@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 : SA2051: (2016-03-31 )
MKSLILAEKPSVARDIADALQINQKRNGYFENNQYIVTWALGHLVTNATPEQYDKNLKEWRLEDLPIIPKYMKTVVIGKTSKQFKTVKALILDNKVKDIIIATDAGREGELVARLILDKVGNKKPIRRLWISSVTKKAIQQGFKNLKDGRQYNDLYYAALARSEADWIVGINATRALTTKYDAQLSLGRVQTPTIQLVNTRQQEINQFKPQQYFTLSLTVKGFDFQLESNQRYTNKETLEQMVNNLKNVDGKIKSVATKHKKSYPQSLYNLTDLQQDMYRRYKIGPKETLNTLQSLYERHKVVTYPRTDSNYLTTDMVDTMKERIQATMATTYKDQARPLMSKTFSSKMSIFNNQKVSDHHAIIPTEVRPVMSDLSNRELKLYDMIVERFLEALMPPHEYDAITVTLEVAGHTFVLKENVTTVLGFKSIRQGESITEMQQPFSEGDEVKISKTNIREHETTPPEYFNEGSLLKAMENPQNFIQLKDKKYAQTLKQTGGIGTVATRADIIDKLFNMNAIESRDGKIKVTSKGKQILELAPEELTSPLLTAQWEEKLLLIERGKYQAKTFINEMKDFTKDVVNGIKNSDRKYKHDNLTTTECPTCGKFMIKVKTKNGQMLVCQDPSCKTKKNVQRKTNARCPNCKKKLTLFGKGKEAVYRCVCGHSETQAHMDQRMKSKSSGKVSRKEMKKYMNKNEGLDNNPFKDALKNLNL
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
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
-------------MKSLILAEK
P
S
V
A
R
D
I
A
D
A
L
--------
Q
IN-QKRNGYFE-N
N
-
Q
Y
I
V
T
W
A
L
G
H
L
VTNA
T
----
P
E
Q
Y
D
K
N
L
K
----
E
WR-LEDLPI
I
P
K
Y
M
K
T
V
VIGKTS
K
Q
F
K
T
V
K
A
L
I
LDNKV
K
D
---
I
I
I
ATDAGR
E
G
E
L
V
A
R
L
I
L
D
KVG----N----K-
K
P
---
I
R
R
L
W
I
S
S
V
T
K
K
A
I
Q
Q
G
F
K
N
L
K--DGRQY
N
D
L
Y
Y
A
A
L
ARSEA
D
W
I
V
GINA
T
R
A
L
T
-----
T
KYD-----
A
Q
---------
L
SLGRVQT
P
T
I
Q
L
V
N
T
R
Q
Q
E
I
N
QFKP
Q
Q
Y
F
T
L
---
S
L
T
-
V
---------------
K
--
G
----
F
D
F
Q
LE-S------------NQ------RYT
N
K
E
T
L
E
Q
M
V
N
N
L
K
NVD
G
K
I
K
S
V
A
T
K
H
K
KSY
P
Q
S
L
Y
N
L
T
D
L
Q
Q
D
M
Y
R
RYKIG
P
K
E
T
L
N
T
L
Q
S
L
Y
E
-------R-------H
K
V
-------
V
TYPRTDSNYL
T
T
D
M
V
D
T
M
K
E
R
I
Q
A
T
M
A
T--T
Y
K
D
QA
R
P
L
M
S
K
T
F
------
S
S
K
M
S
I
FNNQKVSD-HHAII
P
T
E
V
----
R
P
V
M
---
S
----D----LSNR
E
L
---
K
L
Y
D
M
I
V
E
R
F
L
E
ALMPPHEY
D
A
I
T
V
T
L
E
VA
G
H
T
F
V
L
KEN
V
T
--
T
V
L
--
G
F
----
K
S
I-----RQGE
S
-----
I
-
T
E
M
Q
QP-FSEG
D
E
V
K
I
S
KTNIREHETT
P
P
E
YFNE
G
S
L
L
K
A
MEN
P
Q
N
F
I
Q
L
K
D
K
K
Y
A
Q
T
L
K
QTGGIG
T
V
A
T
R
A
D
I
I
D
K
L
F-NMNAIESRD
G
K
I
K
V
TSKG
K
Q
I
---
L
EL
A
P
---
E
---
E
LTSP
L
---
L
T
A
Q
WE
E
K
L
L
L
I
ERGK
Y
Q
A
K
T
F
I
N
E
-
M
K
D
F
T
K
D
V
V
N
GIKNSDRKYKHDNLTTTECPTC
G
K
F
M
I
K
V
KTKNG
Q
M
L
V
CQDPSCK
T
K
K
N
V
Q
R
KTNARCPNC
K
K
K
L
T
L
F
GK
G
K
E
A
V
Y
R
CVCGH
S
E
T
Q
A
H
M
D
Q
R
M
KSKSSGKV
S
R
K
E
M
K
K
Y
M
NKNEGLDNN
P
F
K
D
A
L
K
NLNL
21
HHSearch
91.10
29%
-66
- C3 -
1I7D
3
TOP3_ECOLI
A:
[1-620]
--------------
M
R
L
F
I
A
E
K
P
S
L
A
R
A
I
A
D
V
L
--------
P
K
P
H
R
K
G
D
G
F
I
E
-
C
G
N
G
Q
V
V
T
W
C
I
G
H
L
L
E
Q
A
Q
----
P
D
A
Y
D
S
R
Y
A
----
R
W
N
-
L
A
D
L
P
I
V
P
E
K
W
Q
L
Q
P
R
P
S
V
T
K
Q
L
N
V
I
K
R
F
L
H
--
E
A
S
E
---
I
V
H
A
G
D
P
D
R
E
G
Q
L
L
V
D
E
V
L
D
Y
L
Q
----
L
A
P
E
K
R
-
Q
Q
---
V
Q
R
C
L
I
N
D
L
N
P
Q
A
V
E
R
A
I
D
R
L
R
--
S
N
S
E
F
V
P
L
C
V
S
A
L
A
R
A
R
A
D
W
L
Y
G
I
N
M
T
R
A
Y
T
-----
I
L
G
R
N
A
GYQ
G
V
---------
L
S
V
G
R
V
Q
T
P
V
L
G
L
V
V
R
R
D
E
E
I
E
N
F
V
A
K
D
F
F
E
V
---
K
A
H
I
V
---------------
T
PA
D
----
E
R
F
T
A
I
-
W
Q
P
S
EACEPYQDE
E
G
------
R
L
L
H
R
P
L
A
E
H
V
V
N
R
I
S
G
Q
P
A
I
V
T
S
Y
N
D
K
R
E
S
E
S
A
P
L
P
F
S
L
S
A
L
Q
I
E
A
A
K
R
F
G
L
S
A
Q
N
V
L
D
I
C
Q
K
L
Y
E
-------
T
-------
H
K
L
-------
I
T
F
P
R
S
D
C
R
Y
L
P
E
E
H
F
A
G
R
H
A
V
M
N
A
I
S
V
H
AP
D
L
L
P
--
Q
P
V
V
--
D
P
------
D
I
R
N
R
C
W
D
D
K
K
V
D
A
-
H
H
A
I
I
P
T
A
R
----
S
S
A
----
I
----
N
----
L
T
E
N
E
A
---
K
V
Y
N
L
I
A
R
Q
Y
L
M
Q
F
C
P
D
A
V
F
R
K
C
V
I
E
L
D
I
A
K
G
K
F
V
A
K
A
R
F
L
--
A
E
A
--
G
W
----
R
T
L
-----
L
G
S
K
E
RDEEN
D
-
G
T
P
L
P
V
-
V
A
K
G
D
E
L
L
C
E
K
G
E
V
V
E
R
Q
T
Q
P
P
R
H
F
T
D
A
T
L
L
S
A
M
T
G
I
A
R
F
V
Q
D
--
K
D
L
K
K
I
L
R
A
T
D
G
L
G
T
E
A
T
R
A
G
I
I
E
L
L
F
-
K
R
G
F
L
T
K
K
G
R
Y
I
H
S
T
D
A
G
K
A
L
---
F
H
S
L
P
---
E
---
M
A
T
R
P
D
---
M
T
A
H
W
E
S
V
L
T
Q
I
S
E
K
Q
C
R
Y
Q
D
F
M
Q
P
-
L
V
G
T
L
Y
Q
L
I
D
Q
A
K
R
T
P
----
V
R
Q
F
R
G
I
V
A
P
--------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
90.59
29%
-69
- C3 -
2O5C
3
TOP3_ECOLI
A:
[3-620]
----------------
L
F
I
A
E
K
P
S
L
A
R
A
I
A
D
V
L
P-------
K
P
H
-
R
K
G
D
G
F
I
E
C
G
N
-
G
Q
V
V
T
W
C
I
G
H
L
L
E
Q
A
Q
----
P
D
A
Y
