@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 : OR5DG_HUMAN: (2016-01-13 )
MFLTERNTTSEATFTLLGFSDYLELQIPLFFVFLAVYGFSVVGNLGMIVIIKINPKLHTPMYFFLNHLSFVDFCYSSIIAPMMLVNLVVEDRTISFSGCLVQFFFFCTFVVTELILFAVMAYDHFVAICNPLLYTVAISQKLCAMLVVVLYAWGVACSLTLACSALKLSFHGFNTINHFFCELSSLISLSYPDSYLSQLLLFTVATFNEISTLLIILTSYAFIIVTTLKMPSASGHRKVFSTCASHLTAITIFHGTILFLYCVPNSKNSRHTVKVASVFYTVVIPLLNPLIYSLRNKDVKDAIRKIINTKYFHIKHRHWYPFNFVIEQ
Atome Classification :
(20 SA)
--------.........10..------....--..20..---....--..30........40........50........60........70........-80.......-.90.-------.......100....------...110-------........120.......130.....---..140.......150.......160.......170.......180.......190.....--....200.......210.......220------.....---..230------------------------------------------------------------------------------------------------------------------------------------------------------------------.-------------------------------------------------------------------------------------------------------------------------------------------------------------------......240----..-----------..----....250.......260.....------------.------------.------270.----.-----------....--.280-------...---....290...-....300.......310....--.----..320......-----------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
--------MFLTERNTTSE
A
T
------
F
T
L
L--GFS
D
Y
L
---
E
L
Q
I
--
P
L
F
F
V
F
L
A
V
Y
G
F
S
V
VGNL
G
M
I
V
I
I
K
INPKLH
T
P
M
Y
F
F
L
N
H
L
S
F
V
D
F
C
Y
S
S
I
I
-
A
P
M
M
L
V
N
L
V-VEDR-------TI
S
F
S
G
C
L
V
Q
F
F
F
F
------
C
T
F
V
V
--------
T
E
L
I
L
F
A
V
M
A
Y
D
H
F
V
A
I
C
N
P
L
L
Y
T
V
A
---
I
S
Q
K
L
C
A
M
L
V
V
V
L
Y
A
WG
V
A
C
S
L
T
L
A
C
S
A
L
K
L
S
FHG
F
N
T
I
N
H
F
F
C
E
L
S
S
L
ISLS--Y
P
D
S
Y
--
L
S
Q
L
L
L
F
T
V
A
T
F
N
E
I
S
T
L
L
I
I
L
TS
Y
A
F
------
I
I
V
T
T
---LKMPS------------------------------------------------------------------------------------------------------------------------------------------------------------------A-------------------------------------------------------------------------------------------------------------------------------------------------------------------SG
H
R
K
V
F
S
-----
T
C
-----------
A
S
----
H
L
T
A
I
T
I
FHG
T
I
L
F
L
Y
C
VPNSK------------N------------S------
R
H
T
V
----
K
-----------
V
A
S
V
--
F
Y
T
V
-------
V
I
P
---
L
L
N
P
L
I
Y
S
LR-NK
D
V
K
D
A
I
R
K
I
INTK
Y
F
H
I
K
H
--
R
----
H
W
Y
P
F
N
F
V
IEQ-----------------------------
31
HHSearch
83.70
17%
-166
- C1 -
2KS9
1
NK1R_HUMAN
A:
[33-326]
---------------------------------------------
V
--
