# 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 Q C C 114.34 4.74 11.48 17.91 114.17 -145.61 -89.20 132.81 99.87 0.06 0.07 99.79 0.07 0.06 0.05 0.00 0.00 0.02 0.01 1 S C C 72.56 3.85 10.09 15.55 111.07 -136.37 -83.67 137.79 79.00 1.55 19.45 73.89 1.15 4.51 16.19 2.80 0.00 0.77 0.68 2 K C C 135.26 4.11 10.39 16.09 100.02 -123.46 -74.32 -24.95 57.10 2.70 40.20 37.99 9.71 9.51 30.98 9.33 0.01 1.46 1.00 3 A C H 62.37 4.78 11.47 17.69 100.19 67.91 -74.83 -26.33 49.26 2.81 47.93 31.76 8.96 9.04 35.19 12.49 0.02 1.68 0.85 4 V H H 69.93 6.01 14.15 21.52 98.81 57.73 -74.25 -29.96 43.72 4.29 51.99 29.92 7.19 7.44 36.28 15.14 0.02 2.85 1.15 5 V H H 45.59 14.69 12.08 26.59 94.35 64.49 -65.66 -34.11 23.84 3.68 72.48 12.85 4.51 7.22 41.24 30.57 0.05 2.93 0.63 6 R H G 130.86 6.56 16.24 23.91 92.57 61.01 -69.01 -21.73 25.72 3.06 71.22 8.63 4.26 12.42 35.33 36.17 0.12 2.51 0.55 7 T H G 82.99 4.13 18.33 22.87 94.92 56.84 -81.84 -12.15 36.58 4.24 59.18 9.25 5.99 20.51 25.51 34.29 0.17 3.48 0.79 8 Y C T 60.89 13.63 14.73 28.72 100.67 62.29 -92.12 -13.94 55.02 19.28 25.70 18.20 17.35 22.35 9.73 13.65 0.23 16.69 1.80 9 Y E E 51.56 16.22 11.99 28.25 129.36 57.73 -122.86 149.82 9.69 90.03 0.28 8.28 1.11 0.21 0.11 0.13 0.00 89.81 0.35 10 E E E 93.17 4.65 18.70 24.39 128.76 -168.61 -128.70 147.93 0.96 99.01 0.02 0.86 0.04 0.01 0.01 0.00 0.00 99.03 0.04 11 V E E 77.48 9.90 10.41 21.49 115.87 -131.02 -99.21 127.10 2.51 97.46 0.02 2.14 0.17 0.02 0.01 0.01 0.00 97.58 0.07 12 E E E 109.80 3.20 10.71 15.81 120.76 173.80 -129.68 126.23 18.90 81.02 0.08 15.87 1.85 0.37 0.01 0.06 0.00 81.47 0.36 13 Q C T 162.75 0.48 11.70 10.91 99.19 -36.97 44.74 -8.82 99.36 0.46 0.18 1.05 14.34 84.01 0.01 0.18 0.00 0.36 0.05 14 D C T 127.89 1.44 10.66 12.96 96.72 -33.00 44.12 11.81 99.59 0.25 0.15 0.95 15.63 83.03 0.00 0.16 0.00 0.19 0.02 15 S E E 54.19 4.07 13.39 19.25 133.00 83.35 -127.72 157.82 14.57 85.40 0.02 9.75 4.11 0.23 0.00 0.02 0.00 85.64 0.25 16 I E E 55.19 14.01 9.66 24.17 116.54 -126.67 -99.98 129.48 2.45 97.55 0.00 2.22 0.06 0.00 0.00 0.00 0.00 97.69 0.03 17 K E E 104.13 4.41 17.71 23.35 125.11 -171.90 -122.70 140.94 0.39 99.61 0.00 0.35 0.01 0.00 0.00 0.00 0.00 99.63 0.01 18 L E E 67.90 13.18 11.34 24.92 113.27 -117.62 -77.16 132.10 3.31 96.68 0.01 3.10 0.14 0.01 0.00 0.01 0.00 96.61 0.14 19 K C C 106.15 5.83 14.91 22.06 112.87 -155.35 -91.93 152.24 74.40 25.18 0.42 50.93 19.26 2.90 0.03 0.46 0.00 25.95 0.47 20 N C C 98.16 5.41 15.70 22.07 102.56 -7.53 -51.99 84.56 87.76 11.96 0.28 52.66 31.28 3.34 0.02 0.36 0.00 11.73 0.62 21 K C C 90.72 12.08 12.93 25.46 110.02 -173.49 -88.80 110.00 88.66 11.11 0.23 78.29 9.28 0.86 0.04 0.24 0.00 10.16 1.12 22 K E B 119.60 4.32 19.46 24.88 124.62 77.75 -114.55 140.82 27.21 72.69 0.10 22.58 1.10 0.03 0.08 0.01 0.00 9.55 66.65 23 C C C 14.98 18.74 9.07 27.62 112.06 -117.10 -79.46 129.43 97.09 2.89 0.02 96.81 0.91 0.07 0.00 0.01 0.00 1.27 0.94 24 P C T 90.22 3.80 16.68 21.61 93.43 -137.81 -65.46 -22.56 99.73 0.14 0.14 1.31 8.24 90.14 0.01 0.16 0.00 0.09 0.05 25 R C T 150.63 3.15 15.47 19.67 101.61 42.60 -88.68 -36.32 99.70 0.15 0.15 0.19 4.76 94.79 0.00 0.14 0.00 0.08 0.04 26 C C T 62.22 7.07 13.26 21.82 105.51 16.87 -113.36 -12.87 99.09 0.63 0.27 1.27 9.74 88.15 0.02 0.26 