D
S
R
Y
A
----
R
W
N
-
L
A
D
L
P
I
V
P
E
K
W
Q
L
Q
P
R
P
S
V
T
K
Q
L
N
V
I
K
R
F
L
--
H
E
A
S
E
---
I
V
H
A
G
D
P
D
R
E
G
Q
L
L
V
D
E
V
L
D
Y
L
Q
LA
P
E
K
----
R
-
Q
Q
---
V
Q
R
C
L
I
N
D
L
N
P
Q
A
V
E
R
A
I
D
R
L
R
--
S
N
S
E
F
V
P
L
C
V
S
A
L
A
R
A
R
A
D
W
L
Y
G
I
N
M
T
R
A
Y
T
I
L
G
R
N
A
G
Y
Q
-----
G
V
---------
L
S
V
G
R
V
Q
T
P
V
L
G
L
V
V
R
R
D
E
E
I
E
N
F
V
A
K
D
F
F
E
V
---
K
A
H
-
I
V
T
PAD
E
R
F
T
A
I
W
Q
P
S
E
--
A
----
C
E
P
Y
Q
D
-
E
------------
E
G
------
R
L
L
H
R
P
L
A
E
H
V
V
N
R
I
S
G
Q
P
A
I
V
T
S
Y
N
D
K
R
E
S
E
S
A
P
L
P
F
S
L
S
A
L
Q
I
E
A
A
K
R
F
G
L
S
A
Q
N
V
L
D
I
C
Q
K
L
Y
E
-------
T
-------
H
K
L
-------
I
T
Y
P
R
S
D
C
R
Y
L
P
E
E
H
F
A
G
R
H
A
V
M
N
A
I
S
V
H
--
A
P
D
L
L
P
Q
P
V
V
D
P
D
I
------
R
N
R
--
C
W
D
D
K
K
V
D
A
-
H
H
A
I
I
P
T
-
A
----
R
S
S
A
---
I
----
N
----
L
T
E
N
E
A
---
K
V
Y
N
L
I
A
R
Q
Y
L
M
Q
F
C
P
D
A
V
F
R
K
C
V
I
E
L
D
I
A
K
G
K
F
V
A
K
A
R
F
L
--
A
E
A
--
G
W
----
R
T
L
LGSKE
R
D
E
E
N
-----
D
-
G
T
P
L
P
V
-
V
A
K
G
D
E
L
L
C
E
K
G
E
V
V
E
R
Q
T
Q
P
P
R
H
F
T
D
A
T
L
L
S
A
M
T
G
I
A
R
F
V
Q
D
K
D
L
K
--
K
I
L
R
A
T
D
G
L
G
T
E
A
T
R
A
G
I
I
E
L
L
F
-
K
R
G
F
L
T
K
K
G
R
Y
I
H
S
T
D
A
G
K
A
L
---
F
H
S
L
P
---
E
---
M
A
T
R
P
D
---
M
T
A
H
W
E
S
V
L
T
Q
I
S
E
K
Q
C
R
Y
Q
D
F
M
Q
P
-
L
-------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
90.26
29%
-68
- C3 -
1D6M
-
TOP3_ECOLI
A:
[3-595]
----------------
L
F
I
A
E
K
P
S
L
A
R
A
I
A
D
V
L
P-------
K
P
H
-
R
K
G
D
G
F
I
E
C
G
N
-
G
Q
V
V
T
W
C
I
G
H
L
L
E
Q
A
Q
----
P
D
A
Y
D
S
R
Y
A
----
R
W
N
-
L
A
D
L
P
I
V
P
E
K
W
Q
L
Q
P
R
P
S
V
T
K
Q
L
N
V
I
K
R
F
L
--
H
E
A
S
E
---
I
V
H
A
G
D
P
D
R
E
G
Q
L
L
V
D
E
V
L
D
Y
L
Q
LA
P
E
K
----
R
-
Q
Q
---
V
Q
R
C
L
I
N
D
L
N
P
Q
A
V
E
R
A
I
D
R
L
R
--
S
N
S
E
F
V
P
L
C
V
S
A
L
A
R
A
R
A
D
W
L
Y
G
I
N
M
T
R
A
Y
T
I
L
G-----------
G
V
---------
L
S
V
G
R
V
Q
T
P
V
L
G
L
V
V
R
R
D
E
E
I
E
N
F
V
A
K
D
F
F
E
V
---
K
A
H
-
I
V
T
PAD
E
R
F
T
A
I
W
Q
P
S
E
--
A
----
C
E
P
Y
Q
D
-
E
------------
E
G
------
R
L
L
H
R
P
L
A
E
H
V
V
N
R
I
S
G
Q
P
A
I
V
T
S
Y
N
D
K
R
E
S
E
S
A
P
L
P
F
S
L
S
A
L
Q
I
E
A
A
K
R
F
G
L
S
A
Q
N
V
L
D
I
C
Q
K
L
Y
E
-------
T
-------
H
K
L
-------
I
T
Y
P
R
S
D
C
R
Y
L
P
E
E
H
F
A
G
R
H
A
V
M
N
A
I
S
V
H
--
A
P
D
L
L
P
Q
P
V
V
D
P
D
I
------
R
N
R
--
C
W
D
D
K
K
V
D
A
-
H
H
A
I
I
P
T
-
A
----
R
S
S
A
---
I
----
N
----
L
T
E
N
E
A
---
K
V
Y
N
L
I
A
R
Q
Y
L
M
Q
F
C
P
D
A
V
F
R
K
C
V
I
E
L
D
I
A
K
G
K
F
V
A
K
A
R
F
L
--
A
E
A
--
G
W
----
R
T
L
LG
S
K
E
R
D
E
E
N
-----
D
-
G
T
P
L
P
V
-
V
A
K
G
D
E
L
L
C
E
K
G
E
V
V
E
R
Q
T
Q
P
P
R
H
F
T
D
A
T
L
L
S
A
M
T
G
I
A
R
F
V
Q
D
K
D
L
K
--
K
I
L
R
A
T
D
G
L
G
T
E
A
T
R
A
G
I
I
E
L
L
F
-
K
R
G
F
L
T
K
K
G
R
Y
I
H
S
T
D
A
G
K
A
L
---
F
H
S
L
P
---
E
---
M
A
T
R
P
D
---
M
T
A
H
W
E
S
V
L
T
Q
I
S
E
K
Q
C
R
Y
Q
D
F
M
Q
P
-
L
-------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
90.15
29%
-72
- C3 -
2O54
3
TOP3_ECOLI
A:
[3-623]
----------------
L
F
I
A
E
K
P
S
L
A
R
A
I
A
D
V
L
P-------
K
P
H
-
R
K
G
D
G
F
I
E
C
G
N
-
G
Q
V
V
T
W
C
I
G
H
L
L
E
Q
A
Q
----
P
D
A
Y
D
S
R
Y
A
----
R
W
N
-
L
A
D
L
P
I
V
P
E
K
W
Q
L
Q
P
R
P
S
V
T
K
Q
L
N
V
I
K
R
F
L
--
H
E
A
S
E
---
I
V
H
A
G
D
P
D
R
E
G
Q
L
L
V
D
E
V
L
D
Y
L
Q
LA
P
E
K
----
R
-
Q
Q
---
V
Q
R
C
L
I
N
D
L
N
P
Q
A
V
E
R
A
I
D
R
L
R
--
S
N
S
E
F
V
P
L
C
V
S
A
L
A
R
A
R
A
D
W
L
Y
G
I
N
M
T
R
A
Y
T
I
L
G
R
N
A
G
Y
Q
-----
G
V
---------
L
S
V
G
R
V
Q
T
P
V
L
G
L
V
V
R
R
D
E
E
I
E
N
F
V
A
K
D
F
F
E
V
---
K
A
H
-
I
V
T
PAD
E
R
F
T
A
I
W
QPS
E
--
A
----
C
E
P
Y
Q
D
-
E
------------
E
G
------
R
L
L
H
R
P
L
A
E
H
V
V
N
R
I
S
G
Q
P
A
I
V
T
S
Y
N
D
K
R
E
S
E
S
A
P
L
P
F
S
L
S
A
L
Q
I
E
A
A
K
R
F
G
L
S
A
Q
N
V
L
D
I
C
Q
K
L
Y
E
-------
T
-------
H
K
L
-------
I
T
Y
P
R
S
D
C
R
Y
L
P
E
E
H
F
A
G
R
H
A
V
M
N
A
I
S
V
H
--
A
P
D
L
L
P
Q
P
V
V
D
P
D
I
------
R
N
R
--
C
W
D
D
K
K
V
D
A
-
H
H
A
I
I
P
T
-
A
----
R
S
S
A
---
I
----
N
----
L
T
E
N
E
A
---
K
V
Y
N
L
I
A
R
Q
Y
L
M
Q
F
C
P
D
A
V
F
R
K
C
V
I
E
L
D
I
A
K
G
K
F
V
A
K
A
R
F
L
--
A
E
A
--
G
W
----
R
T
L
LGSKE
R
D
E
E
N
-----
D
-
G
T
P
L
P
V
-
V
A
K
G
D
E
L
L
C
E
K
G
E
V
V
E
R
Q
T
Q
P
P
R
H
F
T
D
A
T
L
L
S
A
M
T
