# 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 97.75 7.76 14.01 22.87 119.04 -153.68 -97.43 140.70 99.94 0.05 0.01 99.63 0.32 0.02 0.00 0.00 0.00 0.02 0.01 1 P C C 73.08 6.77 12.29 20.56 116.12 -103.81 -67.02 150.86 99.75 0.06 0.19 99.39 0.24 0.19 0.11 0.02 0.00 0.02 0.03 2 P C C 74.71 7.52 10.51 19.54 112.12 -102.70 -66.21 148.87 94.99 0.51 4.50 87.13 3.60 4.76 2.21 1.68 0.00 0.19 0.43 3 K C C 132.73 4.40 10.96 17.03 110.35 -106.99 -78.66 136.16 87.92 2.73 9.35 71.44 9.22 6.81 5.30 3.93 0.00 1.06 2.24 4 A C C 83.48 3.10 10.80 15.61 109.12 -106.23 -74.89 133.38 73.31 1.91 24.78 29.93 15.74 28.62 14.45 9.23 0.02 0.92 1.08 5 G C C 56.68 2.20 12.47 15.46 101.30 19.38 76.74 -1.36 73.45 1.13 25.42 30.08 14.99 29.41 15.96 8.36 0.01 0.50 0.69 6 Q C C 93.65 6.67 9.67 17.90 108.10 115.72 -83.77 122.61 64.95 1.36 33.68 45.88 12.81 6.30 28.40 5.27 0.00 0.56 0.77 7 T C C 76.29 4.31 12.31 17.91 110.59 -128.23 -80.79 152.66 56.47 1.05 42.48 43.74 6.95 5.24 40.34 2.81 0.00 0.46 0.45 8 K H H 124.05 4.56 12.56 18.46 95.75 -105.59 -65.64 -36.86 22.33 0.48 77.20 14.79 4.61 4.42 72.86 2.92 0.01 0.22 0.17 9 K H H 123.71 2.82 14.51 18.03 93.69 53.52 -66.99 -39.04 13.78 0.39 85.83 8.71 2.51 3.84 81.43 3.17 0.01 0.22 0.12 10 A H H 49.94 5.24 13.51 20.38 93.31 51.89 -66.43 -38.64 12.00 0.38 87.63 7.88 1.90 3.35 83.36 3.16 0.00 0.24 0.10 11 K H H 101.82 6.19 14.35 21.65 93.23 51.94 -66.90 -38.30 11.05 0.34 88.62 7.00 1.88 3.19 84.98 2.64 0.00 0.20 0.10 12 M H H 93.83 4.33 15.45 20.73 93.44 52.22 -66.98 -39.20 11.61 0.36 88.03 7.06 2.08 3.45 84.71 2.37 0.01 0.21 0.10 13 E H H 103.45 3.27 16.39 20.13 93.51 51.31 -66.56 -39.17 14.56 0.50 84.93 8.58 2.30 4.62 81.35 2.69 0.01 0.30 0.15 14 A H H 45.86 6.72 14.06 22.36 93.69 52.31 -66.30 -36.95 19.39 0.53 80.08 10.25 2.95 7.08 76.21 3.00 0.02 0.29 0.20 15 A H H 55.84 6.56 14.07 21.90 94.84 54.11 -71.70 -31.19 30.77 0.55 68.68 13.81 4.98 12.86 64.97 2.84 0.02 0.26 0.26 16 N C H 100.62 3.78 14.17 18.99 99.53 59.53 -79.56 -7.06 52.19 0.77 47.04 21.73 9.29 21.74 43.29 3.19 0.03 0.31 0.41 17 K C T 128.77 3.76 12.75 17.88 103.96 93.17 -79.12 16.69 67.84 0.93 31.23 24.23 15.47 28.55 26.57 4.22 0.02 0.36 0.58 18 G C C 43.46 4.93 12.68 18.92 105.04 13.49 22.63 -1.63 77.59 0.92 21.48 34.40 16.04 27.95 14.97 5.66 0.00 0.38 0.61 19 A C C 63.40 5.76 11.06 18.30 104.52 87.77 -78.61 35.25 74.85 1.25 23.90 41.47 18.01 15.71 