@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 : bsu07920: (2016-06-12 )
MNRIFFILVAAGVPLSVIGSLMHWPSAVLFAVYCVTIIALASYMGRATESLSIIAGPRIGGLLNATFGNAVELIISLFALKEGLTGIVLASLTGSVLGNLLLVAGLSFFVGGLKYKRQEFNIHDARHNSGLLIFAIIVAFVIPEVFSVGMGNASKLNLSIGISIIMILLYVAALYFKLVTHRGVYQPNNAAQTEEEEEPEWSGKVATIVLFAATIVVAYISENLVHTFHSVAEQFGWSELFIGVIIVAIVGNAAEHASAIIMAFKNKMDIAVEIAVGSTLQIAMFVAPVLVICSIFFPTSMPLVFTLPELVAMVSAVLLMIAISNDGDSNWFEGATLLAAYVIMAIGFFLL
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-----------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
-------------------------M
N
R
I
F
F
I
L
VAAGV
P
L
S
V
I
G
S
L
M---HW
P
S
A
V
-----
L
F
A
V
Y
C
V
T
I
I
--
A
L
A
S
Y
MGRATE
S
L
S
I
I
AG--P-RIG
G
L
L
N
A
TF------G
N
A
V
E
L
I
I
-
S
L
-
F
A
L
K
-E-G-----L
T
G
-----
I
V
L
A
S
L
T
G
S
V
L
---
G
N
L
L
L
V
A
G
L
S
F
F
V
G
-G
L
K
Y
K
R
Q
-EF
N
I
HD-AR-HNSG
L
L
I
F
A
I
I
V
-
A
F
V
I
------
P
E
V
F
-
S
VGM--G---------NA
S
K
------
L
N
L
S
I
G
I
S
I
I
M
I
L
L
Y
V
A
A
L
Y
F
K
L
V
T
HRGV-----YQPN--NAAQT------EEEEE--------P------EWSGK
V
A
T
--
I
V
L
F
A
A
T
I
V
V
A
Y
I
-
S
E
N
L
V
H
--------
T
F
H
S
V
A
E
QF------------G
W
S
----------
E
L
F
I
G
V
I
I
V
A
-------------IVGN
A
A
E
H
A
S
A
I
I
M
A
FKNKM--------
D
I
A
V
E
I
AVG
S
T
L
Q
I
-
A
M
F
V
A
P
V
L
V
I
C
S
I
--F----FPT-SM
P
L
-
V
F
--------
T
L
---
P
E
--
L
V
A
M
--
V
S
A
V
L
L
M
I
A
ISNDG------D---S
N
W
F
E
G
A
T
L
L
A
A
Y
V
I
M
A
I
--
G
F
F
LL------------------------------------------------------------------------------
1
PsiBlast_PDB
92.20
99%
-185
- C3 -
4KJS
-
CHAA_BACSU
A:
[4-351]
----------------------------
I
F
F
I
L
V
A
A
G
V
P
L
S
V
I
G
S
L
M
---
H
W
P
S
A
V
-----
L
F
A
V
Y
C
V
T
I
I
--
A
L
A
S
Y
M
G
R
A
T
E
S
L
S
I
-------
R
I
G
G
L
L
N
A
T
F
------
G
N
A
V
E
L
I
I
-
S
M
-
F
A
L
K
-
E
-
G
-----
L
T
G
-----
I
V
L
A
S
L
T
G
S
V
L
---
G
N
L
L
L
V
A
G
L
S
F
F
V
G
-
G
L
K
Y
A
R
Q
-
E
F
N
I
H
D
-
A
R
-
H
N
S
G
L
L
I
F
A
I
I
V
-
A
F
V
I
------
P
E
V
F
-
S
V
G
M
--
G
---------
N
A
S
K
------
L
N
L
S
I
G
I
S
I
I
M
I
L
L
Y
V
A
A
L
Y
F
K
