@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 : GP161_HUMAN: (2016-01-10 )
MSLNSSLSCRKELSNLTEEEGGEGGVIITQFIAIIVITIFVCLGNLVIVVTLYKKSYLLTLSNKFVFSLTLSNFLLSVLVLPFVVTSSIRREWIFGVVWCNFSALLYLLISSASMLTLGVIAIDRYYAVLYPMVYPMKITGNRAVMALVYIWLHSLIGCLPPLFGWSSVEFDEFKWMCVAAWHREPGYTAFWQIWCALFPFLVMLVCYGFIFRVARVKARKVHCGTVVIVEEDAQRTGRKNSSTSTSSSGSRRNAFQGVVYSANQCKALITILVVLGAFMVTWGPYMVVIASEALWGKSSVSPSLETWATWLSFASAVCHPLIYGLWNKTVRKELLGMCFGDRYYREPFVQRQRTSRLFSISNRITDLGLSPHLTALMAGGQPLGHSSSTGDTGFSCSQDSGTDMMLLEDYTSDDNPPSHCTCPPKRRSSVTFEDEVEQIKEAAKNSILHVKAEVHKSLDSYAASLAKAIEAEAKINLFGEEALPGVLVTARTVPGGGFGGRRGSRTLVSQRLQLQSIEEGDVLAAEQR
Atome Classification :
(20 SA)
.........10---------.........20........30........40........50........60........70........80.........-90-........100.......110.......120.......130......---.140.......150-...-....160..-...------..170-..-----.....-------.180.------..----.-.---------..190.....-----..200.......210.......220------.....--..230.--------------------------.----------------.----.-----.------------------------..--------240------.-----------------------------------------------------------------.---------------------------------------------------------.------------------------------------------------------------------------------.--------.-----------------.------------..-----.-------250-----------------..------------......260.......270.......280.......290......-.300...--------....310.......320.........330...--....340.......350.......360.......370.......380.......390.......400.......410.......420.......430.......440.......450.......460.......470.......480.......490.......500.......510.......520.......
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MSLNS
S
L
S
C
R
----------
K
E
L
S
N
L
T
E
EEGGEGG
V
I
I
T
Q
F
I
A
I
I
V
I
T
I
F
V
C
LGN
L
V
I
V
V
T
L
YK
K
S
Y
L
L
T
LSN
K
F
V
F
S
L
T
L
S
N
F
L
L
S
V
L
V
-
L
P
F
V
V
T
S
S
I
-
R
R
-
E
W
I
F
G
V
V
W
C
N
F
S
A
L
L
Y
L
L
ISSAS
M
L
T
L
G
V
I
A
I
D
R
Y
Y
A
V
L
Y
PMV
Y
P
M
K
---ITGN
R
A
V
M
A
L
V
Y
I
W
-
L
H
S
-
L
I
G
CLPPLF-GWS------SVEF--DE-----
F
K
W
M
C
-------
V
A
A
WH------RE----P-G---------
Y
T
A
F
W
Q
I
W
C
A
-----
L
F
P
F
L
V
M
L
V
C
Y
G
F
I
F
R
V
A
R
V
K
A
R
K
V
------HC
G
T
V
--
V
I
V
EE
D
--------------------------
A
----------------
Q
----R-----T------------------------GR--------K--------N-----------------------------------------------------------------S---------------------------------------------------------S------------------------------------------------------------------------------T--------S-----------------T------------SS-----S-------GS------------------RR------------N
A
F
Q
G
V
VYS
A
N
Q
C
K
A
L
I
T
I
L
V
V
L
G
A
F
M
VTWG
P
Y
M
V
V
I
ASEALWGK-SSVSP
S
L
--------
E
T
W
A
T
W
L
S
F
A
S
A
V
C
H
--
P
L
I
Y
G
L
W
N
K
T
V
R
K
E
L
--
L
G
M
C
FG
D
R
Y
Y
R
E
P
F
V
Q
R
Q
R
T
S
R
L
F
S
I
S
N
R
I
T
DLGL
S
P
H
L
T
A
L
MAGGQPLGHSSSTGDTGFSCSQDSGT
D
M
M
L
L
EDYTSDDNPPSHCTCPPKRRSSVT
F
E
D
E
V
E
Q
I
K
E
A
AKNS
I
L
H
V
K
A
E
V
H
K
S
L
D
S
Y
A
A
S
L
A
K
A
I
EAE
A
K
I
N
L
FGEEALP
G
V
L
V
T
A
R
TVPGGGFGGRRG
S
R
T
L
V
S
Q
R
L
Q
LQSIEEG
D
V
LAAEQR
31
HHSearch
81.03
24%
-150
- 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
L
RL
K
I
Y
K
D
-------------------
T
EG
Y
Y
T
I
G
IGHL-----
L
----
T
-----
K
SPS
L
N
A
A
K
S
E
L
D
K
A
I
---------
G
R
--------
N
--------
T
-----------------------------------------------------------------
N
---------------------------------------------------------
