# 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 38.42 6.31 13.20 20.77 121.57 -135.79 107.32 156.34 99.92 0.06 0.02 98.89 0.98 0.08 0.01 0.00 0.00 0.02 0.02 1 D C C 90.95 3.64 11.33 16.41 113.06 -71.71 -87.80 133.67 95.55 0.08 4.36 93.87 0.73 0.78 4.38 0.17 0.00 0.02 0.05 2 P H H 89.23 3.89 9.50 15.06 99.18 -122.60 -66.27 -26.53 38.00 0.17 61.84 19.99 4.05 13.68 57.84 4.28 0.00 0.08 0.09 3 K H H 135.90 2.33 10.54 13.97 98.49 58.85 -73.34 -31.07 22.70 0.20 77.09 10.60 3.42 9.22 71.39 5.16 0.01 0.10 0.10 4 E H H 110.26 3.12 10.74 15.13 96.13 59.12 -69.32 -36.72 11.95 0.17 87.88 7.42 2.08 3.27 81.84 5.24 0.00 0.09 0.05 5 E H H 105.81 3.17 11.45 15.91 95.49 54.88 -68.93 -37.17 9.52 0.16 90.32 6.06 1.55 2.75 85.80 3.70 0.00 0.09 0.04 6 E H H 107.98 2.81 11.87 15.77 94.98 53.24 -68.39 -37.21 9.37 0.15 90.47 5.39 1.55 3.16 86.58 3.18 0.00 0.08 0.05 7 E H H 104.86 3.04 11.85 16.08 94.86 53.10 -68.40 -37.00 11.02 0.14 88.83 5.56 1.92 4.18 85.02 3.19 0.01 0.07 0.06 8 E H H 109.48 3.30 11.80 16.38 94.77 53.66 -68.95 -34.75 15.60 0.16 84.24 7.41 2.55 6.25 79.77 3.87 0.01 0.08 0.07 9 E H H 116.64 3.33 11.98 16.55 95.35 54.46 -71.65 -30.84 22.46 0.21 77.34 10.56 3.56 9.05 71.32 5.30 0.01 0.10 0.10 10 E H H 119.83 3.48 11.65 16.53 97.45 60.19 -73.82 -25.42 30.72 0.34 68.94 14.83 5.39 11.49 60.91 7.02 0.02 0.16 0.18 11 E H H 124.25 3.58 11.85 16.76 99.57 64.99 -80.71 -11.23 47.50 0.58 51.93 23.93 8.10 16.49 43.87 7.00 0.02 0.25 0.34 12 L C C 101.25 5.74 11.61 18.63 106.60 73.61 -83.59 78.56 67.32 0.85 31.83 40.91 9.11 17.50 25.86 5.71 0.00 0.35 0.55 13 V C C 75.40 7.66 12.20 21.35 116.25 108.39 -96.45 132.37 84.10 1.21 14.69 54.23 23.55 5.40 13.94 1.51 0.00 0.32 1.03 14 D C C 70.34 6.98 15.28 23.66 107.80 -118.33 -84.14 114.13 96.53 0.16 3.31 90.78 4.40 0.90 3.58 0.19 0.00 0.05 0.10 15 P H H 53.47 11.05 15.23 27.65 93.55 -157.92 -64.27 -32.39 25.27 0.10 74.63 14.27 2.37 7.05 75.18 1.05 0.00 0.04 0.05 16 L H H 55.45 13.43 15.95 29.45 92.85 55.93 -65.59 -40.37 6.57 0.03 93.40 2.43 0.88 3.04 92.79 0.83 0.00 0.01 0.02 17 T H H 66.87 4.02 19.49 23.68 92.43 49.80 -65.47 -41.23 2.18 0.02 97.80 1.01 0.30 0.87 97.18 0.62 0.00 0.01 0.01 18 T H H 54.11 5.40 19.27 25.57 92.07 49.75 -65.14 -42.40 1.16 0.01 98.83 0.49 0.15 0.51 98.51 0.33 0.00 0.01 0.00 19 V H H 21.51 