@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 : B0VU36: (2017-12-16 )
MSKCWHDSICPFLIFKINRELLMSNSHVDVIVLGAGASGLMLAAHAAKRGRSVLILEKANKIGKKILMSGGGKCNFTNLYVEPENYISHNPHFVISALSRYSNWDFIGLVCDYGIAYEERKHGQLFTLNGAKEILEMLVSECNKTNNVEIQTHCKVGEIDLLEQGGFSVHTNQGRFSCESLVVATGGLSIPTLGGSGFGYELAQKFGHTVFPTRAGLVPFTFSDHIKEVTTRLSGNALDVTLTNSKNSFTEALLFTHRGLSGPSSLQLSNYWNTGESFKIDFFPSQDLATYLKDKKKAQPKVLLRTLLNEFTAKSIVQELQQLIWPEQSETPIGNISDAQLEHIAEQLHGFTVKPSGTEGYRTAEVTLGGIDTTEVSSKTFESKKQKGLFFIGEVLDVTGHLGGYNFQWAWSSAYAAAQYV
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.......350.......360.......370.......380.......390.......400.......410.......420----
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MSKCWHDSI
C
P
F
L
I
F
KI
N
R
E
L
LMSNSH
V
D
V
I
V
LGAGAS
G
L
M
L
A
A
H
A
AKRG
R
S
V
L
I
L
E
K
A
N
K
I
G
K
K
I
L
MSGGGK
C
N
F
T
N
--
L
Y
VE---PE--NYI---SHNP
H
F
V
I
S
A
L
S
RYSNW
D
F
I
G
L
VCDYGIAYEERKHG
Q
L
F
T
L-N-
G
-
A
K
----
E
I
L
E
M
L
V
S
ECNKT--N
N
V
E
I
Q
T
H
C
KVG
E
I
D
--------
L
L
---E-QGG
F
S
-
V
HT-NQGRFSC
E
S
L
V
V
ATGGLSIPTLGGSGF
G
Y
E
L
A
Q
K
FGHTV---FPTRAG
L
V
---PF
T
F
S
D
H
I
K
E
V
T
---
T
--RLSG
N
A
L
---
D
V
T
L
TN-SK--N---
S
F
T
E
A
L
L
F
THRGLSGPS
S
L
Q
L
SNYWNTG-E--------
S
F
--------
K
-------
I
D
F
FP---
S
---
Q
---
D
L
A
T
Y
L
K
D
KKKA
Q
P
K
V
L
L
R
T
L
L
N
E
F
T
A
K
S
---
I
V
Q
E
L
Q
Q
L
IWPEQ---SET--PIGNI
S
D
A
Q
L
E
H
I
A
E
Q
LH
G
F
T
VKPSGTEG
Y
R
T
A
E
V
T
LGGIDTTEVS
S
K
T
F
E
S
K
KQKG
L
F
F
I
G
E
V
L
D
VTGHLGGY
N
F
Q
W
A
WSSAYAAAQYV-----
121
HHSearch
76.27
50%
-51
- C3 -
-
2GQF
1
Y933_HAEIN
A:
[2-398]
------------------------
S
Q
Y
S
E
N
I
I
I
G
A
G
A
A
G
L
F
C
A
A
Q
L
A
K
L
G
K
S
V
T
V
F
D
N
G
K
K
I
G
R
K
I
L
M
S
G
G
G
F
C
N
F
T
N
--
L
E
V
T
---
P
A
--
H
Y
L
---
S
Q
N
P
H
F
V
K
S
A
L
A
R
Y
T
N
W
D
F
I
S
L
V
A
E
Q
G
I
T
Y
H
E
K
E
L
G
Q
L
F
C
D
-
E
-
G
-
A
E
----
Q
I
V
E
M
L
K
S
E
C
D
K
---
Y
G
A
K
I
L
L
R
S
E
V
S
Q
V
E
--------
R
I
---
Q
N
D
E
K
V
R
F
V
L
Q
V
N
S
T
Q
W
Q
C
K
N
L
I
V
A
T
G
G
L
S
M
P
G
L
G
A
T
P
F
G
Y
Q
I
A
E
Q
F
G
I
P
V
---
I
P
P
R
A
S
L
V
---
P
F
T
Y
R
E
T
D
-
K
F
L
---
T
--
A
L
S
G
I
S
L
---
P
V
T
I
T
A
L
C
G
--
K
---
S
F
Y
N
Q
L
L
F
T
H
R
G
I
S
G
P
A
V
L
Q
I
S
N
Y
W
Q
P
T
-
E
--------
S
V
--------
E
-------
I
D
L
L
P
---
N
---
H
---
N
V
E
E
E
I
N
Q
A
K
Q
S
S
P
K
Q
M
L
K
T
I
L
V
R
L
L
P
K
K
---
L
V
E
