@TOME V2.2
(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 : T0781: (2014-05-16 )
MKKMEKKWPFVFNGIVIFCLILLILGMRWQAKKEESEVLNVTESLQKESEITSFSEEEEAVLYMLSALKKNDLDMALRGCAIDETALQINFVKTAEELPGMQLIDLPAPTSDYSYYFPLTSAEMTKAYIEQFEELSTEIPEIETLEVLEIAEKKEKEREEQLAECLAAQEVSELEIYVKCGEQSYRLGFTAVQYEKNWKIHSLKEGLLYETDIPACVQMEEMREAKKTYVLPNQLTGANYFQAMPISEKTPQRAVEQFIYAIEKGDLTRALAFATTESSQDTSPELLKKQGEYAKELKTMLYGFLGTEDARLYGKSEEQLNKLRGKLNPEYMVYLDLIKVIPIETEENTETVKQYAGLYSYNGKNYLTGYTLCRQEDGWQIQSLSAPALSLESGEVMRLSKEESRKTSEQSVLKAEKNER
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---------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
--------MKKMEKKW
P
F
VFN
G
I
V
-----
I
F
C
-
L
I
L
L
I-LGMRW-QAK--------KE
E
S
E
V
L
--
N
V
T
E
S
L
Q
K
E
-----SEITSF
S
E
E
---
E
E
A
V
L
Y
---------
M
-------
L
S
A
---LKKN
D
-
L
D
M
-
A
L
R-----------------GCAIDE
T
A
L
Q
I
N
--------
F
V
K
T
A
E
---------------EL-PG
M
Q
----
L
I
DLPAP-----TSD
Y
S
Y
-------
Y
F
PL
T
S
A
E
-
M
T
K
--------
A
Y
-------------
I
E
Q
F
E
E
L
S
TEIPE--I
E
T
L
E
V
L
E
I
A
E
K
K
E
-
K
-
E
R
E
-----------------------
E
Q
L
A
E
C
---------
L
--
A
A
Q
-
E
V
S
E
L
E
I
Y
V
K
CGEQ
S
Y
R
LG
F
T
-----
A
V
Q
----
Y
EKN
W
K
I
H
SLKEG
L
L
-YETDI
P
A
C
V
Q
M
E
E
M
R
-
E
A
K
K
T
-
Y
VLPNQ-LTGAN
Y
-
F
QAM-PISEK
T
P
Q
R
---
A
V
E
Q
F
I
Y
A
IEKGD
L
T
R
A
L
A
F
ATTES----SQDT
S
P
E
L
L
K
KQ------
G
E
Y
A
K
E
L
K
----------------------
T
M
L
Y
G
FLGTE
D
A
R
LYGK
S
E
E
Q
L
N
K
L
RGK--LNPE
Y
M
V
Y
L
D
L
I
K
VIPIETEE-
N
T
E
T
V
K
Q
Y
A
G
LYSYN--GK
N
Y
L
T
G
Y
---
T
L
C
RQEDG
W
Q
I
QSLS----APALSLE-SG
E
---
V
M
RL
S
---
K
E
E---SRK
T
S
E
-------
Q
S
V
L
K
AEKNER-----------------------------------------------------------------------------------------
23
Fugue
90.86
15%
-23
- C3 -
4FDT
1
?
