@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 : B0VKC0: (2017-10-26 )
MCGVVGIAGKSPVNQMLFDALTMLQHRGQDAAGIVTCHEGRLFLRKDNGMVRDVFHTRHMRALLGNYGIGHVRYPTAGSSSSAEAQPFYVNSPYGITLAHNGNLTNAEEIHDDLFKTDLRHMNTDSDSEVLLNVFAHELQKIGTLNPTPEDIFHTVSRVHERCQGAYGVVAMITGHGLVGFRDPNGIRPLIYGSRVTEQGEMEYIIASESVAITALGFKIERDIAPGEAIFINADGELFTKQCAANPKYRPCIFEYVYFARPDAIIDGISVYKARLKMGEKLAHKILRDWGEDHDIDVVIPIPDTSRTSALELANILGVKLREGFMKNRYIGRTFIMPGQQQRKKSVRQKLNPVELEFKGKNVLLVDDSIVRGTTCNEIIQMARDSGAKKVYFASAAPKVMYPNVYGIDMPAKTELIASERSVEEIQEIIGADRLIFQDLEDLKNAVRTSKVPTLTEFDCSVFDGIYVTGGIDADYLNNLEQKRNDSAKKKKDGYIDVNIDAASVDLTGIKEE
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.
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MCGVVGIAGKS
P
V
N
Q
M
L
F
D
A
L
T
M
L
Q
HRGQDA
A
G
I
V
T
C-HE-
G
R
L
F
-
L
RKDN
G
M
V
R
D
V
F
H
T
R
H
M
R
A
L
L
GNYGIG
H
V
RYPTAGSSSSAEAQ
P
F
Y
VNSPY
G
I
T
L
AHNGNLT
N
A
E
E
I
H
D
D
L
F
K
T
-
D
L
R
HMNTDS
D
S
E
V
L
L
N
V
F
A
H
E
L
Q
K
IGTLNP
T
P
E
D
I
F
H
T
V
S
R
V
H
E
R
CQGAY
G
V
V
A
M
I
T--GHGLVGFRDPNGIRP
L
I
YGSRVTEQGE
M
E
Y
I
I
ASE
S
V
A
I
T
A
L
G
F
K
I
E
RDIAPG
E
A
I
F
I
NADG
E
L
F
T
-
K
Q
CAANPKY
R
P
----
C
I
F
E
Y
V
YFAR
P
D
A
I
I
D
G
I
S
V
Y
K
A
R
L
K
M
G
E
K
L
A
H
K
I
L
R
DWGEDHD
I
D
V
V
I
PIPDTSR
T
S
A
L
E
L
A
N
I
L
G
V
K
L
R
E
G
F
MKNRYIG
R
T
FIMP
G
Q
-------
Q
Q
R
K
K
S
V
R
QKLN
P
V
E
L
E
FKG
K
N
V
L
L
VDDSIVRGT
T
C
N
E
I
I
Q
M
A
R
DSGA
K
K
V
Y
FASAAPK----VMY-P
N
V
YGIDMPA
K
T
E
L
I
ASER
S
V
E
E
I
Q
E
I
IGA
D
R
L
I
F
Q
D
L
E
D
L
K
N
A
V
R
TSKV
P
T
L
T
EFDC
S
V
FD
G
I
Y
V
TGGI
D
A
D
Y
L
N
N
L
E
Q
KRNDSAKKKKD
G
Y
I
D
V
N
I
D
A
A
S
V
DLTGIKEE
22
PsiBlast_CBE
76.32
63%
-30
- C6 -
-
1ECG
4
PUR1_ECOLI
B:
[1-487]
-
C
G
I
V
G
I
A
G
V
M
P
V
N
Q
S
I
Y
D
A
L
T
V
L
Q
H
R
G
Q
D
A
A
G
I
I
T
I
-
D
A
-
N
N
C
F
R
L
R
K
A
N
G
L
V
S
D
V
F
E
A
R
H
M
Q
R
L
Q
G
N
M
G
I
G
H
V
R
Y
P
T
A
G
S
S
S
A
S
E
A
Q
P
F
Y
V
N
S
P
Y
G
I
T
L
A
H
N
G
N
L
T
N
A
H
E
L
R
K
K
L
F
E
E
-
K
R
R
H
I
N
T
T
S
D
S
E
I
L
L
N
I
F
A
S
E
L
D
N
F
R
H
Y
P
L
E
A
D
N
I
F
A
A
I
A
A
T
N
R
L
I
R
G
A
Y
A
C
V
A
M
I
I
--
G
H
G
M
V
A
F
R
D
P
N
G
I
R
P
L
V
L
G
K
R
D
I
D
E
N
R
T
E
Y
M
V
A
S
E
S
V
A
L
D
T
L
G
F
D
F
L
R
D
V
A
P
G
E
A
I
Y
I
T
E
E
G
Q
L
F
T
-
R
Q
C
A
D
N
P
V
S
N
P
----
C
L
F
E
Y
V
Y
F
A
R
P
D
S
F
I
D
K
I
S
V
Y
S
A
R
V
N
M
G
T
K
L
G
E
K
I
A
R
E
W
-
E
D
L
D
I
D
V
V
I
P
I
P
E
T
S
C
D
I
A
L
E
I
A
R
I
L
G
K
P
Y
R
Q
G
F
V
K
N
R
Y
V
G
R
T
F
I
M
P
G
Q
-------
Q
L
R
R
K
S
V
R
R
K
L
N
A
N
R
A
E
F
R
D
K
N
V
L
L
V
D
D
S
I
V
R
G
T
T
S
E
Q
I
I
E
M
A
R
E
