# 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 125.21 3.43 10.06 15.28 118.68 -151.25 -99.88 138.21 99.88 0.11 0.00 99.80 0.11 0.02 0.00 0.00 0.00 0.06 0.01 1 P C C 108.12 1.97 8.83 12.36 114.13 -107.96 -75.83 144.74 89.33 10.50 0.18 88.95 0.66 0.39 0.05 0.07 0.00 8.71 1.16 2 L E E 125.81 2.76 6.08 10.77 117.96 -141.86 -103.48 132.15 45.80 53.78 0.42 39.91 4.95 0.67 0.21 0.26 0.00 50.26 3.75 3 E E E 151.96 1.10 8.37 10.62 117.34 -151.72 -105.08 127.71 34.13 65.43 0.44 32.13 1.77 0.32 0.24 0.21 0.00 63.56 1.78 4 I E E 115.53 4.48 5.91 12.08 117.36 -158.83 -105.59 126.14 39.71 59.02 1.27 37.54 1.50 0.46 0.65 0.46 0.00 58.35 1.03 5 R E E 187.57 0.80 9.71 10.67 103.19 -172.24 -100.49 -16.84 48.71 49.29 2.00 38.43 8.45 1.75 0.77 0.96 0.00 48.97 0.65 6 E E E 141.93 1.59 8.68 11.53 125.41 3.00 -132.21 137.44 39.10 58.02 2.88 33.53 4.10 1.50 1.11 1.32 0.00 57.63 0.81 7 L E E 119.51 3.45 6.97 12.52 118.88 -158.35 -112.88 129.07 36.50 61.65 1.85 32.69 2.77 0.78 0.96 0.71 0.00 61.34 0.75 8 V E E 114.13 1.68 9.16 12.31 118.51 -161.57 -113.48 126.53 27.75 71.11 1.13 24.94 2.03 0.58 0.63 0.40 0.00 70.77 0.65 9 I E E 115.54 4.08 7.64 13.97 119.17 -163.81 -113.43 128.27 25.16 73.99 0.85 23.06 1.39 0.34 0.48 0.25 0.00 74.07 0.40 10 K E E 154.41 1.50 10.53 13.36 120.49 -165.51 -117.46 133.96 22.65 76.45 0.91 20.88 1.09 0.36 0.53 0.25 0.00 76.46 0.43 11 A E E 71.33 5.10 8.09 15.51 125.63 -171.61 -129.99 142.33 22.81 76.17 1.03 21.19 1.19 0.38 0.65 0.30 0.00 75.73 0.57 12 S E E 78.86 2.51 11.93 15.93 120.69 -161.23 -115.62 135.26 22.21 77.04 0.75 20.88 1.22 0.37 0.50 0.26 0.00 75.71 1.05 13 V E E 91.31 6.20 8.46 16.45 117.05 -155.61 -106.41 127.70 39.26 59.20 1.54 34.34 3.72 1.19 0.95 0.66 0.00 57.36 1.78 14 N C C 113.11 2.60 10.73 14.79 117.72 -169.25 -110.38 128.78 71.51 26.68 1.81 54.85 12.53 3.60 0.74 1.05 0.00 25.68 1.55 15 E C C 143.80 2.49 10.07 14.11 104.35 -152.91 -88.94 30.21 85.14 10.03 4.82 53.41 21.13 10.99 1.36 3.32 0.00 8.35 1.44 16 G C C 55.08 2.55 10.58 14.49 112.18 15.17 61.54 146.18 90.63 3.75 5.62 48.38 22.02 20.65 1.24 4.28 0.00 2.35 1.07 17 G C C 50.65 3.55 9.73 14.98 114.39 -100.08 -91.41 159.42 88.38 3.37 8.25 48.89 21.53 18.18 1.77 6.41 0.00 1.86 1.35 18 Q C C 138.66 2.15 10.38 13.90 108.65 -96.43 -90.84 94.37 84.65 4.35 11.00 50.28 20.51 14.26 3.38 7.31 0.00 2.39 1.86 19 N C C 112.04 3.13 9.44 14.33 111.92 98.92 -94.31 120.21 85.94 3.92 10.14 55.55 16.51 14.04 3.37 6.58 0.00 2.21 1.75 20 Q C C 134.19 2.76 9.72 14.20 106.93 -152.43 -90.27 55.98 88.78 2.77 8.45 58.32 15.41 15.22 3.30 4.89 0.00 1.51 1.35 21 G C C 53.90 2.68 10.58 14.69 109.79 39.62 -77.85 150.72 91.98 1.92 6.10 61.37 16.48 14.25 2.39 3.53 0.00 1.02 0.95 22 T C C 105.52 2.28 10.55 14.23 107.86 -36.71 -91.46 69.34 90.20 2.23 7.57 59.43 16.66 14.26 3.29 4.08 0.00 1.21 1.07 23 G C C 51.65 3.47 11.01 15.86 111.34 43.10 -55.31 165.41 90.92 2.28 6.81 56.55 17.95 16.61 2.88 3.71 0.00 1.21 1.10 24 G C C 45.75 4.63 11.05 17.15 111.65 37.05 -61.60 