# 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 61.41 12.73 11.14 24.06 118.75 -163.56 -101.43 132.36 99.01 0.91 0.08 98.41 0.82 0.06 0.07 0.01 0.00 0.36 0.27 1 H C C 104.94 4.53 12.76 18.73 113.33 -112.94 -76.57 140.50 97.10 0.50 2.40 96.10 0.61 0.36 2.47 0.09 0.00 0.16 0.22 2 K H H 146.83 2.17 12.29 15.75 93.61 -120.57 -60.40 -35.41 10.76 0.06 89.17 1.41 1.07 8.12 86.21 3.11 0.02 0.03 0.03 3 S H H 60.58 3.55 13.07 17.84 93.32 54.49 -66.59 -37.59 8.72 0.13 91.15 1.48 0.91 6.47 87.20 3.78 0.03 0.08 0.04 4 V H H 50.32 7.42 12.02 21.39 93.38 50.33 -66.61 -40.48 3.85 0.22 95.93 1.20 0.56 2.25 90.53 5.24 0.02 0.18 0.04 5 A H H 46.37 4.29 13.67 19.62 91.89 51.77 -63.76 -40.25 4.43 0.26 95.31 1.43 0.56 2.56 90.26 4.92 0.01 0.21 0.04 6 E H H 105.04 2.75 16.07 19.15 92.14 52.27 -66.06 -34.69 13.40 0.28 86.33 1.88 0.93 10.58 78.92 7.39 0.03 0.20 0.07 7 R H H 84.82 10.39 12.29 23.72 92.10 58.18 -67.56 -26.97 15.33 0.20 84.47 2.38 1.17 10.44 57.11 28.65 0.03 0.12 0.08 8 K H T 115.13 7.33 13.97 22.66 91.42 67.22 -67.19 -22.99 39.19 0.09 60.72 1.13 1.33 36.48 33.47 27.45 0.02 0.05 0.06 9 N C T 125.47 1.28 16.91 17.34 94.77 52.38 -92.44 0.06 53.97 0.10 45.93 2.17 2.39 49.53 16.86 28.91 0.01 0.04 0.09 10 W C C 75.58 12.55 7.91 21.03 114.34 112.16 -75.88 135.12 92.45 3.89 3.66 70.30 20.66 0.92 3.03 0.52 0.00 0.35 4.21 11 H C T 140.79 2.05 17.28 19.13 103.38 -124.75 -70.53 -27.42 53.50 0.63 45.86 7.30 10.76 34.24 23.81 22.95 0.06 0.28 0.60 12 K C T 100.77 7.72 14.43 22.93 101.00 20.98 -79.84 16.00 53.00 1.18 45.81 3.50 8.38 39.67 23.46 22.91 0.42 0.50 1.17 13 Y H G 75.69 13.63 11.77 25.32 114.17 37.84 -86.62 132.17 42.61 1.54 55.85 3.45 6.80 30.64 25.23 30.76 0.91 0.64 1.57 14 G H G 38.20 6.27 16.71 23.78 107.16 13.79 74.07 -91.44 45.98 1.09 52.93 4.47 7.90 31.85 18.85 35.12 0.22 0.45 1.13 15 S C T 79.06 2.45 17.81 20.00 94.57 41.70 -78.65 -13.82 59.30 1.20 39.50 7.66 10.76 39.60 9.41 30.76 0.05 0.52 1.24 16 E C T 53.76 13.13 9.41 22.90 97.07 65.38 -91.42 1.99 75.78 2.46 21.77 30.17 14.25 30.96 5.52 15.77 0.02 0.85 2.46 17 K C T 145.46 3.35 11.50 17.22 110.67 124.61 -63.75 129.85 98.65 0.35 1.00 1.97 3.39 93.38 0.19 0.60 0.00 0.15 0.34 18 G C T 68.82 0.34 14.03 11.79 95.37 14.37 81.93 0.48 99.67 0.08 0.24 1.04 5.01 93.62 0.02 0.24 0.00 0.05 0.02 19 S C C 54.90 6.60 8.16 16.70 120.15 117.54 -92.23 141.70 98.51 1.41 0.08 60.55 37.42 0.33 0.02 0.05 0.00 0.27 1.38 20 P C C 111.50 1.39 13.86 15.22 107.97 -103.62 -66.71 152.65 98.99 0.75 0.25 60.63 28.76 9.36 0.03 0.32 0.00 0.29 0.61 21 A C S 82.47 3.12 12.49 17.08 112.07 -75.88 -76.22 140.45 98.23 1.33 0.44 21.71 61.62 14.70 0.03 0.56 0.00 0.70 0.67 22 G C S 30.40 5.75 14.76 22.00 134.62 64.99 130.58 -174.80 95.25 4.37 0.38 28.48 63.88 2.94 0.06 0.36 0.00 1.89 2.40 23 P C C 69.80 7.78 12.44 21.73 113.28 -34.03 -71.06 141.90 94.52 5.07 0.41 82.97 9.73 1.34 0.10 0.34 0.00 1.79 3.72 24 S C C 52.53 4.99 13.83 20.38 121.51 -152.86 -101.39 150.95 93.81 5.78 0.41 86.85 5.01 0.54 0.21 0.15 0.00 1.38 5.87 25 A C T 84.25 3.76 11.02 16.78 92.07 -112.95 -61.71 -29.02 75.34 0.36 24.30 2.63 5.87 67.43 8.28 15.26 