NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 A 4.3848 8.2531 123.5942 51.5727 20.8752 176.8396 -1 G 4.2578 7.7174 110.6180 44.3562 0.0000 173.3376 0 S 4.1935 7.9877 114.4254 61.5567 63.0298 174.2475 1 M 4.0476 8.2812 120.4028 58.3606 32.1060 177.8501 2 A 4.3489 7.9345 121.7805 54.6422 18.6448 178.8690 3 L 3.5883 7.8595 118.7932 58.3468 42.1792 179.0912 4 K 3.8941 8.0130 119.2440 59.5885 32.0052 178.7382 5 R 3.8896 7.7471 118.6189 59.4371 29.9646 178.5589 6 I 3.3193 8.0064 120.0877 64.4030 36.8648 177.9968 7 H 4.0623 8.4041 117.4298 58.7306 28.5588 177.5642 8 K 3.9066 7.9425 120.9485 59.7652 31.9629 178.5849 9 E 4.0462 8.4809 119.0196 59.2721 29.3771 179.0903 10 L 4.1155 8.5153 120.7777 58.4632 42.1612 178.8481 11 N 4.3946 8.5616 116.6623 56.3410 38.3439 177.2652 12 D 4.3641 8.1360 120.3913 57.2218 40.7539 178.5957 13 L 4.0065 8.0576 118.3296 58.0075 41.7869 179.2713 14 A 4.1074 7.8673 119.0748 54.9039 18.2863 179.5058 15 R 4.2458 7.6407 116.5158 58.2924 31.0334 177.1522 16 D 4.6127 7.6371 120.1687 51.1735 39.9701 172.5609 17 P 4.5637 0.0000 0.0000 61.7104 32.6455 175.2456 18 P 4.3741 0.0000 0.0000 62.6577 31.8531 176.7279 19 A 4.1160 8.5577 123.6117 54.9539 18.6369 178.4622 20 Q 4.6903 7.9448 112.8234 56.1029 29.9848 175.0258 21 C 5.5836 7.6791 112.3474 58.4686 32.6276 173.0863 22 S 4.7792 8.2408 112.8484 57.4296 65.7531 172.6812 23 A 5.0699 7.9533 125.9607 51.1083 22.3070 175.1795 24 G 3.0055 8.3317 106.2696 44.2764 0.0000 170.8481 25 P 4.4805 0.0000 0.0000 63.1407 30.8415 176.7332 26 V 3.8839 8.9359 124.2574 65.7269 32.8141 175.7107 27 G 4.2251 7.3461 106.7211 45.6600 0.0000 172.8541 28 D 4.5951 9.1155 124.3915 53.6274 41.0628 175.2323 29 D 4.7924 7.6891 120.4828 52.4401 41.1842 176.3240 30 M 4.1949 8.6832 127.2542 57.9433 32.5358 176.9907 31 F 4.3370 8.7415 116.5680 59.0628 39.6574 174.2662 32 H 5.5423 8.8035 118.8382 54.0202 31.2158 172.9747 33 W 5.4767 9.5121 123.5614 54.8801 33.1799 174.5601 34 Q 5.2842 8.8975 122.1123 54.5169 31.8712 174.1271 35 A 5.3199 8.8668 124.7906 50.3924 23.3725 174.8243 36 T 4.6401 8.9133 110.4188 59.8109 71.6284 173.0730 37 I 4.8294 8.7825 126.1744 59.8025 39.7278 174.5190 38 M 4.8418 8.9508 127.7578 54.0601 33.0333 176.6317 39 G 4.0784 9.3660 111.7610 46.0818 0.0000 171.8974 40 P 4.6248 0.0000 0.0000 62.3083 32.1908 175.7624 41 N 4.6820 8.5077 118.5006 54.8724 38.9869 175.1590 42 D 4.5825 9.9671 121.3040 54.7394 39.5089 173.9526 43 S 4.9031 7.3880 113.1248 55.5374 65.3584 173.2699 44 P 4.3592 0.0000 0.0000 64.6766 31.1719 177.0489 45 Y 4.8539 7.3855 116.2615 57.3543 38.5253 175.1410 46 Q 4.1771 7.6484 120.9687 58.1419 29.3203 176.9828 47 G 4.0807 9.2160 113.4835 45.1820 0.0000 173.7892 48 G 3.7250 8.3033 107.3941 45.8974 0.0000 173.0265 49 V 4.7633 8.2771 122.9024 60.8018 33.6941 174.6855 50 F 4.8777 9.1620 127.4826 55.7860 41.4702 174.8426 51 F 4.9829 9.4598 123.3831 56.5716 40.7094 175.0174 52 L 5.1336 8.9216 121.8390 53.1885 46.1413 175.1506 53 T 5.0143 8.8257 116.0028 60.5560 70.1286 173.2544 54 I 4.8638 8.5032 127.6992 59.8178 41.4067 173.8627 55 H 5.3148 8.9142 123.9282 53.9308 31.8527 172.8782 56 F 4.4917 8.9330 123.3452 55.9824 39.9042 174.3888 57 P 4.6018 0.0000 0.0000 62.3698 32.1762 177.0908 58 T 4.2359 8.4745 113.3973 63.9760 67.5985 174.2442 59 D 5.1684 7.9134 120.9197 53.1625 40.1227 175.2633 60 Y 4.4559 8.0447 120.7660 58.5642 39.3396 173.9232 61 P 3.6291 0.0000 0.0000 62.7105 31.7475 177.1488 62 F 4.9246 7.8455 117.9127 58.7128 39.5541 176.0612 63 K 4.7261 7.7390 119.2072 53.3600 35.0896 174.0325 64 P 2.9700 0.0000 0.0000 60.8925 32.0468 174.3092 65 P 4.1121 0.0000 0.0000 62.5808 32.3792 175.5952 66 K 