# 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 L C C 96.09 8.29 12.18 21.42 111.96 -149.34 -89.60 125.09 99.72 0.25 0.04 99.64 0.13 0.05 0.01 0.00 0.00 0.12 0.04 1 K C C 133.65 4.17 11.69 17.69 117.20 -149.78 -99.38 135.26 89.18 8.34 2.48 84.82 2.31 2.18 1.30 0.91 0.00 5.11 3.36 2 K C C 144.10 3.21 11.85 16.96 116.41 -138.93 -95.37 135.55 82.09 14.23 3.68 62.28 14.81 4.46 1.65 2.19 0.00 8.93 5.67 3 T C C 68.92 9.91 8.81 19.40 118.85 -145.18 -99.28 141.25 82.47 14.44 3.10 67.01 10.74 3.99 1.31 1.88 0.00 8.86 6.21 4 T C C 92.43 4.50 12.97 18.88 106.57 -158.74 -97.43 23.61 84.17 11.73 4.10 48.68 23.51 12.68 1.43 2.56 0.01 5.98 5.15 5 G C S 51.35 4.20 14.06 19.45 103.98 -81.14 83.11 -1.40 90.92 3.44 5.63 18.18 44.57 28.80 1.17 3.97 0.01 1.99 1.32 6 L C S 78.78 10.50 10.56 21.59 111.14 71.01 -96.49 108.29 80.36 12.01 7.63 30.73 31.26 19.16 1.95 5.25 0.06 5.74 5.86 7 V C T 99.92 5.34 13.13 20.13 111.03 -137.50 -75.67 128.65 79.48 10.24 10.27 14.34 16.34 48.72 2.72 7.26 0.11 6.37 4.14 8 G C T 52.81 3.76 16.07 20.82 97.75 15.12 83.89 -2.38 84.19 7.09 8.72 16.46 18.78 49.41 2.01 6.41 0.03 4.95 1.94 9 L C C 61.28 12.99 12.15 25.61 116.91 113.13 -91.56 135.95 70.02 22.51 7.47 50.48 12.12 6.58 2.94 4.95 0.03 15.73 7.17 10 A C C 56.87 8.11 17.61 26.44 112.52 -122.66 -74.91 137.32 64.86 29.93 5.21 49.02 9.37 5.55 2.70 2.89 0.04 22.66 7.76 11 V C C 66.22 13.13 15.26 28.33 116.08 -144.50 -99.49 131.02 70.27 26.12 3.61 48.66 14.85 5.93 1.74 2.24 0.04 17.93 8.60 12 C C C 29.35 14.94 12.65 28.04 124.33 -141.27 -113.31 143.64 84.92 14.17 0.91 75.83 7.42 1.36 0.50 0.44 0.00 8.86 5.59 13 N C S 126.50 1.92 18.19 20.43 94.74 -135.50 -72.22 -24.74 99.52 0.32 0.17 7.02 90.88 1.76 0.05 0.05 0.00 0.15 0.09 14 T C S 61.91 6.62 18.35 25.96 112.43 29.38 -126.04 89.88 99.28 0.37 0.35 46.57 52.03 0.73 0.23 0.07 0.00 0.10 0.25 15 P H H 16.72 20.53 14.58 35.38 93.21 -173.02 -62.59 -36.36 6.28 0.03 93.68 1.74 1.03 3.54 90.75 2.91 0.01 0.01 0.01 16 H H H 53.35 16.22 18.27 33.95 91.80 55.63 -63.07 -40.76 3.05 0.01 96.94 0.34 0.26 2.29 94.02 3.07 0.01 0.01 0.00 17 E H H 97.60 3.59 23.09 26.22 91.87 49.83 -65.75 -40.19 1.59 0.01 98.39 0.30 0.14 1.02 95.36 3.15 0.00 0.01 0.00 18 R H H 80.75 