@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 : GASR_HUMAN: (2016-01-09 )
MELLKLNRSVQGTGPGPGASLCRPGAPLLNSSSVGNLSCEPPRIRGAGTRELELAIRITLYAVIFLMSVGGNMLIIVVLGLSRRLRTVTNAFLLSLAVSDLLLAVACMPFTLLPNLMGTFIFGTVICKAVSYLMGVSVSVSTLSLVAIALERYSAICRPLQARVWQTRSHAARVIVATWLLSGLLMVPYPVYTVVQPVGPRVLQCVHRWPSARVRQTWSVLLLLLLFFIPGVVMAVAYGLISRELYLGLRFDGDSDSDSQSRVRNQGGLPGAVHQNGRCRPETGAVGEDSDGCYVQLPRSRPALELTALTAPGPGSGSRPTQAKLLAKKRVVRMLLVIVVLFFLCWLPVYSANTWRAFDGPGAHRALSGAPISFIHLLSYASACVNPLVYCFMHRRFRQACLETCARCCPRPPRARPRALPDEDPPTPSIASLSRLSYTTISTLGPG
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.......420------........430.......440.....-----
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
M
E
L
L
KLNRSVQGTGPGPGASLCRPGAPLLNSSSVGNLSCEPPRIRGAGT
R
E
L
E
L
A
I
R
I
T
L
Y
A
V
I
F
---------
L
M
SVGG
N
M
L
I
I
V
VLG
L
S
R
R
L
R
T
V
T
N
A
F
L
L
S
L
A
V
S
D
L
L
L
A
V
A
C
-
M
P
F
T
L
L
P
N
L
M
-
G
T
F
I
F
G
T
------
V
I
C
K
A
V
S
Y
L
MGV
S
V
S
V
S
T
L
S
L
V
A
I
A
L
E
R
Y
S
A
I
C
R
P
L
Q
A
R
V
W
---QTRSH
A
A
R
V
I
V
A
T
W
L
L
S
G
L
L
-MVPY
P
V
-
Y
T
V
VQPV--
G
P
R
V
L
---
Q
-------
C
V
H
RWP-----
S
--
A
R
---
V
--
R
-----
Q
T
W
S
V
L
L
L
---
L
L
L
F
FI
P
G
V
V
M
A
V
A
Y
G
L
I
S
R
E
-----
L
Y
---------------
L
G
L
R
FD----------G--DSDS-------
D
S
Q
----
S
R
--
V
-------R------------------------N------------Q----------G-------G------------------------------------------L------------P--G-------AVH------------Q----------------------N----------G-------------R----------C-----R----------------P---------------------ET--G----------------A---V--G---------------------------------------ED--------S----------------------------D-------------------G------------------
C
---------------
Y
V
-Q--LPRS------R-----P------
A
L
----------
E
-----------
L
--------
T
A
------------
L
TA-------P--------GPGSGSR
P
-
T
Q
A
-
K
L
L
A
K
--------
K
R
V
V
R
M
L
L
V
I
V
V
L
F
F
L
C
W
L
P---VYSANTW-----RAFDG------PG------AHRALSGA
P
I
S
F
I
H
-----------------------------
L
L
S
Y
A
S
A
C
V
N
P
L
V
Y
C
F
M
H
R
R
F
R
Q
A
C
L
--
E
T
C
A
R
CCPRPPRARPRALP-------DEDPPT
P
S
I
A
S
L
S
RL
S
Y
T
T
I
STLGPG-----
70
HHSearch
85.21
23%
-134
- C7 -
2RH1
16
ADRB2_HUMAN (first)
A:
[38-477]
---------------------------------------------------
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
CC---
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
GR
N
-------
T
------------------------------------------
N
------------
G
--
V
-------
I
T
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
---------------------------------------
M
G
--------
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
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
----------------------------------------------------
66
HHSearch
83.89
21%
-117
- C7 -
3ODU
6
CXCR4_HUMAN (first)
A:
[41-497]
----------------------------------------------
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
NAKL
K
----------------
P
---------------------
V
Y
--
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
M
---
G
--
E
---------------------------------------
T
G
--------
V
----------------------------
A
