# 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 117.68 5.44 10.74 18.06 114.72 -146.33 -93.07 131.16 99.75 0.21 0.04 99.61 0.17 0.06 0.02 0.00 0.00 0.10 0.04 1 T C C 101.14 2.66 9.73 14.12 112.83 -143.64 -89.77 136.75 88.17 1.51 10.32 81.81 1.48 6.39 5.41 3.32 0.00 0.81 0.80 2 G C C 55.03 2.50 9.25 13.33 111.60 -105.51 -77.42 165.65 64.90 2.62 32.49 33.51 13.50 18.77 13.16 18.37 0.03 1.27 1.40 3 L C C 125.74 2.57 8.63 12.90 108.60 -77.22 -86.31 115.07 53.60 3.99 42.41 26.89 11.44 16.20 17.23 24.37 0.06 2.21 1.59 4 S C C 78.86 3.05 9.16 13.88 112.13 -149.66 -94.63 127.50 50.91 7.04 42.05 30.17 9.25 12.18 18.61 23.09 0.06 4.35 2.28 5 M C C 124.41 4.08 8.78 14.64 107.68 -145.30 -90.92 84.76 55.21 9.72 35.07 29.54 11.90 14.67 19.01 15.32 0.23 5.42 3.91 6 D C C 112.44 2.39 10.47 14.29 106.32 111.34 -87.52 77.19 68.08 7.80 24.13 32.99 15.27 21.03 14.20 8.93 0.13 4.20 3.25 7 G C C 56.57 2.73 10.93 15.14 103.10 -64.07 70.85 12.20 82.46 4.19 13.36 36.29 20.75 26.50 6.10 6.35 0.02 2.08 1.92 8 G C C 52.75 3.59 10.32 15.58 107.77 -142.31 29.18 15.89 90.85 2.62 6.53 32.28 27.66 31.40 1.87 4.32 0.00 1.29 1.18 9 G C C 55.63 2.56 11.73 15.47 110.49 -78.80 91.19 43.64 94.11 3.19 2.70 40.15 34.73 19.30 0.48 2.36 0.00 1.57 1.41 10 S C C 65.89 5.12 9.35 16.33 118.36 -82.21 -91.42 140.63 96.28 3.16 0.55 66.81 28.20 1.34 0.18 0.35 0.00 1.34 1.77 11 P C C 93.21 3.74 9.97 15.46 109.45 -105.89 -68.81 147.62 91.94 2.45 5.61 66.31 10.96 13.94 1.02 5.22 0.00 1.33 1.22 12 K C T 161.27 1.67 9.69 12.77 109.79 -106.61 -81.70 130.49 86.27 3.08 10.65 30.69 20.19 35.44 1.46 9.24 0.00 1.45 1.52 13 G C T 55.48 2.16 10.25 13.73 112.94 23.52 98.27 -15.88 87.28 2.12 10.60 24.80 28.18 34.15 1.26 9.55 0.00 1.03 1.03 14 D C C 116.16 1.98 10.35 13.56 107.76 -73.15 -88.81 98.16 88.15 3.58 8.27 53.50 21.78 12.12 1.44 7.46 0.00 1.81 1.89 15 V C C 94.40 4.67 8.57 15.18 115.04 119.98 -95.10 134.04 90.32 6.06 3.61 60.59 24.56 4.55 1.41 2.14 0.00 2.34 4.41 16 D C C 79.83 4.82 10.06 16.81 111.41 -124.05 -88.92 119.34 97.02 1.66 1.32 81.14 14.06 1.72 0.48 0.78 0.00 0.73 1.10 17 P C T 93.54 4.25 10.13 16.40 94.46 -150.79 -67.51 -17.66 71.77 0.80 27.43 15.77 8.94 46.75 5.01 22.64 0.00 0.42 0.46 18 F C T 141.41 3.27 10.56 15.17 97.56 63.96 -84.00 -6.18 69.67 1.43 28.90 11.79 9.92 47.56 6.26 22.90 0.01 0.79 0.77 19 Y C C 152.95 2.99 11.48 15.81 106.97 72.50 -94.23 60.62 64.33 4.34 31.33 30.63 15.06 20.08 8.14 21.64 0.04 2.16 2.25 20 Y C C 114.84 6.89 8.88 17.42 119.42 115.75 -103.36 139.23 80.01 4.56 15.43 45.63 25.34 9.33 10.15 4.79 0.02 1.75 2.99 21 D C C 87.15 3.35 12.28 16.92 108.68 -131.07 -87.61 114.98 87.42 