@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 : jhp_0615: (2015-12-16 )
MPYSSKVQSLSESATIAISTLAKELKSQGKDILSFSAGEPDFDTPQAIKDAAIKALNDGFTKYTPVAGIPELLKAIAFKLKKENNLDYEPSEILVSNGAKQSLFNAIQALIGEGDEVVIPVPFWVTYPELVKYSGGVSQFIQTDEKSHFKITPKQLKDALSPKTKMLILTTPSNPTGMLYSKAELEALGEVLKDTKVWVLSDEIYEKLVYKGEFVSCAAVSEEMKKRTITINGLSKSVAMTGWRMGYAASKDKKLVKLMSNLQSQCTSNINSITQMASIVALEGLVDKEIETMRQAFEKRCHLAHAKINAIEGLNALKPDGAFYLFINIGSLCGGDSMRFCHELLEKEGVALVPGKAFGLEGYVRLSFACSEEQIEKGIERIARFVKSKG
Atome Classification :
(33 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
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
----MPY
S
S
K
V
Q
S
LSES
A
T
I
A
I
S
T
L
A
K
E
L
K
SQGK
D
I
L
SFSAGEPDFD--
T
P
Q
A
I
K
D
A
A
I
K
A
L
ND-G--FTKYTPVA
G
I
P
E
L
L
K
A
I
A
F
K
L
KKENNLDYE---
P
-
S
E
I
L
VSNG
A
K
Q
S
L
F
N
A
I
Q
A
L
IGEG
D
E
V
V
I
PV
P
F
WVT
Y
P
E
L
V
KYSG
G
V
S
Q
F
I
QT--DEK---------S
H
F
K
I
T
P
K
Q
L
K
D
ALSPK
T
K
M
L
I
L
TTPSNPTG
M
L
Y
S
K
A
E
L
E
A
L
G
E
V
L
K
DT
K
V
W
V
L
S
D
E
I
Y
E
K
L
VY-KG-EF
V
S
C
A
A
V
S
E
E
-MKK
R
T
I
T
INGLS
K
S
V
A
MTGWRMGYAAS-
K
D
K
K
L
V
K
L
M
S
N
L
Q
S
Q
C
T
S
N
I
N
S
I
T
Q
M
A
S
I
V
A
L
--
E
-------
G
L
V
--
D
K
E
-----
I
E
T
M
R
Q
A
F
E
KRCHLAH
A
K
I
N
A
IEGLN--ALKPD
G
A
F
Y
L
F
I
N
IGSLCG---------G
D
S
M
R
F
C
H
E
L
L
E
KE
G
V
A
LVPGKAFGL-------
E
G
Y
V
R
L
S
F
AC
S
E
E
Q
I
E
K
G
I
E
R
I
A
R
F
V
KSKG
21
PsiBlast_CBE
93.33
44%
-98
- C1 -
1J32
2
?
B:
[1-384]
----
M
K
L
A
A
R
V
E
S
V
S
P
S
M
T
L
I
I
D
A
K
A
K
A
M
K
A
E
G
I
D
V
C
S
F
S
A
G
E
P
D
F
N
--
T
P
K
H
I
V
E
A
A
K
A
A
L
E
Q
-
G
--
K
T
R
Y
G
P
A
A
G
E
P
R
L
R
E
A
I
A
Q
K
L
Q
R
D
N
G
L
C
Y
G
---
A
-
D
N
I
L
V
T
N
G
G
K
Q
S
I
F
N
L
M
L
A
M
I
E
P
G
D
E
V
I
I
P
A
P
F
W
V
S
Y
P
E
M
V
K
L
A
E
G
T
P
V
I
L
P
T
--
T
V
E
---------
T
Q
F
K
V
S
P
E
Q
I
R
Q
A
I
T
P
K
T
K
L
L
V
F
N
T
P
S
N
P
T
G
M
V
Y
T
P
D
E
V
R
A
I
A
Q
V
A
V
E
A
G
L
W
V
L
S
D
E
I
Y
E
K
I
L
Y
D
D
A
-
Q
H
L
S
I
G
A
A
S
P
E
-
A
Y
E
R
S
V
V
C
S
G
F
A
K
T
Y
A
M
T
G
W
R
V
G
F
L
A
G
-
P
-
V
P
L
V
K
A
A
T
K
I
Q
G
H
S
T
S
N
V
C
T
F
A
Q
Y
G
A
I
A
A
Y
--
E
-------
N
S
Q
--
D
C
------
V
Q
E
M
L
A
A
F
A
E
R
R
R
Y
M
L
D
A
L
N
A
M
P
G
L
E
--
C
P
K
P
D
G
A
F
Y
M
F
P
S
I
A
K
-
T
G
---------
R
S
S
L
D
F
C
S
E
L
L
D
Q
H
Q
V
A
T
V
P
G
A
A
F
G
A
-------
D
D
C
I
R
L
S
Y
A
T
D
L
D
T
I
K
R
G
M
E
R
L
E
K
F
L
H
G
I
L
4
PsiBlast_PDB
92.23
43%
-101
- C1 -
1BJW
1
AAT_THET8
A:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
S
A
T
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
K
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
S
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
A
S
R
A
F
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
55
HHSearch
92.13
45%
-93
- C1 -
1J32
2
?
