# 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 114.09 5.70 11.81 19.07 115.98 -147.98 -91.21 134.26 99.19 0.73 0.08 99.13 0.22 0.09 0.03 0.01 0.00 0.38 0.14 1 A C C 72.51 4.46 9.01 15.21 113.59 -134.74 -84.84 141.09 83.38 7.45 9.18 76.90 1.90 4.61 6.75 2.14 0.00 4.18 3.53 2 D C C 108.28 2.38 9.31 13.23 110.37 -127.58 -86.33 118.27 78.97 5.17 15.86 58.29 11.73 8.65 10.85 5.23 0.00 3.24 2.00 3 A C C 77.59 3.74 8.77 14.20 99.62 -161.17 -77.62 -11.24 66.10 2.83 31.07 41.03 12.56 13.01 17.57 13.07 0.02 1.61 1.13 4 S C C 80.30 2.62 9.85 13.86 103.29 70.57 -80.76 8.98 64.79 2.37 32.83 40.30 11.40 13.63 19.06 13.26 0.02 1.30 1.03 5 Q C C 122.11 3.07 10.08 14.68 105.72 70.60 -85.01 72.30 65.53 2.97 31.50 42.57 11.27 12.06 19.61 11.50 0.02 1.62 1.35 6 A C C 68.78 4.89 9.16 15.71 111.07 90.92 -85.39 130.01 73.56 3.50 22.94 50.28 12.36 10.78 16.30 6.73 0.01 1.94 1.60 7 T C C 92.87 3.56 9.87 15.13 110.17 -145.94 -91.35 117.39 77.87 4.60 17.53 52.03 13.04 12.65 12.06 5.56 0.01 2.64 2.00 8 D C C 103.73 3.23 10.06 14.89 109.01 -144.53 -90.52 99.68 81.64 4.05 14.31 48.19 17.34 16.56 8.72 5.23 0.01 2.22 1.73 9 N C C 108.29 3.64 9.48 14.80 109.48 -129.00 -93.19 101.30 84.90 3.64 11.47 42.95 22.37 20.35 5.23 5.61 0.01 2.03 1.45 10 T C C 97.84 3.27 9.14 14.13 107.29 99.13 -89.73 72.19 83.90 5.87 10.22 47.30 21.98 15.35 4.05 5.70 0.01 3.59 2.03 11 T C C 98.28 2.87 9.62 14.14 109.33 77.84 -91.98 101.99 82.08 10.30 7.62 56.17 17.32 8.70 3.17 4.36 0.01 6.95 3.31 12 Q C C 128.32 2.88 9.80 14.52 113.57 -116.50 -90.49 128.75 84.20 10.98 4.82 64.14 14.67 4.88 2.46 2.44 0.01 6.81 4.59 13 V C C 99.51 4.56 8.82 15.40 116.71 -140.64 -97.73 135.12 94.43 4.44 1.13 74.75 18.27 1.56 0.60 0.52 0.00 2.46 1.84 14 P C C 86.52 4.05 10.40 16.26 114.79 -110.60 -71.05 149.43 97.55 1.26 1.18 86.35 8.92 2.43 0.48 0.57 0.00 0.76 0.49 15 P C C 110.08 2.33 11.02 14.90 109.85 -104.04 -70.45 141.44 95.47 1.78 2.74 75.34 15.66 4.41 1.30 1.31 0.00 0.79 1.19 16 L C C 104.51 5.42 8.74 16.01 115.58 -112.88 -89.52 132.72 94.85 1.25 3.90 74.94 17.39 2.52 2.49 1.30 0.00 0.51 0.83 17 P C C 91.99 3.60 11.43 16.60 111.42 -108.43 -68.67 148.31 77.79 1.09 21.11 60.54 6.87 10.51 11.05 9.87 