@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 : I3TZT8: (2017-12-17 )
MKIAIAGAGAMGSRIGLMLHQSGNEVLLIDRWPAHIEAIRTNGLIADFNGKEVVAKLPIYSPEEIIESNEHVDLIVALTKANQLDDMFCSIQSIITDNTYVLCLLNGLGHEDVLEKYVPKKNILFGITMWTAGLAGPGKVTLLGDGEIELENLEPEGEAFTKKVVEVFQEANLNPIYSHNVRYSIWRKACVNGTLNGLCTILDCNIAELGAQKAAESMVRTIVSEFASIAAKEGIILDQEEVYQHIASTYDPDNIGLHYPSMYQDLIKNHRLTEIDYINGAIWRKGQKYDIATPYCAFLTQLVHAKEGILGAE
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.
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
M
K
I
A
I
AGAGAMG
S
R
I
G
L
M
L
HQSG
N
E
V
L
L
IDRWP
A
H
I
E
A
I
RTN
G
L
I
ADFNG
K
E
V
V
A
KLPIY
S
P
E
E
I
I-ESNE
H
V
D
L
I
V
A
LTKAN
Q
L
D
D
M
F
C
S
I
Q
S
I
ITDN
T
Y
V
L
C
L
LNGL
G
H
E
D
V
L
E
K
YVPKK
N
I
L
F
G
I
T
M
WTAGLAGP
G
K
V
T
L
LGDG
E
I
E
L
ENLEPE
G
-
E
A
F
T
K
K
V
V
E
V
F
Q
EANLNPIYSHN
V
R
Y
S
I
W
R
K
A
C
VNG
T
L
N
G
L
C
T
I
LDC
N
I
A
E
L
G
A
Q
K
A
A
E
S
M
V
R
T
I
V
S
E
F
A
S
I
A
A
KE
G
I
IL--
D
Q
E
E
V
Y
Q
H
I
A
STYD--PDNIGLHY
P
S
M
Y
Q
D
L
I
-KNHRL
T
E
I
DYIN
G
A
I
WRKGQKYDIA
T
P
Y
C
A
F
L
T
Q
L
V
H
A
KEGILGAE
4
PsiBlast_PDB
91.09
64%
-139
- C3 -
-
5X20
8
?
A:
[1-309]
M
K
I
A
I
A
G
A
G
A
M
G
S
R
F
G
L
M
L
H
Q
S
G
N
E
V
L
L
I
D
G
W
A
E
H
V
Q
Q
I
K
E
H
G
L
Q
A
N
F
N
G
K
E
V
E
A
K
L
P
I
V
L
Q
S
E
V
--
E
K
E
D
Q
V
D
L
I
I
L
F
T
K
A
M
Q
L
E
K
M
L
Q
D
I
Q
S
L
I
K
K
D
T
E
V
L
C
L
L
N
G
I
G
H
E
D
I
I
E
K
F
V
P
M
E
N
I
Y
I
G
N
T
M
W
T
A
G
L
E
G
P
G
Q
V
K
L
F
G
S
G
S
V
E
L
Q
N
L
G
D
G
K
-
E
A
A
A
K
K
L
A
D
K
L
S
E
S
G
L
N
A
H
F
S
D
N
I
H
Y
S
I
Y
R
K
A
C
V
N
G
T
M
N
G
L
C
T
I
L
D
V
N
M
A
E
L
G
K
T
S
T
A
H
K
M
V
A
T
I
V
N
E
F
A
K
V
A
A
V
E
K
I
E
L
--
D
V
P
E
V
I
A
H
C
E
S
C
F
D
--
P
E
T
I
G
L
H
Y
P
S
M
Y
Q
D
L
I
-
K
N
H
R
L
T
E
I
D
Y
I
N
G
A
I
S
R
K
G
K
K
Y
G
V
A
T
P
Y
C
D
F
L
T
E
L
V
H
A
K
E
D
S
L
---
24
PsiBlast_CBE
90.74
64%
-137
- C3 -
-
5X20
3
?
