# 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 55.39 14.33 20.22 34.25 125.14 -169.29 -113.63 139.41 99.47 0.53 0.00 99.55 0.05 0.01 0.00 0.00 0.00 0.38 0.01 1 C E E 24.54 15.90 18.57 34.87 124.12 -159.98 -116.01 140.15 41.53 58.38 0.09 39.51 0.80 0.22 0.02 0.05 0.00 58.63 0.77 2 I E E 31.58 16.22 19.36 35.99 120.90 -158.07 -112.51 132.55 10.15 89.76 0.09 8.41 1.16 0.16 0.03 0.05 0.00 89.94 0.26 3 E E E 54.70 13.86 21.42 35.35 123.27 -162.81 -114.07 135.43 3.20 96.75 0.05 2.63 0.25 0.04 0.01 0.02 0.00 96.98 0.06 4 F E E 31.39 17.74 19.39 37.22 126.48 -170.21 -121.90 141.72 2.20 97.73 0.07 1.85 0.15 0.03 0.02 0.02 0.00 97.87 0.06 5 A E E 21.00 14.13 21.06 35.93 125.10 -163.43 -119.07 140.13 4.09 95.72 0.19 3.27 0.40 0.11 0.06 0.07 0.00 96.00 0.09 6 F E E 40.95 15.72 17.27 33.38 126.77 -165.10 -124.55 143.16 7.62 91.85 0.53 5.94 1.17 0.39 0.19 0.22 0.00 91.80 0.29 7 K E E 97.95 8.45 16.69 26.08 118.89 -147.10 -105.63 134.13 26.55 71.97 1.48 19.78 4.84 2.20 0.36 0.88 0.00 71.35 0.59 8 K E E 109.59 7.64 12.92 21.78 116.48 -153.61 -106.34 127.22 44.39 50.38 5.23 11.30 12.64 23.99 0.58 4.30 0.02 45.78 1.38 9 A C T 88.30 2.63 13.91 17.22 96.95 -3.49 51.07 37.01 91.84 3.18 4.99 6.03 13.25 71.67 0.30 5.48 0.00 2.84 0.44 10 G C T 52.65 3.25 14.02 18.21 101.54 -53.33 84.97 -1.65 93.33 4.31 2.36 9.11 22.87 60.89 0.13 2.55 0.00 4.05 0.39 11 I E E 72.11 8.84 12.66 23.10 117.39 117.45 -102.39 127.69 37.73 62.06 0.21 28.48 8.55 1.02 0.06 0.16 0.00 60.57 1.17 12 P E E 58.47 9.47 16.72 27.31 114.44 -124.29 -73.35 139.90 20.36 79.49 0.15 17.82 1.35 0.22 0.05 0.07 0.00 80.13 0.37 13 I E E 43.90 15.09 16.24 31.81 119.54 -157.28 -107.57 130.68 5.81 93.85 0.34 4.77 0.69 0.20 0.15 0.12 0.00 93.81 0.26 14 V E E 43.38 13.24 19.14 33.04 118.35 -157.69 -108.77 126.19 3.48 95.94 0.58 2.79 0.37 0.16 0.31 0.17 0.00 96.03 0.18 15 R E E 80.08 14.36 19.43 33.39 121.36 -168.97 -111.60 132.83 7.97 90.07 1.96 5.95 1.19 0.61 0.87 0.60 0.00 90.57 0.22 16 N E E 47.51 13.99 20.21 34.21 120.15 -162.81 -112.96 130.02 21.82 74.19 3.98 14.29 5.62 2.12 1.91 1.36 0.00 74.27 0.44 17 F E E 49.44 15.98 19.08 34.97 120.70 -166.30 -110.96 133.77 28.75 63.81 7.43 20.99 5.91 3.27 4.12 2.77 0.02 61.35 1.57 18 L E E 46.13 14.31 18.90 33.52 116.77 -156.93 -101.89 128.96 35.51 56.37 8.13 22.90 9.28 6.14 4.50 3.43 0.08 51.08 2.59 19 H E E 76.63 11.87 18.07 30.22 115.88 -159.23 -104.14 130.06 45.08 48.59 6.33 26.90 12.94 7.89 3.16 3.18 0.15 42.24 3.55 20 S C C 38.62 11.15 15.76 27.67 119.57 -159.65 -103.63 150.11 67.71 27.81 4.48 46.97 13.78 6.73 2.19 2.34 0.02 25.12 2.85 21 T C T 82.88 7.11 15.28 23.17 98.46 -131.60 -72.53 -19.14 80.21 9.82 9.97 22.70 28.75 30.15 4.68 4.47 0.08 7.08 2.08 22 E C T 117.74 4.67 16.23 21.57 100.61 59.17 -85.03 -6.86 81.17 5.35 13.48 14.37 26.39 41.56 6.81 5.51 0.13 3.45 1.77 23 G C C 26.97 10.90 15.16 26.55 