# 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 135.38 2.83 11.06 15.36 112.96 -144.91 -95.55 125.90 99.93 0.05 0.02 99.74 0.18 0.05 0.01 0.00 0.00 0.02 0.01 1 A C C 67.16 4.34 8.42 14.62 117.87 -120.19 -83.78 150.57 97.49 0.26 2.25 95.33 1.45 1.32 1.00 0.62 0.00 0.09 0.20 2 P C C 99.42 2.36 10.14 13.95 111.85 -96.58 -68.40 148.92 85.93 0.72 13.35 72.49 6.05 7.21 3.42 10.04 0.00 0.38 0.41 3 Q C C 127.96 3.23 8.90 13.91 107.15 -108.47 -78.29 132.66 74.77 1.94 23.29 53.57 9.25 10.64 4.02 20.57 0.00 0.99 0.98 4 L C C 106.96 4.96 8.47 15.04 108.50 -121.06 -84.08 116.84 74.92 2.46 22.63 44.36 12.80 17.07 3.92 19.29 0.00 1.23 1.32 5 K C C 159.74 1.54 11.15 13.46 101.01 -175.58 -91.14 5.96 79.42 2.37 18.20 39.24 22.16 18.24 3.91 13.80 0.01 0.98 1.67 6 D C C 59.44 6.44 8.29 16.80 111.42 117.66 -97.13 113.53 98.38 0.46 1.16 65.51 32.12 0.67 0.98 0.20 0.00 0.11 0.42 7 P H H 94.07 2.08 12.26 15.34 92.55 -151.73 -61.39 -33.47 19.41 0.06 80.53 2.25 2.28 14.73 77.42 3.22 0.03 0.03 0.04 8 W H H 141.94 2.90 12.86 16.71 92.54 54.09 -65.73 -39.04 12.30 0.05 87.66 1.24 1.07 9.93 83.94 3.73 0.03 0.02 0.03 9 A H H 33.43 7.34 11.09 20.62 92.01 50.98 -64.36 -40.48 2.98 0.02 96.99 0.73 0.36 1.77 93.07 4.04 0.00 0.01 0.01 10 R H H 131.88 3.36 14.02 18.43 91.84 51.55 -64.71 -40.08 1.73 0.01 98.26 0.33 0.17 1.07 94.44 3.99 0.00 0.00 0.00 11 R H H 142.84 1.92 15.56 17.25 92.70 50.06 -67.09 -37.26 5.00 0.02 94.98 0.38 0.32 4.09 89.83 5.34 0.01 0.01 0.01 12 E H H 81.01 5.48 13.75 20.77 94.60 49.39 -76.53 -22.86 14.35 0.03 85.62 0.96 0.86 12.31 78.79 7.02 0.03 0.01 0.02 13 A H H 40.25 7.27 11.43 20.90 92.04 78.18 -61.29 -39.44 12.82 0.09 87.10 1.45 0.98 8.90 44.59 43.97 0.02 0.05 0.04 14 W H G 148.47 3.64 13.39 18.15 92.04 54.23 -69.15 -26.54 19.46 0.10 80.44 1.43 1.30 15.18 29.33 52.62 0.02 0.05 0.06 15 R H G 144.57 3.07 12.95 17.18 93.95 57.39 -75.35 -21.24 28.25 0.37 71.38 4.16 3.39 18.82 20.87 52.32 0.04 0.19 0.22 16 Y C C 137.87 4.54 10.86 16.89 100.19 54.27 -95.00 -4.18 63.22 3.20 33.58 30.08 17.48 17.12 14.49 17.16 0.07 1.21 2.39 17 Q C C 113.62 4.11 9.63 15.49 113.65 81.40 -97.92 123.75 90.82 2.74 6.45 50.35 33.52 6.80 3.83 2.44 0.00 0.96 2.11 18 T C C 98.49 2.56 10.15 14.30 111.07 -105.97 -79.88 136.19 94.66 0.85 4.49 38.48 34.25 22.27 1.33 2.82 0.00 0.38 0.46 19 N C C 126.59 1.56 10.80 13.19 105.19 -105.15 -82.96 67.69 93.59 1.29 5.12 