@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 : PA1535: (2016-01-30 )
MTDFQQYFDESHQLIRDSVRRFVEREVLPYIDEWEEAEEFPRELYLKAGAAGILGIGYPEAYGGSCEGDLFAKVAASEELMRCGSGGLVAGLGSLDIGLPPVVKWARPEVRERVVPAVLRGEKIMALAVTEPSGGSDVANLKTRAVRDGDHYRVSGSKTFITSGVRADYYTVAVRTGGEGFAGISLLLVEKGTAGFSVGRKLKKMGWWASDTAELFFDDCRVPAENLIGVENAGFACIMANFQSERLALAVMANMTAQLALEESLRWAREREAFGKPIGKFQVLRHRLAEMATQLEVSREFTYRQAAKMAAGKSVIKEISMAKNFATDVADRLTYDAVQVLGGMGYMRESLVERLYRDNRILSIGGGSREIMNEIIGKQMGL
Atome Classification :
(24 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-------------------------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
----------------MT
D
F
Q
Q
Y
F
D
E
S
H
Q
L
I
R
D
S
V
R
R
F
V
E
R
E
V
L
P
Y
I
D
E
W
E
E
-
A
E
-
E
F
P
--
R
E
L
Y
L
KAGAA
G
I
LGIGYPEAYG-GSCE
G
-
D
--
L
F
A
K
V
A
A
S
E
E
L
M
R
CGS-G
G
L
V
A
GLGS--L-DIGLPPVVKWA
R
P
E
V
R
E
R
V
V
P
A
V
LRG
E
K
I
M
A
L
A
V
TEPSGGS
D
V
A
N
L
K
T
R
AV--R--DGD-
H
Y
R
VSGS
K
T
F
I
TSGVRA
D
Y
Y
T
V
-
A
V
RTGGE---G---
F
A
G
I
S
L
L
L
V
E-KGTA
G
F
S
V
G
R
K
L
K
K
MGWWAS
D
T
A
E
L
F
F
D
DCRV
P
A
E
N
LIGV-ENA
G
F
A
C
I
M
ANFQS
E
R
L
A
L
A
V
M
A
N
M
T
A
Q
L
A
L
E
E
S
L
R
W
A
R
E
R
E
A
FGKP
I
G
K
F
Q
V
L
R
H
R
L
A
E
M
A
T
Q
L
E
V
S
R
E
F
T
Y
R
Q
A
--------------
A
K
-
M
AA
G
--------------
K
-------------------
S
-
V
I
K
E
I
S
M
A
K
N
F
A
T
D
V
A
D
R
L
T
Y
D
A
V
Q
V
LGG
M
G
Y
M
R
E
S
L
V
E
R
L
YRDN
R
I
L
S
IGGG
S
R
E
I
M
N
E
I
I
G
K
QMGL-------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
90.41
49%
-88
- C1 -
3P4T
3
?
A:
[31-401]
----------------------------
E
A
L
R
K
T
V
R
A
F
A
E
R
E
V
L
P
H
A
H
E
W
E
R
-
A
G
-
E
I
P
--
R
E
L
H
R
K
A
A
E
L
G
L
L
G
A
G
F
P
E
D
A
G
-
G
S
G
G
--
D
--
G
A
D
P
V
V
I
C
E
E
M
H
Y
A
G
S
P
G
G
V
Y
A
S
L
F
T
--
C
-
G
I
A
V
P
H
M
I
A
S
G
D
Q
R
L
I
D
T
Y
V
R
P
T
L
R
G
E
K
I
G
A
L
A
I
T
E
P
G
G
G
S
D
V
G
H
L
R
T
R
A
D
--
L
--
D
G
D
-
H
Y
V
I
N
G
A
K
T
Y
I
T
S
G
V
R
A
D
Y
V
V
T
-
A
A
R
T
G
G
P
---
G
---
A
G
G
V
S
L
I
V
V
D
-
K
G
T
P
G
F
E
V
T
R
K
L
D
K
M
G
W
R
S
S
D
T
A
E
L
S
Y
T
D
V
R
V
P
V
A
N
L
V
G
S
-
E
N
T
G
F
A
Q
I
A
A
A
F
V
A
E
R
V
G
L
A
T
Q
A
Y
A
G
A
Q
R
C
L
D
L
T
V
E
W
C
R
N
R
D
T
F
G
R
P
L
I
S
R
Q
A
V
Q
N
T
L
A
G
M
A
R
R
I
D
V
A
R
V
Y
T
R
H
V
V
--------------
E
R
-
Q
L
A
G
--------------
E
-------------------
T
N
L
I
A
E
V
C
F
A
K
N
T
A
V
E
A
G
E
W
V
A
N
Q
A
V
Q
L
F
G
G
M
G
Y
M
A
E
S
E
V
E
R
Q
Y
R
D
M
R
I
L
G
I
G
G
G
T
T
E
I
L
T
S
L
A
A
K
T
L
G
F
-------------------------------------------------------------------------------------------------------------------------------------------
25
PsiBlast_CBE
90.37
49%
-89
- C1 -
3OIB
7
?
B:
[31-401]
----------------------------
E
A
L
R
K
T
V
R
A
F
A
E
R
E
V
L
P
H
A
H
E
W
E
R
-
A
G
-
E
I
P
--
R
E
L
H
R
K
A
A
E
L
G
L
L
G
A
G
F
P
E
D
A
G
-
G
S
G
G
--
D
--
G
A
D
P
V
V
I
C
E
E
M
H
Y
A
G
S
P
G
G
V
Y
A
S
L
F
T
--
C
-
G
I
A
V
P
H
M
I
A
S
G
D
Q
R
L
I
D
T
Y
V
R
P
T
L
R
G
E
K
I
G
A
L
A
I
T
E
P
G
G
G
S
D
V
G
H
L
R
T
R
A
D
--
L
--
D
G
D
-
H
Y
V
I
N
G
A
K
T
Y
I
T
S
G
V
R
A
D
Y
V
V
T
-
A
A
R
T
G
G
P
---
G
---
A
G
G
V
S
L
I
V
V
D
-
K
G
T
P
G
F
E
V
T
R
K
L
D
K
M
G
W
R
S
S
D
T
A
E
L
S
Y
T
D
V
R
V
P
V
A
N
L
V
G
S
-
E
N
T
G
F
A
Q
I
A
A
A
F
V
A
E
R
V
G
L
A
T
Q
A
Y
A
G
A
Q
R
C
L
D
L
T
V
E
W
C
R
N
R
D
T
F
G
R
P
L
I
S
R
Q
A
V
Q
N
T
L
A
G
M
A
R
R
I
D
V
A
R
V
Y
T
R
H
V
V
--------------
E
R
-
Q
L
A
G
--------------
E
-------------------
T
N
L
I
A
E
V
C
F
A
K
N
T
A
V
E
A
G
E
W
V
A
N
Q
A
V
Q
L
F
G
G
M
G
Y
M
A
E
S
E
V
E
R
Q
Y
R
D
M
R
I
L
G
I
G
G
G
T
T
E
I
L
T
S
L
A
A
K
T
L
G
F
-------------------------------------------------------------------------------------------------------------------------------------------
24
PsiBlast_CBE
90.34
49%
-90
- C1 -
3P4T
3
?