-------------------
G
F
T
N
S
L
R
M
L
Q
Q
K-------
R
---------------
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
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
-------------------------------------------
72
HHSearch
82.92
22%
-135
- C7 -
3RZE
5
ENLYS_BPT4 (first)
A:
[9-442]
------------------------------------------------------
M
P
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
------------
T
----------
E
-------
G
------------------------------------------
Y
Y
T
I
G
IGHLLTKS
P
S
L
N
-------
A
A
K
------------
S
----------------------
E
L
D
K
A
I
GRNTN
G
V------------
I
----------
T
-----
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
L
D
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
K
----------
R
-----------
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
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
----------------------------------------------------
76
HHSearch
82.80
22%
-130
- C7 -
3PBL
2
DRD3_HUMAN (first)
A:
[41-472]
--------------------------------------------------------
Y
A
L
S
Y
C
A
L
I
---------
L
A
I
V
F
G
N
G
L
V
C
M
A
V
L
K
E
R
A
L
Q
T
T
T
N
Y
L
V
V
S
L
A
V
A
D
L
L
V
A
T
L
V
-
M
P
W
V
V
Y
L
E
V
T
G
G
V
W
N
F
S
R
------
I
C
C
D
V
F
V
T
L
D
V
M
M
C
T
A
S
I
W
N
L
C
A
I
S
I
D
R
Y
T
A
V
V
M
P
V
H
Y
Q
H
G
T
G
Q
S
S
C
R
R
V
A
L
M
I
T
A
V
W
V
L
A
F
A
V
-
S
C
P
L
L
F
-
G
F
N
T
T
-----
G
D
P
T
---
V
-------
C
S
I
S
N
P
-----------------------
D
F
V
I
Y
S
S
---
V
V
S
F
Y
L
P
F
G
V
T
V
L
V
Y
A
R
I
Y
V
V
-----
L
K
---------------
Q
R
R
R
K
N
----------
I
--
F
E
M
L
-------
R
I
D
----
E
G
LR
L
K
I
Y
K
D
TE
G
------------------------
Y
------------
Y
T
I
--------
G
-------
I
------------------------------------------
G
------------
H
--
L
-------
L
T
K
------------
S
----------------------
P
----------
S
L
N
A
A
K
S
E
L
D
K
A
I
G
R
----------
N
-----
T
----------------
N
---------------------
G
V
IT
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
------
K
R
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
----------------------------------------------------
10
PsiBlast_PDB
81.72
24%
-129
- C8 -
4U15
6
ACM3_RAT
A:
[8-392]
----------------------------------------------------------
T
I
W
Q
V
V
F
I
A
F
L
T
G
F
L
A
L
V
T
I
I
G
N
I
L
V
I
V
A
F
K
V
N
K
Q
L
K
T
V
N
N
Y
F
L
L
S
L
A
C
A
D
L
I
I
G
V
I
S
-
M
N
L
F
T
T
Y
I
I
M
-
N
R
W
A
L
G
N
------
L
A
C
D
L
W
L
S
I
D
Y
V
A
S
N
A
S
V
M
N
L
L
V
I
S
F
D
R
Y
F
S
I
T
R
P
L
T
Y
R
A
K
---
R
T
T
K
R
A
G
V
M
I
G
L
A
W
V
I
S
F
V
L
-
W
A
P
A
I
L
-
F
W
-
Q
Y
F
V
--
G
K
R
T
V
PPG
E
-------
C
F
I
Q
F
L
-----
S
----------
E
-----
P
T
I
T
F
G
T
A
---
I
A
A
F
Y
M
P
V
T
I
M
T
I
L
Y
W
R
I
Y
K
E
T
EKMN
I
F
---------------
E
M
L
R
I
D
----------
E
GG
G
S
G
G
-------
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
L
I
K
E
--------
K
K
A
A
Q
T
L
S
A
I
L
L
A
F
I
I
T
W
T
P
Y
N
I
M
V
L
V
N
T
F
-----
C
D
S
C
I
------
P
K
------
T
Y
W
N
L
G
-------
Y
-----------------------------
W
L
C
Y
I
N
S
T
V
N
P
V
C
Y
A
L
C
N
K
T
F
R
T
T
F
K
--
T
L
-------------------------------------------------------
11
PsiBlast_PDB
81.06
24%
-126
- C8 -
4U16
2
?
