# 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 D C C 98.51 4.99 14.01 20.40 107.27 -157.40 -87.59 92.37 99.94 0.04 0.02 99.84 0.08 0.06 0.01 0.00 0.00 0.02 0.00 1 N C C 106.65 4.17 13.08 18.63 102.77 -155.05 -93.66 55.62 93.21 1.58 5.21 84.48 1.91 7.75 1.95 2.20 0.00 0.82 0.89 2 I C C 66.51 13.45 8.90 21.94 102.83 126.76 -89.65 27.87 85.92 4.85 9.23 60.91 9.78 14.84 2.24 7.16 0.00 2.69 2.38 3 Q C T 130.24 3.05 13.79 18.54 109.37 127.20 -77.59 118.61 86.52 4.39 9.10 23.03 13.46 50.47 1.91 6.82 0.01 2.69 1.61 4 G C T 51.94 3.66 16.29 20.60 99.44 20.80 83.86 -1.86 89.93 2.91 7.16 20.84 18.92 50.54 1.18 5.83 0.00 1.84 0.84 5 I C C 37.55 17.77 8.96 25.89 115.49 114.32 -92.70 128.65 92.25 6.41 1.35 74.95 15.64 1.01 0.82 0.52 0.00 2.22 4.84 6 T C C 71.31 3.37 19.90 22.91 121.21 -142.41 -87.66 159.04 96.41 2.23 1.36 93.53 2.57 0.39 1.24 0.16 0.00 0.75 1.38 7 K H H 113.39 9.53 13.57 23.95 93.11 -106.87 -58.90 -39.21 3.14 0.02 96.84 0.91 0.57 1.45 96.66 0.40 0.00 0.01 0.00 8 P H H 79.20 2.29 18.52 20.27 91.74 52.19 -63.52 -38.96 1.84 0.01 98.15 0.40 0.18 1.10 97.78 0.53 0.00 0.00 0.00 9 A H H 32.39 7.27 16.84 26.00 91.88 50.80 -64.75 -40.55 0.70 0.01 99.29 0.20 0.07 0.35 98.89 0.48 0.00 0.01 0.00 10 I H H 20.66 17.43 13.95 31.68 91.98 50.01 -64.60 -42.13 0.50 0.01 99.49 0.15 0.06 0.23 99.34 0.21 0.00 0.01 0.00 11 R H H 116.67 5.88 19.10 25.78 91.67 50.93 -63.38 -40.99 0.85 0.02 99.12 0.26 0.09 0.42 99.07 0.14 0.00 0.01 0.00 12 R H H 127.96 2.20 20.19 21.40 91.95 50.18 -64.51 -41.78 1.25 0.03 98.71 0.31 0.15 0.70 98.62 0.19 0.00 0.02 0.01 13 L H H 43.06 9.47 15.55 26.78 92.19 49.78 -65.00 -41.25 1.93 0.08 97.98 0.53 0.27 1.10 97.56 0.47 0.01 0.04 0.02 14 A H H 29.61 11.87 12.56 25.56 92.22 51.77 -64.33 -39.75 4.21 0.09 95.71 0.90 0.36 2.83 94.67 1.14 0.01 0.05 0.02 15 R H H 170.94 1.52 15.69 17.21 92.29 51.59 -67.39 -32.84 12.35 0.12 87.54 1.10 0.92 10.40 86.00 1.42 0.05 0.06 0.05 16 R H H 164.18 1.74 13.28 15.35 96.25 53.05 -81.95 -9.09 44.95 0.22 54.83 1.81 3.66 38.65 53.51 2.07 0.07 0.09 0.15 17 G C T 51.77 3.69 12.08 17.05 100.27 -41.42 60.31 5.81 74.12 0.20 25.67 3.33 8.48 60.75 25.14 2.04 0.02 0.08 0.17 18 G C C 51.76 2.90 13.19 17.16 101.49 -114.63 77.62 6.64 96.75 0.79 2.47 43.44 19.93 33.66 0.81 1.44 0.00 0.45 0.29 19 V C C 61.96 11.49 8.12 19.92 114.62 125.38 -93.05 128.18 