@TOME V2.3
(Mar 2018)
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 : B0VTN8: (2017-12-14 )
MDVRLSDRVNAIKPSPTLAVTNKAAELKAAGKNVIGLGAGEPDFDTPQHIKDAAIEAINNGFTKYTAVDGTPGLKKAIIAKLKRDNNLDYQPNQILVSCGGKQSFFNLALALLNKGDEVIIPAPFWVSYPDMVIIAEGTPVIVKCGEEQRFKITPEQLEAAITPNTRLVVLNSPSNPTGMIYSKAELEALAEVLRRHPQVFVASDDMYEPIRWEDEFYNIATVAPDLYDRTIVLNGVSKAYAMTGWRIGYAAGPAKIIGAMKKIQSQSTSNPTSISQVAAEAALNGPQDVLKPMIEAFKRRHDLVVNGLNDIKGISCLPADGAFYAYANIRPLIRAKGLKSCTEFSEWLLEETGVAVVPGDAFGLGGFMRISYATADEVLVDALARIKKAAESIEGVDAAIASIEAEKAAK
Atome Classification :
(28 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
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MDVRLSDRVNAIKPSP
T
L
A
VTNK
A
A
E
L
KAAGK
N
V
I
GLGAGEPDFD
T
P
Q
H
I
K
D
A
A
I
E
A
I
NNGF
T
K
Y
TAVDGTP
G
L
K
K
A
I
I
A
K
L
KRDNNLDYQP-
N
Q
I
L
V
SCGGK
Q
S
F
F
N
L
A
L
A
L
LNKGD
E
V
I
I
PAPFWVSYP
D
M
V
I
IAEG
T
P
V
I
V
KCGEEQ
R
F
K
I
T
P
E
Q
L
E
A
AITPN
T
R
L
V
V
L
NSPSNPT
G
M
I
Y
S
K
A
E
L
E
A
L
A
E
V
L
R
RHP
Q
V
F
VASDDMYEPIRWED-E-FY
N
I
A
TVAPDLYD
R
T
I
V
LNGV
S
K
A
Y
AMTG
W
R
I
GYAA
G
P
A
K
I
I
G
A
M
K
K
I
Q
SQSTSNP
T
S
I
S
Q
V
A
A
E
AALN
G
P
Q
--
D
--
V
L
K
P
M
I
----
E
A
F
K
R
R
H
D
L
V
VNGLNDIKG
I
S
CLPADG
A
F
Y
A
YANI
R
P
L
----
I
R
A
K
G
L
K
S
C
T
E
F
S
E
W
L
L
E
ET
G
V
A
VVPGDAFGL--G--
G
F
M
R
I
S
YA
T
A
D
E
V
L
V
D
A
L
A
R
I
K
K
A
A
E
SI
E
G
V
D
A
A
I
A
S
I
E
A
E
KAAK
74
HHSearch
89.40
39%
-111
- C1 -
-
1O4S
2
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
------------------
21
PsiBlast_CBE
89.15
45%
-51
- C1 -
-
1J32
2
?
B:
[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
-----------------
1
PsiBlast_PDB
89.13
45%
-54
- 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
-----------------
14
PsiBlast_PDB
88.26
37%
-108
- C1 -
-
1O4S
2
AAT_THEMA
A:
[14-383]
----
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
-----------------------
46
PsiBlast_CBE
87.77
37%
-110
- C1 -
-
1O4S
2
AAT_THEMA
B:
[14-383]
----
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
-----------------------
63
HHSearch
87.43
45%
-39
* C1 *
-
1J32
2
?
