@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 : PA0123: (2015-12-22 )
MDSLKGMAIFATVVDKGSMAAAAQSLGMTPSAVSQQIRKLESRAQVTLLHRTTRRLTLTEAGEAFYRSCAQMLAIAEEAERRLGEWRDAPVGELRLAAPVGFSGTLITQALKPLLENHRQLRLQLFFQDERIDLVAERIDLAIRVGNLADSSLVARHLGDWSSVLCAAPAYLRQRAPINRPEQLTEVDWISLNTSNHLNHLTLSGPGGEVCKLRLEPRVAANGMLAVRQFTLDGLGVSYQPLPEVRDALNDGRLQQLLPEWRIPGLGIYAVTPRREAQPAKVKVAIEALRRAFATDGDERWS
Atome Classification :
(20 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--
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
----MDSLK
G
M
A
I
F
A
T
VVDKG
S
M
A
A
A
A
Q
SLGM
T
P
S
A
V
S
Q
Q
I
R
K
L
E
SRA
Q
V
T
L
L
HRTT
R
R
L
T
L
T
E
A
G
E
A
F
Y
R
S
C
A
Q
M
L
A
-
I
A
E
E
A
E
R
R
LGEWR-DAPVG-
E
L
R
L
AAP-V-GF
S
G
T
L
I
T
Q
A
L
K
P
L
L
E
N
H
R
Q
L
R
L
Q
L
F
---
F
-QD--
E
--
R
I
D
--
L
V
---
A
E
-
R
I
D
L
A
I
R
V---GNLA---
D
-
S
S
L
V
A
R
H
L-G
D
W
S
-
S
V
L
C
A
A
P
A
Y
--
L
R
QR-APIN-RPEQL
T
E
V
D
-
W
I
S
LNTSNHL
N
--
H
L
-
T
LSGP-----GG
E
V
C
K
L
-
R
LE
P
R
V-AA-N
G
M
-
L
A
-
V
R
Q
F
TLD-GLGVSYQP
L
P
E
-
V
R
D
A
LND
G
R
L
Q
Q
-
L
L
P
E
W-R-IP--G-
L
G
I
Y
A
VTPRREAQP
A
K
V
-
K
V
A
I
E
A
L
R
R
A
FATDGDERWS--
23
HHSearch
88.69
27%
-108
- C4 -
3HHG
-
?
A:
[2-294]
----
K
T
N
S
E
E
L
T
V
F
V
Q
V
V
E
S
G
S
F
S
R
A
A
E
Q
L
A
M
A
N
S
A
V
S
R
I
V
K
R
L
E
E
K
L
G
V
N
L
L
N
R
T
T
R
Q
L
S
L
T
E
E
G
A
Q
Y
F
R
R
A
Q
R
I
L
Q
-
E
M
A
A
A
E
T
E
M
L
A
V
H
-
E
I
P
Q
G
-
V
L
S
V
D
S
A
-
M
-
P
M
V
L
H
L
L
A
P
L
A
A
K
F
N
E
R
Y
P
H
I
R
L
S
L
V
---
S
-
S
E
--
G
--
Y
I
N
--
L
I
---
E
R
-
K
V
D
I
A
L
R
A
---
G
E
L
D
---
D
-
S
G
L
R
A
R
H
L
-
F
D
S
R
-
F
R
V
I
A
S
P
E
Y
--
L
A
K
H
-
G
T
P
Q
-
S
T
E
E
L
A
G
H
Q
-
C
L
G
F
T
E
P
G
S
L
N
--
T
W
-
A
V
L
D
A
-----
Q
G
--
N
P
Y
-
K
I
S
P
H
F
-
T
A
-
S
S
G
-
E
I
-
L
R
S
L
C
L
S
-
G
C
G
I
V
C
L
S
D
F
L
-
V
D
N
D
I
A
E
G
K
L
I
P
-
L
L
A
E
Q
T
S
-
D
K
--
T
-
H
P
F
N
A
V
Y
Y
S
D
K
A
V
N
L
R
L
-
R
V
F
L
D
F
L
V
E
E
L
G
----------
24
HHSearch
88.52
27%
-118
- C4 -
3SZP
-
?
