NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 D 4.5826 8.3649 120.1953 54.3162 42.2131 175.0786 4 L 4.2732 8.2358 122.0942 52.8481 42.6752 173.9315 5 V 3.3975 8.2998 122.6723 64.2369 32.6042 171.4731 6 D 4.2465 9.4416 117.7168 52.5665 42.9345 175.2981 7 T 3.8830 8.2261 125.0788 66.2671 68.3530 176.6870 8 T 3.7247 7.4123 116.7099 66.8386 68.3801 176.0396 9 E 4.0071 9.0140 120.7197 59.7994 29.4883 179.2780 10 M 4.3737 7.9840 117.5039 57.5763 31.4433 178.3690 11 Y 4.0737 8.1177 117.7623 60.7929 38.3699 177.4911 12 L 4.0739 8.2090 119.9141 57.9538 41.8337 179.2829 13 R 3.9205 8.7289 118.7714 60.0868 29.8407 178.6230 14 T 3.8996 7.7901 115.0385 66.8534 68.5657 176.7827 15 I 3.6890 8.2879 122.0187 64.2964 36.9965 177.9920 16 Y 3.9698 8.1383 120.5230 60.7899 38.7873 177.3307 17 E 4.0101 8.4817 119.4891 59.5855 29.4770 179.3938 18 L 3.9308 8.1207 118.8258 57.9518 41.6959 179.3719 19 E 3.8828 7.7864 117.7025 59.6436 29.1980 179.2307 20 E 3.8849 7.7461 117.0119 59.3368 29.5707 178.4967 21 E 4.3183 7.8111 115.5220 55.8550 29.7172 177.5761 22 G 3.8279 8.0742 107.4569 45.7590 0.0000 174.4284 23 V 3.8527 7.2272 119.0549 62.5238 32.2783 175.1629 24 T 4.5045 8.0885 120.5083 61.3070 69.6325 172.8839 25 P 4.3711 0.0000 0.0000 63.1268 32.2631 175.1570 26 L 4.9652 8.2664 124.2978 52.2431 45.1024 177.9534 27 R 3.4857 8.9612 120.8862 59.8454 29.5602 179.0678 28 A 4.0498 8.0088 119.5327 54.9180 18.3724 179.4109 29 R 4.0824 8.8177 117.5517 58.5900 30.1644 179.1581 30 I 3.6039 7.4266 119.3831 64.0885 37.1734 177.6560 31 A 3.9018 7.8385 121.6314 55.7726 18.2097 179.1024 32 E 3.9350 7.8761 115.6682 59.5901 29.3011 179.6675 33 R 3.9098 8.0862 118.4275 59.3001 30.3734 178.1828 34 L 4.2217 8.5335 115.0905 54.3128 42.4182 176.1479 35 E 3.8301 7.7141 117.3186 57.9790 27.2218 173.8752 36 Q 4.7679 8.0639 115.8738 53.2599 33.0848 177.0972 37 S 4.4821 8.3959 114.9290 58.0944 65.1520 175.6915 38 G 3.5841 8.5237 109.8699 47.7145 0.0000 174.2365 39 P 4.3084 0.0000 0.0000 65.4368 31.2360 178.5634 40 T 3.8566 8.0388 114.5196 66.8191 68.3603 176.3612 41 V 3.9272 7.6901 120.8451 65.7962 31.3972 178.3792 42 S 4.1724 8.1971 114.5510 61.5605 62.7691 176.6814 43 Q 3.9926 8.2404 120.8906 59.2847 28.3978 179.0851 44 T 3.8099 8.1876 116.8809 66.5474 68.4473 176.9294 45 V 3.5953 8.1934 120.2537 66.0344 31.4980 177.5359 46 A 4.0073 8.1922 120.5305 55.5012 18.1914 179.6675 47 R 3.8301 7.7746 116.4502 59.9271 30.1136 178.6645 48 M 4.0964 8.7036 119.2491 58.1846 31.6874 178.0855 49 E 4.4486 8.6531 120.1783 57.7473 29.8969 178.1388 50 R 4.1383 7.5041 117.8084 58.8879 30.3473 177.0076 51 D 4.7153 8.0659 115.9259 53.5908 41.1150 176.4771 52 G 3.8777 7.8504 107.0255 46.7577 0.0000 174.7030 53 L 4.5935 8.2838 121.9651 55.5284 43.4074 176.8601 54 V 4.8842 7.5017 116.7947 60.5096 35.5539 173.7158 55 V 4.5317 8.6822 119.8682 61.3050 35.2161 173.8166 56 V 4.3622 8.7550 127.7945 61.4757 32.1116 175.9965 57 A 4.2402 8.7396 132.5716 52.2913 18.9403 176.4926 58 S 4.5329 8.4988 111.0353 58.9249 62.7958 174.1304 59 D 4.8757 7.6475 118.6732 53.6587 39.4888 178.0510 60 R 3.9347 8.3621 116.5671 57.5957 28.9524 176.7826 61 S 4.4458 7.7685 113.9460 58.3814 64.2571 173.5164 62 L 4.7579 8.6188 123.9706 54.2808 42.3209 176.4662 63 Q 4.5102 9.3054 125.0341 54.1877 30.0332 175.6523 64 M 4.7669 8.7570 124.0887 55.8984 32.5637 175.8633 65 T 4.6064 8.2233 109.7988 59.4182 71.7228 173.5778 66 P 4.6761 0.0000 0.0000 66.1830 31.2654 179.1944 67 T 4.0330 7.9246 114.2606 66.3150 68.5304 176.9463 68 G 4.1803 7.9549 108.9999 47.5093 0.0000 175.4389 69 R 3.9966 9.2729 122.2904 59.4819 29.9138 178.5959 70 T 3.8542 7.7468 115.4163 66.6477 68.5680 176.7562 71 L 4.2011 7.6145 120.4108 58.2688 40.3600 178.9583 72 A 3.9401 8.0244 122.1513 55.5038 18.3333 179.7833 73 T 3.2846 7.9007 113.8985 66.5004 68.4802 176.7180 74 A 3.9331 8.4093 123.0346 55.3290 18.2515 179.8784 75 V 3.4615 8.1315 116.8579 66.1903 31.6208 177.6001 76 M 3.8690 7.5316 117.6657 58.7682 32.0993 177.9608 77 R 3.8542 8.3371 118.7454 59.6903 30.2805 178.6943 78 K 4.0867 8.4004 118.2197 59.3417 31.7698 178.9628 79 H 4.1241 8.4588 119.3661 59.1410 29.7558 177.5998 80 R 4.0947 8.0872 119.9342 59.1850 29.8649 178.9657 81 L 3.9360 7.7931 118.0841 57.8451 41.5866 179.2984 82 A 3.9076 7.9821 120.5898 55.3411 18.1269 