@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 : spr1682: (2018-01-17 )
MTTLFSKIKEVTELAAVSGHEAPVRAYLREKLTPHVDEVVTDGLGGIFGIKHSEAVDAPRVLVASHMDEVGFMVSEIKPDGTFRVVEIGGWNPMVVSSQRFKLLTRDGHEIPVISGSVPPHLTRGKGGPTMPAIADIVFDGGFADKAEAESFGIRPGDTIVPDSSAILTANEKNIISKAWDNRYGVLMVSELAEALSGQKLGNELYLGSNVQEEVGLRGAHTSTTKFDPEVFLAVDCSPAGDVYGGQGKIGDGTLIRFYDPGHLLLPGMKDFLLTTAEEAGIKYQYYCGKGGTDAGAAHLKNGGVPSTTIGVCARYIHSHQTLYAMDDFLEAQAFLQALVKKLDRSTVDLIKHY
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.......310.......320.......330.......340.......350..
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
M
T
T
L
F
S
K
I
K
E
V
T
E
L
A
A
VSGH
E
-
A
-
P
V
R
A
Y
L
R
E
KLT
P
H
V
D
E
V
V
T
DGLG
G
I
FGIKHSEAVDA
P
R
V
L
V
A
S
H
M
D
E
V
G
F
M
V
S
EIKPDG
T
F
R
V
V
E
IGGWN
P
M
V
VSS
Q
R
F
K
L
L
TRDGHEI
P
V
ISGSVPPHLTRGKGGPTMP
A
I
A
D
-
I
V
FDGGFADKAE
A
E
SFGIRPGD-TIVPDS
S
A
I
L
TANE
K
N
I
I
S
K
A
WDNRY
G
V
L
M
V
S
E
L
A
E
A
LSGQ--KLG--NELYLGSN
V
Q
E
E
VGLRGAHTSTTKFDP
E
V
F
L
A
V
D----CSP-AGDVY--G-----G----QG-----KI----GD
G
T
L
I
R
F
YD----PG
H
L
LLPG
M
K
D
F
L
L
T
T
A
E
EA
G
I
K
Y
Q
Y
-
Y
C-G--K-GG-TDA
G
--
A
A
H
LKNGGVP
S
T
T
I
G
V
C
A
R
Y
I
H
SH
Q
T
L
Y
A
M
D
D
F
L
E
A
Q
A
F
L
Q
A
L
V
K
K
L
D
R
S
T
V
D
L
I
KHY
54
HHSearch
91.52
100%
-75
- C2 -
-
3KL9
-
?
E:
[2-355]
M
T
T
L
F
S
K
I
K
E
V
T
E
L
A
A
V
S
G
H
E
-
A
-
P
V
R
A
Y
L
R
E
K
L
T
P
H
V
D
E
V
V
T
D
G
L
G
G
I
F
G
I
K
H
S
E
A
V
D
A
P
R
V
L
V
A
S
H
M
D
E
V
G
F
M
V
S
E
I
K
P
D
G
T
F
R
V
V
E
I
G
G
W
N
P
M
V
V
S
S
Q
R
F
K
L
L
T
R
D
G
H
E
I
P
V
I
S
G
---------------
P
A
I
A
D
-
I
V
F
D
G
G
F
A
D
K
A
E
A
E
S
F
G
I
R
P
G
D
-
T
I
V
P
D
S
S
A
I
L
T
A
N
E
K
N
I
I
S
K
A
W
D
N
R
Y
G
V
L
M
V
S
E
L
A
E
A
L
S
G
Q
--
K
L
G
--
N
E
L
Y
L
G
S
N
V
Q
E
E
V
G
L
R
G
A
H
T
S
T
T
K
F
D
P
E
V
F
L
A
V
D
----
C
S
P
-
A
G
D
V
Y
--
G
-----
G
----
Q
G
-----
K
I
----
G
D
G
T
L
I
R
F
Y
D
----
P
G
H
L
L
L
P
G
M
K
D
F
L
L
T
T
A
E
E
A
G
I
K
Y
Q
Y
-
Y
C
-
G
--
K
-
G
G
-
T
D
A
G
--
A
A
H
L
K
N
G
G
V
P
S
T
T
I
G
V
C
A
R
Y
I
H
S
H
Q
T
L
Y
A
M
D
D
F
L
E
A
Q
A
F
L
Q
A
L
V
K
K
L
D
R
S
T
V
D
L
I
K
H
Y
1
PsiBlast_PDB
90.45
100%
-72
- C2 -
-
3KL9
-
?
