# 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 108.49 6.40 10.96 18.79 114.32 -149.43 -91.07 132.65 99.95 0.04 0.01 99.88 0.06 0.03 0.00 0.00 0.00 0.02 0.01 1 D C C 102.74 3.42 10.22 15.35 110.23 -152.25 -88.84 111.05 91.63 1.53 6.83 85.22 1.36 5.86 1.06 5.03 0.00 0.86 0.62 2 S C C 81.58 3.46 9.19 14.41 103.43 -151.96 -86.24 13.76 89.65 1.77 8.58 35.57 19.84 32.74 0.58 9.68 0.00 0.97 0.62 3 K C C 146.25 2.74 11.01 15.23 106.60 82.79 -88.19 42.86 88.04 3.00 8.96 37.19 22.70 27.04 0.55 9.88 0.00 1.74 0.89 4 T C S 73.46 6.69 10.56 18.94 117.12 91.74 -98.19 133.14 96.33 3.48 0.19 42.90 53.65 0.53 0.05 0.12 0.00 1.85 0.90 5 P C C 81.35 4.98 14.71 21.03 113.91 -109.12 -67.61 147.86 94.95 4.96 0.09 81.57 12.50 0.86 0.02 0.09 0.00 4.42 0.56 6 V C C 64.48 13.73 12.10 25.73 118.54 -126.33 -97.91 136.38 65.77 34.13 0.10 57.74 6.30 0.53 0.02 0.10 0.00 34.16 1.15 7 T E E 56.32 10.01 19.41 30.08 125.35 -165.14 -121.75 140.76 20.85 79.11 0.03 18.39 2.06 0.10 0.01 0.03 0.00 78.61 0.80 8 L E E 61.85 12.06 20.42 32.75 116.34 -124.48 -85.82 136.06 9.13 90.86 0.01 8.36 0.52 0.04 0.00 0.01 0.00 90.74 0.33 9 A E E 8.51 21.57 16.30 37.73 130.62 -165.54 -123.12 153.80 5.06 94.93 0.01 4.48 0.42 0.02 0.00 0.00 0.00 95.03 0.04 10 K E E 90.21 7.14 24.82 32.51 120.08 -135.19 -111.13 133.13 1.28 98.72 0.00 1.09 0.06 0.00 0.00 0.00 0.00 98.82 0.02 11 V E E 24.64 20.68 13.27 34.10 109.35 -118.80 -75.32 123.83 0.37 99.63 0.00 0.35 0.01 0.00 0.00 0.00 0.00 99.64 0.01 12 I E E 83.49 5.18 19.87 26.08 100.62 174.81 -97.28 -32.75 1.00 98.99 0.00 0.68 0.14 0.01 0.00 0.00 0.00 99.16 0.00 13 K E E 103.74 3.55 22.12 26.16 136.97 -0.84 -151.77 150.13 0.43 99.57 0.00 0.28 0.05 0.00 0.00 0.00 0.00 99.66 0.00 14 V E E 58.40 16.66 12.66 28.72 116.39 -142.11 -110.76 123.67 0.36 99.64 0.00 0.34 0.01 0.00 0.00 0.00 0.00 99.65 0.00 15 L E E 79.60 6.70 16.84 24.80 106.24 -166.95 -97.79 12.18 1.63 98.37 0.01 1.30 0.15 0.02 0.00 0.00 0.00 98.50 0.02 16 G E E 33.70 6.14 16.40 23.81 137.13 -45.77 156.80 176.31 5.02 94.96 0.01 3.54 1.15 0.11 0.00 0.01 0.00 95.14 0.05 17 R E E 136.11 6.10 12.71 20.82 123.89 -92.26 -114.39 144.23 9.39 90.57 0.04 8.50 0.61 0.06 0.01 0.02 0.00 89.99 0.81 18 T E E 87.00 5.00 10.71 17.62 118.52 -150.38 -108.10 141.10 36.99 62.66 0.34 30.95 5.22 0.74 0.11 0.26 0.00 60.10 2.61 19 G C S 46.80 2.28 11.47 14.95 125.98 27.88 111.59 -172.00 80.63 6.72 12.64 18.12 32.92 30.42 1.13 11.25 0.01 4.94 1.21 20 S C T 102.88 0.68 10.21 10.71 95.84 -67.92 -70.44 -21.00 80.96 0.83 18.21 4.09 22.36 53.46 1.01 18.17 0.00 0.46 0.44 21 R C T 183.68 1.07 10.33 11.75 101.22 53.91 -89.69 10.81 79.05 0.93 20.02 3.18 14.45 59.80 1.05 20.52 0.00 0.53 0.48 22 G C T 44.60 