@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 : O10D3_HUMAN: (2016-01-11 )
MEVKNCCMVTEFILLGIPHTEGLEMTLFVLFLPFYACTLLGNVSILVAVMSSARLHTPMYFFLGNLSVFDMGFSSVTCPKMLLYLMGLSRLISYKDCVCQLFFFHFLGSIECFLFTVMAYDRFTAICYPLRYTVIMNPRICVALAVGTWLLGCIHSSILTSLTFTLPYCGPNEVDHFFCDIPALLPLACADTSLAQRVSFTNVGLISLVCFLLILLSYTRITISILSIRTTEGRRRAFSTCSAHLIAILCAYGPIITVYLQPTPNPMLGTVVQILMNLVGPMLNPLIYTLRNKEVKTALKTILHRTGHVPES
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)
------------------------M-EV
K
N
C
C
M
V
T
E
F
I
LLGIPHTE-GL
E
----------------
M
T
L
F
V
L
F
L
P
F
Y
--
A
C
T
----
L
LG
N
V
S
I
-
L
V
A
V
M
S
S-ARLHT
P
-
M
-
Y
F
F
LGN
L
S
V
F
---DMGFSSV
T
-
C
P
K
-
M
L
L
Y
L
M
-
G
L
S
R
L
-
I
S
Y
K
D
-------
C
V
C
Q
L
F
----
F
F
H
F
LG
S
I
E
C
F
L
F
T
-------
V
M
A
Y
D
R
F
T
A
I
C
Y
P
L
R
Y
T
V
--------
I
---MNP
R
I
C
V
A
L
A
V
G
T
W
L
L
G
C
I
H
S
-
S
I
L
T
S
L
T
F
TLP-----Y-----CGP
N
E
V
D
H
F
F
CD
I
P
A
L
L
PLACA
D
T
S
-
L
-
A
-
Q
-
R
VSFTN
V
G
L
I
S
L
V
C
F
----
L
---
L
I
-----
L
L
-
S
Y
T
R
I
T
I
S
I
L
S
-------
I
RTT-----------E--------------------G
R
R
R
A
F
--
S
T
C
S
A
H
L
I
A
I
L
CAYG
P
I
I
T
V
Y
LQ----P--T-----P--N--
P
-----
M
L
G
-------
T
V
---------
V
Q
I
L
M
N
L
V
G
P
M
L
N
P
------
L
I
-----
Y
T
LR
N
K
E
V
K
T
A
L
K
-
T
-
I
L
H
------------------RTGHVPES---------------------------------------------------------------------------------------------------------------------------------------------
30
HHSearch
85.27
16%
-148
* C2 *
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
-----
L
--
Y
L-
K
KFI--
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
---------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
83.57
17%
-149
- C2 -
2Z73
5
OPSD_TODPA
A:
[34-332]
-------------------------------------------------
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
LE
W
V-
T
-----
P
Y
A
-------
A
Q
---------
L
P
V
M
F
A
K
A
S
A
I
H
N
P
------
M
I
-----
Y
S
V
S
H
P
K
F
R
E
A
I
S
-
Q
-
T
F
P
------------------
W
V
L
T
C
C
Q
F
---------------------------------------------------------------------------------------------------------------------------------------------
31
HHSearch
81.68
16%
-136
- C2 -
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
DF
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
---------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
80.38
23%
-144
- C2 -
3RZE
4
ENLYS_BPT4 (first)
A:
[26-287]
-----------------------------------------------------------------------------------------
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
HCN
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
---------------------------------------------------------------------------------------------------------------------------------------------
39
Fugue
80.24
16%
-124
- C2 -
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
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
GMQC
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
Q
E
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
QGS
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
---------------------------------------------------------------------------------------------------------------------------------------------
29
HHSearch
79.53
16%
-140
- C2 -
