ARECA's report on LYS25

Residue probability: 0.769
Residue probability confidence: 0.942

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 174.092 176.660 3.133 0.000 0.000
CA 55.646 57.014 3.028 0.658 1.000
CB 34.585 32.981 3.186 0.936 1.000
CG 25.106 24.941 1.956 0.600 0.909
CD 29.299 29.020 2.193 0.811 0.889
CE 41.649 41.893 1.492 0.787 0.875
N 123.734 120.954 4.210 0.866 1.000
NZ NA -- -- 0.000 0.000
HA 4.847 4.262 0.489 0.664 1.000
HB2 1.523 1.774 0.365 0.620 1.000
HB3 1.637 1.742 0.385 0.502 1.000
HG2 1.259 1.358 0.344 1.000 0.909
HG3 1.199 1.343 0.357 0.510 0.909
HD 1.563 1.614 0.957 0.643 0.889
HE2 2.871 2.907 0.230 1.000 0.875
HE3 2.762 2.901 0.241 1.000 0.875
H 8.058 8.185 0.605 0.933 1.000
HZ NA -- -- 0.000 0.000

[Back]

Detailed Probabilities of LYS(25)-CA:

Overall probability: 0.658
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU24 0.00 1.00
LYS25 0.77 1.00
PHE26 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
L24HA 1.00
K25HB2 1.00
K25HB3 1.00
K25HG2 1.00
K25HG3 1.00
K25HD2 0.98
K25H 1.00
K25HA 1.00
F26HA 1.00
F26H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU24 HA 1.00 0.400 0.00 0.00
LYS25 HA 1.00 0.015 1.00 1.16
LYS25 HB2 1.00 0.071 0.00 0.00
LYS25 HB3 1.00 0.024 1.00 1.06
LYS25 HG2 1.00 0.006 1.00 0.38
LYS25 HG3 1.00 0.029 1.00 0.61
LYS25 HD2 0.98 0.031 0.90 0.00
LYS25 H 1.00 0.063 0.00 0.00
LYS25 HE2 0.77 0.010 1.00 0.23
LYS25 HE3 0.76 0.008 1.00 0.11
PHE26 HA 1.00 0.027 1.00 1.16
PHE26 H 1.00 0.049 0.00 0.00

Detailed Probabilities of LYS(25)-CB:

Overall probability: 0.936
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS25 0.92 1.00
PHE26 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K25HA 1.00
K25HB2 1.00
K25HG2 1.00
K25HG3 1.00
K25HD2 1.00
K25HE2 0.99
K25HE3 0.99
K25H 1.00
K25HB3 1.00
F26H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS25 HA 1.00 0.009 1.00 0.27
LYS25 HB2 1.00 0.006 1.00 2.42
LYS25 HB3 1.00 0.001 1.00 3.07
LYS25 HG2 1.00 0.027 1.00 0.46
LYS25 HG3 1.00 0.033 0.70 0.00
LYS25 HD2 1.00 0.034 0.60 0.00
LYS25 HE2 0.99 0.002 1.00 0.10
LYS25 HE3 0.99 0.006 1.00 0.07
LYS25 H 1.00 0.010 1.00 0.41
PHE26 H 1.00 0.009 1.00 0.10
PHE26 HA 0.87 0.003 1.00 0.27

Detailed Probabilities of LYS(25)-CG:

Overall probability: 0.600
Overall confidence: 0.909

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS25 0.56 0.90
PHE26 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K25HA 1.00
K25HB2 1.00
K25HB3 1.00
K25HG2 1.00
K25HD2 1.00
K25HE2 1.00
K25HE3 1.00
K25H 1.00
K25HZ2 1.00
K25HG3 1.00
F26H 0.96


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS25 HA 1.00 0.014 1.00 0.22
LYS25 HB2 1.00 0.283 0.00 0.00
LYS25 HB3 1.00 0.349 0.00 0.00
LYS25 HG2 1.00 0.019 1.00 3.52
LYS25 HG3 1.00 0.041 0.00 0.00
LYS25 HD2 1.00 0.323 0.00 0.00
LYS25 HE2 1.00 0.004 1.00 0.16
LYS25 HE3 1.00 0.016 1.00 0.16
LYS25 H 1.00 0.009 1.00 0.07
PHE26 H 0.96 0.004 1.00 0.09

