@TOME V2.3
(Nov 2016)
Ref.
-
-
Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
Core Structure Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
Core Structure Cluster
Contacts with Ligands
Show alignment :
Atome selection
All alignments
Only Template with Ligand
Column output:
Score:
Atome Rank Value
Tools Score
Hide column
Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
Hide column
Structural Clustering:
Cluster Num
3D-Jury Struct. Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
Hide column
Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
Hide column
Sequence & Result Tab:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : Lmo1600: (2016-03-26 )
MVNTNLEELRTQVDQLNIDLLELISKRANLVQEIGKIKGTQGSLRFDPLREREMLNTILAANEGPFEDSTVQKLFKEIFKAGLELQEEDHSKALLVSRKNKKEDTIVTVKGLPIGNGEPVFVFGPCSVESYEQVAAVAESIKAKGLKLIRGGAFKPRTSPYDFQGLGLEGLKILKRVSDEYGLGVISEIVTPADIEVALDYVDVIQIGARNMQNFELLKAAGRVDKPILLKRGLSATIEEFIGAAEYIMSQGNGKIILCERGIRTYEKATRNTLDISAVPILKKETHLPVMVDVTHSTGRKDLLLPCAKAALAIEADGVMAEVHPDPAVALSDSAQQMDIPEFEEFWNAILASNLVPHKIK
Atome Classification :
(26 SA)
-----.........10........20........30........40........50........60........70........80........90........100.......110.......120.......130.......140.......150.......160.......170.......180.......190.......200.......210.......220.......230.......240.......250.......260.--....-..270.......280.......290-........300.......310.......320...--....330.......340....-----...350.......360
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
-----MVNT
N
L
E
E
L
R
T
Q
V
D
QL
N
I
D
L
L
E
L
I
S
K
R
A
N
L
V
Q
E
I
G
K
IKGTQGSLRFDP
L
R
E
R
E
M
L
N
T
I
L
AANEGPFE
D
S
T
V
Q
K
L
F
K
E
I
F
K
AGLELQEEDHS
K
A
L
L
V
SRKNKKED
T
I
V
T
V
K
G
L
PIGNG
E
P
V
F
V
FGPCS
V
E
S
Y
E
Q
V
A
A
V
A
E
S
I
K
AKG
L
K
L
IRGGAFKPRTSPYDFQGLG
L
E
G
L
K
I
L
K
R
V
S
D
EYG
L
G
V
I
S
E
IVTP
A
D
I
E
V
A
L
D
Y
V
D
V
I
Q
I
G
ARNM
Q
N
F
E
L
L
K
A
AGRVDK
P
I
L
L
K
RG
L
S
A
T
I
E
E
F
I
G
A
A
E
Y
I
M
SQGN
G
K
I
I
L
CERGI--
R
T
Y
E
-
K
ATRNTLDISAVPILKKETHL
P
V
-
M
-
V
D
V
THSTGRK
D
L
L
L
P
CAK
A
A
L
A
I
EAD
G
V
M
A
EVHP--DP
A
V
ALSDSAQQMD
I
P
E
F
E
E
F
-----
W
N
A
I
L
A
S
NLVPHKIK-
2
PsiBlast_PDB
96.47
100%
-108
- C3 -
3TFC
3
?
A:
[33-380]
-------------
L
R
T
Q
V
D
Q
L
N
I
D
L
L
E
L
I
S
K
R
A
N
L
V
Q
E
I
G
K
I
K
-----
L
R
F
D
P
L
R
E
R
E
M
L
N
T
I
L
A
A
N
E
G
P
F
E
D
S
T
V
Q
K
L
F
K
E
I
F
K
A
G
L
E
L
Q
E
E
D
H
S
K
A
L
L
V
S
R
K
N
K
K
E
D
T
I
V
T
V
K
G
L
P
I
G
N
G
E
P
V
F
V
F
G
P
C
S
V
E
S
Y
E
Q
V
A
A
V
A
E
S
I
K
A
K
G
L
K
L
I
R
G
G
A
F
K
P
R
T
S
P
Y
D
F
Q
G
L
G
L
E
G
L
K
I
L
K
R
V
S
D
E
Y
G
L
G
V
I
S
E
I
V
T
P
A
D
I
E
V
A
L
D
Y
V
D
V
I
Q
I
G
A
R
N
M
Q
N
F
E
L
L
K
A
A
G
R
V
D
K
P
I
L
L
K
R
G
L
S
A
T
I
E
E
F
I
G
A
A
E
Y
I
M
S
Q
G
N
G
K
I
I
L
C
E
R
G
I
--
R
T
Y
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
L
K
K
E
T
H
L
P
V
-
M
-
V
D
V
T
H
S
T
G
R
K
D
L
L
L
P
C
A
K
A
A
L
A
I
E
A
D
G
V
M
A
E
V
H
P
--
D
P
A
V
A
L
S
D
S
A
Q
Q
M
D
I
P
E
F
E
E
F
-----
W
N
A
I
L
A
S
N
L
V
------
1
PsiBlast_PDB
95.39
100%
-105
- C3 -
3NVT
2
?
