# 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 113.56 6.41 12.27 19.99 115.27 -138.93 -93.71 135.15 99.87 0.12 0.00 99.84 0.06 0.02 0.00 0.00 0.00 0.07 0.01 1 K C C 132.24 3.46 13.51 18.59 118.00 -151.82 -101.37 137.05 79.49 20.37 0.13 79.28 0.55 0.27 0.03 0.06 0.00 19.06 0.76 2 V E E 79.54 9.22 11.06 21.53 121.45 -146.36 -110.01 136.67 48.12 51.78 0.10 43.89 2.47 0.22 0.02 0.08 0.00 52.64 0.68 3 E E E 82.40 7.87 15.37 24.75 125.25 -169.46 -119.55 144.98 7.59 92.36 0.05 6.99 0.57 0.07 0.01 0.03 0.00 91.91 0.42 4 I E E 93.80 6.92 16.85 25.10 118.02 -129.38 -98.20 133.82 3.06 96.91 0.03 2.95 0.16 0.01 0.03 0.01 0.00 88.10 8.74 5 D C C 18.58 17.33 10.46 28.57 109.00 -118.08 -74.32 124.23 86.09 13.89 0.02 86.90 0.41 0.05 0.00 0.01 0.00 11.85 0.77 6 S C T 70.56 5.00 17.66 23.96 92.64 -149.99 -71.12 -21.56 99.79 0.10 0.12 0.35 4.73 94.73 0.00 0.11 0.00 0.07 0.02 7 F C T 94.92 9.93 15.00 25.33 99.23 45.48 -82.87 -40.16 99.86 0.05 0.09 0.06 2.64 97.20 0.00 0.07 0.00 0.02 0.01 8 S C T 53.29 6.38 14.23 22.04 101.27 19.73 -105.03 -14.24 99.86 0.06 0.08 0.37 3.93 95.58 0.00 0.08 0.00 0.03 0.01 9 G C C 47.54 4.09 14.52 20.04 95.55 -121.50 80.20 5.56 99.30 0.63 0.07 83.80 11.00 4.50 0.01 0.07 0.00 0.36 0.26 10 A C C 50.05 6.33 14.06 22.36 119.06 139.38 -78.40 147.88 96.00 3.98 0.02 91.26 4.81 0.12 0.00 0.01 0.00 3.47 0.32 11 K E E 127.69 4.78 19.01 25.02 114.17 -113.91 -77.89 134.99 2.14 97.85 0.01 2.01 0.13 0.00 0.01 0.00 0.00 85.64 12.21 12 I E E 18.97 20.65 10.82 31.11 124.12 -161.68 -121.12 137.92 9.94 90.05 0.02 9.78 0.31 0.01 0.01 0.01 0.00 84.55 5.34 13 Y C C 111.92 4.89 20.43 25.61 117.96 -125.57 -86.39 143.88 92.94 6.98 0.07 91.55 1.58 0.17 0.01 0.06 0.00 6.07 0.56 14 P C T 77.81 9.39 14.07 24.46 109.63 -85.97 -59.15 135.29 92.93 1.38 5.69 2.71 7.21 82.16 0.19 6.37 0.00 0.97 0.38 15 G C T 54.85 3.00 16.67 20.37 94.60 20.73 85.00 -3.58 92.82 1.09 6.10 2.83 6.96 82.29 0.26 6.62 0.00 0.82 0.23 16 R C C 135.69 5.03 16.81 22.98 106.86 96.88 -104.15 2.45 86.20 5.35 8.45 46.51 24.77 13.69 0.76 9.31 0.00 3.29 1.67 17 G C S 23.48 11.71 15.26 27.43 132.95 39.09 142.81 -173.26 87.11 12.49 0.40 38.64 45.32 3.46 0.05 0.42 0.00 11.18 0.93 18 T E E 57.70 8.91 19.82 29.43 122.90 -61.75 -110.42 139.60 29.57 70.30 0.12 23.11 5.02 0.60 0.01 0.11 0.00 70.72 0.42 19 L E E 44.41 15.58 15.99 31.99 119.77 -149.29 -109.20 133.72 2.18 97.82 0.00 1.93 0.10 0.00 0.00 0.00 0.00 97.90 0.06 20 F E E 58.49 10.58 18.12 30.11 124.09 -169.04 -117.59 140.99 0.22 99.78 0.00 0.20 0.01 0.00 0.00 0.00 0.00 99.79 0.00 21 V E E 57.58 10.01 14.07 25.73 115.60 -145.52 -106.92 124.57 1.03 98.97 0.00 0.99 0.03 0.00 0.00 0.00 0.00 98.90 0.08 22 R C C 106.77 7.09 12.71 21.29 116.85 -173.04 -106.04 135.89 60.03 39.80 0.17 56.72 1.53 0.35 0.02 0.13 0.00 40.61 0.64 23 G C T 51.10 2.92 13.05 16.71 108.21 -63.83 63.62 -128.32 91.69 3.89 4.42 1.52 7.82 81.89 0.07 5.10 0.00 3.23 0.36 24 D C T 117.78 1.78 11.54 13.99 98.10 6.28 -85.66 9.27 96.07 0.13 3.80 0.63 5.20 89.41 0.05 4.59 0.00 0.07 0.04 25 S C T 84.02 3.26 11.93 16.51 97.49 -67.94 68.51 10.35 94.32 0.61 5.07 7.51 40.80 44.47 0.13 6.52 0.00 0.39 0.18 26 K C C 102.85 4.87 13.82 20.48 117.38 128.81 -86.69 140.58 65.49 34.41 0.10 61.87 1.86 0.36 0.02 0.07 0.00 34.70 1.12 27 I E E 68.46 11.20 14.06 26.52 120.62 -151.54 -112.39 131.67 1.06 98.93 0.00 1.08 0.03 0.00 0.00 0.00 0.00 98.79 0.11 28 F E E 49.41 13.10 17.48 31.80 124.38 -169.21 -118.85 138.80 0.15 99.85 0.00 0.15 0.00 0.00 0.00 0.00 0.00 99.84 0.00 29 R E E 99.62 9.97 21.54 31.98 120.46 -152.18 -108.32 132.03 0.63 99.37 0.00 0.57 0.02 0.00 0.00 0.00 0.00 99.38 0.03 30 F E E 22.61 18.81 13.12 32.25 118.27 -144.65 -93.98 141.79 17.49 82.49 0.03 17.43 0.32 0.03 0.01 0.01 0.00 81.50 0.70 31 Q C S 92.94 6.87 19.09 27.04 96.44 -150.64 -82.68 -24.01 99.21 0.76 0.04 14.40 84.22 0.71 0.01 0.02 0.00 0.60 0.05 32 N C S 65.27 4.34 19.98 24.69 137.93 8.94 -146.70 164.82 98.99 0.50 0.51 18.72 79.60 0.74 0.44 0.07 0.00 0.13 0.30 33 S H H 76.33 4.40 15.14 21.15 91.50 -101.78 -61.12 -35.44 4.84 0.02 95.14 0.63 0.97 3.00 93.87 1.49 0.02 0.00 0.01 34 K H H 138.82 1.82 19.54 20.87 91.40 53.56 -64.09 -40.11 3.65 0.02 96.32 0.46 0.43 2.58 94.75 1.74 0.02 0.01 0.01 35 S H H 13.71 15.33 14.31 30.62 92.07 49.17 -65.21 -41.11 2.13 0.02 97.85 0.54 0.28 1.24 96.15 1.76 0.01 0.01 0.01 36 A H H 24.65 12.00 15.75 29.11 91.35 52.14 -62.66 -41.90 0.84 0.01 99.15 0.28 0.09 0.39 98.74 0.50 0.00 0.00 0.00 37 S H H 55.03 2.37 21.26 22.55 91.35 50.70 -63.66 -41.28 1.12 0.01 98.87 0.16 0.08 0.76 98.39 0.60 0.00 0.01 0.00 38 L H H 47.19 8.00 16.89 26.76 91.82 51.00 -64.92 -40.75 1.76 0.01 98.23 0.22 0.13 1.27 97.32 1.06 0.00 0.01 0.00 39 F H H 43.71 16.53 13.32 29.70 92.41 51.05 -65.27 -40.17 4.49 0.03 95.48 0.52 0.34 3.55 93.94 1.61 0.01 0.01 0.01 40 K H H 127.96 4.01 16.90 21.94 92.02 50.74 -67.79 -32.62 14.65 0.06 85.29 1.09 1.10 12.37 83.88 1.47 0.03 0.02 0.03 41 Q H H 117.49 