@TOME V2.3
(Nov 2016)
Ref.
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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 : NTR1_HUMAN: (2016-01-11 )
MRLNSSAPGTPGTPAADPFQRAQAGLEEALLAPGFGNASGNASERVLAAPSSELDVNTDIYSKVLVTAVYLALFVVGTVGNTVTAFTLARKKSLQSLQSTVHYHLGSLALSDLLTLLLAMPVELYNFIWVHHPWAFGDAGCRGYYFLRDACTYATALNVASLSVERYLAICHPFKAKTLMSRSRTKKFISAIWLASALLAVPMLFTMGEQNRSADGQHAGGLVCTPTIHTATVKVVIQVNTFMSFIFPMVVISVLNTIIANKLTVMVRQAAEQGQVCTVGGEHSTFSMAIEPGRVQALRHGVRVLRAVVIAFVVCWLPYHVRRLMFCYISDEQWTPFLYDFYHYFYMVTNALFYVSSTINPILYNLVSANFRHIFLATLACLCPVWRRRRKRPAFSRKADSVSSNHTLSSNATRETLY
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)
MRLNSSAPGTPGTPAA
D
P
F
Q
R
A
Q
A
G
L
E
E
A
L
LAPGFGNASGNAS
E
R
V
LAAPSSELDV
N
T
D
I
Y
S
K
V
L
V
T
A
V
Y
L
A
L
F
V
V
GTVGN
T
V
T
A
F
T
L
A
R
K
K
S
L
Q
S
L
Q
S
T
V
H
Y
H
L
G
S
L
A
L
S
D
L
L
T
L
L
L
AM
P
V
E
L
Y
N
F
I
W
V
HHPWAFGDAG
C
R
G
Y
Y
F
L
RDAC
T
Y
A
T
A
L
N
V
A
S
L
S
V
E
R
Y
L
A
ICHPF
K
A
K
T
L
---
M
S
R
S
R
T
K
K
F
I
S
A
I
W
L
A
S
A
L
L
A
V
P
M
L
F
T-MGEQNRSAD--GQHAGG
L
V
C-----T
P
T
I
H
T
A
T
V
K
-
V
V
I
Q
V
N
T
F
M
-
S
F
I
F
P
M
V
V
I
S
V
L
N
T
I
I
A
N
K
L
T
V
M
V
R
Q
A
AEQG
Q
V
C
-----------
T
------------------------------------------V------------------G----------------------------------------------------------------------------------------------G---------------------------------------------------------------E-------------------------------------------------------------H------------------
S
-----------------------------------------------------------------------------
T
-----------
F
-----------
S
-------------
M
-------------AIEP
G
R
V
Q
A
L
R
H
--
G
V
R
V
L
R
A
V
V
I
A
F
V
V
C
W
L
P
Y
H
V
R
R
L
---
M
F
C
Y
ISDEQ--W
T
P
F
L
Y
D
F
Y
H
Y
F
Y
M
V
T
N
A
L
F
Y
V
S
ST
I
N
P
I
L
Y
N
L
V
SA
N
F
R
H
I
F
L
A
T
L
A
C
L
C
P
V
W
R
R
RRKR-PAFSRKADSVSSNHTLSSNATRETLY
2
PsiBlast_PDB
98.71
83%
-141
- C2 -
4BUO
10
NTR1_RAT
A:
[6-320]
--------------------------------------------------
N
S
D
L
D
V
N
T
D
I
Y
S
K
V
L
V
T
A
I
Y
L
A
L
F
V
V
G
T
V
G
N
S
V
T
L
F
T
L
A
R
K
K
---
S
L
Q
S
T
V
D
Y
Y
L
G
S
L
A
L
S
D
L
L
I
L
L
L
A
M
P
V
E
L
Y
N
F
I
W
V
H
H
P
W
A
F
G
D
A
G
C
R
G
Y
Y
F
L
R
D
A
C
T
Y
A
T
A
L
N
V
V
S
L
S
V
E
L
Y
L
A
I
C
H
P
F
K
A
K
T
L
---
M
S
R
S
R
T
K
K
F
I
S
A
I
W
L
A
S
A
L
L
A
I
P
M
L
F
T
-
M
G
L
Q
N
L
S
G
D
--
G
T
H
P
G
G
L
V
C
-----
T
P
I
V
D
T
A
T
L
K
-
V
V
I
Q
V
N
T
F
M
-
S
F
L
F
P
M
L
V
A
S
I
L
N
T
V
I
A
N
K
L
T
V
M
V
H
Q
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
G
R
V
Q
A
L
R
R
--
G
V
L
V
L
R
A
V
V
I
A
F
V
V
C
W
L
P
Y
H
V
R
R
L
---
M
F
C
Y
I
S
D
E
Q
--
W
T
T
F
L
F
D
F
Y
H
Y
F
Y
M
L
T
