@TOME V2.3
(Mar 2018)
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 : spr0715: (2017-12-28 )
MTEEIKNLQAQDYDASQIQVLEGLEAVRMRPGMYIGSTSKEGLHHLVWEIVDNSIDEALAGFASHIQVFIEPDDSITVVDDGRGIPVDIQEKTGRPAVETVFTVLHAGGKFGGGGYKVSGGLHGVGSSVVNALSTQLDVHVHKNGKIHYQEYRRGHVVADLEIVGDTDKTGTTVHFTPDPKIFTETTIFDFDKLNKRIQELAFLNRGLQISITDKRQGLEQTKHYHYEGGIASYVEYINENKDVIFDTPIYTDGEMDDITVEVAMQYTTGYHENVMSFANNIHTHEGGTHEQGFRTALTRVINDYARKNKLLKDNEDNLTGEDVREGLTAVISVKHPNPQFEGQTKTKLGNSEVVKITNRLFSEAFSDFLMENPQIAKRIVEKGILAAKARVAAKRAREVTRKKSGLEISNLPGKLADCSSNNPAETELFIVEGDSAGGSAKSGRNREFQAILPIRGKILNVEKASMDKILANEEIRSLFTAMGTGFGAEFDVSKARYQKLVLMTDADVDGAHIRTLLLTLIYRYMKPILEAGYVYIAQPPIYGVKVGSEIKEYIQPGADQEIKLQEALARYSEGRTKPTIQRYKGLGEMDDHQLWETTMDPEHRLMARVSVDDAAEADKIFDMLMGDRVEPRREFIEENAVYSTLDV
Atome Classification :
(47 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.......610.......620.......630.......640......
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
M
T
E
E
I
K
N
LQAQDY
D
A
S
Q
I
-
Q
V
L
E
G
L
E
A
V
RMRP
G
M
Y
IGSTS-
K
-
E
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
F
A
--
S
H
I
Q
V
F
IEPD-D
S
I
T
V
V
DDGRG
I
P
V
D
IQEKTGR
P
A
V
E
T
V
F
T
V
L
HAGGKFGGG
G
Y
K
VSG-------GLH
G
V
G
S
S
V
V
N
A
L
ST
Q
L
D
V
H
V
HKN
G
K
I
H
Y
Q
E
YRR--G-
H
V
V
A
D
L
E
I
V
G--D--T--D--KT
G
T
T
V
H
FT-------PDP
K
I
F
T
E
TTIF
D
F
D
K
L
N
K
R
I
Q
E
L
A
F
LNRG
L
Q
I
S
I
T
D
K
R-----Q
G
L
------
E
-
Q
T-------
K
H
Y
HYEG
G
I
A
S
Y
V
E
Y
I
NENK
D
V
I
F
DTPI-YTDGEMD
D
I
T
V
E
V
A
M
Q
YTTG
Y
-
H
E
N
V
M
S
F
A
NNIHTHEGG
T
H
E
Q
G
F
R
T
A
L
T
R
V
I
N
D
Y
A
R
KNKLLKDNEDNL
T
G
E
D
V
R
E
G
L
T
A
V
I
SVKHPNP--QFEGQTKTKLGN
S
E
V
V
K
I
T
N
R
L
F
S
E
A
F
S
D
F
L
ME
N
P
Q
I
A
K
R
I
V
EK
G
I
L
A
A
K
A
R
V
A
A
K
R
A
R
E
V
T
R
KKSGLEISNLPGKLADCSSNNPA
E
T
E
L
F
I
V
EGDSAGGSAKSGRNR
E
F
Q
A
I
LPIR
G
K
I
L
NV
E
K
A
S
M
D
K
I
L
A
N
E
E
I
R
S
L
F
T
A
MGTGFGA-EFDV
S
K
A
R
Y
Q
K
L
V
L
M
TDADVD
G
A
H
I
R
T
L
L
L
T
L
I
Y
R
Y
M
K
P
I
L
EA
G
Y
V
Y
IAQPPI
Y
G
V
K
V
G
S
E
I
K
E
Y
IQPGAD
Q
E
I
K
L
Q
E
A
L
A
--------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
Y
SEGRTK
P
T
I
Q
R
Y
KGLGEMD
D
H
Q
L
W
E
TTMDP
E
H
R
L
M
A
R
VSVDDA
A
E
A
D
K
I
F
D
M
L
MGDR
V
E
P
R
R
E
F
I
E
ENAVYSTLDV
1
PsiBlast_PDB
100.00
49%
0
- C- -
-
4I3H
2
?
A:
[24-648]
--------------------------
A
V
R
K
R
P
G
M
Y
I
G
S
T
D
-
G
-
A
G
L
H
H
L
V
W
E
I
V
D
N
A
V
D
E
A
L
S
-----
D
R
I
D
V
T
I
N
K
D
-
G
S
L
T
V
Q
D
H
---------------
T
V
E
V
I
F
T
I
L
H
A
G
G
K
F
-----------------
L
H
G
V
G
S
S
V
V
N
A
L
S
S
W
L
E
V
E
I
T
R
D
G
A
V
Y
K
Q
R
F
E
N
--
G
G
K
P
V
T
T
L
K
K
I
G
--
T
--
A
PK
S
--
K
T
G
T
K
V
T
F
M
-------
P
D
A
T
I
F
S
-
T
T
D
F
K
Y
N
T
I
S
E
R
L
N
E
S
A
F
L
L
K
N
V
T
L
S
L
T
D
K
R
-----
T
--------
D
-
E
A
-------
I
E
F
H
Y
E
N
G
V
Q
D
F
V
S
Y
L
N
E
D
K
E
I
L
--
T
P
V
L
Y
F
E
G
E
D
N
G
F
Q
V
E
V
A
L
Q
Y
N
D
G
F
-
S
D
N
I
L
S
F
V
N
N
V
R
T
K
D
G
G
T
H
E
T
G
L
K
S
A
I
T
K
V
M
N
D
Y
A
R
K
T
G
L
L
K
E
K
----
E
G
S
D
Y
R
E
G
L
A
A
V
L
S
I
L
V
P
E
E
H
L
Q
F
E
G
Q
T
K
D
K
L
G
S
P
L
A
R
P
V
V
D
G
I
V
A
D
K
L
T
F
F
L
M
E
N
G
E
L
A
S
N
L
I
R
K
A
I
K
A
R
D
A
R
E
A
A
R
K
A
R
---------------
G
K
L
T
P
A
Q
S
K
N
P
A
K
N
E
L
Y
L
V
E
G
D
S
A
G
G
S
A
K
Q
G
R
D
R
K
F
Q
A
I
L
P
L
R
G
K
V
I
N
T
A
K
A
K
M
A
D
I
L
K
N
E
E
I
N
T
M
I
Y
T
I
G
A
G
V
G
A
-
D
F
S
I
E
D
A
N
Y
D
K
I
I
I
M
T
D
A
D
T
D
G
A
H
I
Q
T
L
L
L
T
F
F
Y
R
Y
M
R
P
L
V
E
A
G
H
V
Y
I
A
L
P
P
L
Y
K