107.28 -25.95 70.01 -20.84 70.39 17.65 11.97 28.63 21.06 23.03 6.22 5.08 0.20 12.69 3.07 24 V C C 57.21 12.12 13.87 26.39 107.25 58.91 -86.96 90.71 51.78 36.38 11.83 35.81 8.81 7.22 7.86 4.25 0.17 30.01 5.88 25 I E E 90.78 8.41 15.60 24.62 104.82 141.47 -87.35 -1.92 39.95 47.59 12.46 22.09 9.01 11.19 7.94 4.92 0.37 35.32 9.15 26 Y C T 139.98 5.74 16.57 23.12 102.09 36.31 -88.58 21.59 65.77 22.99 11.24 12.02 10.86 44.60 5.59 5.32 0.32 17.23 4.05 27 G C T 41.44 6.52 17.56 24.75 105.29 -78.28 90.06 7.36 84.26 9.10 6.64 17.47 19.18 48.61 2.37 3.79 0.06 6.70 1.82 28 L C C 31.41 19.06 10.27 28.48 118.17 139.03 -85.87 140.45 87.25 11.52 1.23 48.47 39.06 1.23 0.84 0.41 0.00 5.89 4.10 29 P C C 50.94 6.77 16.07 24.60 113.49 -104.17 -64.39 146.73 91.90 5.66 2.44 89.68 2.13 0.59 2.35 0.30 0.00 3.29 1.66 30 Q H H 123.27 3.82 14.10 19.62 92.62 -114.84 -59.93 -36.48 7.01 0.14 92.86 1.76 1.45 4.18 87.85 4.61 0.03 0.08 0.05 31 R H H 141.75 2.80 16.70 19.87 92.44 56.77 -66.00 -36.55 4.36 0.22 95.42 0.91 0.61 2.98 89.29 5.94 0.03 0.19 0.04 32 V H H 28.50 15.38 13.11 28.74 94.91 47.90 -72.81 -37.71 2.92 0.20 96.87 0.77 0.40 1.81 90.53 6.26 0.01 0.19 0.02 33 Q H H 63.86 14.49 14.33 28.46 93.09 58.09 -67.28 -33.07 7.30 0.28 92.41 1.52 0.91 4.96 86.44 5.83 0.05 0.21 0.07 34 R H H 152.04 3.02 19.52 22.69 93.91 55.19 -75.23 -19.58 48.17 0.31 51.52 1.63 2.25 42.71 49.64 3.40 0.07 0.16 0.15 35 N C T 80.78 7.50 18.28 26.37 100.15 46.18 -101.05 4.68 64.52 0.95 34.53 4.82 4.43 52.70 33.57 3.50 0.07 0.61 0.31 36 L C E 23.69 21.00 12.79 33.09 117.86 105.25 -95.61 137.05 53.30 44.19 2.51 39.25 11.05 2.91 1.74 1.01 0.02 41.77 2.26 37 A E E 41.37 8.41 23.58 32.37 123.33 -164.68 -114.41 142.39 24.13 75.26 0.62 19.79 3.02 0.99 0.20 0.33 0.00 75.12 0.55 38 I E E 23.58 21.80 15.46 36.67 123.36 -158.95 -119.37 132.34 9.34 90.53 0.14 7.47 1.69 0.30 0.03 0.08 0.00 90.20 0.23 39 N E E 66.99 7.65 23.57 31.56 118.32 -164.45 -112.25 126.02 4.45 95.51 0.04 3.58 0.60 0.09 0.01 0.02 0.00 95.66 0.05 40 Y E E 41.55 20.39 14.39 33.98 128.73 -173.35 -124.90 143.44 2.74 97.25 0.01 2.40 0.16 0.01 0.00 0.00 0.00 97.39 0.03 41 T E E 49.08 7.98 22.39 31.26 123.76 -160.71 -120.76 135.98 0.93 99.07 0.00 0.81 0.04 0.00 0.00 0.00 0.00 99.13 0.01 42 V E E 37.14 16.04 15.31 31.80 118.32 -148.79 -105.83 128.63 0.65 99.35 0.00 0.58 0.02 0.00 0.00 0.00 0.00 99.40 0.01 43 K E E 76.93 8.72 18.21 28.13 123.67 -170.69 -119.11 138.08 0.81 99.19 0.00 0.71 0.03 0.00 0.00 0.00 0.00 99.25 0.01 44 Q E E 83.27 8.68 15.19 25.25 119.54 -146.40 -107.18 132.41 1.47 98.53 0.00 1.30 0.07 0.01 0.00 0.00 0.00 98.58 0.04 45 Y E E 83.29 9.40 10.17 21.09 122.28 -163.24 -110.66 144.15 12.27 87.67 0.06 11.28 0.60 0.11 0.01 0.03 0.00 87.66 0.30 46 K E E 148.13 2.17 11.46 14.99 118.07 -158.08 -120.77 125.59 33.12 65.54 1.34 6.57 8.76 21.47 0.11 1.15 0.00 61.00 0.93 47 E C T 166.96 