@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 : PA1246: (2016-01-27 )
MARLGSSVTNEIKQALAASRGALRSVAAFSGVINLLMLVPSLYMLQVYDRVLSSANEVTLLMLTLMALGVFVFMGALEALRSFVLVRVSERFDGQLHGRIYAAAFERNLRAGGQEASQALHDLTTLRQFITGQALFAFFDAPWFPVYLLVIFLFDPWLGLLSLVGALALMALAWFNERATRAPLAKAGELSIKSGQLASNNLRNAEVIEAMGMLGSMRGRWERLHQAFLDQQSLASERAARINALSKYLRIALQSLVLGLGAWLAVEGRITPGMMIAGSILMGRALGPIDQLIGVWKQWGAARDAYRRLSGLLDEFPARERRMELPEPRGHLLLESLDAAPPGSEARTLRGLTLAIPAGSVVGVIGPSGSGKSSLARVVLGIWPTLHGSVRLDGAEIRQYERETLGPRIGYLPQDIELFAGTVAENIARFGEVQADKVVEAARLAGVHELVLRLPQGYDTVLGVGGAGLSGGQRQRIALARALYGAPTLVVLDEPNSNLDDSGEQALLAAIQALKARGCTVLLITHRAGVLGCADRLLALNAGQLHLYGERDQVLAALNNQRAASASQQRADYRVAGYGAPQVVAAPRQGGVE
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.---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
-----------------------------------------------------------------------------MARL
G
S
S
V
T
N
E
I
K
Q
A
L
A
A
S
R
G
A
L
R
S
V
A
A
F
S
G
V
I
N
L
L
M
L
V
P
S
L
--
Y
M
L
Q
--
V
Y
D
R
V
LSSAN--E---
V
T
L
L
M
L
T
L
-
M
A
L
G
V
F
V
F
M
-
G
A
L
E
A
L
R
S
F
V
L
V
R
V
S
E
RFDGQLH
G
R
I
Y
------
A
A
A
F
-----
E
-----
R
N
L
R
-AG---
G
---
Q
E
A
-
S
Q
-
A
-
L
H
D
L
T
T
L
R
Q
F
----
I
T
G
Q
A
L
F
A
F
FDA
P
W
F
P
V
Y
L
L
V
I
F
LF
D
P
W
-
L
G
L
-
L
S
L
-
V
G
A
L
A
L
-
M
A
L
A
W
F
NER---ATRAPLAKA
G
-
E
L
S
IKSGQLASNNLR
N
A
E
V
I
E
A
M
G
M
L
G
S
M
R
G
R
W
E
R
L
H
Q
A
F
L
D
Q
-------
Q
S
L
A
S
E
R
-----
A
A
R
I
-----
N
A
L
S
K
Y
L
R
I
A
-
L
Q
S
L
V
L
G
L
G
--------
A
W
L
A
VEGRITP
G
M
M
I
A
G
S
I
L
MGRALG-
P
I
D
Q
L
I
G
V
W
K
QWG
A
A
R
D
A
Y
R
R
L
S
G
L
L
D
--E-FP
A
R
E
----R-RM-------ELPEP----RGH
L
L
L
E
-----SLD------AAPPGS-EA
R
T
LR
G
L
T
L
A
IPAG
S
V
V
G
V
IGPSGS
G
K
S
S
L
A
R
V
V
L
G
IWPTL---H
G
S
V
R
L
D
G
A
E
I
R
Q
Y
E
R
E
TLGPRIGYLP
Q
D
I
E
L
F
A
G
T
V
A
E
N
I
A
--
R
F
--GE----
V
Q
A
--
D
K
-
V
V
E
A
A
R
L
A
G
V
H
E
L
V
L
RLPQGY
D
T
VLGVGGAGLSGG
Q
R
Q
R
I
A
L
A
R
A
LYGA
P
T
L
V
V
L
DEPNSNLDDS
G
E
Q
A
L
L
A
A
I
Q
A
L
K
A-RG
C
T
V
L
L
I
THRAG
V
L
G
C
A
D
R
L
L
ALNAG
Q
L
H
L
YG
E
R
D
Q
V
L
A
A
LNNQRAASASQQRA
D
Y
R
VAGYGAP
Q
V
V
AAPRQGGVE---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
83.21
25%
-110
- C2 -
2HYD
3
Y1866_STAAM
A:
[31-564]
-----------------------------------------------------------------------------------------------------------------
M
L
I
P
L
L
I
K
Y
A
I
D
GV
I
N
N
H
A
L
T
T
D
E
--
K
---
V
H
H
L
T
I
A
I
G
I
A
L
F
I
F
V
I
V
R
P
P
I
E
F
I
R
Q
Y
L
A
Q
W
T
S
N
K
I
L
Y
D
I
R
K
K
L
Y
N
H
L
Q
A
L
S
A
R
F
-----
Y
-----
A
N
N
Q
-
V
G
-------
Q
V
I
-
S
R
-
V
-
I
N
D
V
E
Q
T
K
D
F
----
I
L
T
G
L
M
N
I
W
L
D
C
I
T
I
I
I
A
L
S
I
M
F
F
L
D
V
K
-
L
T
L
-
A
A
L
F
I
F
P
F
Y
I
-
L
T
V
Y
V
F
F
G
R
---
L
R
K
L
T
R
E
R
S
Q
-
A
L
A
E
V
Q
G
F
L
-
H
E
R
V
Q
G
I
S
V
V
K
S
F
A
I
E
D
N
E
A
K
N
F
D
K
K
N
T
N
F
L
-
T
-------
R
A
L
K
H
T
R
W
N
A
Y
S
F
A
A
I
-----
N
T
V
T
D
I
G
P
I
-----
I
V
I
G
V
G
--------
A
Y
L
A
I
S
G
S
I
T
V
G
T
L
A
A
F
V
G
Y
L
E
L
L
F
G
-
P
L
R
R
L
V
A
S
F
T
T
L
T
Q
S
F
A
S
M
D
R
V
F
Q
L
I
D
--
E
D
Y
D
I
K
N
GVGA
Q
-
P
I
-------
E
I
K
Q
------
G
R
I
D
I
D
-----
H
V
S
------
F
Q
Y
N
D
N
-
E
A
P
I
L
K
D
I
N
L
S
I
E
K
G
E
T
V
A
F
V
G
M
S
G
G
G
K
S
T
L
I
N
L
I
P
R
F
Y
D
V
T
---
S
G
Q
I
L
I
D
G
H
N
I
K
D
F
L
T
G
S
L
R
N
Q
I
G
L
V
Q
Q
D
N
I
L
F
S
D
T
V
K
E
N
I
L
--
L
G
--
R
P
----
T
A
T
--
D
E
E
V
V
E
A
A
K
M
A
N
A
H
D
F
I
M
N
L
P
Q
G
Y
D
T
E
V
G
E
R
G
V
K
L
S
G
G
Q
K
Q
R
L
S
I
A
R
I
F
L
N
N
P
P
I
L
I
L
D
E
A
T
S
A
L
D
