@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 : Rv0890c: (2016-04-26 )
MRALLAQNRLVTLCGTGGVGKTRLAIQIASASELRDGLCFVDLAPITESGIVAATAARAVGLPDQPGRSTMDSLRRFIGNRRMLMVLDNCEHLLDACAALVVELLGACPELTILATSREPIGMAGEITWRVPSMSITDEAVELFADRASRVQPGFTIANHNAAAVGEICRRLDGIPLAIEFAAARVRSMSPLEIADGLDDCFRLLAGGVRGAVQRQQTLRASIDWSHALLTETEQILFRRLAPFVGGFDLAAVRAVAAGSDLDPFSVLDQLTLLVDKSLVVADDCQGRTRYRLLETVRRYALEKLGDSGEADVHARHRDYYTALAASLNTPADNDHQRLVARAETEIDNLRAAFAWSRENGHITEALQLASSLQPIWFGRAHLREGLSWFNSILEDQRFHRLAVSTAVRARALADKAMLSTWLATSPVGATDIIAPAQQALAMAREVGDPAALVRALTACGCSSGYNAEAAAPYFAEATDLARAIDDKWTLCQILYWRGVGTCISGDPNALRAAAEECRDLADTIGDRFVSRHCSLWLSLAQMWAGNLTEALELSREITAEAEASNDVPTKVLGLYTQAQVLAYCGASAAHAIAGACIAAATELGGVYQGIGYAAMTYAALAAGDVTAALEASDAARPILRAQPDQVTMHQVLMAQLALAGGDAIAARQFANDAVDATNGWHRMVALTIRARVATARGEPELARDDAHAALACGAELHIYQGMPDAMELLAGLAGEVGSHSEGVRLLGAAAALRQQTRQVRFKIWDAGYQASVTALREAMGDEDFDRAWAEGAALSTDEAIAYAQRGRGERKRPARGWGSLTPTERDVVRLVSEGLSNKDIAKRLFVSPRTVQTHLTHVYAKLGLPSRVQLVDEAARRGSPS
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.......480.......490.......500.......510.......520.......530----........540...--..-----------------..550.......560..--.....570.......580.....------------.-----------------.-590.......600....-.-.-.610.......620.......630-.........640-.-..-....650..--.....660.......--670......--.680--.........690.......700.......710.......720.......730.......740.......750-.........760.......770--.....--------..780.......790..--.....800-........810.......820.......830.......840.......850.......860.......870.......880---------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
-----------------------------------------MRALLAQN
R
L
V
T
L
CGTGGVG
K
T
R
L
A
I
Q
IA
S
-
A
---
S
----
E
LRDG
L
C
F
V
DLAP-IT--E--S
G
------
I
V
A
A
T
A
A
RAVGL-------------------PD----Q-------P
G
R
S
T
M
D
S
L
R
---
R
F
I--G--NR
R
M
L
M
V
L
DN
C
E
H
L
L
D
A
-------
C
--
A
A
L
V
V
E
L
LGACP
E
L
T
I
L
ATSREP--I--G-M--------A----
G
E
-
I
T
W
-RV-PSMSI-
T
D
E
A
V
E
L
F
A
D
R
A
SRVQP
G
F
T
IANH
N
A
A
A
V
G
E
I
C
R
RLDGIP-----
L
A
I
E
F
A
A
A
R
V
RSMS--
P
--
L
E
-
I
AD
G
L
D
D
C
-
F
R
-
L
L
AG
G
V
R
G
A
V
Q
R
Q
Q
T
L
R
ASIDW
S
H
A
L
L
T
E
T
E
Q
I
L
F
R
R
L
A
P
F
V--G
G
--
F
D
L
A
A
V
R
A
VAAGS--DL
D
P
F
S
V
L
D
Q
L
T
L
L
VDK
S
L
V
----
V
ADDCQG
R
T
R
Y
R
L
L
------------
E
T
V
R
R
Y
A
L
E
KLGDS--GEAD
V
H
A
R
H
R
D
Y
Y
----
T
A
L
A
A
SLNTPAD
N
D
H
Q
R
L
V
A
R
--
A
E
T
E
I
D
N
L
R
A
A
F
-
A
WSRENG
H
I
T
--
E
A
L
Q
L
A
S
SLQ
P
I
WF
G
--
R
A
H
L
R
E
G
L
S
W
F
N
S
I
L
E
D
Q
--
R
F
H
R
L
A
V
S
T
A
V
R
A
R
A
L
A
D
K
A
