NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 462 M 4.6165 8.2516 117.5923 55.0885 32.7570 174.1165 463 R 4.4300 8.4257 121.7920 54.6947 32.5075 173.0099 464 M 5.1167 9.3918 127.0210 53.8844 35.7975 175.0123 465 L 4.5590 8.1725 122.4342 53.8490 45.3677 174.8715 466 V 4.8350 8.6253 126.8224 61.1079 34.4221 174.3347 467 A 5.3426 8.7180 127.7526 49.2345 22.1070 174.4337 468 D 4.8719 8.4751 120.9797 53.0779 43.8298 175.0916 469 D 4.4742 8.8264 124.1223 55.9782 39.9565 176.6431 470 H 4.5309 8.9186 118.1537 54.8467 29.4949 176.2788 471 E 3.7641 8.7868 121.0048 59.1515 30.0391 179.0246 472 A 4.1433 7.9954 121.1327 54.8022 17.9412 179.1942 473 N 4.4209 8.0882 114.8014 56.4265 38.3540 177.7257 474 R 3.9691 7.6001 119.2851 59.4131 29.7825 179.0159 475 M 4.1091 7.5956 118.6795 58.3239 32.1956 179.2213 476 V 3.7601 7.4891 111.2280 64.1781 31.2954 178.5923 477 L 4.1414 7.6728 118.0283 57.4770 41.2698 179.1197 478 Q 4.0012 7.6374 118.5382 58.9538 29.0262 177.9759 479 R 4.1111 7.4895 117.6619 58.7599 30.2340 178.4051 480 L 4.1890 7.4360 117.5178 59.4958 41.2394 178.2164 481 L 4.5949 7.5367 123.0474 53.1016 44.0771 176.3072 *487 K 4.1042 8.2244 124.6975 57.4212 33.5193 175.9522 488 V 4.9331 8.3151 126.5808 61.0748 34.8446 173.8563 489 L 4.8249 8.6061 128.7340 53.4417 44.7128 174.5246 490 C 5.4506 8.7051 123.1924 58.0381 30.7816 173.4286 491 V 4.2965 8.2584 120.9608 60.2631 34.6373 175.3840 492 N 4.4889 9.0957 118.5796 55.2880 39.3231 177.4483 493 G 4.0037 7.7622 104.9285 43.5883 0.0000 173.8092 494 A 4.1188 8.2962 119.5961 54.7698 18.4649 179.6348 495 E 3.9811 8.0829 116.8599 59.5292 29.4296 179.3137 496 Q 4.1927 7.9699 118.1094 58.7069 29.0706 178.6777 497 V 3.7089 7.4242 119.3760 64.5529 31.0343 178.5101 498 L 4.0539 7.6444 119.0302 57.5562 40.9442 179.0688 499 D 4.4148 7.9531 118.4633 57.2420 40.7847 178.6280 500 A 3.8840 8.4018 121.7535 55.3946 18.1484 179.5884 501 M 4.4139 7.9270 115.8576 58.2034 32.0922 178.4984 502 A 4.1380 7.5862 119.3398 54.3797 18.5309 178.8143 503 E 4.1687 7.5997 116.7081 57.5900 30.4002 176.1722 504 E 4.5714 7.3664 116.0209 54.6072 31.9454 174.8966 505 D 4.8887 7.9607 119.9347 53.0027 42.6670 175.9235 506 Y 4.8449 8.0544 119.3403 56.2088 42.1078 175.3834 507 D 4.6831 9.0304 122.7137 57.3492 41.9412 176.3126 508 A 4.8957 7.8253 117.3840 50.6702 23.0687 175.1649 509 V 4.4682 8.5047 119.7845 61.0809 34.5465 174.3447 510 I 4.9902 8.5748 129.0282 59.5760 39.3017 175.0765 511 V 4.7974 8.4391 126.0120 59.7801 34.9564 174.1799 512 D 4.7819 8.3475 122.8030 54.0571 41.6682 175.9330 513 L 3.9487 9.0235 129.0937 58.4610 43.0443 176.7849 514 H 4.9679 8.0958 120.6624 54.6807 27.8908 174.2384 515 M 4.8664 8.0253 122.8057 52.2801 35.5802 174.3293 516 P 4.3660 0.0000 0.0000 63.6538 33.6865 177.5075 517 G 3.6700 9.2454 113.3241 46.6048 0.0000 174.8523 518 M 4.3143 9.1062 116.1364 54.1609 34.2790 174.8512 519 N 4.9421 8.4682 124.6664 51.3923 41.1325 175.9961 520 G 3.6069 8.7007 106.6957 47.8796 0.0000 175.7165 521 L 3.9977 7.9062 122.0637 58.1029 42.4127 178.5131 522 D 4.3737 9.1703 119.3054 57.5920 40.6479 178.5431 523 M 4.0202 8.1402 118.6780 58.3977 32.1996 178.0145 524 L 3.9313 7.9194 120.4701 58.1519 42.3927 179.0990 525 K 3.9592 8.4037 118.8241 59.6365 31.8819 179.2082 526 Q 4.0150 8.0477 119.4843 58.8817 28.8376 177.9265 527 L 3.9817 8.3189 122.0905 57.7761 42.0964 178.7257 528 R 3.9298 8.2172 119.1717 59.5575 30.0819 178.9582 529 V 3.6997 7.7130 118.3469 64.9509 31.3530 178.2943 530 M 4.0760 7.8232 119.2725 58.4506 31.4905 178.7792 531 Q 4.3578 8.7259 119.5342 58.2601 28.6778 178.3184 532 A 4.1560 7.9485 120.4641 54.2018 18.6013 178.9390 533 S 4.4183 7.9158 111.8750 59.1663 63.2754 173.6612 534 G 3.4567 7.4803 112.3381 45.4673 0.0000 174.3158 535 M 4.0642 7.8255 121.2920 55.2666 32.7400 175.4993 536 R 4.0431 8.4502 125.4509 56.4443 30.8543 175.4602 537 Y 4.2701 8.5693 126.2373 57.6977 39.4831 174.7453 538 T 4.5090 7.4169 116.4104 58.8118 71.5892 171.8577 539 P 4.2109 0.0000 0.0000 62.6344 33.2271 175.1460 540 V 4.9228 8.3192 121.8105 61.1039 34.5330 174.0830 541 V 4.7467 8.5657 127.8771 60.1296 33.7242 174.8836 542 V 4.7359 8.1499 123.9557 61.0823 33.9680 174.1676 543 L 5.3000 8.6043 126.5836 52.0856 44.8665 175.6340 