ARECA's report on SER126

Residue probability: 0.959
Residue probability confidence: 0.865

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 175.504 174.682 1.868 0.000 0.000
CA 59.965 58.750 3.025 0.838 0.889
CB 63.460 63.523 4.288 1.000 0.833
N 116.080 116.135 5.326 1.000 0.889
HA 4.447 4.486 0.430 0.875 0.889
HB2 4.023 3.856 0.325 1.000 0.833
HB3 4.030 3.825 0.343 1.000 0.833
H 7.861 8.292 0.600 1.000 0.889
HG NA -- -- 0.000 0.000

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Detailed Probabilities of SER(126)-CA:

Overall probability: 0.838
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLY125 0.85 1.00
SER126 1.00 0.80
LEU127 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
G125HA3 1.00
G125HA2 1.00
S126HB2 1.00
S126HB3 1.00
S126H 1.00
S126HG 1.00
S126HA 1.00
L127H 1.00
L127HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLY125 HA2 1.00 0.022 1.00 0.35
GLY125 HA3 1.00 0.033 0.70 0.00
SER126 HA 1.00 0.000 1.00 1.80
SER126 HB2 1.00 0.000 1.00 0.35
SER126 HB3 1.00 0.000 1.00 0.35
SER126 H 1.00 0.000 1.00 0.10
LEU127 HA 1.00 0.165 0.00 0.00
LEU127 H 1.00 0.000 1.00 0.10

Detailed Probabilities of SER(126)-CB:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
SER126 1.00 0.80
LEU127 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
S126HA 1.00
S126HB3 1.00
S126H 1.00
S126HG 1.00
S126HB2 1.00
L127H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
SER126 HA 1.00 0.000 1.00 0.39
SER126 HB2 1.00 0.000 1.00 5.71
SER126 HB3 1.00 0.000 1.00 5.71
SER126 H 1.00 0.000 1.00 0.19
LEU127 H 1.00 0.000 1.00 0.18

Detailed Probabilities of SER(126)-N:

Overall probability: 1.000
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLY125 1.00 1.00
SER126 1.00 0.80
LEU127 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
G125HA3 1.00
G125H 1.00
G125HA2 1.00
S126HA 1.00
S126HB2 1.00
S126HB3 1.00
S126HG 1.00
S126H 1.00
L127H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLY125 HA2 1.00 0.000 1.00 -8964.00
GLY125 HA3 1.00 0.000 1.00 -8964.00
GLY125 H 1.00 0.000 1.00 -2552.00
SER126 HA 1.00 0.000 1.00 -4457.00
SER126 HB2 1.00 0.000 1.00 -12870.00
SER126 HB3 1.00 0.000 1.00 -12870.00
SER126 H 1.00 0.000 1.00 -39740.00
LEU127 H 1.00 0.000 1.00 -29180.00
LEU127 HB2 0.57 0.027 1.00 -461.00

Detailed Probabilities of SER(126)-HA:

Overall probability: 0.875
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLY125 1.00 1.00
SER126 1.00 0.80
LEU127 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
G125HA3 1.00
G125HA2 1.00
S126HB2 1.00
S126HB3 1.00
S126H 1.00
S126HG 1.00
S126HA 1.00
L127H 1.00
L127HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLY125 HA2 1.00 0.015 1.00 0.01
GLY125 HA3 1.00 0.015 1.00 0.01
SER126 HA 1.00 0.000 1.00 1.80
SER126 HB2 1.00 0.000 1.00 0.39
SER126 HB3 1.00 0.000 1.00 0.39
SER126 H 1.00 0.000 1.00 -4457.00
LEU127 HA 1.00 0.165 0.00 0.00
LEU127 H 1.00 0.000 1.00 -2283.00

Detailed Probabilities of SER(126)-HB2:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
SER126 1.00 0.80
LEU127 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
S126HA 1.00
S126HB3 1.00
S126H 1.00
S126HG 1.00
S126HB2 1.00
L127H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
SER126 HA 1.00 0.000 1.00 0.35
SER126 HB2 1.00 0.000 1.00 5.71
SER126 HB3 1.00 0.000 1.00 5.71
SER126 H 1.00 0.000 1.00 -12870.00
LEU127 H 1.00 0.000 1.00 -3709.00
LEU127 HA 0.68 0.002 1.00 0.01

Detailed Probabilities of SER(126)-HB3:

Overall probability: 1.000
Overall confidence: 0.833

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
SER126 1.00 0.80
LEU127 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
S126HA 1.00
S126HB2 1.00
S126H 1.00
S126HG 1.00
S126HB3 1.00
L127H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
SER126 HA 1.00 0.000 1.00 0.35
SER126 HB2 1.00 0.000 1.00 5.71
SER126 HB3 1.00 0.000 1.00 5.71
SER126 H 1.00 0.000 1.00 -12870.00
LEU127 H 1.00 0.000 1.00 -3709.00
LEU127 HA 0.76 0.005 1.00 0.01

Detailed Probabilities of SER(126)-H:

Overall probability: 1.000
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLY125 1.00 1.00
SER126 1.00 0.80
LEU127 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
G125HA3 1.00
G125H 1.00
G125HA2 1.00
S126HA 1.00
S126HB2 1.00
S126HB3 1.00
S126HG 1.00
S126H 1.00
L127H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLY125 HA2 1.00 0.000 1.00 0.05
GLY125 HA3 1.00 0.000 1.00 0.05
GLY125 H 1.00 0.000 1.00 -2283.00
SER126 HA 1.00 0.000 1.00 0.10
SER126 HB2 1.00 0.000 1.00 0.19
SER126 HB3 1.00 0.000 1.00 0.19
SER126 H 1.00 0.000 1.00 -39740.00
LEU127 H 1.00 0.000 1.00 -34180.00
LEU127 HA 0.88 0.021 1.00 0.08
LEU127 HB2 0.57 0.021 1.00 0.08