# 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 E C C 110.27 4.47 16.86 21.75 105.26 -134.97 -83.54 90.05 99.51 0.17 0.32 99.40 0.14 0.17 0.11 0.05 0.00 0.06 0.06 1 A H G 36.84 14.29 9.27 23.11 94.58 132.97 -68.98 -23.33 35.35 0.52 64.13 27.34 1.93 6.45 5.05 58.80 0.00 0.32 0.11 2 R H G 156.48 3.72 11.64 17.19 93.26 68.28 -67.60 -22.32 32.60 0.27 67.13 4.33 4.02 22.22 3.24 65.94 0.00 0.16 0.09 3 K H G 164.49 0.89 14.46 14.28 95.92 55.36 -85.81 -4.10 32.11 0.26 67.63 4.46 4.41 20.92 2.24 67.74 0.00 0.14 0.08 4 L C S 48.56 12.32 7.11 19.71 118.99 102.73 -83.24 145.78 98.19 0.41 1.41 37.80 59.77 0.73 0.73 0.37 0.00 0.08 0.51 5 S C C 57.73 2.01 16.45 17.90 119.29 -114.28 -73.43 160.60 99.62 0.10 0.28 98.20 1.34 0.12 0.21 0.02 0.00 0.02 0.08 6 P H H 82.55 7.27 11.59 20.41 92.09 -105.41 -58.52 -38.07 2.73 0.00 97.27 0.45 0.41 1.60 96.89 0.64 0.00 0.00 0.00 7 V H H 99.73 1.38 15.88 16.33 92.20 51.92 -64.94 -40.85 1.65 0.00 98.34 0.18 0.14 1.17 97.82 0.69 0.00 0.00 0.00 8 E H H 93.03 3.21 16.41 20.17 91.83 49.62 -65.17 -40.40 0.72 0.00 99.27 0.14 0.06 0.44 98.68 0.69 0.00 0.00 0.00 9 L H H 27.02 14.49 12.17 27.52 91.83 50.65 -64.07 -42.06 0.21 0.00 99.79 0.04 0.01 0.10 99.74 0.11 0.00 0.00 0.00 10 E H H 94.68 5.47 17.65 24.12 91.26 50.99 -63.48 -40.97 0.20 0.00 99.80 0.02 0.01 0.10 99.83 0.03 0.00 0.00 0.00 11 K H H 119.36 1.54 20.50 20.03 91.98 49.69 -64.63 -41.67 0.17 0.00 99.83 0.02 0.01 0.09 99.85 0.03 0.00 0.00 0.00 12 L H H 55.70 7.47 17.88 26.79 91.89 49.63 -64.97 -41.25 0.15 0.00 99.85 0.02 0.01 0.08 99.87 0.03 0.00 0.00 0.00 13 V H H 27.98 13.99 15.48 30.36 91.84 50.35 -63.99 -42.08 0.14 0.00 99.86 0.01 0.01 0.08 99.88 0.02 0.00 0.00 0.00 14 R H H 127.31 2.67 20.58 22.74 91.47 50.30 -63.84 -41.65 0.17 0.00 99.83 0.02 0.01 0.10 99.85 0.02 0.00 0.00 0.00 15 E H H 99.14 2.34 20.39 21.72 91.61 49.65 -64.44 -41.42 0.33 0.00 99.67 0.03 0.01 0.20 99.72 0.03 0.00 0.00 0.00 16 K H H 51.42 11.97 16.15 29.09 91.78 50.43 -64.70 -40.80 0.57 0.00 99.42 0.07 0.03 0.35 99.51 0.04 0.00 0.00 0.00 17 K H H 93.23 8.21 18.01 26.99 91.46 51.83 -63.14 -41.04 0.38 0.00 99.62 0.05 0.02 0.20 99.70 0.03 0.00 0.00 0.00 18 R H H 140.29 1.49 21.23 20.63 91.81 50.35 -64.31 -41.65 0.19 0.00 99.81 0.02 0.01 0.11 99.84 0.03 0.00 0.00 0.00 19 E H H 82.16 5.42 19.05 25.29 91.63 49.92 -64.66 -41.24 0.19 0.00 99.81 0.02 0.01 0.12 99.82 0.04 0.00 0.00 0.00 20 L H H 36.01 13.28 15.25 29.46 91.80 50.83 -64.15 -41.75 0.16 0.00 99.84 0.01 0.01 0.11 99.83 0.04 0.00 0.00 0.00 21 M H H 92.72 3.05 19.94 22.77 91.54 50.39 -63.57 -41.51 0.16 0.00 99.84 0.01 0.00 0.11 99.83 0.04 0.00 0.00 0.00 22 E H H 104.47 2.17 20.41 21.45 91.75 49.82 -64.67 -40.97 0.39 0.00 99.61 0.02 0.01 0.28 99.60 0.07 0.00 0.00 0.00 23 L H H 36.09 11.66 14.50 27.58 91.82 51.06 -64.55 -41.19 0.38 0.00 99.62 0.03 0.02 0.24 99.51 0.20 0.00 0.00 0.00 24 R H H 115.76 6.33 17.08 24.48 91.64 51.78 -63.44 -41.38 0.50 0.00 99.49 0.05 0.03 0.33 99.28 0.31 0.00 0.00 0.00 25 F H H 125.28 1.38 18.51 18.02 91.98 