# 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 126.59 3.56 11.97 17.15 115.98 -161.85 -100.64 132.30 99.91 0.08 0.01 99.87 0.06 0.02 0.00 0.00 0.00 0.04 0.01 1 I C C 109.05 5.19 8.31 15.33 116.05 -148.15 -95.26 130.18 91.24 4.42 4.34 89.36 0.81 1.83 3.14 0.72 0.00 2.45 1.69 2 T C C 90.19 3.34 9.30 14.51 116.49 -162.47 -99.64 143.56 87.96 4.62 7.41 75.97 7.26 4.32 6.09 1.77 0.00 2.93 1.66 3 K C C 151.71 2.31 9.79 13.65 106.68 -129.00 -83.00 86.32 77.67 3.06 19.28 56.65 12.78 6.91 17.76 3.08 0.00 1.72 1.09 4 T C C 87.89 3.96 9.99 15.60 107.64 75.67 -85.22 121.21 72.39 1.41 26.20 50.92 11.91 7.85 25.09 2.98 0.00 0.68 0.57 5 S C C 62.56 4.17 11.39 16.99 106.59 -117.56 -79.65 116.88 67.19 0.76 32.05 52.09 7.25 6.02 31.57 2.40 0.00 0.32 0.34 6 K H H 130.01 4.14 12.27 17.77 95.22 -128.20 -67.21 -31.71 29.89 0.37 69.74 16.13 5.96 8.21 67.22 2.15 0.01 0.15 0.17 7 N H H 89.89 3.96 13.76 18.80 94.28 55.18 -67.95 -37.22 21.45 0.27 78.28 11.53 3.84 6.57 76.10 1.71 0.01 0.11 0.12 8 A H H 54.39 3.06 15.11 18.93 92.85 52.96 -65.23 -40.92 7.37 0.12 92.51 4.11 1.28 2.33 91.08 1.09 0.00 0.06 0.05 9 A H H 44.05 4.69 14.81 21.12 92.30 50.91 -64.45 -41.49 4.08 0.07 95.85 2.16 0.58 1.39 95.17 0.64 0.00 0.03 0.02 10 R H H 101.95 7.25 15.40 23.71 92.43 50.57 -64.93 -41.01 2.54 0.06 97.40 1.23 0.33 0.96 97.00 0.44 0.00 0.03 0.02 11 L H H 87.52 4.15 16.97 22.00 92.05 50.42 -64.71 -41.29 1.81 0.04 98.15 0.79 0.21 0.72 97.94 0.31 0.00 0.02 0.01 12 K H H 120.58 2.08 18.88 20.28 92.13 49.79 -64.82 -41.40 1.71 0.03 98.26 0.63 0.18 0.76 98.16 0.25 0.00 0.01 0.01 13 R H H 103.51 6.56 17.78 25.13 92.20 49.66 -64.77 -41.31 1.75 0.02 98.23 0.54 0.17 0.84 98.22 0.21 0.00 0.01 0.01 14 H H H 64.51 11.63 15.93 28.24 92.08 50.50 -64.34 -41.07 1.69 0.01 98.30 0.50 0.16 0.82 98.31 0.20 0.00 0.00 0.00 15 A H H 55.24 3.74 18.96 23.06 91.77 50.96 -63.93 -40.82 1.70 0.01 98.28 0.46 0.16 0.87 98.25 0.25 0.00 0.00 0.00 16 R H H 130.18 2.44 20.36 22.12 92.07 49.91 -65.02 -41.18 2.00 0.02 97.98 0.52 0.20 1.09 97.80 0.37 0.00 0.01 0.00 17 V H H 34.00 12.92 16.29 30.05 92.32 49.49 -64.89 -42.12 2.13 0.02 97.85 0.56 0.23 1.15 97.52 0.52 0.00 0.01 0.00 18 R H H 95.63 12.67 16.73 29.35 91.80 51.96 -63.19 -40.05 3.02 0.02 96.96 0.70 0.30 1.81 96.03 1.13 0.00 0.01 0.01 19 A H H 70.42 2.53 19.46 21.73 91.84 52.25 -65.47 -37.23 6.76 0.04 93.20 0.93 0.58 5.00 90.16 3.29 0.02 