# 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 138.18 2.50 8.66 13.02 115.06 -154.63 -94.83 134.15 99.92 0.07 0.01 99.86 0.07 0.02 0.01 0.00 0.00 0.03 0.01 1 K C C 161.71 1.28 7.49 10.27 116.84 -150.53 -99.68 133.96 94.07 4.16 1.76 92.27 0.91 1.45 0.73 0.55 0.00 2.04 2.05 2 R C C 177.38 1.69 6.55 10.10 115.21 -141.01 -95.10 129.69 91.49 4.80 3.70 76.97 9.02 5.21 1.05 2.72 0.00 3.06 1.97 3 T C C 108.16 1.63 7.52 10.70 111.84 -160.45 -95.45 123.38 92.72 3.56 3.73 62.12 21.04 9.43 0.87 3.07 0.00 2.19 1.28 4 F C C 152.10 2.52 7.29 11.72 115.67 -129.69 -101.98 128.54 92.60 3.58 3.83 60.79 24.74 6.83 1.29 2.56 0.00 1.62 2.18 5 Q C C 126.04 2.37 8.88 13.13 116.66 -160.92 -104.71 128.43 96.74 1.14 2.12 80.94 14.43 1.31 1.60 0.53 0.00 0.45 0.73 6 P C C 91.52 3.63 9.00 14.60 108.59 -113.12 -66.20 146.63 80.80 0.81 18.39 55.57 8.44 16.20 14.86 4.07 0.00 0.40 0.45 7 S C C 68.49 3.55 9.86 14.94 111.75 -113.39 -86.34 134.08 75.34 0.99 23.68 51.43 8.45 14.35 20.88 3.88 0.00 0.43 0.56 8 T H H 86.49 3.47 10.38 15.28 97.00 -135.62 -75.74 -25.97 39.27 1.00 59.73 26.80 9.14 4.34 56.71 2.20 0.01 0.37 0.44 9 L H H 104.29 2.48 11.39 14.89 93.69 63.62 -65.69 -40.31 10.72 0.27 89.00 6.32 1.92 2.99 86.62 1.93 0.01 0.14 0.07 10 K H H 124.39 1.79 13.26 15.23 93.13 50.68 -66.06 -40.26 6.72 0.29 92.99 3.76 1.05 2.41 90.22 2.29 0.02 0.20 0.06 11 R H H 114.59 4.02 12.46 17.98 92.95 50.93 -65.96 -40.03 4.67 0.20 95.13 2.32 0.74 1.92 92.45 2.39 0.01 0.13 0.04 12 A H H 50.13 6.02 11.81 19.53 92.58 51.96 -65.73 -38.72 5.35 0.18 94.47 2.23 0.80 2.53 91.95 2.31 0.02 0.11 0.05 13 R H H 152.67 2.11 14.47 16.95 94.00 49.85 -69.61 -35.08 9.50 0.23 90.27 3.01 1.36 5.36 87.66 2.36 0.05 0.12 0.09 14 V H H 91.66 2.72 14.45 17.63 98.20 44.58 -81.75 -35.63 17.82 0.26 81.92 3.98 2.81 11.12 79.99 1.79 0.06 0.11 0.13 15 H H H 104.03 4.47 13.37 19.01 101.72 37.14 -95.30 -20.06 41.77 0.57 57.66 10.50 9.90 21.05 56.47 1.48 0.06 0.18 0.36 16 G H H 30.40 5.34 14.61 21.26 113.46 -69.64 46.49 -141.61 45.27 0.51 54.22 22.27 11.79 11.35 51.84 2.27 0.02 0.17 0.29 17 F H H 105.48 7.14 13.26 21.46 93.94 -33.81 -65.42 -36.72 9.16 0.09 90.75 2.67 1.64 4.99 87.91 2.65 0.05 0.04 0.05 18 R H H 144.67 2.39 15.39 18.32 92.00 52.98 -64.73 -39.84 3.59 0.04 96.38 0.93 0.47 2.06 93.33 3.16 0.01 0.02 0.01 19 A H H 52.48 3.30 15.43 19.61 92.33 51.51 -65.29 -39.60 2.69 0.03 97.28 0.58 0.30 1.59 92.19 5.30 0.01 0.02 0.01 20 R H H 89.10 7.49 13.11 22.21 92.63 51.13 -67.88 -33.60 4.66 0.03 95.30 0.60 0.43 3.33 89.43 6.16 0.01 0.02 0.01 21 M H H 88.02 6.51 11.99 20.21 93.08 56.03 -73.17 -19.39 24.42 0.08 75.51 1.76 1.49 20.82 