@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 : I3U5N4: (2017-12-29 )
MHKGWSGHFFCAQNEKGSEKMAEITLEFDTIAAISTPPGEGAISIVRLSGDQAVQLADKVYQSGNKRLSEVPSHTIHYGHIVDPKSNQLVDEVMVSVMRAPKTFTREDVVEINCHGGIVVVNQILQLLLREGARLAEPGEFTKRAFLNGRVDLSQAEAVMDLIRAKTDKAMGLALNQLDGNLSALIRSLRQEILETLAQVEVNIDYPEYDDVEELTTKLLLEKAQMIQQRIQALLATSKQGKVLREGLSTAIIGRPNVGKSSLLNHLLREEKAIVTDIAGTTRDVIEEYVNVRGVPLKLIDTAGIRETEDVVERIGVERSRKALAEADLILLVLNQSEPLTAEDEQLLEATSGLKRIILLNKTDLPAQLEQEKLKKLIENEPVFSISVAKNDGLDRLESAISDLFFSGETGERDATYVSNTRHIALLEKASLSLEEVIAGIDSGMPVDLVQIDMTRCWDYLGEVVGDSVQDELITQLFSQFCLGK
Atome Classification :
(27 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...
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MHKGWSG
H
F
F
C
AQNEKGSEK
M
A
E
I
T
L
E
F
D
T
I
A
A
ISTP--P--GEG
A
I
S
I
V
R
LSGD
Q
A
V
Q
L
A
D
K
V
Y
Q
S--GN
K
-
R
L
S
-EVPSH
T
I
H
Y
G
H
I
VDPKSN
Q
L
V
D
E
V
M
V
S
V
M
RAPKTFTRE
D
V
V
E
I
NCHG
G
I
V
V
V
N
Q
I
L
Q
L
L
L
REGARLAEP
G
E
F
T
K
R
A
FLNGRVD
L
S
Q
A
E
A
V
M
D
L
I
R
A
KTDKAM
G
L
A
L
N
Q
LDG
N
L
S
A
L
I
R
S
L
R
Q
E
I
L
E
T
L
A
Q
V
E
V
N
IDYPEYD
D
V
E
E
L
T
T
K
L
L
L
E
K
A
Q
M
I
Q
Q
R
I
Q
A
L
LATSKQ
G
K
V
L
R
E
GL
S
T
AIIGRPNV
G
K
S
S
L
L
N
H
L
L
R
E
E
K
A
I
V
TDIAG
T
T
R
D
V
I
E
E
Y
V
NV-RGV
P
L
K
L
I
DTAGIR-
E
T
E
-
D
--
V
V
E
R
IG
V
E
R
S
R
K
A
LAEA
D
L
I
L
L
V
LN-QS-----EPLTA
E
----
D
E
Q
L
--
L
E
---
A
--T--SG
L
K
R
I
I
L
-----
L
NKTDL
P
A
Q
L
E
--
Q
----------
E
----
K
L
K
-
K
-------
L
I---E-N---E-P
V
F
S
I
---
S
VAKND
G
L
D
R
L
E
S
A
I
----
S
D
L
F
FSGETGERD
A
T
Y
VSNT
R
H
I
A
L
L
E
K
ASL
S
L
E
E
V
I
A
G
IDSGMP
V
D
L
V
Q
I
D
M
T
R
C
W
D
Y
L
G
E
VVGD
S
V
Q
D
E
L
I
T
Q
L
F
S
Q
FCLGK
68
Fugue
78.93
41%
-21
- C3 -
-
1XZP
-
MNME_THEMA
A:
[27-482]
---------------------
S
S
V
D
K
L
M
D
T
I
V
A
V
A
T
P
--
P
--
G
K
G
A
I
A
I
L
R
L
S
G
P
D
S
W
K
I
V
Q
K
H
L
R
T
--
R
S
K
-
I
-----
V
P
R
K
A
I
H
G
W
I
H
E
--
N
G
E
D
V
D
E
V
V
V
V
F
Y
K
S
P
K
S
Y
T
G
E
D
M
V
E
V
M
C
H
G
G
P
L
V
V
K
K
L
L
D
L
F
L
K
S
G
A
R
M
A
E
P
G
E
F
T
K
R
A
F
L
N
G
K
M
D
L
T
S
A
E
A
V
R
D
L
I
E
A
K
S
E
T
S
L
K
L
S
L
R
N
L
K
G
G
L
R
D
F
V
D
S
L
R
R
E
L
I
E
V
L
A
E
I
R
V
E
L
D
Y
P
D
E
I
E
T
N
---
T
G
E
V
V
T
R
L
E
R
I
K
E
K
L
T
E
E
L
K
K
A
D
A
G
I
L
L
N
R
G
L
R
M
V
I
V
G
K
P
N
V
G
K
S
T
L
L
N
R
L
L
N
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D
R
A
I
V
T
D
I
P
G
T
T
R
D
V
I
S
E
E
I
V
I
-
R
G
I
L
F
R
I
V
D
T
A
G
V
R
S
E
T
N
-
D
--
L
V
E
R
L
G
I
E
R
T
L
Q
E
I
E
K
A
D
I
V
L
F
V
L
D
-
A
S
-----
S
P
L
D
E
E
----
D
R
K
I
--
L
E
---
R
--
I
--
K
N
K
R
Y
L
V
V
-----
I
N
K
V
D
V
V
E
K
I
N
--
E
----------
E
----
E
I
K
-
N
-------
K
L
---
G
-
T
---
D
R
