@TOME V2.2
(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 : S15A4_HUMAN: (2015-12-09 )
MEGSGGGAGERAPLLGARRAAAAAAAAGAFAGRRAACGAVLLTELLERAAFYGITSNLVLFLNGAPFCWEGAQASEALLLFMGLTYLGSPFGGWLADARLGRARAILLSLALYLLGMLAFPLLAAPATRAALCGSARLLNCTAPGPDAAARCCSPATFAGLVLVGLGVATVKANITPFGADQVKDRGPEATRRFFNWFYWSINLGAILSLGGIAYIQQNVSFVTGYAIPTVCVGLAFVVFLCGQSVFITKPPDGSAFTDMFKILTYSCCSQKRSGERQSNGEGIGVFQQSSKQSLFDSCKMSHGGPFTEEKVEDVKALVKIVPVFLALIPYWTVYFQMQTTYVLQSLHLRIPEISNITTTPHTLPAAWLTMFDAVLILLLIPLKDKLVDPILRRHGLLPSSLKRIAVGMFFVMCSAFAAGILESKRLNLVKEKTINQTIGNVVYHAADLSLWWQVPQYLLIGISEIFASIAGLEFAYSAAPKSMQSAIMGLFFFFSGVGSFVGSGLLALVSIKAIGWMSSHTDFGNINGCYLNYYFFLLAAIQGATLLLFLIISVKYDHHRDHQRSRANGVPTSRRA
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.......430.........440..--.....450.......460-........470.......480.......490.......500.......510--.---.......520.......530.......540.......550.......560..------......570.....-----------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MEGSGGGAGERAPLLG
A
R
R
A
A
A
A
A
A
A
A
G
AFAGRRAA
C
G
A
V
L
L
T
E
L
L
E
R
A
-----
A
F
YGITS
N
L
V
L
F
L----N-----GA-----PFCWEGA------
Q
A
S
E
A
L
L
L
F
M
G
L
T
Y
LGSPFG
G
W
L
A
D
ARL
G
---
R
A
R
A
I
L
L
S
L
A
L
Y
---
L
L
G
M
L
A
F
P
L
-LAAP
A
T
R
A
A
LCGS
A
R
L
L
NCTAPG
P
D
A
A
A
RCC
S
-
P
-
A
T
F
A
G
L
V
L
V
G
L
G
V
A
T
V
K
ANITPFG
A
D
Q
V
KDRG
P
E
A
T
R
R
---
F
--
F
N
W
F
Y
W
S
IN
L
G
A
-
I
L
---
S
LG
G
I
A
Y
I
Q
QNVSFVTGY
A
I
P
-------
T
V
C
V
G
L
A
F
V
V
F
L
CG
Q
S
V
F
I
----------------
T
----KPPDG
S
A
F
T
D
M
F
K
I
L
T
Y
S
C
C
SQKRSGERQ-----------------SNG------------------E
G
I
-----------
G
V
-------------FQQS
S
K
Q
S
L
F
-----
D
-SCKMSHGGPF-------
T
-----
E
E
K
V
E
D
V
K
A
--
L
V
K
I
V
P
V
F
L
A
L
I
P
---
Y
W
T
V
Y
F
Q
M
Q
T
T
Y
V
----------
L
Q
S
L
HLR---IPEISNITTTPHT
L
P
----
A
A
W
L
T
M
F
D
A
V
L
I
L
L
LIP
L
K
D
K
L
V
D
P
I
L
R
R-----HGL
L
P
S
S
L
K
R
I
A
V
G
M
F
F
V
M
C
S
A
---
F
A
A
G
I
L
E
S
K
R
L
N
L
V
--
K
E
K
T
I
N
Q
T
I
G
N
V
V
Y
--HAA
D
L
S
L
W
W
Q
V
P
Q
Y
L
L
I
--
G
I
S
E
I
F
A
S
I
AG
L
E
F
A
YSAA
P
K
S
M
Q
S
A
I
M
G
L
F
F
F
F
S
G
V
G
S
F
V
G
S
G
L
L
A
L
V
S
---
I
---
K
A
I
GWMSSHTDFGNIN
G
C
Y
L
N
Y
Y
F
F
L
L
A
A
IQ
G
A
T
L
L
L
F
L
I
I
S
V
K
YDHH-R
D
H
------
Q
RSRANGVPTSRRA-----------
1
PsiBlast_PDB
90.56
25%
-128
- C4 -
4OH3
1
PTR7_ARATH
A:
[29-572]
-------------------------------
G
G
W
A
S
A
A
M
I
L
C
I
E
A
V
E
R
L
-----
T
T
L
G
I
G
V
N
L
V
T
Y
L
----
T
-----
G
T
------
M
H
L
G
N
A
------
T
A
A
N
T
V
T
N
F
L
G
T
S
F
M
L
C
L
L
G
G
F
I
A
D
T
F
L
G
---
R
Y
L
T
I
A
I
F
A
A
I
Q
---
A
T
G
V
S
I
L
T
L
S
T
I
I
P
G
L
R
P
P
R
C
N
P
T
T
S
S
H
C
-----
E
Q
A
S
G
I
Q
L
-
T
-
V
L
Y
L
A
L
Y
L
T
A
L
G
T
G
G
V
K
A
S
V
S
G
F
G
S
D
Q
F
D
E
T
E
P
K
E
R
S
K
M
T
Y
F
--
F
N
R
F
F
F
C
I
N
V
G
S
-
L
L
---
A
V
T
V
L
V
Y
V
Q
D
D
V
G
R
K
W
G
Y
G
I
C
-------
A
F
A
I
V
L
A
L
S
V
F
L
A
G
T
N
R
Y
R
----------------
F
----
K
K
L
I
G
S
P
M
T
Q
V
A
A
V
I
V
A
A
W
R
N
---------------------------------------------------------------------------------
A
A
I
R
-----
D
-
Q
E
A
G
V
T
S
---TLS----
T
-----
L
T
D
V
E
E
V
K
Q
--
I
V
R
M
L
P
I
W
A
T
C
I
L
---
F
W
T
V
H
A
Q
L
T
T
L
S
V
----------
A
Q
S
---------
E
T
L
D
R
S
I
G
S
F
E
I
P
----
P
A
S
M
A
V
F
Y
V
G
G
L
L
L
T
T
A
V
Y
D
R
V
A
I
R
L
C
K
K
L
FNYP
H
G
L
R
P
--
L
Q
R
I
G
L
G
L
F
F
G
S
M
A
M
---
A
V
A
A
L
V
E
L
K
R
L
R
T
A
--
H
A
-----------------
P
L
G
F
Y
L
L
I
P
Q
Y
L
I
V
--
G
I
G
E
A
L
I
Y
T
G
Q
L
D
F
F
L
R
E
C
P
K
G
M
K
G
M
S
T
G
L
L
L
S
T
L
A
L
G
F
F
F
S
S
V
L
V
T
I
V
E
---
K
F
TG
K
A
H
P
W
I
A
D
-----
D
L
N
K
G
R
L
Y
N
F
Y
W
L
V
A
V
L
V
A
L
N
F
L
I
F
L
V
F
S
K
W
Y
V
Y
K
-
E
K
R
------
L
A
E
V
---------------------
3
PsiBlast_PDB
84.13
22%
-116
- C4 -
4UVM
5
?
