# 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 103.51 8.50 12.89 22.26 114.60 -158.66 -94.31 133.21 99.78 0.20 0.02 99.68 0.13 0.06 0.01 0.00 0.00 0.09 0.03 1 C C C 79.97 5.97 11.24 18.71 116.40 -155.16 -97.36 141.81 91.57 6.48 1.95 86.98 2.33 2.33 0.99 0.70 0.00 3.14 3.53 2 A C C 68.57 4.76 11.87 18.17 114.91 -107.96 -81.54 143.21 90.47 3.66 5.87 64.08 18.45 7.95 2.36 3.45 0.00 2.03 1.67 3 P C C 90.60 5.56 11.85 18.95 102.71 -110.54 -69.45 6.13 89.02 1.95 9.03 47.28 15.97 26.32 3.18 5.39 0.00 1.07 0.80 4 S C C 67.31 6.22 12.64 20.09 103.75 68.47 -86.44 10.14 83.76 2.52 13.72 43.71 17.29 23.34 6.48 6.57 0.00 1.14 1.47 5 G C C 29.69 8.70 11.78 21.65 106.05 70.68 -69.91 -41.52 73.52 0.88 25.60 46.37 21.51 4.73 24.65 1.95 0.00 0.26 0.53 6 P H H 86.10 3.09 14.60 18.30 94.42 -70.71 -64.94 -36.34 22.27 0.29 77.43 8.51 4.77 9.87 74.21 2.34 0.03 0.13 0.14 7 F H H 110.97 4.19 14.52 19.74 93.57 53.98 -66.64 -38.42 11.31 0.20 88.49 3.02 2.03 6.87 85.34 2.48 0.07 0.10 0.09 8 Y H H 58.64 11.98 10.86 23.67 93.51 51.36 -67.53 -38.94 5.81 0.17 94.02 1.95 1.07 3.31 90.08 3.39 0.04 0.11 0.06 9 R H H 135.43 4.87 13.62 20.01 93.00 53.42 -65.12 -39.54 5.02 0.14 94.84 1.41 0.71 3.09 90.22 4.41 0.03 0.09 0.04 10 V H H 116.15 1.58 14.65 16.28 92.64 53.35 -68.72 -27.93 13.64 0.16 86.20 1.54 1.48 10.67 81.64 4.39 0.11 0.08 0.08 11 A C T 57.86 6.46 12.04 20.07 94.60 54.67 -84.75 -4.33 62.54 0.11 37.36 1.01 2.55 58.35 35.12 2.81 0.03 0.04 0.11 12 G C T 55.78 1.87 16.98 18.62 96.49 -106.65 83.31 10.18 99.60 0.03 0.36 4.69 2.58 92.46 0.17 0.08 0.00 0.01 0.01 13 M C C 49.69 13.88 9.19 23.42 118.93 133.97 -90.35 142.39 98.74 1.07 0.19 95.18 3.24 0.27 0.11 0.05 0.00 0.32 0.84 14 S C C 50.57 3.82 19.54 23.30 123.47 -138.01 -89.03 165.46 98.10 1.63 0.28 96.44 1.53 0.15 0.21 0.04 0.00 0.39 1.24 15 Y H H 106.80 12.40 14.36 27.02 91.38 -105.96 -59.22 -38.24 1.64 0.01 98.35 0.21 0.25 1.03 98.29 0.20 0.00 0.00 0.00 16 L H H 91.20 5.63 18.34 24.68 92.14 52.11 -64.94 -40.33 0.85 0.00 99.15 0.05 0.04 0.70 98.94 0.26 0.00 0.00 0.00 17 R H H 118.25 4.62 20.19 25.14 92.06 48.46 -66.08 -40.80 0.32 0.00 99.68 0.02 0.01 0.24 99.51 0.21 0.00 0.00 0.00 18 Y H H 47.21 14.30 17.34 32.03 92.09 50.03 -64.48 -42.58 0.08 0.00 99.92 0.01 0.00 0.04 99.92 0.03 0.00 0.00 0.00 19 S H H 28.69 13.42 18.58 32.29 91.88 50.57 -64.14 -41.56 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 20 N H H 75.63 6.15 21.84 28.30 91.93 50.37 -64.41 -41.60 0.05 0.00 99.95 0.00 0.00 0.03 99.96 0.01 0.00 0.00 0.00 21 I H H 66.61 6.65 22.29 29.37 91.77 49.19 -64.38 -42.63 0.04 0.00 99.96 0.00 0.00 0.03 99.96 0.01 0.00 0.00 0.00 22 C H H 29.78 13.04 20.11 33.55 92.06 49.77 -64.69 -42.12 0.10 0.00 99.90 0.01 0.00 0.07 99.91 0.01 0.00 0.00 0.00 23 A H H 23.27 12.94 18.55 32.31 91.56 51.27 -63.66 -41.73 0.26 0.00 99.74 0.02 0.01 0.18 99.77 0.03 0.00 0.00 0.00 24 D H H 76.81 4.19 22.34 26.49 91.67 50.44 -64.56 -41.04 0.25 0.00 99.75 0.02 0.01 0.16 99.77 0.03 0.00 0.00 0.00 25 L H H 59.12 7.18 19.68 27.67 91.77 50.21 -64.53 -42.28 0.23 0.00 99.77 0.02 0.01 0.15 99.76 0.06 0.00 0.00 0.00 26 L H H 42.31 14.40 16.86 31.41 92.08 49.43 -64.59 -41.59 0.45 0.00 99.54 0.04 0.02 0.31 99.40 0.22 0.00 0.00 0.00 27 R H H 100.19 10.34 16.62 27.41 91.34 52.17 -64.67 -35.36 2.31 0.00 97.68 0.11 0.10 1.97 96.89 0.92 0.00 0.00 0.00 28 N H H 117.28 1.75 19.22 20.33 91.79 53.51 -72.61 -21.91 18.98 0.01 81.01 0.30 0.48 19.17 78.74 1.28 0.01 0.00 0.01 29 V H H 72.83 7.91 14.80 23.57 97.47 52.23 -92.90 -9.20 43.91 0.11 55.98 1.56 3.23 38.07 55.20 1.79 0.04 0.04 0.08 30 L C S 42.85 16.73 7.82 23.56 118.04 95.97 -82.69 144.67 89.17 3.89 6.94 35.06 49.62 3.55 6.43 0.83 0.01 0.83 3.66 31 K C C 118.24 2.86 14.73 18.24 115.68 -108.30 -72.12 151.65 97.45 0.69 1.86 94.90 1.95 0.65 1.58 0.20 0.00 0.23 0.48 32 E H H 147.38 1.79 12.94 15.61 94.10 -105.43 -57.05 -40.40 14.39 0.06 85.55 1.26 1.31 10.56 70.84 15.92 0.04 0.03 0.03 33 P H H 101.28 1.15 14.34 14.68 91.41 51.08 -65.85 -30.96 13.85 0.03 86.12 0.61 0.74 11.68 73.19 13.72 0.03 0.02 0.02 34 F H H 70.26 10.03 11.26 22.42 94.37 45.93 -77.97 -25.96 10.73 0.08 89.19 1.16 0.91 7.56 74.13 16.13 0.03 0.05 0.03 35 K H H 85.81 10.53 12.65 23.95 91.93 66.42 -60.54 -42.53 2.95 0.11 96.95 1.35 0.53 1.22 95.43 1.37 0.01 0.05 0.03 36 A H H 66.40 1.57 17.97 18.23 91.72 50.71 -64.54 -40.52 2.36 0.07 97.56 0.82 0.29 1.28 95.96 1.58 0.01 0.05 0.01 37 K H H 113.08 3.20 17.79 