# 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 95.66 6.56 12.32 20.07 110.63 -152.13 -87.50 118.25 99.83 0.07 0.10 99.78 0.07 0.05 0.06 0.00 0.00 0.03 0.01 1 F C H 128.13 3.59 10.63 15.55 97.93 89.73 -74.06 -33.04 51.50 1.30 47.20 44.60 1.32 5.40 46.01 1.54 0.00 0.56 0.57 2 F H H 134.16 2.75 9.99 14.07 96.29 60.02 -70.51 -36.18 33.77 0.70 65.53 22.54 4.95 6.33 63.94 1.67 0.01 0.32 0.25 3 S H H 65.23 2.87 11.21 15.28 96.60 56.11 -69.94 -38.07 14.68 0.38 84.94 10.16 2.33 3.28 82.09 1.82 0.00 0.21 0.10 4 Q H H 111.36 2.28 12.50 15.42 95.30 52.71 -67.98 -38.52 6.70 0.25 93.05 4.18 1.16 2.14 90.56 1.73 0.01 0.16 0.05 5 V H H 78.24 3.50 12.37 17.17 93.78 52.19 -66.30 -40.95 5.02 0.19 94.79 2.88 0.84 1.81 92.89 1.41 0.00 0.13 0.04 6 L H H 88.40 3.52 13.26 17.86 93.22 50.82 -66.48 -40.08 4.94 0.14 94.92 2.69 0.79 1.84 93.37 1.19 0.00 0.08 0.03 7 R H H 139.15 2.34 14.65 17.34 93.35 51.84 -66.36 -39.82 6.47 0.15 93.39 3.34 0.96 2.51 91.86 1.19 0.01 0.08 0.04 8 S H H 60.26 3.28 14.42 18.50 93.21 50.75 -66.60 -39.38 8.78 0.13 91.10 4.22 1.24 3.63 89.32 1.47 0.01 0.06 0.05 9 S H H 59.90 3.99 14.09 19.08 93.40 52.12 -66.82 -38.19 11.08 0.12 88.80 4.90 1.66 4.79 86.49 2.03 0.01 0.06 0.05 10 A H H 60.87 3.40 14.23 18.52 93.26 53.13 -67.43 -38.03 16.49 0.18 83.33 7.18 2.49 7.30 80.25 2.60 0.01 0.08 0.08 11 R H H 145.17 2.31 15.05 17.65 93.94 51.09 -68.66 -36.86 27.46 0.25 72.29 11.38 4.26 12.22 69.29 2.61 0.01 0.11 0.13 12 A H H 55.04 4.30 13.34 19.01 94.16 53.63 -68.60 -36.19 36.00 0.25 63.75 18.24 6.95 10.63 61.27 2.68 0.01 0.10 0.12 13 A H H 55.43 4.09 13.02 18.60 93.46 59.75 -64.60 -39.83 34.94 0.37 64.69 22.37 5.35 7.80 55.30 8.85 0.00 0.18 0.16 14 P H H 79.90 3.25 13.51 17.67 93.14 52.19 -66.70 -36.25 33.16 0.73 66.10 20.99 4.34 8.23 54.16 11.59 0.01 0.45 0.24 15 I H H 101.74 3.43 12.61 17.15 94.38 52.50 -70.32 -35.05 27.68 1.07 71.24 16.57 4.56 7.22 56.29 14.34 0.02 0.65 0.33 16 K H H 128.40 3.25 12.57 16.97 95.62 60.55 -71.02 -31.02 38.05 1.41 60.54 23.45 6.57 9.29 50.58 8.81 0.02 0.81 0.48 17 R C H 157.92 2.47 12.65 16.03 98.08 55.69 -76.13 -13.81 53.26 1.72 45.01 33.71 7.96 12.26 38.06 6.40 0.02 0.94 0.64 18 Y C C 144.69 4.25 10.35 16.10 102.04 71.80 -81.86 -6.99 65.80 2.12 32.08 45.66 9.33 10.14 28.96 3.97 0.01 1.04 0.89 19 T C C 93.78 3.16 10.52 15.17 105.96 73.44 -89.21 13.33 75.68 1.96 22.36 49.48 12.75 12.32 20.21 3.37 0.00 0.91 0.95 20 G C C 55.76 2.27 10.79 14.39 106.15 42.39 -71.49 0.44 76.68 1.22 22.10 32.05 19.09 26.12 14.91 6.59 0.01 0.53 0.68 21 G C C 52.91 2.90 10.64 15.04 108.60 41.17 -84.24 87.83 76.17 1.26 22.56 