@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 : bsu12970: (2016-06-20 )
MKGVFSLNYKPKALNKGDTVGVIAPASPPDPKKLDTALLFLEELGLQVKLGKALKNQHGYLAGQDDERLADLHEMFRDDEVKAVLCACGGFGTGRIAAGIDFSLIRKHPKIFWGYSDITFLHTAIHQNTGLVTFHGPMLSTDIGLDDVHPLTKASYKQLFQETEFTYTEELSPLTELVPGKAEGELVGGNLSLLTSTLGTPFEIDTRGKLLFIEDIDEEPYQIDRMLNQLKMGGKLTDAAGILVCDFHNCVPVKREKSLSLEQVLEDYIISAGRPALRGFKIGHCSPSIAVPIGAKAAMNTAEKTAVIEAGVSEGALKT
Atome Classification :
(20 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......-.300..-.....310.......
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MK
G
V
F
SLNYKPKALNKGD
T
V
G
V
I---APA---SP---P
D
P
---
K
K
L
D
T
A
L
L
F
L
E
ELG
L
Q
V
K
L
G
K
A
L
KNQHGYLAGQD
D
E
R
L
A
D
L
H
E
M
FRDD
E
V
K
A
V
L
C
ACGGFGTGRIAAGI
D
F
S
L
I
R-KHP
K
I
F
WGYS
D
I
T
F
L
H
T
A
IHQNT
G
L
V
T
FHGPMLST---DIGLD----------------D--VHP------
L
T
K
A
S
Y
----
K
Q
------------------
L
F
------
Q
---ET---E---
F
-------
T
---------
Y
--------
T
------
E
---E----L
S
P
-------------------
L
T
E
---LV---P-------------GKAEG
E
L
VGG
N
L
S
L
L
T
S
TLGT
P
F
-
E
-IDT-R-G
K
L
L
F
I
E-DID----E----E
P
Y
Q
I
D
R
M
L
N
Q
L
KMGGKLTDA
A
G
I
L
V
C
---DFHNCVPVKREKSL
S
L
E
Q
V
L
E
D
Y
I
ISAGRPAL
R
G
F
KIGHCSPSIAVPIG
A
K
A
A-MNTA
E
K
-
T
A
V
I
EAGVSEGALKT
19
PsiBlast_PDB
76.92
28%
-117
- C3 -
3TLB
1
MCCF_ECOLX
A:
[43-362]
----------------
G
D
T
I
G
F
F
S
SS
A
P
A
---
T
V
---
T
A
K
---
N
R
F
F
R
G
V
E
F
L
Q
R
K
G
F
K
L
V
S
G
K
L
T
G
K
T
D
F
Y
R
S
G
T
I
K
E
R
A
Q
E
F
N
E
L
V
Y
N
P
D
I
T
C
I
M
S
T
I
G
G
D
N
S
N
S
L
L
P
F
L
D
Y
D
A
I
I
-
A
N
P
K
I
I
I
G
Y
S
D
T
T
A
L
L
A
G
I
Y
A
K
T
G
L
I
T
F
Y
G
P
A
L
I
P
---
S
F
G
------------------
E
--
H
P
P
------
L
V
D
I
T
Y
----
E
S
------------------
F
I
K
I
L
TRK
Q
---
A
G
---
I
---
Y
-------
T
---------
Y
--------
T
L
PEKWS
D
---
E
----
S
I
N
-------------------
W
N
E
NKI
L
R
---
P
K
K
L
Y
K
NN
C
A
F
Y
G
S
G
K
V
E
G
R
V
I
G
G
N
L
N
T
L
T
G
I
W
G
S
E
W
-
M
-
P
E
I
-
R
N
G
D
I
L
F
I
E
-
D
S
R
----
K
----
S
I
A
T
V
E
R
L
F
S
M
L
K
L
N
R
V
F
D
K
V
S
A
I
I
L
G
KH-
E
L
F
D
C
A
G
S
K
R
R
P
Y
E
V
L
T
E
V
L
D
G
K
Q
I
----
P
V
L
D
G
F
D
C
S
H
T
H
P
M
L
T
L
P
L
G
V
K
L
A
-
I
D
F
D
N
K
-
N
I
S
I
-----------
18
PsiBlast_PDB
76.25
28%
-120
- C3 -
3TLE
1
MCCF_ECOLX
A:
[43-362]
----------------
G
D
T
I
G
F
F
S
SS
A
P
A
---
T
V
---
T
A
K
---
N
R
F
F
R
G
V
E
F
L
Q
R
K
G
F
K
L
V
S
G
K
L
T
G
K
T
D
F
Y
R
S
G
T
I
K
E
R
A
Q
E
F
N
E
L
V
Y
N
P
D
I
T
C
I
M
S
T
I
G
G
D
N
S
N
S
L
L
P
F
L
D
Y
D
A
I
I
-
A
N
P
K
I
I
I
G
Y
S
D
T
T
A
L
L
A
G
I
Y
A
K
T
G
L
I
T
F
Y
G
P
A
L
I
P
---
S
F
G
------------------
E
