Overall probability: 0.846 Overall confidence: 1.000 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence SER72 0.00 1.00 LYS73 1.00 1.00 LEU74 0.50 1.00 Expected NOESY Contacts Proton Expected probability S72HA 1.00 K73HB2 1.00 K73HB3 1.00 K73HG2 1.00 K73HG3 1.00 K73HD2 0.98 K73HD3 0.98 K73H 1.00 K73HA 1.00 L74HA 1.00 L74H 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio SER72 HA 1.00 0.083 0.00 0.00 LYS73 HA 1.00 0.009 1.00 12.17 LYS73 HB2 1.00 0.024 1.00 2.01 LYS73 HB3 1.00 0.025 1.00 2.01 LYS73 HG2 1.00 0.017 1.00 0.46 LYS73 HG3 1.00 0.010 1.00 0.74 LYS73 HD2 0.98 0.002 1.00 0.52 LYS73 HD3 0.98 0.003 1.00 0.52 LYS73 H 1.00 0.001 1.00 0.66 LYS73 HE2 0.77 0.009 1.00 0.06 LYS73 HE3 0.76 0.014 1.00 0.06 LEU74 HA 1.00 0.055 0.00 0.00 LEU74 H 1.00 0.006 1.00 0.38
Overall probability: 0.802 Overall confidence: 1.000 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence LYS73 0.78 1.00 LEU74 1.00 1.00 Expected NOESY Contacts Proton Expected probability K73HA 1.00 K73HB3 1.00 K73HG2 1.00 K73HG3 1.00 K73HD2 1.00 K73HD3 1.00 K73HE2 0.98 K73HE3 0.99 K73H 1.00 K73HB2 1.00 L74H 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio LYS73 HA 1.00 0.015 1.00 1.59 LYS73 HB2 1.00 0.009 1.00 53.87 LYS73 HB3 1.00 0.010 1.00 53.87 LYS73 HG2 1.00 0.014 1.00 3.20 LYS73 HG3 1.00 0.005 1.00 3.41 LYS73 HD2 1.00 0.001 1.00 5.56 LYS73 HD3 1.00 0.000 1.00 5.56 LYS73 HE2 0.98 0.053 0.02 0.00 LYS73 HE3 0.99 0.048 0.01 0.00 LYS73 H 1.00 0.032 0.80 0.00 LEU74 H 1.00 0.006 1.00 2.14
Overall probability: 0.980 Overall confidence: 0.909 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence LYS73 0.98 0.91 Expected NOESY Contacts Proton Expected probability K73HA 1.00 K73HB2 1.00 K73HB3 1.00 K73HG2 1.00 K73HD2 1.00 K73HD3 1.00 K73HE2 1.00 K73HE3 1.00 K73H 1.00 K73HZ2 1.00 K73HG3 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio LYS73 HA 1.00 0.024 1.00 0.81 LYS73 HB2 1.00 0.003 1.00 2.94 LYS73 HB3 1.00 0.002 1.00 2.94 LYS73 HG2 1.00 0.007 1.00 6.42 LYS73 HG3 1.00 0.009 1.00 52.13 LYS73 HD2 1.00 0.002 1.00 6.34 LYS73 HD3 1.00 0.001 1.00 6.34 LYS73 HE2 1.00 0.022 1.00 0.86 LYS73 HE3 1.00 0.017 1.00 0.86 LYS73 H 1.00 0.032 0.80 0.00
Overall probability: 0.750 Overall confidence: 0.900 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence LYS73 0.75 0.90 Expected NOESY Contacts Proton Expected probability K73HA 0.98 K73HB2 1.00 K73HB3 1.00 K73HG2 1.00 K73HG3 1.00 K73HD3 1.00 K73HE2 1.00 K73HE3 1.00 K73HZ2 1.00 K73HD2 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio LYS73 HA 0.98 0.020 1.00 1.05 LYS73 HB2 1.00 0.037 0.30 0.00 LYS73 HB3 1.00 0.038 0.20 0.00 LYS73 HG2 1.00 0.087 0.00 0.00 LYS73 HG3 1.00 0.019 1.00 11.42 LYS73 HD2 1.00 0.000 1.00 244.35 LYS73 HD3 1.00 0.001 1.00 244.35 LYS73 HE2 1.00 0.000 1.00 6.07 LYS73 HE3 1.00 0.005 1.00 6.07 LYS73 H 0.87 0.002 1.00 0.35