A:
[32-381]
------------
E
L
R
T
Q
V
D
Q
L
N
I
D
L
L
E
L
I
S
K
R
A
N
L
V
Q
E
I
G
K
I
K
G
-----
R
F
D
P
L
R
E
R
E
M
L
N
T
I
L
A
A
N
E
G
P
F
E
D
S
T
V
Q
K
L
F
K
E
I
F
K
A
G
L
E
L
Q
E
E
D
H
S
K
A
L
L
V
S
R
K
N
K
K
E
D
T
I
V
T
V
K
G
L
P
I
G
N
G
E
P
V
F
V
F
G
P
C
S
V
E
S
Y
E
Q
V
A
A
V
A
E
S
I
K
A
K
G
L
K
L
I
R
G
G
A
F
K
P
R
T
S
P
Y
D
F
Q
G
L
G
L
E
G
L
K
I
L
K
R
V
S
D
E
Y
G
L
G
V
I
S
E
I
V
T
P
A
D
I
E
V
A
L
D
Y
V
D
V
I
Q
I
G
A
R
N
M
Q
N
F
E
L
L
K
A
A
G
R
V
D
K
P
I
L
L
K
R
G
L
S
A
T
I
E
E
F
I
G
A
A
E
Y
I
M
S
Q
G
N
G
K
I
I
L
C
E
R
G
I
--
R
T
Y
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
L
K
K
E
T
H
L
P
V
-
M
-
V
D
V
T
H
S
T
G
R
K
D
L
L
L
P
C
A
K
A
A
L
A
I
E
A
D
G
V
M
A
E
V
H
P
--
D
P
A
V
A
L
S
D
S
A
Q
Q
M
D
I
P
E
F
E
E
F
-----
W
N
A
I
L
A
S
N
L
V
P
-----
85
Fugue
95.38
99%
-105
- C3 -
3NVT
2
?
A:
[32-381]
------------
E
L
R
T
Q
V
D
Q
L
N
I
D
L
L
E
L
I
S
K
R
A
N
L
V
Q
E
I
G
K
I
K
G
R
F
-----
D
P
L
R
E
R
E
M
L
N
T
I
L
A
A
N
E
G
P
F
E
D
S
T
V
Q
K
L
F
K
E
I
F
K
A
G
L
E
L
Q
E
E
D
H
S
K
A
L
L
V
S
R
K
N
K
K
E
D
T
I
V
T
V
K
G
L
P
I
G
N
G
E
P
V
F
V
F
G
P
C
S
V
E
S
Y
E
Q
V
A
A
V
A
E
S
I
K
A
K
G
L
K
L
I
R
G
G
A
F
K
P
R
T
S
P
Y
D
F
Q
G
L
G
L
E
G
L
K
I
L
K
R
V
S
D
E
Y
G
L
G
V
I
S
E
I
V
T
P
A
D
I
E
V
A
L
D
Y
V
D
V
I
Q
I
G
A
R
N
M
Q
N
F
E
L
L
K
A
A
G
R
V
D
K
P
I
L
L
K
R
G
L
S
A
T
I
E
E
F
I
G
A
A
E
Y
I
M
S
Q
G
N
G
K
I
I
L
C
E
R
G
I
--
R
T
Y
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
L
K
K
E
T
H
L
P
V
-
M
-
V
D
V
T
H
S
T
G
R
K
D
L
L
L
P
C
A
K
A
A
L
A
I
E
A
D
G
V
M
A
E
V
H
P
--
D
P
A
V
A
L
S
D
S
A
Q
Q
M
D
I
P
E
F
E
E
F
-----
W
N
A
I
L
A
S
N
L
V
P
-----
95
HHSearch
94.41
98%
-107
- C3 -
3NVT
2
?
A:
[32-381]
------------
E
L
R
T
Q
V
D
Q
L
N
I
D
L
L
E
L
I
S
K
R
A
N
L
V
Q
E
I
G
K
I
K
G
-----
R
F
D
P
L
R
E
R
E
M
L
N
T
I
L
A
A
N
E
G
P
F
E
D
S
T
V
Q
K
L
F
K
E
I
F
K
A
G
L
E
L
Q
E
E
D
H
S
K
A
L
L
V
S
R
K
N
K
K
E
D
T
I
V
T
V
K
G
L
P
I
G
N
G
E
P
V
F
V
F
G
P
C
S
V
E
S
Y
E
Q
V
A
A
V
A
E
S
I
K
A
K
G
L
K
L
I
R
G
G
A
F
K
P
R
T
S
P
Y
D
F
Q
G
L
G
L
E
G
L
K
I
L
K
R
V
S
D
E
Y
G
L
G
V
I
S
E
I
V
T
P
A
D
I
E
V
A
L
D
Y
V
D
V
I
Q
I
G
A
R
N
M
Q
N
F
E
L
L
K
A
A
G
R
V
D
K
P
I
L
L
K
R
G
L
S
A
T
I
E
E
F
I
G
A
A
E
Y
I
M
S
Q
G
N
G
K
I
I
L
C
E
R
G
I
--
R
T
Y
E
K
A
-
T
R
N
T
L
D
I
S
A
V
P
I
L
K
K
E
T
H
L
P
V
-
M
-
V
D
V
T
H
S
T
G
R
K
D
L
L
L
P
C
A
K
A
A
L
A
I
E
A
--
D
G
V
M
A
E
V
H
P
D
P
A
V
A
L
S
D
S
A
Q
Q
M
D
I
P
E
F
E
E
F
-----
W
N
A
I
L
A
S
N
L
V
P
-----
21
PsiBlast_CBE
93.86
100%
-110
- C3 -
3TFC
3
?