L
W
I
E
Q
-
G
I
V
----
Q
D
E
--
V
I
A
N
I
S
K
V
R
V
K
N
L
V
D
F
I
H
H
W
E
F
T
P
N
G
T
E
G
Y
R
T
A
E
V
T
M
G
G
V
D
T
K
V
I
S
S
K
T
M
E
S
N
Q
V
S
G
L
Y
F
I
G
E
V
L
D
V
T
G
W
L
G
G
Y
N
F
Q
W
A
W
S
S
A
Y
A
C
A
L
S
I
-----
1
PsiBlast_PDB
74.97
50%
-46
- C3 -
-
2GQF
1
Y933_HAEIN
A:
[8-395]
------------------------------
I
I
I
G
A
G
A
A
G
L
F
C
A
A
Q
L
A
K
L
G
K
S
V
T
V
F
D
N
G
K
K
I
G
R
K
I
L
M
S
G
G
G
F
C
N
F
T
N
--
L
E
V
T
---
P
A
--
H
Y
L
---
S
Q
N
P
H
F
V
K
S
A
L
A
R
Y
T
N
W
D
F
I
S
L
V
A
E
Q
G
I
T
Y
H
E
K
E
L
G
Q
L
F
C
D
-
E
-
G
-
A
E
----
Q
I
V
E
M
L
K
S
E
C
D
K
Y
---
G
A
K
I
L
L
R
S
E
V
S
Q
V
E
--------
R
I
Q
ND
E
-
K
V
R
F
V
-
L
Q
V
-
N
S
T
Q
W
Q
C
K
N
L
I
V
A
T
G
G
L
S
M
P
G
L
G
A
T
P
F
G
Y
Q
I
A
E
Q
F
G
I
P
V
---
I
P
P
R
A
S
L
V
---
P
F
T
Y
R
E
T
D
K
F
L
T
---
A
---
L
S
G
I
S
L
---
P
V
T
I
T
A
L
C
G
--
K
---
S
F
Y
N
Q
L
L
F
T
H
R
G
I
S
G
P
A
V
L
Q
I
S
N
Y
W
Q
P
T
-
E
--------
S
V
--------
E
-------
I
D
L
L
P
---
N
---
H
---
N
V
E
E
E
I
N
Q
A
K
Q
S
S
P
K
Q
M
L
K
T
I
L
V
R
L
L
P
K
K
---
L
V
E
-----
L
W
I
E
Q
GI
V
Q
D
E
--
V
I
A
N
I
S
K
V
R
V
K
N
L
V
D
F
I
H
H
W
E
F
T
P
N
G
T
E
G
Y
R
T
A
E
V
T
M
G
G
V
D
T
K
V
I
S
S
K
T
M
E
S
N
Q
V
S
G
L
Y
F
I
G
E
V
L
D
V
T
G
W
L
G
G
Y
N
F
Q
W
A
W
S
S
A
Y
A
C
A
--------
119
HHSearch
71.76
43%
-62
- C3 -
-
3V76
1
?
A:
[28-417]
---------------------------
Q
D
V
V
I
I
G
A
G
A
A
G
M
M
C
A
I
E
A
G
K
R
G
R
R
V
L
V
I
D
H
A
R
A
P
G
E
K
I
R
I
S
G
G
G
R
C
N
F
T
N
--
I
H
A
S
---
P
R
--
N
F
L
---
S
G
N
P
H
F
C
K
S
A
L
A
R
Y
R
P
Q
D
F
V
A
L
V
E
R
H
G
I
G
W
H
E
K
T
L
G
Q
L
F
C
D
-
H
-
S
-
A
K
----
D
I
I
R
M
L
M
A
E
M
K
E
---
A
G
V
Q
L
R
L
E
T
S
I
G
E
V
E
--------
R
T
-----
A
S
G
F
R
-
V
T
T
-
S
A
G
T
V
D
A
A
S
L
V
V
A
S
G
G
K
S
I
P
K
M
G
A
T
G
L
A
Y
R
I
A
E
Q
F
G
L
P
V
---
V
E
T
R
P
A
L
V
---
P
L
T
L
D
Q
A
---
Q
L
A
K
L
G
--
A
L
A
G
V
A
A
---
D
A
E
A
R
F
-
G
K
--
A
---
A
F
R
E
A
V
L
I
T
H
R
G
L
S
G
P
A
I
L
Q
I
S
S
Y
W
R
E
G
-
E
--------
E
I
--------
V
-------
L
R
L
M
P
---
D
---
I
---
D
I
A
S
I
L
K
G
M
R
R
A
N
G
R
Q
A
V
Q
T
A
L
A
D
I
L
P
R
R
---
L
A
Q
F
F
A
D
E
A
K
L
T
-----
G
R
--
M
L
A
D
L
S
D
K
T
I
D
A
L
A
S
S
I
Q
V
W
A
V
K
P
A
G
S
E
G
Y
R
T
A
E
V
T
L
G
G
V
D
T
R
A
L
D
S
R
T
M
Q
A
K
E
V
P
G
L
Y
F
V
G
E
C
V
D
V
T
G
W
L
G
G
Y
N
F
Q
W
A
W
A
S
G
F
V
A
G
Q
D
V
-----
2
PsiBlast_PDB
66.17
43%
-67
- C3 -
-
3V76
1
?