L
E
S
E
S
I
I
Q
E
A
L
D
V
L
-
S
-
K
D
R
T
T
L
I
V
A
H
R
L
S
T
I
T
H
A
D
K
I
V
V
I
E
N
G
H
I
V
E
T
G
T
H
R
E
L
I
A
K
Q
G
A
Y
E
H
L
Y
S
I
Q
N
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
82.77
25%
-107
- C2 -
2ONJ
4
Y1866_STAAM
A:
[31-564]
-----------------------------------------------------------------------------------------------------------------
M
L
I
P
L
L
I
K
Y
A
I
D
GV
I
N
N
H
A
L
T
T
D
E
--
K
---
V
H
H
L
T
I
A
I
G
I
A
L
F
I
F
V
I
V
R
P
P
I
E
F
I
R
Q
Y
L
A
Q
W
T
S
N
K
I
L
Y
D
I
R
K
K
L
Y
N
H
L
Q
A
L
S
A
R
F
-----
Y
-----
A
N
N
Q
-
V
G
-------
Q
V
I
-
S
R
-
V
-
I
N
D
V
E
Q
T
K
D
F
----
I
L
T
G
L
M
N
I
W
L
D
C
I
T
I
I
I
A
L
S
I
M
F
F
L
D
V
K
-
L
T
L
-
A
A
L
F
I
F
P
F
Y
I
-
L
T
V
Y
V
F
F
G
R
---
L
R
K
L
T
R
E
R
S
Q
-
A
L
A
E
V
Q
G
F
L
-
H
E
R
V
Q
G
I
S
V
V
K
S
F
A
I
E
D
N
E
A
K
N
F
D
K
K
N
T
N
F
L
-
T
-------
R
A
L
K
H
T
R
W
N
A
Y
S
F
A
A
I
-----
N
T
V
T
D
I
G
P
I
-----
I
V
I
G
V
G
--------
A
Y
L
A
I
S
G
S
I
T
V
G
T
L
A
A
F
V
G
Y
L
E
L
L
F
G
-
P
L
R
R
L
V
A
S
F
T
T
L
T
Q
S
F
A
S
M
D
R
V
F
Q
L
I
D
--
E
D
Y
D
I
K
N
GVGA
Q
-
P
I
-------
E
I
K
Q
------
G
R
I
D
I
D
-----
H
V
S
------
F
Q
Y
N
D
N
-
E
A
P
I
L
K
D
I
N
L
S
I
E
K
G
E
T
V
A
F
V
G
M
S
G
G
G
K
S
T
L
I
N
L
I
P
R
F
Y
D
V
T
---
S
G
Q
I
L
I
D
G
H
N
I
K
D
F
L
T
G
S
L
R
N
Q
I
G
L
V
Q
Q
D
N
I
L
F
S
D
T
V
K
E
N
I
L
--
L
G
--
R
P
----
T
A
T
--
D
E
E
V
V
E
A
A
K
M
A
N
A
H
D
F
I
M
N
L
P
Q
G
Y
D
T
E
V
G
E
R
G
V
K
L
S
G
G
Q
K
Q
R
L
S
I
A
R
I
F
L
N
N
P
P
I
L
I
L
D
E
A
T
S
A
L
D
L
E
S
E
S
I
I
Q
E
A
L
D
V
L
-
S
-
K
D
R
T
T
L
I
V
A
H
R
L
S
T
I
T
H
A
D
K
I
V
V
I
E
N
G
H
I
V
E
T
G
T
H
R
E
L
I
A
K
Q
G
A
Y
E
H
L
Y
S
I
Q
N
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
103
HHSearch
79.83
24%
-110
- C2 -
3ZDQ
6
ABCBA_HUMAN
A:
[6-572]
------------------------------------------------------------------------------------
E
A
R
K
L
L
G
L
A
Y
P
E
R
R
R
L
A
A
A
V
G
F
L
T
M
S
S
V
I
S
M
S
A
P
F
--
F
L
G
K
--
I
I
D
V
I
Y
T
N
P
T
--
V
DY
S
D
N
L
T
R
L
C
L
-
G
L
S
A
V
F
L
C
G
-
A
A
A
N
A
I
R
V
Y
L
M
Q
T
S
G
Q
R
I
V
N
R
L
R
T
S
L
F
------
S
S
I
L
-----
R
-----
Q
E
V
A
F
F
D
K
T
R
T
---
G
E
L
-
I
N
-
R
L
S
S
D
T
A
L
L
G
R
S
----
V
T
E
N
L
S
D
G
L
R
A
G
A
Q
A
S
V
G
I
S
M
M
F
F
V
S
P
N
-
L
A
T
-
F
V
L
-
S
V
V
P
P
V
-
S
I
I
A
V
I
Y
G
R
---
Y
L
R
K
L
T
K
V
T
Q
-
D
S
L
A
Q
A
T
Q
L
A
E
E
R
I
G
N
V
R
T
V
R
A
F
G
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M
T
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I
E
K
Y
A
S
K
V
D
H
V
M
Q
L
-------
A
R
K
E
A
F
A
-----
R
A
G
F
-----
F
G
A
T
G
L
S
G
N
L
-
I
V
L
S
V
L
Y
K
G
--------
G
L
L
M
G
S
A
H
M
T
V
G
E
L
S
S
F
L
M
Y
A
F
W
V
G
I
-
S
I
G
G
L
S
S
F
Y
S
E
L
M
K
G
L
G
A
G
G
R
L
W
E
L
L
E
--
R
-
E
P
K
L
P
----
F
-
N
E
G
V
I
L
---
N
E
K
S
F
----
Q
G
A
L
E
F
K
-----
N
V
H
------
F
A
Y
P
A
R
P
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V
P
I
F
Q
D
F
S
L
S
I
P
S
G
S
V
T
A
L
V
G
P
S
G
S
G
K
S
T
V
L
S
L
L
L
R
L
Y
D
P
A
---
S
G
T
I
S
L
D
G
H
D
I
R
Q
L
N
P
V
W
L
R
S
K
I
G
T
V
S
Q
E
P
I
L
F
S
C
S
I
A
E
N
I
A
--
Y
G
--
A
D
DPSS
V
T
A
--
E
E
-
I
Q
R
V
A
E
V
A
N
A
V
A
F
I
R
N
F
P
Q
G
F
N
T
V
V
G
E
K
G
V
L
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
L
L
K
N
P
K
I
L
L
L
D
E
A
T
S
A
L
D
A
E
N
E
Y
L
V
Q
E
A
L
D
R
L
M
D
--
G
R
T
V
L
V
I
A
H
R
L
S
T
I
K
N
A
N
M
V
A
V
L
D
Q
G
K
I
T
E
Y
G
K
H
E
E
L
L
S
K
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
104
HHSearch
78.73
22%
-112
- C2 -
3WMG
6
?
