# 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 98.65 8.64 13.43 22.82 114.10 -156.56 -94.70 128.50 99.74 0.23 0.03 99.54 0.21 0.08 0.01 0.00 0.00 0.11 0.04 1 A C C 72.04 5.80 11.71 18.82 109.49 -134.32 -77.66 129.98 92.68 2.88 4.44 78.53 2.01 12.92 1.80 1.77 0.00 1.81 1.16 2 G C C 51.86 4.06 10.91 16.39 110.23 8.36 56.05 33.54 89.47 4.34 6.19 47.59 18.60 23.82 1.86 3.98 0.00 2.28 1.85 3 R C C 151.44 4.10 10.28 16.00 108.93 101.06 -89.44 103.94 83.27 5.39 11.34 46.43 21.25 15.95 4.16 6.87 0.01 2.58 2.76 4 S C C 79.80 3.56 10.87 15.97 109.67 -145.07 -89.71 117.60 83.73 3.40 12.87 35.09 23.89 25.85 4.96 6.95 0.01 1.59 1.67 5 G C S 47.25 4.65 11.87 17.78 109.46 44.49 38.64 -36.13 81.56 1.77 16.67 28.97 29.40 24.23 8.75 6.79 0.01 0.73 1.11 6 D C C 97.61 3.84 12.54 17.56 104.25 72.91 -83.28 17.22 64.06 1.53 34.41 36.18 16.80 12.12 26.85 6.52 0.02 0.62 0.90 7 S H H 59.01 5.76 13.30 20.28 103.93 78.65 -78.66 -11.61 48.07 0.94 50.99 27.67 10.54 11.39 44.02 5.46 0.02 0.41 0.49 8 D H H 76.61 9.22 13.62 23.31 96.04 62.57 -69.01 -31.66 29.13 0.42 70.45 16.57 6.03 8.15 65.25 3.61 0.01 0.18 0.20 9 E H H 112.54 3.52 16.81 20.92 94.01 57.79 -66.57 -38.02 11.92 0.15 87.94 6.10 2.23 4.31 85.19 2.03 0.01 0.07 0.06 10 D H H 73.45 5.36 18.14 24.12 93.58 52.35 -66.63 -39.08 6.20 0.07 93.73 3.22 1.02 2.43 92.05 1.22 0.00 0.03 0.03 11 L H H 36.91 15.04 15.77 31.15 92.49 52.68 -64.83 -41.74 2.69 0.03 97.28 1.34 0.35 1.09 96.59 0.61 0.00 0.01 0.01 12 L H H 59.44 9.86 19.44 29.83 91.85 51.27 -63.95 -41.46 0.89 0.01 99.10 0.38 0.09 0.38 98.93 0.21 0.00 0.00 0.00 13 K H H 108.49 3.56 23.03 26.20 91.90 50.48 -64.58 -41.34 0.44 0.00 99.56 0.13 0.04 0.21 99.53 0.08 0.00 0.00 0.00 14 A H H 23.15 12.09 19.63 32.74 91.93 51.11 -64.12 -42.50 0.25 0.00 99.75 0.05 0.02 0.14 99.76 0.04 0.00 0.00 0.00 15 V H H 27.53 15.71 19.26 35.23 92.01 50.13 -63.74 -42.32 0.09 0.00 99.91 0.01 0.00 0.05 99.92 0.01 0.00 0.00 0.00 16 R H H 112.27 5.89 22.53 28.71 91.63 51.28 -63.62 -41.53 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 17 L H H 65.23 7.12 21.46 28.95 91.77 50.71 -64.18 -42.38 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 18 I H H 29.06 16.05 18.36 34.76 91.97 50.25 -64.59 -42.00 0.06 0.00 99.94 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 19 K H H 82.30 10.41 