# 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 65.94 14.90 15.16 29.72 122.15 -167.12 -107.96 138.23 99.64 0.34 0.02 99.65 0.07 0.03 0.01 0.00 0.00 0.22 0.01 1 K C C 108.23 7.33 18.31 26.51 122.00 -157.98 -108.97 136.42 57.24 36.93 5.82 52.67 1.44 2.30 4.24 1.35 0.00 36.03 1.97 2 F E E 67.58 14.49 14.43 29.16 119.40 -151.62 -103.89 135.43 30.14 60.98 8.88 22.48 5.03 2.89 6.44 2.49 0.02 59.14 1.50 3 I E E 50.56 13.31 16.68 30.63 115.31 -151.56 -100.26 131.11 19.42 71.27 9.31 15.11 2.54 1.72 6.30 2.53 0.01 70.98 0.81 4 K E E 96.48 9.82 19.44 29.49 116.30 -155.33 -106.54 135.95 15.38 75.00 9.62 11.34 2.38 1.76 6.44 2.49 0.01 74.96 0.61 5 Y E E 87.74 12.80 17.81 30.71 121.25 -156.85 -110.71 133.09 14.78 76.56 8.66 11.44 1.90 1.41 6.27 2.08 0.01 76.16 0.74 6 L E E 43.51 15.10 16.25 31.61 117.86 -160.37 -106.52 131.81 23.46 69.29 7.25 18.93 2.78 1.47 5.87 1.69 0.02 67.91 1.33 7 S C E 41.86 9.65 16.81 27.51 119.20 -151.19 -101.32 144.40 47.37 45.67 6.95 37.76 5.67 2.45 5.22 1.84 0.01 45.58 1.48 8 T C C 75.54 8.70 14.79 24.24 101.15 -134.14 -79.40 -19.10 56.32 12.34 31.34 21.54 16.38 19.66 20.05 10.02 0.26 10.36 1.73 9 A C T 69.07 3.87 15.59 20.15 97.56 64.01 -72.80 -28.72 59.73 5.55 34.72 15.27 16.89 28.74 20.71 12.65 0.27 4.03 1.44 10 H C T 94.28 8.42 13.80 23.06 100.85 48.55 -87.37 -11.85 56.25 9.76 33.99 20.50 13.22 24.08 19.60 13.12 0.28 7.04 2.16 11 L C T 64.40 12.84 12.16 25.04 100.81 76.03 -78.02 -11.04 59.33 12.39 28.27 22.69 12.78 25.26 17.03 10.29 0.29 8.90 2.74 12 N C T 98.55 5.60 16.71 23.16 99.60 54.42 -76.27 -1.52 70.14 10.69 19.17 23.02 14.61 33.61 10.59 7.96 0.10 8.39 1.73 13 Y C T 120.26 7.43 16.68 24.80 105.57 53.04 -96.12 15.73 65.77 20.32 13.91 22.94 17.71 27.08 5.96 7.05 0.15 17.12 2.00 14 M C E 62.39 13.36 17.00 30.33 116.40 59.74 -105.76 132.08 58.00 36.48 5.52 23.80 19.72 16.30 1.67 3.32 0.04 33.63 1.52 15 N E E 48.55 12.37 21.28 33.88 113.78 -145.25 -101.62 124.59 32.21 65.89 1.89 19.46 8.43 5.76 0.47 1.27 0.00 63.90 0.70 16 I E E 14.54 21.92 18.63 40.51 124.93 -169.70 -119.86 135.47 6.36 93.52 0.11 5.37 0.63 0.15 0.04 0.05 0.00 93.57 0.18 17 A E E 15.82 14.78 24.76 40.07 122.99 -163.32 -114.38 136.54 1.25 98.73 0.02 1.07 0.06 0.02 0.00 0.01 0.00 98.80 0.03 18 V E E 17.58 19.95 20.02 40.05 120.45 -160.19 -114.19 128.63 0.71 99.28 0.01 0.62 0.03 0.00 0.00 0.00 0.00 