# 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 37.00 6.16 13.25 20.71 122.66 -140.86 100.59 -174.97 99.88 0.09 0.02 97.10 2.68 0.14 0.01 0.00 0.00 0.04 0.03 1 D C C 88.36 3.46 11.78 16.51 111.30 -59.92 -85.15 132.59 90.06 0.08 9.85 87.58 1.03 1.22 9.66 0.43 0.00 0.02 0.05 2 P H H 88.80 3.78 9.55 15.00 95.86 -124.96 -63.88 -32.09 26.19 0.11 73.70 9.76 3.05 12.96 63.95 10.15 0.00 0.06 0.06 3 K H H 132.91 2.29 10.84 14.27 95.62 54.85 -69.21 -33.64 16.65 0.13 83.22 5.57 2.29 8.52 72.23 11.25 0.01 0.07 0.06 4 E H H 110.17 2.76 10.88 14.89 94.79 54.79 -68.26 -35.85 9.70 0.11 90.18 4.41 1.68 3.72 78.74 11.35 0.00 0.07 0.04 5 E H H 109.00 3.04 11.08 15.46 95.36 53.88 -68.89 -36.16 12.17 0.16 87.67 6.20 2.09 4.44 78.91 8.21 0.01 0.09 0.06 6 E H H 112.43 3.33 11.15 15.84 95.41 53.63 -70.34 -34.33 16.58 0.21 83.21 8.59 2.70 5.96 74.87 7.67 0.01 0.11 0.09 7 E H H 115.24 3.61 11.25 16.28 95.87 54.95 -72.40 -31.32 23.26 0.27 76.47 12.22 3.79 8.06 67.76 7.89 0.01 0.14 0.13 8 E H H 125.89 2.96 11.49 15.75 97.81 60.18 -75.05 -23.40 34.38 0.41 65.21 17.98 6.01 11.27 56.22 8.10 0.01 0.18 0.21 9 E C H 126.86 3.25 11.85 16.38 101.00 62.63 -84.00 3.78 53.34 0.67 45.99 29.87 8.37 15.75 37.63 7.67 0.01 0.28 0.40 10 L C C 96.62 6.78 10.99 19.07 109.79 101.89 -84.12 117.97 72.94 1.03 26.02 49.21 9.44 14.08 20.86 5.32 0.00 0.43 0.66 11 V C C 75.42 7.66 12.35 21.52 116.88 142.55 -97.90 133.37 87.19 1.43 11.38 60.94 21.03 4.30 10.82 1.31 0.00 0.40 1.21 12 D C C 71.69 6.85 15.47 23.70 107.84 -117.82 -83.28 115.11 97.07 0.16 2.77 92.24 3.78 0.70 2.99 0.15 0.00 0.05 0.10 13 P H H 51.21 11.55 15.04 27.90 93.32 -157.24 -64.06 -32.42 23.08 0.08 76.84 13.17 2.06 6.25 77.52 0.93 0.00 0.03 0.04 14 L H H 55.50 13.65 15.97 29.65 92.75 56.06 -65.34 -40.46 5.55 0.02 94.42 1.98 0.72 2.64 93.85 0.80 0.00 0.01 0.01 15 T H H 67.75 3.83 19.73 23.57 92.34 49.69 -65.46 -41.37 1.92 0.01 98.07 0.85 0.25 0.79 97.48 0.62 0.00 0.01 0.00 16 T H H 52.53 5.55 19.34 25.87 92.10 49.83 -64.91 -42.32 1.23 0.01 98.76 0.46 0.15 0.61 98.44 0.35 0.00 0.00 0.00 17 V H H 18.39 17.15 16.24 33.85 92.04 49.21 -64.48 -43.02 0.65 0.00 99.34 0.20 0.07 0.34 99.27 0.12 0.00 0.00 0.00 18 R H H 88.11 12.23 18.31 30.60 91.58 51.53 -62.66 -42.27 0.27 0.00 99.73 