# 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 94.65 7.15 12.48 20.75 110.40 -156.16 -92.47 114.26 99.27 0.42 0.31 99.26 0.13 0.07 0.25 0.02 0.00 0.18 0.09 1 L H H 104.68 3.89 10.43 15.78 98.96 109.06 -70.19 -33.84 48.34 3.14 48.52 43.96 1.20 3.96 46.50 1.59 0.00 1.63 1.17 2 R H H 163.30 1.58 10.94 13.08 95.65 57.39 -68.98 -35.71 20.97 1.09 77.94 13.77 3.47 4.91 74.84 2.04 0.01 0.69 0.27 3 Y H H 136.57 2.94 11.79 15.85 97.96 53.78 -72.41 -36.05 11.16 0.94 87.90 7.89 1.79 2.96 83.92 2.54 0.01 0.71 0.18 4 S H H 52.44 6.07 11.79 19.34 94.94 56.01 -67.84 -39.49 6.49 0.71 92.80 4.97 1.00 1.76 89.60 1.99 0.01 0.55 0.11 5 L H H 93.02 3.42 13.95 18.23 93.68 53.84 -66.66 -39.73 2.79 0.27 96.94 1.71 0.47 1.08 95.24 1.25 0.01 0.21 0.04 6 Q H H 107.40 2.22 15.95 18.03 93.68 51.79 -66.47 -39.88 2.56 0.16 97.28 1.23 0.36 1.19 95.98 1.08 0.00 0.12 0.02 7 A H H 44.22 6.73 13.62 21.92 93.59 51.74 -66.14 -40.27 3.15 0.14 96.71 1.24 0.41 1.66 95.28 1.27 0.01 0.11 0.02 8 R H H 112.92 7.86 14.82 23.51 93.45 52.98 -65.89 -38.88 4.03 0.11 95.86 1.29 0.47 2.36 93.79 1.98 0.01 0.07 0.02 9 S H H 65.90 2.97 16.29 19.53 93.05 53.57 -66.78 -35.33 9.29 0.12 90.59 1.68 0.78 6.71 87.43 3.26 0.02 0.08 0.04 10 A H H 65.70 4.14 15.23 20.22 93.53 55.20 -71.17 -24.64 23.32 0.23 76.45 2.58 1.76 18.62 73.09 3.65 0.06 0.12 0.12 11 L H H 67.79 11.44 11.37 23.21 97.59 58.94 -86.18 -2.59 46.22 1.45 52.33 10.52 6.08 30.19 47.19 4.42 0.16 0.70 0.75 12 R C T 156.39 3.93 13.50 19.45 108.43 118.65 -71.69 122.54 73.10 2.84 24.06 8.87 6.36 55.78 22.44 3.64 0.10 1.51 1.30 13 G C T 56.54 2.38 15.23 18.12 99.44 18.20 82.03 0.42 83.05 2.34 14.61 12.22 9.97 60.51 11.14 3.91 0.03 1.55 0.68 14 V C C 68.58 10.35 9.59 20.91 116.48 128.76 -90.92 132.26 77.15 11.71 11.14 54.29 14.43 8.04 7.90 3.73 0.02 8.78 2.79 15 R C C 153.83 3.36 14.57 19.49 118.48 -156.56 -104.02 133.32 65.43 26.49 8.07 51.28 7.56 5.01 5.96 2.81 0.04 20.60 6.73 16 F C C 103.80 10.40 9.94 21.01 119.45 -153.76 -102.73 137.24 65.44 27.32 7.24 49.19 9.30 5.66 4.50 3.22 0.04 21.45 6.65 17 S C C 69.57 4.46 12.20 18.25 119.78 -157.04 -106.73 146.56 75.66 18.33 6.01 53.40 13.21 8.78 2.81 3.24 0.01 14.49 4.07 18 S C C 80.56 3.77 10.05 15.67 109.61 -137.19 -93.16 113.99 86.43 8.32 5.24 43.94 24.26 19.16 1.52 3.42 0.00 5.55 2.14 19 S C C 86.06 2.29 9.96 13.70 107.79 -136.95 -94.14 75.48 93.23 2.98 3.79 42.20 28.98 22.40 0.76 2.92 0.00 1.59 1.15 20 H C C 145.38 2.48 8.74 12.75 106.63 106.88 -90.15 57.25 94.60 2.46 2.95 42.76 34.48 17.41 0.54 2.42 0.00 1.13 1.26 21 S C C 85.36 1.88 10.09 13.22 115.97 61.21 -98.61 135.78 96.11 2.27 1.61 48.86 36.15 10.99 