1.62 10.96 74.08 7.79 4.91 9.73 1.80 0.00 0.67 1.03 22 Y H H 138.01 4.40 11.31 17.56 94.26 -153.56 -64.84 -34.66 6.68 0.05 93.27 2.38 1.31 3.28 91.63 1.34 0.01 0.02 0.02 23 E H H 122.65 1.94 13.89 16.16 92.19 54.28 -65.55 -39.69 3.18 0.02 96.79 0.61 0.37 2.13 95.47 1.39 0.01 0.01 0.01 24 T H H 71.20 2.88 13.87 17.53 92.70 49.40 -66.65 -40.84 2.55 0.03 97.41 0.66 0.32 1.57 95.75 1.67 0.01 0.02 0.01 25 V H H 72.75 4.43 13.40 19.20 92.85 48.86 -66.02 -40.95 2.49 0.05 97.47 0.86 0.32 1.31 96.42 1.05 0.00 0.03 0.01 26 R H H 129.09 3.10 15.49 19.33 92.26 50.30 -64.99 -41.49 2.96 0.07 96.97 0.91 0.36 1.69 96.29 0.68 0.01 0.04 0.02 27 N H H 87.90 2.56 16.62 19.16 92.43 48.51 -66.07 -40.76 2.40 0.02 97.57 0.54 0.28 1.47 97.32 0.37 0.00 0.01 0.01 28 G H H 32.52 3.45 15.76 20.02 92.16 51.12 -64.17 -41.71 1.84 0.01 98.15 0.38 0.17 1.08 98.09 0.27 0.00 0.00 0.00 29 G H H 32.40 4.21 15.51 20.96 92.13 51.10 -64.24 -40.87 1.47 0.01 98.52 0.36 0.12 0.82 98.46 0.23 0.00 0.00 0.00 30 L H H 94.40 2.86 16.32 19.52 92.22 49.73 -65.34 -40.63 0.59 0.00 99.41 0.15 0.04 0.31 99.37 0.12 0.00 0.00 0.00 31 I H H 100.03 2.14 16.64 18.43 92.21 49.39 -64.83 -42.22 0.35 0.00 99.64 0.07 0.02 0.20 99.65 0.05 0.00 0.00 0.00 32 F H H 121.38 2.09 16.79 18.45 92.32 48.49 -65.06 -41.65 0.22 0.00 99.78 0.03 0.01 0.12 99.80 0.03 0.00 0.00 0.00 33 A H H 54.00 3.17 15.39 19.32 91.81 50.40 -64.29 -41.36 0.15 0.00 99.85 0.02 0.00 0.10 99.86 0.02 0.00 0.00 0.00 34 G H H 35.53 2.89 15.52 18.98 91.81 50.65 -64.03 -41.63 0.18 0.00 99.82 0.01 0.01 0.13 99.83 0.02 0.00 0.00 0.00 35 L H H 95.23 1.99 16.27 17.81 92.01 50.01 -64.61 -41.48 0.09 0.00 99.91 0.01 0.00 0.06 99.92 0.01 0.00 0.00 0.00 36 A H H 62.14 2.31 15.64 18.01 91.77 50.62 -64.29 -41.31 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 37 F H H 121.81 2.44 15.41 17.97 92.12 49.70 -65.12 -40.66 0.11 0.00 99.89 0.01 0.00 0.08 99.89 0.02 0.00 0.00 0.00 38 I H H 96.45 2.23 15.83 17.90 92.01 49.42 -64.88 -41.95 0.12 0.00 99.88 0.01 0.00 0.09 99.88 0.02 0.00 0.00 0.00 39 V H H 83.06 2.09 15.97 17.75 91.84 49.33 -64.14 -41.69 0.17 0.00 99.83 0.01 0.00 0.11 99.84 0.03 0.00 0.00 0.00 40 G H H 33.69 3.24 14.18 18.56 91.72 51.10 -63.37 -41.16 0.39 0.00 99.61 0.02 0.01 0.29 99.61 0.06 0.00 0.00 0.00 41 L H H 92.08 2.31 14.96 17.39 92.00 50.34 -64.91 -41.09 0.23 0.00 99.77 0.01 0.01 0.16 99.71 0.10 0.00 0.00 0.00 42 L H H 93.92 2.00 14.44 16.44 92.23 50.03 -65.04 -40.85 0.30 0.00 99.70 0.03 0.02 0.21 99.50 0.25 0.00 0.00 0.00 43 I H H 93.28 2.46 12.97 16.17 92.73 49.22 -65.61 -40.21 0.82 0.00 99.17 0.07 0.05 0.64 98.62 0.63 0.00 0.00 0.00 44 L H H 104.85 2.07 12.28 