A:
[45-417]
--------------------------------------------
E
A
G
K
R
G
R
R
V
L
V
I
D
H
A
R
A
P
G
E
K
I
R
I
S
G
G
G
R
C
N
F
T
N
--
I
H
A
S
---
P
R
--
N
F
L
---
S
G
N
P
H
F
C
K
S
A
L
A
R
Y
R
P
Q
D
F
V
A
L
V
E
R
H
G
I
G
W
H
E
K
T
L
G
Q
L
F
C
D
-
H
-
S
-
A
K
----
D
I
I
R
M
L
M
A
E
-
M
K
E
--
A
G
V
Q
L
R
L
E
T
S
I
G
E
V
E
--------
R
T
---
A
-
S
-
G
F
R
-
V
T
T
-
S
A
G
T
V
D
A
A
S
L
V
V
A
S
G
G
K
S
I
P
K
M
G
A
T
G
L
A
Y
R
I
A
E
Q
F
G
L
P
V
---
V
E
T
R
P
A
L
V
---
P
L
T
L
D
Q
A
Q
L
A
K
L
---
G
--
A
L
A
G
V
A
A
---
D
A
E
A
R
F
-
G
K
--
A
---
A
F
R
E
A
V
L
I
T
H
R
G
L
S
G
P
A
I
L
Q
I
S
S
Y
W
R
E
G
-
E
--------
E
I
--------
V
-------
L
R
L
M
P
---
D
---
I
---
D
I
A
S
I
L
K
G
M
R
R
A
N
G
R
Q
A
V
Q
T
A
L
A
D
I
-------
L
P
R
R
L
A
Q
F
F
A
D
E
A
---
K
L
T
GR
M
L
A
D
L
S
D
K
T
I
D
A
L
A
S
S
I
Q
V
W
A
V
K
P
A
G
S
E
G
Y
R
T
A
E
V
T
L
G
G
V
D
T
R
A
L
D
S
R
T
M
Q
A
K
E
V
P
G
L
Y
F
V
G
E
C
V
D
V
T
G
W
L
G
G
Y
N
F
Q
W
A
W
A
S
G
F
V
A
G
Q
D
V
-----
120
HHSearch
61.05
32%
5
- C3 -
-
2I0Z
1
?
A:
[25-439]
-------------------------
M
H
Y
D
V
I
V
I
G
G
G
P
S
G
L
M
A
A
I
G
A
A
E
E
G
A
N
V
L
L
L
D
K
G
N
K
L
G
R
K
L
A
I
S
G
G
G
R
C
N
V
T
N
--
R
L
P
L
D
E
I
V
K
--
H
I
P
---
G
-
N
G
R
F
L
Y
S
A
F
S
I
F
N
N
E
D
I
I
T
F
F
E
N
L
G
V
K
L
K
E
E
D
H
G
R
M
F
P
V
-
S
N
K
-
A
Q
----
S
V
V
D
A
L
L
T
R
L
K
D
---
L
G
V
K
I
R
T
N
T
P
V
E
T
I
E
--------
Y
E
-----
N
G
Q
T
K
A
V
I
L
Q
T
G
E
V
L
E
T
N
H
V
V
I
A
V
G
G
K
S
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P
Q
T
G
S
T
G
D
G
Y
A
W
A
E
K
A
G
H
T
I
---
T
E
L
F
P
T
E
V
---
P
I
L
S
N
E
P
---
F
I
---
R
D
R
S
L
Q
G
L
A
L
R
--
D
I
N
L
S
V
-
L
N
A
I
I
---
S
H
K
M
D
M
L
F
T
H
F
G
L
S
G
P
A
A
L
R
C
S
Q
F
V
V
K
A
-
L
K
K
F
KTN
T
I
Q
M
--------
S
-------
I
D
A
L
P
---
E
---
E
N
S
E
Q
L
F
Q
R
M
L
K
Q
M
K
E
D
P
K
K
G
I
K
N
V
L
K
G
Y
V
P
E
R
---
Y
F
L
F
L
L
E
K
N
E
I
D
----
G
S
E
--
Q
A
G
Q
V
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H
E
K
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R
A
L
V
K
D
F
K
E
F
T
V
N
V
N
G
T
Q
S
I
E
K
A
F
V
T
G
G
G
V
S
V
K
E
I
N
P
K
E
M
S
S
K
F
T
N
G
L
Y
F
C
G
E
V
L
D
I
H
G
Y
T
G
G
Y
N
I
T
S
A
L
V
T
G
R
I
A
G
T
T
A
-----
123
HHSearch
60.92
31%
-6
- C3 -
-
4CNK
8
?
