@TOME V2.3
(Nov 2016)
Ref.
-
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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 : SA0477: (2016-03-15 )
MSKIIGSDRVKRGMAEMQKGGVIMDVVNAEQARIAEEAGAVAVMALERVPSDIRAAGGVARMANPKIVEEVMNAVSIPVMAKARIGHITEARVLEAMGVDYIDESEVLTPADEEYHLRKDQFTVPFVCGCRNLGEAARRIGEGAAMLRTKGEPGTGNIVEAVRHMRQVNSEVSRLTVMNDDEIMTFAKDIGAPYEILKQIKDNGRLPVVNFAAGGVATPQDAALMMELGADGVFVGSGIFKSEDPEKFAKAIVQATTHYQDYELIGRLASELGTAMKGLDINQLSLEERMQERGW
Atome Classification :
(30 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...
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MSKII
G
S
D
R
V
K
R
G
M
A
E
M
QKG
G
V
I
M
D
VVN
A
E
Q
A
R
I
A
E
EA
G
A
V
A
V
M
A
L
E
RV
P
S
D
I
R
AAGGVARMA
N
P
K
I
V
E
E
V
M
N
AVSI
P
V
M
A
KARIGH
I
T
E
A
R
V
L
E
A
MGVDYIDESEVLTP-ADEEYHLRKDQFT
V
P
F
VCGC
R
N
L
G
E
A
A
R
R
IGEG
A
A
M
L
RTKGEPGT
G
N
I
V
E
A
V
R
H
M
R
Q
V
N
S
E
V
S
R
L
T
VMN
D
D
E
-
I
----------------------------------
M
-
T
F
A
-
K
D-IG
A
P
Y
E
I
L
K
Q
I
KDNGR
L
P
V
V
N
--F--AAGGVATP
Q
D
A
A
L
M
M
E
LGAD
G
V
F
VGSGIFKSE
D
P
E
K
F
A
K
A
I
V
Q
A
TTH
Y
Q
D
Y
E
L
I
G
R
L
A
S
E
L
G
T
A
MKGLD
I
N
Q
L
S
L
E
E
R
M
Q
ERGW
5
PsiBlast_PDB
93.41
77%
-96
- C4 -
4WXY
-
PDXS_GEOKA
A:
[13-300]
---
L
T
G
T
D
R
V
K
R
G
M
A
E
M
Q
K
G
G
V
I
M
D
V
V
N
A
E
Q
A
K
I
A
E
A
A
G
A
V
A
V
M
A
L
E
R
V
P
A
D
I
R
A
A
G
G
V
A
R
M
A
D
P
T
V
I
E
E
V
M
N
A
V
S
I
P
V
M
A
-
V
R
I
G
H
Y
V
E
A
R
V
L
E
A
L
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
I
D
K
R
Q
F
T
V
P
F
V
C
G
C
R
D
L
G
E
A
A
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
I
R
K
V
V
N
M
S
E
D
E
-
L
----------------------------------
V
-
A
E
A
-
K
Q
-
L
G
A
P
V
E
V
L
R
E
I
K
R
L
G
R
L
P
V
V
N
--
F
--
A
A
G
G
V
T
T
P
A
D
A
A
L
M
M
H
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
E
N
P
E
K
Y
A
R
A
I
V
E
A
T
T
H
Y
E
D
Y
E
L
I
A
H
L
S
K
G
L
G
G
A
M
R
G
I
D
I
A
T
L
L
P
E
H
R
M
Q
----
2
PsiBlast_PDB
92.56
80%
-107
- C4 -
2NV2
1
PDXS_BACSU
A:
[5-269]
-----
G
T
E
R
V
K
R
G
M
A
E
M
Q
K
G
G
V
I
M
D
V
I
N
A
E
Q
A
K
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
V
P
A
D
I
R
A
A
G
G
V
A
R
M
A
D
P
T
I
V
E
E
V
M
N
A
V
S
I
P
V
M
A
K
A
R
I
G
H
I
V
E
A
R
V
L
E
A
M
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
L
N
K
N
E
Y
T
V
P
F
V
C
G
C
R
D
L
G
E
A
T
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
V
R
K
V
V
A
M
S
E
D
E
-
L
----------------------------------
M
-
T
E
A
-
K
N
-
L
G
A
P
Y
E
L
L
L
Q
I
K
K
D
G
K
L
P
V
V
N
--
F
--
A
A
G
G
V
A
T
P
A
D
A
A
L
M
M
Q
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
D
N
P
A
K
F
A
K
A
I
V
E
A
T
T
H
F
T
D
Y
K
L
I
A
E
L
S
K
-------------------------
26
PsiBlast_CBE
92.48
80%
-102
- C4 -
2NV2
32
PDXS_BACSU
W:
[5-271]
-----
G
T
E
R
V
K
R
G
M
A
E
M
Q
K
G
G
V
I
M
D
V
I
N
A
E
Q
A
K
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
V
P
A
D
I
R
A
A
G
G
V
