@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 : Wbm0764: (2015-12-04 )
MESNYNADAIKILRGLDAVRKRPGMYIGDTDDGSGLHHMVYEVVDNAIDESLAGYCDKIEVSINEDGSVSVTDNGRGIPTDIHKEEGISAAEVIMTQLHAGGKFDSNTYKVSGGLHGVGISVVNALSSWLELTIWRNKKEHFMRFEDGESIEPLKIVNKNTNKRGTRVTFMPSTETFSSIDFSYSTLENRIRELAFLNSSINITLRDLRNKPYIESHFNDSKQSKDNFGTANFVRYLDKNKTHVTKITSMKGDAKDLGISIEISMEWNDSYYEHMLCFTNNIRQRDGGTHLAGFRSALTRCINNYATDEGFLKKAKVSLTGEDVREGLTCVLSLKMPDPKFSSQTKDKLVSSEARTVVESIVFDKLSTILETDPKLAASIVERVIRSAKGREAARKARELVKNKNSIDISTLPGKLADCQEKVPELSELFIVEGNSAGGTAKQGRNRKTQAVLALRGKILNVERVSLDRIFSSAEIGSLITAIGAGIGSEHFDIEKTRYHKIIIMTDADVDGSHIRTLILTFFFRYMREVIERGYLYIAQPPLYKVTKNAEDTYIKDDETFEKYIVNLAVKKLTLNSTGRGLRFILSKCLSISNISKNYSRGIPQNLLESLLILSKKNALSSANEILKYLKLMYSEYNWEVEIKDEEREVHISKLFQGLADKYVFPLSMLDSKEIRNILSSLDDVIDLFNGDSFLKSQETEIKIRSPSALAKIVMDYGKKGLTLQRFKGLGEMNADQLWDTTLNPETRTLLKVEIKDCEEADSIFSVLMGDIVEPRRNFINNNALNVYDVDI
Atome Classification :
(54 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
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MESNYN
A
D
A
I
K
I
L
R
G
L
D
A
V
R
KRP
G
M
Y
IGDTDDGS
G
L
H
H
M
V
Y
E
V
V
D
N
A
I
D
E
S
L
A
GYC
D
K
I
E
V
S
INEDG
S
V
S
VTDNGRGIPTD
I
H
K
E
EGI
S
A
A
E
V
I
M
T
Q
L
HAGGKFDS
N
T
Y
K
VSGGLH
G
V
G
I
S
V
V
N
A
L
S
S
W
L
E
L
T
IWRNK
K
E
H
F
M
RFED-G-ESIE
P
L
K
-
I
-VNK-N-T-NKR--G
T
R
V
T
F
M
PSTETF-SSI-D-F
S
Y
S
T
L
E
N
R
I
R
E
L
A
FLNSS
I
N
I
T
L
R
D
LR-----NKP
Y
I
E
S--------HFNDSKQSKDNFG
T
A
-
N
F
V
R
Y
L
DKNK
T
H
V
-
T
K
I
TSMKGDAKDL
G
I
S
I
E
I
S
M
EWN
D
S
Y
-
Y
E
H
M
L
-
C
F
TNNIRQRDGGT
H
L
A
G
F
R
S
A
L
T
R
C
I
N
NYAT
D
E
G
F
L
K
K
A
K
V
SL
T
G
E
D
V
R
E
G
L
T
C
V
L
S
LKMPDP--KFSS
Q
T
K
D
K
L
V
S
S
E
A
R
T
V
V
E
S
I
V
F
D
K
L
S
T
I
L
ET
D
P
K
L
A
A
S
I
V
E
R
V
I
R
SAK
G
R
E
A
A
R
K
A
R
E
L
VKNKNSIDISTLPG
K
L
A
D
C
Q
E
K
V
P
E
L
S
E
L
F
I
V
EGNSAGGTAKQGRNR
K
T
Q
A
V
L
ALR
G
K
I
L
N
V
E
R
V
S
L
D
R
I
FSS
A
E
I
G
S
L
I
T
A
I
G
AGIGSEHFDIEKT
R
Y
H
K
I
I
I
M
TDADVD
G
S
H
I
R
T
L
I
L
T
F
F
F
R
Y
M
R
E
V
I
ERG
Y
L
Y
IAQPPL
Y
K
VTKNAEDTYIK
D
D
E
T
F
E
K
Y
I
V
N
L
A
V
K
K
L
T
LNSTG
R
G
L
R
F
I
L
S
K
C
L
S
I
S
NIS
K
N
Y
SRGI
P
Q
N
L
L
E
S
L
L
I
L
SKKNAL
S
S
A
N
E
I
L
K
Y
L
K
L
M
Y
SEY
N
W
E
V
E
I
KDE
E
R
E
V
H
I
S
K
L
F
Q
G
L
A
D
K
Y
V
F
P
L
S
ML
D
S
K
E
I
R
N
I
L
S
S
L
D
D
V
I
D
L
FNGDSFLKSQE
T
E
I
K
IR
S
P
S
A
L
A
K
I
V
M
D
YGKKG
L
T
L
Q
R
F
KGLGEM
N
A
D
Q
L
WDTTLNPET
R
T
L
L
K
V
E
IKDC
E
E
A
D
S
I
F
S
V
L
M
G
D
I
V
E
P
R
R
N
FINNNA
L
N
V
Y
DVDI
1
PsiBlast_PDB
87.56
49%
-96
- C3 -
4I3H
2
?