0.00 0.60 0.56 18 A C C 80.66 3.56 9.99 15.41 111.24 -111.69 -80.38 134.95 65.51 2.49 32.00 41.43 10.45 13.41 15.76 16.40 0.01 1.34 1.20 19 V C C 93.93 5.25 9.84 16.74 115.41 -154.03 -98.60 133.37 56.32 4.75 38.93 35.73 10.30 10.47 19.49 19.47 0.03 2.82 1.68 20 A C C 73.36 4.42 10.82 16.85 111.28 -135.60 -83.79 133.05 58.47 4.78 36.75 37.09 10.53 10.86 19.33 17.61 0.03 2.91 1.64 21 E C C 128.07 4.09 11.44 17.15 111.24 -130.28 -87.75 117.92 67.41 4.00 28.59 40.27 13.86 13.45 16.23 12.29 0.03 2.23 1.64 22 T C C 80.43 6.32 11.09 19.00 114.09 -149.01 -92.93 131.86 78.90 2.77 18.33 51.71 16.33 10.75 12.14 6.29 0.01 1.33 1.44 23 T C C 67.48 5.92 11.39 19.07 112.62 -143.07 -89.97 134.48 89.52 0.66 9.82 72.68 13.69 1.89 10.42 0.73 0.00 0.23 0.36 24 P H H 83.04 4.47 12.59 18.47 96.49 -123.65 -63.26 -38.30 22.87 0.34 76.80 15.49 3.42 4.84 74.27 1.72 0.00 0.16 0.10 25 E H H 133.12 1.76 14.52 16.27 93.77 50.96 -65.99 -37.14 9.65 0.21 90.14 5.29 1.63 3.62 87.33 1.94 0.01 0.11 0.06 26 A H H 52.89 4.25 14.04 19.52 93.19 51.92 -66.90 -39.51 5.76 0.23 94.02 3.66 0.88 1.93 91.51 1.81 0.00 0.15 0.05 27 V H H 54.34 7.71 12.98 22.21 92.82 51.83 -65.78 -41.12 3.70 0.15 96.15 2.31 0.56 1.24 94.74 1.02 0.00 0.10 0.02 28 K H H 111.91 3.21 16.77 20.35 92.37 50.68 -64.68 -41.11 2.95 0.10 96.95 1.54 0.43 1.16 96.14 0.65 0.00 0.06 0.02 29 A H H 57.54 2.66 17.06 19.69 92.27 50.41 -65.36 -41.20 2.94 0.07 96.99 1.31 0.41 1.29 96.30 0.62 0.00 0.04 0.02 30 A H H 45.65 5.97 15.00 22.33 92.57 51.16 -65.57 -40.54 3.30 0.08 96.62 1.42 0.43 1.50 95.90 0.69 0.01 0.04 0.02 31 E H H 97.06 5.71 15.81 22.39 92.50 50.53 -66.11 -39.61 3.79 0.09 96.13 1.52 0.49 1.81 95.34 0.76 0.01 0.05 0.02 32 K H H 128.31 2.22 16.87 19.01 92.43 50.87 -65.84 -39.42 5.71 0.12 94.17 2.04 0.77 2.95 93.12 1.01 0.01 0.06 0.03 33 A H H 59.90 3.37 15.78 19.70 92.98 50.94 -66.98 -37.76 10.52 0.18 89.31 3.63 1.44 5.50 87.83 1.42 0.02 0.09 0.06 34 A H H 48.91 6.40 13.50 21.34 93.65 52.22 -69.88 -34.41 21.18 0.47 78.35 9.10 3.19 9.51 75.69 2.06 0.03 0.23 0.19 35 V H H 83.64 4.88 13.63 19.67 95.14 55.92 -70.80 -31.95 31.74 0.77 67.49 13.86 5.69 12.95 64.22 2.54 0.04 0.37 0.33 36 G H H 45.23 3.19 13.83 17.73 