@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 : Lmo2735: (2016-04-06 )
MQTELVNQIEVKLRKIYQAAYQPAYLEKMLACAENYSNNTRGSIDTISEKNVYLIAYGDSIFEKNKHPLQTLNEFLQEYAQDAITDVHLLPIFPSTSDDGFSVTDYKQIDEQLGDWDDVQKMSENFRVMLDFVANHMSKSSDWFKRFSDNEAPYNQFFIEKDSQFDYKNVTRPRTSPLFHKYENGKELWTTFSEDQLDLNVRNIDCLVALTDVLLFYASKQATSIRLDAIGFLWKTSGTTCMHLPETHEIISLWRLLIDELYPNLQIITETNVPHEENISYFGDGKNEANMVYQFPLPPLVLHTFTCHDTTKLSKWAKSISQVSDTATYFNFLASHDGIGMRPATGILSDEEINSLVQKAVQNGGQVSYKDNADGTQSVYELNINYGEALQNLDEDTTEELVTKKIIAAHSILLTLQGVPAIYYHSLLGSKNDLVGYEESGINRRINREKLEKNQLVHELKTDTYRKTIFTSLKKLVQIRRNHTAFSPFATQEILDLGPDVFAIKRESEGECIYGIINVTSHDISKKVAFSGTNLLANQPVTSELELTAYEVVWIKKAVQ
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
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
----------------------------------MQ
T
E
L
V
N
Q
I
E
V
K
L
R
K
I
Y
-----
Q
A
AYQ
P
A
-
Y
L
E
K
M
L
--------
A
C
A
-ENYS--NN--TRGSIDT---------ISEK
N
--
V
Y
L
I
AYG
D
S
I
F
E----KN---KH
P
L
Q
T
L
N
E
F
L
Q
E
Y
A
--------
Q
D
AI-T
D
V
H
L
L
PIFP---S---T---SDDGFSV
T
D
Y
K
Q
I
D
E
QLG
D
W
D
D
V
-----
Q
K
M
-----
S
-----
E
N
F
R
-----
V
M
L
D
F
V
A
N
HMS
K
S
S
D
W
F
K
RF---------SD-N-EAPYN
Q
F
---
F
IEKDSQF-------D------YKNV----TR---PRT------SP
L
-
F
HKYEN-G
K
E
L
W
TTFSED
Q
L
D
L
NVRN
I
D
C
L
V
A
L
T
D
V
L
L
F
Y
ASKQ
A
T
S
I
R
L
D
A
I
G
F
L
WKTSG
T
----------------
T
C
M
------------HLP
E
T
H
E
I
I
S
L
W
R
L
L
I
D
E
LYPN
L
Q
I
I
TETNVPHE-EN
I
S
YFG-DGKNEA
N
M
V
Y
QFPLPP
L
V
L
H
T
F
TCH
D
T
T
-------
K
L
S
K
W
A
K
S
I
S
Q
VS
D
T
A
T
Y
F
N
F
L
A
SHDGIGMRPATGIL------
S
D
E
E
I
N
S
L
V
Q
K
A
V
Q-N------GG
Q
V
S
YKDNADGT
Q
S
V
Y
E
L
NIN
Y
G
---
E
--------
A
L
Q
NLDE
D
T
T
E
E
L
V
T
K
K
I
I
A
A
H
S
I
L
L
T
LQG
V
P
A
I
Y
Y
H
S
L
LGSKNDLVGYE---E--------SG---I---NRRI
N
R
E
K
L
E
K
N
Q
L
V
H
E
-------------------
L
-KT
D
T
Y
------------
R
K
T
I
F
T
S
L
K
----------
K
L
V
Q
I
R
RNHTAFS-----P
F
A
T
Q
E
I
L
DLG----P
D
V
F
A
I
K
RESEG
E
C
I
Y
G
I
I
NVTSH------DI
S
------
K
K
V
AF------S-GTNLLANQ-P-----V---T--SE
L
E
L
T
A
Y
E
V
V
W
I
K
K
AVQ
24
HHSearch
86.56
21%
-82
* C1 *
1G5A
2
AMYS_NEIPO
A:
[37-627]
------------------------------------
D
T
H
F
P
K
L
M
N
E
L
D
S
V
Y
-----
G
N
N
E
A
L
L
P
M
L
E
M
L
L
A
Q
A
W
Q
S
Y
S
Q
R
N
-
S
S
L
K
--
D
I
D
I
A
R
E
N
N
P
D
---------
W
I
L
S
N
K
Q
V
G
G
V
C
Y
V
D
L
F
A
-----------
G
D
L
K
G
L
K
D
K
I
P
-
Y
F
--------
Q
E
L
G
L
T
Y
L
H
L
M
P
L
F
K
---
C
---
P
E
GK
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
-----
I
A
A
L
H
E
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
---
Y
Y
I
F
P
D
R
R
M
P
D
Q
Y
D
R
T
------
L
R
E
I
----
F
P
---
D
Q
H
------
P
G
G
-
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
A
F
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
E
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
G
-
Q
--
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
A
Y
L
GIS
G
Y
D
H
R
Q
F
L
N
R
F
F
V
N
R
F
DGSFAR
G
V
P
F
Q
--
Y
N
P
S
--
T
G
D
C
R
V
S
G
T
A
A
---
A
--------
L
V
G
L
A
Q
---
D
D
P
H
A
V
D
R
I
K
L
L
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
KSD
D
---
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
D
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
-----
G
G
-
R
L
V
T
F
N
T
N
N---
K
H
I
I
G
Y
I
R
N
N
---
A
L
L
A
F
G
N
F
S
E
Y
------
P
Q
T
------
V
T
A
H
T
LQAMPF
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
---
7
PsiBlast_PDB
82.04
23%
-65
- C1 -
1MW3
3
AMYS_NEIPO
A:
[61-628]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
H
L
M
P
L
F
K
CPE
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
Y
Y
I
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
EIF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
A
F
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
E
