@TOME V2.2
(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 : S12A5_HUMAN: (2015-12-09 )
MSRRFTVTSLPPAGPARSPDPESRRHSVADPRHLPGEDVKGDGNPKESSPFINSTDTEKGKEYDGKNMALFEEEMDTSPMVSSLLSGLANYTNLPQGSREHEEAENNEGGKKKPVQAPRMGTFMGVYLPCLQNIFGVILFLRLTWVVGIAGIMESFCMVFICCSCTMLTAISMSAIATNGVVPAGGSYYMISRSLGPEFGGAVGLCFYLGTTFAGAMYILGTIEILLAYLFPAMAIFKAEDASGEAAAMLNNMRVYGTCVLTCMATVVFVGVKYVNKFALVFLGCVILSILAIYAGVIKSAFDPPNFPICLLGNRTLSRHGFDVCAKLAWEGNETVTTRLWGLFCSSRFLNATCDEYFTRNNVTEIQGIPGAASGLIKENLWSSYLTKGVIVERSGMTSVGLADGTPIDMDHPYVFSDMTSYFTLLVGIYFPSVTGIMAGSNRSGDLRDAQKSIPTGTILAIATTSAVYISSVVLFGACIEGVVLRDKFGEAVNGNLVVGTLAWPSPWVIVIGSFFSTCGAGLQSLTGAPRLLQAISRDGIVPFLQVFGHGKANGEPTWALLLTACICEIGILIASLDEVAPILSMFFLMCYMFVNLACAVQTLLRTPNWRPRFRYYHWTLSFLGMSLCLALMFICSWYYALVAMLIAGLIYKYIEYRGAEKEWGDGIRGLSLSAARYALLRLEEGPPHTKNWRPQLLVLVRVDQDQNVVHPQLLSLTSQLKAGKGLTIVGSVLEGTFLENHPQAQRAEESIRRLMEAEKVKGFCQVVISSNLRDGVSHLIQSGGLGGLQHNTVLVGWPRNWRQKEDHQTWRNFIELVRETTAGHLALLVTKNVSMFPGNPERFSEGSIDVWWIVHDGGMLMLLPFLLRHHKVWRKCKMRIFTVAQMDDNSIQMKKDLTTFLYHLRITAEVEVVEMHESDISAYTYEKTLVMEQRSQILKQMHLTKNEREREIQSITDESRGSIRRKNPANTRLRLNVPEETAGDSEEKPEEEVQLIHDQSAPSCPSSSPSPGEEPEGEGETDPEKVHLTWTKDKSVAEKNKGPSPVSSEGIKDFFSMKPEWENLNQSNVRRMHTAVRLNEVIVKKSRDAKLVLLNMPGPPRNRNGDENYMEFLEVLTEHLDRVMLVRGGGREVITIYS
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......1050......1060......1070......1080......1090......1100......1110......1120......1130......
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MSR
R
F
T
VTSLPPAGPARSPD
P
E
S
RRHSVADPRHLPGEDVKGDGNPKESSPFINSTDTEKGKEYDGKN
M
A
L
F
E
E
EMDT
S
P
M
V
S
S
L
L
S
G
L
A
NYTNLPQGSREHEEAENNEGGKKKPVQAPR
M
G
T
F
M
G
V
Y
L
P
C
L
Q
N
I
F
G
V
I
L
F
L
-
R
L
T
W
V
V
G
I
A
G
I
M
E
S
F
C
M
V
F
I
CC
S
C
T
M
L
T
A
I
S
M
S
A
IATNGVVPAGG-
S
Y
Y
M
I
SRSLGPEF-G
G
A
V
G
L
C
F
Y
L
G
T
T
F
A
G
A
M
Y
I
L
G
T
I
E
I
L
L
A
Y
L
F
P
A
M
A
I
F
KAEDASG
E
A
A
A
M
LNNM
R
V
Y
G
T
C
V
L
T
C
M
A
T
V
V
F
V
-
G
V
K
Y
V
N
K
F
A
L
V
F
L
G
C
V
I
L
S
I
-
L
A
I
Y
A
G
V
I
K
SAFDPPNF
P
I
C
L
LG-NRTLSRH
G
F
D
V
C
A
K
L
AWEGNE
T
V
T
T
R
L
W
G
L
F
C
S
-----
S
R
FLN
A
T
C
D
E
Y
F
TRNNV
T
E
IQGIPG
A
A
S
G
L
I
K
E
N
L
W
S
S
Y
LTK
G
V
I
V
ERSGMTSVGLADGTPIDMDH
P
-
Y
V
F
S
D
