@TOME V2.3
(Mar 2018)
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 : Q3Y1L6: (2018-01-26 )
MKVKKAVIPAAGLGTRFLPATKAMAKEMLPIVDKPTIQFIVEEALDSGIEDILIVTGKEKRPIEDHFDANIELENNLREKEKTELLALVEETTQVNLHFIRQSHPRGLGDAVLQAKAFIGNEPFVVMLGDDLMKDDIPLTQQLMMDYEETQASAVAVMRVPENETSKYGIIDPKTDSEKGRCRVKGFVEKPEMGKAPSNLAIIGRYLLTPKIFEILETQEPGAGNEIQLTDALQTLNQTEAVYAREFKGKRYDVGDKLGYMKTNIEYGLQHSEIGTSLSAYIIQLSKKLRTES
Atome Classification :
(26 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)
(QMean)
(Ligand)
(Uniprot)
MKVKKAVIPAAGLGTRFL
P
A
T
K
A
M
A
K
E
MLPIVDK
P
T
I
Q
F
I
V
E
E
A
L
DSGI
E
D
I
L
I
V
TGKEKRP
I
E
DHFDA
N
I
E
LENNLR---
E
K
E
-
K
T
E
L
L
A
L
V
--
E
--ET
T
Q
-
V
N
L
H
F
I
RQSHPR
G
L
G
D
A
V
L
Q
A
K
A
FIG--NE
P
F
V
V
M
LGDDLM--KD-DI-
P
L
T
Q
Q
L
M
M
D
Y
E
E
TQA----
S
A
V
A
V
M
RVPENETSKYGIIDPKTDS-EKG
R
C
---
R
V
KGFVEKPEMGKAPSN
L
A
I
I
G
R
Y
LL
T
P
K
I
F
E
I
L
ETQEPGAGN
E
I
Q
L
T
D
A
L
Q
TL-
N
Q
T
E
-
A
V
Y
A
R
E
FKGKRYDVGDKLG
Y
M
K
T
N
I
EYGLQ
H
S
EIG
T
S
L
S
A
Y
I
I
-
Q
L
S
K
K
LRTES
3
PsiBlast_PDB
83.30
47%
4
- C1 -
-
5J49
1
?
A:
[10-292]
L
K
V
T
K
A
V
F
P
V
A
G
L
G
T
R
F
L
P
A
T
K
A
S
P
K
E
M
L
P
I
V
D
K
P
L
I
Q
Y
A
V
E
E
A
M
A
A
G
I
T
E
M
I
F
V
T
G
R
S
K
R
A
I
E
D
H
F
D
K
S
Y
E
I
E
A
E
L
Q
---
A
R
G
-
K
D
K
L
L
E
L
V
--
R
S
I
K
P
S
H
-
V
D
C
F
Y
V
R
Q
P
E
A
L
G
L
G
H
A
V
L
C
A
E
K
L
V
G
--
D
N
P
F
A
V
I
L
A
D
D
L
L
--
Y
G
-
T
P
-
P
V
M
A
Q
M
I
E
V
F
D
H
Y
H
S
----
S
V
I
G
V
E
E
I
P
A
Q
E
T
K
S
Y
G
I
V
D
G
K
-
E
W
-
E
D
S
I
I
---
K
M
S
G
I
V
E
K
P
E
P
N
V
A
P
S
N
L
G
V
V
G
R
Y
V
L
K
P
R
I
F
E
H
L
R
A
L
K
P
G
A
G
G
E
L
Q
L
T
D
A
I
Q
S
L
-
L
A
D
E
-
Q
V
L
A
Y
K
Y
H
G
T
R
F
D
C
G
S
K
L
G
Y
L
K
A
T
V
E
F
A
L
R
H
P
E
V
A
A
D
F
E
E
Y
L
------------
25
PsiBlast_CBE
82.40
43%
-100
- C1 -
-
2UX8
1
?
E:
[14-294]
--
L
R
K
A
V
F
P
V
A
G
L
G
T
R
F
L
P
A
T
K
A
M
P
K
E
M
L
P
V
V
D
R
P
L
I
Q
Y
A
V
D
E
A
V
E
A
G
I
E
Q
M
I
F
V
T
G
R
G
K
S
A
L
E
D
H
F
D
I
A
Y
E
L
E
A
T
M
A
---
A
R
G
-
K
S
L
D
V
L
D
G
--
T
--
R
L
K
P
-
G
N
I
A
Y
V
R
Q
Q
E
P
M
G
L
G
H
A
V
W
C
A
R
D
I
V
G
--
D
E
P
F
A
V
L
L
P
D
D
F
M
--
F
G
-
Q
P
-
G
C
L
K
Q
M
V
D
A
Y
N
K
V
G
G
----
N
L
I
C
A
E
E
V
P
D
D
Q
T
H
R
Y
G
I
I
T
P
G
T
-
Q
-
D
G
V
L
T
---
E
V
K
G
L
V
E
K
P
A
P
G
T
A
P
S
N
L
S
V
I
G
R
Y
I
L
Q
P
E
V
M
R
I
L
E
N
Q
--------
Q
L
T
D
A
M
Q
R
M
-
I
G
D
Q
-
P
F
H
G
V
T
F
Q
G
T
R
Y
D
C
G
D
K
A
G
F
I
Q
A
N
L
A
V
A
L
S
R
P
D
L
E
P
A
V
R
A
F
A
V
-
K
---------
2
PsiBlast_PDB
82.29
47%
9
- C1 -
-
5VE7
1
?
