@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 : B0VT69: (2017-12-11 )
MMKIAVLVSGNGSNLQALIDANLSGQIVGVLSNKADAYALERAQNANIATAVISHKDFPSREDFDEAMHQQLIAWQADVVILAGFMRILTANFVDKWQGKMLNIHPSLLPAYKGVNTHQRVLNTGDRLHGCTVHFVTSELDAGQAIAQSAIEVKEHDNVASLAERVHKLEHFIYPQVAEWLCNGQLTWKNGQAYFRNQILEHPIRFASW
Atome Classification :
(63 SA)
.........10........20----.----....----...30........40........50........60....-....70........80........90........100.......110.......120.......130.......140.......150.......160.......170.......180......-.190-.......200.......
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
M
M
K
I
A
V
L
V
SGNGS
N
L
Q
A
L
I
DA----N----LS
G
Q
----
I
V
G
V
LSNKA
D
A
Y
A
L
E
RAQNAN
I
A
T
A
V
ISHKDFPS
R
E
D
F
D
-
E
A
M
H
Q
Q
L
I
A
W
Q
A
D
V
V
I
L
A
G
F
M
R
I
L
T
A
N
F
V
D
K
WQ
G
K
M
LNIHP
S
L
L
P
A
YKGV
N
T
H
Q
R
V
LNTGDRLH
G
C
T
V
H
F
V
TSELDA
G
Q
A
I
A
Q
S
A
I
EVKEHD
N
V
A
S
L
A
E
R
V
H
K
L
E
H
F
I
Y
P
Q
V
A
E
W
L
CNG
Q
L
T
W-KN
G
Q
-
A
Y
F
R
N
Q
I
L
EHPIRFASW
42
PsiBlast_CBE
85.63
50%
-46
- C4 -
-
1MEJ
1
PUR2_HUMAN
A:
[14-211]
---
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
I
C
W
V
--------------
13
PsiBlast_PDB
85.31
51%
-48
- C4 -
-
5J9F
2
A:
[2-197]
-
A
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
A
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
21
PsiBlast_CBE
85.22
51%
-51
- C4 -
-
4EW3
1
A:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
7
PsiBlast_PDB
85.20
51%
-49
- C4 -
-
4ZYV
2
A:
[2-197]
-
A
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
40
PsiBlast_CBE
85.17
50%
-50
- C4 -
-
1MEJ
1
C:
[14-211]
---
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
TREP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
I
C
W
V
--------------
38
PsiBlast_CBE
85.01
50%
-46
- C4 -
-
1MEN
1
PUR2_HUMAN
B:
[14-211]
---
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
TREP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
I
C
W
V
--------------
17
PsiBlast_PDB
84.94
51%
-45
- C4 -
-
1RBQ
1
PUR2_HUMAN
A:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
50
PsiBlast_CBE
84.91
47%
-57
- C4 -
-
1JKX
1
PUR3_ECOLI
A:
[1-203]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
---------
6
PsiBlast_PDB
84.87
51%
-48
- C4 -
-
4ZYU
2
A:
[2-197]
-
A
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
10
PsiBlast_PDB
84.86
51%
-46
- C4 -
-
4ZYY
2
A:
[2-197]
-
A
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
15
PsiBlast_PDB
84.77
51%
-44
- C4 -
-
1NJS
1
PUR2_HUMAN
A:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
33
PsiBlast_CBE
84.76
51%
-45
- C4 -
-
1RBQ
2
PUR2_HUMAN
C:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
TREP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
5
PsiBlast_PDB
84.72
51%
-49
- C4 -
-
4ZYT
2
A:
[2-197]
-
A
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
34
PsiBlast_CBE
84.68
51%
-43
- C4 -
-
1RBQ
1
PUR2_HUMAN
B:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
TREP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
12
PsiBlast_PDB
84.67
51%
-46
- C4 -
-
4ZZ0
2
A:
[2-197]
-
A
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
4
PsiBlast_PDB
84.61
51%
-45
- C4 -
-
4ZZ3
2
A:
[2-197]
-
A
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
27
PsiBlast_CBE
84.58
51%
-43
- C4 -
-
1RC0
1
B:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
TREP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
61
PsiBlast_CBE
84.56
47%
-50
- C4 -
-
1C2T
2
PUR3_ECOLI
B:
[1-203]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
CKTN
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
---------
35
PsiBlast_CBE
84.53
51%
-44
- C4 -
-
1RBM
2
B:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
TREP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
