@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 : SA0119: (2016-03-12 )
MRIVQPVIEQLKAQSHPVCHYIYDLVGLEHHLQHITSSLPSNCQMYYAMKANSERTILDTISQYVEGFEVASQGEIAKGLAFKPANHIIFGGPGKTDEELRYAVSEGVQRIHVESMHELQRLNAILEDEDKTQHILLRVNLAGPFPNATLHMAGRPTQFGISEDEVDDVIEAALVMPNIHLDGFHFHSISNNLDSNLHVDVVKLYFKKAKSWSEKHRFPLKHINLGGGIGVNYADLTSQFEWDNFVENFKTLIVEQEMEDVTLNFECGRFIVAHIGYYVTEVLDIKKVHGAWYAILRGGTQQFRLPVSWQHNHPFEIYRYKDNPYSFEKVSISRQDTTLVGQLCTPKDVFAREVQIDAISTGDVIVFKYAGAYGWSISHHDFLSHPHPEFIYLTQTKEDE
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---
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
---------------MR
I
V
Q
P
V
I
E
Q
L
K
AQSH
P
V
C
H
Y
I
Y
D
L
V
G
L
E
H
H
L
Q
H
I
T
S
SLP-S-------N
C
Q
M
Y
-
Y
A
M
KANSE
R
T
I
L
D
T
I
S
Q
Y
V
E
G
F
EVASQG
E
I
----AKGL--AFK-P----AN
H
I
I
FGGPGK
T
D
E
E
L
R
Y
A
V
S
E
G
V
Q
R
I
H
V
E
S
M
H
E
L
Q
R
L
N
A
I
LEDEDKT
Q
H
I
L
L
R
V
NLA-GPFPNA
T
L
H----M--AGRP-TQFGI
S
--
E
D
E
V
--
D
--
D
V
I
E
A
A
L
VMPNIHLD--
G
F
H
FHSISNNLDSN-----
L
H
V
D
V
V
K
L
Y
F
K
K
A
KS
W
-
S
E
KHRF----PL
K
H
INLGGGIGV
N
Y
-------
A
D
L
TSQ-F
E
---
W
D
N
F
V
E
N
F
K
T
L
I
V
E
----Q-----E----M--E
D
-----
V
T
L
N--FEC
G
R
F
I
V
A
H
I
G
Y
Y
V
T
E
V
L
D
I
K
K
V
------
H
-----
G
-
A
-
W
Y
A
I
LRGG-----T
Q
Q
F
R
L
P
V
---
S
WQHNHP
F
E
I
--
Y
R
YKDNPY
S
F
E
K
V
S
ISRQD
T
T
L
VGQLC
T
P
K
D
V
F
A
R
E
-------
V
Q
I
-
D
A
-ISTG
D
V
I
V
F
K
YAGAYGWSI-SHHDFLSHPHP
E
F
I
Y
L
TQTKEDE-----
33
HHSearch
93.08
30%
-91
- C1 -
2J66
2
BTRK_BACCI
A:
[9-398]
------------------------
T
A
L
T
K
R
F
E
T
P
F
Y
L
Y
D
G
D
F
I
E
A
H
Y
R
Q
L
R
S
R
T
N
-
P
-------
A
I
Q
F
Y
-
L
S
L
K
A
N
N
N
I
H
L
A
K
L
F
R
Q
W
G
L
G
V
E
V
A
S
A
G
E
L
----
A
L
A
R
H
-
A
G
F
-
S
----
A
E
N
I
I
F
S
G
P
G
K
K
R
S
E
L
E
I
A
V
Q
S
G
I
Y
C
I
I
A
E
S
V
E
E
L
F
Y
I
E
E
L
A
E
K
E
N
K
T
A
R
V
A
I
R
I
N
P
D
-
K
S
F
--
T
A
I
K
----
M
--
G
G
V
P
-
R
Q
F
G
M
D
--
E
S
M
L
--
D
--
A
V
M
D
A
V
R
S
L
Q
F
T
K
F
I
--
G
I
H
V
Y
T
G
T
Q
N
L
N
T
D
-----
S
I
I
E
S
M
K
Y
T
V
D
L
G
R
N
I
-
Y
E
R
Y
G
I
----
V
C
E
C
I
N
L
G
G
G
F
G
V
P
Y
-------
F
--
E
K
A
-
L
D
---
I
G
K
I
T
R
T
V
S
D
Y
V
Q
E
A
R
D
T
R
-----
F
----
P
---
Q
-----
T
T
F
I
--
I
E
S
G
R
Y
L
L
A
Q
A
A
V
Y
V
T
E
V
L
Y
R
K
A
S
------
K
-----
G
-
E
-
V
F
V
I
V
D
G
G
-----
M
H
H
H
A
A
S
----------
P
M
E
Y
--
I
P
--------------
L
E
K
V
T
I
A
G
P
L
C
T
P
E
D
C
L
G
K
D
-------
V
H
V
-
P
A
-
L
Y
P
G
D
L
V
C
V
L
N
S
G
A
Y
G
L
S
F
-
S
P
V
H
F
L
G
H
P
T
P
I
E
I
L
K
R
N
G
---------
1
PsiBlast_PDB
91.52
32%
-91
- C1 -
2J66
2
BTRK_BACCI
A:
[20-390]
-----------------------------------
Y
L
Y
D
G
D
F
I
E
A
H
Y
R
Q
L
R
S
R
T
N
-
P
-------
A
I
Q
F
Y
-
L
S
L
K
A
N
N
N
I
H
L
A
K
L
F
R
Q
W
G
L
G
V
E
V
A
S
A
G
E
L
----
A
L
A
R
H
-
A
G
F
-
S
----
A
E
N
I
I
F
S
G
P
G
K
K
R
S
E
L
E
I
A
V
Q
S
G
I
Y
C
I
I
A
E
S
V
E
E
L
F
Y
I
E
E
L
A
E
K
E
N
K
T
A
R
V
A
I
R
I
N
P
D
-
K
S
F
--
T
A
I
K
----
M
--
G
G
V
P
-
R
Q
F
G
M
D
--
E
S
M
L
--
D
--
A
V
M
D
A
V
R
S
L
Q
F
T
K
F
I
--
G
I
H
V
Y
T
G
T
Q
N
L
N
T
D
-----
S
I
I
E
S
M
K
Y
T
V
D
L
G
R
N
I
-
Y
E
R
Y
G
I
----
V
C
E
C
I
N
L
G
G
G
F
G
V
P
Y
-------
F
--
E
K
A
-
L
D
---
I
G
K
I
T
R
T
V
S
D
Y
V
------
Q
-----
E
----
A
--
R
D
TRFPQ
T
T
F
I
--
I
E
S
G
R
Y
L
L
A
Q
A
A
V
Y
V
T
E
V
L
Y
R
K
A
S
------
K
-----
G
-
E
-
V
F
V
I
V
D
G
G
MHHHA
A
S
---------------
P
M
E
Y
I
P---------
L
E
K
V
T
I
A
-------
G
P
L
C
T
P
E
D
C
L
G
K
D
-------
V
H
V
-
P
A
-
L
Y
P
G
D
L
V
C
V
L
N
S
G
A
Y
G
L
S
F
-
S
P
V
H
F
L
G
H
P
T
P
-----------------
41
HHSearch
87.27
25%
-91
- C1 -
3VAB
4
?