Overall probability: 0.878 Overall confidence: 0.889 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence LYS73 0.88 0.89 Expected NOESY Contacts Proton Expected probability K73HB2 0.98 K73HB3 0.99 K73HG2 1.00 K73HG3 1.00 K73HD2 1.00 K73HD3 1.00 K73HE3 1.00 K73HZ2 1.00 K73HE2 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio LYS73 HB2 0.98 0.035 0.50 0.00 LYS73 HB3 0.99 0.036 0.40 0.00 LYS73 HG2 1.00 0.010 1.00 2.64 LYS73 HG3 1.00 0.014 1.00 3.64 LYS73 HD2 1.00 0.012 1.00 15.02 LYS73 HD3 1.00 0.013 1.00 15.02 LYS73 HE2 1.00 0.005 1.00 641.65 LYS73 HE3 1.00 0.010 1.00 641.65 LYS73 HA 0.77 0.022 1.00 0.47
Overall probability: 0.923 Overall confidence: 0.909 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence SER72 0.67 0.75 LYS73 1.00 1.00 LEU74 1.00 1.00 Expected NOESY Contacts Proton Expected probability S72H 1.00 S72HG 0.97 S72HB2 1.00 S72HA 1.00 K73HA 1.00 K73HB2 1.00 K73HB3 1.00 K73HG2 1.00 K73HG3 1.00 K73H 1.00 L74H 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio SER72 HA 1.00 0.060 0.00 0.00 SER72 HB2 1.00 0.008 1.00 -457591.00 SER72 H 1.00 0.005 1.00 -549382.00 LYS73 HA 1.00 0.014 1.00 -830971.00 LYS73 HB2 1.00 0.014 1.00 -1133081.00 LYS73 HB3 1.00 0.013 1.00 -1133081.00 LYS73 HG2 1.00 0.006 1.00 -634765.00 LYS73 HG3 1.00 0.009 1.00 -472196.00 LYS73 H 1.00 0.002 1.00 -6784282.00 LYS73 HD2 0.88 0.009 1.00 -380110.00 LYS73 HD3 0.87 0.008 1.00 -380110.00 LEU74 H 1.00 0.004 1.00 -810082.00 LEU74 HB2 0.61 0.021 1.00 -472196.00
Overall probability: 0.769 Overall confidence: 1.000 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence SER72 0.00 1.00 LYS73 1.00 1.00 LEU74 0.00 1.00 Expected NOESY Contacts Proton Expected probability S72HA 1.00 K73HB2 1.00 K73HB3 1.00 K73HG2 1.00 K73HG3 1.00 K73HD2 0.98 K73HD3 0.98 K73H 1.00 K73HA 1.00 L74HA 1.00 L74H 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio SER72 HA 1.00 0.076 0.00 0.00 LYS73 HA 1.00 0.009 1.00 12.17 LYS73 HB2 1.00 0.015 1.00 1.59 LYS73 HB3 1.00 0.015 1.00 1.59 LYS73 HG2 1.00 0.008 1.00 0.44 LYS73 HG3 1.00 0.024 1.00 0.81 LYS73 HD2 0.98 0.020 1.00 1.05 LYS73 HD3 0.98 0.020 1.00 1.05 LYS73 H 1.00 0.014 1.00 -830971.00 LYS73 HE2 0.77 0.022 1.00 0.47 LYS73 HE3 0.76 0.022 1.00 0.47 LEU74 HA 1.00 0.065 0.00 0.00 LEU74 H 1.00 0.060 0.00 0.00
Overall probability: 0.782 Overall confidence: 1.000 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence LYS73 0.76 1.00 LEU74 1.00 1.00 Expected NOESY Contacts Proton Expected probability K73HA 1.00 K73HB3 1.00 K73HG2 1.00 K73HG3 1.00 K73HD2 1.00 K73HD3 1.00 K73HE2 0.98 K73HE3 0.99 K73H 1.00 K73HB2 1.00 L74H 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio LYS73 HA 1.00 0.024 1.00 2.01 LYS73 HB2 1.00 0.009 1.00 53.87 LYS73 HB3 1.00 0.009 1.00 53.87 LYS73 HG2 1.00 0.023 1.00 2.64 LYS73 HG3 1.00 0.003 1.00 2.94 LYS73 HD2 1.00 0.037 0.30 0.00 LYS73 HD3 1.00 0.037 0.30 0.00 LYS73 HE2 0.98 0.035 0.50 0.00 LYS73 HE3 0.99 0.035 0.50 0.00 LYS73 H 1.00 0.014 1.00 -1133081.00 LEU74 H 1.00 0.007 1.00 -2784560.00
