@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 : O10H2_HUMAN: (2016-01-11 )
MLGLNHTSMSEFILVGFSAFPHLQLMLFLLFLLMYLFTLLGNLLIMATVWSERSLHTPMYLFLCVLSVSEILYTVAIIPRMLADLLSTQRSIAFLACASQMFFSFSFGFTHSFLLTVMGYDRYVAICHPLRYNVLMSPRGCACLVGCSWAGGSVMGMVVTSAIFQLTFCGSHEIQHFLCHVPPLLKLACGNNVPAVALGVGLVCIMALLGCFLLILLSYAFIVADILKIPSAEGRNKAFSTCASHLIVVIVHYGFASVIYLKPKGPHSQEGDTLMATTYAVLTPFLSPIIFSLRNKELKVAMKRTFLSTLYSSGT
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)
--------------------------------------------------------------------------------------------------MLGLNHT
S
M
S
E
F
I
L
V
G----------------FSA
F
---
P
H
L
-------------
Q
L
M
L
F
L
L
F
L
L
M
Y
----------------
L
F
T
L
L
G
N
L
L
I
M
A
T
VWSERSL-----H
T
P
M
Y
L
F
L
C
V
L
S
V
S
E
---------
I
L
-------
Y
T
V
A
----
I
-
I
P
R
M
L
A
D
L
L
-
S
T
Q
R
S
I
A
F
------------
L
A
C
A
S
Q
M
F
F
S
F
SFG
F
T
H
S
F
L
L
T
V
MGY-----D
R
Y
V
A
I
CHP
L
R
Y
N
V
L
---MSPRG
C
A
C
L
V
GCSWAGG
S
V
M
G
M
V
V
T
S
A
I
F
Q
LTFCG
S
H
E
I
Q
H
F
L
CHVP
P
L
L
K
LA--CGNN--V--
P
A
V
A
L
G
V
----
G
L
V
C
I
M
A
L
L
G
------
C
F
L
L
I
L
------
L
S
Y
A
---
F
I
-------
V
A
D
I
L
---------------KIPS---------AE--------------------GR
N
K
A
F
S
T
C
A
S
H
L
I
V
V
I
V
HYG
F
A
S
V
I
Y
L
KPK-G------P-H---S----QEG--
D
--
T
L
M
A
T
T
Y
A
V
L
T
P
F
L
S
P
I
I
F
S
LRN
K
E
L
K
V
A
M
K
R
T
F
L
S
T
L
YSSGT----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
36
HHSearch
85.47
17%
-154
- C4 -
2Z73
5
OPSD_TODPA
A:
[33-333]
-------------------------------------------------------------------------------------------------------------------------------------------
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
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
LEW
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
43
Fugue
81.37
17%
-136
- C4 -
1F88
8
OPSD_BOVIN
A:
[1-348]
-----------------------------------------------------------------------------------------------------
M
N
G
T
E
G
P
N
F
Y
V
P
F
SNKTGVVRSPFEAPQY
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
YT
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
FTVKEAAASAT----
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
VSKTETS
Q
V
A
P
A----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
45
Fugue
80.70
20%
-178
- C3 -
1DMU
5
T2B1_BACIU
A:
[1-299]
--------------------------------------------------------------------------------------------------
M
Y
N
L
H
R
E
K
I
F
M
S
Y
N
Q
N
----------------
K
Q
Y
L
E
D
N
P
E
I
-------------
Q
E
K
I
E
L
Y
G
L
N
L
L
----------------
N
E
V
I
S
D
N
E
E
E
I
R
A
D
Y
N
E
A
N
F
-----
L
H
P
F
W
M
N
Y
P
P
L
D
R
G
K
MPKGDQIPW
I
E
-------
V
G
E
K
----
A
-
V
G
S
K
L
T
R
L
V
-
S
Q
R
E
D
I
T
V
R
EIGLPTGPD
E
R
Y
L
L
T
S
P
T
I
Y
S
L
T
N
G
F
T
D
S
I
M
M
F
V
--------
D
I
K
S
V
G
P
R
D
S
D
Y
D
L
V
---
L
S
P
N
Q
V
S
-------
G
N
G
D
W
A
Q
L
E
G
G
I
Q
N
N
Q
Q
T
I
Q
G
P
R
S
S
Q
I
F
L
P
T
I
P
P
L
Y
I
L
S
--
D
G
T
I
--
A
--
P
V
V
H
L
F
I
----
K
P
I
Y
A
M
R
S
L
T
KG
D
T
G
Q
S
L
Y
K
I
K
------
L
A
S
V
---
P
N
-------
G
L
G
L
F
---------------
C
N
P
----------------------------------
G
Y
A
F
D
S
A
Y
K
F
L
F
R
P
-----------------------
G
-
K
---
D
----
D
R
T
--
K
--
S
L
L
Q
K
R
V
R
V
D
L
R
V
L
D
K
I
----
G
P
R
V
M
T
I
D
M
D
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
34
HHSearch
76.95
15%
-154
- C4 -
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
---------
P
G
DSSDRYH
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
LYLK
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
51
Fugue
72.33
22%
-159
- C2 -
4OK4
1
?
