# 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 48.15 3.58 11.62 16.73 120.00 17.57 106.00 132.37 99.88 0.10 0.02 99.46 0.33 0.12 0.01 0.00 0.00 0.05 0.02 1 I C C 131.18 2.19 9.13 12.75 112.53 -85.37 -94.73 123.65 89.45 4.24 6.32 82.21 3.11 4.47 3.11 2.61 0.00 2.32 2.18 2 T C C 103.71 2.06 7.64 11.40 111.51 110.99 -90.86 124.17 81.79 6.00 12.21 52.21 15.04 14.62 3.75 8.45 0.01 3.56 2.38 3 Y C C 164.41 2.78 7.02 11.55 111.46 -154.59 -97.30 116.25 76.83 6.27 16.90 41.71 16.57 19.19 4.21 12.20 0.02 3.33 2.77 4 K C T 165.75 1.15 8.73 10.78 107.96 -120.45 -88.43 97.32 82.17 2.90 14.93 27.02 18.76 37.26 3.24 10.81 0.02 1.51 1.38 5 G C T 59.39 1.40 9.07 11.39 110.55 -23.83 90.65 -11.95 89.78 2.91 7.31 30.20 24.94 35.24 1.22 5.79 0.00 1.61 1.00 6 V C C 111.98 2.51 7.07 11.46 115.63 30.42 -95.28 132.80 86.29 11.11 2.60 64.93 16.38 4.28 0.88 1.86 0.00 6.04 5.62 7 T C C 107.67 1.52 9.21 12.06 116.39 -154.98 -102.43 126.59 88.73 10.52 0.75 77.72 9.53 1.21 0.29 0.48 0.00 7.53 3.24 8 V C C 108.14 3.33 7.35 12.87 114.81 -148.22 -91.83 130.59 92.24 7.45 0.31 85.27 6.43 0.66 0.11 0.19 0.00 5.11 2.24 9 H C C 139.16 2.41 9.15 13.34 115.05 -137.23 -89.13 134.11 97.69 2.18 0.13 93.24 4.37 0.26 0.05 0.06 0.00 1.05 0.97 10 T C C 108.27 1.89 10.48 13.94 114.95 -128.25 -87.12 132.47 99.58 0.34 0.07 95.74 3.77 0.14 0.03 0.02 0.00 0.13 0.16 11 P C C 69.12 8.44 7.10 16.64 114.73 -111.90 -68.32 149.61 99.33 0.20 0.46 95.41 3.49 0.52 0.27 0.09 0.00 0.07 0.15 12 K C C 131.28 1.79 12.06 14.39 114.91 -104.15 -71.77 150.56 97.90 0.35 1.75 94.62 2.71 0.67 1.44 0.19 0.00 0.09 0.28 13 T H H 108.49 1.49 10.17 12.69 92.61 -111.10 -59.26 -37.15 6.98 0.03 92.99 1.64 1.62 3.76 92.02 0.93 0.01 0.01 0.01 14 W H H 187.00 0.89 12.23 12.32 92.40 53.40 -65.68 -38.43 3.24 0.01 96.75 0.56 0.40 2.11 96.07 0.85 0.00 0.00 0.00 15 H H H 91.27 4.64 11.65 17.97 93.18 48.70 -68.52 -39.26 1.37 0.01 98.61 0.39 0.16 0.77 97.83 0.83 0.00 0.01 0.00 16 T H H 57.13 7.03 12.01 20.66 92.22 50.97 -64.16 -42.04 0.81 0.01 99.19 0.24 0.09 0.39 99.04 0.24 0.00 0.00 0.00 17 V H H 90.29 1.71 16.60 17.52 92.34 48.73 -64.74 -42.22 0.75 0.01 99.24 0.15 0.07 0.44 99.20 0.13 0.00 0.00 0.00 18 T H H 76.50 1.91 17.44 18.55 92.13 48.52 -64.76 -41.77 0.63 0.00 99.37 0.10 0.05 0.37 99.38 0.09 0.00 0.00 0.00 19 G H H 20.92 7.90 13.80 23.69 92.01 50.74 -64.13 -41.75 0.74 0.00 99.26 0.11 0.05 0.45 99.29 0.09 0.00 0.00 0.00 20 K H H 108.68 4.98 16.81 22.71 91.77 50.35 -64.44 -41.05 0.66 0.00 99.34 0.07 0.04 0.47 99.35 0.09 0.00 0.00 0.00 21 G H H 40.94 1.76 18.30 18.87 91.69 50.25 -64.17 -42.07 0.67 0.00 99.33 0.07 0.04 0.46 99.36 0.08 0.00 0.00 0.00 22 L H H 92.54 2.49 17.87 20.01 92.13 48.90 -65.16 -41.50 0.30 0.00 99.70 0.04 0.02 0.18 99.72 0.05 0.00 0.00 0.00 23 C H H 49.26 6.80 14.81 23.03 92.20 50.90 -64.39 -41.16 0.20 0.00 99.80 0.02 0.01 0.12 99.82 0.03 0.00 0.00 0.00 24 A H H 55.22 3.01 16.64 20.08 91.68 51.03 -63.73 -41.45 0.16 0.00 99.84 0.01 0.01 0.10 99.86 0.03 0.00 0.00 0.00 25 V H H 86.70 1.67 17.51 18.04 