N
A
L
V
Y
V
S
A
A
I
N
P
I
L
Y
N
L
V
S
A
N
F
R
Q
V
F
L
S
T
L
----------------------------------------
22
PsiBlast_CBE
98.69
83%
-144
- C2 -
4BUO
5
NTR1_RAT
B:
[3-322]
-----------------------------------------------
S
G
P
N
S
D
L
D
V
N
T
D
I
Y
S
K
V
L
V
T
A
I
Y
L
A
L
F
V
V
G
T
V
G
N
S
V
T
L
F
T
L
A
R
------
L
Q
S
T
V
D
Y
Y
L
G
S
L
A
L
S
D
L
L
I
L
L
L
A
M
P
V
E
L
Y
N
F
I
W
V
H
H
P
W
A
F
G
D
A
G
C
R
G
Y
Y
F
L
R
D
A
C
T
Y
A
T
A
L
N
V
V
S
L
S
V
E
L
Y
L
A
I
C
H
P
F
K
A
K
T
L
---
M
S
R
S
R
T
K
K
F
I
S
A
I
W
L
A
S
A
L
L
A
I
P
M
L
F
T
-
M
G
L
Q
N
L
S
G
D
--
G
T
H
P
G
G
L
V
C
-----
T
P
I
V
D
T
A
T
L
K
-
V
V
I
Q
V
N
T
F
M
-
S
F
L
F
P
M
L
V
A
S
I
L
N
T
V
I
A
N
K
L
T
V
M
V
H
Q
A
A
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
-----------
N
-------------
M
-------------
T
I
E
P
G
R
V
Q
A
L
R
R
--
G
V
L
V
L
R
A
V
V
I
A
F
V
V
C
W
L
P
Y
H
V
R
R
L
---
M
F
C
Y
I
S
D
E
Q
--
W
T
T
F
L
F
D
F
Y
H
Y
F
Y
M
L
T
N
A
L
V
Y
V
S
A
A
I
N
P
I
L
Y
N
L
V
S
A
N
F
R
Q
V
F
L
S
T
L
A
C
--------------------------------------
1
PsiBlast_PDB
98.32
83%
-141
- C2 -
3ZEV
6
NTR1_RAT
A:
[6-325]
-------------------------------------------------
P
N
S
D
L
D
V
N
T
D
I
Y
S
K
V
L
V
T
A
I
Y
L
A
L
F
V
V
G
T
V
G
N
S
V
T
L
F
T
L
A
R
K
K
---
S
L
Q
S
T
V
D
Y
Y
L
G
S
L
A
L
S
D
L
L
I
L
L
L
A
M
P
V
E
L
Y
N
F
I
W
V
H
H
P
W
A
F
G
D
A
G
C
R
G
Y
Y
F
L
R
D
A
C
T
Y
A
T
A
L
N
V
V
S
L
S
V
E
L
Y
L
A
I
C
H
P
F
K
A
K
T
L
---
M
S
R
S
R
T
K
K
F
I
S
A
I
W
L
A
S
A
L
L
A
I
P
M
L
F
T
-
M
G
L
Q
N
L
S
G
D
--
G
T
H
P
G
G
L
V
C
-----
T
P
I
V
D
T
A
T
L
K
-
V
V
I
Q
V
N
T
F
M
-
S
F
L
F
P
M
L
V
A
S
I
L
N
T
V
I
A
N
K
L
T
V
M
V
H
Q
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
G
R
V
Q
A
L
R
R
--
G
V
L
V
L
R
A
V
V
I
A
F
V
V
C
W
L
P
Y
H
V
R
R
L
---
M
F
C
Y
I
S
D
E
Q
--
W
T
T
F
L
F
D
F
Y
H
Y
F
Y
M
L
T
N
A
L
V
Y
V
S
A
A
I
N
P
I
L
Y
N
L
V
S
A
N
F
R
Q
V
F
L
S
T
L
A
C
--------------------------------------
21
PsiBlast_CBE
98.29
83%
-144
- C2 -
3ZEV
2
NTR1_RAT
B:
[6-325]
-------------------------------------------------
P
N
S
D
L
D
V
N
T
D
I
Y
S
K
V
L
V
T
A
I
Y
L
A
L
F
V
V
G
T
V
G
N
S
V
T
L
F
T
L
A
------
S
L
Q
S
T
V
D
Y
Y
L
G
S
L
A
L
S
D
L
L
I
L
L
L
A
M
P
V
E
L
Y
N
F
I
W
V
H
H
P
W
A
F
G
D
A
G
C
R
G
Y
Y
F
L
R
D
A
C
T
Y
A
T
A
L
N
V
V
S
L
S
V
E
L
Y
L
A
I
C
H
P
F
K
A
K
T
L
---
M
S
R
S
R
T
K
K
F
I
S
A
I
W
L
A
S
A
L
L
A
I
P
M
L
F
T
-
M
G
L
Q
N
L
S
G
D
--
G
T
H
P
G
G
L
V
C
-----
T
P
I
V
D
T
A
T
L
K
-
V
V
I
Q
V
N
T
F
M
-
S
F
L
F
P
M
L
V
A
S
I
L
N
T
V
I
A
N
K
L
T
V
M
V
---------------------
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
P
G
R
V
Q
A
L
R
R
--
G
V
L
V
L
R
A
V
V
I
A
F
V
V
C
W
L
P
Y
H
V
R
