NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.3030 8.1749 117.3711 63.2427 69.1124 171.3669 4 I 4.2585 7.4348 122.2817 58.4589 39.9085 174.1352 5 N 4.4929 9.6526 125.5838 52.0805 39.8727 173.2129 6 P 4.2420 0.0000 0.0000 63.4615 31.9917 175.6950 7 T 4.2054 8.1646 118.5481 62.5662 69.8552 175.6866 8 N 4.6175 7.9901 124.6225 52.4960 37.4392 174.8723 9 Y 4.2113 7.8761 123.6008 60.5635 38.1653 177.6815 10 T 3.8943 7.8797 116.6280 66.4827 68.6167 176.2914 11 L 3.9637 7.8229 121.8273 57.9416 42.1523 178.4775 12 L 3.9667 8.0686 120.3684 58.2347 42.0297 179.1894 13 K 4.0502 8.4785 118.6844 59.3964 32.0103 179.5881 14 K 4.0437 7.9439 119.0089 59.5036 31.8723 179.4822 15 Q 4.0527 8.4177 118.2609 58.4433 28.7242 178.4853 16 A 3.9560 8.3576 122.0868 55.0743 18.6560 179.3358 17 A 3.9592 8.0821 119.2938 55.7341 18.2506 180.1508 18 S 4.1953 7.8073 112.0249 61.3483 62.8839 176.4631 19 L 4.1563 8.0406 123.0325 57.5119 42.1874 178.4863 20 I 4.3560 7.2838 110.8160 59.6265 38.2051 174.5436 21 E 4.0970 7.1698 120.5092 58.0239 29.8112 176.8515 22 D 4.6888 8.8094 124.0233 54.5227 38.7714 173.5578 23 E 4.6873 7.5586 118.1355 55.2952 31.1318 175.6645 24 H 4.9631 8.3459 114.8477 53.5245 31.7396 173.5095 25 H 4.3597 8.1255 120.5878 55.5432 30.2436 174.5999 26 M 3.8618 8.5238 128.4560 59.0317 31.9766 178.0374 27 I 3.5797 7.3908 118.8728 64.2277 37.3301 178.1376 28 A 3.9696 8.1466 121.1066 55.2054 18.2222 179.5753 29 I 3.6011 7.8532 118.3386 64.5332 37.1579 178.7559 30 L 3.3651 7.9814 120.0993 57.4830 41.1916 179.7721 31 S 4.0617 8.1859 115.3128 61.8305 62.8444 176.5945 32 N 4.3404 8.2108 119.0822 56.5770 38.2540 177.5111 33 M 4.1898 8.4209 120.6621 58.0531 31.9857 178.9075 34 S 4.2043 8.4651 114.6299 61.4161 63.0593 176.5495 35 A 3.9070 7.7476 124.6645 54.6910 17.9440 179.2855 36 L 3.8839 7.8099 117.6336 58.3047 42.4573 178.9640 37 L 4.1632 8.0970 118.9171 57.8316 41.3786 178.9294 38 N 4.3301 8.0654 115.8799 56.6791 38.9841 175.9921 39 D 4.6170 8.2022 117.9827 55.4398 41.1981 176.3680 40 N 4.9082 7.9165 114.4333 52.2210 40.5530 173.8878 41 L 4.5781 7.8075 118.7742 52.8145 43.4133 175.6044 42 D 4.5850 8.4892 123.1549 54.1249 42.4930 174.7356 43 Q 3.5523 8.6021 121.2500 57.2658 27.1384 173.2109 44 I 4.8414 7.6727 107.8821 58.9897 40.7588 174.4257 45 N 5.0983 8.8654 118.3226 52.5854 38.7732 174.1693 46 W 5.2120 7.9872 128.8788 56.6101 34.6408 173.3124 47 V 4.8330 7.7361 126.2379 60.8260 34.3547 174.1482 48 G 3.6265 8.2148 111.2692 46.2080 0.0000 171.8526 49 F 5.6913 8.6237 117.9761 56.1507 44.0759 173.6378 50 Y 5.0318 8.9968 117.4443 56.3066 41.8568 174.5432 51 L 5.1980 9.0735 123.1371 52.7459 44.8670 175.4540 52 L 4.7313 8.4806 125.8323 54.8686 42.7719 176.2787 53 E 4.5658 9.6019 125.8754 56.4854 34.1427 175.3467 54 Q 3.6423 9.4355 122.8663 57.7985 26.1989 173.0327 55 N 4.2824 8.1652 106.0439 53.5363 36.9529 174.2874 56 E 4.7883 7.8318 112.7420 55.3384 33.7918 173.5588 57 L 5.0495 9.2631 121.5966 53.8567 43.6814 175.7295 58 I 5.0676 8.9507 124.6506 58.8971 40.1948 174.8511 59 L 3.3125 8.8118 129.0546 56.1312 42.3494 176.4489 60 G 4.4887 8.1287 113.4058 43.8521 0.0000 170.1492 61 P 4.5538 0.0000 0.0000 63.3905 32.2897 175.7535 62 F 4.8638 7.8086 117.0126 56.0267 41.2717 173.0272 63 Q 4.2180 10.0432 118.4384 53.2998 31.1920 176.3223 64 G 3.9228 8.0671 111.9240 45.6633 0.0000 171.5733 65 H 4.9665 8.5290 118.5457 53.5468 30.4630 173.0200 66 P 4.3852 0.0000 0.0000 63.5119 31.5098 175.5995 67 A 4.6801 8.1201 123.5292 49.7167 22.2216 175.3112 68 C 4.2890 8.2126 117.1771 60.1687 28.9511 174.5634 69 V 3.8790 8.5982 124.1889 65.6940 32.4273 175.1161 70 H 5.4022 8.1570 116.2259 54.1817 30.5938 174.4981 71 I 4.4633 