@TOME V2.3
(Nov 2016)
Ref.
-
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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 : O52L1_HUMAN: (2016-01-12 )
MTLVSFFSFLSKPLIMLLSNSSWRLSQPSFLLVGIPGLEESQHWIALPLGILYLLALVGNVTILFIIWMDPSLHQSMYLFLSMLAAIDLVLASSTAPKALAVLLVHAHEIGYIVCLIQMFFIHAFSSMESGVLVAMALDCYVAICHPLHHSTILHPGVIGCIGMVVLVRGLLLLIPFPILLGKLIFCQATIIGHAYCEHMAVVKLACSETTVNRAYGLTMALLVIGLDVLAIGVSYAHILQAVLKVPGSEARLKAFSTCGSHICVILVFYVPGIFSFLTHRFGHHVPHHVHVLLATWYLLMPPALNPLVYGVKTQQIRQRVLRVFTQKD
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.......-------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
---M
T
L
V
S
F
F
S
F
----
L
S
K
P
L
-----------------
I
M
L
LS---NS------------------------SWRLS-QP
S
F
L
L
V
GIPGLEESQ
H
W
---
I
A
L
P
L
G
I
L
-
Y
L
L
-----
A
L
V-GN
V
T
I
L
-----
F
I
I
-----------WMDP
S
L
-
H
Q
-
S
M
Y
L
F
L
S
M
--
L
A
A
I
D
L
V
LASS--------------T-A
P
K
A
L
A
V
L
-------
L
-
V
H
A
------HE
I
G
Y
-
I
V
C
--
L
I
----------
Q
M
F
F
I
H
A
F
S
SMES-
G
V
--
L
V
A
M
A
L
----------------
D
C
Y
V
A
I
C
------------HPL---------HHSTI---LH------
P
G
V
I
G
C
I
G
--
M
V
V
L
V
R
G
L
--
L
L
-L--I
P
F
P
--------------
I
L
-
L
G
K
-
L
I
F
C
-------
Q
A
----
T
I
----------------------
I
G
-----------
H
A
Y
C
E
H
M
A
V
V
---KLA-CSET--T
V
N
R
A
Y
G
L
T
M
------
A
L
-----
L
V
I
G
-
L
D
V
------------
L
A
I
G
-------
V
S
Y
A
H
----
I
L
Q
A
V
L
KV------PG------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
A
R
L
-----
K
-------
A
F
S
--TCGS
H
I
C
-
V
I
L
V
F
Y
V
P
G
I
--------
F
S
F
L
T
H
R
FGHH----------V----
P
--------
H
H
-
V
--
H
V
L
L
-----
A
T
W
Y
L
LMPPAL
N
P
L
----------
V
YGV
K
T
Q
Q
I
R
Q
---
R
V
L
R
V
FTQKD-------------------------
23
HHSearch
87.92
18%
-158
- C4 -
2RH1
16
ADRB2_HUMAN (first)
A:
[37-477]
------------------------------------------------------------------------------------------
E
V
W
V
V
G
---
M
G
I
V
M
S
L
I
-
V
L
A
-----
I
V
F
-
G
N
V
L
V
I
-----
T
A
I
-----------
A
K
F
E
R
L
-
Q
T
-
V
T
N
Y
F
I
T
S
--
L
A
C
A
D
L
V
M
G
L
A
--------------
V
-
V
P
F
G
A
A
H
I
-------
L
-
M
K
M
------
W
T
F
G
N
-
F
W
C
--
E
F
----------
W
T
S
I
D
V
L
C
V
T
A
S
I
-
E
T
--
L
C
V
I
A
V
----------------
D
R
Y
F
A
I
T
------------
S
P
F
---------
K
Y
Q
S
L
---
L
T
------
K
N
K
A
R
V
I
I
--
L
M
V
W
I
V
S
G
--
L
T
-
S
--
F
L
P
I
--------------
Q
M
H
W
Y
R
-
A
T
H
--------------------------------------
Q
E
-----------
A
I
N
C
Y
A
E
E
-------
T
-
C
C
D
F
--
F
T
N
Q
A
Y
A
I
A
S
------
S
I
-----
V
S
F
Y
-
V
P
L
------------
V
I
M
V
-------
F
V
Y
S
R
----
V
F
Q
E
A
K
R
Q
------
L
N
I
F
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
TEGYYTIGIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYKF-
C
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
K
E
H
-----
K
-------
A
L
K
--
T
L
G
I
I
M
G
-
T
F
T
L
C
W
L
P
F
F
--------
I
V
N
I
V
H
V
I
Q
D
N
----------
L
----
I
--------
R
K
-
E
--
V
Y
I
L
-----
L
N
W
I
G
Y
V
N
S
G
F
N
P
L
----------
I
Y
C
-
R
S
P
D
F
R
I
---
A
F
Q
E
L
L
C
L
---------------------------
29
HHSearch
84.25
17%
-157
- C4 -
2Z73
5
OPSD_TODPA
A:
[30-332]
-----------------------------------------------------------------------------------------
P
D
A
V
Y
Y
S
---
L
G
I
F
I
G
I
C
-
G
I
I
