@TOME V2.3
(Mar 2018)
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 : LinJ_27_1860: (2018-03-10 )
MQVNSLLERMRKVRQEKAAAAAAAPPAVTNATATVPAANAAIRDAPVSSAADADTAGGGGVVSSSLLTGVTVPAPPPVFASPSSARLEYRDNAKDPLCVPFTCDMIVPVLNALLSNQQHSSTSTVAAAASGGLNGAVVPMMTEAVNSIDATGGDTRDVSALSSASAEIPGAGRDSSGKESQSIVVAKAVVRMREVLAAQGPPQMPQKAAVESVPSITATGTATAAGAPVSSLRPSSASLFADAAYNTACAVARVDVSGAVRPICRDVNYYTRVGRISQGVYGVVFRAVTTADYERQHRQQSRHRVTRPGSAASSAAAPPGHVRTYALKHIKKMWLEDSQVGLPPYLMREIDLLLRLQHPNIMGALELVLLDPTPVPRRLASPPKSCSPSSSSSESPSSSSSLSSESPSTEQHAEEAAECDRALRRLRSTAEDTAGQNLAKKAKIDNAEEPLPQREEARPATQAQTKGEKGAAQDAAATRPLAAVGAASKAKDVFLVMDYCPYDLGSYMRRYATAAELYGDGDDCKSTHASAQVPYFHITPRNAHPQAAASYVARAKSIVYQILRAVAFLHDSRILHRDLKTSNVLLGEDGYVKVCDFGLGRLYREGQALTPTVVTLMYRAPELHFGVVDYSHKMDVWSVGCIFAELFLRRPLFHASTDSHHLLAVCEVLGIPTEESFPGLYHLPQTKTMMQSLPRWNRTSRLASLFQRGAVLPTVAHGDVPVAAEGALLPESGVDLLASVLQWNPRRRPSAAEALQHPFFKEEPLPCAPAELMRPMPWMDAAIAAGNAAPSAALVPEDRRDQPGSRGSQGCPSTATHMAPSTTGRPSSASVPPAMQHVADIPSGVEATVAAVSSASEGATAASPLASASPDTFPGGSRSVFVSDTVGGGYQQAISTRDYSGSDGDLAEEDEEEQRLQLHTRRSTRDQVEDDDDSDAETERVGRQARFLANQDRDE
Atome Classification :
(21 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...
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
M
Q
V
N
S
L
L
E
R
M
R
K
V
R
Q
E
K
A
AAAAAAPPAVTNA
T
A
TVPAANAAIRDAPVSSAADADTAGGG
G
V
V
S
SSLLTGVTVPAPPPVFASPSS
A
R
L
E
YRDNAKD
P
L
C
V
PF
T
C
D
M
I
V
P
V
L
N
A
L
LSNQQHSSTS
T
V
A
A
AASGGLNG
A
V
V
P
M
M
T
E
A
V
N
S
IDATGGDT
R
D
V
S
A
L
SSASAEIPGAGRDSSGKE
S
Q
S
I
V
V
A
K
A
V
V
R
M
R
E
V
L
AAQGPPQM
P
Q
K
A
A
V
ESVPSITATGTATAAGAPVSSLRPSS
A
S
L
F
A
DAAYNT
A
C
A
V
A
R
V
DVSGA
V
R
P
I
C
RD
V
N
Y
Y
T
R
V
G
R
I
SQ
G
V
Y
G
V
V
F
R
A
VT
T
A
D
Y
E
R
Q
H
R
Q
Q
S
RHRVTRPGSAASSAAAPP
G
H
V
R
T
Y
A
L
K
H
I
K
K
M
W
LE---D---S-QVGL
P
P
Y
L
M
R
E
I
D
L
L
L
RL-QHPNI
M
G
A
L
E
L
V
L
LDPTPV
P
R
RLASPPKSCSPSSSSSESPSSSSSLSSESP
S
T
E
Q
H
A
E
E
A
A
E
C
D
R
A
L
R
R
L
R
S
T
A
E
DTAGQ
N
L
A
K
KAKIDNAEEPLPQREEARPATQAQTKGEKGAAQDAAATRP
L
A
AVGAASKA
K
D
V
F
L
V
M
DYCP
Y
-
D
L
G
S
Y
M
R
R
Y
A
T
A
A
E
LYGDGDDCKSTHASAQV
P
Y
F
H
ITPRNA
H
P
Q
A
A
A
S
Y
V
A
R
A
K
S
I
V
Y
Q
I
L
R
A
V
A
F
L
HD
S
R
I
L
H
R
DLKTS
N
V
L
L--G-E--D--G----
Y
V
K
V
C
D
F
G
L
G
R
L
Y
R-EGQ-A-----L
T
P
T
V
V
T
L
M
YRAPE
L
H
F
G
-----
V
VDYSHKMD
V
W
S
V
G
C
I
F
A
E
L
F
L
RRPLFHASTD-S
H
H
L
L
A
V
C
E
V
LGIPTEESFPGLYHLP
Q
T
K
T
M
M
Q
SLPRWN
R
T
S
R
L
A
S
L
F
QRGAV
L
P
TVAHGDVPVAAEGALLPES
G
V
D
