@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 : OR4DB_HUMAN: (2016-01-13 )
MELGNVTRVKEFIFLGLTQSQDQSLVLFLFLCLVYMTTLLGNLLIMVTVTCESRLHTPMYFLLRNLAILDICFSSTTAPKVLLDLLSKKKTISYTSCMTQIFLFHLLGGADIFSLSVMAFDCYMAISKPLHYVTIMSRGQCTALISASWMGGFVHSIVQISLLLPLPFCGPNVLDTFYCDVPQVLKLTCTDTFALEFLMISNNGLVTTLWFIFLLVSYTVILMTLRSQAGGGRRKAISTCTSHITVVTLHFVPCIYVYARPFTALPTEKAISVTFTVISPLLNPLIYTLRNQEMKSAMRRLKRRLVPSERE
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)
MELG
N
V
T
R
V
K
E
F
I
F
LGLTQ---------------S----------------QD
Q
S
L
V
L
F
L
F
L
C
L
V
Y
M
T
T
L
LGN
L
L
I
M
V
T
V
TCESRLH
T
P
M
Y
F
L
L
R
N
L
A
I
L
D
I
CFSSTT-
A
P
K
V
L
L
D
L
L
-SKKKT
I
S
Y
T
S
C
M
T
Q
I
F
--
L
F
H
LLGGA
D
I
F
S
L
S
V
M
A
F
D
C
Y
M
A
ISKP
L
H
Y
V
T
I
---MSRG
Q
C
T
A
L
I
S
A
S
W
M
G
G
F
V
H
S
I
V
Q
I
S
L
-
L
L---PLP-----F-CG
P
N
V
L
D
T
F
YCDV
P
Q
V
L
K
L
TCT-------D
T
F
--
A
L
E
F
L
M
ISNN
G
L
V
T
T
L
W
F
I
F
L
L
V
S
------------
Y
T
V
I
L
M
T
L
R
SQAG------------G---------------------G-R
R
K
A
I
S
TCTS
H
I
T
V
V
T
L
HF
V
P
C
I
Y
V
YARPFT-------A---L--------PTE
K
---------
A
---------
I
S
V
T
F
--
T
V
I
S
P
L
L
N
P
L
I
Y
T
L
R
N
Q
E
M
K
S
A
M
R
R
L
-----------
K
R
RLVPSERE---------------------------------------------------------------------------------------------------------------------------------------------------------
31
HHSearch
88.15
18%
-133
- 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
PGDSSDRYH
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
DLYLKKFI
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
---------------------------------------------------------------------------------------------------------------------------------------------------------
39
Fugue
85.62
19%
-119
- C1 -
1F88
8
OPSD_BOVIN
A:
[1-348]
---
M
N
G
T
E
G
P
N
F
Y
V
P
F
S
N
K
---------------
T
GVVRSPFEAPQYYLAE
P
W
Q
F
S
M
L
A
A
Y
M
F
L
L
I
M
L
G
F
P
I
N
F
L
T
L
Y
V
T
V
Q
H
K
K
L
R
T
P
L
N
Y
I
L
L
N
L
A
V
A
D
L
F
M
V
F
G
G
-
F
T
T
T
L
Y
T
S
L
-
H
G
Y
F
V
F
G
P
T
G
C
N
L
E
G
F
--
F
A
T
L
G
G
E
I
A
L
W
S
L
V
V
L
A
I
E
R
Y
V
V
V
C
K
P
M
S
N
F
R
----
F
G
E
N
H
A
I
M
G
V
A
F
T
W
V
M
A
L
A
C
A
------------------------
A
P
P
L
V
G
W
S
R
Y
I
P
E
G
M
Q
C
S
C
G
I
DYYTPH
E
E
T
--
N
N
E
S
F
V
I
Y
M
F
V
V
H
F
I
I
P
L
I
V
I
F
F
C
------------
Y
G
Q
L
V
F
T
V
K
E
A
A
A
------------
S
---------------------
A
T
T
Q
K
A
E
K
E
V
T
R
M
V
I
I
M
V
I
A
F
L
I
C
W
L
P
Y
A
G
V
A
F
-------
Y
---
I
--------
F
T
H
Q
GSDFGPIFM
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---------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
83.34
18%
-130
- C1 -
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
PLE
W
VT------
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
81.63
16%
-114
- 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
YRA
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
GR
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
40
Fugue
79.61
18%
-102
- C1 -
1U19
15
OPSD_BOVIN
A:
[4-349]
--
M
N
G
T
E
G
P
N
F
Y
V
P
F
S
N
K
T
GVVRSPFEAPQYYLA
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
Q
GSDFGPIFM
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
CGKNPLGDD
E
A
S
T
T
V
S
K
T
E
TSQVAPA--------------------------------------------------------------------------------------------------------------------------------------------------
29
HHSearch
78.07
18%
-119
- C1 -
1U19
14
OPSD_BOVIN
A:
[40-327]
------------------------------------------------------
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
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
QQESA
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
SD-
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
---------------------------------------------------------------------------------------------------------------------------------------------------------
28
HHSearch
75.51
18%
-117
- C1 -
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
RTQVIQ
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
72.19
19%
-103
- C1 -
2X72
5
GNAT1_BOVIN (first)
A:
[58-318]