8.9067 123.8749 58.7003 40.1885 173.4230 72 P 4.6907 0.0000 0.0000 62.0696 32.3256 176.9131 73 I 3.7041 8.3267 123.6216 62.6115 37.6390 177.9605 74 G 4.0486 8.6418 110.9312 45.6545 0.0000 173.5702 75 K 4.3116 7.7247 119.7989 55.7102 33.6469 177.6263 76 G 3.9860 8.6695 111.3745 45.0461 0.0000 174.2553 77 V 2.8312 7.6084 116.4855 65.8326 31.1803 177.7697 78 C 4.1012 7.7000 116.1975 62.6817 28.0585 176.1487 79 G 4.1167 7.7192 108.1692 47.6249 0.0000 175.7334 80 T 4.4926 8.4286 119.0787 65.5897 68.4990 176.8626 81 A 4.2128 7.7677 124.3652 54.6787 18.1512 180.1053 82 V 3.6192 7.4122 109.9703 64.2181 32.1199 178.0942 83 S 4.2733 8.1576 113.4550 61.2920 62.9457 176.0364 84 E 4.1660 8.4481 119.0624 56.2703 29.5684 176.7175 85 R 4.0197 7.9045 116.4837 56.9936 27.9288 176.0770 86 R 4.8382 7.5833 113.6237 54.3829 34.3780 174.7780 87 T 4.3287 8.4926 116.7911 64.0536 69.4763 173.7262 88 Q 4.6308 9.3094 124.8578 54.0984 31.6244 174.6919 89 V 4.6442 8.5833 124.2733 61.2738 33.5116 174.5764 90 V 4.3638 9.1842 129.6837 61.4174 32.5844 176.2654 91 A 4.1408 8.8172 130.2670 54.1601 20.2369 175.9387 92 D 4.7742 7.9494 114.4720 52.5141 42.6816 175.4862 93 V 3.6054 8.8978 128.6261 66.0464 31.6130 177.6234 94 H 4.5125 7.8107 115.2745 57.4233 28.5946 175.7849 95 Q 4.3445 8.1072 117.7453 55.6610 29.3915 175.3753 96 F 4.1283 7.9585 121.5535 56.8132 39.2633 174.7078 97 K 3.5736 8.2775 128.9511 58.1826 32.7830 176.2209 98 G 4.0548 8.7298 112.7650 46.5379 0.0000 172.9844 99 H 4.8011 7.8433 114.6449 54.5661 33.4341 172.0732 100 I 4.5576 7.9149 126.4076 58.8009 39.9653 175.2514 101 A 4.2156 8.5179 125.8901 53.1575 18.7623 177.0083 102 C 4.4551 8.4695 116.6241 59.7113 34.5975 173.6075 103 D 4.5682 7.7319 118.2629 51.8922 42.5422 175.1548 104 A 4.0818 8.8700 130.7054 55.4102 18.5828 178.1930 105 N 4.5373 7.9023 112.5170 55.9138 38.9831 176.0593 106 S 4.4365 8.0297 114.4791 58.9883 63.6067 173.4655 107 K 4.5492 9.4580 124.3247 57.1567 34.8531 176.1775 108 S 5.1895 7.6509 112.3576 56.7693 66.9336 172.3591 109 E 5.3390 8.9618 118.8164 55.5144 33.5711 173.6962 110 I 4.9055 8.1292 124.7894 59.0904 41.7202 174.0234 111 V 4.7819 8.9655 128.6986 61.0254 34.6863 174.0249 112 V 4.6881 8.4920 127.8158 60.3288 33.7576 173.0528 113 P 4.7538 0.0000 0.0000 62.6621 32.2999 175.6726 114 I 4.6958 8.5248 124.3259 59.7187 39.3768 174.8616 115 F 5.3885 9.6802 125.9042 55.8554 42.1678 175.5586 116 K 4.4027 9.0081 121.8262 56.4619 34.8881 175.9014 117 D 4.3114 9.5038 127.0936 55.8369 38.1152 174.1557 118 D 4.5308 8.5320 114.7106 54.6762 39.1497 173.9581 119 K 4.7685 7.7678 119.3289 54.1869 34.3868 175.7965 120 I 3.8263 8.3225 124.3780 61.2962 37.6479 175.9374 121 I 4.3626 8.9219 117.2433 59.6479 39.1269 175.5796 122 G 4.1515 6.9642 107.3968 46.5288 0.0000 171.3810 123 V 4.9722 7.8179 110.7327 59.9852 36.7802 173.7295 124 L 4.6287 9.0359 125.7574 53.7323 43.9142 174.6927 125 D 5.2732 9.0190 125.6672 52.5530 44.6749 174.2427 126 I 5.1778 8.5402 125.7507 59.9006 40.9176 174.0708 127 D 5.5678 9.7345 127.2237 52.7429 43.6642 175.4547 128 A 5.1704 8.7001 122.7018 49.4726 22.4835 175.0117 129 P 4.8694 0.0000 0.0000 62.4816 31.7452 175.8666 130 I 4.6898 7.1471 111.4150 59.1454 40.6340 174.9955 131 T 4.2171 8.2858 111.2415 61.9821 69.7299 173.2373 132 D 4.3647 8.8825 119.8103 55.3544 40.2921 175.1106 133 R 3.7681 7.6874 119.2276 58.1681 30.4398 176.1389 134 F 5.0714 7.8737 116.5757 55.9845 40.4671 175.3811 135 D 5.0352 8.6525 126.9286 51.9735 43.0643 176.5390 136 D 4.4039 8.5537 117.7058 57.5873 40.6516 178.3582 137 N 4.2580 8.2526 117.2149 56.7818 39.0287 176.4660 138 D 4.3358 8.7330 120.4792 57.1742 40.9815 178.5174 139 K 3.7820 8.0768 120.0689 