# 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 A C C 65.17 5.93 10.83 18.22 111.48 -148.63 -89.12 138.34 99.96 0.03 0.02 99.86 0.08 0.04 0.01 0.00 0.00 0.01 0.00 1 D C C 95.61 3.32 9.84 14.70 110.26 -140.33 -86.39 119.30 88.10 0.60 11.30 84.43 1.18 4.30 6.52 2.90 0.00 0.23 0.43 2 K C C 146.32 2.71 9.23 13.55 97.60 -145.99 -73.56 -17.04 60.00 1.00 39.00 29.05 9.83 21.55 13.77 24.70 0.00 0.48 0.62 3 S C G 81.13 2.35 9.72 13.38 97.92 67.26 -79.89 -12.47 56.71 1.18 42.11 22.07 11.21 24.37 13.85 27.20 0.01 0.56 0.73 4 D C C 105.12 2.46 10.03 13.83 100.15 65.46 -88.44 6.36 60.14 1.74 38.12 31.75 13.02 16.07 13.26 24.06 0.01 0.82 1.01 5 L C C 102.80 4.29 8.66 14.75 107.11 101.23 -86.42 59.73 77.05 3.08 19.87 40.31 24.31 13.20 11.18 7.55 0.02 1.11 2.32 6 G C C 47.85 3.31 9.93 14.70 112.53 96.48 -87.86 149.94 88.64 2.87 8.49 61.90 15.71 10.81 4.09 4.26 0.00 1.31 1.93 7 Y C T 181.94 1.82 9.40 12.32 98.75 -16.81 -82.35 -5.27 86.81 2.22 10.97 31.54 24.53 31.71 3.53 6.39 0.00 0.97 1.32 8 T C T 99.73 2.21 9.84 13.28 104.17 72.11 -87.77 11.50 90.30 1.32 8.38 17.32 28.69 44.92 2.62 4.99 0.00 0.60 0.86 9 G C S 58.86 1.53 11.81 13.92 100.52 -104.17 82.88 2.38 93.42 1.34 5.24 25.72 44.61 23.64 1.45 3.21 0.00 0.60 0.78 10 L C C 78.92 6.30 8.03 16.24 117.67 117.13 -91.43 145.44 92.52 3.39 4.08 67.70 21.34 2.97 3.14 1.05 0.00 1.11 2.68 11 T C C 74.59 2.12 13.41 15.87 119.51 -119.92 -79.07 163.23 91.32 2.28 6.40 81.03 7.78 1.82 6.30 0.73 0.00 0.80 1.53 12 D H H 107.47 2.58 11.41 15.59 93.06 -103.63 -60.12 -38.48 7.42 0.05 92.53 2.62 1.91 3.20 91.10 1.11 0.01 0.02 0.02 13 E H H 134.75 1.04 13.97 14.15 92.30 51.10 -64.98 -39.71 3.91 0.02 96.06 0.92 0.55 2.33 95.07 1.10 0.01 0.01 0.01 14 Q H H 93.85 2.56 13.52 16.77 92.52 49.11 -66.18 -40.05 2.26 0.02 97.72 0.71 0.29 1.20 96.70 1.09 0.00 0.01 0.01 15 A H H 41.62 4.86 11.57 18.64 91.99 51.90 -64.14 -41.34 1.35 0.01 98.64 0.48 0.16 0.63 98.19 0.53 0.00 0.00 0.00 16 Q H H 107.09 1.94 15.12 17.07 91.83 50.20 -64.82 -40.77 1.42 0.01 98.57 0.34 0.15 0.81 98.32 0.37 0.00 0.00 0.00 17 E H H 107.19 1.65 15.39 16.45 91.93 50.37 -64.77 -41.31 1.78 0.01 98.21 0.32 0.15 1.12 98.05 0.34 0.00 0.00 0.00 18 L H H 89.87 2.58 14.85 17.81 92.04 49.62 -64.40 -41.42 1.54 0.00 98.46 0.32 0.15 0.87 98.41 0.24 0.00 0.00 0.00 19 H H H 103.79 2.99 14.58 18.38 91.96 50.12 -64.50 -40.56 1.19 0.00 98.81 0.24 0.10 0.67 98.81 0.18 0.00 0.00 0.00 20 S H H 61.26 2.09 15.10 17.24 91.91 51.10 -64.50 -40.68 1.36 0.00 98.63 0.18 0.09 0.90 98.64 0.18 0.00 0.00 0.00 21 V H H 89.49 1.80 15.13 16.54 92.19 49.56 -64.96 -41.78 0.82 0.00 99.18 0.12 0.06 0.51 99.16 0.14 0.00 0.00 0.00 22 Y H H 133.14 2.26 14.79 17.29 92.21 49.07 -65.00 -41.33 0.50 0.00 99.50 0.09 0.04 0.29 99.50 0.08 0.00 0.00 0.00 23 M H H 100.60 2.27 14.98 17.51 91.96 49.52 -64.58 -41.35 0.35 0.00 99.64 0.05 0.02 0.21 