A:
[21-425]
-MQT
K
I
Q
K
Y
A
G
T
A
M
P
Y
P
N
R
T
D
G
M
T
-----
P
F
Y
-
I
N
H
L
G
R
H
G
A
R
F
P
T
S
R
--------
K
A
L
D
K
V
E
--
K
V
L
V
S
A
Q
Q
E
-----
N
G
L
T
S
E
G
M
A
---
L
L
S
M
I
R
---------
R
-------
L
S
R
---
L
F
D
G
Q
-
W
G
K
-
L
S
K
-----------------
L
G
E
T
E
Q
E
G
I
A
G
R
--------
M
I
R
N
Y
P
---------------
Q
L
F
S
N
S
A
----
K
I
E
A
I
A
T
------------------
Y
V
P
R
S
I
N
S
-
M
-
D
--------
A
F
-------------
L
S
C
M
I
R
H
N
P
A
L
---------------
Q
V
Q
-
R
-
S
E
G
-----------------------
K
Q
Y
N
H
I
---------
L
--
R
F
F
-
D
L
N
--
K
S
Y
V
N
Y
K
E
K
G
D
W
L
P
I
Y
-----
K
A
F
----
V
H
K
K
I
S
P
V
P
I
M
K
K
F
L
---------
L
N
P
E
Q
Y
L
-
D
K
E
A
E
-
E
F
V
M
A
L
-
F
S
V
A
A
I
-
L
P
D
T
-
S
I
P
L
N
L
E
D
L
---
F
T
L
D
E
W
H
R
Y
W
Q
T
Q
N
L
R
Q
Y
M
S
K
S
S
A
P
----
V
G
K
M
L
P
V
A
I
---------------
A
W
----------------------
P
L
L
S
E
F
I
R
S
A
Q
E
V
I
S
G
K
S
D
Y
Q
A
N
-
F
R
F
A
--
H
A
E
T
V
I
P
F
V
S
L
M
G
I
E
K
T
D
V
Q
V
C
R
P
D
S
V
S
V
Y
W
K
D
Y
E
I
S
--
P
M
A
A
N
V
Q
W
---
L
F
Y
R
D
R
D
Q
R
I
W
V
K
I
L
L
NE
E
A
A
A
L
P
I
S
-
T
A
C
---
F
P
Y
Y
S
---
W
E
K
---
T
R
I
F
F
N
-------
Q
R
I
E
M
A
K
K
T
L
S
V
F
N--------------------------------------------------------------------------------------
20
Fugue
83.13
20%
1
- C2 -
4C2E
-
CTPB_BACSU
A:
[2-436]
AD
S
E
R
D
K
A
M
D
K
I
E
K
A
Y
E
L
I
S
N
E
Y
V
EKVD
R
E
K
L
-
L
E
G
A
I
-
Q
G
M
L
S
-
T
L
N
--------
D
P
Y
S
V
Y
M
--
D
K
Q
T
A
K
Q
F
S
-----
D
S
L
D
S
S
F
E
G
---
I
G
A
E
V
G
---------
M
E
DG
K
I
I
I
V
S
P
---
F
K
K
S
P
-
A
E
K
-
A
-------------------
G
L
K
P
N
D
E
I
I
S
I
N
GESMAGKD
L
N
H
A
V
L
---------------
K
I
-
R
G
K
K
G
S
S
V
S
M
K
I
Q
R
P
-----
G
T
K
K
Q
L
-------
S
F
R
I
K
R
A
E
-
I
P
L
--------
E
T
-------------
V
F
A
S
E
K
K
V
Q
G
-
H
S
--
V
G
Y
I
A
I
S
T
F
S
E
H
T
T
-
E
-
D
F
A
-----------------------
K
A
L
R
E
----------
L
--
E
K
K
-
E
I
E
G
L
V
I
D
V
R
G
N
P
G
G
Y
-----------------------
I
Q
S
V
E
E
I
L
K
H
F
V
T
K
D
Q
P
Y
I
Q
I
A
E
R
N
-
G
D
K
K
R
-
Y
--
F
S
T
-
L
T
H
K
K
A
-
Y
P
V
N
-
V
I
T
D
K
G
S
A
A
---
A
S
E
I
L
A
G
A
L
K
E
A
G
H
Y
D
V
V
G
---
D
T
S
----
F
G
K
G
T
V
Q
Q
A
V
P
M
------
G
D
G
S
-
N
I
K
----------------------
L
T
L
Y
K
W
L
T
P
N
G
N
W
I
H
K
K
G
I
E
P
T
I
A
I
K
-----
Q
P
D
Y
F
S
A
G
P
L
Q
L
K
E
P
L
K
V
D
M
-
N
N
E
D
V
K
H
A
Q
V
L
L
K
G
L
--
S
F
D
P
----------
G
R
E
D
G
Y
F
S
K
D
M
K
----
K
A
V
M
A
F
Q
-
D
Q
N
---
K
L
N
K
T
GII
D
T
R
---
T
A
E
T
L
N
-------
Q
Q
I
E
K
K
K
S
D
E
K
ND
L
Q
L
Q
T
A
L
K
S
L
F----------------------------------------------------------------------------
18
Fugue
66.50
16%
-10
- C3 -
4CGY
-
?