4.3086 8.5205 121.3776 55.5966 33.5512 176.1667 67 V 4.8735 8.1667 123.8232 61.2205 34.4784 174.0845 68 A 5.0375 8.6957 128.1181 50.1876 23.3376 175.0793 69 F 4.6173 9.6757 119.9547 57.9186 39.6214 176.4407 70 T 4.4723 9.1518 112.9696 62.9114 70.4586 175.2850 71 T 4.4525 8.1960 118.7284 62.7268 69.4503 175.2245 72 R 4.0634 8.5847 125.2169 56.4395 30.6401 176.0602 73 I 4.8893 8.1728 121.2120 59.6236 40.9982 174.0925 74 Y 3.7057 8.7861 128.7268 56.7087 37.6902 173.6262 75 H 4.7904 7.5649 125.8145 53.7695 33.2032 172.6817 76 P 4.0975 0.0000 0.0000 65.0225 31.3787 177.1865 77 N 4.7136 8.1944 115.1243 52.6251 39.0120 173.5606 78 I 4.7436 7.3674 119.6009 59.5598 40.4210 175.0654 79 N 4.7904 8.3500 123.5072 50.9179 39.3046 175.8865 80 S 4.1779 8.4636 111.8358 61.0628 63.0220 174.6461 81 N 4.5401 8.3657 116.7779 53.0379 38.6901 175.6857 82 G 4.4411 8.4236 106.6607 45.9721 0.0000 173.4950 83 S 4.5645 8.0624 115.1929 58.1177 63.6197 172.8855 84 I 4.6485 8.2491 126.7360 59.6499 39.5319 175.6898 85 S 4.4934 8.8371 123.1647 57.0513 61.8756 172.3061 86 L 4.5913 7.9538 127.0879 52.1968 45.0266 176.4031 87 D 4.4641 8.9810 126.6107 57.4005 40.5884 178.6343 88 I 3.8927 7.7600 111.9862 63.2563 37.7432 177.1916 89 L 4.4262 7.7355 119.1153 53.5396 42.1298 176.6681 90 R 4.6406 8.6936 116.0783 56.2995 30.0003 178.4268 91 S 4.1808 9.5708 123.5235 61.5397 63.5426 175.2826 92 Q 4.4582 7.9197 117.5594 55.0196 28.9978 175.3973 93 W 4.3412 7.7784 129.1826 57.5680 31.4591 175.1466 94 S 4.3855 6.7617 117.9307 55.3498 64.9102 172.6998 95 P 4.5381 0.0000 0.0000 63.6681 31.0695 177.0638 96 A 3.9752 7.2708 122.3990 54.7990 18.6625 178.3907 97 L 4.0145 6.9385 114.6174 54.8987 42.2757 176.4684 98 T 5.1366 7.9042 109.6950 59.3112 73.3988 174.6071 99 I 3.8303 10.1903 121.9719 64.1448 37.7610 178.0539 100 S 4.2048 8.1465 114.8373 61.4141 62.9262 176.2955 101 K 3.9075 7.8212 121.9637 59.1337 31.7905 179.3564 102 V 3.6519 7.9089 118.2650 66.1788 31.4306 178.1745 103 L 4.0284 8.0889 118.6689 57.6980 41.3626 179.4754 104 L 4.0113 8.3723 119.4443 57.8771 41.4631 179.6368 105 S 4.1334 8.3082 115.1922 61.7730 62.7808 176.9299 106 I 3.7603 7.8724 122.4638 64.3150 36.9505 178.0627 107 C 4.0497 8.3769 118.0668 63.1011 28.0169 176.2616 108 S 4.1221 8.2945 114.6070 61.2668 61.7380 175.8301 109 L 3.9660 8.0850 122.5548 58.0467 41.8231 178.6388 110 L 4.0316 7.6291 118.1237 58.0676 41.6342 178.9377 111 C 4.5580 7.8638 115.0565 61.6549 29.2789 173.8469 112 D 4.7328 7.7635 118.7961 51.1791 40.8959 172.8114 113 P 4.3285 0.0000 0.0000 62.3848 32.4921 176.6355 114 N 4.7615 9.2258 119.1880 51.1005 37.6239 173.8865 115 P 4.2018 0.0000 0.0000 64.2061 32.2429 177.9983 116 D 4.5606 7.8632 117.6728 55.3678 41.6003 175.9942 117 D 4.8027 7.3173 117.5741 51.4048 40.8229 172.5019 118 P 4.6385 0.0000 0.0000 60.9529 33.4512 177.0086 119 L 3.9865 8.4694 122.7467 57.5323 42.5544 177.2756 120 V 4.2066 7.4672 120.7464 59.4698 31.2712 173.4164 121 P 4.2132 0.0000 0.0000 65.5759 31.5114 177.4860 122 E 3.9740 8.2097 116.3836 59.4335 29.2765 179.4989 123 I 3.8587 7.6787 119.3313 64.1608 37.1411 177.9532 124 A 3.9043 7.9389 121.1670 55.2619 18.1492 179.2738 125 R 3.8407 8.1754 117.0411 59.8332 30.0396 178.8492 126 I 3.7593 7.4689 118.0394 64.4398 36.9192 177.4731 127 Y 3.7377 8.1467 119.6713 60.9507 38.5642 178.4131 128 K 4.1473 8.3510 117.8986 58.4400 32.3175 178.4591 129 T 4.4763 7.6522 107.9687 61.7804 71.6044 174.8120 130 D 4.6932 8.3512 121.0554 51.4554 42.3891 175.1534 131 R 3.7339 7.9537 122.7336 59.7232 30.2661 177.1574 132 E 3.9449 8.0410 117.7931 59.0654 29.5238 178.8444 133 K 3.8975 8.1655 119.2339 59.5206 32.2505 177.7564 134 Y 4.1386 