0.07 0.02 0.13 99.71 0.06 0.00 0.00 0.00 19 E H H 105.94 2.12 22.47 23.01 91.73 49.83 -64.11 -41.97 0.30 0.00 99.69 0.06 0.02 0.18 99.63 0.11 0.00 0.00 0.00 20 H H H 84.76 6.37 20.20 27.16 91.92 48.66 -65.25 -41.15 0.53 0.00 99.47 0.06 0.03 0.38 99.27 0.25 0.00 0.00 0.00 21 C H H 9.97 19.84 12.74 32.81 91.72 49.92 -66.47 -38.20 1.46 0.00 98.54 0.08 0.07 1.21 97.30 1.33 0.00 0.00 0.00 22 E H H 100.87 7.62 16.90 25.52 91.24 56.79 -67.83 -24.80 22.64 0.00 77.35 0.26 0.37 23.55 74.03 1.79 0.00 0.00 0.00 23 Q C T 133.47 1.55 18.29 18.98 93.84 55.00 -85.49 -8.81 68.88 0.02 31.10 0.91 1.55 66.65 29.09 1.78 0.00 0.00 0.02 24 L C S 42.23 13.98 8.58 23.01 115.10 98.80 -79.81 135.36 95.96 0.36 3.68 28.63 65.12 1.65 3.80 0.31 0.00 0.06 0.43 25 E H H 152.31 1.03 17.17 17.25 92.53 -135.61 -61.14 -36.19 18.93 0.03 81.04 1.04 2.15 15.57 74.30 6.86 0.04 0.01 0.03 26 K H H 108.76 6.41 17.18 24.53 92.40 52.12 -68.73 -32.72 18.13 0.02 81.85 0.54 1.01 16.90 75.45 6.04 0.03 0.01 0.02 27 C H H 10.02 20.12 12.09 32.15 97.28 45.80 -80.61 -27.82 11.56 0.03 88.41 0.91 0.73 9.70 81.97 6.64 0.02 0.01 0.01 28 V H H 64.81 5.68 19.35 26.04 91.78 63.76 -62.26 -42.04 1.24 0.00 98.76 0.34 0.12 0.56 98.60 0.38 0.00 0.00 0.00 29 K H H 114.20 2.30 23.14 24.17 91.54 50.13 -64.48 -41.43 0.86 0.00 99.14 0.15 0.05 0.52 99.06 0.22 0.00 0.00 0.00 30 A H H 11.73 16.47 16.97 34.34 91.48 50.43 -64.57 -41.97 0.29 0.00 99.71 0.04 0.01 0.17 99.70 0.08 0.00 0.00 0.00 31 R H H 86.81 13.43 19.51 32.45 91.82 52.34 -62.76 -41.58 0.07 0.00 99.93 0.01 0.00 0.03 99.94 0.02 0.00 0.00 0.00 32 E H H 106.14 2.14 23.88 24.34 91.52 50.34 -63.79 -41.81 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 33 R H H 94.30 8.50 21.48 30.34 91.85 49.66 -64.65 -41.60 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 34 L H H 15.41 19.91 16.12 36.11 91.93 50.45 -63.70 -41.92 0.06 0.00 99.94 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 35 E H H 98.53 4.07 23.21 27.21 91.40 50.62 -63.66 -41.37 0.13 0.00 99.87 0.01 0.00 0.09 99.88 0.02 0.00 0.00 0.00 36 L H H 80.18 3.06 22.55 24.83 91.58 50.06 -64.17 -42.00 0.35 0.00 99.65 0.02 0.01 0.25 99.66 0.05 0.00 0.00 0.00 37 C H H 12.56 16.19 16.12 33.33 91.84 49.97 -64.31 -41.94 0.64 0.00 99.35 0.06 0.03 0.43 99.35 