# 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 Y C C 113.97 9.82 13.20 23.78 120.27 -166.86 -103.75 134.88 99.82 0.14 0.03 99.76 0.09 0.05 0.01 0.00 0.00 0.07 0.02 1 R C C 146.02 4.99 11.68 18.46 114.27 -151.55 -93.32 131.85 91.17 2.76 6.07 87.00 1.08 4.11 3.07 1.99 0.00 1.71 1.03 2 K C C 139.47 3.52 11.50 16.76 110.44 -144.13 -88.22 116.24 85.53 4.90 9.57 63.86 10.76 10.90 3.84 5.55 0.00 2.97 2.11 3 L C C 91.35 8.55 9.18 18.70 107.01 -143.90 -78.49 85.00 84.43 3.86 11.71 39.45 16.36 29.45 3.77 7.27 0.01 2.11 1.59 4 G C C 56.31 2.41 13.40 16.50 101.49 11.41 79.90 0.71 89.26 1.98 8.75 37.18 22.77 29.82 2.86 5.51 0.00 0.97 0.89 5 R C C 111.17 7.38 9.72 18.66 119.56 114.90 -92.30 149.81 91.65 2.13 6.22 48.95 37.11 5.81 3.52 2.38 0.00 0.83 1.39 6 T C C 81.24 2.54 14.84 17.62 118.83 -112.09 -79.09 160.57 93.24 1.79 4.97 72.59 18.12 2.24 4.38 0.86 0.00 0.61 1.20 7 S H H 65.57 6.33 11.75 19.58 94.86 -103.34 -61.27 -40.79 8.68 0.04 91.28 2.92 2.83 3.00 90.40 0.80 0.00 0.01 0.02 8 D H H 109.40 1.52 15.59 16.77 92.92 50.68 -65.33 -38.28 3.99 0.02 95.99 0.99 0.59 2.20 95.42 0.78 0.00 0.01 0.01 9 Q H H 94.82 3.69 16.24 20.69 92.42 49.80 -66.20 -40.02 1.77 0.01 98.22 0.67 0.22 0.84 97.52 0.73 0.00 0.00 0.00 10 R H H 52.11 15.46 13.94 29.48 91.58 50.92 -64.23 -41.87 0.68 0.00 99.31 0.25 0.07 0.30 99.13 0.24 0.00 0.00 0.00 11 K H H 88.95 10.07 18.88 29.37 91.29 51.11 -62.70 -41.48 0.42 0.00 99.58 0.12 0.03 0.21 99.55 0.09 0.00 0.00 0.00 12 A H H 52.57 2.96 22.46 24.67 91.33 50.48 -63.47 -41.56 0.42 0.00 99.58 0.10 0.03 0.22 99.58 0.07 0.00 0.00 0.00 13 M H H 49.48 11.54 20.98 33.05 91.83 49.90 -64.78 -41.82 0.46 0.00 99.54 0.08 0.03 0.27 99.57 0.06 0.00 0.00 0.00 14 L H H 11.66 22.66 18.73 40.85 91.30 50.53 -63.65 -42.59 0.21 0.00 99.79 0.04 0.01 0.11 99.81 0.03 0.00 0.00 0.00 15 R H H 105.09 10.47 23.19 33.51 91.28 51.10 -62.64 -42.10 0.13 0.00 99.87 0.02 0.01 0.07 99.88 0.02 0.00 0.00 0.00 16 D H H 78.42 4.05 26.24 30.21 91.73 49.48 -65.16 -41.07 0.29 0.00 99.71 0.03 0.01 0.18 99.73 0.03 0.00 0.00 0.00 17 L H H 15.80 19.22 21.81 40.63 91.62 49.55 -64.39 -42.66 0.56 0.00 99.44 0.05 0.03 0.40 99.47 0.05 0.00 0.00 0.00 18 A H H 6.60 22.95 20.78 43.26 91.41 50.62 -63.45 -42.64 0.69 0.00 99.31 0.06 0.04 0.46 99.37 0.06 0.00 0.00 0.00 19 T H H 52.90 7.99 25.15 33.37 91.67 50.66 -64.28 -42.13 0.95 0.00 99.04 0.16 0.07 0.61 99.00 0.15 