@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 : Rv2623: (2016-05-12 )
MSSGNSSLGIIVGIDDSPAAQVAVRWAARDAELRKIPLTLVHAVSPEVATWLEVPLPPGVLRWQQDHGRHLIDDALKVVEQASLRAGPPTVHSEIVPAAAVPTLVDMSKDAVLMVVGCLGSGRWPGRLLGSVSSGLLRHAHCPVVIIHDEDSVMPHPQQAPVLVGVDGSSASELATAIAFDEASRRNVDLVALHAWSDVDVSEWPGIDWPATQSMAEQVLAERLAGWQERYPNVAITRVVVRDQPARQLVQRSEEAQLVVVGSRGRGGYAGMLVGSVGETVAQLARTPVIVARESLT
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.....
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MSSGN
S
S
L
G
I
I
V
GIDD-SPA
A
Q
V
A
V
R
WAARDAELRKI
P
L
T
L
-
V
HAVSPE
V
A
T
W
L
EV-PL-P-----P---
G
---
V
L
RW
Q
Q
DHG
R
H
L
I
D
D
A
--
L
K
V
V
E
Q
AS------LRA---GP-P-TVHS--E--I-V-PAAAV
P
-
T
L
VD-MS--K--D--
A
V
L
M
-
V
V
G
CLG-SGRW-
P
G
R
L
L
G
S
V
S
S
G
L
L
RHAHC
P
V
V
I
I
HDEDSVMPHPQQA
P
V
L
V
G
VDGS
S
A
S
-------
E
-------
L
A
T
A
I
AFDEASRR--N
V
D
L
V
A
L
H
AWSDV
D
V
S
EWPGI---D---WP
A
T
Q
S
M
-
A
E
Q
V
L
A
E
R
L
A
G
W
Q
E
RYPN
V
A
I
-
T
R
V
V
VRD
Q
P
A
R
Q
L
V
Q
RS--EE
A
Q
L
V
V
V
GSRGRGGY
A
G
-
M
L
VG
S
V
G
E
T
V
A
Q
L
ART
P
V
I
V
ARESLT
24
PsiBlast_CBE
92.57
100%
-125
- C4 -
3CIS
1
Y2623_MYCTU
E:
[17-307]
----
N
S
S
L
G
I
I
V
G
I
D
D
-
S
P
A
A
Q
V
A
V
R
W
A
A
R
D
A
E
L
R
K
I
P
L
T
L
-
V
H
A
V
S
P
E
V
A
T
W
L
E
V
-
P
L
-
P
-----
P
---
G
---
V
L
R
W
Q
Q
D
H
G
R
H
L
I
D
D
A
--
L
K
V
V
E
Q
A
S
------
L
R
A
---
G
P
-
P
-
T
V
H
S
--
E
--
I
-
V
-
P
A
A
A
V
P
-
T
L
V
D
-
M
S
--
K
--
D
--
A
V
L
M
-
V
V
G
C
L
G
-
S
G
R
W
-
P
G
R
L
L
G
S
V
S
S
G
L
L
R
H
A
H
C
P
V
V
I
I
H
D
E
D
S
V
M
P
H
P
Q
Q
A
P
V
L
V
G
V
D
G
S
S
A
S
-------
E
-------
L
A
T
A
I
A
F
D
E
A
S
R
R
--
N
V
D
L
V
A
L
H
A
W
S
D
V
D
V
S
E
W
P
G
I
---
D
---
W
P
A
T
Q
S
M
-
A
E
Q
V
L
A
E
R
L
A
G
W
Q
E
R
Y
P
N
V
A
I
-
T
R
V
V
V
R
D
Q
P
A
R
Q
L
V
Q
R
S
--
