@TOME V2.3
(Nov 2016)
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 : gbs1796: (2015-12-10 )
MKHYDTIIIGGGPAGMMAAISSNFYGNKTLLIEKNKRLGKKLAGTGGGRCNVTNNGNLDELLAGIPGNGRFLYSVFSQFDNHDIINFFQDNGVTLKEEDHGRMFPTTDKSRTIINALENKIKELGGQIMTDTEVVSVKKIGDSFYIKTKDTQFASDKLIVTTGGKSYPSTGSTGFGHDIARHFKLEVTDMEAAESPLLTDFPHKKLQGISLDDVTLSFEKHIITHDLLFTHFGLSGPAALRISSFVKGGETIYLDVLPNISVKELETHFQNEREKSLKNALKILLPERLAEFYAEDLPEKVKQVSVKDLETLIQKLKKLPILVTGKMSLAKSFVTKGGVDLKEINPKTLESKKVAGLHFAGEVLDINAHTGGFNITSALCTGWVAGSLHY
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.......360.......370.......380.......390--
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MKHY
D
T
I
I
IGGG
P
A
G
M
M
A
A
I
SSNFYG
N
K
T
L
L
I
EK
N
K
R
L
G
K
K
LAGTGGGR
C
N
VTN-NG
N
L
D
E
L
L
AG-IPGN
G
R
F
L
Y
S
V
F
S
QFDN
H
D
I
I
N
F
FQDNG
V
T
LKEEDHGRMFPTTDK
S
R
T
I
I
N
A
L
E
N
K
I
K
E
LGG
Q
I
MTD
T
E
V
V
S
V
K
KI--G---
D
----
S
F
-
Y
--
I
K
T--KD-TQFAS
D
K
L
I
V
T
TGGKSYPSTGSTG
F
G
H
D
I
A
R
H
F
K
L
E
V
TDMEAAESPLL---TDFP---H----KKLQGISLD
D
V
T
L
-
S
F
--
E
-
K
H
I
--
I
T
--
H
--
D
L
L
F
T
HFGLSGPA
A
L
R
I
S
S
F
VKGG--------
E
--------
T
I
Y
L
--DVLPNI
S
V
K
E
-
L
E
T
----
H
F
Q
----
N
E
R
E
----
K
S
L
K
N
A
L
K
I
L
L
P
E
R
L
A
E
F
Y
A
E
------
D
L
P
---
E
----
K
V
K
Q
V
S
V
K
D
L
E
T
L
I
Q
K
L
KKL
P
I
L
V
T
G
K
M
S
L
A
K
S
F
V
T
KGGV
D
L
KEINPKTLESKKV
A
G
L
H
FA
G
E
V
L
D
I
NAHTGGF
N
I
T
S
A
L
C
T
G
W
VAGSLHY----
22
PsiBlast_CBE
94.18
79%
-91
- C3 -
4CNJ
1
?
D:
[1-390]
M
N
H
F
D
T
I
I
I
G
G
G
P
A
G
M
M
A
T
I
S
S
S
F
Y
G
Q
K
T
L
L
L
E
K
N
K
R
L
G
K
K
L
A
G
T
G
G
G
R
C
N
V
T
N
-
N
G
N
L
D
D
L
M
A
G
-
I
P
G
N
G
R
F
L
Y
S
V
F
S
Q
F
D
N
H
D
I
I
N
F
F
T
E
N
G
V
K
L
K
V
E
D
H
G
R
V
F
P
V
T
D
K
S
R
T
I
I
E
A
L
E
K
K
I
A
E
L
G
G
T
V
I
T
N
T
E
I
V
S
V
K
K
T
--
D
---
E
----
L
F
-
T
--
V
R
S
--
S
D
-
Q
A
W
T
C
Q
K
L
I
V
T
T
G
G
K
S
Y
P
S
T
G
S
T
G
F
G
H
D
I
A
R
H
F
K
H
T
V
T
D
L
E
A
A
E
S
P
L
L
---
T
D
F
P
---
H
----
K
A
L
Q
G
I
S
L
D
D
V
T
L
-
S
Y
--
G
-
K
H
I
--
I
T
--
H
--
D
L
L
F
T
H
F
G
L
S
G
P
A
A
L
R
L
S
S
F
V
K
G
G
--------
E
--------
T
I
Y
L
--
D
V
L
P
Q
M
S
Q
Q
D
-
L
A
D
----
F
L
E
----
E
H
R
E
----
K
S
L
K
N
C
L
K
I
L
L
P
E
R
I
A
D
F
F
T
Q
------
P
F
P
---
E
----
K
V
K
Q
L
N
L
S
E
K
E
A
L
I
K
Q
I
K
E
L
P
I
S
V
T
G
K
M
S
L
A
K
S
F
V
T
K
G
G
V
S
L
K
E
I
N
P
K
T
L
E
S
K
L
V
P
G
L
H
F
A
G
E
V
L
D
I
N
A
H
T
G
G
F
N
I
T
S
A
L
C
T
G
W
V
A
G
S
L
H
Y
----
23
PsiBlast_CBE
93.73
79%
-93
- C3 -
4CNJ
1
?
