@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 : bsu16990: (2016-06-27 )
MQSGKMKALMKKDGAFGAVLTEVPIPEIDKHEVLIKVKAASICGTDVHIYNWDQWARQRIKTPYVFGHEFSGIVEGVGENVSSVKVGEYVSAETHIVCGECVPCLTGKSHVCTNTAIIGVDTAGCFAEYVKVPADNIWRNPADMDPSIASIQEPLGNAVHTVLESQPAGGTTAVIGCGPIGLMAVAVAKAAGASQVIAIDKNEYRLRLAKQMGATCTVSIEKEDPLKIVSALTSGEGADLVCEMSGHPSAIAQGLAMAANGGRFHILSLPEHPVTIDLTNKVVFKGLTIQGITGRKMFSTWRQVSQLISSNMIDLAPVITHQFPLEEFEKGFELMRSGQCGKVILIP
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.......320.-.-.....330-.......340......
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MQSG
K
M
K
A
L
M
KKDGAF
G
A
V
-
L
TEVPIPEI-DK-
H
--
E
V
L
I
K
V
K
A
ASICGTD
V
--------
H
I
Y
N
W
D
Q
W
A
R
----
Q
RIKT
P
Y
VFG
H
E
F
S
G
-
I
V
E
G
VGE----NV------SSVKVG
E
Y
VSAE
T
H
I
V
CGECVPCLTGKS-HVCTN
T
A
I
I
G
V-D
T
A
--------
G
C
F
A
E
Y
V
KV-
P
A
D
NIWR-------NPADMDP
S
I
-
A
S
I
Q
E
P
L
G
N
A
V
H
T
V
L
ES----QP---A-GG
T
T
-----
A
-
V
I
-GCG
P
I
G
L
M
A
V
A
V
A
KAAGA
S
Q
V
I
A
IDK
N
E
Y
R
L
R
L
A
K
QMG
A
T
C
T
V
S
IE--K---ED
P
L
K
I
V
S
A
L
T--S--GEG
A
--
D
L
V
C
EMSG
H
P
S
A
I
---
A
Q
G
L
A
MAANG
G
R
F
H
I
--
L
SLPEH
P
--
V
T
I
--D-LTN
K
V
V
-FKG
L
T
I
QGITG
R
K
----
M
F
S
T
------
W
R
Q
V
S
Q
L
I
SSNM
I
D
L
A
P
V
ITHQF-
P
-
L
E
E
F
E
K
G
F
-
E
L
M
RSGQC-
G
K
V
I
LIP
23
PsiBlast_CBE
91.98
50%
-117
- C1 -
3GFB
7
TDH_THEKO
B:
[4-347]
----
K
M
Q
A
I
M
K
T
K
P
A
Y
G
A
E
-
L
V
E
V
D
V
P
K
P
-
G
P
-
G
--
E
V
L
I
K
V
L
A
T
S
I
C
G
T
D
L
--------
H
I
Y
E
W
N
E
W
A
Q
----
S
R
I
K
P
P
Q
I
M
G
H
E
V
A
G
-
E
V
V
E
V
G
P
----
G
V
------
E
D
L
Q
V
G
D
Y
I
S
V
E
T
H
I
V
C
G
K
C
Y
A
C
K
H
N
R
Y
-
H
V
C
Q
N
T
K
I
F
G
V
-
D
M
D
--------
G
V
F
A
H
Y
A
I
V
-
P
A
K
N
A
W
K
-------
N
P
K
D
M
P
P
E
Y
-
A
A
L
Q
E
P
L
G
N
A
V
D
T
V
L
A
G
----
P
I
---
A
-
G
R
S
T
-----
L
-
I
T
-
G
A
G
P
L
G
L
L
G
I
A
V
A
K
A
S
G
A
Y
P
V
I
V
S
E
P
S
E
F
R
R
K
L
A
K
K
V
G
A
D
Y
V
V
N
P
F
--
E
---
E
D
P
V
K
F
V
M
D
I
T
--
D
--
G
A
G
V
--
E
V
F
L
E
F
S
G
A
P
K
A
L
---
E
Q
G
L
K
A
V
T
P
G
G
R
V
S
L
--
L
G
L
F
P
R
E
--
V
T
I
--
D
-
F
N
N
L
I
I
-
F
K
A
L
E
V
H
G
I
T
G
R
H
----
L
W
E
T
------
W
Y
T
V
S
S
L
I
Q
S
G
K
L
N
L
D
P
I
I
T
H
K
Y
-
K
G
F
D
K
F
E
E
A
F
-
E
L
M
R
A
G
K
T
-
G
K
V
V
F
F
P
21
PsiBlast_CBE
91.18
50%
-119
- C1 -
3GFB
4
TDH_THEKO
D:
[4-347]
----
K
M
Q
A
I
M
K
T
K
P
A
Y
G
A
E
-
L
V
E
V
D
V
P
K
P
-
G
P
-
G
--
E
V
L
I
K
V
L
A
T
S
I
C
G
T
D
L
--------
H
I
Y
E
W
N
E
W
A
Q
----
S
R
I
K
P
P
Q
I
M
G
H
E
V
A
G
-
E
V
V
E
V