R
L
---
M
F
C
Y
I
S
D
E
Q
--
W
T
T
F
L
F
D
F
Y
H
Y
F
Y
M
L
T
N
A
L
V
Y
V
S
A
A
I
N
P
I
L
Y
N
L
V
S
A
N
F
R
Q
V
F
L
S
T
L
A
C
--------------------------------------
4
PsiBlast_PDB
96.19
79%
-146
- C2 -
4BV0
1
NTR1_RAT
A:
[7-326]
--------------------------------------------------
N
S
D
L
D
V
N
T
D
I
Y
S
K
V
L
V
T
A
I
Y
L
A
L
F
V
V
G
T
V
G
N
G
V
T
L
F
T
L
A
R
K
-------
S
R
V
D
Y
Y
L
G
S
L
A
L
S
D
L
L
I
L
L
F
A
L
P
V
D
V
Y
N
F
I
W
V
H
H
P
W
A
F
G
D
A
G
C
K
G
Y
Y
F
L
R
E
A
C
T
Y
A
T
A
L
N
V
V
S
L
S
V
E
L
Y
L
A
I
R
H
P
-----
L
---
M
S
R
S
R
T
K
K
F
I
S
A
I
W
L
A
S
A
L
L
A
I
P
M
L
F
T
-
V
G
L
Q
N
L
S
G
D
--
G
T
H
P
G
G
L
V
C
-----
T
P
I
V
D
T
A
T
L
K
-
V
V
I
Q
L
N
T
F
M
-
S
F
L
F
P
M
L
V
A
S
I
L
N
T
V
I
A
R
R
L
T
V
M
V
H
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
G
R
V
Q
A
L
R
R
--
G
V
L
V
L
R
A
M
V
I
A
F
V
V
C
W
L
P
Y
H
V
R
R
L
---
M
F
V
Y
I
S
D
E
Q
--
W
T
T
A
L
F
D
F
Y
H
Y
F
Y
M
L
S
N
A
L
V
Y
V
S
A
A
I
N
P
I
L
Y
N
L
V
S
A
N
F
R
Q
V
F
L
S
T
L
A
C
L
-------------------------------------
23
PsiBlast_CBE
96.17
80%
-142
- C2 -
4BWB
1
NTR1_RAT
B:
[8-323]
---------------------------------------------------
S
D
L
D
V
N
T
D
I
Y
S
K
V
L
V
T
A
I
Y
L
A
L
F
V
V
G
T
V
G
N
G
V
T
L
F
T
L
A
R
K
K
------
S
R
V
D
Y
Y
L
G
S
L
A
L
S
D
L
L
I
L
L
F
A
L
P
V
D
L
Y
N
F
I
W
V
H
H
P
W
A
F
G
D
A
G
C
K
G
Y
Y
F
L
R
E
A
C
T
Y
A
T
A
L
N
V
V
S
L
S
V
E
L
Y
L
A
I
C
H
P
--
A
K
T
L
---
M
S
R
S
R
T
K
K
F
I
S
A
I
W
L
A
S
A
L
L
A
I
P
M
L
F
T
-
M
G
L
Q
N
L
S
G
D
--
G
T
H
P
G
G
L
V
C
-----
T
P
I
V
D
T
A
T
L
R
-
V
V
I
Q
L
N
T
F
M
-
S
F
L
F
P
M
L
V
A
S
I
L
N
T
V
A
A
R
R
L
T
V
M
V
H
Q
A
A
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
G
R
V
Q
A
L
R
R
--
G
V
L
V
L
R
A
V
V
I
A
F
V
V
C
W
L
P
Y
H
V
R
R
L
---
M
F
V
Y
I
S
D
E
Q
--
W
T
T
A
L
F
D
F
Y
H
Y
F
Y
M
L
S
N
A
L
V
Y
V
S
A
A
I
N
P
I
L
Y
N
L
V
S
A
N
F
R
Q
V
F
L
S
T
L
----------------------------------------
3
PsiBlast_PDB
96.13
80%
-144
- C2 -
4BWB
1
NTR1_RAT
A:
[7-327]
--------------------------------------------------
N
S
D
L
D
V
N
T
D
I
Y
S
K
V
L
V
T
A
I
Y
L
A
L
F
V
V
G
T
V
G
N
G
V
T
L
F
T
L
A
-----
Q
S
L
Q
S
R
V
D
Y
Y
L
G
S
L
A
L
S
D
L
L
I
L
L
F
A
L
P
V
D
L
Y
N
F
I
W
V
H
H
P
W
A
F
G
D
A
G
C
K
G
Y
Y
F
L
R
E
A
C
T
Y
A
T
A
L
N
V
V
S
L
S
V
E
L
Y
L
A
I
C
H
P
F
K
A
K
T
L
---
M
S
R
S
R
T
K
K
F
I
S
A
I
W
L
A
S
A
L
L
A
I
P
M
L
F
T
-
M
G
L
Q
N
L
S
G
D
--
G
T
H
P
G
G
L
V
C
-----
T
P
I
V
D
T
A
T
L
R
-
V
V
I
Q
L
N
T
F
M
-
S
F
L
F
P
M
L
V
A
S
I
L
N
T
V
A
A
R
R
L
T
V
M
V
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
P
G
R
V
Q
A
L
R
R
--
G
V
L
V
L
R
A
V
V
I
A
F
V
V
C
W
L
P
Y
H
V
R
R
L
---
M
F
V
Y
I
S
D
E
Q
