# 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 A C C 70.22 6.48 11.65 19.56 112.65 163.23 -95.22 131.65 99.87 0.08 0.04 99.75 0.09 0.08 0.02 0.00 0.00 0.04 0.01 1 G C C 49.60 3.89 11.22 16.63 117.63 47.11 -100.97 167.36 91.96 2.92 5.13 86.30 1.41 5.26 2.21 1.82 0.00 1.99 0.99 2 L C C 121.20 3.79 9.20 14.57 109.29 -97.26 -87.75 108.81 78.07 9.08 12.85 51.46 15.37 11.64 4.66 7.94 0.01 6.37 2.56 3 L C C 112.59 4.38 9.50 15.60 112.05 -149.82 -93.18 120.71 72.38 14.82 12.80 46.45 15.41 10.98 4.71 7.86 0.03 11.17 3.40 4 K C C 129.28 5.14 11.11 18.00 117.03 -155.61 -101.35 131.20 72.12 17.40 10.48 51.72 12.65 7.42 4.17 6.39 0.02 13.67 3.95 5 K C C 133.90 4.62 12.82 19.31 117.78 -151.63 -101.27 135.34 78.41 17.85 3.74 63.27 11.24 3.00 2.08 1.84 0.01 13.69 4.86 6 T C C 68.88 9.91 10.01 20.74 119.28 -154.28 -101.49 142.33 78.50 19.28 2.22 66.68 8.18 2.37 1.27 1.08 0.00 13.46 6.96 7 T C C 88.75 5.16 13.48 19.99 109.81 -163.66 -101.76 58.43 78.42 17.69 3.88 48.93 21.71 8.04 1.75 2.15 0.03 10.10 7.29 8 G C S 46.30 5.50 14.62 21.07 109.35 -51.92 80.02 -114.53 85.12 4.27 10.61 15.08 38.92 32.36 2.67 6.70 0.04 2.58 1.65 9 L C T 90.75 10.17 12.88 23.25 104.41 -2.60 -90.62 18.86 79.02 6.87 14.11 16.79 26.37 36.86 3.52 9.48 0.07 4.06 2.86 10 V C T 85.85 8.24 14.13 23.23 111.18 112.87 -83.51 120.80 78.06 9.27 12.67 12.53 16.80 48.70 3.48 8.84 0.11 6.30 3.23 11 G C T 46.50 5.81 16.94 23.64 99.66 6.25 83.40 -0.84 79.65 12.70 7.65 22.41 19.10 39.52 1.85 5.28 0.03 9.51 2.31 12 L C C 55.24 13.93 13.24 27.61 117.77 121.15 -88.10 134.59 65.22 30.27 4.51 49.67 9.73 4.61 2.01 2.76 0.02 23.86 7.33 13 A C C 53.55 9.09 18.95 28.48 112.29 -121.31 -77.72 135.57 56.62 39.23 4.15 42.48 8.80 4.52 2.28 2.31 0.04 32.88 6.69 14 V C C 60.26 14.33 16.22 30.28 115.80 -143.26 -101.52 131.12 61.91 35.12 2.96 44.57 11.96 4.44 1.53 1.81 0.04 26.82 8.83 15 C C C 27.85 15.50 13.38 29.25 124.13 -148.45 -110.46 143.87 77.97 21.04 1.00 70.43 5.82 1.19 0.59 0.49 0.00 15.61 5.88 16 E C S 146.44 2.25 18.58 21.36 94.93 -139.12 -71.47 -26.11 99.35 0.43 0.21 6.06 91.55 1.94 0.07 0.05 0.00 0.21 0.11 17 T C C 62.81 6.68 18.75 26.32 110.62 27.30 -127.14 82.30 99.09 0.47 0.44 52.31 45.74 1.11 0.29 0.11 0.00 0.15 0.29 18 P H H 13.57 21.33 14.57 36.18 93.14 170.65 -62.16 -36.72 5.61 0.03 94.37 1.97 0.88 2.79 92.47 1.86 0.00 0.01 0.01 19 H H H 52.13 16.61 18.60 34.56 91.59 55.21 -62.94 -40.98 2.36 0.01 97.63 0.29 0.20 1.72 95.91 1.86 0.00 0.00 0.00 20 E H H 101.41 3.30 23.65 26.31 91.88 49.69 -65.71 -40.46 1.19 0.01 98.80 0.22 0.10 0.76 96.97 1.94 0.00 0.00 0.00 21 R H H 80.15 10.23 20.98 31.57 91.79 49.43 -65.13 -41.38 0.71 0.00 99.28 0.17 0.06 0.37 98.98 0.41 0.00 0.00 0.00 22 L H H 5.53 24.38 16.92 41.31 91.74 49.91 -64.71 -41.81 0.37 0.00 99.63 0.06 0.02 0.18 99.62 0.10 0.00 0.00 0.00 23 K H H 85.43 11.64 21.35 32.69 91.26 52.03 -62.51 -41.46 0.15 0.00 99.85 0.02 0.00 0.08 99.83 0.07 0.00 0.00 0.00 24 I H H 85.53 3.37 24.12 26.75 91.70 49.52 -64.39 -42.50 0.12 0.00 99.88 0.01 0.00 0.08 99.85 0.06 0.00 0.00 0.00 25 L H H 26.61 15.05 20.77 36.07 91.67 49.06 -64.48 -42.36 0.18 0.00 99.82 0.01 0.00 0.13 99.80 0.06 0.00 0.00 0.00 26 Y H H 20.34 21.21 18.44 39.22 92.08 50.39 -64.09 -41.44 0.28 0.00 99.72 0.02 0.01 0.19 99.74 0.04 0.00 0.00 0.00 27 T H H 61.11 6.13 22.49 29.03 91.52 51.23 -64.09 -41.01 0.17 0.00 99.83 0.01 0.01 0.12 99.84 0.02 0.00 0.00 0.00 28 K H H 98.36 4.69 23.30 27.96 91.73 50.18 -64.99 -41.18 0.17 0.00 99.83 0.01 0.00 0.12 99.83 0.04 0.00 0.00 0.00 29 I H H 13.79 19.89 18.60 38.39 91.93 49.42 -64.55 -42.95 0.24 0.00 99.76 0.02 0.01 0.15 99.75 0.06 0.00 0.00 0.00 30 L H H 36.87 15.23 19.14 34.37 91.55 50.78 -63.41 -40.64 0.22 0.00 99.78 0.02 0.01 0.14 99.69 0.14 0.00 0.00 0.00 31 D H H 91.45 2.07 23.57 24.24 91.88 50.72 -64.48 -40.59 0.67 0.00 99.33 0.03 0.02 0.54 98.82 0.59 0.00 0.00 0.00 32 V H H 36.51 10.30 18.98 30.55 92.01 49.27 -65.57 -41.08 1.33 0.00 98.67 0.06 0.05 1.13 96.99 1.77 0.00 0.00 0.00 33 L H H 15.48 21.42 13.43 34.65 91.52 53.19 -65.25 -34.85 2.33 0.00 97.67 0.11 0.11 2.01 91.61 6.16 0.00 0.00 0.00 34 G H H 46.30 5.50 17.92 24.68 90.84 60.31 -67.56 -20.68 38.46 0.02 61.52 0.41 0.71 39.45 53.48 5.91 0.01 0.01 0.02 35 H C T 145.86 1.62 18.88 19.76 94.59 53.21 -90.11 -7.80 67.25 0.03 32.72 0.90 2.00 66.18 25.21 5.67 0.00 0.01 0.04 36 I C S 30.68 18.48 7.33 24.65 117.77 98.24 -79.62 140.41 99.78 0.11 0.11 10.14 89.48 0.21 0.06 0.01 0.00 0.02 0.08 37 P C C 69.86 3.37 16.67 20.68 113.11 -103.21 -62.91 143.59 99.76 0.13 0.10 99.14 0.50 0.17 0.03 0.03 