@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 : SA1164: (2016-03-22 )
MKKLNIALLGLGTVGSGVVKIIEENRQQIQDTLNKDIVIKHILVRDKSKKRPLNISQYHLTEDVNEILNDDSLDIIVEVMGGIEPTVDWLRTALKNKKHVITANKDLLAVHLKLLEDLAEENGVALKFEASVAGGIPIVNAINNGLNANNISKFMGILNGTSNFILSKMTKEQTTFEEALDEAKRLGFAEADPTDDVEGVDAARKVVITSYLSFNQVIKLNDVKRRGISGVTLTDINVADQLGYKIKLIGKGIYENGKVNASVEPTLIDKKHQLAAVEDEYNAIYVIGDAVGDTMFYGKGAGSLATGSAVVSDLLNVALFFESDLHTLPPHFELKTDKTREMMDSDAEINIKEKSNFFVVVNHVKGSIENFENELKAILPFHRSLRVANYDNQSYAAVIVGLESSPEELITKHGYEVDKVYPVEGV
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)
(Ligand)
(Uniprot)
--M-
K
K
L
N
I
A
L
L
G
LGT
V
G
S
G
V
V
K
I
I
E
E
N
R
Q
---------
Q
I
Q
D
---
T
L
N
K
D
I
V
I
-----
K
H
--
I
L
VRD-----------KSKK--------RP------L---N----
I
---
S
-----
Q
-
Y
----
H
L
T
E
-
D
V
N
--
E
I
LN----DD
S
L
D
I
I
V
E
-----
V
MGG-IE---
P
---
T
V
D
W
L
-
R
T
A
LKNK
K
H
V
I
TAN
K
D
L
L
A
V
H
L
K
L
L
E
D
L
--
A
--EEN
G
V
A
-
L
K
F
E
ASVAGGI
P
I
V
N
A
I
NNGL
N
-
A
N
N
-
I
S
K
F
M
G
I
LNGT
S
N
F
I
L
S
K
-MTKE---Q
T
---
T
F
E
E
A
L
D
E
A
K
RLGFAEADPTDDV
E
G
V
D
A
A
R
K
V
V
I
T
SYLSFN
Q
V
I
-
K
-LN
D
V
K
RRGIS
G
V
T
L
T
---------------------DI
N
V
A
D
QL
G
Y
K
I
K
L
I
GKGIYENGKV-------------------NASVEP
T
L
IDKKHQ
L
A
A
VEDEY-
N
A
I
Y
V
I
GDA-VGD
T
M
F
YGKGAGSLA
T
G
S
A
V
V
S
D
L
L
N
V
A
L
FFESDLHTLPP
H
F
E
LK
T
D
K
T
R
E
M
MDSD-A
E
I
N
I
KEKS
N
F
F
V
V
V
N-HVKG
S
I
E
N
F
E
N
E
L
K
A
I
L
P
F
H
R
SLRVAN-YDNQ
S
Y
A
A
V
I
V
GLES
S
P
E
E
L
I
T
KHGYEVD
K
V
YPVEGV----------
44
Fugue
96.39
99%
-111
- C4 -
4PG7
9
?
A:
[20-446]
-H
M
-
K
K
L
N
I
A
L
L
G
L
G
T
V
G
S
G
V
V
K
I
I
E
E
N
R
Q
---------
Q
I
Q
D
---
T
L
N
K
D
I
V
I
-----
K
H
--
I
L
V
R
D
-----------
K
S
K
K
--------
R
P
------
L
---
N
----
I
---
S
-----
Q
-
Y
----
H
L
T
E
-
D
V
N
--
E
I
L
N
----
D
D
S
L
D
I
I
V
E
-----
V
M
G
G
-
I
E
---
P
---
T
V
D
W
L
-
R
T
A
L
K
N
K
K
H
V
I
T
A
N
K
D
L
L
A
V
H
L
K
L
L
E
D
L
--
A
--
E
E
N
G
V
A
-
L
K
F
E
A
S
V
A
G
G
-------------
P
N
N
-
I
S
K
F
M
G
I
L
N
G
T
S
N
F
I
L
S
K
-
M
T
K
E
---
Q
T
---
T
F
E
E
A
L
D
E
A
K
R
L
G
F
A
E
A
D
P
T
D
D
V
E
G
V
D
A
A
R
K
V
V
I
T
S
Y
L
S
F
N
Q
V
I
-
K
-
L
N
D
V
K
R
R
G
I
S
G
V
T
L
T
---------------------
D
I
N
V
A
D
Q
L
G
Y
K
I
K
L
I
G
K
G
I
Y
E
N
G
K
V
-------------------
N
A
S
V
E
P
T
L
I
D
K
K
H
Q
L
A
A
V
E
D
E
Y
-
N
A
I
Y
V
I
G
D
A
-
V
G
D
T
M
F
Y
G
K
G
A
G
S
L
A
T
G
S
A
V
V
S
D
L
L
N
V
A
L
F
F
E
S
---
T
L
P
P
H
F
E
L
K
T
D
K
T
R
E
M
-----------
E
K
S
N
F
F
V
V
V
N
-
H
V
K
G
S
I
E
N
F
E
N
E
L
K
A
I
L
P
F
H
R
S
L
R
V
A
N
-
Y
D
N
Q
S
Y
A
A
V
I
V
G
L
E
S
S
P
E
E
L
I
T
K
H
G
Y
E
V
D
K
V
Y
P
V
E
G
V
----------
18
PsiBlast_CBE
95.04
100%
-113
- C4 -
4PG4
13
?
