# 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 99.92 8.16 13.85 22.75 106.52 69.07 -82.23 94.26 99.91 0.01 0.08 99.82 0.06 0.07 0.04 0.00 0.00 0.00 0.00 1 E C C 108.38 6.97 12.19 20.29 103.73 126.80 -78.67 -7.22 74.11 0.32 25.57 67.34 0.97 5.76 23.98 1.63 0.00 0.13 0.18 2 Q C C 113.94 4.01 13.84 19.03 98.84 75.12 -72.12 -28.84 57.46 0.40 42.14 42.01 5.75 7.96 41.54 2.38 0.00 0.16 0.21 3 Y H H 113.49 7.73 15.79 24.23 97.21 59.86 -70.86 -34.66 27.78 0.22 72.00 18.43 4.19 5.03 70.49 1.68 0.00 0.08 0.10 4 S H H 25.67 17.76 14.44 31.30 93.86 53.30 -65.44 -39.75 11.47 0.07 88.46 7.06 1.57 2.92 87.32 1.09 0.00 0.02 0.03 5 E H H 99.03 6.20 20.30 27.03 92.67 53.18 -64.15 -39.99 2.30 0.01 97.69 1.02 0.29 0.85 97.36 0.48 0.00 0.00 0.00 6 A H H 48.58 4.64 22.54 27.30 91.77 50.47 -64.57 -40.75 1.25 0.01 98.74 0.48 0.13 0.54 98.53 0.32 0.00 0.00 0.00 7 C H H 10.02 20.27 18.44 38.73 92.06 50.32 -64.48 -42.82 0.86 0.00 99.14 0.30 0.08 0.41 98.98 0.22 0.00 0.00 0.00 8 I H H 27.44 17.54 21.05 38.23 91.48 49.98 -63.26 -42.50 0.32 0.00 99.68 0.09 0.03 0.15 99.67 0.07 0.00 0.00 0.00 9 E H H 108.34 2.98 27.10 29.66 91.45 50.21 -63.74 -41.46 0.21 0.00 99.79 0.04 0.02 0.11 99.79 0.04 0.00 0.00 0.00 10 A H H 22.40 12.43 23.06 36.14 91.63 50.46 -64.01 -41.99 0.21 0.00 99.79 0.03 0.01 0.11 99.79 0.04 0.00 0.00 0.00 11 C H H 4.55 24.70 19.57 44.16 91.57 50.60 -63.57 -42.71 0.18 0.00 99.82 0.03 0.01 0.11 99.82 0.03 0.00 0.00 0.00 12 I H H 63.37 10.30 25.21 35.65 91.67 50.21 -63.61 -41.87 0.17 0.00 99.83 0.03 0.01 0.10 99.84 0.03 0.00 0.00 0.00 13 D H H 75.41 4.14 27.55 31.63 91.39 49.99 -64.10 -41.12 0.21 0.00 99.79 0.02 0.01 0.13 99.81 0.03 0.00 0.00 0.00 14 C H H 7.73 21.58 20.66 41.99 91.85 51.01 -64.12 -42.36 0.22 0.00 99.78 0.02 0.01 0.14 99.80 0.03 0.00 0.00 0.00 15 M H H 33.54 18.27 22.34 39.73 91.11 51.60 -62.99 -42.01 0.15 0.00 99.85 0.01 0.01 0.09 99.87 0.03 0.00 0.00 0.00 16 K H H 117.92 2.71 27.71 30.07 91.35 49.98 -63.57 -41.47 0.19 0.00 99.81 0.02 0.01 0.12 99.83 0.03 0.00 0.00 0.00 17 A H H 24.15 11.49 23.66 35.91 91.62 49.96 -64.07 -42.25 0.23 0.00 99.77 0.02 0.01 0.15 99.79 0.04 0.00 0.00 0.00 18 C H H 4.06 24.60 18.36 43.01 91.34 50.77 -63.53 -42.54 0.31 0.00 99.69 0.03 0.01 0.20 99.71 0.05 0.00 0.00 0.00 19 N H H 67.40 9.35 24.68 34.18 91.49 50.56 -63.68 -41.28 0.34 0.00 99.66 0.03 0.01 0.22 99.68 0.06 0.00 0.00 0.00 20 H H H 105.08 3.07 26.69 28.98 91.54 49.62 -64.20 -41.98 0.39 0.00 99.61 0.03 0.02 0.27 99.61 0.07 0.00 0.00 0.00 21 C H H 13.93 17.58 20.13 37.87 91.76 49.90 -64.09 -42.85 0.35 0.00 99.65 0.03 0.02 0.23 99.64 0.08 0.00 0.00 0.00 22 F H H 30.52 19.06 18.96 37.51 91.28 50.38 -62.96 -42.39 0.30 0.00 99.70 0.03 0.02 0.20 99.61 0.15 0.00 0.00 0.00 23 T H H 76.27 2.96 24.61 26.72 91.61 49.88 -63.87 -41.79 0.59 0.00 99.41 0.04 0.03 0.46 99.03 0.43 0.00 0.00 0.00 24 K H H 88.87 5.54 21.81 27.66 91.98 49.72 -65.57 -40.22 1.52 0.00 98.48 0.08 0.09 1.29 96.94 1.59 0.00 0.00 0.00 25 C H H 12.50 19.54 13.75 33.34 92.48 51.34 -66.31 -37.50 5.22 0.00 94.77 0.27 0.26 4.56 90.36 4.56 0.00 0.00 0.00 26 L H H 79.08 9.97 16.66 27.28 91.72 56.95 -68.97 -25.60 29.74 0.03 70.23 1.30 1.30 26.63 65.71 5.01 0.01 0.01 0.03 27 E C T 146.43 1.32 18.35 18.54 95.25 54.14 -84.46 -6.51 62.00 0.10 37.90 5.31 4.56 51.06 34.62 4.31 0.01 0.03 0.09 28 E C C 74.35 11.89 9.45 21.70 115.02 93.06 -81.49 140.72 89.11 0.36 10.53 52.11 27.28 9.49 8.39 2.25 0.00 0.09 0.38 29 S C C 88.67 1.85 15.13 17.27 102.29 -141.20 -76.45 7.30 90.29 0.34 9.37 45.51 23.70 21.22 5.04 4.09 0.00 0.12 0.32 30 V C C 78.63 7.80 11.42 20.41 105.67 62.12 -90.04 70.36 89.83 0.38 9.79 60.78 11.97 17.04 5.58 4.12 0.00 0.15 0.35 31 Q C C 98.09 6.79 12.26 20.39 100.24 141.16 -75.85 -27.38 53.15 0.46 46.39 34.93 8.60 10.24 30.84 14.86 0.00 0.18 0.33 32 H H H 150.13 1.55 15.74 17.26 95.05 53.21 -63.10 -33.28 26.12 0.16 73.72 4.69 3.69 15.49 43.00 32.94 0.02 0.08 0.09 33 H H H 109.18 5.88 15.09 22.01 95.80 46.79 -74.06 -25.30 24.61 0.15 75.24 3.66 2.90 15.45 44.83 32.98 0.02 0.07 0.08 34 L H H 46.24 15.51 12.98 28.10 95.64 53.95 -79.08 -19.09 23.52 0.18 76.30 6.65 3.12 12.24 52.30 25.49 0.02 0.08 0.10 35 S H H 53.41 5.17 18.95 25.07 92.50 73.10 -62.07 -41.81 4.49 0.01 95.50 1.06 0.51 2.57 94.53 1.33 0.00 0.00 0.00 36 G H H 31.39 5.36 21.79 27.52 92.22 51.01 -64.44 -40.45 2.39 0.00 97.61 0.33 0.19 1.62 96.96 0.90 0.00 0.00 0.00 37 C H H 15.08 18.51 17.22 35.88 91.87 50.90 -64.86 -41.98 1.48 0.00 98.51 0.41 0.13 0.78 97.92 0.75 0.00 0.00 0.00 38 I H H 52.72 12.71 21.15 33.80 91.68 50.94 -63.47 -42.01 0.60 0.00 99.39 0.14 0.05 0.29 99.30 0.22 0.00 0.00 0.00 39 R H H 131.36 3.10 25.91 28.42 91.65 50.31 -64.24 -41.05 0.34 0.00 99.66 0.06 0.02 0.17 99.66 0.09 0.00 0.00 0.00 40 L H H 34.40 14.54 21.76 36.31 91.72 49.91 -64.82 -41.85 0.26 0.00 99.74 0.03 0.01 0.17 99.73 0.06 0.00 0.00 0.00 41 D H H 18.59 21.22 19.37 40.08 91.66 51.39 -63.55 -41.99 0.17 0.00 99.83 0.01 0.01 0.11 99.83 0.04 0.00 0.00 0.00 42 R H H 119.72 5.83 26.43 32.78 91.79 50.35 -64.47 -41.08 0.11 0.00 99.89 0.01 0.00 0.07 99.89 0.03 0.00 