@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 : Wbm0453: (2015-12-01 )
MPNIVTRFAPSPTGFLHIGGARTALFNWLYAKHHGGRFLLRIEDTDRKRSTQEAIDAIINGLKWLGVSYDGEIVYQSKRIERHIEVANLLVEKGKAYCCCCPEDKVAEKKAKAREERKIYKHKCTSVIPDAKPVVRFNVPDSQEIIVDDKIYGHIKVNSDQLDDMVILRSDNTPTYIFAVVVDDHDAGITDIIRGSDHLTNTFKQVLIYQALDFDIPRFAHVPLIHGRDGNKLSKRHGATSVCDYEKMGILPKAMRNYLLRLGWSHGNDEIISNEQAVKWFNLESIGRSPARLNFKKLEHLNNHYINNMSNEDILTLMLGESTLTNKKKNYLLQGLTELKKRANYLTELLDLAQFYIKDPPFDLSEEAEQVVKSNLDIIKLLASFLSNIGDKNWNKGFLSSQVKEFSKLHSAKISDIYHSLRAPITGVMDAPGIIDIMIILGKDECIRRLQAV
Atome Classification :
(26 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.......420.......430.......440--....-....450.
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MPN
I
V
TRFAPSPT
G
F
L
H
IGG
A
R
T
A
L
F
N
W
L
Y
A
KHHG
G
R
F
L
L
R
IEDTDRKR
S
T
Q
E
A
I
D
A
I
I
N
G
L
K
W
L
G
VSYD------
G
E
--------
I
--
V
-------
Y
-------
Q
S
K
R
I
E
R
H
I
E
V
A
N
L
L
V
EKG
K
A
Y
C
C
CCPE
D
K
V
----
A
E
K
K
A
K
-------------------
A
R
E
----
E
R
K
I
---
Y
K
H
-------
K
-------
C
---------
T
SVI--PD--------AK-------
P
-
V
-
V
R
F
NVPDS
Q
E
I
I
VDD
K
I
Y
G
H
I
K
-VNSD-Q-L-D
D
M
V
I
L
RS-----D-----NT
P
T
Y
I
F
A
V
V
VDDHDA
G
I
T
D
I
IRGS
D
H
L
T
N
T
F
K
Q
V
L
I
Y
QALDFDIPRFAHV
P
L
I
HGRDGNK
L
S
K
RHGATSVC
D
Y
E
KMGI
L
P
K
A
M
R
N
Y
L
L
R
LGWS--HG-N--D-EIISN--EQ
A
V
K
W
F
N
L
E
S
IGRSPARL
N
F
K
K
L
E
H
L
N
N
H
YINN-MSNE
D
I
---
L
T
L
---
M
L----------GESTLT
N
K
----
K
-----
K
-
N
Y
L
L
Q
G
L
T
E
L
K
K
R
A
N
Y
L
T
E
L
L
D
L
-
A
Q
F
-
Y
IKD---------P-PFD
L
S
E
-----
E
A
E
Q
V
V
K
---SN
L
D
I
I
K
-
L
L
A
S
F
L
S
N
IGDKNWN
K
G
F
L
S
S
Q
-
V
K
E
F
S
K
L
H
S
A
K
I
S
D
I
Y
H
S
L
RAPITGVMDAP
G
I
I
D
I
M
I
I
L---G
K
D
E
-
C
I
R
R
L
QAV
1
PsiBlast_PDB
90.70
35%
-104
- C3 -
2O5R
4
SYE1_THEMA
A:
[14-476]
---
V
R
V
R
F
A
P
S
P
T
G
F
L
H
V
G
G
A
R
T
A
L
F
N
F
L
F
A
R
K
E
K
G
K
F
I
L
R
I
E
D
T
D
L
E
R
S
E
R
E
Y
E
E
K
L
M
E
S
L
R
W
L
G
L
L
W
D
E-----
G
P
--------
D
--
V
GGDHGPY
R
-------
Q
S
E
R
V
E
I
Y
R
E
H
A
E
R
L
V
K
E
G
K
A
Y
Y
V
Y
A
Y
P
E
E
I
----
E
E
M
R
E
K
L
L
S
E
GKAPHYSQEMFEKFD
T
P
E
----
R
R
R
E
---
Y
E
E
-------
K
-------
G
---------
L
----------------
R
-------
P
-
A
-
V
F
F
K
M
P
-
R
K
D
Y
V
L
N
D
V
V
K
G
E
V
V
-
F
K
T
G
-
A
-
I
-
G
D
F
V
I
M
R
S
-----
N
-----
G
L
P
T
Y
N
F
A
C
V
V
D
D
M
L
M
E
I
T
H
V
I
R
G
D
D
H
L
S
N
T
L
R
Q
L
A
L
Y
E
A
F
E
K
A
P
P
V
F
A
H
V
S
T
I
L
G
P
D
G
K
K
L
S
K
R
H
G
A
T
S
V
E
A
F
R
D
M
G
Y
L
P
E
A
L
V
N
Y
L
A
L
L
G
W
S
--
H
P
E
G
--
K
-
E
L
L
T
L
--
E
E
L
I
S
S
F
S
L
D
R
L
S
P
N
P
A
I
F
D
P
Q
K
L
K
W
M
N
G
Y
Y
L
R
N
-
M
P
I
E
K
L
---
A
E
L
A
K
P
