# 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 123.80 4.35 10.59 16.56 114.29 -166.06 -100.61 125.51 99.87 0.12 0.01 99.80 0.09 0.04 0.00 0.00 0.00 0.06 0.01 1 F C C 158.94 2.28 8.09 12.09 112.75 -153.81 -93.61 124.60 90.98 7.61 1.42 83.03 2.41 5.67 0.58 0.62 0.00 4.42 3.28 2 G C C 58.45 1.74 7.90 11.11 113.47 -150.14 -101.44 152.10 93.88 5.12 1.00 57.55 27.33 9.22 0.25 0.83 0.00 2.98 1.85 3 L C C 125.34 1.91 6.93 10.59 116.72 -106.09 -89.85 142.78 97.12 1.53 1.35 65.32 27.55 4.23 0.37 0.99 0.00 0.72 0.83 4 P C C 109.99 1.63 8.16 11.16 111.85 -100.14 -70.16 146.64 93.54 0.63 5.83 58.18 18.17 16.40 0.99 5.56 0.00 0.29 0.41 5 Q C C 147.64 1.35 7.85 10.47 109.51 -102.11 -81.62 132.44 90.02 0.80 9.18 56.32 18.40 14.27 1.58 8.51 0.00 0.35 0.56 6 Q C C 135.36 1.89 8.38 11.85 113.88 -118.09 -84.20 138.02 91.04 0.86 8.10 68.96 15.20 6.34 1.94 6.58 0.00 0.39 0.60 7 E C C 148.42 1.65 9.79 12.83 114.74 -119.36 -85.49 137.00 96.10 0.90 3.00 85.74 9.08 1.51 1.64 1.06 0.00 0.33 0.64 8 V C C 77.58 7.20 6.83 15.44 114.88 -112.00 -77.07 144.78 97.63 0.83 1.54 94.16 3.00 0.58 1.16 0.23 0.00 0.26 0.60 9 S C C 62.87 1.89 11.44 13.95 117.92 -114.92 -75.77 161.94 98.09 0.38 1.53 96.81 1.14 0.39 1.20 0.12 0.00 0.11 0.23 10 E H H 149.21 1.25 10.45 12.43 92.75 -104.61 -59.97 -37.81 3.27 0.01 96.72 1.07 0.73 1.34 96.42 0.44 0.00 0.00 0.00 11 E H H 131.84 1.00 11.66 12.32 92.26 52.96 -65.00 -39.75 1.87 0.01 98.13 0.46 0.25 1.00 97.77 0.51 0.00 0.00 0.00 12 E H H 99.93 2.77 11.58 15.62 92.50 49.43 -66.17 -39.60 1.09 0.00 98.91 0.36 0.12 0.53 98.42 0.57 0.00 0.00 0.00 13 K H H 109.62 2.72 12.64 16.45 91.93 51.01 -64.58 -41.15 0.63 0.00 99.37 0.22 0.06 0.27 99.25 0.20 0.00 0.00 0.00 14 R H H 141.23 1.38 14.78 15.49 91.83 50.05 -64.83 -40.80 0.72 0.00 99.27 0.16 0.05 0.37 99.30 0.11 0.00 0.00 0.00 15 A H H 55.14 2.24 14.35 17.03 91.87 50.27 -64.44 -40.97 0.87 0.00 99.13 0.17 0.05 0.47 99.19 0.12 0.00 0.00 0.00 16 H H H 100.74 2.83 14.31 17.94 92.20 50.88 -64.81 -40.67 1.28 0.00 98.72 0.36 0.10 0.62 98.77 0.14 0.00 0.00 0.00 17 Q H H 102.13 2.13 15.21 17.45 91.98 50.80 -64.53 -40.61 0.94 0.00 99.06 0.24 0.08 0.47 99.11 0.10 0.00 0.00 0.00 18 E H H 109.82 1.80 15.75 17.11 92.09 50.20 -64.78 -41.16 0.73 0.00 99.27 0.18 0.06 0.37 99.31 0.08 0.00 0.00 0.00 19 Q H H 102.25 2.07 15.55 17.49 92.15 49.89 -64.76 -41.28 0.76 0.00 99.23 0.20 0.07 0.39 99.26 0.08 0.00 0.00 0.00 20 T H H 67.59 2.61 14.77 17.98 92.15 49.86 -64.23 -41.29 0.63 0.00 99.37 0.15 0.05 0.32 99.43 0.06 0.00 0.00 0.00 21 E H H 106.29 2.19 15.32 17.65 91.94 49.95 -64.46 -41.03 0.40 0.00 99.60 0.07 0.02 0.21 99.65 0.04 0.00 0.00 0.00 22 K H H 118.29 1.97 15.65 17.44 92.10 50.34 -64.88 -41.03 0.34 0.00 99.66 0.06 0.02 0.18 99.70 0.04 0.00 0.00 0.00 23 T H H 75.22 2.12 15.27 17.30 92.21 49.90 -64.81 -41.64 0.30 0.00 99.70 0.05 0.02 0.16 99.74 0.03 0.00 0.00 0.00 24 L H H 96.99 2.05 15.19 17.23 92.13 49.25 -64.87 -41.40 0.17 0.00 99.83 0.03 0.01 0.09 