ARECA's report on SER70

Residue probability: 0.795
Residue probability confidence: 0.836

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 171.414 174.682 1.868 0.000 0.000
CA 57.424 58.750 3.025 1.000 0.875
CB 66.693 63.523 4.288 0.800 0.833
N 109.416 116.135 5.326 0.750 0.800
HA 5.098 4.486 0.430 0.714 0.875
HB2 3.614 3.856 0.325 0.800 0.833
HB3 3.901 3.825 0.343 1.000 0.833
H 7.226 8.292 0.600 0.500 0.800
HG NA -- -- 0.000 0.000

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Detailed Probabilities of SER(70)-CA:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP69 1.00 1.00
SER70 1.00 0.80
ILE71 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D69HA 1.00
S70HB2 1.00
S70HB3 1.00
S70H 1.00
S70HG 1.00
S70HA 1.00
I71HA 1.00
I71H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP69 HA 1.00 0.006 1.00 0.55
ASP69 HB3 0.82 0.016 1.00 0.17
SER70 HA 1.00 0.003 1.00 2.77
SER70 HB2 1.00 0.011 1.00 0.55
SER70 HB3 1.00 0.008 1.00 0.72
SER70 H 1.00 0.017 1.00 0.11
ILE71 HA 1.00 0.011 1.00 0.17
ILE71 H 1.00 0.008 1.00 0.90
ILE71 HG13 0.62 0.029 1.00 0.31

Detailed Probabilities of SER(70)-CB:

Overall probability: 0.800
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
SER70 0.75 0.80
ILE71 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
S70HA 1.00
S70HB3 1.00
S70H 1.00
S70HG 1.00
S70HB2 1.00
I71H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
SER70 HA 1.00 0.007 1.00 0.57
SER70 HB2 1.00 0.005 1.00 1.66
SER70 HB3 1.00 0.004 1.00 1.58
SER70 H 1.00 1.972 0.00 0.00
ILE71 H 1.00 0.007 1.00 0.45

Detailed Probabilities of SER(70)-N:

Overall probability: 0.750
Overall confidence: 0.800

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP69 0.67 0.75
SER70 0.75 0.80
ILE71 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D69H 1.00
D69HB2 1.00
D69HA 1.00
D69HB3 1.00
S70HA 1.00
S70HB2 1.00
S70HB3 1.00
S70HG 1.00
S70H 1.00
I71H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP69 HA 1.00 0.096 0.00 0.00
ASP69 HB2 1.00 0.013 1.00 -91470.00
ASP69 HB3 1.00 0.004 1.00 -98884.00
SER70 HA 1.00 0.007 1.00 -764246.00
SER70 HB2 1.00 0.087 0.00 0.00
SER70 HB3 1.00 0.010 1.00 -559546.00
SER70 H 1.00 0.004 1.00 -13554855.00
ILE71 H 1.00 0.004 1.00 -179463.00

Detailed Probabilities of SER(70)-HA:

Overall probability: 0.714
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP69 0.00 1.00
SER70 1.00 0.80
ILE71 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
D69HA 1.00
S70HB2 1.00
S70HB3 1.00
S70H 1.00
S70HG 1.00
S70HA 1.00
I71HA 1.00
I71H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP69 HA 1.00 0.138 0.00 0.00
SER70 HA 1.00 0.003 1.00 2.77
SER70 HB2 1.00 0.007 1.00 0.57
SER70 HB3 1.00 0.005 1.00 0.60
SER70 H 1.00 0.007 1.00 -764246.00
ILE71 HA 1.00 0.079 0.00 0.00
ILE71 H 1.00 0.006 1.00 -1365183.00

Detailed Probabilities of SER(70)-HB2:

Overall probability: 0.800
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
SER70 0.75 0.80
ILE71 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
S70HA 1.00
S70HB3 1.00
S70H 1.00
S70HG 1.00
S70HB2 1.00
I71H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
SER70 HA 1.00 0.011 1.00 0.55
SER70 HB2 1.00 0.005 1.00 1.66
SER70 HB3 1.00 0.003 1.00 1.54
SER70 H 1.00 0.087 0.00 0.00
ILE71 H 1.00 0.003 1.00 -761024.00

Detailed Probabilities of SER(70)-HB3:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
SER70 1.00 0.80
ILE71 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
S70HA 1.00
S70HB2 1.00
S70H 1.00
S70HG 1.00
S70HB3 1.00
I71H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
SER70 HA 1.00 0.008 1.00 0.72
SER70 HB2 1.00 0.004 1.00 1.58
SER70 HB3 1.00 0.001 1.00 2.09
SER70 H 1.00 0.010 1.00 -559546.00
ILE71 H 1.00 0.012 1.00 -598325.00

Detailed Probabilities of SER(70)-H:

Overall probability: 0.500
Overall confidence: 0.800

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP69 0.33 0.75
SER70 0.50 0.80
ILE71 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D69H 1.00
D69HB2 1.00
D69HA 1.00
D69HB3 1.00
S70HA 1.00
S70HB2 1.00
S70HB3 1.00
S70HG 1.00
S70H 1.00
I71H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP69 HA 1.00 0.106 0.00 0.00
ASP69 HB2 1.00 0.646 0.00 0.00
ASP69 HB3 1.00 0.003 1.00 0.05
SER70 HA 1.00 0.017 1.00 0.11
SER70 HB2 1.00 1.972 0.00 0.00
SER70 HB3 1.00 1.973 0.00 0.00
SER70 H 1.00 0.004 1.00 -13554855.00
ILE71 H 1.00 0.017 1.00 -171442.00