544 S 4.8259 8.0516 115.5076 57.3362 65.6527 175.3765 545 A 4.0555 8.7427 124.5444 54.9047 18.6400 178.1458 546 D 4.5842 8.1330 116.3431 54.3547 41.2936 176.4273 547 V 4.2915 8.3107 122.5246 61.3854 32.2031 176.0762 548 T 3.8864 7.8454 118.5710 63.7804 68.6830 173.2943 549 P 4.2473 0.0000 0.0000 65.5439 31.3457 178.4079 550 E 3.9889 8.1311 116.9578 58.8436 29.3960 178.5295 551 A 4.2097 7.7879 121.4129 54.5197 18.8308 179.6438 552 I 2.6608 7.2471 117.9000 64.2857 37.3221 178.6342 553 R 4.1100 7.8424 119.8190 58.7091 29.4465 179.0535 554 A 4.0465 7.6330 119.1398 55.1244 18.2678 179.6286 555 C 4.2117 7.8515 115.3860 62.9823 28.4495 176.1264 556 E 4.3899 7.9956 119.8020 58.6568 29.0153 178.6232 557 Q 4.1478 7.9183 116.9812 57.4352 29.0072 177.0443 558 A 4.4773 8.2312 119.6084 52.2940 19.4140 176.3981 559 G 3.2996 6.9895 106.0435 44.7845 0.0000 173.9850 560 A 4.1830 8.3463 125.9614 52.3627 18.8550 178.6663 561 R 4.5881 8.4133 120.3708 57.2349 31.6545 176.5206 562 A 4.8591 7.8093 118.9222 50.4388 23.2423 174.9902 563 F 4.8966 8.6786 121.1035 56.8320 42.2618 173.6957 564 L 5.0118 8.5308 125.5370 52.7025 45.1276 176.2151 565 A 4.6712 8.6225 123.6733 51.8670 20.1003 176.1765 566 K 4.7631 8.2827 119.2477 53.9112 34.3764 174.9481 567 P 4.4056 0.0000 0.0000 62.0426 32.0761 176.5782 568 V 4.0205 8.0369 121.9878 60.3885 32.4555 176.5663 569 V 3.7542 8.2557 122.5707 62.4158 32.9832 176.6667 570 A 3.9719 8.6866 127.8405 55.3724 18.2354 179.4872 571 A 3.9633 7.9379 118.6887 55.3116 18.4645 179.8088 572 K 4.0049 7.9781 116.2785 58.8871 32.2190 179.3446 573 L 4.0317 7.5768 122.5695 57.6274 42.1854 178.9843 574 L 4.0549 7.8540 118.6916 57.7970 41.3548 179.2593 575 D 4.4269 7.9570 119.4948 57.3699 40.2540 178.8205 576 T 4.2788 7.7394 111.3660 64.0194 68.9939 176.8475 577 L 4.0672 8.0676 121.8349 57.3993 41.7539 179.0704 578 A 4.1624 7.9107 120.2773 54.8534 17.7490 179.3907 579 D 4.4522 7.8529 117.8375 57.4550 40.6281 178.8010 580 L 4.1442 7.5870 117.4898 56.4988 41.6512 176.9839 581 A 4.3627 7.4669 124.6543 52.1052 19.1798 175.9746 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 462 M 8.25 4.62 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 463 R 8.43 4.43 0.00 1.97 1.86 0.00 3.07 0.00 0.00 3.09 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 464 M 9.39 5.12 0.00 1.92 2.06 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 2.54 2.62 0.00 465 L 8.17 4.56 0.00 0.54 0.95 0.65 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 466 V 8.63 4.84 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 0.84 0.00 0.00 0.88 0.00 0.00 467 A 8.72 5.34 1.13 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 0.00 0.00 468 D 8.48 4.87 0.00 2.63 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 469 D 8.83 4.47 0.00 2.77 2.75 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 0.00 470 H 8.92 4.53 0.00 3.42 3.24 0.00 5.61 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 471 E 8.79 3.76 0.00 2.15 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 2.38 2.32 0.00 472 A 8.00 4.14 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 0.00 473 N 8.09 4.42 0.00 2.83 2.86 0.00 0.00 7.18 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 0.00 474 R 7.60 3.97 0.00 1.81 1.96 0.00 3.10 0.00 0.00 3.30 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.86 0.00 475 M 7.60 4.11 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.57 0.00 476 V 7.49 3.76 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 0.90 0.00 0.00 1.03 0.00 0.00 477 L 7.67 4.14 0.00 1.70 1.68 0.93 0.67 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 0.00 478 Q 7.64 4.00 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.99 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 479 R 7.49 4.11 0.00 1.86 1.97 0.00 3.21 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 480 L 7.44 4.19 0.00 1.88 1.79 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 481 L 7.54 4.59 0.00 1.77 1.58 0.94 0.75 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 *487 K 8.22 4.10 0.00 1.93 1.96 0.00 1.56 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.43 1.56 7.81 488 V 8.32 4.93 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 0.82 0.00 0.00 0.93 0.00 