# 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 117.11 4.78 10.53 17.19 118.98 -160.94 -101.38 138.00 99.90 0.07 0.02 99.81 0.10 0.04 0.01 0.00 0.00 0.03 0.01 1 D C C 103.67 3.32 8.70 13.85 110.52 -131.43 -84.65 125.35 88.05 1.87 10.08 80.10 1.51 7.82 5.57 3.01 0.00 1.03 0.95 2 S C C 82.19 2.94 8.22 12.82 104.54 -163.83 -90.63 20.74 78.13 3.25 18.61 44.41 17.58 16.60 11.30 6.91 0.02 1.74 1.44 3 E C C 136.55 2.24 9.43 13.19 109.82 107.73 -89.58 116.53 67.53 7.24 25.23 39.56 18.55 9.77 18.11 7.28 0.09 4.45 2.19 4 V C C 96.23 4.54 8.01 14.18 109.87 113.00 -91.97 117.08 63.12 12.33 24.56 46.17 10.22 6.16 19.04 6.36 0.07 9.20 2.77 5 Q C C 115.34 4.09 8.76 14.60 110.79 -130.98 -92.07 122.01 61.05 19.98 18.97 48.95 6.30 4.65 14.75 5.10 0.04 16.18 4.03 6 R C C 166.57 2.41 9.20 13.18 105.41 -157.34 -86.08 50.42 48.95 27.08 23.97 28.18 8.98 12.88 16.68 7.16 0.71 17.89 7.52 7 D C T 118.11 1.67 10.61 13.06 99.67 21.14 -85.83 28.07 79.39 3.49 17.12 15.21 14.14 49.55 10.73 6.70 0.08 2.30 1.28 8 G C T 48.51 4.46 10.75 16.56 102.89 -69.71 86.14 4.37 84.80 3.55 11.66 19.30 21.25 45.00 5.18 5.83 0.03 2.37 1.05 9 R C C 139.30 4.02 11.71 17.45 116.68 130.43 -94.83 138.33 54.82 35.15 10.04 35.51 12.50 7.41 6.00 4.70 0.24 23.98 9.65 10 I E C 87.71 7.95 10.15 19.53 112.41 -132.45 -91.68 122.85 43.40 46.14 10.46 33.34 5.18 3.56 6.72 4.68 0.07 30.98 15.48 11 L C T 106.28 4.76 12.17 18.51 105.83 -164.10 -86.17 22.21 55.10 17.47 27.43 22.08 12.55 23.35 7.05 18.55 0.29 13.01 3.11 12 D C T 97.28 3.87 13.72 18.64 103.42 40.35 -95.53 46.46 63.22 10.48 26.30 21.24 14.92 29.23 6.14 18.58 0.15 7.35 2.39 13 L C C 88.29 7.91 11.16 20.23 106.37 129.79 -82.39 76.85 67.67 9.62 22.71 35.46 17.44 16.96 5.74 15.53 0.07 5.78 3.02 14 I C C 97.14 6.20 12.03 19.42 111.98 64.52 -102.08 100.21 83.82 10.14 6.05 51.53 23.58 8.43 3.22 2.68 0.02 3.79 6.75 15 D C C 59.19 6.06 11.39 19.28 124.63 107.31 -103.82 160.06 97.81 0.88 1.31 87.82 9.46 0.39 1.33 0.13 0.00 0.26 0.61 16 D H H 107.85 1.81 13.48 15.62 92.90 -107.18 -63.51 -33.44 4.58 0.02 95.40 0.62 0.80 3.20 94.26 1.09 0.02 0.01 0.01 17 A H H 55.53 3.00 12.92 17.15 92.13 53.99 -64.54 -39.63 2.82 0.05 97.13 0.33 0.32 2.25 95.05 1.98 0.03 0.03 0.01 18 