L
L
A
S
V
LQWNPRRRP
S
A
A
E
A
L
QHPFFKE--EPLPCA
P
A
E
L
MRPMP
W
M
D
A
A
IAAGNAAPSAALVPEDRRDQPGSRGSQGCPSTATHMAPSTTGRPSSASV
P
P
A
M
Q
H
V
A
DIPS
G
V
E
A
T
V
A
A
VSSASEGATAASPLASASPDTFPGGS
R
S
V
F
V
SDTVGG
G
Y
Q
Q
AISTRDYSGSDGDLAE
E
D
E
E
E
Q
R
L
Q
L
HTRRSTRDQVEDDDDS
D
A
E
T
E
R
V
G
R
Q
A
R
F
LANQDRDE
41
HHSearch
80.37
35%
-57
- C1 -
-
1UNL
1
CDK5_HUMAN
A:
[2-290]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
K
Y
E
K
L
E
K
I
G
E
G
T
Y
G
T
V
F
K
A
K
N
R
E
T
-----------------------------
H
E
I
V
A
L
K
R
V
R
L
D
D
D
D
----------
E
G
V
P
S
S
A
L
R
E
I
C
L
L
K
E
L
-
K
H
K
N
I
V
R
L
H
D
V
L
H
S
-----------------------------------------------------------------------------------------------------------------------
D
K
K
L
T
L
V
F
E
F
C
D
Q
-
D
L
K
K
Y
F
D
S
C
N
G
---------------------------
D
L
D
--------
P
E
I
V
K
S
F
L
F
Q
L
L
K
G
L
G
F
C
H
S
R
N
V
L
H
R
D
L
K
P
Q
N
L
L
I
--
N
-
R
--
N
--
G
----
E
L
K
L
A
N
F
G
L
A
R
A
F
G
-
I
P
V
R
C
-----
Y
S
A
E
V
V
T
L
W
Y
R
P
P
D
V
L
F
G
-----
A
K
L
Y
S
T
S
I
D
M
W
S
A
G
C
I
F
A
E
L
A
N
A
G
R
P
L
F
P
G
N
D
V
D
D
Q
L
K
R
I
F
R
L
L
G
T
P
T
E
E
Q
W
P
S
M
T
K
L
P
D
Y
K
P
Y
-------
P
-------
M
Y
P
A
----------
T
T
S
L
V
N
V
V
P
K
L
N
A
T
G
R
D
L
L
Q
N
L
L
K
C
N
P
V
Q
R
I
S
A
E
E
A
L
Q
H
P
Y
F
S
D
--
F
C
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
HHSearch
78.60
33%
-103
- C1 -
-
1UA2
1
CDK7_HUMAN
D:
[13-300]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
K
L
D
F
L
G
E
G
Q
F
A
T
V
Y
K
A
R
D
K
N
T
-----------------------------
N
Q
I
V
A
I
K
K
I
-------------------
N
R
T
A
L
R
E
I
K
L
L
Q
E
L
-
S
H
P
N
I
I
G
L
L
D
A
F
G
H
-----------------------------------------------------------------------------------------------------------------------
K
S
N
I
S
L
V
F
D
F
M
E
T
-
D
L
E
V
I
I
K
D
N
S
L
---------------------------
V
L
T
--------
P
S
H
I
K
A
Y
M
L
M
T
L
Q
G
L
E
Y
L
H
Q
H
W
I
L
H
R
D
L
K
P
N
N
L
L
L
--
D
-
E
--
N
--
G
----
V
L
K
L
A
D
F
G
L
A
K
S
F
G
-
S
P
N
R
A
-----
Y
T
H
Q
V
V
T
R
W
Y
R
A
P
E
L
L
F
G
-----
A
R
M
Y
G
V
G
V
D
M
W
A
V
G
C
I
L
A
E
L
L
L
R
V
P
F
L
P
G
D
S
D
-
L
D
Q
L
T
R
I
F
E
T
L
G
T
P
T
E
E
Q
W
P
D
M
C
S
L
P
D
Y
V
T
F
--------------
K
S
F
P
-----------
G
I
P
L
H
H
I
F
S
A
A
G
D
D
L
L
D
L
I
Q
G
L
F
L
F
N
P
C
A
R
I
T
A
T
Q
A
L
K
M
K
Y
F
S
N
--
R
P
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
39
HHSearch
75.45
36%
-77
- C- -
-
3GBZ
-
?
