# 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 A C C 73.03 5.77 12.88 19.83 110.27 -141.30 -88.30 115.84 99.93 0.06 0.01 99.79 0.15 0.02 0.00 0.00 0.00 0.02 0.01 1 V C C 96.80 4.91 10.62 17.38 116.96 -132.79 -98.87 131.69 98.92 1.01 0.07 97.72 1.23 0.13 0.03 0.02 0.00 0.40 0.47 2 P C C 82.47 5.75 10.22 17.82 113.22 -110.59 -67.30 147.88 98.30 1.10 0.60 94.57 2.83 1.10 0.19 0.29 0.00 0.64 0.38 3 T C C 102.16 3.35 11.33 16.39 111.38 -141.95 -94.18 122.04 94.34 3.62 2.04 84.78 7.18 2.19 0.80 1.11 0.00 1.68 2.25 4 T C C 82.18 6.10 10.28 18.05 118.06 -157.99 -102.12 136.46 88.70 3.68 7.62 73.86 10.49 4.29 2.92 4.59 0.00 2.07 1.78 5 L C C 104.10 5.67 12.12 19.25 112.71 -147.57 -91.07 129.33 81.16 2.36 16.48 44.85 23.62 13.30 5.22 10.73 0.00 1.24 1.04 6 E C C 131.63 3.41 15.47 20.11 114.22 -120.83 -90.42 132.74 81.62 2.53 15.85 51.39 17.39 13.01 5.52 10.18 0.00 1.34 1.18 7 W C C 84.95 16.40 9.15 24.49 113.62 -117.53 -83.89 129.34 83.94 2.41 13.66 66.24 12.52 4.79 8.58 5.10 0.00 0.95 1.82 8 N C C 76.97 4.17 17.04 21.81 124.23 -154.28 -99.82 163.80 88.69 0.87 10.45 80.70 5.57 1.81 10.31 0.76 0.00 0.28 0.57 9 L H H 117.17 3.92 13.72 19.22 92.59 -101.57 -60.62 -34.20 18.24 0.08 81.68 2.39 2.72 13.20 80.41 1.17 0.03 0.03 0.05 10 N H H 106.80 2.07 18.04 19.77 92.09 53.74 -66.40 -37.90 12.14 0.08 87.78 1.64 1.50 9.02 86.89 0.83 0.04 0.02 0.05 11 V H H 31.87 13.17 15.50 29.57 92.63 49.64 -66.80 -41.86 1.57 0.01 98.42 0.42 0.20 0.81 98.37 0.21 0.00 0.00 0.00 12 G H H 13.44 15.38 15.20 31.08 91.40 52.97 -62.62 -42.09 0.39 0.00 99.60 0.13 0.03 0.17 99.61 0.07 0.00 0.00 0.00 13 L H H 95.34 2.81 22.17 24.12 91.66 50.03 -64.37 -41.27 0.12 0.00 99.88 0.03 0.01 0.05 99.88 0.02 0.00 0.00 0.00 14 T H H 62.11 5.31 21.55 27.16 91.72 49.24 -64.54 -42.45 0.05 0.00 99.95 0.01 0.00 0.02 99.95 0.01 0.00 0.00 0.00 15 M H H 21.09 20.38 16.89 36.92 91.86 49.84 -64.54 -42.19 0.04 0.00 99.96 0.00 0.00 0.02 99.96 0.01 0.00 0.00 0.00 16 I H H 65.31 11.51 20.56 32.17 91.53 50.31 -63.18 -42.33 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 17 V H H 89.53 1.89 24.99 24.70 91.23 48.80 -64.10 -42.12 0.14 0.00 99.86 0.01 0.00 0.10 99.88 0.01 0.00 0.00 0.00 18 C H H 32.62 10.64 20.18 31.81 91.78 49.25 -64.99 -41.90 0.23 0.00 99.77 0.02 0.01 0.14 99.82 0.01 0.00 0.00 0.00 19 N H H 