B:
[29-382]
---------
N
L
E
E
L
R
T
Q
V
D
Q
L
N
I
D
L
L
E
L
I
S
K
R
A
N
L
V
Q
------------------
E
R
E
M
L
N
T
I
L
A
A
N
E
G
P
F
E
D
S
T
V
Q
K
L
F
K
E
I
F
K
A
G
L
------
H
S
K
A
L
L
V
S
R
K
N
K
K
E
D
T
I
V
T
V
K
G
L
P
I
G
N
G
E
P
V
F
V
F
G
P
C
S
V
E
S
Y
E
Q
V
A
A
V
A
E
S
I
K
A
K
G
L
K
L
I
R
G
G
A
F
K
P
R
T
S
P
Y
D
F
Q
G
L
G
L
E
G
L
K
I
L
K
R
V
S
D
E
Y
G
L
G
V
I
S
E
I
V
T
P
A
D
I
E
V
A
L
D
Y
V
D
V
I
Q
I
G
A
R
N
M
Q
N
F
E
L
L
K
A
A
G
R
V
D
K
P
I
L
L
K
R
G
L
S
A
T
I
E
E
F
I
G
A
A
E
Y
I
M
S
Q
G
N
G
K
I
I
L
C
E
R
G
I
--
R
T
Y
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
L
K
K
E
T
H
L
P
V
-
M
-
V
D
V
T
H
S
T
G
R
K
D
L
L
L
P
C
A
K
A
A
L
A
I
E
A
D
G
V
M
A
E
V
H
P
--
D
P
A
V
A
L
S
D
S
A
Q
Q
M
D
I
P
E
F
E
E
F
-----
W
N
A
I
L
A
S
N
L
V
P
H
----
22
PsiBlast_CBE
93.75
100%
-109
- C3 -
3NVT
2
?
B:
[30-380]
----------
L
E
E
L
R
T
Q
V
D
Q
L
N
I
D
L
L
E
L
I
S
K
R
A
N
L
V
Q
--------------------
E
M
L
N
T
I
L
A
A
N
E
G
P
F
E
D
S
T
V
Q
K
L
F
K
E
I
F
K
A
G
L
E
L
Q
----
S
K
A
L
L
V
S
R
K
N
K
K
E
D
T
I
V
T
V
K
G
L
P
I
G
N
G
E
P
V
F
V
F
G
P
C
S
V
E
S
Y
E
Q
V
A
A
V
A
E
S
I
K
A
K
G
L
K
L
I
R
G
G
A
F
K
P
R
T
S
P
Y
D
F
Q
G
L
G
L
E
G
L
K
I
L
K
R
V
S
D
E
Y
G
L
G
V
I
S
E
I
V
T
P
A
D
I
E
V
A
L
D
Y
V
D
V
I
Q
I
G
A
R
N
M
Q
N
F
E
L
L
K
A
A
G
R
V
D
K
P
I
L
L
K
R
G
L
S
A
T
I
E
E
F
I
G
A
A
E
Y
I
M
S
Q
G
N
G
K
I
I
L
C
E
R
G
I
--
R
T
Y
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
L
K
K
E
T
H
L
P
V
-
M
-
V
D
V
T
H
S
T
G
R
K
D
L
L
L
P
C
A
K
A
A
L
A
I
E
A
D
G
V
M
A
E
V
H
P
--
D
P
A
V
A
L
S
D
S
A
Q
Q
M
D
I
P
E
F
E
E
F
-----
W
N
A
I
L
A
S
N
L
V
------
33
PsiBlast_CBE
74.12
54%
-98
- C3 -
1RZM
4
AROF_THEMA
B:
[71-322]
---------------------------------------------------------------------------------------------------
L
V
S
R
E
F
H
P
E
D
T
V
I
D
L
G
D
V
K
I
G
N
G
Y
F
T
I
I
A
G
P
C
S
V
E
G
R
E
M
L
M
E
T
A
H
F
L
S
E
L
G
V
K
V
L
R
G
G
A
Y
K
P
R
T
S
P
Y
S
F
Q
G
L
G
E
K
G
L
E
Y
L
R
E
A
A
D
K
Y
G
M
Y
V
V
T
E
A
L
G
E
D
D
L
P
K
V
A
E
Y
A
D
I
I
Q
I
G
A
R
N
A
Q
N
F
R
L
L
S
K
A
G
S
Y
N
K
P
V
L
L
K
R
G
F
M
N
T
I
E
E
F
L
L
S
A
E
Y
I
A
N
S
G
N
T
K
I
I
L
C
E
R
G
I
--
R
T
F
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
I
R
K
E
S
H
L
P
I
-
L
-
V
D
P
S
H
S
G
G
R
R
D
L
V
I
P
L
S
R
A
A
I
A
V
G
A
H
G
I
I
V
E
V
H
P
--
E
P
E
K
A
L
S
D
G
K
Q
S
L
D
F
E
L
F
K
E
L
---------------------
4
PsiBlast_PDB
73.65
54%
-98
- C3 -
1RZM
3
AROF_THEMA
A:
[71-322]
---------------------------------------------------------------------------------------------------
L
V
S
R
E
F
H
P
E