G
P
----
G
V
------
E
D
L
Q
V
G
D
Y
I
S
V
E
T
H
I
V
C
G
K
C
Y
A
C
K
H
N
R
Y
-
H
V
C
Q
N
T
K
I
F
G
V
-
D
M
D
--------
G
V
F
A
H
Y
A
I
V
-
P
A
K
N
A
W
K
-------
N
P
K
D
M
P
P
E
Y
-
A
A
L
Q
E
P
L
G
N
A
V
D
T
V
L
A
G
----
P
I
---
A
-
G
R
S
T
-----
L
-
I
T
-
G
A
G
P
L
G
L
L
G
I
A
V
A
K
A
S
G
A
Y
P
V
I
V
S
E
P
S
E
F
R
R
K
L
A
K
K
V
G
A
D
Y
V
V
N
P
F
--
E
---
E
D
P
V
K
F
V
M
D
I
T
--
D
--
G
A
G
V
--
E
V
F
L
E
F
S
G
A
P
K
A
L
---
E
Q
G
L
K
A
V
T
P
G
G
R
V
S
L
--
L
G
L
F
P
R
E
--
V
T
I
--
D
-
F
N
N
L
I
I
-
F
K
A
L
E
V
H
G
I
T
G
R
H
----
L
W
E
T
------
W
Y
T
V
S
S
L
I
Q
S
G
K
L
N
L
D
P
I
I
T
H
K
Y
-
K
G
F
D
K
F
E
E
A
F
-
E
L
M
R
A
G
K
T
-
G
K
V
V
F
F
P
1
PsiBlast_PDB
90.37
50%
-113
- C1 -
3GFB
2
TDH_THEKO
A:
[4-347]
----
K
M
Q
A
I
M
K
T
K
P
A
Y
G
A
E
-
L
V
E
V
D
V
P
K
P
-
G
P
-
G
--
E
V
L
I
K
V
L
A
T
S
I
C
G
T
D
L
--------
H
I
Y
E
W
N
E
W
A
Q
----
S
R
I
K
P
P
Q
I
M
G
H
E
V
A
G
-
E
V
V
E
V
G
P
----
G
V
------
E
D
L
Q
V
G
D
Y
I
S
V
E
T
H
I
V
C
G
K
C
Y
A
C
K
H
N
R
Y
-
H
V
C
Q
N
T
K
I
F
G
V
-
D
M
D
--------
G
V
F
A
H
Y
A
I
V
-
P
A
K
N
A
W
K
-------
N
P
K
D
M
P
P
E
Y
-
A
A
L
Q
E
P
L
G
N
A
V
D
T
V
L
A
G
----
P
I
---
A
-
G
R
S
T
-----
L
-
I
T
-
G
A
G
P
L
G
L
L
G
I
A
V
A
K
A
S
G
A
Y
P
V
I
V
S
E
P
S
E
F
R
R
K
L
A
K
K
V
G
A
D
Y
V
V
N
P
F
--
E
---
E
D
P
V
K
F
V
M
D
I
T
--
D
--
G
A
G
V
--
E
V
F
L
E
F
S
G
A
P
K
A
L
---
E
Q
G
L
K
A
V
T
P
G
G
R
V
S
L
--
L
G
L
F
P
R
E
--
V
T
I
--
D
-
F
N
N
L
I
I
-
F
K
A
L
E
V
H
G
I
T
G
R
H
----
L
W
E
T
------
W
Y
T
V
S
S
L
I
Q
S
G
K
L
N
L
D
P
I
I
T
H
K
Y
-
K
G
F
D
K
F
E
E
A
F
-
E
L
M
R
A
G
K
T
-
G
K
V
V
F
F
P
3
PsiBlast_PDB
90.31
48%
-119
- C1 -
2DFV
3
TDH_PYRHO
A:
[2-344]
---
E
K
M
V
A
I
M
K
T
K
P
G
Y
G
A
E
-
L
V
E
V
D
V
P
K
P
-
G
P
-
G
--
E
V
L
I
K
V
L
A
T
S
I
C
G
T
D
L
--------
H
I
Y
E
W
N
E
W
A
Q
----
S
R
I
K
P
P
Q
I
M
G
H
E
V
A
G
-
E
V
V
E
I
G
P
----
G
V
------
E
G
I
E
V
G
D
Y
V
S
V
E
T
H
I
V
C
G
K
C
Y
A
C
R
R
G
Q
Y
-
H
V
C
Q
N
T
K
I
F
G
V
-
D
T
D
--------
G
V
F
A
E
Y
A
V
V
-
P
A
Q
N
I
W
K
-------
N
P
K
S
I
P
P
E
Y
-
A
T
L
Q
E
P
L
G
N
A
V
D
T
V
L
A
G
----
P
I
---
S
-
G
K
S
V
-----
L
-
I
T
-
G
A
G
P
L
G
L
L
G
I
A
V
A
K
A
S
G
A
Y
P
V
I
V
S
E
P
S
D
F
R
R
E
L
A
K
K
V
G
A
D
Y
V
I
N
P
F
--
E
---
E
D
V
V
K
E
V
M
D
I
T
--
D
--
G
N
G
V
--
D
V
F
L
E
F
S
G
A
P
K
A
L
---
E
Q
G
L
Q
A
V
T
P
A
G
R
V
S
L
--
L
G
L
Y
P
G
K
--
V
T
I
--
D
-
F
N
N
L
I
I
-
F
K
A
L
T
I
Y
G
I
T
G
R
H
----
L
W
E
T
------
W
Y
T
V
S
R
L
L
Q
S
G
K
L
N
L
D
P
I
I
T
H
K
Y
-
K
G
F
D
K