C:
[1-309]
M
K
I
A
I
A
G
A
G
A
M
G
S
R
F
G
L
M
L
H
Q
S
G
N
E
V
L
L
I
D
G
W
A
E
H
V
Q
Q
I
K
E
H
G
L
Q
A
N
F
N
G
K
E
V
E
A
K
L
P
I
V
L
Q
S
E
V
--
E
K
E
D
Q
V
D
L
I
I
L
F
T
K
A
M
Q
L
E
K
M
L
Q
D
I
Q
S
L
I
K
K
D
T
E
V
L
C
L
L
N
G
I
G
H
E
D
I
I
E
K
F
V
P
M
E
N
I
Y
I
G
N
T
M
W
T
A
G
L
E
G
P
G
Q
V
K
L
F
G
S
G
S
V
E
L
Q
N
L
G
D
G
K
-
E
A
A
A
K
K
L
A
D
K
L
S
E
S
G
L
N
A
H
F
S
D
N
I
H
Y
S
I
Y
R
K
A
C
V
N
G
T
M
N
G
L
C
T
I
L
D
V
N
M
A
E
L
G
K
T
S
T
A
H
K
M
V
A
T
I
V
N
E
F
A
K
V
A
A
V
E
K
I
E
L
--
D
V
P
E
V
I
A
H
C
E
S
C
F
D
--
P
E
T
I
G
L
H
Y
P
S
M
Y
Q
D
L
I
-
K
N
H
R
L
T
E
I
D
Y
I
N
G
A
I
S
R
K
G
K
K
Y
G
V
A
T
P
Y
C
D
F
L
T
E
L
V
H
A
K
E
D
S
L
---
1
PsiBlast_PDB
89.54
75%
-137
- C3 -
-
2EW2
-
?
A:
[16-316]
------------
S
R
L
G
I
M
L
H
Q
G
G
N
D
V
T
L
I
D
Q
W
P
A
H
I
E
A
I
R
K
N
G
L
I
A
D
F
N
G
E
E
V
V
A
N
L
P
I
F
S
P
E
E
I
D
-
H
Q
N
E
Q
V
D
L
I
I
A
L
T
K
A
Q
Q
L
D
A
M
F
K
A
I
Q
P
M
I
T
E
K
T
Y
V
L
C
L
L
N
G
L
G
H
E
D
V
L
E
K
Y
V
P
K
E
N
I
L
V
G
I
T
M
W
T
A
G
L
E
G
P
G
R
V
K
L
L
G
D
G
E
I
E
L
E
N
I
D
P
S
G
-
K
K
F
A
L
E
V
V
D
V
F
Q
K
A
G
L
N
P
S
Y
S
S
N
V
R
Y
S
I
W
R
K
A
C
V
N
G
T
L
N
G
L
C
T
I
L
D
C
N
I
A
E
F
G
A
L
P
V
S
E
S
L
V
K
T
L
I
S
E
F
A
A
V
A
E
K
E
A
I
Y
L
--
D
Q
A
E
V
Y
T
H
I
V
Q
T
Y
D
--
P
N
G
I
G
L
H
Y
P
S
M
Y
Q
D
L
I
-
K
N
H
R
L
T
E
I
D
Y
I
N
G
A
V
W
R
K
G
Q
K
Y
N
V
A
T
P
F
C
A
M
L
T
Q
L
V
H
G
K
E
E
L
L
G
A
K
25
PsiBlast_CBE
89.44
64%
-138
- C3 -
-
5X20
5
?
B:
[1-309]
M
K
I
A
I
A
G
A
G
A
M
G
S
R
F
G
L
M
L
H
Q
S
G
N
E
V
L
L
I
D
G
W
A
E
H
V
Q
Q
I
K
E
H
G
L
Q
A
N
F
N
G
K
E
V
E
A
K
L
P
I
V
L
Q
S
E
V
----
E
D
Q
V
D
L
I
I
L
F
T
K
A
M
Q
L
E
K
M
L
Q
D
I
Q
S
L
I
K
K
D
T
E
V
L
C
L
L
N
G
I
G
H
E
D
I
I
E
K
F
V
P
M
E
N
I
Y
I
G
N
T
M
W
T
A
G
L
E
G
P
G
Q
V
K
L
F
G
S
G
S
V
E
L
Q
N
L
G
D
G
K
-
E
A
A
A
K
K
L
A
D
K
L
S
E
S
G
L
N
A
H
F
S
D
N
I
H
Y
S
I
Y
R
K
A
C
V
N
G
T
M
N
G
L
C
T
I
L
D
V
N
M
A
E
L
G
K
T
S
T
A
H
K
M
V
A
T
I
V
N
E
F
A
K
V
A
A
V
E
K
I
E
L
--
D
V
P
E
V
I
A
H
C
E
S
C
F
D
--
P
E
T
I
G
L
H
Y
P
S
M
Y
Q
D
L
I
-
K
N
H
R
L
T
E
I
D
Y
I
N
G
A
I
S
R
K
G
K
K
Y
G
V
A
T
P
Y
C
D
F
L
T
E
L
V
H
A
K
E
D
S
L
---
28
PsiBlast_CBE
88.46
64%
-147
- C3 -
-
3WFJ
1
?
