# 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 124.78 4.35 10.13 16.17 111.87 -156.66 -89.75 125.75 99.96 0.02 0.02 99.88 0.06 0.04 0.01 0.00 0.00 0.01 0.00 1 A C C 81.90 2.62 8.90 13.32 113.63 -123.79 -82.47 139.52 89.50 1.38 9.12 85.89 0.90 3.96 6.52 1.42 0.00 0.69 0.61 2 A C C 83.73 2.57 8.29 12.71 114.29 -126.42 -87.14 135.79 83.13 3.12 13.75 62.51 13.35 6.95 10.54 3.67 0.00 1.85 1.13 3 V C C 106.20 3.47 8.23 13.70 116.84 -147.20 -99.59 132.32 74.46 6.87 18.66 58.41 10.31 5.14 15.20 4.36 0.01 4.57 2.01 4 V C C 101.59 3.53 8.76 14.23 116.97 -158.51 -102.70 135.59 70.94 7.43 21.62 56.95 8.09 5.15 18.08 4.53 0.01 5.31 1.88 5 A C C 71.18 4.34 8.45 14.64 116.08 -141.28 -93.16 138.25 72.76 6.64 20.60 56.68 8.55 6.56 17.10 4.58 0.01 4.84 1.67 6 K C C 143.70 2.93 9.04 13.78 112.87 -141.71 -92.81 128.18 73.60 6.77 19.63 52.50 11.24 9.17 15.36 5.08 0.01 4.60 2.02 7 R C C 170.29 2.33 8.36 12.42 108.25 -143.70 -90.11 91.95 79.72 4.73 15.55 46.37 15.42 18.22 10.95 4.49 0.01 2.88 1.64 8 E C C 158.76 1.05 9.39 11.06 107.54 37.89 -91.70 85.00 89.45 1.78 8.77 35.74 24.77 29.73 4.66 3.40 0.00 0.92 0.77 9 G C S 48.62 2.32 10.49 14.15 126.58 14.91 141.77 -172.60 97.90 1.42 0.68 38.33 52.36 7.32 0.15 0.51 0.00 0.90 0.43 10 P C C 95.57 2.78 10.74 15.07 115.67 -40.26 -72.27 146.08 97.51 2.22 0.27 69.95 25.69 2.03 0.07 0.20 0.00 1.56 0.51 11 P C C 89.43 5.15 10.39 17.36 111.62 -105.39 -68.48 143.55 92.95 5.80 1.25 78.46 9.75 4.65 0.36 0.92 0.00 4.20 1.67 12 F C C 142.40 3.75 11.08 16.55 107.83 -146.24 -90.80 65.47 85.38 13.00 1.62 59.63 21.69 3.90 0.77 0.94 0.00 7.85 5.22 13 I C C 88.35 8.08 9.36 18.74 116.17 26.38 -105.66 124.34 87.34 11.50 1.16 63.02 23.41 1.41 0.80 0.44 0.00 5.78 5.14 14 S C C 58.68 3.84 13.03 18.19 116.78 -144.86 -90.34 146.54 97.61 1.30 1.10 94.54 2.84 0.44 0.97 0.13 0.00 0.67 0.40 15 E H H 131.61 3.29 12.12 17.20 92.79 -127.06 -60.66 -36.91 3.46 0.01 96.53 0.86 0.57 1.85 95.92 0.80 0.00 0.00 0.00 16 A H H 73.55 1.55 14.93 16.09 92.09 52.73 -64.76 -40.53 1.94 0.01 98.05 0.31 0.21 1.26 97.20 1.00 0.00 0.00 0.00 17 A H H 45.69 5.38 13.59 20.71 92.31 49.31 -65.70 -40.50 1.24 0.01 98.75 0.32 0.14 0.69 97.63 1.22 0.00 0.00 0.00 18 V H H 58.64 8.58 13.77 23.63 92.18 49.93 -65.01 -41.20 1.53 0.01 98.46 0.44 0.18 0.81 97.91 0.65 0.00 0.01 0.00 19 R H H 137.04 2.68 17.77 20.68 91.89 50.78 -64.31 -40.76 2.21 0.01 97.78 0.52 0.23 1.29 97.64 0.30 0.00 0.00 0.00 20 G H H 38.27 2.77 18.41 21.04 91.91 50.19 -64.46 -42.09 2.85 0.01 97.14 0.52 0.25 1.79 97.18 0.25 0.00 0.00 0.00 21 N H H 63.35 8.37 17.39 26.47 92.10 49.23 -65.16 -40.39 2.22 0.00 