# 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 103.47 8.88 12.30 21.98 115.08 -161.34 -92.64 131.09 99.89 0.09 0.02 99.83 0.07 0.03 0.01 0.00 0.00 0.04 0.01 1 A C C 64.63 6.40 12.13 20.02 114.56 -138.81 -86.77 132.72 92.40 5.88 1.72 88.26 1.12 3.64 0.81 0.58 0.00 4.19 1.41 2 R C C 146.67 5.78 13.68 21.12 116.12 -142.97 -96.43 128.18 83.70 14.26 2.04 65.47 13.80 4.09 1.04 1.09 0.00 10.48 4.03 3 V C C 35.28 15.25 12.22 28.04 120.15 -154.65 -108.00 132.78 88.64 10.51 0.84 82.15 6.28 0.63 0.54 0.30 0.00 7.65 2.45 4 T C C 54.08 5.34 22.22 27.59 124.32 -144.02 -91.70 160.86 87.31 11.50 1.18 84.56 2.94 0.34 1.13 0.18 0.00 5.78 5.08 5 V H H 33.36 19.24 12.89 31.85 91.57 -110.69 -58.46 -38.38 5.21 0.06 94.73 1.21 0.88 3.10 90.03 4.71 0.02 0.03 0.02 6 E H H 117.53 3.16 19.18 22.78 91.51 54.93 -63.10 -39.31 2.88 0.02 97.10 0.34 0.27 2.12 92.74 4.50 0.01 0.01 0.00 7 D H H 66.85 4.49 18.93 24.07 91.99 50.07 -66.67 -38.29 2.03 0.02 97.95 0.25 0.18 1.45 92.28 5.81 0.00 0.01 0.00 8 C H H 8.32 20.41 12.29 32.82 92.69 51.60 -67.00 -38.58 2.66 0.02 97.32 0.41 0.28 1.79 92.79 4.70 0.01 0.02 0.00 9 L H H 58.24 13.05 13.91 27.39 91.50 58.18 -65.95 -30.13 7.79 0.07 92.15 0.85 0.64 5.81 81.62 10.98 0.03 0.04 0.03 10 D H H 120.66 0.94 19.20 18.29 91.69 57.58 -72.59 -21.05 26.78 0.05 73.17 0.70 1.08 25.27 65.65 7.19 0.04 0.02 0.04 11 K H H 113.41 5.96 15.79 22.72 98.94 42.28 -97.36 -15.01 39.29 0.06 60.65 1.04 2.34 35.93 55.73 4.85 0.03 0.02 0.06 12 V C C 25.30 17.97 7.85 24.89 126.75 53.84 -123.99 143.77 93.09 0.87 6.04 73.65 14.84 3.47 6.25 0.59 0.00 0.20 0.99 13 E C S 158.46 1.00 17.28 17.25 95.52 -148.92 -79.41 -24.95 99.56 0.19 0.25 40.24 57.63 1.74 0.14 0.08 0.00 0.06 0.11 14 T C S 61.94 4.18 17.90 22.91 133.42 27.41 -138.31 154.78 98.30 0.80 0.89 42.46 54.80 0.86 0.78 0.13 0.00 0.15 0.83 15 R H H 110.65 12.55 14.05 26.81 92.26 -117.85 -60.56 -36.14 1.64 0.00 98.35 0.14 0.25 1.17 98.10 0.34 0.00 0.00 0.00 16 F H H 119.46 5.04 19.37 24.80 91.62 55.24 -63.66 -41.01 0.81 0.00 99.19 0.06 0.06 0.64 98.91 0.33 0.00 0.00 0.00 17 D H H 53.30 7.77 20.27 28.99 91.62 49.96 -65.13 -40.46 0.13 0.00 99.87 0.02 0.01 0.08 99.72 0.17 0.00 0.00 0.00 18 L H H 11.72 20.73 16.69 37.62 91.69 51.02 -63.10 -43.15 0.04 0.00 99.96 0.00 0.00 0.02 99.95 0.03 0.00 0.00 0.00 19 V H H 42.28 13.55 21.75 35.21 91.47 49.69 -63.98 -42.49 0.04 0.00 99.96 0.00 0.00 0.02 99.96 0.01 0.00 0.00 0.00 20 V H H 72.23 4.60 25.67 30.21 91.42 49.36 -63.92 -42.60 0.04 0.00 99.96 0.00 0.00 0.03 99.96 0.01 0.00 0.00 0.00 21 L H H 30.45 13.28 22.92 36.79 91.53 49.47 -64.44 -42.78 0.05 0.00 99.95 0.00 0.00 0.03 99.96 0.01 0.00 0.00 0.00 22 A H H 6.98 21.49 20.31 41.66 91.16 50.58 -63.57 -42.70 0.12 0.00 99.88 0.00 0.00 0.08 99.90 0.01 0.00 0.00 0.00 23 S H H 40.13 10.08 23.94 34.20 91.46 51.33 -63.65 -42.11 0.34 0.00 99.66 0.02 0.01 0.22 99.72 0.02 0.00 