@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 : Wbm0778: (2015-12-04 )
MPISLPKVRGIYRYSVLMSKITWLNVGGQADILFKPRDIEDLIYLIKNTKLPISVIGATSNMIVRDSGIRGITVKLGKEFAYIKYKSNNSIIAGGAALLSNLAYFAGEQQVSGLEFLVGIPGTIGGGIEMNAGAYGSDVASVVQSIKAVNLSDGNLYEFSSKEMGYVYRGHSLKGQWIFIEAEFKGVSSGHEVILHRLKEIINKKNKSQPVRGKTAGCIFKNPRAYQAWKLIDGSGCRGLNNGGAKISKKHCNFLLNYNNATASDLENLGNKVRNTVKDKFNIELEWEIRVLGSH
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...--
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
-----MPISLPKVRG
I
Y
R
Y
S
V
L
M
SK
I
T
W
L
NVGGQ
A
D
I
L
FKPR
D
I
E
---
D
---
L
I
Y
L
I
K---N-TK---L
P
I
S
V
IGATS
N
M
I
V
-RD--------S--------GI
R
G
I
T
V
KLG
K
E
F
A
Y
I
K
YK----SNN
S
I
I
A
G
G
A
A
--
L
L
S
N
L
A
Y
F
AGEQQVSG
L
E
F
L
VGIPGTIGGG
I
E
MNAGAYG
S
D
V
A
S
V
V
Q
S
I
K
A
V
NL-S-DG
N
L
Y
E
FSSKE
M
G
Y
V
YRG----HSL-K-
G
----
Q
------------------------
W
--
I
F
I
E
A
E
FKGVSS
G
H
------------
E
---
V
--
I
----
L
H
R
L
-------
K
E
I
I
N------KKNKSQP--V--RGKTA
G
C
I
FKNP---------------------------R-----------------A--------------------------
Y
Q
A
W
K
------------------LIDGSGCRGLNNGGAKI
S
K
K
H
C
N
F
L
L
NYNNA
T
A
S
D
L
E
N
L
G
N
K
V
R
N
T
V
KD
K
F
N
I
E
L
E
W
E
I
R
V
LGSH--
2
PsiBlast_PDB
96.87
34%
-107
- C6 -
1HSK
1
MURB_STAAU
A:
[37-315]
----------------------
L
K
R
Y
T
Y
T
K
T
G
G
N
A
D
F
Y
I
T
P
T
K
N
E
---
E
---
V
Q
A
V
V
K
Y
A
Y
Q
-
N
E
---
I
P
V
T
Y
L
G
N
G
S
N
I
I
I
-
R
E
--------
G
--------
G
I
R
G
I
V
I
S
L
-
L
S
L
D
H
I
E
V
-----
S
D
D
A
I
I
A
G
S
G
A
--
A
I
I
D
V
S
R
V
A
R
D
Y
A
L
T
G
L
E
F
A
C
G
I
P
G
S
I
G
G
A
V
Y
M
N
A
G
A
Y
G
G
E
V
K
D
C
I
D
Y
A
L
C
V
N
--
E
-
Q
G
S
L
I
K
L
T
T
K
E
L
E
L
D
Y
R
N
----
S
I
I
Q
K
-
E
----
H
------------------------
L
--
V
V
L
E
A
A
F
T
L
A
P
G
K
M
------------
T
---
E
--
I
----
Q
A
K
M
-------
D
D
L
T
E
------
R
R
E
S
K
Q
P
--
L
--
E
Y
P
S
C
G
S
V
F
Q
R
P
---------------------------
P
-----------------
G
--------------------------
H
F
A
G
K
------------------
L
I
Q
D
S
N
L
Q
G
H
R
I
G
G
V
E
V
S
T
K
H
A
G
F
M
V
N
V
D
N
G
T
A
T
D
Y
E
N
L
I
H
Y
V
Q
K
T
V
K
E
K
F
G
I
E
L
N
R
E
V
R
I
I
G
E
H
--
23
HHSearch
95.22
33%
-103
* C6 *
1HSK
1
MURB_STAAU
A:
[28-315]
-------------
N
E
K
I
K
V
D
E
P
L
K
R
Y
T
Y
T
K
T
G
G
N
A
D
F
Y
I
T
P
T
K
N
E
---
E
---
V
Q
A
V
V
K
Y
A
-
Y
Q
N
E
---
I
P
V
T
Y
L
G
N
G
S
N
I
I
I
-
R
E
--------
G
--------
G
I
R
G
I
V
I
S
L
L
S
-
L
D
-
H
I
E
V
