# 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 K C C 148.56 2.57 10.88 14.85 108.71 -138.45 -87.70 116.40 99.88 0.10 0.02 99.70 0.16 0.06 0.01 0.00 0.00 0.04 0.02 1 Y C C 162.22 3.05 7.55 12.60 115.25 -152.04 -96.44 128.74 96.57 2.91 0.52 93.66 1.74 1.15 0.26 0.15 0.00 1.02 2.02 2 K C C 148.93 1.97 8.51 12.25 115.90 -154.68 -102.58 127.86 98.74 0.96 0.30 82.28 15.81 0.65 0.15 0.12 0.00 0.37 0.63 3 P C C 91.07 3.32 8.26 13.63 115.94 -111.00 -68.53 149.52 97.39 0.34 2.27 88.14 6.85 2.54 0.96 1.14 0.00 0.14 0.24 4 P C C 98.35 3.21 8.59 13.69 109.88 -101.02 -66.74 149.10 82.69 0.85 16.46 63.69 8.58 10.27 5.89 10.58 0.00 0.39 0.59 5 A C C 83.33 2.51 8.58 12.67 109.66 -109.60 -79.03 140.04 73.91 1.93 24.16 48.88 14.24 10.47 8.47 15.91 0.00 0.96 1.07 6 E C C 149.47 1.69 10.37 13.21 109.15 -96.39 -86.06 127.77 71.63 2.71 25.66 51.41 11.66 8.11 9.51 16.60 0.00 1.49 1.22 7 R C C 139.18 5.91 7.86 15.40 113.50 -125.85 -90.92 130.76 78.71 3.04 18.25 58.94 12.16 7.43 8.09 10.20 0.00 1.65 1.53 8 R C C 172.67 2.04 11.40 14.58 107.81 -160.93 -94.16 81.76 84.40 5.05 10.55 64.18 12.46 7.30 5.51 4.97 0.01 2.39 3.18 9 F C C 132.53 4.41 9.39 15.62 118.27 58.43 -104.04 141.00 87.03 5.97 7.00 52.82 22.51 11.63 3.61 3.10 0.01 2.54 3.77 10 G C C 41.88 4.17 11.97 17.60 123.34 18.87 99.03 -169.82 89.94 3.43 6.64 49.67 24.76 15.67 2.11 4.19 0.00 1.46 2.13 11 K C T 143.57 3.67 12.40 17.66 100.17 -72.23 -71.77 -13.99 73.71 2.19 24.10 13.72 14.74 45.02 3.22 20.95 0.02 1.15 1.18 12 G C T 46.03 5.61 13.23 19.99 97.31 58.87 -66.52 -12.60 73.73 1.73 24.54 11.68 14.53 46.90 2.87 22.23 0.01 0.96 0.82 13 V C C 87.76 5.78 14.48 21.34 99.86 55.85 -95.30 -0.16 71.05 4.98 23.97 39.65 17.46 13.76 3.67 20.53 0.01 2.63 2.28 14 Q C C 70.03 9.84 14.16 25.36 117.32 102.10 -90.58 136.25 88.10 9.12 2.78 60.43 24.55 3.07 1.05 1.76 0.00 5.30 3.84 15 L E B 89.19 6.33 19.56 26.61 119.40 -130.73 -89.91 141.56 49.26 50.35 0.40 43.27 2.15 0.11 0.30 0.06 0.00 7.27 46.84 16 C C C 12.52 19.31 10.18 29.91 109.89 -110.19 -68.22 131.11 95.41 4.50 0.09 95.70 0.61 0.07 0.04 0.02 0.00 1.33 2.23 17 K C T 135.13 3.54 17.96 22.65 93.19 -150.52 -71.05 -26.33 99.46 0.25 0.29 1.43 8.00 90.07 0.03 0.22 0.00 0.15 0.11 18 R C T 126.70 5.84 15.97 22.92 100.42 44.54 -84.48 -40.65 99.72 0.09 0.20 0.09 3.27 96.47 0.00 0.11 0.00 0.04 0.03 19 C C T 63.00 6.24 14.28 21.97 103.52 19.63 -108.82 -14.38 99.67 0.11 0.22 0.25 4.43 95.09 0.01 0.13 0.00 0.05 0.04 20 G C C 45.31 4.58 14.52 20.61 96.41 -117.02 82.04 4.53 98.72 1.17 0.11 73.98 22.64 1.91 0.04 0.08 0.00 0.43 0.92 21 S C C 48.09 6.32 13.74 22.10 117.57 136.63 -76.40 143.63 96.35 3.45 0.20 83.62 11.19 0.63 0.07 0.12 0.00 0.95 3.43 22 R C C 150.21 6.09 15.15 22.91 106.03 -153.58 -91.69 26.40 80.03 17.81 2.16 46.58 25.98 5.68 0.96 1.13 0.03 4.50 15.13 23 D C C 78.37 6.22 17.26 24.37 118.47 99.27 -100.58 142.21 95.28 2.57 2.15 44.31 39.53 11.82 0.75 1.17 0.00 1.22 1.21 24 S C C 39.90 9.81 16.79 27.56 112.01 -122.78 -73.56 143.11 79.65 5.70 14.65 48.56 24.10 7.18 10.53 3.87 0.02 2.87 2.87 25 V C S 36.47 11.74 17.37 30.33 95.70 -138.59 -71.72 -30.44 48.00 22.92 29.08 14.32 