@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 : Q3XZW4: (2018-01-17 )
MAMIKFDHVDKYYGKFHALKNINLEFEKGEVVVVIGPSGSGKSTMLRCINGLETISSGKLLINDTDLHDKKTKLTEVRKNIGMVFQHFNLYPNKTVLENITLAPIKVLKQDQATAVKNAEKFLKTVNMLDKKDSYPSMLSGGQQQRVAIARGLAMNPEMLLFDEPTSALDPEMIGDVLDVMKKLAHDGMSMIVVTHEMGFAKEVADRVIFMADGEVLEDSRNVRDFFENPNEVRAQQFISKVINH
Atome Classification :
(28 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...--
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
M
A
M
I
K
FD
H
V
D
K
Y
Y
--
G
-
K
--
F
H
A
L
K
N
I
N
L
E
F
EKG
E
V
V
V
V
IGPSGS
G
K
S
T
M
L
R
C
I
N
G
L
----
E
T
ISSG
K
L
L
I
ND-------------TDLH---D-K--------
K
T
K
L
T
E
V
R
K
N
-
I
G
M
V
F
Q
H
FNLYPN
K
T
V
L
ENIT
L
A
P
I
K
V
L
K--Q
D
Q
A
-
T
A
V
K
N
A
E
K
F
L
K
T
V
N
M
LDK-KDSY----
P
S
M
LSGGQ
Q
Q
R
V
A
I
ARGLAM-NP
E
M
L
L
FDEPTSAL
D
P
E
M
I
G
D
V
L
D
V
M
K
K
L
-
A
HD-G
M
S
M
I
V
V
T
HEMG
F
A
K
E
V
AD
R
V
I
F
M-ADG
E
V
LEDSR
N
V
R
D
F
FEN
P
N
E
V
R
A
Q
Q
F
I
S
K
V
INH--
9
PsiBlast_PDB
93.46
54%
-130
- C1 -
-
2OLJ
3
?
A:
[22-262]
L
Q
M
I
D
V
H
Q
L
K
K
S
F
--
G
-
S
--
L
E
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
----
E
D
F
D
E
G
E
I
I
I
D
G
-------------
I
N
L
K
---
A
-
K
--------
D
T
N
L
N
K
V
R
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
--
W
P
R
E
-
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
H
A
Y
----
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
-
D
G
G
Y
I
I
E
E
G
K
P
-
E
D
L
F
D
R
P
Q
H
E
R
T
K
A
F
L
S
K
V
-----
11
PsiBlast_PDB
93.19
54%
-128
- C1 -
-
2OUK
-
?
A:
[22-262]
L
Q
M
I
D
V
H
Q
L
K
K
S
F
--
G
-
S
--
L
E
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
----
E
D
F
D
E
G
E
I
I
I
D
G
-------------
I
N
L
K
---
A
-
K
--------
D
T
N
L
N
K
V
R
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
--
W
P
R
E
-
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
H
A
Y
----
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
-
D
G
G
Y
I
I
E
E
G
K
P
-
E
D
L
F
D
R
P
Q
H
E
R
T
K
A
F
L
S
K
V
-----
32
PsiBlast_CBE
93.17
54%
-121
- C1 -
-
2OLK
1
?
D:
[22-262]
L
Q
M
I
D
V
H
Q
L
K
K
S
F
--
G
-
S
--
L
E
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
----
E
D
F
D
E
G
E
I
I
I
D
G
-------------
I
N
L
K
---
A
-
K
--------
D
T
N
L
N
K
V
R
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
--
W
P
R
E
-
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
H
A
Y
----
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
-
D
G
G
Y
I
I
E
E
G
K
P
-
E
D
L
F
D
R
P
Q
H
E
R
T
K
A
F
L
S
K
V
-----
34
PsiBlast_CBE
92.56
54%
-119
- C1 -
-
2OLK
2
?