A:
[30-733]
HPNLIVT
E
Q
D
V
A
N
I
A
A
SWESY
D
A
Y
A
E
Q
L
N
A
D
K
T
N
L
D
A
F
M
A
E
G
V
V
V
P
MPKDAGGG
Y
T
H
E
Q
H
K
R
N
Y
K
A
I
R
N
A
G
F
L
Y
Q
V
TGD
E
K
Y
L
T
F
A
K
D
L
L
L
A
Y
A
K
M
YP
S
L
G
-
E
H
P
N
R
K
E
Q
S
P
-
G
----------------
R
L
F
W
---
Q
S
L
-------------
N
E
A
V
W
L
V
Y
S
I
Q
G
----------------
Y
D
A
I
I
D
G
L
A
A
E
E
K
Q
E
I
E
S
G
V
-----
F
L
P
M
A
K
F
L
S
V
E
S
------------------------------------
P
E
T
F
-
N
K
I
H
N
L
G
T
------------
W
A
V
A
A
V
G
M
T
G
Y
V
L
G
N
D
E
L
V
E
I
S
L
M
G
L
-----
D
K
T
G
K
A
G
F
M
K
Q
L
D
K
L
---
F
S
P
D
G
Y
Y
T
------
E
G
P
Y
Y
Q
R
Y
A
L
M
P
F
I
W
F
A
K
A
I
E
T
N
E
--------
P
E
R
K
I
F
E
--
Y
R
N
N
---------------------
I
L
L
K
A
------
V
Y
T
T
I
D
------
L
S
Y
A
GYF
F
P
-------
I
N
D
A
L
---------------
K
----------------------------------
D
K
G
I
D
T
V
E
L
V
H
A
L
A
I
V
Y
S
I
T
G
D
N
T
L
L
D
I
A
Q
E
Q
G
------
R
-
I
---
S
----
L
T
G
--
D
--
G
L
K
V
A
K
-
A
V
G
E
G
L
T
Q
P
Y
---------------
N
Y
R
S
I
L
L
G
D
G
A
DGDQ
G
A
L
S
I
H
R
L
G
E
G
HN
H
M
A
L
V
A
KNTSQGMGHGHFDKL
N
W
L
L
Y
D
NGNEIVTDYGAARYLNVEAKYGGHYLAENNTWAKQTIAHN
T
L
V
V
NEQSHFYGD
V
T
T
A
D
L
H
H
P
E
V
L
S
F
Y
S
G
ED
Y
Q
L
S
S
A
K
E
ANAYDG
V
E
F
V
R
S
M
L
L
V
N
V
PSLE
H
P
I
V
V
D
V
L
N
V
S
A
D
K
A
S
T
F
D
L
P
L
Y
F
N
G
QIIDFS
F
K
V
K
DNKNVMKMLGKRNGYQHLWLR
N
T
A
P
V
G
D
A
S
E
R
A
T
W
I
L
DD
R
F
Y
S
Y
A
F
V
T
S
T
PSKK
Q
N
V
L
I
A
E
L
G
ANDPNYNL
R
Q
Q
Q
V
L
I
R
R
V
E
KAK
Q
A
S
F
V
S
V
L
E
P
H
G
K
Y
D
GSLETTSGAYSNVK
S
V
K
H
V
S
E
NG
K
D
V
V
V
V
D
L
KDG
S
N
V
V
V
A
L
SYNANSE
Q
V
H
K
V
N
AG
E
E
A
I
E
W
K
G
F
S
S
V
V
V
42
Fugue
72.18
15%
-135
- C4 -
1U19
15
OPSD_BOVIN
A:
[4-349]
---------------------------------------------------------------------------------------MN
G
T
E
G
PNFYV
P
F
S
N
K
T
G
V
V
R
S
P
F
E
A
P
----------------
Q
Y
Y
L
AE-
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
YY
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
FTVKEAAAQQQESA
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
DEA
S
T
T
V
S
K
TETSQVAPA----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
70.10
14%
-149
- C4 -
1U19
14
OPSD_BOVIN
A:
[41-328]
----------------------------------------------------------------------------------------------------------------------------------------------------------
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
P
L
G
D
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
29
HHSearch
67.20
22%
-184
- C4 -
3EML
8
ENLYS_BPT4
A:
[22-222]
----------------------------------------------------------------------------------------------------------------------------------------------------------
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
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
K
L
K
P
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
30
HHSearch
66.12
14%
-141
- C4 -
2LNL
-
CXCR1_HUMAN
A:
[37-323]
------------------------------------------------------------------------------------------------------------------------------------------
L
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
RTQVI
Q
E
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
25
HHSearch
64.78
21%
-165
- C4 -
3RZE
2
ENLYS_BPT4 (first)
A:
[10-200]
-----------------------------------------------------------------------------------------------------------------------------------------------------------
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
