# 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 38.01 6.20 14.45 21.72 116.61 -130.49 58.52 -167.60 99.74 0.06 0.20 99.54 0.13 0.14 0.14 0.01 0.00 0.02 0.01 1 A C C 71.89 4.30 11.49 17.04 99.67 -12.89 -75.48 -21.30 59.03 0.91 40.07 50.16 1.56 7.06 38.09 2.28 0.00 0.40 0.47 2 D H H 103.58 2.20 11.47 14.65 97.38 62.43 -72.42 -28.36 43.08 1.05 55.88 26.73 6.69 10.56 51.81 3.25 0.01 0.47 0.49 3 G H H 38.79 3.54 12.31 17.15 95.80 55.79 -65.18 -38.64 28.77 0.94 70.29 15.97 6.15 8.83 63.51 4.65 0.04 0.49 0.36 4 V H H 78.91 4.62 12.26 18.26 93.97 52.82 -67.44 -39.03 16.97 0.96 82.07 9.59 3.39 5.73 75.79 4.54 0.04 0.62 0.29 5 L H H 89.98 3.84 13.34 18.43 93.53 51.86 -66.96 -39.27 14.62 1.04 84.34 8.39 2.70 5.11 78.07 4.68 0.04 0.72 0.29 6 R H H 142.26 1.89 15.36 17.11 93.40 51.76 -66.68 -39.41 16.03 0.74 83.23 8.74 2.73 5.78 78.68 3.36 0.02 0.45 0.24 7 R H H 120.65 3.89 15.34 19.95 93.48 50.94 -67.09 -39.20 16.86 0.46 82.68 8.26 2.68 6.73 79.59 2.30 0.02 0.24 0.18 8 H H H 79.54 8.04 14.30 23.50 93.43 51.45 -66.31 -40.17 8.80 0.14 91.07 4.62 1.43 3.05 89.69 1.10 0.00 0.06 0.05 9 N H H 89.64 3.12 17.44 20.86 92.89 52.13 -65.32 -39.80 3.82 0.05 96.13 1.51 0.54 1.80 95.41 0.71 0.00 0.03 0.01 10 E H H 109.12 2.42 18.31 20.34 92.40 50.32 -66.00 -40.77 2.74 0.04 97.22 0.93 0.34 1.46 96.66 0.59 0.00 0.02 0.01 11 V H H 53.40 8.00 16.36 25.68 92.42 48.97 -65.29 -42.35 1.41 0.02 98.57 0.48 0.17 0.68 98.42 0.24 0.00 0.01 0.00 12 R H H 100.08 7.77 17.61 26.23 92.09 50.62 -63.63 -41.49 0.64 0.00 99.35 0.16 0.06 0.34 99.33 0.11 0.00 0.00 0.00 13 G H H 34.08 2.75 19.48 21.99 91.62 50.39 -63.63 -42.07 0.57 0.00 99.43 0.10 0.04 0.33 99.44 0.08 0.00 0.00 0.00 14 A H H 48.44 4.14 18.82 23.54 91.74 50.26 -64.17 -41.65 0.36 0.00 99.64 0.05 0.02 0.21 99.67 0.05 0.00 0.00 0.00 15 L H H 52.62 10.52 16.62 28.11 91.93 50.11 -64.41 -41.51 0.27 0.00 99.73 0.04 0.01 0.15 99.77 0.03 0.00 0.00 0.00 16 R H H 118.09 5.51 18.60 24.82 91.64 50.70 -63.17 -41.41 0.21 0.00 99.79 0.03 0.01 0.12 99.82 0.02 0.00 0.00 0.00 17 F H H 121.02 1.85 19.97 20.46 91.80 49.47 -64.50 -42.17 0.16 0.00 99.84 0.02 0.00 0.10 99.86 0.02 0.00 0.00 0.00 18 F H H 90.83 6.07 18.34 25.17 91.99 49.12 -64.57 -42.21 0.16 0.00 99.84 0.01 0.01 0.11 99.84 0.02 0.00 0.00 0.00 19 L H H 48.29 10.61 15.89 27.67 91.97 49.10 -64.57 -41.13 0.23 0.00 99.77 0.02 0.01 0.16 99.78 0.04 0.00 0.00 0.00 20 D H H 77.85 3.18 18.97 22.20 91.80 50.96 -63.97 -40.69 0.57 0.00 99.43 0.05 0.03 0.41 99.41 0.09 0.00 0.00 0.00 21 S H H 52.85 2.77 18.17 20.90 91.81 50.58 -64.84 -40.76 1.66 0.00 98.34 