@TOME V2.3
(Nov 2016)
Ref.
-
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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 : gbs0824: (2015-12-03 )
MSDNRSHIEEKYQWDLTTVFATDELWETEVVELTQAIDNAKGFSGHLLDSSQSLLEITEVELDLSRRLEKVYVYASMKNDQDTTVAKYQEFQAKATALYAKFSETFSFYEPELLQLSESDYQSFLLEMPDLQKYDHFFEKIFANKPHVLSQNEEELLAGASEIFGAAGETFEILDNADMVFPVVKNAKGEEVELTHGNFISLMESSDRTVRKEAYQAMYSTYEQFQHTYAKTLQTNVKSQNFKARVHHYQSARQSALSANFIPEEVYETLIKTVNHHLPLLHRYMKLRQKVLGLDDLKMYDVYTPLSQMDMSFTYDEALKKSEEVLAIFGEVYSERVHRAFTERWIDVHVNKGKRSGAYSGGSYDTNAFMLLNWQDTLDNLYTLVHETGHSLHSTFTRENQPYVYGDYSIFLAEIASTTNENILTETLLKEVKDDKNRFAILNHYLDGFKGTIFRQTQFAEFEHAIHVADQEGQVLTSEYLNNLYAELNEKYYGLTKEDNHFIQYEWARIPHFYYNYYVFQYATGFAAANYLAERIVNGNPEDKEAYLNYLKAGNSDYPLNVIAKAGVDMTSADYLDAAFRVFEERLVELENLVAKGVHND
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........420.---.--.-.-.----------..430--.--------...----.----.-.-..--440.-------...-----------.-----------..----450.......460.......-..470.......480.......490.....-.--.-500--....--.--...510..--..-...520..--.....530...-..-.--------------.---540----------........-.550....-------...560.-.....---.570.......580.......590.......600-
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
------MSD
N
R
S
H
I
E
E
K
Y
Q
W
D
L
T
T
V
F
ATDEL
W
E
T
E
V
V
E
L
T
Q
A
I
DNAKGFS
G
H
L--LDSS
Q
S
L
L
E
I
T
E
V
E
L
D
L
S
R
R
L
E
K
V
Y
V
Y
A
S------MKNDQD
T
T
V
A
K
Y
Q
E
--------------
F
Q
A
K
A
T
A
L
-----
Y
-----
A
K
F
S
E
TF-SFY
E
--------
P
E
L
L
QL---
S
E
S
D
Y
Q
S
F
L
LEM--P
D
L
----
Q
-
K
Y
D
H
F
F
E
K
I
FANKPHVLSQ
N
E
E
E
L
L
A
G
A
S
E
--
I
F
-------GAAG
E
T
F
E
ILDNA
D
M
---
V
---
F
P
VV--------------K-N-AKG
E
E
V
E
LTHG
N
F
I
S
L
-ME-SSD
R
T
V
R
------
K
E
A
Y
Q
A
M
Y
S
----
T
------
Y
E
-
Q
F
Q
H
T
Y
A
K
T
L
Q
T
NVK---SQ
N
F
K
A
R
V
-----
H
H
Y
----------
Q
-
S
------
A
-
R
Q
S
AL---------S---A----N--F
I
--------
P
-
E
E
V
Y
E
T
L
I
K
T
V
---
N
H
H
L
-
P
-
L
----
L
H
R
Y
---
M
----
K
L
-
R
Q
K
---VL---------------G------LD--------D
L
K
M
Y
D
------VYT
P
-
L
S
-------
Q
------------M--D--MSF--
T
Y
D
E
A
L
K
K
S
E
------------
E
V
L
-
A
I
F
G
E
V
Y
S
E
-----------
R
---------
V
---------
H
----------
R
A
----------
F
T
E
-
R
--------
W
-----------
I
D
--
V
H
VNKGKRSGAYSGG-S-Y---D-T-----------
N
-----------
A
--
F
M
L
L
N
W
Q
--
D
---------
T
---------
L
D
N
L
Y
T
L
V
H
ETG
H
S
L
H
S
T
FTR-ENQ
P
--
Y
----
V
-YG-
D
Y
S
I
F
-
L
A
E
I
A
STTNE
N
I
---
L
--
T
-
E
-
T
----------
L
L
K
----
E
--------
V
KD----D----K-
N
-
R
F
--
A
I
L
N
-------
H
Y
L
-----------
D
-----------GF----KG
T
I
F
R
Q
T
Q
F
A
--
E
F
E
H
A
I
H
-VADQEGQ
V
L
T
S
E
Y
L
N
N
L
Y
A
E
L
N
E
K
YYGLTK-E--D-N-
H
--
F
I
Q
Y
--
E
--WARI
P
H
F
Y
--
Y
N
-
Y
Y
V
F
Q
YAT--
G
F
A
A
A
N
Y
L
A
E
R
-
I
V-N--------------G---N------------P
E
D
K
E
A
Y
L
-
N
Y
L
K
AGNS-------DYP
L
N
V
I
-
A
KAGV---DMT
S
A
D
Y
L
D
A
A
F
R
V
F
E
E
R
L
V
E
L
E
N
L
V
A
KGVHND--
46
Fugue
92.68
36%
-69
- C3 -
3CE2
6
?
A:
[11-610]
------
Q
V
R
P
R
S
E
I
S
P
Q
D
C
W
D
I
T
P
L
Y
L
N
R
K
A
W
K
A
D
L
D
S
F
G
L
K
S
P
T
W
P
A
L
Q
A
T
Q
YQ
L
D
N
S
E
S
L
L
S
L
L
T
T
L
F
S
I
E
R
K
L
N
K
L
Y
V
Y
A
H
------
L
T
H
D
Q
D
I
T
N
Q
E
G
I
A
--------------
D
L
K
S
I
T
H
L
-----
H
-----
T
L
F
A
E
E
T
-
S
W
V
Q
--------
P
A
L
T
S
L
---
S
E
S
L
I
A
Q
H
L
S
A
---
P
C
L
----
A
-
P
Y
R
F
Y
L
E
K
I
F
R
L
S
I
H
T
G
T
P
G
E
E
K
I
L
A
S
A
F
T
--
P
L
-------
E
V
A
S
K
A
F
S
S
L
S
D
S
E
I
---
P
---
F
G
Q
A
--------------
T
-
D
-
S
E
G
N
S
H
P
L
S
H
A
L
A
S
L
Y
-
M
Q
-
S
T
D
R
E
L
R
------
K
T
S
Y
L
A
Q
C
E
----
R
------
Y
H
-
S
Y
R
H
T
F
A
N
L
L
N
G
K
I
Q
---
A
H
V
F
Y
A
K
N
-----
K
R
Y
----------
N
-
S
------
C
-
L
Q
A
A
L
---------
Y
---
H
----
N
--
N
I
--------
P
-
T
T
V
Y
T
N
L
I
D
I
V
---
K
K
N
S
-
S
-
L
----
I
T
K
Y
---
F
----
S
I
-
K
Q
R
---
C
L
---------------
N
------
L
K
--------
D
F
H
F
Y
D
------
V
Y
A
P
-
L
S
-------
Q
---------------
E
--
K
K
Y
--
T
F
Q
E
A
V
D
L
I
Y
------------
T
S
L
-
S
P
L
G
T
E
Y
I
D
-----------
T
---------
L
---------
K
----------
Q
G
----------
L
T
T
Q
G
--------
W
-----------
V
D
--
K
Y
E
N
L
N
K
R
S
G
A
Y
S
S
G
-
C
-
Y
---
D
-
S
-----------
H
-----------
P
--
Y
V
L
L
N
Y
T
--
G
---------
T
---------
L
Y
D
V
S
V
I
A
H
E
G
G
H
S
M
H
S
Y
F
S
R
-
K
H
Q
P
--
F
----
H
-
D
A
-
Q
Y
P
I
F
-
L
A
E
I
A
S
T
L
N
E
M
L
---
L
--
M
-
D
-
S
----------
M
L
K
----
E
--------
S
D
S
----
K
----
E
-
E
-
K
I
--
T
I
L
T
-------
R
C
L
-----------
D
-----------
T
I
----
F
S
T
L
F
R
Q
V
L
F
A
--
S
F
E
Y
D
I
H
-
H
A
A
E
H
G
V
P
L
T
E
E
Y
L
S
S
T
Y
K
N
L
Q
N
E
F
Y
G
E
I
I
-
T
--
F
-
D
-
V
--
L
S
N
I
--
E
--
W
A
R
I
P
H
F
Y
--
Y
N
-
F
Y
V
Y
Q
Y
A
T
--
G
I
I
A
A
L
C
F
L
E
K
-
I
L
-
N
--------------
N
---
E
------------
D
N
A
L
N
S
Y
L
-
N
F
L
K
S
G
G
S
-------
D
F
P
L
E
I
L
-
K
K
S
G
L
---
D
M
G
T
V
E
P
I
Q
K
A
F
C
F
I
E
K
K
I
Q
E
L
S
S
L
I
---------
1
PsiBlast_PDB
85.35
55%
-22
- C3 -
2QR4
-
?
