@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 : O51I1_HUMAN: (2016-01-12 )
MLGLNGTPFQPATLQLTGIPGIQTGLTWVALIFCILYMISIVGNLSILTLVFWEPALHQPMYYFLSMLALNDLGVSFSTLPTVISTFCFNYNHVAFNACLVQMFFIHTFSFMESGILLAMSLDRFVAICYPLRYVTVLTHNRILAMGLGILTKSFTTLFPFPFVVKRLPFCKGNVLHHSYCLHPDLMKVACGDIHVNNIYGLLVIIFTYGMDSTFILLSYALILRAMLVIISQEQRLKALNTCMSHICAVLAFYVPIIAVSMIHRFWKSAPPVVHVMMSNVYLFVPPMLNPIIYSVKTKEIRKGILKFFHKSQA
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..----------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
------MLGLNGT---PFQ------------
P
-
A
T
L
Q
L
TGIPG
I
----------
Q
-
T
G
L
T
-----
W
------------
V
A
L
----
I
-
F
C
I
L
-----
Y
M
I
S
I
VGN
L
S
I
L
----
T
L
V
--FW--------EPALH
Q
P
M
Y
-
Y
F
L
S
M
L
--
A
L
N
DLGVS-
F
S
--
T
-
L
P
---
T
----
V
I
S
T
F
C
-FNY
N
H
V
A
F
----
N
A
C
L
V
Q
M
F
F
I
H
T
F
S
F
M
ESG
I
L
-----
L
-------------
A
M
S
L
---
D
R
-
F
V
A
--
I
C
Y
---
P
L
R
Y
V
T
V
---LTHN
R
I
L
---
A
M
-
G
L
G
I
L
-
T
----
K
S
F
--------TTLF
P
F
P
F
---
V
-----
V
K
RLP---FC-KGN---------------VLHHSYC---L
H
P
D
L
M
K
V
A-CG-------D
I
H
-
V
------
N
-NI
Y
---
G
L
L
V
I
I
F
TY------------------G-----M
D
S
--------
T
F
I
L
L
S
Y
A
L
I
L
R
A
M
L
V
I
--------I-------S-----------
Q
------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
--------
Q
-------------
R
L
-----
K
A
L
N
T
C
M
S
H
I
C
A
V
L
A
F
Y
V
-----------
P
--
I
I
A
V
S
M
I
---------
H
R
F
W
KS----------A--P--
P
-----------
V
V
H
V
M
MS
N
V
Y
----
L
FVPPML
N
P
I
I
Y
SV--
K
-
T
K
E
I
R
K
G
I
L
K
F
----
F
HKSQA----------------------
25
HHSearch
83.53
17%
-145
- C3 -
2RH1
16
ADRB2_HUMAN (first)
A:
[41-477]
-----------------------------------------------------------
V
-----
G
------------
M
G
I
----
V
-
M
S
L
I
-----
V
L
A
I
V
F
G
N
V
L
V
I
----
T
A
I
--
A
K
--------
F
E
R
L
Q
T
V
T
N
-
Y
F
I
T
S
L
--
A
C
A
D
L
V
M
G
-
L
A
--
V
-
V
P
---
F
----
G
A
A
H
I
L
-
M
K
M
W
T
F
G
N
----
F
W
C
E
F
W
T
S
I
D
V
L
C
V
T
A
S
I
E
T
L
-----
C
-------------
V
I
A
V
---
D
R
-
Y
F
A
--
I
T
S
---
P
F
K
Y
Q
S
L
---
L
T
K
N
K
A
R
---
V
I
-
I
L
M
V
W
-
I
----
V
S
G
--------
L
T
S
F
L
P
I
Q
M
--
H
-----
W
Y
R
A
T
---
H
---------------------
Q
E
A
I
N
C
---
Y
A
E
----
E
T
-
C
C
-------
D
F
F
-
T
------
N
-
Q
A
Y
---
A
I
A
S
S
I
V
S
F
------------------
Y
-----
V
P
L
--------
V
I
M
V
F
V
Y
S
R
V
F
Q
E
A
K
R
Q
--------
L
-------
N
-----------
I
F
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
TEGYYTIGIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYKFC-
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
-------------------------
24
HHSearch
83.46
19%
-137
- C3 -
3RZE
5
ENLYS_BPT4 (first)
A:
[11-443]
------------------------------------------------------------------------------
L
V
V
----
V
-
L
S
T
I
-----
C
L
V
T
V
G
L
N
L
L
V
L
----
Y
A
V
--
R
S
--------
E
R
K
L
H
T
V
G
N
-
L
Y
I
V
S
L
--
S
V
A
D
L
I
V
G
-
A
V
--
V
-
M
P
---
M
----
N
I
L
Y
L
L
-
M
S
K
W
S
L
G
R
----
P
L
C
L
F
W
L
S
M
D
Y
V
A
S
T
A
S
I
F
S
V
-----
F
-------------
I
L
C
I
---
D
R
-
Y
R
S
--
V
Q
Q
---
P
L
R
Y
L
K
Y
---
R
T
K
T
R
A
S
---
A
T
-
I
L
G
A
W
-
F
----
L
S
F
--------
L
W
V
I
P
I
L
G
---------
W
N
H
---------------------------
R
R
E
D
K
C
---
E
T
D
F
Y
------------------
D
------
V
-
T
W
F
---
K
V
M
T
A
I