8.0938 119.7806 61.1435 38.7255 178.0770 135 N 4.1773 8.5459 117.2585 56.2383 38.5772 177.4471 136 R 3.8444 7.8714 119.4019 59.4083 30.1822 179.1013 137 I 3.4461 7.7402 119.1666 64.2081 37.0234 178.3525 138 A 3.8454 7.5483 121.7644 55.2313 18.0947 179.8094 139 R 4.2632 7.7709 117.7383 58.9469 30.0319 179.2204 140 E 4.0294 8.2788 118.2870 59.2892 29.4792 179.4735 141 W 4.3673 8.7638 119.1653 60.1219 29.0006 178.7115 142 T 4.2447 8.4179 115.8593 66.8843 67.6972 176.7678 143 Q 4.0288 8.0422 118.9631 58.7556 28.8366 178.5341 144 K 3.8537 8.1130 118.5971 59.2415 32.1517 178.1969 145 Y 4.7171 8.3245 113.8131 57.6526 39.6921 176.4037 146 A 4.5751 8.0719 121.2438 51.6532 19.8178 176.2736 147 M 4.3428 7.7166 119.6612 55.9432 31.2038 174.7724 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 -2 A 8.25 4.38 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 -1 G 7.72 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 0.00 0.00 0.00 0.00 0 S 7.99 4.19 0.00 3.95 3.94 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 0.00 0.00 0.00 1 M 8.28 4.05 0.00 2.28 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 2.74 2.78 0.00 2 A 7.93 4.35 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.86 3.59 0.00 2.10 1.87 0.77 0.80 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 4 K 8.01 3.89 0.00 2.06 2.00 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.46 7.81 5 R 7.75 3.89 0.00 1.88 2.09 0.00 3.18 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.83 0.00 6 I 8.01 3.32 1.38 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.23 0.12 0.32 0.00 0.00 7 H 8.40 4.06 0.00 3.35 3.34 0.00 5.63 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 7.94 3.91 0.00 2.03 1.98 0.00 1.64 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 1.45 1.50 7.81 9 E 8.48 4.05 0.00 2.17 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 2.41 2.53 0.00 10 L 8.52 4.12 0.00 2.05 1.93 0.48 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.56 4.39 0.00 2.93 2.87 0.00 0.00 7.09 8.26 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 12 D 8.14 4.36 0.00 2.91 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.06 4.01 0.00 1.97 1.79 1.26 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 14 A 7.87 4.11 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 15 R 7.64 4.25 0.00 1.96 2.15 0.00 3.25 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 16 D 7.64 4.61 0.00 2.73 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.56 0.00 2.21 2.17 0.00 3.78 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 1.98 1.98 0.00 18 P 0.00 4.37 0.00 2.08 2.05 0.00 3.71 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 2.06 2.12 0.00 19 A 8.56 4.12 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 20 Q 7.94 4.69 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.64 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 21 C 7.68 5.58 0.00 3.01 2.85 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.24 4.78 0.00 3.89 3.64 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 23 A 7.95 5.07 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.33 3.01 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 0.00 0.00 0.00 25 P 0.00 4.48 0.00 2.10 1.97 0.00 3.15 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.67 0.00 26 V 8.94 3.88 2.30 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 0.80 0.00 0.00 0.98 0.00 0.00 27 G 7.35 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 0.00 0.00 0.00 0.00 28 D 9.12 4.60 0.00 2.70 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 29 D 7.69 4.79 0.00 2.75 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 30 M 8.68 