@TOME V2.3
(Nov 2016)
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 : Rv0014c: (2016-04-18 )
MTTPSHLSDRYELGEILGFGGMSEVHLARDLRLHRDVAVKVLRADLARDPSFYLRFRREAQNAAALNHPAIVAVYDTGEAETPAGPLPYIVMEYVDGVTLRDIVHTEGPMTPKRAIEVIADACQALNFSHQNGIIHRDVKPANIMISATNAVKVMDFGIARAIADSGNSVTQTAAVIGTAQYLSPEQARGDSVDARSDVYSLGCVLYEVLTGEPPFTGDSPVSVAYQHVREDPIPPSARHEGLSADLDAVVLKALAKNPENRYQTAAEMRADLVRVHNGEPPEAPKVLTDAERTSLLSSAAGNLSGPRTDPLPRQDLDDTDRDRSIGSVGRWVAVVAVLAVLTVVVTIAINTFGGITRDVQVPDVRGQSSADAIATLQNRGFKIRTLQKPDSTIPPDHVIGTDPAANTSVSAGDEITVNVSTGPEQREIPDVSTLTYAEAVKKLTAAGFGRFKQANSPSTPELVGKVIGTNPPANQTSAITNVVIIIVGSGPATKDIPDVAGQTVDVAQKNLNVYGFTKFSQASVDSPRPAGEVTGTNPPAGTTVPVDSVIELQVSKGNQFVMPDLSGMFWVDAEPRLRALGWTGMLDKGADVDAGGSQHNRVVYQNPPAGTGVNRDGIITLRFGQ
Atome Classification :
(25 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....
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MT
T
P
S
H
L
S
D
R
Y
E
L
G
E
I
LGFGGM
S
E
V
H
L
A
R
D
L
R
L
H
R
D
V
A
V
K
V
L
--
R
A
D
LARD
P
S
F
Y
L
R
F
R
R
EAQNAAALNH
P
A
I
V
A
V
Y
DTGEAETPAGP
L
P
Y
I
V
M
E
YVDGV
T
L
R
D
I
VHT-EGPM
T
P
K
R
A
I
E
V
I
A
D
A
C
Q
ALNFSHQNG
I
I
H
RDVKP
A
N
I
M
I
SA--T
N
A
---
V
K
V
M
D
F
G
I
A
R
A
I
ADSGNS
V
T
Q
T
A
A
V
I
GTAQYL
S
P
E
QARGDSV-DARS
D
V
Y
S
L
G
C
V
L
Y
E
V
LTGEPPFTGDS
P
V
S
V
A
Y
Q
H
V
REDPIP--
P
S
A
RHEGLSA
D
L
D
A
V
V
L
K
A
L
AKNP
E
N
R
Y
Q
T
A
A
E
M
R
A
D
L
V
R
VHNGEPPEAP
K
V
L
T
D
A
E
R
T
S
L
L
S
S
AAGNLSGPRTDPLPRQDLDDTDRDRSI
G
S
V
G
R
W
V
A
V
V
A
V
L
A
V
L
T
V
V
V
T
I
A
I
NTFGGITRDVQVPDVRGQSS
A
D
A
I
A
T
L
QNR
G
F
K
I
R
T
LQKPDSTIPPDHVIGTDPAANTSVSAG
D
E
I
T
V
NVSTGPEQREIPDV
S
T
L
T
Y
A
E
A
V
K
K
L
T
A
AGFGRFKQANSPS
T
P
E
L
V
G
K
V
IGTNPPANQTSA
I
T
N
V
V
I
I
I
VGSGPATKDIPDVAGQ
T
V
D
V
A
QKNL
N
V
Y
G
F
T
KFSQASVDSPRPAGEVTGTNPPAGTTVPV
D
S
V
I
E
L
Q
VSKG
N
Q
F
V
MPDLS
G
M
F
W
VDAEP
R
L
R
ALGWTGMLDKGADVDAGGSQH
N
R
V
V
Y
QNPPAGTGVNRD
G
I
I
T
L
R
FGQ
6
PsiBlast_PDB
89.83
99%
-95
- C2 -
3F61
5
PKNB_MYCTU
A:
[4-293]
M
T
T
P
S
H
L
S
D
R
Y
E
L
G
E
I
L
G
F
G
G
M
S
E
V
H
L
A
R
D
L
R
D
H
R
D
V
A
V
K
V
L
--
R
A
D
L
A
R
D
P
S
F
Y
L
R
F
R
R
E
A
Q
N
A
A
A
L
N
H
P
A
I
V
A
V
Y
D
T
G
E
A
E
T
P
A
G
P
L
P
Y
I
V
M
E
Y
V
D
G
V
T
L
R
D
I
V
H
T
-
E
G
P
M
T
P
K
R
A
I
E
V
I
A
D
A
C
Q
A
L
N
F
S
H
Q
N
G
I
I
H
R
D
V
K
P
A
N
I
M
I
S
A
--
T
N
A
---
V
K
V
M
D
F
G
I
A
-------------------
A
Q
Y
L
S
P
E
Q
A
R
G
D
S
V
-
D
A
R
S
D
V
Y
S
L
G
C
V
L
Y
E
V
L
T
G
E
P
P
F
T
G
D
S
P
D
S
V
A
Y
Q
H
V
R
E
D
P
I
P
--
P
S
A
R
H
E
G
L
S
A
D
L
D
A
V
V
L
K
A
L
A
K
N
P
E
N
R
Y
Q
T
A
A
E
M
R
A
D
L
V
R
V
H
N
G
E
P
P
E
A
P
K
V
L
T
D
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
89.22
99%
-92
- C2 -
3ORK
3
?
