# 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 A C C 77.86 3.35 10.72 15.69 113.28 -117.20 -77.79 145.92 99.80 0.08 0.11 99.62 0.14 0.11 0.06 0.01 0.00 0.03 0.02 1 A C C 85.76 2.29 8.12 12.14 112.13 -132.19 -85.81 128.16 78.51 1.63 19.86 67.28 2.46 8.90 16.74 2.91 0.00 0.81 0.89 2 Q C C 141.66 1.49 7.68 10.58 112.70 -138.42 -91.99 124.63 70.03 3.40 26.58 45.81 13.34 10.46 22.76 4.42 0.02 1.71 1.47 3 K C C 131.32 3.39 7.67 12.99 115.10 -150.69 -91.53 136.27 68.19 2.83 28.98 50.55 11.62 5.39 26.65 3.30 0.01 1.37 1.10 4 S C C 61.99 2.48 9.51 13.39 116.59 -127.09 -81.20 160.12 64.24 2.27 33.49 54.12 6.35 3.03 33.12 1.56 0.00 0.93 0.89 5 F H H 158.46 1.20 9.80 11.57 93.31 -109.79 -61.90 -37.61 4.20 0.05 95.75 2.01 0.80 1.35 95.38 0.43 0.00 0.02 0.01 6 R H H 155.51 1.10 11.54 12.50 92.23 51.88 -65.05 -39.83 2.00 0.03 97.97 0.75 0.29 0.93 97.62 0.39 0.00 0.01 0.01 7 I H H 83.59 2.69 11.39 15.42 92.20 48.52 -65.47 -41.42 0.99 0.01 98.99 0.36 0.13 0.46 98.75 0.29 0.00 0.01 0.00 8 K H H 113.74 2.31 12.86 15.97 91.79 50.82 -64.28 -40.74 0.58 0.00 99.42 0.19 0.06 0.27 99.33 0.15 0.00 0.00 0.00 9 Q H H 105.47 1.53 14.19 15.32 91.90 49.94 -64.69 -40.98 0.56 0.00 99.43 0.14 0.05 0.29 99.40 0.10 0.00 0.00 0.00 10 K H H 116.54 1.83 14.29 16.06 91.92 49.60 -64.83 -41.26 0.63 0.00 99.37 0.14 0.05 0.35 99.36 0.10 0.00 0.00 0.00 11 M H H 96.52 2.42 13.60 16.62 92.17 49.94 -64.74 -40.99 0.70 0.00 99.30 0.15 0.05 0.40 99.26 0.14 0.00 0.00 0.00 12 A H H 55.96 1.95 13.73 15.98 91.64 50.86 -63.66 -41.34 1.18 0.00 98.82 0.21 0.09 0.74 98.75 0.22 0.00 0.00 0.00 13 K H H 122.92 1.47 14.11 15.15 92.26 50.22 -65.75 -39.64 1.97 0.01 98.03 0.31 0.15 1.31 97.81 0.41 0.00 0.00 0.00 14 A H H 57.07 2.60 12.21 15.88 92.37 52.21 -65.04 -39.54 3.73 0.01 96.25 0.56 0.31 2.57 95.51 1.04 0.00 0.01 0.01 15 K H H 135.21 1.58 12.67 14.50 92.57 51.90 -66.39 -34.75 11.28 0.05 88.67 1.38 0.92 8.55 87.27 1.82 0.02 0.02 0.02 16 K H H 139.12 1.65 11.56 13.73 93.76 53.78 -71.95 -26.97 28.68 0.26 71.06 5.77 2.84 20.07 68.04 2.99 0.04 0.11 0.15 17 Q C H 124.42 2.31 10.07 13.74 96.57 68.27 -73.30 -20.02 54.55 0.68 44.77 10.27 7.12 36.69 41.75 3.44 0.06 0.28 0.40 18 N C T 126.89 1.30 10.32 12.23 99.60 52.33 -89.78 8.62 77.20 0.93 21.87 22.20 11.72 43.49 18.14 3.54 0.01 0.39 0.51 19 R C C 146.02 2.67 8.61 13.31 119.01 117.26 -93.24 138.58 97.33 2.17 0.50 54.25 42.47 0.98 0.29 0.17 0.00 0.88 0.94 20 P C C 110.50 1.49 10.31 12.98 114.34 -103.96 -68.03 146.36 91.65 7.58 0.76 84.99 5.28 1.02 0.42 0.29 0.00 3.06 4.94 21 L C C 112.45 4.42 7.32 13.85 115.29 -110.23 -81.33 139.96 92.21 4.15 3.64 79.74 9.72 2.62 2.44 1.21 0.00 2.34 1.93 22 P C C 88.18 3.23 9.43 14.41 113.34 -104.86 -67.28 146.75 83.22 4.46 12.32 64.73 9.62 8.94 7.50 4.76 0.00 3.28 1.17 23 Q C C 143.01 1.82 9.87 12.98 100.78 -132.00 -78.42 -4.78 56.13 16.80 27.07 26.07 18.14 12.95 17.27 8.92 0.19 14.36 2.12 24 W E E 176.92 2.64 9.54 13.48 105.66 74.67 -88.55 44.06 