@TOME V2.3
(Nov 2016)
Ref.
-
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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 : Lmo2737: (2016-04-06 )
MPNIKEIAKLAGVSVTTVSRVLNNHPYVAEEKRVRVQAVIDELDYSPNRSAMDLARGKTNTVGVIIPYNDHPWFDKIVNGILEVAFKNRYSVTLFPTGYDPKEEEKYLMRLKTKQVDGLIITSRANNWDVILPYLAYGPIIACEYVESKEVSCSYIDRVKAYRAGFQFLEDEGYKKVAFTAGRASRESTSTYGKINAYEQVFGPVGDNRFLSECYTLEDGLKAGEHFFAAGKDWPDAIYANGDEVAAGVMYHVKKLGLRVPEDVAILGQENLPIGKVLEITTLDHNLKKLGENAFTIFEQGKLQRIKVEHELIRRKTV
Atome Classification :
(26 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......
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MP
N
I
K
E
I
A
K
L
AG
V
S
V
T
T
V
S
R
V
L
NNHPY-V
A
E
E
K
R
V
R
V
Q
A
V
I
D
E
LDYSPNR
S
A
M
D
LARGKT
N
T
V
G
V
I
I
PYNDHP
W
F
D
K
I
V
N
G
I
L
E
V
A
FKN
R
Y
S
V
T
L
F
PTGYD
P
K
E
E
E
K
Y
L
M
R
L
KTKQVD
G
L
I
I
--
T
SR--ANNW
D
V
I
L
P
Y
L-AYG-
P
---
I
I
A
C
E
Y
VES--K-EV
S
C
S
Y
I
D
R
V
--
K
A
Y
R
A
G
F
---
Q
F
L
EDEG
Y
K
K
V
A
F
TAG--RASRESTS--TYGK
I
N
A
Y
E
Q
V
FG----PV-G---D---
N
R
F
L
S
E
C
-
Y
T
L
E
D
G
L
K
AGE
H
F
FAAGKDWPD
A
I
YAN
G
D
E
V
A
A
G
V
M
Y
H
V
K
K
LGLRVPE
D
V
A
I
LGQENLPIG
K
V
L
--
E
I
T
TL
D
H
N
L
K
K
LGEN
A
F
T
I
F------EQG
K
L
Q
------
R
I
K
V
E
H
E
L
I
R
RKTV
12
PsiBlast_PDB
90.34
27%
-83
- C4 -
1QPZ
2
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
Y
--
P
E
P
L
L
A
M
L
E
E
Y
-
R
H
I
-
P
---
M
V
V
M
D
W
G
E
A
--
K
A
D
F
T
D
A
V
I
D
----
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
P
H
R
-
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
V
N
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
7
PsiBlast_PDB
90.25
27%
-83
- C4 -
1PNR
2
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
Y
--
P
E
P
L
L
A
M
L
E
E
Y
-
R
H
I
-
P
---
M
V
V
M
D
W
G
E
A
--
K
A
D
F
T
D
A
V
I
D
----
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
P
H
R
-
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
VN
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
10
PsiBlast_PDB
89.93
27%
-81
- C4 -
1QP0
2
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
Y
--
P
E
P
L
L
A
M
L
E
E
Y
-
R
H
I
-
P
---
M
V
V
M
D
W
G
E
A
--
K
A
D
F
T
D
A
V
I
D
----
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
P
H
R
-
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
VN
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
1
PsiBlast_PDB
89.55
27%
-83
- C4 -
1BDH
2
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
A
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
--
M
C
S
EY
P
E
P
L
L
A
M
L
E
E
Y
-
R
H
I
-
P
---
M
V
V
M
D
W
G
E
A
--
K
A
D
F
T
D
A
V
I
D
----
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
P
H
R
-
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
VN
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
13
PsiBlast_PDB
89.46
27%
-83
- C4 -
1ZAY
2
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
Y
--
P
E
P
L
L
A
M
L
E
E
Y
-
R
H
I
-
P
---
M
V
V
M
D
W
G
E
A
--
K
A
D
F
T
D
A
V
I
D
----
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
P
H
R
-