G
VIT
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
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
78.24
23%
-144
- C3 -
3EML
13
ENLYS_BPT4
A:
[21-469]
------------------------------------
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
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
GEGQVAC
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
TEGYYTIGIGHLLTKSPS
L
N
A
A
----------------
K
----
S
E
L
D
K
A
I
G-----------------------
R
N
--------
T
--------
N
GVIT
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
29
HHSearch
78.09
21%
-153
- C3 -
2RH1
16
ADRB2_HUMAN (first)
A:
[37-477]
---------------------------------
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
TEGYYTIGIGHLLTKSPS
L
N
A
A
----------------
K
S
---
E
L
D
K
A
I
G
------------------------
R
N
--------
T
NGVIT
K
D
E
A
-----------------------------------------------------------------
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
K----------------------------------------------------------------------------
R
W
D
E
A
A
V
N
L
A
-----------------
K
S
R
W
Y
N
-------
Q
T
P
----
N
R
A
K
R
V
I
T
T
F
------------------
R
T
------------
G
T
W
D
A
Y
K
F
C
L
K
E
H
K
A
L
K
T
L
G
I
I
M
G
T
F
T
L
C
W
L
P
F
F
I
V
N
I
V
H
V
I
Q
D
N
--
L
I
R
K
E
V
--------
Y
I
L
L
N
W
I
G
Y
V
N
S
G
F
N
--
P
L
I
Y
C
-
R
S
P
D
F
R
I
A
F
--
Q
E
L
L
C
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
25
HHSearch
75.42
22%
-138
* C3 *
3UON
4
ACM2_HUMAN (first)
A:
[23-457]
------------------------------------
V
V
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
VR
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
TEG
Y
Y
T
I
GIGHL
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
NAKL
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
---
R
M
L
----------------------------------------------------------------------------
Q
--------
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
------------
T
P
-----
N
-------
R
A
K
R
V
I
T
T
F
-----------
R
T
------------
G
T
W
D
A
Y
P
P
P
S
R
E
K
K
V
T
R
T
I
L
A
I
L
L
A
F
I
I
T
W
A
P
Y
N
V
M
V
L
I
N
T
F
C
A
P
--
C
I
P
N
T
V
--------
W
T
I
G
Y
W
L
C
Y
I
N
S
T
I
N
--
P
A
C
Y
A
L
C
N
A
T
F
K
K
T
F
--
K
H
L
L
M
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
27
HHSearch
73.44
19%
-148
- C3 -
3RZE
5
ENLYS_BPT4 (first)
A:
[9-443]
-------------------------------------
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
TEG
Y
Y
T
I
G
IGHLL--------
T
----------------
K
SPS
L
N
-----
A
A
K
S
E
L
D
K
A
I
G--------------
R
N
TNGVIT
K
D
E
--------
A
-----------------------------------------------------------------
E
---------------------------------------------------------
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKL
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
----------------------------
N
--------
S
-----------------
L
------------
R
M
-----
L
-------
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
T
G
T
W
D
A
Y
L
H
M
N
R
E
R
K
A
A
K
Q
L
G
F
I
M
A
A
F
I
L
C
W
I
P
Y
F
I
F
F
M
V
I
A
F
C
K
N
--
C
C
N
E
H
L
--------
H
M
F
T
I
W
L
G
Y
I
N
S
T
L
N
--
P
L
I
Y
P
L
C
N
E
N
F
K
K
T
F
--
K
R
I
L
H
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
72.87
25%
-166
- C3 -
2Y00
13
ADRB1_MELGA
A:
[20-285]
---------------------------------------------
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
-
H
W
W
------
R
D
E
---
D
P
-----
Q
A
L
K
C
-----------
Y
------
Q
D
----
P
-