A:
[17-512]
---------------------------------------
I
I
A
S
E
A
C
E
R
F
-----
S
F
Y
G
M
R
N
I
L
T
P
F
L
----
M
-----
T
A
LLLSI
P
E
E
L
R
G
A
------
V
A
K
D
V
F
H
S
F
V
I
G
V
Y
F
F
P
L
L
G
G
W
I
A
D
R
F
F
G
---
K
Y
N
T
I
L
W
-------------------------------
L
S
L
I
Y
C
V
G
H
A
F
L
A
I
F
E
H
S
V
-
Q
-
G
F
Y
T
G
L
F
L
I
A
L
G
S
G
G
I
K
P
L
V
S
S
F
M
G
D
Q
F
D
Q
S
N
K
S
L
A
Q
K
---
A
--
F
D
M
F
Y
F
T
I
N
F
G
S
-
F
F
---
A
S
L
S
M
P
L
L
L
K
N
F
G
A
A
V
A
F
G
I
P
-------
G
V
L
M
F
V
A
T
V
F
F
W
L
G
R
K
R
Y
I
----------------
H
----
M
P
P
E
P
K
D
P
H
G
F
L
P
V
I
R
-
S
A
L
L
T
K
V
E
G
K
G
N
I
G
L
V
L
A
L
I
G
G
V
S
A
A
Y
A
L
V
N
I
------------------
P
T
L
-----------
G
I
V
A
G
L
C
C
A
M
V
L
V
M
G
F
V
G
A
G
A
S
L
Q
L
-----
E
-
R
A
R
K
S
H
-----------
P
-----
D
A
A
V
D
G
V
R
S
--
V
L
R
I
L
V
L
F
A
L
V
T
P
---
F
W
S
L
F
D
Q
K
A
S
T
W
I
----------
L
Q
A
------------
N
D
M
V
K
P
Q
W
F
E
----
P
A
M
M
Q
A
L
N
P
L
L
V
M
L
L
I
P
F
N
N
F
V
L
Y
P
A
I
E
R
-----
M
G
V
K
L
T
A
L
R
K
M
G
A
G
I
A
I
T
G
L
S
W
---
I
V
V
G
-------------------
T
I
Q
L
M
M
D
--
G
G
S
A
L
S
I
F
W
Q
I
L
P
Y
A
L
L
--
T
F
G
E
V
L
V
S
A
T
G
L
E
F
A
Y
S
Q
A
P
K
A
M
K
G
T
I
M
S
F
W
T
L
S
V
T
V
G
N
L
--
W
V
L
L
A
N
V
S
---
V
---
K
S
P
T
V
T
E
Q
I
V
Q
T
G
M
S
V
T
A
F
Q
M
F
F
F
A
G
F
A
I
L
A
A
I
V
F
A
L
Y
A
R
S
Y
Q
M
Q
D
H
Y
-----------------------------------
33
Fugue
82.42
21%
-120
- C4 -
4IKW
13
?
A:
[3-494]
-------------
S
I
D
K
Q
Q
I
A
A
S
V
P
Q
R
G
F
F
-
G
H
P
K
G
L
F
T
L
F
F
T
E
F
W
E
R
F
-----
S
Y
Y
G
M
R
A
I
L
V
Y
Y
M
YYEV
S
-----
K
G
-----
G
L
G
L
D
E
H
------
L
A
L
A
I
M
S
I
Y
G
A
L
V
Y
M
S
G
I
I
G
G
W
L
A
D
R
V
F
G
---
T
S
R
A
V
F
Y
G
G
L
L
I
---
M
A
G
H
I
A
L
A
I
----------------------
P
G
G
-------
V
-
A
-
A
L
F
V
S
M
A
L
I
V
L
G
T
G
L
L
K
P
N
V
S
S
I
V
G
D
M
Y
K
P
-
G
D
D
R
R
D
A
---
G
--
F
S
I
F
Y
M
G
I
N
L
G
A
-
F
L
---
A
P
L
V
V
G
T
A
G
M
K
Y
N
F
H
L
G
F
G
L
A
-------
A
V
G
M
F
L
G
L
V
V
F
V
A
T
R
K
K
N
L
GLAGTYVP
N
P
L
T
P
A
E
K
K
----
K
A
A
A
I
M
A
V
G
A
V
V
I
A
V
L
L
A
I
L
I
P
N
G
W
F
T
V
E
-----------------
T
F
I
------------------
S
L
V
-----------
G
I
-------------
L
G
I
I
I
P
I
I
Y
F
-----
V
-
V
M
Y
R
S
P
K
T
T
-----------------
A
E
E
R
S
R
--
V
I
A
Y
I
P
L
F
V
A
S
A
M
---
F
W
A
I
Q
E
Q
G
S
T
I
L
A
----------
N
Y
A
D
K
R
T
---
Q
L
D
V
A
G
I
H
-----
L
S
----
P
A
W
F
Q
S
L
N
P
L
F
I
I
I
L
A
P
V
F
A
W
M
W
V
K
L
G
K
R
-----
Q
---
P
T
I
P
Q
K
F
A
L
G
L
L
F
A
G
L
S
F
---
I
V
I
L
V
P
G
H
L
--------------
S
G
G
G
L
V
H
--------
P
I
W
L
V
L
S
Y
F
I
V
--
V
L
G
E
L
C
L
S
P
V
G
L
S
A
T
T
K
L
A
P
A
A
F
S
A
Q
T
M
S
L
W
F
L
S
N
A
A
A
Q
A
I
N
A
Q
L
V
R
F
Y
T
---
P
---
E
--------------------
N
E
T
A
Y
F
G
T
I
G
G
A
A
L
V
L
G
L
I
L
L
A
I
A
P
R
I
-
G
R
L
------
M
K
G
----------------------
12
PsiBlast_PDB
81.24
20%
-126
- C4 -
4D2B
8
?
A:
[8-449]
-----------------------------
F
F
G
Q
P
L
G
L
S
T
L
F
M
T
E
M
W
E
R
F
-----
S
Y
Y
G
M
R
A
I
L
L
Y
Y
M
W
F
L
I
S
-----
T
G
-----
D
L
H
I
T
R
A
------
T
A
A
S
I
M
A
I
Y
A
S
M
V
Y
L
S
G
T
I
G
G
F
V
A
D
R
I
I
G
---
A
R
P
A
V
F
W
G
G
V
L
I
---
M
L
G
H
I
---
V
-
L
A
L
P
F
G
A
S
A
L
F
G
S
---------------------------
I
I
L
I
I
I
G
T
G
F
L
K
P
N
V
S
T
L
-
V
G
T
L
Y
D
E
H
D
R
R
R
D
A
---
G
--
F
S
I
F
V
F
G
I
N
L
G
A
-
F
I
---
A
P
L
I
V
G
A
A
Q
E
A
A
G
Y
H
V
A
F
S
L
A
-------
A
I
G
M
F
I
G
L
L
V
Y
Y
F
G
G
K
K
T
L
----------------
D
PHYL
R
P
T
D
P
L
A
P
E
E
V
K
P
L
L
V
K
V
S
L
A
V
A
G
F
I
A
I
I
-----------------
V
V
M
------------------
N
L
V
-----------
G
W
-------------
N
S
L
P
A
Y
I
N
L
L
-----
T
-
I
V
A
I
A
I
P
V
F
Y
-------
F
-----
A
W
M
I
S
----LR
V
V
S
Y
I
P
L
F
I
A
A
V
L
---
F
W
A
I
--
E
E
Q
G
S
V
V
----------
L
A
T
F
A
A
E
---
R
V
D
S
S
-------
W
F
P
----
V
S
W
F
Q
S
L
N
P
L
F
I
M
L
Y
T
P
F
F
A
W
L
W
T
A
---
N
-----
Q
---
P
S
S
P
T
K
F
A
V
G
L
M
F
A
G
L
S
F
---
L
L
M
A
I
------------
P
G
A
L
Y
G
T
S
G
K
V
---------
S
P
L
W
L
V
G
S
W
A
L
V
--
I
L
G
E
M
L
I
S
P
V
G
L
S
V
T
T
----------
M
M
S
M
W
F
L
S
S
S
V
G
S
A
L
N
A
Q
L
V
T
L
Y
N
---
A
---
K
S
E
V
A
Y
F
S
Y
F
G
L
G
S
V
V
L
G
I
V
L
V
F
L
S
----------------------------------------------------------
32
Fugue
79.52
22%
-114
- C4 -
2XUT
-
?