G
I
A
R
F
V
Q
D
K
D
L
K
--
K
I
L
R
A
T
D
G
L
G
T
E
A
T
R
A
G
I
I
E
L
L
F
-
K
R
G
F
L
T
K
K
G
R
Y
I
H
S
T
D
A
G
K
A
L
---
F
H
S
L
P
---
E
---
M
A
T
R
P
D
---
M
T
A
H
W
E
S
V
L
T
Q
I
S
E
K
Q
C
R
Y
Q
D
F
M
Q
P
-
L
-------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
89.64
29%
-72
- C3 -
2O19
3
TOP3_ECOLI
A:
[3-623]
----------------
L
F
I
A
E
K
P
S
L
A
R
A
I
A
D
V
L
P-------
K
P
H
-
R
K
G
D
G
F
I
E
C
G
N
-
G
Q
V
V
T
W
C
I
G
H
L
L
E
Q
A
Q
----
P
D
A
Y
D
S
R
Y
A
----
R
W
N
-
L
A
D
L
P
I
V
P
E
K
W
Q
L
Q
P
R
P
S
V
T
K
Q
L
N
V
I
K
R
F
L
--
H
E
A
S
E
---
I
V
H
A
G
D
P
D
R
E
G
Q
L
L
V
D
E
V
L
D
Y
L
Q
LA
P
E
K
----
R
-
Q
Q
---
V
Q
R
C
L
I
N
D
L
N
P
Q
A
V
E
R
A
I
D
R
L
R
--
S
N
S
E
F
V
P
L
C
V
S
A
L
A
R
A
R
A
D
W
L
Y
G
I
N
M
T
R
A
Y
T
I
L
G
R
N
A
G
Y
Q
-----
G
V
---------
L
S
V
G
R
V
Q
T
P
V
L
G
L
V
V
R
R
D
E
E
I
E
N
F
V
A
K
D
F
F
E
V
---
K
A
H
-
I
V
T
PAD
E
R
F
T
A
I
W
Q
P
S
E
--
A
----
C
E
P
Y
Q
D
-
E
------------
E
G
------
R
L
L
H
R
P
L
A
E
H
V
V
N
R
I
S
G
Q
P
A
I
V
T
S
Y
N
D
K
R
E
S
E
S
A
P
L
P
F
S
L
S
A
L
Q
I
E
A
A
K
R
F
G
L
S
A
Q
N
V
L
D
I
C
Q
K
L
Y
E
-------
T
-------
H
K
L
-------
I
T
Y
P
R
S
D
C
R
Y
L
P
E
E
H
F
A
G
R
H
A
V
M
N
A
I
S
V
H
--
A
P
D
L
L
P
Q
P
V
V
D
P
D
I
------
R
N
R
--
C
W
D
D
K
K
V
D
A
-
H
H
A
I
I
P
T
-
A
----
R
S
S
A
---
I
----
N
----
L
T
E
N
E
A
---
K
V
Y
N
L
I
A
R
Q
Y
L
M
Q
F
C
P
D
A
V
F
R
K
C
V
I
E
L
D
I
A
K
G
K
F
V
A
K
A
R
F
L
--
A
E
A
--
G
W
----
R
T
L
LGSKE
R
D
E
E
N
-----
D
-
G
T
P
L
P
V
-
V
A
K
G
D
E
L
L
C
E
K
G
E
V
V
E
R
Q
T
Q
P
P
R
H
F
T
D
A
T
L
L
S
A
M
T
G
I
A
R
F
V
Q
D
K
D
L
K
--
K
I
L
R
A
T
D
G
L
G
T
E
A
T
R
A
G
I
I
E
L
L
F
-
K
R
G
F
L
T
K
K
G
R
Y
I
H
S
T
D
A
G
K
A
L
---
F
H
S
L
P
---
E
---
M
A
T
R
P
D
---
M
T
A
H
W
E
S
V
L
T
Q
I
S
E
K
Q
C
R
Y
Q
D
F
M
Q
P
-
L
-------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
89.40
29%
-74
- C3 -
2O59
2
TOP3_ECOLI
A:
[3-627]
----------------
L
F
I
A
E
K
P
S
L
A
R
A
I
A
D
V
L
P-------
K
P
H
-
R
K
G
D
G
F
I
E
C
G
N
-
G
Q
V
V
T
W
C
I
G
H
L
L
E
Q
A
Q
----
P
D
A
Y
D
S
R
Y
A
----
R
W
N
-
L
A
D
L
P
I
V
P
E
K
W
Q
L
Q
P
R
P
S
V
T
K
Q
L
N
V
I
K
R
F
L
--
H
E
A
S
E
---
I
V
H
A
G
D
P
D
R
E
G
Q
L
L
V
D
E
V
L
D
Y
L
Q
LA
P
E
K
----
R
-
Q
Q
---
V
Q
R
C
L
I
N
D
L
N
P
Q
A
V
E
R
A
I
D
R
L
R
--
S
N
S
E
F
V
P
L
C
V
S
A
L
A
R
A
R
A
D
W
L
Y
G
I
N
M
T
R
A
Y
T
I
L
G
R
N
A
G
Y
Q
-----
G
V
---------
L
S
V
G
R
V
Q
T
P
V
L
G
L
V
V
R
R
D
E
E
I
E
N
F
V
A
K
D
F
F
E
V
---
K
A
H
-
I
V
T
PAD
E
R
F
T
A
I
W
Q
P
S--------
C
E
P
Y
Q
D
-
E
------------
E
G
------
R
L
L
H
R
P
L
A
E
H
V
V
N
R
I
S
G
Q
P
A
I
V
T
S
Y
N
D
K
R
E
S
E
S
A
P
L
P
F
S
L
S
A
L
Q
I
E
A
A
K
R
F
G
L
S
A
Q
N
V
L
D
I
C
Q
K
L
Y
E
-------
T
-------
H
K
L
-------
I
T
Y
P
R
S
D
C
R
Y
L
P
E
E
H
F
A
G
R
H
A
V
M
N
A
I
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V
H
--
A
P
D
L
L
P
Q
P
V
V
D
P
D
I
------
R
N
R
--
C
W
D
D
K
K
V
D
A
-
H
H
A
I
I
P
T
-
A
----
R
S
S
A
---
I
----
N
----
L
T
E
N
E
A
---
K
V
Y
N
L
I
A
R
Q
Y
L
M
Q
F
C
P
D
A
V
F
R
K
C
V
I
E
L
D
I
A
K
G
K
F
V
A
K
A
R
F
L
--
A
E
A
--
G
W
----
R
T
L
LGSK-----
N
-----
D
-
G
T
P
L
P
V
-
V
A
K
G
D
E
L
L
C
E
K
G
E
V
V
E
R
Q
T
Q
P
P
R
H
F
T
D
A
T
L
L
S
A
M
T
G
I
A
R
F
V
Q
D
K
D
L
K
--
K
I
L
R
A
T
D
G
L
G
T
E
A
T
R
A
G
I
I
E
L
L
F
-
K
R
G
F
L
T
K
K
G
R
Y
I
H
S
T
D
A
G
K
A
L
---
F
H
S
L
P
---
E
---
M
A
T
R
P
D
---
M
T
A
H
W
E
S
V
L
T
Q
I
S
E
K
Q
C
R
Y
Q
D
F
M
Q
P
-
L
-------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
89.39
29%
-70
- C3 -
2O5E
3
TOP3_ECOLI
A:
[3-620]
----------------
L
F
I
A
E
K
P
S
L
A
R
A
I
A
D
V
L
P-------
K
P
H
-
R
K
G
D
G
F
I
E
C
G
N
-
G
Q
V
V
T
W
C
I
G
H
L
L
E
Q
A
Q
----
P
D
A
Y
D
S
R
Y
A
----
R
W
N
-
L
A
D
L
P
I
V
P
E
K
W
Q
L
Q
P
R
P
S
V
T
K
Q
L
N
V
I
K
R
F
L
--
H
E
A
S
E
---
I
V
H
A
G
D
P
D
R
E
G
Q
L
L
V
D
E
V
L
D
Y
L
Q
LA
P
E
K
----
R
-
Q
Q
---
V
Q
R
C
L
I
N
D
L
N
P
Q
A
V
E
R
A
I
D
R
L
R
--
S
N
S
E
F
V
P
L
C
V
S
A
L
A
R
A
R
A
D
W
L
Y
G
I
N
M
T
R
A
Y
T
I
L
G
R
N
A
G
Y
Q
-----
G
V
---------
L
S
V
G
R
V
Q
T
P
V
L
G
L
V
V
R
R
D
E
E
I
E
N
F
V
A
K
D
F
F
E
V
---
K
A
H
-
I
VTPAD
E
R
F
T
A
I
W
Q
PS
E
--
A
----
C
E
P
Y
Q
D
-
E
------------
E
G
------
R
L
L
H
R
P
L
A
E
H
V
V
N
R
I
S
G
Q
P
A
I
V
T
S
Y
N
D
K
R
E
S
E
S
A
P
