@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 : bsu02400: (2016-06-04 )
MNSAHNKNETTFQRSMKSRHLFMLSLGGVIGTGLFLSSGYTIQQAGPAGTILAYLVGAGIVYLVMLCLGELSVAMPVTGAFHTYAAKYIGPGTGFTVAWLYWLTWTVALGSEFTAAGLLMQRWFPHTSVWMWSAVFALFIFLLNAFSVKFFAESEFWFSSIKVLAIVLFILLGGSAMFGIIPIKGGEAAPMLSNFTAEGGLFPNGFVPILMTMLSVNFAFSGTELIGIAAGESVDPDKTIPKAIKTTVWRLSLFFVGTIFVLSGLIPIQDAGVIKSPFVAVFDRVGVPYAADIMNFVILTAILSAANSGLYASSRMLWSLSKEKTLHPTFAKLTSKGTPFNALVFSMIGGILSLLSSVFAPDTVYVVLVSISGFAVVVVWMGIAASQFMFRKRYIEAGNKVTDLKYRTPLYPFVPIAAFLLCLASVVGIAFDPNQRIALYCGVPFMAICYAIYYVKNRKSQPAADMTHSK
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------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MNSAHNKN
E
T
T
F
Q
R
S
MKSR
H
L
F
M
L
SLG
G
V
IGT
G
L
F
LSSG
Y
T
I
QQAGP
A
G
T
I
L
A
Y
L
V
------
G
A
G
I
-
V
Y
L
V
M
L
C
L
G
E
L
SV---AMP-VT
G
A
F
H
T
Y
-
A
A
K
YIGP-GT-G
F
T
V
A
W
L
Y
W
L
-
T
W
T
V
ALGS---E
F
T
A
-
A
G
L
L
M
Q
R
-------WFP----H-
T
-----
S
---
V
---
W
M
W
S
A
V
F
A
L
F
I
F
-
L
L
N
AF
S
V
---
K
F
F
AE
S
E
F
W
F
S
S
I
K
V
L
A
I
V
L
F
I
L
LGG
S
A
M
F
G
-------
I
I
P
IKGGEAAP
M
L
SNFTAEGGLFPN-
G
F
V
P
I
L
-------
M
T
M
L
S
V
N
F
AFSG
T
E
---
L
I
G
I
AAGESVDPDK
T
I
P
K
A
I
K
--
T
T
V
W
R
L
S
L
F
F
V
G
T
----------------------
I
F
V
L
SGLIPIQD----AG-V-I---KS
P
F
V
A
V
F
D
RVG--V--
P
Y
----------------
A
A
D
I
M
N
F
V
I
----
L
T
A
I
L
S
A
ANSGL
Y
-
A
S
S
R
M
L
W
SL--SKEKTL
H
P
T
F
A
K
-----------LTSK-GT
P
F
N
A
L
V
--
F
S
M
I
G
G
I
L
S
L
L
S
-
S
V-----------FAP---
D
T
V
--
Y
V
V
L
V
--SISGFA
V
V
V
V
W
M
G
I
A
-
A
S
Q
F
M
F
R
K
R
Y
I
EAGN
K
V
T
D
L
K
-YRTPLY----
P
F
V
P
I
-
A
A
F
L
L
C
L
A
S
V
V
G
I
AFD----------------PN
Q
R
I
A
L
Y
C-G
V
P
F
M
A
I
C
--
Y
A
I
Y
Y
VKNRKSQPAADMTHSK--------
5
PsiBlast_PDB
87.80
24%
-152
- C5 -
3L1L
2
ADIC_ECO57
A:
[21-440]
--------------------------
G
A
I
M
G
S
G
V
F
L
L
P
A
N
L
A
S
T
G
G
I
A
--
I
Y
G
W
L
V
T
I
I
G
A
L
G
L
S
M
-
V
Y
------
A
K
M
S
F
---
L
D
P
-
S
P
G
G
S
Y
A
Y
-
A
R
R
C
F
G
P
-
F
L
-
G
Y
Q
T
N
V
L
Y
W
L
A
C
W
I
G
N
I
A
M
---
V
V
I
G
-
V
G
Y
L
-
S
Y
-------
F
F
P
ILK-
D
-
P
-----
W
---
V
---
L
T
I
T
C
V
V
V
L
W
I
F
V
L
L
N
I
V
G
P
---
K
M
I
T
R
V
Q
------
A
V
A
T
V
L
A
L
I
P
I
V
G
I
A
V
F
G
-------
W
F
W
F
R
G
-
E
T
Y
M
A
-----------------
A
I
Q
-------
S
T
L
N
V
T
L
W
S
F
I
G
V
E
---
S
A
S
V
A
A
G
V
V
K
N
P
K
R
N
V
P
I
A
T
I
--
G
G
V
L
I
A
A
V
C
Y
V
L
S
----------------------
T
T
A
I
M
G
M
I
P
N
A
A
----
L
R
-
V
-
S
---
A
S
P
F
G
D
A
A
R
M
A
L
--
G
--
D
T
----------------
A
G
A
I
V
S
F
C
A
----
A
A
G
C
L
G
S
L
G
G
W
T
L
-
L
A
G
Q
T
A
K
A
A
--
A
D
D
G
L
F
P
P
I
F
A
R
-----------
V
N
K
A
-
G
T
P
V
A
G
L
I
--
I
V
G
I
L
M
T
I
F
Q
L
S
-
S
I
-----------
S
P
N
---
A
T
K
--
E
F
G
L
V
S
-
S
V
S
V
I
F
T
L
V
P
Y
L
Y
T
C
-
A
A
L
L
L
L
G
H
G
H
F
G