G
CCDFVTN
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
71.97
25%
-166
- C3 -
2Y01
12
ADRB1_MELGA
A:
[20-285]
---------------------------------------------
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
-
H
W
W
------
R
D
E
---
D
P
-----
Q
A
L
K
C
-----------
Y
------
Q
D
----
P
-
G
CCDFVTN
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
71.87
25%
-165
- C3 -
4AMJ
12
ADRB1_MELGA
A:
[20-285]
---------------------------------------------
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
-
H
W
W
------
R
D
E
---
D
P
-----
Q
A
L
K
C
-----------
Y
------
Q
D
----
P
-
G
CCDFVTN
R
A
Y
A
I
A
S
S
I
I
S
F
-----
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
E
A
K
E
Q
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
------------------------------------------------------------------------------
R
----------------------------------------------------------------------------------------------
V
M
L
M
R
E
H
K
A
L
K
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
N
-
V
F
N
R
-
D
L
V
P
D
W
L
--------
F
V
A
F
N
W
L
G
Y
A
N
S
A
M
N
--
P
I
I
Y
C
R
S
P
D
F
R
K
A
F
K
--
R
L
L
A
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
71.75
25%
-166
- C3 -
3ZPQ
11
ADRB1_MELGA
A:
[20-285]
---------------------------------------------
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
-
H
W
W
------
R
D
E
---
D
P
-----
Q
A
L
K
C
-----------
Y
------
Q
D
----
P
-
G
CCDFVTN
R
A
Y
A
I
A
S
S
I
I
S
F
-----
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
E
A
K
E
Q
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
------------------------------------------------------------------------------
R
----------------------------------------------------------------------------------------------
V
M
L
M
R
E
H
K
A
L
K
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
N
-
V
F
N
R
-
D
L
V
P
D
W
L
--------
F
V
A
F
N
W
L
G
Y
A
N
S
A
M
N
--
P
I
I
Y
C
R
S
P
D
F
R
K
A
F
K
--
R
L
L
A
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
71.73
25%
-165
- C3 -
2Y02
13
ADRB1_MELGA
A:
[20-285]
---------------------------------------------
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
-
H
W
W
------
R
D
E
---
D
P
-----
Q
A
L
K
C
-----------
Y
------
Q
D
----
P
-
G
CCDFVTN
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
52
Fugue
71.69
23%
-147
- 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
--
K
N
-----
K
T
I
T
C
-------
Y
D
T
T
S
------
D
E
----
Y
-
L
---------
R
S
Y
F
I
Y
S
M
C
T
T
V
A
MF
C
V
P
L
V
L
I
L
G
C
Y
G
L
I
V
R
A
L
I
Y
K
M
K
K
Y
------
T
C
T
V
C
G
Y
I
Y
N
P
E
D
--------------------------
G
----------------
D
----
P
-----
D
------------------------
N
G
--------
V
--------
N
-----------------------------------------------------------------
P
---------------------------------------------------------
G
------------------------------------------------------------------------------
T
--------
D
-----------------
F
------------
K
D
IVCPL
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
71.66
25%
-167
- C3 -
2Y04
13
ADRB1_MELGA
A:
[20-285]
---------------------------------------------
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
-
H
W
W
------
R
D
E
---
D
P
-----
Q
A
L
K
C
-----------
Y
------
Q
D
----
P
-
G
CCDFVTN
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
71.59
25%
-168
- C3 -
2VT4
8
ADRB1_MELGA
A:
[20-283]
---------------------------------------------