---------------------------------------------------
S
G
K
V
A
T
--
I
V
L
F
A
A
T
I
V
V
A
Y
I
-
S
E
N
L
V
H
--------
T
F
H
S
V
A
E
Q
F
------------
G
W
S
----------
E
L
F
I
G
V
I
I
V
A
-------------
I
V
G
N
A
A
E
H
A
S
A
I
I
M
A
F
K
N
K
M
--------
D
I
A
V
E
I
A
V
G
S
T
L
Q
I
-
A
M
F
V
A
P
V
L
V
I
C
S
I
--
F
----
F
P
T
-
S
M
P
L
-
V
F
--------
T
L
---
P
E
--
L
V
A
M
--
V
S
A
V
L
L
M
I
A
I
S
N
D
G
------
D
---
S
N
W
F
E
G
A
T
L
L
A
A
Y
V
I
M
A
I
--
G
F
F
L
L
------------------------------------------------------------------------------
8
HHSearch
79.16
40%
-180
- C3 -
4K1C
22
VCX1_YEAST
A:
[45-402]
------------------------------
L
N
F
L
L
V
F
V
P
L
G
L
I
W
G
H
F
---
Q
L
S
H
T
L
-----
T
F
L
F
N
F
L
A
I
I
--
P
L
A
A
I
L
A
N
A
T
E
E
L
A
D
K
A
G
--
N
-
T
I
G
G
L
L
N
A
T
F
------
G
N
A
V
E
L
I
V
-
S
I
-
I
A
L
K
-
K
-
G
-----
Q
V
R
-----
I
V
Q
A
S
M
L
G
S
L
L
---
S
N
L
L
L
V
L
G
L
C
F
I
F
G
-
G
Y
N
R
V
Q
Q
-
T
F
N
Q
T
A
-
A
Q
-
T
M
S
S
L
L
A
I
A
-
C
A
-
S
L
L
I
------
P
A
A
F
-
R
A
T
L
--
P
FI-------
D
G
K
I
------
L
E
L
S
R
G
T
S
I
V
I
L
I
V
Y
V
L
F
L
Y
F
Q
L
G
S
H
H
A
L
-----
F
E
Q
Q
--
E
E
E
T
D
E
V
M
S
T
I
S
R
N
P
H
--------
H
------
S
L
S
V
K
S
S
L
--
V
I
L
L
G
T
T
V
I
I
S
F
C
-
A
D
F
L
V
G
--------
T
I
D
N
V
V
E
S
T
------------
G
L
S
----------
K
T
F
I
G
L
I
V
I
P
-------------
I
V
G
N
A
A
E
H
V
T
S
V
L
V
A
M
K
D
K
M
--------
D
L
A
L
G
V
A
I
G
S
S
L
Q
V
-
A
L
F
V
T
P
F
M
V
L
V
G
W
--
M
----
I
D
V
-
P
M
T
L
-
N
F
--------
S
T
---
F
E
--
T
A
T
L
--
F
I
A
V
F
L
S
N
Y
L
I
L
D
G
------
E
---
S
N
W
L
E
G
V
M
S
L
A
M
Y
I
L
I
A
M
--
A
F
F
Y
-------------------------------------------------------------------------------
17
Fugue
77.48
38%
-179
* C3 *
4K1C
22
VCX1_YEAST
A:
[27-406]
------------T
A
W
R
A
A
V
Y
D
L
Q
Y
I
L
K
A
S
P
L
N
F
L
L
V
F
V
P
L
G
L
I
W
G
H
F
---
Q
L
S
H
T
L
-----
T
F
L
F
N
F
L
A
I
I
--
P
L
A
A
I
L
A
N
A
T
E
E
L
A
D
K
A
G
--
N
-
T
I
G
G
L
L
N
A
T
F
------
G
N
A
V
E
L
I
V
-
S
I
-
I
A
L
K
-
K
-
G
-----
Q
V
R
-----
I
V
Q
A
S
M
L
G
S
L
L
---
S
N
L
L
L
V
L
G
L
C
F
I
F
G
-
G
Y
N
R
V
Q
Q
-
T
F
N
Q
T
A
-
A
