@TOME V2.3
(Nov 2016)
Ref.
-
-
Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
Core Structure Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
Core Structure Cluster
Contacts with Ligands
Show alignment :
Atome selection
All alignments
Only Template with Ligand
Column output:
Score:
Atome Rank Value
Tools Score
Hide column
Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
Hide column
Structural Clustering:
Cluster Num
3D-Jury Struct. Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
Hide column
Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
Hide column
Sequence & Result Tab:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : Lmo1766: (2016-03-28 )
MNIAIFASGSGSNFQALVDDEFIKPYVKLLVCDKPNAYVLERANKHDIPVFLFEAKNYPDKEAFETEILLELRRLEIDLLVLAGYMRLIGPTLLAEFPEQIVNLHPSLLPEFKGKDAIGQAIQANVSGTGVTAHFVDAGMDTGPIIDQVKVTIETAETTDTLAEKIHQVEHIFYPKVIRGLIQNGGND
Atome Classification :
(51 SA)
.........10.......---.---20.---..---.-....30.---.......40........50........60........70........80........90........100.......110.......120.......130.......140.......150.......160.......170.......----180......
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
M
N
I
A
I
F
ASGSGS
N
F
Q
ALV---
D
---
D
E
F
---
I
K
---
P
-
Y
V
K
L
L
VC---DKPN
A
Y
V
LERANKHDI
P
V
F
L
F
EAKNYP
D
K
E
A
F
E
T
E
I
L
L
E
L
R
R
L
E
I
D
L
L
V
L
A
G
Y
M
R
LI
G
P
T
L
L
A
E
F
P
E
Q
I
V
N
L
H
P
S
L
L
P
EFKG
K
D
A
I
G
Q
A
I
QANVSGTG
V
T
A
H
F
VDAGMDTGPI
I
D
Q
V
K
V
T
I
ETAE
T
T
D
T
L
A
E
K
I
H
Q
V
E
H
I
F
Y
P
K
V
I
R
----
G
L
I
QNGGND
88
HHSearch
94.81
52%
-146
- C4 -
3P9X
6
?
A:
[3-191]
K
R
V
A
I
F
A
S
G
S
G
T
N
A
E
A
I
I
---
Q
---
S
Q
K
---
A
G
QLP
C
-
E
V
A
L
L
I
T
---
D
K
P
G
A
K
V
V
E
R
V
K
V
H
E
I
P
V
C
A
L
D
P
K
T
Y
P
S
K
E
A
Y
E
I
E
V
V
Q
Q
L
K
E
K
Q
I
D
F
V
V
L
A
G
Y
M
R
L
V
G
P
T
L
L
G
A
Y
E
G
R
I
V
N
I
H
P
S
L
L
P
A
F
P
G
L
H
A
I
E
Q
A
I
R
A
N
V
K
V
T
G
V
T
I
H
Y
V
D
E
G
M
D
T
G
P
I
I
A
Q
E
A
V
S
I
E
E
E
D
T
L
E
T
L
T
T
K
I
Q
A
V
E
H
R
L
Y
P
A
T
L
H
----
K
L
L
S
K
A
E
--
2
PsiBlast_PDB
94.79
51%
-148
- C4 -
3P9X
6
?
A:
[4-192]
-
R
V
A
I
F
A
S
G
S
G
T
N
A
E
A
I
I
---
Q
---
S
Q
K
A
GQ
L
P
---
C
-
E
V
A
L
L
I
T
---
D
K
P
G
A
K
V
V
E
R
V
K
V
H
E
I
P
V
C
A
L
D
P
K
T
Y
P
S
K
E
A
Y
E
I
E
V
V
Q
Q
L
K
E
K
Q
I
D
F
V
V
L
A
G
Y
M
R
L
V
G
P
T
L
L
G
A
Y
E
G
R
I
V
N
I
H
P
S
L
L
P
A
F
P
G
L
H
A
I
E
Q
A
I
R
A
N
V
K
V
T
G
V
T
I
H
Y
V
D
E
G
M
D
T
G
P
I
I
A
Q
E
A
V
S
I
E
E
E
D
T
L
E
T
L
T
T
K
I
Q
A
V
E
H
R
L
Y
P
A
T
L
H
----
K
L
L
S
K
A
E
N
-
21
PsiBlast_CBE
94.19
51%
-150
- C4 -
3P9X
5
?
