ARECA's report on GLU98

Residue probability: 0.974
Residue probability confidence: 0.925

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 180.040 176.942 2.547 0.000 0.000
CA 58.950 57.442 3.837 0.900 1.000
CB 29.435 30.185 4.018 1.000 0.875
CG 36.433 36.085 1.533 1.000 0.875
N 121.984 120.574 4.837 1.000 1.000
HA 4.336 4.245 0.429 0.909 1.000
HB2 2.179 2.021 0.233 1.000 0.875
HB3 2.053 1.994 0.244 1.000 0.875
HG2 2.377 2.258 0.226 1.000 0.875
HG3 2.437 2.233 0.232 1.000 0.875
H 8.670 8.332 0.601 0.927 1.000
HE2 NA -- -- 0.000 0.000

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Detailed Probabilities of GLU(98)-CA:

Overall probability: 0.900
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ILE97 0.50 1.00
GLU98 1.00 1.00
SER99 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
I97HA 1.00
E98HB2 1.00
E98HB3 1.00
E98HG2 1.00
E98HG3 1.00
E98H 1.00
E98HA 1.00
S99HA 1.00
S99H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ILE97 HA 1.00 0.398 0.00 0.00
ILE97 HG21 0.69 0.009 1.00 0.02
GLU98 HA 1.00 0.000 1.00 1.87
GLU98 HB2 1.00 0.000 1.00 0.14
GLU98 HB3 1.00 0.000 1.00 0.19
GLU98 HG2 1.00 0.000 1.00 0.15
GLU98 HG3 1.00 0.000 1.00 0.07
GLU98 H 1.00 0.000 1.00 0.10
SER99 HA 1.00 0.007 1.00 1.87
SER99 H 1.00 0.000 1.00 0.03

Detailed Probabilities of GLU(98)-CB:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU98 1.00 0.86
SER99 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E98HA 1.00
E98HB3 1.00
E98HG2 1.00
E98HG3 1.00
E98H 1.00
E98HE2 1.00
E98HB2 1.00
S99H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU98 HA 1.00 0.000 1.00 0.33
GLU98 HB2 1.00 0.000 1.00 3.58
GLU98 HB3 1.00 0.000 1.00 2.24
GLU98 HG2 1.00 0.000 1.00 0.38
GLU98 HG3 1.00 0.000 1.00 0.32
GLU98 H 1.00 0.000 1.00 0.13
SER99 H 1.00 0.000 1.00 0.04
SER99 HA 0.70 0.007 1.00 0.33

Detailed Probabilities of GLU(98)-CG:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU98 1.00 0.86
SER99 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E98HA 1.00
E98HB2 1.00
E98HB3 1.00
E98HG3 1.00
E98H 1.00
E98HE2 1.00
E98HG2 1.00
S99H 0.97


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU98 HA 1.00 0.000 1.00 0.14
GLU98 HB2 1.00 0.000 1.00 0.48
GLU98 HB3 1.00 0.000 1.00 0.42
GLU98 HG2 1.00 0.000 1.00 4.04
GLU98 HG3 1.00 0.000 1.00 1.07
GLU98 H 1.00 0.000 1.00 0.05
SER99 H 0.97 0.000 1.00 0.01

Detailed Probabilities of GLU(98)-N:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ILE97 1.00 1.00
GLU98 1.00 1.00
SER99 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
I97HG13 0.95
I97HG22 0.98
I97HA 1.00
I97HG12 0.98
I97HB 1.00
I97H 1.00
E98HA 1.00
E98HB2 1.00
E98HB3 1.00
E98HG2 1.00
E98HG3 1.00
E98H 1.00
S99H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ILE97 HA 1.00 0.000 1.00 -1030.00
ILE97 HB 1.00 0.000 1.00 -2452.00
ILE97 HG12 0.98 0.000 1.00 -192.00
ILE97 HG13 0.95 0.000 1.00 -1795.00
ILE97 HG21 0.99 0.000 1.00 -1283.00
ILE97 H 1.00 0.000 1.00 -4658.00
GLU98 HA 1.00 0.000 1.00 -4084.00
GLU98 HB2 1.00 0.000 1.00 -5084.00
GLU98 HB3 1.00 0.000 1.00 -3493.00
GLU98 HG2 1.00 0.000 1.00 -2078.00
GLU98 HG3 1.00 0.000 1.00 -2444.00
GLU98 H 1.00 0.000 1.00 -34770.00
SER99 H 1.00 0.000 1.00 -2203.00
SER99 HA 0.86 0.007 1.00 -4084.00

Detailed Probabilities of GLU(98)-HA:

Overall probability: 0.909
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ILE97 0.67 1.00
GLU98 1.00 1.00
SER99 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
I97HA 1.00
E98HB2 1.00
E98HB3 1.00
E98HG2 1.00
E98HG3 1.00
E98H 1.00
E98HA 1.00
S99HA 1.00
S99H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ILE97 HA 1.00 0.290 0.00 0.00
ILE97 HG21 0.69 0.002 1.00 0.02
ILE97 H 0.93 0.004 1.00 -155.00
GLU98 HA 1.00 0.000 1.00 1.87
GLU98 HB2 1.00 0.000 1.00 0.33
GLU98 HB3 1.00 0.000 1.00 0.42
GLU98 HG2 1.00 0.000 1.00 0.14
GLU98 HG3 1.00 0.000 1.00 0.07
GLU98 H 1.00 0.000 1.00 -4084.00
SER99 HA 1.00 0.004 1.00 3.08
SER99 H 1.00 0.000 1.00 -6964.00

Detailed Probabilities of GLU(98)-HB2:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU98 1.00 0.86
SER99 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E98HA 1.00
E98HB3 1.00
E98HG2 1.00
E98HG3 1.00
E98H 1.00
E98HE2 1.00
E98HB2 1.00
S99H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU98 HA 1.00 0.000 1.00 0.14
GLU98 HB2 1.00 0.000 1.00 3.58
GLU98 HB3 1.00 0.000 1.00 2.59
GLU98 HG2 1.00 0.000 1.00 0.48
GLU98 HG3 1.00 0.000 1.00 0.53
GLU98 H 1.00 0.000 1.00 -5084.00
SER99 H 1.00 0.000 1.00 -2138.00

Detailed Probabilities of GLU(98)-HB3:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU98 1.00 0.86
SER99 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E98HA 1.00
E98HB2 1.00
E98HG2 1.00
E98HG3 1.00
E98H 1.00
E98HE2 1.00
E98HB3 1.00
S99H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU98 HA 1.00 0.000 1.00 0.19
GLU98 HB2 1.00 0.000 1.00 2.24
GLU98 HB3 1.00 0.000 1.00 7.57
GLU98 HG2 1.00 0.000 1.00 0.42
GLU98 HG3 1.00 0.000 1.00 0.57
GLU98 H 1.00 0.000 1.00 -3493.00
SER99 H 1.00 0.000 1.00 -1894.00
SER99 HA 0.82 0.002 1.00 0.02

Detailed Probabilities of GLU(98)-HG2:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU98 1.00 0.86
SER99 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E98HA 1.00
E98HB2 1.00
E98HB3 1.00
E98HG3 1.00
E98H 1.00
E98HE2 1.00
E98HG2 1.00
S99H 0.97


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU98 HA 1.00 0.000 1.00 0.15
GLU98 HB2 1.00 0.000 1.00 0.38
GLU98 HB3 1.00 0.000 1.00 0.77
GLU98 HG2 1.00 0.000 1.00 4.04
GLU98 HG3 1.00 0.000 1.00 1.31
GLU98 H 1.00 0.000 1.00 -2078.00
SER99 H 0.97 0.000 1.00 -751.00

Detailed Probabilities of GLU(98)-HG3:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU98 1.00 0.86
SER99 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E98HA 1.00
E98HB2 1.00
E98HB3 1.00
E98HG2 1.00
E98H 1.00
E98HE2 1.00
E98HG3 1.00
S99H 0.97


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU98 HA 1.00 0.000 1.00 0.07
GLU98 HB2 1.00 0.000 1.00 0.32
GLU98 HB3 1.00 0.000 1.00 0.30
GLU98 HG2 1.00 0.000 1.00 1.07
GLU98 HG3 1.00 0.000 1.00 4.75
GLU98 H 1.00 0.000 1.00 -2444.00
SER99 H 0.97 0.000 1.00 -572.00

Detailed Probabilities of GLU(98)-H:

Overall probability: 0.927
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ILE97 0.84 1.00
GLU98 1.00 1.00
SER99 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
I97HG13 0.95
I97HG22 0.98
I97HA 1.00
I97HG12 0.98
I97HB 1.00
I97H 1.00
E98HA 1.00
E98HB2 1.00
E98HB3 1.00
E98HG2 1.00
E98HG3 1.00
E98H 1.00
S99H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ILE97 HA 1.00 0.000 1.00 0.03
ILE97 HB 1.00 0.000 1.00 0.04
ILE97 HG12 0.98 0.000 1.00 0.00
ILE97 HG13 0.95 0.119 0.05 0.00
ILE97 HG21 0.99 0.000 1.00 0.03
ILE97 H 1.00 0.000 1.00 -3828.00
GLU98 HA 1.00 0.000 1.00 0.10
GLU98 HB2 1.00 0.000 1.00 0.13
GLU98 HB3 1.00 0.000 1.00 0.15
GLU98 HG2 1.00 0.000 1.00 0.05
GLU98 HG3 1.00 0.000 1.00 0.04
GLU98 H 1.00 0.000 1.00 -34770.00
SER99 H 1.00 0.000 1.00 -2805.00