Y
E
E
A
F
-
E
L
M
R
A
G
K
T
-
G
K
V
V
F
--
22
PsiBlast_CBE
87.61
50%
-113
- C1 -
3GFB
6
TDH_THEKO
C:
[4-347]
----
K
M
Q
A
I
M
K
T
K
P
A
Y
G
A
E
-
L
V
E
V
D
V
P
K
P
-
G
P
-
G
--
E
V
L
I
K
V
L
A
T
S
I
C
G
T
D
L
--------
H
I
Y
E
W
N
E
W
A
Q
----
S
R
I
K
P
P
Q
I
M
G
H
E
V
A
G
-
E
V
V
E
V
G
P
----
G
V
------
E
D
L
Q
V
G
D
Y
I
S
V
E
T
H
I
V
C
G
K
C
Y
A
C
K
H
N
R
Y
-
H
V
C
Q
N
T
K
I
F
G
V
-
D
M
D
--------
G
V
F
A
H
Y
A
I
V
-
P
A
K
N
A
W
K
-------
N
P
K
D
M
P
P
E
Y
-
A
A
L
Q
E
P
L
G
N
A
V
D
T
V
L
A
G
----
P
I
---
A
-
G
R
S
T
-----
L
-
I
T
-
G
A
G
P
L
G
L
L
G
I
A
V
A
K
A
S
G
A
Y
P
V
I
V
S
E
P
S
E
F
R
R
K
L
A
K
K
V
G
A
D
Y
V
V
N
P
F
--
E
---
E
D
P
V
K
F
V
M
D
I
T
--
D
--
G
A
G
V
--
E
V
F
L
E
F
S
G
A
P
K
A
L
---
E
Q
G
L
K
A
V
T
P
G
G
R
V
S
L
--
L
G
L
F
P
R
E
--
V
T
I
--
D
-
F
N
N
L
I
I
-
F
K
A
L
E
V
H
G
I
T
G
R
H
----
L
W
E
T
------
W
Y
T
V
S
S
L
I
Q
S
G
K
L
N
L
D
P
I
I
T
H
K
Y
-
K
G
F
D
K
F
E
E
A
F
-
E
L
M
R
A
G
K
T
-
G
K
V
V
F
F
P
87
HHSearch
85.81
49%
-119
- C1 -
2D8A
6
TDH_PYRHO
A:
[3-346]
---
E
K
M
V
A
I
M
K
T
K
P
G
Y
G
A
E
-
L
V
E
V
D
V
P
K
P
-
G
P
-
G
--
E
V
L
I
K
V
L
A
T
S
I
C
G
T
D
L
--------
H
I
Y
E
W
N
E
W
A
Q
----
S
R
I
K
P
P
Q
I
M
G
H
E
V
A
G
-
E
V
V
E
I
G
P
----
G
V
------
E
G
I
E
V
G
D
Y
V
S
V
E
T
H
I
V
C
G
K
C
Y
-------------
T
K
I
F
G
V
-
D
T
D
--------
G
V
F
A
E
Y
A
V
V
-
P
A
Q
N
I
W
K
-------
N
P
K
S
I
P
P
E
Y
-
A
T
L
Q
E
P
L
G
N
A
V
D
T
V
L
A
G
----
P
I
---
S
-
G
K
S
V
-----
L
-
I
T
-
G
A
G
P
L
G
L
L
G
I
A
V
A
K
A
S
G
A
Y
P
V
I
V
S
E
P
S
D
F
R
R
E
L
A
K
K
V
G
A
D
Y
V
I
N
P
F
--
E
---
E
D
V
V
K
E
V
M
D
I
T
--
D
--
G
N
G
V
--
D
V
F
L
E
F
S
G
A
P
K
A
L
---
E
Q
G
L
Q
A
V
T
P
A
G
R
V
S
L
--
L
G
L
Y
P
G
K
--
V
T
I
--
D
-
F
N
N
L
I
I
-
F
K
A
L
T
I
Y
G
I
T
G
R
H
----
L
W
E
T
------
W
Y
T
V
S
R
L
L
Q
S
G
K
L
N
L
D
P
I
I
T
H
K
Y
K
G
-
F
D
K
Y
E
E
A
F
-
E
L
M
R
A
G
K
T
-
G
K
V
V
F
M
-
2
PsiBlast_PDB
84.55
48%
-119
- C1 -
2D8A
6
TDH_PYRHO
A:
[3-345]
---
E
K
M
V
A
I
M
K
T
K
P
G
Y
G
A
E
-
L
V
E
V
D
V
P
K
P
-
G
P
-
G
--
E
V
L
I
K
V
L
A
T
S
I
C
G
T
D
L
--------
H
I
Y
E
W
N
E
W
A
Q
----
S
R
I
K
P
P
Q
I
M
G
H
E
V
A
G
-
E
V
V
E
I
G
P
----
G
V
------
E
G
I
E
V
G
D
Y
V
S
V
E
T
H
I
V
C
G
K
C
Y
-------------
T
K
I
F
G
V
-
D
T
D
--------
G
V
F
A
E
Y
A
V
V
-
P
A
Q
N
I
W
K
-------
N
P
K
S
I
P
P
E
Y
-
A
T
L
Q
E
P
L
G
N
A
V
D
T
V
L
A
G
----
P
I
---
S
-
G
K
S
V
-----
L
-
I
T
-
G
A
G
P
L
G
L
L
G
I
A
V
A
K
A
S
G
A
Y
P
V
I
V
S
E
P
S
D
F
R
R
E
L
A
K
K
V
G
A
D
Y
V
I
N
P
F
--