16.26 16.31 33.13 92.14 49.09 -64.38 -43.05 0.61 0.01 99.39 0.21 0.06 0.29 99.29 0.14 0.00 0.00 0.00 20 R H H 88.92 11.97 18.18 30.26 91.54 51.52 -62.76 -42.18 0.35 0.00 99.64 0.10 0.03 0.18 99.59 0.09 0.00 0.00 0.00 21 E H H 105.31 2.16 22.24 22.94 91.69 49.99 -64.10 -41.99 0.42 0.00 99.58 0.09 0.04 0.25 99.47 0.15 0.00 0.00 0.00 22 Q H H 77.84 6.23 19.95 26.79 91.94 48.89 -65.23 -40.84 0.73 0.00 99.26 0.09 0.05 0.52 98.99 0.33 0.00 0.00 0.00 23 C H H 11.56 19.14 12.65 32.08 91.88 50.10 -66.25 -37.47 2.08 0.00 97.92 0.13 0.10 1.71 96.50 1.54 0.00 0.00 0.00 24 E H H 102.45 7.25 16.75 25.06 91.19 56.73 -67.69 -24.87 25.46 0.01 74.54 0.36 0.47 26.06 71.14 1.95 0.01 0.00 0.01 25 Q C T 134.94 1.47 18.24 18.74 93.67 55.15 -84.64 -9.74 70.32 0.02 29.66 1.10 1.76 67.50 27.68 1.92 0.00 0.01 0.03 26 L C S 44.63 13.62 8.77 22.92 114.48 97.20 -81.24 134.04 94.02 0.56 5.42 32.70 58.37 2.25 5.48 0.49 0.00 0.09 0.62 27 E H H 150.66 1.10 17.19 17.46 92.91 -137.40 -61.74 -36.94 12.70 0.03 87.27 1.15 1.98 9.44 84.07 3.30 0.02 0.01 0.02 28 K H H 108.77 6.03 17.54 24.44 92.58 52.14 -67.66 -36.86 11.02 0.02 88.97 0.57 0.79 9.77 85.49 3.34 0.02 0.00 0.01 29 C H H 11.69 18.92 12.72 31.84 94.78 47.86 -71.47 -38.31 6.20 0.02 93.78 0.77 0.47 4.74 90.79 3.21 0.01 0.01 0.01 30 V H H 63.91 5.40 19.72 26.02 91.47 55.29 -62.76 -42.18 0.88 0.00 99.12 0.23 0.08 0.40 99.01 0.27 0.00 0.00 0.00 31 K H H 112.51 2.36 23.04 24.14 91.48 50.10 -64.40 -41.83 0.67 0.00 99.33 0.11 0.03 0.41 99.30 0.14 0.00 0.00 0.00 32 A H H 13.22 15.66 17.01 33.69 91.51 50.50 -64.23 -42.05 0.24 0.00 99.76 0.03 0.01 0.14 99.78 0.05 0.00 0.00 0.00 33 R H H 88.71 12.86 19.49 31.99 91.86 52.11 -62.89 -41.52 0.07 0.00 99.93 0.01 0.00 0.03 99.94 0.01 0.00 0.00 0.00 34 E H H 105.90 2.18 23.58 24.18 91.56 50.32 -63.81 -41.72 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 35 R H H 96.11 8.14 21.28 29.81 91.83 49.66 -64.46 -41.65 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 36 L H H 18.92 18.76 16.19 35.14 91.95 50.38 -63.76 -41.81 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 37 E H H 98.45 3.84 22.98 26.65 91.40 50.84 -63.67 -41.43 0.13 0.00 99.87 0.01 0.00 0.10 99.88 0.02 0.00 0.00 0.00 38 L H H 79.06 3.06 22.19 24.54 91.57 49.91 -64.23 -42.01 0.32 0.00 99.68 0.02 0.01 0.23 99.69 0.05 0.00 