0.00 489 L 8.61 4.82 0.00 1.90 1.45 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 490 C 8.71 5.45 0.00 2.84 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 0.00 491 V 8.26 4.30 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 0.69 0.00 0.00 0.91 0.00 0.00 492 N 9.10 4.49 0.00 2.72 2.82 0.00 0.00 6.86 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 0.00 493 G 7.76 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 494 A 8.30 4.12 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 0.00 495 E 8.08 3.98 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 2.39 2.39 0.00 496 Q 7.97 4.19 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 497 V 7.42 3.71 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 0.76 0.00 0.00 0.81 0.00 0.00 498 L 7.64 4.05 0.00 1.91 1.75 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 499 D 7.95 4.41 0.00 2.89 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 0.00 500 A 8.40 3.88 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 0.00 501 M 7.93 4.41 0.00 2.09 2.24 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 2.68 2.63 0.00 502 A 7.59 4.14 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 0.00 503 E 7.60 4.17 0.00 1.89 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 2.29 2.49 0.00 504 E 7.37 4.57 0.00 1.91 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 2.24 2.39 0.00 505 D 7.96 4.89 0.00 2.52 2.50 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 0.00 506 Y 8.05 4.84 0.00 2.88 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 0.00 507 D 9.03 4.68 0.00 2.88 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 0.00 508 A 7.83 4.90 1.19 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 0.00 0.00 509 V 8.50 4.47 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 0.93 0.00 0.00 0.80 0.00 0.00 510 I 8.57 4.99 1.81 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.47 0.85 0.00 0.00 511 V 8.44 4.80 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 0.62 0.00 0.00 0.88 0.00 0.00 512 D 8.35 4.78 0.00 2.80 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 513 L 9.02 3.95 0.00 1.67 1.52 0.92 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 514 H 8.10 4.97 0.00 3.17 3.28 0.00 5.89 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 515 M 8.03 4.87 0.00 1.93 2.02 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 2.62 2.69 0.00 516 P 0.00 4.37 0.00 2.02 1.98 0.00 3.73 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 517 G 9.25 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 0.00 518 M 9.11 4.31 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 519 N 8.47 4.94 0.00 3.12 2.96 0.00 0.00 6.49 7.75 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 0.00 520 G 8.70 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 521 L 7.91 4.00 0.00 1.79 1.84 0.95 1.29 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 0.00 522 D 9.17 4.37 0.00 2.81 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 0.00 523 M 8.14 4.02 0.00 2.21 2.09 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 2.72 2.52 0.00 524 L 7.92 3.93 0.00 2.14 1.78 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 525 K 8.40 3.96 0.00 1.82 1.85 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.63 7.81 526 Q 8.05 4.01 0.00 2.32 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 527 L 8.32 3.98 0.00 1.98 1.74 0.88 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 528 R 8.22 3.93 0.00 2.22 2.15 0.00 3.24 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 1.72 0.00 529 V 7.71 3.70 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 0.85 0.00 0.00 0.94 0.00 0.00 530 M 7.82 4.08 0.00 2.05 2.31 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.59 0.00 531 Q 8.73 4.36 0.00 2.31 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 532 A 7.95 4.16 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 0.00 533 S 7.92 4.42 0.00 4.06 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 0.00 534 G 7.48 3.