ARECA's report on VAL78

Residue probability: 0.946
Residue probability confidence: 1.000

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 174.162 175.682 2.367 0.000 0.000
CA 60.229 62.613 4.828 0.778 1.000
CB 34.355 32.918 4.591 1.000 1.000
CG1 21.108 21.563 2.746 1.000 1.000
CG2 22.145 21.368 2.801 1.000 1.000
N 124.071 121.057 5.832 1.000 1.000
HA 5.166 4.178 0.599 0.750 1.000
HB 1.557 1.980 0.322 1.000 1.000
HG1 0.615 0.816 0.264 1.000 1.000
HG2 0.725 0.803 0.504 1.000 1.000
H 7.830 8.311 0.669 0.936 1.000

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Detailed Probabilities of VAL(78)-CA:

Overall probability: 0.778
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS77 0.00 1.00
VAL78 1.00 1.00
PHE79 0.67 1.00

Expected NOESY Contacts
Proton Expected probability
K77HA 1.00
V78HG11 1.00
V78HG21 1.00
V78H 1.00
V78HB 1.00
V78HA 1.00
F79H 1.00
F79HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS77 HA 1.00 0.284 0.00 0.00
VAL78 HA 1.00 0.001 1.00 0.38
VAL78 HB 1.00 0.000 1.00 0.04
VAL78 HG11 1.00 0.000 1.00 0.09
VAL78 HG21 1.00 0.000 1.00 0.09
VAL78 H 1.00 0.000 1.00 0.02
PHE79 HA 1.00 0.265 0.00 0.00
PHE79 H 1.00 0.000 1.00 0.20
PHE79 HB2 0.52 0.028 1.00 0.01

Detailed Probabilities of VAL(78)-CB:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL78 1.00 1.00
PHE79 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V78HA 1.00
V78HG11 1.00
V78HG21 1.00
V78H 1.00
V78HB 1.00
F79H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL78 HA 1.00 0.001 1.00 0.03
VAL78 HB 1.00 0.000 1.00 0.64
VAL78 HG11 1.00 0.000 1.00 0.19
VAL78 HG21 1.00 0.000 1.00 0.20
VAL78 H 1.00 0.000 1.00 0.09
PHE79 H 1.00 0.000 1.00 0.01
PHE79 HA 0.85 0.024 1.00 0.02

Detailed Probabilities of VAL(78)-CG1:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL78 1.00 1.00
PHE79 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V78HA 1.00
V78HG12 1.00
V78HG21 1.00
V78H 1.00
V78HB 1.00
F79H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL78 HA 1.00 0.001 1.00 0.12
VAL78 HB 1.00 0.000 1.00 0.27
VAL78 HG11 1.00 0.000 1.00 7.59
VAL78 HG21 1.00 0.000 1.00 0.80
VAL78 H 1.00 0.000 1.00 0.05
PHE79 H 0.98 0.000 1.00 0.10
PHE79 HA 0.60 0.014 1.00 0.03

Detailed Probabilities of VAL(78)-CG2:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL78 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V78HA 1.00
V78HG11 1.00
V78HG22 1.00
V78H 1.00
V78HB 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL78 HA 1.00 0.001 1.00 0.14
VAL78 HB 1.00 0.000 1.00 0.27
VAL78 HG11 1.00 0.000 1.00 0.50
VAL78 HG21 1.00 0.000 1.00 8.57
VAL78 H 1.00 0.000 1.00 0.12

Detailed Probabilities of VAL(78)-N:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS77 1.00 1.00
VAL78 1.00 1.00
PHE79 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K77HG2 0.98
K77HG3 0.96
K77HA 1.00
K77HB3 1.00
K77HB2 1.00
K77H 1.00
V78HA 1.00
V78HG11 1.00
V78HG21 1.00
V78HB 1.00
V78H 1.00
F79H 1.00
F79HA 0.96


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS77 HA 1.00 0.000 1.00 -12720.00
LYS77 HB2 1.00 0.000 1.00 -1383.00
LYS77 HB3 1.00 0.000 1.00 -1383.00
LYS77 HG2 0.98 0.000 1.00 -111.00
LYS77 HG3 0.96 0.000 1.00 -917.00
LYS77 H 1.00 0.000 1.00 -333.00
LYS77 HD2 0.56 0.000 1.00 -2480.00
LYS77 HD3 0.58 0.000 1.00 -2480.00
VAL78 HA 1.00 0.001 1.00 -1357.00
VAL78 HB 1.00 0.000 1.00 -4289.00
VAL78 HG11 1.00 0.000 1.00 -2235.00
VAL78 HG21 1.00 0.000 1.00 -4505.00
VAL78 H 1.00 0.000 1.00 -34900.00
PHE79 HA 0.96 0.019 1.00 -12720.00
PHE79 H 1.00 0.000 1.00 -161.00