C:
[1-390]
M
N
H
F
D
T
I
I
I
G
G
G
P
A
G
M
M
A
T
I
S
S
S
F
Y
G
Q
K
T
L
L
L
E
K
N
K
R
L
G
K
K
L
A
G
T
G
G
G
R
C
N
V
T
N
-
N
G
N
L
D
D
L
M
A
G
-
I
P
G
N
G
R
F
L
Y
S
V
F
S
Q
F
D
N
H
D
I
I
N
F
F
T
E
N
G
V
K
L
K
V
E
D
H
G
R
V
F
P
V
T
D
K
S
R
T
I
I
E
A
L
E
K
K
I
A
E
L
G
G
T
V
I
T
N
T
E
I
V
S
V
K
K
T
--
D
---
E
----
L
F
-
T
--
V
R
S
--
S
D
-
Q
A
W
T
C
Q
K
L
I
V
T
T
G
G
K
S
Y
P
S
T
G
S
T
G
F
G
H
D
I
A
R
H
F
K
H
T
V
T
D
L
E
A
A
E
S
P
L
L
---
T
D
F
P
---
H
----
K
A
L
Q
G
I
S
L
D
D
V
T
L
-
S
Y
--
G
-
K
H
I
--
I
T
--
H
--
D
L
L
F
T
H
F
G
L
S
G
P
A
A
L
R
L
S
S
F
V
K
G
G
--------
E
--------
T
I
Y
L
--
D
V
L
P
Q
M
S
Q
Q
D
-
L
A
D
----
F
L
E
----
E
H
R
E
----
K
S
L
K
N
C
L
K
I
L
L
P
E
R
I
A
D
F
F
T
Q
------
P
F
P
---
E
----
K
V
K
Q
L
N
L
S
E
K
E
A
L
I
K
Q
I
K
E
L
P
I
S
V
T
G
K
M
S
L
A
K
S
F
V
T
K
G
G
V
S
L
K
E
I
N
P
K
T
L
E
S
K
L
V
P
G
L
H
F
A
G
E
V
L
D
I
N
A
H
T
G
G
F
N
I
T
S
A
L
C
T
G
W
V
A
G
S
L
H
Y
----
2
PsiBlast_PDB
93.67
79%
-92
- C3 -
4CNK
11
?
A:
[1-390]
M
N
H
F
D
T
I
I
I
G
G
G
P
A
G
M
M
A
T
I
S
S
S
F
Y
G
Q
K
T
L
L
L
E
K
N
K
R
L
G
K
K
L
A
G
T
G
G
G
R
C
N
V
T
N
-
N
G
N
L
D
D
L
M
A
G
-
I
P
G
N
G
R
F
L
Y
S
V
F
S
Q
F
D
N
H
D
I
I
N
F
F
T
E
N
G
V
K
L
K
V
E
D
H
G
R
V
F
P
V
T
D
K
S
R
T
I
I
E
A
L
E
K
K
I
A
E
L
G
G
T
V
I
T
N
T
E
I
V
S
V
K
K
T
--
D
---
E
----
L
F
-
T
--
V
R
S
--
S
D
-
Q
A
W
T
C
Q
K
L
I
V
T
T
G
G
K
S
Y
P
S
T
G
S
T
G
F
G
H
D
I
A
R
H
F
K
H
T
V
T
D
L
E
A
A
E
S
P
L
L
---
T
D
F
P
---
H
----
K
A
L
Q
G
I
S
L
D
D
V
T
L
-
S
Y
--
G
-
K
H
I
--
I
T
--
H
--
D
L
L
F
T
H
F
G
L
S
G
P
A
A
L
R
L
S
S
F
V
K
G
G
--------
E
--------
T
I
Y
L
--
D
V
L
P
Q
M
S
Q
Q
D
-
L
A
D
----
F
L
E
----
E
H
R
E
----
K
S
L
K
N
C
L
K
I
L
L
P
E
R
I
A
D
F
F
T
Q
------
P
F
P
---
E
----
K
V
K
Q
L
N
L
S
E
K
E
A
L
I
K
Q
I
K
E
L
P
I
S
V
T
G
K
M
S
L
A
K
S
F
V
T
K
G
G
V
S
L
K
E
I
N
P
K
T
L
E
S
K
L
V
P
G
L
H
F
A
G
E
V
L
D
I
N
A
H
T
G
G
F
N
I
T
S
A
L
C
T
G
W
V
A
G
S
L
H
Y
----
1
PsiBlast_PDB
93.55
79%
-92
- C3 -
4CNJ
1
?
A:
[1-390]
M
N
H
F
D
T
I
I
I
G
G
G
P
A
G
M
M
A
T
I
S
S
S
F
Y
G
Q
K
T
L
L
L
E
K
N
K
R
L
G
K
K
L
A
G
T
G
G
G
R
C
N
V
T
N
-
N
G
N
L
D
D
L
M
A
G
-
I
P
G
N
G
R
F
L
Y
S
V
F
S
Q
F
D
N
H
D
I
I
N
F
F
T
E
N
G
V
K
L
K
V
E
D
H
G
R
V
F
P
V
T
D
K
S
R
T
I
I
E
A
L
E
K
K
I
A
E
L
G
G
T
V
I
T
N
T
E
I
V
S
V
K
K
T
--
D
---
E
----
L
F
-
T
--
V
R
S
--
S
D
-
Q
A
W
T
C
Q
K
L
I
V
T
T
G
G
K
S
Y
P
S
T
G
S
T
G
F
G
H
D
I
A
R
H
F
K
H
T
V
T
D
L
E
A
A
E
S
P
L
L
---
T
D
F
P
---
H
----
K
A
L
Q
G
I
S
L
D
D
V
T
L
-
S
Y
--
G
-
K
H
I
--
I
T
--
H
--
D
L
L
F
T
H
F
G
L
S
G
P
A
A
L
R
L
S
S
F
V
K
G
G
--------
E
--------
T
I
Y
L
--
D
V
L
P
Q
M
S
Q
Q
D
-
L
A
D
----
F
L
E
----
E
H
R
E
----
K
S
L
K
N
C
L
K
I
L
L
P
E
R
I
A
D
F
F
T
Q
------
P
F
P
---
E
----
K
V
K
Q
L
N
L
S
E
K
E
A
L
I
K
Q
I
K
E
L
P
I
S
V
T
G
K
M
S
L
A
K
S
F
V
T
K
G
G
V
S
L
K
E
I
N
P
K
T
L
E
S
K
L
V
P
G
L
H
F
A
G
E
V
L
D
I
N
A
H
T
G
G
F
N
I
T
S
A
L
C
T
G
W
V
A
G
S
L
H
Y
----
24
PsiBlast_CBE
93.25
79%
-93
- C3 -
4CNJ
1
?