A:
[4-293]
M
T
T
P
S
H
L
S
D
R
Y
E
L
G
E
I
L
G
F
G
G
M
S
E
V
H
L
A
R
D
L
R
D
H
R
D
V
A
V
K
V
L
--
R
A
D
L
A
R
D
P
S
F
Y
L
R
F
R
R
E
A
Q
N
A
A
A
L
N
H
P
A
I
V
A
V
Y
D
T
G
E
A
E
T
P
A
G
P
L
P
Y
I
V
M
E
Y
V
D
G
V
T
L
R
D
I
V
H
T
-
E
G
P
M
T
P
K
R
A
I
E
V
I
A
D
A
C
Q
A
L
N
F
S
H
Q
N
G
I
I
H
R
D
V
K
P
A
N
I
M
I
S
A
--
T
N
A
---
V
K
V
M
D
F
G
I
A
------------------
T
A
Q
Y
L
S
P
E
Q
A
R
G
D
S
V
-
D
A
R
S
D
V
Y
S
L
G
C
V
L
Y
E
V
L
T
G
E
P
P
F
T
G
D
S
P
V
S
V
A
Y
Q
H
V
R
E
D
P
I
P
--
P
S
A
R
H
E
G
L
S
A
D
L
D
A
V
V
L
K
A
L
A
K
N
P
E
N
R
Y
Q
T
A
A
E
M
R
A
D
L
V
R
V
H
N
G
E
P
P
E
A
P
K
V
L
T
D
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
87.89
99%
-88
- C2 -
3ORP
1
?
A:
[4-293]
M
T
T
P
S
H
L
S
D
R
Y
E
L
G
E
I
L
G
F
G
G
M
S
E
V
H
L
A
R
D
L
R
D
H
R
D
V
A
V
K
V
L
--
R
A
D
L
A
R
D
P
S
F
Y
L
R
F
R
R
E
A
Q
N
A
A
A
L
N
H
P
A
I
V
A
V
Y
D
T
G
E
A
E
T
P
A
G
P
L
P
Y
I
V
M
E
Y
V
D
G
V
T
L
R
D
I
V
H
T
-
E
G
P
M
T
P
K
R
A
I
E
V
I
A
D
A
C
Q
A
L
N
F
S
H
Q
N
G
I
I
H
R
D
V
K
P
A
N
I
M
I
S
A
--
T
N
A
---
V
K
V
M
D
F
G
I
A
----------------
I
G
T
A
Q
Y
L
S
P
E
Q
A
R
G
D
S
V
-
D
A
R
S
D
V
Y
S
L
G
C
V
L
Y
E
V
L
T
G
E
P
P
F
T
G
D
S
P
V
S
V
A
Y
Q
H
V
R
E
D
P
I
P
--
P
S
A
R
H
E
G
L
S
A
D
L
D
A
V
V
L
K
A
L
A
K
N
P
E
N
R
Y
Q
T
A
A
E
M
R
A
D
L
V
R
V
H
N
G
E
P
P
E
A
P
K
V
L
T
D
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
87.69
99%
-88
- C2 -
3ORT
2
?
A:
[4-292]
M
T
T
P
S
H
L
S
D
R
Y
E
L
G
E
I
L
G
F
G
G
M
S
E
V
H
L
A
R
D
L
R
D
H
R
D
V
A
V
K
V
L
--
R
A
D
L
A
R
D
P
S
F
Y
L
R
F
R
R
E
A
Q
N
A
A
A
L
N
H
P
A
I
V
A
V
Y
D
T
G
E
A
E
T
P
A
G
P
L
P
Y
I
V
M
E
Y
V
D
G
V
T
L
R
D
I
V
H
T
-
E
G
P
M
T
P
K
R
A
I
E
V
I
A
D
A
C
Q
A
L
N
F
S
H
Q
N
G
I
I
H
R
D
V
K
P
A
N
I
M
I
S
A
--
T
N
A
---
V
K
V
M
D
F
G
I
A
R
------------------
A
Q
Y
L
S
P
E
Q
A
R
G
D
S
V
-
D
A
R
S
D
V
Y
S
L
G
C
V
L
Y
E
V
L
T
G
E
P
P
F
T
G
D
S
P
V
S
V
A
Y
Q
H
V
R
E
D
P
I
P
--
P
S
A
R
H
E
G
L
S
A
D
L
D
A
V
V
L
K
A
L
A
K
N
P
E
N
R
Y
Q
T
A
A
E
M
R
A
D
L
V
R
V
H
N
G
E
P
P
E
A
P
K
V
L
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
87.53
99%
-90
- C2 -
3ORO
2
?
