@TOME V3
(Feb 2022)
Ref.
-
-
Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
3D Alignment Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
3D Alignment 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 Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
PDB Ligands
Affinity Score
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:
Sequence Alignment
Tab of Complexes
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : D6TPR2_9CHLR: (2019-01-27 )
MLFENESMGFNHDEICATWNIPPLVSVQKPLTGTIHNVFLLTTREAKYVLRIYSYPPEKRFRIVNEHAIARYVQSHHLPAIAPLPISSGCETFLERDGHFYALYPFAQGEQLSRAMLNSNQSHVGEIISAMGHSLAEVHLVLSSYCLPTTRPLSLVVNREQTIAKIEELEIVIPAKEALDDLDQRVLSALRARKQYLLTASDVDVSELNALPWQPLHGDFQETNLFFSHGRVSAIIDWDQACSGPRAWEILRTLHYVFALDPSRCQRFLEAYQQVFPLPMEVLHLTAKVYTWVQLNNLWGWRSYYLDNNQSLRQLLSTSDSQPFTTRWAQLAKML
Atome Classification :
(22 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...-----------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
------------------MLFENESM-GFNHD
E
I
C
-ATWN-I--P-P-L--
V
S
VQ--KPL-TG
T
I
H
N
V
F
L
--
L
T
---------T-R--------E
A
--------
K
Y
V
L
R
I
Y-S--Y
P
P
------
E
K
R
----
F
R
I
-
V
N
E
H
A
I
A
R
Y
V
Q
S-HH--LP--AIAPLPI
S
S
G
C
E
T
F
L
ER----DG
H
F
Y
A
L
Y
PFAQ
G
E
Q
L
S
R
A
M
-L---------NS--------
N
Q
S
H
V
G
E
I
I
S
A
M
G
H
S
L
A
E
V
H
L
V
L
S
SYCLPTT---R
P
---
L
-
S
-
L
---
V
VN--R
E
Q
T
I
A
K
---
I
E
E
L
E
I
V
I---P------
A
-----
K
---
E
A
----
L
D
D
L
D
----
Q
R
V
---
L
S
A
L
R
A
R
K
Q
Y
L
L
TASDV
D
-
V
-
S
E
LN-----ALPWQP------LHGDFQET
N
L
F
F--S-H--G----
R
V
S
A
I
I
D
W
D
QACSG
P
R
A
W
E
I
L
R
T
L
-
H
-----------------
Y
V
--F-AL-------------
D
P
-------------
S
R
C
Q
R
-------
F
L
E
A
Y
Q
Q
--VF------PL
P
M
------
E
V
L
H
L
T
A
K
V
Y
T
W
V
Q
LNNL-WG
W
R
S
YYLD
N
N
Q
S
L
R
Q
L
L
S
TSDS-------QP
F
T
T
R
W
A
Q
L
A
KML-----------------------------------------------
23
HHSearch
81.55
20%
-106
- C5 -
-
2PPQ
-
KHSE_AGRFC
A:
[5-268]
----------------------
T
D
I
T
-
E
D
E
L
R
N
F
L
-
T
Q
Y
D
-
V
--
G
-
S
-
L
--
T
S
Y
K
--
G
I
A
-
E
---
N
S
N
F
L
--
L
H
---------
T
-
T
--------
K
D
--------
P
L
I
L
T
L
Y
-
E
--
K
--------
K
N
D
------
L
-
P
F
F
L
G
L
M
Q
H
L
A
A
-
K
G
--
L
S
--
C
P
L
P
L
P
R
K
D
G
E
-
L
L
G
E
L
----
S
G
R
P
A
A
L
I
S
F
L
E
G
M
W
L
R
K
---
P
---------
E
A
--------
K
H
------
C
R
E
V
G
K
A
L
A
A
M
H
L
A
S
E
G
F
E
I
K
R
P
---
N
A
L--
S
-
V
-
D
---
G
W
-------
K
V
L
---
W
D
K
S
E
E
R
A
---
D
-----------------
E
----
V
E
K
G
L
----
R
E
E
---
I
R
P
E
I
D
Y
L
----
A
A
-------
H
W
P
K
-----
D
L
P
A
G
V
------
I
H
A
D
L
F
Q
D
N
V
F
F
--
L
-
G
--
D
----
E
L
S
G
L
I
D
F
Y
F
A
C
N
D
L
L
A
Y
D
V
S
I
C
L
-
N
-----------------
A
W
--
C
-
F
E
KDGAY--------
N
V
-------------
T
K
G
K
A
-------
L
L
E
G
Y
Q
S
--
V
R
------
P
L
S
E
------
A
E
L
E
A
L
P
L
L
-----------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
80.72
25%
-40
- C5 -
-
2PPQ
-
KHSE_AGRFC
A:
[19-257]
--------------------------------------
Y
D
-
V
--
G
-
S
-
L
--
T
S
Y
K
--
G
I
A
-
E
---
N
S
N
F
L
--
L
H
---------
T
-
T
--------
K
D
--------
P
L
I
L
T
L
Y
-
E
--
K
---------
K
N
D
L
P
F
F
L
G
-
L
M
Q
H
L
A
A
K
------
G
--
L
S
--
C
P
L
P
L
P
R
K
D
G
-
E
L
L
G
E
L
----
S
G
R
P
A
A
L
I
S
F
L
E
G
M
W
L
R
K
--------------
P
--------
E
A
K
H
C
R
E
V
----
G
K
A
L
A
A
M
H
L
--
A
S
E
G
F
E
I
K
---
R
P
---
N
-
A
-
L
---
S
V
D
--
G
W
K
V
L
W
D
---
K
S
E
-------------------------
E
R
----
A
D
E
V
E
----
K
G
L
---
R
E
E
I
R
P
E
I
D
Y
L
A
A
H
W
P
K
D
-------------
L
P
A
G
V
------
I
H
A
D
L
F
Q
D
N
V
F
F
--
L
-
G
--
D
----
E
L
S
G
L
I
D
F
Y
F
A
C
N
D
L
L
A
Y
D
V
S
I
C
L
-
N
A
----------------
W
C
--
F
-
E
K
-------------
D
G
AYN
V
---------
T
K
G
K
A
-------
L
L
E
G
Y
Q
S
--
V
R
------
P
L
----------------------------------------------------------------------------------------------------------------------
61
Fugue
78.57
16%
-10
- C5 -
-
4OCV
2
?
