# 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 F C C 90.84 11.44 19.22 30.63 122.83 -152.84 -106.96 138.34 98.80 1.16 0.04 98.14 0.76 0.08 0.02 0.01 0.00 0.45 0.54 1 C C C 15.67 17.81 13.52 31.82 116.59 -123.38 -80.67 142.33 95.94 2.88 1.18 94.60 1.12 0.32 1.12 0.09 0.00 0.65 2.09 2 R H H 115.69 6.00 20.00 27.00 92.39 -124.45 -61.90 -35.03 7.38 0.05 92.57 0.83 1.21 5.55 90.04 2.29 0.05 0.02 0.03 3 F H H 27.92 16.99 14.55 31.82 92.32 52.62 -66.30 -40.03 6.55 0.07 93.38 0.60 0.76 5.44 89.00 4.06 0.07 0.03 0.03 4 T H H 41.91 13.16 14.22 27.71 94.18 47.27 -68.96 -38.99 4.45 0.06 95.49 0.61 0.53 3.39 90.18 5.19 0.04 0.04 0.02 5 A H H 71.47 3.80 15.74 20.64 91.98 55.63 -67.45 -28.26 11.31 0.09 88.60 0.91 1.13 9.54 83.81 4.42 0.08 0.04 0.05 6 E C T 118.38 3.78 14.94 19.72 95.05 51.37 -86.31 -2.89 73.21 0.09 26.70 0.71 2.08 70.18 24.50 2.39 0.02 0.03 0.10 7 G C T 45.90 3.80 16.20 21.12 99.07 -106.69 82.56 16.50 98.00 0.04 1.96 4.35 2.11 92.01 1.14 0.35 0.00 0.02 0.02 8 V C C 35.89 17.12 8.96 25.36 112.13 153.68 -81.48 125.41 91.65 1.84 6.50 88.10 2.20 2.10 1.74 4.04 0.00 0.97 0.84 9 Q C C 131.59 2.71 18.40 21.93 100.35 154.35 -94.50 -21.50 89.29 2.80 7.91 49.83 29.64 9.20 1.33 7.34 0.00 1.70 0.96 10 E C C 116.75 4.12 20.43 25.42 125.47 30.19 -127.95 138.55 79.08 11.85 9.07 57.60 13.12 7.67 1.71 8.40 0.01 8.47 3.02 11 I C C 23.68 22.53 10.82 32.42 120.21 -162.72 -114.05 130.11 87.30 10.70 2.00 83.10 3.72 0.71 0.89 1.05 0.00 7.04 3.48 12 D C C 67.94 5.56 22.39 28.29 109.61 -153.86 -102.09 111.48 96.71 2.55 0.75 95.46 1.26 0.49 0.23 0.31 0.00 1.43 0.81 13 Y C T 53.84 19.77 12.00 31.32 94.30 -169.82 -74.74 -11.74 87.58 0.52 11.90 7.91 8.74 70.24 1.59 10.97 0.00 0.30 0.26 14 K C T 144.45 2.90 18.00 21.74 92.16 67.16 -76.90 -14.32 88.40 0.32 11.28 3.95 11.38 72.65 1.38 10.28 0.00 0.18 0.20 15 D C C 68.84 6.11 15.79 23.43 107.38 69.77 -107.15 94.85 91.19 1.50 7.31 73.13 12.75 4.54 2.29 5.45 0.00 0.55 1.29 16 I H H 63.22 15.81 11.76 27.36 93.64 176.50 -64.10 -34.93 6.15 0.04 93.81 1.76 0.96 3.34 85.17 8.73 0.01 0.02 0.02 17 A H H 71.92 2.10 19.04 20.68 91.59 59.32 -63.41 -38.75 2.54 0.01 97.45 0.18 0.18 2.01 86.35 11.27 0.00 0.00 0.00 18 T H H 42.77 8.69 17.46 27.58 92.61 50.10 -66.37 -39.30 1.66 0.01 98.33 0.12 0.11 1.30 87.15 11.30 0.00 0.00 0.00 19 L H H 5.54 24.84 12.29 37.08 91.63 53.05 -65.72 -36.92 2.22 0.01 97.77 0.22 0.18 1.62 88.10 9.86 0.00 0.01 0.00 20 K H H 110.47 9.75 19.26 29.56 90.86 60.61 -63.54 -31.69 12.52 0.06 87.42 0.59 0.63 10.24 58.42 30.03 0.03 0.03 0.03 21 N H T 105.69 3.01 22.95 25.77 91.60 57.32 -74.30 -19.37 39.61 0.07 60.32 0.69 1.47 