Detailed Probabilities of LYS(25)-CD:

Overall probability: 0.811
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS25 0.81 0.89

Expected NOESY Contacts
Proton Expected probability
K25HA 0.98
K25HB2 1.00
K25HB3 1.00
K25HG2 1.00
K25HG3 1.00
K25HD3 1.00
K25HE2 1.00
K25HE3 1.00
K25HZ2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS25 HA 0.98 0.037 0.30 0.00
LYS25 HB2 1.00 0.020 1.00 25.27
LYS25 HB3 1.00 0.073 0.00 0.00
LYS25 HG2 1.00 0.030 1.00 1.82
LYS25 HG3 1.00 0.030 1.00 0.00
LYS25 HD2 1.00 0.001 1.00 36.33
LYS25 HE2 1.00 0.007 1.00 1.06
LYS25 HE3 1.00 0.005 1.00 0.70
LYS25 H 0.87 0.007 1.00 0.09

Detailed Probabilities of LYS(25)-CE:

Overall probability: 0.787
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS25 0.79 0.88

Expected NOESY Contacts
Proton Expected probability
K25HB2 0.98
K25HB3 0.99
K25HG2 1.00
K25HG3 1.00
K25HD2 1.00
K25HE3 1.00
K25HZ2 1.00
K25HE2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS25 HB2 0.98 0.022 1.00 1.69
LYS25 HB3 0.99 0.092 0.01 0.00
LYS25 HG2 1.00 0.025 1.00 0.50
LYS25 HG3 1.00 0.035 0.50 0.00
LYS25 HD2 1.00 0.018 1.00 1.69
LYS25 HE2 1.00 0.021 1.00 88.59
LYS25 HE3 1.00 0.001 1.00 7.74

Detailed Probabilities of LYS(25)-N:

Overall probability: 0.866
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU24 0.85 1.00
LYS25 0.84 1.00
PHE26 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
L24HA 1.00
L24H 1.00
L24HB3 1.00
L24HB2 1.00
L24HG 0.98
K25HA 1.00
K25HB2 1.00
K25HB3 1.00
K25HG2 1.00
K25HG3 1.00
K25H 1.00
F26H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU24 HA 1.00 0.000 1.00 -1954649.00
LEU24 HB2 1.00 0.006 1.00 -632202.00
LEU24 HB3 1.00 0.002 1.00 -179511.00
LEU24 HG 0.98 0.000 1.00 -632202.00
LEU24 H 1.00 0.039 0.10 0.00
LEU24 HD11 0.52 0.000 1.00 -702269.00
LYS25 HA 1.00 0.013 1.00 -382156.00
LYS25 HB2 1.00 0.005 1.00 -710619.00
LYS25 HB3 1.00 0.004 1.00 -825126.00
LYS25 HG2 1.00 0.011 1.00 -237215.00
LYS25 HG3 1.00 0.049 0.00 0.00
LYS25 H 1.00 0.010 1.00 -6110496.00
LYS25 HD2 0.88 0.035 0.88 0.00
PHE26 H 1.00 0.012 1.00 -84489.00
PHE26 HA 0.92 0.001 1.00 -382156.00

Detailed Probabilities of LYS(25)-HA:

Overall probability: 0.664
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU24 0.50 1.00
LYS25 0.76 1.00
PHE26 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
L24HA 1.00
K25HB2 1.00
K25HB3 1.00
K25HG2 1.00
K25HG3 1.00
K25HD2 0.98
K25H 1.00
K25HA 1.00
F26HA 1.00
F26H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU24 HA 1.00 0.104 0.00 0.00
LEU24 H 0.89 0.007 1.00 -111239.00
LYS25 HA 1.00 0.015 1.00 1.16
LYS25 HB2 1.00 0.009 1.00 0.40
LYS25 HB3 1.00 0.009 1.00 0.27
LYS25 HG2 1.00 0.957 0.00 0.00
LYS25 HG3 1.00 0.014 1.00 0.22
LYS25 HD2 0.98 0.037 0.30 0.00
LYS25 H 1.00 0.013 1.00 -382156.00
PHE26 HA 1.00 0.045 0.00 0.00
PHE26 H 1.00 0.011 1.00 -2530640.00

