# 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 T C C 83.33 5.60 12.33 19.63 120.73 -165.15 -106.91 140.55 99.68 0.31 0.01 99.69 0.09 0.03 0.01 0.00 0.00 0.16 0.03 1 R C C 159.97 3.60 10.23 15.71 112.30 -146.77 -96.12 124.55 86.78 7.62 5.60 76.65 2.32 7.90 2.75 2.37 0.00 5.22 2.80 2 N C C 113.86 3.26 10.27 15.14 108.49 -143.08 -91.56 96.07 86.92 5.72 7.36 42.86 19.89 25.11 2.69 4.21 0.01 3.45 1.78 3 G C C 45.33 5.90 10.03 17.30 111.85 -90.75 -74.23 136.73 85.32 4.39 10.28 44.54 22.02 19.52 4.30 5.52 0.01 2.39 1.70 4 R C C 144.16 4.43 11.46 17.48 112.45 -120.69 -92.19 129.08 74.61 6.60 18.79 49.87 15.33 9.44 11.60 7.14 0.02 3.45 3.14 5 D C C 96.35 4.70 11.69 17.85 107.31 -123.71 -84.01 98.73 71.63 3.45 24.91 50.69 11.16 9.83 14.73 10.18 0.01 1.98 1.42 6 S C C 66.21 6.60 11.01 18.91 104.57 75.14 -85.22 23.85 59.84 2.29 37.86 34.04 11.58 14.66 18.06 19.46 0.02 1.24 0.94 7 E C C 128.96 3.85 13.95 18.93 101.30 86.17 -83.73 5.37 56.78 2.62 40.60 26.15 13.42 18.32 18.55 21.00 0.08 1.38 1.10 8 A C C 53.70 9.20 12.65 22.90 112.39 95.35 -84.65 136.40 62.15 3.51 34.33 33.40 14.56 15.40 14.37 18.98 0.04 2.04 1.21 9 K C C 106.16 8.52 16.12 25.50 115.76 -149.65 -97.25 132.07 73.66 11.85 14.49 48.76 16.32 9.37 5.52 8.48 0.01 9.59 1.94 10 R C C 109.76 11.59 18.01 29.57 118.54 -146.25 -97.21 135.98 55.64 41.62 2.74 45.31 7.28 2.49 1.09 1.68 0.00 37.85 4.31 11 L E E 48.36 15.97 18.31 33.96 121.32 -160.62 -108.76 140.90 36.85 62.81 0.34 31.98 3.65 0.56 0.12 0.22 0.00 62.00 1.47 12 G E E 14.13 13.74 22.26 35.94 142.46 142.47 -148.23 174.23 13.65 86.18 0.17 10.98 2.40 0.44 0.05 0.12 0.00 85.50 0.51 13 V E E 31.80 19.61 17.21 36.25 116.87 -73.39 -98.25 133.32 6.75 92.64 0.61 5.68 0.86 0.41 0.31 0.31 0.00 91.89 0.53 14 K E E 103.10 8.24 21.70 30.42 100.00 -171.61 -93.07 -27.71 13.49 85.68 0.82 6.30 5.40 2.01 0.22 0.52 0.00 85.20 0.37 15 R E E 88.46 9.85 20.06 30.60 135.90 19.41 -143.37 146.62 20.61 78.52 0.86 14.20 3.70 2.55 0.23 0.66 0.00 77.32 1.34 16 F C C 78.06 14.40 15.38 29.69 126.11 -166.73 -124.50 139.53 51.98 41.27 6.75 44.34 4.15 3.10 0.48 6.03 0.00 40.13 1.78 17 G C T 43.75 7.50 16.67 25.04 98.09 -7.26 58.62 50.88 88.84 3.70 7.45 0.98 6.70 81.73 0.12 7.38 0.00 2.81 0.28 18 G C T 52.85 4.15 17.09 22.13 95.87 -25.28 82.64 0.43 91.93 1.61 6.46 2.01 