A:
[24-547]
-----------------
A
V
R
K
R
P
G
M
Y
I
G
S
T
D
-
G
A
G
L
H
H
L
V
W
E
I
V
D
N
A
V
D
E
A
L
S
---
D
R
I
D
V
T
I
N
K
D
G
S
L
T
V
Q
D
H
---------------
T
V
E
V
I
F
T
I
L
H
A
G
G
K
F
----------
L
H
G
V
G
S
S
V
V
N
A
L
S
S
W
L
E
V
E
I
T
R
D
G
A
V
Y
K
Q
R
F
E
N
-
G
G
K
P
V
T
T
L
K
K
I
-
G
T
A
-
P
-
K
-
S
K
T
--
G
T
K
V
T
F
M
P
D
A
T
I
F
-
S
T
T
-
D
-
F
K
Y
N
T
I
S
E
R
L
N
E
S
A
F
L
L
K
N
V
T
L
S
L
T
D
K
R
-----
T
D
E
A
I
E
F
--------
H
Y
E
N
--------
G
V
Q
-
D
F
V
S
Y
L
N
E
D
K
E
I
L
-
T
P
V
L
Y
F
E
G
E
--
D
N
G
F
Q
V
E
V
A
L
Q
Y
N
D
G
F
-
S
D
N
I
L
-
S
F
V
N
N
V
R
T
K
D
G
G
T
H
E
T
G
L
K
S
A
I
T
K
V
M
N
D
Y
A
R
K
T
G
L
L
K
E
K
----
E
G
S
D
Y
R
E
G
L
A
A
V
L
S
I
L
V
P
E
E
H
L
Q
F
E
G
Q
T
K
D
K
L
G
S
P
L
A
R
P
V
V
D
G
I
V
A
D
K
L
T
F
F
L
M
E
N
G
E
L
A
S
N
L
I
R
K
A
I
K
A
R
D
A
R
E
A
A
R
K
A
R
---------------
G
K
L
T
P
A
Q
S
K
N
P
A
K
N
E
L
Y
L
V
E
G
D
S
A
G
G
S
A
K
Q
G
R
D
R
K
F
Q
A
I
L
P
L
R
G
K
V
I
N
T
A
K
A
K
M
A
D
I
L
K
N
E
E
I
N
T
M
I
Y
T
I
G
A
G
V
G
A
D
-
F
S
I
E
D
A
N
Y
D
K
I
I
I
M
T
D
A
D
T
D
G
A
H
I
Q
T
L
L
L
T
F
F
Y
R
Y
M
R
P
L
V
E
A
G
H
V
Y
I
A
L
P
P
L
Y
K
M
S
K
G
A
Y
A
W
D
G
E
L
E
E
L
R
L
Q
R
Y
K
G
L
G
E
M
N
A
D
Q
L
W
E
T
T
M
N
P
E
T
R
T
L
I
R
V
T
I
E
D
L
A
R
A
E
R
R
V
N
V
L
M
G
D
K
V
E
P
R
R
K
W
I
E
D
N
V
K
F
T
L
E
N
I
Q
N
M
S
L
E
D
I
M
G
E
R
F
G
R
Y
S
K
Y
I
I
Q
D
R
A
L
P
D
I
R
D
G
L
K
P
V
Q
R
R
I
L
Y
S
M
N
K
D
S
N
T
F
D
K
S
Y
R
K
S
A
K
S
V
G
N
I
M
G
N
F
H
P
H
G
D
S
S
I
Y
D
A
M
V
R
M
S
Q
N
W
K
N
R
E
I
L
V
E
M
H
G
N
N
G
S
M
D
G
D
P
P
A
A
M
R
Y
T
E
A
R
L
S
E
I
A
G
Y
L
L
Q
D
I
E
K
K
T
V
P
F
A
W
N
F
D
D
T
E
K
E
P
T
V
L
P
A
A
F
P
N
L
L
V
N
G
S
9
PsiBlast_PDB
80.65
58%
-74
- C2 -
4ZVI
3
?
A:
[1-361]
---------------
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
-------------------
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
-
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
E
G
------
G
I
K
-
A
F
V
E
Y
L
N
K
N
K
T
P
I
-
H
P
N
I
F
Y
F
S
T
E
K
D
-
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
-
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
K
K
A
K
V
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
R
A
R
E
M
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
136
Fugue
80.51
57%
-64
- C2 -
1EI1
6
GYRB_ECOLI
A:
[1-391]
-
S
N
S
S
D
S
S
S
I
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
T----
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
D
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
E
D
H
F
--------
H
Y
E
G
--------
G
I
K
-
A
F
V
E
Y
L
N
K
N
K
T
P
I
-
H
P
-
N
I
F
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
-
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
K
K
A
K
V
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
R
A
R
E
M
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
135
Fugue
80.37
57%
-64
- C2 -
1EI1
6
GYRB_ECOLI
A:
[1-391]
-
S
N
S
S
D
S
S
S
I
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
D
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
E
D
H
F
--------
H
Y
E
G
--------
G
I
K
-
A
F
V
E
Y
L
N
K
N
K
T
P
I
-
H
P
-
N
I
F
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
-
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
K
K
A
K
V
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
R
A
R
E
M
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
79.83
57%
-64
- C2 -
4WUB
5
GYRB_ECOLI
A:
[3-375]
---
S
Y
D
S
S
S
I
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
E
G
------
G
I
K
-
A
F
V
E
Y
L
N
K
N
K
T
P
I
-
H
P
N
I
F
Y
F
S
T
E
K
D
-
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
-
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
-----
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
R
A
R
E
M
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
79.65
57%
-64
- C2 -
4WUD
4
GYRB_ECOLI
A:
[3-375]
---
S
Y
D
S
S
S
I
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
E
G
------
G
I
K
-
A
F
V
E
Y
L
N
K
N
K
T
P
I
-
H
P
N
I
F
Y
F
S
T
E
K
D
-
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
-
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
-----
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
R
A
R
E
M
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
79.56
58%
-63
- C2 -
4PRV
2
GYRB_ECOLI
A:
[16-382]
---------
I
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
E
G
------
G
I
K
-
A
F
V
E
Y
L
N
K
N
K
T
P
I
-
H
P
N
I
F
Y
F
S
T
E
K
D
-
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
-
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
-------------
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
79.40
57%
-62
- C2 -
4WUC
5
GYRB_ECOLI
A:
[3-375]
---
S
Y
D
S
S
S
I
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
E
G
------
G
I
K
-
A
F
V
E
Y
L
N
K
N
K
T
P
I
-
H
P
N
I
F
Y
F
S
T
E
K
D
-
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
-
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
-----
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
R
A
R
E
M
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
79.35
57%
-64
- C2 -
4XTJ
5
GYRB_ECOLI
A:
[3-375]
---
S
Y
D
S
S
S
I
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
E
G
------
G
I
K
-
A
F
V
E
Y
L
N
K
N
K
T
P
I
-
H
P
N
I
F
Y
F
S
T
E
K
D
-
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
-
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
-----
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
R
A
R
E
M
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
78.03
58%
-63
- C2 -
1EI1
5
GYRB_ECOLI
A:
[9-375]
---------
I
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
D
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
E
G
------
G
I
K
-
A
F
V
E
Y
L
N
K
N
K
T
P
I
-
H
P
N
I
F
Y
F
S
T
E
K
D
-
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
-
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
K
K
A
K
V
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
R
A
R
E
M
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
77.91
42%
-67
- C2 -
3ZKB
3
GYRB_MYCTU
A:
[16-428]
---
E
Y
G
A
A
S
I
T
I
L
E
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
G
E
-
R
G
L
H
H
L
I
W
E
V
V
D
N
A
V
D
E
A
M
A
G
Y
A
T
T
V
N
V
V
L
L
E
D
G
G
V
E
V
A
D
D
G
R
G
I
P
V
A
T
H
A
S
-
G
I
P
T
V
D
V
V
M
T
Q
L
H
A
G
G
K
F
D
S
D
A
Y
A
I
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
T
R
L
E
V
E
I
K
R
D
G
Y
E
W
S
Q
V
Y
E
K
-
S
-
E
---
P
L
G
-
L
K
Q
G
A
-
P
-
T
-
K
K
T
--
G
S
T
V
R
F
W
A
D
P
A
V
F
-
E
T
T
-
E
-
Y
D
F
E
T
V
A
R
R
L
Q
E
M
A
F
L
N
K
G
L
T
I
N
L
T
D
E
R
------------P-------
H
K
V
K
S
R
T
F
H
Y
P
G
G
L
V
-
D
F
V
K
H
I
N
R
T
K
N
A
I
H
S
S
I
V
D
F
S
G
--
K
G
T
G
H
E
V
E
I
A
M
Q
W
N
A
G
Y
-
S
E
S
V
H
-
T
F
A
N
T
I
N
T
H
E
G
G
T
H
E
E
G
F
R
S
A
L
T
S
V
V
N
K
Y
A
K
D
R
K
L
L
---
D
P
N
L
T
G
D
D
I
R
E
G
L
A
A
V
I
S
V
K
V
S
E
P
--
Q
F
E
G
Q
T
K
T
K
L
G
N
T
E
V
K
S
F
V
Q
K
V
C
N
E
Q
L
T
H
W
F
E
A
N
P
T
D
A
K
V
V
V
N
K
A
V
S
S
A
Q
A
R
I
A
A
R
K
A
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
116
HHSearch
77.66
45%
-70
- C2 -
1KIJ
3
?