A:
[1-290]
-----
M
K
L
D
D
L
N
L
F
R
L
V
V
E
N
G
S
Y
T
S
T
S
K
K
T
M
I
P
V
A
T
I
T
R
R
I
Q
A
L
E
D
S
L
N
L
R
L
L
N
R
H
A
R
K
L
T
L
T
E
A
G
E
R
F
Y
K
D
C
S
P
L
L
E
-
R
L
A
S
M
T
E
E
I
T
D
E
C
-
R
G
A
S
G
-
R
I
R
I
S
A
P
-
S
-
N
L
T
K
R
M
M
M
P
M
F
N
A
F
M
E
K
Y
P
D
I
H
I
E
L
M
---
M
-
S
N
--
Q
--
A
D
D
--
L
D
---
P
T
-
E
W
D
V
I
F
R
V
---
G
P
Q
R
---
D
-
S
S
L
I
A
R
K
I
-
G
E
V
K
-
D
I
L
V
A
S
P
Q
Y
--
L
S
S
H
-
P
Q
P
T
-
H
A
E
E
L
H
Q
H
Q
-
L
L
K
G
Y
P
L
---
L
--
K
W
-
Q
L
T
N
S
-----
Q
G
E
T
V
V
N
-
S
D
R
G
R
F
-
Q
A
-
S
A
L
-
N
V
-
V
R
S
A
C
S
E
-
G
L
G
I
T
L
M
P
D
V
M
-
L
R
E
F
L
E
D
G
S
L
V
Q
-
V
L
S
D
W
-
S
-
S
N
--
P
-
R
D
I
Y
M
L
Y
N
H
K
D
H
Q
P
E
K
V
-
R
L
F
I
D
F
V
I
G
Y
H
L
----------
1
PsiBlast_PDB
87.67
29%
-115
- C4 -
3SZP
-
?
A:
[3-283]
-------
L
D
D
L
N
L
F
R
L
V
V
E
N
G
S
Y
T
S
T
S
K
K
T
M
I
P
V
A
T
I
T
R
R
I
Q
A
L
E
D
S
L
N
L
R
L
L
N
R
H
A
R
K
L
T
L
T
E
A
G
E
R
F
Y
K
D
C
S
P
L
L
E
R
L
A
S
M
T
E
E
I
T
D
E
C
R
-
G
A
S
-
G
-
R
I
R
I
S
A
P
-
S
-
N
L
T
K
R
M
M
M
P
M
F
N
A
F
M
E
K
Y
P
D
I
H
I
E
L
M
---
M
-
S
N
--
Q
--
A
D
D
--
L
D
---
P
T
-
E
W
D
V
I
F
R
V
---
G
P
Q
R
---
D
-
S
S
L
I
A
R
K
I
-
G
E
V
K
-
D
I
L
V
A
S
P
Q
Y
--
L
S
S
H
-
P
----
Q
P
T
H
A
E
E
L
H
-
Q
H
Q
L
L
K
G
Y
P
L
L
--
K
W
-
Q
L
T
N
S
-----
Q
G
E
T
V
V
N
-
S
D
R
G
R
F
-
Q
A
-
S
A
L
-
N
V
-
V
R
S
A
C
S
E
-
G
L
G
I
T
L
M
P
D
V
M
-
L
R
E
F
L
E
D
G
S
L
V
Q
-
V
L
S
D
W
-
S
-
S
N
--
P
-
R
D
I
Y
M
L
Y
N
H
K
D
H
Q
P
E
K
V
-
R
L
F
I
D
F
V
I
G
Y
H
L
----------
2
PsiBlast_PDB
86.76
29%
-110
- C4 -
3T1B
-
?
B:
[3-283]
-------
L
D
D
L
N
L
F
R
L
V
V
E
N
G
S
Y
T
S
T
S
K
K
T
M
I
P
V
A
T
I
T
R
R
I
Q
A
L
E
D
S
L
N
L
R
L
L
N
R
H
A
R
K
L
T
L
T
E
A
G
E
R
F
Y
K
D
C
S
P
L
L
E
R
L
A
S
M
T
E
E
I
T
D
E
C
R
-
G
A
S
-
G
-
R
I
R
I
S
A
P
-
S
-
E
L
T
K
R
M
M
M
P
M
F
N
A
F
M
E
K
Y
P
D
I
H
I
E
L
M
---
M
-
S
N
--
Q
--
A
D
---
L
D
---
P
T
-
E
W
D
V
I
F
R
V
---
G
P
Q
R
---
D
-
S
S
L
I
A
R
K
I
-
G
E
V
K
-
D
I
L
V
A
S
P
Q
Y
--
L
S
S
H
-
P
----
Q
P
T
H
A
E
E
L
H
-
Q
H
Q
L
L
K
G
Y
P
L
L
--
K
W
-
Q
L
T
N
S
-----
Q
G
E
T
V
V
N
-
S
D
R
G
R
F
-
Q
A
-
S
A
L
-
N
V
-
V
R
S
A
C
S
E
-
G
L
G
I
T
L
M
P
D
V
M
-
L
R
E
F
L
E
D
G
S
L
V
Q
-
V
L
S
D
W
-
S
-
S
N
--
P
-
R
D
I
Y
M
L
Y
N
H
K
D
H
Q
P
E
K
V
-
R
L
F
I
D
F
V
I
G
Y
H
L
----------
4
PsiBlast_PDB
79.49
29%
-122
- C4 -
3HHG
-
?
