# 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 46.12 5.05 13.44 19.93 117.43 -165.34 115.84 50.40 99.90 0.08 0.02 99.58 0.23 0.14 0.01 0.00 0.00 0.03 0.02 1 G C C 50.52 3.78 11.56 16.82 111.30 15.20 -98.53 165.10 96.24 1.10 2.66 71.81 6.33 18.35 1.05 1.27 0.00 0.53 0.67 2 T C C 103.83 2.43 10.67 14.46 105.09 -48.90 -85.71 17.95 94.27 0.85 4.88 41.50 34.28 18.74 2.62 1.96 0.00 0.32 0.59 3 D C C 91.78 3.05 11.63 15.90 108.13 99.84 -83.71 129.33 79.61 0.51 19.88 39.32 34.57 4.58 19.85 1.16 0.00 0.12 0.41 4 P H H 84.54 4.98 11.71 18.12 94.13 -119.72 -64.10 -36.33 17.48 0.08 82.44 3.50 2.64 11.55 80.00 2.21 0.03 0.03 0.05 5 A H H 57.94 4.99 13.13 19.55 93.45 53.34 -66.50 -39.12 10.75 0.05 89.20 2.25 1.40 7.02 87.37 1.89 0.02 0.02 0.03 6 T H H 70.84 2.91 15.09 18.58 93.05 51.76 -66.25 -40.63 4.37 0.03 95.60 1.84 0.72 1.92 94.23 1.25 0.00 0.01 0.01 7 M H H 89.33 4.25 15.43 20.54 92.46 50.83 -64.99 -41.81 1.51 0.01 98.48 0.55 0.18 0.71 98.12 0.43 0.00 0.00 0.00 8 V H H 61.58 7.90 15.27 24.38 92.17 49.58 -64.75 -41.45 0.65 0.00 99.35 0.18 0.06 0.33 99.23 0.20 0.00 0.00 0.00 9 N H H 82.88 4.65 17.21 22.73 92.05 50.98 -64.41 -40.46 0.56 0.00 99.44 0.12 0.04 0.31 99.39 0.14 0.00 0.00 0.00 10 N H H 87.04 2.85 18.32 21.07 92.14 50.38 -65.06 -40.73 0.93 0.00 99.07 0.10 0.05 0.64 99.03 0.18 0.00 0.00 0.00 11 I H H 65.31 8.58 17.28 26.75 92.23 49.85 -64.79 -42.35 1.05 0.00 98.95 0.08 0.05 0.78 98.90 0.19 0.00 0.00 0.00 12 C H H 39.50 11.57 15.99 28.46 91.93 50.53 -64.09 -41.13 1.20 0.00 98.80 0.15 0.09 0.80 98.37 0.59 0.00 0.00 0.00 13 T H H 80.81 3.14 19.67 22.81 92.04 50.39 -64.93 -40.05 2.68 0.01 97.31 0.22 0.15 2.13 95.14 2.34 0.01 0.00 0.00 14 F H H 98.96 5.81 18.81 25.18 92.43 49.54 -66.87 -39.85 3.79 0.01 96.20 0.21 0.22 3.24 92.76 3.55 0.01 0.00 0.00 15 I H H 43.46 15.83 15.33 31.05 93.50 49.51 -72.60 -30.49 12.21 0.04 87.74 0.76 0.99 10.73 84.79 2.65 0.04 0.01 0.03 16 L H H 81.87 9.03 16.28 26.00 98.20 47.95 -92.54 -9.28 45.70 0.36 53.93 4.28 7.51 34.20 50.87 2.61 0.11 0.11 0.30 17 G C S 29.70 5.50 15.21 22.11 124.72 92.75 -84.29 166.12 88.36 0.39 11.25 9.15 71.43 6.31 12.09 0.59 0.00 0.08 0.34 18 P H H 111.29 1.82 15.86 17.97 92.44 -79.05 -62.92 -34.06 27.96 0.07 71.97 1.12 4.65 21.69 70.99 1.39 0.07 0.02 0.06 19 F H H 132.66 2.24 17.71 19.69 92.40 50.30 -65.68 -40.42 14.33 0.03 85.64 0.78 1.37 11.89 84.75 1.16 0.03 0.01 0.02 20 G H H 9.18 15.82 13.22 29.79 91.89 51.39 -64.09 -42.00 2.70 0.01 97.29 0.45 0.27 1.67 96.74 0.86 0.00 0.00 0.00 21 Q H H 75.37 11.50 17.70 29.39 91.56 51.35 -63.11 -41.36 0.91 0.00 99.08 0.13 0.06 0.58 98.80 0.42 0.00 0.00 0.00 22 S H H 64.44 2.10 22.88 23.32 91.48 50.07 -64.08 -41.97 0.77 0.00 99.23 0.09 0.04 