A:
[10-292]
L
K
V
N
K
A
V
F
P
V
A
G
L
G
T
R
F
L
P
A
T
K
A
S
P
K
E
M
L
P
V
V
D
K
P
L
I
Q
Y
A
V
E
E
A
I
A
A
G
I
T
E
M
I
F
V
T
G
R
S
K
R
A
I
E
D
H
F
D
K
S
Y
E
V
E
A
E
L
E
---
A
R
G
-
K
A
K
L
L
E
L
V
--
R
S
I
K
P
S
H
-
V
D
C
F
Y
V
R
Q
P
E
A
L
G
L
G
H
A
V
L
C
A
E
K
L
V
A
--
D
N
P
F
A
V
I
L
A
D
D
L
L
--
D
G
-
N
P
-
P
V
M
K
Q
M
V
D
V
F
D
H
Y
H
S
----
S
V
I
G
V
E
E
I
P
P
S
E
T
K
S
Y
G
I
V
D
G
K
-
E
W
-
E
E
S
I
V
---
K
M
S
A
I
V
E
K
P
A
P
E
V
A
P
S
N
L
G
V
V
G
R
Y
I
L
K
P
R
I
F
E
H
L
R
A
L
K
P
----
E
L
Q
L
T
D
A
I
Q
A
L
-
L
A
D
E
-
Q
V
L
A
Y
K
Y
Q
G
T
R
Y
D
C
G
S
K
L
G
Y
L
K
A
T
V
E
F
A
L
R
H
P
E
V
G
T
E
F
D
A
Y
L
------------
23
PsiBlast_CBE
81.69
43%
-96
- C1 -
-
2UX8
1
?
G:
[14-294]
--
L
R
K
A
V
F
P
V
A
G
L
G
T
R
F
L
P
A
T
K
A
M
P
K
E
M
L
P
V
V
D
R
P
L
I
Q
Y
A
V
D
E
A
V
E
A
G
I
E
Q
M
I
F
V
T
G
R
G
K
S
A
L
E
D
H
F
D
I
A
Y
E
L
E
A
T
M
A
---
A
R
G
-
K
S
L
D
V
L
D
G
--
T
--
R
L
K
P
-
G
N
I
A
Y
V
R
Q
Q
E
P
M
G
L
G
H
A
V
W
C
A
R
D
I
V
G
--
D
E
P
F
A
V
L
L
P
D
D
F
M
--
F
G
-
Q
P
-
G
C
L
K
Q
M
V
D
A
Y
N
K
V
G
G
----
N
L
I
C
A
E
E
V
P
D
D
Q
T
H
R
Y
G
I
I
T
P
G
T
-
Q
-
D
G
V
L
T
---
E
V
K
G
L
V
E
K
P
A
P
G
T
A
P
S
N
L
S
V
I
G
R
Y
I
L
Q
P
E
V
M
R
I
L
E
N
Q
G
K
G
A
G
G
E
I
Q
L
T
D
A
M
Q
R
M
-
I
G
D
Q
-
P
F
H
G
V
T
F
Q
G
T
R
Y
D
C
G
D
K
A
G
F
I
Q
A
N
L
A
V
A
L
S
R
P
D
L
E
P
A
V
R
A
F
A
V
-
K
---------
27
PsiBlast_CBE
80.85
43%
-97
- C1 -
-
2UX8
1
?
C:
[14-294]
--
L
R
K
A
V
F
P
V
A
G
L
G
T
R
F
L
P
A
T
K
A
M
P
K
E
M
L
P
V
V
D
R
P
L
I
Q
Y
A
V
D
E
A
V
E
A
G
I
E
Q
M
I
F
V
T
G
R
G
K
S
A
L
E
D
H
F
D
I
A
Y
E
L
E
A
T
M
A
---
A
R
G
-
K
S
L
D
V
L
D
G
--
T
--
R
L
K
P
-
G
N
I
A
Y
V
R
Q
Q
E
P
M
G
L
G
H
A
V
W
C
A
R
D
I
V
G
--
D
E
P
F
A
V
L
L
P
D
D
F
M
--
F
G
-
Q
P
-
G
C
L
K
Q
M
V
D
A
Y
N
K
V
G
G
----
N
L
I
C
A
E
E
V
P
D
D
Q
T
H
R
Y
G
I
I
T
P
G
T
-
Q
-
D
G
V
L
T
---
E
V
K
G
L
V
E
K
P
A
P
G
T
A
P
S
N
L
S
V
I
G
R
Y
I
L
Q
P
E
V
M
R
I
L
E
N
Q
G
-------
Q
L
T
D
A
M
Q
R
M
-
I
G
D
Q
-
P
F
H
G
V
T
F
Q
G
T
R
Y
D
C
G
D
K
A
G
F
I
Q
A
N
L
A
V
A
L
S
R
P
D
L
E
P
A
V
R
A
F
A
V
-
K
---------
1
PsiBlast_PDB
80.84
47%
10
- C1 -
-
5VCT
1
?
