@TOME V2.3
(Mar 2018)
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 : B0VL89: (2017-11-01 )
MANTSRSASQSTASSASAAHKRALVIVESPAKAKTINKYLGSQYIVKSSVGHVRDLPTGGSKATEKKPAARTKLTEAEKEQKANQALINRMGVDPEHGWQAHYEVLSGKENVVAELKKLAKDADAIYLATDLDREGEAIAWHLREVIGGDDSRYHRVVFNEITKNAIQEAFKQPTRLDLNRVNAQQARRFLDRVVGFMVSPLLWEKIARGLSAGRVQSVAVKLVVEREREIRAFIPEEYWQVFADTKAKKDDIRLEAVKQAGKTLKLKNKAETDALLDVLKGAEYKVAQREDKPTKVNPSAPYITSTLQQAASTRLGFSVKKTMMLAQRLYEAGFITYMRTDSTFLSDDAVSMVRAHIESQYGEKYLPAKPNRYGNKAGAQEAHEAIRPSNVALTGDQLAGVERDAQRLYDLIWRQFVACQMTPAEYLSSTLTVEAGNVELKAKGRTLVFDGFTKVRGANKSDDDIILPAIKVGEILKLEKLDPSQHFTKPPARFTEASLVKELEKRGIGRPSTYAAIISTIQERGYVKLENRRLFAEKMGEIVTDRLDESFNNLMNYAFTADLEGQLDRVATGERNWKELLDTFYGDFKKRLTNAQGEQGMRRNQPVEVPAVHCPECSRPMQIRTGTTGVFLGCSGYNLPPKERCKGTLNLTPVESLAALSDDDSAETADLMSKHRCPKCGTAMDSYVIDGGRKLHVCGNNPDCDGYELEEGEFKIKGYDGPTIPCDKCDGEMQLKTGRFGPYFACTSCDNTRKVLKNGQPAPPRVEPIKMEHLRSTKHDDYFVLRDGAAGLFLAASKFPKIRETRAPKVAELRSVADQLDPKYQFILQAPDVDPEGNPTIVKFSRKNQSQYVGSETPEGKQTKWSLIYQDGKWIEG
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......
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MANTSRSASQSTASSASAAH
K
R
A
L
V
I
VESPAKA
K
T
I
N
K
Y
LGS
Q
Y
I
V
KSSVGHVRDLPTGGSKATEKKPAARTKL
T
E
A
E
K
--
E
Q
-------
K
A
N
Q
-
A
L
I
N
RMGVDPEH
G
W
Q
A
H
Y
E
V
LSG
K
E
N
V
V
A
E
L
K
K
L
AKDA
D
A
I
Y
L
ATDLDREG
E
A
I
A
W
H
L
R
E
V
IGGDDS
R
Y
H
R
V
V
F
N
E
I
T
K
N
A
I
Q
E
A
FKQPTRL
D
L
N
RV
N
A
Q
Q
A
R
R
F
L
D
R
V
V
G
F
M
V
S
P
L
L
W
E
K
I
A
R
G
L
SAG
R
V
Q
S
V
A
V
K
L
V
V
ERE
R
E
I
R
A
FI
P
E
E
Y
W
Q
V
F
A
DTKAKK-------D-
D
---------
I
--
R
L
E
A
V
K
----------------QAG------------------
K
T
L
KLKNKA
E
T
D
A
L
L
D
V
L
KGAE
Y
K
VAQREDKPTKVNPSA
P
Y
I
T
S
T
L
Q
Q
A
A
S
TRLG
F
S
V
K
K
T
M
M
L
A
Q
R
L
Y
E--------A--------G
F
I
T
Y
M
RTDSTFLS
D
D
A
V
S
M
V
R
A
H
I
E
S
Q
YGEKYLPAKPNRYGNK-A-G
A
Q
E
A
H
E
AIRPS
N
V
A
L-T
G
D
----
Q
----LAG--
V
E
R
D
A
Q
R
L
Y
D
L
I
W
R
Q
F
V
A
CQM
T
P
A
E
YLS
S
T
L
T
V
EA----G
N
----
V
E
L
K
AKG
R
T
L
--
V
FDGFTK--------VRGA-NKSD--------D
D
I
I
L
P
A
IKV
G
E
I
L
K
L
EKLDPSQHFTKPPARF
T
E
A
S
L
V
K
E
L
E
K
RGIGR
P
S
T
Y
A
A
I
I
S
T
I
Q
ER
G
Y
V
K
LE
N
R
R
L
F
A
E
K
M
G
E
I
V
T
D
R
L
D
E
S
F
N
N
L
M
N
Y
A
F
TADLEGQ
L
D
R
VATGER
N
W
K
E
L
L
D
T
F
Y
--
G
D
F
K
K
R
L
TNA-QG---EQGM------R----RNQ--PVEVPAVHCPECS----------R
P
M
Q
I
RTGT
T
G
V
F
L
-----GCS---GYNL
P
P
K
E
---RCKGTLNLT
P
V
E
S
L
A
ALSDDDS
A
E
T
A
D
L
M
S
KHRCPKCGT
A
M
D
S
Y
VIDGG
R
K
L
H
VCGNNPDCDGYELEE
G
E
F
K
I
KGYDGPTIPCDKCDG
E
M
Q
L
KTGRFG
P
Y
F
A
CTS--CD
N
T
R
K
V
L
KNGQPAPPRVEP
I
K
M
E
H
L
RSTKHD
D
Y
F
V
L
RDGAA
G
L
F
L
AASKFP
K
I
R
ETRA
P
K
V
A
E
L
R
S
V
A
D
QLDP
K
Y
Q
F
I
L
QAPDVDPEGNP
T
I
V
K
F
SRKNQSQYVGSETPEGKQ
T
K
W
S
L
I
YQD
G
K
WIEG
1
PsiBlast_PDB
74.77
65%
40
- C1 -
-
4RUL
1
TOP1_ECOLI
A:
[5-864]
---------------------
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
DPE
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
L
P
P
K
E
---
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
I
D
P
K
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
Y
D
G
P
I
V
E
C
E
K
C
G
S
E
M
H
L
K
M
G
R
F
G
K
Y
M
A
C
T
N
EE
C
K
N
T
R
K
I
L
R
N
G
E
V
A
P
P
K
E
D
P
V
P
L
P
E
L
P
C
E
K
S
D
A
Y
F
V
L
R
D
G
A
A
G
V
F
L
A
A
N
T
F
P
K
S
R
E
T
R
A
P
L
V
E
E
----
R
D
R
L
P
E
K
L
R
Y
L
A
D
A
P
------
N
K
T
M
V
R
F
S
R
K
T
K
Q
Q
Y
V
S
S
E
K
------
G
W
S
A
F
Y
V
D
G
K
W
V
E
-
5
PsiBlast_PDB
66.12
67%
34
- C1 -
-
1CY6
1
TOP1_ECOLI
A:
[5-595]
---------------------
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
---------------------------------
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
---------
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
DPE
E
G
G
M
------
R
----
P
N
Q
--
M
V
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
65.82
67%
31
- C1 -
-
3PWT
-
TOP1_ECOLI
A:
[3-593]
---------------------
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
---------------------------------
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
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
DPE
E
G
G
M
------
R
----
P
N
Q
--
M
V
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
65.37
67%
34
- C1 -
-
1MW9
-
TOP1_ECOLI
X:
[3-591]
---------------------
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
----------------------------------
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
----------
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
DPE
E
G
G
M
------
R
----
P
N
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
64.60
67%
33
- C1 -
-
3PX7
2
TOP1_ECOLI
A:
[3-590]
---------------------
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
----------------------------------
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
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