M
S
K
G
-------
A
Y
-
A
W
-
D
G
E
L
E
E
L
R
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
Q
R
Y
K
G
L
G
E
M
N
A
D
Q
L
W
E
T
T
M
N
P
E
T
R
T
L
I
R
V
T
I
E
D
L
A
R
A
E
R
R
V
N
V
L
M
G
D
K
V
E
P
R
R
K
W
I
E
D
N
V
K
F
T
----
2
PsiBlast_PDB
78.01
49%
22
- C1 -
-
4JUO
1
PARE_STRPN
C:
[47-663]
--------------------------
A
V
R
K
R
P
G
M
Y
I
G
S
T
D
-
G
-
A
G
L
H
H
L
V
W
E
I
V
D
N
A
V
D
E
A
L
S
-----
D
R
I
D
V
T
I
N
K
D
-
G
S
L
T
V
Q
D
H
---------------
T
V
E
V
I
F
T
I
L
H
A
G
G
K
F
-----------------
L
H
G
V
G
S
S
V
V
N
A
L
S
S
W
L
E
V
E
I
T
R
D
G
A
V
Y
K
Q
R
F
E
N
--
G
G
K
P
V
T
T
L
K
K
I
G
--
T
--
A
PK
S
--
K
T
G
T
K
V
T
F
M
-------
P
D
A
T
I
F
S
-
T
T
D
F
K
Y
N
T
I
S
E
R
L
N
E
S
A
F
L
L
K
N
V
T
L
S
L
T
D
K
R
-----
T
--------
D
-
E
A
-------
I
E
F
H
Y
E
--
V
Q
D
F
V
S
Y
L
N
E
D
K
E
I
L
--
T
P
V
L
Y
F
E
G
E
D
N
G
F
Q
V
E
V
A
L
Q
Y
N
D
G
F
-
S
D
N
I
L
S
F
V
N
N
V
R
T
K
D
G
G
T
H
E
T
G
L
K
S
A
I
T
K
V
M
N
D
Y
A
R
K
T
G
L
L
K
E
K
----
E
G
S
D
Y
R
E
G
L
A
A
V
L
S
I
L
V
P
E
E
HL
Q
F
E
G
Q
T
K
D
K
L
G
S
P
L
A
R
P
V
V
D
G
I
V
A
D
K
L
T
F
F
L
M
E
N
G
E
L
A
S
N
L
I
R
K
A
I
K
A
R
D
A
R
E
A
A
R
K
A
R
-----------------
L
T
P
A
Q
S
K
N
P
A
K
N
E
L
Y
L
V
E
G
D
S
A
G
G
S
A
K
Q
G
R
D
R
K
F
Q
A
I
L
P
L
R
G
K
V
I
N
T
A
K
A
K
M
A
D
I
L
K
N
E
E
I
N
T
M
I
Y
T
I
G
A
G
V
G
A
-
D
F
S
I
E
D
A
N
Y
D
K
I
I
I
M
T
D
A
D
T
D
G
A
H
I
Q
T
L
L
L
T
F
F
Y
R
Y
M
R
P
L
V
E
A
G
H
V
Y
I
A
-
P
P
L
Y
K
-----------
A
Y
-
A
W
T
D
G
E
L
E
E
L
R
K
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
Q
R
Y
K
G
L
G
E
M
N
A
D
Q
L
W
E
T
T
M
N
P
E
T
R
T
L
I
R
V
T
I
E
D
L
A
R
A
E
R
R
V
N
V
L
M
G
D
K
V
E
P
R
R
K
W
I
E
D
N
V
K
F
T
----
135
HHSearch
67.68
51%
-69
* C2 *
-
3ZKB
-
GYRB_MYCTU
H:
[17-427]
------------
Y
G
A
A
S
I
-
T
I
L
E
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
G
-
E
-
R
G
L
H
H
L
I
W
E
V
V
D
N
A
V
D
E
A
M
A
G
Y
A
--
T
T
V
N
V
V
L
L
E
D
-
G
G
V
E
V
A
D
D
G
R
G
I
P
V
A
T
H
A
-
S
G
I
P
T
V
D
V
V
M
T
Q
L
H
A
G
G
K
F
D
S
D
A
Y
A
I
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
T
R
L
E
V
E
I
K
R
D
G
Y
E
W
S
Q
V
Y
E
K
--
S
-
E
P
L
G
-
L
K
Q
G
A
--
P
--
T
--
K
--
K
T
G
S
T
V
R
F
W
-------
A
D
P
A
V
F
E
T
-
T
E
Y
D
F
E
T
V
A
R
R
L
Q
E
M
A
F
L
N
K
G
L
T
I
N
L
T
D
E
R
-----
V
--------
V
-
K
S
-------
R
T
F
H
Y
P
G
G
L
V
D
F
V
K
H
I
N
R
T
K
N
A
I
H
S
S
I
V
-
D
F
S
G
K
G
T
G
H
E
V
E
I
A
M
Q
W
N
A
G
Y
-
S
E
S
V
H
T
F
A
N
T
I
N
T
H
E
G
G
T
H
E
E
G
F
R
S
A
L
T
S
V
V
N
K
Y
A
K
D
R
K
L
L
K
D
K
D
P
N
L
T
G
D
D
I
R
E
G
L
A
A
V
I
S
V
K
V
S
E
P
--
Q
F
E
G
Q
T
K
T
K
L
G
N
T
E
V
K
S
F
V
Q
K
V
C
N
E
Q
L
T
H
W
F
E
A
N
P
T
D
A
K
V
V
V
N
K
A
V
S
S
A
Q
A
R
I
A
A
R
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
31
PsiBlast_CBE
62.38
48%
-7
- C2 -
-
3ZKD
2
GYRB_MYCTU
C:
[17-426]
------------
Y
G
A
A
S
I
-
T
I
L
E
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
G
-
E
-
R
G
L
H
H
L
I
W
E
V
V
D
N
A
V
D
E
A
M
A
G
Y
A
--
T
T
V
N
V
V
L
L
E
D
-
G
G
V
E
V
A
D
D
G
R
G
I
P
V
A
T
H
-
A
S
G
I
P
T
V
D
V
V
M
T
Q
L
H
A
G
G
K
F
D
S
D
A
Y
A
I
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
T
R
L
E
V
E
I
K
R
D
G
Y
E
W
S
Q
V
Y
E
K
--
S
-
E
P
L
G
-
L
K
Q
G
A
--
P
--
T
--
K
--
K
T
G
S
T
V
R
F
W
-------
A
D
P
A
V
F
-
E
T
T
E
Y
D
F
E
T
V
A
R
R
L
Q
E
M
A
F
L
N
K
G
L
T
I
N
L
T
D
E
R
VTQDE
R
A
A
------
E
-
S
T
APHK
V
K
S
R
T
F
H
Y
P
G
G
L
V
D
F
V
K
H
I
N
R
T
K
N
A
I
H
S
S
I
V
-
D
F
S
G
K
G
T
