ARECA's report on GLN16

Residue probability: 0.877
Residue probability confidence: 0.987

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 173.468 176.405 1.998 0.000 0.000
CA 54.599 56.667 2.318 0.800 1.000
CB 33.127 29.436 2.799 0.778 1.000
CG 33.491 33.781 1.871 1.000 1.000
N 121.949 119.799 3.762 1.000 0.917
NE2 111.338 111.924 2.434 1.000 1.000
HA 4.483 4.265 0.455 0.909 1.000
HB2 1.902 2.047 0.290 0.900 1.000
HB3 1.674 2.012 0.313 0.900 1.000
HG2 2.238 2.308 0.289 1.000 1.000
HG3 2.420 2.284 0.313 0.782 1.000
H 8.776 8.232 0.711 1.000 0.917
HE21 7.482 7.217 0.496 0.667 1.000
HE22 6.804 7.041 0.463 0.667 1.000

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Detailed Probabilities of GLN(16)-CA:

Overall probability: 0.800
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR15 0.50 1.00
GLN16 1.00 1.00
ASP17 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
T15HA 1.00
Q16HB2 1.00
Q16HB3 1.00
Q16HG2 1.00
Q16HG3 1.00
Q16H 1.00
Q16HA 1.00
D17H 1.00
D17HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR15 HA 1.00 0.422 0.00 0.00
THR15 HB 0.77 0.013 1.00 0.07
GLN16 HA 1.00 0.007 1.00 7.49
GLN16 HB2 1.00 0.007 1.00 0.81
GLN16 HB3 1.00 0.007 1.00 0.74
GLN16 HG2 1.00 0.005 1.00 0.52
GLN16 HG3 1.00 0.010 1.00 0.45
GLN16 H 1.00 0.012 1.00 0.36
ASP17 HA 1.00 0.141 0.00 0.00
ASP17 H 1.00 0.001 1.00 1.85

Detailed Probabilities of GLN(16)-CB:

Overall probability: 0.778
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN16 0.75 1.00
ASP17 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q16HA 1.00
Q16HB3 1.00
Q16HG2 1.00
Q16HG3 1.00
Q16H 1.00
Q16HE21 1.00
Q16HE22 1.00
Q16HB2 1.00
D17H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN16 HA 1.00 0.004 1.00 0.45
GLN16 HB2 1.00 0.003 1.00 4.27
GLN16 HB3 1.00 0.008 1.00 2.54
GLN16 HG2 1.00 0.002 1.00 0.77
GLN16 HG3 1.00 0.003 1.00 0.66
GLN16 H 1.00 0.000 1.00 0.13
GLN16 HE21 1.00 0.591 0.00 0.00
GLN16 HE22 1.00 1.269 0.00 0.00
ASP17 H 1.00 0.003 1.00 0.19

Detailed Probabilities of GLN(16)-CG:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN16 1.00 1.00
ASP17 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q16HA 1.00
Q16HB2 1.00
Q16HB3 1.00
Q16HG3 1.00
Q16H 1.00
Q16HE21 1.00
Q16HE22 1.00
Q16HG2 1.00
D17H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN16 HA 1.00 0.007 1.00 0.33
GLN16 HB2 1.00 0.000 1.00 0.70
GLN16 HB3 1.00 0.007 1.00 0.56
GLN16 HG2 1.00 0.012 1.00 15.17
GLN16 HG3 1.00 0.004 1.00 3.77
GLN16 H 1.00 0.000 1.00 0.05
GLN16 HE21 1.00 0.024 1.00 0.21
GLN16 HE22 1.00 0.004 1.00 0.08
ASP17 H 0.98 0.000 1.00 0.14

Detailed Probabilities of GLN(16)-N:

Overall probability: 1.000
Overall confidence: 0.917

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR15 1.00 0.80
GLN16 1.00 1.00
ASP17 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
T15HB 1.00
T15HG1 0.98
T15HA 1.00
T15HG23 0.96
T15H 1.00
Q16HA 1.00
Q16HB2 1.00
Q16HB3 1.00
Q16HG2 1.00
Q16HG3 1.00
Q16H 1.00
D17H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR15 HA 1.00 0.007 1.00 -1687766.00
THR15 HB 1.00 0.003 1.00 -878414.00
THR15 HG21 0.97 0.002 1.00 -576923.00
THR15 H 1.00 0.000 1.00 -94540.00
GLN16 HA 1.00 0.006 1.00 -584584.00
GLN16 HB2 1.00 0.000 1.00 -552781.00
GLN16 HB3 1.00 0.019 1.00 -808246.00
GLN16 HG2 1.00 0.006 1.00 -136385.00
GLN16 HG3 1.00 0.001 1.00 -127521.00
GLN16 H 1.00 0.006 1.00 -5825646.00
ASP17 H 1.00 0.000 1.00 -130126.00
ASP17 HA 0.86 0.015 1.00 -116482.00

