# 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 93.72 7.49 13.83 22.27 105.05 1.79 -80.93 70.66 99.86 0.03 0.11 99.79 0.06 0.06 0.07 0.00 0.00 0.01 0.01 1 E H H 101.51 6.88 11.56 19.66 96.71 111.11 -69.13 -33.83 45.09 0.53 54.39 38.91 0.82 5.25 53.19 1.38 0.00 0.18 0.27 2 L H H 114.52 2.24 12.57 15.40 93.33 58.90 -65.45 -38.93 14.31 0.11 85.57 6.47 1.93 5.79 83.84 1.87 0.00 0.05 0.06 3 L H H 100.54 2.59 14.45 17.37 92.42 51.50 -65.93 -39.73 5.36 0.05 94.59 2.36 0.65 2.27 92.87 1.81 0.00 0.02 0.01 4 M H H 61.53 9.95 13.08 24.19 92.22 50.78 -65.97 -40.06 1.89 0.02 98.09 0.80 0.23 0.84 96.81 1.30 0.00 0.01 0.00 5 I H H 68.15 8.52 15.13 24.81 92.04 51.29 -64.52 -40.95 0.82 0.01 99.17 0.28 0.08 0.39 98.88 0.36 0.00 0.00 0.00 6 V H H 87.97 2.22 19.80 21.01 91.99 49.66 -64.70 -42.06 0.51 0.01 99.48 0.13 0.04 0.27 99.40 0.16 0.00 0.00 0.00 7 V H H 62.80 6.54 19.02 26.13 91.85 48.84 -64.64 -42.02 0.48 0.00 99.52 0.10 0.04 0.27 99.49 0.09 0.00 0.00 0.00 8 I H H 36.37 14.65 16.64 31.86 91.51 49.65 -63.92 -41.90 0.28 0.00 99.72 0.05 0.02 0.15 99.74 0.04 0.00 0.00 0.00 9 G H H 30.37 6.28 20.00 27.03 91.49 51.35 -63.08 -41.76 0.14 0.00 99.86 0.02 0.00 0.08 99.88 0.02 0.00 0.00 0.00 10 C H H 69.23 3.41 22.42 25.33 91.53 49.68 -64.40 -41.95 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 11 L H H 45.75 13.59 19.26 33.04 91.78 49.66 -64.49 -42.08 0.05 0.00 99.95 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 12 F H H 67.79 13.73 19.91 33.32 91.48 49.68 -63.62 -41.76 0.07 0.00 99.93 0.00 0.00 0.05 99.93 0.02 0.00 0.00 0.00 13 A H H 56.99 3.76 23.58 26.63 91.29 50.34 -63.68 -42.11 0.14 0.00 99.86 0.01 0.00 0.10 99.85 0.03 0.00 0.00 0.00 14 A H H 41.06 7.37 21.87 29.71 91.52 49.85 -64.42 -42.00 0.34 0.00 99.66 0.02 0.01 0.25 99.62 0.10 0.00 0.00 0.00 15 A H H 15.69 17.13 16.72 34.35 91.51 51.57 -63.50 -41.82 0.93 0.00 99.07 0.08 0.04 0.67 98.76 0.45 0.00 0.00 0.00 16 T H H 60.69 7.03 21.06 28.56 91.30 51.09 -63.85 -41.32 2.35 0.01 97.64 0.23 0.14 1.79 96.20 1.63 0.00 0.00 0.00 17 Y H H 125.78 3.17 21.83 24.53 91.63 50.34 -64.83 -40.28 5.23 0.03 94.74 0.78 0.43 3.79 91.08 3.88 0.01 0.01 0.01 18 L H H 37.53 14.34 15.00 30.02 91.83 52.00 -66.16 -35.90 11.26 0.08 88.66 2.45 1.07 7.45 81.19 7.74 0.02 0.05 0.04 19 L H H 69.38 12.29 15.22 27.84 92.04 56.32 -69.03 -27.58 26.23 0.18 73.58 5.78 2.46 17.69 67.46 6.38 0.04 0.09 0.11 20 L H H 119.27 2.58 17.71 19.96 94.70 53.37 -83.87 -14.22 48.32 0.41 51.27 12.69 7.27 28.81 45.85 4.89 0.04 0.16 0.28 21 S C C 45.60 9.17 11.10 21.64 115.15 89.50 -86.09 136.39 85.84 0.77 13.39 