A:
[41-419]
------------------------
P
E
I
A
K
A
V
G
T
P
F
Y
V
Y
S
R
A
T
I
E
R
H
F
R
V
F
H
D
A
F
A
D
M
-------
D
T
L
V
T
-
Y
A
L
K
A
N
S
N
Q
A
V
L
T
A
L
A
K
L
G
A
G
A
D
T
V
S
Q
G
E
I
----
R
R
A
L
A
-
A
G
I
-
P
----
A
N
R
I
V
F
S
G
V
G
K
T
P
R
E
M
D
F
A
L
E
A
G
I
Y
C
F
N
V
E
S
E
P
E
L
E
I
L
S
A
R
A
V
A
A
G
K
V
A
P
V
S
L
R
I
N
P
D
V
D
A
K
T
H
A
K
I
---------
K
S
E
-
N
K
F
G
I
P
--
R
D
K
A
--
R
--
A
A
Y
A
R
A
A
S
L
P
G
L
N
V
V
--
G
I
D
M
H
I
G
S
Q
I
I
D
L
E
-----
P
F
D
N
A
F
A
L
M
A
E
L
V
K
E
L
--
Q
A
D
G
H
----
N
I
R
H
V
D
V
G
G
G
L
G
I
P
Y
-------
R
T
P
--
P
-
P
P
---
P
V
A
Y
A
Q
I
V
A
K
H
I
K
P
----
L
--------------
G
-----
L
K
T
V
--
F
E
P
G
R
L
I
V
G
N
A
G
L
L
V
T
E
V
I
F
V
K
E
G
------
D
-----
A
-
K
-
N
F
V
I
V
D
A
A
-----
M
N
D
L
I
R
P
T
---
L
Y
D
A
F
H
D
I
R
P
--
V
I
M
P
N
-------
D
N
A
P
R
I
R
A
D
F
V
G
P
V
C
E
T
G
D
Y
L
G
L
D
-------
R
E
V
-
A
K
-
P
A
P
G
D
L
I
A
I
C
T
T
G
A
Y
G
A
V
L
-
S
S
T
-
Y
N
S
R
L
L
I
P
E
V
L
G
D
G
E
---------
39
HHSearch
86.82
24%
-98
- C1 -
2P3E
-
DCDA_AQUAE
A:
[22-399]
--------------------
G
V
S
L
K
E
L
A
Q
T
F
G
T
P
L
Y
V
Y
S
S
N
F
I
K
E
R
F
E
A
Y
R
K
A
F
P
---------
D
A
L
I
C
-
Y
A
V
K
A
N
F
N
P
H
L
V
K
L
L
G
E
L
G
A
G
A
D
I
V
S
G
G
E
L
----
Y
L
A
K
K
-
A
G
I
-
P
----
P
E
R
I
V
Y
A
G
V
G
K
T
E
K
E
L
T
D
A
V
D
S
E
I
L
M
F
N
V
E
S
R
Q
E
L
D
V
L
N
E
I
A
G
K
L
G
K
K
A
R
I
A
I
R
V
N
P
-----------------------
S
K
F
G
V
D
--
I
R
E
A
--
Q
--
K
E
Y
E
Y
A
S
K
L
E
N
L
E
I
V
--
G
I
H
C
H
I
G
S
Q
I
L
D
I
S
-----
P
Y
R
E
A
V
E
K
V
V
S
L
Y
E
S
L
--
T
Q
K
G
F
----
D
I
K
Y
L
D
I
G
G
G
L
G
I
K
Y
-------
K
P
E
D
K
E
-
P
A
---
P
Q
D
L
A
D
L
L
K
D
L
L
------
V
--------------
K
-----
A
K
I
I
--
L
E
P
G
R
S
I
M
G
N
A
G
I
L
I
T
Q
V
Q
F
L
K
D
K
------
G
-----
S
-
K
-
H
F
I
I
V
D
A
G
-----
M
N
D
L
I
R
P
S
---
I
Y
N
A
Y
H
H
I
----
I
P
V
E
T
-------
K
E
---
V
V
A
D
I
V
G
P
I
C
E
T
G
D
F
L
A
L
D
-------
R
E
I
-
E
E
-
V
Q
R
G
E
Y
L
A
V
L
S
A
G
A
Y
G
F
A
M
-
S
S
H
-
Y
N
M
R
P
R
A
A
E
V
L
V
E
N
G
---------
29
HHSearch
85.99
22%
-87
- C1 -
2O0T
1
DCDA_MYCTU
A:
[34-429]
------------------------
T
Q
L
A
Q
E
Y
G
T
P
L
F
V
I
D
E
D
D
F
R
S
R
C
R
E
T
A
A
A
F
G
-
S
-------
G
A
N
V
H
-
Y
A
A
K
A
F
L
C
S
E
V
A
R
W
I
S
E
E
G
L
C
L
D
V
C
T
G
G
E
L
----
A
V
A
L
H
-
A
S
F
-
P
----
P
E
R
I
T
L
H
G
N
N
K
S
V
S
E
L
T
A
A
V
K
A
G
V
G
H
I
V
V
D
S
M
T
E
I
E
R
L
D
A
I
A
G
E
A
G
I
V
Q
D
V
L
V
R
L
T
V
G
V
E
A
H
T
H
E
F
I
S
----
T
--
A
H
E
D
-
Q
K
F
G
L
S
--
V
A
S
G
A
A
M
--
A
A
V
R
R
V
F
A
T
D
H
L
R
L
V
--
G
L
H
S
H
I
G
S
Q
I
F
D
V
D
-----
G
F
E
L
A
A
H
R
V
I
G
L
L
R
D
V
-
V
G
E
F
G
P
EKTA
Q
I
A
T
V
D
L
G
G
G
L
G
I
S
Y
-------
L
P
S
D
D
P
-
P
P
---
I
A
E
L
A
A
K
L
G
T
I
V
S
D
----
E
S
T
A
VG
L
----
P
---
T
-----
P
K
L
V
--
V
E
P
G
R
A
I
A