E:
[1-309]
M
K
I
A
I
A
G
A
G
A
M
G
S
R
F
G
L
M
L
H
Q
S
G
N
E
V
L
L
I
D
G
W
A
E
H
V
Q
Q
I
K
E
H
G
L
Q
A
N
F
----
V
E
A
K
L
P
I
V
L
Q
S
---------
V
D
L
I
I
L
F
T
K
A
M
Q
L
E
K
M
L
Q
D
I
Q
S
L
I
K
K
D
T
E
V
L
C
L
L
N
G
I
G
H
E
D
I
I
E
K
F
V
P
M
E
N
I
Y
I
G
N
T
M
W
T
A
G
L
E
G
P
G
Q
V
K
L
F
G
S
G
S
V
E
L
Q
N
L
G
D
G
K
-
E
A
A
A
K
K
L
A
D
K
L
S
E
S
G
L
N
A
H
F
S
D
N
I
H
Y
S
I
Y
R
K
A
C
V
N
G
T
M
N
G
L
C
T
I
L
D
V
N
M
A
E
L
G
K
T
S
T
A
H
K
M
V
A
T
I
V
N
E
F
A
K
V
A
A
V
E
K
I
E
L
--
D
V
P
E
V
I
A
H
C
E
S
C
F
D
--
P
E
T
I
G
L
H
Y
P
S
M
Y
Q
D
L
I
-
K
N
H
R
L
T
E
I
D
Y
I
N
G
A
I
S
R
K
G
K
K
Y
G
V
A
T
P
Y
C
D
F
L
T
E
L
V
H
A
K
E
D
S
L
---
26
PsiBlast_CBE
87.72
64%
-148
- C3 -
-
3WFJ
1
?
G:
[1-309]
M
K
I
A
I
A
G
A
G
A
M
G
S
R
F
G
L
M
L
H
Q
S
G
N
E
V
L
L
I
D
G
W
A
E
H
V
Q
Q
I
K
E
H
G
L
Q
A
N
F
N
G
----
A
K
L
P
I
V
L
Q
----------
V
D
L
I
I
L
F
T
K
A
M
Q
L
E
K
M
L
Q
D
I
Q
S
L
I
K
K
D
T
E
V
L
C
L
L
N
G
I
G
H
E
D
I
I
E
K
F
V
P
M
E
N
I
Y
I
G
N
T
M
W
T
A
G
L
E
G
P
G
Q
V
K
L
F
G
S
G
S
V
E
L
Q
N
L
G
D
G
K
-
E
A
A
A
K
K
L
A
D
K
L
S
E
S
G
L
N
A
H
F
S
D
N
I
H
Y
S
I
Y
R
K
A
C
V
N
G
T
M
N
G
L
C
T
I
L
D
V
N
M
A
E
L
G
K
T
S
T
A
H
K
M
V
A
T
I
V
N
E
F
A
K
V
A
A
V
E
K
I
E
L
--
D
V
P
E
V
I
A
H
C
E
S
C
F
D
--
P
E
T
I
G
L
H
Y
P
S
M
Y
Q
D
L
I
-
K
N
H
R
L
T
E
I
D
Y
I
N
G
A
I
S
R
K
G
K
K
Y
G
V
A
T
P
Y
C
D
F
L
T
E
L
V
H
A
K
E
D
S
L
---
3
PsiBlast_PDB
87.25
64%
-147
- C3 -
-
3WFJ
1
?
A:
[1-309]
M
K
I
A
I
A
G
A
G
A
M
G
S
R
F
G
L
M
L
H
Q
S
G
N
E
V
L
L
I
D
G
W
A
E
H
V
Q
Q
I
K
E
H
G
L
Q
A
N
F
---
E
V
E
A
K
L
P
I
V
L
Q
S
E
V
--------
D
L
I
I
L
F
T
K
A
M
Q
L
E
K
M
L
Q
D
I
Q
S
L
I
--
D
T
E
V
L
C
L
L
N
G
I
G
H
E
D
I
I
E
K
F
V
P
M
E
N
I
Y
I
G
N
T
M
W
T
A
G
L
E
G
P
G
Q
V
K
L
F
G
S
G
S
V
E
L
Q
N
L
G
D
G
K
-
E
A
A
A
K
K
L
A
D
K
L
S
E
S
G
L
N
A
H
F
S
D
N
I
H
Y
S
I
Y
R
K
A
C
V
N
G
T
M
N
G
L
C
T
I
L
D
V
N
M
A
E
L
G
K
T
S
T
A
H
K
M
V
A
T
I
V
N
E
F
A
K
V
A
A
V
E
K
I
E
L
--
D
V
P
E
V
I
A
H
C
E
S
C
F
D
--
P
E
T
I
G
L
H
Y
P
S
M
Y
Q
D
L
I
-
K
N
H
R
L
T
E
I
D
Y
I
N
G
A
I
S
R
K
G
K
K
Y
G
V
A
T
P
Y
C
D
F
L
T
E
L
V
H
A
K
E
D
S
L
---
30
PsiBlast_CBE
86.83
64%
-151
- C3 -
-
3WFJ
1
?