L
P
F
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L
S
A
L
Q
I
E
A
A
K
R
F
G
L
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A
Q
N
V
L
D
I
C
Q
K
L
Y
E
-------
T
-------
H
K
L
-------
I
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Y
P
R
S
D
C
R
Y
L
P
E
E
H
F
A
G
R
H
A
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M
N
A
I
S
V
H
--
A
P
D
L
L
P
Q
P
V
V
D
P
D
I
------
R
N
R
--
C
W
D
D
K
K
V
D
A
-
H
H
A
I
I
P
T
-
A
----
R
S
S
A
---
I
----
N
----
L
T
E
N
E
A
---
K
V
Y
N
L
I
A
R
Q
Y
L
M
Q
F
C
P
D
A
V
F
R
K
C
V
I
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L
D
I
A
K
G
K
F
V
A
K
A
R
F
L
--
A
E
A
--
G
W
----
R
T
L
LGSKE
R
D
E
E
N
-----
D
-
G
T
P
L
P
V
-
V
A
K
G
D
E
L
L
C
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K
G
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V
E
R
Q
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Q
P
P
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H
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D
A
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L
L
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A
M
T
G
I
A
R
F
V
Q
D
K
D
L
K
--
K
I
L
R
A
T
D
G
L
G
T
E
A
T
R
A
G
I
I
E
L
L
F
-
K
R
G
F
L
T
K
K
G
R
Y
I
H
S
T
D
A
G
K
A
L
---
F
H
S
L
P
---
E
---
M
A
T
R
P
D
---
M
T
A
H
W
E
S
V
L
T
Q
I
S
E
K
Q
C
R
Y
Q
D
F
M
Q
P
-
L
-------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
89.10
29%
-69
- C3 -
1I7D
3
TOP3_ECOLI
A:
[3-595]
----------------
L
F
I
A
E
K
P
S
L
A
R
A
I
A
D
V
L
P-------
K
P
H
-
R
K
G
D
G
F
I
E
C
G
N
-
G
Q
V
V
T
W
C
I
G
H
L
L
E
Q
A
Q
----
P
D
A
Y
D
S
R
Y
A
----
R
W
N
-
L
A
D
L
P
I
V
P
E
K
W
Q
L
Q
P
R
P
S
V
T
K
Q
L
N
V
I
K
R
F
L
--
H
E
A
S
E
---
I
V
H
A
G
D
P
D
R
E
G
Q
L
L
V
D
E
V
L
D
Y
L
Q
LA
P
E
K
----
R
-
Q
Q
---
V
Q
R
C
L
I
N
D
L
N
P
Q
A
V
E
R
A
I
D
R
L
R
--
S
N
S
E
F
V
P
L
C
V
S
A
L
A
R
A
R
A
D
W
L
Y
G
I
N
M
T
R
A
Y
T
I
L
G
R
N
A
G
Y
Q
-----
G
V
---------
L
S
V
G
R
V
Q
T
P
V
L
G
L
V
V
R
R
D
E
E
I
E
N
F
V
A
K
D
F
F
E
V
---
K
A
H
-
I
V
T
PAD
E
R
F
T
A
I
W
Q
P
S
E
--
A
----
C
E
P
Y
Q
D
-
E
------------
E
G
------
R
L
L
H
R
P
L
A
E
H
V
V
N
R
I
S
G
Q
P
A
I
V
T
S
Y
N
D
K
R
E
S
E
S
A
P
L
P
F
S
L
S
A
L
Q
I
E
A
A
K
R
F
G
L
S
A
Q
N
V
L
D
I
C
Q
K
L
Y
E
-------
T
-------
H
K
L
-------
I
T
F
P
R
S
D
C
R
Y
L
P
E
E
H
F
A
G
R
H
A
V
M
N
A
I
S
V
H
--
A
P
D
L
L
P
Q
P
V
V
D
P
D
I
------
R
N
R
--
C
W
D
D
K
K
V
D
A
-
H
H
A
I
I
P
T
-
A
----
R
S
S
A
---
I
----
N
----
L
T
E
N
E
A
---
K
V
Y
N
L
I
A
R
Q
Y
L
M
Q
F
C
P
D
A
V
F
R
K
C
V
I
E
L
D
I
A
K
G
K
F
V
A
K
A
R
F
L
--
A
E
A
--
G
W
----
R
T
L
LGSKE
R
D
E
E
N
-----
D
-
G
T
P
L
P
V
-
V
A
K
G
D
E
L
L
C
E
K
G
E
V
V
E
R
Q
T
Q
P
P
R
H
F
T
D
A
T
L
L
S
A
M
T
G
I
A
R
F
V
Q
D
K
D
L
K
--
K
I
L
R
A
T
D
G
L
G
T
E
A
T
R
A
G
I
I
E
L
L
F
-
K
R
G
F
L
T
K
K
G
R
Y
I
H
S
T
D
A
G
K
A
L
---
F
H
S
L
P
---
E
---
M
A
T
R
P
D
---
M
T
A
H
W
E
S
V
L
T
Q
I
S
E
K
Q
C
R
Y
Q
D
F
M
Q
P
-
L
-------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
80.66
27%
-51
- C3 -
2GAI
-
TOP1_THEMA
A:
[7-588]
---------------
K
Y
I
V
V
E
S
P
A
K
A
K
T
I
K
S
I
L
---------------------
G
N
-
E
Y
E
V
F
A
S
M
G
H
I
I
-
D
L
P
----
K
S
K
F
G
V
D
L
E
----
K
-----
D
F
E
--
P
E
F
--
A
V
I
K
G
K
E
----
K
V
V
E
K
L
K
D
L
A
K
K
G
E
---
L
L
I
A
S
D
M
D
R
E
G
E
A
I
A
W
H
I
A
R
V
T
N
----
T
----
L
-
G
R
---
K
N
R
I
V
F
S
E
I
T
P
R
V
I
R
E
A
V
K
N
P
R
EI
D
M
K
K
V
R
----
A
Q
L
A
R
R
I
L
D
R
I
V
G
Y
S
L
S
P
V
L
W
-----
R
N
F
K
-----
S
N
---------
L
S
A
G
R
V
Q
S
A
T
L
K
L
V
C
D
R
E
R
E
I
L
R
F
V
P
K
K
Y
H
R
I
---
T
V
N
-
F
---------------
D
--
G
----
L
T
A
E
I
D
V
K
------------
E
K
------
K
F
F
D
A
E
T
L
K
E
-
I
Q
S
I
D
E
L
V
V
E
E
K
K
V
S
V
--
K
K
F
A
P
P
E
P
F
K
T
S
T
L
Q
Q
E
A
Y
S
K
L
G
F
S
V
S
K
T
M
M
I
A
Q
Q
L
Y
E
G
V
E
T
KD
G
H
-------
I
A
F
-------
I
T
Y
M
R
T
D
S
----
T
R
V
S
D
Y
A
K
E
--------------
E
A
R
N
L
I
T
E
V
F
GEEYVG--------------A
H
E
A
I
R
P
T
N
V
----
F
M
T
P
---
E
----
E
AGKY
L
N
S
D
Q
K
---
K
L
Y
E
L
I
W
K
R
F
L
A
S
Q
M
K
P
S
Q
Y
E
E
T
R
F
V
L
R
T
K
D
G
K
Y
R
F
K
G
T
V
L
--
K
K
I
FD
G
Y
----
E
K
V
-----
W
K
T
E
R
-----
N
-
T
-
G
E
F
P
-
F
E
E
G
E
S
V
K
P
V
V
V
K
I
E
E
Q
E
T
K
P
K
P
R
Y
T
E
G
S
L
V
K
E
M
E