21.27 92.35 49.11 -66.67 -39.24 2.36 0.06 97.58 0.68 0.27 1.37 96.03 1.59 0.01 0.04 0.01 38 A H H 17.70 14.97 12.16 27.91 92.38 52.57 -64.99 -39.96 3.77 0.06 96.18 0.97 0.46 2.25 94.51 1.76 0.01 0.04 0.01 39 Q H H 103.07 4.67 17.36 23.06 92.08 53.44 -66.12 -33.66 15.10 0.17 84.73 2.79 1.65 10.67 82.31 2.39 0.03 0.09 0.07 40 A H H 68.84 2.65 16.95 19.63 93.30 55.63 -70.81 -27.41 31.41 0.43 68.16 7.22 4.56 20.39 63.71 3.64 0.06 0.21 0.21 41 R H H 101.55 11.19 12.17 23.71 100.18 72.12 -78.17 -12.91 41.61 2.07 56.32 18.73 8.07 16.91 46.88 7.31 0.13 1.15 0.83 42 Q C H 109.50 6.56 14.98 22.61 98.38 99.69 -77.11 -14.55 55.27 4.88 39.85 23.52 10.66 21.81 30.54 8.70 0.15 3.27 1.35 43 A C C 62.99 5.76 15.92 22.64 108.84 63.97 -90.59 67.75 63.36 11.70 24.95 31.50 11.26 21.19 16.08 8.47 0.09 9.69 1.72 44 I C C 66.54 12.73 11.64 24.80 119.34 122.31 -104.22 133.63 60.68 33.73 5.58 46.33 9.71 3.75 3.36 2.18 0.01 32.90 1.76 45 H E E 104.11 5.95 16.20 23.43 118.98 -160.85 -110.88 131.56 32.70 64.88 2.42 24.94 6.10 2.22 1.20 1.14 0.00 63.40 0.99 46 F E E 86.16 13.42 11.37 24.99 126.09 -169.76 -123.82 141.15 12.16 87.17 0.68 9.92 1.74 0.57 0.32 0.30 0.00 86.76 0.39 47 R E E 127.16 5.04 16.64 23.35 124.37 -165.54 -121.79 139.94 4.64 95.06 0.30 3.88 0.49 0.21 0.13 0.12 0.00 95.01 0.16 48 Q E E 89.36 10.68 12.68 24.35 123.19 -157.13 -116.19 138.53 4.52 95.29 0.20 4.00 0.37 0.15 0.09 0.09 0.00 95.02 0.28 49 A E E 42.00 7.62 13.70 23.32 127.82 -175.94 -131.41 147.19 12.17 87.78 0.05 11.47 0.55 0.06 0.01 0.03 0.00 87.63 0.25 50 P E E 76.19 4.71 15.11 20.95 115.21 -111.16 -75.02 146.70 21.04 78.91 0.05 18.18 1.69 0.15 0.01 0.04 0.00 79.76 0.18 51 Y E E 104.82 9.30 8.45 18.92 118.94 -141.76 -103.51 134.62 14.53 85.38 0.09 13.49 0.91 0.13 0.03 0.06 0.00 84.60 0.80 52 V E E 95.08 2.75 10.04 14.78 120.77 -176.16 -131.73 124.67 8.00 91.54 0.45 4.71 2.28 1.05 0.18 0.30 0.00 84.33 7.16 53 D C T 138.43 0.35 11.25 10.09 92.47 -14.01 52.82 42.69 98.95 0.52 0.53 0.67 5.81 92.56 0.02 0.48 0.00 0.36 0.09 54 G C T 61.90 1.47 9.78 12.35 94.61 -50.68 79.61 2.94 99.32 0.21 0.47 0.80 6.77 91.76 0.02 0.47 0.00 0.14 0.04 55 K E E 142.01 1.25 12.24 14.11 123.70 101.23 -115.20 139.92 10.35 89.52 0.13 4.99 