# 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 S C C 79.98 3.50 11.87 16.90 112.57 -141.11 -82.96 144.67 99.97 0.02 0.01 99.86 0.08 0.04 0.00 0.00 0.00 0.00 0.00 1 G C C 53.51 2.98 9.80 14.40 113.49 -124.18 -88.04 154.60 92.98 0.43 6.60 86.22 1.73 5.79 4.21 1.56 0.00 0.18 0.32 2 T C C 104.78 2.22 9.04 12.82 108.40 -106.49 -88.19 110.44 81.55 1.13 17.32 50.59 16.74 14.47 11.39 5.53 0.00 0.46 0.82 3 G C C 47.61 3.04 10.03 14.43 113.22 -21.10 -89.35 163.37 74.55 1.07 24.39 46.54 14.29 14.12 15.45 8.41 0.00 0.45 0.73 4 L C H 123.87 2.83 9.34 13.60 98.32 -79.96 -72.03 -23.57 55.50 0.81 43.69 22.76 11.65 22.15 27.44 15.06 0.03 0.37 0.56 5 G C H 56.13 1.71 11.12 13.55 97.80 53.80 -72.96 -24.16 56.06 0.81 43.13 22.66 11.94 22.49 27.78 14.17 0.03 0.35 0.57 6 E C C 124.37 2.95 10.47 14.85 101.27 65.46 -84.33 -4.45 56.36 1.01 42.62 36.48 10.96 9.54 32.29 9.74 0.01 0.44 0.55 7 V C C 87.45 4.67 9.92 16.28 106.85 87.53 -83.97 61.13 59.52 1.11 39.37 40.12 12.16 7.01 36.41 3.33 0.00 0.45 0.50 8 D C C 88.44 2.71 12.39 15.98 105.99 68.84 -80.17 114.47 62.35 0.94 36.71 49.27 6.86 4.94 36.15 1.97 0.00 0.34 0.46 9 V H H 94.96 2.99 11.27 15.53 94.58 -120.66 -66.44 -37.48 9.65 0.07 90.28 4.43 1.80 3.55 89.02 1.15 0.00 0.02 0.03 10 D H H 101.42 1.57 13.48 15.08 92.85 52.37 -65.77 -39.09 4.81 0.03 95.16 1.55 0.67 2.48 94.37 0.90 0.00 0.01 0.01 11 T H H 74.66 2.15 13.84 16.31 92.68 50.18 -65.65 -41.14 2.60 0.02 97.38 0.82 0.35 1.35 96.72 0.74 0.00 0.01 0.01 12 Y H H 121.63 2.52 13.63 16.90 92.35 50.18 -64.99 -42.24 1.38 0.01 98.60 0.43 0.17 0.72 98.29 0.39 0.00 0.00 0.00 13 L H H 91.83 2.23 14.52 17.08 92.13 49.35 -64.90 -41.17 0.85 0.00 99.14 0.21 0.09 0.46 99.04 0.19 0.00 0.00 0.00 14 S H H 60.69 2.01 15.02 17.05 91.86 50.91 -64.16 -41.11 0.85 0.00 99.15 0.21 0.09 0.45 99.12 0.13 0.00 0.00 0.00 15 N H H 89.98 2.03 15.36 17.33 92.21 50.04 -65.44 -40.06 1.39 0.00 98.60 0.26 0.11 0.86 98.61 0.16 0.00 0.00 0.00 16 L H H 90.19 2.35 15.11 17.73 92.04 50.86 -64.69 -41.02 0.85 0.00 99.15 0.19 0.08 0.47 99.14 0.13 0.00 0.00 0.00 17 Q H H 104.63 1.93 15.50 17.27 92.12 50.39 -64.74 -40.90 0.96 0.00 99.04 0.20 0.08 0.52 99.08 0.12 0.00 0.00 0.00 18 T H H 77.05 2.01 15.51 17.39 92.07 50.04 -64.74 -41.31 1.47 0.00 98.53 0.29 0.12 0.82 98.64 0.13 0.00 0.00 0.00 19 K H H 124.30 1.78 15.66 17.18 92.10 50.08 -65.10 -40.76 1.01 0.00 98.99 0.19 0.08 0.54 99.09 0.10 0.00 0.00 0.00 20 T H H 73.45 2.23 15.53 17.75 92.12 50.20 -65.07 -41.22 0.91 