ARECA's report on LYS75

Residue probability: 0.803
Residue probability confidence: 0.929

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 176.355 176.660 3.133 0.000 0.000
CA 53.639 57.014 3.028 0.802 1.000
CB 34.954 32.981 3.186 0.821 1.000
CG 22.886 24.941 1.956 0.700 0.909
CD 28.780 29.020 2.193 0.752 0.889
CE 42.241 41.893 1.492 1.000 0.875
N 126.207 120.954 4.210 1.000 0.909
NZ NA -- -- 0.000 0.000
HA 5.299 4.262 0.489 0.709 1.000
HB2 1.533 1.774 0.365 1.000 1.000
HB3 0.811 1.742 0.385 0.601 1.000
HG 1.010 1.358 0.344 0.803 0.909
HD2 -0.917 1.614 0.957 0.891 0.889
HD3 0.714 1.595 0.387 0.625 0.889
HE2 2.350 2.907 0.230 0.718 0.875
HE3 2.076 2.901 0.241 0.718 0.875
H 9.472 8.185 0.605 0.904 0.909
HZ NA -- -- 0.000 0.000

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Detailed Probabilities of LYS(75)-CA:

Overall probability: 0.802
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR74 0.00 1.00
LYS75 0.86 1.00
GLU76 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
T74HA 1.00
K75HB2 1.00
K75HB3 1.00
K75HG2 1.00
K75HD2 0.98
K75HD3 0.98
K75H 1.00
K75HA 1.00
E76HA 1.00
E76H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR74 HA 1.00 0.127 0.00 0.00
LYS75 HA 1.00 0.002 1.00 3.33
LYS75 HB2 1.00 0.001 1.00 0.52
LYS75 HB3 1.00 0.006 1.00 0.65
LYS75 HG2 1.00 0.013 1.00 0.24
LYS75 HD2 0.98 0.052 0.02 0.00
LYS75 HD3 0.98 0.002 1.00 0.08
LYS75 H 1.00 0.003 1.00 0.22
GLU76 HA 1.00 0.013 1.00 0.08
GLU76 H 1.00 0.004 1.00 1.10

Detailed Probabilities of LYS(75)-CB:

Overall probability: 0.821
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 0.78 1.00
GLU76 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K75HA 1.00
K75HB3 1.00
K75HG2 1.00
K75HD2 1.00
K75HD3 1.00
K75HE2 0.98
K75HE3 0.99
K75H 1.00
K75HB2 1.00
E76H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HA 1.00 0.003 1.00 0.41
LYS75 HB2 1.00 0.006 1.00 4.27
LYS75 HB3 1.00 0.000 1.00 0.76
LYS75 HG2 1.00 0.027 1.00 0.60
LYS75 HD2 1.00 0.001 1.00 0.16
LYS75 HD3 1.00 0.003 1.00 0.19
LYS75 HE2 0.98 0.402 0.02 0.00
LYS75 HE3 0.99 0.178 0.01 0.00
LYS75 H 1.00 0.007 1.00 0.09
GLU76 H 1.00 0.004 1.00 0.28
GLU76 HA 0.65 0.014 1.00 0.05

Detailed Probabilities of LYS(75)-CG:

Overall probability: 0.700
Overall confidence: 0.909

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 0.67 0.90
GLU76 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K75HA 1.00
K75HB2 1.00
K75HB3 1.00
K75HG3 1.00
K75HD2 1.00
K75HD3 1.00
K75HE2 1.00
K75HE3 1.00
K75H 1.00
K75HZ2 1.00
E76H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HA 1.00 0.004 1.00 0.13
LYS75 HB2 1.00 0.002 1.00 0.19
LYS75 HB3 1.00 0.371 0.00 0.00
LYS75 HG2 1.00 0.172 0.00 0.00
LYS75 HD2 1.00 0.007 1.00 0.18
LYS75 HD3 1.00 0.468 0.00 0.00
LYS75 HE2 1.00 0.006 1.00 0.16
LYS75 HE3 1.00 0.030 1.00 0.00
LYS75 H 1.00 0.000 1.00 0.29
GLU76 H 0.97 0.008 1.00 0.07

