@TOME V2.3
(Nov 2016)
Ref.
-
-
Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
Core Structure Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
Core Structure Cluster
Contacts with Ligands
Show alignment :
Atome selection
All alignments
Only Template with Ligand
Column output:
Score:
Atome Rank Value
Tools Score
Hide column
Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
Hide column
Structural Clustering:
Cluster Num
3D-Jury Struct. Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
Hide column
Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
Hide column
Sequence & Result Tab:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : SMO_HUMAN: (2016-01-14 )
MAAARPARGPELPLLGLLLLLLLGDPGRGAASSGNATGPGPRSAGGSARRSAAVTGPPPPLSHCGRAAPCEPLRYNVCLGSVLPYGATSTLLAGDSDSQEEAHGKLVLWSGLRNAPRCWAVIQPLLCAVYMPKCENDRVELPSRTLCQATRGPCAIVERERGWPDFLRCTPDRFPEGCTNEVQNIKFNSSGQCEVPLVRTDNPKSWYEDVEGCGIQCQNPLFTEAEHQDMHSYIAAFGAVTGLCTLFTLATFVADWRNSNRYPAVILFYVNACFFVGSIGWLAQFMDGARREIVCRADGTMRLGEPTSNETLSCVIIFVIVYYALMAGVVWFVVLTYAWHTSFKALGTTYQPLSGKTSYFHLLTWSLPFVLTVAILAVAQVDGDSVSGICFVGYKNYRYRAGFVLAPIGLVLIVGGYFLIRGVMTLFSIKSNHPGLLSEKAASKINETMLRLGIFGFLAFGFVLITFSCHFYDFFNQAEWERSFRDYVLCQANVTIGLPTKQPIPDCEIKNRPSLLVEKINLFAMFGTGIAMSTWVWTKATLLIWRRTWCRLTGQSDDEPKRIKKSKMIAKAFSKRHELLQNPGQELSFSMHTVSHDGPVAGLAFDLNEPSADVSSAWAQHVTKMVARRGAILPQDISVTPVATPVPPEEQANLWLVEAEISPELQKRLGRKKKRRKRKKEVCPLAPPPELHPPAPAPSTIPRLPQLPRQKCLVAAGAWGAGDSCRQGAWTLVSNPFCPEPSPPQDPFLPSAPAPVAWAHGRRQGLGPIHSRTNLMDTELMDADSDF
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.....
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MAAARPARGPEL
P
L
L
G
L
L
L
L
L
L
LGDPGRGAASSGNATGPGPRSAGGSARRSAAVTGPPP
P
L
S
HCGRAAPCEP
L
R
Y
NVCLGSVLPYGAT
S
T
LLAGDSDS
Q
E
EAH
G
K
L
V
L
-WSGLRNA
P
R
C
W
A
V
I
Q
P
L
L
C
A
V
YMPKCEN---D---RVEL---P
S
R
T
L
C
Q
ATRG
P
C
A
I
V
ERERG--W
P
D
F
L
RC-T----PDRFPEG-------CTN
E
V
Q
N
I
K