A:
[8-388]
----------------------------------------------------------
T
I
W
Q
V
V
F
I
A
F
L
T
G
F
L
A
L
V
T
I
I
G
N
I
L
V
I
V
A
F
K
V
N
K
Q
L
K
T
V
N
N
Y
F
L
L
S
L
A
C
A
D
L
I
I
G
V
I
S
-
M
N
L
F
T
T
Y
I
I
M
-
N
R
W
A
L
G
N
------
L
A
C
D
L
W
L
S
I
D
Y
V
A
S
N
A
S
V
M
N
L
L
V
I
S
F
D
R
Y
F
S
I
T
R
P
L
T
Y
R
A
K
---
R
T
T
K
R
A
G
V
M
I
G
L
A
W
V
I
S
F
V
L
-
W
A
P
A
I
L
-
F
W
-
Q
Y
F
V
--
G
K
R
T
V
PPG
E
-------
C
F
I
Q
F
L
-----
S
----------
E
-----
P
T
I
T
F
G
T
A
---
I
A
A
F
Y
M
P
V
T
I
M
T
I
L
Y
W
R
I
Y
K
E
T
EKMN
I
F
---------------
E
M
L
R
I
D
----------
E
GG
G
S
G
G
-------
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
L
I
K
E
--------
K
K
A
A
Q
T
L
S
A
I
L
L
A
F
I
I
T
W
T
P
Y
N
I
M
V
L
V
N
T
F
-----
C
D
S
C
I
------
P
K
------
T
Y
W
N
L
G
-------
Y
-----------------------------
W
L
C
Y
I
N
S
T
V
N
P
V
C
Y
A
L
C
N
-------------------------------------------------------------------
74
HHSearch
80.22
22%
-121
- C7 -
3EML
13
ENLYS_BPT4
A:
[20-472]
----------------------------------------------------
G
S
S
V
Y
I
T
V
E
L
A
I
A
---------
V
L
A
I
L
G
N
V
L
V
C
W
A
V
W
L
N
S
N
L
Q
N
V
T
N
Y
F
V
V
S
L
A
A
A
D
I
A
V
G
V
L
A
-
I
P
F
A
I
T
I
S
T
---
G
F
C
A
A
C
------
H
G
C
L
F
I
A
C
F
V
L
V
L
T
Q
S
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
R
I
P
L
R
Y
N
G
L
---
V
T
G
T
R
A
K
G
I
I
A
I
C
W
V
L
S
F
A
I
-
G
L
T
P
M
L
-
G
W
N
N
C
G
Q
-----
S
Q
---
G
-------
C
G
E
G
Q
V
ACLFE
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
----
L
R
--
L
-------
K
------------------------
I
------------
Y
----------
K
D
TEGYYT
I
------------------------------------------
G
IGHLLTKSPS--
L
--
N
-------
A
A
K
------------
S
----------------------
E
----------
L
-------------
D
K
A
I
GRNTNGV
I
-----
T
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
------
K
R
----------
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
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
-----------------------------------------------
58
Fugue
79.68
22%
-129
- C7 -
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
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
TN
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
--------------------------
62
Fugue
78.96
19%
-138
- C7 -
4XNV
15
P2RY1_HUMAN (first)
A:
[38-382]
-----------------------------------
S
F
K
C
A
L
T
K
------
T
G
F
Q
F
Y
Y
L
P
A
V
Y
I
L
V
F
---------
I
I
G
F
L
G
N
S
V
A
I
W
M
F
V
F
H
M
K
P
W
S
G
I
S
V
Y
M
F
N
L
A
L
A
D
F
L
Y
V
L
T
L
-
P
A
L
I
F
Y
Y
F
N
K
-
T
D
W
I
F
G
D
------
A
M
C
K
L
Q
R
F
I
F
H
V
N
L
Y
G
S
I
L
F
L
T
C
I
S
A
H
R
Y
S
G
V
V
Y
P
-
K
S
L
G
R
---
L
K
K
K
N
A
I
C
I
S
V
L
V
W
L
I
V
V
V
A
-
I
S
P
I
L
F
-
Y
S
G
T
G
V
R
--
K
N
K
T
I
---
T
-------
C
Y
D
T
T
S
-----
D
EY
L
R
---
S
--
Y
-----
F
I
Y
S
M
C
T
T
---
V
A
M
F
C
V
P
L
V
L
I
L
G
C
Y
G
L
I
V
R
A
-----
L
I
---------------
Y
K
M
K