57.20 14.79 12.72 12.59 1.86 0.00 0.27 0.56 22 K C C 151.52 3.58 14.14 19.47 100.45 -152.10 -86.89 13.52 93.93 0.83 5.25 59.37 24.40 10.05 3.87 1.43 0.00 0.34 0.53 23 S C C 47.92 5.79 13.55 21.06 119.82 119.45 -92.83 146.40 92.02 2.09 5.89 58.71 30.31 2.43 5.51 0.73 0.00 0.45 1.86 24 L H H 110.15 4.53 14.71 20.67 92.44 -123.32 -61.13 -35.81 8.92 0.05 91.02 1.80 2.32 4.71 90.40 0.71 0.01 0.02 0.03 25 L H H 96.37 4.34 17.01 22.26 91.67 55.03 -64.13 -40.84 3.35 0.02 96.62 0.78 0.45 1.89 96.33 0.53 0.00 0.01 0.00 26 R H H 73.57 12.77 16.34 29.35 91.90 49.02 -65.74 -39.71 0.73 0.01 99.26 0.23 0.08 0.34 98.97 0.37 0.00 0.00 0.00 27 I H H 52.51 13.75 17.67 31.49 91.66 52.15 -63.29 -42.33 0.25 0.00 99.74 0.06 0.02 0.12 99.66 0.14 0.00 0.00 0.00 28 I H H 81.67 6.57 23.20 29.63 91.86 49.62 -63.96 -42.25 0.21 0.00 99.79 0.03 0.01 0.11 99.77 0.08 0.00 0.00 0.00 29 I H H 60.90 10.45 22.98 33.57 91.82 48.90 -64.42 -42.10 0.20 0.00 99.80 0.02 0.01 0.11 99.81 0.04 0.00 0.00 0.00 30 G H H 8.26 17.96 19.46 37.63 91.26 51.61 -63.15 -42.42 0.30 0.00 99.70 0.03 0.01 0.18 99.72 0.06 0.00 0.00 0.00 31 T H H 52.57 9.45 25.26 34.94 91.72 49.70 -64.08 -41.47 0.26 0.00 99.74 0.02 0.01 0.17 99.74 0.06 0.00 0.00 0.00 32 G H H 21.75 10.84 23.82 35.01 91.88 51.37 -63.92 -41.94 0.48 0.00 99.52 0.04 0.02 0.33 99.51 0.10 0.00 0.00 0.00 33 L H H 36.26 16.78 22.90 38.96 91.79 49.07 -64.76 -42.25 0.72 0.00 99.28 0.06 0.03 0.51 99.27 0.12 0.00 0.00 0.00 34 L H H 58.33 13.13 24.78 37.36 91.76 49.58 -64.30 -41.87 0.70 0.00 99.30 0.08 0.04 0.46 99.30 0.12 0.00 0.00 0.00 35 S H H 42.57 9.01 25.53 34.62 91.84 50.45 -64.61 -41.63 0.81 0.00 99.19 0.08 0.04 0.56 99.20 0.12 0.00 0.00 0.00 36 H H H 51.18 14.33 23.97 37.79 91.96 49.72 -65.11 -41.72 0.50 0.00 99.50 0.04 0.03 0.35 99.47 0.11 0.00 0.00 0.00 37 G H H 12.06 16.40 21.40 37.70 91.49 52.05 -62.52 -42.06 0.33 0.00 99.67 0.03 0.02 0.22 99.64 0.09 0.00 0.00 0.00 38 A H H 43.88 7.79 25.27 33.50 91.65 50.58 -63.94 -41.66 0.19 0.00 99.80 0.02 0.01 0.13 99.77 0.07 0.00 0.00 0.00 39 H H H 66.66 11.08 24.10 35.09 91.80 50.70 -64.41 -41.96 0.17 0.00 99.83 0.01 0.01 0.12 99.78 0.08 0.00 0.00 0.00 40 L H H 38.33 16.52 21.58 37.46 91.71 50.60 -64.07 -42.12 0.16 0.00 99.84 0.01 0.00 0.11 99.79 0.08 0.00 0.00 0.00 41 L H H 62.71 11.77 23.08 34.63 91.31 50.56 -63.09 -41.96 0.28 0.00 99.72 0.02 0.01 0.20 99.63 0.15 0.00 0.00 0.00 42 L H H 74.20 8.13 23.85 31.98 91.70 50.08 -64.30 -41.87 0.55 0.00 99.45 0.03 0.02 0.42 99.18 0.34 0.00 0.00 0.00 43 L H H 56.70 12.31 21.63 33.77 92.01 49.58 -65.56 -41.23 1.62 0.00 98.37 