# 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 S C C 73.83 4.49 10.50 16.58 116.06 -150.30 -92.32 144.59 99.83 0.10 0.07 99.65 0.15 0.09 0.03 0.01 0.00 0.04 0.02 1 S C C 84.77 2.42 8.73 12.77 109.79 -147.63 -88.73 114.10 81.02 1.16 17.82 68.43 2.37 10.57 14.54 2.84 0.00 0.57 0.68 2 H C C 150.86 1.62 8.01 11.01 108.08 -144.91 -90.47 92.88 71.00 2.28 26.72 42.10 15.17 13.82 22.13 4.58 0.02 1.04 1.15 3 K C C 127.20 3.59 7.90 13.42 112.99 75.92 -90.16 132.16 68.57 2.25 29.18 47.56 14.58 6.21 26.00 3.60 0.01 0.98 1.06 4 T C C 76.22 2.64 9.68 13.75 115.65 -140.37 -82.56 159.87 66.79 2.24 30.97 56.33 6.66 3.11 30.23 1.75 0.00 0.89 1.02 5 F H H 151.66 1.42 10.09 12.17 93.33 -112.74 -61.55 -38.36 3.94 0.04 96.02 1.75 0.81 1.30 95.72 0.40 0.00 0.01 0.01 6 R H H 152.68 1.26 11.73 13.00 92.44 51.92 -65.07 -40.23 1.91 0.02 98.07 0.59 0.27 0.97 97.77 0.38 0.00 0.01 0.00 7 I H H 86.22 2.73 11.59 15.58 92.26 48.28 -65.95 -41.01 0.94 0.01 99.05 0.27 0.11 0.49 98.81 0.31 0.00 0.00 0.00 8 K H H 114.02 2.31 13.06 16.12 91.86 50.68 -64.67 -40.64 0.56 0.00 99.43 0.15 0.05 0.28 99.34 0.17 0.00 0.00 0.00 9 R H H 138.75 1.47 14.48 15.43 91.88 49.92 -64.75 -40.83 0.64 0.00 99.35 0.12 0.05 0.38 99.32 0.12 0.00 0.00 0.00 10 F H H 107.54 2.25 14.04 16.67 92.01 49.69 -64.45 -42.14 0.53 0.00 99.46 0.11 0.04 0.30 99.45 0.09 0.00 0.00 0.00 11 L H H 83.32 2.82 13.78 17.45 91.93 50.10 -64.25 -41.16 0.48 0.00 99.52 0.09 0.03 0.28 99.48 0.12 0.00 0.00 0.00 12 A H H 56.02 2.00 14.06 16.35 91.50 50.84 -63.89 -41.09 0.83 0.00 99.17 0.11 0.05 0.54 99.11 0.18 0.00 0.00 0.00 13 K H H 120.84 1.55 14.53 15.64 92.33 50.02 -65.43 -40.00 1.31 0.00 98.68 0.16 0.09 0.91 98.52 0.31 0.00 0.00 0.00 14 K H H 111.93 2.60 13.27 16.59 92.38 50.93 -65.63 -39.94 2.15 0.01 97.84 0.27 0.16 1.53 97.08 0.96 0.00 0.00 0.00 15 Q H H 108.58 2.21 12.97 15.84 92.23 51.63 -65.54 -37.03 6.74 0.03 93.23 0.68 0.48 5.22 91.76 1.83 0.01 0.01 0.01 16 K H H 136.01 1.74 12.60 14.73 92.75 53.83 -69.90 -28.14 22.02 0.14 77.84 3.25 1.96 16.54 74.92 3.14 0.03 0.06 0.08 17 Q C H 118.98 2.67 11.21 15.15 94.84 63.53 -72.69 -19.87 51.01 0.47 48.52 8.47 6.37 35.86 45.20 3.55 0.06 0.18 0.31 18 N C T 114.71 2.47 11.00 14.52 98.84 53.19 -90.31 5.35 76.06 0.78 23.16 21.51 11.26 43.61 19.09 3.70 0.01 0.31 0.49 19 R C C 141.75 3.02 10.21 15.18 117.79 109.02 -94.79 135.59 97.50 2.10 0.40 56.43 40.61 0.84 0.23 0.14 0.00 0.86 0.89 20 P C C 102.92 2.33 11.70 15.47 114.01 -105.63 -67.38 146.70 92.44 7.03 0.53 87.30 4.31 0.52 0.33 0.15 0.00 2.23 5.16 21 I C C 91.25 7.38 8.10 17.10 115.19 -110.70 -82.29 139.28 95.73 2.35 1.91 84.34 10.39 0.90 1.70 0.32 0.00 0.89 1.46 22 P C C 72.97 3.91 11.56 17.19 111.10 -105.23 -64.07 140.26 91.65 1.52 6.83 87.52 2.45 1.75 6.19 0.70 0.00 0.60 0.78 23 Q H H 125.54 2.67 10.98 15.30 93.38 -135.24 -62.75 -32.48 18.79 1.42 79.79 7.91 4.67 8.24 68.85 8.80 0.11 1.02 0.39 24 W H H 164.33 1.76 11.96 14.19 92.70 60.26 -66.26 -34.56 10.10 3.78 86.12 3.73 1.83 5.44 73.88 10.81 0.11 3.88 0.30 