H
M
V
K
I
---
S
A
L
K
G
E
G
L
E
K
L
E
E
S
I
----
Y
R
E
T
-
Q
E
I
F
E
R
G
S
D
S
L
I
T
N
L
R
Q
K
Q
L
L
E
N
V
K
G
H
L
E
D
A
I
K
S
L
K
E
G
M
P
V
D
M
A
S
I
D
L
E
R
A
L
N
L
L
D
E
V
T
G
R
S
F
R
E
D
L
L
D
T
I
F
S
N
F
C
V
G
K
49
HHSearch
78.51
41%
-24
- C3 -
-
1XZP
-
MNME_THEMA
A:
[27-482]
---------------------
S
S
V
D
K
L
M
D
T
I
V
A
V
A
T
P
--
P
--
G
K
G
A
I
A
I
L
R
L
S
G
P
D
S
W
K
I
V
Q
K
H
L
-
R
--
T
R
----
S
-
K
I
V
P
R
K
A
I
H
G
W
I
H
E
N
--
G
E
D
V
D
E
V
V
V
V
F
Y
K
S
P
K
S
Y
T
G
E
D
M
V
E
V
M
C
H
G
G
P
L
V
V
K
K
L
L
D
L
F
L
K
S
G
A
R
M
A
E
P
G
E
F
T
K
R
A
F
L
N
G
K
M
D
L
T
S
A
E
A
V
R
D
L
I
E
A
K
S
E
T
S
L
K
L
S
L
R
N
L
K
G
G
L
R
D
F
V
D
S
L
R
R
E
L
I
E
V
L
A
E
I
R
V
E
L
D
Y
P
D
E
I
E
T
N
---
T
G
E
V
V
T
R
L
E
R
I
K
E
K
L
T
E
E
L
K
K
A
D
A
G
I
L
L
N
R
G
L
R
M
V
I
V
G
K
P
N
V
G
K
S
T
L
L
N
R
L
L
N
E
D
R
A
I
V
T
D
I
P
G
T
T
R
D
V
I
S
E
E
I
V
I
-
R
G
I
L
F
R
I
V
D
T
A
G
V
R
-
S
E
T
N
D
--
L
V
E
R
L
G
I
E
R
T
L
Q
E
I
E
K
A
D
I
V
L
F
V
L
D
-
A
S
-----
S
P
L
D
E
E
----
D
R
K
I
--
L
E
---
R
--
I
--
K
N
K
R
Y
L
V
V
-----
I
N
K
V
D
V
V
E
K
I
N
--
E
----------
E
----
E
I
K
-
N
-------
K
L
---
G
T
D
---
R
-
H
M
V
K
I
---
S
A
L
K
G
E
G
L
E
K
L
E
E
S
I
----
Y
R
E
T
Q
E
I
F
E
-
R
G
S
D
S
L
I
T
N
L
R
Q
K
Q
L
L
E
N
V
K
G
H
L
E
D
A
I
K
S
L
K
E
G
M
P
V
D
M
A
S
I
D
L
E
R
A
L
N
L
L
D
E
V
T
G
R
S
F
R
E
D
L
L
D
T
I
F
S
N
F
C
V
G
K
3
PsiBlast_PDB
77.96
42%
-35
- C3 -
-
1XZQ
2
?
A:
[34-482]
----------------------------
D
T
I
V
A
V
A
T
P
--
P
--
G
K
G
A
I
A
I
L
R
L
S
G
P
D
S
W
K
I
V
Q
K
H
L
R
T
--
R
S
K
-
I
----
V
P
R
K
A
I
H
-
G
W
I
--
H
E
N
G
E
D
V
D
E
V
V
V
V
F
Y
K
S
P
K
S
Y
T
G
E
D
M
V
E
V
M
C
H
G
G
P
L
V
V
K
K
L
L
D
L
F
L
K
S
G
A
R
M
A
E
P
G
E
F
T
K
R
A
F
L
N
G
K
M
D
L
T
S
A
E
A
V
R
D
L
I
E
A
K
S
E
T
S
L
K
L
S
L
R
N
L
K
G
G
L
R
D
F
V
D
S
L
R
R
E
L
I
E
V
L
A
E
I
R
V
E
L
D
Y
P
--
D
E
I
E
T
N
T
G
E
V
V
T
-
R
L
E
R
I
K
E
K
L
T
E
E
L
K
K
A
D
A
G
I
L
L
N
R
G
L
R
M
V
I
V
G
K
P
N
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G
K
S
T
L
L
N
R
L
L
N
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D
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A
I
V
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D
I
P
G
T
T
R
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I
S
E
E
I
V
I
-
R
G
I
L
F
R
I
V
D
T
A
G
V
R
S
E
T
N
-
D
--
L
V
E
R
L
G
I
E
R
T
L
Q
E
I
E
K
A
D
I
V
L
F
V
L
D
-
A
S
-----
S
P
L
D
E
E
----
D
R
K
I
--
L
E
---
R
--
I
--
K
N
K
R
Y
L
V
V
-----
I
N
K
V
D
V
V
E
K
I
N
--
E
----------
E
----
E
I
K
N
K
-------
L
G
---
T
-
D
---
R
-
H
M
V
K
I
---
S
A
L
K
G
E
G
L
E
K
L
E
E
S
I
Y
R
E
T
Q
E
I
F
E
R
G
S
D
-----
S
L
I
T
N
L
R