G
P
G
T
I
T
L
Y
E
V
G
T
V
K
D
V
------
D
VSA
T
A
H
-
R
-
R
Y
V
S
V
D
G
G
-----
M
S
D
N
I
R
T
A
---
L
Y
G
A
Q
Y
D
V
R
L
--
V
S
R
V
--------
S
D
A
P
P
V
P
A
R
L
V
G
K
H
C
E
S
G
D
I
I
V
R
D
-------
T
W
V
-
P
D
D
I
R
P
G
D
L
V
A
V
A
A
T
G
A
Y
C
Y
S
L
-
S
S
R
-
Y
N
M
V
G
R
P
A
V
V
A
V
H
A
G
---------
13
PsiBlast_PDB
85.88
22%
-81
- C1 -
2O0T
1
DCDA_MYCTU
A:
[37-421]
---------------------------
A
Q
E
Y
G
T
P
L
F
V
I
D
E
D
D
F
R
S
R
C
R
E
T
A
A
A
F
G
-
S
-------
G
A
N
V
H
-
Y
A
A
K
A
F
L
C
S
E
V
A
R
W
I
S
E
E
G
L
C
L
D
V
C
T
G
G
E
L
----
A
V
A
L
H
-
A
S
F
-
P
----
P
E
R
I
T
L
H
G
N
N
K
S
V
S
E
L
T
A
A
V
K
A
G
V
G
H
I
V
V
D
S
M
T
E
I
E
R
L
D
A
I
A
G
E
A
G
I
V
Q
D
V
L
V
R
L
T
V
G
V
E
A
H
T
H
E
F
I
S
----
T
--
A
H
E
D
-
Q
K
F
G
L
S
VA
S
G
A
A
--
M
--
A
A
V
R
R
V
F
A
T
D
H
L
R
L
V
--
G
L
H
S
H
I
G
S
Q
I
F
D
V
D
G
F
E
L
A
A
H
-
R
V
I
G
L
L
R
D
V
V
G
E
F
-
G
P
E
K
T
A
----
Q
I
A
T
V
D
L
G
G
G
L
G
I
S
Y
-------
L
P
S
D
D
P
-
P
P
---
I
A
E
L
A
A
K
L
G
T
I
V
S
D
----
E
-----
S
T
A
VG
L
--
P
T
-----
P
K
L
V
--
V
E
P
G
R
A
I
A
G
P
G
T
I
T
L
Y
E
V
G
T
V
K
D
V
DVSA
T
A
H
-----
R
-
R
-
Y
V
S
V
D
G
G
M
-----
S
D
N
I
R
T
A
L
---
Y
G
A
Q
Y
D
V
R
L
V
--
S
R
V
S
D
A
P
P
V
P
A
R
---------
L
V
G
K
H
C
E
S
G
D
I
I
V
R
D
-------
T
W
V
P
D
D
-
I
R
P
G
D
L
V
A
V
A
A
T
G
A
Y
C
Y
S
L
S
S
R
Y
N
M
V
G
R
P
-------------------
4
PsiBlast_PDB
84.99
26%
-85
- C1 -
2QGH
2
DCDA_HELPX
A:
[29-386]
----------------------------
Q
T
H
K
T
P
F
Y
L
Y
D
F
D
K
I
K
Q
A
F
L
N
Y
K
E
A
F
K
-
G
-------
R
K
S
L
I
C
Y
A
L
K
A
N
S
N
L
S
I
L
S
L
L
A
H
L
E
S
G
A
D
C
V
S
I
G
E
I
----
Q
R
A
L
K
A
G
I
K
-
P
-----
Y
R
I
V
F
S
G
V
G
K
S
A
F
E
I
E
Q
A
L
K
L
N
I
L
F
L
N
V
E
S
F
M
E
L
K
T
I
E
T
I
A
Q
S
L
G
I
K
A
R
I
S
I
R
I
N
----
P
N
I
D
A
K
T
H
PYIS
T
--
G
L
K
E
-
N
K
F
G
V
G
--
E
K
E
A
--
L
--
E
M
F
L
W
A
K
K
S
A
F
L
E
P
V
--
S
V
H
F
H
I
G
S
Q
L
L
D
L
E
-----
P
I
I
E
A
S
Q
K
V
A
K
I
A
K
S
L
-
I
A
L
G
-
I
----
D
L
R
F
F
D
V
G
G
G
I
G
V
S
Y
-------
E
N
E
E
T
I
-
K
L
---
Y
D
Y
A
Q
G
I
L
N
A
L
-------------
Q
----
G
--
L
D
-----
L
T
I
I
--
C
E
P
G
R
S
I
V
A
E
S
G
E
L
I
T
Q
V
L
Y
E
K
K
-------------
N
-
K
-
R
F
V
I
V
D
A
G
-----
M
N
D
F
L
R
P
S
---
L
Y
H
A
K
H
A
I
R
V
--
I
----
T
P
S
---
E
I
S
----
P
C
D
V
V
G
P
V
C
E
S
S
D
T
F
L
K
D
-------
A
H
L
-
P
E
-
L
E
P
G
D
K
I
A
I
E
K
V
G
A
Y
G
S
S
M
-
A
S
Q
-------------------------
12
PsiBlast_PDB
84.46
22%
-79
- C1 -
1HKV
4
DCDA_MYCTU
A:
[35-419]
---------------------------
A
Q
E
Y
G
T
P
L
F
V
I
D
E
D
D
F
R
S
R
C
R
E
T
A
A
A
F
G
-
S
-------
G
A
N
V
H
-
Y
A
A
K
A
F
L
C
S
E
V
A
R
W
I
S
E
E
G
L
C
L
D
V
C
T
G
G
E
L
----
A
V
A
L
H
-
A
S
F
-
P
----
P
E
R
I
T
L
H
G
N
N
K
S
V
S
E
L
T
A
A
V
K
A
G
V
G
H
I
V
V
D
S
M
T
E
I
E
R
L
D
A
I
A
G
E
A
G
I
V
Q
D
V
L
