# 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 H C C 125.06 4.69 10.87 17.30 116.01 -163.60 -97.62 130.67 99.83 0.10 0.07 99.73 0.09 0.08 0.03 0.01 0.00 0.04 0.02 1 S C C 82.46 2.47 9.06 13.11 110.11 -153.29 -90.89 112.21 87.50 0.96 11.54 79.44 1.16 7.46 9.43 1.57 0.00 0.50 0.45 2 Q C C 137.00 1.87 8.98 12.12 102.46 84.03 -82.96 -4.28 74.41 1.18 24.40 43.59 14.26 15.47 22.53 3.01 0.00 0.50 0.63 3 G C C 46.02 2.79 9.64 13.82 106.14 64.32 -68.57 -51.31 63.69 0.97 35.33 36.62 16.65 9.86 33.01 3.00 0.01 0.38 0.48 4 T H H 97.63 1.74 10.58 12.97 97.35 47.08 -71.60 -35.34 29.91 0.67 69.41 17.88 6.73 6.51 65.85 2.46 0.01 0.30 0.26 5 F H H 133.91 2.30 10.73 14.03 96.43 53.49 -71.03 -36.10 19.08 0.55 80.37 11.05 3.81 5.51 76.88 2.26 0.02 0.28 0.19 6 T H H 77.04 2.90 11.78 15.80 96.06 54.62 -68.88 -38.91 10.21 0.19 89.60 6.13 1.67 2.88 87.50 1.66 0.00 0.10 0.06 7 S H H 65.79 2.07 13.07 15.49 94.52 52.26 -67.38 -39.60 6.62 0.08 93.30 3.23 1.06 2.52 91.92 1.20 0.00 0.04 0.03 8 D H H 87.50 1.97 13.36 15.58 93.23 51.55 -66.50 -39.77 5.36 0.06 94.58 2.24 0.79 2.42 93.56 0.93 0.00 0.03 0.03 9 Y H H 129.72 2.19 13.11 15.84 92.72 50.73 -65.66 -40.56 2.58 0.02 97.40 0.97 0.36 1.20 96.95 0.50 0.00 0.01 0.01 10 S H H 60.52 2.23 13.67 16.39 92.27 52.07 -64.77 -40.94 1.39 0.01 98.60 0.55 0.16 0.60 98.42 0.26 0.00 0.00 0.00 11 K H H 128.31 1.45 14.77 15.65 92.36 50.31 -65.25 -40.57 1.25 0.01 98.75 0.31 0.13 0.70 98.60 0.26 0.00 0.00 0.00 12 Y H H 131.42 1.75 14.38 15.98 92.21 49.69 -65.16 -41.37 1.24 0.01 98.76 0.28 0.12 0.71 98.64 0.25 0.00 0.00 0.00 13 L H H 89.80 2.14 14.14 16.59 91.99 49.67 -64.78 -41.10 1.17 0.00 98.82 0.30 0.13 0.60 98.80 0.17 0.00 0.00 0.00 14 D H H 84.27 1.90 14.74 16.62 91.88 50.56 -64.51 -40.61 1.53 0.00 98.47 0.37 0.14 0.80 98.53 0.15 0.00 0.00 0.00 15 S H H 62.58 1.92 14.74 16.60 91.89 50.76 -65.12 -40.47 1.73 0.00 98.27 0.37 0.16 0.92 98.38 0.16 0.00 0.00 0.00 16 R H H 138.38 1.79 14.98 16.54 92.25 50.51 -65.35 -40.47 1.26 0.00 98.74 0.26 0.11 0.67 98.82 0.13 0.00 0.00 0.00 17 R H H 136.33 1.75 14.91 16.46 92.16 50.44 -64.96 -40.98 0.81 0.00 99.18 0.17 0.07 0.41 99.25 0.10 0.00 0.00 0.00 18 A H H 58.29 1.97 14.46 16.52 91.90 50.18 -64.14 -40.89 0.55 0.00 99.45 0.11 0.04 0.28 99.50 0.08 0.00 0.00 0.00 19 Q H H 104.27 1.76 14.76 16.33 91.82 50.48 -64.89 -40.55 0.35 0.00 99.65 0.05 0.02 0.19 99.70 0.05 0.00 0.00 0.00 20 D H H 81.31 1.94 14.32 16.24 91.95 50.73 -64.74 -40.79 0.30 0.00 99.70 0.04 0.02 0.17 99.73 0.05 0.00 0.00 0.00 21 F H H 120.64 1.51 14.10 15.19 91.93 49.89 -64.52 -41.71 0.24 0.00 99.76 0.03 0.01 0.14 99.76 0.06 0.00 0.00 0.00 22 V H H 84.09 1.66 13.33 14.99 91.87 49.72 -64.67 -41.35 0.25 0.00 99.75 0.03 0.01 0.16 99.70 0.09 0.00 0.00 0.00 23 Q H H 104.08 1.56 12.67 14.34 91.77 50.56 -64.26 -40.79 0.68 0.00 99.32 0.07 0.03 0.50 99.00 0.39 0.00 0.00 0.00 24 W H H 155.65 1.40 11.51 13.10 91.98 50.63 -65.35 -40.16 1.86 0.00 98.13 0.14 0.09 1.50 97.50 0.77 0.00 0.00 0.00 25 L H H 116.45 1.20 10.38 11.84 92.43 50.51 -67.35 -36.40 5.48 0.01 94.51 0.41 0.32 4.34 94.13 0.80 0.00 0.00 0.00 26 M H H 137.34 1.12 9.22 10.79 94.43 50.58 -74.54 -22.10 23.96 0.10 75.94 3.21 2.36 17.55 75.82 0.94 0.02 0.03 0.07 27 N C H 125.49 1.20 9.02 10.97 99.74 53.12 -85.79 11.45 65.48 0.25 34.27 27.97 1.82 31.59 37.49 0.89 0.00 0.08 0.16 28 T C C 93.76 3.18 9.76 14.40 106.15 115.74 -86.82 57.03 99.95 0.01 0.04 99.76 0.10 0.11 0.02 0.00 0.00 0.01 0.00