0.00 0.00 24 M H H 88.01 4.82 26.24 31.18 91.69 49.54 -64.52 -42.03 0.44 0.00 99.56 0.05 0.02 0.27 99.63 0.03 0.00 0.00 0.00 25 R H H 49.54 14.89 22.69 37.22 92.04 49.40 -64.77 -41.81 0.47 0.00 99.53 0.07 0.03 0.26 99.57 0.06 0.00 0.00 0.00 26 A H H 10.10 19.40 18.42 37.91 91.39 51.65 -62.82 -42.24 0.51 0.00 99.49 0.09 0.04 0.27 99.49 0.12 0.00 0.00 0.00 27 N H H 76.64 4.92 23.83 28.76 91.51 50.62 -63.84 -41.08 1.17 0.01 98.82 0.18 0.08 0.76 98.64 0.33 0.00 0.00 0.00 28 K H H 91.10 4.90 22.32 27.33 91.85 50.27 -64.93 -41.35 2.73 0.03 97.25 0.45 0.26 1.86 96.76 0.64 0.01 0.01 0.00 29 I H H 21.73 16.41 15.44 32.45 92.25 50.17 -65.28 -41.25 5.91 0.10 93.99 1.71 0.80 3.39 93.12 0.89 0.01 0.05 0.03 30 L H H 64.31 11.57 15.35 27.37 92.56 50.67 -66.73 -37.57 15.19 0.26 84.55 5.99 1.93 7.59 82.59 1.66 0.02 0.13 0.10 31 K H H 145.48 1.74 16.82 18.22 94.74 51.06 -72.24 -30.04 32.54 0.39 67.07 9.67 4.59 18.44 65.00 1.89 0.04 0.16 0.20 32 N C T 105.24 3.38 14.34 18.59 98.96 41.32 -88.56 -3.41 70.22 0.34 29.43 12.84 10.83 44.84 28.96 2.16 0.02 0.12 0.23 33 G C T 41.43 5.86 14.30 21.36 106.96 -106.26 82.30 9.28 94.33 0.27 5.41 35.33 12.92 46.50 3.37 1.61 0.00 0.13 0.16 34 Y C C 105.43 11.28 12.09 23.57 106.05 77.61 -83.64 40.50 91.09 0.68 8.23 71.04 11.62 8.39 5.11 3.00 0.00 0.29 0.54 35 S C C 64.21 6.16 15.11 22.29 106.37 108.06 -87.45 18.98 79.14 0.91 19.96 54.09 14.26 10.74 12.14 7.72 0.00 0.39 0.65 36 E C C 113.46 5.41 15.71 22.11 100.60 52.99 -80.23 -13.32 63.48 0.98 35.55 36.28 13.41 13.95 20.53 14.76 0.01 0.45 0.60 37 S C C 48.50 9.55 13.40 23.92 100.65 55.56 -73.84 -13.02 60.20 1.23 38.57 37.30 8.94 13.86 21.60 17.01 0.01 0.64 0.65 38 M C C 83.95 9.87 14.05 24.57 98.50 59.14 -77.11 -19.10 57.77 1.93 40.30 30.09 13.67 14.79 24.55 14.86 0.04 0.86 1.15 39 E C C 82.95 9.31 12.70 23.03 103.69 68.89 -85.19 25.41 63.07 1.94 34.99 32.85 18.90 12.47 24.35 9.43 0.03 0.79 1.19 40 N C C 98.09 4.67 13.81 19.76 103.64 63.34 -80.46 41.31 71.40 1.01 27.59 46.75 11.67 12.76 17.73 10.00 0.00 0.48 0.61 41 E C C 104.74 7.38 10.88 19.50 102.08 70.37 -84.12 -1.30 65.90 0.98 33.12 37.75 11.92 15.70 17.43 16.12 0.00 0.45 0.64 42 K C C 134.62 3.94 12.55 17.97 103.00 71.02 -81.24 9.94 65.59 0.86 33.54 30.19 13.43 22.12 15.60 17.66 0.01 0.36 0.63 43 K C C 138.72 4.17 13.05 18.60 103.08 27.50 -81.58 36.81 71.11 0.75 28.14 31.53 15.64 24.16 12.48 15.30 0.00 0.30 0.59 44 E C C 93.88 9.09 12.42 22.50 112.16 140.65 -91.72 127.48 82.23 0.69 17.08 48.29 19.84 13.94 9.08 8.01 0.00 0.26 0.58 45 K C C 105.39 5.61 19.29 25.20 115.60 -112.29 -79.64 146.77 88.26 0.81 10.92 65.21 19.90 1.97 11.33 0.80 0.00 0.22 0.58 46 A H H 33.50 16.15 16.41 32.31 92.97 -116.61 -59.82 -37.49 2.99 0.01 97.00 0.69 0.51 1.47 97.06 0.27 0.00 0.00 0.00 47 T H H 33.44 16.90 20.04 36.20 92.32 53.85 -64.54 -40.25 1.42 0.00 98.57 0.28 0.14 0.82 98.52 0.23 0.00 