# 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 106.77 5.00 11.09 17.51 106.85 63.55 -79.46 103.82 99.87 0.02 0.10 99.77 0.07 0.08 0.06 0.00 0.00 0.01 0.00 1 K C C 137.30 2.30 10.45 13.83 100.98 122.99 -75.38 -27.62 62.44 0.35 37.20 53.72 1.04 6.60 36.76 1.55 0.00 0.13 0.20 2 H H H 128.28 2.08 9.52 12.69 96.25 58.87 -69.06 -33.80 35.49 0.40 64.11 21.66 5.12 9.28 60.47 3.09 0.01 0.16 0.22 3 F H H 133.01 2.14 9.99 13.24 93.44 56.22 -66.28 -37.67 11.66 0.14 88.20 5.43 1.84 4.72 81.93 5.92 0.01 0.07 0.06 4 L H H 100.88 2.08 11.34 14.27 92.84 51.66 -66.47 -38.41 6.74 0.10 93.15 2.41 1.06 3.35 86.01 7.06 0.02 0.06 0.03 5 T H H 79.85 2.25 12.23 15.21 93.54 50.04 -67.01 -39.30 7.11 0.11 92.77 2.10 1.11 3.98 85.45 7.22 0.02 0.07 0.04 6 Y H H 131.00 2.94 11.91 15.96 94.02 48.66 -68.70 -36.84 8.56 0.11 91.34 2.17 1.26 5.07 83.28 8.09 0.04 0.06 0.05 7 L H H 100.52 3.28 12.07 16.60 94.15 51.51 -74.31 -25.79 17.61 0.19 82.19 3.67 2.20 11.54 72.29 10.05 0.05 0.10 0.10 8 S H H 71.74 3.06 12.75 16.87 96.48 56.42 -83.21 -11.63 46.27 0.31 53.42 6.06 4.93 35.05 45.07 8.44 0.08 0.14 0.23 9 T C T 70.50 4.69 11.37 17.77 112.04 84.14 -89.29 133.81 62.18 0.83 36.99 14.67 15.75 32.74 29.69 6.12 0.06 0.29 0.68 10 A H H 65.03 3.50 12.13 16.97 100.58 -106.78 -70.06 -36.47 39.82 0.25 59.94 14.28 19.64 4.97 59.98 0.94 0.01 0.05 0.13 11 P H H 88.62 2.38 13.06 16.00 94.01 47.43 -65.44 -36.84 9.42 0.06 90.53 3.20 1.45 4.45 89.90 0.94 0.00 0.02 0.03 12 V H H 84.50 2.53 13.42 16.60 93.33 51.04 -65.97 -40.62 2.54 0.04 97.42 0.95 0.29 1.17 96.92 0.63 0.00 0.02 0.01 13 L H H 83.90 3.34 13.35 17.94 92.41 50.15 -65.37 -40.95 0.61 0.01 99.38 0.23 0.06 0.25 99.17 0.28 0.00 0.00 0.00 14 A H H 54.17 3.13 13.53 17.89 92.08 51.12 -64.23 -40.52 0.31 0.00 99.69 0.09 0.02 0.14 99.64 0.11 0.00 0.00 0.00 15 A H H 59.80 2.16 14.75 17.11 92.16 50.83 -64.68 -41.07 0.16 0.00 99.84 0.03 0.01 0.08 99.82 0.06 0.00 0.00 0.00 16 I H H 95.86 2.00 14.85 16.84 92.07 49.78 -64.67 -41.52 0.13 0.00 99.87 0.02 0.01 0.07 99.86 0.04 0.00 0.00 0.00 17 W H H 139.55 2.60 14.24 17.56 92.08 49.80 -65.06 -40.97 0.18 0.00 99.82 0.03 0.01 0.11 99.82 0.04 0.00 0.00 0.00 18 M H H 104.94 2.39 14.34 17.30 92.00 50.63 -64.62 -40.89 0.25 0.00 99.74 0.05 0.01 0.15 99.75 0.04 0.00 0.00 0.00 19 T H H 83.96 1.63 15.10 16.25 92.15 49.79 -65.13 -41.05 0.47 0.01 99.53 0.13 0.04 0.26 99.51 0.05 0.00 0.00 0.00 20 I H H 101.13 1.89 15.30 16.94 92.49 