A:
[2-355]
M
T
T
L
F
S
K
I
K
E
V
T
E
L
A
A
V
S
G
H
E
-
A
-
P
V
R
A
Y
L
R
E
K
L
T
P
H
V
D
E
V
V
T
D
G
L
G
G
I
F
G
I
K
H
S
E
A
V
D
A
P
R
V
L
V
A
S
H
M
D
E
V
G
F
M
V
S
E
I
K
P
D
G
T
F
R
V
V
E
I
G
G
W
N
P
M
V
V
S
S
Q
R
F
K
L
L
T
R
D
G
H
E
I
P
V
I
S
G
---------------
P
A
I
A
D
-
I
V
F
D
G
G
F
A
D
K
A
E
A
E
S
F
G
I
R
P
G
D
-
T
I
V
P
D
S
S
A
I
L
T
A
N
E
K
N
I
I
S
K
A
W
D
N
R
Y
G
V
L
M
V
S
E
L
A
E
A
L
S
G
Q
--
K
L
G
--
N
E
L
Y
L
G
S
N
V
Q
E
E
V
G
L
R
G
A
H
T
S
T
T
K
F
D
P
E
V
F
L
A
V
D
----
C
S
P
-
A
G
D
V
Y
--
G
-----
G
----
Q
G
-----
K
I
----
G
D
G
T
L
I
R
F
Y
D
----
P
G
H
L
L
L
P
G
M
K
D
F
L
L
T
T
A
E
E
A
G
I
K
Y
Q
Y
-
Y
C
-
G
--
K
-
G
G
-
T
D
A
G
--
A
A
H
L
K
N
G
G
V
P
S
T
T
I
G
V
C
A
R
Y
I
H
S
H
Q
T
L
Y
A
M
D
D
F
L
E
A
Q
A
F
L
Q
A
L
V
K
K
L
D
R
S
T
V
D
L
I
K
H
Y
55
HHSearch
88.83
100%
-73
- C2 -
-
3KL9
-
?
G:
[4-355]
--
T
L
F
S
K
I
K
E
V
T
E
L
A
A
V
S
G
H
E
-
A
-
P
V
R
A
Y
L
R
E
K
L
T
P
H
V
D
E
V
V
T
D
G
L
G
G
I
F
G
I
K
H
S
E
A
V
D
A
P
R
V
L
V
A
S
H
M
D
E
V
G
F
M
V
S
E
I
K
P
D
G
T
F
R
V
V
E
I
G
G
W
N
P
M
V
V
S
S
Q
R
F
K
L
L
T
R
D
G
H
E
I
P
V
I
S
G
---------------
P
A
I
A
D
-
I
V
F
D
G
G
F
A
D
K
A
E
A
E
S
F
G
I
R
P
G
D
-
T
I
V
P
D
S
S
A
I
L
T
A
N
E
K
N
I
I
S
K
A
W
D
N
R
Y
G
V
L
M
V
S
E
L
A
E
A
L
S
G
Q
--
K
L
G
--
N
E
L
Y
L
G
S
N
V
Q
E
E
V
G
L
R
G
A
H
T
S
T
T
K
F
D
P
E
V
F
L
A
V
D
----
C
S
P
-
A
G
D
V
Y
--
G
-----
G
----
Q
G
-----
K
I
----
G
D
G
T
L
I
R
F
Y
D
----
P
G
H
L
L
L
P
G
M
K
D
F
L
L
T
T
A
E
E
A
G
I
K
Y
Q
Y
-
Y
C
-
G
--
K
-
G
G
-
T
D
A
G
--
A
A
H
L
K
N
G
G
V
P
S
T
T
I
G
V
C
A
R
Y
I
H
S
H
Q
T
L
Y
A
M
D
D
F
L
E
A
Q
A
F
L
Q
A
L
V
K
K
L
D
R
S
T
V
D
L
I
K
H
Y
56
HHSearch
71.86
38%
-47
- C2 -
-
1VHE
-
YSDC_BACSU
A:
[7-358]
-
D
E
T
L
T
M
L
K
D
L
T
D
A
K
G
I
P
G
N
E
-
R
-
E
V
R
Q
V
M
K
S
Y
I
E
P
F
A
D
E
V
T
T
D
R
L
G
S
L
I
A
K
K
T
G
A
E
-
N
G
P
K
I
M
I
A
G
H
L
D
E
V
G
F
M
V
T
Q
I
T
D
K
G
F
I
R
F
Q
T
V
G
G
W
W
A
Q
V
M
L
A
Q
R
V
T
I
V
T
K
K
G
-
E
I
T
G
V
I
G
S
K
P
P
H
I
L
S
P
E
A
R
K
K
S
V
E
I
K
D
-
M
F
I
D
I
G
A
S
S
R
E
E
A
L
E
W
G
V
L
P
G
D
-
M
I
V
P
H
F
E
F
T
V
M
N
N
E
K
F
L
L
A
K
A
W
D
N
R
I
G
C
A
I
A
I
D
V
L
R
N
L
Q
N
T
--
D
H
P
--
N
I
V
Y
G
V
G
T
V
Q
E
E
V
G
L
R
G
A
K
T
A
A
H
T
I
Q
P
D
I
A
F
G
V
D
----
V
G
I
-
A
G
D
T
P
GI
S
EKE--
A
----
Q
S
-----
K
M
----
G
K
G
P
Q
I
I
V
Y
D
----
A
S
M
V
S
H
K
G
L
R
D
A
V
V
A
T
A
E
E
A
G
I
P
Y
Q
F
-
D
A
-
I
--
A
G
G
G
-
T
D
S
G
--
A
I
H
L
T
A
N
G
V
P
A
L
S
I
T
I
A
T
R
Y
I
H
T
H
A
A
M
L
H
R
D
D
Y
E
N
A
V
K
L
I
T
E
V
I
K
K
L
D
R
K
T
V
D
-----
5
PsiBlast_PDB
69.70
35%
-48
- C2 -
-
5DS0
1
?
