NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2510 8.2493 123.5807 52.0387 19.9872 177.2218 2 D 4.5327 8.3502 122.6056 51.0961 42.1834 175.8200 3 L 3.9300 9.1822 121.3975 58.6068 42.2846 179.7819 4 E 3.9938 8.2230 117.7253 59.4853 29.4020 178.9002 5 D 4.3663 8.8652 119.2648 57.5930 40.8827 178.6358 6 N 4.3392 8.3735 116.9864 56.5754 38.4158 177.4115 7 M 4.1159 8.3526 120.2586 58.2759 32.0190 178.3014 8 E 3.9383 8.3628 119.4850 59.6313 29.8097 178.9654 9 T 3.8694 8.0881 115.7135 66.5923 68.5149 176.4359 10 L 3.9680 8.0835 120.8261 57.8597 41.5901 179.1052 11 N 4.2742 8.4753 117.0884 56.8316 38.9224 176.4767 12 D 4.3845 8.4510 120.5779 57.7255 40.7757 178.7394 13 N 4.4595 8.2647 116.5991 55.6952 38.4962 177.2942 14 L 3.9747 7.9267 122.2432 58.1296 42.2165 179.2173 15 K 3.9795 7.8577 118.5407 59.2959 31.7452 179.3826 16 V 3.5782 7.5458 117.5663 66.1531 31.6014 177.7785 17 I 3.8505 7.8246 119.3055 64.4830 36.7357 178.1155 18 E 3.9801 7.9126 118.3326 59.1607 29.4681 179.0075 19 K 4.2076 7.8160 115.4542 56.8487 33.5840 177.1696 20 A 4.1556 7.0846 123.7963 52.5658 18.7845 176.7701 21 D 4.9941 8.5690 119.1118 52.3785 40.1867 175.7388 22 N 5.0081 7.6828 116.1129 50.7389 41.5017 174.8940 23 A 3.9636 8.5945 123.5327 55.2840 18.5603 179.9103 24 A 3.9480 7.9854 118.8281 55.4715 18.4567 179.5343 25 Q 3.8962 8.4313 117.9853 59.1797 29.1284 178.5448 26 V 3.5719 7.5394 119.2442 65.8320 31.5692 178.0826 27 K 3.9204 8.4858 118.6061 59.5592 31.9336 178.7452 28 D 4.2857 8.2338 117.9223 57.2556 41.1735 178.1078 29 A 4.2516 7.8708 122.5046 54.7827 18.3535 179.6158 30 L 3.9802 8.0516 117.4785 58.2408 41.7616 179.8894 31 T 3.8606 8.1119 115.7528 66.6418 68.3761 176.8650 32 K 4.0511 8.1291 120.4275 59.5370 31.9498 179.4059 33 M 4.0501 8.1375 118.8729 58.2108 31.8399 178.4862 34 A 3.9563 8.2671 120.9009 55.2885 18.6713 179.5869 35 A 3.8988 7.9086 118.4748 55.1569 18.4125 179.7363 36 A 4.0288 8.1748 119.1169 55.2718 18.4587 179.7760 37 A 3.8010 8.3250 119.4374 55.1398 18.2191 179.6579 38 A 3.6476 7.7827 118.4578 55.3082 18.4808 179.0888 39 D 4.3613 7.8029 115.2566 57.1970 41.6244 177.9570 40 A 3.9121 7.6632 121.0762 53.8885 18.1271 179.0924 41 W 3.6749 7.2569 127.3466 60.2104 30.6670 176.8501 42 S 3.6132 7.6114 109.1437 58.0636 63.0926 173.9503 43 A 4.1738 7.4365 124.4316 52.1955 18.9008 177.0178 44 T 4.2981 8.0151 116.3296 60.8222 70.3570 173.0866 45 P 4.4308 0.0000 0.0000 61.4935 32.7200 175.3517 46 P 4.4211 0.0000 0.0000 65.1966 31.2074 178.4959 47 K 4.3087 7.9595 113.3000 57.6270 32.2793 177.2287 48 L 4.6860 7.9045 118.1929 54.1101 43.0648 178.1024 49 E 3.9110 8.0873 120.8144 59.2381 29.4296 178.4702 50 D 4.6259 7.8851 115.7014 54.1232 40.1980 176.5202 51 K 4.3014 7.5386 119.9244 55.2419 33.3614 176.6980 52 S 4.2391 8.2956 116.2428 57.5838 62.9801 173.4953 53 P 4.1900 0.0000 0.0000 65.3031 31.1906 176.6390 54 D 4.7032 7.7641 115.6351 53.8821 41.2791 176.8916 55 S 4.3615 7.7007 113.7983 57.6364 65.1454 173.2057 56 P 4.3348 0.0000 0.0000 65.8965 30.9665 178.9845 57 E 4.0782 8.0881 116.9323 59.8296 29.5442 179.1341 58 M 4.0015 7.8466 118.2674 58.3846 31.9484 178.5510 59 H 4.3383 8.3239 116.6259 59.1151 29.0709 177.3201 60 D 4.4913 8.3662 119.7633 57.1815 40.9685 177.9509 61 F 4.0534 8.4217 121.3705 61.5339 39.3167 177.3377 62 R 4.2597 8.3560 117.6772 59.6426 29.8208 178.4845 63 H 4.4773 8.7609 118.2699 59.3399 29.7546 177.3622 64 G 3.4414 8.0078 107.1922 47.9400 0.0000 175.6666 65 F 4.0229 7.4170 119.4576 60.0026 38.8836 177.9322 66 W 4.3417 7.9091 118.7526 59.4558 28.8482 178.1394 67 C 4.0509 8.3433 119.2128 62.4400 30.9181 175.4610 68 L 3.9045 7.9552 121.9678 58.1904 41.5845 178.9339 69 I 3.7513 8.3720 120.2274 64.2265 37.0349 178.5155 70 G 3.6656 8.2331 106.5281 48.1495 0.0000 175.7652 71 Q 4.0695 8.0461 120.6349 58.4769 28.5908 