# 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 124.91 3.52 9.74 15.22 118.35 -154.52 -94.39 139.30 99.94 0.06 0.00 99.77 0.18 0.01 0.00 0.00 0.00 0.02 0.01 1 P C C 103.21 2.47 8.50 12.90 114.14 -104.55 -67.38 148.07 98.78 0.83 0.39 97.28 0.37 1.46 0.09 0.14 0.00 0.40 0.27 2 K C C 163.64 1.35 7.72 10.60 114.75 -113.39 -83.44 139.79 88.68 9.85 1.47 77.20 7.87 3.03 0.46 1.04 0.00 5.32 5.09 3 A C C 89.44 2.34 7.00 11.28 113.47 -117.66 -84.06 137.98 84.34 14.06 1.61 72.81 8.60 2.38 0.54 1.13 0.00 9.90 4.63 4 K C C 154.37 1.74 9.07 12.39 118.85 -149.10 -106.42 139.10 81.52 16.77 1.70 70.89 8.02 1.96 0.78 0.97 0.00 11.67 5.70 5 T C C 98.38 3.74 8.43 14.27 117.73 -135.04 -94.69 141.10 83.35 13.99 2.66 70.02 10.09 2.61 1.52 1.25 0.00 9.40 5.12 6 H C C 120.24 4.92 9.21 15.77 112.94 -142.14 -93.96 121.11 88.44 6.61 4.95 74.37 10.64 3.13 3.59 1.57 0.00 3.99 2.71 7 S C C 79.79 2.62 11.77 15.47 100.72 -157.74 -77.60 -25.84 57.09 2.46 40.45 33.28 11.46 13.25 26.51 13.08 0.05 1.22 1.15 8 G H H 43.60 3.62 12.35 17.25 94.84 56.84 -64.62 -32.54 43.64 1.22 55.14 13.00 9.68 20.84 33.39 21.75 0.10 0.63 0.62 9 A H H 43.69 9.47 10.44 21.02 94.10 59.37 -71.65 -26.62 32.43 1.42 66.14 11.92 6.26 13.87 38.28 28.23 0.09 0.79 0.56 10 S H H 60.81 6.97 12.43 20.78 94.15 69.48 -66.31 -26.13 29.85 1.73 68.42 12.43 5.72 11.97 37.20 31.01 0.07 1.04 0.57 11 K H H 143.55 2.34 15.69 18.44 93.87 61.97 -77.11 -14.32 43.06 2.63 54.31 13.35 8.57 21.34 27.55 26.50 0.11 1.72 0.86 12 R C T 114.94 7.94 14.30 23.06 97.70 57.77 -91.08 -11.23 57.38 7.20 35.42 17.25 16.12 25.99 15.35 18.12 0.20 5.39 1.59 13 F E E 69.30 13.89 10.68 24.81 124.28 73.25 -109.44 140.40 29.77 68.24 2.00 24.42 4.83 1.54 0.99 1.04 0.00 65.39 1.79 14 R E E 131.18 3.87 16.47 21.84 127.70 -169.49 -125.94 147.80 6.64 93.18 0.18 6.11 0.44 0.09 0.12 0.06 0.00 92.74 0.44 15 R E E 144.82 5.65 11.21 18.86 115.49 -120.37 -90.35 131.62 4.19 95.73 0.08 4.01 0.18 0.03 0.07 0.02 0.00 88.89 6.80 16 T C C 57.79 6.53 8.71 17.08 121.64 -143.56 -87.72 171.67 90.19 9.74 0.08 90.10 0.56 0.12 0.02 0.03 0.00 8.38 0.79 17 G C T 69.01 0.41 10.18 9.78 91.84 -93.23 -63.77 -20.89 97.49 1.60 0.92 1.65 8.98 86.93 0.04 0.95 0.00 1.28 0.17 18 T C T 110.43 0.88 10.47 11.08 94.38 56.39 -88.80 -0.38 98.88 0.18 0.94 0.83 7.43 90.54 0.04 1.01 0.00 0.10 0.04 19 G C S 43.67 4.25 10.89 16.93 97.76 -103.21 87.35 6.14 98.83 0.43 0.74 11.76 82.51 4.68 0.07 0.59 0.00 0.25 0.14 20 K C C 104.61 4.33 12.87 19.01 119.03 131.84 -85.05 145.27 91.94 7.94 0.12 88.45 3.57 0.24 0.05 0.06 0.00 6.43 1.21 21 I E E 66.60 