R
L
-------------------
G
I
G
R
P
S
T
Y
A
S
T
I
K
L
L
L
-
N
R
G
Y
I
K
K
I
R
G
Y
L
Y
P
T
I
V
G
S
V
V
M
D
Y
L
E
K
K
Y
---
S
---
D
V
V
S
V
S
---
F
T
A
E
M
E
K
D
L
D
E
V
E
Q
G
K
K
T
D
K
I
V
L
R
E
----
F
Y
E
S
F
S
S
V
F
D
R
N
D
R
-
I
V
V
D
F
P
T
N
Q
K
C
-
S
C
G
K
E
M
R
L
S
F
G
K
Y
G
F
Y
L
K
C
E
C
G
K
T
R
S
V
K
N
---------------------------------------------------------------------------------
9
PsiBlast_PDB
80.52
27%
-54
- C3 -
2GAJ
-
TOP1_THEMA
A:
[7-588]
---------------
K
Y
I
V
V
E
S
P
A
K
A
K
T
I
K
S
I
L
---------------------
G
N
-
E
Y
E
V
F
A
S
M
G
H
I
I
-
D
L
P
----
K
S
K
F
G
V
D
L
E
----
K
-----
D
F
E
--
P
E
F
--
A
V
I
K
G
K
E
----
K
V
V
E
K
L
K
D
L
A
K
K
G
E
---
L
L
I
A
S
D
M
D
R
E
G
E
A
I
A
W
H
I
A
R
V
T
N
----
T
----
L
-
G
R
---
K
N
R
I
V
F
S
E
I
T
P
R
V
I
R
E
A
V
K
N
P
R
EI
D
M
K
K
V
R
----
A
Q
L
A
R
R
I
L
D
R
I
V
G
Y
S
L
S
P
V
L
W
-----
R
N
F
K
-----
S
N
---------
L
S
A
G
R
V
Q
S
A
T
L
K
L
V
C
D
R
E
R
E
I
L
R
F
V
P
K
K
Y
H
R
I
---
T
V
N
-
F
---------------
D
--
G
----
L
T
A
E
I
D
V
K
------------
E
K
------
K
F
F
D
A
E
T
L
K
E
-
I
Q
S
I
D
E
L
V
V
E
E
K
K
V
S
V
--
K
K
F
A
P
P
E
P
F
K
T
S
T
L
Q
Q
E
A
Y
S
K
L
G
F
S
V
S
K
T
M
M
I
A
Q
Q
L
Y
E
G
V
E
T
KD
G
H
-------
I
A
F
-------
I
T
Y
M
R
T
D
S
----
T
R
V
S
D
Y
A
K
E
--------------
E
A
R
N
L
I
T
E
V
F
GEEYVG--------------A
H
E
A
I
R
P
T
N
V
----
F
M
T
P
---
E
----
E
A
G
K
Y
L
N
S
D
Q
K
---
K
L
Y
E
L
I
W
K
R
F
L
A
S
Q
M
K
P
S
Q
Y
E
E
T
R
F
V
L
R
T
K
D
G
K
Y
R
F
K
G
T
V
L
--
K
K
I
FD
G
Y
----
E
K
V
-----
W
K
T
E
R
-----
N
-
T
-
G
E
F
P
-
F
E
E
G
E
S
V
K
P
V
V
V
K
I
E
E
Q
E
T
K
P
K
P
R
Y
T
E
G
S
L
V
K
E
M
E
R
L
-------------------
G
I
G
R
P
S
T
Y
A
S
T
I
K
L
L
L
-
N
R
G
Y
I
K
K
I
R
G
Y
L
Y
P
T
I
V
G
S
V
V
M
D
Y
L
E
K
K
Y
---
S
---
D
V
V
S
V
S
---
F
T
A
E
M
E
K
D
L
D
E
V
E
Q
G
K
K
T
D
K
I
V
L
R
E
----
F
Y
E
S
F
S
S
V
F
D
R
N
D
R
-
I
V
V
D
F
P
T
N
Q
K
C
-
S
C
G
K
E
M
R
L
S
F
G
K
Y
G
F
Y
L
K
C
E
C
G
K
T
R
S
V
K
N
---------------------------------------------------------------------------------
23
HHSearch
79.45
26%
-62
* C3 *
1MW9
9
TOP1_ECOLI
X:
[2-581]
-------------
G
K
A
L
V
I
V
E
S
P
A
K
A
K
T
I
N
K
Y
L
--------
G
S
--------------
D
Y
V
V
K
S
S
V
G
H
I
R
D
L
P
T
-------------ERGA
L
V
N
R
M
G
V
D
P
W
H
N
W
E
A
H
Y
E
V
L
P
G
K
E
K
V
V
S
E
L
K
Q
L
A
E
--
K
A
D
H
---
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
----
G
----
D
D
A
R
---
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
K
P
G
----
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
-----
K
K
I
A
-----
R
G
---------
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
---
D
A
S
T
T
---------------
T
PS
G
----
E
A
L
A
L
Q
-
V
THQNDK------
P
F
------
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
-------
A
--------
G
Y
-------
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
--
K
Y
L
P
---
E
------------
S
P
N
Q
Y
A
---------
R
E
A
I
R
P
S
D
V
----
N
V
M
A
ESL
K
----
D
----
M
E
A
D
A
Q
---
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
G
D
F
R
L
K
A
R
G
R
I
L
--
R
F
D
--
G
W
----
T
K
V
-----
M
P
A
L
-------E
D
R
I
L
P
A
-
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
-------------------
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
-
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
---
T
D
R
L
E
---
E
NFR
E
L
M
N
Y
D
---
F
T
A
Q
M
E
N
N
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
-
F
F
S
D
F
T
Q
Q
L
D
K
A
E
K
D
-----------------------------------------------------------------------------------------------------------------------------
22
HHSearch
79.28
28%
-54
- C3 -
2GAI
-
TOP1_THEMA
A:
[7-587]
---------------
K
Y
I
V
V
E
S
P
A
K
A
K
T
I
K
S
I
L
--------
G
N
--------------
E
Y
E
V
F
A
S
M
G
H
I
I
D
L
P
K
----
S
K
-
F
---------
G
V
D
---
L
E
K
D
F
E
--
P
E
F
A
V
I
K
G
K
E
K
V
V
E
K
L
K
D
L
A
K
---
K
G
E
---
L
L
I
A
S
D
M
D
R
E
G
E
A
I
A
W
H
I
A
R
V
T
N
----
T
----
L
-
G
R
---
K
N
R
I
V
F
S
E
I
T
P
R
V
I
R
E
A
V
K
N
P
R
---
E
I
D
M
-
K
K
V
R
A
Q
L
A
R
R
I
L
D
R
I
V
G
Y
S
L
S
P
V
L
W
-----
R
N
F
K
-----
S
N
---------
L
S
A
G
R
V
Q
S
A
T
L
K
L
V
C
D
R
E
R
E
I
L
R
F
V
P
K
K
Y
H
R
I
---
T
V
N
F
D
---------------
G
L
-
T
----
A
