NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 439 N 4.6693 8.4249 119.2068 53.2443 38.8598 172.7396 440 K 4.5589 7.9084 122.4687 53.1267 36.2277 174.6100 441 Q 4.2149 8.4644 118.9743 55.5280 30.1597 175.9652 442 F 4.2656 8.6253 123.4422 58.4392 40.0760 174.1917 443 H 4.6421 8.2944 125.9988 54.5634 29.6868 175.2980 444 T 4.3998 8.3606 114.4184 61.2676 70.3768 175.1111 445 G 3.9500 8.7743 109.7373 45.2295 0.0000 173.7937 446 I 3.8758 7.2804 120.8039 60.9530 37.6899 175.2749 447 E 4.5564 8.5010 123.7136 54.8713 32.3457 175.6546 448 I 4.3613 8.3755 126.5279 60.0404 36.3811 176.3128 449 K 4.2272 9.1537 125.6194 57.1988 32.9872 177.2342 450 V 4.4985 7.9918 119.3676 60.9621 33.3228 174.5494 451 W 5.7645 8.3026 123.7633 55.1634 32.0734 173.3256 452 A 4.9428 9.2187 121.3569 50.2179 22.6029 174.8676 453 I 5.0018 8.7335 120.7627 59.5157 40.0414 174.7065 454 A 4.8639 9.2758 129.3333 50.4747 21.3384 174.8426 455 C 4.5297 8.7350 124.3648 59.0218 32.2548 173.8493 456 F 5.3979 9.4413 124.6068 57.0363 39.1297 176.4126 457 A 4.4704 7.9862 122.0882 50.5274 19.6720 176.2446 458 P 4.3477 0.0000 0.0000 62.5114 32.5303 177.7855 459 Q 3.8615 8.6554 124.2640 58.4726 28.6042 178.7985 460 R 3.9999 7.8132 115.3029 58.3370 29.6755 177.6759 461 Q 4.5733 7.8276 117.3389 55.8299 30.6690 174.6733 462 C 4.5644 8.2717 121.4351 57.1716 31.7489 173.2771 463 T 4.6138 8.0865 118.4169 59.5917 71.2849 175.0027 464 E 4.0890 8.8392 120.4156 59.8225 29.2840 180.1474 465 V 3.6793 7.7751 118.5070 64.8725 31.5100 178.0018 466 H 4.2062 7.9625 116.8716 58.7752 28.6226 177.5527 467 L 4.1351 8.1356 120.6268 57.9620 41.4725 179.8725 468 K 4.0580 8.3326 118.3618 59.4224 31.9866 179.4589 469 S 4.1030 8.4848 113.7174 61.3988 62.3981 175.7980 470 F 4.2417 8.5906 123.5956 61.7856 39.0223 177.2698 471 T 3.7084 8.2494 115.2444 66.5115 68.3938 176.2980 472 E 3.9462 8.3470 121.2810 59.4859 29.7349 178.9622 473 Q 3.9783 8.1804 118.0887 58.7285 28.7450 178.4486 474 L 3.7448 7.7083 121.4887 57.8141 42.0251 178.7862 475 R 3.9385 8.1782 119.1332 59.5331 30.0032 178.7145 476 K 3.9343 7.8049 117.5407 59.5039 32.1163 179.3404 477 I 3.7250 7.5861 118.7407 63.9389 37.6678 178.0849 478 S 4.1417 7.8687 114.4927 61.1788 63.0955 176.1708 479 R 4.0048 7.9426 122.3062 59.5141 29.6811 178.2729 480 D 4.3380 7.9521 116.8129 57.1821 40.8637 178.1831 481 A 4.1106 7.8653 119.5879 51.9593 19.9586 176.1380 482 G 3.4477 7.6680 106.0604 44.7774 0.0000 170.1083 *484 P 4.1348 0.0000 0.0000 63.0490 33.4712 176.4372 485 I 4.6900 8.2004 126.1094 59.1632 38.0911 175.9260 486 Q 4.1691 8.8680 126.4784 56.1653 28.5744 177.3995 487 G 3.6841 9.0191 110.1785 47.7921 0.0000 173.1401 488 Q 4.3554 7.9238 120.9882 53.2636 29.2638 173.2309 489 P 3.3432 0.0000 0.0000 62.0425 31.9262 176.9458 490 C 3.8765 8.0471 115.3261 60.4664 30.2496 173.4939 491 F 4.5285 7.2783 121.2262 57.2803 43.0325 172.7179 492 C 4.7659 7.6874 126.5242 58.3511 33.3024 172.6900 493 K 4.4707 8.2336 124.6912 54.7310 36.4793 175.5130 494 Y 4.8366 8.4527 119.0374 57.5856 39.6500 174.6043 495 A 4.6618 8.5349 122.1474 51.1107 23.4462 175.4149 496 Q 4.7341 8.0559 116.0671 55.2431 32.3509 176.3928 497 G 4.1425 9.1547 108.4758 46.0009 0.0000 173.9573 498 A 3.8716 8.5722 122.8143 55.2084 18.1125 179.8748 499 D 4.4612 8.0538 115.5577 56.5569 41.0174 178.0537 500 S 4.4297 7.9882 113.7756 59.7868 63.4408 176.2645 501 V 3.5966 7.5295 122.1886 65.9903 31.4987 177.0505 502 E 4.0389 7.9161 118.3501 58.7452 29.5452 177.6246 503 P 4.4935 0.0000 0.0000 63.4950 31.3968 177.9313 *505 F 4.8979 8.1324 119.6516 