0.54 99.02 0.31 0.00 0.00 0.00 23 L H H 74.93 6.16 21.80 28.23 91.76 48.91 -64.64 -41.58 0.29 0.00 99.71 0.04 0.02 0.18 99.68 0.08 0.00 0.00 0.00 24 A H H 10.36 19.81 15.85 35.77 91.38 51.51 -63.12 -42.68 0.10 0.00 99.90 0.01 0.00 0.06 99.91 0.02 0.00 0.00 0.00 25 V H H 71.18 7.14 22.70 30.06 91.44 49.36 -63.27 -42.25 0.05 0.00 99.95 0.00 0.00 0.03 99.96 0.01 0.00 0.00 0.00 26 L H H 98.42 2.01 24.94 25.04 91.30 49.16 -63.71 -42.45 0.02 0.00 99.98 0.00 0.00 0.01 99.98 0.00 0.00 0.00 0.00 27 G H H 13.50 12.93 19.02 32.98 91.43 49.98 -64.02 -42.67 0.04 0.00 99.96 0.00 0.00 0.02 99.97 0.00 0.00 0.00 0.00 28 I H H 44.86 15.61 19.30 34.47 91.56 49.42 -63.42 -42.49 0.03 0.00 99.97 0.00 0.00 0.02 99.97 0.00 0.00 0.00 0.00 29 V H H 84.06 3.21 23.64 26.20 91.39 49.21 -63.64 -42.58 0.05 0.00 99.95 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 30 A H H 53.54 3.90 22.76 26.28 91.49 49.14 -64.20 -42.34 0.16 0.00 99.84 0.00 0.00 0.13 99.84 0.01 0.00 0.00 0.00 31 I H H 30.42 15.05 17.50 33.09 91.77 49.62 -64.77 -42.17 0.33 0.00 99.67 0.01 0.02 0.28 99.66 0.03 0.00 0.00 0.00 32 G H H 22.71 9.36 18.22 28.83 91.72 51.59 -62.62 -42.35 0.75 0.00 99.25 0.04 0.04 0.62 99.15 0.14 0.00 0.00 0.00 33 I H H 96.90 1.95 21.39 21.61 91.71 49.15 -64.12 -41.80 0.87 0.00 99.13 0.03 0.05 0.78 98.89 0.23 0.01 0.00 0.00 34 S H H 31.30 6.92 15.54 24.49 91.84 50.65 -64.25 -41.45 1.62 0.01 98.38 0.12 0.17 1.31 97.72 0.66 0.01 0.00 0.00 35 W H H 85.74 11.67 12.45 24.89 92.05 50.52 -64.75 -40.70 2.71 0.01 97.28 0.14 0.21 2.40 95.42 1.74 0.07 0.00 0.01 36 M H H 128.71 2.79 14.71 18.39 91.32 52.58 -66.01 -31.49 8.36 0.02 91.62 0.23 0.39 8.11 89.52 1.67 0.06 0.01 0.01 37 F C T 150.13 1.27 13.99 14.65 93.49 49.35 -87.04 -4.74 66.70 0.06 33.25 0.50 1.96 64.15 31.42 1.89 0.01 0.02 0.06 38 G C T 53.69 3.54 11.99 17.31 95.97 -111.03 78.76 12.36 99.44 0.03 0.53 2.39 3.47 93.73 0.28 0.10 0.00 0.01 0.02 39 R C C 158.41 2.13 14.57 17.39 101.58 123.00 -93.40 8.96 99.09 0.61 0.30 72.57 25.11 1.35 0.14 0.14 0.00 0.20 0.50 40 A C C 33.46 15.64 8.09 22.82 121.22 83.71 -103.55 143.12 98.30 1.09 0.61 54.68 42.00 1.66 0.28 0.27 0.00 0.34 0.75 41 S C C 63.75 2.90 17.99 20.77 120.05 -129.08 -88.22 159.41 98.66 0.51 0.83 95.22 2.81 0.75 0.54 0.18 0.00 0.15 0.36 42 L H H 119.61 4.21 13.27 19.22 92.12 -110.35 -60.12 -35.58 10.46 0.04 89.50 2.69 1.94 5.77 88.28 1.27 0.01 0.01 0.02 43 G H H 46.82 2.04 16.89 18.69 91.91 55.14 -64.04 -38.81 6.67 0.02 93.32 1.26 0.79 4.28 92.37 1.28 0.00 0.01 0.01 44 L H H 56.43 10.13 15.01 26.18 92.36 50.30 -66.48 -39.97 2.12 0.01 97.87 0.73 0.25 1.04 96.96 1.01 0.00 0.01 0.00 45 V H H 41.48 13.58 14.70 28.75 91.69 51.68 -62.62 -42.21 0.60 0.00 99.39 0.18 0.05 0.29 99.14 