19.52 30.08 91.55 51.38 -63.26 -41.10 0.13 0.00 99.87 0.01 0.01 0.10 99.86 0.02 0.00 0.00 0.00 20 F H H 104.05 3.69 20.31 23.81 91.99 50.22 -64.68 -41.77 0.35 0.00 99.65 0.02 0.02 0.30 99.58 0.08 0.00 0.00 0.00 21 L H H 52.66 10.25 16.90 27.97 92.40 50.02 -65.81 -40.69 1.03 0.00 98.97 0.07 0.06 0.85 98.73 0.28 0.00 0.00 0.00 22 Y H H 66.57 14.12 14.35 28.55 92.94 49.10 -68.15 -34.61 5.72 0.02 94.25 0.53 0.46 4.63 93.33 1.01 0.01 0.01 0.01 23 Q H H 118.28 3.56 16.34 20.74 93.72 55.53 -72.74 -26.81 21.10 0.09 78.81 2.09 2.16 16.76 77.47 1.39 0.04 0.03 0.06 24 S H H 76.26 2.94 14.84 18.35 99.26 52.02 -85.53 -8.88 46.77 0.46 52.76 9.91 11.90 25.94 49.98 1.72 0.07 0.13 0.35 25 N C C 76.83 9.76 10.61 21.15 111.89 92.05 -99.63 109.68 98.83 0.62 0.55 51.49 46.22 1.17 0.34 0.15 0.00 0.17 0.46 26 P C C 78.65 5.10 13.54 20.28 116.81 -130.79 -70.56 150.07 99.51 0.37 0.13 88.90 10.09 0.50 0.05 0.06 0.00 0.13 0.27 27 P C C 83.81 6.29 12.56 20.62 115.37 -101.88 -68.94 148.19 99.63 0.27 0.10 94.01 5.20 0.44 0.03 0.05 0.00 0.10 0.17 28 P C C 71.33 8.91 10.20 20.32 113.36 -103.38 -67.48 149.88 98.99 0.70 0.31 92.16 5.91 0.79 0.11 0.15 0.00 0.22 0.66 29 N C C 109.19 3.15 12.68 17.15 114.24 -111.39 -85.85 136.38 98.85 0.70 0.45 90.79 7.07 0.87 0.19 0.20 0.00 0.23 0.65 30 P C C 105.22 3.37 9.94 15.22 97.04 -120.93 -66.44 -18.60 89.44 0.55 10.01 35.93 20.49 33.57 3.62 5.79 0.00 0.25 0.36 31 E C T 150.56 1.33 11.60 13.32 103.69 71.67 -85.69 16.49 85.60 1.24 13.15 31.06 19.77 35.63 5.67 6.54 0.00 0.54 0.79 32 G C C 33.56 6.36 9.36 17.21 125.85 89.55 -120.84 -177.77 85.26 3.00 11.74 43.63 33.68 8.57 5.78 5.13 0.01 1.07 2.12 33 T C C 77.49 2.17 13.94 16.13 119.13 -77.02 -82.08 164.55 83.44 3.66 12.90 68.40 11.62 2.57 12.23 1.54 0.00 1.19 2.44 34 R H H 164.51 2.37 11.30 15.04 92.15 -101.79 -60.06 -38.08 5.10 0.05 94.86 1.97 1.25 2.03 93.87 0.85 0.00 0.02 0.02 35 Q H H 125.35 1.17 14.07 14.60 92.10 52.45 -65.01 -39.81 2.45 0.02 97.53 0.69 0.35 1.30 96.82 0.83 0.00 0.01 0.01 36 A H H 44.63 3.93 12.84 18.54 91.98 50.28 -64.91 -40.61 1.43 0.02 98.56 0.48 0.17 0.70 97.92 0.72 0.00 0.01 0.00 37 R H H 99.43 5.60 13.15 20.28 92.39 50.81 -64.73 -41.14 0.97 0.01 99.03 0.31 0.11 0.45 98.79 0.33 0.00 0.00 0.00 38 R H H 126.87 2.13 15.79 17.79 91.88 50.03 -64.86 -40.97 0.89 0.00 99.10 0.22 