Q
-
T
M
S
S
L
L
A
I
A
C
A
S
-
L
L
I
P
------
A
A
F
R
A
T
L
P
F
--
I
---------
D
G
K
I
------
L
E
L
S
R
G
T
S
I
V
I
L
I
V
Y
V
L
F
L
Y
F
Q
L
G
S
H
H
A
L
-----
F
E
Q
Q
--
E
E
E
T
D
------
E
V
M
S
T
--------
I
S
RN
P
H
H
S
L
S
V
K
S
S
L
--
V
I
L
L
G
T
T
V
I
I
S
F
C
-
A
D
F
L
V
G
--------
T
I
D
N
V
V
E
S
T
------------
G
L
S
----------
K
T
F
I
G
L
I
V
I
P
-------------
I
V
G
N
A
A
E
H
V
T
S
V
L
V
A
M
K
D
K
M
--------
D
L
A
L
G
V
A
I
G
S
S
L
Q
V
-
A
L
F
V
T
P
F
M
V
L
V
G
W
--
M
----
I
D
V
-
P
M
T
L
-
N
F
--------
S
T
---
F
E
--
T
A
T
L
--
F
I
A
V
F
L
S
N
Y
L
I
L
D
G
------
E
---
S
N
W
L
E
G
V
M
S
L
A
M
Y
I
L
I
A
M
--
A
F
F
Y
Y
PDE---------------------------------------------------------------------------
2
PsiBlast_PDB
75.40
39%
-180
- C3 -
4K1C
22
VCX1_YEAST
A:
[52-401]
-------------------------------------
V
P
L
G
L
I
W
G
H
F
---
Q
L
S
H
T
L
-----
T
F
L
F
N
F
L
A
I
I
--
P
L
A
A
I
L
A
N
A
T
E
E
L
A
D
K
A
G
--
N
-
T
I
G
G
L
L
N
A
T
F
------
G
N
A
V
E
L
I
V
-
S
I
-
I
A
L
K
-
K
-
G
-----
Q
V
R
-----
I
V
Q
A
S
M
L
G
S
L
L
---
S
N
L
L
L
V
L
G
L
C
F
I
F
G
-
G
Y
N
R
V
Q
Q
-
T
F
N
Q
T
A
-
A
Q
-
T
M
S
S
L
L
A
I
A
C
-
A
-
S
L
L
I
------
P
A
A
F
-
R
A
T
L
--
P
-------------FI
D
G
K
I
L
E
L
S
R
G
T
S
I
V
I
L
I
V
Y
V
L
F
L
Y
F
Q
L
G
S
H
H
A
L
-----
F
E
------
Q
Q
E
------
E
E
T
D
E
V
M
S
T
I
S
RN
P
------
H
H
S
L
S
V
K
S
S
L
V
I
L
L
G
T
T
V
I
I
S
F
C
-
A
D
F
L
V
G
--------
T
I
D
N
V
V
E
S
T
------------
G
L
S
----------
K
T
F
I
G
L
I
V
I
P
-------------
I
V
G
N
A
A
E
H
V
T
S
V
L
V
A
M
K
D
K
M
--------
D
L
A
L
G
V
A
I
G
S
S
L
Q
V
-
A
L
F
V
T
P
F
M
V
L
V
G
W
--
M
----
I
D
V
-
P
M
T
L
-
N
F
--------
S
T
---
F
E
--
T
A
T
L
--
F
I
A
V
F
L
S
N
Y
L
I
L
D
G
------
E
---
S
N
W
L
E
G
V
M
S
L
A
M
Y
I
L
I
A
M
--
A
F
F
--------------------------------------------------------------------------------
6
PsiBlast_CBE
75.33
39%
-178
- C3 -
4K1C
7
VCX1_YEAST
B:
[52-401]
-------------------------------------
V
P
L
G
L
I
W
G
H
F
---
Q
L
S
H
T
L
-----
T
F
L
F
N
F
L
A
I
I
--
P
L
A
A
I
L
A
N
A
T
E
E
L
A
D
K
A
G
--
N
-
T
I
G
G
L