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
D
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
33
HHSearch
81.86
20%
-72
- C1 -
3WY2
6
?
A:
[4-537]
------------------------------------------------------------------------------------------------
N
M
M
---------
W
W
R
G
G
--
V
I
Y
Q
I
Y
P
R
S
F
L
D
----
S
R
GDG
V
G
D
L
N
G
I
T
E
K
L
D
-
Y
V
--------
A
S
L
N
V
D
G
I
W
L
S
P
F
F
T
---
S
---
P
M--
L
D
F
G
Y
D
V
S
D
Y
R
D
V
D
P
M
F
G
T
L
E
D
F
-----
K
A
L
-----
L
E
K
A
H
S
L
G
L
K
-----
V
M
I
D
Q
V
I
S
H
T
S
D
Q
H
P
W
F
Q
E
S
---------
R
Q
N
R
-
T
N
P
K
A
D
W
---
F
V
W
A
D
P
K
P
-------
D
GTPPNN
W
L
S
I
----
F
------
G
------
G
S
A
-
W
T
F
D
S
R
R
Q
Q
Y
Y
L
H
N
F
L
T
S
Q
P
D
V
N
F
H
H
P
E
A
R
Q
A
Q
L
D
N
M
R
F
W
L
D
L
G
V
D
G
F
R
L
D
T
V
N
F
Y
F
H
D
A
E
L
R
D
N
P
P
VPKGEAKTLGA
P
E
A
NPYTWQRHVYDL
S
R
P
E
N
L
D
F
L
K
D
L
R
A
L
M
D
E
-
Y
P
G
T
T
T
V
G
E
I
G
D
D
N
P
L
E
R
M
A
E
Y
T
-
A
G
G
D
K
L
H
M
A
Y
T
F
D
L
L
N
M
P
------
H
S
A
S
-------
Y
L
R
E
V
I
E
R
F
Q
R
L
A
G
D
A
W
P
C
W
A
T
S
N
H
D
V
V
R
S
A
---------------------
T
------------------------------------------------
R
W
G
A
D
------
E
D
P
H
A
Y
P
K
V
M
L
A
V
L
F
S
L
R
G
S
V
C
L
Y
Q
G
E
E
L
G
L
P
E
A
D
V
P
F
E
RIQ
D
P
Y
G
K
V
LWP
E
F
---
K
---
G
R
D
G
C
R
T
P
M
P
W
T
D
G
E
Q
G
GFSPVEPWLPME
A
R
H
L
E
L
A
V
S
R
Q
Q
D
D
------------
P
N
A
T
L
N
T
V
R
----------
A
L
L
A
F
R
R
S
H
P
A
L
F
-----
D
G
-
D
L
S
L
V
D
V
G
----
D
D
L
L
G
F
T
R
Q
K
G
D
E
T
L
L
C
V
F
N
L
T
G
Q
------
E
Q
Q
------
T
T
L
P
V
------
E
V
A
S
D
L
P
V
A
H
F
T
-----
A
T
R
-
D
G-
S
T
L
T
L
P
A
Y
Q
A
A
F
M
Q
V
---
17
PsiBlast_PDB
81.43
23%
-66
- C1 -
4FLO
5
AMYS_NEIPO
A:
[61-628]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
H
L
M
P
L
F
K
CPE
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
Y
Y
I
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
EIF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
P
C
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
E
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
D
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
5
PsiBlast_PDB
81.35
23%
-63
- C1 -
1MW1
2
AMYS_NEIPO
A:
[61-628]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
H
L
M
P
L
F
K
CPE
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
Y
Y
I
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
EIF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
A
F
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
E
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
D
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
14
PsiBlast_PDB
81.32
23%
-63
- C1 -
4FLR
20
AMYS_NEIPO
A:
[61-628]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
H
L
M
P
L
F
K
CPE
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
Y
Y
I
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
EIF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
P
L
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
E
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
D
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
15
PsiBlast_PDB
81.26
23%
-64
- C1 -
4FLQ
9
AMYS_NEIPO
A:
[61-628]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
H
L
M
P
L
F
K
C
P
E
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
Y
Y
I
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
E
IF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
P
I
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
E
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
D
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
8
PsiBlast_PDB
81.25
23%
-62
- C1 -
3UEQ
3
AMYS_NEIPO
A:
[65-632]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
H
L
M
P
L
F
K
CPE
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
Y
Y
I