0.00 0.00 48 V H H 41.99 10.00 23.44 33.97 92.18 49.75 -65.14 -41.94 0.37 0.00 99.62 0.09 0.03 0.18 99.55 0.14 0.00 0.00 0.00 49 V H H 24.81 12.49 23.50 36.87 91.74 49.82 -63.37 -43.14 0.07 0.00 99.93 0.01 0.00 0.03 99.92 0.03 0.00 0.00 0.00 50 A H H 5.85 21.18 21.00 42.26 91.64 50.81 -62.61 -43.58 0.04 0.00 99.96 0.00 0.00 0.02 99.96 0.01 0.00 0.00 0.00 51 L H H 31.29 17.01 23.50 40.00 91.71 49.96 -63.92 -42.20 0.03 0.00 99.97 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 52 R H H 96.12 7.36 25.81 33.70 91.86 50.08 -64.24 -41.80 0.03 0.00 99.97 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 53 E H H 25.57 13.05 20.66 34.88 91.69 49.58 -63.83 -42.76 0.10 0.00 99.89 0.01 0.00 0.07 99.91 0.02 0.00 0.00 0.00 54 I H H 19.66 19.18 17.09 36.47 92.03 48.89 -64.18 -43.19 0.29 0.00 99.71 0.02 0.01 0.22 99.70 0.06 0.00 0.00 0.00 55 A H H 49.80 10.44 18.06 28.91 90.96 51.37 -65.24 -33.34 2.71 0.00 97.29 0.05 0.06 2.61 97.16 0.12 0.00 0.00 0.00 56 E C T 112.43 3.79 18.37 22.52 92.40 50.88 -84.98 -4.08 83.34 0.01 16.65 0.18 0.66 81.29 17.63 0.23 0.00 0.00 0.01 57 S C T 74.35 7.25 15.24 23.95 93.65 -118.55 68.02 25.52 99.59 0.00 0.40 0.47 1.12 98.14 0.23 0.03 0.00 0.00 0.00 58 E C S 96.48 6.61 18.64 26.28 95.08 127.08 -82.62 -18.03 99.42 0.35 0.23 31.39 66.68 1.39 0.12 0.09 0.00 0.11 0.22 59 I C S 15.08 22.20 11.93 33.72 121.14 48.59 -119.33 125.18 95.14 4.42 0.43 25.87 68.36 0.95 0.27 0.12 0.00 1.01 3.40 60 T C C 53.19 5.80 23.42 29.20 130.81 -167.84 -117.54 164.29 98.55 0.94 0.51 94.72 3.77 0.17 0.48 0.06 0.00 0.37 0.42 61 S H H 47.79 13.59 14.50 28.34 91.92 -105.39 -59.50 -36.31 10.85 0.11 89.04 2.02 1.71 7.19 80.60 8.32 0.05 0.06 0.05 62 E H H 126.49 1.96 19.43 20.91 91.55 54.84 -64.33 -38.96 7.23 0.09 92.68 1.22 0.86 4.97 83.98 8.85 0.03 0.06 0.03 63 Q H H 52.62 9.47 16.25 27.21 92.31 50.16 -66.44 -39.29 5.03 0.13 94.85 1.42 0.77 2.81 85.05 9.81 0.02 0.09 0.03 64 I H H 23.11 17.13 13.16 30.53 92.77 50.30 -66.34 -40.83 10.70 0.57 88.73 4.75 2.03 4.72 82.45 5.50 0.03 0.37 0.15 65 L H H 75.11 6.05 15.81 23.25 93.14 50.41 -66.65 -37.53 25.16 1.10 73.74 12.80 4.29 9.45 68.89 3.57 0.04 0.62 0.35 66 R H H 135.70 3.41 14.96 19.31 94.21 55.18 -67.80 -36.98 24.68 0.82 74.51 13.07 5.06 8.01 68.98 4.14 0.03 0.47 0.25 67 N H H 94.11 4.75 13.89 19.79 95.91 47.56 -72.33 -27.50 28.16 0.98 70.86 14.55 4.79 9.70 64.44 5.57 0.03 0.64 0.28 68 E H H 101.44 6.84 12.23 20.31 96.44 56.75 -73.75 -26.34 32.71 1.64 65.65 17.77 5.22 10.86 58.93 5.62 0.03 1.11 0.46 69 I H H 94.74 6.59 10.45 18.38 100.59 58.02 -82.96 -15.11 40.06 3.33 56.61 23.39 7.05 11.86 50.47 4.12 0.07 1.95 1.09 70 E C C 136.81 2.46 11.07 14.87 103.80 68.95 -84.29 10.11 65.01 1.48 33.50 46.07 2.32 14.37 34.22 1.66 0.00 0.73 0.63 71 G C C 49.78 3.73 13.09 18.18 108.19 -35.11 77.93 -10.91 99.88 0.04 0.08 99.30 0.19 0.41 0.06 0.01 0.00 0.02 0.01