F
F
----------
E
K
A
G
I
K
I
I
----
D
-----
E
-
E
Y
F
K
K
V
L
E
I
T
K
E
R
V
E
V
L
S
E
F
P
E
E
-
S
R
F
-
F
F
E
D
---------
P
A
P
V
E
I
P
E
-----
E
M
K
E
V
F
S
---
Q
--------
L
K
E
E
L
Q
N
V
---
R
W
T
M
E
E
I
T
P
V
-
F
K
K
V
L
K
Q
H
G
V
K
P
K
E
F
Y
M
T
L
R
R
V
L
T
G
R
E
E
G
P
E
L
V
N
I
I
P
L
L
---
G
K
E
I
-
F
L
R
R
I
E
R
S
24
PsiBlast_CBE
90.61
33%
-100
- C3 -
2DXI
2
SYE_THET8
B:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
EAEERARR
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
AER
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
26
PsiBlast_CBE
90.60
33%
-98
- C3 -
2CV1
2
SYE_THET8
B:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
EAEERARR
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
AER
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
13
PsiBlast_PDB
90.56
33%
-96
- C3 -
2CV0
1
SYE_THET8
A:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
E
A
E
E
R
A
R
R
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
A
E
R
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
15
PsiBlast_PDB
90.32
33%
-97
- C3 -
2CV2
2
SYE_THET8
A:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
E
A
E
E
R
A
R
R
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
A
E
R
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
28
PsiBlast_CBE
90.23
33%
-97
- C3 -
1N78
1
SYE_THET8
B:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
EAEERARR
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
AER
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
6
PsiBlast_PDB
90.23
33%
-96
- C3 -
1G59
-
SYE_THET8
A:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
-------
A
APTGPYR
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
E
A
E
E
R
A
R
R
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
A
E
R
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
25
PsiBlast_CBE
90.03
33%
-101
- C3 -
2CV2
2
SYE_THET8
B:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
EAEERARR
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
AER
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
14
PsiBlast_PDB
90.03
33%
-97
- C3 -
2CV1
2
SYE_THET8
A:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
E
A
E
E
R
A
R
R
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
A
E
R
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
16
PsiBlast_PDB
89.92
33%
-97
- C3 -
2DXI
2
SYE_THET8
A:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
E
A
E
E
R
A
R
R
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
A
E
R
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
11
PsiBlast_PDB
