# 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 F C C 112.47 5.50 11.68 18.45 107.38 -158.31 -87.14 107.39 99.48 0.15 0.37 99.40 0.08 0.11 0.31 0.01 0.00 0.05 0.04 1 Y C C 152.34 2.20 10.10 13.40 98.02 141.55 -72.43 -35.20 56.98 1.38 41.64 45.67 1.50 8.64 41.00 1.92 0.00 0.68 0.58 2 F H H 152.00 1.21 9.54 11.19 95.75 53.00 -69.46 -36.12 36.23 1.19 62.57 19.31 6.28 11.74 59.20 2.37 0.03 0.59 0.49 3 M H H 122.88 1.46 10.15 12.13 94.70 51.94 -68.43 -37.56 17.83 0.47 81.70 8.97 3.53 6.39 78.09 2.57 0.02 0.27 0.16 4 N H H 95.14 2.17 10.65 13.82 95.53 51.28 -70.16 -36.13 14.08 0.39 85.53 8.71 2.20 4.14 82.33 2.27 0.01 0.22 0.12 5 Q H H 107.49 2.25 11.24 14.40 95.14 56.69 -68.46 -37.47 5.94 0.21 93.86 3.12 0.99 2.27 91.93 1.49 0.01 0.14 0.05 6 L H H 97.03 2.15 12.25 15.01 94.64 54.02 -67.60 -40.75 3.83 0.18 95.99 1.93 0.60 1.60 94.75 0.95 0.01 0.12 0.04 7 T H H 79.05 2.05 13.30 15.60 94.54 51.27 -67.02 -41.31 2.52 0.14 97.34 1.14 0.32 1.16 96.61 0.64 0.00 0.10 0.02 8 Y H H 135.15 1.94 13.50 15.57 93.65 50.20 -66.25 -40.78 1.47 0.06 98.47 0.49 0.15 0.76 97.93 0.60 0.00 0.05 0.01 9 G H H 36.37 2.55 12.71 16.24 92.63 51.91 -64.78 -41.33 1.65 0.03 98.33 0.37 0.14 0.98 97.84 0.64 0.00 0.02 0.00 10 F H H 126.98 1.65 13.71 15.28 92.77 49.87 -65.63 -40.73 2.15 0.03 97.82 0.32 0.15 1.45 97.31 0.74 0.00 0.02 0.01 11 L H H 98.33 1.72 13.77 15.44 92.63 50.74 -65.19 -41.26 3.50 0.02 96.48 0.37 0.21 2.53 96.32 0.54 0.00 0.01 0.01 12 L H H 95.17 2.00 13.53 15.83 92.59 50.53 -65.31 -40.88 1.87 0.00 98.12 0.23 0.12 1.23 98.23 0.20 0.00 0.00 0.00 13 M H H 107.36 1.85 14.02 15.93 92.19 50.89 -64.73 -41.42 0.36 0.00 99.64 0.06 0.02 0.18 99.66 0.07 0.00 0.00 0.00 14 I H H 95.82 1.95 14.44 16.44 92.05 49.84 -64.83 -41.31 0.19 0.00 99.81 0.03 0.01 0.11 99.80 0.05 0.00 0.00 0.00 15 T H H 75.55 2.13 14.45 16.76 92.20 50.10 -64.91 -41.21 0.12 0.00 99.88 0.01 0.00 0.06 99.89 0.03 0.00 0.00 0.00 16 L H H 93.85 2.08 14.45 16.72 91.98 50.14 -64.72 -41.32 0.10 0.00 99.90 0.01 0.00 0.06 99.91 0.02 0.00 0.00 0.00 17 L H H 93.97 1.98 14.68 16.68 91.84 50.25 -64.54 -41.66 0.11 0.00 99.89 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 18 I H H 94.60 2.09 14.62 16.88 92.09 49.07 -64.52 -41.74 0.20 0.00 99.80 0.01 0.01 0.14 99.80 0.04 0.00 0.00 0.00 19 L H H 87.45 2.36 14.37 17.14 92.09 49.33 -64.12 -41.65 0.41 0.00 99.59 0.04 0.02 0.29 99.56 0.09 0.00 0.00 0.00 20 F H H 116.05 2.15 14.08 