A:
[24-378]
-------------------------
T
-
N
E
A
L
F
D
V
A
-
S
H
F
A
-
L
--
E
-
G
-
T
--
V
D
S
I
--
E
P
Y
G
D
G
H
I
N
T
T
Y
L
--
V
T
---------
T
-
D
--------
G
P
--------
R
Y
I
L
Q
R
M
-
N
TG
I
F
P
------
D
T
V
----
N
L
M
-
R
N
V
E
L
V
T
S
T
L
K
A
-
Q
G
--
K
E
--
T
L
D
I
V
R
T
T
S
G
-
D
T
W
A
E
I
----
D
G
G
A
W
R
V
Y
K
F
I
E
H
------
T
-
M
---------
S
Y
--------
N
L
V
P
N
P
D
V
F
R
E
A
G
R
A
F
G
D
F
Q
N
F
L
S
G
F
--
D
A
N
---
Q
L
---
T
-
E
-
T
---
I
A
H
--
F
H
D
T
P
H
R
---
F
E
D
F
K
K
A
L
---
A
------
A
-----
D
---
E
L
GR--
A
A
G
C
G
----
P
E
I
---
E
F
Y
L
S
H
A
D
Q
Y
A
V
V
M
D
G
L
R
-
D
----
G
-----
S
I
P
L
R
V
------
T
H
N
D
T
K
L
N
N
I
L
M
DA
T
-
T
--
G
----
K
A
R
A
I
I
D
L
D
T
I
M
P
G
S
M
L
F
D
F
G
D
S
I
-
R
-----------------
F
G
AS
T
-
A
L
-------------
E
D
-------------
E
R
D
L
D
K
V
H
F
S
T
E
L
F
R
A
Y
T
E
--
G
F
------
V
G
E
L
R
DSIT
A
R
E
A
E
L
L
P
F
S
G
N
L
L
T
M
E
C
G
-
M
R
F
L
A
D
Y
L
E
G
D
V
Y
F
A
T
K
Y
P
E
H
N
L
-------
V
R
S
R
T
Q
I
K
L
V
R
E
M
E
Q
R
A
D
E
T
R
A
I
V
A
D
V
M
E
T
T------------------------------
52
Fugue
73.71
15%
-11
* C5 *
-
1ZYL
-
SRKA_ECOLI
A:
[4-328]
------------------
S
A
F
T
F
Q
T
L
H
P
D
T
I
M
D
A
L
-
F
E
H
G
-
I
--
R
-
V
-
D
--
S
G
L
T
--
P
L
N
-
S
Y
E
N
R
V
Y
Q
F
--
Q
D
---------
E
-
D
--------
R
R
--------
R
F
V
V
K
F
Y
-
R
--
P
E
R
------
W
T
A
----
D
Q
I
-
L
E
E
H
Q
F
A
L
Q
L
V
N
-
D
E
--
V
P
--
V
--
A
A
P
V
A
F
N
G
Q
T
L
L
N
H
----
Q
G
F
Y
F
A
V
F
P
S
V
G
G
R
Q
F
--------------------------
E
A
D
N
I
D
Q
M
E
A
V
G
R
Y
L
G
R
M
H
Q
T
G
R
K
Q
L
F
I
H
R
---
P
T
---
I
-
G
-
L
---
N
E
Y
--
L
I
E
P
R
K
L
---
F
E
D
A
T
L
I
P
---
S
G-----
L
-----
K
---
A
A
----
F
L
K
A
T
----
D
E
L
---
I
A
A
V
T
A
H
W
R
---------------
E
-----
D
F
T
V
L
R
------
L
H
G
D
C
H
A
G
N
I
L
W
--
R
-
D
--
G
------
P
M
F
V
D
L
D
D
A
R
N
G
P
A
V
Q
D
L
W
M
L
L
-
N
-----------------
G
D
--
K
-
A
E
-------------
Q
R
-------------
M
Q
L
E
T
-------
I
I
E
A
Y
E
E
--
F
S
------
E
F
D
T
------
A
E
I
G
L
I
E
P
L
R
A
M
R
L
V
Y
Y
L
-
A
-
W
L
M
R
R
W
A
D
P
A
F
P
K
N
F
P
W
L
T
G
E
-------
D
Y
W
L
R
Q
T
A
T
F
I
E
Q
A
K
V
L
Q
EPPLQLTPMY---------------------------------
27
HHSearch
70.47
15%
-15
- C5 -
-
4WH3
8
NAHK_BIFL2
A:
[4-293]
-------------------------
S
-
N
E
V
L
F
G
I
A
-
S
H
F
A
-
L
--
E
G
A
-
V
--
T
G
I
E
--
P
Y
G
-
D
G
H
I
N
T
T
Y
L
--
V
T
---------
T
-
D
--------
G
P
--------
R
Y
I
L
Q
Q
M
-
N
--
T
S
I
FPD
T
--
V
N
L
------
M
-
R
N
V
E
L
V
T
S
T
L
K
A
-
Q
G
--
K
E
--
T
L
D
I
V
P
T
T
S
G
A
-
T
W
A
E
I
----
D
G
G
A
W
R
V
Y
K
F
I
E
H
T
V
S
Y
N
L
V
-
P
---------
N
P
--------
D
V
------
F
R
E
A
G
S
A
F
G
D
F
Q
N
F
L
S
E
F
D
A
S
Q
L
---
T
E
---
T
-------
I
A
H
--
F
H
D
T
P
H
R
---
F
E
D
F
K
A
A
L
---
A
------
A
DKLGR
A
---
A
A
----
C
Q
P
E
I
----
D
F
Y
L
S
H
A
D
Q
Y
A
V
V
M
----
D
G
-------
L
R
D
G
-----
S
I
P
L
R
V
------
T
H
N
D
T
K
L
N
N
I
L
M
--
D
-
A
TT
G
----
K
A
R
A
I
I
D
L
D
T
I
M
P
G
S
M
L
F
D
F
G
D
S
I
-
R
-----------------
F
G
--
A
-
S
T
ALEDEKDLSK
V
H
F
S
T
-------------
E
L
F
R
A
-------
Y
T
E
G
F
V
G
E
L
R
G
------
S
I
T
A
------
R
E
A
E
L
L
P
-------------------------------------------------------------------------------------------------------
25
HHSearch
70.46
14%
-17
- C5 -
-
4OCV
2
?
