# 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 A C C 55.98 9.06 14.28 24.22 115.76 -147.56 -85.48 142.03 99.86 0.11 0.03 99.79 0.08 0.04 0.01 0.00 0.00 0.06 0.01 1 R C C 152.13 4.79 14.28 20.78 116.12 -142.00 -94.12 128.89 84.29 13.93 1.78 82.42 1.27 1.07 1.53 0.32 0.00 9.09 4.30 2 V C C 48.86 13.13 11.26 25.10 119.03 -160.20 -105.92 133.20 89.32 8.95 1.73 81.66 7.04 0.87 1.55 0.35 0.00 6.61 1.91 3 T C C 60.03 4.42 20.33 24.82 123.01 -147.36 -92.26 159.56 88.20 9.78 2.02 85.90 2.39 0.49 2.03 0.22 0.00 5.73 3.25 4 V H H 44.01 17.60 12.57 29.81 91.98 -112.03 -58.89 -38.58 4.69 0.08 95.23 1.64 0.93 2.26 94.11 0.98 0.01 0.03 0.02 5 Q H H 114.23 2.97 18.61 22.11 91.82 53.67 -63.22 -40.47 2.88 0.04 97.08 0.58 0.36 1.91 96.01 1.09 0.01 0.02 0.01 6 D H H 70.83 3.28 19.41 22.69 92.32 48.53 -66.47 -38.79 2.48 0.05 97.47 0.62 0.32 1.58 96.00 1.43 0.01 0.03 0.01 7 A H H 7.76 17.76 12.80 31.42 91.92 52.57 -64.16 -42.36 1.66 0.04 98.30 0.59 0.25 0.84 97.80 0.50 0.00 0.02 0.01 8 V H H 41.60 12.36 14.34 27.54 91.94 50.25 -64.17 -41.06 1.19 0.03 98.78 0.34 0.16 0.66 98.45 0.37 0.00 0.01 0.01 9 E H H 147.36 0.93 18.81 17.82 92.33 49.67 -65.53 -38.82 1.54 0.02 98.44 0.26 0.15 1.05 97.98 0.54 0.01 0.01 0.00 10 K H H 124.86 3.69 16.56 21.12 95.66 43.06 -77.01 -37.67 3.21 0.01 96.78 0.16 0.24 2.73 96.41 0.43 0.01 0.00 0.00 11 I H H 46.79 13.67 11.65 25.63 101.63 27.94 -102.16 -18.19 10.55 0.05 89.40 1.10 1.70 7.23 89.59 0.32 0.02 0.02 0.03 12 G C C 53.67 2.15 18.05 20.29 97.96 -128.34 78.66 0.06 99.31 0.13 0.55 42.99 42.98 13.41 0.32 0.17 0.00 0.06 0.08 13 N C C 66.34 5.18 18.04 24.32 135.05 33.64 -142.84 155.02 98.14 0.81 1.04 49.22 47.90 0.84 0.91 0.16 0.00 0.16 0.81 14 R H H 109.35 12.80 14.90 27.80 92.64 -117.83 -62.88 -36.13 3.15 0.00 96.85 0.36 0.59 1.96 96.66 0.42 0.00 0.00 0.00 15 F H H 118.57 5.87 20.01 25.94 91.66 55.20 -64.01 -41.32 1.61 0.00 98.39 0.14 0.12 1.24 98.09 0.41 0.00 0.00 0.00 16 D H H 54.08 7.90 20.92 29.69 91.69 49.40 -65.70 -40.42 0.23 0.00 99.77 0.04 0.02 0.13 99.60 0.21 0.00 0.00 0.00 17 L H H 13.97 19.98 17.20 37.31 91.45 51.49 -63.34 -43.07 0.05 0.00 99.95 0.00 0.00 0.03 99.93 0.03 0.00 0.00 0.00 18 V H H 41.90 13.58 22.03 35.58 91.55 49.73 -64.15 -42.43 0.03 0.00 99.97 0.00 0.00 0.02 99.96 0.01 0.00 0.00 0.00 19 L H H 76.30 5.61 25.67 31.14 91.53 49.51 -63.65 -42.49 0.02 0.00 99.98 0.00 0.00 0.02 99.98 0.01 0.00 0.00 0.00 20 V H H 27.89 12.74 23.15 36.54 91.46 49.39 -64.20 -43.23 0.03 0.00 99.97 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 21 A H H 8.13 20.31 20.53 40.76 91.35 50.51 -63.54 -42.72 0.06 0.00 99.94 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 22 A H H 37.03 9.86 23.49 33.64 91.28 51.02 -63.10 -42.30 0.14 0.00 99.86 0.01 0.00 0.09 99.88 0.01 0.00 0.00 0.00 23 R H H 114.17 4.52 26.06 30.62 91.66 49.46 -64.76 -41.94 0.33 0.00 99.67 0.02 0.01 0.22 99.74 0.02 0.00 0.00 0.00 24 R H H 52.61 14.34 21.82 36.02 91.94 49.62 -64.89 -41.78 0.34 0.00 99.66 0.03 0.02 0.19 99.72 0.03 0.00 0.00 0.00 25 A H H 14.91 16.69 18.23 35.30 91.41 51.98 -62.65 -42.17 0.30 0.00 99.70 0.05 0.02 0.16 99.72 0.06 0.00 0.00 0.00 26 R H H 123.79 3.83 23.50 26.94 91.56 50.43 -64.04 -41.21 0.51 0.00 99.48 0.06 0.03 0.34 99.39 0.19 0.00 0.00 0.00 27 Q H H 77.27 5.68 19.81 26.10 92.02 50.41 -65.05 -40.19 1.20 0.01 98.80 0.14 0.09 0.87 98.42 0.48 0.00 0.00 0.00 28 M H H 41.12 14.77 13.64 28.80 92.44 51.21 -66.07 -38.38 3.35 0.02 96.64 0.45 0.28 2.45 95.86 0.94 0.01 0.01 0.00 29 Q H H 106.36 6.30 15.76 23.17 92.77 53.49 -69.67 -27.72 12.10 0.06 87.84 1.12 0.99 9.69 87.05 1.08 0.03 0.03 0.03 30 V C H 106.98 2.05 14.28 16.53 98.45 53.74 -85.82 -7.12 51.99 0.27 47.75 3.62 6.30 40.32 47.77 1.66 0.05 0.09 0.19 31 G C T 53.55 3.18 13.00 17.40 104.84 -76.55 88.22 7.07 82.61 0.31 17.07 13.98 11.75 56.12 15.84 1.97 0.00 0.12 0.23 32 G C C 44.59 5.73 11.06 18.37 113.82 159.54 27.23 77.56 94.57 0.60 4.83 52.36 21.51 20.82 1.67 2.96 0.00 0.26 0.42 33 K C C 145.65 3.36 13.11 17.90 105.67 -83.37 -87.54 16.50 95.39 1.03 3.57 45.19 40.01 10.28 1.09 2.25 0.00 0.40 0.77 34 D C C 93.34 5.00 13.93 20.27 109.47 32.60 -95.61 104.09 97.20 0.90 1.90 66.33 26.49 4.19 0.57 1.40 0.00 0.39 0.63 35 P C C 67.48 10.71 11.33 22.97 106.30 -151.98 -69.03 126.82 93.58 0.58 5.85 50.65 14.50 27.25 0.94 6.06 0.00 0.30 0.31 36 L C C 102.89 5.79 15.64 22.35 100.12 64.85 -82.88 -11.06 93.15 1.58 5.26 39.04 25.77 27.82 0.87 4.90 0.00 0.72 0.87 37 V C S 46.39 12.62 9.69 22.99 117.00 81.56 -102.84 127.30 96.85 1.64 1.51 39.71 55.70 1.61 0.80 0.56 0.00 0.55 1.07 38 P C C 81.01 4.19 13.82 19.34 110.84 -114.64 -67.32 147.02 93.29 0.78 5.93 81.97 6.29 5.10 1.68 4.09 0.00 0.41 0.46 39 E C C 133.42 4.56 10.93 17.21 103.84 -116.95 -74.68 7.51 73.37 0.96 25.68 36.91 15.46 20.04 4.38 22.16 0.00 0.45 0.62 40 E C C 140.19 2.44 12.17 15.83 102.55 70.37 -83.85 5.60 71.79 0.93 27.27 32.22 14.58 24.15 4.24 23.78 0.00 0.44 0.59 41 N C C 90.36 6.97 10.85 19.07 106.05 91.35 -93.60 74.57 77.42 0.75 21.83 40.74 16.58 18.87 3.72 19.20 0.00 0.33 0.56 42 D C C 88.44 6.88 12.89 20.99 104.78 143.34 -88.25 29.50 89.18 0.51 10.31 49.22 25.71 14.10 3.91 6.40 0.00 0.18 0.49 43 K C C 104.75 5.51 17.73 24.02 113.97 108.29 -84.44 138.04 89.38 0.80 9.82 60.49 26.04 2.16 9.57 0.90 0.00 0.19 0.65 44 T H H 46.81 15.26 15.92 31.01 93.40 -124.49 -61.34 -37.33 3.05 0.01 96.94 0.88 0.61 1.39 96.82 0.30 0.00 0.00 0.00 45 T H H 42.02 14.65 19.17 33.44 92.05 53.69 -64.13 -40.69 1.12 0.00 98.88 0.23 0.11 0.63 98.80 0.22 0.00 0.00 0.00 46 V H H 48.75 7.93 22.54 31.15 91.82 49.11 -64.49 -42.40 0.29 0.00 99.71 0.07 0.02 0.15 99.61 0.15 0.00 0.00 0.00 47 I H H 30.49 11.63 22.07 34.77 91.75 49.57 -63.54 -43.30 0.06 0.00 99.94 0.01 0.00 0.03 99.92 0.03 0.00 0.00 0.00 48 A H H 6.55 19.82 19.55 39.79 91.39 50.78 -62.43 -43.66 0.04 0.00 99.96 0.00 0.00 0.02 99.95 0.02 0.00 0.00 0.00 49 L H H 41.01 13.12 