A:
[10-292]
L
K
V
N
K
A
V
F
P
V
A
G
L
G
T
R
F
L
P
A
T
K
A
S
P
K
E
M
L
P
V
V
D
K
P
L
I
Q
Y
A
V
E
E
A
I
A
A
G
I
T
E
M
I
F
V
T
G
R
S
K
R
A
I
E
D
H
F
D
K
S
Y
E
V
E
A
E
L
E
---
A
R
G
-
K
A
K
L
L
E
L
V
--
R
S
I
K
P
S
H
-
V
D
C
F
Y
V
R
Q
P
E
A
L
G
L
G
H
A
V
L
C
A
E
K
L
V
A
--
D
N
P
F
A
V
I
L
A
D
D
L
L
--
D
G
-
N
P
-
P
V
M
K
Q
M
V
D
V
F
D
H
Y
H
S
----
S
V
I
G
V
E
E
I
P
P
S
E
T
K
S
Y
G
I
V
D
G
K
-
E
W
-
E
E
S
I
V
---
K
M
S
A
I
V
E
K
P
A
P
E
V
A
P
S
N
L
G
V
V
G
R
Y
I
L
K
P
R
I
F
E
H
L
R
A
L
K
P
----
E
L
Q
L
T
D
A
I
Q
A
L
-
L
A
D
E
-
Q
V
L
A
Y
K
Y
Q
G
T
R
Y
D
C
G
S
K
L
G
Y
L
K
A
T
V
E
F
A
L
R
H
P
E
V
G
T
E
F
D
A
Y
L
------------
5
PsiBlast_PDB
80.18
47%
-13
- C1 -
-
3JUJ
-
?
A:
[2-268]
--
I
K
K
C
L
F
P
A
A
G
Y
G
T
R
F
L
P
I
T
K
T
I
P
K
E
M
L
P
I
V
D
K
P
L
I
Q
Y
A
V
E
E
A
M
E
A
G
C
E
V
M
A
I
V
T
G
R
N
K
R
S
L
E
D
Y
F
D
T
S
Y
E
I
E
H
Q
I
Q
---
G
T
N
-
K
E
N
A
L
K
S
I
--
R
--
N
I
I
E
K
C
C
F
S
Y
V
R
Q
K
Q
M
K
G
L
G
H
A
I
L
T
G
E
A
L
I
G
--
N
E
P
F
A
V
I
L
A
D
D
L
C
I
S
H
D
-
H
P
-
S
V
L
K
Q
M
T
S
L
Y
Q
K
Y
Q
C
----
S
I
V
A
I
E
E
V
A
L
E
E
V
S
K
Y
G
V
I
R
G
E
W
-
L
-
E
E
G
V
Y
---
E
I
K
D
M
V
E
K
P
N
Q
E
D
A
P
S
N
L
A
V
I
G
R
Y
I
L
T
P
D
I
F
E
I
L
S
E
T
K
P
G
K
N
N
E
I
Q
I
T
D
A
L
R
T
Q
-
A
K
R
K
-
R
I
I
A
Y
Q
F
K
G
K
R
Y
D
C
G
S
V
E
G
Y
I
E
A
S
N
A
Y
---------------------------
26
PsiBlast_CBE
79.72
43%
-101
- C1 -
-
2UX8
1
?
D:
[14-294]
--
L
R
K
A
V
F
P
V
A
G
L
G
T
R
F
L
P
A
T
K
A
M
P
K
E
M
L
P
V
V
D
R
P
L
I
Q
Y
A
V
D
E
A
V
E
A
G
I
E
Q
M
I
F
V
T
G
R
G
K
S
A
L
E
D
H
F
D
I
A
Y
E
L
E
A
T
M
A
---
A
R
G
-
K
S
L
D
V
L
D
G
--
T
--
R
L
K
P
-
G
N
I
A
Y
V
R
Q
Q
E
P
M
G
L
G
H
A
V
W
C
A
R
D
I
V
G
--
D
E
P
F
A
V
L
L
P
D
D
F
M
--
F
G
-
Q
P
-
G
C
L
K
Q
M
V
D
A
Y
N
K
V
G
G
----
N
L
I
C
A
E
E
V
P
D
D
Q
T
H
R
Y
G
I
I
T
P
G
T
-
Q
-
D
G
V
L
T
---
E
V
K
G
L
V
E
K
P
A
P
G
T
A
P
S
N
L
S
V
I
G
R
Y
I
L
Q
P
E
V
M
R
I
L
E
N
Q
G
-------
Q
L
T
D
A
M
Q
R
M
-
I
G
D
Q
-
P
F
H
G
V
T
F
Q
G
T
R
Y
D
C
G
D
K
A
G
F
I
Q
A
N
L
A
V
A
L
S
R
P
D
L
E
P
A
V
R
A
F
A
V
-
K
---------
28
PsiBlast_CBE
79.19
43%
-98
- C1 -
-
2UX8
1
?
B:
[14-294]
--
L
R
K
A
V
F
P
V
A
G
L
G
T
R
F
L
P
A
T
K
A
M
P
K
E
M
L
P
V
V
D
R
P
L
I
Q
Y
A
V
D
E
A
V
E
A
G
I
E
Q
M
I
F
V
T
G
R
G
K
S
A
L
E
D
H
F
D
I
A
Y
E
L
E
A
T
M
A
---
A
R
G
-
K
S
L
D
V
L
D
G
--
T
--
R
L
K
P
-
G
N
I
A
Y
V
R
Q
Q
E
P
M
G
L
G
H
A
V
W
C
A
R
D
I
V
G
--
D
E
P
F
A
V
L
L
P
D
D
F
M
--
F
G
-
Q
P
-
G
C
L
K
Q
M
V
D
A
Y
N
K
V
G
G
----
N
L
I
C
A
E
E
V
P
D
D
Q
T
H
R
Y
G
I
I
T
P
G
T
-
Q
-
D
G
V
L
T
---
E
V
K
G
L
V
E
K
P
A
P
G
T
A
P
S
N
L
S
V
I
G
R
Y
I
L
Q
P
E
V
M
R
I
L
E
N
Q
G
--------
L
T
D
A
M
Q
R
M
-
I
G
D
Q
-
P
F
H
G
V
T
F
Q
G
T
R
Y
D
C
G
D
K
A
G
F
I
Q
A
N
L
A
V
A
L
S
R
P
D
L
E
P
A
V
R
A
F
A
V
-
K
---------
24
PsiBlast_CBE
78.37
43%
-99
- C1 -
-
2UX8
1
?