FNSSG--------Q
C
E
V
P
L
V
RTD
N
P
K
S
W
Y
E
D
V
EGCGIQCQNPLFT
E
A
E
H
Q
D
M
H
S
Y
I
A
A
F
G
A
V
T
G
L
C
T
L
F
T
L
A
T
F
V
A
D
WRNSNRY
P
A
V
I
L
F
Y
V
N
A
C
F
F
VG
S
I
G
W
L
A
Q
F
MDGAR
R
E
I
V
CRADG
T
M
RLGEPTSNE
T
L
S
C
V
I
I
F
V
I
V
Y
Y
A
L
M
A
G
V
V
W
F
V
V
L
T
Y
A
W
H
T
S
F
K
A
LGTTYQPLSGKT
S
Y
F
H
L
L
TWS
L
P
F
V
L
T
V
A
I
L
A
V
AQVDGDSV
S
G
I
C
F
V
GYKN
Y
R
Y
RA
G
F
V
L
A
P
I
G
L
V
L
I
V
G
G
Y
F
L
I
R
G
V
M
T
L
F
S
IKSNHPG
L
L
S
E
K
A
A
S
K
I
N
E
T
M
L
R
L
G
I
F
G
F
L
A
F
G
F
V
L
I
T
F
S
C
H
F
Y
D
F
F
N
Q
A
E
W
E
R
S
F
R
D
Y
V
L
C
QA
N
V
T
IGLPTKQPIPDCEIKNR
P
S
L
L
V
E
K
I
N
L
F
A
M
FGTGI
A
M
S
T
W
V
W
T
K
A
T
L
L
I
W
R
R
T
W
C
RLTGQSDD
E
P
K
R
I
K
K
S
K
M
I
A
K
A
F
S
K
R
H
E
L
L
QNPGQE
L
S
F
S
M
HTVSHDGPVA
G
L
A
F
DLNEPSA
D
V
S
S
A
W
A
Q
H
V
T
K
M
V
A
RRGAILPQDISVTPVATPVPPEEQA
N
L
W
L
V
EAEI
S
P
E
L
Q
K
R
L
G
R
K
K
K
R
R
K
R
K
KEVCPLAPPPELHPPAPAPSTIPRLPQL
P
R
Q
K
C
L
V
AAGAWGAGDSCRQG
A
W
T
LVSNPFCPEPSPPQDPFLPSAPAP
V
A
WAHGRRQGLGPIHSRTNLMDTELMDADSDF
1
PsiBlast_PDB
86.70
100%
-149
- C1 -
4JKV
10
C562_ECOLX (first)
A:
[110-470]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
G
--------
Q
C
E
V
P
L
V
R
T
D
N
P
K
S
W
Y
E
D
V
E
G
C
G
I
Q
C
Q
N
P
L
F
T
E
A
E
H
Q
D
M
H
S
Y
I
A
A
F
G
A
V
T
G
L
C
T
L
F
T
L
A
T
F
V
A
D
W
R
N
S
N
R
Y
P
A
V
I
L
F
Y
V
N
A
C
F
F
V
G
S
I
G
W
L
A
Q
F
M
D
G
A
R
R
E
I
V
C
R
A
D
G
T
M
R
L
G
E
P
T
S
N
E
T
L
S
C
V
I
I
F
V
I
V
Y
Y
A
L
M
A
G
V
V
W
F
V
V
L
T
Y
A
W
H
T
S
F
K
A
L
G
T
T
Y
Q
P
--
G
K
T
S
Y
F
H
L
L
T
W
S
L
P
F
V
L
T
V
A
I
L
A
V
A
Q
V
D
G
D
S
V
S
G
I
C
F
V
G
Y
K
N
Y
R
Y
R
A
G
F
V
L
A
P
I
G
L
V
L
I
V
G
G
Y
F
L
I
R
G
V
M
T
L
F
S
I
K
S
N
H
P
G
L
L
S
E
K
A
A
S
K
I
N
E
T
M
L
R
L
G
I
F
G
F
L
A
F
G
F
V
L
I
T
F
S
C
H
F
Y
D
F
F
N
Q
A
E
W
E
R
S
F
R
D
Y
V
L
C
Q
A
N
-------------
C
E
I
K
N
R
P
S
L
L
V
E
K
I
N
L
F
A
M
F
G
T
G
I
A
M
S
T
W
V
W
T
K
A
T
L
L
I
W
R
R
T
W
C
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