B:
[21-446]
--
M
-
K
K
L
N
I
A
L
L
G
L
G
T
V
G
S
G
V
V
K
I
I
E
E
N
R
Q
---------
Q
I
Q
D
---
T
L
N
K
D
I
V
I
-----
K
H
--
I
L
V
R
D
-----------
K
S
K
K
--------
R
P
----------
N
----
I
---
S
-----
Q
-
Y
----
H
L
T
E
-
D
V
N
--
E
I
L
N
----
D
D
S
L
D
I
I
V
E
-----
V
M
G
G
-
I
E
---
P
---
T
V
D
W
L
-
R
T
A
L
K
N
K
K
H
V
I
T
A
N
K
D
L
L
A
V
H
L
K
L
L
E
D
L
--
A
--
E
E
N
G
V
A
-
L
K
F
E
A
S
V
A
G
G
I
P
I
V
N
----------
N
-
I
S
K
F
M
G
I
L
N
G
T
S
N
F
I
L
S
K
-
M
T
K
E
---
Q
T
---
T
F
E
E
A
L
D
E
A
K
R
L
G
F
A
E
A
D
P
T
D
D
V
E
G
V
D
A
A
R
K
V
V
I
T
S
Y
L
S
F
N
Q
V
I
-
K
-
L
N
D
V
K
R
R
G
I
S
G
V
T
L
T
---------------------
D
I
N
V
A
D
Q
L
G
Y
K
I
K
L
I
G
K
G
I
Y
E
N
G
K
V
-------------------
N
A
S
V
E
P
T
L
I
D
K
K
H
Q
L
A
A
V
E
D
E
Y
-
N
A
I
Y
V
I
G
---
V
G
D
T
M
F
Y
G
K
G
A
G
S
L
A
T
G
S
A
V
V
S
D
L
L
N
V
A
L
F
---------------------------------
E
K
S
N
F
F
V
V
V
N
-
H
V
K
G
S
I
E
N
F
E
N
E
L
K
A
I
L
P
F
H
R
S
L
R
V
A
N
-
Y
D
N
Q
S
Y
A
A
V
I
V
G
L
E
S
S
P
E
E
L
I
T
K
H
G
Y
E
V
D
K
V
Y
P
V
E
G
V
----------
2
PsiBlast_PDB
94.41
100%
-110
- C4 -
4PG6
11
?
A:
[21-446]
--
M
-
K
K
L
N
I
A
L
L
G
L
G
T
V
G
S
G
V
V
K
I
I
E
E
N
R
Q
---------
Q
I
Q
D
---
T
L
N
K
D
I
V
I
-----
K
H
--
I
L
V
R
D
-----------
K
S
K
K
--------
R
P
------
L
---
N
----
I
---
S
-----
Q
-
Y
----
H
L
T
E
-
D
V
N
--
E
I
L
N
----
D
D
S
L
D
I
I
V
E
-----
V
M
G
G
-
I
E
---
P
---
T
V
D
W
L
-
R
T
A
L
K
N
K
K
H
V
I
T
A
N
K
D
L
L
A
V
H
L
K
L
L
E
D
L
--
A
--
E
E
N
G
V
A
-
L
K
F
E
A
-------------------
N
N
-
I
S
K
F
M
G
I
L
N
G
T
S
N
F
I
L
S
K
-
M
T
K
E
---
Q
T
---
T
F
E
E
A
L
D
E
A
K
R
L
G
F
A
E
A
D
P
T
D
D
V
E
G
V
D
A
A
R
K
V
V
I
T
S
Y
L
S
F
N
Q
V
I
-
K
-
L
N
D
V
K
R
R
G
I
S
G
V
T
L
T
---------------------
D
I
N
V
A
D
Q
L
G
Y
K
I
K
L
I
G
K
G
I
Y
E
N
G
K
V
-------------------
N
A
S
V
E
P
T
L
I
D
K
K
H
Q
L
A
A
V
E
D
E
Y
-
N
A
I
Y
V
I
G
D
A
-
V
G
D
T
M
F
Y
G
K
G
A
G
S
L
A
T
G
S
A
V
V
S
D
L
L
N
V
A
L
F
F
E
------
P
P
H
F
E
L
K
T
D
K
T
R
E
------------
E
K
S
N
F
F
V
V
V
N
-
H
V
K
G
S
I
E
N
F
E
N
E
L
K
A
I
L
P
F
H
R
S
L
R
V
A
N
-
Y
D
N
Q
S
Y
A
A
V
I
V
G
L
E
S
S
P
E
E
L
I
T
K
H
G
Y
E
V
D
K
V
Y
P
V
E
G
V
----------
1
PsiBlast_PDB
93.59
100%
-109
- C4 -
4PG4
13
?
