# 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 123.37 3.85 10.48 16.09 118.33 -137.08 -94.60 139.73 99.93 0.06 0.00 99.78 0.17 0.02 0.00 0.00 0.00 0.03 0.01 1 P C C 99.60 3.15 8.99 14.08 113.95 -107.05 -68.84 148.48 99.11 0.75 0.14 98.40 0.30 0.67 0.04 0.04 0.00 0.34 0.22 2 K C C 158.19 1.80 8.35 11.83 115.01 -120.76 -88.96 136.72 90.57 8.94 0.49 82.92 6.33 1.22 0.17 0.30 0.00 4.57 4.49 3 I C C 128.19 3.34 7.79 13.15 114.80 -133.82 -92.01 130.27 85.25 14.26 0.49 79.56 5.01 0.73 0.20 0.28 0.00 9.76 4.47 4 K C C 143.53 2.56 10.52 14.67 121.15 -154.69 -107.44 142.80 82.95 16.40 0.66 76.13 5.74 0.87 0.34 0.32 0.00 10.88 5.73 5 T C C 87.25 6.22 9.60 17.63 118.75 -133.19 -97.87 140.33 83.83 14.91 1.26 74.32 7.87 1.10 0.83 0.52 0.00 9.08 6.28 6 V C C 76.62 7.14 10.87 19.55 111.44 -129.53 -91.70 117.81 90.98 6.46 2.56 85.15 4.87 1.09 2.15 0.55 0.00 3.75 2.46 7 R H H 166.44 2.59 13.21 17.16 95.79 -156.29 -67.33 -32.89 32.14 1.27 66.58 18.23 6.31 9.23 48.98 15.99 0.05 0.70 0.51 8 G H H 40.89 3.00 14.51 18.32 93.41 56.86 -65.18 -36.36 24.54 0.53 74.93 6.07 4.08 13.40 51.98 23.88 0.08 0.30 0.22 9 A H H 29.41 11.94 11.56 24.56 93.39 53.13 -69.78 -29.83 14.47 0.44 85.09 4.42 2.21 6.99 57.05 28.89 0.04 0.27 0.14 10 A H H 44.17 11.34 12.45 24.60 91.99 66.09 -63.36 -30.61 13.12 0.49 86.39 3.83 1.96 6.59 54.31 32.84 0.03 0.30 0.14 11 K H H 151.63 1.61 18.10 19.22 92.26 60.75 -73.84 -16.76 31.86 0.77 67.37 4.53 3.75 21.30 37.94 31.60 0.10 0.48 0.30 12 R C T 115.75 7.39 15.67 24.01 96.58 55.99 -91.62 -7.32 51.80 1.97 46.22 8.02 8.88 33.65 24.20 22.98 0.16 1.30 0.81 13 F E E 52.03 17.69 9.82 26.82 122.53 86.82 -102.69 141.55 38.45 59.77 1.79 30.61 7.08 1.52 1.10 0.90 0.01 55.21 3.58 14 K E E 118.38 3.47 18.54 23.08 127.20 -172.21 -125.01 147.44 10.84 88.98 0.17 10.17 0.65 0.11 0.12 0.06 0.00 88.31 0.58 15 K E E 128.01 6.55 11.77 20.19 115.13 -114.88 -82.42 133.50 5.06 94.86 0.07 4.76 0.22 0.03 0.08 0.02 0.00 83.88 11.01 16 T C C 53.12 7.10 8.76 17.75 122.96 -141.37 -89.94 171.79 88.24 11.67 0.09 88.34 0.60 0.11 0.02 0.04 0.00 9.86 1.03 17 G C T 68.70 0.46 10.43 10.14 91.84 -94.42 -63.84 -22.47 96.57 1.89 1.54 1.62 10.31 84.68 0.06 1.66 0.00 1.44 0.24 18 K C T 167.84 0.64 10.64 10.59 95.28 55.34 -89.70 2.73 98.02 0.22 1.76 0.68 7.58 89.54 0.05 1.96 0.00 0.13 0.06 19 G C S 45.41 3.52 11.76 16.77 102.59 -98.26 91.29 3.19 97.75 0.49 1.76 8.24 75.40 14.18 0.09 1.63 0.00 0.31 0.15 20 G C C 27.61 6.39 12.21 20.33 126.70 121.98 -94.59 169.01 87.63 12.22 0.15 78.21 8.74 0.60 0.05 0.10 0.00 10.78 1.51 21 F E E 80.89 11.43 11.68 24.25 125.02 -106.88 -117.39 