A:
[26-601]
---------------------------
S
D
Q
E
F
D
E
K
Y
L
E
L
S
E
E
L
K
Q
S
E
K
H
K
G
T
L
--
D
Q
G
A
S
Q
F
L
N
A
I
E
F
V
L
R
V
Y
R
Q
T
E
V
I
Y
V
Y
A
H
------
L
K
N
D
Q
D
T
G
N
T
D
Y
Q
A
--------------
L
Y
A
R
A
S
S
L
-----
F
-----
S
K
V
S
E
A
V
-
S
W
F
E
--------
P
E
I
L
Q
L
---
S
D
D
Q
I
W
Q
Y
F
K
E
E
--
P
K
L
----
E
-
V
Y
R
H
Y
I
Q
Q
I
V
D
N
R
A
H
V
L
S
A
E
Q
E
S
L
L
A
G
A
G
E
--
I
F
-------
D
A
S
S
D
T
F
A
V
L
N
N
A
D
L
---
V
---
F
P
T
I
--------------
E
-
G
-
E
N
G
E
I
V
Q
L
S
H
G
V
Y
G
Q
L
-
L
E
-
S
T
D
R
R
V
R
------
E
A
A
F
K
G
L
Y
S
----
V
------
Y
E
-
Q
F
R
N
T
F
A
S
T
L
G
T
H
I
K
---
G
H
N
F
K
A
K
V
-----
R
N
Y
----------
S
-
S
------
A
-
R
E
A
S
L
---------
S
---
N
----
N
--
H
I
--------
P
-
E
S
V
Y
D
T
L
V
D
V
V
---
N
K
H
L
-
P
-
L
----
L
H
R
Y
---
M
----
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L
-
R
K
R
---
L
L
---------------
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------
V
E
--------
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------
L
Y
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P
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-------
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------------
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--
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--
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-------
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A
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------------
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A
L
-
K
P
M
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Y
M
A
-----------
I
---------------------------------------------------------------------------------------------------------------------------------------------
T
---------
L
D
Q
L
F
T
L
V
H
E
M
G
H
S
V
H
S
Y
F
T
---------------------
I
F
-
L
A
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I
A
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T
N
E
N
I
---
L
--
T
-
E
-
Y
----------
L
L
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----
T
--------
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K
D
----
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----
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-
V
-
R
A
--
Y
V
L
N
-------
H
Y
L
-----------
D
-----------
G
F
----
K
G
T
V
F
R
Q
T
Q
F
A
--
E
F
E
H
F
M
H
-
T
E
D
E
K
G
V
P
L
T
S
E
Y
L
S
D
S
Y
G
K
L
N
A
K
Y
Y
G
P
A
V
-
E
--
E
-
D
-
P
--
E
I
K
F
--
E
--
W
S
R
I
P
H
F
Y
--
Y
N
-
Y
Y
V
F
Q
Y
S
T
--
G
F
S
A
A
S
A
L
A
K
K
-
I
L
-
N
--------------
Q
---
E
------------
P
E
A
L
E
N
Y
L
-
A
Y
L
K
A
G
N
S
-------
D
Y
P
V
E
V
M
-
K
K
A
G
V
---
D
M
T
Q
A
A
Y
I
E
D
A
M
S
M
F
E
Q
R
L
N
E
L
E
E
L
I
D
R
E
------
22
HHSearch
84.88
56%
-22
- C3 -
2QR4
-
?
A:
[28-602]
-----------------------------
Q
E
F
D
E
K
Y
L
E
L
S
E
E
L
K
Q
S
E
K
H
K
G
T
L
--
D
Q
G
A
S
Q
F
L
N
A
I
E
F
V
L
R
V
Y
R
Q
T
E
V
I
Y
V
Y
A
H
------
L
K
N
D
Q
D
T
G
N
T
D
Y
Q
A
--------------
L
Y
A
R
A
S
S
L
-----
F
-----
S
K
V
S
E
A
V
-
S
W
F
E
--------
P
E
I
L
Q
L
---
S
D
D
Q
I
W
Q
Y
F
K
E
E
--
P
K
L
----
E
-
V
Y
R
H
Y
I
Q
Q
I
V
D
N
R
A
H
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L
S
A
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Q
E
S
L
L
A
G
A
G
E
--
I
F
-------
D
A
S
S
D
T
F
A
V
L
N
N
A
D
L
---
V
---
F
P
T
I
--------------
E
-
G
-
E
N
G
E
I
V
Q
L
S
H
G
V
Y
G
Q
L
-
L
E
-
S
T
D
R
R
V
R
------
E
A
A
F
K
G
L
Y
S
----
V
------
Y
E
-
Q
F
R
N
T
F
A
S
T
L
G
T
H
I
K
---
G
H
N
F
K
A
K
V
-----
R
N
Y
----------
S
-
S
------
A
-
R
E
A
S
L
---------
S
---
N
----
N
--
H
I
--------
P
-
E
S
V
Y
D
T
L
V
D
V
V
---
N
K
H
L
-
P
-
L
----
L
H
R
Y
---
M
----
E
L
-
R
K
R
---
L
L
---------------
E
------
V
E
--------
K
L
H
M
Y
D
------
L
Y
T
P
-
V
L
-------
G
------------
E
A-
P
--
I
-------
E
A
K
E
K
A
L
------------
E
A
L
-
K
P
M
G
E
E
Y
M
A
-----------
I
---------------------------------------------------------------------------------------------------------------------------------------------
T
---------
L
D
Q
L
F
T
L
V
H
E
M
G
H
S
V
H
S
Y
F
T
---------------------
I
F
-
L
A
E
I
A
S
T
T
N
E
N
I
---
L
--
T
-
E
-
Y
----------
L
L
E
----
T
--------
E
K
D
----
P
----
R
-
V
-
R
A
--
Y
V
L
N
-------
H
Y
L
-----------
D
-----------
G
F
----
K
G
T
V
F
R
Q
T
Q
F
A
--
E
F
E
H
F
M
H
-
T
E
D
E
K
G
V
P
L
T
S
E
Y
L
S
D
S
Y
G
K
L
N
A
K
Y
Y
G
P
A
V
-
E
--
E
-
D
-
P
--
E
I
K
F
--
E
--
W
S
R
I
P
H
F
Y
--
Y
N
-
Y
Y
V
F
Q
Y
S
T
--
G
F
S
A
A
S
A
L
A
K
K
-
I
L
-
N
--------------
Q
---
E
------------
P
E
A
L
E
N
Y
L
-
A
Y
L
K
A
G
N
S
-------
D
Y
P
V
E
V
M
-
K
K
A
G
V
---
D
M
T
Q
A
A
Y
I
E
D
A
M
S
M
F
E
Q
R
L
N
E
L
E
E
L
I
D
R
E
------
7
PsiBlast_PDB
67.57
22%
-42
- C3 -
3SKS
4
?
A:
[17-539]
----------------------------
E
E
L
K
E
K
F
T
V
A
L
-
E
K
F
D
N
A
K
T
V
E
------
E
Q
K
Q
V
I
H
S
I
N
E
I
R
N
D
F
G
T
M
G
N
L
C
Y
I
R
H
S
------
V
----
D
T
T
D
A
F
Y
K
E
E
Q
D
F
F
D
E
F
S
P
V
---
V
Q
G
Y
G
T
K
Y
-----
Y
N
A
L
I
H
S
P
F
R
E
E
L
E
A
Y
Y
G
--------
K
Q
L
F
A
L
---
A
E
C
D
L
K
T
Y
S
D
E
V
V
-
K
D
L
----
Q
----------
L
E
N
K
---
L
S
S
Q
Y
T
Q
L
L
A
S
A
K
I
--
D
F
---------
A
G
E
---------------------------------------------
E
R
T
L
S
Q
L
I
P
F
-
M
Q
-
G
K
E
R
S
E
R
------
K
A
A
S
E
A
Y
Y
G
F
L
A
E
N
------
E
E
-
E
L
D
R
I
Y
D
E
L
V
K
V
R
T
K
I
A
K
S
L
G
F
K
N
F
V
E
L
G
Y
A
R
M
Y
----------
R
-
T
------
D
-
Y
N
A
E
M
---------
V
---
A
----
N
--
Y
R
--------
Q
-
Q
--------
V
L
---
D
Y
I
V
-
P
-
V
----
T
T
E
L
---
R
----
K
R
-
Q
Q
A
---
R
I
---------------
G
------
V
E
--------
K
L
A
Y
Y
D
ENFEFP
T
G
N
P
-
T
P
-------
K
------------
G
--
D
--
A
D
W
--
I
V
N
H
G
K
T
M
Y
K
------------
E
L
S
-
A
E
T
D
E
F
F
N
F
-----------
M
---------
L
---------
D
----------
N
D
----------
L
------------------------
L
D
--
L
V
A
K
K
G
K
A
G
G
G
Y
C
---
T
-
Y
---
I
-
E
-----------
N
YK
A
--------
P
--
F
I
F
S
N
F
N
--
G
---------
T
---------
S
G
D
I
D
V
L
T
H
E
A
G
H
A
F
Q
V
Y
E
S
R
-
K
F
E
I
--
P
----
E
-
Y
N
-
W
P
T
Y
E
-
A
C
E
I
H
S
M
S
M
E
-
F
---
F
--
T
-
W
-
P
----------
W
M
K
LFF-
E
--------
E
D
A
----
D
----
K
-
Y
-
Y
F
--
S
H
L
S
-------
S
A
L
-----------
L
-----------
F
L
----
P
Y
G
V
----
S
V
D
--
E
Y
Q
H
Y
V
Y
-----
E
N
P
E
A
S
P
E
E
R
K
T
A
W
R
N
I
E
K
K
Y
L
P
H
---------------------------------
S
P
F
Y
Y
I
D
Y
T
L
--
A
Q
I
C
A
L
Q
F
W
K
R
-
A
R
-
D
--------------
N
---
R
------------
Q
E
A
W
E
D
Y
V
-
N
L
C
Q
Q
G
G
S
-------
K
S
F
L
E
L
V
-
E
V
A
N
L
---
T
S
P
F
A
E
G
C
V
K
S
V
I
T
E
I
E
A
W
L
H
A
I
D
D
T
K
L
-------
24
HHSearch
66.97
18%
-42
- C3 -
3AHN
4
?