A:
[1-387]
----
M
K
L
A
A
R
V
E
S
V
S
P
S
M
T
L
I
I
D
A
K
A
K
A
M
K
A
E
G
I
D
V
C
S
F
S
A
G
E
P
D
F
N
--
T
P
K
H
I
V
E
A
A
K
A
A
L
E
Q
-
G
--
K
T
R
Y
G
P
A
A
G
E
P
R
L
R
E
A
I
A
Q
K
L
Q
R
D
N
G
L
C
Y
G
A--
D
--
N
I
L
V
T
N
G
G
K
Q
S
I
F
N
L
M
L
A
M
I
E
P
G
D
E
V
I
I
P
A
P
F
W
V
S
Y
P
E
M
V
K
L
A
E
G
T
P
V
I
L
P
T
--
T
V
E
---------
T
Q
F
K
V
S
P
E
Q
I
R
Q
A
I
T
P
K
T
K
L
L
V
F
N
T
P
S
N
P
T
G
M
V
Y
T
P
D
E
V
R
A
I
A
Q
V
A
V
E
A
G
L
W
V
L
S
D
E
I
Y
E
K
I
L
Y
-
D
D
A
Q
H
L
S
I
G
A
A
S
P
E
-
A
Y
E
R
S
V
V
C
S
G
F
A
K
T
Y
A
M
T
G
W
R
V
G
F
L
A
G
-
P
V
-
P
L
V
K
A
A
T
K
I
Q
G
H
S
T
S
N
V
C
T
F
A
Q
Y
G
A
I
A
A
Y
--
E
-------
N
S
---
Q
D
C
-----
V
Q
E
M
L
A
A
F
A
E
R
R
R
Y
M
L
D
A
L
N
A
M
P
G
L
E
--
C
P
K
P
D
G
A
F
Y
M
F
P
S
I
A
K
T
G
----------
R
S
S
L
D
F
C
S
E
L
L
D
Q
H
Q
V
A
T
V
P
G
A
A
F
G
A
-------
D
D
C
I
R
L
S
Y
A
T
D
L
D
T
I
K
R
G
M
E
R
L
E
K
F
L
H
G
I
L
56
HHSearch
91.02
42%
-96
* C1 *
1B5P
3
AAT_THET8
A:
[3-382]
-----
G
L
S
R
R
V
Q
A
M
K
P
S
A
T
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
P--
E
--
E
T
I
V
T
V
G
G
S
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
---
V
-
A
P
E
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
K
-
E
V
I
K
A
M
A
S
V
S
R
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
L
E
A
L
--
T
-------
N
Q
E
A
S
R
A
F
-----
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
-
E
A
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
1
PsiBlast_PDB
90.73
44%
-97
- C1 -
1J32
2
?
