# 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 112.51 4.90 10.25 16.75 113.57 -158.23 -93.18 124.39 99.53 0.24 0.23 99.39 0.16 0.13 0.13 0.02 0.00 0.11 0.06 1 L C C 119.15 2.46 8.52 12.44 104.31 -138.70 -81.73 24.23 58.97 2.47 38.56 49.17 1.92 8.97 30.25 7.19 0.00 1.26 1.24 2 Q H H 132.60 1.95 8.10 11.41 100.88 71.41 -79.98 -3.40 46.99 1.99 51.02 24.14 8.92 14.75 36.62 13.61 0.04 1.14 0.78 3 S H H 75.23 2.61 8.20 12.34 105.38 93.24 -83.77 35.44 39.62 1.93 58.45 22.50 6.78 10.48 40.94 17.42 0.04 1.22 0.61 4 L H H 119.14 2.05 8.52 11.88 102.45 77.61 -79.49 -11.30 33.09 2.10 64.81 17.95 6.65 9.41 48.03 15.91 0.06 1.41 0.59 5 I H H 110.15 3.09 8.17 12.98 107.49 67.18 -87.38 89.77 33.61 3.50 62.89 20.55 6.67 8.46 48.43 12.50 0.07 2.31 1.01 6 K H H 141.71 2.37 9.29 13.17 104.60 54.14 -80.53 46.06 40.70 2.67 56.63 21.74 7.04 12.92 44.60 11.02 0.07 1.81 0.80 7 K C H 147.49 2.00 9.30 12.51 103.99 53.79 -85.35 32.03 51.78 2.52 45.69 20.85 9.43 21.89 33.71 11.52 0.11 1.61 0.87 8 V C C 105.00 2.59 8.07 12.31 102.16 79.71 -88.14 -10.62 61.84 5.55 32.61 31.69 12.65 18.05 24.13 8.21 0.11 3.37 1.79 9 W C C 185.68 2.21 8.14 11.87 106.41 65.68 -90.73 44.09 74.70 8.87 16.43 45.41 17.62 11.53 11.52 5.39 0.07 5.25 3.21 10 I C C 110.77 3.19 8.62 13.71 115.35 123.88 -96.79 129.82 88.24 7.85 3.91 54.67 31.10 3.18 2.29 1.62 0.01 4.88 2.25 11 P C C 97.88 2.82 9.76 14.28 112.37 -110.81 -69.40 142.60 89.07 6.64 4.29 75.69 8.33 4.96 1.86 2.36 0.00 4.98 1.82 12 M C C 129.37 3.33 8.17 13.46 111.26 -137.92 -90.03 123.81 90.75 5.39 3.86 72.70 13.51 3.71 1.98 1.96 0.00 2.37 3.78 13 K C C 131.52 2.66 9.38 13.72 118.54 -143.51 -98.10 142.76 95.04 1.19 3.77 72.76 19.86 2.41 2.41 1.23 0.00 0.48 0.86 14 P C T 101.91 2.44 9.62 13.36 101.61 -99.09 -66.48 -24.00 59.92 0.61 39.47 13.89 8.38 36.98 16.01 23.98 0.01 0.30 0.44 15 Y C T 170.13 1.92 9.82 12.85 99.46 50.64 -81.60 -8.03 55.26 0.85 43.89 11.23 7.82 34.72 20.67 24.48 0.04 0.43 0.61 16 Y C C 128.28 4.49 9.41 15.66 106.25 68.62 -91.91 37.09 50.29 2.55 47.15 28.36 11.10 11.25 25.75 21.04 0.04 1.20 1.27 17 T H H 70.56 4.44 10.65 16.78 106.35 90.41 -81.09 118.28 48.60 2.07 49.33 30.32 11.71 8.32 42.81 5.03 0.03 0.92 0.87 18 Q H H 119.31 2.22 12.81 15.62 95.05 -113.63 -67.22 -37.09 17.75 0.55 81.71 6.41 4.85 8.32 76.71 3.10 0.10 0.28 0.22 19 A H H 60.78 2.56 12.63 16.02 93.40 51.78 -65.76 -40.19 11.82 