Q
K
Q
L
L
E
N
V
K
G
H
L
E
D
A
I
K
S
L
K
E
G
M
P
V
D
M
A
S
I
D
L
E
R
A
L
N
L
L
D
E
V
T
G
R
S
F
R
E
D
L
L
D
T
I
F
S
N
F
C
V
G
K
2
PsiBlast_PDB
77.63
42%
-25
- C3 -
-
1XZP
-
MNME_THEMA
A:
[27-482]
---------------------
S
S
V
D
K
L
M
D
T
I
V
A
V
A
T
P
--
P
--
G
K
G
A
I
A
I
L
R
L
S
G
P
D
S
W
K
I
V
Q
K
H
L
R
T
--
R
S
K
-
I
----
V
P
R
K
A
I
H
-
G
W
I
--
H
E
N
G
E
D
V
D
E
V
V
V
V
F
Y
K
S
P
K
S
Y
T
G
E
D
M
V
E
V
M
C
H
G
G
P
L
V
V
K
K
L
L
D
L
F
L
K
S
G
A
R
M
A
E
P
G
E
F
T
K
R
A
F
L
N
G
K
M
D
L
T
S
A
E
A
V
R
D
L
I
E
A
K
S
E
T
S
L
K
L
S
L
R
N
L
K
G
G
L
R
D
F
V
D
S
L
R
R
E
L
I
E
V
L
A
E
I
R
V
E
L
D
Y
P
--
D
E
I
E
T
N
T
G
E
V
V
T
-
R
L
E
R
I
K
E
K
L
T
E
E
L
K
K
A
D
A
G
I
L
L
N
R
G
L
R
M
V
I
V
G
K
P
N
V
G
K
S
T
L
L
N
R
L
L
N
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D
R
A
I
V
T
D
I
P
G
T
T
R
D
V
I
S
E
E
I
V
I
-
R
G
I
L
F
R
I
V
D
T
A
G
V
R
S
E
T
N
-
D
--
L
V
E
R
L
G
I
E
R
T
L
Q
E
I
E
K
A
D
I
V
L
F
V
L
D
-
A
S
-----
S
P
L
D
E
E
----
D
R
K
I
--
L
E
---
R
--
I
--
K
N
K
R
Y
L
V
V
-----
I
N
K
V
D
V
V
E
K
I
N
--
E
----------
E
----
E
I
K
N
K
-------
L
G
---
T
-
D
---
R
-
H
M
V
K
I
---
S
A
L
K
G
E
G
L
E
K
L
E
E
S
I
Y
R
E
T
Q
E
I
F
E
R
G
S
D
-----
S
L
I
T
N
L
R
Q
K
Q
L
L
E
N
V
K
G
H
L
E
D
A
I
K
S
L
K
E
G
M
P
V
D
M
A
S
I
D
L
E
R
A
L
N
L
L
D
E
V
T
G
R
S
F
R
E
D
L
L
D
T
I
F
S
N
F
C
V
G
K
1
PsiBlast_PDB
72.37
44%
24
- C3 -
-
3GEH
2
MNME_NOSS1
A:
[9-462]
-----------------------------
T
I
A
A
I
A
T
A
I
V
P
--
Q
Q
G
S
V
G
I
V
R
V
S
G
S
Q
A
I
A
I
A
Q
T
L
F
D
A
--
P
G
K
-
Q
V
W
-
E
--
S
H
R
I
L
Y
G
Y
I
R
H
P
Q
T
R
Q
I
V
D
E
A
L
L
L
L
M
K
A
P
R
S
Y
T
R
E
D
V
V
E
F
H
C
H
G
G
I
I
A
V
Q
Q
V
L
Q
L
C
L
E
S
G
A
R
L
A
Q
P
G
E
F
T
L
R
A
F
L
N
G
R
L
D
L
T
Q
A
E
S
I
A
D
L
V
G
A
R
S
P
Q
A
A
Q
T
A
L
A
G
L
Q
G
K
L
A
H
P
I
R
Q
L
R
A
N
C
L
D
I
L
A
E
I
E
A
R
I
D
F
E
E
--
D
L
P
P
L
D
D
E
A
I
I
S
D
I
E
N
I
A
A
E
I
S
Q
L
L
A
T
K
D
K
G
E
L
L
R
T
G
L
K
V
A
I
V
G
R
P
N
V
G
K
S
S
L
L
N
A
W
S
Q
S
D
R
A
I
V
T
D
L
P
G
T
T
R
D
V
V
E
S
Q
L
V
V
-
G
G
I
P
V
Q
V
L
D
------------------------
Q
A
A
N
T
A
D
L
V
L
L
T
I
D
-
A
A
-----
T
G
W
T
T
G
----
D
Q
E
I
--
Y
E
---
Q
--
V
--
K
H
R
P
L
I
L
V
-----
M
N
K
I
D
L
---
V
E
--
K
----------
Q
----
L
I
T
-
S
-------
L
E
---
Y
-
P
---
E
-
N
I
T
Q
I
V
H
T
A
A
A
Q
K
Q
G
I
D
S
L
E
T
A
I
----
L
E
I
V
Q
T
G
K
V
Q
A
A
D
M
D
L
A
I
N
Q
R
Q
A
A
A
L
T
Q
A
K
M
S
L
E
Q
V
Q
A
T
I
T
Q
Q
L
P
L
D
F
W
T
I
D
L
R
G
A
I
Q
A
L
G
E
I
T
G
E
E
V
T
E
S
V
L
D
R
I
F
S
R
F
C
I
G
K
48
HHSearch
72.33
43%
25
- C3 -
-
3GEH
2
MNME_NOSS1
A:
[3-462]
-----------------------
H
M
A
I
T
G
T
I
A
A
I
A
T
A
--
I
V
P
Q
Q
G
S
V
G
I
V
R
V
S
G
S
Q
A
I
A
I
A
Q
T
L
F
D
A