M
L
S
T
W
LATSPVG
A
T
D
I
I
A
P
A
Q
Q
A
L
A
M
--
A
R
EVG
D
P
A
A
L
V
R
A
L
T
A
CGCSSGYNAEAAAP
Y
F
A
E
A
T
D
L
A
R
A
IDDK
W
T
L
C
Q
I
L
Y
WRGVGTCISG
D
P
N
A
L
R
A
A
A
E
E
C
R
D
L
A
D
T
I
G
D
R
F
V
S
-----
R
H
C
S
L
W
L
S
L
A
Q
M
W
A--G
N
-----------------
L
T
E
A
L
E
L
S
R
E
ITAEAEA--SNDV
P
T
K
V
L
G
L
Y
T
Q
A
Q
V
L
A
YCG
A
------------
S
-----------------
A
-
A
H
A
I
A
G
A
C
I
A
A
A
T
E
L
G
G
-
V
-
Y
-
Q
G
I
G
Y
A
A
M
T
Y
A
A
L
AAG
D
V
T
A
A
L---EASDAARPILRA-Q-P
D
-
Q
V
T
M
H
Q
V
L
M
--
A
Q
L
A
LAGG
D
A
I
A
A
R
Q
--
F
ANDAVDAT--NG----W
H
R
M
V
A
L
T
I
R
A
R
V
ATARGEPELARDD
A
H
A
A
L
ACG
A
E
L
H
I
YQGM
P
D
A
M
E
L
L
A
G
L
A
G
EVGSHS
E
G
V
R
L
L
G
A
A
---
A
A
L
R
Q
Q
T
R
Q
V
R
F
K
I
WDAGY
Q
A
S
--
V
T
A
L
R
--------
E
AMG
D
E
D
F
D
R
A
W
AEGAA--LST
D
E
A
I
--
A
Y
A
Q
RGRGERKRPARGWGSLTP
T
E
R
D
V
V
R
L
V
S
EGLS
N
K
D
I
A
K
R
LFVSP
R
T
V
Q
T
H
L
T
H
V
Y
A
KLGL
P
S
R
V
Q
L
V
D
E
A
A
RRGSPS---------
80
Fugue
71.79
17%
-40
- C3 -
4UI9
-
APC5_HUMAN
O:
[27-756]
--------------------------------------------------------
K
D
W
V
T
P
Y
K
I
A
V
L
V
L
L
-
S
---
E
----
M
S
R
T
G
---------------------------------------------------------------------
E
G
A
V
S
L
V
E
R
R
---
R
L
------
N
Q
Q
L
L
P
L
L
Q
G
P
D
I
T
V
S
K
-------
L
--
L
K
L
I
E
E
S
---
C
P
Q
-----------------
L
--------
A
----
N
S
-
V
Q
I
-
R
I
-
K
L
M
A
E
G
E
L
K
D
M
E
Q
F
F
D
D
L
S
D
S
F
S
G
T
E
P
E
V
H
K
T
S
V
V
G
L
F
L
R
H
M
I
L
A
Y
-----
S
K
L
S
F
S
Q
V
F
-
K
L
Y
T
--
A
--
L
Q
-
Q
Y
F
Q
S
D
E
N
-
K
K
-
P
L
S
Q
K
Q
A
E
F
F
L
S
Q
Q
A
S
L
L
K
N
D
E
T
K
A
L
---------------------------------------
T
P
A
S
L
Q
K
E
L
N
N
L
L
K
F
N
-----------
P
D
F
A
E
A
H
Y
L
------------
S
Y
L
N
N
L
R
V
Q
D
V
F
S
S
--
T
H
S
L
L
H
Y
F
D
R
L
I
L
----
T
G
--
A
E
S
K
S
N
G
E
E
G
Y
G
R
S
L
R
Y
--
A
A
L
N
L
A
A
L
H
C
R
F
G
H
Y
Q
Q
A
E
L
A
L
Q
--
E
A
I
R
I
A
Q
E
S
N
----
D
--
H
V
C
L
Q
H
C
L
S
W
L
Y
V
L
G
Q
K
R
--
S
D
S
Y
V
L
L
E
H
S
V
K
K
A
V
H
F
G
L
P
Y
L
A
S
L
G
I
Q
S
L
V
Q
Q
R
A
F
A
G
K
T
A
N
K
L
M
D
--
A
L
K
D
S
D
L
L
H
W
K
H
S
L
----------
S
E
L
I
D
I
S
I
A
Q
K
T
A
I
W
R
L
Y
--------------------
G
R
S
T
M
A
L
Q
Q
A
Q
M
L
L
S
M
N
S
L
E
Q
Q
N
N
T
E
-----
S
F
A
V
A
L
C
H
L
A
E
L
H
A
EQ
G
C
-----------------
F
A
A
A
S
E
V
L
K
H
L
K
E
R
F
P
---
P
N
S
Q
H
A
Q
L
W
M
L
C
D
Q
K
I
Q
F
D
R
A
M
N
------------
D
-----------------
G
-
K
Y
H
L
A
D
S
L
V
T
G
I
T
A
L
N
S
--------------------------
I
---
E
G
V
Y
R
K
A
V
V
L
Q
A
-
Q
-
N
Q
-
M
S
E
A
H
K
L
L
Q
--
K
L
L
V
H
C
Q
K
L
----------
K
N
T
E
M
V
I
--
S
V
----
L
L
S
V
A
E
L
Y
W
R
S
------
S
S