----
S
D
D
A
I
I
A
G
S
G
A
--
A
I
I
D
V
S
R
V
A
R
D
Y
A
L
T
G
L
E
F
A
C
G
I
P
G
S
I
G
G
A
V
Y
M
N
A
G
A
Y
G
G
E
V
K
D
C
I
D
Y
A
L
C
V
-
N
-
E
-
Q
G
S
L
I
K
L
T
T
K
E
L
E
L
D
Y
R
N
----
S
I
I
-
Q
-
K
E---
H
------------------------
L
--
V
V
L
E
A
A
F
T
L
A
P
G
--------------
K
---
M
--
T
E
I
--
Q
A
K
M
-------
D
D
L
T
E
------
R
R
E
S
K
Q
P
--
L
--
E
Y
P
S
C
G
S
V
F
Q
R
P
---------------------------
P
-----------------
G
--------------------------
H
F
A
G
K
------------------
L
I
Q
D
S
N
L
Q
G
H
R
I
G
G
V
E
V
S
T
K
H
A
G
F
M
V
N
V
D
N
G
T
A
T
D
Y
E
N
L
I
H
Y
V
Q
K
T
V
K
E
K
F
G
I
E
L
N
R
E
V
R
I
I
G
E
H
--
40
Fugue
95.09
32%
-100
- C6 -
1HSK
1
MURB_STAAU
A:
[15-317]
N
K
D
I
Y
Q
A
L
Q
Q
L
I
P
N
E
K
I
K
V
D
E
P
L
K
R
Y
T
Y
T
K
T
G
G
N
A
D
F
Y
I
T
P
T
K
N
E
---
E
---
V
Q
A
V
V
K
---
Y
-
A
Y
Q
N
E
I
P
V
T
Y
L
G
N
G
S
N
I
I
I
-
R
E
--------
G
--------
G
I
R
G
I
V
I
S
L
-
L
S
L
D
H
I
E
V
S
-----
D
D
A
I
I
A
G
S
G
A
--
A
I
I
D
V
S
R
V
A
R
D
Y
A
L
T
G
L
E
F
A
C
G
I
P
G
S
I
G
G
A
V
Y
M
N
A
G
A
Y
G
G
E
V
K
D
C
I
D
Y
A
L
C
V
N
--
E
-
Q
G
S
L
I
K
L
T
T
K
E
L
E
L
D
Y
R
N
----
S
I
I
-
Q
K
E
----
H
------------------------
L
--
V
V
L
E
A
A
F
T
L
A
P
G
K
M
------------
T
---
E
--
I
----
Q
A
K
M
-------
D
D
L
T
E
------
R
R
E
S
K
Q
P
--
L
--
E
Y
P
S
C
G
S
V
F
Q
R
P
---------------------------
P
-----------------
G
--------------------------
H
F
A
G
K
------------------
L
I
Q
D
S
N
L
Q
G
H
R
I
G
G
V
E
V
S
T
K
H
A
G
F
M
V
N
V
D
N
G
T
A
T
D
Y
E
N
L
I
H
Y
V
Q
K
T
V
K
E
K
F
G
I
E
L
N
R
E
V
R
I
I
G
E
H
P
K
3
PsiBlast_PDB
92.72
33%
-99
- C6 -
4PYT
4
MURB_BACLD
A:
[26-301]
--------------------------
T
T
I
K
I
G
G
P
A
D
C
L
V
I
P
K
D
I
Q
A
V
R
D
---
T
M
E
V
V
K
---
N
-
H
G
---
V
Q
W
R
A
I
G
R
G
S
N
L
L
V
-
L
D
--------
E
--------
G
I
R
G
V
V
I
K
L
G
A
G
L
D
H
M
E
I
D
----
G
E
Q
V
T
V
G
G
G
Y
S
--
V
V
-
R
L
S
T
G
I
S
K
K
G
L
S
G
L
E
F
A
S
G
I
P
G
S
V
G
G
A
V
Y
M
N
A
G
A
H
G
S
D
I
S
R
I
L
--
V
K
A
L
I
L
F
E
-
D
G
T
M
E
W
L
T
N
E
E
M
E
F
S
Y
R
T
----
S
I
L
-
Q
-
N
----
K
------------------------
R
P
G
I
C
L
E
A
V
L
Q
L
E
Q
K
E
R
------------
D
---
A
--
I
----
V
A
Q
M
-------
Q
K
N
K
D
------
Y
R
K
E
T
Q
P
--
V
--
S
N
P
C
A
G
S
I
F
R
N
P
---------------------------
L
-----------------
P
--------------------------
D
H
A
G
R
------------------
L
V
E
Q
A
G
L
K
G
H
R
I
G
G
A
K
V
S
E
M
H
G
N
F
I
V
N
A
G
G
A
T
A
K
D
V
L
D
L
I