--
H
P
P
------
L
V
D
I
T
Y
----
E
S
------------------
F
I
K
I
L
TRK
Q
---
S
G
---
I
---
Y
-------
T
---------
Y
--------
T
L
PEKWS
D
---
E
----
S
I
N
-------------------
W
N
E
NKI
L
R
---
P
K
K
L
Y
K
NN
C
A
F
Y
G
S
G
K
V
E
G
R
V
I
G
G
N
L
N
T
L
T
G
I
W
G
S
E
W
-
M
-
P
E
I
-
R
N
G
D
I
L
F
I
E
-
D
S
R
----
K
----
S
I
A
T
V
E
R
L
F
S
M
L
K
L
N
R
V
F
D
K
V
S
A
I
I
L
G
KH-
E
L
F
D
C
A
G
S
K
R
R
P
Y
E
V
L
T
E
V
L
D
G
K
Q
I
----
P
V
L
D
G
F
D
C
S
H
T
H
P
M
L
T
L
P
L
G
V
K
L
A
-
I
D
F
D
N
K
-
N
I
S
I
-----------
20
PsiBlast_PDB
76.22
28%
-115
- C3 -
3TLG
-
MCCF_ECOLX
B:
[16-335]
----------------
G
D
T
I
G
F
F
S
SS
A
P
A
---
T
V
---
T
A
K
---
N
R
F
F
R
G
V
E
F
L
Q
R
K
G
F
K
L
V
S
G
K
L
T
G
K
T
D
F
Y
R
S
G
T
I
K
E
R
A
Q
E
F
N
E
L
V
Y
N
P
D
I
T
C
I
M
S
T
I
G
G
D
N
S
N
S
L
L
P
F
L
D
Y
D
A
I
I
-
A
N
P
K
I
I
I
G
Y
S
D
T
T
A
L
L
A
G
I
Y
A
K
T
G
L
I
T
F
Y
G
P
A
L
I
P
---
S
F
G
------------------
E
--
H
P
P
------
L
V
D
I
T
Y
----
E
S
------------------
F
I
K
I
L
TRK
Q
---
S
G
---
I
---
Y
-------
T
---------
Y
--------
T
L
P
EKWS
D
---
E
----
S
I
N
-------------------
W
N
E
NKI
L
R
---
P
K
K
L
Y
K
NN
C
A
F
Y
G
S
G
K
V
E
G
R
V
I
G
G
N
L
N
T
L
T
G
I
W
G
S
E
W
-
M
-
P
E
I
-
R
N
G
D
I
L
F
I
E
-
D
S
R
----
K
----
S
I
A
T
V
E
R
L
F
S
M
L
K
L
N
R
V
F
D
K
V
S
A
I
I
L
G
KH-
E
L
F
D
C
A
G
S
K
R
R
P
Y
E
V
L
T
E
V
L
D
G
K
Q
I
----
P
V
L
D
G
F
D
C
S
H
T
H
P
M
L
T
L
P
L
G
V
K
L
A
-
I
D
F
D
N
K
-
N
I
S
I
-----------
11
PsiBlast_PDB
76.20
29%
-92
- C3 -
5FD8
1
?
A:
[6-326]
----------
P
T
K
L
K
K
G
D
E
I
R
V
I
---
S
P
S
CSL
S
I
---
V
S
T
---
E
N
R
R
L
A
V
K
R
L
T
E
L
G
F
H
V
T
F
S
T
H
A
E
E
I
D
R
F
A
S
S
S
I
S
S
R
V
Q
D
L
H
E
A
F
R
D
P
N
V
K
A
I
L
T
T
L
G
G
Y
N
S
N
G
L
L
K
Y
L
D
Y
D
L
I
R
-
E
N
P
K
F
F
C
G
Y
S
D
I
T
A
L
N
N
A
I
Y
T
K
T
G
L
V
T
Y
S
G
P
H
F
S
S
FGM
E
K
G
L
E
Y
T
T
D
Y
F
L
Q
C
L
TSNKPI
E
--
V
L
P
------
S
E
T
W
S
D
----
D
S
------------------
W
Y
------
I
---
D
Q
---
E
N
R
K
F
-------
I
---------
K
--------
N
------
E
---
G
----
Y
V
S
-------------------
I
H
E
----------------------
G
E
A
T
G
D
I
I
G
G
N
M
S
T
L
N
L
L
Q
G
T
S
Y
-
M
-
P
N
L
-
K
-
D
K
I
L
F
L
E
-
E
D
S
LTGT
S
----
T
L
K
T
F
D
R
Y
L
H
S
L
M
Q
Q
Q
N
F
K
H
V
K
G
I
V
I
G
---
K
M
Q
K
G
A
E
C
T
I
E
---
D
I
Q
E
M
I
A
S
K
P
E
L
A
H
I
P
I
I
A
N
A
S
F
G
H
T
T
P
I
F
T
F
P
I
G
G
R
A
T
I
I
S
S
K
E
K
-
T
S
I
------------
17
PsiBlast_PDB
75.63
28%
-116
- C3 -
3TLA
1
MCCF_ECOLX
A:
[43-362]
----------------
G
D
T
I
G
F
F
S
SS
A
P
A
---
T
V
---
T
A
K
---
N
R
F
F
R
G
V
E
F
L
Q
R
K
G
F
K
L
V
S
G
K
L
T
G
K
T
D
F
Y
R
S
G
T
I
K
E
R
A
Q
E
F
N