0.00 0.00 43 E H H 76.69 7.37 26.47 34.37 91.63 50.18 -64.37 -42.07 0.14 0.00 99.86 0.01 0.00 0.10 99.86 0.03 0.00 0.00 0.00 44 C H H 5.52 23.72 20.18 43.63 91.47 50.60 -64.02 -42.23 0.15 0.00 99.85 0.01 0.00 0.10 99.86 0.03 0.00 0.00 0.00 45 A H H 25.40 14.70 23.71 38.21 91.05 51.71 -63.06 -41.88 0.07 0.00 99.93 0.00 0.00 0.04 99.93 0.02 0.00 0.00 0.00 46 D H H 82.32 3.20 28.63 31.70 91.25 50.24 -63.76 -41.44 0.08 0.00 99.92 0.00 0.00 0.05 99.92 0.02 0.00 0.00 0.00 47 I H H 23.09 17.92 23.85 41.25 91.81 49.75 -64.32 -42.95 0.10 0.00 99.90 0.00 0.00 0.07 99.90 0.03 0.00 0.00 0.00 48 C H H 8.26 23.61 20.75 44.06 91.34 50.95 -63.68 -42.11 0.11 0.00 99.89 0.01 0.00 0.07 99.89 0.03 0.00 0.00 0.00 49 A H H 51.35 6.16 27.45 34.10 91.49 50.65 -63.40 -41.83 0.17 0.00 99.83 0.01 0.00 0.12 99.83 0.03 0.00 0.00 0.00 50 L H H 61.95 7.76 26.90 35.32 91.53 49.57 -64.26 -41.99 0.23 0.00 99.77 0.01 0.01 0.16 99.78 0.04 0.00 0.00 0.00 51 A H H 4.12 23.64 19.41 43.00 91.51 50.94 -63.77 -42.41 0.28 0.00 99.72 0.02 0.01 0.17 99.74 0.06 0.00 0.00 0.00 52 V H H 39.57 13.52 23.24 36.62 91.21 50.53 -62.98 -42.73 0.62 0.00 99.38 0.05 0.03 0.40 99.33 0.19 0.00 0.00 0.00 53 K H H 114.09 2.67 26.56 28.30 91.65 49.97 -64.06 -41.18 1.75 0.00 98.24 0.10 0.08 1.42 97.87 0.52 0.00 0.00 0.00 54 A H H 12.22 15.40 17.35 33.88 91.87 51.09 -64.25 -41.67 3.63 0.01 96.36 0.30 0.24 2.82 94.81 1.82 0.00 0.00 0.00 55 M H H 45.55 17.28 15.46 32.27 91.91 51.79 -65.27 -37.78 10.86 0.02 89.12 0.69 0.60 9.32 86.49 2.88 0.01 0.01 0.01 56 Q H H 126.58 2.84 19.28 22.59 91.68 55.10 -68.71 -26.67 27.19 0.06 72.75 1.29 2.07 23.56 70.75 2.24 0.04 0.02 0.04 57 T C T 79.68 4.40 15.26 20.61 97.96 52.60 -88.55 2.91 80.00 0.13 19.87 3.16 14.96 60.62 19.13 1.94 0.01 0.04 0.14 58 D C T 118.89 2.53 16.83 20.45 96.61 -116.73 56.09 42.11 99.46 0.03 0.51 24.38 6.35 68.87 0.22 0.16 0.00 0.01 0.02 59 S C C 26.64 15.19 9.66 24.99 115.22 172.08 -82.61 137.42 99.71 0.07 0.22 97.49 2.11 0.19 0.08 0.06 0.00 0.01 0.06 60 P C T 106.71 2.08 19.08 21.11 92.73 -130.26 -65.14 -21.50 96.77 0.06 3.17 3.52 9.00 84.86 1.15 1.40 0.00 0.02 0.05 61 F C T 78.51 11.17 16.05 28.03 96.05 55.19 -93.77 3.01 95.22 0.05 4.73 8.65 3.24 84.12 2.48 1.45 0.00 0.02 0.04 62 M H H 23.94 21.50 13.41 34.53 92.21 103.50 -59.43 -42.56 1.61 0.00 98.39 0.54 0.14 0.64 98.15 0.53 0.00 0.00 0.00 63 K H H 121.70 6.08 21.98 29.27 91.26 52.80 -62.84 -40.40 0.29 0.00 99.71 0.03 0.02 0.17 99.40 0.38 0.00 0.00 0.00 64 E H H 99.59 4.47 25.49 29.92 91.66 49.41 -65.56 -41.15 0.15 0.00 99.85 