A:
[22-640]
------FS
R
A
A
M
E
M
A
L
R
G
V
R
---
K
-----
V
L
C
-
V
A
E
K
N
-
D
A
A
K
G
-
I
A
D
--------
L
L
S
N
G
R
M
--
R
R
R
E
G
L
S
K
F
-----
N
K
I
Y
E
F
D
Y
H
L
YG
Q
N
V
T
M
V
---------
M
-------
T
S
V
SGH
L
L
A
H
D
-
F
Q
M
-
Q
F
R
KWQSCNPLVLFE
A
E
I
E
K
Y
C
P
E
N
F
V
D
I
K
K
T
--------
L
E
R
E
T
R
Q
CQ
A
L
V
I
WTDCD
R
E
G
E
N
-
I
G
F
E
----
I
I
H
V
C
K
A
V
KPN
L
Q
V
L
R
A
R
-------
F
S
E
I
T
P
H
A
-
V
R
T
--------
A
C
E
N
LTEPD
Q
R
V
S
D
A
V
D
V
R
Q
E
L
D
L
R
I
G
A
A
-
F
T
R
F
Q
T
L
R
L
Q
R
I
F
P
-
E
-
V
L
A
-----------------------
E
Q
L
I
S
Y
G
S
C
Q
F
P
T
L
G
F
--
V
V
E
-
R
F
K
A
I
Q
A
F
V
P
--
E
I
F
H
R
I
K
V
T
-----
H
D
H
KD
G
I
V
E
F
N
W
K
R
H
R
L
F
N
H
T
A
-
C
L
V
L
Y
Q
L
C
V
E
-
D
P
M
A
-
T
V
V
E
V
-
R
S
K
P
K
S
-
K
W
R
P
Q
A
-
L
D
T
V
-
E
L
E
K
L
A
S
R
K
LRI
N
A
K
E
T
M
R
I
A
E
K
L
Y
T
Q
G
Y
I
S
Y
P
R
T
E
T
NIFP
R
D
L
N
L
T
V
L
V
E
Q
Q
TPDPRW
G
A
F
A
Q
S
I
L
E
R
GGPTPRNGNKSDQAHPPIHP
T
K
Y
T
N
N
L
Q
G
D
E
Q
R
L
Y
E
F
I
V
R
H
F
L
A
C
C
S
Q
D
A
Q
G
Q
E
T
T
V
E
I
D
I
A
Q
-
E
R
F
V
A
H
G
-
L
M
I
L
A
R
N
Y
L
D
V
Y
P
Y
D
H
W
S
D
K
I
L
P
V
Y
EQG
S
H
F
Q
P
S
T
V
E
M
V
D
G
E
T
----
S
P
P
K
L
L
T
-
E
A
D
---
L
I
A
L
M
---
E
K
H
GIG
T
D
A
T
H
A
-------
E
H
I
E
T
I
K
A
R
M
Y
V
G
L
T
PDK
R
F
L
P
G
H
L
G
M
G
L
V
E
G
Y
D
S
MGYEMSKP
D
L
R
A
E
L
E
A
D
L
K
L
I
C
D
GKKD
K
F
V
V
L
R
Q
Q
V
Q
K
Y
K
Q
V
F
I
E
A
V
A
K
A
K
K
L
D
E
A
L
A
Q
Y
FGNGT
24
Fugue
65.29
22%
12
- C2 -
3DSM
-
?