--------
K
-
A
R
-
P
A
Y
----
L
A
V
T
T
-
I
A
F
L
Y
C
I
W
A
V
V
G
--------------------
S
G
A
K
E
V
M
W
S
-
F
V
T
L
M
V
I
T
A
M
Y
A
L
N
Y
N
R
L
H
K
N
P
Y
P
L
D
A
------------
1
PsiBlast_PDB
87.27
25%
-150
- C5 -
3OB6
1
ADIC_ECOLI
A:
[21-440]
--------------------------
G
N
I
M
G
S
G
V
F
L
L
P
A
N
L
A
S
T
G
G
I
A
--
I
Y
G
W
L
V
T
I
I
G
A
L
G
L
S
M
-
V
Y
------
A
K
M
S
F
---
L
D
P
-
S
P
G
G
S
Y
A
Y
-
A
R
R
C
F
G
P
-
F
L
-
G
Y
Q
T
N
V
L
Y
W
L
A
C
W
I
G
A
I
A
M
---
V
V
I
G
-
V
G
Y
L
-
S
Y
-------
F
F
P
ILK-
D
-
P
-----
L
---
V
---
L
T
I
T
C
V
V
V
L
W
I
F
V
L
L
N
I
V
G
P
---
K
M
I
T
R
V
Q
------
A
V
A
T
V
L
A
L
I
P
I
V
G
I
A
V
F
G
-------
W
F
W
F
R
G
-
E
T
Y
M
A
A
W
N
V
S
G
L
G
T
------
F
G
A
I
Q
-------
S
T
L
N
V
T
L
W
S
F
I
G
V
E
---
S
A
S
V
A
A
G
V
V
K
N
P
K
R
N
V
P
I
A
T
I
--
G
G
V
L
I
A
A
V
C
Y
V
L
S
----------------------
T
T
A
I
M
G
M
I
P
N
A
A
----
L
R
-
V
-
S
---
A
S
P
F
G
D
A
A
R
M
A
L
--
G
--
D
T
----------------
A
G
A
I
V
S
F
C
A
----
A
A
G
C
L
G
S
L
G
G
W
T
L
-
L
A
G
Q
T
A
K
A
A
--
A
D
D
G
L
F
P
P
I
F
A
R
-----------
V
N
K
A
-
G
T
P
V
A
G
L
I
--
I
V
G
I
L
M
T
I
F
Q
L
S
-
S
I
-----------
S
P
-----------
G
L
V
S
-
S
V
S
V
I
F
T
L
V
P
Y
L
Y
T
C
-
A
A
L
L
L
L
G
H
G
H
F
G
--------
K
-
A
R
-
P
A
Y
----
L
A
V
T
T
-
I
A
F
L
Y
C
I
W
A
V
V
G
--------------------
S
G
A
K
E
V
M
W
S
-
F
V
T
L
M
V
I
T
A
M
Y
A
L
N
Y
N
R
L
H
K
N
P
Y
P
L
D
A
------------
15
HHSearch
83.80
20%
-157
- C5 -
3L1L
2
ADIC_ECO57
A:
[7-403]
------------
A
H
K
V
G
L
I
P
V
T
L
M
V
S
G
A
I
M
G
S
G
V
F
L
L
P
A
N
L
A
S
-
T
G
G
I
-
A
I
Y
G
W
L
V
------
T
I
I
G
-
A
L
G
L
S
M
V
Y
A
K
M
S
F
---
L
D
P
-
S
P
G
G
S
Y
A
Y
-
A
R
R
C
F
G
P
-
F
L
-
G
Y
Q
T
N
V
L
Y
W
L
-
A
C
W
I
G
N
I
A
---
M
V
V
I
-
G
V
G
Y
L
S
Y
-------
F
F
P
----
I
-
L
K----
D
---
P
W
V
L
T
I
T
C
V
V
V
L
W
I
F
V
-
L
L
N
I
V
G
P
---
K
M
I
T
R
V
Q
A
V
A
T
V
L
A
L
I
P
I
V
G
I
A
V
F
G
W
F
W
F
R
G
-----------
E
------
T
Y
M
A
--------------
A
I
Q
-------
S
T
L
N
V
T
L
W
S
F
I
G
V
E
---
S
A
S
V
A
A
G
V
V
K
N
P
K
R
N
V
P
I
A
T
I
--
G
G
V
L
I
A
A
V
C
Y
V
L
S
----------------------
T
T
A
I
M
G
M
I
P
N
A
A
----
L
R
-
V
-
S
---
A
S
P
F
G
D
A
A
R
M
A
L
--
G
--
D
T
----------------
A
G
A
I
V
S
F
C
A
----
A
A
G
C
L
G
S
L
G
G
W
T
L
-
L
A
G
Q
T
A
K
A
A
--
A
D
D
G
L
F
P
P
I
F
A
R
-----------
V
N
K
A
-
G
T
P
V
A
G
L
I
--
I
V
G
I
L
M
T
I
F
Q
L
S
-
S
I
S----------
P
N
A
---
T
K
E
--
F
G
L
V
S
--
S
V
S
V
I
F
T
L
V
P
Y
L
Y
T
C
-
A
A
L
L
L
L
G
H
G
H
F
G
K
-----
A
R
P
-
A
----
Y
----
L
A
V
T
T
-
I
A
F
L
Y
C
I
W
A
V
V
----------------------------------------------------------------------
2
PsiBlast_PDB
81.94
23%
-153
- C5 -
3NCY
-
ADIC_SALTY
A:
[21-404]
--------------------------
G
N
I
M
G
S
G
V
F
L
L
P
A
N
L
A
A
T
G
G
I
A
--
I
Y
G
W
L
V
------
T
I
I
G
