# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 K C C 151.76 2.21 11.14 14.80 114.00 -139.71 -90.02 132.12 99.92 0.06 0.02 99.80 0.11 0.05 0.01 0.00 0.00 0.02 0.01 1 N C C 121.96 2.33 8.04 12.15 113.46 -148.19 -95.74 125.85 96.91 1.82 1.27 92.68 1.13 3.52 0.36 0.56 0.00 0.99 0.76 2 H C C 144.10 2.58 6.87 11.35 112.93 -161.33 -97.43 119.96 93.35 4.96 1.69 72.64 12.88 7.51 0.43 1.39 0.00 3.05 2.10 3 T C C 109.81 1.58 8.17 11.16 114.35 -166.83 -101.78 126.07 91.34 7.25 1.41 70.12 16.83 3.99 0.42 1.12 0.00 3.96 3.57 4 S C C 81.72 2.64 7.25 11.93 116.36 -143.70 -97.61 135.50 96.40 3.04 0.56 72.91 22.38 1.28 0.21 0.35 0.00 1.80 1.07 5 P C C 103.53 2.61 8.10 12.54 110.82 -113.62 -73.81 143.16 94.19 1.41 4.39 63.45 15.36 15.27 1.06 3.44 0.00 0.86 0.57 6 D C C 123.30 1.28 9.23 11.62 110.74 -129.83 -89.39 119.42 91.48 2.29 6.23 67.18 11.42 12.69 1.77 4.52 0.00 1.32 1.11 7 V C C 97.61 4.58 7.01 13.51 115.72 -161.11 -102.24 126.98 86.71 4.69 8.61 69.23 10.61 6.73 3.48 5.04 0.00 2.71 2.21 8 D C C 103.61 2.23 10.32 13.90 110.37 -152.01 -99.53 111.46 87.16 4.40 8.43 74.38 6.77 5.95 4.30 3.90 0.00 2.55 2.16 9 L C C 112.17 4.12 8.50 14.49 96.01 -165.97 -75.38 -11.76 61.03 2.63 36.34 31.47 9.68 20.52 15.10 20.42 0.04 1.34 1.43 10 G C T 55.35 1.71 11.59 13.96 97.78 64.27 -63.21 -31.15 58.53 1.37 40.11 14.93 12.20 31.42 16.99 22.76 0.09 0.66 0.95 11 D C C 105.44 1.95 11.05 13.77 100.45 53.01 -88.84 3.41 56.30 2.24 41.47 26.21 11.33 19.27 18.64 22.26 0.04 1.11 1.14 12 I C C 94.41 6.25 7.92 15.59 101.55 94.58 -77.41 -14.25 54.34 4.23 41.44 33.10 10.03 11.43 26.41 14.81 0.06 2.19 1.97 13 S C H 85.64 1.68 11.40 13.89 98.81 86.78 -74.67 -22.86 57.46 2.69 39.85 23.20 9.67 24.94 26.47 12.83 0.12 1.50 1.25 14 G C T 54.19 1.75 11.78 14.00 100.06 43.45 -71.00 -15.29 59.89 2.36 37.75 20.45 11.99 28.18 24.77 12.10 0.14 1.25 1.12 15 I C C 99.15 4.72 8.94 15.34 101.96 77.80 -83.27 -11.15 54.02 5.14 40.84 34.86 10.66 9.80 32.30 7.54 0.08 2.75 2.01 16 N C C 107.74 2.45 11.50 15.00 102.64 67.08 -86.11 17.97 54.79 4.31 40.90 38.86 7.50 8.88 34.31 6.42 0.03 2.65 1.36 17 A H H 70.73 3.48 10.13 15.15 99.42 89.43 -75.43 -20.00 40.71 3.44 55.84 21.79 8.19 12.31 43.40 10.97 0.10 2.26 0.97 18 S H H 79.65 2.10 10.98 14.02 99.90 69.61 -79.07 -21.70 41.11 5.09 53.80 21.01 7.81 13.49 42.97 9.66 0.15 3.79 1.11 19 V H H 105.03 2.29 10.64 13.96 101.93 61.91 -84.60 -12.26 38.12 8.98 52.89 20.42 8.67 11.35 42.83 7.91 0.28 6.68 1.86 20 V C H 89.09 3.84 10.04 15.52 107.43 69.59 -88.32 84.10 48.64 10.31 41.04 28.47 12.76 9.08 36.61 3.89 0.19 6.55 2.45 21 N C C 94.77 2.95 12.18 16.15 103.71 -110.53 -82.34 71.00 68.47 5.57 25.96 55.55 5.02 6.38 25.25 2.68 0.00 3.70 1.42 