B:
[2-389]
-------------------------
N
H
F
D
T
I
I
I
G
G
G
P
A
G
M
M
A
T
I
S
S
S
F
Y
G
Q
K
T
L
L
L
E
K
N
K
R
L
G
K
K
L
A
G
T
G
G
G
R
C
N
V
T
N
--
N
G
N
----
L
D
--
D
L
M
AGI
P
G
N
G
R
F
L
Y
S
V
F
S
Q
F
D
N
H
D
I
I
N
F
F
T
E
N
G
V
K
L
K
V
E
D
H
G
R
V
F
P
V
-
T
D
K
-
S
R
----
T
I
I
E
A
L
E
K
K
I
A
E
---
L
G
G
T
V
I
T
N
T
E
I
V
S
V
K
--------
K
T
-----
D
E
L
F
T
-
V
R
S
-
S
D
Q
A
W
T
C
Q
K
L
I
V
T
T
G
G
K
S
Y
P
S
T
G
S
T
G
F
G
H
D
I
A
R
H
F
K
H
T
V
---
T
D
L
E
A
A
E
S
---
P
L
L
T
D
F
----
P
H
---
K
--
A
L
Q
G
I
S
L
D--
D
V
T
L
S
Y
-
G
K
--
H
---
I
I
T
H
D
L
L
F
T
H
F
G
L
S
G
P
A
A
L
R
L
S
S
F
V
K
G
G
-
E
--------
T
I
--------
Y
-------
L
D
V
L
P
---
Q
---
M
SQQ
D
L
A
D
F
L
E
E
H
R
----
E
K
S
L
K
N
C
L
K
I
L
L
P
E
R
---
I
A
D
F
F
T
Q
P
F
--------
P
E
--
K
V
K
Q
L
N
L
S
E
K
E
A
L
I
K
Q
I
K
E
L
P
I
S
V
T
G
K
M
S
L
A
K
S
F
V
T
K
G
G
V
S
L
K
E
I
N
P
K
T
L
E
S
K
L
V
P
G
L
H
F
A
G
E
V
L
D
I
N
A
H
T
G
G
F
N
I
T
S
A
L
C
T
G
W
V
A
G
S
L
H
-----
122
HHSearch
60.33
31%
-3
- C3 -
-
4CNJ
1
?
D:
[2-389]
-------------------------
N
H
F
D
T
I
I
I
G
G
G
P
A
G
M
M
A
T
I
S
S
S
F
Y
G
Q
K
T
L
L
L
E
K
N
K
R
L
G
K
K
L
A
G
T
G
G
G
R
C
N
V
T
N
--
N
G
N
----
L
D
--
D
L
M
AGI
P
G
N
G
R
F
L
Y
S
V
F
S
Q
F
D
N
H
D
I
I
N
F
F
T
E
N
G
V
K
L
K
V
E
D
H
G
R
V
F
P
V
-
T
D
K
-
S
R
----
T
I
I
E
A
L
E
K
K
I
A
E
---
L
G
G
T
V
I
T
N
T
E
I
V
S
V
K
--------
K
T
-----
D
E
L
F
T
-
V
R
S
-
S
D
Q
A
W
T
C
Q
K
L
I
V
T
T
G
G
K
S
Y
P
S
T
G
S
T
G
F
G
H
D
I
A
R
H
F
K
H
T
V
---
T
D
L
E
A
A
E
S
---
P
L
L
T
D
F
----
P
H
---
K
--
A
L
Q
G
I
S
L
D--
D
V
T
L
S
Y
-
G
K
--
H
---
I
I
T
H
D
L
L
F
T
H
F
G
L
S
G
P
A
A
L
R
L
S
S
F
V
K
G
G
-
E
--------
T
I
--------
Y
-------
L
D
V
L
P
---
Q
---
M
SQQ
D
L
A
D
F
L
E
E
H
R
----
E
K
S
L
K
N
C
L
K
I
L
L
P
E
R
---
I
A
D
F
F
T
Q
P
F
--------
P
E
--
K
V
K
Q
L
N
L
S
E
K
E
A
L
I
K
Q
I
K
E
L
P
I
S
V
T
G
K
M
S
L
A
K
S
F
V
T
K
G
G
V
S
L
K
E
I
N
P
K
T
L
E
S
K
L
V
P
G
L
H
F
A
G
E
V
L
D
I
N
A
H
T
G
G
F
N
I
T
S
A
L
C
T
G
W
V
A
G
S
L
H
-----
4
PsiBlast_PDB
59.69
32%
9
- C3 -
-
4CNK
5
?