M
----
T
S
Y
F
T
L
L
V
G
I
YFPS
V
T
G
IMAGSNRSG
D
L
R
D
A
Q
KSIPT
G
T
I
L
A
I
ATT
S
A
V
Y
I
S
S
V
V
--
L
F
G
A
C
I
E
G
V
V
L
R
D
KFGEAVNG
N
L
V
V
G
-TLAWPS
P
W
V
I
V
I
G
S
F
F
S
T
C
G
A
G
L
Q
SLTG
A
P
R
L
L
Q
A
I
SRDG
I
V
P
F
L
Q
V
FGHGKANGE
P
T
W
A
L
L
L
T
A
C
I
C
E
I
G
I
L
I
-------
A
S
L
D
E
V
A
P
I
L
S
M
F
F
L
M
C
Y
M
F
V
N
L
A
C
A
V
Q
T
L
L
RTPNWRP
R
F
R
Y
Y
H
W
T
L
S
F
L
G
M
S
L
C
L
A
L
M
F
I
C
---
S
W
------
Y
Y
A
L
V
A
M
L
I
A
G
L
I
Y
K
Y
I
E
YRGAE
K
E
WGDGIRGL
S
L
S
A
A
R
Y
A
L
L
R
LEEGPPHTKNWR
P
Q
L
L
V
L
V
R
VDQDQNVV
H
P
Q
L
L
S
L
T
S
Q
LKAGK
G
-
L
T
I
V
G
S
V
L
E
G
T
FLEN-------------H--------P
Q
--
A
Q
R
A
E
---
E
S
I
R
R
---
L
---
M
E
---
A
E
K
V
-
K
G
F
C
Q
V
V
I
SSN
L
R
D
G
V
S
H
-
L
I
Q
SGGLGGLQHN
T
V
L
V
GWPRNWRQK
E
D
H
Q
T
W
R
N
F
I
E
L
V
R
E
TTAG
H
L
A
L
L
V
TKNVSMFPG
N
P
E
RFSEG
S
I
D
V
W
--------
W
I
V--------HDG
G
M
L
M
L
L
P
F
L
L
R
H
H
K
V
W
R
KCK
M
R
I
F
T
V
A
QMDDN
S
I
Q
M
K
K
D
L
T
T
F
L
Y
H
L
R
I
T
A
E
V
E
V
V
E
MHESDI
S
A
Y
T
Y
E
K
T
L
V
---
M
E
Q
R
S
Q
I
L
K
Q
M
HLT
K
N
E
R
E
R
E
I
Q
S
I
T
D
ESRGSIR--RKNPAN
T
R
L
R
L
NVPEETAGDSEEK
P
E
E
E
V
Q
L
I
HDQSAPSCPSSSPSPGEEPEGEGETDP
E
K
V
H
L
T
WTKDK
S
V
A
EKNKGPSPV
S
S
E
G
I
K
D
F
F
SMKPEWENL
N
Q
S
N
V
R
R
M
H
T
A
V
R
L
N
E
V
I
VKKSRD
A
K
L
V
L
L
NMPGPPRNRNG
D
E
N
Y
M
E
F
L
E
V
L
T
E
H
L
D
R
V
M
L
V
RGGG
R
E
V
I
T
IYS
6
HHSearch
94.69
18%
-147
- C2 -
3GIA
7
Y609_METJA
A:
[3-431]
------------------------------------------------------------------------------------------------------------------
L
K
N
K
K
L
S
L
W
E
A
V
S
M
-
A
V
G
V
M
I
G
A
S
I
F
S
-
I
F
G
V
G
A
K
I
A
G
R
-
N
L
P
E
T
F
I
L
S
G
I
Y
A
L
L
V
A
Y
S
Y
T
K
L
G
A
K
-
I
V
S
N
A
G
-
P
I
A
F
I
H
K
A
I
G
D
N
I
I
T
G
A
L
S
I
L
L
W
M
S
Y
V
I
S
I
A
L
F
A
K
G
F
A
G
Y
F
L
P
L
I
N
A
P
I
--------------
N
T
F
N
I
A
I
T
E
I
G
I
V
A
F
F
T
A
L
N
F
F
-
G
S
K
A
V
G
R
A
E
F
F
I
V
L
V
K
L
L
I
L
-
G
L
F
I
F
A
G
L
I
T
-
I
H
P
S
--------------------------------------------------------------------------------
Y
V
I
P
D
L
A
P
S
-------------------------------
A
----
V
S
G
M
I
F
A
S
A
I
F
F
L
S
Y
M
G
F
G
V
I
T
N
A
S
E
H
I
E
N
P
K
K
N
V
P
R
A
I
F
I
S
I
L
I
V
M
F
V
Y
V
G
V
A
I
--
S