-
A
L
A
L
S
M
V
Y
A
K
M
S
S
---
L
D
P
-
S
P
G
G
S
Y
A
Y
-
A
R
R
C
F
G
P
-
F
L
-
G
Y
Q
T
N
V
L
Y
W
L
A
C
W
I
G
N
I
A
M
---
V
V
I
G
-
V
G
Y
L
-
S
Y
-------
F
F
P
ILK-
D
-
P
-----
L
---
V
---
L
T
L
T
C
V
A
V
L
W
I
F
V
L
L
N
I
V
G
P
---
K
M
I
T
R
V
Q
---
A
V
A
T
V
L
A
L
V
P
I
V
---
G
I
A
V
F
G
-------
W
F
W
F
K
G
E
--------
W
N
V
S
G
---
M
N
-
T
F
G
A
I
Q
-------
S
T
L
N
V
T
L
W
S
F
I
G
V
E
---
S
A
S
V
A
A
G
V
V
K
N
P
K
R
N
V
P
I
A
T
I
--
G
G
V
L
I
A
A
V
C
Y
V
L
S
----------------------
T
T
A
I
M
G
M
I
P
N
A
A
----
L
R
-
V
-
S
---
A
S
P
F
G
D
A
A
R
M
A
L
--
G
--
D
T
----------------
A
G
A
I
V
S
F
C
A
----
A
A
G
C
L
G
S
L
G
G
W
T
L
-
L
A
G
Q
T
A
K
A
A
--
A
D
D
G
L
F
P
P
I
F
A
R
-----------------
T
P
V
A
G
L
L
----
I
V
G
V
L
M
T
I
F
Q
F
S
S
-----------
M
S
P
---
N
A
A
K
E
F
G
L
V
S
--
S
V
S
V
I
F
T
L
V
P
Y
L
Y
T
C
-
A
A
L
L
L
L
G
H
G
H
F
G
--------
K
-
A
R
-
P
L
Y
----
L
L
I
T
F
-
V
A
F
V
Y
C
I
W
A
V
I
G
---------------------------------------------------------------------
3
PsiBlast_PDB
81.20
24%
-139
- C5 -
3LRB
-
ADIC_ECO57
A:
[21-435]
--------------------------
G
N
I
M
G
S
G
V
F
L
L
P
A
N
L
A
S
T
G
G
I
A
--
I
Y
G
W
L
V
T
I
I
G
A
L
G
L
S
M
-
V
Y
------
A
K
M
S
F
---
L
D
P
-
S
P
G
G
S
Y
A
Y
-
A
R
R
C
F
G
P
-
F
L
-
G
Y
Q
T
N
V
L
Y
W
L
A
C
W
I
G
N
I
A
M
---
V
V
I
G
-
V
G
Y
L
-
S
Y
-------
F
F
P
ILK-
D
-
P
-----
L
---
V
---
L
T
I
T
C
V
V
V
L
W
I
F
V
L
L
N
I
V
G
P
---
K
M
I
T
R
V
Q
------
A
V
A
T
V
L
A
L
I
P
I
V
G
I
A
V
F
G
-------
W
F
W
F
R
G
-
E
T
Y
M
A
A
W
N
V
S
G
L
G
T
------
F
G
A
I
Q
-------
S
T
L
N
V
T
L
W
S
F
I
G
V
E
---
S
A
S
V
A
A
G
V
V
K
N
P
K
R
N
V
P
I
A
T
I
--
G
G
V
L
I
A
A
V
C
Y
V
L
S
----------------------
T
T
A
I
M
G
M
I
P
N
---------------------------------
T
----------------
A
G
A
I
V
S
F
C
A
----
A
A
G
C
L
G
S
L
G
G
W
T
L
-
L
A
G
Q
T
A
K
A
A
--
A
D
D
G
L
F
P
P
I
F
A
R
-----------
V
N
K
A
-
G
T
P
V
A
G
L
I
--
I
V
G
I
L
M
T
I
F
Q
L
S
-
S
I
-----------
S
P
N
---
A
T
K
--
E
F
G
L
V
S
-
S
V
S
V
I
F
T
L
V
P
Y
L
Y
T
C
-
A
A
L
L
L
L
G
H
G
H
F
G
--------
K
-
A
R
-
P
A
Y
----
L
A
V
T
T
-
I
A
F
L
Y
C
I
W
A
V
V
G
--------------------
S
G
A
K
E
V
M
W
S
-
F
V
T
L
M
V
I
T
A
M
Y
A
L
N
Y
N
R
L
H
K
N
P
-----------------
4
PsiBlast_PDB
81.11
24%
-140
- C5 -
3LRC
-
ADIC_ECO57
A:
[21-435]
--------------------------
G
N
I
M
G
S
G
V
F
L
L
P
A
N
L
A
S
T
G
G
I
A
--
I
Y
G
W
L
V
T
I
I
G
A
L
G
L
S
M
-
V
Y
------
A
K
M
S
F
---
L
D
P
-
S
P
G
G
S
Y
A
Y
-
A
R
R
C
F
G
P
-
F
L
-
G
Y
Q
T
N
V
L
Y
W
L
A
C
W
I
G
N
I
A
M
---
V
V
I
G
-
V
G
Y
L
-
S
Y
-------
F
F
P
ILK-
D
-
P
-----
L
---
V
---
L
T
I
T
C
V
V
V
L
W
I
F
V
L
L
N
I
V
G
P
---
K
M
I
T
R
V
Q
------
A
V
A
T
V
L
A
L
I
P
I
V
G
I
A
V
F
G
-------
W
F
W
F
R
G
-
E
T
Y
M
A
A
W
N
V
S
G
L
G
T
------
F
G
A
I
Q
-------
S
T
L
N
