@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 : OX2R_HUMAN: (2016-01-14 )
MSGTKLEDSPPCRNWSSASELNETQEPFLNPTDYDDEEFLRYLWREYLHPKEYEWVLIAGYIIVFVVALIGNVLVCVAVWKNHHMRTVTNYFIVNLSLADVLVTITCLPATLVVDITETWFFGQSLCKVIPYLQTVSVSVSVLTLSCIALDRWYAICHPLMFKSTAKRARNSIVIIWIVSCIIMIPQAIVMECSTVFPGLANKTTLFTVCDERWGGEIYPKMYHICFFLVTYMAPLCLMVLAYLQIFRKLWCRQIPGTSSVVQRKWKPLQPVSQPRGPGQPTKSRMSAVAAEIKQIRARRKTARMLMIVLLVFAICYLPISILNVLKRVFGMFAHTEDRETVYAWFTFSHWLVYANSAANPIIYNFLSGKFREEFKAAFSCCCLGVHHRQEDRLTRGRTSTESRKSLTTQISNFDNISKLSEQVVLTSISTLPAANGAGPLQNW
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..
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MSGTKLEDSPPCRNWS
S
A
S
ELNETQEPFLNPTDY
D
D
E
E
F
L
R
Y
L
W
R
EYLHPKE
Y
E
W
V
L
I
A
G
Y
I
I
V
F
V
V
A
L
I
G
N
V
L
V
C
V
A
V
WKNHH
M
R
T
V
T
N
Y
F
I
V
N
L
S
L
A
D
V
L
V
T
I
TCL
P
A
T
L
V
V
D
I-
T
E
T
-
W
F
F
G
Q
S
L
C
K
V
I
P
Y
L
Q
T
V
S
V
S
V
S
V
L
T
L
S
C
I
A
L
D
R
W
Y
A
I
C
H
P
L
-
M
F
K
S
-----
T
A
K
RARN
S
I
V
I
--
I
W
I
V
S
C
I
I
M
I
------------
P
Q
A
I
V
---------
M
E
C
S
T
VFP-GL-ANK
T
T
L
F
T
V
CDERW---GG
E
--
I
Y
P
K
M
Y
H
I
C
F
F
L
V
T
Y
M
A
P
L
C
L
M
V
L
A
Y
L
Q
I
F
R
K
L
W
C
R
QIPG
T
S
S
V
V
Q
-
R
-----KW--K--------------------------P--------------------L------------Q-------P---------------------------------------------------V----------------------------------------S--------------Q-P--------------------------------------------------------------R-------------------------------G-----------------------------------------------P----------------------------G---------Q---------
P
-------------
T
K
-------------
S
-------------------
R
M
-----------
S
----------
A
V
A
A
E
I
K
Q
I
R
--
A
R
R
K
T
A
R
M
L
M
I
V
L
L
V
F
A
I
C
Y
L
P
I
S
I
L
N
V
L
----
K
R
V
F
G
M
FA--H-TEDR
E
T
V
Y
A
W
-
F
T
F
S
H
W
L
V
Y
ANSAAN
P
I
I
Y
N
F
LS
G
K
F
R
E
E
F
K
A
A
F
-
S
C
C
C
LGVHHR
Q
E
D
RLTRGRTS
T
E
S
R
K
S
L
T
T
Q
ISNF
D
N
I
S
K
L
S
E
Q
V
V
L
T
S
ISTLPAANGAGPLQNW
45
HHSearch
79.09
25%
-136
- C9 -
3PBL
2
DRD3_HUMAN (first)
A:
[42-472]
---------------------------------------------------------
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
IGHL
L
TKSPS
L
N
A
---------------------------------------------------
A
K
S
E
L
D
K
A
I
GR------------------------------
N
TNGVIT--------
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
K
R
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
-
G
T
W
D
A
Y
G
V
P
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
HHSearch
73.46
26%
-134
- C9 -
3EML
13
ENLYS_BPT4
A:
[25-470]
---------------------------------------------------------
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
D
---
V
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
-----
G
L
RL
K
I
Y
K
D
TEGYYTIGIGHLL---------
T
--------------------
K
------------
S
-------
P
S
L
N
A
-----------------------------------------------
A
K
---------------------------------------
S
E
L
D
K
A
I
GRNTNGVI
T
-
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
-------------------------------
K
-----------------------------------------------
R
----------------------------
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
-----------
G
----------
T
W
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
C
--------
S
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
L
R
Q
----------------------------------------------------------
40
HHSearch
72.59
24%
-129
- C9 -
2RH1
16
ADRB2_HUMAN (first)
A:
[43-477]
--------------------------------------------------------
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
LL---
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
GRN--
T
-------
N
G--------------------------------------------------
V
----------------------------------------
I
T
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
