@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 : PA0999: (2016-01-25 )
MGNPILAGLGFSLPKRQVSNHDLVGRINTSDEFIVERTGVRTRYHVEPEQAVSALMVPAARQAIEAAGLLPEDIDLLLVNTLSPDHHDPSQACLIQPLLGLRHIPVLDIRAQCSGLLYGLQMARGQILAGLARHVLVVCGEVLSKRMDCSDRGRNLSILLGDGAGAVVVSAGESLEDGLLDLRLGADGNYFDLLMTAAPGSASPTFLDENVLREGGGEFLMRGRPMFEHASQTLVRIAGEMLAAHELTLDDIDHVICHQPNLRILDAVQEQLGIPQHKFAVTVDRLGNMASASTPVTLAMFWPDIQPGQRVLVLTYGSGATWGAALYRKPEEVNRPC
Atome Classification :
(21 SA)
.........10........20...---.....30........40........50..-----......60........70........80........90........100.......110.......120.......130.......140.......150.......160.......170-.......180.......190.......200.......210.......220.......230.......240.......250.......260.......270.......--280.......290......--.300-...--....------.310.......320.......330.....
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MGNPILAGLGFSL
P
K
RQVSNHD
L
V
---
G
R
INTSD
E
F
I
V
ERTGV
R
T
R
Y
HV
E
P
E
Q
A
V
S
-----
A
L
M
V
P
A
A
R
Q
A
I
E
A
AGLLPED
I
D
L
L
L
V
NTLSPDHHDP
S
Q
A
C
L
I
Q
P
L
L
GLRHIPV
L
D
I
R
A
Q
C
S
G
L
L
Y
G
L
Q
MAR
G
Q
I
L
A
G
L
A
R
H
V
L
V
V
C
G
E
V
L
S
K
RMDCSDRGR
N
L
S
I
L
L
GDGA
G
A
V
V
V
SAG-ESLEDG
L
L
D
L
R
LGADG
N
Y
F
D
L
L
M
TAAPGSASPT
F
L
D
E
N
V
L
R
EGGG
E
F
L
MRGR
P
M
F
E
H
A
S
Q
T
L
V
R
I
A
G
E
M
L
A
A
HEL
T
L
D
DI
D
H
V
ICHQPN
L
R
I
L
D
A
V
Q
E
Q
LGIPQH
K
F
--
A
V
T
V
D
RLGNMASAST
P
V
T
L
--
A
M
F--WPD--IQPG------
Q
R
V
L
V
L
T
YGSGAT
W
G
A
A
L
YRK
P
E
E
VNRPC
83
HHSearch
98.24
100%
-134
- C1 -
3H78
1
PQSD_PSEAE
A:
[24-352]
-
G
N
P
I
L
A
G
L
G
F
S
L
P
K
R
Q
V
S
N
H
D
L
V
---
G
R
I
N
T
S
D
E
F
I
V
E
R
T
G
V
R
T
R
Y
H
V
E
P
E
Q
A
V
S
-----
A
L
M
V
P
A
A
R
Q
A
I
E
A
A
G
L
L
P
E
D
I
D
L
L
L
V
N
T
L
S
P
D
H
H
D
P
S
Q
A
C
L
I
Q
P
L
L
G
L
R
H
I
P
V
L
D
I
R
A
Q
A
S
G
L
L
Y
G
L
Q
M
A
R
G
Q
I
L
A
G
L
A
R
H
V
L
V
V
C
G
E
V
L
S
K
R
M
D
C
S
D
R
G
R
N
L
S
I
L
L
G
D
G
A
G
A
V
V
V
S
A
G
-
E
S
L
E
D
G
L
L
D
L
R
L
G
A
D
G
N
Y
F
D
L
L
M
T
A
A
P
G
S
A
S
P
T
F
L
D
E
N
V
L
R
E
G
G
G
E
F
L
M
R
G
R
P
M
F
E
H
A
S
Q
T
L
V
R
I
A
G
E
M
L
A
A
H
E
L
T
L
D
D
I
D
H
V
I
C
H
Q
P
N
L
R
I
L
D
A
V
Q
E
Q
L
G
I
P
Q
H
K
F
--
A
V
T
V
D
R
L
G
N
M
A
S
A
S
T
P
V
T
L
--
A
M
F
--
W
P
D
--
I
Q
P
G
------
Q
R
V
L
V
L
T
Y
G
S
G
A
T
W
G
A
A
L
Y
R
K
P
-------
2
PsiBlast_PDB
98.03
99%