A
G
A
K
K
V
Y
L
A
S
A
A
P
E
----
I
R
F
-
P
N
V
Y
G
I
D
M
P
S
A
T
E
L
I
A
H
G
R
E
V
D
E
I
R
Q
I
I
G
A
D
G
L
I
F
Q
D
L
N
D
L
I
D
A
V
R
A
E
N
-
P
D
I
Q
Q
F
E
C
S
V
F
N
G
V
Y
V
T
K
D
V
D
Q
G
Y
L
D
F
L
D
T
L
R
N
D
D
A
K
------------------------
2
PsiBlast_PDB
75.86
63%
-32
- C6 -
-
1ECG
4
PUR1_ECOLI
A:
[1-487]
-
C
G
I
V
G
I
A
G
V
M
P
V
N
Q
S
I
Y
D
A
L
T
V
L
Q
H
R
G
Q
D
A
A
G
I
I
T
I
-
D
A
-
N
N
C
F
R
L
R
K
A
N
G
L
V
S
D
V
F
E
A
R
H
M
Q
R
L
Q
G
N
M
G
I
G
H
V
R
Y
P
T
A
G
S
S
S
A
S
E
A
Q
P
F
Y
V
N
S
P
Y
G
I
T
L
A
H
N
G
N
L
T
N
A
H
E
L
R
K
K
L
F
E
E
-
K
R
R
H
I
N
T
T
S
D
S
E
I
L
L
N
I
F
A
S
E
L
D
N
F
R
H
Y
P
L
E
A
D
N
I
F
A
A
I
A
A
T
N
R
L
I
R
G
A
Y
A
C
V
A
M
I
I
--
G
H
G
M
V
A
F
R
D
P
N
G
I
R
P
L
V
L
G
K
R
D
I
D
E
N
R
T
E
Y
M
V
A
S
E
S
V
A
L
D
T
L
G
F
D
F
L
R
D
V
A
P
G
E
A
I
Y
I
T
E
E
G
Q
L
F
T
-
R
Q
C
A
D
N
P
V
S
N
P
----
C
L
F
E
Y
V
Y
F
A
R
P
D
S
F
I
D
K
I
S
V
Y
S
A
R
V
N
M
G
T
K
L
G
E
K
I
A
R
E
W
-
E
D
L
D
I
D
V
V
I
P
I
P
E
T
S
C
D
I
A
L
E
I
A
R
I
L
G
K
P
Y
R
Q
G
F
V
K
N
R
Y
V
G
R
T
F
I
M
P
G
Q
-------
Q
L
R
R
K
S
V
R
R
K
L
N
A
N
R
A
E
F
R
D
K
N
V
L
L
V
D
D
S
I
V
R
G
T
T
S
E
Q
I
I
E
M
A
R
E
A
G
A
K
K
V
Y
L
A
S
A
A
P
E
----
I
R
F
-
P
N
V
Y
G
I
D
M
P
S
A
T
E
L
I
A
H
G
R
E
V
D
E
I
R
Q
I
I
G
A
D
G
L
I
F
Q
D
L
N
D
L
I
D
A
V
R
A
E
N
-
P
D
I
Q
Q
F
E
C
S
V
F
N
G
V
Y
V
T
K
D
V
D
Q
G
Y
L
D
F
L
D
T
L
R
N
D
D
A
K
------------------------
23
PsiBlast_CBE
75.82
63%
-30
- C6 -
-
1ECF
3
PUR1_ECOLI
B:
[1-487]
-
C
G
I
V
G
I
A
G
V
M
P
V
N
Q
S
I
Y
D
A
L
T
V
L
Q
H
R
G
Q
D
A
A
G
I
I
T
I
-
D
A
-
N
N
C
F
R
L
R
K
A
N
G
L
V
S
D
V
F
E
A
R
H
M
Q
R
L
Q
G
N
M
G
I
G
H
V
R
Y
P
T
A
G
S
S
S
A
S
E
A
Q
P
F
Y
V
N
S
P
Y
G
I
T
L
A
H
N
G
N
L
T
N
A
H
E
L
R
K
K
L
F
E
E
-
K
R
R
H
I
N
T
T
S
D
S
E
I
L
L
N
I
F
A
S
E
L
D
N
F
R
H
Y
P
L
E
A
D
N
I
F
A
A
I
A
A
T
N
R
L
I
R
G
A
Y
A
C
V
A
M
I
I
--
G
H
G
M
V
A
F
R
D
P
N
G
I
R
P
L
V
L
G
K
R
D
I
D
E
N
R
T
E
Y
M
V
A
S
E
S
V
A
L
D
T
L
G
F
D
F
L
R
D
V
A
P
G
E
A
I
Y
I
T
E
E
G
Q
L
F
T
-
R
Q
C
A
D
N
P
V
S
N
P
----
C
L
F
E
Y
V
Y
F
A
R
P
D
S
F
I
D
K
I
S
V
Y
S
A
R
V
N
M
G
T
K
L
G
E
K
I
A
R
E
W
-
E
D
L
D
I
D
V
V
I
P
I
P
E
T
S
C
D
I
A
L
E
I
A
R
I
L
G
K
P
Y
R
Q
G
F
V
K
N
R
Y
V
G
R
T
F
I
M
P
G
Q
-------
Q
L
R
R
K
S
V
R
R
K
L
N
A
N
R
A
E
F
R
D
K
N
V
L
L
V
D
D
S
I
V
R
G
T
T
S
E
Q
I
I
E
M
A
R
E
A
G
A
K
K
V
Y
L
A
S
A
A
P
E
----
I
R
F
-
P
N
V
Y
G
I
D
M
P
S
A
T
E
L
I
A
H
G
R
E
V
D
E
I
R
Q
I
I
G
A
D
G
L
I
F
Q
D
L
N
D
L
I
D
A
V
R
A
E
N
-
P
D
I
Q
Q
F
E
C
S
V
F
N
G
V
Y
V
T
K
D
V
D
Q
G
Y
L
D
F
L
D
T
L
R
N
D
D
A
K
