# 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 P C C 97.94 3.11 11.33 15.76 110.87 -108.14 -71.78 142.69 99.97 0.03 0.01 99.84 0.11 0.04 0.00 0.00 0.00 0.01 0.01 1 F C C 165.93 1.94 8.13 11.64 108.64 -130.72 -89.02 110.28 95.44 3.68 0.88 92.03 1.73 1.63 0.37 0.33 0.00 1.28 2.63 2 V C C 110.50 2.32 7.35 11.44 116.96 -155.07 -100.50 131.91 95.07 3.22 1.70 75.55 17.13 2.09 0.81 0.87 0.00 1.42 2.13 3 P C C 96.12 2.50 8.68 12.83 114.54 -117.13 -77.45 147.61 84.90 1.29 13.80 72.78 7.28 4.94 3.94 9.77 0.00 0.70 0.59 4 P H G 99.93 3.11 8.75 13.59 104.73 -109.00 -71.15 119.54 41.05 0.75 58.20 19.67 6.07 13.94 4.87 54.79 0.00 0.44 0.21 5 S H G 83.19 2.47 9.84 13.76 102.08 67.72 -82.12 2.97 37.44 0.68 61.88 10.98 6.36 19.71 5.91 56.42 0.00 0.38 0.25 6 W H G 168.05 3.35 9.79 14.63 101.35 66.31 -87.43 4.07 38.33 0.95 60.73 16.52 7.75 14.76 8.66 51.42 0.00 0.49 0.40 7 A C H 60.81 4.02 10.29 16.07 99.62 95.97 -69.82 -38.04 51.87 0.63 47.51 32.45 13.36 6.92 36.74 9.93 0.01 0.25 0.35 8 P H H 81.34 3.50 11.10 16.07 95.16 52.33 -68.21 -32.27 20.92 0.33 78.76 9.00 2.96 8.23 55.05 24.43 0.01 0.19 0.13 9 S H H 71.86 2.83 11.60 15.62 94.74 54.11 -68.60 -31.51 9.64 0.12 90.24 1.93 1.08 5.44 59.39 32.04 0.01 0.08 0.03 10 V H H 96.57 2.18 12.35 15.20 94.29 51.89 -70.54 -35.20 13.68 0.11 86.21 1.25 1.26 9.41 56.99 30.95 0.03 0.06 0.05 11 F H H 117.91 3.24 12.64 16.94 94.53 50.03 -73.98 -31.05 21.24 0.12 78.64 1.76 1.99 15.85 59.84 20.35 0.07 0.06 0.07 12 V H H 75.59 3.99 12.34 17.96 92.72 58.74 -64.28 -42.84 8.78 0.07 91.14 2.83 1.93 4.26 85.15 5.75 0.02 0.03 0.04 13 P H H 77.64 2.68 14.15 17.52 92.13 49.71 -64.45 -39.53 6.29 0.06 93.66 1.47 0.62 3.92 87.05 6.88 0.01 0.03 0.02 14 L H H 100.90 1.90 15.03 16.72 92.93 48.36 -67.06 -39.61 4.22 0.05 95.72 0.75 0.46 2.83 88.59 7.31 0.02 0.03 0.02 15 T H H 73.57 2.70 14.31 17.64 92.67 49.11 -65.76 -40.87 4.19 0.05 95.77 0.73 0.53 2.83 91.54 4.32 0.01 0.02 0.02 16 G H H 34.95 3.89 13.08 18.52 92.57 51.09 -65.24 -40.20 15.71 0.04 84.24 0.88 0.80 14.19 79.56 4.49 0.03 0.02 0.03 17 L H H 105.96 1.92 14.73 16.64 93.23 48.80 -67.52 -39.02 34.98 0.05 64.96 0.75 1.42 32.71 61.71 3.31 0.04 0.02 0.04 18 V H H 90.30 1.81 15.30 16.67 