E
E
A
Q
L
V
V
V
G
S
R
G
R
G
G
Y
A
G
-
M
L
V
G
S
V
G
E
T
V
A
Q
L
A
R
T
P
V
I
V
A
R
E
S
--
1
PsiBlast_PDB
92.37
100%
-125
- C4 -
3CIS
3
Y2623_MYCTU
A:
[18-306]
-----
S
S
L
G
I
I
V
G
I
D
D
-
S
P
A
A
Q
V
A
V
R
W
A
A
R
D
A
E
L
R
K
I
P
L
T
L
-
V
H
A
V
S
P
E
V
A
T
W
L
E
V
-
P
L
-
P
-----
P
---
G
---
V
L
R
W
Q
Q
D
H
G
R
H
L
I
D
D
A
--
L
K
V
V
E
Q
A
S
------
L
R
A
---
G
P
-
P
-
T
V
H
S
--
E
--
I
-
V
-
P
A
A
A
V
P
-
T
L
V
D
-
M
S
--
K
--
D
--
A
V
L
M
-
V
V
G
C
L
G
-
S
G
R
W
-
P
G
R
L
L
G
S
V
S
S
G
L
L
R
H
A
H
C
P
V
V
I
I
H
D
E
D
S
V
M
P
H
P
Q
Q
A
P
V
L
V
G
V
D
G
S
S
A
S
-------
E
-------
L
A
T
A
I
A
F
D
E
A
S
R
R
--
N
V
D
L
V
A
L
H
A
W
S
D
V
D
V
S
E
W
P
G
I
---
D
---
W
P
A
T
Q
S
M
-
A
E
Q
V
L
A
E
R
L
A
G
W
Q
E
R
Y
P
N
V
A
I
-
T
R
V
V
V
R
D
Q
P
A
R
Q
L
V
Q
R
S
--
E
E
A
Q
L
V
V
V
G
S
R
G
R
G
G
Y
A
G
-
M
L
V
G
S
V
G
E
T
V
A
Q
L
A
R
T
P
V
I
V
A
R
E
---
26
PsiBlast_CBE
92.07
100%
-124
- C4 -
3CIS
3
Y2623_MYCTU
C:
[18-307]
-----
S
S
L
G
I
I
V
G
I
D
D
-
S
P
A
A
Q
V
A
V
R
W
A
A
R
D
A
E
L
R
K
I
P
L
T
L
-
V
H
A
V
S
P
E
V
A
T
W
L
E
V
-
P
L
-
P
-----
P
---
G
---
V
L
R
W
Q
Q
D
H
G
R
H
L
I
D
D
A
--
L
K
V
V
E
Q
A
S
------
L
R
A
---
G
P
-
P
-
T
V
H
S
--
E
--
I
-
V
-
P
A
A
A
V
P
-
T
L
V
D
-
M
S
--
K
--
D
--
A
V
L
M
-
V
V
G
C
L
G
-
S
G
R
W
-
P
G
R
L
L
G
S
V
S
S
G
L
L
R
H
A
H
C
P
V
V
I
I
H
D
E
D
S
V
M
P
H
P
Q
Q
A
P
V
L
V
G
V
D
G
S
S
A
S
-------
E
-------
L
A
T
A
I
A
F
D
E
A
S
R
R
--
N
V
D
L
V
A
L
H
A
W
S
D
V
D
V
S
E
W
P
G
I
---
D
---
W
P
A
T
Q
S
M
-
A
E
Q
V
L
A
E
R
L
A
G
W
Q
E
R
Y
P
N
V
A
I
-
T
R
V
V
V
R
D
Q
P
A
R
Q
L
V
Q
R
S
--
E
E
A
Q
L
V
V
V
G
S
R
G
R
G
G
Y
A
G
-
M
L
V
G
S
V
G
E
T
V
A
Q
L
A
R
T
P
V
I
V
A
R
E
S
--
27
PsiBlast_CBE
91.89
100%
-126
- C4 -
3CIS
4
Y2623_MYCTU
B:
[17-306]
----
N
S
S
L
G
I
I
V
G
I
D
D