K-----------------
R
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
----------
G
T
W
D
A
Y
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
---------------------------------------------------------------
41
HHSearch
71.54
24%
-135
- C9 -
3ODU
6
CXCR4_HUMAN (first)
A:
[48-496]
-----------------------------------------------------
K
I
F
L
P
T
I
Y
S
I
I
F
L
T
G
I
V
G
N
G
L
V
I
L
V
M
G
Y
Q
K
K
L
R
S
M
T
D
K
Y
R
L
H
L
S
V
A
D
L
L
F
V
-
I
T
L
P
F
W
A
V
D
A
V
--
A
N
-
W
Y
F
G
N
F
L
C
K
A
V
H
V
I
Y
T
V
N
L
Y
S
S
V
W
I
L
A
F
I
S
L
D
R
Y
L
A
I
V
H
A
T
-
N
S
Q
R
P
R
---
K
L
L
A
E
K
V
V
Y
V
G
--
V
W
I
P
A
L
L
L
T
I
------------
P
D
F
I
F
---------
A
N
V
S
E
A
----------
D
D
R
Y
I
C
D
R
F
Y
---
P
N
D
--
L
W
V
V
V
F
Q
F
Q
H
I
M
V
G
L
I
L
P
G
I
V
I
L
S
C
Y
C
I
I
I
S
K
L
S
H
S
G
S
N
I
F
E
M
L
R
I
-
D
-----
E
G
--
L
--------------------------
R
--------------------
L
------------
K
I
Y
-----
K
D
TEG
Y
Y
T
I
GIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
IGRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKLK
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
-------------------------------
K
-----------------------------------------------
R
----------------------------
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
-----------
G
----------
T
W
D
A
Y
G
S
K
G
H
--
Q
K
R
K
A
L
K
T
T
V
I
L
I
L
A
F
F
A
C
W
L
P
Y
Y
I
G
I
S
I
----
D
S
F
I
L
L
E
I
I
K
Q
G
C
E
F
E
N
T
V
H
K
W
-
I
S
I
T
E
A
L
A
F
F
H
C
C
L
N
P
I
L
Y
A
F
L
G
A
K
F
K
T
S
A
Q
H
A
L
-
T
S
G
R
P
L
E
V
L
F
Q
------------------------------------------------------
39
HHSearch
70.12
20%
-134
- C9 -
3RZE
5
ENLYS_BPT4 (first)
A:
[12-443]
---------------------------------------------------------
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
YR---
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
GRNTNGVI
T
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
T
G
T
W
D
A
Y
L
H
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
---------------------------------------------------------------
60
Fugue
69.89
26%
-128
- C9 -
4XNV
15
P2RY1_HUMAN (first)
A:
[38-382]
--------
S
F
K
C
A
---------------
L
T
K
T
G
F
------------------
Q
F
Y
Y
L
P
A
V
Y
I
L
V
F
I
I
G
F
L
G
N
S
V
A
I
W
M
F
V
F
H
M
K
P
W
S
G
I
S
V
Y
M
F
N
L
A
L
A
D
F
L
Y
V
L
T
-
L
P
A
L
I
F
Y
Y
F
-
N
K
T
D
W
I
F
G
D
A
M
C
K
L
Q
R
F
I
F
H
V
N
L
Y
G
S
I
L
F
L
T
C
I
S
A
H
R
Y
S
G
V
V
Y
P
K
---
S
L
-----
G
R
L
K
K
K
N
A
I
C
I
--
S
V
L
V
W
L
I
V
V
V
------------
A
I
S
P
I
---------
L
F
Y
S
-----
G
T
-
G
V
R
K
N
K
T
I
T
C
Y
D
T
T
---
S
D
E
Y
L
R
S
Y
F
I
Y
S
M
C
T
T
V
A
M
F
C
V
P
L
V
L
I
L
G
C
Y
G
L
I
V
R
A
L
I
Y
K
M
K
K
Y
T
C
T
V
C
G
-
Y
-----
I
Y
--
N
--------------------------
P
--------------------
E
------------
D
G------
D
---------------------------------------------------
P
----------------------------------------
D
--------------
N
-
G
--------------------------------------------------------------
V
-------------------------------
N
-----------------------------------------------
P
----------------------------
G
---------
T
---------
D
-------------
F
K
DIVC---------
P
-------------------
L
C
-----------
G
----------
V
G
K
D
Q
F
E
E
V
E
E
P
L
R
R
K
S
I
Y
L
V
I
I
V
L
T
V
F
A
V
S
Y
I
P
F
H
V
M
K
T
M
N
L
R
A
R
L
D
F
Q
T
P
A
--
M
-
C
A
F
N
D
R
V
Y
A
T
-
Y
Q
V
T
R
G
L
A
S
L
N
S
C
V
N
P
I
L
Y
F
L
A
G
D
T
F
R
R
R
-----------------------------------------------------------------------
59
Fugue
69.75
20%
-103
- C9 -
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
G
W
S
R
Y
I
P
E
G
M
-
Q
------
C
S
C
G
I
D
Y
YTP
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
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
N
P
S
T
T
V
S
K
T
E
T
S
Q
V
A
P
A
-----------------------------------------