------------------------
26
PsiBlast_CBE
75.80
63%
-37
- C6 -
-
1ECB
3
PUR1_ECOLI
C:
[1-482]
-
C
G
I
V
G
I
A
G
V
M
P
V
N
Q
S
I
Y
D
A
L
T
V
L
Q
H
R
G
Q
D
A
A
G
I
I
T
I
-
D
A
-
N
N
C
F
R
L
R
K
A
N
G
L
V
S
D
V
F
E
A
R
H
M
Q
R
L
Q
G
N
M
G
I
G
H
V
R
Y
P
T
A
G
S
S
S
A
S
E
A
Q
P
F
Y
V
N
S
P
Y
G
I
T
L
A
H
N
G
N
L
T
N
A
H
E
L
R
K
K
L
F
E
E
-
K
R
R
H
I
N
T
T
S
D
S
E
I
L
L
N
I
F
A
S
E
L
D
N
F
R
H
Y
P
L
E
A
D
N
I
F
A
A
I
A
A
T
N
R
L
I
R
G
A
Y
A
C
V
A
M
I
I
--
G
H
G
M
V
A
F
R
D
P
N
G
I
R
P
L
V
L
G
K
R
D
I
D
E
N
R
T
E
Y
M
V
A
S
E
S
V
A
L
D
T
L
G
F
D
F
L
R
D
V
A
P
G
E
A
I
Y
I
T
E
E
G
Q
L
F
T
-
R
Q
C
A
D
N
P
V
S
N
P
----
C
L
F
E
Y
V
Y
F
A
R
P
D
S
F
I
D
K
I
S
V
Y
S
A
R
V
N
M
G
T
K
L
G
E
K
I
A
R
E
W
-
E
D
L
D
I
D
V
V
I
P
I
P
E
T
S
C
D
I
A
L
E
I
A
R
I
L
G
K
P
Y
R
Q
G
F
V
K
N
R
Y
V
G
R
T
F
I
M
P
G
Q
-------
Q
L
R
R
K
S
V
R
R
K
L
N
A
N
R
A
E
F
R
D
K
N
V
L
L
V
D
D
S
I
V
R
G
T
T
S
E
Q
I
I
E
M
A
R
E
A
G
A
K
K
V
Y
L
A
S
A
A
P
E
----
I
R
F
-
P
N
V
Y
G
I
D
M
P
S
A
T
E
L
I
A
H
G
R
E
V
D
E
I
R
Q
I
I
G
A
D
G
L
I
F
Q
D
L
N
D
L
I
D
A
V
R
A
E
N
-
P
D
I
Q
Q
F
E
C
S
V
F
N
G
V
Y
V
T
K
D
V
D
Q
G
Y
L
D
F
L
D
T
L
R
-----------------------------
1
PsiBlast_PDB
75.65
63%
-30
- C6 -
-
1ECF
3
PUR1_ECOLI
A:
[1-487]
-
C
G
I
V
G
I
A
G
V
M
P
V
N
Q
S
I
Y
D
A
L
T
V
L
Q
H
R
G
Q
D
A
A
G
I
I
T
I
-
D
A
-
N
N
C
F
R
L
R
K
A
N
G
L
V
S
D
V
F
E
A
R
H
M
Q
R
L
Q
G
N
M
G
I
G
H
V
R
Y
P
T
A
G
S
S
S
A
S
E
A
Q
P
F
Y
V
N
S
P
Y
G
I
T
L
A
H
N
G
N
L
T
N
A
H
E
L
R
K
K
L
F
E
E
-
K
R
R
H
I
N
T
T
S
D
S
E
I
L
L
N
I
F
A
S
E
L
D
N
F
R
H
Y
P
L
E
A
D
N
I
F
A
A
I
A
A
T
N
R
L
I
R
G
A
Y
A
C
V
A
M
I
I
--
G
H
G
M
V
A
F
R
D
P
N
G
I
R
P
L
V
L
G
K
R
D
I
D
E
N
R
T
E
Y
M
V
A
S
E
S
V
A
L
D
T
L
G
F
D
F
L
R
D
V
A
P
G
E
A
I
Y
I
T
E
E
G
Q
L
F
T
-
R
Q
C
A
D
N
P
V
S
N
P
----
C
L
F
E
Y
V
Y
F
A
R
P
D
S
F
I
D
K
I
S
V
Y
S
A
R
V
N
M
G
T
K
L
G
E
K
I
A
R
E
W
-
E
D
L
D
I
D
V
V
I
P
I
P
E
T
S
C
D
I
A
L
E
I
A
R
I
L
G
K
P
Y
R
Q
G
F
V
K
N
R
Y
V
G
R
T
F
I
M
P
G
Q
-------
Q
L
R
R
K
S
V
R
R
K
L
N
A
N
R
A
E
F
R
D
K
N
V
L
L
V
D
D
S
I
V
R
G
T
T
S
E
Q
I
I
E
M
A
R
E
A
G
A
K
K
V
Y
L
A
S
A
A
P
E
----
I
R
F
-
P
N
V
Y
G
I
D
M
P
S
A
T
E
L
I
A
H
G
R
E
V
D
E
I
R
Q
I
I
G
A
D
G
L
I
F
Q
D
L
N
D
L
I
D
A
V
R
A
E
N
-
P
D
I
Q
Q
F
E
C
S
V
F
N
G
V
Y
V
T
K
D
V
D
Q
G
Y
L
D
F
L
D
T
L
R
N
D
D
A
K
------------------------
24
PsiBlast_CBE
75.53
63%
-28
- C6 -
-
1ECC
3
PUR1_ECOLI
B:
[1-487]
-
C
G
I
V
G
I
A
G
V
M
P
V
N
Q
S
I
Y
D
A
L
T
V
L
Q
H
R
G
Q
D
A
A
G
I
I
T
I
-
D
A
-
N
N
C
F
R
L
R
K
A
N
G
L
V
S
D
V
F
E
A
R
H
M
Q
R
L
Q
G
N
M
G