86.23
100%
-149
- C1 -
4N4W
7
SMO_HUMAN
A:
[110-473]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
G
--------
Q
C
E
V
P
L
V
R
T
D
N
P
K
S
W
Y
E
D
V
E
G
C
G
I
Q
C
Q
N
P
L
F
T
E
A
E
H
Q
D
M
H
S
Y
I
A
A
F
G
A
V
T
G
L
C
T
L
F
T
L
A
T
F
V
A
D
W
R
N
S
N
R
Y
P
A
V
I
L
F
Y
V
N
A
C
F
F
V
G
S
I
G
W
L
A
Q
F
M
D
G
A
R
R
E
I
V
C
R
A
D
G
T
M
R
L
G
E
P
T
S
N
E
T
L
S
C
V
I
I
F
V
I
V
Y
Y
A
L
M
A
G
V
V
W
F
V
V
L
T
Y
A
W
H
T
S
F
K
A
L
G
T
T
Y
Q
P
L
S
G
K
T
S
Y
F
H
L
L
T
W
S
L
P
F
V
L
T
V
A
I
L
A
V
A
Q
V
D
G
D
S
V
S
G
I
C
F
V
G
Y
K
N
Y
R
Y
R
A
G
F
V
L
A
P
I
G
L
V
L
I
V
G
G
Y
F
L
I
R
G
V
M
T
L
F
S
I
K
S
N
H
P
G
L
L
S
E
---
S
K
I
N
E
T
M
L
R
L
G
I
F
G
F
L
A
F
G
F
V
L
I
T
F
S
C
H
F
Y
D
F
F
N
Q
A
E
W
E
R
S
F
R
D
Y
V
L
C
Q
A
-------------
D
C
E
I
K
N
R
P
S
L
L
V
E
K
I
N
L
F
A
M
F
G
T
G
I
A
M
S
T
W
V
W
T
K
A
T
L
L
I
W
R
R
T
W
C
R
L
T
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
40
Fugue
86.06
80%
-121
- C1 -
4JKV
10
C562_ECOLX (first)
A:
[2-470]
----------------------------------------------------------------------------------------------
G
T
A
D
L
E
D
N
W
E
T
L
N
D
-
N
L
K
V
I
E
K
A
D
N
A
A
Q
V
K
D
A
L
T
K
M
R
A
A
A
L
D
A
---
Q
---
K
A
-----
T
P
P
K
L
E
D
K
S
P
D
S
P
E
M
K
D
F
R
H
G
--
F
D
I
L
V
G
Q
-
I
----
D
D
A
L
K
L
A
N
E
GK
V
K
E
A
Q
A
A
A
E
Q
L
K
T
T
R
N
A
YIQKYLSG
Q
C
E
V
P
L
V
R
T
D
N
P
K
S
W
Y
E
D
V
E
G
C
G
I
Q
C
Q
N
P
L
F
T
E
A
E
H
Q
D
M
H
S
Y
I
A
A
F
G
A
V
T
G
L
C
T
L
F
T
L
A
T
F
V
A
D
W
R
N
S
N
R
Y
P
A
V
I
L
F
Y
V
N
A
C
F
F
V
G
S
I
G
W
L
A
Q
F
M
D
G
A
R
R
E
I
V
C
R
A
D
G
T
M
R
L
G
E
P
T
S
N
E
T
L
S
C
V
I
I
F
V
I
V
Y
Y
A
L
M
A
G
V
V
W
F
V
V
L
T
Y
A
W
H
T
S
F
K
A
L
G
T
T
Y
Q
P
--
G
K
T
S
Y
F
H
L
L
T
W
S
L
P
F
V
L
T
V
A
I
L
A
V
A
Q
V
D
G
D
S
V
S
G
I
C
F
V
G
Y
K
N
Y
R
Y
R
A
G
F
V
L
A
P
I
G
L
V
L
I
V
G
G
Y
F
L
I
R
G
V
M
T
L
F
S
I
K
S
N
H
P
G
L
L
S
E
K
A
A
S
K
I
N
E
T
M
L
R
L
G
I
F
G
F
L
A
F
G
F
V
L
I
T
F
S
C
H
F
Y
D
F
F
N
Q
A
E
W
E
R
S
