@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 : PA1604: (2016-01-30 )
MAFLLIGLSEHRPLPLGQGSPLRWLALLFGLLAWHAGAGERVIYPRHSEGRNPEPYVVELLQLALARSGGDYRLEPSAQPMPQSRAQLRLEQDDPGLQVMWAQSRDDLEETLLPIRIPIYRGLIGWRIPLVSAANKDILASARTLDDLRRLRFGQRQDWADTPILRANGLEVKTSQNYESLFRMLDAGRFEVFPREVVVIDGELEDASRAGLHLAIDQHLALHYPAAFYFFVSRQRPELAEAIRQGLEKAIADGSFERLFERHFKTRLEKLALRQRRIIELKNPYLPGKTPFQREALWYRP
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--------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
----
M
A
F
L
L
I
GLSEHRPLPLGQGS
P
L
R
W
L
A
L
L
F
G
-----
L
L
A
W
HAGAGE
R
V
I
Y
PRHSEGRNP
E
P
Y
V
V
--
E
L
L
Q
L
A
L
AR-S------GGDYRLEPSAQPM-PQ
S
R
A
Q
L
R
LE--------QDDPG
L
Q
V
M
WA-Q--S-RD---
D
L
E
E--TLL
P
I
R
-
I
P
I
Y
R
G
L--------IGWRI---------------------------PLVSAA
N
K
D
I
L
A
S
AR
T
L
D
D
L
R
--
R
L
RFGQRQDWADT-
P
I
L
RA----N----G---
L
-
E
V
KTSQ
N
Y
E
S
L
F
R
M
L
DAGR
F
E
V
-------FP
R
E
V
V
--
V
I-D--GE-LEDASRA
G
L
H
L
A
IDQ----
H
L
--
A
L
---H---Y
P
------
A
A
F
Y
F
-----
F
VSR-QR
P
E
L
A
E
A
I
R
----
Q
G
L
E
K
A
IAD
G
S
--
F
E
R
L
F
E
R
---
H
F
K
T
R
L
E
K
L
A
L
R
Q
R
R
I
I
ELKNPYL-PGKT--PFQREALWYRP---------------------------------------------------
40
Fugue
83.88
20%
-54
- C7 -
4NY2
4
?
A:
[5-408]
PK
G
T
I
Y
L
T
F
D
D
G
P
V
N
A
S
V
E
V
I
K
V
L
N
Q
G
G
V
K
A
T
F
Y
-----
F
N
A
W
H
L
D
----------
G
I
G
D
E
N
E
D
R
A
L
--
E
A
L
K
L
A
L
D
S
-
G
H
I
V
G
N
H
S
Y
D
H
M
I
H
N
C
V
E
E
F
G
P
T
S
G
A
D
C
N
A
T
GNHQIHSY
Q
D
P
V
R
D
A
A
S
F
E
-
Q
--
N
-
L
I
---
T
L
E
K
--
Y
L
P
T
I
R
S
Y
P
N
Y
K
G
Y
E
L
A
R
L
P
YT
N
G
W
R
V
TKH
F
Q
A
D
GLCATSDNLKPWEPG
Y
V
C
D
P
A
N
P
S
N
S
V
K
A
S
I
Q
V
Q
N
I
L
A
N
Q
G
--
Y
Q
T
H
G
W
D
V
D
W
A
---
P
E
N
W
G
----
I
----
P
---
M
-
P
A
N
S
L
T
E
A
V
P
F
L
A
Y
V
D
K
A
L
N
S
C
-------
S
P
T
T
I
E
--
P
I
-
N
--
S
K
-
T
Q
E
F
P
C
-
G
T
P
L
H
A
D
K
----
V
I
--
V
L
---
T
---
H
D
------
F
L
F
E
D
GKRGM
G
A
T
Q
-
N
L
P
K
L
A
E
F
I
R
----
I
A
K
E
A
G
Y
V
F
D
T
--
M
D
N
Y
T
P
R
WSV
G
K
T
Y
Q
A
G
E
Y
V
L
Y
Q
G
V
V
Y
K
A
V
I
S
H
T
-
A
Q
Q
D
WA
P
S
S
T
S
S
L
W
T
N
A
DPATNWTLNVSYEQG
D
I
V
N
Y
KG
K
R
Y
L
V
S
V
P
H
V
S
Q
QDWTPDTQNTL
F
T
A
L
E
L
22
HHSearch
72.12
16%
-85
- C8 -
2Y7I
7
?