A
I
G
N
L
P
I
D
E
L
I
K
A
S
E
N
A
L
--
A
V
A
A
K
P
F
L
G
N
L
G
F
L
L
I
S
I
G
A
L
F
S
I
S
S
A
M
N
A
T
I
Y
G
G
A
N
V
A
Y
S
L
A
K
D
G
E
L
P
--
E
F
F
E
R
K
V
W
F
K
S
T
-
E
G
L
Y
I
T
S
A
L
G
V
L
F
A
L
L
-------
F
N
M
E
G
V
A
S
I
T
S
A
V
F
M
V
I
Y
L
F
V
I
L
S
H
Y
I
L
I
-
D
-
E
V
G
G
R
K
E
I
----
V
I
F
S
F
I
V
V
L
G
V
F
L
L
L
L
Y
Y
---
Q
W
I
T
N
R
F
V
F
Y
G
I
I
A
T
F
I
G
V
L
I
F
E
I
I
Y
R
K
V
T
K
R
T
F
S
N
N
M
Y
V
K
S
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
HHSearch
79.80
15%
-143
- C2 -
3L1L
2
ADIC_ECO57
A:
[7-431]
--------------------------------------------------------------------------------------------------------------------
A
H
K
V
G
L
I
P
V
T
L
M
-
V
S
G
A
I
M
G
S
G
V
F
L
-
L
P
A
N
L
A
S
-
T
G
G
-
I
A
I
Y
G
W
L
V
T
I
I
G
A
L
G
L
S
M
V
Y
A
K
M
S
F
L
-
D
P
S
P
G
G
-
S
Y
A
Y
A
R
R
C
F
G
P
F
L
-
G
Y
Q
T
N
V
L
Y
W
L
A
C
W
I
G
N
I
A
M
V
V
I
G
V
G
Y
L
S
Y
F
F
P
I
L
K
--------------
D
P
W
V
L
T
I
T
C
V
V
V
L
W
I
F
V
L
L
N
I
V
-
G
P
K
M
I
T
R
V
Q
A
V
A
T
V
L
A
L
I
P
I
-
V
G
I
A
V
F
G
W
F
W
-
F
R
G
E
T
Y
--------------------------------------------------------------------------------
M
A
-------------------------------------------
A
I
Q
S
T
L
N
V
T
L
W
S
F
I
G
V
E
S
A
S
V
A
A
G
V
V
K
N
P
K
R
N
V
P
I
A
T
I
G
G
V
L
I
A
A
V
C
Y
V
L
S
T
T
--
A
I
M
G
M
I
P
N
A
A
L
R
V
S
-
A
S
P
F
-
G
D
A
A
R
M
-
A
L
G
D
T
A
G
A
I
V
S
F
C
A
A
A
G
C
L
G
S
L
G
G
W
T
L
L
A
G
Q
T
A
K
A
A
A
D
D
G
L
F
P
--
P
I
F
A
R
V
N
K
A
G
T
P
V
A
G
L
I
I
V
G
I
L
M
T
I
F
Q
L
S
SISPNAT
K
E
F
G
L
V
S
S
V
S
V
I
F
T
L
V
P
Y
L
Y
T
C
A
A
L
L
L
L
-
G
H
G
H
F
G
K
A
R
P
---
A
Y
L
A
V
T
T
I
A
F
L
Y
C
I
W
A
V
V
G
S
---
G
A
K
E
V
---
M
W
S
F
V
T
L
M
V
I
T
A
M
Y
A
L
N
Y
N
R
L
H
K
N
P
Y
P
L
D
A
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
19
Fugue
75.04
16%
-92
- C2 -
3GIA
7
Y609_METJA
A:
[3-435]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
K
N
K
K
L
S
L
W
E
A
V
S
M
A
V
G
V
M
I
G
A
S
I
F
S
I
F
G
V
G
A
K
I
A
G
R
N
L
P
E
T
F
I
L
S
G
I
Y
A
L
L
V
A
Y
S
Y
T
K
L
G
A
K
I
V
S
N
A
G
P
I
A
F
I
H
K
A
I
G
D
N
I
I
T
G
A
L
S
I
L
L
W
M
S
Y
V
I
-
S
I
A
L
F
A
K
G
F
A
G
Y
F
L
P
L
I
NAP
I
N
T
F
N
I
A
I
T
E
I
G
I
V
A
F
F
T
A
L
N
F
F
G
S
K
