@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 : PA0892: (2016-01-23 )
MYKLEVQDLHKRYGSHEVLKGVSLAAKAGDVISIIGSSGSGKSTFLRCINLLEQPHAGKILLNGEELKLVPGRDGALKAADSRQLQRMRSRLSMVFQHFNLWSHMSALENVIEAPVHVLGVSKKEAIEKAEHYLAKVGVAHRKDAYPAHMSGGEQQRVAIARALAVEPEVMLFDEPTSALDPELVGEVLKVMQDLAQEGRTMVVVTHEMGFAREVSNQLVFLHKGLVEEHGCPKEVLANPQSDRLKQFLSGSLK
Atome Classification :
(32 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..---
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
M
Y
K
L
E
V
Q
D
L
H
K
RYG
S
-
H
E
---
V
L
K
G
V
S
L
AAKAG
D
V
I
S
I
IGSSGS
G
K
S
T
F
L
R
C
I
N
L
LEQP-HA
G
K
I
L
LNG----------E
E
L
K
L
VPGRDGALKA
A
D
S
R
Q
L
Q
--
R
M
R
-
S
R
-
L
S
M
V
F
Q
H
F
N
L
W
S
H
M
S
A
L
E
N
V
I
EA
P
V
H
V
LGV
S
K
K
E
A
I
E
K
A
E
H
Y
L
A
K
VGVAHR-K-DAY----PA-------HMSGG
E
Q
Q
R
V
A
I
A
R
A
LAV-EP
E
V
M
L
F
DEPTSAL
D
P
E
---
L
V
G
E
V
L
K
V
M
Q
D
L
A
QE-G
R
T
M
V
V
V
T
HEMG
F
A
R
E
V
SNQ
L
V
F
L
H
K
-
G
L
V
EEHG
C
P
K
E
V
LANP
Q
-
S
D
R
L
K
Q
F
L
SGSLK---
122
HHSearch
98.61
70%
-107
- C1 -
1B0U
4
HISP_SALTY
A:
[6-257]
--
K
L
H
V
I
D
L
H
K
R
Y
G
G
-
H
E
---
V
L
K
G
V
S
L
Q
A
R
A
G
D
V
I
S
I
I
G
S
S
G
S
G
K
S
T
F
L
R
C
I
N
F
L
E
K
P
-
S
E
G
A
I
I
V
N
G
----------
Q
N
I
N
L
V
R
D
K
D
G
Q
L
K
V
A
D
K
N
Q
L
R
--
L
L
R
-
T
R
-
L
T
M
V
F
Q
H
F
N
L
W
S
H
M
T
V
L
E
N
V
M
E
A
P
I
Q
V
L
G
L
S
K
H
D
A
R
E
R
A
L
K
Y
L
A
K
V
G
I
D
E
R
-
A
Q
G
K
Y
----
P
V
-------
H
L
S
G
G
Q
Q
Q
R
V
S
I
A
R
A
L
A
M
-
E
P
D
V
L
L
F
D
E
P
T
S
A
L
D
P
E
---
L
V
G
E
V
L
R
I
M
Q
Q
L
A
E
E
-
G
K
T
M
V
V
V
T
H
E
M
G
F
A
R
H
V
S
S
H
V
I
F
L
H
Q
-
G
K
I
E
E
E
G
D
P
E
Q
V
F
G
N
P
Q
-
S
P
R
L
Q
Q
F
L
K
G
S
L
K
---
1
PsiBlast_PDB
98.51
69%
-107
- C1 -
1B0U
4
HISP_SALTY
A:
[6-258]
--
K
L
H
V
I
D
L
H
K
R
Y
G
G
-
H
E
---
V
L
K
G
V
S
L
Q
A
R
A
G
D
V
I
S
I
I
G
S
S
G
S
G
K
S
T
F
L
R
C
I
N
F
L
E
K
P
-
S
E
G
A
I
I
V
N
G
----------
Q
N
I
N
L
V
R
D
K
D
G
Q
L
K
V
A
D
K
N
Q
L
R
--
L
L
R
-
T
R
-
L
T
M
V
F
Q
H
F
N
L
W
S
H
M
T
V
L
E
N
V
M
E
A
P
I
Q
V
L
G
L
S
K
H
D
A
R
E
R
A
L
K
Y
L
A
K
V
G
I
D
E
R
A
Q
-
G
K
Y
----
P
V
-------
H
L
S
G
G
Q
Q
Q
R
V
S
I
A
R
A
L
A
M
-
E
P
D
V
L
L
F
D
E
P
T
S
A
L
D
P
E
---
L
V
G
E
V
L
R
I
M
Q
Q
L
A
E
E
-
G
K
T
M
V
V
V
T
H
E
M
G
F
A
R
H
V
S
S
H
V
I
F
L
H
Q
-
G
K
I
E
E
E
G
D
P
E
Q
V
F
G
N
P
Q
-
S
P
R
L
Q
Q
F
L
K
G
S
L
K
---
102
Fugue
95.13
69%
-113
- C1 -
1B0U
4
HISP_SALTY
A:
[5-261]
-
N
K
L
H
V
I
D
L
H
K
R
Y
G
G
H
E
V
---
L
K
-
G
V
S
L
Q
A
R
A
G
D
V
I
S
I
I
G
S
S
G
S
G
K
S
T