0.12 0.00 0.00 0.00 38 D H H 55.47 10.97 18.35 29.75 91.80 52.18 -63.71 -40.49 1.71 0.00 98.29 0.21 0.12 1.18 98.19 0.31 0.00 0.00 0.00 39 N H H 101.94 1.43 21.80 20.94 92.13 50.04 -65.76 -39.88 5.18 0.01 94.81 0.52 0.40 4.00 94.17 0.89 0.01 0.00 0.01 40 R H H 97.97 6.64 17.47 25.08 93.10 49.05 -68.10 -38.08 9.47 0.05 90.48 1.55 1.07 6.65 89.33 1.34 0.02 0.02 0.02 41 V H H 31.58 15.48 11.78 27.34 93.98 52.30 -69.63 -35.40 19.52 0.35 80.13 6.49 3.57 10.21 77.50 1.86 0.04 0.13 0.19 42 S H H 76.14 3.00 15.54 19.20 95.06 55.97 -74.16 -22.61 41.41 0.63 57.96 15.01 7.10 19.67 55.52 2.09 0.03 0.23 0.35 43 S C H 72.80 2.88 12.27 16.25 103.18 71.48 -82.62 0.10 64.54 0.75 34.71 22.14 15.11 27.31 31.72 2.97 0.02 0.26 0.46 44 R C C 152.49 4.13 10.27 16.04 102.16 82.05 -80.42 2.34 79.67 0.70 19.63 33.06 23.92 22.75 15.69 3.82 0.00 0.24 0.52 45 S C C 71.92 3.63 10.64 15.72 104.97 88.12 -83.87 22.62 84.50 0.64 14.86 42.93 17.99 23.77 8.54 6.01 0.00 0.25 0.50 46 Q C C 128.31 3.25 10.50 15.28 99.79 72.55 -78.58 -8.75 80.24 0.68 19.08 29.29 25.15 26.54 8.39 9.75 0.00 0.26 0.62 47 T C T 92.41 3.43 10.75 15.62 103.73 64.27 -88.23 4.80 80.86 0.78 18.37 24.73 26.89 30.20 7.55 9.68 0.00 0.32 0.62 48 E C C 135.27 2.99 13.27 17.47 103.01 63.93 -86.68 24.72 83.29 1.55 15.16 45.13 19.18 19.32 6.71 7.99 0.00 0.73 0.94 49 E C C 74.38 11.59 11.12 23.31 115.41 130.48 -87.83 137.46 88.83 2.30 8.87 73.04 11.87 3.45 7.15 2.09 0.00 1.02 1.38 50 D C C 74.09 5.96 19.14 25.65 114.85 -154.06 -93.48 132.84 87.22 4.30 8.48 80.76 3.91 2.21 7.77 1.08 0.00 1.57 2.69 51 C H H 30.34 17.80 13.83 31.13 94.38 -132.63 -66.78 -27.44 44.65 0.92 54.42 27.02 8.67 8.86 52.73 1.86 0.01 0.38 0.47 52 T H H 65.21 7.11 19.47 27.25 92.18 63.49 -64.19 -40.60 11.70 0.23 88.08 4.95 2.17 4.77 85.96 1.91 0.02 0.10 0.13 53 E H H 89.91 5.24 21.36 26.96 92.18 50.95 -65.35 -40.41 2.93 0.03 97.04 0.78 0.39 1.68 93.81 3.32 0.01 0.02 0.01 54 E H H 32.33 16.45 17.63 34.11 92.15 50.72 -65.24 -41.39 2.51 0.02 97.46 0.55 0.25 1.59 94.12 3.46 0.00 0.01 0.01 55 L H H 42.81 14.76 19.15 33.76 91.92 50.80 -63.82 -41.33 3.06 0.02 96.92 0.53 0.28 2.12 94.36 2.69 0.00 0.01 0.01 56 F H H 96.43 5.67 22.43 28.19 91.60 50.70 -63.98 -42.01 2.40 0.01 97.59 0.47 0.24 1.57 96.58 1.12 