178.8655 72 I 3.7359 8.0560 121.1284 64.7015 37.0894 178.0283 73 H 4.1236 8.6128 117.0258 58.9988 28.4635 177.7028 74 A 3.9853 8.1967 122.1860 55.0678 18.1851 179.5602 75 A 3.9545 8.1389 119.3504 55.2614 18.4644 179.6848 76 L 3.9243 8.2806 119.1653 58.3161 41.6029 178.4863 77 H 4.0379 8.5124 118.5681 59.3141 29.7535 177.2805 78 L 4.0344 7.8696 120.2465 57.7173 41.4127 179.3187 79 A 3.9971 8.0907 120.7681 55.3030 18.1175 179.4637 80 N 4.2888 8.6061 114.1428 55.9859 38.6114 176.4549 81 E 4.3751 7.5212 116.8178 55.8662 29.7657 177.3645 82 G 3.9194 8.0040 107.3782 46.2444 0.0000 175.8959 83 K 4.3002 7.6575 121.4899 54.7297 30.0821 177.4850 84 V 3.5312 7.7726 122.7477 65.8681 31.9945 177.2338 85 K 3.9635 7.9927 117.6897 59.5640 31.8559 179.0985 86 E 3.9506 8.1512 118.1525 59.3159 29.3874 179.0943 87 A 3.9960 8.0661 120.9184 55.1998 18.3985 179.7437 88 Q 3.9122 8.5165 116.8121 58.9109 28.8162 178.7988 89 A 3.9605 8.2815 121.7584 55.1446 18.2361 179.4755 90 A 3.9426 8.0563 118.0715 55.3196 18.6079 179.4396 91 A 4.0696 8.3328 119.5145 55.0946 18.4284 179.3079 92 E 3.8727 8.3449 117.9593 59.7719 29.5740 179.2326 93 Q 4.0927 8.1159 117.3797 58.4457 28.6753 178.3715 94 L 3.9513 7.6184 120.3135 57.8580 41.5524 179.3936 95 K 3.8984 7.9018 117.8575 59.7866 31.9023 179.1125 96 T 3.8335 7.6203 115.9661 67.1387 68.3709 176.6665 97 T 3.8095 7.7580 116.7877 66.6394 68.5798 176.1843 98 C 3.8032 7.9181 118.6511 63.1124 28.1558 176.0959 99 N 4.2830 8.7312 117.6965 56.1776 37.6603 177.3220 100 A 3.9276 8.0426 122.1340 55.3746 18.4538 179.2888 101 C 4.1693 7.7781 116.7281 62.8550 31.6266 175.3563 102 H 4.2764 8.0464 117.8114 59.1293 28.1230 177.3952 103 Q 3.9610 8.1991 120.2532 58.9781 28.8026 178.2986 104 K 3.9003 7.3012 117.1015 58.2062 32.5089 177.3029 105 Y 4.8717 7.9090 112.6770 57.4225 39.9098 175.7006 106 R 4.1893 8.1301 125.1930 56.4850 30.1207 175.6791 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 1 A 8.25 4.25 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 2 D 8.35 4.53 0.00 2.95 2.82 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 0.00 0.00 0.00 3 L 9.18 3.93 0.00 1.76 1.77 1.09 1.08 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 4 E 8.22 3.99 0.00 2.20 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 2.43 2.42 0.00 5 D 8.87 4.37 0.00 2.81 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.37 4.34 0.00 2.87 2.94 0.00 0.00 7.09 7.44 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 7 M 8.35 4.12 0.00 2.09 2.31 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 3.01 0.00 8 E 8.36 3.94 0.00 2.09 2.15 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 2.32 2.51 0.00 9 T 8.09 3.87 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 1.21 0.00 0.00 10 L 8.08 3.97 0.00 2.05 1.76 0.96 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.48 4.27 0.00 2.96 2.93 0.00 0.00 7.31 8.13 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 12 D 8.45 4.38 0.00 2.77 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.26 4.46 0.00 2.87 2.97 0.00 0.00 6.71 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 7.93 3.97 0.00 1.98 1.83 0.97 0.46 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 15 K 7.86 3.98 0.00 1.98 1.84 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.64 7.81 16 V 7.55 3.58 2.24 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 0.83 0.00 0.00 0.97 0.00 0.00 17 I 7.82 3.85 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.44 0.91 0.00 0.00 18 E 7.91 3.98 0.00 2.15 2.03 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 2.35 2.48 0.00 19 K 7.82 4.21 0.00 1.94 1.93 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.64 1.55 7.81 20 A 7.08 4.16 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 21 D 8.57 4.99 0.00 2.73 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 