P
T
I
A
L
P
M
L
L
Q
A
L
A
L
S
K
E
Y
R
L
-
Q
Y
L
A
S
E
T
V
L
N
L
A
F
A
Q
L
I
---------
L
G
I
P
---
E
Q
A
L
S
L
L
H
M
A
I
E
P
I
L
A
D
G
------------------------
A
I
L
D
K
G
R
A
M
F
L
V
--
A
K
C
Q
V
A
S
--
A
A
S
Y
D
Q
P
K
K
A
E
A
L
E
A
A
I
E
N
L
N
E
A
K
N
Y
F
A
K
V
D
---------
C
K
E
R
I
R
D
V
V
Y
F
Q
A
R
L
Y
H
T
L
G
K
T
Q
E
R
N
R
C
A
M
L
F
R
Q
L
H
Q
E
L
P
S
VPLINHL--
63
HHSearch
62.18
18%
-58
- C8 -
4WND
18
GPSM2_HUMAN
A:
[23-341]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
D
C
R
A
G
V
S
F
F
E
A
A
V
Q
V
G
T
E
--
D
L
K
T
L
S
A
I
Y
S
Q
L
G
N
A
Y
F
Y
L
H
D
Y
A
K
A
L
E
Y
H
H
H
D
L
T
L
A
R
T
I
G
D
Q
L
G
E
-----
A
K
A
S
G
N
L
G
N
T
L
K
V
L
--
G
N
-----------------
F
D
E
A
I
V
C
C
Q
R
H
L
D
I
S
R
E
--
L
N
D
K
V
G
E
A
R
A
L
Y
N
L
G
N
V
Y
H
A
K
G
K
S
F
GCFP
E
E
V
R
D
A
L
-----------------
Q
A
A
V
D
F
Y
E
E
N
L
S
L
V
T
A
L
G
D
R
A
-
A
-
Q
G
R
A
F
G
N
L
G
N
T
H
Y
L
L
G
N
F
R
D
A
V
---
I
A
H
E
Q
R
L
L
I
A
K
E
F
G
D
K
A
-
A
E
R
R
A
Y
S
N
L
--
G
N
A
Y
I
F
L
G
E
F
E
T
A
S
E
--
Y
Y
K
K
T
L
L
L
A
--
R
Q
LKDR
A
V
E
A
Q
S
C
Y
S
L
G
N
T
Y
T
L
L
Q
D
Y
E
K
A
I
D
Y
H
L
K
H
L
A
I
A
Q
E
L
N
D
R
I
G
E
G
R
A
C
W
S
L
G
N
A
Y
T
A
L
G
N
H
D
Q
A
M
H
F
A
E
K
H
---
L
E
I
S
R
E
V
G
---------------------------------------------------------------------------------------------------------------------------------------------------
79
Fugue
58.33
17%
-53
- C4 -
5DSE
-
TTC7B_HUMAN
A:
[140-843]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
I
A
E
A
Y
A
T
K
G
L
--
C
L
E
D
--
V
I
T
C
Y
E
K
A
G
D
I
A
L
L
----
Y
L
Q
E
I
E
R
V
L
G
F
F
L
E
------------
T
G
L
Q
R
A
H
V
L
Y
F
K
N
G
--
N
L
T
R
G
V
G
R
F
R
E
L
L
----
R
A
V
----
E
T
R
T
T
Q
N
L
R
M
T
I
A
R
Q
L
A
E
I
L
L
R
G
M
C
E
Q
S
-
Y
W
N
P
L
E
D
P
F
C
PQ
E
N
T
E
E
A
L
L
L
L
L
I
S
E
S
--
M
A
N
R
S
V
V
Y
D
L
L
T
I
A
L
G
R
R
--
G
Q
Y
E
M
L
S
E
C
L
E
R
A
M
K
F
A
F
E
E
F
H
L
W
Y
Q
F
A
L
S
L
M
A
A
G
K
S
A
R
A
V
K
V
L
K
E
--
C
I
R
L
K
P
D
D
A
T
I
P
L
L
A
A
K
L
C
M
G
S
L
H
------
W
L
E
E
A
E
K
F
A
K
T
V
V
T
S
E
F
K
A
K
G
Y
L
A
L
G
L
T
Y
S
L
Q
A
T
D
A
S
L
R
G
M
Q
E
V
L
Q
R
K
A
L
L
A
F
Q
R
A
H
S
L
SPTD
H
Q
A
A
F
Y
L
A
L
Q
L
A
I
S
--
R
Q
-----------------
I
P
E
A
L
G
Y
V
R
Q
A
L
Q
L
-
Q
G
--
D
D
A
N
S
L
H
L
L
A
L
L
L
S
A
Q
-------------------
K
-----------------
H
-
Y
H
D
A
L
N
I
I
D
M
A
L
S
E
Y
P
E
-
N
-
F
-
I
L
L
-
F
S
K
V
K
L
Q
S
L
C
R
G
P
D
E
A
L
L
---
T
C
K
H
M
L
Q
I
W
K
S
C
-
Y
-
L
H
P
W
M
T
L
A
Q
I
W
L
H
A
A
E
V
Y
I
G
I
G
K
P
A
E
A
T
A
--
C
T
Q
E
A
A
N
L
F
--
P
M
----
S
H
N
V
--
L
Y
M
R
G
Q
I
A
E
L
R
G
S
M
D
E
A
R
R
W
Y
E
E
A
L
A
I
S
P
T
H
------
