# 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 M C C 99.77 5.47 12.70 19.40 103.46 60.65 -78.28 -11.82 99.71 0.02 0.26 99.60 0.08 0.09 0.21 0.01 0.00 0.01 0.01 1 E H H 119.29 2.68 12.07 15.71 96.24 60.79 -68.65 -36.58 33.61 0.19 66.20 29.30 0.92 3.74 64.44 1.45 0.00 0.07 0.09 2 E H H 113.60 3.54 11.48 16.37 93.78 55.26 -66.13 -38.93 11.62 0.10 88.28 6.24 1.70 3.86 86.06 2.04 0.00 0.05 0.05 3 E H H 109.88 2.92 13.40 17.35 92.79 51.63 -65.96 -39.75 6.41 0.08 93.51 3.43 0.88 2.30 91.14 2.18 0.00 0.04 0.03 4 R H H 126.11 3.14 15.23 18.97 92.35 50.56 -65.68 -40.36 4.59 0.06 95.35 2.44 0.63 1.67 93.54 1.67 0.00 0.03 0.02 5 R H H 105.00 7.09 16.15 24.27 92.17 50.69 -65.04 -40.64 3.60 0.04 96.35 1.75 0.47 1.41 95.53 0.82 0.00 0.02 0.01 6 R H H 98.42 9.70 17.60 27.78 92.11 51.23 -64.38 -40.87 3.03 0.03 96.94 1.27 0.33 1.30 96.55 0.53 0.00 0.01 0.01 7 H H H 101.08 4.76 21.33 26.31 92.14 49.85 -65.16 -41.22 3.23 0.03 96.73 1.27 0.32 1.47 96.47 0.44 0.00 0.01 0.01 8 L H H 73.75 5.50 22.89 28.38 91.83 49.45 -64.26 -42.16 2.00 0.01 97.98 0.71 0.20 0.90 97.93 0.25 0.00 0.00 0.00 9 A H H 18.36 14.73 19.79 35.18 91.63 50.74 -63.45 -42.63 1.27 0.00 98.73 0.39 0.11 0.57 98.80 0.13 0.00 0.00 0.00 10 A H H 27.96 12.42 21.37 34.29 91.67 50.44 -63.42 -42.17 0.75 0.00 99.25 0.18 0.05 0.36 99.33 0.08 0.00 0.00 0.00 11 A H H 48.31 4.58 24.96 29.50 91.27 50.27 -63.62 -42.35 0.39 0.00 99.60 0.06 0.02 0.20 99.66 0.05 0.00 0.00 0.00 12 E H H 66.92 9.78 24.12 34.03 91.77 49.71 -64.53 -41.67 0.37 0.00 99.63 0.05 0.02 0.20 99.70 0.04 0.00 0.00 0.00 13 A H H 10.71 19.56 18.03 38.05 91.21 51.54 -63.26 -42.08 0.33 0.00 99.67 0.04 0.01 0.17 99.74 0.03 0.00 0.00 0.00 14 R H H 109.65 7.10 23.58 31.01 91.48 50.96 -62.93 -41.90 0.31 0.00 99.69 0.04 0.01 0.17 99.73 0.04 0.00 0.00 0.00 15 F H H 91.11 4.50 22.73 26.99 91.70 49.95 -63.61 -42.55 0.35 0.00 99.65 0.04 0.02 0.24 99.61 0.10 0.00 0.00 0.00 16 L H H 24.28 13.55 16.30 31.27 91.82 49.65 -64.47 -41.84 0.52 0.00 99.48 0.05 0.03 0.36 99.31 0.25 0.00 0.00 0.00 17 L H H 53.82 12.63 14.73 27.83 91.94 50.51 -64.84 -39.86 1.43 0.00 98.57 0.11 0.08 1.13 97.95 0.72 0.00 0.00 0.00 18 E H H 139.32 2.01 17.27 19.55 91.44 52.96 -66.35 -30.07 8.53 0.01 91.46 0.25 0.33 7.94 90.71 0.76 0.01 0.00 0.00 19 L C T 101.30 4.12 14.26 19.45 94.44 51.40 -86.38 -4.18 68.69 0.02 31.29 0.67 1.93 64.72 31.63 1.03 0.00 0.01 0.02 20 G C T 53.14 2.64 16.43 19.82 99.29 -102.99 84.56 13.44 99.37 0.02 0.62 8.24 3.26 87.97 0.43 0.08 0.00 0.01 0.01 21 R C C 91.85 11.66 11.86 24.29 109.34 150.07 -88.56 108.81 99.63 0.10 0.27 96.80 2.66 0.21 0.19 0.03 0.00 0.03 0.08 22 P C C 56.87 