@TOME V2.3
(Mar 2018)
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 : spr1087: (2018-01-04 )
MKKQEKLALVESALEDFYGDQQFASSLRESVLYSIHAGGKRIRPFLLLEVLEALQVAIKPAHAQVATALEMIHTGSLIHDDLPAMDDDDYRRGRLTNHKKFGEAMAILAGDALFLDPYALIAQADLPSQIKVDLIANLSLASGSLGMVAGQVLDMEGEHQHLSLEELQTIHANKTGKLLAYPFQAAAIIAELSPEMQVKLKTVGELIGLAFQVRDDVLDVTASFEEIGKTPQKDLQAEKSTYPALLGLEESIAFCNQTLDQANEKLEEIAQQVPFETESIVSVVESLRING
Atome Classification :
(57 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
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MK
K
Q
E
K
L
A
L
V
E
S
A
L
E
D
FYG
D
Q
-
Q
-
F
A
S
-
S
L
R
E
S
V
L
Y
SIHAGGKR
I
R
P
F
L
L
L
E
V
L
E
A
L
-----
Q
V
A
------IK-P-
A
H
A
Q
-
V
A
T
A
L
E
M
I
HTGSLIHDDLPAMDD
D
D
YRRGRLT
N
H
K
K
F
G
E
A
M
A
I
LAGD
A
L
F
L
D
P
Y
A
L
I
AQ--A--D-L--P---S---------
Q
I
K
V
D
L
I
A
N
L
SLASGS
L
G
M
V
A-
G
Q
V
LD-MEGEHQ--H--L
S
L
E
E
---
L
Q
T
I
HANKTG
K
L
L
A
Y
P
F
Q
A
A
A
I
-
I
A
EL-S-P
E
M
Q
V
K
-
L
K
-
T
V
G
E
L
I
G
L
A
F
Q
VRD
D
V
L
D
V
T
A
S
F
E
E
IGKT
P
Q
K
D
L
Q
A
EKSTY
P
A
L
LG
L
E
E
S
I
A
F
-------
C
N
Q
T
L
D
Q
A
N
E
K
L
E
E
I
A
Q
Q--VP-F
E
T
E
-----
S
I
V
S
V
V
E
S
LRING
21
PsiBlast_CBE
82.60
56%
-12
- C1 -
-
4LFG
2
?
B:
[3-290]
----
D
K
L
K
K
I
D
Q
T
I
H
A
F
Y
C
E
K
-
A
-
V
I
S
E
K
L
N
E
A
V
L
Y
S
I
N
A
G
G
K
R
I
R
P
I
L
F
L
E
V
I
E
A
L
-----
Q
I
P
------
L
T
-
E
-
S
H
F
K
-
A
A
A
A
L
E
M
I
H
T
G
S
L
I
H
D
D
L
P
A
M
D
N
D
D
Y
R
R
G
Q
L
T
N
H
K
K
F
D
E
A
T
A
I
L
A
G
D
S
L
F
L
D
A
F
G
M
L
A
E
--
T
--
D
-
F
--
P
---
T
---------
D
V
T
V
D
L
V
R
S
L
S
S
A
S
G
T
F
G
M
V
G
-
G
Q
M
L
D
-
M
A
A
E
G
K
--
K
--
L
N
L
K
N
---
L
Q
L
I
H
R
H
K
T
G
Q
L
L
A
Y
P
F
W
A
A
A
R
-
V
A
Q
L
-
D
-
E
N
L
L
A
T
-
F
L
-
E
I
G
M
I
I
G
L
A
F
Q
V
R
D
D
I
L
D
I
T
A
N
F
E
E
I
G
K
T
P
K
K
D
V
M
A
E
K
M
T
Y
P
H
L
L
G
L
N
E
S
Y
Q
I
-------
L
D
E
S
L
D
Q
A
E
A
I
L
R
K
L
S
D
E
--
I
A
-
F
A
P
Q
-----
K
I
L
S
L
I
E
R
L
R
L
D
A
22
PsiBlast_CBE
81.98
56%
-13
- C1 -
-
4LFE
2
?
B:
[3-290]
----
D
K
L
K
K
I
D
Q
T
I
H
A
F
Y
C
E
K
-
A
-
V
I
S
E
K
L
N
E
A
V
L
Y
S
I
N
A
G
G
K
R
I
R
P
I
L
F
L
E
V
I
E
A
L
-----
Q
I
P
------
L
T
-
E
-
S
H
F
K
-
A
A
A
A
L
E
M
I
H
T
G
S
L
I
H
D
D
L
P
A
M
D
N
D
D
Y
R
R
G
Q
L
T
N
H
K
K
F
D
E
A
T
A
I
L
A
G
D
S
L
F
L
D
A
F
G
M
L
A
E
--
T
--
D
-
F
--
P
---
T
---------
D
V
T
V
D
L
V
R
S
L
S
S
A
S
G
T
F
G
M
V
G
-
G
Q
M
L
D
-
M
A
A
E
G
K
--
K
--
L
N
L
K
N
---
L
Q
L
I
H
R
H
K
T
G
Q
L
L
A
Y
P
F
W
A
A
A
R
-
V
A
Q
L
-
D
-
E
N
L
L
A
T
-
F
L
-
E
I
G
M
I
I
G
L
A
F
Q
V
R
D
D
I
L
D
I
T
A
N
F
E
E
I
G
K
T
P
K
K
D
V
M
A
E
K
M
T
Y
P
H
L
L
G
L
N
E
S
Y
Q
I
-------
L
D
E
S
L
D
Q
A
E
A
I
L
R
K
L
S
D
E
--
I
A
-
F
A
P
Q
-----
K
I
L
S
L
I
E
R
L
R
L
D
A
2
PsiBlast_PDB
80.78
56%
-17
- C1 -
-
4LFG
2
?
A:
[3-290]
----
D
K
L
K
K
I
D
Q
T
I
H
A
F
Y
C
E
K
-
A
-
V
I
S
E
K
L
N
E
A
V
L
Y
S
I
N
A
G
G
K
R
I
R
P
I
L
F
L
E
V
I
E
A
L
-----
Q
I
P
------
L
T
-
E
-
S
H
F
K
-
A
A
A
A
L
E
M
I
H
T
G
S
L
I
H
D
D
L
P
A
M
D
N
D
D
Y
R
R
G
Q
L
T
N
H
K
K
F
D
E
A
T
A
I
L
A
G
D
S
L
F
L
D
A
F
G
M
L
A
E
--
T
--
D
-
F
--
P
---
T
---------
D
V
T
V
D
L
V
R
S
L
S
S
A
S
G
T
F
G
M
V
G
-
G
Q
M
L
D
-
M
A
A
E
G
K
--
K
--
L
N
L
K
N
---
L
Q
L
I
H
R
H
K
T
G
Q
L
L
A
Y
P
F
W
A
A
A
R
-
V
A
Q
L
-
D
-
E
N
L
L
A
T
-
F
L
-
E
I
G
M
I
I
G
L
A
F
Q
V
R
D
D
I
L
D
I
T
A
N
F
E
E
I
G
K
T
P
K
K
D
V
M
A
E
K
M
T
Y
P
H
L
L
G
L
N
E
S
Y
Q
I
-------
L
D
E
S
L
D
Q
A
E
A
I
L
R
K
L
S
D
E
--
I
A
-
F
A
P
Q
-----
K
I
L
S
L
I
E
R
L
R
L
D
A
1
PsiBlast_PDB
80.33
56%
-32
- C1 -
-
4LFE
1
?
A:
[3-290]
----
D
K
L
K
K
I
D
Q
T
I
H
A
F
Y
C
E
K
-
A
-
V
I
S
E
K
L
N
E
A
V
L
Y
S
I
N
A
G
G
K
R
I
R
P
I
L
F
L
E
V
I
E
A
L
-----
Q
I
P
------
L
T
-
E
-
S
H
F
K
-
A
A
A
A
L
E
M
I
H
T
G
S
L
I
H
D
D
L
P
A
M
D
N
D
D
Y
R
R
G
Q
L
T
N
H
K
K
F
D
E
A
T
A
I
L
A
G
D
S
L
F
L
D
A
F
G
M
L
A
E
--
T
--
D
-
F
--
P
---
T
---------
D
V
T
V
D
L
V
R
S
L
S
S
A
S
G
T
F
G
M
V
G
-
G
Q
M
L
D
-
M
A
A
E
G
K
--
K
--
L
N
L
K
N
---
L
Q
L
I
H
R
H
K
T
G
Q
L
L
A
Y
P
F
W
A
A
A
R
-
V
A
Q
L
-
D
-
E
N
L
L
A
T
-
F
L
-
E
I
G
M
I
I
G
L
A
F
Q
V
R
D
D
I
L
D
I
T
A
----------------
K
M
T
Y
P
H
L
L
G
L
N
E
S
Y
Q
I
-------
L
D
E
S
L
D
Q
A
E
A
I
L
R
K
L
S
D
E
--
I
A
-
F
A
P
Q
-----
K
I
L
S
L
I
E
R
L
R
L
D
A
79
HHSearch
75.24
56%
7
- C1 -
-
4LFG
2
?
A:
[3-285]
----
D
K
L
K
K
I
D
Q
T
I
H
A
F
Y
C
E
K
-
A
V
I
S
E
-
K
L
N
E
A
V
L
Y
S
I
N
A
G
G
K
R
I
R
P
I
L
F
L
E
V
I
E
A
L
-----
Q
I
P
L-----
T
E
-
S
-
H
-
F
K
-
A
A
A
A
L
E
M
I
H
T
G
S
L
I
H
D
D
L
P
A
M
D
N
D
D
Y
R
R
G
Q
L
T
N
H
K
K
F
D
E
A
T
A
I
L
A
G
D
S
L
F
L
D
A
F
G
M
L
A
E
--
T
--
D
-
F
--
P
---
T
---------
D
V
T
V
D
L
V
R
S
L
S
S
A
S
G
T
F
G
M
V
G
-
G
Q
M
L
D
-
M
A
A
E
G
K
--
K
--
L
N
L
K
N
---
L
Q
L
I
H
R
H
K
T
G
Q
L
L
A
Y
P
F
W
A
A
A
R
-
V
A
Q
L
-
D
-
E
N
L
L
A
T
-
F
L
-
E
I
G
M
I
I
G
L
A
F
Q
V
R
D
D
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L
D
I
T
A
N
F
E
E
I
G
K
T
P
K
K
D
V
M
A
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K
M
T
Y
P
H
L
L
G
L
N
E
S
Y
Q
I
-------
L
D
E
S
L
D
Q
A
E
A
I
L
R
K
L
S
D
E
--
I
A
-
F
A
P
Q
-----
K
I
L
S
L
I
E
R
-----
4
PsiBlast_PDB
74.07
44%
-89
- C- -
-
3P8L
-
?