I
G
H
V
R
Y
P
T
A
G
S
S
S
A
S
E
A
Q
P
F
Y
V
N
S
P
Y
G
I
T
L
A
H
N
G
N
L
T
N
A
H
E
L
R
K
K
L
F
E
E
-
K
R
R
H
I
N
T
T
S
D
S
E
I
L
L
N
I
F
A
S
E
L
D
N
F
R
H
Y
P
L
E
A
D
N
I
F
A
A
I
A
A
T
N
R
L
I
R
G
A
Y
A
C
V
A
M
I
I
--
G
H
G
M
V
A
F
R
D
P
N
G
I
R
P
L
V
L
G
K
R
D
I
D
E
N
R
T
E
Y
M
V
A
S
E
S
V
A
L
D
T
L
G
F
D
F
L
R
D
V
A
P
G
E
A
I
Y
I
T
E
E
G
Q
L
F
T
-
R
Q
C
A
D
N
P
V
S
N
P
----
C
L
F
E
Y
V
Y
F
A
R
P
D
S
F
I
D
K
I
S
V
Y
S
A
R
V
N
M
G
T
K
L
G
E
K
I
A
R
E
W
-
E
D
L
D
I
D
V
V
I
P
I
P
E
T
S
C
D
I
A
L
E
I
A
R
I
L
G
K
P
Y
R
Q
G
F
V
K
N
R
Y
V
G
R
T
F
I
M
P
G
Q
-------
Q
L
R
R
K
S
V
R
R
K
L
N
A
N
R
A
E
F
R
D
K
N
V
L
L
V
D
D
S
I
V
R
G
T
T
S
E
Q
I
I
E
M
A
R
E
A
G
A
K
K
V
Y
L
A
S
A
A
P
E
----
I
R
F
-
P
N
V
Y
G
I
D
M
P
S
A
T
E
L
I
A
H
G
R
E
V
D
E
I
R
Q
I
I
G
A
D
G
L
I
F
Q
D
L
N
D
L
I
D
A
V
R
A
E
N
-
P
D
I
Q
Q
F
E
C
S
V
F
N
G
V
Y
V
T
K
D
V
D
Q
G
Y
L
D
F
L
D
T
L
R
N
D
D
A
K
------------------------
4
PsiBlast_PDB
75.13
63%
-30
- C6 -
-
1ECC
3
PUR1_ECOLI
A:
[1-487]
-
C
G
I
V
G
I
A
G
V
M
P
V
N
Q
S
I
Y
D
A
L
T
V
L
Q
H
R
G
Q
D
A
A
G
I
I
T
I
-
D
A
-
N
N
C
F
R
L
R
K
A
N
G
L
V
S
D
V
F
E
A
R
H
M
Q
R
L
Q
G
N
M
G
I
G
H
V
R
Y
P
T
A
G
S
S
S
A
S
E
A
Q
P
F
Y
V
N
S
P
Y
G
I
T
L
A
H
N
G
N
L
T
N
A
H
E
L
R
K
K
L
F
E
E
-
K
R
R
H
I
N
T
T
S
D
S
E
I
L
L
N
I
F
A
S
E
L
D
N
F
R
H
Y
P
L
E
A
D
N
I
F
A
A
I
A
A
T
N
R
L
I
R
G
A
Y
A
C
V
A
M
I
I
--
G
H
G
M
V
A
F
R
D
P
N
G
I
R
P
L
V
L
G
K
R
D
I
D
E
N
R
T
E
Y
M
V
A
S
E
S
V
A
L
D
T
L
G
F
D
F
L
R
D
V
A
P
G
E
A
I
Y
I
T
E
E
G
Q
L
F
T
-
R
Q
C
A
D
N
P
V
S
N
P
----
C
L
F
E
Y
V
Y
F
A
R
P
D
S
F
I
D
K
I
S
V
Y
S
A
R
V
N
M
G
T
K
L
G
E
K
I
A
R
E
W
-
E
D
L
D
I
D
V
V
I
P
I
P
E
T
S
C
D
I
A
L
E
I
A
R
I
L
G
K
P
Y
R
Q
G
F
V
K
N
R
Y
V
G
R
T
F
I
M
P
G
Q
-------
Q
L
R
R
K
S
V
R
R
K
L
N
A
N
R
A
E
F
R
D
K
N
V
L
L
V
D
D
S
I
V
R
G
T
T
S
E
Q
I
I
E
M
A
R
E
A
G
A
K
K
V
Y
L
A
S
A
A
P
E
----
I
R
F
-
P
N
V
Y
G
I
D
M
P
S
A
T
E
L
I
A
H
G
R
E
V
D
E
I
R
Q
I
I
G
A
D
G
L
I
F
Q
D
L
N
D
L
I
D
A
V
R
A
E
N
-
P
D
I
Q
Q
F
E
C
S
V
F
N
G
V
Y
V
T
K
D
V
D
Q
G
Y
L
D
F
L
D
T
L
R
N
D
D
A
K
------------------------
21
PsiBlast_CBE
75.06
63%
-29
- C6 -
-
1ECJ
1
PUR1_ECOLI
C:
[1-487]
-
C
G
I
V
G
I
A
G
V
M
P
V
N
Q
S
I
Y
D
A
L
T
V
L
Q
H
R
G
Q
D
A
A
G
I
I
T
I
-
D
A
-
N
N
C
F
R
L
R
K
A
N
G
L
V
S
D
V
F
E
A
R
H
M
Q
R
L
Q
G
N
M
G
I
G
H
V
R
Y
P
T
A
G
S
S
S
A
S
E
A
Q
P
F
Y
V
N
S
P
Y
G
I
T
L
A
H
N
G
N
L
T
N
A
H
E
L
R
K
K
L
F
E
E
-
K
R
R
H
I
N
T
T
S
D
S
E
I
L
L
N
I
F
A
S
E
L
D
N
F
R
H
Y
P
L
E
A
D
N
I
F
A
A
I
A
A
T
N
R
L
I
R
G
A
Y
A
C
V
A
M
I
I
--
G
H
G