A
V
G
R
A
E
F
F
I
V
L
V
K
L
L
I
L
G
L
F
I
F
A
G
L
I
T
I
H
P
S
Y
V
I
P
D
L
A
P
S
A
-
V
S
G
M
I
F
----
A
S
A
I
F
F
L
S
Y
M
G
F
G
V
I
T
N
A
S
E
H
I
------
E
N
P
K
K
N
V
P
R
A
I
F
I
S
I
L
I
V
M
F
V
Y
V
G
V
A
I
--
S
A
I
G
N
L
P
I
D
E
L
I
K
A
S
E
N
A
L
A
V
A
A
K
P
F
-
L
G
N
L
G
F
L
-
L
I
S
I
G
A
L
F
S
I
S
S
A
M
N
A
T
I
Y
G
G
A
N
V
A
Y
S
L
A
K
D
G
E
L
P
--
E
F
F
E
R
K
V
W
F
K
S
T
E
G
L
Y
I
T
S
A
L
G
V
L
F
A
L
L
F
--------
N
M
E
G
V
A
S
I
T
S
A
V
F
M
V
I
Y
L
F
V
I
L
S
H
Y
I
---
L
I
D
E
V
G
G
R
K
E
I
V
I
F
S
F
I
V
V
L
G
V
F
L
L
L
L
Y
Y
Q
W
I
T
N
R
F
V
------
F
Y
G
I
I
A
T
F
I
G
V
L
I
F
E
I
I
Y
R
K
V
T
K
R
T
F
S
N
N
M
Y
V
K
S
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
HHSearch
49.81
13%
-65
- C3 -
3G40
-
?
A:
[492-698]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
W
K
A
N
L
L
V
P
V
E
D
----
P
R
E
L
M
G
T
F
D
F
L
R
D
I
T
Y
P
K
G
-
S
V
K
L
L
G
L
A
----
D
K
E
-----------------------
N
--
L
L
S
Q
L
---
P
S
I
S
E
---
G
---
F
Q
---
E
E
G
V
-
F
S
S
W
T
I
I
-----
E
E
N
L
V
V
-
G
M
E
A
L
T
G
S
F
F
R
P
S
I
L
F
L
R
L
P
E
N
R
D
R
D
------
E
E
I
R
E
I
I
R
K
A
S
M
Y
R
M
G
V
L
L
F
S
K
H
P
Q
A
G
----
L
G
R
Q
N
L
I
N
L
W
--------
I
E
N
RWDISMEL
G
N
M
D
L
A
L
L
I
A
Y
K
L
K
S
N
W
---
K
A
S
L
S
F
M
T
F
A
P
T
A
I
Q
A
Q
A
A
E
N
F
L
Q
S
L
A
E
L
A
R
I
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
49.41
24%
-33
- C2 -
3GIA
4
Y609_METJA
A:
[174-361]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
H
P
S
Y
V
I
P
D
L
A
P
S
A
V
S
G
M
I
F
A
S
A
I
F
F
L
S
Y
M
G
F
G
V
I
T
N
A
S
E
H
I
E
N
P
K
K
N
V
P
R
A
I
F
I
S
I
L
I
V
M
F
V
Y
V
G
V
A
I
S
A
I
G
N
L
P
I
D
E
L
I
K
A
S
E
N
A
L
A
V
A
A
K
P
F
L
G
-
N
L
G
F
---
L
L
I
S
I
G
A
L
F
S
I
S
S
A
M
N
A
T
I
Y
G
G
A
N
V
A
Y
S
L
A
K
D
G
E
L
P
---
E
F
F
E
R
K
V
W
F
K
S
T
E
G
L
Y
I
T
S
A
L
G
V
L
F
A
L
L
-------
F
N
M
E
G
V
A
S
I
T
S
A
V
F
M
V
I
Y
L
F
V
I
L
S
H
Y
I
L
I
D
E
V
G
G
R
K
E
I
V
I
F
S
F
I
V
V
L
G
V
F
L
L
L
L
Y
Y
Q
W
I
T
N
R
---
F
V
------
F
Y
G
I
I
A
T
F
I
G
V
L
I
F
E
I
I
Y
R
K
V
T
K
R
T
F
S
N
N
M
Y
V
K
S
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
49.03
24%
-29
- C2 -
3GI9
-
Y609_METJA
C:
[174-361]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
