# 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 114.54 5.84 11.51 18.68 114.16 -165.54 -92.56 132.26 99.68 0.25 0.07 99.40 0.23 0.15 0.03 0.01 0.00 0.12 0.05 1 A C C 77.03 4.25 9.33 15.13 110.98 -136.68 -81.26 129.74 90.76 2.47 6.77 79.33 2.47 9.90 2.43 3.18 0.00 1.41 1.29 2 G C C 54.15 2.82 9.19 13.48 110.89 -112.58 -89.71 144.38 85.64 2.85 11.51 48.62 17.88 19.31 2.86 8.46 0.00 1.46 1.40 3 H C C 144.89 2.39 8.75 12.65 107.66 -56.36 -87.62 95.20 79.91 2.75 17.34 44.01 18.33 17.75 4.81 12.29 0.00 1.33 1.47 4 H C C 133.32 3.30 7.97 12.94 110.27 112.11 -91.71 115.07 77.45 2.37 20.18 45.10 16.46 15.88 6.72 13.33 0.01 1.10 1.41 5 T C C 98.93 2.81 8.79 13.27 107.83 -157.73 -90.55 70.99 74.54 1.69 23.77 40.04 16.67 18.11 9.25 14.09 0.01 0.76 1.07 6 N C C 117.44 2.37 9.50 13.25 107.71 68.58 -90.46 66.23 71.05 2.11 26.85 37.59 16.08 17.70 10.60 15.82 0.01 1.00 1.20 7 Y C C 150.23 4.00 8.15 13.90 109.34 106.95 -91.79 93.93 68.57 3.07 28.36 43.71 12.00 12.65 11.62 16.88 0.01 1.61 1.52 8 K C C 144.92 2.48 9.41 13.46 108.47 105.14 -93.17 85.89 69.54 5.40 25.06 45.53 11.42 12.33 10.84 14.38 0.02 3.01 2.48 9 W C C 180.27 3.07 8.28 13.02 109.81 98.59 -91.60 109.97 75.34 5.10 19.56 41.38 15.56 19.06 7.73 11.13 0.02 2.68 2.43 10 N C C 122.34 2.07 8.92 12.41 108.98 68.66 -96.70 84.27 87.21 3.30 9.48 46.12 23.26 18.27 3.27 5.73 0.01 1.54 1.80 11 G C C 44.97 3.32 8.63 13.68 124.54 -107.54 -138.29 172.97 96.78 2.13 1.10 58.77 33.93 4.14 0.31 0.77 0.00 1.00 1.07 12 P C C 116.34 1.46 10.01 12.39 110.19 -61.62 -71.78 140.70 96.71 2.04 1.25 67.77 21.83 6.97 0.28 1.07 0.00 1.03 1.06 13 L C C 116.12 3.35 7.34 12.64 117.30 -107.03 -92.10 136.68 96.62 2.43 0.95 67.57 24.33 4.62 0.23 0.77 0.00 1.12 1.36 14 P C C 108.47 1.88 9.81 13.09 113.66 -106.46 -73.70 145.43 97.61 1.63 0.76 71.87 21.42 4.20 0.18 0.63 0.00 0.83 0.88 15 R C C 168.23 2.73 8.47 13.25 116.08 -115.37 -90.53 133.77 97.98 1.55 0.47 74.64 21.91 1.40 0.16 0.29 0.00 0.67 0.92 16 P C C 92.31 4.04 8.85 14.74 113.03 -107.68 -68.41 146.52 98.01 0.88 1.11 83.68 10.14 4.21 0.33 0.72 0.00 0.45 0.47 17 H C C 158.46 1.41 10.54 12.96 112.92 -123.59 -87.15 128.41 96.35 1.99 1.66 82.60 10.89 2.59 0.84 0.71 0.00 0.74 1.63 18 V C C 77.43 8.27 6.61 15.86 116.50 -141.51 -92.20 138.69 97.38 1.15 1.48 87.95 8.44 0.88 1.11 0.34 0.00 0.40 0.89 19 S C C 66.83 1.96 12.51 14.89 115.60 -106.78 -70.35 154.05 97.06 0.58 2.36 94.53 1.99 0.76 1.93 0.25 0.00 0.19 0.35 20 A H H 86.11 1.87 10.19 13.47 92.62 -111.74 -58.68 -36.51 7.58 0.03 92.39 1.59 1.27 4.64 90.45 2.02 0.01 0.01 0.02 21 G H H 52.99 0.96 12.57 12.77 92.11 53.76 -64.96 -38.57 5.61 0.02 94.36 0.94 0.64 3.80 92.25 2.33 