22.58 35.79 91.49 49.99 -63.38 -41.79 0.03 0.00 99.97 0.00 0.00 0.02 99.96 0.01 0.00 0.00 0.00 50 R H H 100.17 5.69 24.34 30.28 91.70 49.95 -64.35 -41.97 0.05 0.00 99.95 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 51 E H H 27.99 12.84 18.57 32.69 91.90 49.54 -64.02 -42.31 0.15 0.00 99.85 0.01 0.00 0.09 99.86 0.03 0.00 0.00 0.00 52 I H H 29.30 16.89 15.54 32.61 92.05 49.13 -64.69 -42.60 0.38 0.00 99.62 0.02 0.01 0.29 99.55 0.12 0.00 0.00 0.00 53 E H H 113.53 5.65 17.42 24.03 91.18 51.08 -64.64 -34.33 2.96 0.00 97.04 0.05 0.06 2.90 96.80 0.18 0.00 0.00 0.00 54 E C T 118.48 2.94 16.51 19.80 92.35 51.42 -84.05 -4.97 76.34 0.01 23.65 0.17 0.62 74.83 24.03 0.34 0.00 0.00 0.01 55 G C T 46.43 6.03 14.36 22.00 94.34 -114.99 76.45 16.36 99.55 0.00 0.45 0.65 1.18 97.84 0.28 0.04 0.00 0.00 0.00 56 L C S 76.90 7.64 16.39 25.37 95.58 128.10 -81.06 -16.46 98.77 0.58 0.65 45.92 50.77 2.16 0.36 0.28 0.00 0.23 0.27 57 I C C 32.36 19.46 11.04 29.68 121.05 62.23 -113.13 133.42 83.61 14.74 1.65 41.30 39.94 3.56 0.91 0.74 0.01 6.31 7.22 58 N C C 79.01 5.91 18.60 25.55 130.63 -175.98 -130.05 156.55 86.85 11.66 1.49 77.77 6.65 2.04 0.69 0.83 0.00 9.59 2.42 59 N C C 104.63 8.11 13.77 22.93 98.27 -131.29 -86.05 1.05 84.03 7.17 8.80 39.97 31.84 13.03 3.70 4.73 0.01 5.21 1.52 60 Q C C 119.06 2.98 15.73 20.00 116.79 98.51 -93.34 135.87 80.77 8.58 10.65 43.74 24.81 12.97 4.91 5.40 0.01 6.54 1.62 61 I C C 90.83 9.13 12.01 22.31 114.85 -135.34 -92.45 129.29 78.94 9.02 12.04 64.45 8.84 5.43 7.99 4.26 0.01 6.39 2.64 62 L C C 61.36 11.66 10.26 22.70 116.76 -141.21 -93.34 139.87 86.38 3.57 10.05 73.28 9.88 2.69 9.08 1.76 0.00 2.20 1.11 63 D C C 77.08 3.76 15.23 19.79 114.59 -128.38 -85.79 145.12 88.44 1.54 10.02 82.81 3.39 1.91 9.60 0.98 0.00 0.78 0.54 64 V H H 84.12 5.37 11.62 18.84 93.20 -128.65 -61.94 -36.91 7.58 0.10 92.32 3.80 1.45 2.75 89.84 2.07 0.00 0.05 0.03 65 R H H 150.63 1.47 14.07 15.41 92.13 53.40 -64.77 -40.33 4.79 0.08 95.14 1.74 0.73 2.47 92.47 2.52 0.01 0.05 0.02 66 E H H 90.77 3.31 13.10 17.69 92.13 49.64 -66.12 -39.97 3.99 0.09 95.93 1.77 0.57 1.84 92.78 2.96 0.00 0.06 0.02 67 R H H 98.82 5.20 11.77 18.79 92.23 51.18 -64.76 -40.49 3.66 0.07 96.27 1.80 0.55 1.51 94.29 1.80 0.00 0.04 0.02 68 Q H H 96.20 2.10 13.09 15.77 92.10 51.09 -65.05 -39.78 5.21 0.09 94.70 2.43 0.69 2.28 92.71 1.81 0.00 0.05 0.02 69 E H H 108.99 1.66 12.56 14.43 92.20 51.34 -65.49 -39.35 7.08 0.09 92.83 2.96 0.94 3.32 90.26 2.42 0.01 0.05 0.03 70 Q H H 104.65 2.92 10.51 14.85 93.03 52.46 -67.38 -36.26 11.65 0.12 88.24 4.05 1.59 6.10 84.93 3.21 0.01 0.06 0.05 71 Q H H 124.84 2.04 9.63 12.83 94.38 53.05 -71.45 -28.79 26.22 0.23 73.55 7.75 2.90 15.64 70.75 2.72 0.02 0.10 0.13 72 E C H 145.14 1.25 9.21 11.16 97.43 56.60 -78.57 -11.41 54.76 0.25 44.98 28.49 1.44 22.65 45.69 1.48 0.00 0.10 0.16 73 Q C C 127.35 2.63 10.14 14.29 103.70 80.06 -79.66 27.57 99.91 0.02 0.07 99.65 0.12 0.17 0.05 0.00 0.00 0.01 0.00