# 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 41.24 16.54 16.93 33.31 123.71 -169.42 -113.39 137.86 96.65 3.35 0.00 96.21 0.13 0.01 0.00 0.00 0.00 3.63 0.02 1 Q E E 82.81 8.26 21.26 30.02 118.27 -142.83 -102.28 130.65 7.84 92.15 0.01 8.05 0.11 0.01 0.00 0.00 0.00 91.59 0.24 2 I E E 11.22 22.06 14.93 37.23 124.17 -166.67 -118.63 136.03 1.32 98.67 0.00 1.29 0.04 0.00 0.00 0.00 0.00 98.64 0.02 3 F E E 57.98 8.80 24.51 34.34 117.06 -150.31 -104.86 128.45 0.29 99.71 0.00 0.28 0.00 0.00 0.00 0.00 0.00 99.71 0.00 4 V E E 5.94 23.83 16.31 40.59 123.26 -169.12 -117.62 134.00 0.29 99.71 0.00 0.26 0.01 0.00 0.00 0.00 0.00 99.73 0.00 5 K E E 81.43 7.54 23.61 31.67 116.02 -145.88 -102.47 124.20 1.62 98.37 0.01 1.43 0.08 0.01 0.00 0.00 0.00 98.38 0.09 6 T C C 14.03 18.21 13.35 31.91 124.28 -150.39 -90.24 166.49 66.32 33.59 0.09 64.85 0.84 0.13 0.02 0.05 0.00 33.11 1.00 7 L C T 89.84 9.74 14.94 25.58 91.55 -100.16 -63.92 -23.16 98.20 1.11 0.69 1.09 6.97 90.21 0.02 0.69 0.00 0.89 0.13 8 T C T 85.59 4.04 15.12 20.17 93.98 58.21 -87.18 -0.25 99.10 0.23 0.67 0.73 7.02 91.36 0.02 0.68 0.00 0.14 0.04 9 G C S 49.81 3.21 14.89 19.19 98.39 -100.81 88.64 4.43 98.86 0.75 0.39 15.23 82.00 1.79 0.03 0.30 0.00 0.44 0.20 10 K C C 101.57 5.34 14.62 21.78 117.96 134.06 -79.71 143.37 96.84 3.14 0.02 95.38 1.57 0.10 0.00 0.01 0.00 2.74 0.19 11 T E E 75.63 9.58 14.80 25.77 123.57 -149.20 -117.02 137.03 2.07 97.93 0.00 1.96 0.07 0.00 0.00 0.00 0.00 97.78 0.19 12 I E E 30.71 15.48 15.68 32.14 124.21 -170.32 -122.84 135.67 0.17 99.83 0.00 0.16 0.00 0.00 0.00 0.00 0.00 99.84 0.00 13 T E E 73.28 8.49 20.18 29.74 120.96 -154.03 -111.65 132.73 0.27 99.73 0.00 0.26 0.00 0.00 0.00 0.00 0.00 99.73 0.01 14 L E E 20.38 19.55 15.01 34.66 127.20 -175.64 -127.24 139.29 2.36 97.64 0.00 2.34 0.05 0.00 0.00 0.00 0.00 97.55 0.06 15 E E E 116.82 4.72 24.01 29.59 114.62 -139.27 -98.00 126.54 12.66 87.33 0.01 12.12 0.44 0.02 0.00 0.00 0.00 87.29 0.11 16 V C C 11.21 23.24 12.26 35.14 131.73 176.21 -132.38 151.42 50.99 48.99 0.01 51.10 0.98 0.03 0.00 0.01 0.00 45.38 2.50 17 E C C 100.07 3.77 24.46 27.61 116.49 -121.39 -85.57 143.19 98.99 1.00 0.01 99.04 0.22 0.02 0.00 0.00 0.00 0.62 0.09 18 P C T 47.02 17.99 13.17 30.68 91.18 -115.34 -60.52 -24.96 99.67 0.12 