# 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 95.84 8.13 12.25 21.62 117.52 -145.41 -93.58 136.83 99.92 0.07 0.01 99.80 0.13 0.02 0.00 0.00 0.00 0.03 0.01 1 P C C 89.34 4.24 11.81 17.80 113.54 -109.59 -67.17 148.06 88.84 1.30 9.87 85.41 0.85 4.07 5.93 2.42 0.00 0.63 0.69 2 R C C 153.38 4.56 9.95 16.36 109.48 -116.88 -81.85 126.18 77.42 4.71 17.87 58.43 9.76 8.62 10.13 8.08 0.01 2.57 2.41 3 S C C 60.09 5.76 11.59 18.86 115.35 -151.44 -95.61 145.34 63.94 7.48 28.58 48.51 8.39 6.78 12.33 16.44 0.01 4.56 2.97 4 L C G 97.41 8.37 10.58 19.88 98.78 -128.52 -77.12 -15.35 47.25 6.18 46.56 21.99 11.43 16.01 13.65 31.00 0.12 4.06 1.75 5 K C G 140.19 3.64 13.12 18.19 101.99 70.14 -83.76 -0.73 48.92 8.02 43.05 20.32 11.49 19.68 12.60 28.18 0.23 5.26 2.25 6 K C C 135.30 3.88 13.09 18.52 109.64 79.84 -92.00 104.25 61.19 7.88 30.93 25.46 20.43 17.60 10.47 18.19 0.26 4.25 3.34 7 G C C 31.10 7.98 12.25 21.55 130.57 29.49 147.54 176.91 93.21 4.14 2.64 46.43 34.83 12.09 0.56 2.12 0.00 2.31 1.66 8 P C S 87.88 5.81 15.32 22.10 100.31 -44.44 -72.03 -4.83 94.03 3.37 2.60 27.34 36.70 30.39 0.43 2.12 0.00 2.20 0.82 9 F C C 96.42 10.64 15.34 26.34 107.48 59.39 -93.28 50.21 68.68 27.78 3.53 35.12 18.99 16.77 1.15 2.54 0.04 18.74 6.64 10 I C C 46.79 16.29 13.02 29.21 117.78 127.69 -99.39 128.69 69.71 28.78 1.51 58.23 9.11 1.02 1.14 0.56 0.00 18.21 11.71 11 D C C 58.57 9.47 16.98 27.66 107.73 -131.26 -85.63 113.49 93.62 5.00 1.37 92.67 1.26 0.47 0.98 0.21 0.00 3.42 0.99 12 L H H 89.49 7.47 15.78 24.78 93.86 -164.75 -66.34 -32.31 10.64 0.09 89.27 4.13 1.21 5.21 87.33 2.02 0.01 0.05 0.03 13 H H H 111.73 3.00 19.43 22.39 91.51 57.68 -64.48 -38.96 5.18 0.04 94.78 1.11 0.48 3.43 92.57 2.37 0.01 0.02 0.01 14 L H H 22.16 15.29 15.81 31.91 92.26 51.36 -65.46 -41.02 1.53 0.01 98.46 0.39 0.14 0.91 96.34 2.21 0.00 0.01 0.00 15 L H H 35.45 14.86 16.37 31.68 91.81 52.54 -63.23 -42.16 0.70 0.01 99.29 0.18 0.06 0.39 98.70 0.67 0.00 0.00 0.00 16 K H H 116.29 2.28 22.64 23.72 91.61 50.71 -63.94 -41.48 0.63 0.01 99.36 0.13 0.05 0.39 99.20 0.22 0.00 0.00 0.00 17 K H H 90.40 6.20 21.19 27.79 91.63 49.66 -64.91 -41.39 0.52 0.00 99.48 0.10 0.04 0.33 99.41 0.11 0.00 0.00 0.00 18 V H H 12.10 19.45 