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
------------
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
G
--
D
----
Y
E
G
L
E
M
K
S
T
R
Y
-----------------------------
21
HHSearch
82.87
17%
-168
- C1 -
3UON
4
ACM2_HUMAN (first)
A:
[24-457]
---------------------------------------------
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
EGLRL
K
I
Y
K
D
TEG
Y
Y
T
I
GIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKL
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYPP-
P
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
R
E
K
K
V
T
R
-----
T
I
-----------
L
A
----
I
L
L
A
F
I
I
T
W
A
P
Y
N
V
M
V
L
I
N
T
F
C
------------
A
PC----------
I
------
P
N
T
V
----
W
-----------
T
I
G
Y
--
W
L
C
Y
-------
I
N
S
---
T
I
N
P
A
C
Y
A
L
C
-
N
A
T
F
K
K
T
F
K
H
L
L
M
-------------------------------------------------------
40
Fugue
81.69
14%
-133
- C1 -
1U19
15
OPSD_BOVIN
A:
[4-349]
MN
G
T
E
G
PN
F
Y
V
P
F
S
N
K
T
G
V
V
R
SPFEAP
Q
Y
Y
L
--
A
E
P
W
Q
F
---
S
M
L
A
--
A
Y
M
F
L
L
I
M
---
L
G
F
P
I
N
F
L
T
L
Y
V
T
V
Q
H
K
K
L
R
T
P
L
N
Y
I
L
L
N
L
A
V
A
D
L
F
M
V
F
G
G
-
F
T
T
T
L
Y
T
S
L
-
H
G
Y
F
-------
V
F
G
P
T
G
C
N
L
E
G
F
F
A
------
T
L
G
G
E
--------
I
A
L
W
S
L
V
V
L
A
I
E
R
Y
V
V
V
C
K
P
M
-
S
N
F
R
---
F
G
E
N
H
A
I
M
G
V
A
F
T
W
V
M
A
L
A
C
A
A
P
P
L
V
G
W
S
R
Y
I
P
E
G
M
----
Q
C
S
C
G
I
D
Y
Y
---
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
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
N
P
L
G
D
--
D
----
E
A
S
T
T
V
S
K
T
E
T
SQVAPA-----------------------
42
Fugue
81.31
19%
-132
* C3 *
4IC4
-
A:
[26-397]
--------
K
S
V
T
R
R
N
D
I
P
E
A
A
------
A
S
P
P
--
S
L
L
S
F
L
---
R
K
N
V
GK
D
L
S
S
I
A
M
P
V
T
S
N
E
P
I
S
I
L
Q
L
I
S
E
T
F
E
Y
A
P
L
L
T
K
A
T
Q
R
P
D
P
I
T
F
V
S
A
F
A
I
S
F
L
-
S
I
Y
R
D
K
T
R
T
-
L
R
K
P
FNPLLA
E
T
F
E
L
I
R
E
D
M
G
F
R
L
I
------
S
E
K
V
S
--------
H
R
P
P
V
F
A
F
F
A
E
H
----
L
D
W
E
C
S
Y
T
V
T
---
P
S
Q
K
F
----------
W
G
K
S
I
E
L
N
N
E
-
G
I
L
R
L
K
F
K
T
T
G
E
L
F
E
W
T
Q
P
T
T
I
L
K
N
L
I
--
A
G
E
R
Y
--
M
E
P
V
N
E
F
E
V
H
S
S
K
G
D
K
S
H
I
L
F
D
K
A
G
M
F
SGRSE
G
F
K
V
S
I
---
I
P
P
P
S
------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
R
K
K
E
T
L
A
G
K
WT
Q
S
L
-----------
A
N
----
E
T
T
H
E
T
I
W
E
V
G
D
L
----
V
S
N
P
K
------------
K
------------
K
------
Y
G
F
T
----
K
-----------
F
T
A
N
--
L
N
E
I
TEIEKGN
L
P
P
TDS
R
L
R
P
D
I
R
A
Y
E
-
E
G
N
V
D
K
A
E
E
W
K
L
K
L
E
Q
L
Q
R
E
R
--
R
N
K
GQ
D
V
E
P
K
Y
F
E
K
V
S
KN
E
W
K
Y
I
T
G
PKS
Y
W
E
R
R
K
K
HDWSDISQLW
39
Fugue
80.74
13%
-134
- C1 -
1F88
8
OPSD_BOVIN