Detailed Probabilities of LYS(75)-CD:

Overall probability: 0.752
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 0.75 0.89

Expected NOESY Contacts
Proton Expected probability
K75HA 0.98
K75HB2 1.00
K75HB3 1.00
K75HG2 1.00
K75HD3 1.00
K75HE2 1.00
K75HE3 1.00
K75HZ2 1.00
K75HD2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HA 0.98 2.955 0.02 0.00
LYS75 HB2 1.00 0.004 1.00 0.18
LYS75 HB3 1.00 0.090 0.00 0.00
LYS75 HG2 1.00 0.009 1.00 0.31
LYS75 HD2 1.00 0.003 1.00 0.64
LYS75 HD3 1.00 0.007 1.00 0.63
LYS75 HE2 1.00 0.006 1.00 0.15
LYS75 HE3 1.00 0.003 1.00 0.24

Detailed Probabilities of LYS(75)-CE:

Overall probability: 1.000
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 1.00 0.88

Expected NOESY Contacts
Proton Expected probability
K75HB2 0.98
K75HB3 0.99
K75HG2 1.00
K75HD2 1.00
K75HD3 1.00
K75HE3 1.00
K75HZ2 1.00
K75HE2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HB2 0.98 0.010 1.00 0.08
LYS75 HB3 0.99 0.006 1.00 0.09
LYS75 HG2 1.00 0.008 1.00 0.34
LYS75 HD2 1.00 0.002 1.00 0.32
LYS75 HD3 1.00 0.005 1.00 0.27
LYS75 HE2 1.00 0.001 1.00 1.79
LYS75 HE3 1.00 0.003 1.00 1.56

Detailed Probabilities of LYS(75)-N:

Overall probability: 1.000
Overall confidence: 0.909

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR74 1.00 0.80
LYS75 1.00 1.00
GLU76 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
T74H 1.00
T74HG22 0.95
T74HG1 0.97
T74HB 1.00
T74HA 1.00
K75HA 1.00
K75HB2 1.00
K75HB3 1.00
K75HG2 1.00
K75H 1.00
E76H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR74 HA 1.00 0.001 1.00 -1493524.00
THR74 HB 1.00 0.005 1.00 -134288.00
THR74 HG21 0.96 0.008 1.00 -1142098.00
THR74 H 1.00 0.015 1.00 -153442.00
LYS75 HA 1.00 0.005 1.00 -376386.00
LYS75 HB2 1.00 0.001 1.00 -271516.00
LYS75 HB3 1.00 0.003 1.00 -410651.00
LYS75 HG2 1.00 0.008 1.00 -1163921.00
LYS75 H 1.00 0.000 1.00 -3973519.00
LYS75 HD2 0.88 0.002 1.00 -164169.00
GLU76 H 1.00 0.000 1.00 -146731.00

Detailed Probabilities of LYS(75)-HA:

Overall probability: 0.709
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR74 0.00 1.00
LYS75 0.73 1.00
GLU76 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
T74HA 1.00
K75HB2 1.00
K75HB3 1.00
K75HG2 1.00
K75HD2 0.98
K75HD3 0.98
K75H 1.00
K75HA 1.00
E76HA 1.00
E76H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR74 HA 1.00 0.494 0.00 0.00
LYS75 HA 1.00 0.002 1.00 3.33
LYS75 HB2 1.00 0.003 1.00 0.41
LYS75 HB3 1.00 0.002 1.00 0.35
LYS75 HG2 1.00 0.004 1.00 0.13
LYS75 HD2 0.98 2.955 0.02 0.00
LYS75 HD3 0.98 0.515 0.02 0.00
LYS75 H 1.00 0.005 1.00 -376386.00
LYS75 HE2 0.77 0.033 0.77 0.00
GLU76 HA 1.00 0.011 1.00 0.18
GLU76 H 1.00 0.003 1.00 -2829488.00