-134
- C1 -
3H78
1
PQSD_PSEAE
A:
[24-352]
-
G
N
P
I
L
A
G
L
G
F
S
L
P
K
R
Q
V
S
N
H
D
L
V
---
G
R
I
N
T
S
D
E
F
I
V
E
R
T
G
V
R
T
R
Y
H
V
E
P
E
Q
A
V
S
-----
A
L
M
V
P
A
A
R
Q
A
I
E
A
A
G
L
L
P
E
D
I
D
L
L
L
V
N
T
L
S
P
D
H
H
D
P
S
Q
A
C
L
I
Q
P
L
L
G
L
R
H
I
P
V
L
D
I
R
A
Q
A
S
G
L
L
Y
G
L
Q
M
A
R
G
Q
I
L
A
G
L
A
R
H
V
L
V
V
C
G
E
V
L
S
K
R
M
D
C
S
D
R
G
R
N
L
S
I
L
L
G
D
G
A
G
A
V
V
V
S
A
G
-
E
S
L
E
D
G
L
L
D
L
R
L
G
A
D
G
N
Y
F
D
L
L
M
T
A
A
P
G
S
A
S
P
T
F
L
D
E
N
V
L
R
E
G
G
G
E
F
L
M
R
G
R
P
M
F
E
H
A
S
Q
T
L
V
R
I
A
G
E
M
L
A
A
H
E
L
T
L
D
D
I
D
H
V
I
C
H
Q
P
N
L
R
I
L
D
A
V
Q
E
Q
L
G
I
P
Q
H
K
F
--
A
V
T
V
D
R
L
G
N
M
A
S
A
S
T
P
V
T
L
--
A
M
F
--
W
P
D
--
I
Q
P
G
------
Q
R
V
L
V
L
T
Y
G
S
G
A
T
W
G
A
A
L
Y
R
K
P
-------
1
PsiBlast_PDB
96.07
100%
-135
- C1 -
3H76
-
PQSD_PSEAE
A:
[1-329]
-
G
N
P
I
L
A
G
L
G
F
S
L
P
K
R
Q
V
S
N
H
D
L
V
---
G
R
I
N
T
S
D
E
F
I
V
E
R
T
G
V
R
T
R
Y
H
V
E
P
E
Q
A
V
S
-----
A
L
M
V
P
A
A
R
Q
A
I
E
A
A
G
L
L
P
E
D
I
D
L
L
L
V
N
T
L
S
P
D
H
H
D
P
S
Q
A
C
L
I
Q
P
L
L
G
L
R
H
I
P
V
L
D
I
R
A
Q
C
S
G
L
L
Y
G
L
Q
M
A
R
G
Q
I
L
A
G
L
A
R
H
V
L
V
V
C
G
E
V
L
S
K
R
M
D
C
S
D
R
G
R
N
L
S
I
L
L
G
D
G
A
G
A
V
V
V
S
A
G
-
E
S
L
E
D
G
L
L
D
L
R
L
G
A
D
G
N
Y
F
D
L
L
M
T
A
A
P
G
S
A
S
P
T
F
L
D
E
N
V
L
R
E
G
G
G
E
F
L
M
R
G
R
P
M
F
E
H
A
S
Q
T
L
V
R
I
A
G
E
M
L
A
A
H
E
L
T
L
D
D
I
D
H
V
I
C
H
Q
P
N
L
R
I
L
D
A
V
Q
E
Q
L
G
I
P
Q
H
K
F
--
A
V
T
V
D
R
L
G
N
M
A
S
A
S
T
P
V
T
L
--
A
M
F
--
W
P
D
--
I
Q
P
G
------
Q
R
V
L
V
L
T
Y
G
S
G
A
T
W
G
A
A
L
Y
R
K
P
-------
21
PsiBlast_CBE
95.89
99%
-134
- C1 -
3H78
2
PQSD_PSEAE
B:
[24-352]
-
G
N
P
I
L
A
G
L
G
F
S
L
P
K
R
Q
V
S
N
H
D
L
V
---
G
R
I
N
T
S
D
E
F
I
V
E
R
T
G
V
R
T
R
Y
H
V
E
P
E
Q
A
V
S
-----
A
L
M
V
P
A
A
R
Q
A
I
E
A
A
G
L
L
P
E
D
I
D
L
L
L
V
N
T
L
S
P
D
H
H
D
P
S
Q
A
C
L
I
Q
P
L
L
G
L
R
H
I
P
V
L
D
I
R
A
Q
A
S
G
L
L
Y
G
L
Q
M
A
R
G
Q
I
L
A
G
L
A
R
H
V
L
V
V
C
G
E
V
L
S
K
R
M
D
C
S
D
R
G
R
N
L
S
I
L
L
G
D
G
A
G
A
V
V
V
S
A
G
-
E
S
L
E
D
G
L
L
D
L
R
L
G
A
D
G
N
Y
F
D
L
L
M
T
A
A
P
G
S
A
S
P
T
F
L
D
E
N
V
L
R
E
G
G
G
E
F
L
M
R
G
R
P
M
F
E
H
A
S
Q
T
L
V
R
I
A
G
E
M
L
A
A
H
E
L
T
L
D
D
I
D
H
V
I
C
H
Q
P
N
L
R
I
L
D
A
V
Q
E
Q
L
G
I
P
Q
H
K
F
--
A
V
T
V
D
R
L
G
N
M
A
S
A
S
T
P
V
T
L
--
A
M
F
--
W
P
D
--
I
Q
P
G
------
Q
R
