# 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 97.69 8.32 11.89 21.11 114.82 -161.55 -93.30 136.35 99.87 0.11 0.02 99.81 0.09 0.03 0.01 0.00 0.00 0.04 0.02 1 S C C 68.68 4.72 10.35 16.56 111.99 -127.67 -84.12 140.02 85.50 2.53 11.97 78.84 1.44 6.59 6.75 3.71 0.00 1.33 1.34 2 E C C 139.54 3.13 9.72 14.40 100.44 -134.77 -78.73 -16.17 73.13 2.48 24.39 37.72 17.47 18.71 12.48 11.07 0.01 1.20 1.33 3 D C C 106.88 2.82 10.37 14.64 101.59 67.68 -84.49 0.01 71.63 1.90 26.48 35.83 18.92 17.53 13.83 11.93 0.01 0.89 1.05 4 A C C 68.06 5.08 10.38 17.00 103.39 90.48 -82.53 3.76 70.04 2.01 27.95 42.96 15.68 11.65 17.91 9.72 0.01 0.93 1.14 5 T C C 68.80 7.39 10.30 19.05 114.19 79.67 -88.68 135.40 71.92 1.78 26.31 46.36 17.54 8.06 19.23 7.01 0.00 0.78 1.02 6 P C C 80.41 6.16 12.00 19.58 107.77 -108.06 -71.93 136.01 69.32 1.55 29.13 43.51 11.41 14.22 20.79 8.50 0.00 0.83 0.73 7 K C C 136.60 4.10 13.13 18.55 106.63 -139.84 -86.58 67.53 64.22 2.64 33.14 34.54 16.90 13.42 23.42 9.15 0.03 1.31 1.24 8 A C C 59.81 6.02 12.75 20.20 116.52 -110.14 -85.14 141.73 65.29 2.46 32.25 39.75 18.89 7.08 25.87 6.18 0.01 1.34 0.90 9 P C C 71.19 8.09 12.43 21.75 109.23 -104.56 -70.27 135.52 60.78 5.04 34.17 44.99 8.20 7.39 26.09 8.36 0.01 3.41 1.55 10 V C C 79.77 7.94 12.65 21.76 112.35 -134.02 -87.68 134.33 51.23 14.01 34.77 35.68 8.76 7.00 25.44 9.37 0.10 9.57 4.10 11 E C C 113.19 5.84 14.19 21.16 113.10 -118.04 -83.68 131.77 52.15 17.64 30.20 35.19 8.93 7.95 21.31 9.33 0.13 12.60 4.56 12 R C C 140.24 6.97 12.57 20.66 103.62 -104.83 -83.81 49.61 53.42 18.40 28.17 29.20 11.53 13.51 17.65 10.33 0.29 12.36 5.12 13 T C T 73.49 7.36 14.33 22.53 104.87 113.28 -97.43 14.35 73.18 7.07 19.75 22.44 16.88 34.38 10.94 8.42 0.14 4.34 2.46 14 G C T 44.77 5.91 15.86 22.74 97.86 -96.77 83.16 4.64 86.78 4.55 8.67 22.90 26.35 38.34 3.03 5.10 0.01 3.10 1.16 15 L C C 62.60 10.04 13.00 24.45 118.51 125.64 -94.32 138.47 70.20 23.31 6.49 47.57 16.21 6.12 3.72 3.14 0.05 14.46 8.73 16 I C C 79.64 8.95 14.29 24.46 113.04 -138.11 -94.55 128.13 63.25 30.86 5.89 46.45 10.51 5.09 3.69 2.73 0.05 19.18 12.29 17 R C C 130.25 5.93 14.31 21.54 125.67 -158.54 -127.89 143.02 65.63 25.54 8.83 