ARECA's report on VAL22

Residue probability: 0.880
Residue probability confidence: 1.000

Chemical Shift Distributions and Assignment Probabilities
Atom Assigned CS DB avg. DB std Overall probability Overall confidence
C NA -- -- 0.000 0.000
CA 62.799 62.613 4.828 0.857 1.000
CB 29.829 32.918 4.591 1.000 1.000
CG1 20.110 21.563 2.746 1.000 1.000
CG2 19.942 21.368 2.801 1.000 1.000
N 109.032 121.057 5.832 0.369 1.000
HA 4.132 4.178 0.599 0.778 1.000
HB 1.984 1.980 0.322 0.800 1.000
HG1 0.638 0.816 0.264 1.000 1.000
HG2 0.854 0.803 0.504 1.000 1.000
H 8.037 8.311 0.669 1.000 1.000

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Detailed Probabilities of VAL(22)-CA:

Overall probability: 0.857
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU21 0.50 1.00
VAL22 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E21HA 1.00
V22HG11 1.00
V22HG21 1.00
V22H 1.00
V22HB 1.00
V22HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU21 HA 1.00 0.092 0.00 0.00
GLU21 HB3 0.84 0.011 1.00 0.16
VAL22 HA 1.00 0.000 1.00 2.03
VAL22 HB 1.00 0.000 1.00 0.16
VAL22 HG11 1.00 0.000 1.00 0.20
VAL22 HG21 1.00 0.000 1.00 0.08
VAL22 H 1.00 0.014 1.00 0.14

Detailed Probabilities of VAL(22)-CB:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL22 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V22HA 1.00
V22HG11 1.00
V22HG21 1.00
V22H 1.00
V22HB 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL22 HA 1.00 0.000 1.00 0.17
VAL22 HB 1.00 0.000 1.00 1.84
VAL22 HG11 1.00 0.000 1.00 0.13
VAL22 HG21 1.00 0.000 1.00 0.11
VAL22 H 1.00 0.011 1.00 0.04

Detailed Probabilities of VAL(22)-CG1:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL22 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V22HA 1.00
V22HG12 1.00
V22HG21 1.00
V22H 1.00
V22HB 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL22 HA 1.00 0.000 1.00 0.15
VAL22 HB 1.00 0.000 1.00 0.25
VAL22 HG11 1.00 0.000 1.00 5.03
VAL22 HG21 1.00 0.000 1.00 0.44
VAL22 H 1.00 0.000 1.00 0.07

Detailed Probabilities of VAL(22)-CG2:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL22 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V22HA 1.00
V22HG11 1.00
V22HG22 1.00
V22H 1.00
V22HB 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL22 HA 1.00 0.000 1.00 0.05
VAL22 HB 1.00 0.000 1.00 0.22
VAL22 HG11 1.00 0.000 1.00 0.41
VAL22 HG21 1.00 0.000 1.00 5.74
VAL22 H 1.00 0.001 1.00 0.08

Detailed Probabilities of VAL(22)-N:

Overall probability: 0.369
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU21 0.18 1.00
VAL22 0.60 1.00

Expected NOESY Contacts
Proton Expected probability
E21HG2 0.98
E21HA 1.00
E21HB2 1.00
E21HG3 0.96
E21HB3 1.00
E21H 1.00
V22HA 1.00
V22HG11 1.00
V22HG21 1.00
V22HB 1.00
V22H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU21 HA 1.00 3.103 0.00 0.00
GLU21 HB2 1.00 1.256 0.00 0.00
GLU21 HB3 1.00 1.113 0.00 0.00
GLU21 HG2 0.98 1.246 0.02 0.00
GLU21 HG3 0.96 1.244 0.04 0.00
GLU21 H 1.00 0.017 1.00 -107.00
VAL22 HA 1.00 3.272 0.00 0.00
VAL22 HB 1.00 1.124 0.00 0.00
VAL22 HG11 1.00 0.009 1.00 -406.00
VAL22 HG21 1.00 0.006 1.00 -162.00
VAL22 H 1.00 0.000 1.00 -1030.00