A:
[1-348]
MN
G
T
E
G
PN
F
Y
V
P
F
S
N
K
T
G
V
V
R
------
S
P
F
E
--
A
P
Q
Y
Y
L
AE
P
W
Q
F
S
--
M
L
A
A
Y
M
F
L
L
I
M
L
G
F
P
I
N
F
L
T
L
Y
V
T
V
Q
H
K
K
L
R
T
P
L
N
Y
I
L
L
N
L
A
V
A
D
L
F
M
V
F
G
G
-
F
T
T
T
L
Y
T
S
L
-
H
G
Y
F
-------
V
F
G
P
T
G
C
N
L
E
G
F
F
A
------
T
L
G
G
E
--------
I
A
L
W
S
L
V
V
L
A
I
E
R
Y
V
V
V
C
K
P
M
-
S
N
F
R
---
F
G
E
N
H
A
I
M
G
V
A
F
T
W
V
M
A
L
A
C
A
A
P
P
L
V
G
W
S
R
Y
I
P
E
G
M
Q
C
----
S
C
G
I
D
Y
Y
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
Q
------------
G
------------
S
------
D
F
G
P
----
I
-----------
F
M
T
I
P
A
F
F
A
K
-------
T
S
A
---
V
Y
N
P
V
I
Y
I
M
M
-
N
K
Q
F
R
N
C
M
V
T
T
L
C
C
G
K
N
P
S
T
T
--
V
----
S
K
T
E
T
S
Q
V
A
P
A
-----------------------------
28
HHSearch
80.45
15%
-167
- C1 -
3EML
13
ENLYS_BPT4
A:
[21-472]
--------------------------------------------
S
S
--
V
Y
I
T
V
E
L
A
I
A
V
L
A
I
L
G
N
V
L
V
C
W
A
V
W
L
N
S
N
L
Q
N
V
T
N
Y
F
V
V
S
L
A
A
A
D
I
A
V
G
V
L
A
-
I
P
F
A
I
T
I
S
T
---
G
F
-------
C
A
A
C
H
G
C
L
F
I
A
C
F
V
------
L
V
L
T
Q
--------
S
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
R
I
P
L
R
Y
N
G
L
---
V
T
G
T
R
A
K
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
P
M
L
G
W
N
N
C
G
Q
-------
S
Q
G
C
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
GLRL
K
I
Y
K
D
TEGYYTIGIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
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
TGTW
D
A
Y
R
S
T
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
K
E
V
H
A
A
K
-----
S
L
-----------
A
I
----
I
V
G
L
F
A
L
C
W
L
P
L
H
I
I
N
C
F
T
F
F
C
------------
P
DCSH--------
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
-------------------------------------------------
24
HHSearch
80.38
16%
-169
- C1 -
3RZE
5
ENLYS_BPT4 (first)
A:
[10-443]
------------------------------------------------
P
L
V
V
V
L
S
T
I
C
L
V
T
V
G
L
N
L
L
V
L
Y
A
V
R
S
E
R
K
L
H
T
V
G
N
L
Y
I
V
S
L
S
V
A
D
L
I
V
G
A
V
V
-
M
P
M
N
I
L
Y
L
L
-
M
S
K
W
-------
S
L
G
R
P
L
C
L
F
W
L
S
M
D
------
Y
V
A
S
T
--------
A
S
I
F
S
V
F
I
L
C
I
D
R
Y
R
S
V
Q
Q
P
L
R
Y
L
K
Y
---
R
T
K
T
R
A
S
A
T
I
L
G
A
W
F
L
S
F
L
W
V
I
P
I
L
G
--
W
N
H
-------
R
R
E
D
K
C
E
T
D
F
Y
D
-------------
V
T
W
F
K
V
M
T
A
I
I
N
F
Y
L
P
T
L
L
M
L
W
F
Y
A
K
------
I
Y
K
A
V
---
R
Q
H
C
N
I
F
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
TEG
Y
Y
T
I
G
IGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKL
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYLH-
M
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
R
E
R
K
A
A
K
-----
Q
L
-----------