15.16 8.30 0.00 0.51 0.83 20 K C C 131.81 3.34 12.26 16.90 105.69 119.32 -81.28 64.22 72.15 1.77 26.07 40.95 17.38 14.21 16.71 8.91 0.01 0.77 1.05 21 K C C 126.79 4.18 11.56 17.22 104.24 -113.11 -77.29 15.28 68.57 1.85 29.57 42.34 15.29 11.35 19.46 9.71 0.01 0.83 1.02 22 T C C 83.27 5.20 11.03 17.63 104.95 56.44 -82.86 43.33 69.44 1.75 28.81 46.99 12.65 9.85 20.04 8.73 0.00 0.83 0.91 23 T C C 89.60 4.42 10.89 16.81 106.47 57.23 -87.00 57.83 69.42 1.95 28.63 47.65 11.71 10.10 19.69 8.90 0.01 0.93 1.02 24 K C C 130.71 4.08 10.95 16.66 107.60 93.70 -85.50 99.24 71.94 1.78 26.28 45.05 14.64 12.38 17.62 8.53 0.01 0.84 0.94 25 K C C 142.30 2.97 11.60 16.01 108.36 -141.89 -87.58 102.44 74.38 2.47 23.16 46.59 14.72 12.95 14.98 8.27 0.01 1.22 1.27 26 W C C 136.57 7.98 9.11 18.17 111.95 -138.24 -89.11 128.14 75.83 3.33 20.84 47.28 16.41 12.04 14.37 6.50 0.01 1.53 1.87 27 S C C 66.30 4.38 11.14 17.00 112.54 -138.64 -87.79 137.99 81.25 2.25 16.50 57.17 13.27 10.25 12.34 4.62 0.00 1.06 1.29 28 K C T 151.52 2.54 11.39 15.42 104.11 -120.30 -76.87 10.04 65.18 1.13 33.69 19.93 17.27 28.80 27.36 5.46 0.04 0.47 0.66 29 G C H 46.37 3.34 12.86 17.22 101.77 41.45 -14.45 -37.27 62.00 0.84 37.16 19.60 16.90 26.43 31.32 4.88 0.03 0.34 0.50 30 Q H H 102.90 4.12 13.35 18.60 98.28 55.14 -71.98 -33.50 37.84 0.81 61.35 24.95 7.15 6.79 56.78 3.64 0.01 0.35 0.33 31 S H H 49.95 7.67 13.05 22.03 95.92 57.74 -67.48 -38.82 18.82 0.53 80.65 11.95 3.41 4.83 76.06 3.30 0.01 0.29 0.17 32 R H H 118.72 6.54 15.28 22.87 94.45 53.60 -67.20 -38.77 9.16 0.34 90.49 5.17 1.56 3.25 86.04 3.64 0.01 0.23 0.09 33 E H H 96.98 4.67 17.01 22.45 93.16 52.57 -66.68 -39.45 6.31 0.25 93.44 3.25 0.97 2.55 88.53 4.45 0.01 0.19 0.06 34 A H H 42.35 8.71 16.27 26.12 92.84 52.41 -66.41 -37.96 6.72 0.26 93.01 2.77 0.96 3.26 87.28 5.45 0.01 0.20 0.07 35 L H H 52.91 13.03 15.58 28.91 93.11 52.38 -69.06 -32.70 10.27 0.29 89.43 3.24 1.44 5.83 82.50 6.66 0.04 0.19 0.10 36 Q H H 96.78 8.06 18.30 26.97 93.94 58.88 -71.90 -20.68 26.42 0.30 73.28 3.13 2.62 20.53 68.47 4.84 0.11 0.16 0.15 37 N C T 85.33 7.84 18.23 26.66 98.18 52.92 -92.79 4.25 58.50 0.62 40.89 7.32 6.32 43.48 37.65 4.51 0.06 0.30 0.37 38 A C C 41.23 13.30 15.77 29.38 116.55 111.37 -81.02 137.74 75.33 11.98 12.69 44.65 21.05 9.32 9.35 3.89 0.09 5.76 5.90 39 V C C 55.34 14.14 17.71 31.76 112.50 -141.51 -94.99 120.05 71.76 20.35 7.90 52.92 