11
PsiBlast_PDB
69.69
27%
-150
- C9 -
4AMJ
12
ADRB1_MELGA
A:
[16-296]
--------------------------------------------------------
L
L
M
A
L
V
V
L
L
I
V
A
--
G
N
V
L
V
I
A
A
I
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
-
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
-
R
Y
Q
S
-----
L
M
T
R
A
R
A
K
V
I
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
HWWRDED
P
Q
A
-----------
L
K
C
Y
Q
D
-
P
-
G
C
-
C
D
F
V
T
-------------------
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
---------------------------------------------------------------------------------------
E
-------
A
---------------------------------------------------
K
----------------------------------------
E
--------------
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
----------
R
V
-----
M
L
M
--
R
E
H
K
A
L
K
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
--------------
N
-
V
F
N
R
D
L
V
P
D
W
L
F
V
A
F
N
W
L
G
Y
A
N
S
A
M
N
P
I
I
Y
C
-
R
S
P
D
F
R
K
A
F
K
R
L
L
-
A
----------------------------------------------------------------
9
PsiBlast_PDB
69.37
27%
-156
- C9 -
2Y03
9
ADRB1_MELGA
A:
[16-296]
--------------------------------------------------------
L
L
M
A
L
V
V
L
L
I
V
A
--
G
N
V
L
V
I
A
A
I
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
-
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
-
R
Y
Q
S
-----
L
M
T
R
A
R
A
K
V
I
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
HWWRDED
P
Q
A
-----------
L
K
C
Y
Q
D
-
P
-
G
C
-
C
D
F
V
T
-------------------
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
---------------------------------------------------------------------------------------
E
-------
A
---------------------------------------------------
K
----------------------------------------
E
--------------
Q
-
I
--------------------------------------------------------------
R
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
----------
R
V
-----
M
L
M
--
R
E
H
K
A
L
K
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
--------------
N
-
V
F
N
R
D
L
V
P
D
W
L
F
V
A
F
N
W
L
G
Y
A
N
S
A
M
N
P
I
I
Y
C
-
R
S
P
D
F
R
K
A
F
K
R
L
L
-
A
----------------------------------------------------------------
6
PsiBlast_PDB
69.30
27%
-153
- C9 -
2Y00
13
ADRB1_MELGA
A:
[16-296]
--------------------------------------------------------
L
L
M
A
L
V
V
L
L
I
V
A
--
G
N
V
L
V
I
A
A
I
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
-
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
-
R
Y
Q
S
-----
L
M
T
R
A
R
A
K
V
I
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
HWWRDED
P
Q
A
-----------
L
K
C
Y
Q
D
-
P
-
G
C
-
C
D
F
V
T
-------------------
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
---------------------------------------------------------------------------------------
E
-------
A
---------------------------------------------------
K
----------------------------------------
E
--------------
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
----------
R
V
-----
M
L
M
--
R
E
H
K
A
L
K
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
--------------
N
-
V
F
N
R
D
L
V
P
D
W
L
F
V
A
F
N
W
L
G
Y
A
N
S
A
M
N
P
I
I
Y
C
-
R
S
P
D
F
R
K
A
F
K
R
L
L
-
A
----------------------------------------------------------------
7
PsiBlast_PDB
69.13
27%
-153
- C9 -
2Y01
12
ADRB1_MELGA
A:
[16-296]
--------------------------------------------------------
L
L
M
A
L
V
V
L
L
I
V
A
--
G
N
V
L
V
I
A
A
I
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
-
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
-
R
Y
Q
S
-----
L
M
T
R
A
R
A
K
V
I
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
HWWRDED
P
Q
A
-----------
L
K
C
Y
Q
D
-
P
-
G
C
-
C
D
F
V
T
-------------------
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