0.00 0.00 0.00 20 S H H 31.59 8.94 23.15 33.05 91.73 50.73 -64.88 -40.63 1.45 0.01 98.55 0.23 0.12 0.97 98.31 0.36 0.00 0.00 0.00 21 L H H 6.92 23.35 17.28 40.51 91.81 50.86 -65.08 -41.83 1.93 0.02 98.05 0.29 0.16 1.41 97.56 0.56 0.01 0.01 0.00 22 I H H 45.85 16.95 19.36 35.46 93.57 45.98 -68.70 -39.14 4.67 0.04 95.29 0.42 0.37 3.74 94.84 0.56 0.02 0.02 0.02 23 I H H 96.24 5.18 21.35 26.65 97.88 39.30 -83.46 -35.80 15.22 0.07 84.71 1.02 1.59 12.18 84.63 0.48 0.03 0.02 0.04 24 S C H 49.53 8.42 17.94 26.91 104.66 27.56 -104.40 -1.49 55.61 0.77 43.62 20.67 10.40 22.87 44.42 0.97 0.02 0.31 0.35 25 E C S 93.74 13.91 16.57 29.89 95.67 -137.13 61.21 12.60 96.68 2.45 0.87 22.77 67.01 6.95 0.31 0.45 0.00 2.24 0.25 26 R C E 104.08 7.57 22.71 31.22 132.99 58.46 -137.97 147.40 50.04 48.95 1.01 38.45 6.89 3.48 0.22 0.72 0.00 49.55 0.68 27 I E E 12.69 23.94 14.91 38.86 125.78 -169.26 -128.52 134.87 24.70 75.13 0.18 23.52 0.83 0.13 0.07 0.08 0.00 74.33 1.04 28 E E E 99.02 7.02 25.70 33.45 118.02 -155.95 -108.31 129.15 14.48 85.44 0.08 13.77 0.73 0.08 0.05 0.03 0.00 84.41 0.94 29 T E E 14.78 21.08 14.15 34.87 139.30 158.47 -145.22 166.89 33.24 66.71 0.05 31.26 1.66 0.06 0.02 0.02 0.00 66.24 0.73 30 T C C 59.06 5.46 22.13 27.58 119.48 -98.64 -76.06 161.39 72.88 26.97 0.15 71.41 1.76 0.10 0.10 0.05 0.00 25.38 1.21 31 E H H 108.43 9.19 15.65 25.75 91.76 -106.99 -58.52 -38.84 2.70 0.01 97.29 0.38 0.41 1.67 97.03 0.50 0.00 0.00 0.00 32 A H H 65.06 2.20 21.75 22.76 91.45 52.61 -63.49 -40.97 1.91 0.00 98.08 0.18 0.16 1.38 97.75 0.51 0.00 0.00 0.00 33 R H H 66.00 13.30 19.00 32.30 92.27 47.60 -66.97 -39.09 0.91 0.00 99.09 0.15 0.07 0.58 98.61 0.59 0.00 0.00 0.00 34 A H H 5.70 22.55 14.55 37.26 91.24 53.41 -62.55 -42.19 0.29 0.00 99.71 0.04 0.02 0.15 99.62 0.16 0.00 0.00 0.00 35 K H H 120.08 3.52 24.10 27.66 91.48 51.02 -63.81 -40.41 0.46 0.00 99.54 0.03 0.02 0.34 99.43 0.18 0.00 0.00 0.00 36 E H H 87.98 5.71 23.77 29.63 91.75 49.73 -65.21 -41.37 1.61 0.00 98.39 0.05 0.04 1.43 98.24 0.24 0.00 0.00 0.00 37 V H H 3.09 25.51 17.45 43.11 92.08 48.95 -66.13 -40.87 2.45 0.00 97.55 0.15 0.12 1.92 97.63 0.17 0.00 0.00 0.00 38 R H H 86.40 16.17 21.49 36.06 91.26 54.86 -60.74 -42.68 0.63 0.00 99.37 0.12 0.04 0.28 99.48 0.08 0.00 0.00 0.00 39 S H H 61.88 2.46 26.11 27.25 91.57 50.56 -63.96 -40.70 0.45 0.00 99.55 0.05 0.02 0.27 99.58 0.08 0.00 0.00 0.00 40 V