D
T
V
I
D
L
G
D
V
K
I
G
N
G
Y
F
T
I
I
A
G
P
C
S
V
E
G
R
E
M
L
M
E
T
A
H
F
L
S
E
L
G
V
K
V
L
R
G
G
A
Y
K
P
R
T
S
P
Y
S
F
Q
G
L
G
E
K
G
L
E
Y
L
R
E
A
A
D
K
Y
G
M
Y
V
V
T
E
A
L
G
E
D
D
L
P
K
V
A
E
Y
A
D
I
I
Q
I
G
A
R
N
A
Q
N
F
R
L
L
S
K
A
G
S
Y
N
K
P
V
L
L
K
R
G
F
M
N
T
I
E
E
F
L
L
S
A
E
Y
I
A
N
S
G
N
T
K
I
I
L
C
E
R
G
I
--
R
T
F
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
I
R
K
E
S
H
L
P
I
-
L
-
V
D
P
S
H
S
G
G
R
R
D
L
V
I
P
L
S
R
A
A
I
A
V
G
A
H
G
I
I
V
E
V
H
P
--
E
P
E
K
A
L
S
D
G
K
Q
S
L
D
F
E
L
F
K
E
L
---------------------
32
PsiBlast_CBE
73.30
54%
-97
- C3 -
3PG9
4
AROF_THEMA
B:
[71-322]
---------------------------------------------------------------------------------------------------
L
V
S
R
E
F
H
P
E
D
T
V
I
D
L
G
D
V
K
I
G
N
G
Y
F
T
I
I
A
G
P
C
S
V
E
G
R
E
M
L
M
E
T
A
H
F
L
S
E
L
G
V
K
V
L
R
G
G
A
Y
K
P
R
T
S
P
Y
S
F
Q
G
L
G
E
K
G
L
E
Y
L
R
E
A
A
D
K
Y
G
M
Y
V
V
T
E
A
L
G
E
D
D
L
P
K
V
A
E
Y
A
D
I
I
Q
I
G
A
R
N
A
Q
N
F
R
L
L
S
K
A
G
S
Y
N
K
P
V
L
L
K
R
G
F
M
N
T
I
E
E
F
L
L
S
A
E
Y
I
A
N
S
G
N
T
K
I
I
L
C
E
R
G
I
--
R
T
F
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
I
R
K
E
S
H
L
P
I
-
L
-
V
D
P
S
H
S
G
G
R
R
D
L
V
I
P
L
S
R
A
A
I
A
V
G
A
H
G
I
I
V
E
V
H
P
--
E
P
E
K
A
L
S
D
G
K
Q
S
L
D
F
E
L
F
K
E
L
---------------------
41
PsiBlast_CBE
72.12
52%
-97
- C3 -
1VS1
2
?
D:
[15-276]
---------------------------------------------------------------------------------------------------
L
A
L
K
S
E
E
R
R
E
T
V
V
E
V
E
G
V
R
I
G
G
G
S
K
A
V
I
A
G
P
C
S
V
E
S
W
E
Q
V
R
E
A
A
L
A
V
K
E
A
G
A
H
M
L
R
G
G
A
F
K
P
R
T
S
P
Y
S
F
Q
G
L
G
L
E
G
L
K
L
L
R
R
A
G
D
E
A
G
L
P
V
V
T
E
V
L
D
P
R
H
V
E
T
V
S
R
Y
A
D
M
L
Q
I
G
A
R
N
M
Q
N
F
P
L
L
R
E
V
G
R
S
G
K
P
V
L
L
K
R
G
F
G
N
T
V
E
E
L
L
A
A
A
E
Y
I
L
L
E
G
N
W
Q
V
V
L
V
E
R
G
I
--
R
T
F
E
-
P
S
T
R
F
T
L
D
V
A
A
V
A
V
L
K
E
A
T
H
L
P
V
-
I
-
V
D
P
S
H
P
A
G
R
R
S
L
V
P
A
L
A
K
A
G
L
A
A
G
A
D
G
L
I
V
E
V
H
P
--
N
P
E
E
A
L
S
D
A
K
Q
Q
L
T
P
G
E
F
A
R
L
M
G
E
L
R
W
H
R
L
L
-----------
5
PsiBlast_PDB
72.12
54%
-97
- C3 -
3PG9
3
AROF_THEMA
A:
[71-322]
---------------------------------------------------------------------------------------------------
L
V
S
R
E
F
H
P
E
D
T
V
I
D
L
G
D
V
K
I
G
N
G
Y
F
T
I
I
A
G
P
C
S
V
E
G
R
E
M
L
M
E
T
A
H
F
L
S
E
L
G
V
K
V
L
R
G
G
A
Y
K
P
R
T
S
P
Y
S
F
Q
G
L
G
E
K
G
L
E
Y
L
R
E
A
A
D
K
Y
G
M
Y
V
V
T
E
A
L
G
E
D
D
L
P
K
V
A
E
Y
A
D
I
I
Q
I
G
A
R
N
A
Q
N
F
R
L
L
S
K
A
G
S
Y
N
K
P
V
L
L
K
R
G
F
M
N
T
I
E
E
F
L
L
S
A
E
Y
I
A
N
S
G
N
T
K