10.92 6.89 4.86 3.45 0.04 13.83 7.08 40 M C C 81.17 11.64 20.67 32.05 105.56 -167.13 -91.69 25.32 77.58 18.45 3.97 55.37 17.28 4.48 2.25 1.96 0.01 13.22 5.42 41 F C C 29.51 21.27 11.99 32.18 123.36 81.34 -107.63 141.20 85.14 14.14 0.73 63.90 21.02 0.70 0.51 0.29 0.00 7.55 6.04 42 D C C 78.38 4.10 20.15 24.13 118.25 -114.16 -76.54 155.95 98.65 1.18 0.17 97.90 0.90 0.08 0.11 0.02 0.00 0.68 0.30 43 K H H 131.47 5.74 13.60 21.27 92.03 -112.71 -58.62 -37.95 1.03 0.00 98.97 0.10 0.11 0.65 98.98 0.15 0.00 0.00 0.00 44 E H H 127.40 1.26 18.37 18.02 91.70 53.11 -64.71 -40.62 0.66 0.00 99.34 0.05 0.04 0.50 99.18 0.23 0.00 0.00 0.00 45 T H H 28.34 11.84 15.78 28.95 92.06 48.34 -66.05 -40.98 0.27 0.00 99.73 0.03 0.01 0.18 99.59 0.19 0.00 0.00 0.00 46 Y H H 23.92 19.70 13.86 33.48 91.45 51.72 -62.68 -42.98 0.08 0.00 99.91 0.01 0.00 0.04 99.91 0.04 0.00 0.00 0.00 47 D H H 76.90 3.48 21.18 24.56 91.19 50.93 -63.27 -41.23 0.13 0.00 99.87 0.01 0.00 0.08 99.88 0.02 0.00 0.00 0.00 48 K H H 103.90 3.30 21.61 24.52 91.52 50.21 -64.37 -41.63 0.20 0.00 99.80 0.01 0.00 0.15 99.80 0.04 0.00 0.00 0.00 49 L H H 8.23 21.46 15.36 37.08 91.92 49.62 -64.09 -42.33 0.23 0.00 99.77 0.01 0.01 0.17 99.71 0.10 0.00 0.00 0.00 50 R H H 77.87 15.29 17.18 31.94 91.45 52.25 -63.49 -37.94 0.97 0.00 99.03 0.04 0.04 0.86 98.59 0.47 0.00 0.00 0.00 51 S H H 81.49 1.40 21.36 20.96 92.66 51.60 -69.30 -33.24 7.61 0.00 92.38 0.10 0.17 7.79 91.24 0.69 0.01 0.00 0.00 52 E H H 86.89 7.94 18.21 26.74 95.65 45.45 -78.05 -33.02 14.39 0.03 85.59 0.25 1.01 13.42 84.68 0.57 0.04 0.01 0.02 53 V C C 11.90 20.36 11.16 31.41 105.36 32.64 -119.09 55.66 92.51 0.55 6.94 46.48 40.72 5.01 6.07 0.97 0.00 0.13 0.63 54 P C T 75.44 8.13 15.48 25.18 92.83 153.04 -64.66 -25.46 93.30 0.25 6.45 13.53 4.98 74.60 0.78 5.84 0.00 0.15 0.13 55 K C T 156.06 1.58 19.19 20.11 94.78 50.98 -90.09 -3.18 92.59 0.26 7.14 3.75 7.09 81.01 0.54 7.33 0.00 0.15 0.14 56 Y C C 55.17 17.76 11.56 28.66 117.95 95.61 -87.88 138.52 94.42 1.40 4.18 72.03 17.67 4.14 0.71 4.02 0.00 0.62 0.81 57 K C S 121.65 6.73 21.62 29.17 97.60 -157.18 -81.88 -20.96 94.90 3.19 1.91 33.55 55.95 5.71 0.31 1.60 0.00 2.11 0.78 58 L E E 42.72 15.97 20.97 36.44 117.24 53.88 -109.97 122.20 39.87 58.20 1.93 23.00 14.93 3.06 0.68 1.32 0.05 50.14 6.81 59 I E E 13.02 23.16 20.85 43.59 113.83 -163.71 -112.41 117.45 36.73 62.68 0.59 30.37 6.16 0.47 0.38 0.29 0.00 