L
N
A
T
F
------
G
N
A
V
E
L
I
V
-
S
I
-
I
A
L
K
-
K
-
G
-----
Q
V
R
-----
I
V
Q
A
S
M
L
G
S
L
L
---
S
N
L
L
L
V
L
G
L
C
F
I
F
G
-
G
Y
N
R
V
Q
Q
-
T
F
N
Q
T
A
-
A
Q
-
T
M
S
S
L
L
A
I
A
C
-
A
-
S
L
L
I
------
P
A
A
F
-
R
A
T
L
--
P
-------------D
G
K
I
--
L
E
L
S
R
G
T
S
I
V
I
L
I
V
Y
V
L
F
L
Y
F
Q
L
G
S
H
H
A
L
-----
F
E
------
Q
Q
E
------
E
E
T
D
E
V
M
S
T
I
S
RN
P
------
H
H
S
L
S
V
K
S
S
L
V
I
L
L
G
T
T
V
I
I
S
F
C
-
A
D
F
L
V
G
--------
T
I
D
N
V
V
E
S
T
------------
G
L
S
----------
K
T
F
I
G
L
I
V
I
P
-------------
I
V
G
N
A
A
E
H
V
T
S
V
L
V
A
M
K
D
K
M
--------
D
L
A
L
G
V
A
I
G
S
S
L
Q
V
-
A
L
F
V
T
P
F
M
V
L
V
G
W
--
M
----
I
D
V
-
P
M
T
L
-
N
F
--------
S
T
---
F
E
--
T
A
T
L
--
F
I
A
V
F
L
S
N
Y
L
I
L
D
G
------
E
---
S
N
W
L
E
G
V
M
S
L
A
M
Y
I
L
I
A
M
--
A
F
F
--------------------------------------------------------------------------------
19
Fugue
59.13
18%
-150
- C3 -
4KPP
4
?
A:
[2-396]
-----------------------DF
T
K
E
K
F
Q
L
L
A
I
S
S
L
T
L
P
W
L
I
S
L
A
F
N
Y
H
H
P
A
L
T
-----
Q
T
L
L
S
G
L
A
V
V
--
S
A
S
F
L
I
S
W
A
A
E
T
A
E
M
D
V
P
--
R
-
S
F
S
L
A
I
V
A
L
L
------
A
V
L
P
E
Y
A
V
D
G
Y
-
F
A
W
K
-
A
-
G
-----
S
V
G
GE
Y
V
H
Y
A
T
A
N
M
T
G
A
N
R
---
L
L
I
G
I
G
W
S
L
V
A
F
I
A
-
F
R
T
L
K
S
K
-
E
V
E
L
D
D
G
I
R
-
L
E
I
F
F
L
F
L
A
T
L
Y
-
A
F
T
L
------
P
L
K
G
-
H
I
---------------------------
S
P
F
D
A
L
V
F
V
S
L
Y
A
I
Y
I
Y
L
S
T
K
A
E
R
E
E
-----
V
E
V
G
--
G
V
P
A
Y
------
L
C
S
L
K
--------
T
------
E
T
R
R
L
S
V
V
--
V
L
F
L
F
A
G
F
T
I
L
M
S
-
V
E
A
F
S
E
--------
G
L
L
E
T
A
R
I
A
------------
G
I
D
----------
E
F
L
A
V
Q
W
I
A
P
-------------
L
A
S
E
S
P
E
L
I
V
A
I
Y
F
V
R
R
F
R
V
--------
S
A
S
M
N
A
L
I
S
S
K
V
N
Q
W
T
L
L
I
G
T
I
A
I
I
Y
S
I
S
A
F
----
K
L
Q
-
S
L
P
L
D
A
R
--------
Q
S
---
E
E
--
V
L
L
T
--
A
A
Q
S
L
F
A
V
A
I
L
L
D
L
------
K
---
I
S
W
K
E
A
S
A
L
F
L
L
F
I
V
Q
L
L
F
P
G
V
E
V
R
Y
I
I
S
A
I
Y
I
I
L
S
L
P
I
L
F
A
K
R
K
E
I
V
E
S
F
R
T
V
K
R
L
I
S
LE------------------------------------------
9
HHSearch
57.77
15%
-155
- C3 -
4KPP
4
?