A
R
M
A
D
P
T
I
V
E
E
V
M
N
A
V
S
I
P
V
M
A
K
A
R
I
G
H
I
V
E
A
R
V
L
E
A
M
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
L
N
K
N
E
Y
T
V
P
F
V
C
G
C
R
D
L
G
E
A
T
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
V
R
K
V
V
A
M
S
E
D
E
-
L
----------------------------------
M
-
T
E
A
-
K
N
-
L
G
A
P
Y
E
L
L
L
Q
I
K
K
D
G
K
L
P
V
V
N
--
F
--
A
A
G
G
V
A
T
P
A
D
A
A
L
M
M
Q
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
D
N
P
A
K
F
A
K
A
I
V
E
A
T
T
H
F
T
D
Y
K
L
I
A
E
L
S
K
E
L
-----------------------
36
PsiBlast_CBE
92.26
80%
-103
- C4 -
2NV2
1
PDXS_BACSU
C:
[5-270]
-----
G
T
E
R
V
K
R
G
M
A
E
M
Q
K
G
G
V
I
M
D
V
I
N
A
E
Q
A
K
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
V
P
A
D
I
R
A
A
G
G
V
A
R
M
A
D
P
T
I
V
E
E
V
M
N
A
V
S
I
P
V
M
A
K
A
R
I
G
H
I
V
E
A
R
V
L
E
A
M
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
L
N
K
N
E
Y
T
V
P
F
V
C
G
C
R
D
L
G
E
A
T
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
V
R
K
V
V
A
M
S
E
D
E
-
L
----------------------------------
M
-
T
E
A
-
K
N
-
L
G
A
P
Y
E
L
L
L
Q
I
K
K
D
G
K
L
P
V
V
N
--
F
--
A
A
G
G
V
A
T
P
A
D
A
A
L
M
M
Q
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
D
N
P
A
K
F
A
K
A
I
V
E
A
T
T
H
F
T
D
Y
K
L
I
A
E
L
S
K
E
------------------------
31
PsiBlast_CBE
92.10
80%
-102
- C4 -
2NV2
1
PDXS_BACSU
M:
[5-270]
-----
G
T
E
R
V
K
R
G
M
A
E
M
Q
K
G
G
V
I
M
D
V
I
N
A
E
Q
A
K
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
V
P
A
D
I
R
A
A
G
G
V
A
R
M
A
D
P
T
I
V
E
E
V
M
N
A
V
S
I
P
V
M
A
K
A
R
I
G
H
I
V
E
A
R
V
L
E
A
M
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
L
N
K
N
E
Y
T
V
P
F
V
C
G
C
R
D
L
G
E
A
T
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
V
R
K
V
V
A
M
S
E
D
E
-
L
----------------------------------
M
-
T
E
A
-
K
N
-
L
G
A
P
Y
E
L
L
L
Q
I
K
K
D
G
K
L
P
V
V
N
--
F
--
A
A
G
G
V
A
T
P
A
D
A
A
L
M
M
Q
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
D
N
P
A
K
F
A
K
A
I
V
E
A
T
T
H
F
T
D
Y
K
L
I
A
E
L
S
K
E
------------------------
1
PsiBlast_PDB
91.92
80%
-109
- C4 -
2NV1
2
PDXS_BACSU
A:
[9-274]
------
T
E
R
V
K
R
G
M
A
E
M
Q
K
G
G
V
I
M
D
V
I
N
A
E
Q
A
K
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
-------
A
G
G
V
A
R
M
A
D
P
T
I
V
E
E
V
M
N
A
V
S
I
P
V
M
A
K
A
R
I
G
H
I
V
E
A
R
V
L
E
A
M
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
L
N
K
N
E
Y
T
V
P
F
V
C
G
C
R
D
L
G
E
A
T
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
V
R
K
V
V
A
M
S
E
D
E
-
L
----------------------------------
M
-
T
E
A
-
K
N
-
L
G
A
P
Y
E
L
L
L
Q
I
K
K
D
G
K
L
P
V
V
N
--
F
--
A
A
G
G
V
A
T
P
A
D
A
A
L
M
M
Q
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
D
N
P
A
K
F
A
K
A
I
V
E
A
T
T
H
F
T
D
Y
K
L
I
A
E
L
S
K
E
L
-----------------------
46
PsiBlast_CBE
91.15
77%
-115
- C4 -
4WY0
7
PDXS_GEOKA
K:
[25-281]
---------------