E
---
E
D
V
V
K
E
V
M
D
I
T
--
D
--
G
N
G
V
--
D
V
F
L
E
F
S
G
A
P
K
A
L
---
E
Q
G
L
Q
A
V
T
P
A
G
R
V
S
L
--
L
G
L
Y
P
G
K
--
V
T
I
--
D
-
F
N
N
L
I
I
-
F
K
A
L
T
I
Y
G
I
T
G
R
H
----
L
W
E
T
------
W
Y
T
V
S
R
L
L
Q
S
G
K
L
N
L
D
P
I
I
T
H
K
Y
-
K
G
F
D
K
Y
E
E
A
F
-
E
L
M
R
A
G
K
T
-
G
K
V
V
F
--
101
HHSearch
80.99
47%
-111
- C1 -
2DQ4
3
TDH_THET8
A:
[1-340]
-----
M
R
A
L
A
K
L
A
P
E
E
G
L
T
-
L
V
D
R
P
V
P
E
P
-
G
P
-
G
--
E
I
L
V
R
V
E
A
A
S
I
C
G
T
D
L
--------
H
I
W
K
W
D
A
W
A
R
----
G
R
I
R
P
P
L
V
T
G
H
E
F
S
G
-
V
V
E
A
V
G
P
----
G
V
------
R
R
P
Q
V
G
D
H
V
S
L
E
S
H
I
V
C
H
A
C
P
A
C
R
T
G
N
Y
-
H
V
C
L
N
T
Q
I
L
G
V
-
D
R
D
--------
G
G
F
A
E
Y
V
V
V
-
P
A
E
N
A
W
V
-------
N
P
K
D
L
P
F
E
V
-
A
A
I
L
E
P
F
G
N
A
V
H
T
V
Y
A
G
S---
G
V
---
S
-
G
K
S
V
-----
L
-
I
T
-
G
A
G
P
I
G
L
M
A
A
M
V
V
R
A
S
G
A
G
P
I
L
V
S
D
P
N
P
Y
R
L
A
F
A
R
P
Y
-
A
D
R
L
V
N
P
L
--
E
---
E
D
L
L
E
V
V
R
R
V
T
-----
G
S
G
V
--
E
V
L
L
E
F
S
G
N
E
A
A
I
---
H
Q
G
L
M
A
L
I
P
G
G
E
A
R
I
--
L
G
I
P
S
D
P
--
I
R
F
--
D
-
L
A
G
E
L
V
-
M
R
G
I
T
A
F
G
I
A
G
R
R
----
L
W
Q
T
------
W
M
Q
G
T
A
L
V
Y
S
G
R
V
D
L
S
P
L
L
T
H
R
L
-
P
-
L
S
R
Y
R
E
A
F
-
G
L
L
A
S
G
Q
A
-
V
K
V
I
L
D
-
24
PsiBlast_CBE
77.98
47%
-109
- C1 -
2EJV
4
TDH_THET8
B:
[1-341]
-----
M
R
A
L
A
K
L
A
P
E
E
G
L
T
-
L
V
D
R
P
V
P
E
P
-
G
P
-
G
--
E
I
L
V
R
V
E
A
A
S
I
C
G
T
D
L
--------
H
I
W
K
W
D
A
W
A
R
----
G
R
I
R
P
P
L
V
T
G
H
E
F
S
G
-
V
V
E
A
V
G
P
----
G
V
------
R
R
P
Q
V
G
D
H
V
S
L
E
S
H
I
V
C
H
A
C
P
A
C
R
T
G
N
Y
-
H
V
C
L
N
T
Q
I
L
G
V
-
D
R
D
--------
G
G
F
A
E
Y
V
V
V
-
P
A
E
N
A
W
V
-------
N
P
K
D
L
P
F
E
V
-
A
A
I
L
E
P
F
G
N
A
V
H
T
V
Y
A
G
----
S
G
---
V
-
S
G
K
S
-----
V
-
L
I
T
G
A
G
P
I
G
L
M
A
A
M
V
V
R
A
S
G
A
G
P
I
L
V
S
D
P
N
P
Y
R
L
A
F
A
R
P
Y
A
D
R
L
V
N
P
L
E
------
E
D
L
L
E
V
V
R
R
V
T
-----
G
S
G
V
--
E
V
L
L
E
F
S
G
N
E
A
A
I
---
H
Q
G
L
M
A
L
I
P
G
G
E
A
R
I
--
L
G
I
P
S
D
P
--
I
R
F
--
D
-
L
A
G
E
L
V
-
M
R
G
I
T
A
F
G
I
A
G
R
R
----
L
W
Q
T
------
W
M
Q
G
T
A
L
V
Y
S
G
R
V
D
L
S
P
L
L
T
H
R
L
-
P
-
L
S
R
Y
R
E
A
F
-
G
L
L
A
S
G
Q
A
-
V
K
V
I
L
D
P
25
PsiBlast_CBE
76.99
47%
-109
- C1 -
2DQ4
3
TDH_THET8
B:
[1-341]
-----
M
R
A
L
A
K
L
A
P
E
E
G
L
T
-
L
V
D
R
P
V
P
E
P
-
G
P
-
G
--
E
I
L
V
R
V
E
A
A
S
I
C
G
T
D
L
--------
H
I
W
K
W
D
A
W
A
R
----
G
R
I
R
P
P
L
V
T
G
H
E
F
S
G
-
V
V
E
A
V
G
P
----
G
V
------
R
R
P
Q
V
G
D
H
V
S
L
E
S
H
I
V
C
H
A
C
P
A
C
R
T
G
N
Y