Detailed Probabilities of LYS(25)-HB2:

Overall probability: 0.620
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS25 0.58 1.00
PHE26 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K25HA 1.00
K25HB3 1.00
K25HG2 1.00
K25HG3 1.00
K25HD2 1.00
K25HE2 0.98
K25HE3 0.99
K25H 1.00
K25HB2 1.00
F26H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS25 HA 1.00 0.071 0.00 0.00
LYS25 HB2 1.00 0.004 1.00 4.27
LYS25 HB3 1.00 0.006 1.00 2.42
LYS25 HG2 1.00 0.291 0.00 0.00
LYS25 HG3 1.00 0.283 0.00 0.00
LYS25 HD2 1.00 0.020 1.00 25.27
LYS25 HE2 0.98 0.022 1.00 1.69
LYS25 HE3 0.99 0.038 0.20 0.00
LYS25 H 1.00 0.005 1.00 -710619.00
PHE26 H 1.00 0.014 1.00 -349291.00

Detailed Probabilities of LYS(25)-HB3:

Overall probability: 0.502
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS25 0.45 1.00
PHE26 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K25HA 1.00
K25HB2 1.00
K25HG2 1.00
K25HG3 1.00
K25HD2 1.00
K25HE2 0.99
K25HE3 0.99
K25H 1.00
K25HB3 1.00
F26H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS25 HA 1.00 0.024 1.00 1.06
LYS25 HB2 1.00 0.005 1.00 2.32
LYS25 HB3 1.00 0.001 1.00 3.07
LYS25 HG2 1.00 0.405 0.00 0.00
LYS25 HG3 1.00 0.349 0.00 0.00
LYS25 HD2 1.00 0.073 0.00 0.00
LYS25 HE2 0.99 0.092 0.01 0.00
LYS25 HE3 0.99 0.066 0.01 0.00
LYS25 H 1.00 0.004 1.00 -825126.00
PHE26 H 1.00 0.012 1.00 -246729.00

Detailed Probabilities of LYS(25)-HG2:

Overall probability: 1.000
Overall confidence: 0.909

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS25 1.00 0.90
PHE26 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K25HA 1.00
K25HB2 1.00
K25HB3 1.00
K25HG3 1.00
K25HD2 1.00
K25HE2 1.00
K25HE3 1.00
K25H 1.00
K25HZ2 1.00
K25HG2 1.00
F26H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS25 HA 1.00 0.006 1.00 0.38
LYS25 HB2 1.00 0.020 1.00 0.50
LYS25 HB3 1.00 0.027 1.00 0.46
LYS25 HG2 1.00 0.027 1.00 3.17
LYS25 HG3 1.00 0.019 1.00 3.52
LYS25 HD2 1.00 0.030 1.00 1.82
LYS25 HE2 1.00 0.025 1.00 0.50
LYS25 HE3 1.00 0.023 1.00 0.58
LYS25 H 1.00 0.011 1.00 -237215.00
PHE26 H 0.98 0.029 1.00 -372844.00

Detailed Probabilities of LYS(25)-HG3:

Overall probability: 0.510
Overall confidence: 0.909

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS25 0.47 0.90
PHE26 0.90 1.00

Expected NOESY Contacts
Proton Expected probability
K25HA 1.00
K25HB2 1.00
K25HB3 1.00
K25HG2 1.00
K25HD2 1.00
K25HE2 1.00
K25HE3 1.00
K25H 1.00
K25HZ2 1.00
K25HG3 1.00
F26H 0.96


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS25 HA 1.00 0.029 1.00 0.61
LYS25 HB2 1.00 0.040 0.00 0.00
LYS25 HB3 1.00 0.033 0.70 0.00
LYS25 HG2 1.00 0.033 0.70 0.00
LYS25 HG3 1.00 0.041 0.00 0.00
LYS25 HD2 1.00 0.030 1.00 0.00
LYS25 HE2 1.00 0.035 0.50 0.00
LYS25 HE3 1.00 0.037 0.30 0.00
LYS25 H 1.00 0.049 0.00 0.00
PHE26 H 0.96 0.031 0.90 0.00