15.59 35.41 91.86 50.06 -64.20 -42.86 0.24 0.00 99.76 0.05 0.02 0.13 99.76 0.04 0.00 0.00 0.00 19 E H H 86.44 6.09 20.81 27.47 91.39 50.95 -63.18 -41.77 0.19 0.00 99.80 0.03 0.01 0.12 99.81 0.04 0.00 0.00 0.00 20 K H H 108.08 2.03 21.56 21.98 91.71 49.72 -64.38 -41.47 0.31 0.00 99.69 0.04 0.02 0.21 99.66 0.06 0.00 0.00 0.00 21 A H H 14.09 10.96 13.51 27.00 91.45 50.99 -63.51 -41.40 0.50 0.00 99.50 0.08 0.03 0.32 99.47 0.10 0.00 0.00 0.00 22 V H H 60.56 10.50 13.49 24.79 92.43 49.68 -64.88 -40.95 1.21 0.01 98.79 0.16 0.08 0.85 98.66 0.25 0.00 0.00 0.00 23 E H H 150.89 0.98 15.45 15.53 91.87 50.46 -66.80 -32.85 5.15 0.02 94.83 0.26 0.27 4.39 94.76 0.31 0.01 0.01 0.01 24 S C H 76.16 2.00 13.00 15.40 94.52 48.21 -86.85 -4.94 50.64 0.09 49.27 1.28 2.78 44.17 50.89 0.76 0.02 0.02 0.07 25 G C T 60.13 1.63 13.02 15.51 94.30 -114.53 77.00 14.77 98.98 0.08 0.94 11.17 8.29 79.68 0.48 0.30 0.00 0.04 0.03 26 D C C 70.83 6.55 11.04 19.41 112.20 136.08 -89.57 122.34 98.59 0.52 0.89 78.67 15.85 3.90 0.23 0.75 0.00 0.23 0.38 27 K C C 140.33 5.38 13.85 21.11 98.38 -167.95 -93.59 -1.35 98.69 0.69 0.62 76.91 18.82 2.79 0.11 0.63 0.00 0.33 0.41 28 K C C 117.58 3.72 18.45 23.32 119.18 112.58 -87.90 141.51 98.95 1.01 0.04 64.22 34.74 0.22 0.01 0.03 0.00 0.59 0.20 29 P C C 56.20 12.69 16.40 29.43 115.93 -103.62 -65.48 148.50 96.30 3.68 0.02 91.44 4.82 0.15 0.00 0.02 0.00 3.34 0.23 30 L E E 22.32 21.03 14.38 35.52 115.28 -121.93 -90.60 133.41 16.41 83.55 0.04 15.47 0.56 0.03 0.02 0.02 0.00 75.75 8.15 31 R E E 125.14 6.81 23.67 31.33 116.93 -144.43 -97.92 132.37 15.79 84.18 0.03 15.31 0.59 0.04 0.01 0.02 0.00 82.26 1.77 32 T E E 24.87 21.18 13.17 33.53 124.92 -166.34 -113.75 142.84 47.38 52.40 0.21 43.60 2.49 0.37 0.05 0.16 0.00 51.45 1.89 33 W C C 129.36 7.26 20.43 28.34 103.43 -163.32 -98.32 -7.91 77.54 21.58 0.88 42.74 30.90 4.81 0.15 0.83 0.00 18.78 1.79 34 S C C 36.91 12.51 16.20 29.29 122.26 52.78 -114.51 138.70 87.64 10.04 2.33 51.24 28.38 8.25 0.41 2.16 0.00 7.70 1.86 35 R C C 127.80 10.71 16.30 27.37 98.90 -168.15 -92.41 -13.63 81.19 5.73 13.08 32.57 28.32 21.14 1.44 11.39 0.00 3.86 1.28 36 R C S 148.01 4.39 20.20 25.15 99.63 63.17 -90.15 13.13 80.73 6.13 13.13 26.41 33.24 