B:
[31-401]
----------------------------
E
A
L
R
K
T
V
R
A
F
A
E
R
E
V
L
P
H
A
H
E
W
E
R
-
A
G
-
E
I
P
--
R
E
L
H
R
K
A
A
E
L
G
L
L
G
A
G
F
P
E
D
A
G
-
G
S
G
G
--
D
--
G
A
D
P
V
V
I
C
E
E
M
H
Y
A
G
S
P
G
G
V
Y
A
S
L
F
T
--
C
-
G
I
A
V
P
H
M
I
A
S
G
D
Q
R
L
I
D
T
Y
V
R
P
T
L
R
G
E
K
I
G
A
L
A
I
T
E
P
G
G
G
S
D
V
G
H
L
R
T
R
A
D
--
L
--
D
G
D
-
H
Y
V
I
N
G
A
K
T
Y
I
T
S
G
V
R
A
D
Y
V
V
T
-
A
A
R
T
G
G
P
---
G
---
A
G
G
V
S
L
I
V
V
D
-
K
G
T
P
G
F
E
V
T
R
K
L
D
K
M
G
W
R
S
S
D
T
A
E
L
S
Y
T
D
V
R
V
P
V
A
N
L
V
G
S
-
E
N
T
G
F
A
Q
I
A
A
A
F
V
A
E
R
V
G
L
A
T
Q
A
Y
A
G
A
Q
R
C
L
D
L
T
V
E
W
C
R
N
R
D
T
F
G
R
P
L
I
S
R
Q
A
V
Q
N
T
L
A
G
M
A
R
R
I
D
V
A
R
V
Y
T
R
H
V
V
--------------
E
R
-
Q
L
A
G
--------------
E
-------------------
T
N
L
I
A
E
V
C
F
A
K
N
T
A
V
E
A
G
E
W
V
A
N
Q
A
V
Q
L
F
G
G
M
G
Y
M
A
E
S
E
V
E
R
Q
Y
R
D
M
R
I
L
G
I
G
G
G
T
T
E
I
L
T
S
L
A
A
K
T
L
G
F
-------------------------------------------------------------------------------------------------------------------------------------------
115
HHSearch
89.63
51%
-94
- C1 -
3R7K
5
?
A:
[28-402]
----------------------
W
T
T
P
E
R
R
A
L
S
Q
M
A
R
S
F
V
E
R
E
I
A
P
K
L
A
E
W
E
H
-
V
G
-
E
I
P
--
R
D
L
H
L
N
A
A
E
V
G
L
L
G
I
G
F
P
E
E
V
G
-
G
S
G
-
G
-
N
--
A
I
D
S
A
L
V
T
E
A
I
L
A
A
-
G
-
G
S
T
G
V
C
A
A
L
F
T
H
-
G
I
A
L
P
H
I
A
A
N
G
S
D
A
L
I
E
R
Y
V
R
P
T
L
A
G
K
M
I
G
S
L
G
V
T
E
P
G
A
G
S
D
V
A
N
L
R
T
R
A
V
--
R
--
E
G
D
-
T
Y
V
V
N
G
A
K
T
F
I
T
S
G
V
R
A
D
F
V
T
T
-
A
V
R
T
G
G
P
---
G
---
Y
G
G
V
S
L
L
V
I
D
K
N
S
-
P
G
F
E
V
S
R
R
L
D
K
M
G
W
R
C
S
D
T
A
E
L
S
F
V
D
V
R
V
P
A
D
N
L
V
G
A
-
E
N
S
G
F
L
Q
I
M
Q
Q
F
Q
A
E
R
L
G
I
A
V
Q
A
Y
A
T
A
G
R
A
L
D
L
A
K
S
W
A
R
E
R
E
T
F
G
R
P
L
T
G
R
Q
I
I
R
H
K
L
A
E
M
A
R
Q
V
D
V
A
C
T
Y
T
R
A
V
M
---------------
Q
R
W
L
A
G
--------------
E
-------------------
D
-
V
V
A
E
V
S
M
A
K
N
T
A
V
Y
A
C
D
Y
V
V
N
E
A
V
Q
I
F
G
G
M
G
Y
M
R
E
S
E
I
E
R
H
Y
R
D
C
R
I
L
G
I
G
G
G
T
N
E
I
M
N
E
V
I
A
K
R
I
G
--------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
89.54
49%
-87
- C1 -
3OIB
17
?
A:
[31-401]
----------------------------
E
A
L
R
K
T
V
R
A
F
A
E
R
E
V
L
P
H
A
H
E
W
E
R
-
A
G
-
E
I
P
--
R
E
L
H
R
K
A
A
E
L
G
L
L
G
A
G
F
P
E
D
A
G
-
G
S
G
G
--
D
--
G
A
D
P
V
V
I
C
E
E
M
H
Y
A
G
S
P
G
G
V
Y
A
S
L
F
T
--
C
-
G
I
A
V
P
H
M
I
A
S
G
D
Q
R
L
I
D
T
Y
V
R
P
T
L
R
G
E
K
I
G
A
L
A
I
T
E
P
G
G
G
S
D
V
G
H
L
R
T
R
A
D
--
L
--
D
G
D
-
H
Y
V
I
N
G
A
K
T
Y
I
T
S
G
V
R
A
D
Y
V
V
T
-
A
A
R
T
G
G
P
---
G
---
A
G
G
V
S
L
I
V
V
D
-
K
G
T
P
G
F
E
V
T
R
K
L
D
K
M
G
W
R
S
S
D
T
A
E
L
S
Y
T
D
V
R
V
P
V
A
N
L
V
G
S
-
E
N
T
G
F
A
Q
I
A
A
A
F
V
A
E
R
V
G
L
A
T
Q
A
Y
A
G
A
Q
R
C
L
D
L
T
V
E
W
C
R
N
R
D
T
F
G
R
P
L
I
S
R
Q
A
V
Q
N
T
L
A
G
M
A
R
R
I
D
V
A
R
V
Y
T
R
H
V
V
--------------
E
R
-
Q
L
A
G
--------------
E
-------------------
T
N
L
I
A
E
V
C
F
A
K
N
T
A
V
E
A
G
E
W
V
A
N
Q
A
V
Q
L
F
G
G
M
G
Y
M
A
E
S
E
V
E
R
Q
Y
R
D
M
R
I
L
G
I
G
G
G
T
T
E
I
L
T
S
L
A
A
K
T
L
G
F
-------------------------------------------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
89.15
41%
-94
- C1 -
2PG0
2
?