38.16 32.26 27.31 0.02 0.03 0.07 22 Y C T 28.75 19.23 16.24 35.73 97.37 47.65 -99.66 -7.31 53.61 0.37 46.02 2.79 4.47 45.45 19.71 27.07 0.03 0.22 0.26 23 I E B 23.73 20.32 13.22 33.39 122.57 87.62 -101.84 141.11 5.06 94.81 0.13 2.84 0.55 0.02 0.14 0.01 0.00 9.14 87.30 24 T C C 42.73 8.34 15.73 25.71 123.48 -133.47 -82.04 171.71 94.63 5.27 0.10 95.24 0.36 0.10 0.04 0.03 0.00 3.28 0.95 25 E C T 160.22 1.79 14.61 17.51 90.15 -91.83 -63.12 -22.29 98.93 0.55 0.52 0.46 3.37 95.34 0.05 0.34 0.00 0.34 0.10 26 S C T 78.73 2.09 17.32 19.11 92.41 56.73 -86.53 -3.15 99.44 0.11 0.45 0.22 3.14 96.18 0.02 0.34 0.00 0.06 0.03 27 G C S 16.51 16.22 13.00 29.19 95.54 -107.11 83.88 7.99 99.47 0.32 0.21 11.27 87.31 1.01 0.02 0.13 0.00 0.12 0.12 28 K C C 99.97 5.17 22.10 28.22 120.19 136.46 -85.94 145.54 94.31 5.61 0.08 76.21 18.23 0.23 0.04 0.04 0.00 2.82 2.43 29 I E B 28.71 21.25 14.94 35.98 112.56 -112.74 -78.31 130.83 8.16 91.76 0.08 5.81 0.53 0.02 0.09 0.01 0.00 11.33 82.21 30 V C C 33.51 14.14 17.92 32.94 115.67 -130.06 -85.76 133.12 93.82 6.08 0.10 92.99 1.40 0.08 0.05 0.03 0.00 4.84 0.61 31 P C C 48.72 9.14 19.37 29.50 113.69 -107.11 -66.87 146.13 92.27 2.99 4.74 88.32 2.93 1.53 2.90 1.41 0.00 1.72 1.18 32 S H G 55.47 12.52 13.43 26.31 92.60 -120.99 -62.95 -24.77 46.67 0.98 52.34 12.60 9.63 24.06 21.97 30.60 0.04 0.49 0.61 33 R H G 168.50 2.11 17.75 20.09 91.94 65.09 -71.83 -19.50 44.06 1.87 54.07 10.69 8.84 23.73 24.80 29.81 0.17 0.98 0.97 34 I H H 71.38 11.02 13.75 25.36 98.95 57.27 -88.78 -8.46 46.75 3.71 49.54 17.60 12.74 17.48 24.89 23.46 0.21 1.83 1.79 35 T C C 47.48 14.86 12.19 26.53 106.14 68.04 -95.59 7.60 70.16 3.55 26.29 35.71 17.88 17.33 20.01 5.50 0.08 1.43 2.07 36 G C S 54.27 3.08 18.11 21.75 99.81 -104.58 81.36 4.16 88.94 2.21 8.85 28.91 38.98 21.75 4.86 3.32 0.01 0.98 1.19 37 T C S 42.69 14.67 10.61 25.09 120.51 112.30 -95.20 150.76 87.02 3.57 9.41 36.45 41.43 9.36 6.57 2.64 0.02 1.38 2.14 38 R C C 126.51 4.01 17.57 21.94 115.30 -103.96 -75.72 151.58 87.64 3.71 8.65 76.47 7.51 2.88 7.76 1.50 0.00 1.32 2.56 39 A H H 65.54 6.55 13.84 21.95 92.62 -112.83 -58.37 -38.74 2.72 0.01 97.26 0.78 0.49 1.23 96.97 0.52 0.00 0.00 0.00 40 K H H 131.57 1.98 19.08 20.59 91.85 53.83 -64.58 -40.09 1.15 0.00 98.84 0.20 0.11 0.72 98.51 0.46 0.00 0.00 0.00 41 Y H H 58.26 12.53 16.83 30.08 92.43 48.26 -66.57 -40.55 0.48 0.00 99.52 0.10 0.04 0.27 99.19 0.40 0.00 0.00 0.00 42 Q H H 36.72 16.87 16.05 32.70 91.78 52.91 -62.87 -42.27 0.16 0.00 99.84 0.03 0.01 0.08 99.79 0.08 0.00 0.00 0.00 43 R H H 128.73 3.39 23.27 26.48 91.63 50.28 -64.06 -41.16 0.16 0.00 99.84 0.02 0.01 0.10 