---------------------------------------------
K
------------------------
Y
------------
T
----------
C
-------
T
------------------------------------------
V
------------
C
--
G
-------
Y
I
Y
------------
N
----------------------
P
----------
E
-------------
D
----------
G
-----
D
----------------
P
---------------------
D
N
--
G
----------------
V
------------------------------------------------------------------------------------------------------------------------------------------------------------
N
-----
P
------
G
T
----------
D
-----------
F
--------
K
D
------------
I
V
C
-------
P
--------
L
C
G
V
G
K
D
Q
F
E
E
V
-
E
E
P
L
R
--------
R
K
S
I
Y
L
V
I
I
V
L
T
V
F
A
V
S
Y
I
P
---
F
H
V
M
K
T
M
N
L
R
A
R
L
D
F
Q
T
------
P
A
M
C
----
A
F
N
D
R
V
Y
A
T
Y
Q
V
T
R
-----------------------------
G
L
A
S
L
N
S
C
V
N
P
I
L
Y
F
L
A
G
D
T
F
R
R
R
-------------------------------------------------------------
68
HHSearch
78.86
22%
-121
- C7 -
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
G
VR
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
----
L
R
--
L
-------
K
------------------------
I
------------
Y
----------
K
D
TE----
G
Y
Y
T
I
GI------------------------------------
G
------------
H
--
L
-------
L
T
K
------------
S
PS
L
N
A
A
K
S
--------------
E
L
D
K
A
I
GRNTN
G
-------------
V
----------
I
-----
T
----------------
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
K
----------
R
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
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
-----------------------------------------------------
12
PsiBlast_PDB
78.70
22%
-133
- C8 -
4MBS
8
CCR5_HUMAN (first)
A:
[21-362]
-------------------------------------
P
C
Q
K
I
N
V
K
Q
I
A
A
R
L
L
P
-----
P
L
Y
S
L
V
F
---------
I
F
G
F
V
G
N
M
L
V
I
L
I
L
I
N
Y
K
R
L
K
S
M
T
D
I
Y
L
L
N
L
A
I
S
D
L
F
F
L
L
T
--
V
P
F
-
W
A
H
Y
A
A
-
A
Q
W
D
F
G
N
------
T
M
C
Q
L
L
T
G
L
Y
F
I
G
F
F
S
G
I
F
F
I
I
L
L
T
I
D
R
Y
L
A
V
V
H
A
V
F
A
L
K
A
---
R
T
V
T
F
G
V
V
T
S
V
I
T
W
V
V
A
V
F
A
-
S
L
P
N
I
I
-
F
T
R
S
Q
K
E
--
G
L
H
-
Y
---
T
-------
C
S
S
H
F
P
-----
Y
--
S
Q
---
Y
--
Q
F
W
K
N
F
Q
T
L
K
I
V
I
L
---
G
L
V
--
L
P
L
L
V
M
V
I
C
Y
S
G
I
L
K
T
-----
L
------------------
L
R
M
K
-------------------------------------------
K
------------------------
Y
------------
T
----------
C
-------
T
------------------------------------------
V
------------
C
--
G
-------
Y
I
Y
------------
N
----------------------
P
----------
E
-------------
D
----------
G
-----
D
----------------
P
---------------------
D
N
--
G
--------------------
V
--
N
---------------------------------------
P
G
--------
T
----------------------------
D
-------------------
F
------------------------------------------
K
D
------
I
-----
P
------
D
D
----------
W
-----------
V
--------
C
P
------------
L
C
G
-------
V
--------
G