A:
[15-228]
----------------------------------------------
T
Y
A
P
Y
E
F
--
V
D
A
D
N
K
I
V
G
F
D
I
--
D
V
A
N
A
V
C
K
E
M
Q
------
A
---
E
C
S
F
T
--
N
Q
-
S
F
D
S
L
I
P
S
L
R
--------
F
K
--
K
F
D
A
V
I
A
G
M
--
D
M
T
P
---
K
R
E
Q
--
Q
V
S
F
S
--
Q
P
Y
Y
E
G
L
--------
S
---
A
---------------------------
V
V
V
T
R
K
G
-----
A
Y
H
T
F
A
D
L
K
--
G
K
K
V
G
L
E
N
G
T
T
H
Q
-
R
Y
L
Q
D
----
K
QQ--
A
---
I
-
T
P
V
A
Y
D
S
Y
L
N
A
F
T
D
L
K
N
N
R
L
E
G
-------
V
F
G
D
V
A
--
A
I
-
G
--
K
W
-
L
K
N
N
P
----
D
Y
A
I
M
D
E
R
A
S
D
P
--
D
----
Y
---
Y
G
------
K
G
L
G
I
-----
A
V
R
K
-
D
N
D
A
L
L
Q
E
I
N
----
A
A
L
D
K
V
K
A
S
P
E
--
Y
A
Q
M
Q
E
K
---
W
F
T
------------------------------------------------------------------------------------------
26
HHSearch
67.61
12%
-77
- C8 -
2YLN
10
?
A:
[74-279]
--------------------------------------------------------
D
K
D
G
K
L
T
G
Y
D
V
--
E
V
T
R
A
V
A
E
K
L
G
------
V
---
K
V
E
F
K
--
E
T
-
Q
W
D
S
M
M
A
G
L
K
--------
A
G
--
R
F
D
V
V
A
N
-
Q
VG
L
T
S
P
---
E
R
Q
A
--
T
F
D
K
S
--
E
P
Y
S
W
S
G
--------
A
---
V
---------------------------
L
V
A
H
N
D
S
-----
N
I
K
S
I
A
D
I
K
--
G
V
K
T
A
Q
S
L
T
S
N
Y
G
-
E
K
A
K
A
----
A
----
G
---
A
-
Q
L
V
P
V
D
G
L
A
Q
S
L
T
L
I
E
Q
K
R
A
D
A
-------
T
L
N
D
E
L
--
A
V
-
L
--
D
Y
-
L
K
K
N
P
N
--
A
G
V
K
I
V
W
----
S
A
--
P
A
---
D
---
E
K
------
V
G
S
G
L
-----
I
V
N
K
-
G
N
D
E
A
V
A
K
F
S
----
T
A
I
N
E
L
K
A
D
G
T
--
L
K
K
L
G
E
Q
---
F
F
G
K
D
I
S
V
Q
------------------------------------------------------------------------------------
34
HHSearch
67.45
13%
-83
- C8 -
1XT8
1
?