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
EIF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
A
F
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
E
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
D
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
10
PsiBlast_PDB
81.02
23%
-63
- C1 -
1MVY
3
AMYS_NEIPO
A:
[61-628]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
Y
L
M
P
L
F
K
CPE
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
YYI
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
E
IF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
A
F
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
Q
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
G
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
3
PsiBlast_PDB
80.51
23%
-64
- C1 -
1G5A
2
AMYS_NEIPO
A:
[61-628]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
H
L
M
P
L
F
K
C
P
E
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
Y
Y
I
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
E
IF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
A
F
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
E
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
D
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
18
PsiBlast_PDB
80.45
23%
-63
- C1 -
4FLS
4
AMYS_NEIPO
A:
[61-628]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
H
L
M
P
L
F
K
CPE
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
Y
Y
I
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
EIF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
A
K
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
Q
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
D
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
4
PsiBlast_PDB
80.41
23%
-65
- C1 -
1JG9
3
AMYS_NEIPO
A:
[61-628]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
H
L
M
P
L
F
K
C
P
E
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
Y
Y
I
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
EIF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
A
F
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
E
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
D
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
12
PsiBlast_PDB
80.17
23%
-63
- C1 -
1S46
1
AMYS_NEIPO
A:
[61-628]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
Y
L
M
P
L
F
K
CPE
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
YYI
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
EIF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
A
F
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
Q
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
G
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
16
PsiBlast_PDB
80.05
23%
-63
- C1 -
1JGI
1
AMYS_NEIPO
A:
[61-628]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
Y
L
M
P
L
F
K
CPE
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
Y
Y
I
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
E
IF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
A
F
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
Q
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
D
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
11
PsiBlast_PDB
79.81
23%
-63
- C1 -
1MW0
4
AMYS_NEIPO
A:
[61-628]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
Y
L
M
P
L
F
K
CPE
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
Y
Y
I
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
EIF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
A
F
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
Q
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
G
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
30
HHSearch
79.67
22%
-74
- C1 -
1WZA
2
?