---------------------------------------------------------------------------------------
E
-------
A
---------------------------------------------------
K
----------------------------------------
E
--------------
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
----------
R
V
-----
M
L
M
--
R
E
H
K
A
L
K
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
--------------
N
-
V
F
N
R
D
L
V
P
D
W
L
F
V
A
F
N
W
L
G
Y
A
N
S
A
M
N
P
I
I
Y
C
-
R
S
P
D
F
R
K
A
F
K
R
L
L
-
A
----------------------------------------------------------------
14
PsiBlast_PDB
69.10
27%
-156
- C9 -
4EA3
3
C562_ECOLX (first)
A:
[121-405]
-------------------------------------------------
P
L
G
L
K
V
T
I
V
G
L
Y
L
A
V
C
V
G
G
L
L
G
N
C
L
V
M
Y
V
I
L
R
H
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
T
L
V
L
L
T
-
L
P
F
Q
G
T
D
I
L
-
L
G
F
-
W
P
F
G
N
A
L
C
K
T
V
I
A
I
D
Y
Y
N
M
F
T
S
T
F
T
L
T
A
M
S
V
D
R
Y
V
A
I
C
H
P
-----------
T
S
S
K
A
Q
A
V
N
V
A
--
I
W
A
L
A
S
V
V
G
V
------------
P
V
A
I
M
G
S
A
Q
VEDE
E
I
E
C
L
V
E
I
P
------------
T
P
Q
D
Y
W
---
G
-------
P
V
F
A
I
C
I
F
L
F
S
F
I
V
P
V
L
V
I
S
V
C
Y
S
L
M
I
R
R
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
-------------------------------
G
-----------------------------------------------
V
----------------------------
R
---------
L
---------
L
-------------
S
G
-------------
S
-------------------
R
-----------------------------
E
K
D
R
--
N
L
R
R
I
T
R
L
V
L
V
V
V
A
V
F
V
G
C
W
T
P
V
Q
V
F
-
V
L
----
A
Q
G
L
G
V
Q
P
--
S
-
S
---
E
T
A
V
A
I
-
L
R
F
C
T
A
L
G
Y
V
N
S
C
L
N
P
I
L
Y
A
F
L
D
----
E
N
F
K
A
C
F
R-----------------------------------------------------------------
13
PsiBlast_PDB
69.05
27%
-151
- C9 -
3ZPR
11
ADRB1_MELGA
A:
[16-296]
--------------------------------------------------------
L
L
M
A
L
V
V
L
L
I
V
A
--
G
N
V
L
V
I
A
A
I
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
-
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
-
R
Y
Q
S
-----
L
M
T
R
A
R
A
K
V
I
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
HWWRDED
P
Q
A
-----------
L
K
C
Y
Q
D
-
P
-
G
C
-
C
D
F
V
T
-------------------
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
---------------------------------------------------------------------------------------
E
-------
A
---------------------------------------------------
K
----------------------------------------
E
--------------
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
L
M
--
R
E
H
K
A
L
K
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
--------------
N
-
V
F
N
R
D
L
V
P
D
W
L
F
V
A
F
N
W
L
G
Y
A
N
S
A
M
N
P
I
I
Y
C
-
R
S
P
D
F
R
K
A
F
K
R
L
L
------------------------------------------------------------------
20
PsiBlast_PDB
69.01
27%
-148
- C9 -
2YCY
6
ADRB1_MELGA
A:
[16-294]
--------------------------------------------------------
L
L
M
A
L
V
V
L
L
I
V
A
--
G
N
V
L
V
I
A
A
I
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
-
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
-
R
Y
Q
S
-----
L
M
T
R
A
R
A
K
V
I
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
HWWRDED
P
Q
A
-----------
L
K
C
Y
Q
D
-
P
-
G
C
-
C
D
F
V
T
-------------------
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
---------------------------------------------------------------------------------------
E
-------
A
---------------------------------------------------
K
----------------------------------------
E
--------------
Q
-
I
--------------------------------------------------------------
R
------------------------------------------------------------------------------------------------------------
D
---------
R
---------
A
-------------
S
K
-------------
R
-------------------
K
R
-----------
V
----------
M
L
M
R
