@TOME V2.3
(Mar 2018)
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 : I3U173: (2017-12-19 )
MNPLLIVGTRQWKGVHSVMAYKYLVIVESPAKAKTIEKYLGRNYKVMASVGHIRDLPKSKMGIDFENNYEPHYISIRGKGDVIKSLKAAAKKAQKVYLASDPDREGEAIAWHLAYLLGLDLKEKNRVVFNEITKDAVKAAFKEPRTIDVDLVDAQQARRTLDRIVGYSISPILWRKVKKGLSAGRVQSVALKIIIDREKEIREFVPEEYWSIDGNFKKARKKFKANFWGIDGKKKKLPDAQSVKEVTARIDGTDFEVKKVEKKERKRNPANPFTTSSLQQEAARKLNFRTRKTMMVAQQLYEGITLGKQGTVGLITYMRTDSTRIADTAKAEAAAFIEDTYGKEFSRHDHRKIKNAQGAQDAHEAVRPTSVLRTPDELKQYLDKDQLKLYTLIWSRFVASQMTPAILDTMKVTLEQNGVIFIANGSKIKFKGFMQVYVEGRDDGKEEKENILPELEEGDVVQSVDIEPKQHFTQPPARFSEATLIRALEENGVGRPSTYAPTLDTIQRRYYVKLTQKRFEPTELGEIVNSLICEFFPQIVDIHFTAEMEGDLDKIEEGTEAWVKVVDRFYKPFEKELTNAEEKIEKIQIKDEPAGFDCDVCGHPMVIKLGKYGKFYACSNFPDCRNTKPIVKEIGVTCPVCHEGQVIERKSKKNRLFYGCSRFPECEFTSWDKPVGRNCPKCDGYLVEKKVKGGKQVVCVNGDYEEDIQK
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
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MN
P
L
L
I
V
GTRQW
K
G
V
H
S
V
M
A
Y
K
Y
L
V
I
VESPAK
A
K
T
I
E
K
Y
LGRN
Y
K
V
M
A
SVG
H
I
RDLP
K
S
--------------K--------------M---------GIDFENNYEP
H
Y
I
S
I
RGK
G
D
V
I
K
S
L
K
A
A
A
K
KA
Q
K
V
Y
LASDPDREG
E
A
I
A
W
H
L
A
Y
L
LGLDLKEKNR
V
V
F
N
E
I
T
K
D
A
V
K
A
A
FKEP
R
T
I
D
V
DLV
D
A
Q
Q
A
R
R
T
L
D
R
I
VGYSI
S
P
I
L
W
R
K
V
K
KGLSAGR
V
Q
S
V
A
L
K
I
I
IDR
E
K
E
I
R
E
FV
P
E
E
YWSIDG
N
F
-------
K
K
A
R
-------
K
-
K
FKANFWGIDG------------------KKKK------------------LP-
D
A
Q
S
V
K
E
V
T
A
RIDGTD
F
E
V
K
K
V
E
K
K
E
RKRNPANPF
T
T
S
S
L
Q
Q
E
A
A
R
KLNF
R
T
R
K
T
M
M
V
A
Q
Q
L
Y
E
GITLGKQG
T
V
G
L
I
T
Y
M
RTDSTRIADTA
K
A
E
A
A
A
F
I
E
D
TYGKEF----S
R
H
D
H
R
K
IKN-AQG
A
Q
D
A
H
E
AVRP
T
S
-VLR-
T
P
D
E
L
K
---
Q
Y
L
D
K
---
D
Q
L
K
L
Y
T
L
I
W
S
R
F
V
A
S
QM
T
P
A
I
L
D
T
M
K
V
T
LEQ----N
G
------
V
I
F
I
ANG
S
K
I
--
K
--
F
K
G
F
M
Q
V
Y
V
EGRDD--G----
K
E
--
E
K
E
N
ILPELEEG
D
V
V
Q
SVDIE
P
K
Q
HFTQPPAR
F
S
E
A
T
L
I
R
A
L
E
ENGVGRPSTYAP
T
L
D
T
I
Q
R
R
Y
Y
V
K
L
T
Q
KRF
E
P
T
E
L
G
E
I
V
N
S
L
I
C
E
F
F
P
Q
I
V
D
I
H
F
T
AEMEG
D
L
D
K
I
E
E
G
T
E
A
W
V
K
V
V
D
R
F
Y
------
K
P
F
E
K
E
L
T
N
A
E
E
K
I
E
K
---
I
----------
Q
IKDEP---AGFDC----------DVCGH
P
M
V
I
K
LGKYG
K
F
Y
A
CSNFP-----DCRNT
K
P
I
V
K
EIGVTCPVCHEG
Q
V
I
E
R
KSKKN
R
L
F
YGCSRFPECEFTSWDK---------PVGRNCPKCD
G
Y
L
V
E
K
---KVKG--G
K
Q
V
V
C
VNG
D
Y
E
E
D
IQK
3
PsiBlast_PDB
74.52
44%
-21
- C2 -
-
2GAJ
-
TOP1_THEMA
A:
[7-586]
----------------------
K
Y
I
V
V
E
S
P
A
K
A
K
T
I
K
S
I
L
G
N
E
Y
E
V
F
A
S
M
G
H
I
I
D
L
P
K
S
--------------
K
--------------
F
---------
G
V
D
L
E
K
D
F
E
P
E
F
A
V
I
K
G
K
E
K
V
V
E
K
L
K
D
L
A
K
K
G
E
-
L
L
I
A
S
D
M
D
R
E
G
E
A
I
A
W
H
I
A
R
V
T
N
T
-
L
G
R
K
N
R
I
V
F
S
E
I
T
P
R
V
I
R
E
A
V
K
N
P
R
E
I
D
M
K
K
V
R
A
Q
L
A
R
R
I
L
D
R
I
V
G
Y
S
L
S
P
V
L
W
R
N
F
K
S
N
L
S
A
G
R
V
Q
S
A
T
L
K
L
V
C
D
R
E
R
E
I
L
R
F
V
P
K
K
Y
H
R
I
T
V
N
F
-------
D
G
L
T
-------
A
-
E
-------
I
D
V
------------------
K
E
K
K
------------------
F
F
-
D
A
E
T
L
K
E
I
Q
S
-
I
D
E
L
V
V
E
E
K
K
V
S
V
K
--
K
F
A
P
P
E
P
F
K
T
S
T
L
Q
Q
E
A
Y
S
K
L
G
F
S
V
S
K
T
M
M
I
A
Q
Q
L
Y
E
G
V
E
T
-
K
D
G
H
I
A
F
I
T
Y
M
R
T
D
S
T
R
V
S
D
Y
A
K
E
E
A
R
N
L
I
T
E
V
F
G
E
E
Y
----
V
G
---------------
A
H
E
A
I
R
P
T
N
-
V
F
M
-
T
P
E
E
A
G
---
K
Y
L
N
S
---
D
Q
K
K
L
Y
E
L
I
W
K
R
F
L
A
S
Q
M
K
P
S
Q
Y
E
E
T
R
F
V
L
R
T
----
K
D
------
G
K
Y
R
F
K
G
T
V
L
--
K
K
I
F
D
G
Y
E
K
V
W
K
T
E
R
N
T
--
G
----
E
--------
F
P
-
F
E
E
G
E
S
V
K
P
V
V
V
K
I
E
E
Q
E
T
K
P
K
P
R
Y
T
E
G
S
L
V
K
E
M
E
R
L
G
I
G
R
P
S
T
Y
A
S
T
I
K
L
L
L
N
R
G
Y
I
K
K
I
R
G
Y
L
Y
P
T
I
V
G
S
V
V
M
D
Y
L
E
K
K
Y
S
D
V
V
S
V
S
F
T
A
E
M
E
K
D
L
D
E
V
E
Q
G
K
K
T
D
K
I
V
L
R
E
F
Y
------
E
S
F
----
S
S
V
F
D
R
N
D
R
---
I
----------
