@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 : BRS3_HUMAN: (2016-01-09 )
MAQRQPHSPNQTLISITNDTESSSSVVSNDNTNKGWSGDNSPGIEALCAIYITYAVIISVGILGNAILIKVFFKTKSMQTVPNIFITSLAFGDLLLLLTCVPVDATHYLAEGWLFGRIGCKVLSFIRLTSVGVSVFTLTILSADRYKAVVKPLERQPSNAILKTCVKAGCVWIVSMIFALPEAIFSNVYTFRDPNKNMTFESCTSYPVSKKLLQEIHSLLCFLVFYIIPLSIISVYYSLIARTLYKSTLNIPTEEQSHARKQIESRKRIARTVLVLVALFALCWLPNHLLYLYHSFTSQTYVDPSAMHFIFTIFSRVLAFSNSCVNPFALYWLSKSFQKHFKAQLFCCKAERPEPPVADTSLTTLAVMGTVPGTGSIQMSEISVTSFTGCSVKQAEDRF
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.......330.......340...-....350.......360.......370.......380.......390.......
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MAQRQPHSPN
Q
T
L
I
S
I
TNDTESSSSVVSNDNTNKGWSGDNSP
G
I
E
A
L
C
A
I
Y
I
T
Y
A
V
I
I
S
V
G
ILG
N
A
I
L
I
K
V
F
F
KTKSMQTV
P
N
I
F
I
T
S
L
A
F
G
D
L
L
L
L
L
T
CVPV
D
A
T
H
Y
L
-
A
E
GW
L
F
G
R
I
G
C
K
V
L
S
F
I
R
L
TSVG
V
S
V
F
T
L
T
ILS
A
D
R
Y
K
A
V
V
K
P
L
E----RQP
S
---
N
A
I
L
K
T
C
V
K
A
G
C
V
W
I
V
S
M
I
F
A
-
L
P
E
A
I
F
-SN
V
Y
TFRDPNKN--M
T
F
E
--S--CTSYP
V
----
S
K
K
L
L
Q
E
I
H
S
L
L
C
F
L
V
F
-
Y
I
I
P
L
S
I
I
S
V
Y
Y
S
L
I
A
R
T
L
Y
K
S
TLNIP
T
E
E
---------------------------------------------------------------------------------------------------------------------------------------
Q
------------------------------------------------------------------------------------------------------------------------------------------------------
S
----------------
H
----------------
A
R
K
Q
I
E
S
R
K
R
I
A
--------
R
------
T
V
L
V
L
V
A
L
F
A
L
C
W
LP
N
H
L
L
Y
L
Y
H
SFTS--QTY----V
D
P
---
S
A
M
H
F
I
F
T
I
-
F
S
R
V
L
A
F
S
NSCV
N
P
F
A
L
Y
W
L
S
K
S
F
Q
K
H
F
K
A
Q
L
-
F
C
CKAERPEPPVADTS
L
T
T
L
A
V
M
GTVPGTG
S
I
Q
M
S
E
I
S
V
T
S
FTGCSVKQAEDRF
34
HHSearch
87.06
25%
-118
* C3 *
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
TGTW---
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
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
----------------------------------------------------
31
HHSearch
86.75
22%
-119
- 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
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
-----------------------------------------------------
8
PsiBlast_PDB
83.38
28%
-139
- C3 -
4N6H
23
C562_ECOLX (first)
A:
[127-406]
------------------------------------------------
A
I
T
A
L
Y
S
A
V
C
A
V
G
L
L
G
N
V
L
V
M
F
G
I
V
R
Y
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
A
L
A
T
S
T
-
L
P
F
Q
S
A
K
Y
L
-
M
E
T
W
P
F
G
E
L
L
C
K
A
V
L
S
I
D
Y
Y
N
M
F
T
S
I
F
T
L
T
M
M
S
V
D
R
Y
I
A
V
C
H
P
V
K
ALDF
R
T
P
A
---
K
A
K
L
I
N
I
----
C
I
W
V
L
A
S
G
V
G
-
V
P
I
M
V
M
-
A
-
V
T
R
P
R
D
G
A
V
V
--
C
M
L
Q
--------
F
P
S
----
P
S
W
Y
W
D
T
V
T
K
I
C
V
F
L
F
A
-
F
V
V
P
I
L
I
I
T
V
C
Y
G
L
M
L
L
R
L
R
S
V
R
L
L
S
G
S
K
E
---------------------------------------------------------------------------------------------------------------------------------------
K
------------------------------------------------------------------------------------------------------------------------------------------------------
D
----------------
R
----------------------
S
L
R
R
I
T
--------
R
------
M
V
L
V
V
V
G
A
F
V
V
C
W
A
P
I
H
I
F
V
I
V
W
T
L
V
D
--
I
D
R
----
R
D
P
L
V
V
A
A
L
H
L
C
I
A
------
L
G
Y
A
N
S
S
L
N
P
V
L
Y
A
F
L
D
E
N
F
K
R
C
F
R
Q
L
C
-
R
K
P
C
G
-------------------------------------------------
6
PsiBlast_PDB
83.25
28%
-143
- C3 -
4RWA
2
C562_ECOLX (first)
A:
[124-403]