W H H 66.48 11.15 9.59 21.77 92.62 50.75 -66.72 -40.33 1.32 0.02 98.66 0.24 0.14 0.94 96.46 2.20 0.01 0.01 0.00 19 R H H 140.81 4.03 12.73 18.22 92.11 51.93 -66.15 -34.45 4.56 0.02 95.42 0.35 0.26 3.99 93.36 2.00 0.02 0.01 0.01 20 E C T 135.23 1.24 14.38 14.65 94.60 48.30 -86.93 -7.87 63.41 0.04 36.55 0.75 1.69 59.79 36.26 1.46 0.01 0.01 0.04 21 D C T 94.63 6.90 10.89 19.40 96.02 -117.93 57.76 38.51 97.98 0.05 1.97 4.14 5.20 88.82 1.53 0.25 0.00 0.02 0.04 22 K C C 137.31 2.46 14.81 18.02 105.41 133.50 -104.39 21.85 93.20 6.47 0.33 81.01 9.43 1.84 0.16 0.16 0.00 1.59 5.81 23 L C C 51.88 13.26 8.10 21.41 117.15 117.11 -86.73 135.85 97.85 2.08 0.08 82.48 15.38 0.22 0.03 0.04 0.00 0.88 0.97 24 P C C 64.72 4.02 14.66 19.97 112.14 -111.75 -68.29 143.22 97.71 2.02 0.27 96.02 1.56 0.35 0.08 0.13 0.00 0.66 1.21 25 Y H G 147.35 6.71 10.52 18.78 93.47 -129.57 -65.05 -28.70 42.40 1.20 56.40 5.77 6.95 27.51 0.92 57.76 0.00 0.60 0.48 26 E H G 153.45 1.07 13.02 13.96 94.25 65.37 -71.30 -18.22 42.74 0.43 56.83 1.37 4.09 33.99 0.69 59.52 0.00 0.25 0.10 27 D H G 97.61 3.77 12.18 17.26 97.88 49.09 -92.69 -0.27 40.64 0.82 58.54 4.99 5.43 27.09 0.87 60.93 0.00 0.51 0.18 28 V C C 51.98 12.50 8.57 21.36 114.47 91.78 -98.04 124.27 82.80 16.56 0.63 71.20 10.81 0.64 0.24 0.42 0.00 11.59 5.11 29 A C C 78.59 2.93 16.35 20.12 112.49 -152.54 -94.53 120.45 64.89 34.91 0.20 61.32 3.07 0.28 0.09 0.11 0.00 27.08 8.05 30 I C C 57.12 11.89 9.08 21.76 122.19 166.44 -119.24 137.75 75.59 24.37 0.05 67.96 8.82 0.08 0.02 0.03 0.00 18.41 4.68 31 P C C 67.16 3.16 15.50 19.48 113.34 -108.82 -66.16 144.18 90.80 9.17 0.03 91.93 0.25 0.02 0.01 0.01 0.00 7.03 0.75 32 L H G 103.22 7.99 9.63 19.01 91.85 -123.04 -58.83 -32.76 8.29 0.13 91.58 1.12 0.81 4.54 0.37 93.06 0.00 0.09 0.00 33 N H G 137.80 0.60 13.64 12.96 90.38 62.29 -69.99 -16.49 8.14 0.09 91.77 0.44 0.59 5.24 0.28 93.38 0.00 0.06 0.00 34 E H G 118.27 3.89 12.37 17.73 96.19 57.74 -93.76 -1.51 8.96 0.10 90.94 1.02 1.02 4.54 0.29 93.07 0.00 0.06 0.00 35 L C S 54.08 13.82 7.91 21.61 118.43 101.66 -82.88 141.78 99.53 0.31 0.16 29.43 69.95 0.18 0.05 0.05 0.00 0.07 0.27 36 P C C 64.98 6.08 12.20 20.25 115.69 -107.45 -66.85 151.42 99.10 0.71 0.19 93.77 4.82 