E
I
--
D
-
V
K-----------
E
K
------
K
F
F
D
A
E
T
L
K
E
I
Q
S
---
I
D
E
L
V
V
E
E
K
K
V
S
V
K
K
F
A
P
P
E
P
F
K
T
S
T
L
Q
Q
E
A
Y
S
K
L
G
F
S
V
S
K
T
M
M
I
A
Q
Q
L
Y
E
-------
G
V
E
T
KD
G
H
I
A
F
-------
I
T
Y
M
R
T
D
S
T
R
V
S
D
Y
A
K
E
E
A
R
N
L
I
T
E
V
F
G
E
--
E
Y
V
G
-----------------------------
A
-
H
E
A
I
R
P
T
N
V
----
F
M
T
P
---
E
EAGK
Y
----
L
N
S
D
Q
K
---
K
L
Y
E
L
I
W
K
R
F
L
A
S
Q
M
K
P
S
Q
Y
E
E
T
R
F
V
L
R
T
K
D
G
K
Y
R
F
K
G
T
V
L
K
K
I
F
D
--
G
Y
----
E
K
V
-----
W
K
T
E
R
-----
N
--
T
G
E
F
P
-
F
E
E
G
E
S
V
K
P
V
V
V
K
I
E
E
Q
E
T
K
P
K
P
R
Y
T
E
G
S
L
V
K
E
M
E
R
-------------------
L
G
I
G
R
P
S
T
Y
A
S
T
I
K
L
L
L
-
N
R
G
Y
I
K
K
I
R
G
Y
L
Y
P
T
I
V
G
S
V
V
---
M
D
Y
L
E
K
KY
S
---
D
V
V
S
V
S
---
F
T
A
E
M
E
K
D
L
D
E
V
E
Q
G
K
K
T
D
K
I
V
L
R
E
-
F
Y
E
S
F
S
S
V
F
D
R
N
D
R
I
----
V
V
D
F
P
T
N
Q
K
C
S
-
C
G
K
E
M
R
L
S
F
G
K
Y
G
F
Y
L
K
C
E
---
C
G
K
T
R
S
V
K
-------------------------------------------------------------------------------
46
Fugue
77.03
27%
-39
- C3 -
2GAI
-
TOP1_THEMA
A:
[7-601]
---------------
K
Y
I
V
V
E
S
P
A
K
A
K
T
I
K
S
I
L
---------------------
G
N
-
E
Y
E
V
F
A
S
M
G
H
I
-----------------
I
----
D
L
P
-
K
S
K
F
G
V
D
L
E
K
D
F
E
P
E
F
A
V
I
K
G
K
E
K
V
V
E
K
L
K
D
L
A
K
K
G
E
---
L
L
I
A
S
D
M
D
R
E
G
E
A
I
A
W
H
I
A
R
V
T
N
----
T
----
L
-
G
R
---
K
N
R
I
V
F
S
E
I
T
P
R
V
I
R
E
A
V
K
N
P
R
--
E
I
D
--
M
K
K
V
R
A
Q
L
A
R
R
I
L
D
R
I
V
G
Y
S
L
S
P
V
L
W
-----
R
N
F
K
-----
S
N
---------
L
S
A
G
R
V
Q
S
A
T
L
K
L
V
C
D
R
E
R
E
I
L
R
F
V
P
K
K
Y
H
R
I
---
T
V
N
-
F
---------------
D
--
G
----
L
T
A
E
I
D
-
V
------------
K
E
--------
K
K
F
F
D
A
E
T
L
K
E
I
Q
S
I
D
E
L
V
V
E
E
K
K
V
S
V
K
K
F
A
P
P
E
P
F
K
T
S
T
L
Q
Q
E
A
Y
S
K
L
G
F
S
V
S
K
T
M
M
I
A
Q
Q
L
Y
E
-------
G
-------
V
E
T
KD
G
H
I
A
F
I
T
Y
M
R
T
D
S
T
R
V
S
D
Y
A
K
E
E
A
R
N
L
I
T
E
V
-------------------------------
F
G
E
E
Y
V
G
A
-
H
E
A
I
R
P
T
N
V
FMTP
E
E
A
G
---
K
----
Y
----
L
N
S
D
Q
K
---
K
L
Y
E
L
I
W
K
R
F
L
A
S
Q
M
K
P
S
Q
Y
E
E
T
R
F
V
L
R
T
K
D
G
K
Y
R
F
K
G
T
V
L
--
K
K
I
FD
G
Y
----
E
K
V
-----
W
K
-
T
E
-----
R
-
N
T
G
E
F
P
-
F
E
E
G
E
S
V
K
P
V
V
V
K
I
E
E
Q
E
T
K
P
K
P
R
Y
T
E
G
S
L
V
K
E
M
E
R
L
-------------------
G
I
G
R
P
S
T
Y
A
S
T
I
K
L
L
L
-
N
R
G
Y
I
K
K
I
R
G
Y
L
Y
P
T
I
V
G
S
V
V
---
M
D
Y
L
E
---
K
---
K
Y
S
D
V
V
S
V
S
F
T
A
E
M
E
K
D
L
D
E
V
E
Q
G
K
---
K
T
D
K
I
V
-
L
R
E
F
Y
E
S
F
S
S
V
F
D
R
N
D
R
I
V
V
--
D
F
P
T
N
Q
K
C
S
C
G
K
E
M
R
L
S
F
G
K
Y
G
F
Y
L
K
C
E
---
C
G
K
T
R
S
V
K
N
D
E
I
A
V
I
D
D
--
G
K
I
F
L
---------------------------------------------------------------
51
Fugue
75.52
23%
-23
- C3 -
4CGY
1
TOP3A_HUMAN
A:
[22-640]
FS
R
A
A
M
E
M
A
L
RGV
R
K
V
L
C
V
A
E
K
N
D
A
A
K
G
I
A
D
L
L
S
N
GR
M
R
R
R
E
G
L
-
S
K
F
N
K
I
Y
E
-
F
D
-
Y
H
L
Y
G
Q
N
V
T
M
V
M
T
S
V
S
GHL
L
A
H
D
F
Q
M
Q
F
R
----
K
W
Q
-
S
C
N
----
P
L
V
L
F
E
A
E
I
E
K
Y
C
P
E
N
F
V
D
I
K
K
T
L
E
R
E
T
R
Q
CQ
A
L
V
I
W
T
D
C
D
R
E
G
E
N
I
G
F
E
I
I
H
V
C
K
----
A
----
V
-
K
P
N
L
Q
V
L
R
A
R
F
S
E
I
T
P
H
A
V
R
T
A
C
E
N
L
T
--
E
P
D
--
Q
R
V
S
D
A
V
D
V
R
Q
E
L
D
L
R
I
G
A
A
F
T
R
F
Q
T
-----
L
R
L
Q
-----
R
I
F
PEVLAEQL
I
S
Y
G
S
C
Q
F
P
T
L
G
F
V
V
E
R
F
K
A
I
Q
A
F
V
P
E
I
F
H
R
I
---
K
V
T
-
H
---------------
D
--
H
KD
G
I
V
E
F
N
W
K
-
R
------------
H
R
------
L
F
N
H
T
A
C
L
V
L
Y
Q
L
C
V
E
D
P
M
A
T
V
V
E
V
R
S
K
P
K
S
K
W
R
P
Q
A
L
D
T
V
E
L
E
K
L
A
S
R
K
L
R
I
N
A
K
E
T
M
R
I
A
E
K
L
Y
T
-------
Q
-------
G
Y
I
--------
S
Y
P
R
T
E
T
N
I
F
P
R
D
L
N
L
T
V
L
V
E
-
Q
Q
T
P
D
P
--
R
W
G
A
F
A
Q
S
I
L
E
R
G
G
------
P
T
P
R
N
--
G
N
K
S
D
Q
A
-
H
P
P
I
H
P
T
K
Y
----
T
------
N
----
N
----
L
Q
G
D
E
Q
---
R
L
Y
E
F
I
V
R
H
F
L
A
C
C
S
Q
D
A
Q
G
Q
E
T
T
V
E
I
D
I
A
Q
E
R
F
V
A
H
G
L
M
I
--
L
A
R
--
N
Y
----
L
D
V
-----
Y
P
Y
D
H
-----
W
-
S
D
K
I
L
P
V
Y
E
Q
G
S
H
F
Q
P
S
T
V
E
M
V
D
G
E
T
S
P
P
K
L
L
T
E
A
D
L
I
A
L
M
E
K
H
-------------------
G
I
G
T
D
A
T
H
A
E
H
I
E
T
I
K
A
R
M
Y
V
G
L
T
P
D
K
R
F
L
P
G
H
L
G
M
G
L
---
V
E
G
Y
D
---
S
MGY
E
M
S
K
P
D
---
L
R
A
E
L
E
A
D
L
K
L
I
C
D
G
K
---------------
K
D
K
F
V
V
L
R
Q
Q
V
Q
K
Y
K
Q
V
F
I
E
A
V
A