E
L
V
Y
N
P
D
I
T
C
I
M
S
T
I
G
G
D
N
S
N
S
L
L
P
F
L
D
Y
D
A
I
I
-
A
N
P
K
I
I
I
G
Y
S
D
T
T
A
L
L
A
G
I
Y
A
K
T
G
L
I
T
F
Y
G
P
A
L
I
P
---
S
F
G
------------------
E
--
H
P
P
------
L
V
D
I
T
Y
----
E
S
------------------
F
I
K
I
L
TRK
Q
---
S
G
---
I
---
Y
-------
T
---------
Y
--------
T
L
P
EKWS
D
---
E
----
S
I
N
-------------------
W
N
E
NKI
L
R
---
P
K
K
L
Y
K
NN
C
A
F
Y
G
S
G
K
V
E
G
R
V
I
G
G
N
L
N
T
L
T
G
I
W
G
S
E
W
-
M
-
P
E
I
-
R
N
G
D
I
L
F
I
E
-
D
S
R
----
K
----
S
I
A
T
V
E
R
L
F
S
M
L
K
L
N
R
V
F
D
K
V
S
A
I
I
L
G
KH-
E
L
F
D
C
A
G
S
K
R
R
P
Y
E
V
L
T
E
V
L
D
G
K
Q
I
----
P
V
L
D
G
F
D
C
S
H
T
H
P
M
L
T
L
P
L
G
V
K
L
A
-
I
D
F
D
N
K
-
N
I
S
I
-----------
16
PsiBlast_PDB
75.42
28%
-117
- C3 -
3TLZ
4
MCCF_ECOLX
A:
[43-362]
----------------
G
D
T
I
G
F
F
S
SS
A
P
A
---
T
V
---
T
A
K
---
N
R
F
F
R
G
V
E
F
L
Q
R
K
G
F
K
L
V
S
G
K
L
T
G
K
T
D
F
Y
R
S
G
T
I
K
E
R
A
Q
E
F
N
E
L
V
Y
N
P
D
I
T
C
I
M
S
T
I
G
G
D
N
S
N
S
L
L
P
F
L
D
Y
D
A
I
I
-
A
N
P
K
I
I
I
G
Y
S
D
T
T
A
L
L
A
G
I
Y
A
K
T
G
L
I
T
F
Y
G
P
A
L
I
P
---
S
F
G
------------------
E
--
H
P
P
------
L
V
D
I
T
Y
----
E
S
------------------
F
I
K
I
L
TRK
Q
---
S
G
---
I
---
Y
-------
T
---------
Y
--------
T
L
P
EKWS
D
---
E
----
S
I
N
-------------------
F
N
E
NKI
L
R
---
P
K
K
L
Y
K
NN
C
A
F
Y
G
S
G
K
V
E
G
R
V
I
G
G
N
L
N
T
L
T
G
I
W
G
S
E
W
-
M
-
P
E
I
-
R
N
G
D
I
L
F
I
E
-
D
S
R
----
K
----
S
I
A
T
V
E
R
L
F
S
M
L
K
L
N
R
V
F
D
K
V
S
A
I
I
L
G
KH-
E
L
F
D
C
A
G
S
K
R
R
P
Y
E
V
L
T
E
V
L
D
G
K
Q
I
----
P
V
L
D
G
F
D
C
S
H
T
H
P
M
L
T
L
P
L
G
V
K
L
A
-
I
D
F
D
N
K
-
N
I
S
I
-----------
10
PsiBlast_PDB
74.76
29%
-86
- C3 -
4E5S
1
?
A:
[6-326]
----------
P
T
K
L
K
K
G
D
E
I
R
V
I
---
S
P
S
CSL
S
I
---
V
S
T
---
E
N
R
R
L
A
V
K
R
L
T
E
L
G
F
H
V
T
F
S
T
H
A
E
E
I
D
R
F
A
S
S
S
I
S
S
R
V
Q
D
L
H
E
A
F
R
D
P
N
V
K
A
I
L
T
T
L
G
G
Y
N
S
N
G
L
L
K
Y
L
D
Y
D
L
I
R
-
E
N
P
K
F
F
C
G
Y
S
D
I
T
A
L
N
N
A
I
Y
T
K
T
G
L
V
T
Y
S
G
P
H
F
S
S
F
G
M
E
K
G
L
E
Y
T
T
D
Y
F
L
Q
C
L
TSNKPI
E
--
V
L
P
------
S
E
T
W
S
D
----
D
S
------------------
W
Y
------
I
---
D
Q
---
E
N
R
K
F
-------
I
---------
K
--------
N
------
E
---
G
----
Y
V
S
-------------------
I
H
E
----------------------
G
E
A
T
G
D
I
I
G
G
N
M
S
T
L
N
L
L
Q
G
T
S
Y
-
M
-
P
N
L
-
K
-
D
K
I
L
F
L
E
-
E
D
S
LTGT
S
----
T
L
K
T
F
D
R
Y
L
H
S
L
M
Q
Q
Q
N
F
K
H
V
K
G
I
V
I
G
---
K
M
Q
K
G
A
E
C
T
I
E
---
D
I
Q
E
M
I
A
S
K
P
E
L
A
H
I
P
I
I
A
N
A
S
F
G
H
T
T
P
I
F
T
F
P
I
G
G
R
A
T
I
I
S
S
K
E
K
-
T
S
I
------------
9
PsiBlast_PDB
74.67
29%
-115
- C3 -
4INJ
3
?