A:
[1-487]
------------------------------------------------------------------------------------------------------------
F
E
K
H
G
--
T
Y
Y
E
I
F
V
R
S
F
Y
D
----
S
D
GDG
I
G
D
L
K
G
I
I
E
K
L
D
-
Y
L
NDGDPETI
A
D
L
G
V
N
G
I
W
L
M
P
I
F
K
---
S
---
P
---
S
Y
H
G
Y
D
V
T
D
Y
Y
K
I
N
P
D
Y
G
T
L
E
D
F
-----
H
K
L
-----
V
E
A
A
H
Q
R
G
I
K
-----
V
I
I
D
L
P
I
N
H
T
S
E
R
H
P
W
F
L
K
A
---------
S
R
-
D
K
N
S
E
Y
R
D
Y
---
Y
V
W
A
G
P
D
T
-------
D
------
T
K
E
-----
T
K
---
L
D
G
------
G
R
V
-
W
H
Y
S
P
T
--
G
M
Y
Y
G
Y
F
W
S
G
M
P
D
L
N
Y
N
N
P
E
V
Q
E
K
V
I
G
I
A
K
Y
W
L
K
Q
G
V
D
G
F
R
L
D
G
A
M
H
I
F
P
P
A
Q
---------------------------------
Y
D
K
N
F
T
W
W
E
K
F
R
Q
E
I
E
E
V
K
P
-
V
Y
L
V
G
E
V
W
D
I
S
E
-
T
V
A
P
Y
F
K
----
Y
G
F
D
S
T
F
N
F
K
L
A
E
A
V
I
A
T
A
K
A
G
F
P
F
G
F
N
K
K
A
K
H
I
Y
G
V
Y
D
R
E
-
V
G
F
G
N
Y
I
D
A
P
F
L
T
N
H
D
Q
N
R
I
L
-------------------------------------------------------------
D
--------
Q
L
G
---------
Q
D
R
N
K
A
R
V
A
A
S
I
Y
L
T
L
P
G
N
P
F
I
Y
Y
G
E
E
I
G
M
R
G
Q
G
-------------------------
P
H
E
V
I
R
E
P
F
Q
W
Y
N
G
S
G
E
GETYWEPAMYNDGFTS---
V
E
Q
E
E
K
N
------------
L
D
S
L
L
N
H
Y
R
----------
R
L
I
H
F
R
N
E
N
P
V
F
Y
-----
T
G
-
K
I
E
I
I
N
G
G
----
L
N
V
V
A
F
R
R
Y
N
D
K
R
D
L
Y
V
Y
H
N
L
V
N
R
------
P
V
K
------
I
K
V
A
S
G
-----
N
-
W
T
L
L
F
N
S
G
-
D
K
E
I
T
P
V
E
D
N
N
K
-
L
M
Y
T
I
P
A
Y
T
T
I
V
L
E
K
---
6
PsiBlast_PDB
79.66
23%
-62
- C1 -
1MW2
3
AMYS_NEIPO
A:
[61-628]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
H
L
M
P
L
F
K
CPE
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
Y
Y
I
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
EIF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
A
F
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
E
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
D
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
13
PsiBlast_PDB
79.51
23%
-62
- C1 -
1ZS2
3
AMYS_NEIPO
A:
[61-628]
-----------------------------------------------------------------
L
E
M
L
L
--------
A
Q
A
W
Q
S
Y
S
Q
R
N
S
--
S
L
K
D
I
D
I
A
R
E
N
N
PDWI
L
S
N
K
Q
--
V
G
G
V
C
Y
V
D
-
L
F
A
----
G
D
---
L
K
G
L
K
D
K
I
P
Y
F
Q
E
L
G
-----------
L
-
T
Y
L
Y
L
M
P
L
F
K
CPE
G
---
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
I
A
A
L
H
E
-----
A
G
I
S
-----