0.00 0.00 0.00 57 D H H 46.38 11.08 20.39 31.93 92.08 51.30 -65.09 -40.88 2.64 0.01 97.35 0.43 0.21 1.86 96.10 1.40 0.00 0.00 0.00 58 F H H 33.22 18.40 18.45 36.36 91.94 50.47 -64.43 -41.35 1.82 0.01 98.18 0.28 0.16 1.28 95.76 2.50 0.00 0.00 0.00 59 L H H 63.96 10.37 21.13 31.69 91.98 51.25 -65.28 -38.33 2.39 0.01 97.60 0.26 0.19 1.82 94.40 3.33 0.00 0.00 0.00 60 H H H 88.48 7.35 21.24 28.96 92.22 52.13 -69.36 -28.98 9.12 0.03 90.85 0.59 0.60 7.69 86.53 4.55 0.02 0.01 0.01 61 A H H 20.15 17.13 15.52 32.70 94.50 62.05 -70.84 -21.24 23.38 0.11 76.51 2.80 2.28 18.09 71.47 5.19 0.05 0.05 0.08 62 R H H 98.96 12.53 19.29 31.09 95.69 57.84 -76.21 -29.34 39.92 0.40 59.69 5.07 7.29 28.04 54.98 4.04 0.15 0.15 0.28 63 D C C 63.21 9.57 18.49 28.52 111.51 56.82 -99.49 110.28 69.47 0.87 29.66 35.86 16.24 16.36 27.68 2.95 0.01 0.27 0.63 64 H H H 100.51 10.46 17.71 28.42 95.05 -146.71 -65.93 -25.57 45.29 0.15 54.55 2.99 5.08 36.16 51.07 4.47 0.06 0.06 0.12 65 C H H 53.80 7.39 20.51 28.37 93.73 56.59 -67.93 -37.33 39.40 0.10 60.50 2.55 3.35 32.61 57.87 3.46 0.05 0.04 0.08 66 V H H 26.31 13.11 19.35 33.36 92.55 51.24 -65.72 -41.85 5.28 0.02 94.70 1.40 0.62 3.08 93.17 1.70 0.00 0.01 0.01 67 A H H 15.40 16.54 16.99 34.14 91.94 52.96 -62.28 -42.73 1.13 0.00 98.86 0.31 0.11 0.61 98.31 0.65 0.00 0.00 0.00 68 H H H 91.88 5.53 21.02 27.03 91.75 50.70 -64.36 -41.16 0.60 0.00 99.40 0.14 0.05 0.34 98.93 0.53 0.00 0.00 0.00 69 K H H 97.93 4.43 20.69 25.19 91.97 50.01 -65.02 -41.51 0.50 0.00 99.50 0.10 0.04 0.30 99.14 0.42 0.00 0.00 0.00 70 L H H 31.33 14.02 15.86 30.86 92.18 49.57 -64.71 -42.32 0.87 0.00 99.13 0.14 0.06 0.57 98.73 0.48 0.00 0.00 0.00 71 F H H 68.17 11.02 14.82 26.64 92.16 50.01 -64.44 -39.91 2.15 0.00 97.84 0.35 0.18 1.49 96.62 1.35 0.00 0.00 0.00 72 K H H 136.29 1.79 16.19 17.84 92.27 51.76 -66.65 -36.14 8.38 0.01 91.61 0.61 0.45 7.16 88.87 2.90 0.01 0.00 0.01 73 N H H 99.10 3.75 13.50 18.35 93.16 52.07 -72.69 -24.13 25.85 0.04 74.12 1.68 1.29 22.59 71.29 3.09 0.01 0.01 0.03 74 L C H 69.82 11.10 8.97 20.29 98.14 56.71 -84.28 -7.98 50.40 0.30 49.31 21.47 1.97 26.90 46.78 2.55 0.00 0.10 0.22 75 K C C 144.66 3.50 13.79 18.90 103.67 131.44 -71.12 84.39 99.95 0.03 0.03 99.83 0.07 0.06 0.01 0.00 0.00 0.01 0.00