97.77 0.43 0.18 1.34 97.81 0.23 0.00 0.00 0.00 22 A H H 42.43 9.14 17.87 27.95 91.76 51.32 -64.27 -40.34 0.89 0.00 99.11 0.18 0.07 0.47 99.13 0.14 0.00 0.00 0.00 23 A H H 55.16 3.97 20.31 24.17 91.86 51.01 -64.29 -41.32 0.61 0.00 99.39 0.12 0.04 0.31 99.43 0.11 0.00 0.00 0.00 24 V H H 68.44 5.36 20.55 26.31 91.79 49.71 -64.20 -42.38 0.32 0.00 99.68 0.05 0.02 0.18 99.67 0.08 0.00 0.00 0.00 25 L H H 50.81 12.22 18.39 30.89 91.89 49.48 -64.72 -41.72 0.28 0.00 99.71 0.04 0.02 0.17 99.70 0.08 0.00 0.00 0.00 26 D H H 66.29 8.87 20.43 29.64 91.82 50.79 -63.64 -41.20 0.49 0.00 99.50 0.05 0.03 0.34 99.50 0.08 0.00 0.00 0.00 27 Y H H 129.58 3.63 23.09 26.20 91.82 49.71 -65.24 -41.48 0.64 0.00 99.36 0.06 0.04 0.46 99.35 0.09 0.00 0.00 0.00 28 C H H 45.66 9.49 21.09 30.94 91.90 49.76 -64.76 -41.70 0.63 0.00 99.37 0.07 0.04 0.42 99.37 0.09 0.00 0.00 0.00 29 R H H 72.96 15.23 21.15 35.36 91.69 51.11 -63.85 -41.56 0.54 0.00 99.46 0.05 0.03 0.39 99.43 0.10 0.00 0.00 0.00 30 T H H 56.95 9.34 23.63 32.89 91.79 49.43 -64.50 -41.95 0.39 0.00 99.61 0.04 0.03 0.27 99.60 0.07 0.00 0.00 0.00 31 S H H 49.77 6.74 25.49 31.95 91.57 49.33 -64.62 -42.37 0.39 0.00 99.61 0.04 0.03 0.26 99.61 0.07 0.00 0.00 0.00 32 V H H 40.52 13.66 24.26 37.69 91.87 48.77 -64.66 -42.26 0.27 0.00 99.72 0.02 0.01 0.18 99.73 0.05 0.00 0.00 0.00 33 S H H 22.87 17.48 22.93 39.52 91.51 51.26 -63.38 -42.52 0.17 0.00 99.83 0.02 0.01 0.11 99.83 0.04 0.00 0.00 0.00 34 A H H 46.40 9.18 26.56 35.68 91.68 50.12 -63.79 -42.26 0.13 0.00 99.87 0.01 0.00 0.09 99.86 0.04 0.00 0.00 0.00 35 L H H 72.38 8.03 28.10 36.37 91.58 48.47 -64.37 -42.60 0.11 0.00 99.89 0.01 0.00 0.08 99.87 0.03 0.00 0.00 0.00 36 S H H 15.68 17.62 24.25 41.59 91.89 49.90 -63.93 -42.47 0.16 0.00 99.84 0.01 0.00 0.11 99.84 0.04 0.00 0.00 0.00 37 G H H 16.92 16.25 24.05 39.68 91.80 51.05 -63.04 -42.34 0.21 0.00 99.79 0.01 0.01 0.15 99.78 0.05 0.00 0.00 0.00 38 A H H 47.56 7.61 27.19 35.08 91.59 49.91 -64.09 -42.51 0.41 0.00 99.59 0.02 0.02 0.31 99.55 0.10 0.00 0.00 0.00 39 T H H 44.41 10.08 26.12 36.39 91.82 48.78 -64.69 -42.21 0.86 0.00 99.14 0.06 0.05 0.67 99.00 0.21 0.00 0.00 0.00 40 A H H 12.22 17.25 19.63 37.27 91.48 51.72 -63.84 -41.86 1.19 0.01 98.80 0.11 0.09 0.90 98.22 0.66 0.01 0.00 0.00 41 G H H 25.90 11.26 19.73 31.30 92.10 52.28 -64.13 -39.75 3.94 0.01 96.05 0.26 0.23 3.39 93.81 2.29 0.02 0.01 0.01 42 I H H 98.11 6.24 20.80 27.29 91.73 52.78 -67.63 -34.87 10.21 0.03 89.76 0.39 0.61 9.47 87.31 2.15 0.04 0.01 0.02 43 L H H 79.92 8.18 17.22 26.20 92.99 51.97 -85.61 -4.94 47.87 0.15 51.99 1.14 3.42 42.54 50.05 2.60 0.07 0.05 