G
F
----
I
M
A
A
F
I
L
C
W
I
P
Y
F
I
F
F
M
V
I
A
F
C
------------
K
NC----------
C
------
N
E
H
L
----
H
-----------
M
F
T
I
--
W
L
G
Y
-------
I
N
S
---
T
L
N
P
L
I
Y
P
L
C
-
N
E
N
F
K
K
T
F
K
R
I
L
H
I
------------------------------------------------------
30
HHSearch
78.35
14%
-136
- C1 -
1U19
14
OPSD_BOVIN
A:
[38-329]
------------------------------------------
W
Q
F
S
--
M
L
A
A
Y
M
F
L
L
I
M
L
G
F
P
I
N
F
L
T
L
Y
V
T
V
Q
H
K
K
L
R
T
P
L
N
Y
I
L
L
N
L
A
V
A
D
L
F
M
V
F
G
G
-
F
T
T
T
L
Y
T
S
L
-
H
G
Y
F
-------
V
F
G
P
T
G
C
N
L
E
G
F
F
A
------
T
L
G
G
E
--------
I
A
L
W
S
L
V
V
L
A
I
E
R
Y
V
V
V
C
K
P
M
S
N
F
R
F
----
G
E
N
H
A
I
M
G
V
A
F
T
W
V
M
A
L
A
C
A
A
P
P
L
V
G
W
S
R
---
Y
I
-
P
E
G
M
Q
C
S
C
G
I
D
Y
Y
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
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
D
--
D
----
E
A
S
T
T
V
S
K
T
E
T
-----------------------------
27
HHSearch
77.81
15%
-161
* C1 *
2Z73
5
OPSD_TODPA
A:
[32-334]
------------------------------------------
A
V
Y
Y
--
S
L
G
I
F
I
G
I
C
G
I
I
G
C
G
G
N
G
I
V
I
Y
L
F
T
K
T
K
S
L
Q
T
P
A
N
M
F
I
I
N
L
A
F
S
D
F
T
F
S
L
V
N
G
F
P
L
M
T
I
S
C
F
-
L
K
K
W
-------
I
F
G
F
A
A
C
K
V
Y
G
F
I
G
------
G
I
F
G
F
--------
M
S
I
M
T
M
A
M
I
S
I
D
R
Y
N
V
I
G
R
P
M
A
A
S
K
K
---
M
S
H
R
R
A
F
I
M
I
I
F
V
W
L
W
S
V
L
W
A
I
G
P
I
F
G
W
G
A
----
Y
T
L
E
G
V
L
C
N
C
S
F
D
Y
I
S
R
-------
D
S
--
T
T
R
S
N
I
L
C
M
F
I
L
G
F
F
G
P
I
L
I
I
F
F
C
Y
F
N
------
I
V
M
S
V
---
S
N
H
E
K
E
M
A
A
M
A
K
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
F
--
D
----
D
K
E
T
E
D
D
K
D
A
E
-----------------------------
32
HHSearch
77.46
17%
-165
- C1 -
3PBL
2
DRD3_HUMAN (first)
A:
[41-472]
-------------------------------------------------
Y
A
L
S
Y
C
A
L
I
L
A
I
V
F
G
N
G
L
V
C
M
A
V
L
K
E
R
A
L
Q
T
T
T
N
Y
L
V
V
S
L
A
V
A
D
L
L
V
A
T
L
V
-
M
P
W
V
V
Y
L
E
V
T
G
G
V
W
-------
N
F
S
R
I
C
C
D
V
F
V
T
L
D
------
V
M
M
C
T
--------
A
S
I
W
N
L
C
A
I
S
I
D
R
Y
T
A
V
V
M
P
V
H
Y
Q
H
G
T
G
Q
S
S
C
R
R
V
A
L
M
I
T
A
V
W
V
L
A
F
A
V
S
C
P
L
L
F
G
F
-
N
--
T
----
T
G
D
P
T
V
C
S
I
S
N
----------------
P
D
F
V
I
Y
S
S
V
V
S
F
Y
L
P
F
G
V
T
V
L
V
Y
A
R
------
I
Y
V
V
L
---
K
Q
R
R
R
------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
N
I
F
E
M
L
R
I
D
E
GLRL
K
I
Y
K
D
TEG
Y
Y
T
I
G
IGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
T
GTWDAYGVP
L
R
E
K
K
A
T
Q
-----
M
V
-----------
A
I
----
V
L
G
A
F
I
V
C
W
L
P
F
F
L
T
H
V
L
N
T
H
C
------------
Q
TCH---------
V
------
S
P
E
L
----
Y
-----------
S
A
T
T
--
W
L
G
Y
-------
V
N
S
---
A
L
N
P