A:
[32-560]
---------------------------------------------------------
N
A
E
E
Q
N
E
A
M
K
E
I
N
Q
L
R
N
D
F
S
T
M
A
Q
I
C
Y
------
I
R
H
T
I
D
T
N
D
E
F
Y
K
Q
--------------
E
Q
D
F
F
D
E
----------------------
V
E
--------
P
I
V
K
G
L
---
V
N
D
Y
Y
R
A
L
V
S
-----------
S
-
P
F
R
S
Q
L
E
G
K
W
G
K
Q
---
L
F
A
L
A
E
A
E
L
K
T
Y
S
P
--
D
I
V
E
D
L
Q
L
E
N
K
L
T
S
E
Y
T
K
L
V
A
S
-
A
---
K
---
I
F
--------------------
F
E
G
E
E
R
T
L
--
A
Q
L
Q
P
F
-
V
E
-
S
P
D
R
D
M
R
------
K
R
A
S
E
A
R
F
T
----
F
------
F
Q
-
E
H
E
E
K
F
D
E
I
Y
D
Q
L
V
K
---
V
R
T
A
I
A
Q
K
-----
L
G
F
----------
K
-
N
------
F
-
V
E
L
G
Y
---------
A
R
L
G
R
----
T
--
D
Y
--------
N
-
A
E
M
V
A
K
F
R
K
Q
V
---
E
K
H
I
V
P
-
I
----
A
V
K
L
---
R
----
E
R
-
Q
R
E
---
R
I
---------------
G
------
V
E
--------
K
L
K
Y
Y
D
------
E
A
F
V
-
F
P
-------
T
------------
G
NP
M
--
P
K
G
--
D
A
N
W
I
I
E
N
G
K
------------
K
M
Y
-
E
E
L
S
P
E
T
G
E
-----------
F
---------
F
---------
R
----------
Y
M
----------
I
E
H
-
E
--------
L
-----------
M
D
--
L
V
A
K
K
G
K
A
S
G
G
Y
C
T
Y
-
I
-
E
---
N
Y
K
-----------
A
-----------
P
--
F
I
F
S
N
F
T
--
G
---------
T
---------
S
G
D
I
D
V
L
T
H
E
A
G
H
A
F
Q
V
Y
E
S
R
-
H
Y
E
I
--
P
----
E
-
Y
N
-
W
P
T
L
E
-
A
C
E
I
H
S
M
S
M
E
F
F
---
T
--
W
-
P
-
W
----------
M
K
L
----
F
--------
F
K
E
----
D
----
A
-
E
-
K
Y
--
Q
-
F
--------
Y
H
L
-----------
S
-----------
D
A
----
L
L
F
L
P
Y
G
V
A
V
D
--
E
F
Q
H
F
V
Y
-
E
----
N
P
N
A
T
P
A
E
R
K
Q
A
W
R
A
I
E
R
K
Y
M
P
T
K
D
-
Y
--
D
G
N
-
D
Y
L
E
R
G
G
--
F
--
W
Q
R
Q
S
H
I
Y
T-
T
A
-
F
Y
Y
I
D
Y
T
L
--
A
Q
I
C
A
F
Q
F
W
K
R
-
S
R
-
E
--------------
N
---
Y
------------
K
E
A
W
N
D
Y
L
-
T
L
C
R
Q
G
G
S
-------
K
P
F
T
E
L
V
-
R
V
A
N
L
I--
S
P
F
E
D
G
C
V
Q
S
V
V
G
G
I
E
G
W
L
N
S
V
D
D
Q
S
L
--------
49
Fugue
66.31
15%
-42
- C3 -
3AHN
4
?
A:
[1-564]
------------
M
K
F
S
E
F
R
Y
E
R
P
N
I
E
K
L
K
A
S
F
Q
Q
A
L
Q
S
F
Q
K
A
--------------
S
N
A
E
E
Q
N
E
A
M
K
E
I
N
Q
L
R
N
D
F
S
T
M
A
Q
I
C
Y
------
I
R
H
T
I
D
T
N
D
E
F
Y
K
Q
--------------
E
Q
D
F
F
D
E
V
-----
E
-----
P
I
V
K
G
L
V
-
N
D
Y
Y
--------
R
A
L
V
S
----------
S
P
F
R
S
Q
--
L
E
G
----
K
-
W
G
K
Q
L
F
A
L
A
E
A
E
L
K
T
----
Y
S
P
D
I
V
E
D
L
Q
L
--
E
N
-------
K
L
T
S
E
Y
T
K
L
V
A
S
A
K
I
---
F
---
F
------------------------
E
G
E
E
R
T
L
A
Q
L
Q
P
F
-
V
E
-
S
P
D
R
D
M
R
------
K
R
A
S
E
A
R
F
T
----
F
------
F
Q
-
E
H
E
E
K
F
D
E
I
Y
D
Q
L
V
K
---
V
R
T
A
I
A
Q
K
-----
L
G
F
----------
K
-
N
------
F
-
V
E
L
G
Y
---------
A
---
R
L
GRT
D
--
Y
N
--------
A
-
E
M
V
A
K
F
R
K
Q
V
E
---
K
H
I
V
-
P
-
I
----
A
V
K
L
---
R
----
E
R
-
Q
R
E
---
R
I
---------------
G
------
V
E
--------
K
L
K
Y
Y
D
------
E
A
F
V
-
F
P
-------
T
------------
G
--
N
--
P
M
P
KG
D
A
N
W
I
I
E
N
G
K
------------
K
M
Y
-
E
E
L
S
P
E
T
G
E
-----------
F
---------
F
---------
R
----------
Y
M
----------
I
E
H
-
E
--------
L
-----------
M
D
--
L
V
A
K
K
G
K
A
S
G
G
Y
C
T
Y
I
E
-
N
---
Y
-
K
-----------
A
-----------
P
--
F
I
F
S
N
F
T
--
G
---------
T
---------
S
G
D
I
D
V
L
T
H
E
A
G
H
A
F
Q
V
Y
E
S
R
-
H
Y
E
I
--
P
----
E
-
Y
N
-
W
P
T
L
E
-
A
C
E
I
H
S
M
S
M
E
-
F
---
F
--
T
-
W
-
P
----------
W
M
K
----
L
--------
F
F
K
----
E
----
D
-
A
-
E
K
--
Y
Q
F
Y
-------
H
L
S
-----------
D
-----------
A
L
----
L
-
F
L
P
Y
G
V
A
V
D
--
E
F
Q
H
F
V
Y
-
E
N
P
N
----
A
T
P
A
E
R
K
Q
A
W
R
A
I
E
R
K
Y
M
P
T
K
D
Y
D
--
G
-
N
-
D
--
Y
L
E
R
GG
F
--
W
Q
R
Q
S
H
I
Y
--
T
T
A
F
Y
Y
I
D
Y
T
L
--
A
Q
I
C
A
F
Q
F
W
K
R
-
S
R
-
E
--------------
N
---
Y
------------
K
E
A
W
N
D
Y
L
-
T
L
C
R
Q
G
G
S
-------
K
P
F
T
E
L
V
-
R
V
A
N
L
I--
S
P
F
E
D
G
C
V
Q
S
V
V
G
G
I
E
G
W
L
N
S
V
D
D
Q
S
L
--------
23
HHSearch
65.67
17%
-46
- C3 -
3SKS
4
?