0.35 0.08 0.09 0.00 0.19 0.71 37 E C C 121.31 3.28 14.32 18.76 112.67 -102.51 -71.04 139.49 98.83 0.41 0.75 95.96 2.38 0.54 0.34 0.25 0.00 0.12 0.42 38 P C G 79.37 7.78 9.16 18.31 94.94 -116.43 -62.18 -29.10 55.80 0.69 43.51 30.79 6.94 16.80 9.53 35.19 0.00 0.36 0.38 39 E C G 142.60 1.65 11.99 14.24 95.30 60.92 -73.26 -15.99 50.12 1.86 48.01 25.52 7.77 16.91 12.59 35.39 0.01 1.04 0.78 40 Q H G 116.70 3.22 10.66 15.24 98.44 62.87 -80.69 -5.94 47.63 2.97 49.39 29.43 8.34 10.55 12.70 36.20 0.01 1.72 1.06 41 D C C 86.36 6.00 8.91 16.34 103.70 75.51 -88.72 34.65 68.19 3.20 28.62 40.27 12.38 15.93 10.75 17.21 0.02 1.59 1.84 42 N C C 116.23 2.61 10.81 14.74 101.30 88.74 -89.52 16.09 85.11 2.15 12.75 36.09 19.31 30.36 5.53 6.47 0.01 1.03 1.20 43 G C C 55.16 2.61 11.09 14.96 101.58 -98.78 78.20 6.53 92.99 1.36 5.66 35.48 30.15 27.66 1.75 3.58 0.00 0.60 0.79 44 G C C 44.90 4.33 10.33 16.22 112.91 -99.63 23.72 165.02 89.06 1.88 9.05 50.61 24.26 14.20 4.29 4.58 0.00 0.80 1.25 45 T C C 103.83 3.06 9.84 14.48 103.02 -115.18 -86.20 11.72 76.71 2.78 20.51 37.24 20.12 19.93 12.80 7.15 0.03 1.29 1.46 46 T C C 106.00 1.78 11.32 13.71 104.43 84.05 -91.35 13.83 67.98 4.09 27.93 37.79 15.82 15.04 20.27 7.14 0.07 2.02 1.85 47 E C C 88.62 6.96 8.90 17.46 113.74 99.57 -85.86 141.44 66.79 2.62 30.59 48.34 12.82 5.46 27.15 3.96 0.01 1.27 1.00 48 S C C 57.84 2.98 13.31 17.11 116.04 -124.61 -78.96 160.87 64.34 2.35 33.31 56.34 4.72 3.30 31.73 2.02 0.00 1.10 0.78 49 V H H 92.13 4.64 10.88 17.27 93.62 -108.58 -60.98 -37.33 9.71 0.37 89.92 7.26 1.70 2.11 87.06 1.58 0.00 0.19 0.09 50 K H H 135.36 1.56 13.50 15.09 92.30 53.52 -64.97 -39.97 5.94 0.35 93.71 3.99 1.02 2.00 90.82 1.84 0.01 0.24 0.08 51 E H H 100.38 2.67 13.61 17.08 92.20 50.40 -66.12 -39.15 4.77 0.42 94.81 2.82 0.87 1.92 91.76 2.19 0.02 0.33 0.08 52 Q H H 78.53 5.74 12.04 19.53 92.38 52.17 -65.30 -39.48 5.44 0.30 94.26 3.02 0.91 2.28 91.70 1.77 0.02 0.22 0.08 53 E H H 103.13 3.71 13.68 18.66 91.97 52.44 -64.85 -38.84 9.44 0.30 90.26 4.91 1.17 4.15 87.71 1.71 0.03 0.19 0.12 54 M H H 112.47 2.14 14.92 17.10 92.70 51.27 -66.91 -37.57 15.57 0.42 84.01 7.17 2.16 7.19 80.71 2.33 0.04 0.22 0.19 55 K H H 113.82 3.41 14.66 18.91 93.23 52.83 -66.52 -37.92 22.75 0.72 76.53 10.28 3.22 10.01 72.72 3.06 0.04 0.36 0.32 56 W H H 116.42 6.36 12.75 20.48 96.15 50.77 -76.31 -25.99 30.79 1.20 68.02 17.31 4.25 10.23 63.08 3.99 0.04 0.59 0.51 57 T H H 71.34 4.73 14.08 19.83 95.65 59.71 -70.51 -35.44 35.84 1.42 62.75 20.46 5.58 10.80 58.03 3.84 0.03 0.70 0.56 58 D H H 86.30 3.22 14.35 18.14 95.10 55.62 -70.03 -32.78 38.21 0.91 60.89 17.17 6.12 15.43 55.66 4.76 0.03 0.44 0.38 59 L H H 93.53 3.41 14.13 18.22 94.64 52.06 -69.87 -34.88 36.79 0.84 62.37 10.04 7.40 20.15 55.52 5.97 0.10 0.42 0.41 60 A H H 54.19 4.52 13.41 19.31 95.16 50.56 -65.07 -34.58 32.61 0.69 66.70 11.38 4.97 16.93 58.60 7.37 0.06 0.35 0.33 61 L H H 81.59 4.77 12.72 18.93 93.79 55.36 -67.05 -36.45 17.40 0.52 82.08 8.76 2.71 6.49 69.28 12.24 0.02 0.33 0.17 62 Q H H 103.39 2.64 13.64 17.04 93.04 56.66 -65.30 -38.11 13.80 0.62 85.57 5.66 2.06 6.31 72.25 13.06 0.04 0.47 0.15 63 Y H H 130.33 2.53 13.25 16.47 93.38 51.36 -68.66 -37.20 15.65 0.92 83.43 6.09 2.56 7.50 69.47 13.39 0.08 0.68 0.24 64 L H H 93.10 3.90 11.68 16.99 93.67 54.53 -68.82 -36.19 19.29 1.47 79.25 9.50 3.77 7.69 69.16 8.37 0.08 0.97 0.45 65 H H H 124.48 3.13 11.43 15.80 96.07 53.12 -77.95 -18.76 30.18 2.25 67.57 15.62 5.19 11.44 59.51 6.01 0.08 1.35 0.80 66 E C H 132.23 2.23 11.15 14.52 99.55 68.81 -75.36 -14.95 49.90 1.43 48.68 17.92 9.25 23.81 42.82 4.78 0.08 0.69 0.66 67 N C T 119.96 1.96 10.84 13.83 102.02 52.16 -92.79 19.13 73.15 1.32 25.53 29.04 13.53 30.78 21.25 4.10 0.03 0.55 0.71 68 V C C 89.57 4.93 8.03 14.96 116.04 126.75 -94.19 131.10 98.12 1.25 0.64 55.57 41.79 0.85 0.45 0.16 0.00 0.37 0.82 69 P C C 89.40 3.16 9.31 14.41 114.89 -109.19 -66.89 149.51 98.79 0.55 0.66 92.34 4.99 1.51 0.26 0.29 0.00 0.25 0.34 70 P C C 112.43 1.90 8.70 12.22 107.74 -105.44 -71.10 139.40 94.10 1.62 4.28 72.47 9.86 11.56 1.13 3.12 0.00 0.80 1.06 71 I C C 139.44 1.67 7.17 10.38 110.48 -121.18 -91.29 116.07 92.15 2.83 5.02 46.13 19.10 27.21 1.01 3.80 0.00 1.42 1.32 72 G C C 58.95 1.53 8.35 11.19 111.91 16.73 74.21 161.25 95.00 1.70 3.30 65.52 8.02 21.68 0.57 2.48 0.00 1.01 0.72 73 N C C 127.08 1.88 9.67 12.93 108.17 -104.62 -93.21 87.10 99.72 0.19 0.09 98.90 0.55 0.35 0.02 0.03 0.00 0.10 0.05