------------------------------------------------
A
I
T
A
L
Y
S
A
V
C
A
V
G
L
L
G
N
V
L
V
M
F
G
I
V
R
Y
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
A
L
A
T
S
T
-
L
P
F
Q
S
A
K
Y
L
-
M
E
T
W
P
F
G
E
L
L
C
K
A
V
L
S
I
D
Y
Y
N
M
F
T
S
I
F
T
L
T
M
M
S
V
D
R
Y
I
A
V
C
H
P
V
K
A
L
D
F
R
T
P
A
---
K
A
K
L
I
N
I
----
C
I
W
V
L
A
S
G
V
G
-
V
P
I
M
V
M
-
A
-
V
T
R
P
R
D
G
A
V
V
--
C
M
L
Q
--------
F
P
S
----
P
S
W
Y
W
D
T
V
T
K
I
C
V
F
L
F
A
-
F
V
V
P
I
L
I
I
T
V
C
Y
G
L
M
L
L
---------
G
S
K
E
---------------------------------------------------------------------------------------------------------------------------------------
K
------------------------------------------------------------------------------------------------------------------------------------------------------
D
----------------
R
----------------------
S
L
R
R
I
T
--------
R
------
M
V
L
V
V
V
G
A
F
V
V
C
W
A
P
I
H
I
F
V
I
V
W
T
L
V
D
--
I
D
R
----
R
D
P
L
V
V
A
A
L
H
L
C
I
A
------
L
G
Y
A
N
S
S
L
N
P
V
L
Y
A
F
L
D
E
N
F
K
R
C
F
R
Q
L
C
-------------------------------------------------------
32
HHSearch
83.20
23%
-119
- C3 -
3ODU
6
CXCR4_HUMAN (first)
A:
[45-498]
-------------------------------------------
N
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
TGTW
D
----------------
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
E
I
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
-------------------------------------------
41
HHSearch
83.16
22%
-127
- 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
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
----------------------------------------------------
38
HHSearch
82.95
21%
-120
- C3 -
3EML
13
ENLYS_BPT4
A:
[23-471]
------------------------------------------------
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
ACLF
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
C
P
--
D
C
-----------
S
H
A
P
L
W
L
M
Y
-
L
A
I
V
L
S
H
T
N
S
V
V
N
P
F
I
Y
A
Y
R
I
R
E
F
R
Q
T
F
R
K
I
I
-
R
S
H
V
L
R
Q
-----------------------------------------------
1
PsiBlast_PDB
82.67
29%
-131
- C3 -
4EA3
3
C562_ECOLX (first)
A:
[132-405]
-----------------------------------------------------
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
P
F
G
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
----------------------------------------------------------
7
PsiBlast_PDB
82.53
28%
-137
- C3 -
4RWD
6
C562_ECOLX (first)
A:
[124-403]
------------------------------------------------
A
I
T
A
L
Y
S
A
V
C
A
V
G
L
L
G
N
V
L
V
M
F
G
I
V
R
Y
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
A
L
A
T
S
T
-
L
P
F
Q
S
A
K
Y
L
-
M
E
T
W
P
F
G
E
L
L
C
K
A
V
L
S
I
D
Y
Y
N
M
F
T
S
I
F
T
L
T
M
M
S
V
D
R
Y
I
A
V
C
H
P
V
K
A
L
D
F
R
T
P
A
---
K
A
K
L
I
N
I
----
C
I
W
V
L
A
S
G
V
G
-
V
P
I
M
V
M
-
A
-
V
T
R
P
R
D
G
A
V
V
--
C
M
L
Q
--------
F
P
S
----
P
S
W
Y
W
D
T
V
T
K
I
C
V
F
L
F
A
-
F
V
V
P
I
L
I
I
T
V
C
Y
G
L
M
L
L
R
L
R
S
V
R
L
L
S
G
S
K
E
---------------------------------------------------------------------------------------------------------------------------------------
K
------------------------------------------------------------------------------------------------------------------------------------------------------
D
----------------
R
----------------------
S
L
R
R
I
T
--------
R
------
M
V
L
V
V
V
G
A
F
V
V
C
W
A
P
I
H
I
F
V
I
V
W
T
L
V
D
--
I
D
R
----
R
D
P
L
V
V
A
A
L
H
L
C
I
A
------
L
G
Y
A
N
S
S
L
N
P
V
L
Y
A
F
L
D
E
N
F
K
R
C
F