32.63 21.82 12.41 4.40 4.66 0.23 15.07 8.77 18 G C S 43.07 3.94 15.91 20.73 119.83 14.45 76.63 -155.51 74.22 7.73 18.05 13.58 31.48 30.30 2.80 14.21 0.08 4.68 2.86 19 L C T 113.67 5.07 14.24 20.27 94.14 -28.06 -73.08 -20.19 76.40 2.63 20.97 5.59 15.14 54.67 2.13 19.60 0.03 1.59 1.26 20 N C T 62.25 10.98 11.25 22.96 98.32 54.68 -98.12 14.78 73.23 6.67 20.10 10.83 14.55 47.54 2.19 18.41 0.06 4.12 2.30 21 K C T 127.45 5.75 12.16 20.11 111.04 132.73 -63.40 130.06 85.76 8.03 6.21 7.73 8.79 69.37 1.58 4.43 0.03 5.13 2.93 22 G C T 56.88 2.37 15.44 18.21 95.24 16.18 84.33 -1.75 89.94 6.47 3.60 9.21 13.06 67.71 0.67 3.06 0.01 5.35 0.93 23 H C C 87.87 8.39 11.72 21.63 117.80 123.46 -85.29 141.17 79.78 18.25 1.97 56.83 20.15 2.89 0.77 1.38 0.00 13.43 4.54 24 K E C 141.12 3.07 16.10 20.29 113.76 -114.26 -76.64 137.53 43.96 54.68 1.35 38.55 2.60 0.68 1.08 0.47 0.00 25.40 31.23 25 T C C 52.76 14.40 9.15 23.11 119.33 -148.56 -97.37 144.02 79.94 18.06 1.99 71.01 6.94 1.76 1.27 0.92 0.00 14.23 3.87 26 T C C 80.11 4.98 14.55 20.75 117.50 -138.18 -99.50 137.34 83.58 13.87 2.55 72.22 9.05 1.92 1.63 1.07 0.00 10.78 3.32 27 R C C 156.72 4.44 12.34 18.54 113.01 -117.46 -78.79 132.84 83.95 10.65 5.40 69.14 11.18 3.27 3.33 2.22 0.00 8.45 2.41 28 R C C 134.89 6.79 9.53 17.75 113.97 -136.30 -90.45 127.03 88.23 6.71 5.07 76.14 9.24 2.74 2.97 2.11 0.00 4.94 1.86 29 V C C 109.73 2.70 11.17 15.41 115.05 -154.07 -97.80 129.47 88.20 6.09 5.70 78.95 6.73 2.48 3.42 2.16 0.00 4.28 1.98 30 L C C 102.37 6.51 7.95 15.94 115.81 -137.15 -87.69 136.36 89.43 4.67 5.90 78.73 7.86 2.88 3.30 2.43 0.00 2.97 1.84 31 K C C 153.06 1.81 11.40 14.36 114.97 -136.18 -86.33 142.14 93.53 2.09 4.38 74.21 15.71 3.65 2.27 1.99 0.00 1.17 1.01 32 E C C 137.18 3.21 10.20 15.39 113.36 -103.36 -78.61 138.16 95.31 1.50 3.19 77.50 15.01 2.80 1.56 1.43 0.00 0.70 1.00 33 R C C 119.48 6.31 8.96 16.99 116.21 -127.93 -88.41 140.87 97.68 0.65 1.67 87.03 9.88 0.88 0.95 0.53 0.00 0.22 0.52 34 P C G 92.68 3.56 11.10 16.21 95.79 -113.88 -61.00 -31.18 50.94 0.76 48.30 25.50 6.54 18.03 8.54 40.61 0.00 0.42 0.34 35 S H G 73.25 4.21 10.76 16.49 96.64 61.89 -76.47 -13.55 46.49 0.77 52.73 15.42 7.74 22.87 9.86 