0.01 0.17 0.35 26 V C T 125.48 0.90 13.81 13.87 92.96 59.00 -74.51 -18.14 76.06 0.17 23.77 1.45 4.70 70.76 8.53 14.25 0.01 0.08 0.20 27 T C T 76.99 5.23 11.52 18.24 101.09 41.47 -98.64 -9.60 74.61 0.99 24.41 5.18 9.50 59.14 10.64 14.17 0.07 0.51 0.80 28 A C C 46.38 11.95 8.09 19.91 112.96 82.23 -92.25 118.81 79.37 9.76 10.87 56.86 14.39 7.16 7.60 3.44 0.02 4.83 5.70 29 R C C 160.28 2.31 12.84 16.45 118.03 128.48 -102.90 137.61 69.34 26.07 4.59 54.35 9.66 4.14 2.89 1.95 0.02 12.04 14.95 30 L C C 130.22 2.51 9.28 13.76 114.58 -124.14 -83.57 135.82 73.93 19.69 6.38 39.97 17.52 17.69 2.87 3.37 0.12 11.86 6.61 31 G C C 55.29 2.49 9.86 13.67 118.18 16.69 87.65 161.90 89.08 7.49 3.43 43.61 25.05 21.01 0.84 2.59 0.00 5.47 1.44 32 E C C 137.95 2.10 9.84 13.15 118.33 -26.45 -89.19 146.16 87.05 9.28 3.68 42.25 37.92 7.50 0.90 2.64 0.00 7.65 1.14 33 E C C 157.11 1.34 9.50 12.16 112.49 -104.27 -79.35 129.79 62.21 34.18 3.61 48.49 8.91 4.01 0.90 2.51 0.00 33.71 1.47 34 V E E 94.84 5.11 7.18 14.26 122.19 -169.44 -118.64 137.07 27.60 71.58 0.81 25.79 1.60 0.31 0.48 0.33 0.00 69.59 1.90 35 E E E 151.11 1.18 11.08 12.99 116.89 -143.56 -101.95 130.32 21.66 77.53 0.81 20.42 0.96 0.24 0.52 0.25 0.00 76.75 0.87 36 L E E 106.23 6.10 7.58 15.41 117.70 -157.29 -103.89 132.39 27.60 71.18 1.23 25.74 1.39 0.33 0.81 0.37 0.00 70.56 0.81 37 R E E 169.37 1.62 12.52 15.13 117.82 -158.69 -106.48 131.08 32.03 67.09 0.87 30.68 1.09 0.24 0.56 0.26 0.00 66.08 1.10 38 L E E 107.48 5.66 9.19 16.78 113.93 -126.38 -77.99 137.68 44.55 53.90 1.55 41.85 1.99 0.58 1.00 0.55 0.00 50.90 3.12 39 S C C 60.38 4.74 9.87 16.42 122.57 -156.88 -103.61 156.02 84.67 12.39 2.93 78.02 5.01 1.56 1.95 0.97 0.00 10.32 2.18 40 R C T 179.88 1.52 11.30 13.53 96.43 -124.94 -73.50 -20.83 70.34 3.15 26.51 22.72 20.48 27.56 22.44 3.87 0.10 1.87 0.96 41 N C C 96.46 2.61 11.39 15.03 99.70 58.41 -83.20 15.86 69.48 1.08 29.44 30.81 12.04 26.85 25.81 3.48 0.02 0.47 0.52 42 W H H 115.66 5.92 10.01 17.79 94.47 100.06 -65.10 -38.68 20.36 0.33 79.31 15.61 2.75 3.71 75.09 2.57 0.00 0.15 0.11 43 K H H 124.48 2.06 13.29 15.88 92.40 53.62 -64.45 -40.59 6.99 0.20 92.81 5.12 1.15 1.94 89.87 1.76 0.00 0.11 0.04 44 Q H H 104.19 1.52 13.85 15.06 92.36 50.90 -65.24 -40.00 4.01 0.23 95.76 2.39 0.72 1.55 93.30 1.82 0.01 0.17 0.04 45 A H H 49.33 3.15 11.89 16.58 92.04 51.32 -65.11 -40.03 4.15 0.26 95.59 2.20 0.71 1.72 93.68 1.45 0.01 0.19 0.05 46 E H H 95.16 2.67 11.76 15.61 92.26 50.99 -65.13 -39.71 5.55 0.23 94.21 2.93 0.85 2.30 92.37 1.32 0.01 0.16 0.06 47 E H H 114.71 1.47 11.83 13.48 92.33 51.77 -65.81 -39.01 8.26 0.19 91.55 3.99 0.94 3.68 89.61 1.59 0.01 0.11 0.06 48 E H H 122.63 1.49 10.62 12.63 92.93 52.16 -67.37 -35.97 14.74 0.18 85.08 6.01 1.51 7.21 82.87 2.23 0.02 0.09 0.07 49 R H H 161.12 1.62 9.65 12.17 93.77 54.61 -69.53 -32.55 29.06 0.32 70.62 9.82 2.70 15.78 69.04 2.34 0.02 0.14 0.15 50 I C H 126.49 1.64 8.85 11.45 97.21 53.63 -80.44 -19.46 51.64 0.43 47.94 27.01 1.65 21.15 48.28 1.49 0.00 0.17 0.24 51 Q C C 132.48 2.11 10.70 14.03 103.13 85.05 -78.95 46.29 99.69 0.06 0.25 98.98 0.24 0.47 0.24 0.01 0.00 0.03 0.02