ARECA's report on ARG105

Residue probability: 0.440
Residue probability confidence: 0.911

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C 173.917 176.453 2.303 0.000 0.000
CA 52.465 56.803 3.326 0.169 1.000
CB 32.955 30.892 2.424 0.500 1.000
CG 26.576 27.247 1.538 0.444 0.900
CD 41.442 43.189 1.415 0.789 0.800
N 124.856 120.701 3.779 0.725 1.000
NE 82.387 89.115 13.484 0.000 0.778
NH1 NA -- -- 0.000 0.000
NH2 NA -- -- 0.000 0.000
HA 4.915 4.301 0.495 0.750 1.000
HB2 1.857 1.793 0.292 0.000 1.000
HB3 1.816 1.757 0.307 0.233 1.000
HG2 1.805 1.559 0.294 0.337 0.909
HG3 1.752 1.535 0.310 0.150 0.900
HD2 3.515 3.105 0.301 0.717 0.800
HD3 3.339 3.081 0.306 0.714 0.800
H 8.705 8.248 0.623 0.736 1.000
HE 7.599 7.398 0.718 0.333 0.778
HH1 NA -- -- 0.000 0.000
HH2 NA -- -- 0.000 0.000

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Detailed Probabilities of ARG(105)-CA:

Overall probability: 0.169
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL104 0.50 1.00
ARG105 0.13 1.00
LYS106 0.00 1.00

Expected NOESY Contacts
Proton Expected probability
V104HA 1.00
R105HB2 1.00
R105HB3 1.00
R105HG2 1.00
R105HG3 1.00
R105HD2 0.98
R105HD3 0.97
R105H 1.00
R105HA 1.00
K106HA 1.00
K106H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL104 HA 1.00 0.199 0.00 0.00
VAL104 HG11 0.57 0.025 1.00 0.42
ARG105 HA 1.00 0.114 0.00 0.00
ARG105 HB2 1.00 0.198 0.00 0.00
ARG105 HB3 1.00 0.239 0.00 0.00
ARG105 HG2 1.00 0.250 0.00 0.00
ARG105 HG3 1.00 0.303 0.00 0.00
ARG105 HD2 0.98 0.181 0.02 0.00
ARG105 HD3 0.97 0.005 1.00 0.52
ARG105 H 1.00 0.371 0.00 0.00
LYS106 HA 1.00 0.142 0.00 0.00
LYS106 H 1.00 0.377 0.00 0.00

Detailed Probabilities of ARG(105)-CB:

Overall probability: 0.500
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG105 0.44 1.00
LYS106 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
R105HA 1.00
R105HB3 1.00
R105HG2 1.00
R105HG3 1.00
R105HD2 1.00
R105HD3 1.00
R105H 1.00
R105HE 1.00
R105HB2 1.00
K106H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG105 HA 1.00 0.006 1.00 0.13
ARG105 HB2 1.00 1.474 0.00 0.00
ARG105 HB3 1.00 1.515 0.00 0.00
ARG105 HG2 1.00 1.526 0.00 0.00
ARG105 HG3 1.00 1.579 0.00 0.00
ARG105 HD2 1.00 0.006 1.00 0.06
ARG105 HD3 1.00 0.008 1.00 0.07
ARG105 H 1.00 0.006 1.00 0.09
ARG105 HE 1.00 0.480 0.00 0.00
LYS106 H 1.00 0.004 1.00 0.15

Detailed Probabilities of ARG(105)-CG:

Overall probability: 0.444
Overall confidence: 0.900

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG105 0.44 0.90

Expected NOESY Contacts
Proton Expected probability
R105HA 1.00
R105HB2 1.00
R105HB3 1.00
R105HG2 1.00
R105HD2 1.00
R105HD3 1.00
R105H 1.00
R105HE 1.00
R105HH11 1.00
R105HG3 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG105 HA 1.00 0.008 1.00 0.11
ARG105 HB2 1.00 0.540 0.00 0.00
ARG105 HB3 1.00 0.499 0.00 0.00
ARG105 HG2 1.00 0.488 0.00 0.00
ARG105 HG3 1.00 0.435 0.00 0.00
ARG105 HD2 1.00 0.003 1.00 0.22
ARG105 HD3 1.00 0.007 1.00 0.17
ARG105 H 1.00 0.004 1.00 0.07
ARG105 HE 1.00 0.471 0.00 0.00

