@TOME V2.3
(Mar 2018)
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 : LinJ_26_2460: (2018-03-10 )
MVTLKTSASPSVYPAKASVSARPSSQISAADQTAVERLQDLSYAEVQEAQEWLARAGSAKQAWAVSRSVPVVRPTEAVAADPLANESGGTAAALLEAAPASLDAAANLRFSQFFRASLMEEDSDDAAMSDGGRGAVHGGAGKDTGTREAVEMTRAGDVRRSTGPTRSCGEAAPRSCQHGGAFPSAWPYVASEFDGPGADVEVEKGDGDDLTDSPITGVPPSSTHLHRTSVDADGKAAAPLPDSSIFLSPSAPGASAKCTLVWPASPLLAERDSSTPARRSLSPATTARRWSLSCFDIGRRIGHGHSGKTFLAREKYSKVVVALKVFNDDYAQRHEGGTNMVERAMRLQAAAGRHCPHIVRLYAFFTDARRCYAALEYADAGDLATHLLRQPHQRLPEAQAQVIVYHVALALRHLHEQRVVHRAVTMRNVLLRRSEAGATAKLGDFASAVHLADGRARWLGELGGSHDGGRSLEYAAPEVICGRGWSCKSDMWALGILVFEMICGHHPFDHVSAAEMKRLICSGAACHSPHALSRTGMSFVRSLLCVDEAARSSAATALAHPFLSVNAAATTPAVASAMQDTAASGRTEPAGSAAQAAPASVAVAEEACMGAVALPVSRDLSSTFSLAAVLANTEANCGNDGGHSRSTAAMPTGTKATISCAGASLVSPAPRDDIPYARRDGNPSASSLTTTSPSPTVTPFSTAQRVTGTTRRAHGAAWHTADAVAPAASLLSTSSPGPLMSFALLTHPWQSTALPPSVTLSASSLFGALSDEGADTSSGRRPSATRLRSPGNASRHSPTTTLSDMSASVLSTTRTPTTLASGAAQPTGGAFTDSAAAESVLSGSFKSGNTHNTIYLHSQQHHARHGQQQEQQETPAAYGALGTTRSGERRRSEDTRGDCSVTVSSWTPRPSCDARTEWATQDADVSVSSLTVSSTSSSSMGAVVPQASFHTRASDAPPRQLTGRIASPMAVNGALQAERLPLTGRLASSTITLTSVRGAPGAPKAAVTSSHARRPPPGTKRLSKRRECSLRLAFETLSDEDSW
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.......450.......460.......470.......480.......490.......500.......510.......520...--------------------------------------------------------....530.......540.......550-----.-----......560.......570.......580.......590.......600.......610.......620.......630.......640.......650.......660.......670.......680.......690.......700.......710.......720.......730.......740.......750.......760.......770.......780.......790.......800.......810.......820.......830.......840.......850.......860.......870.......880.......890.......900.......910.......920.......930.......940.......950.......960.......970.......980.......990.......1000......1010......1020......1030......1040
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
M
V
T
L
KTSASPSVYPAKASVSARPSSQISA
A
D
Q
T
A
V
E
R
L
Q
DL
S
Y
A
E
V
Q
E
A
Q
E
W
L
A
RAGSAK
Q
A
W
A
VSRSVPVVRPTEAVAADPLANESGG
T
A
A
A
L
L
E
AAPASL
D
A
A
AN
L
R
F
S
Q
F
F
R
A
S
L
MEEDSDDAAMSDGGRGAVHGGAGKDTG
T
R
E
A
V
E
M
TRAGDVRRSTGPTRSCGEAAPRSCQHGGAFPSAW
P
Y
V
A
SEFDGPGA
D
V
E
V
EKGDGDDLTDSPITGVPPSST
H
L
H
R
TSVDADGKAAAPLPDS
S
I
F
LSPSAPGAS
A
K
C
T
L
V
WPASPLLAERDSSTPARRSLSPATT
A
R
R
W
S
L
S
C
F
D
I
G
R
R
IGHGHSGK
T
F
L
A
R
E
K
Y
S
K
V
V
V
A
L
K
VFN
D
D
Y
A
Q
R
HEG
G
T
N
M
V
E
R
A
M
R
L
Q
A
AAGRH
C
P
H
I
V
R
L
Y
A
F
F
T
D
A
R
R
C
Y
A
A
L
EYA
D
A
G
D
L
A
T
H
L
L
R
Q
P
H
Q
RL
P
E
A
Q
A
Q
V
I
V
Y
H
V
A
L
A
L
R
H
L
H
E
-
Q
R
V
V
H
R
A
V
T
M
R
N
V
L
L