B:
[8-384]
---------------------
R
Y
L
R
E
E
H
H
M
F
R
A
A
F
R
K
F
L
E
K
E
A
Y
P
H
Y
N
D
W
E
K
-
R
G
-
I
I
P
--
R
S
F
W
A
K
M
G
E
N
G
F
L
C
P
W
V
D
E
K
Y
G
-
G
-
L
N
A
-
D
--
F
A
Y
S
V
V
I
N
E
E
L
E
K
V
G
S
-
S
L
V
G
I
G
L
H
N
----
D
I
V
T
P
Y
I
A
S
Y
G
T
E
E
Q
K
Q
K
W
L
P
K
C
V
T
G
E
L
I
T
A
I
A
M
T
E
P
G
A
G
S
D
L
A
N
I
S
T
T
A
V
--
K
--
D
G
D
-
Y
Y
I
V
N
G
Q
K
T
F
I
T
N
G
I
H
A
D
L
I
V
V
-
A
C
K
T
D
P
Q
---
A
KPP
H
R
G
I
S
L
L
V
V
E
-
R
D
T
P
G
F
T
R
G
R
K
L
E
K
V
G
L
H
A
Q
D
T
A
E
L
F
F
Q
D
A
K
V
P
A
Y
N
L
L
G
E
-
E
G
K
G
F
Y
Y
L
M
E
K
L
Q
Q
E
R
L
V
V
A
I
A
A
Q
T
A
A
E
V
M
F
S
L
T
K
Q
Y
V
K
Q
R
T
A
F
G
K
R
V
S
E
F
Q
T
V
Q
F
R
L
A
E
M
A
T
E
I
A
L
G
R
T
F
V
D
R
V
I
--------------
E
E
-
H
M
A
G
--------------
K
-------------------
Q
-
I
V
T
E
V
S
M
A
K
W
W
I
T
E
M
A
K
R
V
A
A
E
A
M
Q
L
H
G
G
Y
G
Y
M
E
E
Y
E
I
A
R
R
Y
R
D
I
P
V
S
A
I
Y
A
G
T
N
E
M
M
K
T
I
I
A
R
Q
L
D
--------------------------------------------------------------------------------------------------------------------------------------------
125
HHSearch
85.73
47%
-85
- C1 -
3P4T
3
?
A:
[23-399]
--------------------
S
I
W
T
T
A
E
R
E
A
L
R
K
T
V
R
A
F
A
E
R
E
V
L
P
H
A
H
E
W
E
R
-
A
G
-
E
I
P
--
R
E
L
H
R
K
A
A
E
L
G
L
L
G
A
G
F
P
E
D
A
G
-
G
S
G
-
G
-
D
--
G
A
D
P
V
V
I
C
E
E
M
H
Y
A
-
G
-
S
P
G
G
V
Y
A
S
L
F
T
C
-
G
I
A
V
P
H
M
I
A
S
G
D
Q
R
L
I
D
T
Y
V
R
P
T
L
R
G
E
K
I
G
A
L
A
I
T
E
P
G
G
G
S
D
V
G
H
L
R
T
R
A
D
--
L
--
D
G
D
-
H
Y
V
I
N
G
A
K
T
Y
I
T
S
G
V
R
A
D
Y
V
V
T
-
A
A
R
T
G
G
P
---
G
---
A
G
G
V
S
L
I
V
V
D
K
G
T
-
P
G
F
E
V
T
R
K
L
D
K
M
G
W
R
S
S
D
T
A
E
L
S
Y
T
D
V
R
V
P
V
A
N
L
V
G
S
-
E
N
T
G
F
A
Q
I
A
A
A
F
V
A
E
R
V
G
L
A
T
Q
A
Y
A
G
A
Q
R
C
L
D
L
T
V
E
W
C
R
N
R
D
T
F
G
R
P
L
I
S
R
Q
A
V
Q
N
T
L
A
G
M
A
R
R
I
D
V
A
R
V
Y
T
R
H
V
V
---------------
E
R
Q
L
A
G
E-------------
T
-------------------
N
-
L
I
A
E
V
C
F
A
K
N
T
A
V
E
A
G
E
W
V
A
N
Q
A
V
Q
L
F
G
G
M
G
Y
M
A
E
S
E
V
E
R
Q
Y
R
D
M
R
I
L
G
I
G
G
G
T
T
E
I
L
T
S
L
A
A
K
T
L
G
F
-------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
85.73
41%
-92
- C1 -
2PG0
2
?
A:
[8-385]
---------------------
R
Y
L
R
E
E
H
H
M
F
R
A
A
F
R
K
F
L
E
K
E
A
Y
P
H
Y
N
D
W
E
K
-
R
G
-
I
I
P
--
R
S
F
W
A
K
M
G
E
N
G
F
L
C
P
W
V
D
E
K
Y
G
-
G
-
L
N
A
-
D
--
F
A
Y
S
V
V
I
N
E
E
L
E
K
V
G
S
-
S
L
V
G
I
G
L
H
N
----
D
I
V
T
P
Y
I
A
S
Y
G
T
E
E
Q
K
Q
K
W
L
P
K
C
V
T
G
E
L
I
T
A
I
A
M
T
E
P
G
A
G
S
D
L
A
N
I
S
T
T
A
V
--
K
--
D
G
D
-
Y
Y
I
V
N
G
Q
K
T
F
I
T
N
G
I
H
A
D
L
I
V
V
-
A
C
K
T
D
P
Q
---
A
KPP
H
R
G
I
S
L
L
V
V
E
-
R
D
T
P
G
F
T
R
G
R
K
L
E
K
V
G
L
H
A
Q
D
T
A
E
L
F
F
Q
D
A
K
V
P
A
Y
N
L
L
G
E
-
E
G
K
G
F
Y
Y
L
M
E
K
L
Q
Q
E
R
L
V
V
A
I
A
A
Q
T
A
A
E
V
M
F
S
L
T
K
Q
Y
V
K
Q
R
T
A
F
G
K
R
V
S
E
F
Q
T
V
Q
F
R
L
A
E
M
A
T
E
I
A
L
G
R
T
F
V
D
R
V
I
--------------
E
E
-
H
M
A
G
--------------
K
-------------------
Q
-
I
V
T
E
V
S
M
A
K
W
W
I
T
E
M
A
K
R
V
A
A
E
A
M
Q
L
H
G
G
Y
G
Y
M
E
E
Y
E
I
A
R
R
Y
R
D
I
P
V
S
A
I
Y
A
G
T
N
E
M
M
K
T
I
I
A
R
Q
L
D
L
-------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
85.45
53%
-87
- C1 -
3R7K
5
?