16.58 92.23 48.85 -65.44 -40.35 0.95 0.00 99.04 0.08 0.06 0.73 98.90 0.23 0.00 0.00 0.00 21 S H H 61.32 2.58 13.32 16.71 92.90 49.94 -66.73 -38.99 2.61 0.00 97.39 0.11 0.13 2.31 96.99 0.45 0.01 0.00 0.00 22 Q H H 117.75 1.74 14.31 15.96 96.07 41.77 -76.43 -37.23 8.11 0.00 91.88 0.10 0.27 8.25 90.79 0.57 0.02 0.00 0.00 23 F C T 123.76 2.38 14.12 16.73 100.79 35.47 -89.01 -37.54 51.99 0.03 47.98 0.31 1.55 49.21 47.91 0.96 0.02 0.01 0.03 24 F H H 107.55 3.20 13.84 17.96 96.54 42.54 -76.42 -39.85 24.86 0.03 75.11 0.66 1.71 22.50 74.01 1.05 0.03 0.01 0.03 25 L H H 85.35 2.83 14.11 17.82 92.20 53.75 -63.89 -42.06 4.48 0.01 95.51 1.16 0.61 2.53 93.00 2.68 0.00 0.00 0.00 26 P H H 70.75 2.44 14.87 17.82 91.84 50.24 -64.14 -39.79 3.20 0.01 96.79 0.93 0.24 1.82 94.56 2.44 0.00 0.00 0.00 27 M H H 98.65 2.77 14.75 18.01 92.53 50.76 -65.70 -40.13 1.27 0.01 98.73 0.30 0.11 0.73 96.70 2.15 0.00 0.00 0.00 28 I H H 93.03 2.73 14.78 18.01 92.41 50.34 -64.88 -41.48 0.86 0.01 99.13 0.24 0.09 0.45 98.83 0.39 0.00 0.00 0.00 29 L H H 94.02 1.93 14.80 16.69 92.10 50.12 -64.56 -41.34 0.59 0.00 99.41 0.14 0.04 0.30 99.34 0.17 0.00 0.00 0.00 30 R H H 140.74 1.86 14.67 16.62 92.27 50.40 -64.70 -40.78 0.51 0.00 99.49 0.09 0.03 0.29 99.45 0.13 0.00 0.00 0.00 31 L H H 88.47 2.76 14.26 17.62 92.03 49.90 -64.85 -41.22 0.41 0.00 99.59 0.06 0.02 0.24 99.57 0.10 0.00 0.00 0.00 32 Y H H 130.70 2.09 14.83 17.02 92.16 50.20 -64.79 -41.25 0.57 0.00 99.43 0.10 0.04 0.32 99.39 0.15 0.00 0.00 0.00 33 V H H 79.94 2.04 14.48 16.68 91.95 49.81 -64.74 -41.40 0.93 0.00 99.07 0.17 0.06 0.54 98.99 0.22 0.00 0.00 0.00 34 S H H 55.83 2.39 13.34 16.50 91.89 50.81 -63.93 -40.88 1.52 0.01 98.46 0.32 0.12 0.90 98.22 0.44 0.00 0.01 0.00 35 R H H 133.69 2.03 13.00 15.51 92.60 51.18 -65.72 -39.39 2.74 0.02 97.24 0.47 0.22 1.81 96.48 1.00 0.00 0.01 0.00 36 L H H 99.09 1.84 11.93 14.33 92.67 51.07 -66.24 -39.33 4.88 0.03 95.09 0.84 0.44 3.28 93.89 1.52 0.01 0.02 0.01 37 F H H 142.30 1.42 10.87 12.70 94.22 50.41 -69.66 -35.51 11.03 0.10 88.87 2.30 1.25 7.24 87.32 1.79 0.01 0.04 0.04 38 I H H 127.35 1.41 9.39 11.45 96.00 51.09 -76.58 -25.46 25.53 0.41 74.07 6.88 3.64 15.19 72.33 1.55 0.04 0.16 0.21 39 S C H 83.35 1.79 8.34 11.40 100.57 57.90 -82.74 -5.30 56.21 0.47 43.32 30.80 1.66 21.04 44.90 1.15 0.00 0.17 0.28 40 K C C 153.79 2.01 10.80 14.18 103.18 132.40 -78.05 50.29 99.97 0.01 0.02 99.88 0.04 0.05 0.02 0.00 0.00 0.00 0.00