@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 : O52H1_HUMAN: (2016-01-12 )
MPSASAMIIFNLSSYNPGPFILVGIPGLEQFHVWIGIPFCIIYIVAVVGNCILLYLIVVEHSLHEPMFFFLSMLAMTDLILSTAGVPKALSIFWLGAREITFPGCLTQMFFLHYNFVLDSAILMAMAFDHYVAICSPLRYTTILTPKTIIKSAMGISFRSFCIILPDVFLLTCLPFCRTRIIPHTYCEHIGVAQLACADISINFWYGFCVPIMTVISDVILIAVSYAHILCAVFGLPSQDACQKALGTCGSHVCVILMFYTPAFFSILAHRFGHNVSRTFHIMFANLYIVIPPALNPMVYGVKTKQIRDKVILLFSKGTG
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)
---MPSA
S
A
M
I
I
----
F
--------NLSSYNPG
P
------
F
I
L
V
GIPGL--
E
Q
F
H
V
W
I---
G
I
P
F
C
I
I
Y
I
V
A
V
V
G
N
C
-
I
L
L
Y
L
I
V
V
EHSLH
E
P
M
F
F
F
L
S
M
L
A
M
T
D
L
I
L
STAG-VP
K
A
L
S
I
F
----
W
L-GAREIT
F
P
G
C
L
T
Q
M
F
F
L
H
Y
-------
N
F
V
L
D
S
-------
A
I
L
M
A
M
A
F
D
---
H
Y
V
A
I
----CSPL
R
Y
T
T
I---L
T
P
K
T
I
I
K
S
A
MGI
S
F
R
S
F
C
I
IL
P
D
V
F
L
-
L
T
C
L
P
F
C
R
TRII
P
H
T
Y
C
E
---HIG-V
A
Q
L
A
C
A
------
D
I
---------
S
I
N
F
W
--------
Y
G
F
C
V
P
I
M
T
V
I
S
D
V
I
L
I
A
V
-------
S
Y
A
H
--
I
L
C
-
A
V
FGLP
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
----
A
-
C
---
Q
K
A
L
G
TC
G
S
H
V
C
V
I
L
----MFY
T
P
A
F
----
F
S
I
L
A
----
H
R
FGHN----------V----------
S
R
--
T
F
H
I
M
F
A
N
L
Y
I
V
IPPAL---
N
P
M
V
YG--V
K
T
K
QIR
D
K
V
I
L
L
FSKGTG-------------------------------------
24
HHSearch
89.51
19%
-155
- C7 -
2RH1
16
ADRB2_HUMAN (first)
A:
[41-477]
-------------------------------------------------------
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
TGTWDAYKF--
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
Q
D
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
----------------------------------------
23
HHSearch
88.98
20%
-149
- C7 -
3RZE
5
ENLYS_BPT4 (first)
A:
[11-443]
---------------------------------------------------------
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
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
----------------------------------------
41
Fugue
85.30
17%
-141
- C7 -
1F88
8
OPSD_BOVIN
A:
[1-348]
---
M
N
G
T
E
G
P
N
F
----
Y
VPFSNKTG
V
V
R
S
P
F
E
A
P
------
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
AVY
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
PSTTVSKTETS
Q
V
A
P
A---------------------
28
HHSearch
84.15
18%
-150
- C7 -
2Z73
5
OPSD_TODPA
A:
[31-332]
---------------------------------------------------
D
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
L
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
-------------------------------------
2
PsiBlast_PDB
80.65
23%
-175
- C7 -
4GBR
1
ADRB2_HUMAN
A:
[2-270]
------------------------------------------------------
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
T
K
T
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
Q
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
----
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
Q
D
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
-----------------------------------------
21
HHSearch
80.10
18%
-158
- C7 -
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
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
P
----------
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
-----------------------------------------
5
PsiBlast_PDB
79.90
22%
-177
- C7 -
4LDL
3
ADRB2_HUMAN
A:
[179-447]
------------------------------------------------------