0.00 0.00 39 C H H 13.59 15.60 15.94 32.69 91.85 50.17 -64.04 -41.93 0.53 0.00 99.47 0.06 0.02 0.35 99.47 0.10 0.00 0.00 0.00 40 D H H 57.71 10.23 18.31 29.09 91.76 51.93 -63.63 -40.67 1.27 0.00 98.73 0.15 0.08 0.86 98.67 0.24 0.00 0.00 0.00 41 E H H 118.99 1.44 21.51 20.65 92.04 49.94 -65.62 -40.39 3.72 0.01 96.27 0.35 0.26 2.85 95.87 0.65 0.00 0.00 0.00 42 R H H 99.41 6.15 17.33 24.47 92.96 48.85 -67.91 -38.57 8.18 0.04 91.78 1.19 0.85 5.88 91.02 1.02 0.01 0.02 0.02 43 V H H 32.27 14.45 11.56 26.43 93.80 51.44 -69.65 -35.76 18.94 0.31 80.75 6.10 3.35 10.10 78.48 1.65 0.04 0.12 0.18 44 S H H 75.17 2.91 15.08 18.67 94.68 55.63 -70.97 -27.76 39.56 0.60 59.84 13.83 6.64 19.54 57.27 2.13 0.03 0.22 0.33 45 S C H 76.74 2.24 12.53 15.47 99.17 58.66 -81.69 -13.69 61.26 0.68 38.06 17.45 13.95 30.13 34.70 3.09 0.03 0.24 0.41 46 R C C 148.21 4.29 10.17 16.06 102.18 65.95 -83.60 -0.24 76.95 0.67 22.38 29.45 23.98 23.60 18.32 3.92 0.01 0.23 0.49 47 S C C 72.13 3.68 10.53 15.64 104.54 87.46 -83.49 14.36 83.39 0.64 15.97 43.63 16.58 23.30 9.87 5.87 0.00 0.26 0.50 48 Q C C 128.19 3.30 10.40 15.20 100.51 81.54 -78.75 -3.68 78.99 0.71 20.30 31.88 22.92 24.84 9.55 9.91 0.00 0.27 0.63 49 T C T 93.42 3.20 10.67 15.30 103.84 69.03 -88.78 6.40 79.90 0.73 19.36 25.52 25.31 29.95 8.59 9.73 0.00 0.30 0.60 50 E C C 136.80 2.78 12.98 16.94 103.65 64.15 -86.28 25.04 82.08 1.48 16.44 42.90 19.79 19.84 7.70 8.19 0.00 0.69 0.90 51 E C C 78.32 10.60 11.03 22.49 116.26 136.25 -88.16 138.96 88.42 2.30 9.28 71.83 12.51 3.63 7.39 2.25 0.00 1.01 1.39 52 D C C 74.87 5.65 18.40 24.71 115.08 -150.45 -93.87 135.04 87.29 4.05 8.65 80.91 3.82 2.30 7.76 1.18 0.00 1.58 2.46 53 C H H 32.28 17.09 13.37 30.12 94.41 -129.43 -66.48 -28.43 43.67 1.03 55.30 27.14 7.34 9.83 51.96 2.76 0.01 0.46 0.50 54 T H H 66.55 6.53 18.80 26.16 92.22 62.96 -64.05 -40.27 13.61 0.45 85.94 5.24 2.42 6.24 80.85 4.80 0.03 0.25 0.18 55 E H H 94.86 4.63 20.76 25.67 92.25 50.99 -65.51 -40.00 4.22 0.04 95.73 0.85 0.52 2.60 86.71 9.27 0.01 0.03 0.01 56 E H H 38.65 15.17 17.12 32.51 92.18 50.75 -65.72 -40.99 4.53 0.04 95.43 0.74 0.45 3.05 86.40 9.31 0.01 0.03 0.01 57 L H H 45.58 13.99 18.30 32.33 92.10 50.72 -64.22 -40.29 7.55 0.05 92.40 1.14 0.75 5.35 84.85 7.84 0.01 0.03 0.02 58 L H H 78.91 5.11 21.42 26.75 91.52 51.47 -63.84 -41.67 5.39 0.04 94.57 1.01 0.61 3.63 91.58 3.12 0.01 0.02 0.01 59 D H H 52.53 9.97 19.83 30.34 92.11 51.35 -65.38 -40.40 4.69 0.02 95.30 0.74 0.39 3.39 91.74 3.72 0.00 0.01 0.01 60 F H H 40.20 16.96 17.75 34.43 92.15 51.12 -64.97 -41.21 2.49 0.01 97.49 0.45 0.26 1.67 92.82 4.79 0.00 0.01 0.00 61 L H H 68.22 9.13 20.56 30.12 91.84 51.33 -64.89 -39.82 2.83 0.01 97.16 0.36 0.26 2.06 92.40 4.91 0.00 0.01 0.00 62 H H H 90.49 6.64 20.58 27.63 92.24 51.49 -68.30 -33.52 8.90 0.03 91.07 0.74 0.68 7.13 85.29 6.11 0.02 0.01 0.02 63 A H H 22.39 15.78 15.28 31.39 93.53 58.23 -69.17 -32.28 20.33 0.11 79.56 3.00 2.18 14.98 73.14 6.53 0.05 0.05 0.08 64 R H H 103.71 11.49 18.72 29.83 94.81 55.91 -74.73 -29.73 36.55 0.33 63.12 4.58 6.08 26.26 57.87 4.72 0.14 0.13 0.23 65 D C C 67.00 9.01 17.97 27.43 107.64 53.74 -98.30 85.93 66.89 0.77 32.33 33.49 13.56 19.18 29.54 3.43 0.01 0.25 0.55 66 H H H 101.16 9.97 17.42 27.72 95.58 -161.84 -66.44 -24.80 43.89 0.21 55.90 4.19 5.37 33.31 51.72 5.12 0.06 0.09 0.15 67 C H H 56.28 7.21 19.98 27.71 94.30 55.73 -67.65 -35.91 38.20 0.13 61.67 3.11 3.56 30.62 58.46 4.05 0.05 0.05 0.10 68 V H H 31.29 12.05 19.25 32.25 92.77 50.71 -66.14 -41.49 6.55 0.04 93.41 1.77 0.76 3.86 91.32 2.25 0.01 0.02 0.02 69 A H H 16.35 16.14 16.48 33.30 91.96 53.72 -62.22 -42.70 1.48 0.01 98.51 0.44 0.16 0.77 97.73 0.89 0.00 0.00 0.00 70 H H H 94.67 5.42 20.54 26.49 91.78 51.10 -64.09 -41.03 0.81 0.00 99.18 0.21 0.07 0.46 98.49 0.76 0.00 0.00 0.00 71 K H H 105.70 3.89 20.48 24.29 91.94 49.97 -65.05 -41.55 0.69 0.00 99.31 0.16 0.06 0.41 98.74 0.63 0.00 0.00 0.00 72 L H H 35.23 13.36 15.77 30.10 92.20 49.36 -64.94 -42.09 1.16 0.00 98.84 0.22 0.10 0.75 98.26 0.68 0.00 0.00 0.00 73 F H H 69.36 10.98 14.55 26.40 92.21 49.99 -64.89 -39.65 2.76 0.01 97.23 0.49 0.24 1.88 95.70 1.67 0.00 0.00 0.01 74 N H H 107.49 1.90 15.94 17.78 92.35 52.60 -66.97 -32.64 10.81 0.02 89.18 0.80 0.60 9.22 86.41 2.94 0.01 0.01 0.01 75 S H H 70.07 3.82 13.17 18.15 93.54 55.03 -74.50 -21.49 30.14 0.05 69.81 2.27 1.64 25.89 66.87 3.26 0.01 0.02 0.04 76 L C H 72.76 10.78 8.69 19.75 99.79 62.15 -84.30 -3.92 54.05 0.43 45.52 26.76 2.20 25.25 42.68 2.64 0.00 0.15 0.31 77 K C C 148.19 3.06 13.87 18.46 105.47 116.82 -73.22 95.29 99.94 0.03 0.03 99.83 0.07 0.06 0.01 0.00 0.00 0.02 0.01