9.39 79.99 0.07 6.93 0.00 1.49 0.12 19 E C C 87.89 7.98 15.63 25.17 120.05 128.66 -84.23 146.61 89.35 10.59 0.06 74.97 13.53 0.32 0.01 0.08 0.00 10.67 0.43 20 S E E 66.55 6.85 20.45 28.26 117.42 -123.16 -87.60 140.49 15.57 84.42 0.01 15.70 0.30 0.01 0.00 0.00 0.00 81.95 2.03 21 V E E 11.27 23.00 12.32 35.14 125.67 -169.22 -124.58 140.64 1.93 98.07 0.00 2.09 0.02 0.00 0.00 0.00 0.00 94.62 3.27 22 L E C 88.77 4.09 23.85 27.62 119.93 -126.60 -85.37 151.09 49.48 50.51 0.01 50.89 0.34 0.02 0.00 0.00 0.00 47.37 1.37 23 A C T 55.02 12.14 15.19 27.73 109.59 -87.43 -59.06 134.39 99.17 0.71 0.11 0.08 1.31 98.14 0.00 0.07 0.00 0.35 0.04 24 G C T 42.18 5.35 20.61 26.89 95.38 24.20 88.84 -5.77 99.68 0.25 0.08 0.15 1.81 97.80 0.00 0.08 0.00 0.16 0.01 25 S C C 35.37 11.53 19.26 31.64 117.65 124.16 -78.08 143.73 89.15 10.77 0.08 84.56 3.95 0.12 0.00 0.08 0.00 10.87 0.41 26 I E E 51.00 15.62 20.79 36.15 110.64 -119.24 -79.62 123.03 2.76 97.23 0.00 2.86 0.05 0.00 0.00 0.00 0.00 96.37 0.72 27 I E E 12.40 21.92 21.13 42.90 101.02 175.98 -96.11 -32.89 1.97 98.03 0.00 1.17 0.70 0.02 0.00 0.00 0.00 98.09 0.01 28 V E E 10.40 21.42 21.82 42.94 137.99 4.74 -150.88 147.11 0.74 99.25 0.00 0.58 0.09 0.02 0.00 0.00 0.00 99.28 0.03 29 R E E 91.02 12.97 22.98 35.44 122.91 -160.77 -121.59 130.77 3.83 96.15 0.02 3.27 0.34 0.05 0.00 0.01 0.00 96.18 0.14 30 Q E E 44.14 17.48 15.76 32.92 115.06 -147.95 -96.49 126.46 27.70 72.08 0.21 23.31 3.18 0.65 0.05 0.19 0.00 71.88 0.74 31 R C C 132.01 6.62 17.07 24.95 115.53 -167.08 -101.31 129.64 70.86 28.48 0.65 43.91 18.16 8.74 0.08 0.73 0.00 27.08 1.29 32 G C S 48.97 3.74 16.63 20.94 110.40 12.43 94.22 -27.52 89.00 10.52 0.48 35.31 41.14 12.43 0.04 0.59 0.00 9.69 0.80 33 T C C 66.48 11.04 12.26 23.84 118.04 66.82 -101.98 138.19 85.15 14.04 0.81 64.91 17.01 3.18 0.14 0.81 0.00 12.04 1.93 34 K C C 145.71 3.12 18.03 21.81 108.01 -142.94 -95.99 66.72 78.88 20.41 0.71 59.98 15.59 2.86 0.16 0.71 0.00 17.83 2.88 35 F C C 62.63 17.44 10.62 27.17 120.76 91.20 -105.04 136.38 65.30 33.89 0.80 51.89 10.59 1.78 0.29 0.63 0.00 24.32 10.48 36 H C C 120.12 4.34 18.75 24.00 116.46 -145.98 -97.29 128.57 81.15 18.38 0.47 74.87 4.71 1.05 0.13 0.35 0.00 15.69 3.20 37 A C C 61.93 10.60 12.98 24.29 112.00 -117.02 -68.18 139.12 86.09 11.67 2.24 36.78 20.57 