A:
[12-291]
--------
D
R
Y
E
L
G
E
I
L
G
F
G
G
M
S
E
V
H
L
A
R
D
L
R
D
H
R
D
V
A
V
K
V
L
--
R
A
D
L
A
R
D
P
S
F
Y
L
R
F
R
R
E
A
Q
N
A
A
A
L
N
H
P
A
I
V
A
V
Y
D
T
G
E
A
E
T
P
A
G
P
L
P
Y
I
V
M
E
Y
V
D
G
V
T
L
R
D
I
V
H
T
-
E
G
P
M
T
P
K
R
A
I
E
V
I
A
D
A
C
Q
A
L
N
F
S
H
Q
N
G
I
I
H
R
D
V
K
P
A
N
I
M
I
S
A
--
T
N
A
---
V
K
V
M
D
F
G
I
A
R
A
I
A
--------
T
A
A
V
I
G
T
A
Q
Y
L
S
P
E
Q
A
R
G
D
S
V
-
D
A
R
S
D
V
Y
S
L
G
C
V
L
Y
E
V
L
T
G
E
P
P
F
T
G
D
S
P
V
S
V
A
Y
Q
H
V
R
E
D
P
I
P
--
P
S
A
R
H
E
G
L
S
A
D
L
D
A
V
V
L
K
A
L
A
K
N
P
E
N
R
Y
Q
T
A
A
E
M
R
A
D
L
V
R
V
H
N
G
E
P
P
E
A
P
K
V
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
87.48
100%
-95
- C2 -
1O6Y
3
PKNB_MYCTU
A:
[23-298]
--
T
P
S
H
L
S
D
R
Y
E
L
G
E
I
L
G
F
G
G
M
S
E
V
H
L
A
R
D
L
R
L
H
R
D
V
A
V
K
V
L
--
R
A
D
L
A
R
D
P
S
F
Y
L
R
F
R
R
E
A
Q
N
A
A
A
L
N
H
P
A
I
V
A
V
Y
D
T
G
E
A
E
T
P
A
G
P
L
P
Y
I
V
M
E
Y
V
D
G
V
T
L
R
D
I
V
H
T
-
E
G
P
M
T
P
K
R
A
I
E
V
I
A
D
A
C
Q
A
L
N
F
S
H
Q
N
G
I
I
H
R
D
V
K
P
A
N
I
M
I
S
A
--
T
N
A
---
V
K
V
M
D
F
G
I
A
R
A
I
A
----------------
Q
Y
L
S
P
E
Q
A
R
G
D
S
V
-
D
A
R
S
D
V
Y
S
L
G
C
V
L
Y
E
V
L
T
G
E
P
P
F
T
G
D
S
P
V
S
V
A
Y
Q
H
V
R
E
D
P
I
P
--
P
S
A
R
H
E
G
L
S
A
D
L
D
A
V
V
L
K
A
L
A
K
N
P
E
N
R
Y
Q
T
A
A
E
M
R
A
D
L
V
R
V
H
N
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
86.21
100%
-89
- C2 -
2FUM
1
PKNB_MYCTU
A:
[23-297]
--
T
P
S
H
L
S
D
R
Y
E
L
G
E
I
L
G
F
G
G
M
S
E
V
H
L
A
R
D
L
R
L
H
R
D
V
A
V
K
V
L
--
R
A
D
L
A
R
D
P
S
F
Y
L
R
F
R
R
E
A
Q
N
A
A
A
L
N
H
P
A
I
V
A
V
Y
D
T
G
E
A
E
T
P
A
G
P
L
P
Y
I
V
M
E
Y
V
D
G
V
T
L
R
D
I
V
H
T
-
E
G
P
M
T
P
K
R
A
I
E
V
I
A
D
A
C
Q
A
L
N
F
S
H
Q
N
G
I
I
H
R
D
V
K
P
A
N
I
M
I
S
A
--
T
N
A
---
V
K
V
M
D
F
G
I
A
R
A
I
A
D
------------
G
T
A
Q
Y
L
S
P
E
Q
A
R
G
D
S
V
-
D
A
R
S
D
V
Y
S
L
G
C
V
L
Y
E
V
L
T
G
E
P
P
F
T
G
D
S
P
V
S
V
A
Y
Q
H
V
R
E
D
P
I
P
--
P
S
A
R
H
E
G
L
S
A
D
L
D
A
V
V
L
K
A
L
A
K
N
P
E
N
R
Y
Q
T
A
A
E
M
R
A
D
L
V
R
V
H
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
85.86
100%
-99
- C2 -
2FUM
1
PKNB_MYCTU
C:
[23-298]
--
T
P
S
H
L
S
D
R
Y
E
L
G
E
I
L
G
F
G
G
M
S
E
V
H
L
A
R
D
L
R
L
H
R
D
V
A
V
K
V
L
--
R
A
D
L
A
R
D
P
S
F
Y
L
R
F
R
R
E
A
Q
N
A
A
A
L
N
H
P
A
I
V
A
V
Y
D
T
G
E
A
E
T
P
A
G
P
L
P
Y
I
V
M
E
Y
V
D
G
V
T
L
R
D
I
V
H
T
-
E
G
P
M
T
P
K
R
A
I
E
V
I
A
D
A
C
Q
A
L
N
F
S
H
Q
N
G
I
I
H
R
D
V
K
P
A
N
I
M
I
S
A
--
T
N
A
---
V
K
V
M
D
F
----------------------
A
Q
Y
L
S
P
E
Q
A
R
G
D
S
V
-
D
A
R
S
D
V
Y
S
L
G
C
V
L
Y
E
V
L
T
G
E
P
P
F
T
G
D
S
P
V
S
V
A
Y
Q
H
V
R
E
D
P
I
P
--
P
S
A
R
H
E
G
L
S
A
D
L
D
A
V
V
L
K
A
L
A
K
N
P
E
N
R
Y
Q
T
A
A
E
M
R
A
D
L
V
R
V
H
N
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
84.93
99%
-91
- C2 -
3ORM
2
?