B:
[4-192]
-
R
V
A
I
F
A
S
G
S
G
T
N
A
E
A
I
I
---
Q
---
S
Q
K
AGQ
L
P
---
C
-
E
V
A
L
L
I
T
---
D
K
P
G
A
K
V
V
E
R
V
K
V
H
E
I
P
V
C
A
L
D
P
K
T
Y
P
S
K
E
A
Y
E
I
E
V
V
Q
Q
L
K
E
K
Q
I
D
F
V
V
L
A
G
Y
M
R
L
V
G
P
T
L
L
G
A
Y
E
G
R
I
V
N
I
H
P
S
L
L
P
A
F
P
G
L
H
A
I
E
Q
A
I
R
A
N
V
K
V
T
G
V
T
I
H
Y
V
D
E
G
M
D
T
G
P
I
I
A
Q
E
A
V
S
I
E
E
E
D
T
L
E
T
L
T
T
K
I
Q
A
V
E
H
R
L
Y
P
A
T
L
H
----
K
L
L
S
K
A
E
N
-
89
HHSearch
88.61
58%
-110
- C4 -
3AV3
-
?
A:
[2-187]
K
R
L
A
V
F
A
S
G
S
G
T
N
F
Q
A
I
V
---
D
---
A
A
K
---
R
G
DLP
A
-
R
V
A
L
L
V
C
---
D
R
P
G
A
K
V
I
E
R
A
A
R
E
N
V
P
A
F
V
F
S
P
K
D
Y
P
S
K
A
A
F
E
S
E
I
L
R
E
L
K
G
R
Q
I
D
W
I
A
L
A
G
Y
M
R
L
I
G
P
T
L
L
S
A
Y
E
G
K
I
V
N
I
H
P
S
L
L
P
A
F
P
G
K
D
A
I
G
Q
A
Y
R
A
G
V
S
E
T
G
V
T
V
H
Y
V
D
E
G
-
D
T
G
P
V
I
A
Q
R
V
V
P
I
V
P
G
E
P
I
E
A
L
E
E
R
I
H
Q
V
E
H
E
L
Y
P
T
V
L
R
----
M
L
L
G
-----
1
PsiBlast_PDB
87.97
57%
-114
- C4 -
3AV3
-
?
A:
[3-186]
-
R
L
A
V
F
A
S
G
S
G
T
N
F
Q
A
I
V
---
D
---
A
A
K
R
GD
L
P
---
A
-
R
V
A
L
L
V
C
---
D
R
P
G
A
K
V
I
E
R
A
A
R
E
N
V
P
A
F
V
F
S
P
K
D
Y
P
S
K
A
A
F
E
S
E
I
L
R
E
L
K
G
R
Q
I
D
W
I
A
L
A
G
Y
M
R
L
I
G
P
T
L
L
S
A
Y
E
G
K
I
V
N
I
H
P
S
L
L
P
A
F
P
G
K
D
A
I
G
Q
A
Y
R
A
G
V
S
E
T
G
V
T
V
H
Y
V
D
E
G
-
D
T
G
P
V
I
A
Q
R
V
V
P
I
V
P
G
E
P
I
E
A
L
E
E
R
I
H
Q
V
E
H
E
L
Y
P
T
V
L
R
----
M
L
L
------
59
PsiBlast_CBE
86.13
33%
-139
- C4 -
3KCQ
1
?
B:
[9-190]
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
K
A
F
S
---
T
------
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
----
60
PsiBlast_CBE
86.09
33%
-145
- C4 -
3KCQ
1
?
A:
[9-190]
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
K
A
F
S
---
T
-
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
----
93
HHSearch
85.98
33%
-144
- C4 -
3KCQ
1
?
A:
[9-192]
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
---
K
---
A
F
S
---
T
-ESS
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
--
90
HHSearch
85.90
39%
-144
- C4 -
3AUF
-
?
A:
[2-189]
I
R
I
G
V
L
I
S
G
S
G
T
N
L
Q
A
I
L
---
D
---
G
C
R
---
E
G
RI-
P
G
R
V
A
V
V
I
S
---
D
R
A
D
A
Y
G
L
E
R
A
R
R
A
G
V
D
A
L
H
M
D
P
A
A
Y
P
S
R
T
A
F
D
A
A
L
A
E
R
L
Q
A
Y
G
V
D
L
V
C
L
A
G
Y
M
R
L
V
R
G
P
M
L
T
A
F
P
N
R
I
L
N
I
H
P
S
L
L
P
A
F
P
G
L
E
A
Q
R
Q
A
L
E
H
G
V
K
V
A
G
C
T
V
H
F
V
T
A
G
V
D
E
G
P
I
I
L
Q
A
A
V
P
V
L
E
G
D
T
V
E
D
L
R
R
R
I
L
A
E
E
H
R
I
Y
P
E
A
I
R
----
L
F
A
E
G
R
---
4
PsiBlast_PDB
85.64
35%
-147
- C4 -
2YWR
5
?