A:
[10-356]
-----------------------------
L
L
A
I
S
S
L
T
L
P
W
L
I
S
L
A
F
N
Y
--
H
H
P
A
L
T
-----
Q
T
L
L
S
G
L
A
V
V
--
S
A
S
F
L
I
S
W
A
A
E
T
A
E
M
D
V
P
--
R
-
S
F
S
L
A
I
V
A
L
L
------
A
V
L
P
E
Y
A
V
-
D
G
-
Y
F
A
W
-
K
A
G
S
VGGE
Y
V
H
-----
Y
A
T
A
N
M
T
G
A
N
R
---
L
L
I
G
I
G
W
S
L
V
A
F
I
A
-
F
R
T
L
K
S
K
-
E
V
E
L
D
D
G
I
R
-
L
E
I
F
F
L
F
L
A
-
T
L
Y
A
F
T
L
------
P
--
L
--------------------
K
------
G
H
I
S
P
F
D
A
L
V
F
V
S
L
Y
A
I
Y
I
Y
L
S
T
K
A
E
R
E
E
-----
V
E
V
G
--
G
V
P
A
Y
L
-----
C
S
L
K
T
--------
E
------
T
R
R
L
S
V
-
V
--
V
L
F
L
F
A
G
F
T
I
L
M
S
-
V
E
A
F
S
E
--------
G
L
L
E
T
A
R
I
A
------------
G
I
D
----------
E
F
L
A
V
Q
W
I
A
P
-------------
L
A
S
E
S
P
E
L
I
V
A
I
Y
F
V
R
R
F
R
V
--------
S
A
S
M
N
A
L
I
S
S
K
V
N
Q
-
W
T
L
L
I
G
T
I
A
I
I
Y
S
--
I
----
S
A
F
K
L
Q
S
L
-
P
L
--------
D
A
R
Q
S
E
E
--
V
L
L
T
--
A
A
Q
S
L
F
A
V
A
I
L
L
D
L
------
K
---
I
S
W
K
E
A
S
A
L
F
L
L
F
I
V
Q
L
L
--
F
P
G
--------------------------------------------------------------------------------
18
Fugue
51.27
16%
-161
- C3 -
3V5U
21
Y091_METJA
A:
[1-304]
---------------------------------------
M
V
I
L
G
V
G
Y
---
F
L
L
G
L
I
-----
L
L
Y
Y
G
S
D
W
F
V
--
L
G
S
E
R
I
A
R
H
F
N
V
S
N
F
V
I
G
--
A
-----
T
V
M
A
I
G
------
T
S
L
P
E
I
L
T
-
S
A
-
Y
A
S
Y
-
M
-
H
-----
A
P
G
-----
I
S
I
G
N
A
I
G
S
C
I
---
C
N
I
G
L
V
L
G
L
S
A
I
I
S
-
P
I
I
V
D
K
N
-
L
Q
K
N
I
L
-
V
Y
-
L
L
F
V
I
F
A
A
V
I
G
I
-
D
-----------------------------------------
G
F
S
W
I
D
G
V
V
L
L
I
L
F
I
I
Y
L
R
W
T
V
K
N
G
S
A
---------------------------
K
--------
N
------
N
P
S
V
V
F
S
L
--
V
L
L
I
I
G
L
I
G
V
L
V
G
-
A
E
L
F
V
D
--------
G
A
K
K
I
A
L
A
L
------------
D
I
S
----------
D
K
V
I
G
F
T
L
V
A
-------------
F
G
T
S
L
P
E
L
M
V
S
L
A
A
A
K
R
N
L
G
--------
G
M
V
L
G
N
V
I
G
S
N
I
A
D
-
I
G
G
A
L
A
V
G
S
L
F
M
--------------
H
L
-
P
A
--------
E
N
---
V
Q
--
M
A
V
L
--
V
I
M
S
L
L
L
Y
L
F
A
K
Y
S
------
K
---
I
G
R
W
Q
G
I
L
F
L
A
L
Y
I
I
A
I
A
--
S
L
R
M
G
GG----------------------------------------------------------------------------
20
Fugue
50.78
16%
-177
- C3 -
4WGV
-
?