2.21 15.84 18.02 95.72 52.75 -83.87 -9.35 47.18 0.36 52.46 5.32 7.41 33.96 50.87 2.03 0.06 0.11 0.25 42 R C T 128.43 9.53 11.96 22.24 100.03 -141.44 5.41 39.73 74.60 1.06 24.34 29.08 10.82 34.35 21.61 3.07 0.01 0.41 0.65 43 K C C 125.00 4.66 14.14 20.20 102.62 158.85 -86.13 -15.71 84.49 1.29 14.22 47.61 22.48 13.84 11.85 2.82 0.00 0.47 0.93 44 N C C 73.19 6.21 14.29 22.08 110.02 29.43 -115.72 101.73 94.69 0.43 4.88 76.79 15.26 2.27 4.51 0.73 0.00 0.14 0.29 45 P H H 62.39 11.62 11.32 24.06 93.33 -163.58 -63.40 -23.68 35.22 0.61 64.17 15.62 4.30 14.18 45.98 19.30 0.01 0.35 0.25 46 R H H 152.70 3.17 15.77 20.05 92.75 66.54 -68.83 -24.17 26.88 1.12 72.01 9.25 3.59 12.85 52.58 20.60 0.04 0.79 0.31 47 R H H 127.22 5.49 16.68 23.01 95.36 55.32 -80.25 -18.38 19.96 2.05 77.99 9.95 3.27 6.77 56.96 21.02 0.03 1.58 0.41 48 I H H 43.29 14.88 12.98 27.93 95.49 71.30 -70.29 -37.18 19.93 1.69 78.38 13.09 3.65 4.78 69.89 6.99 0.02 1.18 0.40 49 A H H 54.39 5.56 18.27 24.56 93.42 60.18 -64.20 -39.19 17.80 1.00 81.20 10.23 2.56 5.74 76.83 3.69 0.01 0.68 0.25 50 W H H 120.66 4.99 18.62 24.18 92.85 51.54 -67.13 -38.88 13.12 0.61 86.26 6.57 1.87 5.19 82.76 3.03 0.01 0.42 0.14 51 T H H 31.81 10.93 15.69 28.11 92.75 52.28 -65.80 -42.03 6.42 0.42 93.16 4.06 0.90 2.00 91.20 1.47 0.00 0.30 0.07 52 V H H 54.77 7.57 17.08 25.94 91.95 50.80 -64.05 -42.40 2.29 0.19 97.51 1.25 0.32 0.90 96.62 0.72 0.00 0.15 0.02 53 L H H 79.44 3.25 17.93 21.37 91.73 50.08 -64.05 -42.08 1.82 0.14 98.04 0.84 0.23 0.84 97.29 0.68 0.01 0.11 0.02 54 F H H 84.99 5.13 15.72 22.26 91.91 49.39 -64.94 -41.54 2.09 0.11 97.80 0.79 0.24 1.08 97.06 0.73 0.01 0.08 0.01 55 R H H 91.41 7.76 13.44 22.56 92.11 50.61 -65.20 -40.45 2.91 0.07 97.02 0.86 0.32 1.68 96.20 0.88 0.01 0.05 0.01 56 K H H 117.37 2.69 14.13 17.53 92.09 50.23 -65.70 -39.48 5.91 0.07 94.02 1.27 0.62 3.87 92.93 1.23 0.01 0.04 0.02 57 H H H 128.79 1.71 13.60 15.27 93.40 48.19 -68.99 -35.79 13.20 0.11 86.69 2.50 1.52 8.94 85.37 1.55 0.02 0.04 0.05 58 H H H 116.43 3.73 10.81 15.98 96.99 45.26 -81.82 -20.85 30.69 0.45 68.86 7.84 4.71 18.32 66.88 1.80 0.04 0.18 0.23 59 K C H 134.05 3.62 9.36 14.59 99.95 64.51 -81.26 -6.68 53.89 1.57 44.54 23.89 7.71 22.09 42.72 2.18 0.03 0.65 0.72 60 K C C 155.29 1.63 9.57 12.41 106.49 92.31 -86.66 59.05 80.04 1.00 18.96 59.64 1.67 16.44 20.11 1.14 0.00 0.45 0.55 61 G C C 53.97 2.35 12.17 15.72 111.53 -40.66 87.29 -7.95 99.97 0.02 0.01 99.82 0.08 0.07 0.00 0.00 0.00 0.01 0.00