I
I
L
C
E
R
G
I
--
R
T
F
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
I
R
K
E
S
H
L
P
I
-
L
-
V
D
P
S
H
S
G
G
R
R
D
L
V
I
P
L
S
R
A
A
I
A
V
G
A
H
G
I
I
V
E
V
H
P
--
E
P
E
K
A
L
S
D
G
K
Q
S
L
D
F
E
L
F
K
E
L
---------------------
30
PsiBlast_CBE
72.06
54%
-95
- C3 -
3PG9
2
AROF_THEMA
D:
[71-322]
---------------------------------------------------------------------------------------------------
L
V
S
R
E
F
H
P
E
D
T
V
I
D
L
G
D
V
K
I
G
N
G
Y
F
T
I
I
A
G
P
C
S
V
E
G
R
E
M
L
M
E
T
A
H
F
L
S
E
L
G
V
K
V
L
R
G
G
A
Y
K
P
R
T
S
P
Y
S
F
Q
G
L
G
E
K
G
L
E
Y
L
R
E
A
A
D
K
Y
G
M
Y
V
V
T
E
A
L
G
E
D
D
L
P
K
V
A
E
Y
A
D
I
I
Q
I
G
A
R
N
A
Q
N
F
R
L
L
S
K
A
G
S
Y
N
K
P
V
L
L
K
R
G
F
M
N
T
I
E
E
F
L
L
S
A
E
Y
I
A
N
S
G
N
T
K
I
I
L
C
E
R
G
I
--
R
T
F
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
I
R
K
E
S
H
L
P
I
-
L
-
V
D
P
S
H
S
G
G
R
R
D
L
V
I
P
L
S
R
A
A
I
A
V
G
A
H
G
I
I
V
E
V
H
P
--
E
P
E
K
A
L
S
D
G
K
Q
S
L
D
F
E
L
F
K
E
L
---------------------
26
PsiBlast_CBE
71.91
54%
-98
- C3 -
3PG9
2
AROF_THEMA
H:
[71-322]
---------------------------------------------------------------------------------------------------
L
V
S
R
E
F
H
P
E
D
T
V
I
D
L
G
D
V
K
I
G
N
G
Y
F
T
I
I
A
G
P
C
S
V
E
G
R
E
M
L
M
E
T
A
H
F
L
S
E
L
G
V
K
V
L
R
G
G
A
Y
K
P
R
T
S
P
Y
S
F
Q
G
L
G
E
K
G
L
E
Y
L
R
E
A
A
D
K
Y
G
M
Y
V
V
T
E
A
L
G
E
D
D
L
P
K
V
A
E
Y
A
D
I
I
Q
I
G
A
R
N
A
Q
N
F
R
L
L
S
K
A
G
S
Y
N
K
P
V
L
L
K
R
G
F
M
N
T
I
E
E
F
L
L
S
A
E
Y
I
A
N
S
G
N
T
K
I
I
L
C
E
R
G
I
--
R
T
F
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
I
R
K
E
S
H
L
P
I
-
L
-
V
D
P
S
H
S
G
G
R
R
D
L
V
I
P
L
S
R
A
A
I
A
V
G
A
H
G
I
I
V
E
V
H
P
--
E
P
E
K
A
L
S
D
G
K
Q
S
L
D
F
E
L
F
K
E
L
---------------------
28
PsiBlast_CBE
71.85
54%
-94
- C3 -
3PG9
2
AROF_THEMA
F:
[71-322]
---------------------------------------------------------------------------------------------------
L
V
S
R
E
F
H
P
E
D
T
V
I
D
L
G
D
V
K
I
G
N
G
Y
F
T
I
I
A
G
P
C
S
V
E
G
R
E
M
L
M
E
T
A
H
F
L
S
E
L
G
V
K
V
L
R
G
G
A
Y
K
P
R
T
S
P
Y
S
F
Q
G
L
G
E
K
G
L
E
Y
L
R
E
A
A
D
K
Y
G
M
Y
V
V
T
E
A
L
G
E
D
D
L
P
K
V
A
E
Y
A
D
I
I
Q
I
G
A
R
N
A
Q
N
F
R
L
L
S
K
A
G
S
Y
N
K
P
V
L
L
K
R
G
F
M
N
T
I
E
E
F
L
L
S
A
E
Y
I
A
N
S
G
N
T
K
I
I
L
C
E
R
G
I
--
R
T
F
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
I
R
K
E
S
H
L
P
I
-
L
-
V
D
P
S
H
S
G
G
R
R
D
L
V
I
P
L
S
R
A
A
I
A
V
G
A
H
G
I
I
V
E
V
H
P
--
E
P
E
K
A
L
S
D
G
K
Q
S
L
D
F
E
L
F
K
E
L
---------------------
7
PsiBlast_PDB
71.71
53%
-94
- C3 -
4C1K
3
?