22.08 1.16 11.66 0.01 4.27 1.17 37 S C C 25.12 18.15 13.62 31.41 118.68 99.94 -94.29 145.78 70.29 16.55 13.16 48.97 15.17 6.37 1.24 11.89 0.00 15.11 1.24 38 T E E 60.77 8.71 23.17 32.45 120.69 -142.68 -109.25 135.19 37.47 61.23 1.30 32.16 4.12 0.87 0.53 0.92 0.01 54.64 6.75 39 I E E 32.68 20.74 15.48 36.19 116.99 -150.03 -101.67 126.69 25.05 74.82 0.13 23.49 1.17 0.07 0.11 0.06 0.00 51.57 23.54 40 F C C 59.48 11.40 18.91 31.29 112.52 -141.36 -88.70 123.01 98.30 1.67 0.02 98.03 0.64 0.03 0.00 0.01 0.00 1.17 0.12 41 P H G 72.45 9.60 16.35 27.09 91.54 -130.68 -59.16 -31.79 13.51 0.19 86.30 1.29 1.18 9.33 1.15 86.87 0.00 0.15 0.01 42 N H G 104.47 4.32 20.35 25.73 89.46 64.12 -68.50 -15.56 12.79 0.11 87.10 0.36 0.73 10.66 0.88 87.28 0.00 0.08 0.01 43 M H G 14.28 21.54 13.94 36.03 94.44 57.83 -94.41 -6.00 11.67 0.16 88.16 1.06 1.05 7.64 0.85 89.27 0.00 0.12 0.01 44 I C T 60.27 14.33 16.04 30.92 112.93 116.28 -62.92 133.22 96.50 1.74 1.77 0.67 1.63 95.22 0.23 0.84 0.00 0.66 0.75 45 G C T 43.22 4.22 22.18 27.21 94.09 22.65 84.48 -2.93 99.35 0.35 0.29 0.33 1.83 97.35 0.01 0.19 0.00 0.26 0.02 46 L C C 25.53 18.00 15.59 34.08 119.93 129.17 -78.48 147.10 94.06 5.92 0.03 88.79 4.80 0.12 0.00 0.03 0.00 6.10 0.15 47 T E E 44.24 10.32 24.86 35.92 118.12 -138.12 -105.10 129.71 1.35 98.65 0.00 1.34 0.04 0.00 0.00 0.00 0.00 98.46 0.16 48 I E E 4.91 25.02 18.08 43.73 124.20 -170.03 -119.72 136.54 0.10 99.90 0.00 0.09 0.00 0.00 0.00 0.00 0.00 99.90 0.00 49 A E E 17.62 12.57 25.48 39.08 118.50 -148.97 -102.92 132.42 0.09 99.91 0.00 0.09 0.00 0.00 0.00 0.00 0.00 99.90 0.00 50 V E E 7.86 21.94 19.07 41.37 120.72 -164.59 -115.89 129.81 0.34 99.66 0.00 0.30 0.01 0.00 0.00 0.00 0.00 99.67 0.01 51 H E E 44.60 12.20 18.86 32.35 114.72 -154.42 -104.69 122.09 5.93 94.02 0.04 4.77 0.71 0.14 0.01 0.03 0.00 94.18 0.16 52 N E E 60.40 9.56 16.40 27.50 102.29 176.37 -109.73 29.98 39.63 59.75 0.63 26.45 9.07 4.48 0.07 0.62 0.00 58.61 0.70 53 G C T 44.26 5.99 15.01 21.81 98.76 -84.71 76.34 -16.61 98.72 0.49 0.78 1.80 33.03 63.86 0.02 0.87 0.00 0.33 0.10 54 R C T 178.69 1.49 15.19 16.54 103.28 32.35 -99.44 -20.43 98.74 0.61 0.65 1.95 37.82 59.02 0.02 0.68 0.00 0.41 0.10 55 Q E E 117.30 2.21 16.87 