G
H
E
V
E
I
A
M
Q
W
N
A
G
Y
-
S
E
S
V
H
T
F
A
N
T
I
N
T
H
E
G
G
T
H
E
E
G
F
R
S
A
L
T
S
V
V
N
K
Y
A
K
D
R
K
L
L
K
D
--
P
N
L
T
G
D
D
I
R
E
G
L
A
A
V
I
S
V
K
V
S
E
P
--
Q
F
E
G
Q
T
K
T
K
L
G
N
T
E
V
K
S
F
V
Q
K
V
C
N
E
Q
L
T
H
W
F
E
A
N
P
T
D
A
K
V
V
V
N
K
A
V
S
S
A
Q
A
R
I
A
A
R
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
144
HHSearch
62.03
48%
1
- C2 -
-
1KIJ
3
GYRB_THET8
B:
[7-388]
----------------
A
I
-
R
V
L
K
G
L
E
G
V
R
H
R
P
A
M
Y
I
G
G
T
G
-
V
-
E
G
Y
H
H
L
F
K
E
I
L
D
N
A
V
D
E
A
L
A
G
Y
A
--
T
E
I
L
V
R
L
N
E
D
-
G
S
L
T
V
E
D
N
G
R
G
I
P
V
D
L
M
P
E
E
G
K
P
A
V
E
V
I
Y
N
T
L
H
S
G
G
K
F
E
Q
G
A
Y
K
V
S
G
-------
G
L
H
G
V
G
A
S
V
V
N
A
L
S
E
W
T
V
V
E
V
F
R
E
G
K
H
H
R
I
A
F
S
R
--
G
-
E
V
T
E
P
L
R
V
V
G
EA
P
--
R
--
G
--
K
T
G
T
R
V
T
F
K
-------
P
D
P
E
I
F
G
N
-
L
R
F
D
P
S
K
I
R
A
R
L
R
E
V
A
Y
L
V
A
G
L
K
L
V
F
Q
D
R
Q
-----
H
G
---------
K
E
-------
E
V
F
L
D
K
G
G
V
A
S
F
A
K
A
L
A
E
G
E
D
L
L
Y
E
K
P
F
-
L
I
R
G
T
H
G
E
V
E
V
E
V
G
F
L
H
T
Q
G
Y
-
N
A
E
I
L
T
Y
A
N
M
I
P
T
R
D
G
G
T
H
L
T
A
F
K
S
A
Y
S
R
A
L
N
Q
Y
A
K
K
A
G
L
N
K
E
K
G
P
Q
P
T
G
D
D
L
L
E
G
L
Y
A
V
V
S
V
K
L
P
N
P
--
Q
F
E
G
Q
T
K
G
K
L
L
N
P
E
A
G
T
A
V
G
Q
V
V
Y
E
R
L
L
E
I
L
E
E
N
P
R
I
A
K
A
V
Y
E
K
A
L
R
A
A
Q
A
R
E
A
A
R
K
A
R
E
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
136
HHSearch
61.38
51%
-4
- C2 -
-
3ZKB
2
GYRB_MYCTU
D:
[12-427]
-------
K
A
Q
D
E
Y
G
A
A
S
I
-
T
I
L
E
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
G
-
E
-
R
G
L
H
H
L
I
W
E
V
V
D
N
A
V
D
E
A
M
A
G
Y
A
--
T
T
V
N
V
V
L
L
E
D
-
G
G
V
E
V
A
D
D
G
R
G
I
P
V
A
T
H
A
-
S
G
I
P
T
V
D
V
V
M
T
Q
L
H
A
G
G
K
F
D
S
D
A
Y
A
I
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
T
R
L
E
V
E
I
K
R
D
G
Y
E
W
S
Q
V
Y
E
K
--
S
-
E
P
L
G
-
L
K
Q
G
A
--
P
--
T
--
K
--
K
T
G
S
T
V
R
F
W
-------
A
D
P
A
V
F
E
T
-
T
E
Y
D
F
E
T
V
A
R
R
L
Q
E
M
A
F
L
N
K
G
L
T
I
N
L
T
D
E
R
-----
V
T
Q
STAPHK
V
-
K
S
-------
R
T
F
H
Y
P
G
G
L
V
D
F
V
K
H
I
N
R
T
K
N
A
I
H
S
S
I
V
-
D
F
S
G
K
G
T
G
H
E
V
E
I
A
M
Q
W
N
A
G
Y
-
S
E
S
V
H
T
F
A
N
T
I
N
T
H
E
G
G
T
H
E
E
G
F
R
S
A
L
T
S
V
V
N
K
Y
A
K
D
R
K
L
L
K
D
K
D
P
N
L
T
G
D
D
I
R
E
G
L
A
A
V
I
S
V
K
V
S
E
P
--
Q
F
E
G
Q
T
K
T
K
L
G
N
T
E
V
K
S
F
V
Q
K
V
C
N
E
Q
L
T
H
W
F
E
A
N
P
T
D
A
K
V
V
V
N
K
A
V
S
S
A
Q
A
R
I
A
A
R
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
47
PsiBlast_CBE
61.36
47%
-1
- C2 -
-
1KIJ
3
GYRB_THET8
B:
[7-372]
----------------
A
I
-
R
V
L
K
G
L
E
G
V
R
H
R
P
A
M
Y
I
G
G
T
G
-
V
-
E
G
Y
H
H
L
F
K
E
I
L
D
N
A
V
D
E
A
L
A
G
Y
A
--
T
E
I
L
V
R
L
N
E
D
-
G
S
L
T
V
E
D
N
G
R
G
I
P
V
D
L
M
P
E
E
G
K
P
A
V
E
V
I
Y
N
T
L
H
S
G
G
K
F
E
Q
G
A
Y
K
V
S
G
-------
G
L
H
G
V
G
A
S
V
V
N
A
L
S
E
W
T
V
V
E
V
F
R
E
G
K
H
H
R
I
A
F
S
R
--
G
-
E
V
T
E
P
L
R
V
V
G
--
E
--
A
--
P
RG
K
T
G
T
R
V
T
F
K
-------
P
D
P
E
I
F
G
N
L
R
-
F
D
P
S
K
I
R
A
R
L
R
E
V
A
Y
L
V
A
G
L
K
L
V
F
Q
D
R
Q
-----
H
G
K
------
E
-
E
V
---------
F
L
D
K
G
G
V
A
S
F
A
K
A
L
A
E
G
E
D
L
L
Y
E
K
P
F
-
L
I
R
G
T
H
G
E
V
E
V
E
V
G
F
L
H
T
Q
G
Y
-
N
A
E
I
L
T
Y
A
N
M
I
P
T
R
D
G
G
T
H
L
T
A
F
K
S
A
Y
S
R
A
L
N
Q
Y
A
K
K
A
G
L
N
K
E
K
G
P
Q
P
T
G
D
D
L
L
E
G
L
Y
A
V
V
S
V
K
L
P
N
P
--
Q
F
E
G
Q
T
K
G
K
L
L
N
P
E
A
G
T
A
V
G
Q
V
V
Y
E
R
L
L
E
I
L
E
E
N
P
R
I
A
K
A
V
Y
E
K
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
61.01
100%
-124
- C1 -
-
4Z2C
1
?