0.29 1.45 0.00 1.01 1.24 22 A C C 75.75 3.28 10.38 15.42 117.17 -99.27 -75.58 147.72 98.00 1.67 0.33 60.53 35.54 1.99 0.08 0.27 0.00 0.72 0.87 23 P C C 76.16 7.67 8.54 17.67 113.75 -104.39 -66.56 147.67 97.94 1.76 0.30 78.88 17.29 1.47 0.08 0.23 0.00 0.69 1.35 24 K C C 143.31 2.19 12.23 15.76 118.53 -135.18 -98.03 140.28 98.24 1.46 0.31 86.52 10.55 0.80 0.10 0.19 0.00 0.45 1.40 25 P C T 105.83 3.25 10.18 15.45 110.61 -96.75 -62.21 139.77 92.20 0.81 6.99 12.44 7.55 71.03 0.61 7.50 0.00 0.46 0.41 26 G C T 56.83 2.47 12.05 15.58 100.09 20.56 82.91 -3.04 91.71 0.79 7.50 10.41 8.13 72.10 0.67 7.89 0.00 0.51 0.29 27 S C C 66.74 5.01 11.14 17.85 110.20 112.86 -85.59 130.23 85.35 4.08 10.58 57.33 16.75 9.18 1.18 11.50 0.00 2.13 1.94 28 T C C 91.27 4.88 11.69 18.27 114.92 -136.40 -100.06 127.14 79.97 14.40 5.63 53.21 18.49 7.63 1.40 4.64 0.01 7.67 6.95 29 I C C 84.38 8.35 10.45 20.30 117.49 -162.51 -99.74 130.79 85.75 13.56 0.69 61.44 23.97 1.15 0.23 0.49 0.00 9.97 2.75 30 P C C 85.65 4.67 13.85 19.95 112.25 -119.67 -71.32 139.67 81.86 15.60 2.54 68.24 9.44 3.54 0.76 1.91 0.00 12.83 3.28 31 F C C 111.98 8.60 10.16 19.85 118.13 -154.57 -105.69 133.67 68.29 24.85 6.86 50.77 10.82 5.93 2.83 4.42 0.06 16.61 8.56 32 Y C C 150.82 3.55 12.26 17.42 114.04 -150.33 -100.72 119.94 71.05 23.60 5.35 57.99 7.03 4.71 2.21 3.39 0.01 17.86 6.80 33 I C C 91.12 7.84 8.85 17.94 109.04 -172.70 -99.73 88.81 76.57 13.71 9.72 45.31 15.15 16.96 3.72 5.66 0.03 9.71 3.45 34 N C C 112.26 2.47 11.36 15.06 108.98 114.07 -93.04 97.64 85.78 4.86 9.36 34.11 27.47 25.24 3.46 5.19 0.01 3.03 1.49 35 K C S 145.65 2.80 10.63 14.87 102.18 -113.48 -81.19 1.50 81.91 3.33 14.75 32.05 35.45 15.25 8.14 5.78 0.02 1.61 1.69 36 K C S 126.70 3.61 11.20 16.21 102.81 73.90 -80.60 -1.16 76.11 3.31 20.58 27.56 28.11 20.99 14.89 5.29 0.05 1.66 1.43 37 P C C 71.66 4.90 12.05 18.44 99.34 51.89 -72.65 -17.85 71.63 2.63 25.74 44.14 10.34 16.25 22.16 4.56 0.01 1.26 1.29 38 L H H 86.43 4.96 12.38 18.96 94.44 58.42 -63.76 -39.73 14.30 0.30 85.39 9.32 2.69 3.37 80.76 3.58 0.01 0.19 0.08 39 P H H 70.07 4.15 14.03 19.50 92.45 52.58 -65.25 -38.45 8.01 0.39 91.60 4.03 1.10 3.28 86.00 5.17 0.02 0.34 0.07 40 T H H 64.01 4.89 14.12 20.48 92.79 51.29 -66.76 -38.93 4.19 0.39 95.41 1.78 0.59 1.99 88.79 6.39 0.02 0.40 0.04 41 L H H 77.54 5.38 13.78 20.66 92.75 51.88 -66.61 -39.34 3.54 0.46 95.99 1.39 0.51 1.78 89.80 5.99 0.02 0.48 0.04 42 L H H 89.40 4.41 14.58 20.07 92.86 51.58 -67.25 -38.07 7.07 1.14 91.79 2.16 0.94 4.14 85.83 5.62 0.07 1.08 0.15 43 Y H H 125.92 4.29 14.19 19.62 94.26 49.43 -73.02 -34.52 13.72 1.82 84.46 3.41 1.94 8.94 