D
-
H
-
P
D
---
F
D
Y
V
---
S
L
E
D
L
F
K
Q
S
D
V
I
D
L
H
V
P
--
G
I
E
Q
N
T
H
I
I
N
E
A
A
F
N
L
M
K
P
G
A
I
V
I
N
T
A
R
P
N
L
I
D
T
Q
A
M
L
S
N
L
K
S
G
K
L
A
G
V
G
I
D
T
Y
E
Y
E
T
E
D
L
L
N
L
A
K
H
G
S
F
K
D
-
P
L
W
D
E
L
L
G
-
M
P
N
V
V
L
S
P
H
I
A
Y
Y
T
E
T
A
V
H
N
M
V
Y
F
S
L
Q
H
L
V
D
F
L
T
K
G
E
T
S
T
E
V
T
9
PsiBlast_PDB
85.43
32%
-107
- C1 -
1J4A
4
LDHD_LACDA
A:
[3-330]
-
K
I
F
A
Y
A
I
R
E
D
E
K
P
F
L
K
E
W
E
D
A
H
K
-
D
V
E
V
E
Y
T
D
K
L
L
-
T
P
E
T
V
A
L
A
K
G
A
D
G
V
-------
V
V
Y
Q
Q
L
D
Y
I
A
-
E
T
-
L
Q
A
L
A
D
N
---
G
I
T
K
M
S
L
R
N
V
G
V
D
N
I
D
M
A
K
A
K
E
L
G
F
Q
I
T
N
V
P
V
Y
S
P
N
A
I
A
E
H
A
A
I
Q
A
A
R
I
L
R
Q
D
K
A
M
D
E
K
V
-
A
R
H
D
L
R
W
A
-
P
T
I
G
R
E
V
R
D
Q
V
V
G
V
V
G
T
G
H
I
G
Q
V
F
M
Q
I
M
E
G
F
G
A
K
V
I
T
Y
D
I
F
R
N
-
P
E
L
-
E
-
K
K
---
G
Y
Y
V
D
--
S
L
D
D
L
Y
K
Q
A
D
V
I
S
L
H
V
P
--
D
V
P
A
N
V
H
M
I
N
D
E
S
I
A
K
M
K
Q
D
V
V
I
V
N
V
S
R
G
P
L
V
D
T
D
A
V
I
R
G
L
D
S
G
K
I
F
G
Y
A
M
D
V
Y
E
G
E
V
G
I
F
N
E
D
W
E
G
K
E
F
P
D
-
A
R
L
A
D
L
I
A
-
R
P
N
V
L
V
T
P
K
T
A
F
Y
T
T
H
A
V
R
N
M
V
V
K
A
F
D
N
N
L
E
L
V
E
G
K
E
A
E
T
P
V
K
8
PsiBlast_PDB
85.12
32%
-115
- C1 -
2DLD
2
LDHD_LACHE
A:
[3-321]
-
K
V
F
A
Y
A
I
R
K
D
E
E
P
F
L
N
E
W
K
E
A
H
K
-
D
I
D
V
D
Y
T
D
K
L
L
-
T
P
E
T
A
K
L
A
K
G
A
D
G
V
-------
V
V
Y
Q
Q
L
D
Y
T
A
-
D
T
-
L
Q
A
L
A
D
A
---
G
V
T
K
M
S
L
R
N
V
G
V
D
N
I
D
M
D
K
A
K
E
L
G
F
Q
I
T
N
V
P
V
Y
S
P
N
A
I
A
E
H
A
A
I
Q
A
A
R
V
L
R
Q
D
K
R
M
D
E
K
M
-
A
K
R
D
L
R
W
A
-
P
T
I
G
R
E
V
R
D
Q
V
V
G
V
V
G
T
G
H
I
G
Q
V
F
M
R
I
M
E
G
F
G
A
K
V
I
A
Y
D
I
F
K
N
-
P
E
L
-
E
-
K
K
---
G
Y
Y
V
D
--
S
L
D
D
L
Y
K
Q
A
D
V
I
S
L
H
V
P
--
D
V
P
A
N
V
H
M
I
N
D
K
S
I
A
E
M
K
D
G
V
V
I
V
N
C
S
R
G
R
L
V
D
T
D
A
V
I
R
G
L
D
S
G
K
I
F
G
F
V
M
D
T
Y
E
D
E
V
G
V
F
N
K
D
W
E
G
K
E
F
P
D
-
K
R
L
A
D
L
I
D
-
R
P
N
V
L
V
T
P
H
T
A
F
Y
T
T
H
A
V
R
N
M
V
V
K
A
F
N
N
N
L
K
L
I
N
G
E
K
P
D
S
P
V
A
25
PsiBlast_CBE
83.18
33%
-103
* C1 *
1J49
2
LDHD_LACDA
B:
[3-330]
-
K
I
F
A
Y
A
I
R
E
D
E
K
P
F
L
K
E
W
E
D
A
H
K
-
D
V
E
V
E
Y
T
D
K
L
L
-
T
P
E
T
V
A
L
A
K
G
A
D
G
V
-------
V
V
Y
Q
Q
L
D
Y
I
A
-
E
T
-
L
Q
A
L
A
D
N
