@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 : B0VLQ9: (2017-11-04 )
MSFLLQATIFLGASLILVPLGKRLGIATVLGYLFTGILLGPSVLNIAHDPEAIMELAEFGVILLMFLIGLELRPQRLWEMRDSIFVMGSLQVVITGIILMLTVLLLFQQHLAASFVIGFALALSSTAFVLQLLTEKQQLNTTYGQQSFSILLFQDIAAIPLLAVITLLAGTESTHHGIAYFAAIIATFTGLFLFSRYVMRPFFRFVAKSGATELITAVGLFIILAVVLLMDTLGISTTLGAFLTGVLLADSEFRHELEASIAPFKGLLLGLFFMTVGMTTQLSLLIEMPWLIIGGAIGLLVIKTLVLTAIARYKKYSWNNSLLLGTCLAQGGEFAFVILSLAKSEKILTDALLEPVTLIVTLSMVLTPVIYWIMACKIIPLFHKELPPEYDEIPQQDNPIIIAGFGRFGQIIARIARLQHLGFTAIDNNLHQVDFVRRYGGKLYYGDVTQPDLLRSAGIEKAKVFILAIDDVEDSMNVARHLRLNYPNLKLLARARDRHHVHLLRDLGVEHIWRETYLSSLGMAYCALRELGISDEQAYNNIEIFRDYDEKLLIQQQSIYTDEQKVFETHRNALAELEHLFESDAQQASSKHDVNLKRHLQPNRIDITRDHEE
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.----------------------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
-M
S
F
L
L
Q
A
T
I
F
LG
A
S
L
I
L
V
PLGKRL
G
I
A
T
V
L
G
Y
L
F
T
G
I
LLGPS
V
L
NIAH
D
---
P
E
A
I
M
E
L
A
E
F
G
V
I
L
L
M
F
L
IGLEL
R
P
Q
R
L
-
W
E
M
R
D
S
I
F
V
MG
S
L
Q
V
V
I
T
G
I
I
L
M
L
T
V
L
L
L
F
Q
Q
--
H
L
A
A
S
F
V
I
G
F
A
L
A
L
S
S
T
A
F
V
L
Q
L
L
T
E
K
-
Q
Q
LNTTYGQ
Q
S
F
S
I
L
L
F
Q
D
I
A
A
I
P
L
L
A
V
I
T
L
LAGTEST-H--
H
-----------
G
-
I
-
A
Y
F
A
A
I
I
A
T
F
T
G
L
F
L
F
-
S
R
Y
V
M
R
-
P
F
F
R
-
F
V
A
KSG
A
T
E
L
I
T
A
V
G
L
F
I
I
L
A
V
V
L
L
M
D
T-------LGI
S
T
T
L
G
A
F
L
T
G
V
LL-----A
D
S
E
F
R
H
---------
E
L
E
AS---I----A
P
F
K
G
--
L
L
L
G
L
F
F
M
T
VG
M
T
T
Q
L
S
L
L
I
EM--
P
-
W
-
L
-
I
IG
G
A
I
G
L
L
V
I
K
T
L
V
L
T
A
I
A
R
Y
--------KKYSWNN
S
L
L
L
G
T
C
L
AQGG
E
F
A
F
V
I
L
S
L
AKSE
K
------------------
I
----------
L
T
D
A
L
LE
P
V
T
L
I
V
T
L
S
-----
M
V
-----
L
T
P
V
I
Y
W
I
M
A
C
K
I
I
P
L
F
H
K
ELPP
E
Y
D
EIPQQDN
P
I
I
I
A
G
F
G
R
F
G
Q
I
I
A
R
I
A
R
L
Q
HLG
F
T
A
IDNN
L
H
Q
V
--
D
F
V
R
-
R
YGG
K
L
Y
YGDVT
Q
P
D
L
-
L
R
SAGIE
K
A
K
V
F
I
L
A
I-D-DV
E
D
S
M
N
V
-----
A
R
H
LRLNYP
N
L
K
L
L
A
RARDR
H
H
V
H
L
L
R
D
L
G
V
E
H
I
W
-
R
E
T
Y
L
S
S
L
-
G
M
A
Y
C
A
L
R
E
LGIS
D
---
E
Q
AYNN
I
E
I
F-RDY
D
E
K
L
L
I
Q
Q
Q
SIY
T
D
E
Q
K
V
F
E
T
H
R
N
A
L
A
E
L
E
H
L
