ARECA's report on ASP84

Residue probability: 0.912
Residue probability confidence: 0.893

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 174.308 176.463 2.348 0.000 0.000
CA 54.015 54.786 4.266 0.750 0.875
CB 43.771 40.949 3.070 1.000 0.833
N 124.451 120.550 5.690 1.000 1.000
HD2 NA -- -- 0.000 0.000
HA 4.502 4.587 0.329 0.714 0.875
HB2 2.588 2.708 0.282 1.000 0.833
HB3 2.664 2.654 0.285 1.000 0.833
H 8.205 8.304 1.027 0.917 1.000

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Detailed Probabilities of ASP(84)-CA:

Overall probability: 0.750
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN83 0.50 1.00
ASP84 1.00 0.80
GLN85 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
Q83HA 1.00
D84HD2 1.00
D84HB2 1.00
D84HB3 1.00
D84H 1.00
D84HA 1.00
Q85H 1.00
Q85HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN83 HA 1.00 0.217 0.00 0.00
GLN83 HB2 0.61 0.010 1.00 0.06
ASP84 HA 1.00 0.000 1.00 1.90
ASP84 HB2 1.00 0.000 1.00 0.12
ASP84 HB3 1.00 0.000 1.00 0.13
ASP84 H 1.00 0.000 1.00 0.08
GLN85 HA 1.00 0.165 0.00 0.00
GLN85 H 1.00 0.000 1.00 0.27

Detailed Probabilities of ASP(84)-CB:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP84 1.00 0.80
GLN85 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D84HD2 1.00
D84HA 1.00
D84HB3 1.00
D84H 1.00
D84HB2 1.00
Q85H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP84 HA 1.00 0.000 1.00 0.06
ASP84 HB2 1.00 0.000 1.00 0.44
ASP84 HB3 1.00 0.000 1.00 0.35
ASP84 H 1.00 0.000 1.00 0.02
GLN85 H 1.00 0.000 1.00 0.01

Detailed Probabilities of ASP(84)-N:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN83 1.00 1.00
ASP84 1.00 1.00
GLN85 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q83HB3 1.00
Q83HB2 1.00
Q83H 1.00
Q83HG2 0.98
Q83HA 1.00
Q83HG3 0.96
D84HA 1.00
D84HB2 1.00
D84HB3 1.00
D84H 1.00
Q85H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN83 HA 1.00 0.000 1.00 -7282.00
GLN83 HB2 1.00 0.000 1.00 -371.00
GLN83 HB3 1.00 0.000 1.00 -823.00
GLN83 HG2 0.98 0.000 1.00 -1911.00
GLN83 HG3 0.96 0.000 1.00 -1445.00
GLN83 H 1.00 0.000 1.00 -712.00
ASP84 HA 1.00 0.000 1.00 -2612.00
ASP84 HB2 1.00 0.000 1.00 -1550.00
ASP84 HB3 1.00 0.000 1.00 -1219.00
ASP84 H 1.00 0.000 1.00 -24020.00
GLN85 H 1.00 0.023 1.00 -560.00

Detailed Probabilities of ASP(84)-HA:

Overall probability: 0.714
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN83 0.00 1.00
ASP84 1.00 0.80
GLN85 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
Q83HA 1.00
D84HD2 1.00
D84HB2 1.00
D84HB3 1.00
D84H 1.00
D84HA 1.00
Q85H 1.00
Q85HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN83 HA 1.00 0.288 0.00 0.00
ASP84 HA 1.00 0.000 1.00 1.90
ASP84 HB2 1.00 0.000 1.00 0.06
ASP84 HB3 1.00 0.000 1.00 0.07
ASP84 H 1.00 0.000 1.00 -2612.00
GLN85 HA 1.00 0.168 0.00 0.00
GLN85 H 1.00 0.000 1.00 -13250.00

Detailed Probabilities of ASP(84)-HB2:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP84 1.00 0.80
GLN85 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D84HD2 1.00
D84HA 1.00
D84HB3 1.00
D84H 1.00
D84HB2 1.00
Q85H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP84 HA 1.00 0.000 1.00 0.12
ASP84 HB2 1.00 0.000 1.00 0.44
ASP84 HB3 1.00 0.000 1.00 0.38
ASP84 H 1.00 0.000 1.00 -1550.00
GLN85 H 1.00 0.000 1.00 -1408.00

Detailed Probabilities of ASP(84)-HB3:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP84 1.00 0.80
GLN85 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D84HD2 1.00
D84HA 1.00
D84HB2 1.00
D84H 1.00
D84HB3 1.00
Q85H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP84 HA 1.00 0.000 1.00 0.13
ASP84 HB2 1.00 0.000 1.00 0.35
ASP84 HB3 1.00 0.000 1.00 0.42
ASP84 H 1.00 0.000 1.00 -1219.00
GLN85 H 1.00 0.000 1.00 -1213.00

Detailed Probabilities of ASP(84)-H:

Overall probability: 0.917
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN83 0.83 1.00
ASP84 1.00 1.00
GLN85 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q83HB3 1.00
Q83HB2 1.00
Q83H 1.00
Q83HG2 0.98
Q83HA 1.00
Q83HG3 0.96
D84HA 1.00
D84HB2 1.00
D84HB3 1.00
D84H 1.00
Q85H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN83 HA 1.00 0.000 1.00 0.12
GLN83 HB2 1.00 0.000 1.00 0.02
GLN83 HB3 1.00 0.232 0.00 0.00
GLN83 HG2 0.98 0.000 1.00 0.02
GLN83 HG3 0.96 0.000 1.00 0.00
GLN83 H 1.00 0.000 1.00 -560.00
ASP84 HA 1.00 0.000 1.00 0.08
ASP84 HB2 1.00 0.000 1.00 0.02
ASP84 HB3 1.00 0.000 1.00 0.02
ASP84 H 1.00 0.000 1.00 -24020.00
GLN85 H 1.00 0.000 1.00 -651.00
GLN85 HB2 0.61 0.002 1.00 0.03