H
P
S
Y
V
I
P
D
L
A
P
S
A
V
S
G
M
I
F
A
S
A
I
F
F
L
S
Y
M
G
F
G
V
I
T
N
A
S
E
H
I
E
N
P
K
K
N
V
P
R
A
I
F
I
S
I
L
I
V
M
F
V
Y
V
G
V
A
I
S
A
I
G
N
L
P
I
D
E
L
I
K
A
S
E
N
A
L
A
V
A
A
K
P
F
L
G
-
N
L
G
F
---
L
L
I
S
I
G
A
L
F
S
I
S
S
A
M
N
A
T
I
Y
G
G
A
N
V
A
Y
S
L
A
K
D
G
E
L
P
---
E
F
F
E
R
K
V
W
F
K
S
T
E
G
L
Y
I
T
S
A
L
G
V
L
F
A
L
L
-------
F
N
M
E
G
V
A
S
I
T
S
A
V
F
M
V
I
Y
L
F
V
I
L
S
H
Y
I
L
I
D
E
V
G
G
R
K
E
I
V
I
F
S
F
I
V
V
L
G
V
F
L
L
L
L
Y
Y
Q
W
I
T
N
R
---
F
V
------
F
Y
G
I
I
A
T
F
I
G
V
L
I
F
E
I
I
Y
R
K
V
T
K
R
T
F
S
N
N
M
Y
V
K
S
L
E
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
47.93
24%
-28
- C2 -
3GI8
-
Y609_METJA
C:
[174-361]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
H
P
S
Y
V
I
P
D
L
APSA
V
S
G
M
I
F
A
S
A
I
F
F
L
S
Y
M
G
F
G
V
I
T
N
A
S
E
H
I
E
N
P
K
K
N
V
P
R
A
I
F
I
S
I
L
I
V
M
F
V
Y
V
G
V
A
I
SA
I
G
N
L
P
I
D
E
L
I
K
A
S
E
N
A
L
A
V
A
A
K
P
F
L
G
-
N
L
G
F
---
L
L
I
S
I
G
A
L
F
S
I
S
S
A
M
N
A
T
I
Y
G
G
A
N
V
A
Y
S
L
A
K
D
G
E
L
P
---
E
F
F
E
R
K
V
W
F
K
S
T
E
G
L
Y
I
T
S
A
L
G
V
L
F
A
L
L
-------
F
N
M
E
G
V
A
S
I
T
S
A
V
F
M
V
I
Y
L
F
V
I
L
S
H
Y
I
L
I
D
E
V
G
G
R
K
E
I
V
I
F
S
F
I
V
V
L
G
V
F
L
L
L
L
Y
Y
Q
W
I
T
N
R
---
F
V
------
F
Y
G
I
I
A
T
F
I
G
V
L
I
F
E
I
I
Y
R
K
V
T
K
R
T
F
S
N
N
M
Y
V
K
S
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
Fugue
46.05
12%
-38
- C3 -
3G40
-
?
A:
[492-760]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
W
K
A
N
L
L
V
P
V
----
E
D
P
R
E
L
M
G
T
F
D
F
L
R
D
I
T
Y
P
K
G
-
S
V
K
L
L
G
L
A
D
K
---------------------------
E
N
--
L
L
S
Q
L
---
P
S
I
S
E
---
G
---
F
Q
---
E
E
G
V
-
F
S
S
W
T
I
I
-----
E
E
N
L
V
V
-
G
M
E
A
L
T
G
S
F
F
R
P
S
I
L
F
L
R
L
P
------
E
N
R
D
R
D
E
E
I
R
E
I
I
R
K
A
S
M
Y
R
M
G
V
L
L
F
S
K
----
H
P
Q
A
G
L
G
R
Q
N
L
I
N
L
W
I
E
NRWDIS
M
E
L
--------
G
N
M
D
L
A
L
L
I
A
Y
K
L
K
S
N
W
---
K
A
S
L
S
F
M
T
F
A
P
T
A
I
Q
A
Q
A
A
E
N
F
L
Q
S
L
A
E
L
A
R
I
P
N
V
K
M
Q
V
L
R
E
N
P
I
K
S
S
K
L
P
F
A
S
L
H
I
F
S
L
D
P
N
P
D
L
D
L
A
R
H
L
M
E
K
A
G
S
S
C
I
F
A
L
D
S
G
E
E
N
A
L
A
--
L
L
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
HHSearch
43.61
17%
-9
* C3 *
3FG9
2
?