47.85 -65.20 -41.42 0.57 0.01 99.42 0.11 0.04 0.36 99.41 0.08 0.00 0.00 0.00 21 T H H 70.78 2.89 15.04 18.52 92.63 48.46 -65.52 -41.25 1.06 0.01 98.93 0.15 0.08 0.74 98.90 0.12 0.00 0.01 0.00 22 A H H 54.91 2.61 14.91 18.12 91.88 51.00 -64.02 -41.12 0.93 0.00 99.06 0.13 0.07 0.57 99.12 0.09 0.00 0.00 0.00 23 G H H 35.40 2.47 14.84 17.86 92.01 51.17 -63.46 -41.39 0.79 0.00 99.21 0.13 0.06 0.47 99.26 0.09 0.00 0.00 0.00 24 I H H 94.82 2.25 15.44 17.74 92.12 49.88 -64.73 -41.30 0.53 0.00 99.47 0.07 0.03 0.32 99.49 0.08 0.00 0.00 0.00 25 L H H 91.08 2.64 14.89 18.11 92.19 50.04 -64.87 -41.09 0.39 0.00 99.61 0.05 0.02 0.23 99.60 0.09 0.00 0.00 0.00 26 I H H 90.87 2.43 14.61 17.40 92.00 49.95 -64.66 -41.37 0.38 0.00 99.62 0.05 0.02 0.23 99.59 0.11 0.00 0.00 0.00 27 E H H 102.05 2.06 14.59 16.81 92.01 50.34 -64.12 -40.94 0.67 0.00 99.32 0.07 0.03 0.47 99.18 0.25 0.00 0.00 0.00 28 F H H 106.82 2.82 13.52 17.07 92.07 49.65 -65.19 -40.20 0.87 0.00 99.13 0.08 0.05 0.64 98.60 0.63 0.00 0.00 0.00 29 N H H 79.42 4.50 11.38 17.53 92.35 51.69 -67.49 -33.20 2.61 0.00 97.38 0.15 0.10 2.24 95.73 1.78 0.00 0.00 0.00 30 R H H 159.66 1.44 12.53 14.11 93.73 50.67 -69.81 -35.88 7.75 0.00 92.25 0.17 0.25 7.66 90.56 1.35 0.01 0.00 0.00 31 F H H 152.42 1.15 12.31 12.95 97.83 38.42 -82.09 -29.82 11.82 0.02 88.16 0.34 1.05 10.69 87.19 0.68 0.03 0.00 0.02 32 Y C C 119.11 3.73 9.34 14.81 109.31 32.69 -125.28 72.53 98.07 0.45 1.48 63.60 33.10 1.25 1.14 0.32 0.00 0.11 0.49 33 P C G 89.75 3.34 9.16 14.57 97.82 167.93 -63.63 -27.33 54.15 0.27 45.58 9.61 4.82 38.49 7.66 39.10 0.00 0.14 0.18 34 D H G 116.09 1.31 11.72 13.34 95.69 57.22 -75.60 -2.05 47.29 0.22 52.49 5.71 4.40 35.74 9.53 44.36 0.00 0.11 0.14 35 L H G 89.83 5.09 9.15 15.99 96.46 86.05 -76.84 -6.22 35.38 0.55 64.06 17.89 5.26 11.80 8.17 56.38 0.00 0.31 0.20 36 L C G 109.64 3.89 9.61 15.16 98.04 81.34 -75.16 -17.99 53.22 1.27 45.51 17.34 11.59 25.10 6.89 37.79 0.01 0.64 0.63 37 F C G 155.95 1.80 10.22 13.15 108.06 55.70 -99.28 39.30 60.79 5.09 34.12 20.35 15.52 26.20 4.63 28.27 0.04 1.83 3.16 38 H C S 124.11 3.43 7.26 12.78 116.91 115.28 -98.29 132.41 96.89 2.53 0.58 44.67 51.25 1.30 0.17 0.33 0.00 1.26 1.01 39 P C C 113.58 1.37 9.00 11.63 110.93 -110.93 -69.59 142.66 99.03 0.75 0.22 96.63 1.52 1.07 0.06 0.09 0.00 0.41 0.23 40 L C C 125.96 3.22 9.27 14.29 107.82 -119.69 -81.25 104.98 99.96 0.04 0.00 99.85 0.09 0.03 0.00 0.00 0.00 0.01 0.01