96.84 52.70 -66.65 -31.47 47.84 0.89 51.26 25.41 7.11 15.85 47.46 3.35 0.02 0.42 0.39 37 V H H 95.76 3.70 12.08 16.92 97.86 56.84 -77.23 -24.52 48.12 1.60 50.28 29.53 8.85 11.10 43.62 5.42 0.02 0.83 0.62 38 H C H 119.80 4.66 10.80 16.88 102.82 61.71 -82.03 -4.40 54.34 1.95 43.71 35.06 8.03 11.61 37.15 6.33 0.02 1.06 0.75 39 K C C 139.52 3.08 11.51 16.05 104.64 88.43 -81.17 20.80 64.04 2.00 33.97 40.09 10.48 13.36 27.58 6.61 0.02 1.06 0.80 40 K C C 144.13 2.77 11.51 15.69 108.04 63.60 -86.66 98.02 71.81 3.35 24.85 48.58 11.07 11.48 20.27 5.42 0.01 1.83 1.35 41 I C C 91.32 7.16 9.27 17.79 113.14 -154.64 -92.25 127.86 79.56 4.39 16.05 60.79 13.13 4.72 14.47 2.76 0.00 2.20 1.92 42 N C C 101.67 3.12 13.26 17.34 107.39 -135.79 -86.90 102.67 84.56 3.53 11.91 75.39 4.96 3.95 9.64 2.47 0.00 1.82 1.77 43 L C G 93.44 7.92 9.91 19.01 96.23 -170.22 -69.98 -25.96 50.33 1.47 48.20 20.40 7.38 23.02 13.52 34.19 0.01 0.84 0.65 44 A C T 80.99 2.65 12.48 16.25 94.84 64.12 -72.01 -21.82 53.31 0.78 45.91 8.24 7.63 36.39 12.08 34.73 0.04 0.41 0.48 45 A C G 73.58 2.98 12.42 16.42 97.30 58.22 -83.57 -10.36 52.78 1.02 46.20 11.74 11.25 30.73 10.00 35.14 0.03 0.51 0.60 46 A C S 43.13 8.86 9.27 19.62 115.73 90.17 -84.27 141.51 92.43 0.91 6.66 29.02 60.92 2.28 6.01 0.82 0.00 0.23 0.72 47 P C C 75.64 3.29 15.14 19.10 108.16 -99.89 -67.06 143.71 81.41 2.15 16.44 72.30 4.24 3.58 16.53 1.39 0.00 0.88 1.08 48 I H H 86.12 9.03 12.54 22.54 94.61 -118.59 -64.63 -36.45 18.07 0.46 81.47 11.23 3.79 3.91 79.47 1.21 0.01 0.18 0.20 49 R H H 125.36 5.64 15.51 22.23 93.08 55.64 -64.97 -39.78 3.82 0.13 96.05 1.76 0.64 1.55 95.17 0.76 0.01 0.07 0.03 50 Q H H 88.70 3.41 17.42 21.23 92.57 50.91 -65.51 -40.84 1.65 0.10 98.25 0.77 0.26 0.73 97.39 0.77 0.01 0.06 0.01 51 Y H H 66.46 9.29 15.25 26.04 92.40 50.03 -64.34 -42.68 0.94 0.05 99.01 0.35 0.14 0.49 98.45 0.54 0.01 0.02 0.01 52 L H H 49.10 12.45 14.78 27.93 92.17 49.27 -64.87 -41.09 0.81 0.03 99.16 0.22 0.11 0.48 98.81 0.34 0.02 0.01 0.01 53 E H H 102.44 5.91 17.25 23.91 92.96 46.47 -69.52 -37.63 1.28 0.02 98.71 0.14 0.11 1.01 98.39 0.31 0.03 0.01 0.01 54 A H H 65.75 3.51 18.57 22.28 100.12 35.62 -87.32 -36.34 7.07 0.01 92.92 0.09 