-
S
P
A
A
Q
V
A
V
R
W
A
A
R
D
A
E
L
R
K
I
P
L
T
L
-
V
H
A
V
S
P
E
V
A
T
W
L
E
V
-
P
L
-
P
-----
P
---
G
---
V
L
R
W
Q
Q
D
H
G
R
H
L
I
D
D
A
--
L
K
V
V
E
Q
A
S
------
L
R
A
---
G
P
-
P
-
T
V
H
S
--
E
--
I
-
V
-
P
A
A
A
V
P
-
T
L
V
D
-
M
S
--
K
--
D
--
A
V
L
M
-
V
V
G
C
L
G
-
S
G
R
W
-
P
G
R
L
L
G
S
V
S
S
G
L
L
R
H
A
H
C
P
V
V
I
I
H
D
E
D
S
V
M
P
H
P
Q
Q
A
P
V
L
V
G
V
D
G
S
S
A
S
-------
E
-------
L
A
T
A
I
A
F
D
E
A
S
R
R
--
N
V
D
L
V
A
L
H
A
W
S
D
V
D
V
S
E
W
P
G
I
---
D
---
W
P
A
T
Q
S
M
-
A
E
Q
V
L
A
E
R
L
A
G
W
Q
E
R
Y
P
N
V
A
I
-
T
R
V
V
V
R
D
Q
P
A
R
Q
L
V
Q
R
S
--
E
E
A
Q
L
V
V
V
G
S
R
G
R
G
G
Y
A
G
-
M
L
V
G
S
V
G
E
T
V
A
Q
L
A
R
T
P
V
I
V
A
R
E
---
31
HHSearch
91.85
99%
-126
- C4 -
3CIS
3
Y2623_MYCTU
A:
[18-306]
-----
S
S
L
G
I
I
V
G
I
D
D
-
S
P
A
A
Q
V
A
V
R
W
A
A
R
D
A
E
L
R
K
I
P
L
T
L
-
V
H
A
V
S
P
E
V
A
T
W
L
E
V
-
P
L
-
P
-----
P
---
G
---
V
L
R
W
Q
Q
D
H
G
R
H
L
I
D
D
A
--
L
K
V
V
E
Q
A
S
------
L
-
R
---
A
G
P
P
-
T
V
H
S
--
E
--
I
-
V
-
P
A
A
A
V
P
-
T
L
V
D
-
M
S
--
K
--
D
--
A
V
L
M
-
V
V
G
C
L
G
-
S
G
R
W
-
P
G
R
L
L
G
S
V
S
S
G
L
L
R
H
A
H
C
P
V
V
I
I
H
D
E
D
S
V
M
P
H
P
Q
Q
A
P
V
L
V
G
V
D
G
S
S
A
S
-------
E
-------
L
A
T
A
I
A
F
D
E
A
S
R
R
--
N
V
D
L
V
A
L
H
A
W
S
D
V
D
V
S
E
W
P
G
I
---
D
---
W
P
A
T
Q
S
M
-
A
E
Q
V
L
A
E
R
L
A
G
W
Q
E
R
Y
P
N
V
A
I
-
T
R
V
V
V
R
D
Q
P
A
R
Q
L
V
Q
R
S
--
E
E
A
Q
L
V
V
V
G
S
R
G
R
G
G
Y
A
G
-
M
L
V
G
S
V
G
E
T
V
A
Q
L
A
R
T
P
V
I
V
A
R
E
---
25
PsiBlast_CBE
91.22
100%
-125
- C4 -
3CIS
3
Y2623_MYCTU
D:
[18-306]
-----
S
S
L
G
I
I
V
G
I
D
D
-
S
P
A
A
Q
V
A
V
R
W
A
A
R
D
A
E
L
R
K
I
P
L
T
L
-
V
H
A
V
S
P
E
V
A
T
W
L
E
V
-
P
L
-
P
-----
P
---
G
---
V
L
R
W
Q
Q
D
H
G
R
H
L
I
D
D
A
--
L
K
V
V
E
Q
A
S
------
L
R
A
---
G
P
-
P
-
T
V
H
S