F
E
S
D
A
Q
QASSKHDV
N
L
K
RHLQPN
R
I
D
ITRDHEE----------------------------------------------------------------------------------------------------------------------------------------
31
Fugue
87.83
29%
-133
- C1 -
-
3EYW
2
KEFC_ECOLI (first)
B:
[5-411]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
R
V
I
I
A
G
F
G
R
F
G
Q
I
T
G
R
L
L
L
S
S
G
V
K
M
V
V
L
D
H
D
P
D
H
I
--
E
T
L
R
-
K
F
G
M
K
V
F
Y
G
D
A
T
R
M
D
L
-
L
E
S
A
G
A
A
K
A
E
V
L
I
N
A
I
-
D
-
D
P
Q
T
N
L
Q
L
-----
T
E
M
V
K
E
H
F
P
H
L
Q
I
I
A
R
A
R
D
V
D
H
Y
I
R
L
R
Q
A
G
V
E
K
P
E
-
R
E
T
F
E
G
A
L
-
K
T
G
R
L
A
L
E
S
L
G
L
G
P
---
Y
E
A
R
E
R
A
D
V
F
-
R
R
F
N
I
Q
M
V
E
E
M
A
M
V
E
N
D
T
K
A
R
A
A
V
Y
K
R
T
S
A
M
I
L
I
I
Y
A
H
P
Y
P
H
H
S
H
A
N
K
R
M
L
E
Q
A
R
T
L
E
G
V
E
I
R
S
L
Y
Q
L
YPDFNID
I
A
A
E
Q
E
A
L
S
R
ADLIVWQHPMQWYSIP
P
L
L
K
L
W
I
D
K
V
F
SHGWAYGHGGTALHG
K
H
L
L
W
A
V
T
T
GGGESHFEIGAHPG
F
D
V
L
S
Q
P
L
Q
A
T
A
I
Y
C
G
L
N
W
L
P
P
F
A
M
H
CTFICD
D
E
T
L
E
G
Q
A
R
H
Y
K
Q
R
L
L
E
W
Q
E
A
H
35
Fugue
80.64
24%
-155
- C2 -
-
4BWZ
-
?
A:
[3-386]
G
A
E
H
L
L
E
I
F
Y
L
L
L
A
A
Q
V
C
A
F
I
F
K
R
L
N
Q
P
V
V
I
G
E
V
L
A
G
V
L
V
G
P
A
L
L
G
L
V
H
E
---
G
E
I
L
E
F
L
A
E
L
G
A
V
F
L
L
F
M
V
G
L
E
T
R
L
K
D
I
-
L
A
V
G
K
E
A
F
L
V
A
V
L
G
V
A
L
P
F
L
G
G
Y
L
Y
G
L
E
I
G
F
E
--
T
L
P
A
L
F
-
L
G
T
A
L
V
A
T
S
V
G
I
T
A
R
V
L
Q
E
L
-
G
V
L
S
R
P
Y
S
R
I
I
L
G
A
A
V
I
D
D
V
L
G
L
I
V
L
A
C
V
N
G
V
A
E
T
G
Q
V
E
V
--
G
-----------
A
-
I
-
T
R
L
I
V
L
S
V
V
F
V
G
L
A
V
F
-
L
S
T
L
I
A
----
R
-
L
P
L
E
R
L
P
V
G
S
P
L
G
F
A
L
A
L
G
V
G
M
A
A
L
A
A
S
-------
I
G
L
A
P
I
V
G
A
F
L
G
G
M
L
L
-----
S
E
V
R
E
K
Y
---------
R
L
E
E
P
---
I
----
F
A
I
E
S
--
F
L
A
P
I
F
F
A
M
V
G
V
R
L
E
L
S
A
L
A
S
P
--
V
-
V
-
L
-
V
A
G
T
V
V
T
V
I
A
I
L
G
K
V
L
G
G
F
L
G
A
--------
L
T
Q
G
V
R
S
A
L
T
V
G
C
G
M
A
P
R
G
E
V
G
L
I
V
A
A
L
G
L
K
A
--------------------------------
G
A
V
N
E
E
E
Y
A
I
V
L
F
M
-----
V
V
-----
F
T
T
L
F
A
P
F
A
L
K
P
L
I
A
W
T
E
R
E
R
A
A
K
E
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
79.94
26%
-168
- C2 -
-
5BZ3
7
?