K
D
Q
F
E
E
V
-
E
E
E
-
K
--
K
R
--------
H
R
D
V
R
L
I
F
T
I
M
I
V
Y
F
L
F
W
A
P
Y
N
I
V
L
L
L
N
T
F
-----
Q
E
F
F
G
LNN
C
--
S
S
------
S
N
R
L
D
Q
A
M
Q
V
T
--
E
-----------------------------
T
L
G
M
T
H
C
C
I
N
P
I
I
Y
A
F
V
G
E
E
F
R
N
Y
L
L
--
V
F
F
Q
-----------------------------------------------------
56
Fugue
78.49
24%
-110
- C7 -
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
TN
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
-----
2
PsiBlast_PDB
78.32
25%
-132
- C8 -
4IB4
9
5HT2B_HUMAN (first)
A:
[43-406]
----------------------------------------------------------------------------
T
I
G
G
N
T
L
V
I
L
A
V
S
L
E
K
K
L
Q
Y
A
T
N
Y
F
L
M
S
L
A
V
A
D
L
L
V
G
L
F
V
-
M
P
I
A
L
L
------
T
I
M
F
E
A
MWPLP
L
V
L
C
P
A
W
L
F
L
D
V
L
F
S
T
A
S
I
W
H
L
C
A
I
S
V
D
R
Y
I
A
I
K
K
P
I
Q
A
N
Q
Y
---
N
S
R
A
T
A
F
I
K
I
T
V
V
W
L
I
S
I
G
I
-
A
I
P
V
P
I
-
K
G
I
E
T
----
N
P
N
N
I
---
T
-------
C
V
-------------
L
---
T
--
K
-----
E
R
F
G
D
F
M
L
F
G
S
L
A
A
F
F
T
P
L
A
I
M
I
V
T
Y
F
L
T
I
H
A
-----
L
Q
K
K
A
A
D
----------
L
E
D
N
W
E
----------
T
--
L
N
D
N
L
K
V
I
E
K
A
D
N
A
----
A
Q
--
V
-------
K
------------------------
D
A
L
T
K
M
R
A
A
A
LDA
Q
----------
K
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
----------------
D
---
F
--
R
---------------------------------------
H
G
--------
F
----------------------------
D
-------------------
I
------------------
L
---------------
V
G
-
Q
--
I
D
D
A
L
-----
K
-----
L
------
A
N
----------
E
-----------
G
--------
K
V
------------
K
E
A
-------
Q
--------
A
A
A
E
Q
L
K
T
-
T
R
N
-
A
Y
I
Q
K
Y
L
Q
T
I
S
N
E
Q
R
A
S
K
V
L
G
I
V
F
F
L
F
L
L
M
W
C
P
---
F
F
I
T
N
I
T
-----
L
V
L
C
D
------
S
C
------
N
Q
T
T
L
Q
M
L
L
E
I
F
V
W
------------------------------
I
G
Y
V
S
S
G
V
N
P
L
V
Y
T
L
F
N
K
T
F
R
D
A
F
G
--
R
Y
I
T
C
N
Y
R
-------------------------------------------------
3
PsiBlast_PDB
77.28
25%
-133
- C8 -
4NC3
11
C562_ECOLX
A:
[43-406]
----------------------------------------------------------------------------
T
I
G
G
N
T
L
V
I
L
A
V
S
L
E
K
K
L
Q
Y
A
T
N
Y
F
L
M
S
L
A
V
A
D
L
L
V
G
L
F
V
-
M
P
I
A
L
L
------
T
I
M
F
E
A
MWPLP
L
V
L
C
P
A
W
L
F
L
D
V
L
F
S
T
A
S
I
W
H
L
C
A
I
S
V
D
R
Y
I
A
I
K
K
P
I
Q
A
N
Q
Y
---
N
S
R
A
T
A
F
I
K
I
T
V
V
W
L
I
S
I
G
I
-
A
I
P
V
P
I
-
K
G
I
E
T
-
V
D-
N
P
N
N
I
---
T
-------
C
V
-------------
L
---
T
--
K
-----
E
R
F
G
D
F
M
L
F
G
S
L
A
A
F
F
T
P
L
A
I
M
I
V
T
Y
F
L
T
I
H
A
-----
L
Q
K
K
A
A
D
----------
L
E
D
N
W
E
----------
T
--
L
N
D
N
L
K
V
I
E
K
A
D
N
A
----
A
Q
--
V
-------
K
------------------------
D
A
L
T
K
M
RA----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
----------------
D
---
F
--
R
---------------------------------------
H
G
--------
F
----------------------------
D
-------------------
I
------------------
L
---------------
V
G
-
Q
--
I
D
D
A