--
E
--
I
-
V
-
P
A
A
A
V
P
-
T
L
V
D
-
M
S
--
K
--
D
--
A
V
L
M
-
V
V
G
C
L
G
-
S
G
R
W
-
P
G
R
L
L
G
S
V
S
S
G
L
L
R
H
A
H
C
P
V
V
I
I
H
D
E
D
S
V
M
P
H
P
Q
Q
A
P
V
L
V
G
V
D
G
S
S
A
S
-------
E
-------
L
A
T
A
I
A
F
D
E
A
S
R
R
--
N
V
D
L
V
A
L
H
A
W
S
D
V
D
V
S
E
W
P
G
I
---
D
---
W
P
A
T
Q
S
M
-
A
E
Q
V
L
A
E
R
L
A
G
W
Q
E
R
Y
P
N
V
A
I
-
T
R
V
V
V
R
D
Q
P
A
R
Q
L
V
Q
R
S
--
E
E
A
Q
L
V
V
V
G
S
R
G
R
G
G
Y
A
G
-
M
L
V
G
S
V
G
E
T
V
A
Q
L
A
R
T
P
V
I
V
A
R
E
---
21
PsiBlast_CBE
90.79
100%
-125
- C4 -
3CIS
7
Y2623_MYCTU
H:
[18-306]
-----
S
S
L
G
I
I
V
G
I
D
D
-
S
P
A
A
Q
V
A
V
R
W
A
A
R
D
A
E
L
R
K
I
P
L
T
L
-
V
H
A
V
S
P
---
T
W
-----
L
-
P
-----
P
---
G
---
V
L
R
W
Q
Q
D
H
G
R
H
L
I
D
D
A
--
L
K
V
V
E
Q
A
S
------
L
R
A
---
G
P
-
P
-
T
V
H
S
--
E
--
I
-
V
-
P
A
A
A
V
P
-
T
L
V
D
-
M
S
--
K
--
D
--
A
V
L
M
-
V
V
G
C
L
G
-
S
G
R
W
-
P
G
R
L
L
G
S
V
S
S
G
L
L
R
H
A
H
C
P
V
V
I
I
H
D
E
D
S
V
M
P
H
P
Q
Q
A
P
V
L
V
G
V
D
G
S
S
A
S
-------
E
-------
L
A
T
A
I
A
F
D
E
A
S
R
R
--
N
V
D
L
V
A
L
H
A
W
S
D
V
D
V
S
E
W
P
G
I
---
D
---
W
P
A
T
Q
S
M
-
A
E
Q
V
L
A
E
R
L
A
G
W
Q
E
R
Y
P
N
V
A
I
-
T
R
V
V
V
R
D
Q
P
A
R
Q
L
V
Q
R
S
--
E
E
A
Q
L
V
V
V
G
S
R
G
R
G
G
Y
A
G
-
M
L
V
G
S
V
G
E
T
V
A
Q
L
A
R
T
P
V
I
V
A
R
E
---
2
PsiBlast_PDB
86.43
98%
-136
- C4 -
2JAX
3
Y2623_MYCTU
A:
[8-294]
-------
L
G
I
I
V
G
I
D
D
-
S
P
A
A
Q
V
A
V
R
W
A
A
R
D
A
E
L
R
K
I
P
L
T
L
-
V
H
A
V
S
-----------------------------
R
W
Q
Q
D
H
G
R
H
L
I
D
D
A
--
L
K
V
V
E
Q
A
S
------
L
R
A
---
G
P
-
P
-
T
V
H
S
--
E
--
I
-
V
-
P
A
A
A
V
P
-
T
L
V
D
-
M
S
--
K
--
D
--
A
V
L
M
-
V
V
G
C
L
G
-
S
G
R
W
-
P
G
R
L
L
G
S
V
S
S
G
L
L
R
H
A
H
C
P
V
V
I
I
H
D
----------
A
P
V
L
V
G
V
D
G
S
S
A
S
-------
E
-------
L
A
T
A
I
A
F
D
E
A
S
R
R