F:
[14-294]
--
L
R
K
A
V
F
P
V
A
G
L
G
T
R
F
L
P
A
T
K
A
M
P
K
E
M
L
P
V
V
D
R
P
L
I
Q
Y
A
V
D
E
A
V
E
A
G
I
E
Q
M
I
F
V
T
G
R
G
K
S
A
L
E
D
H
F
D
I
A
Y
E
L
E
A
T
M
A
---
A
R
G
-
K
S
L
D
V
L
D
G
--
T
--
R
L
K
P
-
G
N
I
A
Y
V
R
Q
Q
E
P
M
G
L
G
H
A
V
W
C
A
R
D
I
V
G
--
D
E
P
F
A
V
L
L
P
D
D
F
M
--
F
G
-
Q
P
-
G
C
L
K
Q
M
V
D
A
Y
N
K
V
G
G
----
N
L
I
C
A
E
E
V
P
D
D
Q
T
H
R
Y
G
I
I
T
P
G
T
-
Q
-
D
G
V
L
T
---
E
V
K
G
L
V
E
K
P
A
P
G
T
A
P
S
N
L
S
V
I
G
R
Y
I
L
Q
P
E
V
M
R
I
L
E
N
Q
G
K
------
Q
L
T
D
A
M
Q
R
M
-
I
G
D
Q
-
P
F
H
G
V
T
F
Q
G
T
R
Y
D
C
G
D
K
A
G
F
I
Q
A
N
L
A
V
A
L
S
R
P
D
L
E
P
A
V
R
A
F
A
V
-
K
---------
21
PsiBlast_CBE
78.34
47%
8
- C1 -
-
5J49
1
?
B:
[10-292]
L
K
V
T
K
A
V
F
P
V
A
G
L
G
T
R
F
L
P
A
T
K
A
S
P
K
E
M
L
P
I
V
D
K
P
L
I
Q
Y
A
V
E
E
A
M
A
A
G
I
T
E
M
I
F
V
T
G
R
S
K
R
A
I
E
D
H
F
D
K
S
Y
E
I
E
A
E
L
Q
---
A
R
G
-
K
D
K
L
L
E
L
V
--
R
SI
K
P
S
H
-
V
D
C
F
Y
V
R
Q
P
E
A
L
G
L
G
H
A
V
L
C
A
E
K
L
V
G
--
D
N
P
F
A
V
I
L
A
D
D
L
L
--
Y
G
-
T
P
-
P
V
M
A
Q
M
I
E
V
F
D
H
Y
H
S
----
S
V
I
G
V
E
E
I
P
A
Q
E
T
K
S
Y
G
I
V
D
G
K
-
E
W
-
E
D
S
I
I
---
K
M
S
G
I
V
E
K
P
E
P
N
V
A
P
S
N
L
G
V
V
G
R
Y
V
L
K
P
R
I
F
E
H
L
R
A
L
K
P
G
A
G
G
E
L
Q
L
T
D
A
I
Q
S
L
-
L
A
D
E
-
Q
V
L
A
Y
K
Y
H
G
T
R
F
D
C
G
S
K
L
G
Y
L
K
A
T
V
E
F
A
L
R
H
P
E
V
A
A
D
F
E
E
Y
L
------------
30
PsiBlast_CBE
78.14
47%
-20
- C1 -
-
3JUK
1
?
C:
[2-268]
--
I
K
K
C
L
F
P
A
A
G
Y
G
T
R
F
L
P
I
T
K
T
I
P
K
E
M
L
P
I
V
D
K
P
L
I
Q
Y
A
V
E
E
A
M
E
A
G
C
E
V
M
A
I
V
T
G
R
N
K
R
S
L
E
D
Y
F
D
T
S
Y
------------
N
-
K
E
N
A
L
K
S
I
--
R
--
N
I
I
E
K
C
C
F
S
Y
V
R
Q
K
Q
M
K
G
L
G
H
A
I
L
T
G
E
A
L
I
G
--
N
E
P
F
A
V
I
L
A
D
D
L
C
IS
H
D
-
H
P
-
S
V
L
K
Q
M
T
S
L
Y
Q
K
Y
Q
C
----
S
I
V
A
I
E
E
V
A
L
E
E
V
S
K
Y
G
V
I
R
G
E
W
-
L
-
E
E
G
V
Y
---
E
I
K
D
M
V
E
K
P
N
Q
E
D
A
P
S
N
L
A
V
I
G
R
Y
I
L
T
P
D
I
F
E
I
L
S
E
T
K
P
G
K
N
N
E
I
Q
I
T
D
A
L
R
T
Q
-
A
K
R
K
-
R
I
I
A
Y
Q
F
K
G
K
R
Y
D
C
G
S
V
E
G
Y
I
E
A
S
N
A
Y
---------------------------
4
PsiBlast_PDB
76.88
45%
12
- C1 -
-
5I1F
1
?
