# 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 H C C 113.88 7.15 13.98 22.45 117.26 -161.87 -102.21 129.71 99.75 0.23 0.02 99.61 0.18 0.05 0.01 0.00 0.00 0.10 0.04 1 F C C 124.90 6.13 12.32 20.03 117.81 -156.48 -104.36 132.09 95.46 2.90 1.64 93.27 1.20 1.55 0.63 0.57 0.00 1.59 1.20 2 A C C 59.37 8.66 11.83 21.56 112.25 -119.56 -72.61 144.21 88.97 4.34 6.68 65.91 10.74 12.17 1.67 5.07 0.00 2.74 1.71 3 A C C 58.89 9.19 13.45 23.49 107.79 -133.02 -84.34 97.24 86.09 5.65 8.25 55.66 16.07 14.05 1.45 7.22 0.00 3.33 2.22 4 D C C 95.01 5.76 18.74 25.16 101.78 -124.48 -87.62 8.77 81.59 8.88 9.52 36.78 28.65 16.98 1.53 7.76 0.01 5.34 2.96 5 C C C 33.18 16.47 15.02 31.29 111.67 83.52 -97.36 40.34 74.15 19.32 6.53 34.67 24.88 15.26 1.34 5.15 0.04 11.22 7.43 6 C C C 28.19 17.27 14.33 31.64 116.72 68.97 -95.87 132.18 71.19 26.77 2.04 52.21 14.38 4.52 0.61 1.67 0.00 16.91 9.69 7 T C C 78.98 7.48 18.70 27.02 99.30 -169.95 -89.79 -19.17 76.92 22.21 0.87 44.90 26.92 5.35 0.15 0.82 0.00 19.68 2.18 8 S C E 58.27 5.23 21.19 27.10 133.82 13.26 -141.27 152.85 55.19 43.85 0.95 36.53 14.66 4.36 0.17 0.92 0.00 41.75 1.63 9 Y E E 95.32 16.76 13.09 28.96 127.76 -159.84 -128.31 143.40 44.68 54.98 0.34 41.42 2.54 0.50 0.12 0.25 0.00 50.23 4.95 10 I E C 63.98 9.57 16.32 27.32 122.81 -158.15 -117.85 137.05 47.02 52.81 0.17 45.99 1.26 0.21 0.07 0.10 0.00 44.88 7.48 11 S C C 78.30 6.05 15.53 23.39 103.35 -150.92 -93.92 17.21 78.19 21.71 0.11 55.06 21.77 0.71 0.02 0.10 0.00 21.32 1.02 12 Q C S 92.26 5.43 17.86 24.58 127.89 102.64 -119.02 151.40 81.56 18.38 0.06 33.52 47.66 0.62 0.01 0.06 0.00 17.39 0.75 13 S C C 70.84 6.84 19.27 27.17 115.15 -105.80 -76.23 139.78 79.49 20.49 0.03 78.53 1.65 0.09 0.01 0.02 0.00 17.96 1.74 14 I C C 8.66 24.46 11.12 35.81 116.72 -136.85 -96.20 128.20 73.24 26.75 0.01 74.54 0.74 0.02 0.00 0.01 0.00 20.64 4.06 15 P C C 58.30 4.81 23.36 28.35 112.08 -113.19 -66.27 140.39 71.85 28.11 0.04 73.90 0.33 0.02 0.01 0.02 0.00 23.36 2.36 16 C H G 50.17 16.88 12.89 29.32 91.90 -126.31 -60.17 -30.45 6.88 0.20 92.92 0.63 0.73 4.30 0.51 93.65 0.00 0.17 0.00 17 S H G 84.77 2.07 20.94 23.11 90.07 65.84 -68.41 -17.22 6.17 0.15 93.68 0.29 0.50 4.36 0.41 94.32 0.00 0.12 0.00 18 L H G 35.50 15.57 16.12 32.19 94.32 