A:
[11-356]
--------
K
T
L
M
E
A
F
G
P
S
G
F
E
-
R
-
E
V
N
A
I
C
K
E
Y
M
E
P
Y
A
D
E
V
V
V
D
K
L
G
S
V
T
F
I
--
A
K
G
N
D
R
P
R
I
L
M
A
G
H
T
D
E
V
G
F
I
V
S
S
I
S
K
E
G
Y
L
T
F
N
T
L
G
G
W
W
S
Q
V
L
L
G
Q
R
V
V
V
R
T
C
K
G
M
V
H
G
I
I
A
-
S
K
P
P
H
I
L
P
P
D
E
R
K
K
I
V
E
A
R
D
-
M
F
I
D
I
G
A
T
S
E
E
E
A
E
E
S
G
V
K
V
G
D
-
P
I
V
P
W
S
P
F
S
V
I
Q
N
G
R
V
A
M
G
K
A
F
D
D
R
I
G
A
F
V
L
M
E
A
I
R
R
M
K
D
Q
--
G
I
E
HP
N
T
V
Y
G
S
A
T
V
Q
E
E
V
G
L
R
G
A
Q
T
T
A
H
V
V
D
P
D
V
A
L
V
L
E
----
V
D
I
-
A
G
D
V
P
---KPHE-
A
----
L
T
-----
K
M
----
G
K
G
P
G
L
V
T
Y
D
----
R
S
M
I
P
N
Q
P
L
K
E
F
V
I
N
V
A
K
Q
A
Q
I
P
L
Q
L
S
Q
M
-
S
--
G
-
G
G
-
T
D
A
G
--
R
I
H
M
N
R
A
G
C
P
S
V
V
I
T
I
P
T
R
H
I
H
S
H
V
G
L
L
S
L
K
D
T
E
N
A
I
R
L
V
I
E
L
I
K
R
L
D
L
E
T
V
E
-----
2
PsiBlast_PDB
69.62
37%
-48
- C2 -
-
1VHE
-
YSDC_BACSU
A:
[10-362]
----
L
T
M
L
K
D
L
T
D
A
K
G
I
P
G
N
E
-
R
-
E
V
R
Q
V
M
K
S
Y
I
E
P
F
A
D
E
V
T
T
D
R
L
G
S
L
I
A
-
K
K
T
G
A
E
N
G
P
K
I
M
I
A
G
H
L
D
E
V
G
F
M
V
T
Q
I
T
D
K
G
F
I
R
F
Q
T
V
G
G
W
W
A
Q
V
M
L
A
Q
R
V
T
I
V
T
K
K
G
-
E
I
T
G
V
I
G
S
K
P
P
H
I
L
S
P
E
A
R
K
K
S
V
E
I
K
D
-
M
F
I
D
I
G
A
S
S
R
E
E
A
L
E
W
G
V
L
P
G
D
-
M
I
V
P
H
F
E
F
T
V
M
N
N
E
K
F
L
L
A
K
A
W
D
N
R
I
G
C
A
I
A
I
D
V
L
R
N
L
Q
N
T
--
D
H
P
--
N
I
V
Y
G
V
G
T
V
Q
E
E
V
G
L
R
G
A
K
T
A
A
H
T
I
Q
P
D
I
A
F
G
V
D
----
V
G
I
-
A
G
D
T
P
--
G
ISEKE
A
----
Q
S
-----
K
M
----
G
K
G
P
Q
I
I
V
Y
D
----
A
S
M
V
S
H
K
G
L
R
D
A
V
V
A
T
A
E
E
A
G
I
P
Y
Q
F
D
A
I
-
A
--
G
-
G
G
-
T
D
S
G
--
A
I
H
L
T
A
N
G
V
P
A
L
S
I
T
I
A
T
R
Y
I
H
T
H
A
A
M
L
H
R
D
D
Y
E
N
A
V
K
L
I
T
E
V
I
K
K
L
D
R
K
T
V
D
E
I
T
Y
-
57
HHSearch
68.59
36%
-46
- C2 -
-
5DS0
17
?
C:
[3-355]
A
D
K
S
M
E
L
M
K
T
L
M
E
A
F
G
P
S
G
F
E
-
R
-
E
V
N
A
I
C
K
E
Y
M
E
P
Y
A
D
E
V
V
V
D
K
L
G
S
V
T
F
I
A
K
G
N
--
D
R
P
R
I
L
M
A
G
H
T
D
E
V
G
F
I
V
S
S
I
S
K
E
G
Y
L
T
F
N
T
L
G
G
W
W
S
Q
V
L
L
G
Q
R
V
V
V
R
T
C
K
G
-
M
V
H
G
I
I
A
S
K
P
P
H
I
L
P
P
D
E
R
K
K
I
V
E
A
R
D
-
M
F
I
D
I
G
A
T
S
E
E
E
A
E
E
S
G
V
K
V
G
D
-
P
I
V
P
W
S
P
F
S
V
I
Q
N
G
R
V
A
M
G
K
A
F
D
D
R
I
G
A
F
V
L
M
E
A
I
R
R
M
K
D
Q
GI
E
H
P
--
N
T
V
Y
G
S
A
T
V
Q
E
E
V
G
L
R
G
A
Q
T
T
A
H
V
V
D
P
D
V
A
L
V
L
E
----
V
D
I
-
A
G
D
V
P
GI
K
PHE--
A
----
L
T
-----
K
M
----
G
K
G
P
G
L
V
T
Y
D
----
R
S
M
I
P
N
Q
P
L
K
E
F
V
I
N
V
A
K
Q
A
Q
I
P
L
Q
L
-
S
Q
M
S
--
G
-
G
G
-
T
D
A
G
R
I
H
M
N
--
R
A
G
C
P
S
V
V
I
T
I
P
T
R
H
I
H
S
H
V
G
L
L
S
L
K
D
T
E
N
A
I
R
L
V
I
E
L
I
K
R
L
D
L
E
T
V
------
4
PsiBlast_PDB
68.31
34%
-49
- C2 -
-
4WWV
-
?