E
M
Q
K
G
G
V
I
M
D
V
V
N
A
E
Q
A
K
I
A
E
A
A
G
A
V
A
V
M
A
L
E
R
---------
G
V
A
R
M
A
D
P
T
V
I
E
E
V
M
N
A
V
S
I
P
V
M
A
-
V
R
I
G
H
Y
V
E
A
R
V
L
E
A
L
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
I
D
K
R
Q
F
T
V
P
F
V
C
G
C
R
D
L
G
E
A
A
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
I
R
K
V
V
N
M
S
E
D
E
-
L
----------------------------------
V
-
A
E
A
-
K
Q
-
L
G
A
P
V
E
V
L
R
E
I
K
R
L
G
R
L
P
V
V
N
--
F
--
A
A
G
G
V
T
T
P
A
D
A
A
L
M
M
H
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
E
N
P
E
K
Y
A
R
A
I
V
E
A
T
T
H
Y
E
D
Y
E
L
I
A
H
L
S
K
G
L
-----------------------
52
PsiBlast_CBE
91.12
77%
-114
- C4 -
4WY0
3
PDXS_GEOKA
A:
[25-281]
---------------
E
M
Q
K
G
G
V
I
M
D
V
V
N
A
E
Q
A
K
I
A
E
A
A
G
A
V
A
V
M
A
L
E
R
---------
G
V
A
R
M
A
D
P
T
V
I
E
E
V
M
N
A
V
S
I
P
V
M
A
-
V
R
I
G
H
Y
V
E
A
R
V
L
E
A
L
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
I
D
K
R
Q
F
T
V
P
F
V
C
G
C
R
D
L
G
E
A
A
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
I
R
K
V
V
N
M
S
E
D
E
-
L
----------------------------------
V
-
A
E
A
-
K
Q
-
L
G
A
P
V
E
V
L
R
E
I
K
R
L
G
R
L
P
V
V
N
--
F
--
A
A
G
G
V
T
T
P
A
D
A
A
L
M
M
H
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
E
N
P
E
K
Y
A
R
A
I
V
E
A
T
T
H
Y
E
D
Y
E
L
I
A
H
L
S
K
G
L
-----------------------
23
PsiBlast_CBE
91.08
80%
-113
- C4 -
2NV1
2
PDXS_BACSU
D:
[11-275]
--------
R
V
K
R
G
M
A
E
M
Q
K
G
G
V
I
M
D
V
I
N
A
E
Q
A
K
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
---------
G
V
A
R
M
A
D
P
T
I
V
E
E
V
M
N
A
V
S
I
P
V
M
A
K
A
R
I
G
H
I
V
E
A
R
V
L
E
A
M
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
L
N
K
N
E
Y
T
V
P
F
V
C
G
C
R
D
L
G
E
A
T
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
V
R
K
V
V
A
M
S
E
D
E
-
L
----------------------------------
M
-
T
E
A
-
K
N
-
L
G
A
P
Y
E
L
L
L
Q
I
K
K
D
G
K
L
P
V
V
N
--
F
--
A
A
G
G
V
A
T
P
A
D
A
A
L
M
M
Q
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
D
N
P
A
K
F
A
K
A
I
V
E
A
T
T
H
F
T
D
Y
K
L
I
A
E
L
S
K
E
L
G
----------------------
25
PsiBlast_CBE
90.84
80%
-111
- C4 -
2NV1
2
PDXS_BACSU
B:
[13-273]
----------
K
R
G
M
A
E
M
Q
K
G
G
V
I
M
D
V
I
N
A
E
Q
A
K
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
---------
G
V
A
R
M
A
D
P
T
I
V
E
E
V
M
N
A
V
S
I
P
V
M
A
K
A
R
I
G
H
I
V
E
A
R
V
L
E
A
M
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
L
N
K
N
E
Y
T
V
P
F
V
C
G
C
R
D
L
G
E
A
T
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
V
R
K
V
V
A
M
S
E
D
E
-
L
----------------------------------
M
-
T
E
A
-
K
N
-
L
G
A
P
Y
E
L
L
L
Q
I
K
K
D
G
K
L
P
V
V
N
--
F
--
A
A
G
G
V
A
T
P
A
D
A
A
L
M
M
Q
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
D
N
P
A
K
F
A
K
A
I
V
E
A
T
T
H
F
T
D
Y
K
L
I
A
E
L
S
K
E
------------------------
48
PsiBlast_CBE
90.82
77%
-116
- C4 -
4WY0
1
PDXS_GEOKA