A:
[1-384]
----
M
K
L
A
A
R
V
E
S
V
S
P
S
M
T
L
I
I
D
A
K
A
K
A
M
K
A
E
G
I
D
V
C
S
F
S
A
G
E
P
D
F
N
--
T
P
K
H
I
V
E
A
A
K
A
A
L
E
Q
-
G
--
K
T
R
Y
G
P
A
A
G
E
P
R
L
R
E
A
I
A
Q
K
L
Q
R
D
N
G
L
C
Y
G
---
A
-
D
N
I
L
V
T
N
G
G
K
Q
S
I
F
N
L
M
L
A
M
I
E
P
G
D
E
V
I
I
P
A
P
F
W
V
S
Y
P
E
M
V
K
L
A
E
G
T
P
V
I
L
P
T
--
T
V
E
---------
T
Q
F
K
V
S
P
E
Q
I
R
Q
A
I
T
P
K
T
K
L
L
V
F
N
T
P
S
N
P
T
G
M
V
Y
T
P
D
E
V
R
A
I
A
Q
V
A
V
E
A
G
L
W
V
L
S
D
E
I
Y
E
K
I
L
Y
D
D
A
-
Q
H
L
S
I
G
A
A
S
P
E
-
A
Y
E
R
S
V
V
C
S
G
F
A
K
T
Y
A
M
T
G
W
R
V
G
F
L
A
G
-
P
-
V
P
L
V
K
A
A
T
K
I
Q
G
H
S
T
S
N
V
C
T
F
A
Q
Y
G
A
I
A
A
Y
--
E
-------
N
S
Q
--
D
C
------
V
Q
E
M
L
A
A
F
A
E
R
R
R
Y
M
L
D
A
L
N
A
M
P
G
L
E
--
C
P
K
P
D
G
A
F
Y
M
F
P
S
I
A
K
-
T
G
---------
R
S
S
L
D
F
C
S
E
L
L
D
Q
H
Q
V
A
T
V
P
G
A
A
F
G
A
-------
D
D
C
I
R
L
S
Y
A
T
D
L
D
T
I
K
R
G
M
E
R
L
E
K
F
L
H
G
I
L
31
PsiBlast_CBE
90.53
42%
-99
- C1 -
1GC4
4
AAT_THET8
B:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
D
A
V
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
S
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
R
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
ASRAF
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
29
PsiBlast_CBE
90.29
42%
-98
- C1 -
1GC4
4
AAT_THET8
D:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
D
A
V
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
S
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
R
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
ASRAF
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
25
PsiBlast_CBE
90.25
43%
-99
- C1 -
1B5O
3
AAT_THET8
B:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
S
A
T
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
S
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
S
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
ASRAF
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
48
Fugue
90.23
42%
-105
- C1 -
1BJW
1
AAT_THET8
A:
[1-382]
M
R
G
L
S
R
R
V
Q
A
M
K
---
P
S
A
T
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
--FD
T
P
E
H
V
K
E
A
A
R
R
A
L
A
---
Q
G
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
---SVT
P
-
E
E
T
I
V
T
V
G
G
K
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
-
A
G
G
V
-
V
V
E
V
E
T
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
----V
A
P
E
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
P
--
K
E
V
I
K
A
M
A
S
V
S
S
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
L
E
A
L
T
N
Q
-------
E
A
S
--
R
A
F
-----
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
A
V--
R
P
S
G
A
F
Y
V
L
M
D
T
S
----PIA------
P
D
E
V
R
A
A
E
R
L
L
E
-
A
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
22
PsiBlast_CBE
90.19
43%
-94
- C1 -
1BKG
3
AAT_THET8
D:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
S
A
T
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
K
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
S
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
ASRAF
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
8
PsiBlast_PDB
90.15
42%
-98
- C1 -
1GC4
4
AAT_THET8
A:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
D
A
V
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
S
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
R
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
A
S
R
A
F
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
27
PsiBlast_CBE
90.07
42%
-98
- C1 -
1B5P
3
AAT_THET8
B:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
S
A
T
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
S
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
R
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
