@TOME V2.2
(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 : S15A2_HUMAN: (2015-12-09 )
MNPFQKNESKETLFSPVSIEEVPPRPPSPPKKPSPTICGSNYPLSIAFIVVNEFCERFSYYGMKAVLILYFLYFLHWNEDTSTSIYHAFSSLCYFTPILGAAIADSWLGKFKTIIYLSLVYVLGHVIKSLGALPILGGQVVHTVLSLIGLSLIALGTGGIKPCVAAFGGDQFEEKHAEERTRYFSVFYLSINAGSLISTFITPMLRGDVQCFGEDCYALAFGVPGLLMVIALVVFAMGSKIYNKPPPEGNIVAQVFKCIWFAISNRFKNRSGDIPKRQHWLDWAAEKYPKQLIMDVKALTRVLFLYIPLPMFWALLDQQGSRWTLQAIRMNRNLGFFVLQPDQMQVLNPLLVLIFIPLFDFVIYRLVSKCGINFSSLRKMAVGMILACLAFAVAAAVEIKINEMAPAQPGPQEVFLQVLNLADDEVKVTVVGNENNSLLIESIKSFQKTPHYSKLHLKTKSQDFHFHLKYHNLSLYTEHSVQEKNWYSLVIREDGNSISSMMVKDTESRTTNGMTTVRFVNTLHKDVNISLSTDTSLNVGEDYGVSAYRTVQRGEYPAVHCRTEDKNFSLNLGLLDFGAAYLFVITNNTNQGLQAWKIEDIPANKMSIAWQLPQYALVTAGEVMFSVTGLEFSYSQAPSSMKSVLQAAWLLTIAVGNIIVLVVAQFSGLVQWAEFILFSCLLLVICLIFSIMGYYYVPVKTEDMRGPADKHIPHIQGNMIKLETKKTKL
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..--.....620.......630........640.......650......--.660....-...670.......680.......690....--...700.......710.....-..720.......-
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
-------MNPFQKNESKETLFSPV
S
I
EEVPPRPPSPPKKPSPTICGSNY
P
L
S
I
A
F
I
V
V
N
E
F
C
E
R
F
S
Y
Y
G
M
K
A
V
L
I
L
Y
-----
F
L
Y
------
F
------
L
------H-----WNEDT
S
T
S
I
Y
H
A
F
S
S
L
C
Y
F
T
P
I
L
G
A
A
I
A
D
S
W
L
G
K
F
K
T
I
I
Y
L
S
L
V
Y
V
L
G
H
V
I
K
SL--GALPI-L
G
G
Q
V
V
H
T
V
L
S
L
-
I
G
L
S
L
I
ALGTGG-
I
K
P
C
V
A
A-FGG
D
Q
F
E
E
K
H
A
E
E
R
T
R
Y
F
S
V
F
Y
L
S
INA
G
S
L
I
S
T
F
I
T
P
M
LRG
D
V
Q
C
FGE
D
C
Y
A
L
A
FGV
P
G
L
L
M
V
I
A
L
V
V
F
------
A
---------
M
G
--------
S
K
I-----YNKP--PPE-----------G
N
I
V
A
Q
V
F
K
C
I
-----
W
F
A
I
S
N
R
FK-----NRS-G------------------DI
P
K
---------------------
R
--
Q
--------
H
W
L
D
W
A
A
E
K
Y
P
----
K
Q
L
I
----
M
-----------
D
V
K
A
L
T
----
R
V
L
F
L
YI
P
L
----
P
M
F
W
A
L
L
DQQGS--
R
W
T
L
Q
A
----
I
R
MNRNL
G
F
F
V
LQP
D
Q
M
Q
V
L
N
P
L
L
V
L
I
F
I
P
L
F
-
D
F
--
V
I
Y
R
L
V
S
K
CGI
N
F
S
S
L
R
K
M
-------------
A
V
G
M
I
L
A
C
L
A
F
A
V
A
A
A
V
E
I
K
-
I
NEMAPAQP
G
P
Q
E
V
F
L
Q
V
L
N---LAD----D
E
V
K
V
T
V
V
GNEN
N
S
L
L
I
E
S
I
K
S
--
F
Q
KTPHY
S
K
L
H
L
K
TKSQ
D
F
H
F
H
L
K
Y
H
N
L
S
L
Y
T
EHSVQEK
N
W
Y
S
L
V
--
I
REDGN
S
I
S
S
M
M
VKDTESRTTNG
M
T
T
V
R
F
V
N
T
LHKD
V
N
I
S
LSTDTSLN-VGEDYGVS
A
Y
R
T
VQRGEY
P
-
A
V
H
C
R
TEDK
N
F
S
L
N
L
G
L
L
DFG
A
A
Y
L
F
V
I
TNNTNQG
L
Q
A
W
K
IEDIPAN
K
M
S
I
A
W
QLPQ--
Y
A
L
V
TA
G
E
V
M
F
S
V
TG
L
E
-
F
SYSQA
P
S
S
M
K
S
V
L
Q
A
A
W
L
L
T
IAVG
N
I
--
I
V
L
V
V
A
Q
F
-
S
G
L
V
Q
W
A
E
F
I
L
F
S
C
L
L
L
V
I
C
L
I
F
S
I
MG
Y
Y
Y
--
V
PVKTEDMRGPADKHIPHIQG-
N
M
I
K
L
ETKKTKL-
4
PsiBlast_PDB
81.26
30%
-122
- C3 -
4UVM
5
?
A:
[9-428]
-----------------------------------------------
K
W
P
R
Q
I
P
Y
I
I
A
S
E
A
C
E
R
F
S
F
Y
G
M
R
N
I
L
T
P
F
-----
L
M
T
------
A
------
L
LLSIP
E
E
-----
L
R
G
A
V
A
K
D
V
F
H
S
F
V
I
G
V
Y
F
F
P
L
L
G
G
W
I
A
D
R
F
F
G
K
Y
N
T
I
L
W
L
S
L
I
Y
C
V
G
H
A
F
L
A
I
------------
F
E
H
S
V
Q
G
F
Y
T
G
L
F
L
I
A
L
G
S
G
G
-
I
K
P
L
V
S
S
-
F
M
G
D
Q
F
D
Q
S
N
K
S
L
A
Q
K
A
F
D
M
F
Y
F
T
I
N
F
G
S
F
F
A
S
L
S
M
P
L
L
---
L
K
N
F
G
A
---
A
V
A
F
G
I
P
G
V
L
M
F
V
A
T
V
F
F
------
W
---------
L
G
--------
R
K
R
-----
Y
I
H
M
--
P
P
E
-----------
P
K
D
P
H
G
F
L
P
V
I
-----
R
S
A
L
L
T
K
V
E
-----
G
K
G
-
N
I
G
L
V
L
A
L
I
G
G
V
S
A
A
Y
A
L
V
N
I
P
T
LG
I
V
A
G
L
C
C
A
M
V
L
V
M
G
F
V
G
A
G
A
--
S
--------
L
Q
L
E
R
A
R
K
S
H
P
----
D
A
A
V
----
D
-----------
G
V
R
S
V
L
----
R
I
L
V
L
F
A
L
V
----
T
P
F
W
S
L
F
D
Q
K
A
S
--
T
W
I
L
Q
A
----
N
D
M
V
K
P
Q
W
F
---
E
P
A
M
M
Q
A
L
N
P
L
L
V
M
L
L
I
P
F
N
-
N
F
--
V
L
Y
P
A
I
E
R
M
G
V
K
L
T
A
L
R
K
M
-------------
G
A
G
I
A
I
T
G
L
S
W
I
V
V
G
T
I
Q
L
M
-
M
D
G
G
S
A
L
-----
S
I
F
W
Q
I
L
P
Y
A
L
L
T
F
----
G
E
V
L
V
S
A
T
G
L
E
F
A
Y
S
Q
A
P
K
A
M
K
--
G
T
I
M
S
F
W
T
L
S
V
T
V
G
N
L
W
V
L
L
A
N
V
S
V
K
S
P
T
V
T
E
Q
I
V
Q
T
G
M
S
V
T
A
F
Q
--
M
F
F
F
A
G
F
A
I
L
A
A
I
V
F
A
L
Y
A
R
S
Y
Q
M
Q
D
H
Y
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
32
Fugue
73.88
25%
-99
- C3 -
4IKW
13
?