A:
[6-292]
---
Q
Q
H
L
P
L
V
E
K
V
M
V
D
F
I
A
E
Y
-
T
-
E
N
E
-
R
L
K
E
A
M
L
Y
S
I
H
A
G
G
K
R
L
R
P
L
L
V
L
T
T
V
A
A
F
-----
Q
K
E
------
M
E
-
T
-
Q
D
Y
Q
-
V
A
A
S
L
E
M
I
H
T
Y
S
L
I
H
D
D
L
P
A
M
D
D
D
D
L
R
R
G
K
P
T
N
H
K
V
F
G
E
A
T
A
I
L
A
G
D
G
L
L
T
G
A
F
Q
L
L
S
L
--
S
--
Q
-
L
--
G
---
L
---------
S
E
K
V
L
L
M
Q
Q
L
A
K
A
A
G
N
Q
G
M
V
S
-
G
Q
M
G
D
-
I
E
G
E
K
V
--
S
--
L
T
L
E
E
---
L
A
A
V
H
E
K
K
T
G
A
L
I
E
F
A
L
I
A
G
G
V
-
L
A
N
Q
-
T
-
E
E
V
I
G
L
-
L
T
-
Q
F
A
H
H
Y
G
L
A
F
Q
I
R
D
D
L
L
D
A
T
S
-----------------
S
T
Y
P
A
L
L
G
I
A
G
A
K
D
A
-------
L
T
H
Q
L
A
E
G
S
A
V
L
E
K
I
K
A
N
--
V
P
N
F
S
E
E
-----
H
L
A
N
L
L
T
Q
L
Q
L
--
69
HHSearch
67.95
44%
-44
- C- -
-
3P8L
-
?
B:
[7-292]
----
Q
H
L
P
L
V
E
K
V
M
V
D
F
I
A
E
Y
-
T
-
E
N
E
-
R
L
K
E
A
M
L
Y
S
I
H
A
G
G
K
R
L
R
P
L
L
V
L
T
T
V
A
A
F
-----
Q
K
E
M-----
E
T
-
Q
-
D
-
Y
Q
-
V
A
A
S
L
E
M
I
H
T
Y
S
L
I
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D
D
L
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A
M
D
D
D
D
L
R
R
G
K
P
T
N
H
K
V
F
G
E
A
T
A
I
L
A
G
D
G
L
L
T
G
A
F
Q
L
L
S
L
--
S
--
Q
-
L
--
G
---
L
---------
S
E
K
V
L
L
M
Q
Q
L
A
K
A
A
G
N
Q
G
M
V
S
-
G
Q
M
G
D
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I
E
G
E
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V
--
S
--
L
T
L
E
E
---
L
A
A
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H
E
K
K
T
G
A
L
I
E
F
A
L
I
A
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G
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L
A
N
Q
-
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E
E
V
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L
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A
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H
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A
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I
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L
L
D
A
T
S
------------------
T
Y
P
A
L
L
G
I
A
G
A
K
D
A
-------
L
T
H
Q
L
A
E
G
S
A
V
L
E
K
I
K
A
N
V
P
N
F
--
S
E
E
-----
H
L
A
N
L
L
T
Q
L
Q
L
--
70
HHSearch
67.47
44%
-47
- C- -
-
3P8L
-
?
A:
[7-292]
----
Q
H
L
P
L
V
E
K
V
M
V
D
F
I
A
E
Y
-
T
-
E
N
E
-
R
L
K
E
A
M
L
Y
S
I
H
A
G
G
K
R
L
R
P
L
L
V
L
T
T
V
A
A
F
-----
Q
K
E
M-----
E
T
-
Q
-
D
-
Y
Q
-
V
A
A
S
L
E
M
I
H
T
Y
S
L
I
H
D
D
L
P
A
M
D
D
D
D
L
R
R
G
K
P
T
N
H
K
V
F
G
E
A
T
A
I
L
A
G
D
G
L
L
T
G
A
F
Q
L
L
S
L
--
S
--
Q
-
L
--
G
---
L
---------
S
E
K
V
L
L
M
Q
Q
L
A
K
A
A
G
N
Q
G
M
V
S
-
G
Q
M
G
D
-
I
E
G
E
K
V
--
S
--
L
T
L
E
E
---
L
A
A
V
H
E
K
K
T
G
A
L
I
E
F
A
L
I
A
G
G
V
-
L
A
N
Q
-
T
-
E
E
V
I
G
L
-
L
T
-
Q
F
A
H
H
Y
G
L
A
F
Q
I
R
D
D
L
L
D
A
T
S
-----------------
S
T
Y
P
A
L
L
G
I
A
G
A
K
D
A
-------
L
T
H
Q
L
A
E
G
S
A
V
L
E
K
I
K
A
N
V
P
N
F
--
S
E
E
-----
H
L
A
N
L
L
T
Q
L
Q
L
--
71
HHSearch
65.89
43%
-49
- C- -
-
1RTR
-
?
A:
[7-288]
---
N
K
L
I
D
E
V
N
N
E
L
S
V
A
I
N
K
S
-
V
-
M
D
T
-
Q
L
E
E
S
M
L
Y
S
L
N
A
G
G
K
R
I
R
P
V
L
L
L
L
T
L
D
S
L
-----
N
T
E
------
Y
E
-
L
-
G
-
M
K
-
S
A
I
A
L
E
M
I
H
T
Y
S
L
I
H
D
D
L
P
A
M
D
N
D
D
Y
R
R
G
K
L
T
N
H
K
V
Y
G
E
W
T
A
I
L
A
G
D
A
L
L
T
K
A
F
E
L
I
S
S
--
D
--
D
-
R
L-
T
---
D
---------
E
V
K
I
K
V
L
Q
R
L
S
I
A
S
G
H
V
G
M
V
G
-
G
Q
M
L
D
-
M
Q
S
E
G
Q
--
P
--
I
D
L
E
T
---
L
E
M
I
H
K
T
K
T
G
A
L
L
T
F
A
V
M
S
A
A
D
-
I
A
N
V
-
D
-
D
T
T
K
E
H
-
L
E
-
S
Y
S
Y
H
L
G
M
M
F
Q
I
K
D
D
L
L
D
C
Y
G
D
E
A
-------------
K
S
T
Y
V
S
L
L
G
K
D
G
A
E
D
K
-------
L
T
Y
H
R
D
A
A
V
D
E
L
T
Q
I
D
E
Q
--
F
---
N
T
K
-----
H
L
L
E
I
V
D
L
F
----
77
HHSearch
64.78
41%
-53
- C1 -
-
3OAB
2
?
D:
[9-289]
---
L
R
K
A
K
S
V
N
K
A
L
E
A
A
V
Q
M
K
---
E
P
L
-
K
I
H
E
S
M
R
Y
S
L
L
A
G
G
K
R
V
R
P
M
L
C
I
A
A
C
E
L
V
-----
G
G
D
------
E
S
-
T
-
A
-
M
P
-
A
A
C
A
V
E
M
I
H
T
M
S
L
M
H
D
D
L
P
C
M
D
N
D
D
L
R
R
G
K
P
T
N
H
M
A
F
G
E
S
V
A
V
L
A
G
D
A
L
L
S
F
A
F
E
H
V
A
A
--
A
--
T
-
K
--
G
---
A
PP-------
E
R
I
V
R
V
L
G
E
L
A
V
S
I
G
S
E
G
L
V
A
-
G
Q
V
V
D
-
V
C
S
E
G
M
A-
E
--
V
G
L
D
H
---
L
E
F
I
H
H
H
K
T
A
A
L
L
Q
G
S
V
V
L
G
A
I
-
L
G
G
G
-
K
-
E
E
E
V
A
K
-
L
R
-
K
F
A
N
C
I
G
L
L
F
Q
V
V
D
D
I
L
D
V
T
K
S
S
K
E
L
G
K
T
A
G
K
D
L
V
A
D
K
T
T
Y
P
K
L
I
G
V
E
K
S
K
E
F
-------
A
D
R
L
N
R
E
A
Q
E
Q
L
L
H
F
H
P
H
--
R
----
A
A
-----
P
L
I
A
L
A
N
Y
-----
68
HHSearch
64.66
38%
-84
- C1 -
-
3LVS
1
?
B:
[10-284]
----
E
I
Q
D
A
V
E
T
A
M
A
A
A
I
G
R
L
---
P
A
G
-
D
L
R
D
A
M
A
Y
A
A
-
Q
G
G
K
R
L
R
A
F
L
A
I
E
S
A
A
I
H
-----
G
I
S
------
M
A
-
Q
-
A
-
M
P
-
A
A
L
A
V
E
A
L
H
A
Y
S
L
V
H
D
D
M
P
C
M
D
N
D
D
L
R
R
G
L
P
T
V
H
K
K
W
D
D
A
T
A
V
L
A
G
D
A
L
Q
T
L
A
F
E
L
C
T
D
--
P
--
V
-
L
G-
S
---
A
---------
E
N
R
V
A
L
V
A
A
L
A
Q
A
S
G
A
E
G
M
V
Y
-
G
Q
A
L
D
-
I
A
A
E
T
A
AV
P
--
L
T
L
D
E
---
I
I
R
L
Q
A
G
K
T
G
A
L
I
S
F
A
A
Q
A
G
A
I
-
L
A
G
A
-
D
-
R
---
G
P
-
L
T
-
A
Y
A
T
A
L
G
L
A
F
Q
I
A
D
D
I
L
D
V
E
------------
D
A
E
A
H
K
A
T
F
V
S
L
L
G
L
A
G
A
K
S
R
-------
A
A
D
L
V
A
E
A
E
A
A
L
A
P
Y
G
E
A
-------
A
S
-----
T
L
R
A
C
A
R
Y
-----
3
PsiBlast_PDB
63.03
45%
-43
- C1 -
-
1RTR
-
?
A:
[28-286]
--------------------------
T
-
Q
L
E
E
S
M
L
Y
S
L
N
A
G
G
K
R
I
R
P
V
L
L
L
L
T
L
D
S
L
-----
N
T
E
------
Y
E
-
L
-
G
-
M
K
-
S
A
I
A
L
E
M
I
H
T
Y
S
L
I
H
D
D
L
P
A
M
D
N
D
D
Y
R
R
G
K
L
T
N
H
K
V
Y
G
E
W
T
A
I
L
A
G
D
A
L
L
T
K
A
F
E
L
I
S
S
--
D
--
D
R
L
--
T
---
D
---------
E
V
K
I
K
V
L
Q
R
L
S
I
A
S
G
H
V
G
M
V
G
-
G
Q
M
L
D
-
M
Q
S
E
G
Q
--
P
--
I
D
L
E
T
---
L
E
M
I
H
K
T
K
T
G
A
L
L
T
F
A
V
M
S
A
A
D
-
I
A
N
V
-
D
-
D
T
T
K
E
H
-
L
E
-
S
Y
S
Y
H
L
G
M
M
F
Q
I
K
D
D
L
L
D
C
Y
G
D
E
A
-------------
K
S
T
Y
V
S
L
L
G
K
D
G
A
E
D
K
-------
L
T
Y
H
R
D
A
A
V
D
E
L
T
Q
I
D
E
Q
-----
F
N
T
K
-----
H
L
L
E
I
V
D
------
17
PsiBlast_PDB
62.85
39%
-111
- C1 -
-
3NPK
2
?