H H 24.12 15.05 21.86 37.02 92.06 49.19 -65.36 -42.31 0.18 0.00 99.82 0.01 0.01 0.10 99.83 0.04 0.00 0.00 0.00 41 V H H 2.44 26.51 18.31 45.23 91.24 50.75 -63.10 -43.41 0.06 0.00 99.94 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 42 E H H 85.64 9.14 24.53 33.79 91.14 51.67 -62.36 -41.55 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 43 K H H 103.97 4.57 26.61 31.40 91.60 50.14 -64.88 -40.99 0.10 0.00 99.90 0.00 0.00 0.07 99.90 0.01 0.00 0.00 0.00 44 L H H 5.30 23.81 20.84 44.31 91.59 49.88 -64.39 -43.16 0.16 0.00 99.84 0.01 0.00 0.14 99.82 0.03 0.00 0.00 0.00 45 I H H 16.68 21.31 21.97 42.30 91.48 49.42 -63.93 -42.15 0.55 0.00 99.45 0.04 0.03 0.46 99.21 0.25 0.00 0.00 0.00 46 T H H 69.23 3.80 26.99 30.50 91.42 50.20 -63.97 -42.42 1.96 0.01 98.03 0.14 0.14 1.62 97.26 0.83 0.01 0.00 0.00 47 L H H 36.07 10.88 22.22 34.11 91.66 50.03 -65.20 -40.22 2.47 0.00 97.53 0.21 0.19 1.85 95.52 2.22 0.00 0.00 0.00 48 G H H 3.10 23.86 14.73 38.69 91.48 54.12 -65.65 -36.66 7.87 0.02 92.10 0.94 0.60 5.94 88.58 3.91 0.01 0.01 0.01 49 K H H 105.25 9.72 20.52 30.53 92.19 54.75 -69.56 -29.89 19.83 0.05 80.12 1.34 1.65 16.61 77.11 3.20 0.03 0.02 0.04 50 K H H 137.95 2.24 21.82 23.31 98.14 50.37 -89.97 -6.42 35.85 0.17 63.98 4.84 6.91 24.32 61.47 2.21 0.05 0.05 0.14 51 G C C 31.73 15.74 12.50 27.01 108.98 -132.98 71.59 86.71 98.88 0.37 0.76 51.54 30.36 17.05 0.40 0.29 0.00 0.14 0.22 52 D C C 76.79 3.81 20.32 24.13 124.70 141.80 -104.84 162.06 98.52 0.89 0.59 86.20 11.65 0.41 0.49 0.10 0.00 0.19 0.96 53 L H H 97.82 8.22 15.37 24.72 92.27 -103.25 -60.05 -36.98 4.41 0.01 95.57 0.77 0.85 2.54 95.18 0.64 0.01 0.00 0.01 54 A H H 65.43 2.54 20.95 22.79 91.56 53.16 -64.17 -40.90 2.28 0.00 97.71 0.28 0.21 1.60 97.18 0.72 0.00 0.00 0.00 55 S H H 16.01 13.86 16.61 31.71 91.78 49.69 -64.97 -40.96 0.75 0.00 99.24 0.17 0.07 0.41 98.72 0.62 0.00 0.00 0.00 56 R H H 52.81 18.99 17.63 35.43 91.72 52.20 -62.78 -42.23 0.22 0.00 99.78 0.04 0.01 0.12 99.68 0.15 0.00 0.00 0.00 57 R H H 123.84 4.82 24.80 29.95 91.74 50.25 -64.08 -41.15 0.22 0.00 99.78 0.03 0.01 0.14 99.74 0.09 0.00 0.00 0.00 58 N H H 71.31 5.71 25.49 31.30 91.55 49.77 -64.59 -41.45 0.32 0.00 99.68 0.03 0.01 0.22 99.65 0.09 0.00 0.00 0.00 59 A H H 2.62 23.85 18.60 42.79 91.27 50.74 -63.38 -42.93 0.45 0.00 99.54 0.04 0.02 0.31 99.44 0.19 0.00 0.00 0.00 60 A H H 18.81 17.23 21.13 37.99 91.38 