49.03 13.30 60 T C C 24.59 13.82 26.74 41.02 129.39 136.98 -111.54 159.51 94.90 4.72 0.37 87.24 7.70 0.17 0.35 0.06 0.00 3.82 0.65 61 P H H 9.24 23.81 19.51 43.57 91.35 -111.25 -59.44 -36.88 3.36 0.01 96.63 0.16 0.28 2.95 95.51 1.06 0.01 0.01 0.00 62 S H H 43.47 10.01 23.97 34.32 91.66 56.32 -63.58 -40.29 1.85 0.02 98.14 0.10 0.12 1.64 96.97 1.14 0.01 0.01 0.00 63 I H H 38.91 10.07 23.65 34.69 92.04 49.13 -65.28 -42.11 1.24 0.04 98.72 0.15 0.13 0.96 97.23 1.48 0.01 0.03 0.01 64 I H H 4.17 23.88 18.57 42.58 92.37 48.67 -64.81 -43.36 1.52 0.11 98.37 0.24 0.24 1.10 97.86 0.45 0.03 0.05 0.03 65 S H H 11.21 17.15 16.72 34.51 91.66 50.97 -63.33 -42.84 2.21 0.13 97.66 0.38 0.35 1.50 97.18 0.45 0.03 0.05 0.05 66 D H H 100.18 2.44 21.44 23.65 92.41 47.80 -65.57 -40.90 2.22 0.02 97.75 0.17 0.16 1.82 96.93 0.88 0.01 0.01 0.01 67 R H H 112.46 8.57 18.57 27.67 92.52 46.79 -68.77 -37.71 4.38 0.02 95.61 0.12 0.29 3.96 94.83 0.76 0.02 0.00 0.01 68 L H H 30.92 17.13 14.45 31.79 96.06 35.94 -97.13 -2.24 18.59 0.06 81.35 0.78 2.11 15.52 80.53 0.97 0.03 0.01 0.04 69 K C T 159.44 1.89 20.96 22.88 93.08 -125.55 57.13 41.31 99.69 0.05 0.27 14.38 4.62 80.77 0.13 0.06 0.00 0.03 0.01 70 I C C 25.11 19.59 12.42 31.69 130.18 139.22 -119.29 153.96 97.91 2.00 0.10 78.19 19.32 0.23 0.06 0.03 0.00 0.59 1.59 71 A C C 55.91 5.20 23.50 28.75 113.58 -98.84 -68.38 143.06 99.18 0.71 0.11 98.96 0.37 0.04 0.06 0.01 0.00 0.18 0.38 72 V H H 49.33 18.13 15.05 32.43 92.17 -122.17 -59.80 -38.51 4.29 0.01 95.70 0.67 0.76 2.58 95.13 0.85 0.00 0.01 0.01 73 S H H 63.10 4.85 24.73 29.99 91.45 56.45 -64.18 -38.45 2.22 0.02 97.77 0.30 0.22 1.56 96.68 1.23 0.00 0.01 0.01 74 I H H 39.35 13.38 23.64 36.97 92.05 49.11 -66.38 -41.10 0.31 0.00 99.69 0.05 0.02 0.18 99.07 0.68 0.00 0.00 0.00 75 A H H 1.13 26.94 18.86 46.44 91.05 51.53 -62.96 -43.69 0.19 0.00 99.81 0.03 0.01 0.10 99.74 0.12 0.00 0.00 0.00 76 A H H 29.09 14.82 25.41 39.70 91.48 50.93 -62.70 -42.82 0.20 0.00 99.80 0.02 0.01 0.13 99.79 0.04 0.00 0.00 0.00 77 A H H 39.64 5.58 28.34 35.01 91.28 50.09 -63.57 -42.55 0.06 0.00 99.94 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 78 G H H 2.91 21.05 23.13 44.15 91.65 50.31 -64.08 -43.17 0.07 0.00 99.93 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 79 L H H 1.52 27.26 21.62 49.16 91.14 49.99 -64.20 -42.13 0.08 0.00 99.92 0.00 0.00 0.05 99.94 0.01 0.00 0.00 0.00 80 K H H 95.24 