A:
[13-500]
-----------------------------------
Q
I
P
Y
I
I
A
S
E
A
C
E
R
F
-----
S
F
Y
G
M
R
N
I
L
T
P
F
L
----
M
T
A
LLL
S
I
-----
P
E
E
L
R
G
A
------
V
A
K
D
V
F
H
S
F
V
I
G
V
Y
F
F
P
L
L
G
G
W
I
A
D
R
F
F
G
---
K
Y
N
T
I
L
W
L
S
L
I
Y
---
C
V
G
H
A
F
L
A
I
-
F
E
H
S
---------------------------
V
-
Q
-
G
F
Y
T
G
L
F
L
I
A
L
G
S
G
G
I
K
P
L
V
S
S
F
M
G
D
Q
F
D
Q
S
N
K
S
L
A
Q
K
---
A
--
F
D
M
F
Y
F
T
I
N
F
G
S
-
F
F
---
A
S
L
S
M
P
L
L
L
K
N
F
G
A
A
V
A
F
G
I
P
-------
G
V
L
M
F
V
A
T
V
F
F
W
L
G
R
K
R
Y
I
----------------
H
----
M
P
V
E
G
K
G
N
I
G
L
V
L
A
L
I
G
G
V
S
A
A
Y
A
L
V
N
I
P
-----------------
T
L
G
------------------
I
V
A
-----------
G
L
-------------
C
C
A
M
V
L
V
M
G
F
-----
V
-
G
A
G
A
S
L
Q
L
E
R
-------
A
RKSHP
D
A
A
V
D
G
V
R
S
--
V
L
R
I
L
V
L
F
A
L
V
T
P
---
F
W
S
L
F
D
Q
K
A
S
T
W
I
----------
L
Q
A
N
D
------------
M
V
K
P
Q
W
F
E
----
P
A
M
M
Q
A
L
N
P
L
L
V
M
L
L
I
P
F
N
N
F
-----------------
V
T
A
L
R
K
M
G
A
G
I
A
I
T
G
L
S
W
---
I
----------
V
V
G
--
T
I
Q
L
M
M
D
G
G
S
A
L
---------
S
I
F
W
Q
I
L
P
Y
A
L
L
--
T
F
G
E
V
L
V
S
A
T
G
L
E
F
A
Y
S
Q
A
P
K
A
M
K
G
T
I
M
S
F
W
T
L
S
V
T
V
G
N
L
W
V
L
L
A
N
V
S
V
K
---
S
---
P
-----------------
T
V
T
E
Q
I
V
Q
T
G
M
S
V
T
A
F
Q
M
F
F
F
A
G
F
A
I
L
A
A
I
-
V
F
A
-------------------------------
5
PsiBlast_PDB
78.31
21%
-110
- C4 -
4IKW
13
?
A:
[6-441]
-----------------
K
Q
Q
I
A
A
S
V
P
Q
R
G
F
F
G
H
P
K
G
L
F
T
L
F
F
T
E
F
W
E
R
F
-----
S
Y
Y
G
M
R
A
I
L
V
Y
Y
M
YYEV
S
-----
K
G
-----
G
L
G
L
D
E
H
------
L
A
L
A
I
M
S
I
Y
G
A
L
V
Y
M
S
G
I
I
G
G
W
L
A
D
R
V
F
G
---
T
S
R
A
V
F
Y
G
G
L
L
I
---
M
A
G
H
I
A
----
L
A
I
P
G
G
V
A
A
L
---------------------------
F
V
S
M
A
L
I
V
L
G
T
G
L
L
K
P
N
V
S
S
I
V
G
D
M
Y
K
---
P
G
D
D
R
R
---
D
A
G
F
S
I
F
Y
M
G
I
N
L
G
A
-
F
L
---
A
P
L
V
V
G
T
A
G
M
K
Y
N
F
H
L
G
F
G
L
A
-------
A
V
G
M
F
L
G
L
V
V
F
V
A
T
R
-------------------------
K
K
N
L
G
L
A
G
T
Y
V
P
N
P
L
T
--
P
A
E
K
K
K
A
A
A
I
M
-----------------
A
V
G
------------------
A
V
V
I
A
V
L
L
A
I
L
I
P
N
G
W
-------------
F
T
V
E
T
F
I
S
L
V
-----
G
-
I
L
G
I
I
I
P
I
I
Y
F
V
V
M
Y
R
S
P
-----
K
T
T
A
E
E
R
S
R
--
V
I
A
Y
I
P
L
F
V
A
S
A
M
---
F
W
A
I
Q
E
Q
G
S
T
I
L
A
----------
N
Y
A
D
K
R
T
---
Q
L
D
V
A
G
I
H
L
S
P
---------
A
W
F
Q
S
L
N
P
L
F
I
I
I
L
A
P
V
F
A
W
M
W
V
K
L
G
K
R
-----
Q
P
T
I
P
---
Q
K
F
A
L
G
L
L
F
A
G
L
S
F
---
I
V
--
I
L
V
P
G
H
L
S
-------------
G
G
G
L
V
--
H
P
I
-----
W
L
V
L
S
Y
F
I
V
--
V
L
G
E
L
C
L
S
P
V
G
L
S
A
T
T
K
L
A
P
A
A
F
S
A
Q
T
M
S
L
W
F
L
S
N
A
A
A
Q
A
I
N
A
Q
L
V
R
F
Y
T
---
P
---
E
N
E
T
A
Y
F
G
T
I
G
G
A
A
L
V
L
G
L
I
L
L
A
I
A
P
R
I
G
R
L
M
K
G
-------------------------------------------------
2
PsiBlast_PDB
77.74
22%
-113
- C4 -
2XUT
-
?