V
R
L
T
V
G
V
E
A
H
T
H
E
F
I
S
----
T
--
A
H
E
D
-
Q
K
F
G
L
S
VA
S
G
A
A
--
M
--
A
A
V
R
R
V
F
A
T
D
H
L
R
L
V
--
G
L
H
S
H
I
G
S
Q
I
F
D
V
D
G
F
E
L
A
A
H
-
R
V
I
G
L
L
R
D
V
V
G
E
F
-
G
P
E
K
T
A
----
Q
I
A
T
V
D
L
G
G
G
L
G
I
S
Y
-------
L
P
S
D
D
P
-
P
P
---
I
A
E
L
A
A
K
L
G
T
I
V
S
D
----
E
-----
S
T
A
V
G
L
--
P
T
-----
P
K
L
V
--
V
E
P
G
R
A
I
A
G
P
G
T
I
T
L
Y
E
V
G
T
V
K
D
V
D
VSAT
A
H
-----
R
-
R
-
Y
V
S
V
D
G
G
M
-----
S
D
N
I
R
T
A
L
---
Y
G
A
Q
Y
D
V
R
L
V
--
S
R
V
S
D
A
P
P
V
P
A
R
---------
L
V
G
K
H
C
E
S
G
D
I
I
V
R
D
-------
T
W
V
P
D
D
-
I
R
P
G
D
L
V
A
V
A
A
T
G
A
Y
C
Y
S
L
S
S
R
Y
N
M
V
G
R
P
-------------------
5
PsiBlast_PDB
84.24
26%
-83
- C1 -
3C5Q
3
DCDA_HELPX
A:
[29-386]
----------------------------
Q
T
H
K
T
P
F
Y
L
Y
D
F
D
K
I
K
Q
A
F
L
N
Y
K
E
A
F
K
-
G
-------
R
K
S
L
I
C
Y
A
L
K
A
N
S
N
L
S
I
L
S
L
L
A
H
L
E
S
G
A
D
C
V
S
I
G
E
I
----
Q
R
A
L
K
A
G
I
K
-
P
-----
Y
R
I
V
F
S
G
V
G
K
S
A
F
E
I
E
Q
A
L
K
L
N
I
L
F
L
N
V
E
S
F
M
E
L
K
T
I
E
T
I
A
Q
S
L
G
I
K
A
R
I
S
I
R
I
N
----
P
N
I
D
A
K
T
H
PYLS
T
--
G
L
K
E
-
N
K
F
G
V
G
--
E
K
E
A
--
L
--
E
M
F
L
W
A
K
K
S
A
F
L
E
P
V
--
S
V
H
F
H
I
G
S
Q
L
L
D
L
E
-----
P
I
I
E
A
S
Q
K
V
A
K
I
A
K
S
L
-
I
A
L
G
-
I
----
D
L
R
F
F
D
V
G
G
G
I
G
V
S
Y
-------
E
N
E
E
T
I
-
K
L
---
Y
D
Y
A
Q
G
I
L
N
A
L
-------------
Q
----
G
--
L
D
-----
L
T
I
I
--
C
E
P
G
R
S
I
V
A
E
S
G
E
L
I
T
Q
V
L
Y
E
K
K
-------------
N
-
K
-
R
F
V
I
V
D
A
G
-----
M
N
D
F
L
R
P
S
---
L
Y
H
A
K
H
A
I
R
V
--
I
----
T
P
S
---
E
I
S
----
P
C
D
V
V
G
P
V
C
E
S
S
D
T
F
L
K
D
-------
A
H
L
-
P
E
-
L
E
P
G
D
K
I
A
I
E
K
V
G
A
Y
G
S
S
M
-
A
S
Q
-------------------------
42
HHSearch
84.09
26%
-93
- C1 -
3N2B
1
DCDA_VIBCH
A:
[44-418]
------------------------
A
D
L
A
N
Q
Y
G
T
P
L
Y
V
Y
S
R
A
T
L
E
R
H
W
H
A
F
D
K
S
V
G
D
Y
-------
P
H
L
I
C
-
Y
A
V
K
A
N
S
N
L
G
V
L
N
T
L
A
R
L
G
S
G
F
D
I
V
S
V
G
E
L
----
E
R
V
L
A
-
A
G
G
-
D
----
P
S
K
V
V
F
S
G
V
G
K
T
E
A
E
M
K
R
A
L
Q
L
K
I
K
C
F
N
V
E
S
E
P
E
L
Q
R
L
N
K
V
A
G
E
L
G
V
K
A
P
I
S
L
R
I
N
P
D
V
D
A
K
T
H
P
Y
I
S
----
T
--
G
L
R
D
-
N
K
F
G
I
T
--
F
D
R
A
--
A
--
Q
V
Y
R
L
A
H
S
L
P
N
L
D
V
H
--
G
I
D
C
H
I
G
S
Q
L
T
A
L
A
-----
P
F
I
D
A
T
D
R
L
L
A
L
I
D
S
L
--
K
A
E
G
I
----
H
I
R
H
L
D
V
G
G
G
L
G
V
V
Y
--------------
P
Q
---
P
S
E
Y
A
K
A
L
L
D
R
L
E
R
----
H
----------
R
---
D
-----
L
E
L
I
--
F
E
P
G
R
A
I
A
A
N
A
G
V
L
V
T
K
V
E
F
L
K
H
T
--------------
K
-
N
F
A
I
I
D
A
A
-----
M
N
D
L
I
R
----------
Q
D
I
I
----
P
L
R
P
-------
R
Q
G
E
A
Q
T
Y
D
L
V
G
P
V
C
E
T
S
D
F
L
G
K
D
-------
R
D
L
-
V
--
L
Q
E
G
D
L
L
A
V
R
S
S
G
A
Y
G
F
T
M
-
S
S
N
-
Y
N
T
R
P
R
V
A
E
V
M
V
D
G
N
---------
3
PsiBlast_PDB
83.80
26%
-84
- C1 -
3VAB
3
?