A:
[14-583]
------------------------------------------------------------------------------------
A
R
R
I
F
A
L
A
W
S
S
S
A
T
M
I
V
I
G
F
I
A
S
I
L
E
G
A
T
L
P
A
F
A
I
--
V
F
G
R
--
M
F
Q
V
F
T
K
S
K
S
Q
I
E
---
G
E
T
W
K
Y
S
V
-
G
F
V
G
I
G
V
F
E
-
F
I
V
A
G
S
R
T
A
L
F
G
I
A
S
E
R
L
A
R
D
L
R
V
A
A
F
------
S
N
L
V
-----
E
-----
Q
D
V
T
Y
F
D
---
R
RKA
G
E
L
G
G
K
-
L
-
N
N
D
V
Q
V
I
Q
Y
S
----
F
S
K
-
L
G
A
V
L
F
N
L
A
Q
C
V
V
G
I
I
V
A
F
I
F
A
P
A
-
L
T
G
-
V
L
I
-
A
L
S
P
L
V
-
V
L
A
V
V
V
Q
M
I
---
E
M
S
G
N
T
K
R
S
S
-
E
A
Y
A
S
A
G
S
V
A
A
E
V
F
S
N
I
R
T
T
K
A
F
E
A
E
R
Y
E
T
Q
R
Y
G
S
K
L
D
P
L
Y
R
L
-------
G
R
R
R
Y
I
S
-----
D
G
L
F
-----
F
G
L
S
M
L
V
I
F
C
-
V
Y
A
L
A
L
W
W
G
--------
G
Q
L
I
A
R
G
S
L
N
L
G
N
L
L
T
A
F
F
S
A
I
L
G
F
M
-
G
V
G
Q
A
A
Q
V
W
P
D
V
T
R
G
L
G
A
G
G
E
L
F
A
M
I
D
--
R
-
V
P
Q
Y
R
----
R
-
P
D
PG
A
E
V
V
T
Q
P
L
V
L
----
K
Q
G
I
V
F
E
-----
N
V
H
------
F
R
Y
P
T
R
M
N
V
E
V
L
R
G
I
S
L
T
I
P
N
G
K
T
V
A
I
V
G
G
S
G
A
G
K
S
T
I
I
Q
L
L
M
R
F
Y
D
I
E
PQG
G
G
L
L
L
F
D
G
T
P
A
W
N
Y
D
F
H
A
L
R
S
Q
I
G
L
V
S
Q
E
P
V
L
F
S
G
T
I
R
D
N
I
L
--
Y
G
--
K
R
D---
A
T
D
--
E
E
-
V
I
Q
A
L
R
E
A
N
A
Y
S
F
V
M
A
L
P
D
G
L
D
T
E
V
G
E
R
G
L
A
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
I
L
K
H
P
T
L
L
C
L
D
E
S
T
S
A
L
D
A
E
S
E
A
L
V
Q
E
A
L
D
R
M
M
A
S
D
G
V
T
S
V
V
I
A
H
R
L
S
T
V
A
R
A
D
L
I
L
V
M
Q
D
G
V
V
V
E
Q
G
N
H
S
E
L
M
A
L
G
P
S
G
F
Y
Y
Q
L
V
E
K
Q
L
A
S
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
122
Fugue
77.50
22%
-91
* C1 *
3B60
2
MSBA_SALTY
A:
[10-581]
----------------------------------------------------------------------------------
W
Q
T
F
R
R
L
W
P
T
I
A
P
F
K
A
G
L
I
V
A
G
I
A
L
I
L
N
A
A
S
D
T
F
M
L
S
--
L
L
K
P
--
L
L
D
D
G
F
G
K
T
D
--
R
---
S
V
L
L
W
M
P
L
-
V
V
I
G
L
M
I
L
R
-
G
I
T
S
Y
I
S
S
Y
C
I
S
W
V
S
G
K
V
V
M
T
M
R
R
R
L
F
------
G
H
M
M
G
MPVA
F
-----
F
D
K
Q
-
S
T
---
G
---
T
L
L
-
S
R
-
I
-
T
Y
D
S
E
Q
V
A
S
S
----
S
S
G
A
L
I
T
V
V
R
E
G
A
S
I
I
G
L
F
I
M
M
F
Y
Y
S
W
Q
-
L
S
I
-
I
L
V
-
V
L
A
P
I
V
-
S
I
A
I
R
V
V
S
K
---
R
F
R
S
I
S
K
N
M
Q
-
N
T
M
G
Q
V
T
T
S
A
E
Q
M
L
K
G
H
K
E
V
L
I
F
G
G
Q
E
V
E
T
K
R
F
D
K
V
S
N
K
M
R
L
Q
-------
G
M
K
M
V
S
A
-----
S
S
I
S
-----
D
P
I
I
Q
L
I
A
S
L
-
A
L
A
F
V
L
Y
A
A
--------
S
F
P
S
V
M
D
S
L
T
A
G
T
I
T
V
V
F
S
S
M
I
A
L
M
R
-
P
L
K
S
L
T
N
V
N
A
Q
F
Q
R
G
M
A
A
C
Q
T
L
F
A
I
L
D
--
S
-
E
Q
E
K
D
----
E
G
K
R
-------
V
I
D
R
A
----
T
G
D
L
E
F
R
-----
N
V
T
------
F
T
Y
P
G
R
-
E
V
P
A
L
R
N
I
N
L
K
I
P
A
G
K
T
V
A
L
V
G
R
S
G
S
G
K
S
T
I
A
S
L
I
T
R
F
Y
D
I
D
---
E
G
H
I
L
M
D
G
H
D
L
R
E
Y
T
L
A
S
L
R
N
Q
V
A
L
V
S
Q
N
V
H
L
F
N
D
T
V
A
N
N
I
A
YA
R
T
--
E
E
----
Y
S
R
--
E
Q
-
I
E
E
A
A
R
M
A
Y
A
M
D
F
I
N
K
M
D
N
G
L
D
T
I
I
G
E
N
G
V
L
L
S
G
G
Q
R
Q
R
I
A
I
A
R
A
L
L
R
D
S
P
I
L
I
L
D
E
A
T
S
A
L
D
T
E
S
E
R
A
I
Q
A
A
L
D
E
L
Q
--
K
N
R
T
S
L
V
I
A
H
R
L
S
T
I
E
Q
A
D
E
I
V
V
V
E
D
G
I
I
V
E
R
G
T
H
S
E
L
L
A
Q
H
G
V
Y
A
Q
L
H
K
M
Q
F
G
