# 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 93.08 9.97 13.08 23.66 115.74 -154.40 -92.15 135.22 99.91 0.06 0.02 99.80 0.12 0.03 0.01 0.00 0.00 0.02 0.01 1 D C C 79.30 6.21 13.65 21.14 111.15 -122.59 -82.08 128.24 89.36 0.20 10.44 86.81 0.65 1.71 10.21 0.43 0.00 0.07 0.11 2 P C H 78.58 7.29 12.89 21.46 95.50 -135.39 -64.69 -27.98 52.30 0.31 47.38 23.01 4.60 23.48 46.00 2.60 0.01 0.13 0.17 3 V H H 78.73 5.51 15.76 22.24 94.55 56.80 -68.93 -37.82 33.92 0.77 65.31 16.17 4.20 14.37 61.78 2.73 0.03 0.38 0.34 4 L H H 64.06 9.25 17.21 27.25 93.59 53.28 -66.53 -39.80 8.99 0.17 90.84 4.74 1.49 3.18 88.46 1.98 0.01 0.09 0.06 5 G H H 17.04 13.73 16.43 30.69 92.89 53.08 -64.19 -41.42 4.78 0.07 95.15 2.26 0.66 1.99 93.83 1.20 0.00 0.04 0.02 6 D H H 71.93 7.46 20.36 28.09 92.73 50.77 -65.90 -39.85 2.16 0.04 97.80 0.98 0.29 0.93 97.08 0.69 0.00 0.02 0.01 7 V H H 62.46 6.41 21.56 28.49 92.40 49.88 -65.25 -42.63 0.95 0.03 99.03 0.36 0.12 0.45 98.84 0.21 0.00 0.02 0.00 8 I H H 38.55 13.28 20.57 34.24 92.37 48.66 -64.47 -42.85 0.44 0.01 99.55 0.15 0.04 0.21 99.53 0.07 0.00 0.00 0.00 9 A H H 21.60 15.59 19.49 35.25 92.00 50.38 -63.43 -42.12 0.39 0.00 99.61 0.09 0.03 0.21 99.61 0.06 0.00 0.00 0.00 10 T H H 58.44 6.90 22.89 29.98 92.06 49.98 -65.01 -41.70 0.51 0.00 99.49 0.09 0.04 0.32 99.50 0.06 0.00 0.00 0.00 11 R H H 101.24 7.40 23.12 30.78 92.20 48.76 -65.28 -41.68 0.38 0.00 99.62 0.05 0.02 0.26 99.62 0.05 0.00 0.00 0.00 12 I H H 27.39 16.99 20.02 36.74 92.10 48.28 -64.82 -43.00 0.29 0.00 99.71 0.04 0.02 0.20 99.70 0.04 0.00 0.00 0.00 13 Y H H 63.58 14.90 20.75 35.14 91.86 49.77 -63.59 -42.43 0.25 0.00 99.75 0.03 0.02 0.17 99.73 0.05 0.00 0.00 0.00 14 K H H 104.91 5.00 23.73 28.73 91.98 49.52 -64.67 -41.51 0.35 0.00 99.65 0.03 0.02 0.26 99.61 0.07 0.00 0.00 0.00 15 A H H 29.76 8.17 20.97 30.41 92.02 49.57 -64.57 -42.02 0.82 0.00 99.18 0.06 0.04 0.66 99.09 0.15 0.00 0.00 0.00 16 C H H 19.32 15.16 18.40 34.23 92.45 48.88 -65.32 -41.58 2.83 0.01 97.15 0.24 0.19 2.30 96.92 0.33 0.00 0.00 0.00 17 F H H 57.59 11.09 17.80 29.89 92.27 49.79 -65.14 -40.71 4.58 0.08 95.34 0.81 0.51 3.27 94.18 1.14 0.02 0.04 0.02 18 K H H 113.76 3.77 19.38 23.46 92.85 51.30 -66.23 -39.15 5.24 0.12 94.64 0.99 0.59 3.71 92.50 2.09 0.03 0.07 0.03 19 H H H 93.19 7.03 17.16 24.97 95.26 45.54 -73.78 -36.47 8.07 0.13 91.79 1.13 0.81 6.20 89.38 2.32 0.04 0.08 0.05 20 V H H 55.77 11.02 14.56 26.22 100.06 36.79 -85.28 -36.32 16.35 0.26 83.39 1.95 2.02 12.76 81.05 1.88 0.10 0.12 0.12 21 Y H H 112.03 7.10 13.48 21.81 102.31 32.30 -96.80 -6.47 44.96 1.07 53.98 7.52 9.28 29.01 50.86 2.11 0.19 0.39 0.64 22 G C T 45.92 4.29 12.86 18.55 107.34 -124.03 70.34 2.46 81.82 1.05 17.13 30.35 14.90 37.23 10.08 6.40 0.00 0.49 0.55 23 K C T 151.52 2.30 12.16 15.46 103.64 73.97 -83.93 13.43 79.21 1.43 19.36 23.31 22.33 34.59 7.70 10.58 