A:
[24-376]
----------------------
K
R
L
N
Q
P
V
V
I
G
E
V
L
A
G
V
L
V
G
P
A
L
L
G
L
V
H
E
---
G
E
I
L
E
F
L
A
E
L
G
A
V
F
L
L
F
M
V
G
L
E
T
R
L
K
D
I
-
L
A
V
G
K
E
A
F
L
V
A
V
L
G
V
A
L
P
F
L
G
G
Y
L
Y
G
L
E
I
G
F
E
--
T
L
P
A
L
F
-
L
G
T
A
L
V
A
T
S
V
G
I
T
A
R
V
L
Q
E
L
-
G
V
L
S
R
P
Y
S
R
I
I
L
G
A
A
V
I
D
D
V
L
G
L
I
V
L
A
C
V
N
G
V
A
E
T
G
Q
V
-
E
--
V
-----------
G
A
I
-
T
R
L
I
V
L
S
V
V
F
V
G
L
A
V
F
L
S
T
L
I
A
R
L
P
L
E
R
-
L
P
V
G
S
---
P
L
G
F
A
L
A
L
G
V
G
M
A
A
--
L
A
A
S
-------
I
G
L
A
P
I
V
G
A
F
L
G
G
M
L
L
-----
S
E
V
R
E
K
Y
---------
R
L
E
E
P
---
I
----
F
A
I
E
S
--
F
L
A
P
I
F
F
A
M
V
G
V
R
L
E
L
S
A
L
A
S
P
--
V
-
V
-
L
-
V
A
G
T
V
V
T
V
I
A
I
L
G
K
V
L
G
G
F
L
G
A
--------
L
T
Q
G
V
R
S
A
L
T
V
G
C
G
M
A
P
R
G
E
V
G
L
I
V
A
A
L
G
L
K
A
G
------------------
A
----------
V
N
E
E
E
Y
A
I
V
L
F
M
V
V
F
T
-----
T
L
F
A
P
F
A
L
K
P
L
I
A
W
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
79.48
26%
-164
- C2 -
-
4BWZ
-
?
A:
[25-377]
----------------------
K
R
L
N
Q
P
V
V
I
G
E
V
L
A
G
V
L
V
G
P
A
L
L
G
L
V
H
E
---
G
E
I
L
E
F
L
A
E
L
G
A
V
F
L
L
F
M
V
G
L
E
T
R
L
K
D
I
-
L
A
V
G
K
E
A
F
L
V
A
V
L
G
V
A
L
P
F
L
G
G
Y
L
Y
G
L
E
I
G
F
E
--
T
L
P
A
L
F
-
L
G
T
A
L
V
A
T
S
V
G
I
T
A
R
V
L
Q
E
L
-
G
V
L
S
R
P
Y
S
R
I
I
L
G
A
A
V
I
D
D
V
L
G
L
I
V
L
A
C
V
N
G
V
A
E
T
G
Q
V
-
E
--
V
-----------
G
A
I
-
T
R
L
I
V
L
S
V
V
F
V
G
L
A
V
F
L
S
T
L
I
A
R
L
P
L
E
R
-
L
P
V
G
S
---
P
L
G
F
A
L
A
L
G
V
G
M
A
A
--
L
A
A
S
-------
I
G
L
A
P
I
V
G
A
F
L
G
G
M
L
L
-----
S
E
V
R
E
K
Y
---------
R
L
E
E
P
---
I
----
F
A
I
E
S
--
F
L
A
P
I
F
F
A
M
V
G
V
R
L
E
L
S
A
L
A
S
P
--
V
-
V
-
L
-
V
A
G
T
V
V
T
V
I
A
I
L
G
K
V
L
G
G
F
L
G
A
--------
L
T
Q
G
V
R
S
A
L
T
V
G
C
G
M
A
P
R
G
E
V
G
L
I
V
A
A
L
G
L
K
A
G
------------------
A
----------
V
N
E
E
E
Y
A
I
V
L
F
M
V
V
F
T
T
L
F
A
P
F
A
-----
L
K
P
L
I
A
W
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
74.85
26%
-
- C2 -
-
5BZ2
-
?