-
H
V
C
L
N
T
Q
I
L
G
V
-
D
R
D
--------
G
G
F
A
E
Y
V
V
V
-
P
A
E
N
A
W
V
-------
N
P
K
D
L
P
F
E
V
-
A
A
I
L
E
P
F
G
N
A
V
H
T
V
Y
A
G
----
S
G
---
V
-
S
G
K
S
-----
V
-
L
I
T
G
A
G
P
I
G
L
M
A
A
M
V
V
R
A
S
G
A
G
P
I
L
V
S
D
P
N
P
Y
R
L
A
F
A
R
P
Y
A
D
R
L
V
N
P
L
E
------
E
D
L
L
E
V
V
R
R
V
T
-----
G
S
G
V
--
E
V
L
L
E
F
S
G
N
E
A
A
I
---
H
Q
G
L
M
A
L
I
P
G
G
E
A
R
I
--
L
G
I
P
S
D
P
--
I
R
F
--
D
-
L
A
G
E
L
V
-
M
R
G
I
T
A
F
G
I
A
G
R
R
----
L
W
Q
T
------
W
M
Q
G
T
A
L
V
Y
S
G
R
V
D
L
S
P
L
L
T
H
R
L
-
P
-
L
S
R
Y
R
E
A
F
-
G
L
L
A
S
G
Q
A
-
V
K
V
I
L
D
P
5
PsiBlast_PDB
76.71
47%
-108
- C1 -
2EJV
4
TDH_THET8
A:
[1-341]
-----
M
R
A
L
A
K
L
A
P
E
E
G
L
T
-
L
V
D
R
P
V
P
E
P
-
G
P
-
G
--
E
I
L
V
R
V
E
A
A
S
I
C
G
T
D
L
--------
H
I
W
K
W
D
A
W
A
R
----
G
R
I
R
P
P
L
V
T
G
H
E
F
S
G
-
V
V
E
A
V
G
P
----
G
V
------
R
R
P
Q
V
G
D
H
V
S
L
E
S
H
I
V
C
H
A
C
P
A
C
R
T
G
N
Y
-
H
V
C
L
N
T
Q
I
L
G
V
-
D
R
D
--------
G
G
F
A
E
Y
V
V
V
-
P
A
E
N
A
W
V
-------
N
P
K
D
L
P
F
E
V
-
A
A
I
L
E
P
F
G
N
A
V
H
T
V
Y
A
G
----
S
G
---
V
-
S
G
K
S
-----
V
-
L
I
T
G
A
G
P
I
G
L
M
A
A
M
V
V
R
A
S
G
A
G
P
I
L
V
S
D
P
N
P
Y
R
L
A
F
A
R
P
Y
A
D
R
L
V
N
P
L
E
------
E
D
L
L
E
V
V
R
R
V
T
-----
G
S
G
V
--
E
V
L
L
E
F
S
G
N
E
A
A
I
---
H
Q
G
L
M
A
L
I
P
G
G
E
A
R
I
--
L
G
I
P
S
D
P
--
I
R
F
--
D
-
L
A
G
E
L
V
-
M
R
G
I
T
A
F
G
I
A
G
R
R
----
L
W
Q
T
------
W
M
Q
G
T
A
L
V
Y
S
G
R
V
D
L
S
P
L
L
T
H
R
L
-
P
-
L
S
R
Y
R
E
A
F
-
G
L
L
A
S
G
Q
A
-
V
K
V
I
L
D
P
4
PsiBlast_PDB
75.84
47%
-108
- C1 -
2DQ4
3
TDH_THET8
A:
[1-341]
-----
M
R
A
L
A
K
L
A
P
E
E
G
L
T
-
L
V
D
R
P
V
P
E
P
-
G
P
-
G
--
E
I
L
V
R
V
E
A
A
S
I
C
G
T
D
L
--------
H
I
W
K
W
D
A
W
A
R
----
G
R
I
R
P
P
L
V
T
G
H
E
F
S
G
-
V
V
E
A
V
G
P
----
G
V
------
R
R
P
Q
V
G
D
H
V
S
L
E
S
H
I
V
C
H
A
C
P
A
C
R
T
G
N
Y
-
H
V
C
L
N
T
Q
I
L
G
V
-
D
R
D
--------
G
G
F
A
E
Y
V
V
V
-
P
A
E
N
A
W
V
-------
N
P
K
D
L
P
F
E
V
-
A
A
I
L
E
P
F
G
N
A
V
H
T
V
Y
A
G
----
S
G
---
V
-
S
G
K
S
-----
V
-
L
I
T
G
A
G
P
I
G
L
M
A
A
M
V
V
R
A
S
G
A
G
P
I
L
V
S
D
P
N
P
Y
R
L
A
F
A
R
P
Y
A
D
R
L
V
N
P
L
E
------
E
D
L
L
E
V
V
R
R
V
T
-----
G
S
G
V
--
E
V
L
L
E
F
S
G
N
E
A
A
I
---
H
Q
G
L
M
A
L
I
P
G
G
E
A
R
I
--
L
G
I
P
S
D
P
--
I
R
F
--
D
-
L
A
G
E
L
V
-
M
R
G
I
T
A
F
G
I
A
G
R
R
----
L
W
Q
T
------
W
M
Q
G
T
A
L
V
Y
S
G
R
V
D
L
S
P
L
L
T
H
R
L
-
P
-
L
S
R
Y
R
E
A
F
-
G
L
L
A
S
G
Q
A
-
V
K
V
I
L
D
P
11
PsiBlast_PDB
72.14
30%
-123
- C1 -
1E3J
4
?