0.01 0.01 0.01 22 H H H 92.49 4.93 11.89 18.25 93.10 49.29 -68.47 -37.60 2.40 0.03 97.57 0.79 0.30 1.28 95.50 2.11 0.00 0.02 0.00 23 R H H 104.17 7.47 12.59 21.27 92.19 53.21 -63.54 -42.06 1.08 0.01 98.91 0.39 0.11 0.49 98.66 0.33 0.00 0.01 0.00 24 I H H 102.73 1.73 16.93 17.85 91.94 49.16 -64.68 -41.74 0.51 0.00 99.49 0.12 0.04 0.27 99.46 0.11 0.00 0.00 0.00 25 A H H 57.95 2.24 17.13 19.01 91.71 49.56 -64.49 -41.81 0.23 0.00 99.77 0.04 0.01 0.12 99.77 0.06 0.00 0.00 0.00 26 T H H 43.74 8.24 14.10 23.84 92.23 50.39 -64.92 -41.26 0.17 0.00 99.83 0.03 0.01 0.10 99.82 0.04 0.00 0.00 0.00 27 K H H 108.03 5.39 16.83 22.91 91.80 50.63 -64.23 -41.26 0.12 0.00 99.88 0.01 0.01 0.08 99.88 0.03 0.00 0.00 0.00 28 F H H 127.47 1.57 18.79 18.96 91.99 49.53 -64.63 -41.91 0.13 0.00 99.87 0.01 0.01 0.09 99.87 0.03 0.00 0.00 0.00 29 L H H 87.95 3.17 18.21 21.26 91.99 49.02 -64.84 -41.62 0.17 0.00 99.83 0.01 0.01 0.12 99.83 0.03 0.00 0.00 0.00 30 G H H 24.00 7.50 15.09 24.05 91.87 50.85 -64.01 -41.44 0.27 0.00 99.73 0.02 0.01 0.18 99.75 0.03 0.00 0.00 0.00 31 A H H 53.84 3.31 17.31 20.94 91.76 50.84 -63.95 -41.33 0.27 0.00 99.73 0.02 0.01 0.18 99.76 0.03 0.00 0.00 0.00 32 T H H 74.80 2.08 17.95 19.26 91.82 50.04 -64.93 -41.07 0.31 0.00 99.69 0.03 0.01 0.20 99.72 0.03 0.00 0.00 0.00 33 M H H 87.37 4.35 16.30 21.25 91.97 50.40 -64.99 -41.13 0.32 0.00 99.68 0.04 0.01 0.20 99.72 0.03 0.00 0.00 0.00 34 F H H 100.79 5.06 15.84 21.57 91.92 50.37 -64.24 -41.70 0.23 0.00 99.77 0.02 0.01 0.16 99.78 0.03 0.00 0.00 0.00 35 F H H 116.86 2.18 16.94 18.70 91.67 50.26 -64.53 -41.75 0.18 0.00 99.82 0.01 0.01 0.13 99.83 0.02 0.00 0.00 0.00 36 W H H 136.27 2.52 16.67 19.15 91.80 50.23 -64.31 -42.06 0.11 0.00 99.89 0.00 0.00 0.08 99.89 0.02 0.00 0.00 0.00 37 M H H 82.40 5.19 15.62 21.62 91.85 49.75 -64.25 -42.12 0.10 0.00 99.90 0.00 0.00 0.08 99.88 0.03 0.00 0.00 0.00 38 F H H 102.80 3.79 16.07 20.42 91.81 49.72 -64.21 -41.44 0.23 0.00 99.77 0.01 0.01 0.19 99.73 0.06 0.00 0.00 0.00 39 L H H 84.38 2.51 16.41 18.95 91.72 50.37 -64.34 -41.86 0.57 0.00 99.43 0.03 0.03 0.48 99.31 0.14 0.00 0.00 0.00 40 R H H 108.04 3.86 15.46 20.20 92.29 49.69 -65.20 -40.92 1.29 0.00 98.71 0.10 0.09 1.08 98.43 0.30 0.00 0.00 0.00 41 I H H 72.45 5.69 13.24 20.40 92.07 50.39 -65.38 -39.74 1.95 0.01 98.04 0.21 0.17 1.50 97.32 0.78 0.01 0.00 0.00 42 K H H 123.44 2.93 14.81 18.31 93.16 49.78 -69.02 -36.55 3.93 0.01 96.06 0.27 0.25 3.32 94.74 1.40 0.01 0.00 0.00 43 E H H 123.71 2.21 14.74 17.05 96.74 43.09 -80.02 -33.42 11.35 0.02 88.62 0.44 0.63 10.33 87.19 1.37 0.02 0.01 0.01 44 E H H 102.17 4.15 13.47 18.65 101.30 35.76 -94.78 -18.85 27.92 0.15 71.94 3.49 4.42 