ASRAF
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
23
PsiBlast_CBE
89.94
43%
-95
- C1 -
1BKG
3
AAT_THET8
C:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
S
A
T
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
K
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
S
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
ASRAF
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
30
PsiBlast_CBE
89.73
42%
-98
- C1 -
1GC4
4
AAT_THET8
C:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
D
A
V
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
S
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
R
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
ASRAF
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
3
PsiBlast_PDB
89.58
43%
-97
- C1 -
1B5O
3
AAT_THET8
A:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
S
A
T
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
S
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
S
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
A
S
R
A
F
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
24
PsiBlast_CBE
89.47
43%
-94
- C1 -
1BKG
3
AAT_THET8
B:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
S
A
T
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
K
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
S
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
ASRAF
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
2
PsiBlast_PDB
89.41
43%
-94
- C1 -
1BKG
4
AAT_THET8
A:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
S
A
T
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
K
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
S
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
A
S
R
A
F
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
6
PsiBlast_PDB
88.41
42%
-98
- C1 -
1B5P
3
AAT_THET8
A:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
S
A
T
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
S
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
R
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
A
S
R
A
F
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
34
PsiBlast_CBE
88.36
42%
-105
- C1 -
1GC3
4
AAT_THET8
F:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
D
A
V
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
S
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
R
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
ASRAF
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
42
PsiBlast_CBE
88.16
39%
-101
- C1 -
1O4S
4
AAT_THEMA
B:
[15-388]
-------
S
R
R
I
S
E
I
P
I
S
K
T
M
E
L
D
A
K
A
K
A
L
I
K
K
G
E
D
V
I
N
L
T
A
G
E
P
D
F
P
--
T
P
E
P
V
V
E
E
A
V
R
F
L
Q
K
-
G
--
E
V
K
Y
T
D
P
R
G
I
Y
E
L
R
E
G
I
A
K
R
I
G
E
R
Y
K
K
D
I
S
---
P
-
D
Q
V
V
V
T
N
G
A
K
Q
A
L
F
N
A
F
M
A
L
L
D
P
G
D
E
V
I
V
F
S
P
V
W
V
S
Y
I
P
Q
I
I
L
A
G
G
T
V
N
V
V
E
T
--
F
M
S
---------
K
N
F
Q
P
S
L
E
E
V
E
G
L
L
V
G
K
T
K
A
V
L
I
N
S
P
N
N
P
T
G
V
V
Y
R
R
E
F
L
E
G
L
V
R
L
A
K
K
R
N
F
Y
I
I
S
D
E
V
Y
D
S
L
V
Y
-
T
D
-
E
F
T
S
I
L
D
V
S
E
G
-
F
-
D
R
I
V
Y
I
N
G
F
S
K
S
H
S
M
T
G
W
R
V
G
Y
L
I
S
-
S
E
-
K
V
A
T
A
V
S
K
I
Q
S
H
T
T
S
C
I
N
T
V
A
Q
Y
A
A
L
K
A
L
--
E
---------
V
--
D
N
S
-----
Y
--
M
V
Q
T
F
K
E
R
K
N
F
V
V
E
R
L
K
K
M
-
G
V
K
--
F
V
E
P
E
G
A
F
Y
L
F
F
K
V
----
R
---------
G
D
D
V
K
F
C
E
R
L
L
E
E
K
K
V
A
L
V
P
G
S
A
F
L
K
-------
P
G
F
V
R
L
S
F
A
T
S
I
E
R
L
T
E
A
L
D
R
I
E
D
F
L
N
S
--
26
PsiBlast_CBE
87.52
42%
-94
- C1 -
1GCK
4
AAT_THET8
B:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
S
A
T
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
S
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
