# 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 117.59 4.91 10.59 17.08 113.35 -154.03 -85.68 132.25 99.95 0.03 0.01 99.89 0.06 0.03 0.00 0.00 0.00 0.01 0.00 1 A C C 76.09 3.36 9.07 14.16 111.88 -129.90 -83.37 134.42 88.70 1.52 9.78 81.44 1.42 7.25 5.17 3.07 0.00 0.74 0.91 2 D C C 104.47 2.91 8.70 13.30 108.16 -131.03 -86.32 103.21 83.96 1.80 14.23 58.68 12.80 12.38 6.15 8.03 0.00 0.89 1.07 3 K C C 141.33 3.42 9.16 14.13 100.59 68.86 -83.17 1.59 66.00 1.75 32.24 38.13 11.34 16.84 9.34 22.57 0.00 0.89 0.90 4 S C C 78.27 3.10 10.02 14.66 102.55 83.34 -82.90 2.44 64.22 1.89 33.89 31.63 13.36 20.17 9.50 23.38 0.01 0.91 1.04 5 D C C 106.00 2.76 10.26 14.49 103.80 71.34 -90.15 31.23 70.27 2.49 27.24 41.77 14.27 14.49 7.72 19.16 0.00 1.22 1.36 6 L C C 100.38 5.08 8.50 15.38 110.34 120.06 -88.43 112.39 83.88 3.79 12.33 51.08 22.34 10.55 6.28 5.50 0.01 1.51 2.74 7 G C C 47.93 3.42 9.99 14.93 115.30 -162.05 -87.68 149.37 91.15 3.21 5.64 65.70 15.30 9.91 2.29 3.18 0.00 1.47 2.14 8 Y C T 185.13 1.68 9.59 12.37 99.20 -93.22 -82.02 -5.84 90.75 2.14 7.11 29.71 29.41 32.32 1.97 4.43 0.00 0.93 1.22 9 T C T 97.75 2.45 10.10 13.77 102.52 69.22 -87.85 4.45 92.69 1.37 5.95 16.24 33.71 43.34 1.61 3.62 0.00 0.62 0.85 10 G C S 59.04 1.54 11.98 14.10 99.40 -105.01 83.33 3.67 94.66 1.47 3.87 22.48 51.80 20.86 1.00 2.36 0.00 0.67 0.83 11 L C C 76.26 6.59 8.00 16.52 119.11 117.71 -92.62 145.61 92.42 4.14 3.44 63.23 26.02 2.82 2.53 0.93 0.00 1.35 3.11 12 T C C 73.39 2.15 13.84 16.25 119.87 -119.26 -79.76 163.13 91.36 2.99 5.66 81.15 7.84 1.65 5.58 0.69 0.00 1.04 2.04 13 D H H 105.33 2.93 11.59 16.24 92.85 -104.14 -59.14 -38.46 6.38 0.05 93.57 2.21 1.50 2.90 92.19 1.15 0.01 0.02 0.02 14 E H H 134.33 1.05 14.38 14.50 92.19 51.50 -64.74 -39.77 3.39 0.02 96.59 0.77 0.44 2.06 95.52 1.18 0.01 0.01 0.01 15 Q H H 92.59 2.71 13.85 17.25 92.36 49.06 -66.09 -40.10 1.95 0.02 98.04 0.57 0.23 1.06 96.93 1.18 0.00 0.01 0.00 16 A H H 39.78 5.28 11.72 19.26 92.03 51.96 -64.04 -41.46 1.23 0.01 98.77 0.39 0.13 0.60 98.27 0.60 0.00 0.00 0.00 17 Q H H 106.59 2.01 15.41 17.42 91.86 50.33 -64.75 -40.80 1.59 0.01 98.40 0.29 0.13 1.00 98.06 0.51 0.00 0.00 0.00 18 E H H 106.90 1.65 15.63 16.63 91.98 50.40 -64.43 -41.28 2.27 0.01 97.72 0.31 0.16 1.59 97.49 0.45 0.00 0.00 0.00 19 L H H 88.55 2.75 14.93 18.13 92.06 49.73 -64.31 -41.58 1.63 0.00 98.36 0.32 0.15 0.94 98.32 0.27 0.00 0.00 0.00 20 H H H 103.27 3.07 14.61 18.51 91.93 50.38 -64.49 -40.59 0.99 0.00 99.00 0.20 0.08 0.55 99.00 0.17 0.00 0.00 0.00 21 S H H 61.96 2.07 15.22 17.27 92.05 51.07 -64.52 -40.68 0.99 0.00 99.01 0.14 0.07 0.63 98.98 0.18 0.00 0.00 0.00 22 V H H 89.72 1.78 15.11 16.48 92.17 49.48 -65.10 -41.87 0.67 0.00 99.33 0.09 0.05 0.43 99.28 0.15 0.00 0.00 0.00 23 Y H H 133.11 2.24 14.74 17.19 92.24 49.11 -65.22 -41.32 0.46 0.00 99.54 0.08 0.03 0.28 99.53 0.08 0.00 0.00 0.00 24 M H H 100.46 2.29 14.95 17.52 92.00 