B:
[1-386]
--
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
------------------
64
HHSearch
86.83
45%
-69
- C1 -
-
1BJW
-
AAT_THET8
B:
[3-381]
---
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
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
AS
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
---------------------
66
HHSearch
84.69
44%
-68
- C1 -
-
1B5P
2
AAT_THET8
B:
[4-382]
----
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
AS
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
--------------------
23
PsiBlast_CBE
84.56
44%
-73
- C1 -
-
1BKG
3
AAT_THET8
C:
[4-380]
----
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
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
EMAR
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
APDE
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
----------------------
2
PsiBlast_PDB
84.46
44%
-73
- C1 -
-
1BKG
4
AAT_THET8
A:
[4-380]
----
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
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
APD
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
----------------------
4
PsiBlast_PDB
84.16
44%
-72
- C1 -
-
1BJW
-
AAT_THET8
A:
[4-380]
----
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
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
AP
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
----------------------
24
PsiBlast_CBE
84.14
44%
-72
- C1 -
-
1BKG
3
AAT_THET8
B:
[4-380]
----
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
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
EMAR
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
APDE
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
----------------------
22
PsiBlast_CBE
83.82
44%
-71
- C1 -
-
1BKG
3
AAT_THET8
D:
[4-380]
----
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
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
EMAR
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
APDE
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
----------------------
3
PsiBlast_PDB
83.55
44%
-72
- C1 -
-
1B5O
2
AAT_THET8
A:
[4-380]
----
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
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
APD
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
----------------------
8
PsiBlast_PDB
82.76
43%
-77
- C1 -
-
1GC4
4
AAT_THET8
A:
[4-380]
----
L
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
APD
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
----------------------
5
PsiBlast_PDB
82.71
44%
-71
- C1 -
-
1GCK
4
AAT_THET8
A:
[4-380]
----
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
APD
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
----------------------
13
PsiBlast_PDB
82.65
41%
-29
- C1 -
-
1GD9
2
?
A:
[3-381]
----
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
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
--
A
GE
G
Y
V
R
I
S
Y
A
T
A
Y
E
K
L
E
E
A
M
D
R
M
E
R
----------------------
45
PsiBlast_CBE
82.56
41%
-30
- C1 -
-
1GD9
2
?
B:
[3-381]
----
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
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
WK
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
--
A
GE
G
Y
V
R
I
S
Y
A
T
A
Y
E
K
L
E
E
A
M
D
R
M
E
R
----------------------
6
PsiBlast_PDB
82.55
44%
-71
- C1 -
-
1B5P
2
AAT_THET8
A:
[4-380]
----
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
APD
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
----------------------
44
PsiBlast_CBE
82.52
41%
-28
- C1 -
-
1GDE
4
?
B:
[3-381]
----
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
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
WK
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
--
A
GE
G
Y
V
R
I
S
Y
A
T
A
Y
E
K
L
E
E
A
M
D
R
M
E
R
----------------------
12
PsiBlast_PDB
82.38
41%
-26
- C1 -
-
1GDE
4
?
A:
[3-381]
----
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
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
--
A
GE
G
Y
V
R
I
S
Y
A
T
A
Y
E
K
L
E
E
A
M
D
R
M
E
R
----------------------
69
HHSearch
82.27
41%
-24
- C1 -
-
1GDE
4
?
A:
[2-387]
---
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
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
----------------
27
PsiBlast_CBE
81.94
44%
-71
- C1 -
-
1B5P
2
AAT_THET8
B:
[4-380]
----
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
EMAR
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
APDE
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
----------------------
25
PsiBlast_CBE
81.85
44%
-73
- C1 -
-
1B5O
2
AAT_THET8
B:
[4-380]
----
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
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
EMAR
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
APDE
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
----------------------
29
PsiBlast_CBE
80.61
43%
-76
- C1 -
-
5BJ4
2
AAT_THET8
B:
[4-380]
----
L
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
EMAR
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
APDE
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
----------------------
26
PsiBlast_CBE
80.24
44%
-71
- C1 -
-
1GCK
4
AAT_THET8
B:
[4-380]
----
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
EMAR
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
APDE
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
----------------------
43
PsiBlast_CBE
79.97
41%
-34
- C1 -
-
1DJU
2
?
B:
[2-380]
----
L
S
D
R
L
E
L
V
S
-------------------
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
--
A
GE
G
Y
V
R
I
S
Y
A
T
A
Y
E
K
L
E
E
A
M
E
R
M
E
R
----------------------
11
PsiBlast_PDB
79.03
41%
-27
- C1 -
-
1DJU
2
?
A:
[2-380]
----
L
S
D
R
L
E
L
V
S
A
-----------------
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
--
A
GE
G
Y
V
R
I
S
Y
A
T
A
Y
E
K
L
E
E
A
M
E
R
M
E
R
----------------------