0.01 0.01 0.09 99.50 0.39 0.00 0.00 0.00 65 I H H 8.68 22.46 20.79 42.81 91.84 49.15 -64.48 -43.45 0.11 0.00 99.89 0.01 0.00 0.06 99.82 0.11 0.00 0.00 0.00 66 C H H 5.50 23.72 21.20 44.56 91.32 50.02 -63.40 -42.18 0.08 0.00 99.92 0.01 0.00 0.04 99.92 0.03 0.00 0.00 0.00 67 A H H 50.46 6.24 27.82 34.78 91.58 51.00 -63.43 -41.56 0.09 0.00 99.91 0.00 0.00 0.06 99.91 0.02 0.00 0.00 0.00 68 L H H 38.88 11.71 26.87 39.30 91.71 49.54 -64.36 -42.62 0.10 0.00 99.90 0.00 0.00 0.07 99.90 0.02 0.00 0.00 0.00 69 C H H 1.50 26.57 22.77 49.34 91.30 49.75 -64.22 -43.47 0.09 0.00 99.91 0.01 0.00 0.05 99.92 0.01 0.00 0.00 0.00 70 A H H 13.13 18.37 24.33 42.28 91.12 51.35 -63.26 -42.61 0.07 0.00 99.93 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 71 D H H 79.70 3.64 29.77 33.87 91.22 50.15 -63.62 -41.67 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 72 I H H 15.05 18.76 24.71 43.18 91.36 49.32 -64.00 -43.50 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 73 C H H 1.95 26.45 21.22 47.77 91.19 50.27 -63.28 -43.14 0.08 0.00 99.92 0.00 0.00 0.05 99.93 0.02 0.00 0.00 0.00 74 E H H 89.77 8.07 27.82 36.68 91.56 49.98 -63.75 -41.82 0.13 0.00 99.87 0.01 0.00 0.09 99.88 0.02 0.00 0.00 0.00 75 A H H 39.48 6.23 27.70 34.93 91.20 49.35 -63.85 -41.53 0.21 0.00 99.79 0.01 0.00 0.14 99.80 0.04 0.00 0.00 0.00 76 C H H 4.13 22.99 21.05 43.99 91.43 50.04 -64.34 -42.53 0.34 0.00 99.66 0.02 0.01 0.23 99.65 0.08 0.00 0.00 0.00 77 G H H 9.11 18.58 21.28 39.46 91.22 52.99 -62.20 -42.74 0.45 0.00 99.55 0.03 0.02 0.33 99.41 0.20 0.00 0.00 0.00 78 T H H 84.88 2.12 27.47 28.40 91.51 49.34 -64.16 -41.55 1.21 0.00 98.79 0.05 0.06 1.03 98.07 0.78 0.00 0.00 0.00 79 E H H 59.21 10.22 22.84 33.43 92.07 49.07 -65.79 -40.55 2.57 0.00 97.43 0.10 0.12 2.26 95.13 2.39 0.00 0.00 0.00 80 C H H 5.14 24.14 13.48 37.68 91.07 52.72 -65.89 -33.11 8.21 0.00 91.79 0.34 0.41 7.20 84.82 7.21 0.00 0.00 0.00 81 G C T 42.88 7.25 19.01 27.26 90.56 62.95 -67.98 -19.53 55.07 0.03 44.90 1.47 1.45 52.65 38.09 6.29 0.01 0.01 0.03 82 K C T 152.18 1.51 20.34 20.84 93.06 58.92 -86.69 -7.68 79.27 0.06 20.68 3.85 4.05 72.65 13.76 5.60 0.00 0.02 0.07 83 H C C 40.86 17.88 7.78 24.41 121.09 97.48 -85.94 151.64 98.54 0.16 1.30 72.81 21.85 3.79 0.94 0.32 0.00 0.03 0.25 84 D C C 133.96 0.57 18.10 16.17 96.43 -135.67 -84.97 3.56 99.81 0.08 0.11 59.66 38.10 2.06 0.04 0.06 0.00 0.02 0.07 85 H C C 66.66 11.56 10.47 23.06 117.49 104.26 -90.59 134.93 99.41 0.26 0.33 53.33 45.47 0.53 0.24 0.06 0.00 0.03 0.35 86 D H H 111.62 1.71 19.33 20.72 