A:
[17-500]
---------------------------------------
I
I
A
S
E
A
C
E
R
F
-----
S
F
Y
G
M
R
N
I
L
T
P
F
L
----
M
-----
T
A
LLLSI
P
E
E
L
R
G
A
------
V
A
K
D
V
F
H
S
F
V
I
G
V
Y
F
F
P
L
L
G
G
W
I
A
D
R
F
F
G
---
K
Y
N
T
I
L
W
-------------------------------
L
S
L
I
Y
C
V
G
H
A
F
L
A
I
F
E
H
S
V
-
Q
-
G
F
Y
T
G
L
F
L
I
A
L
G
S
G
G
I
K
P
L
V
S
S
F
M
G
D
Q
F
D
Q
S
N
K
S
L
A
Q
K
---
A
--
F
D
M
F
Y
F
T
I
N
F
G
S
-
F
F
---
A
S
L
S
M
P
L
L
L
K
N
F
G
A
A
V
A
F
G
I
P
-------
G
V
L
M
F
V
A
T
V
F
F
W
L
G
R
K
R
Y
I
----------------
H
----
M
P
---------------------
V
E
G
K
G
N
I
G
L
V
L
A
L
I
G
G
V
S
A
A
Y
A
L
V
N
I
------------------
P
T
L
-----------
G
I
V
A
G
L
C
C
A
M
V
L
V
M
G
F
V
G
A
G
A
S
L
Q
L
-----
E
-
R
A
R
K
S
H
-----------
P
-----
D
A
A
V
D
G
V
R
S
--
V
L
R
I
L
V
L
F
A
L
V
T
P
---
F
W
S
L
F
D
Q
K
A
S
T
W
I
----------
L
Q
A
------------
N
D
M
V
K
P
Q
W
F
E
----
P
A
M
M
Q
A
L
N
P
L
L
V
M
L
L
I
P
F
N
N
F
V
-----------------
T
A
L
R
K
M
G
A
G
I
A
I
T
G
L
S
W
---
I
V
V
G
-------------------
T
I
Q
L
M
M
D
--
G
G
S
A
L
S
I
F
W
Q
I
L
P
Y
A
L
L
--
T
F
G
E
V
L
V
S
A
T
G
L
E
F
A
Y
S
Q
A
P
K
A
M
K
G
T
I
M
S
F
W
T
L
S
V
T
V
G
N
L
--
W
V
L
L
A
N
V
S
---
V
---
K
S
P
T
V
T
E
Q
I
V
Q
T
G
M
S
V
T
A
F
Q
M
F
F
F
A
G
F
A
I
L
A
A
I
V
F
A
-----------------------------------------------
4
PsiBlast_PDB
77.45
21%
-111
- C4 -
4IKV
8
?
A:
[6-441]
-----------------
K
Q
Q
I
A
A
S
V
P
Q
R
G
F
F
G
H
P
K
G
L
F
T
L
F
F
T
E
F
W
E
R
F
-----
S
Y
Y
G
M
R
A
I
L
V
Y
Y
M
Y
YEV
S
-----
K
G
-----
G
L
G
L
D
E
H
------
L
A
L
A
I
M
S
I
Y
G
A
L
V
Y
M
S
G
I
I
G
G
W
L
A
D
R
V
F
G
---
T
S
R
A
V
F
Y
G
G
L
L
I
---
M
A
G
H
I
A
----
L
A
I
P
G
G
V
A
A
L
---------------------------
F
V
S
M
A
L
I
V
L
G
T
G
L
L
K
P
N
V
S
S
I
V
G
D
M
Y
K
---
P
G
D
D
R
R
---
D
A
G
F
S
I
F
Y
M
G
I
N
L
G
A
-
F
L
---
A
P
L
V
V
G
T
A
G
M
K
Y
N
F
H
L
G
F
G
L
A
-------
A
V
G
M
F
L
G
L
V
V
F
V
A
T
R
-------------------------
K
K
N
L
G
L
A
G
T
Y
V
P
N
P
L
T
--
P
A
E
K
K
K
A
A
A
I
M
-----------------
A
V
G
------------------
A
V
V
I
A
V
L
L
A
I
L
I
P
N
G
W
-------------
F
T
V
E
T
F
I
S
L
V
-----
G
-
I
L
G
I
I
I
P
I
I
Y
F
V
V
M
Y
R
S
P
-----
K
T
T
A
E
E
R
S
R
--
V
I
A
Y
I
P
L
F
V
A
S
A
M
---
F
W
A
I
Q
E
Q
G
S
T
I
L
A
----------
N
Y
A
D
K
R
T
---
Q
L
D
V
A
G
I
H
L
S
P
---------
A
W
F
Q
S
L
N
P
L
F
I
I
I
L
A
P
V
F
A
W
M
W
V
K
L
G
K
R
-----
Q
P
T
I
P
---
Q
K
F
A
L
G
L
L
F
A
G
L
S
F
---
I
V
--
I
L
V
P
G
H
L
S
-------------
G
G
G
L
V
--
H
P
I
-----
W
L
V
L
S
Y
F
I
V
--
V
L
G
E
L
C
L
S
P
V
G
L
S
A
T
T
K
L
A
P
A
A
F
S
A
Q
T
M
S
L
W
F
L
S
N
A
A
A
Q
A
I
N
A
Q
L
V
R
F
Y
T
---
P
---
E
N
E
T
A
Y
F
G
T
I
G
G
A
A
L
V
L
G
L
I
L
L
A
I
A
P
R
I
G
R
L
M
K
--------------------------------------------------
10
PsiBlast_PDB
77.22
22%
-118
- C4 -
4W6V
-
?
A:
[13-455]
-----------------------------
F
F
G
H
P
Y
P
L
S
G
L
F
L
S
E
M
W
E
R
F
-----
S
F
Y
G
I
R
P
L
L
I
L
F
M
----
A
-----
A
T
-----
V
F
--
D
G
G
MGLP
R
E
Q
A
S
A
I
V
G
I
F
A
G
S
M
Y
L
A
A
L
P
G
G
L
L
A
D
N
W
L
G
---
Q
Q
R
A
V
W
Y
G
S
I
L
I
---
A
L
G
H
L
S
I
A
L
--------
S
A
F
F
G
N
D
L
F
---------------------
F
I
G
L
V
F
I
V
L
G
T
G
L
F
K
T
C
I
S
V
M
V
G
T
L
Y
K
---
P
G
D
A
R
R
---
D
G
G
F
S
L
F
Y
M
G
I
N
M
G
S
-
F
I
---
A
P
L
L
S
G
W
L
L
R
T
H
G
W
H
W
G
F
G
I
G
-------
G
I
G
M
L
V
A
L
L
I
F
-
R
G
F
A
I
P
A
----------------
M
----
K
R
Y
D
A
E
V
G
L
D
--------
S
S
W
N
K
P
T
-----------------------
G
R
W
V
T
A
I
M
A
V
V
V
V
I
I
A
L
I
S
Q
G
V
-----------
I
P
-------------
I
N
P
V
M
I
A
S
L
L
V
Y
V
I
A
A
-
S
V
T
L
Y
F
I
Y
L
F
-------
A
-----
F
A
K
M
S
R
-
K
D
--
R
A
R
L
L
V
C
F
I
L
L
V
S
A
A
F
F
W
S
A
F
E
Q
K
P
T
S
F
---------------
N
L
F
---
A
N
D
Y
T
D
R
M
V
M
G
F
E
I
P
----
T
V
W
F
Q
S
I
N
A
L
F
I
I
L
L
A
P
V
F
S
-
W
A
---------------
P
S
S
I
T
K
F
V
I
G
---
I
L
C
A
A
---
A
G
F
A
V
M
M
Y
A
A
Q
H
V
L
--
S
S
G
--------------
G
A
G
V
S
P
L
W
L
V
M
S
I
L
L
L
--
T
L
G
E
L
C
L
S
P
I
G
L
A
T
M
T
L
L
A
P
D
R
M
R
G
Q
V
M
G
L
W
F
C
A
S
S
L
G
N
L
A
A
G
L
I
G
G
H
V
K
---
A
---
D
Q
L
D
M
L
P
T
L
F
A
R
C
S
I
A
L
V
I
C
A
A
V
L
I
L
L
I
V
P
I
R
R
L
M
------------------------------------------------
8
PsiBlast_PDB
77.21
21%
-112
- C4 -
4IKZ
1
?