0.00 99.09 0.20 0.07 0.45 99.18 0.09 0.00 0.00 0.00 21 T H H 75.66 2.05 15.81 17.65 92.06 49.58 -64.73 -41.58 0.49 0.00 99.51 0.08 0.03 0.26 99.55 0.07 0.00 0.00 0.00 22 L H H 92.54 2.20 15.42 17.75 91.78 49.73 -64.52 -40.76 0.29 0.00 99.71 0.04 0.02 0.15 99.74 0.05 0.00 0.00 0.00 23 S H H 61.45 2.14 15.44 17.59 91.70 51.10 -64.39 -40.73 0.37 0.00 99.63 0.05 0.02 0.20 99.68 0.05 0.00 0.00 0.00 24 M H H 109.24 1.65 15.89 16.86 92.10 50.15 -64.93 -41.20 0.35 0.00 99.65 0.05 0.02 0.20 99.68 0.06 0.00 0.00 0.00 25 I H H 99.21 1.82 15.78 17.14 92.09 49.19 -64.61 -41.84 0.26 0.00 99.74 0.04 0.02 0.14 99.76 0.04 0.00 0.00 0.00 26 A H H 56.97 2.39 15.19 17.97 91.70 50.22 -64.00 -41.19 0.37 0.00 99.63 0.05 0.02 0.21 99.66 0.05 0.00 0.00 0.00 27 D H H 83.47 1.86 16.03 17.44 91.58 49.91 -64.59 -40.46 0.65 0.00 99.35 0.08 0.04 0.40 99.41 0.07 0.00 0.00 0.00 28 G H H 36.41 2.27 15.45 17.92 91.91 51.11 -63.68 -41.68 1.07 0.00 98.93 0.13 0.07 0.68 99.02 0.11 0.00 0.00 0.00 29 L H H 96.46 2.01 15.49 17.42 92.00 49.52 -65.02 -40.57 0.93 0.00 99.07 0.16 0.07 0.53 99.13 0.11 0.00 0.00 0.00 30 E H H 110.49 1.95 15.87 17.63 91.78 50.35 -64.73 -40.87 0.64 0.00 99.36 0.13 0.05 0.34 99.40 0.08 0.00 0.00 0.00 31 R H H 138.59 1.53 16.32 16.96 91.98 49.57 -64.65 -40.99 0.72 0.00 99.28 0.13 0.05 0.42 99.31 0.09 0.00 0.00 0.00 32 S H H 56.41 2.24 15.33 17.72 91.74 50.32 -64.12 -41.22 0.90 0.00 99.10 0.16 0.06 0.52 99.16 0.10 0.00 0.00 0.00 33 A H H 57.98 2.49 15.22 18.16 91.74 50.67 -63.98 -41.21 0.58 0.00 99.42 0.09 0.04 0.33 99.47 0.07 0.00 0.00 0.00 34 R H H 142.64 1.51 16.05 16.83 91.69 49.91 -64.52 -40.91 0.38 0.00 99.62 0.06 0.02 0.21 99.65 0.06 0.00 0.00 0.00 35 D H H 87.43 1.61 15.98 16.84 91.82 49.69 -64.78 -41.28 0.38 0.00 99.62 0.06 0.02 0.22 99.64 0.06 0.00 0.00 0.00 36 F H H 115.45 2.00 15.31 17.14 91.83 49.73 -64.87 -41.36 0.24 0.00 99.76 0.03 0.01 0.14 99.76 0.05 0.00 0.00 0.00 37 D H H 82.87 2.03 15.32 17.37 91.55 50.44 -64.12 -40.58 0.20 0.00 99.79 0.02 0.01 0.12 99.79 0.05 0.00 0.00 0.00 38 A H H 58.15 1.93 15.36 17.08 91.68 50.62 -64.08 -41.30 0.31 0.00 99.68 0.03 0.02 0.21 99.67 0.07 0.00 0.00 0.00 39 F H H 117.90 1.73 15.56 16.78 91.98 49.97 -64.46 -41.42 0.47 0.00 99.53 0.05 0.03 0.31 99.52 0.09 0.00 0.00 0.00 40 L H H 91.29 2.15 14.78 17.10 91.94 50.02 -64.32 -41.30 0.64 0.00 99.36 0.09 0.05 0.40 99.33 0.14 0.00 0.00 0.00 41 E H H 112.24 1.73 14.96 16.45 91.76 50.65 -64.17 -40.67 1.33 0.00 98.67 0.15 0.09 0.91 98.58 