A:
[62-281]
---------------------------------------------------------
E
K
G
N
N
Q
G
Y
D
I
--
A
L
A
K
R
I
A
K
E
L
F
GDE---
N
---
K
V
Q
F
V
--
L
V
-
E
A
A
N
R
V
E
F
L
K
--------
S
N
--
K
V
D
I
I
L
A
N
F
--
T
Q
T
P
---
Q
R
A
E
--
Q
V
D
F
C
--
S
P
Y
M
K
V
A
--------
L
---
G
---------------------------
V
A
V
P
K
D
S
-----
N
I
T
S
V
E
D
L
K
--
D
K
T
L
L
L
N
K
G
T
T
A
D
-
A
Y
F
T
Q
----
N
YP--
N
---
I
-
K
T
L
K
Y
D
Q
N
T
E
T
F
A
A
L
M
D
K
R
G
D
A
-------
L
S
H
D
N
T
--
L
L
-
F
--
A
W
-
V
K
D
H
P
D
--
F
K
M
G
I
-
K
----
E
---
L
----
G
---
N
K
------
D
V
I
A
P
-----
A
V
K
K
-
G
D
K
E
L
K
E
F
I
D
----
N
L
I
I
K
L
G
Q
E
Q
F
--
F
H
K
A
Y
D
E
---
T
L
K
A
H
F
G
D
D
V
K
A
D
D
V
V
I
E
G
--------------------------------------------------------------------------
35
Fugue
67.18
14%
-78
- C8 -
1HSL
6
HISJ_ECOLI
A:
[1-238]
------------
A
I
P
Q
K
I
R
I
G
T
D
P
T
Y
A
------------------------
P
F
E
S
K
N
A
Q
G
E
L
V
G
F
D
I
--
D
L
A
K
E
L
C
K
R
-
I
------
N
T
Q
C
T
F
V
E
N
-----
P
L
D
A
L
I
P
S
L
K
--------
A
K
K
I
D
A
I
M
S
S
L
-
S
--
I
-
T
E
---
K
R
Q
Q
--
E
------
I
A
F
T
D
K
L
--------
Y
A
A
D
S
---------------------------
R
L
V
V
A
K
N
S
-
D
I
Q
P
--
T
V
A
S
L
K
--
G
K
R
V
G
V
L
Q
G
T
T
Q
E
-
T
F
G
N
E
HWAP
K
----
G
---
I
-
E
I
V
S
Y
Q
G
Q
D
N
I
Y
S
D
L
T
A
G
R
I
D
A
-------
A
F
Q
D
E
V
--
A
A
-
S
--
E
G
-
F
L
K
Q
P
V
G
K
D
Y
K
F
G
G
P
----
A
V
K
D
E
K
---
L
---
F
G
------
V
G
T
G
M
-----
G
L
R
K
-
E
D
N
E
L
R
E
A
L
N
----
K
A
F
A
E
M
R
A
D
G
T
--
Y
E
K
L
A
K
K
---
Y
F
------------------------
D
F
D
--
V
Y
G
G
----------------------------------------------------------
27
HHSearch
66.94
17%
-76
- C8 -
3VV5
1
?
A:
[52-256]
-------------------------------------------------------
F
D
E
R
N
Q
L
T
G
F
E
V
--
D
L
G
N
A
I
A
E
R
L
G
------
L
---
K
P
R
W
I
--
A
Q
-
S
F
D
T
L
L
I
Q
L
N
--------
Q
G
--
R
F
D
F
V
I
A
S
H
--
G
I
T
E
---
E
R
A
R
--
A
V
D
F
T
--
N
P
H
Y
C
T
G
--------
G
---
V
---------------------------
I
V
S
R
K
G
G
------
P
R
T
A
K
D
L
Q
--
G
K
V
V
G
V
Q
V
G
T
T
Y
M
-
E
A
A
Q
K
----
I
P---
G
---
I
K
E
V
R
T
Y
Q
R
D
P
D
A
L
Q
D
L
L
A
G
R
I
D
T
-------
W
I
T
D
R
F
--
V
A
-
K
--
E
A
-
I
K
E
R
K
L
E
-
N
T
L
Q
V
G
E
-----
L
-------
V
---
F
Q
------
E
R
V
A
M
-----
A
V
A
K
-
G
N
K
S
L
L
D
A
L
N
----
R
A
L
A
E
L
M
Q
D
G
T
--
Y
A
R
I
S
Q
K
---
W
F
G
E
D
V
R
C
K
------------------------------------------------------------------------------------
18
HHSearch
66.31
14%
-73
- C8 -
