# 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 113.08 6.12 10.03 17.66 116.39 -161.02 -93.01 134.29 99.94 0.05 0.01 99.90 0.05 0.01 0.00 0.00 0.00 0.02 0.00 1 A C C 82.84 2.31 9.85 13.83 115.69 -148.86 -95.02 138.45 93.31 6.01 0.68 92.66 0.70 0.74 0.35 0.18 0.00 2.70 2.68 2 L C C 116.98 3.60 8.16 13.85 116.51 -127.09 -88.69 136.68 94.50 3.97 1.53 83.27 9.66 1.60 0.67 0.78 0.00 2.55 1.48 3 P C C 83.91 5.26 8.02 15.19 112.92 -108.35 -68.80 145.91 87.57 4.10 8.33 79.39 4.39 4.24 2.19 5.84 0.00 2.81 1.14 4 R C C 180.32 1.78 10.27 13.19 107.12 -137.67 -84.82 96.79 77.31 6.97 15.72 48.75 18.32 10.45 3.35 12.63 0.01 4.74 1.75 5 N C C 119.11 2.37 10.00 13.85 111.29 33.68 -92.76 122.23 74.20 9.90 15.90 43.70 18.71 11.96 3.30 13.00 0.02 7.24 2.08 6 V C C 103.25 4.41 9.82 15.64 101.10 -137.25 -85.44 -12.47 77.89 11.80 10.31 50.00 19.53 8.36 3.18 7.32 0.02 7.47 4.13 7 I C C 81.40 8.14 8.20 17.64 118.77 66.05 -104.19 132.35 92.00 7.06 0.95 52.71 38.09 2.01 0.36 0.54 0.00 4.28 2.00 8 P C C 95.13 2.83 13.45 17.39 112.03 -109.18 -68.88 145.61 96.46 2.96 0.58 73.27 20.47 2.75 0.15 0.44 0.00 1.97 0.95 9 M C C 120.77 5.68 11.20 18.89 116.17 -115.71 -92.67 134.99 97.25 2.55 0.19 65.91 30.85 0.74 0.06 0.12 0.00 1.21 1.10 10 P C C 59.74 10.71 10.87 22.47 115.11 -105.93 -68.17 151.22 98.07 1.52 0.41 85.09 9.64 3.33 0.07 0.40 0.00 0.91 0.55 11 R C C 173.07 2.51 16.49 19.53 104.31 -132.11 -86.02 39.51 92.95 6.37 0.68 67.81 19.93 4.93 0.14 0.65 0.00 3.19 3.35 12 S C C 38.25 13.55 11.39 25.11 122.45 90.65 -100.84 148.44 90.07 9.32 0.61 60.97 23.77 5.30 0.10 0.65 0.00 6.99 2.22 13 R C S 128.73 6.83 19.34 26.84 104.30 -154.60 -99.09 2.96 84.25 15.50 0.25 31.78 50.19 2.65 0.03 0.26 0.00 14.25 0.85 14 F E E 57.23 15.43 16.01 31.52 125.07 77.83 -108.63 144.84 34.45 65.47 0.08 28.70 4.72 0.37 0.01 0.09 0.00 65.02 1.10 15 L E E 30.73 15.55 18.78 34.91 124.66 -158.55 -116.82 141.50 7.40 92.59 0.01 6.58 0.51 0.02 0.00 0.01 0.00 92.68 0.20 16 R E E 101.26 9.41 22.61 32.40 113.06 -126.85 -87.56 126.82 1.60 98.40 0.00 1.42 0.07 0.00 0.00 0.00 0.00 98.48 0.02 17 V E E 12.42 21.04 15.80 37.06 126.19 -171.65 -122.42 141.01 0.79 99.21 0.00 0.72 0.02 0.00 0.00 0.00 0.00 99.24 0.02 18 K E E 92.03 6.75 22.65 29.92 118.19 -144.44 -105.98 130.45 2.54 97.46 0.00 2.48 0.06 0.00 0.00 0.00 0.00 96.81 0.66 19 C C C 10.28 19.19 10.69 30.66 109.22 -125.85 -78.14 122.15 84.42 15.57 0.01 85.16 0.47 0.03 0.00 0.00 0.00 13.84 0.49 20 I C T 106.58 4.29 16.92 22.48 93.74 -151.44 -68.16 -27.07 99.34 0.16 0.51 0.48 7.97 90.89 0.01 0.51 0.00 0.09 0.04 21 D C T 105.50 2.51 15.49 18.48 97.91 47.08 -79.49 -36.81 99.44 0.07 0.49 0.08 3.88 95.60 0.01 0.38 0.00 0.02 0.03 22 C C T 64.05 5.80 12.74 20.14 102.71 21.15 -106.65 -11.58 99.39 0.18 0.43 0.45 4.84 94.21 0.01 0.37 0.00 0.09 0.03 23 G C C 50.33 3.32 14.54 19.17 95.57 -119.21 78.82 5.68 98.73 1.14 0.13 87.10 8.89 2.72 0.03 0.10 0.00 0.71 0.45 24 N C C 70.17 6.21 14.00 22.11 118.64 136.66 -78.34 147.35 96.06 3.91 0.03 91.89 4.06 0.21 0.00 0.02 0.00 3.49 0.33 25 E E E 102.61 9.23 15.89 26.25 121.94 -140.67 -110.58 136.63 7.64 92.36 0.01 7.18 0.34 0.01 0.00 0.00 0.00 91.93 0.53 26 Q E E 48.74 14.74 16.00 31.14 129.70 -174.95 -131.05 145.96 0.78 99.22 0.00 0.69 0.03 0.00 0.00 0.00 0.00 99.27 0.01 27 I E E 76.40 9.48 20.88 31.08 117.23 -131.75 -99.81 129.83 0.34 99.66 0.00 0.31 0.01 0.00 0.00 0.00 0.00 99.68 0.01 28 V E E 24.95 18.11 15.81 34.17 122.02 -166.57 -114.91 133.52 3.71 96.28 0.00 3.58 0.06 0.00 0.00 0.00 0.00 96.25 0.10 29 F E E 73.37 10.64 17.94 29.48 119.72 -144.32 -101.28 140.00 26.95 73.00 0.06 23.91 1.79 0.16 0.01 0.04 0.00 73.46 0.63 30 S C S 58.23 9.52 16.84 26.79 102.84 -140.47 -88.28 -3.98 85.42 14.34 0.24 20.29 58.80 5.39 0.02 0.25 0.00 14.67 0.59 31 H C S 111.30 5.04 17.95 23.90 114.52 61.17 -108.92 115.06 91.68 7.70 0.63 30.30 55.25 6.37 0.07 0.62 0.00 6.27 1.12 32 P C C 53.33 13.86 12.15 26.17 106.27 -138.33 -71.87 115.55 90.50 7.01 2.49 41.96 23.86 24.78 0.22 2.70 0.00 5.40 1.09 33 A C C 66.83 6.32 17.32 24.28 101.49 58.09 -90.04 18.16 77.24 20.56 2.20 36.78 19.63 20.77 0.17 2.33 0.00 19.16 1.15 34 T C E 57.74 8.89 16.12 26.21 126.30 104.60 -110.74 149.23 52.85 46.17 0.98 33.82 16.80 2.63 0.14 0.84 0.00 44.65 1.11 35 R E E 130.06 6.81 19.99 27.68 114.77 -108.39 -79.62 135.93 21.63 78.26 0.11 20.45 1.03 0.11 0.03 0.07 0.00 77.45 0.86 36 V E E 13.43 21.72 13.30 34.95 125.17 -168.09 -119.78 137.70 10.11 89.87 0.02 9.37 0.54 0.04 0.01 0.01 0.00 89.46 0.56 37 R E E 121.97 5.08 23.65 29.32 119.57 -147.37 -107.67 132.72 6.88 93.10 0.02 6.36 0.29 0.03 0.02 0.01 0.00 86.63 6.66 38 C C C 10.29 20.87 10.33 31.42 110.21 -117.81 -70.11 129.39 82.20 17.77 0.03 83.03 0.47 0.06 0.01 0.02 0.00 15.32 1.10 39 N C T 101.38 4.40 18.06 23.56 93.34 -148.02 -71.07 -24.55 99.61 0.18 0.21 0.55 7.79 91.31 0.01 0.18 0.00 0.12 0.04 40 V C T 91.09 4.79 16.02 21.97 100.63 42.26 -84.59 -41.27 99.66 0.17 0.17 0.10 3.23 96.42 0.00 0.10 0.00 0.06 0.08 41 C C T 68.92 4.78 14.01 20.22 102.50 18.69 -106.80 -14.68 99.77 0.08 0.15 0.36 3.51 95.96 0.01 0.11 0.00 0.04 0.01 42 G C C 46.74 4.71 14.32 20.75 95.16 -121.95 78.79 7.65 99.36 0.54 0.10 89.85 6.18 3.33 0.03 0.07 0.00 0.35 0.19 43 A C C 47.80 6.14 15.75 