RRSEAGATAKL
G
D
F
A
S
A
VHLAD
G
R
A
R
W
L
G
ELGGSHDGGRSLEYAAPEVICGRGWSC
K
S
D
M
W
A
L
G
I
L
V
F
E
M
I
CGHHPFDHV
S
A
A
E
M
K
R
L
I
CSGAA--------------------------------------------------------CHSP
H
A
L
S
R
T
G
M
S
F
V
R
S
L
L
C
V
D
E
A
AR
S
-----
S
-----
A
A
T
A
L
AH
P
F
L
SVNAAAT
T
P
A
V
A
S
A
M
Q
D
T
AASGRTEPAGSAAQAAP
A
S
V
A
V
A
E
E
ACM
G
A
VALPVS
R
D
L
S
S
T
F
S
L
A
A
V
L
ANTEANCGNDGGHSRSTAAMPTG
T
K
A
T
I
S
CAGASLVSPAPRDDIPYARRDGNPSASSLTTTSPSPTVTPFST
A
Q
R
VTGTTRRAHGAAWHT
A
D
A
V
A
P
A
A
S
L
LSTSSPGPL
M
S
F
A
L
LTHPWQSTALPP
S
V
T
L
S
A
S
S
L
F
G
ALSDEGADTSSGRRPSATRLRSPGNASRHSPTT
T
L
S
D
M
S
A
S
V
L
STTRTPTTLASGAAQPTGGAFT
D
S
A
A
A
E
S
V
L
SGSFKSGNTH
N
T
I
Y
L
HSQ
Q
H
H
A
RHG
Q
Q
Q
E
Q
Q
ETPAAYGALGTTRSGERRRSEDTRG
D
C
S
V
T
VSSWTPRPSCDARTEWATQDAD
V
S
V
S
S
L
T
V
SSTSSSSM
G
A
VVPQASFHTRASDA
P
P
R
Q
L
T
G
RIASPMAVNGALQAERLPLTGRLAS
S
T
I
T
L
T
SVRGAPGAPKAAVTSSHARRPPP
G
T
K
R
L
S
K
RRE
C
S
L
R
L
A
F
E
TLSDEDSW
9
PsiBlast_PDB
77.31
32%
-126
- C1 -
-
3D14
1
AURKA_MOUSE
A:
[2-269]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
L
G
S
-
R
Q
W
T
L
E
D
F
D
I
G
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
R
Q
S
K
F
I
L
A
L
K
V
L
F
K
T
Q
L
E
K
-
A
G
V
E
H
Q
L
R
R
E
V
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
L
Y
G
Y
F
H
D
A
T
R
V
Y
L
I
L
E
Y
A
P
L
G
T
V
Y
R
E
L
--
Q
K
L
S
R
F
D
E
Q
R
T
A
T
Y
I
T
E
L
A
N
A
L
S
Y
C
H
S
-
K
R
V
I
H
R
D
I
K
P
E
N
L
L
L
---
G
S
N
G
E
L
K
I
A
D
F
G
W
S
V
H
A
P
S
------
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
R
M
H
D
E
K
V
D
L
W
S
L
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
E
A
H
T
Y
Q
E
T
Y
R
R
I
-
S
R
V
E
--------------------------------------------------------
F
T
F
P
D
F
V
T
E
G
A
R
D
L
I
S
R
L
L
K
H
N
A
S
Q
R
L
-----
T
-----
L
A
E
V
L
E
H
P
W
I
K
A
N
S
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
76.81
31%
-116
- C1 -
-
2VRX
1
AUKBA_XENLA
A:
[11-279]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
F
T
I
D
D
F
D
I
G
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
K
Q
N
K
F
I
M
A
L
K
V
L
F
K
S
Q
L
E
K
-
E
G
V
E
H
Q
L
R
R
E
I
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
M
Y
N
Y
F
H
D
R
K
R
I
Y
L
M
L
E
F
A
P
R
G
E
L
Y
K
E
L
--
Q
K
H
G
R
F
D
E
Q
R
S
A
T
F
M
E
E
L
A
D
A
L
H
Y
C
H
E
-
R
K
V
I
H
R
D
I
K
P
E
N
L
L
M
G
Y
K
---
G
E
L
K
I
A
D
F
G
W
S
V
H
A
P
S
L
R
R
R
T
M
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
K
T
H
D
E
K
V
D
L
W
C
A
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
D
S
P
S
H
T
E
T
H
R
R
I
V
N
-
V
D
--------------------------------------------------------
L
K
F
P
P
F
L
S
D
G
S
K
D
L
I
S
K
L
L
R
Y
H
P
P
Q
R