A:
[5-248]
-------------------------------------------------------------------------------------------------------
K
E
Y
K
E
K
T
V
V
K
I
N
D
V
K
F
G
E
G
F
T
I
-
I
A
G
P
C
S
I
E
S
R
D
Q
I
M
K
V
A
E
F
L
A
E
V
G
I
K
V
L
R
G
G
A
F
K
P
R
T
S
P
Y
S
F
Q
G
Y
G
E
K
A
L
R
W
M
R
E
A
A
D
E
Y
G
L
V
T
V
T
E
V
M
D
T
R
H
V
E
L
V
A
K
Y
S
D
I
L
Q
I
G
A
R
N
S
Q
N
F
E
L
L
K
E
V
G
K
V
E
N
P
V
L
L
K
R
G
M
G
N
T
I
Q
E
L
L
Y
S
A
E
Y
I
M
A
Q
G
N
E
N
V
I
L
C
E
R
G
I
--
R
T
F
E
-
T
A
T
R
F
T
L
D
I
S
A
V
P
V
V
K
E
L
S
H
L
P
I
-
I
-
V
D
P
S
H
P
A
G
R
R
S
L
V
I
P
L
A
K
A
A
Y
A
I
G
A
D
G
I
M
V
E
V
H
P
--
E
P
E
K
A
L
S
D
S
Q
Q
Q
L
T
F
D
D
F
------------------------
29
PsiBlast_CBE
71.62
54%
-93
- C3 -
3PG9
2
AROF_THEMA
E:
[71-322]
---------------------------------------------------------------------------------------------------
L
V
S
R
E
F
H
P
E
D
T
V
I
D
L
G
D
V
K
I
G
N
G
Y
F
T
I
I
A
G
P
C
S
V
E
G
R
E
M
L
M
E
T
A
H
F
L
S
E
L
G
V
K
V
L
R
G
G
A
Y
K
P
R
T
S
P
Y
S
F
Q
G
L
G
E
K
G
L
E
Y
L
R
E
A
A
D
K
Y
G
M
Y
V
V
T
E
A
L
G
E
D
D
L
P
K
V
A
E
Y
A
D
I
I
Q
I
G
A
R
N
A
Q
N
F
R
L
L
S
K
A
G
S
Y
N
K
P
V
L
L
K
R
G
F
M
N
T
I
E
E
F
L
L
S
A
E
Y
I
A
N
S
G
N
T
K
I
I
L
C
E
R
G
I
--
R
T
F
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
I
R
K
E
S
H
L
P
I
-
L
-
V
D
P
S
H
S
G
G
R
R
D
L
V
I
P
L
S
R
A
A
I
A
V
G
A
H
G
I
I
V
E
V
H
P
--
E
P
E
K
A
L
S
D
G
K
Q
S
L
D
F
E
L
F
K
E
L
---------------------
31
PsiBlast_CBE
71.60
54%
-96
- C3 -
3PG9
2
AROF_THEMA
C:
[71-322]
---------------------------------------------------------------------------------------------------
L
V
S
R
E
F
H
P
E
D
T
V
I
D
L
G
D
V
K
I
G
N
G
Y
F
T
I
I
A
G
P
C
S
V
E
G
R
E
M
L
M
E
T
A
H
F
L
S
E
L
G
V
K
V
L
R
G
G
A
Y
K
P
R
T
S
P
Y
S
F
Q
G
L
G
E
K
G
L
E
Y
L
R
E
A
A
D
K
Y
G
M
Y
V
V
T
E
A
L
G
E
D
D
L
P
K
V
A
E
Y
A
D
I
I
Q
I
G
A
R
N
A
Q
N
F
R
L
L
S
K
A
G
S
Y
N
K
P
V
L
L
K
R
G
F
M
N
T
I
E
E
F
L
L
S
A
E
Y
I
A
N
S
G
N
T
K
I
I
L
C
E
R
G
I
--
R
T
F
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
I
R
K
E
S
H
L
P
I
-
L
-
V
D
P
S
H
S
G
G
R
R
D
L
V
I
P
L
S
R
A
A
I
A
V
G
A
H
G
I
I
V
E
V
H
P
--
E
P
E
K
A
L
S
D
G
K
Q
S
L
D
F
E
L
F
K
E
L
---------------------
103
HHSearch
71.44
50%
-92
- C3 -
1VR6
-
AROF_THEMA
A:
[66-334]
----------------------------------------------------------------------------------------------
L
K
P
Y
K
L
V
S
R
E
F
H
P
E
D
T
V
I
D
L
G
D
V
K
I
G
N
G
Y
F
T
I
I
A
G
P
C
S
V
E
G
R
E
M
L
M
E
T
A
H
F
L
S
E
L
G
V
K
V
L
R
G
G
A
Y
K
P
R
T
S
P
Y
S
F
Q
G
L
G
E
K
G
L
E
Y
L
R
E
A
A
D
K
Y
G
M
Y
V
V
T
E
A
L
G
E
D
D
L
P
K
V
A
E
Y
A
D
I
I
Q
I
G
A
R
N
A
Q
N
F
R
L
L
S
K
A
G
S
Y
N
K
P
V
L
L
K
R
G
F
M
N
T
I
E
E
F
L
L
S
A
E
Y
I
A
N
S
G
N
T
K
I
I
L
C
E
R
G
I
R-
T
F
E
K
-
A
-
T
R
N
T
L
D
I
S
A
V
P
I
I
R
K
E
S
H
L
P
I
-
L
-
V
D
P
S
H
S
G
G
R
R
D
L
V
I
P
L
S
R
A
A
I
A
V
G
A
H
G
I
I
V
E
V
H
P
--
E
P
E
K
A
L
S
D
G
K
Q
S
L
D
F
E
L
F
K
E
L
-----
V
Q
E
M
K
K
L
A
D
A
L
G
----
42
PsiBlast_CBE
71.41
52%
-96
- C3 -
1VS1
2
?
