@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 : GP151_HUMAN: (2016-01-10 )
MLAAAFADSNSSSMNVSFAHLHFAGGYLPSDSQDWRTIIPALLVAVCLVGFVGNLCVIGILLHNAWKGKPSMIHSLILNLSLADLSLLLFSAPIRATAYSKSVWDLGWFVCKSSDWFIHTCMAAKSLTIVVVAKVCFMYASDPAKQVSIHNYTIWSVLVAIWTVASLLPLPEWFFSTIRHHEGVEMCLVDVPAVAEEFMSMFGKLYPLLAFGLPLFFASFYFWRAYDQCKKRGTKTQNLRNQIRSKQVTVMLLSIAIISALLWLPEWVAWLWVWHLKAAGPAPPQGFIALSQVLMFSISSANPLIFLVMSEEFREGLKGVWKWMITKKPPTVSESQETPAGNSEGLPDKVPSPESPASIPEKEKPSSPSSGKGKTEKAEIPILPDVEQFWHERDTVPSVQDNDPIPWEHEDQETGEGVK
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.......400.......410.......
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
---M
L
A
A
A
FADSN-SSS
M
N
V
S
F
A
H
L
H
F
AGGYLPSDSQ
D
W
R
T
I
I
P
A
L
L
V
A
V
C
L
V
G
F
V
G
N
L
C
V
I
-
G
I
L
L
HNAWKG
K
P
S
M
I
H
S
L
I
L
N
L
S
L
A
D
L
S
L
L
L
FSAPIRATAYS-KSVW
D
L
G
W
F
V
C
KSS
D
W
F
I
H
T
CMAAK
S
L
T
I
V
V
V
A
K
V
C
F
M
YASDPA
K
Q
V
S
----IH
N
Y
T
-
I
W
S
V
L
-
V
A
-
I
W
T
V
A
S
LLPL
P
E
W
F
F
S
T
I
R
-H---HEG
V
E
-
M
C
L
VD
V
P
A
V
A
E
E
F
-
M
S
M
-
F
G
K
L
Y
P
L
L
A
F
G
L
P
L
F
F
A
S
F
Y
F
------
W
R
A
Y
D
Q
C
K
K---RGT
K
T
Q
----------------------------------------------------------------------------------------------------------------------------------------------------------
N
------------------------------------------------------------------------------------------------------------------------------------------------------------
L
R
N
Q
I
RSK
Q
V
T
V
M
L
L
------
S
I
A
I
-
I
S
A
---
L
L
W
L
P
E
W
V
A
W
L
W
V
W
HLKAA-------GPAPP
Q
----
G
F
I
A
--
L
S
Q
V
L
M
F
SISSAN
P
L
I
F
L
V
M
S
E
E
F
R
E
G
L
K
G
V
W
K
W
MITKKPPTVSESQETPAGNSEGLPDKVPSPESPASIPEKEKPSSPSSGKGKTEKAEIPILP
D
V
E
Q
F
W
H
ERDTVPSVQDNDPIPWEHEDQETGEGVK
28
HHSearch
84.35
18%
-132
- C1 -
2RH1
16
ADRB2_HUMAN (first)
A:
[37-477]
------------------------------------
E
V
W
V
V
G
M
G
I
V
M
S
L
I
V
L
A
I
V
F
G
N
V
L
V
I
-
T
A
I
A
K
F
E
R
L
Q
--
T
V
T
N
Y
F
I
T
S
L
A
C
A
D
L
V
M
G
L
A
V
V
P
F
G
A
A
H
I
L
-
M
K
M
W
T
F
G
N
F
W
C
E
F
W
T
S
I
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
V
D
R
Y
F
A
I
T
S
P
F
K
Y
Q
S
L---
L
T
K
N
K
-
A
R
V
I
I
-
L
M
-
V
W
I
V
S
G
L
T
S
F
L
P
I
Q
M
H
W
Y
R
A
T
---
H
Q
E
A
I
-
N
C
Y
A
E
E
T
C
C
D
F
F
T
-
N
Q
A
-
Y
A
I
A
S
S
I
V
S
F
Y
V
P
L
V
I
M
V
F
V
Y
------
S
R
V
F
Q
E
A
K
R
---
Q
L
N
I
F
E
----------------------------------------------------------------------------------------------------------------------------------------------------------
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
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
TGTWDA--
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
------------------------------------------------------------------------------------------------
27
HHSearch
83.59
18%
-131
- C1 -
3UON
4
ACM2_HUMAN (first)
A:
[23-457]
---------------------------------------
V
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
GVR
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
TGTWD
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
-------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
82.23
21%
-132
- C1 -
4N6H
22