A:
[6-441]
-----------------
K
Q
Q
I
A
A
S
V
P
Q
R
G
F
F
G
H
P
K
G
L
F
T
L
F
F
T
E
F
W
E
R
F
-----
S
Y
Y
G
M
R
A
I
L
V
Y
Y
M
YYEV
S
-----
K
G
-----
G
L
G
L
D
E
H
------
L
A
L
A
I
M
S
I
Y
G
A
L
V
Y
M
S
G
I
I
G
G
W
L
A
D
R
V
F
G
---
T
S
R
A
V
F
Y
G
G
L
L
I
---
M
A
G
H
I
A
----
L
A
I
P
G
G
V
A
A
L
---------------------------
F
V
S
M
A
L
I
V
L
G
T
G
L
L
K
P
N
V
S
S
I
V
G
D
M
Y
K
---
P
G
D
D
R
R
---
D
A
G
F
S
I
F
Y
M
G
I
N
L
G
A
-
F
L
---
A
P
L
V
V
G
T
A
G
M
K
Y
N
F
H
L
G
F
G
L
A
-------
A
V
G
M
F
L
G
L
V
V
F
V
A
T
R
-------------------------
K
K
N
L
G
L
A
G
T
Y
V
P
N
P
L
T
--
P
A
E
K
K
K
A
A
A
I
M
-----------------
A
V
G
------------------
A
V
V
I
A
V
L
L
A--------------------
F
T
V
E
T
F
I
S
L
V
-----
G
-
I
L
G
I
I
I
P
I
I
Y
F
V
V
M
Y
R
S
P
-----
K
T
T
A
E
E
R
S
R
--
V
I
A
Y
I
P
L
F
V
A
S
A
M
---
F
W
A
I
Q
Q
Q
G
S
T
I
L
A
----------
N
Y
A
D
K
R
T
---
Q
L
D
V
A
G
I
H
L
S
P
---------
A
W
F
Q
S
L
N
P
L
F
I
I
I
L
A
P
V
F
A
W
M
W
V
K
L
G
K
R
-----
Q
P
T
I
P
---
Q
K
F
A
L
G
L
L
F
A
G
L
S
F
---
I
V
--
I
L
V
P
G
H
L
S
-------------
G
G
G
L
V
--
H
P
I
-----
W
L
V
L
S
Y
F
I
V
--
V
L
G
E
L
C
L
S
P
V
G
L
S
A
T
T
K
L
A
P
A
A
F
S
A
Q
T
M
S
L
W
F
L
S
N
A
A
A
Q
A
I
N
A
Q
L
V
R
F
Y
T
---
P
---
E
N
E
T
A
Y
F
G
T
I
G
G
A
A
L
V
L
G
L
I
L
L
A
I
A
P
R
I
G
R
L
M
K
G
-------------------------------------------------
11
PsiBlast_PDB
77.16
20%
-121
- C4 -
4APS
-
?
A:
[11-449]
--------------------------------
Q
P
L
G
L
S
T
L
F
M
T
E
M
W
E
R
F
-----
S
Y
Y
G
M
R
A
I
L
L
Y
Y
M
W
F
L
I
S
-----
T
G
-----
D
L
H
I
T
R
A
------
T
A
A
S
I
M
A
I
Y
A
S
M
V
Y
L
S
G
T
I
G
G
F
V
A
D
R
I
I
G
---
A
R
P
A
V
F
W
G
G
V
L
I
---
M
L
G
H
I
---
V
-
L
A
L
P
F
G
A
S
A
L
F
G
S
---------------------------
I
I
L
I
I
I
G
T
G
F
L
K
P
N
V
S
T
L
-
V
G
T
L
Y
D
E
H
D
R
R
R
D
A
---
G
--
F
S
I
F
V
F
G
I
N
L
G
A
-
F
I
---
A
P
L
I
V
G
A
A
Q
E
A
A
G
Y
H
V
A
F
S
L
A
-------
A
I
G
M
F
I
G
L
L
V
Y
Y
F
G
G
K
K
T
L
----------------
D
PHYL
R
P
T
D
P
L
A
P
E
E
V
K
P
L
L
V
K
V
S
L
A
V
A
G
F
I
A
I
I
-----------------
V
V
M
------------------
N
L
V
-----------
G
W
-------------
N
S
L
P
A
Y
I
N
L
L
-----
T
-
I
V
A
I
A
I
P
V
F
Y
-------
F
-----
A
W
M
I
-------
V
V
S
Y
I
P
L
F
I
A
A
V
L
---
F
W
A
I
--
E
E
Q
G
S
V
V
----------
L
A
T
F
A
A
E
---
R
V
D
S
S
-------
W
F
P
----
V
S
W
F
Q
S
L
N
P
L
F
I
M
L
Y
T
P
F
F
A
W
L
W
T
A
W
K
K
N
-----------
S
P
T
K
F
A
V
G
L
M
F
A
G
L
S
F
---
L
L
M
A
I
------------
P
G
A
L
Y
G
T
S
G
K
V
---------
S
P
L
W
L
V
G
S
W
A
L
V
--
I
L
G
E
M
L
I
S
P
V
G
L
S
V
T
T
K
L
A
P
K
A
F
N
S
Q
M
M
S
M
W
F
L
S
S
S
V
G
S
A
L
N
A
Q
L
V
T
L
Y
N
---
A
---
K
S
E
V
A
Y
F
S
Y
F
G
L
G
S
V
V
L
G
I
V
L
V
F
L
-----------------------------------------------------------
13
PsiBlast_PDB
76.80
20%
-123
- C4 -
4D2C
7
?