B:
[22-262]
L
Q
M
I
D
V
H
Q
L
K
K
S
F
--
G
-
S
--
L
E
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
----
E
D
F
D
E
G
E
I
I
I
D
G
-------------
I
N
L
K
---
A
-
K
--------
D
T
N
L
N
K
V
R
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
--
W
P
R
E
-
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
H
A
Y
----
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
-
D
G
G
Y
I
I
E
E
G
K
P
-
E
D
L
F
D
R
P
Q
H
E
R
T
K
A
F
L
S
K
V
-----
33
PsiBlast_CBE
91.60
54%
-123
- C1 -
-
2OLK
1
?
C:
[22-262]
L
Q
M
I
D
V
H
Q
L
K
K
S
F
--
G
-
S
--
L
E
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
----
E
D
F
D
E
G
E
I
I
I
D
G
-------------
I
N
L
K
---
A
-
K
--------
D
T
N
L
N
K
V
R
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
--
W
P
R
E
-
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
H
A
Y
----
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
-
D
G
G
Y
I
I
E
E
G
K
P
-
E
D
L
F
D
R
P
Q
H
E
R
T
K
A
F
L
S
K
V
-----
10
PsiBlast_PDB
90.78
54%
-122
- C1 -
-
2OLK
1
?
A:
[22-262]
L
Q
M
I
D
V
H
Q
L
K
K
S
F
--
G
-
S
--
L
E
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
----
E
D
F
D
E
G
E
I
I
I
D
G
-------------
I
N
L
K
---
A
-
K
--------
D
T
N
L
N
K
V
R
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
--
W
P
R
E
-
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
H
A
Y
----
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
-
D
G
G
Y
I
I
E
E
G
K
P
-
E
D
L
F
D
R
P
Q
H
E
R
T
K
A
F
L
S
K
V
-----
27
PsiBlast_CBE
90.15
54%
-126
- C1 -
-
3C4J
2
?
B:
[22-262]
L
Q
M
I
D
V
H
Q
L
K
K
S
F
--
G
-
S
--
L
E
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
----
E
D
F
D
E
G
E
I
I
I
D
G
-------------
I
N
L
K
---
A
-
K
--------
D
T
N
L
N
K
V
R
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
--
W
P
R
E
-
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
H
A
Y
----
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
-
D
G
G
Y
I
I
E
E
G
K
P
-
E
D
L
F
D
R
P
Q
H
E
R
T
K
A
F
L
S
K
V
-----
13
PsiBlast_PDB
89.96
54%
-120
- C1 -
-
3C4J
2
?
A:
[22-262]
L
Q
M
I
D
V
H
Q
L
K
K
S
F
--
G
-
S
--
L
E
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
----
E
D
F
D
E
G
E
I
I
I
D
G
-------------
I
N
L
K
---
A
-
K
--------
D
T
N
L
N
K
V
R
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
--
W
P
R
E
-
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
H
A
Y
----
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
-
D
G
G
Y
I
I
E
E
G
K
P
-
E
D
L
F
D
R
P
Q
H
E
R
T
K
A
F
L
S
K
V
-----
8
PsiBlast_PDB
89.26
54%
-116
- C1 -
-
3C41
2
?
J:
[1-241]
L
Q
M
I
D
V
H
Q
L
K
K
S
F
--
G
-
S
--
L
E
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
----
E
D
F
D
E
G
E
I
I
I
D
G
-------------
I
N
L
K
---
A
-
K
--------
D
T
N
L
N
K
V
R
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
--
W
P
R
E
-
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
H
A
Y
----
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
-
D
G
G
Y
I
I
E
E
G
K
P
-
E
D
L
F
D
R
P
Q
H
E
R
T
K
A
F
L
S
K
V
-----
28
PsiBlast_CBE
89.24
54%
-126
- C1 -
-
2Q0H
3
?