1WDN
1
GLNH_ECOLI
A:
[13-223]
-----------------------------------------------
F
V
P
F
E
F
---
K
Q
G
D
L
Y
V
G
F
D
V
--
D
L
W
A
A
I
A
K
E
L
K
------
L
---
D
Y
E
L
K
--
P
M
-
D
F
S
G
I
I
P
A
L
Q
--------
T
K
--
N
V
D
L
A
L
A
G
I
--
T
I
T
D
---
E
R
K
K
--
A
I
D
F
S
--
D
G
Y
Y
K
S
G
--------
L
---
L
---------------------------
V
M
V
K
A
N
N
N
----
D
V
K
S
V
K
D
L
D
--
G
K
V
V
A
V
K
S
G
T
G
S
V
-
D
Y
A
K
A
----
N
IK--
T
---
K
-
D
L
R
Q
F
P
N
I
D
N
A
Y
M
E
L
G
T
N
R
A
D
A
-------
V
L
H
D
T
P
--
N
I
-
L
--
Y
F
-
I
K
T
A
G
N
--
G
Q
F
K
A
V
G
----
D
S
--
L
--------
E
A
------
Q
Q
Y
G
I
-----
A
F
P
K
-
G
S
D
E
L
R
D
K
V
N
----
G
A
L
K
T
L
R
E
N
G
T
--
Y
N
E
I
Y
K
K
---
W
F
G
T
E
P
K
--------------------------------------------------------------------------------------
25
HHSearch
66.09
15%
-87
- C8 -
3MPK
4
A:
[48-251]
-------------------------------------------------------
F
R
T
D
E
Q
F
G
G
I
S
A
--
A
V
L
Q
L
L
Q
L
R
T
G
------
L
---
D
F
E
I
I
--
G
V
D
T
V
E
E
L
I
A
K
L
R
--------
S
G
--
E
A
D
M
A
G
A
-
L
--
F
V
N
S
---
A
R
E
S
--
F
L
S
F
S
--
R
P
Y
V
R
N
G
--------
M
---
V
---------------------------
I
V
T
R
Q
D
P
D
----
A
P
V
D
A
D
H
L
D
--
G
R
T
V
A
L
V
R
N
S
A
A
I
-
P
L
L
Q
R
----
R
Y
P--
Q
---
A
-
K
V
V
T
A
D
N
P
S
E
A
M
L
M
V
A
N
G
Q
A
D
A
-------
V
V
Q
T
Q
I
--
S
A
-
S
--
Y
Y
-
V
N
R
Y
F
A
--
G
K
L
R
I
A
S
----
A
L
--
D
----
L
---
P
P
------
A
E
I
A
L
-----
A
T
T
R
-
G
Q
T
E
L
M
S
I
L
N
----
K
A
L
Y
S
I
S
N
-
D
E
--
L
A
S
I
I
S
R
---
W
R
-------------------------------------------------------------------------------------------
19
HHSearch
66.03
14%
-77
- C8 -
1LST
1
ARGT_SALTY
A:
[15-234]
------------------------------------------------
A
P
F
S
S
--
K
D
A
K
G
E
F
I
G
F
D
I
--
D
L
G
N
E
M
C
K
R
M
Q
------
V
---
K
C
T
W
V
--
A
S
-
D
F
D
A
L
I
P
S
L
K
--------
A
K
--
K
I
D
A
I
I
S
S
L
--
S
I
T
D
---
K
R
Q
Q
--
E
I
A
F
S
--
D
K
L
Y
A
A
D
--------
S
---
R
---------------------------
L
I
A
A
K
G
S
P
----
I
Q
P
T
L
E
S
L
K
--
G
K
H
V
G
V
L
Q
G
S
T
Q
E
-
A
Y
A
N
D
----
N
WRTK
G
---
V
-
D
V
V
A
Y
A
N
Q
D
L
I
Y
S
D
L
T
A
G
R
L
D
A
-------
A
L
Q
D
E
V
--
A
A
-
S
--
E
G
F
L
K
Q
P
A
G
--
K
E
Y
A
F
A
G
----
P
S
--
V
K
DKK
Y
---
F
G
------
D
G
T
G
V
-----
G
L
R
K
-
D
D
T
E
L
K
A
A
F
D
----
K
A
L
T
E
L
R
Q
D
G
T
--
Y
D
K
M
A
K
K
---
Y
F
D
F
N
V
Y
G
D
------------------------------------------------------------------------------------
31
HHSearch
66.02
13%
-94
- C8 -