A:
[2-188]
L
K
I
G
V
L
V
S
G
R
G
S
N
L
Q
A
I
I
---
D
A
I
E
S
G
K
---
V
N
---
A
-
S
I
E
L
V
I
S
---
D
N
P
K
A
Y
A
I
E
R
C
K
K
H
N
V
E
C
K
V
I
Q
R
K
E
F
P
S
K
K
E
F
E
E
R
M
A
L
E
L
K
K
K
G
V
E
L
V
V
L
A
G
F
M
R
I
L
S
H
N
F
L
K
Y
F
P
N
K
V
I
N
I
H
P
S
L
I
P
A
F
Q
G
L
H
A
Q
K
Q
A
V
E
F
G
V
K
F
S
G
C
T
V
H
I
V
D
E
S
V
D
A
G
P
V
I
V
Q
A
V
V
P
V
L
P
E
D
D
E
N
T
L
A
D
R
I
L
K
W
E
H
K
I
L
P
Q
T
V
Q
----
W
F
A
Q
D
----
5
PsiBlast_PDB
85.53
39%
-150
- C4 -
3AUF
-
?
A:
[2-183]
I
R
I
G
V
L
I
S
G
S
G
T
N
L
Q
A
I
L
---
D
G
C
R
E
G
R
---
I
P
---
G
-
R
V
A
V
V
I
S
---
D
R
A
D
A
Y
G
L
E
R
A
R
R
A
G
V
D
A
L
H
M
D
P
A
A
Y
P
S
R
T
A
F
D
A
A
L
A
E
R
L
Q
A
Y
G
V
D
L
V
C
L
A
G
Y
M
R
L
V
R
G
P
M
L
T
A
F
P
N
R
I
L
N
I
H
P
S
L
L
P
A
F
P
G
L
E
A
Q
R
Q
A
L
E
H
G
V
K
V
A
G
C
T
V
H
F
V
T
A
G
V
D
E
G
P
I
I
L
Q
A
A
V
P
V
L
E
G
D
T
V
E
D
L
R
R
R
I
L
A
E
E
H
R
I
Y
P
E
A
I
R
-------------
58
PsiBlast_CBE
85.45
33%
-143
- C4 -
3KCQ
1
?
C:
[9-190]
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
---
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
----
54
PsiBlast_CBE
85.04
33%
-144
- C4 -
3GAR
1
PUR3_ECOLI
A:
[1-181]
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
A
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
--------------
3
PsiBlast_PDB
84.95
42%
-140
- C4 -
4S1N
3
?
A:
[6-183]
-
K
I
A
V
F
A
S
G
N
G
S
N
F
Q
-
V
I
---
A
---
E
E
F
---
P
-------
V
E
F
V
F
S
---
D
H
R
D
A
Y
V
L
E
R
A
K
Q
L
G
V
L
S
Y
A
F
E
L
K
E
F
E
S
K
A
D
Y
E
A
A
L
V
E
L
L
E
E
H
Q
I
D
L
V
C
L
A
G
Y
M
K
I
V
G
P
T
L
L
S
A
Y
E
G
R
I
V
N
I
H
P
A
Y
L
P
E
F
P
G
A
H
G
I
E
D
A
W
N
A
G
V
G
Q
S
G
V
T
I
H
W
V
D
S
G
V
D
T
G
Q
V
I
K
Q
V
R
V
P
R
L
A
D
D
T
I
D
R
F
E
A
R
I
H
E
A
E
Y
R
L
Y
P
E
V
V
K
----
A
L
F
T
-----
12
PsiBlast_PDB
84.76
34%
-147
- C4 -
1CDE
2
PUR3_ECOLI
A:
[1-181]
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
--------------
40
PsiBlast_CBE
84.74
34%
-151
- C4 -
1JKX
1
PUR3_ECOLI
B:
[1-181]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
---
D
ACK
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
--------------
94
HHSearch
84.60
36%
-140
- C4 -
2YWR
5
?