V
L
V
L
T
Y
G
S
G
A
T
W
G
A
A
L
Y
R
K
P
-------
7
PsiBlast_PDB
78.97
39%
-123
- C1 -
2EFT
3
FABH_ECOLI
A:
[5-316]
-----
I
I
G
T
G
S
Y
L
P
E
Q
V
R
T
N
A
D
L
E
---
K
M
V
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
H
I
A
A
P
N
E
T
V
S
-----
T
M
G
F
E
A
A
T
R
A
I
E
M
A
G
I
E
K
D
Q
I
G
L
I
V
V
A
T
T
S
A
T
H
A
F
P
S
A
A
C
Q
I
Q
S
M
L
G
I
K
G
C
P
A
F
D
V
A
A
A
C
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
Y
A
L
V
V
G
S
D
V
L
A
R
T
C
D
P
T
D
R
G
T
--
I
I
I
F
G
D
G
A
G
A
A
V
L
A
A
S
-
E
--
E
P
G
I
I
S
T
H
L
H
A
D
G
S
Y
G
E
L
L
T
L
P
N
A
D
R
V
N
P
----
E
N
S
I
H
-----
L
T
M
A
G
N
E
V
F
K
V
A
V
T
E
L
A
H
I
V
D
E
T
L
A
A
N
N
L
D
R
S
Q
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
S
M
D
N
V
--
V
V
T
L
D
R
H
G
N
T
S
A
A
S
V
P
C
A
L
--
D
E
A
--
V
R
D
GR
I
K
P
G
------
Q
L
V
L
L
E
A
F
G
G
G
F
T
W
G
S
A
L
V
R
F
--------
6
PsiBlast_PDB
77.78
39%
-137
- C1 -
1HNK
-
FABH_ECOLI
A:
[5-316]
-----
I
I
G
T
G
S
Y
L
P
E
Q
V
R
T
N
A
D
L
E
---
K
M
V
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
H
I
A
A
P
N
E
T
V
S
-----
T
M
G
F
E
A
A
T
R
A
I
E
M
A
G
I
E
K
D
Q
I
G
L
I
V
V
A
T
T
S
---
A
F
P
S
A
A
C
Q
I
Q
S
M
L
G
I
K
G
C
P
A
F
D
V
A
A
A
C
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
Y
A
L
V
V
G
S
D
V
L
A
R
T
-------
T
--
I
I
I
F
G
D
G
A
G
A
A
V
L
A
A
S
-
E
--
E
P
G
I
I
S
T
H
L
H
A
D
G
S
------------------------------------------
T
E
L
A
H
I
V
D
E
T
L
A
A
N
N
L
D
R
S
Q
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
S
M
D
N
V
--
V
V
T
L
D
R
H
G
N
T
S
A
A
S
V
P
C
A
L
--
D
E
A
--
V
R
D
GR
I
K
P
G
------
Q
L
V
L
L
E
A
F
---
F
T
W
G
S
A
L
V
R
F
--------
8
PsiBlast_PDB
77.54
39%
-122
- C1 -
2GYO
3
FABH_ECOLI
A:
[5-316]
-----
I
I
G
T
G
S
Y
L
P
E
Q
V
R
T
N
A
D
L
E
---
K
M
V
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
H
I
A
A
P
N
E
T
V
S
-----
T
M
G
F
E
A
A
T
R
A
I
E
M
A
G
I
E
K
D
Q
I
G
L
I
V
V
A
T
T
S
A
T
H
A
F
P
S
A
A
C
Q
I
Q
S
M
L
G
I
K
G
C
P
A
F
D
V
A
A
A
C
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
Y
A
L
V
V
G
S
D
V
L
A
R
T
C
D
P
T
D
R
G
T
--
I
I
I
F
G
D
G
A
G
A
A
V
L
A
A
S
-
E
--
E
P
G
I
I
S
T
H
L
H
A
D
G
S
Y
G
E
L
L
T
L
P
N
A
D
R
V
N
P
----
E
N
S
I
H
-----
L
T
M
A
G
N
E
V
F
K
V
A
V
T
E
L
A
H
I
V
D
E
T
L
A
A
N
N
L
D
R
S
Q
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