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
K
L
K
P
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
63.39
29%
-167
- C4 -
4EA3
3
C562_ECOLX (first)
A:
[124-273]
-------------------------------------------------------------------------------------------------------------------------------------------
L
-------------
K
V
T
I
V
G
L
Y
L
A
V
C
----------------
V
G
G
L
L
G
N
C
L
V
M
Y
V
I
L
R
H
T
K
M
-----
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
---------
T
L
--------
V
L
L
----
T
-
L
P
F
Q
G
T
D
I
L
-
L
G
F
W
P
F
G
N
------------
A
L
C
K
T
V
I
A
I
D
Y
Y
N
M
F
T
S
T
F
T
L
T
A
M
S
V
-----
D
R
Y
V
A
I
C
H
P
---------
T
S
S
K
A
Q
A
V
N
V
A
I
-
W
A
L
A
S
V
V
G
V
P
V
--
A
I
M
G
S
A
Q
V
E
D
E
E
I
E
C
L
V
E
I
P
T
P
Q
D
Y
W
G
--
P
V
F
A
--
I
--
C
I
F
L
F
S
F
----
I
V
P
V
L
V
I
S
V
C
------
Y
S
L
M
I
R
------
R
L
R
G
---
V
R
-------
L
L
S
G
S
---------------
R
E
K
D
---------
R
N
--------------------
L
R
R
I
T
R
L
V
L
V
V
V
A
V
F
V
G
C
W
T
P
V
Q
V
F
V
L
A
Q
G
L
-
G
------
V
-
Q
---
P
----
S
S
E
--
T
--
A
V
A
I
L
R
F
C
T
A
L
G
Y
V
N
S
C
L
N
P
I
L
Y
A
F
L
D
E
N
F
K
A
C
F
R
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
HHSearch
62.60
16%
-164
- C4 -
3UON
2
ACM2_HUMAN (first)
A:
[24-215]
----------------------------------------------------------------------------------------------------------------------------------------------------------
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
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
K
L
K
P
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
31
HHSearch
62.55
18%
-181
- C4 -
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
K
L
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
60.08
29%
-161
- C4 -
3UZA
1
AA2AR_HUMAN
A:
[14-137]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
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
L
-------
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
A
Q
S
S
I
F
S
L
L
A
I
A
I
-----
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
---
V
T
G
T
R
A
A
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
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
A
A
A
------
R
R
Q
L
---
K
Q
-------
M
E
S
Q
P
---------------
L
P
G
E
---------
R
A
--------------------
R
S
T
L
Q
K
E
V
H
A
A
K
S
A
A
I
I
A
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
A
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
60.02
29%
-161
- C4 -
3REY
1
AA2AR_HUMAN
A:
[14-137]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
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
L
-------
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
A
Q
S
S
I
F
S
L
L
A
I
A
I
-----
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
---
V
T
G
T
R
A
A
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
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
A
A
A
------
R
R
Q
L
---
K
Q
-------
M
E
S
Q
P
---------------
L
P
G
E
---------
R
A
--------------------
R
S
T
L
Q
K
E
V
H
A
A
K
S
A
A
I
I
A
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
A
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
HHSearch
59.77
15%
-165
- C4 -
2RH1
6
ADRB2_HUMAN (first)
A:
[42-236]
-----------------------------------------------------------------------------------------------------------------------------------------------------------