C:
[25-264]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
S
G
L
E
I
S
N
L
P
G
K
L
A
D
C
S
S
N
N
P
A
E
T
E
L
F
I
V
E
G
D
S
A
G
G
S
A
K
S
G
R
N
R
E
F
Q
A
I
L
P
I
R
G
K
I
L
N
V
E
K
A
S
M
D
K
I
L
A
N
E
E
I
R
S
L
F
T
A
M
G
T
G
F
G
A
-
E
F
D
V
S
K
A
R
Y
Q
K
L
V
L
M
T
D
A
D
V
D
G
A
H
I
R
T
L
L
L
T
L
I
Y
R
Y
M
K
P
I
L
E
A
G
Y
V
Y
I
A
Q
P
P
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
G
E
M
D
D
H
Q
L
W
E
T
T
M
D
P
E
H
R
L
M
A
R
V
S
V
D
D
A
A
E
A
D
K
I
F
D
M
L
M
G
D
R
V
E
P
R
R
E
F
I
E
E
N
A
V
Y
-----
29
PsiBlast_CBE
60.93
48%
-12
- C2 -
-
3ZKD
2
GYRB_MYCTU
E:
[17-427]
------------
Y
G
A
A
S
I
-
T
I
L
E
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
G
-
E
-
R
G
L
H
H
L
I
W
E
V
V
D
N
A
V
D
E
A
M
A
G
Y
A
--
T
T
V
N
V
V
L
L
E
D
-
G
G
V
E
V
A
D
D
G
R
G
I
P
V
A
T
H
-
A
S
G
I
P
T
V
D
V
V
M
T
Q
L
H
A
G
G
K
F
D
S
D
A
Y
A
I
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
T
R
L
E
V
E
I
K
R
D
G
Y
E
W
S
Q
V
Y
E
K
--
S
-
E
P
L
G
-
L
K
Q
G
A
--
P
--
T
--
K
--
K
T
G
S
T
V
R
F
W
-------
A
D
P
A
V
F
-
E
T
T
E
Y
D
F
E
T
V
A
R
R
L
Q
E
M
A
F
L
N
K
G
L
T
I
N
L
T
D
E
R
VTQ---------------PHKV
K
S
-
R
T
F
H
Y
P
G
G
L
V
D
F
V
K
H
I
N
R
T
K
N
A
I
H
S
S
I
V
-
D
F
S
G
K
G
T
G
H
E
V
E
I
A
M
Q
W
N
A
G
Y
-
S
E
S
V
H
T
F
A
N
T
I
N
T
H
E
G
G
T
H
E
E
G
F
R
S
A
L
T
S
V
V
N
K
Y
A
K
D
R
K
L
L
K
D
--
P
N
L
T
G
D
D
I
R
E
G
L
A
A
V
I
S
V
K
V
S
E
P
--
Q
F
E
G
Q
T
K
T
K
L
G
N
T
E
V
K
S
F
V
Q
K
V
C
N
E
Q
L
T
H
W
F
E
A
N
P
T
D
A
K
V
V
V
N
K
A
V
S
S
A
Q
A
R
I
A
A
R
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
60.90
48%
-6
- C2 -
-
3ZKD
2
GYRB_MYCTU
H:
[17-426]
------------
Y
G
A
A
S
I
-
T
I
L
E
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
G
-
E
-
R
G
L
H
H
L
I
W
E
V
V
D
N
A
V
D
E
A
M
A
G
Y
A
--
T
T
V
N
V
V
L
L
E
D
-
G
G
V
E
V
A
D
D
G
R
G
I
P
V
A
T
H
-
A
S
G
I
P
T
V
D
V
V
M
T
Q
L
H
A
G
G
K
F
D
S
D
A
Y
A
I
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
T
R
L
E
V
E
I
K
R
D
G
Y
E
W
S
Q
V
Y
E
K
--
S
-
E
P
L
G
-
L
K
Q
G
A
--
P
--
T
--
K
--
K
T
G
S
T
V
R
F
W
-------
A
D
P
A
V
F
-
E
T
T
E
Y
D
F
E
T
V
A
R
R
L
Q
E
M
A
F
L
N
K
G
L
T
I
N
L
T
D
E
R
VTQ---------------K
V
K
S
---
R
T
F
H
Y
P
G
G
L
V
D
F
V
K
H
I
N
R
T
K
N
A
I
H
S
S
I
V
-
D
F
S
G
K
G
T
G
H
E
V
E
I
A
M
Q
W
N
A
G
Y
-
S
E
S
V
H
T
F
A
N
T
I
N
T
H
E
G
G
T
H
E
E
G
F
R
S
A
L
T
S
V
V
N
K
Y
A
K
D
R
K
L
L
---
D
P
N
L
T
G
D
D
I
R
E
G
L
A
A
V
I
S
V
K
V
S
E
P
--
Q
F
E
G
Q
T
K
T
K
L
G
N
T
E
V
K
S
F
V
Q
K
V
C
N
E
Q
L
T
H
W
F
E
A
N
P
T
D
A
K
V
V
V
N
K
A
V
S
S
A
Q
A
R
I
A
A
R
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
60.69
100%
-124
- C1 -
-
4Z2D
1
?
C:
[25-264]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
S
G
L
E
I
S
N
L
P
G
K
L
A
D
C
S
S
N
N
P
A
E
T
E
L
F
I
V
E
G
D
S
A
G
G
S
A
K
S
G
R
N
R
E
F
Q
A
I
L
P
I
R
G
K
I
L
N
V
E
K
A
S
M
D
K
I
L
A
N
E
E
I
R
S
L
F
T
A
M
G
T
G
F
G
A
-
E
F
D
V
S
K
A
R
Y
Q
K
L
V
L
M
T
D
A
D
V
D
G
A
H
I
R
T
L
L
L
T
L
I
Y
R
Y
M
K
P
I
L
E
A
G
Y
V
Y
I
A
Q
P
P
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
G
E
M
D
D
H
Q
L
W
E
T
T
M
D
P
E
H
R
L
M
A
R
V
S
V
D
D
A
A
E
A
D
K
I
F
D
M
L
M
G
D
R
V
E
P
R
R
E
F
I
E
E
N
A
V
Y
-----
17
PsiBlast_PDB
60.60
47%
-0
- C2 -
-
1KIJ
3
GYRB_THET8
A:
[7-372]
----------------
A
I
-
R
V
L
K
G
L
E
G
V
R
H
R
P
A
M
Y
I
G
G
T
G
-
V
-
E
G
Y
H
H
L
F
K
E
I
L
D
N
A
V
D
E
A
L
A
G
Y
A
--
T
E
I
L
V
R
L
N
E
D
-
G
S
L
T
V
E
D
N
G
R
G
I
P
V
D
L
M
P
E
E
G
K
P
A
V
E
V
I
Y
N
T
L
H
S
G
G
K
F
E
Q
G
A
Y
K
V
S
G
-------
G
L
H
G
V
G
A
S
V
V
N
A
L
S
E
W
T
V
V
E
V
F
R
E
G
K
H
H
R
I
A
F
S
R
--
G
-
E
V
T
E
P
L
R
V
V
G
--
E
--
A
--
P
RG
K
T
G
T
R
V
T
F
K
-------
P
D
P
E
I
F
G
N
L
R
-
F
D
P
S
K
I
R
A
R
L
R
E
V
A
Y
L
V
A
G
L
K
L
V
F
Q
D
R
Q
-----
H
G
K
------
E
-
E
V
---------
F
L
D
K
G
G
V
A
S
F
A
K
A
L
A
E
G
E
D
L
L
Y
E
K
P
F
-
L
I
R
G
T
H
G
E
V
E
V
E
V
G
F
L
H
T
Q
G
Y
-
N
A
E
I
L
T
Y
A
N
M
I
P
T
R
D
G
G
T
H
L
T
A
F
K
S
A
Y
S
R
A
L
N
Q
Y
A
K
K
A
G
L
N
K
E
K
G
P
Q
P
T
G
D
D
L
L
E
G
L
Y
A
V
V
S
V
K
L
P
N
P
--
Q
F
E
G
Q
T
K
G
K
L
L
N
P
E
A
G
T
A
V
G
Q
V
V
Y
E
R
L
L
E
I
L
E
E
N
P
R
I
A
K
A
V
Y
E
K
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
60.51
48%
-11
- C2 -
-
3ZKD
2
GYRB_MYCTU
A:
[17-429]
------------
Y
G
A
A
S
I
-
T
I
L
E
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
G
-
E
-
R
G
L
H
H
L
I
W
E
V
V
D
N
A
V
D
E
A
M
A
G
Y
A
--
T
T
V
N
V
V
L
L
E
D
-
G
G
V
E
V
A
D
D
G
R
G
I
P
V
A
T
H
-
A
S
G
I
P
T
V
D
V
V
M
T
Q
L
H
A
G
G
K
F
D
S
D
A
Y
A
I
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
T
R
L
E
V
E
I
K
R
D
G
Y
E
W
S
Q
V
Y
E
K
--
S
-
E
P
L
G
-
L
K
Q
G
A
--
P
--
T
--
K
--
K
T
G
S
T
V
R
F
W
-------
A
D
P
A
V
F
-
E
T
T
E
Y
D
F
E
T
V
A
R
R
L
Q
E
M
A
F
L
N
K
G
L
T
I
N
L
T
D
E
R
------------------HKVK
S
--
R
T
F
H
Y
P
G
G
L
V
D
F
V
K
H
I
N
R
T
K
N
A
I
H
S
S
I
V
-
D
F
S
G
K
G
T
G
H
E
V
E
I
A
M
Q
W
N
A
G
Y
-
S
E
S
V
H
T
F
A
N
T
I
N
T
H
E
G
G
T
H
E
E
G
F
R
S
A
L
T
S
V
V
N
K
Y
A
K
D
R
-----
K
D
P
N
L
T
G
D
D
I
R
E
G
L
A
A
V
I
S
V
K
V
S
E
P
--
Q
F
E
G
Q
T
K
T
K
L
G
N
T
E
V
K
S
F
V
Q
K
V
C
N
E
Q
L
T
H
W
F
E
A
N
P
T
D
A
K
V
V
V
N
K
A
V
S
S
A
Q
A
R
I
A
A
R
K
A
R
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
60.38
100%
-117
- C1 -
-
4Z2E
1
?