A:
[41-402]
-----------------------------------
R
S
F
V
E
R
E
I
A
P
K
L
A
E
W
E
H
-
V
G
-
E
I
P
--
R
D
L
H
L
N
A
A
E
V
G
L
L
G
I
G
F
P
E
E
V
G
-
G
S
G
G
N
-
A
--
I
D
S
A
L
V
T
E
A
I
L
A
A
G
G
S
-
T
G
V
C
A
A
L
F
T
--
H
-
G
I
A
L
P
H
I
A
A
N
G
S
D
A
L
I
E
R
Y
V
R
P
T
L
A
G
K
M
I
G
S
L
G
V
T
E
P
G
A
G
S
D
V
A
N
L
R
T
R
A
V
--
R
--
E
G
D
-
T
Y
V
V
N
G
A
K
T
F
I
T
S
G
V
R
A
D
F
V
T
T
-
A
V
R
T
G
G
P
---
G
---
Y
G
G
V
S
L
L
V
I
D
-
K
N
S
P
G
F
E
V
S
R
R
L
D
K
M
G
W
R
C
S
D
T
A
E
L
S
F
V
D
V
R
V
P
A
D
N
L
V
G
A
-
E
N
S
G
F
L
Q
I
M
Q
Q
F
Q
A
E
R
L
G
I
A
V
Q
A
Y
A
T
A
G
R
A
L
D
L
A
K
S
W
A
R
E
R
E
T
F
G
R
P
L
T
G
R
Q
I
I
R
H
K
L
A
E
M
A
R
Q
V
D
V
A
C
T
Y
T
R
A
V
M
--------------
Q
R
-
W
L
A
G
--------------
E
-------------------
D
-
V
V
A
E
V
S
M
A
K
N
T
A
V
Y
A
C
D
Y
V
V
N
E
A
V
Q
I
F
G
G
M
G
Y
M
R
E
S
E
I
E
R
H
Y
R
D
C
R
I
L
G
I
G
G
G
T
N
E
I
M
N
E
V
I
A
K
R
I
G
--------------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
84.88
53%
-83
- C1 -
3R7K
5
?
D:
[41-402]
-----------------------------------
R
S
F
V
E
R
E
I
A
P
K
L
A
E
W
E
H
-
V
G
-
E
I
P
--
R
D
L
H
L
N
A
A
E
V
G
L
L
G
I
G
F
P
E
E
V
G
-
G
S
G
G
N
-
A
--
I
D
S
A
L
V
T
E
A
I
L
A
A
G
G
S
-
T
G
V
C
A
A
L
F
T
--
H
-
G
I
A
L
P
H
I
A
A
N
G
S
D
A
L
I
E
R
Y
V
R
P
T
L
A
G
K
M
I
G
S
L
G
V
T
E
P
G
A
G
S
D
V
A
N
L
R
T
R
A
V
--
R
--
E
G
D
-
T
Y
V
V
N
G
A
K
T
F
I
T
S
G
V
R
A
D
F
V
T
T
-
A
V
R
T
G
G
P
---
G
---
Y
G
G
V
S
L
L
V
I
D
-
K
N
S
P
G
F
E
V
S
R
R
L
D
K
M
G
W
R
C
S
D
T
A
E
L
S
F
V
D
V
R
V
P
A
D
N
L
V
G
A
-
E
N
S
G
F
L
Q
I
M
Q
Q
F
Q
A
E
R
L
G
I
A
V
Q
A
Y
A
T
A
G
R
A
L
D
L
A
K
S
W
A
R
E
R
E
T
F
G
R
P
L
T
G
R
Q
I
I
R
H
K
L
A
E
M
A
R
Q
V
D
V
A
C
T
Y
T
R
A
V
M
--------------
Q
R
-
W
L
A
G
--------------
E
-------------------
D
-
V
V
A
E
V
S
M
A
K
N
T
A
V
Y
A
C
D
Y
V
V
N
E
A
V
Q
I
F
G
G
M
G
Y
M
R
E
S
E
I
E
R
H
Y
R
D
C
R
I
L
G
I
G
G
G
T
N
E
I
M
N
E
V
I
A
K
R
I
G
--------------------------------------------------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
84.20
53%
-84
- C1 -
3R7K
5
?
B:
[41-402]
-----------------------------------
R
S
F
V
E
R
E
I
A
P
K
L
A
E
W
E
H
-
V
G
-
E
I
P
--
R
D
L
H
L
N
A
A
E
V
G
L
L
G
I
G
F
P
E
E
V
G
-
G
S
G
G
N
-
A
--
I
D
S
A
L
V
T
E
A
I
L
A
A
G
G
S
-
T
G
V
C
A
A
L
F
T
--
H
-
G
I
A
L
P
H
I
A
A
N
G
S
D
A
L
I
E
R
Y
V
R
P
T
L
A
G
K
M
I
G
S
L
G
V
T
E
P
G
A
G
S
D
V
A
N
L
R
T
R
A
V
--
R
--
E
G
D
-
T
Y
V
V
N
G
A
K
T
F
I
T
S
G
V
R
A
D
F
V
T
T
-
A
V
R
T
G
G
P
---
G
---
Y
G
G
V
S
L
L
V
I
D
-
K
N
S
P
G
F
E
V
S
R
R
L
D
K
M
G
W
R
C
S
D
T
A
E
L
S
F
V
D
V
R
V
P
A
D
N
L
V
G
A
-
E
N
S
G
F
L
Q
I
M
Q
Q
F
Q
A
E
R
L
G
I
A
V
Q
A
Y
A
T
A
G
R
A
L
D
L
A
K
S
W
A
R
E
R
E
T
F
G
R
P
L
T
G
R
Q
I
I
R
H
K
L
A
E
M
A
R
Q
V
D
V
A
C
T
Y
T
R
A
V
M
--------------
Q
R
-
W
L
A
G
--------------
E
-------------------
D
-
V
V
A
E
V
S
M
A
K
N
T
A
V
Y
A
C
D
Y
V
V
N
E
A
V
Q
I
F
G
G
M
G
Y
M
R
E
S
E
I
E
R
H
Y
R
D
C
R
I
L
G
I
G
G
G
T
N
E
I
M
N
E
V
I
A
K
R
I
G
--------------------------------------------------------------------------------------------------------------------------------------------
111
HHSearch
82.56
41%
-93
- C1 -
2PG0
2
?
A:
[6-383]
-------------------
T
A
R
Y
L
R
E
E
H
H
M
F
R
A
A
F
R
K
F
L
E
K
E
A
Y
P
H
Y
N
D
W
E
K
-
R
G
-
I
I
P
--
R
S
F
W
A
K
M
G
E
N
G
F
L
C
P
W
V
D
E
K
Y
G
-
G
L
N
-
A
-
D
--
F
A
Y
S
V
V
I
N
E
E
L
E
K
V
-
G
-
S
S
L
V
G
I
G
L
H
--
N
-
D
I
V
T
P
Y
I
A
S
Y
G
T
E
E
Q
K
Q
K
W
L
P
K
C
V
T
G
E
L
I
T
A
I
A
M
T
E
P
G
A
G
S
D
L
A
N
I
S
T
T
A
V
--
K
--
D
G
D
-
Y
Y
I
V
N
G
Q
K
T
F
I
T
N
G
I
H
A
D
L
I
V
V
-
A
C
K
T
D
P
Q
AKP
P
---
H
R
G
I
S
L
L
V
V
E
R
D
T
-
P
G
F
T
R
G
R
K
L
E
K
V
G
L
H
A
Q
D
T
A
E
L
F
F
Q
D
A
K
V
P
A
Y
N
L
L
G
E
-
E
G
K
G
F
Y
Y
L
M
E
K
L
Q
Q
E
R
L
V
V
A
I
A
A
Q
T
A
A
E
V
M
F
S
L
T
K
Q
Y
V
K
Q
R
T
A
F
G
K
R
V
S
E
F
Q
T
V
Q
F
R
L
A
E
M
A
T
E
I
A
L
G
R
T
F
V
D
R
V
I
---------------
E
E
H
M
A
G
--------------
K
-------------------
Q
-
I
V
T
E
V
S
M
A
K
W
W
I
T
E
M
A
K
R
V
A
A
E
A
M
Q
L
H
G
G
Y
G
Y
M
E
E
Y
E
I
A
R
R
Y
R
D
I
P
V
S
A
I
Y
A
G
T
N
E
M
M
K
T
I
I
A
R
Q
L
D
L
-------------------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
82.44
53%
-82
- C1 -
3R7K
5
?