A:
[24-314]
-------------------------
T
-
N
E
A
L
F
D
V
A
-
S
H
F
A
-
L
--
E
G
T
-
V
--
D
S
I
E
--
P
Y
G
-
D
G
H
I
N
T
T
Y
L
--
V
T
---------
T
-
D
--------
G
P
--------
R
Y
I
L
Q
R
M
-
N
--
T
G
I
FPD---
T
V
N
------
L
M
R
N
V
E
L
V
T
S
T
L
K
A
-
Q
G
--
K
E
--
T
L
D
I
V
R
T
T
S
G
D
-
T
W
A
E
I
----
D
G
G
A
W
R
V
Y
K
F
I
E
H
T
M
S
Y
N
L
V
-
P
---------
N
P
--------
D
V
------
F
R
E
A
G
R
A
F
G
D
F
Q
N
F
L
S
G
F
D
A
N
Q
L
---
T
E
---
T
-
I
-
A
HFH
D
T
---
P
H
R
F
E
D
F
---
K
K
A
L
A
A
D
E
L--
G
------
R
-----
A
---
A
G
----
C
G
P
E
I
----
E
F
Y
---
L
S
H
A
D
Q
Y
A
V
V
-
M
D
G
-------
L
R
D
G
-----
S
I
P
L
R
V
------
T
H
N
D
T
K
L
N
N
I
L
M
--
D
-
A
TT
G
----
K
A
R
A
I
I
D
L
D
T
I
M
P
G
S
M
L
F
D
F
G
D
S
I
-
R
-----------------
F
G
--
A
-
S
T
ALEDERDLDK
V
H
F
S
T
-------------
E
L
F
R
A
-------
Y
T
E
G
F
V
G
E
L
R
D
------
S
I
T
A
------
R
E
A
E
L
L
P
F
------------------------------------------------------------------------------------------------------
22
HHSearch
69.14
13%
-50
- C5 -
-
2Q83
4
COTI_BACSU
A:
[21-321]
----------------------------
E
L
A
E
N
V
L
-
Q
G
W
D
-
V
----
Q
-
A
--
E
K
I
D
--
V
I
Q
-----
A
L
V
W
K
--
V
H
---------
T
-
D
--------
S
G
--------
A
V
C
L
K
R
I
-
H
--
R
P
-------
E
K
K
------
A
-
L
F
S
I
F
A
Q
D
Y
L
A
K
-
K
G
--
M
N
--
V
P
G
I
L
P
N
K
K
G
S
-
L
Y
S
K
H
----
G
S
F
L
F
V
V
Y
D
W
I
E
G
R
P
F
E
L
---
T
---------
V
K
--------
Q
D
------
L
E
F
I
M
K
G
L
A
D
F
H
T
A
S
V
G
Y
Q
P
P
N
G
---
V
P
I
F
T
K
-
L
-
G
---
R
W
---
P
N
H
Y
T
K
R
---
C
K
Q
M
E
T
W
K
---
L
M
A
E
A
E
K
E
-----
D
---
P
F
S
Q
L
-
Y
L
Q
E
I
----
D
G
F
---
I
E
D
G
L
R
I
K
D
R
L
L
Q
S
T
-
Y
V
-
P
W
T
E
Q
L
-----
K
K
S
P
N
L
------
C
H
Q
D
Y
G
T
G
N
T
L
L
--
G
-
E
--
N
----
E
Q
I
W
V
I
D
L
D
T
V
S
F
D
L
P
I
R
D
L
R
K
M
I
-
I
-----------------
P
L
--
L
-
D
T
TGVW---------
D
D
-------------
E
T
F
N
V
-------
M
L
N
A
Y
E
S
--
R
A
------
P
L
T
E
------
E
Q
K
Q
V
M
F
I
-
D
M
L
-
F
P
Y
E
L
-
Y
D
V
I
R
E
K
Y
V
R
K
S
-------------------------------------------------------------------------------
28
HHSearch
68.23
18%
-40
- C5 -
-
1ZYL
-
SRKA_ECOLI
A:
[9-269]
----------------------
Q
T
L
H
-
P
D
T
I
M
D
A
L
-
F
E
H
G
-
I
--
R
-
V
-
D
--
S
G
L
T
--
P
L
--
N
S
Y
E
N
R
V
Y
Q
--
F
Q
---------
D
-
E
D-------
R
R
--------
R
F
V
V
K
F
Y
-
R
--
P
E
R
WT----
A
D
Q
------
I
-
L
E
E
H
Q
F
A
L
Q
L
V
N
-
D
E
--
V
P
--
V
A
A
P
V
A
F
-
N
G
Q
-
T
L
L
N
H
----
Q
G
F
Y
F
A
V
F
P
S
V
G
G
R
Q
F
E
A
---
D
---------
N
I
--------
D
Q
------
M
E
A
V
G
R
Y
L
G
R
M
H
Q
T
G
R
K
Q
L
F
I
H
R
---
P
------------
T
I
G
--
L
N
E
Y
L
I
E
---
P