43.34 0.00 0.41 0.37 36 R H G 142.89 5.07 11.17 17.59 98.71 63.57 -88.98 3.89 46.24 1.38 52.37 22.40 10.44 13.74 10.76 41.33 0.01 0.72 0.61 37 R C C 130.18 6.30 10.55 18.39 112.06 101.37 -88.95 125.96 71.82 1.81 26.36 46.35 14.55 10.66 11.30 15.10 0.00 0.80 1.23 38 K C C 148.56 2.68 11.95 15.93 110.22 -141.77 -86.70 125.12 78.93 1.93 19.15 32.80 15.58 31.32 10.25 7.93 0.01 0.83 1.27 39 G C T 44.26 5.38 11.97 18.62 115.58 -1.63 107.20 -133.58 80.69 1.23 18.08 26.12 20.23 35.11 7.82 9.33 0.01 0.52 0.85 40 A C C 68.09 5.66 11.49 18.47 109.71 -62.25 -80.92 128.53 79.45 2.32 18.23 51.71 15.33 12.16 9.56 8.66 0.00 1.01 1.55 41 Q C C 119.20 4.99 11.78 18.30 105.98 -138.41 -84.81 63.89 82.84 2.23 14.92 56.19 16.65 9.75 9.22 5.76 0.00 0.94 1.48 42 S C C 49.66 6.20 11.06 18.91 120.44 97.21 -95.72 158.89 86.51 1.62 11.87 61.12 21.04 3.87 10.29 2.04 0.00 0.51 1.12 43 K H H 156.95 1.51 13.89 15.80 92.71 -110.18 -61.83 -34.09 22.57 0.25 77.18 4.89 5.31 12.96 69.74 6.77 0.08 0.11 0.14 44 R H H 133.27 4.37 14.64 19.92 92.59 53.87 -66.90 -36.55 22.28 0.28 77.44 4.21 3.51 14.72 70.12 7.05 0.11 0.14 0.13 45 T H H 32.89 12.74 12.19 25.63 94.22 49.45 -70.29 -36.59 19.18 0.36 80.46 7.30 2.74 9.56 73.67 6.35 0.04 0.21 0.13 46 Q H H 94.53 5.40 16.65 23.14 92.40 56.86 -63.84 -41.33 4.55 0.07 95.38 2.16 0.77 1.59 94.61 0.82 0.00 0.03 0.02 47 F H H 116.59 2.78 19.26 21.68 92.32 50.18 -65.43 -41.75 2.41 0.05 97.54 0.89 0.33 1.16 96.98 0.59 0.01 0.03 0.01 48 V H H 42.89 11.59 17.50 29.66 92.31 48.92 -65.27 -42.43 1.09 0.02 98.89 0.34 0.14 0.56 98.54 0.40 0.00 0.01 0.00 49 R H H 67.67 14.40 16.99 31.24 91.72 51.18 -63.44 -41.51 0.73 0.01 99.26 0.17 0.08 0.41 99.04 0.29 0.00 0.00 0.00 50 S H H 52.51 4.19 20.58 25.06 91.76 51.13 -64.48 -40.53 1.25 0.01 98.73 0.22 0.11 0.83 98.46 0.37 0.01 0.01 0.00 51 L H H 65.96 6.12 20.03 26.78 92.00 50.05 -65.14 -42.17 1.94 0.02 98.04 0.26 0.19 1.43 97.71 0.39 0.01 0.01 0.00 52 I H H 27.12 16.03 15.51 32.15 92.33 49.63 -65.18 -42.24 3.25 0.06 96.70 0.47 0.43 2.30 96.35 0.39 0.02 0.02 0.02 53 R H H 102.86 10.38 16.81 27.51 92.16 51.37 -64.00 -40.84 3.60 0.05 96.34 0.59 0.43 2.44 95.88 0.60 0.02 0.02 0.01 54 E H H 128.83 2.35 