ARECA's report on LYS62

Residue probability: 0.591
Residue probability confidence: 0.945

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 174.846 176.660 3.133 0.000 0.000
CA 56.624 57.014 3.028 0.793 1.000
CB 35.500 32.981 3.186 0.273 1.000
CG 24.553 24.941 1.956 0.845 0.917
CD 29.505 29.020 2.193 0.770 0.900
CE 41.780 41.893 1.492 0.114 0.889
N 130.818 120.954 4.210 1.000 1.000
NZ NA -- -- 0.000 0.000
HA 4.514 4.262 0.489 0.867 1.000
HB2 1.426 1.774 0.365 0.669 1.000
HB3 1.345 1.742 0.385 0.184 1.000
HG2 1.556 1.358 0.344 0.455 0.917
HG3 1.416 1.343 0.357 0.636 0.917
HD2 1.603 1.614 0.957 0.156 0.900
HD3 1.740 1.595 0.387 0.570 0.900
HE2 3.058 2.907 0.230 0.627 0.889
HE3 3.060 2.901 0.241 0.626 0.889
H 9.311 8.185 0.605 0.867 1.000
HZ NA -- -- 0.000 0.000

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Detailed Probabilities of LYS(62)-CA:

Overall probability: 0.793
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL61 0.75 1.00
LYS62 0.89 1.00
SER63 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
V61HA 1.00
K62HB2 1.00
K62HB3 1.00
K62HG2 1.00
K62HG3 1.00
K62HD2 0.98
K62HD3 0.98
K62H 1.00
K62HA 1.00
S63HA 1.00
S63H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL61 HA 1.00 0.187 0.00 0.00
VAL61 HB 0.81 0.026 1.00 0.18
VAL61 HG11 0.59 0.018 1.00 0.18
VAL61 H 0.91 0.026 1.00 0.40
LYS62 HA 1.00 0.011 1.00 111.89
LYS62 HB2 1.00 0.000 1.00 1.32
LYS62 HB3 1.00 0.000 1.00 1.09
LYS62 HG2 1.00 0.008 1.00 0.95
LYS62 HG3 1.00 0.010 1.00 1.32
LYS62 HD2 0.98 0.039 0.10 0.00
LYS62 HD3 0.98 0.006 1.00 0.25
LYS62 H 1.00 0.003 1.00 0.57
SER63 HA 1.00 0.057 0.00 0.00
SER63 H 1.00 0.002 1.00 0.40

Detailed Probabilities of LYS(62)-CB:

Overall probability: 0.273
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS62 0.20 1.00
SER63 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K62HA 1.00
K62HB2 1.00
K62HG2 1.00
K62HG3 1.00
K62HD2 1.00
K62HD3 1.00
K62HE2 0.99
K62HE3 0.99
K62H 1.00
K62HB3 1.00
S63H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS62 HA 1.00 1.459 0.00 0.00
LYS62 HB2 1.00 0.478 0.00 0.00
LYS62 HB3 1.00 0.559 0.00 0.00
LYS62 HG2 1.00 0.348 0.00 0.00
LYS62 HG3 1.00 0.488 0.00 0.00
LYS62 HD2 1.00 0.301 0.00 0.00
LYS62 HD3 1.00 0.164 0.00 0.00
LYS62 HE2 0.99 0.003 1.00 0.11
LYS62 HE3 0.99 0.005 1.00 0.11
LYS62 H 1.00 1.038 0.00 0.00
SER63 H 1.00 0.002 1.00 0.15

Detailed Probabilities of LYS(62)-CG:

Overall probability: 0.845
Overall confidence: 0.917

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS62 0.83 0.91
SER63 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K62HA 1.00
K62HB2 1.00
K62HB3 1.00
K62HG3 1.00
K62HD2 1.00
K62HD3 1.00
K62HE2 1.00
K62HE3 1.00
K62H 1.00
K62HZ2 1.00
K62HG2 1.00
S63H 0.97


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS62 HA 1.00 0.002 1.00 0.49
LYS62 HB2 1.00 0.007 1.00 3.08
LYS62 HB3 1.00 0.074 0.00 0.00
LYS62 HG2 1.00 0.010 1.00 3.88
LYS62 HG3 1.00 0.003 1.00 3.08
LYS62 HD2 1.00 0.037 0.30 0.00
LYS62 HD3 1.00 0.009 1.00 1.01
LYS62 HE2 1.00 0.001 1.00 0.65
LYS62 HE3 1.00 0.003 1.00 0.65
LYS62 H 1.00 0.003 1.00 0.14
SER63 H 0.97 0.010 1.00 0.10

Detailed Probabilities of LYS(62)-CD:

Overall probability: 0.770
Overall confidence: 0.900

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS62 0.77 0.90

Expected NOESY Contacts
Proton Expected probability
K62HA 0.98
K62HB2 1.00
K62HB3 1.00
K62HG2 1.00
K62HG3 1.00
K62HD2 1.00
K62HE2 1.00
K62HE3 1.00
K62HZ2 1.00
K62HD3 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS62 HA 0.98 0.006 1.00 0.24
LYS62 HB2 1.00 0.006 1.00 1.13
LYS62 HB3 1.00 0.075 0.00 0.00
LYS62 HG2 1.00 0.041 0.00 0.00
LYS62 HG3 1.00 0.004 1.00 1.13
LYS62 HD2 1.00 0.006 1.00 4.42
LYS62 HD3 1.00 0.033 0.70 0.00
LYS62 HE2 1.00 0.002 1.00 1.25
LYS62 HE3 1.00 0.004 1.00 1.25
LYS62 H 0.87 0.001 1.00 0.08

Detailed Probabilities of LYS(62)-CE:

Overall probability: 0.114
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS62 0.11 0.89

Expected NOESY Contacts
Proton Expected probability
K62HB2 0.98
K62HB3 0.99
K62HG2 1.00
K62HG3 1.00
K62HD2 1.00
K62HD3 1.00
K62HE3 1.00
K62HZ2 1.00
K62HE2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS62 HB2 0.98 0.459 0.02 0.00
LYS62 HB3 0.99 0.532 0.01 0.00
LYS62 HG2 1.00 0.329 0.00 0.00
LYS62 HG3 1.00 0.469 0.00 0.00
LYS62 HD2 1.00 0.282 0.00 0.00
LYS62 HD3 1.00 0.145 0.00 0.00
LYS62 HE2 1.00 0.151 0.00 0.00
LYS62 HE3 1.00 0.153 0.00 0.00
LYS62 HA 0.77 0.002 1.00 0.17

Detailed Probabilities of LYS(62)-N:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL61 1.00 1.00
LYS62 1.00 1.00
SER63 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V61HA 1.00
V61HG21 0.95
V61H 1.00
V61HG11 0.98
V61HB 1.00
K62HA 1.00
K62HB2 1.00
K62HB3 1.00
K62HG2 1.00
K62HG3 1.00
K62H 1.00
S63H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL61 HA 1.00 0.002 1.00 -2993094.00
VAL61 HB 1.00 0.015 1.00 -237358.00
VAL61 HG11 0.98 0.002 1.00 -1035587.00
VAL61 HG21 0.95 0.000 1.00 -698754.00
VAL61 H 1.00 0.023 1.00 -1891826.00
LYS62 HA 1.00 0.003 1.00 -645615.00
LYS62 HB2 1.00 0.001 1.00 -1310803.00
LYS62 HB3 1.00 0.021 1.00 -880713.00
LYS62 HG2 1.00 0.008 1.00 -470350.00
LYS62 HG3 1.00 0.009 1.00 -1310803.00
LYS62 H 1.00 0.002 1.00 -6220846.00
LYS62 HD3 0.87 0.009 1.00 -138508.00
SER63 H 1.00 0.001 1.00 -1891826.00
SER63 HA 0.87 0.010 1.00 -113727.00

Detailed Probabilities of LYS(62)-HA:

Overall probability: 0.867
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL61 1.00 1.00
LYS62 0.80 1.00
SER63 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V61HA 1.00
K62HB2 1.00
K62HB3 1.00
K62HG2 1.00
K62HG3 1.00
K62HD2 0.98
K62HD3 0.98
K62H 1.00
K62HA 1.00
S63HA 1.00
S63H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL61 HA 1.00 0.005 1.00 0.14
VAL61 HG11 0.59 0.006 1.00 0.08
VAL61 H 0.91 0.002 1.00 -101131.00
LYS62 HA 1.00 0.011 1.00 111.89
LYS62 HB2 1.00 0.793 0.00 0.00
LYS62 HB3 1.00 1.459 0.00 0.00
LYS62 HG2 1.00 0.002 1.00 0.49
LYS62 HG3 1.00 0.001 1.00 0.42
LYS62 HD2 0.98 0.005 1.00 0.23
LYS62 HD3 0.98 0.006 1.00 0.24
LYS62 H 1.00 0.003 1.00 -645615.00
LYS62 HE2 0.77 0.002 1.00 0.17
LYS62 HE3 0.76 0.002 1.00 0.17
SER63 HA 1.00 0.024 1.00 1.11
SER63 H 1.00 0.004 1.00 -633644.00

Detailed Probabilities of LYS(62)-HB2:

Overall probability: 0.669
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS62 0.60 1.00
SER63 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K62HA 1.00
K62HB3 1.00
K62HG2 1.00
K62HG3 1.00
K62HD2 1.00
K62HD3 1.00
K62HE2 0.98
K62HE3 0.99
K62H 1.00
K62HB2 1.00
S63H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS62 HA 1.00 0.000 1.00 1.32
LYS62 HB2 1.00 0.221 0.00 0.00
LYS62 HB3 1.00 0.478 0.00 0.00
LYS62 HG2 1.00 0.007 1.00 3.08
LYS62 HG3 1.00 0.011 1.00 5.33
LYS62 HD2 1.00 0.006 1.00 1.58
LYS62 HD3 1.00 0.006 1.00 1.13
LYS62 HE2 0.98 0.459 0.02 0.00
LYS62 HE3 0.99 0.459 0.01 0.00
LYS62 H 1.00 0.001 1.00 -1310803.00
SER63 H 1.00 0.001 1.00 -1444562.00
SER63 HA 0.67 0.015 1.00 0.22

Detailed Probabilities of LYS(62)-HB3:

Overall probability: 0.184
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS62 0.20 1.00
SER63 0.00 1.00

Expected NOESY Contacts
Proton Expected probability
K62HA 1.00
K62HB2 1.00
K62HG2 1.00
K62HG3 1.00
K62HD2 1.00
K62HD3 1.00
K62HE2 0.99
K62HE3 0.99
K62H 1.00
K62HB3 1.00
S63H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS62 HA 1.00 0.000 1.00 1.09
LYS62 HB2 1.00 0.140 0.00 0.00
LYS62 HB3 1.00 0.559 0.00 0.00
LYS62 HG2 1.00 0.074 0.00 0.00
LYS62 HG3 1.00 0.070 0.00 0.00
LYS62 HD2 1.00 0.075 0.00 0.00
LYS62 HD3 1.00 0.075 0.00 0.00
LYS62 HE2 0.99 0.532 0.01 0.00
LYS62 HE3 0.99 0.532 0.01 0.00
LYS62 H 1.00 0.021 1.00 -880713.00
SER63 H 1.00 0.080 0.00 0.00

Detailed Probabilities of LYS(62)-HG2:

Overall probability: 0.455
Overall confidence: 0.917

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS62 0.40 0.91
SER63 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K62HA 1.00
K62HB2 1.00
K62HB3 1.00
K62HG3 1.00
K62HD2 1.00
K62HD3 1.00
K62HE2 1.00
K62HE3 1.00
K62H 1.00
K62HZ2 1.00
K62HG2 1.00
S63H 0.97


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS62 HA 1.00 0.008 1.00 0.95
LYS62 HB2 1.00 0.351 0.00 0.00
LYS62 HB3 1.00 0.348 0.00 0.00
LYS62 HG2 1.00 0.010 1.00 3.88
LYS62 HG3 1.00 0.005 1.00 3.07
LYS62 HD2 1.00 0.136 0.00 0.00
LYS62 HD3 1.00 0.041 0.00 0.00
LYS62 HE2 1.00 0.329 0.00 0.00
LYS62 HE3 1.00 0.329 0.00 0.00
LYS62 H 1.00 0.008 1.00 -470350.00
SER63 H 0.97 0.001 1.00 -406648.00

Detailed Probabilities of LYS(62)-HG3:

Overall probability: 0.636
Overall confidence: 0.917

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS62 0.60 0.91
SER63 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K62HA 1.00
K62HB2 1.00
K62HB3 1.00
K62HG2 1.00
K62HD2 1.00
K62HD3 1.00
K62HE2 1.00
K62HE3 1.00
K62H 1.00
K62HZ2 1.00
K62HG3 1.00
S63H 0.96


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS62 HA 1.00 0.010 1.00 1.32
LYS62 HB2 1.00 0.211 0.00 0.00
LYS62 HB3 1.00 0.488 0.00 0.00
LYS62 HG2 1.00 0.003 1.00 3.08
LYS62 HG3 1.00 0.001 1.00 5.33
LYS62 HD2 1.00 0.004 1.00 1.58
LYS62 HD3 1.00 0.004 1.00 1.13
LYS62 HE2 1.00 0.469 0.00 0.00
LYS62 HE3 1.00 0.469 0.00 0.00
LYS62 H 1.00 0.009 1.00 -1310803.00
SER63 H 0.96 0.009 1.00 -1444562.00

Detailed Probabilities of LYS(62)-HD2:

Overall probability: 0.156
Overall confidence: 0.900

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS62 0.16 0.90

Expected NOESY Contacts
Proton Expected probability
K62HA 0.98
K62HB2 1.00
K62HB3 1.00
K62HG2 1.00
K62HG3 1.00
K62HD3 1.00
K62HE2 1.00
K62HE3 1.00
K62HZ2 1.00
K62HD2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS62 HA 0.98 0.039 0.10 0.00
LYS62 HB2 1.00 0.398 0.00 0.00
LYS62 HB3 1.00 0.301 0.00 0.00
LYS62 HG2 1.00 0.037 0.30 0.00
LYS62 HG3 1.00 0.042 0.00 0.00
LYS62 HD2 1.00 0.128 0.00 0.00
LYS62 HD3 1.00 0.006 1.00 4.42
LYS62 HE2 1.00 0.282 0.00 0.00
LYS62 HE3 1.00 0.282 0.00 0.00

Detailed Probabilities of LYS(62)-HD3:

Overall probability: 0.570
Overall confidence: 0.900

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS62 0.57 0.90

Expected NOESY Contacts
Proton Expected probability
K62HA 0.98
K62HB2 1.00
K62HB3 1.00
K62HG2 1.00
K62HG3 1.00
K62HD2 1.00
K62HE2 1.00
K62HE3 1.00
K62HZ2 1.00
K62HD3 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS62 HA 0.98 0.006 1.00 0.25
LYS62 HB2 1.00 0.535 0.00 0.00
LYS62 HB3 1.00 0.164 0.00 0.00
LYS62 HG2 1.00 0.009 1.00 1.01
LYS62 HG3 1.00 0.014 1.00 0.62
LYS62 HD2 1.00 0.009 1.00 3.56
LYS62 HD3 1.00 0.033 0.70 0.00
LYS62 HE2 1.00 0.145 0.00 0.00
LYS62 HE3 1.00 0.145 0.00 0.00
LYS62 H 0.87 0.009 1.00 -138508.00

Detailed Probabilities of LYS(62)-HE2:

Overall probability: 0.627
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS62 0.63 0.89

Expected NOESY Contacts
Proton Expected probability
K62HB2 0.98
K62HB3 0.99
K62HG2 1.00
K62HG3 1.00
K62HD2 1.00
K62HD3 1.00
K62HE3 1.00
K62HZ2 1.00
K62HE2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS62 HB2 0.98 1.853 0.02 0.00
LYS62 HB3 0.99 0.003 1.00 0.11
LYS62 HG2 1.00 0.001 1.00 0.65
LYS62 HG3 1.00 0.001 1.00 0.68
LYS62 HD2 1.00 0.000 1.00 1.14
LYS62 HD3 1.00 0.002 1.00 1.25
LYS62 HE2 1.00 0.151 0.00 0.00
LYS62 HE3 1.00 0.151 0.00 0.00

Detailed Probabilities of LYS(62)-HE3:

Overall probability: 0.626
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS62 0.63 0.89

Expected NOESY Contacts
Proton Expected probability
K62HB2 0.99
K62HB3 0.99
K62HG2 1.00
K62HG3 1.00
K62HD2 1.00
K62HD3 1.00
K62HE2 1.00
K62HZ2 1.00
K62HE3 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS62 HB2 0.99 1.855 0.01 0.00
LYS62 HB3 0.99 0.005 1.00 0.11
LYS62 HG2 1.00 0.003 1.00 0.65
LYS62 HG3 1.00 0.003 1.00 0.68
LYS62 HD2 1.00 0.002 1.00 1.14
LYS62 HD3 1.00 0.004 1.00 1.25
LYS62 HE2 1.00 0.153 0.00 0.00
LYS62 HE3 1.00 0.153 0.00 0.00

Detailed Probabilities of LYS(62)-H:

Overall probability: 0.867
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL61 1.00 1.00
LYS62 0.75 1.00
SER63 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V61HA 1.00
V61HG21 0.95
V61H 1.00
V61HG11 0.98
V61HB 1.00
K62HA 1.00
K62HB2 1.00
K62HB3 1.00
K62HG2 1.00
K62HG3 1.00
K62H 1.00
S63H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL61 HA 1.00 0.002 1.00 1.57
VAL61 HB 1.00 0.000 1.00 0.13
VAL61 HG11 0.98 0.002 1.00 0.62
VAL61 HG21 0.95 0.003 1.00 0.36
VAL61 H 1.00 0.005 1.00 -326786.00
LYS62 HA 1.00 0.003 1.00 0.57
LYS62 HB2 1.00 4.004 0.00 0.00
LYS62 HB3 1.00 1.038 0.00 0.00
LYS62 HG2 1.00 0.003 1.00 0.14
LYS62 HG3 1.00 0.006 1.00 0.19
LYS62 H 1.00 0.002 1.00 -6220846.00
LYS62 HD2 0.88 0.004 1.00 0.09
LYS62 HD3 0.87 0.001 1.00 0.08
SER63 H 1.00 0.001 1.00 -2741988.00
SER63 HA 0.87 0.005 1.00 0.09