S
M
D
N
V
--
V
V
T
L
D
R
H
G
N
T
S
A
A
S
V
P
C
A
L
--
D
E
A
--
V
R
D
GR
I
K
P
G
------
Q
L
V
L
L
E
A
F
G
G
G
F
T
W
G
S
A
L
V
R
F
--------
9
PsiBlast_PDB
77.52
39%
-120
- C1 -
3IL9
-
FABH_ECOLI
A:
[5-316]
-----
I
I
G
T
G
S
Y
L
P
E
Q
V
R
T
N
A
D
L
E
---
K
M
V
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
H
I
A
A
P
N
E
T
V
S
-----
T
M
G
F
E
A
A
T
R
A
I
E
M
A
G
I
E
K
D
Q
I
G
L
I
V
V
A
T
T
S
A
T
H
A
F
P
S
A
A
C
Q
I
Q
S
M
L
G
I
K
G
C
P
A
F
D
V
A
A
A
-
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
Y
A
L
V
V
G
S
D
V
L
A
R
T
C
D
P
T
D
R
G
T
--
I
I
I
F
G
D
G
A
G
A
A
V
L
A
A
S
-
E
--
E
P
G
I
I
S
T
H
L
H
A
D
G
S
Y
G
E
L
L
T
L
P
N
A
D
R
V
N
P
----
E
N
S
I
H
-----
L
T
M
A
G
N
E
V
F
K
V
A
V
T
E
L
A
H
I
V
D
E
T
L
A
A
N
N
L
D
R
S
Q
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
S
M
D
N
V
--
V
V
T
L
D
R
H
G
N
T
S
A
A
S
V
P
C
A
L
--
D
E
A
--
V
R
D
GR
I
K
P
G
------
Q
L
V
L
L
E
A
F
G
G
G
F
T
W
G
S
A
L
V
R
F
--------
82
HHSearch
77.18
37%
-123
- C1 -
2EBD
-
FABH_AQUAE
A:
[1-309]
-
M
G
T
K
I
I
G
T
G
V
Y
L
P
K
N
V
L
T
N
F
D
L
E
---
K
I
V
D
T
S
D
E
W
I
T
T
R
T
G
I
K
E
R
R
I
A
K
-
E
E
T
I
T
-----
Y
M
A
T
Q
A
A
K
E
A
L
R
E
A
N
L
S
P
E
E
L
D
L
I
I
L
A
T
L
T
P
Q
K
R
F
P
S
T
A
C
L
V
Q
A
Q
L
K
A
K
G
V
Y
A
F
D
I
S
A
A
C
S
G
F
I
Y
A
L
D
I
A
D
S
F
I
K
S
G
K
A
K
N
V
L
V
I
G
A
E
K
L
S
E
A
V
D
W
E
D
R
S
--
T
C
V
L
F
G
D
G
A
G
A
V
V
V
T
R
S
-
E
-
D
K
S
D
I
L
A
T
R
M
Y
A
E
G
S
L
E
E
L
L
H
A
D
N
C
-----------------
G
Y
I
R
M
K
G
R
E
L
F
K
V
A
V
R
S
M
E
E
V
C
R
E
V
L
E
K
A
G
V
K
P
E
E
V
S
L
V
I
P
H
Q
A
N
V
R
I
I
N
A
L
A
E
K
L
N
I
P
K
E
K
V
--
F
V
N
I
Q
K
Y
G
N
T
S
A
A
S
I
P
I
A
L
--
H
E
A
I
K
E
G
K
--
V
K
R
G
------
D
L
I
L
M
T
A
M
G
G
G
L
T
W
G
A
V
L
L
R
Y
--------
4
PsiBlast_PDB
76.89
39%
-121
- C1 -
1HND
1
FABH_ECOLI
A:
[5-316]
-----
I
I
G
T
G
S
Y
L
P
E
Q
V
R
T
N
A
D
L
E
---
K
M
V
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
H
I
A
A
P
N
E
T
V
S
-----
T
M
G
F
E
A
A
T
R
A
I
E
M
A
G
I
E
K
D
Q
I
G
L
I
V
V
A
T
T
S
A
T
H
A
F
P
S
A
A
C
Q
I
Q
S
M
L
G
I
K
G
C
P
A
F
D
V
A
A
A
C
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
Y
A
L
V
V
G
S
D
V
L
A
R
T
C
D
P
T
D
R
G
T
--
I
I
I
F
G
D
G
A
G
A
A
V
L
A
A
S
-
E
--
E
P
G
I
I
S
T
H
L
H
A
D
G
S
Y
G
E
L
L
T
L
P
N
A
D
R
V
N
P
----