0.02 0.68 0.80 24 N C C 116.02 2.57 12.93 16.59 105.05 51.85 -92.24 58.64 81.20 2.15 16.65 41.80 14.24 25.73 6.41 9.68 0.01 1.21 0.94 25 M C C 81.88 11.44 8.66 20.39 112.68 157.96 -91.30 126.27 80.48 4.96 14.56 63.99 9.89 6.49 7.02 7.62 0.00 3.24 1.75 26 K C C 140.44 2.83 15.05 19.09 115.64 -148.69 -95.63 134.96 78.70 8.26 13.04 57.62 11.68 9.35 6.49 6.58 0.01 5.87 2.39 27 A C C 68.74 6.11 13.58 21.18 114.44 -116.15 -83.14 138.61 79.73 8.61 11.66 55.64 15.70 8.67 5.81 5.74 0.01 6.14 2.30 28 Y C C 79.05 13.50 9.29 22.73 119.43 -146.82 -97.92 143.35 86.77 7.43 5.80 66.06 18.00 2.72 4.20 1.78 0.00 4.52 2.71 29 S C C 57.61 2.79 15.44 18.52 121.06 -120.40 -79.77 164.86 91.98 3.26 4.75 84.73 6.07 1.07 4.66 0.53 0.00 1.93 1.01 30 E H H 146.05 2.16 12.05 15.67 92.10 -101.51 -59.67 -35.70 7.27 0.06 92.67 1.98 1.52 3.90 89.84 2.69 0.01 0.03 0.02 31 K H H 148.81 0.96 14.94 14.79 92.36 53.10 -65.80 -37.87 5.97 0.04 93.99 1.24 0.81 3.76 90.87 3.28 0.01 0.02 0.01 32 D H H 48.25 8.95 12.64 23.13 93.85 48.41 -68.91 -36.99 4.93 0.06 95.01 1.92 0.72 2.34 91.09 3.87 0.00 0.04 0.02 33 E H H 69.72 11.28 13.67 25.68 92.12 55.40 -62.72 -41.41 1.30 0.01 98.69 0.50 0.18 0.55 98.23 0.53 0.00 0.00 0.00 34 A H H 59.76 2.11 19.20 20.38 91.68 50.94 -64.17 -41.19 0.92 0.01 99.07 0.26 0.10 0.47 98.88 0.28 0.00 0.00 0.00 35 K H H 103.15 3.79 19.55 23.61 91.99 49.91 -65.08 -41.12 0.97 0.01 99.02 0.25 0.10 0.54 98.83 0.28 0.00 0.00 0.00 36 F H H 31.82 16.40 14.85 31.68 92.05 50.51 -64.24 -42.35 0.68 0.01 99.32 0.19 0.08 0.34 99.21 0.18 0.00 0.00 0.00 37 D H H 67.24 7.84 19.69 28.23 91.68 50.98 -63.45 -41.00 0.67 0.01 99.32 0.18 0.07 0.35 99.26 0.13 0.00 0.00 0.00 38 Q H H 107.69 1.87 22.14 22.30 92.01 49.98 -65.37 -41.09 0.87 0.01 99.13 0.18 0.08 0.53 99.05 0.16 0.00 0.00 0.00 39 C H H 39.38 8.95 18.87 29.12 92.16 49.67 -64.93 -42.20 1.48 0.01 98.51 0.29 0.14 0.94 98.40 0.22 0.00 0.01 0.00 40 L H H 33.39 16.00 16.85 32.99 92.21 50.09 -64.71 -41.35 1.57 0.02 98.40 0.37 0.18 0.93 98.24 0.25 0.00 0.01 0.00 41 T H H 66.58 4.96 20.40 25.80 91.78 50.71 -64.09 -41.48 1.58 0.02 98.40 0.38 0.19 0.93 98.16 0.32 0.00 0.01 0.00 42 S H H 57.89 2.84 21.26 23.30 92.10 50.24 -65.17 -41.20 2.26 0.02 97.71 0.44 0.24 1.46 97.35 0.47 0.00 0.01 0.00 43 Y H H 68.41 11.27 17.98 29.95 92.75 49.47 -65.81 -41.90 2.85 0.05 97.10 0.65 0.35 1.79 96.48 0.69 0.01 0.02 0.01 44 V H H 38.56 13.05 15.98 29.71 92.33 49.65 -64.85 -41.64 3.20 0.07 96.72 0.87 0.43 1.88 95.77 0.98 0.01 0.04 0.02 45 E H H 111.33 2.57 19.77 21.85 92.50 51.28 -65.47 -40.05 8.31 0.09 91.59 1.33 0.81 6.04 89.83 1.88 0.02 0.05 0.03 46 S H H 58.77 3.74 18.25 22.35 92.92 50.75 -67.88 -37.00 22.97 0.14 76.90 2.52 1.98 18.09 74.88 2.36 0.04 0.06 0.07 47 Y H H 71.84 12.86 14.17 27.30 96.91 49.87 -77.03 -26.45 32.03 0.79 67.17 12.43 6.43 14.55 62.35 3.45 0.06 0.37 0.36 48 K H