A
F
I
Q
K
T
I
K
E
K
Y
D
I
D
M
H
T
E
V
E
I
V
G
E
K
--
24
HHSearch
91.45
35%
-95
- C6 -
3TX1
5
MURB_LISMO
A:
[35-321]
--------------
I
A
I
K
L
N
E
P
L
S
K
Y
T
Y
T
K
T
G
G
A
A
D
V
F
V
M
P
K
T
I
E
---
E
---
A
Q
E
V
V
A
Y
C
-
H
Q
N
K
---
I
P
L
T
I
L
G
N
G
S
N
L
I
I
-
K
D
--------
G
--------
G
I
R
G
V
I
L
H
L
D
L
-
L
Q
-
T
I
E
R
----
N
N
T
Q
I
V
A
M
S
G
A
--
K
L
I
D
T
A
K
F
A
L
N
E
S
L
S
G
L
E
F
A
C
G
I
P
G
S
I
G
G
A
L
H
M
N
A
G
A
Y
G
G
E
I
S
D
V
L
E
A
A
T
V
L
-
T
-
Q
-
T
G
E
L
K
K
L
K
R
S
E
L
K
--
Y
R
-----
S
T
I
-
A
-
E
K---
N
------------------------
Y
--
I
V
L
D
A
T
F
S
L
A
L
E
--------------
E
---
K
--
N
L
I
--
Q
A
K
M
-------
D
E
L
T
A
------
A
R
E
A
K
Q
P
--
L
--
E
Y
P
S
C
G
S
V
F
K
R
P
---------------------------
P
-----------------
G
--------------------------
H
F
A
G
K
------------------
L
I
Q
D
S
G
L
Q
G
H
I
I
G
G
A
Q
V
S
L
K
H
A
G
F
I
V
N
I
G
G
A
T
A
T
D
Y
M
N
L
I
A
Y
V
Q
Q
T
V
R
E
K
F
D
V
E
L
E
T
E
V
K
I
I
G
E
D
--
1
PsiBlast_PDB
89.72
34%
-97
- C6 -
3TX1
5
MURB_LISMO
A:
[43-319]
----------------------
L
S
K
Y
T
Y
T
K
T
G
G
A
A
D
V
F
V
M
P
K
T
I
E
---
E
A
Q
E
V
V
A
Y
C
H
---
Q
-
N
K
---
I
P
L
T
I
L
G
N
G
S
N
L
I
I
-
K
D
--------
G
--------
G
I
R
G
V
I
L
H
L
--
D
L
L
Q
T
I
E
R
----
N
N
T
Q
I
V
A
M
S
G
A
--
K
L
I
D
T
A
K
F
A
L
N
E
S
L
S
G
L
E
F
A
C
G
I
P
G
S
I
G
G
A
L
H
M
N
A
G
A
Y
G
G
E
I
S
D
V
L
E
A
A
T
V
L
T
Q
-
T
--
G
E
L
K
K
L
K
R
S
E
L
K
--
Y
R
-----
S
T
I
A
E
-
K
----
N
------------------------
Y
--
I
V
L
D
A
T
F
S
L
A
L
E
E
K
------------
N
---
L
--
I
----
Q
A
K
M
-------
D
E
L
T
A
------
A
R
E
A
K
Q
P
--
L
--
E
Y
P
S
C
G
S
V
F
K
R
P
---------------------------
P
-----------------
G
--------------------------
H
F
A
G
K
------------------
L
I
Q
D
S
G
L
Q
G
H
I
I
G
G
A
Q
V
S
L
K
H
A
G
F
I
V
N
I
G
G
A
T
A
T
D
Y
M
N
L
I
A
Y
V
Q
Q
T
V
R
E
K
F
D
V
E
L
E
T
E
V
K
I
I
G
E
D
--
22
HHSearch
87.25
34%
-89
- C6 -
2GQT
2
MURB_THET8
A:
[2-267]
-------------
E
F
M
R
V
E
R
V
L
L
K
D
Y
T
T
L
G
V
G
G
P
A
E
L
W
-
T
V
E
T
R
E
---
E
---
L
K
R
A
-------
T
E
---
A
P
Y
R
V
L
G
N
G
S
N
L
L
V
-
L
D
--------
E
--------
G
V
P
E
R
V
I
R
L
A
G
E
F
Q
-
T
Y
-------
D
L
K
G
W
V
G
A
G
T
--
L
L
P
L
L
V
Q
E
A
A
R
A
G
L
S
G
L
E
G
L
L
G
I
P
A
Q
V
G
G
A
V
K
M
N
A
G
T
R
F
G
E
M
A
D
A
L
E
A
V
E
V
F
-
H
---
D
G
A
F
H
V
Y
C
P
E
E
L
G
F
G
Y
R
K
----
S
H
L
-
P
-
P
----
G
------------------------
G
--
I
V
T
R
V
R
L
K
L
K
E