N 7.68 5.01 0.00 2.95 2.89 0.00 0.00 6.05 7.46 0.00 0.00 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 A 8.59 3.96 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 24 A 7.99 3.95 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Q 8.43 3.90 0.00 2.28 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 26 V 7.54 3.57 2.21 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 0.98 0.00 0.00 0.98 0.00 0.00 27 K 8.49 3.92 0.00 1.94 1.84 0.00 1.72 0.00 0.00 1.56 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.63 7.81 28 D 8.23 4.29 0.00 2.76 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 29 A 7.87 4.25 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 30 L 8.05 3.98 0.00 1.85 1.74 0.93 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 31 T 8.11 3.86 4.39 0.00 0.00 0.00 0.00 0.00 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 32 K 8.13 4.05 0.00 1.99 1.86 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.46 1.65 7.81 33 M 8.14 4.05 0.00 2.08 2.26 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.57 0.00 34 A 8.27 3.96 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 7.91 3.90 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 36 A 8.17 4.03 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 8.32 3.80 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.78 3.65 1.32 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 0.00 0.00 0.00 39 D 7.80 4.36 0.00 2.77 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 7.66 3.91 0.79 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 0.00 0.00 0.00 0.00 0.00 0.00 41 W 7.26 3.67 0.00 2.63 3.18 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 42 S 7.61 3.61 0.00 3.68 3.45 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 43 A 7.44 4.17 1.32 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 0.00 0.00 0.00 44 T 8.02 4.30 4.14 0.00 0.00 0.00 0.00 0.00 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 45 P 0.00 4.43 0.00 2.04 1.96 0.00 3.10 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.44 0.00 46 P 0.00 4.42 0.00 2.18 2.15 0.00 3.86 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 47 K 7.96 4.31 0.00 1.91 1.89 0.00 1.89 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.47 7.81 48 L 7.90 4.69 0.00 1.34 1.39 0.16 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.09 3.91 0.00 2.09 1.96 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 2.26 2.48 0.00 50 D 7.89 4.63 0.00 2.76 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 51 K 7.54 4.30 0.00 1.85 1.72 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.47 7.81 52 S 8.30 4.24 0.00 3.83 3.70 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 53 P 0.00 4.19 0.00 2.06 2.08 0.00 3.69 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 54 D 7.76 4.70 0.00 2.67 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 S 7.70 4.36 0.00 4.24 3.95 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 0.00 0.00 0.00 56 P 0.00 4.33 0.00 2.23 2.22 0.00 3.61 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 2.15 2.24 0.00 57 E 8.09 4.08 0.00 2.03 1.92 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 2.57 2.67 0.00 58 M 7.85 4.00 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.59 0.00 59 H 8.32 4.34 0.00 3.43 3.40 0.00 5.64 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 D 8.37 4.49 0.00 3.10 3.04 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 61 F 8.42 4.05 0.00 2.71 3.09 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 0.00 0.00 0.00 62 R 8.36 4.26 0.00 2.26 2.66 0.00 3.41 0.00 0.00 2.93 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.84 0.00 63 H 8.76 4.48 0.00 3.43 3.70 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.01 3.44 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 