A:
[35-563]
---------------------------------------------------------
T
V
E
E
Q
K
Q
V
I
H
S
I
N
E
I
R
N
D
F
G
T
M
G
N
L
C
Y
------
I
R
H
S
V
D
T
T
D
A
F
Y
K
E
--------------
E
Q
D
F
F
D
E
----------------------
F
S
--------
P
V
V
Q
G
Y
---
G
T
K
Y
Y
N
A
L
I
H
S
P
F
R
E
E
L
----
E
A
Y
Y
G
K
Q
L
F
A
L
A
E
C
D
L
K
T
Y
S
D
E
V
V
K
D
L
Q
L
E
N
-------------
K
L
S
S
Q
Y
T
Q
L
L
A
S
-
A
---
K
---
I
D
--------------------
F
A
G
E
E
R
T
L
--
S
Q
L
I
P
F
-
M
Q
-
G
K
E
R
S
E
R
------
K
A
A
S
E
A
Y
Y
G
----
F
------
L
A
-
E
N
E
E
E
L
D
R
I
Y
D
E
L
V
K
---
V
R
T
K
I
A
K
S
-----
L
G
F
----------
K
-
N
------
F
-
V
E
L
G
Y
---------
A
R
M
Y
R
----
T
--
D
Y
--------
N
-
A
E
M
V
A
N
Y
R
Q
Q
V
---
L
D
Y
I
V
P
-
V
----
T
T
E
L
---
R
----
K
R
-
Q
Q
A
---
R
I
---------------
G
------
V
E
--------
K
L
A
Y
Y
D
------
E
N
F
E
-
F
P
-------
T
------------
G
--
N
PT
P
K
G
--
D
A
D
W
I
V
N
H
G
K
------------
T
M
Y
-
K
E
L
S
A
E
T
D
E
-----------
F
---------
F
---------
N
----------
F
M
----------
L
D
N
-
D
--------
L
-----------
L
D
--
L
V
A
K
K
G
K
A
G
G
G
Y
C
T
Y
-
I
-
E
---
N
Y
K
-----------
A
-----------
P
--
F
I
F
S
N
F
N
--
G
---------
T
---------
S
G
D
I
D
V
L
T
H
E
A
G
H
A
F
Q
V
Y
E
S
R
-
K
F
E
I
--
P
----
E
-
Y
N
-
W
P
T
Y
E
-
A
C
E
I
H
S
M
S
M
E
F
F
---
T
--
W
-
P
-
W
----------
M
K
L
----
F
--------
F
E
E
----
D
------
A
-
D
K
--
Y
Y
F
--------
S
H
L
-----------
S
-----------
S
A
----
L
L
F
L
P
Y
G
V
S
V
D
--
E
Y
Q
H
Y
V
Y
-
E
----
N
P
E
A
S
P
E
E
R
K
T
A
W
R
N
I
E
K
K
Y
L
P
H
--------------------------------
S
P
-
F
Y
Y
I
D
Y
T
L
--
A
Q
I
C
A
L
Q
F
W
K
R
-
A
R
-
D
--------------
N
---
R
------------
Q
E
A
W
E
D
Y
V
-
N
L
C
Q
Q
G
G
S
-------
K
S
F
L
E
L
V
-
E
V
A
N
L
T--
S
P
F
A
E
G
C
V
K
S
V
I
T
E
I
E
A
W
L
H
A
I
D
D
T
K
L
--------
51
Fugue
62.16
13%
-36
- C3 -
1I1I
2
NEUL_RAT
P:
[14-678]
------
M
S
S
Y
T
A
A
G
R
N
V
L
R
W
D
L
S
-
P
E
Q
I
K
T
R
T
E
Q
L
I
A
Q
T
K
Q
V
Y
D
T
V
G
T
I
A
L
K
E
--
V
T
Y
E
N
C
L
Q
V
L
A
D
I
E
V
T
Y
I
V
E
R
T
M
L
D
F
P
Q
H
VSSDRE
V
R
A
A
S
T
E
A
D
K
K
L
S
R
--------------
F
D
I
E
M
S
M
R
-----
E
-----
D
V
F
Q
R
I
V
-
H
L
Q
E
TCDLEKIK
P
E
A
R
R
Y
---
L
E
K
S
I
K
M
G
K
R
N
G
--
L
H
L
----
S
-
E
H
I
R
N
E
I
K
S
M
K
K
R
M
S
E
L
C
I
D
F
N
K
N
L
N
E
D
D
T
--
S
L
-------
V
F
S
K
A
E
L
G
A
L
P
D
D
F
I
---
D
---
S
L
E
K
--------------
T
-
D
-
E
D
K
Y
K
V
T
L
K
Y
P
H
Y
F
P
V
-
M
K
K
C
C
V
P
E
T
R
------
R
K
M
E
M
A
F
H
T
--------------
R
C
K
Q
E
N
T
A
I
L
Q
Q
L
L
P
---
L
R
A
Q
V
A
K
L
-----
L
G
Y
----------
N
-
T
------
H
-
A
D
F
V
L
ELNTAKSTS
R
---
V
----
A
--
A
F
--------
L
-
D
D
L
S
Q
K
L
K
P
L
G
---
E
A
E
R
-
E
-
F
----
I
L
S
L
---
K
----
K
K
-
E
C
E
---
E
R
---------------
G
------
F
E
YDGKINAW
D
L
H
Y
Y
M
------
T
Q
T
E
-
E
L
KYSVDQE
S
------------
L
--
K
--
E
Y
F
--
P
I
E
V
V
T
E
G
L
L
------------
S
I
Y
Q
E
L
L
G
L
S
F
E
Q
VPDAHVWNKSV
S
---------
L
---------
Y
----------
T
V
----------
K
D
K
-
A
TGEVLGQF
Y
-----------
L
D
--
L
Y
P
R
E
G
K
Y
N
H
A
A
C
F
G
-
L
-
Q
---
P
-
G
-----------
C
LLPDGSRMMSV
A
--
A
L
V
V
N
F
S
--
Q
PVAGRPSLL
R
---------
H
D
E
V
R
T
Y
F
H
E
F
G
H
V
M
H
Q
I
C
A
Q
-
T
D
F
A
--
R
----
F
-
S
G
-
T
N
V
E
T
D
F
V
E
V
P
S
Q
M
L
E
N
W
---
V
WD
V
-
D
-
S
----------
L
R
K
----
L
--------
S
K
H
----
Y
----
K
-
D
-
G
H
--
P
I
T
D
-------
E
L
L
-----------
E
-----------
K
L
----
V
A
S
R
L
V
N
T
G
L
L
--
T
L
R
Q
I
V
L
S
K
V
D
Q
S
L
H
T
N
A
T
L
D
A
A
S
E
Y
A
K
Y
C
T
E
I
L
G
V
A
A
-
T
--
P
-
G
-
T
--
N
M
P
A
--
T
--
F
G
H
L
A
G
G
Y
--
D
G
-
Q
Y
Y
G
Y
L
W
S
--
E
V
F
S
M
D
M
F
H
S
C
-
F
K
-
K
--------------
E
---
G
------------
I
M
N
P
E
V
G
M
-
K
Y
R
N
L
----------------
I
-
L
K
P
G
-------
G
S
L
D
G
M
D
M
L
Q
N
F
L
Q
R
E
P
N
Q
K
A
F
L
M
S
R
G
L
----
6
PsiBlast_PDB
61.70
22%
-40
- C3 -
2H1N
2
?
A:
[159-545]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
R
T
L
A
Q
L
Q
P
F
-
V
E
-
S
P
D
R
A
M
R
------
Q
R
A
S
E
A
R
F
S
----
F
------
F
K
-
D
Y
E
K
E
L
D
E
L
Y
D
E
L
V
H
---
V
R
T
A
I
A
R
K
-----
L
G
F
----------
Q
-
N
F
V
E
L
G
Y
A
-
R
L
G
R
T
---------
D
---
Y
----
N
--
A
D
--------
M
-
V
A
G
Y
R
R
Q
V
K
T
-----
H
I
V
-
P
-
L
----
A
A
K
L
---
R
----
E
R
-
Q
R
Q
---
R
I
---------------
Q
------
V
E
--------
K
L
Y
Y
Y
D
EPFMFP
T
G
N
P
-
T
P
-------
K
------------
G
--
D
--
A
D
W
--
I
V
Q
N
G
R
Q
M
Y
E
------------
E
L
S
-
P
E
T
G
E
F
F
R
Y
-----------
M
---------
V
---------
E
----------
H
E
----------
L
M
------------------------
D
--
L
V
A
K
K
G
K
A
G
G
G
Y
C
T
Y
-
I
-
D
---
D
-
Y
-----------
K
-----------
A
P
-
F
I
F
S
N
F
T
--
G
---------
T
---------
S
G
D
I
D
V
L
T
H
E
A
G
H
A
F
Q
V
Y
E
S
R
-
H
Y
D
I
--
P
----
E
-
Y
N
-
W
P
T
L
E
-
A
C
E
I
H
S
M
S
M
E
F
F
T
WP
W
--
M
-
E
-
L
----------
F
F
G
----
E
---------
D
A
----
D
----
K
-
Y
-
R
F
--
A
H
L
S
-------
D
A
L
--------------------------------
L
F
L
P
Y
G
V
A
V
D
E
F
Q
H
A
V
Y
-----
E
N
P
D
M
T
P
A
E
R
K
S
V
W
R
N
I
-
E
K
A
Y
L
P
T
R
-
D
YA
D
-
H
-
D
--
Y
L
E
R
--
G
GF
W
Q
R
Q
G
H
I
Y
--
T
D
P
F
Y
Y
I
D
Y
T
L
--
A
Q
V
C
A
F
Q
F
W
K
R
-
A
Q
-
E
--------------
D
---
R
------------
A
S
A
W
R
D
Y
V
-
A
L
C
R
L
G
G
S
-------
R
P
F
T
E
L
V
-
K
S
A
N
L
---
Q
S
P
F
A
D
G
A
V
A
S
V
V
G
H
I
E
R
W
L
D
S
V
D
D
K
A
L
-------
5
PsiBlast_PDB
61.41
22%
-41
- C3 -
2H1J
1
?