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
101
HHSearch
76.06
22%
-93
- C1 -
3B60
2
MSBA_SALTY
A:
[13-574]
-------------------------------------------------------------------------------------
F
R
R
L
W
P
T
I
A
P
F
K
A
G
L
I
V
A
G
I
A
L
I
L
N
A
A
S
D
T
F
M
L
S
--
L
L
K
P
--
L
L
D
D
G
F
G
K
T
D
--
R
---
S
V
L
L
W
M
P
L
-
V
V
I
G
L
M
I
L
R
-
G
I
T
S
Y
I
S
S
Y
C
I
S
W
V
S
G
K
V
V
M
T
M
R
R
R
L
F
------
G
H
M
M
-----
G
-----
M
P
V
A
F
F
D
KQS
T
---
G
T
L
-
L
S
R
I
-
T
Y
D
S
E
Q
V
A
S
S
----
S
S
G
A
L
I
T
V
V
R
E
G
A
S
I
I
G
L
F
I
M
M
F
Y
Y
S
W
Q
-
L
S
I
-
I
L
V
-
V
L
A
P
I
V
-
S
I
A
I
R
V
V
S
K
---
R
F
R
S
I
S
K
N
M
Q
-
N
T
M
G
Q
V
T
T
S
A
E
Q
M
L
K
G
H
K
E
V
L
I
F
G
G
Q
E
V
E
T
K
R
F
D
K
V
S
N
K
M
R
L
Q
-------
G
M
K
M
V
S
A
-----
S
S
I
S
-----
D
P
I
I
Q
L
I
A
S
L
-
A
L
A
F
V
L
Y
A
A
--------
S
F
P
S
V
M
D
S
L
T
A
G
T
I
T
V
V
F
S
S
M
I
A
L
M
R
-
P
L
K
S
L
T
N
V
N
A
Q
F
Q
R
G
M
A
A
C
Q
T
L
F
A
I
L
D
--
S
-
E
Q
E
K
D
----
E
-
G
K
R------
V
I
D
R
A
----
T
G
D
L
E
F
R
-----
N
V
T
------
F
T
Y
P
G
R
-
E
V
P
A
L
R
N
I
N
L
K
I
P
A
G
K
T
V
A
L
V
G
R
S
G
S
G
K
S
T
I
A
S
L
I
T
R
F
Y
D
I
D
---
E
G
H
I
L
M
D
G
H
D
L
R
E
Y
T
L
A
S
L
R
N
Q
V
A
L
V
S
Q
N
V
H
L
F
N
D
T
V
A
N
N
I
A
--
Y
A
--
R
T
EE--
Y
S
R
--
E
Q
-
I
E
E
A
A
R
M
A
Y
A
M
D
F
I
N
K
M
D
N
G
L
D
T
I
I
G
E
N
G
V
L
L
S
G
G
Q
R
Q
R
I
A
I
A
R
A
L
L
R
D
S
P
I
L
I
L
D
E
A
T
S
A
L
D
T
E
S
E
R
A
I
Q
A
A
L
D
E
L
Q
K
--
N
R
T
S
L
V
I
A
H
R
L
S
T
I
E
Q
A
D
E
I
V
V
V
E
D
G
I
I
V
E
R
G
T
H
S
E
L
L
A
Q
H
G
V
Y
A
Q
L
H
K
M
Q
F
G
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
73.98
25%
-106
- C2 -
4RY2
-
?
A:
[219-712]
------------------------------------------------------------------------------------------------------------------------------------------------------------
I
F
L
L
Q
-
I
F
L
N
Y
Y
R
S
I
L
V
T
K
L
G
M
S
I
D
K
S
I
M
M
E
Y
Y
------
S
H
V
L
-----
K
LPM
N
F
F
N
S
R
-
K
V
---
G
---
E
I
I
-
S
R
-
F
-
M
-
D
A
S
K
I
R
Q
A
----
I
S
G
A
T
L
T
I
M
I
D
T
I
M
A
V
I
G
G
I
L
L
Y
I
Q
N
S
S
-
L
F
F
-
I
S
F
-
I
I
I
L
L
Y
G
I
I
V
T
V
F
N
K
--------
P
I
Q
N
A
N
R
Q
I
M
E
D
N
A
K
L
T
S
A
L
V
E
S
V
K
G
I
E
T
I
K
S
F
G
A
----
E
E
Q
T
E
K
S
T
R
D
K
-------
I
E
T
V
M
K
S
-----
S
F
K
E
-----
G
M
L
--
Y
I
N
L
S
S
L
T
G
I
V
A
G
L
G
G
I
V
I
L
W
A
G
A
Y
N
V
I
K
G
N
M
S
G
G
Q
L
L
A
F
N
A
L
L
A
Y
F
L
T
-
P
V
K
N
L
I
D
L
Q
P
L
I
Q
T
A
V
V
A
S
N
R
L
G
E
I
L
E
--
L
-
A
T
E
K
E
----
L
--------------------
G
D
I
E
F
R
-----
N
V
D
------
F
-
R
Y
G
L
-
R
K
P
V
L
K
N
I
N
L
T
I
P
K
G
K
T
V
A
I
V
G
E
S
G
S
G
K
T
T
L
A
K
L
L
M
N
F
Y
S
P
E
---
K
G
D
I
L
I
N
G
H
S
I
K
N
I
S
L
E
L
I
R
K
K
I
A
F
V
S
Q
D
V
F
I
F
S
G
T
V
K
E
N
L
C
--
L
G
--
N
E
N---
V
D
M
--
D
E
-
I
I
K
A
A
K
M
A
N
A
H
D
F
I
E
K
L
P
L
K
Y
D
T
F
L
N
E
S
G
A
N
L
S
E
G
Q
K
Q
R
L
A
I
A
R
A
L
L
K
K
P
D
I
L
I
L
D
E
A
T
S
N
L
D
S
I
T
E
N
H
I
K
D
A
I
Y
G
L
E
--
D
D
V
T
V
I
I
I
A
H
R
L
S
T
I
V
N
C
D
K
I
Y
L
L
K
D
G
E
I
V
E
S
G
S
H
T
E
L
I
A
L
K
G
C
Y
F
K
M
W
K
Q
T
E
N
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
73.19
25%
-97
- C2 -
4S0F
2
?