A:
[25-377]
----------------------
K
R
L
N
Q
P
C
V
I
G
E
V
L
A
G
V
L
V
G
P
A
L
L
G
L
V
H
E
---
G
E
I
L
E
F
L
A
E
L
G
A
V
F
L
L
F
M
V
G
L
E
T
R
L
K
D
I
-
L
A
V
G
K
E
A
F
L
V
A
V
L
G
V
A
L
P
F
L
G
G
Y
L
Y
G
L
E
I
G
F
E
--
T
L
P
A
L
F
-
L
G
T
A
L
V
A
T
S
V
G
C
T
A
R
V
L
Q
E
L
-
G
V
L
S
R
P
Y
S
R
I
I
L
G
A
A
V
I
D
D
V
L
G
L
I
V
L
A
V
V
N
G
V
A
E
T
G
Q
V
-
E
--
V
-----------
G
A
I
-
T
R
L
I
V
L
S
V
V
F
V
G
L
A
V
F
L
S
T
L
I
A
R
L
P
L
E
R
-
L
P
V
G
S
---
P
L
G
F
A
L
A
L
G
V
G
M
A
A
--
L
A
A
S
-------
I
G
L
A
P
I
V
G
A
F
L
G
G
M
L
L
-----
S
E
V
R
E
K
Y
---------
R
L
E
E
P
---
I
----
F
A
I
E
S
--
F
L
A
P
I
F
F
A
M
V
G
V
R
L
E
L
S
A
L
A
S
P
--
V
-
V
-
L
-
V
A
G
T
V
V
T
V
I
A
I
L
G
K
V
L
G
G
F
L
G
A
--------
L
T
Q
G
V
R
S
A
L
T
V
G
V
G
M
A
P
R
G
E
V
G
L
I
V
A
A
L
G
L
K
A
G
------------------
A
----------
V
N
E
E
E
Y
A
I
V
L
F
M
V
V
F
T
-----
T
L
F
A
P
F
A
L
K
P
L
I
A
W
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
40
HHSearch
73.91
22%
-171
- C2 -
-
5BZ3
7
?
A:
[4-372]
--
E
H
L
L
E
I
F
Y
L
L
L
A
A
Q
V
C
A
F
I
F
K
R
L
N
Q
P
V
V
I
G
E
V
L
A
G
V
L
V
G
P
A
L
L
G
L
V
H
E
---
G
E
I
L
E
F
L
A
E
L
G
A
V
F
L
L
F
M
V
G
L
E
T
R
L
K
D
I
-
L
A
V
G
K
E
A
F
L
V
A
V
L
G
V
A
L
P
F
L
G
G
Y
L
Y
G
L
-
E
I
G
F
--
E
T
L
P
A
L
F
L
G
T
A
L
V
A
T
S
V
G
I
T
A
R
V
L
Q
E
L
-
G
V
L
S
R
P
Y
S
R
I
I
L
G
A
A
V
I
D
D
V
L
G
L
I
V
L
A
C
V
N
G
V
A
E
T
G
Q
V
-
E
--
V
G
----------
A
-
I
T
R
L
I
V
L
S
V
V
F
V
-
G
L
A
-----
V
F
L
S
-
T
L
I
A
R
L
P
L
E
R
L
P
V
G
S
P
L
G
F
A
L
A
L
G
V
G
M
A
A
L
A
A
S
-------
I
G
L
A
P
I
V
G
A
F
L
G
G
M
L
L
-----
S
E
V
R
E
K
Y
---------
R
L
E
E
P
---
I
----
F
A
I
E
S
--
F
L
A
P
I
F
F
A
M
V
G
V
R
L
E
L
S
A
L
A
S
P
V
V
L
-
V
-
A
-
G
T
V
V
T
V
I
A
I
L
G
K
V
L
G
G
F
L
G
A
L
----------
T
Q
G
V
R
S
A
L
T
V
G
C
G
M
A
P
R
G
E
V
G
L
I
V
A
A
L
G
L
K
A
G
------------------
A
----------
V
N
E
E
E
Y
A
I
V
L
F
M
V
V
F
T
-----
T
L
-----
F
A
P
F
A
L
K
P
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
68.83
33%
-153
- C1 -
-
5NC8
1
?