Detailed Probabilities of ARG(105)-CD:

Overall probability: 0.789
Overall confidence: 0.800

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG105 0.79 0.80

Expected NOESY Contacts
Proton Expected probability
R105HA 0.98
R105HB2 1.00
R105HB3 1.00
R105HG2 1.00
R105HG3 1.00
R105HD3 1.00
R105HE 1.00
R105HH11 1.00
R105HH21 1.00
R105HD2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG105 HA 0.98 0.003 1.00 0.47
ARG105 HB2 1.00 0.080 0.00 0.00
ARG105 HB3 1.00 0.039 0.10 0.00
ARG105 HG2 1.00 0.028 1.00 0.61
ARG105 HG3 1.00 0.025 1.00 0.61
ARG105 HD2 1.00 0.002 1.00 3.12
ARG105 HD3 1.00 0.005 1.00 2.29
ARG105 HE 1.00 0.012 1.00 0.15
ARG105 H 0.87 0.000 1.00 0.07

Detailed Probabilities of ARG(105)-N:

Overall probability: 0.725
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL104 0.80 1.00
ARG105 0.70 1.00
LYS106 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
V104HG11 0.98
V104H 1.00
V104HB 1.00
V104HA 1.00
R105HA 1.00
R105HB2 1.00
R105HB3 1.00
R105HG2 1.00
R105HG3 1.00
R105H 1.00
K106H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL104 HA 1.00 0.009 1.00 -1752962.00
VAL104 HB 1.00 0.003 1.00 -249656.00
VAL104 HG11 0.98 0.028 1.00 -885981.00
VAL104 H 1.00 0.051 0.00 0.00
VAL104 HG21 0.94 0.017 1.00 -885981.00
ARG105 HA 1.00 0.003 1.00 -249172.00
ARG105 HB2 1.00 0.067 0.00 0.00
ARG105 HB3 1.00 0.026 1.00 -545563.00
ARG105 HG2 1.00 0.015 1.00 -545563.00
ARG105 HG3 1.00 0.038 0.20 0.00
ARG105 H 1.00 0.003 1.00 -4371539.00
LYS106 H 1.00 0.035 0.50 0.00

Detailed Probabilities of ARG(105)-NE:

Overall probability: 0.000
Overall confidence: 0.778

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG105 0.00 0.78

Expected NOESY Contacts
Proton Expected probability
R105HB2 1.00
R105HB3 1.00
R105HG2 1.00
R105HG3 1.00
R105HD2 1.00
R105HD3 1.00
R105HH11 1.00
R105HH21 1.00
R105HE 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio

Detailed Probabilities of ARG(105)-HA:

Overall probability: 0.750
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL104 1.00 1.00
ARG105 0.75 1.00
LYS106 0.50 1.00

Expected NOESY Contacts
Proton Expected probability
V104HA 1.00
R105HB2 1.00
R105HB3 1.00
R105HG2 1.00
R105HG3 1.00
R105HD2 0.98
R105HD3 0.97
R105H 1.00
R105HA 1.00
K106HA 1.00
K106H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL104 HA 1.00 0.004 1.00 0.05
VAL104 HG11 0.57 0.011 1.00 0.13
ARG105 HA 1.00 0.114 0.00 0.00
ARG105 HB2 1.00 0.006 1.00 0.13
ARG105 HB3 1.00 0.005 1.00 0.14
ARG105 HG2 1.00 1.400 0.00 0.00
ARG105 HG3 1.00 0.008 1.00 0.11
ARG105 HD2 0.98 0.003 1.00 0.47
ARG105 HD3 0.97 0.003 1.00 0.60
ARG105 H 1.00 0.003 1.00 -249172.00
LYS106 HA 1.00 0.279 0.00 0.00
LYS106 H 1.00 0.003 1.00 -1553448.00