92.64 -134.30 -62.43 -36.97 7.77 0.01 92.22 0.63 1.49 5.24 91.43 1.20 0.00 0.00 0.00 87 H H H 67.21 12.28 18.32 30.75 92.54 51.27 -65.49 -40.20 4.54 0.01 95.46 0.32 0.42 3.69 94.27 1.30 0.00 0.00 0.00 88 C H H 7.77 22.15 15.38 37.38 92.43 48.61 -65.22 -41.70 1.33 0.00 98.67 0.20 0.12 0.84 97.71 1.12 0.00 0.00 0.00 89 Q H H 81.84 7.10 23.86 31.30 91.47 51.12 -63.07 -41.88 0.30 0.00 99.70 0.06 0.03 0.15 99.56 0.20 0.00 0.00 0.00 90 A H H 48.69 4.96 26.94 32.23 91.39 49.66 -64.07 -42.43 0.21 0.00 99.79 0.02 0.01 0.13 99.76 0.08 0.00 0.00 0.00 91 C H H 4.71 22.75 21.16 43.71 91.62 49.54 -64.09 -43.25 0.14 0.00 99.86 0.01 0.00 0.08 99.85 0.05 0.00 0.00 0.00 92 A H H 9.43 19.80 22.55 41.95 90.98 51.12 -62.22 -42.83 0.09 0.00 99.91 0.01 0.00 0.05 99.90 0.03 0.00 0.00 0.00 93 K H H 115.32 2.83 29.32 32.22 91.07 50.06 -63.41 -41.48 0.10 0.00 99.90 0.00 0.00 0.07 99.89 0.03 0.00 0.00 0.00 94 A H H 16.09 14.42 25.21 40.08 91.54 50.03 -64.24 -42.24 0.16 0.00 99.84 0.01 0.01 0.11 99.84 0.03 0.00 0.00 0.00 95 C H H 1.21 27.31 20.85 48.56 91.00 50.50 -63.36 -43.22 0.23 0.00 99.77 0.01 0.01 0.15 99.79 0.03 0.00 0.00 0.00 96 F H H 77.28 11.98 27.08 39.05 91.63 49.96 -63.57 -42.42 0.16 0.00 99.84 0.01 0.01 0.09 99.86 0.02 0.00 0.00 0.00 97 T H H 66.49 3.95 29.41 33.77 91.12 49.71 -63.33 -42.75 0.16 0.00 99.84 0.01 0.01 0.10 99.85 0.03 0.00 0.00 0.00 98 C H H 5.13 21.57 22.75 44.20 91.59 49.45 -64.01 -43.32 0.15 0.00 99.85 0.01 0.01 0.09 99.85 0.03 0.00 0.00 0.00 99 A H H 6.42 21.74 21.36 42.79 90.92 51.44 -62.41 -43.02 0.14 0.00 99.86 0.01 0.01 0.08 99.87 0.03 0.00 0.00 0.00 100 E H H 106.76 2.88 27.80 30.23 91.31 49.98 -63.44 -41.98 0.16 0.00 99.84 0.01 0.01 0.10 99.85 0.04 0.00 0.00 0.00 101 Q H H 62.47 8.37 24.55 33.44 91.63 49.42 -64.49 -42.12 0.31 0.00 99.69 0.02 0.01 0.20 99.70 0.06 0.00 0.00 0.00 102 C H H 3.54 24.70 15.91 40.95 91.37 49.93 -63.60 -42.54 0.73 0.00 99.27 0.07 0.04 0.48 99.26 0.15 0.00 0.00 0.00 103 R H H 111.94 10.01 20.66 30.86 91.40 51.94 -62.54 -41.18 1.29 0.00 98.71 0.17 0.09 0.84 98.25 0.65 0.00 0.00 0.00 104 S H H 77.24 1.66 22.44 22.52 91.96 50.56 -65.68 -37.67 4.72 0.00 95.28 0.36 0.23 3.68 94.49 1.23 0.00 0.00 0.00 105 M H H 61.40 12.88 15.59 28.79 92.93 50.98 -69.05 -31.82 10.45 0.01 89.53 1.16 0.74 7.78 89.07 1.23 0.00 0.00 0.01 106 A H H 34.20 15.73 11.85 27.00 95.93 56.42 -76.91 -19.06 36.21 0.21 63.57 14.90 1.23 18.56 64.06 1.01 0.00 0.06 0.18 107 A C C 76.61 3.69 17.07 21.77 102.58 88.15 -70.34 6.67 99.79 0.01 0.20 99.17 0.11 0.46 0.24 0.01 0.00 0.00 0.00