0.09 0.46 99.05 0.18 0.00 0.00 0.00 39 N H H 85.49 1.88 16.25 17.58 91.96 49.42 -64.98 -40.94 1.10 0.00 98.89 0.24 0.10 0.62 98.87 0.17 0.00 0.00 0.00 40 R H H 110.60 4.48 15.11 20.63 92.26 50.44 -65.01 -40.88 0.92 0.00 99.07 0.17 0.08 0.52 99.08 0.14 0.00 0.00 0.00 41 R H H 114.57 4.41 15.44 20.71 92.08 50.36 -64.88 -40.55 0.73 0.00 99.26 0.15 0.06 0.39 99.28 0.11 0.00 0.00 0.00 42 R H H 133.01 1.71 17.02 17.86 91.82 50.36 -64.71 -40.80 0.65 0.00 99.35 0.11 0.05 0.37 99.35 0.12 0.00 0.00 0.00 43 R H H 126.46 2.33 16.77 18.92 92.10 49.99 -65.17 -41.00 0.78 0.00 99.22 0.11 0.05 0.49 99.20 0.15 0.00 0.00 0.00 44 W H H 101.97 6.40 14.63 22.31 92.36 50.25 -64.92 -41.22 0.80 0.00 99.20 0.13 0.05 0.48 99.17 0.17 0.00 0.00 0.00 45 R H H 123.86 2.96 16.96 20.20 92.06 50.98 -64.32 -41.16 0.55 0.00 99.45 0.09 0.04 0.30 99.48 0.08 0.00 0.00 0.00 46 E H H 102.79 1.91 17.95 18.94 91.78 50.08 -64.27 -41.43 0.38 0.00 99.62 0.06 0.02 0.21 99.65 0.06 0.00 0.00 0.00 47 R H H 105.67 5.66 16.79 23.27 92.14 49.63 -64.94 -40.79 0.37 0.00 99.63 0.05 0.02 0.21 99.66 0.05 0.00 0.00 0.00 48 Q H H 71.96 8.27 16.00 25.26 91.90 51.36 -64.35 -40.41 0.28 0.00 99.72 0.03 0.01 0.16 99.74 0.04 0.00 0.00 0.00 49 R H H 136.46 2.13 19.40 20.82 91.79 50.52 -64.74 -40.56 0.21 0.00 99.79 0.02 0.01 0.13 99.81 0.04 0.00 0.00 0.00 50 Q H H 91.03 3.76 19.15 23.02 92.08 50.14 -65.02 -41.40 0.29 0.00 99.71 0.03 0.01 0.19 99.73 0.04 0.00 0.00 0.00 51 I H H 49.30 11.75 16.80 29.40 92.07 49.81 -64.41 -42.40 0.11 0.00 99.89 0.01 0.00 0.07 99.89 0.02 0.00 0.00 0.00 52 H H H 92.00 7.23 19.20 26.98 91.73 50.12 -63.76 -41.32 0.09 0.00 99.91 0.01 0.00 0.06 99.91 0.02 0.00 0.00 0.00 53 S H H 56.57 2.65 21.09 22.90 91.77 49.99 -64.41 -41.88 0.18 0.00 99.82 0.01 0.01 0.13 99.82 0.03 0.00 0.00 0.00 54 I H H 61.19 7.56 19.77 28.02 92.21 49.02 -64.85 -42.33 0.19 0.00 99.81 0.02 0.01 0.13 99.81 0.04 0.00 0.00 0.00 55 S H H 23.07 13.69 16.74 31.38 91.84 51.62 -63.29 -41.53 0.25 0.00 99.75 0.02 0.01 0.17 99.72 0.08 0.00 0.00 0.00 56 E H H 94.93 5.04 20.48 25.98 91.66 51.36 -63.94 -40.51 0.41 0.00 99.59 0.02 0.01 0.33 99.47 0.16 0.00 0.00 0.00 57 R H H 119.09 3.35 20.72 23.82 91.89 50.79 -64.53 -41.95 0.75 0.00 99.25 0.04 0.03 0.66 99.05 0.23 0.00 0.00 0.00 58 I H H 46.13 10.99 17.22 29.17 92.36 49.23 -64.95 -42.80 