70.15 5.65 0.04 0.03 0.05 22 A C T 84.00 1.56 14.45 15.88 93.53 64.29 -78.86 -15.32 70.88 0.22 28.90 5.62 7.69 56.63 26.09 3.67 0.03 0.08 0.19 23 T C S 62.36 4.27 10.06 16.46 123.41 80.70 -94.44 154.73 97.47 0.65 1.87 8.36 87.92 0.99 1.79 0.10 0.00 0.10 0.74 24 K H H 164.99 0.85 13.19 13.54 92.37 -114.15 -59.93 -36.82 18.57 0.03 81.41 0.69 2.73 15.15 79.78 1.57 0.04 0.01 0.02 25 N H H 106.78 1.64 13.92 15.54 92.97 50.72 -66.36 -34.31 17.92 0.01 82.07 0.78 1.29 15.53 80.81 1.56 0.01 0.00 0.01 26 G H H 18.04 8.62 10.62 21.33 92.37 53.56 -63.92 -39.96 5.49 0.01 94.50 1.45 0.66 3.07 93.44 1.37 0.00 0.01 0.01 27 R H H 129.63 3.39 14.95 19.42 91.67 52.08 -64.34 -40.80 1.47 0.01 98.52 0.48 0.15 0.68 98.32 0.36 0.00 0.00 0.00 28 Q H H 108.52 1.45 17.80 17.75 92.13 50.06 -64.89 -41.31 1.06 0.01 98.93 0.33 0.11 0.51 98.84 0.20 0.00 0.00 0.00 29 V H H 62.05 4.23 16.01 21.38 91.76 49.52 -64.01 -42.93 0.55 0.01 99.44 0.21 0.06 0.23 99.40 0.09 0.00 0.01 0.00 30 L H H 56.48 7.40 13.99 23.18 91.79 49.88 -63.44 -41.99 0.21 0.00 99.79 0.04 0.01 0.10 99.79 0.05 0.00 0.00 0.00 31 S H H 58.52 2.21 16.69 18.66 91.57 50.94 -63.72 -40.98 0.31 0.00 99.69 0.04 0.01 0.18 99.71 0.06 0.00 0.00 0.00 32 R H H 133.45 1.55 16.09 16.82 92.05 50.07 -64.92 -40.79 0.51 0.00 99.49 0.05 0.02 0.33 99.48 0.11 0.00 0.00 0.00 33 R H H 99.98 5.42 12.42 19.31 92.21 50.59 -65.43 -40.84 1.31 0.00 98.68 0.20 0.09 0.84 98.58 0.28 0.00 0.00 0.00 34 R H H 140.42 3.01 12.42 16.75 91.89 51.41 -64.77 -38.71 4.09 0.02 95.90 0.59 0.29 2.84 95.41 0.85 0.00 0.01 0.01 35 A H H 85.95 0.95 12.50 12.77 91.90 52.78 -67.73 -30.00 14.93 0.06 85.02 0.98 0.90 12.78 84.24 1.03 0.02 0.02 0.03 36 K C T 146.22 1.39 11.07 12.76 95.99 51.72 -85.65 -6.68 68.09 0.14 31.77 1.98 3.77 59.77 32.98 1.34 0.01 0.04 0.10 37 G C T 50.88 2.67 10.40 14.46 103.74 -98.78 79.37 16.45 92.22 0.31 7.46 15.19 8.21 68.76 6.24 1.32 0.00 0.14 0.15 38 R C C 146.82 4.05 8.15 14.05 112.15 143.13 -87.47 128.92 85.81 1.78 12.40 72.13 7.13 6.85 6.27 5.78 0.00 0.91 0.93 39 K C C 154.24 1.80 9.49 12.72 114.09 -157.26 -97.26 132.78 80.38 2.83 16.79 54.71 13.87 11.68 6.17 10.81 0.00 1.74 1.02 40 R C C 174.20 1.85 8.82 12.15 112.97 -130.20 -90.68 124.96 75.88 6.34 17.77 50.80 13.41 11.85 5.68 12.12 0.02 4.51 1.61 41 L C C 125.51 3.00 6.85 11.58 109.58 -143.84 -89.02 112.14 77.43 8.07 14.51 55.23 11.84 10.26 5.26 9.41 0.01 6.08 1.92 42 T C C 105.18 1.79 7.80 11.17 117.74 104.09 -104.24 136.66 87.90 5.77 6.33 78.66 3.48 6.40 2.81 2.78 0.00 4.35 1.53 43 V C C 111.36 3.19 9.69 14.63 109.72 -131.29 -88.56 117.20 99.81 0.15 0.03 99.68 0.13 0.07 0.01 0.00 0.00 0.09 0.01