--
W
T
T
A
L
F
D
F
Y
H
Y
F
Y
M
L
S
N
A
L
V
Y
V
S
A
A
I
N
P
I
L
Y
N
L
V
S
A
N
F
R
Q
V
F
L
S
T
L
A
C
L
C
------------------------------------
24
PsiBlast_CBE
94.13
79%
-146
- C2 -
4BV0
1
NTR1_RAT
B:
[6-328]
-------------------------------------------------
P
N
S
D
L
D
V
N
T
D
I
Y
S
K
V
L
V
T
A
I
Y
L
A
L
F
V
V
G
T
V
G
N
G
V
T
L
F
T
L
A
R
------
L
Q
S
R
V
D
Y
Y
L
G
S
L
A
L
S
D
L
L
I
L
L
F
A
L
P
V
D
V
Y
N
F
I
W
V
H
H
P
W
A
F
G
D
A
G
C
K
G
Y
Y
F
L
R
E
A
C
T
Y
A
T
A
L
N
V
V
S
L
S
V
E
L
Y
L
A
I
R
H
P
F
K
H
K
T
----
M
S
R
S
R
T
K
K
F
I
S
A
I
W
L
A
S
A
L
L
A
I
P
M
L
F
T
-
V
G
L
Q
N
L
S
G
D
--
G
T
H
P
G
G
L
V
C
-----
T
P
I
V
D
T
A
T
L
K
-
V
V
I
Q
L
N
T
F
M
-
S
F
L
F
P
M
L
V
A
S
I
L
N
T
V
I
A
R
R
L
T
V
M
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
V
Q
A
L
R
R
--
G
V
L
V
L
R
A
M
V
I
A
F
V
V
C
W
L
P
Y
H
V
R
R
L
---
M
F
V
Y
I
S
D
E
Q
--
W
T
T
A
L
F
D
F
Y
H
Y
F
Y
M
L
S
N
A
L
V
Y
V
S
A
A
I
N
P
I
L
Y
N
L
V
S
A
N
F
R
Q
V
F
L
S
T
L
A
C
L
C
P
-----------------------------------
31
HHSearch
75.65
25%
-123
- C2 -
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
T
------------------------------------------
E
------------------
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
T
G
T
-------------
W
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
--------------------------------------
28
HHSearch
74.61
19%
-111
- C2 -
3EML
13
ENLYS_BPT4
A:
[22-471]
---------------------------------------------------------------
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
---SQ
G
C
G
E
G
Q
V
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
-----------
G
LRL
K
I
Y
K
D
TEGYYTIGIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNT
N
------------------
G
VIT
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
TG
T
-------------
W
-------------
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
---------------------------------
27
HHSearch
72.32
19%
-108
- C2 -
2RH1
16
ADRB2_HUMAN (first)
A:
[39-477]
-------------------------------------------------------------
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
TEGYYTIGIGHLLT--------------------
K
------------------
S
PS
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
TG--
T
-------------
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
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
--------------------------------------
25
HHSearch
70.10
21%
-114
- C2 -
3UON
4
ACM2_HUMAN (first)
A:
[24-457]
---------------------------------------------------------------
V
F
I
V
L
V
A
G
S
L
S
L
V
T
I
I
G
N
I
L
V
M
V
S
I
K
V
N
R
---
H
L
Q
T
V
N
N
Y
F
L
F
S
L
A
C
A
D
L