R
--------------
P
---
K
--
E
E
I
--
L
R
R
M
-------
A
E
V
D
R
------
A
R
-
K
G
Q
P
-----
K
R
K
S
A
G
C
A
F
K
N
P
---------------------------
P
-----------------
G
--------------------------
Q
S
A
G
R
------------------
L
I
D
E
R
G
L
K
G
L
R
V
G
D
A
M
I
S
L
E
H
G
N
F
I
V
N
L
G
Q
A
R
A
K
D
V
L
E
L
V
R
R
V
Q
E
E
----
L
P
L
E
L
E
W
E
V
W
P
------
21
HHSearch
86.12
24%
-81
- C6 -
1UXY
2
MURB_ECOLI
A:
[1-330]
--------------------
H
S
L
K
P
W
N
T
F
G
I
D
H
N
A
Q
H
I
V
C
A
E
D
E
Q
---
Q
---
L
L
N
A
W
Q
Y
A
-
T
A
E
G
---
Q
P
V
L
I
L
G
E
G
S
N
V
L
F
-
L
E
--------
D
---------
Y
R
G
T
V
I
I
N
R
I
--
K
-
G
I
E
I
H
D
E
P
D
A
W
Y
L
H
V
G
A
G
E
--
N
W
H
R
L
V
K
Y
T
L
Q
E
G
M
P
G
L
E
N
L
A
L
I
P
G
C
V
G
S
S
P
I
Q
N
I
G
A
Y
G
V
E
L
Q
R
V
C
A
Y
V
D
S
V
-
E
-
L
A
T
G
K
Q
V
R
L
T
A
K
E
C
R
F
G
Y
R
D
----
S
I
F
-
K
-
H
EYQD
R
------------------------
F
--
A
I
V
A
V
G
L
R
L
P
K
E
W
Q
PVLTYGDLTRL-
D
PTT
V
--
T
P
---
Q
Q
V
F
-------
N
A
V
C
H
------
M
R
T
T
K
L
P
--
D
PK
V
N
G
N
A
G
A
F
F
K
N
P
---------------------------
V
-----------------
V
S
A
E
T
A
K
A
L
L
S
Q
F
PTA
P
N
Y
P
Q
ADG
S
V
K
L
A
A
G
W
------------------
L
I
D
Q
C
Q
L
K
G
M
Q
I
G
G
A
A
V
H
R
Q
Q
A
L
V
L
I
N
E
D
N
A
K
S
E
D
V
V
Q
L
A
H
H
V
R
Q
K
V
G
E
K
F
N
V
W
L
E
P
E
V
R
F
I
G
A
S
--
4
PsiBlast_PDB
83.90
34%
-91
- C6 -
2GQT
2
MURB_THET8
A:
[9-255]
--------------------
V
L
L
K
D
Y
T
T
L
G
V
G
G
P
A
E
L
W
----
T
V
E
---
T
---
R
E
E
L
K
R
---
A
-
T
E
---
A
P
Y
R
V
L
G
N
G
S
N
L
L
V
-
L
D
--------
E
--------
G
V
P
E
R
V
I
R
L
A
G
E
F
Q
T
Y
D
L
K
----
G
----
W
V
G
A
G
T
--
L
L
P
L
L
V
Q
E
A
A
R
A
G
L
S
G
L
E
G
L
L
G
I
P
A
Q
V
G
G
A
V
K
M
N
A
G
T
R
F
G
E
M
A
D
A
L
E
A
V
E
V
F
H
----
D
G
A
F
H
V
Y
C
P
E
E
L
G
F
G
Y
R
K
----
S
H
L
-
P
-
P
----
G
------------------------
G
--
I
V
T
R
V
R
L
K
L
K
E
R
P
K
------------
E
---
E
--
I
----
L
R
R
M
-------
A
E
V
-
D
------
R
A
R
K
G
Q
P
--
K
--
R
-
K
S
A
G
C
A
F
K
N
P
---------------------------
P
-----------------
G
--------------------------
Q
S
A
G
R
------------------
L
I
D
E
R
G
L
K
G
L
R
V
G
D
A
M
I
S
L
E
H
G
N
F
I
V
N
L
G
Q
A
R
A
K
D
V
L
E
L
V
R
R
V
Q
E
E
L
P
L
E
L
E
W
E
V
W
P
----------
13
PsiBlast_PDB
83.60
25%
-82
- C6 -
3I99
3
MURB_VIBCH
A:
[42-343]
------------------------------------------
D
L
K
---
A
---
L
Y
C
S
A
E
---
W
-
A
S
---
L
P
K
L
I
I
G
K
G
S
N
M
L
F
-
T
C
--------
H
--------
Y
T
G
M
I
V
V
