# 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 Q C C 114.20 2.88 13.26 16.78 100.52 60.55 -75.34 29.68 99.19 0.06 0.74 98.95 0.13 0.19 0.67 0.02 0.00 0.02 0.02 1 I H H 101.75 2.70 10.02 14.12 94.70 96.28 -66.40 -38.80 26.71 0.14 73.15 24.15 0.81 2.83 70.42 1.68 0.00 0.06 0.05 2 L H H 105.38 1.73 11.03 13.41 93.19 53.05 -65.55 -39.35 10.67 0.11 89.22 7.12 1.26 2.75 86.64 2.14 0.00 0.05 0.03 3 K H H 125.10 1.56 12.12 13.93 92.62 50.82 -65.48 -39.31 5.45 0.08 94.47 3.24 0.74 1.77 91.83 2.36 0.00 0.05 0.02 4 E H H 112.21 1.64 12.92 14.68 92.24 50.90 -65.51 -39.71 4.15 0.05 95.80 2.23 0.54 1.49 94.12 1.58 0.00 0.03 0.02 5 L H H 95.22 1.75 13.21 15.10 92.06 50.10 -65.14 -40.50 3.91 0.04 96.05 2.01 0.52 1.41 95.21 0.82 0.00 0.02 0.01 6 E H H 110.96 1.72 14.04 15.68 91.99 50.33 -64.85 -41.01 3.39 0.03 96.58 1.68 0.42 1.24 96.12 0.51 0.00 0.01 0.01 7 E H H 106.66 1.93 14.23 16.27 91.94 50.15 -65.05 -40.62 3.20 0.02 96.78 1.26 0.38 1.39 96.52 0.44 0.00 0.00 0.01 8 S H H 57.24 2.00 14.43 16.59 91.87 50.75 -64.58 -40.75 3.65 0.01 96.34 1.44 0.45 1.60 96.04 0.45 0.00 0.00 0.01 9 S H H 59.52 1.87 14.70 16.46 91.73 50.76 -64.35 -40.79 3.59 0.01 96.40 1.09 0.36 1.84 96.30 0.39 0.00 0.00 0.01 10 F H H 117.59 2.04 14.23 16.49 92.12 50.20 -65.25 -40.70 2.75 0.01 97.24 0.92 0.30 1.40 97.00 0.37 0.00 0.00 0.01 11 R H H 135.94 2.10 14.44 16.92 91.86 51.58 -64.19 -41.01 0.84 0.00 99.16 0.27 0.07 0.39 99.12 0.14 0.00 0.00 0.00 12 K H H 124.32 1.51 15.50 16.37 92.01 50.09 -64.97 -40.97 0.69 0.00 99.31 0.18 0.06 0.37 99.26 0.13 0.00 0.00 0.00 13 T H H 75.77 1.87 15.17 16.79 91.96 49.54 -64.81 -41.46 0.59 0.00 99.41 0.13 0.05 0.32 99.39 0.10 0.00 0.00 0.00 14 F H H 107.96 2.57 14.29 17.50 91.99 49.47 -64.47 -41.43 0.50 0.00 99.50 0.09 0.03 0.30 99.44 0.14 0.00 0.00 0.00 15 E H H 99.65 2.49 14.50 17.58 91.62 50.68 -63.83 -41.11 0.50 0.00 99.50 0.06 0.03 0.33 99.39 0.18 0.00 0.00 0.00 16 D H H 84.27 1.70 14.97 16.32 91.97 49.80 -64.81 -40.30 0.93 0.00 99.06 0.11 0.06 0.66 98.90 0.27 0.00 0.00 0.00 17 Y H H 128.83 1.99 13.87 16.09 92.25 49.92 -65.59 -41.06 1.89 0.01 98.10 0.18 0.13 1.47 97.65 0.57 0.00 0.00 0.00 18 L H H 92.51 2.73 12.74 16.45 92.63 48.92 -66.23 -39.88 4.60 0.02 95.37 0.49 0.42 3.64 94.31 1.12 0.01 0.01 0.01 19 H H H 122.03 1.91 12.60 14.99 93.05 48.41 -69.10 -33.86 16.04 0.07 83.89 1.24 1.30 13.65 81.38 2.30 0.05 0.03 0.04 20 N H H 105.88 1.57 12.35 14.02 95.94 46.28 -79.25 -27.55 34.35 0.20 65.45 3.51 3.38 27.40 61.61 3.79 0.07 0.08 0.13 21 V C H 93.48 2.51 11.14 14.64 99.21 48.87 -84.08 -31.58 49.51 1.46 49.04 9.37 8.99 31.43 38.80 9.55 0.32 0.72 0.81 22 V C T 104.16 2.21 10.23 13.50 98.56 51.57 -79.47 -27.86 61.35 3.26 35.38 12.25 11.75 37.24 24.39 10.73 0.36 1.81 1.47 23 F C T 157.38 1.62 9.81 12.28 102.06 46.15 -94.62 13.61 66.13 8.21 25.66 23.00 12.80 32.06 14.67 9.46 0.29 4.77 2.95 24 V C C 98.63 2.98 8.37 13.34 114.03 113.84 -92.00 126.03 92.97 6.37 0.66 51.22 41.79 0.96 0.43 0.24 0.00 3.81 1.55 25 P C C 104.19 2.10 9.24 13.11 113.73 -116.00 -68.10 144.78 92.75 6.85 0.41 87.38 4.84 0.73 0.17 0.20 0.00 4.80 1.87 26 R C C 169.06 2.43 7.51 12.08 116.21 -129.83 -93.10 135.97 96.19 3.63 0.18 85.67 10.21 0.41 0.07 0.10 0.00 1.81 1.73 27 P C C 107.60 1.87 7.73 11.34 112.87 -105.02 -67.85 147.76 98.23 1.26 0.50 87.36 7.73 3.16 0.13 0.35 0.00 0.71 0.56 28 S C C 93.73 1.41 7.13 10.10 109.59 -120.25 -84.90 134.42 98.94 0.62 0.45 94.31 1.76 3.02 0.11 0.22 0.00 0.28 0.30 29 R C C 186.06 1.38 9.38 11.87 105.52 -132.12 -84.37 33.14 99.93 0.05 0.02 99.74 0.15 0.07 0.00 0.00 0.00 0.02 0.01