1.81 0.01 98.18 0.12 0.11 1.52 97.85 0.40 0.00 0.00 0.00 59 L H H 52.75 10.93 15.68 27.47 92.22 48.85 -65.13 -40.41 3.08 0.03 96.89 0.34 0.29 2.37 95.31 1.66 0.01 0.01 0.01 60 S H H 61.56 3.68 16.54 20.80 93.32 48.86 -69.43 -37.77 7.83 0.05 92.11 0.59 0.59 6.64 89.50 2.57 0.06 0.02 0.03 61 T H H 80.93 3.70 16.35 20.45 99.53 38.78 -84.41 -37.17 14.69 0.08 85.22 0.78 1.12 13.02 82.29 2.61 0.10 0.03 0.05 62 Y H H 111.02 7.71 14.24 22.69 102.35 30.68 -95.01 -32.94 36.12 0.34 63.54 1.93 4.35 29.77 60.49 2.83 0.27 0.13 0.24 63 L C T 79.00 7.97 12.47 21.53 101.15 36.18 -96.26 -10.11 60.36 1.69 37.95 7.39 17.83 35.41 34.25 3.03 0.29 0.59 1.21 64 G C C 51.19 2.73 14.47 18.15 104.85 -119.56 77.32 28.16 95.20 1.48 3.32 51.10 16.95 27.53 1.32 1.63 0.00 0.76 0.70 65 R C C 136.64 5.96 10.72 18.37 117.38 -89.27 -94.50 141.41 94.51 3.24 2.25 71.03 17.59 5.62 0.83 1.38 0.00 1.61 1.93 66 S C C 70.02 4.87 10.63 17.27 114.17 -119.09 -84.93 142.47 92.93 5.44 1.64 82.76 6.66 3.17 0.60 0.95 0.00 2.37 3.49 67 A C S 86.82 3.18 10.29 15.05 102.72 -150.18 -87.11 -2.03 97.20 2.12 0.68 45.13 48.64 3.69 0.17 0.47 0.00 1.05 0.85 68 E C S 137.96 1.77 11.27 14.13 119.02 93.06 -97.77 137.54 97.13 2.69 0.17 35.29 61.28 1.04 0.04 0.11 0.00 1.48 0.76 69 P C C 102.07 3.76 9.39 15.25 113.56 -104.20 -67.13 144.52 94.97 4.61 0.42 83.40 10.34 1.26 0.11 0.32 0.00 2.60 1.97 70 V C C 88.96 5.71 7.93 15.49 116.85 -127.70 -94.88 133.29 92.31 6.53 1.16 78.79 11.74 1.57 0.38 0.82 0.00 3.74 2.95 71 P C C 114.83 1.52 10.90 13.15 109.09 -112.89 -70.36 132.75 85.69 5.78 8.53 63.70 12.55 8.23 1.37 8.47 0.00 3.83 1.86 72 L C C 105.58 5.86 7.39 14.81 117.85 -134.90 -97.14 136.69 80.99 6.97 12.04 49.52 18.59 12.21 1.73 11.30 0.00 4.27 2.37 73 Q C C 146.10 1.38 11.91 13.93 114.32 -140.81 -95.44 127.67 83.51 7.74 8.75 60.60 13.31 8.42 1.60 8.15 0.00 4.31 3.60 74 L C C 89.86 8.80 7.51 17.33 118.73 -149.95 -95.52 136.87 95.53 3.59 0.87 66.85 28.15 0.69 0.44 0.38 0.00 1.66 1.83 75 P C C 78.17 3.92 12.10 17.55 116.87 -108.93 -67.07 154.12 98.24 0.61 1.14 93.78 3.81 0.96 0.46 0.44 0.00 0.31 0.24 76 P C C 97.17 2.84 12.86 16.84 112.43 -98.69 -66.21 144.27 92.09 2.13 5.78 87.38 3.01 2.36 1.74 3.40 0.00 1.00 1.11 77 L H G 93.15 9.38 7.97 17.93 103.47 -121.78 -75.29 15.05 40.09 3.70 56.22 26.85 6.04 7.10 4.25 52.53 0.00 