C:
[15-276]
---------------------------------------------------------------------------------------------------
L
A
L
K
S
E
E
R
R
E
T
V
V
E
V
E
G
V
R
I
G
G
G
S
K
A
V
I
A
G
P
C
S
V
E
S
W
E
Q
V
R
E
A
A
L
A
V
K
E
A
G
A
H
M
L
R
G
G
A
F
K
P
R
T
S
P
Y
S
F
Q
G
L
G
L
E
G
L
K
L
L
R
R
A
G
D
E
A
G
L
P
V
V
T
E
V
L
D
P
R
H
V
E
T
V
S
R
Y
A
D
M
L
Q
I
G
A
R
N
M
Q
N
F
P
L
L
R
E
V
G
R
S
G
K
P
V
L
L
K
R
G
F
G
N
T
V
E
E
L
L
A
A
A
E
Y
I
L
L
E
G
N
W
Q
V
V
L
V
E
R
G
I
--
R
T
F
E
-
P
S
T
R
F
T
L
D
V
A
A
V
A
V
L
K
E
A
T
H
L
P
V
-
I
-
V
D
P
S
H
P
A
G
R
R
S
L
V
P
A
L
A
K
A
G
L
A
A
G
A
D
G
L
I
V
E
V
H
P
--
N
P
E
E
A
L
S
D
A
K
Q
Q
L
T
P
G
E
F
A
R
L
M
G
E
L
R
W
H
R
L
L
-----------
40
PsiBlast_CBE
71.40
53%
-93
- C3 -
4C1L
6
?
B:
[5-248]
-------------------------------------------------------------------------------------------------------
K
E
Y
K
E
K
T
V
V
K
I
N
D
V
K
F
G
E
G
F
T
I
-
I
A
G
P
C
S
I
E
S
R
D
Q
I
M
K
V
A
E
F
L
A
E
V
G
I
K
V
L
R
G
G
A
F
K
P
R
T
S
P
Y
S
F
Q
G
Y
G
E
K
A
L
R
W
M
R
E
A
A
D
E
Y
G
L
V
T
V
T
E
V
M
D
T
R
H
V
E
L
V
A
K
Y
S
D
I
L
Q
I
G
A
R
N
S
Q
N
F
E
L
L
K
E
V
G
K
V
E
N
P
V
L
L
K
R
G
M
G
N
T
I
Q
E
L
L
Y
S
A
E
Y
I
M
A
Q
G
N
E
N
V
I
L
C
E
R
G
I
--
R
T
F
E
-
T
A
T
R
F
T
L
D
D
S
A
V
P
V
V
K
E
L
S
H
L
P
I
-
I
-
V
D
P
S
H
P
A
G
R
R
S
L
V
I
P
L
A
K
A
A
Y
A
I
G
A
D
G
I
M
V
E
V
H
P
--
E
P
E
K
A
L
S
D
S
Q
Q
Q
L
T
F
D
D
F
------------------------
86
Fugue
71.37
44%
-78
- C3 -
1RZM
3
AROF_THEMA
A:
[1-338]
M
I
V
V
L
K
P
G
S
T
E
E
D
I
R
K
V
V
K
L
A
E
S
Y
N
L
K
C
H
I
S
K
G
Q
E
R
T
V
I
G
-
I
I
G
D
D
R
Y
V
V
A
D
K
F
E
S
L
D
C
V
E
S
V
V
R
V
L
----------------------------
K
P
Y
K
L
V
S
R
E
F
H
P
E
D
T
V
I
D
L
G
D
V
K
I
G
N
G
Y
F
T
I
I
A
G
P
C
S
V
E
G
R
E
M
L
M
E
T
A
H
F
L
S
E
L
G
V
K
V
L
R
G
G
A
Y
K
P
R
T
S
P
Y
S
F
Q
G
L
G
E
K
G
L
E
Y
L
R
E
A
A
D
K
Y
G
M
Y
V
V
T
E
A
L
G
E
D
D
L
P
K
V
A
E
Y
A
D
I
I
Q
I
G
A
R
N
A
Q
N
F
R
L
L
S
K
A
G
S
Y
N
K
P
V
L
L
K
R
G
F
M
N
T
I
E
E
F
L
L
S
A
E
Y
I
A
N
S
G
N
T
K
I
I
L
C
E
R
G
I
--
R
T
F
E
-
K
A
T
R
N
T
L
D
I
S
A
V
P
I
I
R
K
E
S
H
L
P
I
-
L
-
V
D
P
S
H
S
G
G
R
R
D
L
V
I
P
L
S
R
A
A
I
A
V
G
A
H
G
I
I
V
E
V
H
P
--
E
P
E
K
A
L
S
D
G
K
Q
S
L
D
F
E
L
F
K
E
L
-----
V
Q
E
M
K
K
L
A
D
A
L
G
V
K
V
N
39
PsiBlast_CBE
71.36
53%
-96
- C3 -
1ZCO
3
?
B:
[5-248]
-------------------------------------------------------------------------------------------------------
K
E
Y
D
E
K
T
V
V
K
I
N
D
V
K
F
G
E
G
F
T
I
-
I
A
G
P
C
S
I
E
S
R
E
Q
I
M
K
V
A
E
F
L
A
E
V
G
I
K
V
L
R
G
G
A
F
K
P
R
T
S
P
Y
S
F
Q
G
Y
G
E
K
A
L
R
W
M
R
E
A
A
D
E
Y
G
L
V
T
V
T
E
V
M
D
T
R
H
V
E
L
V
A
K
Y
S
D
I
L
Q
I
G
A
R
N
S
Q
N
F
E
L
L
K
E
V
G
K
V
E
N
P
V
L
L
K
R
G
M
G
N
T
I
Q
E
L
L
Y
S
A
E
Y
I
M
A
Q
G
N
E
N
V
I
L
C
E
R
G
I
--
R
T
F
E
-
T
A
T
R
F
T
L
D
I
S
A
V
P
V
V
K
E
L
S
H
L
P
I
-
I
-
V
D
P
S
H
P
A
G
R
R
S
L
V
I
P
L
A
K
A
A
Y
A
I
G
A
D
G
I
M
V
E
V
H
P
--
E
P
E
K
A
L
S
D
S
Q
Q
Q
L
T
F
D
D
F
------------------------
43
PsiBlast_CBE
71.05
52%
-98
- C3 -
1VS1
2
?