A:
[17-130]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
I
L
L
T
V
D
E
D
D
--
N
T
S
S
E
R
A
F
R
Y
A
T
T
L
A
H
D
Y
D
V
P
L
G
I
C
S
V
L
E
S
E
D
I
N
I
-------------
F
DSL
T
P
S
K
I
Q
A
K
-
R
K
H
V
E
D
V
V
A
E
Y
V
Q
---
L
---
A
E
---
Q
R
G
V
N
Q
V
E
P
L
V
Y
E
G
G
D
V
D
D
V
I
L
E
Q
V
I
P
E
F
-----
K
P
D
L
L
V
T
G
A
D
T
E
F
P
H
S
K
I
A
G
A
I
G
P
R
L
A
R
K
A
P
I
S
V
I
V
V
R
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
HHSearch
41.22
16%
8
- C3 -
1Q77
-
Y178_AQUAE
A:
[6-120]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
L
V
L
T
D
A
Y
----
S
D
C
E
K
A
I
T
Y
A
V
N
F
S
E
K
L
G
A
E
L
D
I
L
A
V
L
E
D
V
Y
N
L
E
R
A
N
V
T
FG
L
P
F
P
PE
I
--------
K
E
E
S
K
K
R
I
E
---
R
R
L
R
E
---
V
---
W
E
K
L
T
G
S
T
E
-
I
P
G
V
E
Y
R
-
I
G
P
L
S
E
E
V
K
K
-
F
V
E
G
K
-----
G
Y
E
L
V
V
W
A
C
Y
P
S
A
Y
L
C
K
V
I
D
G
L
N
L
A
S
L
I
V
K
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
HHSearch
38.10
11%
-12
- C3 -
3FDX
3
?
A:
[3-117]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
I
L
V
P
I
D
I
S
D
K
--
E
F
T
E
R
I
I
S
H
V
E
S
E
A
R
I
D
D
A
E
V
H
F
L
T
V
I
P
S
-------------------G
M
------
D
E
L
-
R
E
G
S
E
---
T
Q
L
K
E
---
I
A
K
K
F
S
---
I
P
E
D
-
R
M
H
F
H
V
A
E
-
G
S
P
K
D
K
I
L
A
-
L
A
K
S
L
-----
P
A
D
L
V
I
I
A
S
H
R
P
D
I
T
T
Y
L
L
G
S
N
A
A
A
V
V
R
H
A
E
C
S
V
L
V
V
R
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
HHSearch
37.64
9%
-24
- C3 -
3MT0
-
?
A:
[9-101]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
I
L
V
V
I
E
P
D
----
Q
L
E
G
L
A
L
K
R
A
Q
L
I
A
G
V
T
Q
S
H
L
H
L
L
V
C
E
K
R
R
D
-----------------------------
H
S
A
A
L
---
N
D
L
A
Q
---
E
---
L
R
---
E
E
G
Y
-
S
V
S
T
N
Q
A
W
K
D
S
L
H
Q
T
I
I
A
-
E
Q
Q
A
E
-----
G
C
G
L
I
I
K
Q
H
F
P
D
N
P
L
K
K
A
I
L
T
P
D
D
W
K
L
L
R
F
A
P
C
P
V
L
M
T
K
T
A
R
P
W
T
G
G
K
I
L
A
A
V
D
V
G
N
N
D
G
E
H
R
--------
S
L
H
--------
A
G
I
I
S
H
A
Y
D
I
A
G
L
A
K
A
T
L
H
V
I
S
A
H
P
T
F
Q
L
S
E
T
I
E
A
R
Y
R
E
A
C
R
T
F
Q
A
E
Y
G
F
S
D
E
Q
L
H
I
E
E
G
P
A
D
V
L
I
P
R
T
A
Q
K
L
D
A
V
---
V
T
V
I
G
T
V
A
R
T
G
L
S
G
A
L
I
G
N
T
A
E
V
V
L
D
T
L
E
S
D
V
L
V
--
L
K
P
D
D
I
I
A
H
L
E
E
L
A
S
K
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------
14
HHSearch
33.80
11%
46
- C3 -
1TQ8
-
Y1636_MYCTU
A:
[19-131]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
T
V
V
V
G
T
D
G
S
----
D
S
S
M
R
A
V
D
R
A
A
Q
I
A
G
A
D
A
-
K
L
I
I
A
S
A
Y
L
P
-------------------------------
T
A
P
I
Y
---
E
I
L
H
D
A
K
E
R
---
A
H
---
N
A
G
A
-
K
N
V
E
E
R
P
I
V
G
A
P
V
D
A
L
V
N
-
L
A
D
E
E
-----
K
A
D
L
L
V
V
G
N
V
G
L
S
T
I
A
G
R
L
L
G
S
V
P
A
N
V
S
R
R
A
K
V
D
V
L
I
V
H
T
T
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
Fugue
32.52
22%
153
- C1 -
1DWN
-
?