22 I H H 95.30 3.98 10.70 16.39 95.42 157.79 -66.68 -36.36 10.17 0.27 89.56 7.51 1.36 1.89 88.09 0.95 0.00 0.13 0.07 23 Q H H 120.79 1.45 13.45 14.78 92.68 54.46 -65.15 -40.29 2.26 0.04 97.70 0.90 0.30 1.03 96.88 0.85 0.00 0.02 0.01 24 K H H 120.20 1.53 14.26 15.39 92.46 50.21 -65.96 -40.07 1.43 0.03 98.54 0.51 0.18 0.72 97.75 0.81 0.00 0.02 0.00 25 E H H 92.25 2.98 13.23 17.31 92.38 50.89 -65.01 -41.02 1.02 0.02 98.96 0.41 0.12 0.48 98.53 0.45 0.00 0.01 0.00 26 I H H 88.92 2.56 13.69 17.00 91.86 50.33 -64.56 -41.27 0.63 0.01 99.37 0.24 0.06 0.28 99.27 0.14 0.00 0.00 0.00 27 D H H 84.87 1.64 15.22 16.35 91.74 50.83 -64.24 -40.78 0.74 0.00 99.25 0.22 0.06 0.38 99.22 0.12 0.00 0.00 0.00 28 R H H 136.03 1.63 15.22 16.40 91.89 50.13 -65.09 -41.03 0.79 0.00 99.20 0.17 0.06 0.46 99.18 0.12 0.00 0.00 0.00 29 L H H 89.98 2.53 14.22 17.29 91.83 50.02 -64.50 -41.08 0.62 0.00 99.37 0.15 0.05 0.34 99.36 0.10 0.00 0.00 0.00 30 N H H 90.14 1.97 14.98 16.92 91.74 50.80 -64.29 -40.45 0.86 0.00 99.14 0.21 0.07 0.46 99.16 0.10 0.00 0.00 0.00 31 E H H 108.37 1.60 15.59 16.52 91.90 50.54 -64.79 -41.00 1.04 0.00 98.96 0.23 0.09 0.59 98.93 0.15 0.00 0.00 0.00 32 V H H 79.82 2.02 14.92 16.95 91.84 49.60 -64.47 -41.79 1.02 0.00 98.97 0.28 0.09 0.54 98.91 0.17 0.00 0.00 0.00 33 A H H 56.37 2.27 13.84 16.69 91.81 50.34 -64.04 -40.95 1.18 0.01 98.82 0.32 0.11 0.62 98.67 0.27 0.00 0.00 0.00 34 K H H 122.99 1.55 14.68 15.84 91.89 50.78 -64.66 -40.64 2.23 0.01 97.76 0.51 0.21 1.36 97.41 0.50 0.00 0.00 0.00 35 N H H 95.68 1.48 14.24 15.28 92.19 50.26 -65.29 -39.85 4.57 0.02 95.41 0.85 0.43 3.08 94.89 0.73 0.00 0.01 0.01 36 L H H 98.75 1.65 13.03 14.71 92.27 50.45 -65.50 -40.37 6.56 0.06 93.39 1.88 0.88 3.79 92.07 1.33 0.01 0.03 0.03 37 N H H 96.14 1.72 12.29 14.38 92.75 51.14 -66.97 -36.22 11.13 0.13 88.73 3.88 1.49 5.90 86.18 2.41 0.01 0.07 0.05 38 E H H 124.55 1.39 11.89 13.37 93.40 54.25 -67.05 -37.03 16.98 0.20 82.82 4.03 2.06 10.72 78.44 4.52 0.03 0.12 0.08 39 S H H 74.22 1.46 10.41 12.37 94.26 55.00 -68.05 -34.71 23.35 0.45 76.20 5.73 3.02 14.73 71.10 4.92 0.06 0.29 0.17 40 L H H 122.37 1.22 8.92 10.75 96.27 54.81 -72.72 -29.49 29.90 2.46 67.64 12.30 5.39 13.89 60.54 5.35 0.13 1.71 0.69 41 I H H 125.57 1.54 7.87 10.46 99.75 60.16 -77.88 -21.39 38.84 5.41 55.74 19.49 7.16 13.98 49.45 4.63 0.18 3.79 1.32 42 D C H 118.84 1.08 8.09 9.88 102.33 56.42 -85.11 23.93 56.08 3.67 40.25 30.20 4.80 20.47 37.16 3.81 0.04 2.45 1.07 43 L C C 128.19 1.77 6.37 9.79 105.24 111.17 -83.83 41.33 75.34 1.93 22.72 59.89 1.50 12.99 21.69 2.02 0.00 1.22 0.69 44 Q C C 141.89 1.47 10.14 12.66 106.40 84.01 -85.26 79.19 99.74 0.11 0.14 99.49 0.13 0.19 0.10 0.01 0.00 0.07 0.02