0.22 0.36 2.07 97.30 0.01 0.17 0.00 0.07 0.02 19 S C T 81.62 2.47 20.86 23.49 92.48 58.11 -89.26 -3.18 99.72 0.09 0.20 0.42 1.92 97.42 0.01 0.18 0.00 0.05 0.01 20 D C C 31.35 13.95 14.34 29.69 116.99 116.79 -70.52 143.63 98.51 1.39 0.10 71.93 26.70 0.19 0.02 0.07 0.00 0.72 0.37 21 T E B 45.10 7.09 24.05 31.57 123.13 -127.67 -86.69 160.70 14.16 85.76 0.08 10.48 0.27 0.01 0.07 0.00 0.00 3.78 85.41 22 I H H 10.61 24.44 14.53 39.48 90.52 -111.65 -58.15 -39.48 1.93 0.02 98.05 0.22 0.21 1.41 97.74 0.40 0.01 0.01 0.00 23 E H H 107.40 5.91 22.30 28.97 91.07 54.98 -62.54 -40.66 0.75 0.00 99.25 0.07 0.04 0.54 99.09 0.25 0.00 0.00 0.00 24 N H H 82.01 3.89 24.28 27.89 92.02 48.75 -65.91 -40.01 0.46 0.00 99.54 0.09 0.04 0.28 99.29 0.29 0.00 0.00 0.00 25 V H H 4.76 23.02 17.46 40.74 91.75 49.93 -64.47 -43.52 0.30 0.00 99.70 0.06 0.02 0.16 99.64 0.11 0.00 0.00 0.00 26 K H H 54.99 17.63 19.89 36.31 91.42 52.23 -61.96 -42.64 0.24 0.00 99.75 0.04 0.01 0.14 99.76 0.05 0.00 0.00 0.00 27 A H H 52.89 2.89 23.22 25.32 91.33 50.74 -63.17 -42.41 0.52 0.00 99.48 0.05 0.02 0.37 99.46 0.10 0.00 0.00 0.00 28 K H H 86.14 5.88 21.95 28.17 91.99 49.27 -65.45 -41.07 1.46 0.01 98.53 0.13 0.08 1.13 98.48 0.17 0.00 0.00 0.00 29 I H H 7.25 21.09 13.89 35.49 91.94 49.35 -64.84 -42.77 3.26 0.06 96.68 0.47 0.43 2.25 96.53 0.27 0.01 0.02 0.02 30 Q H H 74.79 10.23 15.54 26.43 92.31 50.66 -64.10 -41.15 6.83 0.15 93.02 1.55 0.89 4.19 92.73 0.50 0.02 0.06 0.06 31 D H H 118.96 0.86 17.52 16.58 93.73 46.84 -69.17 -36.93 12.00 0.09 87.91 1.48 1.31 9.01 87.30 0.80 0.03 0.04 0.04 32 K H H 127.11 3.77 15.37 20.16 98.20 39.59 -80.41 -35.45 21.98 0.11 77.91 1.13 2.86 17.87 76.92 1.04 0.06 0.03 0.07 33 E H H 84.64 9.34 13.16 23.32 101.45 23.98 -104.09 -9.21 28.41 0.21 71.38 2.42 7.22 19.03 70.26 0.76 0.10 0.05 0.17 34 G C C 57.39 1.66 18.47 19.69 95.31 -117.48 76.13 16.27 99.75 0.09 0.16 69.55 11.05 19.16 0.06 0.08 0.00 0.04 0.06 35 I C C 27.70 16.68 9.53 26.50 116.92 144.67 -89.67 133.52 99.66 0.32 0.01 91.80 7.78 0.04 0.01 0.00 0.00 0.08 0.30 36 P C C 60.77 3.70 20.85 24.63 112.75 -109.63 -64.96 144.18 99.94 0.05 0.02 99.74 0.20 0.02 0.00 0.00 0.00 0.01 0.02 37 P H G 56.41 16.38 11.71 27.50 91.96 -119.77 -58.44 -35.27 11.78 0.08 88.14 1.25 1.03 6.97 0.45 90.24 0.00 