V
T
L
W
S
F
I
G
V
E
---
S
A
S
V
A
A
G
V
V
K
N
P
K
R
N
V
P
I
A
T
I
--
G
G
V
L
I
A
A
V
C
Y
V
L
S
----------------------
T
T
A
I
M
G
M
I
P
N
---------------------------------
T
----------------
A
G
A
I
V
S
F
C
A
----
A
A
G
C
L
G
S
L
G
G
W
T
L
-
L
A
G
Q
T
A
K
A
A
--
A
D
D
G
L
F
P
P
I
F
A
R
-----------
V
N
K
A
-
G
T
P
V
A
G
L
I
--
I
V
G
I
L
M
T
I
F
Q
L
S
-
S
I
-----------
S
P
N
---
A
T
K
--
E
F
G
L
V
S
-
S
V
S
V
I
F
T
L
V
P
Y
L
Y
T
C
-
A
A
L
L
L
L
G
H
G
H
F
G
--------
K
-
A
R
-
P
A
Y
----
L
A
V
T
T
-
I
A
F
L
Y
C
I
W
A
V
V
G
--------------------
S
G
A
K
E
V
M
W
S
-
F
V
T
L
M
V
I
T
A
M
Y
A
L
N
Y
N
R
L
H
K
N
P
-----------------
24
Fugue
77.36
16%
-165
- C5 -
3GIA
7
Y609_METJA
A:
[3-435]
----------
L
K
N
K
K
L
S
L
W
E
A
V
S
M
A
V
G
V
M
I
G
A
S
I
F
S
I
F
G
V
G
A
K
I
A
G
R
N
-
L
P
E
T
F
I
L
------
S
G
I
Y
-
A
L
L
V
A
Y
S
Y
T
K
L
G
A
---
K
I
V
-
S
N
A
G
P
I
A
F
-
I
H
K
A
I
G
D
N
I
I
-
T
G
A
L
S
I
L
L
W
M
-
S
Y
V
I
S
I
A
L
---
F
A
K
G
F
A
G
Y
F
L
P
L
-------
I
N
A
----
P
-
I
-----
N
---
T
---
F
N
I
A
I
T
E
I
G
I
V
A
-
F
F
T
A
L
N
F
FG
S
K
A
V
G
R
A
E
F
F
I
V
L
V
K
L
L
I
L
G
L
F
I
F
A
G
L
I
T
-------------
I
H
P
S
Y
V
I
P
D
L
A
---------
P
S
-
A
V
S
G
M
I
-------
F
A
S
A
I
F
F
L
S
Y
M
G
F
G
---
V
I
T
N
A
S
E
H
I
E
N
P
K
K
N
V
P
R
A
I
F
--
I
S
I
L
I
V
M
F
V
Y
V
G
V
----------------------
A
I
S
A
I
G
N
L
P
I
D
E
----
L
I
-
K
A
S
---
E
N
A
L
A
V
A
A
K
P
F
L
--
G
--
N
L
----------------
G
F
L
L
I
S
I
G
A
----
L
F
S
I
S
S
A
M
N
A
T
I
Y
-
G
G
A
N
V
A
Y
S
L
--
A
K
D
G
E
L
P
E
F
F
E
R
-----------
K
V
W
F
K
S
T
E
G
L
Y
I
T
--
S
A
L
G
V
L
F
A
L
L
F
N
-------------------------
M
E
G
V
A
--
S
I
T
S
A
V
F
M
V
I
Y
L
F
V
I
-
L
S
H
Y
I
L
I
D
E
V
--------
G
G
R
-
K
E
I
V
I
F
----
S
F
I
V
V
-
L
G
V
F
L
L
L
L
Y
Y
Q
W
I
T
N
R
----------------
F
V
F
Y
G
I
I
A
T
-
F
I
G
V
L
I
----
F
E
I
I
Y
R
K
V
T
K
R
T
F
S
N
N
M
Y
V
K
S
--------
13
HHSearch
70.98
17%
-154
- C5 -
3GIA
6
Y609_METJA
A:
[3-370]
----------
L
K
N
K
K
L
S
L
W
E
A
V
S
M
A
V
G
V
M
I
G
A
S
I
F
S
I
F
G
V
G
A
K
I
A
G
R
N
-
L
P
E
T
F
I
L
------
S
G
I
Y
-
A
L
L
V
A
Y
S
Y
T
K
L
G
A
---
K
I
V
-
S
N
A
G
P
I
A
F
-
I
H
K
A
I
G
D
-
N
I
I
T
G
A
L
S
I
L
L
W
M
-
S
Y
V
I
S
I
A
L
---
F
A
K
G
-
F
A
G
Y
F
L
P
-------
L
I
N
----
A
P
I
-----
N
T
F
N
I
---
A
I
T
E
I
G
I
V
A
F
F
T
-
A
L
N
F
F
G
S
---
K
A
V
G
R
A
E
F
F
I
V
L
V
K
L
L
I
L
G
L
F
I
F
A
G
L
I
T
I
--------------------
H
P
S
Y
V
I
--
P
D
L
A
P
S
-
A
V
S
G
M
I
-------
F
A
S
A
I
F
F
L
S
Y
M
G
F
G
---
V
I
T
N
A
S
E
H
I
E
N
P
K
K
N
V
P
R
A
I
F
--
I
S
I
L
I
V
M
F
V
Y
V
G
V
----------------------
A
I
S
A
I
G
N
L
P
I
D
E
----
L
I
K
A
-
S
---
E
N
A
L
A
V
A
A
K
P
F
L
--
G
--
N
L
----------------
G
F
L
L
I
S
I
G
A
----
L
F
S
I
S
S
A
M
N
A
T
I
Y
-
G
G
A
N
V
A
Y
S
L
--
A
K
D
G
E
L
P
E
F
F
E
R
