# 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 92.43 10.29 12.91 23.84 119.76 -150.61 -101.58 137.30 99.97 0.03 0.00 99.93 0.05 0.01 0.00 0.00 0.00 0.01 0.00 1 P C C 71.55 8.15 12.12 21.52 113.79 -110.92 -68.66 147.67 96.73 0.85 2.42 89.84 0.72 6.98 0.93 0.72 0.00 0.49 0.31 2 K C C 149.86 3.17 14.34 18.95 106.58 -136.99 -86.82 107.41 93.39 2.73 3.88 63.29 17.29 12.85 1.77 1.96 0.00 1.46 1.38 3 L C C 54.12 12.92 11.36 24.85 120.41 -137.31 -104.66 138.25 93.35 3.22 3.43 74.69 16.25 2.30 2.24 1.14 0.00 1.56 1.82 4 S C C 49.99 4.24 20.54 24.74 122.08 -134.50 -86.82 160.76 94.70 2.02 3.28 89.41 4.29 0.88 3.03 0.37 0.00 0.72 1.30 5 A H H 35.32 16.06 12.34 28.29 92.12 -108.60 -59.01 -38.13 5.09 0.03 94.88 1.41 1.00 2.70 92.40 2.46 0.01 0.01 0.01 6 A H H 66.12 2.48 18.62 20.89 91.62 54.26 -63.33 -39.45 2.81 0.01 97.17 0.40 0.32 1.94 93.65 3.69 0.00 0.01 0.00 7 E H H 91.58 4.50 18.42 23.58 91.89 49.86 -66.39 -39.07 1.74 0.01 98.25 0.29 0.18 1.13 93.89 4.50 0.00 0.01 0.00 8 L H H 10.75 22.28 11.32 33.23 91.77 51.63 -65.49 -39.06 1.94 0.01 98.05 0.26 0.18 1.31 93.33 4.91 0.00 0.00 0.00 9 R H H 118.56 9.95 16.49 27.05 90.99 57.46 -65.90 -27.56 23.72 0.02 76.26 0.49 0.67 23.26 70.96 4.58 0.02 0.01 0.02 10 Q C T 142.92 1.00 19.23 18.29 93.58 55.48 -84.79 -8.54 58.00 0.03 41.97 0.97 1.68 56.40 37.22 3.68 0.01 0.01 0.04 11 L C S 37.16 15.40 8.62 23.98 119.86 100.99 -79.04 148.48 98.10 0.32 1.58 42.17 54.62 1.11 1.52 0.16 0.00 0.05 0.36 12 S C C 58.92 2.31 20.29 21.32 121.19 -119.36 -79.98 164.78 98.79 0.36 0.85 97.84 0.74 0.30 0.72 0.05 0.00 0.07 0.28 13 G H H 32.32 12.50 12.72 25.46 92.33 -100.32 -57.34 -42.59 2.74 0.01 97.26 0.49 0.52 1.58 96.84 0.56 0.00 0.00 0.00 14 E H H 134.63 1.49 18.51 19.12 92.20 51.09 -65.10 -40.11 1.09 0.00 98.90 0.11 0.10 0.79 98.45 0.56 0.00 0.00 0.00 15 E H H 95.65 3.58 18.80 22.65 91.76 49.34 -65.14 -40.45 0.52 0.00 99.48 0.09 0.04 0.33 98.94 0.60 0.00 0.00 0.00 16 L H H 11.95 19.33 12.92 32.72 91.56 50.35 -63.35 -42.94 0.21 0.00 99.79 0.03 0.01 0.11 99.70 0.14 0.00 0.00 0.00 17 R H H 98.96 9.86 18.91 29.23 91.30 50.69 -62.57 -41.83 0.24 0.00 99.76 0.02 0.01 0.15 99.76 0.06 0.00 0.00 0.00 18 N H H 88.32 1.75 22.79 22.25 91.68 49.70 -64.18 -41.89 0.35 0.00 99.65 0.03 0.01 0.24 99.67 0.06 0.00 