@TOME V2.3
(Nov 2016)
Ref.
-
-
Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
Core Structure Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
Core Structure Cluster
Contacts with Ligands
Show alignment :
Atome selection
All alignments
Only Template with Ligand
Column output:
Score:
Atome Rank Value
Tools Score
Hide column
Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
Hide column
Structural Clustering:
Cluster Num
3D-Jury Struct. Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
Hide column
Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
Hide column
Sequence & Result Tab:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : GPR63_HUMAN: (2016-01-10 )
MVFSAVLTAFHTGTSNTTFVVYENTYMNITLPPPFQHPDLSPLLRYSFETMAPTGLSSLTVNSTAVPTTPAAFKSLNLPLQITLSAIMIFILFVSFLGNLVVCLMVYQKAAMRSAINILLASLAFADMLLAVLNMPFALVTILTTRWIFGKFFCRVSAMFFWLFVIEGVAILLIISIDRFLIIVQRQDKLNPYRAKVLIAVSWATSFCVAFPLAVGNPDLQIPSRAPQCVFGYTTNPGYQAYVILISLISFFIPFLVILYSFMGILNTLRHNALRIHSYPEGICLSQASKLGLMSLQRPFQMSIDMGFKTRAFTTILILFAVFIVCWAPFTTYSLVATFSKHFYYQHNFFEISTWLLWLCYLKSALNPLIYYWRIKKFHDACLDMMPKSFKFLPQLPGHTKRRIRPSAVYVCGEHRTVV
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.......
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
M
V
F
S
A
V
L
T
A
F
HTGTS
N
T
T
F
V
V
Y
EN
T
Y
M
N
I
TLPPPFQHP
D
L
S
P
L
L
R
Y
S
F
ETMAPTGL
S
S
L
T
VNSTAVPTT
P
A
A
F
KSLNL
P
L
Q
I
T
L
S
A
I
M
I
F
I
L
F
V
S
F
L
G
N
L
V
V
C
L
M
V
Y
Q
K
A
A
M
R
S
A
I
N
I
L
L
A
S
L
A
F
A
D
M
L
L
A
V
LNM
P
F
A
L
V
T
I
L
-
T
T
R
W
I
F
G
K
F
F
C
R
V
S
A
M
F
F
W
L
F
V
I
EG
V
A
I
L
L
I
I
SI
D
R
F
L
I
I
V
---Q---RQD---KLNPY
R
A
K
V
L
I
A
V
SWAT
S
F
C
VAF-PLAV-----G-NPDLQIPSRAP
Q
C
V
F
G
YT-----TNP---G
Y
Q
A
Y
V
I
L
I
S
L
I
S
F
F
I
P
F
L
V
I
L
Y
S
F
M
G
I
L
N
T
L
R
HN
A
L
R
IHSYPEG
I
C
----------------------------
L
---------------------
S
--------------------
Q
--------------------------
A
S----------------------------------------------------------------------------------------------------------K------------------------------------------------------------L-------------------------------------------------------
G
-------------
L
-
M
---------------
S
----------L-------------QR
P
-------------
F
Q
M
S
IDMGFK
T
R
A
F
T
T
I
L
I
L
F
A
V
F
I
V
CWAP
F
T
T
Y
S
L
V
A
T
F
S
K
H
F
------
Y
Y
Q
H
N
F
F
E
I
S
T
W
L
L
W
L
C
Y
L
K
S
AL
N
P
L
I
Y
Y
W
R
I
K
K
F
H
D
A
C
L
D
MM
P
K
S
F
K
FLPQLPGHTKRRIRP
S
A
V
Y
V
CGEHRTVV
32
HHSearch
92.87
25%
-174
- C3 -
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
---------------------
G
LRL
K
I
Y
K
D
TEG
Y
Y
T
I
G
IGHL
L
--------------------------
T
K
SPS
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
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
-------------------------------
25
HHSearch
86.77
23%
-163
- C3 -
2RH1
16
ADRB2_HUMAN (first)
A:
[39-477]
-------------------------------------------------------------------------------
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
PFK
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
CC---
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
TEGYYTIGIGHLLT
K
--------------------
S
PS
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
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
-------------------------------
27
HHSearch
86.54
21%
-176
- C3 -
3RZE
5
ENLYS_BPT4 (first)
A:
[10-443]
----------------------------------------------------------------------------------
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
PLR
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
-
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
TGT
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
-------------------------------
14
PsiBlast_PDB
85.75
26%
-173
- C3 -
4BVN
11
ADRB1_MELGA
A:
[11-300]
--------------------------------------------------------------------------------
E
A
G
M
S
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
HWWRD
E
-
D
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
------------------------
6
PsiBlast_PDB
85.45
26%
-177
- C3 -
2Y00
13
ADRB1_MELGA
A:
[11-300]
--------------------------------------------------------------------------------
E
A
G
M
S
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
HWWRD
E
-
D
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
------------------------
11
PsiBlast_PDB
85.05
26%
-174
- C3 -
4AMJ
12
ADRB1_MELGA
A:
[11-300]
--------------------------------------------------------------------------------
E
A
G
M
S
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
HWWRD
E
-
D
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
------------------------
4
PsiBlast_PDB
84.94
27%
-172
- C3 -
2YCZ
2
ADRB1_MELGA
A:
[11-299]
