ARECA's report on LYS123

Residue probability: 0.985
Residue probability confidence: 0.945

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 179.307 176.660 3.133 0.000 0.000
CA 59.243 57.014 3.028 1.000 1.000
CB 32.306 32.981 3.186 1.000 1.000
CG 25.679 24.941 1.956 0.913 0.917
CD 29.286 29.020 2.193 1.000 0.900
CE 41.780 41.893 1.492 1.000 0.889
N 121.605 120.954 4.210 1.000 1.000
NZ NA -- -- 0.000 0.000
HA 4.025 4.262 0.489 0.846 1.000
HB2 1.934 1.774 0.365 1.000 1.000
HB3 1.914 1.742 0.385 1.000 1.000
HG2 1.575 1.358 0.344 1.000 0.917
HG3 1.698 1.343 0.357 1.000 0.917
HD2 1.843 1.614 0.957 1.000 0.900
HD3 1.748 1.595 0.387 1.000 0.900
HE2 3.013 2.907 0.230 1.000 0.889
HE3 3.009 2.901 0.241 1.000 0.889
H 8.400 8.185 0.605 1.000 1.000
HZ NA -- -- 0.000 0.000

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Detailed Probabilities of LYS(123)-CA:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN122 1.00 1.00
LYS123 1.00 1.00
ALA124 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q122HA 1.00
K123HB2 1.00
K123HB3 1.00
K123HG2 1.00
K123HG3 1.00
K123HD2 0.98
K123HD3 0.98
K123H 1.00
K123HA 1.00
A124H 1.00
A124HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN122 HA 1.00 0.013 1.00 1.01
GLN122 HB2 0.68 0.024 1.00 0.32
GLN122 H 0.87 0.000 1.00 0.09
LYS123 HA 1.00 0.000 1.00 6.54
LYS123 HB2 1.00 0.000 1.00 0.62
LYS123 HB3 1.00 0.000 1.00 0.52
LYS123 HG2 1.00 0.000 1.00 0.08
LYS123 HG3 1.00 0.000 1.00 0.21
LYS123 HD2 0.98 0.000 1.00 0.14
LYS123 HD3 0.98 0.000 1.00 0.15
LYS123 H 1.00 0.000 1.00 0.03
ALA124 HA 1.00 0.022 1.00 1.01
ALA124 H 1.00 0.000 1.00 0.01

Detailed Probabilities of LYS(123)-CB:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 1.00 1.00
ALA124 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K123HA 1.00
K123HB3 1.00
K123HG2 1.00
K123HG3 1.00
K123HD2 1.00
K123HD3 1.00
K123HE2 0.98
K123HE3 0.99
K123H 1.00
K123HB2 1.00
A124H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HA 1.00 0.000 1.00 0.51
LYS123 HB2 1.00 0.000 1.00 8.38
LYS123 HB3 1.00 0.000 1.00 7.26
LYS123 HG2 1.00 0.000 1.00 0.57
LYS123 HG3 1.00 0.000 1.00 0.77
LYS123 HD2 1.00 0.000 1.00 2.01
LYS123 HD3 1.00 0.000 1.00 0.51
LYS123 HE2 0.98 0.000 1.00 0.02
LYS123 HE3 0.99 0.000 1.00 0.07
LYS123 H 1.00 0.000 1.00 0.07
ALA124 H 1.00 0.000 1.00 0.03
ALA124 HA 0.65 0.017 1.00 0.11

Detailed Probabilities of LYS(123)-CG:

Overall probability: 0.913
Overall confidence: 0.917

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 1.00 0.91
ALA124 0.04 1.00

Expected NOESY Contacts
Proton Expected probability
K123HA 1.00
K123HB2 1.00
K123HB3 1.00
K123HG2 1.00
K123HD2 1.00
K123HD3 1.00
K123HE2 1.00
K123HE3 1.00
K123H 1.00
K123HZ2 1.00
K123HG3 1.00
A124H 0.96


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HA 1.00 0.000 1.00 0.03
LYS123 HB2 1.00 0.000 1.00 0.22
LYS123 HB3 1.00 0.000 1.00 0.19
LYS123 HG2 1.00 0.000 1.00 0.57
LYS123 HG3 1.00 0.000 1.00 2.12
LYS123 HD2 1.00 0.000 1.00 0.14
LYS123 HD3 1.00 0.000 1.00 1.33
LYS123 HE2 1.00 0.000 1.00 0.09
LYS123 HE3 1.00 0.000 1.00 0.09
LYS123 H 1.00 0.000 1.00 0.05
ALA124 H 0.96 0.201 0.04 0.00

Detailed Probabilities of LYS(123)-CD:

Overall probability: 1.000
Overall confidence: 0.900

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 1.00 0.90

Expected NOESY Contacts
Proton Expected probability
K123HA 0.98
K123HB2 1.00
K123HB3 1.00
K123HG2 1.00
K123HG3 1.00
K123HD3 1.00
K123HE2 1.00
K123HE3 1.00
K123HZ2 1.00
K123HD2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HA 0.98 0.000 1.00 0.02
LYS123 HB2 1.00 0.000 1.00 0.25
LYS123 HB3 1.00 0.000 1.00 0.39
LYS123 HG2 1.00 0.000 1.00 0.14
LYS123 HG3 1.00 0.000 1.00 0.67
LYS123 HD2 1.00 0.000 1.00 1.54
LYS123 HD3 1.00 0.000 1.00 0.87
LYS123 HE2 1.00 0.000 1.00 0.08
LYS123 HE3 1.00 0.000 1.00 0.02
LYS123 H 0.88 0.004 1.00 0.01

Detailed Probabilities of LYS(123)-CE:

Overall probability: 1.000
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 1.00 0.89

Expected NOESY Contacts
Proton Expected probability
K123HB2 0.98
K123HB3 0.99
K123HG2 1.00
K123HG3 1.00
K123HD2 1.00
K123HD3 1.00
K123HE3 1.00
K123HZ2 1.00
K123HE2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HB2 0.98 0.000 1.00 0.25
LYS123 HB3 0.99 0.000 1.00 0.05
LYS123 HG2 1.00 0.000 1.00 0.12
LYS123 HG3 1.00 0.000 1.00 2.53
LYS123 HD2 1.00 0.000 1.00 0.02
LYS123 HD3 1.00 0.000 1.00 0.30
LYS123 HE2 1.00 0.000 1.00 37.22
LYS123 HE3 1.00 0.000 1.00 39.86

Detailed Probabilities of LYS(123)-N:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN122 1.00 1.00
LYS123 1.00 1.00
ALA124 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q122HG2 0.98
Q122HA 1.00
Q122HB3 1.00
Q122H 1.00
Q122HG3 0.96
K123HA 1.00
K123HB2 1.00
K123HB3 1.00
K123HG2 1.00
K123HG3 1.00
K123H 1.00
A124H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN122 HA 1.00 0.000 1.00 -3169.00
GLN122 HB2 1.00 0.000 1.00 -3749.00
GLN122 HG2 0.98 0.000 1.00 -674.00
GLN122 HG3 0.96 0.000 1.00 -301.00
GLN122 H 1.00 0.000 1.00 -3743.00
LYS123 HA 1.00 0.000 1.00 -1309.00
LYS123 HB2 1.00 0.000 1.00 -4843.00
LYS123 HB3 1.00 0.000 1.00 -4610.00
LYS123 HG2 1.00 0.000 1.00 -1329.00
LYS123 HG3 1.00 0.000 1.00 -3061.00
LYS123 H 1.00 0.000 1.00 -43270.00
LYS123 HD2 0.88 0.000 1.00 -1154.00
LYS123 HD3 0.87 0.000 1.00 -1516.00
ALA124 H 1.00 0.000 1.00 -3260.00
ALA124 HA 0.90 0.009 1.00 -3169.00

Detailed Probabilities of LYS(123)-HA:

Overall probability: 0.846
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN122 0.67 1.00
LYS123 1.00 1.00
ALA124 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
Q122HA 1.00
K123HB2 1.00
K123HB3 1.00
K123HG2 1.00
K123HG3 1.00
K123HD2 0.98
K123HD3 0.98
K123H 1.00
K123HA 1.00
A124H 1.00
A124HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN122 HA 1.00 0.110 0.00 0.00
GLN122 HB2 0.68 0.002 1.00 0.09
GLN122 H 0.87 0.002 1.00 -2424.00
LYS123 HA 1.00 0.000 1.00 6.54
LYS123 HB2 1.00 0.000 1.00 0.51
LYS123 HB3 1.00 0.000 1.00 0.56
LYS123 HG2 1.00 0.000 1.00 0.02
LYS123 HG3 1.00 0.000 1.00 0.03
LYS123 HD2 0.98 0.000 1.00 0.02
LYS123 HD3 0.98 0.000 1.00 0.06
LYS123 H 1.00 0.000 1.00 -1309.00
ALA124 HA 1.00 0.093 0.00 0.00
ALA124 H 1.00 0.000 1.00 -986.00