99.32 0.02 19 Y E E 56.85 11.97 20.24 33.20 124.10 -172.02 -118.25 140.69 1.89 98.07 0.03 1.58 0.15 0.04 0.01 0.01 0.00 98.16 0.06 20 E E E 87.92 10.99 15.62 27.13 119.25 -152.29 -109.18 130.72 12.69 87.15 0.16 9.67 2.20 0.57 0.03 0.11 0.00 87.14 0.27 21 N C E 94.08 5.34 14.29 20.92 111.16 -175.42 -118.55 98.70 50.00 48.97 1.03 23.54 14.35 12.13 0.12 0.95 0.00 48.28 0.62 22 G C T 56.45 1.89 14.87 16.83 106.40 -58.06 69.52 -87.82 97.06 1.18 1.76 8.72 29.90 58.47 0.31 1.45 0.00 0.95 0.20 23 S C T 77.37 4.56 13.96 19.50 100.98 -1.69 -97.15 -1.36 95.21 2.41 2.39 8.72 35.21 51.39 0.78 1.52 0.01 2.04 0.33 24 K E E 105.22 6.31 16.62 24.00 123.83 89.81 -105.29 145.05 33.28 65.35 1.37 22.20 10.10 2.37 0.91 0.62 0.00 62.76 1.04 25 I E E 26.88 19.17 13.17 32.37 121.21 -151.51 -110.28 133.00 12.41 87.06 0.53 10.82 1.01 0.24 0.42 0.16 0.00 87.01 0.35 26 K E E 79.39 8.87 23.71 32.96 123.78 -167.65 -118.38 138.77 5.66 93.75 0.59 4.71 0.54 0.14 0.50 0.13 0.00 93.83 0.15 27 A E E 10.22 22.69 16.43 38.97 127.88 -169.33 -126.19 141.92 3.62 95.81 0.57 3.05 0.28 0.08 0.49 0.10 0.00 95.90 0.10 28 R E E 84.96 9.85 25.42 35.67 125.67 -166.41 -123.57 137.71 2.99 96.40 0.61 2.64 0.17 0.06 0.54 0.09 0.00 96.36 0.13 29 V E E 15.13 21.57 17.07 38.64 120.67 -155.93 -111.08 131.99 6.44 92.83 0.74 5.88 0.35 0.12 0.59 0.16 0.00 92.58 0.33 30 E E E 58.83 9.90 21.65 32.36 122.06 -166.83 -113.72 136.90 16.80 80.83 2.37 13.05 2.84 1.21 1.29 0.87 0.00 80.03 0.71 31 N E E 50.18 12.10 16.17 29.21 113.84 -136.51 -95.80 127.13 29.26 66.84 3.89 20.86 6.72 2.93 2.15 1.65 0.02 64.34 1.33 32 V E E 57.61 9.04 14.64 25.25 115.88 -167.36 -105.24 127.21 35.71 58.96 5.33 25.41 7.40 4.59 3.20 2.41 0.07 54.04 2.89 33 V C E 76.28 8.04 11.33 20.67 113.65 -152.43 -102.80 118.71 47.23 44.88 7.88 13.66 12.54 25.33 3.07 4.40 0.23 37.42 3.34 34 N C T 126.48 1.81 13.13 15.54 97.21 -3.74 46.36 36.73 89.65 4.51 5.84 10.68 14.69 64.59 1.45 3.93 0.01 3.85 0.80 35 G C T 58.19 2.35 11.73 15.41 98.61 -63.15 81.90 3.08 92.81 3.04 4.15 14.66 27.81 50.78 0.58 3.31 0.00 2.25 0.60 36 K C E 128.68 2.80 12.83 17.27 120.15 117.76 -102.65 141.54 56.10 42.46 1.44 27.52 19.52 11.70 0.30 1.18 0.01 37.40 2.37 37 S E E 67.67 7.56 12.39 21.45 112.88 -117.24 -81.01 129.79 34.41 64.82 0.78 26.39 6.66 2.33 0.24 0.64 0.00 60.50 3.23 38 V E E 67.46 9.98 14.04 25.00 103.60 