# 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 136.19 2.54 9.71 13.91 114.00 -158.01 -97.16 125.26 99.78 0.16 0.06 99.72 0.09 0.06 0.03 0.00 0.00 0.08 0.02 1 F C C 156.62 2.19 7.33 11.41 114.94 -152.40 -98.47 129.96 81.24 5.90 12.85 76.26 1.45 4.30 9.72 2.51 0.00 4.05 1.71 2 A C C 83.80 2.21 7.06 11.10 115.62 -149.04 -97.59 136.70 72.43 10.83 16.74 55.71 9.22 6.73 12.83 4.67 0.02 8.50 2.32 3 V C C 115.51 2.30 7.20 11.34 115.19 -148.76 -98.93 131.36 62.36 13.09 24.55 45.23 9.47 6.94 18.61 6.58 0.04 10.90 2.23 4 E C C 139.71 2.28 8.39 12.40 115.49 -148.67 -98.23 133.37 58.44 14.26 27.30 43.10 8.19 6.52 20.24 7.49 0.04 12.29 2.12 5 M C C 127.86 3.61 8.25 13.75 114.94 -147.70 -96.24 132.40 57.94 14.50 27.56 41.85 8.84 6.71 19.53 8.44 0.05 12.46 2.13 6 K C C 148.34 2.33 10.34 14.20 114.49 -144.96 -91.54 133.59 58.47 17.01 24.52 41.45 8.75 7.87 16.21 8.68 0.07 14.14 2.83 7 F C C 124.48 6.76 8.56 16.78 114.22 -148.99 -96.82 132.56 64.89 18.15 16.96 46.21 11.01 7.24 10.46 6.99 0.05 14.69 3.35 8 E C C 132.18 2.88 14.09 18.17 117.18 -151.64 -98.23 135.18 71.70 19.45 8.85 53.61 12.06 5.13 5.47 3.90 0.02 14.27 5.53 9 V C C 79.37 9.22 13.76 24.03 114.58 -109.14 -83.80 132.89 88.83 10.73 0.44 78.57 9.54 0.67 0.20 0.23 0.00 9.34 1.45 10 P C C 35.72 14.50 13.96 29.14 114.20 -120.63 -70.88 144.48 88.83 10.90 0.27 80.04 7.74 0.67 0.08 0.18 0.00 10.32 0.98 11 V E B 77.51 6.56 21.81 28.94 123.20 -147.15 -110.52 138.30 14.53 85.38 0.09 11.72 0.56 0.02 0.08 0.01 0.00 8.16 79.46 12 C C C 9.70 20.54 11.40 32.63 109.47 -112.03 -69.10 127.95 94.86 5.10 0.04 95.38 0.46 0.05 0.01 0.01 0.00 2.59 1.50 13 T C T 68.52 6.98 19.43 27.82 92.97 -151.75 -72.92 -21.69 99.63 0.25 0.12 1.96 8.36 89.31 0.01 0.12 0.00 0.16 0.08 14 S C T 53.82 8.97 16.51 26.16 99.78 47.85 -84.05 -40.86 99.77 0.15 0.08 0.12 3.32 96.40 0.00 0.06 0.00 0.07 0.03 15 C C T 63.44 5.50 14.71 21.71 102.19 18.88 -107.18 -13.71 99.87 0.07 0.05 0.30 4.67 94.92 0.00 0.05 0.00 0.04 0.01 16 G C C 47.80 4.85 14.21 20.82 94.12 -121.95 77.90 8.23 99.63 0.33 0.04 80.96 16.73 1.91 0.01 0.03 0.00 0.14 0.22 17 K C C 100.88 4.56 15.47 21.76 118.35 142.53 -78.55 145.62 97.67 2.31 0.02 87.65 10.17 0.14 0.00 0.02 0.00 1.45 0.56 18 E E B 125.09 4.52 18.32 24.27 112.59 -104.20 -69.52 135.98 5.47 94.50 0.03 4.31 0.31 0.01 0.04 0.00 0.00 13.11 82.21 19 I C C 17.57 21.51 10.46 31.56 119.29 -150.65 -104.71 132.49 83.35 16.60 0.05 80.65 3.08 0.09 0.01 0.03 0.00 13.63 2.50 20 T C C 78.60 4.23 22.87 27.13 113.92 -144.24 -96.42 125.23 95.94 3.88 0.19 93.38 2.84 0.20 0.06 0.10 0.00 2.34 1.08 21 P C C 46.90 16.82 11.03 27.05 111.19 -128.81 -70.62 142.60 84.75 4.83 10.42 67.70 7.55 9.00 3.43 7.34 0.00 2.90 2.08 22 R C C 131.05 4.73 14.79 20.79 122.27 -154.08 -107.53 151.68 77.67 8.03 14.30 43.13 15.90 18.55 3.35 10.94 0.03 4.38 3.72 23 E C T 143.13 2.45 14.27 17.64 103.54 -87.73 -70.18 106.08 77.83 4.65 17.52 11.53 17.69 48.66 3.47 13.70 0.09 3.09 1.77 24 H C T 138.83 3.49 14.98 19.52 98.45 22.36 -61.40 16.31 82.41 3.89 13.70 12.24 16.55 53.51 2.89 10.84 0.02 2.96 0.99 25 A C C 30.65 13.59 11.10 25.32 125.47 109.65 -105.86 150.05 77.97 20.07 1.96 43.91 26.18 9.10 0.43 1.69 0.00 15.79 2.89 26 T E E 55.35 8.94 17.64 27.74 119.24 -149.62 -105.99 136.94 49.80 49.80 0.40 38.95 9.00 1.42 0.09 0.35 0.00 48.78 1.41 27 H E E 96.48 9.59 18.45 28.73 122.60 -133.34 -109.75 136.55 17.38 82.46 0.16 15.18 1.90 0.29 0.04 0.13 0.00 81.09 1.37 28 F E E 42.17 14.84 15.62 31.29 130.76 -177.05 -133.08 149.05 10.01 89.94 0.05 8.57 1.14 0.13 0.01 0.04 0.00 89.41 0.70 29 V E E 81.88 5.51 21.56 27.46 115.49 -121.68 -90.67 133.36 11.57 88.39 0.04 10.99 0.57 0.05 0.02 0.02 0.00 81.12 7.23 30 C C C 10.30 19.98 9.80 30.07 109.41 -116.65 -72.87 124.01 95.22 4.75 0.02 95.22 0.63 0.08 0.00 0.01 0.00 3.63 0.43 31 P C T 79.34 5.13 16.72 23.29 93.13 -145.25 -66.54 -25.29 98.78 0.22 1.00 1.35 8.04 89.19 0.04 1.17 0.00 0.15 0.06 32 N C T 114.35 2.42 15.49 18.49 100.00 41.43 -84.72 -35.52 99.00 0.13 0.87 0.16 4.20 94.80 0.01 0.72 0.00 0.06 0.04 33 C C T 67.99 4.80 13.45 19.64 103.59 19.62 -109.09 -13.87 98.91 0.23 0.85 0.91 6.23 91.76 0.03 0.88 0.00 0.13 0.06 34 G C C 43.36 5.09 13.95 20.75 95.70 -120.82 81.38 4.57 98.26 1.57 0.17 83.09 9.69 5.39 0.03 0.17 0.00 1.14 0.49 35 E C C 88.54 5.71 15.78 23.21 117.48 143.35 -75.91 144.27 91.42 8.54 0.04 88.75 2.73 0.13 0.00 0.03 0.00 7.72 0.62 36 A E E 45.58 11.48 16.21 28.50 117.40 -125.78 -91.94 136.40 3.62 96.38 0.01 3.54 0.12 0.01 0.00 0.00 0.00 95.65 0.68 37 I E E 38.21 14.07 17.72 32.63 122.66 -167.59 -118.47 134.40 1.31 98.69 0.00 1.31 0.03 0.00 0.00 0.00 0.00 98.60 0.06 38 I E E 42.19 13.01 20.00 33.99 118.06 -141.46 -104.81 129.23 4.58 95.41 0.01 4.65 0.11 0.01 0.00 0.00 0.00 95.03 0.20 39 W E E 41.58 16.03 18.83 35.42 123.19 -166.20 -115.42 136.28 15.33 84.65 0.01 14.10 0.62 0.05 0.00 0.01 0.00 84.93 0.28 40 R E E 72.56 10.53 20.58 31.94 125.19 -157.90 -117.52 141.09 12.07 87.89 0.04 12.33 0.42 0.03 0.02 0.02 0.00 78.09 9.09 41 C C C 11.56 