B:
[1-390]
M
N
H
F
D
T
I
I
I
G
G
G
P
A
G
M
M
A
T
I
S
S
S
F
Y
G
Q
K
T
L
L
L
E
K
N
K
R
L
G
K
K
L
A
G
T
G
G
G
R
C
N
V
T
N
-
N
G
N
L
D
D
L
M
A
G
-
I
P
G
N
G
R
F
L
Y
S
V
F
S
Q
F
D
N
H
D
I
I
N
F
F
T
E
N
G
V
K
L
K
V
E
D
H
G
R
V
F
P
V
T
D
K
S
R
T
I
I
E
A
L
E
K
K
I
A
E
L
G
G
T
V
I
T
N
T
E
I
V
S
V
K
K
T
--
D
---
E
----
L
F
-
T
--
V
R
S
--
S
D
-
Q
A
W
T
C
Q
K
L
I
V
T
T
G
G
K
S
Y
P
S
T
G
S
T
G
F
G
H
D
I
A
R
H
F
K
H
T
V
T
D
L
E
A
A
E
S
P
L
L
---
T
D
F
P
---
H
----
K
A
L
Q
G
I
S
L
D
D
V
T
L
-
S
Y
--
G
-
K
H
I
--
I
T
--
H
--
D
L
L
F
T
H
F
G
L
S
G
P
A
A
L
R
L
S
S
F
V
K
G
G
--------
E
--------
T
I
Y
L
--
D
V
L
P
Q
M
S
Q
Q
D
-
L
A
D
----
F
L
E
----
E
H
R
E
----
K
S
L
K
N
C
L
K
I
L
L
P
E
R
I
A
D
F
F
T
Q
------
P
F
P
---
E
----
K
V
K
Q
L
N
L
S
E
K
E
A
L
I
K
Q
I
K
E
L
P
I
S
V
T
G
K
M
S
L
A
K
S
F
V
T
K
G
G
V
S
L
K
E
I
N
P
K
T
L
E
S
K
L
V
P
G
L
H
F
A
G
E
V
L
D
I
N
A
H
T
G
G
F
N
I
T
S
A
L
C
T
G
W
V
A
G
S
L
H
Y
----
21
PsiBlast_CBE
93.25
79%
-92
- C3 -
4CNK
13
?
B:
[1-390]
M
N
H
F
D
T
I
I
I
G
G
G
P
A
G
M
M
A
T
I
S
S
S
F
Y
G
Q
K
T
L
L
L
E
K
N
K
R
L
G
K
K
L
A
G
T
G
G
G
R
C
N
V
T
N
-
N
G
N
L
D
D
L
M
A
G
-
I
P
G
N
G
R
F
L
Y
S
V
F
S
Q
F
D
N
H
D
I
I
N
F
F
T
E
N
G
V
K
L
K
V
E
D
H
G
R
V
F
P
V
T
D
K
S
R
T
I
I
E
A
L
E
K
K
I
A
E
L
G
G
T
V
I
T
N
T
E
I
V
S
V
K
K
T
--
D
---
E
----
L
F
-
T
--
V
R
S
--
S
D
-
Q
A
W
T
C
Q
K
L
I
V
T
T
G
G
K
S
Y
P
S
T
G
S
T
G
F
G
H
D
I
A
R
H
F
K
H
T
V
T
D
L
E
A
A
E
S
P
L
L
---
T
D
F
P
---
H
----
K
A
L
Q
G
I
S
L
D
D
V
T
L
-
S
Y
--
G
-
K
H
I
--
I
T
--
H
--
D
L
L
F
T
H
F
G
L
S
G
P
A
A
L
R
L
S
S
F
V
K
G
G
--------
E
--------
T
I
Y
L
--
D
V
L
P
Q
M
S
Q
Q
D
-
L
A
D
----
F
L
E
----
E
H
R
E
----
K
S
L
K
N
C
L
K
I
L
L
P
E
R
I
A
D
F
F
T
Q
------
P
F
P
---
E
----
K
V
K
Q
L
N
L
S
E
K
E
A
L
I
K
Q
I
K
E
L
P
I
S
V
T
G
K
M
S
L
A
K
S
F
V
T
K
G
G
V
S
L
K
E
I
N
P
K
T
L
E
S
K
L
V
P
G
L
H
F
A
G
E
V
L
D
I
N
A
H
T
G
G
F
N
I
T
S
A
L
C
T
G
W
V
A
G
S
L
H
Y
----
3
PsiBlast_PDB
75.44
45%
-81
- C2 -
2I0Z
2
?
A:
[26-437]
--
H
Y
D
V
I
V
I
G
G
G
P
S
G
L
M
A
A
I
G
A
A
E
E
G
A
N
V
L
L
L
D
K
G
N
K
L
G
R
K
L
A
I
S
G
G
G
R
C
N
V
T
N
-
R
L
P
L
D
E
I
V
K
H
-
I
P
G
N
G
R
F
L
Y
S
A
F
S
I
F
N
N
E
D
I
I
T
F
F
E
N
L
G
V
K
L
K
E
E
D
H
G
R
M
F
P
V
S
N
K
A
Q
S
V
V
D
A
L
L
T
R
L
K
D
L
G
V
K
I
R
T
N
T
P
V
E
T
I
E
Y
E
--
N
G
Q
T
K
----
A
V
-
I
--
L
Q
T
--
G
E
-
V
-
L
E
T
N
H
V
V
I
A
V
G
G
K
S
V
P
Q
T
G
S
T
G
D
G
Y
A
W
A
E
K
A
G
H
T
I
T
E
L
F
P
T
E
V
P
I
L
---
S
N
E
P
F
I
R
D
----
R
S
L
Q
G
L
A
L
R
D
I
N
L
-
S
V
LN---
A
I
--
I
S
--
H
K
M
D
M
L
F
T
H
F
G
L
S
G
P
A
A
L
R
C
S
Q
F
V
V
K
A
L
K
K
F
KT--
N
--------
T
I
Q
M
S
I
D
A
L
P
E
E
N
S
E
Q
-
L
F
Q
R
M
L
K
Q
M
K
----
E
D
P
K
----
K
G
I
K
N
V
L
K
G
Y
V
P
E
R
Y
F
L
F
L
L
E
K
N
EI--
D
G
S
---
E
----
Q
A
G
Q
V
S
H
E
K
I
R
A
L
V
K
D
F
K
E
F
T
V
N
V
N
G
T
Q
S
I
E
K
A
F
V
T
G
G
G
V
S
V
K
E
I
N
P
K
E
M
S
S
K
F
T
N
G
L
Y
F
C
G
E
V
L
D
I
H
G
Y
T
G
G
Y
N
I
T
S
A
L
V
T
G
R
I
A
G
T
T
A
G
----
135
HHSearch
74.85
46%
-79
- C2 -
2I0Z
2
?