25 I H H 78.20 4.52 10.73 17.11 93.89 53.43 -67.87 -38.75 5.20 4.62 90.19 2.26 0.90 2.48 77.71 11.12 0.04 5.33 0.16 26 W H H 124.79 5.20 10.23 17.20 94.10 54.01 -69.04 -34.70 7.37 7.64 84.99 3.36 1.25 3.33 74.76 8.63 0.07 8.26 0.34 27 M H H 113.34 2.66 10.81 14.67 96.88 54.82 -77.18 -25.25 19.03 18.51 62.45 9.54 3.21 7.19 55.86 5.52 0.22 16.88 1.57 28 K H H 133.33 2.54 9.67 13.54 103.21 71.65 -81.84 -6.95 33.01 23.19 43.80 16.17 5.94 11.46 39.87 4.11 0.34 19.28 2.82 29 T C H 85.53 3.43 8.45 13.43 106.90 56.24 -101.72 60.38 49.30 17.81 32.88 17.05 10.21 22.37 29.14 4.04 0.89 12.59 3.70 30 G C T 63.03 0.85 10.83 11.51 101.72 -81.87 68.66 -8.69 90.66 0.85 8.49 13.02 18.56 59.36 5.47 2.71 0.00 0.47 0.41 31 N C T 125.02 2.08 9.15 12.52 100.38 -20.68 -87.44 17.82 94.21 1.08 4.71 17.13 28.18 49.36 1.94 2.36 0.00 0.65 0.38 32 K C C 147.48 1.54 10.29 12.90 113.98 119.76 -95.52 126.57 67.34 29.14 3.52 37.94 23.63 7.02 1.90 1.89 0.03 22.18 5.41 33 I C C 101.94 5.67 8.08 15.61 114.41 -131.60 -93.30 128.16 64.56 32.87 2.57 54.31 6.86 2.25 1.73 1.21 0.00 27.61 6.02 34 R C C 150.42 3.07 11.26 16.06 114.65 -168.97 -105.95 134.96 76.56 20.89 2.55 63.71 9.80 2.49 1.85 0.99 0.00 18.46 2.69 35 Y C C 145.00 4.55 9.61 16.09 120.42 -134.43 -113.35 136.81 80.61 15.64 3.75 62.20 14.94 3.21 2.81 1.33 0.00 11.41 4.10 36 N C C 76.14 5.29 9.52 16.84 115.50 -164.90 -112.49 120.29 91.86 4.27 3.86 83.16 6.52 2.00 2.95 1.06 0.00 2.75 1.56 37 S C T 81.91 2.91 9.75 14.38 94.06 -151.18 -68.91 -20.47 61.06 1.17 37.77 18.56 11.94 30.22 21.47 16.53 0.03 0.61 0.64 38 K C T 156.50 1.11 11.13 12.43 94.38 64.27 -76.52 -17.94 57.69 1.16 41.15 14.07 12.44 30.98 24.95 16.23 0.07 0.54 0.71 39 R C C 135.08 4.08 9.03 14.78 100.47 68.80 -86.77 12.04 53.34 1.62 45.04 29.42 12.26 12.00 28.54 16.15 0.02 0.78 0.83 40 R C H 138.54 4.13 9.68 15.55 100.95 107.16 -74.90 -23.75 51.07 1.39 47.54 34.12 8.30 9.20 37.36 9.69 0.01 0.72 0.61 41 H H H 124.92 2.83 10.51 14.61 102.07 61.21 -85.45 0.02 47.64 1.64 50.72 31.00 7.35 10.16 38.79 11.11 0.02 0.90 0.68 42 W H H 148.77 3.95 9.25 14.88 101.08 65.77 -77.23 -12.24 40.66 1.36 57.97 22.09 7.41 12.18 42.55 14.45 0.03 0.75 0.55 43 R H H 147.61 2.71 9.87 14.04 101.61 61.01 -78.65 -17.10 39.92 1.36 58.72 20.73 7.62 12.64 45.31 12.37 0.04 0.74 0.55 44 R H H 149.96 2.96 9.34 13.78 101.12 96.41 -77.65 -24.48 41.98 1.33 56.70 21.52 9.67 11.95 44.68 10.91 0.05 0.65 0.58 45 T H H 92.23 2.70 8.75 12.90 101.56 71.56 -81.70 -20.97 44.72 1.24 54.04 22.66 9.35 13.33 41.72 11.73 0.04 0.61 0.56 46 K C H 156.63 1.38 9.04 11.33 98.02 61.31 -75.50 -15.96 51.15 1.46 47.39 21.50 10.68 19.79 34.44 12.10 0.06 0.71 0.72 47 L C T 116.14 2.73 7.91 12.16 99.51 62.73 -82.60 -3.73 64.64 1.59 33.77 19.39 12.48 33.53 22.89 10.05 0.06 0.76 0.84 48 G C C 59.03 1.49 10.53 12.89 99.99 -107.82 74.83 9.48 90.52 0.94 8.54 53.77 3.69 34.24 5.06 2.27 0.00 0.52 0.45 49 L C C 100.65 5.46 9.73 16.78 104.17 126.25 -82.86 22.22 99.79 0.15 0.06 99.56 0.17 0.12 0.03 0.01 0.00 0.08 0.03