R
K
L
F
E
D
A
---
T
------
L
I----
P
---
S
G
----
L
K
A
A
F
----
L
K
A
---
T
D
E
L
I
A
A
V
----
T
A
-------
H
W
R
E
-----
D
F
T
V
L
R
------
L
H
G
D
C
H
A
G
N
I
L
W
--
R
-
D
--------
G
P
M
F
V
D
L
D
D
A
R
N
G
P
A
V
Q
D
L
W
M
L
L
-
N
-----------------
G
D
--
K
-
A
E
-------------
Q
R
-------------
M
Q
L
E
T
-------
I
I
E
A
Y
E
E
--
F
S
------
E
F
D
T
------
A
E
I
G
L
I
E
P
L
-----------------------------------------------------------------------------------------------------
42
SP3
68.21
11%
-105
- C5 -
-
1ND4
1
KKA2_KLEPN
A:
[10-264]
---------------------------
G
S
P
-
A
A
W
V
-
E
R
---
L
--
F
-
G
----
Y
D
W
A
--
Q
Q
T
-
I
G
C
S
D
A
A
V
F
--
R
L
---------
S
-
A
--------
Q
G
--------
R
P
V
L
F
V
K
-
T
--
D
L
S
------
G
A
L
----
N
E
L
-
Q
D
E
A
A
R
L
S
W
L
A
T
-
T
G
--
V
P
--
C
A
A
V
L
D
V
V
T
-------
E
----
A
G
R
D
W
L
L
L
G
E
V
P
G
Q
D
L
L
S
S
H
-
L
---------
A
-------------
P
A
E
K
V
S
I
M
A
D
A
M
R
R
L
H
T
L
-------
D
P
---
A
T
---
C
-
P
-
F
---
D
H
Q
--
A
K
H
R
I
E
R
---
A
R
T
R
M
E
A
----------------------------
G
L
V
D
----
Q
D
D
---
L
D
E
E
H
Q
G
L
A
P
A
E
L
F
A
R
L
K
-
A
-
R
M
P
D
-----
G
E
D
L
V
V
------
T
H
G
D
A
C
L
P
N
I
M
V
--
E
-
N
--
G
----
R
F
S
G
F
I
D
C
G
R
L
G
V
A
D
R
Y
Q
D
I
A
L
A
T
-
R
-----------------
D
I
--
A
E
E
L
-------------
G
G
-------------
E
W
A
D
R
-------
F
L
V
L
Y
-
G
--
I
A
------
A
P
D
S
------
Q
R
I
A
F
Y
R
L
L
D
E
F
F
-------------------------------------------------------------------------------------------------
21
HHSearch
67.16
13%
-42
- C5 -
-
4PDY
1
?
A:
[23-316]
-----------------------------
I
P
Q
A
V
V
-
S
K
Y
D
-
L
----
A
-
I
--
Q
Q
R
-----
H
----
A
D
G
N
I
E
--
V
W
---------
T
D
S
--------
K
G
R
-------
R
Y
A
A
K
R
S
-
S
--
I
A
-------
P
A
H
------
C
-
R
I
M
V
Q
C
L
R
H
A
Q
E
-
Q
G
--
F
T
K-
F
A
R
F
V
T
T
S
S
N
A
-
P
Y
V
R
H
----
G
D
F
T
Y
Y
V
T
E
W
V
S
G
Q
P
A
N
F
---
G
---------
L
P
--------
E
H
------
V
A
Q
T
A
Y
T
L
A
Q
F
H
E
A
T
R
S
F
R
T
D
W
K
------------
D
---
D
V
---
F
G
L
F
Q
A
R
---
W
R
D
L
R
Q
M
W
L
G
A
D
------
R
KRE--
K
---
D
A
----
F
D
Q
L
L
L
S
M
R
D
E
L
---
H
R
D
A
A
E
S
L
A
L
-
F
E
D
R
D
V
I
A
Y
-
L
E
A
E
-----
R
S
S
G
G
W
------
C
H
L
D
V
I
P
S
N
C
L
Y
--
T
-
P
--
Q
----
H
Q
V
V
L
I
D
F
E
L
A
R
P
A
P
R
A
L
D
M
A
H
L
L
-
R
-----------------
R
S
--
L
-
E
R
G
NW----------
D
G
-------------
H
L
A
Y
A
-------
C
F
L
H
F
D
A
--
V
R
------
N
I
P
K
------
S
E
Y
R
A
V
E
A
I
-
L
R
-
F
P
Y
L
P
-
W
R
I
A
H
A
R
Y
H
F
A
--------------------------------------------------------------------------------
55
Fugue
63.64
12%
-0
- C5 -
-
3I1A
2
?
