# 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 117.37 4.60 10.54 16.77 110.13 -144.17 -85.36 122.57 99.86 0.03 0.11 99.73 0.09 0.09 0.06 0.01 0.00 0.01 0.01 1 K C C 135.75 2.99 9.46 14.12 110.53 -163.15 -86.85 122.33 80.03 0.61 19.36 72.05 1.33 5.48 19.43 1.12 0.00 0.23 0.36 2 D C C 96.41 2.33 9.44 12.97 106.92 -122.96 -80.59 116.11 65.46 0.85 33.69 50.18 6.60 6.71 33.78 1.91 0.00 0.31 0.52 3 F H H 140.37 2.65 9.04 13.14 94.35 -80.45 -65.82 -34.83 11.23 0.13 88.65 4.79 2.00 4.85 84.15 4.06 0.02 0.06 0.06 4 T H H 89.81 1.79 11.35 13.80 92.74 54.38 -66.49 -38.59 7.01 0.08 92.91 2.04 1.06 3.97 87.48 5.35 0.02 0.05 0.03 5 T H H 75.82 2.27 11.94 15.02 93.19 49.56 -67.22 -39.68 5.73 0.08 94.18 1.53 0.88 3.41 87.94 6.12 0.02 0.05 0.03 6 Y H H 122.75 3.60 11.45 16.44 93.43 49.56 -67.56 -38.95 6.06 0.08 93.86 1.61 0.92 3.57 87.66 6.13 0.03 0.04 0.03 7 L H H 97.83 3.47 12.03 16.85 93.84 50.39 -71.51 -30.42 14.82 0.15 85.03 2.63 1.63 10.38 76.40 8.75 0.05 0.08 0.08 8 S H H 72.74 2.68 13.01 16.55 95.04 56.42 -79.78 -15.76 42.17 0.18 57.65 3.77 3.57 34.41 50.68 7.29 0.07 0.08 0.14 9 T C T 74.73 4.40 11.61 17.57 105.83 71.99 -88.52 18.01 60.43 0.55 39.03 10.64 13.86 36.38 32.84 5.54 0.06 0.19 0.48 10 A H H 60.97 3.96 11.63 17.08 106.57 88.51 -71.11 134.98 43.34 0.29 56.37 15.54 21.08 5.96 55.93 1.25 0.01 0.07 0.16 11 P H H 88.50 2.61 12.87 16.21 94.01 39.33 -65.33 -34.91 12.06 0.07 87.87 3.54 1.87 6.41 86.69 1.40 0.01 0.03 0.04 12 V H H 86.72 2.40 13.48 16.33 93.49 51.22 -66.34 -40.44 4.20 0.07 95.73 1.45 0.50 2.13 94.76 1.09 0.01 0.04 0.02 13 I H H 85.13 3.38 13.33 17.93 92.68 49.85 -65.47 -40.96 1.00 0.01 98.99 0.40 0.11 0.41 98.63 0.44 0.00 0.00 0.00 14 A H H 51.72 3.67 13.06 18.29 92.22 51.25 -64.22 -40.68 0.45 0.00 99.54 0.15 0.03 0.20 99.46 0.15 0.00 0.00 0.00 15 T H H 77.39 2.06 14.94 17.02 92.32 50.38 -65.17 -40.88 0.25 0.00 99.74 0.06 0.02 0.13 99.69 0.09 0.00 0.00 0.00 16 I H H 96.82 1.90 14.88 16.64 92.26 49.71 -64.94 -41.52 0.20 0.00 99.80 0.04 0.01 0.11 99.76 0.07 0.00 0.00 0.00 17 W H H 135.89 2.82 14.08 17.75 92.14 49.45 -65.24 -41.01 0.30 0.01 99.70 0.07 0.02 0.17 99.66 0.07 0.00 0.00 0.00 18 F H H 116.30 2.62 14.10 17.49 92.10 50.34 -64.75 -40.93 0.41 0.01 99.58 0.10 0.04 0.24 99.55 0.06 0.00 0.01 0.00 19 T H H 83.62 1.66 15.05 16.25 92.37 49.94 -65.28 -41.05 0.59 0.01 99.40 0.18 0.05 0.33 99.35 0.08 0.00 0.01 0.00 20 F H H 125.57 1.80 15.16 16.68 92.58 48.50 -65.57 -41.23 0.65 0.01 99.34 0.13 0.05 0.42 99.29 0.10 0.00 0.01 0.00 21 T H H 71.27 2.96 14.87 18.51 92.55 48.58 -65.50 -41.04 1.04 0.01 98.94 0.14 0.08 0.74 98.89 0.13 0.00 0.01 0.00 22 A H H 55.91 2.58 14.92 18.04 91.98 50.93 -64.01 -40.87 0.77 0.00 99.23 0.11 0.06 0.48 99.27 0.09 0.00 0.00 0.00 23 G H H 35.68 2.41 14.85 17.74 92.05 51.23 -63.55 -41.09 0.63 0.00 99.37 0.09 0.04 0.38 99.41 0.08 0.00 0.00 0.00 24 L H H 91.36 2.48 15.16 17.93 92.22 50.20 -65.15 -40.94 0.42 0.00 99.58 0.05 0.02 0.26 99.60 0.08 0.00 0.00 0.00 25 L H H 91.40 2.67 14.79 18.08 92.23 50.43 -64.89 -40.98 0.31 0.00 99.69 0.04 0.01 0.19 99.68 0.08 0.00 0.00 0.00 26 I H H 92.57 2.17 14.79 17.07 92.09 50.11 -64.53 -41.47 0.31 0.00 99.69 0.03 0.01 0.20 99.66 0.09 0.00 0.00 0.00 27 E H H 101.03 2.14 14.42 16.82 92.09 50.41 -64.32 -41.07 0.58 0.00 99.42 0.05 0.03 0.41 99.29 0.22 0.00 0.00 0.00 28 I H H 85.20 3.16 12.96 17.19 92.28 50.01 -64.91 -40.27 0.77 0.00 99.23 0.06 0.04 0.58 98.70 0.61 0.00 0.00 0.00 29 N H H 85.31 3.93 11.41 16.91 92.25 52.18 -68.22 -32.00 2.93 0.00 97.06 0.15 0.11 2.57 95.10 2.06 0.00 0.00 0.00 30 R H H 164.74 1.28 12.26 13.58 94.16 51.10 -73.08 -33.02 10.74 0.01 89.26 0.19 0.33 10.71 87.09 1.66 0.01 0.00 0.00 31 Y H H 172.55 1.07 11.89 12.50 98.98 37.03 -92.12 -25.05 16.17 0.03 83.80 0.38 1.36 14.74 82.54 0.90 0.04 0.01 0.02 32 F C S 118.04 3.48 8.47 13.70 111.75 38.10 -123.38 91.06 98.55 0.76 0.69 37.29 60.37 0.87 0.61 0.10 0.00 0.18 0.58 33 P C C 101.86 2.26 9.04 13.04 103.95 -162.13 -68.76 -2.80 96.89 0.63 2.48 38.92 27.19 30.79 0.58 1.89 0.00 0.30 0.34 34 D C C 112.53 1.79 10.12 13.04 107.69 30.21 -94.93 89.40 91.06 1.34 7.60 38.13 27.63 25.29 1.94 5.55 0.00 0.55 0.91 35 P C C 86.17 4.81 7.79 14.47 108.64 -164.12 -75.30 124.46 70.35 0.92 28.73 36.24 9.88 22.16 3.41 27.41 0.00 0.45 0.44 36 L C T 128.55 1.94 9.01 12.34 103.26 -145.70 -85.41 -1.07 68.19 1.37 30.44 20.12 15.37 32.51 3.52 27.15 0.00 0.72 0.61 37 V C G 112.65 2.07 8.44 12.03 114.82 63.02 -103.38 120.40 62.33 5.96 31.71 22.52 17.26 23.82 4.01 26.65 0.02 2.28 3.43 38 F C C 140.02 3.26 6.88 12.08 116.78 -156.06 -104.72 130.98 86.87 4.38 8.75 47.32 32.61 6.92 2.01 6.79 0.00 2.39 1.96 39 S C C 92.73 1.24 8.51 10.97 111.32 -134.46 -85.48 132.22 97.12 1.38 1.50 92.57 2.04 2.94 0.39 0.75 0.00 0.84 0.47 40 F C C 153.30 3.26 9.17 14.26 108.37 -138.38 -89.47 92.49 99.95 0.04 0.01 99.82 0.11 0.04 0.00 0.00 0.00 0.02 0.01