A:
[42-402]
-----------------------
E
I
A
K
A
V
G
T
P
--
F
Y
V
Y
S
R
A
T
I
E
R
H
F
R
V
F
H
D
A
F
A
-
D
M------
D
T
L
V
T
-
Y
A
L
K
A
N
S
N
Q
A
V
L
T
A
L
A
K
L
G
A
G
A
D
T
V
S
Q
G
E
I
----
R
R
A
L
--
A
A
G
I
P
----
A
N
R
I
V
F
S
G
V
G
K
T
P
R
E
M
D
F
A
L
E
A
G
I
Y
C
F
N
V
E
S
E
P
E
L
E
I
L
S
A
R
A
V
A
A
G
K
V
A
P
V
S
L
R
I
N
----
P
D
V
D
A
K
T
H
----
A
KI--
K
S
E
N
K
F
G
I
P
--
R
D
K
A
--
R
--
A
A
Y
A
R
A
A
S
L
P
G
L
N
V
V
--
G
I
D
M
H
I
G
S
Q
I
I
D
L
E
-----
P
F
D
N
A
F
A
L
M
A
E
L
V
K
E
L
Q
A
D
G
H
N
------
I
R
H
V
D
V
G
G
G
L
G
I
P
Y
-------
R
T
P
----
P
P
---
P
P
V
A
Y
A
Q
----
I
V
A
----
K
-----
H
----
I
--
K
P
-----
L
G
L
K
T
V
F
E
P
G
R
L
I
V
G
N
A
G
L
L
V
T
E
V
I
F
V
K
E
G
------
D
-----
A
-
K
-
N
F
V
I
V
D
A
A
-----
M
N
D
L
I
R
P
T
---
L
Y
D
A
F
H
D
I
R
---------
P
V
I
M
P
N
D
N
A
P
R
I
R
A
D
F
V
G
P
V
C
E
T
G
D
Y
L
G
L
D
-------
R
E
V
-
A
K
-
P
A
P
G
D
L
I
A
I
C
T
T
G
A
Y
G
A
V
L
-
S
---------------------------
10
PsiBlast_PDB
83.64
24%
-106
- C1 -
2PLJ
3
?
A:
[45-396]
-----------------
L
I
E
A
S
V
E
Q
F
G
A
---
P
L
--
L
L
L
D
C
D
V
I
R
Q
Q
Y
R
A
L
K
N
A
L
P
---------
N
V
T
L
H
-
Y
A
L
K
P
L
P
H
P
V
V
V
R
T
L
L
A
E
G
A
S
F
D
L
A
T
T
G
E
V
E
L
V
A
S
E
G
V
------
P
----
A
D
L
T
I
H
T
H
P
I
K
R
D
A
D
I
R
D
A
L
A
Y
G
C
N
V
F
V
V
D
N
L
N
E
L
E
K
F
K
A
Y
R
D
D
V
E
----
L
L
V
R
L
S
-----
F
----------------
S
-
K
K
F
G
C
S
--
P
E
Q
A
--
L
--
V
I
I
E
T
A
K
E
W
-
N
I
R
I
K
--
G
L
S
F
H
V
G
S
Q
T
T
N
P
N
-----
K
Y
V
E
A
I
H
T
C
R
H
V
M
E
Q
V
-
V
E
R
G
L
P
----
A
L
S
T
L
D
I
G
G
G
F
P
V
N
Y
----------
T
Q
Q
V
M
P
---
I
D
Q
F
C
A
P
I
N
E
A
L
-
S
----
L
-----
L
----
P
--
E
T
-----
V
H
V
L
--
A
E
P
G
R
F
I
C
A
P
A
V
T
S
V
A
S
V
M
G
Q
A
E
R
------
E
-----
G
-
Q
I
W
Y
Y
L
D
D
G
I
-----
Y
G
S
F
----------
S
G
L
M
F
D
D
--
A
R
Y
---
P
L
T
T
I
K
Q
G
G
E
L
I
P
S
V
L
S
G
P
T
C
D
S
V
D
V
I
A
E
N
-------
I
L
L
-
P
K
-
L
N
N
G
D
L
V
I
G
R
T
M
G
A
Y
-
T
S
A
-
T
A
T
D
F
-----------------------
11
PsiBlast_PDB
83.25
24%
-105
- C1 -
2PLK
2
?