-----
G
C
G
-
G
N
G
I
V
I
-----
Y
L
F
-----------
T
K
T
K
S
L
-
Q
T
-
P
A
N
M
F
I
I
N
--
L
A
F
S
D
F
T
F
S
L
V
--------------
N
G
F
P
L
M
T
I
S
C
-------
F
-
L
K
K
------
W
I
F
G
F
-
A
A
C
--
K
V
----------
Y
G
F
I
G
G
I
F
G
F
M
S
I
-
M
T
--
M
A
M
I
S
I
----------------
D
R
Y
N
V
I
G
------------
R
P
M
---------
A
A
S
K
K
---
M
S
------
H
R
R
A
F
I
M
I
--
I
F
V
W
L
W
S
V
--
L
W
-
A
--
I
G
P
I
--------------
F
G
-
W
G
A
-
Y
T
L
---------------
E
----------------------
G
V
-----------
L
C
N
C
S
F
D
Y
I
S
---------
R
D
--
S
T
T
R
S
N
I
L
C
M
------
F
I
-----
L
G
F
F
-
G
P
I
------------
L
I
I
F
-------
F
C
Y
F
N
----
I
V
M
S
V
S
N
H
------
E
K
E
M
A
A
M
A
K
RLNAKE
L
R
K
A
Q
A
G
----------------------------------------------------------------------------------------------------------------------------------------------
A
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
A
E
M
-----
R
-------
L
A
K
--
I
S
I
V
I
V
S
-
Q
F
L
L
S
W
S
P
Y
A
--------
V
V
A
L
L
A
Q
F
G
P
L
E---------
W
----
V
--------
T
P
-
Y
--
A
A
Q
L
-----
P
V
M
F
A
K
A
S
A
I
H
N
P
M
----------
I
Y
S
V
S
H
P
K
F
R
E
---
A
I
S
Q
T
F
P
W
V
L
-------------------------
28
HHSearch
82.39
19%
-159
- C4 -
2KS9
1
NK1R_HUMAN
A:
[32-323]
---------------------------------------------------------------------------------------------
I
V
L
---
W
A
A
A
Y
T
V
I
-
V
V
T
-----
S
V
V
-
G
N
V
V
V
M
-----
W
I
I
-----------
L
A
H
K
R
M
-
R
T
-
V
T
N
Y
F
L
V
N
--
L
A
F
A
E
A
S
M
A
A
F
--------------
N
-
T
V
V
N
F
T
Y
A
-------
V
-
H
N
E
------
W
Y
Y
G
L
-
F
Y
C
--
K
F
----------
H
N
F
F
P
I
A
A
V
F
A
S
I
-
Y
S
--
M
T
A
V
A
F
----------------
D
R
Y
M
A
I
I
------------
H
P
L
---------
Q
P
R
L
-----
S
------
A
T
A
T
K
V
V
I
--
C
V
I
W
V
L
A
L
--
L
L
-
A
--
F
P
Q
G
--------------
Y
Y
-
S
T
T
-
E
T
----------------
M
----------------------
P
S
-----------
R
V
V
C
M
I
E
W
P
E
---
H
----
P
N
K
--
I
Y
E
K
V
Y
H
I
C
V
------
T
V
-----
L
I
Y
F
-
L
P
L
------------
L
V
I
G
-------
Y
A
Y
T
V
----
V
G
I
T
L
W
A
S
------
E
I
PGDSSDRYH
E
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------
V
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
A
K
R
-----
K
-------
V
V
K
--
M
M
I
V
V
V
C
-
T
F
A
I
C
W
L
P
F
H
--------
I
F
F
L
L
P
Y
I
N
P
D
----------
L
YLKK
F
--------
I
Q
-
Q
--
V
Y
L
A
-----
I
M
W
L
A
M
S
S
T
M
Y
N
P
I
----------
I
Y
C
C
L
N
D
R
F
R
L
---
G
F
K
H
A
F
R
C
C
P
-------------------------
21
HHSearch
79.43
17%
-163
* C4 *
3UON
4
ACM2_HUMAN (first)
A:
[24-457]
----------------------------------------------------------------------------------------------
V
F
---
I
V
L
V
A
G
S
L
-
S
L
V
-----
T
I
I
-
G
N
I
L
V
M
-----
V
S
I
-----------
K
V
N
R
H
L
-
Q
T
-
V
N
N
Y
F
L
F
S
--
L
A
C
A
D
L
I
I
G
V
F
--------------
S
-
M
N
L
Y
T
L
Y
T
-------
V
-
I
G
Y
------
W
P
L
G
P
-
V
V
C
--
D
L
----------
W
L
A
L
D
Y
V
V
S
N
A
S
V
-
M
N
--
L
L
I
I
S
F
----------------
D
R
Y
F
C
V
T
------------
K
P
L
---------
T
Y
P
V
K
---
R
T
------
T
K
M
A
G
M
M
I
--
A
A
A
W
V
L
S
F
--
I
L
-
W
--
A
P
A
I
--------------
L
F
-
W
Q
F
-
I
V
G
V
-------
R
------
T
----------------------
V
E
-----------
D
G
E
C
Y
I
Q
F
F
---------------
S
N
A
A
V
T
F
G
T
------
A
I
-----
A
A
F
Y
-
L
P
V
------------
I
I
M
T