R
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
ASRAF
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
11
PsiBlast_PDB
87.10
39%
-100
- C1 -
1O4S
8
AAT_THEMA
A:
[15-388]
-------
S
R
R
I
S
E
I
P
I
S
K
T
M
E
L
D
A
K
A
K
A
L
I
K
K
G
E
D
V
I
N
L
T
A
G
E
P
D
F
P
--
T
P
E
P
V
V
E
E
A
V
R
F
L
Q
K
-
G
--
E
V
K
Y
T
D
P
R
G
I
Y
E
L
R
E
G
I
A
K
R
I
G
E
R
Y
K
K
D
I
S
---
P
-
D
Q
V
V
V
T
N
G
A
K
Q
A
L
F
N
A
F
M
A
L
L
D
P
G
D
E
V
I
V
F
S
P
V
W
V
S
Y
I
P
Q
I
I
L
A
G
G
T
V
N
V
V
E
T
--
F
M
S
---------
K
N
F
Q
P
S
L
E
E
V
E
G
L
L
V
G
K
T
K
A
V
L
I
N
S
P
N
N
P
T
G
V
V
Y
R
R
E
F
L
E
G
L
V
R
L
A
K
K
R
N
F
Y
I
I
S
D
E
V
Y
D
S
L
V
Y
-
T
D
-
E
F
T
S
I
L
D
V
S
E
G
-
F
-
D
R
I
V
Y
I
N
G
F
S
K
S
H
S
M
T
G
W
R
V
G
Y
L
I
S
-
S
E
-
K
V
A
T
A
V
S
K
I
Q
S
H
T
T
S
C
I
N
T
V
A
Q
Y
A
A
L
K
A
L
--
E
---------
V
--
D
N
S
-----
Y
--
M
V
Q
T
F
K
E
R
K
N
F
V
V
E
R
L
K
K
M
-
G
V
K
--
F
V
E
P
E
G
A
F
Y
L
F
F
K
V
----
R
---------
G
D
D
V
K
F
C
E
R
L
L
E
E
K
K
V
A
L
V
P
G
S
A
F
L
K
-------
P
G
F
V
R
L
S
F
A
T
S
I
E
R
L
T
E
A
L
D
R
I
E
D
F
L
N
S
--
5
PsiBlast_PDB
86.67
42%
-98
- C1 -
1GCK
4
AAT_THET8
A:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
S
A
T
V
A
V
N
A
K
A
L
E
L
R
R
Q
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
S
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
R
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
A
S
R
A
F
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
28
PsiBlast_CBE
86.40
42%
-98
- C1 -
5BJ4
3
AAT_THET8
B:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
----------------
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
S
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
R
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
ASRAF
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
9
PsiBlast_PDB
83.90
42%
-98
- C1 -
5BJ4
3
AAT_THET8
A:
[5-382]
-------
S
R
R
V
Q
A
M
K
P
----------------
G
V
D
L
V
A
L
T
A
G
E
P
D
F
D
--
T
P
E
H
V
K
E
A
A
R
R
A
L
A
Q
-
G
--
K
T
K
Y
A
P
P
A
G
I
P
E
L
R
E
A
L
A
E
K
F
R
R
E
N
G
L
S
V
T
---
P
-
E
E
T
I
V
T
V
G
G
S
Q
A
L
F
N
L
F
Q
A
I
L
D
P
G
D
E
V
I
V
L
S
P
Y
W
V
S
Y
P
E
M
V
R
F
A
G
G
V
V
V
E
V
E
T
--
L
P
E
---------
E
G
F
V
P
D
P
E
R
V
R
R
A
I
T
P
R
T
K
A
L
V
V
N
S
P
N
N
P
T
G
A
V
Y
P
K
E
V
L
E
A
L
A
R
L
A
V
E
H
D
F
Y
L
V
S
D
E
I
Y
E
H
L
L
Y
-
E
G
-
E
H
F
S
P
G
R
V
A
P
E
----
H
T
L
T
V
N
G
A
A
K
A
F
A
M
T
G
W
R
I
G
Y
A
C
G
-
P
-
K
E
V
I
K
A
M
A
S
V
S
R
Q
S
T
T
S
P
D
T
I
A
Q
W
A
T
---
L
--
E
-------
A
L
T
--
N
Q
E
A
S
R
A
F
V
E
M
A
R
E
A
Y
R
R
R
R
D
L
L
L
E
G
L
T
A
L
-
G
L
K
--
A
V
R
P
S
G
A
F
Y
V
L
M
D
T
S
P
I
A
----------
P
D
E
V
R
A
A
E
R
L
L
E
A
-
G
V
A
V
V
P
G
T
D
F
A
A
-------
F
G
H
V
R
L
S
Y
A
T
S
E
E
N
L
R
K
A
L
E
R
F
A
R
V
L
----
58
HHSearch
83.02
38%
-95
- C1 -
1O4S
8
AAT_THEMA
A:
[14-388]
------
V
S
R
R
I
S
E
I
P
I
S
K
T
M
E
L
D
A
K
A
K
A
L
I
K
K
G
E
D
V
I
N
L
T
A
G
E
P
D
F
P
--
T
P
E
P
V
V
E
E
A
V
R
F
L
Q
K
-
G
--
E
V
K
Y
T
D
P
R
G
I
Y
E
L
R
E
G
I
A
K
R
I
G
E
R
Y
K
K
D
I
S
P--
D
--
Q
V
V
V
T
N
G
A
K
Q
A
L
F
N
A
F
M
A
L
L
D
P
G
D
E
V
I
V
F
S
P
V
W
V
S
Y
I
P
Q
I
I
L
A
G
G
T
V
N
V
V
E
T
--
F
M
S
---------
K
N
F
Q
P
S
L
E
E
V
E
G
L
L
V
G
K
T
K
A
V
L
I
N
S
P
N
N
P
T
G
V
V
Y
R
R
E
F
L
E
G
L
V
R
L
A
K
K
R
N
F
Y
I
I
S
D
E
V
Y
D
S
L
V
Y
-
T
D
-
E
F
T
S
I
L
D
-
V
S
E
-
G
F
D
R
I
V
Y
I
N
G
F
S
K
S
H
S
M
T
G
W
R
V
G
Y
L
I
S
-
S
E
-
K
V
A
T
A
V
S
K
I
Q
S
H
T
T
S
C
I
N
T
V
A
Q
Y
A
A
L
K
A
L
--
E
-------
V
D
---
N
S
--------
Y
M
V
Q
T
F
K
E
R
K
N
F
V
V
E
R
L
K
K
M
-
G
V
K
--
F
V
E
P
E
G
A
F
Y
L
F
F
K
V
R
G
D
-------------
D
V
K
F
C
E
R
L
L
E
E
K
K
V
A
L
V
P
G
S
A
F
L
K
-------
P
G
F
V
R
L
S
F
A
T
S
I
E
R
L
T
E
A
L
D
R
I
E
D
F
L
N
S
--
57
HHSearch
78.88
38%
-92
- C1 -
1GD9
2
?