Detailed Probabilities of LYS(25)-HD2:

Overall probability: 0.643
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS25 0.64 0.89

Expected NOESY Contacts
Proton Expected probability
K25HA 0.98
K25HB2 1.00
K25HB3 1.00
K25HG2 1.00
K25HG3 1.00
K25HD3 1.00
K25HE2 1.00
K25HE3 1.00
K25HZ2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS25 HA 0.98 0.031 0.90 0.00
LYS25 HB2 1.00 0.036 0.40 0.00
LYS25 HB3 1.00 0.034 0.60 0.00
LYS25 HG2 1.00 0.331 0.00 0.00
LYS25 HG3 1.00 0.323 0.00 0.00
LYS25 HD2 1.00 0.001 1.00 36.33
LYS25 HE2 1.00 0.018 1.00 1.69
LYS25 HE3 1.00 0.002 1.00 1.00
LYS25 H 0.88 0.035 0.88 0.00

Detailed Probabilities of LYS(25)-HE2:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS25 1.00 0.88

Expected NOESY Contacts
Proton Expected probability
K25HB2 0.98
K25HB3 0.99
K25HG2 1.00
K25HG3 1.00
K25HD2 1.00
K25HE3 1.00
K25HZ2 1.00
K25HE2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS25 HB2 0.98 0.002 1.00 0.14
LYS25 HB3 0.99 0.002 1.00 0.10
LYS25 HG2 1.00 0.004 1.00 0.15
LYS25 HG3 1.00 0.004 1.00 0.16
LYS25 HD2 1.00 0.007 1.00 1.06
LYS25 HE2 1.00 0.021 1.00 88.59
LYS25 HE3 1.00 0.024 1.00 8.55
LYS25 HA 0.77 0.010 1.00 0.23

Detailed Probabilities of LYS(25)-HE3:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS25 1.00 0.88

Expected NOESY Contacts
Proton Expected probability
K25HB2 0.99
K25HB3 0.99
K25HG2 1.00
K25HG3 1.00
K25HD2 1.00
K25HE2 1.00
K25HZ2 1.00
K25HE3 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS25 HB2 0.99 0.010 1.00 0.10
LYS25 HB3 0.99 0.006 1.00 0.07
LYS25 HG2 1.00 0.004 1.00 0.14
LYS25 HG3 1.00 0.016 1.00 0.16
LYS25 HD2 1.00 0.005 1.00 0.70
LYS25 HE2 1.00 0.001 1.00 7.74
LYS25 HE3 1.00 0.001 1.00 25.44
LYS25 HA 0.76 0.008 1.00 0.11

Detailed Probabilities of LYS(25)-H:

Overall probability: 0.933
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LEU24 1.00 1.00
LYS25 0.86 1.00
PHE26 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
L24HA 1.00
L24H 1.00
L24HB3 1.00
L24HB2 1.00
L24HG 0.98
K25HA 1.00
K25HB2 1.00
K25HB3 1.00
K25HG2 1.00
K25HG3 1.00
K25H 1.00
F26H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LEU24 HA 1.00 0.009 1.00 1.10
LEU24 HB2 1.00 0.007 1.00 0.20
LEU24 HB3 1.00 0.009 1.00 0.15
LEU24 HG 0.98 0.006 1.00 0.18
LEU24 H 1.00 0.011 1.00 -126929.00
LEU24 HD11 0.52 0.007 1.00 0.61
LEU24 HD21 0.59 0.005 1.00 0.27
LYS25 HA 1.00 0.063 0.00 0.00
LYS25 HB2 1.00 0.010 1.00 0.37
LYS25 HB3 1.00 0.010 1.00 0.41
LYS25 HG2 1.00 0.008 1.00 0.09
LYS25 HG3 1.00 0.009 1.00 0.07
LYS25 H 1.00 0.010 1.00 -6110496.00
LYS25 HD2 0.88 0.007 1.00 0.09
PHE26 H 1.00 0.003 1.00 -126048.00