78.82 4.82 0.21 1.47 0.39 44 F H H 114.79 4.84 13.36 19.46 99.17 52.68 -78.72 -27.64 25.86 2.90 71.23 7.68 5.09 15.15 64.80 4.12 0.37 1.80 0.98 45 G H H 43.61 4.09 14.21 19.22 98.49 51.52 -66.08 -40.00 42.17 1.73 56.11 8.37 7.11 27.25 48.08 7.07 0.37 1.01 0.74 46 T H H 83.50 3.92 13.91 18.78 100.82 41.74 -83.67 -25.47 48.44 1.81 49.75 8.21 8.86 31.32 41.93 7.51 0.32 1.03 0.81 47 F C H 117.20 5.55 13.66 20.31 100.33 45.49 -85.27 -13.84 51.80 3.89 44.30 13.72 12.67 26.90 35.42 7.17 0.41 2.20 1.53 48 G C H 33.73 7.04 13.91 22.29 99.73 66.29 -61.16 -35.65 52.69 5.13 42.18 27.64 10.98 15.05 32.52 8.91 0.08 3.54 1.26 49 V H H 80.57 6.09 14.65 21.64 97.42 53.57 -72.88 -33.30 29.10 9.29 61.61 14.85 5.94 9.37 40.78 19.89 0.19 7.63 1.34 50 I H H 88.88 6.45 15.26 22.62 96.00 57.86 -71.29 -34.50 22.27 13.75 63.98 10.48 4.36 8.24 42.14 21.25 0.24 11.86 1.43 51 F H H 98.11 7.64 15.09 23.73 96.79 53.54 -75.02 -30.47 26.75 13.22 60.03 12.18 5.09 10.29 36.81 22.70 0.34 10.82 1.76 52 S H H 46.31 7.55 15.70 24.45 94.82 59.90 -68.56 -36.37 30.64 6.57 62.79 15.71 5.79 10.73 51.24 9.86 0.22 5.28 1.19 53 I H H 70.65 7.54 16.19 24.69 93.45 60.51 -64.74 -42.35 10.92 0.84 88.24 6.57 2.17 2.94 85.32 2.16 0.01 0.69 0.12 54 P H H 55.36 7.24 16.27 24.88 92.55 51.61 -65.14 -38.97 7.71 1.05 91.24 4.79 0.91 2.43 88.63 2.11 0.01 1.01 0.10 55 F H H 93.05 6.35 16.63 24.04 92.63 50.93 -66.09 -40.30 3.53 1.48 94.99 1.84 0.52 1.41 92.25 2.24 0.02 1.64 0.10 56 I H H 73.64 6.29 16.36 23.63 92.51 50.65 -65.76 -41.70 3.12 2.68 94.20 1.62 0.43 1.10 92.59 1.38 0.01 2.76 0.11 57 V H H 65.77 5.74 16.00 22.87 92.28 49.95 -65.40 -41.55 3.68 3.80 92.52 1.82 0.48 1.31 91.21 1.19 0.01 3.84 0.14 58 V H H 67.35 4.84 15.28 21.40 92.73 50.07 -65.50 -41.14 5.14 3.08 91.78 2.41 0.66 2.06 89.62 1.66 0.02 3.40 0.15 59 K H H 101.33 4.26 15.11 20.37 93.14 50.98 -66.43 -38.97 9.86 2.04 88.11 3.36 1.23 5.33 85.17 2.49 0.05 2.16 0.21 60 Y H H 110.28 4.94 13.22 19.49 94.27 49.96 -71.03 -34.22 18.20 1.28 80.52 5.68 2.50 10.50 76.79 3.13 0.07 1.05 0.28 61 H H H 107.51 4.19 12.40 17.93 95.18 55.07 -71.32 -32.23 27.53 1.40 71.07 10.71 4.68 13.14 67.10 2.99 0.07 0.87 0.45 62 N H H 95.39 3.64 10.63 15.76 98.58 56.56 -79.77 -15.06 43.42 1.25 55.33 19.16 6.03 19.28 50.97 3.34 0.04 0.62 0.56 63 R C H 156.45 2.55 9.86 13.81 98.71 65.45 -77.30 -15.28 56.69 1.45 41.86 18.39 8.84 29.95 36.91 4.46 0.06 0.71 0.69 64 N C C 120.03 1.95 9.50 12.74 100.94 64.09 -85.55 22.85 73.69 0.88 25.43 38.10 2.54 32.03 23.35 3.06 0.00 0.43 0.49 65 L C C 107.38 4.73 9.91 16.30 102.94 119.57 -81.37 14.09 99.85 0.05 0.11 99.65 0.10 0.15 0.06 0.00 0.00 0.02 0.01