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
VN
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
2
PsiBlast_PDB
89.32
27%
-83
- C4 -
1QP7
2
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
A
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
--
M
C
S
EY
P
E
P
L
L
A
M
L
E
E
Y
-
R
H
I
-
P
---
M
V
V
M
D
W
G
E
A
--
K
A
D
F
T
D
A
V
I
D
----
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
P
H
R
-
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
VN
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
18
PsiBlast_PDB
89.19
26%
-84
- C4 -
1VPW
2
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
M
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
Y
--
P
E
P
L
L
A
M
L
E
E
Y
-
R
H
I
-
P
---
M
V
V
M
D
W
G
E
A
--
K
A
D
F
T
D
A
V
I
D
----
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
P
H
R
-
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
VN
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
11
PsiBlast_PDB
89.01
27%
-82
- C4 -
1QP4
2
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
Y
--
P
E
P
L
L
A
M
L
E
E
Y
-
R
H
I
-
P
---
M
V
V
M
D
W
G
E
A
--
K
A
D
F
T
D
A
V
I
D
----
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
P
H
R
-
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
VN
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
4
PsiBlast_PDB
88.94
27%
-82
- C4 -
1QQB
2
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
A
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
--
M
C
S
EY
P
E
P
L
L
A
M
L
E
E
Y
-
R
H
I
-
P
---
M
V
V
M
D
W
G
E
A
--
K
A
D
F
T
D
A
V
I
D
----
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
P
H
R
-
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
VN
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
3
PsiBlast_PDB
88.84
27%
-82
- C4 -
1QQA
2
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
A
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
--
M
C
S
EY
P
E
P
L
L
A
M
L
E
E
Y
-
R
H
I
-
P
---
M
V
V
M
D
W
G
E
A
--
K
A
D
F
T
D
A
V
I
D
----
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
P
H
R
-
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
VN
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
9
PsiBlast_PDB
88.76
27%
-81
- C4 -
1WET
2
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
MC
S
E
Y
--
P
E
P
L
L
A
M
L
E
E
Y
-
R
H
I
-
P
---
M
V
V
M
D
W
G
E
A
--
K
A
D
F
T
D
A
V
I
D
----
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
P
H
R
-
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
V
N
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
8
PsiBlast_PDB
88.68
27%
-83
- C4 -
1BDI
2
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
Y
--
P
E
P
L
L
A
M
L
E
E
Y
-
R
H
I
-
P
---
M
V
V
M
D
W
G
E
A
--
K
A
D
F
T
D
A
V
I
D
----
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
P
H
R
-
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
VN
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
6
PsiBlast_PDB
88.68
27%
-85
- C4 -
1JFS
2
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
Y
