# 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 G C C 41.61 6.28 13.74 21.19 113.80 -116.76 77.26 168.66 99.93 0.03 0.04 99.75 0.11 0.10 0.02 0.00 0.00 0.01 0.01 1 T C C 97.13 3.58 11.31 16.31 107.90 -112.84 -90.15 54.54 79.01 0.51 20.48 69.91 1.48 7.04 19.33 1.72 0.00 0.21 0.31 2 G C H 47.21 3.29 11.76 16.21 106.44 52.39 -49.53 -74.14 58.88 0.70 40.42 33.77 11.42 13.85 36.35 3.94 0.01 0.27 0.39 3 M H H 113.61 4.56 11.43 17.23 98.15 36.50 -73.50 -29.29 38.41 0.66 60.93 23.45 7.46 9.28 54.43 4.76 0.01 0.29 0.31 4 E H H 99.25 6.54 13.05 20.74 97.57 61.11 -71.12 -34.27 25.89 0.52 73.59 16.50 4.91 6.12 67.91 4.10 0.01 0.25 0.20 5 S H H 52.05 6.88 14.04 22.17 98.25 56.41 -71.17 -33.59 22.96 0.43 76.61 15.41 3.91 5.06 72.10 3.15 0.01 0.20 0.16 6 K H H 115.41 4.45 17.03 22.19 94.16 56.52 -67.21 -37.55 16.54 0.31 83.15 10.02 2.84 4.59 80.11 2.17 0.01 0.15 0.11 7 Y H H 80.38 10.77 17.07 28.45 93.38 52.71 -66.48 -40.58 10.54 0.21 89.24 6.11 1.94 3.19 87.12 1.46 0.01 0.09 0.08 8 K H H 63.90 14.80 18.32 32.59 92.14 52.47 -64.23 -41.57 5.91 0.13 93.97 3.35 0.92 1.97 92.62 1.04 0.00 0.06 0.04 9 E H H 70.97 12.03 20.13 32.05 92.03 51.22 -64.83 -41.63 4.30 0.10 95.60 2.04 0.62 1.82 94.38 1.05 0.00 0.06 0.03 10 I H H 58.74 9.60 21.95 31.95 92.39 49.03 -65.76 -42.30 3.43 0.08 96.50 1.22 0.52 1.83 95.21 1.15 0.01 0.04 0.02 11 L H H 31.27 15.39 21.24 36.54 92.29 49.11 -65.34 -43.05 3.87 0.06 96.08 0.89 0.48 2.61 94.23 1.72 0.01 0.03 0.02 12 L H H 16.55 21.41 20.40 41.04 92.65 48.19 -66.21 -41.61 6.80 0.06 93.15 0.78 0.59 5.67 90.10 2.76 0.04 0.03 0.02 13 L H H 43.04 15.00 21.32 35.82 93.16 48.07 -67.51 -37.80 9.70 0.07 90.23 1.07 0.96 7.81 85.71 4.32 0.06 0.03 0.04 14 T H H 61.67 7.49 23.66 31.30 92.97 49.38 -68.36 -37.36 15.93 0.08 83.99 1.35 1.36 13.05 76.37 7.71 0.07 0.04 0.05 15 G H H 11.10 17.06 19.25 36.16 93.43 54.44 -69.08 -33.07 32.85 0.14 67.00 2.42 2.68 26.86 56.49 11.31 0.07 0.06 0.11 16 L H H 11.00 23.16 15.71 38.76 93.91 53.90 -81.80 -11.29 44.97 0.47 54.56 9.89 5.28 28.42 31.17 24.58 0.06 0.22 0.39 17 D C T 82.04 8.83 18.75 28.49 92.53 83.07 -64.31 -23.17 71.89 0.33 27.77 6.43 5.92 58.62 13.99 14.57 0.01 0.16 0.31 18 N C T 111.68 3.16 20.72 24.04 95.68 50.48 -93.15 3.82 83.04 0.16 16.79 8.93 7.25 66.84 4.91 11.85 0.00 0.08 0.13 19 I C C 17.39 22.58 8.47 29.73 118.28 112.82 -82.57 139.24 99.04 0.58 0.38 78.39 