0.23 7.37 91.87 0.39 0.04 0.00 0.01 55 T C T 56.72 7.67 17.61 26.38 108.30 24.70 -111.22 -38.98 59.82 0.06 40.12 0.23 1.70 56.70 40.64 0.63 0.02 0.01 0.06 56 V H H 25.37 16.21 15.99 32.50 100.58 34.04 -89.05 -38.83 28.56 0.37 71.06 1.15 3.39 23.64 70.43 0.72 0.27 0.08 0.31 57 V H H 47.36 11.31 17.73 29.86 91.92 59.05 -61.46 -44.91 1.29 0.00 98.71 0.30 0.14 0.59 98.74 0.23 0.00 0.00 0.00 58 P H H 63.86 4.83 21.03 26.09 91.58 49.58 -64.73 -40.42 0.58 0.00 99.42 0.09 0.03 0.36 99.17 0.35 0.00 0.00 0.00 59 V H H 47.09 10.92 20.20 31.51 92.45 47.86 -66.74 -42.31 0.21 0.00 99.79 0.02 0.01 0.14 99.53 0.29 0.00 0.00 0.00 60 L H H 37.30 16.57 19.38 35.44 92.45 48.41 -65.63 -42.20 0.22 0.00 99.78 0.01 0.01 0.16 99.72 0.10 0.00 0.00 0.00 61 M H H 69.82 9.33 21.98 31.51 91.63 49.43 -64.35 -41.85 0.30 0.00 99.70 0.02 0.01 0.21 99.71 0.05 0.00 0.00 0.00 62 Q H H 85.54 5.48 24.58 29.96 91.70 49.58 -64.25 -41.56 0.22 0.00 99.77 0.01 0.01 0.16 99.80 0.03 0.00 0.00 0.00 63 G H H 10.45 15.44 19.68 35.66 91.76 51.31 -63.15 -42.77 0.18 0.00 99.82 0.01 0.01 0.12 99.84 0.02 0.00 0.00 0.00 64 M H H 45.66 15.47 20.94 35.97 91.53 50.26 -63.49 -41.56 0.09 0.00 99.91 0.01 0.00 0.06 99.91 0.02 0.00 0.00 0.00 65 Q H H 83.93 5.56 23.84 29.39 91.65 50.50 -63.75 -41.79 0.15 0.00 99.85 0.01 0.00 0.13 99.83 0.02 0.00 0.00 0.00 66 A H H 29.53 7.68 21.15 30.15 91.63 49.82 -63.90 -42.31 0.16 0.00 99.84 0.01 0.01 0.14 99.83 0.02 0.00 0.00 0.00 67 L H H 18.79 16.23 16.46 33.53 91.66 50.32 -64.14 -42.62 0.10 0.00 99.90 0.00 0.00 0.08 99.87 0.04 0.00 0.00 0.00 68 C H H 46.84 10.51 16.80 28.11 92.14 50.51 -64.42 -40.91 0.32 0.00 99.68 0.01 0.01 0.27 99.60 0.12 0.00 0.00 0.00 69 K H H 139.55 2.35 18.79 20.98 92.50 49.33 -67.26 -37.80 2.20 0.00 97.79 0.03 0.06 2.21 97.54 0.17 0.00 0.00 0.00 70 E H H 96.36 6.14 16.06 23.16 95.83 39.76 -89.36 -12.12 9.59 0.03 90.38 0.34 1.09 7.96 90.31 0.24 0.02 0.01 0.02 71 R C C 143.38 6.78 15.98 24.48 95.92 -130.65 56.86 47.34 99.70 0.19 0.11 66.32 32.27 1.11 0.07 0.03 0.00 0.05 0.15 72 P C C 32.26 15.40 9.83 25.56 117.98 -161.35 -69.78 150.88 99.21 0.34 0.46 96.06 2.06 1.10 0.08 0.31 0.00 0.11 0.27 73 D C S 128.06 0.94 17.63 17.36 92.95 -121.52 -67.78 -26.51 99.65 0.14 0.21 2.55 89.08 8.13 0.03 0.09 0.00 0.06 0.06 74 N C C 70.45 7.16 16.38 24.87 109.06 28.95 -128.56 77.15 99.24 0.43 0.33 56.35 39.30 3.58 0.14 0.16 0.00 0.14 0.34 75 P H H 25.65 17.99 13.88 32.40 92.86 171.98 -62.16 -35.04 6.54 0.05 93.40 3.68 0.64 2.36 92.23 1.05 0.00 0.02 0.03 76 V H H 45.31 15.12 19.09 33.83 91.48 56.45 -63.50 -40.77 1.00 0.00 99.00 0.11 0.06 0.71 98.57 0.55 0.00 0.00 0.00 77 E H H 88.50 6.34 22.72 29.25 91.82 50.60 -64.97 -40.98 0.15 0.00 99.85 0.02 0.01 0.09 99.58 0.31 0.00 0.00 0.00 78 F H H 41.97 12.38 20.19 33.42 91.53 50.12 -63.80 -42.92 0.05 0.00 99.95 0.00 0.00 0.03 99.85 0.11 0.00 0.00 0.00 79 L H H 24.74 17.74 20.16 37.55 91.79 49.49 -63.82 -42.35 0.05 0.00 99.95 0.00 0.00 0.04 99.90 0.06 0.00 0.00 0.00 80 A H H 27.24 11.30 19.81 32.04 91.27 51.79 -63.05 -42.50 0.11 0.00 99.89 0.00 0.00 0.09 99.83 0.07 0.00 0.00 0.00 81 Y H H 106.10 5.75 22.23 28.13 91.70 50.10 -64.49 -41.89 0.35 0.00 99.65 0.01 0.01 0.32 99.52 0.14 0.00 0.00 0.00 82 Y H H 48.55 12.43 18.53 31.89 92.04 49.48 -64.21 -42.70 0.91 0.00 99.09 0.04 0.04 0.78 98.80 0.34 0.00 0.00 0.00 83 L H H 40.78 14.14 16.97 31.43 92.32 49.51 -65.45 -41.30 3.34 0.01 96.65 0.16 0.18 2.91 95.90 0.83 0.01 0.00 0.00 84 L H H 79.50 7.34 17.31 25.34 92.93 48.45 -69.37 -34.28 11.16 0.05 88.79 0.84 1.01 9.26 87.35 1.45 0.04 0.02 0.03 85 S H H 65.72 4.30 16.75 21.74 95.24 49.00 -80.08 -22.64 33.08 0.36 66.57 4.64 4.70 24.27 63.92 2.03 0.09 0.13 0.23 86 H C T 87.68 9.57 13.65 24.05 101.33 49.93 -94.09 4.71 64.22 1.25 34.53 18.67 13.36 32.95 30.80 2.93 0.07 0.43 0.79 87 N C C 75.11 8.48 12.65 22.38 111.33 126.35 -92.93 112.42 89.02 1.70 9.28 47.59 28.35 13.31 4.30 4.55 0.00 0.64 1.27 88 P C C 83.45 6.21 12.45 20.25 104.38 -142.01 -71.39 73.18 90.07 0.86 9.07 35.13 25.20 30.14 2.37 6.25 0.00 0.38 0.53 89 Q C C 116.07 4.24 12.44 18.28 112.04 77.45 -94.78 117.31 89.84 2.10 8.06 44.54 27.86 17.51 2.19 5.60 0.00 0.86 1.44 90 P C C 81.73 7.07 10.16 18.69 107.88 -127.26 -75.41 107.03 86.15 1.63 12.22 49.15 14.44 22.33 2.48 9.89 0.00 0.84 0.87 91 N C C 109.21 3.85 11.77 17.05 107.62 63.33 -89.03 88.81 88.83 1.74 9.43 43.65 18.50 26.46 1.63 8.03 0.00 