@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 : OR2L5_HUMAN: (2016-01-13 )
MENYNQTSTDFILLGLFPPSKIGLFLFILFVLIFLMALIGNLSMILLIFLDTHLHTPMYFLLSQLSLIDLNYISTIVPKMASDFLYGNKSISFIGCGIQSFFFMTFAGAEALLLTSMAYDRYVAICFPLHYPIRMSKRMYVLMITGSWMIGSINSCAHTVYAFRIPYCKSRAINHFFCDVPAMLTLACTDTWVYEYTVFLSSTIFLVFPFTGIACSYGWVLLAVYRMHSAEGRKKAYSTCSTHLTVVTFYYAPFAYTYLCPRSLRSLTEDKVLAVFYTILTPMLNPIIYSLRNKEVMGALTRVIQNIFSVKM
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------------------------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
------------------------------------------------------------------------------MENYNQTST
D
F
I
L
L
G----------------LF
P
P
-
S
K
I
G
L
F
L
F
I
L
F
V
-------
L
I
F
L
M
A
L
IG
N
L
S
M
I
L
L
I
--------
F
LDTHL-H
T
-------
P
M
Y
F
L
L
S
Q
L
S
L
I
D
L
N
Y
I
S
T
I
-
V
P
K
M
A
S
D
F
L-YGNK
S
I
S
F
I
G
C
G
--
I
Q
S
F
---
F
F
M
T
FAGA
E
A
L
L
L
T
S
---------------MAYD
R
Y
V
A
I
C
F
PLHYPIR---MS
K
-----
R
M
Y
V
L
M
I
T--G
S
W
M
IG
S
I
N
------------------
S
C
A
H
T
V
Y
A
--
F
RI---------------PYCKS---------RAI
N
H
F
FC--DV
P
A
M
L
T
L
A
C-------T-------D
T
W
V
Y
--
E
Y
T
-------
V
F
LS
S
T
I
F
L
V
FP---------------FTGI
A
C
S
Y
G
W
-------
V
L
L
A
V
-----------
Y
R
M
HSA-----------E--------------------G
R
K
K
A
-----
Y
ST-----------CS
T
H
L
T
-----
V
V
T
F
Y-------YA
P
F
A
Y
T
YL
C
P
R
S
------
L
R
---
S
----
L
T
-E
D
-
K
V
--
L
--
A
V
F
Y
-------
T
I
L
T
P
-
M
L
N
-
P
I
I
Y
S
LRN
K
---
E
V
M
-
G
A
-
L
T
R
V
I
------------------
Q
N
I
FSVKM------------------------------------------------------------------------------------------------------------------------------------------
43
Fugue
84.12
18%
-113
- C3 -
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
KNKTI
T
C
Y
D
T
T
S
D
EY
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
PEDGDPDNGVNPGTD
F
K
D
I
V
C
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
-------------------------------------------------------------------------------------------------------------------------------------------
27
HHSearch
83.07
15%
-132
- C3 -
2KS9
1
NK1R_HUMAN
A:
[35-324]
------------------------------------------------------------------------------------------------------------------------
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
P
GDSSDRYH
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
LYL-
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
------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
82.94
16%
-135
- C3 -
2Z73
5
OPSD_TODPA
A:
[35-334]
----------------------------------------------------------------------------------------------------------------------
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
LEW
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
T
C
C
Q
------------------------------------------------------------------------------------------------------------------------------------------
40
Fugue
80.65
15%
-124
- C3 -
1F88
8
OPSD_BOVIN
A:
[1-348]
--------------------------------------------------------------------------------
M
N
G
T
E
G
P
N
F
Y
V
P
F
SNKTGVVRSPFEAPQY
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
DYYTPH
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
TVSKTETS
Q
V
A
P
A-----------------------------------------------------------------------------------------------------------------------------
45
Fugue
78.48
20%
-157
- C2 -
4XR7
-
PAN3_YEAST
B:
[1-456]
MH
S
L
L
Q
YRSADQLFIPNN
I
R
E
D
L
T
K
K
N
L
S
I
L