A:
[8-259]
----------
L
T
V
F
V
Q
V
V
E
S
G
S
F
S
R
A
A
E
Q
L
A
M
A
N
S
A
V
S
R
I
V
K
R
L
E
E
K
L
G
V
N
L
L
N
R
T
T
R
Q
L
S
L
T
E
E
G
A
Q
Y
F
R
R
A
Q
R
I
L
Q
-
E
M
A
A
A
E
T
E
M
L
A
V
H
-
E
I
P
Q
G
-
V
L
S
V
D
S
A
-
M
-
P
M
V
L
H
L
L
A
P
L
A
A
K
F
N
E
R
Y
P
H
I
R
L
S
L
V
---
S
-
S
E
--
G
--
Y
I
N
--
L
I
---
E
R
-
K
V
D
I
A
L
R
A
---
G
E
L
D
---
D
-
S
G
L
R
A
R
H
L
-
F
D
S
R
-
F
R
V
I
A
S
P
E
Y
--
L
A
K
H
-
G
T
P
Q
-
S
T
E
E
L
A
G
H
Q
-
C
L
G
F
T
E
P
G
S
L
N
--
T
W
-
A
V
L
D
A
-----
Q
G
N
--
P
Y
-
K
I
S
P
H
F
-
T
A
-
S
S
G
-
E
I
-
L
R
S
L
C
L
S
-
G
C
G
I
V
C
L
S
D
F
L
-
V
D
N
D
I
A
E
G
K
L
I
P
-
L
L
A
E
Q
-
T
-
S
D
--
K
-
T
H
P
F
N
A
V
Y
Y
S
D
K
A
V
N
L
R
-
L
R
V
F
L
D
F
L
V
E
E
L
G
---------
30
HHSearch
73.75
28%
-104
- C4 -
3MZ1
-
?
A:
[85-296]
----------------------------------------------------------------------------------------------
L
P
K
G
-
R
L
R
V
E
T
A
-
S
-
A
F
A
N
L
V
I
I
P
A
L
P
E
F
H
K
K
Y
P
D
I
Q
I
D
L
G
---
V
-
S
D
--
R
--
T
----
Y
L
---
A
E
-
N
V
D
C
A
I
R
A
---
G
T
L
T
---
D
-
Q
S
L
I
A
R
R
I
-
T
E
M
K
-
F
V
A
C
A
S
R
D
F
--
L
E
R
H
-
P
V
P
Q
-
H
P
S
D
L
E
K
N
C
-
Y
V
V
G
Y
F
L
P
K
-
Q
Q
M
P
F
-
H
F
R
R
G
------
N
E
E
I
E
V
-
S
G
R
Y
T
M
-
A
A
-
N
E
S
-
T
T
-
Y
L
A
A
A
R
A
-
G
L
G
V
I
Q
A
P
L
F
M
-
V
R
E
D
L
R
N
G
T
M
V
P
-
V
L
P
D
W
-
Q
-
V
E
--
P
-
M
P
I
Y
L
V
Y
P
P
N
R
H
L
S
S
R
L
-
R
V
F
A
D
W
V
V
K
V
M
A
Q
S
Q
N
------
25
HHSearch
71.94
18%
-98
- C4 -
3FXQ
7
TSAR_COMTE
A:
[1-296]
----
M
L
K
L
Q
T
L
Q
A
L
I
C
I
E
E
V
G
S
L
R
A
A
A
Q
L
L
H
L
S
Q
P
A
L
S
A
A
I
Q
Q
L
E
D
E
L
K
A
P
L
L
V
R
T
K
R
G
V
S
L
T
S
F
G
Q
A
F
M
K
H
A
R
L
I
V
T
-
E
S
R
R
A
Q
E
E
I
G
Q
L
R
-
G
R
W
E
G
-
H
I
T
F
A
A
S
-
P
-
A
I
A
L
A
A
L
P
L
A
L
A
S
F
A
R
E
F
P
D
V
T
V
N
V
R
---
D
-
G
M
--
Y
PA
V
S
P
Q
-
L
R
---
D
G
-
T
L
D
F
A
L
T
A
---
A
H
K
H
DI-
D
-
T
D
L
E
A