59.5236 32.2111 178.1322 140 E 3.7964 8.1005 119.2566 59.9107 29.5420 178.6575 141 H 4.1775 7.6477 115.7875 58.4081 28.6375 177.8749 142 L 4.0117 7.9949 121.4732 57.6373 41.3821 179.2861 143 E 4.0016 8.2535 118.5427 59.2698 29.2430 179.1983 144 A 4.0473 7.8670 120.8067 55.1489 18.4353 179.8012 145 I 3.7743 7.9323 118.6313 64.4423 37.1362 178.8027 146 V 3.7499 7.9467 119.2091 65.8340 31.3242 178.2753 147 K 4.1882 8.1107 118.4272 59.1077 31.5960 179.4449 148 I 3.7530 7.2912 119.7219 64.3540 37.4204 178.1525 149 I 3.8615 7.7605 120.5542 64.4723 37.0750 178.2348 150 E 4.0330 8.6473 119.8280 59.5353 29.0569 179.6003 151 K 4.0135 7.9424 117.5186 59.4321 32.3973 178.8069 152 Q 4.2063 8.0932 117.0206 57.4620 28.6468 177.3407 153 L 4.4720 7.4947 117.7860 55.0795 42.2130 176.3807 154 A 4.1880 7.9562 126.2702 52.4317 18.3583 177.0935 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 T 8.17 4.30 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 4 I 7.43 4.26 1.84 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 1.35 0.69 0.85 0.00 0.00 5 N 9.65 4.49 0.00 2.70 2.73 0.00 0.00 7.08 8.18 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 6 P 0.00 4.24 0.00 2.01 2.00 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 7 T 8.16 4.21 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 0.23 0.00 0.00 8 N 7.99 4.62 0.00 2.72 2.63 0.00 0.00 7.22 7.56 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 9 Y 7.88 4.21 0.00 2.86 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 10 T 7.88 3.89 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 11 L 7.82 3.96 0.00 1.75 1.81 0.92 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 12 L 8.07 3.97 0.00 1.88 1.89 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.48 4.05 0.00 1.93 1.89 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.16 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.77 7.81 14 K 7.94 4.04 0.00 1.91 1.86 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.64 7.81 15 Q 8.42 4.05 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.60 0.00 16 A 8.36 3.96 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 17 A 8.08 3.96 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 18 S 7.81 4.20 0.00 4.01 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 19 L 8.04 4.16 0.00 1.89 1.80 0.92 1.31 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 20 I 7.28 4.36 1.83 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.54 0.89 0.00 0.00 21 E 7.17 4.10 0.00 2.21 1.89 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 2.32 2.28 0.00 22 D 8.81 4.69 0.00 2.89 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 23 E 7.56 4.69 0.00 2.03 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 2.39 2.37 0.00 24 H 8.35 4.96 0.00 3.05 3.26 0.00 5.94 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 H 8.13 4.36 0.00 3.24 3.19 0.00 5.89 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 M 8.52 3.86 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 27 I 7.39 3.58 1.88 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.76 0.90 0.00 0.00 28 A 8.15 3.97 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 29 I 7.85 3.60 1.97 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.70 0.81 0.00 0.00 30 L 7.98 3.37 0.00 1.54 1.32 0.42 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 31 S 8.19 4.06 0.00 3.92 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 N 8.21 4.34 0.00 2.88 2.85 0.00 0.00 7.12 7.28 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 33 M 8.42 4.19 0.00 2.21 2.23 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.79 0.00 34 S 8.47 4.20 0.00 4.00 