NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.4050 8.1885 115.4118 57.7065 64.8658 175.2249 5 A 3.9055 8.0887 125.1824 52.8856 18.5634 177.2631 6 S 4.7562 8.1052 109.0988 57.8943 64.8539 174.3526 7 G 3.7497 7.9192 109.2817 48.2004 0.0000 174.0565 8 P 4.2944 0.0000 0.0000 65.5030 31.2825 178.2216 9 E 4.1245 8.1678 117.1708 59.0781 29.6637 177.8443 10 H 4.1015 8.4477 118.5308 59.3760 29.9602 177.0512 11 E 4.0209 8.7661 120.7088 59.3951 29.3012 179.1779 12 F 4.0751 8.2193 120.3265 61.1819 39.4116 177.3510 13 V 3.4699 8.2183 118.2062 66.0029 31.4960 177.8250 14 S 3.9990 8.0420 112.8765 61.2995 62.1768 176.1337 15 K 3.8768 8.0360 122.2090 59.3823 31.9762 178.5335 16 F 3.7227 7.8914 120.9755 61.0631 38.9946 176.7811 17 L 3.9945 7.9854 119.0731 58.3925 42.0281 178.8547 18 T 3.9614 7.7121 115.2198 66.7260 68.4777 176.6691 19 L 3.8693 7.8834 120.6410 57.6758 41.3986 179.2946 20 A 4.0079 7.7033 119.2901 53.7216 18.3125 178.0162 21 T 4.5401 7.1097 105.3270 61.0664 69.6252 174.9027 22 L 4.0358 7.6054 123.6991 57.6516 41.6831 177.3312 23 T 4.6013 7.3190 105.5207 58.8697 71.4603 173.3730 24 E 3.9490 8.5726 121.5812 55.8821 29.6686 175.6924 25 P 4.2701 0.0000 0.0000 62.4833 32.1390 176.0197 26 K 3.8302 8.7738 123.2679 59.1753 32.0087 176.6500 27 L 4.3046 7.4977 117.7713 52.1003 42.7842 174.7725 28 P 4.5706 0.0000 0.0000 61.8928 32.2824 177.2139 29 K 3.8587 8.7191 118.7802 59.7224 31.9071 178.2615 30 S 4.4335 7.9663 110.0676 58.5886 63.5339 173.5711 31 Y 4.1674 7.9604 123.9434 58.1807 38.9232 175.2981 32 T 4.0896 7.3589 122.6100 61.0609 71.6236 173.6307 33 K 3.7541 8.0740 128.3797 55.3591 32.9284 174.6796 34 P 4.2339 0.0000 0.0000 62.5722 31.7876 177.2193 35 L 4.2768 8.5346 124.4997 57.5865 42.3167 178.9477 36 K 3.9854 8.0918 116.9624 58.8665 32.0192 177.0569 37 D 4.7023 8.1626 116.6042 53.7860 41.4255 176.5514 38 V 3.7568 7.3302 121.0346 62.9788 31.7103 175.2532 39 T 4.3868 8.4940 121.4876 62.7473 68.7819 173.0534 40 N 4.9677 7.7343 115.9129 52.1149 40.0924 173.6070 41 L 4.6049 8.3970 115.4279 54.1404 42.8970 178.8503 42 G 3.7714 7.9062 106.8211 46.7998 0.0000 174.2136 43 V 4.3744 8.0844 123.2095 59.8875 33.5360 173.8442 44 P 4.3443 0.0000 0.0000 62.8016 31.7795 176.2374 45 L 4.4512 8.1644 122.0982 52.8599 42.8654 175.0330 46 P 4.4555 0.0000 0.0000 62.8472 31.9126 176.3087 47 T 4.1200 8.1080 116.4450 63.3021 67.7691 174.8356 48 L 4.2899 8.2697 125.2028 54.1978 42.5591 178.4768 49 K 4.0466 8.0747 121.2572 59.1779 32.2396 177.3876 50 Y 4.4666 6.4951 115.9644 57.0614 38.5603 175.7148 51 K 4.3273 8.5861 123.5768 56.3392 33.0899 175.4874 52 Y 4.6845 8.4200 121.9704 55.9803 40.4480 175.1438 53 K 4.4241 7.1469 125.1192 56.9693 36.0533 176.1883 54 Q 4.1445 8.2819 117.0812 57.7405 27.8119 173.4341 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 4 S 8.19 4.40 0.00 4.02 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 A 8.09 3.91 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.11 4.76 0.00 4.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 7.92 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 P 0.00 4.29 0.00 2.18 2.16 0.00 3.53 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 9 E 8.17 4.12 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.35 0.00 10 H 8.45 4.10 0.00 3.34 3.47 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.77 4.02 0.00 2.29 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 12 F 8.22 4.08 0.00 3.26 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.22 3.47 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.07 0.00 0.00 14 S 8.04 4.00 0.00 3.92 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.04 3.88 0.00 1.89 1.71 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.39 7.81 16 F 7.89 3.72 0.00 2.43 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.99 3.99 0.00 1.77 1.84 0.95 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.71 3.96 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 19 L 7.88 3.87 0.00 1.37 1.52 0.81 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 20 A 7.70 4.01 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 7.11 4.54 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 22 L 7.61 4.04 0.00 1.74 1.74 0.87 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 23 T 7.32 4.60 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 24 E 8.57 3.95 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 25 P 0.00 4.27 0.00 2.18 1.98 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 26 K 8.77 3.83 0.00 1.65 1.79 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.31 1.43 7.81 27 L 7.50 4.30 0.00 1.56 1.31 0.78 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.57 0.00 2.26 2.20 0.00 3.69 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.04 0.00 29 K 8.72 3.86 0.00 1.79 1.96 0.00 1.75 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.47 1.47 7.81 30 S 7.97 4.43 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 Y 7.96 4.17 0.00 2.96 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 T 7.36 4.09 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 33 K 8.07 3.75 0.00 1.69 1.67 0.00 1.84 0.00 0.00 1.72 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.54 7.81 34 P 0.00 4.23 0.00 2.33 1.94 0.00 3.63 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.03 0.00 35 L 8.53 4.28 0.00 1.69 1.64 0.90 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.09 3.99 0.00 1.77 1.86 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.46 7.81 37 D 8.16 4.70 0.00 2.70 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 7.33 3.76 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.92 0.00 0.00 39 T 8.49 4.39 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 40 N 7.73 4.97 0.00 2.82 2.74 0.00 0.00 5.90 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.40 4.60 0.00 1.63 1.69 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 42 G 7.91 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 8.08 4.37 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.93 0.00 0.00 44 P 0.00 4.34 0.00 2.08 1.97 0.00 3.72 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 45 L 8.16 4.45 0.00 1.63 1.59 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 46 P 0.00 4.46 0.00 2.17 2.05 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 47 T 8.11 4.12 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 48 L 8.27 4.29 0.00 1.81 1.77 1.05 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 49 K 8.07 4.05 0.00 0.85 1.55 0.00 1.59 0.00 0.00 1.58 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.03 1.13 7.81 50 Y 6.50 4.47 0.00 3.11 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 K 8.59 4.33 0.00 1.80 1.79 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.49 1.47 7.81 52 Y 8.42 4.68 0.00 2.92 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 K 7.15 4.42 0.00 1.57 1.56 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.37 7.81 54 Q 8.28 4.14 0.00 2.03 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.65 0.00 0.00 0.00 0.00 0.00 2.01 2.17 0.00