A:
[2-386]
-------------------------
N
H
F
D
T
I
I
I
G
G
G
P
A
G
M
M
A
T
I
S
S
S
F
Y
G
Q
K
T
L
L
L
E
K
N
K
R
L
G
K
K
L
A
G
T
G
G
G
R
C
N
V
T
N
NG
N
L
D
D
---
L
M
--
A
G
I
---
P
G
N
G
R
F
L
Y
S
V
F
S
Q
F
D
N
H
D
I
I
N
F
F
T
E
N
G
V
K
L
K
V
E
D
H
G
R
V
F
P
V
-
T
-
D
-
K
S
R
T
I
I
E
A
L
E
K
K
I
A
E
L
G
G
T
V
I
T
N
T
E
I
V
S
V
K
K
T
D
E
L
-------------------
F
T
-
V
R
S
-
S
D
Q
A
W
T
C
Q
K
L
I
V
T
T
G
G
K
S
Y
P
S
T
G
S
T
G
F
G
H
D
I
A
R
H
F
K
H
T
V
---
T
D
L
E
A
A
E
S
---
P
L
-
L
T
D
F
P
H
K
A
L
---
Q
--
G
I
S
L
D
-----
D
V
T
L
S
Y
-
G
K
--
H
---
I
I
T
H
D
L
L
F
T
H
F
G
L
S
G
P
A
A
L
R
L
S
S
F
V
K
G
G
-
E
--------
T
I
--------
Y
-------
L
D
V
L
P
QMS
Q
---
Q
---
D
L
A
D
F
L
E
E
H
R
E
K
S
L
K
N
C
L
K
I
L
L
P
E
R
I
A
D
F
---
F
T
Q
P
-----
F
P
E
K
---------
V
K
Q
L
N
L
S
E
K
E
A
L
I
K
Q
I
K
E
L
P
I
S
V
T
G
K
M
S
L
A
K
S
F
V
T
K
G
G
V
S
L
K
E
I
N
P
K
T
L
E
S
K
L
V
P
G
L
H
F
A
G
E
V
L
D
I
N
A
H
T
G
G
F
N
I
T
S
A
L
C
T
G
W
V
A
G
--------
21
PsiBlast_CBE
59.48
32%
11
- C3 -
-
4CNK
8
?
B:
[2-386]
-------------------------
N
H
F
D
T
I
I
I
G
G
G
P
A
G
M
M
A
T
I
S
S
S
F
Y
G
Q
K
T
L
L
L
E
K
N
K
R
L
G
K
K
L
A
G
T
G
G
G
R
C
N
V
T
N
NG
N
L
D
D
---
L
M
--
A
G
I
---
P
G
N
G
R
F
L
Y
S
V
F
S
Q
F
D
N
H
D
I
I
N
F
F
T
E
N
G
V
K
L
K
V
E
D
H
G
R
V
F
P
V
-
T
-
D
-
K
S
RTII
E
A
L
E
K
K
I
A
E
L
G
G
T
VI
T
N
T
E
I
V
S
V
K
K
T
D
E
L
-------------------
F
T
-
V
R
S
-
S
D
Q
A
W
T
C
Q
K
L
I
V
T
T
G
G
K
S
Y
P
S
T
G
S
T
G
F
G
H
D
I
A
R
H
F
K
H
T
V
---
T
D
L
E
A
A
E
S
---
P
L
-
L
T
D
F
P
H
K
A
L
---
Q
--
G
I
S
L
D
-----
D
V
T
L
S
Y
-
G
K
--
H
---
I
I
T
H
D
L
L
F
T
H
F
G
L
S
G
P
A
A
L
R
L
S
S
F
V
K
G
G
-
E
--------
T
I
--------
Y
-------
L
D
V
L
P
QMS
Q
---
Q
---
D
L
A
D
F
L
E
E
H
R
E
K
S
L
K
N
C
L
K
I
L
L
P
E
R
I
A
D
F
---
F
T
Q
P
-----
F
P
E
K
---------
V
K
Q
L
N
L
S
E
K
E
A
L
I
K
Q
I
K
E
L
P
I
S
V
T
G
K
M
S
L
A
K
S
F
V
T
K
G
G
V
S
L
K
E
I
N
P
K
T
L
E
S
K
L
V
P
G
L
H
F
A
G
E
V
L
D
I
N
A
H
T
G
G
F
N
I
T
S
A
L
C
T
G
W
V
A
G
--------
5
PsiBlast_PDB
59.33
32%
2
- C3 -
-
2I0Z
1
?
