# 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 46.23 4.67 19.15 24.32 103.37 -88.87 83.96 5.17 99.82 0.18 0.00 99.39 0.36 0.10 0.00 0.00 0.00 0.13 0.01 1 A C C 39.08 16.10 10.44 25.62 123.05 140.83 -93.23 152.07 61.64 38.32 0.04 58.02 1.44 0.35 0.00 0.03 0.00 39.75 0.41 2 T E E 84.20 3.94 19.48 24.32 122.44 -144.88 -115.78 136.75 11.24 88.74 0.02 9.55 1.21 0.09 0.00 0.02 0.00 88.83 0.30 3 L E E 78.02 13.42 13.90 27.46 111.23 -117.92 -77.03 126.29 0.93 99.07 0.00 0.89 0.02 0.00 0.00 0.00 0.00 99.03 0.06 4 V E E 57.20 10.40 17.25 28.77 100.63 176.78 -100.97 -19.26 1.57 98.42 0.00 1.04 0.27 0.03 0.00 0.00 0.00 98.65 0.01 5 G E E 15.84 8.19 20.03 29.98 143.18 -48.34 158.70 177.65 2.38 97.61 0.00 1.04 0.81 0.09 0.00 0.00 0.00 98.05 0.01 6 V E E 78.50 8.98 16.52 27.00 128.43 -95.71 -128.38 144.74 2.21 97.78 0.01 2.13 0.12 0.01 0.00 0.00 0.00 96.35 1.39 7 D C C 30.33 15.02 11.29 26.64 124.27 -133.62 -85.16 172.44 92.19 7.74 0.07 93.21 0.21 0.09 0.01 0.03 0.00 5.57 0.87 8 K C T 160.42 2.15 15.77 18.78 90.84 -93.16 -64.19 -21.79 99.52 0.09 0.39 0.10 1.45 98.03 0.00 0.36 0.00 0.05 0.01 9 F C T 103.51 7.71 13.75 22.87 93.21 55.22 -89.52 2.88 99.56 0.06 0.37 0.07 1.58 97.96 0.00 0.35 0.00 0.03 0.01 10 G C S 38.44 4.73 17.71 23.62 98.07 -101.57 89.80 6.21 99.49 0.29 0.22 12.67 85.82 1.07 0.01 0.18 0.00 0.15 0.10 11 N C C 30.44 15.06 13.24 29.44 119.41 135.06 -80.29 145.60 97.52 2.46 0.01 95.00 2.67 0.12 0.00 0.01 0.00 1.85 0.34 12 K E E 88.02 7.86 22.09 30.57 118.48 -127.70 -96.14 136.09 0.62 99.38 0.00 0.61 0.02 0.00 0.00 0.00 0.00 99.03 0.34 13 Y E E 21.07 20.87 16.30 37.18 130.27 -170.94 -125.74 149.99 0.29 99.71 0.00 0.27 0.00 0.00 0.00 0.00 0.00 99.72 0.01 14 Y E E 45.35 12.70 21.80 35.50 128.32 -159.54 -125.36 145.66 0.69 99.31 0.00 0.65 0.02 0.00 0.00 0.00 0.00 99.30 0.03 15 Q E E 40.53 15.08 17.57 33.24 124.18 -156.52 -116.40 138.04 5.79 94.20 0.02 5.32 0.31 0.03 0.01 0.01 0.00 93.94 0.38 16 K E E 81.28 9.49 16.89 27.47 111.22 -147.33 -98.84 114.33 42.48 57.23 0.29 37.74 2.84 0.43 0.06 0.18 0.00 57.85 0.90 17 L C C 85.17 8.61 13.17 22.89 107.34 -166.69 -85.65 92.82 72.23 23.85 3.91 55.70 10.14 6.00 1.09 2.67 0.00 22.76 1.63 18 G C C 49.30 3.77 13.12 18.04 106.08 33.30 36.38 -1.50 79.78 12.33 7.90 40.56 22.73 17.87 2.04 5.57 0.02 8.66 2.54 19 D C S 104.47 3.26 10.78 15.31 104.41 45.14 -90.70 38.87 77.62 8.72 13.66 28.48 28.60 22.38 4.41 8.04 0.10 4.80 3.19 20 T C T 86.02 4.42 8.67 14.85 110.50 93.15 -95.69 107.70 76.51 4.66 18.83 19.28 29.28 29.84 6.31 