# 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 D C C 120.31 1.47 11.59 13.64 108.96 -163.50 -96.86 99.46 99.86 0.11 0.03 99.76 0.10 0.05 0.01 0.00 0.00 0.05 0.02 1 A C C 76.81 4.09 6.55 12.61 117.15 -164.62 -101.89 134.13 85.56 3.10 11.34 81.30 1.30 5.05 5.81 3.44 0.00 2.10 0.99 2 E C C 150.47 1.21 8.47 10.87 115.98 -159.13 -102.41 131.58 79.89 8.11 12.00 60.10 11.13 8.50 6.33 5.66 0.01 5.96 2.32 3 F C C 147.38 3.24 6.51 11.80 115.96 -152.70 -97.23 130.88 77.50 9.66 12.84 60.37 9.90 6.86 6.99 5.98 0.01 7.18 2.72 4 R C C 164.66 2.13 8.62 12.56 116.72 -163.47 -105.03 133.85 81.66 6.79 11.55 65.14 9.17 6.89 7.23 4.54 0.00 4.80 2.22 5 H C C 142.37 2.68 7.66 12.28 113.93 -149.26 -97.85 129.24 82.16 5.20 12.64 56.25 13.81 11.86 7.96 4.90 0.00 3.33 1.90 6 D C C 105.28 2.79 8.22 12.82 110.57 -160.67 -98.26 108.50 83.81 2.97 13.22 55.49 14.28 13.91 7.92 5.38 0.00 1.69 1.32 7 S C C 87.56 1.94 8.52 11.86 102.88 -155.87 -88.30 7.79 75.67 1.81 22.52 31.45 16.83 28.01 14.20 7.71 0.02 0.87 0.92 8 G C C 55.82 1.97 9.41 12.62 102.98 47.18 -56.33 2.99 69.20 2.46 28.34 26.20 18.40 25.55 18.90 8.56 0.06 1.21 1.12 9 Y C C 150.14 3.36 7.93 13.03 111.06 106.82 -92.79 111.43 53.94 8.05 38.01 36.52 10.01 8.11 30.05 7.75 0.08 5.39 2.09 10 E C H 127.81 2.73 9.72 14.05 113.09 -149.68 -92.79 127.85 44.59 12.89 42.52 32.09 7.00 6.33 35.72 6.26 0.07 10.31 2.22 11 V H H 91.93 4.24 8.66 14.62 113.51 -158.03 -92.52 127.19 40.73 10.06 49.21 29.16 6.68 6.14 42.21 5.94 0.06 8.26 1.54 12 H H H 125.87 3.17 9.19 13.91 107.78 -146.23 -87.92 93.57 43.17 5.48 51.35 30.12 6.49 7.50 44.27 6.31 0.04 4.23 1.03 13 H H H 133.64 3.07 9.15 13.70 101.05 -143.19 -80.32 4.21 41.70 2.75 55.55 25.59 7.33 9.94 46.10 8.45 0.04 1.82 0.73 14 Q H H 130.48 2.03 9.82 12.98 101.77 75.19 -82.00 -0.64 41.42 2.74 55.84 23.23 7.26 11.82 46.02 9.05 0.05 1.87 0.71 15 K H H 141.18 2.34 9.75 13.40 106.57 65.62 -89.56 58.81 42.07 5.08 52.86 25.65 6.84 10.43 44.26 7.87 0.06 3.83 1.08 16 L H H 102.98 4.23 8.54 14.53 110.98 70.01 -94.14 114.61 42.49 7.25 50.26 31.38 5.82 5.70 43.82 6.19 0.03 5.90 1.15 17 V H H 96.94 3.54 9.11 14.39 112.20 -159.00 -96.40 123.35 34.10 12.04 53.86 24.15 4.39 5.90 46.18 6.83 0.04 11.24 1.27 18 F H H 151.03 2.29 9.64 13.29 107.62 -158.93 -92.01 60.11 32.03 14.00 53.97 18.61 5.77 8.82 43.85 8.40 0.19 12.63 1.71 19 F H H 141.44 3.03 9.30 13.87 110.55 50.15 -95.96 107.64 35.92 13.34 50.74 22.04 6.82 8.78 41.08 7.85 0.20 11.15 2.09 20 A H H 73.51 4.14 8.89 14.86 109.50 -150.12 -89.15 112.55 42.32 7.75 49.93 26.00 7.76 9.74 40.93 7.91 0.09 6.27 1.30 21 E H H 133.82 2.70 10.27 14.56 113.62 -149.59 -93.68 133.38 46.79 5.91 47.29 23.71 11.54 13.34 36.74 8.99 0.18 4.15 1.36 22 D C C 105.71 2.90 10.76 15.26 109.66 -100.66 -88.94 115.87 