Detailed Probabilities of LYS(123)-HB2:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 1.00 1.00
ALA124 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K123HA 1.00
K123HB3 1.00
K123HG2 1.00
K123HG3 1.00
K123HD2 1.00
K123HD3 1.00
K123HE2 0.98
K123HE3 0.99
K123H 1.00
K123HB2 1.00
A124H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HA 1.00 0.000 1.00 0.62
LYS123 HB2 1.00 0.000 1.00 8.38
LYS123 HB3 1.00 0.000 1.00 8.52
LYS123 HG2 1.00 0.000 1.00 0.15
LYS123 HG3 1.00 0.000 1.00 0.22
LYS123 HD2 1.00 0.000 1.00 0.25
LYS123 HD3 1.00 0.000 1.00 0.34
LYS123 HE2 0.98 0.000 1.00 0.25
LYS123 HE3 0.99 0.000 1.00 0.25
LYS123 H 1.00 0.000 1.00 -4843.00
ALA124 H 1.00 0.000 1.00 -3590.00
ALA124 HA 0.65 0.001 1.00 0.04

Detailed Probabilities of LYS(123)-HB3:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 1.00 1.00
ALA124 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K123HA 1.00
K123HB2 1.00
K123HG2 1.00
K123HG3 1.00
K123HD2 1.00
K123HD3 1.00
K123HE2 0.99
K123HE3 0.99
K123H 1.00
K123HB3 1.00
A124H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HA 1.00 0.000 1.00 0.52
LYS123 HB2 1.00 0.000 1.00 7.26
LYS123 HB3 1.00 0.000 1.00 9.57
LYS123 HG2 1.00 0.000 1.00 0.14
LYS123 HG3 1.00 0.000 1.00 0.19
LYS123 HD2 1.00 0.000 1.00 0.39
LYS123 HD3 1.00 0.000 1.00 0.35
LYS123 HE2 0.99 0.000 1.00 0.05
LYS123 HE3 0.99 0.000 1.00 0.05
LYS123 H 1.00 0.000 1.00 -4610.00
ALA124 H 1.00 0.000 1.00 -3306.00
ALA124 HA 0.84 0.019 1.00 0.04

Detailed Probabilities of LYS(123)-HG2:

Overall probability: 1.000
Overall confidence: 0.917

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 1.00 0.91
ALA124 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K123HA 1.00
K123HB2 1.00
K123HB3 1.00
K123HG3 1.00
K123HD2 1.00
K123HD3 1.00
K123HE2 1.00
K123HE3 1.00
K123H 1.00
K123HZ2 1.00
K123HG2 1.00
A124H 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HA 1.00 0.000 1.00 0.08
LYS123 HB2 1.00 0.000 1.00 0.57
LYS123 HB3 1.00 0.000 1.00 0.58
LYS123 HG2 1.00 0.000 1.00 1.92
LYS123 HG3 1.00 0.000 1.00 0.57
LYS123 HD2 1.00 0.000 1.00 0.14
LYS123 HD3 1.00 0.000 1.00 0.35
LYS123 HE2 1.00 0.000 1.00 0.12
LYS123 HE3 1.00 0.000 1.00 0.12
LYS123 H 1.00 0.000 1.00 -1329.00
ALA124 H 0.98 0.000 1.00 -138.00

Detailed Probabilities of LYS(123)-HG3:

Overall probability: 1.000
Overall confidence: 0.917

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 1.00 0.91
ALA124 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K123HA 1.00
K123HB2 1.00
K123HB3 1.00
K123HG2 1.00
K123HD2 1.00
K123HD3 1.00
K123HE2 1.00
K123HE3 1.00
K123H 1.00
K123HZ2 1.00
K123HG3 1.00
A124H 0.96


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HA 1.00 0.000 1.00 0.21
LYS123 HB2 1.00 0.000 1.00 0.77
LYS123 HB3 1.00 0.000 1.00 0.84
LYS123 HG2 1.00 0.000 1.00 0.76
LYS123 HG3 1.00 0.000 1.00 2.12
LYS123 HD2 1.00 0.000 1.00 0.67
LYS123 HD3 1.00 0.000 1.00 7.94
LYS123 HE2 1.00 0.000 1.00 2.53
LYS123 HE3 1.00 0.000 1.00 2.53
LYS123 H 1.00 0.000 1.00 -3061.00
ALA124 H 0.96 0.000 1.00 -312.00

Detailed Probabilities of LYS(123)-HD2:

Overall probability: 1.000
Overall confidence: 0.900

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 1.00 0.90

Expected NOESY Contacts
Proton Expected probability
K123HA 0.98
K123HB2 1.00
K123HB3 1.00
K123HG2 1.00
K123HG3 1.00
K123HD3 1.00
K123HE2 1.00
K123HE3 1.00
K123HZ2 1.00
K123HD2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HA 0.98 0.000 1.00 0.14
LYS123 HB2 1.00 0.000 1.00 2.01
LYS123 HB3 1.00 0.000 1.00 3.36
LYS123 HG2 1.00 0.000 1.00 0.16
LYS123 HG3 1.00 0.000 1.00 0.14
LYS123 HD2 1.00 0.000 1.00 1.54
LYS123 HD3 1.00 0.000 1.00 0.83
LYS123 HE2 1.00 0.000 1.00 0.02
LYS123 HE3 1.00 0.000 1.00 0.02
LYS123 H 0.88 0.000 1.00 -1154.00

Detailed Probabilities of LYS(123)-HD3:

Overall probability: 1.000
Overall confidence: 0.900

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 1.00 0.90

Expected NOESY Contacts
Proton Expected probability
K123HA 0.98
K123HB2 1.00
K123HB3 1.00
K123HG2 1.00
K123HG3 1.00
K123HD2 1.00
K123HE2 1.00
K123HE3 1.00
K123HZ2 1.00
K123HD3 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HA 0.98 0.000 1.00 0.15
LYS123 HB2 1.00 0.000 1.00 0.51
LYS123 HB3 1.00 0.000 1.00 0.65
LYS123 HG2 1.00 0.000 1.00 0.49
LYS123 HG3 1.00 0.000 1.00 1.33
LYS123 HD2 1.00 0.000 1.00 0.87
LYS123 HD3 1.00 0.000 1.00 6.77
LYS123 HE2 1.00 0.000 1.00 0.30
LYS123 HE3 1.00 0.000 1.00 0.30
LYS123 H 0.87 0.000 1.00 -1516.00

Detailed Probabilities of LYS(123)-HE2:

Overall probability: 1.000
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 1.00 0.89

Expected NOESY Contacts
Proton Expected probability
K123HB2 0.98
K123HB3 0.99
K123HG2 1.00
K123HG3 1.00
K123HD2 1.00
K123HD3 1.00
K123HE3 1.00
K123HZ2 1.00
K123HE2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HB2 0.98 0.000 1.00 0.02
LYS123 HB3 0.99 0.000 1.00 0.02
LYS123 HG2 1.00 0.000 1.00 0.08
LYS123 HG3 1.00 0.000 1.00 0.09
LYS123 HD2 1.00 0.000 1.00 0.08
LYS123 HD3 1.00 0.000 1.00 0.17
LYS123 HE2 1.00 0.000 1.00 37.22
LYS123 HE3 1.00 0.000 1.00 37.22

Detailed Probabilities of LYS(123)-HE3:

Overall probability: 1.000
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 1.00 0.89

Expected NOESY Contacts
Proton Expected probability
K123HB2 0.99
K123HB3 0.99
K123HG2 1.00
K123HG3 1.00
K123HD2 1.00
K123HD3 1.00
K123HE2 1.00
K123HZ2 1.00
K123HE3 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HB2 0.99 0.000 1.00 0.07
LYS123 HB3 0.99 0.000 1.00 0.06
LYS123 HG2 1.00 0.000 1.00 0.02
LYS123 HG3 1.00 0.000 1.00 0.09
LYS123 HD2 1.00 0.000 1.00 0.02
LYS123 HD3 1.00 0.000 1.00 0.28
LYS123 HE2 1.00 0.000 1.00 39.86
LYS123 HE3 1.00 0.000 1.00 39.86

Detailed Probabilities of LYS(123)-H:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLN122 1.00 1.00
LYS123 1.00 1.00
ALA124 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
Q122HG2 0.98
Q122HA 1.00
Q122HB3 1.00
Q122H 1.00
Q122HG3 0.96
K123HA 1.00
K123HB2 1.00
K123HB3 1.00
K123HG2 1.00
K123HG3 1.00
K123H 1.00
A124H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLN122 HA 1.00 0.000 1.00 0.09
GLN122 HB2 1.00 0.000 1.00 0.08
GLN122 HG2 0.98 0.000 1.00 0.06
GLN122 HG3 0.96 0.000 1.00 0.01
GLN122 H 1.00 0.000 1.00 -5373.00
LYS123 HA 1.00 0.000 1.00 0.03
LYS123 HB2 1.00 0.000 1.00 0.07
LYS123 HB3 1.00 0.000 1.00 0.07
LYS123 HG2 1.00 0.000 1.00 0.04
LYS123 HG3 1.00 0.000 1.00 0.05
LYS123 H 1.00 0.000 1.00 -43270.00
LYS123 HD2 0.88 0.004 1.00 0.01
LYS123 HD3 0.87 0.008 1.00 0.01
ALA124 H 1.00 0.000 1.00 -4272.00