--
P
E
P
L
L
A
M
L
E
E
Y
-
R
H
I
-
P
---
M
V
V
M
D
F
G
E
A
--
K
A
D
F
T
D
A
V
I
D
----
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
-
P
H
R
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
VN
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
16
PsiBlast_PDB
88.00
27%
-86
- C4 -
1JFT
3
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
--
M
C
---
S
E
Y
P
E
P
L
L
A
M
L
-
E
E
Y
-
R
---
H
I
P
M
V
V
M
D
A
--
G
-
E
A
K
A
D
F
T
D
A
V
I
D
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
-
P
H
R
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
V
N
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
20
PsiBlast_PDB
87.62
27%
-78
- C4 -
2PUA
2
PURR_ECOLI
A:
[2-330]
--
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
Y
--
P
E
P
L
L
A
M
L
E
E
Y
-
R
H
I
-
P
---
M
V
V
M
D
W
G
E
A
--
K
A
D
F
T
D
A
V
I
D
----
N
A
F
E
G
G
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
PL
E
A
N
T
G
A
G
R
--
L
A
G
F
M
K
A
M
E
E
A
M
I
----
K
V
-
P
---
E
---
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
Q
P
H
R
-
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
VN
K
R
E
E
P
Q
------
S
I
E
V
H
P
R
L
I
E
R
R
S
V
19
PsiBlast_PDB
86.94
29%
-94
- C4 -
1ZVV
4
CCPA_BACSU
A:
[5-305]
---
I
Y
D
V
A
R
E
A
S
V
S
M
A
T
V
S
R
V
V
N
G
N
P
N
-
V
K
P
S
T
R
K
K
V
L
E
T
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
K
K
T
T
T
V
G
V
I
I
P
D
I
S
N
I
F
Y
A
E
L
A
R
G
I
E
D
I
A
S
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
Q
D
K
Q
L
H
L
L
N
N
M
L
G
K
Q
V
D
G
I
I
F
--
M
S
---
G
N
V
T
E
E
H
V
E
E
L
-
K
K
S
-
P
V
P
V
V
L
A
A
S
I
E
S
T
--
N
-
Q
I
P
S
V
T
I
D
Y
E
--
Q
A
A
F
D
A
V
---
Q
S
L
I
D
S
G
H
K
N
I
A
F
V
S
G
--
T
L
-
E
E
P
I
N
--
H
A
K
K
V
K
G
Y
K
R
A
L
T
E
S
G
L
P
V
-
R
---
D
---
S
Y
I
V
E
G
D
-
Y
T
Y
D
S
G
I
E
A
V
E
K
L
L
E
E
-
D
E
K
P
T
A
I
F
V
G
T
D
E
M
A
L
G
V
I
H
G
A
Q
D
R
G
L
N
V
P
N
D
L
E
I
I
G
F
D
N
T
R
L
S
T
M
V
RP
Q
L
T
S
V
V
Q
P
M
Y
D
I
G
A
V
A
M
R
L
L
--------------------------------
55
HHSearch
84.42
25%
-80
* C4 *
1QPZ
2
PURR_ECOLI
A:
[1-330]
-
A
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
F
-
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
--
M
C
S
--
E
Y
P
E
P
L
L
A
M
L
E
E
Y
R
H
I
P
---
M
V
V
M
D
W
G
E
A
KA
D
-
F
T
D
A
V
I
D
N
A
F
--
E
G
G
Y
M
A
G
---
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
--
P
L
E
R
--
N
T
--
G
A
G
R
L
A
G
F
M
K
A
M
E
----
E
A
M
I
K
V
-
P
E--
S
W
I
V
Q
G
D
-
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
-
Q
P
H
R
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
TP
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
------
L
D
R
I
V
N
KRE
E
P
Q
S
I
E
V
H
P
R
L
I
E
R
R
S
V
50
HHSearch
84.26
28%
-76
- C4 -
2HSG
-
CCPA_BACME
A:
[2-331]
N
V
T
I
Y
D
V
A
R
E
A
S
V
S
M
A
T
V
S
R
V
V
N
G
N
P
N
-
V
K
P
S
T
R
K
K
V
L
E
T
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
-
K
T
T
T
V
G
V
I
I
P
--
S
N
I
F
Y
A
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
Q
D
K
E
L
H
L
L
N
N
M
L
G
K
Q
V
D
G
I
I
F
--
M
S
G
--
N
V
T
E
E
H
V