QVFPSSGKVIPSIVQDYFNLVPLNFNNKT
T
L
F
K
V
F
S
NYDGK
A
Y
V
L
K
R
L
P
N
I
D
K
S
M
N
P
N
K
I
S
K
----------------
I
Y
Q
I
W
S
K
I
N
C
T
N
L
I
K
F
R
-------
D
I
F
Q
T
T
K
F
G
D
L
S
I
C
L
V
F
D
Y
YPNSLS
L
Y
D
Y
H
F
V
N
F
-------
P
K
F
P
I
T
N
N
Y
L
W
I
Y
L
V
Q
L
T
N
V
-
I
N
S
I
H
S
Q
N
L
-
S
I
G
N
T
L
N
W
R
K
V
L
--
I
T
G
D
PGR
I
K
L
S
H
C
N
F
M
D
L
L
F
N
D
DTDTVVSST
I
E
G
Q
Q
Q
L
D
Y
K
Y
L
G
E
L
L
F
N
L
S
I
N
I
E
---
N
S
N
NN
T
A
P
K
E
Y
R
L
E
E
I
--
T
P
Q
S
I
D
D
M
R
------------------
Q
I
D
D
K
-
F
K
--
D
V
L
---------------
K
Y
L
I
S
D
N
G
DSKKS
I
H
D
L
T
S
H
F
Y
--
D
-
K
M
F
M
V
L
E
S
-------
S
-------
Q
T
Y
T
E
--
Y
M
E
-------
S
V
L
S
R
E
L
--------------------------
E
N
G
R
-------
L
F
R
L
V
-----------
N
K
L
N
C
I
-----------
F
--------------------
G
R
I
E
S
RIDIN
W
S
E
-----------
S
G
T
K
F
P
-----
I
I
L
F
Y
-------
D
Y
V
F
H
Q
V
D
S
N
G
K
P
------
I
M
---
D
----
L
T
-
H
V
L
R
C
--
L
--
N
K
L
D
A
GIQ
E
K
L
M
L
V
T
P
D
E
L
N
-
C
I
I
I
S
--
Y
K
---
E
L
K
-
D
L
-
I
E
S
T
F
------------------
R
S
I
T
Q
H
--------------------------------------------------------------------------------------------------------------------------------------------
44
Fugue
78.23
15%
-140
- C3 -
3ODU
6
CXCR4_HUMAN (first)
A:
[37-502]
-------------------------------------------------------------------------------
P
C
F
R
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
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
DD
R
Y
I
C
D
R
F
Y
PN
D
L
W
V
V
V
---------
F
Q
F
Q
H
I
M
V
GL
I
L
P
G
I
V
I
L
S
C
-------
Y
-------
C
I
I
I
S
--
K
L
S
HSGSN
I
F
E
M
L
R
I
D
E
G
L
R
L
K
---------------
I
Y
K
D
T
E
G
Y
-
Y
-------
T
I
G
I
G
-----------
H
L
L
T
K
S
-----------
P
--------------------
S
L
N
A
A
-----
K
S
E
-----------
L
D
K
A
I
G
RNTNG
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
L
D
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
TGTWDAYGSK
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
EI
I
K
Q
G
C
E
F
E
N
T
V
H
K
W
I
S
I
T
E
A
L
A
F
FHCC
L
N
P
I
L
Y
AFLGAKFKTS
A
Q
H
A
L
TSGRPLEVLFQ--
39
Fugue
77.89
16%
-115
- C3 -
1U19
15
OPSD_BOVIN
A:
[4-349]
----------------------------------------------------------------MN
G
T
E
G
PNFYVPFS
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
DYYTP
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
KEAAAQQQESA
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
CGKNPLGDDEA
S
T
T
V
S
K
T
E
T
S
Q
V
A
P
A-----------------------------------------------------------------------------------------------------------------------------------------
42
Fugue
77.20
16%
-115
- C3 -
2RH1
16
ADRB2_HUMAN (first)
A:
[36-477]
----------------------------------------------------------------------------------------------------------------
D
-
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
TEGYYTIGIG
H
L
L
T
K
S
-----
P
S
L
N
A
-------
A
K
S
E
L
D
K
A
I
G
R
N
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
-
L
D
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
TGTWDAYKFCL
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
QDNLIR
K
E
V
Y
I
L
L
N
W
I
G
Y
V
N
S
G
F
N
PLIYCRS
P
D
F
R
I
A
F
Q
E
L
L
CL
31
HHSearch
75.00
19%
-116
- C3 -
2LNL
-
CXCR1_HUMAN
A:
[41-323]
-----------------------------------------------------------------------------------------------------------------------
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
RTQVI
Q
E
---
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
73.29
16%
-107
- C3 -
