# 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 119.09 4.97 10.75 17.25 114.82 -152.27 -87.35 138.82 99.89 0.09 0.03 99.80 0.09 0.04 0.01 0.00 0.00 0.04 0.01 1 A C C 76.38 3.43 9.15 14.38 112.72 -113.77 -76.13 139.29 92.46 3.84 3.71 86.08 1.39 5.59 2.13 1.14 0.00 2.09 1.58 2 R C C 165.51 2.67 9.25 13.72 112.34 -143.44 -92.96 123.58 90.13 5.63 4.24 64.69 18.17 6.67 2.60 1.64 0.00 2.08 4.15 3 F C C 98.71 6.26 8.14 16.11 112.21 -125.24 -93.04 119.86 96.16 0.79 3.05 84.91 10.36 0.68 2.98 0.33 0.00 0.28 0.47 4 P H H 95.85 1.94 12.66 15.25 94.64 -136.51 -60.22 -37.90 9.36 0.11 90.53 4.47 1.42 3.88 87.12 3.02 0.00 0.06 0.04 5 E H H 122.07 1.89 13.34 15.60 92.73 51.04 -66.39 -38.01 6.01 0.15 93.84 2.25 0.88 3.20 89.72 3.77 0.02 0.11 0.04 6 A H H 33.61 7.33 11.09 20.55 92.26 50.87 -65.51 -40.11 3.78 0.24 95.97 1.85 0.62 1.71 90.87 4.67 0.01 0.23 0.03 7 E H H 91.50 4.96 13.66 20.05 92.10 52.06 -65.05 -38.91 3.79 0.19 96.01 1.80 0.60 1.78 92.66 2.97 0.01 0.16 0.03 8 A H H 60.25 2.47 15.02 17.86 92.22 52.77 -66.82 -37.22 8.31 0.28 91.41 2.46 1.06 5.27 87.02 3.87 0.05 0.19 0.08 9 R H H 114.05 5.13 13.89 20.35 94.56 53.41 -69.52 -32.39 13.57 0.32 86.10 3.50 1.63 8.99 81.27 4.23 0.06 0.18 0.14 10 I H H 74.70 9.40 12.41 22.76 94.66 58.70 -69.38 -31.06 21.68 0.66 77.66 6.57 2.95 12.80 72.28 4.65 0.08 0.34 0.32 11 F H H 127.39 4.52 13.99 19.71 95.08 55.74 -77.59 -16.68 43.65 1.15 55.19 12.37 6.50 25.24 49.49 5.15 0.10 0.53 0.62 12 R C T 159.91 2.61 16.33 19.29 100.93 48.43 -90.32 -2.20 65.73 1.57 32.71 23.46 11.69 30.37 28.22 4.75 0.04 0.74 0.74 13 K C C 91.05 9.13 15.18 25.21 118.90 71.44 -97.70 142.36 86.36 5.78 7.86 65.07 12.95 8.07 5.63 2.61 0.00 4.26 1.41 14 L C C 47.75 13.36 16.57 30.77 118.72 -143.82 -104.78 133.27 58.06 38.47 3.47 48.61 5.88 2.44 2.11 1.36 0.00 36.89 2.70 15 V E B 46.82 10.38 20.92 32.30 121.89 -154.36 -111.47 135.41 6.31 93.53 0.16 5.81 0.49 0.08 0.17 0.03 0.00 30.39 63.04 16 C C C 9.28 19.22 12.84 33.27 109.33 -113.68 -68.41 128.58 92.22 7.73 0.05 93.84 0.30 0.05 0.01 0.01 0.00 4.69 1.10 17 M C T 99.25 7.03 18.69 26.92 92.75 -148.39 -69.51 -25.56 99.82 0.07 0.11 0.30 2.91 96.65 0.00 0.08 0.00 0.04 0.02 18 R C T 140.25 4.27 17.52 22.80 99.25 45.08 -82.49 -40.64 99.90 0.02 0.08 0.02 1.18 98.74 0.00 0.04 0.00 0.01 0.00 19 C C T 61.59 5.91 15.15 22.59 101.90 18.71 -108.94 -11.72 99.91 0.02 0.07 0.09 1.73 98.13 0.00 0.04 0.00 0.01 0.01 20 G C C 42.73 5.92 15.90 23.40 93.91 -120.70 76.35 10.23 99.61 0.38 0.02 91.00 7.35 1.25 0.00 0.01 0.00 0.17 0.21 21 A C C 35.60 9.01 14.60 25.70 118.85 150.57 -74.41 147.71 97.21 2.79 0.00 94.88 2.82 0.03 0.00 0.00 0.00 1.75 0.51 22 T E B 80.96 6.33 20.13 27.30 116.93 -117.86 -88.93 137.06 1.30 98.70 0.00 1.40 0.06 0.00 0.01 0.00 0.00 33.33 65.19 23 N C C 25.97 19.06 11.27 29.66 121.46 -163.56 -112.46 135.29 76.48 23.51 0.01 75.93 1.12 0.03 0.00 0.01 0.00 21.83 1.08 24 P C C 63.47 5.32 18.19 24.40 114.17 -107.98 -66.70 152.57 93.81 5.57 0.62 82.55 5.11 5.74 0.03 1.19 0.00 4.44 0.93 25 W C T 174.87 4.89 14.69 21.18 107.68 -84.58 -61.94 130.51 98.93 0.32 0.76 0.44 5.07 93.28 0.01 0.93 0.00 0.21 0.06 26 G C T 60.69 1.34 17.53 18.17 95.23 20.52 82.00 0.50 99.29 0.13 0.58 1.17 4.00 93.89 0.01 0.82 0.00 0.09 0.02 27 A C C 22.12 15.81 8.39 24.19 115.49 133.36 -72.33 140.85 98.02 1.89 0.08 96.42 1.71 0.11 0.02 0.05 0.00 0.62 1.07 28 K C S 146.07 2.53 19.28 22.21 98.33 -169.58 -97.42 -17.49 99.20 0.77 0.03 19.62 79.41 0.39 0.01 0.02 0.00 0.37 0.18 29 K E B 98.91 4.54 21.31 26.60 135.05 32.79 -138.79 152.01 29.49 70.34 0.18 10.37 19.48 0.27 0.13 0.04 0.00 24.35 45.35 30 C C C 11.15 20.31 11.21 31.82 111.37 -108.48 -74.44 131.22 52.86 47.06 0.08 53.46 0.94 0.07 0.03 0.03 0.00 30.43 15.04 31 R C T 129.36 5.58 18.18 24.89 93.93 -141.89 -68.69 -31.12 96.20 3.26 0.54 0.80 3.84 92.70 0.03 0.44 0.00 1.73 0.45 32 K C T 127.89 3.69 17.88 22.32 96.09 46.31 -76.41 -36.99 99.31 0.36 0.33 0.10 1.82 97.58 0.01 0.19 0.00 0.12 0.18 33 C C T 53.61 8.25 14.24 24.00 101.66 23.05 -107.07 -8.92 99.60 0.12 0.28 0.33 2.69 96.71 0.02 0.15 0.00 0.07 0.04 34 G C C 42.45 4.57 17.42 23.15 96.16 -113.28 82.48 7.30 88.83 10.84 0.33 64.69 11.95 12.28 0.15 0.21 0.00 5.21 5.51 35 Y C C 65.76 12.15 11.28 24.73 114.30 147.65 -75.21 138.73 79.30 20.06 0.64 74.85 3.10 0.59 0.27 0.32 0.00 6.34 14.55 36 K C T 145.79 3.17 17.37 21.83 111.76 -147.79 -90.06 132.19 81.60 8.52 9.88 29.06 21.84 30.27 1.34 9.24 0.03 4.49 3.74 37 G C T 46.12 4.86 17.23 22.82 99.29 25.51 68.88 14.85 89.31 2.87 7.82 23.17 32.03 33.16 0.72 8.20 0.00 1.76 0.96 38 L C C 64.80 13.72 12.57 26.18 107.79 110.57 -85.22 90.66 89.53 5.02 5.45 65.87 16.23 6.18 1.10 5.14 0.00 2.43 3.05 39 R C C 120.03 7.03 14.32 22.83 121.29 86.16 -105.32 138.64 92.77 5.52 1.72 73.89 17.85 1.03 1.02 0.72 0.00 2.52 2.97 40 P C C 79.43 6.10 14.03 21.50 114.02 -106.70 -66.83 150.15 82.63 7.38 9.99 69.69 6.45 5.74 3.32 6.83 0.00 4.23 3.74 41 K C C 139.75 4.36 11.81 18.17 111.66 -104.79 -75.85 139.48 79.84 5.04 15.12 53.53 15.38 10.30 4.03 11.65 0.01 2.76 2.34 42 A C C 66.13 6.21 8.98 16.89 113.88 -111.62 -78.43 141.78 78.23 6.38 15.39 54.37 14.09 9.14 3.90 11.94 0.01 3.69 2.86 43 R C C 184.99 1.51 11.01 13.25 101.11 -156.34 -88.52 -4.32 83.63 6.06 10.32 53.88 21.85 7.84 3.48 6.69 0.00 3.35 2.90 44 E C C 118.38 3.50 8.86 14.29 117.64 90.07 -96.35 138.18 92.85 4.51 2.65 51.88 38.42 2.82 1.25 1.23 0.00 2.30 2.10 45 P C C 103.31 2.67 9.37 13.82 111.16 -108.49 -69.05 143.73 90.99 3.38 5.63 70.74 10.27 9.86 1.67 3.92 0.00 2.15 1.40 46 R C C 175.57 2.16 8.21 12.16 109.56 -128.42 -86.48 115.02 88.43 4.54 7.02 53.82 16.33 18.05 1.62 5.48 0.00 2.40 2.29 47 G C C 58.01 1.86 8.63 11.87 107.74 4.59 77.04 6.38 89.07 3.36 7.57 39.01 24.42 25.54 1.10 6.75 0.00 1.76 1.42 48 G C C 57.34 2.14 8.15 11.96 109.58 -88.59 -38.67 98.47 89.43 3.18 7.39 36.23 23.04 30.20 0.96 6.65 0.00 1.75 1.16 49 G C C 59.66 1.65 8.83 11.80 108.19 0.68 77.42 10.03 92.16 3.14 4.70 65.36 7.21 19.77 0.85 3.60 0.00 2.07 1.14 50 R C C 172.98 2.23 10.01 13.79 107.08 30.78 -85.76 92.63 99.36 0.55 0.09 98.86 0.44 0.22 0.03 0.03 0.00 0.29 0.13