@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 : TA2R1_HUMAN: (2016-01-15 )
MLESHLIIYFLLAVIQFLLGIFTNGIIVVVNGIDLIKHRKMAPLDLLLSCLAVSRIFLQLFIFYVNVIVIFFIEFIMCSANCAILLFINELELWLATWLGVFYCAKVASVRHPLFIWLKMRISKLVPWMILGSLLYVSMICVFHSKYAGFMVPYFLRKFFSQNATIQKEDTLAIQIFSFVAEFSVPLLIFLFAVLLLIFSLGRHTRQMRNTVAGSRVPGRGAPISALLSILSFLILYFSHCMIKVFLSSLKFHIRRFIFLFFILVIGIYPSGHSLILILGNPKLKQNAKKFLLHSKCCQ
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.......--------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
--------MLE
S
H
L
I
I
-----------------------
Y
F
L
--------
L
A
V
I
Q
F
------------
L
L
G
IFTN
G
I
-
I
-
V
V
VN
G
I
D
L
--
I
K-HRKM-A-
P
L
-
D
L
L
---------
L
S
C
L
A
V
S
R
-------
I
F
L
Q
L
----
F
I
-
F
Y
V
N
----
V
I
-------------------------
V
----
I
F
--------
F
I
E
-
F
I
M
C-SAN
C
A
I
L
L
F
I
----
N
E
L
E
L
W
----
L
A
T
W
L
--------
G
V
F
Y
C
A
-
K
V
---------
A
SVR----HP
L
----
F
I
W
L
------
K
--
M
R
I
S
---KL
V
P
W
---
M
I
L
G
S
L
L
Y
V
-
S
-
M
I
C
V
F
HS--K-YA
G
F
M
V
P
Y
F
L
R
K
F
F
SQN----AT----IQ--KE--D-T---
L
---
A
--
I
Q
-
I
-
F
----------
S
F
V
A
E
FS
V
----
P
L
L
I
-------
F
L
F
A
-
V
L
L
--------
L
I
--
F
S
L
G
R
H
T
R
Q
M
R
N
-----------T--VA----------------------------------------------------------------------------------------------------------------------------------------------------G------------------------------------------------------------------------------------------------------------------------------------------------------SRVPGRGA-------------
P
I
----------
S
A
L
L
S
I
-----------------
L
-----
S
F
L
I
---
L
Y
F
-
S
H
C
M
I
K
------
V
F
L
-
S
-
S
---
L
---
K
----
F
------------
H
----
I
R
R
F
--
I
F
L
----
F
F
I
L
V
-
I
-------GIYPS-G
H
--------
S
L
I
L
I
L-GNP
K
L
K
Q
N
A
K
K
F
L
LHSKCCQ--------------------
1
PsiBlast_PDB
82.18
20%
-179
- C3 -
4ZWJ
-
?
A:
[199-483]
--------
M
L
A
A
Y
M
--------------------------
F
L
--------
L
I
V
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
L
----
G
G
-
F
T
S
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
FG
E
N
H
A
I
M
G
V
A
F
T
W
V
------
M
--
A
L
A
C
---
A
A
P
P
L
---
A
G
W
S
R
Y
I
P
E
-
G
-
L
Q
C
S
C
G
I
--
D
-
Y
------
Y
T
L
K
P
E
V
N
N
E
----
S
F
----
V
-----------------------
I
-
Y
----------
M
F
V
V
H
F
T
I
----
P
M
I
I
-------
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
Y
V
-----------------
I
-----
A
F
L
I
---
C
W
V
-
P
Y
A
S
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
S
-
A
-------
A
I
Y
----
N
--------
P
V
I
Y
I
M
-
M
N
K
Q
F
R
N
----
C
M
L
T
T
I
C
C
G
--------------------
24
Fugue
72.18
19%
-207
- C2 -
4QT9
2
?