10.11 20.67 31.19 91.88 49.69 -65.09 -41.39 1.12 0.01 98.87 0.30 0.11 0.59 98.23 0.77 0.00 0.00 0.00 19 L H H 6.79 23.92 16.88 40.75 91.71 50.08 -64.59 -42.07 0.60 0.00 99.40 0.12 0.04 0.31 99.29 0.24 0.00 0.00 0.00 20 R H H 99.94 11.49 21.27 32.49 91.21 52.05 -62.40 -41.55 0.20 0.00 99.80 0.02 0.01 0.11 99.70 0.16 0.00 0.00 0.00 21 I H H 84.94 3.46 23.97 26.78 91.69 49.57 -64.31 -42.39 0.15 0.00 99.85 0.01 0.00 0.10 99.72 0.17 0.00 0.00 0.00 22 L H H 28.08 14.56 20.81 35.70 91.75 49.01 -64.41 -42.49 0.26 0.00 99.74 0.01 0.01 0.19 99.65 0.14 0.00 0.00 0.00 23 Y H H 19.95 21.20 18.39 39.19 91.96 50.27 -64.34 -41.32 0.41 0.00 99.59 0.03 0.01 0.29 99.61 0.06 0.00 0.00 0.00 24 T H H 59.79 6.57 22.33 29.37 91.66 51.23 -64.20 -41.01 0.21 0.00 99.79 0.02 0.01 0.13 99.81 0.03 0.00 0.00 0.00 25 K H H 101.02 4.38 23.50 27.74 91.80 50.16 -64.92 -41.44 0.18 0.00 99.82 0.01 0.01 0.12 99.82 0.04 0.00 0.00 0.00 26 I H H 15.53 19.07 19.02 38.01 91.98 49.22 -64.40 -43.05 0.24 0.00 99.76 0.02 0.01 0.15 99.75 0.07 0.00 0.00 0.00 27 L H H 29.94 15.81 19.00 34.97 91.54 50.74 -63.40 -41.18 0.22 0.00 99.78 0.02 0.01 0.14 99.70 0.14 0.00 0.00 0.00 28 D H H 83.34 2.47 23.34 24.62 91.74 51.15 -64.18 -40.89 0.64 0.00 99.36 0.03 0.02 0.51 98.95 0.48 0.00 0.00 0.00 29 V H H 36.79 9.59 18.89 29.94 91.95 49.70 -64.88 -41.41 1.15 0.00 98.85 0.06 0.05 0.95 97.51 1.43 0.00 0.00 0.00 30 L H H 15.12 21.28 13.36 34.47 91.59 52.73 -65.27 -36.32 1.84 0.00 98.16 0.10 0.09 1.53 93.00 5.27 0.00 0.00 0.00 31 E H H 117.90 5.61 17.80 24.70 90.81 57.63 -67.58 -25.21 26.62 0.01 73.37 0.35 0.60 26.79 66.52 5.71 0.01 0.00 0.01 32 E C T 141.73 1.54 18.80 19.39 94.81 51.94 -87.79 -9.16 57.92 0.02 42.05 0.88 1.88 55.77 36.51 4.92 0.01 0.01 0.03 33 I C S 31.64 18.27 7.15 24.21 117.34 98.04 -78.70 140.85 99.75 0.10 0.15 10.52 88.99 0.28 0.09 0.01 0.00 0.02 0.08 34 P C C 69.09 3.44 16.27 20.49 113.08 -103.52 -62.89 143.53 99.77 0.11 0.12 99.13 0.49 0.21 0.03 0.03 0.00 0.03 0.08 35 K C T 146.42 5.04 11.07 18.29 92.00 -123.95 -61.78 -28.25 99.46 0.07 0.47 2.38 10.46 86.66 0.07 0.35 0.00 0.04 0.04 36 N C T 132.03 0.95 15.29 15.20 94.84 57.68 -89.03 2.87 99.40 0.06 0.54 2.58 9.15 87.69 0.07 0.44 0.00 0.03 0.04 37 A