Detailed Probabilities of LYS(75)-HB2:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 1.00 1.00
GLU76 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K75HA 1.00
K75HB3 1.00
K75HG2 1.00
K75HD2 1.00
K75HD3 1.00
K75HE2 0.98
K75HE3 0.99
K75H 1.00
K75HB2 1.00
E76H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HA 1.00 0.001 1.00 0.52
LYS75 HB2 1.00 0.006 1.00 4.27
LYS75 HB3 1.00 0.001 1.00 0.57
LYS75 HG2 1.00 0.002 1.00 0.19
LYS75 HD2 1.00 0.004 1.00 0.18
LYS75 HD3 1.00 0.021 1.00 0.41
LYS75 HE2 0.98 0.010 1.00 0.08
LYS75 HE3 0.99 0.003 1.00 0.08
LYS75 H 1.00 0.001 1.00 -271516.00
GLU76 H 1.00 0.003 1.00 -1255238.00

Detailed Probabilities of LYS(75)-HB3:

Overall probability: 0.601
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 0.56 1.00
GLU76 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K75HA 1.00
K75HB2 1.00
K75HG2 1.00
K75HD2 1.00
K75HD3 1.00
K75HE2 0.99
K75HE3 0.99
K75H 1.00
K75HB3 1.00
E76H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HA 1.00 0.006 1.00 0.65
LYS75 HB2 1.00 0.000 1.00 0.76
LYS75 HB3 1.00 0.003 1.00 0.70
LYS75 HG2 1.00 0.371 0.00 0.00
LYS75 HD2 1.00 0.090 0.00 0.00
LYS75 HD3 1.00 0.183 0.00 0.00
LYS75 HE2 0.99 0.006 1.00 0.09
LYS75 HE3 0.99 0.088 0.01 0.00
LYS75 H 1.00 0.003 1.00 -410651.00
GLU76 H 1.00 0.004 1.00 -850114.00

Detailed Probabilities of LYS(75)-HG2:

Overall probability: 0.803
Overall confidence: 0.909

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 0.89 0.90
GLU76 0.03 1.00

Expected NOESY Contacts
Proton Expected probability
K75HA 1.00
K75HB2 1.00
K75HB3 1.00
K75HG3 1.00
K75HD2 1.00
K75HD3 1.00
K75HE2 1.00
K75HE3 1.00
K75H 1.00
K75HZ2 1.00
E76H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HA 1.00 0.013 1.00 0.24
LYS75 HB2 1.00 0.027 1.00 0.60
LYS75 HB3 1.00 0.009 1.00 0.32
LYS75 HG2 1.00 0.172 0.00 0.00
LYS75 HD2 1.00 0.009 1.00 0.31
LYS75 HD3 1.00 0.016 1.00 0.28
LYS75 HE2 1.00 0.008 1.00 0.34
LYS75 HE3 1.00 0.012 1.00 0.26
LYS75 H 1.00 0.008 1.00 -1163921.00
GLU76 H 0.97 0.048 0.03 0.00

Detailed Probabilities of LYS(75)-HD2:

Overall probability: 0.891
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 0.89 0.89

Expected NOESY Contacts
Proton Expected probability
K75HA 0.98
K75HB2 1.00
K75HB3 1.00
K75HG2 1.00
K75HD3 1.00
K75HE2 1.00
K75HE3 1.00
K75HZ2 1.00
K75HD2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HA 0.98 0.052 0.02 0.00
LYS75 HB2 1.00 0.001 1.00 0.16
LYS75 HB3 1.00 0.003 1.00 0.17
LYS75 HG2 1.00 0.007 1.00 0.18
LYS75 HD2 1.00 0.003 1.00 0.64
LYS75 HD3 1.00 0.004 1.00 0.58
LYS75 HE2 1.00 0.002 1.00 0.32
LYS75 HE3 1.00 0.002 1.00 0.47
LYS75 H 0.88 0.002 1.00 -164169.00