20.12 0.33 0.24 0.10 0.00 0.13 0.69 20 T C C 69.34 2.59 21.16 22.65 123.46 -135.85 -86.09 165.38 99.14 0.49 0.37 98.74 0.40 0.09 0.28 0.03 0.00 0.10 0.36 21 D H H 93.73 7.38 13.89 22.88 91.17 -103.18 -57.90 -38.89 1.88 0.00 98.12 0.26 0.22 1.18 97.13 1.21 0.00 0.00 0.00 22 E H H 123.18 1.61 18.92 19.43 91.65 52.21 -64.12 -40.67 0.96 0.00 99.04 0.09 0.07 0.70 97.91 1.23 0.00 0.00 0.00 23 E H H 52.15 11.92 17.07 29.83 91.97 49.04 -65.57 -40.63 0.45 0.00 99.55 0.06 0.03 0.30 98.12 1.49 0.00 0.00 0.00 24 L H H 9.42 21.64 14.05 35.86 91.28 50.81 -62.94 -42.10 0.37 0.00 99.63 0.04 0.02 0.26 98.48 1.21 0.00 0.00 0.00 25 D H H 77.18 4.90 21.61 26.89 91.43 51.37 -63.95 -39.78 2.50 0.00 97.50 0.08 0.06 2.30 94.43 3.13 0.00 0.00 0.00 26 R H H 105.33 5.67 22.07 27.94 91.75 50.89 -65.05 -41.04 8.86 0.01 91.14 0.15 0.23 8.58 86.38 4.64 0.01 0.00 0.00 27 F H H 9.28 22.61 17.35 39.97 92.39 49.69 -66.42 -40.06 10.44 0.04 89.53 0.92 0.71 7.90 78.48 11.94 0.02 0.02 0.02 28 K H H 58.72 17.41 18.84 35.13 91.56 56.80 -61.16 -39.19 5.12 0.03 94.85 0.43 0.29 3.83 56.02 39.40 0.00 0.02 0.00 29 F H H 116.20 4.06 22.87 26.79 91.97 53.31 -66.78 -29.70 10.72 0.03 89.26 0.44 0.49 9.10 45.32 44.61 0.01 0.02 0.01 30 F H H 63.84 11.31 19.62 31.52 94.79 50.43 -82.13 -21.97 17.15 0.09 82.76 1.14 1.32 13.05 42.41 41.96 0.03 0.05 0.05 31 L C C 9.75 23.04 13.13 35.82 95.87 68.83 -71.52 -28.77 56.50 2.81 40.69 30.03 17.90 11.07 28.62 9.30 0.09 0.94 2.04 32 S C C 42.71 11.22 15.62 27.44 95.29 75.11 -66.37 -32.98 59.50 2.37 38.13 34.32 7.49 18.53 26.15 10.92 0.03 1.13 1.42 33 D C T 114.65 1.92 17.32 19.19 94.90 47.27 -75.42 -23.18 59.89 0.95 39.16 13.98 12.22 33.65 24.10 14.86 0.07 0.43 0.68 34 E C T 104.97 6.71 15.78 23.32 97.84 51.61 -82.86 -25.47 60.75 0.94 38.32 15.93 13.19 32.02 23.69 14.00 0.06 0.42 0.68 35 F C C 51.98 16.78 11.54 27.41 104.39 46.73 -96.93 26.74 73.82 1.32 24.86 28.96 22.40 23.80 15.04 8.29 0.03 0.50 0.99 36 N C C 127.38 1.91 19.94 21.43 97.74 -129.72 16.88 44.38 93.12 0.91 5.96 50.90 16.13 26.44 3.14 2.45 0.00 0.46 0.49 37 I C C 22.32 19.41 9.45 28.27 119.72 142.50 -101.36 136.99 92.03 3.16 4.81 71.71 17.54 2.21 3.99 1.06 0.00 1.21 2.28 38 A C C 56.78 2.97 20.58 22.80 115.57 -113.81 -69.18 149.00 93.70 1.30 5.01 91.14 1.54 1.37 4.10 0.62 0.00 0.58 0.65 39 T H H 72.16 12.56 12.24 24.80 92.87 -116.23 -58.94 -37.27 22.40 0.41 77.20 5.28 