A:
[159-545]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
R
T
L
A
Q
L
Q
P
F
-
V
E
-
S
P
D
R
A
M
R
------
Q
R
A
S
E
A
R
F
S
----
F
------
F
K
-
D
Y
E
K
E
L
D
E
L
Y
D
E
L
V
H
---
V
R
T
A
I
A
R
K
-----
L
G
F
----------
Q
-
N
F
V
E
L
G
Y
A
-
R
L
G
R
T
---------
D
---
Y
----
N
--
A
D
--------
M
-
V
A
G
Y
R
R
Q
V
K
T
-----
H
I
V
-
P
-
L
----
A
A
K
L
---
R
----
E
R
-
Q
R
Q
---
R
I
---------------
Q
------
V
E
--------
K
L
Y
Y
Y
D
EPFMFP
T
G
N
P
-
T
P
-------
K
------------
G
--
D
--
A
D
W
--
I
V
Q
N
G
R
Q
M
Y
E
------------
E
L
S
-
P
E
T
G
E
F
F
R
Y
-----------
M
---------
V
---------
E
----------
H
E
----------
L
M
------------------------
D
--
L
V
A
K
K
G
K
A
G
G
G
Y
C
T
Y
-
I
-
D
---
D
-
Y
-----------
K
-----------
A
P
-
F
I
F
S
N
F
T
--
G
---------
T
---------
S
G
D
I
D
V
L
T
H
E
A
G
H
A
F
Q
V
Y
E
S
R
-
H
Y
D
I
--
P
----
E
-
Y
N
-
W
P
T
L
E
-
A
C
E
I
H
S
M
S
M
E
F
F
T
WP
W
--
M
-
E
-
L
----------
F
F
G
----
E
---------
D
A
----
D
----
K
-
Y
-
R
F
--
A
H
L
S
-------
D
A
L
--------------------------------
L
F
L
P
Y
G
V
A
V
D
E
F
Q
H
A
V
Y
-----
E
N
P
D
M
T
P
A
E
R
K
S
V
W
R
N
I
-
E
K
A
Y
L
P
T
R
-
D
YA
D
-
H
-
D
--
Y
L
E
R
--
G
GF
W
Q
R
Q
G
H
I
Y
--
T
D
P
F
Y
Y
I
D
Y
T
L
--
A
Q
V
C
A
F
Q
F
W
K
R
-
A
Q
-
E
--------------
D
---
R
------------
A
S
A
W
R
D
Y
V
-
A
L
C
R
L
G
G
S
-------
R
P
F
T
E
L
V
-
K
S
A
N
L
---
Q
S
P
F
A
D
G
A
V
A
S
V
V
G
H
I
E
R
W
L
D
S
V
D
D
K
A
L
-------
30
HHSearch
57.43
13%
-51
- C3 -
1KA2
1
CBP1_PYRFU
A:
[8-493]
------------------------------------------------------------
E
T
I
K
Q
I
L
A
K
Y
R
R
I
W
A
I
G
H
A
Q
S
V
L
G
------
W
D
L
E
V
N
M
P
K
E
G
I
-
L
--------------
E
R
S
V
A
Q
G
E
---------------------------------
L
S
V
L
-------
S
H
E
L
L
L
-
H
--
P
E
F
----
V
----
N
L
V
E
K
A
K
G
L
-
E
-
N
L
N
E
Y
E
R
G
I
V
R
V
L
D
R
--
S
--------------
I
R
I
A
R
A
---------------------------------------
F
P
P
E
F
I
--
R
-
E
V
-
S
E
T
T
S
L
A
------
T
K
A
W
E
E
A
K
A
----
K
------
D
---
D
F
S
K
F
E
P
W
L
D
K
I
I
S
---
L
A
K
R
A
A
E
Y
-----
L
G
Y
----------
E
E
E
------
P
-
Y
D
A
L
L
---------
D
---
L
----
Y
EE
G
L
--------
R
-
T
R
D
V
E
K
M
F
E
V
L
---
E
K
K
L
-
K
P
L
----
L
D
K
I
---
L
----
E
--
E
G
---------------------
K
------
V
P
--------
R
E
H
P
L
-------------
E
-----------------------
K
--
E
K
Y
--
E
R
E
W
M
E
R
V
N
L
------------
W
I
L
-
Q
K
F
G
F
P
L
G
T
--------------------------------------------------------
R
-
A
--------
R
-----------
L
D
--------
V
S
A
H
P
F
T
T
E
-
F
-
G
---
I
-
R
-----------
D
-----------
V
--
R
I
T
T
R
Y
E
--
G
---------
Y
DF-------
R
R
T
I
L
S
T
V
H
E
F
G
H
A
L
Y
E
L
Q
Q
D
-
E
R
F
M
--
F
T---
P
I
A
G
-
G
V
S
L
G
-
I
H
E
S
Q
S
R
F
W
E
N
I
I--
G
--
R
-
S
-
K
E
---------
F
V
E
----
L
I
Y
P
V
L
K
E
N
L
P
F
----
M
------
S
-
N
Y
T
P
E
D
V
Y
-------
L
Y
F
-----------
N
I
V
R
P
D
FIRTEA
D
V
----
V
T
Y
N
F
H
I
L
L
R
F
--
K
L
E
R
L
M
V
-
S
----
E
-
E
I
K
A
K
D
L
P
E
M
W
N
D
E
M
E
R
L
L
G
I
R
P
-
R
---------
K
Y
S
E
--
G
--
I
L
Q
D
I
H
W
A
HG
S
I
-
G
Y
F
P
T
Y
T
I
--
G
T
L
L
S
A
Q
L
Y
Y
H
-
I
K
-
K
--------------
D
---
I
P
D
F
E
E
K
V
A
K
AEF
D
P
I
K
A
W
L
R
E
K
I
H
R
W
G
S
I
-------
Y
P
P
K
E
L
L
K
K
A
I
G
E
---
D
M
D
A
E
Y
F
V
R
W
V
K
E
K
Y
L
-------------------
25
HHSearch
57.26
14%
-48
- C3 -
1R42
7
ACE2_HUMAN
A:
[21-600]
---------------------------------------------------------
I
E
E
Q
A
K
T
F
L
D
K
F
N
H
E
A
E
D
L
F
Y
Q
S
S
L
A
S
------
W
N
Y
N
T
N
I
T
E
E
N
V
-
Q
--------------
N
M
N
N
A
G
D
K
-----
W
-----
S
A
F
L
K
E
Q
-
S
T
L
A
--------
Q
M
Y
P
---------
L
Q
E
I
Q
N
-----------
L
-
T
V
K
L
Q
L
Q
A
L
Q
Q
N
G
S
S
V
L
S
E
D
---
K
S
K
R
L
N
T
--
I
L
-------
N
T
M
S
T
I
Y
S
T
G
K
V
C
N
P
---
D
-------------------------
N
P
Q
E
C
L
L
L
E
-
P
G
L
N
E
I
M
A
N
-
S
L
D
Y
N
E
R
------
L
W
A
W
E
S
W
R
S
----
E
------
V
----
G
K
Q
L
R
P
L
Y
E
E
Y
V
V
---
L
K
N
E
M
A
R
A
-----
N
H
Y
----------
E
-
D
------
Y
-
G
D
Y
W
R
---------
G
---
D
----
Y
--
E
V
N
GVDGY
D
Y
S
-
R
G
Q
L
I
E
D
V
E
H
T
---
F
E
E
I
K
P
-
L
----
Y
E
H
L
H
A
Y
V
----
R
A
K
L
M
N
---
A
Y
PSYISPIGCLPAHLL
G
------
D
M
--------
W
G
R
F
W
T
------
N
L
Y
S
-
L
T
-------
V
PFGQKPNIDV
T
D
A
M
V
D
--
Q
A
W
--
D
A
Q
R
I
F
K
E
A
E
------------
K
F
F
-
V
S
V
G
L
P
N
M
T
--------------------------------------------------------
Q
-
G
--------
F
-----------
W
E
NS
M
L
T
D
P
G
N
V
Q
K
A
V
C
H
P
-
T
A
W
DLG
K
-
G
-----------
D
-----------
F
--
R
I
L
M
C
T
K
--
V
---------
T
---------
M
D
D
F
L
T
A
H
H
E
M
G
H
I
Q
Y
D
M
A
Y
A
--
A
Q
P
--
F
----
L
-
L
R
N
G
A
N
E
G
-
F
H
E
A
V
G
E
I
M
S
L
S
---
A
--
A
-
T
P
K
----------
H
L
K
----
S
I