L
-----
P
-----
L
K
G
V
M
E
H
P
W
V
K
A
N
S
R
R
V
L
P
P
V
Y
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
75.84
31%
-115
- C1 -
-
3ZTX
1
AUKBA_XENLA
A:
[10-279]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
F
T
I
D
D
F
D
I
G
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
K
Q
N
K
F
I
M
A
L
K
V
L
F
K
S
Q
L
E
K
-
E
G
V
E
H
Q
L
R
R
E
I
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
M
Y
N
Y
F
H
D
R
K
R
I
Y
L
M
L
E
F
A
P
R
G
E
L
Y
K
E
L
--
Q
K
H
G
R
F
D
E
Q
R
S
A
T
F
M
E
E
L
A
D
A
L
H
Y
C
H
E
-
R
K
V
I
H
R
D
I
K
P
E
N
L
L
M
G
Y
K
---
G
E
L
K
I
A
D
F
G
W
S
V
H
A
P
S
L
R
R
R
T
M
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
K
T
H
D
E
K
V
D
L
W
C
A
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
D
S
P
S
H
T
E
T
H
R
R
I
V
N
-
V
D
--------------------------------------------------------
L
K
F
P
P
F
L
S
D
G
S
K
D
L
I
S
K
L
L
R
Y
H
P
P
Q
R
L
-----
P
-----
L
K
G
V
M
E
H
P
W
V
K
A
N
S
R
R
V
L
P
P
V
Y
Q
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
75.63
31%
-116
- C1 -
-
4C2V
1
AUKBA_XENLA
A:
[12-282]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
F
T
I
D
D
F
D
I
G
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
K
Q
N
K
F
I
M
A
L
K
V
L
F
K
S
Q
L
E
K
-
E
G
V
E
H
Q
L
R
R
E
I
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
M
Y
N
Y
F
H
D
R
K
R
I
Y
L
M
L
E
F
A
P
R
G
E
L
Y
K
E
L
--
Q
K
H
G
R
F
D
E
Q
R
S
A
T
F
M
E
E
L
A
D
A
L
H
Y
C
H
E
-
R
K
V
I
H
R
D
I
K
P
E
N
L
L
M
G
Y
K
---
G
E
L
K
I
A
D
F
G
W
S
V
H
A
P
S
L
R
R
R
T
M
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
K
T
H
D
E
K
V
D
L
W
C
A
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
D
S
P
S
H
T
E
T
H
R
R
I
V
N
-
V
D
--------------------------------------------------------
L
K
F
P
P
F
L
S
D
G
S
K
D
L
I
S
K
L
L
R
Y
H
P
P
Q
R
L
-----
P
-----
L
K
G
V
M
E
H
P
W
V
K
A
N
S
R
R
V
L
P
P
V
Y
Q
S
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
74.98
31%
-116
- C1 -
-
2BFY
1
AUKBA_XENLA
A:
[9-279]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
K
F
T
I
D
D
F
D
I
V
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
K
Q
N
K
F
I
M
A
L
K
V
L
F
K
S
Q
L
E
K
-
E
G
V
E
H
Q
L
R
R
E
I
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
M
Y
N
Y
F
H
D
R
K
R
I
Y
L
M
L
E
F
A
P
R
G
E
L
Y
K
E
L
--
Q
K
H
G
R
F
D
E
Q
R
S
A
T
F
M
E
E
L
A
D
A
L
H
Y
C
H
E
-
R
K
V
I
H
R
D
I
K
P
E
N
L
L
M
G
Y
K
---
G
E
L
K
I
A
D
F
G
W
S
V
H
A
P
S
L
R
R
R
T
M
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
K
T
H
D
E
K
V
D
L
W
C
A
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
D
S
P
S
H
T
E
T
H
R
R
I
V
N
-
V
D
--------------------------------------------------------