A:
[4-336]
---
D
N
L
S
A
V
L
Y
K
Q
N
D
L
R
---
L
E
Q
R
P
I
P
E
P
-
K
E
-
D
--
E
V
L
L
Q
M
A
Y
V
G
I
C
G
S
D
V
--------
H
Y
Y
E
H
G
R
I
A
D
----
F
I
V
K
D
P
M
V
I
G
H
E
A
S
G
-
T
V
V
K
V
G
K
----
N
V
------
K
H
L
K
K
G
D
R
V
A
V
E
P
G
V
P
C
R
R
C
Q
F
C
K
E
G
K
Y
-
N
L
C
P
D
L
T
F
C
A
T
P
P
D
D
--------
G
N
L
A
R
Y
Y
V
H
-
A
A
D
F
C
H
K
-------
L
P
D
N
V
S
L
E
E
-
G
A
L
L
E
P
L
S
V
G
V
H
A
C
R
R
A
----
G
V
---
Q
-
L
G
T
T
-----
V
L
V
I
-
G
A
G
P
I
G
L
V
S
V
L
A
A
K
A
Y
G
A
F
-
V
V
C
T
A
R
S
P
R
R
L
E
V
A
K
N
C
G
A
D
V
T
L
V
V
D
PA
K
---
E
E
E
S
S
I
I
E
R
I
R
--
S
A
I
G
D
L
P
--
N
V
T
I
D
C
S
G
N
E
K
C
I
---
T
I
G
I
N
I
T
R
T
G
G
T
L
M
L
--
V
G
M
G
S
Q
M
--
V
T
V
--
P
-
L
V
N
A
C
A
--
R
E
I
D
I
K
S
V
F
--
R
----
Y
C
N
D
------
Y
P
I
A
L
E
M
V
A
S
G
R
C
N
V
K
Q
L
V
T
H
S
F
-
K
-
L
E
Q
T
V
D
A
F
-
E
A
A
R
------------
102
HHSearch
69.47
29%
-112
- C1 -
4UEJ
4
GATD_ECOLI
A:
[1-346]
-----
M
K
S
V
V
N
D
T
D
G
I
-
V
R
-
V
A
E
S
V
I
P
E
I
K
H
Q
-
D
--
E
V
R
V
K
I
A
S
S
G
L
C
G
S
D
L
--------
P
R
I
F
K
N
G
--------
A
H
Y
Y
P
I
T
L
G
H
E
F
S
G
-
Y
I
D
A
V
G
S
----
G
V
------
D
D
L
H
P
G
D
A
V
A
C
V
P
L
L
P
C
F
T
C
P
E
C
L
K
G
F
Y
-
S
Q
C
A
K
Y
D
F
I
G
S
-
R
R
D
--------
G
G
F
A
E
Y
I
V
V
-
K
R
K
N
V
F
A
-------
L
P
T
D
M
P
I
E
D
G
A
F
I
E
-
P
I
T
V
G
L
H
A
F
H
L
A
Q---
G
C
---
E
-
N
K
N
V
-----
I
-
I
I
-
G
A
G
T
I
G
L
L
A
I
Q
C
A
V
A
L
G
A
K
S
V
T
A
I
D
I
S
S
E
K
L
A
L
A
K
S
F
G
A
M
Q
T
F
N
S
S
--
E
---
M
S
A
P
Q
M
Q
S
V
L
R
--
E
--
L
R
F
N
--
Q
L
I
L
E
T
A
G
V
P
Q
T
V
---
E
L
A
V
E
I
A
G
P
H
A
Q
L
A
L
--
V
G
T
L
H
Q
D
--
L
H
L
T
S
A
-
T
F
G
K
I
L
-
R
K
E
L
T
V
I
G
S
W
M
N
Y
SSPW
P
G
Q
E
------
W
E
T
A
S
R
L
L
T
E
R
K
L
S
L
E
P
L
I
A
H
R
G
-
S
-
F
E
S
F
A
Q
A
V
-
R
D
I
A
R
N
A
M
P
G
K
V
L
L
I
P
95
HHSearch
69.46
30%
-122
- C1 -
4EJ6
19
?