I:
[26-282]
----------------
M
Q
K
G
G
V
I
M
D
V
V
N
A
E
Q
A
K
I
A
E
A
A
G
A
V
A
V
M
A
L
E
R
--------
G
G
V
A
R
M
A
D
P
T
V
I
E
E
V
M
N
A
V
S
I
P
V
M
A
-
V
R
I
G
H
Y
V
E
A
R
V
L
E
A
L
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
I
D
K
R
Q
F
T
V
P
F
V
C
G
C
R
D
L
G
E
A
A
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
I
R
K
V
V
N
M
S
E
D
E
-
L
----------------------------------
V
-
A
E
A
-
K
Q
-
L
G
A
P
V
E
V
L
R
E
I
K
R
L
G
R
L
P
V
V
N
--
F
--
A
A
G
G
V
T
T
P
A
D
A
A
L
M
M
H
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
E
N
P
E
K
Y
A
R
A
I
V
E
A
T
T
H
Y
E
D
Y
E
L
I
A
H
L
S
K
G
L
G
----------------------
24
PsiBlast_CBE
90.78
80%
-114
- C4 -
2NV1
2
PDXS_BACSU
C:
[10-274]
-------
E
R
V
K
R
G
M
A
E
M
Q
K
G
G
V
I
M
D
V
I
N
A
E
Q
A
K
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
---------
G
V
A
R
M
A
D
P
T
I
V
E
E
V
M
N
A
V
S
I
P
V
M
A
K
A
R
I
G
H
I
V
E
A
R
V
L
E
A
M
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
L
N
K
N
E
Y
T
V
P
F
V
C
G
C
R
D
L
G
E
A
T
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
V
R
K
V
V
A
M
S
E
D
E
-
L
----------------------------------
M
-
T
E
A
-
K
N
-
L
G
A
P
Y
E
L
L
L
Q
I
K
K
D
G
K
L
P
V
V
N
--
F
--
A
A
G
G
V
A
T
P
A
D
A
A
L
M
M
Q
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
D
N
P
A
K
F
A
K
A
I
V
E
A
T
T
H
F
T
D
Y
K
L
I
A
E
L
S
K
E
L
-----------------------
45
PsiBlast_CBE
90.44
77%
-118
- C4 -
4WY0
1
PDXS_GEOKA
L:
[26-281]
----------------
M
Q
K
G
G
V
I
M
D
V
V
N
A
E
Q
A
K
I
A
E
A
A
G
A
V
A
V
M
A
L
E
----------
G
V
A
R
M
A
D
P
T
V
I
E
E
V
M
N
A
V
S
I
P
V
M
A
-
V
R
I
G
H
Y
V
E
A
R
V
L
E
A
L
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
I
D
K
R
Q
F
T
V
P
F
V
C
G
C
R
D
L
G
E
A
A
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
I
R
K
V
V
N
M
S
E
D
E
-
L
----------------------------------
V
-
A
E
A
-
K
Q
-
L
G
A
P
V
E
V
L
R
E
I
K
R
L
G
R
L
P
V
V
N
--
F
--
A
A
G
G
V
T
T
P
A
D
A
A
L
M
M
H
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
E
N
P
E
K
Y
A
R
A
I
V
E
A
T
T
H
Y
E
D
Y
E
L
I
A
H
L
S
K
G
L
-----------------------
22
PsiBlast_CBE
90.09
80%
-107
- C4 -
2NV1
2
PDXS_BACSU
E:
[9-273]
------
T
E
R
V
K
R
G
M
A
E
M
Q
K
G
G
V
I
M
D
V
I
N
A
E
Q
A
K
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
---------
G
V
A
R
M
A
D
P
T
I
V
E
E
V
M
N
A
V
S
I
P
V
M
A
K
A
R
I
G
H
I
V
E
A
R
V
L
E
A
M
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
L
N
K
N
E
Y
T
V
P
F
V
C
G
C
R
D
L
G
E
A
T
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
V
R
K
V
V
A
M
S
E
D
E
-
L
----------------------------------
M
-
T
E
A
-
K
N
-
L
G
A
P
Y
E
L
L
L
Q
I
K
K
D
G
K
L
P
V
V
N
--
F
--
A
A
G
G
V
A
T
P
A
D
A
A
L
M
M
Q
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
D
N
P
A
K
F
A
K
A
I
V
E
A
T
T
H
F
T
D
Y
K
L
I
A
E
L
S
K
E
------------------------
44
PsiBlast_CBE
90.06