175.77 -101.32 -9.81 30.65 68.54 0.81 18.13 8.51 6.02 0.20 0.64 0.00 65.14 1.37 39 G E E 27.06 7.04 18.71 26.80 135.24 -86.03 140.22 -178.42 27.82 71.58 0.60 12.70 10.24 5.95 0.09 0.48 0.00 69.90 0.63 40 A E E 55.95 13.00 14.94 28.05 128.67 -101.53 -124.93 145.79 25.56 73.82 0.61 20.51 3.85 1.13 0.17 0.41 0.00 73.17 0.77 41 R E E 88.03 11.46 17.66 29.80 129.82 -174.40 -131.93 143.64 16.64 83.04 0.32 13.93 2.39 0.54 0.11 0.21 0.00 81.73 1.09 42 D E E 91.32 6.41 20.06 27.68 115.70 -135.42 -94.53 131.69 23.02 76.76 0.22 19.40 2.65 0.59 0.06 0.16 0.00 76.06 1.08 43 F E E 25.05 19.15 10.99 29.96 125.96 -171.08 -121.90 146.71 45.33 54.42 0.25 43.16 1.55 0.30 0.11 0.15 0.00 51.60 3.13 44 D C S 111.57 2.35 19.88 22.21 97.27 -147.71 -88.18 -18.14 92.40 7.50 0.10 31.38 60.60 0.85 0.02 0.07 0.00 6.71 0.38 45 S C S 40.87 4.54 21.60 26.54 139.14 5.87 -151.17 162.25 92.53 5.88 1.59 30.04 62.72 0.78 1.48 0.21 0.00 1.85 2.92 46 T H H 44.56 16.76 12.86 29.31 91.51 -108.83 -61.03 -36.05 2.34 0.01 97.64 0.43 0.44 1.39 96.20 1.52 0.01 0.00 0.00 47 E H H 131.06 1.79 20.32 21.47 91.37 55.90 -63.39 -40.36 1.11 0.01 98.88 0.14 0.11 0.81 97.24 1.70 0.01 0.00 0.00 48 Q H H 75.53 5.75 18.85 25.53 91.75 49.35 -66.11 -39.40 0.52 0.01 99.48 0.08 0.05 0.35 97.84 1.67 0.00 0.00 0.00 49 L H H 8.57 22.17 12.73 35.03 91.60 51.29 -63.70 -42.99 0.38 0.00 99.62 0.06 0.03 0.23 99.06 0.61 0.00 0.00 0.00 50 E H H 79.90 10.92 18.52 29.70 91.48 51.64 -63.30 -40.85 1.49 0.00 98.51 0.11 0.07 1.25 97.42 1.14 0.00 0.00 0.00 51 S H H 67.90 1.64 22.21 21.59 91.90 50.68 -65.11 -40.70 3.57 0.01 96.43 0.17 0.23 3.03 94.03 2.52 0.01 0.00 0.00 52 W H H 74.22 11.55 17.73 29.96 92.67 48.51 -67.12 -40.04 4.19 0.01 95.79 0.22 0.22 3.42 91.13 4.98 0.01 0.01 0.00 53 F H H 21.13 21.11 13.02 33.56 94.82 47.78 -77.33 -29.83 10.83 0.08 89.09 0.92 0.71 8.82 82.33 7.10 0.04 0.05 0.04 54 Y H H 146.99 5.16 16.88 23.43 96.52 67.12 -66.80 -19.60 37.37 0.14 62.49 1.19 1.51 33.82 58.57 4.69 0.06 0.06 0.10 55 G C T 59.63 1.32 17.92 18.33 95.94 42.27 -86.15 -0.66 65.24 0.12 34.64 2.41 3.49 57.25 33.17 3.52 0.01 0.05 0.10 56 L C S 41.93 16.44 7.90 23.56 115.99 111.61 -80.66 138.18 98.42 0.50 1.08 45.20 51.83 1.39 0.82 0.22 0.00 0.12 0.42 57 P C C 92.15 2.93 16.00 19.45 110.56 -108.55 -66.92 145.82 93.23 1.00 5.76 66.43 10.97 15.97 3.12 2.32 0.00 0.45 0.74 58 G C C 