0.00 0.00 19 K H H 79.35 8.32 20.51 29.41 91.86 49.27 -65.23 -40.92 0.32 0.00 99.68 0.03 0.02 0.20 99.70 0.05 0.00 0.00 0.00 20 V H H 11.77 20.11 15.31 35.64 91.73 50.59 -64.09 -42.57 0.22 0.00 99.78 0.03 0.01 0.13 99.79 0.04 0.00 0.00 0.00 21 R H H 122.77 4.04 22.13 26.36 91.34 51.02 -63.41 -41.59 0.20 0.00 99.80 0.03 0.01 0.12 99.82 0.03 0.00 0.00 0.00 22 E H H 103.17 2.17 22.92 23.45 91.53 49.54 -64.45 -41.67 0.31 0.00 99.69 0.04 0.01 0.19 99.72 0.04 0.00 0.00 0.00 23 L H H 21.34 14.94 16.80 32.83 91.71 49.85 -64.19 -41.95 0.41 0.00 99.59 0.05 0.02 0.24 99.65 0.04 0.00 0.00 0.00 24 K H H 80.89 12.37 18.63 30.87 91.26 52.26 -62.34 -41.66 0.31 0.00 99.69 0.04 0.01 0.16 99.75 0.04 0.00 0.00 0.00 25 E H H 114.86 1.63 22.62 22.10 91.73 50.10 -64.27 -41.62 0.19 0.00 99.81 0.02 0.01 0.10 99.84 0.03 0.00 0.00 0.00 26 E H H 91.20 5.17 20.69 26.30 91.70 49.04 -64.87 -41.13 0.23 0.00 99.77 0.02 0.01 0.14 99.77 0.05 0.00 0.00 0.00 27 L H H 24.60 16.56 15.29 32.26 91.82 49.97 -64.39 -41.80 0.34 0.00 99.66 0.03 0.01 0.23 99.65 0.08 0.00 0.00 0.00 28 F H H 101.61 4.24 20.67 25.18 91.71 50.29 -63.78 -40.92 0.60 0.00 99.39 0.04 0.02 0.48 99.31 0.15 0.00 0.00 0.00 29 G H H 36.96 2.40 20.95 22.38 91.72 50.32 -64.41 -40.85 2.52 0.00 97.48 0.12 0.10 2.16 97.32 0.31 0.00 0.00 0.00 30 L H H 32.90 12.43 15.00 28.72 91.94 51.33 -64.65 -41.00 2.39 0.01 97.60 0.26 0.18 1.71 96.98 0.86 0.00 0.00 0.00 31 R H H 110.39 8.27 17.21 26.29 91.78 52.25 -63.32 -41.46 2.53 0.02 97.46 0.46 0.27 1.65 96.22 1.39 0.01 0.01 0.01 32 F H H 129.13 1.35 19.06 18.43 92.05 49.43 -64.64 -40.78 3.89 0.04 96.07 0.72 0.46 2.68 94.49 1.58 0.02 0.02 0.02 33 Q H H 77.61 4.25 15.31 20.79 92.83 49.41 -66.08 -40.11 5.57 0.10 94.33 1.69 0.92 3.19 92.39 1.69 0.03 0.05 0.04 34 S H H 34.15 11.14 10.81 22.97 92.65 53.35 -64.57 -40.05 8.03 0.10 91.87 1.97 0.99 5.18 87.89 3.85 0.03 0.05 0.04 35 A H H 84.54 1.75 13.53 15.89 91.73 53.52 -66.59 -29.08 15.64 0.09 84.27 1.22 1.29 13.17 80.61 3.56 0.06 0.04 0.05 36 T C T 99.57 1.33 12.73 13.84 94.21 50.29 -86.88 -2.69 66.59 0.10 33.31 1.13 4.06 60.73 30.64 3.26 0.02 0.04 0.12 37 G C T 57.04 2.32 11.59 15.46 95.78 -111.03 79.94 9.19 98.19 0.06 1.75 4.25 11.03 83.13 0.94 0.57 0.00 0.03 0.04 38 Q C C 124.74 2.08 13.33 16.18 96.72 121.44 -82.46 -15.26 98.19 0.34 1.46 60.24 34.18 3.69 0.47 1.03 0.00 0.12 0.26 39 L C C 49.06 14.05 7.44 21.01 118.17 58.99 -108.43 125.97 96.21 0.99 2.80 74.31 17.33 4.24 0.92 1.91 0.00 0.33 0.96 40 E C C 152.66 1.44 15.83 17.17 100.10 -165.50 -88.44 -20.78 98.25 0.26 1.48 54.75 39.29 4.28 0.65 0.73 0.00 0.09 0.21 41 N C C 82.84 5.04 13.29 19.83 109.09 56.04 -104.86 97.48 97.18 0.46 2.36 71.23 21.21 4.67 1.34 0.92 0.00 0.13 0.49 42 T H H 74.54 7.82 11.93 21.38 94.39 -173.73 -66.86 -31.33 19.96 0.10 79.95 9.67 4.26 6.44 76.61 2.92 0.00 0.03 0.06 43 A H H 72.03 1.63 17.39 18.19 91.57 58.20 -63.53 -40.12 6.78 0.02 93.20 1.27 0.83 4.21 91.05 2.62 0.00 0.00 0.01 44 R H H 107.38 5.94 17.18 24.14 92.08 50.33 -65.76 -40.21 2.34 0.01 97.65 0.68 0.26 1.23 95.51 2.30 0.00 0.00 0.00 45 L H H 26.94 16.05 13.46 30.00 91.90 51.99 -63.74 -42.18 0.70 0.00 99.30 0.23 0.07 0.33 98.75 0.63 0.00 0.00 0.00 46 R H H 126.28 3.34 21.11 24.33 91.73 50.82 -64.04 -40.99 0.53 0.00 99.47 0.15 0.04 0.28 99.27 0.25 0.00 0.00 0.00 47 E H H 95.10 3.20 21.74 24.45 91.83 50.29 -64.38 -42.01 0.55 0.00 99.45 0.11 0.04 0.33 99.33 0.19 0.00 0.00 0.00 48 V H H 21.08 16.02 17.04 33.66 91.87 49.60 -64.29 -42.55 0.57 0.00 99.43 0.13 0.04 0.31 99.44 0.08 0.00 0.00 0.00 49 R H H 102.22 10.49 20.45 30.97 91.68 51.27 -62.55 -41.84 0.16 0.00 99.84 0.02 0.01 0.08 99.87 0.02 0.00 0.00 0.00 50 K H H 114.38 2.47 23.66 25.04 91.76 49.64 -64.57 -41.62 0.07 0.00 99.93 0.01 0.00 0.04 99.94 0.01 0.00 0.00 0.00 51 D H H 43.92 10.64 20.96 32.18 91.82 49.51 -64.77 -41.85 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 52 I H H 24.67 17.45 18.71 36.19 91.53 50.08 -63.67 -42.61 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 53 A H H 49.44 4.56 22.79 27.46 91.23 50.84 -62.91 -41.61 0.05 0.00 99.95 0.00 0.00 0.03 99.96 0.01 0.00 0.00 0.00 54 R H H 115.49 4.42 23.70 28.14 91.67 50.14 -64.34 -41.58 0.08 0.00 99.92 0.00 0.00 0.05 99.93 0.01 0.00 0.00 0.00 55 V H H 19.69 17.61 18.54 36.50 91.65 50.10 -64.29 -42.93 0.07 0.00 99.93 0.00 0.00 0.05 99.93 0.01 0.00 0.00 0.00 56 Y H H 89.01 10.53 21.53 32.11 91.50 50.31 -63.32 -41.90 0.09 0.00 99.91 0.01 0.00 0.06 99.91 0.02 0.00 0.00 0.00 57 T H H 66.94 3.10 23.12 25.34 91.66 50.04 -63.90 -42.61 0.24 0.00 99.76 0.03 0.01 0.15 99.77 0.04 