DPE
E
G
G
M
------
R
----
P
N
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
64.60
67%
6
- C1 -
-
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
64.47
67%
36
- C1 -
-
1CY4
1
TOP1_ECOLI
A:
[5-595]
---------------------
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
---------------------------------
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
----------
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
DPE
E
G
G
M
------
R
----
P
N
Q
--
M
V
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
64.47
67%
33
- C1 -
-
1ECL
-
TOP1_ECOLI
A:
[3-590]
---------------------
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
----------------------------------
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
----------
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
DPE
E
G
G
M
------
R
----
P
N
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
64.25
67%
50
- C1 -
-
1MW8
2
TOP1_ECOLI
X:
[3-591]
---------------------
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
G
-------------------------------
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
-------
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
DPE
E
G
G
M
------
R
----
P
N
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
64.25
67%
34
- C1 -
-
1CY2
2
TOP1_ECOLI
A:
[5-595]
---------------------
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
----------------------------------
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
---------
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
DPE
E
G
G
M
------
R
----
P
N
Q
--
M
V
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
63.62
67%
35
- C1 -
-
1CY8
2
TOP1_ECOLI
A:
[5-595]
---------------------
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
----------------------------------
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
----------
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
DPE
E
G
G
M
------
R
----
P
N
Q
--
M
V
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
63.46
67%
35
- C1 -
-
1CY1
3
TOP1_ECOLI
A:
[5-595]
---------------------
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
DPE
E
G
G
M
------
R
----
P
N
Q
--
M
V
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
35
HHSearch
62.54
66%
53
- C1 -
-
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
-------------------------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
AL
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
31
HHSearch
53.74
42%
32
- C1 -
-
5D5H
2
TOP1_MYCTU
A:
[19-674]
--------------------
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
S
D
V
P
A
-----------
K
Y
K
SQ
P
W
-------
A
--
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
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
LV
G
G
E
A
DD
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
I
N
LEGI
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
L
-----
E
R
L
---
V
A
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
53.62
39%
-1
- C1 -
-
2GAJ
-
TOP1_THEMA
A:
[7-588]
----------------------
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
KD
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
52.11
39%
17
- C1 -
-
5D5H
2
TOP1_MYCTU
A:
[22-694]
-----------------------
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
S
D
V
P
A
---------------------
K
Y
K
S
-
Q
P
W
A
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
A
S
V
-------
S
-
D
PDAAPP
T
F
S
A
--
R
L
T
A
V
A
GRRVATGRDFDSLGTL
R
K
G
------------------
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
S
GH
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
DE
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
FG
G
D
H
G
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
DDTHG
R
P
I
Y
V
R
V
G
K
N
G
P
Y
L
E
R
L
V
A
G
D
T
---
G
E
--
P
T
P
Q
---
R
A
N
L
S
D
S
I
T
P
D
E
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
51.89
37%
3
- C1 -
-
2GAJ
-
TOP1_THEMA
A:
[7-578]
----------------------
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
KD
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
32
HHSearch
49.85
39%
-3
- C- -
-
2GAI
-
TOP1_THEMA
B:
[7-588]
----------------------
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
VETKDGHI
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
Fugue
49.35
40%
-1
- 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
KD
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
46.84
37%
2
- C- -
-
2GAI
-
TOP1_THEMA
A:
[7-578]
----------------------
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
KD
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
KY
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------