GLLSPD-
F
Q
E
----
D
----
N
-
E
T
E
I
--
N
F
L
L
-------
K
Q
A
-----------
L
-----------
T
I
----
V
G
T
L
P
F
T
Y
M
L
E
--
K
W
R
W
M
V
F
-
K
----
G
-
E
I
P
K
D
Q
W
M
K
K
W
W
E
M
K
R
E
I
V
G
V
V
E
-
P
--
V
-
P
H
D
--
E
T
Y
C
--
D
--
P
A
S
L
F
H
V
S
--
N
D
-
Y
S
F
I
R
Y
Y
T
--
R
T
L
Y
Q
F
Q
F
Q
E
A
-
L
C
-
Q
A
A
KHEGPLHKCDIS
N
---
S
------------
T
E
A
G
Q
K
L
F
-
N
M
L
R
L
G
K
S
-------
E
P
W
T
L
A
L
E
N
V
V
G
A
---
K
N
M
N
V
R
P
L
L
N
Y
F
E
P
L
F
T
W
L
K
D
Q
N
K
N
S
F
V
G
W
S
T
D
--
28
HHSearch
56.62
16%
-39
- C3 -
2O36
1
THOP1_HUMAN
A:
[42-659]
---------------------------------------------------------
E
D
V
S
Y
E
S
T
L
K
A
L
A
D
V
E
V
T
Y
T
V
Q
R
N
I
L
D
------
F
P
Q
H
V
-
S
P
S
K
D
I
R
T
--------------
A
S
T
E
A
D
K
K
-----
L
-----
S
E
F
D
V
E
M
-
S
M
R
E
--------
D
V
Y
Q
R
I
V
W
L
Q
E
K
V
Q
K
D
S
L
R
-
P
--
E
A
A
----
R
-
Y
L
E
R
L
I
K
L
G
R
R
N
G
L
H
-
L
P
R
E
T
Q
E
N
I
K
R
I
K
K
--
K
L
-------
S
L
L
C
I
D
F
N
K
N
L
N
E
D
T
T
F
L
P
---
F
T
L
Q
ELGGLP
E
D
F
L
N
S
LE
K
-
M
E
D
G
K
L
K
V
T
L
K
Y
P
H
Y
F
P
L
L
K
K
-
C
H
V
P
E
T
R
------
R
K
V
E
E
A
F
N
S
----
R
------
C
K
E
E
N
----
S
A
I
L
K
E
L
V
T
---
L
R
A
Q
K
S
R
L
-----
L
G
F
----------
H
-
T
------
H
-
A
D
Y
V
L
---------
E
--------
M
--
N
M
AK------
T
-
S
Q
T
V
A
T
F
L
D
E
L
---
A
Q
K
L
K
P
-
L
----
G
E
Q
E
---
R
A
V
I
L
E
L
-
K
R
A
E
C
E
R
R
---------------
G
LPF---
D
G
--------
R
I
R
A
W
D
------
M
R
Y
Y
-
M
N
-------
Q
V
E
E
TRYCVD
Q
N
L
L
--
K
--
E
Y
F
--
P
V
Q
V
V
T
H
G
L
L
------------
G
I
Y
Q
E
L
L
G
L
A
F
H
H
-----------
E
EGASAWHED
V
---------
R
----------
L
Y
T
A
R
DAASGEV
V
G
K
-
F
--------
Y
-----------
L
D
--
L
Y
P
R
E
G
K
Y
G
H
A
A
C
F
G
-
L
-
Q
---
P
-
G
C
L
R
QDG
S
R
Q
I
A
I
-----------
A
--
A
M
V
A
N
F
T
--
K
---------
P
TADA
P
S
L
L
Q
H
D
E
V
R
T
Y
F
H
E
F
G
H
V
M
H
Q
L
C
S
Q
A
E
F
A
M
--
F
----
S
-
G
T
-
H
V
E
T
D
-
F
V
E
A
P
S
Q
M
L
E
N
W
---
V
--
W
-
E
-
Q
E
---------
P
L
L
R
M
S
R
H
--------
Y
R
T
----
G
----
S
A
V
-
P
R
--
E
L
L
E
-------
K
L
I
-----------
E
-----------
S
R
QAN
T
G
L
F
N
L
R
Q
I
V
L
A
--
K
V
D
Q
A
L
H
-
T
Q
T
D
-------
A
D
P
A
E
E
Y
A
R
L
C
Q
E
I
L
G
V
P
A
-
T
---------
P
G
T
N
--
M
--
P
A
T
F
G
H
L
A
GG
Y
D
-
A
Q
Y
Y
G
Y
L
W
--
S
E
V
Y
S
M
D
M
F
H
T
R
F
K
-
Q
--------------
E
---
G
VLN---------
S
K
V
G
M
D
Y
R
S
C
I
L
R
P
G
G
S
-------
E
D
A
S
A
M
L
R
R
F
L
G
R
---
D
P
K
Q
D
A
F
L
L
S
K
G
L
----------------------
26
HHSearch
56.17
15%
-40
* C3 *
2O3E
1
NEUL_RAT
A:
[59-675]
----------------------------------------------------------
E
V
T
Y
E
N
C
L
Q
V
L
A
D
I
E
V
T
Y
I
V
E
R
T
M
L
D
------
F
P
Q
H
V
-
S
S
D
R
E
V
R
A
--------------
A
S
T
E
A
D
K
K
-----
L
-----
S
R
F
D
I
E
M
-
S
M
R
E
--------
D
V
F
Q
R
I
V
H
L
Q
E
T
C
D
L
E
K
I
K
-
P
--
E
A
R
----
R
-
Y
L
E
K
S
I
K
M
G
K
R
N
G
L
H
-
L
S
E
H
I
R
N
E
I
K
S
M
K
K
--
R
M
-------
S
E
L
C
I
D
F
N
K
N
L
N
E
D
D
---
T
S
L
V
F
S
K
A
ELGALP
D
D
F
I
D
S
L
E
K
T
D
-
E
D
K
Y
K
V
T
L
K
Y
P
H
Y
F
P
V
M
K
K
-
C
C
V
P
E
T
R
------
R
K
M
E
M
A
F
H
T
----
R
------
C
K
Q
E
N
T
----
A
I
L
Q
Q
L
L
P
---
L
R
A
Q
V
A
K
L
-----
L
G
Y
----------
N
-
T
------
H
-
A
D
F
V
L
---------
E
---
L
----
N
--
T
A
K-------
S
-
T
S
R
V
A
A
F
L
D
D
L
---
S
Q
K
L
K
P
-
L
G
E
A
E
R
E
F
I
---
L
----
S
L
-
K
K
K
---
E
C
---------------
E
E
R
GFEY
D
G
--------
K
I
N
A
W
D
------
L
H
Y
Y
-
M
T
-------
Q
T
E
E
L
K
YSVD
Q
--
E
S
L
K
--
E
Y
F
--
P
I
E
V
V
T
E
G
L
L
------------
S
I
Y
Q
E
L
L
G
L
S
F
E
Q
-----------
V
---------
P
DAHVWNKS
V
S
L
Y
T
V
K
DKATG
E
V
----------
L
G
Q
-
F
--------
Y
-----------
L
D
--
L
Y
P
R
E
G
K
Y
N
H
A
A
C
F
G
-
L
-
Q
---
P
-
G
CL---------
L
PDGSRM
M
----
S
V
A
A
L
V
V
N
F
S
--
Q
PVAGR
P
S
L
L
R
---------
H
D
E
V
E
T
Y
F
H
E
F
G
H
V
M
H
Q
I
C
A
Q
T
D
F
A
R
--
F
----
S
-
G
T
-
N
V
E
R
D
-
F
V
E
V
P
S
Q
M
L
E
N
W
---
V
--
W
-
D
-
V
D
S
L
R
K
-----
L
S
K
----
H
--------
Y
K
D
----
G
------
H
-
P
I
T
D
E
L
L
E
-------
K
L
V
-----------
A
S
RLVN------
T
G
----
L
-
L
T
L
R
Q
I
V
L
S
--
K
V
D
Q
S
L
H
-
T
N
A
T
-------
L
D
A
A
S
E
Y
A
K
Y
C
T
E
I
L
G
V
A
A
-
T
---------
P
G
T
N
--
M
--
P
A
T
F
G
H
L
A
GG
Y
D
-
G
Q
Y
Y
G
Y
L
W
--
S
E
V
F
S
M
D
M
F
H
S
-
C
F
K
K
--------------
E
GIM
N
------------
P
E
V
G
M
K
Y
R
N
L
I
L
K
P
G
G
S
-------
L
D
G
M
D
M
L
Q
N
F
L
Q
R
---
E
P
N
Q
K
A
F
L
M
S
R
G
L
----------------------
29
HHSearch
52.84
14%
-44
- C3 -
3HQ2
9
CBP1_BACSU
A:
[98-496]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
P
E
A
E
Y
K
E
Y
-
V
I
---
L
C
S
K
A
------
E
T
A
W
E
E
A
K
G
----
K
------
S
---
D
F
S
L
F
S
P
Y
L
E
Q
L
I
E
---
F
N
K
R
F
I
T
Y
-----
W
G
Y
----------
Q
-
E
------
H
P
Y
D