A:
[45-396]
-----------------
L
I
E
A
S
V
E
Q
F
G
A
---
P
L
--
L
L
L
D
C
D
V
I
R
Q
Q
Y
R
A
L
K
N
A
L
P
---------
N
V
T
L
H
-
Y
A
L
K
P
L
P
H
P
V
V
V
R
T
L
L
A
E
G
A
S
F
D
L
A
T
T
G
E
V
E
L
V
A
S
E
G
V
------
P
----
A
D
L
T
I
H
T
H
P
I
K
R
D
A
D
I
R
D
A
L
A
Y
G
C
N
V
F
V
V
D
N
L
N
E
L
E
K
F
K
A
Y
R
D
D
V
E
----
L
L
V
R
L
S
-----
F
------------------
K
K
F
G
C
S
--
P
E
Q
A
--
L
--
V
I
I
E
T
A
K
E
W
-
N
I
R
I
K
--
G
L
S
F
H
V
G
S
Q
T
T
N
P
N
-----
K
Y
V
E
A
I
H
T
C
R
H
V
M
E
Q
V
-
V
E
R
G
L
P
----
A
L
S
T
L
D
I
G
G
G
F
P
V
N
Y
----------
T
Q
Q
V
M
P
---
I
D
Q
F
C
A
P
I
N
E
A
L
-
S
----
L
-----
L
----
P
--
E
T
-----
V
H
V
L
--
A
E
P
G
R
F
I
C
A
P
A
V
T
S
V
A
S
V
M
G
Q
A
E
R
------
E
-----
G
-
Q
I
W
Y
Y
L
D
D
G
I
-----
Y
G
S
F
----------
S
G
L
M
F
D
D
--
A
R
Y
---
P
L
T
T
I
K
Q
G
G
E
L
I
P
S
V
L
S
G
P
T
C
D
S
V
D
V
I
A
E
N
-------
I
L
L
-
P
K
-
L
N
N
G
D
L
V
I
G
R
T
M
G
A
Y
-
T
S
A
-
T
A
T
D
F
-----------------------
31
HHSearch
81.98
22%
-82
* C1 *
1TWI
3
DCDA_METJA
A:
[22-410]
------------------------
I
E
L
A
E
K
F
G
T
P
L
Y
V
M
S
E
E
Q
I
K
I
N
Y
N
R
Y
I
E
A
F
K
-
R
W
E
E
E
TG
K
E
F
I
V
A
-
Y
A
Y
K
A
N
A
N
L
A
I
T
R
L
L
A
K
L
G
C
G
A
D
V
V
S
G
G
E
L
----
Y
I
A
K
L
-
S
N
V
-
P
----
S
K
K
I
V
F
N
G
N
C
K
T
K
E
E
I
I
M
G
I
E
A
N
I
R
A
F
N
V
D
S
I
S
E
L
I
L
I
N
E
T
A
K
E
L
G
E
T
A
N
V
A
F
R
I
N
P
N
V
N
P
K
T
H
P
K
I
S
----
T
--
G
L
K
K
-
N
K
F
G
L
D
--
V
E
S
G
--
I
A
M
K
A
I
K
M
A
L
E
M
E
Y
V
N
V
V
--
G
V
H
C
H
I
G
S
Q
L
T
D
I
S
-----
P
F
I
E
E
T
R
K
V
M
D
F
V
V
E
L
-
K
-
E
E
G
I
----
E
I
E
D
V
N
L
G
G
G
L
G
I
P
Y
-------
Y
K
D
K
Q
I
-
P
T
---
Q
K
D
L
A
D
A
I
I
N
T
M
L
K
----
Y
-----
K
----
D
KV
E
M
-----
P
N
L
I
--
L
E
P
G
R
S
L
V
A
T
A
G
Y
L
L
G
K
V
H
H
I
K
E
T
------
P
-----
V
-
T
-
K
W
V
M
I
D
A
G
-----
M
N
D
M
M
R
P
A
---
M
Y
E
A
Y
H
H
I
I
----
N
C
K
--------
V
K
N
E
K
E
V
V
S
I
A
G
G
L
C
E
S
S
D
V
F
G
R
D
-------
R
E
L
-
D
K
-
V
E
V
G
D
V
L
A
I
F
D
V
G
A
Y
G
I
S
M
-
A
N
N
-
Y
N
A
R
G
R
P
R
M
V
L
T
S
K
K
G
--------
30
HHSearch
81.86
22%
-91
- C1 -
2YXX
1
DCDA_THEMA
A:
[5-366]
------------------------
R
K
V
A
E
I
H
G
T
P
T
Y
V
Y
F
E
E
T
L
R
K
R
S
R
L
V
K
E
V
F
E
G
V
-------
N
L
L
P
T
-
F
A
V
K
A
N
N
N
P
V
L
L
K
I
L
R
E
E
G
F
G
M
D
V
V
T
K
G
E
L
----
L
A
A
K
L
-
A
G
V
-
P
----
S
H
T
V
V
W
N
G
N
G
K
S
R
D
Q
M
E
H
F
L
R
E
D
V
R
I
V
N
V
D
S
F
E
E
M
E
I
W
R
E
L
N
P
---
E
G
V
E
Y
F
I
R
V
N
P
E
V
D
A
K
T
H
P
H
I
S
----
T
--
G
L
K
K
-
H
K
F
G
I
P
--
L
E
D
L
--
D
--
S
F
M
E
R
---
F
R
S
M
N
I
R
--
G
L
H
V
H
I
G
S
Q
I
T
R
V
E
-----
P
F
V
E
A
F
S
K
V
V
R
A
S
E
R
-----
Y
G
------
F
E
E
I
N
I
G
G
G
W
G
I
N
Y
-------
S
G
--
E
E
-
L
D
---
L
S
S
Y
R
E
K
V
V
P
D
L
K
----------------
R
---
F
-----
K
R
V
I
--
V
E