4.19 0.00 1.86 2.04 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 31 F 8.74 4.34 0.00 3.24 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 32 H 8.80 5.54 0.00 3.21 3.30 0.00 5.57 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 9.51 5.48 0.00 3.15 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 8.90 5.28 0.00 2.18 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.72 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 35 A 8.87 5.32 1.20 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 0.00 0.00 0.00 0.00 0.00 36 T 8.91 4.64 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 0.63 0.00 0.00 37 I 8.78 4.83 1.83 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.66 0.93 0.00 0.00 38 M 8.95 4.84 0.00 1.92 2.20 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 2.62 2.55 0.00 39 G 9.37 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.62 0.00 2.32 2.07 0.00 3.86 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.18 0.00 41 N 8.51 4.68 0.00 2.76 2.79 0.00 0.00 7.04 8.06 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 42 D 9.97 4.58 0.00 2.84 2.85 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.39 4.90 0.00 4.21 4.11 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.36 0.00 1.81 2.23 0.00 3.60 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.98 0.00 45 Y 7.39 4.85 0.00 3.24 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 46 Q 7.65 4.18 0.00 2.35 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.54 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 47 G 9.22 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.30 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 V 8.28 4.76 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 0.34 0.00 0.00 0.87 0.00 0.00 50 F 9.16 4.88 0.00 3.10 3.20 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 0.00 0.00 0.00 51 F 9.46 4.98 0.00 3.06 2.97 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 0.00 0.00 0.00 52 L 8.92 5.13 0.00 1.40 1.36 0.16 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.83 5.01 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 1.28 0.00 0.00 54 I 8.50 4.86 1.72 0.00 0.00 0.90 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 0.52 -0.06 0.00 0.00 55 H 8.91 5.31 0.00 2.99 3.18 0.00 5.80 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.93 4.49 0.00 2.71 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 4.60 0.00 2.29 2.19 0.00 3.80 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.08 0.00 58 T 8.47 4.24 4.08 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 0.00 0.00 0.00 1.19 0.00 0.00 59 D 7.91 5.17 0.00 3.04 2.94 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 0.00 0.00 0.00 60 Y 8.04 4.46 0.00 3.30 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 61 P 0.00 3.63 0.00 1.81 1.30 0.00 2.68 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.49 0.00 62 F 7.85 4.92 0.00 3.26 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 63 K 7.74 4.73 0.00 1.72 1.62 0.00 1.88 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.71 7.81 64 P 0.00 2.97 0.00 1.82 1.73 0.00 3.62 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.96 0.00 65 P 0.00 4.11 0.00 1.43 1.04 0.00 2.95 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 66 K 8.52 4.31 0.00 1.65 1.71 0.00 1.56 0.00 0.00 1.52 0.00 0.00 2.74 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.30 7.81 67 V 8.17 4.87 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 0.68 0.00 0.00 0.71 0.00 0.00 68 A 8.70 5.04 1.28 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 0.00 0.00 69 F 9.68 4.62 0.00 2.88 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 70 T 9.15 4.47 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 1.26 0.00 0.00 71 T 8.20 4.45 4.