L
K
F
P
P
F
L
S
D
G
S
K
D
L
I
S
K
L
L
R
Y
H
P
P
Q
R
L
-----
P
-----
L
K
G
V
M
E
H
P
W
V
K
A
N
S
R
R
V
L
P
P
V
Y
Q
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
74.94
32%
-129
- C1 -
-
3DJ7
1
AURKA_MOUSE
A:
[7-269]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
Q
W
T
L
E
D
F
D
I
G
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
R
Q
S
K
F
I
L
A
L
K
V
L
F
K
T
Q
L
E
K
-
A
G
V
E
H
Q
L
R
R
E
V
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
L
Y
G
Y
F
H
D
A
T
R
V
Y
L
I
L
E
Y
A
P
L
G
T
V
Y
R
E
L
--
Q
K
L
S
R
F
D
E
Q
R
T
A
T
Y
I
T
E
L
A
N
A
L
S
Y
C
H
S
-
K
R
V
I
H
R
D
I
K
P
E
N
L
L
L
---
G
S
N
G
E
L
K
I
A
D
F
G
W
S
V
H
A
P
S
------
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
R
M
H
D
E
K
V
D
L
W
S
L
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
E
A
H
T
Y
Q
E
T
Y
R
R
I
-
S
R
V
E
--------------------------------------------------------
F
T
F
P
D
F
V
T
E
G
A
R
D
L
I
S
R
L
L
K
H
N
A
S
Q
R
L
-----
T
-----
L
A
E
V
L
E
H
P
W
I
K
A
N
S
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
74.76
31%
-116
- C1 -
-
4C2W
1
AUKBA_XENLA
A:
[11-277]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
T
I
D
D
F
D
I
G
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
K
Q
N
K
F
I
M
A
L
K
V
L
F
K
S
Q
L
E
K
-
E
G
V
E
H
Q
L
R
R
E
I
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
M
Y
N
Y
F
H
D
R
K
R
I
Y
L
M
L
E
F
A
P
R
G
E
L
Y
K
E
L
--
Q
K
H
G
R
F
D
E
Q
R
S
A
T
F
M
E
E
L
A
D
A
L
H
Y
C
H
E
-
R
K
V
I
H
R
D
I
K
P
E
N
L
L
M
G
Y
K
---
G
E
L
K
I
A
D
F
G
W
S
V
H
A
P
S
L
R
R
R
T
M
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
K
T
H
D
E
K
V
D
L
W
C
A
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
D
S
P
S
H
T
E
T
H
R
R
I
V
N
-
V
D
--------------------------------------------------------
L
K
F
P
P
F
L
S
D
G
S
K
D
L
I
S
K
L
L
R
Y
H
P
P
Q
R
L
-----
P
-----
L
K
G
V
M
E
H
P
W
V
K
A
N
S
R
R
V
L
P
P
V
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
74.70
31%
-117
- C1 -
-
2VGO
1
AUKBA_XENLA
A:
[10-278]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
F
T
I
D
D
F
D
I
G
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
K
Q
N
K
F
I
M
A
L
K
V
L
F
K
S
Q
L
E
K
-
E
G
V
E
H
Q
L
R
R
E
I
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
M
Y
N
Y
F
H
D
R
K
R
I
Y
L
M
L
E
F
A
P
R
G
E
L
Y
K
E
L
--
Q
K
H
G
R
F
D
E
Q
R
S
A
T
F
M
E
E
L
A
D
A
L
H
Y
C
H
E
-
R
K
V
I
H
R
D
I
K
P
E
N
L
L
M
G
Y
K
---
G
E
L
K
I
A
D
F
G
W
S
V
H
A
P
S
L
R
R
R
T
M
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
K
T
H
D
E
K
V
D
L
W
C
A
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
D
S
P
S
H
T
E
T
H
R
