# 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 L C C 99.36 7.42 13.04 21.77 117.39 -163.15 -98.20 135.75 98.99 0.94 0.07 99.02 0.13 0.07 0.03 0.01 0.00 0.70 0.04 1 G C C 43.72 5.16 13.52 19.77 124.80 -161.09 -112.21 169.41 68.38 26.19 5.43 61.48 2.79 2.84 3.70 1.38 0.00 26.87 0.93 2 Y E E 141.62 6.27 11.54 19.23 119.44 -109.40 -106.78 134.10 32.73 59.67 7.61 24.81 4.96 2.11 5.27 2.04 0.02 59.95 0.83 3 I E E 83.33 8.45 12.50 22.53 119.87 -158.33 -110.20 129.69 10.37 82.81 6.82 8.01 1.10 0.65 5.66 1.12 0.00 82.99 0.47 4 I E E 79.90 8.62 15.08 25.13 117.98 -158.25 -106.58 127.29 6.64 87.51 5.85 4.92 0.66 0.48 5.28 0.85 0.00 87.41 0.39 5 I E E 61.96 10.61 14.52 26.46 121.12 -163.23 -111.65 134.57 9.67 84.43 5.90 7.33 1.01 0.72 5.14 1.14 0.00 83.94 0.71 6 A E E 39.57 10.38 13.85 25.41 117.25 -137.02 -86.68 144.92 32.87 58.42 8.72 24.32 5.14 3.45 4.37 4.18 0.02 57.36 1.17 7 A C T 68.02 6.09 14.89 21.85 101.03 -114.15 -73.64 -21.12 79.74 14.06 6.20 12.53 26.84 40.62 1.64 4.35 0.03 12.84 1.15 8 N C T 115.39 2.84 15.45 18.83 102.07 43.92 -95.41 37.61 90.63 4.69 4.68 20.10 30.70 40.10 0.63 4.08 0.00 3.55 0.84 9 T C C 46.13 12.23 7.90 20.53 116.96 135.60 -96.38 133.49 94.89 3.89 1.22 61.95 32.06 1.11 0.80 0.42 0.00 1.68 1.98 10 P C C 77.85 3.72 13.45 18.39 112.25 -105.46 -66.66 149.77 85.86 1.37 12.77 66.79 8.69 10.33 6.46 6.25 0.00 0.76 0.72 11 V C T 107.95 3.32 11.17 15.96 101.04 -101.64 -67.13 -11.83 65.22 2.01 32.77 20.47 13.86 31.66 13.40 18.50 0.03 1.08 1.00 12 L C T 110.03 3.89 10.04 15.55 101.96 62.09 -82.34 20.72 59.82 5.95 34.23 23.75 10.89 26.41 14.88 18.20 0.11 3.83 1.94 13 R C C 135.84 5.96 9.80 17.23 105.12 89.69 -87.87 48.25 58.67 8.27 33.06 38.89 9.63 10.81 16.72 15.94 0.03 5.54 2.43 14 K C C 141.96 3.24 11.97 16.71 108.63 73.08 -88.50 86.85 73.87 5.08 21.05 47.97 10.57 15.02 14.63 6.74 0.01 3.73 1.32 15 S C C 68.86 5.00 12.88 19.26 111.90 58.41 -96.30 108.06 86.65 4.99 8.35 70.67 7.13 9.11 4.97 3.01 0.00 4.47 0.65 16 V C C 73.53 9.60 11.45 21.98 118.01 41.64 -105.06 130.92 76.24 19.65 4.11 66.42 6.27 2.54 2.47 1.60 0.00 19.70 0.99 17 Y E E 99.96 9.53 13.69 24.44 119.39 -161.22 -110.25 131.21 35.77 60.65 3.58 31.04 2.73 1.50 2.10 1.54 0.00 59.62 1.47 18 Y E E 133.82 6.48 15.73 23.81 119.85 -158.33 -109.47 130.11 23.74 74.49 1.78 21.09 1.52 0.76 1.29 0.71 0.00 70.22 4.40 19 F E E 63.35 14.50 10.07 24.86 122.14 -167.58 -113.11 138.69 43.28 56.06 0.65 40.08 2.10 0.53 0.43 0.27 0.00 54.29 2.29 20 Q C C 147.28 1.42 