A
L
L
---------
D
---
L
F
E--
P
--
G
V
--------
T
-
V
K
V
L
D
Q
L
F
A
E
L
---
K
E
A
I
-
I
P
L
----
V
K
Q
V
---
T
----
A
S
-
G
N
K
--------------------
P
---------------------
D
------
T
S
-
F
-
I
------------------------
T
--
K
A
F
--
P
K
E
K
Q
K
E
L
S
L
------------
Y
F
L
-
Q
E
L
G
Y
D
F
D
G
-------------------------------------------------------------------------------------
G
R
L
D
E
T
V
H
P
F
A
T
T
-
L
-
N
---
R
-
G
-----------
D
-----------
V
--
R
V
T
T
R
Y
D
--
E
---------
K
DF-------
R
T
A
I
F
G
T
I
H
E
C
G
H
A
I
Y
E
Q
N
I
D
-
E
A
L
S
GT
N
----
L
-
S
D
-
G
A
S
M
G
-
I
H
E
S
Q
S
L
F
Y
E
N
F
---
I
--
G
R
N
-
K
H---------
F
W
T
PY
Y
K
K
--------
I
Q
E
A
S
--
P
VQFK
D
-
I
-
S
L
--
D
D
F
V
-------
R
A
I
N
E
S
K
P
S
FIRVE
A
-----------
D
E
----
L
T
Y
P
L
H
I
I
I
R
Y
--
E
I
E
K
A
I
F
-
S
----
N
-
E
V
S
V
E
D
L
P
S
L
W
N
Q
K
Y
Q
D
Y
L
G
I
T
P
-
Q
---------
T
D
A
E
--
G
--
I
L
Q
D
V
H
W
A
GG
D
F
-
G
Y
F
P
S
Y
A
L
--
G
Y
M
Y
A
A
Q
L
K
Q
K
-
M
L
-
E
--------------
D
---
L
P
E
F
D
A
L
L
E
R
GEF
H
P
I
K
Q
W
L
T
E
K
V
H
I
H
G
K
R
-------
K
K
P
L
D
I
I
K
D
A
T
G
E
---
E
L
N
V
R
Y
L
I
D
Y
L
S
N
K
Y
S
N
L
Y
L
---------------
32
HHSearch
49.88
14%
-51
- C3 -
3HOA
-
CBP1_THET8
A:
[116-504]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
S
F
W
E
E
A
R
P
----
R
------
D
---
D
W
R
G
F
L
P
Y
L
K
R
V
Y
A
---
L
T
K
E
K
A
E
V
-----
L
F
A
LPPAPGDPPY
G
-
E
------
L
-
Y
D
A
L
L
---------
D
G
Y
-
E
----
P
--
G
M
--------
R
-
A
R
E
L
L
P
L
F
A
E
L
---
K
E
G
L
-
K
G
L
----
L
D
R
I
---
L
----
G
S
-
G
K
R
----------------------------------------
P
D
--------
T
S
I
-
L
H
--------------------------
R
P
Y
--
P
V
E
A
Q
R
R
F
A
L
------------
E
L
L
-
S
A
C
G
Y
D
L
E
A
-------------------------------------------------------------------------------------
G
R
L
D
P
T
A
H
P
F
E
I
A
-
I
-
G
---
P
-
G
-----------
D
-----------
V
--
R
I
T
T
R
Y
Y
ED
F
---------
F
---------
N
A
G
I
F
G
T
L
H
E
M
G
H
A
L
Y
E
Q
G
L
P
-
K
E
H
W
--
G
TP--
R
-
G
D
-
A
V
S
L
G
-
V
H
E
S
Q
S
R
T
W
E
N
L
---
V
--
G
-
R
-
S
L
G
F
W
E
R
F
F
P
R
A
R
E
----
V
--------
F
A
S
LGDV
S
----
L
-
E
-
D
F
H
-
F
A
V
N
A
V
E
P
S
LI
R
V
E
-----------
A
-----------
D
E
----
V
T
Y
N
L
H
I
L
V
R
L
--
E
L
E
L
A
L
F
-
R
----
G
-
E
L
S
P
E
D
L
P
E
A
W
A
E
K
Y
R
D
H
L
G
V
A
P
-
K
---------
D
Y
K
D
--
G
--
V
M
Q
D
V
H
W
A
GG
L
F
-
G
Y
F
P
T
Y
T
L
--
G
N
L
Y
A
A
Q
F
F
Q
K
-
A
E
-
A
--------------
E
---
L
GPL
E
P
R
F
A
R
GEF
Q
P
F
L
D
W
T
R
A
R
I
H
A
E
G
S
R
-------
F
R
P
R
V
L
V
E
R
V
T
G
E
---
A
P
S
A
R
P
F
L
A
Y
L
E
K
K
Y
A
A
L
Y
----------------
52
Fugue
46.04
16%
-29
- C2 -
4M59
3
?
A:
[6-714]
PD
A
Q
V
L
V
L
A
I
S
S
H
P
L
P
T
L
A
A
F
L
A
S
--
R
R
D
E
L
L
R
A
D
I
T
S
L
L
K
A
L
E
----
L
S
G
H
---
W
E
W
A
L
A
L
L
R
W
A
G
K
E
G
A
A
D
A
S
A
L
E
M
V
V
R
A
L
------
G
R
E
G
Q
H
D
A
V
C
A
L
L
D
ETPLPPG
S
R
L
D
V
R
A
Y
T
T
V
L
H
A
L
S
R
A
GR
Y
-----
E
R
A
L
E
L
F
-
A
E
L
R
--------
R
Q
G
V
A
P
---
T
L
V
T
Y
N
V
V
L
D
V
Y
--
G
R
M
GRS
W
P
-
R
I
V
A
L
L
D
E
M
R
A
A
G
V
E
P
D
G
F
T
A
S
T
V
I
A
A
C
S
R
D
G
L
V
-------
D
E
A
V
A
F
F
E
D
L
K
A
R
G
H
---
A
---
P
S
V
V
--------------
T
-
Y
-
N
A
L
L
Q
V
F
G
K
A
G
N
Y
T
E
A
-
L
R
-
V
L
G
E
M
E
Q
N
G
C
Q
P
D
A
V
T
Y
N
E
L
A
G
----
T
E
E
A
A
R
C
L
D
-
T
M
A
S
P
N
A
F
T
Y
N
T
V
M
T
---
A
Y
G
N
V
G
K
V
-----
D
E
A
----------
L
-
A
------
L
-
F
D
Q
M
K
---------
K
---
T
----
G
--
F
V
--------
P
N
V
N
T
Y
N
L
V
L
G
M
L
G
K
K
S
R
F
T
-
V
-
M
----
L
E
M
L
---
G
----
E
M
-
S
R
S
---
G
C
---------------
T
------
P
N
--------
R
V
T
W
N
T
------
M
L
A
V
-
S
G
-------
K
------------
R
--
G
--
M
E
D
--
Y
V
T
R
V
L
E
G
M
R
S
S
G
V
E
L
S
R
D
T
Y
N
T
L
I
-
A
A
Y
G
R
C
G
S
R
-----------
T
---------
N
---------
A
----------
F
K
----------
M
Y
N
-
E
--------
M
T
S
A
G
F
T
P
C
I
T
T
Y
N
--
A
L
L
N
V
L
S
R
Q
G
D
W
S
T
A
-
Q
-
S
---
I
-
V
-----------
S
-----------
K
--
M
R
T
K
G
F
K
P
N
E
---------
Q
---------
S
Y
S
L
L
L
Q
C
Y
A
K
G
G
N
V
A
G
I
A
A
I
-
E
N
E
V
--
Y
GSGA
V
-
F
P
-
S
W
V
I
L
-
R
T
L
V
I
A
N
F
K
C
R
R
---
L
D
G
M
-
E
-
T
----------
A
F
Q
----
E
--------
V
K
A
----
R
G
Y
--
N
-
P
-
D
L
--
V
I
F
N
-------
S
M
L
-----------
S
-----------
I
Y
----
A
K
N
-
G
M
Y
S
K
A
T
--
E
V
F
D
S
I
K
-
R
S
G
L
S
P
D
L
I
T
Y
N
S
L
M
D
M
Y
A
K
C
S
E
S
-
W
E
A
E
K
-
I
--
L
-
N
-
Q
--
L
K
C
S
--
Q
--
T
M
K
P
D
V
V
S
--
Y
N
-
T
V
I
N
G
F
C
K
QG
L
V
K
E
A
Q
R
V
L
S
E
-
M
V
A
D
--------------
G
---
M
------------
A
P
C
A
V
T
Y
H
-
T
L
V
G
G
Y
S
S
LEMF
S
E
A
R
E
V
I
G
Y
M
-
V
Q
H
G
L
KPM
E
L
T
Y
R
R
V
V
E
S
Y
C
R
A
F
E
E
A
R
G
F
L
S
E
V
K
A
L
E
A
Y
I
E
D
A
3
PsiBlast_PDB
45.85
22%
-31
- C3 -
3AHN
3
?
