# 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 114.43 4.78 14.32 20.72 117.89 -151.25 -98.38 137.42 99.95 0.05 0.00 99.83 0.13 0.01 0.00 0.00 0.00 0.03 0.00 1 P C C 87.49 4.77 13.72 19.94 113.52 -104.57 -69.07 146.96 97.80 2.18 0.02 96.54 1.12 0.30 0.00 0.01 0.00 1.89 0.14 2 I C C 76.22 12.66 10.68 23.45 118.61 -121.01 -90.59 136.74 57.31 42.63 0.06 49.49 5.93 0.47 0.01 0.07 0.00 43.14 0.89 3 K E E 96.63 8.02 19.08 28.06 125.12 -163.16 -119.72 139.72 20.04 79.93 0.03 17.54 2.02 0.08 0.01 0.02 0.00 79.72 0.60 4 L E E 60.86 12.97 19.13 32.36 117.47 -126.01 -85.42 137.60 10.00 89.99 0.01 9.25 0.47 0.03 0.00 0.01 0.00 90.00 0.25 5 A E E 8.78 20.75 16.80 37.50 130.79 -169.50 -122.88 153.08 5.88 94.12 0.00 5.35 0.41 0.01 0.00 0.00 0.00 94.18 0.05 6 R E E 105.77 7.16 25.06 32.82 119.73 -131.79 -107.64 132.96 2.31 97.69 0.00 2.05 0.09 0.00 0.00 0.00 0.00 97.80 0.05 7 V E E 18.54 22.03 13.09 35.31 109.50 -118.80 -76.13 124.32 1.01 98.99 0.00 0.96 0.01 0.00 0.00 0.00 0.00 99.01 0.02 8 T E E 67.25 5.20 20.69 26.80 100.62 174.77 -96.67 -31.85 2.71 97.29 0.00 1.81 0.51 0.02 0.00 0.00 0.00 97.66 0.01 9 K E E 101.97 3.87 22.59 27.01 137.17 -0.23 -152.02 150.07 0.74 99.26 0.00 0.49 0.10 0.01 0.00 0.00 0.00 99.41 0.00 10 V E E 54.06 17.69 13.20 30.11 117.41 -145.35 -109.78 124.34 0.40 99.59 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.61 0.00 11 L E E 75.91 7.46 17.74 26.31 111.14 -167.53 -97.54 124.93 1.41 98.58 0.00 1.16 0.11 0.01 0.00 0.00 0.00 98.70 0.01 12 G E E 31.07 7.29 16.79 25.29 139.91 -10.06 166.73 173.13 2.77 97.22 0.00 2.05 0.45 0.03 0.00 0.00 0.00 97.44 0.03 13 R E E 133.40 6.03 14.12 22.14 125.85 -94.92 -121.94 147.14 5.61 94.37 0.02 5.06 0.32 0.03 0.00 0.01 0.00 94.25 0.32 14 T E E 77.41 6.34 10.75 18.87 119.79 -137.97 -104.46 143.49 27.75 72.06 0.19 24.08 3.18 0.38 0.06 0.14 0.00 70.38 1.77 15 G C C 42.73 3.56 10.94 15.98 124.97 -3.72 92.49 -171.25 80.07 6.50 13.43 27.59 24.97 27.28 0.87 13.37 0.00 4.89 1.02 16 S C T 103.38 0.61 10.47 10.71 94.72 -67.17 -69.06 -21.03 83.57 0.64 15.79 2.64 14.95 63.37 0.52 17.85 0.00 0.37 0.30 17 Q C T 142.75 1.15 10.58 12.04 98.85 50.71 -88.91 3.62 83.21 0.41 16.38 1.86 9.54 68.88 0.50 18.76 0.00 0.22 0.22 18 G C T 43.97 4.84 11.07 17.54 100.09 -104.56 82.57 4.66 88.03 1.89 10.08 18.55 32.44 36.08 0.64 10.56 0.00 1.09 0.63 19 Q C C 105.05 4.17 14.21 19.53 108.74 128.60 -83.49 110.18 81.80 17.30 0.90 60.44 12.48 8.12 0.16 0.84 0.00 16.20 1.76 20 C E E 35.02 12.01 13.29 26.48 131.30 64.89 -133.92 155.20 30.42 69.53 0.04 27.09 2.08 0.14 0.01 0.03 0.00 70.16 0.49 21 T E E 32.02 11.96 17.87 31.34 123.60 -137.54 -114.99 139.95 3.17 96.82 0.01 2.90 0.10 0.01 0.00 0.00 0.00 96.93 0.05 22 Q E E 55.10 11.97 19.96 32.73 119.79 -143.40 -101.94 135.83 0.56 99.44 0.00 0.48 0.02 0.00 0.00 0.00 0.00 99.49 0.01 23 V E E 12.07 19.53 16.59 36.74 125.11 -165.97 -119.56 138.18 0.67 99.33 0.00 0.60 0.01 0.00 0.00 0.00 0.00 99.38 0.01 24 R E E 81.13 8.99 23.85 33.48 117.81 -142.72 -102.27 128.87 0.51 99.49 0.00 0.45 0.01 0.00 0.00 0.00 0.00 99.53 0.01 25 V E E 10.88 21.89 15.76 37.82 124.28 -168.78 -117.99 136.02 1.54 98.45 0.00 1.40 0.04 0.00 0.00 0.00 0.00 98.52 0.03 26 E E E 69.96 7.40 22.72 30.84 121.41 -159.61 -113.59 132.39 3.27 96.72 0.01 2.90 0.15 0.01 0.00 0.01 0.00 96.84 0.08 27 F E E 40.64 15.56 12.94 29.33 112.37 -134.21 -86.00 124.62 17.24 82.64 0.11 15.28 1.37 0.21 0.03 0.07 0.00 82.44 0.60 28 M C S 92.27 6.65 14.60 22.71 100.47 -155.87 -87.01 -20.94 74.82 23.91 1.27 25.65 28.90 19.84 0.11 1.23 0.00 23.50 0.75 29 D C S 117.68 1.54 14.42 15.86 100.00 39.07 -90.90 -1.01 89.51 9.55 0.95 8.99 50.01 30.07 0.05 1.08 0.00 9.16 0.64 30 D C C 70.13 5.95 10.13 17.99 112.22 52.17 -118.24 103.55 87.10 11.96 0.93 56.50 23.39 7.29 0.12 1.15 0.00 9.88 1.67 31 T C T 102.64 3.49 10.51 16.21 96.03 -172.42 -78.04 -13.07 90.09 7.56 2.35 19.38 30.68 40.26 0.19 2.47 0.00 6.02 1.00 32 S C S 92.58 1.06 13.41 14.02 95.92 60.75 -85.18 -10.19 87.11 11.03 1.86 11.36 38.15 37.66 0.10 1.96 0.00 10.00 0.77 33 R C C 115.35 6.07 12.90 20.61 124.74 52.55 -124.92 138.57 65.43 33.41 1.16 43.89 16.54 4.22 0.13 1.19 0.00 33.02 1.00 34 S E E 45.92 11.84 12.87 25.49 129.31 -173.81 -128.06 146.73 31.51 68.40 0.09 28.79 1.74 0.17 0.02 0.06 0.00 68.75 0.47 35 I E E 51.59 11.51 16.75 29.71 121.14 -151.94 -115.75 130.58 2.64 97.33 0.03 2.33 0.27 0.03 0.01 0.01 0.00 97.23 0.12 36 I E E 78.03 11.45 17.71 29.79 121.23 -163.51 -116.33 128.30 0.84 99.15 0.01 0.77 0.04 0.00 0.00 0.00 0.00 99.16 0.03 37 R E E 86.79 10.95 18.13 29.82 129.56 178.18 -130.51 143.81 3.55 96.44 0.01 3.13 0.18 0.02 0.00 0.00 0.00 96.64 0.03 38 N E E 81.06 7.06 20.82 28.39 113.45 -124.43 -82.75 129.14 8.25 91.72 0.03 7.04 0.87 0.05 0.01 0.01 0.00 91.87 0.15 39 V E E 18.80 21.23 11.03 31.61 118.39 -159.39 -107.38 132.32 13.93 86.02 0.05 13.64 0.47 0.04 0.03 0.02 0.00 82.72 3.09 40 K C S 142.46 2.76 20.12 23.05 104.34 -161.71 -94.77 22.20 66.11 33.83 0.06 32.28 34.19 0.79 0.01 0.07 0.00 31.56 1.10 41 G C S 