A:
[21-278]
--------------------
E
-
S
-
F
H
P
-
F
F
N
E
A
L
A
L
M
L
K
A
G
G
K
H
F
R
A
Q
L
L
L
S
V
V
Q
S
N
-----
K
P
E
------
L
L
-
N
-
Q
A
L
D
-
V
A
L
A
L
E
F
I
H
T
Y
S
L
I
H
D
D
L
P
A
M
D
N
A
D
F
R
R
G
I
P
T
L
H
K
S
Y
D
E
T
T
A
I
L
V
G
D
A
L
N
T
E
A
F
L
V
L
S
H
--
A
--
H
-
L
--
K
---
D
---------
E
I
K
I
K
L
I
K
T
L
A
F
N
A
G
L
N
G
M
V
I
-
G
Q
A
I
D
-
C
F
F
E
D
K
--
R
--
L
S
L
N
E
---
L
E
F
L
H
T
H
K
T
A
R
L
I
A
A
A
L
K
M
G
C
E
-
I
C
E
L
-
N
-
N
E
E
S
N
Q
-
I
Y
-
K
L
G
L
K
L
G
L
I
F
Q
I
N
D
D
I
I
D
V
T
------------------
N
S
F
V
N
L
L
G
L
E
Q
A
I
K
T
K
E
N
L
L
N
E
C
E
Q
D
L
E
K
L
N
E
K
L
A
Q
M
I
Q
N
--
L
------------------------
76
HHSearch
62.49
39%
-80
- C1 -
-
3M0G
-
?
B:
[9-272]
----
E
V
Q
D
A
V
E
T
A
M
A
A
A
I
G
R
L
---
P
A
G
-
D
L
R
D
A
M
A
Y
A
A
-
Q
G
G
K
R
L
R
A
F
L
A
I
E
S
A
A
I
H
-----
G
I
S
------
M
A
-
Q
-
A
-
M
P
-
A
A
L
A
V
E
A
L
H
A
Y
S
L
V
H
D
D
M
P
C
M
D
N
D
D
L
R
R
G
L
P
T
V
H
K
K
W
D
D
A
T
A
V
L
A
G
D
A
L
Q
T
L
A
F
E
L
C
T
D
--
P
--
V
-
L
G-
S
---
A
---------
E
N
R
V
A
L
V
A
A
L
A
Q
A
S
G
A
E
G
M
V
Y
-
G
Q
A
L
D
-
I
A
A
E
T
A
AV
P
--
L
T
L
D
E
---
I
I
R
L
Q
A
G
K
T
G
A
L
I
S
F
A
A
Q
A
G
A
I
-
L
A
G
A
-
D
-
R
---
G
P
-
L
T
-
A
Y
A
T
A
L
G
L
A
F
Q
I
A
D
D
I
L
D
V
------------------
K
A
T
F
V
S
L
L
G
L
A
G
A
K
S
R
-------
A
A
D
L
V
A
E
A
E
A
A
L
A
P
Y
G
E
----------------------------
67
HHSearch
61.73
42%
-32
- C1 -
-
5XN5
-
?
A:
[11-300]
----
E
K
A
A
A
V
N
R
A
L
D
A
S
I
P
A
D
-
E
-
P
P
A
-
A
L
H
E
A
M
R
Y
A
L
L
A
G
G
K
R
V
R
P
A
L
C
L
A
A
C
A
V
V
-----
G
G
R
------
E
A
-
W
-
A
-
M
P
-
A
A
A
A
V
E
M
V
H
T
M
S
L
V
H
D
D
L
P
C
M
D
D
D
D
L
R
R
G
K
P
T
C
H
V
V
Y
G
E
P
I
A
V
L
T
G
D
A
L
L
S
L
S
F
H
H
M
A
R
--
F
--
D
-
S
--
Y
---
P
PDIDADK
H
P
A
R
V
V
R
A
I
G
E
L
A
R
C
I
G
S
E
G
L
V
A
-
G
Q
V
V
D
-
L
E
M
T
-------
V
P
L
E
R
---
L
E
Y
I
H
L
H
K
T
A
A
L
L
E
A
S
V
V
I
G
A
I
-
L
G
G
G
-
S
-
D
E
Q
I
E
S
-
L
R
-
M
Y
A
R
S
I
G
L
L
F
Q
V
V
D
D
I
L
D
V
T
-----------
K
D
L
A
S
D
K
T
T
Y
P
K
L
L
G
L
E
K
S
R
E
F
-------
A
E
K
L
L
S
D
A
R
E
Q
L
S
G
F
D
Q
E
--
T
----
A
A
-----
P
L
L
H
L
A
N
Y
I
----
62
HHSearch
61.32
38%
-36
- C1 -
-
4F62
1
?
A:
[10-289]
---
T
Y
T
Q
S
R
V
D
Q
Y
L
E
Q
Q
L
S
D
Y
-
A
-
P
A
N
-
Q
L
H
N
A
M
R
Y
S
L
F
-
G
G
K
R
I
R
P
M
L
T
Y
A
S
A
Q
L
V
-----
G
D
I
------
S
S
-
L
-
T
-
D
A
-
S
A
A
A
L
E
S
I
H
A
Y
S
L
I
H
D
D
L
P
A
M
D
N
-------
P
T
C
H
I
Q
F
D
E
A
T
A
I
L
A
G
D
A
L
Q
T
F
A
F
E
L
L
S
N
--
P
--
T
-
S
--
A
---
Q
P
--------
E
L
A
I
K
L
I
Q
E
L
V
V
A
S
G
R
N
G
M
I
T
-
G
Q
M
I
D
-
L
S
S
E
N
K
--
N
--
I
S
L
A
E
---
L
E
Q
M
H
V
H
K
T
G
A
L
I
K
A
S
V
R
M
G
A
L
-
S
T
G
Q
V
K
-
P
E
Q
L
A
K
-
L
D
-
A
Y
A
H
A
I
G
L
A
F
Q
V
Q
D
D
I
I
D
L
T
----------------
N
K
A
T
Y
P
K
L
L
G
L
D
G
A
K
A
L
-------
V
V
R
L
H
E
Q
A
I
A
Q
I
S
E
F
G
D
K
-------
S
Q
-----
P
L
T
D
L
A
N
Y
-----
78
HHSearch
61.04
41%
-69
- C1 -
-
3KRA
-
?
D:
[9-289]
---
L
R
K
A
K
S
V
N
K
A
L
E
A
A
V
Q
M
K
---
E
P
L
-
K
I
H
E
S
M
R
Y
S
L
L
A
G
G
K
R
V
R
P
M
L
C
I
A
A
C
E
L
V
-----
G
G
D
------
E
S
-
T
-
A
-
M
P
-
A
A
C
A
V
E
M
I
H
T
M
S
L
M
H
D
D
L
P
C
M
D
N
D
D
L
R
R
G
K
P
T
N
H
M
A
F
G
E
S
V
A
V
L
A
G
D
A
L
L
S
F
A
F
E
H
V
A
A
--
A
--
T
-
K
--
G
---
A
PP-------
E
R
I
V
R
V
L
G
E
L
A
V
S
I
G
S
E
G
L
V
A
-
G
Q
V
V
D
-
V
C
S
E
G
M
A-
E
--
V
G
L
D
H
---
L
E
F
I
H
H
H
K
T
A
A
L
L
Q
G
S
V
V
L
G
A
I
-
L
G
G
G
-
K
-
E
E
E
V
A
K
-
L
R
-
K
F
A
N
C
I
G
L
L
F
Q
V
V
D
D
I
L
D
V
T
------------------
T
T
Y
P
K
L
I
G
V
E
K
S
K
E
F
-------
A
D
R
L
N
R
E
A
Q
E
Q
L
L
H
F
H
P
H
--
R
----
A
A
-----
P
L
I
A
L
A
N
Y
-----
74
HHSearch
60.74
36%
-76
- C1 -
-
4KKM
1
?
B:
[54-315]
--------------------------
R
-
R
L
V
E
A
M
R
Y
A
A
I
G
G
G
K
R
L
R
P
L
L
V
V
A
T
C
A
L
F
-----
N
V
D
------
R
E
-
A
-
A
-
L
R
-
V
G
M
A
I
E
C
I
H
V
Y
S
L
I
H
D
D
M
P
C
M
D
N
D
D
L
R
R
G
K
P
T
V
H
K
A
F
D
D
A
S
A
V
L
S
G
D
A
L
Q
A
L
A
F
E
I
L
S
E
--
E
--
K
-
I
HT
D
---
P
---------
H
V
R
L
E
L
I
Q
A
L
A
I
A
S
G
K
D
G
M
V
G
-
G
Q
A
I
D
-
L
A
A
E
T
S
TV
P
--
F
D
L
P
T
---
I
T
R
L
Q
Q
L
K
T
G
A
L
F
G
F
C
L
E
A
G
A
I
-
M
G
R
Q
-
N
-
K
D
I
R
D
R
-
L
K
-
A
Y
A
R
D
I
G
L
A
F
Q
I
A
D
D
L
I
D
A
E
G
D
--------------
G
K
A
T
F
L
S
L
L
G
L
E
K
A
R
S
Q
-------
A
Q
A
L
V
D
Q
A
I
A
H
L
S
V
F
G
S
-------
E
A
D
-----
Y
L
R
S
I
A
R
Y
I
----
72
HHSearch
60.68
35%
-33
- C1 -
-
3Q1O
2
?
B:
[21-304]
-----
E
C
E
R
F
E
S
F
L
K
N
H
H
L
H
L
E
S
-
F
H
P
-
Y
L
E
K
A
F
F
E
M
V
L
N
G
G
K
R
F
R
P
K
L
F
L
A
V
L
C
A
L
-----
V
G
Q
K
D
Y
S
N
Q
Q
T
-
E
-
Y
-
F
K
-
I
A
L
S
I
E
C
L
H
T
Y
S
L
I
H
D
D
L
P
C
M
D
N
A
A
L
R
R
N
H
P
T
L
H
A
K
Y
D
E
T
T
A
V
L
I
G
D
A
L
N
T
Y
S
F
E
L
L
S
N
--
A
--
L
-
L
--
E
---
S
---------
H
I
I
V
E
L
I
K
I
L
S
A
N
G
G
I
K
G
M
I
L
-
G
Q
A
L
D
-
C
Y
F
E
N
T
--
P
--
L
N
L
E
Q
---
L
T
F
L
H
E
H
K
T
A
K
L
I
S
A
S
L
I
M
G
L
V
-
A
S
G
I
-
K
D
E
E
L
F
K
W
-
L
Q
-
A
F
G
L
K
M
G
L
C
F
Q
V
L
D
D
I
I
D
V
T
Q
D
E
E
E
S
G
K
T
--
T
H
L
D
S
A
K
N
S
F
V
N
L
L
G
L
E
R
A
N
N
Y
-------
A
Q
T
L
K
T
E
V
L
N
D
L
D
A
L
K
P
-------
A
Y
P
-----
L
L
Q
E
N
L
N
A
L
L
---
16
PsiBlast_PDB
60.64
41%
-55
- C1 -
-
4F62
1
?