R
I
V
N
-
V
D
--------------------------------------------------------
L
K
F
P
P
F
L
S
D
G
S
K
D
L
I
S
K
L
L
R
Y
H
P
P
Q
R
L
-----
P
-----
L
K
G
V
M
E
H
P
W
V
K
A
N
S
R
R
V
L
P
P
V
Y
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
74.69
31%
-121
- C1 -
-
2VGP
1
AUKBA_XENLA
A:
[11-279]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
T
I
D
D
F
D
I
G
R
P
L
G
K
G
---
N
V
Y
L
A
R
E
K
Q
N
K
F
I
M
A
L
K
V
L
F
K
S
Q
L
E
K
-
E
G
V
E
H
Q
L
R
R
E
I
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
M
Y
N
Y
F
H
D
R
K
R
I
Y
L
M
L
E
F
A
P
R
G
E
L
Y
K
E
L
--
Q
K
H
G
R
F
D
E
Q
R
S
A
T
F
M
E
E
L
A
D
A
L
H
Y
C
H
E
-
R
K
V
I
H
R
D
I
K
P
E
N
L
L
M
G
Y
K
---
G
E
L
K
I
A
D
F
G
W
S
V
H
A
P
S
L
R
R
R
T
M
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
K
T
H
D
E
K
V
D
L
W
C
A
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
D
S
P
S
H
T
E
T
H
R
R
I
V
N
-
V
D
--------------------------------------------------------
L
K
F
P
P
F
L
S
D
G
S
K
D
L
I
S
K
L
L
R
Y
H
P
P
Q
R
L
-----
P
-----
L
K
G
V
M
E
H
P
W
V
K
A
N
S
R
R
V
L
P
P
V
Y
Q
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
74.58
31%
-122
- C1 -
-
5EYK
1
AUKBA_XENLA
A:
[8-274]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
T
I
D
D
F
D
I
V
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
K
Q
N
K
F
I
M
A
L
K
V
L
F
K
S
Q
L
E
K
-
E
G
V
E
H
Q
L
R
R
E
I
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
M
Y
N
Y
F
H
D
R
K
R
I
Y
L
M
L
E
F
A
P
R
G
E
L
Y
K
E
L
--
Q
K
H
G
R
F
D
E
Q
R
S
A
T
F
M
E
E
L
A
D
A
L
H
Y
C
H
E
-
R
K
V
I
H
R
D
I
K
P
E
N
L
L
M
G
Y
K
---
G
E
L
K
I
A
D
F
G
W
S
V
H
A
----
R
R
T
M
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
K
T
H
D
E
K
V
D
L
W
C
A
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
D
S
P
S
H
T
E
T
H
R
R
I
V
N
-
V
D
--------------------------------------------------------
L
K
F
P
P
F
L
S
D
G
S
K
D
L
I
S
K
L
L
R
Y
H
P
P
Q
R
L
-----
P
-----
L
K
G
V
M
E
H
P
W
V
K
A
N
S
R
R
V
L
P
P
V
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
74.21
31%
-118
- C1 -
-
4B8M
1
AUKBA_XENLA
A:
[11-281]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
F
T
I
D
D
F
D
I
G
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
K
Q
N
K
F
I
M
A
L
K
V
L
F
K
S
Q
L
E
K
-
E
G
V
E
H
Q
L
R
R
E
I
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
M
Y
N
Y
F
H
D
R
K
R
I
Y
L
M
L
E
F
A
P
R
G
E
L
Y
K
E
L
--
Q
K
H
G
R
F
D
E
Q
R
S
A
T
F
M
E
E
L
A
D
A
L
H
Y
C
H
E
-
R
K
V
I
H
R
D
I
K
P
E
N
L
L
M
G
Y
K
---
G
E
L
K
I
A
D
F
G
W
S
V
H
A
P
S
L
R
R
R
T
M
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
K
T
H
D
E
K
V
D
L
W
C
A
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