R
Q
L
C
-------------------------------------------------------
5
PsiBlast_PDB
80.82
30%
-137
- C3 -
5C1M
7
?
A:
[10-296]
---------------------------------------
G
S
P
S
M
V
T
A
I
T
I
M
A
L
Y
S
I
V
C
V
V
G
L
F
G
N
F
L
V
M
Y
V
I
V
R
Y
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
A
L
A
T
S
T
-
L
P
F
Q
S
V
N
Y
L
-
M
G
T
W
P
F
G
N
I
L
C
K
I
V
I
S
I
D
Y
Y
N
M
F
T
S
I
F
T
L
C
T
M
S
V
D
R
Y
I
A
V
C
H
P
V
K
A
L
D
F
R
T
P
R
---
N
A
K
I
V
N
V
----
C
N
W
I
L
S
S
A
I
G
-
L
P
-
V
M
F
-
M
A
T
T
K
Y
R
Q
G
S
I
D
C
T
L
T
F
S
--
H
--
P
T
W
Y
------
W
E
N
L
L
K
-----
I
C
V
F
I
F
A
F
I
M
P
V
L
I
I
T
V
C
Y
G
L
M
I
L
R
L
-
K
S
-----
V
R
M
---------------------------------------------------------------------------------------------------------------------------------------
L
------------------------------------------------------------------------------------------------------------------------------------------------------
S
----------------
G
----------------
S
K
E
K
D
R
N
L
R
R
I
T
--------
R
------
M
V
L
V
V
V
A
V
F
I
V
C
W
T
P
I
H
I
Y
V
I
I
K
A
L
I
T
I
P
E
T
T
----
F
Q
T
---
V
S
W
H
F
C
I
A
------
L
G
Y
T
N
S
C
L
N
P
V
L
Y
A
F
L
D
E
N
F
K
R
C
F
-----------------------------------------------------------
33
HHSearch
79.95
19%
-121
- C3 -
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
TGTWD
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
----------------------------------------------------
12
PsiBlast_PDB
79.39
27%
-119
- C3 -
2YCZ
2
ADRB1_MELGA
A:
[19-299]
------------------------------------------------------
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
DP
G
--
C
C
D
F
V
T
----
N
R
A
---------------
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
E
A
K
E
---------------------------------------------------------------------------------------------------------------------------------------
Q
------------------------------------------------------------------------------------------------------------------------------------------------------
I
----------------
R
----------------
K
I
D
R
A
S
K
R
K
R
V
M
L
M
R
E
H
K
A
L
K
------
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
N
V
F
N
R
--
D
L
V
----
P
D
--------
W
L
F
V
A
-
F
N
W
-
L
G
Y
A
N
S
A
M
N
P
I
-
I
Y
C
R
S
P
D
F
R
K
A
F
K
R
L
L
A
F
-----------------------------------------------------
9
PsiBlast_PDB
79.24
27%
-120
- C3 -
2VT4
8
ADRB1_MELGA
A:
[19-298]
------------------------------------------------------
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
DP
G
--
C
C
D
F
V
T
----
N
R
A
---------------
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
E
A
K
E
---------------------------------------------------------------------------------------------------------------------------------------
Q
------------------------------------------------------------------------------------------------------------------------------------------------------
I
----------------
R
----------------------------
E
H
K
A
L
---
K
------
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
N
V
F
N
R
--
D
L
V
----
P
D
--------
W
L
F
V
A
-
F
N
W
-
L
G
Y
A
N
S
A
M
N
P
I
-
I
Y
C
R
S
P
D
F
R
K
A
F
K
R
L
L
A------------------------------------------------------
18
PsiBlast_PDB
78.85
28%
-124
- C3 -
2Y03
9
ADRB1_MELGA
A:
[19-300]
------------------------------------------------------
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
PG
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