-------
V
L
Y
W
H
----
I
S
R
A
S
K
S
R
------
I
N
I
F
E
M
L
R
I
D
EGLRL
K
I
Y
K
D
TEG
Y
Y
T
I
GIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKL
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYPP-
P
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
R
E
K
-----
K
-------
V
T
R
--
T
I
L
A
I
L
L
-
A
F
I
I
T
W
A
P
Y
N
--------
V
M
V
L
I
N
T
F
C
A
P
----------
C
----
I
--------
P
N
-
T
--
V
W
T
I
-----
G
Y
W
L
C
Y
I
N
S
T
I
N
P
A
----------
C
Y
A
L
C
N
A
T
F
K
K
---
T
F
K
H
L
L
M
----------------------------
24
HHSearch
79.08
17%
-156
- C4 -
3RZE
5
ENLYS_BPT4 (first)
A:
[9-443]
----------------------------------------------------------------------------------------------
M
P
---
L
V
V
V
L
S
T
I
-
C
L
V
-----
T
V
G
-
L
N
L
L
V
L
-----
Y
A
V
-----------
R
S
E
R
K
L
-
H
T
-
V
G
N
L
Y
I
V
S
--
L
S
V
A
D
L
I
V
G
A
V
--------------
V
-
M
P
M
N
I
L
Y
L
-------
L
-
M
S
K
------
W
S
L
G
R
-
P
L
C
--
L
F
----------
W
L
S
M
D
Y
V
A
S
T
A
S
I
-
F
S
--
V
F
I
L
C
I
----------------
D
R
Y
R
S
V
Q
------------
Q
P
L
---------
R
Y
L
K
Y
---
R
T
------
K
T
R
A
S
A
T
I
--
L
G
A
W
F
L
S
F
--
L
W
-
V
--
I
P
I
L
--------------
G
--
W
N
H
------------------------------------------
R
R
-----------
E
D
K
C
E
T
D
F
Y
D
---------------
V
T
W
F
K
V
M
T
------
A
I
-----
I
N
F
Y
-
L
P
T
------------
L
L
M
L
-------
W
F
Y
A
K
----
I
Y
K
A
V
R
Q
H
------
C
N
I
F
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
TEG
Y
Y
T
I
G
IGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKL
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYLH-
M
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
R
E
R
-----
K
-------
A
A
K
--
Q
L
G
F
I
M
A
-
A
F
I
L
C
W
I
P
Y
F
--------
I
F
F
M
V
I
A
F
C
K
N
----------
C
----
C
--------
N
E
-
H
--
L
H
M
F
-----
T
I
W
L
G
Y
I
N
S
T
L
N
P
L
----------
I
Y
P
L
C
N
E
N
F
K
K
---
T
F
K
R
I
L
H
I
---------------------------
31
HHSearch
78.64
16%
-163
- C4 -
3EML
13
ENLYS_BPT4
A:
[21-468]
---------------------------------------------------------------------------------------------
S
S
V
---
Y
I
T
V
E
L
A
I
-
A
V
L
-----
A
I
L
-
G
N
V
L
V
C
-----
W
A
V
-----------
W
L
N
S
N
L
-
Q
N
-
V
T
N
Y
F
V
V
S
--
L
A
A
A
D
I
A
V
G
V
L
--------------
A
-
I
P
F
A
I
T
I
S
-------
T
---
G
------
F
C
A
A
C
-
H
G
C
--
L
F
----------
I
A
C
F
V
L
V
L
T
Q
S
S
I
-
F
S
--
L
L
A
I
A
I
----------------
D
R
Y
I
A
I
R
------------
I
P
L
---------
R
Y
N
G
L
---
V
T
------
G
T
R
A
K
G
I
I
--
A
I
C
W
V
L
S
F
--
A
I
-
G
--
L
T
P
M
--------------
L
G
-
W
N
N
-
C
G
Q
---------------------------------------------------
S
Q
G
C
G
E
G
Q
V
------
A
-
C
L
F
E
DV
V
P
M
N
Y
M
V
Y
F
N
------
F
F
-----
A
C
V
L
-
V
P
L
------------
L
L
M
L
-------
G
V
Y
L
R
----
I
F
L
A
A
R
R
Q
------
L
N
I
F
E
M
L
R
I
D
E
GLRL
K
I
Y
K
D
TEGYYTIGIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTW
D
A
Y
R
S
T
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
K
E
V
-----
H
-------
A
A
K
--
S
L
A
I
I
V
G
-
L
F
A
L
C
W
L
P
L
H
--------
I
I
N
C
F
T
F
F
C
P
D
CS--------
H
----
A
--------
P
L
-
W
--
L
M
Y
L
-----
A
I
V
L
S
H
T
N
S
V
V
N
P
F
----------
I
Y
A
Y
R
I
R
E
F
R
Q
---
T
F
R
K
I
I
R
S
H
V
-------------------------
44
Fugue
78.53
17%
-178
- C5 -
4PG7
9
?