0.65 12.32 11.98 96.25 -2.84 43.79 40.04 97.39 1.43 1.18 1.75 10.03 85.58 0.05 1.23 0.00 1.17 0.18 48 G C T 47.71 5.03 10.90 17.34 96.99 -59.31 83.39 1.27 98.36 0.68 0.96 4.07 26.72 67.55 0.04 1.00 0.00 0.52 0.11 49 K E E 126.65 2.35 15.02 18.21 121.81 112.32 -108.68 140.01 25.11 74.76 0.12 19.02 5.44 0.97 0.03 0.11 0.00 73.14 1.30 50 A E E 44.74 13.76 9.82 23.73 110.84 -114.12 -73.17 127.30 2.88 97.11 0.01 2.60 0.16 0.02 0.00 0.00 0.00 97.04 0.18 51 V E E 80.38 4.94 16.50 22.78 103.21 176.39 -103.19 -26.63 4.69 95.30 0.01 3.29 0.96 0.10 0.00 0.01 0.00 95.60 0.03 52 S E E 46.19 6.36 18.96 26.59 139.41 -1.62 -156.68 153.90 2.48 97.50 0.02 1.78 0.47 0.08 0.00 0.01 0.00 97.65 0.02 53 A E E 44.15 16.96 13.03 29.26 128.62 -166.88 -135.00 137.60 2.36 97.63 0.01 2.08 0.15 0.02 0.00 0.01 0.00 97.72 0.03 54 K E E 88.60 7.72 19.89 28.74 129.97 -176.82 -133.38 142.88 1.84 98.14 0.01 1.50 0.24 0.03 0.00 0.01 0.00 98.19 0.02 55 T E E 68.49 10.06 17.91 28.65 119.79 -140.18 -103.13 134.48 2.55 97.44 0.01 2.30 0.15 0.02 0.00 0.01 0.00 97.45 0.08 56 I E E 25.23 16.70 11.67 29.07 118.30 -158.65 -110.07 130.16 15.72 84.16 0.13 15.24 0.56 0.09 0.06 0.05 0.00 82.97 1.03 57 K C S 140.68 2.77 18.70 22.13 99.20 -173.58 -93.80 -22.89 88.80 10.48 0.73 34.56 52.56 1.92 0.28 0.38 0.00 9.61 0.68 58 T C C 66.43 4.00 19.39 23.74 118.80 30.55 -125.09 122.89 85.63 4.20 10.17 46.16 36.26 3.52 9.15 1.43 0.01 2.32 1.15 59 L H H 37.20 19.40 11.80 30.54 93.76 -146.97 -63.19 -33.17 19.80 0.74 79.46 7.42 3.46 8.59 53.32 26.46 0.06 0.44 0.25 60 Q H H 93.60 8.84 16.25 25.95 91.79 62.52 -65.24 -30.75 13.27 0.42 86.32 3.01 1.77 7.39 54.72 32.69 0.04 0.27 0.11 61 E H H 122.20 2.93 19.02 21.96 92.39 53.55 -71.46 -24.12 12.61 0.20 87.18 1.81 1.37 7.90 55.78 32.90 0.04 0.13 0.06 62 A H H 29.33 14.91 14.24 29.13 97.22 53.05 -85.27 -20.39 29.46 0.35 70.18 3.33 4.26 19.70 50.21 21.91 0.19 0.18 0.22 63 F C S 50.76 16.41 12.77 28.90 115.23 50.71 -113.51 110.42 86.54 2.36 11.10 27.76 53.88 5.08 8.72 2.15 0.02 0.79 1.61 64 P C C 75.11 5.55 17.41 23.87 112.39 -138.21 -70.73 146.07 78.06 3.83 18.11 55.54 8.69 13.31 8.76 9.72 0.00 2.17 1.81 65 S C C 64.30 8.50 12.30 21.72 109.14 -111.10 -79.12 133.81 74.52 7.40 18.09 47.10 12.11 15.08 6.30 11.95 0.02 4.12 3.32 66 K C C 135.09 4.81 12.68 18.99 104.62 -147.31 -88.90 41.47 77.10 8.94 13.97 30.80 20.39 27.47 4.74 8.27 0.07 4.95 3.31 67 G C C 47.51 4.65 11.71 17.87 112.30 -43.35 94.28 139.83 83.34 9.85 6.81 29.45 26.45 28.83 1.52 4.88 0.01 6.63 2.22 68 D C C 94.82 5.01 9.87 16.60 112.08 -93.94 -89.82 126.38 81.48 13.55 4.98 56.37 15.60 9.13 1.51 3.65 0.00 9.91 3.82 69 T C C 100.44 3.20 9.53 14.70 112.34 -161.98 -96.32 121.20 82.47 14.95 2.58 76.69 2.14 3.59 1.01 1.23 0.00 10.87 4.47 70 K C C 148.89 2.82 11.33 15.96 110.70 -144.22 -88.06 121.36 99.69 0.29 0.02 99.66 0.09 0.04 0.01 0.00 0.00 0.15 0.04