A:
[6-318]
----------
P
A
K
L
K
Q
G
D
E
I
R
I
I
---
A
P
S
---
R
S
IGI
M
A
D
---
N
Q
V
E
I
A
V
N
R
L
T
D
M
G
F
K
V
T
F
G
E
H
V
A
E
M
D
C
M
M
S
S
S
I
R
S
R
V
A
D
I
H
E
A
F
N
D
S
S
V
K
A
I
L
T
V
I
G
G
F
N
S
N
Q
L
L
P
Y
L
D
Y
D
L
I
S
-
E
N
P
K
I
L
C
G
F
A
D
I
T
A
L
A
T
A
I
Y
T
Q
T
E
L
I
T
Y
S
G
A
H
F
S
S
FSM
E
K
G
L
D
----------------
Y
--
V
---------
M
E
S
F
S
----
D
C
------------------
L
L
------
Q
---
K
E
---
P
---
F
-------
A
---------
L
--------
K
------
E
---
S
----
A
T
W
SDDEWYLDQE
N
R
N
F
I
PNEG
L
V
V
---
M
Q
---
P
-------------
G
V
A
E
G
I
I
I
G
G
N
L
C
T
L
N
L
L
Q
G
T
E
Y
-
M
-
P
N
L
-
A
-
G
T
I
L
F
I
E
D
D
F
M
----
T
----
I
P
E
T
F
D
R
D
L
E
S
L
L
S
Q
P
G
A
D
E
I
E
G
M
V
I
G
---
R
F
Q
Q
K
T
A
M
T
A
E
K
---
L
A
Y
I
I
E
T
K
T
A
L
Q
K
I
P
V
I
S
G
A
D
F
G
H
T
Q
P
I
A
T
F
P
I
G
G
T
A
R
-
I
D
T
N
Q
-----------------
14
PsiBlast_PDB
74.55
30%
-125
- C3 -
1ZL0
11
LDC_PSEAE
A:
[20-303]
-------------------
V
A
L
I
---
A
P
A
---
S
A
---
I
A
T
---
D
V
L
E
A
T
L
R
Q
L
E
V
H
G
V
D
Y
H
L
G
R
H
V
E
A
R
Y
R
Y
L
A
G
T
V
E
Q
R
L
E
D
L
H
N
A
F
D
M
P
D
I
T
A
V
W
C
L
R
G
G
Y
G
C
G
Q
L
L
P
G
L
D
W
G
R
L
Q
A
A
S
P
R
P
L
I
G
F
S
D
I
S
V
L
L
S
A
F
H
R
H
-
G
L
P
A
I
H
G
P
V
-
A
T
---
G
L
G
L
S
---------------------
P
------
L
S
A
P
R
E
----
Q
Q
------------------
E
R
------
L
---
A
S
---
L
---
A
-------
S
---------
V
--------
S
------
R
---
L
----
L
A
G
-------------------
I
D
H
---
E
L
---
P
V
Q
H
L
G
GHK-----
Q
R
V
E
G
A
L
I
G
G
N
L
T
A
L
A
C
M
A
G
T
L
G
-
G
-
L
H
A
P
A
-
G
S
I
L
V
L
E
-
D
V
G
----
E
----
P
Y
Y
R
L
E
R
S
L
W
Q
L
L
E
S
I
D
A
R
Q
L
G
A
I
C
L
G
---
S
F
T
D
C
--
P
R
K
E
V
A
H
S
L
E
R
I
F
G
E
Y
A
A
A
I
E
V
P
L
Y
H
H
L
P
S
G
H
G
A
Q
N
R
A
W
P
Y
G
----------
K
-
T
A
V
L
E
----------
12
PsiBlast_PDB
74.52
30%
-104
- C3 -
4H1H
2
?