C:
[1-309]
M
K
I
A
I
A
G
A
G
A
M
G
S
R
F
G
L
M
L
H
Q
S
G
N
E
V
L
L
I
D
G
W
A
E
H
V
Q
Q
I
K
E
H
G
L
Q
A
N
F
----
V
E
A
K
L
P
I
V
L
Q
---------
Q
V
D
L
I
I
L
F
T
K
A
M
Q
L
E
K
M
L
Q
D
I
Q
S
L
I
--
D
T
E
V
L
C
L
L
N
G
I
G
H
E
D
I
I
E
K
F
V
P
M
E
N
I
Y
I
G
N
T
M
W
T
A
G
L
E
G
P
G
Q
V
K
L
F
G
S
G
S
V
E
L
Q
N
L
G
--
K
-
E
A
A
A
K
K
L
A
D
K
L
S
E
S
G
L
N
A
H
F
S
D
N
I
H
Y
S
I
Y
R
K
A
C
V
N
G
T
M
N
G
L
C
T
I
L
D
V
N
M
A
E
L
G
K
T
S
T
A
H
K
M
V
A
T
I
V
N
E
F
A
K
V
A
A
V
E
K
I
E
L
--
D
V
P
E
V
I
A
H
C
E
S
C
F
D
--
P
E
T
I
G
L
H
Y
P
S
M
Y
Q
D
L
I
-
K
N
H
R
L
T
E
I
D
Y
I
N
G
A
I
S
R
K
G
K
K
Y
G
V
A
T
P
Y
C
D
F
L
T
E
L
V
H
A
K
E
D
S
L
---
31
PsiBlast_CBE
86.22
64%
-151
- C3 -
-
3WFJ
1
?
B:
[1-309]
M
K
I
A
I
A
G
A
G
A
M
G
S
R
F
G
L
M
L
H
Q
S
G
N
E
V
L
L
I
D
G
W
A
E
H
V
Q
Q
I
K
E
H
G
L
Q
A
N
F
N
---
V
E
A
K
L
P
I
V
L
Q
----------
V
D
L
I
I
L
F
T
K
A
M
Q
L
E
K
M
L
Q
D
I
Q
S
L
I
----
E
V
L
C
L
L
N
G
I
G
H
E
D
I
I
E
K
F
V
P
M
E
N
I
Y
I
G
N
T
M
W
T
A
G
L
E
G
P
G
Q
V
K
L
F
G
S
G
S
V
E
L
Q
N
L
G
D
G
K
-
E
A
A
A
K
K
L
A
D
K
L
S
E
S
G
L
N
A
H
F
S
D
N
I
H
Y
S
I
Y
R
K
A
C
V
N
G
T
M
N
G
L
C
T
I
L
D
V
N
M
A
E
L
G
K
T
S
T
A
H
K
M
V
A
T
I
V
N
E
F
A
K
V
A
A
V
E
K
I
E
L
--
D
V
P
E
V
I
A
H
C
E
S
C
F
D
--
P
E
T
I
G
L
H
Y
P
S
M
Y
Q
D
L
I
-
K
N
H
R
L
T
E
I
D
Y
I
N
G
A
I
S
R
K
G
K
K
Y
G
V
A
T
P
Y
C
D
F
L
T
E
L
V
H
A
K
E
D
S
L
---
29
PsiBlast_CBE
85.37
64%
-145
- C3 -
-
3WFJ
1
?