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 0.00 35 A 7.75 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 36 L 7.81 3.88 0.00 1.65 1.74 0.92 0.97 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 37 L 8.10 4.16 0.00 1.90 1.72 0.96 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 38 N 8.07 4.33 0.00 2.78 2.95 0.00 0.00 7.32 8.09 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 39 D 8.20 4.62 0.00 2.67 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 40 N 7.92 4.91 0.00 2.76 2.72 0.00 0.00 6.81 7.83 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 41 L 7.81 4.58 0.00 1.71 1.66 1.07 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 42 D 8.49 4.58 0.00 2.58 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 43 Q 8.60 3.55 0.00 2.15 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.53 0.00 0.00 0.00 0.00 0.00 2.17 2.32 0.00 44 I 7.67 4.84 2.17 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 0.91 1.12 0.00 0.00 45 N 8.87 5.10 0.00 2.81 3.00 0.00 0.00 6.67 8.60 0.00 0.00 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 W 7.99 5.21 0.00 3.40 3.15 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 47 V 7.74 4.83 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 0.65 0.00 0.00 0.80 0.00 0.00 48 G 8.21 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.62 5.69 0.00 2.94 2.96 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 50 Y 9.00 5.03 0.00 3.02 2.86 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.07 5.20 0.00 1.61 1.56 0.96 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.48 4.73 0.00 1.67 1.58 0.96 0.70 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 53 E 9.60 4.57 0.00 2.00 1.80 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 2.24 2.30 0.00 54 Q 9.44 3.64 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 55 N 8.17 4.28 0.00 2.85 2.89 0.00 0.00 7.00 7.66 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 56 E 7.83 4.79 0.00 2.00 2.01 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 2.40 2.35 0.00 57 L 9.26 5.05 0.00 1.66 1.73 0.78 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 58 I 8.95 5.07 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.59 0.90 0.00 0.00 59 L 8.81 3.31 0.00 1.66 1.57 0.53 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.13 4.49 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 0.00 61 P 0.00 4.55 0.00 2.10 1.94 0.00 3.64 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 62 F 7.81 4.86 0.00 1.62 2.45 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 63 Q 10.04 4.22 0.00 1.73 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.92 0.00 0.00 0.00 0.00 0.00 2.11 2.41 0.00 64 G 8.07 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 65 H 8.53 4.97 0.00 3.30 3.37 0.00 5.94 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 66 P 0.00 4.39 0.00 2.13 2.16 0.00 3.78 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.29 0.00 67 A 8.12 4.68 0.80 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 0.00 0.00 68 C 8.21 4.29 0.00 2.90 2.86 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.60 3.88 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 0.87 0.00 0.00 0.96 0.00 0.00 70 H 8.16 5.40 0.00 3.05 3.43 0.00 5.89 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 I 8.91 4.46 1.65 0.00 0.00 -0.12 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 0.81 0.70 0.00 0.00 72 P 0.00 4.69 0.00 1.91 1.97 0.00 3.63 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 2.00 2.10 0.00 73 I 8.33 3.70 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.20 0.91 0.00 0.00 74 G 8.64 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 0.00 0.00 0.00 0.00 75 K 