# 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 122.79 4.13 9.97 15.87 113.92 -150.27 -90.22 132.43 99.94 0.05 0.02 99.86 0.07 0.03 0.00 0.00 0.00 0.02 0.01 1 N C C 117.33 2.42 8.17 12.32 110.93 -145.68 -89.67 115.78 94.18 1.24 4.58 87.38 1.26 6.42 1.87 1.81 0.00 0.66 0.60 2 T C C 108.53 1.85 7.23 10.66 104.64 -166.46 -90.84 28.80 92.08 2.05 5.87 54.09 19.19 18.95 1.51 4.27 0.00 1.08 0.93 3 E C C 150.54 1.39 8.23 10.75 107.30 112.31 -84.25 67.39 91.10 2.52 6.38 53.36 25.25 12.67 1.75 4.46 0.00 1.30 1.20 4 K C C 144.39 2.12 8.65 12.48 115.78 68.30 -94.33 134.56 96.06 1.92 2.02 64.69 29.95 1.55 1.41 0.63 0.00 0.88 0.90 5 P C C 94.15 3.10 9.68 14.57 112.74 -107.34 -71.02 147.44 91.53 2.88 5.59 81.21 6.31 3.94 3.96 1.57 0.00 1.46 1.54 6 C C C 74.66 5.78 7.89 15.36 113.58 -115.87 -84.23 137.49 90.17 2.78 7.04 76.87 9.22 3.73 5.55 1.63 0.00 1.20 1.79 7 T C C 80.14 2.10 12.07 14.76 118.71 -131.82 -86.84 167.67 83.19 1.43 15.38 65.18 13.84 3.52 14.34 1.82 0.00 0.56 0.74 8 E H H 141.77 1.86 10.67 13.66 93.81 -99.37 -63.04 -36.67 18.29 0.30 81.42 7.68 4.91 7.28 74.05 5.78 0.03 0.14 0.13 9 E H H 133.18 1.14 12.52 13.30 92.94 53.05 -66.87 -37.75 14.31 0.16 85.53 4.00 2.44 8.22 78.26 6.88 0.04 0.09 0.07 10 N H H 81.01 2.99 11.79 16.04 93.83 50.32 -67.63 -38.20 13.87 0.22 85.90 5.28 2.26 6.85 78.18 7.18 0.02 0.13 0.09 11 F H H 102.91 3.53 11.54 16.56 93.74 50.29 -67.64 -39.30 12.13 0.25 87.62 6.59 2.29 4.29 82.67 3.90 0.01 0.14 0.10 12 E H H 112.03 1.86 14.12 15.97 93.04 51.76 -65.21 -40.59 9.66 0.17 90.17 4.84 1.70 3.60 87.89 1.82 0.01 0.08 0.07 13 N H H 92.31 2.00 14.13 16.12 93.91 49.71 -68.19 -38.35 11.90 0.14 87.96 5.24 1.88 5.05 86.03 1.66 0.01 0.07 0.06 14 E H H 104.73 2.60 13.56 16.80 93.43 51.67 -66.36 -39.86 9.62 0.10 90.28 4.34 1.48 3.97 88.85 1.26 0.01 0.05 0.04 15 I H H 98.53 1.82 14.41 16.09 92.51 50.49 -65.32 -41.06 6.49 0.06 93.44 3.11 0.85 2.33 92.93 0.72 0.00 0.03 0.02 16 M H H 103.15 1.76 14.41 16.02 92.28 50.03 -65.17 -40.83 3.53 0.03 96.44 1.60 0.41 1.39 96.12 0.47 0.00 0.01 0.01 17 R H H 135.10 1.85 14.43 16.33 92.23 50.33 -65.19 -40.38 1.21 0.00 98.79 0.42 0.12 0.52 98.71 0.21 0.00 0.00 0.00 18 A H H 57.72 2.14 14.31 16.76 92.02 51.20 -64.61 -40.79 0.70 0.00 99.30 0.19 0.06 0.35 99.25 0.15 0.00 0.00 0.00 19 K H H 122.10 1.46 15.46 16.13 92.02 50.31 -64.81 -41.24 0.54 0.00 99.46 0.12 0.04 0.29 99.44 0.10 0.00 0.00 0.00 20 W H H 135.78 1.88 14.76 