# 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 119.59 4.77 11.03 17.46 117.02 -154.78 -92.33 140.91 99.84 0.13 0.03 99.75 0.10 0.05 0.01 0.00 0.00 0.06 0.02 1 A C C 72.08 4.31 9.52 15.61 114.31 -125.55 -82.51 143.85 92.30 4.11 3.60 88.22 1.14 3.65 1.19 1.72 0.00 2.50 1.58 2 K C C 149.31 2.54 10.32 14.50 112.38 -136.22 -90.44 134.37 85.07 6.80 8.12 50.12 16.22 18.71 1.54 6.84 0.00 4.00 2.58 3 G C C 42.84 6.27 9.88 17.47 111.51 7.98 42.68 133.80 82.99 4.51 12.50 45.46 17.48 19.29 1.32 12.32 0.00 2.68 1.45 4 K C T 143.86 3.18 12.66 17.29 105.79 -133.50 -87.34 16.11 80.13 5.01 14.87 24.02 27.52 29.29 1.45 13.29 0.01 3.08 1.33 5 D C C 102.22 3.74 14.07 18.72 104.57 45.83 -88.44 50.74 78.91 9.84 11.25 32.70 21.87 24.90 1.03 10.51 0.00 7.85 1.13 6 V C C 50.35 12.35 10.87 24.08 118.93 147.84 -98.00 136.01 71.94 27.09 0.97 59.36 10.25 1.51 0.19 0.81 0.00 26.41 1.45 7 R E E 119.95 6.98 18.16 26.11 119.26 -159.11 -106.61 133.04 28.51 71.32 0.17 25.90 2.13 0.22 0.05 0.11 0.00 70.48 1.11 8 V E E 34.15 16.62 14.85 31.82 120.23 -160.90 -111.70 130.47 8.84 91.15 0.01 8.30 0.32 0.02 0.00 0.01 0.00 91.21 0.14 9 K E E 88.13 8.40 21.36 30.48 119.42 -161.27 -108.69 129.77 3.13 96.87 0.00 2.85 0.12 0.00 0.00 0.00 0.00 96.99 0.03 10 V E E 16.73 20.62 16.09 36.79 124.00 -168.86 -120.23 134.17 0.94 99.06 0.00 0.83 0.02 0.00 0.00 0.00 0.00 99.13 0.01 11 I E E 50.90 9.34 24.58 34.88 117.66 -157.04 -109.90 125.87 0.44 99.56 0.00 0.39 0.01 0.00 0.00 0.00 0.00 99.60 0.00 12 L E E 11.89 23.14 17.69 41.22 118.94 -164.44 -108.63 129.26 0.57 99.43 0.00 0.50 0.01 0.00 0.00 0.00 0.00 99.48 0.01 13 E E E 68.04 9.52 24.89 34.80 119.93 -159.60 -111.54 133.96 1.73 98.26 0.01 1.55 0.07 0.00 0.00 0.00 0.00 98.30 0.07 14 C E E 13.53 20.10 14.73 35.08 113.32 -136.43 -89.97 132.14 21.20 78.67 0.13 20.55 0.69 0.06 0.05 0.06 0.00 78.17 0.43 15 T C C 70.75 6.81 20.80 28.30 96.07 -157.86 -75.47 -24.50 43.46 18.93 37.61 20.65 11.74 13.64 17.13 18.77 0.43 15.77 1.86 16 G H G 32.69 6.38 19.28 26.45 94.06 61.05 -70.57 -25.08 39.11 10.14 50.75 10.87 11.11 18.47 24.30 24.85 0.82 7.46 2.12 17 C H H 27.52 15.10 14.37 29.80 98.24 55.96 -79.76 -15.24 36.65 11.05 52.30 18.49 8.65 10.99 26.67 24.90 0.29 7.77 2.25 18 V C H 57.20 11.39 14.96 26.86 101.33 65.98 -86.26 -14.13 43.21 15.89 40.90 26.46 9.68 8.96 28.18 11.32 0.34 10.86 4.20 19 R C C 139.94 4.36 15.17 20.46 104.40 68.86 -83.20 23.46 57.14 13.06 29.80 33.86 11.97 12.16 23.26 6.26 0.21 8.22 4.05 20 K C C 132.82 4.01 13.19 18.46 104.46 52.35 -84.58 13.99 69.57 7.21 23.21 29.50 18.31 23.05 16.70 5.73 0.15 3.98 2.58 21 S C C 65.85 5.67 11.01 18.06 106.74 62.68 -86.24 65.33 83.37 3.25 13.38 35.03 19.88 