109.30 89.65 2.17 8.17 63.51 14.83 11.18 4.68 3.52 0.00 1.10 1.20 25 A C C 78.99 3.60 11.37 16.39 101.40 -69.28 -78.63 -14.27 80.99 1.68 17.33 58.07 12.22 9.98 14.52 3.52 0.00 0.79 0.91 26 G C C 47.70 3.36 12.70 17.12 104.11 57.25 -69.52 -45.79 72.97 1.12 25.91 47.89 13.03 11.12 23.36 3.52 0.00 0.50 0.57 27 D C C 91.83 3.40 13.18 17.49 103.88 43.89 -81.14 53.12 56.87 0.96 42.17 44.03 5.48 6.93 39.71 3.00 0.00 0.42 0.43 28 Q H H 97.15 7.32 11.46 19.91 94.74 139.21 -65.85 -36.16 19.55 0.27 80.18 12.72 2.82 4.70 77.80 1.73 0.00 0.12 0.10 29 S H H 72.62 2.47 14.85 17.83 93.12 54.76 -65.00 -38.76 11.40 0.15 88.45 7.05 1.53 3.15 86.90 1.26 0.00 0.07 0.05 30 A H H 62.22 2.26 15.69 17.92 92.49 51.53 -65.96 -39.62 4.39 0.07 95.54 2.89 0.60 1.16 94.64 0.66 0.00 0.04 0.02 31 I H H 74.79 5.77 14.64 21.82 92.56 50.22 -64.72 -42.33 1.21 0.02 98.76 0.68 0.14 0.39 98.57 0.21 0.00 0.01 0.00 32 I H H 76.89 5.59 15.59 22.54 92.12 49.68 -64.10 -42.20 0.48 0.01 99.52 0.21 0.05 0.18 99.47 0.09 0.00 0.00 0.00 33 A H H 58.54 2.48 17.46 19.70 91.79 50.29 -63.72 -41.41 0.33 0.00 99.66 0.11 0.03 0.15 99.67 0.05 0.00 0.00 0.00 34 A H H 52.53 2.89 17.27 20.37 91.81 50.42 -64.36 -41.61 0.28 0.00 99.72 0.07 0.02 0.13 99.74 0.03 0.00 0.00 0.00 35 C H H 51.61 5.54 15.58 22.55 92.09 50.33 -64.60 -41.97 0.22 0.00 99.78 0.05 0.01 0.11 99.81 0.02 0.00 0.00 0.00 36 V H H 72.76 4.04 16.35 21.27 91.81 49.91 -64.04 -41.92 0.14 0.00 99.86 0.02 0.01 0.07 99.89 0.01 0.00 0.00 0.00 37 E H H 113.73 1.75 17.61 18.39 91.85 50.38 -64.46 -41.24 0.10 0.00 99.90 0.02 0.00 0.05 99.92 0.01 0.00 0.00 0.00 38 Q H H 99.59 2.56 16.62 19.27 91.96 50.15 -64.83 -41.29 0.11 0.00 99.89 0.01 0.00 0.06 99.91 0.01 0.00 0.00 0.00 39 V H H 69.00 4.46 14.94 20.46 91.98 50.09 -64.27 -42.49 0.10 0.00 99.90 0.01 0.00 0.06 99.91 0.01 0.00 0.00 0.00 40 L H H 88.08 2.47 15.73 18.41 91.69 50.20 -63.99 -40.71 0.15 0.00 99.85 0.02 0.01 0.08 99.87 0.02 0.00 0.00 0.00 41 A H H 57.54 1.98 15.47 17.25 91.71 51.03 -64.09 -40.73 0.33 0.00 99.67 0.04 0.02 0.19 99.71 0.04 0.00 0.00 0.00 42 I H H 82.63 2.93 14.07 17.85 92.01 50.10 -64.72 -41.48 0.58 0.00 99.42 0.09 0.04 0.34 99.45 0.08 0.00 0.00 0.00 43 L H H 87.78 2.50 12.98 16.26 92.02 50.34 -64.60 -40.53 1.40 0.01 98.59 0.31 0.12 0.81 98.56 0.21 0.00 0.00 0.00 44 Q H H 111.74 1.41 12.59 13.90 92.53 50.48 -65.86 -38.72 4.84 0.02 95.14 0.89 0.45 3.12 95.03 0.48 0.00 0.01 0.01 45 E H H 119.10 1.66 11.31 13.44 93.25 51.96 -67.59 -35.84 12.92 0.06 87.02 2.76 1.58 8.06 86.60 0.93 0.01 0.02 0.03 46 K H H 136.27 1.80 9.77 12.57 94.45 54.30 -69.33 -31.42 25.12 0.17 74.71 6.80 4.14 14.26 72.71 1.91 0.03 0.07 0.10 47 S H H 86.73 1.28 8.96 10.98 96.91 56.45 -76.29 -19.17 45.88 0.42 53.70 14.32 6.34 25.87 50.37 2.66 0.03 0.16 0.25 48 E C C 142.72 1.46 7.45 10.17 101.27 66.90 -81.16 -2.22 70.72 0.45 28.82 46.08 2.41 20.96 28.17 1.89 0.00 0.18 0.30 49 R C C 168.05 2.03 8.99 12.54 105.02 86.94 -82.27 71.53 99.88 0.04 0.08 99.66 0.12 0.13 0.05 0.00 0.00 0.02 0.01