77%
-113
- C4 -
4WY0
7
PDXS_GEOKA
F:
[26-281]
----------------
M
Q
K
G
G
V
I
M
D
V
V
N
A
E
Q
A
K
I
A
E
A
A
G
A
V
A
V
M
A
L
E
R
V
--------
G
V
A
R
M
A
D
P
T
V
I
E
E
V
M
N
A
V
S
I
P
V
M
A
-
V
R
I
G
H
Y
V
E
A
R
V
L
E
A
L
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
I
D
K
R
Q
F
T
V
P
F
V
C
G
C
R
D
L
G
E
A
A
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
I
R
K
V
V
N
M
S
E
D
E
-
L
----------------------------------
V
-
A
E
A
-
K
Q
-
L
G
A
P
V
E
V
L
R
E
I
K
R
L
G
R
L
P
V
V
N
--
F
--
A
A
G
G
V
T
T
P
A
D
A
A
L
M
M
H
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
E
N
P
E
K
Y
A
R
A
I
V
E
A
T
T
H
Y
E
D
Y
E
L
I
A
H
L
S
K
G
L
-----------------------
138
HHSearch
89.84
78%
-105
- C4 -
2NV1
2
PDXS_BACSU
A:
[9-274]
------
T
E
R
V
K
R
G
M
A
E
M
Q
K
G
G
V
I
M
D
V
I
N
A
E
Q
A
K
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
-------
A
G
G
V
A
R
M
A
D
P
T
I
V
E
E
V
M
N
A
V
S
I
P
V
M
A
K
A
R
I
G
H
I
V
E
A
R
V
L
E
A
M
G
V
D
Y
I
D
E
S
E
V
L
T
P
A
D
E
E
F
H
L
N
-
K
N
E
Y
T
V
P
F
V
C
G
C
R
D
L
G
E
A
T
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
V
R
K
V
V
A
M
S
E
D
E
-
L
----------------------------------
M
-
T
E
A
-
K
N
-
L
G
A
P
Y
E
L
L
L
Q
I
K
K
D
G
K
--
L
P
V
V
N
F
--
A
A
G
G
V
A
T
P
A
D
A
A
L
M
M
Q
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
D
N
P
A
K
F
A
K
A
I
V
E
A
T
T
H
F
T
D
Y
K
L
I
A
E
L
S
K
E
L
-----------------------
49
PsiBlast_CBE
89.76
77%
-108
- C4 -
4WY0
4
PDXS_GEOKA
G:
[16-281]
------
T
D
R
V
K
R
G
M
A
E
M
Q
K
G
G
V
I
M
D
V
V
N
A
E
Q
A
K
I
A
E
A
A
G
A
V
A
V
M
A
L
E
R
---------
G
V
A
R
M
A
D
P
T
V
I
E
E
V
M
N
A
V
S
I
P
V
M
A
-
V
R
I
G
H
Y
V
E
A
R
V
L
E
A
L
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
I
D
K
R
Q
F
T
V
P
F
V
C
G
C
R
D
L
G
E
A
A
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
I
R
K
V
V
N
M
S
E
D
E
-
L
----------------------------------
V
-
A
E
A
-
K
Q
-
L
G
A
P
V
E
V
L
R
E
I
K
R
L
G
R
L
P
V
V
N
--
F
--
A
A
G
G
V
T
T
P
A
D
A
A
L
M
M
H
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
E
N
P
E
K
Y
A
R
A
I
V
E
A
T
T
H
Y
E
D
Y
E
L
I
A
H
L
S
K
G
L
-----------------------
47
PsiBlast_CBE
89.72
77%
-115
- C4 -
4WY0
1
PDXS_GEOKA
J:
[27-281]
-----------------
Q
K
G
G
V
I
M
D
V
V
N
A
E
Q
A
K
I
A
E
A
A
G
A
V
A
V
M
A
L
E
----------
G
V
A
R
M
A
D
P
T
V
I
E
E
V
M
N
A
V
S
I
P
V
M
A
-
V
R
I
G
H
Y
V
E
A
R
V
L
E
A
L
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
I
D
K
R
Q
F
T
V
P
F
V
C
G
C
R
D
L
G
E
A
A
R
R
I
A
E
G
A
S
M
L
R
T
K
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
I
R
K
V
V
N
M
S
E
D
E
-
L
----------------------------------
V
-
A
E
A
-
K
Q
-
L
G
A
P
V
E
V
L
R
E
I
K
R
L
G
R
L
P
V
V
N
--
F
--
A
A
G
G
V
T
T
P
A
D
A
A
L
M
M
H
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
E
N
P
E
K
Y
A
R
A
I
V
E
A
T
T
H
Y
E
D
Y
E
L
I
A
H
L
S
K
G
L
-----------------------
139
