ARECA's report on LYS96

Residue probability: 0.990
Residue probability confidence: 0.943

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 179.034 176.660 3.133 0.000 0.000
CA 58.934 57.014 3.028 0.933 1.000
CB 32.069 32.981 3.186 1.000 1.000
CG 24.910 24.941 1.956 1.000 0.909
CD 28.889 29.020 2.193 1.000 0.889
CE 41.780 41.893 1.492 1.000 0.875
N 119.582 120.954 4.210 1.000 1.000
NZ NA -- -- 0.000 0.000
HA 4.065 4.262 0.489 0.924 1.000
HB2 1.901 1.774 0.365 1.000 1.000
HB3 1.971 1.742 0.385 1.000 1.000
HG2 1.440 1.358 0.344 1.000 0.909
HG3 1.570 1.343 0.357 1.000 0.909
HD2 1.680 1.614 0.957 1.000 0.889
HD3 1.682 1.595 0.387 1.000 0.889
HE 2.930 2.907 0.230 1.000 0.875
H 7.786 8.185 0.605 1.000 1.000
HZ NA -- -- 0.000 0.000

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Detailed Probabilities of LYS(96)-CA:

Overall probability: 0.933
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG95 1.00 1.00
LYS96 1.00 1.00
ILE97 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
R95HA 1.00
K96HB2 1.00
K96HB3 1.00
K96HG2 1.00
K96HG3 1.00
K96HD2 0.98
K96HD3 0.98
K96H 1.00
K96HA 1.00
I97HA 1.00
I97H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG95 HA 1.00 0.028 1.00 1.01
ARG95 HB2 0.66 0.004 1.00 0.64
ARG95 HB3 0.81 0.001 1.00 0.43
ARG95 H 0.85 0.000 1.00 0.09
LYS96 HA 1.00 0.000 1.00 8.60
LYS96 HB2 1.00 0.000 1.00 0.64
LYS96 HB3 1.00 0.000 1.00 0.43
LYS96 HG2 1.00 0.000 1.00 0.17
LYS96 HG3 1.00 0.000 1.00 0.19
LYS96 HD2 0.98 0.000 1.00 0.29
LYS96 HD3 0.98 0.000 1.00 0.29
LYS96 H 1.00 0.000 1.00 0.19
LYS96 HE2 0.77 0.000 1.00 0.06
ILE97 HA 1.00 0.058 0.00 0.00
ILE97 H 1.00 0.000 1.00 0.16

Detailed Probabilities of LYS(96)-CB:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS96 1.00 1.00
ILE97 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K96HA 1.00
K96HB3 1.00
K96HG2 1.00
K96HG3 1.00
K96HD2 1.00
K96HD3 1.00
K96HE2 0.98
K96H 1.00
K96HB2 1.00
I97H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS96 HA 1.00 0.000 1.00 0.74
LYS96 HB2 1.00 0.000 1.00 9.57
LYS96 HB3 1.00 0.000 1.00 2.67
LYS96 HG2 1.00 0.000 1.00 0.55
LYS96 HG3 1.00 0.000 1.00 0.58
LYS96 HD2 1.00 0.000 1.00 0.95
LYS96 HD3 1.00 0.000 1.00 0.95
LYS96 HE2 0.98 0.000 1.00 0.12
LYS96 H 1.00 0.000 1.00 0.23
ILE97 H 1.00 0.000 1.00 0.20

Detailed Probabilities of LYS(96)-CG:

Overall probability: 1.000
Overall confidence: 0.909

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS96 1.00 0.90
ILE97 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K96HA 1.00
K96HB2 1.00
K96HB3 1.00
K96HG3 1.00
K96HD2 1.00
K96HD3 1.00
K96HE2 1.00
K96H 1.00
K96HZ2 1.00
K96HG2 1.00
I97H 0.97


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS96 HA 1.00 0.000 1.00 0.18
LYS96 HB2 1.00 0.000 1.00 0.41
LYS96 HB3 1.00 0.000 1.00 0.13
LYS96 HG2 1.00 0.000 1.00 6.20
LYS96 HG3 1.00 0.000 1.00 1.61
LYS96 HD2 1.00 0.000 1.00 0.97
LYS96 HD3 1.00 0.000 1.00 0.97
LYS96 HE2 1.00 0.000 1.00 0.16
LYS96 H 1.00 0.000 1.00 0.05
ILE97 H 0.97 0.000 1.00 0.04