99.84 0.04 0.00 0.00 0.00 44 Q H H 75.00 6.93 22.94 30.20 91.67 49.53 -64.69 -41.59 0.12 0.00 99.88 0.01 0.00 0.08 99.87 0.03 0.00 0.00 0.00 45 L H H 11.51 21.62 18.58 40.02 92.12 49.84 -64.60 -42.10 0.11 0.00 99.89 0.01 0.00 0.07 99.89 0.02 0.00 0.00 0.00 46 A H H 27.00 12.86 21.76 34.97 91.58 51.63 -62.94 -42.29 0.11 0.00 99.89 0.01 0.00 0.08 99.89 0.02 0.00 0.00 0.00 47 R H H 126.16 2.79 26.16 28.14 91.60 49.69 -64.20 -41.75 0.11 0.00 99.89 0.01 0.00 0.08 99.89 0.02 0.00 0.00 0.00 48 A H H 16.01 13.23 21.04 35.38 91.74 50.26 -64.13 -42.76 0.16 0.00 99.84 0.01 0.00 0.11 99.84 0.03 0.00 0.00 0.00 49 I H H 14.34 21.21 19.14 39.93 91.88 49.66 -64.27 -42.79 0.21 0.00 99.79 0.02 0.01 0.13 99.78 0.05 0.00 0.00 0.00 50 K H H 97.08 6.89 23.58 30.76 91.50 50.82 -63.19 -41.94 0.22 0.00 99.78 0.02 0.01 0.14 99.76 0.06 0.00 0.00 0.00 51 R H H 111.80 4.13 23.37 27.38 91.73 49.36 -64.62 -41.69 0.23 0.00 99.77 0.02 0.01 0.15 99.72 0.10 0.00 0.00 0.00 52 A H H 10.30 15.33 15.98 32.71 91.82 50.83 -63.78 -42.06 0.25 0.00 99.75 0.02 0.01 0.17 99.61 0.19 0.00 0.00 0.00 53 R H H 84.21 11.32 16.84 28.64 92.12 50.85 -63.80 -41.08 0.48 0.00 99.52 0.03 0.02 0.37 99.22 0.35 0.00 0.00 0.00 54 Y H H 141.36 2.89 17.34 20.63 92.42 49.07 -66.18 -38.44 0.99 0.00 99.01 0.05 0.04 0.85 98.65 0.41 0.00 0.00 0.00 55 L H H 93.64 4.65 14.79 20.64 93.90 50.18 -75.10 -26.66 7.62 0.01 92.37 0.14 0.22 7.90 90.98 0.75 0.01 0.00 0.00 56 S C T 71.22 5.51 14.71 21.23 97.75 19.29 -80.39 -10.71 59.68 0.03 40.29 0.38 1.08 58.29 39.31 0.90 0.01 0.01 0.02 57 L C T 95.37 5.82 14.80 21.83 98.73 55.84 -87.92 -10.02 79.45 0.24 20.31 4.09 8.47 64.48 21.22 1.43 0.01 0.08 0.22 58 L C S 57.11 11.96 9.59 22.23 118.18 72.42 -102.77 135.53 93.43 1.22 5.36 40.34 48.05 5.20 2.40 2.69 0.00 0.46 0.85 59 P C C 89.05 3.65 14.24 19.04 105.37 -117.33 -68.98 126.85 92.33 0.81 6.86 60.60 17.93 13.38 1.75 5.50 0.00 0.42 0.42 60 Y C C 147.17 5.66 11.10 18.36 111.97 -133.87 -92.98 114.19 84.44 5.19 10.37 59.87 12.78 11.03 3.62 7.05 0.00 2.42 3.23 61 T C C 75.88 6.19 9.93 17.80 119.20 147.49 -108.57 139.99 86.95 3.51 9.53 66.59 11.88 8.22 3.82 5.80 0.00 1.97 1.72 62 D C C 105.38 3.47 9.81 15.08 107.06 -148.98 -88.25 72.00 84.37 1.88 13.74 47.35 21.57 15.66 3.85 9.71 0.00 0.98 0.88 63 R C C 164.52 2.58 9.35 13.61 107.54 109.24 -91.99 97.62 84.26 1.86 13.88 47.06 19.02 18.22 3.19 10.68 0.00 0.97 0.85 64 H C C 129.38 4.19 7.31 13.39 111.39 99.77 -93.26 116.12 89.67 1.71 8.62 79.32 2.09 9.65 2.34 4.84 0.00 1.07 0.70 65 Q C C 131.39 2.81 10.97 15.58 113.37 -162.04 -100.90 122.60 99.81 0.12 0.07 99.62 0.13 0.12 0.03 0.01 0.00 0.07 0.02