16.26 20.88 16.97 37.45 91.89 50.94 -64.20 -41.86 0.34 0.00 99.66 0.04 0.02 0.21 99.72 0.01 0.00 0.00 0.00 20 I H H 87.21 5.51 23.05 28.73 91.40 50.61 -63.74 -41.95 0.19 0.00 99.81 0.02 0.01 0.12 99.84 0.01 0.00 0.00 0.00 21 V H H 84.56 2.43 24.58 25.50 91.36 48.62 -64.14 -42.66 0.13 0.00 99.87 0.02 0.01 0.07 99.88 0.02 0.00 0.00 0.00 22 A H H 16.26 15.05 17.86 33.76 91.39 50.19 -63.94 -42.57 0.14 0.00 99.85 0.02 0.00 0.09 99.84 0.05 0.00 0.00 0.00 23 I H H 47.50 15.03 18.67 33.43 91.58 49.66 -63.95 -41.78 0.19 0.00 99.81 0.01 0.01 0.15 99.75 0.08 0.00 0.00 0.00 24 A H H 60.47 2.65 22.68 24.29 91.44 50.57 -63.68 -42.33 0.62 0.00 99.38 0.02 0.02 0.56 99.23 0.17 0.00 0.00 0.00 25 F H H 101.86 3.99 21.52 25.38 91.88 47.92 -65.26 -40.85 2.21 0.00 97.78 0.09 0.09 2.00 97.46 0.36 0.00 0.00 0.00 26 A H H 13.26 17.16 14.46 32.18 91.90 52.66 -63.96 -41.59 3.45 0.01 96.54 0.32 0.23 2.63 94.19 2.61 0.01 0.00 0.00 27 K H H 91.39 9.77 17.94 28.17 91.78 52.96 -64.07 -38.67 5.63 0.02 94.35 0.49 0.36 4.55 88.56 6.01 0.02 0.01 0.01 28 Y H H 148.38 1.86 20.33 20.96 92.73 51.11 -68.00 -35.24 9.00 0.04 90.96 0.72 0.68 7.32 84.88 6.32 0.04 0.02 0.02 29 T H H 58.23 8.21 16.09 25.34 93.80 50.18 -74.66 -29.29 18.90 0.16 80.94 2.01 2.16 14.92 76.47 4.16 0.10 0.07 0.10 30 M C H 50.09 16.80 10.72 26.58 99.76 66.08 -82.83 4.82 52.28 2.35 45.37 18.68 10.08 25.86 39.21 3.69 0.19 0.87 1.41 31 K C C 146.08 2.78 16.09 19.87 96.26 117.01 -72.51 -25.65 79.27 1.87 18.86 30.57 21.88 27.12 15.37 3.18 0.02 0.71 1.13 32 E C C 118.85 3.24 14.53 18.87 110.09 47.18 -113.68 90.59 98.42 0.97 0.61 56.28 40.94 1.20 0.31 0.22 0.00 0.28 0.77 33 P C T 79.88 8.94 10.68 20.97 108.56 -152.51 -65.93 134.67 91.17 0.66 8.17 17.64 7.21 65.72 0.91 7.82 0.00 0.37 0.33 34 G C T 57.59 2.56 14.80 18.27 98.24 26.22 81.44 -0.11 92.32 0.69 6.98 13.32 9.90 68.15 0.70 7.20 0.00 0.40 0.33 35 A C C 63.22 6.40 12.29 20.13 105.34 112.14 -88.92 38.27 88.37 2.44 9.19 47.26 29.98 10.45 1.43 8.05 0.00 0.97 1.84 36 G C C 35.52 6.36 13.65 21.45 130.77 -66.79 126.23 -177.20 96.29 2.31 1.40 54.39 36.62 5.17 0.28 1.17 0.00 1.00 1.36 37 P C C 84.29 5.96 13.79 21.03 112.35 -46.63 -70.65 147.01 96.10 2.01 1.89 65.99 21.87 7.95 0.36 1.74 0.00 0.97 1.11 38 K C C 145.53 3.51 14.98 20.03 114.55 -122.46 -86.74 134.17 93.12 5.45 1.43 72.07 