# 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 78.44 3.63 10.41 15.67 113.91 -159.70 -90.65 136.29 99.91 0.07 0.02 99.85 0.06 0.04 0.01 0.00 0.00 0.03 0.01 1 V C C 120.15 1.71 8.94 12.10 113.71 -144.26 -93.15 129.42 89.05 5.27 5.68 85.06 1.41 3.14 4.39 1.00 0.00 3.29 1.72 2 I C C 111.37 4.30 7.29 13.57 114.78 -144.48 -93.46 131.24 84.08 8.93 6.99 67.37 12.44 3.84 5.76 1.83 0.01 5.32 3.44 3 S C C 65.40 2.76 11.35 15.37 114.69 -144.25 -92.19 132.56 87.03 7.04 5.93 80.51 4.38 2.12 5.01 1.29 0.00 3.70 2.99 4 V H H 92.50 4.64 9.82 16.35 93.53 -141.48 -63.69 -34.83 11.32 0.21 88.47 6.61 2.63 2.88 86.67 1.03 0.01 0.08 0.09 5 K H H 131.43 2.23 12.41 15.64 92.16 57.35 -63.68 -40.16 3.84 0.06 96.10 0.98 0.62 2.28 94.76 1.29 0.01 0.03 0.02 6 P H H 75.31 2.09 13.33 15.87 92.07 49.51 -65.63 -40.09 2.70 0.09 97.21 0.85 0.35 1.57 95.54 1.59 0.01 0.06 0.02 7 I H H 81.83 3.74 12.63 17.82 92.21 49.31 -65.12 -41.46 1.50 0.04 98.46 0.47 0.19 0.82 97.36 1.12 0.00 0.03 0.01 8 L H H 75.61 5.57 12.12 19.46 91.89 50.50 -65.03 -40.29 1.16 0.03 98.80 0.27 0.11 0.71 97.53 1.34 0.00 0.02 0.00 9 L H H 103.58 2.22 14.15 16.90 91.87 51.03 -64.81 -39.28 1.85 0.01 98.14 0.17 0.10 1.46 95.48 2.77 0.00 0.01 0.00 10 A H H 76.74 1.29 15.19 15.60 92.04 49.79 -68.02 -34.93 7.57 0.01 92.42 0.22 0.24 7.30 89.47 2.75 0.01 0.00 0.00 11 M H H 94.09 4.73 13.78 19.80 95.64 46.29 -83.35 -21.33 25.03 0.03 74.94 0.83 1.11 22.85 72.93 2.22 0.02 0.01 0.03 12 T H H 51.57 8.62 11.63 21.92 93.30 75.60 -62.34 -40.97 9.68 0.06 90.26 3.87 2.21 3.25 89.88 0.75 0.00 0.02 0.03 13 P H H 83.59 2.03 16.62 18.29 91.81 53.79 -64.03 -40.65 3.36 0.01 96.62 1.07 0.40 1.66 96.15 0.71 0.00 0.01 0.00 14 V H H 87.39 1.92 17.03 18.30 91.87 49.59 -65.06 -40.93 1.03 0.01 98.96 0.30 0.10 0.54 98.51 0.54 0.00 0.00 0.00 15 F H H 82.07 8.01 14.57 23.88 92.17 50.01 -65.29 -41.13 0.28 0.00 99.72 0.07 0.02 0.15 99.53 0.23 0.00 0.00 0.00 16 I H H 77.89 6.10 15.66 23.12 91.64 50.90 -63.79 -42.20 0.16 0.00 99.84 0.02 0.01 0.10 99.72 0.14 0.00 0.00 0.00 17 L H H 99.18 1.60 18.38 18.61 91.77 49.80 -64.43 -41.29 0.20 0.00 99.80 0.02 0.01 0.14 99.65 0.18 0.00 0.00 0.00 18 L H H 78.18 3.77 16.58 21.13 91.77 49.98 -65.06 -41.07 0.40 0.00 99.60 0.02 0.02 0.33 99.33 0.30 0.00 0.00 0.00 19 C H H 38.38 9.94 12.87 24.35 92.10 51.35 -64.66 -40.40 1.40 0.01 98.59 0.10 0.08 1.19 97.55 1.06 0.01 0.00 0.00 20 L H H 99.20 3.52 15.61 20.02 92.06 51.59 -65.95 -37.40 3.80 0.02 96.17 0.18 0.19 3.51 93.97 2.10 0.03 0.01 0.01 21 F H H 149.09 