A:
[21-446]
--
M
-
K
K
L
N
I
A
L
L
G
L
G
T
V
G
S
G
V
V
K
I
I
E
E
N
R
Q
---------
Q
I
Q
D
---
T
L
N
K
D
I
V
I
-----
K
H
--
I
L
V
R
D
-----------
K
S
K
K
--------
R
P
------
L
---
N
----
I
---
S
-----
Q
-
Y
----
H
L
T
E
-
D
V
N
--
E
I
L
N
----
D
D
S
L
D
I
I
V
E
-----
V
M
G
G
-
I
E
---
P
---
T
V
D
W
L
-
R
T
A
L
K
N
K
K
H
V
I
T
A
N
K
D
L
L
A
V
H
L
K
L
L
E
D
L
--
A
--
E
E
N
G
V
A
-
L
K
F
E
A
-------------------
N
N
-
I
S
K
F
M
G
I
L
N
G
T
S
N
F
I
L
S
K
-
M
T
K
E
---
Q
T
---
T
F
E
E
A
L
D
E
A
K
R
L
G
F
A
E
A
D
P
T
D
D
V
E
G
V
D
A
A
R
K
V
V
I
T
S
Y
L
S
F
N
Q
V
I
-
K
-
L
N
D
V
K
R
R
G
I
S
G
V
T
L
T
---------------------
D
I
N
V
A
D
Q
L
G
Y
K
I
K
L
I
G
K
G
I
Y
E
N
G
K
V
-------------------
N
A
S
V
E
P
T
L
I
D
K
K
H
Q
L
A
A
V
E
D
E
Y
-
N
A
I
Y
V
I
G
D
A
-
V
G
D
T
M
F
Y
G
K
G
A
G
S
L
A
T
G
S
A
V
V
S
D
L
L
N
V
A
L
F
F
E
----
T
L
P
P
H
F
E
L
K
T
D
K
-------------
I
K
E
K
S
N
F
F
V
V
V
N
-
H
V
K
G
S
I
E
N
F
E
N
E
L
K
A
I
L
P
F
H
R
S
L
R
V
A
N
-
Y
D
N
Q
S
Y
A
A
V
I
V
G
L
E
S
S
P
E
E
L
I
T
K
H
G
Y
E
V
D
K
V
Y
P
V
E
G
V
----------
45
Fugue
72.55
35%
-85
- C4 -
3MTJ
3
?
A:
[5-442]
FQ
G
M
K
P
I
H
V
G
L
L
G
L
G
T
V
G
G
G
T
L
T
V
L
R
R
N
A
E
---------
E
I
T
R
---
R
A
G
R
E
I
R
V
-----
V
R
--
A
A
V
R
N
-----------
L
D
K
A
--------
E
A
------
L
---
A
----
G
---
G
-----
L
------
P
L
T
T
-
N
P
F
--
D
V
V
D
----
D
P
E
I
D
I
V
V
E
-----
L
I
G
G
-
L
E
---
P
---
A
R
E
L
V
M
Q
-
A
I
A
N
G
K
H
V
V
T
A
N
K
H
L
V
A
K
Y
G
N
E
I
F
A
A
--
A
--
Q
A
K
G
V
-
M
V
T
F
E
A
A
V
A
G
G
I
P
I
I
K
A
L
R
E
G
L
T
-
A
N
R
-
I
E
W
L
A
G
I
I
N
G
T
S
N
F
I
L
S
E
M
R
D
-
K
---
G
A
---
A
F
D
D
V
L
K
E
A
Q
R
L
G
Y
A
E
A
D
P
T
F
D
I
E
G
I
D
A
A
H
K
L
T
I
L
S
A
I
A
F
G
-
I
P
M
Q
-
F
E
R
A
Y
T
E
G
I
S
Q
L
T
R
E
---------------------
D
V
R
Y
A
E
E
L
G
Y
R
I
K
L
L
G
I
A
R
R
A
E
N
G
I
-------------------
E
L
R
V
H
P
T
L
I
P
E
R
R
L
I
A
N
V
-
D
G
A
M
N
A
V
L
V
K
G
D
A
-
V
G
P
T
L
Y
Y
G
A
G
A
G
S
E
P
T
A
S
A
V
V
A
D
L
V
D
V
T
R
L
H
T
A
D
P
H
H
R
V
P
H
L
A
F
Q
P
D
Q
L
A
D
T
P
I
L
P
M
E
A
V
----
R
T
A
Y
Y
L
R
L
R
A
F
R
P
G
V
L
A
D
I
T
R
I
L
A
D
-----
S
S
I
S
I
D
A
M
V
Q
K
E
Q
V
D
I
I
L
L
T
-
H
V
T
L
E
K
N
V
N
A
A
I
A
K
I
E
A
L
D
A
V
A
G
K
V
M
R
I
R
L
E
DLG
27
HHSearch
65.29
35%
-81
- C4 -
2EJW
3
?
A:
[1-313]
--
M
-
E
A
L
K
I
A
L
L
G
G
G
T
V
G
S
A
F
Y
N
L
V
L
E
R
A
E
---------
E
L
S
----
A
F
G
V
V
P
R
F
-----
L
G
--
V
L
V
R
D
-----------
P
R
K
P
--------
R
A
------
I
---
P
----
Q
----------------
E
L
L
R
-
A
-
E
--
P
-
F
D
----
L
L
E
A
D
L
V
V
E
-----
A
M
G
G
-
V
E
---
A
---
P
L
R
L
V
-
L
P
A
L
E
A
G
I
P
L
I
T
A
N
K
A
L
L
A
E
A
W
E
S
L
R
P
F
--
A
--
E
E
G
--
L
-
I
Y
H
E
A
S
V
M
A
G
T
P
A
L
S
F
L
E
T
L
R
--
G
S
E
-
L
L
E
L
H
G
I
L
N
G
T
T
L
Y
I
L
Q
E
-
M
E
K
----
G
R
---
T
Y
A
E
A
L
L
E
A
Q
R
L
G
Y
A
E
A
D
P
T
L
D
V
E
G
I
D
A
A
H
K
L
T
L
L
A
R
L
L
V
D
P
G
F
-
P
-
F
A
E
V
E
A
Q
G
I
A
R
L
T
P
E
---------------------
V
L
Q
K
A
E
A
R
G
E
R
V
R
L
V
A
S
L
F
G
E
G
G
R
W
-------------------
R
A
A
V
A
P
R
R
L
P
Q
D
H
P
L
A
R
A
R
G
---
N
A
L
W
V
R
A
R
P
-
L
G
E
A
F
V
T
G
P
G
A
G
G
G
A
T
A
S
G
L
F
A
D
L
L
R
F
L
S
G
A
P
G
H
L
------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
65.14
41%
-82
- C4 -
3MTJ
3
?
