# 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 109.92 5.39 10.74 17.67 116.62 -166.74 -93.09 138.81 99.93 0.03 0.04 99.80 0.12 0.04 0.02 0.00 0.00 0.01 0.01 1 E C C 125.89 2.81 10.55 14.73 110.28 -112.21 -77.98 133.52 78.30 0.55 21.14 75.36 0.74 3.52 18.45 1.42 0.00 0.24 0.27 2 T H H 83.08 4.07 9.06 14.80 99.13 -140.57 -72.57 -25.58 39.33 0.64 60.04 26.44 5.76 8.47 51.82 6.89 0.01 0.31 0.31 3 V H H 86.99 3.49 9.90 14.98 95.81 68.03 -68.28 -36.32 21.84 0.55 77.61 10.90 4.33 7.69 64.53 12.00 0.03 0.31 0.20 4 A H H 64.48 2.96 10.37 14.79 94.11 55.43 -66.72 -35.23 19.65 0.59 79.77 9.67 3.61 6.92 65.38 13.85 0.03 0.35 0.19 5 R H H 158.44 1.87 11.28 14.01 95.17 54.73 -71.81 -29.17 27.44 0.98 71.58 13.31 5.56 9.97 59.51 10.66 0.06 0.54 0.39 6 R H H 149.79 3.00 10.30 14.74 98.97 58.96 -81.72 -10.50 45.26 1.81 52.93 23.44 9.46 14.64 44.39 6.28 0.06 0.85 0.87 7 R C C 156.64 2.75 10.33 14.52 105.28 81.18 -82.14 49.33 67.48 1.71 30.80 33.95 13.68 19.84 27.32 3.57 0.02 0.69 0.93 8 G C C 51.96 2.49 11.51 14.96 104.67 29.93 14.52 -26.43 82.09 0.91 17.00 37.49 16.97 27.79 13.32 3.50 0.00 0.37 0.56 9 G C C 48.13 3.31 11.05 15.68 104.74 38.64 -36.36 -28.69 77.85 0.79 21.36 36.59 20.15 21.34 16.66 4.40 0.00 0.29 0.56 10 G C H 43.54 3.12 11.51 15.78 106.94 59.33 -52.92 -52.84 49.83 0.74 49.43 23.66 14.53 13.43 42.35 5.28 0.03 0.27 0.44 11 I H H 123.84 1.43 12.11 13.55 93.60 31.49 -66.59 -37.07 25.06 0.47 74.46 8.30 5.41 12.93 67.06 5.74 0.09 0.23 0.24 12 F H H 125.22 2.49 12.49 15.69 93.61 51.49 -66.96 -38.11 16.75 0.32 82.93 6.88 2.85 8.10 76.43 5.39 0.04 0.18 0.13 13 E H H 95.49 4.14 12.40 18.06 93.02 53.11 -65.38 -40.09 6.28 0.09 93.62 3.01 1.11 2.55 91.00 2.23 0.01 0.05 0.03 14 S H H 59.49 2.40 13.99 16.94 92.56 51.86 -65.03 -40.41 3.67 0.06 96.27 1.26 0.54 1.96 94.51 1.67 0.02 0.03 0.02 15 L H H 94.65 1.99 14.46 16.41 92.46 49.87 -65.16 -40.89 2.43 0.04 97.53 0.67 0.31 1.44 95.92 1.62 0.01 0.02 0.01 16 Y H H 114.03 3.78 12.88 17.95 92.94 49.88 -66.44 -39.86 2.79 0.04 97.17 0.70 0.35 1.73 95.51 1.64 0.02 0.02 0.01 17 K H H 113.98 3.12 13.53 17.66 92.57 51.41 -66.36 -38.81 5.02 0.05 94.93 0.65 0.45 3.97 93.28 1.56 0.04 0.02 0.02 18 V H H 88.37 1.91 14.01 15.95 94.44 48.56 -68.26 -40.71 9.57 0.07 90.36 0.67 0.89 8.45 87.93 1.91 0.09 0.03 0.04 19 V H H 87.15 2.76 13.23 16.63 95.89 43.61 -73.83 -38.87 22.38 0.19 77.43 1.31 2.36 19.22 72.93 3.69 0.26 0.08 0.14 20 M H H 103.02 4.04 11.69 17.05 96.58 44.20 -77.73 -26.83 37.44 0.38 62.17 3.83 4.06 29.05 51.41 11.01 0.19 0.19 0.26 21 R C H 153.43 2.45 12.86 16.19 95.30 64.70 -73.70 -24.52 52.20 0.76 47.04 7.82 8.72 34.92 34.95 12.56 0.16 0.35 0.52 22 R C C 136.09 3.23 12.13 16.62 108.38 57.57 -97.49 91.26 64.94 1.83 33.23 26.73 15.45 24.05 22.18 9.59 0.06 0.70 1.24 23 N H H 90.93 4.79 11.57 17.95 101.50 -140.90 -73.86 -26.13 45.07 1.02 53.90 