A:
[25-440]
-
M
H
Y
D
V
I
V
I
G
G
G
P
S
G
L
M
A
A
I
G
A
A
E
E
G
A
N
V
L
L
L
D
K
G
N
K
L
G
R
K
L
A
I
S
G
G
G
R
C
N
V
T
N
-
R
L
P
L
D
E
I
V
K
H
-
I
P
G
N
G
R
F
L
Y
S
A
F
S
I
F
N
N
E
D
I
I
T
F
F
E
N
L
G
V
K
L
K
E
E
D
H
G
R
M
F
P
V
S
N
K
A
Q
S
V
V
D
A
L
L
T
R
L
K
D
L
G
V
K
I
R
T
N
T
P
V
E
T
I
E
Y
E
--
N
---
G
----
Q
T
K
A
--
V
I
L
--
Q
T
G
E
V
L
E
T
N
H
V
V
I
A
V
G
G
K
S
V
P
Q
T
G
S
T
G
D
G
Y
A
W
A
E
K
A
G
H
T
I
T
E
L
F
P
T
E
V
P
I
L
---
S
N
E
P
---
F
I
R
D
-
R
S
L
Q
G
L
A
L
R
D
I
N
L
S
V
L
--
N
----A
I
I
S
--
H
K
M
D
M
L
F
T
H
F
G
L
S
G
P
A
A
L
R
C
S
Q
F
V
V
K
A
L
K
K
F
KTN
T
I
--------
Q
M
S
I
--
D
A
L
P
E
E
N
S
E
Q
-
L
F
Q
----
R
M
L
K
Q
M
K
E
D
P
K
----
K
G
I
K
N
V
L
K
G
Y
V
P
E
R
Y
F
L
F
L
L
E
------
K
N
E
---
I
DGSE
Q
A
G
Q
V
S
H
E
K
I
R
A
L
V
K
D
F
K
E
F
T
V
N
V
N
G
T
Q
S
I
E
K
A
F
V
T
G
G
G
V
S
V
K
E
I
N
P
K
E
M
S
S
K
F
T
N
G
L
Y
F
C
G
E
V
L
D
I
H
G
Y
T
G
G
Y
N
I
T
S
A
L
V
T
G
R
I
A
G
T
T
A
G
----
124
Fugue
74.85
46%
-77
* C2 *
2I0Z
2
?
A:
[25-444]
-
M
H
Y
D
V
I
V
I
G
G
G
P
S
G
L
M
A
A
I
G
A
A
E
E
G
A
N
V
L
L
L
D
K
G
N
K
L
G
R
K
L
A
I
S
G
G
G
R
C
N
V
T
N
-
R
L
P
L
D
E
I
V
K
H
-
I
P
G
N
G
R
F
L
Y
S
A
F
S
I
F
N
N
E
D
I
I
T
F
F
E
N
L
G
V
K
L
K
E
E
D
H
G
R
M
F
P
V
S
N
K
A
Q
S
V
V
D
A
L
L
T
R
L
K
D
L
G
V
K
I
R
T
N
T
P
V
E
T
I
E
Y
E
--
N
---
G
----
Q
T
-
K
--
A
V
I
LQ
T
G
-
E
V
L
E
T
N
H
V
V
I
A
V
G
G
K
S
V
P
Q
T
G
S
T
G
D
G
Y
A
W
A
E
K
A
G
H
T
I
T
E
L
F
P
T
E
V
P
I
L
S
NE
P
F
I
R
---
D
----
R
S
L
Q
G
L
A
L
R
D
I
N
L
-
S
V
--
L
-
N
A
I
--
I
S
H
K
M
--
D
M
L
F
T
H
F
G
L
S
G
P
A
A
L
R
C
S
Q
F
V
V
K
A
--------
L
K
K
F
KTN
T
I
Q
M
S
I
--
D
A
L
P
E
E
N
S
E
Q
-
L
F
Q
----
R
M
L
----
K
Q
M
K
E
D
PK
K
G
I
K
N
V
L
K
G
Y
V
P
E
R
Y
F
L
F
L
L
E
K
N
EI--
D
G
S
---
E
----
Q
A
G
Q
V
S
H
E
K
I
R
A
L
V
K
D
F
K
E
F
T
V
N
V
N
G
T
Q
S
I
E
K
A
F
V
T
G
G
G
V
S
V
K
E
I
N
P
K
E
M
S
S
K
F
T
N
G
L
Y
F
C
G
E
V
L
D
I
H
G
Y
T
G
G
Y
N
I
T
S
A
L
V
T
G
R
I
A
G
T
T
A
G
E
N
A
K
134
HHSearch
69.75
32%
-75
- C2 -
3V76
1
?