------------------------------------------------------------------------
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
Q
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
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
Q
---------
G
S
C
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
71.66
18%
-103
- C1 -
4BEZ
3
OPSD_BOVIN
A:
[58-318]
------------------------------------------------------------------------
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
D
-
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
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
Q
---------
G
S
C
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------
24
HHSearch
67.22
19%
-143
- C1 -
3EML
8
ENLYS_BPT4
A:
[22-219]
-------------------------------------------------------
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
VV
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
---------------------------------------------------------------------------------------------------------------------------------------------------------
23
HHSearch
65.20
20%
-141
- C1 -
2RH1
6
ADRB2_HUMAN (first)
A:
[40-233]
------------------------------------------------------
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
---------------------------------------------------------------------------------------------------------------------------------------------------------
27
HHSearch
63.41
23%
-142
- C1 -
3PBL
1
DRD3_HUMAN (first)
A:
[41-224]
---------------------------------------------------------
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
---------------------------------------------------------------------------------------------------------------------------------------------------------
21
HHSearch
61.37
19%
-144
- C1 -
3UON
2
ACM2_HUMAN (first)
A:
[25-213]
--------------------------------------------------------
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
---------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
60.20
25%
-133
- C1 -
4IAQ
1
5HT1B_HUMAN (first)
A:
[9-156]
-----------
Y
I
Y
Q
D
-
S
I
---------------
S
----------------
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
---------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
59.53
25%
-135
- C1 -
4IAR
1
C562_ECOLX
A:
[9-156]
-----------
Y
I
Y
Q
D
-
S
I
---------------
S
----------------
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
---------------------------------------------------------------------------------------------------------------------------------------------------------
22
HHSearch
59.03
21%
-133
- C1 -
3RZE
2
ENLYS_BPT4 (first)
A:
[10-198]
--------------------------------------------------------
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
---------------------------------------------------------------------------------------------------------------------------------------------------------
25
HHSearch
57.50
16%
-134
- C1 -
3ODU
6
CXCR4_HUMAN (first)
A:
[47-236]
-----------------------------------------------------
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
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
---------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
56.94
24%
-144
- C1 -
3RZE
2
ENLYS_BPT4 (first)
A:
[9-147]
-------------------------------------------------------
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
---------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
55.02
26%
-150
- C1 -
2YCW
4
ADRB1_MELGA
A:
[7-136]
----------------------------------
S
----------------
Q
Q
W
E
A
G
M
S
L
L
M
A
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
C
C
D
F
V
T
N
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
R
L
L
A
---------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
55.01
26%
-138
- C1 -
4GPO
-
ADRB1_MELGA
A:
[7-136]
----------------------------------
S
----------------
Q
Q
W
E
A
G
M
S
L
L
M
A
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
C
C
D
F
V
T
N
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
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------