# 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 M C C 106.18 4.69 13.91 19.59 105.37 148.86 -83.82 71.84 98.95 0.33 0.72 98.91 0.10 0.13 0.63 0.02 0.00 0.10 0.12 1 I H H 94.99 5.41 11.30 17.83 96.90 97.20 -69.36 -36.30 23.07 0.38 76.56 20.97 0.65 2.35 74.96 0.80 0.00 0.16 0.12 2 T H H 87.33 3.37 11.58 16.21 94.22 56.40 -66.18 -39.28 8.67 0.32 91.01 5.44 0.94 2.41 89.90 1.03 0.00 0.21 0.07 3 L H H 111.74 1.30 13.85 14.56 93.39 50.67 -65.93 -39.68 3.17 0.14 96.69 1.60 0.35 1.24 95.52 1.14 0.00 0.13 0.02 4 L H H 85.97 3.49 13.71 18.05 93.13 50.58 -66.41 -40.26 1.57 0.05 98.38 0.70 0.17 0.69 97.63 0.75 0.00 0.04 0.01 5 V H H 54.01 8.43 12.21 21.96 92.78 50.77 -65.25 -41.49 1.15 0.03 98.83 0.41 0.12 0.56 98.60 0.28 0.00 0.02 0.00 6 A H H 60.47 3.01 15.87 19.25 92.23 51.16 -64.08 -41.21 0.69 0.01 99.31 0.20 0.06 0.34 99.29 0.11 0.00 0.00 0.00 7 L H H 95.64 1.72 17.25 17.93 92.07 50.53 -64.48 -41.69 0.32 0.00 99.68 0.07 0.02 0.16 99.69 0.06 0.00 0.00 0.00 8 L H H 65.72 7.57 14.92 23.50 92.20 49.90 -65.14 -41.35 0.21 0.00 99.78 0.04 0.01 0.12 99.79 0.04 0.00 0.00 0.00 9 V H H 62.30 8.28 14.96 24.19 92.05 50.19 -64.37 -41.65 0.22 0.00 99.78 0.04 0.01 0.12 99.79 0.04 0.00 0.00 0.00 10 L H H 104.52 1.69 18.59 19.02 91.69 50.01 -64.41 -41.64 0.27 0.00 99.73 0.04 0.01 0.16 99.73 0.05 0.00 0.00 0.00 11 I H H 93.03 2.80 18.01 20.52 91.97 48.56 -65.07 -41.80 0.70 0.00 99.30 0.09 0.04 0.47 99.29 0.11 0.00 0.00 0.00 12 S H H 29.43 10.98 13.83 26.10 92.38 50.35 -64.84 -40.96 2.67 0.01 97.33 0.26 0.13 2.05 97.33 0.22 0.00 0.00 0.00 13 L H H 82.91 5.41 16.93 23.19 91.85 51.19 -63.79 -41.02 2.11 0.00 97.89 0.23 0.16 1.47 97.70 0.43 0.00 0.00 0.00 14 G H H 42.23 1.96 18.18 19.29 91.84 51.57 -64.53 -40.23 2.06 0.00 97.94 0.26 0.14 1.40 97.13 1.06 0.00 0.00 0.00 15 L H H 78.45 6.05 15.62 22.67 92.69 50.00 -67.62 -37.31 2.32 0.01 97.68 0.22 0.13 1.77 95.98 1.89 0.00 0.00 0.00 16 V H H 62.66 9.29 14.54 24.65 93.30 50.76 -67.40 -39.47 3.77 0.01 96.21 0.27 0.21 3.15 94.22 2.11 0.01 0.01 0.00 17 V H H 92.42 2.71 17.34 19.96 93.90 47.27 -70.18 -37.96 17.33 0.04 82.62 0.55 0.74 16.43 79.94 2.25 0.04 0.02 0.03 18 T H H 74.90 3.09 16.79 20.10 94.30 49.12 -71.32 -36.51 19.61 0.03 80.36 0.93 1.08 17.52 78.92 1.49 0.02 0.01 0.02 19 V H H 53.54 8.86 14.22 24.30 92.58 55.24 -64.55 -43.00 5.89 0.02 94.09 1.84 1.09 2.76 91.92 2.36 0.00 0.01 0.01 20 P H H 63.01 5.80 