A:
[32-351]
---------------------------
N
A
E
---------
E
I
T
R
---
R
A
G
R
E
I
R
V
-----
V
R
--
A
A
V
R
N
-----------
L
D
K
A
--------
E
A
------
L
---
A
--------
G
-----
G
-
L
----
P
L
T
T
-
N
P
F
--
D
V
V
D
----
D
P
E
I
D
I
V
V
E
-----
L
I
G
G
-
L
E
---
P
---
A
R
E
L
V
-
M
Q
A
I
A
N
G
K
H
V
V
T
A
N
K
H
L
V
A
K
Y
G
N
E
I
F
A
A
--
A
--
Q
A
K
G
V
M
-
V
T
F
E
A
A
V
A
G
G
I
P
I
I
K
A
L
R
E
G
L
T
-
A
N
R
-
I
E
W
L
A
G
I
I
N
G
T
S
N
F
I
L
S
E
-
M
R
D
K
---
G
A
---
A
F
D
D
V
L
K
E
A
Q
R
L
G
Y
A
E
A
D
P
T
F
D
I
E
G
I
D
A
A
H
K
L
T
I
L
S
A
I
A
F
G
I
P
M
-
Q
-
F
E
R
A
Y
T
E
G
I
S
Q
L
T
R
E
---------------------
D
V
R
Y
A
E
E
L
G
Y
R
I
K
L
L
G
I
A
R
R
A
E
N
G
I
-------------------
E
L
R
V
H
P
T
L
I
P
E
R
R
L
I
A
N
V
D
G
A
M
-
N
A
V
L
V
K
G
D
A
-
V
G
P
T
L
Y
Y
G
A
G
A
G
S
E
P
T
A
S
A
V
V
A
D
L
V
D
V
T
R
L
H
T
A
D
P
H
H
R
V
P
H
L
A
F
Q
P
D
Q
-----------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
64.66
35%
-90
- C4 -
2EJW
3
?
B:
[1-283]
--
M
-
E
A
L
K
I
A
L
L
G
G
G
T
V
G
S
A
F
Y
N
L
V
L
E
R
A
E
---------
E
L
S
A
---
F
---
G
V
V
P
-----
R
F
LG
V
L
V
R
D
-----------
P
R
K
P
--------
R
-----------
A
----
I
---
P
-----
Q
-
E
----
L
L
R
A
-
E
P
F
--
D
L
L
E
----
A
D
---
L
V
V
E
-----
A
M
G
G
-
V
E
---
A
---
P
L
R
L
V
-
L
P
A
L
E
A
G
I
P
L
I
T
A
N
K
A
L
L
A
E
A
W
E
S
L
R
P
F
--
A
--
E
E
G
--
L
-
I
Y
H
E
A
S
V
M
A
G
T
P
A
L
S
F
L
E
T
-
L
R
-
G
S
E
-
L
L
E
L
H
G
I
L
N
G
T
T
L
Y
I
L
Q
E
-
M
E
K
G
---
R
T
----
Y
A
E
A
L
L
E
A
Q
R
L
G
Y
A
E
A
D
P
T
L
D
V
E
G
I
D
A
A
H
K
L
T
L
L
A
R
L
L
V
D
P
G
F
-
P
-
F
A
E
V
E
A
Q
G
I
A
R
L
T
P
E
---------------------
V
L
Q
K
A
E
A
R
G
E
R
V
R
L
V
A
S
L
F
G
E
G
G
R
W
-------------------
R
A
A
V
A
P
R
R
L
P
Q
D
H
P
L
A
R
A
R
G
---
N
A
L
W
V
R
A
R
P
-
L
G
E
A
F
------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
64.22
35%
-89
- C4 -
2EJW
3
?
A:
[1-283]
--
M
-
E
A
L
K
I
A
L
L
G
G
G
T
V
G
S
A
F
Y
N
L
V
L
E
R
A
E
---------
E
L
S
A
---
F
---
G
V
V
P
-----
R
F
L
G
V
L
V
R
D
-----------
P
R
K
P
--------
R
-----------
A
----
I
---
P
-----
Q
-
E
----
L
L
R
A
-
E
P
F
--
D
L
L
E
----
A
D
---
L
V
V
E
-----
A
M
G
G
-
V
E
---
A
---
P
L
R
L
V
-
L
P
A
L
E
A
G
I
P
L
I
T
A
N
K
A
L
L
A
E
A
W
E
S
L
R
P
F
--
A
--
E
E
G
--
L
-
I
Y
H
E
A
S
V
M
A
G
T
P
A
L
S
F
L
E
T
-
L
R
-
G
S
E
-
L
L
E
L
H
G
I
L
N
G
T
T
L
Y
I
L
Q
E
-
M
E
K
G
---
R
T
----
Y
A
E
A
L
L
E
A
Q
R
L
G
Y
A
E
A
D
P
T
L
D
V
E
G
I
D
A
A
H
K
L
T
L
L
A
R
L
L
V
D
P
G
F
-
P
-
F
A
E
V
E
A
Q
G
I
A
R
L
T
P
E
---------------------
V
L
Q
K
A
E
A
R
G
E
R
V
R
L
V
A
S
L
F
G
E
G
G
R
W
-------------------
R
A
A
V
A
P
R
R
L
P
Q
D
H
P
L
A
R
A
R
G
---
N
A
L
W
V
R
A
R
P
-
L
G
E
A
F
------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_CBE
64.05
35%
-91
- C4 -
2EJW
4
?