10.43 0.13 2.27 2.44 21 Q C T 145.88 1.33 10.89 12.68 98.22 -64.77 -73.65 -19.82 80.78 2.53 16.70 15.95 27.38 38.77 4.84 10.26 0.05 1.26 1.48 22 Y C T 159.18 2.89 11.22 15.31 102.06 38.69 -94.76 12.10 83.83 3.59 12.57 17.98 25.27 41.65 3.30 8.15 0.03 2.03 1.59 23 G C C 33.10 5.96 14.14 21.56 121.13 -97.09 97.23 -174.17 82.28 14.65 3.06 40.87 22.66 19.79 0.57 2.50 0.00 11.12 2.48 24 R C C 99.13 9.89 14.44 25.23 117.57 -39.50 -93.80 134.44 68.37 30.77 0.86 58.66 6.44 1.94 0.21 0.71 0.00 29.21 2.84 25 H E E 68.41 12.27 17.43 30.21 123.06 -165.71 -114.82 139.99 41.37 58.35 0.28 33.68 6.52 0.85 0.07 0.23 0.00 56.89 1.76 26 R E E 46.42 16.38 18.45 34.90 128.72 -165.04 -125.41 144.13 13.98 85.96 0.06 11.41 2.12 0.20 0.01 0.04 0.00 85.81 0.41 27 W E E 51.99 13.99 22.28 36.71 127.68 -160.82 -120.74 144.66 2.54 97.45 0.01 2.30 0.12 0.01 0.00 0.00 0.00 97.35 0.21 28 V E E 11.11 21.17 18.81 40.32 121.51 -152.91 -114.61 131.48 1.41 98.59 0.01 1.31 0.05 0.01 0.00 0.00 0.00 98.42 0.21 29 E E E 62.88 10.46 23.73 34.63 119.03 -160.93 -108.21 129.44 7.61 92.33 0.06 6.99 0.41 0.06 0.02 0.03 0.00 92.03 0.47 30 Y C C 35.90 17.54 14.09 31.85 117.01 -145.51 -90.83 140.89 50.65 46.46 2.89 45.65 3.28 1.09 0.99 1.88 0.00 44.76 2.34 31 A C S 54.85 7.01 16.45 24.64 97.64 -138.06 -73.39 -29.25 88.70 4.63 6.67 26.99 45.22 17.00 1.37 5.10 0.01 3.35 0.96 32 S C S 60.25 3.46 16.07 19.97 125.37 21.67 -120.03 153.68 87.92 3.53 8.55 22.16 41.02 25.18 1.79 6.39 0.01 1.77 1.68 33 K C T 136.77 5.53 11.08 18.43 95.48 -111.57 -64.26 -23.81 88.12 0.93 10.95 8.55 27.20 52.08 1.59 9.53 0.00 0.45 0.59 34 D C T 115.58 1.85 13.62 15.72 97.38 53.10 -82.71 -0.70 89.75 1.10 9.14 10.21 25.75 53.49 1.21 8.16 0.00 0.58 0.59 35 R C C 138.97 4.59 14.05 19.78 104.49 55.13 -102.04 18.32 86.49 5.98 7.54 39.82 26.57 19.88 1.37 6.35 0.01 2.77 3.23 36 Y C C 68.07 15.50 9.99 24.98 119.90 110.13 -105.43 135.25 90.37 7.79 1.85 72.12 14.30 2.91 0.78 1.08 0.00 3.49 5.32 37 N C C 73.79 5.18 19.89 25.57 116.34 -163.32 -112.63 120.35 95.28 3.38 1.34 91.89 2.50 1.07 0.43 0.68 0.00 1.43 2.00 38 A H G 36.59 17.43 11.43 28.27 92.88 -143.57 -64.57 -21.96 24.60 0.52 74.88 6.96 2.53 12.12 0.97 77.00 0.00 0.30 0.12 39 S H G 86.48 2.06 18.04 20.44 90.76 67.08 -71.04 -15.13 24.87 0.22 74.91 1.06 1.81 18.75 0.65 77.58 0.00 0.13 0.03 40 Q H G 107.00 5.30 17.20 23.47 94.56 59.09 -90.69 -7.08 22.14 0.24 77.62 1.57 2.68 14.94 0.59 80.06 0.00 0.13 0.03 41 V C S 15.75 21.97 8.42 29.16 119.70 92.56 -87.96 141.70 98.81 1.08 0.12 6.34 92.13 0.11 