Detailed Probabilities of ARG(105)-HB2:

Overall probability: 0.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG105 0.00 1.00
LYS106 0.00 1.00

Expected NOESY Contacts
Proton Expected probability
R105HA 1.00
R105HB3 1.00
R105HG2 1.00
R105HG3 1.00
R105HD2 1.00
R105HD3 1.00
R105H 1.00
R105HE 1.00
R105HB2 1.00
K106H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG105 HA 1.00 0.198 0.00 0.00
ARG105 HB2 1.00 1.474 0.00 0.00
ARG105 HB3 1.00 1.066 0.00 0.00
ARG105 HG2 1.00 1.472 0.00 0.00
ARG105 HG3 1.00 0.540 0.00 0.00
ARG105 HD2 1.00 0.080 0.00 0.00
ARG105 HD3 1.00 0.058 0.00 0.00
ARG105 H 1.00 0.067 0.00 0.00
LYS106 H 1.00 0.145 0.00 0.00

Detailed Probabilities of ARG(105)-HB3:

Overall probability: 0.233
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG105 0.26 1.00
LYS106 0.00 1.00

Expected NOESY Contacts
Proton Expected probability
R105HA 1.00
R105HB2 1.00
R105HG2 1.00
R105HG3 1.00
R105HD2 1.00
R105HD3 1.00
R105H 1.00
R105HE 1.00
R105HB3 1.00
K106H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG105 HA 1.00 0.239 0.00 0.00
ARG105 HB2 1.00 1.515 0.00 0.00
ARG105 HB3 1.00 1.025 0.00 0.00
ARG105 HG2 1.00 1.513 0.00 0.00
ARG105 HG3 1.00 0.499 0.00 0.00
ARG105 HD2 1.00 0.039 0.10 0.00
ARG105 HD3 1.00 0.017 1.00 0.60
ARG105 H 1.00 0.026 1.00 -545563.00
LYS106 H 1.00 0.104 0.00 0.00

Detailed Probabilities of ARG(105)-HG2:

Overall probability: 0.337
Overall confidence: 0.909

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG105 0.38 0.90
LYS106 0.03 1.00

Expected NOESY Contacts
Proton Expected probability
R105HA 1.00
R105HB2 1.00
R105HB3 1.00
R105HG3 1.00
R105HD2 1.00
R105HD3 1.00
R105H 1.00
R105HE 1.00
R105HH11 1.00
R105HG2 1.00
K106H 0.97


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG105 HA 1.00 0.250 0.00 0.00
ARG105 HB2 1.00 1.526 0.00 0.00
ARG105 HB3 1.00 1.014 0.00 0.00
ARG105 HG2 1.00 1.524 0.00 0.00
ARG105 HG3 1.00 0.488 0.00 0.00
ARG105 HD2 1.00 0.028 1.00 0.61
ARG105 HD3 1.00 0.006 1.00 0.60
ARG105 H 1.00 0.015 1.00 -545563.00
LYS106 H 0.97 0.093 0.03 0.00

Detailed Probabilities of ARG(105)-HG3:

Overall probability: 0.150
Overall confidence: 0.900

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG105 0.15 0.90

Expected NOESY Contacts
Proton Expected probability
R105HA 1.00
R105HB2 1.00
R105HB3 1.00
R105HG2 1.00
R105HD2 1.00
R105HD3 1.00
R105H 1.00
R105HE 1.00
R105HH11 1.00
R105HG3 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG105 HA 1.00 0.303 0.00 0.00
ARG105 HB2 1.00 1.579 0.00 0.00
ARG105 HB3 1.00 0.961 0.00 0.00
ARG105 HG2 1.00 1.577 0.00 0.00
ARG105 HG3 1.00 0.435 0.00 0.00
ARG105 HD2 1.00 0.025 1.00 0.61
ARG105 HD3 1.00 0.047 0.00 0.00
ARG105 H 1.00 0.038 0.20 0.00