N
R
L
N
G
I
E
H
Q
Q
D
D
----
D
Y
H
R
L
H
V
A
G
G
E
--
D
W
P
S
L
V
S
W
C
V
E
Q
G
I
G
G
L
E
N
L
A
L
I
P
G
C
A
G
S
A
P
I
Q
N
I
G
A
Y
G
V
E
F
K
D
V
C
D
Y
V
E
Y
L
C
L
-
E
-
T
G
T
V
K
R
L
T
M
E
E
C
Q
F
G
Y
R
D
----
S
I
F
-
K
-
H
----
Q
LYQKAVVT
A
V
G
L
K
F
A
KA-------
W
QP
I
I
Q
Y
G
P
L
K
D
L
S
S
D
C
------------
A
---
I
H
D
V
----
Y
Q
R
V
-------
C
A
T
R
M
------
E
K
L
P
D
P
A
--
V
--
M
G
-
N
A
G
S
F
F
K
N
P
---------------------------
V
I
S
Q
Q
A
F
A
R
L
Q
I
E
H
PD
V
V
A
--------------------------
Y
P
A
E
Q
G
V
K
V
A
A
G
W
----------
L
I
D
Q
A
G
L
K
G
H
Q
I
G
G
A
K
V
H
P
K
Q
A
L
V
I
V
N
T
G
D
A
S
A
Q
D
V
L
M
L
A
A
D
I
Q
Q
R
V
F
N
C
Y
G
I
E
L
E
H
E
V
R
F
I
G
E
S
--
5
PsiBlast_PDB
83.51
34%
-87
- C6 -
2GQU
2
MURB_THET8
A:
[9-255]
--------------------
V
L
L
K
D
Y
T
T
L
G
V
G
G
P
A
E
L
W
----
T
V
E
---
T
---
R
E
E
L
K
R
---
A
-
T
E
---
A
P
Y
R
V
L
G
N
G
S
N
L
L
V
-
L
D
--------
E
--------
G
V
P
E
R
V
I
R
L
A
G
E
F
Q
T
Y
D
L
K
----
G
----
W
V
G
A
G
T
--
L
L
P
L
L
V
Q
E
A
A
R
A
G
L
S
G
L
E
G
L
L
G
I
P
A
Q
V
G
G
A
V
K
M
N
A
G
T
R
F
G
E
M
A
D
A
L
E
A
V
E
V
F
H
----
D
G
A
F
H
V
Y
C
P
E
E
L
G
F
G
Y
R
K
----
S
H
L
-
P
-
P
----
G
------------------------
G
--
I
V
T
R
V
R
L
K
L
K
E
R
P
K
------------
E
---
E
--
I
----
L
R
R
M
-------
A
E
V
-
D
------
R
A
R
K
G
Q
P
--
K
--
R
-
K
S
A
G
C
A
F
K
N
P
---------------------------
P
-----------------
G
--------------------------
Q
S
A
G
R
------------------
L
I
D
E
R
G
L
K
G
L
R
V
G
D
A
M
I
S
L
E
H
G
N
F
I
V
N
L
G
Q
A
R
A
K
D
V
L
E
L
V
R
R
V
Q
E
E
L
P
L
E
L
E
W
E
V
W
P
----------
20
HHSearch
83.08
25%
-86
- C6 -
3I99
3
MURB_VIBCH
A:
[9-344]
------------
T
T
M
Q
I
Q
L
G
A
N
L
K
P
Y
H
T
F
G
I
E
Q
L
A
A
Q
L
V
V
A
E
S
I
D
---
D
---
L
K
A
L
Y
C
SA-
E
W
A
S
---
L
P
K
L
I
I
G
K
G
S
N
M
L
F
-
T
C
-----------------
H
Y
T
G
M
I
V
V
N
R
--
L
N
-
G
I
E
H
Q
Q
D
D
D
Y
H
R
L
H
V
A
G
G
E
--
D
W
P
S
L
V
S
W
C
V
E
Q
G
I
G
G
L
E
N
L
A
L
I
P
G
C
A
G
S
A
P
I
Q
N
I
G
A
Y
G
V
E
F
K
D
V
C
D
Y
V
E
Y
L
-
C
-
L
E
T
G
T
V
K
R
L
T
M
E
E
C
Q
F
G
Y
R
D
----
S
I
F
-
K
-
H
QLYQ
K
------------------------
A
--
V
V
T
A
V
G
L
K
F
A
K
A
W
Q
PIIQYGPLKDLS
S
---
D
C-
A
I
---
H
D
V
Y
-------
Q
R
V
C
A
------
T
R
M
E
K
L
P
DP
A
--
V
M
G
N
A
G
S
F
F
K
N
P
---------------------------
V
-----------------
I
S
Q
Q
A
F
A
R
L
Q
I
E
H
PD
V
V
A
Y
P
A
EQ
G
V
K
-
V
A
A
G
W
------------------
L
I
D
Q
A
G
L
K
G
H
Q
I
G