F
L
R
C
I
N
F
L
E
K
P
S-
E
G
A
I
I
V
N
G
QNI
N
L
V
R
D
KD----------
G
Q
L
K
V
A
D
K
N
Q
L
R
--
L
L
R
-
T
-
R
L
T
M
V
F
Q
H
F
N
L
W
S
H
M
T
V
L
E
N
V
M
E
A
P
I
Q
V
L
G
L
S
K
H
D
A
R
E
R
A
L
K
Y
L
A
K
V
G
I
D
E
R
-
A
-
Q
G
-KY--
P
V
-------
H
L
S
G
G
Q
Q
Q
R
V
S
I
A
R
A
L
A
M
E-
P
D
V
L
L
F
D
E
P
T
S
A
L
D
P
E
---
L
V
G
E
V
L
R
I
M
Q
Q
L
A
E
E
-
G
K
T
M
V
V
V
T
H
E
M
G
F
A
R
H
V
S
S
H
V
I
F
L
H
-Q
G
K
I
E
E
E
G
D
P
E
Q
V
F
G
N
P
-Q
S
P
R
L
Q
Q
F
L
K
G
S
L
K
KLE
5
PsiBlast_PDB
86.09
53%
-112
- C1 -
4YMV
1
?
J:
[4-240]
-----
V
N
D
V
Y
K
N
F
G
S
-
L
E
---
V
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
-
T
K
G
E
V
F
I
D
G
------------
V
K
I
N
N
G
K
---------
V
N
I
N
--
K
V
R
-
Q
K
-
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
T
L
A
P
V
K
V
K
K
M
N
K
K
E
A
E
E
L
A
V
D
L
L
A
K
V
G
L
L
D
K
-
K
-
D
Q
Y
----
P
I
-------
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
-
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
K
E
V
L
N
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
D
D
-
G
V
I
V
E
E
G
T
P
E
E
I
F
Y
R
A
K
-
N
E
R
T
R
E
F
L
S
K
I
L
----
22
PsiBlast_CBE
85.50
53%
-110
- C1 -
4YMU
2
?
A:
[4-240]
-----
V
N
D
V
Y
K
N
F
G
S
-
L
E
---
V
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
-
T
K
G
E
V
F
I
D
G
------------
V
K
I
N
N
G
K
---------
V
N
I
N
--
K
V
R
-
Q
K
-
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
T
L
A
P
V
K
V
K
K
M
N
K
K
E
A
E
E
L
A
V
D
L
L
A
K
V
G
L
L
D
K
-
K
-
D
Q
Y
----
P
I
-------
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
-
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
K
E
V
L
N
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
D
D
-
G
V
I
V
E
E
G
T
P
E
E
I
F
Y
R
A
K
-
N
E
R
T
R
E
F
L
S
K
I
L
----
3
PsiBlast_PDB
84.81
53%
-110
- C1 -
4YMT
-
?
J:
[4-240]
-----
V
N
D
V
Y
K
N
F
G
S
-
L
E
---
V
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
-
T
K
G
E
V
F
I
D
G
------------
V
K
I
N
N
G
K
---------
V
N
I
N
--
K
V
R
-
Q
K
-
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
T
L
A
P
V
K
V
K
K
M
N
K
K
E
A
E
E
L
A
V
D
L
L
A
K
V
G
L
L
D
K
-
K
-
D
Q
Y
----
P
I
-------
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
-
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
K
E
V
L
N
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
D
D
-
G
V
I
V
E
E
G
T
P
E
E
I
F
Y
R
A
K
-
N
E
R
T
R
E
F
L
S
K
I
L
----
26
PsiBlast_CBE
84.71
51%
-106
- C1 -
2OUK
2
?
