@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 : gbs1395: (2015-12-07 )
MDGKSISVKSYANIAIIKYWGKADAEKMIPATSSISLTLENMYTETRLTTLGKDAKKDEFYISGVLQNDHEHDKMSAILDRFRQNKSGFVKIETTNNMPTAAGLSSSSSGLSALVKACNDFFGTNLSQSQLAQEAKFASGSSSRSFFGPVAAWDKDSGDIYKVHTDLDLAMIMLVLNDKRKPISSREGMKICTETSTTFNEWVRQSEQDYQDMLVYLKNNDFQKVGQLTERNALAMHSTTKTATPAFSYLTEETYKAMDVVKKLREKGHECYYTMDAGPNVKVLCLRQDLEALAAILEKDYRIIVSTTKELADG
Atome Classification :
(23 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..
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MDG
K
S
I
S
V
K
S
Y
A
N
I
A
I
I
K
YWGKA
D
A
----
E
KM-IPAT
S
S
I
S
L
T
L
E
--NMYTE
T
R
L
T
TLGKDAKKD
E
F
Y
I
S
G
VLQNDHE
H
D
K
M
S
A
I
L
D
R
F
RQ--NK-----S
G
F
V
K
I
E
TTNNMPTAAGLSSSS
S
G
L
S
A
L
V
K
A
C
N
D
F
FGTNL
S
Q
S
Q
L
A
Q
E
A
KFASGSSSRSFFGPVAAWDK----DSG
D
-----
I
----
Y
-
K
-
V
----HT---
D
L
D
L
A
M
I
--
M
L
VLNDKRKPI-SSREG
M
K
I
CTETS
T
T
F
N
E
W
V
R
-
Q
S
E
Q
D
Y
Q
D
M
L
V
YLKNN
D
F
Q
K
V
G
Q
L
T
ERN
A
L
A
MHSTTKTAT
P
A
---
F
S
Y
L
T
E
E
T
Y
K
A
M
D
V
V
K
K
L
R
EK--G
H
E
C
Y
Y
T
MDAGP
N
V
K
V
L
C
L
R
Q
D
L
E
A
L
A
A
I
L
E--KD
Y
R
I
I
V
S
T
T
K
E
LADG
1
PsiBlast_PDB
99.79
67%
-83
- C1 -
2GS8
10
?
A:
[5-316]
-
D
P
N
V
I
T
V
T
S
Y
A
N
I
A
I
I
K
Y
W
G
K
E
N
Q
----
A
K
M
-
I
P
S
T
S
S
I
S
L
T
L
E
--
N
M
F
T
T
T
S
V
S
F
L
P
D
T
A
T
S
D
Q
F
Y
I
N
G
I
L
Q
N
D
E
E
H
T
K
I
S
A
I
I
D
Q
F
R
Q
--
P
G
-----
Q
A
F
V
K
M
E
T
Q
N
N
M
P
T
A
A
G
L
S
S
S
S
S
G
L
S
A
L
V
K
A
C
D
Q
L
F
D
T
Q
L
D
Q
K
A
L
A
Q
K
A
K
F
A
S
G
S
S
S
R
S
F
F
G
P
V
A
A
W
D
K
----
D
S
G
A
-----
I
----
Y
-
K
-
V
----
E
T
---
D
L
K
M
A
M
I
--
M
L
V
L
N
A
A
K
K
P
I
-
S
S
R
E
G
M
K
L
C
R
D
T
S
T
T
F
D
Q
W
V
E
-
Q
S
A
I
D
Y
Q
H
M
L
T
Y
L
K
T
N
N
F
E
K
V
G
Q
L
T
E
A
N
A
L
A
M
H
A
T
T
K
T
A
N
P
P
---
F
S
Y
L
T
K
E
S
Y
Q
A
M
E
A
V
K
E
L
R
Q
E
--
G
F
A
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
C
L
E
K
D
L
A
Q
L
A
E
R
L
G
--
K
N
Y
R
I
I
V
S
K
T
K
D
L
P
D
V
45
HHSearch
96.43
68%
-71
- C1 -
2GS8
10
?