A:
[8-449]
-----------------------------
F
F
G
Q
P
L
G
L
S
T
L
F
M
T
E
M
W
E
R
F
-----
S
Y
Y
G
M
R
A
I
L
L
Y
Y
M
W
F
L
I
S
-----
T
G
-----
D
L
H
I
T
R
A
------
T
A
A
S
I
M
A
I
Y
A
S
M
V
Y
L
S
G
T
I
G
G
F
V
A
D
R
I
I
G
---
A
R
P
A
V
F
W
G
G
V
L
I
---
M
L
G
H
I
---
V
-
L
A
L
P
F
G
A
S
A
L
F
G
S
---------------------------
I
I
L
I
I
I
G
T
G
F
L
K
P
N
V
S
T
L
-
V
G
T
L
Y
D
E
H
D
R
R
R
D
A
---
G
--
F
S
I
F
V
F
G
I
N
L
G
A
-
F
I
---
A
P
L
I
V
G
A
A
Q
E
A
A
G
Y
H
V
A
F
S
L
A
-------
A
I
G
M
F
I
G
L
L
V
Y
Y
F
G
G
K
K
T
L
----------------
D
PHYL
R
P
T
D
P
L
A
P
E
E
V
K
P
L
L
V
K
V
S
L
A
V
A
G
F
I
A
I
I
-----------------
V
V
M
------------------
N
L
V
-----------
G
W
-------------
N
S
L
P
A
Y
I
N
L
L
-----
T
-
I
V
A
I
A
I
P
V
F
Y
-------
F
-----
A
W
------------
Y
I
P
L
F
I
A
A
V
L
---
F
W
A
I
--
E
E
Q
G
S
V
V
----------
L
A
T
F
A
A
E
---
R
V
D
S
S
-------
W
F
P
----
V
S
W
F
Q
S
L
N
P
L
F
I
M
L
Y
T
P
F
F
A
W
L
W
T
A
W
-------------
S
S
P
T
K
F
A
V
G
L
M
F
A
G
L
S
F
---
L
L
M
A
I
------------
P
G
A
L
Y
G
T
S
G
K
V
---------
S
P
L
W
L
V
G
S
W
A
L
V
--
I
L
G
E
M
L
I
S
P
V
----------------
M
M
S
M
W
F
L
S
S
S
V
G
S
A
L
N
A
Q
L
V
T
L
Y
N
---
A
---
K
S
E
V
A
Y
F
S
Y
F
G
L
G
S
V
V
L
G
I
V
L
V
F
L
S
----------------------------------------------------------
7
PsiBlast_PDB
76.66
21%
-113
- C4 -
4IKY
8
?
A:
[6-441]
-----------------
K
Q
Q
I
A
A
S
V
P
Q
R
G
F
F
G
H
P
K
G
L
F
T
L
F
F
T
E
F
W
E
R
F
-----
S
Y
Y
G
M
R
A
I
L
V
Y
Y
M
YYEV
S
-----
K
G
-----
G
L
G
L
D
E
H
------
L
A
L
A
I
M
S
I
Y
G
A
L
V
Y
M
S
G
I
I
G
G
W
L
A
D
R
V
F
G
---
T
S
R
A
V
F
Y
G
G
L
L
I
---
M
A
G
H
I
A
----
L
A
I
P
G
G
V
A
A
L
---------------------------
F
V
S
M
A
L
I
V
L
G
T
G
L
L
K
P
N
V
S
S
I
V
G
D
M
Y
K
---
P
G
D
D
R
R
---
D
A
G
F
S
I
F
Y
M
G
I
N
L
G
A
-
F
L
---
A
P
L
V
V
G
T
A
G
M
K
Y
N
F
H
L
G
F
G
L
A
-------
A
V
G
M
F
L
G
L
V
V
F
V
A
T
R
-------------------------
K
K
N
L
G
L
A
G
T
Y
V
P
N
P
L
T
--
P
A
E
K
K
K
A
A
A
I
M
-----------------
A
V
G
------------------
A
V
V
I
A
V
L
L
A
I
L
I
P
N
G
W
-------------
F
T
V
E
T
F
I
S
L
V
-----
G
-
I
L
G
I
I
I
P
I
I
Y
F
V
V
M
Y
R
S
P
-----
K
T
T
A
E
E
R
S
R
--
V
I
A
Y
I
P
L
F
V
A
S
A
M
---
F
W
A
I
Q
Q
Q
G
S
T
I
L
A
----------
N
Y
A
D
K
R
T
---
Q
L
D
V
A
G
I
H
L
S
P
---------
A
W
F
Q
S
L
N
P
L
F
I
I
I
L
A
P
V
F
A
W
M
W
V
K
L
G
K
R
-----
Q
P
T
I
P
---
Q
K
F
A
L
G
L
L
F
A
G
L
S
F
---
I
V
--
I
L
V
P
G
H
L
S
-------------
G
G
G
L
V
--
H
P
I
-----
W
L
V
L
S
Y
F
I
V
--
V
L
G
E
L
C
L
S
P
V
G
L
S
A
T
T
K
L
A
P
A
A
F
S
A
Q
T
M
S
L
W
F
L
S
N
A
A
A
Q
A
I
N
A
Q
L
V
R
F
Y
T
---
P
---
E
N
E
T
A
Y
F
G
T
I
G
G
A
A
L
V
L
G
L
I
L
L
A
I
A
P
R
I
G
R
L
M
K
G
-------------------------------------------------
6
PsiBlast_PDB
76.14
21%
-113
- C4 -
4IKX
1
?
A:
[6-441]
-----------------
K
Q
Q
I
A
A
S
V
P
Q
R
G
F
F
G
H
P
K
G
L
F
T
L
F
F
T
E
F
W
E
R
F
-----
S
Y
Y
G
M
R
A
I
L
V
Y
Y
M
YYEV
S
-----
K
G
-----
G
L
G
L
D
E
H
------
L
A
L
A
I
M
S
I
Y
G
A
L
V
Y
M
S
G
I
I
G
G
W
L
A
D
R
V
F
G
---
T
S
R
A
V
F
Y
G
G
L
L
I
---
M
A
G
H
I
A
----
L
A
I
P
G
G
V
A
A
L
---------------------------
F
V
S
M
A
L
I
V
L
G
T
G
L
L
K
P
N
V
S
S
I
V
G
D
M
Y
K
---
P
G
D
D
R
R
---
D
A
G
F
S
I
F
Y
M
G
I
N
L
G
A
-
F
L
---
A
P
L
V
V
G
T
A
G
M
K
Y
N
F
H
L
G
F
G
L
A
-------
A
V
G
M
F
L
G
L
V
V
F
V
A
T
R
-------------------------
K
K
N
L
G
L
A
G
T
Y
V
P
N
P
L
T
--
P
A
E
K
K
K
A
A
A
I
M
-----------------
A
V
G
------------------
A
V
V
I
A
V
L
L
A
I
L
I
P
N
G
W
-------------
F
T
V
E
T
F
I
S
L
V
-----
G
-
I
L
G
I
I
I
P
I
I
Y
F
V
V
M
Y
R
S
P
-----
K
T
T
A
E
E
R
S
R
--
V
I
A
Y
I
P
L
F
V
A
S
A
M
---
F
W
A
I
Q
Q
Q
G
S
T
I
L
A
----------
N
Y
A
D
K
R
T
---
Q
L
D
V
--
I
H
L
S
P
---------
A
W
F
Q
S
L
N
P
L
F
I
I
I
L
A
P
V
F
A
W
M
W
V
K
L
G
K
R
-----
Q
P
T
I
P
---
Q
K
F
A
L
G
L
L
F
A
G
L
S
F
---
I
V
--
I
L
V
P
G
H
L
---------------
G
G
L
V
--
H
P
I
-----
W
L
V
L
S
Y
F
I
V
--
V
L
G
E
L
C
L
S
P
V
G
L
S
A
T
T
K
L
A
P
A
A
F
S
A
Q
T
M
S
L
W
F
L
S
N
A
A
A
Q
A
I
N
A
Q
L
V
R
F
Y
T
---
P
---
E
N
E
T
A
Y
F
G
T
I
G
G
A
A
L
V
L
G
L
I
L
L
A
I
A
P
R
I
G
R
L
M
K
--------------------------------------------------
9
PsiBlast_PDB
75.79
20%
-123
- C4 -
4XNI
10
?