E:
[1-283]
--
M
-
E
A
L
K
I
A
L
L
G
G
G
T
V
G
S
A
F
Y
N
L
V
L
E
R
A
E
---------
E
L
S
A
---
F
---
G
V
V
P
-----
R
F
LG
V
L
V
R
D
-----------
P
R
K
P
--------
R
-----------
A
----
I
---
P
-----
Q
-
E
----
L
L
R
A
-
E
P
F
--
D
L
L
E
----
A
D
---
L
V
V
E
-----
A
M
G
G
-
V
E
---
A
---
P
L
R
L
V
-
L
P
A
L
E
A
G
I
P
L
I
T
A
N
K
A
L
L
A
E
A
W
E
S
L
R
P
F
--
A
--
E
E
G
--
L
-
I
Y
H
E
A
S
V
M
A
G
T
P
A
L
S
F
L
E
T
-
L
R
-
G
S
E
-
L
L
E
L
H
G
I
L
N
G
T
T
L
Y
I
L
Q
E
-
M
E
K
G
---
R
T
----
Y
A
E
A
L
L
E
A
Q
R
L
G
Y
A
E
A
D
P
T
L
D
V
E
G
I
D
A
A
H
K
L
T
L
L
A
R
L
L
V
D
P
G
F
-
P
-
F
A
E
V
E
A
Q
G
I
A
R
L
T
P
E
---------------------
V
L
Q
K
A
E
A
R
G
E
R
V
R
L
V
A
S
L
F
G
E
G
G
R
W
-------------------
R
A
A
V
A
P
R
R
L
P
Q
D
H
P
L
A
R
A
R
G
---
N
A
L
W
V
R
A
R
P
-
L
G
E
A
F
------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_CBE
63.82
35%
-88
- C4 -
2EJW
3
?
F:
[1-283]
--
M
-
E
A
L
K
I
A
L
L
G
G
G
T
V
G
S
A
F
Y
N
L
V
L
E
R
A
E
---------
E
L
S
A
---
F
---
G
V
V
P
-----
R
F
LG
V
L
V
R
D
-----------
P
R
K
P
--------
R
-----------
A
----
I
---
P
-----
Q
-
E
----
L
L
R
A
-
E
P
F
--
D
L
L
E
----
A
D
---
L
V
V
E
-----
A
M
G
G
-
V
E
---
A
---
P
L
R
L
V
-
L
P
A
L
E
A
G
I
P
L
I
T
A
N
K
A
L
L
A
E
A
W
E
S
L
R
P
F
--
A
--
E
E
G
--
L
-
I
Y
H
E
A
S
V
M
A
G
T
P
A
L
S
F
L
E
T
-
L
R
-
G
S
E
-
L
L
E
L
H
G
I
L
N
G
T
T
L
Y
I
L
Q
E
-
M
E
K
G
---
R
T
----
Y
A
E
A
L
L
E
A
Q
R
L
G
Y
A
E
A
D
P
T
L
D
V
E
G
I
D
A
A
H
K
L
T
L
L
A
R
L
L
V
D
P
G
F
-
P
-
F
A
E
V
E
A
Q
G
I
A
R
L
T
P
E
---------------------
V
L
Q
K
A
E
A
R
G
E
R
V
R
L
V
A
S
L
F
G
E
G
G
R
W
-------------------
R
A
A
V
A
P
R
R
L
P
Q
D
H
P
L
A
R
A
R
G
---
N
A
L
W
V
R
A
R
P
-
L
G
E
A
F
------------------------------------------------------------------------------------------------------------------------------------------------
47
Fugue
63.79
33%
-76
- C4 -
2EJW
3
?
A:
[1-331]
--
M
-
E
A
L
K
I
A
L
L
G
G
G
T
V
G
S
A
F
Y
N
L
V
L
E
R
A
E
---------
E
L
S
A
---
F
-
G
V
V
P
R
F
-----
L
G
--
V
L
V
R
D
-----------
P
R
K
P
--------
R
A
------
I
---
P
----
Q
---
E
-----
L
-
L
----
R
------
A
--
E
P
F
D
----
L
L
E
A
D
L
V
V
E
-----
A
M
G
G
-
V
E
---
A
---
P
L
R
L
V
-
L
P
A
L
E
A
G
I
P
L
I
T
A
N
K
A
L
L
A
E
A
W
E
S
L
R
P
F
--
A
--
E
E
G
L
I
Y
---
H
E
A
S
V
M
A
G
T
P
A
L
S
F
L
E
-
T
L
R
-
G
S
E
-
L
L
E
L
H
G
I
L
N
G
T
T
L
Y
I
L
Q
E
-
M
E
-
K
---
G
R
---
T
Y
A
E
A
L
L
E
A
Q
R
L
G
Y
A
E
A
D
P
T
L
D
V
E
G
I
D
A
A
H
K
L
T
L
L
A
R
L
L
V
D
P
G
F
-
P
-
F
A
E
V
E
A
Q
G
I
A
R
L
T
P
E
---------------------
V
L
Q
K
A
E
A
R
G
E
R
V
R
L
V
A
S
L
F
G
E
G
G
R
W
-------------------
R
A
A
V
A
P
R
R
L
P
Q
D
H
P
L
A
R
A
R
G
---
N
A
L
W
V
R
A
R
P
-
L
G
E
A
F
V
T
G
P
G
A
G
G
G
A
T
A
S
G
L
F
A
D
L
L
R
F
L
S
G
A
P
G
H
L
P
A
P
R
A
R
P
P
L
E
E
G
S
P
W
P
G
V
------------------------------------------------------------------------------------------------
23
HHSearch
63.07
34%
-82
- C4 -
3DO5
3
?