23.99 14.14 8.82 49.24 2.89 0.02 0.34 0.56 24 S H H 71.83 2.56 13.60 16.68 94.27 60.26 -66.84 -35.02 16.74 0.14 83.12 3.68 3.01 10.22 79.96 2.96 0.04 0.06 0.08 25 V H H 76.02 3.38 13.75 18.19 93.15 52.17 -66.59 -40.08 6.85 0.10 93.05 1.90 0.89 3.97 91.10 2.03 0.01 0.05 0.04 26 Y H H 109.49 4.53 13.68 19.64 92.27 51.46 -65.38 -40.61 2.01 0.02 97.97 0.68 0.22 0.96 97.12 1.00 0.00 0.01 0.00 27 V H H 79.10 3.36 14.92 19.01 92.01 50.32 -64.94 -41.53 0.74 0.01 99.26 0.24 0.06 0.33 99.12 0.25 0.00 0.00 0.00 28 T H H 73.81 2.78 15.57 18.76 92.13 50.40 -65.41 -40.99 0.47 0.00 99.53 0.09 0.03 0.27 99.42 0.20 0.00 0.00 0.00 29 F H H 115.58 2.82 15.78 19.05 92.53 49.25 -65.89 -41.40 0.38 0.00 99.62 0.04 0.02 0.26 99.54 0.13 0.00 0.00 0.00 30 V H H 78.31 3.51 15.71 19.91 92.31 49.06 -64.94 -42.19 0.44 0.00 99.56 0.04 0.03 0.31 99.54 0.08 0.00 0.00 0.00 31 I H H 90.52 3.33 16.41 20.14 92.15 48.35 -64.93 -42.21 0.49 0.00 99.50 0.05 0.03 0.35 99.49 0.07 0.00 0.00 0.00 32 A H H 56.07 2.68 16.61 19.48 91.78 49.73 -63.82 -42.01 0.35 0.00 99.65 0.03 0.02 0.24 99.62 0.10 0.00 0.00 0.00 33 G H H 35.40 2.67 16.56 19.44 92.18 50.16 -64.09 -41.27 0.51 0.00 99.49 0.03 0.02 0.38 99.42 0.15 0.00 0.00 0.00 34 A H H 51.85 3.40 15.86 20.11 91.90 50.21 -64.51 -41.70 0.91 0.00 99.09 0.04 0.03 0.75 98.98 0.20 0.00 0.00 0.00 35 F H H 108.62 3.33 16.37 20.14 92.19 49.47 -64.90 -41.71 1.35 0.00 98.64 0.08 0.06 1.10 98.56 0.20 0.00 0.00 0.00 36 L H H 96.11 1.88 17.07 18.25 91.60 49.84 -63.63 -41.88 0.65 0.00 99.35 0.07 0.03 0.44 99.31 0.15 0.00 0.00 0.00 37 G H H 39.45 2.03 16.32 18.03 91.85 49.76 -64.13 -41.29 0.66 0.00 99.34 0.07 0.03 0.44 99.30 0.15 0.00 0.00 0.00 38 E H H 97.48 3.61 15.43 19.89 92.11 50.59 -64.90 -40.74 0.54 0.00 99.46 0.05 0.03 0.36 99.44 0.12 0.00 0.00 0.00 39 R H H 126.21 3.14 16.00 19.64 91.83 50.18 -64.47 -40.84 0.55 0.00 99.45 0.06 0.03 0.36 99.44 0.10 0.00 0.00 0.00 40 A H H 61.45 1.77 16.77 17.73 91.69 50.33 -63.87 -41.69 0.61 0.00 99.39 0.09 0.04 0.39 99.37 0.11 0.00 0.00 0.00 41 V H H 84.61 2.02 16.63 18.18 91.94 48.85 -64.79 -41.74 0.67 0.00 99.33 0.10 0.04 0.43 99.32 0.11 0.00 0.00 0.00 42 D H H 66.00 4.69 14.64 20.74 91.80 50.02 -64.44 -41.13 0.77 0.00 99.22 0.11 0.04 0.50 99.24 0.11 0.00 0.00 0.00 43 Y H H 126.39 2.50 16.27 18.88 91.88 49.79 -64.76 -41.07 0.93 0.00 99.07 0.08 0.05 0.68 99.06 0.13 0.00 0.00 0.00 44 G H H 38.30 1.79 16.75 17.77 91.84 50.07 -64.11 -41.69 1.35 0.00 98.65 0.11 0.08 0.98 98.67 0.15 0.00 0.00 0.00 45 I H H 86.33 2.75 15.77 18.96 92.02 48.81 -65.15 -41.39 1.67 0.00 98.33 0.15 0.11 1.23 98.34 0.17 0.00 0.00 0.00 46 H H H 93.74 4.71 14.50 20.59 91.93 50.70 -64.73 -40.47 1.34 0.00 98.66 0.17 0.11 0.89 98.66 0.16 0.00 0.00 0.00 47 K H H 120.68 1.80 15.81 17.30 91.80 50.67 -64.31 -41.19 1.22 0.00 98.78 0.15 0.09 0.84 98.70 0.22 0.00 0.00 0.00 48 L H H 96.23 