I
G
R
Y
I
V
A
P
S
G
Y
L
L
L
R
V
V
L
V
K
R
R
------
H
-----
N
-
K
-
A
F
V
V
V
D
G
G
-----
M
N
V
L
I
R
P
A
---
L
Y
S
A
Y
H
R
I
F
V
--
L
G
K
----------
Q
G
K
E
M
R
A
D
V
V
G
P
L
C
E
S
G
D
V
I
A
Y
D
-------
R
E
L
-
P
E
-
V
E
P
G
D
I
I
A
V
E
N
A
G
A
Y
G
Y
T
M
-
S
N
N
-
Y
N
S
T
T
R
P
A
E
V
L
V
R
E
N
G
--------
14
PsiBlast_PDB
81.55
23%
-75
- C1 -
1HKW
1
DCDA_MYCTU
A:
[35-410]
---------------------------
A
Q
E
Y
G
T
P
L
F
V
I
D
E
D
D
F
R
S
R
C
R
E
T
A
A
A
F
G
-
S
-------
G
A
N
V
H
-
Y
A
A
K
A
F
L
C
S
E
V
A
R
W
I
S
E
E
G
L
C
L
D
V
C
T
G
G
E
L
----
A
V
A
L
H
-
A
S
F
-
P
----
P
E
R
I
T
L
H
G
N
N
K
S
V
S
E
L
T
A
A
V
K
A
G
V
G
H
I
V
V
D
S
M
T
E
I
E
R
L
D
A
I
A
G
E
A
G
I
V
Q
D
V
L
V
R
L
T
V
G
V
E
A
H
T
H
E
F
I
S
----
T
--
A
H
E
D
-
Q
K
F
G
L
S
--
V
A
S
G
--
A
--
A
M
A
A
V
R
R
V
F
A
T
D
H
L
R
LV
G
L
H
S
H
I
G
S
Q
I
F
D
V
D
G
F
E
L
A
A
H
-
R
V
I
G
L
L
R
D
V
V
G
E
F
-
G
P
E
K
T
A
----
Q
I
A
T
V
D
L
G
G
G
L
G
I
S
Y
-------
L
P
S
D
D
P
-
P
P
---
I
A
E
L
A
A
K
L
G
T
I
V
S
D
----
E
-----
S
T
A
V
G
L
--
P
T
-----
P
K
L
V
--
V
E
P
G
R
A
I
A
G
P
G
T
I
T
L
Y
E
V
G
T
V
K
D
V
D
VSAT
A
H
-----
R
-
R
-
Y
V
S
V
D
G
G
M
-----
S
D
N
I
R
T
A
L
---
Y
G
A
Q
Y
D
V
R
L
V
--
S
R
V
S
D
A
P
P
V
P
A
R
---------
L
V
G
K
H
C
E
S
G
D
I
I
V
R
D
-------
T
W
V
P
D
D
-
I
R
P
G
D
L
V
A
V
A
A
T
G
A
Y
C
Y
S
L
-
S
---------------------------
6
PsiBlast_PDB
80.63
25%
-102
- C1 -
2P3E
-
DCDA_AQUAE
A:
[29-384]
---------------------------
A
Q
T
F
G
T
P
L
Y
V
Y
S
S
N
F
I
K
E
R
F
E
A
Y
R
K
A
F
P
---------
D
A
L
I
C
-
Y
A
V
K
A
N
F
N
P
H
L
V
K
L
L
G
E
L
G
A
G
A
D
I
V
S
G
G
E
L
Y
L
--
A
K
K
A
--
G
I
--
P
----
P
E
R
I
V
Y
A
G
V
G
K
T
E
K
E
L
T
D
A
V
D
S
E
I
L
M
F
N
V
E
S
R
Q
E
L
D
V
L
N
E
I
A
G
K
L
G
K
K
A
R
I
A
I
R
V
N
P
-----------------------
S
K
F
G
V
D
--
I
R
E
A
--
Q
--
K
E
Y
E
Y
A
S
K
L
E
N
L
E
I
V
--
G
I
H
C
H
I
G
S
Q
I
L
D
I
S
-----
P
Y
R
E
A
V
E
K
V
V
S
L
Y
E
S
L
-
T
Q
K
G
-
F
----
D
I
K
Y
L
D
I
G
G
G
L
G
I
K
Y
KPE
D
K
E
P
A
P
Q
D
L
A
-
D
L
---
L
K
D
L
L
--
V
K
A
K
I
I
--------------------------------
L
E
P
G
R
S
I
M
G
N
A
G
I
L
I
T
Q
V
Q
F
L
K
D
K
------
G
-----
S
-
K
-
H
F
I
I
V
D
A
G
-----
M
N
D
L
I
R
P
S
IYN
A
Y
H
H
I
I
P
V
E
T
--
K
E
---------------
V
V
A
D
I
V
G
P
I
C
E
T
G
D
F
L
A
L
D
-------
R
E
I
-
E
E
-
V
Q
R
G
E
Y
L
A
V
L
S
A
G
A
Y
G
F
A
M
-
S
S
H
-------------------------
54
Fugue
80.61
21%
-89
- C1 -
7ODC
1
DCOR_MOUSE
A:
[2-418]
S
S
F
T
K
DE
F
D
C
H
I
L
D
E
G
F
T
A
K
D
I
L
D
Q
K
I
N
D
K
D
A
--
F
Y
V
A
D
L
G
D
I
L
K
K
H
L
R
W
L
K
A
L
P
---------
R
V
T
P
F
-
Y
A
V
K
C
N
D
S
R
A
I
V
S
T
L
A
A
I
G
T
G
F
D
C
A
S
K
T
E
I
----
Q
L
V
Q
--
G
L
G
V
P
----
A
E
R
V
I
Y
A
N
P
C
K
Q
V
S
Q
I
K
Y
A
A
S
N
G
V
Q
M
M
T
F
D
S
E
I
E
L
M
K
V
A
R
A
