# 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 K C C 125.69 3.98 12.14 17.33 106.50 -133.55 -80.89 95.02 99.68 0.02 0.30 99.50 0.11 0.11 0.27 0.01 0.00 0.01 0.00 1 D H H 93.00 2.81 10.42 14.38 101.48 78.90 -75.03 -28.81 37.91 0.10 61.99 32.59 0.97 3.99 61.09 1.29 0.00 0.03 0.04 2 E H H 132.96 1.44 10.57 12.51 94.32 58.91 -65.99 -37.04 10.03 0.05 89.92 4.75 1.46 3.77 88.03 1.94 0.00 0.02 0.02 3 Q H H 110.47 1.58 11.72 13.63 92.77 52.09 -66.15 -39.11 5.22 0.04 94.73 2.50 0.76 2.06 92.62 2.02 0.00 0.02 0.01 4 L H H 78.80 2.89 11.34 15.71 92.27 51.02 -65.02 -40.50 2.78 0.03 97.19 1.33 0.42 1.08 95.74 1.40 0.00 0.02 0.01 5 Q H H 99.11 2.16 12.94 15.74 92.09 51.12 -64.67 -40.13 2.57 0.03 97.40 1.09 0.34 1.12 96.50 0.93 0.00 0.02 0.01 6 Q H H 102.18 1.65 13.46 15.11 91.91 50.63 -65.00 -39.97 3.30 0.03 96.67 1.19 0.39 1.61 95.82 0.96 0.00 0.02 0.01 7 R H H 131.34 1.91 13.43 15.62 92.18 50.88 -65.38 -39.77 4.52 0.05 95.42 1.63 0.58 2.25 94.40 1.09 0.01 0.02 0.02 8 R H H 131.57 2.36 13.11 16.17 92.51 50.38 -65.72 -39.37 6.81 0.08 93.12 2.41 0.93 3.48 91.69 1.40 0.01 0.04 0.03 9 A H H 62.94 2.42 12.52 15.84 92.86 51.74 -65.85 -37.23 12.71 0.10 87.18 3.85 1.75 7.08 85.13 2.08 0.02 0.05 0.05 10 N H H 110.26 1.69 12.89 14.79 94.95 51.47 -74.34 -23.93 27.68 0.21 72.11 8.11 3.99 15.81 69.09 2.77 0.03 0.09 0.12 11 Q H H 114.68 3.01 11.59 15.91 99.39 65.26 -76.84 -19.18 45.64 0.55 53.81 20.08 8.37 17.81 49.75 3.45 0.02 0.22 0.29 12 R C H 146.28 3.00 12.11 16.40 101.65 70.20 -79.20 -12.48 56.82 0.93 42.25 36.80 7.74 11.55 39.96 3.08 0.01 0.40 0.46 13 L C H 98.59 3.47 12.54 17.22 98.98 67.66 -73.57 -34.35 57.47 0.61 41.91 40.00 6.56 8.75 42.12 2.03 0.00 0.25 0.29 14 G H H 37.55 3.85 14.18 19.02 99.34 48.53 -53.64 -46.06 42.65 0.29 57.06 28.07 6.00 7.50 56.38 1.81 0.00 0.10 0.14 15 A H H 61.26 4.20 13.33 18.68 94.18 46.13 -66.40 -38.69 10.18 0.10 89.72 5.22 1.85 3.47 87.71 1.67 0.00 0.04 0.04 16 E H H 120.26 1.90 15.60 17.33 93.00 53.17 -65.80 -39.53 6.47 0.11 93.42 3.58 0.96 2.30 91.58 1.48 0.00 0.06 0.03 17 V H H 73.31 2.98 15.59 19.11 92.36 50.07 -65.10 -41.82 4.12 0.08 95.80 2.29 0.59 1.46 94.62 0.98 0.00 0.04 0.02 18 M H H 80.73 5.24 15.16 21.76 92.18 49.96 -64.66 -41.25 2.79 0.03 97.17 1.47 0.36 1.01 96.62 0.52 0.00 0.02 0.01 19 S H H 48.83 4.45 15.50 21.25 91.62 51.10 -63.78 -41.08 2.39 0.02 97.60 0.98 0.25 1.03 97.33 0.39 0.00 0.01 0.01 20 Q H H 100.80 1.92 17.86 18.90 91.82 50.14 -64.70 -40.83 1.66 0.01 98.32 0.56 0.18 0.81 98.10 0.34 0.00 0.00 0.00 21 R H H 121.42 3.02 16.95 20.34 92.09 50.41 -64.93 -41.21 1.68 0.01 98.31 0.48 0.16 0.91 98.08 0.36 0.00 0.00 0.00 22 I H H 67.56 6.87 14.31 22.81 92.07 50.16 -64.44 -42.00 1.50 0.01 98.49 0.45 0.15 0.78 98.20 0.40 0.00 0.00 0.00 23 R H H 134.84 2.54 16.57 19.40 91.72 50.83 -64.03 -40.89 2.44 0.02 97.54 0.67 0.25 1.36 97.07 0.63 0.00 0.01 0.00 24 E H H 109.03 1.57 16.96 17.44 92.05 49.66 -64.92 -40.40 6.03 0.03 93.94 1.08 0.58 4.11 93.05 1.13 0.02 0.01 0.02 25 M H H 77.79 4.45 13.49 19.56 92.79 49.71 -66.57 -39.04 8.78 0.06 91.16 1.92 1.10 5.58 89.20 2.12 0.02 0.03 0.03 26 S H H 49.63 6.47 11.03 19.27 92.82 54.41 -67.07 -34.09 16.04 0.10 83.86 3.11 1.63 11.03 80.24 3.84 0.04 0.05 0.06 27 D H H 113.85 1.33 13.84 14.92 94.60 50.79 -77.66 -17.67 33.85 0.04 66.10 1.33 2.01 30.00 63.54 3.05 0.03 0.01 0.03 28 N H H 125.12 1.25 13.50 14.37 99.51 35.37 -91.39 -11.12 43.56 0.08 56.36 1.94 6.25 34.74 54.60 2.31 0.05 0.03 0.08 29 D C C 72.41 4.56 11.22 17.54 111.65 32.76 -126.83 89.43 99.56 0.13 0.31 95.64 3.76 0.16 0.27 0.03 0.00 0.03 0.11 30 P H H 81.91 5.64 10.97 18.90 93.04 -166.84 -62.28 -32.99 3.80 0.00 96.19 1.03 0.31 2.11 95.91 0.63 0.00 0.00 0.00 31 R H H 165.11 1.22 15.94 16.47 91.82 55.39 -64.60 -39.88 1.28 0.00 98.72 0.16 0.08 0.91 98.38 0.46 0.00 0.00 0.00 32 V H H 65.37 4.31 15.74 21.17 92.07 49.11 -65.06 -41.80 0.26 0.00 99.74 0.05 0.02 0.13 99.55 0.24 0.00 0.00 0.00 33 V H H 44.82 8.46 13.88 24.27 91.79 50.35 -63.08 -42.44 0.09 0.00 99.91 0.01 0.00 0.04 99.89 0.05 0.00 0.00 0.00 34 A H H 48.09 3.72 16.83 21.54 91.24 50.84 -63.01 -41.53 0.06 0.00 99.94 0.01 0.00 0.03 99.95 0.01 0.00 0.00 0.00 35 L H H 85.39 2.49 18.10 20.21 91.55 50.12 -64.40 -41.78 0.04 0.00 99.96 0.00 0.00 0.02 99.96 0.01 0.00 0.00 0.00 36 V H H 56.60 6.09 15.80 23.48 91.69 50.13 -64.04 -42.69 0.05 0.00 99.95 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 37 I H H 76.16 5.72 15.60 22.50 91.76 49.39 -64.10 -41.77 0.10 0.00 99.90 0.01 0.00 0.06 99.90 0.02 0.00 0.00 0.00 38 R H H 133.58 2.22 16.13 18.39 91.62 50.39 -64.39 -40.65 0.35 0.00 99.65 0.02 0.01 0.25 99.61 0.10 0.00 0.00 0.00 39 Q H H 100.56 2.44 15.02 17.81 92.03 50.26 -65.00 -39.81 1.89 0.00 98.11 0.10 0.07 1.56 97.91 0.35 0.00 0.00 0.00 40 W H H 129.85 4.26 12.59 18.15 92.75 49.95 -66.65 -38.92 5.59 0.01 94.40 0.55 0.40 4.25 94.12 0.66 0.00 0.00 0.00 41 M H H 113.22 2.82 12.10 15.86 94.30 50.36 -72.65 -28.32 18.68 0.17 81.15 4.09 2.76 11.79 80.11 1.06 0.03 0.06 0.10 42 S H H 74.55 2.32 10.84 14.17 99.16 58.46 -81.59 -9.87 47.81 0.53 51.67 14.34 7.98 25.47 49.99 1.69 0.03 0.18 0.31 43 N C C 103.07 3.54 8.70 13.94 106.33 85.26 -88.35 72.48 67.70 0.75 31.55 30.36 15.96 21.82 26.87 4.23 0.01 0.28 0.48 44 D C C 113.13 2.03 8.66 12.20 103.04 159.67 -84.27 12.48 76.66 0.72 22.62 38.58 15.83 22.66 16.49 5.66 0.00 0.29 0.48 45 H C C 138.23 2.76 7.48 12.04 107.80 103.60 -88.37 84.86 86.35 0.45 13.20 66.95 3.73 16.44 9.01 3.33 0.00 0.22 0.31 46 E C C 143.46 2.23 10.75 14.47 108.85 -144.58 -85.64 113.62 99.87 0.03 0.11 99.64 0.14 0.15 0.04 0.01 0.00 0.01 0.01