# 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 129.93 3.33 10.60 15.51 117.56 -157.03 -94.09 137.66 99.92 0.08 0.01 99.86 0.07 0.02 0.00 0.00 0.00 0.03 0.01 1 A C C 86.29 2.39 7.98 12.23 112.17 -119.15 -83.27 134.81 94.03 5.65 0.32 91.73 1.76 0.91 0.13 0.12 0.00 3.02 2.34 2 V C C 112.79 2.33 7.05 11.32 117.18 -142.45 -99.48 133.31 91.73 7.99 0.28 65.83 25.99 0.65 0.13 0.15 0.00 4.36 2.90 3 P C C 96.72 2.87 7.85 12.69 114.64 -107.21 -67.99 148.13 93.21 5.64 1.15 85.86 5.56 1.77 0.37 0.68 0.00 3.96 1.80 4 A C C 91.90 1.63 8.31 11.41 112.13 -116.64 -76.93 139.10 90.27 6.27 3.46 73.15 12.62 4.11 1.29 2.11 0.00 3.42 3.29 5 R C C 177.60 1.79 8.04 11.49 116.09 -116.35 -94.88 134.53 88.92 7.13 3.95 67.83 16.02 4.76 1.68 2.25 0.00 3.96 3.50 6 R C C 173.46 1.92 8.27 12.01 116.28 -142.01 -95.56 135.42 88.68 6.76 4.56 70.33 14.16 3.88 2.84 1.73 0.00 3.45 3.60 7 T C C 86.36 4.36 7.78 14.04 116.29 -143.99 -95.32 143.17 92.69 3.88 3.42 77.44 13.27 1.92 2.81 0.81 0.00 1.79 1.96 8 S C C 61.08 2.55 10.16 14.05 118.63 -119.50 -80.95 160.65 90.86 2.90 6.23 81.01 8.27 1.18 6.27 0.62 0.00 1.10 1.55 9 K H H 157.68 1.30 10.44 12.56 92.77 -106.79 -61.72 -35.79 9.90 0.18 89.92 3.85 2.38 4.36 86.96 2.28 0.02 0.08 0.07 10 A H H 73.04 1.30 11.28 12.68 92.71 53.06 -65.37 -39.76 9.08 0.35 90.57 3.58 1.65 4.60 87.02 2.79 0.03 0.23 0.08 11 K H H 108.27 2.76 11.14 15.17 93.09 49.48 -67.27 -38.65 6.51 0.51 92.98 3.29 1.21 2.82 88.95 3.21 0.02 0.41 0.08 12 K H H 108.99 3.29 11.04 15.87 92.54 53.37 -64.47 -40.51 5.88 0.32 93.80 2.62 0.99 2.72 91.07 2.29 0.02 0.23 0.06 13 A H H 70.69 1.67 12.27 14.26 92.73 51.62 -66.73 -36.94 11.37 0.34 88.29 3.61 1.41 6.54 85.75 2.34 0.04 0.22 0.09 14 K H H 137.17 1.75 12.10 14.32 93.81 53.08 -69.40 -33.45 20.53 0.37 79.10 5.52 2.67 12.16 76.93 2.36 0.04 0.19 0.14 15 R H H 139.19 3.68 10.28 15.50 97.91 59.08 -75.82 -22.15 37.63 1.02 61.35 15.40 6.56 16.23 58.34 2.53 0.04 0.43 0.48 16 R C H 153.91 2.71 10.39 14.52 101.39 68.99 -81.31 8.30 58.78 2.40 38.82 35.49 8.15 14.72 36.07 3.31 0.02 1.08 1.16 17 T C C 87.59 3.40 9.58 14.59 105.65 90.58 -88.87 29.97 71.49 1.98 26.52 43.03 11.11 16.55 22.17 5.17 0.01 0.96 0.99 18 H C C 141.61 2.47 9.90 13.57 102.50 74.15 -86.93 2.28 76.21 1.80 21.99 38.14 16.99 21.18 14.39 7.53 0.01 0.90 0.86 19 Y C C 156.06 3.36 9.64 14.67 108.87 85.64 -93.07 68.94 80.04 