89.84
33%
-97
- C3 -
1N78
1
SYE_THET8
A:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
E
A
E
E
R
A
R
R
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
A
E
R
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
29
PsiBlast_CBE
89.80
33%
-96
- C3 -
1N77
1
SYE_THET8
B:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
EAEERARR
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
AER
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
27
PsiBlast_CBE
89.79
33%
-98
- C3 -
2CV0
1
SYE_THET8
B:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
EAEERARR
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
AER
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
10
PsiBlast_PDB
89.55
33%
-95
- C3 -
1N77
1
SYE_THET8
A:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
E
A
E
E
R
A
R
R
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
A
E
R
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
9
PsiBlast_PDB
89.46
33%
-96
- C3 -
1N75
1
SYE_THET8
A:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
E
A
E
E
R
A
R
R
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
A
E
R
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
8
PsiBlast_PDB
89.23
33%
-96
- C3 -
1J09
2
SYE_THET8
A:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
E
A
E
E
R
A
R
R
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
A
E
R
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
12
PsiBlast_PDB
89.01
33%
-97
- C3 -
2CUZ
1
SYE_THET8
A:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
GGPHGPY
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
E
A
E
E
R
A
R
R
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
A
E
R
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
7
PsiBlast_PDB
88.89
33%
-95
- C3 -
1GLN
-
SYE_THET8
A:
[2-464]
---
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
E-----
G
P
--------
D
--
V
-------
A
APTGPYR
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
----
E
T
----
P
E
E
L
E
Q
-------------------
I
R
K
----
E
K
G
G
---
Y
D
G
-------
R
-------
A
---------
R
N
I
P
--
P
E
E
A
E
E
R
A
R
R
G
E
-------
P
H
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
--
G
R
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
A
E
R
V
K
P
---
F
L
----------
R
E
A
G
L
S
W
E
----
S
-----
E
-
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
L
F
T
E
D
---------
Y
-
P
--
V
S
E
-----
K
A
Q
R
K
L
E
---
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
--
A
Q
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
2
PsiBlast_PDB
88.74
37%
-87
- C3 -
2CFO
1
