# 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 G C C 47.68 4.37 13.08 18.92 116.60 -135.03 95.48 -172.02 99.92 0.07 0.01 99.82 0.10 0.04 0.00 0.00 0.00 0.03 0.01 1 S C C 81.98 3.39 10.10 15.19 115.18 -110.37 -97.46 132.91 85.49 4.36 10.15 78.25 2.08 6.25 4.99 3.85 0.00 2.61 1.97 2 T C C 94.38 3.58 8.94 14.36 112.92 -161.93 -95.21 124.31 76.50 8.43 15.07 49.92 13.88 12.74 6.92 8.12 0.02 5.27 3.13 3 R C C 160.79 3.47 9.63 14.77 109.32 -159.06 -93.05 109.20 71.58 8.81 19.61 40.12 16.29 16.00 9.34 9.69 0.05 5.22 3.28 4 N C C 108.99 3.77 11.19 16.40 106.45 150.61 -92.18 62.48 77.07 5.05 17.87 34.34 20.45 23.57 8.38 8.44 0.04 2.75 2.02 5 G C C 45.51 5.65 11.27 18.26 106.99 -108.18 75.38 7.90 82.77 3.06 14.18 37.77 23.29 22.58 7.20 6.26 0.01 1.52 1.36 6 R C C 135.47 5.16 11.66 18.42 113.88 129.30 -91.27 135.67 71.38 6.44 22.18 45.19 15.52 10.74 14.86 7.23 0.03 3.20 3.22 7 D C C 91.43 5.44 11.81 18.65 106.83 -125.19 -84.84 103.06 69.29 4.12 26.58 47.88 11.07 10.25 17.34 9.38 0.01 2.30 1.77 8 S C C 66.71 6.33 11.64 19.30 102.51 105.94 -82.35 -3.29 55.84 2.40 41.76 29.15 11.85 15.68 21.82 19.16 0.04 1.29 1.00 9 E C H 130.13 3.80 14.36 19.08 99.46 70.49 -81.91 -5.57 52.79 2.60 44.61 20.47 13.13 20.38 22.21 21.19 0.13 1.39 1.10 10 A C C 50.53 9.90 12.57 23.43 112.62 96.06 -85.37 134.98 56.54 3.41 40.06 27.86 13.51 16.37 18.47 20.57 0.07 1.90 1.26 11 K C C 109.71 8.03 16.40 25.34 114.88 -145.23 -96.36 130.32 69.87 9.51 20.62 43.50 16.32 10.80 9.59 10.71 0.03 6.94 2.10 12 R C C 108.31 11.74 17.79 29.44 118.28 -141.91 -97.86 136.15 60.83 33.28 5.89 46.67 9.37 4.45 2.70 3.29 0.01 28.69 4.81 13 L E E 51.53 15.55 18.32 33.61 119.51 -153.92 -103.60 139.70 45.83 53.47 0.70 38.31 5.69 1.09 0.26 0.42 0.00 52.51 1.73 14 G E E 14.81 13.28 22.20 35.54 140.96 131.14 144.05 -175.11 17.09 82.63 0.28 13.09 3.47 0.80 0.08 0.19 0.00 81.68 0.68 15 V E E 33.22 19.55 17.09 36.09 117.23 -70.95 -99.35 132.45 8.08 91.33 0.59 6.76 1.12 0.48 0.28 0.32 0.00 90.41 0.63 16 K E E 102.79 8.12 21.38 30.06 100.48 -173.02 -94.08 -27.89 12.14 86.55 1.31 6.82 4.04 1.72 0.49 0.67 0.01 85.72 0.52 17 R E E 90.32 10.09 19.59 30.31 134.02 14.06 -141.65 145.07 21.94 76.47 1.59 18.38 2.44 1.06 0.45 1.12 0.00 74.98 1.55 18 F C C 77.59 14.20 15.20 29.39 125.96 -171.42 -124.93 138.52 55.74 35.94 8.32 47.66 4.28 3.26 0.47 7.79 0.00 34.46 2.09 19 G