Detailed Probabilities of GLN(16)-NE2:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN16 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q16HB2 1.00
Q16HB3 1.00
Q16HG2 1.00
Q16HG3 1.00
Q16HE22 1.00
Q16HE21 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN16 HB2 1.00 0.006 1.00 -100968.00
GLN16 HB3 1.00 0.000 1.00 -98685.00
GLN16 HG2 1.00 0.000 1.00 -635542.00
GLN16 HG3 1.00 0.008 1.00 -548823.00
GLN16 HE21 1.00 0.003 1.00 -10091628.00
GLN16 HE22 1.00 0.000 1.00 -6415238.00

Detailed Probabilities of GLN(16)-HA:

Overall probability: 0.909
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR15 0.67 1.00
GLN16 1.00 1.00
ASP17 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
T15HA 1.00
Q16HB2 1.00
Q16HB3 1.00
Q16HG2 1.00
Q16HG3 1.00
Q16H 1.00
Q16HA 1.00
D17H 1.00
D17HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR15 HA 1.00 0.341 0.00 0.00
THR15 HB 0.77 0.018 1.00 0.07
THR15 H 0.87 0.004 1.00 -93853.00
GLN16 HA 1.00 0.007 1.00 7.49
GLN16 HB2 1.00 0.004 1.00 0.45
GLN16 HB3 1.00 0.007 1.00 0.47
GLN16 HG2 1.00 0.007 1.00 0.33
GLN16 HG3 1.00 0.006 1.00 0.36
GLN16 H 1.00 0.006 1.00 -584584.00
ASP17 HA 1.00 0.011 1.00 0.64
ASP17 H 1.00 0.006 1.00 -3432666.00

Detailed Probabilities of GLN(16)-HB2:

Overall probability: 0.900
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN16 0.88 1.00
ASP17 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q16HA 1.00
Q16HB3 1.00
Q16HG2 1.00
Q16HG3 1.00
Q16H 1.00
Q16HE21 1.00
Q16HE22 1.00
Q16HB2 1.00
D17H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN16 HA 1.00 0.007 1.00 0.81
GLN16 HB2 1.00 0.003 1.00 4.27
GLN16 HB3 1.00 0.002 1.00 2.28
GLN16 HG2 1.00 0.000 1.00 0.70
GLN16 HG3 1.00 0.004 1.00 0.63
GLN16 H 1.00 0.000 1.00 -552781.00
GLN16 HE21 1.00 0.006 1.00 -100968.00
GLN16 HE22 1.00 0.219 0.00 0.00
ASP17 H 1.00 0.003 1.00 -539830.00
ASP17 HA 0.61 0.018 1.00 0.23

Detailed Probabilities of GLN(16)-HB3:

Overall probability: 0.900
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN16 0.88 1.00
ASP17 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q16HA 1.00
Q16HB2 1.00
Q16HG2 1.00
Q16HG3 1.00
Q16H 1.00
Q16HE21 1.00
Q16HE22 1.00
Q16HB3 1.00
D17H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN16 HA 1.00 0.007 1.00 0.74
GLN16 HB2 1.00 0.008 1.00 2.54
GLN16 HB3 1.00 0.007 1.00 4.51
GLN16 HG2 1.00 0.007 1.00 0.56
GLN16 HG3 1.00 0.004 1.00 0.59
GLN16 H 1.00 0.019 1.00 -808246.00
GLN16 HE21 1.00 0.000 1.00 -98685.00
GLN16 HE22 1.00 0.447 0.00 0.00
ASP17 H 1.00 0.009 1.00 -368427.00
ASP17 HA 0.79 0.025 1.00 0.31