A:
[11-305]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
I
D
R
Y
R
R
I
T
K
L
G
E
G
T
Y
G
E
V
Y
K
A
I
D
T
V
T
-----------------------------
N
E
T
V
A
I
K
R
I
R
L
E
H
------------------
A
I
R
E
V
S
L
L
K
E
L
-
Q
H
R
N
I
I
E
L
K
S
V
I
H
H
-----------------------------------------------------------------------------------------------------------------------
N
H
R
L
H
L
I
F
E
Y
A
E
N
-
D
L
K
K
Y
M
D
K
N
P
D
----------------------------
V
S
--------
M
R
V
I
K
S
F
L
Y
Q
L
I
N
G
V
N
F
C
H
S
R
R
C
L
H
R
D
L
K
P
Q
N
L
L
L
SV-----
T
--
P
----
V
L
K
I
G
D
F
G
L
A
R
A
F
G
-----------------
T
L
W
Y
R
P
P
E
I
L
L
G
-----
S
R
H
Y
S
T
S
V
D
I
W
S
I
A
C
I
W
A
E
M
L
M
K
T
P
L
F
P
G
D
S
E
-
I
D
Q
L
F
K
I
F
E
V
L
G
L
P
D
D
T
T
W
P
G
V
T
A
L
P
D
W
K
Q
S
F
---
P
K
F
R
-
G
K
T
L
K
R
-------------------
V
L
G
A
L
L
D
D
E
G
L
D
L
L
T
A
M
L
E
M
D
P
V
K
R
I
S
A
K
N
A
L
E
H
P
Y
F
S
H
--
N
D
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
HHSearch
74.96
30%
-74
- C1 -
-
5BYZ
7
MK07_HUMAN
A:
[4-307]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
G
D
E
Y
E
I
I
E
T
I
G
N
G
A
Y
G
V
V
S
S
A
R
R
R
L
T
-----------------------------
G
Q
Q
V
A
I
K
K
I
P
N
A
F
D
V
----------
V
T
N
A
K
R
T
L
R
E
L
K
I
L
K
H
F
-
K
H
D
N
I
I
A
I
K
D
I
L
R
P
T
V
P
-----------------------------------------------------------------------------------------------------------------
Y
G
E
F
K
S
V
Y
V
V
L
D
L
M
E
S
-
D
L
H
Q
I
I
H
S
S
Q
P
----------------------------
L
T
--------
L
E
H
V
R
Y
F
L
Y
Q
L
L
R
G
L
K
Y
M
H
S
A
Q
V
I
H
R
D
L
K
P
S
N
L
L
V
--
N
-
E
--
N
--
C
----
E
L
K
I
G
D
F
G
M
A
R
G
L
C
-
T
S
P
-
A
EHQYF
M
T
E
Y
V
A
T
R
W
Y
R
A
P
E
L
M
L
S
-----
L
H
E
Y
T
Q
A
I
D
L
W
S
V
G
C
I
F
G
E
M
L
A
R
R
Q
L
F
P
G
K
N
Y
-
V
H
Q
L
Q
L
I
M
M
V
L
G
T
P
S
P
A
V
I
Q
A
V
G
A
E
-
R
V
R
A
Y
---
I
Q
S
L
P
---------
P
R
---------
Q
P
V
P
W
E
T
V
Y
P
G
A
D
R
Q
A
L
S
L
L
G
R
M
L
R
F
E
P
S
A
R
I
S
A
A
A
A
L
R
H
P
F
L
A
K
--
Y
H
D
P
D
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
40
HHSearch
74.41
29%
-94
- C1 -
-
4NM5
5
GSK3B_HUMAN
A:
[39-334]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
Q
E
V
S
Y
T
D
T
K
V
I
G
N
G
S
F
G
V
V
Y
Q
A
K
L
C
D
S
-----------------------------
G
E
L
V
A
I
K
K
V
L
Q
D
K
----------------
R
F
K
N
R
E
L
Q
I
M
R
K
L
-
D
H
C
N
I
V
R
L
R
Y
F
F
Y
S
S
G
E
-----------------------------------------------------------------------------------------------------------------
K
K
D
E
V
Y
L
N
L
V
L
D
Y
V
P
E
-
T
V
Y
R
V
A
R
H
Y
S
R
A
K
------------------------
Q
T
L
P
--------
V
I
Y
V
K
L
Y
M
Y
Q
L
F
R
S
L
A
Y
I
H
S
F
G
I
C
H
R
D
I
K
P
Q
N
L
L
L
--
D
-
P
D-
T
--
A
----
V
L
K
L
C
D
F
G
S
A
K
Q
L
V
-
R
G
E
-
P
-----
N
V
S
Y
I
C
S
R
Y
Y
R
A
P
E
L
I
F
G
-----
A
T
D
Y
T
S
S
I
D
V
W
S
A
G
C
V
L
A
E
L
L
L
G
Q
P
I
F
P
G
D
S
G
-
V
D
Q
L
V
E
I
I
K
V
L
G
T
P
T
R
E
Q
I
R
E
M
N
P
N
--
Y
T
E
F
--
K
F
P
Q
I
K
-
A
H
P
W
T
K
-------------------
V
F
R
P
R
T
P
P
E
A
I
A
L
C
S
R
L
L
E
Y
T
P
T
A
R
L
T
P
L
E
A
C
A
H
S
F
F
D
E
--
L
R
D
P
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
HHSearch
73.97
30%
-92
* C1 *