3KBR
9
PHEC_PSEAE
A:
[25-236]
-----------------------------------------------
Y
K
P
F
S
Y
--
R
T
E
E
G
G
Y
A
G
F
D
V
--
D
M
A
Q
R
L
A
E
S
L
G
------
A
---
K
L
V
V
V
--
P
T
-
S
W
P
N
L
M
R
D
F
A
--------
D
D
--
R
F
D
I
A
M
S
G
I
--
S
I
N
L
---
E
R
Q
R
--
Q
A
Y
F
S
--
I
P
Y
L
R
D
G
--------
K
---
T
---------------------------
P
I
T
L
C
S
E
E
A
---
R
F
Q
T
L
E
Q
I
D
QP
G
V
T
A
I
V
N
P
G
G
T
N
E
-
K
F
A
R
A
----
N
LK--
K
---
A
-
R
I
L
V
H
P
D
N
V
T
I
F
Q
Q
I
V
D
G
K
A
D
L
-------
M
M
T
D
A
I
--
E
A
-
R
--
L
Q
-
S
R
L
H
P
E
---
L
C
A
V
H
P
----
Q
P
--
F
--------
D
F
------
A
E
K
A
Y
-----
L
L
P
R
-
D
-
E
A
F
K
R
Y
V
D
----
Q
W
L
H
I
A
E
Q
S
G
L
--
L
R
Q
R
M
E
H
---
W
L
-------------------------------------------------------------------------------------------
21
HHSearch
64.41
11%
-82
- C8 -
3TQL
2
?
A:
[12-227]
-----------------------------------------------
Y
P
P
Y
V
Y
--
M
G
--
G
Q
V
E
G
F
G
A
--
D
I
V
K
A
V
C
K
Q
M
Q
------
A
---
V
C
T
I
S
--
N
Q
-
P
W
D
S
L
I
P
S
L
K
--------
L
G
--
K
F
D
A
L
F
G
G
M
--
N
I
T
T
---
A
R
Q
K
--
E
V
D
F
T
--
D
P
Y
Y
T
N
S
--------
V
---
S
---------------------------
F
I
A
D
K
N
T
P
----
L
T
L
S
K
Q
G
L
K
--
G
K
I
I
G
V
Q
G
G
T
T
F
D
-
S
Y
L
Q
D
----
S
FGN-
S
---
I
-
T
I
Q
R
Y
P
S
E
E
D
A
L
M
D
L
T
S
G
R
V
D
A
-------
V
V
G
D
T
P
--
L
I
-
K
--
Q
W
-
L
K
Q
N
G
R
--
R
E
Y
V
L
I
G
----
K
P
--
V
N
---
D
PNY
F
G
------
K
G
V
G
I
-----
A
V
K
K
-
G
N
Q
A
L
L
L
K
L
N
----
K
A
L
A
A
I
K
A
N
G
V
--
Y
A
A
I
V
Q
K
---
Y
F
-------------------------------------------------------------------------------------------
30
HHSearch
64.14
12%
-83
- C8 -
2PVU
3
?
A:
[59-265]
---------------------------------------------------------
Q
K
G
K
I
V
G
F
D
V
--
D
L
L
D
A
V
M
K
A
A
G
------
L
---
D
Y
E
L
K
--
N
I
-
G
W
D
P
L
F
A
S
L
Q
--------
S
K
--
E
V
D
M
G
I
S
G
I
--
T
I
T
D
---
E
R
K
Q
--
S
Y
D
F
S
--
D
P
Y
F
E
A
T
--------
Q
---
V
---------------------------
I
L
V
K
Q
G
S
-----
P
V
K
N
A
L
D
L
K
--
G
K
T
I
G
V
Q
N
A
T
T
G
Q
-
E
A
A
E
K
----
L
FGK-
G
---
P
-
H
I
K
K
F
E
T
T
V
V
A
I
M
E
L
L
N
G
G
V
D
A
-------
V
I
T
D
N
A
--
V
A
-
N
--
E
Y
-
V
K
N
N
P
N
--
K
K
L
Q
V
I
E
----
D
P
--
K
N
---
F
---
A
S
------
E
Y
Y
G
M
-----
I
F
P
K
--
N
S
E
L
K
A
K
V
D
----
E
A
L
K
N
V
I
N
S
G
K
--
Y
T
E
I
Y
K
K
---
W
F
G
K
E
P
K
L
D
R
L
K
Q
--------------------------------------------------------------------------------
23
HHSearch
64.10
12%
-87
- C8 -
2PYY
1
?