V
V
-
D
F
P
---
T
N
Q
K
C
----------
S
-
C
G
K
E
M
R
L
S
F
G
K
Y
G
F
Y
L
K
C
---------
E
C
G
K
T
R
S
V
----------------------------------------------------------------------------------------------
1
PsiBlast_PDB
73.32
39%
62
- C2 -
-
4RUL
1
TOP1_ECOLI
A:
[4-728]
--------------------
G
K
A
L
V
I
V
E
S
P
A
K
A
K
T
I
N
K
Y
L
G
S
D
Y
V
V
K
S
S
V
G
H
I
R
D
L
P
T
-K
D
E
R
G
A
L
V
N
-----
R
--------------
M
---------
G
V
D
P
W
H
N
W
E
A
H
Y
E
V
L
P
G
K
E
K
V
V
S
E
L
K
Q
L
A
E
K
A
D
H
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
G
D
D
A
R
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
K
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
K
K
I
A
R
G
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
-------
T
T
P
S
-------
G
-
E
A
L
A
L
Q
V
T
H
Q
N
------------------
D
K
P
F
------------------
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
A
---------
G
Y
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
K
Y
----
L
P
E
S
P
N
Q
Y
A
S
-
K
---
Q
E
A
H
E
A
I
R
P
S
D
-
V
N
V
-
M
A
E
S
L
K
---
D
-
M
E
A
---
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
----
G
D
------
F
R
L
K
A
R
G
R
I
L
--
R
--
F
D
G
W
T
K
V
M
P
A
L
R
---------
K
G
--
D
E
D
R
I
L
P
A
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
R
E
L
M
N
Y
D
F
T
A
Q
M
E
N
S
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
------
S
D
F
T
Q
Q
L
D
K
A
E
K
D
P
E
E
---
G
----------
G
M
R
P
N
Q
M
V
L
T
S
I
D
C
----------
P
T
C
G
R
K
M
G
I
R
T
A
S
T
G
V
F
L
G
C
S
G
Y
A
LPPKE
R
C
K
T
T
I
N
L
V
P
E
N
E
V
L
-------
N
V
L
E
G
E
D
A
E
T
N
A
L
R
A
K
R
R
C
P
K
C
G
-
T
A
M
D
S
Y
L
IDPK
R
K
L
H
V
C
G
N
N
P
T
C
D
G
Y
E
I
E
E
G
E
F
R
I
K
G
YD
G
P
I
V
E
C
-----------
21
HHSearch
73.10
42%
-18
- C2 -
-
2GAJ
-
TOP1_THEMA
A:
[7-601]
----------------------
K
Y
I
V
V
E
S
P
A
K
A
K
T
I
K
S
I
L
G
N
E
Y
E
V
F
A
S
M
G
H
I
I
D
L
P
K
S
--------------
K
--------------
F
---------
G
V
D
L
E
K
D
F
E
P
E
F
A
V
I
K
G
K
E
K
V
V
E
K
L
K
D
L
A
K
K
-
G
E
L
L
I
A
S
D
M
D
R
E
G
E
A
I
A
W
H
I
A
R
V
T
N
T
L
-
G
R
K
N
R
I
V
F
S
E
I
T
P
R
V
I
R
E
A
V
K
N
P
R
E
I
D
M
K
K
V
R
A
Q
L
A
R
R
I
L
D
R
I
V
G
Y
S
L
S
P
V
L
W
R
N
F
K
S
N
L
S
A
G
R
V
Q
S
A
T
L
K
L
V
C
D
R
E
R
E
I
L
R
F
V
P
K
K
Y
H
R
I
T
V
N
F
-------
D
G
L
T
-------
A
-
E
I
D
V
K
-------------------------
E
K
K
------------------
F
F
-
D
A
E
T
L
K
E
I
Q
S
I
---
D
E
L
V
V
E
E
K
K
V
S
V
K
K
F
A
P
P
E
P
F
K
T
S
T
L
Q
Q
E
A
Y
S
K
L
G
F
S
V
S
K
T
M
M
I
A
Q
Q
L
Y
E
G
V
E
T
K
-
D
G
H
I
A
F
I
T
Y
M
R
T
D
S
T
R
V
S
D
Y
A
K
E
E
A
R
N
L
I
T
E
V
F
G
E
E
Y
----
V
G
---------------
A
H
E
A
I
R
P
T
N
-
V
F
M
-
T
P
E
E
A
G
---
K
Y
L
N
S
---
D
Q
K
K
L
Y
E
L
I
W
K
R
F
L
A
S
Q
M
K
P
S
Q
Y
E
E
T
R
F
V
L
R
T
----
K
D
------
G
K
Y
R
F
K
G
T
V
L
K
K
I
--
F
D
G
Y
E
K
V
W
K
T
E
R
---------------
N
T
G
E
F
P
F
E
E
G
E
S
V
K
P
V
V
V
K
I
E
E
Q
E
T
K
P
K
P
R
Y
T
E
G
S
L
V
K
E
M
E
R
L
G
I
G
R
P
S
T
Y
A
S
T
I
K
L
L
L
N
R
G
Y
I
K
K
I
R
G
Y
L
Y
P
T
I
V
G
S
V
V
M
D
Y
L
E
K
K
Y
S
D
V
V
S
V
S
F
T
A
E
M
E
K
D
L
D
E
V
E
Q
G
K
K
T
D
K
I
V
L
R
E
F
Y
------
E
S
F
S
S
V
F
D
R
N
D
R
I
V
V
-----------------
D
F
P
T
---
N
Q
-
K
C
----------
S
-
C
G
K
E
M
R
L
S
F
G
K
Y
G
F
Y
L
K
C
E
---------
C
G
K
T
R
S
V
K
N
D
----------
E
I
-
A
V
--
I
D
D
G
K
I
F
L
------------------------------------------------------------------
2
PsiBlast_PDB
71.81
44%
-22
- C- -
-
2GAI
-
TOP1_THEMA
A:
[7-586]
----------------------
K
Y
I
V
V
E
S
P
A
K
A
K
T
I
K
S
I
L
G
N
E
Y
E
V
F
A
S
M
G
H
I
I
D
L
P
K
S
--------------
K
--------------
F
---------
G
V
D
L
E
K
D
F
E
P
E
F
A
V
I
K
G
K
E
K
V
V
E
K
L
K
D
L
A
K
K
G
E
-
L
L
I
A
S
D
M
D
R
E
G
E
A
I
A
W
H
I
A
R
V
T
N
T
-
L
G
R
K
N
R
I
V
F
S
E
I
T
P
R
V
I
R
E
A
V
K
N
P
R
E
I
D
M
K
K
V
R
A