A:
[20-446]
--H
M
K
K
L
N
I
A
L
L
GLG
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
ED
V
N
E
I
L
-
N
D
D
S
L
D
-----
I
I
V
E
VMGGI
E
P
T
V
D
W
L
R
T
A
L
-
K
N
-
K
K
H
V
I
T
A
N
KD
L
L
A
V
H
L
K
L
L
E
D
--------------
L
-
A
E
E
N
G
V
A
L
-------
K
-
F
E
A
SVAGGP
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
DVKRRGISGVT
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
VEDE
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
FESTLP
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
GY
E
V
D
K
V
Y
P
V
E
G
V------------------------
46
Fugue
76.43
17%
-157
- C3 -
4TR2
8
?
A:
[54-627]
DD
V
H
K
I
I
S
E
L
R
F
----
L
Q
K
V
E
-----------------
T
I
L
E
S
---
S
N
MSVSDVEADANAYNPDRDAP
K
E
E
L
Q
K
L
Q
D
-
K
K
S
L
R
L
I
V
S
E
N
H
A
T
S
P
S
F
FEE
S
L
L
Q
E
D
V
V
-
S
F
I
-----
Q
S
K
-
G
K
L
S
N
L
KNLK
S
M
I
I
-----------
D
L
N
S
D
M
T
D
E
-
E
L
A
E
Y
I
S
L
--
L
E
R
K
G
A
L
I
E
S
D
K
L
V
G
A
DYKFNDEYR
N
-
L
Q
W
G
L
D
L
A
RLDET
Q
D
L
-
I
N
A
------
N
R
V
S
V
T
K
I
C
--
V
I
----------
D
S
G
I
D
Y
N
H
P
D
L
R
N
-
N
I
--
D
V
N
V
K
E
L
H
GRKGVDDDSNGVVD
D
V
Y
G
A
N
F
VNNSGDPMDDNY
H
G
T
---------
H
V
S
G
I
---
I
S
AVGNNG
I
G
I
V
G
V
D
G
H
S
K
L
V
I
C
K
A
L
DQ
H
K
-
L
--
G
R
L
G
--------------
D
M
-
F
K
C
-
I
D
Y
C
-------
I
S
R
QAH
M
I
----------------------
N
G
S
F
S
F
D
E
YS
N
I
F
N
A
S
V
E
H
L
R
S
L
---
G
I
L
-
F
F
V
S
--
A
S
N
C
A
H
D
K
L
S
------
K
P
-----
D
I
A
K
-
C
D
-------------
L
A
V
N
-------
H
R
Y
P
P
----
I
L
S
K
T
H
N
N
------
V
I
------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
A
N
L
-----
K
R
D
LDE
S
Y
S
L
S
--
V
N
S
F
Y
S
N
-
I
Y
C
Q
L
A
A
P
G
T
--------
N
I
Y
S
T
T
P
M
N
N
Y
----------
R
----
K
--------
L
N
-
G
--
T
S
M
A
-----
S
P
H
V
A
A
I
A
S
I
V
R
S
I
----------
N
P
N
L
T
Y
L
Q
I
V
E
---
I
L
R
N
A
I
V
K
L
P
SLTERVSWG
G
Y
V
D
I
L
R
A
V
N
L
A
I
D
S
K
17
PsiBlast_PDB
75.76
22%
-178
- C4 -
4LDE
3
A:
[191-447]
----------------------------------------------------------------------------------------------------------
L
-
I
V
L
-----
A
I
V
F
G
N
V
L
V
I
-----
T
A
I
-----------
A
K
F
E
R
L
-
Q
T
-
V
T
N
Y
F
I
T
S
--
L
A
C
A
D
L
V
M
G
L
A
--------------
V
-
V
P
F
G
A
A
H
I
-------
L
-
T
K
T
------
W
T
F
G
N
-
F
W
C
E
F
W
T
----------
S
I
D
V
L
C
V
T
A
S
I
E
T
-----
L
C
V
I
A
V
----------------
D
R
Y
F
A
I
T
------------
S
P
F
---------
K
Y
Q
S
L
---
L
T
------
K
N
K
A
R
V
I
I
L
-
M
V
W
I
V
S
G
L
--
T
S
-
F
--
L
P
I
Q
--------------
M
H
-
W
Y
R
-
A
T
H
Q
-------
E
A
----
I
------------------------------------
N
C
Y
A
E
E
---------
T
-
C
C
D
F
--
F
T
N
Q
A
Y
A
I
A
S
------
S
I
-----
V
S
F
Y
-
V
P
L
------------
V
I
M
V
-------
F
V
Y
S
R
----
V
F
Q
E
A
K
R
Q
------
L
Q
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
F
AL
K
E
H
K
-------
A
L
K
--
T
L
G
I
I
M
G
-
T
F
T
L
C
W
L
P
F
F
--------
I
V
N
I
V
H
V
I
Q
D
N
L---------
I
----
R
--------
K
E
-
V
--
Y
I
L
L
------
N
W
I
G
Y
V
N
S
G
F
N
P
L
----------
I
Y
C
R
S
P
D
F
R
I
A
---
F
Q
E
L
L
C
L
----------------------------
39
Fugue
75.26
15%
-154
- C4 -
1F88
8
OPSD_BOVIN
A:
[1-348]
---
M
N
-----
G
T
----
E
G
P
N
F
-----------------
Y
V
P
F
S
---
N
K
------------------------
T
G
V
V
R
-
S
P
F
E
A
P
Q
Y
Y
L
A
E
P
W
Q
F
S
M
---
L
A
A
Y
M
F
L
L
-
I
M
L
-----
G
F
P
-
I
N
F
L
T
L
-----
Y
V
T
-----------
V
Q
H
K
K
L
-
R
T
-
P
L
N
Y
I
L
L
N
--
L
A
V
A
D
L
F
M
V
F
G
--------------
G
-
F
T
T
T
L
Y
T
S
-------
L
-
H
G
Y
------
F
V
F
G
P
-
T
G
C
--
N
L
----------
E
G
F
F