B:
[28-191]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
S
V
I
I
A
G
Y
G
R
F
G
Q
V
V
G
R
L
L
S
A
Q
G
Y
H
L
S
I
L
D
H
S
P
S
Q
I
--
D
-------
N
K
V
F
Y
G
D
A
A
R
K
D
L
-
L
E
A
A
G
A
K
D
A
Q
L
L
V
I
A
I
-
D
-
A
P
D
K
A
L
E
I
-----
V
E
L
A
H
K
H
Y
P
Q
L
K
I
V
A
R
A
I
D
R
R
H
A
Y
Q
Y
L
R
L
G
V
T
S
F
K
-
R
E
T
F
D
S
A
V
-
N
L
G
I
E
A
L
T
L
L
G
N
S
S
---
T
V
A
E
R
A
G
D
L
F
-
S
Q
H
D
N
A
S
L
H
E
L
A
A
L
W
G
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
67.02
33%
-160
- C1 -
-
5NC8
1
?
A:
[28-190]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
S
V
I
I
A
G
Y
G
R
F
G
Q
V
V
G
R
L
L
S
A
Q
G
Y
H
L
S
I
L
D
H
S
P
S
Q
I
--
D
M
L
-----
N
K
V
F
Y
G
D
A
A
R
K
D
L
-
L
E
A
A
G
A
K
D
A
Q
L
L
V
I
A
I
-
D
-
A
P
D
K
A
L
E
I
-----
V
E
L
A
H
K
H
Y
P
Q
L
K
I
V
A
R
A
I
D
R
R
H
A
Y
Q
Y
L
R
L
G
V
T
S
F
K
-
R
E
T
F
D
S
A
V
-
N
L
G
I
E
A
L
T
L
L
G
N
S
S
---
T
V
A
E
R
A
G
D
L
F
-
S
Q
H
D
N
A
S
L
H
E
L
A
A
L
W
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
43
HHSearch
65.81
16%
-146
- C2 -
-
4CZ8
5
?
A:
[6-414]
---
L
A
E
A
L
F
L
I
L
F
T
G
V
I
S
M
L
I
S
R
R
T
G
I
S
Y
V
P
I
F
I
L
T
G
L
V
I
G
P
L
L
-
K
L
I
P
R
D
L
A
H
E
I
F
D
F
V
R
V
F
G
L
V
I
I
L
F
T
E
G
H
N
L
S
W
R
L
L
-
K
K
N
M
P
T
I
V
T
L
D
T
I
G
L
I
L
T
A
L
I
A
G
F
I
F
K
V
V
F
N
S
--
S
F
L
L
G
F
L
F
G
A
I
I
G
A
T
D
P
A
T
L
I
P
L
F
R
Q
Y
-
R
-
V
K
Q
D
I
E
T
V
I
V
T
E
S
I
F
N
D
P
L
G
I
V
L
T
L
I
A
I
S
M
L
V
P
G
Y
G
-
G
G
I
F
S
T
L
S
E
K
LGIY
A
G
-
G
V
I
Y
F
L
Y
N
V
S
V
S
I
S
L
G
I
F
-
L
G
I
L
G
Y
-
K
F
I
K
-
R
T
G
I
F
D
F
-
P
E
I
E
A
F
S
L
S
L
A
F
L
G
F
F
I
G
E
R
-------
L
D
A
S
G
Y
L
V
A
T
V
T
G
I
V
L
-----
G
N
Y
K
L
L
K
PREN
I
R
I
L
K
R
L
Q
R
A
I
E
K
E
V
H
F
N
D
T
L
A
A
--
L
A
T
I
F
I
F
V
L
L
G
A
E
M
N
L
E
V
I
W
S
N
--
L
-
G
-
K
G
L
L
V
A
L
G
V
M
I
L
A
R
P
L
A
T
L
P
L
L
K
----------
W
W
N
F
R
E
Y
L
F
I
A
L
-
E
G
P
R
G
V
V
P
S
A
L
A
S
L
P
L
S
L
A
------------------
L
K
YKSPLLT
V
H
W
G
E
I
I
M
A
T
V
V
I
T
V
L
T
S
-----
V
I
-----
V
E
T
L
W
I
P
I
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
46
HHSearch
64.40
31%
-164
- C1 -
-
5NC8
1
?