HHSearch
89.66
67%
-98
* C4 *
2YZR
4
PDXS_METJA
A:
[5-313]
------
T
D
L
L
K
K
G
F
A
K
M
V
K
H
G
V
V
M
D
V
T
N
V
E
Q
A
Q
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
V
P
A
D
I
R
--
G
G
V
A
R
M
S
D
P
A
L
I
E
E
I
M
D
A
V
S
I
P
V
M
A
K
C
R
I
G
H
T
T
E
A
L
V
L
E
A
I
G
V
D
M
I
D
E
S
E
V
L
T
Q
-
A
D
P
F
F
H
I
Y
K
K
K
F
N
V
P
F
V
C
G
A
R
N
L
G
E
A
V
R
R
I
W
E
G
A
A
M
I
R
T
K
G
E
A
G
T
G
N
I
V
E
A
V
R
H
M
R
L
M
N
E
A
I
A
Q
L
Q
R
M
T
D
E
E
-
V
Y
G
V
A
K
F
Y
A
NRYA
E
L
A
K
T
V
R
E
G
M
GLPATVLENEPI
Y
E
G
F
T
L
A
E
I
I
D
G
L
Y
E
V
L
L
E
V
K
K
L
G
R
L
P
V
V
N
--
F
--
A
A
G
G
V
A
T
P
A
D
A
A
L
M
M
Q
L
G
S
D
G
V
F
V
G
S
G
I
F
K
S
E
N
P
L
E
R
A
R
A
I
V
E
A
T
Y
N
Y
D
K
P
D
I
V
A
E
V
S
K
N
L
G
E
A
M
K
G
-----------------
6
PsiBlast_PDB
89.62
77%
-124
- C4 -
4WXZ
-
PDXS_GEOKA
A:
[28-280]
------------------
K
G
G
V
I
M
D
V
V
N
A
E
Q
A
K
I
A
E
A
A
G
A
V
A
V
M
A
L
E
R
---------
G
V
A
R
M
A
D
P
T
V
I
E
E
V
M
N
A
V
S
I
P
V
M
A
-
V
R
I
G
H
Y
V
E
A
R
V
L
E
A
L
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
E
E
F
H
I
D
K
R
Q
F
T
V
P
F
V
C
G
C
R
D
L
G
E
A
A
R
R
I
A
E
G
A
S
M
L
R
T
-
G
E
P
G
T
G
N
I
V
E
A
V
R
H
M
R
K
V
N
A
Q
I
R
K
V
V
N
M
S
E
D
E
-
L
----------------------------------
V
-
A
E
A
-
K
Q
-
L
G
A
P
V
E
V
L
R
E
I
K
R
L
G
R
L
P
V
V
N
--
F
--
A
A
G
G
V
T
T
P
A
D
A
A
L
M
M
H
L
G
A
D
G
V
F
V
G
S
G
I
F
K
S
E
N
P
E
K
Y
A
R
A
I
V
E
A
T
T
H
Y
E
D
Y
E
L
I
A
H
L
S
K
G
------------------------
53
PsiBlast_CBE
89.37
66%
-101
- C4 -
2ZBT
1
PDXS_THET8
D:
[8-278]
-----
G
T
F
Q
I
K
T
G
F
A
E
M
F
K
G
G
V
I
M
D
V
T
T
P
E
Q
A
V
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
V
P
A
D
I
R
A
Q
G
G
V
A
R
M
S
D
P
K
I
I
K
E
I
M
A
A
V
S
I
P
V
M
A
K
V
R
I
G
H
F
V
E
A
M
I
L
E
A
I
G
V
D
F
I
D
E
S
E
V
L
T
P
-
A
D
E
E
H
H
I
D
K
W
K
F
K
V
P
F
V
C
G
A
R
N
L
G
E
A
L
R
R
I
A
E
G
A
A
M
I
R
T
K
G
E
A
G
T
G
N
V
V
E
A
V
R
H
A
R
T
M
W
K
E
I
R
Y
V
Q
S
L
R
E
D
E
-
L
----------------------------------
M
-
A
Y
A
-
K
E
-
I
G
A
P
F
E
L
V
K
W
V
H
D
H
G
R
L
P
V
V
N
--
F
--
A
A
G
G
I
A
T
P
A
D
A
A
L
M
M
H
L
G
M
D
G
V
F
V
G
S
G
I
F
K
S
G
D
P
R
K
R
A
R
A
I
V
R
A
V
A
H
Y
N
D
P
E
V
L
A
E
V
S
E
D
L
G
E
P
M
-------------------
7
PsiBlast_PDB
89.21
66%
-103
- C4 -
2ZBT
1
PDXS_THET8
A:
[8-278]
-----
G
T
F
Q
I
K
T
G
F
A
E
M
F
K
G
G
V
I
M
D
V
T
T
P
E
Q
A
V
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
V
P
A
D
I
R
A
Q
G
G
V
A
R
M
S
D
P
K
I
I
K
E
I
M
A
A
V
S
I
P
V
M
A
K
V
R
I
G
H
F
V
E
A
M
I
L
E
A
I
G
V
D
F
I
D
E
S
E
V
L
T
P
-
A
D
E
E
H
H
I
D
K
W
K
F
K
V
P
F
V
C
G
A
R
N
L
G
E
A
L
R
R
I
A
E
G
A
A
M
I
R
T
K
G
E
A
G
T
G
N
V
V
E
A
V
R
H
A
R
T
M
W
K
E
I
R
Y
V
Q
S
L
R
E
D
E
-
L
----------------------------------
M
-
A
Y
A
-
K
E
-
I
G
A
P
F
E
L
V
K
W
V
H
D
H
G
R
L
P
V
V
N
--
F
--
A
A
G
G
I
A
T
P
A
D
A
A
L
M
M
H
L
G
M
D
G
V
F
V
G
S
G
I
F
K
S
G
D
P
R
K
R
A
R
A
I
V
R
A
V
A
H
Y
N
D
P
E
V
L
A
E
V
S