A:
[10-297]
L
K
V
T
K
A
V
F
P
V
A
G
L
G
T
R
F
L
P
A
T
K
A
S
P
K
E
M
L
P
V
V
D
K
P
L
I
Q
Y
A
V
E
E
A
I
E
A
G
I
T
E
M
I
F
V
T
G
R
S
K
R
A
I
E
D
H
F
D
K
S
Y
E
I
E
A
E
L
E
---
A
R
G
-
K
E
K
L
L
S
L
V
--
R
S
I
K
P
S
H
-
V
D
C
F
Y
V
R
Q
A
E
A
L
G
L
G
H
A
V
L
C
A
E
K
L
V
G
--
D
N
P
F
A
V
I
L
A
D
D
L
L
--
D
G
-
P
T
-
P
V
L
R
Q
M
I
D
V
F
D
H
Y
H
A
----
S
V
I
G
V
E
E
I
A
P
A
D
S
K
S
Y
G
V
I
D
G
K
R
-
W
-
E
D
D
L
F
---
K
L
S
G
I
V
E
K
P
E
P
A
Q
A
P
S
N
F
G
V
V
G
R
Y
V
L
K
P
K
I
F
K
H
L
R
G
L
K
P
G
A
G
G
E
L
Q
L
T
D
A
I
Q
S
L
-
L
T
D
E
-
Q
V
L
A
Y
R
Y
D
G
T
R
F
D
C
G
S
K
L
G
Y
L
K
A
T
V
E
F
A
L
R
H
P
E
V
A
A
D
F
E
R
Y
L
L
A
R
M
S
-------
6
PsiBlast_PDB
76.41
47%
-18
- C1 -
-
3JUK
1
?
A:
[2-268]
--
I
K
K
C
L
F
P
A
A
G
Y
G
T
R
F
L
P
I
T
K
T
I
P
K
E
M
L
P
I
V
D
K
P
L
I
Q
Y
A
V
E
E
A
M
E
A
G
C
E
V
M
A
I
V
T
G
R
N
K
R
S
L
E
D
Y
F
D
T
S
Y
-----------
T
N
-
K
E
N
A
L
K
S
I
--
R
--
N
I
I
E
K
C
C
F
S
Y
V
R
Q
K
Q
M
K
G
L
G
H
A
I
L
T
G
E
A
L
I
G
--
N
E
P
F
A
V
I
L
A
D
D
L
C
I
S
H
D
-
H
P
-
S
V
L
K
Q
M
T
S
L
Y
Q
K
Y
Q
C
----
S
I
V
A
I
E
E
V
A
L
E
E
V
S
K
Y
G
V
I
R
G
E
W
-
L
-
E
E
G
V
Y
---
E
I
K
D
M
V
E
K
P
N
Q
E
D
A
P
S
N
L
A
V
I
G
R
Y
I
L
T
P
D
I
F
E
I
L
S
E
T
K
P
G
K
N
N
E
I
Q
I
T
D
A
L
R
T
Q
-
A
K
R
K
-
R
I
I
A
Y
Q
F
K
G
K
R
Y
D
C
G
S
V
E
G
Y
I
E
A
S
N
A
Y
---------------------------
46
HHSearch
76.08
47%
13
- C1 -
-
3JUJ
-
?
A:
[1-271]
-
M
I
K
K
C
L
F
P
A
A
G
Y
G
T
R
F
L
P
I
T
K
T
I
P
K
E
M
L
P
I
V
D
K
P
L
I
Q
Y
A
V
E
E
A
M
E
A
G
C
E
V
M
A
I
V
T
G
R
N
K
R
S
L
E
D
Y
F
D
T
S
Y
E
I
E
H
Q
I
Q
GTN
K
E
N
-
A
L
K
S
I
R
N
I
------
I
E
K
-
C
C
F
S
Y
V
R
Q
K
Q
M
K
G
L
G
H
A
I
L
T
G
E
A
L
I
G
--
N
E
P
F
A
V
I
L
A
D
D
L
C
--
I
S
H
D
H
P
S
V
L
K
Q
M
T
S
L
Y
Q
K
Y
Q
C
----
S
I
V
A
I
E
E
V
A
L
E
E
V
S
K
Y
G
V
I
R
G
E
W
L
--
E
E
G
V
Y
---
E
I
K
D
M
V
E
K
P
N
Q
E
D
A
P
S
N
L
A
V
I
G
R
Y
I
L
T
P
D
I
F
E
I
L
S
E
T
K
P
G
K
N
N
E
I
Q
I
T
D
A
L
R
T
Q
-
A
K
R
K
-
R
I
I
A
Y
Q
F
K
G
K
R
Y
D
C
G
S
V
E
G
Y
I
E
A
S
N
A
Y
Y
K
K
------------------------
29
PsiBlast_CBE
75.92
47%
-14
- C1 -
-
3JUK
1
?
D:
[2-268]
--
I
K
K
C
L
F
P
A
A
G
Y
G
T
R
F
L
P
I
T
K
T
I
P
K
E
M
L
P
I
V
D
K
P
L
I
Q
Y
A
V
E
E
A
M
E
A
G
C
E
V
M
A
I
V
T
G
R
N
K
R
S
L
E
D
Y
F
D
T
S
Y
-----------
T
N
-
K
E
N
A
L
K
S
I
--
R
--
N
I
I
E
K
C
C
F
S
Y
V
R
Q
K
Q
M
K
G
L
G
H
A
I
L
T
G
E
A
L
I
G
--
N
E
P
F
A
V
I
L
A
D
D
L
C
IS
H
D
-
H
P
-
S
V
L
K
Q
M
T
S
L
Y
Q
K
Y
Q
C
----
S
I
V
A
I
E
E
V
A
L
E
E
V
S
K
Y
G
V
I
R
G
E
W
-
L
-
E
E
G
V
Y
---
E
I
K
D
M
V
E
K
P
N
Q
E
D
A
P
S
N
L
A
V
I
G
R
Y
I
L
T
P
D
I
F
E
I
L
S
E
T
K
P
G
K
N
N
E
I
Q
I
T
D
A
L
R
T
Q
-
A
K
R
K
-
R
I
I
A
Y
Q
F
K
G
K
R
Y
D
C
G
S
V
E
G
Y
I
E
A
S
N
A
Y
---------------------------
35
HHSearch
75.88
45%
-21
- C1 -
-
2UX8
1
?