A:
[3-494]
-------------
S
I
D
K
Q
Q
I
A
A
S
V
P
Q
R
G
F
F
G
H
P
K
-----------------
G
L
F
T
L
F
F
T
E
F
W
E
R
F
S
Y
Y
G
M
R
A
I
L
V
Y
Y
-----
M
Y
Y
------
E
------
V
------
S
KGGLG
L
D
E
H
L
A
L
A
I
M
S
I
Y
G
A
L
V
Y
M
S
G
I
I
G
G
W
L
A
D
R
V
F
G
T
S
R
A
V
F
Y
G
G
L
L
I
M
A
G
H
I
-------
A
L
A
I
-
P
G
G
----
V
A
A
L
F
-
V
S
M
A
L
I
V
L
G
T
G
L
-
L
K
P
N
V
S
S
-
I
V
G
D
M
Y
K
-
P
G
D
D
R
R
D
A
G
F
S
I
F
Y
M
G
I
N
L
G
A
F
L
A
P
L
V
V
G
T
A
G
M
K
Y
N
------
F
H
L
G
F
G
L
A
A
V
G
M
F
L
G
L
V
V
F
------
V
---------
A
T
--------
R
K
K
-----
N
L
G
L
--
A
-------------
G
T
Y
V
P
N
P
L
T
--------------------------------------------------------------------------------------
P
A
E
K
K
K
----
A
A
A
I
----
M
-----------
A
V
G
A
V
V
----
I
A
V
L
L
A
I
L
I
----
P
N
G
W
-------------------------------
F
T
V
E
T
F
I
S
L
V
G
I
L
G
I
I
I
P
I
I
Y
-
F
V
--
V
M
Y
R
S
--------
P
K
T
T
A
E
-------------
E
R
S
R
V
I
A
Y
I
P
L
F
V
A
S
A
M
F
W
A
-
I
Q
E
Q
G
S
T
---------
I
L
A
N
---
Y
A
D
----
K
R
T
Q
L
D
V
A
G
I
H
L
S
P
A
W
F
Q
S
L
N
P
--
L
F
I
I
I
L
A
P
V
F
A
W
M
W
V
K
L
G
-----------------------------------------------------------------------------------------------------
K
R
Q
P
T
I
P
Q
K
F
A
L
G
L
L
F
A
G
L
S
F
I
V
I
L
V
P
G
H
L
S
G
----------
G
G
L
V
H
P
I
W
L
V
L
S
--
Y
F
I
V
V
L
G
E
L
C
L
S
P
V
G
L
S
-
A
T
T
K
L
A
P
A
A
F
S
A
Q
T
M
S
L
W
F
L
S
N
A
A
A
Q
A
--
I
N
A
Q
L
V
R
F
Y
T
P
E
N
E
T
A
Y
F
G
T
I
G
G
A
A
L
V
L
G
L
I
L
L
A
I
------
A
P
R
I
G
R
L
M
K
G
-------------------------
2
PsiBlast_PDB
73.79
70%
-111
- C4 -
5A9H
1
?
A:
[2-194]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
A
S
Q
E
I
F
L
Q
V
L
N
---
L
A
D
----
G
D
V
K
V
T
V
L
G
S
R
N
N
S
L
L
V
E
S
V
S
S
--
F
Q
N
T
T
H
Y
S
K
L
H
L
E
A
K
S
Q
D
L
H
F
H
L
K
Y
N
S
L
S
V
H
N
D
H
S
V
E
E
K
N
C
Y
Q
L
L
--
I
H
Q
D
G
E
S
I
S
S
M
L
V
K
D
T
G
I
K
P
A
N
G
M
A
A
I
R
F
I
N
T
L
H
K
D
L
N
I
S
L
D
T
D
A
P
L
S
-
V
G
K
D
Y
G
V
S
A
Y
R
T
V
L
R
G
K
Y
P
-
A
V
H
C
E
T
E
D
K
V
F
S
L
D
L
G
Q
L
D
F
G
T
T
Y
L
F
V
I
T
N
-----
L
Q
A
W
K
A
E
D
I
------------------------------------------------------------------------------------------------------------------------------------------
30
Fugue
73.61
70%
-107
- C4 -
5A9H
1
?
A:
[1-194]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
A
A
S
Q
E
I
F
L
Q
V
L
N
---
L
A
D
----
G
D
V
K
V
T
V
L
G
S
R
N
N
S
L
L
V
E
S
V
S
S
--
F
Q
N
T
T
H
Y
S
K
L
H
L
E
A
K
S
Q
D
L
H
F
H
L
K
Y
N
S
L
S
V
H
N
D
H
S
V
E
E
K
N
C
Y
Q
L
L
--
I
H
Q
D
G
E
S
I
S
S
M
L
V
K
D
T
G
I
K
P
A
N
G
M
A
A
I
R
F
I
N
T
L
H
K
D
L
N
I
S
L
D
T
D
A
P
L
S
-
V
G
K
D
Y
G
V
S
A
Y
R
T
V
L
R
G
K
Y
P
-
A
V
H
C
E
T
E
D
K
V
F
S
L
D
L
G
Q
L
D
F
G
T
T
Y
L
F
V
I
T
N
-----
L
Q
A
W
K
A
E
D
I
------------------------------------------------------------------------------------------------------------------------------------------
31
Fugue
73.35
29%
-74
- C3 -
2XUT
-
?
