ARECA's report on ASP39

Residue probability: 0.923
Residue probability confidence: 0.893

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 174.482 176.463 2.348 0.000 0.000
CA 53.051 54.786 4.266 0.750 0.875
CB 44.007 40.949 3.070 1.000 0.833
N 124.613 120.550 5.690 1.000 1.000
HD2 NA -- -- 0.000 0.000
HA 5.042 4.587 0.329 0.714 0.875
HB2 2.563 2.708 0.282 1.000 0.833
HB3 2.566 2.654 0.285 1.000 0.833
H 8.400 8.304 1.027 1.000 1.000

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Detailed Probabilities of ASP(39)-CA:

Overall probability: 0.750
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
MET38 0.50 1.00
ASP39 1.00 0.80
PHE40 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
M38HA 1.00
D39HD2 1.00
D39HB2 1.00
D39HB3 1.00
D39H 1.00
D39HA 1.00
F40HA 1.00
F40H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
MET38 HA 1.00 0.857 0.00 0.00
MET38 H 0.85 0.024 1.00 0.00
ASP39 HA 1.00 0.000 1.00 0.00
ASP39 HB2 1.00 0.000 1.00 0.00
ASP39 HB3 1.00 0.000 1.00 0.00
ASP39 H 1.00 0.000 1.00 0.00
PHE40 HA 1.00 0.129 0.00 0.00
PHE40 H 1.00 0.000 1.00 0.00

Detailed Probabilities of ASP(39)-CB:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP39 1.00 0.80
PHE40 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D39HD2 1.00
D39HA 1.00
D39HB3 1.00
D39H 1.00
D39HB2 1.00
F40H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP39 HA 1.00 0.000 1.00 0.00
ASP39 HB2 1.00 0.000 1.00 0.00
ASP39 HB3 1.00 0.000 1.00 0.00
ASP39 H 1.00 0.000 1.00 0.00
PHE40 H 1.00 0.000 1.00 0.00

Detailed Probabilities of ASP(39)-N:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
MET38 1.00 1.00
ASP39 1.00 1.00
PHE40 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
M38H 1.00
M38HG2 0.97
M38HB3 1.00
M38HB2 1.00
M38HA 1.00
D39HA 1.00
D39HB2 1.00
D39HB3 1.00
D39H 1.00
F40H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
MET38 HA 1.00 0.000 1.00 0.00
MET38 HB2 1.00 0.000 1.00 0.00
MET38 HB3 1.00 0.000 1.00 0.00
MET38 HG2 0.97 0.000 1.00 0.00
MET38 H 1.00 0.024 1.00 0.00
MET38 HG3 0.95 0.000 1.00 0.00
ASP39 HA 1.00 0.000 1.00 0.00
ASP39 HB2 1.00 0.000 1.00 0.00
ASP39 HB3 1.00 0.000 1.00 0.00
ASP39 H 1.00 0.000 1.00 0.00
PHE40 H 1.00 0.000 1.00 0.00

Detailed Probabilities of ASP(39)-HA:

Overall probability: 0.714
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
MET38 0.00 1.00
ASP39 1.00 0.80
PHE40 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
M38HA 1.00
D39HD2 1.00
D39HB2 1.00
D39HB3 1.00
D39H 1.00
D39HA 1.00
F40HA 1.00
F40H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
MET38 HA 1.00 0.857 0.00 0.00
ASP39 HA 1.00 0.000 1.00 0.00
ASP39 HB2 1.00 0.000 1.00 0.00
ASP39 HB3 1.00 0.000 1.00 0.00
ASP39 H 1.00 0.000 1.00 0.00
PHE40 HA 1.00 0.129 0.00 0.00
PHE40 H 1.00 0.000 1.00 0.00

Detailed Probabilities of ASP(39)-HB2:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP39 1.00 0.80
PHE40 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D39HD2 1.00
D39HA 1.00
D39HB3 1.00
D39H 1.00
D39HB2 1.00
F40H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP39 HA 1.00 0.000 1.00 0.00
ASP39 HB2 1.00 0.000 1.00 0.00
ASP39 HB3 1.00 0.000 1.00 0.00
ASP39 H 1.00 0.000 1.00 0.00
PHE40 H 1.00 0.000 1.00 0.00

Detailed Probabilities of ASP(39)-HB3:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP39 1.00 0.80
PHE40 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D39HD2 1.00
D39HA 1.00
D39HB2 1.00
D39H 1.00
D39HB3 1.00
F40H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP39 HA 1.00 0.000 1.00 0.00
ASP39 HB2 1.00 0.000 1.00 0.00
ASP39 HB3 1.00 0.000 1.00 0.00
ASP39 H 1.00 0.000 1.00 0.00
PHE40 H 1.00 0.000 1.00 0.00

Detailed Probabilities of ASP(39)-H:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
MET38 1.00 1.00
ASP39 1.00 1.00
PHE40 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
M38H 1.00
M38HG2 0.97
M38HB3 1.00
M38HB2 1.00
M38HA 1.00
D39HA 1.00
D39HB2 1.00
D39HB3 1.00
D39H 1.00
F40H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
MET38 HA 1.00 0.000 1.00 0.00
MET38 HB2 1.00 0.000 1.00 0.00
MET38 HB3 1.00 0.000 1.00 0.00
MET38 HG2 0.97 0.000 1.00 0.00
MET38 H 1.00 0.024 1.00 0.00
MET38 HG3 0.95 0.000 1.00 0.00
ASP39 HA 1.00 0.000 1.00 0.00
ASP39 HB2 1.00 0.000 1.00 0.00
ASP39 HB3 1.00 0.000 1.00 0.00
ASP39 H 1.00 0.000 1.00 0.00
PHE40 H 1.00 0.000 1.00 0.00