ARECA's report on ASP31

Residue probability: 0.884
Residue probability confidence: 0.893

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 175.282 176.463 2.348 0.000 0.000
CA 53.370 54.786 4.266 0.714 0.875
CB 42.722 40.949 3.070 1.000 0.833
N 121.895 120.550 5.690 0.923 1.000
HD2 NA -- -- 0.000 0.000
HA 5.210 4.587 0.329 0.714 0.875
HB2 2.467 2.708 0.282 1.000 0.833
HB3 2.468 2.654 0.285 1.000 0.833
H 8.377 8.304 1.027 0.833 1.000

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Detailed Probabilities of ASP(31)-CA:

Overall probability: 0.714
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG30 0.00 1.00
ASP31 1.00 0.80
VAL32 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
R30HA 1.00
D31HD2 1.00
D31HB2 1.00
D31HB3 1.00
D31H 1.00
D31HA 1.00
V32H 1.00
V32HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG30 HA 1.00 0.470 0.00 0.00
ASP31 HA 1.00 0.000 1.00 0.64
ASP31 HB2 1.00 0.000 1.00 0.14
ASP31 HB3 1.00 0.000 1.00 0.14
ASP31 H 1.00 0.000 1.00 0.04
VAL32 HA 1.00 0.962 0.00 0.00
VAL32 H 1.00 0.000 1.00 0.24

Detailed Probabilities of ASP(31)-CB:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP31 1.00 0.80
VAL32 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D31HD2 1.00
D31HA 1.00
D31HB3 1.00
D31H 1.00
D31HB2 1.00
V32H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP31 HA 1.00 0.000 1.00 0.12
ASP31 HB2 1.00 0.000 1.00 1.35
ASP31 HB3 1.00 0.000 1.00 1.35
ASP31 H 1.00 0.000 1.00 0.10
VAL32 H 1.00 0.000 1.00 0.05

Detailed Probabilities of ASP(31)-N:

Overall probability: 0.923
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG30 1.00 1.00
ASP31 1.00 1.00
VAL32 0.00 1.00

Expected NOESY Contacts
Proton Expected probability
R30H 1.00
R30HA 1.00
R30HG3 0.96
R30HB3 1.00
R30HB2 1.00
R30HG2 0.98
D31HA 1.00
D31HB2 1.00
D31HB3 1.00
D31H 1.00
V32H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG30 HA 1.00 0.000 1.00 -16020.00
ARG30 HB2 1.00 0.000 1.00 -3249.00
ARG30 HB3 1.00 0.000 1.00 -2649.00
ARG30 HG2 0.98 0.000 1.00 -2520.00
ARG30 HG3 0.96 0.000 1.00 -1820.00
ARG30 H 1.00 0.000 1.00 -634.00
ARG30 HD2 0.58 0.000 1.00 -161.00
ARG30 HD3 0.61 0.000 1.00 -373.00
ASP31 HA 1.00 0.000 1.00 -3681.00
ASP31 HB2 1.00 0.000 1.00 -9590.00
ASP31 HB3 1.00 0.000 1.00 -9590.00
ASP31 H 1.00 0.000 1.00 -72120.00
VAL32 H 1.00 0.041 0.00 0.00

Detailed Probabilities of ASP(31)-HA:

Overall probability: 0.714
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG30 0.00 1.00
ASP31 1.00 0.80
VAL32 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
R30HA 1.00
D31HD2 1.00
D31HB2 1.00
D31HB3 1.00
D31H 1.00
D31HA 1.00
V32H 1.00
V32HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG30 HA 1.00 0.470 0.00 0.00
ASP31 HA 1.00 0.000 1.00 0.64
ASP31 HB2 1.00 0.000 1.00 0.12
ASP31 HB3 1.00 0.000 1.00 0.12
ASP31 H 1.00 0.000 1.00 -3681.00
VAL32 HA 1.00 0.232 0.00 0.00
VAL32 H 1.00 0.000 1.00 -16840.00

Detailed Probabilities of ASP(31)-HB2:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP31 1.00 0.80
VAL32 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D31HD2 1.00
D31HA 1.00
D31HB3 1.00
D31H 1.00
D31HB2 1.00
V32H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP31 HA 1.00 0.000 1.00 0.14
ASP31 HB2 1.00 0.000 1.00 1.35
ASP31 HB3 1.00 0.000 1.00 1.35
ASP31 H 1.00 0.000 1.00 -9590.00
VAL32 H 1.00 0.000 1.00 -3567.00
VAL32 HA 0.87 0.021 1.00 0.02

Detailed Probabilities of ASP(31)-HB3:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP31 1.00 0.80
VAL32 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D31HD2 1.00
D31HA 1.00
D31HB2 1.00
D31H 1.00
D31HB3 1.00
V32H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP31 HA 1.00 0.000 1.00 0.14
ASP31 HB2 1.00 0.000 1.00 1.35
ASP31 HB3 1.00 0.000 1.00 1.35
ASP31 H 1.00 0.000 1.00 -9590.00
VAL32 H 1.00 0.000 1.00 -3567.00
VAL32 HA 0.87 0.021 1.00 0.02

Detailed Probabilities of ASP(31)-H:

Overall probability: 0.833
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG30 0.86 1.00
ASP31 1.00 1.00
VAL32 0.00 1.00

Expected NOESY Contacts
Proton Expected probability
R30H 1.00
R30HA 1.00
R30HG3 0.96
R30HB3 1.00
R30HB2 1.00
R30HG2 0.98
D31HA 1.00
D31HB2 1.00
D31HB3 1.00
D31H 1.00
V32H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG30 HA 1.00 0.319 0.00 0.00
ARG30 HB2 1.00 0.000 1.00 0.02
ARG30 HB3 1.00 0.000 1.00 0.01
ARG30 HG2 0.98 0.000 1.00 0.00
ARG30 HG3 0.96 0.000 1.00 0.00
ARG30 H 1.00 0.000 1.00 -309.00
ARG30 HD3 0.61 0.000 1.00 0.01
ASP31 HA 1.00 0.000 1.00 0.04
ASP31 HB2 1.00 0.000 1.00 0.10
ASP31 HB3 1.00 0.000 1.00 0.10
ASP31 H 1.00 0.000 1.00 -72120.00
VAL32 H 1.00 0.064 0.00 0.00