# 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 47.94 3.76 10.80 16.13 120.14 -175.19 -102.92 166.48 99.87 0.05 0.09 99.74 0.10 0.08 0.05 0.01 0.00 0.02 0.01 1 S C C 86.67 1.94 8.71 12.03 112.15 -120.28 -95.12 137.80 59.85 0.55 39.61 52.63 1.61 5.86 37.00 2.39 0.00 0.25 0.25 2 M H H 143.17 1.57 7.21 10.12 108.41 35.23 -85.36 88.50 44.04 0.78 55.18 28.91 7.87 8.36 48.35 5.79 0.01 0.37 0.34 3 A H H 86.44 1.67 7.51 10.59 108.74 58.29 -79.42 116.43 36.02 0.80 63.17 25.05 5.77 6.32 54.54 7.59 0.01 0.43 0.29 4 Q H H 138.12 1.62 7.94 10.90 108.29 -136.39 -87.43 99.14 33.70 0.89 65.41 23.48 5.73 5.94 56.75 7.31 0.01 0.47 0.31 5 E H H 139.76 2.08 8.23 11.97 109.84 61.87 -89.96 119.53 37.68 1.03 61.29 27.25 5.78 5.89 55.24 4.94 0.01 0.53 0.36 6 Q H H 131.02 2.41 8.13 12.34 112.92 -139.81 -94.86 125.71 45.70 1.36 52.94 33.60 6.57 6.18 48.74 3.75 0.01 0.67 0.49 7 T C H 100.82 2.47 8.62 12.90 115.17 -159.48 -99.64 129.94 53.29 2.17 44.54 39.77 7.04 6.33 41.95 3.03 0.01 1.12 0.75 8 K C C 148.21 2.18 8.81 12.74 115.36 -149.61 -98.61 129.34 64.60 2.91 32.50 48.34 8.00 7.15 31.08 2.73 0.01 1.48 1.22 9 R C C 172.30 2.16 8.51 12.42 111.03 -143.29 -87.23 125.44 73.44 2.47 24.09 51.83 8.79 11.75 22.51 2.66 0.00 1.27 1.19 10 G C C 57.78 1.94 9.75 12.90 106.96 14.95 74.65 34.76 83.61 1.56 14.83 49.03 15.44 19.24 12.04 2.66 0.00 0.73 0.86 11 G C C 55.39 2.39 9.58 13.49 110.09 24.78 -88.94 126.63 90.73 1.30 7.97 48.32 25.52 16.67 5.63 2.52 0.00 0.55 0.80 12 G C C 55.89 2.29 10.02 13.65 110.56 31.17 77.54 140.46 91.55 1.08 7.36 46.39 27.60 17.42 4.41 3.04 0.00 0.46 0.67 13 G C C 54.49 2.60 10.29 14.29 108.69 -54.05 -84.15 70.86 87.02 1.01 11.97 42.80 24.14 20.15 7.09 4.72 0.00 0.41 0.68 14 G C C 49.28 3.42 10.33 15.17 113.07 32.98 -90.42 146.50 76.06 1.10 22.84 40.74 20.69 15.09 16.34 5.94 0.00 0.42 0.77 15 D C H 103.11 2.76 10.74 14.72 106.67 -72.94 -85.06 88.72 55.50 0.90 43.60 35.76 11.90 8.70 37.27 5.53 0.01 0.37 0.47 16 D H H 100.53 3.42 10.30 15.14 99.64 82.05 -74.84 -22.65 28.35 0.54 71.11 18.82 5.32 5.96 64.40 5.02 0.01 0.27 0.20 17 D H H 103.29 2.34 11.30 14.70 96.00 62.75 -72.97 -28.27 18.25 0.44 81.32 11.70 3.17 4.84 75.34 4.55 0.01 0.26 0.13 18 D H H 96.77 2.55 11.63 15.20 96.86 57.48 -73.33 -29.06 14.87 0.49 84.64 9.60 2.58 4.08 79.09 4.19 0.01 0.31 0.13 19 I H H 99.62 3.70 10.93 16.01 96.76 56.96 -72.51 -33.51 15.11 0.58 84.31 9.76 2.74 4.04 79.78 3.17 0.01 0.34 0.16 20 A H H 72.15 2.73 11.81 15.61 97.68 58.43 -68.65 -32.42 18.83 0.49 80.68 11.02 3.15 5.57 77.42 2.40 0.01 0.26 0.16 21 G H H 49.17 2.30 12.71 15.72 97.31 47.28 -63.33 -29.92 