ARECA's report on GLU66

Residue probability: 0.965
Residue probability confidence: 0.925

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 178.893 176.942 2.547 0.000 0.000
CA 59.119 57.442 3.837 0.833 1.000
CB 29.262 30.185 4.018 1.000 0.875
CG 36.010 36.085 1.533 1.000 0.875
N 119.362 120.574 4.837 1.000 1.000
HA 4.026 4.245 0.429 0.818 1.000
HB2 2.040 2.021 0.233 1.000 0.875
HB3 2.093 1.994 0.244 1.000 0.875
HG2 2.391 2.258 0.226 1.000 0.875
HG3 2.187 2.233 0.232 1.000 0.875
H 7.803 8.332 0.601 1.000 1.000
HE2 NA -- -- 0.000 0.000

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Detailed Probabilities of GLU(66)-CA:

Overall probability: 0.833
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS65 0.75 1.00
GLU66 1.00 1.00
MET67 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
K65HA 1.00
E66HB2 1.00
E66HB3 1.00
E66HG2 1.00
E66HG3 1.00
E66H 1.00
E66HA 1.00
M67HA 1.00
M67H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS65 HA 1.00 0.203 0.00 0.00
LYS65 HB2 0.65 0.000 1.00 0.62
LYS65 HB3 0.80 0.001 1.00 0.62
LYS65 H 0.87 0.015 1.00 0.04
GLU66 HA 1.00 0.000 1.00 6.11
GLU66 HB2 1.00 0.000 1.00 0.61
GLU66 HB3 1.00 0.000 1.00 0.69
GLU66 HG2 1.00 0.000 1.00 0.13
GLU66 HG3 1.00 0.000 1.00 0.30
GLU66 H 1.00 0.000 1.00 0.08
MET67 HA 1.00 0.049 0.00 0.00
MET67 H 1.00 0.000 1.00 0.03

Detailed Probabilities of GLU(66)-CB:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU66 1.00 0.86
MET67 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E66HA 1.00
E66HB3 1.00
E66HG2 1.00
E66HG3 1.00
E66H 1.00
E66HE2 1.00
E66HB2 1.00
M67H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU66 HA 1.00 0.000 1.00 0.49
GLU66 HB2 1.00 0.000 1.00 9.64
GLU66 HB3 1.00 0.000 1.00 4.04
GLU66 HG2 1.00 0.000 1.00 0.64
GLU66 HG3 1.00 0.000 1.00 2.31
GLU66 H 1.00 0.000 1.00 0.16
MET67 H 1.00 0.000 1.00 0.06
MET67 HA 0.69 0.002 1.00 0.08

Detailed Probabilities of GLU(66)-CG:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU66 1.00 0.86
MET67 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E66HA 1.00
E66HB2 1.00
E66HB3 1.00
E66HG3 1.00
E66H 1.00
E66HE2 1.00
E66HG2 1.00
M67H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU66 HA 1.00 0.000 1.00 0.20
GLU66 HB2 1.00 0.000 1.00 0.38
GLU66 HB3 1.00 0.000 1.00 0.53
GLU66 HG2 1.00 0.000 1.00 5.30
GLU66 HG3 1.00 0.000 1.00 0.96
GLU66 H 1.00 0.000 1.00 0.08
MET67 H 0.98 0.000 1.00 0.01

Detailed Probabilities of GLU(66)-N:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS65 1.00 1.00
GLU66 1.00 1.00
MET67 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K65HG3 0.97
K65HB2 1.00
K65HA 1.00
K65H 1.00
K65HB3 1.00
K65HG2 0.98
E66HA 1.00
E66HB2 1.00
E66HB3 1.00
E66HG2 1.00
E66HG3 1.00
E66H 1.00
M67H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS65 HA 1.00 0.000 1.00 -1340.00
LYS65 HB2 1.00 0.000 1.00 -20360.00
LYS65 HB3 1.00 0.000 1.00 -12710.00
LYS65 HG2 0.98 0.000 1.00 -2661.00
LYS65 HG3 0.97 0.000 1.00 -678.00
LYS65 H 1.00 0.000 1.00 -3152.00
LYS65 HD2 0.59 0.021 1.00 -1012.00
LYS65 HD3 0.62 0.024 1.00 -1012.00
GLU66 HA 1.00 0.000 1.00 -5919.00
GLU66 HB2 1.00 0.000 1.00 -8555.00
GLU66 HB3 1.00 0.000 1.00 -7930.00
GLU66 HG2 1.00 0.000 1.00 -2387.00
GLU66 HG3 1.00 0.000 1.00 -2669.00
GLU66 H 1.00 0.000 1.00 -99120.00
MET67 H 1.00 0.000 1.00 -4118.00
MET67 HB2 0.68 0.016 1.00 -2669.00

Detailed Probabilities of GLU(66)-HA:

Overall probability: 0.818
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS65 0.67 1.00
GLU66 1.00 1.00
MET67 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
K65HA 1.00
E66HB2 1.00
E66HB3 1.00
E66HG2 1.00
E66HG3 1.00
E66H 1.00
E66HA 1.00
M67HA 1.00
M67H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS65 HA 1.00 0.226 0.00 0.00
LYS65 HB2 0.65 0.000 1.00 0.48
LYS65 HB3 0.80 0.000 1.00 0.48
GLU66 HA 1.00 0.000 1.00 6.11
GLU66 HB2 1.00 0.000 1.00 0.49
GLU66 HB3 1.00 0.000 1.00 0.49
GLU66 HG2 1.00 0.000 1.00 0.20
GLU66 HG3 1.00 0.000 1.00 0.12
GLU66 H 1.00 0.000 1.00 -5919.00
MET67 HA 1.00 0.078 0.00 0.00
MET67 H 1.00 0.000 1.00 -1533.00

Detailed Probabilities of GLU(66)-HB2:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU66 1.00 0.86
MET67 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E66HA 1.00
E66HB3 1.00
E66HG2 1.00
E66HG3 1.00
E66H 1.00
E66HE2 1.00
E66HB2 1.00
M67H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU66 HA 1.00 0.000 1.00 0.61
GLU66 HB2 1.00 0.000 1.00 9.64
GLU66 HB3 1.00 0.000 1.00 9.64
GLU66 HG2 1.00 0.000 1.00 0.38
GLU66 HG3 1.00 0.000 1.00 0.58
GLU66 H 1.00 0.000 1.00 -8555.00
MET67 H 1.00 0.000 1.00 -10410.00
MET67 HA 0.69 0.009 1.00 0.16

Detailed Probabilities of GLU(66)-HB3:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU66 1.00 0.86
MET67 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E66HA 1.00
E66HB2 1.00
E66HG2 1.00
E66HG3 1.00
E66H 1.00
E66HE2 1.00
E66HB3 1.00
M67H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU66 HA 1.00 0.000 1.00 0.69
GLU66 HB2 1.00 0.000 1.00 4.04
GLU66 HB3 1.00 0.000 1.00 4.04
GLU66 HG2 1.00 0.000 1.00 0.53
GLU66 HG3 1.00 0.000 1.00 1.23
GLU66 H 1.00 0.000 1.00 -7930.00
MET67 H 1.00 0.000 1.00 -6024.00
MET67 HA 0.86 0.016 1.00 0.09

Detailed Probabilities of GLU(66)-HG2:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU66 1.00 0.86
MET67 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E66HA 1.00
E66HB2 1.00
E66HB3 1.00
E66HG3 1.00
E66H 1.00
E66HE2 1.00
E66HG2 1.00
M67H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU66 HA 1.00 0.000 1.00 0.13
GLU66 HB2 1.00 0.000 1.00 0.64
GLU66 HB3 1.00 0.000 1.00 0.64
GLU66 HG2 1.00 0.000 1.00 5.30
GLU66 HG3 1.00 0.000 1.00 1.07
GLU66 H 1.00 0.000 1.00 -2387.00
MET67 H 0.98 0.000 1.00 -2902.00

Detailed Probabilities of GLU(66)-HG3:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU66 1.00 0.86
MET67 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E66HA 1.00
E66HB2 1.00
E66HB3 1.00
E66HG2 1.00
E66H 1.00
E66HE2 1.00
E66HG3 1.00
M67H 0.97


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU66 HA 1.00 0.000 1.00 0.30
GLU66 HB2 1.00 0.000 1.00 2.31
GLU66 HB3 1.00 0.000 1.00 2.31
GLU66 HG2 1.00 0.000 1.00 0.96
GLU66 HG3 1.00 0.000 1.00 4.16
GLU66 H 1.00 0.000 1.00 -2669.00
MET67 H 0.97 0.000 1.00 -6104.00

Detailed Probabilities of GLU(66)-H:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS65 1.00 1.00
GLU66 1.00 1.00
MET67 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K65HG3 0.97
K65HB2 1.00
K65HA 1.00
K65H 1.00
K65HB3 1.00
K65HG2 0.98
E66HA 1.00
E66HB2 1.00
E66HB3 1.00
E66HG2 1.00
E66HG3 1.00
E66H 1.00
M67H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS65 HA 1.00 0.000 1.00 0.03
LYS65 HB2 1.00 0.000 1.00 0.54
LYS65 HB3 1.00 0.000 1.00 0.54
LYS65 HG2 0.98 0.000 1.00 0.06
LYS65 HG3 0.97 0.000 1.00 0.02
LYS65 H 1.00 0.000 1.00 -5051.00
LYS65 HD2 0.59 0.024 1.00 0.07
LYS65 HD3 0.62 0.024 1.00 0.07
GLU66 HA 1.00 0.000 1.00 0.08
GLU66 HB2 1.00 0.000 1.00 0.16
GLU66 HB3 1.00 0.000 1.00 0.16
GLU66 HG2 1.00 0.000 1.00 0.08
GLU66 HG3 1.00 0.000 1.00 0.06
GLU66 H 1.00 0.000 1.00 -99120.00
MET67 H 1.00 0.000 1.00 -7362.00