0.09 0.07 1.39 97.45 0.99 0.00 0.00 0.00 44 T H H 37.87 14.60 19.92 34.35 92.42 48.95 -65.48 -40.36 7.08 0.01 92.90 0.29 0.32 6.53 91.03 1.82 0.01 0.01 0.01 45 M H H 75.76 9.28 21.67 30.91 92.92 48.11 -68.83 -34.40 17.80 0.10 82.10 1.74 1.94 14.11 76.86 5.16 0.08 0.04 0.07 46 G H H 24.75 9.61 18.40 28.74 93.19 63.67 -64.83 -34.46 34.03 0.33 65.64 4.59 3.91 24.28 52.37 14.32 0.13 0.16 0.23 47 G H H 26.05 10.85 16.97 28.49 94.90 51.59 -68.62 -25.55 44.25 0.54 55.21 7.78 5.50 29.30 40.20 16.46 0.11 0.26 0.39 48 L H H 74.31 11.02 14.89 26.24 95.82 64.82 -72.92 -28.09 47.79 2.07 50.14 18.27 11.49 19.57 33.64 14.65 0.20 0.94 1.24 49 K C H 136.48 4.03 15.56 20.66 100.57 61.17 -81.39 -9.18 56.91 3.00 40.09 21.67 14.22 23.15 26.95 10.68 0.20 1.31 1.81 50 A C T 77.25 3.80 13.85 18.88 101.58 50.69 -83.43 4.39 79.76 0.97 19.27 13.61 17.28 48.78 11.58 7.52 0.02 0.45 0.76 51 G C T 54.38 3.44 14.40 19.03 103.22 -92.34 84.47 5.07 95.74 0.72 3.54 24.76 24.92 46.35 1.01 2.24 0.00 0.35 0.38 52 A C C 50.26 7.48 12.98 22.19 119.69 131.67 -90.94 142.44 97.20 2.55 0.26 65.03 31.55 0.69 0.10 0.14 0.00 0.81 1.67 53 P C C 71.78 6.83 15.50 23.61 115.36 -103.82 -67.27 149.51 98.41 1.12 0.47 90.77 6.60 1.08 0.14 0.27 0.00 0.53 0.61 54 P C C 63.51 11.38 12.56 24.53 109.32 -104.63 -67.31 142.27 91.42 2.61 5.96 57.61 17.78 15.56 1.23 5.07 0.00 1.19 1.56 55 L C C 99.90 6.41 12.77 20.51 107.89 -136.77 -88.76 91.14 81.17 9.73 9.11 38.26 23.08 20.53 2.41 6.23 0.04 4.29 5.17 56 L C C 104.49 5.42 11.12 17.99 110.66 86.28 -94.27 109.30 81.15 6.65 12.20 35.22 25.07 21.60 3.37 8.14 0.03 3.06 3.51 57 G C C 49.77 2.78 12.80 16.66 113.21 1.39 82.09 -142.82 80.73 2.22 17.04 34.92 24.46 22.17 5.29 10.82 0.01 0.94 1.39 58 E C T 135.62 2.87 12.14 15.99 98.68 1.45 -75.35 -23.47 66.15 1.10 32.75 17.89 17.99 31.12 13.61 18.01 0.03 0.47 0.88 59 K C T 132.42 3.30 13.36 17.79 98.99 55.40 -74.07 3.17 61.21 1.31 37.47 23.60 12.41 25.96 16.41 20.08 0.03 0.59 0.92 60 A H G 46.33 10.39 9.70 20.90 96.32 81.00 -70.04 -23.05 47.90 1.24 50.86 28.18 8.20 11.79 19.05 31.57 0.01 0.62 0.58 61 S H G 71.80 4.80 13.64 19.81 95.74 67.22 -72.63 -19.11 47.30 1.61 51.09 24.89 8.48 14.42 17.03 33.62 0.01 0.86 0.68 62 R C G 154.49 3.21 15.25 19.32 98.31 60.42 -84.37 -11.14 50.68 2.58 46.75 25.41 10.74 15.61 14.24 31.54 0.03 1.39 1.04 63 Y C C 103.36 10.26 12.39 23.35 108.82 66.64 -98.15 88.52 70.05 4.47 25.48 46.52 12.87 10.53 10.19 15.28 0.01 2.17 2.43 64 V C C 72.22 10.56 13.67 24.94 116.72 146.43 -103.31 128.87 89.26 3.81 6.93 66.27 17.70 4.80 4.51 2.42 0.00 1.45 2.84 65 D C C 58.78 