A:
[3-330]
--------------------
K
Q
P
I
Q
A
-
Q
Q
L
I
E
L
L
K
-
V
H
Y
G
-
I
--
D
-
I
H
T
--
A
Q
F
I
--
Q
G
G
-
A
D
T
N
A
F
A
Y
Q
--
A
D
---------
S
-
E
--------
S
K
--------
S
Y
F
I
K
L
K
-
Y
----
G
------
Y
H
D
----
E
I
N
-
L
S
I
I
R
L
L
H
D
S
G
I
-
K
E
--
I
I
--
F
P
I
H
T
L
E
A
---
K
L
F
Q
Q
L
----
K
H
F
K
I
I
A
Y
P
F
I
H
A
P
N
G
F
T
Q
N
-
L
---------
T
--------------
G
K
Q
W
K
Q
L
G
K
V
L
R
Q
I
H
E
T
S
V
P
--
I
S
I
Q
---
Q
Q
---
L
-
R
-
K
---
E
I
Y
--
S
P
K
W
R
E
I
---
V
R
S
F
Y
N
Q
I
---
E
------
F
-----
D
---
N
S
----
D
D
K
L
T
----
A
A
F
---
K
S
F
F
N
Q
N
S
A
A
I
H
R
L
V
D
T
S
-
E
-
K
L
S
K
K
IQPD
L
D
K
Y
V
L
------
C
H
S
D
I
H
A
G
N
V
L
V
--
G
-
N
--
E
----
E
S
I
Y
I
I
D
W
D
E
P
M
L
A
P
K
E
R
D
L
M
F
I
G
-
G
-----------------
G
V
GN
V
-
W
N
-------------
K
P
-------------
H
E
I
Q
Y
-------
F
Y
E
G
Y
G
E
---
I
------
N
V
D
K
------
T
I
L
S
Y
Y
R
H
E
R
I
V
E
D
I
A
V
Y
-
G
Q
D
L
L
S
R
N
Q
N
N
Q
S
R
L
E
S
F
K
Y
F
K
E
-------
M
F
D
P
N
N
V
V
E
I
A
F
A
T
E----------------------------------------------
2
PsiBlast_PDB
63.13
21%
-60
- C5 -
-
1ZYL
-
SRKA_ECOLI
A:
[51-254]
--------------------------------------------------------------------------------------------------------
R
F
V
V
K
F
Y
-
R
--
P
E
R
------
W
T
A
----
D
Q
I
-
L
E
E
H
Q
F
A
L
Q
L
V
N
-
D
E
--
V
P
--
V
A
A
P
--
V
A
F
N
G
Q
T
L
L
N
H
----
Q
G
F
Y
F
A
V
F
P
S
V
G
G
R
Q
F
E
A
D
N
-
I
---------
D
Q
----------------
M
E
A
V
G
R
Y
L
G
R
M
H
---------
Q
T
---
G
R
---
K
-
Q
-
L
---
F
I
H
--
R
----
P
T
---
I
G
L
N
E
Y
L
I
---
E
------
P
-----
R
---
K
L
----
F
E
D
A
-----
T
L
I
---
P
S
G
L
K
A
A
---
F
L
K
A
T
D
E
L
-
I
-
A
A
V
T
-----
A
-
H
W
R
E
D
F
T
V
L
R
L
H
G
D
C
H
A
G
N
I
L
W
--
R
-
D
--
G
----
P
M
--
F
V
D
L
D
D
A
R
N
G
P
A
V
Q
D
L
W
M
L
L
-
N
-----------------
G
D
--
K
-
A
E
-------------
Q
R
-------------
M
Q
L
E
T
-------
I
I
E
A
Y
E
E
----------------------------------------------------------------------------------------------------------------------------------
67
Fugue
62.75
14%
4
- C5 -
-
1NW1
-
CKA2_CAEEL
A:
[32-426]
G
M
K
E
L
L
S
T
MDLDTDANTI
P
E
L
K
E
R
A
H
-
M
L
C
A
R
F
L
G
-
G
A
W
K
-
T
VP
L
-
E
-
H
--
L
R
I
S
--
R
I
K
-
G
G
M
S
N
M
L
F
L
--
C
R
L
S
EVYPPIR
N
-
E
--------
P
N
--------
K
V
L
L
R
V
Y
-
F
---
N
P
------
E
T
E
----
S
H
L
-
V
A
E
S
V
I
F
T
L
L
S
E
-
R
H
--
L
G
--
P
K
L
Y
G
I
F
S
G
G
----------------
R
L
E
E
Y
I
P
S
R
P
L
S
C
H
E
-
I
---------
S
L
-------------
A
H
M
S
T
K
I
A
K
R
V
A
K
V
H
---
Q
L
E
V
P
I
W
K
---
E
P
---
D
-
Y
-
L
---
C
E
A
--
L
Q
R
W
L
K
Q
---
L
T
G
T
V
D
A
E
---
H
------
R
-----
F
---
D
L
----
P
E
E
C
G
----
V
S
S
---
V
N
C
L
D
L
A
R
E
L
E
F
L
R
A
H
I
S
-
L
-
S
K
S
--------
P
V
T