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
---------
A
A
-
G
-
D
P
L
F
D
N
F
YYI
F
P
D
R
R
M
P
D
-------
Q
------
Y
D
R
T
----
L
R
EIF
P
D
Q
------
H
P
G
G
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
A
F
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
Q
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
---
G
Q
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
--
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
G
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
GG
R
L
V
T
F
N
T
N
N
K
H
I
I
G
Y
I
R
N
N
A
L
L
A
F
G
N
F
S
E
Y
P
Q
-----
T
V
T
A
H
------
T
L
-------
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
49
Fugue
78.37
20%
-62
- C1 -
1G5A
3
AMYS_NEIPO
A:
[1-628]
SPN
S
Q
Y
L
K
T
R
I
L
DIYT
P
E
Q
R
A
G
I
E
K
S
E
D
W
R
Q
F
S
R
R
M
D
T
H
F
P
K
L
M
N
E
L
D
S
V
Y
GNNEA
L
L
P
M
L
E
M
-
L
L
A
Q
A
W
--------
Q
S
Y
-
S
Q
R
N
--
S
S
--
L
K
D
I
D
I
A
---------
R
E
N
N
P
--
D
W
I
L
S
N
K
Q
V
G
G
V
C
Y
VD
L
F
---
A
G
D
L
K
G
L
K
D
K
I
P
Y
F
Q
--------
E
L
G
L
-
T
Y
L
H
L
M
P
L
F
K
---
C
P
E
G
K
---
S
D
G
G
Y
A
V
S
S
Y
R
D
V
N
P
A
L
G
T
I
G
D
L
-----
R
E
V
-----
I
-----
A
A
L
H
E
A
G
I
S
A
V
V
D
F
I
F
N
H
T
S
N
E
H
E
W
A
Q
R
C
A
--------
A
G
-
D
-
P
L
F
D
N
F
Y
---
Y
I
F
P
D
R
R
M
-------
P
------
D
Q
Y
D
----
R
T
---
L
R
E
IFPDQH
P
G
G
-
F
S
Q
L
E
D
-
G
R
W
V
W
T
T
F
N
S
F
Q
W
D
L
N
Y
S
N
P
W
V
F
R
A
M
A
G
E
M
L
F
L
A
N
L
G
V
D
I
L
R
M
D
A
V
A
F
I
W
K
Q
M
G
T
----------------
S
C
E
------------
N
L
P
Q
A
H
A
L
I
R
A
F
N
A
V
M
R
I
A
A
P
A
V
F
F
K
S
E
A
I
V
H
P
D
-
Q
V
V
Q
Y
I
G
-
Q
--
D
E
C
Q
I
G
Y
N
P
L
Q
M
A
L
L
W
N
T
L
A
T
R
E
V
N
-------
L
L
H
Q
A
L
T
Y
R
H
N
L
P
E
H
T
A
W
V
N
Y
V
R
S
H
D
D
I
G
W
T
F
A
D
E
D
A
------
A
Y
L
G
I
S
G
Y
D
H
R
Q
F
L
-
N
------
R
F
F
V
N
R
F
D
G
S
F
A
R
G
V
P
F
Q
Y
N
P
S
T
G
---
D
C
R
V
S
G
T
--
A
A
A
L
V
G
L
A
Q
D
D
P
H
A
V
D
R
I
K
L
L
Y
S
I
A
L
S
T
G
G
L
P
L
I
Y
L
G
D
E
V
G
T
L
N
D
D
D
W
S
Q
---
D
--------
S
N
---
K
SDD
S
R
W
A
H
R
P
R
Y
N
E
A
L
Y
A
Q
R
-------------------
N
-
D
P
S
T
A
------------
A
G
Q
I
Y
Q
D
L
R
----------
H
M
I
A
V
R
Q
S
N
P
R
F
D
-----
G
G
R
L
V
T
F
N
T
N
N
----
K
H
I
I
G
Y
I
R
N
N
A
---
L
L
A
F
G
N
F
S
E
Y
------
P
Q
T
V
T
AHTL
Q
A
M
P
F
------
K
-
A
H
D
L
I
G
G
K
-
T
-----
V
---
S
LN
Q
D
L
T
L
Q
P
Y
Q
V
M
W
L
E
I
A
--
2
PsiBlast_PDB
76.29
24%
-65
- C1 -
4TVU
3
?