A:
[1-127]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
K
T
I
V
L
S
V
G
E
A
T
R
T
L
T
E
I
Q
S
T
A
D
R
Q
I
F
E
E
K
V
G
P
L
V
G
R
L
R
L
T
A
S
L
R
Q
N
G
---
A
K
T
A
Y
R
V
N
L
K
L
D
Q
A
D
V
V
D
C
S
T
S
V
--------
C
G
E
L
P
K
V
R
Y
T
Q
V
W
S
H
D
V
T
I
V
A
N
S
T
E
A
S
R
K
S
L
Y
D
L
T
K
S
L
V
A
T
S
Q
V
E
D
L
V
V
N
L
V
P
L
G
R
-----------------------------------------------------------------
27
Fugue
30.88
11%
171
- C2 -
4AJ5
-
SKA2_HUMAN
K:
[1-113]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
E
A
E
V
D
K
L
E
L
M
F
Q
K
A
E
S
D
L
D
Y
I
Q
Y
R
L
E
Y
E
I
K
T
N
H
E
K
N
P
V
T
---
L
L
K
E
L
S
V
I
K
S
R
Y
Q
T
L
Y
A
R
F
K
P
V
A
V
E
Q
K
E
S
K
S
R
I
C
--
A
T
V
K
K
T
M
N
M
I
Q
K
L
Q
K
Q
T
D
L
E
L
S
P
L
T
K
E
E
K
T
A
A
E
Q
--------------------------------------------------------------------------------------------------------------------------------------------
21
Fugue
30.46
9%
142
- C2 -
1XQ8
-
SYUA_HUMAN
A:
[1-140]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
D
V
F
M
K
G
L
S
K
A
K
E
G
V
V
A
A
---
A
E
K
T
K
Q
G
V
A
E
A
A
G
K
T
K
E
G
V
L
Y
V
G
S
K
T
K
E
G
V
V
H
G
V
--
A
T
V
A
E
K
T
K
E
Q
V
T
N
V
G
G
A
V
V
T
G
V
T
A
V
A
Q
K
T
V
E
G
A
G
S
I
A
A
A
T
G
F
V
K
K
D
Q
L
G
K
N
E
E
G
A
P
Q
E
G
I
L
E
D
M
P
V
D
P
D
N
E
A
Y
E
M
P
S
E
E
G
Y
Q
D
Y
E
P
E
A
--------------------------------------------------------------------------------------
11
HHSearch
28.51
9%
-92
- C2 -
2JLN
-
?