A:
[28-190]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
S
V
I
I
A
G
Y
G
R
F
G
Q
V
V
G
R
L
L
S
A
Q
G
Y
H
L
S
I
L
D
H
S
P
S
Q
I
--
D
M
L
-----
N
K
V
F
Y
G
D
A
A
R
K
D
L
-
L
E
A
A
G
A
K
D
A
Q
L
L
V
I
A
I
-
D
-
A
P
D
K
A
L
E
I
-----
V
E
L
A
H
K
H
Y
P
Q
L
K
I
V
A
R
A
I
D
R
R
H
A
Y
Q
Y
L
R
L
G
V
T
S
F
K
-
R
E
T
F
D
S
A
V
-
N
L
G
I
E
A
L
T
L
L
G
N
S
S
T
V
A
E
R
A
G
D
L
F
S
Q
H
D
N
A
S
L
H
E
L
A
A
L
----
W
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
41
HHSearch
60.45
15%
-153
* C2 *
-
4CZB
-
NAH1_METJA
A:
[6-407]
---
A
I
G
Y
L
G
L
A
L
V
L
G
S
L
V
A
K
I
A
E
K
L
K
I
P
D
I
P
L
L
L
L
L
G
L
I
I
G
P
F
L
Q
I
I
P
S
D
S
A
-
M
E
I
F
E
Y
A
G
P
I
G
L
I
F
I
L
L
G
G
A
F
T
M
R
I
S
L
L
-
K
R
V
I
K
T
V
V
R
L
D
T
I
T
F
L
I
T
L
L
I
S
G
F
I
F
N
M
V
L
N
L
PY
T
S
P
V
G
Y
L
F
G
A
I
T
A
A
T
D
P
A
T
L
I
P
V
F
S
R
V
-
R
-
T
N
P
E
V
A
I
T
L
E
A
E
S
I
F
N
D
P
L
G
I
V
S
T
S
V
I
L
G
L
F
G
L
F
S
S
----
S
-----------
N
-
P
L
I
D
L
I
T
L
A
G
G
A
I
V
V
G
L
L
-
L
A
K
I
Y
E
-
K
I
I
I
-
H
C
D
---
F
H
E
Y
V
A
P
L
V
L
G
G
A
M
L
L
L
Y
V
G
D
D
L
L
P
S
I
CG
Y
G
F
S
G
Y
M
A
V
A
I
M
G
L
Y
L
-----
G
D
A
L
F
R
A
DDID
Y
K
---
Y
I
V
S
F
---
C
----
D
D
L
S
L
--
L
A
R
V
F
I
F
V
F
L
G
A
C
I
K
L
S
M
L
E
N
Y
--
F
I
P
-
G
-
L
L
V
A
L
G
S
I
F
L
A
R
P
L
G
V
F
L
G
L
I
G
--------
S
K
H
S
F
K
E
K
L
Y
F
A
L
-
E
G
P
R
G
V
V
P
A
A
L
A
V
T
V
G
I
E
I
L
K
N
ADKIPA
S
I
T
K
Y
IT
P
T
D
----------
I
A
G
T
I
I
I
G
T
F
M
T
I
L
L
S
-----
V
I
-----
L
E
A
S
W
A
G
M
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
57
HHSearch
57.81
23%
-171
- C1 -
-
4GX0
1
?
B:
[346-477]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
E
D
E
L
I
F
I
I
G
H
G
R
I
G
C
A
A
A
A
F
L
D
R
K
P
V
P
F
I
L
I
D
R
Q
E
S
P
V
--
C
-----
N
D
H
V
V
V
Y
G
D
A
T
V
G
Q
T
-
L
R
Q
A
G
I
D
R
A
S
G
I
I
V
T
T
-
N
-
D
D
S
T
N
I
F
L
-----
T
L
A
C
R
H
L
H
S
H
I
R
I
V
A
R
A
N
G
E
E
N
V
D
Q
L
Y
A
A
G
A
D
F
V
V
-
S
N
A
S
V
G
A
N
-
I
L
G
N
L
L
E
H
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
42
HHSearch
57.66
15%
-140
- C2 -
-
4D0A
-
NAH1_METJA
B:
[6-407]
---
A
I
G
Y
L
G
L
A
L
V
L
G
S
L
V
A
K
I
A
E
K
L
K
I
P
D
I
P
L
L
L
L
L
G
L
I
I
G
P
F
L
Q
I
I
P
S
D
SA-
M
E
I
F
E
Y
A
G
P
I
G
L
I
F
I
L
L
G
G
A
F
T
M
R
I
S
L
L
-
K
R
V
I
K
T
V
V
R
L
D
T
I
T
F
L
I