-
1J1B
1
GSK3B_HUMAN
B:
[52-345]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
E
V
S
Y
T
D
T
K
V
I
G
N
G
S
F
G
V
V
Y
Q
A
K
L
C
D
S
-----------------------------
G
E
L
V
A
I
K
K
V
L
Q
D
K
----------------
R
F
K
N
R
E
L
Q
I
M
R
K
L
-
D
H
C
N
I
V
R
L
R
Y
F
F
Y
S
S
G
E
-----------------------------------------------------------------------------------------------------------------
K
K
D
E
V
Y
L
N
L
V
L
D
Y
V
P
E
-
T
V
Y
R
V
A
R
H
Y
S
R
A
K
------------------------
Q
T
L
P
--------
V
I
Y
V
K
L
Y
M
Y
Q
L
F
R
S
L
A
Y
I
H
S
F
G
I
C
H
R
D
I
K
P
Q
N
L
L
L
--
D
-
P
D-
T
--
A
----
V
L
K
L
C
D
F
G
S
A
K
Q
L
V
-
R
G
E
-
P
-----
N
V
S
Y
I
C
S
R
Y
Y
R
A
P
E
L
I
F
G
-----
A
T
D
Y
T
S
S
I
D
V
W
S
A
G
C
V
L
A
E
L
L
L
G
Q
P
I
F
P
G
D
S
G
-
V
D
Q
L
V
E
I
I
K
V
L
G
T
P
T
R
E
Q
I
R
E
M
N
--
P
N
Y
T
E
F
--
K
F
P
Q
I
K
-
A
H
P
W
T
K
-------------------
V
F
R
P
R
T
P
P
E
A
I
A
L
C
S
R
L
L
E
Y
T
P
T
A
R
L
T
P
L
E
A
C
A
H
S
F
F
D
E
--
L
R
D
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
35
HHSearch
73.74
36%
-78
- C1 -
-
3GC0
1
?
A:
[32-326]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
I
D
R
Y
R
R
I
T
K
L
G
E
G
T
Y
G
E
V
Y
K
A
I
D
T
V
T
-----------------------------
N
E
T
V
A
I
K
R
I
R
L
E
H
-----------------
T
A
I
R
E
V
S
L
L
K
E
L
-
Q
H
R
N
I
I
E
L
K
S
V
I
H
H
-----------------------------------------------------------------------------------------------------------------------
N
H
R
L
H
L
I
F
E
Y
A
E
N
-
D
L
K
K
Y
M
D
K
N
P
D
----------------------------
V
S
--------
M
R
V
I
K
S
F
L
Y
Q
L
I
N
G
V
N
F
C
H
S
R
R
C
L
H
R
D
L
K
P
Q
N
L
L
L
SV--
E
--
T
--
P
----
V
L
K
I
G
D
F
G
L
A
R
A
F
---------------
E
I
I
T
L
W
Y
R
P
P
E
I
L
L
G
-----
S
R
H
Y
S
T
S
V
D
I
W
S
I
A
C
I
W
A
E
M
L
M
K
T
P
L
F
P
G
D
S
E
-
I
D
Q
L
F
K
I
F
E
V
L
G
L
P
D
D
T
T
W
P
G
V
T
A
L
P
D
W
K
Q
S
---
F
P
K
F
R
-
G
K
T
L
K
-------------------
R
V
L
G
A
L
L
D
D
E
G
L
D
L
L
T
A
M
L
E
M
D
P
V
K
R
I
S
A
K
N
A
L
E
H
P
Y
F
S
H
--
N
D
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
38
HHSearch
72.05
28%
-131
- C1 -
-
4BGQ
3
CDKL5_HUMAN
A:
[10-302]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
M
N
K
F
E
I
L
G
V
V
G
E
G
A
Y
G
V
V
L
K
C
R
H
K
E
T
-----------------------------
H
E
I
V
A
I
K
K
F
K
-----------------
V
K
E
T
T
L
R
E
L
K
M
L
R
T
L
-
K
Q
E
N
I
V
E
L
K
E
A
F
R
R
-----------------------------------------------------------------------------------------------------------------------
R
G
K
L
Y
L
V
F
E
Y
V
E
K
-
N
M
L
E
L
L
E
E
M
P
N
---------------------------
G
V
P
--------
P
E
K
V
K
S
Y
I
Y
Q
L
I
K
A
I
H
W
C
H
K
N
D
I
V
H
R
D
I
K
P
E
N
L
L
I
--
S
-
H
--
N
--
D
----
V
L
K
L
C
D
F
G
F
A
R
N
L
S
-
E
---------------
T
R
W
Y
R
S
P
E
L
L
L
G
-----
A
-
P
Y
G
K
S
V
D
M
W
S
V
G
C
I
L
G
E
L
S
D
G
Q
P
L
F
P
G
E
S
E
-
I
D
Q
L
F
T
I
Q
K
V
L
G
P
L
P
S
E
Q
M
K
L
F
Y
S
N
P
R
F
H
G
L
--
R
F
P
A
V
N
-------------------
H
P
Q
S
L
E
R
R
Y
L
G
I
L
N
S
V
L
L
D
L
M
K
N
L
L
K
L
D
P
A
D
R
Y
L
T
E
Q
C
L
N
H
P
T
F
Q
T
--
Q
R
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
32
HHSearch
64.98
27%
0
- C- -
-
3EB0
3
?