9.46 14.71 25.38 108.66 -126.70 -67.85 146.94 84.63 0.11 15.26 79.53 1.87 2.01 16.01 0.48 0.00 0.03 0.07 23 D H H 102.65 3.80 17.04 22.05 94.73 -119.29 -62.78 -35.59 6.12 0.01 93.86 2.00 1.11 2.80 92.99 1.09 0.00 0.00 0.01 24 E H H 100.84 4.33 19.77 24.34 92.37 54.78 -65.81 -38.92 1.62 0.01 98.37 0.41 0.16 0.91 97.61 0.89 0.00 0.00 0.00 25 V H H 12.92 19.39 15.23 34.82 92.07 50.43 -64.80 -42.50 0.43 0.00 99.57 0.11 0.04 0.23 99.12 0.51 0.00 0.00 0.00 26 L H H 39.60 14.32 18.43 33.01 91.62 51.30 -62.97 -41.61 0.16 0.00 99.84 0.03 0.01 0.08 99.75 0.13 0.00 0.00 0.00 27 R H H 131.44 2.24 24.72 25.57 91.53 50.42 -63.71 -41.72 0.14 0.00 99.86 0.02 0.00 0.08 99.84 0.05 0.00 0.00 0.00 28 L H H 35.54 12.07 20.95 33.81 91.83 49.82 -64.15 -42.44 0.12 0.00 99.88 0.01 0.00 0.08 99.87 0.04 0.00 0.00 0.00 29 L H H 7.48 23.83 16.86 40.71 91.39 50.42 -63.45 -42.21 0.14 0.00 99.86 0.01 0.01 0.08 99.86 0.04 0.00 0.00 0.00 30 E H H 85.74 7.39 22.44 30.19 91.30 51.21 -63.07 -41.35 0.28 0.00 99.72 0.02 0.01 0.19 99.71 0.07 0.00 0.00 0.00 31 R H H 116.51 2.92 23.48 25.40 91.65 50.08 -64.20 -41.88 0.72 0.00 99.28 0.05 0.03 0.57 99.15 0.20 0.00 0.00 0.00 32 L H H 15.74 16.05 15.87 33.05 91.73 49.69 -64.69 -41.88 1.22 0.00 98.78 0.15 0.10 0.84 98.30 0.61 0.00 0.00 0.00 33 L H H 46.03 15.28 14.84 30.00 91.99 50.64 -64.57 -40.00 2.71 0.01 97.28 0.38 0.22 1.91 96.07 1.41 0.00 0.00 0.00 34 E H H 142.80 1.64 18.37 19.67 91.36 52.61 -66.47 -31.77 9.94 0.01 90.05 0.57 0.61 8.49 89.21 1.11 0.01 0.00 0.01 35 E C H 122.39 3.07 16.04 19.66 94.06 49.42 -85.62 -6.49 53.11 0.04 46.86 1.32 3.17 46.62 47.58 1.25 0.01 0.01 0.04 36 G C T 44.32 7.38 14.88 23.52 97.93 -112.25 80.34 16.45 98.01 0.07 1.92 21.80 6.98 69.29 1.56 0.29 0.00 0.03 0.05 37 D C C 49.89 10.97 13.97 26.40 107.90 157.74 -83.91 111.57 99.36 0.07 0.57 98.09 1.19 0.17 0.44 0.04 0.00 0.02 0.05 38 P H H 82.32 6.50 18.06 25.90 93.47 -162.82 -63.67 -30.24 22.31 0.04 77.65 7.84 2.42 10.88 77.24 1.58 0.00 0.02 0.03 39 A H H 48.12 7.34 21.09 29.07 91.97 57.98 -63.96 -38.55 6.17 0.02 93.80 1.50 0.58 3.79 92.89 1.22 0.00 0.01 0.01 40 L H H 11.98 21.36 18.00 39.08 92.13 50.47 -65.43 -41.97 1.06 0.01 98.93 0.33 0.10 0.54 98.11 0.90 0.00 0.00 0.00 41 F H H 46.08 16.67 21.19 37.16 91.67 51.16 -62.65 -42.46 0.38 0.00 99.62 0.10 0.03 0.20 99.35 0.32 0.00 0.00 0.00 42 A H H 47.76 4.10 26.07 30.01 91.22 50.79 -63.41 -42.37 0.14 0.00 99.85 0.02 0.01 0.08 99.81 0.08 0.00 0.00 0.00 43 A H H 17.43 13.31 22.78 36.80 91.55 50.12 -63.69 -42.42 0.12 0.00 99.88 0.01 0.01 0.07 99.86 0.05 0.00 0.00 0.00 44 L H H 4.76 24.91 18.80 43.61 91.55 50.33 -63.84 -42.37 0.12 