A:
[8-449]
-----------------------------
F
F
G
Q
P
L
G
L
S
T
L
F
M
T
E
M
W
E
R
F
-----
S
Y
Y
G
M
R
A
I
L
L
Y
Y
M
W
F
L
I
S
-----
T
G
-----
D
L
H
I
T
R
A
------
T
A
A
S
I
M
A
I
Y
A
S
M
V
Y
L
S
G
T
I
G
G
F
V
A
D
R
I
I
G
---
A
R
P
A
V
F
W
G
G
V
L
I
---
M
L
G
H
I
---
V
-
L
A
L
P
F
G
A
S
A
L
F
G
S
---------------------------
I
I
L
I
I
I
G
T
G
F
L
K
P
N
V
S
T
L
-
V
G
T
L
Y
D
E
H
D
R
R
R
D
A
---
G
--
F
S
I
F
V
F
G
I
N
L
G
A
-
F
I
---
A
P
L
I
V
G
A
A
Q
E
A
A
G
Y
H
V
A
F
S
L
A
-------
A
I
G
M
F
I
G
L
L
V
Y
Y
F
G
G
K
K
T
L
----------------
D
PHYL
R
P
T
D
P
L
A
P
E
E
V
K
P
L
L
V
K
V
S
L
A
V
A
G
F
I
A
I
I
-----------------
V
V
M
------------------
N
L
V
-----------
G
W
-------------
N
S
L
P
A
Y
I
N
L
L
-----
T
-
I
V
A
I
A
I
P
V
F
Y
-------
F
-----
A
--------LR
V
V
S
Y
I
P
L
F
I
A
A
V
L
---
F
W
A
I
--
E
E
Q
G
S
V
V
----------
L
A
T
F
A
A
E
---
R
V
D
S
S
-------
W
F
P
----
V
S
W
F
Q
S
L
N
P
L
F
I
M
L
Y
T
P
F
F
A
W
L
W
T
A
W
K
K
N
-----
Q
---
P
S
S
P
T
K
F
A
V
G
L
M
F
A
G
L
S
F
---
L
L
M
A
I
------------
P
G
A
L
Y
G
T
S
G
K
V
---------
S
P
L
W
L
V
G
S
W
A
L
V
--
I
L
G
E
M
L
I
S
P
V
G
L
S
V
-------------
M
S
M
W
F
L
S
S
S
V
G
S
A
L
N
A
Q
L
V
T
L
Y
N
---
A
---
K
S
E
V
A
Y
F
S
Y
F
G
L
G
S
V
V
L
G
I
V
L
V
F
L
S
K
R
I
Q
G
-----------------------------------------------------
40
Fugue
56.91
17%
-93
- C1 -
4IWS
-
?
A:
[23-515]
M
N
R
S
A
---------
L
D
F
R
H
F
V
D
H
L
R
R
Q
G
D
L
V
D
V
H
--------
T
E
V
D
A
N
L
-----
E
I
G
A
I
T
R
R
V
Y
E
R
R
----
A
-----
P
A
-----
P
L
F
H
N
I
R
------
D
S
L
P
------
G
A
R
V
L
G
A
P
-
A
G
L
R
A
D
R
A
R
A
---
H
S
R
L
A
L
H
----
F
---
G
L
P
E
H
S
G
P
R
-
D
I
V
A
M
L
R
A
A
M
R
A
E
P
I
A
P
R
R
L
E
R
G
P
V
Q
E
N
V
W
L
G
-
E
Q
V
D
L
T
R
F
P
V
P
L
L
H
E
Q
D
G
G
R
Y
F
G
T
Y
G
F
H
V
V
Q
T
P
D
G
------------
S
W
D
S
W
S
V
G
R
L
M
-
L
V
D
RN
T
L
A
G
P
T
I
P
T
Q
H
I
G
I
I
R
E
Q
W
R
R
L
GK
P
T
P
W
A
M
A
L
G
A
P
P
A
A
L
A
A
A
G
M
P
L
P
----------------
E
----
G
V
S
E
A
G
Y
V
G
A
L
V
G
E
P
V
E
V
V
R
T
Q
T
N
G
L
W
V
P
-----------------
A
N
T
------------------
E
I
V
-----------
L
E
-------------
G
E
I
S
L
D
E
T
A
L
-----
E
G
P
M
G
E
Y
H
G
Y
S
F
-------
P
-----
I
G
-------------------------------
K
P
Q
P
L
F
H
----------
V
H
A
L
S
F
R
DQ
P
I
L
P
I
C
V
A
G
T
P
P
E
E
N
H
----
T
I
W
G
T
M
I
S
A
Q
L
L
D
V
A
Q
N
-------------------------
A
G
L
P
V
D
M
V
W
C
S
Y
E
A
ATC
W
A
V
L
S
I
D
V
Q
R
L
A
A
L
GT
D
A
A
A
F
A
A
R
V
A
E
T
V
F
G
S
H
A
G
H
L
-----
V
P
K
L
I
L
V
--
G
N
D
I
D
V
T
E
I
D
Q
V
V
W
A
L
A
T
R
A
H
P
L
H
D
-----
H
F
A
F
P
Q
I
R
D
F
-----------------
P
M
V
P
Y
L
D
A
E
D
K
A
R
G
----------------
S
G
G
R
L
V
I
N
C
L
Y
P
E
Q
F
A
G
Q
M
R
A
A
------
T
A
S
F
R
H
A
Y
P
T
A
L
R
R
R
V
E
E
R
W
SDYGF
34
Fugue
56.85
12%
-106
- C4 -
1PV6
-
LACY_ECOLI
A:
[1-417]
-----------------------------
M
Y
Y
L
K
N
T
N
F
W
M
F
G
L
F
F
F
F
Y
F
-----
F
I
M
G
A
Y
F
P
F
F
P
I
W
----
L
-----
H
D
-----
I
N
H
I
S
K
S
------
D
T
G
I
I
F
A
A
I
S
L
F
S
L
L
F
Q
P
L
F
G
L
L
S
D
K
L
-
G
---
L
R
K
Y
L
L
W
I
I
T
G
M
---
L
V
M
F
A
P
F
F
I
-
F
I
F
G
P
L
L
Q
Y
N
I
L
V
G
S
I
V
G
G
I
Y
L
G
F
C
F
N
A
------------------
G
A
P
A
V
E
A
F
I
E
K
V
S
R
R
S
N
F
E
F
G
R
A
R
M
F
G
---
C
--
V
G
W
A
L
G
A
S
I
V
G
I
-
M
F
---
T
I
N
----------------------------------------
N
Q
F
V
----------------
F
----
W
L
G
S
G
C
A
L
I
L
A
V
L
L
F
F
A
K
T
D
A
P
S
S
A
T
V
A
N
-----------------
A
V
G
------------------
A
N
H
-----------
S
A
-------------
F
S
L
K
L
A
L
E
L
F
-----
R
-
Q
-----------------------------
P
K
--
L
W
F
L
S
L
Y
V
I
G
V
S
C
---
T
Y
D
V
F
D
Q
Q
F
A
N
F
F
----------
T
S
F
F
----------------
A
T
G
E
Q
----
G
T
R
V
F
G
Y
V
T
T
M
G
E
L
L
N
A
S
I
M
F
F
A
P
L
I
I
N
R
-----
I
G
---------
G
K
N
A
L
L
L
A
G
T
I
---
M
S
V
R
I
I
G
S
S
F
A
T