22.19 13.27 19.19 6.62 2.27 16.53 5.60 26 I E E 20.26 17.83 12.49 30.33 96.77 55.16 -78.50 -32.41 12.80 54.87 32.33 6.43 3.36 5.01 23.15 8.67 0.49 36.33 16.57 27 Q H G 107.77 4.91 15.37 21.55 93.30 65.87 -66.40 -39.10 19.59 13.60 66.81 12.71 2.70 5.38 19.63 45.60 0.03 12.83 1.12 28 K H G 147.44 1.91 15.37 17.71 91.90 53.31 -68.69 -31.33 23.17 3.05 73.77 1.86 2.86 19.32 13.65 59.04 0.09 2.82 0.37 29 Y H G 104.85 8.08 13.05 22.54 96.61 38.60 -99.39 5.32 35.44 0.26 64.30 0.81 2.13 33.10 9.48 54.22 0.01 0.15 0.10 30 G C T 52.15 2.78 18.37 21.21 94.03 -110.49 76.79 16.05 99.50 0.12 0.38 2.90 4.36 92.33 0.06 0.26 0.00 0.07 0.02 31 L C C 33.04 15.66 12.73 28.95 118.55 131.13 -103.35 135.47 75.29 24.45 0.26 60.74 12.26 2.23 0.07 0.26 0.00 19.39 5.04 32 Y C C 109.47 8.11 22.10 30.80 106.26 -144.84 -94.80 88.45 60.86 39.02 0.12 35.43 25.81 1.53 0.03 0.12 0.00 33.73 3.35 33 L E E 18.48 18.16 17.30 35.79 134.59 138.54 -130.02 156.10 32.17 67.74 0.09 27.43 5.42 0.18 0.06 0.05 0.00 37.67 29.19 34 C C C 22.26 12.13 20.37 33.69 117.90 -106.36 -71.35 154.70 78.16 21.77 0.07 80.62 0.44 0.02 0.05 0.01 0.00 16.42 2.44 35 R H H 95.45 12.32 17.85 30.60 91.11 -111.65 -57.90 -38.81 0.98 0.00 99.02 0.08 0.09 0.66 99.02 0.15 0.00 0.00 0.00 36 Q H H 101.92 2.97 22.91 25.33 91.70 53.25 -64.07 -41.19 0.37 0.00 99.62 0.02 0.02 0.30 99.49 0.17 0.00 0.00 0.00 37 C H H 24.51 11.14 18.94 31.50 91.81 47.93 -65.27 -41.97 0.12 0.00 99.87 0.01 0.01 0.08 99.73 0.16 0.00 0.00 0.00 38 F H H 12.36 22.16 14.94 37.10 91.62 51.01 -63.49 -43.37 0.05 0.00 99.95 0.00 0.00 0.03 99.92 0.04 0.00 0.00 0.00 39 R H H 108.84 8.33 19.38 28.29 91.59 50.83 -63.76 -40.72 0.15 0.00 99.85 0.01 0.01 0.12 99.78 0.08 0.00 0.00 0.00 40 E H H 110.03 2.17 21.69 22.47 92.59 48.64 -66.99 -40.59 0.93 0.00 99.07 0.01 0.02 0.94 98.89 0.13 0.00 0.00 0.00 41 V H H 37.62 10.79 17.32 29.33 95.89 41.67 -80.98 -34.93 7.29 0.01 92.70 0.17 0.36 6.93 92.23 0.29 0.01 0.00 0.01 42 A H H 10.06 17.84 11.68 30.17 91.83 59.54 -62.85 -41.56 17.37 0.21 82.42 3.42 2.35 11.33 65.71 16.87 0.08 0.09 0.15 43 Y H G 147.31 3.38 15.96 20.46 91.84 52.13 -64.07 -39.70 9.15 0.14 90.72 1.05 0.65 6.79 41.90 49.43 0.04 0.10 0.04 44 P H G 103.45 1.97 16.20 18.16 90.98 53.85 -67.79 -26.57 12.14 0.15 87.71 0.73 0.68 9.98 40.27 48.11 0.08 0.10 0.06 45 M H G 77.20 9.32 12.09 22.72 94.57 50.86 -89.47 0.61 31.86 0.12 68.01 0.80 1.75 28.51 20.42 48.31 0.04 0.06 0.10 46 G C T 54.03 1.90 17.59 18.89 98.05 -100.43 87.71 8.21 99.21 0.08 0.71 2.58 3.18 93.59 0.38 0.21 0.00 0.04 0.02 47 F C C 62.84 14.52 7.89 22.19 120.10 130.65 -91.69 146.77 89.96 9.23 0.80 80.95 7.06 1.94 0.36 0.43 0.00 7.16 2.10 48 R C C 161.11 2.10 15.83 18.80 120.46 -151.72 -112.35 137.98 78.16 20.85 1.00 71.63 4.48 1.52 0.48 0.50 0.00 16.05 5.34 49 K C C 117.40 8.66 10.41 20.30 113.95 -119.48 -79.89 133.79 78.49 20.00 1.51 66.23 7.25 3.95 0.53 1.07 0.00 16.21 4.75 50 T C C 83.95 5.90 9.09 16.56 108.02 -134.16 -84.67 123.55 94.79 4.31 0.90 90.23 1.49 3.35 0.23 0.51 0.00 3.32 0.88 51 R C C 181.08 1.74 12.49 15.11 107.42 -137.13 -86.80 68.42 99.88 0.09 0.02 99.72 0.14 0.07 0.01 0.00 0.00 0.05 0.01