A:
[6-347]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
K
K
Y
S
L
G
K
T
L
G
T
G
-
F
G
I
V
C
E
V
F
D
I
E
S
-----------------------------
G
K
R
F
A
L
K
K
V
L
Q
D
P
----------------
R
Y
K
N
R
E
L
D
I
M
K
V
L
-
D
H
V
N
I
I
K
L
V
D
Y
F
Y
T
T
----------------------------------------------------------------------------------------------------------------------
N
K
Y
L
N
V
I
M
E
Y
V
P
D
-
T
L
H
K
V
L
K
S
F
I
R
S
G
------------------------
R
S
I
P
--------
M
N
L
I
S
I
Y
I
Y
Q
L
F
R
A
V
G
F
I
H
S
L
G
I
C
H
R
D
I
K
P
Q
N
L
L
V
--
N
S
K
--
D
--
N
----
T
L
K
L
C
D
F
G
S
A
K
K
L
I
-
P
S
E
-
P
-----
S
V
A
Y
I
C
S
R
F
Y
R
A
P
E
L
M
L
G
-----
A
T
E
Y
T
P
S
I
D
L
W
S
I
G
C
V
F
G
E
L
I
L
G
K
P
L
F
S
G
E
T
S
-
I
D
Q
L
V
R
I
I
Q
I
M
G
T
P
T
K
E
Q
M
I
R
M
--
N
P
H
Y
--
V
--
R
F
P
T
L
K
-
A
K
D
W
R
K
I
-------------------
L
P
E
G
T
P
S
L
A
I
D
L
L
E
Q
I
L
R
Y
E
P
D
L
R
I
N
P
Y
E
A
M
A
H
P
F
F
D
H
--
L
R
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
28
HHSearch
60.01
28%
-38
- C1 -
-
2Y7J
1
PHKG2_HUMAN
C:
[91-365]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
F
Y
Q
K
Y
D
P
K
D
V
I
G
R
G
V
S
S
V
V
R
R
C
V
H
R
A
T
-----------------------------
G
H
E
F
A
V
K
I
M
E
V
T
A
E
R
---
L
SPE
Q
-
L
E
E
V
R
E
A
T
R
R
E
T
H
I
L
R
Q
V
A
G
H
P
H
I
I
T
L
I
D
S
Y
E
S
-----------------------------------------------------------------------------------------------------------------------
S
S
F
M
F
L
V
F
D
L
M
R
K
G
E
L
F
D
Y
L
T
E
K
V
A
----------------------------
L
S
--------
E
K
E
T
R
S
I
M
R
S
L
L
E
A
V
S
F
L
H
A
N
N
I
V
H
R
D
L
K
P
E
N
I
L
L
--
D
-
D
--
N
--
M
----
Q
I
R
L
S
D
F
G
F
S
C
H
L
E
-
P
G
E
-
K
-----
L
R
E
L
C
G
T
P
G
Y
L
A
P
E
I
L
K
C
SMDET
H
P
G
Y
G
K
E
V
D
L
W
A
C
G
V
I
L
F
T
L
L
A
G
S
P
P
F
W
H
R
R
Q
-
I
L
M
L
R
M
I
M
E
G
-----------
Q
------------
Y
Q
F
-----
S
----
S
-----------------
P
E
W
D
D
R
S
S
T
V
K
D
L
I
S
R
L
L
Q
V
D
P
E
A
R
L
T
A
E
Q
A
L
Q
H
P
F
F
E
R
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
29
HHSearch
58.84
28%
-36
- C1 -
-
2Y7J
1
PHKG2_HUMAN
D:
[92-365]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
Y
Q
K
Y
D
P
K
D
V
I
G
R
G
V
S
S
V
V
R
R
C
V
H
R
A
T
-----------------------------
G
H
E
F
A
V
K
I
M
E
V
---
R
LSP
E
---
Q
-
L
E
E
V
R
E
A
T
R
R
E
T
H
I
L
R
Q
V
A
G
H
P
H
I
I
T
L
I
D
S
Y
E
S
-----------------------------------------------------------------------------------------------------------------------
S
S
F
M
F
L
V
F
D
L
M
R
K
G
E
L
F
D
Y
L
T
E
K
V
A
----------------------------
L
S
--------
E
K
E
T
R
S
I
M
R
S
L
L
E
A
V
S
F
L
H
A
N
N
I
V
H
R
D
L
K
P
E
N
I
L
L
--
D
-
D
--
N
--
M
----
Q
I
R
L
S
D
F
G
F
S
C
H
L
E
-
P
G
E
-
K
-----
L
R
E
L
C