57.8368 41.0272 177.6888 506 R 3.9669 8.4628 119.7597 59.4644 29.7102 178.5153 507 H 4.1326 8.3374 118.0286 59.1838 29.8758 177.2053 508 L 4.0250 7.8447 120.2148 57.8389 41.3003 179.3435 509 K 3.9687 7.9485 118.0615 59.3876 32.2394 177.9128 510 N 4.5636 8.1597 114.3923 54.5470 38.7044 175.6140 511 T 4.0064 7.0973 114.5316 64.1405 70.5081 173.7078 512 Y 4.4128 7.5826 120.9732 55.5778 37.9054 174.8278 513 A 3.9840 8.2901 128.0418 53.2873 19.0547 177.6763 514 G 3.8867 8.8929 109.3688 45.4924 0.0000 173.3727 515 L 3.9848 7.4839 121.5673 55.7348 42.2424 176.6566 516 Q 4.5596 8.8481 124.8032 56.8116 30.8306 175.8421 517 L 4.5830 7.6199 118.5805 53.9186 45.8830 173.6614 518 V 4.7785 8.5053 125.9841 61.1404 33.9533 174.2924 519 V 4.5831 9.3359 129.1962 62.1291 33.0567 174.5906 520 V 4.9873 9.0342 128.7850 61.3619 33.8284 174.2954 521 I 4.6769 8.6801 130.0707 60.6150 38.2853 174.9204 522 L 5.1162 8.7173 127.8947 52.2674 43.8367 175.8974 523 P 4.3954 0.0000 0.0000 61.6023 29.2878 177.9405 524 G 3.7655 8.7514 117.5516 46.6733 0.0000 171.1624 525 K 4.2431 8.5296 122.6656 55.9732 32.9559 176.1026 526 T 4.5727 7.9527 116.2822 59.2753 70.1054 172.3060 527 P 4.4351 0.0000 0.0000 64.4087 31.2316 178.8780 528 V 3.3734 8.0172 118.6124 65.9286 31.2857 177.1007 529 Y 3.9257 7.7739 119.0362 60.7779 38.7092 177.9841 530 A 3.9123 8.1162 121.0893 55.1992 18.3841 179.0730 531 E 3.7952 7.8816 117.7876 59.1166 29.5991 179.0010 532 V 3.3524 7.7546 118.6854 65.9817 31.4658 178.2567 533 K 3.8546 7.6684 118.0922 59.1513 31.9399 179.3221 534 R 3.8092 7.8619 118.9939 59.4650 30.0054 178.8397 535 V 3.6905 7.9659 118.2156 65.8435 31.4250 178.2814 536 G 3.6289 8.4800 105.7023 48.1837 0.0000 175.4409 537 D 4.4851 8.1824 120.3797 55.7523 41.4459 177.4943 538 T 4.3913 7.8750 113.5785 64.9037 70.5623 175.7484 539 V 3.8331 7.8056 119.4161 65.0543 31.6828 176.6313 540 L 4.3915 7.9875 116.4019 53.0917 43.3436 173.8856 541 G 3.5437 7.6775 112.4522 44.8898 0.0000 172.7157 *543 A 4.2695 8.0933 126.9133 51.4577 20.1467 175.2275 544 T 5.1459 8.4626 111.5214 59.8988 72.4442 173.1812 545 Q 4.5514 9.0407 124.3207 54.7564 32.0166 173.9397 546 C 5.3072 8.9720 124.3087 59.2218 29.8672 173.4643 547 V 4.5368 8.7573 120.6393 59.9538 34.6605 175.3710 548 Q 4.6441 8.5311 127.7635 55.9541 28.5102 178.2561 *550 K 4.4914 8.4984 118.2418 57.9361 34.4167 177.4074 551 N 4.7868 7.9087 114.7438 54.1382 39.0686 176.2883 552 V 3.5564 7.5321 117.5570 65.2302 32.0131 177.0113 553 Q 4.0535 8.1585 118.3552 58.3203 28.6620 176.2951 554 R 4.7139 7.8313 117.5544 54.4508 32.2740 175.3504 555 T 4.6284 8.4409 113.4316 61.0845 70.5068 174.5438 556 T 4.7684 8.2020 111.6619 58.5914 73.2178 173.0573 557 P 4.2187 0.0000 0.0000 65.9971 31.3529 178.7393 558 Q 3.9733 8.0414 117.9167 59.4660 29.1858 178.2979 559 T 3.9777 8.0107 110.8043 64.6176 68.7661 176.7225 560 L 4.0536 8.2149 122.1456 57.5738 41.6509 179.1973 561 S 4.0758 8.4501 113.5349 61.4432 62.3937 175.7994 562 N 4.3223 8.3053 119.1785 56.3857 38.2437 177.1343 563 L 3.9788 7.8303 120.9519 58.3653 42.2560 178.6119 564 C 4.0561 8.2657 116.8194 62.9830 28.1020 176.2462 565 L 4.1053 8.1173 120.3899 57.6130 41.1750 179.6924 566 K 3.9826 8.0077 118.2712 59.6220 32.0219 179.4437 567 I 3.6773 7.9671 120.1904 64.2991 37.1105 177.9574 568 N 4.1352 8.6113 118.2962 56.5728 38.5087 177.0489 569 V 3.5976 7.5914 118.4042 65.9965 31.7325 177.8538 570 K 4.0967 7.8115 116.8269 59.1276 32.0615 178.6361 571 L 4.4659 7.8219 116.2762 55.3200 42.0942 178.7662 572 G 3.6169 7.7970 105.9005 46.6091 0.0000 174.8150 573 G 