A:
[7-389]
--------
A
I
R
V
L
K
G
L
E
G
V
R
H
R
P
A
M
Y
I
G
G
T
-
G
V
E
G
Y
H
H
L
F
K
E
I
L
D
N
A
V
D
E
A
L
A
G
Y
A
T
E
I
L
V
R
L
N
E
D
G
S
L
T
V
E
D
N
G
R
G
I
P
V
D
L
M
P
E
E
G
K
P
A
V
E
V
I
Y
N
T
L
H
S
G
G
K
F
E
Q
G
A
Y
K
V
S
G
G
L
H
G
V
G
A
S
V
V
N
A
L
S
E
W
T
V
V
E
V
F
R
E
G
K
H
H
R
I
A
F
S
R
-
G
-
E
V
T
E
P
L
R
-
V
-
V
G
E
A
P
-
R
-
G
K
T
--
G
T
R
V
T
F
K
P
D
P
E
I
F
-
G
N
L
-
R
-
F
D
P
S
K
I
R
A
R
L
R
E
V
A
Y
L
V
A
G
L
K
L
V
F
Q
D
R
Q
-----
H
G
K
----------------
E
E
V
F
L
D
K
G
G
V
A
-
S
F
A
K
A
L
A
E
G
E
D
L
L
Y
E
K
P
F
L
I
R
G
T
-
H
G
E
-
V
E
V
E
V
G
F
L
H
T
Q
G
Y
-
N
A
E
I
L
-
T
Y
A
N
M
I
P
T
R
D
G
G
T
H
L
T
A
F
K
S
A
Y
S
R
A
L
N
Q
Y
A
K
K
A
G
L
N
K
E
K
G
P
Q
P
T
G
D
D
L
L
E
G
L
Y
A
V
V
S
V
K
L
P
N
P
--
Q
F
E
G
Q
T
K
G
K
L
L
N
P
E
A
G
T
A
V
G
Q
V
V
Y
E
R
L
L
E
I
L
E
E
N
P
R
I
A
K
A
V
Y
E
K
A
L
R
A
A
Q
A
R
E
A
A
R
K
A
R
E
L
V
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
43
PsiBlast_CBE
77.44
42%
-67
- C2 -
3ZKB
4
GYRB_MYCTU
B:
[15-429]
--
D
E
Y
G
A
A
S
I
T
I
L
E
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
G
E
-
R
G
L
H
H
L
I
W
E
V
V
D
N
A
V
D
E
A
M
A
G
Y
A
T
T
V
N
V
V
L
L
E
D
G
G
V
E
V
A
D
D
G
R
G
I
P
V
A
T
H
A
S
-
G
I
P
T
V
D
V
V
M
T
Q
L
H
A
G
G
K
F
D
S
D
A
Y
A
I
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
T
R
L
E
V
E
I
K
R
D
G
Y
E
W
S
Q
V
Y
E
K
-
S
-
E
---
P
L
G
-
L
K
Q
G
A
-
P
-
T
-
K
K
T
--
G
S
T
V
R
F
W
A
D
P
A
V
F
-
E
T
T
-
E
-
Y
D
F
E
T
V
A
R
R
L
Q
E
M
A
F
L
N
K
G
L
T
I
N
L
T
D
E
R
----------------------
V
K
S
R
T
F
H
Y
P
G
G
L
V
-
D
F
V
K
H
I
N
R
T
K
N
A
I
H
S
S
I
V
D
F
S
G
--
K
G
T
G
H
E
V
E
I
A
M
Q
W
N
A
G
Y
-
S
E
S
V
H
-
T
F
A
N
T
I
N
T
H
E
G
G
T
H
E
E
G
F
R
S
A
L
T
S
V
V
N
K
Y
A
K
D
R
K
L
L
K
D
K
D
P
N
L
T
G
D
D
I
R
E
G
L
A
A
V
I
S
V
K
V
S
E
P
--
Q
F
E
G
Q
T
K
T
K
L
G
N
T
E
V
K
S
F
V
Q
K
V
C
N
E
Q
L
T
H
W
F
E
A
N
P
T
D
A
K
V
V
V
N
K
A
V
S
S
A
Q
A
R
I
A
A
R
K
A
R
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
77.40
58%
-65
- C2 -
1EI1
6
GYRB_ECOLI
B:
[9-375]
---------
I
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
D
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
E
G
------
G
I
K
-
A
F
V
E
Y
L
N
K
N
K
T
P
I
-
H
P
N
I
F
Y
F
S
T
E
K
D
-
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
-
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
K
K
A
K
V
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
R
A
R
E
M
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
77.26
58%
-60
- C2 -
4PU9
3
GYRB_ECOLI
A:
[16-382]
---------
I
K
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
E
G
------
G
I
K
-
A
F
V
E
Y
L
N
K
N
K
T
P
I
-
H
P
N
I
F
Y
F
S
T
E
K
D
-
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
-
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
K
-----------
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
R
A
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
25
PsiBlast_CBE
76.99
42%
-66
- C2 -
3ZKD
3
GYRB_MYCTU
G:
[15-425]
--
D
E
Y
G
A
A
S
I
T
I
L
E
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
G
E
-
R
G
L
H
H
L
I
W
E
V
V
D
N
A
V
D
E
A
M
A
G
Y
A
T
T
V
N
V
V
L
L
E
D
G
G
V
E
V
A
D
D
G
R
G
I
P
V
A
T
H
A
S
-
G
I
P
T
V
D
V
V
M
T
Q
L
H
A
G
G
K
F
D
S
D
A
Y
A
I
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
T
R
L
E
V
E
I
K
R
D
G
Y
E
W
S
Q
V
Y
E
K
-
S
-
E
---
P
L
G
-
L
K
Q
G
A
-
P
-
T
-
K
K
T
--
G
S
T
V
R
F
W
A
D
P
A
V
F
-
E
T
T
-
E
-
Y
D
F
E
T
V
A
R
R
L
Q
E
M
A
F
L
N
K
G
L
T
I
N
L
T
D
E
R
V-----------P-------
H
K
V
K
S
R
T
F
H
Y
P
G
G
L
V
-
D
F
V
K
H
I
N
R
T
K
N
A
I
H
S
S
I
V
D
F
S
G
--
K
G
T
G
H
E
V
E
I
A
M
Q
W
N
A
G
Y
-
S
E
S
V
H
-
T
F
A
N
T
I
N
T
H
E
G
G
T
H
E
E
G
F
R
S
A
L
T
S
V
V
N
K
Y
A
K
D
R
K
L
L
----
P
N
L
T
G
D
D
I
R
E
G
L
A
A
V
I
S
V
K
V
S
E
P
--
Q
F
E
G
Q
T
K
T
K
L
G
N
T
E
V
K
S
F
V
Q
K
V
C
N
E
Q
L
T
H
W
F
E
A
N
P
T
D
A
K
V
V
V
N
K
A
V
S
S
A
Q
A
R
I
A
A
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
29
PsiBlast_CBE
76.84
42%
-64
- C2 -
3ZKD
3
GYRB_MYCTU
C:
[17-426]
----
Y
G
A
A
S
I
T
I
L
E
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
G
E
-
R
G
L
H
H
L
I
W
E
V
V
D
N
A
V
D
E
A
M
A
G
Y
A
T
T
V
N
V
V
L
L
E
D
G
G
V
E
V
A
D
D
G
R
G
I
P
V
A
T
H
A
S
-
G
I
P
T
V
D
V
V
M
T
Q
L
H
A
G
G
K
F
D
S
D
A
Y
A
I
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
T
R
L
E
V
E
I
K
R
D
G
Y
E
W
S
Q
V
Y
E
K
-
S
-
E
---
P
L
G
-
L
K
Q
G
A
-
P
-
T
-
K
K
T
--
G
S
T
V
R
F
W
A
D
P
A
V
F
-
E
T
T
-
E
-
Y
D
F
E
T
V
A
R
R
L
Q
E
M
A
F
L
N
K
G
L
T
I
N
L
T
D
E
R
VTQDE-------
R
A
A
E
S
T
AP
H
K
V
K
S
R
T
F
H
Y
P
G
G
L
V
-
D
F
V
K
H
I
N
R
T
K
N
A
I
H
S
S
I
V
D
F
S
G
--
K
G
T
G
H
E
V
E
I
A
M
Q
W
N
A
G
Y
-
S
E
S
V
H
-
T
F
A
N
T
I
N
T
H
E
G
G
T
H
E
E
G
F
R
S
A
L
T
S
V
V
N
K
Y
A
K
D
R
K
L
L
K
--
D
P
N
L
T
G
D
D
I
R
E
G
L
A
A
V
I
S
V
K
V
S
E
P
--
Q
F
E
G
Q
T
K
T
K
L
G
N
T
E
V
K
S
F
V
Q
K
V
C
N
E
Q
L
T
H
W
F
E
A
N
P
T
D
A
K
V
V
V
N
K
A
V
S
S
A
Q
A
R
I
A
A
R
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
44
PsiBlast_CBE
76.74
42%
-68
- C2 -
1KIJ
3
?