1U19
14
OPSD_BOVIN
A:
[42-327]
-----------------------------------------------------------------------------------------------------------------------
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
-----------
Q
QESA
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
L
G
------------------------------------------------------------------------------------------------------------------------------------------
48
Fugue
71.84
15%
-138
- C1 -
4BZF
3
GALM_BACSU
A:
[1-322]
----------------------------------------------------------------------------------
A
N
F
I
E
K
I
T
Y
L
G
-----------------
T
P
A
-
I
K
A
G
N
E
H
L
E
M
I
V
V
PEWGSN
V
I
S
L
V
D
K
T
T
N
V
Q
L
L
R
E
P
--------
E
T
A
E
S
F
-
H
D
T
PTLY
G
I
P
I
L
F
P
P
N
R
I
S
D
G
T
F
S
F
R
G
R
T
-
Y
H
F
D
I
N
E
K
D
-
K
H
N
H
L
H
G
F
L
Y
H
E
K
W
N
V
V
T
---
T
K
Q
T
D
E
G
V
I
V
E
T
E
I
D
---------------
L
S
E
L
P
H
V
Q
K
Q
F
P
H
H
A
V
V
R
---
M
T
--------
Y
T
I
K
E
N
--
T
L
F
K
H
A
T
V
M
------------------
N
K
G
K
E
A
F
P
--
W
G
I
---------------
G
Y
H
T
T
-------------
F
I
F
P
--
A
E
S
S
L
F
S
L
T
A
-------
D
-------
Q
Q
W
E
L
--
D
E
R
-------
L
L
P
T
G
K
L
M
D
V
P
Y
---------------
K
E
A
L
H
E
G
M
D
L
RHKQLD
D
V
F
L
S
S
-----------
Y
Q
K
R
G
G
-----------
E
--------------------
N
Q
A
V
I
-----
Y
H
Q
--------------
H
A
H
-----
I
S
I
I
Y
-------
K
A
D
E
Q
F
K
H
W
V
V
Y
N
------
A
D
---
G
-----
K
-
Q
G
-
Y
L
--
C
--
P
E
P
Y
-------
T
W
V
T
N
-
A
V
N
L
D
L
P
S
S
L
T
G
L
---
Q
V
L
-
E
P
G
E
E
T
T
A
------------------
K
S
S
I
T
I
E
L
N-----------------------------------------------------------------------------------------------------------------------------------------
23
HHSearch
68.13
21%
-125
- C3 -
2RH1
6
ADRB2_HUMAN (first)
A:
[42-235]
-----------------------------------------------------------------------------------------------------------------------
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
T
E
G
-------
Y
Y
T
I
G
I
G
H
L
L
T
K
S
------
P
S
---
L
----
N
A
-
A
K
-
S
E
--
L
--
D
K
A
I
-------
G
R
N
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
------------------------------------------------------------------------------------------------------------------------------------------
28
HHSearch
65.97
21%
-139
- C3 -
3PBL
1
DRD3_HUMAN (first)
A:
[41-226]
------------------------------------------------------------------------------------------------------------------------
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
L
R
L
K
-----
I
Y
K
D
T
-------
E
G
Y
Y
T
I
G
I
G
H
L
L
T
------
K
S
---
P
----
S
L
-
N
A
-
A
K
--
S
--
E
L
D
K
-------
A
I
G
R
N
-
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
------------------------------------------------------------------------------------------------------------------------------------------
26
HHSearch
65.74
18%
-151
- C3 -
3EML
8
ENLYS_BPT4
A:
[22-221]
----------------------------------------------------------------------------------------------------------------------
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
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
R
L
K
I
Y
-----
K
D
T
E
G
-------
Y
Y
T
I
G
I
G
H
L
L
T
K
S
------
P
S
---
L
----
N
A
-
A
K
-
S
E
--
L
--
D
K
A
I
-------
G
R
N
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
------------------------------------------------------------------------------------------------------------------------------------------
46
Fugue
65.02
15%
-143
* C4 *
1FSZ
1
?