A:
[16-277]
---------
V
D
Q
Y
L
E
Q
Q
L
S
D
Y
-
A
-
P
A
N
-
Q
L
H
N
A
M
R
Y
S
L
F
-
G
G
K
R
I
R
P
M
L
T
Y
A
S
A
Q
-
L
-----
V
G
D
------
I
S
-
S
-
L
T
D
A
-
S
A
A
A
L
E
S
I
H
A
Y
S
L
I
H
D
D
L
P
A
M
D
N
-------
P
T
C
H
I
Q
F
D
E
A
T
A
I
L
A
G
D
A
L
Q
T
F
A
F
E
L
L
S
N
P-
T
--
S
-
A
--
Q
---
P
---------
E
L
A
I
K
L
I
Q
E
L
V
V
A
S
G
R
N
G
M
I
T
-
G
Q
M
I
D
-
L
S
S
E
N
K
--
N
--
I
S
L
A
E
---
L
E
Q
M
H
V
H
K
T
G
A
L
I
K
A
S
V
R
M
G
A
L
S
T
G
Q
V
-
K
-
P
E
Q
L
A
K
-
L
D
-
A
Y
A
H
A
I
G
L
A
F
Q
V
Q
D
D
I
I
D
L
T
----------------
N
K
A
T
Y
P
K
L
L
G
L
D
G
A
K
A
L
-------
V
V
R
L
H
E
Q
A
I
A
Q
I
S
E
F
G
-----------------------------
5
PsiBlast_PDB
58.67
41%
-26
- C1 -
-
3M9U
6
?
A:
[34-301]
--------------------------
A
-
Q
L
A
A
A
M
T
Y
S
V
L
A
G
G
K
R
L
R
P
L
L
T
V
A
T
M
Q
S
L
-----
G
V
T
------
F
V
-
P
E
R
H
W
R
-
P
V
M
A
L
E
L
L
H
T
Y
S
L
I
H
D
D
L
P
A
M
D
N
D
A
L
R
R
G
E
P
T
N
H
V
K
F
G
A
G
M
A
T
L
A
G
D
G
L
L
T
L
A
F
Q
W
L
T
A
--
T
--
D
-
L
--
P
---
A
---------
T
M
Q
A
A
L
V
Q
A
L
A
T
A
A
G
P
S
G
M
V
A
-
G
Q
A
K
D
-
I
Q
S
E
H
V
--
N
--
L
P
L
S
Q
---
L
R
V
L
H
K
E
K
T
G
A
L
L
H
Y
A
V
Q
A
G
L
I
-
L
G
Q
--
A
-
P
E
A
Q
W
P
-
A
Y
L
Q
F
A
D
A
F
G
L
A
F
Q
I
Y
D
D
I
L
D
V
V
S
S
------------
D
E
A
K
N
T
Y
P
G
K
L
G
L
----
I
G
-------
A
N
Q
A
L
I
D
T
I
H
S
G
Q
A
A
L
Q
G
--
L
P
-
T
S
T
Q
R
D
D
L
A
A
F
F
S
Y
F
D
T
E
R
V
N
-
26
PsiBlast_CBE
58.62
41%
-31
- C1 -
-
3M9U
6
?
C:
[34-299]
--------------------------
A
-
Q
L
A
A
A
M
T
Y
S
V
L
A
G
G
K
R
L
R
P
L
L
T
V
A
T
M
Q
S
L
-----
G
V
T
------
F
V
-
P
E
R
H
W
R
-
P
V
M
A
L
E
L
L
H
T
Y
S
L
I
H
D
D
L
P
A
M
D
N
D
A
L
R
R
G
E
P
T
N
H
V
K
F
G
A
G
M
A
T
L
A
G
D
G
L
L
T
L
A
F
Q
W
L
T
A
--
T
--
D
-
L
--
P
---
A
---------
T
M
Q
A
A
L
V
Q
A
L
A
T
A
A
G
P
S
G
M
V
A
-
G
Q
A
K
D
-
I
Q
S
E
H
V
--
N
--
L
P
L
S
Q
---
L
R
V
L
H
K
E
K
T
G
A
L
L
H
Y
A
V
Q
A
G
L
I
-
L
G
Q
--
A
-
P
E
A
Q
W
P
-
A
Y
L
Q
F
A
D
A
F
G
L
A
F
Q
I
Y
D
D
I
L
D
V
V
S
S
--------------
A
K
N
T
Y
P
G
K
L
G
L
----
I
G
-------
A
N
Q
A
L
I
D
T
I
H
S
G
Q
A
A
L
Q
G
--
L
P
-
T
S
T
Q
RDDLA
A
F
F
S
Y
F
D
T
E
R
---
6
PsiBlast_PDB
57.94
41%
-29
- C1 -
-
3PDE
3
?
A:
[34-301]
--------------------------
A
-
Q
L
A
A
A
M
T
Y
S
V
L
A
G
G
K
R
L
R
P
L
L
T
V
A
T
M
Q
S
L
-----
G
V
T
------
F
V
-
P
E
R
H
W
R
-
P
V
M
A
L
E
L
L
H
T
Y
S
L
I
H
D
D
L
P
A
M
D
N
D
A
L
R
R
G
E
P
T
N
H
V
K
F
G
A
G
M
A
T
L
A
G
D
G
L
L
T
L
A
F
Q
W
L
T
A
--
T
--
D
-
L
--
P
---
A
---------
T
M
Q
A
A
L
V
Q
A
L
A
T
A
A
G
P
S
G
M
V
A
-
G
Q
A
K
D
-
I
Q
S
E
H
V
--
N
--
L
P
L
S
Q
---
L
R
V
L
H
K
E
K
T
G
A
L
L
H
Y
A
V
Q
A
G
L
I
-
L
G
Q
--
A
-
P
E
A
Q
W
P
-
A
Y
L
Q
F
A
D
A
F
G
L
A
F
Q
I
Y
D
D
I
L
D
V
V
S
S
-----------
A
D
E
A
K
N
T
Y
P
G
K
L
G
L
----
I
G
-------
A
N
Q
A
L
I
D
T
I
H
S
G
Q
A
A
L
Q
G
--
L
P
-
T
S
T
Q
R
D
D
L
A
A
F
F
S
Y
F
D
T
E
R
V
N
-
61
HHSearch
57.41
36%
-22
- C1 -
-
3PDE
3
?
A:
[13-295]
---
D
Q
W
V
P
A
L
N
A
P
L
K
Q
A
I
L
A
D
-
S
-
Q
D
A
-
Q
L
A
A
A
M
T
Y
S
V
L
A
G
G
K
R
L
R
P
L
L
T
V
A
T
M
Q
S
L
-----
G
V
T
F
V
----
P
E
-
R
-
H
-
W
R
-
P
V
M
A
L
E
L
L
H
T
Y
S
L
I
H
D
D
L
P
A
M
D
N
D
A
L
R
R
G
E
P
T
N
H
V
K
F
G
A
G
M
A
T
L
A
G
D
G
L
L
T
L
A
F
Q
W
L
T
A
--
T
--
D
-
L
--
P
---
A
---------
T
M
Q
A
A
L
V
Q
A
L
A
T
A
A
G
P
S
G
M
V
A
-
G
Q
A
K
D
-
I
Q
S
E
H
V
--
N
--
L
P
L
S
Q
---
L
R
V
L
H
K
E
K
T
G
A
L
L
H
Y
A
V
Q
A
G
L
I
-
L
G
Q
A
-
P
-
E
A
Q
W
P
A
-
Y
L
-
Q
F
A
D
A
F
G
L
A
F
Q
I
Y
D
D
I
L
D
V
V
S
S
-----------
A
D
E
A
K
N
T
Y
P
G
K
L
G
L
I
G
A
N
Q
A
-------
L
I
D
T
I
H
S
G
Q
A
A
L
Q
G
L
P
T
S
--
T
---
Q
R
D
-----
D
L
A
A
F
F
S
Y
F
----
27
PsiBlast_CBE
57.01
41%
-31
- C1 -
-
3M9U
3
?
B:
[34-299]
--------------------------
A
-
Q
L
A
A
A
M
T
Y
S
V
L
A
G
G
K
R
L
R
P
L
L
T
V
A
T
M
Q
S
L
-----
G
V
T
------
F
V
-
P
E
R
H
W
R
-
P
V
M
A
L
E
L
L
H
T
Y
S
L
I
H
D
D
L
P
A
M
D
N
D
A
L
R
R
G
E
P
T
N
H
V
K
F
G
A
G
M
A
T
L
A
G
D
G
L
L
T
L
A
F
Q
W
L
T
A
--
T
--
D
-
L
--
P
---
A
---------
T
M
Q
A
A
L
V
Q
A
L
A
T
A
A
G
P
S
G
M
V
A
-
G
Q
A
K
D
-
I
Q
S
E
H
V
--
N
--
L
P
L
S
Q
---
L
R
V
L
H
K
E
K
T
G
A
L
L
H
Y
A
V
Q
A
G
L
I
-
L
G
Q
--
A
-
P
E
A
Q
W
P
-
A
Y
L
Q
F
A
D
A
F
G
L
A
F
Q
I
Y
D
D
I
L
D
V
V
S
-------------
D
E
A
K
N
T
Y
P
G
K
L
G
L
----
I
G
-------
A
N
Q
A
L
I
D
T
I
H
S
G
Q
A
A
L
Q
G
--
L
P
-
T
S
T
Q
RDDLA
A
F
F
S
Y
F
D
T
E
R
---
25
PsiBlast_CBE
56.74
41%
-29
- C1 -
-
3PDE
2
?
B:
[34-299]
--------------------------
A
-
Q
L
A
A
A
M
T
Y
S
V
L
A
G
G
K
R
L
R
P
L
L
T
V
A
T
M
Q
S
L
-----
G
V
T
------
F
V
-
P
E
R
H
W
R
-
P
V
M
A
L
E
L
L
H
T
Y
S
L
I
H
D
D
L
P
A
M
D
N
D
A
L
R
R
G
E
P
T
N
H
V
K
F
G
A
G
M
A
T
L
A
G
D
G
L
L
T
L
A
F
Q
W
L
T
A
--
T
--
D
-
L
--
P
---
A
---------
T
M
Q
A
A
L
V
Q
A
L
A
T
A
A
G
P
S
G
M
V
A
-
G
Q
A
K
D
-
I
Q
S
E
H
V
--
N
--
L
P
L
S
Q
---
L
R
V
L
H
K
E
K
T
G
A
L
L
H
Y
A
V
Q
A
G
L
I
-
L
G
Q
--
A
-
P
E
A
Q
W
P
-
A
Y
L
Q
F
A
D
A
F
G
L
A
F
Q
I
Y
D
D
I
L
D
V
V
S
-----------
D
A
D
E
A
K
N
T
Y
P
G
K
L
G
L
----
I
G
-------
A
N
Q
A
L
I
D
T
I
H
S
G
Q
A
A
L
Q
G
--
L
P
-
T
S
T
Q
RDDLA
A
F
F
S
Y
F
D
T
E
R
---
60
HHSearch
55.68
36%
-18
* C1 *
-
3PDE
2
?