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
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
K
L
K
P
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
59.76
29%
-163
- C4 -
3RFM
1
AA2AR_HUMAN
A:
[14-137]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
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
L
-------
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
A
Q
S
S
I
F
S
L
L
A
I
A
I
-----
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
---
V
T
G
T
R
A
A
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
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
A
A
A
------
R
R
Q
L
---
K
Q
-------
M
E
S
Q
P
---------------
L
P
G
E
---------
R
A
--------------------
R
S
T
L
Q
K
E
V
H
A
A
K
S
A
A
I
I
A
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
A
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
47
Fugue
59.46
17%
-189
- C1 -
3GRE
-
VPS15_YEAST
A:
[1031-1454]
----------------------------------------------------------------------------------------------------
E
S
I
E
K
F
L
S
T
F
I
L
P
P
----------------
L
R
D
Y
---
K
E
F
GPIQEIVRSPNMG
N
L
R
G
K
L
I
A
T
L
M
E
NEPNSIT
S
S
A
V
S
P
G
E
T
P
Y
L
I
T
G
S
D
Q
G
V
I
K
I
W
N
L
K
E
I
I
VGEV
Y
S
S
S
L
T
Y
D
C
S
S
T
V
T
Q
---------
I
T
M
IPNFD
A
F
A
V
S
S
KDG
Q
-
I
I
V
L
K
V
N
H
Y
-
Q
Q
E
S
E
V
K
F
------------
L
N
C
E
C
I
R
K
I
N
L
K
N
F
G
K
N
E
Y
A
V
R
M
R
A
F
V
N
EE
K
S
L
L
V
A
L
T
N
L
S
R
V
I
I
F
D
--
I
R
T
L
E
R
L
Q
I
I
E
N
S
P
R
H
G
A
V
S
S
I
C
I
D
E
E
C
C
V
L
I
L
G
T
T
R
G
I
I
D
I
W
D
I
R
F
N
V
L
I
R
S
W
S
F
G
D
H
--
A
--
P
I
T
H
V
E
V
C
QFY
G
K
N
S
V
I
V
V
G
G
SSK---
T
F
L
T
I
W
NFVKGH
C
Q
Y
A
---
F
I
NSDEQPS
M
E
H
F
L
---------------
P
I
E
K
GLEELNFCG
I
R
--------------------
S
L
N
A
L
S
T
I
S
V
S
N
D
K
I
L
L
T
D
E
A
T
S
S
I
V
M
F
S
L
N
-
E
---------------------------
L
S
S
S
K
A
V
I
S
P
F
S
D
V
F
I
P
T
Q
V
T
A
N
L
T
M
L
L
R
K
M
K
H
D
I
I
N
S
I
S
T
C
E
V
DE
T
P
L
L
V
A
C
D
NSG
L
I
G
I
F
Q------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
59.01
29%
-162
- C4 -
3UZC
1
AA2AR_HUMAN
A:
[14-137]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
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
L
-------
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
A
Q
S
S
I
F
S
L
L
A
I
A
I
-----
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
---
V
T
G
T
R
A
A
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
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
A
A
A
------
R
R
Q
L
---
K
Q
-------
M
E
S
Q
P
---------------
L
P
G
E
---------
R
A
--------------------
R
S
T
L
Q
K
E
V
H
A
A
K
S
A
A
I
I
A
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
A
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
58.96
29%
-162
- C4 -
3PWH
1
?
A:
[14-137]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
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
L
-------
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
A
Q
S
S
I
F
S
L
L
A
I
A
I
-----
D
R
Y
I
A
I
A
I
P
L
R
Y
N
G
L
---
V
T
G
T
R
A
A
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
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
A
A
A
------
R
R
Q
L
---
K
Q
-------
M
E
S
Q
P
---------------
L
P
G
E
---------
R
A
--------------------
R
S
T
L
Q
K
E
V
H
A
A
K
S
A
A
I
I
A
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
A
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------