0.00 0.36 0.20 27 G C C 35.42 4.65 15.85 21.86 116.82 -119.77 85.98 -165.26 97.37 2.40 0.23 81.46 14.04 1.60 0.07 0.16 0.00 1.06 1.60 28 S C C 60.32 5.67 16.24 22.97 116.47 25.86 -80.07 145.87 91.81 6.13 2.07 65.13 22.74 3.53 0.99 1.17 0.00 3.12 3.31 29 I C S 66.04 12.47 16.13 28.90 102.47 -138.47 -83.29 -12.46 60.56 31.91 7.53 25.48 27.00 7.70 3.78 3.77 0.57 13.50 18.19 30 M C C 54.80 14.10 17.10 31.13 109.59 64.90 -90.18 106.47 64.41 25.45 10.14 43.58 14.74 6.72 3.86 6.14 0.07 20.83 4.06 31 A E E 27.20 13.50 15.81 30.09 118.95 97.65 -84.65 143.79 44.10 46.45 9.45 32.95 9.74 2.80 3.67 5.55 0.03 42.49 2.77 32 H E E 109.06 7.13 18.13 26.16 115.57 -133.54 -94.87 130.04 28.92 64.90 6.18 22.46 5.02 2.61 2.25 3.73 0.03 60.54 3.36 33 H E E 70.49 12.39 11.39 24.37 121.01 -163.72 -109.80 136.31 37.56 58.96 3.49 30.24 5.15 2.59 1.12 2.22 0.01 56.45 2.23 34 M C C 119.96 4.20 12.56 18.48 113.00 -148.95 -98.42 121.49 60.47 38.00 1.53 37.50 17.66 5.75 0.33 1.19 0.01 35.93 1.63 35 K C C 123.68 4.65 10.43 16.92 118.27 -97.89 -103.42 143.75 81.11 17.77 1.11 36.10 33.33 12.00 0.17 1.05 0.00 15.92 1.44 36 P C T 110.16 1.93 12.16 14.73 100.83 -46.99 -70.90 18.54 93.98 2.94 3.08 25.53 32.31 36.01 0.21 3.30 0.00 2.15 0.48 37 L C T 92.78 4.69 11.64 17.88 121.47 44.51 -110.26 147.86 90.82 6.05 3.12 22.09 34.03 34.74 0.17 3.52 0.00 4.79 0.66 38 E C C 94.58 7.90 13.78 23.00 113.66 -109.68 -80.64 130.57 68.70 29.01 2.29 40.70 12.12 14.33 0.17 2.41 0.00 29.54 0.72 39 R E E 63.94 12.31 15.48 28.96 129.79 -169.66 -128.69 147.66 21.49 78.47 0.04 19.23 1.41 0.13 0.01 0.03 0.00 78.75 0.43 40 W E E 57.41 14.03 18.16 33.11 123.18 -151.33 -113.89 137.49 1.38 98.62 0.00 1.21 0.07 0.00 0.00 0.00 0.00 98.64 0.07 41 A E E 30.13 10.76 21.35 33.15 129.53 -167.57 -127.18 146.20 0.68 99.31 0.00 0.68 0.02 0.00 0.00 0.00 0.00 98.92 0.38 42 C C C 11.72 18.32 13.23 32.67 109.58 -116.93 -79.07 123.94 56.84 43.14 0.03 56.68 0.47 0.05 0.00 0.01 0.00 42.05 0.74 43 G C T 37.08 7.06 17.35 25.85 94.34 -154.05 -69.73 -30.50 99.19 0.16 0.65 0.57 7.14 91.41 0.01 0.73 0.00 0.10 0.03 44 K C T 144.08 2.26 17.03 19.62 98.08 46.13 -79.16 -37.51 99.28 0.14 0.58 0.14 4.39 94.83 0.01 0.53 0.00 0.05 0.05 45 C C T 63.27 6.04 14.47 21.92 100.55 22.03 -103.84 -10.87 99.38 0.18 0.44 0.47 5.13 93.82 0.01 0.43 0.00 0.09 0.04 46 G C C 42.77 5.22 15.79 22.55 95.20 -116.71 80.08 7.86 98.32 1.55 0.12 88.63 6.03 3.62 0.03 0.10 0.00 1.23 0.36 47 Y C C 82.72 8.81 15.11 25.74 117.56 145.97 -75.79 144.93 93.04 6.96 0.01 92.67 0.69 0.03 0.00 0.01 0.00 6.36 0.25 48 T E E 58.94 13.18 15.65 29.24 126.73 -157.43 -122.77 142.37 1.24 98.76 0.00 1.23 0.03 0.00 0.00 0.00 0.00 98.34 0.39 49 E E E 65.69 10.80 17.97 29.84 128.92 -174.42 -131.40 143.63 0.67 99.33 0.00 0.66 0.02 0.00 0.00 0.00 0.00 99.27 0.04 50 F E E 103.69 8.93 15.85 25.90 113.80 -121.08 -84.01 131.31 9.23 90.72 0.05 8.48 0.54 0.13 0.01 0.04 0.00 90.34 0.46 51 I C C 73.19 10.18 12.12 23.42 106.55 -169.12 -98.24 22.19 66.62 32.69 0.69 50.11 9.38 5.71 0.10 0.66 0.00 33.34 0.70 52 G C C 50.07 3.18 13.10 17.52 119.16 -83.25 -92.75 161.53 80.70 18.61 0.70 68.92 3.78 6.53 0.09 0.63 0.00 18.98 1.07 53 K C C 146.44 3.56 12.58 17.93 116.71 -100.52 -100.75 136.92 99.70 0.29 0.01 99.61 0.14 0.03 0.00 0.00 0.00 0.19 0.02