# 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 G C C 42.33 5.29 13.61 20.34 117.94 -133.04 95.85 -163.73 99.95 0.03 0.02 99.85 0.08 0.04 0.01 0.00 0.00 0.01 0.00 1 S C C 84.27 2.76 11.52 15.63 107.66 -77.94 -89.42 77.70 76.49 0.61 22.90 66.72 1.48 8.67 19.84 2.66 0.00 0.27 0.35 2 M C C 117.61 4.61 9.92 16.21 104.76 84.15 -84.42 19.89 62.84 0.88 36.28 38.89 10.09 13.78 31.01 5.35 0.00 0.37 0.51 3 S C H 60.18 5.31 12.04 18.79 104.77 75.70 -80.74 -14.71 56.99 0.60 42.41 35.90 11.11 9.81 38.03 4.57 0.00 0.24 0.32 4 N H H 91.80 4.16 15.73 20.56 99.28 39.46 -75.30 -24.37 44.49 0.46 55.05 29.15 9.29 6.17 52.61 2.39 0.00 0.16 0.23 5 L H H 45.78 13.72 12.84 26.85 93.51 67.50 -64.99 -40.52 6.22 0.04 93.74 3.04 1.25 2.17 92.60 0.91 0.00 0.02 0.02 6 E H H 89.92 8.08 16.41 25.34 92.17 52.32 -63.75 -41.07 2.66 0.02 97.32 1.08 0.37 1.16 96.76 0.61 0.00 0.01 0.00 7 K H H 115.81 1.98 20.07 20.76 92.10 49.72 -65.65 -40.81 2.05 0.02 97.94 0.85 0.28 0.91 97.44 0.50 0.00 0.01 0.00 8 Q H H 72.71 6.98 18.48 26.44 91.91 50.57 -64.98 -41.49 0.97 0.00 99.02 0.41 0.11 0.40 98.90 0.17 0.00 0.00 0.00 9 I H H 23.26 17.10 15.29 32.82 92.11 49.79 -64.41 -42.51 0.39 0.00 99.61 0.14 0.03 0.17 99.59 0.07 0.00 0.00 0.00 10 E H H 95.88 4.54 21.75 26.40 91.46 50.77 -63.42 -41.75 0.25 0.00 99.74 0.06 0.02 0.12 99.74 0.05 0.00 0.00 0.00 11 Q H H 98.09 2.16 23.24 23.69 91.72 49.29 -64.46 -42.01 0.31 0.00 99.69 0.06 0.02 0.17 99.70 0.05 0.00 0.00 0.00 12 A H H 15.39 13.77 17.32 32.42 91.79 50.46 -63.95 -41.85 0.51 0.00 99.49 0.08 0.03 0.27 99.55 0.06 0.00 0.00 0.00 13 R H H 74.36 14.48 18.93 32.94 91.73 50.75 -63.14 -41.91 0.54 0.00 99.45 0.10 0.03 0.28 99.54 0.05 0.00 0.00 0.00 14 E H H 108.98 2.08 24.43 24.75 91.57 49.67 -63.79 -41.94 0.36 0.00 99.64 0.06 0.02 0.18 99.70 0.04 0.00 0.00 0.00 15 E H H 90.60 4.04 23.14 26.93 91.57 48.77 -64.65 -41.04 0.34 0.00 99.66 0.05 0.02 0.18 99.72 0.04 0.00 0.00 0.00 16 A H H 7.95 18.95 15.07 34.76 91.46 51.05 -63.34 -42.29 0.25 0.00 99.75 0.03 0.01 0.13 99.78 0.04 0.00 0.00 0.00 17 H H H 89.56 8.12 21.11 29.65 91.52 50.66 -63.31 -41.36 0.33 0.00 99.67 0.04 0.02 0.19 99.70 0.05 0.00 0.00 0.00 18 K H H 119.77 1.46 23.92 22.60 91.67 49.51 -63.87 -42.55 0.78 0.00 99.21 0.08 0.05 0.53 99.27 0.08 0.00 0.00 0.00 19 I