F
R
D
Y
V
L
C
Q
A
N
-------------
C
E
I
K
N
R
P
S
L
L
V
E
K
I
N
L
F
A
M
F
G
T
G
I
A
M
S
T
W
V
W
T
K
A
T
L
L
I
W
R
R
T
W
C
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_CBE
86.04
100%
-149
- C1 -
4JKV
7
C562_ECOLX (first)
B:
[110-472]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
G
--------
Q
C
E
V
P
L
V
R
T
D
N
P
K
S
W
Y
E
D
V
E
G
C
G
I
Q
C
Q
N
P
L
F
T
E
A
E
H
Q
D
M
H
S
Y
I
A
A
F
G
A
V
T
G
L
C
T
L
F
T
L
A
T
F
V
A
D
W
R
N
S
N
R
Y
P
A
V
I
L
F
Y
V
N
A
C
F
F
V
G
S
I
G
W
L
A
Q
F
M
D
G
A
R
R
E
I
V
C
R
A
D
G
T
M
R
L
G
E
P
T
S
N
E
T
L
S
C
V
I
I
F
V
I
V
Y
Y
A
L
M
A
G
V
V
W
F
V
V
L
T
Y
A
W
H
T
S
F
K
A
L
G
--------
K
T
S
Y
F
H
L
L
T
W
S
L
P
F
V
L
T
V
A
I
L
A
V
A
Q
V
D
G
D
S
V
S
G
I
C
F
V
G
Y
K
N
Y
R
Y
R
A
G
F
V
L
A
P
I
G
L
V
L
I
V
G
G
Y
F
L
I
R
G
V
M
T
L
F
S
I
K
S
N
H
P
G
L
L
S
E
K
A
A
S
K
I
N
E
T
M
L
R
L
G
I
F
G
F
L
A
F
G
F
V
L
I
T
F
S
C
H
F
Y
D
F
F
N
Q
A
E
W
E
R
S
F
R
D
Y
V
L
C
Q
A
N
------------
D
C
E
I
K
N
R
P
S
L
L
V
E
K
I
N
L
F
A
M
F
G
T
G
I
A
M
S
T
W
V
W
T
K
A
T
L
L
I
W
R
R
T
W
C
R
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
64.31
98%
-145
- C1 -
4QIN
1
C562_ECOLX (first)
A:
[6-250]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
C
E
V
P
L
V
R
T
D
N
P
K
S
W
Y
E
D
V
E
G
C
G
I
Q
C
Q
N
P
L
F
T
E
A
E
H
Q
D
M
H
S
Y
I
A
A
F
G
A
V
T
G
L
C
T
L
F
T
L
A
T
F
V
A
D
W
R
N
S
N
R
Y
P
A
V
I
L
F
Y
V
N
A
C
F
F
V
G
S
I
G
W
L
A
Q
F
M
D
G
A
R
R
E
I
V
C
R
A
D
G
T
M
R
L
G
E
P
T
S
N
E
T
L
S
C
V
I
I
F
V
I
V
Y
Y
A
L
M
A
G
V
V
W
F
V
V
L
T
Y
A
W
H
T
S
F
K
A
L
G
T
T
Y
Q
P
L
S
G
K
T
S
Y
F
H
L
L
T
W
S
L
P
F
V
L
T
V
A
I
L
A
V
A
Q
V
D
G
D
S
V
S
G
I
C
F
V
G
Y
K
N
Y
R
Y
R
A
G
F
V
L
A
P
I
G
L
V
L
I
V
G
G
Y
F
L
I
R
G
V
M
T
L
F
S
I
K
S
N
H
A
D
L
E
D
N
W
E
T
L
N
D
N
L
K
V
I
E
K
A
D
N
A
A
Q
V
K
D
A
L
T
K
M
R
A
A
A
L
D
A
Q
K
A
T
P
P
K
L
E
D
K
S
P
D
S
P
E
M
K
D
F
R
H
G
F
D
I
L
V
G
Q
I
D
D
A
L
K
L
A
N
E
G
K
V
K
E
A
Q
A
A
A
E
Q
L
K
T
T
R
N
A
Y
I
Q
K
Y
L
