# 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 I C C 99.12 6.98 13.22 21.73 116.48 -157.11 -100.71 124.42 98.39 1.60 0.01 98.65 0.16 0.02 0.00 0.00 0.00 1.03 0.13 1 I C C 96.17 6.28 11.49 19.58 117.55 -161.04 -105.55 128.86 79.61 20.20 0.19 79.86 1.26 0.18 0.12 0.06 0.00 10.40 8.13 2 E C C 123.97 4.51 12.47 18.87 114.44 -133.13 -90.69 126.38 93.88 5.85 0.27 89.73 4.26 0.31 0.15 0.09 0.00 4.53 0.93 3 P C C 63.02 9.90 11.21 22.14 112.53 -115.89 -69.93 148.98 91.23 3.55 5.22 83.17 5.07 3.01 4.23 1.07 0.00 2.35 1.10 4 S C C 56.35 4.41 17.65 22.46 117.35 -126.23 -86.10 156.23 86.04 5.36 8.60 79.30 3.97 2.07 8.26 0.92 0.00 1.70 3.77 5 L H H 62.94 14.27 12.61 26.88 93.38 -113.78 -61.90 -35.76 5.28 0.11 94.60 2.63 1.26 2.08 92.78 1.17 0.01 0.05 0.03 6 K H H 122.54 4.78 16.39 22.44 91.78 55.25 -63.67 -40.60 2.30 0.10 97.61 0.93 0.38 1.20 96.07 1.33 0.01 0.08 0.02 7 A H H 51.22 2.96 17.91 21.01 91.96 50.37 -64.68 -40.98 1.47 0.16 98.36 0.58 0.26 0.78 96.64 1.58 0.01 0.14 0.02 8 L H H 39.15 9.88 15.38 26.97 92.66 49.51 -65.17 -41.64 1.24 0.11 98.65 0.44 0.18 0.68 97.48 1.12 0.01 0.08 0.01 9 A H H 17.47 13.61 12.15 27.02 91.93 52.18 -64.26 -40.89 2.52 0.08 97.40 0.68 0.24 1.62 95.52 1.86 0.01 0.06 0.02 10 S H H 75.03 2.52 15.89 18.84 92.40 52.04 -65.97 -38.40 7.32 0.05 92.63 0.75 0.43 5.96 90.34 2.46 0.02 0.03 0.02 11 K H H 144.09 1.86 15.87 17.65 92.64 51.78 -68.55 -31.96 13.72 0.08 86.21 0.67 0.78 12.59 84.25 1.58 0.05 0.03 0.04 12 Y C T 94.87 9.43 12.07 22.60 99.85 42.05 -98.91 5.70 72.76 0.43 26.81 2.85 6.38 60.95 27.28 2.02 0.04 0.15 0.33 13 N C T 111.40 3.07 16.36 20.20 96.14 -115.75 55.19 47.45 92.29 0.27 7.44 9.59 4.78 77.85 5.69 1.79 0.00 0.13 0.17 14 C C C 47.59 13.91 10.43 24.26 98.86 161.75 -83.56 2.61 81.39 1.90 16.72 38.59 11.14 31.93 4.45 11.91 0.00 0.96 1.02 15 D C T 106.52 3.31 18.34 22.29 95.49 92.99 -87.72 -1.42 78.26 2.73 19.01 25.53 17.88 35.19 3.51 15.30 0.01 1.45 1.14 16 K C C 91.22 8.16 18.19 27.24 125.78 82.24 -103.94 147.87 81.62 4.47 13.91 35.54 29.52 17.10 2.15 11.59 0.00 3.03 1.06 17 S C C 29.69 13.63 18.88 33.05 115.30 -114.05 -89.03 135.05 65.84 28.46 5.69 46.18 13.04 6.88 1.38 4.21 0.01 26.58 1.73 18 V E E 26.23 15.29 18.60 34.70 124.63 -158.15 -117.01 139.67 9.37 90.49 0.14 8.26 0.81 0.06 0.13 0.05 0.00 50.87 39.82 19 C C C 14.21 16.14 15.17 32.96 108.91 -113.69 -71.88 127.28 53.12 46.81 0.07 54.30 0.46 0.06 0.03 0.03 0.00 41.11 4.01 20 R C T 122.79 8.12 17.15 26.53 93.57 -153.05 -68.50 -28.47 97.72 0.36 1.92 0.73 2.82 94.29 0.05 1.77 0.00 0.28 0.06 21 K C T 132.30 3.47 17.59 21.75 96.53 47.89 -75.69 -40.12 98.06 0.10 1.84 0.24 1.81 96.27 0.04 1.56 0.00 0.05 0.02 22 C C T 58.56 6.67 15.09 23.24 100.66 22.23 -107.32 -10.95 98.76 0.06 1.18 0.32 1.85 96.69 0.02 1.06 0.00 0.03 0.02 23 Y C C 126.85 7.82 15.89 25.00 93.90 -122.21 66.75 25.64 98.15 1.45 0.40 47.06 7.16 44.08 0.11 0.24 0.00 0.86 0.49 24 A C C 33.27 9.72 15.37 26.90 120.52 149.51 -79.42 149.76 64.61 35.30 0.09 55.30 8.68 0.66 0.02 0.08 0.00 33.23 2.04 25 R E E 133.73 6.65 20.52 28.11 114.46 -111.42 -83.76 134.55 7.35 92.59 0.05 5.97 0.60 0.05 0.06 0.02 0.00 49.24 44.05 