51.62 22.54 19.75 1.71 3.06 0.00 0.59 0.73 20 F C C 102.53 7.81 7.35 16.30 114.90 99.57 -96.25 128.24 92.76 2.55 4.69 73.87 15.03 3.49 3.01 1.62 0.00 0.98 2.01 21 T C C 73.24 2.75 12.18 15.93 119.51 -155.24 -91.93 158.30 94.58 1.17 4.25 87.47 5.34 1.69 3.65 0.68 0.00 0.43 0.75 22 R H H 154.52 2.98 10.88 15.47 93.19 -111.74 -62.02 -36.92 11.66 0.11 88.23 3.43 2.57 6.40 83.02 4.44 0.04 0.05 0.06 23 A H H 71.09 2.08 12.23 14.99 92.57 54.30 -65.06 -39.30 7.16 0.04 92.80 1.18 0.86 4.86 86.95 6.08 0.02 0.02 0.02 24 N H H 82.82 3.32 11.93 16.54 92.86 49.91 -67.18 -38.29 4.54 0.04 95.42 0.97 0.54 2.84 87.45 8.14 0.01 0.03 0.01 25 R H H 131.03 3.32 11.90 16.55 92.98 51.68 -66.77 -38.04 6.33 0.06 93.61 1.26 0.79 4.10 86.91 6.86 0.02 0.04 0.02 26 F H H 121.57 2.82 11.85 15.79 93.85 49.08 -72.01 -31.20 15.46 0.24 84.30 2.93 2.15 10.72 76.48 7.34 0.12 0.13 0.12 27 K H H 128.08 3.27 11.50 16.22 94.53 60.76 -67.54 -31.45 27.01 0.28 72.70 3.15 2.77 20.48 61.60 11.50 0.16 0.14 0.18 28 G H H 53.43 2.25 12.21 15.15 95.95 48.62 -75.38 -22.54 47.35 0.20 52.45 4.13 4.13 38.13 42.96 10.31 0.06 0.09 0.18 29 A C T 76.06 2.65 11.51 15.23 99.12 56.79 -81.04 -25.67 60.10 0.64 39.26 13.19 13.05 34.64 27.88 10.31 0.09 0.26 0.58 30 A C C 63.81 4.33 11.00 16.93 114.88 45.25 -95.69 130.21 90.08 1.03 8.88 43.26 41.29 5.70 6.30 2.16 0.00 0.28 1.02 31 P C T 94.41 3.10 12.88 17.32 110.55 -101.91 -66.25 140.64 88.91 0.44 10.65 12.69 10.83 65.48 6.81 3.64 0.00 0.20 0.34 32 G C T 41.66 5.52 13.57 20.27 100.03 19.28 83.63 -1.62 82.15 0.34 17.51 17.21 7.05 57.81 13.73 3.80 0.00 0.14 0.25 33 F H H 108.32 6.29 12.35 20.07 94.65 120.84 -66.48 -36.73 8.53 0.05 91.42 3.75 1.66 3.47 89.99 1.08 0.00 0.01 0.03 34 G H H 42.68 2.76 15.58 18.73 92.87 53.60 -63.51 -42.02 3.45 0.02 96.53 0.82 0.40 2.03 96.10 0.63 0.00 0.01 0.01 35 I H H 96.43 2.63 16.73 19.39 92.51 49.21 -66.09 -40.97 0.86 0.00 99.14 0.21 0.08 0.47 98.91 0.33 0.00 0.00 0.00 36 A H H 38.41 7.67 14.15 23.51 92.03 51.58 -64.42 -41.63 0.23 0.00 99.77 0.05 0.02 0.11 99.74 0.08 0.00 0.00 0.00 37 V H H 73.35 5.07 16.73 22.64 92.06 50.11 -64.54 -42.10 0.08 0.00 99.92 0.01 0.00 0.04 99.92 0.02 0.00 0.00 0.00 38 V H H 87.19 2.11 18.68 19.96 91.91 49.75 -64.81 -42.10 0.04 0.00 99.96 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 39 A H H 52.50 3.86 17.50 22.02 91.87 50.00 -64.51 -41.91 0.03 0.00 99.97 