I
N
F
------------------
Y
-----
L
P
T
--------
L
L
M
L
W
F
Y
A
K
I
Y
K
A
V
R
Q
H
--------
C
-------
N
-----------
I
F
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
TEG
Y
Y
T
I
G
IGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKL
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYLHM-
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
-------------------------
42
Fugue
83.24
16%
-131
- C3 -
1F88
8
OPSD_BOVIN
A:
[1-348]
------
M
N
G
T
E
G
P
---
N
F
Y
VPFSNKTGVVRS
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
PHEETN
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
ASATTQK
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
PSTTVSKTETS
Q
V
A
P
A------
43
Fugue
83.08
16%
-130
- C3 -
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
FEAPQYYLAE
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
DYYTPH
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
AAQQQESA
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
PLGDDEA
S
T
T
V
S
K
TETSQVAPA
26
HHSearch
82.48
20%
-157
- C3 -
3EML
13
ENLYS_BPT4
A:
[22-469]
-----------------------------------------------------------
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
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
CS--------
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
----------------------
23
HHSearch
79.68
17%
-144
- C3 -
3UON
4
ACM2_HUMAN (first)
A:
[25-457]
-----------------------------------------------------------------
F
------------
I
V
L
----
V
-
A
G
S
L
-----
S
L
V
T
I
I
G
N
I
L
V
M
----
V
S
I
--
K
V
--------
N
R
H
L
Q
T
V
N
N
-
Y
F
L
F
S
L
--
A
C
A
D
L
I
I
G
-
V
F
--
S
-
M
N
---
L
----
Y
T
L
Y
T
V
-
I
G
Y
W
P
L
G
P
----
V
V
C
D
L
W
L
A
L
D
Y
V
V
S
N
A
S
V
M
N
L
-----
L
-------------
I
I
S
F
---
D
R
-
Y
F
C
--
V
T
K
---
P
L
T
Y
P
V
K
---
R
T
T
K
M
A
G
---
M
M
-
I
A
A
A
W
-
V
----
L
S
F
--------
I
L
W
A
P
A
I
L
---
F
-----
W
Q
F
I
V
---
G
V
-
R
-----------------
T
V
E
D
G
E
C
---
Y
I
Q
F
F
------------------
S
------
N
-
A
A
V
---
T
F
G
T
A
I
A
A
F
------------------
Y
-----
L
P
V
--------
I
I
M
T
V
L
Y
W
H
I
S
R
A
S
K
S
R
--------
I
-------
N
-----------
I
F
E
M
L
R
I
D
EGLRL
K
I
Y
K
D
TEG
Y
Y
T
I
GIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKL
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTWDAYPPP-
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
--------------------------
35
HHSearch
78.51
18%
-146
* C3 *
2Z73
5
OPSD_TODPA
A:
[34-332]
----------------------------------------------------------
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
RLNAKE
L
R
K
A
Q
A
G
A
----------------------------------------------------------------------------------------------------------------------------------------------
N
--------
A
-------------
E
M
-----
R
L
A
K
I
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
----------------------
31
HHSearch
75.61
16%
-139
- C3 -
2KS9
1
NK1R_HUMAN
A:
[34-324]
-----------------------------------------------------------------
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
PGDSSDRYH
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
YL
K
KF
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
----------------------
45
Fugue
74.94
14%
-145
* C1 *
4V1S
2
?