0.02 0.02 20 K H H 124.34 4.16 19.16 23.76 93.39 50.78 -71.55 -30.74 16.40 0.07 83.53 1.28 1.20 13.73 79.64 4.04 0.04 0.03 0.04 21 L H H 28.92 18.84 12.31 30.49 97.32 49.91 -87.75 -11.56 36.88 0.35 62.77 4.96 3.96 28.07 58.45 4.10 0.09 0.13 0.23 22 S C T 66.02 7.90 14.97 24.35 110.56 111.89 -70.81 128.00 82.53 0.91 16.56 11.67 7.16 62.48 15.12 2.57 0.01 0.37 0.63 23 G C T 56.35 2.90 16.41 19.78 98.08 21.69 83.70 -1.44 96.34 0.36 3.30 13.24 14.55 68.94 1.45 1.46 0.00 0.18 0.19 24 T C C 58.76 8.28 12.51 22.38 121.38 106.94 -97.35 149.21 96.29 2.04 1.68 72.56 20.22 2.79 0.75 0.87 0.00 0.60 2.20 25 A C S 78.99 5.14 14.60 21.24 95.38 -135.86 -71.17 -20.23 97.94 0.65 1.41 7.97 49.13 40.94 0.14 1.23 0.00 0.32 0.28 26 E C S 114.56 5.52 18.05 24.57 102.53 70.86 -86.72 0.85 97.46 1.41 1.13 11.10 44.17 42.17 0.08 1.24 0.00 0.91 0.35 27 R C C 88.62 13.85 19.06 32.35 113.01 58.27 -104.77 113.94 95.48 4.41 0.11 49.19 46.80 0.41 0.02 0.09 0.00 2.74 0.75 28 P C C 10.40 22.31 17.39 39.93 116.44 -124.82 -69.36 147.62 91.15 8.81 0.03 90.09 1.41 0.11 0.00 0.02 0.00 8.04 0.32 29 R E E 67.19 13.81 26.87 40.48 125.28 -150.46 -116.45 138.99 10.28 89.71 0.01 9.69 0.50 0.02 0.00 0.01 0.00 88.69 1.10 30 L E E 4.45 26.39 19.99 46.78 121.31 -155.28 -112.31 131.88 2.07 97.93 0.00 1.94 0.06 0.00 0.00 0.00 0.00 97.96 0.04 31 N E E 31.05 13.96 27.99 42.22 122.73 -169.54 -118.53 133.66 0.58 99.42 0.00 0.54 0.01 0.00 0.00 0.00 0.00 99.44 0.01 32 V E E 8.23 24.91 20.10 44.91 120.96 -165.14 -117.43 128.03 0.27 99.72 0.00 0.26 0.00 0.00 0.00 0.00 0.00 99.74 0.00 33 F E E 54.75 12.36 26.56 39.02 129.26 -174.93 -128.85 141.80 0.19 99.81 0.00 0.17 0.00 0.00 0.00 0.00 0.00 99.82 0.00 34 R E E 79.69 17.55 19.20 35.52 120.33 -152.52 -110.43 130.13 2.64 97.36 0.00 2.35 0.12 0.01 0.00 0.00 0.00 97.44 0.07 35 S C C 27.86 10.66 18.83 30.38 131.23 171.49 -124.24 -176.52 76.59 23.39 0.02 74.77 0.99 0.07 0.00 0.01 0.00 23.85 0.30 36 N C S 106.23 5.64 18.10 24.84 92.01 -89.58 -65.40 -27.38 99.66 0.23 0.11 2.01 76.50 21.21 0.01 0.09 0.00 0.15 0.04 37 K C S 114.00 6.36 18.10 25.06 104.39 24.95 -109.03 -18.00 99.61 0.28 0.11 1.41 77.63 20.64 0.00 0.08 0.00 0.19 0.03 38 H E E 53.45 11.41 21.11 33.01 143.23 14.95 -156.07 158.49 29.26 70.72 0.02 23.04 4.90 0.16 0.00 0.02 0.00 71.59 0.29 39 I E E 6.06 24.46 17.82 43.15 119.18 -132.10 -111.38 129.07 0.68 99.32 0.00 0.66 0.01 0.00 0.00 