Q
L
A
R
R
I
L
D
R
I
V
G
Y
S
L
S
P
V
L
W
R
N
F
K
S
N
L
S
A
G
R
V
Q
S
A
T
L
K
L
V
C
D
R
E
R
E
I
L
R
F
V
P
K
K
Y
H
R
I
T
V
N
F
-------
D
G
L
T
-------
A
-
E
-------
I
D
V
------------------
K
E
K
K
------------------
F
F
-
D
A
E
T
L
K
E
I
Q
S
-
I
D
E
L
V
V
E
E
K
K
V
S
V
K
--
K
F
A
P
P
E
P
F
K
T
S
T
L
Q
Q
E
A
Y
S
K
L
G
F
S
V
S
K
T
M
M
I
A
Q
Q
L
Y
E
G
V
E
T
-
K
D
G
H
I
A
F
I
T
Y
M
R
T
D
S
T
R
V
S
D
Y
A
K
E
E
A
R
N
L
I
T
E
V
F
G
E
E
Y
----
V
G
---------------
A
H
E
A
I
R
P
T
N
-
V
F
M
-
T
P
E
E
A
G
---
K
Y
L
N
S
---
D
Q
K
K
L
Y
E
L
I
W
K
R
F
L
A
S
Q
M
K
P
S
Q
Y
E
E
T
R
F
V
L
R
T
----
K
D
------
G
K
Y
R
F
K
G
T
V
L
--
K
K
I
F
D
G
Y
E
K
V
W
K
T
E
R
N
T
--
G
----
E
--------
F
P
-
F
E
E
G
E
S
V
K
P
V
V
V
K
I
E
E
Q
E
T
K
P
K
P
R
Y
T
E
G
S
L
V
K
E
M
E
R
L
G
I
G
R
P
S
T
Y
A
S
T
I
K
L
L
L
N
R
G
Y
I
K
K
I
R
G
Y
L
Y
P
T
I
V
G
S
V
V
M
D
Y
L
E
K
K
Y
S
D
V
V
S
V
S
F
T
A
E
M
E
K
D
L
D
E
V
E
Q
G
K
K
T
D
K
I
V
L
R
E
F
Y
------
E
S
F
----
S
S
V
F
D
R
N
D
R
---
I
----------
V
V
-
D
F
P
---
T
N
Q
K
C
----------
S
-
C
G
K
E
M
R
L
S
F
G
K
Y
G
F
Y
L
K
C
---------
E
C
G
K
T
R
S
V
----------------------------------------------------------------------------------------------
43
Fugue
71.65
43%
-19
- C- -
-
2GAI
-
TOP1_THEMA
A:
[7-601]
----------------------
K
Y
I
V
V
E
S
P
A
K
A
K
T
I
K
S
I
L
G
N
E
Y
E
V
F
A
S
M
G
H
I
I
D
L
P
K
S
--------------
K
--------------
F
---------
G
V
D
L
E
K
D
F
E
P
E
F
A
V
I
K
G
K
E
K
V
V
E
K
L
K
D
L
A
K
K
G
-
E
L
L
I
A
S
D
M
D
R
E
G
E
A
I
A
W
H
I
A
R
V
T
N
T
L
-
G
R
K
N
R
I
V
F
S
E
I
T
P
R
V
I
R
E
A
V
K
N
P
R
E
I
D
M
K
K
V
R
A
Q
L
A
R
R
I
L
D
R
I
V
G
Y
S
L
S
P
V
L
W
R
N
F
K
S
N
L
S
A
G
R
V
Q
S
A
T
L
K
L
V
C
D
R
E
R
E
I
L
R
F
V
P
K
K
Y
H
R
I
T
V
N
F
-------
D
---------------
G
L
T
A
E
I
D
V
------------------
K
E
K
K
------------------
F
F
-
D
A
E
T
L
K
E
I
Q
---
S
I
D
E
L
V
V
E
E
K
K
V
S
V
K
K
F
A
P
P
E
P
F
K
T
S
T
L
Q
Q
E
A
Y
S
K
L
G
F
S
V
S
K
T
M
M
I
A
Q
Q
L
Y
E
G
V
E
T
K
D
-
G
H
I
A
F
I
T
Y
M
R
T
D
S
T
R
V
S
D
Y
A
K
E
E
A
R
N
L
I
T
E
V
F
G
E
E
Y
-------------------
V
G
A
H
E
A
I
R
P
T
N
-
V
F
M
-
T
P
E
E
A
G
---
K
Y
L
N
S
---
D
Q
K
K
L
Y
E
L
I
W
K
R
F
L
A
S
Q
M
K
P
S
Q
Y
E
E
T
R
F
V
L
R
T
----
K
D
GK----
Y
R
F
K
G
T
V
L
K
K
--
I
--
F
D
G
Y
E
K
V
W
K
T
E
R
N
T
--
G
-------------
E
F
P
F
E
E
G
E
S
V
K
P
V
V
V
K
I
E
E
Q
E
T
K
P
K
P
R
Y
T
E
G
S
L
V
K
E
M
E
R
L
G
I
G
R
P
S
T
Y
A
S
T
I
K
L
L
L
N
R
G
Y
I
K
K
I
R
G
Y
L
Y
P
T
I
V
G
S
V
V
M
D
Y
L
E
K
K
Y
S
D
V
V
S
V
S
F
T
A
E
M
E
K
D
L
D
E
V
E
Q
G
K
K
T
D
K
I
V
L
R
E
F
Y
------
E
S
F
S
S
V
F
D
R
N
D
R
I
V
V
D
---
F
----------
P
T
N
Q
K
C
---
S
----------------
C
G
K
E
M
R
L
S
F
G
K
Y
G
F
Y
L
K
C
---------
E
C
G
K
T
R
S
V
K
N
D
---
E
I
A
V
I
D
D
G
K
I
F
L
----------------------------------------------------------------------------
23
HHSearch
71.06
40%
40
- C2 -
-
5D5H
2
TOP1_MYCTU
A:
[19-673]
--------------------
G
R
R
L
V
I
V
E
S
P
T
K
A
R
K
L
A
S
Y
L
G
S
G
Y
I
V
E
S
S
R
G
H
I
R
D
L
P
R
A
--------------
A
SDVPAKYKSQPWAR
L
---------
G
V
N
V
D
A
D
F
E
P
L
Y
I
I
S
P
E
K
R
S
T
V
S
E
L
R
G
L
L
K
D
V
D
E
L
Y
L
A
T
D
G
D
R
E
G
E
A
I
A
W
H
L
L
E
T
L
K
P
R
-
I
P
V
K
R
M
V
F
H
E
I
T
E
P
A
I
R
A
A
A
E
H
P
R
D
L
D
I
D
L
V
D
A
Q
E
T
R
R
I
L
D
R
L
Y
G
Y
E
V
S
P
V
L
W
K
K
V
A
P
K
L
S
A
G
R
V
Q
S
V
A
T
R
I
I
V
A
R
E
R
D
R
M
A
F
R
S
A
A
Y
W
D
I
L
A
K
L
-------
D
A
S
V
SDPDAAP
P
-
T
F
S
A
R
L
T
A
V
A
G
RRVATGRDFDSLGTLRKG
D
E
V
I
------------------
V
L
-
D
E
G
S
A
T
A
L
A
A
G
L
D
G
T
Q
L
T
V
A
S
A
E
E
K
P
Y
A
R
R
P
Y
P
P
F
M
T
S
T
L
Q
Q
E
A
S
R
K
L
R
F
S
A
E
R
T
M
S
I
A
Q
R
L
Y
E
---------
N
G
Y
I
T
Y
M
R
T
D
S
T
T
L
S
E
S
A
I
N
A
A
R
T
Q
A
R
Q
L
Y
G
D
E
Y
----
V
A
P
A
P
R
Q
Y
T
R
K
V
K
N
A
Q
E
A
H
E
A
I
R
P
A
G
-
E
T
F
A
T
P
D
A
V
R
R
E