2.66 0.59 78 E H G 144.34 2.28 12.48 15.64 99.08 82.93 -75.90 -14.36 32.21 5.89 61.89 12.77 8.31 13.19 3.97 56.36 0.04 4.65 0.71 79 R H G 166.24 2.69 12.91 16.25 102.91 40.40 -92.88 28.58 30.08 8.85 61.07 13.37 7.05 12.04 3.38 55.49 0.02 8.01 0.65 80 L C C 69.36 12.10 8.62 21.19 117.23 110.34 -93.89 133.21 58.25 33.55 8.20 46.45 9.16 3.07 2.94 5.17 0.02 30.03 3.15 81 T E E 79.76 4.73 15.47 21.81 125.15 -169.81 -121.63 141.46 41.45 56.26 2.29 36.25 2.91 1.16 1.54 1.03 0.00 50.76 6.33 82 L E E 74.42 12.19 11.55 24.36 116.98 -144.43 -99.16 128.71 45.20 52.89 1.91 37.36 5.55 1.79 1.14 1.03 0.00 49.20 3.93 83 D C C 87.97 4.66 15.77 21.56 110.85 -160.53 -102.48 112.79 65.74 31.97 2.29 51.57 9.90 4.06 0.81 1.48 0.01 29.71 2.47 84 C C C 62.25 10.97 9.63 21.17 101.97 -170.20 -92.02 11.09 78.53 14.94 6.53 50.30 16.09 12.68 1.90 4.52 0.01 12.15 2.35 85 N C C 125.00 1.94 14.37 16.58 97.17 98.28 -86.76 -1.38 83.31 8.25 8.43 47.23 21.57 15.22 2.57 5.69 0.01 5.22 2.49 86 E C C 104.95 4.97 11.94 18.62 120.35 90.88 -93.35 147.28 74.61 7.43 17.96 30.39 25.66 20.50 5.14 11.34 0.06 4.06 2.83 87 D C C 102.24 4.25 12.80 18.76 109.97 -110.78 -80.23 121.60 77.35 7.64 15.01 40.58 17.71 20.15 4.06 10.21 0.03 4.24 3.02 88 C C C 66.64 9.24 10.86 21.06 100.70 -173.53 -91.18 3.51 78.42 8.40 13.18 41.39 16.42 21.42 3.34 9.23 0.02 4.34 3.83 89 G C C 44.44 4.63 13.23 19.20 110.74 -113.79 84.42 9.45 84.23 7.94 7.83 39.95 23.42 21.66 1.74 5.84 0.01 4.06 3.32 90 T C C 91.25 4.07 11.90 17.34 114.08 -52.59 -98.93 127.77 82.28 9.48 8.24 32.61 31.16 19.64 1.94 5.82 0.03 4.64 4.15 91 S C S 79.19 3.53 11.64 16.36 109.71 -112.90 -92.18 112.91 81.80 7.53 10.67 27.81 29.06 26.21 2.59 7.24 0.03 3.65 3.41 92 G C T 49.51 5.11 11.69 17.77 102.56 -27.46 79.90 -13.50 79.05 4.11 16.84 21.31 26.53 32.56 3.73 11.80 0.03 2.12 1.92 93 T C T 97.13 3.70 11.94 16.81 102.03 57.37 -91.85 -6.43 73.14 7.76 19.11 24.79 21.96 28.55 4.78 12.54 0.08 4.24 3.05 94 Q C C 122.25 3.48 12.36 17.25 107.41 79.89 -91.17 62.78 71.08 11.93 17.00 27.04 21.52 24.74 4.83 10.72 0.14 6.52 4.47 95 G C C 40.54 6.67 11.95 19.89 117.29 -115.90 101.19 170.58 82.78 10.90 6.32 41.86 22.28 19.54 1.62 4.59 0.02 6.44 3.65 96 V C C 98.40 5.65 12.24 19.11 111.66 -79.35 -95.95 122.09 79.68 15.97 4.35 42.24 19.74 18.62 1.31 3.03 0.02 9.47 5.58 