B:
[22-262]
L
Q
M
I
D
V
H
Q
L
K
K
S
F
--
G
-
S
--
L
E
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
----
E
D
F
D
E
G
E
I
I
I
D
G
-------------
I
N
L
K
---
A
-
K
--------
D
T
N
L
N
K
V
R
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
--
W
P
R
E
-
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
H
A
Y
----
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
-
D
G
G
Y
I
I
E
E
G
K
P
-
E
D
L
F
D
R
P
Q
H
E
R
T
K
A
F
L
S
K
V
-----
24
PsiBlast_CBE
88.80
55%
-121
- C1 -
-
4YMV
1
?
A:
[1-240]
--
M
I
F
V
N
D
V
Y
K
N
F
--
G
-
S
--
L
E
V
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
----
E
E
P
T
K
G
E
V
F
I
D
G
-------------
V
K
I
N
---
N
-
G
--------
K
V
N
I
N
K
V
R
Q
K
-
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
T
L
A
P
V
K
V
K
K
--
M
N
K
K
-
E
A
E
E
L
A
V
D
L
L
A
K
V
G
L
L
D
K
-
K
D
Q
Y
----
P
I
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
-
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
K
E
V
L
N
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
-
D
D
G
V
I
V
E
E
G
T
P
E
E
I
F
Y
R
A
K
N
E
-
R
T
R
E
F
L
S
K
I
L
----
25
PsiBlast_CBE
88.33
55%
-126
- C1 -
-
4YMU
1
?
A:
[1-240]
--
M
I
F
V
N
D
V
Y
K
N
F
--
G
-
S
--
L
E
V
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
----
E
E
P
T
K
G
E
V
F
I
D
G
-------------
V
K
I
N
---
N
-
G
--------
K
V
N
I
N
K
V
R
Q
K
-
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
T
L
A
P
V
K
V
K
K
--
M
N
K
K
-
E
A
E
E
L
A
V
D
L
L
A
K
V
G
L
L
D
K
-
K
D
Q
Y
----
P
I
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
-
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
K
E
V
L
N
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
-
D
D
G
V
I
V
E
E
G
T
P
E
E
I
F
Y
R
A
K
N
E
-
R
T
R
E
F
L
S
K
I
L
----
3
PsiBlast_PDB
88.24
55%
-124
- C1 -
-
4YMS
-
?
J:
[1-240]
--
M
I
F
V
N
D
V
Y
K
N
F
--
G
-
S
--
L
E
V
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
----
E
E
P
T
K
G
E
V
F
I
D
G
-------------
V
K
I
N
---
N
-
G
--------
K
V
N
I
N
K
V
R
Q
K
-
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
T
L
A
P
V
K
V
K
K
--
M
N
K
K
-
E
A
E
E
L
A
V
D
L
L
A
K
V
G
L
L
D
K
-
K
D
Q
Y
----
P
I
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
-
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
K
E
V
L
N
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
-
D
D
G
V
I
V
E
E
G
T
P
E
E
I
F
Y
R
A
K
N
E
-
R
T
R
E
F
L
S
K
I
L
----
35
PsiBlast_CBE
88.09
54%
-120
- C1 -
-
2OLJ
2
?
B:
[22-262]
L
Q
M
I
D
V
H
Q
L
K
K
S
F
--
G
-
S
--
L
E
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
----
E
D
F
D
E
G
E
I
I
I
D
G
-------------
I
N
L
K
---
A
-
K
--------
D
T
N
L
N
K
V
R
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
--
W
P
R
E
-
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
H
A
Y
----
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
-
D
G
G
Y
I
I
E
E
G
K
P
-
E
D
L
F
D
R
P
Q
H
E
R
T
K
A
F
L
S
K
V
-----
6
PsiBlast_PDB
88.09
55%
-123
- C1 -
-
4YMV
1
?