M
V
A
F
R
D
P
N
G
I
R
P
L
V
L
G
K
R
D
I
D
E
N
R
T
E
Y
M
V
A
S
E
S
V
A
L
D
T
L
G
F
D
F
L
R
D
V
A
P
G
E
A
I
Y
I
T
E
E
G
Q
L
F
T
-
R
Q
C
A
D
N
P
V
S
N
P
----
C
L
F
E
Y
V
Y
F
A
R
P
D
S
F
I
D
K
I
S
V
Y
S
A
R
V
N
M
G
T
K
L
G
E
K
I
A
R
E
W
-
E
D
L
D
I
D
V
V
I
P
I
P
E
T
S
C
D
I
A
L
E
I
A
R
I
L
G
K
P
Y
R
Q
G
F
V
K
N
R
Y
V
G
R
T
F
I
M
P
G
Q
-------
Q
L
R
R
K
S
V
R
R
K
L
N
A
N
R
A
E
F
R
D
K
N
V
L
L
V
D
D
S
I
V
R
G
T
T
S
E
Q
I
I
E
M
A
R
E
A
G
A
K
K
V
Y
L
A
S
A
A
P
E
----
I
R
F
-
P
N
V
Y
G
I
D
M
P
S
A
T
E
L
I
A
H
G
R
E
V
D
E
I
R
Q
I
I
G
A
D
G
L
I
F
Q
D
L
N
D
L
I
D
A
V
R
A
E
N
-
P
D
I
Q
Q
F
E
C
S
V
F
N
G
V
Y
V
T
K
D
V
D
Q
G
Y
L
D
F
L
D
T
L
R
N
D
D
A
K
------------------------
99
HHSearch
75.01
63%
-21
* C6 *
-
1ECF
3
PUR1_ECOLI
B:
[1-490]
-
C
G
I
V
G
I
A
G
V
M
P
V
N
Q
S
I
Y
D
A
L
T
V
L
Q
H
R
G
Q
D
A
A
G
I
I
T
I
-
D
A
N
N
C
F
R
-
L
R
K
A
N
G
L
V
S
D
V
F
E
A
R
H
M
Q
R
L
Q
G
N
M
G
I
G
H
V
R
Y
P
T
A
G
S
S
S
A
S
E
A
Q
P
F
Y
V
N
S
P
Y
G
I
T
L
A
H
N
G
N
L
T
N
A
H
E
L
R
K
K
L
F
E
E
K
R
R
-
H
I
N
T
T
S
D
S
E
I
L
L
N
I
F
A
S
E
L
D
N
F
R
H
Y
P
L
E
A
D
N
I
F
A
A
I
A
A
T
N
R
L
I
R
G
A
Y
A
C
V
A
M
I
I
--
G
H
G
M
V
A
F
R
D
P
N
G
I
R
P
L
V
L
G
K
R
D
I
D
E
N
R
T
E
Y
M
V
A
S
E
S
V
A
L
D
T
L
G
F
D
F
L
R
D
V
A
P
G
E
A
I
Y
I
T
E
E
G
-
Q
L
F
T
R
Q
C
A
D
N
P
V
S
N
P
----
C
L
F
E
Y
V
Y
F
A
R
P
D
S
F
I
D
K
I
S
V
Y
S
A
R
V
N
M
G
T
K
L
G
E
K
I
A
R
E
W
E
-
D
L
D
I
D
V
V
I
P
I
P
E
T
S
C
D
I
A
L
E
I
A
R
I
L
G
K
P
Y
R
Q
G
F
V
K
N
R
Y
V
G
R
T
F
I
M
P
G
Q
-------
Q
L
R
R
K
S
V
R
R
K
L
N
A
N
R
A
E
F
R
D
K
N
V
L
L
V
D
D
S
I
V
R
G
T
T
S
E
Q
I
I
E
M
A
R
E
A
G
A
K
K
V
Y
L
A
S
A
A
P
E
----
I
R
F
-
P
N
V
Y
G
I
D
M
P
S
A
T
E
L
I
A
H
G
R
E
V
D
E
I
R
Q
I
I
G
A
D
G
L
I
F
Q
D
L
N
D
L
I
D
A
V
R
A
E
N
P
-
D
I
Q
Q
F
E
C
S
V
F
N
G
V
Y
V
T
K
D
V
D
Q
G
Y
L
D
F
L
D
T
L
R
N
D
D
A
K
A
V
Q
---------------------
25
PsiBlast_CBE
74.90
63%
-37
- C6 -
-
1ECB
3
PUR1_ECOLI
D:
[1-481]
-
C
G
I
V
G
I
A
G
V
M
P
V
N
Q
S
I
Y
D
A
L
T
V
L
Q
H
R
G
Q
D
A
A
G
I
I
T
I
-
D
A
-
N
N
C
F
R
L
R
K
A
N
G
L
V
S
D
V
F
E
A
R
H
M
Q
R
L
Q
G
N
M
G
I
G
H
V
R
Y
P
T
A
G
S
S
S
A
S
E
A
Q
P
F
Y
V
N
S
P
Y
G
I
T
L
A
H
N
G
N
L
T
N
A
H
E
L
R
K
K
L
F
E
E
-
K
R
R
H
I
N
T
T
S
D
S
E
I
L
L
N
I
F
A
S
E
L
D
N
F
R
H
Y
P
L
E
A
D
N
I
F
A
A
I
A
A
T
N
R
L
I
R
G
A
Y
A
C
V
A
M
I
I
--
G
H
G
M
V
A
F
R
D
P
N
G
I
R
P
L
V
L
G
K
R
D
I
D
E
N
R
T
E
Y
M
V
A
S
E
S
V
A
L
D
T
L
G
F
D
F
L
R
D
V
A
P
G
E
A
I
Y
I
T
E
E
G
Q
L
F
T
-
R
Q
C
A
D
N
P
V
S
N
P
----
C
L
F
E
Y
V
Y
F
A
R
P
D
S
F
I
D
K
I
S
V
Y
S
A
R
V
N
M
G
T
K
L
G
E