18.90 21.16 93.58 47.21 -69.31 -38.50 5.30 0.05 94.66 0.46 0.47 4.45 93.78 0.76 0.03 0.02 0.01 55 V H H 75.12 7.65 16.92 24.90 99.04 36.82 -84.89 -37.63 12.60 0.06 87.35 0.50 1.05 11.28 86.24 0.79 0.08 0.02 0.04 56 A H H 37.07 12.13 15.01 27.59 99.87 25.67 -98.76 -14.27 25.40 0.19 74.40 1.84 5.32 18.31 73.52 0.73 0.10 0.05 0.14 57 G C S 38.97 5.50 18.67 25.15 99.05 -118.96 81.06 5.62 98.41 0.51 1.08 34.99 48.01 15.49 0.44 0.58 0.00 0.22 0.27 58 L C C 54.73 12.96 15.19 28.63 125.00 85.95 -114.05 147.14 95.18 3.21 1.61 61.29 30.25 3.12 0.96 0.58 0.00 0.94 2.86 59 A C C 27.58 11.04 17.65 29.95 118.10 -117.02 -76.38 154.40 96.43 0.27 3.30 87.97 7.10 0.89 3.53 0.24 0.00 0.08 0.20 60 P H H 60.22 9.07 18.89 29.15 91.88 -111.26 -58.26 -36.48 13.01 0.05 86.94 2.53 2.09 8.24 85.05 2.02 0.02 0.02 0.03 61 Y H H 76.60 13.46 19.67 32.87 92.31 54.15 -65.04 -38.82 9.17 0.05 90.78 1.43 1.01 6.61 88.47 2.40 0.03 0.02 0.03 62 E H H 49.64 15.47 19.07 34.10 92.57 51.15 -66.04 -39.67 3.86 0.03 96.12 1.22 0.43 2.07 94.22 2.04 0.00 0.01 0.01 63 R H H 99.13 9.36 21.62 31.06 92.01 51.34 -65.15 -41.02 0.72 0.00 99.28 0.21 0.06 0.32 99.12 0.28 0.00 0.00 0.00 64 R H H 90.01 9.94 22.52 32.51 92.04 50.13 -64.81 -41.08 0.44 0.00 99.56 0.08 0.03 0.25 99.45 0.19 0.00 0.00 0.00 65 V H H 16.05 18.85 19.13 37.96 92.21 50.50 -64.46 -42.75 0.35 0.00 99.65 0.05 0.02 0.23 99.53 0.18 0.00 0.00 0.00 66 I H H 44.20 11.96 21.40 33.87 91.58 50.31 -63.54 -42.11 0.23 0.00 99.77 0.03 0.01 0.14 99.70 0.11 0.00 0.00 0.00 67 E H H 72.99 5.81 23.02 29.10 91.55 50.76 -63.59 -41.76 0.30 0.00 99.70 0.03 0.01 0.21 99.55 0.19 0.00 0.00 0.00 68 L H H 24.87 13.82 17.91 32.83 91.79 50.61 -64.36 -41.74 0.40 0.00 99.60 0.02 0.02 0.30 99.14 0.51 0.00 0.00 0.00 69 L H H 37.31 15.84 16.25 32.12 92.22 49.87 -65.59 -38.72 1.35 0.00 98.65 0.08 0.07 1.10 97.82 0.93 0.00 0.00 0.00 70 R H H 143.65 4.21 19.15 23.97 92.62 49.80 -68.79 -33.99 8.03 0.01 91.96 0.23 0.35 7.43 91.27 0.70 0.01 0.00 0.00 71 N H H 95.25 4.01 16.86 21.43 99.12 35.73 -100.92 -4.10 34.19 0.10 65.71 2.09 3.85 27.22 65.78 0.93 0.04 0.02 0.08 72 G C C 26.74 14.97 9.34 23.41 105.05 106.71 -59.51 82.65 95.34 0.48 4.19 56.48 14.00 25.06 