A:
[11-223]
----------------------------------------------
V
I
P
P
F
V
L
---
S
N
---
L
S
G
F
S
I
--
D
L
W
R
S
I
A
T
Q
I
G
------
I
---
E
S
K
L
I
E
-
Y
S
-
S
V
P
E
L
I
S
A
I
K
--------
D
N
--
K
V
N
L
G
I
A
A
I
--
S
I
T
A
---
E
R
E
Q
--
N
F
D
F
S
--
L
P
I
F
A
S
G
--------
L
---
Q
---------------------------
I
M
V
R
N
------
G
D
I
R
S
I
D
D
L
P
--
G
K
V
V
A
T
T
A
G
S
T
A
A
-
T
Y
L
R
E
----
H
----
H
---
I
-
S
V
L
E
V
P
K
I
E
E
A
Y
K
A
L
Q
T
K
K
A
D
A
-------
V
V
F
D
A
P
--
V
L
-
L
--
F
Y
-
A
A
N
E
G
K
--
G
K
V
E
I
V
G
----
S
I
--
L
--------
R
E
------
E
S
Y
G
I
-----
I
L
P
N
-
N
-
S
P
Y
R
K
P
I
N
----
Q
A
L
L
N
L
K
E
N
G
T
--
Y
Q
S
L
Y
D
K
---
W
F
D
P
-----------------------------------------------------------------------------------------
42
Fugue
63.73
17%
-39
- C3 -
2YKF
17
PDTAS_MYCTU
A:
[3-288]
----
M
S
T
L
G
D
L
L
A
E
H
T
V
L
P
G
S
A
V
D
H
L
H
A
V
V
G
E
W
Q
-----
L
L
A
D
L
S
F
A
D
Y
L
M
W
V
R
R
D
D
G
-----------
V
L
V
C
V
A
Q
C
R
---------------
P
N
T
G
P
T
-
V
V
H
T
D
A
V
G
T
V
--------
V
A
A
N
S
M
P
L
V
A
A
-
T
--
F
-
S
G
---
G
H
S
V
--
E
V
S
P
V
R
-
F
G
---------------------------------------------------
D
Q
V
V
A
V
L
T
R
H
Q
P
E
L
A
--
A
R
R
--------------
R
S
----
G
----
H
---
L
-
E
T
A
Y
R
L
C
A
T
D
L
L
R
M
L
A
E
G
T
F
P
D
ASRSSPR
A
G
D
G
F
I
--
R
L
-
D
VD
G
V
-
V
S
Y
A
S
P
N
A
L
S
A
Y
H
R
M
----
G
L
--
T
T
---
E
---
L
E
------
G
V
N
L
I
-----
D
A
T
R
-
P
L
I
S
-
D
P
F
E
A
----
H
E
V
D
E
H
V
Q
D
L
L
--
A
G
D
G
K
G
M
---
R
M
E
V
D
A
G
G
A
T
V
L
L
R
T
L
P
L
V
V
A
G
R
N
-
V
G
A
A
--
I
L
I
R
D
V
T
E
V
K
R
---------------------------------------------------
12
PsiBlast_PDB
63.19
19%
-83
- C8 -
4KR5
4
?
A:
[71-229]
-----------------------------------------------------------------------------------------------------------------------------
M
M
S
G
-
M
--
S
-
I
T
---
D
A
R
K
--
Q
V
F
D
Y
G
-
S
P
Y
Y
S
S
------------
N
L
---------------------------
T
I
A
T
S
S
T
D
D
---
S
I
K
S
W
K
D
L
K
--
G
K
T
L
G
A
K
N
G
T
A
S
F
-
D
Y
L
N
A
----
H
A
KEY
G
---
Y
-
T
V
K
T
F
T
D
A
T
T
M
Y
S
S
L
N
N
G
S
I
N
A
-------
L
M
D
D
E
P
--
V
I
----------------
K
Y
A
I
K
Q
----
G
Q
--
K
F
---
A
---
T
P
I
K
P
I
P
D
G
Q
Y
G
F
-----
A
V
K
K
G
S
N
P
E
L
I
E
M
F
N
----
N
G
L
A
N
L
R
A
N
G
E
--
Y
D
K
I
I
D
K
---
Y
L
E
------------------------------------------------------------------------------------------
38
Fugue
62.75
16%
-45
* C7 *
4LXU
13
?