16.92 12.20 30.50 109.81 -117.23 -73.87 128.18 74.02 25.89 0.09 74.73 0.67 0.09 0.03 0.04 0.00 22.24 2.20 42 E C T 114.44 5.21 16.94 23.51 94.01 -148.06 -69.87 -26.84 98.59 0.51 0.90 1.42 7.78 89.27 0.03 1.01 0.00 0.39 0.10 43 S C T 80.05 2.10 15.91 18.25 99.45 44.14 -80.52 -40.48 98.81 0.35 0.84 0.95 6.04 91.79 0.02 0.89 0.00 0.18 0.14 44 C C T 65.59 5.07 13.49 20.03 101.31 20.13 -104.13 -10.20 98.90 0.36 0.74 4.21 11.00 83.53 0.03 0.87 0.00 0.22 0.14 45 R C C 146.40 5.90 13.40 21.26 93.91 -127.02 62.88 24.98 98.38 1.29 0.33 63.71 12.12 22.58 0.06 0.26 0.00 1.01 0.25 46 V C C 72.11 5.26 16.81 23.55 122.01 136.73 -94.68 145.07 72.54 27.36 0.10 61.81 10.02 0.48 0.03 0.09 0.00 24.87 2.70 47 L E E 84.42 9.23 16.58 26.74 113.51 -109.37 -76.15 136.71 8.55 91.37 0.08 6.95 0.75 0.08 0.07 0.03 0.00 55.28 36.84 48 S C C 27.37 15.28 12.17 27.67 125.44 -157.18 -114.85 156.26 61.22 38.66 0.12 53.97 6.03 0.41 0.03 0.10 0.00 36.82 2.65 49 V C C 85.47 5.35 17.88 24.14 120.24 -118.93 -107.16 142.99 85.84 14.01 0.15 69.10 15.15 1.45 0.03 0.17 0.00 12.51 1.59 50 P C C 80.49 5.59 17.88 24.06 110.97 -45.81 -72.90 138.36 94.86 4.95 0.19 49.69 38.03 7.10 0.02 0.25 0.00 4.36 0.54 51 Y C C 72.52 14.66 13.58 28.21 110.70 -135.28 -100.81 104.97 83.62 16.19 0.19 41.70 37.15 4.71 0.02 0.23 0.00 14.98 1.21 52 K E B 104.13 5.38 20.27 26.55 125.75 75.14 -117.42 142.56 8.24 91.71 0.05 6.10 0.78 0.03 0.05 0.01 0.00 19.39 73.65 53 C C C 12.49 18.86 10.28 29.60 109.55 -112.82 -72.77 126.08 93.74 6.24 0.02 94.34 0.57 0.08 0.00 0.01 0.00 4.10 0.88 54 P C T 84.63 4.53 16.32 22.31 93.17 -149.04 -67.86 -26.18 99.79 0.08 0.13 0.51 3.35 95.93 0.00 0.13 0.00 0.05 0.02 55 K C T 143.35 2.26 15.62 18.47 98.89 45.31 -80.23 -37.72 99.78 0.07 0.15 0.09 2.07 97.68 0.00 0.11 0.00 0.03 0.02 56 C C T 65.86 5.52 13.15 20.23 103.42 20.39 -107.73 -10.90 99.77 0.11 0.12 0.37 3.39 96.05 0.00 0.10 0.00 0.05 0.03 57 G C C 47.39 3.71 14.95 20.00 95.85 -114.28 82.27 5.64 98.35 1.54 0.12 86.92 8.38 2.98 0.03 0.09 0.00 0.81 0.81 58 W C C 97.79 8.27 12.27 22.51 119.45 141.22 -77.25 147.20 93.86 6.06 0.08 87.18 6.36 0.45 0.02 0.07 0.00 3.70 2.21 59 E E B 121.84 4.70 16.63 23.08 121.01 -131.07 -102.83 142.73 11.52 88.30 0.18 8.57 1.34 0.12 0.16 0.05 0.00 21.35 68.42 60 G C C 21.12 13.26 12.46 25.84 134.15 -141.95 -119.93 172.34 86.24 13.71 0.05 83.10 2.75 0.29 0.01 0.04 0.00 12.64 1.16 61 P C C 79.37 5.70 18.26 24.47 111.13 -38.01 -68.86 147.59 99.73 0.27 0.01 99.52 0.25 0.04 0.00 0.00 0.00 0.15 0.03