--
N
V
D
L
V
A
L
H
A
W
S
D
V
D
V
S
E
W
P
G
I
---
D
---
W
P
A
T
Q
S
M
-
A
E
Q
V
L
A
E
R
L
A
G
W
Q
E
R
Y
P
N
V
A
I
-
T
R
V
V
V
R
D
Q
P
A
R
Q
L
V
Q
R
S
--
E
E
A
Q
L
V
V
V
G
S
R
G
R
G
G
Y
A
G
-
M
L
V
G
S
V
G
E
T
V
A
Q
L
A
R
T
P
V
I
V
A
R
E
---
53
Fugue
82.09
93%
-130
- C4 -
2JAX
3
Y2623_MYCTU
A:
[8-294]
-------
L
G
I
I
V
G
I
D
D
-
S
P
A
A
Q
V
A
V
R
W
A
A
R
D
A
E
L
R
K
I
P
L
T
L
-
V
H
A
V
S
R
-----------------------------
W
Q
Q
D
H
G
R
H
L
I
D
D
A
--
L
K
V
V
E
Q
A
S
------
L
R
A
---
G
P
-
P
-
T
V
H
S
--
E
--
I
-
V
-
P
A
A
A
V
P
-
T
L
V
D
M
S
K
--
D
--
A
----
V
L
M
V
V
G
C
L
G
-
S
G
R
W
-
P
G
R
L
L
G
S
V
S
S
G
L
L
R
H
A
H
C
P
V
V
I
I
H
D
A
----------
P
V
L
V
G
V
D
G
S
S
A
S
-------
E
-------
L
A
T
A
I
A
F
D
E
A
S
R
R
--
N
V
D
L
V
A
L
H
A
W
S
D
V
D
V
S
E
W
P
G
I
---
D
----
W
P
A
T
Q
S
M
A
E
Q
V
L
A
E
R
L
A
G
W
Q
E
R
Y
P
N
V
A
I
-
T
R
V
V
V
R
D
Q
P
A
R
Q
L
V
Q
R
S
--
E
E
A
Q
L
V
V
V
G
S
R
G
R
G
G
Y
A
G
M
L
V
-
G
S
V
G
E
T
V
A
Q
L
A
R
T
P
V
I
V
A
R
E
---
36
HHSearch
58.62
17%
-111
- C4 -
3MT0
3
?
A:
[4-278]
---
M
Q
A
I
R
S
I
L
V
V
I
E
P
-
D
Q
L
E
G
L
A
L
K
R
A
Q
L
I
A
G
V
T
Q
S
H
L
H
L
-
L
V
C
E
K
R
R
D
--------------------------------
H
S
A
A
L
N
D
L
--
A
Q
E
L
R
E
--------------
E
G
-
Y
-
S
V
S
T
--
N
--
Q
-
A
W
K
D
S
L
H
Q
-
T
I
I
A
-
E
Q
Q
A
E
--
G
--
C
G
L
I
-
I
K
Q
H
F
P
-
D
N
P
L
-
K
K
A
I
L
T
P
D
D
W
K
L
L
R
F
A
P
C
P
V
L
M
T
K
T
A
R
P
----
W
T
G
G
K
I
L
A
A
V
D
V
G
N
N
D
-------
G
E
H
R
S
L
H
A
G
I
I
S
H
A
Y
D
I
A
G
L
A
--
K
A
T
L
H
V
I
S
A
H
P
-----------------
T
F
Q
L
S
E
T
-
I
E
A
R
Y
R
E
A
C
R
T
F
Q
A
E
Y
-
G
F
S
D
E
Q
L
H
I
E
E
G
P
A
D
V
L
I
P
R
T
A
Q
K
L
D
A
V
V
T
V
I
G
T
V
A
R
T
G
L
S
G
-
A
L
I
G
N
T
A
E
V
V
L
D
T
L
E
S
D
V
L
V
L
K
P
D
D
-
52
Fugue
55.31
23%
-104
- C4 -
3AB8
2
?