A:
[1-273]
----
G
H
M
I
K
I
C
I
A
---------
G
K
N
N
I
A
V
N
S
L
Q
F
-----
I
L
K
N
Y
F
E
A
D
Q
I
V
V
I
P
-
N
K
N
D
K
G
I
D
S
W
Q
K
--
S
L
L
K
F
A
L
D
N
-
N
------
I
K
I
V
T
L
D
E
I
Y
N
I
---
E
Q
I
I
F
F
S
L
E
--------
F
D
Q
I
---
I
K
I
E
-
N
--
F
-
K
S
---
D
R
L
F
--
N
I
H
F
S
A
-
L
P
K
Y
K
G
V
--------
F
T
S
I
T
---------------------------
P
I
L
----
N
N
E
L
E
S
G
V
T
L
H
R
I
----------
D
N
G
I
D
T
G
N
I
I
D
Q
----
H
----
C
---
F
-
P
I
D
I
N
D
T
A
R
D
L
Y
F
N
Y
L
K
Y
G
E
S
I
-------
F
K
K
N
I
Q
--
T
I
I
N
--
N
S
-
Y
K
D
L
K
Q
T
N
I
N
S
S
Y
F
S
----
R
K
--
D
I
---
N
---
L
V
------
H
K
I
N
F
-------
K
K
-
T
S
F
E
I
H
N
Q
I
R
A
F
IF
Q
E
Y
Q
L
P
I
I
N
N
--------
S
K
---
I
I
K
S
I
L
A
N
E
F
I
G
Y
N
V
F
E
E
F
E
N
Y
F
I
I
S
G
I
D
--
G
F
K
I
I
A
Q
K
L
N
K
---------------------------------------------------
17
HHSearch
62.60
15%
-62
- C8 -
3H7M
1
?
A:
[21-231]
-----------------------------------------------
Y
P
P
Y
E
F
--
I
D
Q
N
G
K
P
A
G
Y
N
V
--
E
L
T
R
A
I
A
E
V
M
G
------
M
---
T
V
E
F
R
--
L
G
-
A
W
S
E
M
F
S
A
L
K
--------
S
G
--
R
V
D
V
L
Q
G
-
I
--
S
W
S
E
---
K
R
A
R
--
Q
I
D
F
T
--
P
P
H
T
I
V
Y
--------
H
---
A
---------------------------
I
F
A
R
R
D
S
P
----
P
A
A
G
L
E
D
L
R
--
G
R
K
V
A
L
H
R
D
G
I
M
H
-
E
Y
L
A
E
----
R
----
G
YG-
K
-
D
L
V
L
T
P
T
P
A
D
A
L
R
L
L
A
A
G
G
C
D
Y
-------
A
V
V
A
M
V
--
P
G
-
M
--
Y
I
-
I
R
E
N
R
L
--
T
N
L
V
P
V
A
----
R
S
--
I
--------
A
A
------
Q
R
Y
G
Y
-----
A
V
R
Q
-
G
D
A
E
L
L
A
R
F
S
----
E
G
L
A
I
L
R
K
T
G
Q
--
Y
E
A
I
R
A
K
---
W
L
G
V
L
E
P
--------------------------------------------------------------------------------------
20
HHSearch
62.07
11%
-93
- C8 -
1II5
1
?