A:
[28-417]
---
Q
D
V
V
I
I
G
A
G
A
A
G
M
M
C
A
I
E
A
G
K
R
G
R
R
V
L
V
I
D
H
A
R
A
P
G
E
K
I
R
I
S
G
G
G
R
C
N
F
T
N
I
H
A
S
P
R
N
F
L
----
S
G
N
P
H
F
C
K
S
A
L
A
R
Y
R
P
Q
D
F
V
A
L
V
E
R
H
G
I
G
W
H
E
K
T
L
G
Q
L
F
C
-
D
H
S
A
K
D
I
I
R
M
L
M
A
E
M
K
E
A
G
V
Q
L
R
L
E
T
S
I
G
E
V
E
R
T
--
A
---
S
----
G
F
-
R
--
V
T
T
--
S
A
-
G
T
V
D
A
A
S
L
V
V
A
S
G
G
K
S
I
P
K
M
G
A
T
G
L
A
Y
R
I
A
E
Q
F
G
L
P
V
V
E
T
R
P
A
L
V
P
L
T
---
L
D
Q
A
---
Q
L
A
K
L
G
A
L
A
G
V
A
A
D
A
E
A
R
-
F
------
G
K
--
A
A
F
-
R
E
-
A
V
L
I
T
H
R
G
L
S
G
P
A
I
L
Q
I
S
S
Y
W
R
E
G
--------
E
--------
E
I
V
L
--
R
L
M
P
D
I
D
I
A
S
-
I
L
K
----
G
M
R
R
---
A
N
G
R
----
Q
A
V
Q
T
A
L
A
D
I
L
P
R
R
L
A
Q
F
F
A
D
------
E
A
K
---
L
TGR-
M
L
A
D
L
S
D
K
T
I
D
A
L
A
S
S
I
Q
V
W
A
V
K
P
A
G
S
E
G
Y
R
T
A
E
V
T
L
G
G
V
D
T
R
A
L
D
S
R
T
M
Q
A
K
E
V
P
G
L
Y
F
V
G
E
C
V
D
V
T
G
W
L
G
G
Y
N
F
Q
W
A
W
A
S
G
F
V
A
G
Q
D
V
-----
136
HHSearch
67.18
31%
-71
- C2 -
2GQF
2
Y933_HAEIN
A:
[2-399]
S
Q
Y
S
E
N
I
I
I
G
A
G
A
A
G
L
F
C
A
A
Q
L
A
K
L
G
K
S
V
T
V
F
D
N
G
K
K
I
G
R
K
I
L
M
S
G
G
G
F
C
N
F
T
N
L
E
V
T
P
A
H
Y
----
L
S
Q
N
P
H
F
V
K
S
A
L
A
R
Y
T
N
W
D
F
I
S
L
V
A
E
Q
G
I
T
Y
H
E
K
E
L
G
Q
L
F
C
D
-
E
G
A
E
Q
I
V
E
M
L
K
S
E
C
D
K
Y
G
A
K
I
L
L
R
S
E
V
S
Q
V
E
R
I
Q
N
D
---
E
----
K
V
-
R
F
V
L
Q
V
--
N
S
-
T
Q
W
Q
C
K
N
L
I
V
A
T
G
G
L
S
M
P
G
L
G
A
T
P
F
G
Y
Q
I
A
E
Q
F
G
I
P
V
I
P
P
R
A
S
L
V
P
F
T
---
Y
R
E
T
---
D
KFL-
T
A
L
S
G
I
S
L
P
V
T
---
I
T
--
A
L
C
G
K
S
-
F
Y
--
N
--
Q
L
L
F
T
H
R
G
I
S
G
P
A
V
L
Q
I
S
N
Y
W
Q
P
T
--------
E
--------
S
V
E
I
--
D
L
L
P
N
H
N
V
E
E
-
E
I
N
----
Q
A
K
Q
---
S
S
P
K
----
Q
M
L
K
T
I
L
V
R
L
L
P
K
K
L
V
E
L
W
I
E
------
Q
G
I
---
V
Q
D
E
-
V
I
A
N
I
S
K
V
R
V
K
N
L
V
D
F
I
H
H
W
E
F
T
P
N
G
T
E
G
Y
R
T
A
E
V
T
M
G
G
V
D
T
K
V
I
S
S
K
T
M
E
S
N
Q
V
S
G
L
Y
F
I
G
E
V
L
D
V
T
G
W
L
G
G
Y
N
F
Q
W
A
W
S
S
A
Y
A
C
A
L
S
I
S
----
4
PsiBlast_PDB
65.86
32%
-70
- C2 -
2GQF
2
Y933_HAEIN
A:
[3-395]
-
Q
Y
S
E
N
I
I
I
G
A
G
A
A
G
L
F
C
A
A
Q
L
A
K
L
G
K
S
V
T
V
F
D
N
G
K
K
I
G
R
K
I
L
M
S
G
G
G
F
C
N
F
T
N
----
L
E
V
T
P
A
H
Y
L
S
Q
N
P
H
F
V
K
S
A
L
A
R
Y
T
N
W
D
F
I
S
L
V
A
E
Q
G
I
T
Y
H
E
K
E
L
G
Q
L
F
-
C
D
E
G
A
E
Q
I
V
E
M
L
K
S
E
C
D
K
Y
G
A
K
I
L
L
R
S
E
V
S
Q
V
E
R
I
--
Q
---
N
DEKV
R
F
-
V
--
L
Q
V
--
N
S
-
T
Q
W
Q
C
K
N
L
I
V
A
T
G
G
L
S
M
P
G
L
G
A
T
P
F
G
Y
Q
I
A
E
Q
F
G
I
P
V
I
P
P
R
A
S
L
V
P
F
T
Y
R
E
T
D
K
F
---
L
----
T
A
L
S
G
I
S
L
P
V
T
I
T
-
A
L
--
C
-
G
K
S
--
F
Y
--
N
--
Q
L
L
F
T
H
R
G
I
S
G
P
A
V
L
Q
I
S
N
Y
W
Q
P
T
--------
E
--------
S
V
E
I
--
D
L
L
P
N
H
N
V
E
E
E
I
N
Q
----
A
K
Q
----
S
S
P
K
----
Q
M
L
K
T
I
L
V
R
L
L
P
K
K
L
V
E
L
W
I
E
Q
GI
V
Q
D
E
V
I
---
A
----
N
I
S
K
V
R
V
K
N
L
V
D
F
I
H
H
W
E
F
T
P
---
N
G
T
E
G
Y
R
T
A
E
V
T
M
G
G
V
D
T
K
V
I
S
S
K
T
M
E
S
N
Q
V
S
G
L
Y
F
I
G
E
V
L
D
V
T
G
W
L
G
G
Y
N
F
Q
W
A
W
S
S
A
Y
A
C
A
L
S
I
S
----
5
PsiBlast_PDB
63.87
30%
-83
- C2 -
3V76
1
?