Detailed Probabilities of LYS(96)-CD:

Overall probability: 1.000
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS96 1.00 0.89

Expected NOESY Contacts
Proton Expected probability
K96HA 0.98
K96HB2 1.00
K96HB3 1.00
K96HG2 1.00
K96HG3 1.00
K96HD3 1.00
K96HE2 1.00
K96HZ2 1.00
K96HD2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS96 HA 0.98 0.000 1.00 0.20
LYS96 HB2 1.00 0.000 1.00 0.73
LYS96 HB3 1.00 0.000 1.00 0.33
LYS96 HG2 1.00 0.000 1.00 1.06
LYS96 HG3 1.00 0.000 1.00 1.43
LYS96 HD2 1.00 0.000 1.00 27.74
LYS96 HD3 1.00 0.000 1.00 45.30
LYS96 HE2 1.00 0.000 1.00 0.72
LYS96 H 0.88 0.000 1.00 0.04

Detailed Probabilities of LYS(96)-CE:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS96 1.00 0.88

Expected NOESY Contacts
Proton Expected probability
K96HB2 0.98
K96HB3 0.99
K96HG2 1.00
K96HG3 1.00
K96HD2 1.00
K96HD3 1.00
K96HE3 1.00
K96HZ2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS96 HB2 0.99 0.000 1.00 0.19
LYS96 HB3 0.99 0.000 1.00 0.06
LYS96 HG2 1.00 0.000 1.00 0.28
LYS96 HG3 1.00 0.000 1.00 0.42
LYS96 HD2 1.00 0.000 1.00 1.03
LYS96 HD3 1.00 0.000 1.00 1.19
LYS96 HE2 1.00 0.000 1.00 38.95
LYS96 HA 0.76 0.004 1.00 0.00

Detailed Probabilities of LYS(96)-N:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG95 1.00 1.00
LYS96 1.00 1.00
ILE97 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
R95HG2 0.97
R95HA 1.00
R95H 1.00
R95HB3 1.00
R95HB2 1.00
K96HA 1.00
K96HB2 1.00
K96HB3 1.00
K96HG2 1.00
K96HG3 1.00
K96H 1.00
I97H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG95 HA 1.00 0.000 1.00 -749.00
ARG95 HB2 1.00 0.000 1.00 -5959.00
ARG95 HB3 1.00 0.000 1.00 -7169.00
ARG95 HG2 0.97 0.000 1.00 -4714.00
ARG95 H 1.00 0.000 1.00 -2986.00
ARG95 HG3 0.95 0.000 1.00 -1012.00
LYS96 HA 1.00 0.000 1.00 -1769.00
LYS96 HB2 1.00 0.000 1.00 -5959.00
LYS96 HB3 1.00 0.000 1.00 -4141.00
LYS96 HG2 1.00 0.000 1.00 -821.00
LYS96 HG3 1.00 0.000 1.00 -1766.00
LYS96 H 1.00 0.000 1.00 -36770.00
LYS96 HD2 0.88 0.000 1.00 -4130.00
LYS96 HD3 0.87 0.000 1.00 -1012.00
ILE97 H 1.00 0.000 1.00 -14360.00

Detailed Probabilities of LYS(96)-HA:

Overall probability: 0.924
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG95 0.71 1.00
LYS96 1.00 1.00
ILE97 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
R95HA 1.00
K96HB2 1.00
K96HB3 1.00
K96HG2 1.00
K96HG3 1.00
K96HD2 0.98
K96HD3 0.98
K96H 1.00
K96HA 1.00
I97HA 1.00
I97H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG95 HA 1.00 0.070 0.00 0.00
ARG95 HB2 0.66 0.013 1.00 0.07
ARG95 HB3 0.81 0.013 1.00 0.07
ARG95 H 0.85 0.033 0.85 0.00
LYS96 HA 1.00 0.000 1.00 8.60
LYS96 HB2 1.00 0.000 1.00 0.74
LYS96 HB3 1.00 0.000 1.00 0.44
LYS96 HG2 1.00 0.000 1.00 0.18
LYS96 HG3 1.00 0.000 1.00 0.12
LYS96 HD2 0.98 0.000 1.00 0.20
LYS96 HD3 0.98 0.000 1.00 0.20
LYS96 H 1.00 0.000 1.00 -1769.00
LYS96 HE2 0.77 0.004 1.00 0.00
ILE97 HA 1.00 0.019 1.00 0.23
ILE97 H 1.00 0.000 1.00 -1712.00