C S 27.48 10.71 9.49 21.96 119.47 114.85 -79.88 151.50 93.79 1.04 5.16 14.20 78.71 0.90 4.69 0.25 0.00 0.11 1.14 38 A H H 66.19 3.39 17.91 21.79 91.61 -119.57 -60.74 -35.94 5.71 0.01 94.28 0.27 0.66 4.98 93.18 0.89 0.01 0.00 0.01 39 Y H H 61.29 13.53 15.38 29.38 92.17 53.12 -65.16 -39.58 2.59 0.00 97.41 0.19 0.18 2.09 96.59 0.94 0.00 0.00 0.00 40 R H H 67.07 14.13 15.43 29.66 91.59 53.18 -63.26 -41.46 0.39 0.00 99.61 0.07 0.03 0.23 99.25 0.42 0.00 0.00 0.00 41 K H H 125.60 2.25 22.00 23.45 91.84 49.83 -64.90 -41.16 0.26 0.00 99.74 0.04 0.02 0.15 99.67 0.12 0.00 0.00 0.00 42 Y H H 98.40 6.13 21.42 27.98 92.04 48.98 -65.59 -41.70 0.24 0.00 99.76 0.04 0.01 0.15 99.74 0.06 0.00 0.00 0.00 43 T H H 11.44 19.58 16.41 36.13 92.05 49.48 -64.89 -41.88 0.15 0.00 99.85 0.01 0.01 0.10 99.85 0.03 0.00 0.00 0.00 44 E H H 70.73 10.49 20.20 31.07 91.65 51.91 -62.96 -41.39 0.06 0.00 99.94 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 45 Q H H 101.91 2.24 24.39 25.03 91.93 49.92 -64.62 -41.57 0.08 0.00 99.92 0.00 0.00 0.05 99.93 0.01 0.00 0.00 0.00 46 I H H 39.59 11.76 20.86 33.33 91.99 48.95 -64.68 -42.54 0.13 0.00 99.87 0.01 0.00 0.08 99.89 0.02 0.00 0.00 0.00 47 T H H 11.52 20.34 17.10 37.44 91.78 49.86 -63.96 -42.57 0.14 0.00 99.86 0.02 0.00 0.08 99.88 0.01 0.00 0.00 0.00 48 N H H 84.02 4.74 23.16 28.08 91.53 50.74 -64.24 -40.57 0.09 0.00 99.91 0.01 0.00 0.05 99.93 0.01 0.00 0.00 0.00 49 E H H 99.40 3.42 23.88 26.64 91.66 49.85 -64.80 -41.57 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 50 K H H 32.85 17.71 19.18 36.52 92.03 49.71 -64.69 -42.02 0.05 0.00 99.95 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 51 L H H 36.22 15.60 19.04 34.62 91.48 51.59 -62.63 -41.44 0.05 0.00 99.95 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 52 A H H 59.63 2.23 24.07 24.68 91.25 50.81 -63.53 -40.97 0.12 0.00 99.88 0.00 0.00 0.10 99.86 0.03 0.00 0.00 0.00 53 M H H 51.19 8.87 19.72 29.84 91.76 50.35 -64.75 -41.73 0.15 0.00 99.85 0.01 0.01 0.12 99.77 0.10 0.00 0.00 0.00 54 V H H 10.65 21.76 13.10 34.77 91.73 50.95 -65.08 -39.58 0.45 0.00 99.55 0.02 0.02 0.37 99.16 0.43 0.00 0.00 0.00 55 K H H 131.59 4.60 18.89 24.72 91.45 52.44 -67.52 -30.37 5.43 0.00 94.56 0.09 