A:
[13-500]
---------------------------------------------------
Q
I
P
Y
I
I
A
S
E
A
C
E
R
F
S
F
Y
G
M
R
N
I
L
T
P
F
-----
L
M
T
A
LLLSI
P
------
E
------
E
-----
L
R
G
A
V
A
K
D
V
F
H
S
F
V
I
G
V
Y
F
F
P
L
L
G
G
W
I
A
D
R
F
F
G
K
Y
N
T
I
L
W
L
S
L
I
Y
C
V
G
H
A
F
L
A
I
--
F
E
H
S
---------
V
Q
G
F
Y
-
T
G
L
F
L
I
A
L
G
S
G
G
-
I
K
P
L
V
S
S
-
F
M
G
D
Q
F
D
Q
S
N
K
S
L
A
Q
K
A
F
D
M
F
Y
F
T
I
N
F
G
S
F
F
A
S
L
S
M
P
L
L
L
K
N
F
G
------
A
A
V
A
F
G
I
P
G
V
L
M
F
V
A
T
V
F
F
------
W
---------
L
G
--------
R
K
R
-----
Y
I
H
M
--
P
V
E
-----------
G
K
G
N
I
G
L
V
L
A
L
-----
I
G
G
V
S
A
A
Y
A
-----
L
V
N
-
I
P
TLG
I
V
A
G
----------
L
C
C
A
---------------------
M
--
V
--------
L
V
M
G
F
V
G
A
G
A
S
----
L
Q
L
E
----
R
A
RKSHPD
A
A
V
D
G
V
R
S
V
L
----
R
I
L
V
L
F
A
L
V
----
T
P
F
W
S
L
F
D
Q
K
A
S
--
T
W
I
L
Q
A
----
N
D
M
V
K
P
---
Q
W
F
E
P
A
M
M
Q
A
L
N
P
L
L
V
M
L
L
I
P
F
N
-
N
F
--
V
T
A
L
R
K
M
G
A
G
I
A
I
T
G
L
S
W
I
V
V
G
T
I
Q
L
M
M
D
GGS
A
L
S
I
F
W
Q
I
L
P
Y
A
L
L
T
F
G
E
V
L
-
V
S
A
T
G
L
E
F
A
Y
S
Q
A
P
K
A
M
K
G
T
---
I
M
S
----
F
W
T
L
S
V
T
V
G
N
L
W
V
L
L
A
N
V
S
V
K
S
--
P
T
V
T
E
Q
I
V
Q
T
G
M
S
V
T
A
F
Q
M
F
F
F
A
G
F
A
I
L
A
A
I
V
F
A
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
73.26
30%
-110
- C3 -
2XUT
-
?
A:
[13-428]
---------------------------------------------------
Q
I
P
Y
I
I
A
S
E
A
C
E
R
F
S
F
Y
G
M
R
N
I
L
T
P
F
-----
L
M
T
------
A
------
L
LLSIP
E
E
-----
L
R
G
A
V
A
K
D
V
F
H
S
F
V
I
G
V
Y
F
F
P
L
L
G
G
W
I
A
D
R
F
F
G
K
Y
N
T
I
L
W
L
S
L
I
Y
C
V
G
H
A
F
L
A
I
------------
F
E
H
S
V
Q
G
F
Y
T
G
L
F
L
I
A
L
G
S
G
G
-
I
K
P
L
V
S
S
-
F
M
G
D
Q
F
D
Q
S
N
K
S
L
A
Q
K
A
F
D
M
F
Y
F
T
I
N
F
G
S
F
F
A
S
L
S
M
P
L
L
---
L
K
N
F
G
A
---
A
V
A
F
G
I
P
G
V
L
M
F
V
A
T
V
F
F
------
W
---------
L
G
--------
R
K
R
-----
Y
I
H
M
--
P
------------------------------------
V
E
-----
G
K
G
-
N
I
G
L
V
L
A
L
I
G
G
V
S
A
A
Y
A
L
V
N
I
P
T
LG
I
V
A
G
L
C
C
A
M
V
L
V
M
G
F
V
G
AG
A
--
S
--------
L
Q
L
E
R
A
R
K
S
H
P
----
D
A
A
V
----
D
-----------
G
V
R
S
V
L
----
R
I
L
V
L
F
A
L
V
----
T
P
F
W
S
L
F
D
Q
K
A
S
--
T
W
I
L
Q
A
----
N
D
M
V
K
P
Q
W
F
---
E
P
A
M
M
Q
A
L
N
P
L
L
V
M
L
L
I
P
F
N
-
N
F
--
V
------------
T
A
L
R
K
M
-------------
G
A
G
I
A
I
T
G
L
S
W
I
V
V
G
T
I
Q
L
M
-
M
D
G
G
S
A
L
-----
S
I
F
W
Q
I
L
P
Y
A
L
L
T
F
----
G
E
V
L
V
S
A
T
G
L
E
F
A
Y
S
Q
A
P
K
A
M
K
--
G
T
I
M
S
F
W
T
L
S
V
T
V
G
N
L
W
V
L
L
A
N
V
S
V
K
S
P
T
V
T
E
Q
I
V
Q
T
G
M
S
V
T
A
F
Q
--
M
F
F
F
A
G
F
A
I
L
A
A
I
V
F
A
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
66.62
29%
-112
- C3 -
4D2B
7
?
A:
[12-372]
-------------------------------------------------
P
L
G
L
S
T
L
F
M
T
E
M
W
E
R
F
S
Y
Y
G
M
R
A
I
L
-
L
Y
-----
Y
M
W
------
F
L
I
S
T
GD
L
------
H
-----
I
T
R
A
T
A
A
S
I
M
A
I
Y
A
S
M
V
Y
L
S
G
T
I
G
G
F
V
A
D
R
I
I
G
A
R
P
A
V
F
W
G
G
V
L
I
M
L
G
H
I
V
L
A
L
PF
G
A
S
A
L
-
F
G
S
I
I
------------
L
I
I
I
G
T
G
F
-
L
K
P
N
V
S
T
-
L
V
G
T
L
Y
D
E
-
H
D
R
R
R
D
A
G
F
S
I
F
V
F
G
I
N
L
G
A
----
F
I
A
P
L
I
V
G
A
A
Q
E
--
A
A
G
Y
H
V
A
F
S
L
A
A
I
G
M
F
I
G
L
L
V
Y
------
Y
---------
F
G
--------
G
K
K
TLDPH
Y
L
R
P
TD
P
L
A
-----------
P
E
E
V
K
P
L
L
V
K
V
-----
S
L
A
V
A
G
F
I
A
I
I
V
V
M
N
L
V
-
G
WN----------------
S
L
P
A
---------------------
Y
--
I
--------
N
L
L
T
I
V
A
I
A
I
P
V
F
Y
F
A
W
M
I
----
S
-----------------L---
R
V
V
-
S
Y
I
P
L
F
I
A
A
V
L
F
W
A
-
I
E
E
Q
G
S
V
V
L
A
T
F
A
A
----
E
R
V
D
S
S
W
----
F
P
V
S
W
F
Q
S
L
N
P
L
F
I
M
L
Y
T
P
F
F
-
A
W
---
L
W
T
A
---
N
--
Q
P
S
S
P
T
K
F
-------------
A
V
G
L
M
F
A
G
L
S
F
L
L
M
A
I
P
G
A
L
-
Y
G
T
S
G
K
V
S
P
L
W
L
V
G
S
W
A
L
V
I
---
L
G
E
----
M
L
I
S
P
V
G
L
S
V
T
T
M
M
S
M
W
F
L
S
S
S
--
V
G
S
A
L
N
A
Q
L
V
T
L
Y
N
A
K
S
E
V
A
Y
F
S
Y
F
G
L
G
S
V
V
L
G
I
V
L
V
F
L
S
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
37
Fugue
66.33
18%
-76
- C2 -
2QUB
-
?