0.00 0.00 99.32 0.01 40 Y E E 37.39 14.09 27.34 41.85 124.13 -169.01 -120.70 138.00 0.06 99.94 0.00 0.06 0.00 0.00 0.00 0.00 0.00 99.94 0.00 41 A E E 1.81 26.45 20.75 47.76 127.59 -170.38 -125.66 140.89 0.06 99.94 0.00 0.05 0.00 0.00 0.00 0.00 0.00 99.95 0.00 42 Q E E 29.31 16.14 28.54 44.54 126.96 -169.54 -127.25 139.56 0.08 99.92 0.00 0.07 0.00 0.00 0.00 0.00 0.00 99.92 0.00 43 I E E 4.63 24.48 23.38 48.02 117.18 -148.98 -104.83 126.24 0.11 99.89 0.00 0.10 0.00 0.00 0.00 0.00 0.00 99.90 0.00 44 I E E 16.97 16.92 22.85 40.25 124.93 -169.52 -119.75 137.51 0.25 99.75 0.00 0.23 0.01 0.00 0.00 0.00 0.00 99.73 0.03 45 D E E 27.14 12.52 20.11 34.12 108.21 -125.87 -81.60 119.48 16.78 83.21 0.01 16.07 0.30 0.03 0.00 0.00 0.00 83.32 0.28 46 D C T 46.89 16.27 15.35 31.83 93.54 -156.27 -71.09 -23.74 99.43 0.13 0.44 0.26 2.96 96.35 0.02 0.31 0.00 0.08 0.03 47 V C T 99.24 3.83 17.38 22.12 98.22 47.75 -79.04 -40.22 99.40 0.08 0.52 0.14 2.06 97.37 0.01 0.37 0.00 0.03 0.02 48 N C T 104.82 2.24 16.74 18.69 99.27 19.95 -102.75 -9.13 99.61 0.05 0.34 0.42 2.03 97.24 0.02 0.25 0.00 0.02 0.01 49 G C C 37.34 9.87 13.08 24.07 95.29 -122.88 74.90 11.80 99.20 0.47 0.32 69.05 5.40 24.78 0.07 0.21 0.00 0.36 0.13 50 V C C 68.67 6.52 19.31 27.11 116.16 147.31 -85.95 135.44 66.98 32.96 0.06 63.33 3.38 0.15 0.02 0.05 0.00 29.06 4.02 51 T E E 53.56 15.75 17.69 33.02 110.40 -122.09 -77.00 124.27 0.74 99.26 0.00 0.74 0.03 0.00 0.00 0.00 0.00 98.75 0.48 52 L E E 31.98 17.13 21.18 38.18 100.45 176.60 -96.72 -30.08 2.11 97.88 0.00 0.98 0.99 0.02 0.00 0.00 0.00 98.00 0.02 53 A E E 7.14 20.73 22.21 43.07 142.67 -0.87 -157.36 152.06 0.40 99.60 0.00 0.28 0.04 0.00 0.00 0.00 0.00 99.67 0.01 54 S E E 36.30 18.43 24.48 41.18 137.61 -172.44 -145.21 148.90 0.71 99.29 0.00 0.61 0.02 0.00 0.00 0.00 0.00 99.36 0.01 55 A E E 7.37 22.98 21.67 44.03 135.53 -173.38 -140.85 149.85 1.06 98.94 0.00 0.99 0.04 0.00 0.00 0.00 0.00 98.92 0.05 56 S E E 25.64 14.53 25.08 39.39 134.79 -171.66 -136.31 152.46 8.52 91.44 0.04 7.90 0.51 0.05 0.01 0.02 0.00 90.84 0.66 57 T C S 22.54 20.84 17.12 37.23 98.51 -134.12 -82.25 -6.45 73.49 19.66 6.85 26.67 27.89 20.58 1.11 5.23 0.02 17.14 1.35 58 L C S 91.64 8.14 21.39 29.61 95.39 75.41 -82.79 -7.76 86.47 3.95 9.59 24.09 33.46 29.80 2.14 6.89 0.01 2.25 1.36 59 D C C 53.99 12.20 13.89 26.82 110.61 100.18 -81.26 122.64 79.67 2.35 17.99 46.95 21.83 