@TOME V2.3
(Nov 2016)
Ref.
-
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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 : OR1D5_HUMAN: (2016-01-12 )
MDGDNQSENSQFLLLGISESPEQQRILFWMFLSMYLVTVLGNVLIILAISSDSHLHTPMYFFLANLSFTDLFFVTNTIPKMLVNFQSQNKAISYAGCLTQLYFLVSLVTLDNLILAVMAYDRYVATCCPLHYVTAMSPGLCVLLLSLCWGLSVLYGLLLTFLLTRVTFCGPREIHYLFCDMYILLWLACSNTHIIHTALIATGCFIFLTPLGFMTTSYVRIVRTILQMPSASKKYKTFSTCASHLGVVSLFYGTLAMVYLQPLHTYSMKDSVATVMYAVLTPMMNPFIYRLRNKDMHGAPGRVLWRPFQRPK
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)
MDGDNQSE------NS
Q
F
L
L
L
GISESP
E
Q
Q
-------
R
I
L
F
W
M
F
L
S
M
Y
L
V
T
V
LG
N
V
L
I
I
L
A
ISSDSHLH
T
P
M
Y
F
F
L
ANLS
F
T
D
L
F
F
V
T
NT-
I
P
K
M
L
V
N
FQSQ---NKA
I
S
Y
A
G
C
L
T
Q
L
Y
F
L
V
S
L
--
V
T
L
D
N
L
I
L
A
V
M
A
YD
R
Y
V
A
T
CC
P
L
H
Y
V
TAMSP
G
L
C
V
L
L
L
S
L
C
W
G
L
S
V
L
Y
G
L
L
L
T
F
L
L
------------
T
R
V
TF------CGP
R
E
I
H
Y
L
F
-----
C
D
M
Y
I
L
L
W
L
ACSN
T
H
I
I
H
T
A
L
I
AT
G
C
F
I
F
L
T
P
L
G
F
M
T
T
S
Y
V
R
I
---
V
----
R
T
----
I
L
QMPS----A-----------S--------------------KK--------
Y
K
T
F
S
T
C
-----
A
S
H
L
G
V
V
S
L
F
Y
G
T
L
A
M
V
Y
L
QPLH-----TY---S-------
M
K
D
S
V
A
--------
T
---
V
M
Y
A
V
L
-----
T
P
M
M
N
P
F
I
Y
R
LRNKDMHGAPGR
V
L
W-------------RPFQRPK---------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
91.29
23%
-160
- C4 -
3VG9
8
?
A:
[14-294]
--------------------------------------------
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
GWNNCGQ-------
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
K
Q
M
E
S
Q
PLP
G
-----------
E
--------------------
R
A
--------
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
91.11
23%
-168
- C4 -
3UZA
1
AA2AR_HUMAN
A:
[14-294]
--------------------------------------------
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
L
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
--
A
Q
S
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
--
L
T
P
M
L
GWNNCGQP--------
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
A
A
A
R
R
Q
----
L
K
Q
M
E
S
QPLP
G
-----------
E
--------------------
R
A
--------
R
S
T
L
Q
K
E
-----
V
H
A
A
K
S
A
A
I
I
A
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
AP
L
W
L
M
Y
L
A
---
I
V
L
A
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
90.78
23%
-166
- C4 -
3RFM
1
AA2AR_HUMAN
A:
[14-294]
--------------------------------------------
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
L
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
--
A
Q
S
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
--
L
T
P
M
L
GWNNCGQP--------
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
A
A
A
R
R
Q
----
L
K
Q
M
E
S
QPLP
G
-----------
E
--------------------
R
A
--------
R
S
T
L
Q
K
E
-----
V
H
A
A
K
S
A
A
I
I
A
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
AP
L
W
L
M
Y
L
A
---
I
V
L
A
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
90.32
23%
-159
- C4 -
4UHR
1
AA2AR_HUMAN
A:
[14-294]
--------------------------------------------
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
A
A
A
A
D
I
L
V
G
V
L
A
-
I
P
F
A
I
A
--
I
S
T
---
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
L
--
T
A
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
GWNNCGQPKEGK
A
---
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
K
Q
M
E
S
QPLP
G
-----------
E
--------------------
R
A
--------
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
-
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
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
90.10
23%
-167
- C4 -
3REY
1
AA2AR_HUMAN
A:
[14-294]
--------------------------------------------
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
L
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
--
A
Q
S
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
--
L
T
P
M
L
GWNNCGQP--------
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
A
A
A
R
R
Q
----
L
K
Q
M
E
S
QPLP
G
-----------
E
--------------------
R
A
--------
R
S
T
L
Q
K
E
-----
V
H
A
A
K
S
A
A
I
I
A
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
AP
L
W
L
M
Y
L
A
---
I
V
L
A
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
89.98
23%
-160
- C4 -
2YDV
6
?