A:
[1-615]
SHMGIFS
Y
K
D
L
D
E
N
A
S
K
A
L
F
S
D
A
L
A
I
S
T
Y
A
Y
H
N
I
D
N
G
F
D
E
G
Y
H
Q
T
G
F
G
L
G
L
P
L
T
L
I
T
A
L
I
G
S
T
Q
-
S
Q
G
G
L
P
G
--------------------------
L
------
P
-----
W
N
P
D
S
E
Q
A
A
Q
E
A
V
N
N
A
G
W
S
V
------
I
S
A
T
Q
L
G
-
Y
A
G
K
T
D
A
R
G
T
Y
Y
G
E
T
A
G
Y
T
T
--
A
Q
A
E
V
-
L
G
K
Y
D
S
E
G
N
L
T
A
-
I
G
I
S
F
--
R
G
T
S
G
P
R
E
S
L
I
G
D
-
T
I
G
D
V
I
N
D
L
L
A
G
F
G
P
K
G
Y
A
D
G
Y
T
L
K
A
F
G
N
L
L
G
D
V
A
K
F
A
Q
A
H
G
L
S
--
G
E
D
V
V
V
S
G
H
S
----
L
G
G
L
A
V
N
S
M
------
A
---------
A
Q
--------
S
D
------------
A
N
W
-----------
G
G
F
Y
A
Q
S
---
N
-----
Y
V
A
F
A
S
P
T
Q
-----
Y
E
A
-
G
------------------
G
------------------------------------
K
V
I
N
I
G
Y
E
N
D
P
----
V
F
R
A
----
L
-----------
D
G
T
S
L
T
----
L
P
S
L
-------------
G
V
H
D
A
P
H
T
--
S
A
T
N
N
I
----
V
N
F
N
D
H
Y
A
S
D
A
W
N
L
L
P
F
S
I
L
N
I
P
T
W
L
S
H
L
P
F
F
Y
Q
D
--
G
L
M
R
V
L
N
S
---
E
F
Y
S
L
T
D
K
-------------
D
S
T
I
I
V
S
N
L
S
N
V
T
R
G
N
T
W
V
E
D
L
N
R
N
A
E
T
H
S
G
P
---
T
F
I
I
G
S
---
D
G
N
----
D
----
L
I
K
G
G
K
G
N
D
Y
L
E
G
R
D
G
D
D
I
F
R
D
A
G
G
Y
N
L
I
A
G
G
K
G
H
N
I
F
D
T
Q
Q
A
L
K
N
T
E
V
A
Y
D
G
N
-------
T
L
Y
--
L
R
D
A
K
G
G
I
T
L
A
D
----------
D
I
S
T
L
R
S
K
E
T
S
W
L
I
F
N
K
E
V
D
H
Q
V
T
A
A
G
L
K
S
D
S
G
L
K
A
Y
A
A
A
T
G
G
D
G
D
D
V
L
Q
A
R
S
H
D
A
----------------
W
L
F
G
N
A
G
N
D
T
L
I
G
H
A
------------------------
G
G
N
L
T
F
V
------------
G
G
S
G
D
D
I
L
K
G
-------
V
G
N
G
--
N
T
F
L
F
S
G
D
-
F
G
R
D
Q
L
Y
G
F
N
A
S
D
K
L
V
F
I
G
T
E
G
A
S
G
N
I
R
D
Y
--
A
T
Q
Q
N
D
D
L
V
L
A
F
G
H
S
Q
V
T
L
I
G
V
S
L
D
H
I
S
T
D
Q
V
V
L
A
16
PsiBlast_PDB
65.87
27%
-108
- C3 -
4W6V
-
?
A:
[12-388]
------------------------------------------
T
F
F
G
H
P
Y
P
L
S
G
L
F
L
--
S
E
M
W
E
R
F
S
F
Y
G
I
R
P
L
L
I
L
F
M
A
ATV
F
D
G
------
G
------
M
------
G
-----
L
P
R
E
Q
A
S
A
I
V
G
I
F
A
G
S
M
Y
L
A
A
L
P
G
G
L
L
A
D
N
W
L
G
Q
Q
R
A
V
W
Y
G
S
I
L
I
A
L
G
H
L
S
I
A
L
--
S
A
F
--------
F
G
N
D
L
F
F
-
I
G
L
V
F
I
V
L
G
T
G
L
-
F
K
T
C
I
S
V
-
M
V
G
T
L
Y
K
P
G
D
A
-
R
R
D
G
G
F
S
L
F
Y
M
G
I
N
M
G
S
----
F
I
A
P
L
L
S
G
--
W
L
L
R
T
H
G
W
H
W
G
F
G
I
G
G
I
G
M
L
V
A
L
L
I
F
R
G
F
A
I
P
A
---------
M
K
R
Y
D
A
E
VGL
D
S
S
-----
W
N
K
P
--
T
-----------------
G
R
W
V
T
A
I
-----
M
A
V
V
V
V
I
I
A
-----
L
I
S
Q
G
------------------
V
I
P
I
---------------------
N
--
P
V
M
I
A
S
L
L
V
Y
V
I
A
A
S
V
T
L
Y
F
----
I
Y
L
F
A
F
AK
M
-----------
S
R
K
D
R
A
----
R
L
L
V
C
F
I
L
L
V
S
A
-
A
F
F
W
S
A
F
E
Q
K
P
T
--
S
F
N
L
F
A
N
---
D
Y
T
D
R
M
V
M
G
F
E
I
P
T
V
W
F
Q
S
I
N
A
L
F
I
I
L
L
A
P
V
F
-
S
W
--
A
-----------
P
S
S
I
T
K
F
-------------
V
I
G
I
L
C
A
A
A
G
F
A
V
M
M
Y
A
A
Q
H
-
V
L
S
S
G
G
A
G
V
S
P
L
W
L
V
M
S
I
L
L
---
L
T
L
----
G
E
L
C
L
S
P
I
G
L
A
T
M
T
L
L
A
P
D
R
M
R
--
G
Q
V
M
G
L
W
F
C
A
S
S
L
G
N
L
A
A
G
L
I
G
G
H
V
K
A
D
Q
L
D
M
L
P
T
L
F
A
R
C
S
I
A
L
V
--
I
C
A
A
V
L
I
L
L
I
V
P
I
R
R
L
M
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
65.67
70%
-59
* C4 *
5A9I
-
?