146.02 3.01 96.97 0.02 2.93 0.14 0.01 0.02 0.01 0.00 92.83 4.06 22 K E E 102.46 6.73 16.14 24.25 125.05 -159.61 -117.97 142.20 7.10 92.83 0.07 6.82 0.32 0.04 0.06 0.02 0.00 92.29 0.44 23 H E E 90.69 10.96 12.26 24.07 121.24 -143.37 -103.91 138.80 34.59 64.79 0.62 32.08 1.73 0.26 0.46 0.20 0.00 63.56 1.70 24 K C C 113.49 5.93 13.61 21.08 118.51 -132.54 -93.20 142.69 83.32 12.44 4.24 73.61 7.34 2.04 2.96 1.31 0.00 11.33 1.40 25 H C C 108.58 6.90 11.18 19.47 114.08 -113.53 -81.56 140.04 77.46 2.42 20.11 67.29 6.04 4.57 12.18 7.49 0.00 1.50 0.93 26 A C T 70.74 4.14 11.41 17.13 104.41 -128.41 -72.57 50.17 56.86 0.87 42.28 13.35 10.85 32.16 20.46 22.12 0.06 0.42 0.57 27 N C T 103.07 3.25 11.78 16.25 99.13 45.54 -76.45 8.94 55.29 0.70 44.01 15.91 9.14 29.85 22.64 21.61 0.05 0.32 0.49 28 L H H 76.70 7.92 9.48 18.84 96.78 109.06 -74.89 -18.36 34.97 0.62 64.41 22.28 5.84 7.28 45.03 18.99 0.01 0.30 0.28 29 R H H 159.05 2.45 12.00 15.69 94.99 73.16 -67.62 -32.63 25.80 0.63 73.57 11.30 4.73 10.07 52.12 21.15 0.04 0.35 0.24 30 H H H 127.94 1.96 12.33 14.72 94.86 54.90 -71.73 -31.05 26.08 0.68 73.24 8.27 4.80 12.97 52.06 21.11 0.12 0.39 0.27 31 I H H 87.29 4.99 10.96 17.53 98.70 51.51 -81.05 -22.66 31.55 1.08 67.36 12.62 6.84 13.36 50.35 15.59 0.14 0.56 0.53 32 L H H 80.58 7.55 9.62 18.51 96.90 67.74 -74.49 -17.51 39.56 1.59 58.85 22.39 7.38 10.61 41.58 16.46 0.04 0.76 0.78 33 T C H 99.01 2.33 11.49 14.93 95.54 74.90 -73.99 -19.38 50.57 0.97 48.46 16.18 9.46 24.67 32.47 16.18 0.06 0.45 0.54 34 K C T 164.04 0.90 12.09 12.51 97.20 54.41 -88.83 -2.69 59.51 0.87 39.62 17.92 12.53 29.18 25.02 14.34 0.05 0.36 0.59 35 K C C 80.62 9.28 6.72 16.88 120.11 95.46 -87.67 146.96 84.76 0.90 14.34 45.41 34.68 4.27 12.99 1.70 0.00 0.23 0.72 36 A C C 62.93 1.74 12.49 14.49 116.87 -106.92 -68.98 155.64 88.66 0.58 10.75 83.91 2.55 1.76 10.50 0.72 0.00 0.18 0.38 37 T H H 101.68 2.37 9.76 13.78 92.23 -108.85 -60.04 -37.23 13.85 0.14 86.02 5.44 3.38 5.67 82.55 2.81 0.01 0.05 0.07 38 K H H 150.06 0.77 12.33 12.19 92.10 53.63 -65.36 -38.59 9.89 0.09 90.02 2.13 1.73 5.95 87.00 3.09 0.02 0.04 0.04 39 R H H 122.17 2.74 11.59 15.53 92.77 48.35 -67.53 -38.65 7.79 0.13 92.09 2.47 1.25 4.23 88.19 3.72 0.01 0.08 0.04 40 K H H 89.06 6.94 10.40 18.93 92.40 52.69 -64.29 -40.21 5.40 0.09 94.51 1.95 0.81 2.71 89.44 5.00 0.01 0.06 0.03 41 R H H 152.85 2.03 13.16 15.92 92.20 52.53 -66.15 -34.76 8.91 0.07 91.02 1.10 0.74 6.44 80.12 11.49 0.03 0.04 0.03 42 H H H 140.82 1.48 13.57 14.97 93.00 53.72 -73.01 -22.17 19.85 0.07 80.08 1.25 1.32 16.61 70.85 9.84 0.05 0.03 0.05 43 L H H 86.09 