E
D
L
G
E
P
M
-------------------
54
PsiBlast_CBE
88.91
66%
-104
- C4 -
2ZBT
1
PDXS_THET8
C:
[9-278]
------
T
F
Q
I
K
T
G
F
A
E
M
F
K
G
G
V
I
M
D
V
T
T
P
E
Q
A
V
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
V
P
A
D
I
R
A
Q
G
G
V
A
R
M
S
D
P
K
I
I
K
E
I
M
A
A
V
S
I
P
V
M
A
K
V
R
I
G
H
F
V
E
A
M
I
L
E
A
I
G
V
D
F
I
D
E
S
E
V
L
T
P
-
A
D
E
E
H
H
I
D
K
W
K
F
K
V
P
F
V
C
G
A
R
N
L
G
E
A
L
R
R
I
A
E
G
A
A
M
I
R
T
K
G
E
A
G
T
G
N
V
V
E
A
V
R
H
A
R
T
M
W
K
E
I
R
Y
V
Q
S
L
R
E
D
E
-
L
----------------------------------
M
-
A
Y
A
-
K
E
-
I
G
A
P
F
E
L
V
K
W
V
H
D
H
G
R
L
P
V
V
N
--
F
--
A
A
G
G
I
A
T
P
A
D
A
A
L
M
M
H
L
G
M
D
G
V
F
V
G
S
G
I
F
K
S
G
D
P
R
K
R
A
R
A
I
V
R
A
V
A
H
Y
N
D
P
E
V
L
A
E
V
S
E
D
L
G
E
P
M
-------------------
55
PsiBlast_CBE
88.87
66%
-102
- C4 -
2ZBT
1
PDXS_THET8
B:
[8-278]
-----
G
T
F
Q
I
K
T
G
F
A
E
M
F
K
G
G
V
I
M
D
V
T
T
P
E
Q
A
V
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
V
P
A
D
I
R
A
Q
G
G
V
A
R
M
S
D
P
K
I
I
K
E
I
M
A
A
V
S
I
P
V
M
A
K
V
R
I
G
H
F
V
E
A
M
I
L
E
A
I
G
V
D
F
I
D
E
S
E
V
L
T
P
-
A
D
E
E
H
H
I
D
K
W
K
F
K
V
P
F
V
C
G
A
R
N
L
G
E
A
L
R
R
I
A
E
G
A
A
M
I
R
T
K
G
E
A
G
T
G
N
V
V
E
A
V
R
H
A
R
T
M
W
K
E
I
R
Y
V
Q
S
L
R
E
D
E
-
L
----------------------------------
M
-
A
Y
A
-
K
E
-
I
G
A
P
F
E
L
V
K
W
V
H
D
H
G
R
L
P
V
V
N
--
F
--
A
A
G
G
I
A
T
P
A
D
A
A
L
M
M
H
L
G
M
D
G
V
F
V
G
S
G
I
F
K
S
G
D
P
R
K
R
A
R
A
I
V
R
A
V
A
H
Y
N
D
P
E
V
L
A
E
V
S
E
D
L
G
E
P
M
-------------------
13
PsiBlast_PDB
87.67
63%
-105
- C4 -
4JDY
1
PDXS_MYCTU
A:
[3-263]
--------
R
V
K
R
G
M
A
E
M
L
K
G
G
V
I
M
D
V
V
T
P
E
Q
A
R
I
A
E
G
A
G
A
V
A
V
M
A
L
E
R
V
P
A
D
I
R
A
Q
G
G
V
S
R
M
S
D
P
D
M
I
E
G
I
I
A
A
V
T
I
P
V
M
A
K
V
R
I
G
H
F
V
E
A
Q
I
L
Q
T
L
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
Y
A
H
H
I
D
K
W
N
F
T
V
P
F
V
C
G
A
T
N
L
G
E
A
L
R
R
I
S
E
G
A
A
M
I
R
S
K
G
E
A
G
T
G
D
V
S
N
A
T
T
H
M
R
A
I
G
G
E
I
R
R
L
T
S
M
S
E
D
E
-
L
----------------------------------
F
-
V
A
A
-
K
E
-
L
Q
A
P
Y
E
L
V
A
E
V
A
R
A
G
K
L
P
V
T
L
--
F
--
T
A
G
G
I
A
T
P
A
D
A
A
M
M
M
Q
L
G
A
E
G
V
F
V
G
S
G
I
F
K
S
G
A
P
E
H
R
A
A
A
I
V
K
A
T
T
F
F
D
D
P
D
V
L
A
K
V
S
--------------------------
65
PsiBlast_CBE
87.23
63%
-105
- C4 -
4JDY
1
PDXS_MYCTU
C:
[3-263]
--------
R
V
K
R
G
M
A
E
M
L
K
G
G
V
I
M
D
V
V
T
P
E
Q
A
R
I
A
E
G
A
G
A
V
A
V
M
A
L
E
R
V
P
A
D
I
R
A
Q
G
G
V
S
R
M
S
D
P
D
M
I
E
G
I
I
A
A
V
T
I
P
V
M
A
K
V
R
I
G
H
F
V
E
A
Q
I
L
Q
T
L
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
Y
A
H
H
I
D
K
W
N
F
T
V
P
F
V
C
G
A
T
N
L
G
E
A
L
R
R
I
S
E
G
A
A
M
I
R
S
K
G
E
A
G
T
G
D
V
S
N
A
T
T
H
M
R
A
I
G
G
E
I
R
R
L
T
S
M
S
E
D
E
-
L
----------------------------------
F
-
V
A
A
-
K
E
-
L
Q
A
P
Y
E
L
V
A
E
V
A
R
A
G
K
L
P
V
T
L
--
F
--
T
A
G
G
I
A
T
P
A
D
A
A
M
M
M
Q
L
G
A
E
G
V
F
V
G
S
G
I
F
K
S
G
A
P
E
H
R
A
A
A
I
