# 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 Y C C 124.21 5.94 13.25 20.20 103.99 75.67 -90.36 16.95 99.45 0.20 0.34 99.34 0.14 0.09 0.29 0.01 0.00 0.07 0.06 1 E H H 126.21 2.34 11.58 14.88 95.62 79.11 -66.57 -38.13 6.87 0.06 93.07 4.23 0.35 2.02 92.59 0.78 0.00 0.02 0.02 2 A H H 72.05 1.64 10.86 13.06 93.17 53.22 -65.39 -39.83 2.52 0.01 97.47 0.46 0.23 1.54 97.07 0.69 0.00 0.00 0.00 3 L H H 105.86 1.59 11.72 13.67 92.75 50.24 -66.16 -39.67 0.68 0.00 99.32 0.11 0.06 0.40 98.94 0.49 0.00 0.00 0.00 4 A H H 61.19 2.08 12.11 14.90 92.37 51.05 -64.66 -40.82 0.22 0.00 99.78 0.04 0.01 0.12 99.64 0.19 0.00 0.00 0.00 5 W H H 159.89 1.58 13.42 14.94 92.43 50.14 -65.21 -41.12 0.29 0.00 99.71 0.03 0.01 0.18 99.67 0.10 0.00 0.00 0.00 6 L H H 101.91 1.64 14.26 15.64 92.26 49.37 -64.70 -41.55 0.26 0.00 99.74 0.03 0.01 0.17 99.74 0.05 0.00 0.00 0.00 7 S H H 63.08 1.84 14.78 16.42 92.30 49.52 -64.63 -41.67 0.25 0.00 99.75 0.02 0.01 0.16 99.77 0.04 0.00 0.00 0.00 8 G H H 38.77 2.20 15.10 17.37 92.42 50.16 -64.31 -41.75 0.32 0.00 99.68 0.03 0.01 0.22 99.70 0.05 0.00 0.00 0.00 9 G H H 36.97 2.48 14.90 17.82 92.33 50.64 -64.25 -41.86 0.38 0.00 99.62 0.03 0.01 0.26 99.62 0.06 0.00 0.00 0.00 10 L H H 97.98 1.90 15.56 17.20 92.21 49.64 -65.00 -40.89 0.33 0.00 99.67 0.03 0.02 0.22 99.67 0.06 0.00 0.00 0.00 11 G H H 39.83 2.04 15.01 17.06 92.17 51.10 -64.36 -41.35 0.37 0.00 99.63 0.04 0.02 0.25 99.64 0.06 0.00 0.00 0.00 12 F H H 128.26 1.63 15.32 16.46 92.21 49.53 -65.09 -41.36 0.24 0.00 99.76 0.02 0.01 0.16 99.77 0.04 0.00 0.00 0.00 13 F H H 125.49 1.91 15.25 17.02 92.42 49.75 -64.98 -41.73 0.13 0.00 99.87 0.01 0.00 0.08 99.87 0.03 0.00 0.00 0.00 14 V H H 87.61 1.92 15.26 17.04 92.31 49.49 -64.87 -41.63 0.14 0.00 99.86 0.01 0.00 0.09 99.87 0.03 0.00 0.00 0.00 15 G H H 39.55 1.92 15.33 17.07 92.14 50.29 -64.05 -41.80 0.24 0.00 99.76 0.02 0.01 0.17 99.77 0.04 0.00 0.00 0.00 16 L H H 98.35 1.84 15.59 17.09 92.29 49.21 -64.99 -41.61 0.20 0.00 99.80 0.01 0.01 0.14 99.80 0.04 0.00 0.00 0.00 17 G H H 36.02 3.02 14.27 18.29 92.11 50.97 -63.95 -41.70 0.26 0.00 99.74 0.02 0.01 0.17 99.74 0.06 0.00 0.00 0.00 18 L H H 98.26 1.88 15.32 17.01 92.20 50.23 -64.68 -41.11 0.39 0.00 99.61 0.03 0.01 0.28 99.58 0.11 0.00 0.00 0.00 19 L H H 97.59 1.67 15.46 16.61 92.40 49.62 -64.99 -40.81 0.52 0.00 99.48 0.04 0.03 0.37 99.37 0.20 0.00 0.00 0.00 20 A H H 53.88 3.21 13.07 17.58 92.63 51.22 -64.93 -40.53 1.27 0.00 98.73 0.13 0.08 0.94 98.23 0.61 0.00 0.00 0.00 21 V H H 88.03 2.78 13.32 16.96 93.32 50.14 -67.12 -39.05 4.06 0.02 95.92 0.34 0.26 3.32 94.98 1.07 0.01 0.01 0.01 22 L H H 110.95 1.60 13.92 15.28 94.30 48.50 -70.99 -32.61 10.09 0.08 89.84 0.97 0.97 8.17 88.33 1.45 0.04 0.04 0.04 23 N H H 97.82 2.77 12.49 