A:
[45-439]
-------------------VGYMD
P
G
N
W
I
T
S
M
Q
G
G
A
Q
Y
G
Y
T
L
L
F
V
I
L
---
I
S
S
L
A
A
-----
M
L
L
Q
S
M
T
V
R
L
--
G
I
A
T
-----
G
K
D
L
A
Q
M
T
R
--
H
-
F
L
S
K
P
V
A
I
I
F
------
W
I
I
A
E
L
A
I
-
I
A
-
T
D
I
A
-
E
-
V
-----
I
G
S
-----
A
I
A
L
D
L
I
F
G
I
-----
P
L
I
V
G
A
L
I
T
V
F
D
V
-
F
L
L
L
F
I
M
-
R
F
G
F
R
K
-
I
E
-
A
I
V
G
T
L
I
F
T
V
L
A
-
I
F
V
F
E
VFISS
P
Q
L
T
-
D
I
L
N
--
G
FVPHKEIVT
N
Q
G
I
------
L
Y
I
A
L
G
I
I
G
A
T
I
M
P
H
N
L
Y
L
H
S
S
I
V
Q
S
R
K
Y
-----
D
R
H
D
--
N
E
E
K
A
------
Q
A
I
K
Y
--------
A
------
T
I
D
S
N
L
Q
L
--
S
I
A
F
V
V
N
C
L
L
L
T
L
-
G
A
A
L
F
F
GTKTNDLG
G
F
Y
D
L
Y
H
A
L
K
T
EPVLGA
T
L
G
G
V
M
S
----------
T
L
F
A
V
A
L
L
A
S
-------------
G
Q
N
S
T
I
T
G
T
L
A
G
Q
I
V
M
E
G
F
L
--------
R
L
S
I
P
N
W
L
R
R
L
I
T
R
-
S
L
A
V
I
P
V
I
I
C
L
I
I
--
F
KGN
S
E
K
I
-
E
Q
L
L
-
V
F
--------
S
Q
---
V
F
--
L
S
I
A
L
P
F
S
L
I
P
L
Q
L
A
T
S
N
K
K
LMGPFI
N
---
K
T
W
V
N
I
I
S
W
T
L
I
V
I
L
S
G
L
--
N
V
Y
--------------------------------------------------------------------------------
25
Fugue
49.43
19%
-193
- C3 -
4IKW
20
?
A:
[3-494]
SID
K
Q
Q
I
A
A
S
VPQRGFFGHPK
G
L
F
T
L
F
F
T
E
F
W
E
R
F
S
Y
Y
G
M
R
A
I
L
V
Y
Y
---
M
Y
Y
E
V
S
KGGLG
L
D
E
H
L
A
L
A
I
M
--
S
I
Y
G
A
L
V
Y
M
S
G
I
I
G
G
W
L
A
--
D
-
R
V
F
G
T
S
R
A
V
F
------
Y
G
G
L
L
I
M
A
-
G
H
-
I
A
L
A
I
P
-
G
-----
G
V
A
-----
A
L
F
V
S
M
A
L
I
V
L
---
G
T
G
L
L
K
P
N
V
S
S
I
V
G
-
D
M
-------
Y
K
P
G
D
-
D
R
-
R
D
A
G
F
S
I
F
Y
M
G
I
-
N
L
G
A
------
F
L
A
P
-
L
V
V
G
--
T
---------
A
G
M
K
------
Y
N
F
H
L
G
F
G
L
A
A
V
G
M
F
L
G
L
V
V
F
V
A
T
R
K
K
N
L
GLAGT
Y
V
P
N
P
L
T
P
A
E
K
------
K
K
A
A
A
--------
I
------
M
A
V
G
A
V
V
I
--
A
V
L
L
A
I
L
I
P
N
G
W
F
-
T
---
V
E
--------
T
F
I
S
L
V
G
I
L
------------
G
I
I
----------
I
P
I
I
Y
F
V
V
M
Y
R
SPKTT
A
E
E
R
S
R
V
I
A
Y
I
P
L
F
V
A
S
A
M
F
W
A
I
Q
E
Q
G
ST
I
L
A
N
Y
A
D
K
R
T
Q
L
D
V
A
G
I
H
L
S
-
P
A
W
F
Q
S
L
N
P
L
F
I
I
--
I
----
L
A
P
-
V
F
A
W
-
M
W
V
K
L
GKRQP
T
I
---
P
Q
K
F
A
L
G
L
--
L
F
A
G
L
S
F
I
V
I
L
V
P
G
------
H
L
S
G
G
G
L
V
H
P
I
W
L
V
L
S
Y
F
I
V
V
L
--
G
E
L
C
L
SPV
G
L
S
A
T
T
K
L
APAAFSAQ
T
M
S
L
W
F
L
S
N
A
A
A
Q
A
I
N
A
Q
L
VRFYTPENETA
Y
F
G
T
I
G
G
A
A
L
V
L
G
L
I
L
L
A
I
A
P
R
I
G
R
L
MKG
24
Fugue
42.85
17%
-165
- C2 -
1FXO
2
?