Detailed Probabilities of VAL(22)-HA:

Overall probability: 0.778
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU21 0.75 1.00
VAL22 0.80 1.00

Expected NOESY Contacts
Proton Expected probability
E21HA 1.00
V22HG11 1.00
V22HG21 1.00
V22H 1.00
V22HB 1.00
V22HA 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU21 HA 1.00 0.169 0.00 0.00
GLU21 HB2 0.63 0.002 1.00 0.15
GLU21 HB3 0.84 0.000 1.00 0.17
GLU21 H 0.91 0.016 1.00 -2046.00
VAL22 HA 1.00 0.000 1.00 2.03
VAL22 HB 1.00 0.000 1.00 0.17
VAL22 HG11 1.00 0.000 1.00 0.15
VAL22 HG21 1.00 0.000 1.00 0.05
VAL22 H 1.00 3.272 0.00 0.00

Detailed Probabilities of VAL(22)-HB:

Overall probability: 0.800
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL22 0.80 1.00

Expected NOESY Contacts
Proton Expected probability
V22HA 1.00
V22HG11 1.00
V22HG21 1.00
V22H 1.00
V22HB 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL22 HA 1.00 0.000 1.00 0.16
VAL22 HB 1.00 0.000 1.00 1.84
VAL22 HG11 1.00 0.000 1.00 0.25
VAL22 HG21 1.00 0.000 1.00 0.22
VAL22 H 1.00 1.124 0.00 0.00

Detailed Probabilities of VAL(22)-HG11:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL22 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V22HA 1.00
V22HG12 1.00
V22HG21 1.00
V22H 1.00
V22HB 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL22 HA 1.00 0.000 1.00 0.20
VAL22 HB 1.00 0.000 1.00 0.13
VAL22 HG11 1.00 0.000 1.00 5.03
VAL22 HG21 1.00 0.000 1.00 0.41
VAL22 H 1.00 0.009 1.00 -406.00

Detailed Probabilities of VAL(22)-HG21:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
VAL22 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
V22HA 1.00
V22HG11 1.00
V22HG22 1.00
V22H 1.00
V22HB 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
VAL22 HA 1.00 0.000 1.00 0.08
VAL22 HB 1.00 0.000 1.00 0.11
VAL22 HG11 1.00 0.000 1.00 0.44
VAL22 HG21 1.00 0.000 1.00 5.74
VAL22 H 1.00 0.006 1.00 -162.00

Detailed Probabilities of VAL(22)-H:

Overall probability: 1.000
Overall confidence: 1.000

Calculated probabilities for inter- and intra-residue contacts
Residue Probability Confidence
GLU21 1.00 1.00
VAL22 1.00 1.00

Expected NOESY Contacts
Proton Expected probability
E21HG2 0.98
E21HA 1.00
E21HB2 1.00
E21HG3 0.96
E21HB3 1.00
E21H 1.00
V22HA 1.00
V22HG11 1.00
V22HG21 1.00
V22HB 1.00
V22H 1.00


NOESY contacts detailed probability
Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio
GLU21 HA 1.00 0.008 1.00 0.03
GLU21 HB2 1.00 0.002 1.00 0.13
GLU21 HB3 1.00 0.011 1.00 0.04
GLU21 HG2 0.98 0.007 1.00 0.04
GLU21 HG3 0.96 0.007 1.00 0.04
GLU21 H 1.00 0.000 1.00 -1184.00
VAL22 HA 1.00 0.014 1.00 0.14
VAL22 HB 1.00 0.011 1.00 0.04
VAL22 HG11 1.00 0.000 1.00 0.07
VAL22 HG21 1.00 0.001 1.00 0.08
VAL22 H 1.00 0.000 1.00 -1030.00