31.38 3.94 21.22 25.18 140.37 -5.23 148.26 -178.30 89.64 10.34 0.02 3.95 84.31 0.97 0.00 0.02 0.00 10.56 0.19 42 P C C 79.04 5.91 19.98 26.53 114.74 -42.02 -67.54 143.11 89.57 10.40 0.02 82.03 6.66 0.32 0.00 0.03 0.00 10.41 0.55 43 V C C 15.74 23.24 10.65 33.20 122.32 -153.79 -110.89 137.00 64.15 35.82 0.04 67.36 0.76 0.04 0.02 0.02 0.00 11.99 19.81 44 R C C 125.75 3.48 23.66 27.24 129.40 -166.95 -120.88 158.07 80.60 19.36 0.04 82.28 1.11 0.07 0.02 0.02 0.00 7.19 9.32 45 E C T 117.56 8.14 14.67 24.19 109.25 -78.87 -58.82 133.09 98.11 1.72 0.17 0.28 2.26 96.09 0.01 0.11 0.00 1.07 0.18 46 G C T 47.78 3.12 19.03 22.75 95.58 24.29 89.91 -5.85 99.37 0.54 0.09 0.51 2.74 96.14 0.00 0.07 0.00 0.52 0.02 47 D C C 40.99 12.71 14.25 28.25 119.04 133.11 -72.84 148.34 92.25 7.69 0.06 89.90 2.52 0.08 0.01 0.05 0.00 7.08 0.34 48 V E E 68.59 8.75 21.78 31.22 118.17 -133.20 -103.96 131.70 7.31 92.53 0.16 7.27 0.23 0.06 0.11 0.05 0.00 87.31 4.96 49 L E E 12.97 22.94 15.84 38.63 125.05 -167.42 -117.14 139.59 5.32 94.06 0.61 4.91 0.37 0.18 0.45 0.19 0.00 93.32 0.58 50 T E E 54.32 8.88 24.38 33.60 120.94 -155.60 -110.87 133.32 13.33 84.98 1.70 12.47 0.73 0.31 1.10 0.46 0.00 84.27 0.67 51 L E E 25.91 20.34 14.88 34.91 112.02 -132.98 -84.73 127.68 43.56 51.34 5.10 38.34 3.17 1.00 3.43 1.48 0.00 51.30 1.27 52 L C C 75.69 7.51 19.24 27.35 106.88 -144.98 -78.99 123.70 60.50 15.19 24.30 48.10 7.02 4.52 18.14 6.50 0.01 14.26 1.45 53 E C C 105.16 5.66 17.70 23.90 99.95 -90.22 -74.15 -29.68 53.75 7.49 38.77 34.15 11.38 8.59 30.48 8.40 0.04 5.77 1.19 54 S C H 42.24 8.70 14.54 24.43 99.13 62.70 -76.12 -31.69 48.35 3.38 48.26 35.01 6.89 7.23 39.11 8.66 0.02 2.28 0.81 55 E H H 85.79 7.90 13.99 23.14 94.67 67.96 -67.16 -37.46 18.84 0.79 80.37 12.31 3.45 4.80 72.13 6.57 0.02 0.51 0.21 56 R H H 129.07 2.90 15.36 18.82 93.29 53.58 -65.95 -39.94 13.44 0.59 85.96 7.19 2.28 4.78 77.24 7.88 0.04 0.44 0.15 57 E H H 95.86 3.39 14.20 18.56 93.03 51.00 -67.03 -37.91 13.07 0.57 86.36 6.54 2.00 4.98 76.73 9.14 0.03 0.43 0.14 58 A H H 45.14 6.93 10.24 19.12 93.05 55.01 -67.40 -35.55 17.02 0.43 82.55 7.51 2.58 6.93 70.96 11.58 0.02 0.27 0.15 59 R H H 153.54 2.56 11.58 15.54 93.40 57.16 -68.94 -31.03 38.47 0.68 60.85 10.89 4.85 22.27 50.21 11.02 0.06 0.36 0.34 60 R C H 170.52 1.36 10.95 12.87 96.31 56.82 -75.33 -19.03 57.83 0.74 41.43 26.59 1.90 28.76 35.76 6.18 0.00 0.36 0.45 61 L C C 107.15 4.28 10.71 16.54 99.32 66.83 -77.88 -15.41 99.84 0.03 0.12 99.62 0.10 0.16 0.09 0.00 0.00 0.02 0.01