0.88 0.85 92 T C C 92.57 4.70 10.74 17.15 108.79 116.25 -93.74 79.41 89.01 2.75 8.24 53.10 21.16 14.30 1.62 6.92 0.00 1.29 1.61 93 K C C 127.06 4.19 11.36 17.38 118.03 -147.62 -97.05 138.22 96.26 2.77 0.97 61.47 32.55 2.41 0.33 0.59 0.00 1.24 1.40 94 P C C 100.59 3.46 13.02 18.09 110.66 -103.64 -71.44 137.66 96.33 2.49 1.18 76.22 15.72 4.25 0.40 0.78 0.00 1.21 1.43 95 L C C 74.26 11.14 8.74 20.39 117.25 -124.08 -85.32 142.10 96.06 2.76 1.18 77.25 17.13 1.48 0.64 0.50 0.00 1.16 1.86 96 P C C 76.85 4.41 12.50 18.45 113.76 -104.56 -66.84 150.09 92.02 1.71 6.27 81.00 5.84 5.45 3.00 2.75 0.00 0.81 1.15 97 A C T 89.12 2.14 11.75 15.30 107.18 -99.50 -66.05 137.45 71.65 1.39 26.95 22.95 12.80 36.79 11.45 14.32 0.03 0.65 1.00 98 G C T 54.48 2.62 12.54 16.12 100.59 19.11 79.16 -2.10 68.78 1.71 29.52 20.49 13.93 35.34 12.64 15.60 0.06 0.79 1.16 99 A C C 52.98 7.99 9.27 18.59 108.74 125.03 -77.16 114.90 62.86 2.99 34.16 34.60 15.46 13.37 16.43 17.03 0.03 1.34 1.72 100 E C C 134.40 3.14 11.71 16.35 108.69 -111.39 -83.33 105.59 64.18 4.04 31.78 34.18 13.62 17.49 16.32 14.19 0.06 1.88 2.27 101 A C T 81.65 3.44 10.96 15.98 106.77 -109.63 -76.17 103.92 74.92 2.14 22.94 26.76 16.30 33.37 10.02 11.23 0.04 0.98 1.28 102 G C C 55.13 2.89 12.24 16.28 104.18 -3.65 82.81 4.36 86.68 1.90 11.42 33.60 24.62 29.50 3.64 6.68 0.01 0.81 1.15 103 A C C 62.83 5.23 9.98 17.09 117.71 130.22 -81.74 144.53 96.10 2.11 1.79 67.55 27.07 1.62 0.91 0.75 0.00 0.83 1.27 104 P C C 93.58 3.47 11.92 16.99 113.44 -103.89 -68.29 149.73 86.40 3.60 10.00 70.97 7.28 8.24 3.71 5.98 0.00 2.00 1.83 105 A C C 74.57 4.92 9.40 16.17 111.89 -106.19 -75.16 143.31 78.12 8.59 13.29 53.26 13.91 10.91 4.62 8.61 0.01 5.05 3.64 106 A C C 75.53 3.92 8.56 14.45 114.63 -118.16 -85.63 142.20 75.44 10.64 13.91 50.74 15.96 9.05 4.66 9.13 0.02 7.00 3.44 107 K C C 158.11 1.68 9.18 12.43 112.69 -115.12 -84.23 135.51 80.43 8.54 11.02 59.68 13.10 7.67 4.34 6.56 0.01 5.77 2.87 108 A C C 85.07 2.67 7.60 12.28 111.55 -113.68 -77.12 139.97 92.79 3.15 4.06 87.16 1.63 4.72 1.94 1.44 0.00 2.01 1.08 109 D C C 118.89 1.86 10.44 13.69 107.46 -120.81 -83.93 113.64 99.85 0.10 0.05 99.61 0.18 0.12 0.02 0.00 0.00 0.05 0.02