@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 : OR9Q2_HUMAN: (2016-01-14 )
MAERNYTVVTEFFLTAFTEHLQWRVPLFLIFLSFYLATMLGNTGMILLIRGDRRLHTPMYFFLSHLSLVDICYSSAIIPQMLAVLWEHGTTISQARCAAQFFLFTFFASIDCYLLAIMAYDRYTAVCQPLLYVTIITEKARWGLVTGAYVAGFFSAFVRTVTAFTLSFCGNNEINFIFCDLPPLLKLSCGDSYTQEVVIIVFALFVMPACILVILVSYLFIIVAILQIHSAGGRAKTFSTCASHLTAVALFFGTLIFMYLRDNTGQSSEGDRVVSVLYTVVTPMLNPLIYSLRNKEVKEATRKALSKSKPARRP
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)
------------MAER
N
Y
T
V
V
T
E
F
F
L
--
T
A
F
T
-------------
E
H
LQWR
V
P
L
F
L
I
F
L
S
F
Y
L
A
T
M
LG---NT
G
M
I
L
L
I
RGDRRLH
T
P
M
Y
F
F
L
S
H
L
S
L
V
D
I
C
Y
SS
A
I
-
I
P
----
Q
M
L
A
V
L
W
-EHGT
T
I
S
Q
A
R
C
A
A
Q
F
F
L
F
T
F
F
A
S
I
D
C
-------
Y
L
L
A
I
M
AYD
R
Y
T
A
V
C
Q
P
L
L
Y
V
T
I
---
I
TE-KARWGL
V
T
G
A
Y
V
A
G
F
F
S
A
F
V
R
T
V
T
A
F
T
L
S
FCGNN
E
I
N
F
I
F
CDLPP
L
-
L
K
LSCG-D
S
Y
-
T
------
Q
-
E
V
V
I
I
V
F
A
L
F
V
M
P
A
C
I
L
V
I
L
V
S
Y
L
F
I
I
V
A
I
-----------
L
Q
I
HSA-----------G--------------------GRA
K
T
F
S
T
C
A
S
H
L
T
A
V
A
L
F
F
G
T
L
------
I
F
M
Y
L
RDNT------G--Q---S----SE---G
D
R
V
-
V
S
V
L
Y
T
V
V
T
P
M
L
N
P
L
I
Y
S
L
R
N
K
E
V
K
E
A
T
R
K
A
L
----------------SKSKPARRP----------------------------------------------------------------------------------------------------------------------------------------------------------
34
HHSearch
87.90
16%
-153
- C1 -
2Z73
5
OPSD_TODPA
A:
[33-334]
-------------------------------------------------
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
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
F
----------------------------------------------------------------------------------------------------------------------------------------------------------
42
Fugue
80.92
18%
-140
- C1 -
1F88
8
OPSD_BOVIN
A:
[1-348]
---------------
M
N
G
T
E
G
P
N
F
Y
V
--
P
F
S
N
KTGVVRSPFEAPQ
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
Y
-
T
PHEETN
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
CGKNPSTTVS-----
K
T
E
T
S
Q
V
A
P
A---------------------------------------------------------------------------------------------------------------------------------------------------------
43
Fugue
78.52
17%
-123
- C1 -
1U19
15
OPSD_BOVIN
A:
[4-349]
MN
G
T
E
G
PNFYVP
F
S
N
K
T
G
V
V
R
S
P
F
E
A
PQ
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
Y
-
T
PHEETN
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
PA--------------------------------------------------------------------------------------------------------------------------------------------------------
31
HHSearch
78.36
15%
-149
- C1 -
2KS9
1
NK1R_HUMAN
A:
[34-324]
----------------------------------------------------
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
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
FI
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
----------------------------------------------------------------------------------------------------------------------------------------------------------
30
HHSearch
75.38
16%
-135
- C1 -
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
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------
50
Fugue
71.53
13%
-132
- C1 -
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
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
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
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
33
HHSearch
71.29
15%
-129
- C1 -
1U19
14
OPSD_BOVIN
A:
[41-328]
---------------------------------------------------
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
-----------
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
D
----------------------------------------------------------------------------------------------------------------------------------------------------------
24
HHSearch
66.47
19%
-172
- C1 -
3RZE
2
ENLYS_BPT4 (first)
A:
[10-200]
----------------------------------------------------
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
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