OPRD_HUMAN
A:
[128-410]
------------------------------------------
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
R
K
P
C
G
---------------------------------------------------------------------------------------------
47
Fugue
81.82
16%
-116
- C1 -
1F88
8
OPSD_BOVIN
A:
[1-348]
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
-
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
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
---------------------------------------
35
HHSearch
81.07
18%
-135
- 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
GTWDA
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
------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
80.66
21%
-133
- C1 -
4RWD
6
C562_ECOLX (first)
A:
[125-406]
------------------------------------------
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
--------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
80.30
21%
-140
- C1 -
3ZPR
11
ADRB1_MELGA
A:
[7-296]
-----------------------------------
S
Q
Q
W
E
A
G
M
S
L
L
M
A
L
V
V
L
L
I
V
A
G
N
V
L
V
I
-
A
A
I
--
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
R
Y
Q
S
----
L
M
T
R
A
-
R
A
K
V
I
-
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
H
W
W
R
-
D
---
E
D
P
Q
A
-
L
K
C
Y
Q
D
P
G
C
C
D
F
V
-
T
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
------
L
R
V
Y
R
E
A
K
E
Q----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
--------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
80.08
21%
-138
- C1 -
2Y00
13
ADRB1_MELGA
A:
[7-296]
-----------------------------------
S
Q
Q
W
E
A
G
M
S
L
L
M
A
L
V
V
L
L
I
V
A
G
N
V
L
V
I
-
A
A
I
--
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
R
Y
Q
S
----
L
M
T
R
A
-
R
A
K
V
I
-
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
H
W
W
R
-
D
---
E
D
P
Q
A
-
L
K
C
Y
Q
D
P
G
C
C
D
F
V
-
T
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
------
L
R
V
Y
R
E
A
K
E
Q-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
R
V
M
L
M
R
E
H
K
A
L
K
T
L
------
G
I
I
M
G
V
F
T
---
L
C
W
L
P
F
F
L
--
V
N
I
V
N
V
F
N
R
-------
D
L
V
P
D
W
----
L
F
V
A
--
F
N
W
-
L
G
Y
A
N
S
A
M
N
P
I
I
Y
-
C
R
S
P
D
F
R
K
A
F
K
R
L
L
A
-------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
80.02
21%
-136
- C1 -
2Y01
12
ADRB1_MELGA
A:
[7-296]
-----------------------------------
S
Q
Q
W
E
A
G
M
S
L
L
M
A
L
V
V
L
L
I
V
A
G
N
V
L
V
I
-
A
A
I
--
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
R
Y
Q
S
----
L
M
T
R
A
-
R
A
K
V
I
-
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
H
W
W
R
-
D
---
E
D
P
Q
A
-
L
K
C
Y
Q
D
P
G
C
C
D
F
V
-
T
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
------
L
R
V
Y
R
E
A
K
E
Q-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
R
V
M
L
M
R
E
H
K
A
L
K
T
L
------
G
I
I
M
G
V
F
T
---
L
C
W
L
P
F
F
L
--
V
N
I
V
N
V
F
N
R
-------
D
L
V
P
D
W
----
L
F
V
A
--
F
N
W
-
L
G
Y
A
N
S
A
M
N
P
I
I
Y
-
C
R
S
P
D
F
R
K
A
F
K
R
L
L
A
-------------------------------------------------------------------------------------------------
26
HHSearch
79.79
16%
-129
- C1 -
3ODU
6
CXCR4_HUMAN (first)
A:
[41-498]