A:
[1-327]
-------------------
A
S
G
L
F
-----
I
T
N
-------------
E
G
N
--------
F
Q
Y
S
-----
N
A
T
L
S
Y
Y
D
P
-----
A
T
C
----
E
V
---
E
N
E
V
F
Y
---------
R
-------
A
N
G
---
F
K
L
G
D
V
A
Q
S
M
V
I
R
-----------------
D
G
I
G
W
I
V
V
N
N
S
H
--------
V
I
F
A
I
D
---------------
I
N
-
T
F
K
E
----
V
G
R
I
T
G
F
-----
T
S
--
P
R
-------
Y
I
H
F
L
S
D
E
---
K
--------
A
Y
-------------
V
T
Q
I
W
D
Y
R
I
F
I
I
N
--
P
K
T
Y
E
I
T
G
Y
I
E
C
P
D
M
D
M
E
S
-----------------------------
G
---------
S
--
T
E
Q
M
V
Q
Y
G
K
Y
V
Y
V
N
C
--
W
S
Y
Q
-----------------
N
R
I
L
K
I
D
T
E
T
D
K
V
V
-
D
E
L
T
I
G
--
I
Q
P
T
S
L
V
M
D
K
Y
N
K
M
W
T
I
T
D
G
G
Y
E
G
S
P
Y
-
G
Y
E
A
-
P
---------------
S
L
Y
R
I
D
A
E
T
F
T
V
E
K
Q
F
K
F
-----------------
K
L
------
G
D
W
P
-------------------------------------------
S
E
V
Q
L
N
G
T
R
D
T
--
L
---
Y
W
I
N
N
D
I
W
R
--
P
V
E
A
D
R
-
V
P
V
R
P
-----
F
L
E
F
R
--
D
T
K
Y
-
Y
G
L
---
T
V
-
N
P
N
N
G
---
E
V
Y
V
----
A
D
A
I
D
Y
Q
Q
Q
G
I
---
V
Y
R
Y
S
---
P
Q
G
---
K
L
I
D
E
F
Y
V
G
I
I
PG
A
F
C
W
K
L
E
H
H
H
H
H
----------------------------------------------------------------------------------------
19
Fugue
63.75
13%
-21
- C1 -
1NVM
-
ACDH_PSEUF
B:
[1-312]
-----------
M
N
Q
K
L
K
V
A
I
I
G
S
G
-----
N
I
G
-
T
D
L
M
I
-
K
V
L
R
N
-
A
K
Y
--------
L
E
M
G
A
M
V
G
I
D
A
A
S
D
G
L
A
R
-----
A
Q
R
M
G
V
T
T
T
---
Y
A
G
V
E
G
---------
L
-------
I
K
L
---
P
E
F
A
D
-
I
D
F
-
V
F
D
-----------------
A
T
S
A
S
A
H
V
Q
N
E
A
--------
L
L
R
Q
A
K
------------------
P
G
I
R
----
L
I
D
L
T
-
P
-----
A
A
I
G
P
Y
-------
C
V
P
V
V
N
L
E
-
E
H
L
--------
G
K
--------------
L
N
V
N
M
V
T
--
C
G
G
--
Q
A
T
I
P
M
V
A
A
V
S
R
V
--------------------------------------------------
A
-
K
V
H
Y
A
E
I
V
A
S
I
S
S
K
S
-----
A
-----
G
P
G
----
T
R
A
N
----------------------
I
D
E
F
T
-
E
T
T
S
K
-
A
I
E
V
---
I
G
G
A
A
K
-
G
K
A
I
I
I
M
N
P
A
E
P
P
L
---
I
M
R
D
T
V
Y
V
L
S
A
-------------------
A
A
D
Q
A
A
V
A
A
S
V
------
A
E
M
V
Q
A
V
Q
----------------------
A
Y
V
P
G
Y
R
L
K
Q
Q
V
-----
Q
F
D
V
I
P
E
S
A
P
L
--
N
I
P
G
L
G
R
F
S
G
L
K
T
S
V
F
L
E
V
E
G
-
A
A
H
Y
L
P
A
Y
A
---------------------------------------
G
N
L
D
I
M
-
T
S
A
---
A
L
A
T
A
---
E
R
M
---
A
Q
S
M
L
N
-------
A
---------------------------------------------------------------------------------------------------
16
Fugue
58.63
14%
-16
- C3 -
1KOR
3
ASSY_THET8
A:
[1-395]
-------------------
M
K
I
V
L
-----
A
Y
S
G
G
L
D
T
S
-
I
I
L
K
W
-
L
K
E
--------
T
Y
R
A
E
V
I
--
A
F
T
A
D
I
G
Q
G
-------
E
E
V
E
E
A
R
---
E
K
A
L
R
T
GAS
K
A
I
A
L
D
L
-------
K
E
E
---
F
V
R
D
F
-
V
F
P
-
M
M
R