I
I
G
V
F
S
M
N
L
Y
T
L
Y
T
--
V
I
G
Y
W
P
L
G
P
V
V
C
D
L
W
L
A
L
D
Y
V
V
S
N
A
S
V
M
N
L
L
I
I
S
F
D
R
Y
F
C
V
T
K
P
L
T
Y
P
V
K
---
R
T
T
K
M
A
G
M
M
I
A
A
A
W
V
L
S
F
I
L
W
A
P
A
I
L
F
-
W
Q
F
I
V
G
V
-----
R
T
V
E
D
G
E
C
-----
Y
I
Q
F
F
S
--
N
A
-
A
V
T
F
G
T
A
I
A
-
A
F
Y
L
P
V
I
I
M
T
V
L
Y
W
H
I
S
R
A
S
K
S
R
I
N
I
F
E
M
L
R
I
D
E
-----------
G
LRL
K
I
Y
K
D
TEG
Y
Y
T
I
GIGHLLTKS------------------
P
S
L
N
A
A
K
S
E
L
D
K
A
I
GRNTN
G
VIT-------------------------------------------------------------------------------------------
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
TGT
W
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
69.03
26%
-122
- C2 -
2Y01
12
ADRB1_MELGA
A:
[16-300]
----------------------------------------------------------------
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
------------------------
10
PsiBlast_PDB
68.88
26%
-125
- C2 -
2Y03
9
ADRB1_MELGA
A:
[16-300]
----------------------------------------------------------------
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
------------------------
18
PsiBlast_PDB
68.71
26%
-122
- C2 -
2VT4
8
ADRB1_MELGA
A:
[16-298]
----------------------------------------------------------------
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
------------------------
12
PsiBlast_PDB
68.67
26%
-121
- C2 -
4AMJ
12
ADRB1_MELGA
A:
[16-300]
----------------------------------------------------------------
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
------------------------
7
PsiBlast_PDB
68.66
26%
-125
- C2 -
2Y00
13
ADRB1_MELGA
A:
[16-300]
----------------------------------------------------------------
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
------------------------
29
HHSearch
68.56
22%
-122
- C2 -
3ODU
6
CXCR4_HUMAN (first)
A:
[45-496]
-----------------------------------------------------------
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
TE--------
G
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
T
G
-----------
T
-------------
W
-------------
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
-----------------------------
17
PsiBlast_PDB
68.52
24%
-123
- C2 -
4RWD
7
C562_ECOLX (first)
A:
[123-402]
---------------------------------------------------------------
I
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
----------------------------------------
6
PsiBlast_PDB
68.46
26%
-125
- C2 -
4EA3
3
C562_ECOLX (first)
A:
[125-404]
--------------------------------------------------------------
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
-------------------------------------------