15.56 22.68 92.12 51.26 -63.78 -39.76 3.53 0.03 96.44 1.05 0.38 1.93 92.68 3.93 0.00 0.02 0.01 21 V H H 89.96 2.10 17.15 18.86 92.33 50.13 -65.15 -40.63 1.85 0.02 98.13 0.37 0.20 1.16 93.47 4.78 0.00 0.01 0.00 22 A H H 50.87 5.54 14.58 21.51 92.64 51.12 -66.16 -39.18 3.53 0.02 96.44 0.51 0.36 2.47 92.01 4.63 0.01 0.01 0.01 23 L H H 84.60 7.59 13.17 21.93 92.89 51.17 -74.02 -23.54 21.72 0.11 78.16 2.05 1.86 17.68 74.20 4.04 0.04 0.05 0.07 24 A C H 74.43 3.40 13.29 17.83 94.51 60.61 -81.68 -10.95 58.98 0.51 40.51 11.98 10.27 36.64 37.64 2.90 0.04 0.17 0.37 25 T C S 72.36 4.62 10.06 16.75 115.91 91.86 -89.02 136.13 97.25 0.73 2.02 41.09 53.17 2.94 1.57 0.44 0.00 0.22 0.56 26 P C C 110.41 1.75 11.85 14.48 107.09 -107.50 -66.84 136.18 78.56 0.65 20.78 31.61 17.69 30.02 11.73 8.22 0.00 0.27 0.47 27 G C T 51.76 2.13 12.90 15.82 114.53 33.53 99.80 -163.80 71.69 0.55 27.76 18.41 19.95 34.32 17.12 9.52 0.02 0.21 0.46 28 E C C 117.94 3.20 12.61 16.80 99.59 11.47 -79.29 -4.94 58.21 0.45 41.34 36.71 7.71 13.65 32.59 8.85 0.00 0.19 0.30 29 W H H 120.71 7.54 10.28 19.43 94.43 96.33 -63.71 -39.06 15.58 0.11 84.31 8.85 2.67 4.72 77.61 6.03 0.00 0.05 0.05 30 E H H 128.24 1.72 15.39 17.02 92.59 52.20 -65.07 -40.20 7.09 0.05 92.85 2.61 1.05 3.37 86.87 6.04 0.00 0.03 0.02 31 I H H 103.98 1.73 16.45 17.44 92.56 49.00 -66.47 -39.85 6.47 0.05 93.47 2.06 0.88 3.38 87.11 6.51 0.01 0.03 0.02 32 A H H 30.46 8.10 12.75 23.00 92.70 50.52 -65.79 -39.71 8.52 0.06 91.42 2.93 1.22 4.29 86.94 4.55 0.01 0.03 0.03 33 K H H 100.17 5.80 15.63 22.59 92.00 53.93 -63.21 -40.47 8.20 0.05 91.76 2.52 1.10 4.48 89.77 2.07 0.01 0.02 0.02 34 G H H 38.01 2.13 17.33 19.03 92.02 50.23 -64.03 -41.15 10.54 0.05 89.41 2.81 1.18 6.30 87.70 1.95 0.01 0.02 0.03 35 K H H 107.49 3.12 16.89 20.29 92.33 49.86 -65.68 -41.07 7.10 0.07 92.82 2.25 1.04 3.87 90.90 1.85 0.01 0.03 0.04 36 F H H 81.74 8.15 14.39 23.74 92.18 50.20 -64.56 -42.10 4.03 0.09 95.87 1.34 0.60 2.16 94.81 1.00 0.01 0.05 0.03 37 N H H 86.40 3.62 16.48 20.61 92.12 49.45 -65.04 -40.43 3.55 0.09 96.36 1.11 0.44 2.01 95.35 0.99 0.01 0.05 0.03 38 R H H 141.34 1.58 17.67 18.18 92.35 49.97 -65.30 -40.81 3.33 0.04 96.62 0.54 0.36 2.38 95.71 0.94 0.01 0.02 0.02 39 F H H 96.91 4.90 15.98 21.79 92.46 49.14 -65.44 -41.23 3.44 0.03 96.53 0.43 0.33 2.66 95.79 0.75 0.01 0.01 0.01 40 F H H 83.41 7.34 14.80 23.38 92.15 50.20 -64.79 -40.99 1.35 