# 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 123.97 4.03 10.33 15.82 109.96 97.90 -90.58 116.73 99.85 0.13 0.03 99.82 0.06 0.03 0.00 0.00 0.00 0.05 0.02 1 T C C 98.66 2.45 9.02 12.97 112.08 98.78 -94.35 123.97 77.62 3.79 18.60 72.10 1.82 5.74 6.94 9.45 0.00 2.06 1.89 2 A H G 80.42 2.72 8.15 12.50 105.02 -134.99 -82.17 4.73 48.55 2.14 49.31 26.03 8.92 13.97 6.89 42.32 0.00 1.23 0.64 3 S H G 85.55 1.97 9.15 12.44 101.96 78.22 -82.76 -6.19 47.82 1.50 50.68 18.43 9.70 19.83 6.99 43.69 0.01 0.83 0.53 4 Y C G 160.66 2.55 9.25 13.23 104.31 68.05 -90.29 17.30 50.48 1.54 47.97 24.29 10.36 16.36 9.01 38.51 0.01 0.78 0.69 5 L C C 94.32 4.10 9.07 15.04 111.06 120.84 -86.13 122.29 68.28 0.83 30.89 45.80 18.32 5.17 23.08 6.81 0.00 0.32 0.49 6 P H H 82.81 3.53 10.56 15.64 98.90 -110.84 -67.87 -25.87 38.84 0.59 60.56 25.39 4.74 8.80 36.15 24.35 0.00 0.32 0.25 7 S H G 74.76 2.74 10.80 14.79 96.02 57.86 -68.07 -28.72 15.18 0.27 84.55 4.53 2.04 7.59 40.95 44.64 0.01 0.17 0.07 8 I H G 115.16 1.85 11.45 13.95 94.07 58.90 -69.91 -33.59 17.00 0.20 82.80 2.00 1.88 11.26 39.69 44.96 0.02 0.11 0.08 9 F H H 119.30 3.11 11.92 16.20 94.75 51.17 -75.98 -25.90 21.07 0.18 78.75 2.30 2.08 14.22 44.64 36.54 0.04 0.09 0.09 10 V H H 74.49 4.14 11.52 17.52 92.44 64.67 -63.48 -42.53 8.57 0.09 91.33 3.08 1.99 3.91 85.19 5.73 0.01 0.04 0.04 11 P H H 77.51 2.68 13.63 17.10 91.92 50.55 -64.63 -38.96 6.10 0.06 93.84 1.43 0.59 3.80 87.29 6.82 0.01 0.04 0.02 12 L H H 100.93 1.75 14.79 16.23 92.72 48.98 -66.96 -39.50 3.79 0.05 96.16 0.67 0.40 2.54 89.41 6.91 0.02 0.03 0.02 13 I H H 90.87 2.70 14.08 17.49 92.30 49.67 -65.70 -41.28 2.93 0.03 97.03 0.51 0.35 1.95 93.09 4.07 0.01 0.02 0.01 14 G H H 33.81 4.10 12.69 18.50 92.33 51.21 -64.91 -40.11 11.85 0.04 88.12 0.67 0.57 10.65 83.28 4.77 0.02 0.02 0.02 15 L H H 107.12 1.79 14.70 16.34 93.09 48.74 -67.53 -38.63 27.70 0.04 72.26 0.55 1.05 26.52 68.17 3.63 0.04 0.01 0.03 16 V H H 91.34 1.65 15.18 16.24 94.25 46.75 -69.52 -40.76 11.76 0.02 88.22 0.36 0.84 10.70 86.84 1.22 0.03 0.00 0.02 17 F H H 113.12 2.59 14.33 17.48 92.70 50.05 -65.52 -41.61 3.50 0.01 96.49 1.05 0.49 1.62 96.34 0.49 0.00 0.00 0.00 18 P H H 68.49 3.35 13.69 18.31 91.94 50.96 -64.42 -40.23 0.99 0.00 99.01 0.26 0.06 0.51 98.84 0.33 0.00 0.00 0.00 19 A H H 63.02 1.88 15.22 16.88 91.98 50.98 -64.00 -41.23 0.14 0.00 99.86 0.02 0.01 0.08 99.76 0.14 0.00 0.00 0.00 20 I H H 102.43 1.59 15.84 16.65 92.15 49.19 -65.03 -41.71 0.06 0.00 99.94 0.01 0.00 0.03 99.92 0.03 0.00 0.00 0.00 21 T H H 69.14 2.84 14.53 18.13 92.09 49.58 -64.25 -41.75 0.07 0.00 99.93 0.01 0.00 0.04 99.93 0.02 0.00 0.00 0.00 22 M H H 102.07 2.36 15.02 17.70 91.90 50.15 -64.40 -41.16 0.08 0.00 99.92 0.01 0.00 0.05 99.92 0.02 0.00 0.00 0.00 23 A H H 59.79 1.83 15.09 16.71 91.63 50.69 -63.59 -41.70 0.14 0.00 99.86 0.01 0.00 0.09 99.87 0.03 0.00 0.00 0.00 24 S H H 61.33 1.99 14.92 16.85 91.80 50.29 -64.58 -41.02 0.36 0.00 99.64 0.03 0.01 0.25 99.65 0.06 0.00 0.00 0.00 25 L H H 89.76 2.34 14.07 16.89 91.69 50.92 -64.45 -41.18 0.39 0.00 99.61 0.04 0.02 0.26 99.59 0.09 0.00 0.00 0.00 26 F H H 116.86 1.85 13.93 15.84 91.66 50.93 -64.34 -41.38 0.53 0.00 99.47 0.07 0.03 0.35 99.34 0.21 0.00 0.00 0.00 27 I H H 96.34 1.63 13.68 15.16 91.84 50.11 -64.88 -41.46 0.89 0.01 99.10 0.12 0.06 0.61 98.85 0.35 0.00 0.01 0.00 28 Y H H 129.73 1.86 12.60 14.79 92.64 49.30 -66.12 -40.52 2.08 0.05 97.87 0.35 0.17 1.43 97.39 0.61 0.01 0.04 0.01 29 I H H 100.31 1.87 11.39 13.90 93.34 49.37 -66.69 -39.60 5.50 0.18 94.32 1.22 0.64 3.53 93.61 0.83 0.01 0.12 0.04 30 E H H 127.16 1.44 10.86 12.68 94.43 51.14 -70.09 -32.33 14.22 0.27 85.51 3.52 1.89 8.59 84.49 1.25 0.02 0.14 0.09 31 Q H H 124.77 1.60 9.83 12.18 96.98 55.80 -77.50 -20.44 32.68 0.51 66.81 9.08 5.25 18.79 63.99 2.38 0.04 0.23 0.23 32 D C H 108.10 1.90 8.88 12.02 101.61 67.99 -81.25 10.50 53.57 1.13 45.30 20.54 9.32 23.64 42.23 3.26 0.03 0.56 0.42 33 E C C 139.99 1.84 8.22 11.48 104.73 117.00 -85.08 52.05 68.11 3.32 28.57 36.09 10.39 20.87 25.12 4.46 0.02 2.04 1.00 34 I C C 127.40 2.05 7.05 10.78 108.65 85.93 -89.61 92.37 82.07 4.06 13.87 69.76 2.37 9.11 12.91 1.82 0.00 2.45 1.58 35 I C C 122.04 2.86 9.63 14.19 110.21 -152.74 -93.02 103.88 99.89 0.09 0.02 99.85 0.05 0.03 0.01 0.00 0.00 0.05 0.01