Detailed Probabilities of GLN(16)-HG2:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN16 1.00 1.00
ASP17 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q16HA 1.00
Q16HB2 1.00
Q16HB3 1.00
Q16HG3 1.00
Q16H 1.00
Q16HE21 1.00
Q16HE22 1.00
Q16HG2 1.00
D17H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN16 HA 1.00 0.005 1.00 0.52
GLN16 HB2 1.00 0.002 1.00 0.77
GLN16 HB3 1.00 0.001 1.00 0.51
GLN16 HG2 1.00 0.012 1.00 15.17
GLN16 HG3 1.00 0.003 1.00 3.74
GLN16 H 1.00 0.006 1.00 -136385.00
GLN16 HE21 1.00 0.000 1.00 -635542.00
GLN16 HE22 1.00 0.005 1.00 -443020.00
ASP17 H 0.98 0.006 1.00 -324200.00

Detailed Probabilities of GLN(16)-HG3:

Overall probability: 0.782
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN16 0.88 1.00
ASP17 0.04 1.00

Expected NOESY Contacts
Proton Expected probability
Q16HA 1.00
Q16HB2 1.00
Q16HB3 1.00
Q16HG2 1.00
Q16H 1.00
Q16HE21 1.00
Q16HE22 1.00
Q16HG3 1.00
D17H 0.96


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN16 HA 1.00 0.010 1.00 0.45
GLN16 HB2 1.00 0.003 1.00 0.66
GLN16 HB3 1.00 0.183 0.00 0.00
GLN16 HG2 1.00 0.004 1.00 3.77
GLN16 HG3 1.00 0.005 1.00 15.24
GLN16 H 1.00 0.001 1.00 -127521.00
GLN16 HE21 1.00 0.008 1.00 -548823.00
GLN16 HE22 1.00 0.010 1.00 -326499.00
ASP17 H 0.96 0.081 0.04 0.00

Detailed Probabilities of GLN(16)-H:

Overall probability: 1.000
Overall confidence: 0.917

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR15 1.00 0.80
GLN16 1.00 1.00
ASP17 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
T15HB 1.00
T15HG1 0.98
T15HA 1.00
T15HG23 0.96
T15H 1.00
Q16HA 1.00
Q16HB2 1.00
Q16HB3 1.00
Q16HG2 1.00
Q16HG3 1.00
Q16H 1.00
D17H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR15 HA 1.00 0.008 1.00 0.55
THR15 HB 1.00 0.008 1.00 0.45
THR15 HG21 0.97 0.004 1.00 0.22
THR15 H 1.00 0.001 1.00 -128361.00
GLN16 HA 1.00 0.012 1.00 0.36
GLN16 HB2 1.00 0.000 1.00 0.13
GLN16 HB3 1.00 0.007 1.00 0.17
GLN16 HG2 1.00 0.000 1.00 0.05
GLN16 HG3 1.00 0.001 1.00 0.06
GLN16 H 1.00 0.006 1.00 -5825646.00
ASP17 H 1.00 0.019 1.00 -257706.00

Detailed Probabilities of GLN(16)-HE21:

Overall probability: 0.667
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN16 0.67 1.00

Expected NOESY Contacts
Proton Expected probability
Q16HB2 1.00
Q16HB3 1.00
Q16HG2 1.00
Q16HG3 1.00
Q16HE22 1.00
Q16HE21 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN16 HB2 1.00 0.591 0.00 0.00
GLN16 HB3 1.00 0.812 0.00 0.00
GLN16 HG2 1.00 0.024 1.00 0.21
GLN16 HG3 1.00 0.007 1.00 0.20
GLN16 HE21 1.00 0.003 1.00 -10091628.00
GLN16 HE22 1.00 0.002 1.00 -7064521.00

Detailed Probabilities of GLN(16)-HE22:

Overall probability: 0.667
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN16 0.67 1.00

Expected NOESY Contacts
Proton Expected probability
Q16HB2 1.00
Q16HB3 1.00
Q16HG2 1.00
Q16HG3 1.00
Q16HE21 1.00
Q16HE22 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN16 HB2 1.00 1.269 0.00 0.00
GLN16 HB3 1.00 1.490 0.00 0.00
GLN16 HG2 1.00 0.004 1.00 0.08
GLN16 HG3 1.00 0.001 1.00 0.07
GLN16 HE21 1.00 0.000 1.00 -6415238.00
GLN16 HE22 1.00 0.001 1.00 -11999231.00