--------------------------------------------------------------------------------
E
A
G
M
S
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
HWWRD
E
-
D
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
-----------------------
12
PsiBlast_PDB
84.32
26%
-174
- C3 -
3ZPQ
11
ADRB1_MELGA
A:
[11-300]
--------------------------------------------------------------------------------
E
A
G
M
S
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
HWWRD
E
-
D
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
------------------------
2
PsiBlast_PDB
84.31
27%
-169
- C3 -
2YCW
7
ADRB1_MELGA
A:
[11-299]
--------------------------------------------------------------------------------
E
A
G
M
S
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
SPF
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
HWWRD
E
-
D
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
-----------------------
10
PsiBlast_PDB
84.18
26%
-177
- C3 -
2Y04
13
ADRB1_MELGA
A:
[11-300]
--------------------------------------------------------------------------------
E
A
G
M
S
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
HWWRD
E
-
D
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
84.09
27%
-175
- C3 -
2VT4
8
ADRB1_MELGA
A:
[11-298]
--------------------------------------------------------------------------------
E
A
G
M
S
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
HWWRD
E
-
D
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
------------------------
5
PsiBlast_PDB
84.02
27%
-165
- C3 -
2YCY
6
ADRB1_MELGA
A:
[11-299]
--------------------------------------------------------------------------------
E
A
G
M
S
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
HWWRD
E
-
D
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
83.83
26%
-177
- C3 -
2Y02
13
ADRB1_MELGA
A:
[11-300]
--------------------------------------------------------------------------------
E
A
G
M
S
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
HWWRD
E
-
D
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
83.62
26%
-177
- C3 -
2Y03
9
ADRB1_MELGA
A:
[11-300]
--------------------------------------------------------------------------------
E
A
G
M
S
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
HWWRD
E
-
D
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
------------------------
7
PsiBlast_PDB
83.35
26%
-176
- C3 -
2Y01
12
ADRB1_MELGA
A:
[11-300]
--------------------------------------------------------------------------------
E
A
G
M
S
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
HWWRD
E
-
D
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
------------------------
3
PsiBlast_PDB
82.74
27%
-167
- C3 -
2YCX
3
ADRB1_MELGA
A:
[11-294]
--------------------------------------------------------------------------------
E
A
G
M
S
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
HWWRD
E
-
D
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
----------------------------
13
PsiBlast_PDB
82.59
26%
-175
- C3 -
3ZPR
11
ADRB1_MELGA
A:
[11-299]
--------------------------------------------------------------------------------
E
A
G
M
S
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
HWWRD
E
-
D
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
-------------------------
31
HHSearch
81.80
21%
-161
- C3 -
3EML
13
ENLYS_BPT4
A:
[21-472]
--------------------------------------------------------------------------------
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
PLR
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
ACLFE
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
TEGYYTIGIGHLLT
K
--------------------
S
PS
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
------------------------------------------------------------
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
--------------------------
21
HHSearch
81.73
20%
-148
- C3 -
3ODU
6
CXCR4_HUMAN (first)
A:
[41-497]
-------------------------------------------------------------------------
E
E
N
A
N
F
N
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
ATN
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
KRW
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
----------------------
29
HHSearch
80.06
22%
-165
- C3 -
2KS9
1
NK1R_HUMAN
A:
[32-326]
--------------------------------------------------------------------------------
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
NKI
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
P
G
D
S
S
D
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
Y
H
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
------
Y
L
K
K
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
F
I
S
A
G
D
Y
E
G
L
E
M
K
S
T
R
Y
L
Q
T
Q
G
S
V
Y
K
V
S
R