@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 : OR1G1_HUMAN: (2016-01-12 )
MEGKNLTSISECFLLGFSEQLEEQKPLFGSFLFMYLVTVAGNLLIILVIITDTQLHTPMYFFLANLSLADACFVSTTVPKMLANIQIQSQAISYSGCLLQLYFFMLFVMLEAFLLAVMAYDCYVAICHPLHYILIMSPGLCIFLVSASWIMNALHSLLHTLLMNSLSFCANHEIPHFFCDINPLLSLSCTDPFTNELVIFITGGLTGLICVLCLIISYTNVFSTILKIPSAQGKRKAFSTCSSHLSVVSLFFGTSFCVDFSSPSTHSAQKDTVASVMYTVVTPMLNPFIYSLRNQEIKSSLRKLIWVRKIHSP
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)
-----------------------------------MEGKNLT--------
S
I
S
E
C
F
L
LG
F
S
--
E
Q
L
E
EQK
P
L
F
G
S
F
L
F
M
Y
L
V
T
VA---G---
N
L
L
I
I
L
V
I
I
TDTQLH--
T
P
M
Y
F
F
L
ANLSLA
D
A
C
F
V
S
T
T
-
V
P
K
M
--
L
A
N
I
Q
I
Q
SQAISY
S
G
C
L
L
Q
L
Y
F
F
M
L
F
V
M
L
E
A
F
L
L
A
V
M
----
A
Y
D
C
Y
V
A
I
C
HP
L
H
Y
I
L
I
MS---------P
G
L
C
I
F
L
V
S
----------
A
S
W
I
M
N
A
L
H
S
L
L
H
T
L
L
M
N
S
L
S
F
C
ANHEI
P
H
F
--
F
CDINP
L
-
L
S
LSC-------T-------DPFTN
E
L
V
I
F
I
TG
G
----------------
L
T
G
L
I
C
V
L
C
L
I
I
S
Y
T
N
V
F
S
T
----
I
L
KIPS-A-----------Q--------------------G--
K
-----
R
K
A
F
S
T
C
S
S
H
L
S
V
V
S
L
F
-------FG
T
S
F
C
V
DFSSPST---H----------S------A-----------
Q
--------
K
D
T
V
A
S
V
M
Y
T
V
------
V
T
P
M
L
N
-----
P
F
I
Y
S
L
R
N
Q
E
I
K
S
S
L
R
K
L
I
W
---
V
R
K-------------------IHSP----------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
90.43
22%
-149
- C3 -
4GBR
1
ADRB2_HUMAN
A:
[17-286]
--------------------------------------------------------------------------------
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
-----------
I
--------------------
D
--
K
FC
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
39
Fugue
90.12
18%
-126
- C3 -
1F88
8
OPSD_BOVIN
A:
[1-348]
-------------------------MN
G
T
E
G
PNFY
V
P
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
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
QGSDFGP
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---------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
89.56
23%
-145
- C3 -
4LDO
3
A:
[194-463]
--------------------------------------------------------------------------------
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
88.78
23%
-146
- C3 -
4LDL
3
ADRB2_HUMAN
A:
[194-463]
--------------------------------------------------------------------------------
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
87.87
23%
-146
- C3 -
4QKX
2
ADRB2_HUMAN
A:
[194-463]
--------------------------------------------------------------------------------
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
C
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
87.65
23%
-146
- C3 -
4LDE
3
A:
[194-463]
--------------------------------------------------------------------------------
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
81.84
16%
-142
- C3 -
2Z73
5
OPSD_TODPA
A:
[33-332]
-------------------------------------------------------------------
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------
40
Fugue
81.05
15%
-118
- C3 -
1U19
15
OPSD_BOVIN
A:
[4-349]
--------------------------------MN
G
T
E
G
P
N
F
Y
VPFSNKTG
V
V
R
S
P
F
E
A
P
Q
Y
YL
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
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
QGSDFG
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
NPLGDDEA
S
T
T
V
S
K
TETSQ
V
A
P
A
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------
31
HHSearch
80.55
17%
-133
- C3 -
1U19
14
OPSD_BOVIN
A:
[41-326]
---------------------------------------------------------------------
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
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
---
C
G
K
-------------------
N
P
L
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------