SYE_THEEB
A:
[1-470]
--
T
V
R
V
R
L
A
P
S
P
T
G
N
L
H
I
G
T
A
R
T
A
V
F
N
W
L
Y
A
R
H
R
G
G
K
F
I
L
R
I
E
D
T
D
R
E
R
S
R
P
E
Y
T
E
N
I
L
E
G
L
Q
W
L
G
L
T
W
D
------
E
G
--------
P
--
Y
-------
F
-------
Q
S
D
R
L
D
L
Y
R
Q
A
I
Q
T
L
L
D
K
G
L
A
Y
Y
C
Y
C
T
P
E
E
L
E
A
L
R
A
E
Q
K
A
K
-------------------
G
Q
A
----
P
R
Y
D
---
N
R
H
-------
R
-------
H
---------
L
T
P
E
--
E
Q
--------
A
A
F
E
A
A
G
R
T
P
-
V
-
I
R
F
K
I
E
D
D
R
Q
I
E
W
Q
D
L
V
R
G
R
V
S
-
W
Q
G
A
-
D
-
L
G
G
D
M
V
I
A
R
A
-----
A
PRGEI
G
Y
P
L
Y
N
L
V
V
V
V
D
D
I
A
M
G
I
T
D
V
I
R
G
E
D
H
I
G
N
T
P
K
Q
I
L
L
Y
E
A
L
G
A
T
P
P
N
F
A
H
T
P
L
I
L
N
S
T
G
Q
K
L
S
K
R
D
G
V
T
S
I
S
D
F
R
A
M
G
Y
L
A
P
A
L
A
N
Y
M
T
L
L
G
W
S
P
P
E
G
-
V
--
G
-
E
L
F
T
L
--
D
L
A
A
K
H
F
S
F
E
R
I
N
K
A
G
A
R
F
D
W
D
K
L
N
W
L
N
R
Q
Y
I
Q
Q
-
L
E
P
E
E
F
---
L
A
E
---
L
I
P
L
W
Q
G
A
----
G
Y
A
F
D
E
E
R
----
D
-----
R
-
P
W
L
F
D
L
A
Q
L
L
Q
P
G
L
N
T
L
R
E
A
I
D
Q
G
A
V
F
-
F
I
P
S
---------
V
-
T
F
D
-
S
E
-----
A
M
A
Q
L
G
Q
---
P
Q
S
A
T
I
---
L
A
Y
L
L
E
H
L
P
A
E
P
A
L
T
V
A
M
G
Q
Q
L
I
Q
Q
A
A
K
A
A
G
V
K
K
G
A
T
M
R
T
L
R
A
A
L
T
G
A
V
H
G
P
D
L
M
A
A
W
Q
I
L
H
Q
R
G
W
D
E
-
P
R
L
A
A
A
L
K
55
HHSearch
88.32
33%
-97
- C3 -
3AFH
1
SYE2_THEMA
A:
[25-481]
--
L
V
R
V
R
F
A
P
S
P
T
G
H
L
H
V
G
G
A
R
T
A
L
F
N
W
M
F
A
R
K
E
G
G
K
F
I
L
R
I
E
D
T
D
T
E
R
S
S
R
E
Y
E
Q
Q
I
L
E
S
L
R
W
C
G
L
D
W
D
------
E
G
PDIGGDFG
P
--
Y
-------
R
-------
Q
S
E
R
L
E
I
Y
R
E
Y
A
E
K
L
V
E
D
K
R
A
Y
Y
V
V
Y
D
K
E
D
P
----
S
K
E
L
F
T
-------------------
T
------
Y
E
Y
P
---
H
E
Y
-------
K
--------------------
E
--
K
G
--------
H
P
-------
V
-
T
-
I
K
F
K
V
L
P
-
G
K
T
S
F
E
D
L
L
K
G
Y
M
E
-
F
D
N
S
-
T
-
L
-
E
D
F
I
I
M
K
S
-----
N
-----
G
F
P
T
Y
N
F
A
V
V
V
D
D
H
L
M
R
I
S
H
V
F
R
G
E
D
H
L
S
N
T
P
K
Q
L
M
I
Y
E
A
F
G
W
E
A
P
V
F
M
H
I
P
L
I
L
G
S
D
R
T
P
L
S
K
R
H
G
A
T
S
V
E
H
F
R
R
E
G
I
L
S
R
A
L
M
N
Y
L
A
L
L
G
W
R
--
V
E
-
G
--
D
-
E
I
F
T
I
--
E
E
K
L
Q
S
F
D
P
K
D
I
S
N
K
G
V
I
F
D
Y
Q
K
L
E
W
V
N
G
K
H
M
R
R
-
I
D
L
E
D
L
---
K
R
E
---
F
I
----------
E
W
A
K
Y
A
G
K
E
I
P
-
S
V----
D
E
R
Y
F
S
E
T
L
R
I
C
R
E
K
V
N
T
L
S
Q
L
Y
D
I
-
M
Y
P
-
F
M
N
D
-----------
D
Y
E
Y
E
K
-----
D
Y
V
E
K
F
L
KRE
E
A
E
R
V
L
E
-
E
A
K
K
A
F
K
D
L
--
N
S
W
N
M
E
E
I
E
K
T
-
L
R
D
L
S
E
K
G
L
A
S
K
K
V
V
F
Q
L
I
R
G
A
V
T
G
K
L
V
T
P
G
L
F
E
T
I
E
V
L
---
G
K
E
R
-
T
L
K
R
L
E
R
T
52
HHSearch
88.24
36%
-93
- C3 -
2CFO
1
SYE_THEEB
A:
[1-476]
--
T
V
R
V
R
L
A
P
S
P
T
G
N
L
H
I
G
T
A
R
T
A
V
F
N
W
L
Y
A
R
H
R
G
G
K
F
I
L
R
I
E
D
T
D
R
E
R
S
R
P
E
Y
T
E
N
I
L
E
G
L
Q
W
L