A:
[2-325]
-----
M
I
K
I
A
I
V
G
F
G
T
V
G
Q
G
V
A
E
L
L
I
R
K
R
E
---------
E
I
E
K
---
A
-
I
G
E
F
K
V
-----
T
A
--
V
A
D
S
K
-----------
S
S
I
S
--------
G
D
------
F
S
L
-
V
E
A
L
R
M
K
R
E
T
-----
G
M
L
----
R
D
D
A
-
K
A
I
--
E
V
V
R
----
S
A
D
Y
D
V
L
I
E
-----
A
S
V
T
R-----
E
---
G
V
N
Y
I
-
R
E
A
L
K
R
G
K
H
V
V
T
S
N
K
G
P
L
V
A
E
F
H
G
L
M
S
L
--
A
--
E
R
N
G
V
R
-
L
M
Y
E
A
T
V
G
G
A
M
P
V
V
K
L
A
K
R
Y
L
A
-
L
C
E
-
I
E
S
V
K
G
I
F
N
G
T
C
N
Y
I
L
S
R
-
M
E
E
E
---
R
L
---
P
Y
E
H
I
L
K
E
A
Q
E
L
G
Y
A
E
A
D
P
S
Y
D
V
E
G
I
D
A
A
L
K
L
V
I
I
A
N
T
I
-
G
V
K
A
-
S
-
Y
E
D
V
E
V
T
G
I
T
Q
I
T
P
E
---------------------
A
F
Q
V
A
A
E
K
G
Y
T
I
R
L
I
A
E
V
S
R
----
E
-------------------
K
L
K
V
S
P
R
L
V
P
F
H
H
P
L
A
-
I
K
G
T
M
-
N
A
A
M
F
K
T
D
T
-
A
G
S
I
F
V
A
G
R
G
A
G
K
E
E
T
A
S
A
I
L
S
D
L
Y
E
I
Y
A
G
-----------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
62.83
35%
-76
- C4 -
3DO5
3
?
A:
[3-322]
------
I
K
I
A
I
V
G
F
G
T
V
G
Q
G
V
A
E
L
L
I
R
K
R
E
---------
E
I
E
K
---
A
I
G
E
F
K
V
T
A
V
A
D
S
K
S
--
S
I
S
G
D
-----------
F
S
L
V
--------
E
A
------
L
---
R
----
M
---
K
-----
R
-
E
TG--
M
L
R
D
-
D
A
K
A
I
E
V
V
R
----
S
A
D
Y
D
V
L
I
E
ASVTR----------
E
---
G
V
N
Y
I
-
R
E
A
L
K
R
G
K
H
V
V
T
S
N
K
G
P
L
V
A
E
F
H
G
L
M
S
L
--
A
--
E
R
N
G
V
R
-
L
M
Y
E
A
T
V
G
G
A
M
P
V
V
K
L
A
K
R
Y
L
A
-
L
C
E
-
I
E
S
V
K
G
I
F
N
G
T
C
N
Y
I
L
S
R
-
M
E
E
E
---
R
L
---
P
Y
E
H
I
L
K
E
A
Q
E
L
G
Y
A
E
A
D
P
S
Y
D
V
E
G
I
D
A
A
L
K
L
V
I
I
A
N
-
T
I
G
V
K
A
-
S
-
Y
E
D
V
E
V
T
G
I
T
Q
I
T
P
E
---------------------
A
F
Q
V
A
A
E
K
G
Y
T
I
R
L
I
A
E
V
S
R
E
K
L
K
V
-------------------
S
----
P
R
L
V
P
F
H
H
P
L
-
A
I
K
G
T
M
-
N
A
A
M
F
K
T
D
T
-
A
G
S
I
F
V
A
G
R
G
A
G
K
E
E
T
A
S
A
I
L
S
D
L
Y
E
I
--------------------------------------------------------------------------------------------------------------------------
26
HHSearch
62.49
27%
-77
- C4 -
3C8M
4
?
A:
[4-328]
--
M
-
K
T
I
N
L
S
I
F
G
L
G
N
V
G
L
N
L
L
R
I
I
R
S
F
N
E
---------
E
--
N
---
R
L
G
L
K
F
N
V
-----
V
F
--
V
A
D
S
L
-----------
H
S
Y
Y
--------
N
E
RID
I
G
K
V
I
S
Y
K
E
---
K
---
G
-----
S
-
L
DSLE
Y
E
S
I
-
S
A
S
--
E
A
L
A
-----
R
D
F
D
I
V
V
D
-----
A
T
P
A
-
S
A
DG
K
K
---
E
L
A
F
Y
-
K
E
T
F
E
N
G
K
D
V
V
T
A
N
K
S
G
L
A
N
F
W
P
E
I
M
E
Y
--
A
--
R
S
N
N
R
R
-
I
R
Y
E
A
T
V
A
G
G
V
P
L
F
S
F
I
D
Y
S
V
L
-
P
S
R
-
I
K
K
F
R
G
I
V
S
L
T
I
N
Y
F
I
R
E
-
L
A
N
----
K
R
---
E
F
D
D
V
L
S
E
A
T
K
L
G
I
V
E
K
N
Y
K
D
D
L
T
G
L
D
A
A
R
K
S
V
I
L
C
N
H
L
Y
G
S
S
Y
-
R
-
L
S
D
V
F
Y
E
G
I
L
-
Q
------------------------
D
R
S
----
F
G
K
N
E
R
L
V
T
E
T
G
I
V
N
G
K
P
-------------------
S
A
E
S
R
I
K
S
L
D
S
N
D
Y
L
L
T
L
G
K
G
S
-
L
G
Y
Q
L
Q
T
D
T
-
N
G
T
L
N
V
S
D
L
Y
D
G
P
Y
E
T
A
G
A
V
M
N
D
L
V
I
L
S
M
------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
59.66
28%
-81
- C4 -
4XB1
4
?