A:
[19-432]
LS
D
D
A
L
M
D
T
V
Q
R
R
T
F
L
-----------------------
Y
F
W
EGAEPNSG
L
A
P
E
R
Y
HVDGVYPQNDAN
V
V
T
S
G
G
S
G
F
G
I
M
A
I
L
A
G
I
D
R
GY
V
T
-
R
E
E
G
-
L
-
A
R
M
E
R
I
---------
V
S
F
L
E
K
A
D
-------
R
F
H
G
A
----
Y
P
-
H
W
W
Y
GDTG
K
V
-------------------------
K
----
P
F
GQKDNGGD
L
V
E
-
T
A
F
L
M
Q
G
L
L
A
V
H
Q
Y
Y
A
NG-
N
D
K
E
K
A
----
I
A
Q
R
I
--------
D
R
L
W
R
E
V
D
W
---------
D
W
Y
R
----
K
G
G
----
Q
N
V
L
------
Y
--
W
H
W
S
---
P
T
Y
G
W
EMD
F
P
I
H
G
Y
N
E
C
M
I
M
Y
I
L
A
A
A
S
--
P
-
T
H
G
V
P
A
A
V
Y
H
D
G
W
A
Q
N
G
----
A
I
----
V
S
--
P
H
--
K
-
V
---
E
---
G
--
I
E
-
L
-
H
LRYQGTEAGP
L
F
W
A
Q
Y
S
F
LGLD
P
V
G
L
KDEYCPS
Y
F
H
E
M
R
N
L
--------
T
L
--
V
N
R
A
Y
C
I
R
N
P
K
H
YKGFGPD
C
W
G
L
T
--
A
S
----------------------------------------------------------------------------------------------------------------------------------------------------
Y
------------------------------------------------------------------------------------------------------------------------------------------------------
S
-
V
D
G
Y
A
A
HSPNEQDDKGVIS
P
T
----------
A
A
L
S
S
I
-----------------
V
YT
P
E
Y
S
L
Q
V
M
R
H
L
Y
N
M
G
D
K
V
F
G
PFGFYD
A
F
S
-
E
-
T
---
D
---
N
----
W
------------
Y
----
P
Q
R
Y
L
A
I
D
Q
----
G
P
I
A
V
M
I
-------
E
N
Y
R
T
-
G
---------
L
L
W
K
L
F
M
S
H
P
D
V
Q
A
G
L
T
K
L
G
F
N
T
N
-----------------------
7
HHSearch
72.09
12%
-148
- C3 -
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
GTW-------------------------------------------------------------------------------------------------------------------------------------
D
A
Y
G
V
P
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
CQ-
T
C-----------
H
----
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
-------------------------
22
Fugue
71.54
14%
-158
- C3 -
1U19
15
OPSD_BOVIN
A:
[4-349]
-----MN
G
T
E
G
P
N
F
Y
V
PFSNKTGVVRSPFEAPQYYLAE
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
GG
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
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
----
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
GDDEA
S
T
T
V
S
K
TETSQVAPA
13
HHSearch
69.43
13%
-173
- C3 -
1U19
14
OPSD_BOVIN
A:
[42-326]
---------------
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
TP
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
------------
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
--------------------
2
HHSearch
68.61
13%
-150
- C3 -
3UON
4
ACM2_HUMAN (first)
A:
[25-457]
---------------
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
TGTW--
D
A
Y
P
P
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
CAP---------
C
----
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
--------------------------
29
Fugue
68.05
16%
-182
* C2 *
4R33
5
?
A:
[35-418]
-----------
G
D
F
V
L
-----------------------
P
E
L
--------
E
D
V
R
A
E
------------
A
A
T
V
D
T
R
A
V
-
L
-
A
L
A
E
G
E
E
P
--
A
E
-
S
R
A
A
-
V
-
A
L
-
A
L
W
E
DRSIG
T
A
E
L
Q
A
A
A
E
A
R
C
GARRPR
L
H
T
F
V
----
P
L
-
Y
T
T
N
----
Y
C
DSECKMCSMRKGNHRLD
R
K
F
S
G
R
K
E
I
----
T
E
--------
Q
L
E
-
I
L
Y
H
-
H
E
G
V
R
G
V
G
F
L
T
G
E
Y
E
D
K
H
T
R
----
L
A
S
A
F
--------
R
I
G
W
A
I
-
R
T
---------
A
L
D
L
----
G
F
E
----
R
V
Y
F
N
IGSME
Q
--
D
E
I
D
---
V
L
G
E
W
---
I
G
R
E
D
P
----
V
-
T
M
C
V
F
Q
E
--
S
-
Y
D
----
R
E
T
Y
R
R
F
M
G
K
T
----
S
V
----
G
V
--
P
K
--
A
-
D
---
F
---
D
--
R
R
-
V
-
V
----------
S
F
D
R
W
L
D
A
----
G
Y
R
Y
-------
V
N
P
G
-
V
L
V
GLHDD
L
S
A
E
L
--
V
S
L
V
A
H
G
D
H
L
R
S
-----------
R
G
A
T
A
----------------------------------------------------------------------------------------------------------------------------------------------------
D