0.00 0.04 0.09 38 K C T 143.83 5.60 10.95 18.69 91.84 -121.68 -61.32 -28.40 99.47 0.07 0.46 2.12 9.07 88.31 0.06 0.36 0.00 0.04 0.05 39 N C T 132.34 0.90 15.51 15.27 94.57 57.62 -89.30 2.16 99.42 0.06 0.52 2.25 8.08 89.11 0.06 0.44 0.00 0.04 0.03 40 A C S 26.48 10.89 9.45 22.13 119.17 112.63 -78.38 150.84 95.74 1.02 3.24 13.78 81.44 0.66 2.68 0.19 0.00 0.10 1.13 41 A H H 66.52 3.38 18.01 21.86 91.57 -119.45 -60.51 -36.20 6.95 0.01 93.04 0.29 0.78 6.17 91.75 0.98 0.01 0.00 0.01 42 Y H H 62.32 13.63 15.52 29.55 92.17 52.91 -65.38 -38.88 3.74 0.01 96.25 0.25 0.26 3.15 95.18 1.16 0.01 0.00 0.00 43 R H H 64.36 14.55 15.39 29.96 91.66 53.36 -63.21 -41.40 0.47 0.00 99.53 0.08 0.04 0.28 99.12 0.48 0.00 0.00 0.00 44 K H H 125.79 2.29 22.06 23.60 91.82 50.01 -64.79 -41.25 0.25 0.00 99.75 0.04 0.02 0.15 99.66 0.13 0.00 0.00 0.00 45 Y H H 98.60 6.13 21.57 28.10 92.03 48.78 -65.69 -41.67 0.25 0.00 99.75 0.04 0.01 0.16 99.72 0.07 0.00 0.00 0.00 46 T H H 10.35 20.00 16.47 36.59 92.04 49.34 -65.08 -41.91 0.16 0.00 99.84 0.02 0.01 0.11 99.83 0.04 0.00 0.00 0.00 47 E H H 68.95 11.01 20.19 31.49 91.64 51.83 -62.93 -41.56 0.06 0.00 99.94 0.01 0.00 0.04 99.94 0.02 0.00 0.00 0.00 48 Q H H 102.28 2.21 24.58 25.16 91.82 49.91 -64.57 -41.56 0.10 0.00 99.90 0.01 0.00 0.06 99.91 0.02 0.00 0.00 0.00 49 I H H 38.66 11.89 20.95 33.55 91.95 48.82 -64.71 -42.57 0.19 0.00 99.81 0.02 0.01 0.13 99.83 0.02 0.00 0.00 0.00 50 T H H 10.48 20.83 17.14 37.93 91.73 49.81 -64.11 -42.50 0.19 0.00 99.81 0.02 0.01 0.11 99.84 0.01 0.00 0.00 0.00 51 N H H 82.65 5.10 23.18 28.52 91.52 50.89 -64.13 -40.71 0.11 0.00 99.89 0.01 0.00 0.06 99.91 0.01 0.00 0.00 0.00 52 E H H 98.83 3.43 24.00 26.77 91.68 49.89 -64.72 -41.59 0.07 0.00 99.93 0.00 0.00 0.05 99.94 0.01 0.00 0.00 0.00 53 K H H 32.25 17.76 19.31 36.65 92.06 49.72 -64.79 -41.88 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 54 L H H 34.27 16.02 19.02 34.97 91.52 51.54 -62.69 -41.55 0.06 0.00 99.94 0.00 0.00 0.04 99.94 0.02 0.00 0.00 0.00 55 S H H 61.91 2.19 24.31 24.83 91.32 50.80 -63.77 -40.91 0.17 0.00 99.83 0.01 0.00 0.13 99.82 0.04 0.00 0.00 0.00 56 M H H 51.60 8.85 19.88 29.97 91.81 50.37 -64.88 -42.04 0.16 0.00 99.84 0.01 0.01 0.13 99.75 0.11 0.00 0.00 0.00 57 V H H 9.92 21.99 13.30 35.19 91.78 