A:
[5-194]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
E
I
F
L
Q
V
L
N
---
L
A
D
----
G
D
V
K
V
T
V
L
G
S
R
N
N
S
L
L
V
E
S
V
S
S
--
F
Q
N
T
T
H
Y
S
K
L
H
L
E
A
K
S
Q
D
L
H
F
H
L
K
Y
N
S
L
S
V
H
N
D
H
S
V
E
E
K
N
C
Y
Q
L
L
--
I
H
Q
D
G
E
S
I
S
S
M
L
V
K
D
T
G
I
K
P
A
N
G
M
A
A
I
R
F
I
N
T
L
H
K
D
L
N
I
S
L
D
T
D
A
P
L
S
-
V
G
K
D
Y
G
V
S
A
Y
R
T
V
L
R
G
K
Y
P
-
A
V
H
C
E
T
E
D
K
V
F
S
L
D
L
G
Q
L
D
F
G
T
T
Y
L
F
V
I
T
N
I
T
S
Q
G
L
Q
A
W
K
A
E
D
I
------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
64.89
29%
-107
- C3 -
4XNI
6
?
A:
[12-372]
-------------------------------------------------
P
L
G
L
S
T
L
F
M
T
E
M
W
E
R
F
S
Y
Y
G
M
R
A
I
L
-
L
Y
-----
Y
M
W
------
F
L
I
S
T
GD
L
------
H
-----
I
T
R
A
T
A
A
S
I
M
A
I
Y
A
S
M
V
Y
L
S
G
T
I
G
G
F
V
A
D
R
I
I
G
A
R
P
A
V
F
W
G
G
V
L
I
M
L
G
H
I
V
L
A
L
PF
G
A
S
A
L
-
F
G
S
I
I
------------
L
I
I
I
G
T
G
F
-
L
K
P
N
V
S
T
-
L
V
G
T
L
Y
D
E
-
H
D
R
R
R
D
A
G
F
S
I
F
V
F
G
I
N
L
G
A
----
F
I
A
P
L
I
V
G
A
A
Q
E
--
A
A
G
Y
H
V
A
F
S
L
A
A
I
G
M
F
I
G
L
L
V
Y
------
Y
---------
F
G
--------
G
K
K
TLDPH
Y
L
R
P
TD
P
L
A
-----------
P
E
E
V
K
P
L
L
V
K
V
-----
S
L
A
V
A
G
F
I
A
I
I
V
V
M
N
L
V
-
G
WN----------------
S
L
P
A
---------------------
Y
--
I
--------
N
L
L
T
I
V
A
I
A
I
P
V
F
Y
F
A
-------------------------L---
R
V
V
-
S
Y
I
P
L
F
I
A
A
V
L
F
W
A
-
I
E
E
Q
G
S
V
V
L
A
T
F
A
A
----
E
R
V
D
S
S
W
----
F
P
V
S
W
F
Q
S
L
N
P
L
F
I
M
L
Y
T
P
F
F
-
A
W
---
L
W
T
A
W
K
K
N
--
Q
P
S
S
P
T
K
F
-------------
A
V
G
L
M
F
A
G
L
S
F
L
L
M
A
I
P
G
A
L
-
Y
G
T
S
G
K
V
S
P
L
W
L
V
G
S
W
A
L
V
I
---
L
G
E
----
M
L
I
S
P
V
G
L
S
V
M
S
M
W
F
L
S
S
S
V
G
S
--
A
L
N
A
Q
L
V
T
L
Y
N
A
K
S
E
V
A
Y
F
S
Y
F
G
L
G
S
V
V
L
G
I
V
L
V
F
L
S
K
R
I
Q
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
64.70
29%
-110
- C3 -
4D2C
6
?
A:
[12-372]
-------------------------------------------------
P
L
G
L
S
T
L
F
M
T
E
M
W
E
R
F
S
Y
Y
G
M
R
A
I
L
-
L
Y
-----
Y
M
W
------
F
L
I
S
T
GD
L
------
H
-----
I
T
R
A
T
A
A
S
I
M
A
I
Y
A
S
M
V
Y
L
S
G
T
I
G
G
F
V
A
D
R
I
I
G
A
R
P
A
V
F
W
G
G
V
L
I
M
L
G
H
I
V
L
A
L
PF
G
A
S
A
L
-
F
G
S
I
I
------------
L
I
I
I
G
T
G
F
-
L
K
P
N
V
S
T
-
L
V
G
T
L
Y
D
E
-
H
D
R
R
R
D
A
G
F
S
I
F
V
F
G
I
N
L
G
A
----
F
I
A
P
L
I
V
G
A
A
Q
E
--
A
A
G
Y
H
V
A
F
S
L
A
A
I
G
M
F
I
G
L
L
V
Y
------
Y
---------
F
G
--------
G
K
K
TLDPH
Y
L
R
P
TD
P
L
A
-----------
P
E
E
V
K
P
L
L
V
K
V
-----
S
L
A
V
A
G
F
I
A
I
I
V
V
M
N
L
V
-
G
WN----------------
S
L
P
A
---------------------
Y
--
I
--------
N
L
L
T
I
V
A
I
A
I
P
V
F
Y
F
A
W
---------------------------------
Y
I
P
L
F
I
A
A
V
L
F
W
A
-
I
E
E
Q
G
S
V
V
L
A
T
F
A
A
----
E
R
V
D
S
S
W
----
F
P
V
S
W
F
Q
S
L
N
P
L
F
I
M
L
Y
T
P
F
F
-
A
W
---
L
W
T
A
W
-------
S
S
P
T
K
F
-------------
A
V
G
L
M
F
A
G
L
S
F
L
L
M
A
I
P
G
A
L
-
Y
G
T
S
G
K
V
S
P
L
W
L
V
G
S
W
A
L
V
I
---
L
G
E
----
M
L
I
S
P
V
M
M
S
M
W
F
L
S
S
S
V
G
S
A
L
N
--
A
Q
L
V
T
L
Y
N
A
K
S
E
V
A
Y
F
S
Y
F
G
L
G
S
V
V
L
G
I
V
L
V
F
L
S
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
64.32
27%
-106
- C3 -
4IKX
1
?
A:
[20-384]
-----------------------------------------------
G
H
P
K
G
L
F
T
L
F
F
T
E
F
W
E
R
F
S
Y
Y
G
M
R
A
I
L
V
-
Y
-----
Y
M
Y
------
Y
EVSKGG
L
------
G
-----
L
D
E
H
L
A
L
A
I
M
S
I
Y
G
A
L
V
Y
M
S
G
I
I
G
G
W
L
A
D
R
V
F
G
T
S
R
A
V
F
Y
G
G
L
L
I
M
A
G
H
I
-------
A
L
A
I
-
P
G
G
----
V
A
A
L
F
-
V
S
M
A
L
I
V
L
G
T
G
L
-
L
K
P
N
V
S
S
-
I
V
G
D
M
Y
K
P
G
D
-
D
R
R
D
A
G
F
S
I
F
Y
M
G
I
N
L
G
A
----
F
L
A
P
L
V
V
G
T
A
G
M
--
K
Y
N
F
H
L
G
F
G
L
A
A
V
G
M
F
L
G
L
V
V
F
------
V
A
T
RKKNLGL
A
G
--------
T
Y
V
-----
P
N
P
L
--
T
P
A
E
K
K
K
A
A
A
I
M
A
V
G
A
V
V
I
A
V
L
L
A
I
L
I
P
N
G
W
F
T
V
E
T
F
I
S
-----
L
V
G
-
I
------------------
L
G
I
I
---------------------
I
--
P
--------
I
I
Y
F
V
V
M
Y
R
S
P
----
K
T
T
A
----
E
-----------
E
R
S
R
V
I
----
A
Y
I
P
L
F
V
A
S
----
A
M
F
W
A
-
I
Q
Q
Q
G
S
----
T
I
L
A
N
Y
A
D
K
R
T
Q
L
D
V
--
I
H
L
S
P
A
W
F
Q
S
L
N
P
L
F
I
I
I
L
A
P
V
F
-
A
W
--
M
W
V
K
L
G
K
R
---
Q
P
T
I
P
Q
K
F
-------------
A
L
G
L
L
F
A
G
L
S
F
I
V
I
L
V
P
G
H
L
-
G
G
L
V
H
P
I
W
L
V
L
S
Y
F
I
V
V
L
G
E
---
L
C
L
----
S
P
V
G
L
S
A
T
T
K
L
A
P
A
A
F
S
A
Q
T
M
S
--
L
W
F
L
S
N
A
A
A
Q
A
I
N
A
Q
L
V
R
F
Y
T
P
E
N
E
T
A
Y
F
G
T
I
G
G
A
A
L
V
L
G
L
I
L
L
A
--
I
A
P
R
I
G
R
L
M
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
64.08
29%
-112
- C3 -
4XNJ
9
?