3.9857 7.6267 108.0458 45.1064 0.0000 173.5766 574 V 3.8868 7.6558 125.0625 62.4996 31.6146 175.1802 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 439 N 8.42 4.67 0.00 2.71 2.84 0.00 0.00 6.79 5.80 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 0.00 440 K 7.91 4.56 0.00 1.80 1.67 0.00 1.81 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.53 7.81 441 Q 8.46 4.21 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 442 F 8.63 4.27 0.00 2.95 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 0.00 443 H 8.29 4.64 0.00 2.96 3.04 0.00 5.70 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 444 T 8.36 4.40 4.34 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 1.40 0.00 0.00 445 G 8.77 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 0.00 0.00 0.00 446 I 7.28 3.88 1.78 0.00 0.00 0.69 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 0.46 0.84 0.00 0.00 447 E 8.50 4.56 0.00 1.89 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 2.20 2.30 0.00 448 I 8.38 4.36 1.67 0.00 0.00 0.69 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 0.56 0.81 0.00 0.00 449 K 9.15 4.23 0.00 1.79 1.91 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.39 7.81 450 V 7.99 4.50 2.33 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 1.10 0.00 0.00 0.98 0.00 0.00 451 W 8.30 5.76 0.00 3.58 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 0.00 452 A 9.22 4.94 1.09 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 0.00 0.00 453 I 8.73 5.00 1.79 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 1.49 1.03 0.92 0.00 0.00 454 A 9.28 4.86 1.54 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 0.00 0.00 455 C 8.73 4.53 0.00 2.68 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 456 F 9.44 5.40 0.00 3.18 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 0.00 457 A 7.99 4.47 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 0.00 458 P 0.00 4.35 0.00 2.16 1.97 0.00 3.74 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.17 0.00 459 Q 8.66 3.86 0.00 0.93 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.92 0.00 0.00 0.00 0.00 0.00 2.16 1.89 0.00 460 R 7.81 4.00 0.00 1.97 1.99 0.00 3.05 0.00 0.00 3.19 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 461 Q 7.83 4.57 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 7.12 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 462 C 8.27 4.56 0.00 2.92 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 463 T 8.09 4.61 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 464 E 8.84 4.09 0.00 2.05 2.11 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 2.53 2.39 0.00 465 V 7.78 3.68 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 0.85 0.00 0.00 0.93 0.00 0.00 466 H 7.96 4.21 0.00 3.49 3.43 0.00 5.82 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 0.00 467 L 8.14 4.14 0.00 1.91 1.78 0.69 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 468 K 8.33 4.06 0.00 1.94 1.89 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.61 7.81 469 S 8.48 4.10 0.00 3.96 4.07 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 0.00 0.00 0.00 470 F 8.59 4.24 0.00 3.37 3.38 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 0.00 471 T 8.25 3.71 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 1.52 0.00 0.00 472 E 8.35 3.95 0.00 2.10 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 0.00 2.32 2.40 0.00 473 Q 8.18 3.98 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 474 L 7.71 3.74 0.00 1.14 1.38 0.73 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 475 R 