97 G C C 42.70 5.80 13.45 20.36 118.50 25.37 105.66 175.17 85.25 12.71 2.04 42.19 30.38 13.50 0.51 1.63 0.00 7.97 3.81 98 S C C 67.01 5.50 14.03 20.85 118.11 -76.85 -103.93 135.69 89.40 9.16 1.44 67.88 19.88 1.87 0.73 0.73 0.00 6.08 2.83 99 P C C 76.32 9.26 11.43 21.69 108.31 -123.30 -69.94 131.66 66.77 10.91 22.32 39.77 12.65 14.64 13.10 9.12 0.06 8.37 2.28 100 Q C C 111.01 5.68 13.93 20.83 111.79 78.98 -92.57 122.13 43.31 27.08 29.61 24.16 9.31 11.53 18.66 10.60 0.42 22.05 3.28 101 I E E 88.74 8.49 12.18 21.70 113.23 -146.18 -97.59 120.37 31.02 36.95 32.03 20.95 5.78 5.67 22.31 9.82 0.19 32.10 3.18 102 L E E 94.56 7.50 12.96 21.54 111.18 -139.53 -91.57 118.55 30.86 40.54 28.60 21.40 5.09 5.02 21.33 7.79 0.12 36.12 3.12 103 V C E 86.14 7.21 12.40 20.81 112.26 95.91 -97.20 115.76 39.47 37.30 23.22 24.60 8.71 7.24 17.44 6.51 0.25 31.63 3.60 104 E C C 113.69 5.96 13.25 20.54 115.82 -132.89 -98.30 131.34 58.12 26.14 15.74 34.81 16.71 7.07 11.95 4.47 0.22 20.74 4.05 105 S C C 49.64 8.09 11.58 21.15 113.32 -135.39 -93.51 126.49 84.83 4.99 10.17 69.96 11.53 2.77 9.45 1.64 0.00 3.58 1.06 106 P H H 82.41 5.63 12.34 19.66 95.30 -143.88 -64.11 -26.68 42.70 2.56 54.73 25.48 6.46 11.49 46.28 7.79 0.03 1.85 0.62 107 T H H 82.35 2.98 14.57 18.21 94.14 60.94 -67.19 -36.13 28.37 4.18 67.44 13.88 5.48 10.75 54.34 11.16 0.17 3.34 0.87 108 V H H 66.78 7.10 12.39 20.81 94.00 52.61 -68.79 -38.57 21.66 6.64 71.69 11.17 4.58 7.80 57.48 12.00 0.20 5.75 1.02 109 L H H 82.47 7.32 11.41 19.87 94.85 52.00 -72.36 -30.94 24.82 6.48 68.70 13.44 5.27 8.49 56.23 9.87 0.20 5.30 1.21 110 E H H 133.36 2.34 13.28 16.39 96.32 56.43 -75.79 -23.33 39.15 5.25 55.60 19.64 8.04 13.98 46.35 6.82 0.17 3.64 1.37 111 S C H 74.71 3.40 11.71 16.30 100.87 60.66 -84.30 -4.92 58.31 3.16 38.53 19.40 11.45 28.41 31.84 5.78 0.15 1.82 1.17 112 G C T 43.10 5.99 10.49 17.86 110.03 36.35 70.00 17.51 74.03 4.28 21.69 27.10 16.91 31.34 15.06 5.63 0.06 2.52 1.39 113 A C C 76.47 4.10 9.05 14.78 109.31 73.90 -87.82 114.53 76.81 9.03 14.16 48.17 15.51 13.28 8.89 5.33 0.02 6.33 2.47 114 K C C 149.51 2.32 9.07 13.10 112.15 -158.93 -90.84 126.90 82.95 9.83 7.22 73.16 2.82 6.90 4.35 2.37 0.00 7.10 3.30 115 E C C 144.21 2.52 10.72 15.00 110.49 -130.42 -84.93 125.42 99.75 0.20 0.05 99.62 0.13 0.09 0.02 0.00 0.00 0.12 0.02