D:
[13-295]
---
D
Q
W
V
P
A
L
N
A
P
L
K
Q
A
I
L
A
D
-
S
-
Q
D
A
-
Q
L
A
A
A
M
T
Y
S
V
L
A
G
G
K
R
L
R
P
L
L
T
V
A
T
M
Q
S
L
-----
G
V
T
FV----
P
E
-
R
-
H
-
W
R
-
P
V
M
A
L
E
L
L
H
T
Y
S
L
I
H
D
D
L
P
A
M
D
N
D
A
L
R
R
G
E
P
T
N
H
V
K
F
G
A
G
M
A
T
L
A
G
D
G
L
L
T
L
A
F
Q
W
L
T
A
--
T
--
D
-
L
--
P
---
A
---------
T
M
Q
A
A
L
V
Q
A
L
A
T
A
A
G
P
S
G
M
V
A
-
G
Q
A
K
D
-
I
Q
S
E
H
V
--
N
--
L
P
L
S
Q
---
L
R
V
L
H
K
E
K
T
G
A
L
L
H
Y
A
V
Q
A
G
L
I
-
L
G
Q
A
-
P
-
E
A
Q
W
P
A
-
Y
L
-
Q
F
A
D
A
F
G
L
A
F
Q
I
Y
D
D
I
L
D
V
V
S
S
P
A
---------
A
D
E
A
K
N
T
Y
P
G
K
L
G
L
I
G
A
N
Q
A
-------
L
I
D
T
I
H
S
G
Q
A
A
L
Q
G
L
P
T
S
--
T
---
Q
R
D
-----
D
L
A
A
F
F
S
Y
F
----
24
PsiBlast_CBE
55.57
41%
-35
- C1 -
-
3PDE
3
?
C:
[34-299]
--------------------------
A
-
Q
L
A
A
A
M
T
Y
S
V
L
A
G
G
K
R
L
R
P
L
L
T
V
A
T
M
Q
S
L
-----
G
V
T
------
F
V
-
P
E
R
H
W
R
-
P
V
M
A
L
E
L
L
H
T
Y
S
L
I
H
D
D
L
P
A
M
D
N
D
A
L
R
R
G
E
P
T
N
H
V
K
F
G
A
G
M
A
T
L
A
G
D
G
L
L
T
L
A
F
Q
W
L
T
A
--
T
--
D
-
L
--
P
---
A
---------
T
M
Q
A
A
L
V
Q
A
L
A
T
A
A
G
P
S
G
M
V
A
-
G
Q
A
K
D
-
I
Q
S
E
H
V
--
N
--
L
P
L
S
Q
---
L
R
V
L
H
K
E
K
T
G
A
L
L
H
Y
A
V
Q
A
G
L
I
-
L
G
Q
--
A
-
P
E
A
Q
W
P
-
A
Y
L
Q
F
A
D
A
F
G
L
A
F
Q
I
Y
D
D
I
L
D
V
V
S
----------------
K
N
T
Y
P
G
K
L
G
L
----
I
G
-------
A
N
Q
A
L
I
D
T
I
H
S
G
Q
A
A
L
Q
G
--
L
P
-
T
S
T
Q
RDDLA
A
F
F
S
Y
F
D
T
E
R
---
23
PsiBlast_CBE
55.21
41%
-26
- C1 -
-
3PDE
2
?
D:
[34-301]
--------------------------
A
-
Q
L
A
A
A
M
T
Y
S
V
L
A
G
G
K
R
L
R
P
L
L
T
V
A
T
M
Q
S
L
-----
G
V
T
------
F
V
-
P
E
R
H
W
R
-
P
V
M
A
L
E
L
L
H
T
Y
S
L
I
H
D
D
L
P
A
M
D
N
D
A
L
R
R
G
E
P
T
N
H
V
K
F
G
A
G
M
A
T
L
A
G
D
G
L
L
T
L
A
F
Q
W
L
T
A
--
T
--
D
-
L
--
P
---
A
---------
T
M
Q
A
A
L
V
Q
A
L
A
T
A
A
G
P
S
G
M
V
A
-
G
Q
A
K
D
-
I
Q
S
E
H
V
--
N
--
L
P
L
S
Q
---
L
R
V
L
H
K
E
K
T
G
A
L
L
H
Y
A
V
Q
A
G
L
I
-
L
G
Q
--
A
-
P
E
A
Q
W
P
-
A
Y
L
Q
F
A
D
A
F
G
L
A
F
Q
I
Y
D
D
I
L
D
V
V
S
S
P
A
---------
A
D
E
A
K
N
T
Y
P
G
K
L
G
L
----
I
G
-------
A
N
Q
A
L
I
D
T
I
H
S
G
Q
A
A
L
Q
G
--
L
P
-
T
S
T
Q
RDDLA
A
F
F
S
Y
F
D
T
E
R
V
N
-
63
HHSearch
54.12
38%
-41
- C1 -
-
4F62
1
?
B:
[10-289]
---
T
Y
T
Q
S
R
V
D
Q
Y
L
E
Q
Q
L
S
D
Y
-
A
-
P
A
N
-
Q
L
H
N
A
M
R
Y
S
L
F
-
G
G
K
R
I
R
P
M
L
T
Y
A
S
A
Q
L
V
-----
G
D
I
------
S
S
-
L
-
T
-
D
A
-
S
A
A
A
L
E
S
I
H
A
Y
S
L
I
H
D
D
L
P
A
M
---------------
F
D
E
A
T
A
I
L
A
G
D
A
L
Q
T
F
A
F
E
L
L
S
N
--
P
--
T
-
S
--
A
---
Q
P
--------
E
L
A
I
K
L
I
Q
E
L
V
V
A
S
G
R
N
G
M
I
T
-
G
Q
M
I
D
-
L
S
S
E
----
N
--
I
S
L
A
E
---
L
E
Q
M
H
V
H
K
T
G
A
L
I
K
A
S
V
R
M
G
A
L
-
S
T
G
Q
V
K
-
P
E
Q
L
A
K
-
L
D
-
A
Y
A
H
A
I
G
L
A
F
Q
V
Q
D
D
I
I
D
L
------------------
K
A
T
Y
P
K
L
L
G
L
D
G
A
K
A
L
-------
V
V
R
L
H
E
Q
A
I
A
Q
I
S
E
F
G
D
K
-------
S
Q
-----
P
L
T
D
L
A
N
Y
-----
35
PsiBlast_CBE
54.00
41%
-59
- C1 -
-
4F62
1
?
B:
[16-277]
---------
V
D
Q
Y
L
E
Q
Q
L
S
D
Y
-
A
-
P
A
N
-
Q
L
H
N
A
M
R
Y
S
L
F
-
G
G
K
R
I
R
P
M
L
T
Y
A
S
A
Q
-
L
-----
V
G
D
------
I
S
-
S
-
L
T
D
A
-
S
A
A
A
L
E
S
I
H
A
Y
S
L
I
H
D
D
L
P
A
M
---------------
F
D
E
A
T
A
I
L
A
G
D
A
L
Q
T
F
A
F
E
L
L
S
N
P-
T
--
S
-
A
--
Q
---
P
---------
E
L
A
I
K
L
I
Q
E
L
V
V
A
S
G
R
N
G
M
I
T
-
G
Q
M
I
D
-
L
S
S
E
----
N
--
I
S
L
A
E
---
L
E
Q
M
H
V
H
K
T
G
A
L
I
K
A
S
V
R
M
G
A
L
S
T
G
Q
V
-
K
-
P
E
Q
L
A
K
-
L
D
-
A
Y
A
H
A
I
G
L
A
F
Q
V
Q
D
D
I
I
D
L
------------------
K
A
T
Y
P
K
L
L
G
L
D
G
A
K
A
L
-------
V
V
R
L
H
E
Q
A
I
A
Q
I
S
E
F
G
-----------------------------
10
PsiBlast_PDB
52.33
44%
-36
- C1 -
-
3KRF
2
?
A:
[31-272]
-----------------------------
I
H
E
S
M
R
Y
S
L
L
A
G
G
K
R
V
R
P
M
L
C
I
A
A
C
E
L
V
GGD--
E
S
T
------
A
M
-
P
-
A
-----
A
C
A
V
E
M
I
H
T
M
S
L
M
H
D
D
L
P
C
M
D
N
D
D
L
R
R
G
K
P
T
N
H
M
A
F
G
E
S
V
A
V
L
A
G
D
A
L
L
S
F
A
F
E
H
V
A
A
--
A
TK
G
-
A
--
P
---
P
---------
E
R
I
V
R
V
L
G
E
L
A
V
S
I
G
S
E
G
L
V
A
-
G
Q
V
V
D
-
V
C
S
E
G
M
A-
E
--
V
G
L
D
H
---
L
E
F
I
H
H
H
K
T
A
A
L
L
Q
G
S
V
V
L
G
A
I
-
L
G
G
G
-
K
-
E
E
E
V
A
K
-
L
R
-
K
F
A
N
C
I
G
L
L
F
Q
V
V
D
D
I
L
D
V
T
K
----------------
K
T
T
Y
P
K
L
I
G
V
E
K
S
K
E
F
-------
A
D
R
L
N
R
E
A
Q
E
Q
L
---------------------------------
11
PsiBlast_PDB
52.31
44%
-32
- C1 -
-
3KRO
2
?
A:
[31-272]
-----------------------------
I
H
E
S
M
R
Y
S
L
L
A
G
G
K
R
V
R
P
M
L
C
I
A
A
C
E
L
V
GGD--
E
S
T
------
A
M
-
P
-
A
-----
A
C
A
V
E
M
I
H
T
M
S
L
M
H
D
D
L
P
C
M
D
N
D
D
L
R
R
G
K
P
T
N
H
M
A
F
G
E
S
V
A
V
L
A
G
D
A
L
L
S
F
A
F
E
H
V
A
A
--
A
TK
G
-
A
--
P
---
P
---------
E
R
I
V
R
V
L
G
E
L
A
V
S
I
G
S
E
G
L
V
A
-
G
Q
V
V
D
-
V
C
S
E
G
M
A-
E
--
V
G
L
D
H
---
L
E
F
I
H
H
H
K
T
A
A
L
L
Q
G
S
V
V
L
G
A
I
-
L
G
G
G
-
K
-
E
E
E
V
A
K
-
L
R
-
K
F
A
N
C
I
G
L
L
F
Q
V
V
D
D
I
L
D
V
T
K
----------------
K
T
T
Y
P
K
L
I
G
V
E
K
S
K
E
F
-------
A
D
R
L
N
R
E
A
Q
E
Q
L
---------------------------------
12
PsiBlast_PDB
52.17
44%
-31
- C1 -
-
3KRP
1
?
A:
[31-272]
-----------------------------
I
H
E
S
M
R
Y
S
L
L
A
G
G
K
R
V
R
P
M
L
C
I
A
A
C
E
L
V
GGD--
E
S
T
------
A
M
-
P
-
A
-----
A
C
A
V
E
M
I
H
T
M
S
L
M
H
D
D
L
P
C
M
D
N
D
D
L
R
R
G
K
P
T
N
H
M
A
F
G
E
S
V
A
V
L
A
G
D
A
L
L
S
F
A
F
E
H
V
A
A
--
A
TK
G
-
A
--
P
---
P
---------
E
R
I
V
R
V
L
G
E
L
A
V
S
I
G
S
E
G
L
V
A
-
G
Q
V
V
D
-
V
C
S
E
G
M
A-
E
--
V
G
L
D
H
---
L
E
F
I
H
H
H
K
T
A
A
L
L
Q
G
S
V
V
L
G
A
I
-
L
G
G
G
-
K
-
E
E
E
V
A
K
-
L
R
-
K
F
A
N
C
I
G
L
L
F
Q
V
V
D
D
I
L
D
V
T
K
----------------
K
T
T
Y
P
K
L
I
G
V
E
K
S
K
E
F
-------
A
D
R
L
N
R
E
A
Q
E
Q
L
---------------------------------
30
PsiBlast_CBE
51.67
44%
-32
- C1 -
-
3KRP
1
?