A:
[50-414]
-------------------------
G
R
R
V
L
V
I
D
H
A
R
A
P
G
E
K
I
R
I
S
G
G
G
R
C
N
F
T
N
I
H
A
S
P
R
N
F
L
S
G
-
N
P
---
H
F
C
K
S
A
L
A
R
Y
R
P
Q
D
F
V
A
L
V
E
R
H
G
I
G
W
H
E
K
T
L
G
Q
L
F
-
C
D
H
S
A
K
D
I
I
R
M
L
M
A
E
M
K
E
A
G
V
Q
L
R
L
E
T
S
I
G
E
V
E
R
T
--
A
---
S
----
G
F
-
R
--
V
T
T
--
S
A
-
G
T
V
D
A
A
S
L
V
V
A
S
G
G
K
S
I
P
K
M
G
A
T
G
L
A
Y
R
I
A
E
Q
F
G
L
P
V
V
E
T
R
P
A
L
V
P
L
T
---
L
D
Q
A
---
Q
L
A
K
L
G
A
L
A
G
V
A
A
D
-
A
E
A
-
R
F
--
G
-
K
A
A
--
F
R
--
E
--
A
V
L
I
T
H
R
G
L
S
G
P
A
I
L
Q
I
S
S
Y
W
R
E
G
--------
E
--------
E
I
V
L
--
R
L
M
P
D
I
D
I
A
S
I
L
K
G
----
M
R
R
----
A
N
G
R
----
Q
A
V
Q
T
A
L
A
D
I
L
P
R
R
L
A
Q
F
F
A
D
------
E
A
K
LTG
R
----
M
L
A
D
L
S
D
K
T
I
D
A
L
A
S
S
I
Q
V
W
A
V
K
P
A
G
S
E
G
Y
R
T
A
E
V
T
L
G
G
V
D
T
R
A
L
D
S
R
T
M
Q
A
K
E
V
P
G
L
Y
F
V
G
E
C
V
D
V
T
G
W
L
G
G
Y
N
F
Q
W
A
W
A
S
G
F
V
A
G
Q
D
V
-----
81
PsiBlast_CBE
40.48
44%
-90
- C3 -
2EQ8
1
?
D:
[4-44]
M
K
T
Y
D
L
I
V
I
G
T
G
P
G
G
Y
H
A
A
I
R
A
A
Q
L
G
L
K
V
L
A
V
E
---------
A
G
E
V
G
G
V
C
L
N
V
G
-
C
I
P
T
K
A
L
L
H
A
-
A
E
T
L
H
H
L
K
V
A
E
G
F
G
L
K
A
K
P
E
L
D
L
K
K
L
G
G
W
R
D
Q
V
V
K
K
L
T
G
G
V
G
T
L
L
K
G
N
G
V
E
L
L
R
G
F
A
R
L
V
G
P
K
E
V
E
V
G
G
E
R
Y
G
A
K
S
--
L
---
I
----
L
A
-
T
--
G
S
E
--
P
L
-
E
L
K
G
F
P
F
G
E
D
V
W
D
S
T
R
A
L
K
V
E
E
G
L
P
K
R
L
L
V
I
G
G
G
A
V
G
L
E
L
G
Q
V
Y
R
R
L
G
---
A
E
V
T
---
L
----
I
E
Y
M
P
E
I
L
P
Q
G
D
P
-
E
T
--
A
-
A
L
L
--
R
R
--
A
--
L
E
K
E
G
I
R
V
R
T
K
T
K
A
V
G
Y
E
K
K
K
D
G
L
--------
H
--------
V
R
L
E
--
P
A
E
G
G
E
G
E
E
V
-
V
V
D
----
K
V
L
----
V
A
V
G
----
R
K
P
R
T
E
G
L
G
L
E
K
A
G
V
K
V
D
E
R
G
------
F
I
R
---
V
----
N
A
R
M
E
T
S
V
P
G
V
Y
A
I
G
D
A
A
R
P
P
L
L
A
H
K
A
M
R
E
G
L
I
A
A
E
N
A
A
G
K
D
S
A
F
D
Y
Q
V
P
S
V
V
Y
T
S
P
E
W
A
G
V
G
L
T
E
E
E
A
K
R
A
G
Y
K
V
K
V
G
K
F
P
L
A
A
S
G
R
A
L
T
----
77
PsiBlast_CBE
40.48
44%
-88
- C3 -
2EQ9
1
?