V
K
S
M
Q
R
L
A
L
I
L
H
Q
L
G
R
Y
S
L
A
E
K
I
L
R
D
A
---
V
Q
V
N
S
T
A
H
E
V
W
N
G
L
G
E
V
L
Q
A
Q
G
------
N
--------
D
A
A
A
T
E
C
F
L
T
A
L
E
L
E
A
S
---
S
P
A
V
P
F
--
T
I
I
P
R
V
L
-----------------------------------------------------------------------------------
61
HHSearch
57.77
17%
-94
- C6 -
3SFZ
4
APAF_MOUSE
A:
[146-464]
-----------------------------------------------
E
P
G
W
V
T
I
Y
G
M
A
G
C
G
K
S
V
L
A
A
E
A
V
R
D
H
S
L
L
E
G---
C
F
S
G
G
V
H
W
V
S
I
G
K
-
Q
D
--
K
S
G
L
L
------
M
K
L
Q
N
L
C
M
R
L
D
Q
-------------------
E
E
SFSQ
R
LPL----
N
I
E
E
A
K
D
R
L
R
---
V
L
M
--
L
RK
H
P
R
S
L
L
I
L
D
D
V
W
D
P
W
--------------
V
L
K
A
F
---
D
N
Q
C
Q
I
L
L
T
T
R
D
K
--
S
--
V
-
T
--------
D
SVM-
G
P
K
H
V
V
P
V
E
-
S
G
L
G
R
-
E
-
K
G
L
E
I
L
S
L
F
V
N
M
K
K
------
E
D
L
P
A
E
A
H
S
I
I
K
E
C
K
G
S
P
-----
L
V
V
S
L
I
G
A
L
L
R
D
F
P
--
N
R
W
A
Y
-
Y
L
R
Q
L
Q
N
K
Q
F
K
-
R
I
R
K
S
---
S
S
Y
D
Y
E
A
L
D
E
A
M
S
I
S
V
E
M
L
R
E
D
I
K
D
Y
Y
T
D
L
S
I
L
Q
--
K
D
V
K
V
P
T
K
V
L
C
V
L
W
D
L
E
-----
T
E
E
V
E
D
I
L
Q
E
F
V
N
K
S
L
L
----
F
C
N
R
N
G
K
S
F
C
Y
Y
L
H
------------
D
L
Q
V
D
F
L
T
E
K
N
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
52
HHSearch
56.97
18%
-91
- C6 -
1Z6T
1
APAF_HUMAN
A:
[146-449]
-----------------------------------------------
E
P
G
W
V
T
I
H
G
M
A
G
C
G
K
S
V
L
A
A
E
A
V
R
D
H
---
S
L
L
E
G
C
F
P
G
G
V
H
W
V
S
V
G
K
-
Q
D
K
S
G
--
L
L
------
M
K
L
Q
N
L
C
T
R
L
D
Q
-------------------
D
E
----
S
FSQRLPL
N
I
E
E
A
K
D
R
L
R
---
I
L
M
L
R
K
--
H
P
R
S
L
L
I
L
D
D
V
W
D
S
W
V
--------------
L
K
A
F
---
D
S
Q
C
Q
I
L
L
T
T
R
D
K
--
S
--
V
-
T
--------
D
SVM
G
P
K
-
Y
V
V
-
P
V
E
S
S
L
G
K
-
E
-
K
G
L
E
I
L
S
L
F
V
N
M
K
------
K
A
D
L
P
E
Q
A
H
S
I
I
K
E
C
K
G
S
P
-----
L
V
V
S
L
I
G
A
L
L
R
D
F
P
NR
W
--
E
Y
-
Y
L
K
Q
L
Q
N
K
-
Q
F
K
R
I
R
K
---
S
S
S
Y
D
Y
E
A
L
D
E
A
M
S
I
S
V
E
M
L
R
E
D
I
K
D
Y
Y
T
D
L
S
I
L
Q
KD
V
K
--
V
P
T
K
V
L
C
I
L
W
D
M
E
-----
T
E
E
V
E
D
I
L
Q
E
F
V
N
K
S
L
L
----
F
C
D
R
N
G
K
S
F
R
Y
Y
L
H
------------
D
L
Q
V
D
F
L
T
E
K
N
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
78
Fugue
54.50
14%
-50
- C2 -
5F9H
6
DDX58_HUMAN
A:
[11-692]
--------------------------------FKPR
N
Y
Q
L
E
L
A
L
P
A
M
K
G
K
N
T
I
I
C
A
P
T
G
C
G
K
T
F
V
S
L
L
I
C
E
-
H
---
H
----
L
K
K
--------
F
P
-
Q
G
--
Q
--
K
G
------
K
V
V
F
F
A
N
Q
I
P
V
Y
-------------------
E
Q
----
Q
-------
K
S
V
F
S
K
Y
F
E
R
HG
Y
R
V
T
--
G
--
I
S
G
A
T
A
E
N
V
P
V
E
Q
I
V
E
N
-------
N
--
D
I
I
I
L
T
-----
P
Q
I
L
V
N
N
L
K