10.95 5.77 11.94 0.01 1.02 1.54 60 K C T 145.61 4.33 14.99 21.31 94.68 -151.77 -68.25 -22.51 62.74 0.71 36.55 12.50 11.25 38.44 9.86 27.09 0.01 0.34 0.51 61 D C T 106.11 2.95 18.18 21.57 93.17 64.46 -79.00 -7.07 62.58 0.72 36.70 14.85 9.20 38.02 9.46 27.64 0.01 0.35 0.48 62 L C C 24.27 21.00 10.76 30.46 100.79 82.27 -83.50 7.30 65.32 1.54 33.13 36.70 15.01 13.78 10.29 22.56 0.01 0.70 0.95 63 N C C 105.40 4.41 22.12 26.81 101.88 -153.83 -42.37 62.55 85.31 1.26 13.43 67.40 7.65 10.44 5.70 7.39 0.00 0.62 0.81 64 V C C 38.12 19.51 11.41 29.59 109.86 161.91 -89.08 104.32 85.52 1.67 12.81 64.02 11.68 9.71 5.99 6.68 0.00 0.78 1.14 65 E C C 130.62 3.69 18.89 23.29 106.29 -146.93 -84.10 68.85 87.15 1.56 11.29 48.85 19.05 19.44 4.55 6.40 0.00 0.69 1.02 66 S C C 69.90 7.18 15.34 23.46 109.50 24.04 -96.06 84.36 89.77 1.27 8.96 41.19 23.46 25.40 2.73 5.83 0.00 0.54 0.84 67 T C C 70.43 9.73 15.46 25.65 104.51 121.10 -92.13 15.89 92.54 1.44 6.02 41.16 25.89 25.86 1.90 3.66 0.00 0.59 0.93 68 G C C 38.32 11.36 17.03 28.19 103.01 -125.63 77.33 15.31 93.51 2.00 4.49 42.75 34.94 16.24 1.67 2.42 0.00 0.82 1.16 69 D C C 66.09 8.98 20.37 29.72 117.60 128.29 -99.17 130.62 85.33 2.69 11.99 52.13 30.15 2.56 11.28 1.05 0.00 0.63 2.20 70 T H H 49.65 17.17 17.14 33.21 93.88 -143.25 -64.40 -34.92 8.00 0.06 91.94 2.39 1.86 3.73 91.06 0.90 0.01 0.02 0.03 71 S H H 62.04 4.25 25.99 30.39 92.15 54.39 -64.39 -40.47 3.86 0.03 96.11 1.06 0.48 2.15 95.45 0.84 0.00 0.01 0.01 72 A H H 11.25 15.75 21.74 38.11 91.60 50.78 -64.18 -42.02 0.84 0.00 99.16 0.22 0.08 0.44 98.74 0.52 0.00 0.00 0.00 73 A H H 1.40 26.77 19.92 47.00 91.36 51.66 -63.55 -42.23 0.40 0.00 99.60 0.08 0.03 0.22 99.39 0.27 0.00 0.00 0.00 74 T H H 43.48 14.73 27.02 41.01 91.66 51.06 -63.64 -42.14 0.38 0.00 99.62 0.06 0.02 0.24 99.56 0.12 0.00 0.00 0.00 75 K H H 85.57 7.06 30.33 39.00 91.35 50.18 -64.10 -41.75 0.27 0.00 99.73 0.02 0.01 0.18 99.73 0.05 0.00 0.00 0.00 76 V H H 1.80 25.81 26.00 51.40 91.55 49.93 -64.07 -44.01 0.09 0.00 99.91 0.01 0.00 0.06 99.91 0.02 0.00 0.00 0.00 77 G H H 0.56 27.42 24.69 52.24 91.30 51.27 -63.10 -43.06 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 78 E H H 68.00 11.21 29.50 41.61 91.45 50.28 -63.87 -41.99 0.06 0.00 99.94 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 79 L H H 36.57 11.10 29.19 41.90 91.40 50.07 -63.73 -42.75 0.07 0.00 99.93 0.00 0.00 0.05 