F
------
C
H
N
D
L
Q
E
G
N
I
L
L
--
P
-
K
--
R
------
L
V
L
I
D
F
E
Y
A
S
Y
N
Y
R
A
F
D
F
A
N
H
F
-
I
E
W
T
IDYDIDEAPF
Y
K
I
Q
T
E
--
N
-
F
P
-------------
E
N
-------------
D
Q
M
L
E
-------
F
F
L
N
Y
L
R
--
E
Q
GNTREN
E
L
Y
K
------
K
S
E
D
L
V
Q
E
T
L
P
F
V
P
V
S
H
F
F
W
G
V
W
G
L
L
Q
V
E
L
S
P
V
G
F
G
F
A
D
Y
G
R
-------
D
R
L
S
L
Y
F
K
H
K
Q
L
L
K
N
LA--------------------------------------------
66
Fugue
62.34
13%
-36
- C5 -
-
2OLC
4
MTNK_BACSU
A:
[5-396]
--------------------
K
T
P
L
Y
E
-
T
L
N
E
S
S
A
V
-
A
L
A
V
K
L
--
G
-
L
-
T
--
L
T
C
Q
--
E
I
G
-
D
G
N
L
N
Y
V
F
H
--
I
Y
---------
D
-
R
------------------
A
L
I
I
K
Q
A
-----
V
P
------
Y
W
P
----
L
T
I
-
D
R
A
R
I
E
S
S
A
L
I
R
-
Q
G
--
E
H
--
V
P
H
L
V
P
-----
R
V
F
Y
S
D
----
T
E
M
A
V
T
V
M
E
D
L
S
H
L
K
I
A
R
K
G
-
L
---------
I
E
--------
G
E
N
Y
-
P
H
L
S
Q
H
I
G
E
F
L
G
K
T
L
F
Y
S
S
D
Y
A
L
E
P
K
---
V
K
---
K
-
Q
-
L
---
V
K
Q
F
T
N
P
E
L
C
D
I
---
T
E
R
L
V
F
T
D
---
P
------
F
-----
F
---
D
H
DT
N
D
F
E
E
E
L
----
R
P
F
---
V
E
K
L
W
N
N
D
S
V
K
I
E
A
A
K
L
K
---
K
S
F
L
-----
T
S
A
E
T
L
------
I
H
G
D
L
H
T
G
S
I
F
A
--
S
-
E
--
H
----
E
-
T
K
V
I
D
P
E
F
A
F
Y
G
P
I
G
F
D
V
G
Q
F
I
A
N
-----------------
L
F
--
L
-
N
A
-------------
L
S
-------------
R
D
G
A
D
-------
R
E
P
L
Y
E
H
--
V
N
------
Q
V
W
E
------
T
F
E
E
T
F
S
E
A
W
Q
K
D
S
L
D
V
Y
-
A
N
I
D
G
Y
L
T
D
T
L
S
H
I
F
E
E
A
I
G
F
A
G
-------
C
E
L
I
R
R
T
I
G
L
A
H
V
A
D
L
D
T
IVP
F
D
K
R
I
G
R
K
R
L
A
L
E
T
G
T
A
F
I
E
KRSEFKT
I
T
D
V
I
E
L
F
K
L
L
V
K
44
SP3
60.95
14%
0
- C5 -
-
1NW1
-
CKA2_CAEEL
A:
[32-426]
G
M
K
E
L
L
S
T
MDLDTDANTI
P
E
L
K
E
R
A
H
-
M
L
C
A
R
F
L
G
-
G
A
W
K
-
T
--
V
-
P
-
L
EH
L
R
I
S
--
R
I
K
-
G
G
M
S
N
M
L
F
L
--
C
R
---------
L
-
S
--------
E
V
YPPIRNEP
N
K
V
L
L
R
V
-
Y
--
F
N
P
------
E
T
E
----
S
H
L
-
V
A
E
S
V
I
F
T
L
L
S
E
-
R
H
--
L
---
G
P
K
L
Y
G
I
F
S
G
---------------
G
R
L
E
E
Y
I
P
S
R
P
------
L
---------
S
C
--------
H
E
I
S
L
A
H
M
S
T
K
I
A
K
R
V
A
K
V
H
------
Q
L
E
V
P
---
I
W
---
K
-
E
-
P
---
D
Y
L
--
C
E
A
L
Q
R
W
---
L
K
Q
L
T
G
T
V
---
D
------
A
E
H
R
F
D
L
---
P
E
----
E
C
G
V
S
----
S
V
N
---
C
L
D
L
A
R
E
L
E
F
L
R
A
H
I
S
L
S
------------
K
S
P
V
T
F
------
C
H
N
D
L
Q
E
G
N
I
L
L
--
P
-
K
--
R
------
L
V
L
I
D
F
E
Y
A
S
Y
N
Y
R
A
F
D
F
A
N
H
F
-
I
E
W
T
IDYDIDEAPF
Y
K
I
Q
T
E
--
N
-
F
P
-------------
E
N
-------------
D
Q
M
L
E
-------
F
F
L
N
Y
L
R
--
E
Q
------
G
N
T
R
------
E
N
E
L
Y
K
K
S
E
D
L
V
Q
E
T
L
P
F
-
V
P
V
S
H
F
F
W
G
V
W
G
L
L
Q
V
E
L
S
P
V
G
F
G
F
A
D
Y
G
R
D
R
L
S
L
Y
F
K
H
K
Q
L
L
K
N
LA--------------------------------------------
29
HHSearch
60.04
16%
-53
- C5 -
-
3I1A
4
?