0.25 0.00 0.00 0.00 42 E H H 116.89 1.46 15.48 16.15 92.04 49.94 -65.00 -39.81 4.36 0.00 95.64 0.29 0.27 3.47 95.59 0.39 0.00 0.00 0.00 43 N H H 89.93 1.96 14.93 16.77 92.25 49.52 -65.94 -39.43 9.37 0.01 90.61 1.10 0.70 6.80 90.75 0.64 0.00 0.00 0.01 44 V H H 76.65 2.56 14.26 17.49 92.27 50.77 -65.10 -40.91 5.34 0.03 94.63 1.94 0.73 2.39 94.40 0.52 0.00 0.01 0.01 45 T H H 76.63 2.06 15.10 17.20 91.83 50.78 -64.55 -40.78 3.15 0.02 96.84 1.35 0.35 1.28 96.50 0.51 0.00 0.01 0.01 46 L H H 94.66 1.70 15.35 16.54 91.98 50.19 -65.16 -40.76 2.21 0.01 97.78 0.67 0.25 1.14 97.44 0.49 0.00 0.00 0.00 47 E H H 113.77 1.66 15.48 16.62 91.98 49.98 -64.95 -40.75 1.79 0.00 98.20 0.49 0.17 0.96 98.00 0.37 0.00 0.00 0.00 48 W H H 132.87 2.48 14.40 17.44 92.12 49.96 -64.70 -41.37 0.82 0.00 99.18 0.17 0.07 0.45 99.08 0.22 0.00 0.00 0.00 49 E H H 105.34 2.02 15.66 17.57 91.96 50.26 -64.43 -40.90 0.48 0.00 99.52 0.08 0.03 0.28 99.48 0.13 0.00 0.00 0.00 50 A H H 54.69 1.97 15.43 17.32 91.72 50.30 -64.07 -41.21 0.61 0.00 99.39 0.07 0.04 0.38 99.39 0.12 0.00 0.00 0.00 51 Q H H 95.83 2.29 15.30 17.78 92.01 50.35 -64.92 -40.36 0.66 0.00 99.34 0.10 0.04 0.37 99.39 0.09 0.00 0.00 0.00 52 R H H 123.89 3.00 14.35 18.27 92.03 51.26 -64.57 -40.24 0.63 0.00 99.37 0.09 0.03 0.33 99.47 0.08 0.00 0.00 0.00 53 K H H 118.76 1.93 15.04 17.01 91.93 51.17 -64.47 -40.61 0.65 0.00 99.35 0.11 0.03 0.32 99.40 0.13 0.00 0.00 0.00 54 R H H 137.70 1.41 15.21 15.82 92.02 50.81 -64.73 -41.07 0.67 0.00 99.33 0.11 0.04 0.36 99.25 0.24 0.00 0.00 0.00 55 I H H 85.52 2.59 13.54 16.91 92.15 49.03 -64.92 -41.81 0.75 0.01 99.25 0.12 0.05 0.45 98.89 0.49 0.00 0.00 0.00 56 Y H H 106.16 3.56 11.69 16.87 92.30 49.74 -64.83 -41.17 1.29 0.01 98.69 0.20 0.10 0.84 96.82 2.02 0.00 0.01 0.00 57 Q H H 119.94 1.52 12.48 14.14 92.32 50.56 -65.41 -39.71 3.17 0.01 96.81 0.26 0.17 2.56 93.18 3.83 0.01 0.01 0.00 58 H H H 145.22 1.12 11.42 12.49 92.63 51.02 -68.70 -30.64 11.56 0.02 88.42 0.36 0.43 10.91 85.05 3.21 0.01 0.01 0.01 59 F C T 134.82 2.61 9.60 13.49 95.48 45.47 -91.90 0.94 62.24 0.06 37.70 0.81 2.29 59.12 35.36 2.33 0.01 0.02 0.06 60 G C T 60.40 1.00 11.42 12.53 96.53 -107.71 78.35 13.93 99.37 0.07 0.56 6.20 2.80 90.57 0.28 0.10 0.00 0.03 0.02 61 I C C 99.50 4.60 7.57 14.09 108.55 130.28 -90.47 103.79 99.22 0.47 0.31 97.71 0.87 0.79 0.15 0.06 0.00 0.16 0.25 62 K C C 144.61 2.72 12.71 17.00 116.07 -141.20 -101.44 135.87 99.86 0.11 0.04 99.73 0.14 0.04 0.02 0.01 0.00 0.05 0.02