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 72 R 8.58 4.06 0.00 0.76 1.38 0.00 3.25 0.00 0.00 3.01 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.57 0.00 73 I 8.17 4.89 1.87 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.75 0.24 0.00 0.00 74 Y 8.79 3.71 0.00 1.84 2.58 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 75 H 7.56 4.79 0.00 2.93 2.78 0.00 5.73 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.10 0.00 1.99 2.13 0.00 3.24 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 1.53 1.29 0.00 77 N 8.19 4.71 0.00 2.80 2.76 0.00 0.00 6.91 7.31 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 78 I 7.37 4.74 1.48 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.30 0.48 0.00 0.00 79 N 8.35 4.79 0.00 2.96 2.93 0.00 0.00 6.30 7.41 0.00 0.00 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 S 8.46 4.18 0.00 4.05 4.11 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.37 4.54 0.00 2.88 2.90 0.00 0.00 6.94 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 82 G 8.42 4.44 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 83 S 8.06 4.56 0.00 3.97 3.94 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 0.00 0.00 0.00 84 I 8.25 4.65 1.91 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.14 0.94 0.00 0.00 85 S 8.84 4.49 0.00 3.84 3.81 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 86 L 7.95 4.59 0.00 1.71 1.46 0.92 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 87 D 8.98 4.46 0.00 2.74 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.76 3.89 2.02 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.63 0.94 0.00 0.00 89 L 7.74 4.43 0.00 1.84 1.74 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 90 R 8.69 4.64 0.00 1.80 1.32 0.00 3.29 0.00 0.00 3.22 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 91 S 9.57 4.18 0.00 4.01 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 92 Q 7.92 4.46 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.96 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 93 W 7.78 4.34 0.00 3.57 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 94 S 6.76 4.39 0.00 3.62 3.24 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 0.00 95 P 0.00 4.54 0.00 2.09 2.05 0.00 3.32 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.18 0.00 96 A 7.27 3.98 1.14 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 0.00 0.00 0.00 97 L 6.94 4.01 0.00 0.39 1.25 0.49 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.90 5.14 4.50 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 0.00 0.00 0.00 1.24 0.00 0.00 99 I 10.19 3.83 2.11 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.39 1.10 0.00 0.00 100 S 8.15 4.20 0.00 4.14 4.19 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 0.00 0.00 0.00 0.00 101 K 7.82 3.91 0.00 2.03 1.93 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.49 1.59 7.81 102 V 7.91 3.65 2.30 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 1.05 0.00 0.00 1.21 0.00 0.00 103 L 8.09 4.03 0.00 1.77 1.70 0.99 0.40 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 0.00 104 L 8.37 4.01 0.00 1.75 1.73 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.31 4.13 0.00 4.04 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 0.00 106 I 7.87 3.76 1.98 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 1.58 1.02 1.03 0.00 0.00 107 C 8.38 4.05 0.00 3.14 3.01 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 0.00 108 S 8.29 4.12 0.00 3.89 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 L 8.08 3.97 0.00 1.70 1.82 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 110 L 7.63 4.03 0.00 1.81 1.61 0.43 0.12 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 0.00 111 C 7.86 4.56 0.00 3.26 3.06 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 0.00 112 D 7.76 4.73 0.00 2.60 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.33 0.00 1.06 1.35 0.00 3.68 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 1.64 1.98 0.00 114 N 9.23 4.76 0.00 2.71 2.65 0.00 0.00 7.09 8.