B:
[7-372]
--------
A
I
R
V
L
K
G
L
E
G
V
R
H
R
P
A
M
Y
I
G
G
T
G
V
-
E
G
Y
H
H
L
F
K
E
I
L
D
N
A
V
D
E
A
L
A
G
Y
A
T
E
I
L
V
R
L
N
E
D
G
S
L
T
V
E
D
N
G
R
G
I
P
V
D
L
M
P
E
E
G
K
P
A
V
E
V
I
Y
N
T
L
H
S
G
G
K
F
E
Q
G
A
Y
K
V
S
G
G
L
H
G
V
G
A
S
V
V
N
A
L
S
E
W
T
V
V
E
V
F
R
E
G
K
H
H
R
I
A
F
S
R
-
G
-
E
V
T
E
P
L
R
-
V
-
V
G
E
-
A
-
P
R
G
K
T
--
G
T
R
V
T
F
K
P
D
P
E
I
F
-
G
N
L
-
R
-
F
D
P
S
K
I
R
A
R
L
R
E
V
A
Y
L
V
A
G
L
K
L
V
F
Q
D
R
Q
-----
H
----------------
G
K
E
E
V
F
L
D
K
G
G
V
A
-
S
F
A
K
A
L
A
E
G
E
D
L
L
Y
E
K
P
F
L
I
R
G
T
H
G
E
--
V
E
V
E
V
G
F
L
H
T
Q
G
Y
-
N
A
E
I
L
-
T
Y
A
N
M
I
P
T
R
D
G
G
T
H
L
T
A
F
K
S
A
Y
S
R
A
L
N
Q
Y
A
K
K
A
G
L
N
K
E
K
G
P
Q
P
T
G
D
D
L
L
E
G
L
Y
A
V
V
S
V
K
L
P
N
P
--
Q
F
E
G
Q
T
K
G
K
L
L
N
P
E
A
G
T
A
V
G
Q
V
V
Y
E
R
L
L
E
I
L
E
E
N
P
R
I
A
K
A
V
Y
E
K
A
L
R
A
A
Q
A
R
E
A
A
R
K
A
R
E
L
V
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
76.68
42%
-63
- C2 -
3ZKD
3
GYRB_MYCTU
F:
[15-426]
--
D
E
Y
G
A
A
S
I
T
I
L
E
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
G
E
-
R
G
L
H
H
L
I
W
E
V
V
D
N
A
V
D
E
A
M
A
G
Y
A
T
T
V
N
V
V
L
L
E
D
G
G
V
E
V
A
D
D
G
R
G
I
P
V
A
T
H
A
S
-
G
I
P
T
V
D
V
V
M
T
Q
L
H
A
G
G
K
F
D
S
D
A
Y
A
I
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
T
R
L
E
V
E
I
K
R
D
G
Y
E
W
S
Q
V
Y
E
K
-
S
-
E
---
P
L
G
-
L
K
Q
G
A
-
P
-
T
-
K
K
T
--
G
S
T
V
R
F
W
A
D
P
A
V
F
-
E
T
T
-
E
-
Y
D
F
E
T
V
A
R
R
L
Q
E
M
A
F
L
N
K
G
L
T
I
N
L
T
D
E
R
VT-------------------
K
V
K
S
R
T
F
H
Y
P
G
G
L
V
-
D
F
V
K
H
I
N
R
T
K
N
A
I
H
S
S
I
V
D
F
S
G
--
K
G
T
G
H
E
V
E
I
A
M
Q
W
N
A
G
Y
-
S
E
S
V
H
-
T
F
A
N
T
I
N
T
H
E
G
G
T
H
E
E
G
F
R
S
A
L
T
S
V
V
N
K
Y
A
K
D
R
K
------
P
N
L
T
G
D
D
I
R
E
G
L
A
A
V
I
S
V
K
V
S
E
P
--
Q
F
E
G
Q
T
K
T
K
L
G
N
T
E
V
K
S
F
V
Q
K
V
C
N
E
Q
L
T
H
W
F
E
A
N
P
T
D
A
K
V
V
V
N
K
A
V
S
S
A
Q
A
R
I
A
A
R
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
28
PsiBlast_CBE
76.39
42%
-63
- C2 -
3ZKD
3
GYRB_MYCTU
D:
[16-428]
---
E
Y
G
A
A
S
I
T
I
L
E
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
G
E
-
R
G
L
H
H
L
I
W
E
V
V
D
N
A
V
D
E
A
M
A
G
Y
A
T
T
V
N
V
V
L
L
E
D
G
G
V
E
V
A
D
D
G
R
G
I
P
V
A
T
H
A
S
-
G
I
P
T
V
D
V
V
M
T
Q
L
H
A
G
G
K
F
D
S
D
A
Y
A
I
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
T
R
L
E
V
E
I
K
R
D
G
Y
E
W
S
Q
V
Y
E
K
-
S
-
E
---
P
L
G
-
L
K
Q
G
A
-
P
-
T
-
K
K
T
--
G
S
T
V
R
F
W
A
D
P
A
V
F
-
E
T
T
-
E
-
Y
D
F
E
T
V
A
R
R
L
Q
E
M
A
F
L
N
K
G
L
T
I
N
L
T
D
E
R
V--------------------
K
V
K
S
R
T
F
H
Y
P
G
G
L
V
-
D
F
V
K
H
I
N
R
T
K
N
A
I
H
S
S
I
V
D
F
S
G
--
K
G
T
G
H
E
V
E
I
A
M
Q
W
N
A
G
Y
-
S
E
S
V
H
-
T
F
A
N
T
I
N
T
H
E
G
G
T
H
E
E
G
F
R
S
A
L
T
S
V
V
N
K
Y
A
K
D
R
---
K
D
K
D
P
N
L
T
G
D
D
I
R
E
G
L
A
A
V
I
S
V
K
V
S
E
P
--
Q
F
E
G
Q
T
K
T
K
L
G
N
T
E
V
K
S
F
V
Q
K
V
C
N
E
Q
L
T
H
W
F
E
A
N
P
T
D
A
K
V
V
V
N
K
A
V
S
S
A
Q
A
R
I
A
A
R
K
A
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
55
PsiBlast_CBE
69.67
36%
-60
- C2 -
1S16
4
PARE_ECOLI
B:
[4-383]
---
T
Y
N
A
D
A
I
E
V
L
T
G
L
E
P
V
R
R
R
P
G
M
Y
T
----
D
T
T
R
P
N
H
L
G
Q
E
V
I
D
N
S
V
D
E
A
L
A
G
H
A
K
R
V
D
V
I
L
H
A
D
Q
S
L
E
V
I
D
D
G
R
G
M
P
V
D
I
H
P
E
E
G
V
P
A
V
E
L
I
L
C
R
L
H
A
G
G
K
F
S
N
K
N
Y
Q
F
S
G
G
L
H
G
V
G
I
S
V
V
N
A
L
S
K
R
V
E
V
N
V
R
R
D
G
Q
V
Y
N
I
A
F
E
N
-
G
-
E
K
V
Q
D
L
Q
-
V
-
V
G
--
T
-
C
-
G
K
R
NT
G
T
S
V
H
F
W
P
D
E
T
F
F
-
D
S
P
-
R
-
F
S
V
S
R
L
T
H
V
L
K
A
K
A
V
L
C
P
G
V
E
I
T
F
K
D
E
I
-----
N
N
T
E
Q
R
W
--------
C
Y
Q
D
G
L
--
N
D
Y
L
A
E
A
V
N
G
L
P
T
L
P
E
K
P
F
-----
I
G
N
F
A
G
D
T
E
----
A
V
D
W
A
L
L
W
L
P
E
G
-
G
E
L
L
T
E
S
Y
V
N
L
I
P
T
M
Q
G
G
T
H
V
N
G
L
R
Q
G
L
L
D
A
M
R
E
F
C
E
Y
R
N
I
L
P
R
G
-
V
K
L
S
A
E
D
I
W
D
R
C
A
Y
V
L
S
V
K
M
Q
D
P
--
Q
F
A
G
Q
T
K
E
R
L
S
S
R
Q
C
A
A
F
V
S
G
V
V
K
D
A
F
I
L
W
L
N
Q
N
V
Q
A
A
E
L
L
A
E
M
A
I
S
S
A
Q
R
R
--
M
R
A
A
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
117
HHSearch
69.47
36%
-61
- C2 -
1S16
4
PARE_ECOLI
A:
[4-383]
---
T
Y
N
A
D
A
I
E
V
L
T
G
L
E
P
V
R
R
R
P
G
M
Y
T
D
T
T
----
R
P
N
H
L
G
Q
E
V
I
D
N
S
V
D
E
A
L
A
G
H
A
K
R
V
D
V
I
L
H
A
D
Q
S
L
E
V
I
D
D
G
R
G
M
P
V
D
I
H
P
E
E
G
V
P
A
V
E