A:
[37-395]
-----P
G
V
E
I
G
N
N
---
D
Y
Y
------------
T
-
W
C
K
E
T
L
S
V
I
D
K
----------
D
-
L
K
I
S
-----
G
THSYYENQDRSQ
V
S
F
----
I
-
W
G
N
I
-----
F
L
L
Y
T
Y
T
E
G
I
S
L
----
S
K
S
--
E
W
--------
S
D
A
L
M
N
C
F
L
-
N
F
D
N
Y
W
--
H
P
N
Y
K
G
I
A
G
Y
A
--
T
-
L
P
---
T
SAEK
V
P
D
R
F
Y
-
D
E
N
G
W
T
A
I
----
G
L
C
D
A
Y
L
A
T
Q
N
N
S
Y
L
E
K
A
K
G
A
-----
L
-------------
A
F
S
L
S
G
E
D
N
-
V
L
G
G
G
I
Y
F
---
Q
E
T
F
V
S
L
---
P
V
Q
K
N
T
I
---
C
S
-
A
V
T
M
L
-
S
C
M
K
L
Y
E
I
--------
T
Q
D
R
Q
Y
L
D
---
A
-----
A
I
R
I
N
D
--
W
T
-
V
E
N
---------------
L
L
D
K
S
D
N
---
L
L
W
D
A
K
M
V
A
-
D
G
-------
S
V
N
-
T
------
Q
-
K
W
S
---
Y
N
A
G
F
M
I
R
S
------------------
W
-----
L
K
M
--------
Y
Q
A
T
K
D
E
K
Y
L
S
Q
A
K
A
T
L
--------
A
-------
S
-----------
S
------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
--------
A
-------------
K
W
YNSIN
G
A
L
N
D
P
G
Y
F
A
F
S
I
I
D
S
W
F
-----------
D
--
M
Y
D
T
D
K
N
---------
T
V
W
L
T
K
----------
A
--
F
--
H
-----------
A
I
N
F
I
H
N
K
L
R
DGNG
R
Y
P
E
H
W
G
T
P
T
T
S
N
L
--
E
-
K
Y
D
L
R
F
S
T
V
A
A
----
Y
M
Y
M
R
A
A
N
Y
K
R
I
L
N--------------
30
HHSearch
74.51
15%
-134
- C3 -
1U19
14
OPSD_BOVIN
A:
[41-326]
-----------------------------------------------------------
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
QESA
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
----------------------
46
Fugue
73.75
20%
-159
- C1 -
4RKS
4
MV3K_THEAC
A:
[21-337]
------
T
Y
R
S
I
G
S
---
T
A
Y
------------
P
--
T
I
G
V
V
L
L
G
G
I
----------
A
-
N
P
V
T
RTPL
H
T
------------
S
A
G
----
I
-
A
Y
S
D
-----
S
C
G
S
I
R
S
E
T
R
I
Y
A
D
E
A
T
H
I
--
Y
F
NGTESTDD
N
R
S
V
R
R
V
L
D
-
R
Y
S
S
V
F
E
E
A
F
G
T
K
T
V
S
-
Y
S
--
S
-
Q
N
---
F
----
G
I
L
S
G
S
-
S
D
A
G
A
A
S
I
----
G
A
A
I
L
G
L
K
P
D
L
D
P
H
D
V
E
N
D
L
R
AVSES
A
-------------
G
R
S
L
---
F
G
-
G
L
T
--
I
T
W
S
DG
F
H
A
Y
T
E
K
---
I
L
D
P
E
A
F
------------------
S
G
--------
Y
S
I
V
A
F
A
F
---
D
-----
Y
Q
R
N
P
-------
S
D
---------------
V
I
H
Q
N
I
V
RSD
L
Y
P
A
R
K
K
H
A
-
D
E
-------
H
A
H
-
M
------
I
-
K
E
Y
A
K
T
N
D
I
K
G
I
F
D
L
------------------
A
-----
Q
E
D
--------
T
E
---
E
Y
H
S
I
L
R
G
V
G
V
N
--------
V
-------
I
-----------
R
------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
--------
N
-------------
M
Q
-----
K
L
I
S
Y
L
K
L
I
R
K
D
Y
W
N
A
Y
I
-----------
V
--
T
G
G
-----------------------------------------------------
S
N
V
Y
----
V
A
V
E
S
E
N
A
D
R
L
F
S
I
--
E
N
T
F
G
S
K
K
K
M
L
R
I
V
G
G
A
W
H
R
R
P
E
----------------------
34
HHSearch
71.11
16%
-144
- C3 -
3V2Y
1
ENLYS_BPT4
A:
[63-495]
