ARECA's report on ASP12

Residue probability: 0.929
Residue probability confidence: 0.886

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 178.089 176.463 2.348 0.000 0.000
CA 57.608 54.786 4.266 0.967 0.857
CB 41.161 40.949 3.070 1.000 0.800
N 126.315 120.550 5.690 0.878 1.000
HD2 NA -- -- 0.000 0.000
HA 4.273 4.587 0.329 0.857 0.857
HB 2.642 2.708 0.282 1.000 0.800
H 8.586 8.304 1.027 0.875 1.000

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Detailed Probabilities of ASP(12)-CA:

Overall probability: 0.967
Overall confidence: 0.857

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASN11 1.00 1.00
ASP12 1.00 0.75
GLU13 0.90 1.00

Expected NOESY Contacts
Proton Expected probability
N11HA 1.00
D12HD2 1.00
D12HB2 1.00
D12H 1.00
D12HA 1.00
E13H 1.00
E13HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASN11 HA 1.00 0.008 1.00 0.09
ASP12 HA 1.00 0.009 1.00 12.17
ASP12 HB2 1.00 0.002 1.00 1.35
ASP12 H 1.00 0.007 1.00 0.49
GLU13 HA 1.00 0.012 1.00 0.10
GLU13 H 1.00 0.032 0.80 0.00

Detailed Probabilities of ASP(12)-CB:

Overall probability: 1.000
Overall confidence: 0.800

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP12 1.00 0.75
GLU13 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D12HD2 1.00
D12HA 1.00
D12HB3 1.00
D12H 1.00
E13H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP12 HA 1.00 0.008 1.00 1.08
ASP12 HB2 1.00 0.007 1.00 25.87
ASP12 H 1.00 0.007 1.00 0.84
GLU13 H 1.00 0.006 1.00 0.42

Detailed Probabilities of ASP(12)-N:

Overall probability: 0.878
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASN11 0.72 1.00
ASP12 1.00 1.00
GLU13 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
N11HB3 1.00
N11HB2 1.00
N11HA 1.00
N11H 1.00
D12HA 1.00
D12HB2 1.00
D12H 1.00
E13H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASN11 HA 1.00 0.002 1.00 -2251462.00
ASN11 HB2 1.00 0.003 1.00 -94668.00
ASN11 HB3 1.00 0.098 0.00 0.00
ASN11 H 1.00 0.031 0.90 0.00
ASP12 HA 1.00 0.005 1.00 -862589.00
ASP12 HB2 1.00 0.004 1.00 -1883332.00
ASP12 H 1.00 0.005 1.00 -7359728.00
GLU13 H 1.00 0.005 1.00 -815091.00
GLU13 HA 0.86 0.000 1.00 -99629.00

Detailed Probabilities of ASP(12)-HA:

Overall probability: 0.857
Overall confidence: 0.857

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASN11 1.00 1.00
ASP12 1.00 0.75
GLU13 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
N11HA 1.00
D12HD2 1.00
D12HB2 1.00
D12H 1.00
D12HA 1.00
E13H 1.00
E13HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASN11 HA 1.00 0.026 1.00 0.19
ASN11 H 0.86 0.010 1.00 -103502.00
ASP12 HA 1.00 0.009 1.00 12.17
ASP12 HB2 1.00 0.008 1.00 1.08
ASP12 H 1.00 0.005 1.00 -862589.00
GLU13 HA 1.00 0.231 0.00 0.00
GLU13 H 1.00 0.008 1.00 -358055.00

Detailed Probabilities of ASP(12)-HB2:

Overall probability: 1.000
Overall confidence: 0.800

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASP12 1.00 0.75
GLU13 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
D12HD2 1.00
D12HA 1.00
D12HB3 1.00
D12H 1.00
E13H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASP12 HA 1.00 0.002 1.00 1.35
ASP12 HB2 1.00 0.007 1.00 25.87
ASP12 H 1.00 0.004 1.00 -1883332.00
GLU13 H 1.00 0.002 1.00 -809987.00
GLU13 HA 0.84 0.001 1.00 0.09

Detailed Probabilities of ASP(12)-H:

Overall probability: 0.875
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ASN11 0.75 1.00
ASP12 1.00 1.00
GLU13 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
N11HB3 1.00
N11HB2 1.00
N11HA 1.00
N11H 1.00
D12HA 1.00
D12HB2 1.00
D12H 1.00
E13H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ASN11 HA 1.00 0.006 1.00 1.66
ASN11 HB2 1.00 0.127 0.00 0.00
ASN11 HB3 1.00 0.005 1.00 0.10
ASN11 H 1.00 0.003 1.00 -192466.00
ASP12 HA 1.00 0.007 1.00 0.49
ASP12 HB2 1.00 0.007 1.00 0.84
ASP12 H 1.00 0.005 1.00 -7359728.00
GLU13 H 1.00 0.006 1.00 -642560.00