-------------------------------------------------------------------------------
K
A
K
K
L
D
E
A
L
A
Q
Y
F
G
N
G
T
----------------
12
PsiBlast_PDB
71.33
26%
-57
- C3 -
1CY6
4
TOP1_ECOLI
A:
[101-575]
----------------------------------------------------------------------------------------------------------------------------
L
A
E
K
A
D
H
---
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
----
G
----
D
-
D
A
R--
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
--
K
--
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
-----
K
K
I
A
-----
R
G
---------
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
T
T
-
P
---------------
S
--
G
----
E
A
L
A
L
Q
-
V
------------
T
H
QND
K
P
F
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
---------------
A
G
Y
-------
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
--
K
Y
----
L
P
E
S
P
N
Q
Y
------
A
----------
A
---
H
E
A
I
R
P
S
D
V
----
N
V
M
A
---
E
----
S
----
L
K
D
M
E
A
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
G
D
F
R
L
K
A
R
G
R
I
L
--
R
F
D
--
G
W
TKVM
P
A
L
-----
R
---
E
-------
D
R
I
L
P
A
-
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
-------------------
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
-
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
---
R
---
E
L
M
N
Y
D
---
F
T
A
Q
M
E
N
S
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
S
D
F
T
Q
--------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
71.13
26%
-50
- C3 -
1MW8
6
TOP1_ECOLI
X:
[99-573]
----------------------------------------------------------------------------------------------------------------------------
L
A
E
K
A
D
H
---
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
----
G
----
D
-
D
A
R--
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
--
K
--
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
-----
K
K
I
A
-----
R
G
---------
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
DAS
T
T
T
-
P
---------------
S
--
G
----
E
A
L
A
L
Q
-
V
------------
T
H
QNDKPF
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
---------------
A
G
Y
-------
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
--
K
Y
----
L
P
E
S
P
N
Q
Y
------
A
S
--------
E
A
R
E
---
A
I
R
P
S
D
V
----
N
V
M
A
---
E
----
S
----
L
K
D
M
E
A
DAQ
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
G
D
F
R
L
K
A
R
G
R
I
L
--
R
F
D
--
G
W
TKVM
P
A
----------
E
-------
D
R
I
L
P
A
-
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
-------------------
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
-
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
TDR
L
E
E
N
F
---
R
---
E
L
M
N
Y
D
---
F
T
A
Q
M
E
N
N
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
S
D
F
T
Q
--------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
70.78
26%
-51
- C3 -
1MW9
7
TOP1_ECOLI
X:
[99-573]
----------------------------------------------------------------------------------------------------------------------------
L
A
E
K
A
D
H
---
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
----
G
----
D
-
D
A
R--
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
--
K
--
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
-----
K
K
I
A
-----
R
G
---------
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
DAS
T
T
T
-
P
---------------
S
--
G
----
E
A
L
A
L
Q
-
V
------------
T
H
QNDKPF
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
---------------
A
G
Y
-------
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
--
K
Y
----
L
P
E
S
P
N
Q
Y
------
A
-----------
R
E
---
A
I
R
P
S
D
V
----
N
V
M
A
---
E
----
S
----
L
K
D
M
E
A
DAQ
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
G
D
F
R
L
K
A
R
G
R
I
L
--
R
F
D
--
G
W
TKVM
P
A
L
---------
E
-------
D
R
I
L
P
A
-
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
-------------------
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
-
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
TDR
L
E
E
N
F
---
R
---
E
L
M
N
Y
D
---
F
T
A
Q
M
E
N
N
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
S
D
F
T
Q
--------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