Overall probability: 0.745 Overall confidence: 1.000 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence LYS73 0.72 1.00 LEU74 1.00 1.00 Expected NOESY Contacts Proton Expected probability K73HA 1.00 K73HB2 1.00 K73HG2 1.00 K73HG3 1.00 K73HD2 1.00 K73HD3 1.00 K73HE2 0.99 K73HE3 0.99 K73H 1.00 K73HB3 1.00 L74H 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio LYS73 HA 1.00 0.025 1.00 2.01 LYS73 HB2 1.00 0.010 1.00 53.87 LYS73 HB3 1.00 0.010 1.00 53.87 LYS73 HG2 1.00 0.024 1.00 2.64 LYS73 HG3 1.00 0.002 1.00 2.94 LYS73 HD2 1.00 0.038 0.20 0.00 LYS73 HD3 1.00 0.038 0.20 0.00 LYS73 HE2 0.99 0.036 0.40 0.00 LYS73 HE3 0.99 0.036 0.40 0.00 LYS73 H 1.00 0.013 1.00 -1133081.00 LEU74 H 1.00 0.008 1.00 -2784560.00
Overall probability: 0.730 Overall confidence: 0.917 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence LYS73 0.80 0.91 LEU74 0.03 1.00 Expected NOESY Contacts Proton Expected probability K73HA 1.00 K73HB2 1.00 K73HB3 1.00 K73HG3 1.00 K73HD2 1.00 K73HD3 1.00 K73HE2 1.00 K73HE3 1.00 K73H 1.00 K73HZ2 1.00 K73HG2 1.00 L74H 0.97 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio LYS73 HA 1.00 0.017 1.00 0.46 LYS73 HB2 1.00 0.014 1.00 3.20 LYS73 HB3 1.00 0.014 1.00 3.20 LYS73 HG2 1.00 0.003 1.00 27.11 LYS73 HG3 1.00 0.007 1.00 6.42 LYS73 HD2 1.00 0.087 0.00 0.00 LYS73 HD3 1.00 0.087 0.00 0.00 LYS73 HE2 1.00 0.010 1.00 2.64 LYS73 HE3 1.00 0.010 1.00 2.64 LYS73 H 1.00 0.006 1.00 -634765.00 LEU74 H 0.97 0.044 0.03 0.00
Overall probability: 1.000 Overall confidence: 0.909 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence LYS73 1.00 0.91 Expected NOESY Contacts Proton Expected probability K73HA 1.00 K73HB2 1.00 K73HB3 1.00 K73HG2 1.00 K73HD2 1.00 K73HD3 1.00 K73HE2 1.00 K73HE3 1.00 K73H 1.00 K73HZ2 1.00 K73HG3 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio LYS73 HA 1.00 0.010 1.00 0.74 LYS73 HB2 1.00 0.005 1.00 3.41 LYS73 HB3 1.00 0.005 1.00 3.41 LYS73 HG2 1.00 0.019 1.00 7.46 LYS73 HG3 1.00 0.009 1.00 52.13 LYS73 HD2 1.00 0.019 1.00 11.42 LYS73 HD3 1.00 0.019 1.00 11.42 LYS73 HE2 1.00 0.014 1.00 3.64 LYS73 HE3 1.00 0.014 1.00 3.64 LYS73 H 1.00 0.009 1.00 -472196.00
Overall probability: 0.900 Overall confidence: 0.900 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence LYS73 0.90 0.90 Expected NOESY Contacts Proton Expected probability K73HA 0.98 K73HB2 1.00 K73HB3 1.00 K73HG2 1.00 K73HG3 1.00 K73HD3 1.00 K73HE2 1.00 K73HE3 1.00 K73HZ2 1.00 K73HD2 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio LYS73 HA 0.98 0.003 1.00 0.52 LYS73 HB2 1.00 0.000 1.00 5.56 LYS73 HB3 1.00 0.000 1.00 5.56 LYS73 HG2 1.00 0.059 0.00 0.00 LYS73 HG3 1.00 0.001 1.00 6.34 LYS73 HD2 1.00 0.001 1.00 244.35 LYS73 HD3 1.00 0.001 1.00 244.35 LYS73 HE2 1.00 0.013 1.00 15.02 LYS73 HE3 1.00 0.013 1.00 15.02 LYS73 H 0.87 0.008 1.00 -380110.00