T
L
L
I
S
G
F
I
F
N
M
V
L
N
L
PY
T
S
P
V
G
Y
L
F
G
A
I
T
A
A
T
D
P
A
T
L
I
P
V
F
S
R
V
-
R
-
T
N
P
E
V
A
I
T
L
E
A
E
S
I
F
N
D
P
L
G
I
V
S
T
S
V
I
L
G
L
F
G
L
F
S
S
----
S
-----------
N
-
P
L
I
D
L
I
T
L
A
G
G
A
I
V
V
G
L
L
-
L
A
K
I
Y
E
-
K
I
I
I
-
H
C
D
---
F
H
E
Y
V
A
P
L
V
L
G
G
A
M
L
L
L
Y
V
G
D
D
LLPSICG
Y
G
F
S
G
Y
M
A
V
A
I
M
G
L
Y
L
-----
G
D
A
L
F
R
A
DDIDYK---
Y
I
V
S
F
---
C
----
D
D
L
S
L
--
L
A
R
V
F
I
F
V
F
L
G
A
C
I
K
L
S
M
L
E
N
Y
--
F
I
P
-
G
-
L
L
V
A
L
G
S
I
F
L
A
R
P
L
G
V
F
L
G
L
I
G
--------
S
K
H
S
F
K
E
K
L
Y
F
A
L
-
E
G
P
R
G
V
V
P
A
A
L
A
V
T
V
G
I
E
I
LKNADKIPASITKYITPT
D
----------
I
A
G
T
I
I
I
G
T
F
M
T
I
L
L
S
-----
V
I
-----
L
E
A
S
W
A
G
M
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
57.64
21%
-179
- C1 -
-
3FWZ
1
YBAL_ECOLI
A:
[8-122]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
H
A
L
L
V
G
Y
G
R
V
G
S
L
L
G
E
K
L
L
A
S
D
I
P
L
V
V
I
E
T
S
R
T
R
V
--
D
E
L
R
-
E
R
G
V
R
A
V
L
G
N
A
A
N
E
E
I
-
M
Q
L
A
H
L
E
C
A
K
W
L
I
L
T
I
-
P
-
N
G
Y
E
A
G
E
I
-----
V
A
S
A
R
A
K
N
P
D
I
E
I
I
A
R
A
H
Y
D
D
E
V
A
Y
I
T
E
R
G
A
N
Q
V
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
34
Fugue
49.73
20%
-82
- C1 -
-
2G1U
3
?
A:
[17-151]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
K
S
K
Y
I
V
I
F
G
C
G
R
L
G
S
L
I
A
N
L
A
S
S
S
G
H
S
V
V
V
V
D
K
N
E
Y
A
F
--
H
R
L
N
S
E
F
S
G
F
T
V
V
G
D
A
A
E
F
E
T
-
L
K
E
C
G
M
E
K
A
D
M
V
F
A
F
T
-
N
-
D
D
S
T
N
F
F
I
-----
S
M
N
A
R
Y
M
F
N
V
E
N
V
I
A
R
V
Y
D
P
E
K
I
K
I
F
E
E
N
G
I
K
T
I
C
-
P
A
V
L
M
I
E
K
-
V
K
E
F
I
I
G
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
Fugue
49.53
15%
-160
- C2 -
-
1ZCD
-
NHAA_ECOLI
A:
[9-384]
--
S
S
D
A
S
G
G
I
I
L
I
I
A
A
I
L
A
M
I
M
A
N
S
G
A
T
S
G
W
Y
H
D
F
L
E
T
P
V
Q
L
R
V
G
S
L
E
I
N
---
K
N
M
L
L
W
I
N
D
A
L
M
A
V
F
F
L
L
V
G
L
E
V
K
R
E
L
M
Q
G
S
L
A
S
L
R
Q
A
A
F
P
V
I
A
A
I
G
G
M
I
V
P
A
L
L
Y
L
A
F
N
Y
--
A
D
P
I
T
R
E
G
W
A
I
P
A
A
T
D
I
A
F
A
L
G
V
L
A
L
L
G
S
R
V
P
L
A
L
K
I
F
L
M
A
L
A
I
I
D
D
L
G
A
I
I
I
I
A
L
F
Y
------
T
N
-
D
--
L
-----------
S
-
M
-
A
S
L
G
V
A
A
V
A
I
A
V
L
A
V
L
-
N
L
C
G
A
R
-
R
T
---------------
G
V
Y
I
L
V
G
V
V
L
W
T
A
V
L
K
-------
S
G
V
H
A
T
L
A
G
V
I
V
G
F
F
I
PLKEK
H
G
R
S
P
A