D:
[31-272]
-----------------------------
I
H
E
S
M
R
Y
S
L
L
A
G
G
K
R
V
R
P
M
L
C
I
A
A
C
E
L
V
GGD--
E
S
T
------
A
M
-
P
-
A
-----
A
C
A
V
E
M
I
H
T
M
S
L
M
H
D
D
L
P
C
M
D
N
D
D
L
R
R
G
K
P
T
N
H
M
A
F
G
E
S
V
A
V
L
A
G
D
A
L
L
S
F
A
F
E
H
V
A
A
--
A
TK
G
-
A
--
P
---
P
---------
E
R
I
V
R
V
L
G
E
L
A
V
S
I
G
S
E
G
L
V
A
-
G
Q
V
V
D
-
V
C
S
E
G
M
A-
E
--
V
G
L
D
H
---
L
E
F
I
H
H
H
K
T
A
A
L
L
Q
G
S
V
V
L
G
A
I
-
L
G
G
G
-
K
-
E
E
E
V
A
K
-
L
R
-
K
F
A
N
C
I
G
L
L
F
Q
V
V
D
D
I
L
D
V
T
K
S
S
K
E
L
G
K
-----------
T
Y
P
K
L
I
G
V
E
K
S
K
E
F
-------
A
D
R
L
N
R
E
A
Q
E
Q
L
---------------------------------
13
PsiBlast_PDB
51.03
44%
-33
- C1 -
-
3OAB
2
?
A:
[31-272]
-----------------------------
I
H
E
S
M
R
Y
S
L
L
A
G
G
K
R
V
R
P
M
L
C
I
A
A
C
E
L
V
GGD--
E
S
T
------
A
M
-
P
-
A
-----
A
C
A
V
E
M
I
H
T
M
S
L
M
H
D
D
L
P
C
M
D
N
D
D
L
R
R
G
K
P
T
N
H
M
A
F
G
E
S
V
A
V
L
A
G
D
A
L
L
S
F
A
F
E
H
V
A
A
--
A
TK
G
-
A
--
P
---
P
---------
E
R
I
V
R
V
L
G
E
L
A
V
S
I
G
S
E
G
L
V
A
-
G
Q
V
V
D
-
V
C
S
E
G
M
A-
E
--
V
G
L
D
H
---
L
E
F
I
H
H
H
K
T
A
A
L
L
Q
G
S
V
V
L
G
A
I
-
L
G
G
G
-
K
-
E
E
E
V
A
K
-
L
R
-
K
F
A
N
C
I
G
L
L
F
Q
V
V
D
D
I
L
D
V
T
K
----------------
K
T
T
Y
P
K
L
I
G
V
E
K
S
K
E
F
-------
A
D
R
L
N
R
E
A
Q
E
Q
L
---------------------------------
9
PsiBlast_PDB
50.94
44%
-34
- C1 -
-
3KRC
1
?
A:
[31-272]
-----------------------------
I
H
E
S
M
R
Y
S
L
L
A
G
G
K
R
V
R
P
M
L
C
I
A
A
C
E
L
V
GGD--
E
S
T
------
A
M
-
P
-
A
-----
A
C
A
V
E
M
I
H
T
M
S
L
M
H
D
D
L
P
C
M
D
N
D
D
L
R
R
G
K
P
T
N
H
M
A
F
G
E
S
V
A
V
L
A
G
D
A
L
L
S
F
A
F
E
H
V
A
A
--
A
TK
G
-
A
--
P
---
P
---------
E
R
I
V
R
V
L
G
E
L
A
V
S
I
G
S
E
G
L
V
A
-
G
Q
V
V
D
-
V
C
S
E
G
M
A-
E
--
V
G
L
D
H
---
L
E
F
I
H
H
H
K
T
A
A
L
L
Q
G
S
V
V
L
G
A
I
-
L
G
G
G
-
K
-
E
E
E
V
A
K
-
L
R
-
K
F
A
N
C
I
G
L
L
F
Q
V
V
D
D
I
L
D
V
T
K
----------------
K
T
T
Y
P
K
L
I
G
V
E
K
S
K
E
F
-------
A
D
R
L
N
R
E
A
Q
E
Q
L
---------------------------------
51
PsiBlast_CBE
50.25
35%
-4
- C1 -
-
3Q1O
2
?
A:
[37-307]
--------------------
E
-
S
-
F
H
P
-
Y
L
E
K
A
F
F
E
M
V
L
N
G
G
K
R
F
R
P
K
L
F
L
A
V
L
C
A
L
V
G
Q
K
D
Y
S
N
------
Q
Q
-
T
-
E
Y
F
K
-
I
A
L
S
I
E
C
L
H
T
Y
S
L
I
H
D
D
L
P
C
M
D
N
A
A
L
R
R
N
H
P
T
L
H
A
K
Y
D
E
T
T
A
V
L
I
G
D
A
L
N
T
Y
S
F
E
L
L
S
N
--
A
--
L
-
L
--
E
---
S
---------
H
I
I
V
E
L
I
K
I
L
S
A
N
G
G
I
K
G
M
I
L
-
G
Q
A
L
D
-
C
Y
F
E
N
T
--
P
--
L
N
L
E
Q
---
L
T
F
L
H
E
H
K
T
A
K
L
I
S
A
S
L
I
M
G
L
V
-
A
S
G
I
-
K
-
D
E
E
L
F
K
W
L
Q
-
A
F
G
L
K
M
G
L
C
F
Q
V
L
D
D
I
I
D
V
T
Q
D
E
E
E
S
G
K
T
T
H
L
D
--
S
A
K
N
S
F
V
N
L
L
G
L
E
R
A
N
N
Y
-------
A
Q
T
L
K
T
E
V
L
N
D
L
D
A
L
K
P
A
--
Y
P
-
L
L
Q
E
-----
N
L
N
A
L
L
N
T
L
----
20
PsiBlast_PDB
50.05
43%
-35
- C1 -
-
1RQI
3
ISPA_ECOLI
A:
[35-281]
-------------------------------
E
T
M
Q
Y
G
A
L
L
G
G
K
R
L
R
P
F
L
V
Y
A
T
G
H
M
F
-----
G
V
S
------
T
N
-
T
-
L
D
A
P
-
A
A
-
A
V
E
C
I
H
A
Y
S
L
I
H
D
D
L
P
A
M
D
D
D
D
L
R
R
G
L
P
T
C
H
V
K
F
G
E
A
N
A
I
L
A
G
D
A
L
Q
T
L
A
F
S
I
L
S
D
--
A
--
D
-
M
--
P
EVS
D
---------
R
D
R
I
S
M
I
S
E
L
A
S
A
S
G
I
A
G
M
C
G
-
G
Q
A
L
D
-
L
D
A
E
G
K
--
H
--
V
P
L
D
A
---
L
E
R
I
H
R
H
K
T
G
A
L
I
R
A
A
V
R
L
G
A
L
-
S
A
G
D
-
K
-
G
R
R
A
L
P
V
L
D
-
K
Y
A
E
S
I
G
L
A
F
Q
V
Q
D
D
I
L
D
V
V
G
D
T
A
T
L
G
K
R
Q
G
A
D
Q
Q
L
G
K
S
T
Y
P
A
L
L
G
L
E
Q
A
R
K
K
-------
A
R
D
L
I
D
D
A
R
Q
S
L
K
Q
L
A
E
Q
---------------------------
38
PsiBlast_CBE
50.02
43%
-37
- C1 -
-
1RQI
2
ISPA_ECOLI
B:
[35-281]
-------------------------------
E
T
M
Q
Y
G
A
L
L
G
G
K
R
L
R
P
F
L
V
Y
A
T
G
H
M
F
-----
G
V
S
------
T
N
-
T
-
L
D
A
P
-
A
A
-
A
V
E
C
I
H
A
Y
S
L
I
H
D
D
L
P
A
M
D
D
D
D
L
R
R
G
L
P
T
C
H
V
K
F
G
E
A
N
A
I
L
A
G
D
A
L
Q
T
L
A
F
S
I
L
S
D
--
A
--
D
-
M
--
P
EVS
D
---------
R
D
R
I
S
M
I
S
E
L
A
S
A
S
G
I
A
G
M
C
G
-
G
Q
A
L
D
-
L
D
A
E
G
K
--
H
--
V
P
L
D
A
---
L
E
R
I
H
R
H
K
T
G
A
L
I
R
A
A
V
R
L
G
A
L
-
S
A
G
D
-
K
-
G
R
R
A
L
P
V
L
D
-
K
Y
A
E
S
I
G
L
A
F
Q
V
Q
D
D
I
L
D
V
V
G
D
T
A
T
L
G
K
R
Q
G
A
D
Q
Q
L
G
K
S
T
Y
P
A
L
L
G
L
E
Q
A
R
K
K
-------
A
R
D
L
I
D
D
A
R
Q
S
L
K
Q
L
A
E
Q
---------------------------
40
PsiBlast_CBE
49.83
43%
-36
- C1 -
-
1RQJ
2
ISPA_ECOLI
A:
[34-280]
-------------------------------
E
T
M
Q
Y
G
A
L
L
G
G
K
R
L
R
P
F
L
V
Y
A
T
G
H
M
F
-----
G
V
S
------
T
N
-
T
-
L
D
A
P
-
A
A
-
A
V
E
C
I
H
A
Y
S
L
I
H
D
D
L
P
A
M
D
D
D
D
L
R
R
G
L
P
T
C
H
V
K
F
G
E
A
N
A
I
L
A
G
D
A
L
Q
T
L
A
F
S
I
L
S
D
--
A
--
D
-
M
--
P
EVS
D
---------
R
D
R
I
S
M
I
S
E
L
A
S
A
S
G
I
A
G
M
C
G
-
G
Q
A
L
D
-
L
D
A
E
G
K
--
H
--
V
P
L
D
A
---
L
E
R
I
H
R
H
K
T
G
A
L
I
R
A
A
V
R
L
G
A
L
-
S
A
G
D
-
K
-
G
R
R
A
L
P
V
L
D
-
K
Y
A
E
S
I
G
L
A
F
Q
V
Q
D
D
I
L
D
V
V
G
D
T
A
T
L
G
K
R
Q
G
A
D
Q
Q
L
G
K
S
T
Y
P
A
L
L
G
L
E
Q
A
R
K
K
-------
A
R
D
L
I
D
D
A
R
Q
S
L
K
Q
L
A
E
Q
---------------------------
39
PsiBlast_CBE
49.67
43%
-35
- C1 -
-
1RQJ
2
ISPA_ECOLI
B:
[34-280]
-------------------------------
E
T
M
Q
Y
G
A
L
L
G
G
K
R
L
R
P
F
L
V
Y
A
T
G
H
M
F
-----
G
V
S
------
T
N
-
T
-
L
D
A
P
-
A
A
-
A
V
E
C
I
H
A
Y
S
L
I
H
D
D
L
P
A
M
D
D
D
D
L
R
R
G
L
P
T
C
H
V
K
F
G
E
A
N
A
I
L
A
G
D
A
L
Q
T
L
A
F
S
I
L
S
D
--
A
--
D
-
M
--
P
EVS
D
---------
R
D
R
I
S
M
I
S
E
L
A
S
A
S
G
I
A
G
M
C
G
-
G
Q
A
L
D
-
L
D
A
E
G
K
--
H
--
V
P
L
D
A
---
L
E
R
I
H
R
H
K
T
G
A
L
I
R
A
A
V
R
L
G
A
L
-
S
A
G
D
-
K
-
G
R
R
A
L
P
V
L
D
-
K
Y
A
E
S
I
G
L
A
F
Q
V
Q
D
D
I
L
D
V
V
G
D
T
A
T
L
G
K
R
Q
G
A
D
Q
Q
L
G
K
S
T
Y
P
A
L
L
G
L
E
Q
A
R
K
K
-------
A
R
D
L
I
D
D
A
R
Q
S
L
K
Q
L
A
E
Q
---------------------------
49
PsiBlast_CBE
49.58
35%
-9
- C1 -
-
3Q1O
2
?