E
N
S
I
H
-----
L
T
M
A
G
N
E
V
F
K
V
A
V
T
E
L
A
H
I
V
D
E
T
L
A
A
N
N
L
D
R
S
Q
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
S
M
D
N
V
--
V
V
T
L
D
R
H
G
N
T
S
A
A
S
V
P
C
A
L
--
D
E
A
--
V
R
D
GR
I
K
P
G
------
Q
L
V
L
L
E
A
F
G
G
G
F
T
W
G
S
A
L
V
R
F
--------
5
PsiBlast_PDB
76.75
39%
-122
- C1 -
1HNJ
2
FABH_ECOLI
A:
[5-316]
-----
I
I
G
T
G
S
Y
L
P
E
Q
V
R
T
N
A
D
L
E
---
K
M
V
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
H
I
A
A
P
N
E
T
V
S
-----
T
M
G
F
E
A
A
T
R
A
I
E
M
A
G
I
E
K
D
Q
I
G
L
I
V
V
A
T
T
S
A
T
H
A
F
P
S
A
A
C
Q
I
Q
S
M
L
G
I
K
G
C
P
A
F
D
V
A
A
A
C
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
Y
A
L
V
V
G
S
D
V
L
A
R
T
C
D
P
T
D
R
G
T
--
I
I
I
F
G
D
G
A
G
A
A
V
L
A
A
S
-
E
--
E
P
G
I
I
S
T
H
L
H
A
D
G
S
Y
G
E
L
L
T
L
P
N
A
D
R
V
N
P
----
E
N
S
I
H
-----
L
T
M
A
G
N
E
V
F
K
V
A
V
T
E
L
A
H
I
V
D
E
T
L
A
A
N
N
L
D
R
S
Q
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
S
M
D
N
V
--
V
V
T
L
D
R
H
G
N
T
S
A
A
S
V
P
C
A
L
--
D
E
A
--
V
R
D
GR
I
K
P
G
------
Q
L
V
L
L
E
A
F
G
G
G
F
T
W
G
S
A
L
V
R
F
--------
13
PsiBlast_PDB
76.67
37%
-127
- C1 -
4YLT
-
FABH_YERPE
A:
[7-315]
-------
G
T
G
S
Y
L
P
V
Q
V
R
S
N
A
D
L
E
---
K
M
V
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
R
I
A
G
L
D
E
T
V
A
-----
T
M
G
F
Q
A
A
E
K
A
L
E
M
A
G
I
D
K
D
D
I
G
L
I
I
V
A
T
T
S
S
S
H
A
F
P
S
S
A
C
Q
V
Q
R
M
L
G
I
K
D
A
A
S
F
D
L
A
A
A
C
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
H
A
I
V
I
G
S
D
V
L
S
R
A
L
D
P
E
D
R
G
--
T
I
I
L
F
G
D
G
A
G
A
V
V
L
G
A
S
-
E
--
Q
P
G
I
M
S
T
H
L
H
A
D
G
R
Y
G
E
L
L
A
L
P
Y
P
----
P
A
Y
V
------------
T
M
A
G
N
E
V
F
K
V
A
V
T
E
L
A
H
I
V
D
E
T
L
Q
V
N
N
L
D
R
T
A
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
G
M
D
K
V
--
V
I
T
L
D
R
H
G
N
T
S
A
A
S
V
P
S
A
F
--
D
E
A
--
V
R
D
GR
I
Q
R
G
------
Q
L
V
L
L
E
A
F
G
G
G
F
T
W
G
S
A
L
V
R
F
--------
24
PsiBlast_CBE
76.36
39%
-122
- C1 -
1HN9
1
FABH_ECOLI
B:
[5-316]
-----
I
I
G
T
G
S
Y
L
P
E
Q
V
R
T
N
A
D
L
E
---
K
M
V
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
H
I
A
A
P
N
E
T
V
S
-----
T
M
G
F
E
A
A
T
R
A
I
E
M
A
G
I
E
K
D
Q
I
G
L
I
V
V
A
T
T
S
A
T
H
A
F
P
S
A
A
C
Q
I
Q
S
M
L
G
I
K
G
C
P
A
F
D
V
A
A
A
C
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
