# 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 K C C 147.30 2.53 11.57 15.59 115.65 -162.37 -99.88 135.36 99.89 0.11 0.01 99.81 0.09 0.03 0.00 0.00 0.00 0.05 0.01 1 S C C 84.45 2.59 9.00 13.35 114.51 -145.85 -93.98 135.75 93.32 3.80 2.88 88.59 1.45 3.93 0.97 1.21 0.00 2.23 1.61 2 Y C C 155.80 4.04 7.13 12.84 109.16 -162.79 -95.43 95.44 92.41 4.62 2.97 62.36 16.41 13.42 0.78 2.26 0.00 2.74 2.02 3 T C C 105.81 1.95 9.13 12.40 106.65 127.22 -93.78 41.13 92.90 4.54 2.56 59.63 25.05 8.11 0.76 1.81 0.00 2.33 2.31 4 T C C 89.78 3.27 8.14 13.33 117.46 98.98 -96.84 134.30 96.78 2.56 0.66 61.50 34.76 0.83 0.40 0.24 0.00 1.11 1.15 5 P C C 92.40 3.58 8.52 14.08 113.36 -108.28 -66.94 149.49 91.53 1.81 6.65 75.80 9.69 6.17 3.48 2.90 0.00 0.98 0.98 6 K C C 154.01 1.97 8.73 12.32 112.49 -115.36 -82.23 139.63 82.73 5.08 12.19 63.39 11.71 7.20 6.62 5.46 0.00 2.50 3.11 7 K C C 154.29 2.02 8.29 11.94 111.63 -112.19 -82.30 132.40 75.53 7.62 16.85 52.19 14.68 8.37 8.99 7.86 0.01 4.24 3.65 8 N C C 107.48 3.52 7.54 12.85 109.75 -148.06 -92.05 107.33 79.70 4.63 15.68 61.12 10.76 7.65 8.00 7.73 0.00 2.95 1.79 9 K C C 157.54 1.75 8.66 11.58 101.87 -169.56 -89.83 3.73 79.42 4.48 16.09 50.29 18.17 11.12 8.80 7.16 0.01 2.76 1.69 10 H C C 135.19 2.91 7.72 12.45 113.40 83.61 -95.53 123.07 82.42 5.68 11.90 53.84 19.33 9.22 6.71 5.13 0.01 3.67 2.08 11 K C C 149.99 2.00 8.59 12.23 115.29 -150.42 -92.41 136.32 85.25 6.33 8.42 68.00 11.72 5.20 5.36 3.08 0.00 4.35 2.30 12 R C C 165.64 2.94 7.43 12.38 115.07 -127.95 -89.78 135.29 86.44 6.71 6.85 68.89 11.79 5.30 4.31 2.63 0.00 4.79 2.29 13 K C C 146.18 2.28 8.83 12.84 117.11 -147.39 -96.47 141.07 87.44 7.35 5.21 65.88 15.96 5.28 3.27 2.09 0.00 5.67 1.85 14 K C C 159.36 1.86 8.97 12.45 113.30 -119.82 -88.88 128.78 82.59 13.10 4.31 65.44 13.00 3.55 3.03 1.60 0.00 9.76 3.61 15 V C C 88.70 5.36 7.97 15.21 120.06 -167.02 -109.58 137.07 80.82 15.68 3.50 70.55 8.06 1.64 2.79 1.01 0.00 12.54 3.41 16 K C C 160.15 1.55 11.70 14.19 113.16 -126.72 -87.23 131.12 79.56 16.19 4.24 70.32 6.49 2.07 3.22 1.24 0.00 13.77 2.88 17 L C C 92.77 7.68 8.44 17.49 119.16 -154.76 -99.66 138.98 74.00 18.08 7.92 64.94 6.23 2.37 5.47 2.61 0.00 14.79 3.60 18 A C C 67.64 4.08 12.79 18.23 113.30 -128.32 -81.68 133.98 71.63 19.16 9.21 62.36 6.22 2.73 5.67 3.72 0.01 15.27 4.03 19 V C C 80.45 8.37 10.27 19.80 114.60 -147.40 -95.74 130.41 43.58 17.92 38.50 33.62 6.62 5.31 9.40 28.01 0.02 14.50 2.52 20 L H G 107.48 4.31 13.37 18.97 100.30 -146.58 -86.23 -26.11 37.11 15.14 47.75 15.85 10.91 14.33 6.89 38.06 0.06 12.47 1.44 21 K H G 115.72 4.54 15.74 21.47 126.59 3.53 -131.33 138.89 37.70 15.99 46.31 16.85 9.43 14.39 5.34 38.61 0.02 14.44 0.92 22 Y C C 96.70 11.01 12.31 24.21 121.95 -158.06 -115.05 138.24 66.54 27.41 6.05 48.93 14.22 3.52 1.39 4.40 0.00 26.40 1.14 23 Y E E 83.93 9.56 12.61 23.73 128.94 -170.08 -121.52 152.65 14.43 85.47 0.10 13.38 0.97 0.10 0.04 0.05 0.00 84.79 0.68 24 K E E 121.28 4.08 15.57 21.26 124.90 -144.17 -116.82 146.97 1.70 98.30 0.01 1.68 0.09 0.01 0.00 0.00 0.00 98.14 0.08 25 V E E 75.19 8.74 8.97 19.10 117.79 -128.42 -100.70 133.26 2.73 97.26 0.01 2.76 0.08 0.00 0.01 0.00 0.00 94.62 2.52 26 D C C 63.93 3.85 10.01 15.87 124.49 -138.54 -87.03 173.79 96.88 3.10 0.02 97.26 0.22 0.05 0.00 0.01 0.00 2.11 0.35 27 E C T 176.18 0.38 8.95 8.92 90.31 -90.66 -63.37 -21.98 99.45 0.21 0.34 0.29 2.45 96.79 0.01 0.29 0.00 0.14 0.03 28 N C T 134.35 0.43 10.09 9.25 92.62 53.95 -87.98 1.13 99.59 0.06 0.35 0.15 2.39 97.12 0.00 0.30 0.00 0.03 0.01 29 G C S 43.99 4.75 9.31 16.06 95.53 -106.06 83.21 7.29 99.46 0.31 0.23 14.67 84.05 0.84 0.02 0.17 0.00 0.16 0.10 30 K C C 121.13 1.99 13.34 16.26 118.88 136.32 -84.63 143.71 95.41 4.57 0.02 94.68 1.51 0.04 0.00 0.01 0.00 3.00 0.75 31 I E E 77.98 11.50 9.22 21.38 115.33 -126.03 -91.45 130.21 1.17 98.83 0.00 1.22 0.03 0.00 0.00 0.00 0.00 97.93 0.82 32 S E E 55.21 4.60 16.15 22.15 126.85 -174.68 -125.69 149.66 1.12 98.88 0.00 1.10 0.05 0.00 0.00 0.00 0.00 98.80 0.06 33 R E E 125.29 9.30 12.55 22.97 112.18 -116.54 -83.73 126.80 9.01 90.97 0.02 8.51 0.55 0.06 0.00 0.02 0.00 90.20 0.65 34 L C C 76.74 7.78 14.71 23.97 102.60 -171.40 -90.38 -25.07 74.37 25.50 0.13 61.04 10.45 0.76 0.02 0.14 0.00 27.05 0.54 35 R C C 104.92 9.58 15.36 25.58 128.43 -2.73 -137.03 142.27 74.50 25.38 0.12 63.57 8.57 0.64 0.02 0.13 0.00 26.18 0.90 36 R C C 113.21 10.14 16.50 27.38 121.98 -162.54 -110.44 137.65 56.91 43.00 0.09 53.98 2.39 0.21 0.02 0.06 0.00 42.07 1.26 37 E E E 91.03 8.97 18.06 27.87 124.67 -149.08 -110.43 146.18 14.83 85.10 0.08 13.15 0.78 0.03 0.08 0.02 0.00 50.29 35.65 38 C C C 20.51 17.31 10.10 27.53 113.18 -120.54 -83.23 131.50 76.74 23.23 0.03 75.35 1.79 0.10 0.01 0.03 0.00 20.52 2.20 39 P C C 97.81 2.86 17.70 21.15 93.90 -142.90 -74.52 -16.03 95.81 4.05 0.14 52.52 41.32 2.28 0.01 0.18 0.00 3.05 0.64 40 S C S 45.97 6.00 11.86 19.91 129.67 61.90 -119.49 158.77 94.46 4.36 1.19 13.16 73.58 7.36 0.19 0.84 0.00 1.65 3.23 41 D C T 132.06 0.95 13.33 14.37 91.85 -120.72 -66.58 -21.48 92.44 0.57 6.99 2.03 31.66 59.57 0.36 5.74 0.00 0.26 0.37 42 E C T 140.02 2.06 15.49 17.98 95.16 57.49 -82.26 -20.16 90.84 1.16 8.00 3.26 24.55 63.49 0.65 6.78 0.00 0.62 0.64 43 C C C 30.07 16.27 10.08 25.71 110.93 45.59 -103.19 19.73 80.82 11.64 7.55 29.86 25.38 24.21 1.62 5.59 0.11 3.87 9.36 44 G C C 25.98 6.50 17.27 25.06 126.97 -137.99 74.70 -168.94 90.53 6.93 2.54 69.61 12.03 8.13 0.50 2.36 0.00 3.23 4.15 45 A C T 77.64 4.47 17.81 