2.54 1.36 0.00 0.19 0.37 73 K C C 167.25 1.09 17.58 17.60 96.27 -138.33 -85.36 -4.76 98.14 0.43 1.43 43.12 41.67 13.46 0.48 0.82 0.00 0.18 0.27 74 D C C 51.08 11.25 10.51 22.94 108.72 102.80 -85.48 110.61 98.01 0.44 1.55 83.25 13.22 1.55 1.03 0.40 0.00 0.13 0.42 75 K H H 141.19 2.98 15.85 20.44 93.68 -167.61 -66.53 -33.56 8.67 0.03 91.30 3.04 2.32 2.99 90.89 0.72 0.00 0.01 0.02 76 R H H 132.54 2.97 19.47 22.43 91.57 54.51 -64.13 -41.06 2.43 0.01 97.57 0.36 0.27 1.62 96.93 0.80 0.01 0.00 0.00 77 A H H 11.02 16.49 14.67 32.13 91.96 49.67 -64.51 -42.22 1.11 0.01 98.88 0.25 0.11 0.64 98.08 0.91 0.00 0.00 0.00 78 R H H 67.39 13.99 16.90 30.98 91.60 51.74 -63.05 -41.77 0.51 0.00 99.48 0.12 0.05 0.26 99.14 0.42 0.00 0.00 0.00 79 K H H 114.59 2.08 23.98 24.36 91.74 50.19 -64.03 -42.15 0.56 0.00 99.44 0.10 0.04 0.31 99.37 0.17 0.00 0.00 0.00 80 F H H 58.33 7.64 20.76 29.54 91.76 49.37 -64.08 -42.81 0.68 0.00 99.31 0.09 0.05 0.43 99.21 0.21 0.00 0.00 0.00 81 S H H 4.74 20.66 13.51 34.85 91.27 50.76 -63.24 -42.51 0.91 0.01 99.08 0.14 0.08 0.53 99.12 0.12 0.00 0.00 0.00 82 K H H 96.17 8.82 17.44 26.96 91.69 51.15 -63.84 -40.25 0.81 0.00 99.19 0.09 0.06 0.51 99.19 0.15 0.00 0.00 0.00 83 K H H 151.95 1.13 19.75 19.18 92.30 49.37 -67.00 -38.79 1.27 0.00 98.73 0.06 0.07 1.03 98.60 0.23 0.00 0.00 0.00 84 K H H 102.59 7.26 17.09 25.09 97.99 37.41 -82.74 -37.71 3.71 0.01 96.28 0.08 0.18 3.46 95.99 0.28 0.01 0.00 0.00 85 L H H 46.59 13.33 12.64 26.40 101.52 25.81 -104.91 -15.40 11.60 0.04 88.36 0.65 1.70 8.84 88.49 0.26 0.02 0.01 0.03 86 G C S 48.18 2.54 17.65 20.52 100.09 -126.31 79.07 -2.91 99.23 0.25 0.52 36.93 56.82 5.56 0.25 0.19 0.00 0.09 0.16 87 T C S 63.57 3.34 18.10 21.77 134.23 29.52 -138.71 162.02 97.10 1.69 1.22 37.45 58.30 1.09 1.05 0.18 0.00 0.29 1.64 88 F H H 111.73 10.32 13.23 24.35 92.09 -111.96 -61.10 -36.45 8.63 0.03 91.34 1.21 3.34 4.02 90.69 0.68 0.02 0.01 0.02 89 G H H 45.28 1.86 19.66 20.44 91.99 52.93 -62.78 -42.81 4.17 0.00 95.82 0.32 0.49 3.07 95.40 0.70 0.00 0.00 0.00 90 R H H 96.93 5.33 19.33 25.40 91.80 47.36 -66.29 -39.48 1.23 0.00 98.77 0.23 0.12 0.76 98.22 0.67 0.00 0.00 0.00 91 A H H 6.34 19.39 12.45 32.49 91.13 52.82 -62.15 -42.97 0.42 0.00 99.58 0.08 0.03 0.22 99.46 0.21 0.00 0.00 0.00 92 K H H 108.24 5.74 21.14 27.56 91.56 50.78 -63.58 -41.37 0.28 0.00 99.72 0.04 0.02 0.15 99.71 0.08 0.00 0.00 0.00 93 R H H 137.00 1.76 23.28 23.14 91.61 49.66 -64.35 -41.84 0.16 0.00 99.84 0.02 0.01 0.09 99.84 0.04 0.00 0.00 0.00 94 K H H 58.44 12.66 19.48 32.30 92.31 48.98 -65.67 -40.84 0.15 0.00 99.85 0.02 0.01 0.08 99.86 0.03 0.00 0.00 0.00 95 C H H 18.93 16.94 16.95 34.15 91.85 50.84 -63.43 -41.95 0.12 0.00 99.88 0.01 0.00 0.06 99.90 0.02 0.00 0.00 0.00 96 E H H 102.60 2.51 23.31 24.63 91.41 50.18 -63.57 -42.01 0.10 0.00 99.90 0.01 0.00 0.05 99.92 0.01 0.00 0.00 0.00 97 E H H 87.71 4.51 22.05 26.61 91.56 49.52 -64.68 -41.96 0.13 0.00 99.87 0.01 0.00 0.08 99.89 0.02 0.00 0.00 0.00 98 L H H 19.71 18.01 16.49 34.84 92.04 50.33 -64.66 -40.76 0.17 0.00 99.83 0.01 0.00 0.11 99.84 0.03 0.00 0.00 0.00 99 Q H H 81.87 8.48 20.13 29.09 91.53 52.51 -63.30 -40.42 0.20 0.00 99.80 0.02 0.01 0.12 99.83 0.02 0.00 0.00 0.00 100 R H H 142.68 1.89 22.42 22.97 91.89 50.05 -65.08 -40.90 0.20 0.00 99.80 0.01 0.01 0.13 99.82 0.02 0.00 0.00 0.00 101 I H H 48.29 9.62 19.07 29.82 91.98 49.65 -64.55 -43.01 0.13 0.00 99.87 0.02 0.01 0.08 99.88 0.02 0.00 0.00 0.00 102 I H H 39.57 12.44 17.22 30.53 91.94 49.33 -64.22 -42.23 0.14 0.00 99.86 0.02 0.01 0.08 99.87 0.03 0.00 0.00 0.00 103 A H H 48.92 3.51 18.59 22.56 91.42 50.66 -63.00 -41.69 0.24 0.00 99.76 0.02 0.01 0.14 99.77 0.05 0.00 0.00 0.00 104 E H H 92.77 2.85 17.69 20.66 91.93 49.87 -64.88 -40.68 0.54 0.00 99.46 0.05 0.03 0.35 99.45 0.11 0.00 0.00 0.00 105 S H H 35.03 8.33 12.91 23.10 91.99 51.59 -65.65 -39.25 1.78 0.00 98.21 0.20 0.11 1.21 98.15 0.32 0.00 0.00 0.00 106 R H H 135.65 3.99 13.34 18.70 91.96 51.24 -66.07 -37.19 6.43 0.01 93.56 0.71 0.47 4.66 93.38 0.77 0.00 0.00 0.00 107 R H H 172.54 1.09 12.76 13.67 92.91 52.40 -68.22 -30.95 20.08 0.07 79.85 2.99 1.83 14.37 79.60 1.12 0.01 0.02 0.04 108 A H H 76.05 2.69 9.85 13.84 96.32 54.61 -79.31 -13.69 47.63 0.21 52.16 19.33 1.47 24.61 53.29 1.08 0.00 0.07 0.14 109 H C C 131.23 4.49 10.79 16.82 102.97 84.64 -82.77 46.20 99.89 0.03 0.09 99.53 0.14 0.23 0.07 0.00 0.00 0.01 0.01