A:
[2-190]
L
K
I
G
V
L
V
S
G
R
G
S
N
L
Q
A
I
I
---
D
---
A
I
E
---
S
G
KV-
N
A
S
I
E
L
V
I
S
---
D
N
P
K
A
Y
A
I
E
R
C
K
K
H
N
V
E
C
K
V
I
Q
R
K
E
F
P
S
K
K
E
F
E
E
R
M
A
L
E
L
K
K
K
G
V
E
L
V
V
L
A
G
F
M
R
I
L
S
H
N
F
L
K
Y
F
P
N
K
V
I
N
I
H
P
S
L
I
P
A
F
Q
G
L
H
A
Q
K
Q
A
V
E
F
G
V
K
F
S
G
C
T
V
H
I
V
D
E
S
V
D
A
G
P
V
I
V
Q
A
V
V
P
V
L
P
E
D
D
E
N
T
L
A
D
R
I
L
K
W
E
H
K
I
L
P
Q
T
V
Q
----
W
F
A
Q
D
R
I
--
11
PsiBlast_PDB
84.46
34%
-150
- C4 -
1JKX
1
PUR3_ECOLI
A:
[1-181]
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
--------------
6
PsiBlast_PDB
84.42
34%
-148
- C4 -
1C3E
2
PUR3_ECOLI
A:
[1-181]
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
--------------
10
PsiBlast_PDB
84.41
34%
-148
- C4 -
1C2T
2
PUR3_ECOLI
A:
[1-181]
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
--------------
43
PsiBlast_CBE
84.24
34%
-147
- C4 -
1CDE
2
PUR3_ECOLI
D:
[1-181]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
---
D
ACK
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
--------------
57
PsiBlast_CBE
84.20
33%
-144
* C4 *
3KCQ
1
?
D:
[9-190]
L
R
V
G
V
L
I
S
G
R
G
S
N
L
E
A
L
A
KAF
S
---------
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
----
45
PsiBlast_CBE
84.19
34%
-147
- C4 -
1CDE
2
PUR3_ECOLI
B:
[1-181]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
---
D
ACK
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
--------------
44
PsiBlast_CBE
84.13
34%
-147
- C4 -
1CDE
2
PUR3_ECOLI
C:
[1-181]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
---
D
ACK
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
--------------
22
PsiBlast_CBE
84.06
34%
-149
- C4 -
1C3E
2
PUR3_ECOLI
B:
[1-181]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
---
D
ACK
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
--------------
47
PsiBlast_CBE
84.03
34%
-149
- C4 -
1C2T
2
PUR3_ECOLI
B:
[1-181]
M
N
I
V
V
L
I
S
G
N
G
S
N
L
Q
A
I
I
---
D
ACK
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
--------------
48
PsiBlast_CBE
82.92
33%
-135
- C4 -
1MEN
1
C:
[14-205]
--
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
LVAS
G
T
V
Q
L
G
E
N
-
51
PsiBlast_CBE
82.68
33%
-142
- C4 -
1MEJ
1
C:
[14-205]
--
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
LVAS
G
T
V
Q
L
G
E
N
-
35
PsiBlast_CBE
82.31
33%
-131
- C4 -
1RBQ
3
PUR2_HUMAN
B:
[3-194]
--
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
LVAS
G
T
V
Q
L
G
E
N
-
49
PsiBlast_CBE
82.19
33%
-138
- C4 -
1MEN
1
PUR2_HUMAN
B:
[14-205]
--
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
LVAS
G
T
V
Q
L
G
E
N
-
34
PsiBlast_CBE
82.16
33%
-134
- C4 -
1RBQ
3
PUR2_HUMAN
C:
[3-194]
--
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
LVAS
G
T
V
Q
L
G
E
N
-
37
PsiBlast_CBE
82.08
33%
-136
- C4 -
1NJS
2
B:
[3-194]
--
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
LVAS
G
T
V
Q
L
G
E
N
-
31
PsiBlast_CBE
81.97
33%
-134
- C4 -
1RBY
2
PUR2_HUMAN
C:
[3-194]
--
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
LVAS
G
T
V
Q
L
G
E
N
-
30
PsiBlast_CBE
81.86
33%
-133
- C4 -
1RBY
1
D:
[3-194]
--
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
LVAS
G
T
V
Q
L
G
E
N
-
50
PsiBlast_CBE
81.85
33%
-132
- C4 -
1MEN
1
PUR2_HUMAN
A:
[14-205]
--
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
-
20
PsiBlast_PDB
81.72
33%
-133
- C4 -
1RC1
2
PUR2_HUMAN
A:
[3-194]
--
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
-
32
PsiBlast_CBE
81.71
33%
-133
- C4 -
1RBY
2
PUR2_HUMAN
B:
[3-194]
--
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
LVAS
G
T
V
Q
L
G
E
N
-
17
PsiBlast_PDB
81.71
33%
-132
- C4 -
1RBY
2
PUR2_HUMAN
A:
[3-194]
--
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
-
14
PsiBlast_PDB
81.70
33%
-130
- C4 -
1NJS
3
PUR2_HUMAN
A:
[3-194]
--
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
-
28
PsiBlast_CBE
81.60
33%
-130
- C4 -
1RC0
1
B:
[3-194]
--
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
LVAS
G
T
V
Q
L
G
E
N
-
36
PsiBlast_CBE
81.57
33%
-132
- C4 -
1RBM
4
B:
[3-194]
--
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
LVAS
G
T
V
Q
L
G
E
N
-
27
PsiBlast_CBE
81.57
33%
-135
- C4 -
1RC1
3
B:
[3-194]
--
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
LVAS
G
T
V
Q
L
G
E
N
-
16
PsiBlast_PDB
81.55
33%
-130
- C4 -
1RBQ
3
PUR2_HUMAN
A:
[3-194]
--
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
-
26
PsiBlast_CBE
81.36
33%
-131
- C4 -
1ZLY
2
A:
[3-194]
--
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
-
19
PsiBlast_PDB
81.25
33%
-130
- C4 -
1RC0
1
PUR2_HUMAN
A:
[3-194]
--
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
-
15
PsiBlast_PDB
81.21
33%
-127
- C4 -
1RBM
3
PUR2_HUMAN
A:
[3-194]
--
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
81.19
37%
-127
- C4 -
4DS3
5
?