-------------------------
S
A
L
E
V
V
I
L
K
T
L
H
--
M
F
E
V
P
F
L
L
V
G
C
F
K
Y
I
T
S
Q
F
E
V
R
F
S
A
T
I
Y
L
V
C
F
C
F
F
K
Q
L
A
M
I
F
M
S
V
L
A
G
N
M
---
Y
---
E
S
I
G
----------------
F
Q
G
A
Y
L
V
L
G
L
V
A
L
G
F
T
L
I
S
V
F
T
L
S
G
P
G
P
-
L
S
L
------
L
R
R
Q
V
N
E
V
A
----------------
38
Fugue
54.02
14%
-99
- C3 -
2OCC
-
COX1_BOVIN
A:
[1-514]
-----
M
F
I
N
R
W
L
F
S
T
N
H
K
D
I
G
T
L
Y
L
L
F
G
A
W
A
G
M
V
G
T
A
L
S
L
L
I
R
A
E
L
G
Q
P
GTLLG-----------------
D
-----
D
Q
-----
I
Y
N
V
V
V
T
------
A
H
A
F
V
M
I
F
F
M
V
M
P
I
M
I
G
G
F
G
N
W
L
V
P
L
M
I
G
APD
M
A
F
P
R
M
N
N
M
S
F
W
---
L
L
P
P
S
F
L
L
L
-
L
A
S
S
M
V
E
-----
A
G
A
G
T
G
W
T
V
Y
P
P
L
A
G
N
L
A
H
A
G
A
-
S
V
D
L
T
I
F
S
L
H
L
A
G
V
S
S
I
L
G
A
I
N
F
I
T
T
I
I
N
M
K
P
P
A
M
S
Q
Y
---
Q
--
T
P
L
F
V
W
S
V
M
I
T
A
-
V
L
---
L
L
L
S
L
P
V
L
A
A
G
I
T
M
L
L
T
D
R
N
---------------------------------------------------------------------------------------------------------------------------------------------------------
L
-----
N
-
T
T
F
F
D
P
A
G
G
G
-------
D
-----
P
I
L
Y
Q
H
L
F
W
--
F
F
G
H
P
E
V
Y
I
L
I
L
P
---
G
F
G
M
I
S
H
I
V
T
Y
Y
S
GKKEPFG
Y
M
G
M
V
W
A
M
M
S
---
I
G
F
L
G
F
I
V
W
A
H
H
M
F
T
VGMD
V
D
T
R
A
Y
F
T
S
A
T
M
I
I
A
I
P
T
G
V
K
V
F
S
W
L
A
T
L
-----
H
G
--
G
N
I
K
W
S
P
A
M
M
W
A
L
G
F
I
F
L
---
F
T
V
G
G
L
T
G
I
V
L
A
-----
N
S
S
L
D
I
V
L
H
D
T
Y
Y
--
V
V
A
H
F
H
Y
V
L
S
M
G
A
V
F
A
I
M
G
G
F
V
H
W
F
P
L
F
S
G
Y
T
L
N
D
T
W
A
K
I
H
F
A
I
M
F
V
G
V
N
M
T
F
F
P
Q
H
F
L
G
L
S
G
M
P
R
R
Y
S
DYP
D
---
A
Y
T
M
W
N
T
I
S
S
M
G
S
F
I
S
L
T
A
V
M
L
M
V
F
I
I
W
E
A
F
A
S
K
R
E
V
L
---
T
V
D
L
T
T
T
-
N
L
E
WLNGCP
P
P
Y
H
T
F
E
E
P
T
Y
V
N
L
K----------
14
PsiBlast_PDB
49.98
22%
-145
- C4 -
4Q65
-
DTPD_ECOLI
A:
[14-192]
---------------------------------------
V
V
A
L
Q
I
W
E
Y
F
-----
S
F
Y
G
M
R
A
L
L
I
L
Y
L
----
T
-----
N
------
Q
L
K
Y
N
D
T
------
H
A
Y
E
L
F
S
A
Y
C
S
L
V
Y
V
T
P
I
L
G
G
F
L
A
D
K
V
L
G
---
N
R
M
A
V
M
L
G
A
L
L
M
---
A
I
G
H
V
V
L
----------------------------
G
A
S
E
I
H
P
-
S
-
F
L
Y
L
S
L
A
I
I
V
C
G
Y
G
L
F
K
S
N
V
S
C
L
L
G
E
L
Y
E
P
T
D
P
---
R
R
---
D
G
G
F
S
L
M
Y
A
A
G
N
V
G
S
-
I
I
---
A
P
I
A
C
G
Y
A
Q
E
E
Y
S
W
A
M
G
F
G
L
A
-------
A
V
G
M
I
A
G
L
V
I
F
L
C
G
N
R
H
F
T
----------------
H
----
T
R
G
V
R
A
T
N
F
L
L
P
N
W
G
W
L
L
V
L
L
V
A
T
P
A
L
I
T
-----------------
I
L
F
------------------
W
K
E
-----------
W
S
-------------
V
Y
A
L
I
V
A
T
I
I
-----
G
-
L
G
V
L
A
K
I
Y
E
N
-------
Q
-----
K
Q
R
E
L
G
L
I
V
--
T
L
T
F
F
S
M
L
F
W
A
F
A
---
Q
Q
G
G
S
S
I
S
L
Y
I
D
R
----------
F
V
N
T
V
P
T
---
A
M
F
Q
S
I
N
A
F
A
V
M
L
C
G
----
V
F
L
A
W
V
V
N
R
T
V
R
I
W
G
K
F
A
L
G
L
G
L
M
S
A
G
F
C
-----
I
L
T
L
S
A
R
W
S
A
M
Y
G
L
P
L
M
V
L
G
L
A
---
V
M
G
F
A
E
L
F
I
D
P
V
A
M
--
S
Q
I
T
R
I
E
V
T
G
V
L
T
G
--
I
Y
M
L
L
S
G
A
I
A
N
Y
L
A
G
V
I
--
A
D
Q
T
S
S
I
N
A
Y
I
E
V
F
D
Q
I
T
W
G
A
L
A
C
V
G
V
V
L
M
I
W
L
Y
Q
A
--------------------------------------------------------------------------------------------------------
26
HHSearch
43.53
13%
-99
- C4 -
1PW4
-
GLPT_ECOLI
A:
[252-430]
---------------------------------
N
K
L
L
W
Y
I
A
I
A
N
V
F
V
Y
L
-----
L
R
Y
G
I
L
D
W
S
P
T
Y
L
----
K
-----
E
V
-----
K
H
-
F
A
L
D
------
K
S
S
W
A
Y
F
L
Y
E
Y
A
G
I
P
G
T
L
L
C
G
W
M
S
D
K
-
V
F
---
R
G
N
R
G
A
T
G
V
F
F
M
T
L
V
T
I
A
T
I
V
Y
W
M
-
N
P
A
G
--------------------------
N
P
-
T
-
V
D
M
I
C
M
I
V
I
G
F
L
I
Y
G
P
V
M
L
I
G
L
H
A
L
E
L
A
P
K
K
---
A
A
G
T
---
A
--
A
G
F
T
G
L
F
G
Y
L
G
G
S
V
A
---
A
S
A
I
V
G
Y
T
V
D
F
F
G
W
D
G
G
F
M
V
M
-------
I
G
G
S
I
L
A
V
I
L
L
I
V
V
M
I
G
E
K
----------------
R
----
R
H
E
Q
L
L
Q
E
L
V
P
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------