A
T
L
G
G
E
I
A
L
-
W
S
--
L
V
V
L
A
I
----------------
E
R
Y
V
V
V
C
------------
K
P
M
---------
S
N
F
R
F
---
G
E
------
N
H
A
I
M
G
V
A
--
F
T
W
V
M
A
L
A
--
C
A
-
A
--
P
P
L
V
GW
S
R
Y
---------
I
P
-
E
G
M
-
Q
C
S
C
-------
G
I
----
D
Y
----------------------
Y
T
-----------
P
-----------------
H
E
E
--
T
N
N
E
S
F
V
I
Y
M
------
F
V
-----
V
H
F
I
-
I
P
L
------------
I
V
I
F
-------
F
C
Y
G
Q
----
L
V
F
T
V
K
E
A
------
A
A
------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
T
T
Q
-----
K
-------
A
E
K
--
E
V
T
R
M
V
I
-
I
M
V
I
A
F
L
I
C
W
--------
L
P
Y
A
G
V
A
F
Y
I
F
----------
T
----
H
QGSDF---
G
P
-
I
--
F
M
T
I
-----
P
A
F
F
A
K
T
S
A
V
Y
N
P
V
----------
I
Y
I
M
M
N
K
Q
F
R
N
---
C
M
V
T
T
L
C
C
G
K
NPSTTVSKTETS
Q
V
A
P
A--------
19
PsiBlast_PDB
74.88
22%
-174
- C4 -
4LDO
3
A:
[191-447]
----------------------------------------------------------------------------------------------------------
L
-
I
V
L
-----
A
I
V
F
G
N
V
L
V
I
-----
T
A
I
-----------
A
K
F
E
R
L
-
Q
T
-
V
T
N
Y
F
I
T
S
--
L
A
C
A
D
L
V
M
G
L
A
--------------
V
-
V
P
F
G
A
A
H
I
-------
L
-
T
K
T
------
W
T
F
G
N
-
F
W
C
E
F
W
T
----------
S
I
D
V
L
C
V
T
A
S
I
E
T
-----
L
C
V
I
A
V
----------------
D
R
Y
F
A
I
T
------------
S
P
F
---------
K
Y
Q
S
L
---
L
T
------
K
N
K
A
R
V
I
I
L
-
M
V
W
I
V
S
G
L
--
T
S
-
F
--
L
P
I
Q
--------------
M
H
-
W
Y
R
-
A
T
H
Q
-------
E
A
----
I
------------------------------------
N
C
Y
A
E
E
---------
T
-
C
C
D
F
--
F
T
N
Q
A
Y
A
I
A
S
------
S
I
-----
V
S
F
Y
-
V
P
L
------------
V
I
M
V
-------
F
V
Y
S
R
----
V
F
Q
E
A
K
R
Q
------
L
Q
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
F
AL
K
E
H
K
-------
A
L
K
--
T
L
G
I
I
M
G
-
T
F
T
L
C
W
L
P
F
F
--------
I
V
N
I
V
H
V
I
Q
D
N
L---------
I
----
R
--------
K
E
-
V
--
Y
I
L
L
------
N
W
I
G
Y
V
N
S
G
F
N
P
L
----------
I
Y
C
R
S
P
D
F
R
I
A
---
F
Q
E
L
L
C
L
----------------------------
15
PsiBlast_PDB
74.82
21%
-171
- C4 -
4GBR
1
ADRB2_HUMAN
A:
[14-270]
----------------------------------------------------------------------------------------------------------
L
-
I
V
L
-----
A
I
V
F
G
N
V
L
V
I
-----
T
A
I
-----------
A
K
F
E
R
L
-
Q
T
-
V
T
N
Y
F
I
T
S
--
L
A
C
A
D
L
V
M
G
L
A
--------------
V
-
V
P
F
G
A
A
H
I
-------
L
-
T
K
T
------
W
T
F
G
N
-
F
W
C
E
F
W
T
----------
S
I
D
V
L
C
V
T
A
S
I
E
T
-----
L
C
V
I
A
V
----------------
D
R
Y
F
A
I
T
------------
S
P
F
---------
K
Y
Q
S
L
---
L
T
------
K
N
K
A
R
V
I
I
L
-
M
V
W
I
V
S
G
L
--
T
S
-
F
--
L
P
I
Q
--------------
M
H
-
W
Y
R
-
A
T
H
Q
-------
E
A
----
I
------------------------------------
N
C
Y
A
E
E
---------
T
-
C
C
D
F
--
F
T
N
Q
A
Y
A
I
A
S
------
S
I
-----
V
S
F
Y
-
V
P
L
------------
V
I
M
V
-------
F
V
Y
S
R
----
V
F
Q
E
A
K
R
Q
------
L
Q
------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
D
K
F
C
L
K
E
H
K
-------
A
L
K
--
T
L
G
I
I
M
G
-
T
F
T
L
C
W
L
P
F
F
--------
I
V
N
I
V
H
V
I
Q
D
N
----------
L
----
I
--------
R
K
-
E
--
V
Y
I
L
-----
L
N
W
I
G
Y
V
N
S
G
F
N
P
L
----------
I
Y
C
R
S
P
D
F
R
I
A
---
F
Q
E
L
L
C
L
----------------------------
18
PsiBlast_PDB
74.74
22%
-176
- C4 -
4LDL
3
ADRB2_HUMAN
A:
[191-447]
----------------------------------------------------------------------------------------------------------
L
-
I
V
L
-----
A
I
V
F
G
N
V
L
V
I
-----
T
A
I
-----------
A
K
F
E
R
L
-
Q
T
-
V
T
N
Y
F
I
T
S
--
L
A
C
A
D
L
V
M
G
L
A
--------------
V
-
V
P
F
G
A
A
H
I
