# 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 112.04 5.04 10.47 17.07 112.12 -159.77 -95.23 122.16 99.89 0.06 0.05 99.81 0.08 0.05 0.03 0.00 0.00 0.02 0.01 1 H C C 134.01 2.55 8.89 12.90 106.61 -150.53 -87.91 65.91 72.53 2.20 25.27 67.74 1.19 5.11 20.86 3.03 0.00 1.01 1.06 2 N C C 109.24 2.69 8.34 12.46 104.34 72.54 -81.57 -23.23 56.98 2.21 40.82 40.17 7.45 9.48 33.93 6.93 0.01 1.22 0.80 3 H H H 135.92 2.16 8.74 12.23 98.87 74.03 -75.00 -26.93 38.58 2.74 58.68 26.12 6.02 7.60 45.16 12.55 0.02 1.82 0.70 4 F H H 143.54 1.96 9.43 12.46 97.41 67.21 -73.69 -32.21 24.92 2.78 72.31 15.04 4.33 6.54 53.70 17.75 0.04 2.06 0.53 5 F H H 136.45 2.58 9.60 13.46 97.31 54.40 -75.35 -30.87 21.85 3.06 75.09 12.00 3.89 6.99 56.57 17.57 0.06 2.38 0.55 6 L H H 107.90 3.17 9.57 14.30 97.96 56.25 -75.16 -25.36 24.65 3.12 72.22 12.32 4.68 8.76 54.40 16.73 0.09 2.29 0.73 7 A H H 73.53 2.91 10.02 14.38 100.05 66.58 -75.63 -21.40 45.38 2.01 52.60 16.13 7.87 21.92 40.54 11.43 0.13 1.23 0.76 8 A C T 80.80 2.29 10.80 14.16 102.85 66.32 -88.00 6.64 61.92 1.93 36.16 19.88 11.54 31.24 26.18 9.21 0.07 1.02 0.86 9 L C C 88.91 5.85 7.98 15.59 115.70 94.94 -88.92 135.02 84.67 0.82 14.51 53.30 27.45 4.03 12.08 2.37 0.00 0.29 0.47 10 P C C 86.37 3.30 10.66 15.51 108.53 -112.26 -68.00 143.44 64.51 0.75 34.73 50.18 5.31 9.07 20.46 14.21 0.00 0.40 0.36 11 E H G 138.88 2.31 10.74 14.35 100.58 -116.26 -71.42 -22.41 35.19 0.84 63.97 14.45 6.21 13.82 27.88 36.82 0.01 0.45 0.35 12 A H G 66.22 3.60 10.10 15.20 101.26 63.22 -74.84 -18.16 30.48 0.81 68.71 11.02 4.81 13.74 29.58 40.07 0.02 0.45 0.31 13 Y H G 125.43 5.37 9.47 16.40 99.34 63.29 -82.38 -7.88 25.53 0.70 73.77 10.86 4.17 10.23 31.01 43.09 0.01 0.39 0.25 14 S H G 71.23 3.40 10.69 15.67 96.39 85.86 -68.47 -31.16 21.85 0.54 77.60 6.12 3.12 11.75 27.24 51.27 0.01 0.32 0.17 15 I H G 125.17 1.63 11.76 13.80 95.57 56.67 -73.73 -24.01 26.72 0.41 72.87 3.71 3.09 18.05 23.73 51.02 0.01 0.24 0.15 16 F H G 119.38 4.37 10.17 16.12 101.47 50.81 -92.37 2.20 33.19 0.80 66.01 7.95 5.90 18.98 21.18 45.16 0.03 0.41 0.39 17 K C C 109.72 5.09 11.10 17.88 109.30 112.10 -72.73 114.27 54.29 0.80 44.91 35.45 12.66 7.11 34.59 9.46 0.01 0.34 0.38 18 P H H 83.85 3.49 11.35 16.20 99.74 -106.28 -67.09 -26.20 30.59 0.82 68.59 13.50 4.17 12.36 49.81 19.32 0.03 0.51 0.30 19 L H H 111.38 2.44 11.55 14.96 94.80 56.93 -69.50 -30.19 16.50 1.14 82.36 5.73 2.53 7.52 57.06 25.99 0.07 0.86 0.24 20 V H H 86.05 3.84 10.50 15.83 96.08 56.19 -73.76 -33.64 14.85 1.19 83.96 4.71 2.42 6.93 57.18 27.57 0.08 0.89 0.22 21 D H H 98.45 2.86 12.04 15.98 96.59 55.18 -78.16 -21.91 36.27 1.00 62.73 6.42 4.42 22.99 42.47 22.50 0.17 0.61 0.43 22 I H H 