29.32 0.38 2.06 0.00 8.34 2.55 38 G C S 37.82 5.37 16.74 23.41 129.73 59.06 129.24 -170.58 91.51 6.14 2.35 21.94 34.93 34.85 0.24 2.42 0.00 3.86 1.76 39 A C T 86.12 2.63 18.64 21.32 96.19 -56.28 -73.76 -17.73 94.43 3.55 2.02 4.05 33.68 57.04 0.11 2.00 0.00 2.37 0.75 40 N C T 54.71 13.98 16.18 30.01 97.81 40.25 -98.41 5.68 91.86 7.53 0.61 7.93 26.64 56.93 0.03 0.74 0.00 7.38 0.36 41 V E E 20.95 20.78 14.04 34.49 125.49 88.62 -114.56 140.41 10.31 89.67 0.02 8.82 0.99 0.05 0.00 0.01 0.00 89.76 0.37 42 G E E 20.56 8.09 23.72 32.71 141.53 164.00 -154.51 176.63 0.56 99.43 0.00 0.49 0.02 0.00 0.00 0.00 0.00 99.45 0.03 43 C E E 56.22 13.94 16.14 30.13 125.17 -107.23 -118.85 141.82 1.18 98.82 0.00 1.17 0.03 0.00 0.00 0.00 0.00 98.55 0.24 44 G C C 20.68 10.53 12.72 24.59 126.66 -143.45 -88.86 -177.20 85.50 14.46 0.04 84.62 0.67 0.10 0.00 0.02 0.00 14.16 0.43 45 R C T 197.16 0.87 14.96 15.24 91.47 -88.26 -63.88 -23.37 96.83 0.85 2.32 0.63 8.71 87.00 0.03 2.87 0.00 0.59 0.16 46 D C T 98.07 2.93 15.86 19.32 93.74 51.78 -89.95 6.99 97.65 0.11 2.24 0.43 6.79 89.76 0.02 2.90 0.00 0.06 0.02 47 H C S 69.53 12.71 14.88 28.19 93.63 -107.11 71.39 21.71 94.40 3.08 2.53 17.36 54.80 21.08 0.09 3.52 0.00 2.81 0.35 48 T E E 24.53 12.14 20.92 34.43 119.21 144.78 -86.31 143.58 45.62 54.37 0.01 46.10 0.45 0.03 0.00 0.00 0.00 52.70 0.72 49 L E E 4.01 25.07 19.17 45.19 115.37 -127.68 -90.28 130.46 0.12 99.88 0.00 0.12 0.00 0.00 0.00 0.00 0.00 99.86 0.02 50 F E E 44.38 12.40 26.81 39.73 128.81 -173.42 -126.93 144.60 0.06 99.94 0.00 0.05 0.00 0.00 0.00 0.00 0.00 99.94 0.00 51 A E E 6.38 23.21 15.07 38.83 112.07 -117.44 -78.58 131.32 4.80 95.20 0.00 4.92 0.07 0.00 0.00 0.00 0.00 94.77 0.24 52 K C S 103.32 6.19 23.04 29.91 95.61 -160.44 -87.13 -21.23 93.22 6.54 0.24 22.47 62.81 7.23 0.01 0.31 0.00 6.90 0.26 53 A C S 42.03 6.16 21.78 28.61 137.10 22.36 -140.41 164.89 93.50 6.23 0.27 2.60 81.85 9.31 0.01 0.23 0.00 5.69 0.31 54 D C C 89.13 6.12 21.06 27.90 113.54 -90.00 -68.55 141.96 94.29 5.45 0.25 59.62 29.22 4.92 0.01 0.39 0.00 5.60 0.23 55 G E E 12.49 10.46 20.04 32.45 143.39 97.31 159.70 -172.41 23.27 76.72 0.01 20.49 2.46 0.14 0.00 0.01 0.00 76.30 0.60 56 K E E 81.09 7.99 24.50 33.36 125.14 -66.92 -117.24 140.91 0.49 99.51 0.00 0.47 0.01 0.00 0.00 0.00 0.00 99.47 0.04 57 V E