E
---------
H
K
A
L
K
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
--------------
N
-
V
F
N
R
D
L
V
P
D
W
L
F
V
A
F
N
W
L
G
Y
A
N
S
A
M
N
P
I
I
Y
C
-
R
S
P
D
F
R
K
A
F
K
R
L
L
-
A
F
---------------------------------------------------------------
8
PsiBlast_PDB
68.92
27%
-154
- C9 -
2Y02
13
ADRB1_MELGA
A:
[16-296]
--------------------------------------------------------
L
L
M
A
L
V
V
L
L
I
V
A
--
G
N
V
L
V
I
A
A
I
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
-
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
-
R
Y
Q
S
-----
L
M
T
R
A
R
A
K
V
I
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
HWWRDED
P
Q
A
-----------
L
K
C
Y
Q
D
-
P
-
G
C
-
C
D
F
V
T
-------------------
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
---------------------------------------------------------------------------------------
E
-------
A
---------------------------------------------------
K
----------------------------------------
E
--------------
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
----------
R
V
-----
M
L
M
--
R
E
H
K
A
L
K
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
--------------
N
-
V
F
N
R
D
L
V
P
D
W
L
F
V
A
F
N
W
L
G
Y
A
N
S
A
M
N
P
I
I
Y
C
-
R
S
P
D
F
R
K
A
F
K
R
L
L
-
A
----------------------------------------------------------------
10
PsiBlast_PDB
68.71
27%
-156
- C9 -
2Y04
13
ADRB1_MELGA
A:
[16-296]
--------------------------------------------------------
L
L
M
A
L
V
V
L
L
I
V
A
--
G
N
V
L
V
I
A
A
I
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
-
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
-
R
Y
Q
S
-----
L
M
T
R
A
R
A
K
V
I
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
HWWRDED
P
Q
A
-----------
L
K
C
Y
Q
D
-
P
-
G
C
-
C
D
F
V
T
-------------------
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
---------------------------------------------------------------------------------------
E
-------
A
---------------------------------------------------
K
----------------------------------------
E
--------------
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
----------
R
V
-----
M
L
M
--
R
E
H
K
A
L
K
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
--------------
N
-
V
F
N
R
D
L
V
P
D
W
L
F
V
A
F
N
W
L
G
Y
A
N
S
A
M
N
P
I
I
Y
C
-
R
S
P
D
F
R
K
A
F
K
R
L
L
-
A
----------------------------------------------------------------
12
PsiBlast_PDB
68.65
27%
-151
- C9 -
3ZPQ
11
ADRB1_MELGA
A:
[16-296]
--------------------------------------------------------
L
L
M
A
L
V
V
L
L
I
V
A
--
G
N
V
L
V
I
A
A
I
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
-
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
-
R
Y
Q
S
-----
L
M
T
R
A
R
A
K
V
I
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
HWWRDED
P
Q
A
-----------
L
K
C
Y
Q
D
-
P
-
G
C
-
C
D
F
V
T
-------------------
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
---------------------------------------------------------------------------------------
E
-------
A
---------------------------------------------------
K
----------------------------------------
E
--------------
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
----------
R
V
-----
M
L
M
--
R
E
H
K
A
L
K
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
--------------
N
-
V
F
N
R
D
L
V
P
D
W
L
F
V
A
F
N
W
L
G
Y
A
N
S
A
M
N
P
I
I
Y
C
-
R
S
P
D
F
R
K
A
F
K
R
L
L
-
A
----------------------------------------------------------------
1
PsiBlast_PDB
68.54
100%
-176
- C9 -
4S0V
1
OX2R_HUMAN
A:
[56-260]
-------------------------------------------------
P
K
E
Y
E
W
V
L
I
A
G
Y
I
I
V
F
V
V
A
L
I
G
N
V
L
V
C
V
A
V
W
K
N
H
H
M
R
T
V
T
N
Y
F
I
V
N
L
S
L
A
D
V
L
V
T
I
T
C
L
P
A
T
L
V
V
D
I
-
T
E
T
-
W
F
F
G
Q
S
L
C
K
V
I
P
Y
L
Q
T
V
S
V
S
V
S