28.39 0.44 71.17 14.80 4.94 9.24 67.98 2.65 0.01 0.20 0.18 22 S H H 73.83 2.80 11.73 15.62 99.11 55.87 -76.67 -24.48 30.89 0.52 68.59 17.42 5.87 8.44 64.83 2.99 0.01 0.23 0.21 23 T H H 89.20 2.79 11.94 15.76 99.85 56.81 -77.74 -28.73 34.17 0.67 65.17 21.65 6.14 7.17 61.67 2.81 0.01 0.30 0.26 24 A H H 65.22 3.06 11.89 15.99 101.29 55.63 -73.15 -35.55 35.85 0.63 63.51 24.50 5.21 6.57 60.70 2.50 0.00 0.28 0.24 25 A H H 67.28 2.67 12.08 15.64 99.56 52.16 -69.26 -37.90 30.28 0.39 69.33 18.42 4.78 7.06 67.35 2.07 0.00 0.17 0.15 26 G H H 40.48 2.73 12.69 16.17 96.06 44.22 -57.20 -43.38 22.00 0.25 77.76 12.06 4.21 6.36 75.07 2.08 0.01 0.10 0.10 27 Q H H 115.04 1.65 13.00 14.56 93.89 47.90 -67.15 -38.86 11.68 0.18 88.14 6.49 2.17 3.68 85.73 1.77 0.01 0.09 0.07 28 E H H 113.34 1.63 13.33 14.87 92.85 51.69 -65.94 -39.41 8.95 0.18 90.87 5.49 1.34 2.66 88.92 1.43 0.00 0.10 0.05 29 R H H 134.98 1.93 13.06 15.39 92.44 51.32 -65.50 -40.38 4.90 0.07 95.03 2.83 0.70 1.52 94.07 0.82 0.00 0.03 0.02 30 R H H 139.13 1.78 13.66 15.56 92.20 51.02 -65.01 -40.63 3.45 0.04 96.51 1.72 0.46 1.30 95.81 0.67 0.00 0.02 0.01 31 E H H 112.94 1.52 14.49 15.55 92.11 50.41 -64.63 -40.71 3.39 0.04 96.57 1.57 0.43 1.36 95.95 0.65 0.00 0.02 0.01 32 K H H 120.50 1.60 14.50 15.77 92.30 49.96 -65.23 -40.95 4.10 0.05 95.85 1.82 0.52 1.71 95.24 0.65 0.00 0.02 0.02 33 L H H 91.33 2.07 13.86 16.16 92.33 49.97 -65.46 -41.23 5.23 0.06 94.71 2.57 0.68 1.95 94.09 0.65 0.00 0.02 0.02 34 T H H 77.20 1.95 14.41 16.28 92.49 50.56 -65.24 -41.04 5.90 0.05 94.05 2.98 0.76 2.06 93.62 0.53 0.00 0.02 0.02 35 E H H 114.38 1.52 14.83 15.77 92.49 50.17 -65.44 -40.93 5.21 0.03 94.76 2.24 0.68 2.06 94.51 0.48 0.00 0.01 0.01 36 E H H 111.96 1.66 14.73 15.94 92.35 50.08 -65.44 -40.60 5.12 0.03 94.85 2.32 0.61 1.98 94.62 0.44 0.00 0.01 0.01 37 T H H 76.30 1.90 14.25 16.08 92.01 50.03 -64.66 -41.50 2.79 0.01 97.20 1.28 0.31 1.03 97.07 0.30 0.00 0.00 0.00 38 D H H 84.37 1.84 14.57 16.29 91.96 50.53 -64.38 -40.67 1.39 0.00 98.61 0.51 0.14 0.59 98.59 0.18 0.00 0.00 0.00 39 D H H 86.17 1.64 14.95 16.13 92.00 50.51 -64.91 -40.49 1.04 0.00 98.96 0.30 0.09 0.51 98.94 0.16 0.00 0.00 0.00 40 L H H 94.91 1.70 14.71 16.01 91.64 50.22 -64.43 -41.73 0.77 0.00 99.23 0.19 0.06 0.41 99.21 0.13 0.00 0.00 0.00 41 L H H 94.55 1.88 14.49 16.29 91.79 50.38 -64.39 -41.17 0.47 0.00 99.53 0.13 0.04 0.23 99.53 0.07 0.00 0.00 0.00 42 D H H 84.49 1.77 14.99 16.49 91.74 50.86 -64.18 -40.79 0.44 0.00 99.56 0.09 0.03 0.24 99.58 0.06 0.00 0.00 0.00 43 E H H 112.47 1.54 15.27 16.16 91.77 50.19 -64.55 -41.15 0.46 0.00 99.54 0.07 0.03 0.28 