G
T
P
G
Y
L
A
P
E
I
L
K
C
SMDET
H
P
G
Y
G
K
E
V
D
L
W
A
C
G
V
I
L
F
T
L
L
A
G
S
P
P
F
W
H
R
R
Q
-
I
L
M
L
R
M
I
M
E
G
-----------
Q
------------
Y
Q
F
------
S
---
S
-----------------
P
E
W
D
D
R
S
S
T
V
K
D
L
I
S
R
L
L
Q
V
D
P
E
A
R
L
T
A
E
Q
A
L
Q
H
P
F
F
E
R
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
57.77
38%
-150
- C1 -
-
1CKP
2
CDK2_HUMAN
A:
[105-294]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
S
Y
L
F
Q
L
L
Q
G
L
A
F
C
H
S
H
R
V
L
H
R
D
L
K
P
Q
N
L
L
I
--
N
-
T
--
E
--
G
----
A
I
K
L
A
D
F
G
L
A
R
A
F
-----------------
V
T
L
W
Y
R
A
P
E
I
L
L
G
-----
C
K
Y
Y
S
T
A
V
D
I
W
S
L
G
C
I
F
A
E
M
V
T
R
R
A
L
F
P
G
D
S
E
-
I
D
Q
L
F
R
I
F
R
T
L
G
T
P
D
E
V
V
W
P
G
V
T
S
M
P
D
Y
K
P
---
S
F
P
K
W
A
R
Q
D
-----
F
S
K
--
V
V
P
P
--------------
L
D
E
D
G
R
S
L
L
S
Q
M
L
H
Y
D
P
N
K
R
I
S
A
K
A
A
L
A
H
P
F
F
Q
D
V
T
K
P
V
P
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
56.52
38%
-146
- C1 -
-
1DI8
1
CDK2_HUMAN
A:
[105-294]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
S
Y
L
F
Q
L
L
Q
G
L
A
F
C
H
S
H
R
V
L
H
R
D
L
K
P
Q
N
L
L
I
--
N
-
T
--
E
--
G
----
A
I
K
L
A
D
F
G
L
A
R
A
F
---------------
E
V
V
T
L
W
Y
R
A
P
E
I
L
L
G
-----
C
K
Y
Y
S
T
A
V
D
I
W
S
L
G
C
I
F
A
E
M
V
T
R
R
A
L
F
P
G
D
S
E
-
I
D
Q
L
F
R
I
F
R
T
L
G
T
P
D
E
V
V
W
P
G
V
T
S
M
P
D
Y
K
P
---
S
F
P
K
W
A
R
Q
D
-----
F
S
K
--
V
V
P
P
--------------
L
D
E
D
G
R
S
L
L
S
Q
M
L
H
Y
D
P
N
K
R
I
S
A
K
A
A
L
A
H
P
F
F
Q
D
V
T
K
P
V
P
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
56.00
38%
-149
- C1 -
-
1FVT
1
CDK2_HUMAN
A:
[105-294]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
S
Y
L
F
Q
L
L
Q
G
L
A
F
C
H
S
H
R
V
L
H
R
D
L
K
P
Q
N
L
L
I
--
N
-
T
--
E
--
G
----
A
I
K
L
A
D
F
G
L
A
R
A
F
G
---------------
V
V
T
L
W
Y
R
A
P
E
I
L
L
G
-----
C
K
Y
Y
S
T
A
V
D
I
W
S
L
G
C
I
F
A
E
M
V
T
R
R
A
L
F
P
G
D
S
E
-
I
D
Q
L
F
R
I
F
R
T
L
G
T
P
D
E
V
V
W
P
G
V
T
S
M
P
D
Y
K
P
---
S
F
P
K
W
A
R
Q
D
-----
F
S
K
--
V
V
P
P
--------------
L
D
E
D
G
R
S
L
L
S
Q
M
L
H
Y
D
P
N
K
R
I
S
A
K
A
A
L
A
H
P
F
F
Q
D
V
T
K
P
V
P
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
HHSearch
55.64
24%
-53
- C1 -
-
1TKI
-
TITIN_HUMAN
A:
[21-282]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Y
E
K
Y
M
I
A
E
D
L
G
R
G
E
F
G
I
V
H
R
C
V
E
T
S
S
-----------------------------
K
K
T
Y
M
A
K
F
V
K
V
K
G
T
-------------
D
Q
V
L
V
K
K
E
I
S
I
L
N
I
A
-
R
H
R
N
I
L
H
L
H
E
S
F
E
S
-----------------------------------------------------------------------------------------------------------------------
M
E
E
L
V
M
I
F
E
F
I
S
G
L
D
I
F
E
R
I
N
T
S
A
F
---------------------------
E
L
N
--------
E
R
E
I
V
S
Y
V
H
Q
V