------------------------------------------------------------------------------------------------------------------------------------------------------
L
S
V
P
R
M
R
P
-------------
A
M
KS
R
D
T
T
R
V
G
D
D
D
Y
L
R
L
-----------------
M
-----
S
V
V
A
---
F
T
C
-
P
E
--
Q
R
------
L
V
L
-
T
-
T
---
R
---
E
----
P
------------
Q
----
E
F
Q
D
--
V
A
L
----
G
L
A
G
V
-
I
S
P
G
S
PDV
A
P
Y
R
A
-
G
C
EARNDEKS
S
Q
F
L
V
A
-
D
L
R
R
P
R
H
I
L
G
R
I
E
A
S
G
T
P
V
D
HFVNPAGEASR---------
14
HHSearch
66.52
13%
-140
- C3 -
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
YI
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
FGPL
E
------------
W
----
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
--------------------
3
HHSearch
66.43
11%
-146
- C3 -
3RZE
5
ENLYS_BPT4 (first)
A:
[9-443]
--------------
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
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
TGTW--------------------------------
D
A
Y
L
H
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-----------
N
C---
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
-------------------------
4
HHSearch
63.55
13%
-160
- C3 -
3ODU
6
CXCR4_HUMAN (first)
A:
[47-497]
------------
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
TGTWD
A
Y
G
S
K
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
--------------------
12
HHSearch
63.32
11%
-141
- C3 -
2KS9
1
NK1R_HUMAN
A:
[35-324]
---------------------------------------
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
PN-
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
G
D
S
-----------
S
--
D
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
Y
H
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
NP-
D
------------
L
YLKK
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
F
I
S
--------------------
6
HHSearch
63.04
13%
-148
- C3 -
3EML
13
ENLYS_BPT4
A:
[22-469]
--------------
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
EGQV
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
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
CPDCS-------
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
--------------------
30
Fugue
62.37
13%
-174
- C2 -
4OHC
5
?
A:
[10-230]
--------------------------------------------------------------------------------------------------
T
-
G
Y
-
D
R
Q
---------
S
I
S
D
T
T
A
K
-------
I
L
L
E
V
----
Q
A
-
V
H
F
N
-----------------------------------------------------------
A
E
K
P
F
I
----
F
T
S
G
W
A
----
S
P
V
Y
I
--------
D
C
R
K
L
I
-
S
Y
---------
P
R
V
R
----
R
A
L
----
M
E
M
A
------
E
--
T
T
I
T
---
R
D
I
G
F
---
E
Q
------
I
-
D
-
A
V
A
G
G
E
T
--
A
--
G
I
P
F
A
A
W
I
A
D
R
M
M
V
P
M
----
Q
Y
----
V
R
--
K
K
--
P
-
K
GFG
R
---
N
--
A
Q
-
I
-
E
----------
G
H
L
E
E
G
S
---------------------
R
V
L
--------
L
V
--
E
D
L
T
T
D
S
R
S
K
I
N
-----------
F
--
V
N
----------------------------------------------------------------------------------------------------------------------------------------------------
A
------------------------------------------------------------------------------------------------------------------------------------------------------
L
R
T
A
G
--
A
-------------
T
V
----------
N
H
C
F
V
L
-----------------
F
-----
H
Y
N
I
---
F
K
E
-
S
V
S
V
L
K
------------
D
---
I
---
D
----
V
------------
D
----
L
H
A
L
--
A
T
W
----
W
D
V
L
R
-
V
-------
A
K
A
S
G
-
Y
F
--------
E
T
K
T
L
D
-
E
V
E
K
F
L
H
A
P
A
E
W
S
A
A
H
G
G
----------------------
27
Fugue
62.32
13%
-181
- C1 -
3EH0
-
LPXD_ECOLI
A:
[1-341]
--------
M
A
S
----------------------------
I
R
L
--------
A
D
L
A
Q
Q
------------
L
D
A
E
L
H
G
D
G
-
D
-
I
V
I
T
G
V
A
S
--
M
Q
-
S
------
A
Q
-
T
G
H
---------
I
T
F
M
V
N
P
K
-------
Y
R
E
H
L