99.55 0.07 0.00 0.00 0.00 44 I H H 96.28 1.89 14.86 16.58 91.81 49.65 -64.49 -41.87 0.36 0.00 99.64 0.07 0.02 0.20 99.65 0.06 0.00 0.00 0.00 45 D H H 79.69 2.11 14.77 17.01 91.48 50.26 -63.99 -40.72 0.46 0.00 99.53 0.09 0.03 0.26 99.55 0.07 0.00 0.00 0.00 46 D H H 81.10 1.72 15.08 16.41 91.70 50.50 -64.63 -40.63 1.10 0.00 98.90 0.16 0.07 0.71 98.91 0.14 0.00 0.00 0.00 47 V H H 80.83 1.95 14.29 16.31 91.77 50.07 -64.31 -41.85 1.43 0.01 98.56 0.28 0.14 0.87 98.48 0.23 0.00 0.00 0.00 48 L H H 96.41 2.24 13.26 16.05 91.95 49.85 -65.36 -39.90 2.52 0.02 97.46 0.73 0.30 1.33 97.18 0.45 0.00 0.01 0.00 49 E H H 123.15 1.63 13.87 15.43 92.25 50.55 -66.36 -38.27 5.99 0.03 93.98 1.26 0.57 3.80 93.46 0.87 0.01 0.01 0.01 50 E H H 128.51 1.31 14.83 15.29 93.68 48.07 -69.81 -36.53 14.95 0.04 85.01 1.19 1.37 12.01 84.34 1.03 0.02 0.01 0.02 51 N H H 90.92 2.74 13.49 16.85 98.43 37.78 -89.94 -11.85 41.14 0.15 58.71 7.92 3.36 28.44 58.63 1.49 0.01 0.05 0.09 52 A H H 50.71 4.35 11.54 17.91 93.04 79.66 -63.17 -39.82 7.24 0.05 92.71 3.87 0.81 2.47 91.23 1.58 0.00 0.02 0.02 53 E H H 112.11 2.18 14.20 16.82 92.23 52.68 -64.22 -40.95 1.78 0.01 98.21 0.48 0.19 0.96 97.42 0.95 0.00 0.00 0.00 54 D H H 90.88 1.41 15.39 15.90 92.15 50.13 -65.80 -40.38 1.07 0.01 98.92 0.27 0.11 0.60 98.01 1.00 0.00 0.01 0.00 55 F H H 118.01 1.91 13.95 15.97 92.37 49.74 -65.20 -41.61 0.94 0.01 99.05 0.21 0.09 0.55 98.47 0.68 0.00 0.00 0.00 56 V H H 79.84 2.66 12.84 16.47 92.37 49.14 -65.34 -41.40 1.43 0.02 98.55 0.31 0.14 0.89 98.10 0.56 0.00 0.01 0.00 57 R H H 146.12 1.64 13.62 15.34 91.95 51.17 -64.71 -39.27 3.35 0.01 96.64 0.43 0.26 2.46 95.59 1.24 0.01 0.01 0.00 58 A H H 68.29 1.51 12.99 14.32 92.46 51.67 -66.73 -37.98 13.05 0.03 86.91 0.80 0.74 11.39 85.29 1.73 0.02 0.01 0.02 59 Y H H 148.75 1.67 11.77 13.77 96.20 48.26 -72.52 -36.18 25.23 0.33 74.44 3.93 3.12 18.47 71.68 2.40 0.08 0.15 0.17 60 V H H 92.14 2.66 9.83 13.76 97.94 51.05 -74.11 -35.04 31.71 4.78 63.51 16.53 7.11 10.00 59.42 2.72 0.16 2.30 1.76 61 Q H H 130.18 1.45 9.75 11.83 100.22 52.61 -76.46 -24.91 39.01 3.39 57.61 23.40 5.70 10.95 52.82 3.93 0.05 2.26 0.90 62 K H H 161.36 1.02 9.06 10.66 99.74 55.79 -74.92 -13.23 41.45 2.35 56.19 13.03 7.20 22.79 46.87 7.50 0.22 1.55 0.83 63 G C T 61.51 1.03 9.12 10.64 101.01 30.94 -15.73 -5.31 57.95 0.83 41.22 11.89 7.35 38.80 34.14 6.84 0.07 0.43 0.48 64 G C C 57.54 1.91 8.73 12.01 102.99 32.31 -26.96 2.61 82.22 0.74 17.04 50.17 3.00 29.84 13.03 3.15 0.00 0.39 0.43 65 Q C C 133.10 2.35 10.70 14.43 109.16 113.60 -84.61 113.06 99.73 0.19 0.09 99.43 0.24 0.13 0.05 0.01 0.00 0.09 0.04