106.49 3.31 11.24 15.67 99.52 51.68 -89.97 -11.22 45.69 1.38 52.93 7.48 7.42 30.07 38.70 14.31 0.47 0.69 0.86 23 L C H 96.68 4.02 10.79 16.56 98.08 78.52 -70.05 -34.74 53.54 2.11 44.35 24.09 13.60 16.68 28.07 15.48 0.10 1.07 0.91 24 P C T 89.91 2.61 12.28 15.78 95.87 52.39 -70.22 -21.28 56.80 1.09 42.11 18.39 8.22 30.14 26.63 15.45 0.04 0.61 0.52 25 V H H 88.65 3.44 11.87 16.47 98.55 55.77 -77.65 -27.61 33.18 1.57 65.24 11.75 5.57 16.29 48.77 15.88 0.19 0.87 0.67 26 I H H 88.23 4.16 12.21 17.87 95.86 67.59 -67.42 -40.54 10.42 0.64 88.95 6.00 2.26 3.18 84.82 3.15 0.01 0.44 0.14 27 P H H 72.95 3.58 13.22 18.01 93.67 52.07 -66.09 -38.87 7.34 0.45 92.20 4.09 0.83 2.72 88.95 2.96 0.01 0.37 0.07 28 V H H 89.42 2.14 14.12 16.40 93.12 52.30 -66.13 -39.75 2.62 0.13 97.25 0.98 0.31 1.29 94.46 2.82 0.00 0.11 0.03 29 F H H 117.22 2.52 14.02 17.09 92.80 50.85 -66.29 -40.43 1.50 0.05 98.45 0.44 0.16 0.83 96.86 1.66 0.00 0.04 0.01 30 F H H 111.73 3.56 13.56 18.25 92.75 50.17 -66.06 -40.18 0.88 0.01 99.10 0.15 0.07 0.57 98.33 0.87 0.00 0.01 0.00 31 L H H 95.15 2.74 14.29 17.68 92.30 50.96 -65.37 -40.78 0.62 0.00 99.37 0.07 0.04 0.43 98.81 0.64 0.00 0.00 0.00 32 L H H 98.66 1.75 15.51 16.81 92.06 50.34 -64.89 -41.39 0.89 0.00 99.11 0.08 0.05 0.67 98.74 0.46 0.00 0.00 0.00 33 L H H 88.79 2.87 15.33 18.69 92.26 49.89 -65.69 -40.59 0.63 0.00 99.37 0.08 0.04 0.42 99.26 0.21 0.00 0.00 0.00 34 A H H 45.04 4.86 13.52 20.22 91.84 51.96 -63.65 -41.17 0.41 0.00 99.59 0.05 0.02 0.27 99.54 0.12 0.00 0.00 0.00 35 F H H 119.93 2.32 15.59 18.02 92.30 50.17 -64.88 -41.04 0.38 0.00 99.62 0.04 0.02 0.28 99.47 0.19 0.00 0.00 0.00 36 V H H 87.66 1.65 15.85 16.73 91.90 49.26 -64.40 -42.35 0.29 0.00 99.71 0.04 0.02 0.20 99.57 0.17 0.00 0.00 0.00 37 W H H 130.40 3.11 14.52 18.41 92.30 48.85 -65.25 -41.11 0.41 0.00 99.59 0.05 0.02 0.28 99.44 0.21 0.00 0.00 0.00 38 Q H H 81.37 4.56 12.38 18.66 92.14 51.18 -64.17 -40.16 1.08 0.00 98.91 0.11 0.06 0.78 98.64 0.41 0.00 0.00 0.00 39 A H H 69.92 1.72 12.55 14.60 91.85 51.53 -65.13 -36.78 3.87 0.01 96.12 0.23 0.20 3.29 95.41 0.86 0.01 0.00 0.00 40 A H H 80.52 1.53 11.60 13.36 93.08 52.54 -70.32 -26.93 13.75 0.04 86.21 0.63 0.76 12.25 85.16 1.14 0.02 0.01 0.02 41 I C H 108.67 2.96 9.55 13.91 98.29 47.63 -89.06 -5.91 54.19 0.39 45.41 2.79 5.85 44.36 44.63 1.85 0.10 0.13 0.28 42 G C T 58.69 1.30 10.76 12.60 102.47 -113.17 76.63 17.03 94.81 0.80 4.39 23.68 9.38 62.26 2.85 1.13 0.00 0.41 0.29 43 F C C 144.14 3.07 7.52 12.43 107.26 114.46 -89.51 91.52 97.07 0.96 1.97 91.63 1.47 4.45 0.85 0.62 0.00 0.51 0.47 44 R C C 165.64 2.61 11.00 15.34 110.45 115.77 -93.91 116.11 99.92 0.07 0.02 99.84 0.08 0.04 0.01 0.00 0.00 0.03 0.01