0.13 5.44 93.81 0.53 0.00 0.00 0.00 56 A H H 79.84 1.69 18.44 19.11 95.03 46.36 -81.52 -23.67 20.79 0.02 79.19 0.62 1.32 18.60 78.78 0.64 0.01 0.01 0.02 57 E C C 62.53 11.33 11.81 24.13 116.24 38.74 -127.78 100.79 99.24 0.17 0.59 75.72 22.63 0.82 0.53 0.08 0.00 0.04 0.18 58 P C S 94.67 5.60 15.11 22.70 94.72 -171.95 -73.96 -17.73 99.74 0.15 0.11 38.18 60.41 1.20 0.04 0.04 0.00 0.05 0.08 59 D C C 75.37 4.65 19.06 24.54 110.45 88.41 -92.56 115.94 98.10 1.32 0.57 63.15 33.94 0.67 0.42 0.12 0.00 0.22 1.48 60 V H H 35.09 19.23 12.00 30.86 93.14 -155.66 -62.93 -36.35 6.33 0.04 93.63 1.43 1.30 3.73 90.58 2.92 0.02 0.02 0.02 61 K H H 129.45 3.54 19.17 23.61 91.61 56.13 -62.93 -41.04 3.87 0.02 96.10 0.58 0.43 2.79 93.55 2.61 0.01 0.01 0.01 62 K H H 103.56 2.91 20.98 23.29 92.03 48.71 -65.49 -40.29 2.14 0.04 97.82 0.62 0.29 1.22 94.77 3.06 0.01 0.03 0.01 63 L H H 8.99 18.80 13.80 33.46 91.81 51.07 -64.06 -43.15 1.38 0.04 98.58 0.47 0.22 0.72 97.04 1.52 0.00 0.02 0.01 64 E H H 38.62 14.62 15.10 30.25 91.81 51.60 -63.32 -41.44 1.98 0.05 97.97 0.49 0.28 1.22 96.17 1.79 0.01 0.03 0.01 65 D H H 110.39 1.23 20.35 19.94 92.10 50.46 -65.09 -38.63 4.63 0.03 95.34 0.47 0.35 3.83 93.03 2.28 0.01 0.02 0.01 66 Q H H 97.99 6.10 17.38 24.37 92.62 50.06 -70.41 -32.62 9.35 0.04 90.62 0.36 0.72 8.64 88.66 1.55 0.04 0.01 0.02 67 L C H 26.73 18.04 10.89 28.52 98.80 43.96 -95.29 2.63 51.54 0.45 48.01 3.82 12.55 34.29 46.64 2.09 0.11 0.11 0.40 68 Q C T 144.85 1.60 18.32 19.74 94.90 -117.88 57.58 41.62 89.45 0.41 10.14 13.31 7.18 69.31 2.66 6.99 0.00 0.18 0.36 69 G C T 44.82 7.16 14.68 23.01 94.65 -47.11 73.73 7.57 87.34 0.24 12.42 3.09 10.08 73.68 1.41 11.41 0.00 0.12 0.21 70 G C T 34.28 9.13 16.63 26.31 99.03 -77.76 84.26 2.77 87.38 0.89 11.73 15.40 25.05 46.54 1.52 10.51 0.00 0.40 0.58 71 Q C C 76.91 7.52 20.78 28.81 111.73 129.15 -85.30 124.37 89.51 3.58 6.91 79.19 8.16 1.47 5.60 1.31 0.00 0.86 3.41 72 L H H 29.67 20.76 14.54 34.67 93.82 -145.55 -62.32 -40.89 1.71 0.00 98.28 0.38 0.23 0.90 97.80 0.68 0.00 0.00 0.00 73 E H H 102.93 6.65 21.69 28.80 91.61 54.39 -63.24 -40.48 0.54 0.00 99.46 0.06 0.03 0.36 98.78 0.77 0.00 0.00 0.00 74 E H H 85.70 5.10 23.06 28.36 91.74 49.03 -65.74 -40.65 