-----------
K
V
W
F
-
K
S
T
-
E
G
L
Y
--
I
T
S
A
L
G
V
L
F
A
L
L
---------------------
F
N
--
M
E
G
V
A
--
S
I
T
S
A
V
F
M
V
I
Y
L
F
V
I
-
L
S
H
Y
I
L
I
D
E
V
G
------------------------------------------------------------------------------------------------------------
25
Fugue
67.96
12%
-173
- C5 -
4DJK
-
GADC_ECOLI
A:
[12-501]
-----
Q
L
T
L
L
G
F
F
A
I
T
A
S
M
V
M
A
V
Y
E
Y
P
T
F
A
T
S
G
---------------
F
S
L
V
F
F
L
L
------
L
G
G
I
-
L
W
F
I
P
V
G
L
C
A
A
E
M
---
A
T
V
-
D
G
W
G
V
F
A
W
-
V
S
N
T
L
G
P
-
R
W
-
G
F
A
A
I
S
F
G
Y
L
-
Q
I
A
I
G
F
I
P
---
M
L
Y
F
-
V
L
G
A
L
S
Y
-------
I
L
K
----
W
------------------
P
A
L
N
E
D
P
I
T
-
K
T
I
A
A
L
I
---
I
L
W
A
L
A
L
T
Q
F
G
G
T
K
Y
T
A
R
I
-------
A
K
V
G
F
-------
F
A
G
I
L
L
P
A
F
I
L
I
A
L
A
A
I
Y
L
H
T
F
F
P
D
F
S
K
V
G
T
L
-------
V
V
F
V
A
F
I
L
S
Y
M
G
V
E
---
A
S
A
T
H
V
N
E
M
S
N
P
G
R
D
Y
P
L
A
M
L
--
L
L
M
V
A
A
I
C
L
S
S
V
G
----------------------
G
L
S
I
A
M
V
I
P
G
N
E
INLS
A
G
-
V
-
M
---
Q
T
-
F
T
V
L
M
S
H
V
A
PE
I
--
E
W
----------------
T
V
R
V
I
S
A
L
L
----
L
L
G
V
L
A
E
I
A
S
W
I
V
-
G
P
S
R
G
M
Y
V
T
--
A
Q
K
N
L
L
P
A
A
F
A
K
-----------
M
N
K
N
-
G
V
P
V
T
L
V
I
--
S
Q
L
V
I
T
S
I
A
L
I
I
-
L
T
-----------
N
T
G
GG
N
N
M
S
--
F
L
I
A
L
--
A
L
T
V
V
I
Y
L
C
A
Y
F
M
L
F
-
I
G
Y
I
V
L
V
L
K
H
P
D
L
K
R
T
F
N
I
P
G
-
G
K
G
V
K
L
----
V
V
A
I
V
-
G
L
L
T
S
I
M
A
F
I
V
S
--
F
L
----------------
P
P
D
N
I
Q
G
D
S
-
T
D
M
Y
V
E
L
L
--
V
V
S
F
L
V
V
L
A
L
P
F
I
L
Y
A
V
H
F
F
L
HPRARSP-
14
HHSearch
65.69
13%
-182
- C5 -
4DJK
-
GADC_ECOLI
A:
[12-458]
--------------
Q
L
T
L
L
G
F
F
A
I
T
A
S
M
V
M
A
--
V
Y
E
Y
P
--
T
F
A
T
S
G
F
S
-
L
V
F
F
L
L
L
------
G
G
I
L
W
F
I
P
V
G
L
C
A
A
E
M
A
T
---
V
D
G
W---
G
V
F
A
W
-
V
S
N
T
L
G
P
-
R
W
-
G
F
A
A
I
S
F
G
Y
L
-
Q
I
A
I
G
F
I
P
M
L
Y
F
V
L
G
-
A
L
S
Y
I
L
K
-------
W
-
P
----
A
-
L
NEDP
I
T
---
K
---
T
I
A
A
L
I
I
L
W
A
L
A
-
L
T
Q
F
G
G
T
---
K
Y
T
A
R
I
A
K
V
G
F
F
A
G
I
L
L
P
A
F
I
L
I
A
L
A
A
I
Y
L
H
--------------------------
T
F
F
P
D
F
-
S
K
V
G
T
L
-------
V
V
F
V
A
F
I
L
S
Y
M
G
V
E
---
A
S
A
T
H
V
N
E
M
S
N
P
G
R
D
Y
P
L
A
M
L
--
L
L
M
V
A
A
I
C
L
S
S
V
G
----------------------
G
L
S
I
A
M
V
I
P
G
N
E
----
I
N
-
L
-
S
A
G
V
M
Q
T
F
T
V
L
M
S
H
V
A
--
P
EI
E
W
----------------
T
V
R
V
I
S
A
L
L
----
L
L
G
V
L
A
E
I
A
S
W
I
V
-
G
P
S
R
G
M
Y
V
T
--
A
Q
K
N
L
L
P
A
A
F
A
K
-----------
M
N
K
N
-
G
V
P
V
T
L
V
I
--
S
Q
L
V
I
T
S
I
A
L
I
I
-
L
T
N
----------
T
G
G
---
G
N
N
--
M
S
F
L
I
A
L
A
L
T
V
V
I
Y
L
C
A
Y
F
M
L
F
-
I
G
Y
I
V
L
V
L
K
H
P
D
L
-----
K
R
T
-
F
N
I
P
G
G
K
G
V
K
L
V
V
A
I
-
V
G
L
L
T
S
I
M
A
F
I
V
S
F
L
P
----------------
P
------------------------------------------------
31
Fugue
60.50
17%
-114
- C2 -
4WW4
1
?