IR--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
K
R
L
L
A------------------------------------------------------
13
PsiBlast_PDB
78.71
27%
-119
- C3 -
2YCY
6
ADRB1_MELGA
A:
[19-299]
------------------------------------------------------
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
DP
G
--
C
C
D
F
V
T
----
N
R
A
---------------
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
E
A
K
E
---------------------------------------------------------------------------------------------------------------------------------------
Q
------------------------------------------------------------------------------------------------------------------------------------------------------
I
----------------
R
------------------
D
R
A
S
K
R
K
R
V
M
L
M
R
E
H
K
A
L
K
------
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
N
V
F
N
R
--
D
L
V
----
P
D
--------
W
L
F
V
A
-
F
N
W
-
L
G
Y
A
N
S
A
M
N
P
I
-
I
Y
C
R
S
P
D
F
R
K
A
F
K
R
L
L
A
F
-----------------------------------------------------
10
PsiBlast_PDB
78.63
27%
-118
- C3 -
2YCW
7
ADRB1_MELGA
A:
[19-299]
------------------------------------------------------
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
------------------------------------------------------------------------------------------------------------------------------------------------------
I
----------------
R
----------------
K
I
D
R
A
S
K
R
K
R
V
M
L
M
R
E
H
KA
L
K
------
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
N
V
F
N
R
--
D
L
V
----
P
D
--------
W
L
F
V
A
-
F
N
W
-
L
G
Y
A
N
S
A
M
N
P
I
-
I
Y
C
R
S
P
D
F
R
K
A
F
K
R
L
L
A
F
-----------------------------------------------------
20
PsiBlast_PDB
78.33
28%
-121
- C3 -
4AMJ
12
ADRB1_MELGA
A:
[19-300]
------------------------------------------------------
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
PG
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
K
R
L
L
A------------------------------------------------------
11
PsiBlast_PDB
78.25
27%
-119
- C3 -
2YCX
3
ADRB1_MELGA
A:
[19-294]
------------------------------------------------------
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
DP
G
--
C
C
D
F
V
T
----
N
R
A
---------------
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
L
R
V
Y
R
E
A
K
E
---------------------------------------------------------------------------------------------------------------------------------------
Q
------------------------------------------------------------------------------------------------------------------------------------------------------
I
----------------
R
----------------
K
I
D
R
A
S
K
R
K
R
V
M
L
M
R
E
H
KA
L
K
------
T
L
G
I
I
M
G
V
F
T
L
C
W
L
P
F
F
L
V
N
I
V
N
V
F
N
R
--
D
L
V
----
P
D
--------
W
L
F
V
A
-
F
N
W
-
L
G
Y
A
N
S
A
M
N
P
I
-
I
Y
C
R
S
P
D
F
R
K
A
F
K
----------------------------------------------------------
17
PsiBlast_PDB
77.63
28%
-121
- C3 -
2Y02
13
ADRB1_MELGA
A:
[19-300]
------------------------------------------------------
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
PG
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
K
R
L
L
A------------------------------------------------------
19
PsiBlast_PDB
76.85
28%
-119
- C3 -
2Y04
13
ADRB1_MELGA
A:
[19-300]
------------------------------------------------------
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
PG
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
K
R
L
L
A------------------------------------------------------