C:
[41-403]
-----------------------------------
R
S
F
V
E
R
E
I
A
P
K
L
A
E
W
E
H
-
V
G
-
E
I
P
--
R
D
L
H
L
N
A
A
E
V
G
L
L
G
I
G
F
P
E
E
V
G
-
G
S
G
G
N
-
A
--
I
D
S
A
L
V
T
E
A
I
L
A
A
G
G
S
-
T
G
V
C
A
A
L
F
T
--
H
-
G
I
A
L
P
H
I
A
A
N
G
S
D
A
L
I
E
R
Y
V
R
P
T
L
A
G
K
M
I
G
S
L
G
V
T
E
P
G
A
G
S
D
V
A
N
L
R
T
R
A
V
--
R
--
E
G
D
-
T
Y
V
V
N
G
A
K
T
F
I
T
S
G
V
R
A
D
F
V
T
T
-
A
V
R
T
G
G
P
---
G
---
Y
G
G
V
S
L
L
V
I
D
-
K
N
S
P
G
F
E
V
S
R
R
L
D
K
M
G
W
R
C
S
D
T
A
E
L
S
F
V
D
V
R
V
P
A
D
N
L
V
G
A
-
E
N
S
G
F
L
Q
I
M
Q
Q
F
Q
A
E
R
L
G
I
A
V
Q
A
Y
A
T
A
G
R
A
L
D
L
A
K
S
W
A
R
E
R
E
T
F
G
R
P
L
T
G
R
Q
I
I
R
H
K
L
A
E
M
A
R
Q
V
D
V
A
C
T
Y
T
R
A
V
M
--------------
Q
R
-
W
L
A
G
--------------
E
-------------------
D
-
V
V
A
E
V
S
M
A
K
N
T
A
V
Y
A
C
D
Y
V
V
N
E
A
V
Q
I
F
G
G
M
G
Y
M
R
E
S
E
I
E
R
H
Y
R
D
C
R
I
L
G
I
G
G
G
T
N
E
I
M
N
E
V
I
A
K
R
I
G
L
-------------------------------------------------------------------------------------------------------------------------------------------
129
HHSearch
80.24
34%
-92
- C1 -
3OWA
6
?
A:
[32-423]
----------------------
D
F
S
S
E
H
K
M
I
A
K
T
T
E
D
F
I
V
N
E
V
L
P
E
L
E
Y
L
E
Q
--
H
-
E
F
D
R
S
V
R
L
L
K
E
A
G
E
L
G
L
L
G
A
D
V
P
E
E
Y
G
-
G
I
G
-
L
-
D
--
K
V
S
S
A
L
I
A
E
K
F
S
R
A
-
G
--
G
F
A
I
T
H
G
A
--
H
V
G
I
G
S
L
P
I
V
L
F
G
N
E
E
Q
K
K
K
Y
L
P
L
L
A
T
G
E
K
L
A
A
Y
A
L
T
E
P
G
S
G
S
D
A
L
G
A
K
T
T
A
R
--
L
N
A
E
G
T
-
H
Y
V
L
N
G
E
K
Q
W
I
T
N
S
A
F
A
D
V
F
I
V
-
Y
A
K
I
D
G
---------
E
H
F
S
A
F
I
V
E
K
D
Y
-
A
G
V
S
T
S
P
E
E
K
K
M
G
I
K
C
S
S
T
R
T
L
I
L
E
D
A
L
V
P
K
E
N
L
L
G
E
-
I
G
K
G
H
I
I
A
F
N
I
L
N
I
G
R
Y
K
L
G
V
G
T
V
G
S
A
K
R
A
V
E
I
S
A
Q
Y
A
N
Q
R
Q
Q
F
K
Q
P
I
A
R
F
P
L
I
Q
E
K
L
A
N
M
A
A
K
T
Y
A
A
E
S
S
V
Y
R
T
V
---------------
G
L
F
E
S
R
--------------
M
S
T
LS
E
E
E
V
K
D
G
K
A
V
A
A
S
I
A
E
-
Y
A
I
E
C
S
L
N
K
V
F
G
S
E
V
L
D
Y
T
V
D
E
G
V
Q
I
H
G
G
Y
G
F
M
A
E
Y
E
I
E
R
M
Y
R
D
S
R
I
N
R
I
F
E
G
T
N
E
I
N
R
L
I
V
P
G
T
F
L
R
-------------------------------------------------------------------------------------------------------------------------------------------
122
HHSearch
79.91
35%
-80
- C1 -
1UKW
2
?
A:
[4-377]
----------------------
S
L
T
E
E
Q
R
Q
L
Q
A
L
A
R
R
F
A
K
E
V
I
L
P
V
A
Q
E
Y
D
E
-
K
E
-
E
V
P
--
W
P
V
I
E
K
L
H
E
V
G
L
L
N
A
I
I
P
E
E
Y
G
-
G
M
G
-
L
-
K
--
M
L
D
E
V
I
V
G
E
E
L
A
Y
A
-
C
-
M
G
I
Y
T
I
P
M
A
--
S
-
D
L
G
I
T
P
V
L
L
A
G
T
E
E
Q
K
E
R
F
L
R
P
L
T
E
K
P
A
L
A
A
F
A
L
S
E
P
G
N
G
S
D
A
A
A
L
K
T
R
A
I
--
R
--
Q
G
D
-
H
Y
V
L
N
G
T
K
M
W
I
S
N
G
G
E
A
E
W
V
V
V
-
F
A
T
V
N
P
E
L--
R
---
H
K
G
V
V
A
L
V
V
E
R
G
T
-
P
G
F
K
A
I
K
I
H
G
K
M
G
Q
R
A
S
G
T
Y
E
L
V
F
E
D
V
K
V
P
V
E
N
R
L
G
E
-
E
G
E
G
F
K
I
A
M
Q
T
L
N
K
T
R
I
P
V
A
A
G
S
V
G
V
A
R
R
A
L
D
E
A
R
K
Y
A
K
E
R
E
A
F
G
E
P
I
A
N
F
Q
A
I
Q
F
K
L
V
D
M
L
I
G
I
E
T
A
R
M
Y
T
Y
Y
A
A
---------------
W
L
A
D
Q
G
--------------
L
-------------------
P
-
H
A
H
A
S
A
I
A
K
A
Y
A
S
E
I
A
F
E
A
A
N
Q
A
I
Q
I
H
G
G
Y
G
Y
V
R
E
F
P
V
E
K
L
L
R
D
V
K
L
N
Q
I
Y
E
G
T
N
E
I
Q
R
L
I
I
A
R
H
I
L
A
-------------------------------------------------------------------------------------------------------------------------------------------
76
PsiBlast_CBE
78.60
36%
-88
- C1 -
2Z1Q
2
?