A
A
S
K
I
N
E
T
M
L
R
L
G
I
F
G
F
L
A
F
G
F
V
L
I
T
F
S
C
H
F
Y
D
F
F
N
Q
A
E
W
E
R
S
F
R
D
Y
V
L
C
Q
A
N
D
C
E
I
K
N
R
P
S
L
L
V
E
K
I
N
L
F
A
M
F
G
T
G
I
A
M
S
T
W
V
W
T
K
A
T
L
L
I
W
R
R
T
W
C
R
-----------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
63.40
98%
-145
- C1 -
4QIM
2
C562_ECOLX
A:
[4-250]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
G
--------
Q
C
E
V
P
L
V
R
T
D
N
P
K
S
W
Y
E
D
V
E
G
C
G
I
Q
C
Q
N
P
L
F
T
E
A
E
H
Q
D
M
H
S
Y
I
A
A
F
G
A
V
T
G
L
C
T
L
F
T
L
A
T
F
V
A
D
W
R
N
S
N
R
Y
P
A
V
I
L
F
Y
V
N
A
C
F
F
V
G
S
I
G
W
L
A
Q
F
M
D
G
A
R
R
E
I
V
C
R
A
D
G
T
M
R
L
G
E
P
T
S
N
E
T
L
S
C
V
I
I
F
V
I
V
Y
Y
A
L
M
A
G
V
V
W
F
V
V
L
T
Y
A
W
H
T
S
F
K
A
L
------
L
S
G
K
T
S
Y
F
H
L
L
T
W
S
L
P
F
V
L
T
V
A
I
L
A
V
A
Q
V
D
G
D
S
V
S
G
I
C
F
V
G
Y
K
N
Y
R
Y
R
A
G
F
V
L
A
P
I
G
L
V
L
I
V
G
G
Y
F
L
I
R
G
V
M
T
L
F
S
I
K
S
N
H
A
D
L
E
D
N
W
E
T
L
N
D
N
L
K
V
I
E
K
A
D
N
A
A
Q
V
K
D
A
L
T
K
M
R
A
A
A
L
D
A
Q
K
A
T
P
P
K
L
E
D
K
S
P
D
S
P
E
M
K
D
F
R
H
G
F
D
I
L
V
G
Q
I
D
D
A
L
K
L
A
N
E
G
K
V
K
E
A
Q
A
A
A
E
Q
L
K
T
T
R
N
A
Y
I
Q
K
Y
L
A
A
S
K
I
N
E
T
M
L
R
L
G
I
F
G
F
L
A
F
G
F
V
L
I
T
F
S
C
H
F
Y
D
F
F
N
Q
A
E
W
E
R
S
F
R
D
Y
V
L
C
Q
A
N
V
T
I
G
L
P
T
K
Q
P
I
P
D
C
E
I
K
N
R
P
S
L
L
V
E
K
I
N
L
F
A
M
F
G
T
G
I
A
M
S
T
W
V
W
T
K
A
T
L
L
I
W
R
R
T
W
C
R
L
T
---------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
62.80
98%
-149
- C1 -
4O9R
1
C562_ECOLX (first)
A:
[6-250]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
C
E
V
P
L
V
R
T
D
N
P
K
S
W
Y
E
D
V
E
G
C
G
I
Q
C
Q
N
P
L
F
T
E
A
E
H
Q
D
M
H
S
Y
I
A
A
F
G
A
V
T
G
L
C
T
L
F
T
L
A
T
F
V
A
D
W
R
N
S
N
R
Y
P
A
V
I
L
F
Y
V
N
A
C
F
F
V
G
S
I
G
W
L
A
Q
F
M
D
G
A
R
R
E
I
V
C
R
A
D
G
T
M
R
L
G
E
P
T
S
N
E
T
L
S
C
V
I
I
F
V
I
V
Y
Y
A
L
M
A
G
V
V
W
F
V
V
L
T
Y
A
W
H
T
S
F
K
----------
G
K
T
S
Y
F
H
L
L
T
W
S
L
P
F
V
L
T
V
A
I
L
A
V
A
Q
V
D
G
D
S
V
S
G
I
C
F
V
G
Y
K