Q
P
L
-
Y
V
S
D
-
V
V
I
V
G
Q
R
Q
H
--
P
M
A
N
---
A
T
-
R
L
A
E
L
Q
E
C
R
-
W
A
F
S
S
A
P
R
G
P
G
---
A
-
I
I
R
N
A
-----
F
A
-
R
Y
G
L
P
E
P
K
L
G
L
-
V
C
-
E
S
F
-
L
A
-
L
P
G
V
V
A
H
-
S
D
L
L
T
T
M
P
R
T
L
-
Y
E
R
N
A
F
K
D
Q
L
C
S
-
I
P
L
Q
D
-
A
-
L
P
--
N
-
P
T
I
Y
V
L
R
R
H
D
L
P
V
T
P
A
A
-
A
G
L
I
R
W
I
Q
H
H
A
L
----------
47
Fugue
69.90
19%
-81
- C4 -
3ISP
-
Y1985_MYCTU
A:
[5-296]
----
Q
L
D
G
P
Q
L
A
A
L
A
A
V
V
E
L
G
S
F
D
A
A
A
E
R
L
H
V
T
P
S
A
V
S
Q
R
I
K
S
L
E
Q
Q
V
G
Q
V
L
V
V
R
E
-
K
P
C
R
A
T
T
A
G
I
P
L
L
R
L
A
A
Q
T
A
L
-
L
E
S
E
A
L
A
E
M
G
A
---
S
L
K
R
T
-
R
I
T
I
A
V
N
-
A
-
D
S
M
A
T
W
F
S
A
V
F
D
G
L
--
G
D
V
L
L
D
V
R
I
E
---
D
-
Q
D
--
H
--
S
A
R
--
L
L
---
R
E
G
V
A
M
G
A
V
T
T
---
E
R
N
P
---
V
-
P
G
C
R
V
H
P
L
-
G
E
M
R
-
Y
L
P
V
A
S
R
P
F
--
V
Q
R
H
-
L
S
D
G
F
T
A
A
A
A
A
K
A
P
-
S
L
A
W
N
R
D
D
G
L
Q
--
D
M
-
L
V
R
K
A
-----
F
R
R
A
I
T
R
----
P
T
H
-
F
V
-
P
T
T
-
E
G
-
F
T
A
A
A
R
A
-
G
L
G
W
G
M
F
P
E
K
L
-
A
A
S
P
L
A
D
G
S
F
V
R
-
V
C
D
I
H
-
L
-
D
V
--
P
-
L
Y
W
Q
C
W
K
L
D
---------
S
P
I
I
A
R
I
T
D
T
V
R
A
A
A
S
G
L
Y
R
GQ
45
Fugue
69.66
24%
-104
- C4 -
3HHF
1
?
A:
[5-207]
-----------------------------------------------------------------------------------------------
P
Q
G
-
V
L
S
V
D
S
A
M
P
M
V
L
H
L
--
L
A
P
L
A
A
K
F
N
E
R
Y
P
H
I
R
L
S
L
V
---
S
-
S
E
--
G
--
Y
I
N
--
L
I
---
E
R
-
K
V
D
I
A
L
R
A
---
G
E
L
D
---
D
-
S
G
L
R
A
R
H
L
-
F
D
S
R
-
F
R
V
I
A
S
P
E
Y
--
L
A
K
H
-
G
T
P
Q
-
S
T
E
E
L
A
G
H
Q
-
C
L
G
F
T
E
P
G
S
L
N
--
T
W
-
A
V
L
D
A
-----
Q
G
N
--
P
Y
-
K
I
S
P
H
F
-
T
A
-
S
S
G
-
E
I
-
L
R
S
L
C
L
S
-
G
C
G
I
V
C
L
S
D
F
L
-
V
D
N
D
I
A
E
G
K
L
I
P
-
L
L
A
E
Q
-
T
-
S
D
--
K
T
H
P
F
N
A
V
Y
Y
S
D
K
A
V
N
L
R
L
-
R
V
F
L
D
F
L
V
E
E
L
G
----------
42
HHSearch
68.60
24%
-108
- C4 -
3HHF
1
?