2LNL
-
CXCR1_HUMAN
A:
[39-323]
-------------------------------------------------
K
----------------
Y
V
V
I
I
A
Y
A
L
V
F
--
L
L
S
----
L
L
G
N
S
L
V
-
M
L
V
I
L
Y
S
-
R
V
G
R
S
V
-
T
-
D
V
Y
L
L
N
L
A
L
A
---
D
L
L
F
A
L
T
--
L
P
I
-
W
A
A
S
K
V
--
N
G
W
I
-
F
G
T
F
L
-------
C
K
V
V
S
L
----
L
K
E
V
N
F
Y
S
G
I
L
L
L
A
-------
C
I
S
V
D
R
Y
L
A
I
V
H
A
T
R
T
L
T
------------
Q
K
R
H
L
V
K
F
V
C
L
G
C
W
G
L
S
M
N
L
S
-
L
P
F
F
L
F
R
Q
A
-------
Y
------
H
-
P
N
N
S
S
P
V
C
Y
E
V
L
G
N
-----
D
T
A
K
W
-
R
-
M
-
V
L
R
I
L
P
H
T
F
G
F
I
V
P
L
----
F
---
V
M
-----
L
F
-
C
Y
G
F
T
L
R
T
L
F
K
-------
A
H
M
------------
G
--------------------
Q
K
H
R
A
M
--
R
V
I
F
A
V
V
L
I
F
L
L
C
W
L
P
Y
N
L
V
L
L
A
D
T
L
M
R
T-
Q
VI---
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
--------------------------------------------------------------------------------------------------------------------------------------------------
40
Fugue
79.40
14%
-137
- C2 -
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
SPFEAPQYYLAE
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
GMQC
S
C
G
I
D
----
Y
Y
T
P
H
E
E
T
N
N
E
S
F
V
I
Y
M
-
F
-
V
-
V
-
H
--
F
I
I
P
L
I
V
I
F
F
C
Y
----
G
---
Q
L
-----
V
F
-
T
V
K
E
A
A
A
S
A
T
T
-------
Q
K
A
E
-----------
K
--------------------
E
V
T
R
M
V
--
I
I
M
V
I
A
F
L
I
C
W
L
P
Y
A
G
V
A
F
Y
I
F
T
----
H
QG
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
VSKTETS
Q
V
A
P
A---------------------------------------------------------------------------------------------------------------------------------
42
Fugue
68.15
12%
-122
- C2 -
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
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
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
47
Fugue
66.33
14%
-155
- C1 -
4GQA
-
?
A:
[25-412]
A
R
L
N
I
G
L
I
G
SG
F
M
G
Q
A
H
A
D
A
Y
R
R
A
A
M
F
Y
P
D
L
P
K
R
P
H
L
Y
A
L
A
D
Q
D
Q
A
M
A
E
R
----------------
H
A
A
K
L
G
A
E
K
A
Y
GD
W
R
E
----
L
V
N
D
P
Q
V
D
V
V
D
I
T
S
P
-
N
H
L
H
Y
T
M
A
M
A
A
I
A
A
G
K
H
V
Y
C
E
K
P
L
A
V
N
E
Q
Q
-
A
Q
E
M
A
Q
A
A
R
R
-
A
G
V
K
T
M
V
A
F
N
N
IKT
P
A
A
L
L
A
K
Q
I
I
----
A
R
G
D
I
G
E
P
V
R
F
R
G
T
-------
F
D
Q
-
G
F
Y
N
D
P
N
L
P
W
S
W
R
C
SKTLGGSG
A
---
L
G
D
L
G
A
H
T
L
S
V
A
Q
F
L
L
G
G
I
R
E
-
V
T
A
S
A
Q
T
C
L
R
Q
-----
R
P
----
V
P
D
A
E
W
R
E
V
E
N
D
D
Q
V
Q
C
L
V
N
F
D
S
G
A
-
A
-
G
-
V
I
E
A
S
R
I
A
A
G
R
I
F
G
V
F
W
----
E
---
V
S
G
TE
G
T
L
Y
M
D
G
E
R
F
N
E
L
Q
V
Y
-------
R
F
N
D
-----------
D
--------------------
K
H
D
R
G
F
--
K
T
L
Y
A
---------
G
S
Q
I
P
A
Y
A
G
----
F
--
F
-----
G
--
F
--
D
-----
F
G
G
GGLG
Y
F
D
V
K
---------
V
I
E
V
H
D
L
V
Q
G
I
C
G
D
DDCYPN
F
E
-----
F
G
L
Q
N
Q
R
V
L
S
A
I
E
A
S
M
V
S
R
------------------
R
W
V
N
V
V
K
D
---------------------------------------------------------------------------------------------------------------------------------------------
26
HHSearch
63.88
20%
-164
- C2 -
3EML
8
ENLYS_BPT4
A:
[22-222]
------------------------------------------------------------------
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
---------------------------------------------------------------------------------------------------------------------------------------------
22
HHSearch