E
E
L
K
-
K
S
P
V
P
---
V
V
L
A
A
S
I
E
S
T-
N
-
Q
I
P
S
V
T
I
D
Y
E
--
Q
A
A
F
D
A
V
---
Q
S
L
I
D
S
G
H
K
N
I
A
F
V
S
G
--
T
L
E
E
P
-
I
N
--
H
A
K
K
V
K
G
Y
K
R
A
L
T
----
E
S
G
L
---
P
VRD
S
Y
I
V
E
G
D
-
Y
T
Y
D
S
G
I
E
A
V
E
K
L
L
E
-
E
D
E
K
P
T
A
I
F
V
G
T
D
E
M
A
L
G
V
I
H
G
A
Q
D
R
G
L
N
V
P
N
D
L
E
I
I
G
F
D
N
T
R
L
S
T
M
V
RP
Q
L
T
S
V
V
Q
P
M
Y
D
I
G
A
V
A
M
R
L
L
------
T
K
Y
M
N
K
E
T
V
D
SS
I
V
Q
L
P
H
R
I
E
F
R
Q
S
T
5
PsiBlast_PDB
82.79
29%
-91
- C4 -
2HSG
-
CCPA_BACME
A:
[5-305]
---
I
Y
D
V
A
R
E
A
S
V
S
M
A
T
V
S
R
V
V
N
G
N
P
N
-
V
K
P
S
T
R
K
K
V
L
E
T
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
-
K
T
T
T
V
G
V
I
I
P
--
S
N
I
F
Y
A
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
Q
D
K
E
L
H
L
L
N
N
M
L
G
K
Q
V
D
G
I
I
F
--
M
S
---
G
N
V
T
E
E
H
V
E
E
L
-
K
K
S
-
P
V
P
V
V
L
A
A
S
I
E
S
T
--
N
-
Q
I
P
S
V
T
I
D
Y
E
--
Q
A
A
F
D
A
V
---
Q
S
L
I
D
S
G
H
K
N
I
A
F
V
S
G
--
T
L
-
E
E
P
I
N
--
H
A
K
K
V
K
G
Y
K
R
A
L
T
E
S
GL
P
V
-
R
---
D
---
S
Y
I
V
E
G
D
-
Y
T
Y
D
S
G
I
E
A
V
E
K
L
L
E
E
-
D
E
K
P
T
A
I
F
V
G
T
D
E
M
A
L
G
V
I
H
G
A
Q
D
R
G
L
N
V
P
N
D
L
E
I
I
G
F
D
N
T
R
L
S
T
M
V
RP
Q
L
T
S
V
V
Q
P
M
Y
D
I
G
A
V
A
M
R
L
L
--------------------------------
23
PsiBlast_CBE
82.42
31%
-88
- C4 -
3OQO
5
CCPA_BACSU
C:
[5-276]
---
I
Y
D
V
A
R
E
A
N
V
S
M
A
T
V
S
R
V
V
N
G
N
P
N
-
V
K
P
T
T
R
K
K
V
L
E
A
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
K
K
T
T
T
V
G
V
I
I
P
D
I
S
S
I
F
Y
S
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
M
E
K
E
L
H
L
L
N
T
M
L
G
K
Q
V
D
G
I
V
F
--
M
G
---
G
N
I
T
D
E
H
V
A
E
F
-
K
R
S
-
P
VPI
V
L
A
A
S
V
E
E
Q
--
E
-
E
T
P
S
V
A
I
D
Y
E
--
Q
A
I
Y
D
A
V
---
K
L
L
V
D
K
G
H
T
D
I
A
F
V
S
G
--
P
M
A
-
E
P
I
N
--
R
S
K
K
L
Q
G
Y
K
R
A
L
E
----
E
A
-
N
LPF
N
---
E
Q
F
V
A
E
G
D
Y
T
Y
D
S
G
L
E
A
L
Q
H
L
M
S
L
D
K
K
-
P
T
A
I
L
S
A
T
D
E
M
A
L
G
I
I
H
A
A
Q
D
Q
G
L
S
I
P
E
D
L
D
I
I
G
F
D
N
-------------------------------------------------------------
22
PsiBlast_CBE
82.10
31%
-90
- C4 -
3OQM
4
CCPA_BACSU
C:
[5-276]
---
I
Y
D
V
A
R
E
A
N
V
S
M
A
T
V
S
R
V
V
N
G
N
P
N
-
V
K
P
T
T
R
K
K
V
L
E
A
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
K
K
T
T
T
V
G
V
I
I
P
D
I
S
S
I
F
Y
S
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
M
E
K
E
L
H
L
L
N
T
M
L
G
K
Q
V
D
G
I
V
F
--
M
G
---
G
N
I
T
D
E
H
V
A
E
F
-
K
R
S
-
P
VPI
V
L
A
A
S
V
E
E
Q
--
E
-
E
T
P
S
V
A
I
D
Y
E
--
Q
A
I
Y
D
A
V
---
K
L
L
V
D
K
G
H
T
D
I
A
F
V
S
G
--
P
M
A
-
E
P
I
N
--
R
S
K
K
L
Q
G
Y
K
R
A
L
E
----
E
A
-
N
LPF
N
---
E
Q
F
V
A
E
G
D
Y
T
Y
D
S
G
L
E
A
L
Q
H
L
M
S
L
D
K
K
-
P
T
A
I
L
S
A
T
D
E
M
A
L
G
I
I
H
A
A
Q
D
Q
G
L
S
I
P
E
D
L
D
I
I
G
F
D
N
-------------------------------------------------------------
17
PsiBlast_PDB
81.61
31%
-88
- C4 -
3OQO
4
CCPA_BACSU
A:
[5-276]
---
I
Y
D
V
A
R
E
A
N
V
S
M
A
T
V
S
R
V
V
N
G
N
P
N
-
V
K
P
T
T
R
K
K
V
L
E
A
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
K
K
T
T
T
V
G
V
I
I
P
D
I
S
S
I
F
Y
S
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