179.6127 83 E 3.7292 7.7611 116.8480 59.4999 29.2892 179.3124 84 R 3.8935 8.0053 118.7834 59.0578 30.1974 177.9568 85 L 3.9146 8.6138 120.5159 58.4715 42.1056 179.3938 86 L 3.8212 8.0474 118.7540 58.0306 41.3737 179.6580 87 T 3.8582 8.1611 114.9493 67.3362 68.3201 175.6399 88 D 4.4947 9.8391 121.8864 56.1458 40.4040 178.8456 89 I 3.6860 7.5012 117.1246 64.7351 38.5583 178.4159 90 I 3.8938 7.5960 121.0337 61.3101 37.1153 176.3254 91 G 3.7589 7.4347 103.7452 46.4474 0.0000 173.6361 92 L 4.1832 7.6410 120.2327 53.4733 43.2077 175.7109 93 D 4.3312 8.5261 121.9640 54.4705 41.0883 177.3214 94 I 3.8765 8.4701 126.3768 63.9614 38.2221 177.3789 95 N 4.4465 8.8898 117.3815 55.2057 38.7130 175.8336 96 K 4.5091 8.2714 116.4348 55.9665 33.0856 178.1026 97 V 3.6070 7.3939 120.2163 65.9023 31.1419 177.2900 98 H 4.1470 8.0860 118.1311 58.9963 29.7525 176.4290 99 D 4.0970 8.1596 120.2915 57.4960 40.9414 178.6883 100 E 3.9871 7.7545 118.0525 59.2542 29.8008 178.6301 101 A 4.0279 7.5898 120.5228 54.9891 18.0687 178.9765 102 D 4.5635 8.4149 117.9042 56.3453 41.5842 177.8796 103 R 4.5051 8.4492 118.5428 58.2257 30.8608 178.6745 104 W 4.2458 8.5584 118.4726 59.5596 28.6545 177.9465 105 E 4.0020 8.4313 117.7691 59.5449 28.4911 178.1020 106 H 4.9999 7.6992 115.1017 55.2540 29.2047 175.8078 107 V 4.3962 7.8364 112.3312 60.7478 33.4905 175.1452 108 M 4.3023 7.9937 121.0585 54.5331 32.6251 176.9194 109 S 4.5069 8.3819 119.0565 57.5574 65.7707 174.7985 110 D 4.3385 8.5778 122.8139 57.7214 40.5127 178.6191 111 E 3.9975 8.2874 118.4718 59.9838 29.5213 179.8670 112 V 3.7591 8.1807 117.7706 65.4064 31.4810 177.7103 113 E 3.8989 8.5251 119.9396 59.4748 29.3817 178.6819 114 R 3.9489 8.4836 117.4555 59.3794 30.3185 178.9967 115 R 4.1210 7.6696 116.0182 59.0508 30.5714 178.3543 116 L 3.9294 7.9659 120.3073 58.5410 40.5122 179.5979 117 V 3.6641 7.7096 118.5115 64.6403 31.2998 178.3722 118 K 4.1515 8.3161 119.4902 58.1627 32.1295 178.1132 119 V 4.2332 6.9786 107.7672 61.2318 32.4872 176.2617 120 L 4.4189 7.6790 123.5370 54.7552 41.8799 175.9036 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 3 D 8.36 4.58 0.00 2.65 2.66 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 4 L 8.24 4.27 0.00 1.86 1.64 0.97 0.57 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 5 V 8.30 3.40 2.04 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 0.75 0.00 0.00 0.98 0.00 0.00 6 D 9.44 4.25 0.00 2.63 2.34 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 T 8.23 3.88 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 0.74 0.00 0.00 8 T 7.41 3.72 4.32 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 9 E 9.01 4.01 0.00 2.13 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 0.00 2.37 2.38 0.00 10 M 7.98 4.37 0.00 2.11 2.32 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.81 0.00 11 Y 8.12 4.07 0.00 3.20 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 12 L 8.21 4.07 0.00 1.89 1.77 1.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.73 3.92 0.00 1.85 2.00 0.00 3.00 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 14 T 7.79 3.90 4.42 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 1.14 0.00 0.00 15 I 8.29 3.69 2.06 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.07 0.94 0.00 0.00 16 Y 8.14 3.97 0.00 3.02 3.16 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 17 E 8.48 4.01 0.00 2.24 2.04 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 2.47 2.73 0.00 18 L 8.12 3.93 0.00 1.99 1.70 0.90 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 19 E 7.79 3.88 0.00 2.06 1.82 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 2.27 2.44 0.00 20 E 7.75 3.88 0.00 2.00 1.95 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 2.15 1.84 0.00 21 E 7.81 4.32 0.00 1.93 1.95 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 2.31 2.51 0.00 22 G 8.07 3.83 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 23 V 7.23 3.85 2.17 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 0.77 0.00 0.00 0.91 0.00 0.00 24 T 8.09 4.50 4.23 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 25 P 0.00 4.37 0.00 2.10 2.21 0.00 3.61 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.99 0.00 26 L 8.27 4.97 0.00 1.56 1.54 0.91 0.96 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 27 R 8.96 3.49 