89.10 7.92 2.97 80.43 6.24 2.42 1.03 1.84 0.00 5.90 2.14 20 K C C 162.56 1.36 15.44 16.70 100.92 -169.84 -90.06 -26.36 85.63 11.49 2.88 53.36 26.93 5.70 0.65 2.32 0.00 9.84 1.19 21 R C C 161.92 2.17 15.53 18.39 123.33 10.55 -132.98 141.07 61.23 35.36 3.42 46.31 10.63 4.74 0.98 2.49 0.01 32.58 2.26 22 I E C 62.37 14.91 8.23 22.41 121.18 -166.70 -118.38 130.41 49.06 49.38 1.56 43.07 3.56 0.73 1.15 0.69 0.00 40.92 9.88 23 S C C 64.59 2.78 15.22 18.44 122.03 -151.11 -98.16 162.03 77.72 20.89 1.39 73.45 2.83 0.86 0.88 0.44 0.00 20.09 1.44 24 G H H 51.60 2.60 13.97 17.28 100.09 -46.38 -16.12 -58.72 39.84 0.66 59.50 4.17 9.15 26.72 51.61 7.36 0.30 0.35 0.34 25 L H H 113.83 1.83 14.23 16.03 94.09 38.01 -69.33 -34.46 29.02 0.32 70.67 2.76 3.85 22.16 62.73 7.96 0.21 0.16 0.17 26 I H H 68.23 6.70 13.83 22.11 93.09 53.51 -65.77 -39.84 15.55 0.40 84.05 4.07 2.15 9.82 76.23 7.24 0.09 0.24 0.16 27 Y H H 73.79 11.01 13.31 25.35 92.03 53.43 -62.87 -42.19 2.28 0.03 97.69 1.08 0.28 0.90 97.09 0.63 0.00 0.01 0.01 28 E H H 114.40 2.49 18.40 20.84 92.09 50.38 -64.66 -40.82 0.50 0.00 99.50 0.15 0.04 0.23 99.43 0.15 0.00 0.00 0.00 29 E H H 105.49 2.72 19.28 21.65 92.20 48.92 -65.33 -41.27 0.30 0.00 99.69 0.06 0.02 0.16 99.65 0.10 0.00 0.00 0.00 30 V H H 35.28 11.90 16.31 29.37 92.15 48.89 -65.16 -42.00 0.29 0.00 99.71 0.05 0.02 0.16 99.72 0.05 0.00 0.00 0.00 31 R H H 90.45 10.53 17.73 28.71 91.74 51.50 -63.50 -41.21 0.17 0.00 99.83 0.02 0.01 0.09 99.85 0.02 0.00 0.00 0.00 32 A H H 55.64 2.62 20.32 22.30 91.64 50.65 -63.92 -41.73 0.17 0.00 99.83 0.02 0.00 0.11 99.84 0.02 0.00 0.00 0.00 33 V H H 69.57 4.37 19.81 24.63 91.85 49.30 -64.71 -42.31 0.14 0.00 99.86 0.01 0.01 0.09 99.87 0.02 0.00 0.00 0.00 34 L H H 38.67 13.20 16.31 30.34 91.90 49.95 -64.25 -41.89 0.11 0.00 99.89 0.01 0.00 0.06 99.89 0.02 0.00 0.00 0.00 35 K H H 100.71 6.88 18.72 26.31 91.75 51.61 -63.49 -41.27 0.14 0.00 99.85 0.01 0.00 0.09 99.86 0.03 0.00 0.00 0.00 36 S H H 61.32 2.21 20.30 21.40 91.78 50.40 -64.52 -41.44 0.23 0.00 99.77 0.02 0.01 0.17 99.77 0.04 0.00 0.00 0.00 37 F H H 90.08 6.65 18.94 26.39 92.09 48.88 -65.21 -41.85 0.27 0.00 99.73 0.02 0.01 0.18 99.76 0.03 0.00 0.00 0.00 38 L H H 45.12 12.66 16.32 29.69 91.99 49.93 -64.76 -41.54 0.17 0.00 99.83 0.02 0.01 0.10 99.85 0.03 0.00 0.00 0.00 39 E H H 99.37 4.16 19.74 24.28 