?:
[23-231]
------------------------------------------------------------------------------------
S
P
E
D
K
E
L
L
E
----------------
Y
L
Q
Q
-
T
K
A
K
----------------
I
T
V
V
G
C
G
G
A
G
N
N
T
I
T
R
--------
L
K
M
E
G
I
-
E
G
-------
A
------
K
T
V
A
I
N
T
D
A
Q
Q
L
I
-
R
T
K
A
D
K
K
I
L
-
I
G
K
K
L
T
R
G
L
G
A
G
--
G
N
P
K
---
I
G
E
E
A
A
K
E
S
A
E
E
I
K
A
---------------
A
I
---------------------
Q
-----
D
S
D
M
V
F
I
T
--
C
G
L
G
G
G
T
G
T
------------------
G
S
A
P
V
V
A
E
--
I
S
K
---------------
K
I
--------------------------------------------------------
G
-------
A
L
T
V
A
V
V
T
L
P
F
V
---------------
M
E
G
-----------------
K
V
-----------
R
M
K
N
A
M
-----------
E
--------------------
G
L
E
R
L
-----
K
Q
H
-----------
T
D
T
L
V
V
-----
I
P
------------------------------------------
N
E
-
K
L
--
F
--
E
-----------
I
V
P
N
-
M
P
L
-
K
L
A
F
K
V
A
D
E
---
V
L
I
-
N
A
-
V
K
G
L
V
------------------
E
L
I
T
K
D
G
L
------------------------------------------------------------------------------------------------------------------------------------------
22
HHSearch
64.32
19%
-136
- C3 -
3RZE
2
ENLYS_BPT4 (first)
A:
[11-200]
------------------------------------------------------------------------------------------------------------------------
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
T
E
G
-------
Y
Y
T
I
G
I
G
H
L
L
T
K
S
------
P
S
---
L
----
N
A
-
A
K
-
S
E
--
L
--
D
K
A
I
-------
G
R
N
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
------------------------------------------------------------------------------------------------------------------------------------------
47
Fugue
63.94
15%
-153
- C4 -
5BMO
2
?