0.30 87.88 3.27 2.21 7.22 83.92 3.00 0.09 0.18 0.11 20 Y H H 116.94 3.61 12.53 17.45 93.20 49.48 -67.50 -39.45 7.39 0.30 92.31 2.86 1.26 3.98 88.81 2.75 0.04 0.22 0.08 21 Q H H 94.57 3.43 13.59 18.13 92.45 52.27 -65.10 -40.52 3.28 0.16 96.56 1.06 0.47 1.95 94.55 1.81 0.02 0.12 0.03 22 E H H 113.79 2.23 14.68 17.09 93.01 50.22 -66.02 -39.99 4.29 0.21 95.51 0.91 0.52 3.17 93.51 1.65 0.04 0.14 0.05 23 I H H 96.08 2.62 14.48 17.43 93.21 48.48 -68.22 -41.13 5.74 0.31 93.95 0.92 0.66 4.55 92.45 1.04 0.08 0.20 0.09 24 W H H 142.35 2.60 14.67 17.73 93.44 48.85 -66.19 -41.58 7.71 0.50 91.80 1.33 0.99 5.78 90.49 0.84 0.13 0.29 0.15 25 V H H 81.75 2.42 15.11 17.82 92.69 48.82 -65.47 -41.43 7.60 0.15 92.24 0.86 0.67 6.10 91.59 0.60 0.04 0.09 0.05 26 G H H 33.75 3.04 14.70 18.69 92.24 50.73 -64.32 -41.85 2.61 0.02 97.36 0.72 0.30 1.43 97.18 0.33 0.00 0.01 0.01 27 T H H 74.10 2.50 15.65 18.35 92.24 49.25 -65.49 -40.90 0.51 0.00 99.49 0.10 0.04 0.28 99.44 0.14 0.00 0.00 0.00 28 G H H 36.02 2.77 15.09 18.54 92.18 50.94 -64.40 -40.97 0.51 0.00 99.49 0.08 0.03 0.31 99.46 0.12 0.00 0.00 0.00 29 L H H 93.37 2.33 15.46 17.88 92.38 49.62 -65.55 -40.78 0.40 0.00 99.60 0.05 0.02 0.24 99.61 0.08 0.00 0.00 0.00 30 M H H 101.85 2.33 15.40 17.84 92.15 50.30 -64.89 -40.80 0.23 0.00 99.77 0.04 0.01 0.12 99.80 0.03 0.00 0.00 0.00 31 A H H 56.69 2.43 14.82 17.71 91.98 51.19 -64.22 -41.20 0.24 0.00 99.76 0.03 0.01 0.14 99.79 0.03 0.00 0.00 0.00 32 Y H H 130.02 1.99 15.20 17.11 92.17 50.06 -64.78 -41.48 0.11 0.00 99.89 0.01 0.00 0.07 99.91 0.02 0.00 0.00 0.00 33 I H H 90.71 2.23 14.98 17.32 91.90 49.82 -64.44 -42.20 0.08 0.00 99.92 0.01 0.00 0.05 99.92 0.02 0.00 0.00 0.00 34 V H H 80.58 2.09 14.77 16.97 91.83 49.65 -63.94 -42.39 0.15 0.00 99.85 0.01 0.01 0.10 99.84 0.04 0.00 0.00 0.00 35 Y H H 126.70 2.05 14.41 16.65 92.13 49.21 -65.02 -41.27 0.45 0.00 99.55 0.04 0.02 0.33 99.50 0.11 0.00 0.00 0.00 36 K H H 118.34 2.10 14.12 16.55 92.40 50.37 -65.32 -40.06 1.66 0.01 98.33 0.14 0.09 1.30 98.13 0.33 0.00 0.00 0.00 37 I H H 100.55 2.16 13.65 16.11 92.97 48.99 -66.44 -39.91 5.39 0.06 94.55 0.72 0.50 3.99 93.86 0.87 0.01 0.03 0.02 38 R H H 151.30 1.66 13.72 15.42 93.19 51.30 -67.68 -35.83 17.91 0.22 81.87 2.90 2.04 12.72 80.65 1.43 0.04 0.10 0.10 39 S H H 68.12 2.42 12.59 15.76 96.97 48.82 -79.41 -22.90 43.74 0.98 55.28 11.55 6.54 26.07 52.38 2.49 0.07 0.44 