A:
[2-386]
-----
A
L
S
D
R
L
E
L
V
S
A
S
E
I
R
K
L
F
D
I
----
A
A
G
M
K
D
V
I
S
L
G
I
G
E
P
D
F
D
--
T
P
Q
H
I
K
E
Y
A
K
E
A
L
D
K
-
G
--
L
T
H
Y
G
P
N
I
G
L
L
E
L
R
E
A
I
A
E
K
L
K
K
Q
N
G
I
E
A
D
PK-
T
--
E
I
M
V
L
L
G
A
N
Q
A
F
L
M
G
L
S
A
F
L
K
D
G
E
E
V
L
I
P
T
P
A
F
V
S
Y
A
P
A
V
I
L
A
G
G
K
P
V
E
V
P
T
--
Y
E
E
---------
D
E
F
R
L
N
V
D
E
L
K
K
Y
V
T
D
K
T
R
A
L
I
I
N
S
P
C
N
P
T
G
A
V
L
T
K
K
D
L
E
E
I
A
D
F
V
V
E
H
D
L
I
V
I
S
D
E
V
Y
E
H
F
I
Y
-
D
D
A
R
H
Y
S
I
A
S
-
L
D
G
-
M
F
E
R
T
I
T
V
N
G
F
S
K
T
F
A
M
T
G
W
R
L
G
F
V
A
A
-
P
S
-
W
I
I
E
R
M
V
K
F
Q
M
Y
N
A
T
C
P
V
T
F
I
Q
Y
A
A
A
K
A
L
--
K
-------
D
E
R
S
-
W
K
A
-----
V
E
E
M
R
K
E
Y
D
R
R
R
K
L
V
W
K
R
L
N
E
M
-
G
L
P
--
T
V
K
P
K
G
A
F
Y
I
F
P
R
I
R
D
T
G
----------
L
T
S
K
K
F
S
E
L
M
L
K
E
A
R
V
A
V
V
P
G
S
A
F
G
K
AG-----
E
G
Y
V
R
I
S
Y
A
T
A
Y
E
K
L
E
E
A
M
D
R
M
E
R
V
L
K
E
R
K
12
PsiBlast_PDB
73.59
38%
-95
- C1 -
1DJU
2
?
A:
[25-385]
---------------------------------
K
D
V
I
S
L
G
I
G
E
P
D
F
D
--
T
P
Q
H
I
K
E
Y
A
K
E
A
L
D
K
-
G
--
L
T
H
Y
G
P
N
I
G
L
L
E
L
R
E
A
I
A
E
K
L
K
K
Q
N
G
I
E
A
D
---
P
K
T
E
I
M
V
L
L
G
A
N
Q
A
F
L
M
G
L
S
A
F
L
K
D
G
E
E
V
L
I
P
T
P
A
F
V
S
Y
A
P
A
V
I
L
A
G
G
K
P
V
E
V
P
T
--
Y
E
E
---------
D
E
F
R
L
N
V
D
E
L
K
K
Y
V
T
D
K
T
R
A
L
I
I
N
S
P
C
N
P
T
G
A
V
L
T
K
K
D
L
E
E
I
A
D
F
V
V
E
H
D
L
I
V
I
S
D
E
V
Y
E
H
F
I
Y
-
D
D
-
A
R
H
Y
S
I
A
S
L
D
G
-
M
F
E
R
T
I
T
V
N
G
F
S
K
T
F
A
M
T
G
W
R
L
G
F
V
A
A
-
P
S
W
I
I
E
R
M
V
K
F
Q
M
Y
N
A
T
C
P
V
T
F
I
Q
Y
A
A
A
K
A
L
K
--
D
-------
E
R
S
--
W
K
A
-----
V
E
E
M
R
K
E
Y
D
R
R
R
K
L
V
W
K
R
L
N
E
M
-
G
L
P
--
T
V
K
P
K
G
A
F
Y
I
F
P
R
I
R
D
-
T
G
---------
L
T
S
K
K
F
S
E
L
M
L
K
E
A
R
V
A
V
V
P
G
S
A
F
G
K
AG-----
E
G
Y
V
R
I
S
Y
A
T
A
Y
E
K
L
E
E
A
M
E
R
M
E
R
V
L
K
E
R
K
43
PsiBlast_CBE
72.65
37%
-91
- C1 -
1GDE
4
?