20.32 70.08 1.46 0.06 0.05 0.11 45 Y H H 104.03 4.98 12.74 19.30 99.21 59.47 -72.51 -29.78 39.58 0.46 59.96 29.17 5.20 6.86 52.34 5.99 0.01 0.21 0.23 46 P H H 53.87 5.53 11.75 19.39 93.20 68.01 -63.41 -37.23 13.93 0.29 85.77 3.77 2.03 7.69 67.54 18.65 0.05 0.18 0.10 47 A H H 60.64 4.02 12.18 17.67 93.29 53.17 -66.01 -38.77 7.94 0.22 91.84 1.28 0.94 5.01 71.16 21.35 0.05 0.15 0.06 48 M H H 127.86 2.31 12.17 15.31 92.62 50.93 -68.73 -32.28 10.72 0.22 89.06 1.12 1.09 7.54 70.14 19.79 0.11 0.13 0.08 49 L H T 109.03 2.48 11.17 14.72 93.84 48.41 -87.92 -2.93 48.26 0.34 51.40 1.30 3.42 42.12 32.86 19.63 0.19 0.16 0.32 50 G C T 55.84 1.97 12.08 15.06 96.08 -108.90 80.21 10.49 98.23 0.15 1.63 3.85 6.82 87.83 0.73 0.62 0.00 0.08 0.07 51 L C C 101.59 3.81 10.38 15.90 101.98 120.03 -87.50 2.13 94.78 2.22 3.00 52.77 31.23 10.67 0.98 2.06 0.00 0.99 1.31 52 H C C 112.23 5.40 11.38 18.50 121.63 60.93 -112.83 143.15 92.82 4.11 3.07 48.42 37.38 6.96 0.82 2.22 0.00 1.84 2.36 53 N C C 93.40 5.68 10.86 18.29 116.43 -134.06 -94.54 134.75 95.15 3.15 1.70 72.35 17.75 4.65 0.39 1.50 0.00 1.61 1.74 54 F C C 142.03 4.10 11.35 17.14 100.99 -150.80 -83.31 0.25 96.46 2.20 1.33 59.45 30.95 5.94 0.31 1.07 0.00 1.06 1.20 55 Y C C 134.51 4.40 9.49 15.80 119.89 75.80 -108.12 136.40 96.03 3.00 0.97 54.98 37.29 3.67 0.32 0.60 0.00 1.10 2.04 56 P C C 92.54 3.16 11.44 16.05 113.08 -106.95 -73.00 145.17 95.43 1.42 3.16 64.37 19.78 11.15 1.04 2.16 0.00 0.70 0.80 57 P C C 90.34 5.17 8.99 15.74 107.35 -111.31 -75.41 131.04 88.28 1.81 9.91 48.04 18.50 21.86 3.09 6.57 0.00 0.82 1.11 58 K C C 137.36 2.86 9.88 14.30 107.50 86.54 -86.75 89.18 77.12 2.75 20.13 38.95 18.59 20.15 7.39 11.92 0.01 1.17 1.82 59 E C T 135.78 2.41 9.86 13.66 105.91 -117.74 -80.70 73.46 69.90 2.06 28.04 25.91 17.33 27.79 11.13 15.55 0.04 0.91 1.35 60 G C C 47.36 3.73 10.51 15.69 103.01 26.44 38.27 -9.55 67.85 1.81 30.35 27.50 15.93 25.75 13.52 15.30 0.04 0.76 1.20 61 E C C 116.14 4.15 9.42 15.19 100.09 80.63 -75.20 -19.08 60.40 2.03 37.57 33.76 12.32 14.40 20.22 17.23 0.02 0.94 1.12 62 K C C 135.45 2.81 10.12 14.39 102.23 72.59 -80.70 -4.04 58.12 2.49 39.40 30.55 12.03 15.89 21.68 17.38 0.04 1.26 1.17 63 A C C 73.67 3.44 8.86 13.94 103.66 76.74 -83.36 6.23 59.35 2.75 37.90 32.21 12.42 15.09 20.24 17.37 0.04 1.43 1.21 64 V C C 106.28 2.90 8.05 12.60 108.61 87.33 -91.39 94.42 66.14 3.64 30.21 38.77 13.89 14.19 16.94 12.62 0.04 1.91 1.63 65 E C C 144.78 1.85 8.31 11.66 109.62 67.83 -89.88 104.72 84.30 1.84 13.87 71.83 2.21 11.86 8.13 4.05 0.00 1.01 0.91 66 H C C 135.18 3.72 9.41 14.86 109.82 -155.64 -90.78 104.70 99.81 0.11 0.08 99.56 0.17 0.15 0.04 0.01 0.00 0.06 0.02