E 6.31 25.14 14.94 40.77 119.97 -151.40 -106.64 131.02 0.32 99.68 0.00 0.30 0.00 0.00 0.00 0.00 0.00 99.69 0.00 58 K E E 76.81 7.96 25.90 34.34 123.43 -166.92 -118.44 137.10 0.42 99.58 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.62 0.00 59 F E E 27.07 21.63 14.81 36.08 123.54 -159.84 -115.14 137.53 0.80 99.20 0.00 0.70 0.02 0.00 0.00 0.00 0.00 99.26 0.02 60 E E E 80.85 6.53 21.56 28.79 124.74 -170.85 -123.71 142.86 1.19 98.80 0.00 1.04 0.06 0.00 0.00 0.00 0.00 98.88 0.02 61 V E E 54.64 12.84 12.06 25.65 118.03 -143.39 -106.63 128.98 5.90 94.08 0.01 5.18 0.36 0.03 0.00 0.01 0.00 94.24 0.17 62 K E E 113.70 4.65 12.98 19.34 116.05 -161.71 -107.49 129.04 32.37 67.46 0.17 26.39 4.65 0.72 0.03 0.15 0.00 67.48 0.59 63 G C T 43.56 3.03 11.72 15.91 124.44 3.50 95.81 -169.30 83.92 5.75 10.33 11.05 22.54 48.89 0.33 11.92 0.00 4.56 0.72 64 P C T 119.93 1.10 10.59 11.95 97.00 -33.08 -71.25 -15.93 87.54 0.68 11.78 4.26 12.03 68.02 0.35 14.66 0.00 0.45 0.24 65 K C T 147.02 1.90 10.24 12.99 100.27 44.40 -88.35 14.01 88.43 0.60 10.98 4.32 10.48 70.61 0.32 13.68 0.00 0.39 0.20 66 N C T 117.03 3.44 11.52 16.62 97.60 -116.10 50.11 37.49 95.27 2.78 1.95 19.37 14.83 60.81 0.14 2.18 0.00 2.32 0.35 67 R E E 101.12 7.40 12.19 21.35 120.28 154.26 -98.10 142.16 41.36 58.51 0.13 34.84 3.95 0.97 0.02 0.12 0.00 59.60 0.51 68 K E E 88.90 9.90 15.53 26.43 119.99 -137.87 -100.68 135.73 7.15 92.84 0.01 6.27 0.41 0.04 0.00 0.01 0.00 93.18 0.10 69 F E E 58.44 12.89 17.76 31.45 128.25 -167.39 -123.67 145.83 0.69 99.31 0.00 0.60 0.02 0.00 0.00 0.00 0.00 99.36 0.01 70 I E E 26.92 17.58 17.70 35.85 122.59 -153.01 -116.42 133.48 0.39 99.61 0.00 0.34 0.01 0.00 0.00 0.00 0.00 99.65 0.00 71 S E E 30.89 11.13 22.40 34.27 125.55 -164.44 -116.64 143.70 0.67 99.33 0.00 0.56 0.02 0.00 0.00 0.00 0.00 99.42 0.00 72 I E E 27.49 18.60 16.03 35.00 123.01 -159.21 -117.16 133.02 1.77 98.23 0.00 1.56 0.07 0.00 0.00 0.00 0.00 98.31 0.05 73 E E E 90.03 7.43 19.09 27.41 121.33 -162.70 -111.73 134.37 8.39 91.58 0.03 7.69 0.39 0.05 0.01 0.02 0.00 91.54 0.29 74 A E E 49.50 10.93 11.92 23.58 117.46 -136.32 -87.00 144.37 40.46 59.38 0.16 38.98 0.82 0.25 0.03 0.10 0.00 59.22 0.60 75 E C C 129.35 4.19 15.38 20.88 110.39 -118.77 -81.24 128.64 99.57 0.42 0.01 99.55 0.09 0.03 0.00 0.00 0.00 0.32 0.01