L
D
G
P
N
I
---
D
D
F
R
L
Y
E
L
I
W
Q
R
T
V
A
S
Q
M
A
D
A
R
G
M
T
L
S
L
R
I
T
G
M
SGH
Q
E
------
V
V
F
S
A
T
G
R
T
L
--
T
--
F
P
G
F
L
K
A
Y
V
E
T
V
D
E
--
L
V
G
G
E
A
D
--
D
A
E
R
R
L
P
H
L
T
P
G
Q
R
L
D
I
V
E
L
T
P
D
G
H
A
T
N
P
P
A
R
Y
T
E
A
S
L
V
K
A
L
E
E
L
G
I
G
R
P
S
T
Y
S
S
I
I
K
T
I
Q
D
R
G
Y
V
H
K
K
G
S
A
L
V
P
S
W
V
A
F
A
V
T
G
L
L
E
Q
H
F
G
R
L
V
D
Y
D
F
T
A
A
M
E
D
E
L
D
E
I
A
A
G
N
E
R
R
T
N
W
L
N
N
F
Y
------
F
G
G
D
H
G
V
P
D
S
V
A
R
S
G
G
L
K
K
L
V
G
INLEGID
A
R
E
V
N
S
I
---
K
L
-
F
D
----------
D
T
H
G
R
P
I
Y
V
R
V
G
K
N
G
P
Y
L
E
R
L
V
A
------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
70.08
38%
47
- C2 -
-
5D5H
2
TOP1_MYCTU
A:
[22-667]
-----------------------
L
V
I
V
E
S
P
T
K
A
R
K
L
A
S
Y
L
G
S
G
Y
I
V
E
S
S
R
G
H
I
R
D
L
P
R
A
ASDVPAKYKSQPWA
R
--------------
L
---------
G
V
N
V
D
A
D
F
E
P
L
Y
I
I
S
P
E
K
R
S
T
V
S
E
L
R
G
L
L
K
D
V
D
E
L
Y
L
A
T
D
G
D
R
E
G
E
A
I
A
W
H
L
L
E
T
L
K
P
R
I
P
V
K
-
R
M
V
F
H
E
I
T
E
P
A
I
R
A
A
A
E
H
P
R
D
L
D
I
D
L
V
D
A
Q
E
T
R
R
I
L
D
R
L
Y
G
Y
E
V
S
P
V
L
W
K
K
V
A
P
K
L
S
A
G
R
V
Q
S
V
A
T
R
I
I
V
A
R
E
R
D
R
M
A
F
R
S
A
A
Y
W
D
I
L
A
K
L
D
ASVSDP
D
A
A
P
-------
P
-
T
F
S
A
R
L
T
A
V
A
G
------------------
R
R
V
A
TGRDFDSLGTLRKG
D
E
V
I
V
L
-
D
E
G
S
A
T
A
L
A
A
G
L
D
G
T
Q
L
T
V
A
S
A
E
E
K
P
Y
A
R
R
P
Y
P
P
F
M
T
S
T
L
Q
Q
E
A
S
R
K
L
R
F
S
A
E
R
T
M
S
I
A
Q
R
L
Y
E
N
---------
G
Y
I
T
Y
M
R
T
D
S
T
T
L
S
E
S
A
I
N
A
A
R
T
Q
A
R
Q
L
Y
G
D
E
Y
VAPA
P
R
Q
Y
T
R
K
V
K
N
----
A
Q
E
A
H
E
A
I
R
P
A
G
E
T
F
A
-
T
P
D
A
V
R
---
R
E
L
D
G
PN
I
D
D
F
R
L
Y
E
L
I
W
Q
R
T
V
A
S
Q
M
A
D
A
--
R
G
M
T
L
S
L
R
I
----
T
G
M
SGH
Q
E
V
V
F
S
A
T
G
R
T
L
--
T
--
F
P
G
F
L
K
A
Y
V
E
T
V
D
E
LV
G
----
G
E
A
D
D
A
E
R
R
L
P
H
L
T
P
G
Q
R
L
D
I
V
E
L
T
P
D
G
H
A
T
N
P
P
A
R
Y
T
E
A
S
L
V
K
A
L
E
E
L
G
I
G
R
P
S
T
Y
S
S
I
I
K
T
I
Q
D
R
G
Y
V
H
K
K
G
S
A
L
V
P
S
W
V
A
F
A
V
T
G
L
L
E
Q
H
F
G
R
L
V
D
Y
D
F
T
A
A
M
E
D
E
L
D
E
I
A
A
G
N
E
R
R
T
N
W
L
N
N
F
Y
FGGDHG
V
P
D
S
V
A
R
S
G
G
L
K
K
L
V
G
---
I
----------
N
L
E
-------
G
I
D
A
R
E
V
N
S
I
K
L
F
D
D
T
H
G
R
P
I
Y
V
R
V
G
K
N
G
P
Y
------------------------------------------------------------------------------------------------------------------
22
HHSearch
69.92
42%
-17
- C- -
-
2GAI
-
TOP1_THEMA
B:
[7-601]
----------------------
K
Y
I
V
V
E
S
P
A
K
A
K
T
I
K
S
I
L
G
N
E
Y
E
V
F
A
S
M
G
H
I
I
D
L
P
K
S
--------------
K
--------------
F
---------
G
V
D
L
E
K
D
F
E
P
E
F
A
V
I
K
G
K
E
K
V
V
E
K
L
K
D
L
A
K
K
-
G
E
L
L
I
A
S
D
M
D
R
E
G
E
A
I
A
W
H
I
A
R
V
T
N
T
L
-
G
R
K
N
R
I
V
F
S
E
I
T
P
R
V
I
R
E
A
V
K
N
P
R
E
I
D
M
K
K
V
R
A
Q
L
A
R
R
I
L
D
R
I
V
G
Y
S
L
S
P
V
L
W
R
N
F
K
S
N
L
S
A
G
R
V
Q
S
A
T
L
K
L
V
C
D
R
E
R
E
I
L
R
F
V
P
K
K
Y
H
R
I
T
V
N
F
-------
D
G
L
T
-------
A
-
E
I
D
V
K
-------------------------
E
K
K
------------------
F
F
-
D
A
E
T
L
K
E
I
Q
S
I
---
D
E
L
V
V
E
E
K
K
V
S
V
K
K
F
A
P
P
E
P
F
K
T
S
T
L
Q
Q
E
A
Y
S
K
L
G
F
S
V
S
K
T
M
M
I
A
Q
Q
L
Y
E
G
V
E
T
K
-
D
G
H
I
A
F
I
T
Y
M
R
T
D
S
T
R
V
S
D
Y
A
K
E
E
A
R
N
L
I
T
E
V
F
G
E
E
Y
----
V
G
---------------
A
H
E
A
I
R
P
T
N
-
V
F
M
-
T
P
E
E
A
G
---
K
Y
L
N
S
---
D
Q
K
K
L
Y
E
L
I
W
K
R
F
L
A
S
Q
M
K
P
S
Q
Y
E
E
T
R
F
V
L
R
T
----
K
D
------
G
K
Y
R
F
K
G
T
V
L
KK
I
--
F
D
G
Y
E
K
V
W
K
T
E
R
---------------
N
T
G
E
F
P
F
E
E
G
E
S
V
K
P
V
V
V
K
I
E
E
Q
E
T
K
P
K
P
R
Y
T
E
G
S
L
V
K
E
M
E
R
L
G
I
G
R
P
S
T
Y
A
S
T
I
K
L
L
L
N
R
G
Y
I
K
K
I
R
G
Y
L
Y
P
T
I
V
G
S
V
V
M
D
Y
L
E
K
K
Y
S
D
V
V
S
V
S
F
T
A
E
M
E
K
D
L
D
E
V
E
Q
G
K
K
T
D
K
I
V
L
R
E
F
Y
------
E
S
F
S
S
V
F
D
R
N
D
R
I
V
V
-----------------
D
F
P
T
---
N
Q
-
K
C
----------
S
-
C
G
K
E
M
R
L
S
F
G
K
Y
G
F
Y
L
K
C
E
---------
C
G