0.20 0.00 99.80 0.02 0.01 0.13 99.15 0.68 0.00 0.00 0.00 75 V H H 7.91 20.92 17.45 38.62 91.73 50.21 -64.07 -43.34 0.09 0.00 99.91 0.01 0.00 0.05 99.86 0.08 0.00 0.00 0.00 76 I H H 32.28 16.96 20.61 37.15 91.80 50.01 -63.58 -42.75 0.07 0.00 99.93 0.01 0.00 0.04 99.93 0.02 0.00 0.00 0.00 77 L H H 80.18 4.12 24.57 28.49 91.45 49.56 -63.66 -42.43 0.07 0.00 99.93 0.00 0.00 0.04 99.93 0.02 0.00 0.00 0.00 78 Q H H 58.41 9.41 22.56 32.49 91.77 49.39 -64.72 -41.50 0.09 0.00 99.91 0.00 0.00 0.06 99.92 0.02 0.00 0.00 0.00 79 A H H 7.03 20.49 17.81 38.71 91.85 51.05 -63.98 -41.87 0.19 0.00 99.81 0.01 0.01 0.12 99.83 0.02 0.00 0.00 0.00 80 E H H 85.75 7.82 23.16 31.28 91.60 51.20 -63.42 -41.73 0.16 0.00 99.84 0.01 0.01 0.10 99.87 0.02 0.00 0.00 0.00 81 H H H 99.07 3.91 24.03 27.61 91.83 49.50 -64.77 -41.24 0.17 0.00 99.83 0.01 0.00 0.10 99.85 0.03 0.00 0.00 0.00 82 E H H 37.94 15.41 19.37 34.96 92.28 50.71 -64.63 -41.50 0.20 0.00 99.80 0.01 0.01 0.13 99.81 0.04 0.00 0.00 0.00 83 L H H 43.38 13.80 19.53 33.42 91.97 50.78 -64.16 -40.78 0.19 0.00 99.81 0.01 0.01 0.13 99.80 0.05 0.00 0.00 0.00 84 N H H 82.11 3.06 23.01 25.40 91.72 50.55 -64.27 -41.50 0.55 0.00 99.45 0.03 0.02 0.44 99.45 0.07 0.00 0.00 0.00 85 L H H 54.10 8.15 19.98 29.07 91.88 49.74 -64.85 -41.33 0.61 0.00 99.39 0.03 0.02 0.47 99.41 0.07 0.00 0.00 0.00 86 A H H 16.51 15.31 16.01 32.38 91.78 52.10 -63.03 -41.54 0.23 0.00 99.77 0.02 0.01 0.13 99.76 0.07 0.00 0.00 0.00 87 R H H 114.13 4.53 20.25 25.18 91.68 51.01 -63.65 -40.58 0.32 0.00 99.68 0.03 0.01 0.22 99.47 0.27 0.00 0.00 0.00 88 K H H 107.78 3.24 19.05 22.31 91.83 50.46 -64.89 -39.92 0.60 0.00 99.40 0.04 0.02 0.47 98.74 0.73 0.00 0.00 0.00 89 M H H 50.33 13.54 13.41 27.58 92.28 51.45 -67.19 -33.70 1.65 0.00 98.35 0.09 0.08 1.40 96.37 2.05 0.00 0.00 0.00 90 R H H 121.23 8.55 14.40 23.75 91.73 56.08 -67.94 -28.11 18.07 0.01 81.92 0.33 0.49 17.76 79.18 2.23 0.01 0.00 0.01 91 E H H 150.08 0.98 16.92 16.33 95.30 48.13 -89.83 -8.47 47.81 0.03 52.16 0.97 1.70 44.51 50.67 2.10 0.01 0.01 0.03 92 W C C 96.46 10.27 8.66 20.02 116.83 96.72 -81.47 140.33 90.89 0.86 8.25 50.69 34.23 5.76 6.69 1.44 0.00 0.20 0.99 93 K C C 133.24 3.04 15.56 19.48 110.48 -141.80 -91.10 