L
-----
K
-----
L
------
A
N
----------
E
-----------
G
--------
K
V
------------
K
E
A
-------
Q
--------
A
A
A
E
Q
L
K
T
-
T
R
N
-
A
Y
I
Q
K
Y
L
Q
T
I
S
N
E
Q
R
A
S
K
V
L
G
I
V
F
F
L
F
L
L
M
W
C
P
---
F
F
I
T
N
I
T
-----
L
V
L
C
D
------
S
C
------
N
Q
T
T
L
Q
M
L
L
E
I
F
V
W
------------------------------
I
G
Y
V
S
S
G
V
N
P
L
V
Y
T
L
F
N
K
T
F
R
D
A
F
G
--
R
Y
I
T
C
N
Y
R
-------------------------------------------------
75
HHSearch
77.10
26%
-156
* C7 *
2KS9
1
NK1R_HUMAN
A:
[30-325]
---------------------------------------------------
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
NKI
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
-----
61
Fugue
76.60
19%
-101
- C7 -
3ODU
6
CXCR4_HUMAN (first)
A:
[37-502]
-------------------------------------
P
C
F
R
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
HSGSN
I
F
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
----------
K
--
D
T
E
G
-------
Y
Y
T
I
GIG
H
L
--
L
-------
T
------------------------
K
------------
S
----------
P
-------
S
------------------------------------------
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
N
--------
A
KL--------------------------
K
-------------------
P
------------------
V
---------------
Y
D
-
S
--
L
D
A
V
------
R
-----
R
------
A
A
----------
L
-----------
I
--------
N
M
------------
V
F
Q
-------
M
--------
G
E
T
G
V
A
G
F
-
T
N
S
L
R
M
L
Q
Q
--------
K
R
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
GTWDAY
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
FHCC
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
EVLFQ
60
Fugue
74.34
18%
-101
- C7 -
2RH1
16
ADRB2_HUMAN (first)
A:
[36-477]
-------------------------------------------------
D
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
TN---
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
------------------------------------------
T
------------
E
--
G
-------
Y
Y
T
IGIGHLLTKSPS
L
----------------------
N
----------
A
-------------
A
----------
K
-----
S
----------------
E
---------------------
L
D
--
K
----------------
A
---
I
--
G
---------------------------------------
R
N
--------
T
----------------------------
N
-------------------
G
------------------
V
---------------
I
T
-
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
L
D
--------
A
V
R
R
A
A
L
I
N
M
V
F
Q
M
G
E
T
G
V
A
---
G
F
T
N
S
L
R
-----
M
L
Q
Q
K
------
R
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
TGTWDAYKFCL
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
-----
4
PsiBlast_PDB
72.95
24%
-162
- C8 -
3SN6
1
R:
[190-476]
-------------------------------------------------------------
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
CC---
D
--
F
F
---
T
--
N
-----
Q
A
Y
A
I
A
S
S
---
I
V
S
F
Y
V
P
L
V
I
M
V
F
V
Y
S
R
V
F
Q
E
-----
A
K
---------------
R
Q
L
Q
------------
K
--
I
D
K
S