K
T
R
S
V
K
N
D
----------
E
I
-
A
V
--
I
D
D
G
K
I
F
L
------------------------------------------------------------------
13
PsiBlast_PDB
68.11
41%
49
- C2 -
-
1MW9
-
TOP1_ECOLI
X:
[3-584]
---------------------
K
A
L
V
I
V
E
S
P
A
K
A
K
T
I
N
K
Y
L
G
S
D
Y
V
V
K
S
S
V
G
H
I
R
D
L
P
T
-ERGALVN-------
R
--------------
M
---------
G
V
D
P
W
H
N
W
E
A
H
Y
E
V
L
P
G
K
E
K
V
V
S
E
L
K
Q
L
A
E
K
A
D
H
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
G
D
D
A
R
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
K
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
K
K
I
A
R
G
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
-------
T
T
P
S
-------
G
-
E
A
L
A
L
Q
V
T
H
Q
N
------------------
D
K
P
F
------------------
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
A
---------
G
Y
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
K
Y
----
L
P
E
S
P
N
Q
Y
A
---------
R
E
A
I
R
P
S
D
-
V
N
V
-
M
A
E
S
L
K
---
D
-
M
E
A
---
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
----
G
D
------
F
R
L
K
A
R
G
R
I
L
--
R
--
F
D
G
W
T
K
V
M
P
A
L
---------------
E
D
R
I
L
P
A
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
R
E
L
M
N
Y
D
F
T
A
Q
M
E
N
N
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
------
S
D
F
T
Q
Q
L
D
K
A
E
K
D
P
E
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
25
HHSearch
68.07
44%
61
- C2 -
-
1MW9
-
TOP1_ECOLI
X:
[2-581]
--------------------
G
K
A
L
V
I
V
E
S
P
A
K
A
K
T
I
N
K
Y
L
G
S
D
Y
V
V
K
S
S
V
G
H
I
R
D
L
P
T
-------------------------------ERGALVNRM
G
V
D
P
W
H
N
W
E
A
H
Y
E
V
L
P
G
K
E
K
V
V
S
E
L
K
Q
L
A
E
K
A
D
H
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
G
D
D
A
R
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
K
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
K
K
I
A
R
G
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
-------
T
T
P
S
-------
G
E
A
L
A
L
Q
V
T
H
Q
N
D
------------------
K
P
F
R
------------------
P
V
-
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
---------
A
G
Y
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
K
Y
----
L
P
E
S
P
N
Q
Y
A
---------
R
E
A
I
R
P
S
D
-
V
N
V
-
M
A
E
S
L
----
K
D
M
E
A
---
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
----
G
D
------
F
R
L
K
A
R
G
R
I
L
--
R
--
F
D
G
W
T
K
V
M
P
A
L
---------------
E
D
R
I
L
P
A
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
R
E
L
M
N
Y
D
F
T
A
Q
M
E
N
N
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
------
S
D
F
T
Q
Q
L
D
K
A
E
K
D
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
67.21
41%
60
- C2 -
-
1MW8
2
TOP1_ECOLI
X:
[3-584]
---------------------
K
A
L
V
I
V
E
S
P
A
K
A
K
T
I
N
K
Y
L
G
S
D
Y
V
V
K
S
S
V
G
H
I
R
D
L
P
T
S
GDERGALVN-----
R
--------------
M
---------
G
V
D
P
W
H
N
W
E
A
H
Y
E
V
L
P
G
K
E
K
V
V
S
E
L
K
Q
L
A
E
K
A
D
H
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
G
D
D
A
R
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
K
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
K
K
I
A
R
G
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
-------
T
T
P
S
-------
G
-
E
A
L
A
L
Q
V
T
H
Q
N
------------------
D
K
P
F
------------------
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
A
---------
G
Y
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
K
Y
----
L
P
E
S
P
N
Q
Y
A
S
------
E
A
R
E
A
I
R
P
S
D
-
V
N
V
-
M
A
E
S
L
K
---
D
-
M
E
A
---
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
----
G
D
------
F
R
L
K
A
R
G
R
I
L
--
R
--
F
D
G
W
T
K
V
M
P
A
----------------
E
D
R
I
L
P
A
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
R
E
L
M
N
Y
D
F
T
A
Q
M
E
N
N
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