3.51 13.04 56.86 20.76 0.12 0.21 0.21 40 G H H 48.45 1.98 17.97 19.41 92.10 55.59 -63.94 -34.37 20.52 0.15 79.33 2.20 2.12 14.39 58.93 22.13 0.08 0.08 0.09 41 K H H 95.70 6.86 17.61 25.28 92.98 52.82 -73.17 -27.54 15.16 0.21 84.63 3.23 1.99 8.73 61.98 23.81 0.05 0.12 0.09 42 L H H 8.73 24.04 10.51 33.74 92.14 60.35 -66.46 -33.75 18.11 0.46 81.43 5.21 2.92 9.35 60.82 21.20 0.07 0.24 0.21 43 H H H 111.09 8.09 17.54 26.38 92.22 62.41 -68.50 -23.34 44.50 0.28 55.22 2.89 3.07 37.31 41.85 14.47 0.08 0.15 0.19 44 T C T 109.17 1.16 19.96 19.31 96.76 44.02 -94.19 -4.59 60.19 0.17 39.64 3.02 4.19 52.17 28.54 11.81 0.03 0.09 0.15 45 A C S 21.04 17.33 9.70 26.75 120.76 101.33 -79.96 152.67 98.29 0.67 1.04 40.34 57.26 0.65 0.86 0.15 0.00 0.15 0.60 46 N C C 80.60 3.93 23.18 26.40 120.06 -113.89 -79.56 161.75 97.55 1.99 0.46 96.60 0.78 0.10 0.40 0.03 0.00 0.33 1.75 47 R H H 75.53 18.57 15.55 33.07 91.72 -105.20 -59.25 -38.95 0.84 0.00 99.15 0.11 0.10 0.50 99.17 0.12 0.00 0.00 0.00 48 I H H 68.22 11.93 20.86 32.60 92.14 52.23 -64.69 -40.76 0.33 0.00 99.67 0.03 0.02 0.23 99.62 0.10 0.00 0.00 0.00 49 Q H H 87.47 5.45 24.86 30.36 91.90 48.78 -65.62 -40.60 0.16 0.00 99.84 0.02 0.01 0.10 99.76 0.12 0.00 0.00 0.00 50 V H H 7.10 20.96 20.18 41.25 91.58 49.24 -63.76 -43.74 0.08 0.00 99.92 0.01 0.00 0.04 99.91 0.03 0.00 0.00 0.00 51 A H H 4.95 22.25 20.35 42.61 90.90 51.15 -62.62 -43.77 0.06 0.00 99.94 0.01 0.00 0.04 99.92 0.03 0.00 0.00 0.00 52 T H H 57.96 6.69 25.85 33.04 91.62 49.80 -64.43 -41.78 0.18 0.00 99.82 0.01 0.00 0.15 99.78 0.06 0.00 0.00 0.00 53 L H H 38.58 10.02 24.07 34.96 91.74 49.75 -64.49 -42.36 0.39 0.00 99.61 0.02 0.01 0.33 99.54 0.10 0.00 0.00 0.00 54 M H H 5.83 23.30 17.73 41.24 91.79 50.44 -63.81 -42.93 1.14 0.00 98.86 0.18 0.13 0.75 98.77 0.16 0.00 0.00 0.00 55 I H H 42.78 15.82 18.06 33.53 92.00 48.56 -64.64 -41.13 1.61 0.01 98.37 0.38 0.23 0.88 98.32 0.17 0.00 0.00 0.01 56 Q H H 130.14 2.00 21.37 22.91 93.04 47.36 -68.10 -38.86 2.17 0.01 97.83 0.19 0.19 1.67 97.73 0.22 0.00 0.00 0.00 57 N H H 78.88 8.08 18.59 27.22 99.05 36.80 -84.97 -37.71 5.19 0.01 94.80 0.16 0.42 4.59 94.57 0.24 0.01 0.00 0.01 58 A H H 31.75 13.95 14.92 29.21 102.14 22.51 -106.37 -14.06 15.11 0.10 84.79 1.02 4.48 9.70 84.36 0.28 0.05 0.02 0.08 59 G C C 23.75 4.86 21.59 27.56 126.11 -114.81 91.78 168.34 87.11 0.32 12.57 79.51 3.60 2.44 13.59 