V
L
T
L
S
C
I
A
L
D
R
W
Y
A
I
C
H
P
-----
S
-----
T
A
K
R
A
R
N
S
I
V
I
--
I
W
I
V
S
C
I
I
M
I
------------
P
Q
A
I
V
---------
M
E
C
S
T
V
F
-------
K
T
T
L
F
T
V
C
D
E
R
W
---
G
G
E
--
I
Y
P
K
M
Y
H
I
C
F
F
L
V
T
Y
M
A
P
L
C
L
M
V
L
A
Y
L
Q
I
F
R
K
L
W
C
R
Q
G
I
D
C
S
F
W
N
E
-
S
-----
Y
L
--
T
--------------------------
G
--------------------
S
------------
R
-------
D
---------------------------------------------------
E
----------------------------------------
R
--------------
K
-
K
--------------------------------------------------------------
S
-------------------------------
L
-----------------------------------------------
L
----------------------------
S
---------
K
---------
F
-------------
G
M
-------------
D
-------------------
E
G
-----------
V
----------
T
F
M
F
I
G
R
F
D
R
--
G
Q
K
G
V
D
V
L
L
K
A
I
E
I
L
S
S
K
K
E
F
Q
E
M
R
F
I
I
I
----
G
K
G
D
P
E
L
E
--
G
-
W
A
R
S
L
E
E
K
H
G
-
N
V
K
V
I
T
E
M
L
S
R
E
F
V
R
E
L
Y
G
S
V
D
F
V
I
I
P
S
Y
F
E
P
F
G
-
L
V
A
L
E
A
M
C
L
G
A
I
P
I
A
S
A
V
G
G
L
R
D
I
I
T
N
E
T
G
I
L
V
K
A
G
D
P
G
E
L
A
N
A
I
L
K
A
L
E
L
S
R
S
D
L
S
K
F
R
E
N
C
K
K
19
PsiBlast_PDB
68.29
27%
-145
- C9 -
2YCZ
2
ADRB1_MELGA
A:
[16-294]
--------------------------------------------------------
L
L
M
A
L
V
V
L
L
I
V
A
--
G
N
V
L
V
I
A
A
I
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
-
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
-
R
Y
Q
S
-----
L
M
T
R
A
R
A
K
V
I
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
HWWRDED
P
Q
A
-----------
L
K
C
Y
Q
D
-
P
-
G
C
-
C
D
F
V
T
-------------------
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
---------------------------------------------------------------------------------------
E
-------
A
---------------------------------------------------
K
----------------------------------------
E
--------------
Q
-
I
--------------------------------------------------------------
R
-------------------------------
K
-----------------------------------------------
I
----------------------------
D
---------
R
---------
A
-------------
S
K
-------------
R
-------------------
K
R
-----------
V
----------
M
L
M
R
E
---------
H
K
A
L
K
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
--------------
N
-
V
F
N
R
D
L
V
P
D
W
L
F
V
A
F
N
W
L
G
Y
A
N
S
A
M
N
P
I
I
Y
C
-
R
S
P
D
F
R
K
A
F
K
R
L
L
-
A
F
---------------------------------------------------------------
15
PsiBlast_PDB
68.28
27%
-150
- C9 -
4BVN
11
ADRB1_MELGA
A:
[16-296]
--------------------------------------------------------
L
L
M
A
L
V
V
L
L
I
V
A
--
G
N
V
L
V
I
A
A
I
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
-
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
V
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
-
R
Y
Q
S
-----
L
M
T
R
A
R
A
K
V
I
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
HWWRDED
P
Q
A
-----------
L
K
C
Y
Q
D
-
P
-
G
----------
C
C
D
--------
F
--
V
T
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
---------------------------------------------------------------------------------------
E
-------
A
---------------------------------------------------
K
----------------------------------------
E
--------------
Q
-
I
--------------------------------------------------------------
R
-----------------------------------------------------------------------------------------------------------------------------------------------
K
-------------
R
-------------------
K
T
-----------
S
----------
R
V
-----
M
L
M
--
R
E
H
K
A
L
K
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
--------------
N
-
V
F
N
R
D
L
V
P
K
W
L
F
V
A
F
N
W
L
G
Y
A
N
S
A
M
N
P
I
I
L
C
-
R
S
P
D
F
R
K
A
F
K
R
L
L
-
A
----------------------------------------------------------------