V
I
Y
T
T
F
-
N
I
E
F
R
K
A
F
L
K
I
L
S
C
------------------------------------------------------
23
HHSearch
77.25
16%
-163
- C1 -
2RH1
16
ADRB2_HUMAN (first)
A:
[40-477]
--------------------------------------------
V
V
--
G
M
G
I
V
M
S
L
I
V
L
A
I
V
F
G
N
V
L
V
I
T
A
I
A
K
F
E
R
L
Q
T
V
T
N
Y
F
I
T
S
L
A
C
A
D
L
V
M
G
L
A
V
-
V
P
F
G
A
A
H
I
L
-
M
K
M
W
-------
T
F
G
N
F
W
C
E
F
W
T
S
I
D
------
V
L
C
V
T
--------
A
S
I
E
T
L
C
V
I
A
V
D
R
Y
F
A
I
T
S
P
F
K
Y
Q
S
L
---
L
T
K
N
K
A
R
V
I
I
L
M
V
W
I
V
S
G
L
T
S
F
L
P
I
Q
M
H
W
Y
R
A
T
----
H
Q
E
A
I
N
C
Y
A
E
----
E
T
--
C
C
D
F
F
--
T
N
Q
A
Y
A
I
A
S
S
I
V
S
F
Y
V
P
L
V
I
M
V
F
V
Y
S
R
------
V
F
Q
E
A
---
K
R
Q
L
N
------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
F
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
TEGYYTIGIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
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
TGTWDAYKFC--
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
NL----------
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
------------------------------------------------------
22
HHSearch
76.75
15%
-151
- C1 -
3ODU
6
CXCR4_HUMAN (first)
A:
[46-498]
------------------------------------------
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
S
------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
I
F
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
TEG
Y
Y
T
I
GIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
IGRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKLK
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
-------
F
H
C
---
C
L
N
P
I
L
Y
A
F
L
-
G
A
K
F
K
T
S
A
Q
H
A
L
T
S
G
R
P
L
E
V
L
--
F
----
Q
---------------------------------------
45
Fugue
75.66
18%
-138
- C1 -
4XNV
15
P2RY1_HUMAN (first)
A:
[38-382]
----------------
S
F
K
C
A
------
L
T
K
T
--
G
F
---
Q
---
F
Y
Y
L
--
P
A
V
Y
I
L
V
F
I
I
G
F
--
L
G
N
S
V
A
I
W
M
F
V
F
H
M
K
P
W
S
G
I
S
V
Y
M
F
N
L
A
L
A
D
F
L
Y
V
L
T
L
-
P
A
L
I
F
Y
Y
F
N
-
K
T
D
W
-------
I
F
G
D
A
M
C
K
L
Q
R
F
I
F
------
H
V
N
L
Y
--------
G
S
I
L
F
L
T
C
I
S
A
H
R
Y
S
G
V
V
Y
P
--
K
S
L
G
---
R
L
K
K
K
N
A
I
C
I
S
V
L
V
W
L
I
V
V
V
A
I
S
---
P
I
L
F
Y
S
G
T
G
V
R
K
N
K
T
I
T
C
Y
D
T
T
--
S
D
E
--
Y
L
R
S
Y
--
F
I
Y
S
M
C
T
T
V
A
M
F
--
C
V
P
L
V
L
I
L
G
C
Y
G
L
------
I
V
R
A
L
I
Y
K
M
K
K
Y
T
------------------------------------------------------------------------------------------------------------------------------------------------------------------
C
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
T
V
C
G
Y
I
Y
N
-----