K
G
T
--
I
--
P
-------------------
S
L
-
S
I
-
F
T
L
M
I
-
F
D
E
-------------------
C
H
N
-----------------------------
T
S
K
Q
H
--
P
--
Y
N
-
M
I
--
M
F
N
Y
-
L
D
-
Q
K
L
G
G
S
S
G
P
L
P
Q
V
I
G
L
T
A
S
V
G
V
G
D
A
---
K
N
T
D
E
A
L
D
Y
I
C
K
L
C
--
A
S
--
L
D
A
S
V
I
A
T
V
K
H
N
----------
L
E
E
L
E
Q
V
V
Y
K
P
Q
K
----
F
F
R
K
V
E
S
R
I
S
D
K
-----------------
F
K
Y
I
I
A
Q
L
M
R
D
--
T
E
S
L
A
K
R
I
C
K
D
L
R
EFGT
Q
K
Y
E
Q
W
I
V
T
V
Q
K
A
C
M
V
F
Q
M
P
D
--
K
D
E
E
S
R
I
C
K
A
L
F
-
L
Y
T
S
H
L
R
K
Y
N
--
D
A
L
I
I
S
E
H
----------
A
R
M
K
D
A
L
D
Y
L
K
D
F
F
S
N
V
--
R
A
A
F
D
E
I
E
Q
D
L
T
Q
R
F
E
E
K
L
Q
E
L
E
S
-
V
S
R
D
P
S
N
E
N
P
K
L
E
D
L
C
F
I
L
Q
E
--
E
Y
H
L
-------------------
N
P
E
T
I
T
I
L
F
V
K
T
R
A
L
V
D
A
L
K
N
W
I
E
G
N
P
K
L
S
F
L
K
P
G
I
L
T
G
R
D
H
N
------------------------------------------------------------------------------------------------------------------------------------------------
I
L
I
A
T
S
V
A
D
-
E
-
G
-
I
D
I
A
Q
C
N
L
V
I
L
Y
E
Y
V
G
N
V
I
K
M
I
---
Q
T
R
G
R
G
R
A
----------
R
G
S
K
C
F
L
L
T
--
S
N
A
G
V
I
E
K
E
Q
I
N
M
Y
K
E
K
M
M
N
D
S
I
L
R
L
--
Q
T
----
W
D
---
E
A
V
F
R
E
K
I
L
H
I
Q
T
H
E
K
F
I
R
D
S
Q
P
K
P
V
P
D
----------
K
E
N
K
K
L
L
C
R
K
C
K
A
L
A
C
Y
T
A
D
V
R
V
I
E
--------------------
E
C
H
Y
T
V
L
--
G
D
A
F
K
--------
E
C
F
V
S
R
P
H
P
K
P
-
K
Q
F
S
S
--
F
E
K
R
A
K
I
--
F
C
A
R
Q
N
C
S
H
------
D
W
G
I
H
V
K
Y
K
T
F
E
I
P
V
I
K
-------
I
E
S
F
V
V
E
D
I
A
T
G
V
Q
T
L
Y
S
K
W
K
D
F
H
F
E
K
I
P
F
D
P
A
E
-----------------
53
HHSearch
53.72
17%
-61
- C8 -
1HZ4
10
A:
[28-334]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
N
P
D
E
A
E
R
L
A
K
L
A
L
E
E
L
P
P
-
G
W
F
Y
S
R
I
V
A
T
S
V
L
G
E
V
L
H
C
K
G
E
L
T
R
S
L
A
L
M
Q
Q
T
E
Q
M
A
R
Q
H
D
V
W
H
Y
A
-----
L
W
S
L
I
Q
Q
S
E
I
L
F
A
Q
--
G
F
-----------------
L
Q
T
A
W
E
T
Q
E
K
A
F
Q
L
I
N
E
Q
H
L
E
Q
L
P
M
H
E
F
L
V
R
I
R
A
Q
L
L
W
A
W
A
R
------------
L
-----------------
D
E
A
E
A
S
A
R
S
G
I
E
V
L
S
S
Y
Q
P
-
Q
-
Q
-
Q
L
Q
C
L
A
M
L
I
Q
C
S
L
A
R
G
D
L
D
N
A
R
---
S
Q
L
N
R
L
E
N
L
L
G
N
G
K
Y
H
S
D
W
I
S
N
A
N
K
V
R
--
V
I
Y
W
Q
M
T
G
D
K
A
A
A
A
N
--
W
L
R
H
T
A
K
P
E
FA
N
N
----
H
F
L
Q
G
Q
W
R
N
I
A
R
A
Q
I
L
L
G
E
F
E
P
A
E
I
V
L
E
E
L
N
E
N
A
R
S
L
R
L
M
S
D
L
N
R
N
L
L
L
L
N
Q
L
Y
W
Q
A
G
R
K
S
D
A
Q
R
V
L
L
D
A
---
L
K
L
A
N
R
T
G
F
I
S
H
F
V
I
--------------------------------------------------------------------------------------------------------------------------------------------
55
HHSearch
50.74
18%
-57
- C8 -
4A1S
-
?