A:
[9-199]
-
R
V
V
I
F
I
S
G
G
G
S
N
M
E
A
L
I
---
R
---
A
A
Q
---
A
P
---
G
-
F
P
A
E
I
V
A
V
F
S
D
K
A
E
A
G
G
L
A
K
A
E
A
A
G
I
A
T
Q
V
F
K
R
K
D
F
A
S
K
E
A
H
E
D
A
I
L
A
A
L
D
V
L
K
P
D
I
I
C
L
A
G
Y
M
R
L
L
S
G
R
F
I
A
P
Y
E
G
R
I
L
N
I
H
P
S
L
L
P
L
F
P
G
L
H
T
H
Q
R
A
L
D
A
G
M
K
L
A
G
C
T
V
H
L
V
T
E
--
D
E
G
P
I
L
A
Q
A
A
V
P
V
L
D
G
D
T
A
E
T
L
A
A
R
V
L
K
A
E
H
R
L
Y
P
L
A
L
Q
-------------
33
PsiBlast_CBE
80.92
33%
-129
- C4 -
1RBQ
2
D:
[3-194]
--
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
LVAS
G
T
V
Q
L
G
E
N
-
29
PsiBlast_CBE
80.92
33%
-133
- C4 -
1RBZ
2
B:
[3-194]
--
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
LVAS
G
T
V
Q
L
G
E
N
-
61
PsiBlast_CBE
75.80
34%
-113
- C4 -
3DCJ
3
PUR3_MYCTU
B:
[14-184]
-
R
L
V
V
L
A
S
G
T
G
S
L
L
R
S
L
L
---
D
---
A
A
V
---
G
D
Y--
P
-
A
R
V
V
A
V
G
---
V
D
R
E
C
R
A
A
E
I
A
A
E
A
S
V
P
V
F
T
V
R
L
A
D
H
P
S
R
D
A
W
D
V
A
I
T
A
A
T
A
A
H
E
P
D
L
V
V
S
A
G
F
M
R
I
L
G
P
Q
F
L
S
R
F
Y
G
R
T
L
N
T
H
P
A
L
L
P
A
F
P
G
T
H
G
V
A
D
A
L
A
Y
G
V
K
V
T
G
A
T
V
H
L
V
D
A
G
T
D
T
G
P
I
L
A
Q
Q
P
V
P
V
L
D
G
D
D
E
E
T
L
H
E
R
I
K
V
T
E
R
---------------------
62
PsiBlast_CBE
75.01
34%
-120
- C4 -
3DCJ
4
PUR3_MYCTU
A:
[14-184]
-
R
L
V
V
L
A
S
G
T
G
S
L
L
R
S
L
L
---
D
---
A
A
V
---
G
D
Y--
P
-
A
R
V
V
A
V
G
---
V
D
R
E
C
R
A
A
E
I
A
A
E
A
S
V
P
V
F
T
V
R
L
A
D
H
P
S
R
D
A
W
D
V
A
I
T
A
A
T
A
A
H
E
P
D
L
V
V
S
A
G
F
M
R
I
L
G
P
Q
F
L
S
R
F
Y
G
R
T
L
N
T
H
P
A
L
L
P
A
F
P
G
T
H
G
V
A
D
A
L
A
Y
G
V
K
V
T
G
A
T
V
H
L
V
D
A
G
T
D
T
G
P
I
L
A
Q
Q
P
V
P
V
L
D
G
D
D
E
E
T
L
H
E
R
I
K
V
T
E
R
---------------------