------
S
D
F
T
Q
Q
L
D
K
A
E
K
D
P
E
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
66.57
42%
47
- C2 -
-
1CY1
3
TOP1_ECOLI
A:
[5-586]
---------------------
K
A
L
V
I
V
E
S
P
A
K
A
K
T
I
N
K
Y
L
G
S
D
Y
V
V
K
S
S
V
G
H
I
R
D
L
P
--R
G
A
L
V
N
--------
R
--------------
M
---------
G
V
D
P
W
H
N
W
E
A
H
Y
E
V
L
P
G
K
E
K
V
V
S
E
L
K
Q
L
A
E
K
A
D
H
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
G
D
D
A
R
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
K
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
K
K
I
A
R
G
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
-------
T
T
P
S
-------
G
-
E
A
L
A
L
Q
V
T
H
Q
N
------------------
D
K
P
F
------------------
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
A
---------
G
Y
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
K
Y
----
L
P
E
S
P
N
Q
Y
A
-------
E
A
H
E
A
I
R
P
S
D
-
V
N
V
-
M
A
E
S
L
K
---
D
-
M
E
A
---
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
----
G
D
------
F
R
L
K
A
R
G
R
I
L
--
R
--
F
D
G
W
T
K
V
M
P
A
L
------------------
I
L
P
A
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
R
E
L
M
N
Y
D
F
T
A
Q
M
E
N
S
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
------
S
D
F
T
Q
Q
L
D
K
A
E
K
D
P
E
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
66.32
41%
67
- C2 -
-
3PWT
-
TOP1_ECOLI
A:
[3-584]
---------------------
K
A
L
V
I
V
E
S
P
A
K
A
K
T
I
N
K
Y
L
G
S
D
Y
V
V
K
S
S
V
G
H
I
R
D
L
P
T
-DER
G
A
L
V
N
------
R
--------------
M
---------
G
V
D
P
W
H
N
W
E
A
H
Y
E
V
L
P
G
K
E
K
V
V
S
E
L
K
Q
L
A
E
K
A
D
H
I
Y
L
A
T
N
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
G
D
D
A
R
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
K
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
K
K
I
A
R
G
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
-------
T
T
P
S
-------
G
-
E
A
L
A
L
Q
V
T
H
Q
N
------------------
D
K
P
F
------------------
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
A
---------
G
Y
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
K
Y
----
L
P
E
S
P
N
Q
Y
A
--------
A
H
E
A
I
R
P
S
D
-
V
N
V
-
M
A
E
S
L
K
---
D
-
M
E
A
---
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
----
G
D
------
F
R
L
K
A
R
G
R
I
L
--
R
--
F
D
G
W
T
K
V
M
P
A
L
R
--------------
E
D
R
I
L
P
A
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
R
E
L
M
N
Y
D
F
T
A
Q
M
E
N
S
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
------
S
D
F
T
Q
Q
L
D
K
A
E
K
D
P
E
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
66.03
42%
69
- C2 -
-
1CY6
1
TOP1_ECOLI
A:
[5-586]
---------------------
K
A
L
V
I
V
E
S
P
A
K
A
K
T
I
N
K
Y
L
G
S
D
Y
V
V
K
S
S
V
G
H
I
R
D
L
P
T
-DER
G
A
L
V
N
------
R
--------------
M
---------
G
V
D
P
W
H
N
W
E
A
H
Y
E
V
L
P
G
K
E
K
V
V
S
E
L
K
Q
L
A
E
K
A
D
H
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
G
D
D
A
R
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
K
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
K
K
I
A
R
G
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
-------
T
T
P
S
-------
G
-
E
A
L
A
L
Q
V
T
H
Q
N
------------------
D
K
P
F
------------------
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
A
---------
G
Y
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
K
Y
----
L
P
E
S
P
N
Q
Y
A
--------
A
H
E
A
I
R
P
S
D
-
V
N
V
-
M
A
E
S
L
K
---
D
-
M
E
A
---
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
----
G
D
------
F
R
L
K
A
R
G
R
I
L
--
R
--
F
D
G
W
T
K
V
M
P
A
L
R
--------------
E
D
R
I
L
P
A
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
R
E
L
M
N
Y
D
F
T
A
Q
M
E
N
S
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
------
S