14
PsiBlast_PDB
84.53
51%
-43
- C4 -
-
1MEO
-
A:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
---
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
37
PsiBlast_CBE
84.48
50%
-43
- C4 -
-
1MEN
1
C:
[14-211]
---
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
TREP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
I
C
W
V
--------------
36
PsiBlast_CBE
84.43
51%
-43
- C4 -
-
1NJS
1
B:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
TREP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
9
PsiBlast_PDB
84.43
51%
-49
- C4 -
-
4ZYX
2
A:
[2-197]
-
A
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
26
PsiBlast_CBE
84.40
51%
-42
- C4 -
-
1RC1
1
PUR2_HUMAN
A:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
49
PsiBlast_CBE
84.29
47%
-56
- C4 -
-
1JKX
1
PUR3_ECOLI
B:
[1-203]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
CKTN
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
---------
32
PsiBlast_CBE
84.28
51%
-41
- C4 -
-
1RBQ
1
D:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
TREP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
31
PsiBlast_CBE
84.25
51%
-44
- C4 -
-
1RBY
2
PUR2_HUMAN
B:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
TREP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
2
PsiBlast_PDB
84.23
51%
-47
- C4 -
-
4ZZ1
2
A:
[2-197]
-
A
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
-
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
30
PsiBlast_CBE
84.22
51%
-49
- C4 -
-
1RBY
2
PUR2_HUMAN
C:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
TREP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
16
PsiBlast_PDB
84.22
51%
-44
- C4 -
-
1RBM
1
PUR2_HUMAN
A:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
39
PsiBlast_CBE
84.20
50%
-45
- C4 -
-
1MEN
1
PUR2_HUMAN
A:
[14-211]
---
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
I
C
W
V
--------------
45
PsiBlast_CBE
84.19
47%
-50
* C4 *
-
1C3E
2
PUR3_ECOLI
B:
[1-203]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
CKTN
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
---------
28
PsiBlast_CBE
84.15
51%
-44
- C4 -
-
1RBZ
2
B:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
TREP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
114
HHSearch
84.11
47%
-48
- C4 -
-
1C3E
2
PUR3_ECOLI
B:
[1-207]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
CKTN
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
P
P
Q
G
-----
19
PsiBlast_PDB
84.04
51%
-45
- C4 -
-
1RBZ
1
PUR2_HUMAN
A:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
11
PsiBlast_PDB
84.04
51%
-47
- C4 -
-
4ZYZ
2
A:
[2-197]
-
A
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
126
HHSearch
84.02
48%
-55
- C4 -
-
1JKX
1
PUR3_ECOLI
B:
[1-207]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
CKT-
N
K---
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
P
P
Q
G
-----
18
PsiBlast_PDB
84.02
51%
-43
- C4 -
-
1RBY
2
PUR2_HUMAN
A:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
8
PsiBlast_PDB
84.00
51%
-47
- C4 -
-
4ZYW
2
A:
[2-197]
-
A
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
58
PsiBlast_CBE
83.94
47%
-56
- C4 -
-
1CDE
2
PUR3_ECOLI
A:
[1-203]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
---------
25
PsiBlast_CBE
83.89
51%
-46
- C4 -
-
1RC1
2
B:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
TREP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
48
PsiBlast_CBE
83.83
47%
-57
- C4 -
-
1JKX
1
PUR3_ECOLI
C:
[1-203]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
CKTN
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
---------
3
PsiBlast_PDB
83.81
51%
-46
- C4 -
-
4ZZ2
2
A:
[2-197]
-
A
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
29
PsiBlast_CBE
83.76
51%
-48
- C4 -