0.54 0.00 0.09 0.22 60 A H H 31.57 19.02 15.62 33.61 92.45 -80.67 -60.36 -39.86 3.41 0.01 96.58 0.61 0.65 2.00 96.08 0.64 0.00 0.00 0.00 61 V H H 77.25 8.48 22.85 31.52 92.01 50.96 -63.84 -40.84 1.82 0.00 98.18 0.20 0.16 1.33 97.64 0.67 0.00 0.00 0.00 62 S H H 37.23 7.11 23.77 31.50 91.88 49.48 -66.00 -40.05 1.19 0.00 98.81 0.16 0.09 0.82 98.09 0.83 0.00 0.00 0.00 63 A H H 3.72 21.83 18.78 41.02 91.86 51.26 -63.30 -43.51 0.34 0.00 99.65 0.06 0.02 0.17 99.65 0.10 0.00 0.00 0.00 64 V H H 11.79 21.25 22.09 42.60 91.68 49.87 -64.20 -42.91 0.16 0.00 99.84 0.02 0.01 0.09 99.86 0.03 0.00 0.00 0.00 65 M H H 83.58 7.13 26.81 34.39 91.60 50.27 -63.74 -42.44 0.08 0.00 99.92 0.00 0.00 0.05 99.93 0.01 0.00 0.00 0.00 66 K H H 51.71 12.68 25.08 37.72 91.81 48.98 -64.82 -42.27 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 67 T H H 3.27 24.93 21.79 46.40 91.58 49.87 -63.89 -43.12 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 68 I H H 22.06 17.66 22.42 39.78 91.35 50.21 -63.80 -42.50 0.06 0.00 99.94 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 69 R H H 114.83 4.34 26.56 30.83 91.64 50.41 -64.31 -41.82 0.12 0.00 99.88 0.01 0.00 0.09 99.83 0.07 0.00 0.00 0.00 70 I H H 14.28 16.53 20.69 37.90 91.61 49.64 -63.89 -43.62 0.22 0.00 99.78 0.01 0.01 0.18 99.57 0.24 0.00 0.00 0.00 71 F H H 8.80 21.93 16.66 38.84 91.85 49.56 -64.41 -41.54 0.75 0.00 99.25 0.05 0.03 0.59 98.76 0.57 0.00 0.00 0.00 72 Q H H 84.99 8.03 18.73 27.51 91.77 52.47 -64.23 -39.92 5.31 0.00 94.68 0.29 0.22 4.69 94.14 0.65 0.00 0.00 0.00 73 K H H 121.49 4.42 19.00 24.20 90.89 55.17 -66.02 -30.33 16.80 0.02 83.18 0.42 0.77 16.21 81.87 0.69 0.02 0.00 0.01 74 L C T 38.67 14.61 13.39 28.77 95.45 51.21 -90.38 3.72 91.88 0.03 8.08 0.78 5.55 85.11 7.79 0.72 0.00 0.01 0.04 75 N C T 126.20 1.98 19.51 21.45 93.87 -115.74 62.23 33.53 98.74 0.01 1.25 1.58 4.02 93.35 0.80 0.22 0.00 0.01 0.01 76 Y C C 47.56 15.28 12.18 28.17 103.67 127.75 -108.13 48.08 97.79 0.38 1.82 95.30 1.24 1.56 1.20 0.29 0.00 0.10 0.31 77 M H H 87.33 9.13 15.69 26.22 94.43 146.23 -63.25 -38.74 4.13 0.01 95.86 2.26 0.49 1.28 95.34 0.63 0.00 0.00 0.00 78 L H H 101.87 2.14 22.59 23.45 91.82 53.16 -64.07 -40.77 1.10 0.00 98.90 0.16 0.08 0.72 98.21 0.83 0.00 0.00 0.00 79 L H H 26.92 13.71 18.80 33.36 92.13 49.76 -65.06 -41.53 0.43 0.00 99.57 0.06 0.02 0.27 98.91 0.73 0.00 0.00 0.00 80 A H H 7.01 