# 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 G C C 48.98 3.19 14.47 18.58 116.43 -144.18 80.82 7.70 99.92 0.08 0.00 99.83 0.08 0.03 0.00 0.00 0.00 0.05 0.00 1 I C C 115.46 4.54 10.16 16.44 114.31 -81.26 -94.53 130.69 92.63 6.68 0.69 89.25 1.10 2.41 0.14 0.35 0.00 6.03 0.72 2 R C C 138.90 5.22 11.07 18.12 118.05 -161.28 -101.85 137.24 69.75 29.06 1.19 50.40 13.83 4.72 0.22 1.04 0.00 28.36 1.43 3 E E E 96.12 8.32 13.25 22.76 116.69 -145.02 -98.13 133.24 41.66 57.56 0.78 32.90 6.79 1.25 0.12 0.57 0.00 57.84 0.52 4 K E E 97.90 8.19 16.44 25.67 122.48 -154.81 -109.87 137.63 12.16 87.65 0.19 10.57 1.08 0.17 0.05 0.11 0.00 87.79 0.24 5 I E E 26.91 17.19 14.41 32.37 124.49 -166.77 -120.95 138.29 3.20 96.78 0.02 2.87 0.14 0.01 0.01 0.01 0.00 96.90 0.07 6 K E E 86.90 8.13 22.69 31.46 117.92 -147.37 -103.86 131.49 1.39 98.60 0.01 1.17 0.06 0.00 0.00 0.00 0.00 98.73 0.02 7 L E E 15.40 21.47 16.06 37.73 121.05 -164.54 -110.76 136.18 0.80 99.20 0.00 0.70 0.02 0.00 0.00 0.00 0.00 99.25 0.02 8 V E E 50.06 8.34 22.16 31.51 122.37 -164.88 -115.68 135.97 1.11 98.89 0.01 1.01 0.04 0.00 0.00 0.00 0.00 98.78 0.16 9 S E E 16.08 16.38 12.15 29.27 115.30 -122.26 -75.76 144.60 26.36 73.58 0.06 24.79 0.86 0.09 0.01 0.03 0.00 73.60 0.62 10 S C T 75.11 4.60 16.62 22.52 93.51 -140.78 -72.42 -18.04 96.45 1.82 1.73 3.89 31.60 61.03 0.07 1.70 0.00 1.45 0.25 11 A C T 70.00 4.39 13.61 19.20 98.92 66.04 -82.89 2.10 96.79 0.86 2.34 1.79 25.86 69.33 0.10 2.16 0.00 0.50 0.27 12 G C S 55.97 2.31 13.96 17.15 100.81 -88.69 86.80 5.03 96.38 1.67 1.95 12.45 46.64 37.11 0.11 2.16 0.00 1.07 0.45 13 T C C 85.26 4.07 13.13 18.35 100.56 116.46 -92.03 -3.47 95.21 4.00 0.79 41.93 30.68 22.81 0.10 0.91 0.00 2.81 0.77 14 G C C 47.45 4.67 13.90 19.81 99.58 -113.19 83.28 4.63 80.51 19.17 0.32 37.43 36.32 6.77 0.03 0.38 0.00 18.19 0.90 15 H E E 92.05 7.09 13.92 22.58 119.67 126.87 -96.68 139.33 38.76 61.19 0.05 33.72 3.81 0.21 0.01 0.05 0.00 61.47 0.73 16 F E E 104.69 10.80 13.87 25.62 127.95 -166.36 -126.19 144.29 3.41 96.58 0.00 2.99 0.18 0.01 0.00 0.00 0.00 96.72 0.10 17 Y E E 77.85 11.02 15.77 28.11 128.78 -168.51 -130.39 144.23 0.36 99.64 0.00 0.32 0.01 0.00 0.00 0.00 0.00 99.66 0.01 18 T E E 72.66 9.04 15.78 26.41 126.03 -159.83 -122.96 141.24 0.46 99.54 0.00 0.41 0.01 0.00 0.00 0.00 0.00 99.57 0.01 19 T E E 38.88 11.87 14.89 28.24 131.25 -176.89 -135.06 149.89 2.92 97.08 0.00 2.77 0.07 0.00 0.00 0.00 0.00 97.10 0.05 20 T E E 80.72 6.08 17.98 25.43 121.08 -145.57 -111.51 135.61 12.53 87.45 0.02 11.74 0.62 0.04 0.00 0.01 0.00 87.07 0.52 21 K E E 64.20 12.74 12.42 25.99 127.23 -172.15 -123.16 145.95 47.25 52.61 0.14 43.47 2.73 0.23 0.05 0.09 0.00 50.85 2.57 22 N C C 66.98 5.12 14.99 21.72 111.67 -117.37 -79.19 129.78 76.68 23.11 0.22 73.59 2.84 0.41 0.08 0.13 0.00 19.40 3.55 23 K C T 121.41 7.80 10.45 19.64 93.34 -139.80 -64.34 -26.79 95.72 1.35 2.92 5.32 19.12 71.28 0.38 2.50 0.00 0.80 0.60 24 R C T 185.66 0.82 13.21 13.26 93.79 58.29 -73.45 -26.37 97.37 0.38 2.25 1.99 17.64 77.78 0.20 1.97 0.00 0.22 0.21 25 T C T 90.20 2.79 12.33 16.05 101.72 38.28 -98.36 -4.81 95.61 1.80 2.59 10.07 26.87 58.61 0.29 2.41 0.00 1.07 0.67 26 K C C 95.00 8.93 9.91 19.84 110.05 90.99 -100.06 101.52 94.97 4.78 0.25 65.12 29.08 1.24 0.07 0.18 0.00 2.61 1.69 27 P C C 64.17 7.54 11.74 21.05 109.47 -139.71 -68.80 149.45 81.64 4.98 13.38 58.14 10.11 11.10 0.90 15.06 0.00 3.75 0.93 28 E C S 142.99 2.86 14.79 18.43 99.28 -113.79 -74.90 -14.27 75.26 6.95 17.80 28.29 28.71 18.33 1.04 17.41 0.00 5.30 0.92 29 K C C 110.93 6.16 15.35 22.55 119.21 40.76 -110.94 135.09 63.58 16.45 19.97 41.01 11.51 10.91 1.37 19.07 0.00 15.12 1.02 30 L C C 43.18 16.82 11.48 27.78 119.71 -145.23 -105.99 134.28 53.42 43.10 3.47 47.13 4.50 1.56 0.72 2.76 0.00 42.15 1.18 31 E E E 98.93 6.34 19.47 26.70 121.27 -156.57 -113.20 135.93 25.97 73.64 0.39 23.60 1.71 0.40 0.13 0.25 0.00 73.31 0.60 32 L E E 48.69 15.60 13.47 29.22 122.96 -162.79 -117.11 135.26 15.33 84.59 0.08 13.22 1.48 0.10 0.02 0.05 0.00 84.97 0.16 33 K E E 99.61 7.84 17.97 26.97 122.46 -165.92 -118.67 135.59 5.67 94.31 0.02 4.30 1.03 0.03 0.00 0.01 0.00 94.59 0.03 34 K E E 79.97 10.91 16.35 28.17 128.00 -170.94 -127.51 142.86 1.00 99.00 0.01 0.82 0.08 0.01 0.00 0.00 0.00 99.07 0.02 35 F E E 84.83 8.58 15.60 25.76 121.61 -147.87 -113.95 136.26 1.17 98.82 0.01 1.08 0.07 0.00 0.00 0.00 0.00 98.58 0.26 36 D C C 30.41 10.80 11.15 24.28 109.16 -136.18 -93.17 114.38 55.97 44.00 0.02 55.11 0.53 0.07 0.00 0.01 0.00 43.88 0.39 37 P C T 89.72 3.76 13.53 19.10 92.82 -158.63 -67.00 -24.75 99.00 0.10 0.89 0.30 3.65 95.04 0.02 0.90 0.00 0.07 0.02 38 V C T 110.88 1.71 13.10 15.14 97.36 48.23 -76.89 -40.54 99.02 0.13 0.85 0.24 3.64 95.20 0.02 0.79 0.00 0.06 0.04 39 V C T 79.99 3.68 11.42 16.60 99.27 27.46 -98.99 -12.95 99.11 0.25 0.64 1.37 4.06 93.72 0.03 0.62 0.00 0.15 0.06 40 R C T 170.65 2.66 12.12 16.72 94.09 -129.69 58.38 35.14 98.79 0.85 0.35 31.92 4.76 62.11 0.08 0.22 0.00 0.80 0.10 41 Q E E 90.64 3.71 15.11 20.40 131.05 117.78 -124.91 157.07 39.37 60.59 0.04 31.54 5.37 0.51 0.00 0.03 0.00 62.18 0.36 42 H E E 100.87 8.52 14.35 24.15 115.76 -108.78 -81.83 135.22 0.79 99.21 0.00 0.71 0.02 0.00 0.00 0.00 0.00 99.24 0.03 43 V E E 30.23 13.85 14.30 29.57 126.05 -170.51 -124.62 141.66 0.14 99.86 0.00 0.13 0.00 0.00 0.00 0.00 0.00 99.87 0.00 44 I E E 75.49 7.72 19.52 28.30 116.40 -132.71 -94.27 130.29 0.33 99.67 0.00 0.30 0.01 0.00 0.00 0.00 0.00 99.69 0.00 45 Y E E 41.56 17.34 13.65 31.14 126.63 -172.30 -120.32 147.92 3.22 96.77 0.01 2.87 0.15 0.02 0.00 0.00 0.00 96.91 0.05 46 K E E 102.77 6.35 19.87 27.18 123.81 -150.73 -117.75 140.00 8.40 91.52 0.08 6.99 0.93 0.20 0.02 0.05 0.00 91.67 0.13 47 E E E 73.09 13.35 13.23 26.94 119.38 -143.93 -98.56 137.71 13.09 86.66 0.24 11.19 1.38 0.40 0.06 0.16 0.00 86.35 0.45 48 A E E 47.09 8.14 13.53 23.28 127.18 -166.67 -120.32 151.22 23.56 76.12 0.32 20.29 2.36 0.63 0.09 0.22 0.00 75.67 0.75 49 K E E 144.60 3.10 12.56 17.49 116.04 -126.64 -94.20 132.48 40.35 59.50 0.16 37.89 1.09 0.42 0.04 0.11 0.00 58.73 1.71 50 I C C 96.08 8.05 11.01 20.22 111.86 -136.89 -89.10 125.25 99.60 0.40 0.00 99.64 0.05 0.01 0.00 0.00 0.00 0.29 0.01