8.29 26.45 35.14 91.43 51.16 -62.72 -42.53 0.16 0.00 99.84 0.01 0.00 0.08 99.90 0.01 0.00 0.00 0.00 81 Q H H 59.05 7.48 24.62 32.77 91.73 49.86 -64.42 -41.99 0.18 0.00 99.82 0.02 0.01 0.10 99.86 0.01 0.00 0.00 0.00 82 L H H 4.43 23.22 17.44 41.11 91.97 49.76 -64.13 -42.48 0.27 0.00 99.73 0.04 0.01 0.15 99.71 0.07 0.00 0.00 0.00 83 C H H 31.40 16.16 17.36 33.21 92.03 50.37 -64.00 -40.93 0.53 0.00 99.47 0.04 0.02 0.40 99.34 0.21 0.00 0.00 0.00 84 R H H 168.78 1.69 20.48 21.73 90.43 52.45 -63.74 -33.24 4.26 0.01 95.73 0.06 0.08 4.55 95.03 0.27 0.00 0.00 0.00 85 E C T 88.68 8.15 16.00 25.48 92.72 50.97 -87.03 -0.14 93.08 0.01 6.91 0.07 0.58 92.53 6.65 0.16 0.00 0.00 0.01 86 K C T 135.43 5.12 20.46 26.79 92.93 -117.39 63.29 30.13 99.83 0.00 0.17 0.08 0.63 99.19 0.09 0.01 0.00 0.00 0.00 87 L C S 16.04 19.20 17.45 37.37 95.86 125.59 -86.05 -24.73 99.34 0.62 0.04 10.61 86.73 2.14 0.02 0.02 0.00 0.44 0.05 88 I E E 2.44 26.20 14.78 42.34 133.48 27.18 -136.80 149.77 12.73 87.26 0.01 7.90 5.49 0.07 0.00 0.00 0.00 86.06 0.46 89 R E E 103.95 7.36 26.30 34.29 122.88 -151.69 -118.08 134.78 1.23 98.77 0.00 1.13 0.04 0.00 0.00 0.00 0.00 98.80 0.02 90 L E E 59.29 17.72 16.92 33.91 110.32 -117.49 -74.79 125.26 0.50 99.50 0.00 0.49 0.01 0.00 0.00 0.00 0.00 99.50 0.01 91 V E E 51.72 11.25 18.36 30.62 101.72 176.21 -96.02 -32.95 1.36 98.63 0.00 0.98 0.15 0.01 0.00 0.00 0.00 98.84 0.00 92 S E E 43.38 6.79 21.10 28.89 139.77 -5.09 -156.55 154.07 1.02 98.97 0.01 0.72 0.13 0.01 0.00 0.00 0.00 99.11 0.01 93 C E E 63.67 14.63 11.90 26.30 127.24 -167.53 -134.91 136.54 5.31 94.67 0.02 4.49 0.47 0.06 0.00 0.01 0.00 94.88 0.09 94 S C C 50.10 5.68 14.32 21.49 127.80 165.33 -125.46 163.69 57.74 42.17 0.10 53.00 2.76 0.29 0.02 0.07 0.00 43.34 0.51 95 S C S 96.67 1.28 13.80 15.12 96.31 -71.13 -55.69 -41.20 98.86 0.50 0.65 2.22 49.95 46.79 0.03 0.59 0.00 0.34 0.09 96 K C T 149.95 3.19 14.28 18.04 99.99 9.06 -103.79 -4.43 98.80 0.52 0.68 2.44 48.19 48.28 0.03 0.62 0.00 0.37 0.08 97 T E E 42.11 12.58 13.64 27.19 126.17 61.63 -123.16 139.66 34.34 65.51 0.15 26.24 6.82 0.90 0.02 0.13 0.00 65.44 0.45 98 R E E 65.03 13.33 19.33 33.24 120.25 -148.90 -111.10 131.82 3.76 96.23 0.01 3.68 0.09 0.01 0.00 0.00 0.00 96.16 0.06 99 V E E 12.94 18.29 21.50 40.30 121.13 -163.59 -114.97 131.37 0.43 99.57 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.61 0.01 100 Y E E 15.80 20.80 