V
K
A
T
T
F
F
D
D
P
D
V
L
A
K
V
S
--------------------------
66
PsiBlast_CBE
86.73
63%
-107
- C4 -
4JDY
1
PDXS_MYCTU
B:
[3-263]
--------
R
V
K
R
G
M
A
E
M
L
K
G
G
V
I
M
D
V
V
T
P
E
Q
A
R
I
A
E
G
A
G
A
V
A
V
M
A
L
E
R
V
P
A
D
I
R
A
Q
G
G
V
S
R
M
S
D
P
D
M
I
E
G
I
I
A
A
V
T
I
P
V
M
A
K
V
R
I
G
H
F
V
E
A
Q
I
L
Q
T
L
G
V
D
Y
I
D
E
S
E
V
L
T
P
-
A
D
Y
A
H
H
I
D
K
W
N
F
T
V
P
F
V
C
G
A
T
N
L
G
E
A
L
R
R
I
S
E
G
A
A
M
I
R
S
K
G
E
A
G
T
G
D
V
S
N
A
T
T
H
M
R
A
I
G
G
E
I
R
R
L
T
S
M
S
E
D
E
-
L
----------------------------------
F
-
V
A
A
-
K
E
-
L
Q
A
P
Y
E
L
V
A
E
V
A
R
A
G
K
L
P
V
T
L
--
F
--
T
A
G
G
I
A
T
P
A
D
A
A
M
M
M
Q
L
G
A
E
G
V
F
V
G
S
G
I
F
K
S
G
A
P
E
H
R
A
A
A
I
V
K
A
T
T
F
F
D
D
P
D
V
L
A
K
V
S
--------------------------
140
HHSearch
86.33
66%
-97
- C4 -
2ZBT
1
PDXS_THET8
A:
[8-278]
-----
G
T
F
Q
I
K
T
G
F
A
E
M
F
K
G
G
V
I
M
D
V
T
T
P
E
Q
A
V
I
A
E
E
A
G
A
V
A
V
M
A
L
E
R
V
P
A
D
I
R
A
Q
G
G
V
A
R
M
S
D
P
K
I
I
K
E
I
M
A
A
V
S
I
P
V
M
A
K
V
R
I
G
H
F
V
E
A
M
I
L
E
A
I
G
V
D
F
I
D
E
S
E
V
L
T
P
-
A
D
E
E
H
H
I
D
K
W
K
F
K
V
P
F
V
C
G
A
R
N
L
G
E
A
L
R
R
I
A
E
G
A
A
M
I
R
T
K
G
E
A
G
T
G
N
V
V
E
A
V
R
H
A
R
T
-
M
W
K
E
I
R
Y
V
Q
S
L
R
E
D
E
L
----------------------------------
M
-
A
Y
A
-
K
E
-
I
G
A
P
F
E
L
V
K
W
V
H
D
H
G
R
L
P
V
----
V
N
F
A
A
G
G
I
A
T
P
A
D
A
A
L
M
M
H
L
G
M
D
G
V
F
V
G
S
G
I
F
K
S
G
D
P
R
K
R
A
R
A
I
V
R
A
V
A
H
Y
N
D
P
E
V
L
A
E
V
S
E
D
L
G
E
P
M
-------------------
18
PsiBlast_PDB
84.19
55%
-106
- C4 -
4ADU
2
PDX1_PLABE
A:
[12-280]
---------
L
K
H
G
W
C
E
M
L
K
G
G
V
I
M
D
V
K
N
V
E
Q
A
K
I
A
E
K
A
G
A
I
G
V
M
I
L
E
N
I
P
S
E
L
R
N
T
D
G
V
A
R
S
V
D
P
L
K
I
E
E
I
R
K
C
I
S
I
N
V
L
A
K
V
R
I
G
H
F
V
E
A
Q
I
L
E
E
L
K
V
D
M
L
D
E
S
E
V
L
T
M
-
A
D
E
Y
N
H
I
N
K
H
K
F
K
T
P
F
V
C
G
C
T
N
L
G
E
A
L
R
R
I
S
E
G
A
S
M
I
R
T
K
G
E
A
G
T
G
N
I
I
E
A
I
K
H
I
R
T
V
N
N
E
I
K
Y
L
C
S
L
D
E
S
E
-
V
----------------------------------
Y
-
N
F
A
-
K
K
-
L
R
A
P
I
D
L
I
L
L
T
R
K
L
K
R
L
P
V
V
N
--
F
--
A
A
G
G
I
A
T
P
A
D
A
A
M
C
M
Q
L
G
M
D
G
V
F
V
G
S
G
I
F
E
S
E
N
P
Q
K
M
A
S
S
I
V
M
A
V
S
N
F
N
N
P
K
I
L
L
N
V
S
L
G
L
G
K
A
M
H
G
-----------------
71
PsiBlast_CBE
83.86
55%
-104
- C4 -
4ADU
3
PDX1_PLABE
B:
[12-280]
---------
L
K
H
G
W
C
E
M
L
K
G
G
V
I
M
D
V
K
N
V
E
Q
A
K
I
A
E
K
A
G
A
I
G
V
M
I
L
E
N
I
P
S
E
L
R
N
T
D
G
V
A
R
S
V
D
P
L
K
I
E
E
I
R
K
C
I
S
I
N
V
L
A
K
V
R
I
G
H
F
V
E
A
Q
I
L
E
E
L
K
V
D
M
L
D
E
S
E
V
L
T
M
-
A
D
E
Y
N
H
I
N
K
H
K
F
K
T
P
F
V
C
G
C
T
N
L
G
E
A
L
R
R
I
S
E
G
A
S
M
I
R
T
K
G
E
A
G
T
G
N
I
I
E
A
I
K
H
I
R
T
V
N
N
E
I
K
Y
L
C
S
L
D
E
S
E
-
V
----------------------------------
Y
-
N
F
A
-
K
K
-
L
R
A
P
I
D
L
I
L
L
T
R
K
L
K
R
L
P
V
V
N
--
F
--
A
A
G
G
I
A
T
P
A
D
A
A
M
C
M
Q
L
G
M
D
G
V
F
V
G
S
G
I
F
E
S
E
N
P
Q
K
M
A
S
S
I
V
M
A
V
S
N
F
N
N
P
K
I
L
L
N
V
S
L
G
L
G
K
A
M
H
G
-----------------