D
S
P
S
H
T
E
T
H
R
R
I
V
N
-
V
D
--------------------------------------------------------
L
K
F
P
P
F
L
S
D
G
S
K
D
L
I
S
K
L
L
R
Y
H
P
P
Q
R
L
-----
P
-----
L
K
G
V
M
E
H
P
W
V
K
A
N
S
R
R
V
L
P
P
V
Y
Q
S
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
73.61
32%
-134
- C1 -
-
3D15
1
AURKA_MOUSE
A:
[7-269]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
Q
W
T
L
E
D
F
D
I
G
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
R
Q
S
K
F
I
L
A
L
K
V
L
F
K
T
Q
L
E
K
-
A
G
V
E
H
Q
L
R
R
E
V
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
L
Y
G
Y
F
H
D
A
T
R
V
Y
L
I
L
E
Y
A
P
L
G
T
V
Y
R
E
L
--
Q
K
L
S
R
F
D
E
Q
R
T
A
T
Y
I
T
E
L
A
N
A
L
S
Y
C
H
S
-
K
R
V
I
H
R
D
I
K
P
E
N
L
L
L
---
G
S
N
G
E
L
K
I
A
D
F
G
W
S
V
H
A
P
S
-------
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
R
M
H
D
E
K
V
D
L
W
S
L
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
E
A
H
T
Y
Q
E
T
Y
R
R
I
-
S
R
V
E
--------------------------------------------------------
F
T
F
P
D
F
V
T
E
G
A
R
D
L
I
S
R
L
L
K
H
N
A
S
Q
R
L
-----
T
-----
L
A
E
V
L
E
H
P
W
I
K
A
N
S
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
73.57
31%
-115
- C1 -
-
2BFX
-
AUKBA_XENLA
A:
[86-355]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
K
F
T
I
D
D
F
D
I
G
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
K
Q
N
K
F
I
M
A
L
K
V
L
F
K
S
Q
L
E
K
-
E
G
V
E
H
Q
L
R
R
E
I
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
M
Y
N
Y
F
H
D
R
K
R
I
Y
L
M
L
E
F
A
P
R
G
E
L
Y
K
E
L
--
Q
K
H
G
R
F
D
E
Q
R
S
A
T
F
M
E
E
L
A
D
A
L
H
Y
C
H
E
-
R
K
V
I
H
R
D
I
K
P
E
N
L
L
M
G
Y
K
---
G
E
L
K
I
A
D
F
G
W
S
V
H
A
P
S
L
R
R
R
T
M
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
K
T
H
D
E
K
V
D
L
W
C
A
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
D
S
P
S
H
T
E
T
H
R
R
I
V
N
-
V
D
--------------------------------------------------------
L
K
F
P
P
F
L
S
D
G
S
K
D
L
I
S
K
L
L
R
Y
H
P
P
Q
R
L
-----
P
-----
L
K
G
V
M
E
H
P
W
V
K
A
N
S
R
R
V
L
P
P
V
Y
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
73.43
32%
-132
- C1 -
-
3D2I
1
AURKA_MOUSE
A:
[8-269]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
W
T
L
E
D
F
D
I
G
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
R
Q
S
K
F
I
L
A
L
K
V
L
F
K
T
Q
L
E
K
-
A
G
V
E
H
Q
L
R
R
E
V
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
L
Y
G
Y
F
H
D
A
T
R
V
Y
L
I
L
E
Y
A
P
L
G
T
V
Y
R
E
L
--
Q
K
L
S
R
F
D
E
Q
R
T
A
T
Y
I
T
E
L
A
N
A
L
S
Y
C
H
S
-
K
R
V
I
H
R
D
I
K
P
E
N
L
L
L
---
G
S
N
G
E
L
K
I
A
D
F
G
W
S
V
H
A
P
-------
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
R
M
H
D
E
K
V