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
T
K
T
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
Q
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KFA
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
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
-----------------------------------------
22
HHSearch
79.57
15%
-152
- C7 -
3ODU
6
CXCR4_HUMAN (first)
A:
[46-495]
----------------------------------------------------
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
-------------------------------------
42
Fugue
79.52
18%
-147
- C7 -
1U19
15
OPSD_BOVIN
A:
[4-349]
MN
G
T
E
G
P
N
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
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
QQES---------------------------------------------------------------------------------------------------------------------------------------------------------------
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
GS
D
F
G
P
I
F
M
T
I
P
A
F
F
A
K
T
S
AV
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
PLGDDEA
S
T
T
V
S
K
TETSQVAPA---------------
50
Fugue
79.35
20%
-186
- C5 -
4CVH
3
ISPD_HUMAN
A:
[1-411]
-SM
H
P
Q
A
V
A
A
V
L
----
P
------------
A
G
P
T
P
------
K
-----------
Q
F
C
P
I
L
---
E
R
P
L
I
S
Y
T
L
Q
A
L
E
R
V
C
W
I
K
D
I
V
V
A
V
T
G
E
N
M
E
V
M
K
S
I
I
Q
K
Y
Q
H
K
R
I
S
L
V
E
A
G
-
V
T
R
H
R
S
I
F
N
G
L
K
A
L
-
A
E
D
Q
I
N
S
K
L
S
K
P
E
V
V
I
I
H
D
AVRPFVE
E
G
V
L
L
K
-------
V
V
T
A
A
K
E
H
G
---
A
A
G
A
I
----
R
P
L
V
S
T
V
V
S
---
P
S
A
D
G
C
L
D
Y
S
L
E
-
R
A
R
H
R
A
S
E
M
P
Q
A
F
L
-
F
D
V
I
Y
E
A
Y
Q
Q
C
S
D
Y
D
L
E
F
---
G
T
E
-
C
L
Q
L
A
L
K
------
Y
C
C
T
K
A
K
L
V
E
G
S
P
D
L
W
KVTY
K
R
D
L
Y
A
A
E
S
I
I
K
E
R
I
S
Q
E
I
C
V
V
M
D
TE
E
D
N
K
H
V
G
H
--
L
L
E
-
E
V
L
K
S
E
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
H
V
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
K
----
V
-
T
---
S
E
A
L
D
Q
C
Y
N
F
V
C
V
N
V
TTSD
F
Q
E
T
Q
K
L
----
L
S
M
L
E
E
SSL
C
I
L
Y
P
V
----------
V
----------
V
V
--
S
V
H
F
L
D
F
K
L
V
P
P
S
Q
K
M
E
---
N
L
M
Q
I
R
--
E
F
A
K
E
V
K
E
R
N
I
L
L
Y
G
L
L
I
S
Y
PQD
D
Q
K
L
Q
E
S
L
R
Q
G
A
I
I
I
A
S
L
I
K
E
RNSGLIG
Q
L
L
I
A
30
HHSearch
79.34
18%
-160
- C7 -
3EML
13
ENLYS_BPT4
A:
[21-468]
------------------------------------------------------
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
DV-------
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
C
P
D
CS--------
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
-------------------------------------
14
PsiBlast_PDB
79.10
22%
-175
- C7 -
4QKX
2
ADRB2_HUMAN
A:
[179-447]
------------------------------------------------------
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
C
I
L
T
K
T
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
Q
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KFAL
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
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
-----------------------------------------
6
PsiBlast_PDB
78.86
22%
-172
- C7 -
4LDO
3
A:
[179-447]
------------------------------------------------------
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
T
K
T
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
Q
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KFAL
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
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