P
----------------------------------------------------------------------------------------------------------------------------------------------------------
25
HHSearch
65.46
18%
-163
- C1 -
2RH1
6
ADRB2_HUMAN (first)
A:
[41-235]
---------------------------------------------------
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
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
P
----------------------------------------------------------------------------------------------------------------------------------------------------------
23
HHSearch
62.91
20%
-168
- C1 -
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
P
----------------------------------------------------------------------------------------------------------------------------------------------------------
28
HHSearch
62.53
17%
-178
- C1 -
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
P
----------------------------------------------------------------------------------------------------------------------------------------------------------
29
HHSearch
61.75
19%
-183
- C1 -
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
L
----------------------------------------------------------------------------------------------------------------------------------------------------------
26
HHSearch
61.31
18%
-160
- C1 -
3ODU
6
CXCR4_HUMAN (first)
A:
[48-239]
--------------------------------------------------
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
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
----------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
56.14
22%
-160
- C1 -
3RZE
2
ENLYS_BPT4 (first)
A:
[9-138]
---------------------------------------------------
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
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
P
V
Y
D
S
L
D
A
V
R
----------------
R
A
A
L
I
N
M
V
F
----------------------------------------------------------------------------------------------------------------------------------------------------------
35
HHSearch
54.72
17%
-166
- C1 -
3V2Y
1
ENLYS_BPT4
A:
[63-249]
--------------------------------------------------
I
K
L
T
S
V
V
F
I
L
I
C
C
F
I
I
L
E
---
N
I
F
V
L
L
T
I
W
K
T
K
K
F
H
R
P
M
Y
Y
F
I
G
N
L
A
L
S
D
L
L
A
G
V
A
Y
-
T
A
----
N
L
L
L
S
G
A
--
T
T
Y
K
L
T
P
A
Q
W
F
L
R
E
G
S
M
F
V
A
L
S
A
S
V
-------
F
S
L
L
A
I
A
I
E
R
Y
I
T
M
L
K
-----------
N
N
-
F
R
L
F
L
L
I
S
A
C
W
V
I
S
L
I
L
G
G
L
P
I
M
G
W
N
C
-------
I
S
A
L
S
S
C
S
T
V
L
P
----------
L
-
Y
------
H
-
K
H
Y
-
I
L
F
C
T
T
V
F
T
L
L
L
L
S
I
V
I
L
Y
C
R
I
Y
S
L
V
-----------
R
T
R
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
P
V
----------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
54.41
26%
-148
- C1 -
4LDO
3
A:
[174-300]
-----------------------------
A
Y
A
-------------
A
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
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
54.11
26%
-152
- C1 -
4LDL
3
ADRB2_HUMAN
A:
[174-300]
-----------------------------
A
Y
A
-------------
A
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
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
54.02
27%
-163
- C1 -
4IAR
1
C562_ECOLX
A:
[17-135]
-----------------------------------------------
L
P
W
K
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
L
----------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
53.92
27%
-157
- C1 -
4IAQ
1
5HT1B_HUMAN (first)
A:
[17-135]
-----------------------------------------------
L
P
W
K
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
-----------
N
A
A
Q
V
K
-----------
D
--------------------
A
L
T
K
M
R
A
A
A
L
D
A
Q
K
A
T
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
L
L
M
A
----------------
A
R
E
R
K
A
T
K
T
----------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
53.45
26%
-150
- C1 -
4LDE
3
A:
[174-300]
-----------------------------
A
Y
A
-------------
A
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
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------