# 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 V C C 64.84 12.05 13.07 25.55 116.50 -165.09 -99.79 128.94 99.69 0.26 0.05 99.64 0.11 0.05 0.03 0.00 0.00 0.14 0.03 1 E C C 122.18 4.57 13.22 19.41 114.47 -141.86 -90.45 133.17 85.69 7.54 6.77 81.41 1.63 3.42 3.81 2.17 0.00 5.01 2.56 2 E C C 110.74 6.77 10.27 18.54 117.09 -153.67 -99.51 139.04 81.66 7.49 10.85 62.71 9.33 9.50 4.26 6.37 0.00 4.89 2.92 3 S C C 75.06 4.62 11.29 17.41 108.86 -154.33 -90.54 96.46 81.95 4.66 13.39 34.37 18.79 30.09 3.00 9.34 0.01 2.57 1.82 4 N C T 120.58 2.72 13.53 17.38 99.66 -36.94 -65.02 26.37 86.72 1.75 11.54 14.49 24.53 48.23 2.04 8.88 0.00 0.98 0.85 5 G C S 37.50 8.71 13.24 22.76 102.59 -91.37 84.18 1.82 89.77 4.96 5.27 28.45 31.93 29.74 0.61 4.81 0.00 3.48 0.97 6 K C C 102.02 7.83 16.99 25.64 114.70 128.08 -91.25 135.33 78.86 19.45 1.68 58.88 13.98 5.07 0.27 1.63 0.00 18.74 1.44 7 L E E 62.58 12.74 17.69 30.61 121.98 -143.58 -103.22 141.34 42.61 57.07 0.31 35.72 5.00 0.92 0.05 0.26 0.00 56.92 1.13 8 V E E 12.67 20.77 16.71 37.70 123.57 -153.51 -113.76 137.75 7.49 92.49 0.02 6.95 0.41 0.02 0.00 0.01 0.00 92.45 0.15 9 K E E 80.83 9.18 25.67 35.38 115.09 -132.18 -91.18 128.38 1.24 98.75 0.00 1.07 0.05 0.00 0.00 0.00 0.00 98.87 0.01 10 I E E 4.09 25.47 17.52 43.71 124.77 -169.46 -120.16 136.87 0.67 99.33 0.00 0.66 0.01 0.00 0.00 0.00 0.00 99.32 0.01 11 V E E 26.65 10.83 26.02 38.34 117.23 -156.48 -110.41 126.18 0.32 99.68 0.00 0.32 0.00 0.00 0.00 0.00 0.00 99.65 0.03 12 L E E 9.76 22.46 16.29 39.48 110.13 -129.76 -76.63 124.97 2.25 97.74 0.01 2.26 0.04 0.00 0.00 0.00 0.00 97.40 0.29 13 L C S 62.16 8.93 21.52 31.51 99.16 176.56 -93.03 -29.53 78.48 21.32 0.20 12.73 63.33 1.61 0.01 0.21 0.00 21.95 0.18 14 D C S 67.74 4.60 23.46 28.26 139.38 6.95 -150.54 158.65 85.57 14.18 0.24 4.11 79.55 2.75 0.01 0.25 0.00 12.85 0.47 15 D C C 83.91 10.08 16.11 26.85 115.82 -105.00 -83.39 131.75 88.31 11.14 0.55 85.61 2.70 0.42 0.15 0.37 0.00 9.50 1.24 16 V E B 31.70 14.59 10.84 26.18 117.80 -167.82 -116.34 125.10 40.99 58.02 0.98 35.88 1.99 0.20 0.76 0.19 0.00 7.41 53.57 17 D C T 125.72 1.20 16.10 16.85 95.53 -113.83 -60.74 -28.13 76.49 0.88 22.63 1.51 6.42 70.51 2.16 18.19 0.03 0.44 0.73 18 R C T 174.81 2.23 16.59 19.19 