23.87 118.10 146.59 -74.18 144.07 94.87 5.11 0.01 92.84 2.62 0.07 0.00 0.01 0.00 3.75 0.71 44 T E E 70.71 8.94 19.33 28.97 109.97 -110.79 -75.11 127.42 1.29 98.71 0.00 1.33 0.04 0.00 0.00 0.00 0.00 95.27 3.36 45 L E E 16.68 20.32 17.36 37.95 100.00 175.27 -95.91 -28.56 5.71 94.29 0.00 3.86 1.18 0.01 0.00 0.00 0.00 94.93 0.02 46 V E E 11.37 20.74 16.45 37.64 138.77 8.74 -147.28 150.30 0.40 99.60 0.00 0.37 0.02 0.00 0.00 0.00 0.00 99.60 0.01 47 E E E 99.60 5.50 24.27 30.44 122.45 -158.91 -124.62 132.93 0.85 99.15 0.00 0.80 0.02 0.00 0.00 0.00 0.00 99.16 0.02 48 P E E 46.07 17.71 11.05 27.91 113.50 -118.69 -72.05 137.94 8.20 91.78 0.02 7.45 0.37 0.04 0.00 0.01 0.00 91.93 0.19 49 T E E 82.65 3.80 15.93 21.21 122.44 174.72 -134.36 125.82 33.10 66.31 0.59 23.36 8.39 2.68 0.14 0.57 0.00 61.40 3.47 50 G C T 65.66 0.77 15.15 14.77 95.92 -18.63 60.96 30.76 96.35 2.18 1.47 2.29 29.04 65.03 0.04 1.69 0.00 1.60 0.32 51 G C T 48.58 6.04 14.06 21.12 96.55 -46.15 82.84 2.31 97.57 0.99 1.44 2.57 30.34 64.53 0.04 1.65 0.00 0.69 0.17 52 K E E 105.97 5.55 18.27 25.15 127.37 93.21 -118.41 145.24 31.93 67.76 0.31 19.38 12.28 2.53 0.07 0.30 0.00 62.63 2.80 53 G E E 10.19 19.42 13.09 32.35 118.25 -131.94 -85.21 144.90 18.97 80.99 0.05 16.52 1.36 0.15 0.01 0.03 0.00 81.59 0.33 54 I E E 67.53 8.33 23.77 32.63 121.53 -155.14 -116.43 130.38 5.21 94.77 0.02 4.62 0.35 0.04 0.01 0.01 0.00 94.81 0.17 55 I E E 17.82 22.37 15.02 37.25 119.01 -161.72 -107.12 129.24 5.31 94.67 0.03 5.05 0.22 0.02 0.01 0.01 0.00 94.31 0.37 56 R E E 109.49 6.39 24.58 31.17 117.62 -158.18 -104.51 129.78 22.51 77.41 0.09 19.82 1.80 0.18 0.02 0.05 0.00 77.60 0.52 57 A E E 16.91 21.45 12.66 33.38 133.10 166.28 -133.87 153.45 32.23 67.63 0.15 25.43 5.31 0.58 0.02 0.12 0.00 68.31 0.24 58 K E E 117.20 3.69 23.55 27.55 122.92 -143.78 -117.49 138.58 18.89 81.01 0.10 16.52 1.52 0.26 0.02 0.07 0.00 81.38 0.23 59 I E E 59.06 16.15 11.81 27.87 110.28 -119.78 -78.22 123.25 10.21 89.72 0.07 9.90 0.21 0.04 0.02 0.03 0.00 89.50 0.30 60 L E E 86.45 5.01 16.90 23.19 100.48 177.45 -93.62 -33.35 13.77 86.07 0.16 10.16 2.89 0.48 0.02 0.12 0.00 86.20 0.13 61 E E E 101.05 3.40 18.65 22.88 137.08 -1.11 -151.54 150.96 6.81 93.07 0.12 5.05 1.15 0.33 0.02 0.09 0.00 93.19 0.18 62 V E E 77.80 10.98 11.36 23.10 117.53 -141.87 -106.40 126.77 10.34 89.51 0.15 9.38 0.60 0.14 0.04 0.09 0.00 89.37 0.39 63 L E E 77.84 7.42 9.92 19.14 115.07 -155.92 -97.13 132.60 46.59 53.17 0.24 45.79 0.61 0.24 0.07 0.15 0.00 52.39 0.75 64 E C C 149.67 1.80 13.87 16.35 110.31 -120.52 -84.79 125.84 99.43 0.57 0.00 99.40 0.09 0.02 0.00 0.00 0.00 0.48 0.01