29.35 7.59 5.05 0.02 1.62 1.45 22 V C C 98.78 4.58 10.84 16.88 99.59 64.53 -79.36 -18.80 84.29 3.98 11.73 31.92 26.80 26.65 5.56 5.20 0.03 1.78 2.06 23 N C C 95.75 4.43 10.36 16.35 107.09 59.04 -95.76 82.80 87.50 4.27 8.23 47.57 23.05 17.13 3.09 4.72 0.01 1.83 2.60 24 K C T 145.55 3.24 10.78 15.74 100.35 -154.54 -71.63 2.45 78.24 1.87 19.89 16.44 16.51 45.59 4.86 14.48 0.02 0.97 1.12 25 G C T 56.40 2.24 13.26 16.26 99.85 45.35 -63.55 -5.65 79.84 1.69 18.46 14.62 17.65 47.82 3.66 14.41 0.01 0.94 0.88 26 S C C 54.74 8.38 10.45 20.07 108.47 96.80 -88.33 104.63 75.20 6.24 18.55 38.74 22.50 14.70 3.77 14.11 0.02 3.17 3.00 27 R C C 148.66 4.60 15.40 21.31 106.71 -139.25 -91.15 75.01 82.04 10.27 7.69 51.28 16.42 14.51 2.31 5.37 0.01 6.72 3.38 28 G C C 26.11 10.69 15.32 26.74 113.86 -114.16 92.89 168.10 78.52 18.08 3.40 44.41 21.83 13.05 0.60 2.98 0.00 15.05 2.09 29 V C E 51.98 13.38 15.08 28.91 121.10 -85.33 -108.02 135.76 51.47 47.96 0.56 43.87 6.11 1.03 0.14 0.47 0.00 46.70 1.69 30 S E E 43.09 10.76 17.90 29.41 123.95 -163.95 -112.87 144.35 20.54 79.27 0.19 17.86 2.38 0.30 0.06 0.13 0.00 78.32 0.95 31 R E E 105.38 11.27 17.08 28.85 125.44 -157.10 -122.23 138.59 9.16 90.74 0.10 7.80 1.01 0.13 0.03 0.05 0.00 90.69 0.29 32 Y E E 65.88 13.11 16.25 30.34 125.38 -166.07 -122.48 138.43 3.81 96.15 0.03 3.59 0.16 0.02 0.01 0.01 0.00 96.04 0.17 33 I E E 73.61 9.36 18.22 28.77 121.01 -158.20 -113.20 131.80 3.90 96.07 0.03 3.75 0.13 0.02 0.01 0.01 0.00 95.92 0.17 34 T E E 33.66 13.69 14.43 29.21 127.26 -172.44 -121.89 147.98 8.64 91.30 0.06 7.94 0.50 0.05 0.02 0.02 0.00 91.17 0.28 35 Q E E 100.51 6.47 17.95 25.58 121.07 -145.00 -109.93 135.31 17.30 82.59 0.12 15.19 1.84 0.16 0.04 0.06 0.00 81.94 0.77 36 K E E 85.40 10.74 12.77 24.47 120.82 -146.19 -99.85 141.44 42.32 57.47 0.21 38.92 2.80 0.24 0.10 0.13 0.00 55.08 2.74 37 N C C 58.24 7.08 12.53 21.52 116.74 -118.94 -79.56 149.34 71.23 28.53 0.24 69.28 1.80 0.40 0.09 0.12 0.00 25.35 2.95 38 R C T 158.84 4.56 11.24 17.03 94.49 -109.79 -67.78 -23.73 95.42 1.76 2.81 6.73 22.69 66.15 0.39 2.32 0.00 1.27 0.44 39 H C T 148.33 1.56 11.35 13.24 99.99 55.17 -87.37 -2.64 96.78 0.85 2.38 4.57 23.81 68.49 0.25 2.04 0.00 0.51 0.34 40 N C S 107.36 4.27 10.10 15.88 103.79 36.47 -90.16 49.80 94.73 2.97 2.30 37.87 38.89 17.79 0.35 2.17 0.00 1.38 1.54 41 T C C 79.79 4.88 10.25 16.92 115.90 158.78 -99.69 131.04 96.83 2.67 0.50 74.58 21.02 1.32 0.21 0.28 0.00 1.30 1.27 42 P C C 79.11 5.89 11.17 18.71 113.05 -108.53 -67.96 149.21 90.39 3.81 5.80 70.09 12.25 7.74 2.03 3.94 0.00 2.10 1.85 43 S C C 68.36 5.25 11.57 18.34 112.42 -119.32 -81.13 138.89 82.81 4.88 12.31 62.51 11.47 8.61 4.71 7.82 0.00 