ARECA's report on VAL73

Residue probability: 0.665
Residue probability confidence: 0.982

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 173.754 175.682 2.367 0.000 0.000
CA 61.521 62.613 4.828 0.667 1.000
CB 34.387 32.918 4.591 0.000 1.000
CG1 22.601 21.563 2.746 0.857 1.000
CG2 22.053 21.368 2.801 0.800 1.000
N 129.570 121.057 5.832 0.870 0.909
HA 4.719 4.178 0.599 0.625 1.000
HB 2.313 1.980 0.322 0.833 1.000
HG1 1.156 0.816 0.264 0.500 1.000
HG2 0.944 0.803 0.504 0.800 1.000
H 9.241 8.311 0.669 0.700 0.909

[Back]

Detailed Probabilities of VAL(73)-CA:

Overall probability: 0.667
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR72 0.00 1.00
VAL73 0.80 1.00
THR74 0.67 1.00

Expected NOESY Contacts
Proton Expected probability
T72HA 1.00
V73HG11 1.00
V73HG21 1.00
V73H 1.00
V73HB 1.00
V73HA 1.00
T74H 1.00
T74HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR72 HA 1.00 0.053 0.00 0.00
VAL73 HA 1.00 0.003 1.00 2.30
VAL73 HB 1.00 0.021 1.00 0.23
VAL73 HG11 1.00 0.004 1.00 0.70
VAL73 HG21 1.00 0.006 1.00 0.87
VAL73 H 1.00 0.116 0.00 0.00
THR74 HA 1.00 0.054 0.00 0.00
THR74 H 1.00 0.010 1.00 1.22
THR74 HB 0.53 0.019 1.00 0.68

Detailed Probabilities of VAL(73)-CB:

Overall probability: 0.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL73 0.00 1.00
THR74 0.00 1.00

Expected NOESY Contacts
Proton Expected probability
V73HA 1.00
V73HG11 1.00
V73HG21 1.00
V73H 1.00
V73HB 1.00
T74H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL73 HA 1.00 3.954 0.00 0.00
VAL73 HB 1.00 1.548 0.00 0.00
VAL73 HG11 1.00 0.391 0.00 0.00
VAL73 HG21 1.00 0.179 0.00 0.00
VAL73 H 1.00 8.476 0.00 0.00
THR74 H 1.00 8.009 0.00 0.00

Detailed Probabilities of VAL(73)-CG1:

Overall probability: 0.857
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL73 0.80 1.00
THR74 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V73HA 1.00
V73HG12 1.00
V73HG21 1.00
V73H 1.00
V73HB 1.00
T74H 0.97


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL73 HA 1.00 0.002 1.00 0.89
VAL73 HB 1.00 0.002 1.00 1.71
VAL73 HG11 1.00 0.094 0.00 0.00
VAL73 HG21 1.00 0.002 1.00 3.71
VAL73 H 1.00 0.017 1.00 0.29
THR74 H 0.97 0.003 1.00 1.02
THR74 HA 0.52 0.005 1.00 0.11

Detailed Probabilities of VAL(73)-CG2:

Overall probability: 0.800
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL73 0.80 1.00

Expected NOESY Contacts
Proton Expected probability
V73HA 1.00
V73HG11 1.00
V73HG22 1.00
V73H 1.00
V73HB 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL73 HA 1.00 0.178 0.00 0.00
VAL73 HB 1.00 0.002 1.00 1.76
VAL73 HG11 1.00 0.003 1.00 2.97
VAL73 HG21 1.00 0.001 1.00 42.47
VAL73 H 1.00 0.003 1.00 0.55

Detailed Probabilities of VAL(73)-N:

Overall probability: 0.870
Overall confidence: 0.909

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR72 1.00 0.80
VAL73 0.80 1.00
THR74 0.70 1.00