----------------------------------------------------------
I
K
-----
L
------------
T
S
V
----
V
-
F
I
L
I
-----
C
C
F
I
I
L
E
N
I
F
V
L
----
L
T
I
--
W
K
--------
T
K
K
F
H
R
P
M
Y
-
Y
F
I
G
N
L
--
A
L
S
D
L
L
A
G
-
V
A
--
Y
-
T
A
---
N
----
L
L
L
S
G
A
--
T
T
Y
K
L
T
P
----
A
Q
W
F
L
R
E
G
S
M
F
V
A
L
S
A
S
V
F
S
L
-----
L
-------------
A
I
A
I
---
E
R
-
Y
I
T
--
M
L
K
--------------
N
N
F
R
L
F
---
L
L
-
I
S
A
C
W
-
V
----
I
S
L
--------
I
L
G
G
L
P
I
M
---
G
-----
W
N
C
I
S
--------------------------
A
L
S
S
C
---
S
T
V
L
P
L
-----------------
Y
------
H
-
K
H
Y
---
I
L
F
-
C
T
T
V
F
------------------
T
-----
L
L
L
--------
L
S
I
V
I
L
Y
C
R
I
Y
S
L
V
R
T
R
--------
N
-------
I
-----------
F
E
M
L
R
IDEGLRL
K
I
Y
K
D
TE
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
TGTWDAYA
S
R
S
-
S
--------
E
-------------
N
V
-----
A
L
L
K
T
V
I
I
V
L
S
V
F
I
A
C
W
A
-----------
P
--
L
F
I
L
L
L
L
---------
D
V
G
C
K
V
----------
K
--
T
C
D
I
-----------
L
F
R
A
E
Y
F
L
V
L
----
A
V
L
N
S
G
T
N
P
I
I
Y
T
L
--
T
-
N
K
E
M
R
R
A
F
I
R
I
----
M
G
R
P
L
-----------------------
32
HHSearch
70.77
18%
-137
- C3 -
2LNL
-
CXCR1_HUMAN
A:
[38-323]
---------------------------------------------------------
N
K
Y
-----
V
------------
V
I
I
----
A
-
Y
A
L
V
-----
F
L
L
S
L
L
G
N
S
L
V
M
----
L
V
I
--
L
Y
--------
S
R
V
G
R
S
V
T
D
-
V
Y
L
L
N
L
--
A
L
A
D
L
L
F
A
-
L
T
----
L
P
---
I
----
W
A
A
S
K
V
--
N
G
W
I
F
G
T
----
F
L
C
K
V
V
S
L
L
K
E
V
N
F
Y
S
G
I
L
L
L
-----
A
-------------
C
I
S
V
---
D
R
-
Y
L
A
--
I
V
H
---
A
T
R
T
L
T
----
Q
K
R
H
L
V
K
---
F
V
-
C
L
G
C
W
-
G
----
L
S
M
--------
N
L
S
L
P
F
F
L
---
F
-----
R
Q
A
Y
H
---
P
--------------------
N
N
S
S
P
V
C
---
Y
E
V
L
G
N
D
------------
T
A
K
-
W
------
R
-
M
V
L
---
R
I
L
P
H
T
F
G
F
------------------
I
-----
V
P
L
--------
F
V
M
L
F
C
Y
G
F
T
L
R
T
L
F
K
A
--------
H
-------
M
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
--------
Q
-------------
K
H
-----
R
A
M
R
V
I
F
A
V
V
L
I
F
L
L
C
W
L
-----------
P
--
Y
N
L
V
L
L
A
---------
D
T
L
M
R
T
QVIQE
S
C
E
R
R
N
--
N
--
I
-----------
G
R
A
L
D
A
T
E
I
L
----
G
F
L
H
S
C
L
N
P
I
I
Y
A
F
--
I
-
G
Q
N
F
R
H
G
F
L
K
I
----
L
A
M
H
G
-----------------------
49
Fugue
65.58
16%
-133
- C3 -
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
IFG
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
KTI
T
C
-
Y
D
T
TSDEY
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
CG
Y
I
Y
N
PEDGDPDNGVNP
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
TPAM
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
------------------------------------
44
Fugue
65.10
17%
-121
* C2 *
4PEV
1
?