16.53 92.17 49.37 -64.69 -41.58 0.34 0.00 99.66 0.07 0.02 0.18 99.67 0.06 0.00 0.00 0.00 21 A H H 53.98 2.39 14.28 17.30 91.82 50.77 -63.74 -41.54 0.26 0.00 99.74 0.04 0.01 0.14 99.77 0.04 0.00 0.00 0.00 22 K H H 119.36 1.49 15.27 16.10 91.84 49.93 -64.77 -40.87 0.26 0.00 99.73 0.04 0.01 0.15 99.77 0.03 0.00 0.00 0.00 23 K H H 116.13 1.52 15.12 15.99 91.93 49.84 -64.99 -40.95 0.26 0.00 99.74 0.04 0.01 0.14 99.78 0.03 0.00 0.00 0.00 24 R H H 133.59 1.72 14.63 16.15 91.97 49.79 -64.91 -40.66 0.30 0.00 99.70 0.04 0.02 0.16 99.75 0.03 0.00 0.00 0.00 25 M H H 102.01 1.75 14.47 16.05 91.72 50.00 -64.71 -40.89 0.32 0.00 99.68 0.04 0.02 0.17 99.73 0.03 0.00 0.00 0.00 26 R H H 135.82 1.34 15.01 15.50 91.89 49.98 -64.55 -41.06 0.37 0.00 99.62 0.05 0.02 0.20 99.68 0.04 0.00 0.00 0.00 27 K H H 114.08 1.69 14.70 16.09 92.02 49.70 -64.82 -40.80 0.53 0.00 99.47 0.08 0.03 0.30 99.54 0.05 0.00 0.00 0.00 28 L H H 87.17 1.97 14.08 16.23 91.75 50.13 -64.67 -40.88 0.55 0.00 99.44 0.09 0.04 0.29 99.52 0.06 0.00 0.00 0.00 29 K H H 118.65 1.46 14.87 15.70 91.66 50.20 -64.59 -40.65 0.64 0.00 99.36 0.12 0.05 0.34 99.44 0.06 0.00 0.00 0.00 30 R H H 131.44 1.54 14.44 15.57 91.95 50.14 -64.80 -40.68 0.83 0.00 99.17 0.15 0.06 0.44 99.26 0.08 0.00 0.00 0.00 31 K H H 116.31 1.71 14.20 15.81 91.91 50.25 -64.83 -40.47 0.89 0.00 99.11 0.18 0.07 0.46 99.20 0.09 0.00 0.00 0.00 32 R H H 135.64 1.50 14.21 15.34 91.95 50.27 -64.93 -40.47 0.80 0.00 99.19 0.18 0.07 0.40 99.25 0.11 0.00 0.00 0.00 33 R H H 137.47 1.39 14.24 15.08 92.14 50.23 -65.18 -41.02 0.85 0.00 99.15 0.18 0.07 0.44 99.16 0.14 0.00 0.00 0.00 34 H H H 112.15 1.59 13.48 14.94 92.16 49.70 -65.25 -40.92 1.22 0.00 98.78 0.25 0.11 0.67 98.76 0.22 0.00 0.00 0.00 35 M H H 102.90 1.60 12.70 14.38 92.23 50.18 -65.28 -40.76 2.15 0.01 97.85 0.50 0.22 1.18 97.70 0.40 0.00 0.00 0.00 36 K H H 125.29 1.35 12.18 13.44 92.61 50.77 -65.90 -38.78 4.68 0.02 95.30 1.03 0.50 2.79 94.77 0.88 0.00 0.01 0.01 37 A H H 70.43 1.59 10.55 12.73 93.02 51.86 -67.17 -36.77 11.30 0.04 88.66 2.04 1.19 7.58 87.48 1.66 0.01 0.01 0.02 38 R H H 175.08 0.95 9.70 10.87 95.09 52.50 -73.43 -25.51 25.04 0.12 74.84 4.87 3.04 16.93 73.24 1.79 0.02 0.04 0.08 39 S C H 84.78 1.53 8.28 10.94 98.49 60.14 -81.20 -6.87 57.65 0.24 42.11 27.41 2.02 26.60 42.18 1.55 0.00 0.08 0.16 40 K C C 154.42 1.83 10.64 13.67 103.88 93.64 -78.63 52.33 99.90 0.01 0.08 99.55 0.11 0.27 0.06 0.00 0.00 0.01 0.00