ARECA's report on THR92

Residue probability: 0.780
Residue probability confidence: 0.858

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 176.823 174.627 1.788 0.000 0.000
CA 66.793 62.330 4.136 0.500 0.875
CB 68.301 69.395 4.500 1.000 0.833
CG2 21.783 21.588 1.595 0.503 0.833
N 114.461 115.370 5.913 0.875 0.889
HA 3.977 4.461 0.626 0.778 0.875
HB 4.200 4.172 0.855 1.000 0.833
HG2 1.043 1.134 0.349 0.833 0.833
H 7.937 8.272 1.597 0.750 0.889
HG1 NA -- -- 0.000 0.000

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Detailed Probabilities of THR(92)-CA:

Overall probability: 0.500
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ALA91 0.50 1.00
THR92 0.50 0.80
ILE93 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
A91HA 1.00
T92HB 1.00
T92HG21 1.00
T92H 1.00
T92HG1 1.00
T92HA 1.00
I93HA 1.00
I93H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ALA91 HA 1.00 0.154 0.00 0.00
ALA91 HB1 0.67 0.010 1.00 0.19
THR92 HA 1.00 0.216 0.00 0.00
THR92 HB 1.00 0.007 1.00 0.63
THR92 HG21 1.00 0.004 1.00 1.36
THR92 H 1.00 0.309 0.00 0.00
ILE93 HA 1.00 0.316 0.00 0.00
ILE93 H 1.00 0.007 1.00 0.26

Detailed Probabilities of THR(92)-CB:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR92 1.00 0.80
ILE93 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
T92HA 1.00
T92HG21 1.00
T92H 1.00
T92HG1 1.00
T92HB 1.00
I93H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR92 HA 1.00 0.003 1.00 0.38
THR92 HB 1.00 0.002 1.00 3.09
THR92 HG21 1.00 0.004 1.00 1.11
THR92 H 1.00 0.009 1.00 0.83
ILE93 H 1.00 0.000 1.00 0.42
ILE93 HA 0.90 0.012 1.00 0.07

Detailed Probabilities of THR(92)-CG2:

Overall probability: 0.503
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR92 0.50 0.80
ILE93 0.51 1.00

Expected NOESY Contacts
Proton Expected probability
T92HA 1.00
T92HB 1.00
T92HG22 1.00
T92H 1.00
T92HG1 1.00
I93H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR92 HA 1.00 0.006 1.00 1.76
THR92 HB 1.00 0.001 1.00 1.44
THR92 HG21 1.00 0.198 0.00 0.00
THR92 H 1.00 0.460 0.00 0.00
ILE93 H 0.98 0.161 0.02 0.00
ILE93 HA 0.50 0.002 1.00 0.12

Detailed Probabilities of THR(92)-N:

Overall probability: 0.875
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ALA91 0.67 1.00
THR92 1.00 0.80
ILE93 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
A91HB1 1.00
A91H 1.00
A91HA 1.00
T92HA 1.00
T92HB 1.00
T92HG21 1.00
T92HG1 1.00
T92H 1.00
I93H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ALA91 HA 1.00 0.060 0.00 0.00
ALA91 HB1 1.00 0.013 1.00 -1806972.00
ALA91 H 1.00 0.003 1.00 -11257836.00
THR92 HA 1.00 0.002 1.00 -1251608.00
THR92 HB 1.00 0.004 1.00 -1698182.00
THR92 HG21 1.00 0.006 1.00 -596857.00
THR92 H 1.00 0.007 1.00 -11257836.00
ILE93 H 1.00 0.000 1.00 -993148.00

Detailed Probabilities of THR(92)-HA:

Overall probability: 0.778
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ALA91 0.00 1.00
THR92 0.75 0.80
ILE93 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
A91HA 1.00
T92HB 1.00
T92HG21 1.00
T92H 1.00
T92HG1 1.00
T92HA 1.00
I93HA 1.00
I93H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ALA91 HA 1.00 0.217 0.00 0.00
THR92 HA 1.00 0.216 0.00 0.00
THR92 HB 1.00 0.003 1.00 0.38
THR92 HG21 1.00 0.006 1.00 1.76
THR92 H 1.00 0.002 1.00 -1251608.00
ILE93 HA 1.00 0.007 1.00 0.06
ILE93 H 1.00 0.002 1.00 -563391.00
ILE93 HB 0.59 0.000 1.00 0.22
ILE93 HG12 0.57 0.000 1.00 0.05

Detailed Probabilities of THR(92)-HB:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR92 1.00 0.80
ILE93 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
T92HA 1.00
T92HG21 1.00
T92H 1.00
T92HG1 1.00
T92HB 1.00
I93H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR92 HA 1.00 0.007 1.00 0.63
THR92 HB 1.00 0.002 1.00 3.09
THR92 HG21 1.00 0.001 1.00 1.44
THR92 H 1.00 0.004 1.00 -1698182.00
ILE93 H 1.00 0.003 1.00 -836618.00
ILE93 HA 0.90 0.002 1.00 0.06

Detailed Probabilities of THR(92)-HG21:

Overall probability: 0.833
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR92 0.75 0.80
ILE93 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
T92HA 1.00
T92HB 1.00
T92HG22 1.00
T92H 1.00
T92HG1 1.00
I93H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR92 HA 1.00 0.004 1.00 1.36
THR92 HB 1.00 0.004 1.00 1.11
THR92 HG21 1.00 0.198 0.00 0.00
THR92 H 1.00 0.006 1.00 -596857.00
ILE93 H 0.98 0.001 1.00 -423365.00
ILE93 HA 0.50 0.004 1.00 0.20

Detailed Probabilities of THR(92)-H:

Overall probability: 0.750
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ALA91 1.00 1.00
THR92 0.50 0.80
ILE93 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
A91HB1 1.00
A91H 1.00
A91HA 1.00
T92HA 1.00
T92HB 1.00
T92HG21 1.00
T92HG1 1.00
T92H 1.00
I93H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ALA91 HA 1.00 0.010 1.00 0.87
ALA91 HB1 1.00 0.010 1.00 2.98
ALA91 H 1.00 0.012 1.00 -21352072.00
THR92 HA 1.00 0.309 0.00 0.00
THR92 HB 1.00 0.009 1.00 0.83
THR92 HG21 1.00 0.460 0.00 0.00
THR92 H 1.00 0.007 1.00 -11257836.00
ILE93 H 1.00 0.008 1.00 -1005309.00