B:
[5-208]
-----------------------------------------------------------------------------------------------
P
Q
G
-
V
L
S
V
D
S
A
-
M
-
P
M
V
L
H
L
L
A
P
L
A
A
K
F
N
E
R
Y
P
H
I
R
L
S
L
V
---
S
-
S
E
--
G
--
Y
I
N
--
L
I
---
E
R
-
K
V
D
I
A
L
R
A
---
G
--
D
---
D
-
S
G
L
R
A
R
H
L
-
F
D
S
R
-
F
R
V
I
A
S
P
E
Y
--
L
A
K
H
-
G
T
P
Q
-
S
T
E
E
L
A
G
H
Q
-
C
L
G
F
T
E
P
G
S
L
N
--
T
W
-
A
V
L
D
A
-----
Q
G
--
N
P
Y
-
K
I
S
P
H
F
-
T
A
-
S
S
G
-
E
I
-
L
R
S
L
C
L
S
-
G
C
G
I
V
C
L
S
D
F
L
-
V
D
N
D
I
A
E
G
K
L
I
P
-
L
L
A
E
Q
-
T
S
D
K
--
T
-
H
P
F
N
A
V
Y
Y
S
D
K
A
V
N
L
R
L
-
R
V
F
L
D
F
L
V
E
E
L
G
----------
34
HHSearch
67.71
19%
-77
- C4 -
3ISP
-
Y1985_MYCTU
A:
[5-294]
----
Q
L
D
G
P
Q
L
A
A
L
A
A
V
V
E
L
G
S
F
D
A
A
A
E
R
L
H
V
T
P
S
A
V
S
Q
R
I
K
S
L
E
Q
Q
V
G
Q
V
L
V
V
R
E
-
K
P
C
R
A
T
T
A
G
I
P
L
L
R
L
A
A
Q
T
A
L
-
L
E
S
E
A
L
A
E
M
G
--
A
-
S
L
K
R
T
-
R
I
T
I
A
V
N
-
A
-
D
S
M
A
T
W
F
S
A
V
F
D
G
----
L
G
D
V
L
L
D
V
R
---
I
-
E
D
Q
D
H
--
S
A
R
L
-
L
R
---
E
G
-
V
A
M
G
A
V
T
T
---
E
R
N
P
---
V
-
P
G
C
R
V
H
P
L
-
G
E
M
R
-
Y
L
P
V
A
S
R
P
F
--
V
Q
R
H
L
S
D
G
F
-
T
A
A
A
A
A
K
A
P
-
S
L
A
W
N
R
D
D
G
L
Q
--
D
M
-
L
V
R
K
A
-----
F
R
-
R
A
---
I
T
R
P
T
H
-
F
V
-
P
T
T
-
E
G
-
F
T
A
A
A
R
A
-
G
L
G
W
G
M
F
P
E
K
L
-
A
A
S
P
L
A
D
G
S
F
V
R
-
V
C
D
-
I
-------
H
-
L
D
V
P
L
Y
W
Q
C
W
K
L
D
S
P
I
I
-
A
R
I
T
D
T
V
R
A
A
A
S
G
L
Y
R
G
Q
----
48
Fugue
65.18
16%
-79
- C4 -
3FZV
1
?
A:
[4-300]
-----
Y
T
L
R
Q
L
K
Y
F
V
T
T
V
E
C
G
S
V
A
E
A
S
R
K
L
Y
I
A
Q
S
-
I
S
T
A
V
K
G
L
E
E
S
---------
F
V
Q
L
F
L
T
P
A
G
A
R
F
Y
R
K
A
Q
E
L
L
R
M
A
H
E
F
E
Q
N
L
A
D
N
---
D
V
I
A
G
-
Q
I
D
I
G
C
F
-
E
-
T
V
A
P
L
Y
L
P
G
L
I
A
G
F
R
Q
A
Y
P
G
V
E
I
R
I
R
---
D
G
E
Q
--
Q
--
E
L
V
Q
G
L
T
---
S
G
-
R
F
D
L
A
F
L
Y
---
E
H
D
L
---
D
-
S
T
I
E
T
E
P
L
M
P
P
Q
R
-
P
H
A
L
L
P
E
G
H
--
R
F
A
G
-
Q
A
Q
V
-
S
L
R
D
L
C
L
E
P
M
I
L
L
D
V
Q
P
S
R
T
Y
--
F
V
-
S
L
F
E
E
-----
L
G
L
T
P
N
I
-
A
F
S
S
P
S
-
I
E
M
V
R
G
M
V
G
-------
Q
-
G
F
G
F
S
L
L
V
T
R
P
-
H
S
E
C
T
Y
D
G
K
K
V
V
M
V
D
L
A
E
-
P
-
V
S
--
T
-
S
G
L
A
A
A
W
L
K
R
A
Q
L
T
K
P
A
-
R
L
F
V
D
Y
C
R
E
Q
L
G
K
---------
3
PsiBlast_PDB
64.02
29%
-79
- C4 -
3MZ1
-
?