B:
[26-386]
---------------------------------
K
D
V
I
S
L
G
I
G
E
P
D
F
D
--
T
P
Q
H
I
K
E
Y
A
K
E
A
L
D
K
-
G
--
L
T
H
Y
G
P
N
I
G
L
L
E
L
R
E
A
I
A
E
K
L
K
K
Q
N
G
I
E
A
D
---
P
K
T
E
I
M
V
L
L
G
A
N
Q
A
F
L
M
G
L
S
A
F
L
K
D
G
E
E
V
L
I
P
T
P
A
F
V
S
Y
A
P
A
V
I
L
A
G
G
K
P
V
E
V
P
T
--
Y
E
E
---------
D
E
F
R
L
N
V
D
E
L
K
K
Y
V
T
D
K
T
R
A
L
I
I
N
S
P
C
N
P
T
G
A
V
L
T
K
K
D
L
E
E
I
A
D
F
V
V
E
H
D
L
I
V
I
S
D
E
V
Y
E
H
F
I
Y
-
D
D
-
A
R
H
Y
S
I
A
S
L
D
G
-
M
F
E
R
T
I
T
V
N
G
F
S
K
T
F
A
M
T
G
W
R
L
G
F
V
A
A
-
P
S
W
I
I
E
R
M
V
K
F
Q
M
Y
N
A
T
C
P
V
T
F
I
Q
Y
A
A
A
K
A
L
K
--
D
-------
E
R
S
--
W
K
A
-----
V
E
E
M
R
K
E
Y
D
R
R
R
K
L
V
W
K
R
L
N
E
M
-
G
L
P
--
T
V
K
P
K
G
A
F
Y
I
F
P
R
I
R
D
-
T
G
---------
L
T
S
K
K
F
S
E
L
M
L
K
E
A
R
V
A
V
V
P
G
S
A
F
G
K
AG-----
E
G
Y
V
R
I
S
Y
A
T
A
Y
E
K
L
E
E
A
M
D
R
M
E
R
V
L
K
E
R
K
13
PsiBlast_PDB
72.30
37%
-91
- C1 -
1GDE
4
?
A:
[26-386]
---------------------------------
K
D
V
I
S
L
G
I
G
E
P
D
F
D
--
T
P
Q
H
I
K
E
Y
A
K
E
A
L
D
K
-
G
--
L
T
H
Y
G
P
N
I
G
L
L
E
L
R
E
A
I
A
E
K
L
K
K
Q
N
G
I
E
A
D
---
P
K
T
E
I
M
V
L
L
G
A
N
Q
A
F
L
M
G
L
S
A
F
L
K
D
G
E
E
V
L
I
P
T
P
A
F
V
S
Y
A
P
A
V
I
L
A
G
G
K
P
V
E
V
P
T
--
Y
E
E
---------
D
E
F
R
L
N
V
D
E
L
K
K
Y
V
T
D
K
T
R
A
L
I
I
N
S
P
C
N
P
T
G
A
V
L
T
K
K
D
L
E
E
I
A
D
F
V
V
E
H
D
L
I
V
I
S
D
E
V
Y
E
H
F
I
Y
-
D
D
-
A
R
H
Y
S
I
A
S
L
D
G
-
M
F
E
R
T
I
T
V
N
G
F
S
K
T
F
A
M
T
G
W
R
L
G
F
V
A
A
-
P
S
W
I
I
E
R
M
V
K
F
Q
M
Y
N
A
T
C
P
V
T
F
I
Q
Y
A
A
A
K
A
L
K
--
D
-------
E
R
S
--
W
K
A
-----
V
E
E
M
R
K
E
Y
D
R
R
R
K
L
V
W
K
R
L
N
E
M
-
G
L
P
--
T
V
K
P
K
G
A
F
Y
I
F
P
R
I
R
D
-
T
G
---------
L
T
S
K
K
F
S
E
L
M
L
K
E
A
R
V
A
V
V
P
G
S
A
F
G
K
AG-----
E
G
Y
V
R
I
S
Y
A
T
A
Y
E
K
L
E
E
A
M
D
R
M
E
R
V
L
K
E
R
K
44
PsiBlast_CBE
71.64
37%
-92
- C1 -
1GD9
2
?