A:
[219-712]
------------------------------------------------------------------------------------------------------------------------------------------------------------
I
F
L
L
Q
-
I
F
L
N
Y
Y
R
S
I
L
V
T
K
L
G
M
S
I
D
K
S
I
M
M
E
Y
Y
------
S
H
V
L
-----
K
LP
M
N
F
F
N
S
R
-
K
V
---
G
---
E
I
I
-
S
R
-
F
-
M
-
D
A
S
K
I
R
Q
A
----
I
S
G
A
T
L
T
I
M
I
D
T
I
M
A
V
I
G
G
I
L
L
Y
I
Q
N
S
S
-
L
F
F
-
I
S
F
-
I
I
I
L
L
Y
G
I
I
V
T
V
F
N
K
--------
P
I
Q
N
A
N
R
Q
I
M
E
D
N
A
K
L
T
S
A
L
V
E
S
V
K
G
I
E
T
I
K
S
F
G
A
----
E
E
Q
T
E
K
S
T
R
D
K
-------
I
E
T
V
M
K
S
-----
S
F
K
E
-----
G
M
L
--
Y
I
N
L
S
S
L
T
G
I
V
A
G
L
G
G
I
V
I
L
W
A
G
A
Y
N
V
I
K
G
N
M
S
G
G
Q
L
L
A
F
N
A
L
L
A
Y
F
L
T
-
P
V
K
N
L
I
D
L
Q
P
L
I
Q
T
A
V
V
A
S
N
R
L
G
E
I
L
E
--
L
-
A
T
E
K
E
----
L
-
R
E
-------
D
S
D
D
F
VISL
K
G
D
I
E
F
R
-----
N
V
D
------
F
-
R
Y
G
L
-
R
K
P
V
L
K
N
I
N
L
T
I
P
K
G
K
T
V
A
I
V
G
E
S
G
S
G
K
T
T
L
A
K
L
L
M
N
F
Y
S
P
E
---
K
G
D
I
L
I
N
G
H
S
I
K
N
I
S
L
E
L
I
R
K
K
I
A
F
V
S
Q
D
V
F
I
F
S
G
T
V
K
E
N
L
C
--
L
G
--
N
E
N---
V
D
M
--
D
E
-
I
I
K
A
A
K
M
A
N
A
H
D
F
I
E
K
L
P
L
K
Y
D
T
F
L
N
E
S
G
A
N
L
S
E
G
Q
K
Q
R
L
A
I
A
R
A
L
L
K
K
P
D
I
L
I
L
D
Q
A
T
S
N
L
D
S
I
T
E
N
H
I
K
D
A
I
Y
G
L
E
--
D
D
V
T
V
I
I
I
A
H
R
L
S
T
I
V
N
C
D
K
I
Y
L
L
K
D
G
E
I
V
E
S
G
S
H
T
E
L
I
A
L
K
G
C
Y
F
K
M
W
K
Q
T
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
72.61
25%
-108
- C2 -
4A82
-
Y1866_STAAM
A:
[31-564]
-----------------------------------------------------------------------------------------------------------------
M
L
I
P
L
L
I
K
Y
A
I
D
GV
I
N
N
H
A
L
T
T
D
E
--
K
---
V
H
H
L
T
I
A
I
G
I
A
L
F
I
F
V
I
V
R
P
P
I
E
F
I
R
Q
Y
L
A
Q
W
T
S
N
K
I
L
Y
D
I
R
K
K
L
Y
N
H
L
Q
A
L
S
A
R
F
-----
Y
-----
A
N
N
Q
-
V
G
-------
Q
V
I
-
S
R
-
V
-
I
N
D
V
E
Q
T
K
D
F
----
I
L
T
G
L
M
N
I
W
L
D
C
I
T
I
I
I
A
L
S
I
M
F
F
L
D
V
K
-
L
T
L
-
A
A
L
F
I
F
P
F
Y
I
-
L
T
V
Y
V
F
F
G
R
---
L
R
K
L
T
R
E
R
S
Q
-
A
L
A
E
V
Q
G
F
L
-
H
E
R
V
Q
G
I
S
V
V
K
S
F
A
I
E
D
N
E
A
K
N
F
D
K
K
N
T
N
F
L
-
T
-------
R
A
L
K
H
T
R
W
N
A
Y
S
F
A
A
I
-----
N
T
V
T
D
I
G
P
I
-----
I
V
I
G
V
G
--------
A
Y
L
A
I
S
G
S
I
T
V
G
T
L
A
A
F
V
G
Y
L
E
L
L
F
G
-
P
L
R
R
L
V
A
S
F
T
T
L
T
Q
S
F
A
S
M
D
R
V
F
Q
L
I
D
--
E
D
Y
D
I
K
N
GVGA
Q
-
P
I
-------
E
I
K
Q
------
G
R
I
D
I
D
-----
H
V
S
------
F
Q
Y
N
D
N
-
E
A
P
I
L
K
D
I
N
L
S
I
E
K
G
E
T
V
A
F
V
G
M
S
G
G
G
K
S
T
L
I
N
L
I
P
R
F
Y
D
V
T
---
S
G
Q
I
L
I
D
G
H
N
I
K
D
F
L
T
G
S
L
R
N
Q
I
G
L
V
Q
Q
D
N
I
L
F
S
D
T
V
K
E
N
I
L
--
L
G
--
R
P
----
T
A
T
--
D
E
E
V
V
E
A
A
K
M
A
N
A
H
D
F
I
M
N
L
P
Q
G
Y
D
T
E
V
G
E
R
G
V
K
L
S
G
G
Q
K
Q
R
L
S
I
A
R
I
F
L
N
N
P
P
I
L
I
L
D
E
A
T
S
A
L
D
L
E
S
E
S
I
I
Q
E
A
L
D
V
L
-
S
-
K
D
R
T
T
L
I
V
A
H
R
L
S
T
I
T
H
A
D
K
I
V
V
I
E
N
G
H
I
V
E
T
G
T
H
R
E
L
I
A
K
Q
G
A
Y
E
H
L
Y
S
I
Q
N
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
128
Fugue
69.14
20%
-99
- C1 -
4F4C
3
PGP1_CAEEL
A:
[4-1306]
N
G
S
L
R
Q
S
L
R
T
L
D
S
F
SLA
P
E
D
V
L
K
T
A
I
K
T
V
E
D
Y
EGDNIDSNG
E
I
K
I
TRDEVV
N
K
V
S
I
P
Q
L
Y
RYTT
T
L
E
K
L
L
L
F
I
G
T
L
V
A
V
I
T
G
A
G
L
P
L
M
S
I
L
Q
G
K
V
S
Q
A
F
I
N
E
Q
I
V
I
N
N
N
G
S
T
F
L
P
T
G
Q
N
--
Y
T
K
T
--
D
F
E
H
D
V
M
N
V
V
--
W
---
S
Y
A
A
M
T
V
G
-
M
W
A
A
G
Q
I
T
V
-
T
C
Y
L
Y
V
A
E
Q
M
N
N
R
L
R
R
E
F
V
K
S
I
L
-
R
Q
E
------
I
S
W
F
-----
D
-----
T
N
---
H
S
---
G
---
T
L
A
-
T
K
-
L
-
F
D
N
L
E
R
V
K
E
G
----
T
G
D
K
I
G
M
A
F
Q
Y
L
S
Q
F
I
T
G
F
I
V
A
F
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H
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-
W
-
Q
L
T
-
L
V
M
-
L
A
V
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P
I
-
Q
A
L
C
G
F
A
I
A
---
K
S
M
S
T
F
A
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R