49.47 -64.76 -41.12 1.12 0.00 98.88 0.12 0.07 0.80 98.60 0.40 0.00 0.00 0.00 26 Q H H 74.27 4.42 14.96 20.79 92.56 49.48 -65.59 -40.24 2.42 0.01 97.57 0.40 0.25 1.62 97.04 0.68 0.01 0.00 0.01 27 A H H 35.61 10.28 11.03 22.58 92.17 52.47 -64.31 -40.24 4.25 0.02 95.73 0.58 0.36 3.16 93.76 2.13 0.01 0.01 0.01 28 S H H 84.80 1.61 13.53 15.60 91.64 53.41 -66.49 -29.27 12.49 0.03 87.48 0.58 0.64 11.27 85.40 2.06 0.02 0.01 0.02 29 I C T 124.20 1.32 12.63 13.74 94.10 50.08 -87.62 -2.15 67.72 0.07 32.21 0.85 2.94 63.34 30.45 2.31 0.01 0.02 0.07 30 G C T 57.26 2.29 11.67 15.54 95.66 -109.96 78.89 11.55 98.83 0.03 1.15 3.21 6.86 88.97 0.64 0.29 0.00 0.01 0.02 31 Q C C 122.73 2.29 13.01 16.29 97.46 125.30 -83.80 -14.23 98.69 0.24 1.07 61.20 34.13 3.30 0.36 0.72 0.00 0.08 0.20 32 L C C 51.03 13.74 7.55 20.87 115.25 55.42 -111.34 119.39 97.60 0.58 1.81 74.95 18.15 4.30 0.55 1.26 0.00 0.18 0.61 33 S C C 88.71 1.74 15.09 17.21 100.04 -167.30 -87.94 -22.31 98.90 0.15 0.95 61.31 34.68 2.97 0.37 0.49 0.00 0.05 0.14 34 Q C C 97.02 4.37 12.98 18.87 109.37 59.38 -108.72 98.09 98.07 0.27 1.65 75.55 20.54 1.93 1.14 0.45 0.00 0.07 0.31 35 N H H 93.76 6.45 11.22 19.65 94.24 -171.20 -65.56 -30.88 21.54 0.09 78.37 8.74 3.99 8.98 73.98 4.20 0.01 0.03 0.06 36 H H H 136.98 1.28 15.93 16.35 92.20 58.32 -65.28 -37.60 8.99 0.03 90.99 1.96 1.16 5.42 88.09 3.34 0.01 0.01 0.01 37 K H H 97.45 4.95 16.25 22.27 92.35 51.48 -66.13 -39.95 3.27 0.02 96.71 1.22 0.41 1.53 94.05 2.78 0.00 0.01 0.00 38 I H H 29.81 15.02 12.71 28.31 92.03 51.30 -64.03 -42.40 0.88 0.00 99.12 0.29 0.09 0.40 98.56 0.65 0.00 0.00 0.00 39 R H H 125.46 3.08 19.86 22.89 91.71 50.90 -63.97 -41.44 0.49 0.00 99.51 0.13 0.04 0.24 99.36 0.23 0.00 0.00 0.00 40 D H H 77.76 2.37 20.74 22.08 91.81 49.92 -64.64 -41.44 0.52 0.00 99.48 0.09 0.03 0.30 99.42 0.16 0.00 0.00 0.00 41 L H H 28.82 13.29 15.99 30.48 91.89 49.91 -64.26 -41.95 0.43 0.00 99.57 0.07 0.03 0.25 99.56 0.11 0.00 0.00 0.00 42 K H H 87.39 10.50 18.08 28.89 91.68 51.91 -63.12 -41.45 0.44 0.00 99.56 0.06 0.02 0.27 99.57 0.08 0.00 0.00 0.00 43 R H H 139.57 1.80 21.14 21.47 92.06 49.67 -64.73 -41.06 0.34 0.00 99.66 0.04 0.02 0.19 99.70 0.06 0.00 0.00 0.00 44 Q H H 79.70 5.31 19.26 25.26 92.13 49.24 -65.40 -41.24 0.33 0.00 99.67 0.04 0.02 0.19 99.68 0.07 0.00 0.00 0.00 45 I H H 30.53 13.89 14.33 29.27 92.00 49.85 -64.15 -42.34 0.46 0.00 99.54 0.05 0.03 0.28 99.47 0.17 0.00 0.00 0.00 46 A H H 51.54 4.22 16.27 21.58 91.70 51.10 -63.32 -40.62 1.18 0.00 98.81 0.14 0.07 0.80 98.28 0.71 0.00 0.00 0.00 47 R H H 153.13 1.55 16.37 17.43 92.34 50.99 -65.74 -38.12 6.12 0.00 93.87 0.29 0.24 5.26 92.53 1.68 0.00 0.00 0.00 48 L H H 75.72 8.25 12.21 21.67 93.13 51.41 -69.64 -32.39 13.54 0.02 86.44 1.00 0.85 10.99 85.62 1.52 0.01 0.01 0.01 49 L H H 103.07 5.55 11.64 18.59 96.77 51.81 -81.77 -12.08 43.37 0.27 56.36 18.36 1.54 21.96 56.55 1.29 0.00 0.07 0.22 50 T C C 89.69 3.92 12.92 18.12 104.79 76.29 -84.01 27.17 99.94 0.02 0.04 99.79 0.07 0.10 0.03 0.00 0.00 0.01 0.00