--
P
G
---
K
Q
-
V
W
E
S
H
R
I
L
Y
G
Y
I
R
H
P
Q
T
R
Q
I
V
D
E
A
L
L
L
L
M
K
A
P
R
S
Y
T
R
E
D
V
V
E
F
H
C
H
G
G
I
I
A
V
Q
Q
V
L
Q
L
C
L
E
S
G
A
R
L
A
Q
P
G
E
F
T
L
R
A
F
L
N
G
R
L
D
L
T
Q
A
E
S
I
A
D
L
V
G
A
R
S
P
Q
A
A
Q
T
A
L
A
G
L
Q
G
K
L
A
H
P
I
R
Q
L
R
A
N
C
L
D
I
L
A
E
I
E
A
R
I
D
F
E
E
D
L
P
--
P
L
D
D
E
A
I
I
S
D
I
E
N
I
A
A
E
I
S
Q
L
L
A
T
K
D
K
G
E
L
L
R
T
G
L
K
V
A
I
V
G
R
P
N
V
G
K
S
S
L
L
N
A
W
S
Q
S
D
R
A
I
V
T
D
L
P
G
T
T
R
D
V
V
E
S
Q
L
V
V
-
G
G
I
P
V
Q
V
L
D
------------------------
Q
A
A
N
T
A
D
L
V
L
L
T
I
D
-
A
A
-----
T
G
W
T
T
G
----
D
Q
E
I
--
Y
E
---
Q
--
V
--
K
H
R
P
L
I
L
V
-----
M
N
K
I
D
L
V
E
K
Q
L
--
I
----------
T
----
S
L
E
-
Y
-------
P
E
---
N
-
I
---
T
-
Q
I
V
H
T
---
A
A
A
Q
K
Q
G
I
D
S
L
E
T
A
I
----
L
E
I
V
Q
T
G
K
V
Q
A
A
D
M
D
L
A
I
N
Q
R
Q
A
A
A
L
T
Q
A
K
M
S
L
E
Q
V
Q
A
T
I
T
Q
Q
L
P
L
D
F
W
T
I
D
L
R
G
A
I
Q
A
L
G
E
I
T
G
E
E
V
T
E
S
V
L
D
R
I
F
S
R
F
C
I
G
K
5
PsiBlast_PDB
70.95
39%
16
- C3 -
-
3GEI
1
MNME_CHLTE
A:
[18-476]
------------------------------
I
A
A
I
A
T
P
--
V
--
G
V
G
A
L
A
I
V
R
I
S
G
A
G
V
L
D
L
A
D
R
V
F
R
K
V
H
G
S
G
-
K
L
A
-
E
A
A
G
Y
T
A
H
F
G
R
L
Y
D
--
G
E
E
M
V
D
E
V
I
A
L
V
F
R
A
P
R
S
F
T
A
E
Q
M
V
E
F
T
C
H
G
G
P
V
V
V
G
R
V
L
R
L
M
L
D
N
G
C
R
L
A
E
P
G
E
F
T
R
R
A
F
L
N
G
R
I
D
L
L
Q
A
E
A
I
G
E
M
I
H
A
R
T
E
S
A
Y
R
T
A
V
S
Q
M
K
G
D
L
S
V
R
L
G
G
L
R
E
Q
L
I
R
S
C
A
L
I
E
L
E
L
D
F
S
E
-
E
D
V
E
F
Q
S
R
D
E
L
T
M
Q
I
E
T
L
R
S
E
V
N
R
L
I
D
S
Y
Q
H
G
R
I
V
S
E
G
V
S
T
V
I
A
G
K
P
N
A
G
K
S
T
L
L
N
T
L
L
------------------
E
E
C
F
I
H
-
D
K
T
M
F
R
L
T
D
------------------------
M
K
M
A
E
A
D
L
I
L
Y
L
L
D
L
G
T
-----
E
R
L
D
D
E
----
L
T
E
I
--
R
E
L
K
A
A
--
H
--
P
A
A
K
F
L
T
V
-----
A
N
K
L
D
R
A
A
N
----
A
----------
D
----
A
L
I
-
R
-------
A
I
---
A
-
D
G
T
G
T
-
E
V
I
G
I
---
S
A
L
N
G
D
G
I
D
T
L
K
Q
H
M
----
G
D
L
V
K
N
L
----
E
A
S
V
L
V
T
S
L
R
H
Y
E
A
L
R
N
A
S
D
A
L
Q
N
A
L
E
L
I
A
H
E
S
E
T
E
L
I
A
F
E
L
R
A
A
L
D
Y
V
G
Q
I
T
G
K
V
V
N
E
E
V
L
N
T
I
F
D
K
F
C
I
G
K
46
HHSearch
69.94
37%
-1
- C3 -
-
3GEI
1
MNME_CHLTE
A:
[7-476]
-------------------
S
D
L
H
L
P
V
P
G
H
P
I
A
A
I
A
T
P
--
V
--
G
V
G
A
L
A
I
V
R
I
S
G
A
G
V
L
D
L
A
D
R
V
F
R
K
--
V
H
G
S
G
K
L
A
E
A
A
G
Y
T
A
H
F
G
R
L
Y
D
G
--
E
E
M
V
D
E
V
I
A
L
V
F
R
A
P
R
S
F
T
A
E
Q
M
V
E
F
T
C
H
G
G
P
V
V
V
G
R
V
L
R
L
M
L
D
N
G
C
R
L
A
E
P
G
E
F
T
R
R
A
F
L
N
G
R
I
D
L
L
Q
A
E
A
I
G
E
M
I
H
A
R
T
E
S
A
Y
R
T
A
V
S
Q
M
K
G
D
L
S
V
R
L
G
G
L
R
E
Q
L
I
R
S
C
A
L
I
E
L
E
L
D
F
S
E
E
D
V
-
E
F
Q
S
R
D
E
L
T
M
Q
I
E
T
L
R
S
E
V
N
R
L
I
D
S
Y
Q
H
G
R
I
V
S
E
G
V
S
T
V
I
A
G
K