1.47 15.66 16.21 91.83 49.32 -64.01 -42.05 0.78 0.00 99.22 0.09 0.06 0.54 99.09 0.21 0.00 0.00 0.00 49 W H H 119.14 3.70 13.26 18.38 92.46 48.80 -65.31 -41.12 0.66 0.00 99.34 0.08 0.05 0.45 99.12 0.29 0.00 0.00 0.00 50 E H H 92.62 4.69 12.12 18.51 91.86 51.18 -65.11 -38.85 1.34 0.00 98.66 0.13 0.08 1.00 98.26 0.53 0.00 0.00 0.00 51 A H H 78.62 1.23 13.96 14.59 92.33 50.62 -68.44 -34.78 3.96 0.00 96.03 0.20 0.21 3.46 95.36 0.76 0.00 0.00 0.00 52 N H H 113.90 1.43 13.15 14.23 96.87 42.20 -85.50 -20.54 21.65 0.04 78.32 0.69 1.26 20.02 76.87 1.10 0.03 0.01 0.03 53 N C T 74.53 6.01 9.28 17.05 103.68 40.41 -108.91 26.31 68.87 0.54 30.60 13.64 6.30 47.67 29.54 2.31 0.01 0.19 0.33 54 V C T 94.19 3.85 10.09 15.84 110.51 142.81 -71.25 131.33 63.68 1.29 35.04 12.38 7.95 42.52 21.07 14.38 0.11 0.59 0.99 55 G C T 55.10 1.91 13.16 15.46 97.28 14.91 79.87 -6.94 61.42 0.45 38.13 7.35 8.17 44.68 18.09 21.06 0.05 0.20 0.40 56 K C T 134.65 2.23 12.08 15.09 98.57 77.55 -86.63 -9.30 54.22 0.83 44.94 16.51 11.29 26.16 21.06 23.96 0.06 0.36 0.61 57 R C C 129.80 4.52 10.95 16.99 98.86 64.67 -73.11 -27.50 53.93 2.12 43.96 23.66 12.46 18.34 21.27 21.94 0.10 0.93 1.30 58 Y H G 125.89 6.43 9.40 17.22 95.21 59.80 -73.15 -17.60 35.29 1.66 63.05 17.03 6.10 12.99 15.80 46.55 0.01 0.94 0.59 59 E H G 145.92 1.45 12.47 14.36 93.46 71.27 -69.61 -24.02 38.45 0.72 60.82 8.62 6.44 23.13 12.76 48.28 0.03 0.39 0.34 60 D H G 109.36 1.82 12.04 14.35 96.84 51.62 -88.74 -4.43 42.82 0.68 56.50 11.72 7.88 23.27 10.66 45.74 0.02 0.34 0.38 61 I C C 76.07 7.92 7.23 16.67 114.49 91.07 -96.15 120.14 90.55 1.06 8.39 49.65 39.14 2.28 5.64 2.05 0.00 0.29 0.95 62 P C C 94.23 2.45 12.06 15.75 110.60 -134.29 -72.16 138.38 82.28 1.23 16.50 67.56 6.82 8.08 8.85 7.36 0.00 0.65 0.68 63 V C C 98.73 4.68 8.89 15.40 111.44 -139.08 -91.94 123.27 76.74 2.55 20.71 53.36 10.02 13.03 9.56 11.20 0.00 1.26 1.56 64 L C T 123.91 2.57 9.21 13.68 111.92 -139.47 -84.56 127.30 76.49 1.75 21.76 23.03 13.43 40.46 10.28 10.87 0.02 0.89 1.03 65 G C T 58.06 1.92 10.60 13.46 103.02 14.94 83.20 2.08 80.64 1.50 17.87 22.57 15.74 43.24 7.46 9.42 0.01 0.77 0.80 66 Q C C 116.38 3.62 8.32 13.98 112.41 145.50 -89.95 133.04 81.66 2.77 15.57 57.75 15.71 8.18 8.69 6.73 0.00 1.42 1.51 67 K C C 144.05 2.35 9.01 13.10 114.26 -151.46 -95.47 132.82 79.66 3.50 16.84 60.37 11.73 7.28 9.80 7.15 0.00 2.00 1.68 68 L C C 115.28 3.43 7.64 12.96 107.69 -133.19 -83.37 130.19 67.80 2.64 29.56 44.96 9.88 12.99 8.97 20.61 0.00 1.62 0.96 69 S C C 86.75 1.97 7.50 11.01 108.66 -126.55 -85.80 110.92 70.77 1.72 27.51 41.10 11.19 18.77 6.85 20.40 0.00 0.95 0.74 70 E C C 149.67 1.59 7.15 10.16 105.26 82.47 -86.13 38.51 76.52 1.03 22.45 62.45 2.81 13.13 5.70 14.82 0.00 0.59 0.48 71 E C C 143.11 2.13 9.40 13.02 106.96 91.64 -85.38 87.12 99.87 0.03 0.09 99.67 0.13 0.13 0.04 0.01 0.00 0.01 0.01