K
I
A
R
E
W
-
E
D
L
D
I
D
V
V
I
P
I
P
E
T
S
C
D
I
A
L
E
I
A
R
I
L
G
K
P
Y
R
Q
G
F
V
K
N
R
Y
V
G
R
T
F
I
M
---------------
S
V
R
R
K
L
N
A
N
R
A
E
F
R
D
K
N
V
L
L
V
D
D
S
I
V
R
G
T
T
S
E
Q
I
I
E
M
A
R
E
A
G
A
K
K
V
Y
L
A
S
A
A
P
E
----
I
R
F
-
P
N
V
Y
G
I
D
M
P
S
A
T
E
L
I
A
H
G
R
E
V
D
E
I
R
Q
I
I
G
A
D
G
L
I
F
Q
D
L
N
D
L
I
D
A
V
R
A
E
N
-
P
D
I
Q
Q
F
E
C
S
V
F
N
G
V
Y
V
T
K
D
V
D
Q
G
Y
L
D
F
L
D
T
L
------------------------------
5
PsiBlast_PDB
74.77
63%
-30
- C6 -
-
1ECJ
1
PUR1_ECOLI
A:
[1-487]
-
C
G
I
V
G
I
A
G
V
M
P
V
N
Q
S
I
Y
D
A
L
T
V
L
Q
H
R
G
Q
D
A
A
G
I
I
T
I
-
D
A
-
N
N
C
F
R
L
R
K
A
N
G
L
V
S
D
V
F
E
A
R
H
M
Q
R
L
Q
G
N
M
G
I
G
H
V
R
Y
P
T
A
G
S
S
S
A
S
E
A
Q
P
F
Y
V
N
S
P
Y
G
I
T
L
A
H
N
G
N
L
T
N
A
H
E
L
R
K
K
L
F
E
E
-
K
R
R
H
I
N
T
T
S
D
S
E
I
L
L
N
I
F
A
S
E
L
D
N
F
R
H
Y
P
L
E
A
D
N
I
F
A
A
I
A
A
T
N
R
L
I
R
G
A
Y
A
C
V
A
M
I
I
--
G
H
G
M
V
A
F
R
D
P
N
G
I
R
P
L
V
L
G
K
R
D
I
D
E
N
R
T
E
Y
M
V
A
S
E
S
V
A
L
D
T
L
G
F
D
F
L
R
D
V
A
P
G
E
A
I
Y
I
T
E
E
G
Q
L
F
T
-
R
Q
C
A
D
N
P
V
S
N
P
----
C
L
F
E
Y
V
Y
F
A
R
P
D
S
F
I
D
K
I
S
V
Y
S
A
R
V
N
M
G
T
K
L
G
E
K
I
A
R
E
W
-
E
D
L
D
I
D
V
V
I
P
I
P
E
T
S
C
D
I
A
L
E
I
A
R
I
L
G
K
P
Y
R
Q
G
F
V
K
N
R
Y
V
G
R
T
F
I
M
P
G
Q
-------
Q
L
R
R
K
S
V
R
R
K
L
N
A
N
R
A
E
F
R
D
K
N
V
L
L
V
D
D
S
I
V
R
G
T
T
S
E
Q
I
I
E
M
A
R
E
A
G
A
K
K
V
Y
L
A
S
A
A
P
E
----
I
R
F
-
P
N
V
Y
G
I
D
M
P
S
A
T
E
L
I
A
H
G
R
E
V
D
E
I
R
Q
I
I
G
A
D
G
L
I
F
Q
D
L
N
D
L
I
D
A
V
R
A
E
N
-
P
D
I
Q
Q
F
E
C
S
V
F
N
G
V
Y
V
T
K
D
V
D
Q
G
Y
L
D
F
L
D
T
L
R
N
D
D
A
K
------------------------
90
Fugue
74.46
62%
-26
- C6 -
-
1ECF
3
PUR1_ECOLI
A:
[1-492]
-
C
G
I
V
G
I
A
G
V
M
P
V
N
Q
S
I
Y
D
A
L
T
V
L
Q
H
R
G
Q
D
A
A
G
I
I
T
I
D
A
N
-
N
C
F
R
-
L
R
K
A
N
G
L
V
S
D
V
F
E
A
R
H
M
Q
R
L
Q
G
N
M
G
I
G
H
V
R
Y
P
T
A
G
S
S
S
A
S
E
A
Q
P
F
Y
V
N
S
P
Y
G
I
T
L
A
H
N
G
N
L
T
N
A
H
E
L
R
K
K
L
F
E
E
-
K
R
R
H
I
N
T
T
S
D
S
E
I
L
L
N
I
F
A
S
E
L
D
N
F
R
H
Y
P
L
E
A
D
N
I
F
A
A
I
A
A
T
N
R
L
I
R
G
A
Y
A
C
V
A
M
I
I
--
G
H
G
M
V
A
F
R
D
P
N
G
I
R
P
L
V
L
G
K
R
D
I
D
E
N
R
T
E
Y
M
V
A
S
E
S
V
A
L
D
T
L
G
F
D
F
L
R
D
V
A
P
G
E
A
I
Y
I
T
E
E
G
Q
L
F
T
-
R
Q
C
A
D
----
N
P
VSNP
C
L
F
E
Y
V
Y
F
A
R
P
D
S
F
I
D
K
I
S
V
Y
S
A
R
V
N
M
G
T
K
L
G
E
K
I
A
R
E
-
W
E
D
L
D
I
D
V
V
I
P
I
P
E
T
S
C
D
I
A
L
E
I
A
R
I
L
G
K
P
Y
R
Q
G
F
V
K
N
R
Y
V
G
R
T
F
I
M
P
G
Q
QLRRKSV
R
-------
R
K
L
N
A
N
R
A
E
F
R
D
K
N
V
L
L
V
D
D
S
I
V
R
G
T
T
S
E
Q
I
I
E
M
A
R
E
A
G
A
K
K
V
Y
L
A
S
A
A
P
E
----
I
R
F
-
P