50.70 -65.15 -39.80 0.43 0.00 99.57 0.02 0.02 0.35 99.14 0.46 0.00 0.00 0.00 58 K H H 128.88 5.08 19.03 25.36 91.47 52.37 -67.77 -30.29 5.22 0.00 94.78 0.09 0.13 5.22 94.03 0.53 0.00 0.00 0.00 59 A H H 79.28 1.78 18.74 19.53 94.91 47.77 -82.22 -21.53 21.16 0.02 78.82 0.60 1.25 19.05 78.42 0.64 0.01 0.01 0.02 60 E C C 59.11 12.08 11.49 24.40 116.29 45.23 -124.42 103.99 99.31 0.17 0.52 74.70 23.79 0.75 0.47 0.07 0.00 0.04 0.18 61 P C S 96.72 5.05 15.44 22.45 94.74 -171.02 -73.95 -17.39 99.72 0.16 0.12 42.70 55.95 1.12 0.04 0.04 0.00 0.06 0.09 62 D C C 75.42 4.59 18.98 24.41 111.70 87.34 -93.81 118.37 97.63 1.79 0.58 62.38 34.27 0.62 0.44 0.12 0.00 0.28 1.89 63 V H H 35.23 19.19 11.97 30.78 93.09 -153.70 -62.79 -36.25 5.68 0.04 94.28 1.36 1.15 3.28 91.72 2.44 0.01 0.02 0.02 64 K H H 129.03 3.47 19.22 23.54 91.42 56.50 -63.01 -41.00 3.61 0.03 96.37 0.57 0.41 2.57 94.24 2.18 0.01 0.01 0.01 65 K H H 100.39 3.03 20.81 23.35 91.88 48.55 -65.45 -40.14 2.08 0.05 97.87 0.64 0.29 1.17 95.25 2.59 0.01 0.04 0.01 66 L H H 8.48 18.86 13.65 33.41 91.77 50.95 -63.95 -43.12 1.27 0.04 98.69 0.45 0.21 0.65 97.49 1.16 0.01 0.03 0.01 67 E H H 38.78 14.39 15.04 30.06 91.83 51.34 -63.37 -41.40 1.62 0.05 98.33 0.45 0.23 0.96 97.05 1.26 0.01 0.03 0.01 68 E H H 139.06 1.24 20.22 19.85 91.99 50.73 -64.88 -39.26 3.46 0.03 96.50 0.42 0.28 2.80 94.72 1.73 0.01 0.02 0.01 69 R H H 125.57 5.79 17.40 24.12 92.70 49.70 -70.30 -33.64 7.07 0.04 92.90 0.29 0.55 6.54 91.42 1.15 0.03 0.01 0.02 70 L H H 27.30 17.75 10.80 28.22 98.37 43.85 -96.20 2.09 44.57 0.39 55.05 3.42 10.10 30.33 53.92 1.68 0.11 0.10 0.33 71 Q C T 145.05 1.61 18.21 19.71 95.02 -119.29 57.49 41.66 89.34 0.43 10.23 12.90 7.14 69.60 2.86 6.95 0.00 0.19 0.37 72 G C T 45.27 6.80 14.75 22.71 95.11 -44.33 76.32 5.99 87.25 0.25 12.50 3.04 10.49 73.32 1.52 11.29 0.00 0.12 0.22 73 G C T 33.36 9.39 16.50 26.35 99.81 -77.77 83.46 2.98 86.68 0.92 12.40 15.45 27.64 43.29 1.70 10.87 0.00 0.40 0.63 74 Q C C 76.33 7.57 20.86 28.93 111.63 131.60 -84.22 123.55 88.69 3.79 7.52 78.51 7.81 1.67 6.00 1.59 0.00 0.98 3.45 75 I H H 28.62 20.92 14.68 35.02 94.27 -146.99 -62.84 -40.28 1.63 0.00 98.37 0.37 0.22 0.84 97.96 0.60 0.00 0.00 0.00 76 E H H 99.78 7.11 21.69 29.20 91.78 54.25 -63.20 -40.52 0.51 0.00 99.48 