7.72 4.31 0.00 1.99 1.70 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.51 7.81 76 G 8.67 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 0.00 0.00 0.00 77 V 7.61 2.83 1.78 0.00 0.00 0.00 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 -0.12 0.00 0.00 78 C 7.70 4.10 0.00 2.67 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 79 G 7.72 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.43 4.49 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 1.36 0.00 0.00 81 A 7.77 4.21 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 82 V 7.41 3.62 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 0.79 0.00 0.00 0.98 0.00 0.00 83 S 8.16 4.27 0.00 4.03 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 84 E 8.45 4.17 0.00 2.25 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 0.00 2.35 2.30 0.00 85 R 7.90 4.02 0.00 2.08 2.26 0.00 3.17 0.00 0.00 3.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 86 R 7.58 4.84 0.00 1.85 1.79 0.00 3.16 0.00 0.00 3.36 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.97 0.00 87 T 8.49 4.33 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 1.26 0.00 0.00 88 Q 9.31 4.63 0.00 1.84 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.74 0.00 0.00 0.00 0.00 0.00 2.42 2.61 0.00 89 V 8.58 4.64 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 0.88 0.00 0.00 0.94 0.00 0.00 90 V 9.18 4.36 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 1.03 0.00 0.00 0.93 0.00 0.00 91 A 8.82 4.14 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 92 D 7.95 4.77 0.00 2.68 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 V 8.90 3.61 1.81 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 0.39 0.00 0.00 0.87 0.00 0.00 94 H 7.81 4.51 0.00 3.27 3.34 0.00 5.69 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 Q 8.11 4.34 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.93 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 96 F 7.96 4.13 0.00 3.00 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 97 K 8.28 3.57 0.00 1.53 1.39 0.00 1.83 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.33 1.47 7.81 98 G 8.73 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 0.00 0.00 0.00 0.00 99 H 7.84 4.80 0.00 3.31 3.43 0.00 5.68 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 7.91 4.56 1.82 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.77 0.90 0.00 0.00 101 A 8.52 4.22 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.47 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 0.00 103 D 7.73 4.57 0.00 2.60 2.37 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 0.00 104 A 8.87 4.08 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 0.00 105 N 7.90 4.54 0.00 3.10 2.90 0.00 0.00 6.90 7.63 0.00 0.00 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 S 8.03 4.44 0.00 3.86 3.80 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 0.00 107 K 9.46 4.55 0.00 1.72 1.80 0.00 1.68 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.57 7.81 108 S 7.65 5.19 0.00 4.08 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 0.00 109 E 8.96 5.34 0.00 2.01 1.70 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 2.07 2.45 0.00 110 I 8.13 4.91 1.24 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.32 -0.33 0.00 0.00 111 V 8.97 4.78 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 0.74 0.00 0.00 0.85 0.00 0.00 112 V 8.49 4.69 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 0.98 0.00 0.00 0.87 0.00 0.00 113 P 0.00 4.75 0.00 1.95 1.71 0.00 3.78 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 114 I 8.52 4.70 1.87 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.04 0.95 0.00 0.00 