D
L
W
S
L
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
E
A
H
T
Y
Q
E
T
Y
R
R
I
-
S
R
V
E
--------------------------------------------------------
F
T
F
P
D
F
V
T
E
G
A
R
D
L
I
S
R
L
L
K
H
N
A
S
Q
R
L
-----
T
-----
L
A
E
V
L
E
H
P
W
I
K
A
N
S
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
45
HHSearch
70.60
20%
-109
- C1 -
-
4AZF
2
DYRK2_HUMAN
A:
[96-413]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
Y
R
Y
E
V
L
K
V
I
G
K
G
S
F
G
Q
V
V
K
A
Y
D
H
K
V
H
Q
H
V
A
L
K
M
V
R
N
E
K
R
F
H
-
R
Q
A
A
E
E
I
R
I
L
E
H
L
R
K
Q
D
K
D
N
T
M
N
V
I
H
M
L
E
N
F
T
F
R
N
H
I
C
M
T
F
E
L
L
S
M
-
N
L
Y
E
L
I
K
K
N
K
F
Q
G
F
S
L
P
L
V
R
K
F
A
H
S
I
L
Q
C
L
D
A
L
H
K
-
N
R
I
I
H
C
D
L
K
P
E
N
I
L
L
K
Q
Q
G
-
R
S
G
I
K
V
I
D
F
G
S
S
C
Y
E
H
Q
R
----------
V
Y
T
Y
I
Q
S
R
F
Y
R
A
P
E
V
I
L
G
A
R
Y
G
M
P
I
D
M
W
S
L
G
C
I
L
A
E
L
L
T
G
Y
P
L
L
P
G
E
D
E
G
D
Q
L
A
C
M
I
E
L
L
G
MP
S
Q
K
L
L
D
ASKRAKNFVSSKGYP
R
Y
C
T
V
T
TLS
D
V
V
L
N
G
G
RSR
R
G
K
L
R
G
PPES
R
E
W
G
N
A
L
K
G
C
D
D
P
L
F
L
D
F
L
K
Q
C
L
E
W
D
P
A
V
R
M
-----
T
-----
P
G
Q
A
L
R
H
P
W
L
R
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
69.31
32%
-144
- C1 -
-
3DJ6
1
AURKA_MOUSE
A:
[9-269]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
W
T
L
E
D
F
D
I
G
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
R
Q
S
K
F
I
L
A
L
K
V
L
F
K
T
Q
L
E
K
-
A
G
V
E
H
Q
L
R
R
E
V
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
L
Y
G
Y
F
H
D
A
T
R
V
Y
L
I
L
E
Y
A
P
L
G
T
V
Y
R
E
L
--
Q
K
L
S
R
F
D
E
Q
R
T
A
T
Y
I
T
E
L
A
N
A
L
S
Y
C
H
S
-
K
R
V
I
H
R
D
I
K
P
E
N
L
L
L
---
G
S
N
G
E
L
K
I
A
D
F
G
W
---------
T
T
L
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
R
M
H
D
E
K
V
D
L
W
S
L
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
E
A
H
T
Y
Q
E
T
Y
R
R
I
-
S
R
V
E
--------------------------------------------------------
F
T
F
P
D
F
V
T
E
G
A
R
D
L
I
S
R
L
L
K
H
N
A
S
Q
R
L
-----
T
-----
L
A
E
V
L
E
H
P
W
I
K
A
N
S
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
68.35
31%
-125
- C1 -
-
4B8L
1
AUKBA_XENLA
A:
[11-275]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
F
T
I
D
D
F
D
I
G
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
K
Q
N
K
F
I
M
A
L
K
V
L
F
K
S
Q
L
E
K
-
E
G
V
E
H
Q
L
R
R
E
I
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
M
Y
N
Y
F
H
D
R
K
R
I
Y
L
M
L
E
F
A
P
R
G
E
L
Y
K
E
L
--
Q
K
H
G
R
F
D
E
Q
R
S
A
T
F
M
E
E
L
A
D
A
L
H
Y
C
H
E
-
R
K
V
I
H
R
D
I
K
P
E
N
L
L
M
G
Y
K
---
G
E
L
K
I
A
D
F
-------------------------
T
L
D
Y
L
P
P
E
M
I
E
G
K
T
H
D
E
K
V
D
L
W
C
A
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
D
S
P
S
H