16.17 99.88 49.96 -87.25 -8.54 34.53 0.68 64.78 6.78 7.04 22.53 60.82 2.02 0.15 0.25 0.41 24 D C C 72.58 5.70 9.65 17.11 101.90 83.14 -83.78 42.59 67.00 1.65 31.36 38.35 10.05 18.24 28.64 3.09 0.02 0.62 0.99 25 K C T 135.58 2.61 11.22 15.26 95.25 109.28 -68.91 -30.27 53.90 1.13 44.97 18.62 9.83 25.93 22.37 21.91 0.06 0.51 0.78 26 A C T 82.32 1.61 11.11 13.36 94.39 55.62 -71.19 -26.99 54.33 0.75 44.92 10.73 9.29 33.54 18.14 27.31 0.06 0.35 0.58 27 S C T 69.41 3.83 9.34 14.80 99.04 54.45 -85.92 -1.36 61.33 0.87 37.80 18.23 13.53 30.67 10.77 25.73 0.02 0.38 0.66 28 K C C 166.39 1.23 12.06 13.77 99.01 -131.63 28.96 35.84 89.45 1.51 9.04 37.07 23.96 28.87 2.41 6.11 0.00 0.68 0.90 29 V C C 81.49 5.16 7.76 14.97 115.06 135.82 -100.44 123.36 96.99 2.72 0.29 66.43 30.13 0.73 0.11 0.16 0.00 1.22 1.21 30 P C C 106.11 1.97 10.98 14.13 100.31 -144.86 -69.86 -13.87 95.10 3.73 1.17 70.01 18.52 6.43 0.28 1.00 0.00 1.97 1.79 31 F C C 138.41 3.65 8.48 14.13 119.90 66.50 -107.50 135.46 89.64 8.96 1.39 49.82 34.23 5.50 0.40 1.04 0.00 3.76 5.24 32 T C C 95.31 2.81 9.74 14.35 117.27 -137.05 -95.72 135.67 95.15 4.21 0.64 71.88 21.91 1.52 0.22 0.46 0.00 2.57 1.44 33 P C C 101.72 2.97 9.58 14.56 112.19 -105.56 -67.65 143.90 94.78 2.49 2.73 67.95 15.90 10.75 0.51 2.48 0.00 1.68 0.73 34 R C C 166.69 2.56 9.04 13.65 119.03 -145.60 -105.67 134.90 88.83 7.68 3.49 53.25 22.69 13.00 0.72 3.04 0.00 4.78 2.51 35 V C C 111.43 2.46 9.03 13.43 118.26 -149.76 -106.40 131.32 83.92 13.34 2.74 55.66 23.14 5.12 0.90 1.96 0.00 7.90 5.33 36 Y C C 144.35 3.88 7.55 13.49 116.68 -150.37 -102.50 129.37 87.45 11.02 1.53 60.65 23.86 3.31 0.56 1.04 0.00 7.11 3.47 37 P C C 104.30 1.93 9.04 12.42 104.47 -139.38 -75.05 27.09 89.43 4.06 6.51 45.65 20.45 23.79 1.65 4.72 0.00 2.56 1.17 38 Y C C 155.52 2.95 7.62 12.21 111.38 37.51 -100.34 108.30 81.21 4.91 13.88 40.08 17.48 24.33 4.25 8.94 0.02 2.39 2.51 39 D C T 114.02 1.86 8.55 11.76 105.21 -149.71 -83.84 76.42 73.43 2.56 24.01 24.47 16.63 33.35 8.91 14.03 0.03 1.29 1.30 40 N C T 124.05 1.45 8.65 11.12 102.67 44.12 -86.32 41.83 68.52 4.05 27.43 23.36 14.12 31.99 12.60 13.97 0.10 2.35 1.51 41 L C C 114.48 3.02 6.32 11.26 110.24 140.83 -87.26 113.48 56.06 17.04 26.91 38.53 9.18 8.19 16.35 11.05 0.09 13.27 3.34 42 R C C 178.14 1.30 7.73 10.32 110.68 155.24 -95.37 113.24 46.41 26.42 27.17 31.26 7.95 7.17 18.67 8.67 0.17 23.48 2.63 43 V C C 115.12 1.87 6.66 10.26 114.71 -158.46 -98.05 128.53 42.83 29.79 27.38 28.32 7.62 7.19 18.27 8.76 0.09 27.79 1.97 44 E C C 151.54 1.35 7.25 10.10 113.14 -144.85 -92.96 125.95 55.13 22.09 22.79 46.28 1.84 6.90 15.33 6.08 0.02 21.08 2.48 45 L C C 123.30 3.03 8.85 13.68 108.25 -157.11 -90.58 94.77 99.32 0.51 0.17 99.17 0.13 0.15 0.11 0.01 0.00 0.40 0.03