6.84 11.05 19.35 96.86 55.18 -87.80 -6.95 39.85 0.49 59.66 7.14 7.30 26.41 51.62 6.83 0.13 0.18 0.39 44 R C S 118.87 7.76 10.79 20.14 115.71 100.24 -83.00 138.06 97.21 1.37 1.42 46.37 48.54 2.43 0.90 0.49 0.00 0.53 0.75 45 P C C 83.09 4.36 13.34 19.15 115.51 -110.04 -69.33 152.26 95.93 2.47 1.60 75.66 16.23 4.05 0.49 1.08 0.00 2.08 0.41 46 K C C 149.75 3.66 12.81 18.36 113.64 -104.13 -80.30 135.78 83.67 14.70 1.62 67.21 13.40 2.81 0.44 1.28 0.00 13.72 1.15 47 A E E 51.53 8.46 12.49 22.42 130.07 151.83 -129.31 153.07 37.10 61.84 1.06 31.89 4.34 0.89 0.48 0.65 0.00 58.20 3.54 48 M E E 115.14 5.07 16.69 23.02 118.59 -130.43 -100.13 135.36 22.63 77.01 0.36 20.37 1.66 0.24 0.26 0.18 0.00 70.78 6.51 49 V E C 34.46 16.86 9.49 25.84 122.18 -153.58 -104.39 142.08 49.67 50.09 0.24 48.22 1.72 0.14 0.15 0.11 0.00 45.90 3.76 50 S C C 53.82 3.79 16.41 20.77 121.14 -123.25 -79.62 165.48 88.71 10.98 0.31 87.23 1.67 0.16 0.16 0.09 0.00 10.03 0.66 51 K H G 161.07 2.20 12.83 16.66 91.32 -100.49 -59.58 -33.74 20.32 0.17 79.51 1.50 2.16 16.08 23.95 56.11 0.02 0.10 0.08 52 G H G 58.72 0.95 14.83 14.58 91.41 58.39 -69.44 -21.33 19.59 0.12 80.30 0.98 1.56 16.33 22.00 58.98 0.02 0.07 0.06 53 D H G 47.80 12.30 11.56 24.57 96.89 50.94 -95.68 -4.51 16.22 0.24 83.54 3.95 2.01 9.61 23.55 60.66 0.01 0.16 0.07 54 L H H 54.73 14.33 11.73 26.24 92.84 92.34 -59.98 -42.57 1.20 0.00 98.79 0.39 0.12 0.53 98.29 0.66 0.00 0.00 0.00 55 G H H 48.08 1.53 18.51 18.76 91.91 52.17 -64.10 -39.66 0.48 0.00 99.52 0.06 0.03 0.32 99.06 0.53 0.00 0.00 0.00 56 L H H 88.22 3.56 17.37 21.36 92.22 49.86 -66.31 -40.45 0.15 0.01 99.85 0.02 0.01 0.10 99.50 0.37 0.00 0.01 0.00 57 V H H 23.54 17.30 12.59 29.93 92.55 50.40 -65.23 -42.40 0.13 0.00 99.86 0.01 0.01 0.10 99.61 0.27 0.00 0.00 0.00 58 I H H 83.38 8.67 15.41 24.98 91.71 52.35 -63.91 -37.61 1.01 0.00 98.98 0.05 0.04 0.94 98.16 0.82 0.00 0.00 0.00 59 A H H 83.04 1.42 17.15 17.74 91.36 56.44 -68.37 -25.38 19.69 0.01 80.31 0.12 0.21 21.27 77.18 1.21 0.01 0.00 0.00 60 C H H 68.65 6.91 13.58 21.83 96.44 50.39 -90.87 -8.85 48.29 0.02 51.68 0.49 1.08 47.06 49.76 1.59 0.01 0.01 0.02 61 L C C 48.60 14.72 7.83 22.20 114.97 96.91 -83.01 133.18 96.21 1.24 2.54 47.31 46.22 2.63 0.99 1.35 0.00 0.38 1.12 62 P C T 98.54 2.79 13.00 16.92 98.47 -133.18 -65.66 -21.97 93.99 0.97 5.04 23.77 16.40 53.87 0.77 4.24 0.00 0.54 0.40 63 Y C T 169.62 2.47 10.76 14.53 103.38 45.29 -95.34 22.46 91.87 2.03 6.10 38.69 5.17 48.77 1.20 4.15 0.00 1.34 0.67 64 A C C 58.68 9.18 10.56 20.62 108.74 141.73 -80.14 121.88 99.72 0.22 0.06 99.56 0.17 0.09 0.02 0.01 0.00 0.12 0.03