-
1RBY
1
D:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
TREP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
46
PsiBlast_CBE
83.72
47%
-49
- C4 -
-
1C3E
2
PUR3_ECOLI
A:
[1-203]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
---------
62
PsiBlast_CBE
83.70
47%
-49
- C4 -
-
1C2T
2
PUR3_ECOLI
A:
[1-203]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
---------
134
HHSearch
83.55
51%
-51
- C4 -
-
1ZLY
2
A:
[1-194]
-
A
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
----
T
R
EPN
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
-
G
E
N
-------------------
56
PsiBlast_CBE
83.52
47%
-56
- C4 -
-
1CDE
2
PUR3_ECOLI
C:
[1-203]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
CKTN
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
---------
20
PsiBlast_PDB
83.48
51%
-41
- C4 -
-
1RC0
1
PUR2_HUMAN
A:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
57
PsiBlast_CBE
83.39
47%
-56
- C4 -
-
1CDE
2
PUR3_ECOLI
B:
[1-203]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
CKTN
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
---------
55
PsiBlast_CBE
83.38
47%
-56
- C4 -
-
1CDE
2
PUR3_ECOLI
D:
[1-203]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
CKTN
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
---------
47
PsiBlast_CBE
83.22
47%
-57
- C4 -
-
1JKX
1
PUR3_ECOLI
D:
[1-203]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
CKTN
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
R
Q
A
L
E
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
---------
24
PsiBlast_CBE
83.16
51%
-43
- C4 -
-
1ZLY
2
A:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
22
PsiBlast_CBE
83.13
51%
-50
- C4 -
-
4EW2
1
A:
[2-196]
--
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
T
R
EP
N
----
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
K
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
-
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
G
E
N
G
K
------------------
115
HHSearch
83.08
51%
-50
- C4 -
-
4ZZ1
2
A:
[2-196]
-
A
R
V
A
V
L
I
S
G
T
G
S
N
L
Q
A
L
I
D
S
----
T
R
EPN
S
S
A
Q
----
I
D
I
V
I
S
N
K
A
A
V
A
G
L
D
K
A
E
R
A
G
I
P
T
R
V
I
N
H
K
L
Y
K
N
R
V
E
F
D
-
S
A
I
D
L
V
L
E
E
F
S
I
D
I
V
C
L
A
G
F
M
R
I
L
S
G
P
F
V
Q
K
W
N
G
-
M
L
N
I
H
P
S
L
L
P
S
F
K
G
S
N
A
H
E
Q
A
L
E
T
G
V
T
V
T
G
C
T
V
H
F
V
A
E
D
V
D
A
G
Q
I
I
L
Q
E
A
V
P
V
K
R
G
D
T
V
A
T
L
S
E
R
V
K
L
A
E
H
K
I
F
P
A
A
L
Q
L
V
A
S
G
T
V
Q
L
-
G
E
N
G
------------------
54
PsiBlast_CBE
80.15
47%
-51
- C4 -
-
1GAR
1
PUR3_ECOLI
A:
[1-203]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
P
K
Y
P
G
L
H
T
H
-----
N
G
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
---------
53
PsiBlast_CBE
77.92
47%
-55
- C4 -
-
1GAR
1
PUR3_ECOLI
B:
[1-203]
-
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
D
A
C
K
T
N
K
----
I
K
G
T
----
V
R
A
V
F
S
N
K
A
D
A
F
G
L
E
R
A
R
Q
A
G
I
A
T
H
T
L
I
A
S
A
F
D
S
R
E
A
Y
D
-
R
E
L
I
H
E
I
D
M
Y
A
P
D
V
V
V
L
A
G
F
M
R
I
L
S
P
A
F
V
S
H
Y
A
G
R
L
L
N
I
H
P
S
L
L
----------------
D
E
E
H
G
T
S
V
H
F
V
T
D
E
L
D
G
G
P
V
I
L
Q
A
K
V
P
V
F
A
G
D
S
E
D
D
I
T
A
R
V
Q
T
Q
E
H
A
I
Y
P
L
V
I
S
W
F
A
D
G
R
L
K
M
-
H
E
N
A
-
A
W
L
D
G
Q
R
L
---------
123
HHSearch
75.80
39%
-43
- C4 -
-
3KCQ
1
?
B:
[8-205]
E
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
K
A
F
ST-------
S
V
V
----
I
S
C
V
I
S
N
N
A
E
A
R
G
L
L
I
A
Q
S
Y
G
I
P
T
F
V
V
K
R
K
P
L
-----
D
I
-
E
H
I
S
T
V
L
R
E
H
D
V
D
L
V
C
L
A
G
F
M
S
I
L
P
E
K
F
V
T
D
W
H
H
K
I
I
N
I
H
P
S
L
L
P
S
F
K
G
L
N
A
Q
E
Q
A
Y
K
A
G
V
K
I
A
G
C
T
L
H
Y
V
Y
Q
E
L
D
A
G
P
I
I
M
Q
A
A
V
P
V
L
R
E
D
T
A
E
S
L
A
S
R
I
L
A
A
E
H
V
C
Y
P
K
G
V
K
L
I
A
Q
D
K
I
K
L
-
C
D
D
G
T
V
Q
C
T
G
E
-----------
122
HHSearch
74.75
39%
-49
- C4 -
-
3KCQ
1
?