D:
[25-260]
---
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
-----------
A
K
D
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
2
PsiBlast_PDB
84.69
53%
-110
- C1 -
4YMS
-
?
J:
[4-240]
-----
V
N
D
V
Y
K
N
F
G
S
-
L
E
---
V
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
-
T
K
G
E
V
F
I
D
G
------------
V
K
I
N
N
G
K
---------
V
N
I
N
--
K
V
R
-
Q
K
-
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
T
L
A
P
V
K
V
K
K
M
N
K
K
E
A
E
E
L
A
V
D
L
L
A
K
V
G
L
L
D
K
-
K
-
D
Q
Y
----
P
I
-------
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
-
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
K
E
V
L
N
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
D
D
-
G
V
I
V
E
E
G
T
P
E
E
I
F
Y
R
A
K
-
N
E
R
T
R
E
F
L
S
K
I
L
----
6
PsiBlast_PDB
84.62
53%
-113
- C1 -
4YMW
-
?
J:
[4-240]
-----
V
N
D
V
Y
K
N
F
G
S
-
L
E
---
V
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
-
T
K
G
E
V
F
I
D
G
------------
V
K
I
N
N
G
K
---------
V
N
I
N
--
K
V
R
-
Q
K
-
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
T
L
A
P
V
K
V
K
K
M
N
K
K
E
A
E
E
L
A
V
D
L
L
A
K
V
G
L
L
D
K
-
K
-
D
Q
Y
----
P
I
-------
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
-
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
K
E
V
L
N
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
D
D
-
G
V
I
V
E
E
G
T
P
E
E
I
F
Y
R
A
K
-
N
E
R
T
R
E
F
L
S
K
I
L
----
21
PsiBlast_CBE
84.52
53%
-110
- C1 -
4YMV
1
?
A:
[4-240]
-----
V
N
D
V
Y
K
N
F
G
S
-
L
E
---
V
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
-
T
K
G
E
V
F
I
D
G
------------
V
K
I
N
N
G
K
---------
V
N
I
N
--
K
V
R
-
Q
K
-
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
T
L
A
P
V
K
V
K
K
M
N
K
K
E
A
E
E
L
A
V
D
L
L
A
K
V
G
L
L
D
K
-
K
-
D
Q
Y
----
P
I
-------
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
-
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
K
E
V
L
N
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
D
D
-
G
V
I
V
E
E
G
T
P
E
E
I
F
Y
R
A
K
-
N
E
R
T
R
E
F
L
S
K
I
L
----
29
PsiBlast_CBE
84.50
51%
-107
- C1 -
2OLK
1
?
D:
[25-260]
---
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
-----------
A
K
D
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
4
PsiBlast_PDB
84.14
53%
-106
- C1 -
4YMU
2
?
J:
[4-240]
-----
V
N
D
V
Y
K
N
F
G
S
-
L
E
---
V
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
-
T
K
G
E
V
F
I
D
G
------------
V
K
I
N
N
G
K
---------
V
N
I
N
--
K
V
R
-
Q
K
-
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
T
L
A
P
V
K
V
K
K
M
N
K
K
E
A
E
E
L
A
V
D
L
L
A
K
V
G
L
L
D
K
-
K
-
D
Q
Y
----
P
I
-------
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
-
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
K
E
V
L
N
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
D
D
-
G
V
I
V
E
E
G
T
P
E
E
I
F
Y
R
A
K
-
N
E
R
T
R
E
F
L
S
K
I
L
----
34
PsiBlast_CBE
84.10
50%
-103
- C1 -
4U02
1
?
C:
[5-242]
---
I
R
I
R
N
L
H
K
W
F
G
P
-
L
H
---
V
L
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
-
Q
E
G
E
V
V
V
D
G
----------------------
L
S
V
K
D
D
R
A
L
R
--
E
I
R
-
R
E
-
V
G
M
V
F
Q
Q
F
N
L
F
P
H
M
T
V
L
E
N
V
T
L
A
P
M
R
V
R
R
W
P
R
E
K
A
E
K
K
A
L
E
L
L
E
R
V
G
I
L
D
Q
-
A
-
R
K
Y
----
P
A
-------
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
D
V
M
R
D
L
A
Q
G
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
A
D
R
V
V
F
M
D
G
-
G
Q
I
V
E
E
G
R
P
E
E
I
F
T
R
P
K
-
E
E
R
T
R
S
F
L
Q
R
V
L
H
---
24
PsiBlast_CBE
83.90
51%
-107
- C1 -
3C4J
4
?
B:
[25-260]
---
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
-----------
A
K
D
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
10
PsiBlast_PDB
83.84
51%
-108
- C1 -
2OUK
1
?