A:
[26-436]
--------------------------
H
Y
D
V
I
V
I
G
G
G
P
S
G
L
M
A
A
I
G
A
A
E
E
G
A
N
V
L
L
L
D
K
G
N
K
L
G
R
K
L
A
I
S
G
G
G
R
C
N
V
T
N
--
R
L
P
L
---
D
E
I
V
K
H
I
---
P
G
N
G
R
F
L
Y
S
A
F
S
I
F
N
N
E
D
I
I
T
F
F
E
N
L
G
V
K
L
K
E
E
D
H
G
R
M
F
P
V
S
N
-
K
-
A
Q
----
S
V
V
D
A
L
L
T
R
L
-
K
D
--
L
G
V
K
I
R
T
N
T
P
V
E
T
I
E
Y
E
NG
Q
T
K
A
V
I
---
L
-
Q
T
G
E
V
-
L
E
T
-
N
H
-------
V
V
I
A
V
G
G
K
S
V
P
Q
T
G
S
T
G
D
G
Y
A
W
A
E
K
A
G
H
T
I
T
E
L
F
P
T
E
V
P
I
L
S
NE
P
F
I
R
D
R
S
L
Q
G
L
A
---
L
--
R
----
D
I
---
N
L
S
V
L
N
------A
I
I
S
H
K
M
D
M
L
F
T
H
F
G
L
S
G
P
A
A
L
R
C
S
Q
F
V
V
K
A
L
K
--------
K
F
--------
K
TN
T
I
Q
M
S
I
D
A
L
P
EEN
S
---
E
---
Q
L
F
Q
R
M
L
K
Q
M
K
E
D
P
K
K
G
I
K
N
V
L
K
G
Y
V
P
E
R
Y
F
L
F
L
L
E
K
N
E
I
D
G
S
E
Q
---
A
------
G
Q
V
S
H
E
K
I
R
A
L
V
K
D
F
K
E
F
T
V
N
V
N
G
T
Q
S
I
E
K
A
F
V
T
G
G
G
V
S
V
K
E
I
N
P
K
E
M
S
S
K
F
T
N
G
L
Y
F
C
G
E
V
L
D
I
H
G
Y
T
G
G
Y
N
I
T
S
A
L
V
T
G
R
I
A
G
--------
111
Fugue
59.15
32%
19
- C3 -
-
2I0Z
1
?
A:
[25-444]
-------------------------
M
H
Y
D
V
I
V
I
G
G
G
P
S
G
L
M
A
A
I
G
A
A
E
E
G
A
N
V
L
L
L
D
K
G
N
K
L
G
R
K
L
A
I
S
G
G
G
R
C
N
V
T
N
--
R
L
P
L
---
D
E
I
V
K
H
I
---
P
G
N
G
R
F
L
Y
S
A
F
S
I
F
N
N
E
D
I
I
T
F
F
E
N
L
G
V
K
L
K
E
E
D
H
G
R
M
F
P
V
-
S
-
N
K
A
Q
----
S
V
V
D
A
L
L
T
R
L
K
D
---
L
G
V
K
I
R
T
N
T
P
V
E
T
I
E
--------
Y
E
---
N
G
Q
T
K
A
V
-
I
L
Q
-
T
G
E
V
L
E
T
N
H
V
V
I
A
V
G
G
K
S
V
P
Q
T
G
S
T
G
D
G
Y
A
W
A
E
K
A
G
H
T
I
---
T
E
L
F
P
T
E
V
---
P
I
L
S
N
E
-
P
F
I
R
D
---
R
--
S
L
Q
G
L
A
L
R
D
I
N
L
S
V
L
N
-
A
I
--
I
---
S
H
K
M
D
M
L
F
T
H
F
G
L
S
G
P
A
A
L
R
C
S
Q
F
V
V
K
A
-
L
--------
K
K
F
KTN
T
I
Q
M
S
-------
I
D
A
L
P
---
E
EN
S
E
---
Q
L
F
Q
R
M
L
K
Q
M
K
E
D
P
K
K
G
I
K
N
V
L
K
G
Y
V
P
E
R
---
Y
F
L
F
L
L
E
K
N
E
I
D
----
G
S
E
--
Q
A
G
Q
V
S
H
E
K
I
R
A
L
V
K
D
F
K
E
F
T
V
N
V
N
G
T
Q
S
I
E
K
A
F
V
T
G
G
G
V
S
V
K
E
I
N
P
K
E
M
S
S
K
F
T
N
G
L
Y
F
C
G
E
V
L
D
I
H
G
Y
T
G
G
Y
N
I
T
S
A
L
V
T
G
R
I
A
G
T
T
A
G
E
N
A
K
22
PsiBlast_CBE
59.09
32%
12
- C3 -
-
4CNJ
1
?