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 535 M 7.83 4.06 0.00 2.09 1.99 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 2.62 2.51 0.00 536 R 8.45 4.04 0.00 1.83 1.85 0.00 3.52 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 537 Y 8.57 4.27 0.00 2.95 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 0.00 538 T 7.42 4.51 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 1.26 0.00 0.00 539 P 0.00 4.21 0.00 2.14 2.31 0.00 3.66 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.01 0.00 540 V 8.32 4.92 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 1.03 0.00 0.00 0.84 0.00 0.00 541 V 8.57 4.75 2.06 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 0.67 0.00 0.00 0.88 0.00 0.00 542 V 8.15 4.74 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 0.73 0.00 0.00 0.92 0.00 0.00 543 L 8.60 5.30 0.00 1.48 1.40 0.86 0.73 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 0.00 544 S 8.05 4.83 0.00 3.92 3.82 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 0.00 545 A 8.74 4.06 1.31 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 0.00 0.00 0.00 546 D 8.13 4.58 0.00 2.84 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 0.00 547 V 8.31 4.29 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 0.76 0.00 0.00 0.97 0.00 0.00 548 T 7.85 3.89 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 1.21 0.00 0.00 549 P 0.00 4.25 0.00 2.21 2.26 0.00 3.67 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.00 0.00 550 E 8.13 3.99 0.00 2.20 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 2.34 2.37 0.00 551 A 7.79 4.21 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 0.00 552 I 7.25 2.66 1.51 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 0.19 0.52 0.36 0.00 0.00 553 R 7.84 4.11 0.00 1.75 1.94 0.00 3.09 0.00 0.00 3.38 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.43 0.00 554 A 7.63 4.05 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 0.00 555 C 7.85 4.21 0.00 3.30 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 0.00 556 E 8.00 4.39 0.00 2.24 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 0.00 2.56 2.20 0.00 557 Q 7.92 4.15 0.00 2.13 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.91 0.00 0.00 0.00 0.00 0.00 2.62 2.51 0.00 558 A 8.23 4.48 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 0.00 559 G 6.99 3.30 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 0.00 560 A 8.35 4.18 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 0.00 561 R 8.41 4.59 0.00 1.81 2.06 0.00 3.37 0.00 0.00 3.40 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 562 A 7.81 4.86 1.22 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 0.00 0.00 0.00 563 F 8.68 4.90 0.00 3.01 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 0.00 564 L 8.53 5.01 0.00 1.52 1.46 0.90 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 565 A 8.62 4.67 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 0.00 566 K 8.28 4.76 0.00 1.72 1.69 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.39 7.81 567 P 0.00 4.41 0.00 2.03 1.96 0.00 3.67 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 2.01 2.05 0.00 568 V 8.04 4.02 2.12 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 0.83 0.00 0.00 0.91 0.00 0.00 569 V 8.26 3.75 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 1.04 0.00 0.00 0.93 0.00 0.00 570 A 8.69 3.97 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 0.00 571 A 7.94 3.96 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 0.00 572 K 7.98 4.00 0.00 1.82 1.87 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.49 7.81 573 L 7.58 4.03 0.00 1.69 1.83 0.90 0.64 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 0.00 574 L 7.85 4.05 0.00 1.77 1.70 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 575 D 7.96 4.43 0.00 2.72 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 0.00 576 T 7.74 4.28 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 1.27 0.00 0.00 577 L 8.07 4.07 0.00 1.91 1.76 0.94 0.86 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 0.00 578 A 7.91 4.16 1.42 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 0.00 0.00 0.00 579 D 7.85 4.45 0.00 2.87 2.75 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 0.00 580 L 7.59 4.14 0.00 1.76 1.78 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 581 A 7.47 4.36 1.25 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 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.