A:
[85-282]
----------------------------------------------------------------------------------------------
L
P
K
G
-
R
L
R
V
E
T
A
-
S
-
A
F
A
N
L
V
I
I
P
A
L
P
E
F
H
K
K
Y
P
D
I
Q
I
D
L
G
---
V
-
S
D
--
R
--
T
----
Y
L
---
A
E
-
N
V
D
C
A
I
R
A
---
G
T
L
T
---
D
-
Q
S
L
I
A
R
R
I
-
T
E
M
K
-
F
V
A
C
A
S
R
D
F
--
L
-
E
R
-
H
P
V
---
P
Q
H
P
S
D
L
E
-
K
N
C
Y
V
V
G
Y
F
L
P
--
K
---
Q
Q
M
P
F
H
F
R
R
G
N
E
E
I
E
V
-
S
G
R
Y
T
M
-
A
A
-
N
E
S
-
T
T
-
Y
L
A
A
A
R
A
-
G
L
G
V
I
Q
A
P
L
F
M
-
V
R
E
D
L
R
N
G
T
M
V
P
-
V
L
P
D
W
-
Q
-
V
E
--
P
-
M
P
I
Y
L
V
Y
P
P
N
R
H
L
S
S
R
L
-
R
V
F
A
D
W
V
V
K
V
M
A
Q
S
Q
N
------
49
Fugue
62.85
15%
-84
- C4 -
2ESN
-
?
A:
[3-303]
PLLR
R
L
D
L
N
L
L
L
V
F
D
A
L
Y
R
H
R
N
V
G
T
A
A
S
E
L
A
I
S
A
S
A
F
S
H
A
L
G
R
L
R
Q
G
L
D
D
E
L
F
L
R
Q
G
N
R
M
Q
P
T
Q
R
A
E
H
L
A
A
A
V
A
A
A
L
R
-
A
L
G
E
G
L
E
E
W
R
P
F
V
-
P
G
Q
S
Q
R
T
F
V
F
A
A
T
-
D
-
Y
T
A
F
A
L
L
P
P
L
M
N
R
L
Q
H
S
A
P
G
V
R
L
R
L
V
NAE
R
-
K
L
--
S
--
V
E
A
--
L
A
---
S
G
-
R
I
D
F
A
L
G
Y
D
E
E
H
E
R
L
---
P
-
E
G
I
Q
A
H
D
W
-
F
A
D
R
-
Y
V
V
V
A
R
R
D
H
PR
L
A
G
A
-
P
T
L
E
-
G
Y
L
A
E
R
H
A
V
-
V
T
P
W
N
E
D
S
G
V
I
--
D
R
-
L
L
A
R
S
-----
G
L
R
R
E
V
A
-
V
Q
L
P
T
-------
V
-
L
A
-
A
L
F
L
A
G
S
-
T
D
F
L
L
T
A
P
R
H
A
-
A
R
A
L
A
E
A
A
G
L
A
L
-
Y
P
A
P
F
-
D
-
I
P
--
P
-
Y
V
L
R
L
Y
S
H
V
Q
G
-------
R
D
A
H
A
W
M
I
G
Q
L
K
G
L
D
-------
27
HHSearch
62.61
16%
-88
- C4 -
2ESN
-
?
A:
[7-303]
----
R
L
D
L
N
L
L
L
V
F
D
A
L
Y
R
H
R
N
V
G
T
A
A
S
E
L
A
I
S
A
S
A
F
S
H
A
L
G
R
L
R
Q
G
L
D
D
E
L
F
L
R
Q
G
N
R
M
Q
P
T
Q
R
A
E
H
L
A
A
A
V
A
A
A
L
R
-
A
L
G
E
G
L
E
E
W
R
P
F
V
P
G
Q
S
Q
R
-
T
F
V
F
A
A
T
-
D
-
Y
T
A
F
A
L
L
P
P
L
M
N
R
L
Q
H
S
A
P
G
V
R
L
R
L
V
---
N
-
A
E
--
R
KL
S
V
E
A
-
L
A
---
S
G
-
R
I
D
F
A
L
G
Y
---
D
E
E
H
ERL
P
-
E
G
I
Q
A
H
D
W
-
F
A
D
R
-
Y
V
V
V
A
R
R
D
H
--
P
R
L
A
-
G
-
A
P
-
T
L
E
G
Y
L
A
E
R
-
H
A
V
V
T
P
W
N
E
D
S
--
G
V
--
I
D
R
L
-----
L
-
A
R
S
G
L
-
R
R
E
V
A
V
-
Q
L
-
P
T
V
-
L
A
-
A
L
F
L
A
G
S
-
T
D
F
L
L
T
A
P
R
H
A
-
A
R
A
L
A
E
A
A
G
L
A
L
-
Y
P
A
P
F
-
D
-
I
P
--
P
-
Y
V
L
R
L
Y
S
H
V
Q
--
G
R
D
A
H
-
A
W
M
I
G
Q
L
K
G
L
D
-----------
46
Fugue
61.33
16%
-74
- C4 -
1IZ1
-
?