--------------------
H
P
K
A
K
L
V
----
L
--
R
I
A
T
--
K
F
G
A
T
--
L
K
T
S
--
R
--
L
L
L
E
R
A
K
E
-
L
N
I
D
V
I
--
G
V
S
F
H
V
G
S
G
C
T
D
P
D
-----
T
F
V
Q
A
V
S
D
A
R
C
V
F
D
M
A
-
T
E
V
G
-
F
----
S
M
H
L
L
D
I
G
G
G
F
P
G
S
E
----------
D
T
K
-
L
K
---
F
E
E
I
T
S
V
I
N
P
A
L
D
K
----
Y
FP---
S
----
D
--
S
G
-----
V
R
I
I
--
A
E
P
G
R
Y
Y
V
A
S
A
F
T
L
A
V
N
I
I
A
K
K
T
V
------
W
-----
E
Q
T
-
F
M
Y
Y
V
N
D
G
-----
V
Y
G
S
F
N
C
I
---
L
Y
D
H
A
H
V
K
A
L
--
L
Q
K
R
P
K
P
D
E
------
K
Y
Y
S
S
S
I
W
G
P
T
C
D
G
L
D
R
I
V
E
R
-------
C
N
L
-
P
E
-
M
H
V
G
D
W
M
L
F
E
N
M
G
A
Y
T
V
A
A
-
A
S
-
T
F
N
G
F
Q
R
P
N
I
Y
Y
V
M
S
--
R
P
M
W
Q
L
M
K
2
PsiBlast_PDB
80.52
28%
-84
- C1 -
3N2B
1
DCDA_VIBCH
A:
[55-403]
-----------------------------------
Y
V
Y
S
R
A
T
L
E
R
H
W
H
A
F
D
K
S
V
G
-
D
-------
Y
P
H
L
I
C
Y
A
V
K
A
N
S
N
L
G
V
L
N
T
L
A
R
L
G
S
G
F
D
I
V
S
V
G
E
L
----
E
R
V
L
--
A
A
G
G
D
----
P
S
K
V
V
F
S
G
V
G
K
T
E
A
E
M
K
R
A
L
Q
L
K
I
K
C
F
N
V
E
S
E
P
E
L
Q
R
L
N
K
V
A
G
E
L
G
V
K
A
P
I
S
L
R
I
N
----
P
D
V
D
A
K
T
H
P
Y
I
S
T
--
G
L
R
D
-
N
K
F
G
I
T
--
F
D
R
A
--
A
--
Q
V
Y
R
L
A
H
S
L
P
N
L
D
V
H
--
G
I
D
C
H
I
G
S
Q
L
T
A
L
A
-----
P
F
I
D
A
T
D
R
L
L
A
L
I
D
S
L
-
K
A
E
G
-
I
----
H
I
R
H
L
D
V
G
G
G
L
G
V
V
Y
-----------
P
Q
-
P
S
--------
E
Y
A
K
A
L
L
D
R
----
L
-----
E
----
R
H
-
R
D
-----
L
E
L
I
--
F
E
P
G
R
A
I
A
A
N
A
G
V
L
V
T
K
V
E
F
L
K
H
T
--------------
K
-
N
F
A
I
I
D
A
A
-----
M
N
D
L
I
R
-------
Q
D
I
I
P
L
R
---------
P
R
Q
G
E
A
-----
Q
T
Y
D
L
V
G
P
V
C
E
T
S
D
F
L
G
K
D
-------
R
D
L
--
V
-
L
Q
E
G
D
L
L
A
V
R
S
S
G
A
Y
G
F
T
M
-
S
S
N
-------------------------
37
HHSearch
80.02
21%
-86
- C1 -
1KNW
5
DCDA_ECOLI
A:
[18-400]
------------------------
L
R
L
P
A
E
F
G
C
P
V
W
V
Y
D
A
Q
I
I
R
R
Q
I
A
A
L
K
Q
-
F
D
-----------
V
V
R
-
F
A
Q
K
A
C
S
N
I
H
I
L
R
L
M
R
E
Q
G
V
K
V
D
S
V
S
L
G
E
I
----
E
R
A
L
A
-
A
G
Y
-
N
PQTH
P
D
D
I
V
F
T
A
D
V
I
D
Q
A
T
L
E
R
V
S
E
L
Q
I
-
P
V
N
A
G
S
V
D
M
L
D
Q
L
G
Q
V
S
----
P
G
H
R
V
W
L
R
V
N
P
G
F
G
H
G
H
S
Q
K
T
N
----
T
--
G
G
E
N
-
S
K
H
G
I
W
--
Y
T
D
L
--
P
--
A
A
L
D
V
I
Q
-
R
H
H
L
Q
L
V
--
G
I
H
M
H
I
G
S
G
V
D
-
Y
A
-----
H
L
E
Q
V
C
G
A
M
V
R
Q
---
V
--
I
E
F
G
Q
----
D
L
Q
A
I
S
A
G
G
G
L
S
V
P
Y
-------
Q
Q
G
E
E
A
-
V
D
T
E
H
Y
Y
G
L
W
N
A
A
R
E
Q
I
A
R
----
H
-----
L
----
G
--
H
P
-----
V
K
L
E
--
I
E
P
G
R
F
L
V
A
Q
S
G
V
L
I
T
Q
V
R
S
V
K
Q
M
------
G
-----
S
-
R
-
H
F
V
L
V
D
A
G
-----
F
N
D
L
M
R
P
A
---
M
Y
G
S
Y
H
H
I
S
A
--
L
A
A
D
G
R
--
S
--
L
E
H
A
P
T
V
E
T
V
V
A
G
P
L
C
E
S
G
D
V
F
T
Q
Q
EG
G
N
V
E
T
R
A
L
-
P
E
-
V
K
A
G
D
Y
L
V
L
H
D
T
G
A
Y
G
A
S
M
-
S
S
N
-
Y
N
S
R
P
L
L
P
E
V
L
F
D
N
G
---------