G:
[13-292]
-
P
L
R
K
A
V
F
P
V
A
G
L
G
T
R
F
L
P
A
T
K
A
M
P
K
E
M
L
P
V
V
D
R
P
L
I
Q
Y
A
V
D
E
A
V
E
A
G
I
E
Q
M
I
F
V
T
G
R
G
K
S
A
L
E
D
H
F
D
I
A
Y
E
L
E
A
T
M
A
---
A
R
G
K
S
L
D
V
L
D
G
---
T
--
R
L
K
P
-
G
N
I
A
Y
V
R
Q
Q
E
P
M
G
L
G
H
A
V
W
C
A
R
D
I
V
G
--
D
E
P
F
A
V
L
L
P
D
D
F
M
--
F
G
-
Q
P
-
G
C
L
K
Q
M
V
D
A
Y
N
K
V
G
G
----
N
L
I
C
A
E
E
V
P
D
D
Q
T
H
R
Y
G
I
I
T
P
G
T
Q
-----
D
G
VLT
E
V
K
G
L
V
E
K
P
A
P
G
T
A
P
S
N
L
S
V
I
G
R
Y
I
L
Q
P
E
V
M
R
I
L
E
N
Q
G
K
G
A
G
G
E
I
Q
L
T
D
A
M
Q
R
M
-
I
G
D
Q
-
P
F
H
G
V
T
F
Q
G
T
R
Y
D
C
G
D
K
A
G
F
I
Q
A
N
L
A
V
A
L
S
R
P
D
L
E
P
A
V
R
A
F
A
------------
37
HHSearch
75.86
48%
8
- C1 -
-
5J49
1
?
B:
[11-294]
-
K
V
T
K
A
V
F
P
V
A
G
L
G
T
R
F
L
P
A
T
K
A
S
P
K
E
M
L
P
I
V
D
K
P
L
I
Q
Y
A
V
E
E
A
M
A
A
G
I
T
E
M
I
F
V
T
G
R
S
K
R
A
I
E
D
H
F
D
K
S
Y
E
I
E
A
E
L
Q
---
A
R
G
-
K
D
K
L
L
E
L
V
RS
I
--
K
P
S
H
-
V
D
C
F
Y
V
R
Q
P
E
A
L
G
L
G
H
A
V
L
C
A
E
K
L
V
G
--
D
N
P
F
A
V
I
L
A
D
D
L
L
--
Y
G
-
T
P
-
P
V
M
A
Q
M
I
E
V
F
D
H
Y
H
S
----
S
V
I
G
V
E
E
I
P
A
Q
E
T
K
S
Y
G
I
V
D
G
K
E
W
--
E
D
S
I
I
---
K
M
S
G
I
V
E
K
P
E
P
N
V
A
P
S
N
L
G
V
V
G
R
Y
V
L
K
P
R
I
F
E
H
L
R
A
L
K
P
G
A
G
G
E
L
Q
L
T
D
A
I
Q
S
L
-
L
A
D
E
-
Q
V
L
A
Y
K
Y
H
G
T
R
F
D
C
G
S
K
L
G
Y
L
K
A
T
V
E
F
A
L
R
H
P
----
E
V
A
A
D
F
E
-
E
Y
L
R
T
-----
31
PsiBlast_CBE
74.68
47%
-16
- C1 -
-
3JUK
1
?
B:
[2-268]
--
I
K
K
C
L
F
P
A
A
G
Y
G
T
R
F
L
P
I
T
K
T
I
P
K
E
M
L
P
I
V
D
K
P
L
I
Q
Y
A
V
E
E
A
M
E
A
G
C
E
V
M
A
I
V
T
G
R
N
K
R
S
L
E
D
Y
F
D
T
S
Y
------------
N
-
K
E
N
A
L
K
S
I
--
R
--
N
I
I
E
K
C
C
F
S
Y
V
R
Q
K
Q
M
K
G
L
G
H
A
I
L
T
G
E
A
L
I
G
--
N
E
P
F
A
V
I
L
A
D
D
L
C
I
S
H
D
-
H
P
-
S
V
L
K
Q
M
T
S
L
Y
Q
K
Y
Q
C
----
S
I
V
A
I
E
E
V
A
L
E
E
V
S
K
Y
G
V
I
R
G
E
W
-
L
-
E
E
G
V
Y
---
E
I
K
D
M
V
E
K
P
N
Q
E
D
A
P
S
N
L
A
V
I
G
R
Y
I
L
T
P
D
I
F
E
I
L
S
E
T
K
P
G
K
N
N
E
I
Q
I
T
D
A
L
R
T
Q
-
A
K
R
K
-
R
I
I
A
Y
Q
F
K
G
K
R
Y
D
C
G
S
V
E
G
Y
I
E
A
S
N
A
Y
---------------------------
45
HHSearch
74.45
47%
2
- C1 -
-
3JUK
1
?
