# 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 A C C 75.16 4.77 10.99 17.26 113.36 -150.50 -82.90 134.77 99.88 0.09 0.02 99.79 0.09 0.06 0.01 0.00 0.00 0.04 0.02 1 A C C 83.35 2.97 8.66 13.42 111.73 -159.30 -92.78 128.56 92.65 2.40 4.95 84.09 1.74 7.71 1.60 2.41 0.00 1.40 1.05 2 G C C 57.30 1.93 8.70 12.12 113.29 -160.92 -93.93 147.95 90.58 3.94 5.47 46.63 19.93 24.21 0.95 4.66 0.00 2.16 1.46 3 S C C 90.17 1.76 8.12 11.35 108.97 -122.80 -91.09 88.20 90.49 3.77 5.74 47.11 24.65 18.56 0.95 5.16 0.00 2.01 1.56 4 Y C C 149.83 3.28 7.42 12.48 115.22 73.23 -97.99 129.34 90.31 4.28 5.42 60.89 23.42 5.47 1.19 4.56 0.00 2.01 2.46 5 P C T 107.07 2.06 8.74 12.29 99.06 -116.86 -70.18 -13.07 91.14 1.89 6.97 36.74 14.87 39.46 1.00 6.21 0.00 1.04 0.68 6 F C T 168.48 1.31 9.09 11.21 102.88 51.25 -89.29 4.88 88.23 3.42 8.35 35.10 15.60 37.81 1.39 6.91 0.00 1.74 1.46 7 V C C 89.69 4.33 7.79 14.05 115.47 87.82 -99.58 128.95 89.83 5.86 4.31 53.78 32.62 3.12 2.00 2.12 0.00 2.14 4.22 8 P C C 85.66 2.92 10.42 14.78 114.21 -116.51 -76.51 148.81 90.91 1.60 7.49 81.02 7.17 3.05 2.85 4.27 0.00 0.86 0.79 9 P H G 97.24 3.51 9.73 14.87 102.75 -108.92 -67.32 0.75 34.45 0.66 64.89 13.71 4.89 14.28 4.47 62.10 0.00 0.39 0.16 10 S H G 83.67 2.17 10.85 14.09 97.19 68.25 -76.01 -13.88 32.74 0.44 66.82 6.33 4.76 20.27 5.16 63.07 0.00 0.25 0.15 11 W H G 160.05 3.58 10.49 15.50 99.56 59.93 -87.71 -2.44 30.76 0.63 68.61 10.92 5.78 14.29 7.35 61.08 0.00 0.34 0.24 12 A H H 57.67 4.72 10.63 17.17 97.25 88.25 -68.18 -37.99 47.03 0.57 52.39 29.59 11.89 6.59 39.56 11.82 0.01 0.24 0.30 13 P H H 80.36 3.56 11.66 16.67 94.16 52.90 -67.18 -33.39 20.19 0.35 79.46 7.83 2.82 8.48 52.23 28.30 0.02 0.21 0.13 14 S H H 70.26 2.92 12.33 16.30 94.96 54.35 -70.39 -31.41 10.86 0.19 88.95 2.39 1.28 6.00 54.43 35.73 0.01 0.12 0.05 15 V H H 93.72 2.61 12.77 16.20 94.13 53.01 -70.03 -36.25 16.29 0.22 83.48 1.81 1.74 10.79 51.18 34.21 0.05 0.13 0.09 16 F H H 115.89 3.68 13.03 17.82 95.43 49.84 -76.54 -29.94 25.22 0.28 74.50 2.74 2.78 17.93 54.54 21.56 0.13 0.14 0.17 17 V H H 76.14 4.09 12.63 18.30 92.65 60.98 -64.08 -42.43 10.80 0.14 89.06 3.56 2.42 5.21 81.74 6.90 0.03 0.07 0.07 18 P H H 78.17 2.71 14.35 17.68 92.11 49.81 -64.98 -39.13 8.12 0.11 91.77 2.14 0.86 4.89 83.91 8.09 0.02 0.06 0.04 19 L H H 99.98 2.05 15.01 17.01 92.88 48.61 -67.20 -39.82 5.49 0.10 94.40 1.07 0.65 3.60 85.91 8.63 0.03 0.07 0.03 20 T H H 73.30 2.90 