30.66 21.08 25.20 13.45 8.30 0.02 0.53 0.77 22 R C C 168.04 2.38 9.96 13.86 107.37 71.76 -88.13 65.50 70.47 4.23 25.30 43.22 15.48 11.90 18.20 7.07 0.03 2.00 2.10 23 I C C 118.96 3.19 9.77 14.62 107.19 115.96 -90.69 38.51 59.14 3.21 37.65 36.09 13.37 10.47 32.44 4.73 0.03 1.57 1.30 24 G H H 48.27 3.19 11.69 16.01 106.31 27.01 -13.02 -32.47 49.31 1.11 49.58 26.56 12.00 11.97 44.16 4.30 0.02 0.49 0.49 25 E H H 117.96 3.47 11.73 16.50 105.32 59.05 -79.36 38.29 31.33 0.57 68.10 17.76 6.37 7.91 64.40 3.06 0.01 0.26 0.22 26 S H H 60.95 3.60 12.30 17.12 105.60 20.76 -75.33 108.49 25.08 0.45 74.47 17.69 3.10 4.87 71.78 2.18 0.00 0.21 0.16 27 W H H 154.14 3.56 11.86 16.81 95.06 47.89 -66.27 -36.58 5.35 0.09 94.57 2.86 0.84 1.92 93.05 1.26 0.00 0.04 0.03 28 V H H 91.79 2.33 13.59 16.39 93.07 52.76 -65.73 -40.77 2.49 0.05 97.45 1.16 0.36 1.06 96.53 0.85 0.00 0.03 0.01 29 I H H 94.43 2.44 14.38 17.22 92.55 49.62 -66.00 -41.03 2.15 0.06 97.79 0.96 0.30 0.96 96.97 0.77 0.00 0.04 0.01 30 T H H 63.58 3.60 14.13 18.93 92.64 50.08 -65.55 -41.38 2.16 0.06 97.78 0.89 0.31 1.02 97.09 0.64 0.01 0.03 0.01 31 E H H 94.89 3.39 14.18 18.64 92.63 50.46 -65.18 -40.23 2.96 0.05 97.00 0.88 0.39 1.71 96.16 0.81 0.01 0.03 0.01 32 G H H 36.89 3.17 14.02 18.19 92.52 50.92 -65.26 -39.33 3.93 0.03 96.04 0.90 0.46 2.40 94.93 1.27 0.01 0.01 0.01 33 R H H 147.93 2.03 14.97 17.11 92.81 51.07 -67.31 -36.29 7.60 0.03 92.37 0.86 0.61 5.83 89.84 2.80 0.02 0.01 0.01 34 R H H 137.14 2.80 14.41 17.88 93.97 50.84 -70.58 -32.73 20.23 0.05 79.73 1.04 1.15 17.88 76.95 2.89 0.03 0.02 0.03 35 L H H 87.19 3.94 13.95 18.94 94.90 50.48 -73.54 -33.79 18.96 0.04 81.00 1.17 1.40 16.34 79.30 1.71 0.03 0.01 0.03 36 I H H 89.01 3.07 14.78 18.53 93.42 60.32 -63.58 -43.53 5.25 0.01 94.74 2.24 0.87 1.93 94.12 0.83 0.00 0.00 0.01 37 P H H 73.75 2.45 15.94 18.47 92.43 49.08 -65.01 -40.37 3.25 0.01 96.74 1.13 0.29 1.57 96.08 0.92 0.00 0.00 0.00 38 E H H 97.57 3.22 15.20 19.15 92.58 50.75 -65.69 -40.03 1.16 0.01 98.84 0.37 0.12 0.58 98.17 0.75 0.00 0.00 0.00 39 I H H 89.90 3.46 14.91 19.28 92.33 50.32 -64.88 -42.10 0.27 0.00 99.73 0.07 0.02 0.12 99.67 0.11 0.00 0.00 0.00 40 F H H 125.50 2.11 16.02 18.09 92.01 49.60 -64.51 -41.16 0.18 0.00 99.82 0.03 0.01 0.10 99.80 0.05 0.00 0.00 0.00 41 Q H H 104.34 2.07 16.49 18.29 92.27 49.51 -65.47 -41.26 0.19 0.00 99.81 0.02 0.01 0.12 99.80 0.04 0.00 0.00 0.00 42 W H H 132.75 3.02 16.26 19.69 92.35 48.55 -65.35 -41.72 0.18 0.00 99.82 0.02 0.01 0.12 99.83 0.03 0.00 0.00 0.00 43 S H H 49.57 4.57 15.24 21.19 92.01 50.54 -64.27 -41.17 0.20 0.00 99.80 0.02 0.01 0.13 