A:
[21-179]
-----------------------------------------------------------------------------------------------------------------
R
Y
A
E
R
S
V
G
P
F
S
-
L
A
A
I
W
F
A
M
A
I
Q
V
A
I
F
I
A
A
G
Q
M
T
S
S
F
Q
-
V
W
Q
V
I
V
A
I
A
A
G
C
T
I
A
V
I
L
L
F
F
T
Q
S
A
A
I
----
R
W
G
I
N
F
T
V
A
A
R
M
P
F
G
I
R
G
-
S
L
I
P
I
T
L
K
A
L
L
S
L
F
W
F
G
F
Q
T
W
L
G
A
L
A
L
D
E
I
T
R
-
L
L
--
T
G
-------
F
----
T
N
L
P
L
W
I
V
I
F
G
A
I
Q
V
V
T
T
F
Y
-
G
I
T
F
I
R
W
M
N
V
F
A
S
P
V
L
L
A
M
G
-
V
Y
M
V
Y
L
M
L
D
G
A
D
V
S
L
G
E
V
M
S
M
G
G
-
E
N
P
G
M
P
F
S
T
A
I
M
I
F
V
G
G
W
I
A
V
V
V
S
I
H
D
I
V
K
E
C
K
-----
V
D
P
N
A
S
R
E
G
Q
T
K
A
D
A
R
Y
A
T
A
Q
W
L
G
M
V
P
A
S
I
I
F
G
F
I
G
A
A
S
M
V
L
V
G
E
W
N
P
V
I
A
I
T
E
V
V
G
G
V
S
I
P
M
A
I
L
F
-
Q
V
F
V
L
L
----
A
T
W
S
T
N
P
A
A
N
L
L
S
P
A
Y
T
L
C
S
T
F
P
R
V
F
T
F
K
T
G
V
I
V
S
A
V
V
G
L
L
M
M
P
W
Q
F
A
G
V
L
N
T
F
L
--
N
L
L
A
S
A
L
G
P
L
A
G
I
M
I
S
D
Y
F
L
V
R
R
R
R
I
-
S
L
H
D
L
Y
R
T
K
G
I
Y
T
Y
W
R
G
V
N
W
V
A
L
A
V
Y
A
V
A
L
A
V
S
F
L
T
P
D
L
M
F
V
T
G
L
I
A
A
L
L
L
H
I
P
A
M
R
W
V
A
K
T
F
P
L
F
S
E
A
E
S
R
N
E
-------
D
Y
L
R
P
I
G
P
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
25.99
28%
94
- C2 -
2DH6
-
TRPB_ECOLI
A:
[159-224]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
H
S
G
S
A
T
--
L
K
D
A
C
N
E
--
A
L
R
D
W
S
G
S
Y
E
T
A
H
Y
M
L
G
-
T
A
A
G
P
H
P
Y
P
T
I
V
R
E
F
--------
Q
R
M
I
G
E
E
T
K
A
Q
I
L
E
R
E
G
R
L
P
D
A
V
I
A
C
V
G
G
G
S
N
A
I
G
M
F
A
D
F
I
N
E
T
N
V
G
L
I
G
V
-------
E
P
G
V
G
P
Q
H
A
Y
L
N
S
T
G
R
A
D
Y
V
S
I
T
D
D
E
A
L
E
A
F
K
T
L
C
L
H
E
G
I
I
P
A
L
E
S
S
H
A
L
A
H
A
L
K
M
M
R
E
N
P
D
---
K
E
------
Q
L
L
V
V
N
L
S
G
R
G
D
K
D
I
F
T
V
H
D
I
L
K
A
R
G
E
I
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
25.74
28%
94
- C2 -
2DH5
1
TRPB_ECOLI
A:
[159-224]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
H
S
G
S
A
T
--
L
K
D
A
C
N
E
--
A
L
R
D
W
S
G
S
Y
E
T
A
H
Y
M
L
G
-
T
A
A
G
P
H
P
Y
P
T
I
V
R
E
F
--------
Q
R
M
I
G
E
E
T
K
A
Q
I
L
E
R
E
G
R
L
P
D
A
V
I
A
C
V
G
G
G
S
N
A
I
G
M
F
A
D
F
I
N
E
T
N
V
G
L
I
G
V
-------
E
P
G
G
H
G
I
E
T
G
E
H
G
A
P
L
K
H
G
R
V
G
I
Y
F
G
M
K
A
P
M
M
Q
T
E
Q
I
E
E
S
Y
S
I
S
A
G
L
D
F
P
S
V
G
P
Q
H
A
Y
L
N
S
T
---
G
R
------
A
D
Y
V
S
I
T
D
D
E
A
L
E
A
F
K
T
L
C
L
H
E
G
I
I
P
A
L
E
S
S
H
A
L
A
H
A
L
K
M
M
R
E
N
P
D
K
E
Q
L
L
V
V
N
L
S
G
R
G
D
K
D
I
F
T
V
H
D
I
L
K
A
R
G
E
I
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
Fugue
21.50
15%
251
- C2 -
1NYH
-
SIR4_YEAST
A:
[1271-1346]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
S
F
V
D
I
V
L
S
K
A
A
S
A
L
D
E
K
E
K
Q
---
L
A
V
A
N
E
I
I
R
S
L
S
D
E
V
M
R
N
E
I
R
I
T
S
L
Q
G
D
L
T
--
F
T
--
K
K
C
L
E
N
A
R
S
Q
I
S
E
K
D
A
K
I
N
K
L
M
E
-------------------------------------------------------------------------------------------------------------------------------------------------------