A:
[1-271]
-
M
I
K
K
C
L
F
P
A
A
G
Y
G
T
R
F
L
P
I
T
K
T
I
P
K
E
M
L
P
I
V
D
K
P
L
I
Q
Y
A
V
E
E
A
M
E
A
G
C
E
V
M
A
I
V
T
G
R
N
K
R
S
L
E
D
Y
F
D
T
S
Y
-------TN-
K
E
N
-
A
L
K
S
I
R
N
I
------
I
E
K
-
C
C
F
S
Y
V
R
Q
K
Q
M
K
G
L
G
H
A
I
L
T
G
E
A
L
I
G
--
N
E
P
F
A
V
I
L
A
D
D
L
C
--
I
S
H
D
H
P
S
V
L
K
Q
M
T
S
L
Y
Q
K
Y
Q
C
----
S
I
V
A
I
E
E
V
A
L
E
E
V
S
K
Y
G
V
I
R
G
E
W
L
--
E
E
G
V
Y
---
E
I
K
D
M
V
E
K
P
N
Q
E
D
A
P
S
N
L
A
V
I
G
R
Y
I
L
T
P
D
I
F
E
I
L
S
E
T
K
P
G
K
N
N
E
I
Q
I
T
D
A
L
R
T
Q
-
A
K
R
K
-
R
I
I
A
Y
Q
F
K
G
K
R
Y
D
C
G
S
V
E
G
Y
I
E
A
S
N
A
Y
Y
K
K
------------------------
33
PsiBlast_CBE
74.39
38%
-9
- C1 -
-
2PA4
1
?
C:
[12-298]
--
V
K
T
V
V
V
P
A
A
G
L
G
T
R
F
L
P
A
T
K
T
V
P
K
E
L
L
P
V
V
D
T
P
G
I
E
L
I
A
A
E
A
A
E
L
G
A
T
R
L
A
I
I
T
A
P
N
K
A
G
V
L
A
H
F
E
R
S
S
E
L
E
E
T
L
M
---
E
R
G
-
K
T
D
Q
V
E
I
I
--
R
--
R
A
A
D
L
I
K
A
V
P
V
T
Q
D
K
P
L
G
L
G
H
A
V
G
L
A
E
S
V
L
D
--
D
D
E
D
V
V
A
V
---
M
L
--
P
D
-
D
L
-
V
L
P
T
G
V
M
E
R
M
A
Q
V
R
A
E
F
G
G
S
V
L
C
A
V
E
V
S
E
A
D
V
S
K
Y
G
I
F
E
I
E
A
D
T
-
K
D
S
D
V
K--
K
V
K
G
M
V
E
K
P
A
I
E
D
A
P
S
R
L
A
A
T
G
R
Y
L
L
D
R
K
I
F
D
A
L
R
R
I
T
P
G
A
G
G
E
L
Q
L
T
D
A
I
D
L
L
I
D
E
G
H
-
P
V
H
I
V
I
H
Q
G
K
R
H
D
L
G
N
P
G
G
Y
I
P
A
C
V
D
F
G
L
S
H
P
V
Y
G
A
Q
L
K
D
A
I
K
-
Q
I
--------
7
PsiBlast_PDB
72.35
38%
-10
- C1 -
-
2PA4
1
?
A:
[12-298]
--
V
K
T
V
V
V
P
A
A
G
L
G
T
R
F
L
P
A
T
K
T
V
P
K
E
L
L
P
V
V
D
T
P
G
I
E
L
I
A
A
E
A
A
E
L
G
A
T
R
L
A
I
I
T
A
P
N
K
A
G
V
L
A
H
F
E
R
S
S
E
L
E
E
T
L
M
---
E
R
G
-
K
T
D
Q
V
E
I
I
--
R
--
R
A
A
D
L
I
K
A
V
P
V
T
Q
D
K
P
L
G
L
G
H
A
V
G
L
A
E
S
V
L
D
--
D
D
E
D
V
V
A
V
---
M
L
--
P
D
-
D
L
-
V
L
P
T
G
V
M
E
R
M
A
Q
V
R
A
E
FG
G
S
V
L
C
A
V
E
V
S
E
A
D
V
S
K
Y
G
I
F
E
I
E
A
D
T
-
K
D
S
D
V
K
--
K
V
K
G
M
V
E
K
P
A
I
E
D
A
P
S
R
L
A
A
T
G
R
Y
L
L
D
R
K
I
F
D
A
L
R
R
I
T
P
G
A
G
G
E
L
Q
L
T
D
A
I
D
L
L
I
D
E
G
H
-
P
V
H
I
V
I
H
Q
G
K
R
H
D
L
G
N
P
G
G
Y
I
P
A
C
V
D
F
G
L
S
H
P
V
Y
G
A
Q
L
K
D
A
I
K
-
Q
I
--------
39
HHSearch
71.86
39%
-14
* C1 *
-
2PA4
1
?
B:
[11-300]
-
A
V
K
T
V
V
V
P
A
A
G
L
G
T
R
F
L
P
A
T
K
T
V
P
K
E
L
L
P
V
V
D
T
P
G
I
E
L
I
A
A
E
A
A
E
L
G
A
T
R
L
A
I
I
T
A
P
N
K
A
G
V
L
A
H
F
E
R
S
S
E
L
E
E
T
L
M
---
E
R
G
-
K
T
D
Q
V
E
I
I
R
-
R
--
A
A
D
L
-
I
K
A
V
P
V
T
Q
D
K
P
L
G
L
G
H
A
V
G
L
A
E
S
V
L
D
DD
E
D
V
V
A
V
M
L
P
D
D
L
V
--
L
P
-
T
G
--
V
M
E
R
M
A
Q
V
R
A
E
F
G
G
----
S
V
L
C
A
V
E
V
S
E
A
D
V
S
K
Y
G
I
F
E
I
E
A
D
T
K
D
S
D
V
K
---
K
V
K
G
M
V
E
K
P
A
I
E
D
A
P
S
R
L
A
A
T
G
R
Y
L
L
D
R
K
I
F
D
A
L
R
R
I
T
P
G
A
G
G
E
L
Q
L
T
D
A
I
D
L
L
-
I
D
E
G
H
P
V
H
I
V
I
H
Q
G
K
R
H
D
L
G
N
P
G
G
Y
I
P
A
C
V
D
F
G
L
S
H
P
V
Y
G
A
Q
L
K
D
A
I
K
-
Q
I
L
A
------
32
PsiBlast_CBE
71.70
38%
-14
- C1 -
-
2PA4
1
?
