@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 : GRPR_HUMAN: (2016-01-10 )
MALNDCFLLNLEVDHFMHCNISSHSADLPVNDDWSHPGILYVIPAVYGVIILIGLIGNITLIKIFCTVKSMRNVPNLFISSLALGDLLLLITCAPVDASRYLADRWLFGRIGCKLIPFIQLTSVGVSVFTLTALSADRYKAIVRPMDIQASHALMKICLKAAFIWIISMLLAIPEAVFSDLHPFHEESTNQTFISCAPYPHSNELHPKIHSMASFLVFYVIPLSIISVYYYFIAKNLIQSAYNLPVEGNIHVKKQIESRKRLAKTVLVFVGLFAFCWLPNHVIYLYRSYHYSEVDTSMLHFVTSICARLLAFTNSCVNPFALYLLSKSFRKQFNTQLLCCQPGLIIRSHSTGRSTTCMTSLKSTNPSVATFSLINGNICHERYV
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..
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MALN
D
C
F
L
L
NLEV
D
H
F
M
H
CNISSHSADLPV-----NDDWSHP
G
I
L
Y
V
I
-
P
A
V
Y
G
V
I
I
L
I
G
L
IGN
I
T
L
I
K
I
F
C
T
V
K
S
M
RN
V
P
N
L
F
I
S
S
L
ALG
D
L
L
L
L
I
T
CAPV
D
A
S
R
Y
L
-
A
D
R
W
L
F
G
RIG
C
K
L
I
P
F
I
Q
L
TSVG
V
S
V
F
T
L
T
ALS
A
D
R
Y
K
A
I
---VRPMDI
Q
--
A
S
---
H
--
A
L
M
K
I
C
L
K
A
A
F
I
W
I
I
S
M
L
L
A
I
P
E
A
V
-
F
S
D
LHPFHEES---TN
Q
T
F
I
S
C-APYP-HSNE-L
H
P
K
I
H
S
M
A
S
F
L
V
F
--
Y
V
I
P
L
S
I
I
S
V
Y
Y
Y
F
I
---
A
K
N
L
I
Q
S
A
YNLPVEG--------------------------------------------------------------------------------------------------------------------------------------
N
------------------------------------------------------------------------------------------------------------------------------------------------------
I
----------------
H
V
K
K
Q
I
E
S
R
K
R
L
A
--------
K
T
V
L
V
F
V
G
L
F
A
F
C
WLPNH
V
I
Y
L
Y
R---SYHY---S
E
-----
V
D
------
T
S
M
L
H
F
V
T
S
I
--
C
A
R
L
L
A
F
T
N
SC
V
N
P
F
A
L
Y
L
L
S
K
S
F
R
K
QFN
T
Q
L
L
C
CQP
G
L
I
I
R
SHSTGRS
T
T
C
M
T
SLKSTNPS
V
A
T
F
S
LINGNICHERYV
29
HHSearch
91.04
23%
-118
- C2 -
2RH1
16
ADRB2_HUMAN (first)
A:
[40-477]
--------------------------------------------
V
V
G
M
-
G
I
V
M
S
L
I
V
L
A
I
V
F
G
N
V
L
V
I
T
A
I
A
K
F
E
R
L
Q
T
V
T
N
Y
F
I
T
S
L
A
C
A
D
L
V
M
G
L
A
V
V
P
F
G
A
A
H
I
L
-
M
K
M
W
T
F
G
N
F
W
C
E
F
W
T
S
I
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
V
D
R
Y
F
A
I
---
T
S
P
F
K
Y
Q
--
S
L
---
L
--
T
K
N
K
A
R
V
I
I
L
M
V
W
I
V
S
G
L
T
S
F
L
P
I
Q
-
M
H
W
Y
R
A
T
H
Q
E
A
I
--
N
C
Y
A
E
E
T
C
-
C
D
F
F
-------
T
N
Q
A
Y
A
I
A
S
S
I
V
S
--
F
Y
V
P
L
V
I
M
V
F
V
Y
S
R
V
---
F
Q
E
A
K
R
Q
L
N
I
F
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
TEGYYTIGIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
-
T
P
-----------------------------------------------------------------------------------------------------------------------------------------------------
N
R
A
K
R
V
I
T
T
F
R
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
---------------------------------------------
5
PsiBlast_PDB
89.91
27%
-133
- C2 -
4EA3
3
C562_ECOLX (first)
A:
[123-405]
------------------------------------------
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
QPS
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
--------------------------------------------------
36
HHSearch
87.86
21%
-118
- 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
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
---------------------------------------------
33
HHSearch
87.31
21%
-120
- C2 -
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
----SQG
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
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
----------------------------------------
26
HHSearch
87.12
21%
-106
- C2 -
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
----------------------------------------------
4
PsiBlast_PDB
85.25
25%
-113
- C2 -
2KSB
1
NK1R_HUMAN
A:
[5-323]
----------
L
P
V
D
S
D
L
S
P
N
I
S
T
N
T
S
E
--------
P
N
Q
F
V
Q
P
A
W
Q
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
P
G
D
S
--------------------------------------------------------------------------------------------------------------------------------------
S
------------------------------------------------------------------------------------------------------------------------------------------------------
D
----------------
R
Y
H
E
Q
V
S
A
K
R
K
V
V
--------
K
M
M
I
V
V
V
C
T
F
A
I
C
W
L
P
F
H
I
F
F
L
L
P
------
Y
---
I
N
-----
P
D
------
L
Y
L
K
K
F
I
Q
Q
V
Y
L
A
I
M
W
L
A
M
S
S
T
M
Y
N
P
I
I
Y
C
C
L
N
D
R
F
R
L
G
F
K
H
A
F
R
C
C
P
F
I
S
A
G
D
Y
E
G
L
E
M
K
S
T
R
Y
L
Q
T
Q
G
S
V
Y
K
V
S
R
L
E
T
T
I
S
T
V
V
G
A
---
3
PsiBlast_PDB
85.25
25%
-113
- C2 -
2KSA
1
NK1R_HUMAN
A:
[5-323]
----------
L
P
V
D
S
D
L
S
P
N
I
S
T
N
T
S
E
--------
P
N
Q
F
V
Q
P
A
W
Q
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
P
G
D
S
--------------------------------------------------------------------------------------------------------------------------------------
S