A:
[13-363]
-------
I
K
K
L
T
S
L
H
A
P
S
G
R
E
-
D
-
P
V
K
D
L
V
A
E
L
M
K
S
H
V
D
K
L
W
I
D
V
W
G
N
V
V
G
Y
R
K
G
S
K
-
G
S
G
K
I
M
I
A
A
H
M
D
E
I
G
L
F
I
S
H
I
E
D
D
G
F
L
R
V
I
P
I
G
G
V
L
E
R
T
L
L
Y
Q
R
V
V
V
R
T
R
D
G
R
L
Y
R
G
V
I
G
L
K
P
P
H
V
----
E
A
Q
K
V
P
E
L
R
E
-
L
F
I
D
V
G
A
S
S
K
E
E
V
E
K
M
G
I
R
V
G
D
-
I
A
V
F
D
R
E
-
V
A
E
L
G
W
N
R
I
T
S
K
A
F
D
D
R
V
G
V
V
V
M
L
K
A
L
E
M
L
--
E
--
K
H
D
--
V
D
V
Y
L
V
A
T
V
Q
E
E
V
G
L
K
G
A
K
T
S
A
Y
G
I
S
P
D
V
A
L
A
I
D
----
V
T
I
-
A
S
D
V
P
--
G
-----
V
----
A
K
SEWFT
R
L
----
G
Y
G
P
A
I
K
I
V
D
GRNA
G
G
L
I
A
H
P
K
V
G
E
F
L
V
S
I
A
E
K
K
R
I
P
Y
Q
L
-
D
V
-
I
--
S
-
G
G
T
T
D
A
S
--
T
I
A
L
N
K
E
G
V
A
A
G
T
I
S
I
P
S
R
Y
I
H
S
P
V
E
V
V
D
L
R
D
L
Y
N
A
S
L
L
A
K
A
F
I
E
E
A
T
P
E
W
I
Q
S
I
K
--
6
PsiBlast_PDB
68.20
30%
-69
- C2 -
-
1YLO
-
?
A:
[6-341]
----
L
S
L
L
K
A
L
S
E
A
D
A
I
A
S
S
E
-
Q
-
E
V
R
Q
I
L
L
E
E
A
A
R
L
Q
K
E
V
R
F
D
G
L
G
S
V
L
-
I
R
L
N
E
S
T
-
G
P
K
V
M
I
C
A
H
M
D
E
V
G
F
M
V
R
S
I
S
R
E
G
A
I
D
V
L
P
V
G
N
V
R
M
A
A
R
Q
L
Q
P
V
R
I
T
T
R
E
E
C
K
I
P
G
L
-------
L
D
G
D
R
Q
G
N
D
V
S
A
M
R
----
V
D
I
G
A
R
T
Y
D
E
V
M
Q
A
G
I
R
P
G
D
-
R
V
T
F
D
T
T
F
Q
V
L
P
H
Q
R
-
V
M
G
K
A
F
D
D
R
L
S
C
Y
L
L
V
T
L
L
R
E
L
H
D
A
--
E
L
P
--
A
E
V
W
L
V
A
S
S
S
E
E
V
G
L
R
G
G
Q
T
A
T
R
A
V
S
P
D
V
A
I
V
L
D
T
A
--
C
W
A
-
K
N
F
D
Y
--
G
-----
A
----
A
N
HR---
Q
I
----
G
N
G
P
M
L
V
L
S
D
----
K
S
L
I
A
P
P
K
L
T
A
W
I
E
T
V
A
A
E
I
G
V
P
L
Q
A
D
M
F
-
S
--
N
-
G
G
-
T
D
G
G
--
A
V
H
L
T
G
T
G
V
P
T
L
V
M
G
P
A
T
R
H
G
H
C
A
A
S
I
A
D
C
R
D
I
L
Q
M
E
Q
L
L
S
A
L
I
Q
R
L
T
R
E
T
V
------
62
HHSearch
67.97
25%
-94
- C2 -
-
2WYR
-
?
