# 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 129.19 3.31 9.77 14.76 116.34 -159.27 -100.17 132.72 99.85 0.13 0.02 99.80 0.08 0.03 0.01 0.00 0.00 0.06 0.01 1 T C C 104.47 2.09 7.99 11.91 114.71 -150.20 -98.05 131.33 92.69 3.72 3.60 89.74 1.19 2.56 1.75 1.12 0.00 2.13 1.52 2 I C C 123.10 2.89 7.01 11.78 114.51 -157.37 -98.10 129.71 89.02 5.26 5.72 67.11 15.81 6.00 2.71 3.01 0.00 3.05 2.32 3 D C C 112.00 2.01 8.76 12.23 111.11 -142.08 -92.90 117.72 90.62 3.00 6.38 74.95 9.26 6.46 2.70 3.52 0.00 1.88 1.22 4 R C C 163.17 2.99 7.99 12.83 106.07 -168.21 -91.43 38.32 89.47 2.04 8.49 54.35 17.47 18.06 4.22 3.86 0.00 1.10 0.94 5 T C C 106.67 1.52 9.65 12.12 106.28 103.21 -90.44 22.43 87.46 2.44 10.10 49.21 21.61 17.10 6.05 3.61 0.01 1.18 1.23 6 Y C C 127.87 4.32 7.91 14.17 114.35 81.72 -96.68 125.58 85.02 2.33 12.65 51.12 30.30 3.19 12.13 1.28 0.00 0.83 1.15 7 P C C 81.16 2.94 10.50 14.93 104.44 -117.38 -68.32 128.90 66.79 1.71 31.50 54.66 4.70 5.13 32.59 1.52 0.00 0.85 0.55 8 I H H 112.49 2.20 10.56 13.80 95.55 -120.97 -65.64 -37.86 15.45 0.63 83.92 9.96 2.39 3.67 82.06 1.40 0.01 0.34 0.18 9 F H H 124.32 2.32 11.73 14.86 93.52 53.35 -67.88 -36.63 7.42 0.67 91.91 4.52 1.03 2.24 90.16 1.42 0.01 0.50 0.12 10 T H H 70.90 3.09 12.14 16.47 92.78 52.31 -66.83 -39.40 3.97 0.61 95.42 2.40 0.54 1.28 93.97 1.18 0.00 0.56 0.07 11 V H H 82.84 2.40 13.16 16.26 92.66 50.37 -66.16 -41.06 1.93 0.23 97.84 0.89 0.26 0.84 97.22 0.55 0.00 0.21 0.02 12 R H H 133.95 2.04 14.02 16.30 92.48 50.53 -65.61 -40.65 1.57 0.15 98.29 0.58 0.19 0.82 97.93 0.32 0.01 0.13 0.02 13 W H H 131.97 3.07 13.43 17.53 92.38 49.94 -65.20 -41.81 0.92 0.05 99.03 0.28 0.10 0.54 98.80 0.25 0.00 0.03 0.01 14 L H H 91.44 2.67 13.99 17.42 92.00 50.17 -64.82 -41.18 0.62 0.02 99.36 0.16 0.05 0.37 99.18 0.22 0.00 0.01 0.00 15 A H H 62.11 1.93 14.53 16.45 92.09 50.27 -64.54 -40.96 0.92 0.02 99.06 0.18 0.07 0.61 98.83 0.29 0.00 0.01 0.00 16 I H H 95.44 2.15 14.28 16.58 92.78 48.45 -66.16 -40.92 1.59 0.02 98.39 0.25 0.13 1.13 98.04 0.42 0.00 0.01 0.00 17 H H H 105.81 3.08 12.96 17.14 92.84 50.55 -66.92 -37.82 3.72 0.03 96.25 0.57 0.31 2.69 95.37 1.03 0.01 0.01 0.01 18 G H H 41.32 2.99 12.16 16.41 92.75 53.87 -66.36 -35.77 12.22 0.04 87.74 1.09 0.79 10.00 84.82 3.23 0.02 0.02 0.02 19 L H H 123.07 1.35 12.46 13.74 94.37 51.95 -74.47 -26.40 23.83 0.10 76.07 1.69 1.76 20.14 72.84 3.41 0.05 0.04 0.06 20 A H H 77.77 2.00 11.66 14.25 97.26 53.13 -84.29 -17.17 32.97 0.36 66.67 4.72 5.10 23.92 62.96 2.82 0.10 0.14 0.23 21 V C H 88.11 3.83 9.36 14.97 108.70 74.70 -87.85 107.44 58.42 1.12 40.46 29.52 22.46 6.93 37.08 3.03 0.03 0.39 0.55 22 P C C 92.23 2.63 10.84 14.80 108.96 -118.46 -69.95 124.23 54.86 1.46 43.68 43.42 4.29 6.43 39.62 4.93 0.00 0.93 0.38 23 T H H 92.12 3.26 9.99 14.78 102.91 -127.43 -81.34 -3.29 36.69 7.22 56.09 25.63 5.31 6.90 47.38 7.65 0.05 5.85 1.22 24 V H H 102.58 2.41 10.79 14.33 101.41 74.76 -78.57 -29.99 25.21 10.42 64.37 17.09 4.38 5.28 55.70 6.87 0.07 9.42 1.18 25 F H H 138.82 2.40 11.03 14.49 101.80 57.96 -79.59 -15.91 27.55 11.44 61.01 18.36 4.35 5.78 53.12 6.53 0.07 10.66 1.14 26 F H H 126.11 3.31 10.69 15.35 99.41 52.91 -76.17 -31.02 31.82 7.13 61.04 21.85 4.73 6.47 54.70 5.10 0.06 6.08 1.02 27 S H H 75.03 2.20 11.76 14.93 94.51 58.67 -66.77 -37.13 19.73 1.47 78.80 10.50 3.53 7.20 73.64 3.69 0.07 1.03 0.35 28 G H H 46.05 1.88 12.82 15.07 94.58 50.90 -65.33 -36.10 17.13 0.63 82.24 6.46 3.06 8.69 77.34 3.79 0.07 0.40 0.19 29 S H H 58.12 3.13 12.22 16.60 94.21 53.47 -67.70 -38.15 12.16 0.59 87.25 6.21 1.95 4.92 82.75 3.57 0.03 0.43 0.14 30 I H H 89.79 3.13 11.99 16.43 93.27 51.29 -65.87 -41.01 6.03 0.37 93.60 2.97 1.05 2.54 89.83 3.23 0.02 0.29 0.06 31 S H H 68.45 1.65 13.25 14.92 93.20 51.63 -66.00 -39.42 6.78 0.33 92.89 3.03 0.98 3.10 88.88 3.66 0.02 0.27 0.06 32 A H H 68.64 1.60 11.82 13.71 93.25 51.92 -66.86 -36.54 10.07 0.32 89.61 3.40 1.39 5.52 84.71 4.63 0.03 0.23 0.09 33 M H H 111.93 2.49 9.97 13.79 95.90 55.15 -73.22 -28.74 15.36 0.60 84.04 6.39 2.46 7.38 77.66 5.48 0.05 0.41 0.18 34 Q H H 125.13 1.84 9.25 12.29 98.12 69.75 -73.27 -25.35 26.04 1.25 72.71 10.04 3.92 13.14 65.54 6.04 0.08 0.85 0.39 35 F H H 158.60 1.23 8.25 10.30 100.22 64.51 -80.94 -7.74 34.95 2.32 62.72 13.88 5.68 16.98 55.41 5.68 0.13 1.55 0.70 36 I H H 135.20 1.26 6.87 9.30 104.19 72.07 -85.52 17.99 44.27 5.11 50.62 23.89 8.76 13.63 45.37 3.64 0.12 3.01 1.58 37 Q C C 141.88 1.33 6.89 9.59 109.40 89.01 -90.29 108.70 71.16 3.21 25.63 53.66 1.94 13.78 25.69 1.86 0.00 1.91 1.16 38 R C C 176.01 1.98 9.24 12.86 110.00 -146.64 -88.28 120.87 99.84 0.09 0.07 99.70 0.09 0.09 0.05 0.00 0.00 0.05 0.01