A:
[1-268]
-------
M
R
I
L
L
A
T
D
G
-
S
P
Q
A
R
G
A
E
A
L
A
E
W
L
A
Y
K
L
S
A
P
L
T
V
-
L
F
V
V
D
T
R
L
A
R
I
P
E
L
-
L
P
-
V
-----
P
---
V
---
L
R
T
E
L
E
R
A
L
A
L
R
G
E
A
V
--
L
E
R
V
R
Q
S
A
------
L
A
A
---
G
V
-
A
--
V
E
A
--
V
--
L
-
E
-
E
G
V
P
H
E
-
A
I
L
R
-
R
A
--
R
--
A
--
A
D
L
L
-
V
L
G
R
S
G
E
A
H
G
D
-
G
F
G
G
L
G
S
T
A
D
R
V
L
R
A
S
P
V
P
V
L
L
A
P
G
E
-----
P
V
E
L
E
G
A
L
L
G
Y
D
A
S
E
S
A
-------
V
-------
R
A
L
H
A
L
A
P
L
A
R
A
L
--
G
L
G
V
R
V
V
S
V
H
E
D
-------
P
A
---
R
---
A
E
A
W
A
L
E
-
A
E
A
Y
L
R
D
---------
H
G
V
E
A
-
S
A
L
V
L
G
G
D
A
A
D
H
L
L
R
L
Q
--
G
P
G
D
L
L
A
L
G
A
P
V
R
R
-----
L
V
F
G
S
T
A
E
R
V
I
R
N
A
Q
G
P
V
L
T
A
R
----
32
HHSearch
54.75
22%
-105
- C4 -
3AB8
2
?
A:
[1-268]
-------
M
R
I
L
L
A
T
D
G
-
S
P
Q
A
R
G
A
E
A
L
A
E
W
L
A
Y
K
L
S
A
P
L
T
V
-
L
F
V
V
D
T
R
L
A
R
I
P
E
L
L---
P
V
P
V
L
R
T
---
E
---
L
E
R
A
L
A
L
R
G
E
A
V
L
E
R
V
--
R
Q
S
A
L
-----------
A
---
A
G
-
V
-
A
V
E
A
--
V
--
L
-
E
-
E
G
V
P
H
E
-
A
I
L
R
-
R
A
--
R
--
A
--
A
D
L
L
-
V
L
G
R
S
G
-
E
A
H
G
D
G
F
G
G
L
G
S
T
A
D
R
V
L
R
A
S
P
V
P
V
L
L
A
P
G
E
P
-----
V
E
L
E
G
A
L
L
G
Y
D
A
S
E
S
A
-------
V
-------
R
A
L
H
A
L
A
P
L
A
R
A
L
--
G
L
G
V
R
V
V
S
V
H
E
D
P
A
R
A
E
-------------
A
W
A
L
-----
E
A
E
A
Y
---
L
R
D
--
H
G
V
E
A
-
S
A
L
V
L
G
G
D
A
A
D
H
L
L
R
L
Q
--
G
P
G
D
L
L
A
L
G
A
P
----
V
R
R
-
L
V
F
G
S
T
A
E
R
V
I
R
N
A
Q
G
P
V
L
T
A
R
----
34
HHSearch
53.53
18%
-95
- C4 -
3LOQ
9
?
A:
[20-292]
----
F
Q
S
N
A
M
L
L
P
T
D
L
-
S
E
N
S
F
K
V
L
E
Y
L
G
D
F
K
K
V
G
V
E
E
I
G
V
-
L
F
V
I
N
L
T
K
L
------
G
I
D
I
-----
D
---
H
---
Y
I
D
E
M
S
E
K
A
E
E
V
L
P
E
V
--
A
Q
K
I
E
A
A
--------------
G
-
I
-
K
A
E
V
--
I
KP
F
-
P
-
A
G
D
P
V
V
-
E
I
I
K
-
A
S
--
E
--
N
--
Y
S
F
I
-
A
M
G
S
R
G
-
A
S
K
F
-
K
K
I
L
L
G
S
V
S
E
G
V
L
H
D
S
K
V
P
V
Y
I
F
K
H
D
M
V
V
--
N
S
L
F
D
R
V
L
V
A
Y
D
F
S
K
W
A
-------
D
-------
R
A
L
E
Y
A
K
F
V
V
K
K
T
--
G
G
E
L
H
I
I
H
V
S
E
D
G
D
K
T
-
A
-------------
D
-----
L
----
R
V
M
E
E
V
I
G
A
-
E
G
I
E
V
-
H
V
H
I
E
S
G
T
P
H
K
A
I
L
A
K
R
E
E
I
N
A
T
T
I
F
M
G
S
R
G
A
G
S
V
M
T
-
M
I
L
G
S
T
S
E
S
V
I
R
R
S
P
V
P
V
F
V
C
K
R
G
D
-
40
HHSearch
50.86
27%
-134
- C4 -
5AHW
4
?