0.00 99.88 0.01 0.00 0.08 99.87 0.04 0.00 0.00 0.00 45 R H H 102.85 9.51 23.77 33.29 91.41 51.16 -62.93 -41.77 0.22 0.00 99.78 0.02 0.01 0.14 99.78 0.05 0.00 0.00 0.00 46 E H H 92.34 3.65 24.42 27.47 91.64 49.95 -64.23 -41.78 0.65 0.00 99.35 0.05 0.03 0.50 99.27 0.15 0.00 0.00 0.00 47 L H H 17.72 16.08 16.87 33.84 91.82 49.48 -64.49 -42.11 1.29 0.00 98.71 0.13 0.09 0.93 98.31 0.54 0.00 0.00 0.00 48 L H H 43.58 15.84 15.13 30.79 91.91 50.29 -63.81 -40.04 3.53 0.01 96.46 0.37 0.25 2.66 95.48 1.22 0.00 0.00 0.00 49 E H H 144.26 1.69 18.77 20.04 91.70 52.04 -67.23 -29.98 12.44 0.02 87.54 0.72 0.84 10.44 86.92 1.06 0.01 0.01 0.01 50 S H H 67.83 3.95 14.90 19.85 94.93 53.68 -83.79 -9.68 47.67 0.08 52.25 3.19 5.59 36.45 53.53 1.14 0.01 0.02 0.06 51 G C T 51.70 4.52 14.72 20.92 96.89 -119.26 80.46 9.59 98.52 0.16 1.31 36.80 18.97 42.87 0.81 0.38 0.00 0.06 0.11 52 D C C 55.22 9.29 13.31 24.36 111.43 147.69 -76.83 125.75 99.74 0.07 0.18 94.49 5.14 0.10 0.16 0.02 0.00 0.02 0.06 53 P H H 87.12 4.45 18.57 24.06 92.52 -142.15 -61.36 -34.79 12.68 0.01 87.31 1.17 1.06 9.95 86.15 1.65 0.00 0.00 0.01 54 L H H 59.26 11.08 19.58 30.99 92.23 56.17 -65.03 -40.02 7.00 0.01 92.99 0.46 0.34 5.86 91.83 1.49 0.00 0.00 0.00 55 A H H 7.51 20.41 16.50 37.10 91.90 50.81 -64.47 -41.71 0.83 0.00 99.17 0.20 0.07 0.43 98.39 0.91 0.00 0.00 0.00 56 R H H 96.41 10.84 22.05 32.73 91.73 51.65 -62.95 -41.78 0.25 0.00 99.75 0.06 0.02 0.13 99.56 0.24 0.00 0.00 0.00 57 L H H 66.76 6.15 24.88 31.27 91.86 49.60 -64.02 -42.86 0.22 0.00 99.78 0.04 0.01 0.12 99.65 0.17 0.00 0.00 0.00 58 I H H 21.25 17.10 21.60 38.70 91.88 48.74 -63.95 -43.37 0.24 0.00 99.76 0.04 0.01 0.14 99.68 0.13 0.00 0.00 0.00 59 A H H 8.97 20.28 18.72 38.95 91.60 50.25 -63.57 -42.65 0.44 0.00 99.56 0.06 0.02 0.27 99.53 0.11 0.00 0.00 0.00 60 E H H 86.72 6.00 23.03 29.20 92.01 49.45 -64.72 -41.13 1.22 0.00 98.78 0.11 0.06 0.91 98.69 0.23 0.00 0.00 0.00 61 T H H 50.05 6.13 21.00 27.83 93.10 48.04 -66.39 -41.95 3.54 0.01 96.45 0.33 0.25 2.82 96.05 0.54 0.00 0.00 0.00 62 V H H 19.60 16.28 15.89 32.73 92.90 48.53 -65.77 -42.00 6.90 0.05 93.05 1.05 0.70 5.13 91.28 1.78 0.02 0.02 0.02 63 F H H 65.23 13.22 14.37 27.91 92.57 49.24 -66.62 -38.19 12.13 0.13 87.74 2.50 1.35 8.27 83.17 4.56 0.03 0.07 0.06 64 R H H 161.05 1.95 15.85 18.10 92.45 54.10 -67.53 -30.99 28.83 0.25 70.91 4.99 2.69 20.95 66.81 4.26 0.03 0.12 0.14 65 R C H 146.79 3.56 13.37 17.97 96.09 52.73 -80.08 -17.60 51.00 0.31 48.69 18.81 1.45 29.08 47.41 2.91 0.00 0.12 0.22 66 L C C 67.88 13.45 10.98 23.96 101.09 68.50 -80.72 -5.73 99.91 0.02 0.08 99.77 0.07 0.10 0.05 0.00 0.00 0.01 0.00