A:
[13-292]
---------
R
Y
E
L
G
E
I
L
G
F
G
G
M
S
E
V
H
L
A
R
D
L
R
L
H
R
D
V
A
V
K
V
L
--
R
A
D
L
A
R
D
P
S
F
Y
L
R
F
R
R
E
A
Q
N
A
A
A
L
N
H
P
A
I
V
A
V
Y
A
T
G
E
A
E
T
P
A
G
P
L
P
Y
I
V
M
E
Y
V
D
G
V
T
L
R
D
I
V
H
T
-
E
G
P
M
T
P
K
R
A
I
E
V
I
A
D
A
C
Q
A
L
N
F
S
H
Q
N
G
I
I
H
R
D
V
K
P
A
N
I
M
I
S
A
--
T
N
A
---
V
K
V
M
D
F
G
I
A
R
A
I
A
--------------
T
A
Q
Y
L
S
P
E
Q
A
R
G
D
S
V
-
D
A
R
S
D
V
Y
S
L
G
C
V
L
Y
E
V
L
T
G
E
P
P
F
T
G
D
S
P
V
S
V
A
Y
Q
H
V
R
E
D
P
I
P
--
P
S
A
R
H
E
G
L
S
A
D
L
D
A
V
V
L
K
A
L
A
K
N
P
E
N
R
Y
Q
T
A
A
E
M
R
A
D
L
V
R
V
H
N
G
E
P
P
E
A
P
K
V
L
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
68.33
100%
-63
* C5 *
2KUI
-
PKNB_MYCTU
A:
[355-626]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
I
T
R
D
V
Q
V
P
D
V
R
G
Q
S
S
A
D
A
I
A
T
L
Q
N
R
G
F
K
I
R
T
L
Q
K
P
D
S
T
I
P
P
D
H
V
I
G
T
D
P
A
A
N
T
S
V
S
A
G
D
E
I
T
V
N
V
S
T
G
P
E
Q
R
E
I
P
D
V
S
T
L
T
Y
A
E
A
V
K
K
L
T
A
A
G
F
G
R
F
K
Q
A
N
S
P
S
T
P
E
L
V
G
K
V
I
G
T
N
P
P
A
N
Q
T
S
A
I
T
N
V
V
I
I
I
V
G
S
G
P
A
T
K
D
I
P
D
V
A
G
Q
T
V
D
V
A
Q
K
N
L
N
V
Y
G
F
T
K
F
S
Q
A
S
V
D
S
P
R
P
A
G
E
V
T
G
T
N
P
P
A
G
T
T
V
P
V
D
S
V
I
E
L
Q
V
S
K
G
N
Q
F
V
M
P
D
L
S
G
M
F
W
V
D
A
E
P
R
L
R
A
L
G
W
T
G
M
L
D
K
G
A
D
V
D
A
G
G
S
Q
H
N
R
V
V
Y
Q
N
P
P
A
G
T
G
V
N
R
D
G
I
I
T
L
R
F
G
Q
55
HHSearch
67.93
100%
-63
- C5 -
2KUI
-
PKNB_MYCTU
A:
[357-626]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
T
R
D
V
Q
V
P
D
V
R
G
Q
S
S
A
D
A
I
A
T
L
Q
N
R
G
F
K
I
R
T
L
Q
K
P
D
S
T
I
P
P
D
H
V
I
G
T
D
P
A
A
N
T
S
V
S
A
G
D
E
I
T
V
N
V
S
T
G
P
E
Q
R
E
I
P
D
V
S
T
L
T
Y
A
E
A
V
K
K
L
T
A
A
G
F
G
R
F
K
Q
A
N
S
P
S
T
P
E
L
V
G
K
V
I
G
T
N
P
P
A
N
Q
T
S
A
I
T
N
V
V
I
I
I
V
G
S
G
P
A
T
K
D
I
P
D
V
A
G
Q
T
V
D
V
A
Q
K
N
L
N
V
Y
G
F
T
K
F
S
Q
A
S
V
D
S
P
R
P
A
G
E
V
T
G
T
N
P
P
A
G
T
T
V
P
V
D
S
V
I
E
L
Q
V
S
K
G
N
Q
F
V
M
P
D
L
S
G
M
F
W
V
D
A
E
P
R
L
R
A
L
G
W
T
G
M
L
D
K
G
A
D
V
D
A
G
G
S
Q
H
N
R
V
V
Y
Q
N
P
P
A
G
T
G
V
N
R
D
G
I
I
T
L
R
F
G
Q
24
PsiBlast_CBE
67.56
39%
-97
- C2 -
4EQM
1
?