A:
[6-322]
----------
P
A
K
L
K
Q
G
D
E
I
R
I
I
---
A
P
S
---
R
S
IGI
M
A
D
---
N
Q
V
E
I
A
V
N
R
L
T
D
M
G
F
K
V
T
F
G
E
H
V
A
E
M
D
C
M
M
S
S
S
I
R
S
R
V
A
D
I
H
E
A
F
N
D
S
S
V
K
A
I
L
T
V
I
G
G
F
N
S
N
Q
L
L
P
Y
L
D
Y
D
L
I
S
-
E
N
P
K
I
L
C
G
F
S
D
I
T
A
L
A
T
A
I
Y
T
Q
T
E
L
I
T
Y
S
G
A
H
F
S
S
F
S
M
E
K
G
L
D
----------------
Y
--
V
M
E
S
F
S
D
C
L
L
Q
K
E
P
F
ALKE
S
A
------------------
T
W
------
S
---
D
D
---
E
---
W
-------
Y
---------
L
--------
D
------
Q
---
E
N
R
N
-
F
I
P
-------------------
N
E
G
---
L
V
VM
Q
P
-------------
G
V
A
E
G
I
I
I
G
G
N
L
C
T
L
N
L
L
Q
G
T
E
Y
-
M
-
P
N
L
-
A
-
G
T
I
L
F
I
E
D
D
F
M
----
T
----
I
P
E
T
F
D
R
D
L
E
S
L
L
S
Q
P
G
A
D
E
I
E
G
M
V
I
G
---
R
F
Q
Q
K
T
A
M
T
A
E
K
---
L
A
Y
I
I
E
T
K
T
A
L
Q
K
I
P
V
I
S
G
A
D
F
G
H
T
Q
P
I
A
T
F
P
I
G
G
T
A
R
-
I
D
T
N
Q
T
-
D
K
I
------------
24
HHSearch
74.33
29%
-114
- C3 -
4INJ
3
?
A:
[2-324]
------
N
A
M
I
P
A
K
L
K
Q
G
D
E
I
R
I
I
---
A
P
S
---
R
S
---
I
G
I
MA
D
N
Q
V
E
I
A
V
N
R
L
T
D
M
G
F
K
V
T
F
G
E
H
V
A
E
M
D
C
M
M
S
S
S
I
R
S
R
V
A
D
I
H
E
A
F
N
D
S
S
V
K
A
I
L
T
V
I
G
G
F
N
S
N
Q
L
L
P
Y
L
D
Y
D
L
I
S
-
E
N
P
K
I
L
C
G
F
A
D
I
T
A
L
A
T
A
I
Y
T
Q
T
E
L
I
T
Y
S
G
A
H
F
S
S
---
F
S
M
E
K
----------------
G
--
L
D
Y
------
V
M
E
S
F
S
----
D
C
------------------
L
L
------
Q
KEP
F
A
---
L
---
K
ESAT---
W
---------
S
DDEWYLDQ
E
------
N
---
R
N
F
I
P
N
E
G
-------------------
L
V
V
---
M
Q
---
P
-------------
G
V
A
E
G
I
I
I
G
G
N
L
C
T
L
N
L
L
Q
G
T
E
Y
-
M
-
P
N
L
-
A
-
G
T
I
L
F
I
E
-
D
D
F
----
M
T---
I
P
E
T
F
D
R
D
L
E
S
L
L
S
Q
P
G
A
D
E
I
E
G
M
V
I
G
---
R
F
Q
Q
K
T
A
M
T
---
A
E
K
L
A
Y
I
I
E
T
K
T
A
L
Q
K
I
P
V
I
S
G
A
D
F
G
H
T
Q
P
I
A
T
F
P
I
G
G
T
A
R
-
I
D
T
N
Q
T
D
K
I
Q
I
-----------
3
PsiBlast_PDB
73.69
29%
-98
- C3 -
3T5M
2
?
A:
[7-330]
----------
P
K
S
L
K
Y
G
D
T
I
G
I
Y
---
S
P
S
---
S
P
V
T
Y
T
S
P
---
K
R
F
E
R
A
K
S
Y
L
L
Q
K
G
F
H
I
L
E
G
S
L
T
G
R
Y
D
Y
Y
R
S
G
S
I
Q
E
R
A
K
E
L
N
A
L
I
R
N
P
N
V
S
C
I
M
S
T
I
G
G
M
N
S
N
S
L
L
P
Y
I
D
Y
D
A
F
Q
-
N
N
P
K
I
M
I
G
Y
A
D
A
T
A
L
L
L
G
I
Y
A
K
T
G
I
P
T
F
Y
G
P
A
L
V
P
---
S
F
G
------------------
E
--
F
E
P
------
F
V
D
D
T
Y
----
K
Y
F
L
E
T
LLHDQALPYNIKQP
L
F
------
W
---
S
D
---
E
---
F
-------
I
---------
N
--------
W
------
E
---
E
----
K
T
K
-------------------
E
K
E
---
L
R
---
P
N
N
W
I
SV
T
N
-----
G
Q
A
T
G
R
V
I
G
G
N
L
N
T
I
Q
G
I
W
G
S
P
Y
M
P
-
C
I
Q
-
E
-
G
D
I
L
F
I
E
-
D
S
S
----
K
----
D
A
A
T
I
E
R
S
F
S
F
L
K
I
N
G
V
F
D
K
V
S
G
I
I
L
G
KHE
Q
F
D
D
C
G
T
N
R
K
P
Y
E
I
L
L
E
-
V
L
Q
N
Q
R
I
----
P
L
L
A
D
F
D
C
C
H
T
H
P
M
I
T
M
P
I
G
V
Q
V
K
-
M
D
A
T
N
K
-
T
I
H
I
-----------
21
HHSearch
73.68
28%
-97
- C3 -
4E5S
1
?