93.88 46.69 -69.06 -40.88 11.38 0.02 88.60 0.49 1.03 9.76 87.67 1.02 0.02 0.00 0.02 19 L H H 91.12 2.52 14.61 17.57 92.53 50.05 -64.96 -41.97 2.30 0.00 97.69 0.71 0.29 1.00 97.66 0.34 0.00 0.00 0.00 20 P H H 69.89 3.14 14.09 18.30 91.92 50.56 -64.31 -40.11 0.60 0.00 99.40 0.16 0.04 0.29 99.30 0.21 0.00 0.00 0.00 21 A H H 62.13 2.00 15.32 17.22 91.95 50.63 -64.10 -41.28 0.09 0.00 99.91 0.01 0.00 0.05 99.86 0.08 0.00 0.00 0.00 22 I H H 101.33 1.65 16.05 16.93 92.17 49.10 -64.75 -41.69 0.04 0.00 99.96 0.00 0.00 0.02 99.95 0.02 0.00 0.00 0.00 23 A H H 55.48 2.62 14.57 17.89 91.93 49.88 -63.73 -41.91 0.06 0.00 99.94 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 24 M H H 103.09 2.21 15.08 17.50 92.00 49.91 -64.48 -41.06 0.08 0.00 99.92 0.00 0.00 0.05 99.93 0.01 0.00 0.00 0.00 25 A H H 59.96 1.88 14.95 16.70 91.58 50.95 -63.48 -41.59 0.13 0.00 99.87 0.01 0.00 0.09 99.88 0.02 0.00 0.00 0.00 26 T H H 77.63 1.73 15.13 16.46 91.71 49.93 -64.66 -40.96 0.29 0.00 99.71 0.02 0.01 0.21 99.73 0.04 0.00 0.00 0.00 27 L H H 90.81 2.04 14.25 16.51 91.56 50.67 -64.18 -41.41 0.26 0.00 99.74 0.02 0.01 0.18 99.75 0.05 0.00 0.00 0.00 28 F H H 115.51 1.89 13.96 15.96 91.62 50.50 -64.25 -41.38 0.27 0.00 99.73 0.02 0.01 0.18 99.71 0.08 0.00 0.00 0.00 29 V H H 82.76 1.69 13.74 15.32 91.72 50.14 -64.24 -41.74 0.34 0.00 99.66 0.03 0.02 0.23 99.61 0.11 0.00 0.00 0.00 30 Y H H 129.52 1.57 13.01 14.55 92.13 49.77 -65.20 -41.07 0.69 0.00 99.30 0.07 0.04 0.49 99.18 0.21 0.00 0.00 0.00 31 I H H 97.63 1.80 11.52 13.92 92.41 49.12 -65.82 -40.22 1.93 0.02 98.05 0.29 0.17 1.35 97.76 0.41 0.00 0.01 0.00 32 E H H 123.74 1.66 10.62 13.02 93.08 51.38 -67.69 -34.52 6.85 0.05 93.10 1.08 0.75 4.74 92.57 0.82 0.01 0.02 0.02 33 K H H 150.90 1.10 10.25 11.64 94.89 52.88 -73.95 -24.36 26.05 0.11 73.84 3.35 3.09 18.98 73.20 1.26 0.02 0.04 0.07 34 E C H 144.46 1.27 9.24 11.08 99.94 52.47 -86.68 -6.35 53.26 0.34 46.40 14.66 8.85 29.46 45.09 1.59 0.01 0.10 0.24 35 A C C 76.22 2.73 7.58 12.21 112.85 100.06 -86.39 131.86 99.76 0.10 0.14 94.31 5.08 0.40 0.10 0.02 0.00 0.04 0.06 36 P C C 106.82 2.02 11.29 14.49 108.53 -102.92 -68.62 139.78 99.98 0.01 0.01 99.89 0.07 0.03 0.00 0.00 0.00 0.00 0.00