9.49 14.71 25.45 110.71 -149.36 -100.37 113.39 97.74 0.73 1.54 80.88 15.45 1.30 1.32 0.32 0.00 0.25 0.47 66 P H H 79.73 6.85 15.67 24.07 93.06 -153.06 -63.38 -29.19 39.13 0.28 60.59 16.35 11.36 9.93 61.06 1.05 0.01 0.08 0.16 67 L H H 94.39 4.64 18.90 23.76 92.29 58.02 -64.62 -40.25 6.20 0.02 93.77 1.80 1.05 3.08 93.38 0.65 0.00 0.01 0.01 68 P H H 28.13 12.62 16.04 29.81 92.11 50.42 -64.51 -40.33 2.96 0.03 97.01 1.12 0.31 1.42 96.30 0.82 0.00 0.01 0.01 69 Q H H 62.22 11.97 18.16 30.47 92.01 51.64 -64.03 -40.90 0.79 0.01 99.20 0.27 0.08 0.38 98.72 0.55 0.00 0.00 0.00 70 A H H 48.30 5.51 20.93 26.61 91.66 51.18 -63.55 -41.33 0.30 0.00 99.70 0.07 0.02 0.16 99.60 0.15 0.00 0.00 0.00 71 L H H 71.71 8.35 20.92 29.56 91.91 50.37 -64.66 -41.16 0.16 0.00 99.84 0.02 0.01 0.10 99.81 0.06 0.00 0.00 0.00 72 I H H 42.01 15.10 18.31 33.43 91.78 49.87 -64.59 -41.89 0.07 0.00 99.93 0.01 0.00 0.04 99.92 0.03 0.00 0.00 0.00 73 L H H 74.71 7.98 22.12 30.45 91.65 49.80 -63.76 -41.99 0.07 0.00 99.93 0.00 0.00 0.04 99.93 0.02 0.00 0.00 0.00 74 T H H 60.17 6.08 22.47 28.36 91.87 49.70 -63.94 -41.99 0.08 0.00 99.92 0.01 0.00 0.05 99.92 0.02 0.00 0.00 0.00 75 A H H 26.17 12.79 19.24 32.58 91.70 50.48 -63.99 -41.94 0.12 0.00 99.88 0.01 0.00 0.08 99.89 0.02 0.00 0.00 0.00 76 I H H 58.50 12.23 20.58 32.66 91.76 49.05 -64.39 -42.11 0.22 0.00 99.78 0.01 0.01 0.16 99.79 0.04 0.00 0.00 0.00 77 V H H 72.16 5.65 23.19 28.68 91.80 48.80 -64.84 -42.60 0.45 0.00 99.54 0.02 0.02 0.35 99.55 0.06 0.00 0.00 0.00 78 I H H 70.60 7.97 22.38 30.20 91.95 48.24 -64.99 -42.17 0.96 0.00 99.03 0.06 0.04 0.75 99.07 0.08 0.00 0.00 0.00 79 S H H 23.64 14.59 19.18 33.98 91.80 50.68 -64.39 -41.88 0.97 0.00 99.03 0.09 0.04 0.66 99.13 0.07 0.00 0.00 0.00 80 F H H 93.05 8.23 22.73 31.19 91.76 49.57 -64.31 -41.65 0.21 0.00 99.79 0.02 0.01 0.13 99.81 0.04 0.00 0.00 0.00 81 G H H 30.19 6.01 22.23 28.24 91.60 50.63 -64.26 -42.13 0.12 0.00 99.88 0.01 0.00 0.07 99.88 0.03 0.00 0.00 0.00 82 V H H 47.23 10.61 21.54 32.17 91.98 49.04 -64.61 -42.30 0.11 0.00 99.89 0.01 0.00 0.07 99.89 0.03 0.00 0.00 0.00 83 T H H 38.24 12.49 20.15 32.58 91.74 51.05 -63.44 -42.14 0.12 0.00 99.88 0.01 0.00 0.07 99.89 0.02 0.00 0.00 0.00 84 A H H 45.82 6.29 21.19 27.88 91.37 50.78 -63.63 -41.87 0.21 0.00 99.79 0.01 0.00 0.15 99.80 0.03 0.00 0.00 0.00 85 F H H 97.88 6.11 21.75 27.55 91.71 49.84 -63.67 -42.47 0.21 0.00 99.79 0.01 0.01 0.15 99.80 0.03 0.00 0.00 0.00 86 F H H 70.97 11.51 19.51 31.12 91.85 50.47 -64.00 -42.00 0.15 0.00 99.85 0.01 0.00 0.10 99.85 0.03 0.00 0.00 0.00 87 L H H 67.81 9.31 