A:
[3-458]
-
Q
I
S
E
V
R
G
N
T
R
D
H
R
T
A
A
H
T
H
--------
I
K
G
L
G
L
N
S
S
G
I
A
E
K
Q
A
A
G
F
V
G
Q
C
A
A
R
E
A
------
C
G
V
V
-
V
D
L
I
K
A
H
---------
K
M
A
-
G
R
G
V
L
L
A
G
------
G
P
-
G
T
-
G
---
K
T
A
L
A
L
-
A
I
S
Q
E
L
G
T
---
K
I
P
F
-
C
P
I
T
G
S
E
-------
I
Y
S
----
T
-
E
-----
V
----------
K
K
T
E
V
L
M
E
N
-
F
R
R
A
I
G
L
---
R
V
R
E
T
K
D
V
Y
E
G
E
V
S
T
L
L
I
G
L
K
S
A
R
G
Q
K
L
D
Q
K
ERVQVG
D
V
I
Y
I
E
T
N
T
G
A
C
R
S
D
A
Y
A
T
E
F
D
L
E
A
E
-
E
Y
V
P
I
P
-------
K
G
E
V
-----
H
K
K
K
E
---
I
V
Q
D
V
T
L
H
D
L
D
V
A
N
A
R
P
D
I
I
S
--
M
M
G
Q
L
M
K
P
K
M
T
E
I
----------------------
T
D
K
L
R
M
E
I
N
K
V
V
----
Q
K
-
Y
-
I
---
N
Q
G
V
A
E
L
I
P
G
V
L
--
F
--
I
D
----------------
E
A
H
M
L
D
I
E
C
----
F
T
Y
L
N
K
A
L
E
S
P
I
--
A
P
I
V
V
L
A
S
N
--
R
G
I
A
T
I
R
G
A
D
D
L
-----------
K
A
A
H
-
G
I
P
P
D
F
L
Q
--
R
-------------------------------------
L
L
I
I
--
P
T
H
P
Y
E
-------
P
D
-
E
I
R
R
I
V
R
I
R
A
Q
T
E
G
V
Q
L
T
D
A
A
-
V
D
R
V
A
E
----
H
G
V
R
I
S
L
R
Y
C
L
Q
L
L
A
P
A
S
I
L
A
R
----------------
V
N
G
R
--
T
Q
V
-
D
V
Q
D
I
A
E
A
--
E
E
L
F
L
D
A
R
R
S
A
N
I
L
T
S
T
G
G
L
H
--------
7
PsiBlast_PDB
55.56
24%
-155
- C5 -
3GIA
5
Y609_METJA
A:
[139-360]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
N
F
F
G
S
---
K
A
V
G
R
A
E
F
F
I
V
L
V
K
L
L
I
L
G
L
F
I
F
A
------
G
-------
L
I
T
I
H
P
S
Y
V
I
P
D
L
A
P
S
A
V
S
G
M
I
F
A
S
-
A
I
F
F
L
----------------
S
Y
M
G
F
G
---
V
I
T
N
A
S
E
H
I
E
N
P
K
K
N
V
P
R
A
I
F
--
I
S
I
L
I
V
M
F
V
Y
V
G
V
----------------------
A
I
S
A
I
G
N
L
P
I
D
E
----
L
I
-
K
-
A
---
S
E
N
A
L
A
V
A
A
K
-------
P
F
----------------
L
G
N
L
G
F
L
L
I
S
I
G
A
L
F
S
I
S
S
A
M
N
A
T
I
Y
-
G
G
A
N
V
A
Y
S
L
--
A
K
D
G
E
L
P
E
F
F
E
R
KVWFKS
T
E
G
L
Y
I
T
S
A
-
L
G
V
L
F
A
L
L
--
F
N
M
-
E
G
V
A
S
I
T
S
-
A
V
-----------
F
M
V
---
I
Y
L
--
F
V
I
L
------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
54.37
24%
-147
- C5 -
3GI8
-
Y609_METJA
C:
[139-360]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
N
F
F
G
S
---
K
A
V
G
R
A
E
F
F
I
V
L
V
A
L
L
I
L
G
L
F
I
F
A
G
-------------
L
I
T
I
H
P
S
Y
V
I
P
D
L
A
P
S
A
V
S
G
M
I
F
A
S
-
A
I
F
F
L
----------------
S
Y
M
G
F
G
---
V
I
T
N
A
S
E
H
I
E
N
P
K
K
N
V
P
R
A
I
F
--
I
S
I
L
I
V
M
F
V
Y
V
G
V
----------------------
A
I
S
A
I
G
N
L
P
I
D
E
----
L
I
-
K
-
A
---
S
E
N
A
L
A
V
A
A
K
-------
P
F
----------------
L
G
N
L
G
F
L
L
I
SIGA
L
F
S
I
S
S
A
M
N
A
T
I
Y
-
G
G
A
N
V
A
Y
S
L
--
A
K
D
G
E
L
P
E
F
F
E
R
KVWFKSTEGLY
I
T
S
A
-
L
G
V
L
F
A
L
L
--
F
N
M
-
E
G
V
A
S
I
T
S
-
A
V
-----------
F
M
V
---
I
Y
L
--
F
V
I
L
------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
54.30
24%
-149
- C5 -
3GI9
-
Y609_METJA
C:
[139-360]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
N
F
F
G
S
---
K
A
V
G
R
A
E
F
F
I
V
L
V
K
L
L
I
L
G
L
F
I
F
A
------
G
-------
L
I
T
I
H
P
S
Y
V
I
P
D
L
A
P
S
A
V
S
G
M
I
F
A
S
-
A
I
F
F
L
----------------
S
Y
M
G
F
G
---
V
I
T
N
A
S
E
H
I
E
N
P
K
K
N
V
P
R
A
I
F
--
I
S
I
L
I
V
M
F
V
Y
V
G
V
----------------------
A
I
S
A
I
G
N
L
P
I
D
E
----
L
I
-
K
-
A
---
S
E
N
A
L
A
V
A
A
K
-------
P
F
----------------
L
G
N
L
G
F
L
L
I
S
I
G
A
L
F
S
I
S
S
A
M
N
A
T
I
Y
-
G
G
A
N
V
A
Y
S
L
--
A
K
D
G
E
L
P
E
F
F
E
R
KVWFKS
T
E
G
L
Y
I
T
S
A
-
L
G
V
L
F
A
L
L
--
F
N
M
-
E
G
V
A
S
I
T
S
-
A
V
-----------
F
M
V
---
I
Y
L
--
F
V
I
L
------------------------------------------------------------------------------------------------------------------------------------------
29
Fugue
51.33
14%
-170
- C3 -
1EHK
6
COX1_THET8
A:
[14-562]
---------
A
Y
P
E
K
K
A
T
L
Y
F
L
V
L
G
F
L
A
L
I
V
G
S
L
F
G
P
F
Q
A
L
N
Y
G
N
V
D
A
Y
P
L
L
K
R
L
L
P
------
F
V
Q
S
-
Y
Y
Q
G
L
T
L
H
G
V
L
N
A
I
V
F
T
Q
L
-
F
A
Q
A
I
M
V
Y
L
P
A
R
E
L
N
M
-
R
P
-
N
---
M
G
L
M
W
L
-
S
W
W
M
A
F
I
G
---
L
V
V
A
-
A
L
P
L
L
A
N
EATVLYT
F
Y
P
PLKG
H
-
W
-----
A
---
F
---
Y
L
G
A
S
V
F
V
L
S
T
W
-
V
S
I
Y
I
V
L
---
D
L
W
R
R
W
K
A
A
N
P
G
K
V
T
P
L
V
T
Y
M
A
V
V
F
W
L
M
W
F
L
-------
A
S
L
G
L
V
L
E
A
V
L
F
L
L
P
W
S
F
G
---
L
V
E
-
G
V
D
P
L
V
-------
A
R
T
L
F
W
W
T
G
H
P
I
V
Y
F
W
L
L
P
A
Y
A
I
I
Y
T
I
L
P
K
Q
A
G
G
K
L
V
S
--
D
P
M
A
R
L
A
F
L
L
F
L
L
LSTPVGFHHQFADPGID
P
T
W
K
M
I
H
S
V
L
T
L
F
V
A
V
P
----
S
L
-
M
-
T
---
A
F
T
V
A
A
S
L
E
F
A
G
--
R
--
L
R
GGRGLF
G
W
I
R
A
LPWDN
P
A
F
V
A
P
V
L
G
----
L
L
G
F
I
P
G
G
A
G
G
I
V
N
A
S
F
T
L
D
Y
V
V
--
H
N
T
A
W
V
P
G
H
F
H
L
-----------
Q
V
A
------
S
L
V
T
--
L
T
A
M
G
S
L
Y
W
L
L
P
-
N
L
TG
K
P
I
S
D
A
Q
R
R
L
G
L
---
A
V
V
--
W
L
W
F
L
--
G
M
M
I
M
A
V
G
L
H
W
A
G
L
L
N
V
P
R
R
A
Y
I
A
Q
V
P
D
A
Y
P
H
A
A
V
P
M
-
V
F
N
V
L
A
----
G
I
V
L
L
-
V
A
L
L
L
F
I
Y
G
L
F
S
V
L
L
S
RLAEAPLP
F
A
E
V
I
S
G
P
E
D
R
R
L
V
L
A
M
D
R
I
G
F
W
F
A
V
--
A
A
I
L
V
V
L
A
Y
G
P
T
L
V
Q
L
F
G
H
L
N
P
V
P
G
W
R
LW
32
Fugue
46.94
9%
-120
- C4 -
1BKD
-
SOS1_HUMAN
S:
[568-1044]
-----
R
L
P
S
A
D
V
Y
R
F
A
E
P
D
S
----------
E
E
N
I
I
F
E
E
G
I
P
I
I
K
A
G
T
V
I
K
L
I
E
R
L
T
------
Y
-------------
H
M
Y
A
---
D
P
N
-
F
V
R
T
F
L
T
T
-
Y
R
S
F
C
K
P
-
Q
E
-
L
L
S
L
I
I
E
R
F
-------------------
E
I
P
E
P
R
-------
F
R
K
----
E
-
Y
-----
I
---
Q
---
P
V
Q
L
R
V
L
N
V
C
R
H
-
W
V
E
H
H
F
Y
---
D
F
E
R
D
A
Y
L
L
Q
R
M
E
E
F
I
G
T
V
R
G
K
A
M
K
K
W
V
E
S
I
-------
T
K
I
I
Q
R
K
K
I
T
F
Q
S
S
P
P
T
V
E
W
H
I
S
R
P
-
G
H
I
E
T
F
DLLTLHP
I
E
I
A
R
Q
L
T
L
L
E
S
D
L
---
Y
R
A
V
Q
P
S
E
L
V
G
S
V
W
T
K
E
D
K
E
I
NS
P
N
L
L
K
M
I
R
H
T
T
N
L
----------------------
T
L
W
F
E
K
C
I