Detailed Probabilities of LYS(96)-HB2:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS96 1.00 1.00
ILE97 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K96HA 1.00
K96HB3 1.00
K96HG2 1.00
K96HG3 1.00
K96HD2 1.00
K96HD3 1.00
K96HE2 0.98
K96H 1.00
K96HB2 1.00
I97H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS96 HA 1.00 0.000 1.00 0.64
LYS96 HB2 1.00 0.000 1.00 9.57
LYS96 HB3 1.00 0.000 1.00 4.67
LYS96 HG2 1.00 0.000 1.00 0.41
LYS96 HG3 1.00 0.000 1.00 0.48
LYS96 HD2 1.00 0.000 1.00 0.73
LYS96 HD3 1.00 0.000 1.00 0.73
LYS96 HE2 0.98 0.000 1.00 0.19
LYS96 H 1.00 0.000 1.00 -5959.00
ILE97 H 1.00 0.000 1.00 -5011.00

Detailed Probabilities of LYS(96)-HB3:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS96 1.00 1.00
ILE97 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K96HA 1.00
K96HB2 1.00
K96HG2 1.00
K96HG3 1.00
K96HD2 1.00
K96HD3 1.00
K96HE2 0.99
K96H 1.00
K96HB3 1.00
I97H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS96 HA 1.00 0.000 1.00 0.43
LYS96 HB2 1.00 0.000 1.00 2.67
LYS96 HB3 1.00 0.000 1.00 4.18
LYS96 HG2 1.00 0.000 1.00 0.13
LYS96 HG3 1.00 0.000 1.00 0.28
LYS96 HD2 1.00 0.000 1.00 0.33
LYS96 HD3 1.00 0.000 1.00 0.33
LYS96 HE2 0.99 0.000 1.00 0.06
LYS96 H 1.00 0.000 1.00 -4141.00
ILE97 H 1.00 0.000 1.00 -6998.00

Detailed Probabilities of LYS(96)-HG2:

Overall probability: 1.000
Overall confidence: 0.909

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS96 1.00 0.90
ILE97 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K96HA 1.00
K96HB2 1.00
K96HB3 1.00
K96HG3 1.00
K96HD2 1.00
K96HD3 1.00
K96HE2 1.00
K96H 1.00
K96HZ2 1.00
K96HG2 1.00
I97H 0.97


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS96 HA 1.00 0.000 1.00 0.17
LYS96 HB2 1.00 0.000 1.00 0.55
LYS96 HB3 1.00 0.000 1.00 0.27
LYS96 HG2 1.00 0.000 1.00 6.20
LYS96 HG3 1.00 0.000 1.00 1.41
LYS96 HD2 1.00 0.000 1.00 1.06
LYS96 HD3 1.00 0.000 1.00 1.06
LYS96 HE2 1.00 0.000 1.00 0.28
LYS96 H 1.00 0.000 1.00 -821.00
ILE97 H 0.97 0.000 1.00 -2351.00

Detailed Probabilities of LYS(96)-HG3:

Overall probability: 1.000
Overall confidence: 0.909

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS96 1.00 0.90
ILE97 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K96HA 1.00
K96HB2 1.00
K96HB3 1.00
K96HG2 1.00
K96HD2 1.00
K96HD3 1.00
K96HE2 1.00
K96H 1.00
K96HZ2 1.00
K96HG3 1.00
I97H 0.96


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS96 HA 1.00 0.000 1.00 0.19
LYS96 HB2 1.00 0.000 1.00 0.58
LYS96 HB3 1.00 0.000 1.00 0.42
LYS96 HG2 1.00 0.000 1.00 1.61
LYS96 HG3 1.00 0.000 1.00 6.77
LYS96 HD2 1.00 0.000 1.00 1.43
LYS96 HD3 1.00 0.000 1.00 1.43
LYS96 HE2 1.00 0.000 1.00 0.42
LYS96 H 1.00 0.000 1.00 -1766.00
ILE97 H 0.96 0.000 1.00 -308.00