J:
[2-331]
-
M
S
M
I
E
K
L
K
K
F
T
Q
I
P
G
I
S
G
Y
E
-
E
-
R
I
R
E
E
I
I
R
E
I
K
D
F
A
-
D
Y
K
V
D
A
I
G
N
L
I
V
E
L
G
E
---
G
E
E
R
I
L
F
M
A
H
M
D
E
I
G
L
L
I
T
G
I
T
D
E
G
K
L
R
F
R
K
V
G
G
I
D
D
R
L
L
Y
G
R
H
V
N
V
V
T
E
K
G
-
I
L
D
G
V
I
G
A
T
P
P
H
L
------
K
S
V
I
P
W
Y
D
-
L
V
I
D
I
G
A
E
S
K
E
E
A
L
E
L
-
V
K
P
L
D
-
F
A
V
F
K
K
H
F
S
V
L
N
-
G
K
Y
V
S
T
R
G
L
D
D
R
F
G
V
V
A
L
I
E
A
I
K
D
L
V
D
H
--
E
L
E
--
G
K
V
I
F
A
F
T
V
Q
E
E
V
G
L
K
G
A
K
F
L
A
N
H
Y
Y
P
Q
Y
A
F
A
I
D
----
S
F
A
-
C
C
S
P
L
--
T
-----
G
----
D
V
-----
K
L
----
G
K
G
P
V
I
R
A
V
D
----
N
S
A
I
Y
S
R
D
L
A
R
K
V
W
S
I
A
E
K
N
G
I
E
I
Q
I
-
G
V
-
T
--
G
-
G
G
-
T
D
A
S
--
A
F
Q
--
D
-
R
S
K
T
L
A
L
S
V
P
I
K
Y
L
H
S
E
V
E
T
L
H
L
N
D
L
E
K
L
V
K
L
I
E
A
L
A
F
E
------------
59
HHSearch
66.77
30%
-62
- C2 -
-
1YLO
-
?
D:
[3-342]
-
A
M
D
L
S
L
L
K
A
L
S
E
A
D
A
I
A
S
S
E
-
Q
-
E
V
R
Q
I
L
L
E
E
A
A
R
L
Q
K
E
V
R
F
D
G
L
G
S
V
L
I
R
L
N
E
S
--
T
G
P
K
V
M
I
C
A
H
M
D
E
V
G
F
M
V
R
S
I
S
R
E
G
A
I
D
V
L
P
V
G
N
V
R
M
A
A
R
Q
L
Q
P
V
R
I
T
T
R
E
E
C
K
I
P
G
L
L
D
G
---------
D
R
-
Q
G
N
D
V
S
A
-
M
R
V
D
I
G
A
R
T
Y
D
E
V
M
Q
A
G
I
R
P
G
D
-
R
V
T
F
D
T
T
F
Q
V
L
P
-
H
Q
R
V
M
G
K
A
F
D
D
R
L
S
C
Y
L
L
V
T
L
L
R
E
L
H
D
A
--
E
L
P
--
A
E
V
W
L
V
A
S
S
S
E
E
V
G
L
R
G
G
Q
T
A
T
R
A
V
S
P
D
V
A
I
V
L
D
----
T
A
C
-
W
A
K
N
F
DY
G
AA---
N
----
H
R
-----
Q
I
----
G
N
G
P
M
L
V
L
S
D
----
K
S
L
I
A
P
P
K
L
T
A
W
I
E
T
V
A
A
E
I
G
V
P
L
Q
A
-
D
M
-
F
--
S
N
G
G
-
T
D
G
G
--
A
V
H
L
T
G
T
G
V
P
T
L
V
M
G
P
A
T
R
H
G
H
C
A
A
S
I
A
D
C
R
D
I
L
Q
M
E
Q
L
L
S
A
L
I
Q
R
L
T
R
E
T
V
V
-----
63
HHSearch
66.37
25%
-98
- C2 -
-
2CF4
-
?
A:
[3-331]
--
S
M
I
E
K
L
K
K
F
T
Q
I
P
G
I
S
G
Y
E
-
E
-
R
I
R
E
E
I
I
R
E
I
K
D
F
A
-
D
Y
K
V
D
A
I
G
N
L
I
V
E
L
G
E
---
G
E
E
R
I
L
F
M
A
H
M
D
E
I
G
L
L
I
T
G
I
T
D
E
G
K
L
R
F
R
K
V
G
G
I
D
D
R
L
L
Y
G
R
H
V
N
V
V
T
E
K
G
-
I
L
D
G
V
I
G
A
T
P
P
H
L
S
L
E
R
-
D
K
S
V
I
P
W
Y
D
-
L
V
I
D
I
G
A
E
S
K
E
E
A
L
E
L
-
V
K
P
L
D
-
F
A
V
F
K
K
H
F
S
V
L
N
-
G
K
Y
V
S
T
R
G
L
D
D
R
F
G
V
V
A
L
I
E
A
I
K
D
L
V
D
H
--
E
L
E
--
G
K
V
I
F
A
F
T
V
Q
E
E
V
G
L
K
G
A
K
F
L
A
N
H
Y
Y
P
Q
Y
A
F
A
I
D
----
S
F
A
-
C
C
S
P
L
--
T
-----
G
----
D
V
-----
K
L
----
G
K
G
P
V
I
R
A
V
D
----
N
S
A
I
Y
S
R
D
L
A
R
K
V
W
S
I
A
E
K
N
G
I
E
I
Q
I
-
G
V
-
T
--
G
-
G
G
-
T
D
A
S
--
A
F
Q
--
D
-
R
S
K
T
L
A
L
S
V
P
I
K
Y
L
H
S
E
V
E
T
L
H
L
N
D
L
E
K
L
V
K
L
I
E
A
L
A
F
E
------------
61
HHSearch
64.15
26%
-79
- C2 -
-
3ISX
3
?