-------
L
-
T
K
T
------
W
T
F
G
N
-
F
W
C
E
F
W
T
----------
S
I
D
V
L
C
V
T
A
S
I
E
T
-----
L
C
V
I
A
V
----------------
D
R
Y
F
A
I
T
------------
S
P
F
---------
K
Y
Q
S
L
---
L
T
------
K
N
K
A
R
V
I
I
L
-
M
V
W
I
V
S
G
L
--
T
S
-
F
--
L
P
I
Q
--------------
M
H
-
W
Y
R
-
A
T
H
Q
-------
E
A
----
I
------------------------------------
N
C
Y
A
E
E
---------
T
-
C
C
D
F
--
F
T
N
Q
A
Y
A
I
A
S
------
S
I
-----
V
S
F
Y
-
V
P
L
------------
V
I
M
V
-------
F
V
Y
S
R
----
V
F
Q
E
A
K
R
Q
------
L
Q
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
F
A
L
K
E
H
K
-------
A
L
K
--
T
L
G
I
I
M
G
-
T
F
T
L
C
W
L
P
F
F
--------
I
V
N
I
V
H
V
I
Q
D
N
L---------
I
----
R
--------
K
E
-
V
--
Y
I
L
L
------
N
W
I
G
Y
V
N
S
G
F
N
P
L
----------
I
Y
C
R
S
P
D
F
R
I
A
---
F
Q
E
L
L
C
L
----------------------------
13
PsiBlast_PDB
74.13
22%
-175
- C4 -
4QKX
2
ADRB2_HUMAN
A:
[191-447]
----------------------------------------------------------------------------------------------------------
L
-
I
V
L
-----
A
I
V
F
G
N
V
L
V
I
-----
T
A
I
-----------
A
K
F
E
R
L
-
Q
T
-
V
T
N
Y
F
I
T
S
--
L
A
C
A
D
L
V
M
G
L
A
--------------
V
-
V
P
F
G
A
A
C
I
-------
L
-
T
K
T
------
W
T
F
G
N
-
F
W
C
E
F
W
T
----------
S
I
D
V
L
C
V
T
A
S
I
E
T
-----
L
C
V
I
A
V
----------------
D
R
Y
F
A
I
T
------------
S
P
F
---------
K
Y
Q
S
L
---
L
T
------
K
N
K
A
R
V
I
I
L
-
M
V
W
I
V
S
G
L
--
T
S
-
F
--
L
P
I
Q
--------------
M
H
-
W
Y
R
-
A
T
H
Q
-------
E
A
----
I
------------------------------------
N
C
Y
A
E
E
---------
T
-
C
C
D
F
--
F
T
N
Q
A
Y
A
I
A
S
------
S
I
-----
V
S
F
Y
-
V
P
L
------------
V
I
M
V
-------
F
V
Y
S
R
----
V
F
Q
E
A
K
R
Q
------
L
Q
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
F
AL
K
E
H
K
-------
A
L
K
--
T
L
G
I
I
M
G
-
T
F
T
L
C
W
L
P
F
F
--------
I
V
N
I
V
H
V
I
Q
D
N
L---------
I
----
R
--------
K
E
-
V
--
Y
I
L
L
------
N
W
I
G
Y
V
N
S
G
F
N
P
L
----------
I
Y
C
R
S
P
D
F
R
I
A
---
F
Q
E
L
L
C
L
----------------------------
32
HHSearch
71.97
16%
-160
- C4 -
3PBL
2
DRD3_HUMAN (first)
A:
[41-472]
---------------------------------------------------------------------------------------------------
Y
A
L
S
Y
C
A
L
-
I
L
A
-----
I
V
F
-
G
N
G
L
V
C
-----
M
A
V
-----------
L
K
E
R
A
L
-
Q
T
-
T
T
N
Y
L
V
V
S
--
L
A
V
A
D
L
L
V
A
T
L
--------------
V
-
M
P
W
V
V
Y
L
E
-------
V
T
G
G
V
------
W
N
F
S
R
-
I
C
C
--
D
V
----------
F
V
T
L
D
V
M
M
C
T
A
S
I
-
W
N
--
L
C
A
I
S
I
----------------
D
R
Y
T
A
V
V
------------
M
P
V
---------
H
Y
Q
H
G
T
G
Q
S
S
------
C
R
R
V
A
L
M
I
--
T
A
V
W
V
L
A
F
--
A
V
-
S
--
C
P
L
L
--------------
F
G
-
F
N
T
-
T
----------------------------------------
G
D
-----------
P
T
V
C
S
I
S
N
P
------------------
D
F
V
I
Y
S
------
S
V
-----
V
S
F
Y
-
L
P
F
------------
G
V
T
V
-------
L
V
Y
A
R
----
I
Y
V
V
L
K
Q
R
------
R
R
------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
N
I
F
E
M
L
R
I
D
E
GLRL
K
I
Y
K
D
TEG
Y
Y
T
I
G
IGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
T
GTWDAYGVP
L
R
E
K
-----
K
-------
A
T
Q
--
M
V
A
I
V
L
G
-
A
F
I
V
C
W
L
P
F
F
--------
L
T
H
V
L
N
T
H
C
Q
T
C---------
H
----
V
--------
S
P
-
E
--
L
Y
S
A
-----
T
T
W
L
G
Y
V
N
S
A
L
N
P
V
----------
I
Y
T
T
F
N
I
E
F
R
K
---
A
F
L
K
I
L
S
C
---------------------------
42
Fugue
71.34
20%
-112
- C5 -
4PE6
1
?
A:
[18-339]
------------------
K
P
F
-----------------
I
A
L
S
N
GFI
G
N
------------------------
G
W
R
Q
T
M
I
A
K