D
F
T
Q
Q
L
D
K
A
E
K
D
P
E
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
66.01
41%
64
- C2 -
-
3PX7
2
TOP1_ECOLI
A:
[3-584]
---------------------
K
A
L
V
I
V
E
S
P
A
K
A
K
T
I
N
K
Y
L
G
S
D
Y
V
V
K
S
S
V
G
H
I
R
D
L
P
--DER
G
A
L
V
N
------
R
--------------
M
---------
G
V
D
P
W
H
N
W
E
A
H
Y
E
V
L
P
G
K
E
K
V
V
S
E
L
K
Q
L
A
E
K
A
D
H
I
Y
L
A
T
N
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
G
D
D
A
R
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
K
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
K
K
I
A
R
G
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
-------
T
T
P
S
-------
G
-
E
A
L
A
L
Q
V
T
H
Q
N
------------------
D
K
P
F
------------------
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
A
---------
G
Y
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
K
Y
----
L
P
E
S
P
N
Q
Y
A
---------
H
E
A
I
R
P
S
D
-
V
N
V
-
M
A
E
S
L
K
---
D
-
M
E
A
---
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
----
G
D
------
F
R
L
K
A
R
G
R
I
L
--
R
--
F
D
G
W
T
K
V
M
P
A
L
R
-----------------
I
L
P
A
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
R
E
L
M
N
Y
D
F
T
A
Q
M
E
N
S
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
------
S
D
F
T
Q
Q
L
D
K
A
E
K
D
P
E
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
65.96
42%
65
- C2 -
-
1CY4
1
TOP1_ECOLI
A:
[5-586]
---------------------
K
A
L
V
I
V
E
S
P
A
K
A
K
T
I
N
K
Y
L
G
S
D
Y
V
V
K
S
S
V
G
H
I
R
D
L
P
T
-DER
G
A
L
V
N
------
R
--------------
M
---------
G
V
D
P
W
H
N
W
E
A
H
Y
E
V
L
P
G
K
E
K
V
V
S
E
L
K
Q
L
A
E
K
A
D
H
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
G
D
D
A
R
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
K
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
K
K
I
A
R
G
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
-------
T
T
P
S
-------
G
-
E
A
L
A
L
Q
V
T
H
Q
N
------------------
D
K
P
F
------------------
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
A
---------
G
Y
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
K
Y
----
L
P
E
S
P
N
Q
Y
A
---------
H
E
A
I
R
P
S
D
-
V
N
V
-
M
A
E
S
L
K
---
D
-
M
E
A
---
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
----
G
D
------
F
R
L
K
A
R
G
R
I
L
--
R
--
F
D
G
W
T
K
V
M
P
A
L
------------------
I
L
P
A
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
R
E
L
M
N
Y
D
F
T
A
Q
M
E
N
S
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
------
S
D
F
T
Q
Q
L
D
K
A
E
K
D
P
E
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
65.93
42%
40
- C2 -
-
1CY0
1
TOP1_ECOLI
A:
[5-574]
---------------------
K
A
L
V
I
V
E
S
P
A
K
A
K
T
I
N
K
Y
L
G
S
D
Y
V
V
K
S
S
V
G
H
I
R
D
L
P
--A
L
V
N
----------
R
--------------
M
---------
G
V
D
P
W
H
N
W
E
A
H
Y
E
V
L
P
G
K
E
K
V
V
S
E
L
K
Q
L
A
E
K
A
D
H
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
G
D
D
A
R
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
K
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
K
K
I
A
R
G
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
-------
T
T
P
S
-------
G
-
E
A
L
A
L
Q
V
T
H
Q
N
------------------
D
K
P
F
------------------
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
A
---------
G
Y
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
K
Y
----
L
P
E
S
P
N
Q
Y
A
S
-
K
E
N
S
Q
E
A
H
E
A
I
R
P
S
D
-
V
N
V
-
M
A
E
S
L
K
---
D
-
M
E
A
---
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
----
G
D
------
F
R
L
K
A
R
G
R
I
L
--
R
--
F
D
G
W
T
K
V
M
---------------------
I
L
P
A
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
R
E
L
M
N
Y
D
F
T
A
Q
M
E
N
S
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
------
S
D
F