Expected NOESY Contacts
Proton Expected probability
T72HG22 0.97
T72HA 1.00
T72HG1 0.96
T72HB 1.00
T72H 1.00
V73HA 1.00
V73HG11 1.00
V73HG21 1.00
V73HB 1.00
V73H 1.00
T74H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR72 HA 1.00 0.002 1.00 -2335535.00
THR72 HB 1.00 0.004 1.00 -131629.00
THR72 HG21 0.98 0.004 1.00 -1366095.00
THR72 H 1.00 0.007 1.00 -116050.00
VAL73 HA 1.00 0.002 1.00 -417961.00
VAL73 HB 1.00 0.003 1.00 -1011661.00
VAL73 HG11 1.00 0.074 0.00 0.00
VAL73 HG21 1.00 0.000 1.00 -1115092.00
VAL73 H 1.00 0.009 1.00 -7716785.00
THR74 H 1.00 0.033 0.70 0.00

Detailed Probabilities of VAL(73)-HA:

Overall probability: 0.625
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR72 1.00 1.00
VAL73 0.60 1.00
THR74 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
T72HA 1.00
V73HG11 1.00
V73HG21 1.00
V73H 1.00
V73HB 1.00
V73HA 1.00
T74H 1.00
T74HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR72 HA 1.00 0.015 1.00 0.10
VAL73 HA 1.00 0.003 1.00 2.30
VAL73 HB 1.00 3.954 0.00 0.00
VAL73 HG11 1.00 0.002 1.00 0.89
VAL73 HG21 1.00 0.178 0.00 0.00
VAL73 H 1.00 0.002 1.00 -417961.00
THR74 HA 1.00 0.086 0.00 0.00
THR74 H 1.00 0.005 1.00 -2130336.00

Detailed Probabilities of VAL(73)-HB:

Overall probability: 0.833
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL73 0.80 1.00
THR74 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V73HA 1.00
V73HG11 1.00
V73HG21 1.00
V73H 1.00
V73HB 1.00
T74H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL73 HA 1.00 0.021 1.00 0.23
VAL73 HB 1.00 1.548 0.00 0.00
VAL73 HG11 1.00 0.002 1.00 1.71
VAL73 HG21 1.00 0.002 1.00 1.76
VAL73 H 1.00 0.003 1.00 -1011661.00
THR74 H 1.00 0.004 1.00 -185153.00

Detailed Probabilities of VAL(73)-HG11:

Overall probability: 0.500
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL73 0.40 1.00
THR74 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V73HA 1.00
V73HG12 1.00
V73HG21 1.00
V73H 1.00
V73HB 1.00
T74H 0.97


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL73 HA 1.00 0.004 1.00 0.70
VAL73 HB 1.00 0.391 0.00 0.00
VAL73 HG11 1.00 0.094 0.00 0.00
VAL73 HG21 1.00 0.003 1.00 2.97
VAL73 H 1.00 0.074 0.00 0.00
THR74 H 0.97 0.004 1.00 -1812448.00

Detailed Probabilities of VAL(73)-HG21:

Overall probability: 0.800
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL73 0.80 1.00

Expected NOESY Contacts
Proton Expected probability
V73HA 1.00
V73HG11 1.00
V73HG22 1.00
V73H 1.00
V73HB 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL73 HA 1.00 0.006 1.00 0.87
VAL73 HB 1.00 0.179 0.00 0.00
VAL73 HG11 1.00 0.002 1.00 3.71
VAL73 HG21 1.00 0.001 1.00 42.47
VAL73 H 1.00 0.000 1.00 -1115092.00

Detailed Probabilities of VAL(73)-H:

Overall probability: 0.700
Overall confidence: 0.909

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR72 1.00 0.80
VAL73 0.60 1.00
THR74 0.00 1.00

Expected NOESY Contacts
Proton Expected probability
T72HG22 0.97
T72HA 1.00
T72HG1 0.96
T72HB 1.00
T72H 1.00
V73HA 1.00
V73HG11 1.00
V73HG21 1.00
V73HB 1.00
V73H 1.00
T74H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR72 HA 1.00 0.008 1.00 1.07
THR72 HB 1.00 0.016 1.00 0.06
THR72 HG21 0.98 0.006 1.00 0.95
THR72 H 1.00 0.030 1.00 -123043.00
VAL73 HA 1.00 0.116 0.00 0.00
VAL73 HB 1.00 8.476 0.00 0.00
VAL73 HG11 1.00 0.017 1.00 0.29
VAL73 HG21 1.00 0.003 1.00 0.55
VAL73 H 1.00 0.009 1.00 -7716785.00
THR74 H 1.00 0.059 0.00 0.00