D:
[9-273]
------
I
N
E
R
Y
K
I
V
D
K
L
G
G
G
G
M
S
T
V
Y
L
A
E
D
T
I
L
N
I
K
V
A
I
K
A
I
--
F
I
P
P
R
E
K
E
E
T
L
K
R
F
E
R
E
V
H
N
S
S
Q
L
S
H
Q
N
I
V
S
M
I
D
V
D
E
E
D
----
D
C
Y
Y
L
V
M
E
Y
I
E
G
P
T
L
S
E
Y
I
E
S
-
H
G
P
L
S
V
D
T
A
I
N
F
T
N
Q
I
L
D
G
I
K
H
A
H
D
M
R
I
V
H
R
D
I
K
P
Q
N
I
L
I
D
S
--
N
K
T
---
L
K
I
F
D
F
G
I
A
K
-----------------
T
V
Q
Y
F
S
P
E
Q
A
K
G
E
A
T
-
D
E
C
T
D
I
Y
S
I
G
I
V
L
Y
E
M
L
V
G
E
P
P
F
N
G
E
T
A
V
S
I
A
I
K
H
I
-
Q
D
S
V
P
NV
T
T
D
V
R
K
D
I
P
Q
S
L
S
N
V
I
L
R
A
T
E
K
D
K
A
N
R
Y
K
T
I
Q
E
M
K
D
D
L
S
S
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
67.09
41%
-76
- C2 -
4OW8
2
PKNA_MYCTU
A:
[9-283]
------
L
S
G
R
Y
R
L
Q
R
L
I
A
T
G
G
M
G
Q
V
W
E
A
V
D
N
R
L
G
R
R
V
A
V
K
V
L
--
K
S
E
F
S
S
D
P
E
F
I
E
R
F
R
A
E
A
R
T
T
A
M
L
N
H
P
G
I
A
S
V
H
D
Y
G
E
S
Q
----
R
T
A
Y
L
V
M
E
L
V
N
G
E
P
L
N
S
V
L
K
R
-
T
G
R
L
S
L
R
H
A
L
D
M
L
E
Q
T
G
R
A
L
Q
I
A
H
A
A
G
L
V
H
R
D
V
K
P
G
N
I
L
I
T
P
--
T
G
Q
---
V
K
I
T
D
F
G
I
A
K
A
V
--
D
A
A
P
V
T
Q
T
G
M
V
M
G
T
A
Q
Y
I
A
P
E
Q
A
L
G
H
D
A
-
S
P
A
S
D
V
Y
S
L
G
V
V
G
Y
E
A
V
S
G
K
R
P
F
A
G
D
G
A
L
T
V
A
M
K
H
I
K
E
P
P
P
P
--
L
P
P
D
---
L
P
P
N
V
R
E
L
I
E
I
T
L
V
K
N
P
A
M
R
Y
R
S
G
G
P
F
A
D
A
V
A
A
V
R
A
G
R
R
P
P
R
P
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
66.87
39%
-95
- C2 -
4EQM
1
?
F:
[9-273]
------
I
N
E
R
Y
K
I
V
D
K
L
G
G
G
G
M
S
T
V
Y
L
A
E
D
T
I
L
N
I
K
V
A
I
K
A
I
--
F
I
P
P
R
E
K
E
E
T
L
K
R
F
E
R
E
V
H
N
S
S
Q
L
S
H
Q
N
I
V
S
M
I
D
V
D
E
E
D
----
D
C
Y
Y
L
V
M
E
Y
I
E
G
P
T
L
S
E
Y
I
E
S
-
H
G
P
L
S
V
D
T
A
I
N
F
T
N
Q
I
L
D
G
I
K
H
A
H
D
M
R
I
V
H
R
D
I
K
P
Q
N
I
L
I
D
S
--
N
K
T
---
L
K
I
F
D
F
G
I
A
K
-----------------
T
V
Q
Y
F
S
P
E
Q
A
K
G
E
A
T
-
D
E
C
T
D
I
Y
S
I
G
I
V
L
Y
E
M
L
V
G
E
P
P
F
N
G
E
T
A
V
S
I
A
I
K
H
I
-
Q
D
S
V
P
NV
T
T
D
V
R
K
D
I
P
Q
S
L
S
N
V
I
L
R
A
T
E
K
D
K
A
N
R
Y
K
T
I
Q
E
M
K
D
D
L
S
S
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
66.71
39%
-94
- C2 -
4EQM
1
?