A:
[3-146]
-----
A
Y
Q
T
V
V
V
G
T
D
G
-
S
D
S
S
L
R
A
V
D
R
A
G
Q
I
A
A
A
S
N
A
K
L
I
I
-
A
T
A
Y
F
P
--------------------------------
A
P
I
Y
A
I
L
R
E
A
--
N
D
R
A
K
A
A
--------------
G
-
A
T
D
I
E
E
--
R
--
P
-
V
-
V
G
A
P
V
D
-
A
L
V
E
-
L
A
D
E
V
--
K
--
A
D
L
L
-
V
V
G
N
V
G
-
L
S
T
I
-
A
G
R
L
L
G
S
V
P
A
N
V
A
R
R
S
K
T
D
V
L
I
V
H
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
35
HHSearch
50.27
13%
-101
- C4 -
4WY2
5
?
A:
[5-307]
----
E
K
Y
Q
N
L
L
V
V
I
D
P
-
N
Q
D
D
Q
P
A
L
R
R
A
V
Y
I
V
Q
R
N
G
G
R
I
K
A
F
L
P
V
Y
D
L
S
Y
D
M
T
T
L
--
L
S
-
P
-----
D
E
R
N
A
---
M
R
K
G
V
I
N
Q
K
T
A
W
I
K
Q
Q
--
A
R
Y
Y
L
E
--------------
A
G
-
I
-
Q
I
D
I
--
K
--
V
I
W
-
H
N
R
P
Y
E
-
A
I
I
E
-
E
V
I
T
D
--
K
--
H
D
L
L
-
I
K
M
A
H
Q
-
H
D
K
L
-
G
S
L
I
F
T
P
L
D
W
Q
L
L
R
K
C
P
A
P
V
W
M
V
K
D
K
E
-
W
---
P
E
Y
G
T
I
V
V
A
A
N
L
S
N
E
E
S
Y
H
D
A
L
N
L
-------
K
L
I
E
L
T
N
D
L
S
H
R
I
QK
D
P
D
V
H
L
L
S
A
Y
P
V
A
P
I
N
I
A
I
E
L
PDF
D
---
P
N
L
Y
N
N
A
-
L
R
G
Q
H
L
I
A
M
K
E
L
R
Q
K
F
S
I
P
E
E
-
K
T
H
V
K
E
G
L
P
E
Q
V
I
P
Q
V
C
E
E
L
N
A
G
I
V
V
L
G
I
L
G
R
T
G
--
A
-
A
F
L
G
N
T
A
E
Q
L
I
D
H
I
K
C
D
L
L
A
I
K
P
D
G
-
4
PsiBlast_PDB
49.52
29%
-146
- C4 -
5AHW
4
?
A:
[7-145]
---------
V
V
V
G
T
D
G
-
S
D
S
S
L
R
A
V
D
R
A
G
Q
I
A
A
A
S
N
A
K
L
I
I
-
A
T
A
Y
F
P
-----------------------------------------
A
P
I
Y
A
I
L
R
E
A
N
------
D
R
A
K
A
A
G
A
-
T
-
D
I
E
E
--
R
--
P
-
V
-
V
G
A
P
V
D
-
A
L
V
E
-
L
A
--
D
--
E
V
K
A
D
L
L
-
V
V
G
N
V
G
-
L
S
T
I
-
A
G
R
L
L
G
S
V
P
A
N
V
A
R
R
S
K
T
D
V
L
I
V
H
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
50
HHSearch
49.34
23%
-139
- C4 -
3DLO
2
?