-------
E
G
R
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
------------------------------------------------------
1
PsiBlast_PDB
72.38
27%
-117
- C8 -
4S0V
1
OX2R_HUMAN
A:
[57-350]
-------------------------------------------------
K
E
Y
E
W
V
L
-
I
A
G
Y
I
I
V
F
---------
V
V
A
L
I
G
N
V
L
V
C
V
A
V
W
K
N
H
H
M
R
T
V
T
N
Y
F
I
V
N
L
S
L
A
D
V
L
V
T
I
T
C
-
L
P
A
T
L
V
V
D
I
T
-
E
T
W
F
F
G
Q
------
S
L
C
K
V
I
P
Y
L
Q
T
V
S
V
S
V
S
V
L
T
L
S
C
I
A
L
D
R
W
Y
A
I
C
H
P
---------
S
T
A
K
R
A
R
N
S
I
V
I
I
W
I
V
S
C
I
I
-
M
I
P
Q
A
I
-
V
M
E
C
S
T
V
--
F
--------KT
T
L
F
T
V
C
D
E
R
W
G
-----
G
--
E
I
---
Y
--
P
-----
K
M
Y
H
I
C
F
F
---
L
V
T
Y
M
A
P
L
C
L
M
V
L
A
Y
L
Q
I
F
R
K
-----
L
W
---------------
C
R
Q
G
I
D
CSFWNESYLT
G
--
S
R
D
E
-------
R
K
K
----
S
---
L
-------
L
------------------------
S
------------
K
----------
F
-------
G
------------------------------------------
M
------------
D
--
E
-------
G
V
T
------------
F
----------------------
M
----------
F
-------------
I
----------
G
-----
R
----------------
F
---------------------
D
R
--
G
----------------
Q
---
K
--
G
---------------------------------------
V
D
--------
V
----------------------------
L
-------------------
L
------------------
K
---------------
A
I
-
E
--
I
L
S
S
------
K
-----
K
------
E
F
----------
Q
-----------
E
--------
M
R
------------
F
I
I
-------
I
--------
G
K
G
D
P
E
L
E
-
G
W
A
-
R
S
L
E
E
--------
K
H
G
N
V
K
V
I
T
E
M
L
S
R
E
F
V
R
E
L
---
Y
G
S
V
D
F
V
-----
I
I
P
S
Y
------
F
E
------
P
F
G
L
V
A
L
E
A
M
C
L
G
A
-----------------------------
I
P
I
A
S
A
V
G
G
L
R
D
I
I
T
N
E
T
G
I
L
V
K
A
G
D
--
P
G
E
L
A
N
A
I
L
K
A
L
E
L
S
R
S
D
L
-------
S
K
F
R
E
N
C
K
K
R
A
M
S
F
S
K
Q
I
R
A
R
R
K
T
A
R
-----
71
HHSearch
72.20
21%
-145
- C7 -
2Z73
5
OPSD_TODPA
A:
[27-333]
----------------------------------------------
D
Q
V
P
D
A
V
Y
Y
S
L
G
I
F
I
G
I
C
G
---------
I
I
G
C
G
G
N
G
I
V
I
Y
L
F
T
K
T
K
S
L
Q
T
P
A
N
M
F
I
I
N
L
A
F
S
D
F
T
F
S
L
V
N
G
F
P
L
M
T
I
S
C
F
L
-
K
K
W
I
F
G
F
------
A
A
C
K
V
Y
G
F
I
G
G
I
F
G
F
M
S
I
M
T
M
A
M
I
S
I
D
R
Y
N
V
I
G
R
P
M
A
A
S
K
K
---
M
S
H
R
R
A
F
I
M
I
I
F
V
W
L
W
S
V
L
W
-
A
I
G
P
I
F
-
G
W
G
A
Y
T
L
--
E
G
V
L
C
---
N
-------
C
S
F
D
Y
I
-----
S
--
R
D
S
--
T
--
T
-----
R
S
N
I
L
C
M
F
---
I
L
G
F
F
G
P
I
L
I
I
F
F
C
Y
F
N
I
V
M
S
-----
V
S
---------------
N
H
E
K
E
M
----------
A
--
A
M
A
K
-------
R
L
N
----
A
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
E
L
R
K
-
A
Q
A
-
G
A
N
A
E
--------
M
R
L
A
K
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S
I
V
I
V
S
Q
F
L
L
S
W
S
P
---
Y
A
V
V
A
L
L
-----
A
Q
F
G
P
------
L
E
---------
W
V
T
P
Y
A
A
Q
L
P
V
-----------------------------
M
F
A
K
A
S
A
I
H
N
P
M
I
Y
S
V
S
H
P
K
F
R
E
A
I
S
--
Q
T
F
P
W
V
L
T
C
C
Q
F
D
D
K
E
T
E
D
-------
D
K
D
A
E
T
E
I
P
A
G
E
-------------------