P
N
A
G
K
S
T
L
L
N
T
L
L
------------------
E
E
C
F
I
H
-
D
K
T
M
F
R
L
T
D
------------------------
M
K
M
A
E
A
D
L
I
L
Y
L
L
D
-
L
G
-----
T
E
R
L
D
D
E
L
T
E
I
R
E
L
--
K
A
---
A
--
H
--
P
A
A
K
F
L
T
V
-----
A
N
K
L
D
R
A
A
N
A
D
--
A
----------
L
I
---
R
A
I
-
A
-------
D
G
---
T
-
G
---
T
-
E
V
I
G
I
---
S
A
L
N
G
D
G
I
D
T
L
K
Q
H
M
----
G
D
L
V
K
N
L
----
E
A
S
V
L
V
T
S
L
R
H
Y
E
A
L
R
N
A
S
D
A
L
Q
N
A
L
E
L
I
A
H
E
S
E
T
E
L
I
A
F
E
L
R
A
A
L
D
Y
V
G
Q
I
T
G
K
V
V
N
E
E
V
L
N
T
I
F
D
K
F
C
I
G
K
21
PsiBlast_CBE
69.85
39%
11
- C3 -
-
3GEI
1
MNME_CHLTE
B:
[18-476]
------------------------------
I
A
A
I
A
T
P
--
V
--
G
V
G
A
L
A
I
V
R
I
S
G
A
G
V
L
D
L
A
D
R
V
F
R
K
V
H
G
S
G
-
K
L
A
-
E
A
A
G
Y
T
A
H
F
G
R
L
Y
D
--
G
E
E
M
V
D
E
V
I
A
L
V
F
R
A
P
R
S
F
T
A
E
Q
M
V
E
F
T
C
H
G
G
P
V
V
V
G
R
V
L
R
L
M
L
D
N
G
C
R
L
A
E
P
G
E
F
T
R
R
A
F
L
N
G
R
I
D
L
L
Q
A
E
A
I
G
E
M
I
H
A
R
T
E
S
A
Y
R
T
A
V
S
Q
M
K
G
D
L
S
V
R
L
G
G
L
R
E
Q
L
I
R
S
C
A
L
I
E
L
E
L
D
F
S
E
-
E
D
V
E
F
Q
S
R
D
E
L
T
M
Q
I
E
T
L
R
S
E
V
N
R
L
I
D
S
Y
Q
H
G
R
I
V
S
E
G
V
S
T
V
I
A
G
K
P
N
A
G
K
S
T
L
L
N
T
L
L
------------------
E
E
C
F
I
H
-
D
K
T
M
F
R
L
T
D
------------------------
M
K
M
A
E
A
D
L
I
L
Y
L
L
D
L
G
T
-----
E
R
L
D
D
E
----
L
T
E
I
--
R
E
L
KA
A
--
H
--
P
A
A
K
F
L
T
V
-----
A
N
K
L
D
R
A
A
N
----
A
----------
D
----
A
L
I
-
R
-------
A
I
---
A
-
D
GTG
T
-
E
V
I
G
I
---
S
A
L
N
G
D
G
I
D
T
L
K
Q
H
M
----
G
D
L
V
K
--------
S
V
L
V
T
S
L
R
H
Y
E
A
L
R
N
A
S
D
A
L
Q
N
A
L
E
L
I
A
H
E
S
E
T
E
L
I
A
F
E
L
R
A
A
L
D
Y
V
G
Q
I
T
G
K
V
V
N
E
E
V
L
N
T
I
F
D
K
F
C
I
G
K
47
HHSearch
68.79
37%
3
- C3 -
-
3GEE
2
MNME_CHLTE
A:
[12-476]
------------------------
P
V
P
G
H
P
I
A
A
I
A
T
P
--
V
--
G
V
G
A
L
A
I
V
R
I
S
G
A
G
V
L
D
L
A
D
R
V
F
R
K
--
V
H
G
S
G
K
L
A
E
A
A
G
Y
T
A
H
F
G
R
L
Y
D
G
--
E
E
M
V
D
E
V
I
A
L
V
F
R
A
P
R
S
F
T
A
E
Q
M
V
E
F
T
C
H
G
G
P
V
V
V
G
R
V
L
R
L
M
L
D
N
G
C
R
L
A
E
P
G
E
F
T
R
R
A
F
L
N
G
R
I
D
L
L
Q
A
E
A
I
G
E
M
I
H
A
R
T
E
S
A
Y
R
T
A
V
S
Q
M
K
G
D
L
S
V
R
L
G
G
L
R
E
Q
L
I
R
S
C
A
L
I
E
L
E
L
D
F
S
E
E
D
V
-
E
F
Q
S
R
D
E
L
T
M
Q
I
E
T
L
R
S
E
V
N
R
L
I
D
S
Y
Q
H
G
R
I
V
S
E
G
V
S
T
V
I
A
G
K
P
N
A
G
K
S
T
L
L
N
T
L
L
------------------
E
E
C
F
I
H
-
D
K
T
M
F
R
L
T
D
------------------------
M
K
M
A
E
A
D
L
I
L
Y
L
L
D
-
L
G
-----
T
E
R
L
D
D
E
L
T
E
I
R
E
L
--
K
A
---
A
--
H
--
P
A
A
K
F
L
T
V
-----
A
N
K
L
D
R
A
A
N
A
D
--
A
----------
L
I
---
R
A
I
-
A
-------
D
G
---
T
-
G
---
T
-
E
V
I
G
I
---
S
A
L
N
G
D
G
I
D
T
L
K
Q
H
M
----
G
D
L
V
K
N
L
D
K
L
H
E
A
S
V
L
V
T
S
L
R
H
Y
E
A
L
R
N
A
S
D
A
L