A:
[57-346]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
D
C
R
A
G
V
A
F
F
Q
A
A
I
Q
A
G
T
--
E
D
L
R
T
L
S
A
I
Y
S
Q
L
G
N
A
Y
F
Y
L
G
D
Y
N
K
A
M
Q
Y
H
K
H
D
L
T
L
A
K
S
M
N
D
R
L
G
E
-----
A
K
S
S
G
N
L
G
N
T
L
K
V
M
--
G
R
-----------------
F
D
E
A
A
I
C
C
E
R
H
L
T
L
A
R
Q
--
L
G
D
R
L
S
E
G
R
A
L
Y
N
L
G
N
V
Y
H
A
K
G
K
------------
H
L
G
Q
R
N
PGKFG
D
D
V
K
E
A
L
T
R
A
V
E
F
Y
Q
E
N
L
K
L
M
R
D
L
G
D
-
R
G
A
-
Q
G
R
A
C
G
N
L
G
N
T
Y
Y
L
L
G
D
F
Q
A
A
I
---
E
H
H
Q
E
R
L
R
I
A
R
E
F
G
D
R
A
-
A
E
R
R
A
N
S
N
L
--
G
N
S
H
I
F
L
G
Q
F
E
D
A
A
E
--
H
Y
K
R
T
L
A
L
A
--
V
E
L
GE
R
E
V
E
A
Q
S
C
Y
S
L
G
N
T
Y
T
L
L
H
E
F
N
T
A
I
E
Y
H
N
R
H
L
A
I
A
Q
E
L
G
D
R
I
G
E
A
R
A
C
W
S
L
G
N
A
H
S
A
I
G
G
H
E
R
A
L
K
Y
A
E
Q
H
---
L
Q
L
A
U
N
K
U
N
K
-------------------------------------------------------------------------------------------------------------------------------------------------
54
HHSearch
50.54
14%
-95
* C6 *
2QEN
2
?
A:
[30-349]
-----------------------------------------------
N
Y
P
L
T
L
L
L
G
I
R
R
V
G
K
S
S
L
L
R
A
F
L
N
E
R
---
P
----
G
I
L
I
D
C
R
E
L
Y
A
E
R
G
H
I
--
T
--
R
E
------
E
L
I
K
E
L
Q
S
T
I
S
P
F
Q
K
F
Q
S
K
F
KISLNLKFLTL
E
P
RK--
L
-------
S
L
R
E
V
F
R
E
L
N
---
D
L
G
E
-
E
--
L
G
E
F
I
V
A
F
D
E
A
Q
Y
L
R
F
Y
GSRGG
K
E
L
--
L
A
L
F
A
Y
A
Y
D
S
L
P
N
L
K
I
I
L
T
G
S
E
V
G
L
L
--
H
D
F
L
KITDYES
P
LYG
R
I
A
-
G
E
V
-
L
V
-
K
P
F
D
K
-
D
-
T
S
V
E
F
L
K
R
G
F
R
E
V
--
N
L
---
D
V
P
E
N
E
I
E
E
A
V
E
L
L
D
G
I
P
-----
G
W
L
V
V
F
G
V
E
Y
L
R
N
G
--
D
-----
F
G
R
A
M
K
R
T
-----
L
E
V
-------
A
K
G
L
I
M
G
E
L
-
E
E
L
R
R
R
S
P
R
Y
V
D
I
L
R
A
I
A
L
G
Y
------
N
R
W
S
L
I
R
D
Y
L
A
V
K
G
T
K
I
P
E
P
R
L
Y
A
L
L
E
N
L
K
K
M
N
W
I
----
V
E
E
----
D
N
T
Y
K
I
A
D-----------
P
V
V
A
T
V
L
R
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
75
Fugue
49.27
16%
-10
- C5 -
3KLO
3
?
A:
[4-220]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
E
N
K
L
N
V
R
M
--
L
------
S
D
V
C
M
Q
S
R
--
L
L
K
E
A
L
E
S
K
--
L
P
----
L
A
L
E
I
T
-----
P
F
S
E
L
W
L
E
E
N
K
P
E
S
R
S
I
Q
M
L
V
I
D
Y
S
R
I
S
D
D
V
L
T
D
Y
S
S
F
K
H
I
S
C
P
D
A
K
E
V
I
I
N
C
P
Q
D
I
E
H
---
K
L
L
F
K
W
N
N
L
A
G
V
F
Y
I
D
D
D
M
D
T
L
--
I
K
G
M
S
--------
K
I
L
Q
D
E
M
W
L
T
R
K
L
A
Q
E
Y
--
I
L
H
Y
R
----------
A
G
N
S
V
V
T
S
Q
M
Y
A
K
L
T
K
R
E
Q
Q
I
I
K
L
L
G
S
G
A
S
N
I
E
I
A
D
K
L
F
V
S
E
N
T
V
K
T
H
L
H
N
V
F
K
K
I
N
A
K
N
R
L
Q
A
L
I
W
A
K
N
N
I
G
I
----------
28
PsiBlast_CBE
48.38
40%
60
- C7 -
1FSE
2
GERE_BACSU
C:
[12-70]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
T
K
R
E
R
E
V
F
E
L
L
V
Q
D
K
T
T
K
E
I
A
S
E
L
F
I
S
E
K
T
V
R
N
H
I
S
N
A
M
Q
K
L
G
V
K
G
R
S
Q
A
V
V
E
L
L
R
M
G
------------
68
HHSearch
47.31
15%
-59
- C8 -
4A1S
-
?