99.65 0.06 0.00 0.00 0.00 24 S H H 61.17 1.89 15.54 17.12 91.95 50.30 -64.17 -41.16 0.28 0.00 99.71 0.04 0.01 0.17 99.72 0.06 0.00 0.00 0.00 25 G H H 36.04 2.47 14.55 17.56 91.95 50.67 -63.80 -41.33 0.35 0.00 99.65 0.03 0.01 0.23 99.66 0.07 0.00 0.00 0.00 26 L H H 92.02 2.68 14.50 17.80 92.10 50.35 -64.77 -40.59 0.24 0.00 99.76 0.02 0.01 0.16 99.76 0.05 0.00 0.00 0.00 27 W H H 155.87 1.70 15.43 16.75 91.98 49.90 -64.93 -41.25 0.16 0.00 99.84 0.01 0.01 0.10 99.85 0.03 0.00 0.00 0.00 28 L H H 99.82 1.49 15.72 16.34 91.88 49.41 -64.51 -41.90 0.13 0.00 99.87 0.01 0.00 0.09 99.87 0.02 0.00 0.00 0.00 29 F H H 116.81 2.40 14.66 17.52 92.00 49.23 -65.01 -41.23 0.12 0.00 99.88 0.01 0.00 0.08 99.89 0.02 0.00 0.00 0.00 30 S H H 57.33 3.08 14.71 18.60 91.96 50.14 -64.24 -40.94 0.12 0.00 99.88 0.01 0.00 0.08 99.89 0.02 0.00 0.00 0.00 31 A H H 63.58 1.51 16.50 16.91 91.73 50.02 -64.12 -41.76 0.11 0.00 99.89 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 32 V H H 85.36 1.85 16.53 17.73 91.99 48.86 -64.62 -41.90 0.08 0.00 99.92 0.01 0.00 0.05 99.93 0.01 0.00 0.00 0.00 33 A H H 46.48 4.58 13.80 20.09 91.92 50.64 -63.97 -41.45 0.09 0.00 99.91 0.01 0.00 0.06 99.92 0.02 0.00 0.00 0.00 34 I H H 96.79 2.15 16.44 18.31 91.89 49.81 -64.02 -41.91 0.12 0.00 99.88 0.01 0.00 0.09 99.88 0.02 0.00 0.00 0.00 35 V H H 90.42 1.28 17.24 16.82 91.91 49.06 -64.31 -42.06 0.10 0.00 99.90 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 36 A H H 50.07 3.45 14.46 19.12 91.86 50.13 -64.11 -41.36 0.19 0.00 99.81 0.01 0.01 0.13 99.81 0.04 0.00 0.00 0.00 37 H H H 98.25 3.81 14.26 19.26 92.05 50.17 -64.41 -40.96 0.53 0.00 99.47 0.02 0.01 0.44 99.43 0.09 0.00 0.00 0.00 38 L H H 100.37 1.35 15.60 15.87 91.82 49.65 -64.54 -41.27 0.64 0.00 99.36 0.03 0.02 0.52 99.24 0.19 0.00 0.00 0.00 39 A H H 61.91 1.73 14.40 15.88 92.08 50.12 -64.78 -39.88 1.93 0.00 98.07 0.09 0.07 1.63 96.94 1.27 0.00 0.00 0.00 40 V H H 72.70 3.42 11.83 16.80 92.60 50.35 -65.48 -39.87 3.56 0.00 96.44 0.13 0.14 3.15 92.64 3.94 0.00 0.00 0.00 41 Y H H 139.95 1.93 12.30 14.75 92.76 50.74 -65.85 -38.69 4.68 0.00 95.31 0.20 0.20 3.87 85.98 9.73 0.00 0.00 0.00 42 I H H 120.97 1.03 12.09 12.58 93.54 49.99 -70.21 -33.84 15.77 0.01 84.22 0.37 0.47 14.78 74.83 9.52 0.01 0.00 0.01 43 W H H 166.55 1.83 10.20 12.80 97.20 47.26 -83.77 -19.19 30.03 0.05 69.93 1.67 2.04 25.28 59.18 11.74 0.03 0.02 0.05 44 R H G 129.40 4.00 7.88 13.67 103.91 80.97 -74.85 17.34 31.41 0.30 68.28 10.69 5.00 15.19 9.35 59.47 0.00 0.16 0.13 45 P H G 108.99 1.26 9.08 11.08 95.36 84.71 -69.02 -19.35 36.27 0.20 63.53 6.02 3.55 24.97 6.51 58.75 0.00 0.11 0.08 46 W H G 200.82 1.10 8.61 10.28 97.59 58.16 -85.31 -4.83 40.30 0.32 59.39 13.57 2.71 22.55 6.29 54.58 0.00 0.19 0.11 47 F C C 131.48 4.49 8.95 15.08 105.84 93.01 -84.79 77.72 99.59 0.23 0.17 99.28 0.32 0.14 0.06 0.04 0.00 0.10 0.07