Detailed Probabilities of LYS(75)-HD3:

Overall probability: 0.625
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 0.63 0.89

Expected NOESY Contacts
Proton Expected probability
K75HA 0.98
K75HB2 1.00
K75HB3 1.00
K75HG2 1.00
K75HD2 1.00
K75HE2 1.00
K75HE3 1.00
K75HZ2 1.00
K75HD3 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HA 0.98 0.002 1.00 0.08
LYS75 HB2 1.00 0.003 1.00 0.19
LYS75 HB3 1.00 0.094 0.00 0.00
LYS75 HG2 1.00 0.468 0.00 0.00
LYS75 HD2 1.00 0.007 1.00 0.63
LYS75 HD3 1.00 0.280 0.00 0.00
LYS75 HE2 1.00 0.005 1.00 0.27
LYS75 HE3 1.00 0.009 1.00 0.38

Detailed Probabilities of LYS(75)-HE2:

Overall probability: 0.718
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 0.72 0.88

Expected NOESY Contacts
Proton Expected probability
K75HB2 0.98
K75HB3 0.99
K75HG2 1.00
K75HD2 1.00
K75HD3 1.00
K75HE3 1.00
K75HZ2 1.00
K75HE2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HB2 0.98 0.402 0.02 0.00
LYS75 HB3 0.99 0.816 0.01 0.00
LYS75 HG2 1.00 0.006 1.00 0.16
LYS75 HD2 1.00 0.006 1.00 0.15
LYS75 HD3 1.00 0.005 1.00 0.15
LYS75 HE2 1.00 0.001 1.00 1.79
LYS75 HE3 1.00 0.000 1.00 1.59

Detailed Probabilities of LYS(75)-HE3:

Overall probability: 0.718
Overall confidence: 0.875

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS75 0.72 0.88

Expected NOESY Contacts
Proton Expected probability
K75HB2 0.99
K75HB3 0.99
K75HG2 1.00
K75HD2 1.00
K75HD3 1.00
K75HE2 1.00
K75HZ2 1.00
K75HE3 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS75 HB2 0.99 0.178 0.01 0.00
LYS75 HB3 0.99 0.542 0.01 0.00
LYS75 HG2 1.00 0.030 1.00 0.00
LYS75 HD2 1.00 0.003 1.00 0.24
LYS75 HD3 1.00 0.003 1.00 0.22
LYS75 HE2 1.00 0.003 1.00 1.56
LYS75 HE3 1.00 0.001 1.00 2.27

Detailed Probabilities of LYS(75)-H:

Overall probability: 0.904
Overall confidence: 0.909

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
THR74 0.76 0.80
LYS75 1.00 1.00
GLU76 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
T74H 1.00
T74HG22 0.95
T74HG1 0.97
T74HB 1.00
T74HA 1.00
K75HA 1.00
K75HB2 1.00
K75HB3 1.00
K75HG2 1.00
K75H 1.00
E76H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
THR74 HA 1.00 0.001 1.00 0.61
THR74 HB 1.00 0.014 1.00 0.07
THR74 HG21 0.96 0.117 0.04 0.00
THR74 H 1.00 0.002 1.00 -110276.00
LYS75 HA 1.00 0.003 1.00 0.22
LYS75 HB2 1.00 0.007 1.00 0.09
LYS75 HB3 1.00 0.003 1.00 0.09
LYS75 HG2 1.00 0.000 1.00 0.29
LYS75 H 1.00 0.000 1.00 -3973519.00
GLU76 H 1.00 0.010 1.00 -122692.00