C:
[25-264]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
S
G
L
E
I
S
N
L
P
G
K
L
A
D
C
S
S
N
N
P
A
E
T
E
L
F
I
V
E
G
D
S
A
G
G
S
A
K
S
G
R
N
R
E
F
Q
A
I
L
P
I
R
G
K
I
L
N
V
E
K
A
S
M
D
K
I
L
A
N
E
E
I
R
S
L
F
T
A
M
G
T
G
F
G
A
-
E
F
D
V
S
K
A
R
Y
Q
K
L
V
L
M
T
D
A
D
V
D
G
A
H
I
R
T
L
L
L
T
L
I
Y
R
Y
M
K
P
I
L
E
A
G
Y
V
Y
I
A
Q
P
P
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
E
M
D
D
H
Q
L
W
E
T
T
M
D
P
E
H
R
L
M
A
R
V
S
V
D
D
A
A
E
A
D
K
I
F
D
M
L
M
G
D
R
V
E
P
R
R
E
F
I
E
E
N
A
V
Y
-----
123
HHSearch
60.19
96%
-131
- C1 -
-
4Z2D
1
?
C:
[30-264]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
S
N
L
P
G
K
L
A
D
C
S
S
N
N
P
A
E
T
E
L
F
I
V
E
G
D
S
A
G
G
S
A
K
S
G
R
N
R
E
F
Q
A
I
L
P
I
R
G
K
I
L
N
V
E
K
A
S
M
D
K
I
L
A
N
E
E
I
R
S
L
F
T
A
M
G
T
G
F
G
A
-
E
F
D
V
S
K
A
R
Y
Q
K
L
V
L
M
T
D
A
D
V
D
G
A
H
I
R
T
L
L
L
T
L
I
Y
R
Y
M
K
P
I
L
E
A
G
Y
V
Y
I
A
Q
P
P
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
G
E
M
D
D
H
Q
L
W
E
T
T
M
D
P
E
H
R
L
M
A
R
V
S
V
D
D
A
A
E
A
D
K
I
F
D
M
L
M
G
D
R
V
E
P
R
R
E
F
I
E
E
N
A
V
Y
-----
23
PsiBlast_CBE
60.13
100%
-113
- C1 -
-
4Z2C
1
?
D:
[25-265]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
S
G
L
E
I
---
P
G
K
L
A
D
C
S
S
N
N
P
A
E
T
E
L
F
I
V
E
G
D
S
A
G
G
S
A
K
S
G
R
N
R
E
F
Q
A
I
L
P
I
R
G
K
I
L
N
V
E
K
A
S
M
D
K
I
L
A
N
E
E
I
R
S
L
F
T
A
M
G
T
G
F
G
A
-
E
F
D
V
S
K
A
R
Y
Q
K
L
V
L
M
T
D
A
D
V
D
G
A
H
I
R
T
L
L
L
T
L
I
Y
R
Y
M
K
P
I
L
E
A
G
Y
V
Y
I
A
Q
P
P
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
G
E
M
D
D
H
Q
L
W
E
T
T
M
D
P
E
H
R
L
M
A
R
V
S
V
D
D
A
A
E
A
D
K
I
F
D
M
L
M
G
D
R
V
E
P
R
R
E
F
I
E
E
N
A
V
Y
S
----
127
HHSearch
59.86
58%
-33
- C1 -
-
4TMA
-
?
B:
[22-399]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
L
A
D
C
Q
E
R
D
P
A
L
S
E
L
Y
L
V
E
G
D
S
A
G
G
S
A
K
Q
G
R
N
R
K
N
Q
A
I
L
P
L
K
G
K
I
L
N
V
----
Y
D
K
M
L
S
S
Q
E
V
A
T
L
I
T
A
L
G
C
G
I
G
R
D
E
Y
N
P
D
K
L
R
Y
H
S
I
I
I
M
T
D
A
D
V
D
G
S
H
I
R
T
L
L
L
T
F
F
Y
R
Q
M
P
E
I
V
E
R
G
H
V
Y
I
A
Q
P
P
L
Y
K
V
K
K
G
K
-
Q
E
Q
Y
I
K
D
D
E
A
M
D
Q
Y
Q
I
S
I
A
L
DGATLHTNASAP
A
L
A
G
E
A
L
E
K
L
V
S
E
Y
N
A
T
Q
K
M
I
N
R
M
E
RRYP
K
A
M
L
K
E
L
I
Y
Q
P
T
L
T
E
A
D
L
S
D
E
Q
T
V
T
R
W
V
N
A
L
V
S
E
L
N
D
K
EQHG
S
Q
W
K
F
D
V
H
T
N
AEQN
L
F
E
P
I
V
R
V
RTHGVD
T
D
Y
P
L
D
H
E
F
I
T
GG
E
Y
R
R
I
C
T
L
G
E
K
L
R
GLLEED
A
F
I
E
R
GE
R
R
Q
P
V
AS
F
E
Q
A
L
D
W
L
V
K
E
S
R
R
G
L
S
I
Q
R
Y
K
G
L
G
E
M
N
P
E
Q
L
W
E
T
T
M
D
P
E
S
R
R
M
L
R
V
T
V
K
D
A
I
A
A
D
Q
L
F
T
T
L
M
G
D
--------------------
21
PsiBlast_CBE
59.63
100%
-123
- C1 -
-
4Z2E
1
?