C T 44.82 7.13 16.48 24.55 97.62 -6.49 58.00 50.40 88.19 2.84 8.96 0.82 6.01 81.99 0.11 8.73 0.00 2.09 0.25 20 G C T 53.10 4.09 16.81 21.85 95.77 -34.25 82.24 0.42 90.55 1.14 8.31 1.63 7.97 80.64 0.05 8.62 0.00 0.99 0.09 21 E C C 88.98 7.75 15.61 24.96 120.40 127.63 -85.27 146.89 90.02 9.90 0.08 74.60 14.63 0.38 0.01 0.11 0.00 9.79 0.48 22 S E E 66.64 6.89 20.31 28.15 116.94 -121.62 -87.23 141.09 19.01 80.98 0.01 18.95 0.39 0.02 0.00 0.00 0.00 77.84 2.79 23 V E E 11.19 22.95 12.39 35.14 125.60 -169.16 -124.52 140.93 2.58 97.42 0.00 2.77 0.03 0.00 0.00 0.00 0.00 92.56 4.65 24 L C C 88.85 4.10 23.95 27.72 119.92 -127.60 -84.56 151.00 51.01 48.99 0.01 52.54 0.35 0.02 0.00 0.00 0.00 45.55 1.53 25 A C T 54.02 12.27 15.47 28.12 109.74 -87.66 -59.12 134.90 99.18 0.72 0.10 0.08 1.25 98.23 0.00 0.06 0.00 0.34 0.04 26 G C T 39.70 5.87 20.81 27.71 95.33 24.16 89.03 -5.94 99.70 0.23 0.06 0.13 1.79 97.86 0.00 0.05 0.00 0.15 0.01 27 S C C 32.55 12.11 19.74 32.67 118.17 125.17 -77.62 144.88 89.40 10.57 0.03 85.83 3.08 0.07 0.00 0.03 0.00 10.64 0.34 28 I E E 41.61 16.68 21.83 38.19 112.04 -119.54 -80.23 125.81 2.31 97.69 0.00 2.40 0.04 0.00 0.00 0.00 0.00 97.02 0.53 29 I E E 10.31 22.87 22.26 44.52 101.46 175.90 -96.56 -31.65 1.16 98.84 0.00 0.81 0.28 0.01 0.00 0.00 0.00 98.89 0.01 30 V E E 9.13 22.28 22.22 43.94 137.25 5.50 -147.69 146.67 0.74 99.26 0.00 0.61 0.06 0.01 0.00 0.00 0.00 99.29 0.03 31 R E E 85.18 12.89 23.49 35.93 122.30 -158.15 -118.19 131.63 4.61 95.36 0.02 3.97 0.37 0.06 0.00 0.02 0.00 95.41 0.16 32 Q E E 47.15 17.42 15.92 32.91 114.20 -142.11 -91.96 125.76 32.64 67.04 0.32 26.59 4.66 1.04 0.06 0.28 0.00 66.58 0.79 33 R C C 130.78 6.86 17.01 25.00 112.89 -164.79 -99.20 121.66 71.85 27.36 0.79 40.76 20.33 11.12 0.10 0.86 0.00 25.45 1.38 34 G C S 47.33 4.00 16.72 21.34 112.37 6.87 91.82 -147.96 88.78 10.68 0.54 34.81 39.56 14.34 0.04 0.67 0.00 9.77 0.79 35 T C C 67.79 10.97 12.64 24.15 117.70 27.59 -101.23 135.89 84.64 14.58 0.78 64.06 17.01 3.41 0.12 0.81 0.00 12.88 1.70 36 K C C 143.10 3.43 18.50 22.62 109.96 -135.17 -95.46 105.38 75.42 23.96 0.61 58.02 13.98 2.81 0.13 0.64 0.00 21.86 2.56 37 F C C 56.00 18.46 10.81 28.25 122.53 121.86 -106.14 139.32 55.99 43.41 0.60 45.76 7.48 1.19 0.24 0.45 0.00 33.18 11.70 38 H C C 119.45 4.29 19.93 24.91 117.36 -147.72 -98.40 132.73 75.66 24.00 0.35 69.96 4.16 