# 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 123.95 3.73 10.40 15.80 115.74 -153.77 -92.71 135.18 99.80 0.16 0.04 99.66 0.15 0.06 0.01 0.00 0.00 0.07 0.04 1 A C C 78.33 3.51 7.66 12.98 110.41 -127.93 -81.67 131.13 91.90 2.84 5.26 87.25 1.12 4.90 1.25 2.65 0.00 1.50 1.34 2 R C C 182.68 1.33 8.43 10.83 105.00 -148.67 -86.97 16.69 90.38 3.75 5.87 42.43 23.51 24.52 1.04 5.00 0.00 2.02 1.48 3 N C C 130.85 1.23 8.80 10.92 107.72 36.42 -91.67 92.71 89.81 4.27 5.92 45.25 24.24 20.42 1.17 4.86 0.00 2.25 1.81 4 K C C 97.87 6.58 6.74 14.88 117.80 120.41 -94.12 141.23 96.29 3.11 0.60 63.01 33.11 0.44 0.42 0.17 0.00 1.26 1.60 5 P C C 77.50 2.26 11.65 14.92 114.31 -106.54 -65.85 150.54 95.68 3.21 1.11 94.62 1.18 0.27 0.91 0.13 0.00 1.11 1.77 6 F H H 155.40 1.72 10.11 13.03 92.81 -112.38 -58.69 -38.65 1.94 0.01 98.05 0.58 0.27 0.89 97.80 0.45 0.00 0.00 0.00 7 A H H 71.56 1.27 12.02 13.17 91.76 52.86 -64.32 -39.95 1.01 0.00 98.99 0.17 0.09 0.62 98.57 0.55 0.00 0.00 0.00 8 K H H 104.69 2.86 12.31 16.33 92.24 49.11 -66.35 -39.78 0.35 0.00 99.65 0.07 0.03 0.19 99.27 0.43 0.00 0.00 0.00 9 K H H 99.40 3.88 12.49 17.87 91.86 51.90 -64.11 -41.33 0.20 0.00 99.80 0.03 0.02 0.11 99.75 0.10 0.00 0.00 0.00 10 L H H 98.52 1.58 14.99 16.03 91.80 49.74 -64.27 -41.13 0.27 0.00 99.72 0.03 0.01 0.17 99.73 0.06 0.00 0.00 0.00 11 R H H 133.09 1.88 14.91 16.70 92.06 49.91 -64.50 -41.35 0.36 0.00 99.64 0.05 0.02 0.22 99.64 0.07 0.00 0.00 0.00 12 L H H 81.36 3.77 13.66 18.66 92.05 50.07 -64.52 -41.05 0.40 0.00 99.60 0.06 0.02 0.24 99.57 0.10 0.00 0.00 0.00 13 A H H 56.71 2.32 14.77 17.44 91.72 50.80 -63.57 -41.29 0.69 0.00 99.31 0.10 0.04 0.45 99.26 0.15 0.00 0.00 0.00 14 K H H 121.64 1.49 15.37 16.14 92.10 50.02 -65.12 -39.83 1.25 0.00 98.75 0.16 0.08 0.87 98.58 0.30 0.00 0.00 0.00 15 A H H 48.97 3.49 12.75 17.76 92.13 51.77 -64.90 -40.24 2.32 0.01 97.68 0.28 0.17 1.64 97.17 0.74 0.00 0.00 0.00 16 A H H 61.87 3.00 12.90 16.98 91.98 52.01 -65.53 -36.48 8.18 0.04 91.78 0.86 0.61 6.29 90.73 1.46 0.01 0.02 0.02 17 K H H 139.62 1.65 12.72 14.66 93.22 53.24 -70.51 -26.18 23.64 0.23 76.14 4.01 2.40 17.26 73.43 2.63 0.05 0.10 0.12 18 Q H H 123.62 2.31 11.08 14.49 95.62 62.32 -72.87 -22.42 44.61 0.67 54.72 9.04 6.63 29.60 50.86 3.13 0.09 0.27 0.38 19 N C T 118.98 2.13 10.52 13.67 99.49 51.57 -92.19 6.05 68.15 1.16 30.69 22.66 10.96 35.01 26.68 3.55 0.03 0.46 0.65 20 R C C 150.53 2.67 9.68 14.31 117.71 111.39 -88.90 141.59 89.21 2.84 7.95 53.09 29.29 6.82 6.17 1.93 0.01 1.15 1.55 21 R C C 180.88 1.46 11.44 13.98 113.71 -106.62 -78.14 139.85 90.23 6.09 3.68 76.50 10.49 2.70 2.87 0.99 0.00 2.88 3.57 22 V C C 84.95 6.71 7.37 15.75 116.16 -117.71 -84.70 138.83 92.24 4.25 3.51 79.48 11.46 1.23 3.40 0.53 0.00 2.41 1.49 23 P C C 77.39 3.63 10.62 16.02 111.94 -106.09 -65.20 140.68 90.38 4.67 4.95 86.61 2.52 1.50 4.33 0.70 0.00 3.15 1.18 24 V H H 114.12 2.29 10.35 14.15 95.42 -141.40 -68.76 -26.68 34.54 12.45 53.01 19.70 9.67 7.59 45.35 5.34 0.16 10.53 1.66 25 W H H 178.11 1.69 11.00 13.32 97.47 61.87 -72.87 -27.84 20.67 20.20 