51.93 -62.68 -41.15 0.95 0.00 99.05 0.07 0.04 0.73 98.02 1.15 0.00 0.00 0.00 61 K H H 117.77 2.79 25.89 28.04 91.89 51.22 -64.32 -40.11 3.93 0.01 96.06 0.17 0.15 3.43 93.73 2.52 0.01 0.00 0.00 62 T H H 34.27 13.33 21.27 34.67 92.25 49.94 -66.60 -39.80 8.86 0.03 91.11 0.54 0.49 7.45 89.24 2.24 0.01 0.01 0.01 63 L H H 5.12 25.04 15.92 40.85 94.76 49.26 -75.39 -29.07 23.47 1.28 75.25 6.33 4.17 14.02 71.88 2.33 0.11 0.63 0.53 64 R C H 109.50 11.24 19.78 30.65 95.34 64.29 -68.74 -29.17 53.96 3.25 42.78 20.23 10.14 23.03 41.08 2.63 0.06 1.79 1.04 65 N C C 95.55 5.04 20.54 25.74 98.59 49.90 -81.50 2.63 70.91 4.01 25.09 39.59 9.98 20.01 23.03 3.62 0.01 2.93 0.82 66 V C C 35.92 16.81 12.46 28.87 107.43 109.38 -84.14 95.49 57.92 12.72 29.36 40.96 8.57 7.60 25.09 5.28 0.02 10.96 1.52 67 E C C 108.67 6.01 18.44 25.04 104.11 115.03 -84.50 12.23 42.98 29.74 27.28 31.05 5.49 5.74 23.14 5.07 0.06 27.03 2.41 68 I C E 66.50 11.29 13.16 25.16 105.14 88.73 -86.09 55.28 38.47 34.53 27.00 27.07 5.44 5.71 23.29 4.75 0.11 30.75 2.87 69 L C C 81.53 8.85 13.04 22.78 104.41 76.10 -87.04 -8.40 54.39 21.76 23.84 31.23 9.21 13.25 20.52 4.47 0.12 19.14 2.03 70 N C C 100.96 4.46 13.23 18.88 104.16 26.32 -85.84 45.16 81.34 4.12 14.54 37.16 15.99 28.35 10.85 3.83 0.01 2.90 0.91 71 E C C 124.65 4.66 11.71 17.88 101.31 107.79 -76.26 2.10 84.26 1.20 14.54 32.38 20.21 31.75 10.32 4.19 0.00 0.61 0.52 72 D C T 105.44 3.18 13.13 17.43 101.05 64.68 -81.33 0.76 74.72 2.11 23.16 27.06 20.30 27.57 17.80 5.28 0.03 1.21 0.75 73 E C C 105.60 6.49 13.05 20.71 103.18 91.92 -80.48 4.75 55.33 11.80 32.87 31.18 14.00 10.93 27.72 5.22 0.12 8.91 1.94 74 T C H 63.06 7.79 16.12 24.81 103.09 62.76 -80.91 -9.55 42.74 17.55 39.71 31.82 5.61 5.49 36.08 4.01 0.04 14.64 2.30 75 T H H 34.47 15.99 14.57 30.10 99.29 55.45 -73.55 -31.62 38.21 11.26 50.53 28.93 4.56 4.75 47.42 3.16 0.02 9.84 1.33 76 Q H H 83.13 10.01 18.77 28.88 95.05 67.73 -68.60 -35.00 34.33 4.98 60.69 24.95 4.53 4.74 58.71 2.36 0.01 4.03 0.68 77 T H H 71.15 4.32 23.05 26.84 94.34 51.73 -69.35 -38.92 29.66 2.20 68.14 22.69 3.16 3.87 66.86 1.61 0.00 1.39 0.41 78 A H H 13.75 16.35 19.11 35.81 92.79 53.41 -64.66 -42.20 6.85 0.26 92.88 4.80 0.83 1.60 91.79 0.78 0.00 0.15 0.05 79 L H H 10.60 22.76 18.56 40.77 92.07 50.86 -63.69 -42.03 1.57 0.04 98.39 0.79 0.19 0.61 97.93 0.44 0.00 0.03 0.01 80 Q H H 87.12 7.61 23.76 31.63 91.50 