---
G
I
T
K
M
S
L
R
N
V
G
V
D
N
I
D
M
A
K
A
K
E
L
G
F
Q
I
T
N
V
P
V
Y
S
P
N
A
I
A
E
H
A
A
I
Q
A
A
R
I
L
R
Q
D
K
A
M
D
E
K
V
-
A
R
H
D
L
R
W
A
-
P
T
I
G
R
E
V
R
D
Q
V
V
G
V
V
G
T
G
H
I
G
Q
V
F
M
Q
I
M
E
G
F
G
A
K
V
I
T
Y
D
I
F
R
N
-
P
E
L
-
E
-
K
K
---
G
Y
Y
V
D
--
S
L
D
D
L
Y
K
Q
A
D
V
I
S
L
H
V
P
--
D
V
P
A
N
V
H
M
I
N
D
E
S
I
A
K
M
K
Q
D
V
V
I
V
N
V
S
R
G
P
L
V
D
T
D
A
V
I
R
G
L
D
S
G
K
I
F
G
Y
A
M
D
V
Y
E
G
E
V
G
I
F
N
E
D
W
E
G
K
E
F
P
D
-
A
R
L
A
D
L
I
A
-
R
P
N
V
L
V
T
P
H
T
A
F
Y
T
T
H
A
V
R
N
M
V
V
K
A
F
D
N
N
L
E
L
V
E
G
K
E
A
E
T
P
V
K
70
HHSearch
78.59
35%
-99
- C1 -
1DXY
4
DHD2_LACPA
A:
[1-329]
M
K
I
I
A
Y
G
A
R
V
D
E
I
Q
Y
F
K
Q
W
A
K
-
D
T
-
G
N
T
L
E
Y
H
T
E
F
L
-
D
E
N
T
V
E
W
A
K
G
F
D
G
I
-------
N
S
L
Q
T
T
P
Y
A
A
-
G
V
-
F
E
K
M
H
A
Y
---
G
I
K
F
L
T
I
R
N
V
G
T
D
N
I
D
M
T
A
M
K
Q
Y
G
I
R
L
S
N
V
P
A
Y
S
P
A
A
I
A
E
F
A
L
T
D
T
L
Y
L
L
R
N
M
G
K
V
Q
A
Q
L
-
Q
A
G
D
Y
E
K
A
G
T
F
I
G
K
E
L
G
Q
Q
T
V
G
V
M
G
T
G
H
I
G
Q
V
A
I
K
L
F
K
G
F
G
A
K
V
I
A
Y
D
P
Y
P
M
-
K
G
D
-
H
--
P
---
D
F
D
Y
V
--
S
L
E
D
L
F
K
Q
S
D
V
I
D
L
H
V
P
--
G
I
E
Q
N
T
H
I
I
N
E
A
A
F
N
L
M
K
P
G
A
I
V
I
N
T
A
R
P
N
L
I
D
T
Q
A
M
L
S
N
L
K
S
G
K
L
A
G
V
G
I
D
T
Y
E
Y
E
T
E
D
L
L
N
-
L
A
K
H
G
S
F
K
D
P
L
W
D
E
L
L
G
-
M
P
N
V
V
L
S
P
H
I
A
Y
Y
T
E
T
A
V
H
N
M
V
Y
F
S
L
Q
H
L
V
D
F
L
T
K
G
E
T
S
T
E
V
T
72
HHSearch
77.38
31%
-102
- C1 -
3WWY
8
?
A:
[27-355]
T
K
I
I
F
F
D
I
K
D
Y
D
K
E
F
F
K
K
Y
G
A
-
D
Y
-
N
F
E
M
T
F
L
K
V
R
L
-
T
E
E
T
A
N
L
T
K
G
Y
D
V
V
-------
C
G
F
A
N
D
N
I
N
K
-
E
T
-
I
D
I
M
A
E
N
---
G
I
K
L
L
A
M
R
C
A
G
F
N
N
V
S
L
K
D
V
N
E
R
-
F
K
V
V
R
V
P
A
Y
S
P
H
A
I
A
E
Y
T
V
G
L
I
L
A
V
N
R
K
I
N
K
A
Y
V
R
T
-
R
E
G
N
F
S
I
N
-
G
L
M
G
I
D
L
Y
E
K
T
A
G
I
I
G
T
G
K
I
G
Q
I
L
I
K
I
L
R
G
F
D
M
K
V
I
A
Y
D
L
F
P
N
-
Q
K
V
-
A
D
E
L
---
G
F
E
Y
V
--
S
L
D
E
L
Y
A
N
S
D
I
I
S
L
N
C
P
--
L
T
K
D
T
K
Y
M
I
N
R
R
S
M
L
K
M
K
D
G
V
I
L
V
N
T
G
R
G
M
L
I
D
S
A
D
L
V
E
A
L
K
D
K
K
I
G
A
V
A
L
D
V
Y
E
E
E
E
N
Y
F
F
E
D
K
S
T
Q
V
I
E
D
-
D
I
L
G
R
L
L
S
-
F
Y
N
V
L
I
T
S
H
Q
A
Y
F
T
K
E
A
V
G
A
I
T
V
T
T
L
N
N
I
K
D
F
V
E
G
R
P
L
V
N
E
V
P