A:
[52-421]
P
I
S
V
L
V
L
F
D
V
G
G
R
GDL
S
F
N
------------
D
M
A
A
L
G
A
D
R
A
A
E
E
----------
L
G
V
D
V
V
-----
F
------------
Q
T
P
QSLA
V
M
E
S
V
L
-----
D
A
A
S
R
S
G
E
Y
D
L
I
----
V
L
V
G
F
L
W
--------
Q
E
P
L
E
K
V
A
P
R
Y
P
E
Q
K
Y
--
A
L
I
D
A
A
T
R
-
E
R
--
Y
-
D
N
---------
V
A
S
Y
L
-
F
R
E
Q
E
V
A
S
----
L
V
G
I
I
A
A
D
I
A
N
N
I
S
K
A
T
G
E
E
A
-----
K
-------------
A
G
A
V
---
A
G
M
D
I
P
--
P
L
W
---
R
F
H
I
G
Y
L
---
Y
G
V
Q
Y
Y
N
---
Q
A
M
G
T
D
V
E
M
V
----
W
T
Y
--------
T
G
R
F
D
D
P
T
---
L
-----
G
K
T
T
A
---
E
Q
M
L
Q
Q
---------------
G
V
R
V
F
Y
G
---
V
-
A
G
L
T
H
V
G
M
F
N
-------
A
V
K
-
E
------
A
-
A
A
R
---
G
--
V
I
A
F
S
I
------------------
G
-----
Q
D
A
SQEWYDPQ
T
I
I
I
S
G
L
K
R
V
D
V
A
V
Y
T
A
--------
I
-------
K
-----------
D
------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
--------
V
E
G
R
F
R
G
G
I
V
S
L
G
L
K
E
-----
G
G
L
G
L
S
D
E
E
I
I
R
Y
F
A
E
I
A
A
E
T
GQLPEGLT
P
--
E
K
V
V
E
I
V
M
S
Q
R
E
K
WIS
N
D
G
W
R
L
----------
V
--
E
--
E
-----------
L
K
Q
K
I
I
S
G
E
I
----
K
F
V
T
P
Q
-
D
H
D
T
Y
D
S
--
I
-
I
E
E
L
K
A
G
N
L
E
A
----
A
L
E
-------------------------
50
Fugue
60.29
13%
-139
- C1 -
4CRU
1
RCD1_HUMAN
B:
[4-273]
------
M
L
E
R
E
K
I
---
Y
Q
W
------------
I
-
N
E
L
S
------------------------------------------------------------------
S
P
E
T
R
----
E
N
A
--
L
L
--------
E
L
S
K
K
R
E
S
V
-
P
D
L
A
P
M
--
L
W
H
S
F
G
T
I
-
A
A
--
L
-
L
Q
---
E
----
I
V
N
I
Y
P
-
S
--------------------------
I
N
P
P
T
L
-----
T
-------------
A
H
Q
S
---
N
R
-
V
C
N
--
A
L
A
---
L
L
Q
C
V
A
S
---
H
P
E
T
R
S
A
---
F
L
-
A
A
H
-------------------
I
P
L
F
L
Y
P
F
---
L
HTVSK
T
R
P
F
E
---
Y
L
-
R
L
T
---------------
S
L
G
V
I
G
A
---
L
V
K
T
D
E
Q
E
V
-
I
N
-------
F
L
L
-
T
------
T
-
E
I
I
---
P
L
C
L
R
I
M
E
S
------------------
G
S
E
L
S
K
T
V
A
--------
T
F
I
L
Q
K
I
L
L
D
D
T
G
L
A
Y
I
--------
C
-------
Q
-----------
T
------------------------------------------------------------------------------------------------------------------------------------------------------------------
Y
--------
E
-------------
R
F
-----
S
H
V
A
M
I
L
G
K
M
V
L
Q
L
S
K
E
P
-----------
S
--
A
R
L
L
K
H
V
---------
V
R
C
Y
L
R
----------
L
--
S
--
D
-----------
N
P
R
A
R
E
A
L
R
Q
----
C
L
P
D
Q
L
K
D
T
T
F
A
Q
V
LK
D
-
D
T
T
T
K
R
W
L
A
Q
L
----
V
K
N
L
Q
E
----------------------
48
Fugue
59.70
9%
-162
- C2 -
4B9E
11
?