A:
[14-226]
------------------------------------------------
P
P
F
V
F
-
Y
G
----
A
F
T
G
I
S
L
--
D
V
W
R
A
V
A
E
S
Q
K
------
W
---
N
S
E
Y
V
R
-
Q
N
-
S
I
S
A
G
I
T
A
V
A
--------
E
G
--
E
L
D
I
L
I
G
P
I
--
S
V
T
P
---
E
R
A
A
IE
G
I
T
F
T
--
Q
P
Y
F
S
S
G
--------
I
---
G
---------------------------
L
L
I
P
G
T
A
T
P
---
L
F
R
S
V
G
D
L
K
--
N
K
E
V
A
V
V
R
D
T
T
A
V
-
D
W
A
N
F
----
Y
----
Q
---
A
-
D
V
R
E
T
N
N
L
T
A
A
I
T
L
L
Q
K
K
Q
V
E
A
-------
V
M
F
D
R
P
--
A
L
-
I
--
Y
Y
-
T
R
Q
N
P
N
--
L
N
L
E
V
T
E
----
I
R
--
V
--------
S
L
------
E
P
Y
G
F
-----
V
L
K
E
-
N
-
S
P
L
Q
K
T
I
N
----
V
E
M
L
N
L
L
Y
S
R
V
--
I
A
E
F
T
E
R
---
W
L
G
------------------------------------------------------------------------------------------
15
HHSearch
61.74
13%
-62
- C8 -
2Q88
3
?
A:
[21-249]
----------------------------------------------
N
E
P
P
F
T
A
--
V
G
A
D
G
K
V
S
G
A
A
P
--
D
V
A
R
E
I
F
K
R
L
G
------
V
---
A
D
V
V
A
S
-
I
S
-
E
Y
G
A
M
I
P
G
L
Q
--------
A
G
--
R
H
D
A
I
T
A
G
L
--
F
M
K
P
---
E
R
C
A
--
A
V
A
Y
S
--
Q
P
I
L
C
D
A
--------
E
---
A
---------------------------
F
A
L
K
K
G
N
P
L
G
L
K
S
Y
K
D
I
A
D
N
P
--
D
A
K
I
G
A
P
G
G
G
T
E
E
-
K
L
A
L
E
----
A
----
G
VPR
D
-
R
V
I
V
V
P
D
G
Q
S
G
L
K
M
L
Q
D
G
R
I
D
V
-------
Y
S
L
P
V
L
--
S
I
-
N
--
D
L
-
V
S
K
A
N
D
--
P
N
V
E
V
L
A
----
P
V
--
E
G
---
A
---
P
V
------
Y
C
D
G
A
-----
A
F
R
K
-
G
D
E
A
L
R
D
A
F
D
----
V
E
L
A
K
L
K
E
S
G
E
--
F
A
K
I
I
E
P
---
Y
G
F
S
A
K
A
A
M
S
T
T
R
E
K
L
C
A
A
K
-------------------------------------------------------------------------
44
Fugue
60.92
18%
-50
- C5 -
4L5C
3
?
A:
[24-312]
---K
V
K
V
G
I
I
G
G
S
G
F
D
D
P
N
L
F
K
K
V
G
V
R
Q
V
T
T
P
F
G
KPS
D
T
L
V
E
G
F
V
G
D
V
A
C
V
V
L
P
R
H
G
K
G
H
L
I
P
P
S
E
V
N
Y
R
A
N
V
W
A
L
K
D
-
L
------
G
C
T
H
I
L
A
T
N
A
C
G
S
-
L
Q
-------
E
--------
D
L
V
P
G
D
F
V
V
L
N
-
Q
--
F
-
M
D
KTW
G
R
E
N
--
T
F
Y
G
S
K
-
P
D
S
L
K
G
V
--------
L
H
M
P
M
AE-------------------------
P
F
C
E
R
T
R
Q
I
L
I
Q
A
A
R
N
K
S
I
N
V
--
Y
D
K
K
T
M
D
K
S
A
C
I
H
-
P
C
V
H
A
----
E
----
G
---
S
-
A
V
T
I
--
N
G
P
R
F
S
T
R
C
E
S
F
I
H
K
A
-------
M
G
L
D
I
V
N
M
T
L
-
V
--
P
E
-
V
S
L
A
R
E
A
G
L
-----
S
----
Y
A
--
S
I
---
A
---
I
V
------
T
D
F
D
C
-----
W
K
S
E
-
E
E
H
V
C
V
D
M
V
L
----
E
Q
F
R
K
S
V
V
H
V
R
E
I
L
L
E
A
V
A
L
---
I
G
A
E
D
W
T
K
T
I
E
A
N
K
A
L
V
M
S
S
R
Q
D
L
---------------------------------------------------------------------