23.16 108.14 -55.70 -64.22 134.14 95.30 2.33 2.37 3.08 9.28 82.77 0.18 2.40 0.00 1.45 0.83 46 G C T 36.87 7.49 19.06 27.27 94.93 25.56 78.99 -2.12 96.14 1.39 2.47 4.72 9.71 80.99 0.07 3.16 0.00 1.15 0.19 47 V C C 28.17 16.47 15.10 32.18 118.23 121.17 -87.65 136.94 70.63 28.75 0.62 63.43 6.44 0.51 0.10 0.55 0.00 26.93 2.04 48 F E E 64.36 11.21 22.34 33.96 127.89 -163.23 -120.36 146.52 13.04 86.93 0.04 11.97 0.73 0.05 0.02 0.02 0.00 84.30 2.90 49 M E E 48.59 16.85 18.04 34.55 118.98 -130.57 -97.58 138.00 7.52 92.47 0.01 7.29 0.20 0.01 0.00 0.00 0.00 92.28 0.21 50 A E E 24.04 12.22 18.33 31.81 132.31 -175.36 -130.60 154.88 2.36 97.63 0.01 2.21 0.10 0.01 0.00 0.00 0.00 97.59 0.08 51 S E E 60.72 8.89 15.35 25.41 119.79 -131.17 -104.87 133.67 3.76 96.22 0.02 3.24 0.40 0.04 0.00 0.01 0.00 95.98 0.32 52 H E E 84.50 8.08 11.52 21.37 122.69 172.43 -134.57 123.40 39.41 60.50 0.09 35.60 2.66 0.27 0.02 0.07 0.00 60.57 0.80 53 F C T 176.60 1.02 13.96 14.50 97.79 -31.55 52.87 14.27 98.14 1.59 0.27 2.45 41.20 54.59 0.01 0.31 0.00 1.30 0.14 54 D C T 120.74 2.30 13.37 16.67 95.88 -29.92 -24.91 12.19 98.86 0.97 0.16 2.25 39.24 57.44 0.00 0.20 0.00 0.80 0.07 55 R E E 90.39 8.45 13.94 24.03 129.69 88.38 -121.31 150.30 26.81 73.16 0.03 21.61 3.50 0.23 0.00 0.03 0.00 74.36 0.27 56 H E E 54.54 13.65 15.78 30.44 121.07 -142.17 -111.38 134.14 1.32 98.68 0.00 1.17 0.04 0.00 0.00 0.00 0.00 98.75 0.03 57 Y E E 55.58 11.73 20.73 33.58 127.29 -172.23 -123.93 142.55 0.34 99.66 0.00 0.31 0.01 0.00 0.00 0.00 0.00 99.66 0.02 58 C E E 18.05 17.75 16.39 34.65 120.67 -156.31 -114.72 133.69 10.36 89.63 0.01 8.86 0.78 0.06 0.00 0.01 0.00 90.09 0.20 59 G C T 25.73 10.43 19.97 30.42 120.47 -16.44 59.21 -150.91 91.65 6.91 1.44 3.37 21.91 66.47 0.04 1.67 0.00 6.05 0.49 60 K C T 127.91 5.10 19.62 25.43 94.26 -13.26 -71.95 -27.26 97.63 1.00 1.38 1.30 18.58 77.78 0.03 1.46 0.00 0.68 0.18 61 C C T 42.88 11.66 16.98 29.38 100.27 40.37 -100.99 -1.95 95.18 3.56 1.26 2.96 14.50 77.79 0.06 1.36 0.00 3.01 0.33 62 C E E 46.26 12.79 18.19 31.41 97.53 -127.26 69.97 32.55 38.28 61.23 0.48 26.45 6.87 4.72 0.12 0.45 0.00 58.68 2.71 63 L E E 46.22 12.00 19.18 32.17 116.70 153.69 -88.54 136.95 20.15 79.63 0.22 17.92 1.25 0.34 0.08 0.17 0.00 79.53 0.71 64 T E E 41.05 14.77 16.97 32.07 124.19 -163.85 -117.35 140.39 8.04 91.51 0.45 6.88 0.91 0.43 0.15 0.34 0.00 90.68 0.60 65 Y E E 86.75 10.62 17.75 29.29 125.74 -168.64 -122.49 141.31 12.00 87.48 0.53 10.39 1.14 0.51 0.19 0.40 0.00 86.30 1.06 66 C E E 61.11 9.65 13.99 24.87 120.96 -149.98 -109.09 134.79 35.60 64.19 0.21 34.09 0.57 0.29 0.07 0.12 0.00 63.02 1.83 67 F C C 105.28 8.50 14.32 23.86 115.71 -154.91 -101.25 127.88 99.22 0.77 0.00 99.29 0.07 0.01 0.00 0.00 0.00 0.61 0.01