# 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 104.44 7.66 14.61 23.01 113.56 -165.29 -96.54 123.97 99.68 0.31 0.01 99.60 0.14 0.04 0.01 0.00 0.00 0.17 0.04 1 F C C 96.97 9.81 10.33 20.99 118.73 -159.70 -99.72 134.89 82.47 15.74 1.79 80.42 1.55 1.03 1.33 0.42 0.00 7.32 7.92 2 S C C 64.62 4.05 13.44 18.77 119.51 -153.96 -103.28 147.51 87.70 8.67 3.63 78.18 7.01 2.25 2.76 1.09 0.00 6.30 2.41 3 L C C 92.58 8.53 10.91 20.39 96.14 -112.70 -65.73 -28.34 62.64 5.34 32.02 34.79 12.20 15.59 25.03 7.05 0.05 3.99 1.31 4 T C C 79.84 5.28 13.19 19.52 98.33 62.23 -75.98 -23.83 59.88 3.47 36.65 30.56 12.54 16.91 29.18 7.43 0.04 2.40 0.94 5 Q C H 102.57 5.31 14.12 20.47 97.60 56.93 -76.80 -20.38 53.65 5.74 40.61 32.14 11.00 10.68 32.45 8.18 0.05 4.28 1.22 6 T C H 60.64 9.04 13.14 23.16 103.17 69.44 -84.85 -11.17 46.59 9.45 43.97 32.01 7.66 6.97 37.46 6.60 0.05 7.76 1.48 7 W H H 120.57 8.38 14.94 24.12 104.30 61.88 -85.00 28.62 40.98 15.06 43.96 26.86 6.84 7.12 37.96 6.06 0.10 13.31 1.74 8 L H H 74.25 8.26 15.88 24.89 102.43 63.11 -80.16 -22.87 32.40 23.15 44.45 20.70 5.47 6.02 38.97 5.25 0.12 21.66 1.81 9 I H H 63.55 9.85 16.30 26.86 97.32 54.10 -75.21 -35.00 26.27 26.40 47.33 17.13 4.53 4.67 42.63 4.35 0.12 24.68 1.91 10 A H H 41.71 10.19 15.76 26.64 97.01 55.72 -70.75 -37.80 27.15 20.07 52.78 16.08 4.98 6.27 45.91 5.78 0.13 19.55 1.32 11 H H H 96.63 7.81 16.90 25.20 96.46 52.07 -71.90 -32.74 28.81 15.76 55.43 14.33 5.78 9.43 45.18 8.74 0.29 14.92 1.33 12 W H H 115.87 8.10 16.64 25.36 97.68 53.03 -77.81 -34.66 30.07 14.73 55.20 13.33 5.88 11.54 43.67 10.27 0.39 13.51 1.41 13 Y H H 89.96 10.14 15.65 26.41 102.46 47.49 -90.09 -6.76 35.22 18.34 46.43 16.47 7.01 13.13 37.14 8.21 0.58 15.06 2.41 14 C C H 49.70 10.23 14.09 25.34 105.33 73.77 -87.78 34.38 53.25 13.63 33.13 25.47 11.16 16.99 28.78 4.68 0.23 10.49 2.21 15 G C H 34.10 7.53 15.51 23.95 106.97 27.27 -29.04 -40.71 61.78 4.99 33.23 22.23 16.16 23.82 28.15 4.81 0.14 3.61 1.07 16 H H H 108.20 5.96 14.07 21.07 101.22 27.03 -80.09 -20.66 47.90 3.92 48.18 16.49 12.71 19.92 40.48 6.44 0.15 2.92 0.88 17 K H H 122.06 4.13 15.25 20.15 98.63 64.60 -73.39 -22.09 39.38 7.02 53.60 18.30 8.72 13.84 45.55 6.42 0.15 5.82 1.20 18 F H H 83.49 8.59 13.06 22.95 100.07 71.75 -76.04 -27.28 30.42 10.47 59.12 19.00 5.55 7.21 52.12 5.34 0.09 9.29 1.41 19 R H H 104.48 7.86 14.15 23.07 97.58 66.67 -71.83 -37.17 21.89 8.28 69.83 14.48 3.56 5.13 63.64 4.38 0.04 8.00 0.78 20 H H H 98.91 4.91 14.63 20.57 95.28 55.83 -68.29 -37.72 13.95 6.64 79.40 8.14 2.39 4.59 71.58 5.90 0.06 