2.40 17.56 43.12 19.74 17.52 9.39 7.85 0.01 1.31 1.05 20 K C C 147.54 2.38 10.85 14.74 114.16 -141.33 -96.06 127.80 83.18 5.39 11.44 59.86 12.13 11.15 5.58 5.81 0.00 3.65 1.82 21 L C C 96.37 7.52 8.84 17.70 117.13 -154.90 -97.44 132.19 86.28 9.02 4.69 74.13 8.44 3.39 2.51 2.22 0.00 6.30 3.02 22 T C C 101.49 2.44 13.07 16.87 115.99 -156.87 -103.77 127.88 86.39 10.43 3.18 76.11 7.24 2.48 1.66 1.51 0.00 6.98 4.02 23 I C C 87.86 9.34 8.35 18.56 115.76 -153.74 -98.88 126.60 87.39 7.30 5.32 76.89 7.97 2.51 1.14 4.10 0.00 5.00 2.38 24 K C C 158.97 1.57 12.97 15.14 112.31 -144.05 -82.54 133.44 88.67 6.04 5.29 39.09 13.80 36.33 0.84 4.25 0.00 4.62 1.06 25 G C T 46.27 3.30 14.84 18.83 113.24 10.67 105.49 -0.31 88.26 7.70 4.05 31.54 19.15 37.79 0.33 3.58 0.00 7.10 0.51 26 L C C 79.61 11.82 10.05 22.14 120.94 -86.00 -99.25 137.38 60.59 39.20 0.20 56.44 2.90 0.32 0.04 0.16 0.00 39.31 0.84 27 N E E 75.08 5.31 16.62 23.45 131.08 -177.14 -130.51 153.85 6.67 93.26 0.07 6.14 0.55 0.07 0.02 0.04 0.00 92.28 0.90 28 A E E 71.90 4.84 16.23 22.47 115.40 -105.32 -77.05 139.82 4.29 95.67 0.04 4.16 0.18 0.02 0.03 0.02 0.00 87.16 8.44 29 C C C 18.75 16.63 7.81 24.52 109.38 -114.49 -71.59 126.62 92.91 7.06 0.03 93.26 0.44 0.08 0.00 0.01 0.00 5.72 0.49 30 S C T 91.77 1.26 15.23 16.26 93.42 -146.60 -68.91 -24.38 99.59 0.18 0.23 1.46 10.79 87.32 0.01 0.25 0.00 0.13 0.04 31 N C T 113.27 2.46 13.29 16.52 99.59 44.05 -84.67 -37.03 99.77 0.05 0.18 0.11 4.58 95.15 0.00 0.13 0.00 0.02 0.01 32 C C T 65.31 5.08 11.77 18.44 103.65 18.58 -109.12 -14.32 99.76 0.09 0.15 0.50 6.34 92.94 0.00 0.14 0.00 0.05 0.02 33 G C C 48.37 3.51 13.15 18.24 95.65 -121.59 80.68 6.07 99.16 0.78 0.05 85.28 11.83 2.05 0.01 0.05 0.00 0.42 0.35 34 E C C 91.16 4.69 13.81 20.37 119.78 134.81 -80.02 148.10 96.62 3.37 0.01 93.55 3.43 0.06 0.00 0.01 0.00 2.64 0.32 35 M E E 104.00 6.65 15.59 23.61 114.06 -111.20 -79.39 135.72 2.90 97.10 0.01 2.81 0.13 0.01 0.00 0.00 0.00 93.25 3.79 36 K E E 62.58 12.76 12.64 26.18 132.65 173.79 -134.24 155.27 4.60 95.39 0.01 4.49 0.17 0.01 0.00 0.00 0.00 94.19 1.12 37 K C C 98.40 5.47 17.87 24.12 117.27 -101.57 -73.10 151.19 53.39 46.40 0.21 50.45 2.18 0.48 0.03 0.22 0.00 45.08 1.57 38 S C T 55.84 10.33 15.25 26.13 101.05 -96.18 -62.69 49.75 96.20 2.82 0.97 4.50 17.81 73.59 0.03 1.31 0.00 2.43 0.32 39 H C T 110.79 7.72 17.81 26.04 