E:
[9-273]
------
I
N
E
R
Y
K
I
V
D
K
L
G
G
G
G
M
S
T
V
Y
L
A
E
D
T
I
L
N
I
K
V
A
I
K
A
I
--
F
I
P
P
R
E
K
E
E
T
L
K
R
F
E
R
E
V
H
N
S
S
Q
L
S
H
Q
N
I
V
S
M
I
D
V
D
E
E
D
----
D
C
Y
Y
L
V
M
E
Y
I
E
G
P
T
L
S
E
Y
I
E
S
-
H
G
P
L
S
V
D
T
A
I
N
F
T
N
Q
I
L
D
G
I
K
H
A
H
D
M
R
I
V
H
R
D
I
K
P
Q
N
I
L
I
D
S
--
N
K
T
---
L
K
I
F
D
F
G
I
A
K
-----------------
T
V
Q
Y
F
S
P
E
Q
A
K
G
E
A
T
-
D
E
C
T
D
I
Y
S
I
G
I
V
L
Y
E
M
L
V
G
E
P
P
F
N
G
E
T
A
V
S
I
A
I
K
H
I
-
Q
D
S
V
P
NV
T
T
D
V
R
K
D
I
P
Q
S
L
S
N
V
I
L
R
A
T
E
K
D
K
A
N
R
Y
K
T
I
Q
E
M
K
D
D
L
S
S
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
66.00
39%
-90
- C2 -
4EQM
2
?
B:
[9-273]
------
I
N
E
R
Y
K
I
V
D
K
L
G
G
G
G
M
S
T
V
Y
L
A
E
D
T
I
L
N
I
K
V
A
I
K
A
I
--
F
I
P
P
R
E
K
E
E
T
L
K
R
F
E
R
E
V
H
N
S
S
Q
L
S
H
Q
N
I
V
S
M
I
D
V
D
E
E
D
----
D
C
Y
Y
L
V
M
E
Y
I
E
G
P
T
L
S
E
Y
I
E
S
-
H
G
P
L
S
V
D
T
A
I
N
F
T
N
Q
I
L
D
G
I
K
H
A
H
D
M
R
I
V
H
R
D
I
K
P
Q
N
I
L
I
D
S
--
N
K
T
---
L
K
I
F
D
F
G
I
A
K
A
L
---------------
T
V
Q
Y
F
S
P
E
Q
A
K
G
E
A
T
-
D
E
C
T
D
I
Y
S
I
G
I
V
L
Y
E
M
L
V
G
E
P
P
F
N
G
E
T
A
V
S
I
A
I
K
H
I
-
Q
D
S
V
P
NV
T
T
D
V
R
K
D
I
P
Q
S
L
S
N
V
I
L
R
A
T
E
K
D
K
A
N
R
Y
K
T
I
Q
E
M
K
D
D
L
S
S
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
25
PsiBlast_CBE
65.98
39%
-88
- C2 -
4EQM
2
?
C:
[9-273]
------
I
N
E
R
Y
K
I
V
D
K
L
G
G
G
G
M
S
T
V
Y
L
A
E
D
T
I
L
N
I
K
V
A
I
K
A
I
--
F
I
P
P
R
E
K
E
E
T
L
K
R
F
E
R
E
V
H
N
S
S
Q
L
S
H
Q
N
I
V
S
M
I
D
V
D
E
E
D
----
D
C
Y
Y
L
V
M
E
Y
I
E
G
P
T
L
S
E
Y
I
E
S
-
H
G
P
L
S
V
D
T
A
I
N
F
T
N
Q
I
L
D
G
I
K
H
A
H
D
M
R
I
V
H
R
D
I
K
P
Q
N
I
L
I
D
S
--
N
K
T
---
L
K
I
F
D
F
G
I
A
K
A
L
---------------
T
V
Q
Y
F
S
P
E
Q
A
K
G
E
A
T
-
D
E
C
T
D
I
Y
S
I
G
I
V
L
Y
E
M
L
V
G
E
P
P
F
N
G
E
T
A
V
S
I
A
I
K
H
I
-
Q
D
S
V
P
NV
T
T
D
V
R
K
D
I
P
Q
S
L
S
N
V
I
L
R
A
T
E
K
D
K
A
N
R
Y
K
T
I
Q
E
M
K
D
D
L
S
S
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
65.24
39%
-88
- C2 -
4EQM
2
?