A:
[12-342]
--
H
M
K
E
L
I
R
K
L
T
E
A
F
G
P
S
G
R
E
-
E
-
E
V
R
S
I
I
L
E
E
L
E
G
H
I
D
G
H
R
I
D
G
L
G
N
L
I
V
W
K
G
S
---
G
E
K
K
V
I
L
D
A
H
I
D
E
I
G
V
V
V
T
N
V
D
D
K
G
F
L
T
I
E
P
V
G
G
V
S
P
Y
M
L
L
G
K
R
I
R
F
E
N
G
----
T
I
G
V
V
G
M
E
G
E
T
T
E
E
R
Q
E
N
V
R
K
L
S
F
D
K
-
L
F
I
D
I
G
A
N
S
R
E
E
A
Q
K
M
-
C
P
I
G
S
-
F
G
V
Y
D
S
G
F
V
E
V
--
S
G
K
Y
V
S
K
A
M
D
D
R
I
G
C
A
V
I
V
E
V
F
K
R
I
K
-----
P
A
--
V
T
L
Y
G
V
F
S
V
Q
E
E
V
G
L
V
G
A
S
V
A
G
Y
G
V
P
A
D
E
A
I
A
I
D
----
V
T
D
-
S
A
D
T
P
--
K
AIKR-
H
----
A
M
-----
R
L
----
S
G
G
P
A
L
K
V
K
D
----
R
A
S
I
S
S
K
R
I
L
E
N
L
I
E
I
A
E
K
F
D
I
K
Y
Q
M
-
E
V
-
L
T-
F
-
G
G
-
T
N
A
M
--
G
Y
Q
R
T
R
E
G
I
P
S
A
T
V
S
I
P
T
R
Y
V
H
S
P
S
E
M
I
A
P
D
D
V
E
A
T
V
D
L
L
I
R
Y
L
G
-------------
12
PsiBlast_PDB
60.16
27%
-36
- C2 -
-
2CF4
-
?
A:
[3-332]
--
S
M
I
E
K
L
K
K
F
T
Q
I
P
G
I
S
G
Y
E
-
E
-
R
I
R
E
E
I
I
R
E
I
K
D
F
A
D
Y
K
V
-
D
A
I
G
N
L
I
-
V
E
L
G
E
G
--
E
E
R
I
L
F
M
A
H
M
D
E
I
G
L
L
I
T
G
I
T
D
E
G
K
L
R
F
R
K
V
G
G
I
D
D
R
L
L
Y
G
R
H
V
N
V
V
T
E
K
G
I
L
D
G
V
I
-
G
A
T
P
P
H
L
S
L
E
R
D
K
S
V
I
P
W
Y
-
D
-
L
V
I
D
I
G
A
E
S
K
E
E
A
L
E
L
-
V
K
P
L
D
F
A
V
F
K
K
H
F
S
V
L
--
N
G
K
Y
V
S
T
R
G
L
D
D
R
F
G
V
V
A
L
I
E
A
I
K
D
L
V
D
H
--
E
L
E
--
G
K
V
I
F
A
F
T
V
Q
E
E
V
G
L
K
G
A
K
F
L
A
N
H
Y
Y
P
Q
Y
A
F
A
I
D
S
F
A
C
C
S
P
L
T
G
D
V
---------------------
K
L
----
G
K
G
P
V
I
R
A
V
D
----
N
S
A
I
Y
S
R
D
L
A
R
K
V
W
S
I
A
E
K
N
G
I
E
I
Q
I
-
G
V
-
T
--
G
-
G
G
-
T
D
A
S
--
A
F
Q
D
R
S
---
K
T
L
A
L
S
V
P
I
K
Y
L
H
S
E
V
E
T
L
H
L
N
D
L
E
K
L
V
K
L
I
E
A
L
A
F
E
L
-----------
11
PsiBlast_PDB
60.00
27%
-30
- C2 -
-
2WYR
-
?