5.42 0.71 0.05 0.09 0.00 83.01 5.74 56 A E E 69.28 5.93 9.10 16.99 113.25 -110.18 -68.12 140.60 15.09 84.75 0.16 12.55 2.17 0.49 0.05 0.12 0.00 81.29 3.34 57 G C C 37.17 5.09 10.89 17.62 122.29 -157.13 -100.16 -68.50 74.10 25.26 0.64 59.48 10.36 2.61 0.11 0.56 0.00 26.12 0.75 58 A C C 85.08 1.59 15.37 16.65 116.00 -59.68 -82.08 145.25 75.08 24.29 0.63 59.62 11.95 1.93 0.09 0.56 0.00 25.26 0.59 59 S C C 68.45 8.87 9.53 19.55 116.30 -113.29 -81.19 141.45 70.36 29.22 0.43 63.39 4.09 0.79 0.07 0.32 0.00 30.85 0.49 60 K E E 108.95 5.14 13.69 20.79 126.37 -167.86 -126.45 140.91 15.18 84.56 0.26 13.55 1.31 0.26 0.08 0.13 0.00 83.99 0.68 61 V E E 91.21 6.59 12.60 21.11 119.29 -146.34 -104.70 132.41 5.81 94.07 0.12 5.35 0.32 0.06 0.06 0.04 0.00 93.72 0.46 62 Y E E 86.81 9.01 12.09 22.87 125.15 -172.48 -122.22 141.45 11.66 87.69 0.65 10.47 0.92 0.30 0.34 0.22 0.00 87.08 0.67 63 E E E 118.25 3.94 15.58 20.83 114.92 -130.41 -91.43 133.52 30.15 67.28 2.57 25.05 3.90 1.49 1.11 1.26 0.00 66.08 1.11 64 L C C 67.30 12.52 9.51 22.14 107.39 -131.63 -84.36 106.55 63.62 24.39 12.00 38.95 14.23 11.11 4.50 6.82 0.03 22.59 1.76 65 E C C 130.80 2.97 12.61 16.88 105.81 153.06 -91.47 35.15 71.29 15.14 13.57 31.94 18.83 22.21 4.05 8.73 0.05 11.85 2.34 66 N C T 123.99 1.95 13.21 15.85 102.22 33.17 -84.72 29.46 83.62 5.52 10.86 19.93 22.22 42.31 2.54 7.60 0.02 4.08 1.31 67 G C T 46.29 4.77 12.43 18.64 105.14 -82.00 89.26 1.89 87.12 8.82 4.06 28.98 26.74 32.27 0.50 3.51 0.00 6.67 1.33 68 I C C 78.78 8.63 10.12 20.21 116.90 125.36 -94.64 131.75 81.44 18.06 0.49 56.60 24.78 1.16 0.18 0.35 0.00 13.10 3.83 69 P C C 73.07 5.83 12.08 19.77 114.58 -111.04 -66.67 148.19 82.29 16.53 1.18 74.38 4.94 2.04 0.38 0.81 0.00 14.78 2.67 70 K C C 143.01 3.89 11.03 16.92 112.93 -129.50 -87.70 135.34 75.09 20.99 3.92 53.11 14.48 7.12 1.26 2.94 0.01 15.83 5.26 71 T C C 94.26 3.96 9.40 15.23 115.92 -131.50 -96.73 135.35 75.92 19.95 4.13 54.06 13.39 7.83 1.19 3.17 0.00 16.39 3.95 72 A C C 82.77 3.05 8.12 13.12 112.74 -135.82 -88.02 134.37 88.05 9.78 2.17 80.34 2.45 5.40 0.61 1.21 0.00 8.16 1.84 73 N C C 122.98 2.22 10.78 14.42 109.47 -124.18 -88.84 108.87 99.81 0.18 0.02 99.63 0.17 0.07 0.01 0.00 0.00 0.10 0.02