D:
[12-298]
--
V
K
T
V
V
V
P
A
A
G
L
G
T
R
F
L
P
A
T
K
T
V
P
K
E
L
L
P
V
V
D
T
P
G
I
E
L
I
A
A
E
A
A
E
L
G
A
T
R
L
A
I
I
T
A
P
N
K
A
G
V
L
A
H
F
E
R
S
S
E
L
E
E
T
L
M
---
E
R
----
D
Q
V
E
I
I
--
R
--
R
A
A
D
L
I
K
A
V
P
V
T
Q
D
K
P
L
G
L
G
H
A
V
G
L
A
E
S
V
L
D
--
D
D
E
D
V
V
A
V
---
M
L
--
P
D
-
D
L
-
V
L
P
T
G
V
M
E
R
M
A
Q
V
R
A
EFGG
S
V
L
C
A
V
E
V
S
E
A
D
V
S
K
Y
G
I
F
E
I
E
A
D
T
-
K
D
S
D
V
K--
K
V
K
G
M
V
E
K
P
A
I
E
D
A
P
S
R
L
A
A
T
G
R
Y
L
L
D
R
K
I
F
D
A
L
R
R
I
T
P
G
A
G
G
E
L
Q
L
T
D
A
I
D
L
L
I
D
E
G
H
-
P
V
H
I
V
I
H
Q
G
K
R
H
D
L
G
N
P
G
G
Y
I
P
A
C
V
D
F
G
L
S
H
P
V
Y
G
A
Q
L
K
D
A
I
K
-
Q
I
--------
34
PsiBlast_CBE
70.95
38%
-11
- C1 -
-
2PA4
1
?
B:
[12-298]
--
V
K
T
V
V
V
P
A
A
G
L
G
T
R
F
L
P
A
T
K
T
V
P
K
E
L
L
P
V
V
D
T
P
G
I
E
L
I
A
A
E
A
A
E
L
G
A
T
R
L
A
I
I
T
A
P
N
K
A
G
V
L
A
H
F
E
R
S
S
E
L
E
E
T
L
M
---
E
R
G
-
K
T
D
Q
V
E
I
I
--
R
--
R
A
A
D
L
I
K
A
V
P
V
T
Q
D
K
P
L
G
L
G
H
A
V
G
L
A
E
S
V
L
D
--
D
D
E
D
V
V
A
V
---
M
L
--
P
D
-
D
L
-
V
L
P
T
G
V
M
E
R
M
A
Q
V
R
A
E
FG
G
S
V
L
C
A
V
E
V
S
E
A
D
V
S
K
Y
G
I
F
E
I
E
A
D
T
-
K
D
S
D
V
K
--
K
V
K
G
M
V
E
K
P
A
I
E
D
A
P
S
R
L
A
A
T
G
R
Y
L
L
D
R
K
I
F
D
A
L
R
R
I
T
P
G
A
G
G
E
L
Q
L
T
D
A
I
D
L
L
I
D
E
G
H
-
P
V
H
I
V
I
H
Q
G
K
R
H
D
L
G
N
P
G
G
Y
I
P
A
C
V
D
F
G
L
S
H
P
V
Y
G
A
Q
L
K
D
A
I
K
-
Q
I
--------
40
HHSearch
68.82
39%
-9
- C1 -
-
2PA4
1
?
D:
[11-300]
-
A
V
K
T
V
V
V
P
A
A
G
L
G
T
R
F
L
P
A
T
K
T
V
P
K
E
L
L
P
V
V
D
T
P
G
I
E
L
I
A
A
E
A
A
E
L
G
A
T
R
L
A
I
I
T
A
P
N
K
A
G
V
L
A
H
F
E
R
S
S
E
L
E
E
T
L
M
---
E
R
----
D
Q
V
E
I
I
R-
R
--
A
A
D
L
-
I
K
A
V
P
V
T
Q
D
K
P
L
G
L
G
H
A
V
G
L
A
E
S
V
L
D
DD
E
D
V
V
A
V
M
L
P
D
D
L
V
--
L
P
-
T
G
--
V
M
E
R
M
A
Q
V
R
A
E
F
G
G
----
S
V
L
C
A
V
E
V
S
E
A
D
V
S
K
Y
G
I
F
E
I
E
A
D
T
K
D
S
D
V
K
---
K
V
K
G
M
V
E
K
P
A
I
E
D
A
P
S
R
L
A
A
T
G
R
Y
L
L
D
R
K
I
F
D
A
L
R
R
I
T
P
G
A
G
G
E
L
Q
L
T
D
A
I
D
L
L
-
I
D
E
G
H
P
V
H
I
V
I
H
Q
G
K
R
H
D
L
G
N
P
G
G
Y
I
P
A
C
V
D
F
G
L
S
H
P
V
Y
G
A
Q
L
K
D
A
I
K
-
Q
I
L
A
------