V
E
T
E
----
N
L
-
E
-
E
---
R
V
A
V
V
S
R
I
I
E
I
L
--
Q
--
V
F
----------------
Q
E
-
L
N
N
F
N
G
----
V
L
E
V
V
S
A
M
N
S
S
P
V
-
Y
R
L
D
H
T
F
E
Q
IP
S
R
Q
K
K
I
L
E
E
A
H
E
-----------
L
S
E
D
-
H
Y
K
K
Y
L
A
K
--
L
R
S
I
N
P
P
C
V
P
F
F
-
G
I
-----------
Y
L
T
---
N
I
L
--
K
T
E
E
G
--
N
P
E
-------
V
L
K
R
H
-
G
K
E
L
I
N
F
S
K
R
R
K
V
A
E
I
T
G
E
I
Q
Q
Y
Q
N
Q
P
Y
----
C
L
R
V
E
-
S
D
I
K
R
F
F
E
N
L
N
P
M
G
N
S
----------------
M
E
K
E
F
T
D
Y
L
-
F
N
K
S
L
E
I
E
--
P
R
N
P
K
P
L
P
R
F
P
K
K
Y
S
Y
P
L
K
S
P
GVRPSN--
12
PsiBlast_PDB
42.72
26%
-104
- C5 -
1H4T
1
SYP_THET8
A:
[252-372]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
Y
V
H
--
T
T
S
W
G
L
S
W
R
F
I
G
A
----------------------
I
I
M
T
H
G
----
D
D
----
R
G
-
L
-
V
---
L
P
P
R
L
A
P
I
Q
V
V
I
--
V
--
P
I
----------------
Y
K
D
E
S
R
E
R
V
----
L
E
A
A
Q
G
L
R
Q
A
L
L
A
-
Q
G
L
R
V
H
L
D
D
--
R
D
Q
H
T
P
G
Y
K
F
H
E
-----------
W
E
L
K
-
G
V
P
F
R
V
E
L
G
P
K
D
L
E
G
G
Q
A
V
L
A
S
-
R
L
-----------
G
G
K
---
E
T
L
------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
41.98
26%
-103
- C5 -
1HC7
-
SYP_THET8
A:
[252-372]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
Y
V
H
--
T
T
S
W
G
L
S
W
R
F
I
G
A
----------------------
I
I
M
T
H
G
----
D
D
----
R
G
-
L
-
V
---
L
P
P
R
L
A
P
I
Q
V
V
I
--
V
--
P
I
----------------
Y
K
D
E
S
R
E
R
V
----
L
E
A
A
Q
G
L
R
Q
A
L
L
A
-
Q
G
L
R
V
H
L
D
D
--
R
D
Q
H
T
P
G
Y
K
F
H
E
-----------
W
E
L
K
-
G
V
P
F
R
V
E
L
G
P
K
D
L
E
G
G
Q
A
V
L
A
S
-
R
L
-----------
G
G
K
---
E
T
L
------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
41.09
26%
-99
- C5 -
1H4Q
3
SYP_THET8
A:
[252-372]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
Y
V
H
--
T
T
S
W
G
L
S
W
R
F
I
G
A
----------------------
I
I
M
T
H
G
----
D
D
----
R
G
-
L
-
V
---
L
P
P
R
L
A
P
I
Q
V
V
I
--
V
--
P
I
----------------
Y
K
D
E
S
R
E
R
V
----
L
E
A
A
Q
G
L
R
Q
A
L
L
A
-
Q
G
L
R
V
H
L
D
D
--
R
D
Q
H
T
P
G
Y
K
F
H
E
-----------
W
E
L
K
-
G
V
P
F
R
V
E
L
G
P
K
D
L
E
G
G
Q
A
V
L
A
S
-
R
L
-----------
G
G
K
---
E
T
L
------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
40.77
26%
-90
- C5 -
1H4S
3
SYP_THET8
A:
[252-372]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
Y
V
H
--
T
T
S
W
G
L
S
W
R
F
I
G
A
----------------------
I
I
M
T
H
G
----
D
D
----
R
G
-
L
-
V
---
L
P
P
R
L
A
P
I
Q
V
V
I
--
V
--
P
I
----------------
Y
K
D
E
S
R
E
R
V
----
L
E
A
A
Q
G
L
R
Q
A
L
L
A
-
Q
G
L
R
V
H
L
D
D
--
R
D
Q
H
T
P
G
Y
K
F
H
E
-----------
W
E
L
K
-
G
V
P
F
R
V
E
L
G
P
K
D
L
E
G
G
Q
A
V
L
A
S
-
R
L
-----------
G
G
K
---
E
T
L
------------------------------------------------------------------------------------------------------------------------------------------------