A:
[14-294]
--------------------------------------------
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
A
A
A
A
D
I
L
V
G
V
L
A
-
I
P
F
A
I
A
--
I
S
T
---
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
L
--
T
A
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
GWNNCGQPK
E
G
K
A
H
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
K
Q
M
E
S
Q-----------------------------------------------
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
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
89.81
23%
-169
- C4 -
3PWH
1
?
A:
[14-294]
--------------------------------------------
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
L
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
--
A
Q
S
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
--
L
T
P
M
L
GWNNCGQP--------
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
A
A
A
R
R
Q
----
L
K
Q
M
E
S
QPLP
G
-----------
E
--------------------
R
A
--------
R
S
T
L
Q
K
E
-----
V
H
A
A
K
S
A
A
I
I
A
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
AP
L
W
L
M
Y
L
A
---
I
V
L
A
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
89.73
23%
-166
- C4 -
3UZC
1
AA2AR_HUMAN
A:
[14-294]
--------------------------------------------
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
L
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
--
A
Q
S
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
V
T
G
T
R
A
A
G
I
I
A
I
C
W
V
L
S
F
A
I
G
--
L
T
P
M
L
GWNNCGQP--------
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
A
A
A
R
R
Q
----
L
K
Q
M
E
S
QPLP
G
-----------
E
--------------------
R
A
--------
R
S
T
L
Q
K
E
-----
V
H
A
A
K
S
A
A
I
I
A
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
AP
L
W
L
M
Y
L
A
---
I
V
L
A
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
89.54
23%
-159
- C4 -
3VGA
1
AA2AR_HUMAN
A:
[14-294]
--------------------------------------------
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
GWNNCGQ-------
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
K
Q
M
E
S
Q
PLP
G
-----------
E
--------------------
R
A
--------
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
87.89
24%
-150
- C4 -
2YCW
7
ADRB1_MELGA
A:
[23-297]
------------------------------------------------
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
KR
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
-------------
F
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
87.06
24%
-151
- C4 -
2YCX
3
ADRB1_MELGA
A:
[23-294]
------------------------------------------------
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
87.01
24%
-150
- C4 -
2YCZ
2
ADRB1_MELGA
A:
[23-297]
------------------------------------------------
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
-------------
F
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
86.40
23%
-160
- C4 -
2YDO
3
?
A:
[14-294]
--------------------------------------------
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
A
A
A
A
D
I
L
V
G
V
L
A
-
I
P
F
A
I
A
--
I
S
T
---
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
L
--
T
A
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
GWNNCGQPK
E
G
K
A
H
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
K
Q
M
E
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
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
85.25
24%
-146
- C4 -
2YCY
6
ADRB1_MELGA
A:
[23-297]
------------------------------------------------
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
--
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
-------------
F
---------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
85.07
24%
-146
- C4 -
2VT4
8
ADRB1_MELGA
A:
[23-297]
------------------------------------------------
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
-------------------------------------------
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
84.58
23%
-164
- C4 -
4UG2
3
?
A:
[14-294]
--------------------------------------------
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
A
A
A
A
D
I
L
V
G
V
L
A
-
I
P
F
A
I
A
--
I
S
T
---
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
L
--
T
A
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
GWNNCGQPK
E
G
K
A
H
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
-------------------------------------------
A
--------
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
36
HHSearch
83.86
18%
-147
- C4 -
2Z73
5
OPSD_TODPA
A:
[33-333]
----------------------------
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------
46
Fugue
81.80
17%
-129
- C4 -
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
EETC
C
D
F
F
T
------
N
Q
A
Y
A
I
A
S
S
I
V
S
-----
F
Y
V
P
L
V
I
M
V
F
V
Y
S
R
V
---
F
----
Q
E
----
A
K
R
Q
L
N
----
I
-----------
F
--------------------
E
M
--------
L
R
I
D
E
G
-------
L
R
L
K
I
Y
K
D
T
E
G
Y
Y
T
I
G
I
G
H
L
L
T
-----
K
S
---
P
-------
S
L
N
A
A
K
--------
S
---
E
L
D
K
A
I
-----
G
R
N
T
N
G
V
I
T
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
-------------
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYKFCL
K
E
H
K
A
L
K
T
L
G
I
I
M
G
T
F
T
L
C
W
L
P
F
F
I
V
N
I
V
H
V
I
QDNLIR
K
E
V
Y
I
L
L
N
W
I
G
Y
V
N
S
G
F
N
PLIYCRS
P
D
F
R
I
A
F
Q
E
L
L
CL
31
HHSearch
81.73
18%
-149
- C4 -
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
LYLKKFI
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------
42
Fugue
80.56
18%
-122
- C4 -
1F88
8
OPSD_BOVIN
A:
[1-348]
M
N
G
T
E
G
P
N
FYVPFS
N
K
T
G
V
V
R
S
P
F
E
A
P
Q
Y
Y
LAE
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
VFT
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
CGKNPSTTVSKTE
T
S
Q
V
A
P
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------