N
V
Y
G
I
D
M
P
S
A
T
E
L
I
A
H
G
R
E
V
D
E
I
R
Q
I
I
G
A
D
G
L
I
F
Q
D
L
N
D
L
I
D
A
V
R
A
E
N
P
-
D
I
Q
Q
F
E
C
S
V
F
N
G
V
Y
V
T
K
D
V
D
Q
G
Y
L
D
F
L
D
T
L
R
N
D
D
A
K
A
V
Q
R
Q
-------------------
27
PsiBlast_CBE
74.12
63%
-36
- C6 -
-
1ECB
3
PUR1_ECOLI
B:
[1-478]
-
C
G
I
V
G
I
A
G
V
M
P
V
N
Q
S
I
Y
D
A
L
T
V
L
Q
H
R
G
Q
D
A
A
G
I
I
T
I
-
D
A
-
N
N
C
F
R
L
R
K
A
N
G
L
V
S
D
V
F
E
A
R
H
M
Q
R
L
Q
G
N
M
G
I
G
H
V
R
Y
P
T
A
G
S
S
S
A
S
E
A
Q
P
F
Y
V
N
S
P
Y
G
I
T
L
A
H
N
G
N
L
T
N
A
H
E
L
R
K
K
L
F
E
E
-
K
R
R
H
I
N
T
T
S
D
S
E
I
L
L
N
I
F
A
S
E
L
D
N
F
R
H
Y
P
L
E
A
D
N
I
F
A
A
I
A
A
T
N
R
L
I
R
G
A
Y
A
C
V
A
M
I
I
--
G
H
G
M
V
A
F
R
D
P
N
G
I
R
P
L
V
L
G
K
R
D
I
D
E
N
R
T
E
Y
M
V
A
S
E
S
V
A
L
D
T
L
G
F
D
F
L
R
D
V
A
P
G
E
A
I
Y
I
T
E
E
G
Q
L
F
T
-
R
Q
C
A
D
N
P
V
S
N
P
----
C
L
F
E
Y
V
Y
F
A
R
P
D
S
F
I
D
K
I
S
V
Y
S
A
R
V
N
M
G
T
K
L
G
E
K
I
A
R
E
W
-
E
D
L
D
I
D
V
V
I
P
I
P
E
T
S
C
D
I
A
L
E
I
A
R
I
L
G
K
P
Y
R
Q
G
F
V
K
N
R
Y
V
G
R
T
F
I
M
---------------
S
V
R
R
K
L
N
A
N
R
A
E
F
R
D
K
N
V
L
L
V
D
D
S
I
V
R
G
T
T
S
E
Q
I
I
E
M
A
R
E
A
G
A
K
K
V
Y
L
A
S
A
A
P
E
----
I
R
F
-
P
N
V
Y
G
I
D
M
P
S
A
T
E
L
I
A
H
G
R
E
V
D
E
I
R
Q
I
I
G
A
D
G
L
I
F
Q
D
L
N
D
L
I
D
A
V
R
A
E
N
-
P
D
I
Q
Q
F
E
C
S
V
F
N
G
V
Y
V
T
K
D
V
D
Q
G
Y
L
D
F
L
---------------------------------
3
PsiBlast_PDB
74.10
63%
-36
- C6 -
-
1ECB
3
PUR1_ECOLI
A:
[1-481]
-
C
G
I
V
G
I
A
G
V
M
P
V
N
Q
S
I
Y
D
A
L
T
V
L
Q
H
R
G
Q
D
A
A
G
I
I
T
I
-
D
A
-
N
N
C
F
R
L
R
K
A
N
G
L
V
S
D
V
F
E
A
R
H
M
Q
R
L
Q
G
N
M
G
I
G
H
V
R
Y
P
T
A
G
S
S
S
A
S
E
A
Q
P
F
Y
V
N
S
P
Y
G
I
T
L
A
H
N
G
N
L
T
N
A
H
E
L
R
K
K
L
F
E
E
-
K
R
R
H
I
N
T
T
S
D
S
E
I
L
L
N
I
F
A
S
E
L
D
N
F
R
H
Y
P
L
E
A
D
N
I
F
A
A
I
A
A
T
N
R
L
I
R
G
A
Y
A
C
V
A
M
I
I
--
G
H
G
M
V
A
F
R
D
P
N
G
I
R
P
L
V
L
G
K
R
D
I
D
E
N
R
T
E
Y
M
V
A
S
E
S
V
A
L
D
T
L
G
F
D
F
L
R
D
V
A
P
G
E
A
I
Y
I
T
E
E
G
Q
L
F
T
-
R
Q
C
A
D
N
P
V
S
N
P
----
C
L
F
E
Y
V
Y
F
A
R
P
D
S
F
I
D
K
I
S
V
Y
S
A
R
V
N
M
G
T
K
L
G
E
K
I
A
R
E
W
-
E
D
L
D
I
D
V
V
I
P
I
P
E
T
S
C
D
I
A
L
E
I
A
R
I
L
G
K
P
Y
R
Q
G
F
V
K
N
R
Y
V
G
R
T
F
I
M
P
-------------
K
S
V
R
R
K
L
N
A
N
R
A
E
F
R
D
K
N
V
L
L
V
D
D
S
I
V
R
G
T
T
S
E
Q
I
I
E
M
A
R
E
A
G
A
K
K
V
Y
L
A
S
A
A
P
E
----
I
R
F
-
P
N
V
Y
G
I
D
M
P
S
A
T
E
L
I
A
H
G
R
E
V
D
E
I
R
Q
I
I
G
A
D
G
L
I
F
Q
D
L
N
D
L
I
D
A
V
R
A
E
N
-
P
D
I
Q
Q
F
E
C
S
V
F
N
G
V
Y
V
T
K
D
V
D
Q
G
Y
L
D
F
L
D
T
L
------------------------------
15
PsiBlast_PDB
40.72
38%
-198
- C5 -
-
5T3O
-
?