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
65.73
42%
75
- C2 -
-
1CY8
2
TOP1_ECOLI
A:
[5-586]
---------------------
K
A
L
V
I
V
E
S
P
A
K
A
K
T
I
N
K
Y
L
G
S
D
Y
V
V
K
S
S
V
G
H
I
R
D
L
P
--DER
G
A
L
V
N
------
R
--------------
M
---------
G
V
D
P
W
H
N
W
E
A
H
Y
E
V
L
P
G
K
E
K
V
V
S
E
L
K
Q
L
A
E
K
A
D
H
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
G
D
D
A
R
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
K
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
K
K
I
A
R
G
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
-------
T
T
P
S
-------
G
-
E
A
L
A
L
Q
V
T
H
Q
N
------------------
D
K
P
F
------------------
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
A
---------
G
Y
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
K
Y
----
L
P
E
S
P
N
Q
Y
A
---------
H
E
A
I
R
P
S
D
-
V
N
V
-
M
A
E
S
L
K
---
D
-
M
E
A
---
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
----
G
D
------
F
R
L
K
A
R
G
R
I
L
--
R
--
F
D
G
W
T
K
V
M
P
A
L
R
---------
K
G
--
D
E
D
R
I
L
P
A
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
R
E
L
M
N
Y
D
F
T
A
Q
M
E
N
S
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
------
S
D
F
T
Q
Q
L
D
K
A
E
K
D
P
E
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
65.67
42%
64
- C2 -
-
1ECL
-
TOP1_ECOLI
A:
[3-584]
---------------------
K
A
L
V
I
V
E
S
P
A
K
A
K
T
I
N
K
Y
L
G
S
D
Y
V
V
K
S
S
V
G
H
I
R
D
L
P
--DER
G
A
L
V
N
------
R
--------------
M
---------
G
V
D
P
W
H
N
W
E
A
H
Y
E
V
L
P
G
K
E
K
V
V
S
E
L
K
Q
L
A
E
K
A
D
H
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
G
D
D
A
R
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
K
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
K
K
I
A
R
G
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
-------
T
T
P
S
-------
G
-
E
A
L
A
L
Q
V
T
H
Q
N
------------------
D
K
P
F
------------------
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
A
---------
G
Y
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
K
Y
----
L
P
E
S
P
N
Q
Y
A
---------
H
E
A
I
R
P
S
D
-
V
N
V
-
M
A
E
S
L
K
---
D
-
M
E
A
---
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
----
G
D
------
F
R
L
K
A
R
G
R
I
L
--
R
--
F
D
G
W
T
K
V
M
P
A
L
R
-----------------
I
L
P
A
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
R
E
L
M
N
Y
D
F
T
A
Q
M
E
N
S
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
------
S
D
F
T
Q
Q
L
D
K
A
E
K
D
P
E
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
65.54
42%
65
- C2 -
-
1CY2
2
TOP1_ECOLI
A:
[5-586]
---------------------
K
A
L
V
I
V
E
S
P
A
K
A
K
T
I
N
K
Y
L
G
S
D
Y
V
V
K
S
S
V
G
H
I
R
D
L
P
--DER
G
A
L
V
N
------
R
--------------
M
---------
G
V
D
P
W
H
N
W
E
A
H
Y
E
V
L
P
G
K
E
K
V
V
S
E
L
K
Q
L
A
E
K
A
D
H
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
G
D
D
A
R
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
K
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
K
K
I
A
R
G
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
-------
T
T
P
S
-------
G
-
E
A
L
A
L
Q
V
T
H
Q
N
------------------
D
K
P
F
------------------
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
A
---------
G
Y
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
K
Y
----
L
P
E
S
P
N
Q
Y
A
--------
A
H
E
A
I
R
P
S
D
-
V
N
V
-
M
A
E
S
L
K
---
D
-
M
E
A
---
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
----
G
D
------
F
R
L
K
A
R
G
R
I
L
--
R
--
F
D
G
W
T
K
V
M
P
A
L
R
-----------------
I
L
P
A
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
R
E
L
M
N
Y
D
F
T
A
Q
M
E
N
S
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
------
S
D
F
T
Q
Q
L
D
K
A
E
K
D
P
E
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------