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 40 F H H 90.74 6.78 16.90 24.39 92.06 49.32 -64.81 -41.57 0.05 0.00 99.95 0.00 0.00 0.04 99.96 0.01 0.00 0.00 0.00 41 G H H 35.50 3.52 17.41 21.38 91.63 50.87 -63.47 -41.80 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 42 A H H 61.31 2.11 18.34 19.69 91.73 50.45 -64.21 -41.76 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 43 Y H H 110.88 4.38 17.26 22.33 92.00 49.25 -65.00 -41.78 0.09 0.00 99.91 0.01 0.00 0.06 99.92 0.01 0.00 0.00 0.00 44 L H H 73.93 5.37 16.15 22.49 91.79 49.84 -64.18 -41.89 0.13 0.00 99.87 0.01 0.00 0.08 99.88 0.02 0.00 0.00 0.00 45 A H H 58.63 2.14 17.02 18.82 91.67 50.35 -63.70 -41.66 0.22 0.00 99.78 0.02 0.01 0.14 99.79 0.04 0.00 0.00 0.00 46 A H H 58.29 2.14 16.23 18.16 91.66 49.99 -64.27 -41.75 0.35 0.00 99.65 0.04 0.02 0.23 99.61 0.10 0.00 0.00 0.00 47 E H H 87.12 4.50 14.31 20.07 92.01 50.22 -65.25 -40.62 0.78 0.00 99.21 0.08 0.04 0.57 99.04 0.26 0.00 0.00 0.00 48 K H H 114.43 2.83 14.25 17.83 91.95 50.78 -65.31 -40.15 2.28 0.00 97.71 0.18 0.12 1.85 97.23 0.62 0.00 0.00 0.00 49 F H H 129.64 1.45 14.17 15.11 92.41 49.69 -66.62 -39.87 6.44 0.02 93.54 0.63 0.49 5.14 92.58 1.13 0.01 0.01 0.01 50 L H H 100.80 2.02 12.99 15.37 93.17 48.93 -69.12 -36.33 16.70 0.14 83.15 2.99 2.18 11.78 80.79 2.08 0.04 0.06 0.08 51 F H H 115.21 3.32 11.04 15.80 94.88 51.06 -72.62 -31.47 32.85 0.60 66.55 12.08 6.19 16.19 61.27 3.63 0.06 0.27 0.31 52 E H H 116.33 2.76 11.09 15.06 95.52 58.01 -71.57 -27.71 44.13 0.92 54.95 24.07 7.35 13.80 49.32 4.57 0.02 0.43 0.42 53 K C H 136.55 2.27 10.73 14.00 99.06 62.19 -76.70 -16.49 54.53 0.91 44.56 32.63 8.13 14.18 39.01 5.17 0.01 0.41 0.46 54 K C C 129.86 3.14 9.72 14.35 103.76 67.86 -82.86 -1.36 61.02 0.91 38.07 38.56 9.93 12.63 32.16 5.83 0.01 0.39 0.50 55 D C C 99.36 3.05 9.15 13.75 103.73 77.34 -82.93 9.52 65.26 0.92 33.82 39.86 9.98 15.28 25.21 8.69 0.01 0.42 0.55 56 D C C 107.42 2.30 8.94 12.66 101.70 70.21 -83.33 3.32 67.54 0.98 31.49 36.86 12.18 18.74 18.36 12.80 0.01 0.44 0.61 57 H C C 137.19 2.52 8.07 12.15 103.04 76.17 -85.67 10.05 71.49 1.25 27.26 37.81 13.91 20.26 12.97 13.71 0.01 0.58 0.76 58 H C C 139.91 2.43 7.75 11.83 106.29 85.76 -90.90 60.98 82.69 0.88 16.42 63.16 3.98 16.95 7.94 6.97 0.00 0.48 0.52 59 H C C 137.87 3.03 9.79 14.52 107.92 92.40 -91.04 81.24 99.50 0.10 0.40 98.47 0.45 0.68 0.20 0.11 0.00 0.04 0.04