--------------------------------
E
E
N
A
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
TGTWDAY
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
---------------------------------------------------------------------------------------
16
PsiBlast_PDB
79.76
21%
-137
- C1 -
2Y04
13
ADRB1_MELGA
A:
[7-296]
-----------------------------------
S
Q
Q
W
E
A
G
M
S
L
L
M
A
L
V
V
L
L
I
V
A
G
N
V
L
V
I
-
A
A
I
--
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
R
Y
Q
S
----
L
M
T
R
A
-
R
A
K
V
I
-
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
H
W
W
R
-
D
---
E
D
P
Q
A
-
L
K
C
Y
Q
D
P
G
C
C
D
F
V
-
T
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
------
L
R
V
Y
R
E
A
K
E
Q-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
R
V
M
L
M
R
E
H
K
A
L
K
T
L
------
G
I
I
M
G
V
F
T
---
L
C
W
L
P
F
F
L
--
V
N
I
V
N
V
F
N
R
-------
D
L
V
P
D
W
----
L
F
V
A
--
F
N
W
-
L
G
Y
A
N
S
A
M
N
P
I
I
Y
-
C
R
S
P
D
F
R
K
A
F
K
R
L
L
A
-------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
79.38
21%
-139
- C1 -
4EA3
3
C562_ECOLX (first)
A:
[121-405]
--------------------------------
P
---
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
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
-----------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
79.18
21%
-138
- C1 -
3ZPQ
11
ADRB1_MELGA
A:
[7-296]
-----------------------------------
S
Q
Q
W
E
A
G
M
S
L
L
M
A
L
V
V
L
L
I
V
A
G
N
V
L
V
I
-
A
A
I
--
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
R
Y
Q
S
----
L
M
T
R
A
-
R
A
K
V
I
-
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
H
W
W
R
-
D
---
E
D
P
Q
A
-
L
K
C
Y
Q
D
P
G
C
C
D
F
V
-
T
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
------
L
R
V
Y
R
E
A
K
E
Q-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
R
V
M
L
M
R
E
H
K
A
L
K
T
L
------
G
I
I
M
G
V
F
T
---
L
C
W
L
P
F
F
L
--
V
N
I
V
N
V
F
N
R
-------
D
L
V
P
D
W
----
L
F
V
A
--
F
N
W
-
L
G
Y
A
N
S
A
M
N
P
I
I
Y
-
C
R
S
P
D
F
R
K
A
F
K
R
L
L
A
-------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
79.16
21%
-140
- C1 -
4RWA
2
C562_ECOLX (first)
A:
[125-406]
------------------------------------------
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
--------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
79.15
21%
-141
- C1 -
2Y03
9
ADRB1_MELGA
A:
[7-296]
-----------------------------------
S
Q
Q
W
E
A
G
M
S
L
L
M
A
L
V
V
L
L
I
V
A
G
N
V
L
V
I
-
A
A
I
--
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
R
Y
Q
S
----
L
M
T
R
A
-
R
A
K
V
I
-
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
H
W
W
R
-
D
---
E
D
P
Q
A
-
L
K
C
Y
Q
D
P
G
C
C
D
F
V
-
T
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
------
L
R
V
Y
R
E
A
K
E
Q
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
-------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
79.13
21%
-138
- C1 -
2Y02
13
ADRB1_MELGA
A:
[7-296]
-----------------------------------
S
Q
Q
W
E
A
G
M
S
L
L
M
A
L
V
V
L
L
I
V
A
G
N
V
L
V
I
-
A
A
I
--
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
R
Y
Q
S
----
L
M
T
R
A
-
R
A
K
V
I
-
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