L
I
L
C
R
L
H
A
G
G
K
F
S
N
K
N
Y
Q
F
S
G
G
L
H
G
V
G
I
S
V
V
N
A
L
S
K
R
V
E
V
N
V
R
R
D
G
Q
V
Y
N
I
A
F
E
N
-
G
-
E
K
V
Q
D
L
Q
-
V
-
V
G
T
-
C
G
K
-
R
N
T
--
G
T
S
V
H
F
W
P
D
E
T
F
F
-
D
S
P
-
R
-
F
S
V
S
R
L
T
H
V
L
K
A
K
A
V
L
C
P
G
V
E
I
T
F
K
D
E
I
-----
N
N
T
----------------
E
Q
R
W
C
Y
Q
D
G
L
N
-
D
Y
L
A
E
A
V
N
G
L
P
T
L
P
E
K
P
F
I
G
N
F
A
-
G
D
T
-
E
A
V
D
W
A
L
L
W
L
P
E
G
G
E
L
L
T
E
-
S
Y
V
N
L
I
P
T
M
Q
G
G
T
H
V
N
G
L
R
Q
G
L
L
D
A
M
R
E
F
C
E
Y
R
N
I
L
P
R
-
G
V
K
L
S
A
E
D
I
W
D
R
C
A
Y
V
L
S
V
K
M
Q
D
P
--
Q
F
A
G
Q
T
K
E
R
L
S
S
R
Q
C
A
A
F
V
S
G
V
V
K
D
A
F
I
L
W
L
N
Q
N
V
Q
A
A
E
L
L
A
E
M
A
I
S
S
A
Q
R
R
M
R
A
--
A
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
56
PsiBlast_CBE
68.93
36%
-60
- C2 -
1S16
4
PARE_ECOLI
A:
[4-383]
---
T
Y
N
A
D
A
I
E
V
L
T
G
L
E
P
V
R
R
R
P
G
M
Y
T
----
D
T
T
R
P
N
H
L
G
Q
E
V
I
D
N
S
V
D
E
A
L
A
G
H
A
K
R
V
D
V
I
L
H
A
D
Q
S
L
E
V
I
D
D
G
R
G
M
P
V
D
I
H
P
E
E
G
V
P
A
V
E
L
I
L
C
R
L
H
A
G
G
K
F
S
N
K
N
Y
Q
F
S
G
G
L
H
G
V
G
I
S
V
V
N
A
L
S
K
R
V
E
V
N
V
R
R
D
G
Q
V
Y
N
I
A
F
E
N
-
G
-
E
K
V
Q
D
L
Q
-
V
-
V
G
--
T
-
C
-
G
K
R
N
T
G
T
S
V
H
F
W
P
D
E
T
F
F
-
D
S
P
-
R
-
F
S
V
S
R
L
T
H
V
L
K
A
K
A
V
L
C
P
G
V
E
I
T
F
K
D
E
I
-----
N
N
T
E
Q
R
W
--------
C
Y
Q
D
G
L
--
N
D
Y
L
A
E
A
V
N
G
L
P
T
L
P
E
K
P
F
-----
I
G
N
F
A
G
D
T
E
----
A
V
D
W
A
L
L
W
L
P
E
G
-
G
E
L
L
T
E
S
Y
V
N
L
I
P
T
M
Q
G
G
T
H
V
N
G
L
R
Q
G
L
L
D
A
M
R
E
F
C
E
Y
R
N
I
L
P
R
G
-
V
K
L
S
A
E
D
I
W
D
R
C
A
Y
V
L
S
V
K
M
Q
D
P
--
Q
F
A
G
Q
T
K
E
R
L
S
S
R
Q
C
A
A
F
V
S
G
V
V
K
D
A
F
I
L
W
L
N
Q
N
V
Q
A
A
E
L
L
A
E
M
A
I
S
S
A
Q
R
R
--
M
R
A
A
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
59.18
62%
-70
- C2 -
1AJ6
1
GYRB_ECOLI
A:
[11-216]
-----------
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
-----
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
-------
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
H
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
48
PsiBlast_CBE
56.91
65%
-74
- C2 -
4HYP
2
GYRB_ECOLI
C:
[2-204]
--------------
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
-----
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
-----
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
56.16
65%
-61
- C2 -
3G7E
1
GYRB_ECOLI
A:
[1-203]
--------------
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
Y
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
56.08
63%
-64
- C2 -
4DUH
1
GYRB_ECOLI
A:
[15-217]
--------------
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
D
D
N
S
--------
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
56.03
65%
-71
- C2 -
1KZN
1
GYRB_ECOLI
A:
[1-203]
--------------
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
----
G
V
S
A
A
E
V
I
M
T
V
L
H
A
---------------
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
45
PsiBlast_CBE
55.87
63%
-65
- C2 -
4DUH
1
GYRB_ECOLI
B:
[12-217]
-----------
V
L
K
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
H
P
E
E
G
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
------------
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
47
PsiBlast_CBE
55.68
65%
-72
- C2 -
4HYP
2
GYRB_ECOLI
D:
[2-204]
--------------
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
-----
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
-----
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
49
PsiBlast_CBE
55.06
65%
-72
- C2 -
4HYP
2
GYRB_ECOLI
B:
[2-204]
--------------
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
-----
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
-----
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
54.37
65%
-71
- C2 -
4HYP
2
GYRB_ECOLI
A:
[2-204]
--------------
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
-----
V
S
A
A
E
V
I
M
T
V
L
H
A
G
G
K
F
-----
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
54.11
65%
-69
- C2 -
4KFG
3
GYRB_ECOLI
A:
[2-204]
--------------
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
G
I
-----
V
S
A
A
E
V
I
M
T
V
L
-----------
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
52
PsiBlast_CBE
52.71
55%
-70
- C2 -
4MBC
1
?