A:
[28-408]
-----------------------
F
D
E
S
V
K
E
I
A
R
T
T
R
T
F
V
E
R
E
V
L
P
L
L
E
R
M
E
H
-
G
E
L
E
L
N
--
V
P
L
M
R
K
A
G
E
L
G
L
L
A
I
D
V
P
E
E
Y
G
-
G
L
D
L
P
-
K
--
V
I
S
T
V
V
A
-
E
E
L
--
S
G
S
-
G
G
F
S
V
T
Y
G
A
H
-
T
-
S
I
G
T
L
P
L
V
Y
F
G
T
E
E
Q
K
R
K
Y
L
P
K
L
A
S
G
E
W
I
A
A
Y
C
L
T
E
P
G
S
G
S
D
A
L
A
A
K
T
R
A
T
L
S
E
--
D
G
K
-
H
Y
I
L
N
G
V
K
Q
W
I
S
N
A
G
F
A
H
L
F
T
V
-
F
A
K
V
D
G
E
---
H
---
F
---
T
A
F
L
V
E
-
R
D
T
P
G
L
S
F
G
P
E
E
K
K
M
G
I
K
A
S
S
T
R
Q
V
I
L
E
D
V
K
V
P
V
E
N
V
L
G
E
-
I
G
K
G
H
K
I
A
F
N
V
L
N
V
G
R
Y
K
L
G
A
G
A
V
G
G
A
K
R
A
L
E
L
S
A
Q
Y
A
T
Q
R
V
Q
F
G
R
P
I
G
R
F
G
L
I
Q
Q
K
L
G
E
M
A
S
R
I
Y
A
A
E
S
A
V
Y
R
T
V
G
L
I
D
E
A
L
LGKKG
P
E
A
V
-
M
A
G
I
--------------
E
-------------------
E
-
Y
A
V
E
A
S
I
I
K
V
L
G
S
E
V
L
D
Y
V
V
D
E
G
V
Q
I
H
G
G
Y
G
Y
S
Q
E
Y
P
I
E
R
A
Y
R
D
A
R
I
N
R
I
F
E
G
T
N
E
I
N
R
L
L
I
P
G
M
L
L
R
-------------------------------------------------------------------------------------------------------------------------------------------
110
HHSearch
78.33
32%
-88
- C1 -
1RX0
8
ACAD8_HUMAN
A:
[15-391]
-------------------
P
S
M
G
L
N
E
E
Q
K
E
F
Q
K
V
A
F
D
F
A
A
R
E
M
A
P
N
M
A
E
W
D
Q
-
K
E
-
L
F
P
--
V
D
V
M
R
K
A
A
Q
L
G
F
G
G
V
Y
I
Q
T
D
V
G
-
G
S
G
-
L
-
S
--
R
L
D
T
S
V
I
F
E
A
L
A
T
G
-
C
-
T
S
T
T
A
Y
I
S
I
--
H
-
N
M
C
A
W
M
I
D
S
F
G
N
E
E
Q
R
H
K
F
C
P
P
L
C
T
M
E
K
F
A
S
Y
C
L
T
E
P
G
S
G
S
D
A
A
S
L
L
T
S
A
K
--
K
--
Q
G
D
-
H
Y
I
L
N
G
S
K
A
F
I
S
G
A
G
E
S
D
I
Y
V
V
-
M
C
R
T
G
G
P
---
G
---
P
K
G
I
S
C
I
V
V
E
K
G
T
-
P
G
L
S
F
G
K
K
E
K
K
V
G
W
N
S
Q
P
T
R
A
V
I
F
E
D
C
A
V
P
V
A
N
R
I
G
S
-
E
G
Q
G
F
L
I
A
V
R
G
L
N
G
G
R
I
N
I
A
S
C
S
L
G
A
A
H
A
S
V
I
L
T
R
D
H
L
N
V
R
K
Q
F
G
E
P
L
A
S
N
Q
Y
L
Q
F
T
L
A
D
M
A
T
R
L
V
A
A
R
L
M
V
R
N
A
A
---------------
V
A
L
Q
E
E
R-------------
K
-------------------
D
-
A
V
A
L
C
S
M
A
K
L
F
A
T
D
E
C
F
A
I
C
N
Q
A
L
Q
M
H
G
G
Y
G
Y
L
K
D
Y
A
V
Q
Q
Y
V
R
D
S
R
V
H
Q
I
L
E
G
S
N
E
V
M
R
I
L
I
S
R
S
L
L
Q
-------------------------------------------------------------------------------------------------------------------------------------------
53
PsiBlast_CBE
77.54
34%
-86
- C1 -
1BUC
3
ACDS_MEGEL
B:
[5-378]
----------------
L
T
D
I
Q
Q
D
F
---
L
K
L
A
H
D
----
F
G
E
K
K
L
A
P
T
V
T
E
R
D
H
-
K
G
-
I
Y
D
--
K
E
L
I
D
E
L
L
S
L
G
I
T
G
A
Y
F
E
E
K
Y
G
-
G
S
G
D
D
-
G
GD
V
L
S
Y
I
L
A
V
E
E
L
A
K
Y
D
A
-
G
V
A
I
T
L
S
A
T
--
V
-
S
L
C
A
N
P
I
W
Q
F
G
T
E
A
Q
K
E
K
F
L
V
P
L
V
E
G
T
K
L
G
A
F
G
L
T
E
P
N
A
G
T
D
A
S
G
Q
Q
T
I
A
T
--
K
--
N
D
D
G
T
Y
T
L
N
G
S
K
I
F
I
T
N
G
G
A
A
D
I
Y
I
V
F
A
M
T
D
K
S
K
---
G
---
N
H
G
I
T
A
F
I
L
E
-
D
G
T
P
G
F
T
Y
G
K
K
E
D
K
M
G
I
H
T
S
Q
T
M
E
L
V
F
Q
D
V
K
V
P
A
E
N
M
L
G
E
-
E
G
K
G
F
K
I
A
M
M
T
L
D
G
G
R
I
G
V
A
A
Q
A
L
G
I
A
E
A
A
L
A
D
A
V
E
Y
S
K
Q
R
V
Q
F
G
K
P
L
C
K
F
Q
S
I
S
F
K
L
A
D
M
K
M
Q
I
E
A
A
R
N
L
V
Y
K
A
A
--------------
C
K
-
K
Q
E
G
--------------
K
-------------------
P
-
F
T
V
D
A
A
I
A
K
R
V
A
S
D
V
A
M
R
V
T
T
E
A
V
Q
I
F
G
G
Y
G
Y
S
E
E
Y
P
V
A
R
H
M
R
D
A
K
I
T
Q
I
Y
E
G
T
N
E
V
Q
L
M
V
T
G
G
A
L
L
R
-------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
77.53
35%
-75
- C1 -
1UKW
2
?