19.45 15.26 35.39 91.27 51.81 -62.22 -42.67 0.19 0.00 99.81 0.03 0.01 0.11 99.57 0.28 0.00 0.00 0.00 81 K H H 114.92 2.74 23.98 25.95 91.24 50.53 -63.75 -41.20 0.34 0.00 99.66 0.03 0.01 0.24 99.56 0.16 0.00 0.00 0.00 82 R H H 111.40 4.14 22.72 26.71 91.55 49.78 -64.51 -41.85 0.57 0.00 99.43 0.05 0.02 0.41 99.38 0.13 0.00 0.00 0.00 83 L H H 9.76 20.25 15.81 36.53 91.62 50.12 -63.92 -42.24 0.59 0.00 99.41 0.12 0.04 0.34 99.34 0.16 0.00 0.00 0.00 84 Q H H 74.10 9.57 20.04 30.01 91.60 51.45 -62.99 -41.28 0.60 0.00 99.40 0.13 0.04 0.32 99.37 0.14 0.00 0.00 0.00 85 E H H 106.28 1.76 22.40 22.00 91.68 49.36 -64.24 -41.78 0.73 0.00 99.27 0.13 0.05 0.41 99.28 0.13 0.00 0.00 0.00 86 E H H 66.20 8.34 18.57 28.02 92.02 49.29 -65.07 -41.10 0.85 0.00 99.15 0.14 0.06 0.48 99.16 0.15 0.00 0.00 0.00 87 K H H 59.51 14.15 15.63 29.86 91.99 51.06 -63.90 -40.74 1.46 0.00 98.54 0.26 0.12 0.87 98.50 0.25 0.00 0.00 0.00 88 E H H 102.97 2.60 19.70 21.82 91.77 50.75 -64.67 -40.83 2.71 0.01 97.28 0.58 0.25 1.58 97.22 0.36 0.00 0.00 0.00 89 K H H 108.69 2.32 19.30 20.80 92.04 49.83 -65.18 -40.73 4.63 0.02 95.35 1.24 0.54 2.52 95.11 0.56 0.00 0.01 0.01 90 V H H 31.13 10.64 14.40 26.84 92.61 49.40 -65.45 -41.26 6.58 0.05 93.36 2.28 0.89 3.15 92.78 0.86 0.00 0.02 0.02 91 D H H 65.54 6.88 15.56 23.68 92.37 51.47 -64.70 -39.96 8.63 0.07 91.29 3.44 1.11 3.94 90.14 1.30 0.01 0.04 0.03 92 K H H 129.95 1.64 16.96 17.77 92.76 50.69 -66.05 -39.27 11.70 0.10 88.20 3.48 1.70 6.57 85.98 2.15 0.02 0.05 0.04 93 Q H H 102.65 3.06 15.78 19.29 93.24 49.24 -68.15 -37.81 16.21 0.13 83.66 4.30 2.44 9.46 81.32 2.32 0.02 0.06 0.06 94 Y H H 88.81 8.95 12.06 22.20 95.38 47.46 -72.80 -32.92 27.57 0.34 72.10 10.84 5.31 12.07 68.97 2.48 0.02 0.14 0.17 95 K H H 124.54 3.55 13.49 18.27 95.24 59.99 -68.33 -32.19 40.66 0.54 58.80 20.73 6.26 14.34 54.93 3.22 0.01 0.24 0.27 96 S C H 73.73 2.63 12.69 16.12 97.06 56.44 -75.13 -23.21 52.46 0.76 46.77 27.09 9.00 17.19 41.54 4.44 0.02 0.32 0.41 97 V C C 90.19 4.93 11.12 17.49 99.65 55.52 -84.21 -13.05 62.38 1.06 36.57 32.66 14.67 15.35 32.38 3.92 0.02 0.40 0.61 98 T C C 83.02 5.49 10.50 17.46 104.70 66.97 -87.45 27.56 75.94 1.04 23.02 42.55 19.59 13.52 20.15 3.12 0.00 0.37 0.70 99 K C C 135.19 3.13 11.74 16.48 113.21 110.37 -81.69 134.13 93.61 0.57 5.82 68.09 22.37 2.74 5.26 0.93 0.00 0.19 0.42 100 P C C 93.47 4.37 10.63 16.89 