0.04 0.02 0.00 0.11 1.25 42 P C C 51.99 5.74 17.31 24.63 113.96 -102.90 -62.30 146.30 99.83 0.13 0.04 99.67 0.19 0.02 0.02 0.00 0.00 0.03 0.07 43 A H G 73.77 5.35 14.60 21.74 90.70 -113.37 -56.80 -36.58 8.68 0.01 91.31 0.25 0.41 8.00 29.81 61.52 0.00 0.01 0.00 44 E H G 117.57 4.69 18.06 23.74 90.23 60.52 -66.05 -27.79 7.91 0.01 92.08 0.13 0.24 7.99 28.56 63.06 0.00 0.01 0.00 45 W H G 42.94 17.54 15.05 32.42 96.43 45.32 -91.26 -13.51 5.47 0.02 94.51 0.30 0.28 4.63 31.88 62.88 0.00 0.02 0.00 46 H H H 50.29 14.77 16.30 31.40 92.68 83.26 -60.49 -41.90 2.47 0.02 97.51 0.65 0.26 1.58 95.15 2.34 0.00 0.01 0.01 47 G H H 25.52 5.95 19.86 27.19 90.93 52.37 -62.81 -40.70 1.52 0.01 98.47 0.10 0.08 1.37 95.50 2.94 0.01 0.01 0.00 48 W H H 63.71 12.51 18.82 31.85 92.44 49.81 -66.16 -42.21 0.67 0.01 99.32 0.06 0.03 0.58 96.99 2.33 0.00 0.00 0.00 49 L H H 24.85 19.72 17.35 36.51 91.94 48.29 -67.84 -37.00 1.99 0.01 98.00 0.10 0.11 1.85 95.96 1.97 0.01 0.00 0.00 50 H H H 78.52 8.86 18.76 28.71 94.62 42.92 -91.89 -0.27 34.10 0.07 65.83 0.60 1.16 32.72 63.89 1.49 0.06 0.02 0.06 51 F C T 111.82 9.84 16.97 27.30 94.49 -111.87 67.83 23.53 70.92 0.23 28.85 2.25 4.17 62.20 30.01 1.11 0.03 0.08 0.16 52 I C C 87.50 6.61 17.55 25.15 98.04 120.06 -88.90 -16.21 84.90 4.67 10.43 35.26 30.66 19.00 8.38 1.90 0.03 1.55 3.23 53 T C C 38.38 11.42 13.04 25.83 131.45 44.78 -129.55 156.05 87.07 5.99 6.94 47.88 28.55 10.89 4.68 2.18 0.01 2.52 3.30 54 D C S 108.62 4.03 16.90 22.18 97.26 -146.07 -86.59 -6.51 94.00 1.64 4.36 29.58 53.84 10.67 2.92 1.41 0.00 0.76 0.81 55 H C S 104.02 5.70 16.54 23.47 114.81 77.95 -100.32 123.89 90.07 2.50 7.43 38.41 44.53 7.31 5.46 1.75 0.00 0.92 1.61 56 T C C 57.24 11.33 13.75 25.78 107.80 -154.99 -77.52 112.68 82.81 1.21 15.99 62.38 9.97 10.08 12.71 3.60 0.00 0.57 0.70 57 G C C 30.83 11.54 14.39 25.90 101.45 -73.03 43.51 -24.28 60.32 1.23 38.45 35.13 10.24 15.43 27.92 9.99 0.01 0.54 0.75 58 D H H 84.13 5.82 14.17 21.09 101.46 61.39 -80.46 -11.31 42.27 1.69 56.03 21.98 8.79 12.24 40.71 14.65 0.05 0.90 0.69 59 E H H 120.66 4.12 13.19 18.55 100.05 68.24 -73.77 -15.02 34.74 2.40 62.86 16.62 7.15 11.39 44.34 18.15 0.09 1.50 0.75 60 L H H 92.89 7.62 10.56 19.15 98.03 70.69 -77.16 -22.40 38.15 3.02 58.84 17.69 7.69 13.78 43.72 14.02 0.18 1.81 1.10 61 L C C 107.55 4.90 9.83 16.28 101.58 58.19 -89.84 3.31 55.87 2.08 42.05 37.29 3.13 17.02 33.48 6.84 0.01 1.14 1.10 62 S C C 76.02 3.93 11.83 17.42 108.70 89.43 -83.56 105.98 99.86 0.03 0.11 99.63 0.10 0.17 0.07 0.01 0.00 0.02 0.01