4.50 11.43 17.31 106.29 -77.31 85.05 3.57 85.28 2.33 12.39 14.75 22.15 47.93 1.09 11.88 0.00 1.46 0.73 23 G C C 40.37 5.01 13.68 19.95 105.38 -27.60 65.09 2.16 81.21 17.33 1.47 48.26 15.64 17.05 0.24 1.36 0.00 16.04 1.41 24 V E E 56.11 10.14 13.01 24.51 122.03 106.32 -108.18 141.05 36.66 63.25 0.08 33.11 2.37 0.20 0.02 0.06 0.00 63.43 0.82 25 T E E 38.31 11.38 16.46 29.36 121.72 -153.55 -111.14 138.20 5.50 94.47 0.03 5.09 0.19 0.02 0.01 0.01 0.00 94.56 0.12 26 Q E E 63.27 11.00 19.11 30.97 120.87 -146.28 -105.36 137.56 1.31 98.68 0.01 1.13 0.07 0.01 0.00 0.00 0.00 98.77 0.02 27 V E E 14.69 18.40 16.02 35.17 125.84 -166.11 -121.18 139.89 1.16 98.84 0.00 1.03 0.03 0.00 0.00 0.00 0.00 98.92 0.01 28 R E E 83.73 8.63 22.89 32.31 117.84 -143.64 -103.19 130.27 0.69 99.31 0.00 0.61 0.02 0.00 0.00 0.00 0.00 99.36 0.01 29 V E E 13.55 20.56 15.41 36.22 122.52 -169.34 -116.29 135.12 1.67 98.33 0.00 1.50 0.05 0.00 0.00 0.00 0.00 98.41 0.03 30 E E E 70.32 7.53 21.92 30.32 120.85 -160.14 -114.60 131.17 2.70 97.28 0.02 2.40 0.11 0.01 0.00 0.01 0.00 97.40 0.07 31 F E E 50.75 14.42 13.27 28.61 114.45 -138.39 -91.82 128.18 11.04 88.82 0.14 9.35 1.26 0.22 0.03 0.08 0.00 88.71 0.34 32 L C E 72.11 7.56 13.40 22.60 114.41 -155.95 -98.67 139.51 49.83 49.13 1.04 32.75 12.74 4.65 0.16 0.86 0.00 48.15 0.68 33 E C S 144.38 2.42 13.01 16.25 99.67 -108.90 -80.46 -6.83 73.75 25.13 1.12 17.79 36.72 18.82 0.10 1.13 0.00 24.51 0.93 34 D C C 78.91 4.36 10.54 16.68 113.48 83.03 -110.17 110.41 85.75 13.12 1.13 48.63 24.08 13.14 0.14 1.22 0.00 11.69 1.10 35 T C T 105.25 3.11 9.72 14.87 95.82 -159.17 -74.70 -15.73 94.71 3.42 1.87 17.85 30.70 46.26 0.18 1.84 0.00 2.64 0.53 36 S C T 93.58 0.96 12.40 12.90 97.28 54.43 -88.24 -10.72 90.32 8.28 1.40 14.45 33.75 42.16 0.10 1.44 0.00 7.50 0.59 37 R C E 116.53 5.71 11.69 19.17 124.10 52.27 -124.93 137.47 55.16 44.06 0.77 40.68 11.06 2.89 0.11 0.73 0.00 43.64 0.89 38 T E E 62.55 10.02 12.27 23.56 126.80 -173.06 -124.58 142.47 20.66 79.24 0.10 18.21 1.61 0.22 0.02 0.06 0.00 79.47 0.41 39 I E E 56.78 10.27 15.47 27.50 120.55 -157.01 -114.25 129.73 3.54 96.40 0.05 3.10 0.33 0.05 0.02 0.02 0.00 96.34 0.14 40 V E E 71.68 10.26 16.65 27.94 121.12 -163.62 -115.32 129.69 1.89 98.07 0.03 1.75 0.09 0.02 0.01 0.01 0.00 98.02 0.09 41 R E E 91.84 10.10 17.19 28.23 129.23 -172.79 -130.87 143.74 6.52 93.42 0.06 5.68 0.48 0.07 0.01 0.02 0.00 93.65 0.08 42 N E E 88.57 6.05 19.80 26.51 111.92 -122.14 -81.83 127.87 12.93 86.99 0.09 10.83 1.63 0.15 0.02 0.04 0.00 87.10 0.24 43 V E E 24.19 20.02 10.47 29.72 118.50 -161.05 -105.31 132.18 15.86 84.05 0.09 15.04 0.66 0.07 0.05 0.04 0.00 78.94 5.20 44 K C E 147.06 2.35 19.22 21.69 102.98 -161.74 -95.63 7.85 63.17 36.74 0.09 33.91 29.41 0.99 0.01 0.10 0.00 34.26 1.33 45 G C S 31.72 3.84 20.76 24.66 139.18 -3.33 153.71 -177.39 87.62 12.36 0.03 4.61 81.21 1.13 0.00 0.02 0.00 12.81 0.22 46 P C C 78.67 5.67 19.67 26.03 114.76 -39.32 -67.47 143.81 86.69 13.28 0.03 78.11 7.55 0.34 0.00 0.04 0.00 13.31 0.65 47 V C C 16.88 22.96 10.51 32.70 121.49 -150.56 -109.11 136.61 57.20 42.74 0.05 59.97 0.90 0.06 0.03 0.03 0.00 19.49 19.53 48 R C C 121.60 3.82 23.05 26.97 129.12 -166.94 -118.21 157.36 73.31 26.62 0.07 75.00 1.23 0.09 0.02 0.04 0.00 13.18 10.43 49 E C T 112.14 8.27 14.95 24.27 109.58 -81.72 -59.79 135.78 96.98 2.21 0.81 0.44 3.26 93.95 0.05 0.62 0.00 1.47 0.21 50 N C T 115.68 2.90 19.23 22.61 93.76 19.41 78.29 0.63 97.92 1.23 0.85 0.82 3.96 93.15 0.05 0.81 0.00 1.16 0.05 51 D C C 38.54 13.64 14.06 28.64 118.05 132.38 -76.56 147.51 87.32 11.72 0.96 81.25 5.18 0.45 0.13 0.86 0.00 11.66 0.47 52 I E E 69.62 9.85 21.50 32.01 119.48 -138.52 -107.29 131.16 8.51 91.09 0.40 8.38 0.31 0.10 0.31 0.11 0.00 87.21 3.58 53 L E E 13.41 22.32 16.84 39.02 123.45 -165.01 -112.69 138.16 4.56 94.21 1.22 3.98 0.43 0.27 0.99 0.29 0.00 93.56 0.48 54 V E E 52.83 9.88 24.07 34.38 120.47 -157.58 -113.37 130.94 9.55 88.38 2.07 8.69 0.59 0.33 1.49 0.45 0.00 88.00 0.44 55 L E E 23.99 20.12 15.08 34.97 112.77 -135.57 -85.99 126.57 41.59 52.54 5.86 36.56 2.91 0.99 4.26 1.32 0.00 52.95 1.02 56 M C C 84.41 7.63 19.24 27.40 105.32 -149.28 -79.57 -34.96 56.47 16.86 26.68 43.67 7.21 4.63 21.15 5.71 0.02 16.23 1.39 57 E C C 102.16 5.79 17.73 24.06 102.13 -7.84 -74.57 -26.38 53.00 7.14 39.85 35.03 10.48 7.73 33.56 6.43 0.03 5.69 1.04 58 S H H 41.20 8.55 14.60 24.53 99.73 65.79 -75.48 -33.68 45.58 2.72 51.70 34.78 5.74 6.04 45.09 5.87 0.01 1.85 0.63 59 E H H 89.42 7.03 14.64 22.93 93.65 60.99 -65.68 -39.45 12.55 0.43 87.02 8.10 2.27 3.43 82.24 3.57 0.01 0.26 0.11 60 R H H 128.87 2.56 16.12 18.89 92.74 51.83 -65.75 -40.54 7.67 0.28 92.05 4.07 1.29 2.89 87.90 3.58 0.02 0.19 0.07 61 E H H 89.48 3.36 14.79 19.18 92.47 50.45 -65.88 -39.89 7.43 0.28 92.29 3.64 1.13 3.03 87.81 4.09 0.02 0.21 0.07 62 A H H 37.43 6.20 11.16 19.72 91.91 52.65 -64.87 -39.55 9.12 0.23 90.65 4.15 1.37 3.84 85.04 5.36 0.01 0.15 0.07 63 R H H 141.58 2.35 12.64 15.97 92.08 52.65 -65.45 -37.90 16.61 0.29 83.09 5.47 2.04 8.74 74.49 8.94 0.02 0.17 0.12 64 R H H 162.81 1.35 11.55 13.27 92.82 53.56 -67.83 -31.96 31.34 0.39 68.27 7.13 3.05 20.40 60.94 8.04 0.04 0.20 0.19 65 L C H 111.25 2.73 9.28 13.52 95.42 54.44 -78.00 -15.88 50.83 0.61 48.57 23.67 1.80 24.37 45.19 4.31 0.00 0.28 0.36 66 R C C 164.71 2.97 11.62 16.21 101.05 90.02 -72.65 44.13 99.82 0.07 0.12 99.50 0.14 0.21 0.09 0.00 0.00 0.03 0.01