Detailed Probabilities of VAL(78)-HA:

Overall probability: 0.750
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS77 0.00 1.00
VAL78 1.00 1.00
PHE79 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
K77HA 1.00
V78HG11 1.00
V78HG21 1.00
V78H 1.00
V78HB 1.00
V78HA 1.00
F79H 1.00
F79HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS77 HA 1.00 0.618 0.00 0.00
VAL78 HA 1.00 0.001 1.00 0.38
VAL78 HB 1.00 0.001 1.00 0.03
VAL78 HG11 1.00 0.001 1.00 0.12
VAL78 HG21 1.00 0.001 1.00 0.14
VAL78 H 1.00 0.001 1.00 -1357.00
PHE79 HA 1.00 0.599 0.00 0.00
PHE79 H 1.00 0.001 1.00 -10640.00

Detailed Probabilities of VAL(78)-HB:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL78 1.00 1.00
PHE79 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V78HA 1.00
V78HG11 1.00
V78HG21 1.00
V78H 1.00
V78HB 1.00
F79H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL78 HA 1.00 0.000 1.00 0.04
VAL78 HB 1.00 0.000 1.00 0.64
VAL78 HG11 1.00 0.000 1.00 0.27
VAL78 HG21 1.00 0.000 1.00 0.27
VAL78 H 1.00 0.000 1.00 -4289.00
PHE79 H 1.00 0.000 1.00 -865.00

Detailed Probabilities of VAL(78)-HG11:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL78 1.00 1.00
PHE79 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V78HA 1.00
V78HG12 1.00
V78HG21 1.00
V78H 1.00
V78HB 1.00
F79H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL78 HA 1.00 0.000 1.00 0.09
VAL78 HB 1.00 0.000 1.00 0.19
VAL78 HG11 1.00 0.000 1.00 7.59
VAL78 HG21 1.00 0.000 1.00 0.50
VAL78 H 1.00 0.000 1.00 -2235.00
PHE79 H 0.98 0.000 1.00 -5003.00
PHE79 HA 0.60 0.021 1.00 0.02

Detailed Probabilities of VAL(78)-HG21:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL78 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V78HA 1.00
V78HG11 1.00
V78HG22 1.00
V78H 1.00
V78HB 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL78 HA 1.00 0.000 1.00 0.09
VAL78 HB 1.00 0.000 1.00 0.20
VAL78 HG11 1.00 0.000 1.00 0.80
VAL78 HG21 1.00 0.000 1.00 8.57
VAL78 H 1.00 0.000 1.00 -4505.00

Detailed Probabilities of VAL(78)-H:

Overall probability: 0.936
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS77 1.00 1.00
VAL78 1.00 1.00
PHE79 0.52 1.00

Expected NOESY Contacts
Proton Expected probability
K77HG2 0.98
K77HG3 0.96
K77HA 1.00
K77HB3 1.00
K77HB2 1.00
K77H 1.00
V78HA 1.00
V78HG11 1.00
V78HG21 1.00
V78HB 1.00
V78H 1.00
F79H 1.00
F79HA 0.96


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS77 HA 1.00 0.000 1.00 0.22
LYS77 HB2 1.00 0.000 1.00 0.05
LYS77 HB3 1.00 0.000 1.00 0.05
LYS77 HG2 0.98 0.000 1.00 0.02
LYS77 HG3 0.96 0.000 1.00 0.02
LYS77 H 1.00 0.000 1.00 -202.00
LYS77 HD2 0.56 0.000 1.00 0.06
LYS77 HD3 0.58 0.000 1.00 0.06
VAL78 HA 1.00 0.000 1.00 0.02
VAL78 HB 1.00 0.000 1.00 0.09
VAL78 HG11 1.00 0.000 1.00 0.05
VAL78 HG21 1.00 0.000 1.00 0.12
VAL78 H 1.00 0.000 1.00 -34900.00
PHE79 HA 0.96 0.110 0.04 0.00
PHE79 H 1.00 0.000 1.00 -34.00