Y
A
L
V
V
G
S
D
V
L
A
R
T
C
D
P
T
D
R
G
T
--
I
I
I
F
G
D
G
A
G
A
A
V
L
A
A
S
-
E
--
E
P
G
I
I
S
T
H
L
H
A
D
G
S
Y
G
E
L
L
T
L
P
N
A
D
R
V
N
P
----
E
N
S
I
H
-----
L
T
M
A
G
N
E
V
F
K
V
A
V
T
E
L
A
H
I
V
D
E
T
L
A
A
N
N
L
D
R
S
Q
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
S
M
D
N
V
--
V
V
T
L
D
R
H
G
N
T
S
A
A
S
V
P
C
A
L
--
D
E
A
--
V
R
D
GR
I
K
P
G
------
Q
L
V
L
L
E
A
F
G
G
G
F
T
W
G
S
A
L
V
R
F
--------
22
PsiBlast_CBE
76.14
39%
-122
- C1 -
2GYO
3
FABH_ECOLI
B:
[5-316]
-----
I
I
G
T
G
S
Y
L
P
E
Q
V
R
T
N
A
D
L
E
---
K
M
V
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
H
I
A
A
P
N
E
T
V
S
-----
T
M
G
F
E
A
A
T
R
A
I
E
M
A
G
I
E
K
D
Q
I
G
L
I
V
V
A
T
T
S
A
T
H
A
F
P
S
A
A
C
Q
I
Q
S
M
L
G
I
K
G
C
P
A
F
D
V
A
A
A
C
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
Y
A
L
V
V
G
S
D
V
L
A
R
T
C
D
P
T
D
R
G
T
--
I
I
I
F
G
D
G
A
G
A
A
V
L
A
A
S
-
E
--
E
P
G
I
I
S
T
H
L
H
A
D
G
S
Y
G
E
L
L
T
L
P
N
A
D
R
V
N
P
----
E
N
S
I
H
-----
L
T
M
A
G
N
E
V
F
K
V
A
V
T
E
L
A
H
I
V
D
E
T
L
A
A
N
N
L
D
R
S
Q
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
S
M
D
N
V
--
V
V
T
L
D
R
H
G
N
T
S
A
A
S
V
P
C
A
L
--
D
E
A
--
V
R
D
GR
I
K
P
G
------
Q
L
V
L
L
E
A
F
G
G
G
F
T
W
G
S
A
L
V
R
F
--------
72
HHSearch
75.59
40%
-117
- C1 -
1HNJ
2
FABH_ECOLI
A:
[1-317]
-
M
Y
T
K
I
I
G
T
G
S
Y
L
P
E
Q
V
R
T
N
A
D
L
E
---
K
M
V
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
H
I
A
A
P
N
E
T
V
S
-----
T
M
G
F
E
A
A
T
R
A
I
E
M
A
G
I
E
K
D
Q
I
G
L
I
V
V
A
T
T
S
A
T
H
A
F
P
S
A
A
C
Q
I
Q
S
M
L
G
I
K
G
C
P
A
F
D
V
A
A
A
C
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
Y
A
L
V
V
G
S
D
V
L
A
R
T
C
D
P
T
D
R
G
--
T
I
I
I
F
G
D
G
A
G
A
A
V
L
A
A
S
-
E
--
E
P
G
I
I
S
T
H
L
H
A
D
G
S
Y
G
E
L
L
T
L
P
N
A
D
R
V
N
P
E
---------
N
S
I
H
L
T
M
A
G
N
E
V
F
K
V
A
V
T
E
L
A
H
I
V
D
E
T
L
A
A
N
N
L
D
R
S
Q
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
S
M
D
N
V
--
V
V
T
L
D
R
H
G
N
T
S
A
A
S
V
P
C
A
L
--
D
E
A
V
R
D
G
R
--
I
K
P
G
------
Q
L
V
L
L
E
A
F
G
G
G
F
T
W
G
S
A
L
V
R
F
--------
14
PsiBlast_PDB
75.48
37%
-126
- C1 -
4Z19
2
FABH_YERPE
A:
[7-315]
-------
G
T
G
S
Y
L
P
V
Q
V
R
S
N
A
D
L
E
---
K
M
V
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
R
I
A
G
L
D
E
T
V
A
-----
T
M
G