0.34 0.00 0.00 0.00 46 A H H 61.30 2.92 20.85 23.27 91.25 50.59 -63.58 -41.22 0.47 0.00 99.52 0.08 0.03 0.30 99.38 0.22 0.00 0.00 0.00 47 G H H 34.65 4.47 20.30 25.06 92.06 50.17 -64.96 -40.96 1.06 0.00 98.94 0.11 0.05 0.82 98.82 0.19 0.00 0.00 0.00 48 V H H 33.39 15.14 17.10 32.44 92.17 49.57 -64.72 -42.56 0.52 0.00 99.48 0.07 0.03 0.33 99.48 0.07 0.00 0.00 0.00 49 V H H 63.82 9.06 20.46 29.83 91.75 49.29 -63.34 -42.47 0.20 0.00 99.80 0.03 0.01 0.12 99.80 0.04 0.00 0.00 0.00 50 G H H 38.45 2.64 22.46 24.14 91.62 49.59 -63.81 -42.44 0.17 0.00 99.83 0.02 0.01 0.10 99.82 0.05 0.00 0.00 0.00 51 G H H 21.55 8.38 18.78 28.50 91.83 50.40 -64.05 -42.32 0.19 0.00 99.81 0.02 0.01 0.12 99.79 0.06 0.00 0.00 0.00 52 I H H 45.03 13.30 17.80 31.52 91.86 50.12 -64.00 -42.14 0.19 0.00 99.81 0.01 0.01 0.12 99.81 0.05 0.00 0.00 0.00 53 V H H 74.07 5.40 20.10 26.00 91.71 50.37 -63.73 -42.11 0.25 0.00 99.75 0.02 0.01 0.16 99.70 0.11 0.00 0.00 0.00 54 I H H 99.76 3.28 20.14 23.36 92.14 48.92 -64.95 -41.72 0.50 0.00 99.50 0.04 0.02 0.36 99.29 0.28 0.00 0.00 0.00 55 M H H 74.52 9.31 17.53 27.43 92.51 48.79 -66.62 -40.17 1.40 0.01 98.59 0.08 0.07 1.18 98.04 0.62 0.00 0.00 0.00 56 F H H 91.41 8.84 17.49 26.83 93.69 45.31 -71.40 -33.37 10.30 0.03 89.67 0.37 0.53 9.55 88.45 1.07 0.02 0.01 0.02 57 G H H 32.60 5.70 16.91 23.67 94.09 51.26 -76.20 -23.41 35.01 0.07 64.92 2.78 2.31 28.91 64.31 1.59 0.02 0.03 0.06 58 A H H 48.75 6.06 15.43 23.11 92.88 75.16 -61.64 -42.24 14.28 0.08 85.63 3.38 2.48 8.47 80.17 5.38 0.03 0.04 0.05 59 S H H 57.37 4.56 17.17 22.50 92.69 49.75 -65.68 -39.85 11.21 0.07 88.73 2.19 1.34 7.35 82.96 6.07 0.02 0.03 0.04 60 F H H 104.67 4.54 16.69 21.86 92.76 49.96 -66.26 -40.96 7.08 0.09 92.83 1.72 0.93 4.37 86.87 6.00 0.02 0.05 0.03 61 L H H 80.86 4.37 15.58 20.84 92.26 49.63 -64.45 -41.87 5.23 0.10 94.67 1.43 0.79 3.09 90.61 3.97 0.02 0.06 0.03 62 G H H 34.37 4.08 13.91 19.47 92.17 50.62 -63.76 -41.10 7.53 0.11 92.36 1.70 1.01 4.90 88.33 3.92 0.03 0.06 0.04 63 K H H 123.92 2.72 13.87 17.45 92.75 49.76 -66.38 -38.88 10.67 0.13 89.20 2.37 1.47 6.99 84.63 4.37 0.04 0.07 0.06 64 T H H 90.92 2.44 12.75 15.96 93.83 49.53 -68.35 -37.66 15.21 0.16 84.63 2.88 2.20 10.43 80.05 4.23 0.06 0.08 0.08 65 L H H 121.52 2.00 11.72 14.35 95.79 46.00 -74.99 -31.51 25.62 0.43 73.95 4.92 4.58 17.35 69.46 3.14 0.13 0.19 0.23 66 T H H 100.28 2.11 9.69 12.92 100.79 45.97 -89.59 -6.52 45.18 1.29 53.53 10.12 10.15 26.49 49.52 2.33 0.15 0.48 0.75 67 G C C 57.34 1.87 10.10 13.32 106.78 -75.48 75.10 19.18 90.54 0.52 8.94 58.72 2.41 28.99 8.45 0.88 0.00 0.23 0.31 68 G C C 51.70 3.21 12.45 17.11 111.77 -16.96 86.76 -2.34 99.95 0.03 0.01 99.85 0.07 0.06 0.01 0.00 0.00 0.01 0.00