@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 : OR8U1_HUMAN: (2016-01-14 )
MAHINCTQATEFILVGLTDHQELKMPLFVLFLSIYLFTVVGNLGLILLIRADTSLNTPMYFFLSNLAFVDFCYSSVITPKMLGNFLYKQNVISFDACATQLGCFLTFMISESLLLASMAYDRYVAICNPLLYMVVMTPGICIQLVAVPYSYSFLMALFHTILTFRLSYCHSNIVNHFYCDDMPLLRLTCSDTRFKQLWIFACAGIMFISSLLIVFVSYMFIISAILRMHSAEGRQKAFSTCGSHMLAVTIFYGTLIFMYLQPSSSHALDTDKMASVFYTVIIPMLNPLIYSLQNKEVKEALKKIIINKN
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---.......--------------------------------------------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
-------------------MAHI-NC--------------TQA
T
E
F
I
L
V
GLTD
H
Q
E
LK
M
P
----------------
L
F
V
L
F
L
S
I
Y
L
F
T
V
VGNL
G
L
I
L
L
I
RAD-TSLN
T
P
M
Y
F
F
L
-
S
N
L
A
F
V
D
F
C
Y
S
SVI-
T
P
-----
K
M
L
G
N
F
L
-
Y
K
QNVI
S
F
D
A
C
A
-
T
---
Q
L
G
----
C
-----
F
L
T
F
M
-
I
S
E
S
L
-
L
-
L
A
S
M
A
Y
D
R
Y
V
A
I
C
N
P
L
L
Y
M
-
V
V
---MTPG
I
C
I
Q
L
V
AVPY
S
Y
S
F
L
M
A
L
F
H
T
I
L
T
F
R
L
S
Y
C
H
S
N
I
-
V
N
H
-FYCDDM
P
L
-
L
R
L
TC-------S-D--TR
F
--
K
-
Q
-
L
W
I
F
A
C
A
G
I
M
F
I
S
S
-------
L
L
I
V
F
V
S
Y
M
F
I
I
--------
S
A
I
L
-----------
R
M
HSA--------------------E--------
G
R
Q
K
A
F
S
T
CGS
H
M
L
A
V
T
I
F
Y
G
T
L
--------------------
I
F
M
Y
LQPS--S---S--H---A---L
D
-
T
--
D
K
-----------
M
A
S
V
F
Y
-----------
T
-
V
I
I
-
P
M
L
N
P
-
L
I
Y
-SLQ
N
K
E
V
K
E
A
L
K
---
K
I
IINKN--------------------------------------------------------------------------------------------------------------------------------------------------------------
39
HHSearch
88.36
19%
-151
- C2 -
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
37
HHSearch
84.47
16%
-145
- C2 -
2KS9
1
NK1R_HUMAN
A:
[34-323]
-----------------------------------------------------------
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
LYL
K
K
F
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
47
Fugue
78.69
16%
-133
- C2 -
2RH1
16
ADRB2_HUMAN (first)
A:
[36-477]
-----------------------------------------------------
D
E
V
W
V
V
G
----------------
M
G
I
V
M
S
L
I
V
L
A
I
V
F
G
N
V
L
V
I
T
A
I
A
K
F
-
E
R
L
Q
T
V
T
N
Y
F
I
-
T
S
L
A
C
A
D
L
V
M
G
L
A
V
-
V
P
-----
F
G
A
A
H
I
L
-
M
K
M
W
T
F
G
N
F
W
C
E
-
F
---
W
T
S
----
I
-----
D
V
L
C
V
-
T
A
S
I
E
-
T
-
L
C
V
I
A
V
D
R
Y
F
A
I
T
S
P
F
K
Y
Q
-
S
L
---
L
T
K
N
K
A
R
V
I
I
L
M
V
W
I
V
S
G
L
T
S
F
L
P
I
Q
M
H
W
Y
R
A
--------
T
H
-
Q
E
A
I
N
C
Y
A
-
E
E
T
C
C
-------
D
-
F
--
F
T
N
--
Q
-
A
-
Y
A
I
A
S
S
I
V
S
F
Y
V
P
L
-------
V
I
M
V
F
V
Y
S
R
V
F
Q
--------
E
A
K
R
-----------
Q
L
N
I
F
--------------------
E
--------
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
T
E
G
Y
Y
T
I
G
--------------------
I
G
H
L
L
T
K
S
--
P
---
S
--
L
---
N
---
A
A
-
K
--
S
E
-----------
L
D
K
A
I
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
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KR
W
D
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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
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H
K
A
L
K
T
L
G
I
I
M
G
T
F
T
L
C
W
L
P
F
F
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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
45
Fugue
77.89
15%
-134
- C2 -
1F88
8
OPSD_BOVIN
A:
[1-348]
----------------------
M
-
N
G
--------------
T
E
G
P
N
F
Y
V
P
F
S
N
K
T
G
V
V
R
S
P
FEAPQYYLAE
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
YY
T
P
H
--
E
-
E
-
T
N
N
E
S
F
V
I
Y
M
F
V
V
H
-------
F
I
I
P
L
I
V
I
F
F
C
Y
--------
G
Q
L
V
-----------
F
T
V
K
E
--------------------
A
--------
A
A
S
A
T
T
Q
K
A
E
K
E
V
T
R
M
V
I
I
M
V
I
A
--------------------
F
L
I
C
W
L
P
Y
--
A
---
G
--
V
---
A
---
F
Y
-
I
--
F
T
H
QGSDFGPIFM