A
GAVYEGYYLL------
G
T
S
I
A
R
P
L
I
A
K
H
--------
L
V
R
I
A
E
---------------
E
E
-
G
A
E
A
----
I
A
H
G
A
T
G
-----
K
G
N
D
Q
V
-------
R
F
E
L
T
A
Y
A
-
L
K
P
D
I
K
V
I
A
PW
R
E
-------------
W
S
F
----
Q
G
R
K
E
M
--
I
A
Y
A
E
A
H
G
I
P
V
P
-------
P
-----------------------
Y
S
M
D
A
N
---------
L
L
H
I
S
Y
-
E
G
G
V
L
E
D
P
W
A
-
E
P
P
K
G
M
F
R
M
T
-----
Q
D
P
------
E
E
A
P
D
A
P
E
Y
V
E
V
E
-
F
F
E
G
D
P
V
A
V
N
G
E
R
L
--
S
P
A
A
L
-
L
Q
R
L
N
E
-
I
G
G
R
H
G
-
V
G
R
V
-
D
I
V
E
N
R
F
V
G
---
M
K
S
R
G
V
Y
E
T
-
P
G
G
T
I
L
Y
H
A
R
R
A
V
E
S
----
L
T
L
D
R
E
V
L
H
Q
R
D
------
M
L
S
P
K
Y
A
E
----------------------
L
V
Y
Y
G
F
W
--
Y
A
P
E
R
E
A
L
Q
A
Y
F
D
H
-
V
A
R
S
--
V
T
G
V
A
R
L
K
L
Y
K
G
-
N
V
Y
V
V
G
R
K
-
A
P
K
S
L
Y
R
----------------
G
Y
---
D
Q
K
D
A
E
G
F
I
K
I
Q
A
L
R
----
L
R
V
R
A
L
V
-
E
R
-----------------------------------------------------------------------------------------------------------------------------------
22
Fugue
57.86
11%
3
- C3 -
2IVN
2
KAE1_PYRAB
A:
[1-325]
----------------------
M
L
-----
A
L
G
-
I
E
G
T
A
-
H
T
L
G
I
-
G
I
V
--------
S
E
D
K
V
L
A
--
N
V
F
D
T
L
T
T
E
KGGIH
P
K
E
A
A
E
H
H
A
---
R
L
M
K
P
L
---------
L
-------
R
K
A
---
L
S
E
A
G
-
V
S
L
--------------------------
D
D
I
D
V
I
A
--------
F
S
Q
G
P
G
---------------
L
G
-
P
A
L
R
----
V
V
A
T
A
A
R
-----
A
L
A
V
K
Y
-------
R
K
P
I
V
G
V
N
-
H
C
I
--------
A
H
-------------
V
E
-
I
T
K
M
F
G
V
K
D
------
P
V
G
L
Y
V
S
G
--------------------------------------------------------
G
N
T
Q
V
L
A
L
E
G
G
R
Y
R
V
F
G
E
T
LDIG
I
G
N
A
----
I
D
V
F
A
R
E
L
G
L
G
F
---------
P
G
G
P
K
V
E
K
L
A
E
K
G
E
K
Y
-
I
E
L
P
Y
A
-
V
K
G
M
D
L
S
F
S
G
L
-
L
T
E
A
I
R
K
Y
R
---
S
G
K
Y
-----
R
V
E
D
L
A
Y
S
F
Q
E
T
A
F
A
A
----
L
V
E
V
T
E
R
A
V
A
H
T
------
E
K
D
----
E
----------------------
V
V
L
V
G
G
V
A
A
N
-
N
R
L
R
E
M
L
R
I
M
T
E
D
R
G
I
K
--
F
F
V
P
P
Y
D
L
C
----------
R
D
-
N
G
A
M
I
A
Y
T
G
L
R
M
Y
K
A
--
G
I
S
--
F
R
L
---
E
E
T
I
V
K
Q
K
F
R
T
D
E
V
E
----
I
V
W
H
-----------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
46.71
30%
88
- C3 -
4G0U
-
TOP2B_HUMAN
A:
[611-675]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
T
----
V
Q
D
I
L
K
E
F
F
D
L
R
------
L
S
Y
Y
G
L
R
K
----------------------
E
W
L
V
G
M
L
G
A
E
S
T
K
L
N
N
Q
A
R
F
I
L
E
K
I
Q
G
K
--
I
T
I
E
N
R
S
K
K
D
L
I
Q
M
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
46.08
30%
79
- C3 -
4G0V
-
TOP2B_HUMAN
A:
[611-675]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
T
----
V
Q
D
I
L
K
E
F
F
D
L
R
------
L
S
Y
Y
G
L
R
K
----------------------
E
W
L
V
G
M
L
G
A
E
S
T
K
L
N