99.94 0.01 0.00 0.00 0.00 80 V H H 0.90 27.34 25.72 53.04 91.38 49.21 -64.22 -43.99 0.05 0.00 99.95 0.00 0.00 0.03 99.96 0.00 0.00 0.00 0.00 81 A H H 2.19 25.35 23.31 48.32 91.01 51.38 -62.92 -43.43 0.04 0.00 99.96 0.00 0.00 0.02 99.97 0.00 0.00 0.00 0.00 82 K H H 100.14 5.08 29.08 35.10 91.28 50.06 -63.17 -42.29 0.05 0.00 99.95 0.00 0.00 0.03 99.96 0.00 0.00 0.00 0.00 83 R H H 60.71 10.98 25.61 37.06 91.70 49.09 -64.59 -41.87 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 84 A H H 1.10 26.42 16.11 43.53 91.06 50.63 -63.16 -43.22 0.16 0.00 99.84 0.01 0.00 0.11 99.82 0.06 0.00 0.00 0.00 85 A H H 42.70 13.92 19.11 32.59 91.33 50.91 -62.61 -41.33 0.46 0.00 99.54 0.01 0.01 0.41 99.27 0.29 0.00 0.00 0.00 86 E H H 144.01 1.47 21.54 22.14 90.08 53.54 -65.36 -28.90 4.67 0.00 95.33 0.05 0.07 4.99 94.54 0.35 0.00 0.00 0.00 87 K C T 95.56 9.71 16.27 26.81 93.08 52.98 -88.07 1.04 77.61 0.01 22.37 0.19 0.57 76.80 21.89 0.52 0.00 0.00 0.01 88 G C T 45.04 3.64 22.77 26.63 97.61 -101.97 89.05 11.39 99.91 0.00 0.09 0.70 0.55 98.70 0.03 0.01 0.00 0.00 0.00 89 I C C 11.61 24.03 11.12 35.04 112.39 151.37 -80.74 125.50 91.94 7.99 0.06 92.32 0.40 0.06 0.01 0.02 0.00 6.78 0.41 90 S C C 61.66 6.44 24.28 31.56 101.84 173.53 -107.03 -13.70 84.60 15.33 0.07 67.41 15.46 0.42 0.01 0.07 0.00 16.33 0.31 91 D E E 49.46 11.35 25.78 37.84 132.73 34.96 -138.97 143.22 11.07 88.84 0.08 8.93 1.78 0.18 0.01 0.06 0.00 88.82 0.23 92 V E E 2.56 26.98 19.14 46.94 125.23 -166.63 -127.29 133.50 1.23 98.76 0.01 1.14 0.05 0.00 0.00 0.00 0.00 98.73 0.07 93 V E E 21.92 16.32 28.27 44.61 118.29 -162.15 -112.83 125.46 1.12 98.87 0.01 1.08 0.04 0.00 0.00 0.00 0.00 98.78 0.09 94 F E E 7.49 24.91 21.29 46.08 121.09 -166.33 -110.71 131.31 9.44 90.52 0.03 9.25 0.25 0.02 0.01 0.01 0.00 90.24 0.22 95 D E E 43.41 13.95 24.80 38.35 109.35 -146.67 -97.40 109.65 49.55 50.30 0.15 42.73 4.43 0.49 0.03 0.12 0.00 51.63 0.57 96 R C C 53.29 17.98 16.87 34.29 101.29 166.28 -97.81 5.32 84.31 14.18 1.50 70.68 8.93 3.96 0.35 1.28 0.00 12.77 2.04 97 G C C 39.93 8.64 17.45 26.64 102.58 -151.48 51.98 2.35 87.81 7.08 5.11 39.10 22.52 26.99 0.79 4.41 0.01 4.27 1.91 98 G C S 48.69 5.94 16.38 23.10 100.98 -14.00 82.48 -1.59 88.09 2.90 9.01 16.70 36.89 35.01 1.18 7.42 0.01 1.52 1.28 99 Y C C 127.37 7.25 14.53 23.00 117.35 96.43 -97.38 140.43 82.91 5.30 11.79 32.74 31.62 19.10 2.54 8.79 0.03 2.52 