A:
[17-226]
----------
Q
V
L
E
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
S
T
D
-
G
A
G
L
H
H
L
V
W
E
I
V
D
N
A
V
D
E
A
L
S
G
F
G
D
R
I
D
V
T
I
N
K
D
G
S
L
T
V
Q
D
H
G
R
G
M
P
T
G
M
H
A
-
M
G
I
P
T
V
E
V
I
F
T
I
L
H
A
-----------------
V
G
S
S
V
V
N
A
L
S
S
W
L
E
V
E
I
T
R
D
G
A
V
Y
K
Q
R
F
E
N
G
G
-
K
P
V
T
T
L
K
-
K
-
I
G
T
-
A
L
K
-
S
K
T
--
G
T
K
V
T
F
M
P
D
A
T
I
F
-
S
T
T
-
D
-
F
K
Y
N
T
I
S
E
R
L
N
E
S
A
F
L
L
K
N
V
T
L
S
L
T
D
K
R
-----
T
D
E
A
I
E
F
--------
H
Y
E
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
46
PsiBlast_CBE
52.41
65%
-64
- C2 -
4KFG
3
GYRB_ECOLI
B:
[2-204]
--------------
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
D
T
D
D
G
T
G
L
H
H
M
V
F
E
V
V
D
N
A
I
D
E
A
L
A
G
H
C
K
E
I
I
V
T
I
H
A
D
N
S
V
S
V
Q
D
D
G
R
G
I
P
T
------
G
V
S
A
A
E
V
I
M
T
V
L
-------
D
N
S
Y
K
V
S
G
G
L
H
G
V
G
V
S
V
V
N
A
L
S
Q
K
L
E
L
V
I
Q
R
E
G
K
I
H
R
Q
I
Y
E
H
-
G
-
V
P
Q
A
P
L
A
-
V
-
T
G
E
---
T
-
E
K
T
--
G
T
M
V
R
F
W
P
S
L
E
T
F
-
T
N
V
T
E
-
F
E
Y
E
I
L
A
K
R
L
R
E
L
S
F
L
N
S
G
V
S
I
R
L
R
D
K
R
-----
D
G
K
--
E
D
--------
H
F
H
Y
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
53
PsiBlast_CBE
52.33
55%
-69
- C2 -
4MB9
2
?
A:
[17-226]
----------
Q
V
L
E
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
S
T
D
-
G
A
G
L
H
H
L
V
W
E
I
V
D
N
A
V
D
E
A
L
S
G
F
G
D
R
I
D
V
T
I
N
K
D
G
S
L
T
V
Q
D
H
G
R
G
M
P
T
G
M
H
A
-
M
G
I
P
T
V
E
V
I
F
T
I
L
H
A
G
------------
G
L
H
G
V
G
S
S
V
V
N
A
L
S
S
W
L
E
V
E
I
T
R
D
G
A
V
Y
K
Q
R
F
E
N
G
G
-
K
P
V
T
T
L
K
-
K
-
I
G
T
-
A
L
K
-
S
K
T
--
G
T
K
V
T
F
M
P
D
A
T
I
F
-
S
T
T
-
D
-
F
K
Y
N
T
I
S
E
R
L
N
E
S
A
F
L
L
K
N
V
T
L
S
L
T
D
K
R
-----
T
D
E
A
I
E
F
--------
H
Y
E
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
54
PsiBlast_CBE
51.74
55%
-69
- C2 -
4LPB
1
?
A:
[17-226]
----------
Q
V
L
E
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
S
T
D
-
G
A
G
L
H
H
L
V
W
E
I
V
D
N
A
V
D
E
A
L
S
G
F
G
D
R
I
D
V
T
I
N
K
D
G
S
L
T
V
Q
D
H
G
R
G
M
P
T
G
M
H
A
-
M
G
I
P
T
V
E
V
I
F
T
I
L
H
A
-----------------
V
G
S
S
V
V
N
A
L
S
S
W
L
E
V
E
I
T
R
D
G
A
V
Y
K
Q
R
F
E
N
G
G
-
K
P
V
T
T
L
K
-
K
-
I
G
T
-
A
L
K
-
S
K
T
--
G
T
K
V
T
F
M
P
D
A
T
I
F
-
S
T
T
-
D
-
F
K
Y
N
T
I
S
E
R
L
N
E
S
A
F
L
L
K
N
V
T
L
S
L
T
D
K
R
-----
T
D
E
A
I
E
F
--------
H
Y
E
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
51.71
55%
-68
- C2 -
4EM7
1
?
A:
[17-226]
----------
Q
V
L
E
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
S
T
D
-
G
A
G
L
H
H
L
V
W
E
I
V
D
N
A
V
D
E
A
L
S
G
F
G
D
R
I
D
V
T
I
N
K
D
G
S
L
T
V
Q
D
H
G
R
G
M
P
T
G
M
H
A
-
M
G
I
P
T
V
E
V
I
F
T
I
L
H
A
-----------------
V
G
S
S
V
V
N
A
L
S
S
W
L
E
V
E
I
T
R
D
G
A
V
Y
K
Q
R
F
E
N
G
G
-
K
P
V
T
T
L
K
-
K
-
I
G
T
-
A
L
K
-
S
K
T
--
G
T
K
V
T
F
M
P
D
A
T
I
F
-
S
T
T
-
D
-
F
K
Y
N
T
I
S
E
R
L
N
E
S
A
F
L
L
K
N
V
T
L
S
L
T
D
K
R
-----
T
D
E
A
I
E
F
--------
H
Y
E
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
51
PsiBlast_CBE
51.55
55%
-69
- C2 -
4MOT
1
?