K
---------
R
L
E
H
V
---
L
----
H
P
W
V
A
Y
L
I
L
P
L
F
A
F
A
N
A
G
V
S
L
Q
G
V
T
L
D
G
L
--
T
-
S
I
L
-
P
L
G
I
I
A
G
L
L
I
G
K
P
L
G
I
S
L
F
C
W
L
ALRLKLAH
L
P
E
G
T
T
Y
Q
Q
I
M
V
V
G
I
L
C
G
I
G
F
T
M
S
I
F
I
A
S
L
A
F
G
------------------
S
----------
V
D
P
E
L
I
N
W
A
K
L
G
I
L
V
G
-----
S
I
-----
S
S
A
V
I
G
Y
S
W
L
R
V
R
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
38
Fugue
46.64
21%
-110
- C1 -
-
1LSU
2
KTRA_BACSU
A:
[11-144]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
Q
F
A
V
I
G
L
G
R
F
G
G
S
I
V
K
E
L
H
R
M
G
H
E
V
L
A
V
D
I
N
E
E
K
V
--
N
A
Y
A
-
S
Y
A
T
H
A
V
I
A
N
A
T
E
E
N
E
-
L
L
S
L
G
I
R
N
F
E
Y
V
I
V
A
I
G
A
-
N
I
Q
A
S
T
L
T
-----
T
L
L
L
K
E
L
D
I
P
-
N
I
W
V
K
A
Q
N
Y
Y
H
H
K
V
L
E
K
I
G
A
D
R
I
I
-
H
P
E
K
D
M
G
V
-
K
I
A
Q
S
L
S
D
E
N
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
32
Fugue
46.06
18%
-87
- C1 -
-
3FWZ
1
YBAL_ECOLI
A:
[1-140]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
N
A
V
D
I
C
N
H
A
L
L
V
G
Y
G
R
V
G
S
L
L
G
E
K
L
L
A
S
D
I
P
L
V
V
I
E
T
S
R
T
R
V
--
D
E
L
R
-
E
R
G
V
R
A
V
L
G
N
A
A
N
E
E
I
M
Q
L
-
A
H
L
E
C
A
K
W
L
I
L
T
I
-
P
-
N
G
Y
E
A
G
E
I
-----
V
A
S
A
R
A
K
N
P
D
I
E
I
I
A
R
A
H
Y
D
D
E
V
A
Y
I
T
E
R
G
A
N
Q
V
V
M
G
E
R
E
I
A
R
T
M
L
E
L
L
E
T
P
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
25
PsiBlast_CBE
46.02
31%
-80
- C1 -
-
4GX2
1
?
B:
[344-459]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
A
P
E
-
D
E
L
I
F
I
I
G
H
G
R
I
G
C
A
A
A
A
F
L
D
R
K
P
V
P
F
I
L
I
D
R
Q
E
S
P
V
CN
D
H
V
-------
V
V
Y
G
D
A
T
V
G
Q
T
-
L
R
Q
A
G
I
D
R
A
S
G
I
I
V
T
T
-
N
-
D
--
D
S
T
N
I
F
L
T
L
A
C
R
H
L
---
H
S
H
I
R
I
V
A
R
A
N
G
E
E
N
V
D
Q
L
Y
A
A
G
A
D
F
V
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
51
HHSearch
45.59
21%
-110
- C1 -
-
4J7C
2
KTRA_BACSU
B:
[6-140]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
K
Q
F
A
V
I
G
L
G
R
F
G
G
S
I
V
K
E
L
H
R
M
G
H
E
V
L
A
V
D
I
N
E
E
K
V
--
N
A
Y
A
-
S
Y
A
T
H
A
V
I
A
N
A
T
E
E
N
E
-
L
L
S
L
G
I
R
N
F
E
Y
V
I
V
A
I
-
G
A
N
I
Q
A
S
T
L
T
-----
T
L
L
L
K
E
L
D
I
-
P
N
I
W
V
K
A
Q
N
Y
Y
H
H
K
V
L
E
K
I
G
A
D
R
I
I
-
H
P
E
K
D
M
G
V
-
K
I
A
Q
S
L
S
D
E
N
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------