H H 42.38 7.85 17.97 27.67 91.99 48.32 -64.45 -42.19 1.28 0.01 98.71 0.15 0.13 0.85 98.75 0.13 0.00 0.00 0.00 20 C H H 18.20 16.09 12.08 28.68 91.87 50.10 -64.76 -40.19 1.59 0.01 98.41 0.23 0.16 1.03 98.24 0.34 0.00 0.00 0.00 21 D H H 109.87 1.98 17.03 18.93 92.54 48.28 -68.25 -37.48 2.92 0.00 97.07 0.18 0.21 2.46 96.56 0.58 0.01 0.00 0.00 22 T H H 106.64 0.85 16.56 15.43 99.14 37.50 -82.37 -38.24 5.66 0.01 94.33 0.17 0.44 5.16 93.67 0.54 0.02 0.00 0.00 23 E H H 114.92 3.25 13.85 17.99 101.38 23.90 -105.66 -13.47 12.97 0.05 86.98 0.96 2.98 9.25 86.27 0.44 0.05 0.01 0.04 24 G C C 25.43 4.92 15.32 22.10 126.09 -124.14 88.00 169.61 93.57 0.26 6.16 77.06 6.65 8.90 1.59 5.45 0.00 0.12 0.24 25 A C T 69.28 8.85 11.96 21.85 92.72 -56.67 -67.05 -21.91 94.16 0.13 5.71 2.05 11.80 79.64 0.42 5.93 0.00 0.07 0.09 26 T C T 114.08 1.00 15.62 15.67 95.23 55.14 -91.76 -0.55 93.98 0.12 5.90 4.61 10.34 78.01 0.61 6.29 0.00 0.06 0.08 27 S C S 36.09 9.09 9.41 20.45 116.04 114.81 -74.28 145.16 96.76 0.31 2.93 42.38 53.68 0.65 2.61 0.28 0.00 0.05 0.35 28 G H H 57.22 1.24 17.97 18.07 93.31 -123.82 -61.91 -37.87 6.58 0.01 93.41 0.63 1.17 4.34 93.17 0.67 0.00 0.00 0.00 29 Q H H 95.86 5.72 18.07 24.65 92.21 52.96 -65.63 -38.86 2.67 0.00 97.32 0.26 0.23 1.96 97.03 0.52 0.00 0.00 0.00 30 C H H 13.88 16.80 13.22 30.75 91.78 51.02 -63.89 -41.76 0.55 0.00 99.45 0.12 0.05 0.29 99.29 0.25 0.00 0.00 0.00 31 A H H 51.92 4.08 22.02 26.14 91.32 51.09 -62.91 -42.11 0.17 0.00 99.83 0.03 0.01 0.08 99.81 0.06 0.00 0.00 0.00 32 A H H 51.93 2.99 23.56 25.70 91.35 50.18 -63.55 -42.33 0.12 0.00 99.88 0.02 0.00 0.07 99.88 0.03 0.00 0.00 0.00 33 A H H 11.70 16.15 17.82 34.85 91.29 50.48 -63.61 -42.94 0.09 0.00 99.91 0.01 0.00 0.06 99.91 0.02 0.00 0.00 0.00 34 W H H 81.11 12.91 20.56 33.39 91.37 50.79 -62.85 -42.19 0.07 0.00 99.93 0.01 0.00 0.04 99.94 0.01 0.00 0.00 0.00 35 D H H 84.55 2.03 24.91 25.00 91.31 49.90 -63.61 -41.92 0.09 0.00 99.91 0.01 0.00 0.05 99.93 0.01 0.00 0.00 0.00 36 A H H 33.64 7.81 20.92 29.95 91.54 49.87 -64.09 -42.28 0.11 0.00 99.89 0.01 0.00 0.07 99.91 0.01 0.00 0.00 0.00 37 L H H 19.88 17.81 16.37 34.57 91.81 50.17 -63.95 -42.65 0.10 0.00 99.90 0.01 0.00 0.06 99.92 0.01 0.00 0.00 0.00 38 E H H 98.30 4.27 22.13 26.50 91.32 50.44 -63.33 -41.43 