117.84 96.28 1.06 2.66 92.57 2.05 2.04 0.94 1.15 0.00 0.37 0.88 94 L C T 74.02 12.80 10.49 23.43 95.38 -139.10 -66.45 -21.47 95.90 0.85 3.25 12.63 14.21 68.92 0.52 2.79 0.00 0.45 0.48 95 W C T 148.60 6.88 12.91 20.65 97.38 49.17 -89.21 6.82 96.06 1.21 2.74 11.89 14.73 69.19 0.38 2.59 0.00 0.67 0.54 96 E C S 100.06 4.84 12.46 19.07 117.09 115.42 -84.49 142.08 97.72 1.68 0.60 43.82 52.98 1.15 0.16 0.37 0.00 0.69 0.82 97 P C C 94.52 4.18 12.10 17.91 113.50 -102.23 -65.91 144.96 95.94 2.39 1.67 85.86 6.39 3.58 0.38 1.34 0.00 1.30 1.16 98 L C C 94.59 8.35 8.66 18.05 107.50 -117.27 -78.52 121.88 91.69 6.02 2.29 76.95 10.15 3.91 0.62 1.83 0.00 2.68 3.86 99 V C C 106.33 3.88 9.93 15.26 108.78 66.89 -95.84 56.78 92.19 5.85 1.96 73.26 15.05 3.51 0.61 1.41 0.00 2.90 3.26 100 E C C 137.22 2.43 10.35 14.35 117.60 56.23 -96.52 141.65 95.13 3.73 1.14 67.66 25.07 2.60 0.33 0.76 0.00 1.78 1.80 101 E C C 152.52 1.55 11.91 14.54 114.37 -100.93 -83.93 135.05 98.95 0.96 0.09 86.84 11.97 0.24 0.03 0.05 0.00 0.42 0.45 102 P C C 67.04 10.45 7.33 18.27 116.65 -107.43 -65.59 149.67 99.85 0.13 0.02 98.40 1.40 0.08 0.01 0.01 0.00 0.05 0.06 103 P C C 79.23 3.65 10.62 16.08 114.83 -102.78 -64.36 151.04 99.48 0.22 0.31 98.05 0.99 0.54 0.07 0.14 0.00 0.07 0.15 104 A C T 95.14 1.16 10.64 12.33 106.53 -99.99 -66.74 142.90 97.14 0.32 2.53 12.42 22.03 62.38 0.25 2.55 0.00 0.15 0.22 105 D C T 112.71 2.27 9.99 13.49 99.33 20.85 -56.62 43.64 96.21 0.63 3.16 23.51 14.06 58.36 0.46 2.96 0.00 0.30 0.35 106 Q C C 102.67 5.66 8.99 16.43 98.92 156.68 -77.35 -13.88 91.10 1.36 7.54 38.95 18.59 32.45 0.88 7.73 0.00 0.60 0.80 107 W C C 143.31 7.07 8.71 16.80 108.83 55.47 -97.31 75.62 92.46 2.00 5.53 42.91 17.28 31.69 0.77 5.32 0.00 0.92 1.11 108 K C C 143.88 2.06 11.06 14.59 117.85 145.18 -98.12 138.61 93.63 3.24 3.13 65.24 22.70 5.22 0.78 2.44 0.00 1.26 2.36 109 W C C 169.17 4.57 7.32 13.74 114.94 -109.09 -80.11 140.54 97.75 1.46 0.79 54.27 35.91 7.55 0.19 0.62 0.00 0.65 0.80 110 P C C 104.93 2.36 8.92 12.68 109.11 -5.77 -72.46 127.75 99.19 0.43 0.37 88.41 4.06 6.79 0.08 0.22 0.00 0.23 0.20 111 I C C 119.64 3.89 9.79 15.28 108.34 -137.99 -86.07 117.64 99.91 0.08 0.01 99.79 0.11 0.04 0.00 0.00 0.00 0.03 0.01