-----------------------------------------
27
HHSearch
78.60
15%
-151
* C7 *
2KS9
1
NK1R_HUMAN
A:
[32-324]
------------------------------------------------------
I
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
----------
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
-------------------------------------
4
PsiBlast_PDB
77.99
22%
-177
- C7 -
4LDE
3
A:
[179-447]
------------------------------------------------------
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
T
K
T
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
Q
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KFAL
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
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
-----------------------------------------
32
HHSearch
76.92
15%
-160
- C7 -
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
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
----------------------------------------
31
HHSearch
75.91
16%
-151
- C7 -
1U19
14
OPSD_BOVIN
A:
[40-326]
------------------------------------------------------
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
QQQESA
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
-------------------------------------
29
HHSearch
72.40
15%
-153
- C7 -
3V2Y
1
ENLYS_BPT4
A:
[60-495]
---------------------------------------------------
E
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
KT--------
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
--------------------------------------
49
Fugue
71.50
17%
-190
- C2 -
5AHR
2
A:
[1-343]
--S
M
T
C
P
F
Y
K
K
I
PGTG
F
--------
T
V
D
A
F
Q
Y
G
V
VEGCT
A
Y
F
L
T
H
F
H
S
D
--
H
Y
A
G
L
S
K
---
H
F
T
F
-
P
V
Y
C
S
E
I
T
G
N
L
-
L
K
N
K
L
H
V
Q
E
Q
Y
I
H
P
L
P
L
D
T
E
C
I
V
N
G
V
K
V
V
L
L
D
A
N
H
C
P
G
A
V
M
I
L
----
F
Y
-------
L
P
---
N
G
T
V
I
L
H
T
G------
D
F
R
A
D
P
-------
S
M
E
R
S
L
L
A
D
Q
K
V
H
M
L
Y
L
DTTY
C
S
P
--
E
Y
T
F
---
P
S
Q
Q
E
V
I
R
F
A
I
N
T
A
F
E
A
V
T
L
N
P
H
A
L
V
V
-
C
G
T
Y
S
I
G
K
E
K
V
F
L
A
I
A
D
V
L
G
S
K
V
G
-
M
S
Q
E
K
Y
K
------
T
L
---------
Q
C
L
N
I
--------
P
E
I
N
S
L
I
T
T
D
M
C
S
S
L
V
H
L
L
-------
P
M
M
Q
--
I
---------
N
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
----
G
-
L
---
Q
S
H
L
K
K
C
G
G
K
Y
N
Q
I
L
----
A
F
R
P
T
V
I
P
Q
T
K
G
N
I
S
I
----
Y
G
I
P
Y
S
----------
E
----------
H
S
--
S
Y
L
E
M
K
R
F
V
Q
W
L
K
P
Q
K
I
---
I
P
T
V
N
V
GT
W
K
S
R
S
T
M
E
K
Y
F
R
E
W
K
L
E
A
G
Y------------------------------------
33
HHSearch
69.85
15%
-148
- C7 -
2LNL
-
CXCR1_HUMAN
A:
[39-323]
------------------------------------------------------
K
Y
V
V
---
I
I
A
Y
A
L
V
F
L
L
S
L
L
G
N
S
-
L
V
M
L
V
I
L
Y
S
R
V
G
R
S
V
T
D
V
Y
L
L
N
L
A
L
A
D
L
L
F
A
L
T
--
L
P
I
W
A
A
S
K
-----
V
-
N
G
W
I
F
G
T
F
L
C
K
V
V
S
L
L
K
E
V
-------
N
F
Y
S
G
I
-------
L
L
L
A
C
I
S
V
D
---
R
Y
L
A
I
----
V
H
A
T
R
T
L
T
Q
----
K
R
H
L
V
K
F
V
C
L
G
C
W
G
L
S
M
N
L
S
L
P
F
F
L
F
-
R
Q
A
Y
H
P
----
N
N
S
S
P
V
C
Y
---
E
V
L
-
G
N
D
----------
T
A
---------
K
W
R
M
V
--------
L
R
I
L
P
H
T
F
G
F
I
V
P
L
F
V
M
L
F
-------
C
Y
G
F
--
T
L
R
-
T
L
F
K
A
H
--------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
----
Q
-
K
---
H
R
A
M
R
V
I
F
A
V
V
L
I
F
L
----
L
C
W
L
P
Y
N
----
L
V
L
L
A
----
D
T
L
M
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
--------------------------------------