Q
N
A
L
E
L
I
A
H
E
S
E
T
E
L
I
A
F
E
L
R
A
A
L
D
Y
V
G
Q
I
T
G
K
V
V
N
E
E
V
L
N
T
I
F
D
K
F
C
I
G
K
4
PsiBlast_PDB
68.54
39%
23
- C3 -
-
3GEE
2
MNME_CHLTE
A:
[18-476]
------------------------------
I
A
A
I
A
T
P
--
V
--
G
V
G
A
L
A
I
V
R
I
S
G
A
G
V
L
D
L
A
D
R
V
F
R
K
VH
G
S
G
-
K
L
A
-
E
A
A
G
Y
T
A
H
F
G
R
L
Y
D
--
G
E
E
M
V
D
E
V
I
A
L
V
F
R
A
P
R
S
F
T
A
E
Q
M
V
E
F
T
C
H
G
G
P
V
V
V
G
R
V
L
R
L
M
L
D
N
G
C
R
L
A
E
P
G
E
F
T
R
R
A
F
L
N
G
R
I
D
L
L
Q
A
E
A
I
G
E
M
I
H
A
R
T
E
S
A
Y
R
T
A
V
S
Q
M
K
G
D
L
S
V
R
L
G
G
L
R
E
Q
L
I
R
S
C
A
L
I
E
L
E
L
D
F
S
E
-
E
D
V
E
F
Q
S
R
D
E
L
T
M
Q
I
E
T
L
R
S
E
V
N
R
L
I
D
S
Y
Q
H
G
R
I
V
S
E
G
V
S
T
V
I
A
G
K
P
N
A
G
K
S
T
L
L
N
T
L
L
------------------
E
E
C
F
I
H
-
D
K
T
M
F
R
L
T
D
------------------------
M
K
M
A
E
A
D
L
I
L
Y
L
L
D
L
G
T
-----
E
R
L
D
D
E
----
L
T
E
I
--
R
E
L
K
A
A
--
H
--
P
A
A
K
F
L
T
V
-----
A
N
K
L
D
R
A
A
N
----
A
----------
D
----
A
L
I
-
R
-------
A
I
---
A
-
D
G
T
G
T
-
E
V
I
G
I
---
S
A
L
N
G
D
G
I
D
T
L
K
Q
H
M
----
G
D
L
V
K
N
L
D
K
L
H
E
A
S
V
L
V
T
S
L
R
H
Y
E
A
L
R
N
A
S
D
A
L
Q
N
A
L
E
L
I
A
H
E
S
E
T
E
L
I
A
F
E
L
R
A
A
L
D
Y
V
G
Q
I
T
G
K
V
V
N
E
E
V
L
N
T
I
F
D
K
F
C
I
G
K
64
HHSearch
47.44
32%
-97
- C3 -
-
1MKY
1
DER_THEMA
A:
[176-355]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
I
T
D
A
I
K
V
A
I
V
G
R
P
N
V
G
K
S
T
L
F
N
A
I
L
N
K
E
R
A
L
V
S
P
I
P
------
V
D
D
E
V
F
I
-
D
G
R
K
Y
V
F
V
D
T
A
G
L
-----------
E
K
Y
S
N
Y
R
V
V
D
S
I
E
K
A
D
V
V
V
I
V
L
D
-
A
T
-----
Q
G
I
T
R
Q
----
D
Q
R
M
--
A
G
---
L
--
M
E
R
R
G
R
A
S
V
V
V
-----
F
N
K
W
D
L
V
V
H
R
E
KR
Y
----------
D
----
E
F
T
-
K
L
F
R
E
---
K
L
YFI
D
-
Y
---
S
-
P
L
I
F
T
---
S
A
D
K
G
W
N
I
D
R
M
I
D
A
M
----
N
L
A
Y
A
S
------------------------------------------------------------------------------
55
HHSearch
43.34
22%
-86
- C3 -
-
4B43
4
IF2_THET8
A:
[10-235]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
K
E
L
G
M
E
T
Q
E
L
L
E
L
L
D
Q
M
G
V
A
Y
K
S
H
A
S
T
-
L
E
E
K
D
A
E
A
V
R
E
L
V
K
E
Q
R
G
L
Q
E
K
L
A
E
E
E
R
R
K
S
L
P
R
R
P
P
V
V
V
I
M
G
H
V
D
H
G
L
T
T
L
L
D
Y
L
R
K
S
R
I
A
E
-
K
E
A
G
G
I
T
Q
H
V
G
A
F
E
V
K
T
-
P
Q
G
T
V
V
F
I
D
T
P
G
A
E
-
A
--------------------
K
V
A
D
I
A
V
I
V
I
A
-
A
D
-----
D
G
I
M
P
Q
----
T
E
E
A
--
I
A
---
H
--
A
K
A
A
G
A
K
L
I
F
A
-----
I
N
K
I
D
L
P
Q
A
D
P
--
E
----------
K
V
K
R
-
Q
L
M
-
E
R
G
F
V
P
EE
Y
G
---
G
-
D
---
A
-
I
V
I
P
I
---
S
A
K
T
G
Q
G
V
Q
D
L
L
E
M
I
----
L
L
L
A
E
-------------------------------------------------------------------------------
23
PsiBlast_CBE
41.93
47%
-133
- C3 -
-
1XZQ
2
?