58.62 -89.35 -8.60 6.55 0.30 93.15 0.55 0.73 4.05 0.42 93.96 0.00 0.28 0.00 19 M E E 13.89 24.08 11.45 35.23 113.01 96.52 -85.94 123.46 5.38 94.44 0.18 5.04 0.47 0.07 0.10 0.07 0.00 92.78 1.45 20 K E E 111.37 4.99 21.53 27.33 100.37 177.31 -95.64 -31.59 6.24 93.68 0.07 3.70 2.00 0.51 0.01 0.05 0.00 93.62 0.11 21 S E E 43.62 5.97 24.32 31.11 143.97 -5.62 -162.67 161.46 5.43 94.51 0.05 2.60 1.89 0.62 0.01 0.04 0.00 94.79 0.05 22 Y E E 55.15 22.51 13.37 34.60 132.65 -156.46 -140.04 144.21 5.55 94.43 0.02 5.07 0.22 0.02 0.00 0.01 0.00 94.63 0.05 23 F E E 83.34 7.85 23.12 31.65 130.73 -174.25 -135.82 144.59 1.34 98.65 0.01 1.22 0.08 0.01 0.01 0.00 0.00 98.47 0.21 24 E E E 90.04 12.60 16.66 29.27 114.56 -124.06 -85.52 129.56 7.71 92.26 0.03 7.38 0.34 0.04 0.01 0.01 0.00 91.81 0.41 25 T C C 52.57 11.69 14.22 26.54 105.86 -170.77 -94.42 -18.67 75.83 23.93 0.25 65.99 7.43 0.73 0.04 0.22 0.00 24.87 0.71 26 S C C 59.24 6.40 14.18 21.82 123.38 -18.50 -125.11 148.16 91.10 7.92 0.98 66.07 20.16 4.72 0.14 1.13 0.00 6.16 1.61 27 S C T 88.20 2.83 13.02 17.21 97.36 -134.19 -78.54 -9.24 95.79 2.02 2.19 9.26 33.43 52.84 0.13 2.51 0.00 1.30 0.54 28 E C T 140.18 2.54 13.93 17.22 98.34 61.02 -88.16 -3.17 96.48 1.55 1.96 13.86 28.46 53.76 0.13 2.34 0.00 0.97 0.47 29 C C C 32.77 15.00 7.50 21.90 121.91 85.50 -99.85 146.54 93.00 5.96 1.04 64.08 24.97 3.32 0.24 0.87 0.00 2.20 4.32 30 S C S 93.06 1.34 17.19 17.87 94.86 -138.56 -77.25 -15.10 98.66 1.20 0.15 16.54 79.60 2.74 0.02 0.10 0.00 0.61 0.38 31 K C S 96.98 7.26 16.54 25.09 125.78 53.51 -119.20 141.53 98.33 1.61 0.06 4.44 93.12 1.24 0.00 0.04 0.00 0.90 0.25 32 P C C 54.38 10.29 19.42 30.36 112.84 -105.46 -68.32 143.05 96.55 3.37 0.07 76.56 18.63 1.28 0.01 0.09 0.00 3.10 0.33 33 G E E 4.84 18.77 20.53 39.36 141.20 147.55 -154.81 173.60 21.73 78.24 0.03 18.34 2.47 0.20 0.00 0.03 0.00 78.51 0.44 34 V E E 7.02 21.41 22.95 44.74 124.99 -107.96 -120.35 138.81 0.53 99.47 0.00 0.52 0.01 0.00 0.00 0.00 0.00 99.45 0.01 35 I E E 15.16 17.68 25.36 43.35 117.99 -149.55 -106.22 128.01 0.13 99.87 0.00 0.11 0.00 0.00 0.00 0.00 0.00 99.89 0.00 36 F E E 7.39 22.73 20.60 43.54 126.67 -169.60 -119.20 143.86 0.03 99.97 0.00 0.02 0.00 0.00 0.00 0.00 0.00 99.97 0.00 37 L E E 32.71 11.42 23.02 