P
E
DGDPDNGVNPG
T
D
----
F
K
D
I
V
C
P
L
C
G
V
G
K
D
Q
F
E
E
V
E
E
P
------------
L
------------
R
------
R
K
S
I
Y
L
V
I
I
-----------
V
L
T
V
--
F
A
V
S
-------
Y
I
P
---
F
H
V
M
K
T
M
N
L
R
A
R
L
D
F
Q
T
P
A
M
C
A
F
N
D
R
V
Y
A
T
Y
Q
V
T
R
----
G
L
A
S
L
N
S
C
V
N
P
I
L
Y
F
LAGDTFRRR----------------
29
HHSearch
71.60
14%
-150
- C1 -
3V2Y
1
ENLYS_BPT4
A:
[61-495]
------------------------------------------
N
S
I
K
--
L
T
S
V
V
F
I
L
I
C
C
F
I
I
L
E
N
I
F
V
L
L
T
I
W
K
T
K
K
F
H
R
P
M
Y
Y
F
I
G
N
L
A
L
S
D
L
L
A
G
V
A
Y
-
T
A
N
L
L
L
S
G
A
--
T
T
Y
-------
K
L
T
P
A
Q
W
F
L
R
E
G
S
M
------
F
V
A
L
S
--------
A
S
V
F
S
L
L
A
I
A
I
E
R
Y
I
T
M
L
K
-----------
N
N
F
R
L
F
L
L
I
S
A
C
W
V
I
S
L
I
L
G
G
L
P
I
M
G
W
N
-------
C
I
S
A
L
S
S
C
S
T
V
L
P
L
-------------
Y
H
K
H
Y
I
L
F
C
T
T
V
F
T
L
L
L
L
S
I
V
I
L
Y
C
R
------
I
Y
S
L
V
---
R
T
R
N
I
F
E
M
L
R
IDEGLRL
K
I
Y
K
D
TE
G
Y
Y
T
I
G
IGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
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
TGTWDAYA
S
R
-
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
E
N
V
A
L
L
K
-----
T
V
-----------
I
I
----
V
L
S
V
F
I
A
C
W
A
P
L
F
I
L
L
L
L
D
V
G
C
------------
K
------------
V
KTC
D
--
I
L
F
R
----
A
-----------
E
Y
F
L
--
V
L
A
V
-------
L
N
S
---
G
T
N
P
I
I
Y
T
L
T
-
N
K
E
M
R
R
A
F
I
R
I
M
G
R
P
L
----------------------------------------------------
33
HHSearch
70.15
14%
-137
- C1 -
2LNL
-
CXCR1_HUMAN
A:
[37-322]
------------------------------------------
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
----------------------------------------------------
47
Fugue
65.41
21%
-150
- C2 -
2CVH
-
RADB_THEKO
A:
[1-220]
------------
M
L
S
T
G
T
K
S
L
------
D
S
L
L
G
G
G
F
A
P
G
--------------
V
L
T
Q
V
Y
G
P
Y
A
S
G
--------
K
T
T
L
A
L
Q
T
G
L
L
S
G
-
K
K
V
A
Y
V
D
--
T
E
G
G
F
-
S
P
E
R
L
V
Q
M
A
--
E
T
R
-------
G
L
N
P
E
E
A
L
S
R
F
I
L
F
-------
T
P
S
D
--------
F
K
E
Q
R
R
V
I
G
S
L
K
K
T
V
----------------
D
S
N
F
A
L
V
V
V
D
-------------------------
S
I
T
A
H
Y
R
A
E
E
N
R
S
G
L
I
--
A
E
L
S
R
--
Q
L
Q
V
L
L
W
I
A
R
K
H
N
-----------
I
P
V
------
I
V
I
N
Q
---
V
H
F
D
S
------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
T
E
M
T
K
P
V
A
-----
E
--------------------
Q
T
L
G
Y
R
C
K
D
I
L
R
L
D
K
L
P
K
P
G
-----------------------------------
L
----
R
-----------
V
A
V
L
--
E
R
H
R
-------
F
R
P
---
E
G
L
M
A
Y
F
R
I
T
-
E
R
G
I
E
D
V
E
------------------------------------------------------------
17
PsiBlast_PDB
65.11
21%
-170
- C1 -
4EA3
3
C562_ECOLX (first)
A:
[122-327]
