# 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 122.79 4.09 10.13 15.85 114.90 -157.21 -96.07 132.47 99.89 0.10 0.02 99.82 0.08 0.03 0.01 0.00 0.00 0.04 0.01 1 T C C 99.62 2.51 8.00 12.30 115.40 -156.57 -97.13 135.00 92.48 4.24 3.28 88.69 1.14 3.34 1.72 0.88 0.00 2.28 1.94 2 T C C 101.42 2.13 7.45 11.29 113.87 -151.77 -96.15 132.22 88.72 5.09 6.18 63.37 17.07 8.25 3.32 2.83 0.00 2.86 2.30 3 K C C 152.56 1.80 7.89 11.18 109.12 -147.24 -86.69 105.26 86.57 3.90 9.53 59.88 18.65 8.02 5.64 3.92 0.00 2.14 1.75 4 K C C 147.00 2.05 8.26 11.75 109.60 55.97 -84.46 117.87 83.23 2.44 14.34 64.20 10.47 8.41 8.50 5.86 0.00 1.34 1.22 5 S C C 76.16 3.03 7.86 12.52 109.43 -136.62 -84.62 119.63 80.05 1.29 18.67 55.31 10.99 13.86 10.58 7.91 0.00 0.67 0.68 6 A C C 86.80 1.97 8.94 12.09 100.40 -139.16 -83.64 -8.02 74.60 1.27 24.13 41.69 19.23 14.18 14.44 9.16 0.00 0.59 0.70 7 E C C 136.38 1.93 9.12 12.38 109.25 78.43 -88.33 102.76 72.61 1.91 25.48 46.62 19.75 6.75 17.84 7.26 0.01 0.98 0.80 8 V C C 106.47 2.69 8.37 12.77 109.53 -112.41 -82.94 125.90 73.53 4.15 22.32 63.14 5.63 4.82 17.24 5.16 0.00 2.75 1.24 9 L C C 112.88 3.12 8.20 13.11 111.28 -144.31 -90.23 124.22 74.06 6.92 19.02 60.18 7.62 5.79 15.95 3.78 0.01 4.64 2.02 10 V C C 107.98 2.33 9.61 13.42 113.29 -153.18 -100.51 123.59 73.99 7.67 18.34 56.66 11.24 5.77 16.07 3.10 0.02 4.93 2.21 11 Y C C 137.22 3.77 8.32 13.89 114.55 -138.44 -95.69 130.68 74.29 3.49 22.22 54.67 15.24 3.32 22.48 1.46 0.00 2.00 0.81 12 P C H 89.16 2.42 10.75 14.25 101.53 -114.52 -69.12 -21.59 52.73 2.01 45.26 39.28 4.93 7.01 45.09 1.95 0.00 1.34 0.39 13 I H H 111.24 2.19 10.43 13.46 97.44 52.44 -70.78 -37.01 24.38 1.99 73.64 16.51 3.56 5.19 70.94 2.07 0.01 1.34 0.39 14 F H H 122.96 2.57 10.96 14.61 94.91 53.39 -70.33 -36.29 16.63 2.45 80.92 12.04 2.15 3.35 78.08 2.05 0.01 1.95 0.38 15 T H H 77.01 2.72 11.76 15.52 93.54 54.11 -67.81 -39.24 10.57 1.93 87.50 7.41 1.41 2.47 85.33 1.49 0.01 1.65 0.23 16 V H H 89.52 1.85 12.81 14.92 92.60 50.69 -66.36 -40.72 4.35 0.66 95.00 2.51 0.64 1.47 94.00 0.75 0.01 0.55 0.07 17 R H H 135.38 1.98 13.36 15.70 92.58 50.92 -65.67 -40.62 2.46 0.32 97.22 1.28 0.34 1.02 96.55 0.50 0.01 0.28 0.03 18 W H H 133.92 2.95 12.96 16.98 92.39 50.43 -65.31 -41.58 1.30 0.12 98.58 0.59 0.16 0.62 98.12 0.39 0.00 0.09 0.01 19 L H H 94.78 2.23 13.78 16.51 92.07 50.38 -64.73 -41.08 0.93 0.06 99.01 0.39 0.11 0.47 98.63 0.35 0.00 0.04 0.01 20 A H H 62.98 1.80 14.22 15.97 92.00 50.40 -64.59 -40.92 1.28 0.06 98.67 0.41 0.13 0.75 98.25 0.41 0.00 0.04 0.01 21 I H H 96.23 2.18 14.00 16.46 92.90 48.63 -66.62 -40.65 2.07 0.06 97.87 0.51 0.21 