49.61 -64.60 -41.40 0.33 0.00 99.67 0.05 0.02 0.20 99.67 0.06 0.00 0.00 0.00 25 S H H 61.01 1.91 15.47 17.11 91.97 50.13 -64.20 -41.31 0.29 0.00 99.71 0.04 0.01 0.18 99.71 0.06 0.00 0.00 0.00 26 G H H 36.10 2.45 14.54 17.51 92.06 50.57 -63.80 -41.39 0.36 0.00 99.64 0.03 0.01 0.24 99.64 0.07 0.00 0.00 0.00 27 L H H 92.48 2.61 14.49 17.66 92.15 50.34 -64.96 -40.63 0.26 0.00 99.74 0.02 0.01 0.18 99.74 0.05 0.00 0.00 0.00 28 W H H 155.34 1.72 15.32 16.70 92.03 49.85 -64.96 -41.22 0.17 0.00 99.83 0.01 0.01 0.11 99.84 0.03 0.00 0.00 0.00 29 L H H 99.60 1.49 15.61 16.28 91.89 49.39 -64.48 -41.81 0.14 0.00 99.86 0.01 0.00 0.09 99.87 0.02 0.00 0.00 0.00 30 F H H 118.07 2.27 14.67 17.30 92.02 49.22 -64.92 -41.33 0.11 0.00 99.89 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 31 S H H 57.61 2.99 14.66 18.41 92.00 50.25 -64.25 -41.04 0.11 0.00 99.89 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 32 A H H 63.29 1.54 16.37 16.88 91.76 49.98 -64.12 -41.78 0.10 0.00 99.90 0.01 0.00 0.06 99.91 0.01 0.00 0.00 0.00 33 V H H 85.67 1.79 16.46 17.55 91.96 48.75 -64.60 -41.92 0.07 0.00 99.93 0.01 0.00 0.04 99.93 0.01 0.00 0.00 0.00 34 A H H 47.46 4.31 13.83 19.79 91.96 50.65 -63.93 -41.49 0.08 0.00 99.91 0.01 0.00 0.05 99.92 0.02 0.00 0.00 0.00 35 I H H 96.79 2.14 16.27 18.17 91.89 49.94 -64.17 -41.85 0.11 0.00 99.89 0.01 0.00 0.08 99.89 0.02 0.00 0.00 0.00 36 V H H 90.53 1.27 17.12 16.70 91.89 49.16 -64.30 -42.01 0.09 0.00 99.91 0.01 0.00 0.06 99.91 0.02 0.00 0.00 0.00 37 A H H 50.88 3.27 14.47 18.86 91.86 50.12 -64.02 -41.41 0.16 0.00 99.84 0.01 0.00 0.11 99.84 0.04 0.00 0.00 0.00 38 H H H 98.15 3.83 14.12 19.15 92.05 49.93 -64.41 -40.88 0.43 0.00 99.57 0.01 0.01 0.36 99.54 0.08 0.00 0.00 0.00 39 L H H 100.45 1.37 15.46 15.82 91.95 49.72 -64.61 -41.23 0.52 0.00 99.48 0.02 0.02 0.41 99.38 0.17 0.00 0.00 0.00 40 A H H 62.28 1.65 14.33 15.65 92.09 50.09 -64.87 -39.96 1.68 0.00 98.32 0.08 0.06 1.41 97.34 1.10 0.00 0.00 0.00 41 V H H 73.00 3.34 11.73 16.61 92.65 50.25 -65.46 -40.09 3.43 0.00 96.57 0.13 0.14 3.04 93.21 3.47 0.00 0.00 0.00 42 Y H H 139.69 2.02 12.00 14.72 92.82 50.52 -65.89 -38.19 5.03 0.00 94.96 0.22 0.22 4.18 86.41 8.97 0.01 0.00 0.00 43 I H H 123.96 0.99 11.88 12.31 93.59 49.83 -70.51 -32.90 16.80 0.01 83.19 0.42 0.54 15.69 74.82 8.50 0.01 0.00 0.01 44 W H H 173.76 1.61 10.15 12.37 97.64 46.71 -86.10 -17.10 31.94 0.07 67.98 2.13 2.57 26.36 58.97 9.82 0.04 0.03 0.08 45 R H G 127.10 4.17 7.58 13.58 107.22 85.44 -83.23 101.86 48.04 0.60 51.36 22.58 9.67 15.66 8.98 42.48 0.01 0.29 0.34 46 P C G 108.95 1.40 8.83 11.23 96.31 58.81 -68.25 -17.66 51.07 0.35 48.57 11.87 6.05 32.09 5.98 43.64 0.00 0.19 0.18 47 W C G 201.41 1.14 8.56 10.34 98.53 59.19 -83.87 -3.20 54.30 0.49 45.21 21.57 3.20 29.75 5.65 39.34 0.00 0.29 0.19 48 F C C 130.81 4.58 8.98 15.23 106.38 94.92 -85.35 86.92 99.62 0.22 0.16 99.34 0.27 0.15 0.05 0.04 0.00 0.10 0.06