99.82 0.03 0.00 0.00 0.00 44 A H H 57.18 2.81 16.86 19.88 91.89 50.69 -64.18 -41.61 0.27 0.00 99.73 0.02 0.01 0.19 99.74 0.04 0.00 0.00 0.00 45 V H H 84.24 2.24 17.65 19.39 92.27 49.39 -65.31 -41.66 0.36 0.00 99.64 0.03 0.02 0.26 99.64 0.06 0.00 0.00 0.00 46 L H H 81.65 4.10 16.12 21.13 92.32 49.25 -65.41 -41.30 0.49 0.00 99.51 0.05 0.02 0.33 99.46 0.13 0.00 0.00 0.00 47 S H H 51.82 4.68 14.87 20.92 91.99 50.91 -64.73 -40.67 1.10 0.00 98.90 0.11 0.07 0.81 98.55 0.45 0.00 0.00 0.00 48 V H H 91.06 2.29 15.86 18.24 92.39 50.53 -66.36 -39.33 2.03 0.01 97.97 0.12 0.11 1.71 96.94 1.11 0.01 0.00 0.00 49 C H H 82.73 2.42 15.18 17.82 93.18 48.95 -68.15 -37.08 4.34 0.02 95.64 0.20 0.24 3.96 93.94 1.63 0.01 0.01 0.00 50 L H H 104.12 3.29 14.13 18.27 95.05 46.94 -75.49 -29.73 24.79 0.10 75.11 0.71 1.27 23.53 72.09 2.22 0.09 0.04 0.07 51 G H H 40.05 4.05 14.35 19.36 97.34 44.44 -71.66 -19.00 45.99 0.16 53.85 2.66 2.96 39.07 52.69 2.39 0.04 0.06 0.13 52 W H H 134.87 4.08 13.89 19.18 96.09 74.12 -67.79 -43.66 20.93 0.15 78.93 6.38 5.59 9.77 76.16 1.93 0.02 0.05 0.10 53 P H H 73.48 3.49 15.11 19.48 93.12 46.99 -65.26 -38.46 12.62 0.04 87.34 2.55 1.44 8.27 85.97 1.71 0.01 0.02 0.03 54 G H H 36.07 3.26 15.36 19.41 92.37 52.96 -64.91 -40.11 3.63 0.02 96.35 0.90 0.41 2.12 95.11 1.44 0.00 0.01 0.01 55 A H H 52.30 3.42 14.91 19.40 92.13 51.64 -64.54 -41.29 1.22 0.01 98.77 0.39 0.12 0.60 98.19 0.69 0.00 0.00 0.00 56 V H H 78.68 2.85 15.03 18.53 92.08 49.79 -65.14 -41.83 0.64 0.02 99.34 0.17 0.05 0.36 98.99 0.41 0.00 0.01 0.00 57 Y H H 125.62 2.45 15.10 17.90 91.87 49.92 -64.49 -42.02 0.48 0.02 99.51 0.09 0.04 0.30 99.24 0.32 0.00 0.01 0.00 58 F H H 112.01 2.30 14.76 17.41 91.96 49.51 -64.41 -41.72 0.65 0.01 99.34 0.08 0.04 0.47 99.04 0.35 0.00 0.00 0.00 59 F H H 113.56 2.15 14.11 16.61 92.27 49.00 -65.14 -40.78 1.53 0.01 98.46 0.18 0.12 1.13 98.10 0.46 0.00 0.00 0.00 60 S H H 56.32 2.50 12.27 15.86 92.06 51.40 -64.94 -39.78 5.45 0.02 94.53 0.77 0.54 3.87 94.16 0.64 0.00 0.01 0.01 61 K H H 126.03 1.69 12.14 14.18 92.73 51.85 -66.40 -37.57 11.72 0.06 88.22 2.95 1.85 6.82 86.41 1.92 0.01 0.02 0.03 62 A H H 71.81 1.91 10.26 13.06 93.82 54.46 -68.73 -32.90 19.44 0.12 80.44 4.77 2.32 12.24 76.72 3.81 0.02 0.05 0.06 63 R H H 171.31 1.28 9.39 11.40 96.59 54.62 -76.38 -18.68 33.76 0.26 65.98 9.24 4.15 20.85 61.69 3.77 0.03 0.11 0.16 64 K C H 158.48 1.21 8.61 10.72 100.35 63.83 -81.47 5.69 55.96 0.39 43.65 30.65 1.71 22.40 42.71 2.14 0.00 0.15 0.25 65 A C C 78.60 2.95 10.07 14.54 104.55 88.10 -78.78 23.01 99.91 0.02 0.07 99.77 0.06 0.10 0.05 0.00 0.00 0.01 0.00