95.89 33.74 -89.92 8.57 96.26 2.89 0.85 5.40 16.87 73.47 0.02 1.22 0.00 2.80 0.21 40 H C C 78.79 9.18 18.64 28.60 125.83 95.73 -111.22 146.27 68.32 31.32 0.36 42.11 25.84 1.43 0.05 0.39 0.00 27.09 3.09 41 V E B 48.33 12.57 16.80 30.20 121.24 -136.18 -105.16 137.76 12.80 87.14 0.06 11.51 0.66 0.03 0.05 0.02 0.00 30.29 57.43 42 C C C 16.78 15.39 13.12 29.93 110.21 -114.18 -76.52 125.22 83.82 16.13 0.05 84.31 0.84 0.08 0.01 0.02 0.00 12.67 2.07 43 P C T 91.57 5.12 16.73 23.30 92.25 -138.25 -63.94 -26.60 98.18 0.42 1.40 0.41 2.83 94.66 0.02 1.72 0.00 0.29 0.07 44 A C T 79.25 2.44 17.58 20.21 96.68 51.45 -78.24 -33.90 98.55 0.11 1.34 0.10 1.65 96.70 0.01 1.47 0.00 0.05 0.02 45 C C T 53.53 7.57 15.19 24.23 102.89 22.21 -109.16 -13.02 98.58 0.26 1.17 0.97 4.89 92.27 0.01 1.62 0.00 0.17 0.07 46 G C C 17.60 11.53 14.88 27.92 97.69 -116.31 82.39 8.27 86.03 13.77 0.20 74.23 4.64 6.88 0.04 0.14 0.00 12.89 1.18 47 H E E 67.26 7.88 17.10 26.53 125.01 133.96 -102.12 148.43 4.20 95.78 0.02 4.12 0.18 0.01 0.01 0.01 0.00 88.71 6.96 48 Y E E 60.81 14.69 11.70 26.81 122.15 -167.56 -131.84 126.30 4.73 95.18 0.08 3.12 1.03 0.55 0.03 0.06 0.00 90.80 4.42 49 D C T 118.03 2.30 14.98 18.22 92.40 -13.60 54.02 41.10 99.71 0.17 0.12 0.29 2.61 96.87 0.00 0.09 0.00 0.11 0.02 50 G C T 61.56 1.64 13.76 15.80 93.85 -52.05 79.37 3.78 99.82 0.07 0.10 0.34 3.41 96.09 0.00 0.09 0.00 0.05 0.01 51 K E E 122.85 3.00 14.18 18.77 122.21 113.35 -107.49 141.28 7.95 91.95 0.10 4.43 3.60 0.45 0.05 0.06 0.00 85.05 6.37 52 D E E 83.63 6.55 14.07 22.26 108.97 -112.43 -71.77 126.26 14.78 85.10 0.12 13.88 0.62 0.09 0.06 0.05 0.00 79.85 5.44 53 V C C 49.66 12.25 13.10 26.27 99.71 -169.07 -93.65 -21.26 82.87 14.03 3.10 52.98 20.11 9.44 0.90 2.36 0.00 12.97 1.24 54 M C C 73.73 11.09 12.50 24.19 119.61 47.78 -120.27 129.33 77.46 15.57 6.97 38.98 24.87 15.01 2.13 4.65 0.04 10.72 3.62 55 S C C 70.15 4.36 12.61 18.63 115.73 -154.80 -103.67 131.82 81.46 11.99 6.55 60.43 13.11 7.82 1.97 4.87 0.01 8.65 3.14 56 K C C 142.15 4.29 9.61 15.86 106.19 -146.17 -92.84 44.64 85.89 8.07 6.04 55.79 20.21 9.98 1.90 4.14 0.01 5.34 2.64 57 E C C 143.80 1.90 9.99 13.41 113.45 114.41 -86.44 135.41 91.61 4.77 3.62 82.62 2.41 7.11 1.17 1.88 0.00 3.33 1.47 58 A C C 79.39 4.07 10.66 16.51 111.98 -108.85 -76.08 138.06 99.84 0.13 0.03 99.75 0.09 0.06 0.01 0.00 0.00 0.08 0.01