96.24 32.97 -78.81 -17.58 78.21 0.30 21.49 0.92 4.70 74.48 1.51 17.98 0.01 0.16 0.25 19 V C T 35.03 15.92 12.23 27.94 105.51 39.78 -105.90 -19.52 77.36 0.91 21.73 1.34 4.85 73.11 2.28 17.21 0.02 0.46 0.73 20 G C C 21.08 8.56 17.08 27.13 130.08 -101.36 112.17 -175.52 77.15 20.82 2.04 36.69 11.28 29.58 0.76 1.06 0.01 8.68 11.94 21 Q C C 99.32 4.13 20.08 24.55 126.35 -52.25 -111.28 155.59 85.47 14.05 0.48 76.30 7.28 1.19 0.21 0.27 0.00 6.47 8.29 22 Q C T 99.00 10.30 13.61 24.73 109.81 -82.55 -60.28 134.40 97.73 1.97 0.30 0.25 1.79 96.54 0.02 0.14 0.00 1.05 0.21 23 G C T 47.28 3.86 17.79 22.53 95.10 20.99 87.02 -5.62 99.56 0.37 0.08 0.39 2.23 97.01 0.00 0.06 0.00 0.30 0.01 24 Q C C 77.36 7.57 16.46 25.52 117.97 129.09 -77.81 146.42 96.45 3.54 0.01 92.51 3.81 0.07 0.00 0.01 0.00 3.42 0.18 25 T E E 73.12 10.10 16.89 27.90 120.21 -138.18 -105.82 133.34 1.26 98.74 0.00 1.39 0.02 0.00 0.00 0.00 0.00 98.01 0.58 26 V E E 23.86 16.55 15.59 32.84 128.30 -174.68 -128.66 143.41 0.16 99.84 0.00 0.16 0.00 0.00 0.00 0.00 0.00 99.83 0.00 27 V E E 84.52 6.30 22.67 29.65 115.56 -135.23 -94.17 128.24 0.66 99.34 0.00 0.61 0.01 0.00 0.00 0.00 0.00 99.37 0.00 28 V E E 12.64 21.71 11.68 33.11 126.67 -172.60 -121.35 143.77 12.48 87.51 0.01 12.41 0.18 0.01 0.00 0.00 0.00 86.99 0.40 29 K C C 110.20 3.32 21.75 24.52 115.77 -108.14 -70.32 149.72 88.89 10.68 0.42 87.86 0.92 0.19 0.22 0.09 0.00 10.32 0.41 30 A C T 60.30 10.64 14.50 25.72 95.13 -102.32 -58.69 -36.52 54.37 0.17 45.46 0.84 2.88 50.80 42.41 2.80 0.07 0.08 0.12 31 G H H 37.57 3.37 18.89 22.49 92.94 45.44 -53.94 -31.14 39.86 0.08 60.06 1.30 1.86 36.99 57.40 2.31 0.06 0.03 0.05 32 L H H 41.16 9.90 16.81 28.34 92.42 65.03 -66.13 -39.82 5.32 0.18 94.51 1.57 1.03 3.26 91.10 2.78 0.11 0.08 0.08 33 M H H 15.45 21.80 12.76 34.07 91.99 51.56 -64.32 -41.87 3.17 0.22 96.61 0.65 0.48 2.41 93.73 2.15 0.39 0.10 0.09 34 R H H 125.17 6.89 17.90 25.72 93.55 46.40 -69.77 -38.28 3.10 0.21 96.69 0.29 0.37 2.78 93.61 2.02 0.76 0.07 0.10 35 H H H 127.95 2.04 19.36 20.54 100.31 33.90 -92.58 -33.75 9.56 0.20 90.24 0.24 0.70 9.61 85.88 1.78 1.58 0.05 0.17 36 L C T 67.31 8.38 18.11 27.41 107.75 21.57 -106.60 -38.60 58.11 0.30 41.59 0.38 3.04 53.67 40.01 1.77 0.70 0.08 0.35 37 L C T 