0.12 44 G C T 43.05 5.50 19.07 25.29 99.23 -104.34 85.54 15.23 97.69 0.11 2.20 10.58 6.53 80.78 1.52 0.47 0.00 0.06 0.06 45 L C C 66.77 12.10 12.64 25.30 106.32 142.58 -87.24 72.30 96.67 0.99 2.33 51.99 31.34 13.40 0.97 1.17 0.00 0.35 0.79 46 T C C 72.49 5.52 17.32 23.86 125.64 45.90 -123.66 155.87 94.44 2.24 3.32 53.81 31.30 9.07 1.83 1.27 0.00 0.65 2.09 47 G C H 38.05 5.79 17.30 23.90 116.92 -7.71 67.36 -147.54 58.30 0.80 40.89 10.10 37.97 8.95 40.92 1.29 0.05 0.18 0.55 48 L H H 119.94 2.81 17.25 20.40 93.22 -25.53 -66.23 -36.25 10.14 0.04 89.81 1.27 2.30 6.58 88.79 0.95 0.05 0.01 0.04 49 Y H H 125.69 3.55 19.41 23.12 92.09 52.56 -65.15 -39.67 2.95 0.01 97.04 0.40 0.30 2.03 96.54 0.71 0.00 0.00 0.00 50 G H H 5.95 17.35 13.44 31.74 91.28 52.48 -62.52 -42.25 0.83 0.00 99.16 0.12 0.06 0.51 98.94 0.37 0.00 0.00 0.00 51 F H H 77.00 11.83 18.60 30.58 91.68 51.21 -63.36 -41.45 0.19 0.00 99.81 0.02 0.01 0.12 99.73 0.12 0.00 0.00 0.00 52 I H H 99.20 2.08 23.33 23.69 91.46 50.05 -63.90 -42.22 0.08 0.00 99.92 0.01 0.00 0.05 99.90 0.04 0.00 0.00 0.00 53 F H H 76.49 8.15 20.73 29.59 91.67 49.11 -64.47 -41.95 0.05 0.00 99.95 0.00 0.00 0.04 99.93 0.02 0.00 0.00 0.00 54 Y H H 21.35 21.17 16.45 37.29 91.75 50.66 -64.22 -42.53 0.03 0.00 99.97 0.00 0.00 0.02 99.96 0.01 0.00 0.00 0.00 55 L H H 71.71 9.84 21.27 31.24 91.47 50.55 -62.95 -41.57 0.03 0.00 99.97 0.00 0.00 0.02 99.96 0.01 0.00 0.00 0.00 56 L H H 97.09 2.20 24.80 25.34 91.60 49.50 -64.52 -41.74 0.04 0.00 99.96 0.00 0.00 0.03 99.96 0.01 0.00 0.00 0.00 57 A H H 22.66 12.13 20.06 33.17 91.70 49.40 -64.70 -41.58 0.05 0.00 99.95 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 58 S H H 13.09 19.70 17.56 36.96 91.71 51.33 -63.54 -41.57 0.09 0.00 99.91 0.00 0.00 0.06 99.92 0.02 0.00 0.00 0.00 59 V H H 73.64 6.18 22.80 29.26 91.70 50.16 -64.00 -41.85 0.07 0.00 99.93 0.00 0.00 0.05 99.93 0.02 0.00 0.00 0.00 60 L H H 88.63 3.34 24.02 26.51 91.64 49.39 -64.82 -42.03 0.06 0.00 99.94 0.00 0.00 0.04 99.94 0.02 0.00 0.00 0.00 61 L H H 34.31 14.54 19.73 34.48 92.06 49.37 -64.99 -41.85 0.09 0.00 99.91 0.00 0.00 0.06 99.91 0.02 0.00 0.00 0.00 62 S H H 20.37 16.65 17.92 34.62 91.55 51.98 -63.21 -41.91 0.13 0.00 99.87 0.01 0.00 0.09 99.88 0.02 0.00 0.00 0.00 63 L H H 87.41 4.16 22.38 26.47 91.81 50.70 -64.66 -41.56 0.11 0.00 99.89 0.00 0.00 0.08 99.89 0.03 0.00 0.00 0.00 64 L H H 73.20 5.28 21.26 26.77 91.62 50.72 -64.28 -42.32 0.17 0.00 99.83 0.01 0.00 0.12 99.81 0.06 0.00 0.00 0.00 65 L H H 29.14 15.75 16.81 32.92 91.69 50.35 -64.29 -42.02 0.28 0.00 99.71 0.02 0.01 0.21 99.66 0.11 0.00 0.00 0.00 66 I H H 55.19 