M
E
K
E
L
H
L
L
N
T
M
L
G
K
Q
V
D
G
I
V
F
--
M
G
---
G
N
I
T
D
E
H
V
A
E
F
-
K
R
S
-
P
V
P
I
V
L
A
A
S
V
E
E
Q
--
E
-
E
T
P
S
V
A
I
D
Y
E
--
Q
A
I
Y
D
A
V
---
K
L
L
V
D
K
G
H
T
D
I
A
F
V
S
G
--
P
M
A
-
E
P
I
N
--
R
S
K
K
L
Q
G
Y
K
R
A
L
E
----
E
A
-
N
L
P
F
N
---
E
Q
F
V
A
E
G
D
Y
T
Y
D
S
G
L
E
A
L
Q
H
L
M
S
L
D
K
K
-
P
T
A
I
L
S
A
T
D
E
M
A
L
G
I
I
H
A
A
Q
D
Q
G
L
S
I
P
E
D
L
D
I
I
G
F
D
N
-------------------------------------------------------------
14
PsiBlast_PDB
81.44
31%
-87
- C4 -
3OQM
4
CCPA_BACSU
A:
[5-276]
---
I
Y
D
V
A
R
E
A
N
V
S
M
A
T
V
S
R
V
V
N
G
N
P
N
-
V
K
P
T
T
R
K
K
V
L
E
A
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
K
K
T
T
T
V
G
V
I
I
P
D
I
S
S
I
F
Y
S
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
M
E
K
E
L
H
L
L
N
T
M
L
G
K
Q
V
D
G
I
V
F
--
M
G
---
G
N
I
T
D
E
H
V
A
E
F
-
K
R
S
-
P
V
P
I
V
L
A
A
S
V
E
E
Q
--
E
-
E
T
P
S
V
A
I
D
Y
E
--
Q
A
I
Y
D
A
V
---
K
L
L
V
D
K
G
H
T
D
I
A
F
V
S
G
--
P
M
A
-
E
P
I
N
--
R
S
K
K
L
Q
G
Y
K
R
A
L
E
----
E
A
-
N
L
P
F
N
---
E
Q
F
V
A
E
G
D
Y
T
Y
D
S
G
L
E
A
L
Q
H
L
M
S
L
D
K
K
-
P
T
A
I
L
S
A
T
D
E
M
A
L
G
I
I
H
A
A
Q
D
Q
G
L
S
I
P
E
D
L
D
I
I
G
F
D
N
-------------------------------------------------------------
15
PsiBlast_PDB
80.80
31%
-89
- C4 -
3OQN
2
CCPA_BACSU
A:
[5-276]
---
I
Y
D
V
A
R
E
A
N
V
S
M
A
T
V
S
R
V
V
N
G
N
P
N
-
V
K
P
T
T
R
K
K
V
L
E
A
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
K
K
T
T
T
V
G
V
I
I
P
D
I
S
S
I
F
Y
S
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
M
E
K
E
L
H
L
L
N
T
M
L
G
K
Q
V
D
G
I
V
F
--
M
G
---
G
N
I
T
D
E
H
V
A
E
F
-
K
R
S
-
P
V
P
I
V
L
A
A
S
V
E
E
Q
--
E
-
E
T
P
S
V
A
I
D
Y
E
--
Q
A
I
Y
D
A
V
---
K
L
L
V
D
K
G
H
T
D
I
A
F
V
S
G
--
P
M
A
-
E
P
I
N
--
R
S
K
K
L
Q
G
Y
K
R
A
L
E
----
E
A
-
N
L
P
F
N
---
E
Q
F
V
A
E
G
D
Y
T
Y
D
S
G
L
E
A
L
Q
H
L
M
S
L
D
K
K
-
P
T
A
I
L
S
A
T
D
E
M
A
L
G
I
I
H
A
A
Q
D
Q
G
L
S
I
P
E
D
L
D
I
I
G
F
D
N
-------------------------------------------------------------
21
PsiBlast_CBE
80.53
31%
-89
- C4 -
3OQN
2
CCPA_BACSU
C:
[5-276]
---
I
Y
D
V
A
R
E
A
N
V
S
M
A
T
V
S
R
V
V
N
G
N
P
N
-
V
K
P
T
T
R
K
K
V
L
E
A
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
K
K
T
T
T
V
G
V
I
I
P
D
I
S
S
I
F
Y
S
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
M
E
K
E
L
H
L
L
N
T
M
L
G
K
Q
V
D
G
I
V
F
--
M
G
---
G
N
I
T
D
E
H
V
A
E
F
-
K
R
S
-
P
VPI
V
L
A
A
S
V
E
E
Q
--
E
-
E
T
P
S
V
A
I
D
Y
E
--
Q
A
I
Y
D
A
V
---
K
L
L
V
D
K
G
H
T
D
I
A
F
V
S
G
--
P
M
A
-
E
P
I
N
--
R
S
K
K
L
Q
G
Y
K
R
A
L
E
----
E
A
-
N
LPF
N
---
E
Q
F
V
A
E
G
D
Y
T
Y
D
S
G
L
E
A
L
Q
H
L
M
S
L
D
K
K
-
P
T
A
I
L
S
A
T
D
E
M
A
L
G
I
I
H
A
A
Q
D
Q
G
L
S
I
P
E
D
L
D
I
I
G
F
D
N
-------------------------------------------------------------
44
Fugue
41.74
48%
-62
- C4 -
1QPZ
1
PURR_ECOLI
A:
[1-57]
-
A
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
R
-
F
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
--
P
S
A
V
A
R
S
L
K
V
N
H
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------