B:
[33-149]
---------------------------
M
D
T
I
V
A
V
A
T
P
--
P
--
G
K
G
A
I
A
I
L
R
L
S
G
P
D
S
W
K
I
V
Q
K
H
L
R
T
--
R
S
K
-
I
----
V
P
R
K
A
I
H
-
G
W
I
--
H
E
N
G
E
D
V
D
E
V
V
V
V
F
Y
K
S
P
K
S
Y
T
G
E
D
M
V
E
V
M
C
H
G
G
P
L
V
V
K
K
L
L
D
L
F
L
K
S
G
A
R
M
A
E
P
G
E
F
T
K
R
A
F
L
N
G
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
58
HHSearch
38.26
31%
15
- C3 -
-
3IEV
1
ERA_AQUAE
A:
[9-182]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
V
G
Y
V
A
I
V
G
K
P
N
V
G
K
S
T
L
L
N
N
L
L
G
T
K
V
S
I
I
S
P
K
A
G
T
T
R
M
R
V
L
G
V
K
N
I
P
N
E
A
Q
I
I
F
L
D
T
P
G
I
Y
-
E
P
K
-
K
SD
V
L
G
H
S
M
V
E
I
A
K
Q
S
L
E
E
A
D
V
I
L
F
M
I
D
-
A
T
-----
E
G
W
R
P
R
----
D
E
E
I
--
Y
Q
N
--
F
IK
P
--
L
N
K
P
V
I
V
V
-----
I
N
K
I
D
K
I
G
P
A
K
N-
V
----------
L
P
L
I
D
E
I
H
-
K
-------
K
H
---
P
E
L
---
T
-
E
I
V
P
I
---
S
A
L
K
G
A
N
L
D
E
L
V
K
T
I
----
L
K
Y
L
P
E
------------------------------------------------------------------------------
11
PsiBlast_PDB
37.72
32%
-82
- C3 -
-
1MKY
1
DER_THEMA
A:
[179-344]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
A
I
K
V
A
I
V
G
R
P
N
V
G
K
S
T
L
F
N
A
I
L
N
K
E
R
A
L
V
S
P
I
P
------
V
D
D
E
V
F
I
-
D
G
R
K
Y
V
F
V
D
T
A
G
L
-----------
E
K
Y
S
N
Y
R
V
V
D
S
I
E
K
A
D
V
V
V
I
V
L
D
-
A
T
-----
Q
G
I
T
R
Q
----
D
Q
R
M
A
G
L
M
---
E
--
R
--
R
G
R
A
S
V
V
V
-----
F
N
K
W
D
L
V
V
H
R
E
--
K
R
Y
D
E
F
T
K
L
F
R
E
----
K
L
--
Y
-------
F
I
---
D
-
Y
---
S
-
P
L
I
F
T
---
S
A
D
K
G
W
N
I
D
R
---------------------------------------------------------------------------------------------
28
PsiBlast_CBE
37.58
31%
-50
- C3 -
-
4KYU
1
DER_BACSU
B:
[7-163]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
I
V
G
R
P
N
V
G
K
S
T
I
F
N
R
I
A
-----------------
I
Y
S
S
A
E
W
--
N
Y
D
F
N
L
I
D
T
G
G
I
D
-
I
G
D
-
E
--
P
F
L
A
Q
I
R
Q
Q
A
E
I
A
M
D
E
A
D
V
I
I
F
M
V
N
-
G
R
-----
E
G
V
T
A
A
----
D
E
E
V
--
A
K
---
I
--
L
--
Y
R
T
K
K
P
V
V
L
A
V
N
K
L
D
N
T
E
M
R
A
N
I
Y
--
D
----------------
F
Y
-
S
-------
L
G
---
F
-
G
---
E
-
P
-
Y
P
I
---
S
G
T
H
G
L
G
L
G
D
L
L
D
A
V
----
A
E
H
F
--------------------------------------------------------------------------------
56
HHSearch
37.30
31%
15
* C3 *
-
3R9X
3
ERA_AQUAE
A:
[8-181]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
V
G
Y
V
A
I
V
G
K
P
N
V
G
K
S
T
L
L
N
N
L
L
G
T
K
V
S
I
I
S
P
K
A
G
T
T
R
M
R
V
L
G
V
K
N
I
P
N
E
A
Q
I
I
F
L
D
T
P
G
I
Y
-
E
P
K
-
K
SD
V
L
G
H
S
M
V
E
I
A
K
Q
S
L
E
E
A
D
V
I
L
F
M
I
D
-
A
T
-----
E
G
W
R
P
R
----
D
E
E
I
--
Y
Q
N
--
F
IK
P
--
L
N
K
P
V
I
V
V
-----
I
N
K
I
D
K
I
G
P
A
K
N-
V
----------
L
P
L
I
D
E
I
H
-
K
-------
K
H
---
P
E
L
---
T
-
E
I
V
P
I
---
S
A
L
K
G
A
N
L
D
E
L
V
K
T
I
----
L
K
Y
L
P
E
------------------------------------------------------------------------------
40
PsiBlast_CBE
37.11
34%
-136
- C3 -
-
1PUJ
1
RBGA_BACSU
A:
[102-175]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
I
L
Q
E
K
F
D
R
M
R
A
K
G
V
K
P
R
A
I
R
----
A
L
I
I
G
I
P
N
V
G
K
S
T
L
I
N
R
L
A
K
K
N
I
A
--------------
Q
W
V
K
V
--
G
K
E
L
E
L
L
D
T
P
G
I
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
29
PsiBlast_CBE
36.80
31%
-49
- C3 -
-
5X4B
1
?