N
Y
R
Y
R
A
G
F
V
L
A
P
I
G
L
V
L
I
V
G
G
Y
F
L
I
R
G
V
M
T
L
F
S
I
K
S
N
H
A
D
L
E
D
N
W
E
T
L
N
D
N
L
K
V
I
E
K
A
D
N
A
A
Q
V
K
D
A
L
T
K
M
R
A
A
A
L
D
A
Q
K
A
T
P
P
K
L
E
D
K
S
P
D
S
P
E
M
K
D
F
R
H
G
F
D
I
L
V
G
Q
I
D
D
A
L
K
L
A
N
E
G
K
V
K
E
A
Q
A
A
A
E
Q
L
K
T
T
R
N
A
Y
I
Q
K
Y
L
A
A
S
K
I
N
E
T
M
L
R
L
G
I
F
G
F
L
A
F
G
F
V
L
I
T
F
S
C
H
F
Y
D
F
F
N
Q
A
E
W
E
R
S
F
R
D
Y
V
L
C
Q
A
N
V
T
I
P
D
C
E
I
K
N
R
P
S
L
L
V
E
K
I
N
L
F
A
M
F
G
T
G
I
A
M
S
T
W
V
W
T
K
A
T
L
L
I
W
R
R
T
W
C
R
-------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_CBE
56.50
72%
-79
- C1 -
4C79
1
?
B:
[16-132]
---------------------------------------------------------------
C
K
K
S
T
T
C
E
V
L
K
Y
N
T
C
L
G
S
P
L
P
Y
T
H
T
S
L
I
L
A
E
D
S
E
T
Q
E
E
A
F
E
K
L
A
M
-
W
S
G
L
R
N
A
P
R
C
W
A
V
I
Q
P
L
L
C
A
V
Y
M
P
K
C
E
N
---
G
---
K
V
E
L
---
P
S
Q
H
L
C
Q
A
T
R
N
P
C
S
I
V
E
R
E
R
G
--
W
P
N
F
L
K
C
E
N
----
K
E
Q
F
P
K
G
-------
C
Q
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
54.89
72%
-81
- C1 -
4C79
2
?
A:
[16-132]
---------------------------------------------------------------
C
K
K
S
T
T
C
E
V
L
K
Y
N
T
C
L
G
S
P
L
P
Y
T
H
T
S
L
I
L
A
E
D
S
E
T
Q
E
E
A
F
E
K
L
A
M
-
W
S
G
L
R
N
A
P
R
C
W
A
V
I
Q
P
L
L
C
A
V
Y
M
P
K
C
E
N
---
G
---
K
V
E
L
---
P
S
Q
H
L
C
Q
A
T
R
N
P
C
S
I
V
E
R
E
R
G
--
W
P
N
F
L
K
C
E
N
----
K
E
Q
F
P
K
G
-------
C
Q
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
41
Fugue
54.84
71%
-83
- C1 -
4C7A
2
?
A:
[15-131]
--------------------------------------------------------------
F
C
K
K
S
T
T
C
E
V
L
K
Y
N
T
C
L
G
S
P
L
P
Y
T
H
T
S
L
I
L
A
E
D
S
E
T
Q
E
E
A
F
E
K
L
-
A
M
W
S
G
L
R
N
A
P
R
C
W
A
V
I
Q
P
L
L
C
A
V
Y
M
P
K
C
E
N
---
G
---
K
V
E
L
---
P
S
Q
H
L
C
Q
A
T
R
N
P
C
S
I
V
E
R
E
R
G
--
W
P
N
F
L
K
C
E
N
----
K
E
Q
F
P
K
G
-------
C
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
53.83
71%
-84
- C1 -
4C7A
2
?