A:
[25-260]
---
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
-----------
A
K
D
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
30
PsiBlast_CBE
83.80
51%
-104
- C1 -
2OLK
1
?
C:
[25-260]
---
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
-----------
A
K
D
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
33
PsiBlast_CBE
83.73
50%
-101
- C1 -
4U02
1
?
D:
[5-242]
---
I
R
I
R
N
L
H
K
W
F
G
P
-
L
H
---
V
L
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
-
Q
E
G
E
V
V
V
D
G
----------------------
L
S
V
K
D
D
R
A
L
R
--
E
I
R
-
R
E
-
V
G
M
V
F
Q
Q
F
N
L
F
P
H
M
T
V
L
E
N
V
T
L
A
P
M
R
V
R
R
W
P
R
E
K
A
E
K
K
A
L
E
L
L
E
R
V
G
I
L
D
Q
-
A
-
R
K
Y
----
P
A
-------
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
D
V
M
R
D
L
A
Q
G
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
A
D
R
V
V
F
M
D
G
-
G
Q
I
V
E
E
G
R
P
E
E
I
F
T
R
P
K
-
E
E
R
T
R
S
F
L
Q
R
V
L
H
---
8
PsiBlast_PDB
83.50
51%
-108
- C1 -
2OLJ
4
?
A:
[25-260]
---
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
-----------
A
K
D
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
14
PsiBlast_PDB
83.49
50%
-100
- C1 -
4U02
1
?
A:
[5-242]
---
I
R
I
R
N
L
H
K
W
F
G
P
-
L
H
---
V
L
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
-
Q
E
G
E
V
V
V
D
G
----------------------
L
S
V
K
D
D
R
A
L
R
--
E
I
R
-
R
E
-
V
G
M
V
F
Q
Q
F
N
L
F
P
H
M
T
V
L
E
N
V
T
L
A
P
M
R
V
R
R
W
P
R
E
K
A
E
K
K
A
L
E
L
L
E
R
V
G
I
L
D
Q
-
A
-
R
K
Y
----
P
A
-------
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
D
V
M
R
D
L
A
Q
G
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
A
D
R
V
V
F
M
D
G
-
G
Q
I
V
E
E
G
R
P
E
E
I
F
T
R
P
K
-
E
E
R
T
R
S
F
L
Q
R
V
L
H
---
121
HHSearch
83.48
53%
-104
- C1 -
2OLJ
4
?
A:
[22-260]
L
Q
M
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
A
K
D
-----------
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
7
PsiBlast_PDB
83.28
51%
-102
- C1 -
3C41
3
?
J:
[4-239]
---
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
-----------
A
K
D
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
13
PsiBlast_PDB
82.86
50%
-102
- C1 -
4U00
3
?
A:
[5-242]
---
I
R
I
R
N
L
H
K
W
F
G
P
-
L
H
---
V
L
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
-
Q
E
G
E
V
V
V
D
G
----------------------
L
S
V
K
D
D
R
A
L
R
--
E
I
R
-
R
E
-
V
G
M
V
F
Q
Q
F
N
L
F
P
H
M
T
V
L
E
N
V
T
L
A
P
M
R
V
R
R
W
P
R
E
K
A
E
K
K
A
L
E
L
L
E
R
V
G
I
L
D
Q
-
A
-
R
K
Y
----
P
A
-------
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
D
V
M
R
D
L
A
Q
G
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
A
D
R
V
V
F
M
D
G
-
G
Q
I
V
E
E
G
R
P
E
E
I
F
T
R
P
K
-
E
E
R
T
R
S
F
L
Q
R
V
L
H
---
31
PsiBlast_CBE
82.58
51%
-105
- C1 -
2OLK
2
?
B:
[25-260]
---
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
-----------
A
K
D
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
23
PsiBlast_CBE
82.58
51%
-103
- C1 -
3C41
3
?
K:
[4-239]
---
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
-----------
A
K
D
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
9
PsiBlast_PDB
82.58
51%
-104
- C1 -
2OLK
1
?
A:
[25-260]
---
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
-----------
A
K
D
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
12
PsiBlast_PDB
82.18
51%
-102
- C1 -
3C4J
3
?
A:
[25-260]
---
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
-----------
A
K
D
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
11
PsiBlast_PDB
82.15
51%
-102
- C1 -
2Q0H
4
?
A:
[25-260]
---
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
-----------
A
K
D
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
25
PsiBlast_CBE
82.00
51%
-107
- C1 -
2Q0H
4
?