F
E
E
A
A
K
Q
A
Q
A
D
G
------------------------
L
I
-
G
K
Y
K
V
V
-----
N
A
P
-----------
G
N
N
S
A
T
-
E
Q
-
V
A
Q
I
K
S
L
L
--
L
Q
K
P
D
A
L
L
I
N
P
--------------
A
-
S
P
T
A
L
Q
P
V
-------
I
-
Q
Q
A
------
C
D
A
G
V
-
K
V
V
--
V
F
----------
D
----
S
A
I
D
A
P
C
A
-
Y
I
--
L
Q
N
S
F
V
----------------
D
W
A
T
Y
A
A
------------
K
P
V
---------
L
E
S
----------------
I
G
G
K
G
--
N
V
I
V
V
R
G
V
--
V
G
-
S
--
Q
P
E
A
-------------------
E
M
Y
E
T
T
-------
K
K
----
I
L
----------------------
A
E
-----------
Y
P
Q
V
K
T
V
A
T
V
---
T
-
G
M
C
D
G
A
--
T
A
Q
K
A
V
L
G
V
L
------
P
S
VSTVD
A
V
I
G
C
G
D
G
------------
Y
G
V
A
-------
Q
A
F
A
T
A
GKP
I
P
A
V
T
F
E
T
------
N
G
------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
L
S
Y
-----
W
-------
K
D
N
KI
D
N
G
S
V
A
V
M
S
D
P
A
Q
S
V
A
A
L
--------
W
A
A
L
D
L
L
E
G
R
D
----------
L
----
P
--------
K
Q
M
T
F
P
I
V
L
I
E
EKD
R
D
T
W
A
S
V
L
K
P
D
-
E
Y
A
----------
A
W
P
W
T
R
E
L
F
R
Q
---
Q
V
E
A
I
K
T
G
G
E
PVQPPIPST----------------
33
HHSearch
70.95
15%
-155
- C4 -
2LNL
-
CXCR1_HUMAN
A:
[38-323]
--------------------------------------------------------------------------------------------
N
K
Y
V
---
V
I
I
A
Y
A
L
V
-
F
L
L
-----
S
L
L
-
G
N
S
L
V
M
-----
L
V
I
-----------
L
Y
S
R
V
G
-
R
S
-
V
T
D
V
Y
L
L
N
--
L
A
L
A
D
L
L
F
A
L
T
----------------
L
P
I
W
A
A
S
K
---------
V
N
G
------
W
I
F
G
T
-
F
L
C
--
K
V
----------
V
S
L
L
K
E
V
N
F
Y
S
G
I
-
L
L
--
L
A
C
I
S
V
----------------
D
R
Y
L
A
I
V
------------
H
A
T
---------
R
T
L
T
Q
----
K
------
R
H
L
V
K
F
V
C
--
L
G
C
W
G
L
S
M
--
N
L
-
S
--
L
P
F
F
--------------
L
F
-
R
Q
A
-
Y
H
P
---------------
N
----------------------
N
S
-----------
S
P
V
C
Y
E
V
L
G
N
---
D
-----
T
A
--
K
W
R
M
V
L
R
I
L
P
------
H
T
-----
F
G
F
I
-
V
P
L
------------
F
V
M
L
-------
F
C
Y
G
F
----
T
L
R
T
L
F
K
A
------
H
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Q
K
H
-----
R
-------
A
M
R
--
V
I
F
A
V
V
L
-
I
F
L
L
C
W
L
P
Y
N
--------
L
V
L
L
A
D
T
L
M
R
T
QVIQE
S
C
E
R
R
N
----
N
--------
I
G
-
R
--
A
L
D
A
-----
T
E
I
L
G
F
L
H
S
C
L
N
P
I
----------
I
Y
A
F
I
G
Q
N
F
R
H
---
G
F
L
K
I
L
A
M
H
G
-------------------------
30
HHSearch
69.66
16%
-145
- C4 -
1U19
14
OPSD_BOVIN
A:
[38-325]
-------------------------------------------------------------------------------------------
W
Q
F
S
M
---
L
A
A
Y
M
F
L
L
-
I
M
L
-----
G
F
P
-
I
N
F
L
T
L
-----
Y
V
T
-----------
V
Q
H
K
K
L
-
R
T
-
P
L
N
Y
I
L
L
N
--
L
A
V
A
D
L
F
M
V
F
G
--------------
G
-
F
T
T
T
L
Y
T
S
-------
L
-
H
G
Y
------
F
V
F
G
P
-
T
G
C
--
N
L
----------
E
G
F
F
A
T
L
G
G
E
I
A
L
-
W
S
--
L
V
V
L
A
I
----------------
E
R
Y
V
V
V
C
------------
K
P
M
---------
S
N
F
R
F
----
G
------
E
N
H
A
I
M
G
V
--
A
F
T
W
V
M
A
L
--
A
C
-
A
--
A
P
P
L
--------------
V
G
-
W
S
R
-
Y
I
P
---------------
E
----------------------
G
M
-----------
Q
C
S
C
G
I
D
Y
Y
T
---
P
----
H
E
E
--
T
N
N
E
S
F
V
I
Y
M
------
F
V
-----
V
H
F
I
-
I
P
L
------------
I
V
I
F
-------
F
C
Y
G
Q
----
L
V
F
T
V
K
E
A
------
A
A
------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
QQESA
T
T
Q
-----------------------------------------------------------------------------------------------------------------------------------------------------------
K
A
E
K
-----
E
-------
V
T
R
--
M
V
I
I
M
V
I
-
A
F
L
I
C
W
L
P
Y
A
--------
G
V
A
F
Y
I
F
T
H
Q
G
S---------
D
----
F
--------
G
P
-
I
--
F
M
T
I
