ARECA's report on LEU68

Residue probability: 0.835
Residue probability confidence: 1.000

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 178.869 177.056 1.929 0.000 0.000
CA 57.941 55.735 3.802 0.917 1.000
CB 40.875 42.389 3.750 0.875 1.000
CG 26.447 26.892 3.086 0.378 1.000
CD1 25.266 24.837 3.657 1.000 1.000
CD2 23.070 24.201 3.117 1.000 1.000
N 118.269 121.785 4.943 0.868 1.000
HA 3.779 4.315 0.840 0.883 1.000
HB2 1.747 1.601 0.373 0.875 1.000
HB3 1.381 1.508 0.398 0.889 1.000
HG 1.588 1.510 0.340 0.503 1.000
HD1 0.507 0.739 0.294 1.000 1.000
HD2 0.384 0.727 0.421 1.000 1.000
H 8.471 8.237 0.647 0.668 1.000

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Detailed Probabilities of LEU(68)-CA:

Overall probability: 0.917
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
MET67 1.00 1.00
LEU68 1.00 1.00
GLU69 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
M67HA 1.00
L68HB2 1.00
L68HB3 1.00
L68HG 1.00
L68HD11 0.99
L68HD21 0.99
L68H 1.00
L68HA 1.00
E69HA 1.00
E69H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
MET67 HA 1.00 0.020 1.00 0.19
MET67 HB2 0.66 0.022 1.00 0.08
MET67 HB3 0.84 0.002 1.00 0.11
LEU68 HA 1.00 0.001 1.00 3.73
LEU68 HB2 1.00 0.019 1.00 0.47
LEU68 HB3 1.00 0.003 1.00 0.48
LEU68 HG 1.00 0.008 1.00 0.34
LEU68 HD11 0.99 0.007 1.00 0.29
LEU68 HD21 0.99 0.003 1.00 1.09
LEU68 H 1.00 0.003 1.00 0.40
GLU69 HA 1.00 0.127 0.00 0.00
GLU69 H 1.00 0.015 1.00 0.14

Detailed Probabilities of LEU(68)-CB:

Overall probability: 0.875
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU68 0.86 1.00
GLU69 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
L68HA 1.00
L68HB2 1.00
L68HG 1.00
L68HD11 1.00
L68HD21 1.00
L68H 1.00
L68HB3 1.00
E69H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU68 HA 1.00 0.005 1.00 0.66
LEU68 HB2 1.00 0.008 1.00 3.76
LEU68 HB3 1.00 0.014 1.00 5.42
LEU68 HG 1.00 0.044 0.00 0.00
LEU68 HD11 1.00 0.005 1.00 0.61
LEU68 HD21 1.00 0.003 1.00 0.54
LEU68 H 1.00 0.001 1.00 0.42
GLU69 H 1.00 0.015 1.00 0.66

Detailed Probabilities of LEU(68)-CG:

Overall probability: 0.378
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU68 0.43 1.00
GLU69 0.02 1.00

Expected NOESY Contacts
Proton Expected probability
L68HA 1.00
L68HB2 1.00
L68HB3 1.00
L68HD11 1.00
L68HD21 1.00
L68H 1.00
L68HG 1.00
E69H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU68 HA 1.00 0.009 1.00 0.27
LEU68 HB2 1.00 0.101 0.00 0.00
LEU68 HB3 1.00 0.467 0.00 0.00
LEU68 HG 1.00 0.260 0.00 0.00
LEU68 HD11 1.00 0.005 1.00 0.40
LEU68 HD21 1.00 0.005 1.00 0.57
LEU68 H 1.00 0.070 0.00 0.00
GLU69 H 0.98 0.618 0.02 0.00

Detailed Probabilities of LEU(68)-CD1:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU68 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
L68HA 0.99
L68HB2 1.00
L68HB3 1.00
L68HG 1.00
L68HD12 1.00
L68HD21 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU68 HA 0.99 0.014 1.00 0.58
LEU68 HB2 1.00 0.004 1.00 0.58
LEU68 HB3 1.00 0.007 1.00 0.52
LEU68 HG 1.00 0.006 1.00 0.76
LEU68 HD11 1.00 0.005 1.00 26.19
LEU68 HD21 1.00 0.003 1.00 1.80
LEU68 H 0.86 0.002 1.00 0.15