B:
[6-162]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
I
V
G
R
P
N
V
G
K
S
T
I
F
N
R
I
A
-----------------
I
Y
S
S
A
E
W
-
L
N
Y
D
F
N
L
I
D
T
G
G
I
D
-
I
G
D
-
E
--
P
F
L
A
Q
I
R
Q
Q
A
E
I
A
M
D
E
A
D
V
I
I
F
M
V
N
-
G
R
-----
E
G
V
T
A
A
----
D
E
E
V
--
A
K
---
I
--
L
--
Y
R
T
K
K
P
V
V
L
A
V
N
K
L
D
N
T
E
M
R
A
N
I
Y
--
D
----------------
F
Y
-
S
-------
L
G
---
F
-
G
---
E
-
P
-
Y
P
I
---
S
G
T
H
G
L
G
L
G
D
L
L
D
A
V
----
A
E
H
F
--------------------------------------------------------------------------------
24
PsiBlast_CBE
36.73
43%
-55
- C3 -
-
2GJA
1
B:
[3-130]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
H
G
M
K
V
V
I
A
G
R
P
N
A
G
K
S
S
L
L
N
A
L
A
G
R
E
A
A
I
V
T
D
I
A
G
T
T
R
D
V
L
R
E
H
I
H
I
-
D
G
M
P
L
H
I
I
D
T
A
G
L
R
-
E
A
S
-
D
--
E
V
E
R
I
G
I
E
R
A
W
Q
E
I
E
Q
A
D
R
V
L
F
M
V
D
-
G
T
TTDAV
D
P
A
E
I
W
----
P
E
F
I
--
A
R
---
L
--
P
--
A
K
L
P
I
T
V
V
-----
R
N
K
A
D
I
T
G
E
------------------------------------------------------------------------------------------------------------------------------------------------------------
25
PsiBlast_CBE
36.70
43%
-54
- C3 -
-
2GJ9
1
D:
[5-130]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
K
V
V
I
A
G
R
P
N
A
G
K
S
S
L
L
N
A
L
A
G
R
E
A
A
I
V
T
D
I
A
G
T
T
R
D
V
L
R
E
H
I
H
I
-
D
G
M
P
L
H
I
I
D
T
A
G
L
R
-
E
A
S
-
D
--
E
V
E
R
I
G
I
E
R
A
W
Q
E
I
E
Q
A
D
R
V
L
F
M
V
D
-
G
T
TTDAV
D
P
A
E
I
W
----
P
E
F
I
--
A
R
---
L
--
P
--
A
K
L
P
I
T
V
V
-----
R
N
K
A
D
I
T
G
E
------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
36.54
43%
-55
- C3 -
-
2GJ8
2
MNME_ECOLI
A:
[4-130]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
M
K
V
V
I
A
G
R
P
N
A
G
K
S
S
L
L
N
A
L
A
G
R
E
A
A
I
V
T
D
I
A
G
T
T
R
D
V
L
R
E
H
I
H
I
-
D
G
M
P
L
H
I
I
D
T
A
G
L
R
-
E
A
S
-
D
--
E
V
E
R
I
G
I
E
R
A
W
Q
E
I
E
Q
A
D
R
V
L
F
M
V
D
-
G
T
TTDAV
D
P
A
E
I
W
----
P
E
F
I
--
A
R
---
L
--
P
--
A
K
L
P
I
T
V
V
-----
R
N
K
A
D
I
T
G
E
------------------------------------------------------------------------------------------------------------------------------------------------------------
27
PsiBlast_CBE
35.96
43%
-57
- C3 -
-
2GJ9
1
MNME_ECOLI
B:
[5-130]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
K
V
V
I
A
G
R
P
N
A
G
K
S
S
L
L
N
A
L
A
G
R
E
A
A
I
V
T
D
I
A
G
T
T
R
D
V
L
R
E
H
I
H
I
-
D
G
M
P
L
H
I
I
D
T
A
G
L
R
-
E
A
S
-
D
--
E
V
E
R
I
G
I
E
R
A
W
Q
E
I
E
Q
A
D
R
V
L
F
M
V
D
-
G
T
TTDAV
D
P
A
E
I
W
----
P
E
F
I
--
A
R
---
L
--
P
--
A
K
L
P
I
T
V
V
-----
R
N
K
A
D
I
T
G
E
------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
35.68
43%
-51
- C3 -
-
2GJ9
1
MNME_ECOLI
A:
[4-130]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
M
K
V
V
I
A
G
R
P
N
A
G
K
S
S
L
L
N
A
L
A
G
R
E
A
A
I
V
T
D
I
A
G
T
T
R
D
V
L
R
E
H
I
H
I
-
D
G
M
P
L
H
I
I
D
T
A
G
L
R
-
E
A
S
-
D
--
E
V
E
R
I
G
I
E
R
A
W
Q
E
I
E
Q
A
D
R
V
L
F
M
V
D
-
G
T
TTDAV
D
P
A
E
I
W
----
P
E
F
I
--
A
R
---
L
--
P
--
A
K
L
P
I
T
V
V
-----
R
N
K
A
D
I
T
G
E
------------------------------------------------------------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
35.14
43%
-52
- C3 -
-
2GJ9
1
MNME_ECOLI
C:
[4-130]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
M
K
V
V
I
A
G
R
P
N
A
G
K
S
S
L
L
N
A
L
A
G
R
E
A
A
I
V
T
D
I
A
G
T
T
R
D
V
L
R
E
H
I
H
I
-
D
G
M
P
L
H
I
I
D
T
A
G
L
R
-
E
A
S
-
D
--
E
V
E
R
I
G
I
E
R
A
W
Q
E
I
E
Q
A
D
R
V
L
F
M
V
D
-
G
T
TTDAV
D
P
A
E
I
W
----
P
E
F
I
--
A
R
---
L
--
P
--
A
K
L
P
I
T
V
V
-----
R
N
K
A
D
I
T
G
E
------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
33.77
43%
-53
- C3 -
-
2GJA
1
MNME_ECOLI
A:
[3-130]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
H
G
M
K
V
V
I
A
G
R
P
N
A
G
K
S
S
L
L
N
A
L
A
G
R
E
A
A
I
V
T
D
I
A
G
T
T
R
D
V
L
R
E
H
I
H
I
-
D
G
M
P
L
H
I
I
D
T
A
G
L
R
-
E
A
S
-
D
--
E
V
E
R
I
G
I
E
R
A
W
Q
E
I
E
Q
A
D
R
V
L
F
M
V
D
-
G
T
TTDAV
D
P
A
E
I
W
----
P
E
F
I
--
A
R
---
L
--
P
--
A
K
L
P
I
T
V
V
-----
R
N
K
A
D
I
T
G
E
------------------------------------------------------------------------------------------------------------------------------------------------------------