A:
[17-226]
----------
Q
V
L
E
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
S
T
D
-
G
A
G
L
H
H
L
V
W
E
I
V
D
N
A
V
D
E
A
L
S
G
F
G
D
R
I
D
V
T
I
N
K
D
G
S
L
T
V
Q
D
H
G
R
G
M
P
T
G
M
H
A
-
M
G
I
P
T
V
E
V
I
F
T
I
L
H
A
-----------------
V
G
S
S
V
V
N
A
L
S
S
W
L
E
V
E
I
T
R
D
G
A
V
Y
K
Q
R
F
E
N
G
G
-
K
P
V
T
T
L
K
-
K
-
I
G
T
-
A
L
K
-
S
K
T
--
G
T
K
V
T
F
M
P
D
A
T
I
F
-
S
T
T
-
D
-
F
K
Y
N
T
I
S
E
R
L
N
E
S
A
F
L
L
K
N
V
T
L
S
L
T
D
K
R
-----
T
D
E
A
I
E
F
--------
H
Y
E
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
50
PsiBlast_CBE
51.38
55%
-69
- C2 -
5BOD
1
?
A:
[17-226]
----------
Q
V
L
E
G
L
D
A
V
R
K
R
P
G
M
Y
I
G
S
T
D
-
G
A
G
L
H
H
L
V
W
E
I
V
D
N
A
V
D
E
A
L
S
G
F
G
D
R
I
D
V
T
I
N
K
D
G
S
L
T
V
Q
D
H
G
R
G
M
P
T
G
M
H
A
-
M
G
I
P
T
V
E
V
I
F
T
I
L
H
A
G
------------------
S
S
V
V
N
A
L
S
S
W
L
E
V
E
I
T
R
D
G
A
V
Y
K
Q
R
F
E
N
G
G
-
K
P
V
T
T
L
K
-
K
-
I
G
T
-
A
L
K
-
S
K
T
--
G
T
K
V
T
F
M
P
D
A
T
I
F
-
S
T
T
-
D
-
F
K
Y
N
T
I
S
E
R
L
N
E
S
A
F
L
L
K
N
V
T
L
S
L
T
D
K
R
-----
T
D
E
A
I
E
F
--------
H
Y
E
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
96
PsiBlast_CBE
51.00
55%
-60
- C2 -
4URM
1
?
A:
[25-219]
---------------
L
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
N
Q
I
E
V
V
I
E
K
D
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
Q
E
K
M
G
R
P
A
V
E
V
I
L
T
V
L
H
A
G
G
K
-------------
G
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
-
G
-
V
P
Q
F
D
L
K
-
E
-
V
G
--
T
-
T
-
D
K
T
--
G
T
V
I
R
F
K
A
D
G
E
I
F
-
T
E
T
-
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
N
V
R
E
--------
D
S
Y
H
Y
E
G
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
89
PsiBlast_CBE
49.85
55%
-66
- C2 -
4URO
2
GYRB_STAAU
D:
[25-219]
---------------
L
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
N
Q
I
E
V
V
I
E
K
D
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
------
P
A
V
E
V
I
L
T
V
--------------------
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
-
G
-
V
P
Q
F
D
L
K
-
E
-
V
G
--
T
-
T
-
D
K
T
--
G
T
V
I
R
F
K
A
D
G
E
I
F
-
T
E
T
-
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
N
V
R
E
--------
D
S
Y
H
Y
E
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
92
PsiBlast_CBE
48.78
55%
-58
- C2 -
4URO
1
GYRB_STAAU
A:
[26-219]
----------------
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
N
Q
I
E
V
V
I
E
K
D
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
Q
E
K
M
G
R
P
A
V
E
V
I
L
T
V
-------------------
G
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
-
G
-
V
P
Q
F
D
L
K
-
E
-
V
G
--
T
-
T
-
D
K
T
--
G
T
V
I
R
F
K
A
D
G
E
I
F
-
T
E
T
-
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
N
V
R
E
--------
D
S
Y
H
Y
E
G
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
90
PsiBlast_CBE
48.62
55%
-59
- C2 -
4URO
1
GYRB_STAAU
C:
[25-219]
---------------
L
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
N
Q
I
E
V
V
I
E
K
D
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
Q
E
K
M
G
R
P
A
V
E
V
I
L
T
---------------------
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
-
G
-
V
P
Q
F
D
L
K
-
E
-
V
G
--
T
-
T
-
D
K
T
--
G
T
V
I
R
F
K
A
D
G
E
I
F
-
T
E
T
-
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
N
V
R
E
--------
D
S
Y
H
Y
E
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
95
PsiBlast_CBE
48.59
55%
-62
- C2 -
4URM
1
?
B:
[25-219]
---------------
L
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
N
Q
I
E
V
V
I
E
K
D
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
Q
E
K
M
G
R
P
A
V
E
V
I
L
T
V
L
H
A
G
G
K
F
G
------------
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
-
G
-
V
P
Q
F
D
L
K
-
E
-
V
G
--
T
-
T
-
D
K
T
--
G
T
V
I
R
F
K
A
D
G
E
I
F
-
T
E
T
-
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
N
V
R
E
--------
D
S
Y
H
Y
E
G
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
91
PsiBlast_CBE
48.48
55%
-56
- C2 -
4URO
1
GYRB_STAAU
B:
[26-219]
----------------
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
N
Q
I
E
V
V
I
E
K
D
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
Q
E
K
M
G
R
P
A
V
E
V
I
L
T
V
--------------------
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
-
G
-
V
P
Q
F
D
L
K
-
E
-
V
G
--
T
-
T
-
D
K
T
--
G
T
V
I
R
F
K
A
D
G
E
I
F
-
T
E
T
-
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
N
V
R
E
--------
D
S
Y
H
Y
E
G
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
93
PsiBlast_CBE
48.35
55%
-61
- C2 -
4URM
1
?
D:
[26-219]
----------------
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
N
Q
I
E
V
V
I
E
K
D
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
Q
E
K
M
G
R
P
A
V
E
V
I
L
T
V
L
H
A
G
----------------
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
-
G
-
V
P
Q
F
D
L
K
-
E
-
V
G
--
T
-
T
-
D
K
T
--
G
T
V
I
R
F
K
A
D
G
E
I
F
-
T
E
T
-
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
N
V
R
E
--------
D
S
Y
H
Y
E
G
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
94
PsiBlast_CBE
48.05
55%
-63
- C2 -
4URM
2
?