70.66
26%
-53
- C3 -
1CY1
4
TOP1_ECOLI
A:
[101-575]
----------------------------------------------------------------------------------------------------------------------------
L
A
E
K
A
D
H
---
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
----
G
----
D
-
D
A
R--
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
--
K
--
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
-----
K
K
I
A
-----
R
G
---------
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
T
T
-
P
---------------
S
--
G
----
E
A
L
A
L
Q
-
V
------------
T
H
QNDKPF
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
---------------
A
G
Y
-------
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
--
K
Y
----
L
P
E
S
P
N
Q
Y
------
A
---------
E
A
---
H
E
A
I
R
P
S
D
V
----
N
V
M
A
---
E
----
S
----
L
K
D
M
E
A
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
G
D
F
R
L
K
A
R
G
R
I
L
--
R
F
D
--
G
W
TKVM
P
A
L
-------------------
I
L
P
A
-
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
-------------------
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
-
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
---
R
---
E
L
M
N
Y
D
---
F
T
A
Q
M
E
N
S
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
S
D
F
T
Q
--------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
70.48
26%
-54
- C3 -
3PWT
3
TOP1_ECOLI
A:
[99-575]
----------------------------------------------------------------------------------------------------------------------------
L
A
E
K
A
D
H
---
I
Y
L
A
T
N
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
----
G
----
D
-
D
A
R--
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
--
K
--
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
-----
K
K
I
A
-----
R
G
---------
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
T
T
-
P
---------------
S
--
G
----
E
A
L
A
L
Q
-
V
------------
T
H
QND
K
P
F
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
---------------
A
G
Y
-------
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
--
K
Y
----
L
P
E
S
P
N
Q
Y
------
A
----------
A
---
H
E
A
I
R
P
S
D
V
----
N
V
M
A
---
E
----
S
----
L
K
D
M
E
A
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
G
D
F
R
L
K
A
R
G
R
I
L
--
R
F
D
--
G
W
TKVM
P
A
L
-----
R
---
E
-------
D
R
I
L
P
A
-
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
-------------------
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
-
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
---
R
---
E
L
M
N
Y
D
---
F
T
A
Q
M
E
N
S
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
S
D
F
T
Q
Q
L
------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
70.47
26%
-56
- C3 -
1CY4
4
TOP1_ECOLI
A:
[101-575]
----------------------------------------------------------------------------------------------------------------------------
L
A
E
K
A
D
H
---
I
Y
L
A
T
D
L
D
R
E
G
E
A
I
A
W
H
L
R
E
V
I
G
----
G
----
D
-
D
A
R--
Y
S
R
V
V
F
N
E
I
T
K
N
A
I
R
Q
A
F
N
--
K
--
P
G
E
L
N
I
D
R
V
N
A
Q
Q
A
R
R
F
M
D
R
V
V
G
Y
M
V
S
P
L
L
W
-----
K
K
I
A
-----
R
G
---------
L
S
A
G
R
V
Q
S
V
A
V
R
L
V
V
E
R
E
R
E
I
K
A
F
V
P
E
E
F
W
E
V
D
A
S
T
T
T
-
P
---------------
S
--
G
----
E
A
L
A
L
Q
-
V
------------
T
H
QND
K
P
F
R
P
V
N
K
E
Q
T
Q
A
A
V
S
L
L
E
K
A
R
Y
S
V
L
E
R
E
D
K
P
T
T
S
K
P
G
A
P
F
I
T
S
T
L
Q
Q
A
A
S
T
R
L
G
F
G
V
K
K
T
M
M
M
A
Q
R
L
Y
E
---------------
A
G
Y
-------
I
T
Y
M
R
T
D
S
T
N
L
S
Q
D
A
V
N
M
V
R
G
Y
I
S
D
N
F
G
K
--
K
Y
----
L
P
E
S
P
N
Q
Y
------
A
--------------
H
E
A
I
R
P
S
D
V
----
N
V
M
A
---
E
----
S
----
L
K
D
M
E
A
D
A
Q
K
L
Y
Q
L
I
W
R
Q
F
V
A
C
Q
M
T
P
A
K
Y
D
S
T
T
L
T
V
G
A
G
D
F
R
L
K
A
R
G
R
I
L
--
R
F
D
--
G
W
TKVM
P
A
L
-------------------
I
L
P
A
-
V
N
K
G
D
A
L
T
L
V
E
L
T
P
A
Q
H
F
T
K
P
P
A
R
F
S
E
A
S
L
V
K
E
L
E
K
-------------------
R
G
I
G
R
P
S
T
Y
A
S
I
I
S
T
I
Q
-
D
R
G
Y
V
R
V
E
N
R
R
F
Y
A
E
K
M
G
E
I
V
T
D
R
L
E
E
N
F
---
R
---
E
L
M
N
Y
D
---
F
T
A
Q
M
E
N
S
L
D
Q
V
A
N
H
E
A
E
W
K
A
V
L
D
H
F
F
S
D
F
T
Q
--------------------------------------------------------------------------------------------------------------------------------------