G
A
K
V
H
P
K
Q
A
L
V
I
V
N
T
G
D
A
S
A
Q
D
V
L
M
L
A
A
D
I
Q
Q
R
V
F
N
C
Y
G
I
E
L
E
H
E
V
R
F
I
G
E
S
--
11
PsiBlast_PDB
81.91
23%
-88
- C6 -
1MBT
2
MURB_ECOLI
A:
[42-331]
---------------------------------------------------------------------
P
V
L
I
L
G
E
G
S
N
V
L
F
-
L
E
DYR
G
T
V
I
I
N
--------
R
I
K
G
I
E
I
H
D
E
P
D
A
W
Y
L
H
------------
V
G
A
G
E
--
N
W
H
R
L
V
K
Y
T
L
Q
E
G
M
P
G
L
E
N
L
A
L
I
P
G
C
V
G
S
S
P
I
Q
N
I
G
A
Y
G
V
E
L
Q
R
V
C
A
Y
V
D
S
V
E
L
-
A
-
T
G
K
Q
V
R
L
T
A
K
E
C
R
F
G
Y
R
D
SIFK
H
E
Y
-
Q
-
D
----
R
------------------------
F
--
A
I
V
A
V
G
L
R
L
P
K
E
W
Q
------------
P
---
V
--
L
TYGD
L
T
R
L
DPTTVT
P
Q
Q
V
F
N
A
V
C
H
M
R
T
T
K
L
P
D
P
--
K
--
V
N
G
N
A
G
S
F
F
K
N
P
V
V
S
A
E
T
A
K
A
L
L
S
Q
FPTAP
N
Y
P
Q
ADG
S
V
K
-----------------
L
--------------------------
A
A
G
W
-------------------
L
I
D
Q
C
Q
L
K
G
M
Q
I
G
G
A
A
V
H
R
Q
Q
A
L
V
L
I
N
E
D
N
A
K
S
E
D
V
V
Q
L
A
H
H
V
R
Q
K
V
G
E
K
F
N
V
W
L
E
P
E
V
R
F
I
G
A
S
--
12
PsiBlast_PDB
81.82
23%
-91
- C6 -
2MBR
2
MURB_ECOLI
A:
[40-329]
---------------------------------------------------------------------
P
V
L
I
L
G
E
G
S
N
V
L
F
-
L
E
DYR
G
T
V
I
I
N
--------
R
I
K
G
I
E
I
H
D
E
P
D
A
W
Y
L
H
------------
V
G
A
G
E
--
N
W
H
R
L
V
K
Y
T
L
Q
E
G
M
P
G
L
E
N
L
A
L
I
P
G
C
V
G
S
S
P
I
Q
N
I
G
A
Y
G
V
E
L
Q
R
V
C
A
Y
V
D
S
V
E
L
-
A
-
T
G
K
Q
V
R
L
T
A
K
E
C
R
F
G
Y
R
D
SIFK
H
E
Y
-
Q
-
D
----
R
------------------------
F
--
A
I
V
A
V
G
L
R
L
P
K
E
W
Q
------------
P
---
V
--
L
TYGD
L
T
R
L
DPTTVT
P
Q
Q
V
F
N
A
V
C
H
M
R
T
T
K
L
P
D
P
--
K
--
V
N
G
N
A
G
S
F
F
K
N
P
V
V
S
A
E
T
A
K
A
L
L
S
Q
F
PTA
P
N
Y
P
Q
ADG
S
V
K
-----------------
L
--------------------------
A
A
G
W
-------------------
L
I
D
Q
C
Q
L
K
G
M
Q
I
G
G
A
A
V
H
R
Q
Q
A
L
V
L
I
N
E
D
N
A
K
S
E
D
V
V
Q
L
A
H
H
V
R
Q
K
V
G
E
K
F
N
V
W
L
E
P
E
V
R
F
I
G
A
S
--
6
PsiBlast_PDB
81.76
23%
-80
- C6 -
4JAY
5
MURB_PSEAE
A:
[35-336]
------------------------------------------
D
V
R
---
E
---
A
L
A
L
A
R
---
E
-
R
G
---
L
P
L
L
V
I
G
G
G
S
N
L
L
L
T
R
D
------------------
V
E
A
L
V
L
R
M
A
S
Q
G
R
R
I
V
S
D
----
A
A
D
S
V
L
V
E
A
E
A
GE
A
W
D
P
F
V
Q
W
S
L
E
R
G
L
A
G
L
E
N
L
S
L
I
P
G
T
V
G
A
A
P
M
Q
N
I
G
A
Y
G
V
E
L
K
D
V
F
D
S
L
T
A
L
D
R
-
Q
-
D
G
T
L
R
E
F
D
R
Q
A
C
R
F
G
Y
R
D
----
S
L
F
-
K
-
Q
----
E
PDRWLIL
R
V
R
L
R
L
T
RRERLHLDY
G
P
--
V
R
Q
R
L
E