A:
[2-332]
-
M
S
M
I
E
K
L
K
K
F
T
Q
I
P
G
I
S
G
Y
E
-
E
-
R
I
R
E
E
I
I
R
E
I
K
D
F
A
D
Y
K
V
-
D
A
I
G
N
L
I
-
V
E
L
G
E
G
--
E
E
R
I
L
F
M
A
H
M
D
E
I
G
L
L
I
T
G
I
T
D
E
G
K
L
R
F
R
K
V
G
G
I
D
D
R
L
L
Y
G
R
H
V
N
V
V
T
E
K
G
I
L
D
G
V
I
-
G
A
T
P
P
H
L
-----
K
S
V
I
P
W
Y
-
D
-
L
V
I
D
I
G
A
E
S
K
E
E
A
L
E
L
-
V
K
P
L
D
F
A
V
F
K
K
H
F
S
V
L
--
N
G
K
Y
V
S
T
R
G
L
D
D
R
F
G
V
V
A
L
I
E
A
I
K
D
L
V
D
H
--
E
L
E
--
G
K
V
I
F
A
F
T
V
Q
E
E
V
G
L
K
G
A
K
F
L
A
N
H
Y
Y
P
Q
Y
A
F
A
I
D
S
F
A
C
C
S
P
L
T
G
D
V
---------------------
K
L
----
G
K
G
P
V
I
R
A
V
D
----
N
S
A
I
Y
S
R
D
L
A
R
K
V
W
S
I
A
E
K
N
G
I
E
I
Q
I
-
G
V
-
T
--
G
-
G
G
-
T
D
A
S
--
A
F
Q
D
R
S
---
K
T
L
A
L
S
V
P
I
K
Y
L
H
S
E
V
E
T
L
H
L
N
D
L
E
K
L
V
K
L
I
E
A
L
A
F
E
L
-----------
66
HHSearch
59.89
30%
-17
* C2 *
-
2WZN
2
?
A:
[8-350]
S
M
V
D
W
K
L
M
Q
E
I
I
E
A
P
G
V
S
G
Y
E
-
H
L
G
I
R
D
I
V
V
D
V
L
K
E
V
A
D
E
V
K
V
D
K
L
G
N
V
I
A
H
F
K
G
---
S
S
P
R
I
M
V
A
A
H
M
D
K
I
G
V
M
V
N
H
I
D
K
D
G
Y
L
H
I
V
P
I
G
G
V
L
P
E
T
L
V
A
Q
R
I
R
F
F
T
E
K
G
-
E
R
Y
G
V
V
G
V
L
P
P
H
L
R
--------
I
D
W
D
Q
-
I
V
V
D
V
G
A
S
S
K
E
E
A
E
E
M
G
F
R
V
G
T
-
V
G
E
F
A
P
N
F
T
R
L
N
-
E
H
R
F
A
T
P
Y
L
D
D
R
I
C
L
Y
A
M
I
E
A
A
R
Q
L
G
D
----
H
E
--
A
D
I
Y
I
V
G
S
V
Q
E
E
V
G
L
R
G
A
R
V
A
S
Y
A
I
N
P
E
V
G
I
A
M
D
----
V
T
F
-
A
K
Q
P
H
--
D
KGK--
I
----
V
P
-----
E
L
----
G
K
G
P
V
M
D
V
-
G
------
P
N
I
N
P
K
L
R
A
F
A
D
E
V
A
K
K
Y
E
I
P
L
Q
V
-
E
P
-
S
PR
P
-
T
G
-
T
D
A
N
--
V
M
Q
I
N
K
E
G
V
A
T
A
V
L
S
I
P
I
R
Y
M
H
S
Q
V
E
L
A
D
A
R
D
V
D
N
T
I
K
L
A
K
A
L
L
E
E
L
K
P
M
--------
72
HHSearch
59.47
24%
-69
- C2 -
-
1VHO
-
?
A:
[5-335]
-
M
E
T
G
K
L
L
M
E
L
S
N
L
D
G
P
S
G
Y
E
-
T
-
N
V
V
S
Y
I
K
S
V
I
E
P
F
V
D
E
A
K
T
T
R
H
G
S
L
I
G
Y
K
K
G
K
G
--
I
G
K
L
A
F
F
A
H
V
D
E
I
G
F
V
V
S
K
V
-
E
G
Q
F
A
R
L
E
P
V
--------
Y
A
S
K
V
R
I
Y
T
K
N
G
-
I
E
R
G
V
I
G
M
L
A
P
H
L
Q
D
S
E
S
R
K
K
V
P
T
Y
D
E
-
I
F
V
D
L
S
L
------
C
E
R
G
V
R
V
G
D
-
I
A
V
I
D
Q
T
A
F
E
-
T
-
N
G
K
V
V
G
K
A
L
D
N
R
A
S
C
G
V
L
V
K
V
L
E
F
L
K
R
Y
--
D
H
P
--
W
D
V
Y
V
V
F
S
V
Q
E
E
T
G
C
L
G
A
L
T
G
A
Y
E
I
N
P
D
A
A
I
V
M
D
----
V
T
F
-
A
S
E
P
P
F-
S
-----
D
----
H
I
-----
E
L
----
G
K
G
P
V
I
G
L
-------
G
P
V
V
D
R
N
L
V
Q
K
I
I
E
I
A
K
K
H
N
V
S
L
Q
E
-
E
A
-
V
GG
R
------
T
D
--
F
V
Q
L
V
R
N
G
V
R
T
S
L
I
S
I
P
L
K
Y
M
H
T
P
V
E
M
V
D
P
R
D
V
E
E
L
A
R
L
L
S
L
V
A
V
E
L
E
----------
67
HHSearch
57.80
30%
-65
- C2 -
-
2FVG
3
?