Detailed Probabilities of LEU(68)-CD2:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU68 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
L68HA 0.99
L68HB2 1.00
L68HB3 1.00
L68HG 1.00
L68HD11 1.00
L68HD22 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU68 HA 0.99 0.007 1.00 1.14
LEU68 HB2 1.00 0.003 1.00 0.39
LEU68 HB3 1.00 0.010 1.00 0.59
LEU68 HG 1.00 0.005 1.00 0.92
LEU68 HD11 1.00 0.009 1.00 1.80
LEU68 HD21 1.00 0.002 1.00 30.62
LEU68 H 0.85 0.007 1.00 0.21

Detailed Probabilities of LEU(68)-N:

Overall probability: 0.868
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
MET67 0.67 1.00
LEU68 1.00 1.00
GLU69 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
M67HG2 0.99
M67HB2 1.00
M67HA 1.00
M67HB3 1.00
M67H 1.00
M67HG3 0.98
L68HA 1.00
L68HB2 1.00
L68HB3 1.00
L68HG 1.00
L68H 1.00
E69H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
MET67 HA 1.00 0.002 1.00 -284714.00
MET67 HB2 1.00 0.004 1.00 -485003.00
MET67 HB3 1.00 0.000 1.00 -600234.00
MET67 HG2 0.99 0.167 0.01 0.00
MET67 HG3 0.98 0.005 1.00 -167519.00
MET67 H 1.00 0.076 0.00 0.00
LEU68 HA 1.00 0.007 1.00 -832352.00
LEU68 HB2 1.00 0.004 1.00 -871434.00
LEU68 HB3 1.00 0.003 1.00 -612975.00
LEU68 HG 1.00 0.005 1.00 -986313.00
LEU68 H 1.00 0.001 1.00 -6357373.00
LEU68 HD11 0.88 0.003 1.00 -393886.00
LEU68 HD21 0.87 0.003 1.00 -336840.00
GLU69 H 1.00 0.007 1.00 -758646.00
GLU69 HB2 0.55 0.002 1.00 -485003.00

Detailed Probabilities of LEU(68)-HA:

Overall probability: 0.883
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
MET67 0.67 1.00
LEU68 1.00 1.00
GLU69 0.80 1.00

Expected NOESY Contacts
Proton Expected probability
M67HA 1.00
L68HB2 1.00
L68HB3 1.00
L68HG 1.00
L68HD11 0.99
L68HD21 0.99
L68H 1.00
L68HA 1.00
E69HA 1.00
E69H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
MET67 HA 1.00 1.007 0.00 0.00
MET67 HB3 0.84 0.015 1.00 0.06
MET67 H 0.93 0.006 1.00 -128672.00
LEU68 HA 1.00 0.001 1.00 3.73
LEU68 HB2 1.00 0.008 1.00 0.65
LEU68 HB3 1.00 0.005 1.00 0.66
LEU68 HG 1.00 0.009 1.00 0.27
LEU68 HD11 0.99 0.014 1.00 0.58
LEU68 HD21 0.99 0.007 1.00 1.14
LEU68 H 1.00 0.007 1.00 -832352.00
GLU69 HA 1.00 0.034 0.60 0.00
GLU69 H 1.00 0.019 1.00 -867318.00

Detailed Probabilities of LEU(68)-HB2:

Overall probability: 0.875
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU68 0.86 1.00
GLU69 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
L68HA 1.00
L68HB3 1.00
L68HG 1.00
L68HD11 1.00
L68HD21 1.00
L68H 1.00
L68HB2 1.00
E69H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU68 HA 1.00 0.019 1.00 0.47
LEU68 HB2 1.00 0.008 1.00 4.26
LEU68 HB3 1.00 0.008 1.00 3.76
LEU68 HG 1.00 0.101 0.00 0.00
LEU68 HD11 1.00 0.004 1.00 0.58
LEU68 HD21 1.00 0.003 1.00 0.39
LEU68 H 1.00 0.004 1.00 -871434.00
GLU69 H 1.00 0.001 1.00 -509652.00

Detailed Probabilities of LEU(68)-HB3:

Overall probability: 0.889
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU68 0.86 1.00
GLU69 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
L68HA 1.00
L68HB2 1.00
L68HG 1.00
L68HD11 1.00
L68HD21 1.00
L68H 1.00
L68HB3 1.00
E69H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU68 HA 1.00 0.003 1.00 0.48
LEU68 HB2 1.00 0.010 1.00 3.70
LEU68 HB3 1.00 0.014 1.00 5.42
LEU68 HG 1.00 0.467 0.00 0.00
LEU68 HD11 1.00 0.007 1.00 0.52
LEU68 HD21 1.00 0.010 1.00 0.59
LEU68 H 1.00 0.003 1.00 -612975.00
GLU69 H 1.00 0.002 1.00 -388179.00
GLU69 HA 0.90 0.023 1.00 1.34

Detailed Probabilities of LEU(68)-HG:

Overall probability: 0.503
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU68 0.57 1.00
GLU69 0.02 1.00

Expected NOESY Contacts
Proton Expected probability
L68HA 1.00
L68HB2 1.00
L68HB3 1.00
L68HD11 1.00
L68HD21 1.00
L68H 1.00
L68HG 1.00
E69H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU68 HA 1.00 0.008 1.00 0.34
LEU68 HB2 1.00 0.040 0.00 0.00
LEU68 HB3 1.00 0.044 0.00 0.00
LEU68 HG 1.00 0.260 0.00 0.00
LEU68 HD11 1.00 0.006 1.00 0.76
LEU68 HD21 1.00 0.005 1.00 0.92
LEU68 H 1.00 0.005 1.00 -986313.00
GLU69 H 0.98 0.040 0.02 0.00

Detailed Probabilities of LEU(68)-HD11:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU68 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
L68HA 0.99
L68HB2 1.00
L68HB3 1.00
L68HG 1.00
L68HD12 1.00
L68HD21 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU68 HA 0.99 0.007 1.00 0.29
LEU68 HB2 1.00 0.005 1.00 0.70
LEU68 HB3 1.00 0.005 1.00 0.61
LEU68 HG 1.00 0.005 1.00 0.40
LEU68 HD11 1.00 0.005 1.00 26.19
LEU68 HD21 1.00 0.009 1.00 1.80
LEU68 H 0.86 0.003 1.00 -393886.00

Detailed Probabilities of LEU(68)-HD21:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU68 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
L68HA 0.99
L68HB2 1.00
L68HB3 1.00
L68HG 1.00
L68HD11 1.00
L68HD22 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU68 HA 0.99 0.003 1.00 1.09
LEU68 HB2 1.00 0.003 1.00 0.50
LEU68 HB3 1.00 0.003 1.00 0.54
LEU68 HG 1.00 0.005 1.00 0.57
LEU68 HD11 1.00 0.003 1.00 1.80
LEU68 HD21 1.00 0.002 1.00 30.62
LEU68 H 0.85 0.003 1.00 -336840.00

Detailed Probabilities of LEU(68)-H:

Overall probability: 0.668
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
MET67 0.34 1.00
LEU68 0.86 1.00
GLU69 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
M67HG2 0.99
M67HB2 1.00
M67HA 1.00
M67HB3 1.00
M67H 1.00
M67HG3 0.98
L68HA 1.00
L68HB2 1.00
L68HB3 1.00
L68HG 1.00
L68H 1.00
E69H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
MET67 HA 1.00 0.011 1.00 0.16
MET67 HB2 1.00 0.082 0.00 0.00
MET67 HB3 1.00 0.065 0.00 0.00
MET67 HG2 0.99 0.072 0.01 0.00
MET67 HG3 0.98 0.020 1.00 0.08
MET67 H 1.00 0.065 0.00 0.00
LEU68 HA 1.00 0.003 1.00 0.40
LEU68 HB2 1.00 0.002 1.00 0.55
LEU68 HB3 1.00 0.001 1.00 0.42
LEU68 HG 1.00 0.070 0.00 0.00
LEU68 H 1.00 0.001 1.00 -6357373.00
LEU68 HD11 0.88 0.002 1.00 0.15
LEU68 HD21 0.87 0.007 1.00 0.21
GLU69 H 1.00 0.000 1.00 -729112.00
GLU69 HB2 0.55 0.009 1.00 0.06