B:
[6-272]
------------------------
I
Q
-
A
Q
Q
L
I
E
L
L
K
V
H
Y
G
-
I
----
D
-
I
--
H
T
A
Q
--
F
I
Q
-
G
G
A
D
T
N
A
F
A
Y
Q
A
D
---------
S
-
E
--------
S
K
--------
S
Y
F
I
K
L
K
-
Y
--
G
Y
---------
H
------
D
-
E
I
N
L
S
I
I
R
L
L
H
D
-
S
G
--
I
K
E-
I
I
F
P
I
H
T
L
E
A
K
-
L
F
Q
Q
L
----
K
H
F
K
I
I
A
Y
P
F
I
H
A
P
N
G
F
T
Q
N
-
L
---------
T
G
--------
K
Q
------
W
K
Q
L
G
K
V
L
R
Q
I
H
E
T
S
V
P
I
S
I
Q
Q
Q
LRK
E
I
---
Y
-
S
-
P
---
K
W
-------
R
E
I
---
V
R
S
F
Y
N
Q
I
---
E
------
F
-----
D
NSD
D
K
L
T
A
A
F
K
S
F
F
N
Q
N
-
S
A
A
---
I
H
R
L
V
D
T
S
E
K
-
L
S
K
K
------
I
Q
P
D
-----
L
D
K
Y
V
L
------
C
H
S
D
I
H
A
G
N
V
L
V
--
G
-
N
--
E
----
E
S
I
Y
I
I
D
W
D
E
P
M
L
A
P
K
E
R
D
L
M
F
I
G
-
G
-----------------
G
V
--
G
-
N
V
WN-----------
K
P
-------------
H
E
I
Q
Y
-------
F
Y
E
G
Y
G
E
--
I
N
------
V
-----------------------------------------------------------------------------------------------------------------------
41
HHSearch
60.02
17%
-5
- C5 -
-
3ATT
2
Y3168_MYCTU
A:
[9-307]
-----------------------------
W
L
S
S
V
L
-
P
G
G
A
-
A
----
P
-
E
--
V
T
V
E
SG
V
D
S
-
T
G
M
S
S
E
T
I
I
--
L
T
---------
A
-
R
W
Q
Q
DG
R
S
I
Q
Q
--------
K
L
V
A
R
V
A
-
P
--
A
A
E
DVPVFP
T
Y
R
------
L
-
D
H
Q
F
E
V
I
R
L
V
G
E
L
T
D
--
V
P
--
V
P
R
V
R
W
I
E
T
T
G
-
D
---
V
----
L
G
T
P
F
F
L
M
D
Y
V
E
G
V
V
P
P
D
V
M
-
P
YTFGDNWFA
D
A
--------
P
A
E
R
Q
R
Q
L
Q
D
A
T
V
A
A
L
A
T
L
H
S
I
P
N
A
Q
N
T
F
S
F
---
L
T
----------------
D
T
T
L
H
R
H
F
N
W
V
R
S
W
Y
D
F
A
---
V
------
E
-----
G
---
I
G
----
R
S
P
L
L
----
E
R
T
---
F
E
W
L
Q
S
H
W
-----
P
-------
D
D
A
A
-----
A
R
E
P
V
L
------
L
W
G
D
A
R
V
G
N
V
L
Y
--
R
-
D
--
F
----
Q
P
V
A
V
L
D
W
E
M
V
A
L
G
P
R
E
L
D
V
A
W
M
I
-
F
-----------------
A
H
--
R
-
V
F
-------------
Q
E
L
A
G
L
A
TLPGLPEV
M
R
E
D
D
-------
V
R
A
T
Y
Q
A
--
L
T
------
G
V
E
L
------
G
D
L
H
W
---------------------------------------------------------------------------------------------------------
37
HHSearch
59.79
14%
-31
- C5 -
-
4DCA
1
?
A:
[25-278]
------------------------
L
D
-
A
E
I
Y
E
H
L
N
-
K
--
Q
-
I
----
K
-
I
--
N
E
L
R
--
Y
L
S
-
S
G
D
D
S
D
T
F
L
--
C
---------------------
N
E
--------
Q
Y
V
V
K
V
P
-
K
--
R
D
S
V
-----
R
I
S
------
Q
-
K
R
E
L
E
L
Y
R
F
L
E
N
-
C
K
LS
Y
Q
--
I
P
A
V
V
Y
Q
---------------
S
D
R
F
N
I
M
K
Y
I
K
G
E
R
I
T
Y
E
Q
Y
H
---------
K
L
--------
S
E
K
E
K
D
A
L
A
Y
D
E
A
T
F
L
K
E
L
H
S
I
E
I
D
C
S
V
S
L
F
---
S
D
---
A
L
V
-
N
---
K
K
----
D
K
F
L
Q
D
---
K
K
L
L
I
S
I
L
---
E
------
K
-----
E
---
Q
-------
L
L
T
----
D
E
M
---
L
E
H
I
E
T
I
Y
E
N
-
I
L
S
N
------
A
V
L
F
-----
K
Y
T
P
C
L
------
V
H
N
D
F
S
A
N
N
M
I
F
--
R
-
N
--
N
----
R
L
F
G
V
I
D
F
G
D
F
N
V
G
D
P
D
N
D
F
L
C
L
L
-
D
-----------------
C
S
--
T
-
D
D
F------------
G
K
-------------
E
F
G
R
K
-------
V
L
K
Y
Y
Q
H
--
K
A
------
P
E
V
A
------
E
R
K
-----------------------------------------------------------------------------------------------------------
34
HHSearch
59.05
14%
-30
- C5 -
-
5IWU
2
?
A:
[2-260]
-----------------------
S
K
D
-
I
K
Q
V
I
E
I
A
-
K
K
H
N
-
L
--
F
L
K
-
E
--
E
T
I
Q
--
F
N
E
-
S
G
L
D
F
Q
A
V
F
--
A
Q
---------
D
-
N
N-------
G
I
--------
D
W
V
L
R
L
P
-
R
--
R
E
D
V
-----
M
P
R
------
T
-
K
V
E
K
Q
A
L
D
L
V
N
K
-
Y
A
--
I
S
FQ
A
P
N
W
I
I
Y
---------------
T
E
E
L
I
A
Y
K
K
L
D
G
V
P
A
G
T
I
D
-
H
---------
N
I
GNYIWEID
I
N
N
V
P
E
L
F
H
K
S
L
G
R
V
L
A
E
L
H
S
I
P
S
N
K
A
A
A
L
D
L
--
V
V
---
H
-
T
P
E
---
E
A
---
R
M
S
M
K
Q
R
---
M
D
A
V
R
A
K
F
----------------------------
G
V
G
----
E
N
L
---
W
N
R
W
Q
A
W
L
----
N
D
-------
D
D
M
W
-----
P
K
K
T
G
L
------
I
H
G
D
V
H
A
G
H
T
M
I
--
D
K
D
--
A
----
N
V
T
G
L
I
D
W
T
E
A
K
V
T
D
V
S
H
D
F
I
F
N
Y
-
R
-----------------
A
F
-------------------
G
E
-------------
E
G
L
E
A
-------
L
I
L
A
Y
K
E
--
I
G
------
G
Y
Y
W
------
P
-------------------------------------------------------------------------------------------------------------
24
HHSearch
58.99
12%
-42
- C5 -
-
6EF6
2
?