109.75 -107.16 -70.11 143.27 93.83 0.56 5.61 85.09 5.93 2.72 4.60 1.04 0.00 0.21 0.42 101 K C C 127.10 4.51 10.83 17.09 114.43 -122.73 -87.02 135.43 94.20 0.53 5.27 85.38 7.10 1.47 4.79 0.70 0.00 0.18 0.39 102 P C C 83.89 4.65 11.42 17.73 110.66 -107.06 -68.65 147.41 87.39 0.75 11.86 82.28 2.91 2.95 8.96 2.10 0.00 0.29 0.52 103 L C C 103.61 5.22 10.75 17.52 102.38 -120.86 -74.98 -27.55 69.96 0.84 29.20 50.98 9.31 9.94 21.70 7.15 0.00 0.37 0.56 104 S C C 65.99 4.02 11.76 17.09 104.66 56.08 -81.46 17.76 67.43 0.95 31.62 45.56 10.40 11.84 22.93 8.24 0.00 0.42 0.62 105 Q C H 105.33 5.84 10.79 18.14 96.32 67.34 -69.92 -28.33 51.00 0.97 48.04 33.11 9.66 9.31 35.28 11.66 0.01 0.43 0.53 106 A C H 72.47 3.87 11.86 17.24 96.10 62.99 -70.09 -28.58 50.43 1.16 48.41 28.14 10.76 12.44 35.21 12.29 0.02 0.56 0.58 107 E C C 127.86 3.19 13.07 17.40 98.27 56.49 -81.89 -11.03 54.56 1.97 43.47 31.92 11.16 12.64 31.31 11.02 0.03 0.97 0.94 108 M C C 94.88 7.82 11.17 20.21 107.20 76.85 -86.55 82.09 65.12 2.47 32.41 39.80 17.25 9.08 26.33 5.03 0.02 0.86 1.62 109 S C C 53.66 6.30 12.19 20.15 113.51 -132.92 -88.98 130.22 84.57 0.64 14.79 67.38 13.04 3.22 14.24 1.47 0.00 0.22 0.43 110 P C H 84.84 5.58 12.74 19.84 96.20 -128.57 -64.52 -30.41 54.43 0.58 44.98 33.12 7.56 14.08 39.89 4.77 0.00 0.26 0.32 111 A H H 70.24 3.78 13.90 18.80 95.92 56.98 -70.75 -29.04 43.26 0.76 55.98 23.53 8.21 12.96 49.00 5.54 0.02 0.34 0.40 112 A H H 56.21 5.72 13.46 20.58 96.29 57.63 -70.15 -36.51 33.09 0.83 66.07 20.71 7.15 6.90 58.67 5.84 0.01 0.39 0.33 113 S H H 53.98 6.47 12.98 20.75 97.36 54.44 -71.53 -34.41 32.91 1.12 65.97 22.76 5.25 6.61 58.92 5.46 0.01 0.60 0.40 114 A H H 60.03 4.60 13.32 19.31 95.56 57.16 -68.86 -35.31 30.14 1.29 68.57 19.94 5.88 6.52 61.05 5.46 0.02 0.70 0.42 115 A H H 61.02 4.28 12.43 18.23 96.02 56.32 -70.93 -33.06 34.67 1.92 63.41 23.88 5.79 6.92 56.51 5.19 0.02 1.10 0.59 116 I H H 97.75 5.14 10.89 17.57 98.66 56.80 -76.46 -26.45 41.58 2.78 55.64 27.41 6.80 9.29 48.83 5.13 0.03 1.54 0.98 117 R C H 154.26 3.24 10.63 15.39 100.15 64.76 -77.47 -18.82 54.46 2.29 43.25 29.40 9.61 16.45 37.89 4.51 0.03 1.14 0.96 118 N C C 113.66 2.71 9.56 13.81 102.77 61.40 -87.63 15.69 76.79 1.14 22.06 52.29 3.04 20.84 19.84 2.77 0.00 0.56 0.66 119 D C C 106.08 3.24 10.98 15.85 103.36 77.91 -83.16 22.49 99.91 0.03 0.05 99.70 0.12 0.12 0.03 0.00 0.00 0.01 0.01