--------------------------------------
L
---
G
L
K
V
--
T
I
V
G
L
Y
L
A
V
C
V
G
G
L
L
G
N
C
L
V
M
Y
V
I
L
R
H
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
-----------
T
L
V
L
L
-------------
T
L
P
F
Q
G
T
D
I
L
L
G
F
W
PFG
N
A
L
C
K
T
V
I
A
I
D
Y
Y
N
M
F
T
S
T
F
T
L
T
A
M
S
V
D
R
Y
V
A
I
C
H
P
---------
T
S
S
K
A
Q
A
V
N
V
A
I
---
W
A
L
A
S
V
V
-----
G
V
P
V
A
I
M
G
S
A
Q
V
E
D
E
--
E
I
E
C
L
V
E
I
P
--
T
P
Q
D
Y
--
W
G
P
V
F
A
I
C
I
F
L
F
S
F
I
V
P
V
L
V
I
S
V
C
Y
S
L
------
M
I
R
R
L
---
R
G
V
R
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
G
S
R
E
K
D
R
-----
N
L
-----------
R
R
----
I
T
R
L
V
L
V
V
V
A
V
F
V
G
C
W
T
P
V
Q
V
F
------------
V
------------
L
------
A
Q
G
L
----
G
-----------
V
Q
P
S
--
S
E
T
A
-------
V
A
I
---
L
R
F
C
T
A
L
G
Y
V
-
N
S
C
L
N
P
I
L
Y
A
F
L
D
E
N
F
K
A
C
F
R
-----------------------------------------------
19
PsiBlast_PDB
63.96
21%
-170
- C1 -
4Z35
2
?
A:
[80-254]
-----------------------------------------------------------
F
I
M
L
A
N
L
L
V
M
V
A
I
Y
V
N
R
R
F
H
F
P
I
Y
Y
L
M
A
N
L
A
A
A
D
F
-
F
A
G
L
A
-
Y
F
Y
L
M
F
N
T
G
-
P
N
T
R
-------
R
L
T
V
S
T
W
L
L
R
Q
G
L
I
------
D
T
S
L
T
--------
A
S
V
A
N
L
L
A
I
A
I
E
R
H
I
T
V
F
R
M
Q
L
H
T
R
M
---
S
N
R
R
---
V
V
V
V
I
V
V
I
W
T
M
A
I
V
M
G
A
I
P
S
V
------
G
W
N
C
I
----
C
D
I
E
N
C
S
N
M
A
PL
Y
S
D
S
Y
--
L
V
F
W
A
I
F
N
L
V
T
F
----
V
V
M
V
V
L
Y
A
H
I
F
------
G
Y
V
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
------------
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
----
R
N
R
D
T
M
M
S
L
L
K
-----------------------------
18
PsiBlast_PDB
63.66
21%
-176
- C1 -
4Z34
2
LPAR1_HUMAN
A:
[80-254]
-----------------------------------------------------------
F
I
M
L
A
N
L
L
V
M
V
A
I
Y
V
N
R
R
F
H
F
P
I
Y
Y
L
M
A
N
L
A
A
A
D
F
-
F
A
G
L
A
-
Y
F
Y
L
M
F
N
T
G
-
P
N
T
R
-------
R
L
T
V
S
T
W
L
L
R
Q
G
L
I
------
D
T
S
L
T
--------
A
S
V
A
N
L
L
A
I
A
I
E
R
H
I
T
V
F
R
M
Q
L
H
T
R
M
---
S
N
R
R
---
V
V
V
V
I
V
V
I
W
T
M
A
I
V
M
G
A
I
P
S
V
------
G
W
N
C
I
----
C
D
I
E
N
C
S
N
M
A
PL
Y
S
D
S
Y
--
L
V
F
W
A
I
F
N
L
V
T
F
----
V
V
M
V
V
L
Y
A
H
I
F
------
G
Y
V
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
------------
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
----
R
N
R
D
T
M
M
S
L
L
K
-----------------------------
8
PsiBlast_PDB
55.99
20%
-175
- C1 -
4IAQ
1
5HT1B_HUMAN (first)
A:
[34-153]
------------------------------------------------------------
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
K
A
T
K
T
--
L
----
G
I
I
L
G
A
F
I
V
C
W
-----------------------------