0.06 0.03 0.34 98.88 0.69 0.00 0.00 0.00 77 E H H 86.15 4.91 23.18 28.25 91.72 48.85 -65.70 -40.68 0.21 0.00 99.79 0.02 0.01 0.14 99.14 0.69 0.00 0.00 0.00 78 V H H 8.58 20.38 17.57 38.23 91.82 50.23 -64.09 -43.31 0.09 0.00 99.91 0.01 0.00 0.05 99.86 0.07 0.00 0.00 0.00 79 I H H 32.82 16.84 20.42 36.87 91.80 50.06 -63.59 -42.74 0.07 0.00 99.93 0.01 0.00 0.04 99.93 0.02 0.00 0.00 0.00 80 L H H 81.76 4.01 24.36 28.12 91.50 49.61 -63.76 -42.39 0.07 0.00 99.93 0.00 0.00 0.04 99.93 0.02 0.00 0.00 0.00 81 Q H H 64.37 8.68 22.57 31.69 91.86 49.39 -64.81 -41.46 0.10 0.00 99.90 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 82 A H H 7.56 20.09 17.61 38.12 91.84 50.88 -64.18 -41.93 0.24 0.00 99.76 0.02 0.01 0.16 99.79 0.03 0.00 0.00 0.00 83 E H H 87.19 7.77 22.92 30.99 91.65 51.15 -63.25 -41.53 0.18 0.00 99.82 0.01 0.01 0.11 99.84 0.02 0.00 0.00 0.00 84 N H H 82.82 3.56 23.82 26.93 91.84 49.61 -64.91 -41.03 0.22 0.00 99.78 0.02 0.01 0.14 99.80 0.03 0.00 0.00 0.00 85 E H H 42.56 14.50 19.30 34.03 92.17 50.55 -64.95 -41.39 0.29 0.00 99.71 0.02 0.01 0.19 99.72 0.05 0.00 0.00 0.00 86 L H H 45.20 13.38 19.26 32.84 92.05 50.95 -64.12 -41.05 0.26 0.00 99.74 0.02 0.01 0.17 99.73 0.07 0.00 0.00 0.00 87 S H H 55.33 3.11 22.39 24.92 91.65 50.69 -64.00 -41.75 0.61 0.00 99.39 0.04 0.02 0.45 99.39 0.09 0.00 0.00 0.00 88 L H H 58.42 7.51 19.75 28.20 91.91 49.87 -65.02 -41.07 0.69 0.00 99.31 0.04 0.03 0.53 99.30 0.10 0.00 0.00 0.00 89 A H H 19.42 14.52 15.88 31.39 91.84 52.07 -63.32 -41.50 0.31 0.00 99.69 0.03 0.02 0.18 99.67 0.10 0.00 0.00 0.00 90 R H H 120.68 4.28 20.03 24.76 91.70 51.24 -63.99 -40.20 0.50 0.00 99.49 0.04 0.02 0.35 99.20 0.38 0.00 0.00 0.00 91 K H H 110.73 3.07 18.89 21.95 91.91 50.44 -65.12 -39.66 1.01 0.00 98.99 0.06 0.04 0.79 98.10 1.00 0.00 0.00 0.00 92 M H H 53.09 12.89 13.57 27.10 92.60 51.46 -67.26 -33.92 2.42 0.00 97.58 0.15 0.12 2.01 94.95 2.76 0.00 0.00 0.00 93 I H H 84.22 9.18 14.10 24.07 92.30 55.20 -69.16 -28.28 23.20 0.02 76.78 0.46 0.66 22.54 72.93 3.36 0.02 0.01 0.02 94 Q C T 141.63 1.02 16.90 16.43 95.42 49.27 -87.99 -8.91 53.49 0.04 46.47 1.07 1.74 50.23 44.34 2.56 0.01 0.02 0.03 95 W C C 103.56 9.50 9.00 19.78 115.99 95.12 -81.25 137.67 93.10 0.66 6.25 50.30 37.79 4.67 5.31 0.96 0.00 0.14 0.81 96 