J:
[1-240]
--
M
I
F
V
N
D
V
Y
K
N
F
--
G
-
S
--
L
E
V
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
----
E
E
P
T
K
G
E
V
F
I
D
G
-------------
V
K
I
N
---
N
-
G
--------
K
V
N
I
N
K
V
R
Q
K
-
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
T
L
A
P
V
K
V
K
K
--
M
N
K
K
-
E
A
E
E
L
A
V
D
L
L
A
K
V
G
L
L
D
K
-
K
D
Q
Y
----
P
I
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
-
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
K
E
V
L
N
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
-
D
D
G
V
I
V
E
E
G
T
P
E
E
I
F
Y
R
A
K
N
E
-
R
T
R
E
F
L
S
K
I
L
----
7
PsiBlast_PDB
87.94
55%
-121
- C1 -
-
4YMW
-
?
J:
[1-240]
--
M
I
F
V
N
D
V
Y
K
N
F
--
G
-
S
--
L
E
V
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
----
E
E
P
T
K
G
E
V
F
I
D
G
-------------
V
K
I
N
---
N
-
G
--------
K
V
N
I
N
K
V
R
Q
K
-
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
T
L
A
P
V
K
V
K
K
--
M
N
K
K
-
E
A
E
E
L
A
V
D
L
L
A
K
V
G
L
L
D
K
-
K
D
Q
Y
----
P
I
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
-
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
K
E
V
L
N
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
-
D
D
G
V
I
V
E
E
G
T
P
E
E
I
F
Y
R
A
K
N
E
-
R
T
R
E
F
L
S
K
I
L
----
26
PsiBlast_CBE
87.77
54%
-121
- C1 -
-
3C41
2
?
K:
[1-241]
L
Q
M
I
D
V
H
Q
L
K
K
S
F
--
G
-
S
--
L
E
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
----
E
D
F
D
E
G
E
I
I
I
D
G
-------------
I
N
L
K
---
A
-
K
--------
D
T
N
L
N
K
V
R
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
--
W
P
R
E
-
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
H
A
Y
----
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
-
D
G
G
Y
I
I
E
E
G
K
P
-
E
D
L
F
D
R
P
Q
H
E
R
T
K
A
F
L
S
K
V
-----
1
PsiBlast_PDB
87.59
52%
-118
- C1 -
-
4U00
1
?
A:
[4-243]
--
I
I
R
I
R
N
L
H
K
W
F
--
G
-
P
--
L
H
V
L
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
----
E
D
F
Q
E
G
E
V
V
V
D
G
-------------
L
S
V
K
---
D
-
D
--------
R
A
-
L
R
E
I
R
R
E
-
V
G
M
V
F
Q
Q
F
N
L
F
P
H
M
T
V
L
E
N
V
T
L
A
P
M
R
V
R
R
--
W
P
R
E
-
K
A
E
K
K
A
L
E
L
L
E
R
V
G
I
L
D
Q
-
A
R
K
Y
----
P
A
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
D
V
M
R
D
L
-
A
Q
G
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
A
D
R
V
V
F
M
-
D
G
G
Q
I
V
E
E
G
R
P
-
E
E
I
F
T
R
P
K
E
E
R
T
R
S
F
L
Q
R
V
L
H
---
12
PsiBlast_PDB
87.48
54%
-121
- C1 -
-
2Q0H
3
?
A:
[23-262]
-
Q
M
I
D
V
H
Q
L
K
K
S
F
--
G
-
S
--
L
E
V
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
----
E
D
F
D
E
G
E
I
I
I
D
G
-------------
I
N
L
K
---
A
-
K
--------
D
T
N
L
N
K
V
R
E
E
-
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
I
T
L
A
P
M
K
V
R
K
--
W
P
R
E
-
K
A
E
A
K
A
M
E
L
L
D
K
V
G
L
K
D
K
-
A
H
A
Y
----
P
D
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
-
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
L
F
M
-
D
G
G
Y
I
I
E
E
G
K
P
-
E
D
L
F
D
R
P
Q
H
E
R
T
K
A
F
L
S
K
V
-----
4
PsiBlast_PDB
86.21
55%
-123
- C1 -
-
4YMT
-
?