F
Q
A
A
E
K
A
L
E
M
A
G
I
D
K
D
D
I
G
L
I
I
V
A
T
T
S
S
S
H
A
F
P
S
S
A
C
Q
V
Q
R
M
L
G
I
K
D
A
A
S
F
D
L
A
A
A
-
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
H
A
I
V
I
G
S
D
V
L
S
R
A
L
D
P
E
D
R
G
--
T
I
I
L
F
G
D
G
A
G
A
V
V
L
G
A
S
-
E
--
Q
P
G
I
M
S
T
H
L
H
A
D
G
R
Y
G
E
L
L
A
L
P
Y
P
-----
A
Y
V
------------
T
M
A
G
N
E
V
F
K
V
A
V
T
E
L
A
H
I
V
D
E
T
L
Q
V
N
N
L
D
R
T
A
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
G
M
D
K
V
--
V
I
T
L
D
R
H
G
N
T
S
A
A
S
V
P
S
A
F
--
D
E
A
--
V
R
D
GR
I
Q
R
G
------
Q
L
V
L
L
E
A
F
G
G
G
F
T
W
G
S
A
L
V
R
F
--------
10
PsiBlast_PDB
75.16
39%
-122
- C1 -
1EBL
1
FABH_ECOLI
A:
[7-316]
-------
G
T
G
S
Y
L
P
E
Q
V
R
T
N
A
D
L
E
---
K
M
V
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
H
I
A
A
P
N
E
T
V
S
-----
T
M
G
F
E
A
A
T
R
A
I
E
M
A
G
I
E
K
D
Q
I
G
L
I
V
V
A
T
T
S
A
T
H
A
F
P
S
A
A
C
Q
I
Q
S
M
L
G
I
K
G
C
P
A
F
D
V
A
A
A
C
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
Y
A
L
V
V
G
S
D
V
L
A
R
T
C
D
P
T
D
R
G
--
T
I
I
I
F
G
D
G
A
G
A
A
V
L
A
A
S
-
E
--
E
P
G
I
I
S
T
H
L
H
A
D
G
S
Y
G
E
L
L
T
L
P
N
A
D
R
V
N
P
----
E
N
S
I
H
-----
L
T
M
A
G
N
E
V
F
K
V
A
V
T
E
L
A
H
I
V
D
E
T
L
A
A
N
N
N
D
R
S
Q
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
S
M
D
N
V
--
V
V
T
L
D
R
H
G
N
T
S
A
A
S
V
P
C
A
L
--
D
E
A
--
V
R
D
GR
I
K
P
G
------
Q
L
V
L
L
E
A
F
G
G
G
F
T
W
G
S
A
L
V
R
F
--------
23
PsiBlast_CBE
75.06
39%
-124
- C1 -
2EFT
4
FABH_ECOLI
B:
[5-316]
-----
I
I
G
T
G
S
Y
L
P
E
Q
V
R
T
N
A
D
L
E
---
K
M
V
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
H
I
A
A
P
N
E
T
V
S
-----
T
M
G
F
E
A
A
T
R
A
I
E
M
A
G
I
E
K
D
Q
I
G
L
I
V
V
A
T
T
S
A
T
H
A
F
P
S
A
A
C
Q
I
Q
S
M
L
G
I
K
G
C
P
A
F
D
V
A
A
A
C
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
Y
A
L
V
V
G
S
D
V
L
A
R
T
C
D
P
T
D
R
G
T
--
I
I
I
F
G
D
G
A
G
A
A
V
L
A
A
S
-
E
--
E
P
G
I
I
S
T
H
L
H
A
D
G
S
Y
G
E
L
L
T
L
P
N
A
D
R
V
N
P
----
E
N
S
I
H
-----
L
T
M
A
G
N
E
V
F
K
V
A
V
T
E
L
A
H
I
V
D
E
T
L
A
A
N
N
L
D
R
S
Q
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
S
M
D
N
V
--
V
V
T
L
D
R
H
G
N
T
S
A
A
S
V
P
C
A
L
--
D
E
A
--
V
R
D
GR
I
K
P
G
------
Q
L
V
L
L
E
A
F
G
G
G
F
T
W
G
S
A
L
V
R
F
--------
3
PsiBlast_PDB
75.05
39%
-121
- C1 -
1HN9
1
FABH_ECOLI