A:
[1-292]
-----
M
E
F
R
Q
L
K
Y
F
I
A
V
A
E
A
G
N
M
A
A
A
A
K
R
L
H
V
S
Q
P
P
I
T
R
Q
M
Q
A
L
E
A
D
L
G
V
V
L
L
E
R
S
H
R
G
I
E
L
T
A
A
G
H
A
F
L
E
D
A
R
R
I
L
E
-
L
A
G
R
S
G
D
R
S
R
A
A
A
-
R
G
D
V
G
-
E
L
S
V
A
Y
F
-
G
-
T
P
I
Y
R
S
L
P
L
L
L
R
A
F
L
T
S
T
P
T
A
T
V
S
L
T
H
M
T
K
-
D
E
--
Q
--
V
E
G
--
L
L
---
A
G
-
T
I
H
V
G
F
S
R
---
F
F
P
R
---
H
-
P
G
I
E
I
V
N
I
-
A
Q
E
D
-
L
Y
L
A
V
H
R
S
Q
--
S
G
K
F
-
G
K
T
C
-
K
L
A
D
L
R
A
V
E
-
L
T
L
F
P
R
G
G
R
P
S
--
F
A
-
D
E
V
I
G
-----
L
F
K
H
A
G
I
-
E
P
R
I
A
R
-
V
V
-
E
D
A
-
T
A
-
A
L
A
L
T
M
A
-
G
A
A
S
S
I
V
P
A
S
V
-
A
A
I
R
W
P
D
I
A
F
A
R
-
I
V
G
T
R
-
V
-
K
V
--
P
-
I
S
C
I
F
R
K
E
K
Q
P
P
I
L
A
R
F
-
V
E
H
V
R
R
S
A
--------------
51
Fugue
54.73
16%
-111
- C4 -
3KOS
9
AMPR_CITFR
A:
[11-210]
------------------------------------------------------------------------------------------------
Q
E
-
K
L
K
I
G
V
V
-
G
-
T
F
A
I
G
C
L
F
P
L
L
S
D
F
K
R
S
Y
P
H
I
D
L
H
I
S
---
T
-
H
N
--
N
--
R
V
D
--
P
A
---
A
E
-
G
L
D
Y
T
I
R
Y
---
G
G
G
A
---
W
-
H
D
T
D
A
Q
Y
L
-
C
S
A
L
M
S
P
L
C
S
P
T
L
A
-------
S
Q
I
Q
-
T
P
A
D
I
L
K
F
P
-
L
L
R
S
Y
R
R
D
E
W
A
--
L
W
M
Q
T
V
G
E
-----
A
----
P
P
-
S
P
T
H
N
V
M
V
F
-
D
S
S
-
V
T
M
L
E
A
A
Q
A
G
M
G
V
A
I
A
---
P
V
R
M
F
T
H
L
L
S
S
E
R
I
V
Q
-
P
F
L
---
T
-
Q
I
--
D
-
L
G
S
Y
W
I
T
R
L
Q
S
R
P
E
T
P
A
M
R
E
F
S
R
W
L
T
G
V
L
H
K
T
--------
8
PsiBlast_PDB
53.54
31%
-137
- C3 -
3FXU
5
TSAR_COMTE
A:
[1-87]
----
M
L
K
L
Q
T
L
Q
A
L
I
C
I
E
E
V
G
S
L
R
A
A
A
Q
L
L
H
L
S
Q
P
A
L
S
A
A
I
Q
Q
L
E
D
E
L
K
A
P
L
L
V
R
T
K
R
G
V
S
L
T
S
F
G
Q
A
F
M
K
H
A
R
L
I
V
T
-
E
S
R
R
A
Q
E
E
I
G
Q
L
R
-
G
R
W
E
G
-
H
I
T
F
A
A
S
-
P
-
A
I
A
L
A
A
L
P
L
A
L
A
S
F
A
R
E
F
P
D
V
T
V
N
V
R
---
D
-
G
M
--
Y
--
P
A
V
--
S
P
---
Q
L
-
R
D
G
T
L
D
F
A
---
L
T
A
A
---