D:
[1-309]
M
K
I
A
I
A
G
A
G
A
M
G
S
R
F
G
L
M
L
H
Q
S
G
N
E
V
L
L
I
D
G
W
A
E
H
V
Q
Q
I
K
E
H
G
L
Q
A
N
F
------
A
K
L
P
I
V
L
Q
S
E
-------
Q
V
D
L
I
I
L
F
T
K
A
M
Q
L
E
K
M
L
Q
D
I
Q
S
----
D
T
E
V
L
C
L
L
N
G
I
G
H
E
D
I
I
E
K
F
V
P
M
E
N
I
Y
I
G
N
T
M
W
T
A
G
L
E
G
P
G
Q
V
K
L
F
G
S
G
S
V
E
L
Q
N
L
G
--
K
-
E
A
A
A
K
K
L
A
D
K
L
S
E
S
G
L
N
A
H
F
S
D
N
I
H
Y
S
I
Y
R
K
A
C
V
N
G
T
M
N
G
L
C
T
I
L
D
V
N
M
A
E
L
G
K
T
S
T
A
H
K
M
V
A
T
I
V
N
E
F
A
K
V
A
A
V
E
K
I
E
L
--
D
V
P
E
V
I
A
H
C
E
S
C
F
D
--
P
E
T
I
G
L
H
Y
P
S
M
Y
Q
D
L
I
-
K
N
H
R
L
T
E
I
D
Y
I
N
G
A
I
S
R
K
G
K
K
Y
G
V
A
T
P
Y
C
D
F
L
T
E
L
V
H
A
K
E
D
S
L
---
43
HHSearch
81.09
76%
-35
- C3 -
-
2EW2
-
?
B:
[4-315]
M
K
I
A
I
A
G
A
G
A
M
G
S
R
L
G
I
M
L
H
Q
G
G
N
D
V
T
L
I
D
Q
W
P
A
H
I
E
A
I
R
K
N
G
L
I
A
D
F
N
G
E
E
V
V
A
N
L
P
-
I
F
S
P
E
E
I
D
H
Q
N
E
Q
V
D
L
I
I
A
L
T
K
A
Q
Q
L
D
A
M
F
K
A
I
Q
P
M
I
T
E
K
T
Y
V
L
C
L
L
N
G
L
G
H
E
D
V
L
E
K
Y
V
P
K
E
N
I
L
V
G
I
T
M
W
T
A
G
L
E
G
P
G
R
V
K
L
L
G
D
G
E
I
E
L
E
N
I
D
P
S
G
K
K
F
A
L
E
-
V
V
D
V
F
Q
K
A
G
L
N
P
S
Y
S
S
N
V
R
Y
S
I
W
R
K
A
C
V
N
G
T
L
N
G
L
C
T
I
L
D
C
N
I
A
E
F
G
A
L
P
V
S
E
S
L
V
K
T
L
I
S
E
F
A
A
V
A
E
K
E
A
I
Y
L
--
D
Q
A
E
V
Y
T
H
I
V
Q
T
Y
D
--
P
N
G
I
G
L
H
Y
P
S
M
Y
Q
D
L
I
K
N
-
H
R
L
T
E
I
D
Y
I
N
G
A
V
W
R
K
G
Q
K
Y
N
V
A
T
P
F
C
A
M
L
T
Q
L
V
H
G
K
E
E
L
L
G
A
-
2
PsiBlast_PDB
79.27
64%
-
- C3 -
-
3WFI
-
?
A:
[1-309]
M
K
I
A
I
A
G
A
G
A
M
G
S
R
F
G
L
M
L
H
Q
S
G
N
E
V
L
L
I
D
G
W
A
E
H
V
Q
Q
I
K
E
H
G
L
Q
A
N
F
N
G
K
E
V
E
A
K
L
P
I
V
L
Q
S
E
V
--
E
K
E
D
Q
V
D
L
I
I
L
F
T
K
A
M
Q
L
E
K
M
L
Q
D
I
Q
S
L
I
K
K
D
T
E
V
L
C
L
L
N
G
I
G
H
E
D
I
I
E
K
F
V
P
M
E
N
I
Y
I
G
N
T
M
W
T
A
G
L
E
G
P
G
Q
V
K
L
F
G
S
G
S
V
E
L
Q
N
L
G
D
G
K
-
E
A
A
A
K
K
L
A
D
K
L
S
E
S
G
L
N
A
H
F
S
D
N
I
H
Y
S
I
Y
R
K
A
C
V
N
G
T
M
N
G
L
C
T
I
L
D
V
N
M
A
E
L
G
K
T
S
T
A
H
K
M
V
A
T
I
V
N
E
F
A
K
V
A
A
V
E
K
I
E
L
--
D
V
P
E
V
I
A
H
C
E
S
C
F
D
--
P
E
T
I
G
L
H
Y
P
S
M
Y
Q
D
L
I
-
K
N
H
R
L
T
E
I
D
Y
I
N
G
A
I
S
R
K
G
K
K
Y
G
V
A
T
P
Y
C
D
F
L
T
E
L
V
H
A
K
E
D
S
L
---
44
HHSearch
77.51
64%
-
- C3 -
-
3WFI
-
?