A:
[2-293]
---------------------------
K
R
K
G
I
I
L
A
G
G
S
G
-
T
R
L
H
P
A
T
---
L
A
I
S
K
Q
-----
L
L
P
V
Y
D
K
P
M
I
Y
Y
P
L
S
T
L
M
L
A
G
I
R
E
I
L
I
I
S
T
--
P
-
Q
D
T
P
R
F
Q
Q
L
L
------
G
D
G
S
N
W
G
L
-
D
L
Q
Y
A
V
Q
-
P
-
S
-----
P
D
G
-----
L
A
Q
A
F
L
I
G
E
S
F
IGN
D
L
S
A
L
V
L
G
D
N
L
Y
Y
G
H
D
F
H
E
L
L
G
-
S
A
S
-----
Q
-
R
Q
T
G
A
S
V
F
A
Y
H
V
-
L
D
--------
P
E
R
Y
-
G
V
V
E
F
D
Q
---------
G
G
K
A
------
I
S
L
E
E
K
P
L
E
P
K
S
N
Y
A
V
T
G
L
Y
F
Y
--------------
D
Q
--
Q
V
V
D
I
------
A
R
D
L
K
--------
P
------
S
P
R
G
E
L
E
-------
I
T
D
V
N
R
A
Y
L
-
E
R
G
-------------
Q
L
S
V
E
I
M
------------
G
R
G
----------
Y
A
W
L
D
T
G
T
H
D
-------------
S
L
L
E
A
G
Q
F
I
A
T
L
E
N
R
Q
G
L
K
V
--------
A
C
P
E
E
I
A
Y
R
Q
K
W
---------------------------------
I
--------
D
A
---
A
Q
--
L
E
K
L
--
A
A
P
L
-------------------------
A
K
N
G
Y
G
Q
Y
L
K
R
L
L
--
T
E
T
V
Y
------------------------------------------------------------------------------
12
HHSearch
36.45
17%
-165
- C3 -
4K1C
11
VCX1_YEAST
A:
[258-404]
-----------------------------------------------------
S
L
V
-----
I
L
L
G
T
T
V
I
I
S
--
F
C
A
D
F
L
V
G
T
I
D
N
V
V
E
S
T
G
LS
K
T
F
I
G
L
I
V
I
P
I
V
------
G
N
A
A
E
H
V
T
-
S
V
-
L
V
A
M
-
K
-
D
-----
K
M
D
-----
L
A
L
G
V
A
I
G
S
S
L
---
Q
V
A
L
F
V
T
P
F
M
V
L
V
G
-
W
M
I
D
V
P
M
-
T
L
N
F
S
T
----
F
E
T
A
T
L
F
I
A
-
V
F
-
L
S
-
N
--------
Y
L
-
I
-----------------
L
D
------
G
E
S
N
W
L
E
G
V
M
S
L
A
M
Y
I
L
I
A
M
A
F
F
Y
Y
P
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
Fugue
34.46
18%
-155
- C3 -
3D8L
-
?