A:
[7-246]
------------------------------------------------------------------------------------------
T
L
L
----------------
E
L
P
D
-
D
----
F
S
R
V
L
A
I
-------
V
A
H
P
D
D
I
E
F
G
A
G
P
A
V
A
Q
--------
W
T
A
Q
G
--
R
E
-------
V
A
Y
L
L
V
T
R
----
G
E
A
G
I
S
D
L
-
E
P
A
Q
C
G
P
V
R
-
E
A
E
Q
R
K
A
A
A
E
L
G
--
V
H
E
V
---
D
F
L
D
H
Y
N
D
G
T
I
----------------------
E
Y
G
P
G
L
R
R
D
L
A
R
A
V
R
---
R
H
R
-----
P
E
L
I
V
T
F
N
HH
D
T
W
A
S
G
A
W
N
------------------
T
P
D
H
R
A
V
G
--
L
A
A
---------------
L
D
A
V
A
---------
D
A
A
N
R
W
-----
I
F
P
E
L
L
D
E
G
-------
L
-------
E
P
W
R
A
--
G
K
V
-------
A
I
A
G
S
P
----
H
A
---------------
T
H
A
V
A
V
D
-------------------------------
D
-----------
D
--------------------
S
R
D
R
A
-----
V
R
S
-----------
L
A
A
H
-----------------------------
D
R
Y
------
L
G
---
S
----
L
S
-
D
D
-
P
P
--
Q
--
E
R
A
R
-------
F
I
L
G
H
-
L
L
A
-
A
T
A
P
R
F
G
G
R
---
D
G
--------
V
A
------------------
F
Q
I
V
G
---------------------------------------------------------------------------------------------------------------------------------------------
24
HHSearch
61.64
20%
-127
- C3 -
3ODU
6
CXCR4_HUMAN (first)
A:
[49-238]
----------------------------------------------------------------------------------------------------------------------
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
T
E
-------
G
Y
Y
T
I
G
I
G
H
L
L
T
K
------
S
P
---
S
----
L
N
-
A
A
-
K
S
--
E
--
L
D
K
A
-------
I
G
R
N
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
------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
61.52
24%
-142
- C3 -
4IAR
1
C562_ECOLX
A:
[21-146]
----------------------------------------------------------------------------------------------------------------------
V
L
L
V
M
L
L
A
-------
L
I
T
L
A
T
T
L
S
N
A
F
V
I
A
T
V
--------
Y
R
T
R
K
L
-
H
T
-------
P
A
N
Y
L
I
A
S
L
A
V
T
D
L
L
V
S
I
L
V
-
M
P
I
S
T
M
Y
T
V
-
T
G
R
W
T
L
G
Q
V
V
C
D
--
F
W
L
S
---
S
D
I
T
C
C
T
A
S
I
W
H
L
C
V
---------------
I
A
L
D
R
Y
W
A
I
T
D
A
V
E
Y
S
A
K
---
R
T
P
-----
K
R
A
A
V
M
I
A
--
L
V
W
V
F
S
I
S
I
------------------
S
L
P
P
F
F
W
R
--
Q
A
S
---------------
E
C
V
V
N
---------
T
D
H
I
L
Y
T
V
--
Y
S
T
V
G
A
F
Y
F
P
-------
T
-------
L
L
L
I
A
--
L
Y
G
-------
R
I
Y
V
E
A
R
S
R
I
A
D
---------------
L
E
D
N
W
E
T
L
N
D
-------
N
L
K
V
I
-----------
E
K
A
D
N
A
-----------
A
--------------------
Q
V
K
D
A
-----
L
T
K
-----------
M
R
A
A
A
L
-----
D
A
Q
K
A
-------
T
P
P
K
L
E
D
K
S
P
D
S
P
------
E
M
---
K
----
D
F
-
R
H
-
G
F
--
D
--
I
L
V
G
-------
Q
I
D
D
A
-
L
K
L
-
A
N
E
G
K
V
K
E
A
---
Q
A
A
-
A
E
-
Q
L
K
T
T
------------------
R
N
A
Y
I
Q
K
Y
------------------------------------------------------------------------------------------------------------------------------------------
21
HHSearch
60.63
18%
-142
- C3 -
3UON
2
ACM2_HUMAN (first)
A:
[25-215]
-----------------------------------------------------------------------------------------------------------------------
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
E
G
-----------
L
R
L
K
I
Y
-----
K
D
T
E
G
-------
Y
Y
T
I
G
I
G
H
L
L
T
K
S
------
P
S
---
L
----
N
A
-
A
K
-
S
E
--
L
--
D
K
A
I
-------
G
R
N
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
------------------------------------------------------------------------------------------------------------------------------------------