A:
[95-347]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
D
Y
N
K
A
M
Q
Y
H
K
H
D
L
T
L
A
K
S
M
N
D
R
L
G
E
A
K
S
S
G
N
L
G
N
T
L
K
V
M
G
R
F
D
E
A
A
I
C
C
E
R
H
L
T
L
A
R
Q
L
G
D
R
L
S
E
-----
G
R
A
L
Y
N
L
G
N
V
Y
H
A
K
--
G
K
H
L
G
Q
R
N
PGKFG
D
D
V
K
E
A
L
T
R
A
V
E
F
Y
Q
E
N
L
K
L
M
R
D
--
L
G
D
R
G
A
Q
G
R
A
C
G
N
L
G
N
T
Y
Y
L
L
G
D
------------
F
-----------------
Q
A
A
I
E
H
H
Q
E
R
L
R
I
A
R
E
F
G
D
-
R
-
A
A
E
R
R
A
N
S
N
L
G
N
S
H
I
F
L
G
Q
F
E
D
A
A
---
E
H
Y
K
R
T
L
A
L
A
V
E
L
G
E
R
E
-
V
E
A
Q
S
C
Y
S
L
--
G
N
T
Y
T
L
L
H
E
F
N
T
A
I
E
--
Y
H
N
R
H
L
A
I
A
--
Q
E
L
GD
R
I
G
E
A
R
A
C
W
S
L
G
N
A
H
S
A
I
G
G
H
E
R
A
L
K
Y
A
E
Q
H
L
Q
L
A
U
N
K
U
N
K
U
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
46.24
31%
-3
- C7 -
1A04
-
NARL_ECOLI
A:
[64-205]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
M
N
G
L
E
T
L
---
D
K
L
R
E
K
S
L
S
G
R
I
V
V
F
S
V
S
N
H
E
E
D
V
V
T
A
L
K
R
GAD
G
Y
L
L
K
D
M
E
P
E
D
L
L
K
A
L
H
Q
A
A
A
G
E
M
V
L
S
E
A
L
T
P
V
L
A
A
S
L
-------
E
R
D
V
N
Q
L
T
P
R
E
R
D
I
L
K
L
I
A
Q
G
L
P
N
K
M
I
A
R
R
L
D
I
T
E
S
T
V
K
V
H
V
K
H
M
L
K
K
M
K
L
K
S
R
V
E
---------------------
71
Fugue
46.04
37%
55
- C7 -
1A04
-
NARL_ECOLI
A:
[150-216]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
R
D
V
N
Q
L
T
P
R
E
R
D
I
L
K
L
I
A
Q
G
L
P
N
K
M
I
A
R
R
L
D
I
T
E
S
T
V
K
V
H
V
K
H
M
L
K
K
M
K
L
K
S
R
V
E
A
A
V
W
V
H
Q
E
R
I
F
----------
29
PsiBlast_CBE
45.93
40%
62
- C7 -
1FSE
2
GERE_BACSU
B:
[12-70]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
T
K
R
E
R
E
V
F
E
L
L
V
Q
D
K
T
T
K
E
I
A
S
E
L
F
I
S
E
K
T
V
R
N
H
I
S
N
A
M
Q
K
L
G
V
K
G
R
S
Q
A
V
V
E
L
L
R
M
G
------------
33
PsiBlast_CBE
45.65
37%
64
- C7 -
4WSZ
2
?
B:
[7-65]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
T
N
R
E
H
E
I
L
M
L
I
A
Q
G
K
S
N
Q
E
I
A
D
E
L
F
I
T
L
K
T
V
K
T
H
V
S
N
I
L
A
K
L
D
V
D
D
R
T
Q
A
A
I
Y
A
F
Q
H
G
------------
9
PsiBlast_PDB
45.62
40%
60
- C7 -
1FSE
-
GERE_BACSU
A:
[12-70]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
T
K
R
E
R
E
V
F
E
L
L
V
Q
D
K
T
T
K
E
I
A
S
E
L
F
I
S
E
K
T
V
R
N
H
I
S
N
A
M
Q
K
L
G
V
K
G
R
S
Q
A
V
V
E
L
L
R
M
G
------------
32
PsiBlast_CBE
45.07
37%
56
- C7 -
4WT0
1
?