14.97 93.10 50.33 -66.86 -37.89 2.80 0.01 97.19 0.19 0.16 2.35 96.44 0.85 0.00 0.01 0.00 45 L H H 122.61 1.31 11.87 13.08 94.40 49.57 -74.76 -26.51 13.08 0.08 86.85 1.19 1.20 10.62 85.46 1.43 0.04 0.03 0.04 46 S H H 67.76 3.23 9.76 14.49 100.78 62.12 -85.09 -3.75 42.80 1.06 56.14 12.76 7.96 23.77 50.72 3.66 0.11 0.43 0.59 47 R C H 174.24 2.19 10.88 14.37 99.59 -146.39 -32.48 21.99 60.84 1.97 37.20 20.79 14.84 26.37 28.67 7.33 0.09 0.93 0.97 48 R C C 163.91 1.98 11.08 14.24 113.16 102.40 -94.47 131.72 66.05 4.52 29.43 35.29 12.82 18.25 21.45 7.80 0.06 2.44 1.88 49 F C C 123.48 5.73 8.17 15.60 114.92 88.24 -96.57 127.56 73.53 6.49 19.98 52.58 10.16 9.78 15.10 5.75 0.02 3.86 2.75 50 R C C 167.35 2.06 10.97 14.45 112.80 -163.59 -98.89 125.64 75.52 7.95 16.52 48.68 12.94 13.03 12.22 5.10 0.03 4.66 3.34 51 C C C 86.66 4.25 8.45 14.41 111.95 -165.39 -94.60 117.80 78.28 5.16 16.57 43.00 16.77 18.75 10.05 6.40 0.03 2.74 2.26 52 G C C 52.74 2.42 10.26 13.91 108.19 -0.71 79.45 -1.77 74.33 2.45 23.22 32.93 18.77 23.30 11.95 10.54 0.03 1.09 1.40 53 G C T 55.70 2.10 10.26 13.50 105.29 -19.46 49.29 -38.25 67.67 1.29 31.04 19.68 19.82 29.04 15.77 14.19 0.04 0.55 0.91 54 N C C 116.09 2.22 9.71 13.22 105.56 56.62 -87.62 65.77 62.68 1.68 35.64 29.67 15.47 18.11 20.30 14.66 0.04 0.73 1.02 55 K C C 137.33 3.15 9.05 14.04 108.60 100.42 -85.65 103.01 54.76 1.83 43.41 32.91 11.88 10.80 29.72 12.92 0.03 0.85 0.89 56 K C C 144.73 2.31 10.13 13.90 110.73 72.26 -86.03 128.23 53.29 2.08 44.64 35.43 9.48 9.02 31.41 12.70 0.02 1.09 0.86 57 R C C 162.17 2.75 9.64 13.99 110.06 -114.99 -85.36 126.56 55.08 2.83 42.09 39.46 7.46 8.36 30.13 11.85 0.01 1.61 1.12 58 R C C 145.47 4.27 8.84 14.89 113.71 -144.32 -92.25 130.70 61.30 2.83 35.87 43.88 8.87 8.63 26.27 9.59 0.01 1.54 1.20 59 Q C C 125.16 2.61 10.08 14.28 113.10 -146.61 -92.68 129.81 70.04 2.76 27.21 51.27 11.05 7.51 21.90 5.59 0.01 1.37 1.31 60 I C C 110.70 4.26 7.97 13.96 108.61 -148.06 -87.15 101.85 73.99 2.10 23.91 50.19 13.40 10.25 18.02 6.00 0.01 0.98 1.16 61 N C C 105.33 2.81 9.05 13.27 109.46 61.48 -91.29 105.03 78.02 1.51 20.48 52.95 11.75 13.22 10.03 10.39 0.00 0.72 0.94 62 E C T 149.77 1.71 8.46 11.57 98.04 -116.48 -74.22 -15.57 77.36 1.19 21.45 27.09 17.55 34.09 6.53 13.44 0.01 0.53 0.76 63 D C T 121.39 1.13 8.66 10.56 101.51 63.72 -89.43 8.72 81.94 1.45 16.61 32.81 17.36 33.09 4.01 11.24 0.01 0.65 0.84 64 E C C 126.23 2.96 7.19 12.17 114.75 111.27 -89.16 132.14 98.58 0.63 0.79 87.28 10.20 1.21 0.31 0.33 0.00 0.25 0.42 65 P C C 99.62 3.08 10.58 15.35 110.31 -105.59 -67.69 145.59 99.91 0.05 0.04 99.66 0.17 0.11 0.01 0.00 0.00 0.02 0.01