# 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 77.89 3.35 10.82 15.80 113.01 -116.45 -77.39 146.24 99.81 0.08 0.10 99.64 0.14 0.11 0.05 0.01 0.00 0.03 0.02 1 A C C 85.55 2.35 8.08 12.19 111.79 -130.96 -85.62 128.09 78.80 1.58 19.62 67.24 2.53 9.12 16.66 2.81 0.00 0.78 0.87 2 Q C C 142.24 1.45 7.83 10.66 112.92 -139.43 -92.10 124.75 70.58 3.33 26.09 46.14 13.55 10.43 22.44 4.32 0.02 1.65 1.46 3 K C C 129.41 3.61 7.64 13.19 114.93 -149.18 -92.09 136.82 68.38 2.76 28.86 50.05 12.48 5.23 26.73 3.10 0.01 1.32 1.08 4 S C C 61.31 2.52 9.64 13.57 116.86 -129.58 -80.99 159.10 66.27 2.18 31.56 56.61 5.82 2.95 31.36 1.50 0.00 0.90 0.85 5 F H H 157.96 1.24 9.89 11.74 93.13 -111.58 -61.46 -37.69 3.87 0.04 96.08 1.85 0.72 1.25 95.74 0.40 0.00 0.01 0.01 6 R H H 155.29 1.13 11.74 12.71 92.19 51.87 -64.93 -40.01 1.82 0.02 98.16 0.67 0.25 0.85 97.84 0.36 0.00 0.01 0.00 7 I H H 81.52 2.91 11.42 15.78 92.15 48.34 -65.60 -41.33 0.92 0.01 99.06 0.33 0.12 0.44 98.83 0.28 0.00 0.00 0.00 8 K H H 112.92 2.46 12.98 16.32 91.78 50.89 -64.11 -40.67 0.52 0.00 99.48 0.17 0.05 0.24 99.39 0.14 0.00 0.00 0.00 9 Q H H 105.24 1.56 14.39 15.52 91.89 49.96 -64.75 -40.92 0.53 0.00 99.47 0.13 0.05 0.28 99.45 0.09 0.00 0.00 0.00 10 K H H 116.27 1.92 14.47 16.39 91.97 49.65 -64.84 -41.20 0.62 0.00 99.38 0.13 0.05 0.36 99.37 0.10 0.00 0.00 0.00 11 M H H 94.70 2.64 13.67 17.06 92.29 49.87 -64.71 -40.99 0.71 0.00 99.29 0.15 0.05 0.41 99.25 0.14 0.00 0.00 0.00 12 A H H 55.59 2.02 13.94 16.28 91.62 50.86 -63.71 -41.41 1.18 0.00 98.82 0.22 0.09 0.73 98.75 0.22 0.00 0.00 0.00 13 K H H 122.85 1.51 14.21 15.33 92.29 50.07 -65.39 -39.66 1.85 0.01 98.15 0.29 0.14 1.22 97.92 0.42 0.00 0.00 0.00 14 A H H 56.06 2.90 12.14 16.28 92.39 52.23 -65.08 -39.35 3.59 0.01 96.40 0.50 0.28 2.52 95.61 1.08 0.00 0.00 0.01 15 K H H 137.17 1.61 12.79 14.70 92.46 52.56 -66.57 -33.58 11.89 0.05 88.06 1.18 0.86 9.41 86.78 1.70 0.02 0.02 0.02 16 K H H 139.25 1.74 11.62 13.93 94.33 53.96 -75.32 -19.40 32.29 0.27 67.44 5.68 2.99 23.49 64.82 2.71 0.04 0.11 0.16 17 Q C T 121.59 2.72 9.87 14.18 98.50 74.44 -73.98 -15.74 60.10 0.78 39.12 11.19 7.77 40.31 36.56 3.34 0.05 0.32 0.46 18 N C T 127.59 1.37 10.40 12.46 100.30 52.39 -89.83 12.41 81.09 0.96 17.95 23.42 12.11 45.86 14.23 3.43 0.01 0.43 0.51 19 R C C 145.82 2.71 8.91 13.65 119.48 122.03 -95.95 138.86 97.17 2.45 0.38 55.15 41.65 0.82 0.20 0.14 0.00 1.05 0.99 20 P C C 109.91 1.59 10.65 13.44 114.22 -104.10 -67.34 146.34 90.51 8.98 0.51 85.01 4.53 0.72 0.28 0.20 0.00 3.46 5.81 21 L C C 107.06 5.43 7.50 14.84 115.30 -110.18 -81.65 140.16 93.98 4.21 1.81 83.07 9.33 1.56 1.17 0.62 0.00 2.40 1.85 22 P C C 83.93 3.71 9.84 15.30 113.11 -104.97 -66.26 146.47 87.14 4.59 8.27 73.88 7.44 6.08 4.85 3.14 0.00 3.47 1.14 23 Q C C 142.31 1.92 10.47 13.68 98.03 -132.34 -74.96 -19.50 56.51 17.29 26.21 23.01 22.08 12.74 16.19 8.79 0.22 14.84 2.13 24 W E E 173.04 2.90 10.05 14.17 104.92 73.32 -89.84 25.97 29.16 42.94 27.90 14.53 9.39 8.02 18.23 8.65 0.47 38.81 1.89 