ARECA's report on GLN83

Residue probability: 0.865
Residue probability confidence: 1.000

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 174.333 176.405 1.998 0.000 0.000
CA 54.586 56.667 2.318 0.727 1.000
CB 29.870 29.436 2.799 1.000 1.000
CG 33.720 33.781 1.871 0.889 1.000
N 122.153 119.799 3.762 0.992 1.000
NE2 110.447 111.924 2.434 1.000 1.000
HA 5.260 4.265 0.455 0.909 1.000
HB2 2.212 2.047 0.290 0.800 1.000
HB3 1.420 2.012 0.313 1.000 1.000
HG2 2.336 2.308 0.289 0.656 1.000
HG3 2.117 2.284 0.313 0.889 1.000
H 8.437 8.232 0.711 0.668 1.000
HE21 7.201 7.217 0.496 0.857 1.000
HE22 7.200 7.041 0.463 0.857 1.000

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Detailed Probabilities of GLN(83)-CA:

Overall probability: 0.727
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU82 0.50 1.00
GLN83 0.86 1.00
ASP84 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
L82HA 1.00
Q83HB2 1.00
Q83HB3 1.00
Q83HG2 1.00
Q83HG3 1.00
Q83H 1.00
Q83HA 1.00
D84H 1.00
D84HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU82 HA 1.00 0.351 0.00 0.00
LEU82 H 0.92 0.009 1.00 0.06
GLN83 HA 1.00 0.002 1.00 2.16
GLN83 HB2 1.00 0.005 1.00 0.20
GLN83 HB3 1.00 0.006 1.00 0.33
GLN83 HG2 1.00 0.119 0.00 0.00
GLN83 HG3 1.00 0.013 1.00 0.31
GLN83 H 1.00 0.004 1.00 0.26
GLN83 HE21 0.94 0.023 1.00 0.08
ASP84 HA 1.00 0.169 0.00 0.00
ASP84 H 1.00 0.004 1.00 0.72

Detailed Probabilities of GLN(83)-CB:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN83 1.00 1.00
ASP84 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q83HA 1.00
Q83HB2 1.00
Q83HG2 1.00
Q83HG3 1.00
Q83H 1.00
Q83HE21 1.00
Q83HE22 1.00
Q83HB3 1.00
D84H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN83 HA 1.00 0.007 1.00 0.25
GLN83 HB2 1.00 0.004 1.00 0.83
GLN83 HB3 1.00 0.011 1.00 0.99
GLN83 HG2 1.00 0.002 1.00 0.30
GLN83 HG3 1.00 0.007 1.00 0.43
GLN83 H 1.00 0.005 1.00 0.18
GLN83 HE21 1.00 0.023 1.00 0.07
GLN83 HE22 1.00 0.024 1.00 0.07
ASP84 H 1.00 0.015 1.00 0.05

Detailed Probabilities of GLN(83)-CG:

Overall probability: 0.889
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN83 0.88 1.00
ASP84 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q83HA 1.00
Q83HB2 1.00
Q83HB3 1.00
Q83HG2 1.00
Q83H 1.00
Q83HE21 1.00
Q83HE22 1.00
Q83HG3 1.00
D84H 0.96


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN83 HA 1.00 0.002 1.00 0.20
GLN83 HB2 1.00 0.087 0.00 0.00
GLN83 HB3 1.00 0.006 1.00 0.47
GLN83 HG2 1.00 0.001 1.00 1.80
GLN83 HG3 1.00 0.001 1.00 3.35
GLN83 H 1.00 0.000 1.00 0.11
GLN83 HE21 1.00 0.005 1.00 0.37
GLN83 HE22 1.00 0.006 1.00 0.37
ASP84 H 0.96 0.012 1.00 0.10

Detailed Probabilities of GLN(83)-N:

Overall probability: 0.992
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU82 1.00 1.00
GLN83 0.98 1.00
ASP84 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
L82H 1.00
L82HB3 1.00
L82HB2 1.00
L82HA 1.00
L82HG 0.98
Q83HA 1.00
Q83HB2 1.00
Q83HB3 1.00
Q83HG2 1.00
Q83HG3 1.00
Q83H 1.00
D84H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU82 HA 1.00 0.002 1.00 -1721778.00
LEU82 HB2 1.00 0.004 1.00 -419587.00
LEU82 HB3 1.00 0.001 1.00 -255852.00
LEU82 HG 0.98 0.019 1.00 -419587.00
LEU82 H 1.00 0.010 1.00 -120255.00
LEU82 HD21 0.58 0.013 1.00 -649406.00
GLN83 HA 1.00 0.004 1.00 -457948.00
GLN83 HB2 1.00 0.008 1.00 -557367.00
GLN83 HB3 1.00 0.007 1.00 -519520.00
GLN83 HG2 1.00 0.031 0.90 0.00
GLN83 HG3 1.00 0.018 1.00 -203902.00
GLN83 H 1.00 0.001 1.00 -7675379.00
ASP84 H 1.00 0.004 1.00 -148676.00