A:
[2-376]
------------------
D
F
S
--
L
T
E
E
Q
R
Q
L
Q
A
L
A
R
R
F
A
K
E
V
I
L
P
V
A
Q
E
Y
D
E
-
K
E
-
E
V
P
--
W
P
V
I
E
K
L
H
E
V
G
L
L
N
A
I
I
P
E
E
Y
G
-
G
M
G
L
--
K
--
M
L
D
E
V
I
V
G
E
E
L
A
Y
A
C
M
-
G
I
Y
T
I
P
M
A
S
----
D
L
G
I
T
P
V
L
L
A
G
T
E
E
Q
K
E
R
F
L
R
P
L
T
E
K
P
A
L
A
A
F
A
L
S
E
P
G
N
G
S
D
A
A
A
L
K
T
R
A
I
--
R
--
Q
G
D
-
H
Y
V
L
N
G
T
K
M
W
I
S
N
G
G
E
A
E
W
V
V
V
-
F
A
T
V
N
P
E
L--
R
---
H
K
G
V
V
A
L
V
V
E
-
R
G
T
P
G
F
K
A
I
K
I
H
G
K
M
G
Q
R
A
S
G
T
Y
E
L
V
F
E
D
V
K
V
P
V
E
N
R
L
G
E
-
E
G
E
G
F
K
I
A
M
Q
T
L
N
K
T
R
I
P
V
A
A
G
S
V
G
V
A
R
R
A
L
D
E
A
R
K
Y
A
K
E
R
E
A
F
G
E
P
I
A
N
F
Q
A
I
Q
F
K
L
V
D
M
L
I
G
I
E
T
A
R
M
Y
T
Y
Y
A
A
--------------
W
L
-
A
D
Q
G
--------------
L
-------------------
P
-
H
A
H
A
S
A
I
A
K
A
Y
A
S
E
I
A
F
E
A
A
N
Q
A
I
Q
I
H
G
G
Y
G
Y
V
R
E
F
P
V
E
K
L
L
R
D
V
K
L
N
Q
I
Y
E
G
T
N
E
I
Q
R
L
I
I
A
R
H
I
L
A
-------------------------------------------------------------------------------------------------------------------------------------------
82
PsiBlast_CBE
77.48
34%
-84
- C1 -
1RX0
9
ACAD8_HUMAN
C:
[33-390]
-------------------------------------
F
A
A
R
E
M
A
P
N
M
A
E
W
D
Q
-
K
E
-
L
F
P
--
V
D
V
M
R
K
A
A
Q
L
G
F
G
G
V
Y
I
Q
T
D
V
G
-
G
S
G
L
S
-
R
--
L
D
T
S
V
I
F
--
E
A
L
A
T
G
C
-
T
S
T
T
A
Y
I
S
I
--
H
-
N
M
C
A
W
M
I
D
S
F
G
N
E
E
Q
R
H
K
F
C
P
P
L
C
T
M
E
K
F
A
S
Y
C
L
T
E
P
G
S
G
S
D
A
A
S
L
L
T
S
A
K
--
K
--
Q
G
D
-
H
Y
I
L
N
G
S
K
A
F
I
S
G
A
G
E
S
D
I
Y
V
V
-
M
C
R
T
G
G
P
---
G
---
P
K
G
I
S
C
I
V
V
E
-
K
G
T
P
G
L
S
F
G
K
K
E
K
K
V
G
W
N
S
Q
P
T
R
A
V
I
F
E
D
C
A
V
P
V
A
N
R
I
G
S
-
E
G
Q
G
F
L
I
A
V
R
G
L
N
G
G
R
I
N
I
A
S
C
S
L
G
A
A
H
A
S
V
I
L
T
R
D
H
L
N
V
R
K
Q
F
G
E
P
L
A
S
N
Q
Y
L
Q
F
T
L
A
D
M
A
T
R
L
V
A
A
R
L
M
V
R
N
A
A
--------------
V
A
-
L
Q
E
E
R-------------
K
-------------------
D
-
A
V
A
L
C
S
M
A
K
L
F
A
T
D
E
C
F
A
I
C
N
Q
A
L
Q
M
H
G
G
Y
G
Y
L
K
D
Y
A
V
Q
Q
Y
V
R
D
S
R
V
H
Q
I
L
E
G
S
N
E
V
M
R
I
L
I
S
R
S
L
L
Q
-------------------------------------------------------------------------------------------------------------------------------------------
28
PsiBlast_CBE
76.76
37%
-81
- C1 -
4IV6
2
?
B:
[12-380]
----------------------------
E
T
I
V
K
T
V
H
D
F
V
E
K
Q
V
K
P
V
V
R
E
L
E
H
-
A
N
-
T
Y
P
--
E
E
L
I
E
T
M
K
E
I
G
I
F
G
L
A
I
P
E
P
Y
G
F
G
A
V
S
M
-
P
--
C
Y
V
Q
V
A
--
E
E
L
A
R
-
G
W
-
M
S
L
A
G
A
M
G
G
--
H
-
T
V
V
S
K
L
L
L
L
F
G
T
E
E
Q
K
Q
K
Y
L
P
R
M
A
T
G
E
L
R
A
T
M
A
L
T
E
P
G
G
G
S
D
L
Q
A
M
R
T
V
A
R
--
R
--
D
G
D
-
D
Y
V
I
N
G
S
K
T
W
I
S
N
A
R
R
S
D
L
V
A
L
-
M
C
K
T
D
P
D
---
A
QPA
H
K
G
V
S
I
L
L
V
E
-
K
-
V
P
G
F
D
V
S
R
D
L
P
K
L
G
Y
K
G
V
E
S
C
E
L
N
F
T
D
A
R
V
P
V
S
S
L
L
G
D
D
E
G
R
G
F
A
Q
M
M
K
G
L
E
V
G
R
L
Q
V
A
A
R
A
T
G
V
A
R
A
A
F
E
D
A
L
R
Y
S
Q
E
R
E
S
F
G
K
P
I
W
Q
H
Q
S
V
G
N
M
L
A
D
M
G
T
K
L
Y
A
A
R
S
L
L
L
S
A
A
--------------
E
K
-
F
D
A
G
--------------
Q
-------------------
R
-
C
D
M
E
A
G
M
A
K
L
F
A
S
E
T
A
M
Q
I
A
L
D
A
V
R
V
H
G
G
Y
G
Y
S
T
E
Y
D
V
E
R
Y
F
R
D
A
P
L
M
I
V
G
E
G
T
N
E
I
Q
R
N
V
I
A
K
Q
L
V
A
-------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
76.46
37%
-81
- C1 -
4IV6
2
?