Detailed Probabilities of ARG(105)-HD2:

Overall probability: 0.717
Overall confidence: 0.800

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG105 0.72 0.80

Expected NOESY Contacts
Proton Expected probability
R105HA 0.98
R105HB2 1.00
R105HB3 1.00
R105HG2 1.00
R105HG3 1.00
R105HD3 1.00
R105HE 1.00
R105HH11 1.00
R105HH21 1.00
R105HD2 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG105 HA 0.98 0.181 0.02 0.00
ARG105 HB2 1.00 0.006 1.00 0.06
ARG105 HB3 1.00 0.722 0.00 0.00
ARG105 HG2 1.00 0.000 1.00 0.22
ARG105 HG3 1.00 0.003 1.00 0.22
ARG105 HD2 1.00 0.002 1.00 3.12
ARG105 HD3 1.00 0.001 1.00 2.30

Detailed Probabilities of ARG(105)-HD3:

Overall probability: 0.714
Overall confidence: 0.800

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG105 0.71 0.80

Expected NOESY Contacts
Proton Expected probability
R105HA 0.97
R105HB2 1.00
R105HB3 1.00
R105HG2 1.00
R105HG3 1.00
R105HD2 1.00
R105HE 1.00
R105HH11 1.00
R105HH21 1.00
R105HD3 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG105 HA 0.97 0.005 1.00 0.52
ARG105 HB2 1.00 0.008 1.00 0.07
ARG105 HB3 1.00 0.898 0.00 0.00
ARG105 HG2 1.00 0.010 1.00 0.21
ARG105 HG3 1.00 0.007 1.00 0.17
ARG105 HD2 1.00 0.005 1.00 2.29
ARG105 HD3 1.00 0.177 0.00 0.00

Detailed Probabilities of ARG(105)-H:

Overall probability: 0.736
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL104 0.46 1.00
ARG105 0.88 1.00
LYS106 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V104HG11 0.98
V104H 1.00
V104HB 1.00
V104HA 1.00
R105HA 1.00
R105HB2 1.00
R105HB3 1.00
R105HG2 1.00
R105HG3 1.00
R105H 1.00
K106H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL104 HA 1.00 0.007 1.00 1.05
VAL104 HB 1.00 0.045 0.00 0.00
VAL104 HG11 0.98 0.037 0.30 0.00
VAL104 H 1.00 0.051 0.00 0.00
VAL104 HG21 0.94 0.028 1.00 0.77
ARG105 HA 1.00 0.371 0.00 0.00
ARG105 HB2 1.00 0.006 1.00 0.09
ARG105 HB3 1.00 0.003 1.00 0.08
ARG105 HG2 1.00 0.012 1.00 0.06
ARG105 HG3 1.00 0.004 1.00 0.07
ARG105 H 1.00 0.003 1.00 -4371539.00
ARG105 HD2 0.87 0.000 1.00 0.07
ARG105 HD3 0.86 0.001 1.00 0.08
LYS106 H 1.00 0.016 1.00 -107133.00

Detailed Probabilities of ARG(105)-HE:

Overall probability: 0.333
Overall confidence: 0.778

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
ARG105 0.33 0.78

Expected NOESY Contacts
Proton Expected probability
R105HB2 1.00
R105HB3 1.00
R105HG2 1.00
R105HG3 1.00
R105HD2 1.00
R105HD3 1.00
R105HH11 1.00
R105HH21 1.00
R105HE 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
ARG105 HB2 1.00 0.480 0.00 0.00
ARG105 HB3 1.00 0.453 0.00 0.00
ARG105 HG2 1.00 0.459 0.00 0.00
ARG105 HG3 1.00 0.471 0.00 0.00
ARG105 HD2 1.00 0.012 1.00 0.15
ARG105 HD3 1.00 0.012 1.00 0.13