B:
[1-310]
M
K
I
A
I
A
G
A
G
A
M
G
S
R
F
G
L
M
L
H
Q
S
G
N
E
V
L
L
I
D
G
W
A
E
H
V
Q
Q
I
K
E
H
G
L
Q
A
N
F
N
G
K
E
V
E
A
K
L
P
I
V
L
-
Q
S
E
V
-
E
K
E
D
Q
V
D
L
I
I
L
F
T
K
A
M
Q
L
E
K
M
L
Q
D
I
Q
S
L
I
K
K
D
T
E
V
L
C
L
L
N
G
I
G
H
E
D
I
I
E
K
F
V
P
M
E
N
I
Y
I
G
N
T
M
W
T
A
G
L
E
G
P
G
Q
V
K
L
F
G
S
G
S
V
E
L
Q
N
L
G
D
G
K
E
A
A
A
K
K
-
L
A
D
K
L
S
E
S
G
L
N
A
H
F
S
D
N
I
H
Y
S
I
Y
R
K
A
C
V
N
G
T
M
N
G
L
C
T
I
L
D
V
N
M
A
E
L
G
K
T
S
T
A
H
K
M
V
A
T
I
V
N
E
F
A
K
V
A
A
V
E
K
I
E
L
--
D
V
P
E
V
I
A
H
C
E
S
C
F
D
--
P
E
T
I
G
L
H
Y
P
S
M
Y
Q
D
L
I
K
N
-
H
R
L
T
E
I
D
Y
I
N
G
A
I
S
R
K
G
K
K
Y
G
V
A
T
P
Y
C
D
F
L
T
E
L
V
H
A
K
E
D
S
L
N
--
27
PsiBlast_CBE
74.93
64%
-158
- C3 -
-
3WFJ
1
?
F:
[4-309]
---
A
I
A
G
A
G
A
M
G
S
R
F
G
L
M
L
H
Q
S
G
N
E
V
L
L
I
D
G
W
A
E
H
V
Q
-------------------
L
P
I
V
L
--------------
I
I
L
F
T
K
A
M
Q
L
E
K
M
L
Q
D
I
Q
S
L
-----
E
V
L
C
L
L
N
G
I
G
H
E
D
I
I
E
K
F
V
P
M
E
N
I
Y
I
G
N
T
M
W
T
A
G
L
E
G
P
G
Q
V
K
L
F
G
S
G
S
V
E
L
Q
N
L
-----
E
A
A
A
K
K
L
A
D
K
L
----
L
N
A
H
F
S
D
N
I
H
Y
S
I
Y
R
K
A
C
V
N
G
T
M
N
G
L
C
T
I
L
D
V
N
M
A
E
L
G
K
T
S
T
A
H
K
M
V
A
T
I
V
N
E
F
A
K
V
A
A
V
E
K
I
E
L
--
D
V
P
E
V
I
A
H
C
E
S
C
F
D
--
P
E
T
I
G
L
H
Y
P
S
M
Y
Q
D
L
I
-
K
N
H
R
L
T
E
I
D
Y
I
N
G
A
I
S
R
K
G
K
K
Y
G
V
A
T
P
Y
C
D
F
L
T
E
L
V
H
A
K
E
D
S
L
---
48
HHSearch
67.84
28%
-141
- C3 -
-
3HWR
3
?
A:
[20-316]
M
K
V
A
I
M
G
A
G
A
V
G
C
Y
Y
G
G
M
L
A
R
A
G
H
E
V
I
L
I
A
R
P
Q
-
H
V
Q
A
I
E
A
T
G
L
R
L
E
T
Q
S
F
D
E
Q
V
K
V
S
-
A
--
S
S
D
P
-
S
A
V
Q
G
A
D
L
V
L
F
C
V
K
S
T
D
T
Q
S
A
A
L
A
M
K
P
A
L
A
K
S
A
L
V
L
S
L
Q
N
G
V
E
N
A
D
T
L
R
S
L
L
E
Q
-
E
V
A
A
A
V
V
Y
V
A
T
E
M
A
G
P
G
H
V
R
H
H
G
R
G
E
L
V
I
E
P
T
S
-----
H
G
A
N
-
L
A
A
I
F
A
A
A
G
V
P
V
E
T
S
D
N
V
R
G
A
L
W
A
K
L
I
L
N
C
A
Y
N
A
L
S
A
I
T
Q
L
P
Y
G
R
L
V
R
G
E
G
V
E
A
V
M
R
D
V
M
E
E
C
F
A
V
A
R
A
E
G
V
K
L
--
P
D
D
-
V
A
L
A
I
R
R
I
----
A
E
T
M
P
R
Q
S
S
S
T
A
Q
D
L
A
-
R
-
G
K
R
S
E
I
D
H
L
N
G
L
I
V
R
R
G
D
A
L
G
I
P
V
P
A
N
R
V
L
H
A
L
V
R
L
I
E
D
K
Q
Q
--
47
HHSearch
64.96
28%
-134
- C3 -
-
3HWR
3
?