G
L
T
W
D
------
E
G
--------
P
--
Y
-------
F
-------
Q
S
D
R
L
D
L
Y
R
Q
A
I
Q
T
L
L
D
K
G
L
A
Y
Y
C
Y
C
T
P
E
E
L
----
E
A
L
R
A
E
-------------------
Q
K
A
K
GQA
P
R
Y
D
---
N
R
H
-------
R
HLT
P
E
E
Q
A
---------
A
F
E
A
--
A
G
--------
R
T
-------
P
-
V
-
I
R
F
K
I
E
D
D
R
Q
I
E
W
Q
D
L
V
R
G
R
V
S
-
W
Q
G
A
-
D
L
G
-
G
D
M
V
I
A
R
A
APRGE
I
-----
G
Y
P
L
Y
N
L
V
V
V
V
D
D
I
A
M
G
I
T
D
V
I
R
G
E
D
H
I
G
N
T
P
K
Q
I
L
L
Y
E
A
L
G
A
T
P
P
N
F
A
H
T
P
L
I
L
N
S
T
G
Q
K
L
S
K
R
D
G
V
T
S
I
S
D
F
R
A
M
G
Y
L
A
P
A
L
A
N
Y
M
T
L
L
G
W
S
--
P
P
-
E
GV
G
-
E
L
F
T
L
--
D
L
A
A
K
H
F
S
F
E
R
I
N
K
A
G
A
R
F
D
W
D
K
L
N
W
L
N
R
Q
Y
I
Q
Q
-
L
E
P
E
E
F
---
L
A
E
---
L
I
----------
P
L
W
Q
G
A
G
Y
A
F
D
E
E
R----
D
R
P
W
L
F
D
L
A
Q
L
L
Q
P
G
L
N
T
L
R
E
A
I
D
Q
-
G
A
V
-
F
F
I
P
-----------
S
V
T
F
D
S
-----
E
A
M
A
Q
L
G
QP-
Q
S
A
T
I
L
A
-
Y
L
L
E
H
L
P
A
E
--
P
A
L
T
V
A
M
G
Q
Q
L
-
I
Q
Q
A
A
K
A
A
G
V
K
K
G
A
T
M
R
T
L
R
A
A
L
T
G
A
V
H
G
P
D
L
M
A
A
W
Q
I
L
---
H
Q
R
G
W
D
E
P
R
L
A
A
A
5
PsiBlast_PDB
88.03
33%
-99
- C3 -
3AFH
1
SYE2_THEMA
A:
[26-479]
---
V
R
V
R
F
A
P
S
P
T
G
H
L
H
V
G
G
A
R
T
A
L
F
N
W
M
F
A
R
K
E
G
G
K
F
I
L
R
I
E
D
T
D
T
E
R
S
S
R
E
Y
E
Q
Q
I
L
E
S
L
R
W
C
G
L
D
W
D
EGPDIG
G
D
--------
F
GP
Y
-------
R
-------
Q
S
E
R
L
E
I
Y
R
E
Y
A
E
K
L
V
E
D
K
R
A
Y
Y
V
V
Y
D
K
E
D
P
----
S
K
E
L
F
T
-------------------
T
Y
E
----
Y
P
H
E
---
Y
K
E
-------
K
-------
G
---------
H
P
V
------------------------
T
-
I
K
F
K
V
L
P
G
K
-
T
S
F
E
D
L
L
K
G
Y
M
E
-
F
D
N
S
-
T
-
L
-
E
D
F
I
I
M
K
S
-----
N
-----
G
F
P
T
Y
N
F
A
V
V
V
D
D
H
L
M
R
I
S
H
V
F
R
G
E
D
H
L
S
N
T
P
K
Q
L
M
I
Y
E
A
F
G
W
E
A
P
V
F
M
H
I
P
L
I
L
G
S
D
R
T
P
L
S
K
R
H
G
A
T
S
V
E
H
F
R
R
E
G
I
L
S
R
A
L
M
N
Y
L
A
L
L
G
W
R
--
V
E
-
G
--
D
-
E
I
F
T
I
--
E
E
K
L
Q
S
F
D
P
K
D
I
S
N
K
G
V
I
F
D
Y
Q
K
L
E
W
V
N
G
K
H
M
R
R
-
I
D
L
E
D
L
---
K
R
E
---
F
I
----------
E
W
A
K
Y
A
G
K
----
E
I
P
SVD
E
-
R
Y
F
S
E
T
L
R
I
C
R
E
K
V
N
T
L
S
Q
L
Y
D
I
-
M
Y
P
-
F
M
N
D
D
Y
E
Y
E
K
D
Y
V
E
-
K
F
L
K
R
E
-----
E
A
E
R
V
L
E
---
E
A
K
K
A
F
K
-
D
L
N
S
---------
W
N
M
E
E
I
E
K
T
-
L
R
D
L
S
E
K
G
L
A
S
K
K
V
V
F
Q
L
I
R
G
A
V
T
G
K
L
V
T
P
G
L
F
E
T
I
E
V
L
---
G
K
E
R
-
T
L
K
R
L
E
R
T
53
HHSearch
87.93
33%
-94
* C3 *
1J09
2
SYE_THET8
A:
[1-466]
--
M
V
V
T
R
I
A
P
S
P
T
G
D
P
H
V
G
T
A
Y
I
A
L
F
N
Y
A
W
A
R
R
N
G
G
R
F
I
V
R
I
E
D
T
D
R
A
R
Y
V
P
G
A
E
E
R
I
L
A
A
L
K
W
L
G
L
S
Y
D
------
E
G
PDVGGPHG
P
--
Y
-------
R
-------
Q
S
E
R
L
P
L
Y
Q
K
Y
A
E
E
L
L
K
R
G
W
A
Y
R
A
F
E
T
P
E
E
L
----
E
Q
I
R
K
E
-------------------
K