14.24 17.86 92.61 48.93 -66.07 -40.73 5.10 0.08 94.82 0.97 0.70 3.45 89.72 5.06 0.03 0.05 0.03 21 G H H 35.97 3.77 13.21 18.40 93.03 50.69 -65.71 -40.19 16.19 0.07 83.75 0.97 0.92 14.42 78.42 5.13 0.05 0.04 0.04 22 L H H 106.17 1.96 14.64 16.63 93.61 47.06 -68.67 -38.26 36.67 0.07 63.25 0.87 1.68 33.94 59.51 3.84 0.06 0.03 0.06 23 V H H 89.34 1.98 15.11 16.88 94.63 46.19 -71.66 -40.56 12.45 0.04 87.52 0.59 1.24 10.61 86.37 1.12 0.04 0.01 0.02 24 L H H 92.05 2.52 14.66 17.58 92.64 50.34 -64.87 -42.20 2.89 0.00 97.11 0.81 0.40 1.39 96.95 0.45 0.00 0.00 0.00 25 P H H 70.76 3.05 14.22 18.24 92.21 50.14 -64.50 -39.93 0.82 0.00 99.17 0.21 0.06 0.42 99.03 0.27 0.00 0.00 0.00 26 A H H 61.35 2.12 15.17 17.34 92.05 50.79 -64.11 -41.50 0.10 0.00 99.90 0.01 0.00 0.05 99.83 0.10 0.00 0.00 0.00 27 I H H 101.39 1.67 16.04 17.02 92.15 49.10 -64.86 -41.57 0.05 0.00 99.95 0.00 0.00 0.03 99.94 0.03 0.00 0.00 0.00 28 A H H 55.81 2.59 14.71 17.93 91.82 49.89 -63.83 -41.90 0.06 0.00 99.94 0.00 0.00 0.04 99.94 0.02 0.00 0.00 0.00 29 M H H 102.37 2.26 15.08 17.58 91.90 49.90 -64.65 -41.14 0.10 0.00 99.90 0.01 0.00 0.06 99.91 0.02 0.00 0.00 0.00 30 A H H 59.18 2.00 14.91 16.94 91.67 50.86 -63.68 -41.54 0.19 0.00 99.81 0.01 0.00 0.14 99.82 0.03 0.00 0.00 0.00 31 T H H 77.61 1.74 15.17 16.52 91.89 49.96 -64.63 -41.06 0.40 0.00 99.60 0.03 0.01 0.29 99.62 0.05 0.00 0.00 0.00 32 L H H 90.49 2.10 14.35 16.71 91.77 50.61 -64.18 -41.42 0.31 0.00 99.69 0.02 0.01 0.21 99.68 0.07 0.00 0.00 0.00 33 F H H 114.95 1.93 13.95 16.05 91.93 50.35 -64.56 -41.37 0.37 0.00 99.63 0.04 0.02 0.24 99.58 0.12 0.00 0.00 0.00 34 V H H 82.12 1.72 13.64 15.34 91.68 50.21 -64.24 -41.87 0.49 0.00 99.50 0.06 0.03 0.33 99.39 0.18 0.00 0.00 0.00 35 Y H H 129.26 1.59 12.80 14.44 92.19 49.39 -65.15 -41.06 1.08 0.02 98.91 0.16 0.08 0.74 98.71 0.31 0.00 0.01 0.00 36 I H H 98.19 1.71 11.32 13.58 92.51 49.20 -65.82 -40.39 2.77 0.06 97.17 0.54 0.28 1.77 96.89 0.46 0.00 0.04 0.01 37 E H H 125.03 1.43 10.38 12.33 92.95 50.40 -68.30 -35.52 8.69 0.10 91.21 1.71 0.99 5.55 90.92 0.73 0.01 0.05 0.04 38 K H H 150.05 1.11 9.53 11.06 94.84 52.94 -73.35 -25.90 27.82 0.19 71.99 5.50 3.27 18.35 71.60 1.09 0.02 0.07 0.11 39 D C H 112.52 1.44 8.43 10.85 99.57 58.37 -83.88 -2.07 58.91 0.20 40.88 27.74 2.15 25.90 43.01 1.00 0.00 0.07 0.13 40 N C C 122.83 1.97 10.77 13.95 102.08 69.01 -79.71 39.70 99.92 0.01 0.07 99.65 0.11 0.18 0.05 0.00 0.00 0.01 0.00