------------------------------------------------------------------------------------------------------------------------------------------------------
D
----------------
R
Y
H
E
Q
V
S
A
K
R
K
V
V
--------
K
M
M
I
V
V
V
C
T
F
A
I
C
W
L
P
F
H
I
F
F
L
L
P
------
Y
---
I
N
-----
P
D
------
L
Y
L
K
K
F
I
Q
Q
V
Y
L
A
I
M
W
L
A
M
S
S
T
M
Y
N
P
I
I
Y
C
C
L
N
D
R
F
R
L
G
F
K
H
A
F
R
C
C
P
F
I
S
A
G
D
Y
E
G
L
E
M
K
S
T
R
Y
L
Q
T
Q
G
S
V
Y
K
V
S
R
L
E
T
T
I
S
T
V
V
G
A
---
2
PsiBlast_PDB
85.25
25%
-113
- C2 -
2KS9
1
NK1R_HUMAN
A:
[5-323]
----------
L
P
V
D
S
D
L
S
P
N
I
S
T
N
T
S
E
--------
P
N
Q
F
V
Q
P
A
W
Q
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
P
G
D
S
--------------------------------------------------------------------------------------------------------------------------------------
S
------------------------------------------------------------------------------------------------------------------------------------------------------
D
----------------
R
Y
H
E
Q
V
S
A
K
R
K
V
V
--------
K
M
M
I
V
V
V
C
T
F
A
I
C
W
L
P
F
H
I
F
F
L
L
P
------
Y
---
I
N
-----
P
D
------
L
Y
L
K
K
F
I
Q
Q
V
Y
L
A
I
M
W
L
A
M
S
S
T
M
Y
N
P
I
I
Y
C
C
L
N
D
R
F
R
L
G
F
K
H
A
F
R
C
C
P
F
I
S
A
G
D
Y
E
G
L
E
M
K
S
T
R
Y
L
Q
T
Q
G
S
V
Y
K
V
S
R
L
E
T
T
I
S
T
V
V
G
A
---
6
PsiBlast_PDB
84.80
25%
-137
- C2 -
3SN6
1
R:
[188-490]
---------------------------------------------------
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
------
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
FQE
A
K
R
Q
L
Q
K
I
D
--
K
S
E
G
--------------------------------------------------------------------------------------------------------------------------------------
R
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------CLKEHKAL
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
---------------------------------------------
9
PsiBlast_PDB
83.86
27%
-130
- C2 -
4N6H
22
OPRD_HUMAN
A:
[128-412]
-----------------------------------------------
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
CHP
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
RRD
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
----------------------------------------
8
PsiBlast_PDB
83.50
27%
-128
- C2 -
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
CH
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
RRD
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
---------------------------------------------
16
PsiBlast_PDB
83.11
24%
-130
- C2 -
2VT4
8
ADRB1_MELGA
A:
[19-297]
-----------------------------------------------------
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
----------------------------------------------
45
Fugue
82.63
20%
-96
- C2 -
1F88
8
OPSD_BOVIN
A:
[1-348]
--------
M
N
G
T
E
G
P
N
F
Y
V
P
F
S
N
K
T
G
V
V
R
S
PFEAP
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
VH
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
-----------------
12
PsiBlast_PDB
82.28
25%
-130
- C2 -
4LDE
3
A:
[188-463]
---------------------------------------------------
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
F
A
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
--------------------------------------------
7
PsiBlast_PDB
82.07
27%
-133
- C2 -
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
CH
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
RRD
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
---------------------------------------------
20
PsiBlast_PDB
81.95
24%
-129
- C2 -
2YCY
6
ADRB1_MELGA
A:
[19-297]
-----------------------------------------------------
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
--
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
---------------------------------------------
27
HHSearch
81.87
23%
-122
- C2 -
3ODU
6
CXCR4_HUMAN (first)
A:
[46-496]
------------------------------------------
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
------------------------------------
10
PsiBlast_PDB
81.70
26%
-131
- C2 -
5C1M
7
?
A:
[20-296]
-----------------------------------------------
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
CH
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
---------------------------------------------------
14
PsiBlast_PDB
81.68
25%
-129
- C2 -
4LDO
3
A:
[188-463]
---------------------------------------------------
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
F
A
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
--------------------------------------------
13
PsiBlast_PDB
81.43
25%
-129
- C2 -
4LDL
3
ADRB2_HUMAN
A:
[188-463]
---------------------------------------------------
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
F
A
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
--------------------------------------------