0.00 98.65 0.26 0.13 0.86 98.45 0.30 0.00 0.00 0.00 41 Q H H 100.64 2.55 17.37 19.82 92.03 51.88 -64.17 -40.87 0.58 0.00 99.42 0.08 0.03 0.40 99.27 0.21 0.00 0.00 0.00 42 I H H 92.92 2.63 17.66 20.03 92.10 49.70 -64.84 -41.54 0.46 0.00 99.54 0.06 0.02 0.32 99.36 0.24 0.00 0.00 0.00 43 W H H 99.55 8.30 15.24 24.48 92.33 49.71 -65.70 -40.54 0.41 0.00 99.59 0.07 0.02 0.27 99.45 0.19 0.00 0.00 0.00 44 V H H 69.81 5.21 16.67 22.81 91.84 51.17 -64.33 -41.58 0.26 0.00 99.74 0.03 0.01 0.19 99.70 0.07 0.00 0.00 0.00 45 F H H 119.14 1.95 18.61 19.62 91.76 50.52 -64.45 -41.08 0.21 0.00 99.79 0.02 0.01 0.15 99.77 0.05 0.00 0.00 0.00 46 L H H 69.74 6.65 16.53 24.04 92.13 50.31 -65.28 -41.18 0.17 0.00 99.83 0.02 0.01 0.11 99.83 0.04 0.00 0.00 0.00 47 V H H 60.07 8.33 15.95 25.37 92.05 50.07 -64.12 -42.03 0.10 0.00 99.90 0.01 0.00 0.06 99.90 0.02 0.00 0.00 0.00 48 I H H 100.30 2.49 18.82 20.77 91.95 49.44 -64.52 -42.09 0.11 0.00 99.89 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 49 V H H 79.24 3.13 18.71 21.64 91.92 48.49 -64.80 -42.27 0.20 0.00 99.79 0.02 0.01 0.12 99.81 0.04 0.00 0.00 0.00 50 I H H 56.90 8.89 15.76 25.80 92.11 49.11 -64.51 -41.92 0.35 0.00 99.64 0.04 0.02 0.23 99.66 0.06 0.00 0.00 0.00 51 A H H 49.62 5.23 16.97 23.29 91.72 51.02 -63.36 -41.74 0.88 0.00 99.11 0.09 0.05 0.61 99.11 0.14 0.00 0.00 0.00 52 A H H 64.30 1.81 18.79 19.36 91.80 50.05 -64.34 -41.51 1.99 0.01 98.01 0.21 0.14 1.44 97.92 0.29 0.00 0.00 0.00 53 A H H 50.02 4.65 16.23 21.82 92.25 49.87 -64.80 -41.07 3.17 0.01 96.81 0.51 0.32 2.10 96.58 0.47 0.01 0.00 0.01 54 D H H 68.27 6.07 14.70 22.05 92.05 51.41 -64.99 -39.35 5.94 0.03 94.03 1.42 0.66 3.46 93.47 0.95 0.01 0.01 0.01 55 G H H 39.32 2.47 14.92 17.77 92.54 51.81 -64.33 -39.89 8.07 0.04 91.90 1.74 0.89 5.15 90.10 2.07 0.01 0.02 0.02 56 I H H 106.44 1.83 13.73 15.63 92.63 50.39 -66.47 -39.08 8.09 0.08 91.82 2.28 1.14 4.73 88.79 2.96 0.02 0.05 0.03 57 S H H 66.54 3.61 10.91 15.91 93.78 51.80 -68.47 -34.99 11.81 0.13 88.06 3.11 1.64 7.12 84.79 3.19 0.03 0.07 0.06 58 S H H 84.24 1.75 10.21 12.99 95.00 56.03 -75.25 -19.22 31.35 0.23 68.42 5.46 3.36 22.07 65.89 2.96 0.04 0.10 0.13 59 S C H 90.02 1.18 9.37 11.27 99.27 60.32 -83.05 -7.71 60.42 0.27 39.32 23.02 1.71 33.05 40.05 1.90 0.00 0.11 0.16 60 I C C 119.50 3.15 9.99 14.79 104.91 85.30 -84.32 40.09 99.94 0.03 0.02 99.86 0.06 0.04 0.02 0.00 0.00 0.01 0.01