C:
[37-307]
--------------------
E
-
S
-
F
H
P
-
Y
L
E
K
A
F
F
E
M
V
L
N
G
G
K
R
F
R
P
K
L
F
L
A
V
L
C
A
L
VGQKD
Y
S
N
------
Q
Q
-
T
-
E
Y
F
K
-
I
A
L
S
I
E
C
L
H
T
Y
S
L
I
H
D
D
L
P
C
M
D
N
A
A
L
R
R
N
H
P
T
L
H
A
K
Y
D
E
T
T
A
V
L
I
G
D
A
L
N
T
Y
S
F
E
L
L
S
N
--
A
--
L
-
L
--
E
---
S
---------
H
I
I
V
E
L
I
K
I
L
S
A
N
G
G
I
K
G
M
I
L
-
G
Q
A
L
D
-
C
Y
F
E
N
T
--
P
--
L
N
L
E
Q
---
L
T
F
L
H
E
H
K
T
A
K
L
I
S
A
S
L
I
M
G
L
V
-
A
S
G
I
-
K
-
D
E
E
L
F
K
W
L
Q
-
A
F
G
L
K
M
G
L
C
F
Q
V
L
D
D
I
I
D
V
T
Q
D
E
E
E
S
G
K
T
T
H
L
D
--
S
A
K
N
S
F
V
N
L
L
G
L
E
R
A
N
N
Y
-------
A
Q
T
L
K
T
E
V
L
N
D
L
D
A
L
K
P
A
--
Y
P
-
L
L
Q
E
-----
N
L
N
A
L
L
N
T
L
----
31
PsiBlast_CBE
48.83
44%
-14
- C1 -
-
3KRO
2
?
D:
[31-272]
-----------------------------
I
H
E
S
M
R
Y
S
L
L
A
G
G
K
R
V
R
P
M
L
C
I
A
A
C
E
L
V
GGD--
E
S
T
------
A
M
-
P
-
A
-----
A
C
A
V
E
M
I
H
T
M
S
L
M
H
D
D
L
P
C
M
D
N
D
D
L
R
R
G
K
P
T
N
H
M
A
F
G
E
S
V
A
V
L
A
G
D
A
L
L
S
F
A
F
E
H
V
A
A
--
A
TK
G
-
A
--
P
---
P
---------
E
R
I
V
R
V
L
G
E
L
A
V
S
I
G
S
E
G
L
V
A
-
G
Q
V
V
D
-
V
C
S
E
G
M
A-
E
--
V
G
L
D
H
---
L
E
F
I
H
H
H
K
T
A
A
L
L
Q
G
S
V
V
L
G
A
I
-
L
G
G
G
-
K
-
E
E
E
V
A
K
-
L
R
-
K
F
A
N
C
I
G
L
L
F
Q
V
V
D
D
I
L
D
V
T
K
S
S
K
E
L
G
K
T
A
G
K
D
L
V
A
D
K
T
T
Y
P
K
L
I
G
V
E
K
S
K
E
F
-------
A
D
R
L
N
R
E
A
Q
E
Q
L
---------------------------------
50
PsiBlast_CBE
48.16
35%
-3
- C1 -
-
3Q1O
2
?
B:
[37-307]
--------------------
E
-
S
-
F
H
P
-
Y
L
E
K
A
F
F
E
M
V
L
N
G
G
K
R
F
R
P
K
L
F
L
A
V
L
C
A
L
V
G
Q
K
D
Y
S
N
------
Q
Q
-
T
-
E
Y
F
K
-
I
A
L
S
I
E
C
L
H
T
Y
S
L
I
H
D
D
L
P
C
M
D
N
A
A
L
R
R
N
H
P
T
L
H
A
K
Y
D
E
T
T
A
V
L
I
G
D
A
L
N
T
Y
S
F
E
L
L
S
N
--
A
--
L
-
L
--
E
---
S
---------
H
I
I
V
E
L
I
K
I
L
S
A
N
G
G
I
K
G
M
I
L
-
G
Q
A
L
D
-
C
Y
F
E
N
T
--
P
--
L
N
L
E
Q
---
L
T
F
L
H
E
H
K
T
A
K
L
I
S
A
S
L
I
M
G
L
V
-
A
S
G
I
-
K
-
D
E
E
L
F
K
W
L
Q
-
A
F
G
L
K
M
G
L
C
F
Q
V
L
D
D
I
I
D
V
T
Q
D
E
E
E
S
G
K
T
T
H
L
D
--
S
A
K
N
S
F
V
N
L
L
G
L
E
R
A
N
N
Y
-------
A
Q
T
L
K
T
E
V
L
N
D
L
D
A
L
K
P
A
--
Y
P
-
L
L
Q
E
-----
N
L
N
A
L
L
N
T
L
----
33
PsiBlast_CBE
47.32
44%
-38
- C1 -
-
3KRC
1
?
D:
[31-272]
-----------------------------
I
H
E
S
M
R
Y
S
L
L
A
G
G
K
R
V
R
P
M
L
C
I
A
A
C
E
L
V
GGD--
E
S
T
------
A
M
-
P
-
A
-----
A
C
A
V
E
M
I
H
T
M
S
L
M
H
D
D
L
P
C
M
D
N
D
D
L
R
R
G
K
P
T
N
H
M
A
F
G
E
S
V
A
V
L
A
G
D
A
L
L
S
F
A
F
E
H
V
A
A
--
A
TK
G
-
A
--
P
---
P
---------
E
R
I
V
R
V
L
G
E
L
A
V
S
I
G
S
E
G
L
V
A
-
G
Q
V
V
D
-
V
C
S
E
G
M
A-
E
--
V
G
L
D
H
---
L
E
F
I
H
H
H
K
T
A
A
L
L
Q
G
S
V
V
L
G
A
I
-
L
G
G
G
-
K
-
E
E
E
V
A
K
-
L
R
-
K
F
A
N
C
I
G
L
L
F
Q
V
V
D
D
I
L
D
V
T
------------------
T
T
Y
P
K
L
I
G
V
E
K
S
K
E
F
-------
A
D
R
L
N
R
E
A
Q
E
Q
L
---------------------------------
29
PsiBlast_CBE
47.23
44%
-12
- C1 -
-
3OAB
2
?
D:
[31-272]
-----------------------------
I
H
E
S
M
R
Y
S
L
L
A
G
G
K
R
V
R
P
M
L
C
I
A
A
C
E
L
V
GGD--
E
S
T
------
A
M
-
P
-
A
-----
A
C
A
V
E
M
I
H
T
M
S
L
M
H
D
D
L
P
C
M
D
N
D
D
L
R
R
G
K
P
T
N
H
M
A
F
G
E
S
V
A
V
L
A
G
D
A
L
L
S
F
A
F
E
H
V
A
A
--
A
TK
G
-
A
--
P
---
P
---------
E
R
I
V
R
V
L
G
E
L
A
V
S
I
G
S
E
G
L
V
A
-
G
Q
V
V
D
-
V
C
S
E
G
M
A-
E
--
V
G
L
D
H
---
L
E
F
I
H
H
H
K
T
A
A
L
L
Q
G
S
V
V
L
G
A
I
-
L
G
G
G
-
K
-
E
E
E
V
A
K
-
L
R
-
K
F
A
N
C
I
G
L
L
F
Q
V
V
D
D
I
L
D
V
T
K
S
S
K
E
L
G
K
T
A
G
K
D
L
V
A
D
K
T
T
Y
P
K
L
I
G
V
E
K
S
K
E
F
-------
A
D
R
L
N
R
E
A
Q
E
Q
L
---------------------------------
48
PsiBlast_CBE
47.17
35%
-5
- C1 -
-
3Q1O
2
?
D:
[37-307]
--------------------
E
-
S
-
F
H
P
-
Y
L
E
K
A
F
F
E
M
V
L
N
G
G
K
R
F
R
P
K
L
F
L
A
V
L
C
A
L
VGQKD
Y
S
N
------
Q
Q
-
T
-
E
Y
F
K
-
I
A
L
S
I
E
C
L
H
T
Y
S
L
I
H
D
D
L
P
C
M
D
N
A
A
L
R
R
N
H
P
T
L
H
A
K
Y
D
E
T
T
A
V
L
I
G
D
A
L
N
T
Y
S
F
E
L
L
S
N
--
A
--
L
-
L
--
E
---
S
---------
H
I
I
V
E
L
I
K
I
L
S
A
N
G
G
I
K
G
M
I
L
-
G
Q
A
L
D
-
C
Y
F
E
N
T
--
P
--
L
N
L
E
Q
---
L
T
F
L
H
E
H
K
T
A
K
L
I
S
A
S
L
I
M
G
L
V
-
A
S
G
I
-
K
-
D
E
E
L
F
K
W
L
Q
-
A
F
G
L
K
M
G
L
C
F
Q
V
L
D
D
I
I
D
V
T
Q
D
E
E
E
S
G
K
T
T
H
L
D
--
S
A
K
N
S
F
V
N
L
L
G
L
E
R
A
N
N
Y
-------
A
Q
T
L
K
T
E
V
L
N
D
L
D
A
L
K
P
A
--
Y
P
-
L
L
Q
E
-----
N
L
N
A
L
L
N
T
L
----
32
PsiBlast_CBE
46.25
44%
-13
- C1 -
-
3KRF
2
?
D:
[31-272]
-----------------------------
I
H
E
S
M
R
Y
S
L
L
A
G
G
K
R
V
R
P
M
L
C
I
A
A
C
E
L
V
GGD--
E
S
T
------
A
M
-
P
-
A
-----
A
C
A
V
E
M
I
H
T
M
S
L
M
H
D
D
L
P
C
M
D
N
D
D
L
R
R
G
K
P
T
N
H
M
A
F
G
E
S
V
A
V
L
A
G
D
A
L
L
S
F
A
F
E
H
V
A
A
--
A
TK
G
-
A
--
P
---
P
---------
E
R
I
V
R
V
L
G
E
L
A
V
S
I
G
S
E
G
L
V
A
-
G
Q
V
V
D
-
V
C
S
E
G
M
A-
E
--
V
G
L
D
H
---
L
E
F
I
H
H
H
K
T
A
A
L
L
Q
G
S
V
V
L
G
A
I
-
L
G
G
G
-
K
-
E
E
E
V
A
K
-
L
R
-
K
F
A
N
C
I
G
L
L
F
Q
V
V
D
D
I
L
D
V
T
K
S
S
K
E
L
G
K
T
A
G
K
D
L
V
A
D
K
T
T
Y
P
K
L
I
G
V
E
K
S
K
E
F
-------
A
D
R
L
N
R
E
A
Q
E
Q
L
---------------------------------
28
PsiBlast_CBE
45.92
44%
-19
- C1 -
-
3OAC
2
?