K C C 131.95 3.51 14.89 19.58 112.03 -146.87 -95.66 115.71 98.37 0.71 0.92 94.77 2.65 1.00 0.29 0.47 0.00 0.25 0.57 97 P C T 64.50 12.04 10.59 23.04 95.86 -135.69 -66.78 -19.41 97.20 0.58 2.22 18.81 13.74 64.32 0.22 2.31 0.00 0.30 0.28 98 W C T 150.71 6.69 12.66 20.20 99.84 49.91 -94.10 11.84 96.19 1.35 2.46 17.08 14.86 63.95 0.28 2.53 0.00 0.74 0.56 99 E C C 105.71 4.51 12.20 18.43 117.32 115.72 -87.25 139.67 97.51 1.80 0.70 48.46 48.14 1.15 0.18 0.44 0.00 0.74 0.89 100 P C C 96.34 3.99 11.60 17.34 113.39 -101.65 -66.34 145.55 95.84 2.41 1.75 85.61 6.56 3.58 0.41 1.39 0.00 1.36 1.10 101 L C C 100.65 7.09 8.53 16.98 108.52 -114.94 -78.01 126.57 91.47 6.15 2.38 77.14 9.76 3.92 0.66 1.89 0.00 2.96 3.67 102 V C C 107.82 3.65 9.50 14.73 110.85 -146.03 -96.71 102.80 91.46 6.55 1.99 73.28 14.50 3.28 0.64 1.42 0.00 3.34 3.56 103 E C C 139.36 2.21 10.24 13.97 118.79 32.88 -98.40 143.89 94.67 4.16 1.17 67.68 24.66 2.53 0.34 0.78 0.00 2.05 1.96 104 E C C 153.94 1.47 11.73 14.23 114.04 -100.09 -79.51 134.90 98.91 1.00 0.09 87.86 10.92 0.23 0.03 0.05 0.00 0.45 0.46 105 P C C 65.99 10.50 7.05 17.99 116.67 -108.01 -65.57 150.20 99.84 0.13 0.03 98.55 1.26 0.08 0.01 0.01 0.00 0.05 0.06 106 P C C 82.72 3.14 10.89 15.67 114.96 -102.62 -64.31 151.35 99.43 0.24 0.33 97.78 1.11 0.62 0.07 0.17 0.00 0.07 0.17 107 A C T 96.61 1.04 10.47 12.02 108.10 -98.60 -65.53 142.28 97.58 0.30 2.13 10.10 20.18 67.02 0.20 2.15 0.00 0.14 0.20 108 S C T 86.89 2.17 9.90 13.30 98.62 14.95 29.86 32.32 96.98 0.57 2.45 19.49 13.11 64.14 0.34 2.33 0.00 0.29 0.30 109 Q C C 103.50 5.36 8.90 16.08 99.61 147.94 -76.64 -13.99 92.25 1.64 6.11 43.12 19.43 28.67 0.75 6.34 0.00 0.73 0.95 110 W C C 144.91 6.62 8.51 16.32 108.92 48.24 -96.06 90.09 93.04 2.34 4.61 46.77 16.95 28.71 0.64 4.58 0.00 1.09 1.26 111 K C C 144.79 1.98 10.95 14.40 117.68 142.02 -99.67 138.38 93.53 3.68 2.79 67.46 20.73 4.88 0.66 2.27 0.00 1.51 2.48 112 W C C 169.92 4.42 7.23 13.59 114.69 -109.92 -79.99 140.47 97.62 1.58 0.79 56.69 33.09 7.85 0.18 0.64 0.00 0.74 0.81 113 P C C 105.08 2.31 8.78 12.52 108.84 -3.11 -72.52 131.88 99.18 0.45 0.37 88.29 3.92 7.04 0.08 0.22 0.00 0.24 0.20 114 I C C 121.32 3.54 9.78 15.02 108.36 -139.32 -87.12 116.52 99.91 0.08 0.01 99.79 0.11 0.04 0.00 0.00 0.00 0.03 0.01