0.05 0.01 38 D H G 115.02 2.09 18.99 21.42 90.85 61.98 -70.70 -13.89 11.82 0.14 88.04 0.67 0.95 8.22 0.43 89.63 0.00 0.09 0.01 39 Q H G 86.20 8.05 18.07 27.08 97.08 56.57 -96.38 0.49 11.94 0.50 87.55 2.32 1.71 5.93 0.48 89.15 0.00 0.39 0.02 40 Q C C 24.43 21.49 13.53 34.52 120.42 94.39 -96.55 138.47 53.59 45.75 0.66 46.38 7.20 0.47 0.19 0.49 0.00 43.42 1.86 41 R E E 95.64 9.00 26.03 35.42 128.21 -170.17 -127.93 140.79 7.78 92.15 0.07 7.93 0.25 0.03 0.03 0.03 0.00 90.93 0.79 42 L E E 6.71 24.64 17.55 42.70 116.67 -141.36 -100.62 128.56 2.42 97.55 0.02 2.06 0.22 0.01 0.01 0.01 0.00 97.65 0.05 43 I E E 33.90 11.09 23.81 36.06 125.24 -170.43 -120.15 137.76 0.93 99.05 0.02 0.78 0.09 0.02 0.00 0.01 0.00 99.05 0.05 44 F E E 28.39 19.55 14.90 34.20 120.10 -169.60 -124.92 123.95 1.67 98.25 0.07 1.06 0.45 0.18 0.02 0.04 0.00 97.73 0.51 45 A C T 60.85 9.41 15.72 26.25 93.67 -18.88 53.85 42.69 99.23 0.48 0.29 0.32 2.25 96.88 0.01 0.19 0.00 0.31 0.03 46 G C T 61.31 1.81 16.05 18.13 95.37 -47.88 80.73 2.84 99.70 0.12 0.17 0.40 2.75 96.61 0.01 0.14 0.00 0.08 0.01 47 K E E 118.69 3.77 15.71 21.30 123.63 105.83 -109.67 141.34 3.76 96.20 0.04 2.21 1.37 0.20 0.01 0.02 0.00 95.11 1.08 48 Q E E 114.50 5.61 16.78 24.17 114.48 -120.00 -78.54 133.58 5.85 94.13 0.02 5.15 0.48 0.05 0.01 0.01 0.00 93.31 0.99 49 L C C 18.81 22.12 8.98 30.04 115.69 -123.47 -82.08 136.29 79.06 20.90 0.04 78.27 0.89 0.08 0.00 0.02 0.00 20.11 0.62 50 E C C 128.21 2.49 20.91 23.15 118.59 -141.59 -95.64 142.44 98.91 1.01 0.07 98.09 0.83 0.21 0.01 0.04 0.00 0.53 0.30 51 D C T 98.17 7.67 13.92 22.89 108.01 -90.13 -61.52 131.78 99.30 0.27 0.44 1.17 3.90 94.28 0.05 0.35 0.00 0.14 0.10 52 G C T 51.89 3.61 17.81 22.18 96.25 21.36 86.51 -2.45 99.55 0.14 0.30 1.83 3.39 94.34 0.03 0.29 0.00 0.10 0.02 53 R C C 82.75 9.73 15.33 26.52 119.11 127.50 -78.60 146.44 96.03 3.87 0.10 78.00 18.09 0.27 0.02 0.09 0.00 2.45 1.06 54 T E B 38.36 8.85 20.93 30.81 122.90 -130.37 -89.46 157.34 14.59 85.33 0.08 10.46 0.44 0.02 0.06 0.01 0.00 7.01 81.99 55 L H G 9.80 24.60 12.83 37.72 91.25 -111.85 -59.71 -35.26 31.28 0.77 67.94 2.64 3.48 24.76 5.35 63.03 0.01 0.51 0.22 56 S H G 65.42 7.05 18.23 26.32 91.27 60.54 -65.09 -31.77 23.48 0.14 76.39 0.84 1.42 20.25 6.00 71.38 0.00 0.09 0.04 57 D