0.80 0.10 0.26 0.00 21.58 3.14 39 A C C 59.93 11.25 13.67 25.42 112.60 -110.80 -68.61 140.86 83.95 14.02 2.04 33.54 20.95 30.18 0.33 1.84 0.00 10.99 2.17 40 G C T 34.75 6.51 17.17 24.95 130.29 65.75 134.25 -174.94 91.08 6.79 2.13 23.89 33.60 33.84 0.20 2.25 0.00 4.79 1.43 41 A C T 82.07 3.38 19.51 23.07 98.24 -60.84 -75.05 -13.74 91.99 6.00 2.01 6.17 39.26 47.12 0.11 2.00 0.00 4.36 0.98 42 N C T 55.11 13.88 17.12 30.81 97.56 38.00 -95.26 10.75 86.98 12.37 0.66 12.00 28.06 46.55 0.03 0.80 0.00 12.11 0.45 43 V E E 19.46 21.43 14.45 35.49 124.80 91.60 -111.43 140.06 10.58 89.40 0.01 9.18 0.86 0.05 0.00 0.01 0.00 89.58 0.32 44 G E E 19.69 8.61 24.31 33.81 142.15 161.67 -154.61 177.20 0.50 99.49 0.00 0.44 0.02 0.00 0.00 0.00 0.00 99.51 0.03 45 C E E 54.29 14.42 16.63 30.99 125.06 -105.33 -117.67 141.42 1.11 98.88 0.00 1.11 0.03 0.00 0.00 0.00 0.00 98.62 0.24 46 G C C 19.88 11.06 13.03 25.33 126.45 -142.25 -88.96 -177.01 85.72 14.24 0.04 84.88 0.69 0.10 0.00 0.02 0.00 13.86 0.45 47 R C T 195.51 0.99 15.38 15.88 91.42 -87.81 -63.87 -23.04 97.22 0.80 1.97 0.61 8.98 87.25 0.03 2.43 0.00 0.55 0.15 48 D C T 96.63 3.17 16.21 19.92 93.69 51.42 -90.15 7.74 98.01 0.11 1.88 0.42 6.88 90.14 0.02 2.46 0.00 0.06 0.02 49 H C S 68.07 12.90 15.23 28.69 93.64 -107.14 71.91 21.12 95.12 2.63 2.25 17.86 57.95 18.38 0.09 3.00 0.00 2.38 0.35 50 T E E 22.95 12.84 21.09 35.19 119.35 145.31 -86.39 144.41 48.38 51.61 0.01 48.92 0.45 0.02 0.00 0.00 0.00 49.93 0.67 51 L E E 3.61 25.34 19.56 45.87 115.14 -126.38 -88.99 130.69 0.13 99.87 0.00 0.13 0.00 0.00 0.00 0.00 0.00 99.85 0.02 52 F E E 43.16 12.80 27.03 40.30 128.70 -172.21 -126.15 144.28 0.05 99.95 0.00 0.05 0.00 0.00 0.00 0.00 0.00 99.95 0.00 53 A E E 6.28 23.19 15.26 39.00 113.07 -119.09 -79.09 131.85 4.28 95.72 0.00 4.38 0.06 0.00 0.00 0.00 0.00 95.32 0.23 54 K C S 102.26 6.35 23.04 30.05 95.73 -161.16 -87.26 -19.64 92.27 7.36 0.36 22.16 59.01 10.41 0.02 0.46 0.00 7.65 0.29 55 A C S 42.83 6.07 21.97 28.62 136.53 21.33 -139.36 166.42 92.86 6.71 0.42 2.55 77.73 13.01 0.02 0.36 0.00 5.98 0.34 56 D C C 89.30 6.04 21.41 28.11 113.25 -89.56 -68.07 141.33 93.47 5.99 0.54 52.24 33.97 6.65 0.02 0.79 0.00 6.06 0.28 57 G E E 11.91 11.36 19.82 32.91 143.68 98.97 161.63 -173.01 24.90 75.08 0.02 21.61 2.89 0.24 0.00 0.02 0.00 74.64 0.60 58 K E E 78.73 8.38 24.70 34.00 126.06 -72.17 -120.15 