92.10 49.79 -64.73 -41.38 0.20 0.00 99.80 0.02 0.01 0.13 99.81 0.03 0.00 0.00 0.00 26 M H H 91.29 3.65 15.70 20.06 92.01 50.22 -64.96 -41.37 0.30 0.00 99.70 0.03 0.01 0.20 99.72 0.04 0.00 0.00 0.00 27 W H H 127.51 4.53 15.08 20.59 91.97 50.17 -64.27 -41.49 0.38 0.00 99.62 0.03 0.01 0.29 99.62 0.05 0.00 0.00 0.00 28 F H H 120.33 1.81 16.49 17.69 91.83 50.47 -64.06 -41.77 0.51 0.00 99.49 0.02 0.02 0.42 99.49 0.05 0.00 0.00 0.00 29 W H H 140.61 2.12 16.40 18.28 91.91 50.23 -64.59 -41.87 0.28 0.00 99.72 0.01 0.01 0.22 99.71 0.04 0.00 0.00 0.00 30 I H H 76.67 5.17 14.96 21.42 91.79 49.80 -64.27 -42.30 0.16 0.00 99.84 0.01 0.01 0.12 99.83 0.04 0.00 0.00 0.00 31 L H H 85.22 3.36 15.99 20.08 91.82 49.76 -64.24 -41.33 0.25 0.00 99.75 0.02 0.01 0.18 99.73 0.06 0.00 0.00 0.00 32 Y H H 123.43 1.87 16.90 18.05 91.81 49.81 -64.25 -41.97 0.40 0.00 99.60 0.03 0.02 0.29 99.56 0.11 0.00 0.00 0.00 33 R H H 101.87 4.06 15.08 20.31 92.19 50.00 -64.79 -40.68 0.67 0.00 99.33 0.06 0.04 0.50 99.22 0.18 0.00 0.00 0.00 34 A H H 42.01 7.08 12.07 21.05 91.81 51.47 -64.23 -39.52 1.05 0.00 98.95 0.10 0.07 0.76 98.68 0.37 0.00 0.00 0.00 35 K H H 142.25 1.67 15.18 16.84 93.37 48.16 -68.66 -36.72 2.55 0.00 97.45 0.14 0.14 2.21 96.98 0.53 0.01 0.00 0.00 36 Q H H 126.75 1.44 15.11 15.85 98.23 39.82 -82.53 -35.67 7.72 0.01 92.26 0.21 0.44 7.18 91.55 0.60 0.01 0.00 0.00 37 D H H 81.66 4.29 13.44 18.84 104.76 21.35 -109.09 -5.96 27.37 0.11 72.52 3.31 4.40 19.14 72.21 0.80 0.03 0.03 0.08 38 G H H 25.47 6.60 12.49 21.05 102.17 107.36 -24.64 -72.71 45.55 0.30 54.15 37.13 3.81 6.54 44.54 7.70 0.00 0.14 0.15 39 P H H 58.30 5.62 12.63 20.04 92.87 46.35 -64.66 -35.81 15.12 0.25 84.63 3.00 2.34 9.15 65.76 19.41 0.08 0.14 0.11 40 V H H 84.33 3.91 13.07 18.26 93.02 52.88 -65.95 -39.86 8.38 0.31 91.31 1.21 1.10 5.61 70.08 21.62 0.09 0.21 0.08 41 V H H 96.80 3.45 12.53 17.29 92.73 50.14 -68.20 -33.39 11.52 0.36 88.12 1.17 1.32 8.32 68.44 20.21 0.19 0.23 0.12 42 M C T 115.30 3.07 11.50 15.84 94.45 48.78 -88.59 -1.92 50.67 0.42 48.91 1.33 3.87 43.82 30.96 19.21 0.21 0.20 0.40 43 G C T 56.32 1.87 12.79 15.43 95.96 -105.09 81.71 8.44 97.60 0.14 2.27 3.41 7.00 87.55 1.12 0.77 0.00 0.07 0.08 44 W C C 153.51 3.88 10.12 15.79 105.34 120.20 -89.78 35.79 96.78 1.73 1.49 55.30 31.93 9.50 0.48 1.02 0.00 0.77 1.00 45 R C C 144.18 3.77 11.79 17.40 122.90 81.48 -114.61 141.49 96.90 2.44 0.66 63.73 30.58 2.49 0.19 0.46 0.00 0.97 1.58 46 H C C 94.14 7.11 9.11 17.91 115.69 -122.88 -89.32 135.74 98.60 0.98 0.42 87.75 9.81 0.95 0.10 0.31 0.00 0.40 0.67 47 P C T 97.93 3.09 10.82 15.50 94.52 -127.84 -65.22 -20.66 90.04 0.58 9.39 23.70 15.86 49.33 0.78 9.75 0.00 0.30 0.27 48 W C T 177.87 2.83 8.70 13.12 99.47 61.53 -85.41 -2.39 89.11 1.02 9.87 21.93 15.12 51.47 1.13 9.31 0.00 0.50 0.53 49 D C C 107.74 2.63 8.64 13.07 104.49 84.78 -86.09 40.41 91.36 1.13 7.52 70.47 5.76 14.71 1.07 6.84 0.00 0.58 0.56 50 G C C 55.05 2.54 11.69 15.67 109.36 -43.37 81.86 9.73 99.89 0.06 0.05 99.23 0.38 0.32 0.01 0.02 0.00 0.03 0.02