16.63 3.72 0.39 1.13 0.00 2.23 3.84 39 L C C 73.20 11.71 9.52 21.66 115.28 -123.57 -85.26 137.62 95.19 4.35 0.45 77.69 16.46 1.06 0.15 0.30 0.00 1.84 2.50 40 P C C 86.50 4.55 13.33 19.23 107.50 -105.66 -68.32 142.32 92.24 3.69 4.07 61.81 17.62 12.36 0.88 3.49 0.00 1.84 2.00 41 G C C 50.46 3.69 12.02 17.00 112.38 16.55 -67.11 135.24 89.85 2.96 7.18 55.77 20.23 13.19 1.82 5.62 0.00 1.18 2.18 42 E C G 116.62 5.63 9.94 17.01 103.72 -121.49 -81.49 14.42 61.56 1.45 36.99 25.76 14.90 22.16 6.95 28.67 0.01 0.64 0.91 43 A C G 82.16 3.06 11.43 15.73 101.73 73.94 -77.70 -4.54 54.18 1.02 44.80 16.46 11.61 26.71 8.13 35.97 0.01 0.50 0.61 44 F C G 141.31 3.82 11.18 16.32 101.72 55.78 -83.94 -10.81 51.43 2.05 46.52 16.15 12.63 24.04 8.52 36.48 0.03 1.06 1.09 45 F C T 122.66 6.29 10.99 18.48 103.85 28.96 -97.67 36.23 63.49 3.83 32.68 22.72 16.12 26.15 8.12 22.63 0.06 1.71 2.50 46 G C T 48.42 4.67 15.41 21.10 104.80 -107.61 65.68 28.07 85.85 2.39 11.77 22.69 22.66 41.10 2.81 8.20 0.01 1.06 1.47 47 G C S 38.35 7.96 16.33 24.89 110.63 -70.66 89.15 1.81 91.64 3.14 5.22 29.80 34.34 27.99 1.28 3.59 0.00 1.54 1.46 48 M C C 53.78 16.31 13.59 29.51 117.84 63.59 -98.79 136.02 81.40 16.37 2.23 64.61 13.17 2.25 1.34 0.89 0.00 5.09 12.65 49 G C C 22.85 9.05 20.47 30.01 125.74 -151.19 -95.63 170.19 89.15 6.36 4.49 77.40 9.33 1.23 4.73 0.45 0.00 1.54 5.33 50 L H H 72.78 13.53 17.90 31.17 92.80 -97.25 -61.01 -38.31 1.93 0.01 98.06 0.45 0.33 0.97 98.00 0.25 0.00 0.00 0.00 51 P H H 70.41 6.12 22.37 28.87 91.77 53.44 -64.10 -40.19 0.76 0.00 99.23 0.14 0.06 0.47 99.06 0.27 0.00 0.00 0.00 52 A H H 28.03 12.40 20.63 33.52 92.00 50.47 -65.23 -40.61 0.17 0.00 99.83 0.03 0.01 0.10 99.65 0.21 0.00 0.00 0.00 53 L H H 26.81 19.57 20.05 38.77 91.70 50.22 -63.31 -42.72 0.10 0.00 99.90 0.01 0.01 0.06 99.83 0.10 0.00 0.00 0.00 54 L H H 62.82 12.13 24.32 36.08 91.82 49.62 -63.91 -42.15 0.17 0.00 99.83 0.01 0.01 0.11 99.80 0.07 0.00 0.00 0.00 55 A H H 44.84 7.11 25.71 33.09 91.71 50.27 -64.39 -42.11 0.48 0.00 99.52 0.04 0.02 0.35 99.45 0.14 0.00 0.00 0.00 56 T H H 25.00 16.18 23.84 39.58 92.21 48.76 -65.54 -41.69 1.46 0.00 98.54 0.10 0.07 1.20 98.36 0.27 0.00 0.00 0.00 57 T H H 20.91 19.85 23.73 42.30 92.57 50.82 -64.80 -41.68 3.63 0.01 96.37 0.27 0.23 2.93 96.17 0.40 0.00 0.00 0.00 58 S H H 40.83 10.66 