A:
[3-328]
-------
A
M
L
P
T
K
L
K
K
G
D
E
I
R
V
I
---
S
P
S
---
C
S
---
L
S
I
VS
T
E
N
R
R
L
A
V
K
R
L
T
E
L
G
F
H
V
T
F
S
T
H
A
E
E
I
D
R
F
A
S
S
S
I
S
S
R
V
Q
D
L
H
E
A
F
R
D
P
N
V
K
A
I
L
T
T
L
G
G
Y
N
S
N
G
L
L
K
Y
L
D
Y
D
L
I
R
-
E
N
P
K
F
F
C
G
Y
S
D
I
T
A
L
N
N
A
I
Y
T
K
T
G
L
V
T
Y
S
G
P
H
F
S
S
---
F
G
M
E
K
----------------
G
--
L
E
Y
------
T
T
D
Y
F
L
----
Q
C
------------------
L
T
------
S
---
N
K
---
P
---
I
EVLPSE
T
W
S
D
D
SW----
Y
IDQ-----
E
------
N
---
R
K
F
I
K
N
E
G
-------------------
Y
V
S
---
I
H
---
E
-------------
G
E
A
T
G
D
I
I
G
G
N
M
S
T
L
N
L
L
Q
G
T
S
Y
-
M
-
P
N
L
-
K
-
D
K
I
L
F
L
E
-
E
D
S
----
L
TGTS
T
L
K
T
F
D
R
Y
L
H
S
L
M
Q
Q
Q
N
F
K
H
V
K
G
I
V
I
G
---
K
M
Q
K
G
A
E
C
T
---
I
E
D
I
Q
E
M
I
A
S
K
P
E
L
A
H
I
P
I
I
A
N
A
S
F
G
H
T
T
P
I
F
T
F
P
I
G
G
R
A
T
-
I
I
S
S
K
E
-
K
T
S
I
T
I
---------
2
PsiBlast_PDB
73.61
29%
-96
- C3 -
3U1B
1
?
A:
[7-330]
----------
P
K
S
L
K
Y
G
D
T
I
G
I
Y
---
S
P
S
---
S
P
VTY
T
S
P
---
K
R
F
E
R
A
K
S
Y
L
L
Q
K
G
F
H
I
L
E
G
S
L
T
G
R
Y
D
Y
Y
R
S
G
S
I
Q
E
R
A
K
E
L
N
A
L
I
R
N
P
N
V
S
C
I
M
S
T
I
G
G
M
N
S
N
S
L
L
P
Y
I
D
Y
D
A
F
Q
-
N
N
P
K
I
M
I
G
Y
S
D
A
T
A
L
L
L
G
I
Y
A
K
T
G
I
P
T
F
Y
G
P
A
L
V
P
---
S
F
G
------------------
E
--
F
E
P
------
F
V
D
D
T
Y
----
K
Y
F
L
E
T
LLHDQALP
Y
N
I
K
Q
P
L
F
------
W
---
S
D
---
E
---
F
-------
I
---------
N
--------
W
------
E
---
E
----
K
T
K
-------------------
E
K
E
---
L
R
---
P
N
N
W
I
SV
T
N
-----
G
Q
A
T
G
R
V
I
G
G
N
L
N
T
I
Q
G
I
W
G
S
P
Y
M
P
-
C
I
Q
-
E
-
G
D
I
L
F
I
E
-
D
S
R
----
K
----
D
A
A
T
I
E
R
S
F
S
F
L
K
I
N
G
V
F
D
K
V
S
G
I
I
L
G
KHE
Q
F
D
D
C
G
T
N
R
K
P
Y
E
I
L
L
E
-
V
L
Q
N
Q
R
I
----
P
L
L
A
D
F
D
C
C
H
T
H
P
M
I
T
M
P
I
G
V
Q
V
K
-
M
D
A
T
N
K
-
T
I
H
I
-----------
8
PsiBlast_PDB
73.50
29%
-96
- C3 -
4MI1
2
?
A:
[7-330]
----------
P
K
S
L
K
Y
G
D
T
I
G
I
Y
---
S
P
S
---
S
P
VTY
T
S
P
---
K
R
F
E
R
A
K
S
Y
L
L
Q
K
G
F
H
I
L
E
G
S
L
T
G
R
Y
D
Y
Y
R
S
G
S
I
Q
E
R
A
K
E
L
N
A
L
I
R
N
P
N
V
S
C
I
M
S
T
I
G
G
M
N
S
N
S
L
L
P
Y
I
D
Y
D
A
F
Q
-
N
N
P
K
I
M
I
G
Y
A
D
A
T
A
L
L
L
G
I
Y
A
K
T
G
I
P
T
F
Y
G
P
A
L
V
P
---
S
F
G
------------------
E
--
F
E
P
------
F
V
D
D
T
Y
----
K
Y
F
L
E
T
LLHDQALP
Y
N
I
K
Q
P
L
F
------
W
---
S
D
---
E
---
F
-------
I
---------
N
--------
W
------
E
---
E
----
K
T
K
-------------------
E
K
E
---
L
R
---
P
N
N
W
I
SV
T
N
-----
G
Q
A
T
G
R
V
I
G
G
N
L
N
T
I
Q
G
I
W
G
S
P
Y
-
M
P
C
I
Q
-
E
-
G
D
I
L
F
I
E
-
D
S
S
----
K
----
D
A
A
T
I
E
R
S
F
S
F
L
K
I
N
G
V
F
D
K
V
S
G
I
I
L
G
KHE
Q
F
D
D
C
G
T
N
R
K
P
Y
E
I
L
L
E
-
V
L
Q
N
Q
R
I
----
P
L
L
A
D
F
D
C
C
A
T
H
P
M
I
T
M
P
I
G
V
Q
V
K
-
M
D
A
T
N
K
-
T
I
H
I
-----------
6
PsiBlast_PDB
73.50
29%
-95
- C3 -
4MJX
3
?