17.03 18.21 106.43 -156.59 -98.17 53.10 77.41 22.13 0.45 43.23 29.66 4.24 0.14 0.32 0.00 21.67 0.74 21 G C S 35.46 4.65 15.61 21.52 134.32 69.15 -131.07 -177.65 91.92 7.62 0.46 15.31 72.01 4.74 0.15 0.25 0.00 6.67 0.85 22 G C C 35.59 4.00 18.60 22.70 124.11 -69.73 -85.42 167.77 95.18 3.09 1.73 84.42 9.73 1.14 1.42 0.41 0.00 1.66 1.22 23 N H H 71.40 14.17 12.66 26.43 93.18 -98.42 -62.82 -36.54 6.48 0.10 93.42 2.09 1.82 2.86 91.89 1.24 0.02 0.04 0.04 24 N H H 104.07 3.38 18.12 22.16 92.45 53.99 -65.21 -40.03 3.67 0.10 96.23 0.96 0.58 2.26 94.37 1.73 0.02 0.06 0.02 25 E H H 102.29 3.13 19.71 22.55 92.55 49.19 -66.69 -40.10 2.11 0.19 97.69 0.81 0.35 1.15 95.74 1.74 0.02 0.16 0.03 26 L H H 21.01 15.03 13.74 29.86 91.80 51.49 -64.21 -42.35 1.03 0.10 98.87 0.32 0.17 0.55 98.03 0.84 0.01 0.06 0.01 27 G H H 13.95 11.58 13.71 26.98 91.72 51.43 -63.23 -41.31 1.80 0.09 98.11 0.53 0.19 1.06 97.20 0.94 0.01 0.06 0.01 28 T H H 98.95 1.47 18.00 18.48 92.56 49.78 -66.88 -39.74 2.29 0.05 97.66 0.39 0.21 1.59 96.84 0.93 0.01 0.03 0.01 29 A H H 63.58 5.50 15.34 21.89 92.97 50.55 -68.52 -36.09 5.78 0.04 94.18 0.36 0.44 4.82 93.54 0.79 0.02 0.02 0.01 30 V H H 56.71 10.33 12.58 23.94 96.87 33.95 -93.25 -10.36 31.19 0.20 68.61 1.38 2.87 26.71 67.88 0.89 0.07 0.06 0.13 31 G C T 58.46 1.52 16.17 17.47 95.52 -118.53 78.74 10.10 97.14 0.31 2.54 12.66 12.57 72.17 1.44 0.87 0.00 0.16 0.14 32 K C S 105.16 4.33 14.56 20.78 131.91 96.05 -128.41 158.07 97.59 1.50 0.91 22.63 66.45 8.69 0.17 0.71 0.00 0.86 0.49 33 L C C 106.93 5.38 15.13 21.86 113.55 -101.96 -78.47 134.70 93.44 6.05 0.51 76.65 13.35 3.24 0.07 0.56 0.00 5.53 0.60 34 F C C 56.56 15.67 12.35 28.17 129.57 -175.97 -128.33 149.14 75.67 24.18 0.16 68.88 5.65 0.46 0.03 0.14 0.00 23.84 1.00 35 R E E 135.22 5.17 20.94 26.96 116.63 -127.74 -92.73 133.06 28.76 71.02 0.22 26.07 2.05 0.30 0.05 0.16 0.00 70.08 1.28 36 V E E 35.07 19.50 12.92 31.68 125.82 -167.89 -120.31 140.14 11.66 88.22 0.13 10.98 0.67 0.14 0.04 0.09 0.00 86.56 1.52 37 G E E 30.28 7.78 19.27 27.86 123.53 -167.97 -112.75 159.08 13.05 86.76 0.18 9.98 3.15 0.42 0.04 0.14 0.00 85.88 0.39 38 V E E 76.38 10.20 14.55 25.71 123.83 -127.98 -116.49 138.11 13.27 86.61 0.12 11.78 1.24 0.20 0.03 0.08 0.00 85.71 0.95 39 V E E 82.51 7.97 11.75 21.22 115.53 -139.91 -96.12 130.65 28.21 71.65 0.14 27.78 0.61 0.15 0.05 0.07 0.00 69.44 1.90 40 S C C 77.56 3.99 13.94 19.46 115.97 -142.08 -93.89 140.07 98.55 1.44 0.01 98.50 0.11 0.02 0.00 0.00 0.00 1.36 0.02