B:
[20-316]
M
K
V
A
I
M
G
A
G
A
V
G
C
Y
Y
G
G
M
L
A
R
A
G
H
E
V
I
L
I
A
R
P
Q
-
H
V
Q
A
I
E
A
T
G
L
R
L
E
T
Q
S
F
D
E
Q
V
K
V
S
-
A
--
S
S
D
P
-
S
A
V
Q
G
A
D
L
V
L
F
C
V
K
S
T
D
T
Q
S
A
A
L
A
M
K
P
A
L
A
K
S
A
L
V
L
S
L
Q
N
G
V
E
N
A
D
T
L
R
S
L
L
E
Q
-
E
V
A
A
A
V
V
Y
V
A
T
E
M
A
G
P
G
H
V
R
H
H
G
R
G
E
L
V
I
E
P
T
S
-----
H
G
A
N
-
L
A
A
I
F
A
A
A
G
V
P
V
E
T
S
D
N
V
R
G
A
L
W
A
K
L
I
L
N
C
A
Y
N
A
L
S
A
I
T
Q
L
P
Y
G
R
L
V
R
G
E
G
V
E
A
V
M
R
D
V
M
E
E
C
F
A
V
A
R
A
E
G
V
K
L
--
P
D
D
-
V
A
L
A
I
R
R
I
----
A
E
T
M
P
R
Q
S
S
S
T
A
Q
D
L
A
-
R
-
G
K
R
S
E
I
D
H
L
N
G
L
I
V
R
R
G
D
A
L
G
I
P
V
P
A
N
R
V
L
H
A
L
V
R
L
I
E
D
K
Q
Q
--
13
PsiBlast_PDB
62.54
23%
-147
- C3 -
-
4S3M
1
?
A:
[3-283]
L
S
V
A
I
I
G
P
G
A
V
G
T
T
I
A
Y
E
L
Q
Q
S
L
P
H
T
T
L
I
G
R
---
H
A
K
T
I
-
T
Y
Y
T
V
P
H
A
P
A
Q
D
I
V
V
K
----
G
Y
E
D
V
T
-
N
T
---
F
D
V
I
I
I
A
V
K
T
H
Q
L
D
A
V
I
P
H
L
T
Y
L
A
H
E
D
T
L
I
I
L
A
Q
N
G
Y
G
Q
L
E
----
H
I
P
F
K
N
V
C
Q
A
V
-
V
Y
I
S
G
Q
K
K
G
D
V
V
T
H
F
R
D
Y
Q
L
R
I
Q
D
------
N
A
L
T
R
Q
F
R
D
L
V
Q
D
S
Q
I
D
I
V
L
E
A
N
I
Q
Q
A
I
W
Y
K
L
L
V
N
L
G
I
N
S
I
-
T
L
L
G
R
Q
T
V
A
I
M
H
N
P
E
I
R
I
L
C
R
Q
L
L
L
D
G
C
R
V
A
Q
A
E
G
L
N
F
--
S
E
Q
T
V
-
D
T
I
M
T
I
Y
Q
G
Y-----------------------
E
V
E
A
I
Q
G
F
I
Y
R
R
A
R
E
H
N
L
D
T
P
Y
L
D
T
I
Y
S
F
L
R
A
Y
-------
8
PsiBlast_PDB
61.53
27%
-119
- C3 -
-
3HWR
3
?