115 F 9.68 5.39 0.00 2.81 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 0.00 116 K 9.01 4.40 0.00 1.78 1.64 0.00 1.84 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.44 7.81 117 D 9.50 4.31 0.00 2.90 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 0.00 118 D 8.53 4.53 0.00 2.87 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 0.00 119 K 7.77 4.77 0.00 1.98 1.72 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.62 7.81 120 I 8.32 3.83 1.74 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.27 0.75 0.00 0.00 121 I 8.92 4.36 1.85 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.87 0.95 0.00 0.00 122 G 6.96 4.15 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 0.00 123 V 7.82 4.97 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 0.77 0.00 0.00 1.02 0.00 0.00 124 L 9.04 4.63 0.00 1.72 1.63 0.47 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 125 D 9.02 5.27 0.00 2.90 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 I 8.54 5.18 1.59 0.00 0.00 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 1.18 0.52 1.24 0.00 0.00 127 D 9.73 5.57 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.70 5.17 1.11 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 0.00 0.00 129 P 0.00 4.87 0.00 2.21 2.19 0.00 3.51 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 130 I 7.15 4.69 1.84 0.00 0.00 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 1.39 0.65 0.89 0.00 0.00 131 T 8.29 4.22 4.36 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 1.23 0.00 0.00 132 D 8.88 4.36 0.00 2.72 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 0.00 133 R 7.69 3.77 0.00 1.45 1.41 0.00 3.03 0.00 0.00 3.02 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.50 0.00 134 F 7.87 5.07 0.00 3.13 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 0.00 135 D 8.65 5.04 0.00 3.01 2.86 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.55 4.40 0.00 2.72 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 0.00 137 N 8.25 4.26 0.00 2.89 3.09 0.00 0.00 7.24 8.49 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 0.00 138 D 8.73 4.34 0.00 3.10 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.08 3.78 0.00 1.84 2.01 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.44 7.81 140 E 8.10 3.80 0.00 1.96 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 1.97 2.22 0.00 141 H 7.65 4.18 0.00 1.84 2.66 0.00 5.87 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 L 7.99 4.01 0.00 1.65 1.67 0.89 1.05 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 0.00 143 E 8.25 4.00 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 2.33 2.63 0.00 144 A 7.87 4.05 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 0.00 145 I 7.93 3.77 2.09 0.00 0.00 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 1.49 1.14 1.00 0.00 0.00 146 V 7.95 3.75 2.31 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 1.26 0.00 0.00 1.03 0.00 0.00 147 K 8.11 4.19 0.00 2.06 1.86 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.70 7.81 148 I 7.29 3.75 2.12 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 1.55 0.71 0.93 0.00 0.00 149 I 7.76 3.86 2.10 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.12 0.86 0.00 0.00 150 E 8.65 4.03 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.72 0.00 151 K 7.94 4.01 0.00 1.86 1.90 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.72 1.65 7.81 152 Q 8.09 4.21 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.71 0.00 0.00 0.00 0.00 0.00 2.50 2.59 0.00 153 L 7.49 4.47 0.00 1.77 1.71 0.88 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 154 A 7.96 4.19 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