ARECA's report on GLU76

Residue probability: 0.915
Residue probability confidence: 0.925

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 175.080 176.942 2.547 0.000 0.000
CA 59.351 57.442 3.837 0.889 1.000
CB 31.094 30.185 4.018 0.862 0.875
CG 35.337 36.085 1.533 1.000 0.875
N 117.065 120.574 4.837 0.925 1.000
HA 3.779 4.245 0.429 0.900 1.000
HB2 1.897 2.021 0.233 1.000 0.875
HB3 1.895 1.994 0.244 1.000 0.875
HG2 2.185 2.258 0.226 0.786 0.875
HG3 2.186 2.233 0.232 0.786 0.875
H 8.268 8.332 0.601 1.000 1.000
HE2 NA -- -- 0.000 0.000

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Detailed Probabilities of GLU(76)-CA:

Overall probability: 0.889
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 1.00 1.00
GLU76 1.00 1.00
ASN77 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
K75HA 1.00
E76HB2 1.00
E76HB3 1.00
E76HG2 1.00
E76HG3 1.00
E76H 1.00
E76HA 1.00
N77HA 1.00
N77H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HA 1.00 0.011 1.00 0.18
GLU76 HA 1.00 0.002 1.00 10.66
GLU76 HB2 1.00 0.003 1.00 1.93
GLU76 HB3 1.00 0.005 1.00 1.93
GLU76 HG2 1.00 0.004 1.00 0.75
GLU76 HG3 1.00 0.005 1.00 0.75
GLU76 H 1.00 0.002 1.00 0.83
ASN77 HA 1.00 0.130 0.00 0.00
ASN77 H 1.00 0.003 1.00 0.25

Detailed Probabilities of GLU(76)-CB:

Overall probability: 0.862
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU76 0.82 0.86
ASN77 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E76HA 1.00
E76HB3 1.00
E76HG2 1.00
E76HG3 1.00
E76H 1.00
E76HE2 1.00
E76HB2 1.00
N77H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU76 HA 1.00 0.001 1.00 1.77
GLU76 HB2 1.00 0.004 1.00 92.80
GLU76 HB3 1.00 0.006 1.00 92.80
GLU76 HG2 1.00 0.035 0.50 0.00
GLU76 HG3 1.00 0.036 0.40 0.00
GLU76 H 1.00 0.002 1.00 2.22
ASN77 H 1.00 0.003 1.00 0.78
ASN77 HA 0.65 0.010 1.00 0.09

Detailed Probabilities of GLU(76)-CG:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU76 1.00 0.86
ASN77 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E76HA 1.00
E76HB2 1.00
E76HB3 1.00
E76HG3 1.00
E76H 1.00
E76HE2 1.00
E76HG2 1.00
N77H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU76 HA 1.00 0.005 1.00 1.18
GLU76 HB2 1.00 0.005 1.00 4.58
GLU76 HB3 1.00 0.007 1.00 4.58
GLU76 HG2 1.00 0.002 1.00 105.45
GLU76 HG3 1.00 0.003 1.00 105.45
GLU76 H 1.00 0.003 1.00 1.16
ASN77 H 0.97 0.004 1.00 0.38

Detailed Probabilities of GLU(76)-N:

Overall probability: 0.925
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 0.84 1.00
GLU76 1.00 1.00
ASN77 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K75HG3 0.97
K75HB2 1.00
K75HA 1.00
K75H 1.00
K75HB3 1.00
E76HA 1.00
E76HB2 1.00
E76HB3 1.00
E76HG2 1.00
E76HG3 1.00
E76H 1.00
N77H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HA 1.00 0.003 1.00 -2829488.00
LYS75 HB2 1.00 0.003 1.00 -1255238.00
LYS75 HB3 1.00 0.004 1.00 -850114.00
LYS75 HG2 0.98 0.048 0.02 0.00
LYS75 H 1.00 0.010 1.00 -122692.00
LYS75 HD2 0.59 0.013 1.00 -83707.00
GLU76 HA 1.00 0.000 1.00 -1466059.00
GLU76 HB2 1.00 0.001 1.00 -4261351.00
GLU76 HB3 1.00 0.003 1.00 -4261351.00
GLU76 HG2 1.00 0.006 1.00 -1311700.00
GLU76 HG3 1.00 0.007 1.00 -1311700.00
GLU76 H 1.00 0.002 1.00 -13068305.00
ASN77 H 1.00 0.003 1.00 -793418.00

Detailed Probabilities of GLU(76)-HA:

Overall probability: 0.900
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 1.00 1.00
GLU76 1.00 1.00
ASN77 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
K75HA 1.00
E76HB2 1.00
E76HB3 1.00
E76HG2 1.00
E76HG3 1.00
E76H 1.00
E76HA 1.00
N77HA 1.00
N77H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HA 1.00 0.013 1.00 0.08
LYS75 HB2 0.65 0.014 1.00 0.05
GLU76 HA 1.00 0.002 1.00 10.66
GLU76 HB2 1.00 0.001 1.00 1.77
GLU76 HB3 1.00 0.001 1.00 1.77
GLU76 HG2 1.00 0.005 1.00 1.18
GLU76 HG3 1.00 0.005 1.00 1.18
GLU76 H 1.00 0.000 1.00 -1466059.00
ASN77 HA 1.00 0.195 0.00 0.00
ASN77 H 1.00 0.001 1.00 -498283.00

Detailed Probabilities of GLU(76)-HB2:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU76 1.00 0.86
ASN77 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E76HA 1.00
E76HB3 1.00
E76HG2 1.00
E76HG3 1.00
E76H 1.00
E76HE2 1.00
E76HB2 1.00
N77H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU76 HA 1.00 0.003 1.00 1.93
GLU76 HB2 1.00 0.004 1.00 92.80
GLU76 HB3 1.00 0.004 1.00 92.80
GLU76 HG2 1.00 0.005 1.00 4.58
GLU76 HG3 1.00 0.005 1.00 4.58
GLU76 H 1.00 0.001 1.00 -4261351.00
ASN77 H 1.00 0.001 1.00 -1565706.00

Detailed Probabilities of GLU(76)-HB3:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU76 1.00 0.86
ASN77 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E76HA 1.00
E76HB2 1.00
E76HG2 1.00
E76HG3 1.00
E76H 1.00
E76HE2 1.00
E76HB3 1.00
N77H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU76 HA 1.00 0.005 1.00 1.93
GLU76 HB2 1.00 0.006 1.00 92.80
GLU76 HB3 1.00 0.006 1.00 92.80
GLU76 HG2 1.00 0.007 1.00 4.58
GLU76 HG3 1.00 0.007 1.00 4.58
GLU76 H 1.00 0.003 1.00 -4261351.00
ASN77 H 1.00 0.001 1.00 -1565706.00
ASN77 HB2 0.50 0.005 1.00 0.08

Detailed Probabilities of GLU(76)-HG2:

Overall probability: 0.786
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU76 0.75 0.86
ASN77 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E76HA 1.00
E76HB2 1.00
E76HB3 1.00
E76HG3 1.00
E76H 1.00
E76HE2 1.00
E76HG2 1.00
N77H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU76 HA 1.00 0.005 1.00 0.75
GLU76 HB2 1.00 0.035 0.50 0.00
GLU76 HB3 1.00 0.122 0.00 0.00
GLU76 HG2 1.00 0.003 1.00 105.45
GLU76 HG3 1.00 0.003 1.00 105.45
GLU76 H 1.00 0.007 1.00 -1311700.00
ASN77 H 0.97 0.005 1.00 -459860.00

Detailed Probabilities of GLU(76)-HG3:

Overall probability: 0.786
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU76 0.75 0.86
ASN77 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E76HA 1.00
E76HB2 1.00
E76HB3 1.00
E76HG2 1.00
E76H 1.00
E76HE2 1.00
E76HG3 1.00
N77H 0.97


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU76 HA 1.00 0.005 1.00 0.75
GLU76 HB2 1.00 0.035 0.50 0.00
GLU76 HB3 1.00 0.122 0.00 0.00
GLU76 HG2 1.00 0.003 1.00 105.45
GLU76 HG3 1.00 0.003 1.00 105.45
GLU76 H 1.00 0.007 1.00 -1311700.00
ASN77 H 0.97 0.005 1.00 -459860.00

Detailed Probabilities of GLU(76)-H:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 1.00 1.00
GLU76 1.00 1.00
ASN77 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K75HG3 0.97
K75HB2 1.00
K75HA 1.00
K75H 1.00
K75HB3 1.00
E76HA 1.00
E76HB2 1.00
E76HB3 1.00
E76HG2 1.00
E76HG3 1.00
E76H 1.00
N77H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HA 1.00 0.004 1.00 1.10
LYS75 HB2 1.00 0.004 1.00 0.28
LYS75 HB3 1.00 0.004 1.00 0.21
LYS75 HG2 0.98 0.008 1.00 0.07
LYS75 H 1.00 0.000 1.00 -146731.00
GLU76 HA 1.00 0.002 1.00 0.83
GLU76 HB2 1.00 0.002 1.00 2.22
GLU76 HB3 1.00 0.002 1.00 2.22
GLU76 HG2 1.00 0.003 1.00 1.16
GLU76 HG3 1.00 0.003 1.00 1.16
GLU76 H 1.00 0.002 1.00 -13068305.00
ASN77 H 1.00 0.001 1.00 -878518.00
ASN77 HA 0.83 0.001 1.00 1.00