Overall probability: 0.900 Overall confidence: 0.900 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence LYS73 0.90 0.90 Expected NOESY Contacts Proton Expected probability K73HA 0.98 K73HB2 1.00 K73HB3 1.00 K73HG2 1.00 K73HG3 1.00 K73HD2 1.00 K73HE2 1.00 K73HE3 1.00 K73HZ2 1.00 K73HD3 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio LYS73 HA 0.98 0.003 1.00 0.52 LYS73 HB2 1.00 0.000 1.00 5.56 LYS73 HB3 1.00 0.000 1.00 5.56 LYS73 HG2 1.00 0.059 0.00 0.00 LYS73 HG3 1.00 0.001 1.00 6.34 LYS73 HD2 1.00 0.001 1.00 244.35 LYS73 HD3 1.00 0.001 1.00 244.35 LYS73 HE2 1.00 0.013 1.00 15.02 LYS73 HE3 1.00 0.013 1.00 15.02 LYS73 H 0.87 0.008 1.00 -380110.00
Overall probability: 0.781 Overall confidence: 0.889 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence LYS73 0.78 0.89 Expected NOESY Contacts Proton Expected probability K73HB2 0.98 K73HB3 0.99 K73HG2 1.00 K73HG3 1.00 K73HD2 1.00 K73HD3 1.00 K73HE3 1.00 K73HZ2 1.00 K73HE2 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio LYS73 HB2 0.98 0.053 0.02 0.00 LYS73 HB3 0.99 0.053 0.01 0.00 LYS73 HG2 1.00 0.011 1.00 0.89 LYS73 HG3 1.00 0.022 1.00 0.86 LYS73 HD2 1.00 0.000 1.00 6.07 LYS73 HD3 1.00 0.000 1.00 6.07 LYS73 HE2 1.00 0.005 1.00 641.65 LYS73 HE3 1.00 0.005 1.00 641.65 LYS73 HA 0.77 0.009 1.00 0.06
Overall probability: 0.780 Overall confidence: 0.889 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence LYS73 0.78 0.89 Expected NOESY Contacts Proton Expected probability K73HB2 0.99 K73HB3 0.99 K73HG2 1.00 K73HG3 1.00 K73HD2 1.00 K73HD3 1.00 K73HE2 1.00 K73HZ2 1.00 K73HE3 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio LYS73 HB2 0.99 0.048 0.01 0.00 LYS73 HB3 0.99 0.048 0.01 0.00 LYS73 HG2 1.00 0.006 1.00 0.89 LYS73 HG3 1.00 0.017 1.00 0.86 LYS73 HD2 1.00 0.005 1.00 6.07 LYS73 HD3 1.00 0.005 1.00 6.07 LYS73 HE2 1.00 0.010 1.00 641.65 LYS73 HE3 1.00 0.010 1.00 641.65 LYS73 HA 0.76 0.014 1.00 0.06
Overall probability: 0.954 Overall confidence: 0.909 Calculated probabilities for inter- and intra-residue contacts Residue Probability Confidence SER72 1.00 0.75 LYS73 0.92 1.00 LEU74 1.00 1.00 Expected NOESY Contacts Proton Expected probability S72H 1.00 S72HG 0.97 S72HB2 1.00 S72HA 1.00 K73HA 1.00 K73HB2 1.00 K73HB3 1.00 K73HG2 1.00 K73HG3 1.00 K73H 1.00 L74H 1.00 NOESY contacts detailed probability Residue Proton Expected probability Min PPM differences Probability Peak intensity ratio SER72 HA 1.00 0.003 1.00 0.20 SER72 HB2 1.00 0.007 1.00 0.21 SER72 H 1.00 0.001 1.00 -644280.00 LYS73 HA 1.00 0.001 1.00 0.66 LYS73 HB2 1.00 0.032 0.80 0.00 LYS73 HB3 1.00 0.032 0.80 0.00 LYS73 HG2 1.00 0.009 1.00 0.38 LYS73 HG3 1.00 0.032 0.80 0.00 LYS73 H 1.00 0.002 1.00 -6784282.00 LYS73 HD2 0.88 0.002 1.00 0.35 LYS73 HD3 0.87 0.002 1.00 0.35 LEU74 H 1.00 0.006 1.00 -824165.00 LEU74 HA 0.91 0.004 1.00 0.08