A:
[22-155]
----
M
I
Y
M
P
I
V
V
A
V
D
K
K
S
D
R
A
E
R
V
L
R
F
A
A
E
E
A
R
L
R
G
V
P
V
Y
V
-
V
H
S
L
P
G
G
G
R
T
-
K
------------
D
----------
E
D
I
I
E
A
K
E
T
L
S
W
A
--
V
S
I
I
R
K
E
--------------
G
-
A
-
E
G
E
E
H
L
L
--
V
-
R
-
G
K
E
P
P
D
-
D
I
V
D
-
F
A
D
E
V
--
D
--
A
I
A
I
-
V
I
G
I
R
K
-
R
S
P
T
-
G
K
L
I
F
G
S
V
A
R
D
V
I
L
K
A
N
K
P
V
I
C
I
K
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
48.37
25%
-140
- C4 -
3QTB
1
?
A:
[27-155]
---------
I
V
V
A
V
D
K
K
S
D
R
A
E
R
V
L
R
F
A
A
E
E
A
R
L
R
G
V
P
V
Y
V
-
V
H
S
-------------
L
-
P
-----
G
---
G
-----------
G
R
T
K
D
E
D
I
--
I
E
A
K
E
T
L
S
W
A
V
S
I
I
R
K
E
---
G
A
-
E
-
G
E
E
H
--
L
--
L
-
V
-
R
G
K
E
P
P
D
D
I
V
D
-
F
A
--
D
E
V
D
--
A
I
A
I
-
V
I
G
I
R
-----------
F
G
S
V
A
R
D
V
I
L
K
A
N
K
P
V
I
C
I
K
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
48.05
25%
-144
- C4 -
3DLO
2
?
A:
[27-155]
---------
I
V
V
A
V
D
K
K
S
D
R
A
E
R
V
L
R
F
A
A
E
E
A
R
L
R
G
V
P
V
Y
V
-
V
H
S
-------------
L
-
P
-----
G
---
G
-----------
G
R
T
K
D
E
D
I
--
I
E
A
K
E
T
L
S
W
A
V
S
I
I
R
K
E
---
G
A
-
E
-
G
E
E
H
--
L
--
L
-
V
-
R
G
K
E
P
P
D
D
I
V
D
-
F
A
--
D
E
V
D
--
A
I
A
I
-
V
I
G
I
R
K
-
R
S
P
T
-
G
K
L
I
F
G
S
V
A
R
D
V
I
L
K
A
N
K
P
V
I
C
I
K
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
48.02
15%
-100
- C4 -
4R2K
24
USPE_SALTY
A:
[15-316]
---
M
A
M
Y
Q
N
M
L
V
V
I
D
P
-
N
Q
D
D
Q
P
A
L
R
R
A
V
Y
L
H
Q
R
I
G
G
K
I
K
A
-
F
L
P
I
Y
D
F
S
Y
E
M
T
T
L
-
L
S
-
P
-----
D
---
E
R
T
A
M
R
Q
G
V
I
S
Q
R
T
A
W
I
R
E
Q
--
A
K
Y
Y
L
-----------
E
---
A
G
-
V
-
P
I
E
I
--
K
--
V
-
V
W
H
N
R
P
F
E
-
A
I
I
Q
-
E
V
I
A
G
--
S
--
H
D
L
V
-
L
K
M
A
H
Q
-
A
D
R
L
-
E
A
V
I
F
T
P
T
D
W
H
L
L
R
K
C
P
S
P
V
W
M
V
K
D
Q
P
W
----
P
E
G
G
K
A
L
V
A
V
N
L
A
S
E
E
PYHN
A
L
N
E
-------
K
L
V
K
E
T
L
Q
L
A
E
Q
V
N-
H
T
E
V
H
L
V
G
A
Y
P
V
T
P
I
N
I
A
I
E
L
---
P
EFD
P
S
V
Y
N
D
A
-
I
R
G
Q
H
L
L
A
M
K
A
L
R
Q
K
F
S
I
D
E
K
-
V
T
H
V
E
K
G
L
P
E
E
V
I
P
D
L
A
E
H
L
Q
A
G
I
V
V
L
G
T
V
G
R
T
G
L
S
A
-
A
F
L
G
N
T
A
E
Q
V
I
D
H
L
R
C
D
L
L
V
I
K
P
D
--