A:
[12-372]
-------------------------------------------------
P
L
G
L
S
T
L
F
M
T
E
M
W
E
R
F
S
Y
Y
G
M
R
A
I
L
-
L
Y
-----
Y
M
W
------
F
L
I
S
T
GD
L
------
H
-----
I
T
R
A
T
A
A
S
I
M
A
I
Y
A
S
M
V
Y
L
S
G
T
I
G
G
F
V
A
D
R
I
I
G
A
R
P
A
V
F
W
G
G
V
L
I
M
L
G
H
I
V
L
A
L
PF
G
A
S
A
L
-
F
G
S
I
I
------------
L
I
I
I
G
T
G
F
-
L
K
P
N
V
S
T
-
L
V
G
T
L
Y
D
E
-
H
D
R
R
R
D
A
G
F
S
I
F
V
F
G
I
N
L
G
A
----
F
I
A
P
L
I
V
G
A
A
Q
E
--
A
A
G
Y
H
V
A
F
S
L
A
A
I
G
M
F
I
G
L
L
V
Y
------
Y
---------
F
G
--------
G
K
K
TLDPH
Y
L
R
P
TD
P
L
A
-----------
P
E
E
V
K
P
L
L
V
K
V
-----
S
L
A
V
A
G
F
I
A
I
I
V
V
M
N
L
V
-
G
WN----------------
S
L
P
A
---------------------
Y
--
I
--------
N
L
L
T
I
V
A
I
A
I
P
V
F
Y
F
A
W
M
I
----
S
-----------
S
---
T
S
T
E
H
L
R
V
V
-
S
Y
I
P
L
F
I
A
A
V
L
F
W
A
-
I
E
E
Q
G
S
V
V
L
A
T
F
A
A
----
E
R
V
D
S
S
W
----
F
P
V
S
W
F
Q
S
L
N
P
L
F
I
M
L
Y
T
P
F
F
-
A
W
---
L
W
T
A
W
K
K
N
--
Q
P
S
S
P
T
K
F
-------------
A
V
G
L
M
F
A
G
L
S
F
L
L
M
A
I
P
G
A
L
-
Y
G
T
S
G
K
V
S
P
L
W
L
V
G
S
W
A
L
V
I
---
L
G
E
----
M
L
I
S
P
V
G
L
S
V
T
T
K
L
N
S
Q
M
M
S
M
W
--
F
L
S
S
S
V
G
S
A
L
N
A
Q
L
V
T
L
Y
N
A
K
S
E
V
A
Y
F
S
Y
F
G
L
G
S
V
V
L
G
I
V
L
V
F
L
S
--
K
R
I
Q
G
L
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
63.94
29%
-114
- C3 -
4APS
-
?
A:
[12-372]
-------------------------------------------------
P
L
G
L
S
T
L
F
M
T
E
M
W
E
R
F
S
Y
Y
G
M
R
A
I
L
-
L
Y
-----
Y
M
W
------
F
L
I
S
T
GD
L
------
H
-----
I
T
R
A
T
A
A
S
I
M
A
I
Y
A
S
M
V
Y
L
S
G
T
I
G
G
F
V
A
D
R
I
I
G
A
R
P
A
V
F
W
G
G
V
L
I
M
L
G
H
I
V
L
A
L
PF
G
A
S
A
L
-
F
G
S
I
I
------------
L
I
I
I
G
T
G
F
-
L
K
P
N
V
S
T
-
L
V
G
T
L
Y
D
E
-
H
D
R
R
R
D
A
G
F
S
I
F
V
F
G
I
N
L
G
A
----
F
I
A
P
L
I
V
G
A
A
Q
E
--
A
A
G
Y
H
V
A
F
S
L
A
A
I
G
M
F
I
G
L
L
V
Y
------
Y
---------
F
G
--------
G
K
K
TLDPH
Y
L
R
P
TD
P
L
A
-----------
P
E
E
V
K
P
L
L
V
K
V
-----
S
L
A
V
A
G
F
I
A
I
I
V
V
M
N
L
V
-
G
WN----------------
S
L
P
A
---------------------
Y
--
I
--------
N
L
L
T
I
V
A
I
A
I
P
V
F
Y
F
A
W
M
I
---------------------------
V
V
-
S
Y
I
P
L
F
I
A
A
V
L
F
W
A
-
I
E
E
Q
G
S
V
V
L
A
T
F
A
A
----
E
R
V
D
S
S
W
----
F
P
V
S
W
F
Q
S
L
N
P
L
F
I
M
L
Y
T
P
F
F
-
A
W
---
L
W
T
A
W
K
K
N
-----
S
P
T
K
F
-------------
A
V
G
L
M
F
A
G
L
S
F
L
L
M
A
I
P
G
A
L
-
Y
G
T
S
G
K
V
S
P
L
W
L
V
G
S
W
A
L
V
I
---
L
G
E
----
M
L
I
S
P
V
G
L
S
V
T
T
K
L
A
P
K
A
F
N
S
Q
--
M
M
S
M
W
F
L
S
S
S
V
G
S
A
L
N
A
Q
L
V
T
L
Y
N
A
K
S
E
V
A
Y
F
S
Y
F
G
L
G
S
V
V
L
G
I
V
--
L
V
F
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
63.24
27%
-107
- C3 -
4IKY
8
?