A:
[16-131]
---------------------------------------------------------------
C
K
K
S
T
T
C
E
V
L
K
Y
N
T
C
L
G
S
P
L
P
Y
T
H
T
S
L
I
L
A
E
D
S
E
T
Q
E
E
A
F
E
K
L
A
M
-
W
S
G
L
R
N
A
P
R
C
W
A
V
I
Q
P
L
L
C
A
V
Y
M
P
K
C
E
N
---
G
---
K
V
E
L
---
P
S
Q
H
L
C
Q
A
T
R
N
P
C
S
I
V
E
R
E
R
G
--
W
P
N
F
L
K
C
E
N
----
K
E
Q
F
P
K
G
-------
C
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_CBE
53.53
71%
-80
- C1 -
4C7A
2
?
B:
[16-131]
---------------------------------------------------------------
C
K
K
S
T
T
C
E
V
L
K
Y
N
T
C
L
G
S
P
L
P
Y
T
H
T
S
L
I
L
A
E
D
S
E
T
Q
E
E
A
F
E
K
L
A
M
-
W
S
G
L
R
N
A
P
R
C
W
A
V
I
Q
P
L
L
C
A
V
Y
M
P
K
C
E
N
---
G
---
K
V
E
L
---
P
S
Q
H
L
C
Q
A
T
R
N
P
C
S
I
V
E
R
E
R
G
--
W
P
N
F
L
K
C
E
N
----
K
E
Q
F
P
K
G
-------
C
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
HHSearch
46.51
30%
-68
- C1 -
1IJY
-
FZD8_MOUSE
A:
[5-115]
------------------------------------------------------------------
E
L
A
C
Q
E
I
T
V
P
L
C
K
G
--
I
G
Y
E
Y
T
Y
M
P
N
Q
F
N
H
D
T
Q
D
E
A
G
L
E
V
H
Q
-
F
W
P
L
V
E
-
I
Q
C
S
P
D
L
K
F
F
L
C
S
M
Y
T
P
I
C
L
E
---
D
YK-
K
P
L
P
---
P
C
R
S
V
C
E
R
A
K
A
G
C
A
P
L
M
R
Q
Y
G
FA
W
P
D
R
M
R
C
-
D
------
R
L
P
E
Q
-------
G
N
P
D
T
L
C
M
D
Y
E
R
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
45.00
29%
-71
- C1 -
1IJY
-
FZD8_MOUSE
A:
[8-113]
---------------------------------------------------------------------
C
Q
E
I
T
V
P
L
C
K
G
--
I
G
Y
E
Y
T
Y
M
P
N
Q
F
N
H
D
T
Q
D
E
A
G
L
E
V
H
Q
-
F
W
P
L
V
E
I
-
Q
C
S
P
D
L
K
F
F
L
C
S
M
Y
T
P
I
C
L
E
---
D
---
Y
K
K
P
L
P
-
P
C
R
S
V
C
E
R
A
K
A
G
C
A
P
L
M
R
Q
Y
G
FA
W
P
D
R
M
R
C
-------
D
R
L
P
E
Q
-------
G
N
P
D
T
L
C
M
D
Y
E
R
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
43.97
27%
-76
- C1 -
5BQE
3
FZD4_HUMAN
C:
[7-126]
---------------------------------------------------------------------
C
D
P
I
R
I
S
M
C
Q
N
--
L
G
Y
N
V
T
-
M
P
N
L
V
G
H
E
L
Q
T
D
A
E
L
Q
L
T
T
-
F
T
P
L
I
Q
Y
G
-
C
S
S
Q
L
Q
F
F
L
C
S
V
Y
V
P
M
C
-
T
---
E
---
K
I
N
I
P
I
G
P
C
G
G
M
C
L
S
V
-
R
R
C
E
P
V
L
K
E
F
G
FA
W
P
E
S
L
N
C
-
S
------
K
F
P
P
---------
Q
N
D
H
N
H
M
C
M
E
G
P
G
--------
D
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
43
Fugue
43.65
25%
-51
- C1 -
1IJY
-