Detailed Probabilities of LYS(96)-HD2:

Overall probability: 1.000
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS96 1.00 0.89

Expected NOESY Contacts
Proton Expected probability
K96HA 0.98
K96HB2 1.00
K96HB3 1.00
K96HG2 1.00
K96HG3 1.00
K96HD3 1.00
K96HE2 1.00
K96HZ2 1.00
K96HD2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS96 HA 0.98 0.000 1.00 0.29
LYS96 HB2 1.00 0.000 1.00 0.95
LYS96 HB3 1.00 0.000 1.00 0.48
LYS96 HG2 1.00 0.000 1.00 0.97
LYS96 HG3 1.00 0.000 1.00 1.61
LYS96 HD2 1.00 0.000 1.00 27.74
LYS96 HD3 1.00 0.000 1.00 27.74
LYS96 HE2 1.00 0.000 1.00 1.03
LYS96 H 0.88 0.000 1.00 -4130.00

Detailed Probabilities of LYS(96)-HD3:

Overall probability: 1.000
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS96 1.00 0.89

Expected NOESY Contacts
Proton Expected probability
K96HA 0.98
K96HB2 1.00
K96HB3 1.00
K96HG2 1.00
K96HG3 1.00
K96HD2 1.00
K96HE2 1.00
K96HZ2 1.00
K96HD3 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS96 HA 0.98 0.000 1.00 0.29
LYS96 HB2 1.00 0.000 1.00 0.95
LYS96 HB3 1.00 0.000 1.00 0.75
LYS96 HG2 1.00 0.000 1.00 0.97
LYS96 HG3 1.00 0.000 1.00 1.31
LYS96 HD2 1.00 0.000 1.00 45.30
LYS96 HD3 1.00 0.000 1.00 45.30
LYS96 HE2 1.00 0.000 1.00 1.19
LYS96 H 0.87 0.000 1.00 -1012.00

Detailed Probabilities of LYS(96)-HE2:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS96 1.00 0.88

Expected NOESY Contacts
Proton Expected probability
K96HB2 0.98
K96HB3 0.99
K96HG2 1.00
K96HG3 1.00
K96HD2 1.00
K96HD3 1.00
K96HE3 1.00
K96HZ2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS96 HB2 0.99 0.000 1.00 0.12
LYS96 HB3 0.99 0.000 1.00 0.06
LYS96 HG2 1.00 0.000 1.00 0.16
LYS96 HG3 1.00 0.000 1.00 0.15
LYS96 HD2 1.00 0.000 1.00 0.72
LYS96 HD3 1.00 0.000 1.00 0.72
LYS96 HE2 1.00 0.000 1.00 38.95
LYS96 HA 0.76 0.000 1.00 0.06

Detailed Probabilities of LYS(96)-H:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG95 1.00 1.00
LYS96 1.00 1.00
ILE97 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
R95HG2 0.97
R95HA 1.00
R95H 1.00
R95HB3 1.00
R95HB2 1.00
K96HA 1.00
K96HB2 1.00
K96HB3 1.00
K96HG2 1.00
K96HG3 1.00
K96H 1.00
I97H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG95 HA 1.00 0.000 1.00 0.04
ARG95 HB2 1.00 0.000 1.00 0.04
ARG95 HB3 1.00 0.000 1.00 0.05
ARG95 HG2 0.97 0.000 1.00 0.02
ARG95 H 1.00 0.000 1.00 -6128.00
ARG95 HG3 0.95 0.000 1.00 0.02
ARG95 HD2 0.55 0.000 1.00 0.00
ARG95 HD3 0.57 0.000 1.00 0.00
LYS96 HA 1.00 0.000 1.00 0.19
LYS96 HB2 1.00 0.000 1.00 0.23
LYS96 HB3 1.00 0.000 1.00 0.30
LYS96 HG2 1.00 0.000 1.00 0.05
LYS96 HG3 1.00 0.000 1.00 0.07
LYS96 H 1.00 0.000 1.00 -36770.00
LYS96 HD2 0.88 0.000 1.00 0.04
LYS96 HD3 0.87 0.000 1.00 0.04
ILE97 H 1.00 0.000 1.00 -17360.00