D:
[25-265]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
S
G
L
E
I
---
P
G
K
L
A
D
C
S
S
N
N
P
A
E
T
E
L
F
I
V
E
G
D
S
A
G
G
S
A
K
S
G
R
N
R
E
F
Q
A
I
L
P
I
R
G
K
I
L
N
V
E
K
A
S
M
D
K
I
L
A
N
E
E
I
R
S
L
F
T
A
M
G
T
G
F
G
A
-
E
F
D
V
S
K
A
R
Y
Q
K
L
V
L
M
T
D
A
D
V
D
G
A
H
I
R
T
L
L
L
T
L
I
Y
R
Y
M
K
P
I
L
E
A
G
Y
V
Y
I
A
Q
P
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
D
D
H
Q
L
W
E
T
T
M
D
P
E
H
R
L
M
A
R
V
S
V
D
D
A
A
E
A
D
K
I
F
D
M
L
M
G
D
R
V
E
P
R
R
E
F
I
E
E
N
A
V
Y
S
----
25
PsiBlast_CBE
59.20
48%
-34
- C2 -
-
3ZM7
1
GYRB_MYCTU
C:
[36-436]
-----------------------
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
G
-
E
-
R
G
L
H
H
L
I
W
E
V
V
D
N
A
V
D
E
A
M
A
G
Y
A
--
T
T
V
N
V
V
L
L
E
D
-
G
G
V
E
V
A
D
D
G
R
G
I
P
V
A
T
H
-
A
S
G
I
P
T
V
D
V
V
M
T
Q
L
--------------------------
V
G
V
S
V
V
N
A
L
S
T
R
L
E
V
E
I
K
R
D
G
Y
E
W
S
Q
V
Y
E
K
--
S
-
E
P
L
G
-
L
K
Q
G
A
--
P
--
T
--
K
--
K
T
G
S
T
V
R
F
W
-------
A
D
P
A
V
F
-
E
T
T
E
Y
D
F
E
T
V
A
R
R
L
Q
E
M
A
F
L
N
K
G
L
T
I
N
L
T
D
E
R
------------------KV
K
S
---
R
T
F
H
Y
P
G
G
L
V
D
F
V
K
H
I
N
R
T
K
N
A
I
H
S
S
I
V
-
D
F
S
G
K
G
T
G
H
E
V
E
I
A
M
Q
W
N
A
G
Y
-
S
E
S
V
H
T
F
A
N
T
I
N
T
H
E
G
G
T
H
E
E
G
F
R
S
A
L
T
S
V
V
N
K
Y
A
K
D
R
K
L
L
K
D
--
P
N
L
T
G
D
D
I
R
E
G
L
A
A
V
I
S
V
K
V
S
E
P
--
Q
F
E
--
T
K
T
K
L
G
N
T
E
V
K
S
F
V
Q
K
V
C
N
E
Q
L
T
H
W
F
E
A
N
P
T
D
A
K
V
V
V
N
K
A
V
S
S
A
Q
A
R
I
A
A
R
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
59.19
100%
-117
- C1 -
-
4Z2D
1
?
D:
[25-265]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
S
G
L
E
I
---
P
G
K
L
A
D
C
S
S
N
N
P
A
E
T
E
L
F
I
V
E
G
D
S
A
G
G
S
A
K
S
G
R
N
R
E
F
Q
A
I
L
P
I
R
G
K
I
L
N
V
E
K
A
S
M
D
K
I
L
A
N
E
E
I
R
S
L
F
T
A
M
G
T
G
F
G
A
-
E
F
D
V
S
K
A
R
Y
Q
K
L
V
L
M
T
D
A
D
V
D
G
A
H
I
R
T
L
L
L
T
L
I
Y
R
Y
M
K
P
I
L
E
A
G
Y
V
Y
I
A
Q
P
P
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
G
E
M
D
D
H
Q
L
W
E
T
T
M
D
P
E
H
R
L
M
A
R
V
S
V
D
D
A
A
E
A
D
K
I
F
D
M
L
M
G
D
R
V
E
P
R
R
E
F
I
E
E
N
A
V
Y
S
----
132
HHSearch
58.72
52%
19
- C2 -
-
1EI1
4
GYRB_ECOLI
B:
[2-389]
----------
N
S
S
D
S
S
S
I
-
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
-
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
--
K
E
I
I
V
T
I
H
A
D
-
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
--
G
-
V
P
Q
A
P
L
A
V
T
G
--
E
--
T
--
E
--
K
T
G
T
M
V
R
F
W
-------
P
S
L
E
T
F
T
N
V
T
E
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
D
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
---------
K
E
-------
D
H
F
H
Y
E
G
G
I
K
A
F
V
E
Y
L
N
K
N
K
T
P
I
H
P
N
I
F
-
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
K
K
A
K
V
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
R
A
R
E
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
112
Fugue
58.21
51%
18
- C2 -
-
1EI1
4
GYRB_ECOLI
A:
[1-391]
---------
S
N
S
S
D
S
S
S
I
-
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
-
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
--
K
E
I
I
V
T
I
H
A
D
-
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
--
G
-
V
P
Q
A
P
L
A
V
T
G
--
E
--
T
--
E
--
K
T
G
T
M
V
R
F
W
-------
P
S
L
E
T
F
T
N
V
T
E
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
D
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
---------
K
E
-------
D
H
F
H
Y
E
G
G
I
K
A
F
V
E
Y
L
N
K
N
K
T
P
I
H
P
N
I
F
-
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
K
K
A
K
V
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
R
A
R
E
M
T
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
111
Fugue
58.04
51%
18
- C2 -
-
1EI1
4
GYRB_ECOLI
A:
[1-391]
---------
S
N
S
S
D
S
S
S
I
-
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
-
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
--
K
E
I
I
V
T
I
H
A
D
-
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
--
G
-
V
P
Q
A
P
L
A
V
T
G
--
E
--
T
--
E
--
K
T
G
T
M
V
R
F
W
-------
P
S
L
E
T
F
T
N
V
T
E
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
D
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
---------
K
E
-------
D
H
F
H
Y
E
G
G
I
K
A
F
V
E
Y
L
N
K
N
K
T
P
I
H
P
N
I
F
-
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
K
K
A
K
V
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
R
A
R
E
M
T
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
57.27
51%
12
- C2 -
-
4XTJ
1
GYRB_ECOLI
A:
[3-375]
-----------
S
Y
D
S
S
S
I
-
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
-
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
--
K
E
I
I
V
T
I
H
A
D
-
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
--
G
-
V
P
Q
A
P
L
A
V
T
G
--
E
--
T
--
E
--
K
T
G
T
M
V
R
F
W
-------
P
S
L
E
T
F
T
N
V
T
E
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
------
E
-
D
---------
H
F
H
Y
E
G
G
I
K
A
F
V
E
Y
L
N
K
N
K
T
P
I
H
P
N
I
F
-
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
-----
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
57.16
51%
13
- C2 -
-
4WUD
1
GYRB_ECOLI
A:
[3-375]
-----------
S
Y
D
S
S
S
I
-
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
-
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
--
K
E
I
I
V
T
I
H
A
D
-
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
--
G
-
V
P
Q
A
P
L
A
V
T
G
--
E
--
T
--
E
--
K
T
G
T
M
V
R
F
W
-------
P
S
L
E
T
F
T
N
V
T
E
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
------
E
-
D
---------
H
F
H
Y
E
G
G
I
K
A
F
V
E
Y
L
N
K
N
K
T
P
I
H
P
N
I
F
-
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
-----
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
56.75
51%
15
- C2 -
-
4WUC
1
GYRB_ECOLI
A:
[3-375]
-----------
S
Y
D
S
S
S
I
-
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
-
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
--
K
E
I
I
V
T
I
H
A
D
-
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
--
G
-
V
P
Q
A
P
L
A
V
T
G
--
E
--
T
--
E
--
K
T
G
T
M
V
R
F
W
-------
P
S
L
E
T
F
T
N
V
T
E
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
------
E
-
D
---------
H
F
H
Y
E
G
G
I
K
A
F
V
E
Y
L
N
K
N
K
T
P
I
H
P
N
I
F
-
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
-----
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
56.45
51%
14
- C2 -
-
4WUB
1
GYRB_ECOLI
A:
[3-375]
-----------