A:
[1-91]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
A
K
Q
L
S
T
A
R
K
F
K
M
I
T
G
K
D
L
-----
F
Q
Q
Q
--
K
A
M
D
T
------
E
L
K
K
E
--------
D
------
G
E
I
T
D
L
M
E
--
F
V
Q
Y
G
L
Y
L
A
L
F
Q
D
N
I
V
K
A
K
S
--------
D
F
S
D
F
R
S
S
F
------------
E
F
D
TDGKG
L
K
E
L
V
E
L
W
Q
K
E
I
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
HHSearch
33.34
14%
-173
- C3 -
4KJR
-
CHAA_BACSU
A:
[206-348]
-----------------------------------------------------
A
T
I
-----
V
L
F
A
A
T
I
V
V
A
--
Y
I
S
E
N
L
V
H
T
F
H
S
V
A
E
Q
F
G
WS
E
L
F
I
G
V
I
I
V
A
I
V
------
G
N
A
A
E
H
A
S
-
A
I
-
I
M
A
F
-
K
-
N
-----
K
M
D
-----
I
A
V
E
I
A
V
G
S
T
L
---
Q
I
A
M
F
V
A
P
V
L
V
I
C
S
-
I
F
F
P
T
S
---
M
P
L
V
F
-
T
L
-
P
E
L
V
A
M
V
S
A
-
V
L
-
L
M
I
---------
A
I
-
S
-----------------
N
D
------
G
D
S
N
W
F
E
G
A
T
L
L
A
A
Y
V
I
M
A
I
G
F
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
HHSearch
30.08
22%
-146
- C1 -
2HFR
-
A:
[3-11]
---------------------------------
F
W
P
L
V
P
V
A
I
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
Fugue
29.39
26%
-
- C3 -
4DAC
-
?
A:
[1-26]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
V
-----
Y
K
L
D
--
A
N
V
K
R
------
L
E
K
E
V
--------
G
------
K
L
E
G
E
V
A
R
--
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
HHSearch
29.13
16%
-150
- C3 -
4KPP
2
?
A:
[210-357]
------------------------------------------------------
V
V
-----
L
F
L
F
A
G
F
T
I
L
--
M
S
V
E
A
F
S
E
G
L
L
E
T
A
R
I
A
G
ID
E
F
L
A
V
Q
W
I
A
P
L
A
------
S
E
S
P
E
L
I
V
-
A
I
-
Y
F
V
R
-
R
-
F
-----
R
V
S
-----
A
S
M
N
A
L
I
S
S
K
V
---
N
Q
W
T
L
L
I
G
T
I
A
I
I
Y
-
S
I
S
A
F
K
L
Q
S
L
P
L
D
A
-
R
Q
S
E
E
V
L
L
T
A
A
Q
-
S
L
-
F
A
-
V
--------
A
I
-
L
-----------------
L
D
------
L
K
I
S
W
K
E
A
S
A
L
F
L
L
F
I
V
Q
L
L
F
P
G
V
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
16.61
29%
-117
- C3 -
5C5X
-
AQP5_HUMAN
A:
[29-99]
------------------------------------------
L
G
S
A
L
---
K
W
P
S
A
L
-----------
P
T
I
L
--
Q
I
A
L
A
F
G
L
A
I
G
T
L
A
Q
A
L
G
--
P
-
V
S
G
G
H
I
N
P
A
I
T
L
A
L
L
V
G
N
Q
I
S
L
L
R
-
A
F
-
F
Y
V
A
-
A
-
Q
-----
L
V
G
-----
A
I
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
16.20
29%
-110
- C3 -
3D9S
1
AQP5_HUMAN
A:
[30-100]
------------------------------------------
L
G
S
A
L
---
K
W
P
S
A
L
-----------
P
T
I
L
--
Q
I
A
L
A
F
G
L
A
I
G
T
L
A
Q
A
L
G
--
P
-
V
S
G
G
H
I
N
P
A
I
T
L
A
L
L
V
G
N
Q
I
S
L
L
R
-
A
F
-
F
Y
V
A
-
A
-
Q
-----
L
V
G
-----
A
I
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
16.14
29%
-110
- C3 -
5DYE
-
AQP5_HUMAN
A:
[29-99]
------------------------------------------
L
G
S
A
L
---
K
W
P
S
A
L
-----------
P
T
I
L
--
Q
I
A
L
A
F
G
L
A
I
G
T
L
A
Q
A
L
G
--
P
-
V
S
G
G
H
I
N
P
A
I
T
L
A
L
L
V
G
N
Q
I
S
L
L
R
-
A
F
-
F
Y
V
A
-
A
-
Q
-----
L
V
G
-----
A
I
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------