D:
[4-44]
M
K
T
Y
D
L
I
V
I
G
T
G
P
G
G
Y
H
A
A
I
R
A
A
Q
L
G
L
K
V
L
A
V
E
---------
A
G
E
V
G
G
V
C
L
N
V
G
-
C
I
P
T
K
A
L
L
H
A
-
A
E
T
L
H
H
L
K
V
A
E
G
F
G
L
K
A
K
P
E
L
D
L
K
K
L
G
G
W
R
D
Q
V
V
K
K
L
T
G
G
V
G
T
L
L
K
G
N
G
V
E
L
L
R
G
F
A
R
L
V
G
P
K
E
V
E
V
G
G
E
R
Y
G
A
K
S
--
L
---
I
----
L
A
-
T
--
G
S
E
--
P
L
-
E
L
K
G
F
P
F
G
E
D
V
W
D
S
T
R
A
L
K
V
E
E
G
L
P
K
R
L
L
V
I
G
G
G
A
V
G
L
E
L
G
Q
V
Y
R
R
L
G
---
A
E
V
T
---
L
----
I
E
Y
M
P
E
I
L
P
Q
G
D
P
-
E
T
--
A
-
A
L
L
--
R
R
--
A
--
L
E
K
E
G
I
R
V
R
T
K
T
K
A
V
G
Y
E
K
K
K
D
G
L
--------
H
--------
V
R
L
E
--
P
A
E
G
G
E
G
E
E
V
-
V
V
D
----
K
V
L
----
V
A
V
G
----
R
K
P
R
T
E
G
L
G
L
E
K
A
G
V
K
V
D
E
R
G
------
F
I
R
---
V
----
N
A
R
M
E
T
S
V
P
G
V
Y
A
I
G
D
A
A
R
P
P
L
L
A
H
K
A
M
R
E
G
L
I
A
A
E
N
A
A
G
K
D
S
A
F
D
Y
Q
V
P
S
V
V
Y
T
S
P
E
W
A
G
V
G
L
T
E
E
E
A
K
R
A
G
Y
K
V
K
V
G
K
F
P
L
A
A
S
G
R
A
L
T
----
71
PsiBlast_CBE
39.68
42%
-106
- C3 -
3II4
1
DLDH_MYCTU
B:
[3-35]
M
T
H
Y
D
V
V
V
L
G
A
G
P
G
G
Y
V
A
A
I
R
A
A
Q
L
G
L
S
T
A
I
V
E
P
K
Y
W
G
G
V
C
L
N
V
G
C
I
P
S
K
A
L
L
R
-
N
A
E
L
V
H
I
F
T
K
-
D
A
K
A
F
G
I
S
G
E
V
T
F
D
Y
G
I
A
Y
D
R
S
R
K
V
A
E
G
R
V
A
G
V
H
F
L
M
K
K
N
K
I
T
E
I
H
G
Y
G
T
F
A
D
A
N
T
L
L
V
D
L
N
D
G
G
T
E
S
V
T
F
D
N
A
I
I
--
A
---
T
----
G
S
-
S
--
T
R
L
--
V
P
-
G
T
S
L
S
A
N
V
V
T
Y
E
E
Q
I
L
S
R
E
L
P
K
S
I
I
I
A
G
A
G
A
I
G
M
E
F
G
Y
V
L
K
N
Y
G
V
D
V
T
---
I
V
E
F
---
L
----
P
R
A
L
P
N
E
D
A
D
V
S
K
-
E
I
--
E
-
K
Q
F
--
K
K
--
L
--
G
V
T
I
L
T
A
T
K
V
E
S
I
A
D
G
G
S
Q
V
T
V
T
V
--------
T
--------
K
D
G
V
--
A
Q
E
L
K
A
E
K
V
L
-
Q
A
I
----
G
F
A
----
P
N
V
E
----
G
Y
G
L
D
K
A
G
V
A
L
T
D
R
K
A
I
G
V
D
D
------
Y
M
R
---
T
----
N
V
G
H
I
Y
A
I
G
D
V
N
G
L
L
Q
L
A
H
V
A
E
A
Q
G
V
V
A
A
E
T
I
A
G
A
E
T
L
T
L
G
D
H
R
M
L
P
R
A
T
F
C
Q
P
N
V
A
S
F
G
L
T
E
Q
Q
A
R
N
E
G
Y
D
V
V
V
A
K
F
P
F
T
A
N
A
K
A
H
G
V
G
D
----
68
PsiBlast_CBE
39.59
42%
-106
- C3 -
4M52
2
DLDH_MYCTU
C:
[3-35]
M
T
H
Y
D
V
V
V
L
G
A
G
P
G
G
Y
V
A
A
I
R
A
A
Q
L
G
L
S
T
A
I
V
E
P
K
Y
W
G
G
V
C
L
N
V
G
C
I
P
S
K
A
L
L
R
-
N
A
E
L
V
H
I
F
T
K
-
D
A
K
A
F
G
I
S
G
E
V
T
F
D
Y
G
I
A
Y
D
R
S
R
K
V
A
E
G
R
V
A
G
V
H
F
L
M
K
K
N
K
I
T
E
I
H
G
Y
G
T
F
A
D
A
N
T
L
L
V
D
L
N
D
G
G
T
E
S
V
T
F
D
N
A
I
I
--
A
---
T
----
G
S
-
S
--
T
R
L
--
V
P
-
G
T
S
L
S
A
N
V
V
T
Y
E
E
Q
I
L
S
R
E
L
P
K
S
I
I
I
A
G
A
G
A
I
G
M
E
F
G
Y
V
L
K
N
Y
G
V
D
V
T
---
I
V
E
F
---
L
----
P
R
A
L
P
N
E
D
A
D
V
S
K
-
E
I
--
E
-
K
Q
F
--
K
K
--
L
--
G
V
T
I
L
T
A
T
K
V
E
S
I
A
D
G
G
S
Q
V
T
V
T
V
--------
T
--------
K
D
G
V
--
A
Q
E
L
K
A
E
K
V
L
-
Q
A
I
----
G
F
A
----
P
N
V
E
----
G
Y
G
L
D
K
A
G
V
A
L
T
D
R
K
A
I
G
V
D
D
------
Y
M
R
---
T
----
N
V
G
H
I
Y
A
I
G
D
V
N
G
L
L
Q
L
A
H
V
A
E
A
Q
G
V
V
A
A
E
T
I
A
G
A
E
T
L
T
L
G
D
H
R
M
L
P
R
A
T
F
C
Q
P
N
V
A
S
F
G
L
T
E
Q
Q
A
R
N
E
G
Y
D
V
V
V
A
K
F
P
F
T
A
N
A
K
A
H
G
V
G
D
----
9
PsiBlast_PDB
39.36
47%
-104
- C3 -
2EQ7
1
?