A:
[156-391]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
R
T
L
A
Q
L
Q
P
F
-
V
E
-
S
P
D
R
D
M
R
------
K
R
A
S
E
A
R
F
T
----
F
------
F
Q
-
E
H
E
E
K
F
D
E
I
Y
D
Q
L
V
K
---
V
R
T
A
I
A
Q
K
-----
L
G
F
----------
K
-
N
F
V
E
L
G
Y
A
-
R
L
G
R
T
---------
D
---
Y
----
N
--------------
A
E
M
V
A
K
F
R
K
Q
V
---
E
K
H
I
V
P
-
I
----
A
V
K
L
---
R
----
E
R
-
Q
R
E
---
R
I
---------------
G
------
V
E
--------
K
L
K
Y
Y
D
EAFVFP
T
G
N
P
-
M
P
-------
K
------------
G
--
D
--
A
N
W
--
I
I
E
N
G
K
K
M
Y
E
------------
E
L
S
-
P
E
T
G
E
F
F
R
Y
-----------
M
---------
I
---------
E
----------
H
E
----------
L
------------------------
M
D
--
L
V
A
K
K
G
K
A
S
G
G
Y
C
---
T
-
Y
---
I
-
E
-----------
N
YK
A
--------
P
--
F
I
F
S
N
F
T
--
G
---------
T
---------
S
G
D
I
D
V
L
T
H
E
A
G
H
A
F
Q
V
Y
E
S
R
-
H
Y
E
I
--
P
----
E
-
Y
N
-
W
P
T
L
E
-
A
C
E
I
H
S
M
S
M
E
F
F
---
T
--
W
-
P
-
W
----------
M
K
L
----
F
--------
F
K
E
----
D
----
A
-
E
-
K
Y
--
Q
F
Y
H
-------
L
S
D
-----------
A
-----------
L
L
----
F
L
P
Y
G
V
A
V
D
E
F
--
Q
H
F
V
Y
E
N
-
P
N
A
T
P
A
E
R
K
Q
A
W
R
A
I
E
R
K
Y
M
P
T
K
D
Y
D
G
N
D
Y
-
L
--
E
-
R
-
G
--
G
F
W
Q
--
R
--
Q
S
H
I
Y
T
T
A
--
F
Y
-
Y
I
D
Y
T
L
A
Q
--
I
C
A
F
Q
F
W
K
R
S
R
-
E
N
-
Y
--------------
K
---
E
------------
A
W
N
D
Y
L
T
L
-
C
R
Q
G
G
S
K
P
-------
F
T
E
L
V
R
V
-
A
N
L
I
S
---
P
F
E
D
G
C
V
Q
S
V
V
G
G
I
E
G
W
L
N
S
V
D
D
Q
S
L
---------
4
PsiBlast_PDB
45.62
22%
-32
- C3 -
3AHO
4
?
A:
[156-391]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
R
T
L
A
Q
L
Q
P
F
-
V
E
-
S
P
D
R
D
M
R
------
K
R
A
S
E
A
R
F
T
----
F
------
F
Q
-
E
H
E
E
K
F
D
E
I
Y
D
Q
L
V
K
---
V
R
T
A
I
A
Q
K
-----
L
G
F
----------
K
-
N
F
V
E
L
G
Y
A
-
R
L
G
R
T
---------
D
---
Y
----
N
--------------
A
E
M
V
A
K
F
R
K
Q
V
---
E
K
H
I
V
P
-
I
----
A
V
K
L
---
R
----
E
R
-
Q
R
E
---
R
I
---------------
G
------
V
E
--------
K
L
K
Y
Y
D
EAFVFP
T
G
N
P
-
M
P
-------
K
------------
G
--
D
--
A
N
W
--
I
I
E
N
G
K
K
M
Y
E
------------
E
L
S
-
P
E
T
G
E
F
F
R
Y
-----------
M
---------
I
---------
E
----------
H
E
----------
L
------------------------
M
D
--
L
V
A
K
K
G
K
A
S
G
G
Y
C
---
T
-
Y
---
I
-
E
-----------
N
YK
A
--------
P
--
F
I
F
S
N
F
T
--
G
---------
T
---------
S
G
D
I
D
V
L
T
H
E
A
G
H
A
F
Q
V
Y
E
S
R
-
H
Y
E
I
--
P
----
E
-
Y
N
-
W
P
T
L
E
-
A
C
E
I
H
S
M
S
M
E
F
F
---
T
--
W
-
P
-
W
----------
M
K
L
----
F
--------
F
K
E
----
D
----
A
-
E
-
K
Y
--
Q
F
Y
H
-------
L
S
D
-----------
A
-----------
L
L
----
F
L
P
Y
G
V
A
V
D
E
F
--
Q
H
F
V
Y
E
N
-
P
N
A
T
P
A
E
R
K
Q
A
W
R
A
I
E
R
K
Y
M
P
T
K
D
Y
D
G
N
D
Y
-
L
--
E
-
R
-
G
--
G
F
W
Q
--
R
--
Q
S
H
I
Y
T
T
A
--
F
Y
-
Y
I
D
Y
T
L
A
Q
--
I
C
A
F
Q
F
W
K
R
S
R
-
E
N
-
Y
--------------
K
---
E
------------
A
W
N
D
Y
L
T
L
-
C
R
Q
G
G
S
K
P
-------
F
T
E
L
V
R
V
-
A
N
L
I
S
---
P
F
E
D
G
C
V
Q
S
V
V
G
G
I
E
G
W
L
N
S
V
D
D
Q
S
L
---------
2
PsiBlast_PDB
45.60
22%
-30
- C3 -
3AHM
1
?
A:
[156-391]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
R
T
L
A
Q
L
Q
P
F
-
V
E
-
S
P
D
R
D
M
R
------
K
R
A
S
E
A
R
F
T
----
F
------
F
Q
-
E
H
E
E
K
F
D
E
I
Y
D
Q
L
V
K
---
V
R
T
A
I
A
Q
K
-----
L
G
F
----------
K
-
N
F
V
E
L
G
Y
A
-
R
L
G
R
T
---------
D
---
Y
----
N
--------------
A
E
M
V
A
K
F
R
K
Q
V
---
E
K
H
I
V
P
-
I
----
A
V
K
L
---
R
----
E
R
-
Q
R
E
---
R
I
---------------
G
------
V
E
--------
K
L
K
Y
Y
D
EAFVFP
T
G
N
P
-
M
P
-------
K
------------
G
--
D
--
A
N
W
--
I
I
E
N
G
K
K
M
Y
E
------------
E
L
S
-
P
E
T
G
E
F
F
R
Y
-----------
M
---------
I
---------
E
----------
H
E
----------
L
------------------------
M
D
--
L
V
A
K
K
G
K
A
S
G
G
Y
C
---
T
-
Y
---
I
-
E
-----------
N
YK
A
--------
P
--
F
I
F
S
N
F
T
--
G
---------
T
---------
S
G
D
I
D
V
L
T
H
E
A
G
H
A
F
Q
V
Y
E
S
R
-
H
Y
E
I
--
P
----
E
-
Y
N
-
W
P
T
L
E
-
A
C
E
I
H
S
M
S
M
E
F
F
---
T
--
W
-
P
-
W
----------
M
K
L
----
F
--------
F
K
E
----
D
----
A
-
E
-
K
Y
--
Q
F
Y
H
-------
L
S
D
-----------
A
-----------
L
L
----
F
L
P
Y
G
V
A
V
D
E
F
--
Q
H
F
V
Y
E
N
-
P
N
A
T
P
A
E
R
K
Q
A
W
R
A
I
E
R
K
Y
M
P
T
K
D
Y
D
G
N
D
Y
-
L
--
E
-
R
-
G
--
G
F
W
Q
--
R
--
Q
S
H
I
Y
T
T
A
--
F
Y
-
Y
I
D
Y
T
L
A
Q
--
I
C
A
F
Q
F
W
K
R
S
R
-
E
N
-
Y
--------------
K
---
E
------------
A
W
N
D
Y
L
T
L
-
C
R
Q
G
G
S
K
P
-------
F
T
E
L
V
R
V
-
A
N
L
I
S
---
P
F
E
D
G
C
V
Q
S
V
V
G
G
I
E
G
W
L
N
S
V
D
D
Q
S
L
---------