ARECA's report on GLU52

Residue probability: 0.470
Residue probability confidence: 0.785

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 173.600 176.942 2.547 0.000 0.000
CA 56.254 57.442 3.837 0.263 0.889
CB 33.459 30.185 4.018 0.817 0.750
CG 36.666 36.085 1.533 0.500 0.750
N NA -- -- 0.000 0.000
HA 4.258 4.245 0.429 0.667 0.889
HB2 1.656 2.021 0.233 0.714 0.750
HB3 1.952 1.994 0.244 0.167 0.750
HG2 2.100 2.258 0.226 0.317 0.750
HG3 2.044 2.233 0.232 0.317 0.750
H NA -- -- 0.000 0.000
HE2 NA -- -- 0.000 0.000

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Detailed Probabilities of GLU(52)-CA:

Overall probability: 0.263
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
PHE51 0.40 1.00
GLU52 0.00 0.83
LYS53 0.85 1.00

Expected NOESY Contacts
Proton Expected probability
F51HA 1.00
E52HB2 1.00
E52HB3 1.00
E52HG2 1.00
E52HG3 1.00
E52H 1.00
E52HA 1.00
K53HA 1.00
K53H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
PHE51 HA 1.00 0.036 0.40 0.00
GLU52 HA 1.00 0.464 0.00 0.00
GLU52 HB2 1.00 0.589 0.00 0.00
GLU52 HB3 1.00 0.729 0.00 0.00
GLU52 HG2 1.00 0.581 0.00 0.00
GLU52 HG3 1.00 0.637 0.00 0.00
LYS53 HA 1.00 0.033 0.70 0.00
LYS53 H 1.00 0.009 1.00 0.75

Detailed Probabilities of GLU(52)-CB:

Overall probability: 0.817
Overall confidence: 0.750

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU52 0.78 0.71
LYS53 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E52HA 1.00
E52HB3 1.00
E52HG2 1.00
E52HG3 1.00
E52H 1.00
E52HE2 1.00
E52HB2 1.00
K53H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU52 HA 1.00 0.007 1.00 0.17
GLU52 HB2 1.00 0.020 1.00 1.51
GLU52 HB3 1.00 0.123 0.00 0.00
GLU52 HG2 1.00 0.025 1.00 0.34
GLU52 HG3 1.00 0.031 0.90 0.00
LYS53 H 1.00 0.005 1.00 0.09

Detailed Probabilities of GLU(52)-CG:

Overall probability: 0.500
Overall confidence: 0.750

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU52 0.40 0.71
LYS53 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E52HA 1.00
E52HB2 1.00
E52HB3 1.00
E52HG2 1.00
E52H 1.00
E52HE2 1.00
E52HG3 1.00
K53H 0.96


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU52 HA 1.00 0.003 1.00 0.30
GLU52 HB2 1.00 0.006 1.00 0.39
GLU52 HB3 1.00 0.187 0.00 0.00
GLU52 HG2 1.00 0.280 0.00 0.00
GLU52 HG3 1.00 0.279 0.00 0.00
LYS53 H 0.96 0.001 1.00 0.07

Detailed Probabilities of GLU(52)-HA:

Overall probability: 0.667
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
PHE51 0.50 1.00
GLU52 0.60 0.83
LYS53 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
F51HA 1.00
E52HB2 1.00
E52HB3 1.00
E52HG2 1.00
E52HG3 1.00
E52H 1.00
E52HA 1.00
K53HA 1.00
K53H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
PHE51 HA 1.00 0.609 0.00 0.00
PHE51 H 0.90 0.025 1.00 -103502.00
GLU52 HA 1.00 0.464 0.00 0.00
GLU52 HB2 1.00 0.007 1.00 0.17
GLU52 HB3 1.00 0.000 1.00 0.32
GLU52 HG2 1.00 2.599 0.00 0.00
GLU52 HG3 1.00 0.003 1.00 0.30
LYS53 HA 1.00 0.023 1.00 0.25
LYS53 H 1.00 0.004 1.00 -972184.00

Detailed Probabilities of GLU(52)-HB2:

Overall probability: 0.714
Overall confidence: 0.750

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU52 0.60 0.71
LYS53 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E52HA 1.00
E52HB3 1.00
E52HG2 1.00
E52HG3 1.00
E52H 1.00
E52HE2 1.00
E52HB2 1.00
K53H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU52 HA 1.00 0.589 0.00 0.00
GLU52 HB2 1.00 0.020 1.00 1.51
GLU52 HB3 1.00 0.538 0.00 0.00
GLU52 HG2 1.00 0.003 1.00 0.32
GLU52 HG3 1.00 0.006 1.00 0.39
LYS53 H 1.00 0.009 1.00 -230015.00
LYS53 HA 0.64 0.010 1.00 0.37

Detailed Probabilities of GLU(52)-HB3:

Overall probability: 0.167
Overall confidence: 0.750

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU52 0.00 0.71
LYS53 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E52HA 1.00
E52HB2 1.00
E52HG2 1.00
E52HG3 1.00
E52H 1.00
E52HE2 1.00
E52HB3 1.00
K53H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU52 HA 1.00 0.729 0.00 0.00
GLU52 HB2 1.00 0.123 0.00 0.00
GLU52 HB3 1.00 0.688 0.00 0.00
GLU52 HG2 1.00 0.293 0.00 0.00
GLU52 HG3 1.00 0.187 0.00 0.00
LYS53 H 1.00 0.005 1.00 -348647.00

Detailed Probabilities of GLU(52)-HG2:

Overall probability: 0.317
Overall confidence: 0.750

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU52 0.20 0.71
LYS53 0.90 1.00

Expected NOESY Contacts
Proton Expected probability
E52HA 1.00
E52HB2 1.00
E52HB3 1.00
E52HG3 1.00
E52H 1.00
E52HE2 1.00
E52HG2 1.00
K53H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU52 HA 1.00 0.581 0.00 0.00
GLU52 HB2 1.00 0.025 1.00 0.34
GLU52 HB3 1.00 0.540 0.00 0.00
GLU52 HG2 1.00 0.441 0.00 0.00
GLU52 HG3 1.00 0.280 0.00 0.00
LYS53 H 0.98 0.031 0.90 0.00

Detailed Probabilities of GLU(52)-HG3:

Overall probability: 0.317
Overall confidence: 0.750

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU52 0.18 0.71
LYS53 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E52HA 1.00
E52HB2 1.00
E52HB3 1.00
E52HG2 1.00
E52H 1.00
E52HE2 1.00
E52HG3 1.00
K53H 0.96


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU52 HA 1.00 0.637 0.00 0.00
GLU52 HB2 1.00 0.031 0.90 0.00
GLU52 HB3 1.00 0.596 0.00 0.00
GLU52 HG2 1.00 0.385 0.00 0.00
GLU52 HG3 1.00 0.279 0.00 0.00
LYS53 H 0.96 0.017 1.00 -179410.00