19.82 29.47 91.95 50.31 -64.15 -41.73 0.15 0.00 99.85 0.01 0.00 0.10 99.86 0.03 0.00 0.00 0.00 88 V H H 69.30 5.01 21.40 26.08 91.64 49.31 -63.89 -42.50 0.14 0.00 99.86 0.01 0.00 0.09 99.87 0.03 0.00 0.00 0.00 89 L H H 64.01 7.72 20.37 28.55 91.68 49.28 -64.46 -41.86 0.13 0.00 99.87 0.01 0.00 0.08 99.87 0.03 0.00 0.00 0.00 90 A H H 28.70 12.30 17.69 30.56 91.60 51.37 -63.76 -41.97 0.19 0.00 99.81 0.01 0.01 0.12 99.83 0.04 0.00 0.00 0.00 91 Y H H 105.59 6.03 20.38 26.64 91.83 49.68 -64.55 -41.55 0.20 0.00 99.80 0.01 0.01 0.13 99.81 0.04 0.00 0.00 0.00 92 R H H 110.26 4.05 20.66 24.20 91.70 50.06 -64.14 -41.51 0.31 0.00 99.69 0.02 0.01 0.21 99.69 0.06 0.00 0.00 0.00 93 S H H 25.95 9.28 15.89 27.02 91.86 51.01 -63.96 -41.82 0.61 0.00 99.39 0.05 0.03 0.43 99.37 0.11 0.00 0.00 0.00 94 Y H H 80.09 9.94 14.24 25.12 92.20 50.14 -64.54 -40.92 0.49 0.00 99.51 0.05 0.04 0.32 99.42 0.17 0.00 0.00 0.00 95 Q H H 123.63 2.26 16.06 18.53 92.79 48.24 -66.65 -38.96 0.86 0.00 99.14 0.06 0.04 0.67 98.93 0.30 0.00 0.00 0.00 96 E H H 127.83 2.44 15.57 18.19 95.29 42.94 -73.49 -37.82 2.69 0.00 97.31 0.09 0.16 2.33 97.13 0.27 0.00 0.00 0.00 97 I H H 86.22 6.31 12.77 20.37 99.52 31.47 -99.86 -11.94 11.89 0.04 88.07 0.82 2.14 8.67 87.98 0.34 0.02 0.01 0.02 98 G C C 52.31 2.59 15.46 18.77 97.92 -119.63 74.63 20.09 98.68 0.24 1.09 56.12 11.66 31.02 0.40 0.57 0.00 0.11 0.13 99 T C C 45.34 10.26 11.08 22.66 129.07 127.73 -124.23 153.83 95.32 1.71 2.96 75.70 14.42 4.86 1.28 1.59 0.00 0.61 1.54 100 D C S 106.15 4.39 15.15 20.97 97.78 -151.61 -92.58 -2.13 96.54 0.67 2.79 34.21 53.11 9.54 1.18 1.27 0.00 0.26 0.43 101 H C C 100.34 4.96 16.23 22.37 106.81 95.42 -97.77 96.34 94.08 0.86 5.06 71.40 14.08 8.56 3.06 1.78 0.00 0.31 0.81 102 M H H 64.04 14.06 10.66 24.90 94.51 169.38 -64.77 -34.87 24.11 0.30 75.59 10.36 3.94 9.27 51.69 24.45 0.01 0.15 0.14 103 E H H 132.42 2.17 15.65 18.56 91.83 58.38 -64.53 -37.58 16.36 0.12 83.52 2.61 1.84 9.91 56.47 29.05 0.02 0.06 0.05 104 G H H 40.80 3.28 14.44 18.75 92.73 52.27 -68.43 -31.26 14.51 0.16 85.34 3.01 1.84 7.93 57.69 29.36 0.02 0.09 0.05 105 M H H 65.32 11.79 10.42 22.66 95.42 54.36 -76.06 -24.08 23.45 0.49 76.05 7.15 4.65 11.39 57.70 18.58 0.06 0.25 0.23 106 K C H 120.32 5.87 11.53 18.79 102.59 65.37 -86.83 4.02 55.81 1.55 42.64 15.90 11.36 30.28 34.98 5.76 0.11 0.62 0.98 107 G C C 49.92 3.24 10.84 15.73 114.54 96.45 53.91 176.36 93.87 0.39 5.74 54.01 3.25 37.30 3.86 1.17 0.00 0.18 0.24 108 D C C 121.62 1.76 12.92 15.58 105.72 -65.12 -84.59 85.67 99.97 0.02 0.01 99.87 0.07 0.04 0.00 0.00 0.00 0.01 0.00