C
E
A
L
Q
F
L
H
S
H
N
I
G
H
F
D
I
R
P
E
N
I
I
Y
--
Q
-
T
RR
S
--
S
----
T
I
K
I
I
E
F
G
Q
A
R
Q
L
K
-
P
G
D
-
N
-----
F
R
L
L
F
T
A
P
E
Y
Y
A
P
E
V
H
Q
H
-----
D
-
V
V
S
T
A
T
D
M
W
S
L
G
T
L
V
Y
V
L
L
S
G
I
N
P
F
L
A
E
T
N
-
Q
Q
I
I
E
N
I
M
N
A
E
Y
T
---------------------
F
D
-----
E
---
E
--------------------
A
F
K
E
I
S
I
E
A
M
D
F
V
D
R
L
L
V
K
E
R
K
S
R
M
T
A
S
E
A
L
Q
H
P
W
L
K
Q
--
K
I
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
54.23
38%
-78
- C1 -
-
2BKZ
1
CDK2_HUMAN
A:
[110-303]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
S
Y
L
F
Q
L
L
Q
G
L
A
F
C
H
S
H
R
V
L
H
R
D
L
K
P
Q
N
L
L
I
--
N
-
T
--
E
--
G
----
A
I
K
L
A
D
F
G
L
A
R
A
F
G
V
P
V
R
-
T
-----
Y
T
H
E
V
V
T
L
W
Y
R
A
P
E
I
L
L
G
-----
C
K
Y
Y
S
T
A
V
D
I
W
S
L
G
C
I
F
A
E
M
V
T
R
R
A
L
F
P
G
D
S
E
-
I
D
Q
L
F
R
I
F
R
T
L
G
T
P
D
E
V
V
W
P
G
V
T
S
M
P
D
Y
K
P
---
S
F
P
K
W
A
R
Q
D
-----
F
S
K
--
V
V
P
P
--------------
L
D
E
D
G
R
S
L
L
S
Q
M
L
H
Y
D
P
N
K
R
I
S
A
K
A
A
L
A
H
P
F
F
Q
D
--
V
T
K
P
V
P
H
L
R
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
27
HHSearch
54.03
25%
-29
- C1 -
-
2X0G
-
DAPK1_HUMAN
A:
[8-281]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
V
D
D
Y
Y
D
T
G
E
E
L
G
S
G
Q
F
A
V
V
K
K
C
R
E
K
S
T
-----------------------------
G
L
Q
Y
A
A
K
F
I
K
K
R
R
T
K
---
S
---
S
R
R
G
V
S
R
E
D
I
E
R
E
V
S
I
L
K
E
I
-
Q
H
P
N
V
I
T
L
H
E
V
Y
E
N
-----------------------------------------------------------------------------------------------------------------------
K
T
D
V
I
L
I
L
E
L
V
A
G
G
E
L
F
D
F
L
A
E
K
E
S
----------------------------
L
T
--------
E
E
E
A
T
E
F
L
K
Q
I
L
N
G
V
Y
Y
L
H
S
L
Q
I
A
H
F
D
L
K
P
E
N
I
M
L
--
L
-
D
--
R
--
N
VP
K
P
R
I
K
I
I
D
F
G
L
A
H
K
I
D
-
F
G
N
-
E
-----
F
K
N
I
F
G
T
P
E
F
V
A
P
E
I
V
N
Y
-----
E
-
P
L
G
L
E
A
D
M
W
S
I
G
V
I
T
Y
I
L
L
S
G
A
S
P
F
L
G
D
T
K
-
Q
E
T
L
A
N
V
S
A
V
N
Y
------------------------------
E
F
E
D
-------------------
E
Y
F
S
N
T
S
A
L
A
K
D
F
I
R
R
L
L
V
K
D
P
K
K
R
M
T
I
Q
D
S
L
Q
H
P
W
I
K
P
--
K
D
T
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
53.27
25%
-29
- C1 -
-
4B4L
3
DAPK1_HUMAN
A:
[10-283]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
V
D
D
Y
Y
D
T
G
E
E
L
G
S
G
Q
F
A
V
V
K
K
C
R
E
K
S
T
-----------------------------
G
L
Q
Y
A
A
K
F
I
K
K
R
R
T
K
---
S
---
S
R
R
G
V
S
R
E
D
I
E
R
E
V
S
I
L
K
E
I
-
Q
H
P
N
V
I
T
L
H
E
V
Y
E
N
-----------------------------------------------------------------------------------------------------------------------
K
T
D
V
I
L
I
L
E
L
V
A
G
G
E
L
F
D
F
L
A
E
K
E
S
----------------------------
L
T
--------
E
E
E
A
T
E
F
L
K
Q
I
L
N
G
V
Y
Y
L
H
S
L
Q
I
A