H
-
K
H
D
I
D
T
D
L
-
E
A
Q
P
-
L
Y
V
S
D
V
V
I
V
--
G
Q
R
Q
-
H
P
M
A
-
N
A
T
R
L
A
E
L
Q
-
E
C
R
W
A
F
S
S
A
P
R
--
G
P
-
G
A
I
I
R
-----
N
A
F
A
R
Y
G
-
L
P
E
P
K
L
-
G
L
-
V
C
E
-
S
F
-
L
A
L
P
G
V
V
-
A
H
S
D
L
L
T
T
M
P
R
-
T
L
Y
E
R
N
A
F
K
D
Q
L
-
C
S
I
P
L
-
Q
-
D
A
--
L
-
P
N
P
T
I
Y
V
L
R
R
H
D
L
P
V
T
P
-
A
A
A
G
L
I
R
W
I
Q
H
H
A
L
--------
53
Fugue
53.19
16%
-96
- C4 -
4JVC
2
?
A:
[1-203]
---------------------------------------------------------------------------------------------------
N
L
R
V
L
L
D
-
T
-
A
I
P
P
S
F
C
D
T
V
S
S
V
L
L
D
D
F
N
M
V
S
L
I
R
T
---
S
-
P
A
--
D
--
S
L
A
--
T
I
K
QD
N
A
-
E
I
D
I
A
I
T
I
---
D
E
E
L
---
K
I
S
R
F
N
Q
C
V
L
-
G
Y
T
K
-
A
F
V
V
A
H
P
Q
H
--
P
L
C
N
-
A
S
L
H
-
S
I
A
S
L
A
N
Y
R
-
Q
I
S
L
G
S
R
-----------
S
G
Q
-----
H
S
N
L
L
R
P
-
V
S
D
K
V
L
-
F
V
-
E
N
F
-
D
D
-
M
L
R
L
V
E
A
-
G
V
G
W
G
I
A
P
H
Y
F
-
V
E
E
R
L
R
N
G
T
L
A
V
-
L
S
E
L
Y
-
E
-
P
G
G
I
D
-
T
K
V
Y
C
Y
Y
N
T
A
L
E
S
E
R
S
F
-
L
R
F
L
E
S
A
R
Q
R
L
R
E
L
G
-------
7
PsiBlast_PDB
53.17
31%
-134
- C3 -
3FXR
3
TSAR_COMTE
A:
[1-87]
----
M
L
K
L
Q
T
L
Q
A
L
I
C
I
E
E
V
G
S
L
R
A
A
A
Q
L
L
H
L
S
Q
P
A
L
S
A
A
I
Q
Q
L
E
D
E
L
K
A
P
L
L
V
R
T
K
R
G
V
S
L
T
S
F
G
Q
A
F
M
K
H
A
R
L
I
V
T
-
E
S
R
R
A
Q
E
E
I
G
Q
L
R
-
G
R
W
E
G
-
H
I
T
F
A
A
S
-
P
-
A
I
A
L
A
A
L
P
L
A
L
A
S
F
A
R
E
F
P
D
V
T
V
N
V
R
---
D
-
G
M
--
Y
--
P
A
V
--
S
P
---
Q
L
-
R
D
G
T
L
D
F
A
---
L
T
A
A
---
H
-
K
H
D
I
D
T
D
L
-
E
A
Q
P
-
L
Y
V
S
D
V
V
I
V
--
G
Q
R
Q
-
H
P
M
A
-
N
A
T
R
L
A
E
L
Q
-
E
C
R
W
A
F
S
S
A
P
R
--
G
P
-
G
A
I
I
R
-----
N
A
F
A
R
Y
G
-
L
P
E
P
K
L
-
G
L
-
V
C
E
-
S
F
-
L
A
L
P
G
V
V
-
A
H
S
D
L
L
T
T
M
P
R
-
T
L
Y
E
R
N
A
F
K
D
Q
L
-
C
S
I
P
L
-
Q
-
D
A
--
L
-
P
N
P
T
I
Y
V
L
R
R
H
D
L
P
V
T
P
-
A
A
A
G
L
I
R
W
I
Q
H
H
A
L
--------