B:
[26-386]
---------------------------------
K
D
V
I
S
L
G
I
G
E
P
D
F
D
--
T
P
Q
H
I
K
E
Y
A
K
E
A
L
D
K
-
G
--
L
T
H
Y
G
P
N
I
G
L
L
E
L
R
E
A
I
A
E
K
L
K
K
Q
N
G
I
E
A
D
---
P
K
T
E
I
M
V
L
L
G
A
N
Q
A
F
L
M
G
L
S
A
F
L
K
D
G
E
E
V
L
I
P
T
P
A
F
V
S
Y
A
P
A
V
I
L
A
G
G
K
P
V
E
V
P
T
--
Y
E
E
---------
D
E
F
R
L
N
V
D
E
L
K
K
Y
V
T
D
K
T
R
A
L
I
I
N
S
P
C
N
P
T
G
A
V
L
T
K
K
D
L
E
E
I
A
D
F
V
V
E
H
D
L
I
V
I
S
D
E
V
Y
E
H
F
I
Y
-
D
D
-
A
R
H
Y
S
I
A
S
L
D
G
-
M
F
E
R
T
I
T
V
N
G
F
S
K
T
F
A
M
T
G
W
R
L
G
F
V
A
A
-
P
S
W
I
I
E
R
M
V
K
F
Q
M
Y
N
A
T
C
P
V
T
F
I
Q
Y
A
A
A
K
A
L
K
--
D
-------
E
R
S
--
W
K
A
-----
V
E
E
M
R
K
E
Y
D
R
R
R
K
L
V
W
K
R
L
N
E
M
-
G
L
P
--
T
V
K
P
K
G
A
F
Y
I
F
P
R
I
R
D
-
T
G
---------
L
T
S
K
K
F
S
E
L
M
L
K
E
A
R
V
A
V
V
P
G
S
A
F
G
K
AG-----
E
G
Y
V
R
I
S
Y
A
T
A
Y
E
K
L
E
E
A
M
D
R
M
E
R
V
L
K
E
R
K
14
PsiBlast_PDB
70.68
37%
-93
- C1 -
1GD9
2
?
A:
[26-386]
---------------------------------
K
D
V
I
S
L
G
I
G
E
P
D
F
D
--
T
P
Q
H
I
K
E
Y
A
K
E
A
L
D
K
-
G
--
L
T
H
Y
G
P
N
I
G
L
L
E
L
R
E
A
I
A
E
K
L
K
K
Q
N
G
I
E
A
D
---
P
K
T
E
I
M
V
L
L
G
A
N
Q
A
F
L
M
G
L
S
A
F
L
K
D
G
E
E
V
L
I
P
T
P
A
F
V
S
Y
A
P
A
V
I
L
A
G
G
K
P
V
E
V
P
T
--
Y
E
E
---------
D
E
F
R
L
N
V
D
E
L
K
K
Y
V
T
D
K
T
R
A
L
I
I
N
S
P
C
N
P
T
G
A
V
L
T
K
K
D
L
E
E
I
A
D
F
V
V
E
H
D
L
I
V
I
S
D
E
V
Y
E
H
F
I
Y
-
D
D
-
A
R
H
Y
S
I
A
S
L
D
G
-
M
F
E
R
T
I
T
V
N
G
F
S
K
T
F
A
M
T
G
W
R
L
G
F
V
A
A
-
P
S
W
I
I
E
R
M
V
K
F
Q
M
Y
N
A
T
C
P
V
T
F
I
Q
Y
A
A
A
K
A
L
K
--
D
-------
E
R
S
--
W
K
A
-----
V
E
E
M
R
K
E
Y
D
R
R
R
K
L
V
W
K
R
L
N
E
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-
G
L
P
--
T
V
K
P
K
G
A
F
Y
I
F
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R
I
R
D
-
T
G
---------
L
T
S
K
K
F
S
E
L
M
L
K
E
A
R
V
A
V
V
P
G
S
A
F
G
K
AG-----
E
G
Y
V
R
I
S
Y
A
T
A
Y
E
K
L
E
E
A
M
D
R
M
E
R
V
L
K
E
R
K
70
HHSearch
65.44
30%
-93
- C1 -
3E2Y
6
KAT3_MOUSE
A:
[12-409]
---------------------
V
W
V
E
F
T
K
L
A
-
A
D
P
S
V
V
N
L
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--
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PN-
E
--
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PTDGMKWTS
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M
D
D
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---
E
C
Y
-----
F
N
S
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--
P
I
V
P
D
G
G
Y
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L
G
A
DLSDMNSDE
P
Y
D
Y
K
F
V
K
W
M
T
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H
K
K
L
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A
I
P
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F
C
F
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K
K
D
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A
A
E
E
I
F
R
A
W
N
----