11.50 16.39 28.66 91.78 50.65 -64.00 -40.98 0.63 0.00 99.36 0.05 0.03 0.47 99.16 0.29 0.00 0.00 0.00 67 L H H 107.19 2.29 18.89 20.79 92.23 49.81 -65.54 -40.02 1.76 0.00 98.23 0.12 0.09 1.45 97.61 0.73 0.00 0.00 0.00 68 K H H 113.11 5.52 16.74 23.16 93.26 49.05 -70.90 -31.38 7.16 0.01 92.83 0.26 0.36 6.45 92.15 0.76 0.01 0.00 0.00 69 A H H 30.48 14.09 11.72 26.06 95.77 49.62 -82.91 -13.30 41.61 0.13 58.26 2.09 3.99 34.34 57.95 1.43 0.04 0.04 0.11 70 G C T 49.21 3.02 17.54 20.82 103.41 -117.43 74.77 16.38 91.76 0.28 7.95 21.85 9.15 61.20 5.78 1.72 0.00 0.13 0.17 71 R C C 130.09 8.98 12.98 22.61 103.42 -69.43 -62.96 50.06 90.89 1.24 7.87 56.01 23.22 11.74 3.84 3.79 0.00 0.55 0.84 72 R C C 122.33 4.56 17.71 22.95 107.09 125.44 -101.69 87.99 92.91 1.32 5.77 85.06 3.95 4.31 3.10 2.10 0.00 0.69 0.80 73 W H H 58.57 18.57 10.41 27.98 94.55 135.73 -64.56 -35.76 19.48 0.53 79.98 9.04 2.94 7.34 40.56 39.61 0.02 0.33 0.17 74 N H G 99.79 5.65 15.27 22.47 91.40 63.88 -67.22 -22.98 9.98 0.09 89.94 1.15 0.90 6.76 41.69 49.39 0.03 0.06 0.02 75 K H G 140.93 1.88 17.94 19.35 93.23 58.13 -74.44 -25.65 10.50 0.07 89.43 0.81 0.85 7.56 44.86 45.80 0.05 0.04 0.03 76 Y H H 75.67 12.07 13.58 26.20 100.56 37.72 -98.87 -20.33 25.90 0.31 73.79 1.90 3.23 18.46 47.41 28.44 0.22 0.15 0.20 77 F C C 37.53 16.91 8.67 25.05 119.98 54.01 -117.45 127.91 82.01 12.15 5.83 51.99 24.57 3.96 4.27 1.53 0.01 3.10 10.57 78 K C S 156.14 1.63 15.69 17.43 96.28 -155.26 -75.73 -25.84 93.10 2.28 4.62 29.66 34.30 29.61 1.97 2.33 0.00 1.27 0.86 79 S C S 54.65 3.51 16.93 21.03 134.89 5.69 -148.99 162.36 90.79 1.57 7.64 28.18 33.45 29.58 3.34 3.81 0.00 0.65 0.98 80 R C H 128.50 10.39 11.80 22.76 93.31 -108.73 -66.91 -20.45 61.23 0.57 38.20 17.48 26.71 18.06 29.52 7.57 0.03 0.19 0.45 81 R H H 144.92 3.38 16.64 21.03 92.77 69.05 -65.26 -32.06 32.47 0.45 67.08 10.45 9.21 13.83 54.16 11.81 0.09 0.21 0.24 82 P H H 46.54 8.73 14.81 25.17 92.68 58.08 -66.09 -33.40 17.79 0.36 81.85 5.70 2.78 8.74 63.33 19.05 0.05 0.22 0.13 83 L H H 42.48 15.87 13.19 28.84 93.13 54.85 -68.01 -32.91 13.00 0.30 86.70 2.96 1.83 7.25 66.30 21.32 0.05 0.20 0.09 84 F H H 103.96 8.05 17.14 25.79 96.15 45.03 -79.98 -27.37 21.06 0.58 78.37 4.40 3.71 12.68 62.76 15.66 0.21 0.33 0.24 85 T H H 80.46 4.54 17.29 22.30 102.07 45.88 -95.44 -11.76 47.51 1.72 50.78 10.86 13.89 25.36 41.44 6.34 0.34 0.71 1.04 86 G C C 35.47 9.52 15.12 25.05 112.36 46.52 -72.24 146.97 82.61 1.10 16.29 32.83 21.39 28.48 13.56 2.67 0.01 0.40 0.66 87 G C H 29.20 7.82 17.90 26.57 124.11 -86.00 89.53 -164.32 56.45 0.92 42.63 17.41 26.07 13.75 39.66 2.20 0.05 0.26 