A:
[27-306]
-------------------------
D
-
V
T
I
A
Q
Q
A
L
-
T
H
Y
D
-
V
--
S
-
D
-
N
--
A
S
L
R
--
L
L
--
N
L
S
E
N
A
T
Y
L
--
V
E
---------
D
-
G
--------
E
H
--------
Q
S
I
L
R
V
H
-
R
--
Q
D
Y
HQ----
P
H
E
------
I
-
E
S
E
L
D
W
L
A
A
L
R
T
D
S
D
--
V
T
--
V
P
T
V
V
P
A
R
D
G
R
-
R
V
V
T
V
D
P
A
D
V
P
R
H
V
V
H
F
E
M
V
G
G
A
E
P
D
E
E
S
-
L
---------
T
L
--------
D
D
------
F
Q
T
L
G
R
I
T
A
S
L
H
E
H
S
Q
R
W
T
R
P
A
G
----
F
---
G
-
R
-
F
---
S
W
D
--
W
E
H
C
L
G
D
---
T
P
R
W
G
R
W
Q
---
D
AEG---
V
-----
G
---
A
S
----
E
T
A
L
L
----
T
R
A
---
Q
D
L
L
H
R
K
L
----
E
E
-------
Y
G
S
G
-----
P
D
R
Y
G
L
------
I
H
A
D
L
R
L
A
N
L
L
V
--
D
-
S
--
S
TPQ-
R
T
I
T
V
I
D
F
D
D
C
G
F
G
W
Y
F
Y
D
F
G
T
A
V
-
S
-----------------
F
I
--
E
-
H
D
PR-----------
L
G
-------------
E
W
Q
E
S
-------
W
V
A
G
Y
R
S
--
R
R
------
E
L
P
A
------
A
D
E
A
M
L
P
S
F
-----------------------------------------------------------------------------------------------------
26
HHSearch
55.80
16%
-18
- C5 -
-
3CSV
8
?
A:
[4-260]
------------------------
S
R
-
E
D
E
I
R
D
F
L
-
A
T
H
G
-
Y
----
A
-
D
--
W
N
R
T
--
P
---------
R
Y
Q
R
-
L
R
---------
S
-
P
T-------
G
A
--------
K
A
V
L
M
D
W
-
S
--
P
E
E
------
G
G
D
------
T
-
Q
P
F
V
D
L
A
Q
Y
L
R
N
-
L
D
--
I
S
--
A
P
E
I
Y
A
E
E
H
-------------
A
R
G
L
L
L
I
E
D
L
G
D
A
L
F
T
E
V
I
-
N
---------
N
D
--------
P
-
A
Q
E
M
P
L
Y
R
A
A
V
D
L
L
I
H
L
H
D
A
Q
T
P
E
L
A
R
L
D
---
P
E
---
T
-
L
-
S
---
E
M
------
T
R
L
A
---
F
S
E
Y
R
Y
A
I
--------------------------
L
G
D
A
A
----
E
D
N
---
R
K
R
F
E
H
R
F
A
Q
I
L
---------
S
A
Q
L
-----
E
G
D
M
V
F
------
V
H
R
D
F
H
A
Q
N
L
L
W
--
L
-
P
--
E
REGL
A
R
V
G
V
I
D
F
Q
D
A
K
L
G
H
R
A
Y
D
L
V
S
L
L
-
Q
-----------------
D
A
--
R
-
R
D
V------------
P
A
-------------
Q
V
E
A
Q
-------
M
I
D
H
Y
I
Q
--
A
T
------
G
V
D
E
------
S
H
F
R
S
---------------------------------------------------------------------------------------------------------
57
Fugue
54.81
15%
-3
- C5 -
-
1J7L
1
KKA3_ENTFL
A:
[2-264]
------------------------
A
K
-
M
R
I
S
P
E
L
K
-
K
L
I
E
-
K
--
Y
-
R
-
C
--
V
K
D
T
--
E
G
M
-
S
P
A
--
K
V
Y
K
--
L
V
---------
G
-
E
--------
N
E
--------
N
L
Y
L
K
M
T
D
S
--
R
Y
K
------
G
T
T
----
Y
D
V
-
E
R
E
K
D
M
M
L
W
L
E
G
-
K
---------
L
P
V
P
---
K
V
L
H
F
E
R
H
----
D
G
W
S
N
L
L
M
S
E
A
D
G
V
L
C
S
E
E
------------
Y
E
--------
D
E
Q
S
P
E
K
I
I
E
L
Y
A
E
C
I
R
L
F
H
S
I
D
I
S
D
C
-
P
Y
T
---
N
S
---
L
-
D
-
S
---
R
L
A
--
E
L
D
Y
L
L
N
---
N
D
L
A
D
V
-----
D
------
C
-----
E
---
N
W
----
E
E
D
T
P
----
F
K
D
---
P
R
E
L
Y
D
F
L
K
T
E
K
P
E
E
E
L
V
-
F
-
S
---------------------
H
G
D
L
G
D
S
N
I
F
V
--
K
-
D
--
G
----
K
V
S
G
F
I
D
L
G
R
S
G
R
A
D
K
W
Y
D
I
A
F
C
V
-
R
-----------------
S
I
--
R
-
E
D
-------------
I
G
-------------
E
E
----------------------------------------------------------------
Q
Y
V
E
L
F
F
D
L
L
G
I
K
P
D
-------
W
E
K
I
K
Y
Y
I
L
L
D
E
L
F
-----------------------------------------------