H
F
D
L
K
P
E
N
I
M
L
--
L
-
D
--
R
--
N
VP
K
P
R
I
K
I
I
D
F
G
L
A
H
K
I
D
-
F
G
N
-
E
-----
F
K
N
I
F
G
T
P
E
F
V
A
P
E
I
V
N
Y
-----
E
-
P
L
G
L
E
A
D
M
W
S
I
G
V
I
T
Y
I
L
L
S
G
A
S
P
F
L
G
D
T
K
-
Q
E
T
L
A
N
V
S
A
V
N
--------------------------
Y
----
E
F
E
D
E
-------------------
Y
F
S
N
T
S
A
L
A
K
D
F
I
R
R
L
L
V
K
D
P
K
K
R
M
T
I
Q
D
S
L
Q
H
P
W
I
K
P
--
K
D
T
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
53.25
38%
-74
- C1 -
-
2WIP
1
CDK2_HUMAN
A:
[110-303]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
S
Y
L
F
Q
L
L
Q
G
L
A
F
C
H
S
H
R
V
L
H
R
D
L
K
P
Q
N
L
L
I
--
N
-
T
--
E
--
G
----
A
I
K
L
A
D
F
G
L
A
R
A
F
G
V
P
V
R
-
T
-----
Y
T
H
E
V
V
T
L
W
Y
R
A
P
E
I
L
L
G
-----
C
K
Y
Y
S
T
A
V
D
I
W
S
L
G
C
I
F
A
E
M
V
T
R
R
A
L
F
P
G
D
S
E
-
I
D
Q
L
F
R
I
F
R
T
L
G
T
P
D
E
V
V
W
P
G
V
T
S
M
P
D
Y
K
P
---
S
F
P
K
W
A
R
Q
D
-----
F
S
K
--
V
V
P
P
--------------
L
D
E
D
G
R
S
L
L
S
Q
M
L
H
Y
D
P
N
K
R
I
S
A
K
A
A
L
A
H
P
F
F
Q
D
--
V
T
K
P
V
P
H
L
R
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
42
HHSearch
52.61
22%
-61
- C1 -
-
1KOB
1
?
A:
[50-313]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Y
D
Y
Y
D
I
L
E
E
L
G
S
G
A
F
G
V
V
H
R
C
V
E
K
A
T
-----------------------------
G
R
V
F
V
A
K
F
I
N
T
P
Y
P
L
------------
D
K
Y
T
V
K
N
E
I
S
I
M
N
Q
L
-
H
H
P
K
L
I
N
L
H
D
A
F
E
D
-----------------------------------------------------------------------------------------------------------------------
K
Y
E
M
V
L
I
L
E
F
L
S
G
G
E
L
F
D
R
I
A
A
E
D
Y
---------------------------
K
M
S
--------
E
A
E
V
I
N
Y
M
R
Q
A
C
E
G
L
K
H
M
H
E
H
S
I
V
H
L
D
I
K
P
E
N
I
M
C
--
E
-
T
--
K
KA
S
----
S
V
K
I
I
D
F
G
L
A
T
K
L
N
-
P
D
E
-
I
-----
V
K
V
T
T
A
T
A
E
F
A
A
P
E
I
V
D
R
-----
E
-
P
V
G
F
Y
T
D
M
W
A
I
G
V
L
G
Y
V
L
L
S
G
L
S
P
F
A
G
E
D
D
-
L
E
T
L
Q
N
V
K
R
C
D
-------
W
-------------------
E
---
F
D
E
D
--------------------
A
F
S
S
V
S
P
E
A
K
D
F
I
K
N
L
L
Q
K
E
P
R
K
R
L
T
V
H
D
A
L
E
H
P
W
L
K
G
--
D
H
S
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
51.38
38%
-76
- C1 -
-
1FIN
1
CDK2_HUMAN
A:
[105-294]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
S
Y
L
F
Q
L
L
Q
G
L
A
F
C
H
S
H
R
V
L
H
R
D
L
K
P
Q
N
L
L
I
--
N
-
T
--
E
--
G
----
A
I
K
L
A
D
F
G
L
A
R
A
F
G
V
P
V
R
-
T
-----
Y
T
H
E
V
V
T
L
W
Y
R
A
P
E
I
L
L
G
-----
C
K
Y
Y
S
T
A
V
D
I
W
S
L
G
C
I
F
A
E
M
V
T
R
R
A
L
F
P
G
D
S
E
-
I
D
Q
L
F
R
I
F
R
T
L
G
T
P
D
E
V
V
W
P
G
V
T
S
M
P
D
Y
K
P
---
S
F
P
K
W
A
R
Q
D
-----
F
S
K
--
V
V
P
P
--------------
L
D
E
D
G
R
S
L
L
S
Q
M
L
H
Y
D
P
N
K
R
I
S
A
K
A
A
L
A
H
P
F
F
Q
D
V
T
K
P
V
P
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------