E
E
G
I
A
S
P
T
------------
A
---
R
--
D
----
V
S
R
V
-------
I
C
A
I
R
------
R
E
K
L
P
D
P
--
A
--
V
L
G
N
A
G
S
F
F
K
N
P
L
V
D
A
T
Q
A
E
-------------------
R
-----------------
L
--------------------------
R
Q
A
F
P
D
L
V
G
Y
P
Q
ADG
R
L
K
L
A
A
G
W
L
I
D
K
G
G
W
K
G
F
R
D
G
P
V
G
V
H
A
Q
Q
A
L
V
L
V
N
H
G
G
A
T
G
A
Q
V
R
A
L
A
E
R
I
Q
E
D
V
R
R
R
F
G
V
E
L
E
P
E
P
N
L
Y
-----
9
PsiBlast_PDB
81.47
23%
-92
- C6 -
2Q85
2
MURB_ECOLI
A:
[42-331]
---------------------------------------------------------------------
P
V
L
I
L
G
E
G
S
N
V
L
F
-
L
E
DYR
G
T
V
I
I
N
--------
R
I
K
G
I
E
I
H
D
E
P
D
A
W
Y
L
H
------------
V
G
A
G
E
--
N
W
H
R
L
V
K
Y
T
L
Q
E
G
M
P
G
L
E
N
L
A
L
I
P
G
C
V
G
S
S
P
I
Q
N
I
G
A
Y
G
V
E
L
Q
R
V
C
A
Y
V
D
S
V
E
L
-
A
-
T
G
K
Q
V
R
L
T
A
K
E
C
R
F
G
Y
R
D
SIFK
H
E
Y
-
Q
-
D
----
R
------------------------
F
--
A
I
V
A
V
G
L
R
L
P
K
E
W
Q
------------
P
---
V
--
L
TYGD
L
T
R
L
DPTTVT
P
Q
Q
V
F
N
A
V
C
H
M
R
T
T
K
L
P
D
P
--
K
--
V
N
G
N
A
G
S
F
F
K
N
P
V
V
S
A
E
T
A
K
A
L
L
S
Q
F
PTA
P
N
Y
P
Q
ADG
S
V
K
-----------------
L
--------------------------
A
A
G
W
-------------------
L
I
D
Q
C
Q
L
K
G
M
Q
I
G
G
A
A
V
H
R
Q
Q
A
L
V
L
I
N
E
D
N
A
K
S
E
D
V
V
Q
L
A
H
H
V
R
Q
K
V
G
E
K
F
N
V
W
L
E
P
E
V
R
F
I
G
A
S
--
8
PsiBlast_PDB
81.05
23%
-89
- C6 -
1UXY
2
MURB_ECOLI
A:
[40-329]
---------------------------------------------------------------------
P
V
L
I
L
G
E
G
S
N
V
L
F
-
L
E
--------
D
YR
G
T
V
I
I
N
R
I
K
G
I
E
I
H
D
E
P
D
A
W
Y
L
H
------------
V
G
A
G
E
--
N
W
H
R
L
V
K
Y
T
L
Q
E
G
M
P
G
L
E
N
L
A
L
I
P
G
C
V
G
S
S
P
I
Q
N
I
G
A
Y
G
V
E
L
Q
R
V
C
A
Y
V
D
S
V
E
L
-
A
-
T
G
K
Q
V
R
L
T
A
K
E
C
R
F
G
Y
R
D
SIFK
H
E
Y
-
Q
-
D
----
R
------------------------
F
--
A
I
V
A
V
G
L
R
L
P
K
E
W
Q
------------
P
---
V
--
L
TYGD
L
T
R
L
DPTTVT
P
Q
Q
V
F
N
A
V
C
H
M
R
T
T
K
L
P
D
P
--
K
--
V
N
G
N
A
G
A
F
F
K
N
P
V
V
S
A
E
T
A
K
A
L
L
S
Q
F
PTA
P
N
Y
P
Q
ADG
S
V
K
-----------------
L
--------------------------
A
A
G
W
-------------------
L
I
D
Q
C
Q
L
K
G
M
Q
I
G
G
A
A
V
H
R
Q
Q
A
L
V
L
I
N
E
D
N
A
K
S
E
D
V
V
Q
L
A
H
H
V
R
Q
K
V
G
E
K
F
N
V
W
L
E
P
E
V
R
F
I
G
A
S
--
7
PsiBlast_PDB
80.51
23%
-80
- C6 -
4JB1
8
MURB_PSEAE
A:
[35-336]
------------------------------------------
D
V
R
---
E
---
A
L
A
L
A
R
---
E
-
R
G
---
L
P
L
L
V
I
G
G
G
S
N
L
L
L
T
R
D
------------------
V
E
A
L
V
L
