ARECA's report on ASP109

Residue probability: 0.903
Residue probability confidence: 0.861

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 175.796 176.463 2.348 0.000 0.000
CA 53.849 54.786 4.266 0.571 0.875
CB 43.688 40.949 3.070 1.000 0.833
N 122.574 120.550 5.690 1.000 0.889
HD2 NA -- -- 0.000 0.000
HA 4.738 4.587 0.329 0.857 0.875
HB2 2.816 2.708 0.282 1.000 0.833
HB3 2.729 2.654 0.285 1.000 0.833
H 8.036 8.304 1.027 0.889 0.889

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Detailed Probabilities of ASP(109)-CA:

Overall probability: 0.571
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR108 0.00 1.00
ASP109 0.75 0.80
ASP110 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
T108HA 1.00
D109HD2 1.00
D109HB2 1.00
D109HB3 1.00
D109H 1.00
D109HA 1.00
D110H 1.00
D110HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR108 HA 1.00 0.041 0.00 0.00
ASP109 HA 1.00 0.000 1.00 0.80
ASP109 HB2 1.00 0.000 1.00 0.05
ASP109 HB3 1.00 0.000 1.00 0.07
ASP109 H 1.00 0.660 0.00 0.00
ASP110 HA 1.00 0.643 0.00 0.00
ASP110 H 1.00 0.000 1.00 0.14

Detailed Probabilities of ASP(109)-CB:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP109 1.00 0.80
ASP110 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D109HD2 1.00
D109HA 1.00
D109HB3 1.00
D109H 1.00
D109HB2 1.00
D110H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP109 HA 1.00 0.000 1.00 0.14
ASP109 HB2 1.00 0.000 1.00 0.99
ASP109 HB3 1.00 0.000 1.00 0.87
ASP109 H 1.00 0.000 1.00 0.11
ASP110 H 1.00 0.000 1.00 0.06

Detailed Probabilities of ASP(109)-N:

Overall probability: 1.000
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR108 1.00 0.75
ASP109 1.00 1.00
ASP110 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
T108HG1 0.98
T108HA 1.00
T108H 1.00
T108HB 1.00
D109HA 1.00
D109HB2 1.00
D109HB3 1.00
D109H 1.00
D110H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR108 HA 1.00 0.000 1.00 -5831.00
THR108 HB 1.00 0.000 1.00 -5076.00
THR108 H 1.00 0.000 1.00 -11580.00
THR108 HG21 0.94 0.000 1.00 -2825.00
ASP109 HA 1.00 0.000 1.00 -5783.00
ASP109 HB2 1.00 0.000 1.00 -6680.00
ASP109 HB3 1.00 0.000 1.00 -7635.00
ASP109 H 1.00 0.000 1.00 -65400.00
ASP110 H 1.00 0.000 1.00 -819.00

Detailed Probabilities of ASP(109)-HA:

Overall probability: 0.857
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR108 0.00 1.00
ASP109 1.00 0.80
ASP110 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
T108HA 1.00
D109HD2 1.00
D109HB2 1.00
D109HB3 1.00
D109H 1.00
D109HA 1.00
D110H 1.00
D110HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR108 HA 1.00 0.043 0.00 0.00
ASP109 HA 1.00 0.000 1.00 0.80
ASP109 HB2 1.00 0.000 1.00 0.14
ASP109 HB3 1.00 0.000 1.00 0.12
ASP109 H 1.00 0.000 1.00 -5783.00
ASP110 HA 1.00 0.001 1.00 0.01
ASP110 H 1.00 0.000 1.00 -19810.00

Detailed Probabilities of ASP(109)-HB2:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP109 1.00 0.80
ASP110 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D109HD2 1.00
D109HA 1.00
D109HB3 1.00
D109H 1.00
D109HB2 1.00
D110H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP109 HA 1.00 0.000 1.00 0.05
ASP109 HB2 1.00 0.000 1.00 0.99
ASP109 HB3 1.00 0.000 1.00 0.78
ASP109 H 1.00 0.000 1.00 -6680.00
ASP110 H 1.00 0.000 1.00 -4610.00

Detailed Probabilities of ASP(109)-HB3:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP109 1.00 0.80
ASP110 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D109HD2 1.00
D109HA 1.00
D109HB2 1.00
D109H 1.00
D109HB3 1.00
D110H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP109 HA 1.00 0.000 1.00 0.07
ASP109 HB2 1.00 0.000 1.00 0.87
ASP109 HB3 1.00 0.000 1.00 1.12
ASP109 H 1.00 0.000 1.00 -7635.00
ASP110 H 1.00 0.000 1.00 -5558.00

Detailed Probabilities of ASP(109)-H:

Overall probability: 0.889
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR108 1.00 0.75
ASP109 0.75 1.00
ASP110 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
T108HG1 0.98
T108HA 1.00
T108H 1.00
T108HB 1.00
D109HA 1.00
D109HB2 1.00
D109HB3 1.00
D109H 1.00
D110H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR108 HA 1.00 0.000 1.00 0.03
THR108 HB 1.00 0.000 1.00 0.08
THR108 H 1.00 0.000 1.00 -7146.00
THR108 HG21 0.94 0.000 1.00 0.03
ASP109 HA 1.00 0.660 0.00 0.00
ASP109 HB2 1.00 0.000 1.00 0.11
ASP109 HB3 1.00 0.000 1.00 0.10
ASP109 H 1.00 0.000 1.00 -65400.00
ASP110 H 1.00 0.000 1.00 -921.00