0.00 1.84 2.02 0.00 3.16 0.00 0.00 3.38 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 28 A 8.01 4.05 1.30 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 29 R 8.82 4.08 0.00 1.71 1.94 0.00 3.27 0.00 0.00 3.14 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.97 0.00 30 I 7.43 3.60 1.71 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.68 0.17 0.00 0.00 31 A 7.84 3.90 1.38 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 32 E 7.88 3.94 0.00 2.18 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 2.31 2.57 0.00 33 R 8.09 3.91 0.00 1.77 1.98 0.00 3.13 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 34 L 8.53 4.22 0.00 1.68 1.75 0.81 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.71 3.83 0.00 2.15 2.00 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 2.25 2.27 0.00 36 Q 8.06 4.77 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.93 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 37 S 8.40 4.48 0.00 4.06 4.01 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 G 8.52 3.58 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 39 P 0.00 4.31 0.00 2.18 2.13 0.00 3.57 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 40 T 8.04 3.86 4.45 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 1.33 0.00 0.00 41 V 7.69 3.93 2.25 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 1.32 0.00 0.00 1.03 0.00 0.00 42 S 8.20 4.17 0.00 4.08 3.92 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 Q 8.24 3.99 0.00 2.41 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 44 T 8.19 3.81 4.18 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 0.67 0.00 0.00 45 V 8.19 3.60 2.19 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 1.06 0.00 0.00 1.17 0.00 0.00 46 A 8.19 4.01 1.43 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 47 R 7.77 3.83 0.00 2.07 1.94 0.00 3.07 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 48 M 8.70 4.10 0.00 2.09 2.33 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 49 E 8.65 4.45 0.00 2.02 2.17 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 2.33 2.35 0.00 50 R 7.50 4.14 0.00 1.94 2.14 0.00 3.30 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 51 D 8.07 4.72 0.00 2.70 2.68 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 52 G 7.85 3.88 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 0.00 0.00 0.00 53 L 8.28 4.59 0.00 1.71 1.74 0.93 0.71 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 54 V 7.50 4.88 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 0.83 0.00 0.00 1.01 0.00 0.00 55 V 8.68 4.53 2.20 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 0.92 0.00 0.00 0.94 0.00 0.00 56 V 8.76 4.36 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 0.80 0.00 0.00 0.95 0.00 0.00 57 A 8.74 4.24 1.44 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 58 S 8.50 4.53 0.00 3.84 3.87 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 59 D 7.65 4.88 0.00 2.82 2.80 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 60 R 8.36 3.93 0.00 1.98 2.10 0.00 3.21 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 61 S 7.77 4.45 0.00 3.91 4.03 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 62 L 8.62 4.76 0.00 1.56 1.69 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 9.31 4.51 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.86 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 64 M 8.76 4.77 0.00 1.95 2.06 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.61 0.00 65 T 8.22 4.61 4.26 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 1.23 0.00 0.00 66 P 0.00 4.68 0.00 2.19 2.17 0.00 3.60 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 67 T 7.92 4.03 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 68 G 7.95 4.18 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 69 R 9.27 4.00 0.00 2.07 2.00 0.00 3.15 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 70 T 7.75 3.85 4.24 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 1.21 0.00 0.00 71 L 7.61 4.20 0.00 2.00 1.92 0.93 0.98 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 72 A 8.02 3.94 1.45 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 73 T 7.90 3.28 4.24 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 1.12 0.00 0.00 74 A 8.41 3.93 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 