ARECA's report on SER35

Residue probability: 0.691
Residue probability confidence: 0.864

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 175.991 174.682 1.868 0.000 0.000
CA 61.446 58.750 3.025 0.000 0.875
CB 62.764 63.523 4.288 0.833 0.833
N 114.381 116.135 5.326 1.000 0.900
HA 4.046 4.486 0.430 0.500 0.875
HB2 3.919 3.856 0.325 0.800 0.833
HB3 3.949 3.825 0.343 0.800 0.833
H 8.869 8.292 0.600 0.900 0.900
HG NA -- -- 0.000 0.000

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Detailed Probabilities of SER(35)-CA:

Overall probability: 0.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP34 0.00 1.00
SER35 0.00 0.80
ASP36 0.00 1.00

Expected NOESY Contacts
Proton Expected probability
D34HA 1.00
S35HB2 1.00
S35HB3 1.00
S35H 1.00
S35HG 1.00
S35HA 1.00
D36HA 1.00
D36H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP34 HA 1.00 2.457 0.00 0.00
SER35 HA 1.00 1.800 0.00 0.00
SER35 HB2 1.00 1.673 0.00 0.00
SER35 HB3 1.00 1.703 0.00 0.00
SER35 H 1.00 0.136 0.00 0.00
ASP36 HA 1.00 2.273 0.00 0.00
ASP36 H 1.00 0.617 0.00 0.00

Detailed Probabilities of SER(35)-CB:

Overall probability: 0.833
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
SER35 0.75 0.80
ASP36 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
S35HA 1.00
S35HB2 1.00
S35H 1.00
S35HG 1.00
S35HB3 1.00
D36H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
SER35 HA 1.00 0.108 0.00 0.00
SER35 HB2 1.00 0.019 1.00 14.42
SER35 HB3 1.00 0.011 1.00 14.42
SER35 H 1.00 0.003 1.00 0.45
ASP36 H 1.00 0.011 1.00 0.20
ASP36 HA 0.71 0.004 1.00 0.05

Detailed Probabilities of SER(35)-N:

Overall probability: 1.000
Overall confidence: 0.900

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP34 1.00 1.00
SER35 1.00 0.80
ASP36 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D34H 1.00
D34HB2 1.00
D34HA 1.00
D34HB3 1.00
S35HA 1.00
S35HB2 1.00
S35HB3 1.00
S35HG 1.00
S35H 1.00
D36H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP34 HA 1.00 0.003 1.00 -979840.00
ASP34 HB2 1.00 0.002 1.00 -601808.00
ASP34 HB3 1.00 0.003 1.00 -865116.00
ASP34 H 1.00 0.019 1.00 -111496.00
SER35 HA 1.00 0.001 1.00 -523841.00
SER35 HB2 1.00 0.015 1.00 -1028804.00
SER35 HB3 1.00 0.015 1.00 -1028804.00
SER35 H 1.00 0.003 1.00 -3412426.00
ASP36 H 1.00 0.010 1.00 -545988.00

Detailed Probabilities of SER(35)-HA:

Overall probability: 0.500
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP34 0.50 1.00
SER35 0.25 0.80
ASP36 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D34HA 1.00
S35HB2 1.00
S35HB3 1.00
S35H 1.00
S35HG 1.00
S35HA 1.00
D36HA 1.00
D36H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP34 HA 1.00 0.063 0.00 0.00
ASP34 H 0.84 0.026 1.00 -156276.00
SER35 HA 1.00 1.800 0.00 0.00
SER35 HB2 1.00 0.108 0.00 0.00
SER35 HB3 1.00 0.108 0.00 0.00
SER35 H 1.00 0.001 1.00 -523841.00
ASP36 HA 1.00 0.007 1.00 0.20
ASP36 H 1.00 0.009 1.00 -392761.00

Detailed Probabilities of SER(35)-HB2:

Overall probability: 0.800
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
SER35 0.75 0.80
ASP36 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
S35HA 1.00
S35HB3 1.00
S35H 1.00
S35HG 1.00
S35HB2 1.00
D36H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
SER35 HA 1.00 1.673 0.00 0.00
SER35 HB2 1.00 0.019 1.00 14.42
SER35 HB3 1.00 0.019 1.00 14.42
SER35 H 1.00 0.015 1.00 -1028804.00
ASP36 H 1.00 0.018 1.00 -454936.00

Detailed Probabilities of SER(35)-HB3:

Overall probability: 0.800
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
SER35 0.75 0.80
ASP36 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
S35HA 1.00
S35HB2 1.00
S35H 1.00
S35HG 1.00
S35HB3 1.00
D36H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
SER35 HA 1.00 1.703 0.00 0.00
SER35 HB2 1.00 0.011 1.00 14.42
SER35 HB3 1.00 0.011 1.00 14.42
SER35 H 1.00 0.015 1.00 -1028804.00
ASP36 H 1.00 0.012 1.00 -454936.00

Detailed Probabilities of SER(35)-H:

Overall probability: 0.900
Overall confidence: 0.900

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP34 1.00 1.00
SER35 0.75 0.80
ASP36 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D34H 1.00
D34HB2 1.00
D34HA 1.00
D34HB3 1.00
S35HA 1.00
S35HB2 1.00
S35HB3 1.00
S35HG 1.00
S35H 1.00
D36H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP34 HA 1.00 0.008 1.00 0.78
ASP34 HB2 1.00 0.005 1.00 0.28
ASP34 HB3 1.00 0.002 1.00 0.44
ASP34 H 1.00 0.010 1.00 -90754.00
SER35 HA 1.00 0.136 0.00 0.00
SER35 HB2 1.00 0.003 1.00 0.45
SER35 HB3 1.00 0.003 1.00 0.45
SER35 H 1.00 0.003 1.00 -3412426.00
ASP36 H 1.00 0.004 1.00 -444346.00
ASP36 HA 0.83 0.010 1.00 0.09