A:
[12-380]
----------------------------
E
T
I
V
K
T
V
H
D
F
V
E
K
Q
V
K
P
V
V
R
E
L
E
H
-
A
N
-
T
Y
P
--
E
E
L
I
E
T
M
K
E
I
G
I
F
G
L
A
I
P
E
P
Y
G
F
G
A
V
S
M
-
P
--
C
Y
V
Q
V
A
--
E
E
L
A
R
-
G
W
-
M
S
L
A
G
A
M
G
G
--
H
-
T
V
V
S
K
L
L
L
L
F
G
T
E
E
Q
K
Q
K
Y
L
P
R
M
A
T
G
E
L
R
A
T
M
A
L
T
E
P
G
G
G
S
D
L
Q
A
M
R
T
V
A
R
--
R
--
D
G
D
-
D
Y
V
I
N
G
S
K
T
W
I
S
N
A
R
R
S
D
L
V
A
L
-
M
C
K
T
D
P
D
---
A
QPA
H
K
G
V
S
I
L
L
V
E
-
K
-
V
P
G
F
D
V
S
R
D
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P
K
L
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Y
K
G
V
E
S
C
E
L
N
F
T
D
A
R
V
P
V
S
S
L
L
G
D
D
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G
R
G
F
A
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M
M
K
G
L
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G
R
L
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A
A
R
A
T
G
V
A
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A
A
F
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D
A
L
R
Y
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Q
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R
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F
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P
I
W
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L
A
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M
G
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L
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A
A
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S
L
L
L
S
A
A
--------------
E
K
-
F
D
A
G
--------------
Q
-------------------
R
-
C
D
M
E
A
G
M
A
K
L
F
A
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T
A
M
Q
I
A
L
D
A
V
R
V
H
G
G
Y
G
Y
S
T
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Y
D
V
E
R
Y
F
R
D
A
P
L
M
I
V
G
E
G
T
N
E
I
Q
R
N
V
I
A
K
Q
L
V
A
-------------------------------------------------------------------------------------------------------------------------------------------
102
Fugue
73.65
35%
-79
- C1 -
2Z1Q
2
?
B:
[5-577]
KKLWQKGGGWLLEVPE
R
V
Y
T
P
E
D
F
D
E
S
V
K
E
I
A
R
T
T
R
T
F
V
E
R
E
V
L
P
L
L
E
R
M
E
H
G
E
L
-
E
L
N
--
V
P
L
M
R
K
A
G
E
L
G
L
L
A
I
D
V
P
E
E
Y
G
-
G
L
-
D
L
-
P
--
K
V
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T
V
V
A
E
E
L
S
G
S
G
G
-
F
S
V
T
Y
G
A
H
T
----
S
I
G
T
L
P
L
V
Y
F
G
T
E
E
Q
K
R
K
Y
L
P
K
L
A
S
G
E
W
I
A
A
Y
C
L
T
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P
G
S
G
S
D
A
L
A
A
K
T
R
A
T
L
S
E
--
D
G
K
-
H
Y
I
L
N
G
V
K
Q
W
I
S
N
A
G
F
A
H
L
F
T
V
-
F
A
K
V
D
G
E
---------
H
F
T
A
F
L
V
E
-
R
D
T
P
G
L
S
F
G
P
E
E
K
K
M
G
I
K
A
S
S
T
R
Q
V
I
L
E
D
V
K
V
P
V
E
N
V
L
G
E
-
I
G
K
G
H
K
I
A
F
N
V
L
N
V
G
R
Y
K
L
G
A
G
A
V
G
G
A
K
R
A
L
E
L
S
A
Q
Y
A
T
Q
R
V
Q
F
G
R
P
I
G
R
F
G
L
I
Q
Q
K
L
G
E
M
A
S
R
I
Y
A
A
E
S
A
V
Y
R
T
V
--------------
G
L
-
I
D
E
A
L
LGKKG
P
E
A
V
M
A
G
I
E
-------------------
E
-
Y
A
V
E
A
S
I
I
K
V
L
G
S
E
V
L
D
Y
V
V
D
E
G
V
Q
I
H
G
G
Y
G
Y
S
Q
E
Y
P
I
E
R
A
Y
R
D
A
R
I
N
R
I
F
E
G
T
N
E
I
N
R
L
L
I
P
G
M
L
L
R
RAEPED
L
E
L
H
Q
V
Q
N
L
K
K
L
A
L
M
V
A
G
L
A
V
Q
K
YGQGVEEE
Q
E
V
L
G
A
V
A
D
I
L
I
D
A
Y
A
A
E
S
A
L
L
R
A
R
R
L
GGL
A
P
V
L
A
R
I
Y
L
A
Q
A
L
D
R
A
Q
A
G
A
L
S
V
LPRLVEG
D
E
A
R
V
V
Y
S
A
A
R
R
L
T
KREPGD
L
V
A
L
R
R
Q
A
A
E
A
V
L
E
A
GGYPIPR
89
PsiBlast_CBE
65.71
35%
-83
- C1 -
3NF4
2
?
B:
[19-383]
-------------------------
E
A
A
E
L
I
-
E
L
T
R
E
I
A
D
K
V
L
D
P
I
V
D
R
H
E
K
-
D
E
-
T
Y
P
--
E
G
V
F
E
Q
L
G
A
A
G
L
L
S
L
P
Q
P
E
E
W
G
-
G
G
G
Q
P
Y
E
--
V
Y
L
Q
V
L
-
E
E
I
A
A
R
W
A
S
-
V
A
V
A
V
S
V
H
S
--
L
-
S
S
H
--
P
L
L
V
F
G
T
E
E
Q
K
K
R
W
L
P
G
M
L
S
G
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Q
I
G
A
Y
S
L
S
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P
---------
R
C
A
A
T
--
P
--
T
D
G
-
G
Y
V
I
N
G
S
K
S
W
I
T
H
G
G
K
A
D
F
Y
T
L
-
F
A
R
T
G
---------
S
R
G
V
S
C
F
L
V
P
-
A
D
Q
P
G
L
S
F
G
K
P
E
E
K
M
G
L
H
A
V
P
T
T
S
A
F
Y
D
N
A
R
I
D
A
D
R
R
I
G
E
-
E
G
Q
G
L
Q
I
A
F
S
A
L
D
S
G
R
L
G
I
A
A
V
A
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G
L
A
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A
A
L
D
E
A
V
A
Y
A
N
E
R
T
A
F
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R
K
I
I
D
H
Q
G
L
G
F
L
L
A
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M
A
A
A
V
A
T
A
R
A
T
Y
L
D
A
A
--------------
R
R
-
R
D
Q
G
--------------
R
-------------------
P
-
Y
S
Q
Q
A
S
I
A
K
L
T
A
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D
A
A
M
K
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R
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I
M
Q
I
F
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T
N
Q
I
Q
R
L
V
I
A
R
G
L
T
--------------------------------------------------------------------------------------------------------------------------------------------