25.91 36.50 92.27 50.85 -64.44 -42.11 4.77 0.02 95.21 0.68 0.54 3.48 94.77 0.49 0.01 0.01 0.01 59 F H H 86.77 7.32 27.71 35.56 91.95 49.14 -65.00 -42.09 1.77 0.01 98.22 0.25 0.20 1.28 97.92 0.34 0.00 0.00 0.00 60 G H H 7.50 19.20 22.23 41.01 91.78 51.26 -63.46 -42.59 1.29 0.01 98.71 0.23 0.12 0.88 98.42 0.34 0.00 0.00 0.00 61 H H H 46.96 18.39 23.33 40.20 91.79 50.83 -64.04 -41.83 1.10 0.01 98.89 0.21 0.10 0.79 98.55 0.35 0.00 0.00 0.00 62 L H H 81.37 7.02 26.67 33.88 91.80 49.15 -64.37 -42.30 0.66 0.01 99.33 0.10 0.05 0.47 99.17 0.20 0.00 0.00 0.00 63 L H H 67.71 8.30 26.67 35.34 91.74 48.35 -64.61 -42.57 0.84 0.00 99.16 0.09 0.05 0.62 99.08 0.15 0.00 0.00 0.00 64 G H H 5.08 21.35 20.60 41.62 91.71 50.37 -64.33 -42.31 1.00 0.00 99.00 0.10 0.05 0.73 99.00 0.13 0.00 0.00 0.00 65 A H H 29.65 15.18 22.97 37.60 91.53 51.25 -63.10 -42.27 0.28 0.00 99.72 0.02 0.01 0.19 99.71 0.07 0.00 0.00 0.00 66 G H H 35.79 4.43 26.12 30.36 91.45 50.46 -63.65 -42.01 0.22 0.00 99.78 0.02 0.01 0.15 99.75 0.07 0.00 0.00 0.00 67 V H H 46.34 11.59 23.45 35.00 91.84 49.25 -64.72 -42.47 0.23 0.00 99.77 0.02 0.01 0.16 99.75 0.07 0.00 0.00 0.00 68 I H H 19.29 20.62 19.44 39.43 91.61 48.91 -63.74 -43.14 0.27 0.00 99.73 0.02 0.01 0.18 99.71 0.08 0.00 0.00 0.00 69 L H H 73.04 7.73 22.75 30.78 91.47 49.87 -63.16 -42.05 0.64 0.00 99.35 0.06 0.03 0.45 99.30 0.16 0.00 0.00 0.00 70 G H H 33.15 3.57 21.58 25.02 91.34 50.12 -63.73 -41.87 2.40 0.00 97.59 0.17 0.13 1.93 97.32 0.44 0.00 0.00 0.00 71 L H H 33.30 12.40 16.19 29.76 91.87 49.12 -65.67 -40.75 4.19 0.03 95.78 0.56 0.44 3.12 94.49 1.35 0.02 0.01 0.01 72 A H H 39.27 11.86 13.95 26.52 91.71 52.50 -63.68 -40.66 7.19 0.05 92.76 0.90 0.68 5.50 89.66 3.17 0.04 0.02 0.02 73 S H H 85.64 1.68 15.84 17.61 91.19 53.44 -67.19 -26.49 20.50 0.09 79.42 1.31 1.35 17.92 76.07 3.18 0.06 0.04 0.05 74 L C T 109.02 2.88 12.91 16.74 93.20 53.83 -85.66 -2.70 73.60 0.13 26.28 1.25 3.45 68.28 23.97 2.86 0.01 0.05 0.12 75 G C T 57.21 2.19 13.22 16.51 96.03 -109.98 78.51 11.30 96.34 0.11 3.55 3.98 4.68 87.77 2.94 0.53 0.00 0.05 0.06 76 A C C 60.55 6.29 12.50 20.34 97.33 120.98 -82.35 -13.48 98.09 0.90 1.01 92.98 1.62 3.70 0.56 0.22 0.00 0.39 0.54 77 L C C 56.05 16.39 12.24 27.64 110.06 62.89 -96.98 96.93 99.62 0.36 0.02 99.59 0.15 0.03 0.01 0.00 0.00 0.18 0.05