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-
T
L
R
Y
A
K
A
G
K
V
V
E
E
T
I
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--
I
R
T
V
V
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L
N
G
L
R
Y
E
L
E
R
Y
S
T
A
V
E
E
A
-------
K
K
A
G
V
L
K
-----
G
L
F
L
G
I
S
F
G
A
M
Q
A
S
N
F
I
S
F
-
A
L
A
F
Y
I
G
V
G
--------
W
V
H
D
G
S
L
N
F
G
D
M
L
T
T
F
S
S
V
M
M
G
S
M
A
---
L
G
L
A
G
P
Q
L
A
V
L
G
T
A
Q
G
A
A
S
G
I
Y
E
V
L
D
--
R
-
K
P
V
I
D
----
S
-
S
S
-------
K
A
G
R
K
DMKI
K
G
D
I
T
V
E
-----
N
V
H
F
-----
T
Y
P
S
R
P
-
D
V
P
I
L
R
G
M
N
L
R
V
N
A
G
Q
T
V
A
L
V
G
S
S
G
C
G
K
S
T
I
I
S
L
L
L
R
Y
Y
D
V
L
---
K
G
K
I
T
I
D
G
V
D
V
R
D
I
N
L
E
F
L
R
K
N
V
A
V
V
S
Q
E
P
A
L
F
N
C
T
I
E
E
N
I
S
--
L
G
--
K
E
G---
I
T
R
--
E
E
-
M
V
A
A
C
K
M
A
N
A
E
K
F
I
K
T
L
P
N
G
Y
N
T
L
V
G
D
R
G
T
Q
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
L
V
R
N
P
K
I
L
L
L
D
E
A
T
S
A
L
D
A
E
S
E
G
I
V
Q
Q
A
L
D
K
A
A
--
K
G
R
T
T
I
I
I
A
H
R
L
S
T
I
R
N
A
D
L
I
I
S
C
K
N
G
Q
V
V
E
V
G
D
H
R
A
L
M
A
Q
Q
G
L
Y
Y
D
L
V
T
A
Q
T
F
T
D
A
V
D
S
A
A
E
G
E
R
I
-
G
K
D
A
L
S
R
L
K
Q
E
L
E
ENNAQKTN
L
F
E
I
L
Y
H
A
RPH
A
L
S
L
F
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G
M
S
T
A
T
I
G
G
F
I
Y
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Y
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V
F
F
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S
F
M
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AGNPADFL
S
Q
G
H
F
W
A
L
M
F
L
V
L
A
A
A
Q
G
I
C
S
F
L
M
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F
F
M
G
I
A
S
E
S
L
T
R
D
L
R
N
K
L
F
R
N
V
L
S
QHIGFFDSPQNA
S
G
K
I
S
T
R
L
A
T
D
V
P
N
L
R
T
A
I
D
F
R
F
S
T
V
I
T
T
L
V
S
M
V
A
G
I
G
L
A
F
F
Y
G
W
Q
M
A
L
L
I
I
A
I
L
P
I
V
A
F
G
Q
Y
L
R
G
RRFTGKNVKSA
S
E
F
A
D
S
G
K
I
A
I
E
A
I
E
N
V
R
T
V
Q
A
L
AR
E
D
T
F
Y
E
N
F
C
E
K
L
D
I
P
H
K
E
A
I
K
E
A
F
I
Q
G
L
S
Y
G
C
A
S
S
V
L
Y
L
L
N
T
C
A
Y
R
M
G
L
A
L
I
I
TDPPTMQ
P
M
R
V
L
R
V
M
Y
A
I
T
I
S
T
S
TLGFAT
S
Y
F
P
E
Y
A
K
A
T
F
A
G
G
I
I
F
G
M
L
R
KISKIDSLSLAGEKKKLYGK
V
I
F
K
N
V
R
F
A
Y
PERPEIEILK
G
L
S
F
S
V
E
PG
Q
T
L
A
L
V
G
P
S
GCGKST
V
V
A
L
L
E
RFYDTL
G
G
E
I
F
I
DGSEIKTLN
P
E
H
T
R
S
Q
I
A
I
V
S
Q
E
P
T
L
F
DCS
I
A
E
N
I
I
YGLDPSSVT
M
A
Q
V
E
E
A
A
R
L
A
NI
H
N
F
I
A
E
LPEGFETRVGDRGTQLS
G
G
Q
K
Q
R
I
A
I
A
R
A
L
V
R
NPK
I
L
L
L
D
EATSALDT
E
S
E
K
V
V
Q
E
A
L
D
R
A
R
EG
R
T
C
I
V
I
A
HRLNTVMNAD
C
I
A
V
V
S
NGTII
E
K
G
T
H
T
Q
L
M
S
E
K
13
PsiBlast_PDB
61.28
32%
-103
- C2 -
4Q4J
-
Y288_THEMA
B:
[276-577]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
L
I
S
G
F
G
--------
G
W
L
A
L
K
D
I
I
T
V
G
T
-
I
A
T
F
I
G
Y
S
R
Q
F
T
R
P
L
N
E
L
S
N
Q
F
N
M
I
Q
M
A
L
A
S
A
E
R
I
F
E
I
L
D
LE
E
-
E
K
D
D
P
----
D
-
A
V
-------
E
L
R
E
V
----
R
G
E
I
E
F
K
N
V
W
F
-
S
Y
D
------
K
K
K
P
------
V
L
K
D
I
T
F
H
I
K
P
G
Q
K
V
A
L
V
G
P
T
G
S
G
K
T
T
I
V
N
L
L
M
R
F
Y
D
V
D
---
R
G
Q
I
L
V
D
G
I
D
I
R
K
I
K
R
S
S
L
R
S
S
I
G
I
V
L
Q
D
T
I
L
F
S
T
T
V
K
E
N
L
---
K
Y
--
G
N
----
P
G
A
T
D
E
E
-
I
K
E
A
A
K
L
T
H
S
D
H
F
I
K
H
L
P
E
G
Y
E
T
V
L
T
D
N
G
E
D
L
S
Q
G
Q
R
Q
L
L
A
I
T
R
A
F
L
A
N
P
K
I
L
I
L
D
E
A
T
C
N
V
D
T
K
T
E
K
S
I
Q
A
A
M
W
K
L
-
M
-
E
G
K
T
S
I
I
I
A
H
R
L
N
T
I
K
N
A
D
L
I
I
V
L
R
D
G
E
I
V
E
M
G
K
H
D
E
L
I
Q
K
R
G
F
Y
Y
E
L
F
T
S
Q
Y
G
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
61.00
32%
-111
- C2 -
4Q4A
1
Y288_THEMA
B:
[276-577]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
L
I
S
G
F
G
--------
G
W
L
A
L
K
D
I
I
T
V
G
T
-
I
A
T
F
I
G
Y
S
R
Q
F
T
R
P
L
N
E
L
S
N
Q
F
N
M
I
Q
M
A
L
A
S
A
E
R
I
F
E
I
L
D
LE
E
-
E
K
D
D
P
----
D
-
A
V
-------
E
L
R
E
V
----
R
G
E
I
E
F
K
N
V
W
F
-
S
Y
D
------
K
K
K
P
------
V
L
K
D
I
T
F
H
I
K
P
G
Q