N
Q
A
R
F
I
L
E
K
I
Q
G
K
--
I
T
I
E
N
R
S
K
K
D
L
I
Q
M
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
45.06
30%
75
- C3 -
4G0W
-
TOP2B_HUMAN
A:
[611-675]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
T
----
V
Q
D
I
L
K
E
F
F
D
L
R
------
L
S
Y
Y
G
L
R
K
----------------------
E
W
L
V
G
M
L
G
A
E
S
T
K
L
N
N
Q
A
R
F
I
L
E
K
I
Q
G
K
--
I
T
I
E
N
R
S
K
K
D
L
I
Q
M
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
44.96
30%
84
- C3 -
4J3N
-
TOP2B_HUMAN
A:
[611-675]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
T
----
V
Q
D
I
L
K
E
F
F
D
L
R
------
L
S
Y
Y
G
L
R
K
----------------------
E
W
L
V
G
M
L
G
A
E
S
T
K
L
N
N
Q
A
R
F
I
L
E
K
I
Q
G
K
--
I
T
I
E
N
R
S
K
K
D
L
I
Q
M
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
44.59
30%
79
- C3 -
3QX3
-
TOP2B_HUMAN
A:
[611-675]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
T
----
V
Q
D
I
L
K
E
F
F
D
L
R
------
L
S
Y
Y
G
L
R
K
----------------------
E
W
L
V
G
M
L
G
A
E
S
T
K
L
N
N
Q
A
R
F
I
L
E
K
I
Q
G
K
--
I
T
I
E
N
R
S
K
K
D
L
I
Q
M
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
35
HHSearch
44.44
14%
6
* C1 *
2I9X
2
SP5G_STAES
A:
[9-84]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
R
L
R
K
I
Q
T
D
G
-
R
M
---
K
A
L
V
S
I
-
T
L
D
--
E
A
F
V
I
H
D
L
---
R
V
I
E
G
N
S
G
L
F
V
A
M
P
S
----
K
---
R
T
P
-
D
G
E
FRD
I
A
H
P
I
---
N
S
D
---
M
R
Q
E
I
Q
-------
D
A
V
M
K
V
Y
D
--------------------------------------------------------------------------------------------
9
PsiBlast_PDB
43.33
20%
28
- C1 -
4BUG
-
?
A:
[311-452]
-------------------------------------
L
-
I
G
T
Q
W
-
H
P
E
DLVDII
R
M
E
D
K
K
E
V
I
--
P
V
T
H
N
L
T
L
R
-----
K
T
V
T
G
L
A
G
D
---
R
T
K
D
F
H
---------
F
-------
E
I
E
---
L
K
N
N
K
-
Q
E
L
-
L
S
Q
-----------------
T
V
K
T
D
K
T
N
L
E
F
K
--------
D
G
K
A
T
I
---------------
N
L
-
K
H
G
E
----
S
L
T
L
Q
G
L
-----
P
E
G
Y
S
Y
-------
L
V
K
E
T
D
S
E
-
G
Y
K
--------
V
K
-------------
V
N
S
Q
E
V
A
N
A
T
V
S
K
T
G
I
T
S
D
E
T
L
A
F
E
N
N
K
E
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
42.93
20%
9
- C1 -
2XID
-
?
A:
[577-718]
-------------------------------------
L
-
I
G
T
Q
W
-
H
P
E
D
L
V
D
I
I
R
M
E
D
K
K
---------
N
L
T
L
R
-----
K
T
V
T
G
L
A
G
D
---
R
T
K
D
F
H
---------
F
-------
E
I
E
---
L
K
N
N
K
-
Q
E
L
-
L
S
Q
-----------------
T
V
K
T
D
K
T
N
L
E
F
K
--------
D
G
K
A
T
I
---------------
N
L
-
K
H
G
E
----
S
L
T
L
Q
G
L
-----
P
E
G
Y
S
Y
-------
L
V
K
E
T
D
S
E
-
G
Y
K
--------
V
K
-------------
V
N
S
Q
E
V
A
N
A
T
V
S
K
T
G
I
T
S
D
E
T
L
A
F
E
N
N
K
E
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
41.71
20%
66
- C1 -
2XIC
-
?