51.32 -63.66 -41.23 0.89 0.03 99.08 0.35 0.09 0.40 98.76 0.37 0.00 0.02 0.00 81 K H H 93.01 5.93 24.43 30.53 91.71 49.74 -64.77 -41.27 0.97 0.02 99.00 0.27 0.10 0.54 98.63 0.44 0.00 0.01 0.00 82 L H H 6.09 23.23 19.25 42.39 91.66 49.18 -63.89 -43.35 1.50 0.03 98.47 0.29 0.14 0.98 98.09 0.47 0.01 0.01 0.01 83 F H H 25.58 21.02 19.89 39.89 92.77 45.82 -67.04 -39.35 3.79 0.04 96.17 0.37 0.32 3.10 95.54 0.59 0.05 0.01 0.02 84 G H H 35.73 5.04 22.99 28.09 96.83 43.68 -75.41 -41.88 15.72 0.04 84.24 0.36 0.74 14.92 83.03 0.84 0.08 0.01 0.03 85 E H H 90.15 5.70 22.96 28.81 101.05 33.05 -87.81 -40.89 46.17 0.06 53.77 0.55 1.81 43.26 53.19 1.07 0.05 0.02 0.05 86 I H H 6.60 22.04 18.24 40.43 96.00 40.71 -73.90 -43.66 21.44 0.07 78.50 0.84 1.46 19.23 74.23 4.09 0.08 0.03 0.04 87 A H H 9.60 20.11 16.45 36.71 91.01 52.94 -61.75 -42.00 3.91 0.02 96.07 0.53 0.27 2.66 79.36 17.16 0.00 0.01 0.00 88 E H H 116.09 2.66 22.92 24.99 91.55 51.29 -64.39 -37.27 3.27 0.01 96.72 0.19 0.15 2.53 76.59 20.52 0.00 0.01 0.00 89 R H H 107.19 7.97 20.01 28.49 91.85 51.26 -68.69 -30.40 5.60 0.01 94.39 0.23 0.28 4.61 76.28 18.58 0.00 0.01 0.00 90 Y H H 15.37 21.59 12.39 34.18 99.42 39.89 -104.80 5.73 31.97 0.43 67.60 3.54 3.50 23.93 54.72 13.54 0.23 0.15 0.38 91 T C T 71.91 11.03 15.32 27.01 92.57 103.60 -62.42 -30.23 84.33 0.44 15.23 4.78 5.04 74.05 9.89 5.68 0.00 0.20 0.35 92 E C T 153.88 1.12 19.36 18.91 95.68 48.89 -88.72 2.62 88.92 0.36 10.72 3.69 8.39 77.13 3.81 6.59 0.00 0.22 0.17 93 R C C 76.14 15.46 10.47 25.50 117.93 105.98 -87.97 138.59 93.92 1.13 4.94 77.26 12.90 3.71 1.27 3.58 0.00 0.54 0.73 94 Q C C 135.89 2.52 19.43 22.44 111.68 -142.59 -86.98 128.13 93.78 4.39 1.83 40.79 22.15 31.11 0.38 1.45 0.00 2.15 1.98 95 G C S 27.51 9.22 18.67 28.53 129.17 17.21 122.87 -174.83 90.76 8.31 0.93 11.92 42.04 37.18 0.06 1.02 0.00 6.85 0.92 96 G C C 19.46 15.50 18.62 33.40 130.28 -84.74 134.40 -177.89 74.16 25.16 0.68 50.25 19.30 4.33 0.08 0.80 0.00 24.06 1.18 97 Y E E 62.98 15.01 22.63 37.12 132.07 -144.99 -130.83 152.68 25.39 74.53 0.08 20.90 4.34 0.28 0.02 0.07 0.00 73.46 0.92 98 T E E 22.89 21.17 18.24 38.81 125.77 -142.98 -122.40 138.76 3.68 96.31 0.01 3.27 0.23 0.01 0.00 0.00 0.00 96.42 0.07 99 R E E 81.46 11.47 24.45 35.98 127.88 -171.34 -127.62 141.81 0.72 99.28 0.00 0.64 0.02 0.00 0.00 0.00 0.00 99.32 0.01 100 I E E 43.46 18.64 17.85 35.92 119.39 -151.84 -109.86 127.97 0.49 99.51 0.00 0.45 0.01 0.00 0.00 0.00 0.00 99.53 0.01 101 L E E 47.50 12.05 20.03 32.90 124.51 -170.00 -119.21 137.37 0.42 99.57 0.00 0.38 0.01 0.00 0.00 0.00 0.00 99.59 0.01 102 K E E 103.75 9.69 19.22 29.50 114.31 -126.07 -87.60 128.70 1.89 98.10 0.01 1.69 0.08 0.01 0.00 0.00 0.00 98.16 0.06 103 Q E E 56.96 14.41 14.76 29.30 120.71 -171.24 -112.82 132.67 24.18 75.78 0.04 21.30 2.18 0.14 0.01 0.03 0.00 75.88 0.48 104 G E E 28.05 5.53 19.04 25.36 137.47 -73.15 139.22 -176.98 47.98 51.99 0.03 34.00 12.73 0.36 0.00 0.03 0.00 52.43 0.44 105 P C C 85.76 5.15 15.86 22.28 114.86 -54.23 -68.27 147.16 53.48 46.16 0.36 47.88 3.71 0.57 0.13 0.27 0.00 41.80 5.65 106 R C C 88.31 11.88 9.02 21.42 113.51 -114.97 -80.07 135.75 65.36 33.89 0.75 58.34 4.70 0.90 0.38 0.44 0.00 19.35 15.89 107 R C T 183.42 1.59 11.74 14.46 107.81 -110.29 -66.32 131.62 89.55 2.38 8.07 5.12 17.69 65.61 0.39 8.83 0.00 1.55 0.80 108 G C T 67.72 0.43 12.06 10.84 99.75 15.63 79.96 -7.39 89.46 0.63 9.92 2.04 13.05 72.62 0.35 11.28 0.00 0.35 0.31 109 D C T 94.25 3.90 9.95 15.19 101.60 55.22 -98.16 1.76 88.82 1.00 10.18 4.65 16.87 64.87 0.40 12.14 0.00 0.55 0.51 110 G C T 53.70 2.76 13.48 17.28 96.45 -120.47 79.04 7.18 95.50 2.73 1.78 31.49 31.59 32.42 0.18 1.87 0.00 1.65 0.81 111 A C C 34.81 9.37 12.16 23.45 120.25 133.76 -78.44 152.33 83.25 16.52 0.23 65.27 17.42 0.89 0.05 0.23 0.00 14.03 2.12 112 E E E 75.99 8.91 18.81 28.53 114.98 -105.35 -71.43 145.55 36.13 63.80 0.07 34.05 1.36 0.13 0.03 0.05 0.00 59.82 4.56 113 S E E 18.21 16.95 18.03 35.08 131.21 -159.50 -123.09 154.72 20.72 79.26 0.02 18.15 2.16 0.08 0.00 0.02 0.00 79.21 0.38 114 V E E 11.07 20.32 19.31 40.01 124.77 -144.72 -119.05 138.19 1.60 98.39 0.00 1.55 0.06 0.00 0.00 0.00 0.00 98.35 0.04 115 I E E 34.89 12.74 24.74 38.29 116.31 -143.71 -101.07 126.37 0.38 99.62 0.00 0.36 0.01 0.00 0.00 0.00 0.00 99.62 0.00 116 I E E 7.32 24.03 18.30 42.66 120.51 -165.23 -111.31 130.82 0.24 99.76 0.00 0.23 0.00 0.00 0.00 0.00 0.00 99.76 0.00 117 E E E 62.82 10.14 25.01 35.48 121.53 -164.00 -113.04 133.26 0.28 99.72 0.00 0.28 0.00 0.00 0.00 0.00 0.00 99.71 0.01 118 L E E 25.95 19.99 16.61 36.45 114.77 -136.10 -87.46 128.99 3.46 96.53 0.00 3.58 0.04 0.00 0.00 0.00 0.00 96.19 0.18 119 V C C 39.80 13.26 20.41 34.06 115.94 -161.19 -103.35 127.31 96.33 3.67 0.00 96.48 0.05 0.00 0.00 0.00 0.00 3.44 0.03