B:
[25-260]
---
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
-----------
A
K
D
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
32
PsiBlast_CBE
80.12
51%
-103
- C1 -
2OLJ
3
?
B:
[25-260]
---
I
D
V
H
Q
L
K
K
S
F
G
S
-
L
E
---
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
-
D
E
G
E
I
I
I
D
G
----------
I
N
L
K
-----------
A
K
D
T
N
L
N
--
K
V
R
-
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
W
P
R
E
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
-
H
A
Y
----
P
D
-------
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
---
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
D
G
-
G
Y
I
I
E
E
G
K
P
E
D
L
F
D
R
P
Q
-
H
E
R
T
K
A
F
L
S
K
V
F
----
97
PsiBlast_CBE
62.36
31%
-96
- C1 -
4AYX
2
ABCBA_HUMAN
A:
[342-573]
---
L
E
F
K
N
V
H
F
A
Y
P
A
-
R
P
EVP
I
F
Q
D
F
S
L
S
I
P
S
G
S
V
T
A
L
V
G
P
S
G
S
G
K
S
T
V
L
S
L
L
L
R
L
Y
D
P
-
A
S
G
T
I
S
L
D
G
----------
H
---------------
D
I
R
Q
L
N
P
V
W
L
R
-
S
K
-
I
G
T
V
S
Q
E
P
I
L
F
S
-
C
S
I
A
E
N
I
A
Y
G
A
D
D
P
S
S
V
T
A
E
E
I
Q
R
V
A
E
V
A
N
A
V
A
F
I
R
N
F
-
P
-
Q
G
F
----
N
T
V
V
G
EK
G
V
L
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
L
L
K
-
N
P
K
I
L
L
L
D
E
A
T
S
A
L
D
A
E
N
E
Y
L
V
Q
E
A
L
D
R
L
M
D
-----
G
R
T
V
L
V
I
A
H
R
L
S
T
I
K
N
-
A
N
M
V
A
V
L
D
Q
-
G
K
I
T
E
Y
G
K
H
E
E
L
L
S
K
P
N
-
G
---------------
51
PsiBlast_CBE
59.23
36%
-100
- C1 -
3TIF
7
Y796_METJA
A:
[21-224]
----------------------
L
K
N
V
N
L
N
I
K
E
G
E
F
V
S
I
M
G
P
S
G
S
G
K
S
T
M
L
N
I
I
G
C
L
D
K
P
-
T
E
G
E
V
Y
I
D
N
---------------
I
K
T
N
D
-----
L
D
D
D
E
L
T
--
K
I
R
R
D
K
-
I
G
F
V
F
Q
Q
F
N
L
I
P
L
L
T
A
L
E
N
V
-
E
L
P
L
I
F
K
Y
R
G
A
M
S
G
E
E
R
R
K
R
A
L
E
C
L
K
M
A
E
L
-
E
-
E
R
F
ANHK
P
N
-------
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
N
-
N
P
P
I
I
L
A
D
Q
P
T
W
A
L
D
S
K
---
T
G
E
K
I
M
Q
L
L
K
K
L
N
E
E
D
G
K
T
V
V
V
V
T
H
D
I
N
V
A
R
-
F
G
E
R
I
I
Y
L
K
D
-
G
E
V
E
R
E
E
K
L
R
------------------------
50
PsiBlast_CBE
57.20
36%
-102
- C1 -
3TIF
6
Y796_METJA
B:
[21-224]
----------------------
L
K
N
V
N
L
N
I
K
E
G
E
F
V
S
I
M
G
P
S
G
S
G
K
S
T
M
L
N
I
I
G
C
L
D
K
P
-
T
E
G
E
V
Y
I
D
N
---------------
I
K
T
N
D
-----
L
D
D
D
E
L
T
--
K
I
R
R
D
K
-
I
G
F
V
F
Q
Q
F
N
L
I
P
L
L
T
A
L
E
N
V
-
E
L
P
L
I
F
K
Y
R
G
A
M
S
G
E
E
R
R
K
R
A
L
E
C
L
K
M
A
E
L
-
E
-
E
R
F
ANHK
P
N
-------
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
N
-
N
P
P
I
I
L
A
D
Q
P
T
W
A
L
D
S
K
---
T
G
E
K
I
M
Q
L
L
K
K
L
N
E
E
D
G
K
T
V
V
V
V
T
H
D
I
N
V
A
R
-
F
G
E
R
I
I
Y
L
K
D
-
G
E
V
E
R
E
E
K
L
R
G
F
----------------------