H G 101.51 2.72 19.14 22.05 91.59 56.83 -71.97 -22.37 20.49 0.12 79.38 1.02 1.74 17.00 7.40 72.73 0.00 0.07 0.05 58 Y C G 50.54 17.15 12.79 29.57 99.06 52.80 -99.32 6.28 54.05 0.58 45.36 4.61 14.05 34.61 7.34 38.62 0.02 0.28 0.48 59 N C T 117.61 2.50 22.44 24.84 95.15 -121.53 59.05 42.26 95.79 1.48 2.73 23.28 6.46 66.47 0.66 1.81 0.00 0.84 0.48 60 I C C 13.66 24.45 8.71 32.05 115.11 171.00 -83.96 132.29 91.26 8.26 0.49 89.05 1.97 0.31 0.24 0.15 0.00 2.98 5.29 61 Q C C 104.03 3.26 21.85 25.00 124.94 -162.53 -110.47 160.21 95.72 3.71 0.58 94.15 1.27 0.59 0.19 0.22 0.00 1.85 1.72 62 K C T 128.39 6.91 15.97 23.95 105.99 -86.50 -64.17 132.39 94.15 2.84 3.01 2.61 12.75 79.21 0.36 2.39 0.00 2.23 0.44 63 E C T 134.68 3.54 18.94 22.98 95.75 19.32 45.28 12.25 94.42 2.80 2.78 3.94 10.90 79.24 0.23 2.59 0.00 2.91 0.19 64 S C C 22.58 15.05 13.68 29.49 117.87 131.97 -78.41 149.54 91.17 7.97 0.87 73.36 16.25 1.20 0.11 0.88 0.00 7.64 0.56 65 T E E 55.66 9.09 22.78 32.48 120.53 -138.75 -111.48 134.53 17.58 82.31 0.11 16.71 0.88 0.13 0.03 0.07 0.00 81.46 0.72 66 L E E 9.64 24.14 16.55 40.84 123.11 -166.11 -116.61 134.71 1.98 98.00 0.02 1.96 0.09 0.02 0.00 0.01 0.00 97.82 0.10 67 H E E 66.00 9.90 25.77 36.13 118.00 -155.42 -107.34 127.07 1.13 98.84 0.02 1.10 0.06 0.01 0.00 0.01 0.00 98.79 0.02 68 L E E 11.71 23.47 17.49 41.08 119.42 -163.16 -110.03 128.80 1.32 98.65 0.03 1.30 0.05 0.01 0.00 0.01 0.00 98.60 0.02 69 V E E 44.17 9.90 24.14 34.81 120.42 -166.02 -115.61 129.97 2.44 97.54 0.02 2.37 0.09 0.01 0.00 0.01 0.00 97.44 0.07 70 L E E 30.56 19.01 16.46 35.22 122.28 -162.57 -110.03 133.27 7.44 92.51 0.05 7.13 0.30 0.04 0.01 0.02 0.00 92.23 0.26 71 R E E 113.78 7.33 19.46 27.68 118.36 -153.83 -103.18 130.19 25.21 74.55 0.24 22.80 1.62 0.31 0.06 0.15 0.00 74.54 0.53 72 L C C 65.01 13.34 11.43 25.08 115.50 -142.35 -91.42 133.00 56.93 41.57 1.50 46.88 6.49 2.85 0.33 1.19 0.00 40.66 1.58 73 R C C 156.20 3.72 12.33 17.80 113.48 -127.10 -83.16 133.14 76.66 21.29 2.05 39.25 17.45 21.30 0.34 1.85 0.01 17.85 1.96 74 G C C 61.97 1.31 12.53 13.96 103.82 10.92 80.50 -1.28 92.83 5.81 1.37 57.29 11.26 24.52 0.16 1.24 0.00 4.63 0.90 75 C C C 77.75 7.55 11.29 19.78 108.64 81.88 -93.17 82.19 99.87 0.12 0.01 99.75 0.12 0.05 0.00 0.00 0.00 0.07 0.01