2.67 100 L C C 89.39 8.76 15.78 25.23 109.80 -117.45 -90.28 120.98 85.15 5.21 9.64 49.64 20.37 15.26 2.86 6.76 0.01 2.81 2.29 101 Y C C 100.71 13.86 13.21 26.81 114.20 -141.52 -96.78 121.88 86.80 4.10 9.09 62.31 13.53 10.69 3.90 5.21 0.00 2.13 2.23 102 H C C 98.07 6.73 16.73 24.83 127.27 161.13 -134.16 151.73 88.05 1.69 10.26 62.34 19.62 5.36 9.22 1.75 0.00 0.61 1.10 103 G H H 42.10 4.83 20.10 25.43 108.46 -28.14 59.59 -122.20 31.17 0.26 68.57 6.76 13.95 11.12 66.39 1.51 0.05 0.07 0.17 104 R H H 74.45 16.29 19.64 34.86 93.41 7.58 -67.88 -34.52 8.09 0.08 91.83 1.87 1.53 4.78 90.57 1.17 0.02 0.04 0.03 105 V H H 5.66 25.05 18.33 43.09 91.81 53.85 -64.48 -41.62 2.94 0.05 97.01 0.99 0.39 1.48 96.34 0.75 0.01 0.03 0.01 106 K H H 91.03 10.20 25.55 35.78 91.55 52.08 -63.04 -41.26 0.70 0.01 99.30 0.21 0.07 0.32 99.12 0.28 0.00 0.00 0.00 107 A H H 27.62 9.03 26.05 36.34 91.64 51.00 -64.17 -42.10 0.34 0.00 99.66 0.06 0.02 0.18 99.61 0.12 0.00 0.00 0.00 108 L H H 3.84 25.23 23.76 48.38 91.95 49.66 -64.65 -42.85 0.23 0.00 99.77 0.03 0.01 0.14 99.76 0.06 0.00 0.00 0.00 109 A H H 5.52 22.37 23.05 44.89 91.11 50.34 -62.35 -43.43 0.19 0.00 99.81 0.02 0.01 0.11 99.83 0.03 0.00 0.00 0.00 110 D H H 70.78 4.43 28.73 33.64 91.35 50.14 -63.62 -41.71 0.26 0.00 99.74 0.04 0.01 0.15 99.78 0.03 0.00 0.00 0.00 111 A H H 12.64 13.42 22.87 37.45 91.45 50.79 -63.40 -42.78 0.21 0.00 99.79 0.03 0.01 0.13 99.78 0.05 0.00 0.00 0.00 112 A H H 1.99 25.52 16.61 42.77 91.10 50.41 -63.33 -43.04 0.35 0.00 99.64 0.05 0.02 0.23 99.59 0.10 0.00 0.00 0.00 113 R H H 116.97 9.68 20.47 30.45 91.50 50.00 -62.84 -41.32 1.06 0.00 98.93 0.16 0.08 0.75 98.71 0.28 0.00 0.00 0.00 114 E H H 136.87 2.13 21.22 23.18 90.34 53.07 -64.79 -29.35 5.78 0.01 94.21 0.15 0.19 5.46 93.86 0.33 0.00 0.00 0.00 115 A C T 35.78 13.17 14.39 28.45 92.84 53.80 -86.43 -0.15 78.98 0.02 21.00 0.28 0.69 77.00 21.57 0.44 0.00 0.00 0.01 116 G C T 50.48 2.59 21.54 24.00 97.20 -101.62 88.33 10.54 99.73 0.01 0.25 1.03 0.85 97.98 0.10 0.03 0.00 0.00 0.00 117 L C C 17.93 22.56 9.34 31.07 118.18 139.67 -87.71 139.24 97.36 2.51 0.13 95.49 1.82 0.32 0.04 0.06 0.00 1.81 0.45 118 K C C 139.92 2.61 22.57 25.35 114.44 -140.48 -94.08 129.91 70.12 29.65 0.23 71.11 0.64 0.40 0.10 0.09 0.00 19.19 8.47 119 F C C 46.15 22.15 13.71 34.41 118.26 -157.88 -102.77 133.16 96.41 3.58 0.00 97.23 0.09 0.01 0.00 0.00 0.00 2.50 0.17