A:
[7-330]
----------
P
K
S
L
K
Y
G
D
T
I
G
I
Y
---
S
P
S
---
S
P
V
T
Y
T
S
P
---
K
R
F
E
R
A
K
S
Y
L
L
Q
K
G
F
H
I
L
E
G
S
L
T
G
R
Y
D
Y
Y
R
S
G
S
I
Q
E
R
A
K
E
L
N
A
L
I
R
N
P
N
V
S
C
I
M
S
T
I
G
G
M
N
S
N
S
L
L
P
Y
I
D
Y
D
A
F
Q
-
N
N
P
K
I
M
I
G
Y
A
D
A
T
A
L
L
L
G
I
Y
A
K
T
G
I
P
T
F
Y
G
P
A
L
V
P
---
S
F
G
------------------
E
--
F
E
P
------
F
V
D
D
T
Y
----
K
Y
F
L
E
T
LLHDQALP
Y
N
I
K
Q
P
L
F
------
W
---
S
D
---
E
---
F
-------
I
---------
N
--------
W
------
E
---
E
----
K
T
K
-------------------
E
K
E
---
L
R
---
P
N
N
W
I
SV
T
N
-----
G
Q
A
T
G
R
V
I
G
G
N
L
N
T
I
Q
G
I
W
G
S
P
Y
M
P
-
C
I
Q
-
E
-
G
D
I
L
F
I
E
-
D
S
S
----
K
----
D
A
A
T
I
E
R
S
F
S
F
L
K
I
N
G
V
F
D
K
V
S
G
I
I
L
G
KHE
Q
F
D
D
C
G
T
N
R
K
P
Y
E
I
L
L
E
-
V
L
Q
N
Q
R
I
----
P
L
L
A
D
F
D
C
C
A
T
H
P
M
I
T
M
P
I
G
V
Q
V
K
-
M
D
A
T
N
K
-
T
I
H
I
-----------
5
PsiBlast_PDB
73.39
29%
-96
- C3 -
4JVO
1
?
A:
[7-330]
----------
P
K
S
L
K
Y
G
D
T
I
G
I
Y
---
S
P
S
---
S
P
VTY
T
S
P
---
K
R
F
E
R
A
K
S
Y
L
L
Q
K
G
F
H
I
L
E
G
S
L
T
G
R
Y
D
Y
Y
R
S
G
S
I
Q
E
R
A
K
E
L
N
A
L
I
R
N
P
N
V
S
C
I
M
S
T
I
G
G
M
N
S
N
S
L
L
P
Y
I
D
Y
D
A
F
Q
-
N
N
P
K
I
M
I
G
Y
A
D
A
T
A
L
L
L
G
I
Y
A
K
T
G
I
P
T
F
Y
G
P
A
L
V
P
---
S
F
G
------------------
E
--
F
E
P
------
F
V
D
D
T
Y
----
K
Y
F
L
E
T
LL
H
D
Q
A
L
PYNIKQP
L
F
------
W
---
S
D
---
E
---
F
-------
I
---------
N
--------
W
------
E
---
E
----
K
T
K
-------------------
E
K
E
---
L
R
---
P
N
N
W
I
SV
T
N
-----
G
Q
A
T
G
R
V
I
G
G
N
L
N
T
I
Q
G
I
W
G
S
P
Y
M
P
-
C
I
Q
-
E
-
G
D
I
L
F
I
E
-
D
S
S
----
K
----
D
A
A
T
I
E
R
S
F
S
F
L
K
I
N
G
V
F
D
K
V
S
G
I
I
L
G
KHE
Q
F
D
D
C
G
T
N
R
K
P
Y
E
I
L
L
E
-
V
L
Q
N
Q
R
I
----
P
L
L
A
D
F
D
C
C
A
T
H
P
M
I
T
M
P
I
G
V
Q
V
K
-
M
D
A
T
N
K
-
T
I
H
I
-----------
23
HHSearch
73.28
27%
-108
- C3 -
4JVO
1
?