0.48 40 A C H 61.98 3.57 10.99 16.06 100.33 71.11 -73.03 -25.56 55.64 1.30 43.06 20.94 14.80 19.88 39.96 3.22 0.05 0.55 0.60 41 D C H 87.61 2.84 12.21 16.05 101.15 58.07 -74.72 -13.76 53.80 0.82 45.38 29.62 8.28 15.42 42.55 3.38 0.01 0.36 0.38 42 K H H 136.44 2.06 12.21 15.11 94.76 57.15 -66.36 -35.50 23.89 0.44 75.67 12.47 4.59 7.99 70.01 4.52 0.02 0.22 0.18 43 R H H 155.45 1.41 13.42 14.66 92.78 53.58 -65.89 -38.92 15.63 0.40 83.97 7.80 2.79 6.06 78.07 4.90 0.02 0.24 0.13 44 S H H 56.97 2.66 12.48 16.24 92.77 51.58 -66.03 -39.57 11.13 0.32 88.56 6.02 1.80 4.08 82.51 5.29 0.01 0.21 0.09 45 K H H 124.88 1.87 13.05 15.30 92.86 51.36 -66.18 -39.20 7.98 0.24 91.78 3.46 1.34 3.64 85.81 5.50 0.02 0.17 0.06 46 A H H 63.33 1.80 12.60 14.69 92.78 51.93 -65.41 -39.68 9.75 0.28 89.97 3.68 1.51 4.98 84.15 5.38 0.03 0.19 0.08 47 L H H 108.31 1.63 12.09 13.93 93.86 50.43 -68.61 -36.61 15.66 0.45 83.89 5.99 2.74 7.98 77.51 5.31 0.05 0.26 0.17 48 K H H 138.61 1.90 11.14 13.88 95.21 55.79 -70.25 -31.58 25.59 0.70 73.71 10.09 4.78 12.38 67.41 4.60 0.06 0.35 0.32 49 A H H 79.85 1.88 10.16 13.02 96.94 59.50 -73.70 -23.13 39.69 1.05 59.27 16.41 7.22 17.81 51.90 5.57 0.07 0.51 0.51 50 S C H 91.55 1.12 9.80 11.23 99.98 57.78 -83.67 -6.79 57.02 1.74 41.25 21.76 11.98 24.75 33.97 5.79 0.08 0.79 0.88 51 S C C 83.25 2.00 9.05 12.50 112.38 80.26 -92.62 125.32 77.18 2.61 20.21 30.25 26.62 20.97 14.89 4.77 0.03 1.16 1.31 52 A C C 89.09 1.82 8.77 12.11 111.83 -121.13 -82.77 133.06 89.09 5.38 5.54 60.03 20.71 8.41 2.93 2.52 0.00 2.99 2.42 53 A C C 78.21 2.66 8.18 12.80 118.52 -136.27 -95.22 146.09 91.55 7.64 0.81 69.56 21.11 1.14 0.41 0.41 0.00 4.76 2.61 54 P C C 102.97 2.19 8.82 12.67 113.58 -103.10 -68.07 147.30 84.74 10.78 4.48 73.76 6.18 4.26 1.57 2.85 0.00 6.34 5.05 55 A C C 90.96 1.76 7.13 10.51 107.38 -126.60 -82.68 119.73 82.90 4.27 12.83 38.67 22.18 22.10 2.17 10.78 0.00 2.18 1.91 56 H C T 163.45 0.92 7.47 9.21 109.06 1.04 -93.69 103.48 81.87 4.03 14.09 27.98 24.71 29.71 1.91 11.96 0.01 2.05 1.68 57 G C C 58.73 1.54 7.29 10.26 112.12 -13.29 32.92 155.02 83.72 4.40 11.88 42.23 22.62 18.87 1.65 10.48 0.00 2.26 1.88 58 H C C 157.52 1.33 6.88 9.53 108.88 -110.99 -91.35 96.06 90.76 3.70 5.55 77.21 5.33 8.51 1.31 3.70 0.00 2.13 1.81 59 H C C 145.45 2.46 8.82 13.02 108.29 -164.05 -91.07 97.43 99.52 0.32 0.16 98.80 0.48 0.37 0.04 0.05 0.00 0.16 0.10