A:
[577-718]
-------------------------------------
L
-
I
G
T
Q
W
-
H
P
E
DLVDII
R
M
E
D
K
K
E
V
I
--
P
V
T
H
N
L
T
L
R
-----
K
T
V
T
G
L
A
G
D
---
R
T
K
D
F
H
---------
F
-------
E
I
E
---
L
K
N
N
K
-
Q
E
L
-
L
S
Q
-----------------
T
V
K
T
D
K
T
N
L
E
F
K
--------
D
G
K
A
T
I
---------------
N
L
-
K
H
G
E
----
S
L
T
L
Q
G
L
-----
P
E
G
Y
S
Y
-------
L
V
K
E
T
D
S
E
-
G
Y
K
--------
V
K
-------------
V
N
S
Q
E
V
A
N
A
T
V
S
K
T
G
I
T
S
D
E
T
L
A
F
E
N
N
K
E
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
41.62
21%
4
- C3 -
1EWQ
-
MUTS_THEAQ
A:
[446-555]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
G
Y
-------
Y
L
-----
E
-
V
T
R
--------
P
Y
-------------
Y
E
R
V
P
K
E
Y
R
P
V
Q
T
--
L
K
D
R
Q
R
Y
T
L
P
E
M
K
E
-
K
-
E
R
E
V
Y
R
L
E
A
L
I
R
R
R
E
E
E
V
F
L
E
V
R
E
R
A
K
R
Q
A
E
A
---------
L
R
E
A
A
R
-
I
L
A
E
L
D
V
Y
A
A
L
A
E
V
A
V
R
Y
G
Y
V
-----
R
P
R
----
F
G
D
R
L
Q
I
R
A
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
41.47
21%
4
- C3 -
1FW6
-
MUTS_THEAQ
A:
[446-555]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
G
Y
-------
Y
L
-----
E
-
V
T
R
--------
P
Y
-------------
Y
E
R
V
P
K
E
Y
R
P
V
Q
T
--
L
K
D
R
Q
R
Y
T
L
P
E
M
K
E
-
K
-
E
R
E
V
Y
R
L
E
A
L
I
R
R
R
E
E
E
V
F
L
E
V
R
E
R
A
K
R
Q
A
E
A
---------
L
R
E
A
A
R
-
I
L
A
E
L
D
V
Y
A
A
L
A
E
V
A
V
R
Y
G
Y
V
-----
R
P
R
----
F
G
D
R
L
Q
I
R
A
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
40.99
21%
4
- C3 -
1NNE
-
MUTS_THEAQ
A:
[446-555]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
G
Y
-------
Y
L
-----
E
-
V
T
R
--------
P
Y
-------------
Y
E
R
V
P
K
E
Y
R
P
V
Q
T
--
L
K
D
R
Q
R
Y
T
L
P
E
M
K
E
-
K
-
E
R
E
V
Y
R
L
E
A
L
I
R
R
R
E
E
E
V
F
L
E
V
R
E
R
A
K
R
Q
A
E
A
---------
L
R
E
A
A
R
-
I
L
A
E
L
D
V
Y
A
A
L
A
E
V
A
V
R
Y
G
Y
V
-----
R
P
R
----
F
G
D
R
L
Q
I
R
A
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
38.09
26%
50
- C3 -
1YOY
-
?