32.10 38.86 29.04 16.55 9.50 8.56 19.22 8.97 0.40 34.78 2.03 25 I E E 98.02 5.01 8.47 15.22 114.44 69.32 -99.51 127.75 13.86 64.24 21.90 9.48 2.75 2.53 17.61 4.40 0.04 62.21 0.98 26 R E E 142.12 3.36 10.00 15.13 116.12 -155.97 -102.09 134.48 8.99 77.85 13.16 6.33 1.31 1.26 11.59 2.15 0.00 76.76 0.58 27 L E E 102.36 3.76 8.55 14.23 116.83 -141.60 -101.81 131.45 8.93 84.68 6.39 6.76 1.12 0.98 6.13 1.19 0.00 83.06 0.76 28 R E E 154.22 2.94 8.12 12.93 115.29 -163.85 -101.13 134.97 23.86 71.74 4.40 17.76 3.71 2.42 3.17 1.36 0.00 70.76 0.82 29 T C E 101.38 1.67 8.15 10.89 117.10 2.38 -119.41 130.26 47.03 46.98 5.99 12.44 12.24 25.43 2.75 2.82 0.04 42.67 1.60 30 N C T 144.76 0.44 9.85 9.33 98.94 -30.10 43.61 6.86 96.77 0.70 2.53 6.18 15.54 75.38 0.64 1.57 0.00 0.51 0.18 31 N C T 130.61 1.50 8.77 11.27 100.61 -20.32 -96.48 18.65 96.73 1.72 1.55 9.28 23.73 63.90 0.20 1.23 0.00 1.42 0.23 32 T E E 86.39 2.30 9.54 13.51 120.38 109.71 -105.55 138.92 26.28 73.42 0.30 21.68 4.14 0.68 0.12 0.19 0.00 71.51 1.67 33 I E E 94.69 6.43 7.91 16.21 118.38 -151.36 -104.72 131.00 10.26 89.61 0.13 9.59 0.58 0.12 0.07 0.05 0.00 88.44 1.14 34 R E E 141.93 3.10 12.44 17.33 121.61 -168.14 -116.23 138.79 15.21 84.51 0.28 13.43 1.42 0.32 0.15 0.12 0.00 83.87 0.70 35 Y E E 128.12 6.98 9.56 18.27 119.98 -148.28 -108.00 137.25 36.14 62.33 1.53 30.87 4.12 1.03 0.97 0.65 0.00 60.40 1.95 36 N C C 73.14 5.14 10.81 17.98 113.79 -157.47 -106.18 118.75 84.15 12.47 3.37 76.57 5.52 1.64 2.11 1.27 0.00 11.66 1.25 37 A C T 76.22 3.91 10.07 15.86 94.11 -157.21 -68.11 -23.16 58.14 2.10 39.76 20.07 12.78 25.25 20.73 19.05 0.05 1.21 0.85 38 K C T 155.87 1.13 11.87 13.11 95.67 65.40 -75.82 -17.53 56.57 1.61 41.82 16.64 13.14 26.81 22.89 18.76 0.08 0.83 0.85 39 R C C 131.84 4.52 9.43 15.58 99.33 67.15 -85.38 5.87 52.81 1.77 45.43 29.93 11.13 11.84 26.38 18.98 0.03 0.89 0.82 40 R C H 133.65 4.76 9.94 16.41 101.91 103.25 -74.90 -19.52 51.64 1.39 46.97 32.14 9.24 10.99 35.67 10.62 0.01 0.70 0.62 41 N C H 96.97 3.01 11.06 15.29 101.71 60.89 -84.90 13.74 50.97 1.54 47.48 31.72 7.92 12.25 35.04 11.56 0.02 0.81 0.68 42 W H H 150.36 3.89 9.44 15.04 98.42 77.69 -74.24 -25.72 41.55 1.37 57.08 22.42 7.69 12.35 40.84 15.38 0.03 0.73 0.57 43 R H H 152.14 2.51 9.70 13.61 98.53 66.26 -77.44 -18.99 40.66 1.48 57.85 22.71 6.98 11.76 43.88 13.24 0.03 0.81 0.58 44 R H H 155.91 2.46 9.44 13.26 100.26 69.92 -78.22 -19.41 40.83 1.40 57.77 22.60 8.40 10.78 44.48 12.43 0.03 0.72 0.56 45 T H H 92.57 2.75 8.24 12.55 106.40 76.33 -87.33 30.47 46.62 1.45 51.93 25.51 9.14 12.58 40.86 10.54 0.03 0.74 0.60 46 K C H 153.94 1.65 8.27 11.21 104.03 56.73 -82.35 18.60 55.69 2.20 42.12 31.08 9.01 16.28 32.70 8.78 0.02 1.14 0.99 47 M C C 135.54 2.31 7.30 11.17 104.74 83.78 -86.28 40.56 70.37 1.35 28.28 48.41 3.45 18.70 23.35 4.66 0.00 0.66 0.77 48 N C C 125.55 1.93 11.07 14.16 102.90 -114.35 -1.91 38.49 99.84 0.04 0.12 99.01 0.26 0.63 0.07 0.01 0.00 0.02 0.01