91.77 51.16 -63.86 -41.15 0.13 0.00 99.87 0.01 0.00 0.08 99.89 0.02 0.00 0.00 0.00 40 S H H 54.21 3.14 20.27 23.17 91.93 49.87 -65.00 -41.28 0.29 0.00 99.71 0.02 0.01 0.19 99.74 0.03 0.00 0.00 0.00 41 V H H 41.44 10.77 17.80 29.60 92.05 49.35 -64.63 -42.47 0.48 0.00 99.51 0.05 0.02 0.31 99.58 0.04 0.00 0.00 0.00 42 I H H 59.91 10.36 18.07 29.14 91.68 49.92 -63.84 -42.10 0.57 0.00 99.43 0.10 0.04 0.32 99.45 0.09 0.00 0.00 0.00 43 R H H 138.61 2.26 21.81 23.19 91.55 50.11 -64.00 -41.62 0.86 0.00 99.13 0.14 0.07 0.55 99.10 0.15 0.00 0.00 0.00 44 D H H 69.53 4.69 20.56 25.55 92.03 48.71 -65.57 -40.74 1.83 0.01 98.17 0.28 0.14 1.25 98.09 0.22 0.00 0.00 0.00 45 S H H 20.70 13.39 16.15 30.62 92.07 51.25 -64.53 -41.42 2.48 0.02 97.50 0.50 0.25 1.55 97.31 0.37 0.00 0.01 0.00 46 V H H 63.06 6.37 19.08 26.40 91.91 50.32 -64.42 -41.49 3.16 0.08 96.76 0.80 0.42 1.83 96.38 0.49 0.01 0.04 0.02 47 T H H 73.30 2.17 20.85 21.69 92.02 49.76 -64.49 -42.07 4.58 0.16 95.25 1.35 0.64 2.58 94.58 0.70 0.02 0.10 0.04 48 Y H H 84.07 7.02 17.12 25.41 92.39 48.77 -66.09 -41.08 5.69 0.26 94.05 1.73 0.92 3.27 92.60 1.24 0.04 0.16 0.06 49 T H H 30.02 11.01 12.92 25.57 92.30 51.19 -66.11 -39.58 8.20 0.26 91.54 2.90 1.20 4.28 89.66 1.71 0.03 0.16 0.07 50 E H H 124.27 2.13 16.29 18.45 92.66 51.39 -65.59 -39.67 12.90 0.17 86.94 2.56 1.53 8.56 85.25 1.91 0.04 0.09 0.06 51 H H H 138.85 1.44 14.42 15.51 93.56 48.59 -71.28 -30.13 22.99 0.20 76.81 3.35 3.06 16.52 75.09 1.75 0.06 0.08 0.11 52 A C T 48.90 7.91 9.21 18.47 97.52 55.62 -83.14 -7.59 64.07 0.49 35.44 12.19 12.03 38.14 35.01 2.12 0.03 0.17 0.32 53 K C T 177.84 0.64 14.33 13.74 96.14 -127.08 51.36 26.17 88.39 0.34 11.26 20.19 12.56 55.57 9.05 2.26 0.00 0.14 0.22 54 R C C 116.99 5.69 9.56 17.18 123.48 115.17 -109.25 148.16 91.30 0.88 7.81 55.81 21.29 14.25 4.53 3.14 0.00 0.36 0.63 55 K C S 164.87 1.71 13.50 15.95 97.64 -146.18 -82.59 -14.99 95.33 1.34 3.33 31.76 54.69 9.30 1.42 1.61 0.00 0.79 0.44 56 T C C 89.19 2.77 16.79 20.22 127.93 42.85 -130.21 144.31 78.77 17.65 3.58 46.42 26.65 6.30 1.77 2.01 0.01 13.49 3.36 57 V C C 37.37 17.79 9.41 26.55 116.54 -145.41 -102.01 127.78 75.52 23.17 1.30 68.56 6.29 0.46 1.18 0.33 0.00 16.29 6.90 58 T C C 63.67 4.02 20.15 24.14 124.82 -154.35 -94.46 164.81 89.94 9.18 0.88 89.08 1.51 0.20 0.83 0.10 0.00 6.87 1.40 59 S H H 64.29 