H 110.36 6.67 16.14 23.93 94.09 68.76 -64.58 -37.98 32.33 1.58 66.08 16.79 5.84 10.93 60.88 4.05 0.05 0.96 0.50 49 S H H 66.30 2.68 17.79 20.12 94.41 52.61 -70.16 -36.73 34.56 2.15 63.29 19.10 5.33 11.05 58.33 4.15 0.05 1.44 0.55 50 V H H 62.24 7.89 15.64 24.64 95.04 50.29 -69.59 -39.13 29.02 2.48 68.49 16.51 5.80 8.35 63.05 3.96 0.06 1.66 0.60 51 T H H 50.26 10.71 15.20 26.48 95.49 50.64 -68.93 -39.55 27.97 1.87 70.16 14.73 5.49 8.94 65.83 3.28 0.05 1.18 0.49 52 N H H 88.05 4.57 17.53 22.65 94.65 52.04 -67.87 -35.79 30.12 1.28 68.60 14.02 5.85 11.25 64.28 3.41 0.04 0.77 0.37 53 H H H 98.39 4.47 17.61 22.72 94.06 53.51 -67.90 -39.42 22.71 1.47 75.82 11.24 4.08 8.52 71.01 3.69 0.05 1.03 0.36 54 F H H 65.45 11.19 15.45 27.43 93.90 51.35 -66.50 -41.03 12.54 2.58 84.88 6.55 2.20 4.85 79.13 4.47 0.08 2.33 0.38 55 I H H 63.30 9.36 15.49 25.86 93.32 49.51 -66.70 -39.95 8.70 2.59 88.71 4.09 1.51 3.86 81.96 5.61 0.08 2.63 0.27 56 T H H 75.51 3.57 17.08 21.00 93.79 50.11 -68.65 -38.50 11.02 2.04 86.94 4.19 1.81 5.78 79.29 6.57 0.12 1.95 0.29 57 Y H H 117.94 5.91 15.63 22.55 94.90 49.49 -73.02 -31.85 18.02 1.44 80.54 4.91 2.82 11.14 73.04 6.40 0.21 1.11 0.37 58 L H H 74.33 10.02 12.92 23.60 97.63 51.33 -80.23 -15.36 37.13 1.49 61.38 6.54 5.62 25.92 54.81 5.33 0.31 0.84 0.62 59 G C T 45.56 5.47 15.11 21.55 101.60 28.69 70.28 -0.39 66.66 1.64 31.69 15.56 10.76 40.07 27.81 4.19 0.07 0.82 0.72 60 Q C C 121.62 3.52 14.83 19.55 107.63 68.99 -92.77 65.93 79.67 3.21 17.12 40.73 18.45 21.02 12.35 4.33 0.03 1.46 1.63 61 L C C 69.20 11.62 9.74 21.95 116.97 109.06 -87.05 138.89 93.10 2.79 4.11 60.71 30.02 2.52 3.15 0.99 0.00 1.12 1.49 62 P C C 73.12 6.08 12.68 20.40 111.76 -105.70 -68.07 148.88 90.74 2.19 7.07 79.03 6.40 5.59 3.73 3.03 0.00 1.27 0.96 63 K C C 148.37 3.45 11.00 16.25 107.38 -118.39 -80.84 116.65 80.90 5.69 13.40 52.83 15.56 12.36 4.90 8.42 0.01 2.68 3.23 64 K C T 152.02 2.28 11.25 15.05 112.91 -113.66 -88.99 123.46 81.34 4.63 14.03 21.82 19.43 41.02 4.04 9.18 0.04 2.64 1.82 65 G C T 53.80 3.14 11.76 16.36 105.73 8.42 84.12 6.35 85.22 5.42 9.35 28.87 17.75 39.58 2.15 6.72 0.01 3.68 1.25 66 L C C 92.63 7.39 8.88 17.65 114.93 139.44 -90.30 132.86 78.63 14.85 6.52 61.61 11.14 5.33 2.45 4.21 0.01 10.71 4.53 67 S C C 75.58 3.37 11.52 16.56 116.36 -152.44 -97.79 135.93 73.88 20.39 5.73 60.08 7.76 5.14 2.43 3.40 0.01 16.05 5.14 68 L C C 112.63 5.43 8.50 15.64 104.48 -152.97 -86.79 10.53 76.12 16.19 7.69 44.07 17.11 16.16 2.27 5.11 0.02 11.93 3.32 69 D C C 118.15 1.57 9.54 12.28 108.10 105.88 -88.93 84.00 83.58 10.69 5.73 40.24 19.01 25.79 1.42 3.90 0.01 7.59 2.05 70 G C C 55.77 2.58 9.15 13.42 109.95 23.61 26.85 120.49 93.84 3.64 2.52 72.35 5.92 15.84 0.61 1.59 0.00 2.67 1.03 71 S C C 86.01 2.44 11.25 15.17 112.69 -89.28 -92.53 134.71 99.53 0.44 0.03 99.27 0.29 0.08 0.01 0.01 0.00 0.26 0.09