R
M
A
S
Q
G
R
R
I
V
S
D
----
A
A
D
S
V
L
V
E
A
E
A
GE
A
W
D
P
F
V
Q
W
S
L
E
R
G
L
A
G
L
E
N
L
S
L
I
P
G
T
V
G
A
A
P
M
Q
N
I
G
A
Y
G
V
E
L
K
D
V
F
D
S
L
T
A
L
D
R
-
Q
-
D
G
T
L
R
E
F
D
R
Q
A
C
R
F
G
Y
R
D
----
S
L
F
-
K
-
Q
----
E
PDRWLIL
R
V
R
L
R
L
T
R
R
E
R
L
H
LDY
G
P
--
V
R
Q
R
L
E
E
E
G
I
A
S
P
T
------------
A
---
R
--
D
----
V
S
R
V
-------
I
C
A
I
R
------
R
E
K
L
P
D
P
--
A
--
V
L
G
N
A
G
S
F
F
K
N
P
L
V
D
A
T
Q
A
E
-------------------
R
-----------------
L
--------------------------
R
Q
A
F
P
D
L
V
G
Y
P
Q
ADGRLKLA
A
G
W
L
I
D
K
G
G
W
K
G
F
R
D
G
P
V
G
V
H
A
Q
Q
A
L
V
L
V
N
H
G
G
A
T
G
A
Q
V
R
A
L
A
E
R
I
Q
E
D
V
R
R
R
F
G
V
E
L
E
P
E
P
N
L
Y
-----
10
PsiBlast_PDB
80.50
23%
-87
- C6 -
1MBB
2
MURB_ECOLI
A:
[42-331]
---------------------------------------------------------------------
P
V
L
I
L
G
E
G
S
N
V
L
F
-
L
E
DYR
G
T
V
I
I
N
--------
R
I
K
G
I
E
I
H
D
E
P
D
A
W
Y
L
H
------------
V
G
A
G
E
--
N
W
H
R
L
V
K
Y
T
L
Q
E
G
M
P
G
L
E
N
L
A
L
I
P
G
C
V
G
S
S
P
I
Q
N
I
G
A
Y
G
V
E
L
Q
R
V
C
A
Y
V
D
S
V
E
L
-
A
-
T
G
K
Q
V
R
L
T
A
K
E
C
R
F
G
Y
R
D
SIFK
H
E
Y
-
Q
-
D
----
R
------------------------
F
--
A
I
V
A
V
G
L
R
L
P
K
E
W
Q
------------
P
---
V
--
L
TYGD
L
T
R
L
DPTTVT
P
Q
Q
V
F
N
A
V
C
H
M
R
T
T
K
L
P
D
P
--
K
--
V
N
G
N
A
G
S
F
F
K
N
P
V
V
S
A
E
T
A
K
A
L
L
S
QFPT
A
P
N
Y
P
Q
ADG
S
V
K
-----------------
L
--------------------------
A
A
G
W
-------------------
L
I
D
Q
C
Q
L
K
G
M
Q
I
G
G
A
A
V
H
R
Q
Q
A
L
V
L
I
N
E
D
N
A
K
S
E
D
V
V
Q
L
A
H
H
V
R
Q
K
V
G
E
K
F
N
V
W
L
E
P
E
V
R
F
I
G
A
S
--
41
Fugue
62.22
19%
-75
- C6 -
1UXY
2
?
?:
[1-198]
------------------
H
S
--
L
K
P
W
N
T
F
G
I
D
H
N
A
Q
H
I
V
C
A
E
D
E
Q
---
Q
---
L
L
N
A
W
Q
---
Y
-
A
T
A
E
G
Q
P
V
L
I
L
G
E
G
S
N
V
L
F
-
L
E
--------
D
--------
Y
R
G
T
V
I
I
N
R
I
K
G
I
E
I
H
D
E
P
----
D
A
W
Y
L
H
V
G
A
G
E
--
N
W
H
R
L
V
K
Y
T
L
Q
E
G
M
P
G
L
E
N
L
A
L
I
P
G
C
V
G
S
S
P
I
Q
N
I
G
A
Y
G
V
E
L
Q
R
V
C
A
Y
V
D
S
V
E
L
-
A
-
T
G
K
Q
V
R
L
T
A
K
E
C
R
F
G
Y
R
D
----
S
I
F
-
K
-
H
----
E
--------------------------------------
Y
Q
D
------------
R
---
F
--
A
----
I
V
A
V
-------
G
L
R
L
P
------
K
E
W
Q
P
V
------------------------------------------------------------------------------------------------------------------------------------------
L
T
Y
G
D
L
T
R
L
D
P
T
T
V
T
P
Q
Q
V
F
N
A
V
C
H
M
R
T
T
K
L
P
D
P
K
V
N
G
N
A
--