0.13 0.00 99.87 0.01 0.00 0.07 99.90 0.01 0.00 0.00 0.00 39 E H H 108.89 2.04 22.52 22.97 91.61 49.71 -64.28 -41.50 0.19 0.00 99.81 0.02 0.01 0.12 99.84 0.02 0.00 0.00 0.00 40 L H H 39.04 12.60 17.07 30.55 91.70 49.61 -64.93 -41.24 0.27 0.00 99.73 0.03 0.01 0.16 99.77 0.03 0.00 0.00 0.00 41 Q H H 76.34 10.15 18.49 29.08 91.56 51.74 -63.05 -41.13 0.38 0.00 99.62 0.06 0.02 0.20 99.67 0.04 0.00 0.00 0.00 42 A H H 59.03 1.96 20.99 21.29 91.53 50.43 -63.64 -41.97 0.66 0.00 99.34 0.11 0.04 0.36 99.41 0.08 0.00 0.00 0.00 43 E H H 85.46 4.25 19.50 24.24 91.87 49.33 -65.11 -41.03 0.90 0.00 99.10 0.15 0.06 0.51 99.15 0.13 0.00 0.00 0.00 44 A H H 22.77 11.48 14.56 27.68 91.76 51.36 -64.01 -41.00 1.52 0.00 98.47 0.29 0.14 0.87 98.41 0.28 0.00 0.00 0.00 45 A H H 56.23 3.37 17.94 21.68 91.75 51.84 -64.36 -39.84 4.08 0.01 95.91 0.72 0.36 2.60 95.63 0.67 0.00 0.00 0.00 46 H H H 114.66 1.92 17.50 18.67 92.38 50.53 -67.71 -37.31 10.75 0.03 89.22 2.30 1.18 6.78 88.47 1.24 0.01 0.01 0.02 47 Q H H 75.32 6.72 13.46 21.78 93.86 54.10 -68.57 -35.93 16.23 0.10 83.67 6.99 2.50 6.81 81.63 1.98 0.00 0.04 0.05 48 R H H 126.82 4.58 13.53 19.47 94.43 56.61 -66.52 -37.23 20.34 0.15 79.52 10.19 2.86 7.59 76.26 2.95 0.00 0.06 0.07 49 A H H 70.58 2.28 13.27 15.99 94.61 53.98 -68.85 -34.39 27.19 0.17 72.64 14.00 3.72 9.61 69.11 3.39 0.00 0.07 0.08 50 E H H 120.22 2.79 12.22 16.00 97.03 54.33 -76.83 -21.54 39.36 0.24 60.40 21.31 6.18 11.74 57.32 3.21 0.00 0.09 0.13 51 Q C H 106.99 5.06 10.34 16.89 100.87 66.80 -79.16 -6.65 54.16 0.30 45.54 33.13 7.77 12.64 42.77 3.38 0.00 0.11 0.19 52 Q C C 123.77 3.10 10.71 15.28 101.23 86.38 -78.70 -9.86 61.91 0.36 37.73 39.32 9.02 13.62 31.17 6.46 0.00 0.14 0.26 53 D C C 107.38 2.44 11.16 14.90 103.26 66.08 -85.06 29.09 71.31 0.38 28.31 40.91 13.30 17.19 20.09 8.05 0.00 0.15 0.31 54 H C C 134.67 3.52 11.11 16.26 105.56 74.39 -88.34 47.53 80.79 0.44 18.77 55.55 12.41 12.78 12.37 6.35 0.00 0.19 0.35 55 K C C 110.57 6.20 11.79 19.70 117.30 132.99 -90.53 140.33 92.05 0.58 7.37 74.71 13.67 3.51 5.88 1.51 0.00 0.19 0.54 56 T C C 52.22 7.48 13.50 22.59 121.09 -130.01 -85.68 162.66 93.95 0.74 5.31 85.84 6.33 1.29 5.23 0.49 0.00 0.20 0.63 57 S H H 57.74 6.41 15.71 23.61 92.28 -109.04 -60.38 -36.95 6.33 0.02 93.64 1.79 1.33 