K
V
A
L
V
G
P
T
G
S
G
K
T
T
I
V
N
L
L
M
R
F
Y
D
V
D
---
R
G
Q
I
L
V
D
G
I
D
I
R
K
I
K
R
S
S
L
R
S
S
I
G
I
V
L
Q
D
T
I
L
F
S
T
T
V
K
E
N
L
---
K
Y
--
G
N
----
P
G
A
T
D
E
E
-
I
K
E
A
A
K
L
T
H
S
D
H
F
I
K
H
L
P
E
G
Y
E
T
V
L
T
D
N
G
E
D
L
S
Q
G
Q
R
Q
L
L
A
I
T
R
A
F
L
A
N
P
K
I
L
I
L
D
E
A
T
S
N
V
D
T
K
T
E
K
S
I
Q
A
A
M
W
K
L
-
M
-
E
G
K
T
S
I
I
I
A
H
R
L
N
T
I
K
N
A
D
L
I
I
V
L
R
D
G
E
I
V
E
M
G
K
H
D
E
L
I
Q
K
R
G
F
Y
Y
E
L
F
T
S
Q
Y
G
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
60.74
32%
-107
- C2 -
4Q4H
-
Y288_THEMA
B:
[276-577]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
L
I
S
G
F
G
--------
G
W
L
A
L
K
D
I
I
T
V
G
T
-
I
A
T
F
I
G
Y
S
R
Q
F
T
R
P
L
N
E
L
S
N
Q
F
N
M
I
Q
M
A
L
A
S
A
E
R
I
F
E
I
L
D
L
E
E
-
E
K
D
D
P
----
D
-
A
V
-------
E
L
R
E
V
----
R
G
E
I
E
F
K
N
V
W
F
-
S
Y
D
------
K
K
K
P
------
V
L
K
D
I
T
F
H
I
K
P
G
Q
K
V
A
L
V
G
P
T
G
S
G
K
T
T
I
V
N
L
L
M
R
F
Y
D
V
D
---
R
G
Q
I
L
V
D
G
I
D
I
R
K
I
K
R
S
S
L
R
S
S
I
G
I
V
L
Q
D
T
I
L
F
S
T
T
V
K
E
N
L
---
K
Y
--
G
N
----
P
G
A
T
D
E
E
-
I
K
E
A
A
K
L
T
H
S
D
H
F
I
K
H
L
P
E
G
Y
E
T
V
L
T
D
N
G
E
D
L
S
Q
G
Q
R
Q
L
L
A
I
T
R
A
F
L
A
N
P
K
I
L
I
L
D
E
A
T
S
N
V
D
T
K
T
E
K
S
I
Q
A
A
M
W
K
L
-
M
-
E
G
K
T
S
I
I
I
A
H
R
L
N
T
I
K
N
A
D
L
I
I
V
L
R
D
G
E
I
V
E
M
G
K
H
D
E
L
I
Q
K
R
G
F
Y
Y
E
L
F
T
S
Q
Y
G
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
60.49
32%
-109
- C2 -
3QF4
1
Y288_THEMA
B:
[276-577]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
L
I
S
G
F
G
--------
G
W
L
A
L
K
D
I
I
T
V
G
T
-
I
A
T
F
I
G
Y
S
R
Q
F
T
R
P
L
N
E
L
S
N
Q
F
N
M
I
Q
M
A
L
A
S
A
E
R
I
F
E
I
L
D
LE
E
-
E
K
D
D
P
----
D
-
A
V
-------
E
L
R
E
V
----
R
G
E
I
E
F
K
N
V
W
F
-
S
Y
D
------
K
K
K
P
------
V
L
K
D
I
T
F
H
I
K
P
G
Q
K
V
A
L
V
G
P
T
G
S
G
K
T
T
I
V
N
L
L
M
R
F
Y
D
V
D
---
R
G
Q
I
L
V
D
G
I
D
I
R
K
I
K
R
S
S
L
R
S
S
I
G
I
V
L
Q
D
T
I
L
F
S
T
T
V
K
E
N
L
---
K
Y
--
G
N
----
P
G
A
T
D
E
E
-
I
K
E
A
A
K
L
T
H
S
D
H
F
I
K
H
L
P
E
G
Y
E
T
V
L
T
D
N
G
E
D
L
S
Q
G
Q
R
Q
L
L
A
I
T
R
A
F
L
A
N
P
K
I
L
I
L
D
E
A
T
S
N
V
D
T
K
T
E
K
S
I
Q
A
A
M
W
K
L
-
M
-
E
G
K
T
S
I
I
I
A
H
R
L
N
T
I
K
N
A
D
L
I
I
V
L
R
D
G
E
I
V
E
M
G
K
H
D
E
L
I
Q
K
R
G
F
Y
Y
E
L
F
T
S
Q
Y
G
L
V
V
E
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
59.36
36%
-111
- C2 -
4AYX
2
ABCBA_HUMAN
A:
[320-573]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
----
R
-
E
P
-------
K
L
P
F
N
----
E
G
V
I
L
N
E
KSFQG
A
L
E
F
K
N
V
H
F
A
Y
P
A
R
P
-
E
V
P
I
F
Q
D
F
S
L
S
I
P
S
G
S
V
T
A
L
V
G
P
S
G
S
G
K
S
T
V
L
S
L
L
L
R
L
Y
D
P
A
---
S
G
T
I
S
L
D
G
H
D
I
R
Q
L
N
P
V
W
L
R
S
K
I
G
T
V
S
Q
E
P
I
L
F
S
C
S
I
A
E
N
I
A
--
Y
G
--
A
D
DPSS
V
T
A
--
E
E
-
I
Q
R
V
A
E
V
A
N
A
V
A
F
I
R
N
F
P
Q
G
F
N
T
V
V
G
E
K
G
V
L
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
L
L
K
N
P
K
I
L
L
L
D
E
A
T
S
A
L
D
A
E
N
E
Y
L
V
Q
E
A
L
D
R
L
-
M
-
D
G
R
T
V
L
V
I
A
H
R
L
S
T
I
K
N
A
N
M
V
A
V
L
D
Q
G
K
I
T
E
Y
G
K
H
E
E
L
L
S
K
P
N
G
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
36
PsiBlast_CBE
58.26
35%
-112
- C2 -
4AYW
1
ABCBA_HUMAN
A:
[351-598]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
----
R
-
E
P
-------
K
L
P
F
N
----
E
G
V
I
L
N
E
KSFQG
A
L
E
F
K
N
V
H
F
A
Y
P
A
R
P
-
E
V
P
I
F
Q
D
F
S
L
S
I
P
S
G
S
V
T
A
L
V
G
P
S
G
S
G
K
S
T
V
L
S
L
L
L
R
L
Y
D
P
A
---
S
G
T
I
S
L
D
G
H
D
I
R
Q
L
N
P
V
W
L
R
S
K
I
G
T
V
S
Q
E
P
I
L
F
S
C
S
I
A
E
N
I
A
--
Y
G
--
A
D
DPSS
V
T
A
--
E
E
-
I
Q
R
V
A
E
V
A
N
A
V
A
F
I
R
N
F
P
Q
G
F
N
T
V
V
G
E
K
G
V
L
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
L
L
K
N
P
K
I
L
L
L
D
E
----
L
D
A
E
N
E
Y
L
V
Q
E
A
L
D
R
L
-
M
-
D
G
R
T
V
L
V
I
A
H
H
L
S
T
I
K
N
A
N
M
V
A
V
L
D
Q
G
K
I
T
E
Y
G
K
H
E
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