0.00 65 F 7.42 4.02 0.00 3.26 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 66 W 7.91 4.34 0.00 3.36 3.13 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 0.00 0.00 0.00 67 C 8.34 4.05 0.00 2.81 3.02 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 0.00 0.00 0.00 68 L 7.96 3.90 0.00 1.80 1.77 0.87 1.30 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 69 I 8.37 3.75 1.85 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.40 0.90 0.00 0.00 70 G 8.23 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.05 4.07 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 72 I 8.06 3.74 2.06 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.81 0.97 0.00 0.00 73 H 8.61 4.12 0.00 3.38 3.38 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 A 8.20 3.99 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 A 8.14 3.95 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 8.28 3.92 0.00 1.86 1.82 0.94 1.18 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 77 H 8.51 4.04 0.00 3.40 3.43 0.00 5.64 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 78 L 7.87 4.03 0.00 1.91 1.71 0.98 1.47 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 79 A 8.09 4.00 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 80 N 8.61 4.29 0.00 2.77 2.85 0.00 0.00 7.09 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 7.52 4.38 0.00 2.13 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.39 0.00 82 G 8.00 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 0.00 0.00 0.00 83 K 7.66 4.30 0.00 2.02 1.77 0.00 1.68 0.00 0.00 1.89 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.43 7.81 84 V 7.77 3.53 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 1.16 0.00 0.00 1.00 0.00 0.00 85 K 7.99 3.96 0.00 1.84 1.85 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.53 7.81 86 E 8.15 3.95 0.00 2.01 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 2.40 2.38 0.00 87 A 8.07 4.00 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 88 Q 8.52 3.91 0.00 2.26 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 89 A 8.28 3.96 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.06 3.94 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 A 8.33 4.07 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 92 E 8.34 3.87 0.00 2.09 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 0.00 2.31 2.40 0.00 93 Q 8.12 4.09 0.00 2.34 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.52 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 94 L 7.62 3.95 0.00 1.78 1.72 0.92 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 95 K 7.90 3.90 0.00 1.87 1.86 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.57 7.81 96 T 7.62 3.83 4.30 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 1.19 0.00 0.00 97 T 7.76 3.81 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 1.09 0.00 0.00 98 C 7.92 3.80 0.00 3.05 2.87 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 99 N 8.73 4.28 0.00 2.83 2.85 0.00 0.00 7.00 8.37 0.00 0.00 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 A 8.04 3.93 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 C 7.78 4.17 0.00 2.86 2.79 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 0.00 0.00 0.00 0.00 102 H 8.05 4.28 0.00 3.40 3.32 0.00 5.70 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Q 8.20 3.96 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.90 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 104 K 7.30 3.90 0.00 0.79 0.74 0.00 1.50 0.00 0.00 1.60 0.00 0.00 3.10 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.18 1.38 7.81 105 Y 7.91 4.87 0.00 3.11 2.92 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 0.00 106 R 8.13 4.19 0.00 1.88 2.01 0.00 2.87 0.00 0.00 3.12 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00