D:
[31-272]
-----------------------------
I
H
E
S
M
R
Y
S
L
L
A
G
G
K
R
V
R
P
M
L
C
I
A
A
C
E
L
V
GGD--
E
S
T
------
A
M
-
P
-
A
-----
A
C
A
V
E
M
I
H
T
M
S
L
M
H
D
D
L
P
C
M
D
N
D
D
L
R
R
G
K
P
T
N
H
M
A
F
G
E
S
V
A
V
L
A
G
D
A
L
L
S
F
A
F
E
H
V
A
A
--
A
TK
G
-
A
--
P
---
P
---------
E
R
I
V
R
V
L
G
E
L
A
V
S
I
G
S
E
G
L
V
A
-
G
Q
V
V
D
-
V
C
S
E
G
M
A-
E
--
V
G
L
D
H
---
L
E
F
I
H
H
H
K
T
A
A
L
L
Q
G
S
V
V
L
G
A
I
-
L
G
G
G
-
K
-
E
E
E
V
A
K
-
L
R
-
K
F
A
N
C
I
G
L
L
F
Q
V
V
D
D
I
L
D
V
T
K
S
S
K
E
L
G
K
T
A
G
K
D
L
V
A
D
K
T
T
Y
P
K
L
I
G
V
E
K
S
K
E
F
-------
A
D
R
L
N
R
E
A
Q
E
Q
L
---------------------------------
37
PsiBlast_CBE
44.56
41%
-33
- C1 -
-
4LLS
3
?
B:
[60-289]
---------------------------------------
S
G
G
K
R
L
R
G
F
L
V
L
E
T
A
R
L
H
-----
D
I
A
------
A
G
-
E
-
A
-
I
W
-
S
A
T
A
I
E
A
L
H
A
Y
S
L
V
H
D
D
L
P
C
M
D
N
D
D
M
R
R
G
Q
P
T
V
H
K
K
W
D
D
A
T
A
V
L
A
G
D
A
L
Q
T
L
A
F
E
L
V
T
H
PG
A
--
S
-
A
--
S
---
A
---------
E
V
R
A
D
L
A
L
S
L
A
R
A
S
G
A
Q
G
M
V
L
-
G
Q
A
L
D
-
I
A
A
E
T
A
--
R
AP
L
S
L
D
E
---
I
T
R
L
Q
Q
G
K
T
G
A
L
I
G
W
S
A
Q
A
G
A
R
-
L
A
Q
A
-
D
-
T
---
A
A
-
L
K
-
R
Y
A
Q
A
L
G
L
A
F
Q
I
A
D
D
I
L
D
V
T
G
D
S
A
Q
V
G
K
A
V
G
K
D
A
S
A
G
K
A
T
F
V
S
L
L
G
L
D
A
A
R
A
R
-------
A
M
S
L
I
D
E
A
C
D
S
L
---------------------------------
19
PsiBlast_PDB
44.36
41%
-33
- C1 -
-
4LLT
2
?
A:
[60-289]
---------------------------------------
S
G
G
K
R
L
R
G
F
L
V
L
E
T
A
R
L
H
-----
D
I
A
------
A
G
-
E
-
A
-
I
W
-
S
A
T
A
I
E
A
L
H
A
Y
S
L
V
H
D
D
L
P
C
M
D
N
D
D
M
R
R
G
Q
P
T
V
H
K
K
W
D
D
A
T
A
V
L
A
G
D
A
L
Q
T
L
A
F
E
L
V
T
H
PG
A
--
S
-
A
--
S
---
A
---------
E
V
R
A
D
L
A
L
S
L
A
R
A
S
G
A
Q
G
M
V
L
-
G
Q
A
L
D
-
I
A
A
E
T
A
--
R
AP
L
S
L
D
E
---
I
T
R
L
Q
Q
G
K
T
G
A
L
I
G
W
S
A
Q
A
G
A
R
-
L
A
Q
A
-
D
-
T
---
A
A
-
L
K
-
R
Y
A
Q
A
L
G
L
A
F
Q
I
A
D
D
I
L
D
V
T
G
D
S
A
Q
V
G
K
A
V
G
K
D
A
S
A
G
K
A
T
F
V
S
L
L
G
L
D
A
A
R
A
R
-------
A
M
S
L
I
D
E
A
C
D
S
L
---------------------------------
36
PsiBlast_CBE
43.43
41%
-33
- C1 -
-
4LLT
2
?
B:
[60-289]
---------------------------------------
S
G
G
K
R
L
R
G
F
L
V
L
E
T
A
R
L
H
-----
D
I
A
------
A
G
-
E
-
A
-
I
W
-
S
A
T
A
I
E
A
L
H
A
Y
S
L
V
H
D
D
L
P
C
M
D
N
D
D
M
R
R
G
Q
P
T
V
H
K
K
W
D
D
A
T
A
V
L
A
G
D
A
L
Q
T
L
A
F
E
L
V
T
H
PG
A
--
S
-
A
--
S
---
A
---------
E
V
R
A
D
L
A
L
S
L
A
R
A
S
G
A
Q
G
M
V
L
-
G
Q
A
L
D
-
I
A
A
E
T
A
--
R
A
P
L
S
L
D
E
---
I
T
R
L
Q
Q
G
K
T
G
A
L
I
G
W
S
A
Q
A
G
A
R
-
L
A
Q
A
-
D
-
T
---
A
A
-
L
K
-
R
Y
A
Q
A
L
G
L
A
F
Q
I
A
D
D
I
L
D
V
T
G
D
S
A
Q
V
G
K
A
V
G
K
D
A
S
A
G
K
A
T
F
V
S
L
L
G
L
D
A
A
R
A
R
-------
A
M
S
L
I
D
E
A
C
D
S
L
---------------------------------
18
PsiBlast_PDB
43.28
41%
-32
- C1 -
-
4LLS
3
?
A:
[60-289]
---------------------------------------
S
G
G
K
R
L
R
G
F
L
V
L
E
T
A
R
L
H
-----
D
I
A
------
A
G
-
E
-
A
-
I
W
-
S
A
T
A
I
E
A
L
H
A
Y
S
L
V
H
D
D
L
P
C
M
D
N
D
D
M
R
R
G
Q
P
T
V
H
K
K
W
D
D
A
T
A
V
L
A
G
D
A
L
Q
T
L
A
F
E
L
V
T
H
PG
A
--
S
-
A
--
S
---
A
---------
E
V
R
A
D
L
A
L
S
L
A
R
A
S
G
A
Q
G
M
V
L
-
G
Q
A
L
D
-
I
A
A
E
T
A
--
R
A
P
L
S
L
D
E
---
I
T
R
L
Q
Q
G
K
T
G
A
L
I
G
W
S
A
Q
A
G
A
R
-
L
A
Q
A
-
D
-
T
---
A
A
-
L
K
-
R
Y
A
Q
A
L
G
L
A
F
Q
I
A
D
D
I
L
D
V
T
G
D
S
A
Q
V
G
K
A
V
G
K
D
A
S
A
G
K
A
T
F
V
S
L
L
G
L
D
A
A
R
A
R
-------
A
M
S
L
I
D
E
A
C
D
S
L
---------------------------------
57
PsiBlast_CBE
32.79
31%
-91
- C1 -
-
3Q2Q
3
?
A:
[66-293]
---------------------------------
V
M
H
L
T
R
A
G
G
K
R
F
R
P
M
F
A
L
L
A
S
E
F
G
-----
E
K
P
------
L
S
-
E
-
N
V
I
K
-
A
A
V
V
V
E
I
T
H
L
A
T
L
Y
H
D
D
V
--
M
D
E
A
-------
S
A
N
A
R
W
D
N
S
V
A
I
L
A
G
D
I
L
L
A
H
A
S
G
L
M
----------------
S
---------
Q
L
G
T
D
T
V
A
H
F
A
E
T
F
G
E
L
--
V
T
-
G
Q
M
R
E
-
T
V
G
P
R
D
--
T
--
D
P
I
E
H
---
Y
T
N
V
I
R
E
K
T
G
V
L
I
A
S
A
G
Y
L
G
A
M
-
H
A
G
A
-
A
-
P
E
H
I
D
A
-
L
K
-
N
F
G
A
A
V
G
M
I
F
Q
I
V
D
D
I
I
D
I
F
S
E
T
H
----
T
P
G
T
D
L
R
E
G
V
F
T
L
P
V
L
Y
A
L
R
E
D
T
P
V
-------
G
A
E
L
R
D
I
L
T
G
P
L
E
D
-------------------------------
55
PsiBlast_CBE
32.67
33%
-68
- C1 -
-
3WJO
2
?
A:
[36-255]
-------------
L
E
Q
L
N
S
D
V
-
Q
-
L
I
N
-
Q
L
G
---
Y
Y
I
V
S
G
G
G
K
R
I
R
P
--
M
I
A
V
L
A
A
R
-----
A
V
G
------
Y
E
G
N
-
A
H
V
T
-
I
A
A
L
I
E
F
I
H
T
A
T
L
L
H
D
D
V
--
V
D
E
S
D
M
R
R
G
K
A
T
A
N
A
A
F
G
N
A
A
S
V
L
V
G
D
F
I
Y
T
R
A
F
Q
M
M
T
S
--
L
-----------
G
---------
S
L
K
V
-----
L
E
V
M
S
E
A
V
N
V
I
A
E
G
E
V
L
Q
L
M
N
-------------
N
---
Y
M
R
V
I
Y
S
K
T
A
R
L
F
E
A
A
A
Q
C
S
G
I
-
L
A
G
C
-
T
-
P
E
E
E
K
G
-
L
Q
-
D
Y
G
R
Y
L
G
T
A
F
Q
L
I
D
D
L
L
D
Y
N
A
--------
V
G
D
D
L
N
E
G
K
P
T
L
P
L
L
-------------------------------------------------------------
58
PsiBlast_CBE
18.82
34%
-6
- C1 -
-
3OYR
2
?
B:
[61-268]
-------------------------------------
I
A
A
G
G
K
R
L
R
P
--
L
M
T
V
A
A
A
R
-----
L
A
G
------
A
D
-
N
-
D
H
F
Q
K
L
A
A
A
V
E
F
I
H
T
A
T
L
L
H
D
D
V
--
V
D
G
S
Q
L
R
R
G
K
V
A
A
H
L
I
W
G
G
A
Q
S
V
L
V
G
D
F
L
F
A
R
A
F
E
L
M
V
E
--
T
--
N
-
S
--
M
---
K
---------
A
L
E
I
-------
L
A
R
A
S
R
V
I
A
E
-
G
E
V
L
Q
-
L
M
R
S
H
D
-----
L
N
L
S
Q
A
V
Y
L
E
I
I
Q
A
-
K
T
A
E
L
F
A
A
A
S
E
A
G
A
V
-
S
A
G
V
-
D
-
V
A
K
S
E
A
-
L
R
-
D
Y
G
L
N
L
G
L
A
F
Q
L
A
D
D
A
L
D
Y
G
G
A
T
E
T
L
G
K
N
A
G
D
D
F
R
E
G
K
A
T
L
P
L
L
L
A
I
A
R
S
-------------------------------------------------------