1.35 97.34 0.55 0.01 0.04 0.01 22 H H H 108.80 2.84 13.10 16.92 93.10 50.20 -67.19 -37.27 4.65 0.06 95.29 0.93 0.45 3.20 94.27 1.08 0.01 0.03 0.02 23 G H H 41.38 2.73 12.60 16.37 93.21 53.28 -67.32 -36.65 14.82 0.09 85.09 1.84 1.19 11.45 82.21 3.19 0.03 0.04 0.04 24 I H H 119.22 1.63 12.68 14.46 94.95 50.35 -75.45 -27.48 28.16 0.19 71.65 2.90 2.48 22.58 68.29 3.49 0.07 0.09 0.11 25 A H H 72.12 2.38 11.80 15.03 97.56 54.54 -77.96 -23.21 35.56 0.55 63.89 6.94 5.86 23.73 59.69 3.14 0.11 0.23 0.31 26 V H H 88.49 3.41 10.57 15.45 104.91 67.37 -81.99 -3.08 49.32 1.28 49.40 26.02 16.37 8.01 44.75 3.76 0.04 0.51 0.54 27 P C H 86.29 2.62 11.66 15.31 102.10 51.01 -69.80 12.65 50.39 1.62 47.99 38.51 4.04 6.93 44.63 4.44 0.00 1.06 0.37 28 T H H 85.07 3.42 10.82 15.63 98.62 65.35 -75.88 -23.90 32.05 6.42 61.52 22.58 4.22 6.39 53.93 6.43 0.04 5.45 0.96 29 I H H 112.86 2.06 11.67 14.43 95.26 66.18 -69.47 -37.61 17.33 6.66 76.01 11.60 2.71 4.02 69.47 5.14 0.03 6.41 0.61 30 F H H 135.63 1.84 12.19 14.45 94.34 54.25 -68.63 -38.26 16.94 7.28 75.78 10.05 2.47 4.70 69.22 5.38 0.05 7.62 0.52 31 F H H 121.12 2.71 11.74 15.52 94.78 51.20 -68.94 -38.23 16.41 4.99 78.60 9.64 2.43 5.06 72.41 4.91 0.05 5.03 0.48 32 L H H 101.78 2.13 12.54 15.36 92.79 53.78 -65.52 -39.82 7.29 0.65 92.06 3.37 1.18 3.21 88.95 2.62 0.03 0.53 0.10 33 G H H 41.80 1.80 13.24 15.27 93.02 50.92 -64.99 -39.25 6.90 0.29 92.81 2.47 0.99 3.76 89.78 2.71 0.02 0.21 0.06 34 A H H 57.53 2.54 12.40 15.96 93.28 52.04 -66.38 -39.78 5.97 0.28 93.74 2.31 0.87 3.11 90.54 2.87 0.02 0.22 0.06 35 I H H 93.36 2.61 11.99 15.64 93.16 50.87 -66.35 -40.40 5.04 0.31 94.65 2.10 0.79 2.46 91.57 2.76 0.02 0.25 0.05 36 T H H 88.03 1.52 12.64 14.17 93.50 51.15 -66.97 -37.92 8.45 0.32 91.24 3.10 1.14 4.39 87.89 3.15 0.02 0.23 0.07 37 A H H 74.84 1.49 11.01 12.84 94.13 53.53 -70.52 -30.17 17.54 0.34 82.12 4.66 2.16 10.91 78.07 3.82 0.05 0.19 0.13 38 M H H 120.31 2.43 9.04 12.93 100.01 61.08 -82.62 -9.08 28.52 0.93 70.54 11.95 4.61 13.11 64.29 5.08 0.06 0.53 0.36 39 Q H H 130.58 1.76 8.42 11.56 101.81 92.31 -79.77 14.07 39.54 2.55 57.91 18.99 6.48 15.26 50.20 6.52 0.10 1.65 0.80 40 F C H 161.14 1.32 7.60 10.06 103.97 84.35 -84.52 11.55 47.56 5.06 47.38 23.15 8.16 17.47 39.58 6.73 0.18 3.37 1.36 41 I C H 134.98 1.40 6.36 9.19 107.23 85.24 -89.21 69.46 53.26 9.72 37.02 31.55 9.90 12.58 32.18 4.69 0.17 6.48 2.46 42 Q C C 143.03 1.33 6.76 9.54 111.38 111.83 -93.20 123.48 75.87 5.34 18.78 62.33 2.01 10.44 17.81 2.09 0.00 3.73 1.58 43 R C C 176.90 1.98 9.12 12.82 111.23 -142.45 -89.18 123.63 99.79 0.14 0.06 99.67 0.11 0.09 0.04 0.00 0.00 0.08 0.01