56.04 4.25 39.71 34.69 9.82 12.15 31.35 7.99 0.05 2.73 1.24 23 V C C 92.63 5.81 8.73 16.06 102.77 -167.85 -86.47 9.70 60.92 3.68 35.41 31.72 12.03 18.00 28.12 6.62 0.09 1.95 1.47 24 G C C 50.55 3.09 11.92 16.25 106.69 19.33 58.63 -30.03 72.96 2.36 24.68 33.98 14.54 24.94 17.62 6.61 0.03 1.14 1.13 25 S C C 85.27 2.35 11.20 14.54 103.40 36.35 -89.10 9.33 72.63 2.21 25.16 27.89 24.92 20.44 18.07 6.47 0.05 0.95 1.23 26 N C C 87.87 4.71 11.20 17.46 109.73 110.90 -90.63 104.25 75.23 2.37 22.40 46.70 18.49 9.74 18.65 4.12 0.01 0.95 1.34 27 K H H 131.58 4.31 12.43 18.13 95.10 -156.89 -65.53 -33.14 15.38 0.20 84.42 5.47 3.51 7.05 80.96 2.79 0.02 0.09 0.09 28 G H H 43.09 2.72 14.23 17.54 93.41 55.90 -65.74 -39.53 11.34 0.15 88.51 2.97 1.71 6.93 85.51 2.71 0.03 0.08 0.06 29 A H H 51.99 3.88 14.55 19.66 92.91 51.31 -65.84 -40.41 6.70 0.25 93.05 3.16 1.00 2.97 90.39 2.23 0.01 0.18 0.05 30 I H H 75.51 5.55 14.50 21.47 92.68 50.68 -65.70 -41.90 2.22 0.19 97.59 1.17 0.31 0.82 96.83 0.70 0.00 0.14 0.03 31 I H H 89.38 3.66 16.17 20.43 92.24 50.09 -64.40 -41.96 1.04 0.11 98.85 0.47 0.12 0.43 98.42 0.45 0.00 0.09 0.01 32 G H H 37.24 3.33 15.64 19.80 92.07 51.30 -64.27 -41.13 1.46 0.14 98.40 0.52 0.14 0.75 97.78 0.66 0.00 0.14 0.01 33 L H H 95.88 3.55 15.53 19.99 92.28 50.36 -66.09 -40.03 2.05 0.20 97.74 0.59 0.19 1.18 97.00 0.82 0.01 0.21 0.02 34 M H H 102.54 3.93 15.67 20.44 92.65 50.12 -66.76 -39.68 3.76 0.42 95.82 1.01 0.41 2.26 95.09 0.81 0.02 0.36 0.06 35 V H H 86.11 3.08 15.64 19.14 92.76 50.14 -66.18 -40.35 9.20 0.49 90.31 2.44 1.13 5.58 89.54 0.86 0.04 0.32 0.11 36 G H H 40.42 2.93 14.59 18.30 93.21 52.86 -66.12 -38.88 15.81 0.31 83.88 4.67 1.81 8.88 83.09 1.25 0.03 0.16 0.10 37 G H H 39.09 3.39 13.70 18.27 93.80 53.85 -66.33 -39.09 15.42 0.53 84.05 6.17 2.18 7.22 81.94 1.98 0.03 0.33 0.16 38 V H H 88.82 2.68 13.73 17.07 93.59 50.56 -67.36 -40.04 10.47 1.47 88.06 5.86 1.58 3.49 85.56 2.02 0.02 1.26 0.20 39 V H H 92.04 2.10 13.11 15.73 93.36 51.27 -66.38 -40.87 9.80 2.79 87.41 6.03 1.32 2.86 84.62 2.14 0.02 2.77 0.24 40 I H H 109.39 1.94 12.19 14.73 93.90 49.51 -68.25 -39.16 10.74 3.90 85.35 6.10 1.45 3.41 82.38 2.42 0.03 3.91 0.31 41 A H H 70.62 2.50 10.20 14.11 95.16 54.97 -69.86 -30.81 17.28 3.67 79.05 8.81 2.19 6.25 75.60 3.17 0.04 3.57 0.37 42 T H H 97.47 1.88 9.83 12.80 97.06 57.76 -75.36 -24.66 30.10 4.96 64.94 12.25 3.85 13.70 60.83 4.00 0.09 4.63 0.65 43 V H H 115.67 1.37 8.78 11.04 99.16 57.63 -80.62 -20.00 39.51 7.90 52.59 16.12 5.28 18.15 48.56 3.94 0.16 6.40 1.39 44 I C H 131.90 1.49 8.70 11.19 103.10 61.71 -85.37 -0.20 50.53 9.70 39.78 32.87 2.37 14.16 38.60 2.53 0.05 6.80 2.63 45 V C C 102.22 3.76 11.02 16.26 107.60 56.11 -87.42 96.37 99.16 0.68 0.15 99.03 0.15 0.14 0.13 0.01 0.00 0.48 0.06