8.70 14.11 23.91 91.61 -102.29 -58.62 -38.58 3.67 0.01 96.31 0.72 0.66 2.03 96.13 0.45 0.00 0.01 0.00 60 L H H 99.89 2.96 19.30 22.10 91.74 54.26 -64.54 -39.87 1.17 0.00 98.83 0.16 0.10 0.78 98.67 0.29 0.00 0.00 0.00 61 D H H 40.63 11.05 17.46 29.54 91.94 50.36 -65.35 -40.76 0.36 0.00 99.64 0.08 0.03 0.20 99.44 0.25 0.00 0.00 0.00 62 V H H 20.61 17.44 16.31 34.02 91.79 49.82 -64.34 -42.93 0.13 0.00 99.87 0.02 0.01 0.08 99.80 0.09 0.00 0.00 0.00 63 V H H 60.56 6.42 20.37 27.54 91.44 49.79 -63.59 -42.83 0.15 0.00 99.85 0.02 0.01 0.10 99.81 0.06 0.00 0.00 0.00 64 Y H H 104.80 3.50 21.84 25.09 91.79 48.98 -64.17 -42.06 0.27 0.00 99.73 0.03 0.01 0.19 99.67 0.10 0.00 0.00 0.00 65 A H H 14.31 12.35 16.22 30.48 91.47 50.72 -63.27 -42.74 0.64 0.00 99.36 0.06 0.04 0.44 99.23 0.22 0.00 0.00 0.00 66 L H H 38.30 12.16 15.14 28.54 92.01 49.96 -64.50 -40.67 1.99 0.01 98.00 0.28 0.15 1.37 97.44 0.75 0.00 0.00 0.00 67 K H H 133.41 2.53 16.77 19.82 91.98 50.89 -65.27 -39.13 5.39 0.02 94.59 0.66 0.37 3.95 93.31 1.68 0.01 0.01 0.01 68 R H H 150.29 2.94 14.81 18.70 92.51 52.11 -68.28 -30.66 15.54 0.07 84.39 1.24 1.07 12.89 82.87 1.84 0.03 0.03 0.03 69 Q C T 96.27 6.90 12.01 20.17 96.34 51.63 -86.65 -2.62 61.69 0.22 38.09 2.68 4.10 52.65 38.25 2.06 0.02 0.08 0.15 70 G C T 58.79 1.80 14.40 16.64 98.74 -108.01 78.58 11.79 94.10 0.28 5.62 14.51 8.98 70.71 4.47 1.07 0.00 0.13 0.13 71 R C C 122.15 6.46 10.85 19.12 119.07 129.16 -98.60 138.48 93.05 2.32 4.62 80.34 9.27 3.36 3.02 1.55 0.00 1.12 1.34 72 T C C 85.64 4.63 12.72 19.02 116.75 -144.06 -97.11 138.92 89.40 5.59 5.01 80.72 5.30 3.18 2.74 2.05 0.00 3.09 2.92 73 L C C 96.27 7.98 10.18 19.34 108.84 -139.26 -86.90 113.84 81.58 7.38 11.04 41.31 21.86 19.28 3.69 6.64 0.04 3.59 3.59 74 Y C T 162.10 3.52 11.15 16.06 110.22 2.67 -90.83 112.29 84.37 5.06 10.57 20.49 24.31 40.14 3.10 6.85 0.04 2.72 2.34 75 G C C 57.95 2.19 11.26 14.63 103.71 -5.93 80.25 3.31 88.92 3.66 7.42 33.43 24.22 31.80 1.55 5.57 0.00 1.89 1.54 76 F C C 139.60 4.29 8.32 14.31 107.53 106.03 -94.79 55.58 89.97 5.64 4.38 58.76 15.06 16.13 1.32 2.86 0.00 2.87 3.00 77 G C C 56.34 2.38 10.91 14.76 109.57 -69.21 96.31 19.96 96.28 2.37 1.35 80.38 4.40 11.70 0.35 0.79 0.00 1.53 0.86 78 G C C 50.11 4.00 12.61 18.25 113.64 -75.94 93.69 151.89 99.86 0.13 0.02 99.49 0.32 0.10 0.01 0.00 0.00 0.07 0.02