------
G
G
Y
D
---
G
R
A
RNIP
P
E
E
A
-------
E
---------
E
R
A
R
--
R
G
--------
E
P
-------
H
-
V
-
I
R
L
K
V
P
R
P
G
T
T
E
V
K
D
E
L
R
G
V
V
V
-
Y
D
N
Q
-
E
-
I
-
P
D
V
V
L
L
K
S
-----
D
-----
G
Y
P
T
Y
H
L
A
N
V
V
D
D
H
L
M
G
V
T
D
V
I
R
A
E
E
W
L
V
S
T
P
I
H
V
L
L
Y
R
A
F
G
W
E
A
P
R
F
Y
H
M
P
L
L
R
N
P
D
K
T
K
I
S
K
R
K
S
H
T
S
L
D
W
Y
K
A
E
G
F
L
P
E
A
L
R
N
Y
L
C
L
M
G
F
S
--
M
P
-
D
G-
R
-
E
I
F
T
L
--
E
E
F
I
Q
A
F
T
W
E
R
V
S
L
G
G
P
V
F
D
L
E
K
L
R
W
M
N
G
K
Y
I
R
E
V
L
S
L
E
E
V
---
A
E
R
---
V
K
----------
P
F
L
R
E
A
G
L
----
S
WE---
S
E
A
Y
L
R
R
A
V
E
L
M
R
P
R
F
D
T
L
K
E
F
P
E
K
-
A
R
Y
-
L
F
T
E
-----------
D
Y
P
V
S
E
-----
K
A
-
Q
R
K
L
E
--
E
G
L
P
L
L
K
-
E
L
Y
P
R
L
R
A
Q
--
E
E
W
T
E
A
A
L
E
A
L
-
L
R
G
F
A
A
E
K
G
V
K
L
G
Q
V
A
Q
P
L
R
A
A
L
T
G
S
L
E
T
P
G
L
F
E
I
L
A
L
L
---
G
K
E
R
-
A
L
R
R
L
E
R
A
17
PsiBlast_PDB
87.29
34%
-101
- C3 -
4GRI
3
SYE_BORBU
A:
[24-502]
--
S
T
R
V
R
Y
A
P
S
P
T
G
L
Q
H
I
G
G
I
R
T
A
L
F
N
Y
F
F
A
K
S
C
G
G
K
F
L
L
R
I
E
D
T
D
Q
S
R
Y
S
P
E
A
E
N
D
L
Y
S
S
L
K
W
L
G
I
S
F
D
E-----
G
P
--------
V
--
V
GGDYAPY
V
-------
Q
S
Q
R
S
A
I
Y
K
Q
Y
A
K
Y
L
I
E
S
G
H
A
Y
Y
C
Y
C
S
P
E
R
L
-----
E
R
I
K
K
-------------------
I
Q
N
----
I
N
K
M
PPG
Y
D
R
-------
H
-------
C
RNLS
N
E
E
V
E
N
A
L
I
--
K
K
--------
I
K
-------
P
-
V
-
V
R
F
K
I
P
L
E
G
D
T
S
F
D
D
I
L
L
G
R
I
T
W
A
N
K
D
-
I
-
S
-
P
D
P
V
I
L
K
S
-----
D
-----
G
L
P
T
Y
H
L
A
N
V
V
D
D
Y
L
M
K
I
T
H
V
L
R
A
Q
E
W
V
S
S
G
P
L
H
V
L
L
Y
K
A
F
K
W
K
P
P
I
Y
C
H
L
P
M
V
M
G
N
D
G
Q
K
L
S
K
R
H
G
S
T
A
L
R
Q
F
I
E
D
G
Y
L
P
E
A
I
I
N
Y
V
T
L
L
G
W
S
--
Y
D
-
D
--
K
R
E
F
F
S
K
--
N
D
L
E
Q
F
F
S
I
E
K
I
N
K
S
P
A
I
F
D
Y
H
K
L
D
F
F
N
S
Y
Y
I
R
E
-
K
K
D
E
D
L
---
F
N
L
---
L
L
P
F
F
Q
K
K
GYVS
K
P
S
T
L
E
E
N
----
Q
-----
K
-
L
K
L
L
I
P
L
--
I
K
S
R
I
K
K
L
S
D
A
L
N
M
-
T
K
F
-
F
Y
E
D
I--------
K
-
S
W
N
L
D
E
F-------
K
E
V
C
---
S
I
L
E
L
I
K
P
I
L
E
G
F
E
K
R
S
S
E
E
N
-
D
K
I
F
Y
------
D
F
A
E
S
N
---
L
G
E
I
L
L
P
I
R
I
A
A
L
G
S
K
V
S
P
P
L
F
D
S
L
K
L
I
---
G
K
S
K
-
V
F
E
R
I
K
L
A
30
PsiBlast_CBE
87.08
34%
-98
- C3 -
4GRI
2
SYE_BORBU
B:
[24-502]
--
S
T
R
V
R
Y
A
P
S
P
T
G
L
Q
H
I
G
G
I
R
T
A
L
F
N
Y
F
F
A
K
S
C
G
G
K
F
L
L
R
I
E
D
T
D
Q
S
R
Y
S
P
E
A
E
N
D
L
Y
S
S
L
K
W
L
G
I
S
F
D
E-----
G
P
--------
V
--
V
GGDYAPY
V
-------
Q
S
Q
R
S
A
I
Y
K
Q
Y
A
K
Y
L
I
E
S
G
H
A
Y
Y
C
Y
C
S
P
E
R
L
-----
E
R
I
K
K
-------------------
I
Q
N
----
I
N
K
M
PPG
Y
D
R
-------
H
-------
C
RNLSNEEVE
N
A
L
I
--
K
K
--------
I
K
-------
P
-
V
-
V
R
F
K
I
P
L
E
G
D
T
S
F
D
D
I
L
L
G
R
I
T
W
A
N