A:
[33-137]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
R
L
P
E
S
-----
V
A
E
H
S
F
R
A
A
I
I
A
F
I
L
A
L
K
S
G
E
S
V
E
K
--------
A
C
-------------
K
A
A
T
A
A
L
F
H
D
L
H
E
--
A
R
-----------------
E
-----------------------
E
Q
L
S
W
M
---------
E
--
S
K
P
-
D
F
S
D
V
E
V
Y
V
S
D
A
D
K
-
L
E
L
A
F
Q
-----
G
V
E
----
Y
S
Q
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
User Run . : Multi Template Modeling Result:
(1 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
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MKKMEKKW
P
F
VFN
G
I
V
I
F
C
L
I
L
L
ILGMRWQAKKE
E
S
E
V
L
N
V
T
E
S
L
Q
K
E
SEITSF
S
E
E
E
E
A
V
L
Y
M
L
S
A
LKKN
D
L
D
M
A
L
RGCAIDE
T
A
L
Q
I
N
F
V
K
T
A
E
ELPG
M
Q
L
I
DLPAPTSD
Y
S
Y
Y
F
PL
T
S
A
E
M
T
K
A
Y
I
E
Q
F
E
E
L
S
TEIPEI
E
T
L
E
V
L
E
I
A
E
K
K
E
K
E
R
E
E
Q
L
A
E
C
L
A
A
Q
E
V
S
E
L
E
I
Y
V
K
CGEQ
S
Y
R
LG
F
T
A
V
Q
Y
EKN
W
K
I
H
SLKEG
L
L
YETDI
P
A
C
V
Q
M
E
E
M
R
E
A
K
K
T
Y
VLPNQLTGAN
Y
F
QAMPISEK
T
P
Q
R
A
V
E
Q
F
I
Y
A
IEKGD
L
T
R
A
L
A
F
ATTESSQDT
S
P
E
L
L
K
KQ
G
E
Y
A
K
E
L
K
T
M
L
Y
G
FLGTE
D
A
R
LYGK
S
E
E
Q
L
N
K
L
RGKLNPE
Y
M
V
Y
L
D
L
I
K
VIPIETEE
N
T
E
T
V
K
Q
Y
A
G
LYSYNGK
N
Y
L
T
G
Y
T
L
C
RQEDG
W
Q
I
QSLSAPALSLESG
E
V
M
RL
S
K
E
ESRK
T
S
E
Q
S
V
L
K
AEKNER
51
57.82
100%
44
- C- -
M051
-
A:
[2-466]
M
K
K
M
E
K
K
W
P
F
V
F
N
G
I
V
I
F
C
L
I
L
L
I
L
G
M
R
W
Q
A
K
K
E
E
S
E
V
L
N
V
T
E
S
L
Q
K
E
S
E
I
T
S
F
S
E
E
E
E
A
V
L
Y
M
L
S
A
L
K
K
N
D
L
D
M
A
L
R
G
C
A
I
D
E
T
A
L
Q
I
N
F
V
K
T
A
E
E
L
P
G
M
Q
L
I
D
L
P
A
P
T
S
D
Y
S
Y
Y
F
P
L
T
S
A
E
M
T
K
A
Y
I
E
Q
F
E
E
L
S
T
E
I
P
E
I
E
T
L
E
V
L
E
I
A
E
K
K
E
K
E
R
E
E
Q
L
A
E
C
L
A
A
Q
E
V
S
E
L
E
I
Y
V
K
C
G
E
Q
S
Y
R
L
G
F
T
A
V
Q
Y
E
K
N
W
K
I
H
S
L
K
E
G
L
L
Y
E
T
D
I
P
A
C
V
Q
M
E
E
M
R
E
A
K
K
T
Y
V
L
P
N
Q
L
T
G
A
N
Y
F
Q
A
M
P
I
S
E
K
T
P
Q
R
A
V
E
Q
F
I
Y
A
I
E
K
G
D
L
T
R
A
L
A
F
A
T
T
E
S
S
Q
D
T
S
P
E
L
L
K
K
Q
G
E
Y
A
K
E
L
K
T
M
L
Y
G
F
L
G
T
E
D
A
R
L
Y
G
K
S
E
E
Q
L
N
K
L
R
G
K
L
N
P
E
Y
M
V
Y
L
D
L
I
K
V
I
P
I
E
T
E
E
N
T
E
T
V
K
Q
Y
A
G
L
Y
S
Y
N
G
K
N
Y
L
T
G
Y
T
L
C
R
Q
E
D
G
W
Q
I
Q
S
L
S
A
P
A
L
S
L
E
S
G
E
V
M
R
L
S
K
E
E
S
R
K
T
S
E
Q
S
V
L
K
A
E
K
N
E
R