A:
[4-313]
M
D
P
N
V
I
T
V
T
S
Y
A
N
I
A
I
I
K
Y
W
G
K
E
N
Q
----
A
K
M
-
I
P
S
T
S
S
I
S
L
T
L
E
--
N
M
F
T
T
T
S
V
S
F
L
P
D
T
A
T
S
D
Q
F
Y
I
N
G
I
L
Q
N
D
E
E
H
T
K
I
S
A
I
I
D
Q
F
R
Q
--
P
G
-----
Q
A
F
V
K
M
E
T
Q
N
N
M
P
T
A
A
G
L
S
S
S
S
S
G
L
S
A
L
V
K
A
C
D
Q
L
F
D
T
Q
L
D
Q
K
A
L
A
Q
K
A
K
F
A
S
G
S
S
S
R
S
F
F
G
P
V
A
A
W
D
K
----
D
S
G
A
-----
I
----
Y
-
K
V
E
----
T
D
---
L
-
K
--
M
A
M
I
M
L
V
L
N
A
A
K
K
P
I
S
S
R
E
G
M
K
L
C
R
-
D
T
S
T
T
F
D
Q
W
V
E
-
Q
S
A
I
D
Y
Q
H
M
L
T
Y
L
K
T
N
N
F
E
K
V
G
Q
L
T
E
A
N
A
L
A
M
H
A
T
T
K
T
A
N
P
P
---
F
S
Y
L
T
K
E
S
Y
Q
A
M
E
A
V
K
E
L
R
Q
E
--
G
F
A
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
C
L
E
K
D
L
A
Q
L
A
E
R
L
G
--
K
N
Y
R
I
I
V
S
K
T
K
D
L
P
D
V
4
PsiBlast_PDB
86.73
39%
-61
- C1 -
3QT5
-
?
A:
[3-300]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
N
Q
S
K
K
---
S
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
12
PsiBlast_PDB
86.39
39%
-59
- C1 -
4DPY
1
?
A:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
N
Q
S
K
K
V
-
S
A
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
8
PsiBlast_PDB
85.46
39%
-61
- C1 -
4DU7
2
?
A:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
----
K
K
V
-
S
S
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
10
PsiBlast_PDB
85.41
39%
-58
- C1 -
4DPU
2
?
A:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
N
Q
S
K
K
V
-
S
A
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
26
PsiBlast_CBE
85.34
39%
-58
- C1 -
4DPX
5
?
B:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
N
Q
S
K
K
V
-
S
---
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
49
HHSearch
85.17
37%
-59
* C1 *
3QT5
-
?
A:
[-1-308]
S
M
V
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
F
D
P
D
-
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
--
L
A
GN---
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
-
A
H
G
I
N
SN--
G
W
---
E
K
D
L
S
M
I
--
F
V
V
I
N
N
Q
S
K
K
---
S
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
FTY
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
-----
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
6
PsiBlast_PDB
85.16
39%
-60
- C1 -
3QT7
1
?
A:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
N
Q
---
V
-
S
S
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
14
PsiBlast_PDB
85.01
39%
-60
- C1 -
4DU8
3
?
A:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
N
Q
S
K
K
V
-
S
S
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
A
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
29
PsiBlast_CBE
84.91
39%
-56
- C1 -
4DU8
1
?
B:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
N
-------
S
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
A
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
23
PsiBlast_CBE
84.48
39%
-59
- C1 -
3QT7
1
?
B:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
------
V
-
S
S
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
27
PsiBlast_CBE
84.47
39%
-57
- C1 -
4DPU
2
?
B:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
N
Q
S
K
K
V
-
S
A
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
11
PsiBlast_PDB
84.46
39%
-58
- C1 -
4DPX
5
?
A:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
N
Q
S
K
K
V
-
S
A
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
5
PsiBlast_PDB
84.41
39%
-57
- C1 -
3QT6
1
?
A:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
N
Q
S
K
K
V
-
S
S
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
7
PsiBlast_PDB
84.26
39%
-58
- C1 -
4DPT
1
?
A:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
---------
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
24
PsiBlast_CBE
84.15
39%
-56
- C1 -
3QT6
1
?
B:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
N
-------
S
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
9
PsiBlast_PDB
84.11
39%
-61
- C1 -
3QT8
2
?
A:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
----
K
K
V
-
S
A
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
21
PsiBlast_CBE
84.07
39%
-57
- C1 -
4DU7
2
?
B:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
N
----
V
-
S
S
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
47
HHSearch
83.49
26%
-60
- C1 -
2HKE
3
?