Detailed Probabilities of GLN(83)-NE2:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN83 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q83HB2 1.00
Q83HB3 1.00
Q83HG2 1.00
Q83HG3 1.00
Q83HE22 1.00
Q83HE21 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN83 HB2 1.00 0.014 1.00 -159812.00
GLN83 HB3 1.00 0.005 1.00 -201185.00
GLN83 HG2 1.00 0.002 1.00 -652972.00
GLN83 HG3 1.00 0.002 1.00 -512020.00
GLN83 HE21 1.00 0.002 1.00 -12590931.00
GLN83 HE22 1.00 0.003 1.00 -12590931.00
GLN83 HA 0.94 0.003 1.00 -96745.00

Detailed Probabilities of GLN(83)-HA:

Overall probability: 0.909
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU82 0.50 1.00
GLN83 1.00 1.00
ASP84 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
L82HA 1.00
Q83HB2 1.00
Q83HB3 1.00
Q83HG2 1.00
Q83HG3 1.00
Q83H 1.00
Q83HA 1.00
D84H 1.00
D84HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU82 HA 1.00 0.057 0.00 0.00
LEU82 H 0.92 0.008 1.00 -1621019.00
GLN83 HA 1.00 0.002 1.00 2.16
GLN83 HB2 1.00 0.004 1.00 0.22
GLN83 HB3 1.00 0.007 1.00 0.25
GLN83 HG2 1.00 0.001 1.00 0.23
GLN83 HG3 1.00 0.002 1.00 0.20
GLN83 H 1.00 0.004 1.00 -457948.00
GLN83 HE21 0.94 0.003 1.00 -96745.00
ASP84 HA 1.00 0.017 1.00 0.05
ASP84 H 1.00 0.000 1.00 -1120541.00

Detailed Probabilities of GLN(83)-HB2:

Overall probability: 0.800
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN83 0.75 1.00
ASP84 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q83HA 1.00
Q83HB3 1.00
Q83HG2 1.00
Q83HG3 1.00
Q83H 1.00
Q83HE21 1.00
Q83HE22 1.00
Q83HB2 1.00
D84H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN83 HA 1.00 0.005 1.00 0.20
GLN83 HB2 1.00 0.030 1.00 0.00
GLN83 HB3 1.00 0.004 1.00 0.83
GLN83 HG2 1.00 0.095 0.00 0.00
GLN83 HG3 1.00 0.087 0.00 0.00
GLN83 H 1.00 0.008 1.00 -557367.00
GLN83 HE21 1.00 0.014 1.00 -159812.00
GLN83 HE22 1.00 0.014 1.00 -159812.00
ASP84 H 1.00 0.008 1.00 -113172.00
ASP84 HA 0.61 0.024 1.00 0.51

Detailed Probabilities of GLN(83)-HB3:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN83 1.00 1.00
ASP84 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q83HA 1.00
Q83HB2 1.00
Q83HG2 1.00
Q83HG3 1.00
Q83H 1.00
Q83HE21 1.00
Q83HE22 1.00
Q83HB3 1.00
D84H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN83 HA 1.00 0.006 1.00 0.33
GLN83 HB2 1.00 0.008 1.00 0.87
GLN83 HB3 1.00 0.011 1.00 0.99
GLN83 HG2 1.00 0.004 1.00 0.40
GLN83 HG3 1.00 0.006 1.00 0.47
GLN83 H 1.00 0.007 1.00 -519520.00
GLN83 HE21 1.00 0.005 1.00 -201185.00
GLN83 HE22 1.00 0.005 1.00 -201185.00
ASP84 H 1.00 0.008 1.00 -182051.00

Detailed Probabilities of GLN(83)-HG2:

Overall probability: 0.656
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN83 0.61 1.00
ASP84 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q83HA 1.00
Q83HB2 1.00
Q83HB3 1.00
Q83HG3 1.00
Q83H 1.00
Q83HE21 1.00
Q83HE22 1.00
Q83HG2 1.00
D84H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN83 HA 1.00 0.119 0.00 0.00
GLN83 HB2 1.00 0.077 0.00 0.00
GLN83 HB3 1.00 0.002 1.00 0.30
GLN83 HG2 1.00 0.219 0.00 0.00
GLN83 HG3 1.00 0.001 1.00 1.80
GLN83 H 1.00 0.031 0.90 0.00
GLN83 HE21 1.00 0.002 1.00 -652972.00
GLN83 HE22 1.00 0.002 1.00 -652972.00
ASP84 H 0.98 0.002 1.00 -312887.00

Detailed Probabilities of GLN(83)-HG3:

Overall probability: 0.889
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN83 0.88 1.00
ASP84 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q83HA 1.00
Q83HB2 1.00
Q83HB3 1.00
Q83HG2 1.00
Q83H 1.00
Q83HE21 1.00
Q83HE22 1.00
Q83HG3 1.00
D84H 0.96


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN83 HA 1.00 0.013 1.00 0.31
GLN83 HB2 1.00 0.065 0.00 0.00
GLN83 HB3 1.00 0.007 1.00 0.43
GLN83 HG2 1.00 0.000 1.00 1.55
GLN83 HG3 1.00 0.001 1.00 3.35
GLN83 H 1.00 0.018 1.00 -203902.00
GLN83 HE21 1.00 0.002 1.00 -512020.00
GLN83 HE22 1.00 0.002 1.00 -512020.00
ASP84 H 0.96 0.005 1.00 -252310.00

Detailed Probabilities of GLN(83)-H:

Overall probability: 0.668
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU82 0.40 1.00
GLN83 0.83 1.00
ASP84 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
L82H 1.00
L82HB3 1.00
L82HB2 1.00
L82HA 1.00
L82HG 0.98
Q83HA 1.00
Q83HB2 1.00
Q83HB3 1.00
Q83HG2 1.00
Q83HG3 1.00
Q83H 1.00
D84H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU82 HA 1.00 0.129 0.00 0.00
LEU82 HB2 1.00 0.435 0.00 0.00
LEU82 HB3 1.00 0.005 1.00 0.07
LEU82 HG 0.98 0.104 0.02 0.00
LEU82 H 1.00 0.005 1.00 -104325.00
GLN83 HA 1.00 0.004 1.00 0.26
GLN83 HB2 1.00 0.123 0.00 0.00
GLN83 HB3 1.00 0.005 1.00 0.18
GLN83 HG2 1.00 0.008 1.00 0.05
GLN83 HG3 1.00 0.000 1.00 0.11
GLN83 H 1.00 0.001 1.00 -7675379.00
ASP84 H 1.00 0.003 1.00 -157374.00

Detailed Probabilities of GLN(83)-HE21:

Overall probability: 0.857
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN83 0.86 1.00

Expected NOESY Contacts
Proton Expected probability
Q83HB2 1.00
Q83HB3 1.00
Q83HG2 1.00
Q83HG3 1.00
Q83HE22 1.00
Q83HE21 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN83 HB2 1.00 0.216 0.00 0.00
GLN83 HB3 1.00 0.024 1.00 0.07
GLN83 HG2 1.00 0.008 1.00 0.40
GLN83 HG3 1.00 0.006 1.00 0.37
GLN83 HE21 1.00 0.003 1.00 -12590931.00
GLN83 HE22 1.00 0.003 1.00 -12590931.00
GLN83 HA 0.94 0.023 1.00 0.08

Detailed Probabilities of GLN(83)-HE22:

Overall probability: 0.857
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN83 0.86 1.00

Expected NOESY Contacts
Proton Expected probability
Q83HB2 1.00
Q83HB3 1.00
Q83HG2 1.00
Q83HG3 1.00
Q83HE21 1.00
Q83HE22 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN83 HB2 1.00 0.216 0.00 0.00
GLN83 HB3 1.00 0.024 1.00 0.07
GLN83 HG2 1.00 0.008 1.00 0.40
GLN83 HG3 1.00 0.006 1.00 0.37
GLN83 HE21 1.00 0.003 1.00 -12590931.00
GLN83 HE22 1.00 0.003 1.00 -12590931.00
GLN83 HA 0.94 0.023 1.00 0.08