J:
[1-240]
--
M
I
F
V
N
D
V
Y
K
N
F
--
G
-
S
--
L
E
V
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
----
E
E
P
T
K
G
E
V
F
I
D
G
-------------
V
K
I
N
---
N
-
G
--------
K
V
N
I
N
K
V
R
Q
K
-
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
T
L
A
P
V
K
V
K
K
--
M
N
K
K
-
E
A
E
E
L
A
V
D
L
L
A
K
V
G
L
L
D
K
-
K
D
Q
Y
----
P
I
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
-
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
K
E
V
L
N
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
-
D
D
G
V
I
V
E
E
G
T
P
E
E
I
F
Y
R
A
K
N
E
-
R
T
R
E
F
L
S
K
I
L
----
5
PsiBlast_PDB
86.01
55%
-122
- C1 -
-
4YMU
1
?
J:
[1-240]
--
M
I
F
V
N
D
V
Y
K
N
F
--
G
-
S
--
L
E
V
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
----
E
E
P
T
K
G
E
V
F
I
D
G
-------------
V
K
I
N
---
N
-
G
--------
K
V
N
I
N
K
V
R
Q
K
-
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
I
T
L
A
P
V
K
V
K
K
--
M
N
K
K
-
E
A
E
E
L
A
V
D
L
L
A
K
V
G
L
L
D
K
-
K
D
Q
Y
----
P
I
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
-
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
K
E
V
L
N
V
M
K
Q
L
-
A
N
E
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
G
D
R
V
I
F
M
-
D
D
G
V
I
V
E
E
G
T
P
E
E
I
F
Y
R
A
K
N
E
-
R
T
R
E
F
L
S
K
I
L
----
14
PsiBlast_PDB
73.24
47%
-2
- C1 -
-
1B0U
1
HISP_SALTY
A:
[12-253]
--------
L
H
K
R
Y
--
G
-
G
--
H
E
V
L
K
G
V
S
L
Q
A
R
A
G
D
V
I
S
I
I
G
S
S
G
S
G
K
S
T
F
L
R
C
I
N
F
L
----
E
K
P
S
E
G
A
I
I
V
N
G
-------------
Q
N
I
N
L
V
R
D
-
K
DGQLKVAD
K
N
Q
L
R
L
L
R
T
R
-
L
T
M
V
F
Q
H
F
N
L
W
S
H
M
T
V
L
E
N
V
M
E
A
P
I
Q
V
L
G
--
L
S
K
H
-
D
A
R
E
R
A
L
K
Y
L
A
K
V
G
I
D
E
R
A
Q
G
K
Y
----
P
V
H
L
S
G
G
Q
Q
Q
R
V
S
I
A
R
A
L
A
M
-
E
P
D
V
L
L
F
D
E
P
T
S
A
L
D
P
E
L
V
G
E
V
L
R
I
M
Q
Q
L
-
A
E
E
-
G
K
T
M
V
V
V
T
H
E
M
G
F
A
R
H
V
S
S
H
V
I
F
L
-
H
Q
G
K
I
-
E
E
E
G
D
P
E
Q
V
F
G
N
P
Q
S
P
R
L
Q
Q
F
L