0.59 88 L H H 75.60 11.77 16.89 28.86 93.35 -49.76 -65.01 -37.05 12.69 0.15 87.16 2.53 2.96 7.83 84.79 1.65 0.08 0.06 0.09 89 I H H 82.47 7.85 20.13 28.35 92.23 51.54 -64.71 -40.47 4.90 0.05 95.06 0.96 0.72 3.24 93.59 1.42 0.03 0.02 0.02 90 G H H 19.41 9.33 18.33 29.09 91.72 51.57 -63.49 -41.04 2.34 0.01 97.65 0.49 0.27 1.52 96.27 1.43 0.01 0.01 0.01 91 G H H 18.61 11.31 18.39 30.76 92.13 50.69 -64.10 -40.93 2.82 0.01 97.17 0.36 0.23 2.12 95.76 1.50 0.01 0.00 0.00 92 L H H 58.67 10.46 20.24 31.00 92.05 50.48 -65.28 -41.18 3.03 0.01 96.96 0.26 0.21 2.44 95.87 1.18 0.01 0.00 0.01 93 F H H 86.28 8.73 21.00 30.06 92.22 50.07 -65.48 -40.54 2.59 0.02 97.39 0.40 0.26 1.86 96.86 0.59 0.01 0.00 0.01 94 T H H 43.72 9.77 19.63 29.99 92.31 50.93 -64.77 -41.64 0.84 0.00 99.15 0.11 0.06 0.58 99.04 0.20 0.00 0.00 0.00 95 Y H H 82.55 10.25 19.73 30.42 92.00 49.99 -64.28 -41.76 0.28 0.00 99.72 0.03 0.02 0.21 99.62 0.13 0.00 0.00 0.00 96 V H H 53.55 10.13 19.21 29.87 92.14 48.96 -64.65 -42.38 0.15 0.00 99.85 0.01 0.01 0.11 99.78 0.09 0.00 0.00 0.00 97 L H H 68.36 8.09 19.26 27.87 92.03 49.67 -64.49 -41.85 0.19 0.00 99.80 0.01 0.01 0.16 99.71 0.12 0.00 0.00 0.00 98 F H H 80.28 7.66 18.82 27.06 92.10 49.06 -64.91 -42.08 0.56 0.00 99.44 0.03 0.02 0.51 99.21 0.23 0.00 0.00 0.00 99 W H H 86.95 9.28 17.33 27.44 92.16 48.77 -65.24 -41.33 1.22 0.01 98.77 0.07 0.07 1.10 98.23 0.52 0.01 0.00 0.00 100 T H H 45.51 9.07 15.48 25.84 92.71 50.63 -65.79 -40.92 2.22 0.02 97.76 0.18 0.17 1.89 96.54 1.18 0.03 0.01 0.01 101 F H H 109.45 5.57 16.68 22.69 93.48 47.91 -68.70 -39.88 4.34 0.04 95.62 0.41 0.34 3.64 93.55 1.97 0.05 0.02 0.01 102 L H H 86.40 6.20 15.83 22.58 95.47 43.75 -73.80 -36.33 10.48 0.05 89.47 0.58 0.72 9.36 87.24 1.99 0.06 0.02 0.03 103 Y H H 112.45 6.57 13.56 21.27 99.82 38.79 -96.34 -10.85 43.58 0.47 55.94 2.83 4.47 36.10 52.90 2.94 0.24 0.18 0.32 104 G C T 39.67 6.89 12.60 20.70 99.01 59.69 -19.64 -3.17 73.70 0.88 25.42 11.41 8.58 52.91 22.14 4.02 0.04 0.41 0.50 105 M C T 109.14 4.75 13.56 19.52 97.90 90.24 -77.84 -17.93 76.09 3.19 20.72 23.72 18.98 34.36 14.10 5.84 0.06 1.64 1.30 106 V C C 79.06 7.31 11.92 20.44 104.93 54.08 -95.92 3.28 68.72 12.55 18.73 26.84 19.51 23.76 12.14 6.06 0.26 8.30 3.12 107 H C C 105.59 7.26 11.48 20.03 113.58 97.95 -97.69 119.46 68.28 20.03 11.70 43.33 11.83 13.27 7.01 4.76 0.06 16.38 3.34 108 V C C 87.42 6.77 11.21 19.63 115.54 -165.03 -103.48 125.39 81.84 14.99 3.17 77.13 1.30 3.60 1.75 1.01 0.00 12.17 3.05 109 Y C C 129.49 7.31 13.13 21.74 115.65 -164.53 -103.12 125.83 99.80 0.19 0.01 99.80 0.05 0.02 0.00 0.00 0.00 0.12 0.01