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
NPSTTVSKTETS
Q
V
A
P
A---------------------------------------------------------------------------------------------------------------------------------------------
46
Fugue
73.42
15%
-126
- C2 -
1U19
15
OPSD_BOVIN
A:
[4-349]
----------------------
M
-
N
G
--------------
T
E
G
P
N
F
Y
V
P
F
S
N
K
T
G
V
V
R
S
P
FEAPQYYLAE
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
QGSDFGPIFM
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
TETSQVAPA---------------------------------------------------------------------------------------------------------------------------------------
34
HHSearch
71.03
16%
-127
- C2 -
2LNL
-
CXCR1_HUMAN
A:
[38-323]
--------------------------------------------------------
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
TQV
I
QE
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
35
HHSearch
68.53
15%
-128
- C2 -
1U19
14
OPSD_BOVIN
A:
[41-325]
----------------------------------------------------------
S
M
----------------
L
A
A
Y
M
F
L
L
I
M
L
G
F
P
I
N
F
L
T
L
Y
V
T
V
Q
H
-
K
K
L
R
T
P
L
N
Y
I
L
-
L
N
L
A
V
A
D
L
F
M
V
F
G
G
-
F
T
-----
T
T
L
Y
T
S
L
-
H
G
Y
F
V
F
G
P
T
G
C
N
-
L
---
E
G
F
----
F
-----
A
T
L
G
G
-
E
I
A
L
W
-
S
-
L
V
V
L
A
I
E
R
Y
V
V
V
C
K
P
M
S
N
F
-
R
----
F
G
E
N
H
A
I
M
G
V
A
F
T
W
V
M
A
L
A
C
A
A
P
P
L
V
G
W
S
R
--
Y
-
I
-
P
E
-
G
M
Q
-
C
S
C
G
I
D
Y
Y
-
T
P
H
-----------
E
--
E
T
N
--
N
-
E
-
S
F
V
I
Y
M
F
V
V
H
F
I
I
P
-------
L
I
V
I
F
F
C
Y
G
Q
L
V
--------
F
T
V
K
-----------
E
A
A
A
Q
--------------------
Q
QESA
T
T
Q
K
A
E
K
E
V
T
R
M
V
I
I
M
V
I
A
F
L
I
C
W
L
P
Y
--------------------
A
G
V
A
F
Y
I
F
--
T
H
Q-
G
--
S
---
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
29
HHSearch
67.29
20%
-149
- C2 -
2RH1
6
ADRB2_HUMAN (first)
A:
[37-235]
------------------------------------------------------
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
31
HHSearch
66.41
18%
-170
- C2 -
3EML
8
ENLYS_BPT4
A:
[22-221]
----------------------------------------------------------
S
V
----------------
Y
I
T
V
E
L
A
I
A
V
L
A
I
L
G
N
V
L
V
C
W
A
V
W
L
N
-
S
N
L
Q
N
V
T
N
Y
F
V
-
V
S
L
A
A
A
D
I
A
V
G
V
L
A
-
I
P
-----
F
A
I
T
I
S
T
---
G
F
C
A
A
C
H
G
C
L
-
F
---
I
A
C
----
F
-----
V
L
V
L
T
-
Q
S
S
I
F
-
S
-
L
L
A
I
A
I
D
R
Y
I
A
I
R
I
P
L
R
Y
N
-
G
L
---
V
T
G
T
R
A
K
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
P
M
L
G
W
N
N
C
G
Q
--------
S
-
Q
G
C
G
E
G
Q
----
V
A
C
-------
L
-
F
--
E
D
V
VP
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
53
Fugue
65.31
19%
-106
- C1 -
4OWT
-
INT3_HUMAN
A:
[1-466]
GGRL
L
L
S
T
SLDAKD
E
L
E
E
R
L
E
R
C
M
S
I
V
T
S
M
T
AGVS
E
R
E
A
N
D
A
L
N
A
Y
V
C
K
G
L
P
Q
H
E
E
I
C
L
G
----------------
L
F
T
L
I
L
T
E
P
A
Q
A
Q
K
C
Y
R
D
L
A
L
V
S
R
D
G
M
N
I
V
L
N
K
I
N
Q
I
L
M
E
K
--
Y
L
K
L
Q
D
T
C
R
T
-
Q
L
-----
V
W
L
V
R
E
L
-
V
K
S
G
V
L
G
A
D
G
V
C
M
T
F
M
K
Q
I
A
GGDV
T
-----
A
K
N
I
W
-
L
A
E
S
V
-
L
-
D
I
L
T
E
Q
R
E
W
V
-
L
K
S
S
I
L
I
A
M
A
V
---
Y
T
---
Y
L
R
L
I
V
D
H
H
G
T
A
Q
L
Q
A
L
R
Q
K
E
V
D
F
C
I
S
L
L
R
E
R
F
M
E
C
L
M
I
G
R
D
L
V
R
L
-
L
Q
N
V
A
-------
R
-
I
--
P
E
F
--
E
-
L
-
L
W
K
D
I
I
H
N
P
Q
A
L
S
P
QFTG
I
L
Q
L
L
Q
S
R
T
S
R
K
F
L
A
C
R
L
T
P
D
M
E
T
K
L
L
F
M
T
S
RVRFGQQ
K
R
Y
Q
D
--------------------
W
--------
F
Q
R
Q
Y
L
S
T
P
D
S
Q
S
L
R
C
D
L
I
R
Y
I
C
GV
V
H
P
S
N
E
V
L
S
SDILP
R
W
A
I
I
G
W
L
L
T
T
C
--
T
---
S
--
N
---
V
---
A
A
-
S
--
N
A
-----------
K
L
A
L
F
Y
DWLFFSPDKDS
I
M
N
I
E
-
P
A
I
L
V
M
H
H
S
M
K
P
H
P
A
I
T
A
T
L
L
D
F
M
C
R
I
I
P
N
F
Y
PPL
E
G
H
V
R
Q
G
V
F
S
S
L
N
H
I
V
E
K
RVLAHL
A
P
L
F
D
NPKLD
K
E
L
R
A
M
L
R
E
K