19.46 126.51 38.60 -125.53 146.01 27.43 72.47 0.10 19.22 8.06 0.70 0.01 0.09 0.00 71.23 0.69 56 H E E 87.70 14.67 11.39 25.69 120.21 -133.50 -102.20 134.00 6.86 93.13 0.00 6.24 0.31 0.02 0.00 0.00 0.00 93.20 0.23 57 V E E 50.71 9.23 18.39 29.20 120.64 -168.66 -122.34 126.74 2.31 97.69 0.00 2.06 0.07 0.00 0.00 0.00 0.00 97.84 0.02 58 P E E 72.59 8.91 19.81 29.33 114.77 -120.37 -69.95 139.69 1.64 98.36 0.00 1.51 0.03 0.00 0.00 0.00 0.00 98.46 0.01 59 V E E 16.70 20.51 15.33 35.80 127.64 -174.39 -127.58 141.69 0.66 99.34 0.00 0.63 0.01 0.00 0.00 0.00 0.00 99.35 0.02 60 F E E 94.84 7.35 25.13 32.97 116.06 -133.89 -96.03 130.29 1.21 98.79 0.00 1.13 0.03 0.00 0.00 0.00 0.00 98.77 0.07 61 V E E 7.93 24.55 12.99 38.10 114.08 -143.21 -95.25 124.91 23.38 76.60 0.02 22.91 0.42 0.02 0.01 0.01 0.00 76.12 0.52 62 T C C 46.45 5.90 22.68 28.87 134.34 170.22 -130.33 171.39 95.00 4.87 0.14 91.97 3.25 0.15 0.06 0.06 0.00 4.15 0.37 63 D H G 96.59 7.93 15.16 24.43 91.00 -96.40 -60.45 -31.71 19.60 0.15 80.25 1.07 2.32 16.10 11.23 69.13 0.00 0.10 0.04 64 E H G 144.11 1.65 19.40 20.68 90.67 60.19 -70.33 -21.31 18.26 0.10 81.64 0.66 1.32 16.24 11.42 70.27 0.00 0.06 0.03 65 M H G 30.15 17.77 13.60 31.48 96.11 48.46 -96.01 -7.27 16.96 0.30 82.74 1.73 1.84 13.34 12.66 70.12 0.00 0.21 0.09 66 V C T 42.25 17.27 13.74 30.92 112.72 112.92 -65.55 134.02 71.63 5.33 23.03 5.49 5.83 59.22 15.78 7.94 0.25 3.07 2.42 67 G C T 37.15 7.65 20.08 28.62 95.35 21.37 83.31 -3.96 82.39 1.13 16.49 6.21 6.82 68.78 9.98 6.94 0.02 0.69 0.56 68 H C C 77.75 10.91 17.41 28.87 102.62 117.52 -78.07 -32.41 59.82 3.78 36.40 34.59 10.60 15.12 21.28 14.49 0.04 1.95 1.91 69 K H H 99.68 9.84 20.37 29.95 98.88 -42.94 -69.78 -33.63 43.52 9.25 47.22 12.95 9.72 21.14 26.14 19.03 1.51 4.76 4.77 70 L H G 49.39 16.76 16.18 32.11 97.67 33.11 -72.79 -16.39 44.18 5.02 50.80 8.00 9.44 25.28 25.00 25.41 1.33 2.79 2.75 71 G H G 27.86 11.96 17.34 29.16 97.17 40.87 -7.37 -21.88 47.53 2.93 49.54 11.67 9.84 26.52 16.50 32.26 0.20 1.49 1.51 72 E C T 102.44 7.33 18.29 26.28 93.87 69.98 -74.06 -22.05 57.31 3.08 39.61 11.51 11.78 33.68 11.65 27.92 0.15 1.79 1.52 73 F C T 98.34 10.01 15.78 26.26 99.74 44.85 -98.49 0.72 63.01 6.17 30.82 