ARECA's report on ALA124

Residue probability: 0.821
Residue probability confidence: 1.000

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
CA 54.652 53.289 3.425 0.565 1.000
CB 18.934 19.355 4.103 1.000 1.000
N 121.873 123.100 4.487 0.900 1.000
HA 4.144 4.254 0.459 0.625 1.000
HB 1.504 1.346 0.258 1.000 1.000
H 8.601 8.206 0.601 0.837 1.000

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Detailed Probabilities of ALA(124)-CA:

Overall probability: 0.565
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 0.66 1.00
ALA124 1.00 1.00
GLY125 0.00 1.00

Expected NOESY Contacts
Proton Expected probability
K123HA 1.00
A124H 1.00
A124HB1 1.00
A124HA 1.00
G125HA3 1.00
G125H 1.00
G125HA2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HA 1.00 0.119 0.00 0.00
LYS123 HB2 0.65 0.035 0.65 0.00
LYS123 HB3 0.84 0.015 1.00 0.34
LYS123 H 0.90 0.023 1.00 0.06
ALA124 HA 1.00 0.000 1.00 9.26
ALA124 HB1 1.00 0.001 1.00 1.82
ALA124 H 1.00 0.007 1.00 0.55
GLY125 HA2 1.00 0.092 0.00 0.00
GLY125 HA3 1.00 0.081 0.00 0.00
GLY125 H 1.00 0.058 0.00 0.00

Detailed Probabilities of ALA(124)-CB:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ALA124 1.00 1.00
GLY125 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
A124HA 1.00
A124H 1.00
A124HB2 1.00
G125H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ALA124 HA 1.00 0.000 1.00 2.09
ALA124 HB1 1.00 0.001 1.00 30.14
ALA124 H 1.00 0.006 1.00 1.39
GLY125 H 1.00 0.003 1.00 0.44

Detailed Probabilities of ALA(124)-N:

Overall probability: 0.900
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 0.83 1.00
ALA124 1.00 1.00
GLY125 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K123H 1.00
K123HG3 0.96
K123HB3 1.00
K123HB2 1.00
K123HG2 0.98
K123HA 1.00
A124HA 1.00
A124HB1 1.00
A124H 1.00
G125H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HA 1.00 0.068 0.00 0.00
LYS123 HB2 1.00 0.010 1.00 -530958.00
LYS123 HB3 1.00 0.010 1.00 -530958.00
LYS123 HG2 0.98 0.018 1.00 -96504.00
LYS123 HG3 0.96 0.013 1.00 -107012.00
LYS123 H 1.00 0.009 1.00 -618975.00
ALA124 HA 1.00 0.006 1.00 -846356.00
ALA124 HB1 1.00 0.000 1.00 -1567496.00
ALA124 H 1.00 0.004 1.00 -6488405.00
GLY125 H 1.00 0.006 1.00 -487040.00

Detailed Probabilities of ALA(124)-HA:

Overall probability: 0.625
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 0.50 1.00
ALA124 1.00 1.00
GLY125 0.33 1.00

Expected NOESY Contacts
Proton Expected probability
K123HA 1.00
A124H 1.00
A124HB1 1.00
A124HA 1.00
G125HA3 1.00
G125H 1.00
G125HA2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HA 1.00 0.102 0.00 0.00
LYS123 H 0.90 0.019 1.00 -702515.00
ALA124 HA 1.00 0.000 1.00 9.26
ALA124 HB1 1.00 0.000 1.00 2.09
ALA124 H 1.00 0.006 1.00 -846356.00
GLY125 HA2 1.00 0.094 0.00 0.00
GLY125 HA3 1.00 0.094 0.00 0.00
GLY125 H 1.00 0.010 1.00 -478065.00

Detailed Probabilities of ALA(124)-HB1:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ALA124 1.00 1.00
GLY125 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
A124HA 1.00
A124H 1.00
A124HB2 1.00
G125H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ALA124 HA 1.00 0.001 1.00 1.82
ALA124 HB1 1.00 0.001 1.00 30.14
ALA124 H 1.00 0.000 1.00 -1567496.00
GLY125 H 1.00 0.001 1.00 -636121.00
GLY125 HA2 0.56 0.004 1.00 0.18
GLY125 HA3 0.60 0.004 1.00 0.18

Detailed Probabilities of ALA(124)-H:

Overall probability: 0.837
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
LYS123 0.67 1.00
ALA124 1.00 1.00
GLY125 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
K123H 1.00
K123HG3 0.96
K123HB3 1.00
K123HB2 1.00
K123HG2 0.98
K123HA 1.00
A124HA 1.00
A124HB1 1.00
A124H 1.00
G125H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
LYS123 HA 1.00 0.005 1.00 0.37
LYS123 HB2 1.00 0.008 1.00 0.34
LYS123 HB3 1.00 0.008 1.00 0.34
LYS123 HG2 0.98 0.007 1.00 0.06
LYS123 HG3 0.96 0.194 0.04 0.00
LYS123 H 1.00 0.218 0.00 0.00
ALA124 HA 1.00 0.007 1.00 0.55
ALA124 HB1 1.00 0.006 1.00 1.39
ALA124 H 1.00 0.004 1.00 -6488405.00
GLY125 H 1.00 0.006 1.00 -498794.00
GLY125 HA2 0.71 0.006 1.00 0.07
GLY125 HA3 0.75 0.006 1.00 0.07