A:
[20-384]
-----------------------------------------------
G
H
P
K
G
L
F
T
L
F
F
T
E
F
W
E
R
F
S
Y
Y
G
M
R
A
I
L
V
-
Y
-----
Y
M
Y
------
Y
EVSKGG
L
------
G
-----
L
D
E
H
L
A
L
A
I
M
S
I
Y
G
A
L
V
Y
M
S
G
I
I
G
G
W
L
A
D
R
V
F
G
T
S
R
A
V
F
Y
G
G
L
L
I
M
A
G
H
I
-------
A
L
A
I
-
P
G
G
----
V
A
A
L
F
-
V
S
M
A
L
I
V
L
G
T
G
L
-
L
K
P
N
V
S
S
-
I
V
G
D
M
Y
K
P
G
D
-
D
R
R
D
A
G
F
S
I
F
Y
M
G
I
N
L
G
A
----
F
L
A
P
L
V
V
G
T
A
G
M
--
K
Y
N
F
H
L
G
F
G
L
A
A
V
G
M
F
L
G
L
V
V
F
------
V
A
T
RKKNLGL
A
G
--------
T
Y
V
-----
P
N
P
L
--
T
P
A
E
K
K
K
A
A
A
I
M
A
V
G
A
V
V
I
A
V
L
L
A
I
L
I
P
NG
W
F
T
V
E
T
F
I
S
-----
L
V
G
-
I
------------------
L
G
I
I
---------------------
I
--
P
--------
I
I
Y
F
V
V
M
Y
R
S
P
----
K
T
T
A
----
E
-----------
E
R
S
R
V
I
----
A
Y
I
P
L
F
V
A
S
----
A
M
F
W
A
-
I
Q
Q
Q
G
S
----
T
I
L
A
N
Y
A
D
K
R
T
Q
L
D
V
A
G
I
H
L
S
P
A
W
F
Q
S
L
N
P
L
F
I
I
I
L
A
P
V
F
-
A
W
--
M
W
V
K
L
G
K
R
---
Q
P
T
I
P
Q
K
F
-------------
A
L
G
L
L
F
A
G
L
S
F
I
V
I
L
V
P
G
H
L
-
S
G
G
G
L
V
H
P
I
W
L
V
L
S
Y
F
I
V
V
L
---
G
E
L
----
C
L
S
P
V
G
L
S
A
T
T
K
L
A
P
A
A
F
S
A
Q
T
--
M
S
L
W
F
L
S
N
A
A
A
Q
A
I
N
A
Q
L
V
R
F
Y
T
P
E
N
E
T
A
Y
F
G
T
I
G
G
A
A
L
V
L
G
L
I
L
--
L
A
I
A
P
R
I
G
R
L
M
K
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
62.76
26%
-107
- C3 -
4IKW
11
?
A:
[20-384]
-----------------------------------------------
G
H
P
K
G
L
F
T
L
F
F
T
E
F
W
E
R
F
S
Y
Y
G
M
R
A
I
L
V
-
Y
-----
Y
M
Y
------
Y
EVSKGG
L
------
G
-----
L
D
E
H
L
A
L
A
I
M
S
I
Y
G
A
L
V
Y
M
S
G
I
I
G
G
W
L
A
D
R
V
F
G
T
S
R
A
V
F
Y
G
G
L
L
I
M
A
G
H
I
-------
A
L
A
I
-
P
G
G
----
V
A
A
L
F
-
V
S
M
A
L
I
V
L
G
T
G
L
-
L
K
P
N
V
S
S
-
I
V
G
D
M
Y
K
P
G
D
-
D
R
R
D
A
G
F
S
I
F
Y
M
G
I
N
L
G
A
----
F
L
A
P
L
V
V
G
T
A
G
M
--
K
Y
N
F
H
L
G
F
G
L
A
A
V
G
M
F
L
G
L
V
V
F
------
V
A
TRKKNLGL
A
G
--------
T
Y
V
-----
P
N
P
L
--
T
P
A
E
K
K
K
A
A
A
I
M
A
V
G
A
V
V
I
A
V
L
L
A
I
L
I
P
NG
W
F
T
V
E
T
F
I
S
-----
L
V
G
-
I
------------------
L
G
I
I
---------------------
I
--
P
--------
I
I
Y
F
V
V
M
Y
R
S
P
----
K
T
T
A
----
E
-----------
E
R
S
R
V
I
----
A
Y
I
P
L
F
V
A
S
----
A
M
F
W
A
-
I
Q
E
Q
G
S
----
T
I
L
A
N
Y
A
D
K
R
T
Q
L
D
V
A
G
I
H
L
S
P
A
W
F
Q
S
L
N
P
L
F
I
I
I
L
A
P
V
F
-
A
W
--
M
W
V
K
L
G
K
R
---
Q
P
T
I
P
Q
K
F
-------------
A
L
G
L
L
F
A
G
L
S
F
I
V
I
L
V
P
G
H
L
-
S
G
G
G
L
V
H
P
I
W
L
V
L
S
Y
F
I
V
V
L
---
G
E
L
----
C
L
S
P
V
G
L
S
A
T
T
K
L
A
P
A
A
F
S
A
Q
T
--
M
S
L
W
F
L
S
N
A
A
A
Q
A
I
N
A
Q
L
V
R
F
Y
T
P
E
N
E
T
A
Y
F
G
T
I
G
G
A
A
L
V
L
G
L
I
L
--
L
A
I
A
P
R
I
G
R
L
M
K
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
62.65
26%
-108
- C3 -
4IKV
8
?
A:
[20-384]
-----------------------------------------------
G
H
P
K
G
L
F
T
L
F
F
T
E
F
W
E
R
F
S
Y
Y
G
M
R
A
I
L
V
-
Y
-----
Y
M
Y
------
Y
EVSKGG
L
------
G
-----
L
D
E
H
L
A
L
A
I
M
S
I
Y
G
A
L
V
Y
M
S
G
I
I
G
G
W
L
A
D
R
V
F
G
T
S
R
A
V
F
Y
G
G
L
L
I
M
A
G
H
I
-------
A
L
A
I
-
P
G
G
----
V
A
A
L
F
-
V
S
M
A
L
I
V
L
G
T
G
L
-
L
K
P
N
V
S
S
-
I
V
G
D
M
Y
K
P
G
D
-
D
R
R
D
A
G
F
S
I
F
Y
M
G
I
N
L
G
A
----
F
L
A
P
L
V
V
G
T
A
G
M
--
K
Y
N
F
H
L
G
F
G
L
A
A
V
G
M
F
L
G
L
V
V
F
------
V
A
TRKKNLGL
A
G
--------
T
Y
V
-----
P
N
P
L
--
T
P
A
E
K
K
K
A
A
A
I
M
A
V
G
A
V
V
I
A
V
L
L
A
I
L
I
P
N
G
W
F
T
V
E
T
F
I
S
-----
L
V
G
-
I
------------------
L
G
I
I
---------------------
I
--
P
--------
I
I
Y
F
V
V
M
Y
R
S
P
----
K
T
T
A
----
E
-----------
E
R
S
R
V
I
----
A
Y
I
P
L
F
V
A
S
----
A
M
F
W
A
-
I
Q
E
Q
G
S
----
T
I
L
A
N
Y
A
D
K
R
T
Q
L
D
V
A
G
I
H
L
S
P
A
W
F
Q
S
L
N
P
L
F
I
I
I
L
A
P
V
F
-
A
W
--
M
W
V
K
L
G
K
R
---
Q
P
T
I
P
Q
K
F
-------------
A
L
G
L
L
F
A
G
L
S
F
I
V
I
L
V
P
G
H
L
-
S
G
G
G
L
V
H
P
I
W
L
V
L
S
Y
F
I
V
V
L
---
G
E
L
----
C
L
S
P
V
G
L
S
A
T
T
K
L
A
P
A
A
F
S
A
Q
T
--
M
S
L
W
F
L
S
N
A
A
A
Q
A
I
N
A
Q
L
V
R
F
Y
T
P
E
N
E
T
A
Y
F
G
T
I
G
G
A
A
L
V
L
G
L
I
L
--
L
A
I
A
P
R
I
G
R
L
M
K
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
62.44
27%
-106
- C3 -
4IKZ
1
?