A:
[2-37]
---
Y
D
L
L
V
I
G
A
G
P
G
G
Y
V
A
A
I
R
A
A
Q
L
G
M
K
V
G
V
V
E
K
E
K
A
L
G
G
T
C
L
R
V
G
C
I
P
S
K
A
L
L
-
E
T
T
E
R
I
Y
E
A
K
-
K
G
L
L
G
A
K
V
K
G
V
E
L
D
L
P
A
L
M
A
H
K
D
K
V
V
Q
A
N
T
Q
G
V
E
F
L
F
K
K
N
G
I
A
R
H
Q
G
T
A
R
F
L
S
E
R
K
V
L
V
E
E
T
G
E
E
L
E
A
R
Y
I
L
I
A
T
G
--
S
---
A
----
P
L
-
I
--
P
P
W
--
A
Q
-
V
D
Y
E
R
V
V
T
S
T
E
A
L
S
F
P
E
V
P
K
R
L
I
V
V
G
G
G
V
I
G
L
E
L
G
V
V
W
H
R
L
G
A
E
V
I
V
L
---
E
Y
M
D
---
R
----
I
L
P
T
M
D
L
E
V
S
R
A
A
-
E
R
--
V
-
F
K
K
--
Q
G
--
L
--
T
I
R
T
G
V
R
V
T
A
V
V
P
E
A
K
G
A
R
V
E
L
E
G
--------
G
--------
E
V
L
E
--
A
D
R
V
L
V
A
V
G
R
-
R
P
Y
----
T
E
G
----
L
S
L
E
----
N
A
G
L
S
T
D
E
R
G
R
I
P
V
D
E
H
L
R
T
R
------
V
P
H
---
I
----
Y
A
I
G
D
V
V
R
G
P
M
L
A
H
K
A
S
E
E
G
I
A
A
V
E
H
M
V
R
G
F
G
H
V
D
Y
Q
A
I
P
S
V
V
Y
T
H
P
E
I
A
A
V
G
Y
T
E
E
E
L
K
A
Q
G
I
P
Y
K
V
G
K
F
P
Y
S
A
S
G
R
A
R
A
M
G
E
T
E
G
F
I
K
V
----
75
PsiBlast_CBE
39.07
44%
-88
- C3 -
2EQ9
1
?
G:
[4-44]
M
K
T
Y
D
L
I
V
I
G
T
G
P
G
G
Y
H
A
A
I
R
A
A
Q
L
G
L
K
V
L
A
V
E
---------
A
G
E
V
G
G
V
C
L
N
V
G
-
C
I
P
T
K
A
L
L
H
A
-
A
E
T
L
H
H
L
K
V
A
E
G
F
G
L
K
A
K
P
E
L
D
L
K
K
L
G
G
W
R
D
Q
V
V
K
K
L
T
G
G
V
G
T
L
L
K
G
N
G
V
E
L
L
R
G
F
A
R
L
V
G
P
K
E
V
E
V
G
G
E
R
Y
G
A
K
S
--
L
---
I
----
L
A
-
T
--
G
S
E
--
P
L
-
E
L
K
G
F
P
F
G
E
D
V
W
D
S
T
R
A
L
K
V
E
E
G
L
P
K
R
L
L
V
I
G
G
G
A
V
G
L
E
L
G
Q
V
Y
R
R
L
G
---
A
E
V
T
---
L
----
I
E
Y
M
P
E
I
L
P
Q
G
D
P
-
E
T
--
A
-
A
L
L
--
R
R
--
A
--
L
E
K
E
G
I
R
V
R
T
K
T
K
A
V
G
Y
E
K
K
K
D
G
L
--------
H
--------
V
R
L
E
--
P
A
E
G
G
E
G
E
E
V
-
V
V
D
----
K
V
L
----
V
A
V
G
----
R
K
P
R
T
E
G
L
G
L
E
K
A
G
V
K
V
D
E
R
G
------
F
I
R
---
V
----
N
A
R
M
E
T
S
V
P
G
V
Y
A
I
G
D
A
A
R
P
P
L
L
A
H
K
A
M
R
E
G
L
I
A
A
E
N
A
A
G
K
D
S
A
F
D
Y
Q
V
P
S
V
V
Y
T
S
P
E
W
A
G
V
G
L
T
E
E
E
A
K
R
A
G
Y
K
V
K
V
G
K
F
P
L
A
A
S
G
R
A
L
T
----
73
PsiBlast_CBE
39.07
44%
-83
- C3 -
2EQ9
1
?
J:
[4-44]
M
K
T
Y
D
L
I
V
I
G
T
G
P
G
G
Y
H
A
A
I
R
A
A
Q
L
G
L
K
V
L
A
V
E
---------
A
G
E
V
G
G
V
C
L
N
V
G
-
C
I
P
T
K
A
L
L
H
A
-
A
E
T
L
H
H
L
K
V
A
E
G
F
G
L
K
A
K
P
E
L
D
L
K
K
L
G
G
W
R
D
Q
V
V
K
K
L
T
G
G
V
G
T
L
L
K
G
N
G
V
E
L
L
R
G
F
A
R
L
V
G
P
K
E
V
E
V
G
G
E
R
Y
G
A
K
S
--
L
---
I
----
L
A
-
T
--
G
S
E
--
P
L
-
E
L
K
G
F
P
F
G
E
D
V
W
D
S
T
R
A
L
K
V
E
E
G
L
P
K
R
L
L
V
I
G
G
G
A
V
G
L
E
L
G
Q
V
Y
R
R
L
G
---
A
E
V
T
---
L
----
I
E
Y
M
P
E
I
L
P
Q
G
D
P
-
E
T
--
A
-
A
L
L
--
R
R
--
A
--
L
E
K
E
G
I
R
V
R
T
K
T
K
A
V
G
Y
E
K
K
K
D
G
L
--------
H
--------
V
R
L
E
--
P
A
E
G
G
E
G
E
E
V
-
V
V
D
----
K
V
L
----
V
A
V
G
----
R
K
P
R
T
E
G
L
G
L
E
K
A
G
V
K
V
D
E
R
G
------
F
I
R
---
V
----
N
A
R
M
E
T
S
V
P
G
V
Y
A
I
G
D
A
A
R
P
P
L
L
A
H
K
A
M
R
E
G
L
I
A
A
E
N
A
A
G
K
D
S
A
F
D
Y
Q
V
P
S
V
V
Y
T
S
P
E
W
A
G
V
G
L
T
E
E
E
A
K
R
A
G
Y
K
V
K
V
G
K
F
P
L
A
A
S
G
R
A
L
T
----