B:
[15-276]
---------------------------------------------------------------------------------------------------
L
A
L
K
S
E
E
R
R
E
T
V
V
E
V
E
G
V
R
I
G
G
G
S
K
A
V
I
A
G
P
C
S
V
E
S
W
E
Q
V
R
E
A
A
L
A
V
K
E
A
G
A
H
M
L
R
G
G
A
F
K
P
R
T
S
P
Y
S
F
Q
G
L
G
L
E
G
L
K
L
L
R
R
A
G
D
E
A
G
L
P
V
V
T
E
V
L
D
P
R
H
V
E
T
V
S
R
Y
A
D
M
L
Q
I
G
A
R
N
M
Q
N
F
P
L
L
R
E
V
G
R
S
G
K
P
V
L
L
K
R
G
F
G
N
T
V
E
E
L
L
A
A
A
E
Y
I
L
L
E
G
N
W
Q
V
V
L
V
E
R
G
I
--
R
T
F
E
-
P
S
T
R
F
T
L
D
V
A
A
V
A
V
L
K
E
A
T
H
L
P
V
-
I
-
V
D
P
S
H
P
A
G
R
R
S
L
V
P
A
L
A
K
A
G
L
A
A
G
A
D
G
L
I
V
E
V
H
P
--
N
P
E
E
A
L
S
D
A
K
Q
Q
L
T
P
G
E
F
A
R
L
M
G
E
L
R
W
H
R
L
L
-----------
10
PsiBlast_PDB
70.90
52%
-96
- C3 -
1VS1
2
?
A:
[15-276]
---------------------------------------------------------------------------------------------------
L
A
L
K
S
E
E
R
R
E
T
V
V
E
V
E
G
V
R
I
G
G
G
S
K
A
V
I
A
G
P
C
S
V
E
S
W
E
Q
V
R
E
A
A
L
A
V
K
E
A
G
A
H
M
L
R
G
G
A
F
K
P
R
T
S
P
Y
S
F
Q
G
L
G
L
E
G
L
K
L
L
R
R
A
G
D
E
A
G
L
P
V
V
T
E
V
L
D
P
R
H
V
E
T
V
S
R
Y
A
D
M
L
Q
I
G
A
R
N
M
Q
N
F
P
L
L
R
E
V
G
R
S
G
K
P
V
L
L
K
R
G
F
G
N
T
V
E
E
L
L
A
A
A
E
Y
I
L
L
E
G
N
W
Q
V
V
L
V
E
R
G
I
--
R
T
F
E
-
P
S
T
R
F
T
L
D
V
A
A
V
A
V
L
K
E
A
T
H
L
P
V
-
I
-
V
D
P
S
H
P
A
G
R
R
S
L
V
P
A
L
A
K
A
G
L
A
A
G
A
D
G
L
I
V
E
V
H
P
--
N
P
E
E
A
L
S
D
A
K
Q
Q
L
T
P
G
E
F
A
R
L
M
G
E
L
R
W
H
R
L
L
-----------
8
PsiBlast_PDB
70.24
53%
-91
- C3 -
1ZCO
2
?
A:
[5-248]
-------------------------------------------------------------------------------------------------------
K
E
Y
D
E
K
T
V
V
K
I
N
D
V
K
F
G
E
G
F
T
I
-
I
A
G
P
C
S
I
E
S
R
E
Q
I
M
K
V
A
E
F
L
A
E
V
G
I
K
V
L
R
G
G
A
F
K
P
R
T
S
P
Y
S
F
Q
G
Y
G
E
K
A
L
R
W
M
R
E
A
A
D
E
Y
G
L
V
T
V
T
E
V
M
D
T
R
H
V
E
L
V
A
K
Y
S
D
I
L
Q
I
G
A
R
N
S
Q
N
F
E
L
L
K
E
V
G
K
V
E
N
P
V
L
L
K
R
G
M
G
N
T
I
Q
E
L
L
Y
S
A
E
Y
I
M
A
Q
G
N
E
N
V
I
L
C
E
R
G
I
--
R
T
F
E
-
T
A
T
R
F
T
L
D
I
S
A
V
P
V
V
K
E
L
S
H
L
P
I
-
I
-
V
D
P
S
H
P
A
G
R
R
S
L
V
I
P
L
A
K
A
A
Y
A
I
G
A
D
G
I
M
V
E
V
H
P
--
E
P
E
K
A
L
S
D
S
Q
Q
Q
L
T
F
D
D
F
------------------------
96
HHSearch
69.89
49%
-96
- C3 -
1VS1
2
?
A:
[10-275]
----------------------------------------------------------------------------------------------
F
K
G
V
K
L
A
L
K
S
E
E
R
R
E
T
V
V
E
V
E
G
V
R
I
G
G
G
S
K
A
V
I
A
G
P
C
S
V
E
S
W
E
Q
V
R
E
A
A
L
A
V
K
E
A
G
A
H
M
L
R
G
G
A
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-
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--
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-----
M
G
E
L
R
W
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L
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