A:
[207-245]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
V
E
G
K
T
A
L
I
V
D
D
E
I
S
T
A
G
S
L
V
E
A
V
E
A
L
M
Q
A
G
A
K
E
V
Y
A
A
A
---------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
35.38
22%
-125
- C5 -
-
3NAG
-
KPRS_THEVO
A:
[132-238]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
K
V
K
F
S
D
L
H
A
N
D
A
I
V
R
Y
Y
K
N
V
D
V
D
Y
V
V
S
P
D
D
G
G
L
A
R
V
A
D
I
S
A
K
L
G
K
K
-------------
H
F
F
I
E
K
K
-------
R
I
D
D
R
T
V
E
M
K
V
P
N
V
D
V
--
N
G
K
K
L
L
I
V
D
D
I
I
S
T
G
G
T
I
A
K
S
S
G
L
L
R
E
K
G
A
S
K
I
Y
V
S
A
---------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
34.87
22%
-129
- C5 -
-
3LRT
-
KPRS_THEVO
A:
[132-238]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
K
V
K
F
S
D
L
H
A
N
D
A
I
V
R
Y
Y
K
N
V
D
V
D
Y
V
V
S
P
D
D
G
G
L
A
R
V
A
D
I
S
A
K
L
G
K
K
-------------
H
F
F
I
E
K
K
-------
R
I
D
D
R
T
V
E
M
K
V
P
N
V
D
V
--
N
G
K
K
L
L
I
V
D
D
I
I
S
T
G
G
T
I
A
K
S
S
G
L
L
R
E
K
G
A
S
K
I
Y
V
S
A
---------------------------------------------------------------------------------------------------------------------------
58
PsiBlast_CBE
34.77
36%
-139
- C5 -
-
4RAD
1
HPRT_HUMAN
F:
[126-185]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
K
N
V
L
I
V
E
D
I
I
D
T
G
K
T
M
Q
T
L
L
S
L
V
R
Q
Y
N
P
K
M
V
K
V
A
S
L
L
V
K
RTPR--
Y
K
P
D
F
V
G
F
E
I
P
D
K
----------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
33.14
22%
-128
- C5 -
-
3LPN
-
KPRS_THEVO
A:
[132-238]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
K
V
K
F
S
D
L
H
A
N
D
A
I
V
R
Y
Y
K
N
V
D
V
D
Y
V
V
S
P
D
D
G
G
L
A
R
V
A
D
I
S
A
K
L
G
K
K
-------------
H
F
F
I
E
K
K
-------
R
I
D
D
R
T
V
E
M
K
V
P
N
V
D
V
--
N
G
K
K
L
L
I
V
D
D
I
I
S
T
G
G
T
I
A
K
S
S
G
L
L
R
E
K
G
A
S
K
I
Y
V
S
A
---------------------------------------------------------------------------------------------------------------------------
105
HHSearch
32.05
27%
-47
- C6 -
-
1JXA
-
GLMS_ECOLI
C:
[1-223]
-
C
G
I
V
G
A
I
A
Q
R
D
V
A
E
I
L
L
E
G
L
R
R
L
E
Y
R
G
Y
D
S
A
G
L
A
V
V
-
D
A
E
G
H
M
T
-
R
L
R
R
L
G
K
V
Q
M
L
A
Q
A
A
E
E
H
P
L
H
G
G
T
G
I
A
H
T
R
W
A
T
H
G
E
P
S
E
V
N
A
H
P
H
V
S
---
E
H
I
V
V
V
H
N
G
I
I
E
N
H
E
P
L
R
E
E
L
K
A
R
-
G
Y
-
T
F
V
S
E
T
D
T
E
V
I
A
H
L
V
N
W
E
L
K
Q
G
G
-------
T
L
R
E
A
V
L
R
A
I
P
Q
L
R
G
A
Y
G
T
V
I
M
D
S
RH
P
D
T
L
L
A
A
R
S
G
---
S
P
L
V
I
G
L
G
M
-----
G
E
N
F
I
A
S
D
Q
L
A
L
L
P
V
T
-
R
R
F
I
F
L
E
E
G
D
I
A
E
I
T
R
R
S
-
V
N
I
-
F
D
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------