99.85 0.02 0.00 0.00 0.00 25 K H H 118.71 2.23 15.23 17.67 91.97 49.84 -64.36 -41.29 0.14 0.00 99.86 0.02 0.01 0.08 99.88 0.02 0.00 0.00 0.00 26 Q H H 104.69 1.94 15.68 17.35 92.09 49.78 -64.70 -40.97 0.14 0.00 99.86 0.01 0.01 0.08 99.88 0.02 0.00 0.00 0.00 27 A H H 61.02 2.07 15.14 17.20 91.84 50.53 -64.37 -41.48 0.11 0.00 99.89 0.01 0.00 0.06 99.90 0.02 0.00 0.00 0.00 28 A H H 61.21 2.18 15.11 17.46 91.84 50.03 -64.52 -41.45 0.11 0.00 99.89 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 29 Y H H 133.40 1.94 15.88 17.50 92.07 49.55 -64.86 -41.48 0.14 0.00 99.86 0.01 0.00 0.09 99.87 0.03 0.00 0.00 0.00 30 V H H 82.74 2.08 15.69 17.65 92.03 49.58 -64.24 -41.79 0.18 0.00 99.82 0.01 0.01 0.12 99.82 0.03 0.00 0.00 0.00 31 A H H 56.88 2.48 14.57 17.59 91.66 50.59 -64.13 -41.28 0.33 0.00 99.67 0.02 0.01 0.23 99.63 0.10 0.00 0.00 0.00 32 A H H 61.50 1.94 14.95 16.86 91.67 50.18 -64.66 -40.84 0.56 0.00 99.44 0.03 0.02 0.44 99.08 0.42 0.00 0.00 0.00 33 F H H 123.68 1.90 14.47 16.36 92.15 49.96 -65.08 -40.02 0.75 0.00 99.25 0.04 0.03 0.62 97.51 1.80 0.00 0.00 0.00 34 L H H 97.41 2.84 12.92 16.79 92.28 51.57 -65.99 -38.25 2.56 0.00 97.44 0.09 0.08 2.42 90.98 6.43 0.00 0.00 0.00 35 W H H 173.21 1.93 13.27 15.61 93.23 50.58 -71.61 -29.53 12.47 0.01 87.53 0.21 0.31 12.67 81.71 5.07 0.01 0.00 0.00 36 V H H 104.44 1.81 13.16 15.05 97.43 45.92 -88.65 -15.95 29.95 0.07 69.98 1.04 2.27 26.47 66.52 3.56 0.06 0.02 0.06 37 S C C 47.87 5.32 9.38 16.93 109.32 92.21 -85.46 123.06 84.23 0.40 15.38 56.52 23.42 2.95 15.79 0.95 0.00 0.10 0.29 38 P H H 91.48 2.52 12.04 15.73 94.27 -150.96 -64.28 -31.57 31.92 0.16 67.92 7.53 5.91 18.45 64.75 3.18 0.02 0.07 0.09 39 M H H 119.15 1.64 13.00 14.76 92.81 57.36 -66.50 -37.91 14.84 0.12 85.04 3.47 1.76 9.69 81.34 3.59 0.02 0.07 0.05 40 I H H 85.50 3.20 12.40 16.98 92.40 53.56 -65.44 -41.08 4.30 0.06 95.65 1.45 0.50 2.28 92.71 3.01 0.00 0.04 0.01 41 W H H 132.95 3.22 12.66 17.16 92.32 50.07 -65.35 -40.93 1.56 0.02 98.42 0.45 0.15 0.83 97.18 1.37 0.00 0.01 0.00 42 H H H 109.15 2.01 13.88 16.15 92.12 50.74 -65.07 -40.87 1.10 0.01 98.89 0.25 0.09 0.65 98.19 0.80 0.00 0.01 0.00 43 L H H 91.05 1.84 13.66 15.58 91.91 50.37 -64.47 -41.19 0.99 0.00 99.00 0.15 0.07 0.65 98.33 0.78 0.00 0.00 0.00 44 V H H 75.23 2.56 12.42 16.04 92.23 49.24 -65.49 -40.83 1.38 0.01 98.61 0.22 0.12 0.91 97.78 0.97 0.00 0.00 0.00 45 K H H 112.23 2.56 11.34 15.13 92.12 51.47 -65.37 -38.37 2.90 0.01 97.10 0.34 0.21 2.11 94.91 2.42 0.00 0.00 0.00 46 K H H 136.20 1.48 11.05 13.01 92.61 53.12 -66.39 -35.27 9.30 0.01 90.68 0.57 0.46 7.92 85.77 5.25 0.01 0.00 0.01 47 Q H H 132.95 1.16 10.13 11.66 93.36 53.65 -70.31 -28.82 22.91 0.04 77.04 1.57 1.30 19.30 73.02 4.74 0.02 0.02 0.03 48 W C H 183.27 1.75 8.53 11.39 99.06 48.63 -89.38 -6.35 50.33 0.43 49.25 21.87 2.01 26.35 45.95 3.32 0.01 0.17 0.32 49 K C C 143.31 2.88 10.22 14.85 104.73 117.11 -79.01 74.32 99.96 0.02 0.01 99.89 0.05 0.04 0.01 0.00 0.00 0.01 0.00