35.93 116.23 -143.76 -105.87 126.58 0.07 99.93 0.00 0.08 0.00 0.00 0.00 0.00 0.00 99.91 0.01 38 T E E 12.95 16.78 14.16 31.97 124.78 -144.01 -86.62 170.20 46.80 53.14 0.06 46.60 0.44 0.06 0.01 0.03 0.00 52.20 0.65 39 K C T 125.41 7.58 14.83 23.65 91.45 -97.36 -63.26 -23.94 96.99 0.66 2.35 0.43 3.12 93.54 0.05 2.34 0.00 0.44 0.08 40 K C T 144.73 1.85 15.08 16.96 93.29 56.75 -86.73 2.38 97.20 0.13 2.68 0.36 2.64 94.14 0.06 2.70 0.00 0.06 0.03 41 G C S 47.66 4.27 14.16 19.71 96.82 -101.69 87.63 5.16 97.70 0.48 1.83 19.57 71.22 6.74 0.14 1.87 0.00 0.25 0.22 42 R C C 109.37 6.23 16.16 24.09 117.65 141.06 -81.76 142.35 95.09 4.88 0.03 94.54 0.90 0.10 0.01 0.02 0.00 4.09 0.33 43 Q E E 82.05 13.15 18.19 31.29 118.07 -133.38 -97.21 132.40 1.28 98.72 0.00 1.30 0.03 0.00 0.00 0.00 0.00 98.48 0.18 44 V E E 17.48 18.43 21.30 39.61 131.42 -176.92 -131.54 146.99 0.18 99.82 0.00 0.18 0.01 0.00 0.00 0.00 0.00 99.82 0.00 45 C E E 18.02 19.57 23.50 42.44 122.32 -138.41 -108.69 138.69 0.91 99.09 0.00 0.75 0.05 0.00 0.00 0.00 0.00 99.18 0.01 46 A E E 6.75 21.96 19.80 41.48 129.90 -160.14 -118.29 154.47 12.21 87.78 0.01 11.31 0.91 0.02 0.00 0.00 0.00 85.37 2.37 47 K C C 80.17 8.97 25.25 34.59 108.16 -106.31 -76.75 123.09 98.75 1.24 0.01 98.35 0.61 0.02 0.00 0.00 0.00 0.93 0.08 48 P C T 32.01 19.69 13.72 33.26 91.83 -143.97 -64.68 -18.05 99.68 0.08 0.24 2.85 3.75 93.08 0.01 0.25 0.00 0.04 0.02 49 S C T 86.79 1.97 20.28 22.09 92.67 63.54 -87.42 -4.13 99.72 0.04 0.24 1.96 4.97 92.77 0.01 0.26 0.00 0.02 0.01 50 G C S 17.85 12.68 11.15 25.22 116.90 110.54 -71.35 143.15 99.40 0.40 0.20 39.61 59.61 0.16 0.13 0.04 0.00 0.07 0.38 51 P H H 106.98 1.63 19.66 20.66 91.79 -118.23 -60.47 -35.41 7.45 0.01 92.54 0.39 1.07 5.76 92.27 0.50 0.01 0.00 0.00 52 G H H 19.82 10.87 17.67 29.67 92.25 54.10 -64.04 -39.78 4.10 0.01 95.89 0.24 0.35 3.50 95.39 0.51 0.01 0.00 0.00 53 V H H 4.90 23.81 13.85 37.83 91.99 49.87 -64.83 -42.71 0.48 0.00 99.52 0.07 0.04 0.30 99.40 0.19 0.00 0.00 0.00 54 Q H H 78.73 7.82 20.73 29.16 91.37 51.58 -62.79 -42.11 0.14 0.00 99.86 0.03 0.01 0.08 99.82 0.07 0.00 0.00 0.00 55 D H H 79.99 2.51 23.74 24.92 91.65 49.52 -64.23 -41.44 0.24 0.00 99.76 0.03 0.01 0.16 99.74 0.06 0.00 0.00 0.00 56 C H H 11.42 17.23 17.91 35.79 