2.94 93.36 0.56 0.00 0.00 0.01 58 F H H 69.46 11.86 14.71 27.23 92.23 53.25 -65.46 -40.40 2.35 0.01 97.64 0.39 0.26 1.47 97.39 0.48 0.00 0.00 0.00 59 Q H H 74.08 6.18 16.33 23.94 91.66 50.93 -64.23 -41.41 0.89 0.01 99.10 0.22 0.10 0.47 98.78 0.41 0.00 0.00 0.00 60 Q H H 92.00 2.60 18.23 20.59 91.78 50.10 -64.39 -42.20 0.50 0.00 99.50 0.10 0.05 0.27 99.37 0.21 0.00 0.00 0.00 61 Y H H 70.06 7.00 15.30 24.20 91.99 48.85 -64.54 -42.18 0.40 0.00 99.60 0.05 0.03 0.26 99.49 0.17 0.00 0.00 0.00 62 C H H 30.40 11.20 11.64 24.30 91.80 50.15 -65.62 -38.23 0.67 0.00 99.33 0.05 0.03 0.52 99.07 0.32 0.00 0.00 0.00 63 D H H 107.45 1.73 15.39 17.25 92.40 50.77 -67.11 -36.66 2.92 0.00 97.08 0.06 0.10 2.82 96.63 0.38 0.00 0.00 0.00 64 D H H 113.00 1.19 14.81 15.08 94.62 39.12 -80.17 -26.80 7.09 0.00 92.91 0.11 0.54 6.60 92.49 0.25 0.01 0.00 0.00 65 N C C 67.15 5.91 10.52 18.53 113.90 23.80 -135.18 76.37 99.84 0.10 0.06 74.87 24.70 0.23 0.04 0.01 0.00 0.02 0.11 66 P C T 88.42 5.56 10.05 18.04 92.50 173.29 -63.44 -23.87 96.97 0.07 2.96 1.81 2.56 92.88 0.37 2.30 0.00 0.03 0.04 67 D C T 119.60 1.08 14.52 15.09 93.89 57.97 -88.84 -0.74 95.63 0.04 4.32 1.84 2.74 91.56 0.91 2.91 0.00 0.02 0.03 68 A C C 32.30 9.78 8.45 19.88 111.30 115.08 -69.23 139.17 57.52 0.32 42.16 30.63 20.14 7.54 21.54 19.70 0.00 0.10 0.36 69 A H G 79.75 2.44 14.67 17.68 92.85 -123.64 -61.39 -31.46 20.21 0.07 79.72 2.19 1.91 14.22 32.24 49.37 0.00 0.04 0.03 70 E H G 116.74 3.34 15.26 19.44 92.86 58.72 -71.88 -23.98 16.53 0.08 83.39 1.64 1.42 11.76 36.14 48.96 0.00 0.05 0.03 71 C H G 30.69 12.93 9.97 23.62 95.45 61.18 -77.64 -15.39 18.37 0.35 81.28 6.43 2.92 7.97 37.97 44.40 0.01 0.20 0.11 72 R H H 118.86 6.82 13.21 21.34 101.43 83.17 -76.02 2.72 45.81 2.65 51.54 23.49 8.79 14.00 29.82 21.24 0.07 1.31 1.29 73 I C C 110.08 4.06 13.15 18.43 100.17 104.62 -84.68 -15.00 55.19 5.06 39.75 25.76 12.47 18.24 23.39 15.16 0.18 2.59 2.22 74 Y C C 144.93 4.66 9.99 16.22 106.35 59.30 -94.05 17.42 66.35 4.39 29.27 33.73 14.57 18.89 17.45 11.03 0.05 2.23 2.04 75 D C C 96.38 4.46 8.50 14.76 110.86 99.33 -89.75 112.98 88.93 1.32 9.75 76.80 2.00 10.87 6.74 2.19 0.00 0.71 0.69 76 D C C 112.54 2.66 11.28 15.57 106.74 -154.27 -88.59 86.44 99.96 0.03 0.01 99.87 0.07 0.04 0.00 0.00 0.00 0.01 0.00