ARECA's report on SER49

Residue probability: 0.852
Residue probability confidence: 0.885

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C NA -- -- 0.000 0.000
CA 53.401 58.750 3.025 1.000 0.889
CB 65.466 63.523 4.288 0.836 0.857
N 111.050 116.135 5.326 0.929 0.923
HA 5.524 4.486 0.430 0.909 0.889
HB2 3.230 3.856 0.325 0.510 0.857
HB3 3.823 3.825 0.343 0.857 0.857
H 7.711 8.292 0.600 0.920 0.923
HG NA -- -- 0.000 0.000

[Back]

Detailed Probabilities of SER(49)-CA:

Overall probability: 1.000
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG48 1.00 1.00
SER49 1.00 0.80
PRO50 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
R48HA 1.00
S49HB2 1.00
S49HB3 1.00
S49H 1.00
S49HG 1.00
S49HA 1.00
P50HA 1.00
P50HD3 1.00
P50HD2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG48 HA 1.00 0.014 1.00 0.05
ARG48 H 0.87 0.026 1.00 0.14
SER49 HA 1.00 0.012 1.00 3.13
SER49 HB2 1.00 0.015 1.00 0.46
SER49 HB3 1.00 0.026 1.00 0.70
SER49 H 1.00 0.007 1.00 0.15
PRO50 HA 1.00 0.008 1.00 0.05
PRO50 HD2 1.00 0.009 1.00 0.53
PRO50 HD3 1.00 0.014 1.00 0.70
PRO50 HG2 0.94 0.002 1.00 0.10
PRO50 HG3 0.89 0.019 1.00 0.12

Detailed Probabilities of SER(49)-CB:

Overall probability: 0.836
Overall confidence: 0.857

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
SER49 1.00 0.80
PRO50 0.51 1.00

Expected NOESY Contacts
Proton Expected probability
S49HA 1.00
S49HB2 1.00
S49H 1.00
S49HG 1.00
S49HB3 1.00
P50HD3 0.99
P50HD2 0.97


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
SER49 HA 1.00 0.004 1.00 0.34
SER49 HB2 1.00 0.002 1.00 1.09
SER49 HB3 1.00 0.017 1.00 26.96
SER49 H 1.00 0.000 1.00 0.22
PRO50 HD2 0.97 0.009 1.00 0.14
PRO50 HD3 0.99 0.057 0.01 0.00

Detailed Probabilities of SER(49)-N:

Overall probability: 0.929
Overall confidence: 0.923

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG48 0.91 1.00
SER49 1.00 0.80
PRO50 0.87 1.00

Expected NOESY Contacts
Proton Expected probability
R48HB3 1.00
R48HB2 1.00
R48HA 1.00
R48HG3 0.96
R48HG2 0.97
R48H 1.00
S49HA 1.00
S49HB2 1.00
S49HB3 1.00
S49HG 1.00
S49H 1.00
P50HD3 0.96
P50HD2 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG48 HA 1.00 0.004 1.00 -823461.00
ARG48 HB2 1.00 0.006 1.00 -281691.00
ARG48 HB3 1.00 0.009 1.00 -230656.00
ARG48 HG2 0.97 0.036 0.40 0.00
ARG48 HG3 0.96 0.020 1.00 -105114.00
ARG48 H 1.00 0.002 1.00 -941762.00
ARG48 HD2 0.55 0.001 1.00 -241980.00
SER49 HA 1.00 0.003 1.00 -662645.00
SER49 HB2 1.00 0.006 1.00 -1064123.00
SER49 HB3 1.00 0.006 1.00 -832016.00
SER49 H 1.00 0.004 1.00 -16088325.00
PRO50 HD2 0.98 0.013 1.00 -204631.00
PRO50 HD3 0.96 0.034 0.60 0.00
PRO50 HA 0.65 0.018 1.00 -823461.00

Detailed Probabilities of SER(49)-HA:

Overall probability: 0.909
Overall confidence: 0.889

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG48 1.00 1.00
SER49 1.00 0.80
PRO50 0.83 1.00

Expected NOESY Contacts
Proton Expected probability
R48HA 1.00
S49HB2 1.00
S49HB3 1.00
S49H 1.00
S49HG 1.00
S49HA 1.00
P50HA 1.00
P50HD3 1.00
P50HD2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG48 HA 1.00 0.013 1.00 0.06
SER49 HA 1.00 0.012 1.00 3.13
SER49 HB2 1.00 0.003 1.00 0.20
SER49 HB3 1.00 0.004 1.00 0.34
SER49 H 1.00 0.003 1.00 -662645.00
PRO50 HA 1.00 0.340 0.00 0.00
PRO50 HD2 1.00 0.003 1.00 0.56
PRO50 HD3 1.00 0.003 1.00 0.62
PRO50 HB3 0.78 0.013 1.00 0.06
PRO50 HG2 0.94 0.000 1.00 0.16
PRO50 HG3 0.89 0.003 1.00 0.14

Detailed Probabilities of SER(49)-HB2:

Overall probability: 0.510
Overall confidence: 0.857

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
SER49 0.75 0.80
PRO50 0.03 1.00

Expected NOESY Contacts
Proton Expected probability
S49HA 1.00
S49HB3 1.00
S49H 1.00
S49HG 1.00
S49HB2 1.00
P50HD3 0.98
P50HD2 0.96


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
SER49 HA 1.00 0.015 1.00 0.46
SER49 HB2 1.00 0.591 0.00 0.00
SER49 HB3 1.00 0.002 1.00 1.09
SER49 H 1.00 0.006 1.00 -1064123.00
PRO50 HD2 0.96 0.319 0.04 0.00
PRO50 HD3 0.98 0.388 0.02 0.00

Detailed Probabilities of SER(49)-HB3:

Overall probability: 0.857
Overall confidence: 0.857

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
SER49 1.00 0.80
PRO50 0.67 1.00

Expected NOESY Contacts
Proton Expected probability
S49HA 1.00
S49HB2 1.00
S49H 1.00
S49HG 1.00
S49HB3 1.00
P50HD3 0.99
P50HD2 0.97


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
SER49 HA 1.00 0.026 1.00 0.70
SER49 HB2 1.00 0.002 1.00 1.04
SER49 HB3 1.00 0.017 1.00 26.96
SER49 H 1.00 0.006 1.00 -832016.00
PRO50 HD2 0.97 0.036 0.40 0.00
PRO50 HD3 0.99 0.034 0.60 0.00
PRO50 HA 0.72 0.023 1.00 0.23

Detailed Probabilities of SER(49)-H:

Overall probability: 0.920
Overall confidence: 0.923

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG48 0.84 1.00
SER49 1.00 0.80
PRO50 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
R48HB3 1.00
R48HB2 1.00
R48HA 1.00
R48HG3 0.96
R48HG2 0.97
R48H 1.00
S49HA 1.00
S49HB2 1.00
S49HB3 1.00
S49HG 1.00
S49H 1.00
P50HD3 0.96
P50HD2 0.98


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG48 HA 1.00 0.008 1.00 0.29
ARG48 HB2 1.00 0.011 1.00 0.14
ARG48 HB3 1.00 0.010 1.00 0.12
ARG48 HG2 0.97 0.016 1.00 0.07
ARG48 HG3 0.96 0.364 0.04 0.00
ARG48 H 1.00 0.004 1.00 -970521.00
SER49 HA 1.00 0.007 1.00 0.15
SER49 HB2 1.00 0.002 1.00 0.20
SER49 HB3 1.00 0.000 1.00 0.22
SER49 H 1.00 0.004 1.00 -16088325.00
PRO50 HD2 0.98 0.011 1.00 0.07
PRO50 HD3 0.96 0.011 1.00 0.06