A:
[5-301]
-----------
D
P
---
L
L
P
------------
G
-
F
D
Y
L
T
L
H
T
S
A
----------------------------------------------
A
R
-----
L
R
V
A
V
K
G
S
G
P
P
L
----
L
L
L
--
H
G
--------
Y
P
Q
T
H
L
A
W
H
-
R
I
A
P
R
L
--
A
-
E
D
Y
S
V
V
-
L
A
--
D
-
L
R
---
G
----
Y
G
E
S
R
A
-
L
D
E
E
G
A
D
Y
----
S
K
A
A
L
A
R
D
Q
L
E
T
M
G
Q
L
G
F
E
R
F
-----
A
-------------
V
I
G
H
---
D
R
-
G
A
R
--
V
G
Y
---
R
L
A
L
D
H
P
---
Q
A
V
A
A
F
V
---
S
L
-
T
V
V
P
I
-
L
----
D
N
W
A
A
VN
K
V
F
A
L
N
A
Y
H
W
F
L
---
L
-----
A
Q
P
Y
D
---
L
P
-
E
R
L
---------------
I
G
A
D
P
E
H
---
F
L
D
Y
T
L
R
R
M
-
A
Q
-------
G
R
---------
D
-
I
Y
H
---
P
Q
A
L
E
S
Y
R
R
------------------
A
-----
F
R
D
--------
P
A
V
R
H
A
M
C
E
D
Y
R
A
A
V
G
---------
V
-------
D
-----------
A
------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
--------
A
-------------
D
Q
-----
A
D
R
D
A
G
R
R
L
Q
C
P
V
Q
V
L
W
Q
-----------
E
R
P
Y
A
A
G
Q
H
P
---------
L
E
I
W
K
T
----------
W
--
A
--
G
-----------
Q
V
E
G
A
A
I
G
A
S
----
H
M
L
P
E
D
A
-----------
P
D
A
V
L
E
H
L
L
G
F
----
L
A
S
H
R
E
ALR-------------------
29
HHSearch
58.54
21%
-147
- C3 -
3PBL
1
DRD3_HUMAN (first)
A:
[41-226]
------------------------------------------------------------------------------
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
L
R
L
K
I
Y
K
D
T
E
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
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
----------------------
47
Fugue
54.78
10%
-130
- C1 -
2YYE
8
SELD_AQUAE
A:
[3-345]
GGIMVE
L
L
K
L
V
R
S
---
S
G
C
------------
A
-
A
K
V
G
P
G
D
L
Q
E
I
----------
L
-
K
G
F
N
-----
I
------------
Y
T
D
----
E
-
S
T
L
V
SIGDD
A
G
V
Y
E
H
N
G
I
I
W
V
----
Y
T
V
--
D
I
--------
I
T
P
V
V
N
D
P
Y
-
L
W
G
A
I
S
--
T
A
N
A
L
S
D
V
-
Y
A
M
G
G
-
I
P
---
V
----
N
A
L
A
I
S
-
C
F
N
N
C
E
L
D
----
I
E
I
F
R
E
V
I
R
G
A
L
D
K
L
R
E
A
K
T
V
-----
L
L
G
G
H
T
I
D
D
K
E
P
K
F
G
L
S
V
---
A
G
-
I
C
P
--
E
G
K
---
Y
I
T
Q
S
G
A
---
Q
V
G
Q
L
L
I
L
T
K
P
I
-
G
T
G
I
L
-
I
----
K
G
L
--------
K
E
G
I
L
K
E
E
---
D
-----
I
N
E
A
I
---
E
N
-
M
L
A
---------------
L
N
D
K
A
R
N
---
L
M
L
S
L
D
A
T
A
-
C
T
-------
D
V
T
-
G
------
F
-
G
L
L
---
G
H
A
W
N
I
C
K
N
------------------
S
-----
N
I
G
--------
A
R
I
F
F
E
K
V
P
Y
Y
Q
L
S
E
N
L
--------
V
-------
K
-----------
K
------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
--------
I
-------------
Y
P
-----
K
G
A
I
E
N
L
N
F
V
K
N
Y
L
K
S
N
L
-----------
D
--
N
W
K
L
I
L
L
---------
S
D
P
V
T
S
----------
G
--
G
--
L
-----------
L
F
T
I
N
K
E
K
L
E
----
K
I
D
E
T
A
K
E
L
E
V
N
Y
W
--
I
-
I
G
E
T
I
A
E
N
V
L
E
----
V
L
--------------------------
5
PsiBlast_PDB
51.79
30%
-147
- C3 -
4EIY
16
AA2AR_HUMAN (first)
A:
[24-145]
---------------------------------------
G
A
P
P
I
----------
M
-
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
P
-
K
E
G
---------------
K
N
H
S
Q
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
--------
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
L
D
----------
A
--
Q
--
K
-----------
M
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
----------------------