D:
[2-386]
-------------------------
N
H
F
D
T
I
I
I
G
G
G
P
A
G
M
M
A
T
I
S
S
S
F
Y
G
Q
K
T
L
L
L
E
K
N
K
R
L
G
K
K
L
A
G
T
G
G
G
R
C
N
V
T
N
NG
N
L
D
D
---
L
M
--
A
G
I
---
P
G
N
G
R
F
L
Y
S
V
F
S
Q
F
D
N
H
D
I
I
N
F
F
T
E
N
G
V
K
L
K
V
E
D
H
G
R
V
F
P
V
-
T
-
D
-
K
S
RTII
E
A
L
E
K
K
I
A
E
L
G
G
T
VI
T
N
T
E
I
V
S
V
K
K
T
D
E
L
-------------------
F
T
-
V
R
S
-
S
D
Q
A
W
T
C
Q
K
L
I
V
T
T
G
G
K
S
Y
P
S
T
G
S
T
G
F
G
H
D
I
A
R
H
F
K
H
T
V
---
T
D
L
E
A
A
E
S
---
P
L
-
L
T
D
F
P
H
K
A
L
---
Q
--
G
I
S
L
D
-----
D
V
T
L
S
Y
-
G
K
--
H
---
I
I
T
H
D
L
L
F
T
H
F
G
L
S
G
P
A
A
L
R
L
S
S
F
V
K
G
G
-
E
--------
T
I
--------
Y
-------
L
D
V
L
P
QMS
Q
---
Q
---
D
L
A
D
F
L
E
E
H
R
E
K
S
L
K
N
C
L
K
I
L
L
P
E
R
I
A
D
F
---
F
T
Q
P
-----
F
P
E
K
---------
V
K
Q
L
N
L
S
E
K
E
A
L
I
K
Q
I
K
E
L
P
I
S
V
T
G
K
M
S
L
A
K
S
F
V
T
K
G
G
V
S
L
K
E
I
N
P
K
T
L
E
S
K
L
V
P
G
L
H
F
A
G
E
V
L
D
I
N
A
H
T
G
G
F
N
I
T
S
A
L
C
T
G
W
V
A
G
--------
23
PsiBlast_CBE
59.07
32%
11
- C3 -
-
4CNJ
1
?
C:
[2-386]
-------------------------
N
H
F
D
T
I
I
I
G
G
G
P
A
G
M
M
A
T
I
S
S
S
F
Y
G
Q
K
T
L
L
L
E
K
N
K
R
L
G
K
K
L
A
G
T
G
G
G
R
C
N
V
T
N
NG
N
L
D
D
---
L
M
--
A
G
I
---
P
G
N
G
R
F
L
Y
S
V
F
S
Q
F
D
N
H
D
I
I
N
F
F
T
E
N
G
V
K
L
K
V
E
D
H
G
R
V
F
P
V
-
T
-
D
-
K
S
RTII
E
A
L
E
K
K
I
A
E
L
G
G
T
VI
T
N
T
E
I
V
S
V
K
K
T
D
E
L
-------------------
F
T
-
V
R
S
-
S
D
Q
A
W
T
C
Q
K
L
I
V
T
T
G
G
K
S
Y
P
S
T
G
S
T
G
F
G
H
D
I
A
R
H
F
K
H
T
V
---
T
D
L
E
A
A
E
S
---
P
L
-
L
T
D
F
P
H
K
A
L
---
Q
--
G
I
S
L
D
-----
D
V
T
L
S
Y
-
G
K
--
H
---
I
I
T
H
D
L
L
F
T
H
F
G
L
S
G
P
A
A
L
R
L
S
S
F
V
K
G
G
-
E
--------
T
I
--------
Y
-------
L
D
V
L
P
QMS
Q
---
Q
---
D
L
A
D
F
L
E
E
H
R
E
K
S
L
K
N
C
L
K
I
L
L
P
E
R
I
A
D
F
---
F
T
Q
P
-----
F
P
E
K
---------
V
K
Q
L
N
L
S
E
K
E
A
L
I
K
Q
I
K
E
L
P
I
S
V
T
G
K
M
S
L
A
K
S
F
V
T
K
G
G
V
S
L
K
E
I
N
P
K
T
L
E
S
K
L
V
P
G
L
H
F
A
G
E
V
L
D
I
N
A
H
T
G
G
F
N
I
T
S
A
L
C
T
G
W
V
A
G
--------
3
PsiBlast_PDB
58.98
32%
13
- C3 -
-
4CNJ
1
?
A:
[2-386]
-------------------------
N
H
F
D
T
I
I
I
G
G
G
P
A
G
M
M
A
T
I
S
S
S
F
Y
G
Q
K
T
L
L
L
E
K
N
K
R
L
G
K
K
L
A
G
T
G
G
G
R
C
N
V
T
N
NG
N
L
D
D
---
L
M
--
A
G
I
---
P
G
N
G
R
F
L
Y
S
V
F
S
Q
F
D
N
H
D
I
I
N
F
F
T
E
N
G
V
K
L
K
V
E
D
H
G
R
V
F
P
V
-
T
-
D
-
K
S
R
T
I
I
E
A
L
E
K
K
I
A
E
L
G
G
T
V
I
T
N
T
E
I
V
S
V
K
K
T
D
E
L
-------------------
F
T
-
V
R
S
-
S
D
Q
A
W
T
C
Q
K
L
I
V
T
T
G
G
K
S
Y
P
S
T
G
S
T
G
F
G
H
D
I
A
R
H
F
K
H
T
V
---
T
D
L
E
A
A
E
S
---
P
L
-
L
T
D
F
P
H
K
A
L
---
Q
--
G
I
S
L
D
-----
D
V
T
L
S
Y
-
G
K
--
H
---
I
I
T
H
D
L
L
F
T
H
F
G
L
S
G
P
A
A
L
R
L
S
S
F
V
K
G
G
-
E
--------
T
I
--------
Y
-------
L
D
V
L
P
QMS
Q
---
Q
---
D
L
A
D
F
L
E
E
H
R
E
K
S
L
K
N
C
L
K
I
L
L
P
E
R
I
A
D
F
---
F
T
Q
P
-----
F
P
E
K
---------
V
K
Q
L
N
L
S
E
K
E
A
L
I
K
Q
I
K
E
L
P
I
S
V
T
G
K
M
S
L
A
K
S
F
V
T
K
G
G
V
S
L
K
E
I
N
P
K
T
L
E
S
K
L
V
P
G
L
H
F
A
G
E
V
L
D
I
N
A
H
T
G
G
F
N
I
T
S
A
L
C
T
G
W
V
A
G
--------
24
PsiBlast_CBE
58.43
32%
11
- C3 -
-
4CNJ
1
?