60.66
20%
-158
- C2 -
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
---------------------------------------------------------------------------------------------------------------------------------------------
23
HHSearch
60.62
15%
-151
- C2 -
2RH1
6
ADRB2_HUMAN (first)
A:
[40-236]
-------------------------------------------------
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
---------------------------------------------------------------------------------------------------------------------------------------------
25
HHSearch
59.97
14%
-160
- C2 -
3ODU
6
CXCR4_HUMAN (first)
A:
[48-240]
-------------------------------------------------
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
---------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
59.32
23%
-139
- C2 -
2R4S
-
ADRB2_HUMAN
A:
[37-203]
-----------------------------------------------
G
I
V
----------------
M
S
L
I
V
L
A
I
V
F
------------
G
N
V
L
V
-
I
T
A
I
A
-
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
-------------------------------------
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
-
S
I
V
S
F
Y
V
P
L
V
I
-----
M
-----
V
F
V
Y
S
R
V
F
Q
E
A
K
R
Q
L
Q
K
I
D
K
S
E
G
R
F
-
H
-
V
-
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
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
R
R
S
S
L
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
HHSearch
58.74
17%
-153
- C2 -
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
---------------------------------------------------------------------------------------------------------------------------------------------
27
HHSearch
58.32
18%
-168
- C2 -
3PBL
1
DRD3_HUMAN (first)
A:
[41-227]
--------------------------------------------------------------------
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
---------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
57.05
23%
-160
- C2 -
4LDE
3
A:
[186-314]
-----------------------------------------------
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
56.43
23%
-157
- C2 -
4LDL
3
ADRB2_HUMAN
A:
[186-314]
-----------------------------------------------
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
56.20
23%
-157
- C2 -
4LDO
3
A:
[186-314]
-----------------------------------------------
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
54.99
21%
-168
- C2 -
4DKL
8
ENLYS_BPT4 (first)
A:
[14-144]
------------------------------------------------------------------
M
V
T
A
I
T
I
M
A
L
Y
--
S
I
V
C
V
V
G
L
F
G
N
F
L
V
-
M
Y
V
I
V
R
Y
-
T
K
M
K
T
A
-
T
-
N
I
Y
I
F
N
L
A
L
A
---
D
A
L
A
T
S
T
L
-
P
F
Q
-
S
V
N
Y
L
M
-
G
T
----
W
P
F
G
N
-------
I
L
C
K
I
V
I
S
I
D
Y
Y
N
M
F
T
S
I
--
F
T
L
C
-------
T
M
S
V
D
R
Y
I
A
V
C
H
P
V
K
A
L
D
--------
F
---
R
T
P
R
N
A
K
I
V
N
V
C
N
W
I
L
S
S
A
I
G
-
L
P
V
M
F
M
A
T
T
K
Y
-----
R
-----
Q
G
S
I
D
C
T
L
T
F
S
H
P
T
W
Y
W
E
N
L
L
K
I
C
V
-
F
-
I
-
F
-
A
F
I
M
P
V
L
I
I
T
V
C
Y
G
L
----
M
---
I
L
-----
R
L
-
K
S
V
R
N
I
F
E
M
L
R
-------
I
D
E
G
-----------
L
--------------------
R
L
K
I
Y
K
--
N
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
---------------------------------------------------------------------------------------------------------------------------------------------