H
W
W
R
-
D
---
E
D
P
Q
A
-
L
K
C
Y
Q
D
P
G
C
C
D
F
V
-
T
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
------
L
R
V
Y
R
E
A
K
E
Q-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
R
V
M
L
M
R
E
H
K
A
L
K
T
L
------
G
I
I
M
G
V
F
T
---
L
C
W
L
P
F
F
L
--
V
N
I
V
N
V
F
N
R
-------
D
L
V
P
D
W
----
L
F
V
A
--
F
N
W
-
L
G
Y
A
N
S
A
M
N
P
I
I
Y
-
C
R
S
P
D
F
R
K
A
F
K
R
L
L
A
-------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
78.92
21%
-134
- C1 -
4BVN
11
ADRB1_MELGA
A:
[7-296]
-----------------------------------
S
Q
Q
W
E
A
G
M
S
L
L
M
A
L
V
V
L
L
I
V
A
G
N
V
L
V
I
-
A
A
I
--
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
V
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
R
K
----------------------------------------------------------------------------------------------------------------------------------------------------------
T
------------------------------------------------------------------------------------------------------------------------------------------------------------
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
K
W
----
L
F
V
A
--
F
N
W
-
L
G
Y
A
N
S
A
M
N
P
I
I
-
L
C
R
S
P
D
F
R
K
A
F
K
R
L
L
A
-------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
78.28
21%
-137
- C1 -
4AMJ
12
ADRB1_MELGA
A:
[7-296]
-----------------------------------
S
Q
Q
W
E
A
G
M
S
L
L
M
A
L
V
V
L
L
I
V
A
G
N
V
L
V
I
-
A
A
I
--
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
R
Y
Q
S
----
L
M
T
R
A
-
R
A
K
V
I
-
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
H
W
W
R
-
D
---
E
D
P
Q
A
-
L
K
C
Y
Q
D
P
G
C
C
D
F
V
-
T
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
------
L
R
V
Y
R
E
A
K
E
Q-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
R
V
M
L
M
R
E
H
K
A
L
K
T
L
------
G
I
I
M
G
V
F
T
---
L
C
W
L
P
F
F
L
--
V
N
I
V
N
V
F
N
R
-------
D
L
V
P
D
W
----
L
F
V
A
--
F
N
W
-
L
G
Y
A
N
S
A
M
N
P
I
I
Y
-
C
R
S
P
D
F
R
K
A
F
K
R
L
L
A
-------------------------------------------------------------------------------------------------
46
Fugue
77.60
17%
-80
- C1 -
1U19
15
OPSD_BOVIN
A:
[4-349]
---
M
N
G
T
E
G
P
N
F
Y
V
P
F
S
N
K
T
G
V
V
R
S
P
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
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
G
D
D
E
A
S
T
T
V
S
K
T
E
------
T
S
Q
V
A
P
A
--------------------------------------------------------------
20
PsiBlast_PDB
77.09
22%
-136
- C1 -
2VT4
8
ADRB1_MELGA
A:
[10-294]
--------------------------------------
W
E
A
G
M
S
L
L
M
A
L
V
V
L
L
I
V
A
G
N
V
L
V
I
-
A
A
I
--
G
S
T
Q
R
L
Q
T
L
T
N
L
F
I
T
S
L
A
C
A
D
L
V
V
G
L
L
V
V
P
F
G
A
T
L
V
V
-
R
G
T
W
L
W
G
S
F
L
C
E
L
W
T
S
L
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
I
D
R
Y
L
A
I
T
S
P
F
R
Y
Q
S
----
L
M
T
R
A
-
R
A
K
V
I
-
I
C
T
V
W
A
I
S
A
L
V
S
F
L
P
I
M
M
H
W
W
R
-
D
---
E
D
P
Q
A
-
L
K
C
Y
Q
D
P
G
C
C
D
F
V
-
T
N
R
A
Y
A
I
A
S
S
I
I
S
F
Y
I
P
L
L
I
M
I
F
V
A
------
L
R
V
Y
R
E
A
K
E
---
Q
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
-------------------------------------------------------------------------------------------------