--------
129
Fugue
63.20
46%
36
- C1 -
-
1B0U
1
HISP_SALTY
A:
[5-261]
-
N
K
L
H
V
I
D
L
H
K
R
Y
--
G
G---
H
E
V
L
K
G
V
S
L
Q
A
R
A
G
D
V
I
S
I
I
G
S
S
G
S
G
K
S
T
F
L
R
C
I
N
F
L
EKPS----
E
G
A
I
I
V
N
G
QNI
N
L
V
R
D
KDGQL
K
V
A
D
---
K
-
N
--------
Q
L
R
L
L
R
T
-
R
--
L
T
M
V
F
Q
H
F
N
L
W
S
H
M
T
V
L
E
N
V
M
E
A
P
I
Q
V
L
-G-
L
S
K
H
-
D
A
R
E
R
A
L
K
Y
L
A
K
V
G
I
D
E
R
-
A
Q
G
-KY--
P
V
H
L
S
G
G
Q
Q
Q
R
V
S
I
A
R
A
L
A
M
E-
P
D
V
L
L
F
D
E
P
T
S
A
L
D
P
E
L
V
G
E
V
L
R
I
M
Q
Q
L
-
A
E
E
-
G
K
T
M
V
V
V
T
H
E
M
G
F
A
R
H
V
S
S
H
V
I
F
L
H
-
Q
G
K
I
E
E
E
G
D
P
E
Q
V
F
G
N
P
-
Q
S
P
R
L
Q
Q
F
L
K
G
S
L
K
K
LE
43
PsiBlast_CBE
58.30
40%
38
- C1 -
-
1L2T
3
Y796_METJA
B:
[1-232]
--
M
I
K
L
K
N
V
T
K
T
Y
KM
G
-
E
EI
I
Y
A
L
K
N
V
N
L
N
I
K
E
G
E
F
V
S
I
M
G
P
S
G
S
G
K
S
T
M
L
N
I
I
G
C
L
----
D
K
P
T
E
G
E
V
Y
I
D
N
-------------
I
K
T
N
---
D
L
D
--------
D
D
E
L
T
K
I
R
R
D
K
I
G
F
V
F
Q
Q
F
N
L
I
P
L
L
T
A
L
E
N
V
E
L
-
P
L
I
F
K
Y
--
R
G
A
M
-
S
G
E
E
R
R
K
R
A
L
E
C
L
K
M
A
E
L
-
E
E
R
F
ANHK
P
N
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
N
-
N
P
P
I
I
L
A
D
Q
P
T
G
A
L
D
S
K
T
G
E
K
I
M
Q
L
L
K
K
L
N
E
E
D
-
G
K
T
V
V
V
V
T
H
D
I
N
V
A
R
-
F
G
E
R
I
I
Y
L
-
K
D
G
E
V
-
E
R
E
E
K
L
R
G
F
---------------------
46
PsiBlast_CBE
57.66
36%
-47
- C1 -
-
1VCI
1
?
A:
[10-250]
M
V
E
V
K
L
E
N
L
T
K
R
F
--
G
-
N
--
F
T
A
V
N
K
L
N
L
T
I
K
D
G
E
F
L
V
L
L
G
P
S
G
C
G
K
T
T
T
L
R
M
I
A
G
L
----
E
E
P
T
E
G
R
I
Y
F
G
D
-------------
R
D
V
----------------
T
Y
L
P
P
K
D
R
N
-
I
S
M
V
F
Q
------
H
M
T
V
Y
E
N
I
A
F
-
P
L
--
K
K
FP
K
D
E
I
D
K
R
V
R
W
A
A
E
L
L
Q
I
E
E
L
L
N
R
----
Y
----
P
A
Q
L
S
G
G
Q
R
Q
R
V
A
V
A
R
A
I
V
V
-
E
P
D
V
L
L
M
D
E
P
L
S
N
L
D
A
K
L
R
V
A
M
R
A
E
I
K
K
L
-
Q
Q
K
L
K
V
T
T
I
Y
V
T
H
D
Q
V
E
A
M
T
M
G
D
R
I
A
V
M
-
N
R
G
Q
L
L
Q
I
G
S
P
T
-
E
V
Y
L
R
P
N
S
V
F
V
A
T
F
I
G
-------
44
PsiBlast_CBE