A:
[4-318]
---
Q
C
V
T
V
E
A
P
I
N
I
A
F
I
K
Y
W
G
K
R
E
G
GETL
I
L
P
---
T
N
D
S
F
S
I
T
L
S
AS
P
F
R
S
K
T
S
V
E
L
R
D
D
-
I
E
T
D
T
L
R
L
N
G
T
E
V
D
V
G
K
T
P
R
V
Q
S
M
L
L
H
L
R
S
--
T
C
PEELK
N
K
K
V
N
I
V
S
E
N
N
F
P
T
A
A
G
M
A
S
S
A
S
G
Y
C
A
M
S
A
A
L
I
R
A
F
K
---
S
T
T
N
V
S
M
L
A
R
L
G
S
G
S
A
C
R
S
A
F
G
G
F
V
I
W
N
K
----
G
E
K
P
DGSDC
V
----
A
-
T
Q
F
VDET
H
W
---
P
-
E
I
Q
V
M
--
C
A
V
L
K
G
A
Q
K
D
V
S
S
T
K
G
M
Q
Q
S
L
-
K
T
S
P
L
M
K
K
R
I
S
E
T
V
P
E
R
M
K
I
A
S
R
A
I
K
A
R
D
F
A
T
F
A
E
I
A
M
L
E
S
D
D
L
Q
E
I
C
A
T
T
E
P
K
---
I
T
Y
A
T
E
D
S
Y
A
M
I
R
L
V
K
A
Y
N
A
K
K
G
R
T
A
L
A
Y
T
F
D
A
G
A
N
C
F
L
F
V
L
K
E
D
L
P
E
A
V
A
M
L
M
--
E
H
F
P
T
P
F
E
K
F
F
F
G
D
R
E
25
PsiBlast_CBE
83.47
39%
-55
- C1 -
4DPY
1
?
B:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
N
----
V
-
S
A
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
22
PsiBlast_CBE
81.54
39%
-55
- C1 -
4DPT
2
?
B:
[8-305]
---
K
S
G
K
A
R
A
H
T
N
I
A
L
I
K
Y
W
G
K
A
D
E
----
T
Y
I
-
I
P
M
N
N
S
L
S
V
T
L
D
--
R
F
Y
T
E
T
K
V
T
-
F
D
P
D
F
T
E
D
C
L
I
L
N
G
N
E
V
N
A
K
E
K
E
K
I
Q
N
Y
M
N
I
V
R
D
L
A
G
N
-----
R
L
H
A
R
I
E
S
E
N
Y
V
P
T
A
A
G
L
A
S
S
A
S
A
Y
A
A
L
A
A
A
C
N
E
A
L
S
L
N
L
S
D
T
D
L
S
R
L
A
R
R
G
S
G
S
A
S
R
S
I
F
G
G
F
A
E
W
E
K
----
G
H
D
D
-----
L
T
S
Y
A
H
-
G
-
I
----
N
S
NGW
E
K
D
L
S
M
I
--
F
V
V
I
N
N
----
V
-
S
S
R
S
G
M
S
L
T
R
D
T
S
R
F
Y
Q
Y
W
L
D
-
H
V
D
E
D
L
N
E
A
K
E
A
V
K
N
Q
D
F
Q
R
L
G
E
V
I
E
A
N
G
L
R
M
H
A
T
N
L
G
A
Q
P
P
---
F
T
Y
L
V
Q
E
S
Y
D
A
M
A
I
V
E
Q
C
R
K
A
--
N
L
P
C
Y
F
T
M
D
A
G
P
N
V
K
V
L
V
E
K
K
N
K
Q
A
V
M
E
Q
F
L
--
K
V
F
D
E
S
K
I
I
A
S
D
I
I
S
S
15
PsiBlast_PDB
81.36
30%
-50
- C1 -
4Z7C
4
?
A:
[2-317]
---
K
S
V
T
V
S
A
P
S
N
I
A
V
V
K
Y
W
G
K
R
G
D
----
E
R
L
N
L
P
L
N
N
S
L
S
I
T
L
D
--
D
Q
L
S
V
I
T
K
V
T
L
--
N
D
K
N
I
V
I
V
N
D
R
I
L
S
E
D
E
M
K
E
Y
A
G
R
V
L
D
T
F
K
K
I
V
G
K
-----
E
F
H
V
K
V
E
S
K
S
K
F
P
I
N
A
G
L
A
S
S
A
A
G
I
A
A
L
A
F
S
L
N
E
L
L
E
L
N
L
K
S
E
E
L
S
K
I
A
R
L
G
S
G
S
A
C
R
S
M
F
G
G
F
V
V
W
N
K
GERE
D
G
E
D
S
Y
C
Y
Q
I
----
F
-
R
-
H
----
D
Y
---
W
S
E
L
V
D
I
--
I
P
I
L
S
E
K
E
K
K
I
-
S
S
R
K
G
M
I
R
S
A
E
T
S
E
L
M
E
C
R
L
K
-
Y
I
E
K
T
F
N
E
V
I
E
A
I
R
N
R
D
E
K
K
F
Y
Y
L
M
M
R
H
S
N
S
M
H
A
V
I
L
D
S
W
P
S
---
F
F
Y
L
N
D
T
S
I
R
I
M
E
W
I
H
D
Y
G
K
A
--
G
----
Y
T
F
D
A
G
P
N
P
H
I
F
T
T
E
R
N
I
G
D
I
L
E
F
L
K
S
L
E
I
K
R
I
I
V
S
---
K
V
G
D
G