-----
P
A
F
F
A
K
T
S
A
V
Y
N
P
V
----------
I
Y
I
M
M
N
K
Q
F
R
N
---
C
M
V
T
T
L
C
C
G
K
-------------------------
43
Fugue
68.76
20%
-182
- C5 -
4XGC
-
?
D:
[5-457]
--D
R
E
L
V
S
I
R
R
F
----
L
K
E
R
L
Q
RDYTTLRGY
A
K
E
R
S
N
V
R
L
L
L
Q
---
R
T
------------------------
A
E
M
G
E
-
S
N
S
L
L
L
L
G
P
R
G
S
G
K
T
T
L
I
---
N
S
V
L
A
D
L
L
-
P
N
K
-----
S
F
G
-
E
N
---
T
-----
L
I
V
-----------
H
L
D
G
N
L
-
H
T
D
D
R
V
A
L
K
S
I
--
T
V
Q
M
Q
L
E
N
A
A
D
GKVFG---------
S
-
F
A
E
N
L
A
F
L
-------
L
-
Q
C
L
------
K
S
K
S
V
-
I
F
I
--
L
E
E
F
D
L
F
C
A
HHN
Q
T
L
L
Y
N
L
F
D
V
S
Q
S
-
A
Q
A
P
I
C
V
L
G
V
----------------
T
C
R
L
D
V
I
------------
E
L
L
E
K
R
V
K
S
R
FS
H
R
Q
V
F
---
L
F
------
P
S
L
R
R
F
E
D
--
Y
V
D
L
C
R
D
L
--
L
S
-
L
P
T
G
N
S
L
--------------
L
L
-
A
A
E
-
K
I
Y
N
-------
L
Q
----
N
I
QSGALYFSRNHFDPGE
Y
G
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-----------
D
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Y
-----
L
K
N
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-
L
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------------
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LRPQSPH
I
T
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----
M
A
A
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G
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F
------
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G
------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
K
I
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-----
L
-------
L
C
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--
L
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L
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L
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-
L
I
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----------
A
----
K
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-----
A
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---
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P
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QSS----------------
40
Fugue
67.33
15%
-123
- C4 -
1U19
15
OPSD_BOVIN
A:
[4-349]
--------
M
N
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----
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-----------------
Y
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---
N
K
------------------------
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L
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W
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N
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-------
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A
A
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----
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------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
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-------
M
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M
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A
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L
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----------
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M
M
N
K
Q
F
R
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---
C
M
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T
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L
C
C
G
K
NPLGDDEA
S
T
T
V
S
K
TETSQVAPA--