47.65 5.12 14.17 20.43 109.90 11.54 75.41 -143.52 76.69 1.91 21.40 31.46 22.93 23.34 12.91 7.23 0.03 0.70 1.39 59 S C H 76.19 4.21 16.20 21.15 101.60 9.78 -79.11 -11.66 58.03 0.86 41.11 12.73 17.14 28.99 31.89 8.18 0.10 0.35 0.61 60 G H H 24.38 11.38 15.83 27.65 98.27 47.73 -55.16 -27.27 44.11 0.75 55.14 17.59 9.28 19.02 47.87 5.38 0.08 0.31 0.46 61 L H H 48.63 15.30 14.75 29.72 93.71 65.67 -65.13 -37.75 6.56 0.06 93.37 2.73 1.12 2.85 91.33 1.90 0.00 0.03 0.02 62 G H H 35.87 4.07 19.79 24.22 92.43 54.36 -63.08 -41.09 2.95 0.04 97.01 1.10 0.40 1.48 95.71 1.28 0.00 0.02 0.01 63 R H H 116.27 5.16 20.65 26.15 92.34 50.88 -65.95 -40.31 1.29 0.02 98.69 0.51 0.17 0.62 97.88 0.82 0.00 0.01 0.00 64 I H H 24.13 18.29 16.50 34.64 92.32 50.19 -64.82 -42.27 0.56 0.01 99.43 0.18 0.06 0.28 99.22 0.26 0.00 0.00 0.00 65 E H H 78.85 9.34 20.44 30.17 91.56 51.35 -62.99 -41.87 0.33 0.00 99.66 0.08 0.03 0.18 99.61 0.11 0.00 0.00 0.00 66 N H H 88.52 2.22 23.16 23.81 91.66 49.40 -64.50 -41.29 0.45 0.00 99.55 0.07 0.03 0.27 99.53 0.10 0.00 0.00 0.00 67 A H H 23.44 10.74 18.50 30.73 91.67 50.43 -64.26 -42.00 0.52 0.00 99.48 0.07 0.03 0.33 99.45 0.10 0.00 0.00 0.00 68 M H H 39.44 15.49 16.97 32.60 91.63 50.65 -63.76 -41.69 0.63 0.00 99.36 0.11 0.05 0.39 99.29 0.16 0.00 0.00 0.00 69 N H H 84.14 3.48 20.57 24.01 91.66 50.60 -64.36 -40.27 1.32 0.01 98.68 0.21 0.09 0.88 98.53 0.29 0.00 0.00 0.00 70 E H H 100.18 3.13 19.55 22.53 92.09 50.08 -65.83 -40.51 2.59 0.01 97.40 0.31 0.18 1.93 96.98 0.59 0.00 0.00 0.00 71 I H H 44.82 11.40 14.87 27.41 93.01 48.96 -66.33 -39.20 5.16 0.04 94.80 0.86 0.53 3.57 94.14 0.87 0.01 0.02 0.01 72 S H H 45.81 7.78 14.16 23.42 93.09 53.54 -67.20 -32.03 18.72 0.34 80.94 5.57 2.65 10.61 79.21 1.63 0.02 0.15 0.15 73 R H H 150.61 2.36 14.24 17.14 94.80 55.38 -73.09 -25.56 38.07 0.98 60.95 13.84 5.14 20.02 57.10 2.94 0.04 0.48 0.43 74 R H H 140.93 4.04 11.20 16.77 99.11 66.43 -78.76 -19.76 48.06 1.77 50.17 21.20 9.23 18.72 46.29 2.95 0.04 0.82 0.75 75 E C H 129.02 3.42 10.49 15.38 100.78 60.65 -82.29 -11.32 62.91 2.32 34.77 29.82 13.51 19.72 32.11 2.71 0.03 0.99 1.10 76 N C C 109.87 3.00 9.81 14.52 110.25 31.84 -105.40 99.45 99.20 0.35 0.45 91.53 6.28 1.42 0.36 0.08 0.00 0.17 0.16 77 P C C 90.83 4.67 11.19 17.72 108.05 -150.37 -68.63 137.97 99.95 0.03 0.02 99.79 0.13 0.06 0.01 0.00 0.00 0.01 0.00