S
Y
D
S
S
S
I
-
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
-
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
--
K
E
I
I
V
T
I
H
A
D
-
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
--
G
-
V
P
Q
A
P
L
A
V
T
G
--
E
--
T
--
E
--
K
T
G
T
M
V
R
F
W
-------
P
S
L
E
T
F
T
N
V
T
E
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
------
E
-
D
---------
H
F
H
Y
E
G
G
I
K
A
F
V
E
Y
L
N
K
N
K
T
P
I
H
P
N
I
F
-
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
-----
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
56.11
51%
12
- C2 -
-
4PRV
1
GYRB_ECOLI
A:
[16-382]
-----------------
I
-
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
-
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
--
K
E
I
I
V
T
I
H
A
D
-
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
--
G
-
V
P
Q
A
P
L
A
V
T
G
--
E
--
T
--
E
--
K
T
G
T
M
V
R
F
W
-------
P
S
L
E
T
F
T
N
V
T
E
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
------
E
-
D
---------
H
F
H
Y
E
G
G
I
K
A
F
V
E
Y
L
N
K
N
K
T
P
I
H
P
N
I
F
-
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
-------------
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
46
PsiBlast_CBE
55.96
51%
16
- C2 -
-
1EI1
4
GYRB_ECOLI
B:
[9-375]
-----------------
I
-
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
-
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
--
K
E
I
I
V
T
I
H
A
D
-
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
--
G
-
V
P
Q
A
P
L
A
V
T
G
--
E
--
T
--
E
--
K
T
G
T
M
V
R
F
W
-------
P
S
L
E
T
F
T
N
V
T
E
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
D
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
------
E
-
D
---------
H
F
H
Y
E
G
G
I
K
A
F
V
E
Y
L
N
K
N
K
T
P
I
H
P
N
I
F
-
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
K
K
A
K
V
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
55.94
51%
16
- C2 -
-
1EI1
4
GYRB_ECOLI
A:
[9-375]
-----------------
I
-
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
-
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
--
K
E
I
I
V
T
I
H
A
D
-
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
--
G
-
V
P
Q
A
P
L
A
V
T
G
--
E
--
T
--
E
--
K
T
G
T
M
V
R
F
W
-------
P
S
L
E
T
F
T
N
V
T
E
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
D
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
------
E
-
D
---------
H
F
H
Y
E
G
G
I
K
A
F
V
E
Y
L
N
K
N
K
T
P
I
H
P
N
I
F
-
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
K
K
A
K
V
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
55.79
51%
8
- C2 -
-
4PRX
2
GYRB_ECOLI
A:
[16-382]
-----------------
I
-
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
-
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
--
K
E
I
I
V
T
I
H
A
D
-
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
--
G
-
V
P
Q
A
P
L
A
V
T
G
--
E
--
T
--
E
--
K
T
G
T
M
V
R
F
W
-------
P
S
L
E
T
F
T
N
V
T
E
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
------
E
-
D
---------
H
F
H
Y
E
G
G
I
K
A
F
V
E
Y
L
N
K
N
K
T
P
I
H
P
N
I
F
-
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
-----------
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
141
HHSearch
55.52
37%
-7
- C2 -
-
1S16
2
PARE_ECOLI
B:
[4-383]
-----------
T
Y
N
A
D
A
I
-
E
V
L
T
G
L
E
P
V
R
R
R
P
G
M
Y
T
D
T
-----
T
R
P
N
H
L
G
Q
E
V
I
D
N
S
V
D
E
A
L
A
G
H
A
--
K
R
V
D
V
I
L
H
A
D
-
Q
S
L
E
V
I
D
D
G
R
G
M
P
V
D
I
H
P
E
E
G
V
P
A
V
E
L
I
L
C
R
L
H
A
G
G
K
F
S
N
K
N
Y
Q
F
S
G
-------
G
L
H
G
V
G
I
S
V
V
N
A
L
S
K
R
V
E
V
N
V
R
R
D
G
Q
V
Y
N
I
A
F
E
N
--
G
-
E
K
V
Q
D
L
Q
V
V
G
--
T
CG
K
--
R
--
N
T
G
T
S
V
H
F
W
-------
P
D
E
T
F
F
D
S
-
P
R
F
S
V
S
R
L
T
H
V
L
K
A
K
A
V
L
C
P
G
V
E
I
T
F
K
D
E
I
-----
N
N
---------
T
E
-------
Q
R
W
C
Y
Q
D
G
L
N
D
Y
L
A
E
A
V
N
G
L
P
T
L
P
E
K
P
F
-
I
G
N
F
A
G
D
T
E
A
V
D
W
A
L
L
W
L
P
E
G
G
E
L
L
T
E
S
Y
V
N
L
I
P
T
M
Q
G
G
T
H
V
N
G
L
R
Q
G
L
L
D
A
M
R
E
F
C
E
Y
R
N
I
L
P
R
-
G
V
K
L
S
A
E
D
I
W
D
R
C
A
Y
V
L
S
V
K
M
Q
D
P
--
Q
F
A
G
Q
T
K
E
R
L
S
S
R
Q
C
A
A
F
V
S
G
V
V
K
D
A
F
I
L
W
L
N
Q
N
V
Q
A
A
E
L
L
A
E
M
A
I
S
S
A
Q
R
R
M
R
A
--
A
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
55.47
51%
4
- C2 -
-
4ZVI
1
GYRB_ECOLI
A:
[1-361]
------------------------
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
-
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
--
K
E
I
I
V
T
I
H
A
D
-
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
--------------------------
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
-
G
K
I
H
R
Q
I
Y
E
H
--
G
-
V
P
Q
A
P
L
A
V
T
G
--
E
--
T
--
E
--
K
T
G
T
M
V
R
F
W
-------
P
S
L
E
T
F
T
N
V
T
E
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
------
E
-
D
---------
H
F
H
Y
E
G
G
I
K
A
F
V
E
Y
L
N
K
N
K
T
P
I
H
P
N
I
F
-
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
K
K
A
K
V
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
54.81
51%
7
- C2 -
-
4PU9
1
GYRB_ECOLI
A:
[16-382]
-----------------
I
-
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
-
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
--
K
E
I
I
V
T
I
H
A
D
-
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
-------
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
--
G
-
V
P
Q
A
P
L
A
V
T
G
--
E
--
T
--
E
--
K
T
G
T
M
V
R
F
W
-------
P
S
L
E
T
F
T
N
V
T
E
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
------
E
-
D
---------
H
F
H
Y
E
G
G
I
K
A
F
V
E
Y
L
N
K
N
K
T
P
I
H
P
N
I
F
-
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
K
-----------
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
48.62
81%
-82
- C2 -
-
4K4O
2
GYRB_ENTFA
A:
[1-207]
-----------------------
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
S
-
G
-
E
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
F
A
--
K
S
I
Q
V
I
I
E
P
D
-
D
S
I
T
V
I
D
D
G
R
G
I
P
V
G
I
Q
A
K
T
G
R
P
A
V
E
T
V
F
T
V
L
---------------------------
G
S
S
V
V
N
A
L
S
T
S
L
D
V
R
V
Y
K
D
G
K
V
Y
Y
Q
E
Y
R
R
--
G
-
A
V
V
D
D
L
K
V
I
E
--
E
--
T
--
D
--
R
H
G
T
T
V
H
F
I
-------
P
D
P
E
I
F
T
E
T
T
V
Y
D
F
D
K
L
A
T
R
V
R
E
L
A
F
L
N
R
G
L
H
I
S
I
E
D
R
R
-----
E
G
Q
------
E
-
D
K
-------
K
E
Y
H
Y
E
G
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
98
PsiBlast_CBE
47.91
67%
-72
- C2 -
-
4URM
1
?