C:
[8-205]
E
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
K
A
F
STE
E
----
S
S
V
V
----
I
S
C
V
I
S
N
N
A
E
A
R
G
L
L
I
A
Q
S
Y
G
I
P
T
F
V
V
K
R
K
P
L
-----
D
I
-
E
H
I
S
T
V
L
R
E
H
D
V
D
L
V
C
L
A
G
F
M
S
I
L
P
E
K
F
V
T
D
W
H
H
K
I
I
N
I
H
P
S
L
L
P
S
F
K
G
L
N
A
Q
E
Q
A
Y
K
A
G
V
K
I
A
G
C
T
L
H
Y
V
Y
Q
E
L
D
A
G
P
I
I
M
Q
A
A
V
P
V
L
R
E
D
T
A
E
S
L
A
S
R
I
L
A
A
E
H
V
C
Y
P
K
G
V
K
L
I
A
Q
D
K
I
K
L
-
C
D
D
G
T
V
Q
C
T
G
E
-----------
65
PsiBlast_CBE
70.89
41%
-63
- C4 -
-
3KCQ
1
?
B:
[9-182]
-
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
K
A
----
F
----
S
T
--SVV-
I
S
C
V
I
S
N
N
A
E
A
R
G
L
L
I
A
Q
S
Y
G
I
P
T
F
V
V
K
------
R
K
P
L
D
I
E
H
I
S
T
V
L
R
E
H
D
V
D
L
V
C
L
A
G
F
M
S
I
L
P
E
K
F
V
T
D
W
H
H
K
I
I
N
I
H
P
S
L
L
P
S
F
K
G
L
N
A
Q
E
Q
A
Y
K
A
G
V
K
I
A
G
C
T
L
H
Y
V
Y
Q
E
L
D
A
G
P
I
I
M
Q
A
A
V
P
V
L
R
E
D
T
A
E
S
L
A
S
R
I
L
A
A
E
H
V
C
Y
P
K
-----------------------------------
64
PsiBlast_CBE
66.47
41%
-33
- C4 -
-
3KCQ
1
?
C:
[9-182]
-
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
K
A
----
F
----
S
T
E
E
SSVV
I
S
C
V
I
S
N
N
A
E
A
R
G
L
L
I
A
Q
S
Y
G
I
P
T
F
V
V
K
------
R
K
P
L
D
I
E
H
I
S
T
V
L
R
E
H
D
V
D
L
V
C
L
A
G
F
M
S
I
L
P
E
K
F
V
T
D
W
H
H
K
I
I
N
I
H
P
S
L
L
P
S
F
K
G
L
N
A
Q
E
Q
A
Y
K
A
G
V
K
I
A
G
C
T
L
H
Y
V
Y
Q
E
L
D
A
G
P
I
I
M
Q
A
A
V
P
V
L
R
E
D
T
A
E
S
L
A
S
R
I
L
A
A
E
H
V
C
Y
P
K
-----------------------------------
63
PsiBlast_CBE
66.26
41%
-38
- C4 -
-
3KCQ
1
?
D:
[9-182]
-
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
K
A
----
F
----
S
---SSVV
I
S
C
V
I
S
N
N
A
E
A
R
G
L
L
I
A
Q
S
Y
G
I
P
T
F
V
V
K
------
R
K
P
L
D
I
E
H
I
S
T
V
L
R
E
H
D
V
D
L
V
C
L
A
G
F
M
S
I
L
P
E
K
F
V
T
D
W
H
H
K
I
I
N
I
H
P
S
L
L
P
S
F
K
G
L
N
A
Q
E
Q
A
Y
K
A
G
V
K
I
A
G
C
T
L
H
Y
V
Y
Q
E
L
D
A
G
P
I
I
M
Q
A
A
V
P
V
L
R
E
D
T
A
E
S
L
A
S
R
I
L
A
A
E
H
V
C
Y
P
K
-----------------------------------
66
PsiBlast_CBE
66.18
41%
-33
- C4 -
-
3KCQ
1
?
A:
[9-182]
-
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
K
A
----
F
----
S
T
-
E
SSVV
I
S
C
V
I
S
N
N
A
E
A
R
G
L
L
I
A
Q
S
Y
G
I
P
T
F
V
V
K
------
R
K
P
L
D
I
E
H
I
S
T
V
L
R
E
H
D
V
D
L
V
C
L
A
G
F
M
S
I
L
P
E
K
F
V
T
D
W
H
H
K
I
I
N
I
H
P
S
L
L
P
S
F
K
G
L
N
A
Q
E
Q
A
Y
K
A
G
V
K
I
A
G
C
T
L
H
Y
V
Y
Q
E
L
D
A
G
P
I
I
M
Q
A
A
V
P
V
L
R
E
D
T
A
E
S
L
A
S
R
I
L
A
A
E
H
V
C
Y
P
K
-----------------------------------