A:
[18-331]
-----
K
V
N
I
S
I
F
G
F
G
T
V
G
R
A
L
A
E
I
I
A
E
K
S
R
IFG
V
E
L
N
V
I
S
I
T
D
RS
G
T
I
W
G
D
F
D
L
-----
L
E
--
A
K
E
V
K
-----------
E
S
T
G
--------
K
L
------
S
---
N
----
I
---
G
-----
D
-
Y
----
E
V
Y
N
F
S
P
Q
--
E
L
V
E
----
E
V
K
P
N
I
L
V
D
-----
V
S
S
W
-
D
E
---
A
---
H
-
E
M
Y
-
K
V
A
L
G
E
G
I
S
V
V
T
S
N
K
P
P
I
A
N
Y
Y
D
E
L
M
N
L
--
A
--
K
E
N
N
A
G
-
I
F
F
E
S
T
V
M
A
G
T
P
I
I
G
V
L
R
E
N
L
L
-
G
E
N
-
I
K
R
I
D
A
V
V
N
A
S
T
T
F
I
L
T
K
-
M
S
-
E
---
G
K
---
T
L
D
D
A
I
E
E
A
K
S
L
G
I
L
E
E
D
P
S
K
D
I
D
G
I
D
A
Y
Y
K
A
K
I
L
H
W
V
S
Y
G
E
---
P
-
P
E
E
E
E
R
L
G
I
R
E
V
------------------------------
R
D
A
R
N
V
R
L
V
A
Q
--
V
S
K
G
K
I
---------------------
S
V
K
P
R
K
L
S
S
D
N
P
L
-
L
V
E
G
V
Q
-
N
A
A
V
I
R
T
N
N
-
L
G
E
V
I
L
K
G
P
G
G
G
G
R
V
T
A
S
G
V
F
T
D
I
I
K
A
T
L
K
F
----------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
59.64
28%
-83
- C4 -
4XB2
3
?
A:
[18-331]
-----
K
V
N
I
S
I
F
G
F
G
T
V
G
R
A
L
A
E
I
I
A
E
K
S
R
IFG
V
E
L
N
V
I
S
I
T
D
RS
G
T
I
W
G
D
F
D
L
-----
L
E
--
A
K
E
V
A
-----------
E
S
T
G
--------
K
L
------
S
---
N
----
I
---
G
-----
D
-
Y
----
E
V
Y
N
F
S
P
Q
--
E
L
V
E
----
E
V
K
P
N
I
L
V
D
-----
V
S
S
W
-
D
E
---
A
---
H
-
E
M
Y
-
K
V
A
L
G
E
G
I
S
V
V
T
S
N
K
P
P
I
A
N
Y
Y
D
E
L
M
N
L
--
A
--
K
E
N
N
A
G
-
I
F
F
E
S
T
V
M
A
G
T
P
I
I
G
V
L
R
E
N
L
L
-
G
E
N
-
I
K
R
I
D
A
V
V
N
A
S
T
T
F
I
L
T
K
-
M
S
-
E
---
G
K
---
T
L
D
D
A
I
E
E
A
K
S
L
G
I
L
E
E
D
P
S
K
D
I
D
G
I
D
A
Y
Y
K
A
K
I
L
H
W
V
S
Y
G
E
---
P
-
P
E
E
E
E
R
L
G
I
R
E
V
------------------------------
R
D
A
R
N
V
R
L
V
A
Q
--
V
S
K
G
K
I
---------------------
S
V
K
P
R
K
L
S
S
D
N
P
L
-
L
V
E
G
V
Q
-
N
A
A
V
I
R
T
N
N
-
L
G
E
V
I
L
K
G
P
G
G
G
G
R
V
T
A
S
G
V
F
T
D
I
I
K
A
T
L
K
F
----------------------------------------------------------------------------------------------------------------------
25
HHSearch
58.00
24%
-75
- C4 -
3ING
8
?