30
HHSearch
79.71
16%
-136
- C3 -
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
LYLKKF
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------
28
HHSearch
73.62
17%
-115
- C3 -
2LNL
-
CXCR1_HUMAN
A:
[36-323]
-----------------------------------------------------------------
T
L
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
---
R
TQVIQE
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
72.76
24%
-156
- C3 -
3SN6
1
R:
[194-388]
--------------------------------------------------------------------------------
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
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
AKRQ
L
Q
K
I
D
K
-
S
-----------
E
--------------------
G
--
R
-----
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
72.35
23%
-168
- C3 -
2RH1
6
ADRB2_HUMAN (first)
A:
[36-231]
-------------------------------------------------------------------
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------
42
Fugue
71.07
16%
-133
- 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
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
SN
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
GVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAK
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
KRW
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
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
18
PsiBlast_PDB
69.76
23%
-164
- C3 -
3P0G
1
ENLYS_BPT4
A:
[34-232]
----------------------------------------------------------------
Q
Q
R
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
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
R
R
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
69.07
23%
-170
- C3 -
3NY9
4
ADRB2_HUMAN (first)
A:
[40-232]
----------------------------------------------------------------------
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
W
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
HHSearch
68.52
22%
-162
- C3 -
2RH1
6
ADRB2_HUMAN (first)
A:
[41-236]
---------------------------------------------------------------------
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
68.14
23%
-168
- C3 -
3PDS
4
ADRB2_HUMAN (first)
A:
[5-200]
-------------------------------------------------------------------
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
C
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
68.06
23%
-172
- C3 -
3NY8
7
ENLYS_BPT4
A:
[40-232]
----------------------------------------------------------------------
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
W
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------
45
Fugue
67.89
16%
-134
- C2 -
4KPP
4
?
A:
[2-396]
DF
T
K
E
K
F
Q
L
L
A
I
S
S
L
T
L
P
W
L
I
S
L
A
F
N
Y
H
H
P
A
L
T
Q
T
L
L
S
G
L
A
V
--------
V
S
A
S
F
L
I
S
W
A
A
--
E
T
A
E
M
D
V
P
R
S
F
S
L
A
I
V
A
L
L
A
V
L
---
P
---
E
Y
A
V
D
G
Y
F
A
W
K
A
G
S
V
GG
E
Y
V
H
Y
A
T
A
N
M
T
G
A
N
R
L
L
I
G
I
G
-
W
S
L
V
A
F
I
A
F
R
T
L
K
S
K
E
V
E
L
D
D
G
I
R
L
E
I
F
F
L
F
L
A
T
L
Y
A
F
T
L
P
L
K
GHIS
P
F
D
A
L
V
F
V
S
L
Y
A
I
Y
I
Y
L
S
T
K
AER
E
E
V
E
V
G
G
V
P
A
Y
L
C
S
LK
T
E
T
R
R
L
S
V
V
V
L
F
L
F
A
G
F
T
I
L
M
S
V
E
A
F
S
E
G
L
L
E
T
A
R
I
A
G
I
D
E
F
L
A
V
Q
W
I
-
A
P
L
A
S
-------
E
-------
S
P
E
L
I
V
A
I
Y
F
V
R
R
F
R
V
S
A
S
M
N
A
L
I
S
S
K
V
N
Q
W
T
L
L
I
G
T
I
A
I
I
Y
S
I
S
A
F
K
L
Q
----
S
L
P
L
D
A
-
R
-----------
Q
--------------------
S
--
E
-----
E
V
L
L
T
A
A
Q
S
L
F
A
V
A
I
L
L
DLKIS
W
K
E
A
S
A
L
F
L
L
F
I
V
Q
L
L
---
F
----------
P
G
V
----
E
-----------
V
--------
R
Y
I
I
S
A
I
Y
I
I
L
------
S
L
P
I
L
F
-----
A
-----
K
R
K
E
I
V
E
S
F
R
T
V
K
R
---
L
I
S
-------------------
L
E
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------