0.13 0.09 1.36 98.06 0.37 0.00 0.00 0.00 22 W H H 83.76 8.83 14.81 25.07 92.27 50.31 -65.47 -40.97 2.33 0.01 97.66 0.25 0.17 1.80 96.93 0.84 0.00 0.00 0.00 23 Y H H 98.79 7.23 14.35 22.87 92.66 50.90 -66.44 -38.23 5.76 0.08 94.16 1.18 0.66 3.94 92.73 1.39 0.02 0.04 0.03 24 K H H 140.88 1.43 16.16 16.88 93.22 53.74 -67.81 -32.68 14.80 0.18 85.02 2.27 1.69 11.09 83.04 1.69 0.06 0.08 0.09 25 N H H 91.13 3.63 12.63 17.47 98.53 50.02 -86.31 -7.19 35.00 0.69 64.31 9.96 5.70 20.65 60.73 2.21 0.08 0.27 0.39 26 K H H 109.53 7.65 9.27 18.03 102.04 97.33 -75.00 -4.50 48.68 1.95 49.37 23.26 7.49 19.33 43.22 4.76 0.06 0.95 0.91 27 T C H 107.36 1.64 11.29 13.66 100.48 74.79 -80.21 -17.43 54.41 2.14 43.45 18.55 10.37 26.60 36.47 5.82 0.11 1.06 1.01 28 S C T 86.10 1.64 10.75 13.06 101.20 49.59 -88.96 -0.77 70.62 0.80 28.58 14.93 17.12 38.77 22.36 5.92 0.03 0.33 0.53 29 G C T 54.36 2.94 11.09 15.54 103.50 -105.92 79.57 5.46 82.90 0.90 16.21 23.82 23.58 36.05 10.32 5.30 0.01 0.37 0.55 30 T C C 91.64 3.12 11.90 16.42 104.13 118.61 -84.40 -12.87 71.32 3.64 25.04 39.22 20.05 12.52 18.21 6.57 0.03 1.70 1.69 31 I C C 79.96 8.79 9.74 19.67 113.31 63.94 -94.63 122.84 61.60 5.27 33.13 38.24 15.68 8.71 26.16 6.38 0.06 2.55 2.23 32 A C C 62.52 5.41 13.41 20.22 107.23 -137.94 -76.69 140.01 67.20 2.62 30.18 46.49 12.19 8.17 25.65 5.17 0.01 1.41 0.93 33 D C C 83.19 4.39 15.10 20.23 111.45 -64.39 -86.53 132.16 69.02 1.67 29.31 53.83 8.30 5.93 27.22 3.23 0.00 0.75 0.73 34 K H H 110.16 8.53 13.29 22.78 94.26 -127.59 -63.63 -35.21 5.48 0.04 94.48 2.31 0.96 2.26 93.11 1.33 0.00 0.02 0.02 35 N H H 90.10 4.97 16.20 22.16 92.74 53.38 -65.28 -38.99 2.96 0.03 97.02 0.84 0.38 1.66 95.87 1.22 0.00 0.01 0.01 36 Q H H 87.82 4.36 17.77 22.78 92.43 50.93 -66.02 -40.37 1.68 0.04 98.28 0.59 0.22 0.88 97.17 1.11 0.00 0.03 0.01 37 V H H 41.53 9.13 16.18 26.95 91.98 50.82 -64.22 -42.77 1.00 0.03 98.96 0.37 0.12 0.49 98.59 0.40 0.00 0.02 0.01 38 M H H 63.76 9.75 17.69 28.34 92.16 50.41 -64.15 -41.90 0.91 0.02 99.07 0.25 0.09 0.51 98.84 0.30 0.00 0.01 0.00 39 F H H 88.07 5.98 18.51 25.42 91.97 50.09 -64.39 -41.68 1.04 0.01 98.95 0.22 0.08 0.65 98.71 0.33 0.00 0.01 0.00 40 D H H 63.06 4.93 19.19 24.91 91.91 50.41 -64.89 -41.38 1.89 0.01 98.10 0.36 0.16 1.26 97.76 0.45 0.01 0.01 0.01 41 Y H H 72.55 8.68 16.73 26.77 92.11 49.90 -64.57 -42.12 2.49 0.02 97.49 0.35 0.22 1.86 96.63 0.91 0.01 0.01 0.01 42 L H H 51.41 9.02 14.60 25.24 92.38 50.90 -65.08 -39.96 3.98 0.04 95.99 0.61 0.41 2.91 94.26 1.76 0.02 0.02 0.01 43 K H H 126.38 3.30 16.13 20.35 92.37 50.86 -66.07 -38.38 9.56 0.06 90.38 0.98 0.78 7.75 87.75 2.64 0.04 0.03 0.03 44 Y H H 137.28 4.36 14.78 20.15 94.48 48.81 -73.32 -30.96 19.32 0.13 80.56 1.69 1.94 15.72 77.78 2.64 0.09 0.05 0.08 45 K C T 112.98 5.75 13.83 20.75 97.54 48.69 -88.62 -3.58 61.79 0.40 37.81 3.74 6.07 49.64 37.64 2.43 0.05 0.15 0.27 46 G C T 47.32 3.84 16.06 20.76 98.94 -109.98 79.00 15.64 91.92 0.40 7.68 23.78 6.86 60.94 6.86 1.18 0.00 0.18 0.20 47 V C C 50.44 13.18 10.01 23.53 108.35 138.87 -88.62 99.18 82.03 1.34 16.63 73.68 4.27 3.09 16.22 1.46 0.00 0.50 0.77 48 T C C 68.13 5.37 15.31 21.83 117.13 116.92 -88.98 159.92 54.09 0.76 45.15 46.69 3.98 2.88 44.35 1.51 0.00 0.33 0.24 49 E H H 119.95 3.19 16.46 20.23 93.72 -94.05 -62.32 -37.65 13.20 0.97 85.83 7.11 2.52 4.74 80.95 3.73 0.03 0.69 0.22 50 I H H 71.76 6.77 15.05 23.00 92.74 51.29 -66.18 -40.61 7.76 1.09 91.16 4.05 1.19 3.05 86.23 4.31 0.02 0.99 0.15 51 A H H 26.60 11.22 12.30 24.98 92.29 51.61 -64.89 -39.79 5.03 0.49 94.49 2.42 0.75 2.10 89.02 5.20 0.01 0.44 0.07 52 Q H H 101.51 4.14 15.57 20.78 92.42 53.34 -65.25 -36.12 8.29 0.56 91.16 2.87 1.20 4.47 84.40 6.44 0.04 0.46 0.12 53 H H H 122.97 3.13 15.39 19.00 93.39 52.41 -71.48 -29.21 15.73 0.47 83.80 3.86 1.99 10.11 77.20 6.30 0.07 0.31 0.17 54 L H H 80.49 8.67 12.56 22.13 96.18 54.88 -78.32 -20.42 33.15 0.82 66.04 8.58 5.02 20.32 60.52 4.65 0.10 0.42 0.39 55 H C H 113.93 6.58 12.95 20.68 103.07 58.96 -92.60 11.77 58.78 1.88 39.34 20.55 11.06 28.41 34.63 3.51 0.07 0.79 0.97 56 A C C 63.00 4.78 11.15 17.75 118.68 128.36 -84.11 145.34 95.09 1.51 3.40 47.62 44.23 3.35 2.64 0.79 0.00 0.61 0.75 57 P C C 100.46 2.74 12.27 16.36 113.96 -96.59 -67.30 147.57 93.42 1.91 4.67 74.83 13.62 4.86 3.21 1.43 0.00 0.83 1.21 58 A C C 67.42 6.10 8.70 16.58 115.25 -107.46 -74.80 145.73 87.84 1.38 10.79 71.33 13.25 3.40 7.85 2.78 0.00 0.60 0.79 59 P C C 92.13 3.50 10.01 15.25 111.21 -100.92 -68.70 146.91 74.84 1.53 23.63 58.45 7.25 9.09 14.02 9.67 0.00 0.89 0.64 60 Q C C 132.81 2.28 8.93 12.95 112.40 -119.88 -83.88 127.85 62.42 4.77 32.80 41.50 10.36 10.57 17.87 15.13 0.02 3.05 1.50 61 V C C 106.70 3.07 7.42 12.27 110.73 -152.33 -92.88 117.51 55.67 8.62 35.70 34.41 11.07 11.07 18.82 16.46 0.05 6.17 1.95 62 F C C 154.12 2.43 6.75 10.82 110.04 -151.54 -90.80 110.07 58.92 11.27 29.81 38.05 9.67 11.66 15.82 13.65 0.06 8.53 2.57 63 R C C 176.78 1.55 7.24 10.33 112.14 -151.32 -93.34 122.23 76.89 6.64 16.47 66.46 2.18 8.93 10.64 4.67 0.00 5.31 1.80 64 K C C 154.69 2.18 9.71 13.55 110.97 -131.78 -86.13 124.11 99.88 0.08 0.05 99.72 0.11 0.09 0.03 0.00 0.00 0.04 0.01