25 I E E 93.04 5.70 8.72 16.08 113.74 68.21 -96.03 124.69 11.31 67.31 21.38 7.88 2.21 2.03 16.54 4.34 0.03 66.21 0.76 26 R E E 139.04 3.89 10.46 16.02 113.82 -149.41 -98.36 132.31 7.23 80.92 11.85 5.12 1.02 1.01 10.11 1.93 0.00 80.36 0.44 27 L E E 100.74 3.87 9.17 14.90 116.65 -136.76 -102.84 131.55 7.51 86.82 5.67 5.64 0.94 0.84 5.17 1.07 0.00 85.78 0.55 28 R E E 154.00 3.21 8.38 13.50 114.98 -161.29 -102.44 133.22 21.27 74.80 3.93 15.64 3.40 2.20 2.80 1.22 0.00 74.04 0.70 29 T E E 95.89 1.99 8.36 11.63 118.40 16.30 -122.12 131.31 42.89 52.02 5.09 14.00 11.71 19.85 2.42 2.42 0.03 48.10 1.47 30 N C T 144.46 0.46 10.21 9.70 98.27 -42.51 39.80 -18.63 97.29 0.64 2.07 5.79 16.87 74.92 0.51 1.28 0.00 0.47 0.15 31 N C T 133.62 1.36 9.03 11.26 100.90 -21.60 -96.71 11.60 97.27 1.45 1.29 7.79 23.54 66.11 0.16 1.01 0.00 1.20 0.19 32 T E E 84.31 2.39 10.03 14.10 121.13 106.41 -111.21 139.51 23.48 76.29 0.23 19.57 3.52 0.53 0.09 0.14 0.00 74.83 1.32 33 I E E 92.33 7.10 8.00 16.86 118.55 -151.23 -105.89 130.81 7.91 92.00 0.08 7.44 0.41 0.08 0.05 0.03 0.00 91.36 0.63 34 R E E 137.78 3.24 13.25 18.20 122.74 -168.33 -117.97 139.97 9.49 90.36 0.15 8.50 0.74 0.15 0.08 0.06 0.00 90.03 0.43 35 Y E E 121.59 8.16 9.79 19.44 120.32 -148.62 -107.75 137.30 27.71 71.41 0.88 24.31 2.76 0.64 0.53 0.37 0.00 69.92 1.47 36 N C C 70.99 5.30 11.64 18.93 113.05 -157.67 -108.23 116.31 82.87 14.01 3.12 75.84 5.01 1.39 1.95 1.14 0.00 13.63 1.03 37 A C H 72.71 4.46 10.48 16.85 94.35 -160.14 -67.38 -24.64 52.91 2.14 44.95 19.40 11.19 22.14 23.88 21.27 0.06 1.28 0.78 38 K C H 153.96 1.18 12.59 13.81 94.10 64.40 -71.71 -24.65 51.42 1.57 47.01 15.71 11.43 24.01 26.42 20.74 0.09 0.83 0.77 39 R H H 126.04 4.77 10.28 16.65 98.42 57.31 -86.81 2.77 47.67 1.71 50.62 26.25 9.68 11.78 29.84 20.81 0.03 0.89 0.74 40 R H H 123.06 6.05 10.34 17.97 97.61 96.21 -68.17 -30.02 47.46 1.28 51.26 29.89 8.21 10.22 40.02 10.45 0.01 0.65 0.54 41 N H H 97.04 2.88 12.22 16.09 97.42 58.67 -77.91 -12.36 45.61 1.37 53.02 27.74 6.99 11.76 40.15 12.03 0.02 0.74 0.56 42 W H H 143.01 3.69 10.74 15.96 94.95 74.36 -69.50 -32.01 36.67 1.28 62.05 19.11 6.81 11.69 45.63 15.55 0.03 0.70 0.49 43 R H H 132.71 3.53 10.67 15.69 97.02 61.75 -73.85 -28.26 36.73 1.56 61.71 21.20 6.09 10.41 47.92 12.89 0.03 0.88 0.58 44 R H H 140.17 3.31 10.24 15.05 97.70 66.69 -71.93 -32.29 36.83 1.43 61.75 20.85 7.25 9.89 49.25 11.42 0.04 0.75 0.54 45 T H H 90.18 2.44 9.82 13.46 97.69 61.25 -76.83 -31.20 39.97 1.23 58.80 20.13 7.66 12.79 46.69 11.53 0.04 0.65 0.50 46 K H H 148.83 1.68 9.70 12.34 96.81 58.68 -75.22 -22.04 46.59 1.54 51.87 20.08 9.38 18.13 39.94 10.92 0.07 0.80 0.69 47 M C H 119.63 3.23 8.02 12.87 100.15 57.77 -85.12 -5.01 61.23 2.07 36.71 23.76 13.04 25.39 26.81 8.93 0.06 1.00 1.01 48 N C C 130.99 1.37 10.34 12.70 100.42 -123.19 45.64 36.14 88.15 1.45 10.40 60.76 3.56 24.82 6.62 2.72 0.00 0.82 0.70 49 I C C 103.09 5.25 9.56 16.44 106.26 144.78 -87.90 54.43 99.85 0.12 0.04 99.70 0.13 0.07 0.02 0.00 0.00 0.06 0.02