2.91 1.97 44 R C C 152.14 4.93 12.31 18.69 98.83 -130.21 -78.39 -8.47 67.27 9.85 22.88 36.86 20.50 11.47 9.93 12.00 0.07 6.73 2.44 45 L C C 87.21 8.14 11.78 20.92 107.10 71.42 -86.60 69.61 50.33 18.32 31.35 33.90 9.41 8.07 12.54 17.93 0.06 15.72 2.36 46 E C C 101.01 6.60 15.36 22.96 108.35 77.92 -85.82 113.70 43.64 25.50 30.86 30.50 8.33 6.76 12.49 16.71 0.08 23.17 1.96 47 L C E 60.61 14.05 11.96 25.93 109.08 77.35 -86.21 113.36 36.85 34.25 28.90 28.83 4.90 4.75 11.40 15.79 0.04 32.53 1.76 48 R E E 130.27 7.34 16.62 24.72 104.52 110.35 -92.84 9.84 36.04 46.84 17.12 26.11 7.09 5.02 7.02 8.69 0.04 44.56 1.48 49 K E E 104.36 7.45 17.71 25.81 119.87 56.96 -110.02 138.11 26.04 61.51 12.46 15.78 6.81 6.09 4.02 6.88 0.06 58.97 1.39 50 F E E 78.68 12.18 14.96 27.73 119.89 -126.42 -101.39 138.23 19.34 77.47 3.18 13.33 4.28 1.46 2.06 1.52 0.06 58.22 19.07 51 C C C 21.72 14.42 11.68 27.58 111.05 -135.01 -95.07 121.69 83.51 16.30 0.19 79.62 3.27 0.48 0.06 0.11 0.00 14.94 1.50 52 P C T 86.14 4.61 16.37 22.33 92.93 -146.85 -66.35 -23.89 98.46 0.53 1.01 1.90 18.15 78.47 0.10 0.86 0.00 0.42 0.11 53 Y C T 137.57 5.29 14.77 20.48 98.12 50.11 -86.79 -28.50 98.06 0.88 1.06 1.41 18.49 78.32 0.09 0.89 0.00 0.61 0.17 54 C C T 46.11 9.30 11.26 21.90 107.55 34.88 -106.91 3.51 75.70 22.45 1.84 25.87 19.31 31.61 0.35 1.72 0.01 17.42 3.70 55 Y C C 162.31 4.12 13.97 19.51 96.31 -136.75 49.30 8.19 72.15 27.03 0.82 36.09 23.70 12.19 0.17 0.66 0.00 25.79 1.40 56 K C E 118.59 3.17 17.10 21.28 125.78 100.41 -108.15 151.04 62.56 36.96 0.48 20.20 34.16 6.63 0.08 0.41 0.00 37.99 0.53 57 H E E 87.12 12.15 13.71 26.30 118.16 -110.93 -89.87 135.94 28.57 71.23 0.21 25.15 2.14 0.51 0.06 0.16 0.00 71.41 0.57 58 T E E 39.57 11.74 16.45 29.51 126.38 -170.19 -124.36 140.21 4.44 95.54 0.02 4.34 0.21 0.03 0.01 0.01 0.00 94.97 0.43 59 I E E 74.16 10.33 18.17 29.40 116.84 -133.08 -94.91 128.64 3.65 96.32 0.02 3.51 0.18 0.03 0.01 0.01 0.00 95.97 0.29 60 H E E 59.03 13.73 16.00 30.09 125.72 -173.49 -117.82 146.59 10.05 89.83 0.12 8.51 1.15 0.28 0.03 0.08 0.00 89.65 0.30 61 G E E 22.36 9.54 18.57 28.97 137.26 -94.84 -151.63 173.30 12.61 87.20 0.19 9.27 2.73 0.75 0.03 0.14 0.00 86.80 0.27 62 E E E 85.37 9.82 16.91 27.59 125.32 -106.97 -117.32 143.07 9.51 90.35 0.14 8.21 0.96 0.31 0.04 0.09 0.00 89.75 0.63 63 I E E 67.56 11.48 12.06 24.49 120.35 -156.25 -110.78 134.28 13.39 86.44 0.17 11.83 1.22 0.40 0.06 0.11 0.00 85.31 1.07 64 K E E 132.26 3.86 12.28 18.08 118.13 -151.44 -102.87 136.24 29.69 70.16 0.14 28.07 0.81 0.25 0.05 0.08 0.00 69.31 1.41 65 K C C 145.18 3.91 12.35 18.15 109.73 -114.69 -77.05 129.35 99.29 0.70 0.01 99.22 0.12 0.04 0.00 0.00 0.00 0.59 0.02