92.00 49.61 -64.06 -42.91 0.45 0.00 99.55 0.05 0.02 0.32 99.53 0.08 0.00 0.00 0.00 57 M H H 26.83 19.53 16.62 35.59 91.75 51.33 -63.42 -40.70 0.91 0.00 99.08 0.12 0.06 0.65 98.85 0.31 0.00 0.00 0.00 58 K H H 132.51 2.62 20.96 23.65 91.81 51.70 -65.25 -36.95 4.01 0.00 95.98 0.24 0.19 3.42 95.36 0.77 0.00 0.00 0.00 59 K H H 113.83 5.17 19.25 24.97 93.15 50.20 -72.51 -29.21 14.22 0.02 85.76 0.62 0.65 12.77 84.94 0.99 0.01 0.01 0.01 60 L H H 24.27 20.04 13.01 32.27 97.61 57.04 -81.47 -14.82 36.91 0.65 62.44 9.41 8.83 20.08 58.83 2.12 0.09 0.23 0.41 61 K C C 109.80 8.62 17.93 27.18 105.56 105.83 -70.62 105.70 59.83 2.67 37.50 39.25 10.27 10.35 26.58 10.97 0.02 1.32 1.23 62 P C C 77.62 7.32 16.10 24.37 101.38 45.13 -71.24 -8.24 58.17 3.94 37.89 36.26 7.87 13.40 24.42 14.20 0.02 2.48 1.35 63 Y C C 114.43 9.52 14.70 24.79 107.37 73.46 -90.83 75.36 55.49 7.05 37.46 33.11 9.95 12.32 23.98 13.78 0.08 4.45 2.33 64 S C C 54.11 9.86 13.87 24.47 108.59 92.74 -84.94 108.05 63.03 8.70 28.28 40.91 10.12 11.56 20.35 8.52 0.06 5.69 2.79 65 I C C 92.09 8.96 13.26 23.03 107.64 -155.69 -90.37 69.30 66.79 8.45 24.76 34.52 15.37 17.72 17.79 6.59 0.13 5.15 2.75 66 G C C 43.36 5.42 14.05 20.65 113.59 18.97 68.63 -155.04 77.71 4.10 18.19 33.88 20.38 24.40 11.11 6.38 0.04 2.30 1.52 67 S C T 79.10 3.98 13.57 18.79 104.92 -15.40 -86.29 35.18 80.18 2.07 17.76 29.02 22.06 30.06 9.49 7.30 0.02 0.98 1.06 68 G C C 44.26 6.43 12.88 20.38 103.88 0.42 63.49 -8.66 76.99 2.47 20.55 31.05 22.54 24.40 9.52 10.05 0.02 1.20 1.21 69 E C C 111.33 6.00 12.92 20.32 102.03 90.51 -77.68 -14.37 62.15 4.35 33.50 30.09 13.79 18.77 15.23 17.93 0.05 2.60 1.53 70 N C C 93.29 5.78 13.24 20.33 101.41 62.02 -81.34 14.71 56.16 8.07 35.77 30.91 10.44 15.38 15.87 19.67 0.07 5.75 1.91 71 L C C 78.82 9.25 11.75 21.97 100.15 97.31 -79.49 -11.98 49.45 13.60 36.95 30.42 8.95 10.98 16.88 19.90 0.07 10.38 2.40 72 Y C C 126.30 7.39 11.64 20.18 106.57 64.94 -92.26 64.67 50.21 18.93 30.86 29.66 9.36 12.17 15.96 14.84 0.20 14.31 3.51 73 F C C 124.38 5.72 10.20 17.57 112.29 102.60 -95.49 119.31 67.20 12.38 20.42 53.83 2.97 10.47 12.33 7.23 0.01 9.82 3.34 74 Q C C 126.84 3.61 12.59 17.84 110.89 -140.40 -85.81 123.70 99.70 0.24 0.05 99.60 0.11 0.08 0.03 0.00 0.00 0.15 0.02