59.13 10.42 5.21 6.80 51.42 5.95 0.23 18.79 1.18 26 V H H 76.74 4.49 9.84 16.07 101.68 51.87 -82.38 -29.79 11.33 30.72 57.95 6.75 1.99 2.83 51.86 4.95 0.06 30.77 0.80 27 I H H 87.86 4.87 10.09 16.65 101.93 56.24 -81.56 -32.17 10.51 38.38 51.12 6.06 1.59 2.34 47.89 3.63 0.04 37.74 0.71 28 V E E 86.28 3.43 10.58 15.37 114.26 53.45 -97.75 127.30 12.93 53.13 33.95 7.87 1.81 2.65 33.97 2.65 0.04 49.80 1.21 29 K E E 127.77 3.32 9.29 14.14 107.54 -150.40 -86.30 112.98 22.49 53.97 23.53 14.44 3.16 3.95 23.76 2.84 0.07 49.82 1.95 30 T C E 84.33 3.47 8.22 13.23 110.43 51.09 -108.41 87.13 39.04 36.06 24.89 16.31 7.50 15.21 21.95 4.24 0.42 31.45 2.91 31 N C T 139.68 0.70 10.44 10.72 96.71 -37.29 51.37 30.26 88.15 1.46 10.39 13.85 13.71 60.40 7.89 2.71 0.01 0.97 0.47 32 R C T 188.20 1.35 9.24 11.64 97.22 -57.38 63.29 17.45 92.97 1.81 5.22 17.22 21.34 54.95 2.65 2.17 0.00 1.27 0.40 33 K E E 144.48 1.43 9.93 12.39 118.17 115.73 -104.27 137.31 43.78 54.39 1.84 28.76 12.28 4.95 0.80 1.14 0.01 48.48 3.58 34 V E E 91.42 5.19 8.03 15.17 115.62 -127.23 -95.80 127.86 33.76 65.17 1.07 29.71 2.96 0.89 0.65 0.50 0.00 61.00 4.29 35 I C E 105.55 3.56 10.99 16.32 116.45 -169.50 -111.51 127.79 50.46 48.54 1.00 42.24 6.29 1.42 0.51 0.50 0.00 47.33 1.71 36 T C C 85.21 4.56 10.32 16.81 122.80 -141.49 -120.93 137.86 63.51 35.48 1.01 49.01 12.85 1.73 0.51 0.61 0.00 32.22 3.07 37 H C C 97.93 5.21 9.40 16.60 115.02 -159.47 -110.86 118.64 93.20 6.16 0.64 85.55 7.07 0.71 0.36 0.28 0.00 5.09 0.94 38 P C T 95.99 3.21 9.77 14.83 94.87 -148.98 -65.19 -23.78 73.20 2.40 24.39 27.68 12.89 32.90 9.12 15.14 0.01 1.52 0.76 39 K C T 151.86 1.51 10.59 12.79 98.49 65.43 -80.86 -10.19 69.14 2.36 28.50 22.21 14.57 32.71 11.92 16.24 0.03 1.27 1.05 40 R C C 146.41 3.61 9.34 14.61 105.36 78.10 -83.00 74.79 67.08 2.83 30.09 43.54 13.20 10.02 14.36 15.96 0.01 1.43 1.48 41 R C C 138.78 4.22 9.03 15.01 109.28 77.95 -85.98 114.82 68.49 2.16 29.35 47.71 11.89 8.76 20.60 8.84 0.00 1.09 1.12 42 H C C 128.03 2.56 10.16 13.95 103.63 58.96 -86.83 40.75 63.45 2.30 34.25 43.43 9.27 10.67 23.64 10.67 0.01 1.18 1.14 43 W C H 154.10 3.55 8.55 13.90 99.15 116.20 -73.28 -23.84 52.06 1.68 46.26 25.67 9.88 17.03 28.68 17.06 0.03 0.87 0.79 44 R C H 158.52 2.04 9.22 12.55 99.87 64.03 -79.69 -13.19 50.18 1.77 48.06 23.93 9.97 17.03 31.32 15.97 0.05 0.92 0.80 45 R C H 158.86 2.09 8.84 12.23 102.76 83.56 -84.35 -1.05 50.92 1.75 47.33 26.44 12.00 13.17 32.78 13.88 0.05 0.83 0.85 46 T C C 89.39 2.86 7.74 12.30 108.20 95.74 -88.68 62.22 56.07 1.53 42.40 29.83 11.72 14.67 29.29 12.98 0.03 0.75 0.74 47 K C C 154.19 1.52 8.39 11.05 104.07 60.65 -84.02 15.97 60.82 2.22 36.96 30.31 12.56 18.36 23.13 13.41 0.04 1.18 1.00 48 L C C 121.06 2.55 6.42 10.74 106.56 121.03 -86.06 64.18 67.16 3.28 29.55 37.72 12.39 17.38 17.63 11.57 0.02 1.90 1.40 49 K C C 158.35 1.40 7.24 10.09 110.38 -148.32 -88.99 118.14 82.99 2.77 14.24 69.47 2.73 11.39 9.64 3.82 0.00 1.68 1.26 50 E C C 145.17 2.26 9.68 13.60 109.06 -132.99 -82.60 118.00 99.77 0.14 0.09 99.47 0.19 0.19 0.05 0.01 0.00 0.07 0.03