A:
[2-336]
-----
M
Y
L
K
E
L
S
M
M
P
G
V
S
G
D
E
-
G
-
K
V
R
D
F
I
K
S
K
I
E
G
L
V
D
N
L
Y
T
D
V
L
G
N
L
I
A
L
K
R
G
R
D
-
S
S
K
K
L
L
V
S
A
H
M
D
E
V
G
F
V
V
S
K
I
E
K
D
G
K
V
S
F
L
P
V
G
G
V
D
P
R
I
L
P
G
K
V
V
Q
V
K
N
L
-----
K
G
V
I
G
Y
R
------------
P
P
R
F
E
N
-
L
R
I
D
F
G
F
S
S
A
D
E
A
K
K
-
Y
V
S
I
G
D
-
Y
V
S
F
V
S
D
Y
I
E
-
K
-
N
G
R
A
V
G
K
A
F
D
D
R
A
G
C
S
V
L
I
D
V
L
E
S
G
V
----
S
P
A
--
Y
D
T
Y
F
V
F
T
V
Q
E
E
-----
S
A
V
V
V
E
Q
L
K
P
T
C
A
I
V
V
E
----
T
T
T
-
A
G
D
N
P
E-
L
-----
E
ERKW
A
T
-----
H
L
----
G
D
G
P
A
I
T
F
Y
H
----
R
G
Y
V
I
P
K
E
I
F
Q
T
I
V
D
T
A
K
N
N
D
I
P
F
Q
M
-
K
R
-
R
T------------------
Y
G
V
P
A
G
V
I
S
T
P
A
R
Y
I
H
S
P
N
S
I
I
D
L
N
D
Y
E
N
T
K
K
L
I
K
V
L
V
E
E
G
K
I
V
--------
10
PsiBlast_PDB
57.45
31%
-11
- C2 -
-
4X8I
3
AMPK_PYRFU
A:
[7-339]
-------
M
K
K
I
I
E
S
P
G
V
S
G
Y
E
H
L
-
G
I
R
D
L
V
V
D
I
L
K
D
V
A
D
E
V
K
I
D
K
L
G
N
V
--
I
A
H
F
K
G
-
S
A
P
K
V
M
V
A
A
H
M
D
K
I
G
L
M
V
N
H
I
D
K
D
G
Y
L
R
V
V
P
I
G
G
V
L
P
E
T
L
I
A
Q
K
I
R
F
F
T
E
K
G
E
R
Y
G
V
V
-
G
V
L
P
P
H
L
R
------
I
--
D
W
D
S
-
I
I
V
D
V
G
A
S
S
R
E
E
A
E
E
M
G
F
R
I
G
--
T
I
G
E
F
A
P
N
F
T
R
L
S
E
H
R
F
A
T
P
Y
L
D
D
R
I
C
L
Y
A
M
I
E
A
A
R
Q
L
G
E
H
--
E
----
A
D
I
Y
I
V
A
S
V
Q
E
E
I
G
L
R
G
A
R
V
A
S
F
A
I
D
P
E
V
G
I
A
M
D
----
V
T
F
-
A
K
Q
-
P
--
N
-----
D
----
K
G
-----
K
I
VPEL
G
K
G
P
V
M
---
D
----
V
G
P
N
I
N
P
K
L
R
Q
F
A
D
E
V
A
K
K
Y
E
I
P
L
Q
V
-
E
P
-
S
PR
P
-
T
G
-
T
D
A
N
--
V
M
Q
I
N
R
E
G
V
A
T
A
V
L
S
I
P
I
R
Y
M
H
S
Q
V
E
L
A
D
A
R
D
V
D
N
T
I
K
L
A
K
A
L
L
E
E
L
-----------
8
PsiBlast_PDB
57.15
31%
-4
- C2 -
-
2WZN
2
?
A:
[15-347]
-------
M
Q
E
I
I
E
A
P
G
V
S
G
Y
E
H
L
-
G
I
R
D
I
V
V
D
V
L
K
E
V
A
D
E
V
K
V
D
K
L
G
N
V
--
I
A
H
F
K
G
-
S
S
P
R
I
M
V
A
A
H
M
D
K
I
G
V
M
V
N
H
I
D
K
D
G
Y
L
H
I
V
P
I
G
G
V
L
P
E
T
L
V
A
Q
R
I
R
F
F
T
E
K
G
E
R
Y
G
V
V
-
G
V
L
P
P
H
L
R
---------
I
D
W
D
Q
I
V
V
D
V
G
A
S
S
K
E
E
A
E
E
M
G
F
R
V
G
--
T
V
G
E
F
A
P
N
F
T
R
L
N
E
H
R
F
A
T
P
Y
L
D
D
R
I
C
L
Y
A
M
I
E
A
A
R
Q
L
G
D
H
--
E
----
A
D
I
Y
I
V
G
S
V
Q
E
E
V
G
L
R
G
A
R
V
A
S
Y
A
I
N
P
E
V
G
I
A
M
D
----
V
T
F
-
A
K
Q
P
H
--------
D
----
K
G
-----
K
I
VPEL
G
K
G
P
V
M
---
D
----
V
G
P
N
I
N
P
K
L
R
A
F
A
D
E
V
A
K
K
Y
E
I
P
L
Q
V
-
E
P
-
S
PR
P
-
T
G
-
T
D
A
N
--
V
M
Q
I
N
K
E
G
V
A
T
A
V
L
S
I
P
I
R
Y
M
H
S
Q
V
E
L
A
D
A
R
D
V
D
N
T
I
K
L
A
K
A
L
L
E
E
L
-----------