A:
[20-384]
-----------------------------------------------
G
H
P
K
G
L
F
T
L
F
F
T
E
F
W
E
R
F
S
Y
Y
G
M
R
A
I
L
V
-
Y
-----
Y
M
Y
------
Y
EVSKGG
L
------
G
-----
L
D
E
H
L
A
L
A
I
M
S
I
Y
G
A
L
V
Y
M
S
G
I
I
G
G
W
L
A
D
R
V
F
G
T
S
R
A
V
F
Y
G
G
L
L
I
M
A
G
H
I
-------
A
L
A
I
-
P
G
G
----
V
A
A
L
F
-
V
S
M
A
L
I
V
L
G
T
G
L
-
L
K
P
N
V
S
S
-
I
V
G
D
M
Y
K
P
G
D
-
D
R
R
D
A
G
F
S
I
F
Y
M
G
I
N
L
G
A
----
F
L
A
P
L
V
V
G
T
A
G
M
--
K
Y
N
F
H
L
G
F
G
L
A
A
V
G
M
F
L
G
L
V
V
F
------
V
A
T
RKKNLGL
A
G
--------
T
Y
V
-----
P
N
P
L
--
T
P
A
E
K
K
K
A
A
A
I
M
A
V
G
A
V
V
I
A
V
L
L
A
-------
F
T
V
E
T
F
I
S
-----
L
V
G
-
I
------------------
L
G
I
I
---------------------
I
--
P
--------
I
I
Y
F
V
V
M
Y
R
S
P
----
K
T
T
A
----
E
-----------
E
R
S
R
V
I
----
A
Y
I
P
L
F
V
A
S
----
A
M
F
W
A
-
I
Q
Q
Q
G
S
----
T
I
L
A
N
Y
A
D
K
R
T
Q
L
D
V
A
G
I
H
L
S
P
A
W
F
Q
S
L
N
P
L
F
I
I
I
L
A
P
V
F
-
A
W
--
M
W
V
K
L
G
K
R
---
Q
P
T
I
P
Q
K
F
-------------
A
L
G
L
L
F
A
G
L
S
F
I
V
I
L
V
P
G
H
L
-
S
G
G
G
L
V
H
P
I
W
L
V
L
S
Y
F
I
V
V
L
---
G
E
L
----
C
L
S
P
V
G
L
S
A
T
T
K
L
A
P
A
A
F
S
A
Q
T
--
M
S
L
W
F
L
S
N
A
A
A
Q
A
I
N
A
Q
L
V
R
F
Y
T
P
E
N
E
T
A
Y
F
G
T
I
G
G
A
A
L
V
L
G
L
I
L
--
L
A
I
A
P
R
I
G
R
L
M
K
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
39
Fugue
59.90
14%
-71
- C1 -
3RFU
-
?
A:
[74-736]
-------
V
S
P
E
Y
L
D
M
R
R
R
F
W
I
A
L
M
L
T
I
P
V
V
I
L
E
M
G
G
H
G
L
K
H
-------------
F
I
S
G
N
G
S
S
W
I
Q
L
L
L
A
T
P
V
V
L
W
G
G
-----
W
P
F
------
F
------
K
------
R
-----
G
W
Q
S
L
K
T
G
Q
L
N
-------
M
F
T
L
I
A
M
G
I
G
V
A
W
I
Y
S
M
V
A
V
L
W
P
G
V
---
F
P
H
A
F
R
S
Q
E-
G
V
V
A
V
Y
F
E
A
A
A
V
I
T
T
L
V
L
-
L
G
Q
V
L
E
L
K
A
R
E
Q
-
T
G
S
A
I
R
A
L
L
K
L
V
P
E
S
A
H
R
I
K
E
D
G
S
E
E
E
V
S
L
D
N
V
A
V
G
D
L
L
R
V
R
P
G
E
K
I
P
V
D
G
E
V
Q
E
G
R
S
F
V
D
E
S
M
V
T
G
------------------------------------
E
P
I
-----
P
V
A
K
--
E
A
S
-----------
A
K
V
I
G
A
T
I
N
Q
T
-----
G
S
F
V
M
K
A
L
H
-----
V
G
S
-
D
------------------
T
M
L
A
---------------------
R
I
V
Q
--------
M
V
S
D
A
Q
R
S
R
A
P
----
I
Q
R
L
----
A
-----------
D
T
V
S
G
W
----
F
V
P
A
V
I
L
V
A
----
V
L
S
F
I
V
W
A
L
L
G
P
--
Q
P
A
L
S
Y
----
G
L
I
A
A
V
S
V
L
I
I
A
C
P
C
A
L
G
L
A
T
P
M
S
I
M
V
G
V
G
K
G
-
A
Q
S
G
V
L
I
K
-------
N
A
E
A
L
E
R
M
-------------
E
K
V
N
T
L
V
V
D
K
T
G
T
L
T
E
G
H
P
K
-
L
T
R
I
V
T
D
D
F
V
E
D
N
A
L
A
L
A
A
A
---
L
E
H
QSEH
P
L
A
N
A
I
V
H
A
A
K
E
K
G
L
S
L
G
S
V
E
A
--
F
E
A
P
T
G
K
G
----
V
V
G
Q
V
D
G
H
-
H
V
A
I
G
N
A
R
L
M
Q
E
H
G
G
D
N
A
P
L
F
E
K
A
D
E
L
R
G
K
G
A
S
V
M
F
M
A
V
D
-------
G
K
T
V
A
L
L
V
V
E
D
P
I
K
S
-----
S
T
P
E
T
I
L
-
E
L
Q
Q
S
G
I
-------------
E
I
V
M
L
T
G
D
S
K
R
T
A
E
A
V
A
G
T
L
G
--------------
I
K
K
V
V
A
E
I
M
P
E
D
K
S
R
I
V
S
E
L
K
D
K
G
L
I
V
A
M
A
G
D
G
V
N
D
A
P
A
L
A
K
A
D
I
G
I
A
M
G
T
G
T
D
V
A
I
E
S
A
G
V
T
L
L
H
G
D
L
RG
I
A
K
A
R
R
L
S
-
E
S
T
M
S
N
I
R
Q
N
L
F
F
A
F
I
Y
N
V
L
G
V
P
L
A
A
G
V
L
Y
PL
T
G
L
L
L
S
P
M
I
A
A
A
A
M
A
L
S
S
V
S
V
-
I
I
N
A
L
R
L
K
R
V
T
L
-