----
G
L
-
C
Q
A
S
----
A
V
-------------------------
V
----
M
T
--------
Q
D
D
-
L
P
F
A
-
K
S
A
A
L
V
V
K
N
P
----
Y
L
T
Y
A
R
----
M
A
Q
I
L
DTTPQPAQ
N
I
A
P
S
A
-
V
I
D
AT
A
K
L
G
N
N
V
S
I
G
----
A
N
A
----
V
I
E
S
------
G
--
V
E
L
G
D
N
V
I
I
G
A
G
---
C
F
V
G
K
N
S
K
I
-
G
-
A
G
S
R
L
W
A
--
N
------
V
T
I
Y
H
E
I
Q
I
G
Q
N
----
C
L
----
I
Q
--
S
G
--
T
-
V
---
V
---
G
--
A
D
-
G
-
F
----------
G
Y
A
N
D
R
G
N
----
W
V
K
I
-------
P
Q
I
G
-
R
V
I
--------
I
G
D
R
V
E
I
G
A
C
T
T
I
D
R
G
-----------
A
--
L
D
----------------------------------------------------------------------------------------------------------------------------------------------------
D
------------------------------------------------------------------------------------------------------------------------------------------------------
T
I
I
-
G
N
G
V
-------------
I
I
----------
D
N
Q
C
Q
I
A
H
N
V
V
I
G
D
N
T
A
V
A
G
G
V
I
M
-----
A
G
S
L
---
K
I
G
-
R
Y
C
M
I
G
------
G
A
S
-
V
I
N
---
G
---
H
----
M
------------
E
----
I
C
D
K
--
V
T
V
----
T
G
M
G
M
-
V
MRPIT
E
P
G
V
Y
S
S
-
G
I
--------
P
L
---
Q
-
P
N
K
V
W
R
K
T
A
A
L
V
M
N
I
D
D
M
S
K
R
L
K
S
L
E
R
K
V
N
Q
Q
D-------
5
HHSearch
60.13
12%
-142
- C3 -
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
TGT
W
------------------------------------------------------------------------------------------------------------------------------------------------------
D
A
Y
K
F
C
L
K
-------------
E
H
----------
K
A
L
K
T
L
-----------------
G
-----
I
I
M
G
---
T
F
T
-
L
C
W
L
P
F
------
F
I
V
N
I
-
V
---
H
---
V
I
QD-
N
------------
L
----
I
R
K
E
--
V
Y
I
----
L
L
N
W
I
-
G
-------
Y
V
N
S
G
-
F
N
--------
P
L
I
Y
C
--
R
S
P
D
F
R
I
A
F
Q
E
L
L
C
L
-------------------------
11
HHSearch
57.45
12%
-175
- C3 -
2LNL
-
CXCR1_HUMAN
A:
[37-323]
-----------
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
AK-
W
RM
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
---
T
----
Q
VIQE
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
-----------------------
9
HHSearch
52.58
7%
-148
- C3 -
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
GA--
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
--
I
D
EGLRL
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
TGTW
D
------------------------------------------------------------------------------------------------------------------------------------------------------
A
Y
A
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
KVKT--------
C
----
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
-----------------------
19
HHSearch
35.39
6%
345
- C3 -
2JX4
-
V2R_RAT
A:
[1-240]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
--
V
L
--------
I
F
--
R
E
I
H
A
S
L
V
P
G
P
S
-----------
E
--
R
A
----------------------------------------------------------------------------------------------------------------------------------------------------
G
------------------------------------------------------------------------------------------------------------------------------------------------------
R
R
R
R
G
R
R
T
-------------
G
S
----------
P
S
E
G
A
H
-----------------
V
-----
S
A
A
A
---
K
T
V
-
R
T
-----------------------------------------------------------------------------------------------------------------------------------------
15
HHSearch
27.35
11%
83
- C3 -
2KOE
-
A:
[4-38]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
----
F
A
S
M
L
-
C
-------
L
L
N
S
T
-
V
N
--------
P
I
I
Y
A
L
-
R
S
K
D
L
R
H
A
F
R
S
M
F
P
S
A
E
-----------------------
21
Fugue
26.38
30%
337
- C3 -
1TQE
-
Y:
[1-23]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
P
K
-
G
T
--------
G
------
A
S
T
E
V
K
Q
K
L
Q
E
F
L
L
S
K
S
-----------------------