11.19 20.73 14.87 35.89 103.44 29.78 -94.73 -40.82 79.71 1.80 18.49 1.83 13.06 63.61 16.63 1.95 0.57 0.52 1.84 38 F C S 45.18 15.89 14.10 29.67 101.49 43.64 -79.39 -37.53 80.77 6.09 13.14 26.39 36.66 17.98 6.87 5.61 0.22 2.29 3.98 39 P C T 91.67 3.34 15.99 20.28 92.75 58.39 -63.55 -28.58 73.63 2.26 24.12 9.36 11.44 52.01 4.95 19.57 0.06 1.27 1.35 40 E C T 131.71 2.50 16.73 19.49 94.04 45.96 -87.43 1.05 77.87 0.67 21.46 2.12 8.88 67.20 3.03 17.89 0.02 0.36 0.51 41 G C T 35.39 9.34 15.70 25.84 97.54 -109.01 84.67 9.92 85.92 1.89 12.19 7.72 28.46 49.42 2.76 9.86 0.02 1.18 0.59 42 K C C 85.93 8.93 20.73 30.15 110.61 124.29 -96.50 85.54 71.53 27.74 0.73 56.76 7.05 6.64 0.24 0.48 0.00 26.97 1.86 43 A E E 9.60 23.56 14.13 37.21 132.55 137.80 -124.97 152.56 14.85 85.03 0.12 13.95 0.96 0.11 0.06 0.07 0.00 82.68 2.17 44 L E E 58.32 10.12 25.33 35.82 131.37 -161.86 -131.65 147.46 6.58 93.36 0.06 6.41 0.31 0.05 0.03 0.03 0.00 92.54 0.64 45 Y E E 99.02 12.85 22.46 34.63 115.88 -104.39 -72.31 143.73 15.48 84.36 0.16 13.77 1.34 0.21 0.07 0.09 0.00 82.65 1.87 46 A C C 14.98 21.76 12.40 34.02 110.20 -110.52 -72.48 129.98 90.84 8.98 0.17 83.88 6.30 0.38 0.06 0.11 0.00 8.44 0.83 47 T C C 50.31 5.49 19.08 25.50 129.88 -164.63 -115.13 166.30 99.33 0.39 0.27 90.61 8.65 0.17 0.23 0.04 0.00 0.16 0.15 48 P H H 99.95 3.00 14.89 19.17 90.66 -100.87 -57.62 -36.91 7.80 0.03 92.18 1.02 1.24 5.45 89.29 2.97 0.01 0.01 0.01 49 E H H 132.86 1.22 16.69 16.81 91.80 52.29 -64.58 -39.34 6.72 0.04 93.24 1.03 0.78 4.83 89.75 3.57 0.02 0.02 0.01 50 N H H 29.49 13.90 11.62 26.24 92.66 48.97 -67.28 -38.90 4.71 0.11 95.18 1.85 0.72 2.48 90.13 4.71 0.01 0.07 0.03 51 E H H 68.48 12.01 12.21 24.82 91.73 54.28 -63.49 -40.07 3.01 0.06 96.93 0.95 0.38 1.67 93.06 3.89 0.00 0.04 0.01 52 A H H 75.63 1.29 15.77 16.06 91.99 52.18 -65.32 -37.19 7.71 0.08 92.21 1.21 0.65 5.47 85.01 7.57 0.02 0.05 0.02 53 K H H 128.02 3.08 14.20 18.38 93.02 52.17 -70.29 -32.09 20.82 0.08 79.10 1.81 1.23 17.12 73.42 6.32 0.02 0.04 0.04 54 Y H H 73.82 13.75 9.14 22.53 99.43 48.20 -89.92 -8.37 42.52 0.32 57.16 16.25 2.10 24.04 53.98 3.26 0.01 0.12 0.23 55 S C C 76.77 4.12 14.28 19.86 103.10 101.77 -72.79 50.62 99.95 0.03 0.03 99.83 0.06 0.08 0.02 0.00 0.00 0.01 0.00