A:
[55-542]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
L
P
W
F
P
---
S
---
P
L--
R
D
D
G
Y
D
V
A
D
Y
R
G
I
H
P
D
L
G
T
L
D
D
F
K
V
F
L
R
E
A
H
-----
A
-----
R
G
L
W
-----
V
I
G
D
L
V
T
N
H
T
S
S
D
H
P
W
F
Q
A
A
R
RGPTLPDG
S
P
-
N
-
E
--
Y
H
D
Y
---
Y
V
W
S
D
E
G
K
-------
E
------
Y
A
D
T
RIIF
T
D
---
T
E
V
------
S
N
W
-
T
L
D
E
Q
A
-
G
K
Y
Y
W
H
R
F
F
A
S
Q
P
D
L
N
Y
D
N
P
K
V
V
E
E
L
H
G
A
A
R
F
W
L
D
L
G
L
D
G
F
R
V
D
A
V
P
Y
L
I
E
R
E
G
T
----------------
S
C
E
------------
N
L
P
E
T
H
E
I
L
K
G
F
R
A
M
V
D
R
E
Y
P
G
R
L
L
L
A
E
A
N
Q
W
P
E
-
E
V
V
E
Y
F
G
T
E
A
E
P
E
F
H
M
C
F
N
F
P
V
M
P
R
L
Y
M
S
L
K
R
E
D
T
S
-------
S
I
R
E
I
M
G
R
L
P
K
I
P
S
F
G
Q
W
C
I
F
L
R
N
H
D
E
L
T
L
E
----
M
V
------
T
D
D
E
R
A
F
M
Y
----------------
A
A
Y
A
P
D
A
-------
R
M
K
I
N
V
G
IRR
R
--------
L
A
P
L
L
D
N
D
------
R
R
R
I
E
L
L
N
T
V
L
L
A
L
P
G
S
P
V
L
Y
Y
G
D
E
I
G
M
G
D
D
L
G
L
P
D
---
R
--------
N
G
---
V
---
R
T
P
M
Q
W
N
A
G
T
S
G
G
F
S
T
A
-------------------
Q
-
P
S
D
C
F
FPPIQDPVYGFG
R
V
N
V
Q
S
Q
L
Q
DPSS
L
L
K
W
T
A
R
Q
L
E
L
R
R
A
H
P
A
F
A
-----
H
G
D
L
T
F
I
E
T
G
N
----
P
A
I
L
A
F
T
R
Q
Y
D
G
E
T
L
L
I
V
S
N
F
A
G
N
A
Q
A
G
L
L
D
L
A
------
P
F
V
G
R
------
A
-
P
V
T
L
S
G
A
S
-
P
-----
L
---
P
--
V
V
T
G
N
G
Q
Y
P
V
V
-------