A:
[21-309]
-
K
V
A
I
M
G
A
G
A
V
G
C
Y
Y
G
G
M
L
A
R
A
G
H
E
V
I
L
I
A
R
-
P
Q
H
V
Q
A
I
E
A
T
G
L
R
L
E
T
Q
S
F
D
E
Q
V
K
V
S
A
S
S
D
P
S
A
V
-
Q
G
---
A
D
L
V
L
F
C
V
K
S
T
D
T
Q
S
A
A
L
A
M
K
P
A
L
A
K
S
A
L
V
L
S
L
Q
N
G
V
E
N
A
D
T
L
R
S
L
L
E
Q
E
V
A
A
A
V
V
Y
V
A
T
E
-
M
A
G
P
G
H
V
R
H
H
G
R
G
E
L
---
V
I
E
P
T
S
-
H
G
A
N
L
A
A
I
F
A
A
A
G
V
P
V
E
--
T
S
D
N
V
R
G
A
L
W
A
K
L
I
L
N
C
A
Y
N
A
L
S
A
I
T
Q
L
P
Y
G
R
L
V
R
G
E
G
V
E
A
V
M
R
D
V
M
E
E
C
F
A
V
A
R
A
E
G
V
K
L
PD
D
V
A
L
A
I
R
R
I
A
E
T
M
P
--
R
Q
S
-----
S
S
T
A
Q
D
L
A
-
R
G
K
R
-
S
E
I
D
H
L
N
G
L
I
V
R
R
G
D
A
L
G
I
P
V
P
A
N
R
V
L
H
A
L
V
R
---------
64
Fugue
59.94
26%
-138
- C3 -
-
1KS9
-
PANE_ECOLI
A:
[1-291]
M
K
I
T
V
L
G
C
G
A
L
G
Q
L
W
L
T
A
L
C
K
Q
G
H
E
V
Q
G
W
L
R
V
P
Q
P
Y
C
S
V
N
L
V
----
E
T
D
G
S
I
F
N
E
S
L
T
A
N
D
P
D
F
L
A
-
T
----
S
D
L
L
L
V
T
L
K
A
W
Q
V
S
D
A
V
K
S
L
A
S
T
L
P
V
T
T
P
I
L
L
I
H
N
G
M
G
T
I
E
E
L
Q
N
--
I
Q
Q
P
L
L
M
G
T
T
T
H
A
A
R
R
D
G
N
-
V
I
I
H
V
A
N
G
I
T
H
I
G
P
A
R
Q
Q
D
-
G
D
-
Y
S
Y
L
A
D
I
L
Q
T
V
L
P
D
V
A
W
H
N
N
I
R
A
E
L
W
R
K
L
A
V
N
C
V
I
N
P
L
T
A
I
W
N
C
P
N
G
E
L
R
H
H
---
P
Q
E
I
M
Q
I
C
E
E
V
A
A
V
I
E
R
E
G
H
H
T
--
S
A
E
D
L
R
D
Y
V
M
Q
V
I
D
--
A
T
A
--
E
N
I
S
S
M
L
Q
D
I
R
-
A
L
-
R
H
T
E
I
D
Y
I
N
G
F
L
L
R
R
A
R
A
H
G
I
A
V
P
E
N
T
R
L
F
E
M
V
K
R
K
E
S
E
----
51
HHSearch
59.82
30%
-60
- C3 -
-
5AYV
4
?
B:
[1-300]
M
R
I
Y
V
L
G
A
G
S
I
G
S
L
F
G
A
L
L
A
R
A
G
N
D
V
T
L
I
G
R
R
-
E
Q
V
D
A
I
N
K
N
G
L
H
V
F
G
A
E
E
-
F
T
V
K
P
K
-
A
T
-
I
Y
---
A
P
E
E
P
P
D
L
L
I
L
A
V
K
S
Y
S
T
K
T
A
L
E
C
A
R
Q
C
I
G
R
N
T
W
V
L
S
I
Q
N
G
L
G
N
E
E
L
A
L
K
Y
T
P
--
N
V
M
G
G
V
T
T
N
G
A
M
L
V
E
W
G
K
V
L
W
A
G
K
G
I
T
V
I
G
R
Y
P
T
G
R
D
D
F
V
D
E
-
V
A
S
V
F
N
E
A
G
I
D
T
S
V
T
E
N
A
I
G
W
K
W
A
K
A
I
V
N
S
V
I
N
G
L
G
T
V
L
E
V
K
N
G
H
L
K
D
D
P
H
L
E
G
I
S
V
D
I
A
R
E
G
C
M
V
A
Q
Q
L
G
I
E
F
--
E
I
H
P
-
L
E
L
L
W
D
--
T
--
I
E
R
T
R
E
N
Y
N
S
T
L
Q
D
I
W
-
R
-
G
R
E
T
E
V
D
Y
I
H
G
K
I
V
E
Y
A
R
S
V
G
M
E
A
P
R
N
E
L
L
W
V
L
V
K
A
K
E
R
I
N
R
G
-