58.18
36%
-109
- C2 -
3ZDQ
-
ABCBA_HUMAN
A:
[320-572]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
----
R
-
E
P
-------
K
L
P
F
N
----
E
G
V
I
L
N
E
KSFQG
A
L
E
F
K
N
V
H
F
A
Y
P
A
R
P
-
E
V
P
I
F
Q
D
F
S
L
S
I
P
S
G
S
V
T
A
L
V
G
P
S
G
S
G
K
S
T
V
L
S
L
L
L
R
L
Y
D
P
A
---
S
G
T
I
S
L
D
G
H
D
I
R
Q
L
N
P
V
W
L
R
S
K
I
G
T
V
S
Q
E
P
I
L
F
S
C
S
I
A
E
N
I
A
--
Y
G
--
A
D
DPSS
V
T
A
--
E
E
-
I
Q
R
V
A
E
V
A
N
A
V
A
F
I
R
N
F
P
Q
G
F
N
T
V
V
G
E
K
G
V
L
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
L
L
K
N
P
K
I
L
L
L
D
E
A
T
S
A
L
D
A
E
N
E
Y
L
V
Q
E
A
L
D
R
L
-
M
-
D
G
R
T
V
L
V
I
A
H
R
L
S
T
I
K
N
A
N
M
V
A
V
L
D
Q
G
K
I
T
E
Y
G
K
H
E
E
L
L
S
K
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
58.17
27%
3
- C- -
3B5X
-
MSBA_VIBCH
A:
[53-567]
---------------------------------------------------------------------------------------------------------------------------------
D
E
G
F
G
N
A
E
--
S
---
N
F
L
R
I
L
P
F
-
M
I
L
G
L
M
F
V
R
-
G
L
S
G
F
A
S
S
Y
C
L
S
W
V
S
G
N
V
V
M
Q
M
R
R
R
L
F
------
N
H
F
M
-----
H
-----
M
P
V
R
-
F
F
---
D
---
Q
E
S
-
T
G
-
G
-
L
L
S
R
I
T
Y
D
S
E
Q
V
A
G
A
T
S
R
A
L
V
S
I
V
R
E
G
A
S
I
I
G
L
L
T
L
M
F
W
N
S
W
Q
L
S
L
V
L
I
V
-
V
A
P
V
V
A
-
F
A
I
S
F
V
S
K
R
FRK
I
S
R
N
M
Q
T
A
M
G
-
H
V
T
S
S
A
E
Q
M
----
L
K
G
H
K
V
V
L
S
Y
G
G
Q
E
V
E
R
K
R
F
D
K
V
S
N
S
M
R
Q
Q
T
M
K
L
V
S
A
Q
S
I
A
D
P
V
-----
I
Q
M
I
-----
A
S
L
A
L
F
A
--------
V
L
F
L
A
--------
S
V
D
S
I
R
A
E
L
T
P
G
T
F
T
V
V
F
S
A
M
F
G
L
M
R
-
P
L
K
A
L
T
S
V
T
S
E
F
Q
R
G
M
A
A
C
Q
T
L
F
G
L
M
D
--
L
-
E
T
E
R
D
----
N
G
K
Y
-------
E
A
E
R
V
----
N
G
E
V
D
V
K
-----
D
V
T
------
F
T
Y
Q
G
K
-
E
K
P
A
L
S
H
V
S
F
S
I
P
Q
G
K
T
V
A
L
V
G
R
S
G
S
G
K
S
T
I
A
N
L
F
T
R
F
Y
D
V
D
---
S
G
S
I
C
L
D
G
H
D
V
R
D
Y
K
L
T
N
L
R
R
H
F
A
L
V
S
Q
N
V
H
L
F
N
D
T
I
A
N
N
I
A
--
Y
A
AE
G
E
----
Y
T
R
--
E
Q
-
I
E
Q
A
A
R
Q
A
H
A
M
E
F
I
E
N
M
P
Q
G
L
D
T
V
I
G
E
N
G
T
S
L
S
G
G
Q
R
Q
R
V
A
I
A
R
A
L
L
R
D
A
P
V
L
I
L
D
E
A
T
S
A
L
D
T
E
S
E
R
A
I
Q
A
A
L
D
E
L
Q
--
K
N
K
T
V
L
V
I
A
H
R
L
S
T
I
E
Q
A
D
E
I
L
V
V
D
E
G
E
I
I
E
R
G
R
H
A
D
L
L
A
Q
D
G
A
Y
A
Q
L
H
R
I
Q
F
G
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
57.05
36%
-102
- C2 -
4AYT
2
ABCBA_HUMAN
A:
[320-567]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
----
R
-
E
P
-------
K
L
P
F
N
----
E
G
V
I
L
N
E
KSFQG
A
L
E
F
K
N
V
H
F
A
Y
P
A
R
P
-
E
V
P
I
F
Q
D
F
S
L
S
I
P
S
G
S
V
T
A
L
V
G
P
S
G
S
G
K
S
T
V
L
S
L
L
L
R
L
Y
D
P
A
---
S
G
T
I
S
L
D
G
H
D
I
R
Q
L
N
P
V
W
L
R
S
K
I
G
T
V
S
Q
E
P
I
L
F
S
C
S
I
A
E
N
I
A
--
Y
G
--
A
D
DPSS
V
T
A
--
E
E
-
I
Q
R
V
A
E
V
A
N
A
V
A
F
I
R
N
F
P
Q
G
F
N
T
V
V
G
E
K
G
V
L
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
L
L
K
N
P
K
I
L
L
L
D
E
A
T
S
A
L
D
A
E
N
E
Y
L
V
Q
E
A
L
D
R
L
-
M
-
D
G
R
T
V
L
V
I
A
H
R
L
S
T
I
K
N
A
N
M
V
A
V
L
D
Q
G
K
I
T
E
Y
G
K
H
E
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
30
PsiBlast_CBE
57.00
31%
-101
- C2 -
4Q4A
2
?
A:
[314-578]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
R
V
L
E
V
L
N
--
E
-
K
P
A
I
E
E
A
D-
N
-
A
L
-------
A
L
P
N
V
----
E
G
S
V
S
F
E
-----
N
V
E
------
F
R
Y
F
E
N
-
T
D
P
V
L
S
G
V
N
F
S
V
K
P
G
S
L
V
A
V
L
G
E
T
G
S
G
K
S
T
L
M
N
L
I
P
R
L
I
D
P
E
---
R
G
R
V
E
V
D
E
L
D
V
R
T
V
K
L
K
D
L
R
G
H
I
S
A
V
P
Q
E
T
V
L
F
S
G
T
I
K
E
N
L
---
K
W
--
G
R
----
E
D
A
T
D
D
E
-
I
V
E
A
A
K
I
A
Q
I
H
D
F
I
I
S
L
P
E
G
Y
D
S
R
V
E
R
G
G
R
N
F
S
G
G
Q
K
Q
R
L
S
I
A
R
A
L
V
K
K
P
K
V
L
I
L
D
D
C
T
S
S
V
D
P
I
T
E
K
R
I
L
D
G
L
K
R
Y
-
T
-
K
G
C
T
T
F
I
I
T
Q
K
I
P
T
A
L
L
A
D
K
I
L
V
L
H
E
G
K
V
A
G
F
G
T
H
K
E
L
L
E
H
C
K
P
Y
R
E
I
Y
E
S
Q
F
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------