C:
[25-219]
---------------
L
E
A
A
R
K
R
P
G
M
Y
I
G
S
T
S
E
-
R
G
L
H
H
L
V
W
E
I
V
D
N
S
I
D
E
A
L
A
G
Y
A
N
Q
I
E
V
V
I
E
K
D
N
W
I
K
V
T
D
N
G
R
G
I
P
V
D
I
Q
E
K
M
G
R
P
A
V
E
V
I
L
T
V
L
H
A
G
----------------
V
G
S
S
V
V
N
A
L
S
Q
D
L
E
V
Y
V
H
R
N
E
T
I
Y
H
Q
A
Y
K
K
-
G
-
V
P
Q
F
D
L
K
-
E
-
V
G
--
T
-
T
-
D
K
T
--
G
T
V
I
R
F
K
A
D
G
E
I
F
-
T
E
T
-
T
V
Y
N
Y
E
T
L
Q
Q
R
I
R
E
L
A
F
L
N
K
G
I
Q
I
T
L
R
D
E
R
-----
D
E
E
N
V
R
E
--------
D
S
Y
H
Y
E
G
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
76
PsiBlast_CBE
46.71
48%
-69
- C2 -
4BAE
2
GYRB_MYCSM
B:
[4-203]
--------------
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
G
E
-
R
G
L
H
H
L
I
W
E
V
V
D
N
A
V
D
E
A
M
A
G
F
A
T
R
V
D
V
K
I
H
A
D
G
S
V
E
V
R
D
D
G
R
G
I
P
V
E
M
H
A
T
-
G
M
P
T
I
D
V
V
M
T
Q
L
------------------
G
V
G
V
S
V
V
N
A
L
S
T
R
L
E
A
T
V
L
R
D
G
Y
E
W
F
Q
Y
Y
D
----
R
S
V
P
G
K
L
-
K
-
Q
G
G
-
E
-
T
-
K
E
T
--
G
T
T
I
R
F
W
A
D
P
E
I
F
-
E
T
T
-
D
-
Y
N
F
E
T
V
A
R
R
L
Q
E
M
A
F
L
N
K
G
L
T
I
E
L
T
D
E
R
-----
D
G
K
H
R
V
F
--------
H
Y
P
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
73
PsiBlast_CBE
45.49
52%
-53
- C2 -
4URN
1
?
C:
[19-222]
--------------
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
D
K
-
R
G
L
H
H
L
V
Y
E
I
V
D
N
S
V
D
E
V
L
N
G
Y
G
N
E
I
D
V
T
I
N
K
D
G
S
I
S
I
E
D
N
G
R
G
M
P
T
G
I
H
K
S
-
G
K
P
T
V
E
V
I
F
T
V
L
--------------------
G
A
S
V
V
N
A
L
S
E
W
L
E
V
E
I
H
R
D
G
N
I
Y
H
Q
S
F
K
N
-
G
-
G
S
P
S
S
G
L
-
V
-
K
K
G
-
K
-
T
-
K
K
T
--
G
T
K
V
T
F
K
P
D
D
T
I
F
K
A
S
T
-
S
-
F
N
F
D
V
L
S
E
R
L
Q
E
S
A
F
L
L
K
N
L
K
I
T
L
N
D
L
R
-----
S
G
K
E
R
Q
E
--------
H
Y
H
Y
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
75
PsiBlast_CBE
45.32
52%
-61
- C2 -
4URN
1
?
A:
[17-222]
------------
L
E
G
L
E
A
V
R
K
R
P
G
M
Y
I
G
S
T
D
K
-
R
G
L
H
H
L
V
Y
E
I
V
D
N
S
V
D
E
V
L
N
G
Y
G
N
E
I
D
V
T
I
N
K
D
G
S
I
S
I
E
D
N
G
R
G
M
P
T
G
I
H
K
S
-
G
K
P
T
V
E
V
I
F
T
V
L
-------------------
V
G
A
S
V
V
N
A
L
S
E
W
L
E
V
E
I
H
R
D
G
N
I
Y
H
Q
S
F
K
N
-
G
-
G
S
P
S
S
G
L
-
V
-
K
K
G
-
K
-
T
-
K
K
T
--
G
T
K
V
T
F
K
P
D
D
T
I
F
K
A
S
T
-
S
-
F
N
F
D
V
L
S
E
R
L
Q
E
S
A
F
L
L
K
N
L
K
I
T
L
N
D
L
R
-----
S
G
K
E
R
Q
E
--------
H
Y
H
Y
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
74
PsiBlast_CBE
45.20
52%
-53
- C2 -
4URN
2
?
B:
[32-222]
---------------------------
G
S
T
D
K
-
R
G
L
H
H
L
V
Y
E
I
V
D
N
S
V
D
E
V
L
N
G
Y
G
N
E
I
D
V
T
I
N
K
D
G
S
I
S
I
E
D
N
G
R
G
M
P
T
G
I
H
K
S
-
G
K
P
T
V
E
V
I
F
T
V
L
------------------
G
V
G
A
S
V
V
N
A
L
S
E
W
L
E
V
E
I
H
R
D
G
N
I
Y
H
Q
S
F
K
N
-
G
-
G
S
P
S
S
G
L
-
V
-
K
K
G
-
K
-
T
-
K
K
T
--
G
T
K
V
T
F
K
P
D
D
T
I
F
K
A
S
T
-
S
-
F
N
F
D
V
L
S
E
R
L
Q
E
S
A
F
L
L
K
N
L
K
I
T
L
N
D
L
R
-----
S
G
K
E
R
Q
E
--------
H
Y
H
Y
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
63
PsiBlast_CBE
43.01
33%
-57
- C2 -
4KQV
2
?
B:
[8-217]
--------
S
I
E
V
L
T
G
L
D
P
V
K
K
R
P
G
M
Y
T
N
I
E
N
P
----
N
H
L
I
Q
E
I
I
D
N
S
V
D
E
V
L
A
G
F
A
S
K
I
N
I
T
L
Y
E
D
N
S
I
E
V
A
D
D
G
R
G
M
P
V
D
I
H
P
E
H
K
M
S
G
I
E
L
I
M
T
K
L
H
S
G
G
K
--------------
V
G
V
S
V
V
N
A
L
S
T
R
L
E
A
E
I
K
R
D
G
N
V
Y
H
I
V
F
E
D
-
G
-
F
K
T
K
D
L
E
-
I
-
I
D
--
N
-
V
-
G
K
K
N
T
G
T
K
I
R
F
W
P
N
K
K
Y
F
-
D
D
I
-
K
-
V
N
F
K
A
L
K
N
L
L
E
A
K
A
I
L
C
K
A
L
T
I
K
Y
S
N
E
I
-----
K
K
E
K
L
T
W
--------
H
F
E
T
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
139
Fugue
40.63
52%
-47
- C2 -
1EI1
1
GYRB_ECOLI
A:
[220-391]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
I
K
-
A
F
V
E
Y
L
N
K
N
K
T
P
I
-
H
P
-
N
I
F
Y
F
S
T
E
K
D
G
I
G
V
E
V
A
L
Q
W
N
D
G
F
-
Q
E
N
I
Y
-
C
F
T
N
N
I
P
Q
R
D
G
G
T
H
L
A
G
F
R
A
A
M
T
R
T
L
N
A
Y
M
D
K
E
G
Y
S
K
K
A
K
V
S
A
T
G
D
D
A
R
E
G
L
I
A
V
V
S
V
K
V
P
D
P
--
K
F
S
S
Q
T
K
D
K
L
V
S
S
E
V
K
S
A
V
E
Q
Q
M
N
E
L
L
A
E
Y
L
L
E
N
P
T
D
A
K
I
V
V
G
K
I
I
D
A
A
R
A
R
E
A
A
R
R
A
R
E
M
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------