6.83 0.52 21 R H H 119.94 4.16 14.94 19.93 94.31 54.49 -67.86 -38.90 12.31 5.81 81.89 6.37 2.04 4.79 73.50 6.82 0.07 5.93 0.48 22 F H H 82.58 7.60 12.31 21.44 95.42 50.70 -72.83 -36.50 14.18 5.49 80.32 6.97 2.35 5.88 71.95 6.84 0.10 5.34 0.58 23 M H H 86.42 6.52 11.69 19.76 96.63 52.54 -72.81 -31.39 21.11 4.28 74.61 10.50 3.76 8.26 67.44 5.58 0.11 3.65 0.69 24 R H H 153.55 2.47 12.93 16.13 95.34 55.78 -73.66 -27.02 32.70 2.54 64.76 12.08 5.85 16.14 58.45 4.88 0.12 1.76 0.71 25 D C H 82.25 4.55 11.12 17.26 104.09 66.94 -87.56 44.48 50.45 1.61 47.95 21.22 8.37 21.57 42.39 4.91 0.04 0.87 0.64 26 K C H 135.52 4.54 10.63 16.93 99.48 -164.15 -71.24 2.25 56.92 1.62 41.46 22.72 10.53 23.91 28.52 12.64 0.05 0.84 0.80 27 R C T 157.03 2.66 12.15 16.02 102.38 98.93 -85.24 -3.53 65.12 2.15 32.74 24.48 12.50 28.54 20.49 11.81 0.03 1.14 0.99 28 F C C 109.55 7.33 10.18 18.91 111.35 56.97 -95.91 104.43 69.14 4.09 26.77 32.43 16.14 21.49 15.47 10.31 0.05 2.02 2.11 29 H C C 92.01 6.53 11.15 19.48 112.68 -153.04 -100.87 115.77 93.79 1.02 5.19 75.59 16.15 1.79 4.70 0.77 0.00 0.44 0.56 30 P C H 84.86 4.79 12.13 18.60 98.17 -145.25 -65.23 -27.47 57.54 0.74 41.71 28.64 5.56 22.66 35.98 6.40 0.00 0.42 0.33 31 S H H 71.30 3.30 12.92 17.25 100.87 60.72 -75.83 -25.67 47.83 0.90 51.27 21.14 6.41 20.43 43.85 7.26 0.02 0.51 0.38 32 L H H 82.72 6.41 11.53 19.43 97.19 60.14 -71.98 -29.50 24.34 1.37 74.30 16.30 4.36 5.16 65.54 7.33 0.01 0.99 0.32 33 Q H H 103.87 3.99 14.19 19.37 94.99 59.22 -67.35 -39.49 16.79 1.97 81.24 11.83 2.64 3.81 74.41 5.30 0.01 1.69 0.30 34 A H H 59.26 3.44 14.61 18.93 93.94 51.77 -67.06 -39.55 15.55 1.73 82.72 10.64 2.53 3.75 76.45 4.85 0.01 1.51 0.25 35 S H H 53.13 5.17 14.17 20.74 94.79 52.50 -67.82 -38.82 15.72 1.52 82.76 10.52 2.60 4.06 76.90 4.38 0.01 1.26 0.27 36 H H H 98.58 4.73 14.56 20.41 94.29 52.38 -67.97 -38.87 20.07 1.70 78.22 12.62 3.84 5.47 72.80 3.60 0.02 1.24 0.40 37 D H H 78.04 3.26 15.88 19.61 94.14 52.11 -67.66 -39.14 26.86 1.44 71.70 17.98 4.48 5.61 68.19 2.44 0.01 0.81 0.48 38 A H H 53.98 4.14 14.63 20.05 93.28 52.31 -66.09 -40.21 18.43 0.86 80.72 12.45 3.09 4.34 76.80 2.55 0.01 0.45 0.31 39 R H H 126.39 4.31 14.59 19.90 93.06 51.28 -66.92 -39.19 14.43 0.74 84.83 8.15 2.48 5.13 80.30 3.20 0.03 0.45 0.26 40 N H H 84.26 3.57 14.61 19.02 93.72 51.15 -68.12 -37.92 18.25 0.78 80.98 10.10 2.96 6.61 75.71 3.82 0.04 0.47 0.31 41 R H H 130.86 2.70 14.89 18.07 93.73 51.83 -67.53 -38.70 18.67 0.91 80.42 9.39 3.17 7.65 74.69 4.13 0.06 0.57 0.35 42 F H H 103.16 4.79 13.25 19.46 95.24 49.99 -71.59 -34.05 22.74 1.62 75.64 11.33 4.15 8.92 69.58 4.40 0.08 0.97 0.59 43 S H H 56.68 4.93 12.41 18.88 96.00 59.04 -73.05 -28.21 35.90 1.29 62.80 18.10 5.16 12.94 58.89 3.70 0.03 0.71 0.48 44 K H H 136.41 2.38 13.17 16.23 97.68 61.41 -76.72 -18.53 45.43 1.28 53.30 17.88 8.37 19.43 49.16 3.94 0.04 0.67 0.50 45 R H H 133.13 4.20 11.01 16.81 106.89 82.53 -83.47 77.72 46.05 1.83 52.12 23.85 10.06 12.72 47.15 4.54 0.03 1.00 0.64 46 R H H 154.51 2.88 12.59 16.60 100.74 53.12 -75.01 -19.85 44.36 2.43 53.21 23.40 8.47 12.91 46.69 6.21 0.03 1.61 0.68 47 H H H 107.42 4.95 12.38 18.62 105.16 74.06 -84.61 9.89 43.60 4.25 52.16 25.21 7.03 11.97 45.16 6.51 0.05 3.00 1.06 48 F H H 94.32 8.08 10.45 19.80 101.53 71.05 -78.23 -22.27 37.19 5.08 57.73 24.24 6.43 7.89 49.59 7.03 0.05 3.44 1.33 49 K H H 133.27 2.99 13.45 17.44 98.04 68.57 -73.25 -29.59 36.48 3.32 60.20 20.14 6.95 10.73 52.83 6.19 0.05 2.24 0.87 50 T H H 80.22 4.16 12.79 17.83 100.37 51.08 -82.69 -20.08 40.27 2.16 57.57 17.19 9.72 14.30 51.46 5.28 0.07 1.35 0.63 51 N C H 75.79 6.15 11.89 19.56 107.14 54.45 -88.09 71.15 49.81 1.40 48.79 29.10 9.50 11.63 44.26 4.27 0.02 0.71 0.53 52 R H H 132.47 5.54 12.31 19.26 96.07 95.28 -68.09 -30.34 34.13 1.35 64.52 18.87 6.14 10.19 56.69 6.81 0.03 0.79 0.47 53 W H H 155.08 3.03 14.21 17.98 95.16 57.13 -69.19 -35.84 30.13 1.81 68.06 12.92 5.42 12.39 59.74 7.67 0.05 1.34 0.48 54 N H H 82.07 4.89 14.50 20.41 96.96 52.08 -74.72 -26.98 32.59 1.98 65.42 18.58 4.65 10.21 58.03 6.58 0.03 1.39 0.54 55 Y H H 86.11 9.46 11.95 22.57 97.78 64.67 -73.17 -31.67 18.71 1.28 80.01 13.08 3.05 4.55 73.93 4.21 0.01 0.86 0.31 56 Q H H 95.87 4.07 15.21 20.21 94.56 64.06 -66.70 -40.60 9.57 0.80 89.64 5.27 1.68 3.69 83.70 4.83 0.02 0.65 0.15 57 Q H H 97.39 2.56 15.81 18.38 93.26 51.14 -66.50 -39.53 8.89 0.76 90.35 3.75 1.44 4.27 82.92 6.76 0.03 0.69 0.14 58 A H H 41.13 6.01 12.42 20.48 92.73 53.12 -65.18 -38.73 11.11 0.71 88.18 4.17 1.68 5.65 81.01 6.69 0.05 0.58 0.17 59 Y H H 102.95 7.65 10.90 19.91 93.49 52.70 -70.82 -30.74 19.15 1.03 79.82 7.16 2.86 9.74 71.57 7.56 0.05 0.74 0.31 60 R H H 165.07 1.87 12.24 14.95 93.70 61.06 -69.33 -27.23 41.41 1.00 57.60 7.75 5.08 28.31 53.10 4.66 0.09 0.56 0.45 61 D C T 118.03 1.20 11.62 12.96 98.00 50.94 -90.18 -0.33 65.39 0.76 33.86 16.44 6.60 41.83 30.54 3.80 0.02 0.32 0.45 62 M C C 89.89 7.39 6.53 15.32 115.96 106.21 -85.71 137.64 98.72 0.44 0.84 88.24 8.94 1.47 0.68 0.16 0.00 0.16 0.36 63 P C C 101.81 2.25 13.08 16.24 110.21 -105.76 -67.73 144.83 99.93 0.04 0.03 99.74 0.13 0.09 0.01 0.00 0.00 0.01 0.01