A:
[3-323]
----
K
E
I
R
I
I
L
M
G
T
G
N
V
G
L
N
V
L
R
I
I
D
A
S
N
R
---------
R
------
R
--
F
S
I
K
V
-----
V
G
--
V
S
D
S
R
-----------
S
Y
A
S
G
RNLD
I
--
S
S
------
I
---
I
S
---
N
K
--
E
K
TGRI
S
-
D
----
R
A
F
S
-
G
P
E
--
D
L
M
-----
G
E
A
A
D
L
L
V
D
-----
C
T
P
A
-
S
R
---
D
G
V
R
E
Y
S
L
Y
-
R
M
A
F
E
S
G
M
N
V
V
T
A
N
K
S
G
L
A
N
K
W
H
D
I
M
D
S
--
A
--
N
Q
N
S
K
Y
-
I
R
Y
E
A
T
V
A
G
G
V
P
L
F
S
V
L
D
Y
S
I
L
-
P
S
K
-
V
K
R
F
R
G
I
V
S
S
T
I
N
Y
V
I
R
N
-
M
A
N
----
G
R
---
S
L
R
D
V
V
D
D
A
I
K
K
G
I
A
E
S
N
P
Q
D
D
L
N
G
L
D
A
A
R
K
S
V
I
L
V
N
H
I
F
G
T
E
Y
-
T
-
L
N
D
V
E
Y
S
G
V
D
E
R
S
------------------------------
Y
N
A
N
D
R
L
V
T
E
V
Y
V
D
D
R
R
P
-------------------
V
A
V
S
R
I
I
S
L
N
K
D
D
F
L
M
S
I
G
M
D
G
-
L
G
Y
Q
I
E
T
D
S
-
N
G
T
V
N
V
S
D
I
Y
D
G
P
Y
E
T
A
G
A
V
V
N
D
I
L
L
L
S
K
V
-----------------------------------------------------------------------------------------------------------------------
24
HHSearch
57.73
23%
-78
- C4 -
1EBF
2
DHOM_YEAST
A:
[2-357]
--
T
-
K
V
V
N
V
A
V
I
G
A
G
V
V
G
S
A
F
L
D
Q
L
L
A
M
K
S
---------
T
I
-------
T
Y
N
L
V
L
-----
L
A
--
E
A
E
R
S
-----------
L
I
S
K
DFSPLNVG
S
D
------
W
---
K
A
A
--
L
---
A
A
----
S
-
T
----
T
K
T
L
-
P
L
D
--
D
L
I
A
H
L
K
T
S
P
K
P
V
I
L
V
D
-----
N
T
S
S
-
A
----
Y
---
I
A
G
F
Y
-
T
K
F
V
E
N
G
I
S
I
A
T
P
N
K
K
A
F
S
S
D
L
A
T
W
K
A
L
--
F
SN
K
P
T
N
G
F
-
V
Y
H
E
A
T
V
G
A
G
L
P
I
I
S
F
L
R
E
I
I
Q
T
G
D
E
-
V
E
K
I
E
G
I
F
S
G
T
L
S
Y
I
F
N
E
-
F
S
T
S
QAN
D
V
---
K
F
S
D
V
V
K
V
A
K
K
L
G
Y
T
E
P
D
P
R
D
D
L
N
G
L
D
V
A
R
K
V
T
I
V
G
R
I
S
-
G
V
E
V
-
E
S
P
T
S
F
P
V
Q
S
L
I
P
K
P
L
E
SVKS
A
D
E
F
L
E
K
L
S
DYD
K
D
L
T
Q
L
K
K
E
A
A
T
E
N
K
V
L
R
F
I
G
K
V
D
V
A
T
--
K
-------------------
S
V
S
V
G
I
E
K
Y
D
Y
S
H
P
F
A
S
L
K
G
S
D
-
N
V
I
S
I
K
T
K
R
Y
T
N
P
V
V
I
Q
G
A
G
A
G
A
A
V
T
A
A
G
V
L
G
D
V
I
K
I
A
Q
R
-----------------------------------------------------------------------------------------------------------------------
48
Fugue
55.01
23%
-75
- C4 -
1EBF
2
DHOM_YEAST
A:
[1-358]
-S
T
-
K
V
V
N
V
A
V
I
G
A
G
V
V
G
S
A
F
L
D
Q
L
L
A
M
K
S
---------
T
I
T
Y
---
N
L
V
L
L
A
E
A
-----
E
R
--
S
L
I
S
K
DFSPLNVGSD
W
K
A
A
L
--------
A
A
------
S
---
T
----
T
---
K
-----
T
-
L
----
P
L
D
D
-
L
I
A
--
H
L
K
T
----
S
P
K
P
V
I
L
V
D
-----
N
T
S
S
--
A
---
Y
---
I
A
G
F
Y
-
T
K
F
V
E
N
G
I
S
I
A
T
P
N
K
K
A
F
S
S
D
L
A
T
W
K
A
L
F
S
N
--
K
P
T
N
G
F
-
V
Y
H
E
A
T
V
G
A
G
L
P
I
I
S
F
L
R
E
I
I
Q
-
T
G
D
E
V
E
K
I
E
G
I
F
S
G
T
L
S
Y
I
F
N
E
-
F
S
T
S
---
Q
A
NDV
K
F
S
D
V
V
K
V
A
K
K
L
G
Y
T
E
P
D
P
R
D
D
L
N
G
L
D
V
A
R
K
V
T
I
V
G
R
I
S
G
V
E
V
E
-
S
-
P
T
S
F
P
V
Q
S
L
I
P
K
P
L
E
---------------------
S
V
K
S
A
D
E
F
L
E
K
L
S
D
Y
D
K
D
L
T
Q
L
K
K
E
A
A
T
E
N
K
V
L
R
F
I
G
K
V
D
VATK
S
V
S
V
G
I
E
K
Y
D
Y
S
H
P
F
A
S
L
K
G
S
D
-
N
V
I
S
I
K
T
K
R
Y
T
N
P
V
V
I
Q
G
A
G
A
G
A
A
V
T
A
A
G
V
L
G
D
V
I
K
I
A
Q
R
L
----------------------------------------------------------------------------------------------------------------------