A:
[9-273]
------
I
N
E
R
Y
K
I
V
D
K
L
G
G
G
G
M
S
T
V
Y
L
A
E
D
T
I
L
N
I
K
V
A
I
K
A
I
--
F
I
P
P
R
E
K
E
E
T
L
K
R
F
E
R
E
V
H
N
S
S
Q
L
S
H
Q
N
I
V
S
M
I
D
V
D
E
E
D
----
D
C
Y
Y
L
V
M
E
Y
I
E
G
P
T
L
S
E
Y
I
E
S
-
H
G
P
L
S
V
D
T
A
I
N
F
T
N
Q
I
L
D
G
I
K
H
A
H
D
M
R
I
V
H
R
D
I
K
P
Q
N
I
L
I
D
S
--
N
K
T
---
L
K
I
F
D
F
G
I
A
K
A
L
---------------
T
V
Q
Y
F
S
P
E
Q
A
K
G
E
A
T
-
D
E
C
T
D
I
Y
S
I
G
I
V
L
Y
E
M
L
V
G
E
P
P
F
N
G
E
T
A
V
S
I
A
I
K
H
I
-
Q
D
S
V
P
NV
T
T
D
V
R
K
D
I
P
Q
S
L
S
N
V
I
L
R
A
T
E
K
D
K
A
N
R
Y
K
T
I
Q
E
M
K
D
D
L
S
S
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
67
HHSearch
61.33
26%
-76
- C2 -
3UTO
2
UNC22_CAEEL
A:
[154-417]
-----
H
V
L
D
H
Y
D
I
H
E
E
L
G
T
G
A
F
G
V
V
H
R
V
T
E
R
A
T
G
N
N
F
A
A
K
F
V
--
M
T
P
H
E
---
S
D
K
E
T
V
R
K
E
I
Q
T
M
S
V
L
R
H
P
T
L
V
N
L
H
D
A
F
E
D
D
----
N
E
M
V
M
I
Y
E
F
M
S
G
G
E
L
F
E
K
V
A
D
E
H
N
K
M
S
E
D
E
A
V
E
Y
M
R
Q
V
C
K
G
L
C
H
M
H
E
N
N
Y
V
H
L
D
L
K
P
E
N
I
M
F
T
T
KR
S
N
E
---
L
K
L
I
D
F
G
L
T
A
H
L
D
P
K
Q
----
S
V
K
V
T
T
G
T
A
E
F
A
A
P
E
V
A
E
G
K
P
V
-
G
Y
Y
T
D
M
W
S
V
G
V
L
S
Y
I
L
L
S
G
L
S
P
F
G
G
E
N
D
D
E
T
L
R
N
V
K
S
C
D
W
N
M
--
D
D
S
A
F
S
G
I
S
E
D
G
K
D
F
I
R
K
L
L
L
A
D
P
N
T
R
M
T
I
H
Q
A
L
E
H
P
W
L
T
P
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
70
HHSearch
59.80
25%
-83
- C2 -
4RED
-
AAPK1_HUMAN
A:
[13-271]
-----
V
K
I
G
H
Y
I
L
G
D
T
L
G
V
G
T
F
G
K
V
K
V
G
K
H
E
L
T
G
H
A
V
A
V
K
I
L
--
N
R
Q
K
I
R
S
L
D
V
V
G
K
I
R
R
E
I
Q
N
L
K
L
F
R
H
P
H
I
I
K
L
Y
Q
V
I
S
T
P
----
S
D
I
F
M
V
M
E
Y
V
S
G
G
E
L
F
D
Y
I
C
K
-
N
G
R
L
D
E
K
E
S
R
R
L
F
Q
Q
I
L
S
G
V
D
Y
C
H
R
H
M
V
V
H
R
D
L
K
P
E
N
V
L
L
D
A
--
H
M
N
---
A
K
I
A
D
F
G
L
S
N
M
M
S
D
-------------
S
P
N
Y
A
A
P
E
V
I
S
G
R
L
Y
A
G
P
E
V
D
I
W
S
S
G
V
I
L
Y
A
L
L
C
G
T
L
P
F
D
D
D
H
V
P
T
L
F
K
K
----
I
F
Y
------
T
P
Q
Y
L
N
P
S
V
I
S
L
L
K
H
M
L
Q
V
D
P
M
K
R
A
S
I
K
D
I
R
E
H
E
W
F
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
30
PsiBlast_CBE
50.71
33%
-75
- C2 -
2PE0
6
PDPK1_HUMAN
A:
[9-209]
----------
F
K
F
G
K
I
L
G
E
G
S
F
S
T
V
V
L
A
R
E
L
A
T
S
R
E
Y
A
I
K
I
L
E
K
R
H
I
I
K
E
N
K
V
P
Y
V
T
--
R
E
R
D
V
M
S
R
L
D
H
P
F
F
V
K
L
Y
F
T
F
Q
D
D
E
K
L
----
Y
F
G
L
S
Y
A
K
N
G
E
L
L
K
Y
I
R
K
-
I
G
S
F
D
E
T
C
T
R
F
Y
T
A
E
I
V
S
A
L
E
Y
L
H
G
K
G
I
I
H
R
D
L
K
P
E
N
I
L
L
N
E
--
D
M
H
---
I
Q
I
T
D
F
G
T
A
K
V
L
--
S