A:
[5-316]
-----
I
I
G
T
G
S
Y
L
P
E
Q
V
R
T
N
A
D
L
E
---
K
M
V
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
H
I
A
A
P
N
E
T
V
S
-----
T
M
G
F
E
A
A
T
R
A
I
E
M
A
G
I
E
K
D
Q
I
G
L
I
V
V
A
T
T
S
A
T
H
A
F
P
S
A
A
C
Q
I
Q
S
M
L
G
I
K
G
C
P
A
F
D
V
A
A
A
C
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
Y
A
L
V
V
G
S
D
V
L
A
R
T
C
D
P
T
D
R
G
T
--
I
I
I
F
G
D
G
A
G
A
A
V
L
A
A
S
-
E
--
E
P
G
I
I
S
T
H
L
H
A
D
G
S
Y
G
E
L
L
T
L
P
N
A
D
R
V
N
P
----
E
N
S
I
H
-----
L
T
M
A
G
N
E
V
F
K
V
A
V
T
E
L
A
H
I
V
D
E
T
L
A
A
N
N
L
D
R
S
Q
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
S
M
D
N
V
--
V
V
T
L
D
R
H
G
N
T
S
A
A
S
V
P
C
A
L
--
D
E
A
--
V
R
D
GR
I
K
P
G
------
Q
L
V
L
L
E
A
F
G
G
G
F
T
W
G
S
A
L
V
R
F
--------
11
PsiBlast_PDB
73.91
35%
-121
- C1 -
2EBD
-
FABH_AQUAE
A:
[1-308]
M
G
T
K
I
I
-
G
T
G
V
Y
L
P
K
N
V
L
T
N
F
D
L
E
---
K
I
V
D
T
S
D
E
W
I
T
T
R
T
G
I
K
E
R
-
R
I
A
K
E
E
T
I
T
-----
Y
M
A
T
Q
A
A
K
E
A
L
R
E
A
N
L
S
P
E
E
L
D
L
I
I
L
A
T
L
T
P
Q
K
R
F
P
S
T
A
C
L
V
Q
A
Q
L
K
A
K
G
V
Y
A
F
D
I
S
A
A
C
S
G
F
I
Y
A
L
D
I
A
D
S
F
I
K
S
G
K
A
K
N
V
L
V
I
G
A
E
K
L
S
E
A
V
D
W
E
D
--
R
S
T
C
V
L
F
G
D
G
A
G
A
V
V
V
T
R
S
-
E
D
K
S
D
-
I
L
A
T
R
M
Y
A
E
G
S
L
E
E
L
L
H
A
-----------------
D
N
C
G
Y
I
R
M
K
G
R
E
L
F
K
V
A
V
R
S
M
E
E
V
C
R
E
V
L
E
K
A
G
V
K
P
E
E
V
S
L
V
I
P
H
Q
A
N
V
R
I
I
N
A
L
A
E
K
L
N
I
P
K
E
K
V
--
F
V
N
I
Q
K
Y
G
N
T
S
A
A
S
I
P
I
A
L
H
E
A
I
K
--
E
G
K
--
V
K
R
G
------
D
L
I
L
M
T
A
M
G
G
G
L
T
W
G
A
V
L
L
R
Y
--------
98
Fugue
72.98
39%
-117
- C1 -
1HNJ
2
FABH_ECOLI
A:
[1-317]
-
M
Y
T
K
I
I
G
T
G
S
Y
L
P
E
Q
V
R
T
N
A
D
L
E
K
M
V---
D
T
S
D
E
W
I
V
T
R
T
G
I
R
E
R
H
I
A
A
P
-----NET
V
S
T
M
G
F
E
A
A
T
R
A
I
E
M
A
G
I
E
K
D
Q
I
G
L
I
V
V
A
T
T
S
A
T
H
A
F
P
S
A
A
C
Q
I
Q
S
M
L
G
I
K
G
C
P
A
F
D
V
A
A
A
C
A
G
F
T
Y
A
L
S
V
A
D
Q
Y
V
K
S
G
A
V
K
Y
A
L
V
V
G
S
D
V
L
A
R
T
C
D
P
T
--
D
R
G
T
I
I
I
F
G
D
G
A
G
A
A
V
L
A
A
S
E---
E
P
G
I
I
S
T
H
L
H
A
D
G
S
Y
G
E
L
L
T
L
P
N
---
A
D
R
V
N
P
E
-
N
-----
S
I
H
L
T
M
A
G
N
E
V
F
K
V
A
V
T
E
L
A
H
I
V
D
E
T
L
A
A
N
N
L
D
R
S
Q
L
D
W
L
V
P
H
Q
A
N
L
R
I
I
S
A
T
A
K
K
L
G
M
S
M
D
N
-VV-
V
T
L
D
R
H
G
N
T
S
A
A
S
V
P
C
A
L
--
D
E
A
--
V
R
D
------GRIKPG
Q
L
V
L
L
E
A
F
G
G
G
F
T
W
G
S
A
L
V
R
F
--------