75 V 8.13 3.46 2.08 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 1.00 0.00 0.00 76 M 7.53 3.87 0.00 1.89 1.70 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.25 0.00 77 R 8.34 3.85 0.00 1.90 2.09 0.00 3.14 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 78 K 8.40 4.09 0.00 1.82 1.86 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.65 7.81 79 H 8.46 4.12 0.00 3.48 3.50 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 R 8.09 4.09 0.00 2.07 1.96 0.00 3.21 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 81 L 7.79 3.94 0.00 1.73 1.73 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 82 A 7.98 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 83 E 7.76 3.73 0.00 2.12 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 2.33 2.08 0.00 84 R 8.01 3.89 0.00 2.00 1.96 0.00 3.13 0.00 0.00 3.08 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 85 L 8.61 3.91 0.00 1.85 1.85 1.13 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 86 L 8.05 3.82 0.00 1.62 1.44 0.25 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.16 3.86 4.43 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 88 D 9.84 4.49 0.00 2.81 2.53 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 89 I 7.50 3.69 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.54 0.91 0.00 0.00 90 I 7.60 3.89 1.98 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.57 0.92 0.00 0.00 91 G 7.43 3.76 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 92 L 7.64 4.18 0.00 1.56 1.48 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 93 D 8.53 4.33 0.00 2.70 2.53 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 94 I 8.47 3.88 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.03 0.89 0.00 0.00 95 N 8.89 4.45 0.00 2.95 2.86 0.00 0.00 6.83 7.50 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 96 K 8.27 4.51 0.00 1.70 1.74 0.00 1.81 0.00 0.00 1.56 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.32 7.81 97 V 7.39 3.61 2.02 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 0.94 0.00 0.00 0.88 0.00 0.00 98 H 8.09 4.15 0.00 3.28 3.26 0.00 5.95 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 D 8.16 4.10 0.00 2.69 2.77 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 0.00 100 E 7.75 3.99 0.00 2.10 1.58 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 1.66 1.47 0.00 101 A 7.59 4.03 1.15 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 0.00 102 D 8.41 4.56 0.00 2.75 2.93 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 0.00 103 R 8.45 4.51 0.00 2.27 2.13 0.00 3.27 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.90 0.00 104 W 8.56 4.25 0.00 3.30 3.28 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 0.00 105 E 8.43 4.00 0.00 2.11 2.23 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 2.44 1.76 0.00 106 H 7.70 5.00 0.00 3.33 3.40 0.00 5.56 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.84 4.40 2.00 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 0.69 0.00 0.00 0.84 0.00 0.00 108 M 7.99 4.30 0.00 2.04 2.21 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.57 0.00 109 S 8.38 4.51 0.00 4.04 3.96 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 0.00 110 D 8.58 4.34 0.00 2.70 2.76 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 0.00 111 E 8.29 4.00 0.00 1.96 2.02 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 2.41 2.34 0.00 112 V 8.18 3.76 2.18 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 1.02 0.00 0.00 0.92 0.00 0.00 113 E 8.53 3.90 0.00 2.16 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 0.00 2.31 2.35 0.00 114 R 8.48 3.95 0.00 1.90 2.01 0.00 3.21 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.81 0.00 115 R 7.67 4.12 0.00 1.88 1.97 0.00 3.33 0.00 0.00 3.10 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 116 L 7.97 3.93 0.00 2.07 1.72 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 117 V 7.71 3.66 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 0.89 0.00 0.00 0.94 0.00 0.00 118 K 8.32 4.15 0.00 1.98 1.89 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.48 7.81 119 V 6.98 4.23 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 0.88 0.00 0.00 0.99 0.00 0.00 120 L 7.68 4.42 0.00 1.75 1.56 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00