A:
[21-361]
--
Q
S
M
M
K
A
V
R
L
E
S
V
G
N
-
I
S
-
V
R
N
V
G
I
P
E
P
-
G
P
-
D
--
D
L
L
V
K
V
E
A
C
G
I
C
G
T
D
R
--------
H
L
L
H
G
E
F
P
--------
S
T
P
P
V
T
L
G
H
E
F
C
G
-
I
V
V
E
A
G
S
----
A
V
------
R
D
I
A
P
G
A
R
I
T
G
D
P
N
I
S
C
G
R
C
P
Q
C
Q
A
G
R
V
-
N
L
C
R
N
L
R
A
I
G
I
-
H
R
D
--------
G
G
F
A
E
Y
V
L
V
-
P
R
K
Q
A
F
E
-------
I
P
L
T
L
D
P
V
H
-
G
A
F
C
E
P
L
A
C
C
L
H
G
V
D
L
S
G---
I
K
---
A
-
G
S
T
V
-----
A
-
I
L
-
G
G
G
V
I
G
L
L
T
V
Q
L
A
R
L
A
G
A
T
T
V
I
L
S
T
R
Q
A
T
K
R
R
L
A
E
E
V
G
A
T
A
T
V
D
P
S
--
A
---
G
D
V
V
E
A
I
A
G
P
V
GL
V
--
P
G
G
V
--
D
V
V
I
E
C
A
G
V
A
E
T
V
---
K
Q
S
T
R
L
A
K
A
G
G
T
V
V
I
--
L
G
V
L
P
Q
G
--
E
K
V
--
E
I
E
P
F
D
I
L
-
F
R
E
L
R
V
L
G
S
F
I
N
------
P
F
V
------
H
R
R
A
A
D
L
V
A
T
G
A
I
E
I
D
R
M
I
S
R
R
I
-
S
-
L
D
E
A
P
D
V
I
-
S
N
P
A
A
A
G
E
-
V
K
V
L
V
I
-
19
PsiBlast_PDB
65.48
29%
-116
- C1 -
4UEJ
4
GATD_ECOLI
A:
[14-346]
--------------------
V
A
E
S
V
I
P
E
I
--
K
-
H
QD
E
V
R
V
K
I
A
S
S
G
L
C
G
S
D
L
P
R
I
FKNGA
H
Y
Y
----------------
P
I
T
L
G
H
E
F
S
G
-
Y
I
D
A
V
G
S
----
G
V
------
D
D
L
H
P
G
D
A
V
A
C
V
P
L
L
P
C
F
T
C
P
E
C
L
K
G
F
Y
-
S
Q
C
A
K
Y
D
F
I
G
S
-
R
R
D
--------
G
G
F
A
E
Y
I
V
V
-
K
R
K
N
V
F
A
-------
L
P
T
D
M
P
I
E
D
-
G
A
F
I
E
P
I
T
V
G
L
H
A
F
H
L
A
----
Q
G
---
C
E
N
K
N
V
-----
I
-
I
I
-
G
A
G
T
I
G
L
L
A
I
Q
C
A
V
A
L
G
A
K
S
V
T
A
I
D
I
S
S
E
K
L
A
L
A
K
S
F
G
A
M
Q
T
F
N
S
S
--
E
---
M
S
A
P
Q
M
Q
S
V
L
R
--
E
--
L
R
F
N
--
Q
L
I
L
E
T
A
G
V
P
Q
T
V
---
E
L
A
V
E
I
A
G
P
H
A
Q
L
A
L
--
V
G
T
L
H
Q
D
L
H
L
T
S
--
A
-
T
F
G
K
I
L
-
R
K
E
L
T
V
I
G
--
S
W
M
----
N
Y
S
S
PWPG
Q
E
W
E
T
A
S
R
L
L
T
E
R
K
L
S
L
E
P
L
I
A
H
R
G
-
S
-
F
E
S
F
A
Q
A
V
R
D
I
A
R
N
A
M
P
-
G
K
V
L
L
I
P
20
PsiBlast_PDB
64.66
29%
-117
- C1 -
4UEK
4
GATD_ECOLI
A:
[14-346]
--------------------
V
A
E
S
V
I
P
E
I
--
K
-
H
QD
E
V
R
V
K
I
A
S
S
G
L
C
G
S
D
L
P
R
I
FKNGA
H
Y
Y
----------------
P
I
T
L
G
H
E
F
S
G
-
Y
I
D
A
V
G
S
----
G
V
------
D
D
L
H
P
G
D
A
V
A
C
V
P
L
L
P
C
F
T
C
P
E
C
L
K
G
F
Y
-
S
Q
C
A
K
Y
D
F
I
G
S
-
R
R
D
--------
G
G
F
A
E
Y
I
V
V
-
K
R
K
N
V
F
A
-------
L
P
T
D
M
P
I
E
D
-
G
A
F
I
E
P
I
T
V
G
L
H
A
F
H
L
A
----
Q
G
---
C
E
N
K
N
V
-----
I
-
I
I
-
G
A
G
T
I
G
L
L
A
I
Q
C
A
V
A
L
G
A
K
S
V
T
A
I
D
I
S
S
E
K
L
A
L
A
K
S
F
G
A
M
Q
T
F
N
S
S
--
E
---
M
S
A
P
Q
M
Q
S
V
L
R
--
E
--
L
R
F
N
--
Q
L
I
L
E
T
A
G
V
P
Q
T
V
---
E
L
A
V
E
I
A
G
P
H
A
Q
L
A
L
--
V
G
T
L
H
Q
D
L
H
L
T
S
--
A
-
T
F
G
K
I
L
-
R
K
E
L
T
V
I
G
--
S
W
M
----
N
Y
S
S
PWPG
Q
E
W
E
T
A
S
R
L
L
T
E
R
K
L
S
L
E
P
L
I
A
H
R
G
-
S
-
F
E
S
F
A
Q
A
V
R
D
I
A
R
N
A
M
P
-
G
K
V
L
L
I
P
16
PsiBlast_PDB
64.30
31%
-110
- C1 -
3IP1
4
?