141.86 0.61 99.39 0.00 0.59 0.02 0.00 0.00 0.00 0.00 99.34 0.06 59 V E E 5.98 25.19 15.36 41.25 120.28 -152.76 -107.59 131.10 0.36 99.64 0.00 0.34 0.00 0.00 0.00 0.00 0.00 99.66 0.00 60 K E E 76.28 8.19 25.98 34.63 122.44 -167.53 -116.62 135.09 0.51 99.49 0.00 0.45 0.01 0.00 0.00 0.00 0.00 99.54 0.00 61 F E E 24.07 22.03 14.93 36.59 123.71 -161.75 -114.75 137.98 1.01 98.99 0.00 0.88 0.03 0.00 0.00 0.00 0.00 99.06 0.02 62 E E E 81.52 6.65 21.78 29.06 123.93 -169.52 -121.87 140.27 1.51 98.49 0.00 1.31 0.08 0.01 0.00 0.00 0.00 98.56 0.04 63 V E E 51.26 13.61 12.19 26.35 119.76 -151.99 -110.71 130.38 6.94 93.04 0.02 6.05 0.48 0.05 0.00 0.01 0.00 93.19 0.21 64 K E E 118.41 4.32 13.77 19.67 116.91 -160.87 -108.40 128.13 33.20 66.59 0.21 26.37 5.61 0.96 0.03 0.19 0.00 66.21 0.62 65 G C T 40.29 3.57 11.87 16.77 127.32 17.31 105.78 -172.54 80.25 9.71 10.04 17.33 23.82 38.70 0.39 10.91 0.00 7.93 0.91 66 P C T 115.62 1.41 10.93 12.85 99.07 -38.00 -71.03 -8.99 86.17 1.08 12.76 6.41 14.75 62.03 0.45 15.28 0.00 0.72 0.36 67 K C T 149.22 1.97 10.55 13.38 100.34 38.31 -87.35 22.44 87.15 0.74 12.11 5.56 12.81 65.90 0.42 14.58 0.00 0.47 0.26 68 N C T 118.35 3.31 11.71 16.62 97.86 -112.64 47.73 34.32 92.72 4.30 2.99 18.80 19.40 54.25 0.20 3.30 0.00 3.52 0.52 69 R E E 100.42 7.82 12.24 21.73 119.56 152.00 -99.39 139.72 46.30 53.48 0.22 38.10 5.16 1.55 0.03 0.21 0.00 54.31 0.64 70 K E E 85.71 10.40 15.68 27.00 120.15 -143.44 -104.31 135.54 11.10 88.88 0.02 9.75 0.73 0.08 0.00 0.01 0.00 89.26 0.16 71 F E E 57.31 13.09 18.22 32.04 128.01 -166.80 -123.16 145.25 1.09 98.91 0.00 0.95 0.05 0.00 0.00 0.00 0.00 98.98 0.02 72 I E E 24.70 17.94 17.99 36.51 122.95 -155.12 -115.22 133.55 0.47 99.52 0.00 0.42 0.01 0.00 0.00 0.00 0.00 99.55 0.00 73 S E E 29.67 11.37 22.60 34.73 124.88 -162.96 -115.16 142.95 0.71 99.29 0.00 0.60 0.02 0.00 0.00 0.00 0.00 99.37 0.01 74 I E E 26.17 18.84 16.27 35.48 123.22 -160.83 -118.31 132.56 1.88 98.12 0.00 1.67 0.07 0.00 0.00 0.00 0.00 98.20 0.05 75 E E E 90.88 7.39 19.53 27.73 120.61 -160.76 -110.38 133.01 9.22 90.74 0.04 8.46 0.43 0.06 0.01 0.02 0.00 90.71 0.31 76 A E E 47.50 11.54 11.91 24.06 117.15 -137.04 -87.14 143.97 42.36 57.45 0.19 40.62 0.91 0.30 0.04 0.12 0.00 57.40 0.62 77 E C C 128.88 4.18 15.67 21.12 110.48 -118.53 -81.44 128.38 99.54 0.45 0.01 99.50 0.10 0.03 0.00 0.00 0.00 0.34 0.01