FPEFCS---------------------------------------------------------------------------------------------------------
28
HHSearch
65.21
20%
-153
- C2 -
3RZE
2
ENLYS_BPT4 (first)
A:
[10-200]
-----------------------------------------------------------
P
----------------
L
V
V
V
L
S
T
I
C
L
V
T
V
G
L
N
L
L
V
L
Y
A
V
R
S
E
-
R
K
L
H
T
V
G
N
L
Y
I
-
V
S
L
S
V
A
D
L
I
V
G
A
V
V
-
M
P
-----
M
N
I
L
Y
L
L
-
M
S
K
W
S
L
G
R
P
L
C
L
-
F
---
W
L
S
----
M
-----
D
Y
V
A
S
-
T
A
S
I
F
-
S
-
V
F
I
L
C
I
D
R
Y
R
S
V
Q
Q
P
L
R
Y
L
-
K
Y
---
R
T
K
T
R
A
S
A
T
I
L
G
A
W
F
L
S
F
L
W
V
I
P
I
L
G
W
--
N
-
H
-------
R
R
E
-
D
K
-----------
C
-------
E
-
T
--
D
F
Y
--
D
-
V
T
W
F
K
V
M
T
A
I
I
N
F
Y
L
P
-------
T
L
L
M
L
W
F
Y
A
K
I
Y
--------
K
A
V
R
-----------
Q
H
C
N
I
--------------------
F
--------
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
T
E
G
Y
Y
T
I
--------------------
G
I
G
H
L
L
T
K
--
S
---
P
--
S
---
L
---
N
A
-
A
--
K
S
-----------
E
L
D
K
A
I
-----------
G
-
R
N
T
-
N
G
V
I
T
-
K
D
E
-
A
E
K
L
F
N
Q
D
V
D
A
A
---
V
R
G
I
L
R
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
60.56
25%
-157
- C2 -
4EIY
18
AA2AR_HUMAN (first)
A:
[39-162]
---------------------------------------------------------------------------------
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
P
K
E
G
K
-
N
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
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
--
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
27
HHSearch
59.72
20%
-153
- C2 -
3UON
2
ACM2_HUMAN (first)
A:
[24-215]
----------------------------------------------------------
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
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
59.53
22%
-165
- C2 -
2Y00
9
ADRB1_MELGA
A:
[8-157]
------------------------------------------------------
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
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
58.99
22%
-158
- C2 -
2Y01
9
ADRB1_MELGA
A:
[8-157]
------------------------------------------------------
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
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
57.16
25%
-153
- C2 -
3PWH
1
?
A:
[14-137]
---------------------------------------------------------------------------------
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
G
W
N
N
C
G
Q
P
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
Q
-----------
P
L
P
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
A
P
-----------
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
56.82
25%
-155
- C2 -
3UZA
1
AA2AR_HUMAN
A:
[14-137]
---------------------------------------------------------------------------------
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
G
W
N
N
C
G
Q
P
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
Q
-----------
P
L
P
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
A
P
-----------
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
56.75
14%
-148
- C2 -
3PBL
1
DRD3_HUMAN (first)
A:
[41-226]
----------------------------------------------------------------------------
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
56.71
25%
-147
- C2 -
4IAQ
1
5HT1B_HUMAN (first)
A:
[20-153]
---------------------------------------------------------
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
M
A
A
R
E
R
--------------------------------------------------------------------------------------------------------------------------------------------------------------
32
HHSearch
56.64
17%
-143
- C2 -
3ODU
6
CXCR4_HUMAN (first)
A:
[47-239]
--------------------------------------------------------
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------