0.00 0.00 0.00 58 V H H 35.68 10.09 19.70 31.03 91.77 49.50 -64.23 -42.86 0.33 0.00 99.67 0.04 0.02 0.20 99.68 0.06 0.00 0.00 0.00 59 L H H 28.97 14.26 17.39 32.52 91.57 49.76 -63.89 -41.82 0.58 0.00 99.42 0.10 0.04 0.32 99.42 0.12 0.00 0.00 0.00 60 Q H H 88.24 3.95 19.97 24.12 91.82 50.24 -64.06 -41.25 1.64 0.01 98.35 0.31 0.12 0.98 98.23 0.35 0.00 0.00 0.00 61 E H H 89.54 4.05 17.77 22.48 92.25 50.01 -65.20 -40.86 3.26 0.02 96.72 0.61 0.31 2.09 96.12 0.85 0.01 0.01 0.00 62 R H H 93.78 9.30 14.92 25.08 92.56 49.51 -66.42 -39.85 6.66 0.04 93.29 1.23 0.68 4.50 92.25 1.29 0.01 0.02 0.02 63 N H H 93.01 5.00 14.88 21.10 92.66 51.13 -67.85 -31.36 15.51 0.08 84.42 2.04 1.47 11.64 83.17 1.58 0.02 0.03 0.04 64 L H H 102.03 2.82 14.11 17.58 94.77 50.71 -80.98 -11.41 47.34 0.26 52.40 5.06 6.36 35.11 50.45 2.68 0.05 0.10 0.19 65 N C T 109.18 3.35 13.89 18.43 98.50 -106.55 54.70 18.49 62.76 0.47 36.77 13.62 7.93 40.79 32.49 4.64 0.02 0.20 0.31 66 I C C 81.19 7.18 11.28 20.01 100.80 120.04 -85.36 0.05 62.31 1.68 36.01 32.62 11.98 18.74 26.06 8.86 0.03 0.74 0.99 67 V C C 76.99 7.49 11.13 19.91 110.21 77.49 -93.16 106.16 68.61 2.20 29.19 32.73 15.05 21.72 20.35 7.95 0.03 0.98 1.18 68 D C C 111.55 2.39 13.43 16.70 102.47 47.78 -88.27 5.93 78.04 1.34 20.63 34.47 21.54 22.69 12.98 6.88 0.01 0.53 0.90 69 D C C 71.72 5.44 10.69 17.97 112.59 87.37 -101.19 113.50 98.13 0.48 1.39 64.04 32.66 1.42 0.94 0.40 0.00 0.14 0.41 70 P C T 90.48 4.68 10.31 17.04 94.02 -146.96 -63.07 -24.73 73.03 0.42 26.54 24.80 10.81 38.22 11.88 13.76 0.00 0.19 0.32 71 D C T 111.16 1.80 12.28 14.68 96.37 60.48 -79.10 -10.90 69.24 0.63 30.13 19.92 11.54 38.39 14.40 14.95 0.01 0.28 0.51 72 S C C 55.26 6.12 9.14 16.93 101.61 71.83 -78.46 2.21 64.91 1.29 33.81 38.52 14.13 12.45 17.79 15.75 0.01 0.57 0.77 73 T C C 87.70 4.53 9.66 15.74 102.58 92.61 -83.47 -4.45 66.94 1.80 31.26 44.72 11.61 10.89 21.38 9.62 0.01 0.86 0.90 74 K C C 147.62 2.23 10.06 13.64 105.03 80.57 -85.39 29.32 69.81 2.32 27.87 44.81 12.82 12.62 19.35 8.17 0.01 1.13 1.10 75 E C C 138.56 2.45 9.41 13.49 108.32 113.68 -86.06 92.33 81.75 1.28 16.97 71.24 1.95 10.01 11.83 3.64 0.00 0.69 0.65 76 A C C 75.77 4.53 10.48 16.77 110.39 -121.12 -78.41 133.03 99.91 0.04 0.05 99.79 0.08 0.08 0.03 0.00 0.00 0.02 0.00