17.18 16.37 31.02 9.38 19.54 0.23 3.29 2.99 74 A C C 36.75 12.84 12.06 25.61 118.42 98.18 -93.11 139.00 90.92 5.44 3.64 47.07 40.76 3.43 1.86 1.66 0.00 2.71 2.52 75 P C C 82.58 6.23 14.32 21.83 107.71 -114.99 -67.99 139.33 87.91 4.60 7.49 57.91 16.52 13.35 2.36 5.29 0.00 2.99 1.56 76 T C C 84.85 6.61 12.45 20.38 109.45 -126.84 -93.66 110.29 81.96 10.30 7.74 54.77 14.71 12.19 2.49 5.46 0.01 6.67 3.71 77 R C C 140.68 6.17 12.11 19.78 111.88 -152.98 -97.61 111.43 79.63 14.26 6.11 57.71 15.86 5.46 3.00 3.36 0.01 9.91 4.69 78 T C C 87.89 4.66 12.41 18.82 117.29 -143.96 -104.61 131.63 79.20 15.06 5.74 59.46 14.54 4.85 3.21 2.69 0.00 11.45 3.81 79 Y C C 132.34 7.40 10.27 19.05 114.26 -149.10 -92.75 126.94 74.50 15.14 10.36 55.12 12.51 6.06 7.41 3.41 0.02 10.58 4.90 80 R C C 159.00 3.16 11.82 16.59 111.11 -160.34 -96.07 106.78 72.32 8.22 19.46 42.34 14.95 15.31 14.01 5.56 0.03 5.36 2.45 81 G C C 44.49 4.51 12.66 18.48 112.73 4.58 90.84 -153.18 69.15 4.26 26.59 30.10 19.83 20.17 18.38 7.50 0.06 2.38 1.57 82 H C C 112.40 5.63 11.54 18.52 105.93 -43.63 -82.18 56.53 59.62 4.62 35.76 34.23 13.68 12.52 26.44 8.67 0.06 2.54 1.87 83 A C H 59.94 5.00 12.55 18.96 100.72 73.11 -71.53 -27.86 51.05 2.97 45.98 31.42 10.77 9.86 36.13 9.05 0.03 1.62 1.13 84 A H H 59.98 4.75 12.51 18.75 96.92 60.73 -69.63 -31.11 46.77 1.93 51.30 27.78 10.49 9.66 41.79 8.50 0.03 1.03 0.73 85 D H H 78.30 5.30 11.80 18.61 97.71 57.29 -74.20 -26.57 48.62 1.56 49.82 32.60 8.06 8.52 42.02 7.37 0.01 0.83 0.60 86 K H H 121.47 3.90 11.86 17.17 97.73 61.41 -71.18 -29.42 43.35 1.56 55.09 27.80 7.96 8.92 47.02 6.85 0.02 0.83 0.59 87 K H H 130.51 2.69 11.83 15.66 97.44 58.41 -72.88 -29.05 43.13 1.99 54.88 26.94 8.01 9.68 46.32 7.19 0.03 1.07 0.76 88 A H H 64.68 4.54 9.09 15.35 98.64 62.79 -74.81 -23.14 48.76 1.99 49.26 28.82 9.20 11.83 40.44 7.84 0.03 1.06 0.78 89 K C C 143.19 2.55 9.18 13.28 101.83 65.27 -84.34 -0.96 59.76 2.56 37.68 33.29 11.34 15.83 29.88 7.22 0.03 1.32 1.10 90 K C C 149.47 2.12 8.40 12.17 108.12 87.91 -84.95 106.93 76.52 1.86 21.62 59.85 2.71 13.92 17.96 3.60 0.00 0.94 1.01 91 K C C 149.31 2.49 10.31 14.45 108.70 -134.00 -85.04 112.99 99.85 0.07 0.09 99.60 0.14 0.16 0.05 0.01 0.00 0.03 0.01