A:
[7-65]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
T
N
R
E
H
E
I
L
M
L
I
A
Q
G
K
S
N
Q
E
I
A
D
E
L
F
I
T
L
K
T
V
K
T
H
V
S
N
I
L
A
K
L
D
V
D
N
R
T
Q
A
A
I
Y
A
F
Q
H
G
------------
72
Fugue
45.06
36%
61
- C7 -
1FSE
-
GERE_BACSU
A:
[8-74]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
K
P
L
L
T
K
R
E
R
E
V
F
E
L
L
V
Q
D
K
T
T
K
E
I
A
S
E
L
F
I
S
E
K
T
V
R
N
H
I
S
N
A
M
Q
K
L
G
V
K
G
R
S
Q
A
V
V
E
L
L
R
M
G
E
L
E
L--------
77
Fugue
44.72
8%
-57
- C1 -
3GB8
-
XPO1_HUMAN
A:
[53-1061]
LKEHPRVD
T
I
L
E
F
S
QNMNT
K
Y
Y
G
L
Q
I
L
E
N
V
I
K
T
RWR
N
Q
C
E
G
I
K
K
Y
V
V
G
L
I
I
K
T
S
S
E
K
E
K
V
Y
I
G
K
L
N
M
I
L
V
Q
-
I
---
L
----
K
Q
E
W
P
K
H
W
P
T
F
I
S
-
D
I
--
V
--
G
A
S
R
T
S
E
S
L
C
Q
N
N
M
V
I
L
K
L
L
-------------------
S
E
----
E
-------
V
F
T
Q
V
K
S
K
H
L
---
K
D
S
--
M
--
C
N
E
F
S
Q
I
F
Q
L
C
Q
F
V
M
E
N
-------
S
QN
A
P
L
V
H
A
T
L
E
T
L
L
R
F
L
N
W
I
P
L
G
Y
I
--
F
ET
K
-
L
--------
I
----
S
T
-
L
I
Y
-
K
F
-
L
N
V
P
M
-
F
R
N
V
S
L
K
C
L
T
E
I
A
G
V
S
V
S
-
Q
Y
E
E
Q
F
V
T
L
F
T
L
T
M
M
Q
L
K
Q
M
L
PLNTN
I
R
L
A
Y
S
N
G
K
D
D
E
Q
N
--
F
--
I
Q
N
L
S
L
F
L
C
T
F
-
L
K
-
E
H
D
Q
L
I
E
K
R
L
N
L
R
E
T
L
M
E
A
L
H
Y
M
L
L
V
S
E
V
E
E
T
E
I
F
K
I
C
L
E
Y
W
--
N
H
--
L
A
A
E
L
Y
R
E
S
P
F
S
V
--
P
P
R
R
Q
L
Y
L
P
M
L
F
K
V
R
L
L
M
V
S
R
MAK
P
E
E
D
T
D
S
I
N
L
Y
K
N
M
R
E
T
L
V
Y
L
T
H
L
D
Y
V
D
T
E
R
I
M
T
E
K
L
H
N
Q
V
N
G
T
E
W
S
W
K
N
L
N
T
L
C
----
W
A
I
G
S
I
S
G
A
M
H
E
E
D
E
K
R
F
L
V
T
--
V
I
K
D
L
L
G
L
C
E
Q
K
-
R
G
K
D
N
K
A
I
I
A
--
S
N
I
M
Y
I
V
G
Q
Y
P
R
F
L
R
A
H
W
K
F
L
K
T
V
V
N
K
L
F
E
F
M
H
E
T
HD
G
V
Q
D
M
A
C
D
T
F
I
K
I
A
Q
K
C
R
R
H
F
V
Q
V
Q
V
G
E
V
M
P
F
I
D
E
I
L
N
N
I
N
T
I
I
C
D
LQ
P
Q
Q
V
H
T
F
Y
E
A
V
G
Y
M
I
G
A
Q
T
D
Q
T
V
Q
E
H
L
I
E
K
Y
M
L
L
P
N
Q
V
W
D
S
I
I
Q
Q
A
T
K
N
V
D
I
L
K
D
------
P
E
T
V
K
Q
L
G
S
I
L
K
T
N
V
R
A
C
K
A
V
G
H
P
F
V
I
-----
Q
L
G
R
I
Y
L
D
M
L
N
V
Y
K
--
C
L
-----------------
S
E
N
I
S
A
A
I
Q
A
N
G
E
M
V
T
K
--
Q
-----------
P
L
I
R
S
M
R
T
V
K
R
------------
E
-----------------
T
-
L
K
L
I
S
-
G
W
V
S
R
S
N
D
P
Q
M
-
V
-
A
-
E
N
F
V
P
P
L
L
D
A
V
L
I
D
Y
Q
R
N
V
P
A
A
RE
P
E
V
L
S
T
M
A
I
I
V
N
K
-
L
-
G
G
-
H
I
T
A
E
I
P
Q
I
--
F
D
A
V
F
E
C
T
L
N
M
I
N
K
D
--
F
-
E
E
Y
P
E
H
R
--
T
N
----
F
F
L
L
L
Q
A
V
N
S
H
C
F
P
A
F
L
A
I
P
P
T
Q
F
K
L
V
L
D
S
I
I
W
A
F
K
H
T
M
R
N
V
A
D
T
G
L
Q
I
L
F
T
L
L
Q
N
V
A
Q
E
E
A
A
A
Q
S
F
Y
Q
T
Y
F
C
D
I
L
Q
H
I
F
S
V
V
T
D
T
S
H
T
A
G
L
T
M
H
--
A
S
I
L
A
--------
Y
M
F
N
L
V
E
E
G
K
I
S
T
S
L
N
P
--
G
N
P
V
N
N
Q
--
I
F
L
Q
E
Y
V
A
N
L
L
K
S
A
F
P
H
L
Q
D
A
Q
V
K
L
F
V
T
G
L
F
S
L
N
Q
D
I
P
A
F
K
E
H
L
R
D
F
L
V
Q
I
K
E
F
A
G
E
D
T
S
D
L
F
L
E
E
R
E
I
A
L
R
Q
A
D
E
E
K
H
K
R
Q
M
S
VPGIFN