B:
[2-386]
-------------------------
N
H
F
D
T
I
I
I
G
G
G
P
A
G
M
M
A
T
I
S
S
S
F
Y
G
Q
K
T
L
L
L
E
K
N
K
R
L
G
K
K
L
A
G
T
G
G
G
R
C
N
V
T
N
NG
N
L
D
D
---
L
M
--
A
G
I
---
P
G
N
G
R
F
L
Y
S
V
F
S
Q
F
D
N
H
D
I
I
N
F
F
T
E
N
G
V
K
L
K
V
E
D
H
G
R
V
F
P
V
-
T
-
D
-
K
S
RTII
E
A
L
E
K
K
I
A
E
L
G
G
T
VI
T
N
T
E
I
V
S
V
K
K
T
D
E
L
-------------------
F
T
-
V
R
S
-
S
D
Q
A
W
T
C
Q
K
L
I
V
T
T
G
G
K
S
Y
P
S
T
G
S
T
G
F
G
H
D
I
A
R
H
F
K
H
T
V
---
T
D
L
E
A
A
E
S
---
P
L
-
L
T
D
F
P
H
K
A
L
---
Q
--
G
I
S
L
D
-----
D
V
T
L
S
Y
-
G
K
--
H
---
I
I
T
H
D
L
L
F
T
H
F
G
L
S
G
P
A
A
L
R
L
S
S
F
V
K
G
G
-
E
--------
T
I
--------
Y
-------
L
D
V
L
P
QMS
Q
---
Q
---
D
L
A
D
F
L
E
E
H
R
E
K
S
L
K
N
C
L
K
I
L
L
P
E
R
I
A
D
F
---
F
T
Q
P
-----
F
P
E
K
---------
V
K
Q
L
N
L
S
E
K
E
A
L
I
K
Q
I
K
E
L
P
I
S
V
T
G
K
M
S
L
A
K
S
F
V
T
K
G
G
V
S
L
K
E
I
N
P
K
T
L
E
S
K
L
V
P
G
L
H
F
A
G
E
V
L
D
I
N
A
H
T
G
G
F
N
I
T
S
A
L
C
T
G
W
V
A
G
--------
83
PsiBlast_CBE
43.20
43%
-232
- C4 -
-
3DME
1
?
B:
[3-40]
-------------------------
T
D
I
D
C
I
V
I
G
A
G
V
V
G
L
A
I
A
R
A
L
A
A
G
G
H
E
V
L
V
A
E
A
A
E
G
I
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
51
PsiBlast_CBE
42.44
47%
-222
- C4 -
-
4D04
1
PAMO_THEFY
A:
[17-52]
---------------------------
V
D
V
L
V
V
G
A
G
F
S
G
L
Y
A
L
Y
R
L
R
E
L
G
R
S
V
H
V
I
E
T
A
G
D
V
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
62
PsiBlast_CBE
42.29
39%
-214
- C4 -
-
5BUL
1
?
A:
[9-45]
--------------------------
H
Y
D
V
V
I
I
G
S
G
P
A
G
S
L
C
G
I
E
C
R
K
K
G
L
S
V
L
C
I
E
K
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
52
PsiBlast_CBE
42.09
47%
-223
- C4 -
-
4D03
1
PAMO_THEFY
A:
[17-52]
---------------------------
V
D
V
L
V
V
G
A
G
F
S
G
L
Y
A
L
Y
R
L
R
E
L
G
R
S
V
H
V
I
E
T
A
G
D
V
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
84
PsiBlast_CBE
41.61
43%
-224
- C4 -
-
3DME
1
?
A:
[3-40]
-------------------------
T
D
I
D
C
I
V
I
G
A
G
V
V
G
L
A
I
A
R
A
L
A
A
G
G
H
E
V
L
V
A
E
A
A
E
G
I
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------