---------
F
V
G
T
A
Q
Y
V
S
P
E
L
L
T
E
K
S
A
-
C
K
S
S
D
L
W
A
L
G
C
I
I
Y
Q
L
V
A
G
L
P
P
F
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
28
PsiBlast_CBE
49.89
33%
-74
- C2 -
2PE2
11
PDPK1_HUMAN
A:
[9-209]
----------
F
K
F
G
K
I
L
G
E
G
S
F
S
T
V
V
L
A
R
E
L
A
T
S
R
E
Y
A
I
K
I
L
E
K
R
H
I
I
K
E
N
K
V
P
Y
V
T
--
R
E
R
D
V
M
S
R
L
D
H
P
F
F
V
K
L
Y
F
T
F
Q
D
D
E
K
L
----
Y
F
G
L
S
Y
A
K
N
G
E
L
L
K
Y
I
R
K
-
I
G
S
F
D
E
T
C
T
R
F
Y
T
A
E
I
V
S
A
L
E
Y
L
H
G
K
G
I
I
H
R
D
L
K
P
E
N
I
L
L
N
E
--
D
M
H
---
I
Q
I
T
D
F
G
T
A
K
V
L
--
S
---------
F
V
G
T
A
Q
Y
V
S
P
E
L
L
T
E
K
S
A
-
C
K
S
S
D
L
W
A
L
G
C
I
I
Y
Q
L
V
A
G
L
P
P
F
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
29
PsiBlast_CBE
49.81
33%
-75
- C2 -
2PE1
7
PDPK1_HUMAN
A:
[9-209]
----------
F
K
F
G
K
I
L
G
E
G
S
F
S
T
V
V
L
A
R
E
L
A
T
S
R
E
Y
A
I
K
I
L
E
K
R
H
I
I
K
E
N
K
V
P
Y
V
T
--
R
E
R
D
V
M
S
R
L
D
H
P
F
F
V
K
L
Y
F
T
F
Q
D
D
E
K
L
----
Y
F
G
L
S
Y
A
K
N
G
E
L
L
K
Y
I
R
K
-
I
G
S
F
D
E
T
C
T
R
F
Y
T
A
E
I
V
S
A
L
E
Y
L
H
G
K
G
I
I
H
R
D
L
K
P
E
N
I
L
L
N
E
--
D
M
H
---
I
Q
I
T
D
F
G
T
A
K
V
L
--
S
---------
F
V
G
T
A
Q
Y
V
S
P
E
L
L
T
E
K
S
A
-
C
K
S
S
D
L
W
A
L
G
C
I
I
Y
Q
L
V
A
G
L
P
P
F
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
37
PsiBlast_CBE
49.13
31%
-84
- C2 -
4IEB
1
?
A:
[47-254]
------
F
S
D
R
Y
K
G
Q
R
V
L
G
K
G
S
F
G
E
V
I
L
C
K
D
K
I
T
G
Q
E
C
A
V
K
V
I
--
S
K
R
Q
V
---
T
D
K
E
S
L
L
R
E
V
Q
L
L
K
Q
L
D
H
P
N
I
M
K
L
Y
E
F
F
E
D
K
----
G
Y
F
Y
L
V
M
E
V
Y
T
G
G
E
L
F
D
E
I
I
S
-
R
K
R
F
S
E
V
D
A
A
R
I
I
R
Q
V
L
S
G
I
T
Y
M
H
K
N
K
I
V
H
R
D
L
K
P
E
N
L
L
L
E
S
--
K
S
K
D
A
N
I
R
I
I
D
F
G
L
S
T
H
F
E
A
S
----
K
K
M
K
D
K
I
G
T
A
Y
Y
I
A
P
E
V
L
H
G
-
T
Y
-
D
E
K
C
D
V
W
S
T
G
V
I
L
Y
I
L
L
S
G
C
P
P
F
N
G
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
35
PsiBlast_CBE
48.89
33%
-72
- C2 -
1UU3
13
PDPK1_HUMAN
A:
[32-232]
----------
F
K
F
G
K
I
L
G
E
G
S
F
S
T
V
V
L
A
R
E
L
A
T
S
R
E
Y
A
I
K
I
L
E
K
R
H
I
I
K
E
N
K
V
P
Y
V
T
--
R
E
R
D
V
M
S
R
L
D
H
P
F
F
V
K
L
Y
F
T
F
Q
D
D
E
K
L
----
Y
F
G
L
S
Y
A
K
N
G
E
L
L
K
Y
I
R
K
-
I
G
S
F
D
E
T
C
T
R
F
Y
T
A
E
I
V
S
A
L
E
Y
L
H
G
K
G
I
I
H
R
D
L
K
P
E
N
I
L
L
N
E
--
D
M
H
---
I
Q
I
T
D
F
G
T
A
K
V
L
--
S
---------
F
V
G
T
A
Q
Y
V
S
P
E
L
L
T
E
K
S
A
-
C
K
S
S
D
L
W
A
L
G
C
I
I
Y
Q
L
V
A
G
L
P
P
F
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------