K
D
-
I
-
S
-
P
D
P
V
I
L
K
S
-----
D
-----
G
L
P
T
Y
H
L
A
N
V
V
D
D
Y
L
M
K
I
T
H
V
L
R
A
Q
E
W
V
S
S
G
P
L
H
V
L
L
Y
K
A
F
K
W
K
P
P
I
Y
C
H
L
P
M
V
M
G
N
D
G
Q
K
L
S
K
R
H
G
S
T
A
L
R
Q
F
I
E
D
G
Y
L
P
E
A
I
I
N
Y
V
T
L
L
G
W
S
--
Y
D
-
D
--
K
R
E
F
F
S
K
--
N
D
L
E
Q
F
F
S
I
E
K
I
N
K
S
P
A
I
F
D
Y
H
K
L
D
F
F
N
S
Y
Y
I
R
E
-
K
K
D
E
D
L
---
F
N
L
---
L
L
PFFQKKGYVS
K
P
S
T
L
E
E
N
----
Q
-----
K
-
L
K
L
L
I
P
L
--
I
K
S
R
I
K
K
L
S
D
A
L
N
M
-
T
K
F
-
F
Y
E
D
I--------
K
-
S
W
N
L
D
E
FLSRK
K
T
A
K
E
V
C
---
S
I
L
E
L
I
K
P
I
L
E
G
F
E
K
R
S
S
E
E
N
-
D
K
I
F
Y
------
D
F
A
E
S
N
---
L
G
E
I
L
L
P
I
R
I
A
A
L
G
S
K
V
S
P
P
L
F
D
S
L
K
L
I
---
G
K
S
K
-
V
F
E
R
I
K
L
A
31
PsiBlast_CBE
62.61
32%
-90
- C3 -
4A91
2
GLUQ_ECOLI
A:
[7-286]
----
I
G
R
F
A
P
S
P
S
G
E
L
H
F
G
S
L
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A
L
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S
Y
L
Q
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A
R
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R
W
L
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V
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G
A
A
E
T
I
L
R
Q
L
E
H
Y
G
L
H
W
D
------
G
D
--------
V
--
L
-------
W
-------
Q
S
Q
R
H
D
A
Y
R
E
A
L
A
W
L
H
E
Q
G
L
S
Y
Y
C
T
C
-----------
T
R
A
R
-------------------
I
Q
S
----
I
G
G
I
---
Y
D
G
-------
H
-------
C
---------
R
V
L
H
HG
P
D
--------
N
A
-------
A
-
V
R
I
R
Q
Q
H
P
V
T
Q
---
F
T
D
Q
L
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-
A
D
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K
L
A
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R
-
E
D
F
I
I
H
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R
-----
D
-----
G
L
F
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V
V
D
D
H
F
Q
G
V
T
E
I
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P
D
Y
I
H
L
P
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A
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N
P
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A
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--
A
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A
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G
D
P
R
P
V
L
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A
A
L
Q
-
F
L
G
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--
H
W
-
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--
D
-
F
S
V
E
Q
I
L
Q
S
A
V
K
N
W
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S
A
I
V
N
S
T
F
S
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