A:
[26-387]
--
E
G
K
L
T
W
L
G
S
K
V
W
R
Y
P
E
V
R
V
E
E
V
P
E
P
R
I
-
E
K
P
T
--
E
I
I
I
K
V
K
A
C
G
I
C
G
S
D
V
--------
H
M
A
Q
T
D
E
E
G
Y
ILYP
G
L
T
G
F
P
V
T
L
G
H
E
F
S
G
-
V
V
V
E
A
G
P
----
E
A
INRRTN
K
R
F
E
I
G
E
P
V
C
A
E
E
M
L
W
C
G
H
C
R
P
C
A
E
G
F
P
-
N
H
C
E
N
L
N
E
L
G
F
-
N
V
D
--------
G
A
F
A
E
Y
V
K
V
-
D
A
K
Y
A
W
S
LRELEGV
Y
E
G
D
R
L
F
L
A
-
G
S
L
V
E
P
T
S
V
A
Y
N
A
V
I
V
R
GGGI
R
P
-----
G
D
N
V
-----
V
-
I
L
-
G
G
G
P
I
G
L
A
A
V
A
I
L
K
H
A
G
A
S
K
V
I
L
S
E
P
S
E
V
R
R
N
L
A
K
E
L
G
A
D
H
V
I
D
P
T
--
K
---
E
N
F
V
E
A
V
L
D
Y
T
--
N
--
G
L
G
A
--
K
L
F
L
E
A
T
G
V
P
Q
L
V
W
P
Q
I
E
E
V
I
W
R
A
R
G
I
N
A
T
V
--
A
I
V
A
R
A
D
--
A
K
I
--
P
-
L
T
G
E
V
F
Q
V
R
R
A
Q
I
V
G
S
Q
G
H
S
----
G
H
G
T
------
F
P
R
V
I
S
L
M
A
S
G
M
-
D
M
T
K
I
I
S
K
T
V
-
S
-
M
E
E
I
P
E
Y
I
-
K
R
L
Q
T
D
K
---------
7
PsiBlast_PDB
64.02
29%
-115
- C1 -
1VJ0
3
?
A:
[31-378]
------------------
V
-
Y
K
E
F
E
I
S
D
I
-
P
R
-
G
--
S
I
L
V
E
I
L
S
A
G
V
C
G
S
D
V
--------
H
M
F
R
G
E
D
-------
P
R
V
P
L
P
I
I
L
G
H
E
G
A
G
R
V
V
E
V
N
G
E
K
R
D
L
N
G
------
E
L
L
K
P
G
D
L
I
V
W
N
R
G
I
T
C
G
E
C
Y
W
C
K
V
S
K
E
P
Y
L
C
P
N
R
K
V
Y
G
I
-
N
R
G
CSEYPHLR
G
C
Y
S
S
H
I
V
L
D
P
E
T
D
V
L
K
-------
V
S
E
K
D
D
L
D
V
-
L
A
M
A
M
C
S
G
A
T
A
Y
H
A
F
D
E
----
Y
P
ESF
A
-
G
K
T
V
-----
V
-
I
Q
-
G
A
G
P
L
G
L
F
G
V
V
I
A
R
S
L
G
A
E
N
V
I
V
I
A
G
S
P
N
R
L
K
L
A
E
E
I
G
A
D
L
T
L
N
R
R
--
E
TS
V
E
E
R
R
K
A
I
M
D
I
T
--
H
--
G
R
G
A
--
D
F
I
L
E
A
T
G
D
S
R
A
L
---
L
E
G
S
E
L
L
R
R
G
G
F
Y
S
V
A
G
V
A
V
P
Q
D
P
--
V
P
F
--
K
-
V
Y
E
W
L
V
-
L
K
N
A
T
F
K
G
I
W
V
S
D
----
T
S
H
F
------
V
K
T
V
S
-
I
T
S
R
N
Y
Q
L
L
S
K
L
I
T
H
R
L
-
P
-
L
K
E
A
N
K
A
L
-
E
L
M
E
S
R
E
A
-
L
K
V
I
L
Y
P
14
PsiBlast_PDB
63.55
29%
-120
- C1 -
1PL6
3
DHSO_HUMAN
A:
[21-347]
--------------------
L
E
N
Y
P
I
P
E
P
-
G
P
-
N
--
E
V
L
L
R
M
H
S
V
G
I
C
G
S
D
V
--------
H
Y
W
E
Y
G
R
I
G
N
----
F
I
V
K
K
P
M
V
L
G
H
E
A
S
G
-
T
V
E
K
V
G
S
----
S
V
------
K
H
L
K
P
G
D
R
V
A
I
E
P
G
A
P
R
E
N
D
E
F
C
K
M
G
R
Y
-
N
L
S
P
S
I
F
F
C
A
T
P
P
D
D
--------
G
N
L
C
R
F
Y
K
H
-
N
A
A
F
C
Y
K
-------
L
P
D
N
V
T
F
E
E
-
G
A
L
I
E
P
L
S
V
G
I
H
A
C
R
R
------------
G
G
V
T
LG
H
K
V
L
-
V
C
-
G
A
G
P
I
G
M
V
T
L
L
V
A
K
A
M
G
A
A
Q
V
V
V
T
D
L
S
A
T
R
L
S
K
A
K
E
I
G
A
D
L
V
L
Q
I
S
--
K
---
E
S
P
Q
E
I
A
R
K
V
E
--
G
--
Q
L
G
C
KP
E
V
T
I
E
C
T
G
A
E
A
S
I
---
Q
A
G
I
Y
A
T
R
S
G
G
T
L
V
L
--
V
G
L
G
S
E
M
--
T
T
V
--
P
-
L
L
H
A
A
I
--
R
E
V
D
I
K
G
V
F
--
R
----
Y
C
N
T
------
W
P
V
A
I
S
M
L
A
S
K
S
V
N
V
K
P
L
V
T
H
R
F
-
P
-
L
E
K
A
L
E
A
F
-
E
T
F
K
K
G
L
G
-
L
K
I
M
L
--