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
-
H
W
W
------
R
D
E
---
D
P
-----
Q
A
L
K
C
-----------
Y
------
Q
D
----
P
-
G
CCDFVTN
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
71.44
24%
-164
- C3 -
3SN6
1
R:
[187-475]
-----------------------------------------
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
-----
Q
E
AINC-
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
I
DKSEGR---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
30
HHSearch
71.23
22%
-140
- C3 -
2Z73
5
OPSD_TODPA
A:
[29-335]
-------------------------------
V
P
D
A
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
--
R
L
N
A
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
------------
E
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
L
-
E
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
D
D
K
E
T
E
D
D
K
D
A
E
T
E
I
P
A
G
E
------------------------------------------------------------------------------------------------------------------------------------------------------------------
49
Fugue
70.96
18%
-118
- C3 -
1F88
8
OPSD_BOVIN
A:
[1-348]
M
N
G
T
E
G
P
N
F
Y
VPFSNKTGVV
R
S
P
F
E
A
P
Q
Y
Y
L
A
E
P
W
Q
F
S
M
L
A
A
Y
M
F
L
L
I
M
L
G
F
P
I
N
F
L
T
L
Y
V
T
V
Q
H
K
K
L
R
T
P
L
N
Y
I
L
L
N
L
A
V
A
D
L
F
M
V
F
G
G
-
F
T
T
T
L
Y
T
S
L
-
H
G
-
Y
F
V
F
G
P
T
G
C
N
L
E
G
F
F
A
T
L
G
G
E
I
A
L
W
S
L
V
V
L
A
I
E
R
Y
V
V
V
C
K
P
M
S
-
N
F
R
---
F
G
E
N
H
A
I
M
G
V
A
F
T
W
-
V
M
A
-
L
A
C
A
A
P
P
L
V
-
G
W
S
------
R
Y
I
P
--
E
G
-----
M
Q
C
S
C
-------
G
I
D
Y
Y
TPHEET
N
N
----
E
-
S
---------
F
V
I
Y
M
F
V
V
H
F
-----
I
I
P
L
I
V
I
F
F
C
Y
G
Q
L
V
F
T
V
K
E
A
A
A
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
-----------------
A
------------
T
T
-----
Q
-------
K
A
------------------
E
K
------------
E
V
T
R
M
V
I
-------------
I
M
V
I
A
F
L
I
C
W
L
P
Y
A
G
V
A
F
Y
I
F
T
H
Q
G
-
S
D
F
G
P
I
F
--------
M
T
I
P
A
F
F
A
K
T
S
A
V
Y
N
--
P
V
I
Y
I
M
M
N
K
Q
F
R
N
C
M
--
V
T
T
L
C
C
G
K
N
P
S
T
T
V
S
K
T
E
T
S
Q
V
A
P
A
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
70.88
25%
-165
- C3 -
3ZPR
11
ADRB1_MELGA
A:
[20-285]
---------------------------------------------
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
-
H
W
W
------
R
D
E
---
D
P
-----
Q
A
L
K
C
-----------
Y
------
Q
D
----
P
-
G
CCDFVTN
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
70.88
25%
-167
- C3 -
2Y03
9
ADRB1_MELGA
A:
[20-285]
---------------------------------------------
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
-
H
W
W
------
R
D
E
---
D
P
-----
Q
A
L
K
C
-----------
Y
------
Q
D
----
P
-
G
CCDFVTN
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
69.74
25%
-158
- C3 -
2YCX
3
ADRB1_MELGA
A:
[20-283]
---------------------------------------------
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
-
H
W
W
------
R
D
E
---
D
P
-----
Q
A
L
K
C
-----------
Y
------
Q
D
----
P
-
G
CCDFVTN
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
69.63
25%
-138
- C3 -
4MQS
1
?
A:
[56-333]
----------------------------------------------------
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
GVR
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
-----
P
-------
P
S
------------------
R
E
------------
K
------------
K
V
T
R
T
I
L
A
I
L
L
A
F
I
I
T
W
A
P
Y
N
V
M
V
L
I
N
T
F
-
C
A
-
P
C
I
P
N
T
V
--------
W
T
I
G
Y
W
L
C
Y
I
N
S
T
I
N
--
P
A
C
Y
A
L
C
N
A
T
F
K
K
T
F
K
H
L
L
M
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------