10.25 11.50 23.42 116.50 -130.05 -96.51 131.16 1.44 98.55 0.01 1.44 0.05 0.00 0.01 0.00 0.00 96.30 2.19 22 V E E 61.24 7.65 15.50 24.89 124.00 -165.59 -115.77 140.87 3.47 96.50 0.03 3.42 0.12 0.01 0.03 0.01 0.00 96.28 0.12 23 R E E 110.16 10.20 13.25 24.49 122.72 -153.62 -110.33 138.42 18.77 80.81 0.42 17.30 1.09 0.20 0.32 0.13 0.00 80.13 0.83 24 Q C C 87.67 7.72 13.11 22.25 120.30 -125.44 -87.45 144.47 64.02 33.92 2.06 58.60 3.61 0.92 1.24 0.76 0.00 33.47 1.39 25 K C C 117.38 5.74 12.51 19.68 114.82 -110.79 -78.39 140.98 84.37 8.23 7.40 78.23 3.98 2.43 4.58 2.45 0.00 6.40 1.92 26 A C T 65.23 5.85 10.50 17.94 111.90 -110.91 -72.18 140.15 68.09 1.94 29.97 22.89 14.23 31.36 16.99 12.47 0.05 1.12 0.90 27 N C T 109.28 3.06 11.46 15.67 99.80 13.70 -35.85 34.51 66.87 1.10 32.03 25.05 11.91 30.51 19.22 12.10 0.04 0.49 0.69 28 R H H 138.80 4.60 9.73 16.08 97.92 135.78 -77.63 -14.27 41.36 0.87 57.76 24.70 7.63 9.40 39.61 17.82 0.01 0.42 0.42 29 R H H 161.06 2.31 11.04 14.52 96.52 68.87 -71.87 -27.55 31.60 0.86 67.54 14.34 5.75 11.56 44.09 23.41 0.04 0.47 0.34 30 H H H 121.27 2.92 10.53 14.73 96.51 59.83 -73.99 -24.00 30.32 0.95 68.74 11.71 5.43 12.97 43.80 25.10 0.08 0.54 0.37 31 L H H 99.65 3.68 10.45 15.69 96.51 54.75 -75.30 -18.74 35.65 1.07 63.28 16.71 6.68 12.60 41.22 21.68 0.06 0.56 0.49 32 L H H 91.57 5.86 9.32 16.80 97.34 66.15 -81.59 -11.01 39.33 1.25 59.41 21.52 6.30 11.68 32.82 26.41 0.03 0.65 0.57 33 E C T 136.56 2.32 10.66 14.36 96.20 82.14 -70.96 -22.19 53.31 1.00 45.69 13.24 9.81 29.78 24.11 21.94 0.06 0.48 0.59 34 H C T 155.63 1.18 10.89 12.28 99.38 48.74 -93.92 5.85 63.51 0.90 35.60 18.42 13.63 32.09 15.35 19.44 0.02 0.40 0.64 35 K C C 94.20 7.25 7.25 16.03 118.47 107.56 -87.27 142.38 97.48 0.48 2.04 48.51 47.84 1.09 1.71 0.31 0.00 0.11 0.42 36 P C C 82.88 2.37 11.28 14.78 113.32 -106.17 -65.01 149.98 90.65 0.49 8.87 85.21 2.91 2.94 7.05 1.37 0.00 0.17 0.35 37 S H H 82.68 2.50 9.36 13.54 94.35 -115.11 -62.34 -33.08 41.15 0.45 58.40 15.04 11.63 15.61 49.06 8.18 0.03 0.17 0.28 38 T H H 98.21 1.23 12.00 13.02 94.11 59.24 -68.85 -34.53 29.17 0.51 70.31 8.82 7.37 13.79 61.28 8.19 0.07 0.24 0.23 39 R H H 118.49 3.97 11.31 16.76 95.08 53.57 -69.20 -37.21 21.98 0.78 77.24 11.23 4.75 7.34 67.01 8.94 0.03 0.46 0.24 40 T H H 55.54 7.66 10.03 19.26 93.42 54.87 -66.27 -38.77 18.93 0.85 80.23 10.86 3.62 5.84 70.52 8.37 0.02 0.53 0.24 41 R H H 158.23 1.76 13.79 15.94 92.62 55.02 -65.77 -35.10 21.60 0.81 77.59 8.53 3.84 9.59 63.73 13.48 0.07 0.50 0.27 42 R H H 156.99 2.05 14.28 16.68 93.02 56.71 -70.90 -25.60 28.80 0.95 70.25 9.06 4.71 14.84 57.12 13.22 0.12 0.56 0.37 43 L H H 68.18 10.59 10.43 21.81 96.71 55.90 -86.64 -4.00 43.24 2.58 54.18 18.12 8.33 17.95 43.32 9.64 0.13 1.44 1.06 44 D C C 95.33 4.99 12.45 19.35 109.27 105.78 -78.56 123.02 76.93 4.70 18.37 35.56 15.15 26.42 14.87 3.74 0.06 2.63 1.58 45 G C C 46.99 2.77 15.28 18.63 122.22 45.18 110.39 -168.56 83.39 12.90 3.70 33.58 26.41 24.31 1.44 1.94 0.01 11.21 1.11 46 R C C 151.33 5.20 12.88 20.01 119.11 -49.52 -101.77 137.43 64.29 34.44 1.28 53.17 7.87 1.66 0.51 0.67 0.00 35.18 0.94 47 T E E 64.36 8.36 13.75 23.65 127.03 -171.72 -127.40 144.46 12.78 86.78 0.44 11.93 0.99 0.22 0.32 0.17 0.00 85.07 1.31 48 V E E 94.41 5.61 16.57 23.65 116.88 -131.12 -94.92 131.96 9.58 90.23 0.18 9.19 0.52 0.09 0.15 0.06 0.00 87.88 2.11 49 V E E 32.03 16.34 9.72 25.91 123.33 -164.10 -106.15 146.05 49.45 50.38 0.18 48.17 1.15 0.10 0.10 0.07 0.00 48.92 1.48 50 A C C 51.53 3.79 16.54 21.07 118.39 -111.51 -74.15 158.09 95.15 4.65 0.20 94.55 1.01 0.09 0.10 0.05 0.00 3.89 0.30 51 A H G 78.54 4.15 12.22 18.39 91.20 -107.81 -57.98 -35.99 20.04 0.18 79.77 1.76 2.17 14.98 28.37 52.52 0.02 0.11 0.07 52 N H G 130.29 0.72 15.64 14.60 90.69 58.36 -69.89 -20.10 19.74 0.12 80.14 1.14 1.59 15.85 26.65 54.63 0.02 0.07 0.06 53 D H G 47.72 10.81 11.52 23.57 96.94 51.08 -96.08 -2.54 16.62 0.31 83.08 4.61 2.15 9.37 26.12 57.45 0.01 0.19 0.10 54 T H H 45.90 13.18 11.34 25.03 92.62 96.84 -60.41 -41.84 2.44 0.01 97.55 1.01 0.27 1.07 96.12 1.51 0.00 0.00 0.00 55 K H H 147.36 1.15 17.93 17.63 91.75 51.62 -64.74 -39.13 1.14 0.01 98.84 0.17 0.09 0.79 97.60 1.33 0.00 0.01 0.00 56 R H H 131.11 2.70 17.08 19.89 92.07 49.47 -65.37 -40.84 0.69 0.03 99.27 0.11 0.06 0.48 98.12 1.19 0.00 0.03 0.00 57 V H H 29.21 14.62 12.34 27.58 92.37 49.56 -65.09 -42.08 0.73 0.02 99.25 0.15 0.07 0.46 98.43 0.87 0.00 0.01 0.00 58 T H H 65.53 7.15 14.67 22.98 91.74 52.61 -63.56 -39.57 3.11 0.03 96.86 0.44 0.24 2.33 94.05 2.90 0.01 0.02 0.01 59 S H H 79.79 1.28 15.81 16.15 92.35 53.04 -66.50 -34.62 12.75 0.02 87.23 0.58 0.48 11.56 83.26 4.08 0.01 0.01 0.01 60 L H H 94.13 5.13 13.02 19.42 94.02 52.50 -73.59 -26.69 22.29 0.09 77.63 1.66 1.46 18.61 74.65 3.51 0.03 0.03 0.05 61 L C H 81.77 8.90 9.19 18.92 99.95 61.89 -84.19 -6.58 51.78 3.33 44.88 18.77 12.95 22.26 39.91 2.73 0.20 1.22 1.96 62 N C C 125.04 1.81 11.47 14.25 103.84 56.42 -81.24 30.74 89.83 1.65 8.52 60.42 2.37 26.65 7.81 1.11 0.00 0.92 0.73 63 G C C 52.77 3.34 12.48 17.42 109.48 -117.01 80.43 23.50 99.81 0.14 0.04 99.35 0.31 0.20 0.02 0.01 0.00 0.09 0.02