1.28 16.21 16.33 93.75 48.53 -72.13 -31.80 9.56 0.10 90.35 0.61 0.69 8.48 88.03 2.01 0.08 0.05 0.04 22 F H H 113.02 5.37 13.28 19.84 99.15 50.01 -84.72 -11.03 32.74 2.21 65.05 6.35 5.68 22.33 60.65 2.50 0.38 1.12 0.99 23 G C C 33.37 8.53 11.57 21.16 105.81 71.75 -79.68 5.21 66.88 9.30 23.82 30.42 11.81 25.01 21.04 3.16 0.14 5.63 2.80 24 T C C 74.21 5.69 11.51 18.71 114.84 89.90 -96.46 139.12 61.39 25.13 13.48 37.23 14.39 9.73 9.93 4.05 0.23 15.06 9.38 25 R C T 165.94 2.61 10.88 15.01 108.27 -109.83 -83.97 100.49 58.83 25.21 15.96 13.70 15.86 31.12 7.88 7.05 0.93 14.40 9.05 26 N C T 130.92 1.34 12.66 14.27 98.26 10.97 32.51 21.45 86.27 2.37 11.37 9.54 18.15 58.89 3.28 7.54 0.02 1.47 1.12 27 G C T 46.06 4.63 11.55 17.67 106.96 -52.09 88.88 4.94 86.10 7.55 6.34 18.16 28.22 40.55 1.23 4.84 0.02 4.82 2.16 28 F C C 122.90 5.22 12.14 18.97 115.47 106.07 -99.85 131.32 67.40 28.77 3.83 40.24 18.75 9.34 1.39 2.65 0.07 18.17 9.39 29 Y C C 102.43 9.61 10.43 21.18 118.98 -152.69 -106.06 132.90 68.20 29.06 2.74 48.18 14.25 5.20 1.15 1.81 0.02 19.12 10.28 30 D C C 84.21 4.82 13.17 19.57 110.86 -158.47 -99.05 112.76 83.82 13.89 2.28 64.21 14.41 4.81 0.82 1.59 0.00 10.50 3.65 31 T C C 75.87 7.83 9.34 18.45 103.72 -169.95 -93.92 -1.80 70.80 10.09 19.12 39.98 17.19 14.40 4.25 14.26 0.04 5.57 4.31 32 D C T 123.66 1.06 12.38 13.39 96.00 77.23 -74.40 -15.04 74.92 2.76 22.32 10.56 20.66 44.54 3.17 18.20 0.02 1.65 1.19 33 Q C T 132.87 1.79 11.59 14.05 101.75 52.69 -98.67 13.22 72.49 5.16 22.35 18.50 17.07 38.15 3.27 18.15 0.02 3.29 1.56 34 Y C C 98.83 9.83 6.23 16.42 114.51 113.95 -93.44 127.59 73.17 18.76 8.06 53.83 12.01 5.67 3.63 4.59 0.02 9.68 10.56 35 H C C 149.00 1.56 11.87 14.10 111.27 -170.91 -103.35 110.21 78.47 15.19 6.34 52.37 12.93 13.12 2.65 3.58 0.02 9.07 6.27 36 G C T 52.31 2.73 10.60 14.70 109.43 -19.60 80.25 -97.46 83.99 6.16 9.85 20.06 30.58 34.50 2.29 6.68 0.03 3.59 2.26 37 N C T 117.60 2.29 10.65 14.10 103.55 0.06 -87.21 26.36 80.81 3.03 16.16 18.84 27.00 36.11 3.65 11.26 0.02 1.50 1.61 38 A C T 76.77 4.46 9.95 15.97 99.88 -86.51 -29.18 6.95 72.96 4.80 22.24 18.03 24.38 32.27 4.53 15.96 0.07 2.60 2.15 39 A C C 70.53 3.67 9.69 15.06 107.03 104.39 -87.94 55.95 66.95 12.41 20.63 32.15 16.29 20.56 5.41 13.98 0.09 7.16 4.35 40 A C C 72.71 4.44 8.62 14.73 106.49 98.30 -86.29 65.76 73.00 11.76 15.24 55.84 5.61 11.72 5.55 8.88 0.01 7.04 5.35 41 H C C 124.42 5.31 11.56 18.35 109.71 -166.14 -93.34 104.01 99.32 0.49 0.19 99.02 0.23 0.27 0.05 0.05 0.00 0.28 0.10