22.16 42.80 124.39 -166.55 -114.55 140.51 0.29 99.71 0.00 0.27 0.01 0.00 0.00 0.00 0.00 99.72 0.01 101 T E E 17.62 17.28 23.28 40.31 132.79 -178.55 -132.24 152.25 2.58 97.41 0.01 2.49 0.08 0.01 0.01 0.00 0.00 97.35 0.07 102 R E E 63.26 15.86 21.56 36.76 114.59 -109.69 -77.62 138.42 25.84 73.89 0.27 23.74 1.78 0.22 0.14 0.11 0.00 73.41 0.60 103 I C C 49.81 15.64 18.37 33.82 109.19 -126.59 -83.16 121.41 78.36 15.57 6.07 67.11 7.49 3.26 3.28 2.59 0.00 14.97 1.30 104 V C C 56.65 11.94 17.01 29.27 111.81 82.03 -99.84 128.56 80.80 5.74 13.45 54.10 16.74 10.15 8.07 5.37 0.01 3.92 1.64 105 Q C C 123.63 4.54 18.05 23.39 101.25 -78.67 -80.83 -8.92 78.82 3.25 17.93 40.95 22.26 16.24 10.96 6.47 0.02 1.68 1.43 106 A C C 51.91 9.13 14.64 24.61 107.34 65.11 -90.46 17.34 71.46 1.56 26.98 34.19 23.59 14.44 19.90 6.29 0.01 0.65 0.93 107 A C H 44.97 9.70 14.41 24.95 112.38 -101.69 -77.86 150.56 58.85 1.07 40.08 27.30 21.12 11.10 35.02 4.46 0.02 0.42 0.55 108 P H H 69.32 7.02 15.75 23.80 100.40 -67.60 -67.30 -18.29 44.44 0.92 54.64 29.67 6.80 8.51 49.77 4.41 0.01 0.44 0.38 109 A H H 59.06 6.31 14.52 22.21 94.47 56.43 -64.52 -37.64 18.16 0.46 81.38 10.84 3.45 5.42 74.20 5.65 0.02 0.27 0.15 110 E H H 114.06 3.24 16.95 20.78 93.50 51.80 -66.98 -38.23 12.61 0.54 86.85 6.76 2.25 4.71 79.26 6.47 0.02 0.38 0.14 111 A H H 42.00 7.98 14.07 23.62 93.26 51.50 -67.10 -38.33 12.63 0.55 86.82 6.32 2.25 5.05 79.00 6.82 0.03 0.39 0.14 112 A H H 46.79 8.87 13.38 23.41 92.92 53.78 -66.36 -36.18 17.40 0.65 81.95 7.56 3.23 7.78 74.09 6.67 0.06 0.40 0.22 113 A H H 75.11 2.96 15.24 18.99 94.31 54.83 -70.45 -29.04 35.45 0.87 63.68 10.57 5.96 20.33 56.93 5.24 0.11 0.44 0.41 114 A C H 72.76 3.79 13.77 18.53 98.42 56.98 -79.79 -14.37 57.07 1.14 41.78 16.07 11.79 30.62 35.75 4.59 0.07 0.47 0.64 115 A C C 50.04 8.73 9.74 19.64 115.10 90.36 -82.35 141.13 87.21 1.07 11.73 48.46 33.89 5.24 8.15 3.14 0.00 0.36 0.76 116 P C C 95.44 2.96 12.85 16.90 104.59 -108.64 -66.08 134.40 69.81 1.37 28.82 39.15 9.46 21.07 8.77 20.11 0.00 0.71 0.72 117 A C C 76.40 4.08 10.55 16.21 102.97 -102.22 -74.47 -5.07 67.02 3.21 29.78 34.14 10.46 23.37 8.01 20.87 0.01 1.80 1.35 118 A C C 69.32 5.69 9.15 16.26 103.35 67.49 -81.10 11.76 74.37 3.05 22.58 62.14 2.77 11.26 6.59 14.07 0.00 1.88 1.29 119 E C C 137.86 3.00 12.87 17.35 105.78 71.93 -81.75 81.28 99.78 0.13 0.09 99.57 0.15 0.13 0.04 0.01 0.00 0.07 0.02