56.97
40%
38
- C1 -
-
3TIF
4
Y796_METJA
B:
[1-232]
--
M
V
K
L
K
N
V
T
K
T
Y
KM
G
-
E
EI
I
Y
A
L
K
N
V
N
L
N
I
K
E
G
E
F
V
S
I
M
G
P
S
G
S
G
K
S
T
M
L
N
I
I
G
C
L
----
D
K
P
T
E
G
E
V
Y
I
D
N
-------------
I
K
T
N
---
D
L
D
--------
D
D
E
L
T
K
I
R
R
D
K
I
G
F
V
F
Q
Q
F
N
L
I
P
L
L
T
A
L
E
N
V
E
L
-
P
L
I
F
K
Y
--
R
G
A
M
-
S
G
E
E
R
R
K
R
A
L
E
C
L
K
M
A
E
L
-
E
E
R
F
ANHK
P
N
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
N
-
N
P
P
I
I
L
A
D
Q
P
T
W
A
L
D
S
K
T
G
E
K
I
M
Q
L
L
K
K
L
N
E
E
D
-
G
K
T
V
V
V
V
T
H
D
I
N
V
A
R
-
F
G
E
R
I
I
Y
L
-
K
D
G
E
V
-
E
R
E
E
K
L
R
G
F
---------------------
20
PsiBlast_PDB
56.36
40%
38
- C1 -
-
1L2T
3
Y796_METJA
A:
[1-230]
--
M
I
K
L
K
N
V
T
K
T
Y
K
M
G
-
E
E
I
I
Y
A
L
K
N
V
N
L
N
I
K
E
G
E
F
V
S
I
M
G
P
S
G
S
G
K
S
T
M
L
N
I
I
G
C
L
----
D
K
P
T
E
G
E
V
Y
I
D
N
-------------
I
K
T
N
---
D
L
D
--------
D
D
E
L
T
K
I
R
R
D
K
I
G
F
V
F
Q
Q
F
N
L
I
P
L
L
T
A
L
E
N
V
E
L
-
P
L
I
F
K
Y
--
R
G
A
M
-
S
G
E
E
R
R
K
R
A
L
E
C
L
K
M
A
E
L
-
E
E
R
F
ANHK
P
N
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
N
-
N
P
P
I
I
L
A
D
Q
P
T
G
A
L
D
S
K
T
G
E
K
I
M
Q
L
L
K
K
L
N
E
E
D
-
G
K
T
V
V
V
V
T
H
D
I
N
V
A
R
-
F
G
E
R
I
I
Y
L
-
K
D
G
E
V
-
E
R
E
E
K
L
R
-----------------------
45
PsiBlast_CBE
56.14
40%
38
- C1 -
-
3TIF
4
Y796_METJA
A:
[1-230]
--
M
V
K
L
K
N
V
T
K
T
Y
K
M
G
-
E
E
I
I
Y
A
L
K
N
V
N
L
N
I
K
E
G
E
F
V
S
I
M
G
P
S
G
S
G
K
S
T
M
L
N
I
I
G
C
L
----
D
K
P
T
E
G
E
V
Y
I
D
N
-------------
I
K
T
N
---
D
L
D
--------
D
D
E
L
T
K
I
R
R
D
K
I
G
F
V
F
Q
Q
F
N
L
I
P
L
L
T
A
L
E
N
V
E
L
-
P
L
I
F
K
Y
--
R
G
A
M
-
S
G
E
E
R
R
K
R
A
L
E
C
L
K
M
A
E
L
-
E
E
R
F
ANHK
P
N
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
N
-
N
P
P
I
I
L
A
D
Q
P
T
W
A
L
D
S
K
T
G
E
K
I
M
Q
L
L
K
K
L
N
E
E
D
-
G
K
T
V
V
V
V
T
H
D
I
N
V
A
R
-
F
G
E
R
I
I
Y
L
-
K
D
G
E
V
-
E
R
E
E
K
L
R
-----------------------