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 P 0.00 4.20 0.00 2.16 1.80 0.00 3.63 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.03 0.00 116 D 7.86 4.56 0.00 2.66 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 D 7.32 4.80 0.00 2.67 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 P 0.00 4.64 0.00 2.14 1.93 0.00 3.78 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.89 0.00 119 L 8.47 3.99 0.00 1.64 1.66 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.47 4.21 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 0.90 0.00 0.00 0.87 0.00 0.00 121 P 0.00 4.21 0.00 2.18 2.10 0.00 3.63 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 122 E 8.21 3.97 0.00 2.07 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 2.43 2.48 0.00 123 I 7.68 3.86 1.73 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.43 0.51 0.00 0.00 124 A 7.94 3.90 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.18 3.84 0.00 2.03 2.13 0.00 3.11 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 126 I 7.47 3.76 2.22 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.04 1.05 0.00 0.00 127 Y 8.15 3.74 0.00 2.55 2.98 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 0.00 0.00 0.00 128 K 8.35 4.15 0.00 1.93 1.86 0.00 1.95 0.00 0.00 1.87 0.00 0.00 3.32 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.57 7.81 129 T 7.65 4.48 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 1.26 0.00 0.00 130 D 8.35 4.69 0.00 2.67 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 R 7.95 3.73 0.00 1.68 1.81 0.00 2.55 0.00 0.00 2.44 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.66 0.00 132 E 8.04 3.94 0.00 2.04 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 2.38 2.33 0.00 133 K 8.17 3.90 0.00 2.02 1.95 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.50 7.81 134 Y 8.09 4.14 0.00 3.16 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 0.00 135 N 8.55 4.18 0.00 2.89 2.82 0.00 0.00 7.11 8.21 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 0.00 136 R 7.87 3.84 0.00 2.06 1.91 0.00 3.11 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.86 0.00 137 I 7.74 3.45 0.80 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.62 -0.34 0.00 0.00 138 A 7.55 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 7.77 4.26 0.00 2.11 1.98 0.00 3.12 0.00 0.00 3.25 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.54 0.00 140 E 8.28 4.03 0.00 2.34 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 2.35 2.37 0.00 141 W 8.76 4.37 0.00 3.67 3.66 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 0.00 142 T 8.42 4.24 4.58 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 1.47 0.00 0.00 143 Q 8.04 4.03 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.95 0.00 0.00 0.00 0.00 0.00 2.41 2.55 0.00 144 K 8.11 3.85 0.00 1.09 0.79 0.00 1.57 0.00 0.00 1.09 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.15 1.45 7.81 145 Y 8.32 4.72 0.00 3.12 3.01 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 0.00 146 A 8.07 4.58 0.75 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 0.00 147 M 7.72 4.34 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.68 0.00