B:
[25-231]
------------------------
L
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
-
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
--
N
Q
I
E
V
V
I
E
K
D
-
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
Q
E
K
M
G
R
P
A
V
E
V
I
L
T
V
L
H
A
G
G
K
F
G
-------------------
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
--
G
-
V
P
Q
F
D
L
K
E
V
G
--
T
--
T
--
D
--
K
T
G
T
V
I
R
F
K
-------
A
D
G
E
I
F
T
E
T
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
------
N
V
R
E
-------
D
S
Y
H
Y
E
G
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
47.57
81%
-78
- C2 -
-
4KSG
2
GYRB_ENTFA
A:
[1-207]
-----------------------
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
S
-
G
-
E
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
F
A
--
K
S
I
Q
V
I
I
E
P
D
-
D
S
I
T
V
I
D
D
G
R
G
I
P
V
G
I
Q
A
K
T
G
R
P
A
V
E
T
V
F
T
V
L
---------------------------
G
S
S
V
V
N
A
L
S
T
S
L
D
V
R
V
Y
K
D
G
K
V
Y
Y
Q
E
Y
R
R
--
G
-
A
V
V
D
D
L
K
V
I
E
--
E
--
T
--
D
--
R
H
G
T
T
V
H
F
I
-------
P
D
P
E
I
F
T
E
T
T
V
Y
D
F
D
K
L
A
T
R
V
R
E
L
A
F
L
N
R
G
L
H
I
S
I
E
D
R
R
-----
E
G
Q
------
E
-
D
K
-------
K
E
Y
H
Y
E
G
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
47.51
81%
-81
- C2 -
-
4HXW
2
GYRB_ENTFA
A:
[1-207]
-----------------------
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
S
-
G
-
E
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
F
A
--
K
S
I
Q
V
I
I
E
P
D
-
D
S
I
T
V
I
D
D
G
R
G
I
P
V
G
I
Q
A
K
T
G
R
P
A
V
E
T
V
F
T
V
L
--------------------------
V
G
S
S
V
V
N
A
L
S
T
S
L
D
V
R
V
Y
K
D
G
K
V
Y
Y
Q
E
Y
R
R
--
G
-
A
V
V
D
D
L
K
V
I
E
--
E
--
T
--
D
--
R
H
G
T
T
V
H
F
I
-------
P
D
P
E
I
F
T
E
T
T
V
Y
D
F
D
K
L
A
T
R
V
R
E
L
A
F
L
N
R
G
L
H
I
S
I
E
D
R
R
-----
E
G
Q
------
E
-
D
K
-------
K
E
Y
H
Y
E
G
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
99
PsiBlast_CBE
47.44
67%
-73
- C2 -
-
4URM
1
?
A:
[25-231]
------------------------
L
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
-
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
--
N
Q
I
E
V
V
I
E
K
D
-
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
Q
E
K
M
G
R
P
A
V
E
V
I
L
T
V
L
H
A
G
G
K
--------------------
G
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
--
G
-
V
P
Q
F
D
L
K
E
V
G
--
T
--
T
--
D
--
K
T
G
T
V
I
R
F
K
-------
A
D
G
E
I
F
T
E
T
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
------
N
V
R
E
-------
D
S
Y
H
Y
E
G
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
97
PsiBlast_CBE
45.78
67%
-79
- C2 -
-
4URM
2
?
C:
[25-231]
------------------------
L
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
-
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
--
N
Q
I
E
V
V
I
E
K
D
-
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
Q
E
K
M
G
R
P
A
V
E
V
I
L
T
V
L
H
A
G
-----------------------
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
--
G
-
V
P
Q
F
D
L
K
E
V
G
--
T
--
T
--
D
--
K
T
G
T
V
I
R
F
K
-------
A
D
G
E
I
F
T
E
T
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
------
N
V
R
E
-------
D
S
Y
H
Y
E
G
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
95
PsiBlast_CBE
44.38
67%
-77
- C2 -
-
4URO
1
GYRB_STAAU
A:
[26-231]
-------------------------
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
-
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
--
N
Q
I
E
V
V
I
E
K
D
-
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
Q
E
K
M
G
R
P
A
V
E
V
I
L
T
V
--------------------------
G
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
--
G
-
V
P
Q
F
D
L
K
E
V
G
--
T
--
T
--
D
--
K
T
G
T
V
I
R
F
K
-------
A
D
G
E
I
F
T
E
T
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
------
N
V
R
E
-------
D
S
Y
H
Y
E
G
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
92
PsiBlast_CBE
44.25
67%
-80
- C2 -
-
4URO
2
GYRB_STAAU
D:
[25-230]
------------------------
L
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
-
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
--
N
Q
I
E
V
V
I
E
K
D
-
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
------
P
A
V
E
V
I
L
T
V
---------------------------
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
--
G
-
V
P
Q
F
D
L
K
E
V
G
--
T
--
T
--
D
--
K
T
G
T
V
I
R
F
K
-------
A
D
G
E
I
F
T
E
T
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
------
N
V
R
E
-------
D
S
Y
H
Y
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
94
PsiBlast_CBE
44.22
67%
-73
- C2 -
-
4URO
1
GYRB_STAAU
B:
[26-231]
-------------------------
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
-
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
--
N
Q
I
E
V
V
I
E
K
D
-
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
Q
E
K
M
G
R
P
A
V
E
V
I
L
T
V
---------------------------
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
--
G
-
V
P
Q
F
D
L
K
E
V
G
--
T
--
T
--
D
--
K
T
G
T
V
I
R
F
K
-------
A
D
G
E
I
F
T
E
T
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
------
N
V
R
E
-------
D
S
Y
H
Y
E
G
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
93
PsiBlast_CBE
43.92
67%
-73
- C2 -
-
4URO
1
GYRB_STAAU
C:
[25-230]
------------------------
L
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
-
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
--
N
Q
I
E
V
V
I
E
K
D
-
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
Q
E
K
M
G
R
P
A
V
E
V
I
L
T
----------------------------
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
--
G
-
V
P
Q
F
D
L
K
E
V
G
--
T
--
T
--
D
--
K
T
G
T
V
I
R
F
K
-------
A
D
G
E
I
F
T
E
T
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
------
N
V
R
E
-------
D
S
Y
H
Y
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
96
PsiBlast_CBE
43.90
67%
-71
- C2 -
-
4URM
1
?
D:
[26-231]
-------------------------
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
-
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
--
N
Q
I
E
V
V
I
E
K
D
-
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
Q
E
K
M
G
R
P
A
V
E
V
I
L
T
V
L
H
A
G
-----------------------
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
--
G
-
V
P
Q
F
D
L
K
E
V
G
--
T
--
T
--
D
--
K
T
G
T
V
I
R
F
K
-------
A
D
G
E
I
F
T
E
T
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
------
N
V
R
E
-------
D
S
Y
H
Y
E
G
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
113
Fugue
39.77
48%
-74
- C2 -
-
1EI1
1
GYRB_ECOLI
A:
[220-391]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
I
K
A
F
V
E
Y
L
N
K
N
K
T
P
I
H
P
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Y
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I
G
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V
A
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W
N
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-
Q
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I
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C
F
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N
N
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A
M
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A
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A
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D
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A
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D
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--
K
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N
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K
I
I
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A
A
R
A
R
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A
A
R
R
A
R
E
M
T
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
116
Fugue
35.41
49%
26
- C2 -
-
1EI1
4
GYRB_ECOLI
A:
[1-219]
---------
S
N
S
S
D
S
S
S
I
K
-
V
L
K
G
L
D
A
V
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-
T
G
L
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H
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N
A
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--HC
K
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-D
N
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A
A
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I
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T
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L
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A
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G
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D
-------NSYKVSG
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
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--
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K
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L
A
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--
E
--
T
---E-
K
T
G
T
M
V
R
F
W
P
SLETFT-------
N
V
T
E
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
D
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-
K
-----
R
D
---------
G
K
-------
E
D
H
F
H
Y
E
G
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------