26 L C C 25.09 20.53 11.16 31.16 118.84 -132.45 -86.34 138.77 87.47 12.50 0.03 84.72 3.34 0.07 0.00 0.03 0.00 10.77 1.07 27 P C C 48.10 7.22 17.27 26.17 115.33 -105.14 -64.43 150.46 99.30 0.55 0.15 96.73 2.18 0.47 0.03 0.12 0.00 0.25 0.22 28 P C T 95.22 5.41 14.46 21.34 93.29 -105.59 -61.05 -27.19 93.78 0.24 5.98 1.95 5.92 85.58 0.77 5.52 0.00 0.15 0.11 29 R C T 172.57 1.81 16.49 18.18 95.86 52.64 -86.53 0.69 93.19 0.33 6.48 2.85 5.03 84.90 1.17 5.71 0.00 0.21 0.13 30 A C C 26.15 16.74 8.25 24.32 113.70 120.32 -74.38 134.58 86.06 4.45 9.49 68.91 13.21 3.10 2.63 7.28 0.00 1.88 2.99 31 T C C 94.43 3.24 17.41 21.44 107.76 -171.54 -103.97 9.11 79.38 5.66 14.96 43.98 17.01 18.65 6.28 8.35 0.02 2.98 2.72 32 N C C 100.58 4.45 17.81 23.00 103.38 26.63 -117.62 61.28 74.79 8.26 16.94 37.38 17.55 20.95 6.89 9.35 0.08 4.66 3.13 33 C C C 35.44 17.61 10.14 26.83 112.40 160.55 -90.96 127.88 69.65 8.72 21.63 54.06 8.52 6.61 11.59 10.21 0.01 5.66 3.35 34 R C C 123.45 6.13 16.12 23.33 115.66 -160.25 -97.73 137.29 66.36 12.44 21.21 44.66 12.19 9.21 12.78 8.58 0.07 7.90 4.61 35 K C C 120.46 6.78 13.63 21.62 108.69 -117.11 -81.41 115.79 67.09 12.58 20.32 42.66 13.98 10.35 12.07 8.36 0.10 7.94 4.53 36 R C C 134.71 6.18 11.31 19.02 108.22 75.08 -84.22 109.91 72.61 8.48 18.91 45.31 14.40 12.94 10.71 8.07 0.04 5.55 2.99 37 K C T 159.93 1.68 13.36 15.50 99.85 -92.29 -75.25 -20.26 76.36 6.44 17.19 29.18 18.84 29.66 8.36 7.72 0.09 3.78 2.35 38 C C T 78.54 5.64 11.00 17.96 104.90 45.34 -93.36 27.11 85.16 3.14 11.70 22.53 22.28 40.99 5.01 6.04 0.02 1.80 1.33 39 G C C 43.96 4.54 13.77 19.55 107.88 -79.95 90.50 -4.17 87.32 7.35 5.34 33.47 31.89 22.68 1.35 3.80 0.01 4.32 2.48 40 H C C 90.96 7.48 12.57 21.54 113.24 91.93 -93.52 123.92 81.41 12.09 6.49 61.68 12.54 6.24 2.28 4.50 0.01 6.44 6.32 41 T C C 66.88 10.11 12.59 23.35 101.49 -167.62 -80.86 -13.56 66.53 5.54 27.93 37.93 11.90 16.85 4.14 24.02 0.01 3.42 1.74 42 N C C 111.57 3.90 15.72 20.77 95.76 68.99 -78.60 -9.51 65.71 4.14 30.14 26.13 16.51 24.32 3.58 25.72 0.01 2.53 1.19 43 Q C C 103.21 5.57 16.11 22.64 98.07 62.98 -91.59 6.07 66.01 5.91 28.07 37.48 14.09 14.88 3.75 24.40 0.01 3.74 1.67 44 L C C 52.96 15.71 10.63 25.98 113.70 107.12 -87.77 124.32 82.30 11.51 6.19 62.91 14.85 3.39 2.44 4.04 0.01 6.44 5.93 45 R C C 131.54 4.79 16.69 22.97 122.95 -174.34 -119.13 137.19 88.44 11.01 0.55 76.83 10.97 0.57 0.29 0.29 0.00 8.14 2.91 46 P C C 71.01 8.72 11.93 21.97 114.08 -109.26 -66.33 148.35 80.03 16.43 3.54 73.28 3.83 2.20 1.75 1.67 0.00 10.37 6.90 47 K C C 133.33 4.73 10.93 17.48 108.85 -122.61 -81.92 132.56 81.77 4.83 13.40 59.90 13.81 7.78 4.01 9.56 0.00 2.88 2.04 48 K C C 143.96 2.78 9.34 13.94 113.86 -125.74 -88.01 133.54 74.04 4.25 21.70 45.50 17.81 11.27 4.66 16.69 0.01 2.56 1.51 49 K C C 154.22 2.00 9.13 12.67 109.06 -141.13 -86.78 105.92 74.93 4.25 20.82 52.44 11.41 10.72 4.22 17.15 0.00 2.71 1.35 50 L C C 110.29 4.52 6.71 12.88 110.47 -144.76 -90.81 115.89 83.21 2.82 13.97 73.34 2.97 7.91 3.63 9.28 0.00 1.75 1.12 51 K C C 157.51 1.87 11.11 14.18 109.49 -141.56 -88.08 107.20 99.74 0.11 0.14 99.30 0.24 0.29 0.06 0.02 0.00 0.06 0.02