T
E
T
H
R
R
I
V
N
-
V
D
--------------------------------------------------------
L
K
F
P
P
F
L
S
D
G
S
K
D
L
I
S
K
L
L
R
Y
H
P
P
Q
R
L
-----
P
-----
L
K
G
V
M
E
H
P
W
V
K
A
N
S
R
R
V
L
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
67.32
32%
-146
- C1 -
-
3DJ5
1
AURKA_MOUSE
A:
[9-269]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
W
T
L
E
D
F
D
I
G
R
P
L
G
K
G
K
F
G
N
V
Y
L
A
R
E
R
Q
S
K
F
I
L
A
L
K
V
L
F
K
T
Q
L
E
K
-
A
G
V
E
H
Q
L
R
R
E
V
E
I
Q
S
H
L
-
R
H
-
P
N
I
L
R
L
Y
G
Y
F
H
D
A
T
R
V
Y
L
I
L
E
Y
A
P
L
G
T
V
Y
R
E
L
--
Q
K
L
S
R
F
D
E
Q
R
T
A
T
Y
I
T
E
L
A
N
A
L
S
Y
C
H
S
-
K
R
V
I
H
R
D
I
K
P
E
N
L
L
L
---
G
S
N
G
E
L
K
I
A
D
F
G
W
---------
T
T
L
C
G
---------
T
L
D
Y
L
P
P
E
M
I
E
G
R
M
H
D
E
K
V
D
L
W
S
L
G
V
L
C
Y
E
F
L
V
G
M
P
P
F
E
A
H
T
Y
Q
E
T
Y
R
R
I
-
S
R
V
E
--------------------------------------------------------
F
T
F
P
D
F
V
T
E
G
A
R
D
L
I
S
R
L
L
K
H
N
A
S
Q
R
L
-----
T
-----
L
A
E
V
L
E
H
P
W
I
K
A
N
S
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
38
HHSearch
65.22
25%
-129
- C1 -
-
1FOT
-
KAPA_YEAST
A:
[83-360]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
L
Q
D
F
Q
I
L
R
T
L
G
T
G
S
F
G
R
V
H
L
I
R
S
R
H
N
G
R
Y
Y
A
M
K
V
L
K
K
E
I
V
V
R
L
-
K
Q
V
E
H
T
N
D
E
R
L
M
L
--
S
I
V
T
H
P
F
I
I
R
M
W
G
T
F
Q
D
A
Q
Q
I
F
M
I
M
D
Y
I
E
G
G
E
L
F
S
L
L
R
K
S
--
Q
R
F
P
N
P
V
A
K
F
Y
A
A
E
V
C
L
A
L
E
Y
L
H
S
-
K
D
I
I
Y
R
D
L
K
P
E
N
I
L
L
D
K
N
---
G
H
I
K
I
T
D
F
G
F
A
K
Y
V
P
D
V
----------
T
Y
T
L
C
G
T
P
D
Y
I
A
P
E
V
V
S
T
K
P
Y
N
K
S
I
D
W
W
S
F
G
I
L
I
Y
E
M
L
A
G
Y
T
P
F
Y
D
S
N
T
M
K
T
Y
E
K
I
L
N
A
E
---------------------------------------------------------
L
R
F
P
P
F
F
N
E
D
V
K
D
L
L
S
R
L
I
T
R
D
L
S
Q
R
L
-----
G
NLQNG
T
E
D
V
K
N
H
P
W
F
K
E
V
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
28
HHSearch
63.07
25%
-78
- C1 -
-
4GV1
5
AKT1_HUMAN
A:
[5-276]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
T
M
N
E
F
E
Y
L
K
L
L
G
K
G
T
F
G
K
V
I
L
V
K
E
K
A
T
G
R
Y
Y
A
M
K
I
L
K
K
E
V
I
V
A
K
D
-
E
V
A
H
T
L
T
E
N
R
V
L
--
Q
N
S
R
H
P
F
L
T
A
L
K
Y
S
F
Q
T
H
D
R
L
C
F
V
M
E
Y
A
N
G
G
E
L
F
F
H
L
S
R
E
--
R
V
F
S
E
D
R
A
R
F
Y
G
A
E
I
V
S
A
L
D
Y
L
H
S
E
K
N
V
V
Y
R
D
L
K
L
E
N
L
M
L
D
K
D
---
G
H
I
K
I
T
D
F
G
L
C
K
E
G
I
K
D
G
-------
A
T
M
K
T
F
C
G
T
P
E
Y
L
A
P
E
V
L
E
D
N
D
Y
G
R
A
V
D
W
W
G
L
G
V
V
M
Y
E
M
M
C
G
R
L
P
F
Y
N
Q
D
H
E
K
L
F
E
L
I
L
M
E
E
---------------------------------------------------------
I
R
F
P
R
T
L
G
P
E
A
K
S
L
L
S
G
L
L
K
K
D
P
K
Q
R
L
GGGS
E
D
-----
A
K
E
I
M
Q
H
R
F
F
A
G
I
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------