A:
[3-332]
------
A
M
P
L
P
K
S
L
K
Y
G
D
T
I
G
I
Y
---
S
P
S
---
S
P
---
V
T
Y
TS
P
K
R
F
E
R
A
K
S
Y
L
L
Q
K
G
F
H
I
L
E
G
S
L
T
G
R
Y
D
Y
Y
R
S
G
S
I
Q
E
R
A
K
E
L
N
A
L
I
R
N
P
N
V
S
C
I
M
S
T
I
G
G
M
N
S
N
S
L
L
P
Y
I
D
Y
D
A
F
Q
-
N
N
P
K
I
M
I
G
Y
A
D
A
T
A
L
L
L
G
I
Y
A
K
T
G
I
P
T
F
Y
G
P
A
L
V
P
---
S
F
G
E
F
----------------
E
P
F
V
D
D
------
T
Y
K
Y
F
L
----
E
T
------------------
L
L
------
H
---
D
Q
A
L
P
Y
---
N
IKQPLF-
W
SDEFINWEE
K
--------
T
K-----
E
KEL
R
----
P
N
N
-------------------
W
I
S
---
V
T
---
N
-------------
G
Q
A
T
G
R
V
I
G
G
N
L
N
T
I
Q
G
I
W
G
S
P
Y
-
M
-
P
C
I
Q
E
-
G
D
I
L
F
I
E
-
D
S
S
----
K
----
D
A
A
T
I
E
R
S
F
S
F
L
K
I
N
G
V
F
D
K
V
S
G
I
I
L
G
---
K
H
E
Q
F
D
D
C
G
--
T
N
R
K
P
Y
E
I
L
L
E
V
L
Q
N
Q
R
I
P
L
L
A
D
F
D
C
C
A
T
H
P
M
I
T
M
P
I
G
V
Q
V
K
-
M
D
A
T
N
K
-
T
I
H
I
L
E
---------
15
PsiBlast_PDB
72.93
30%
-132
- C3 -
2AUM
-
LDC_PSEAE
A:
[18-301]
-------------------
V
A
L
I
---
A
P
A
---
S
A
---
I
A
T
---
E
V
L
E
A
T
L
R
Q
L
E
V
H
G
V
D
Y
H
L
G
R
H
V
E
A
R
Y
R
Y
L
A
G
T
V
E
Q
R
L
E
D
L
H
N
A
F
D
M
P
D
I
T
A
V
W
C
L
R
G
G
Y
G
C
G
Q
L
L
P
G
L
D
W
G
R
L
E
A
A
S
P
R
P
L
I
G
F
A
D
I
S
V
L
L
S
A
F
H
R
H
-
G
L
P
A
I
H
G
P
V
-
A
T
---
G
L
G
L
----------------------------------------
Q
------------------
E
R
------
L
---
A
S
---
L
---
A
-------
S
---------
V
--------
S
------
R
---
L
----
L
A
G
-------------------
I
D
H
---
E
L
---
P
V
Q
H
L
G
GHK-----
Q
R
V
E
G
A
L
I
G
G
N
L
T
A
L
A
C
M
A
G
T
L
G
-
G
-
L
H
A
P
A
-
G
S
I
L
V
L
E
-
D
V
G
----
E
----
P
Y
Y
R
L
E
R
S
L
W
Q
L
L
E
S
I
D
A
R
Q
L
G
A
I
C
L
G
---
S
F
T
D
C
--
P
R
K
E
V
A
H
S
L
E
R
I
F
G
E
Y
A
A
A
I
E
V
P
L
Y
H
H
L
P
S
G
H
G
A
Q
N
R
A
W
P
Y
G
----------
K
-
T
A
V
L
E
----------
13
PsiBlast_PDB
72.58
30%
-130
- C3 -
1ZRS
-
LDC_PSEAE
A:
[18-301]
-------------------
V
A
L
I
---
A
P
A
---
S
A
---
I
A
T
---
E
V
L
E
A
T
L
R
Q
L
E
V
H
G
V
D
Y
H
L
G
R
H
V
E
A
R
Y
R
Y
L
A
G
T
V
E
Q
R
L
E
D
L
H
N
A
F
D
M
P
D
I
T
A
V
W
C
L
R
G
G
Y
G
C
G
Q
L
L
P
G
L
D
W
G
R
L
E
A
A
S
P
R
P
L
I
G
F
S
D
I
S
V
L
L
S
A
F
H
R
H
-
G
L
P
A
I
H
G
P
V
-
A
T
---
G
L
G
L
----------------------------------------
Q
------------------
E
R
------
L
---
A
S
---
L
---
A
-------
S
---------
V
--------
S
------
R
---
L
----
L
A
G
-------------------
I
D
H
---
E
L
---
P
V
Q
H
L
G
GHK-----
Q
R
V
E
G
A
L
I
G
G
N
L
T
A
L
A
C
M
A
G
T
L
G
-
G
-
L
H
A
P
A
-
G
S
I
L
V
L
E
-
D
V
G
----
E
----
P
Y
Y
R
L
E
R
S
L
W
Q
L
L
E
S
I
D
A
R
Q
L
G
A
I
C
L
G
---
S
F
T
D
C
--
P
R
K
E
V
A
H
S
L
E
R
I
F
G
E
Y
A
A
A
I
E
V
P
L
Y
H
H
L
P
S
G
H
G
A
Q
N
R
A
W
P
Y
G
----------
K
-
T
A
V
L
E
----------