FZD8_MOUSE
A:
[5-126]
------------------------------------------------------------------
E
L
A
C
Q
E
I
T
V
P
L
C
K
G
--
I
G
Y
E
Y
T
Y
M
P
N
Q
F
N
H
D
T
Q
D
E
A
G
L
E
V
H
Q
-
F
W
P
L
V
E
I
-
Q
C
S
P
D
L
K
F
F
L
C
S
M
Y
T
P
I
C
L
E
DYK----
K
P
L
P
---
P
C
R
S
V
C
E
R
A
K
A
G
C
A
P
L
M
R
Q
Y
G
FA
W
P
D
R
M
R
C
-
D
R
L
P
E
Q
G
N
P
D
T
L
-------
C
M
D
Y
E
R
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
42
Fugue
43.29
26%
-51
- C1 -
1IJY
-
FZD8_MOUSE
A:
[5-126]
------------------------------------------------------------------
E
L
A
C
Q
E
I
T
V
P
L
C
K
G
--
I
G
Y
E
Y
T
Y
M
P
N
Q
F
N
H
D
T
Q
D
E
A
G
L
E
V
H
Q
-
F
W
P
L
V
E
I
-
Q
C
S
P
D
L
K
F
F
L
C
S
M
Y
T
P
I
C
L
E
---
D
YK-
K
P
L
P
---
P
C
R
S
V
C
E
R
A
K
A
G
C
A
P
L
M
R
Q
Y
G
FA
W
P
D
R
M
R
C
-
D
R
L
P
E
Q
G
N
P
D
T
L
-------
C
M
D
Y
E
R
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
HHSearch
42.51
28%
-81
- C1 -
1IJX
1
SFRP3_MOUSE
A:
[3-112]
-------------------------------------------------------------------
A
A
C
E
P
V
R
I
P
L
C
K
S
--
L
P
W
E
M
T
K
M
P
N
H
L
H
H
S
T
Q
A
N
A
I
L
A
M
E
Q
-
F
E
G
L
L
G
-
T
H
C
S
P
D
L
L
F
F
L
C
A
M
Y
A
P
I
C
T
I
---
D
FQH
E
P
I
K
---
P
C
K
S
V
C
E
R
A
R
Q
G
C
E
P
I
L
I
K
Y
R
HS
W
P
E
S
L
A
C
-
D
------
E
L
P
V
Y
-------
D
R
G
V
C
I
S
P
E
A
I
V
T
A
--------
D
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
41.56
29%
-73
- C1 -
4F0A
2
FZD8_MOUSE
A:
[8-113]
---------------------------------------------------------------------
C
Q
E
I
T
V
P
L
C
K
G
--
I
G
Y
N
Y
T
Y
M
P
N
Q
F
N
H
D
T
Q
D
E
A
G
L
E
V
H
Q
-
F
W
P
L
V
E
I
-
Q
C
S
P
D
L
K
F
F
L
C
S
M
Y
T
P
I
C
L
E
---
D
---
Y
K
K
P
L
P
-
P
C
R
S
V
C
E
R
A
K
A
G
C
A
P
L
M
R
Q
Y
G
FA
W
P
D
R
M
R
C
-------
D
R
L
P
E
Q
-------
G
N
P
D
T
L
C
M
D
A
A
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
41.19
27%
-82
- C1 -
5CM4
2
?
A:
[6-110]
---------------------------------------------------------------------
C
D
P
I
R
I
S
M
C
Q
N
--
L
G
Y
N
V
T
K
M
P
N
L
V
G
H
E
L
Q
T
D
A
E
L
Q
L
T
T
-
F
T
P
L
I
Q
Y
G
-
C
S
S
Q
L
Q
F
F
L
C
S
V
Y
V
P
M
C
-
T
---
E
---
K
I
N
I
P
I
G
P
C
G
G
M
C
L
S
V
K
R
R
C
E
P
V
L
K
E
F
G
FA
W
P
E
S
L
N
C
-
S
------
K
F
P
P
Q
-------
N
D
H
N
H
M
C
M
E
G
P
G
D
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------