8.18 3.94 0.00 1.96 2.09 0.00 3.17 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 1.62 1.87 0.00 476 K 7.80 3.93 0.00 1.84 1.81 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.64 7.81 477 I 7.59 3.73 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 1.55 1.32 0.95 0.00 0.00 478 S 7.87 4.14 0.00 4.02 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 479 R 7.94 4.00 0.00 1.96 2.20 0.00 3.09 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 480 D 7.95 4.34 0.00 2.82 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 0.00 481 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 0.00 482 G 7.67 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 0.00 0.00 0.00 *484 P 0.00 4.13 0.00 2.15 2.25 0.00 3.91 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 1.97 2.02 0.00 485 I 8.20 4.69 1.54 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.39 -0.15 0.00 0.00 486 Q 8.87 4.17 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.00 0.00 0.00 0.00 0.00 0.00 2.86 2.60 0.00 487 G 9.02 3.68 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 0.00 0.00 0.00 488 Q 7.92 4.36 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 489 P 0.00 3.34 0.00 1.70 0.49 0.00 3.51 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 1.66 1.40 0.00 490 C 8.05 3.88 0.00 2.69 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 0.00 491 F 7.28 4.53 0.00 2.41 2.39 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 0.00 492 C 7.69 4.77 0.00 2.70 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.23 4.47 0.00 1.36 1.47 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.85 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.97 0.22 7.81 494 Y 8.45 4.84 0.00 2.81 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 0.00 495 A 8.53 4.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 496 Q 8.06 4.73 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.42 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 497 G 9.15 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 0.00 0.00 0.00 0.00 498 A 8.57 3.87 1.26 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 0.00 499 D 8.05 4.46 0.00 2.67 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 0.00 500 S 7.99 4.43 0.00 4.13 4.17 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 0.00 0.00 0.00 501 V 7.53 3.60 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 -0.09 0.00 0.00 0.50 0.00 0.00 502 E 7.92 4.04 0.00 2.00 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 2.38 2.40 0.00 503 P 0.00 4.49 0.00 2.25 2.08 0.00 3.70 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.13 0.00 *505 F 8.13 4.90 0.00 3.04 3.10 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 0.00 506 R 8.46 3.97 0.00 2.10 2.02 0.00 3.16 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.84 0.00 507 H 8.34 4.13 0.00 3.23 3.32 0.00 5.59 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 0.00 508 L 7.84 4.02 0.00 1.77 1.56 0.62 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 509 K 7.95 3.97 0.00 1.74 1.98 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.47 7.81 510 N 8.16 4.56 0.00 2.75 2.80 0.00 0.00 6.86 7.06 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 0.00 511 T 7.10 4.01 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 0.36 0.00 0.00 512 Y 7.58 4.41 0.00 2.98 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 0.00 513 A 8.29 3.98 1.24 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 0.00 0.00 514 G 8.89 3.89 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 0.00 0.00 0.00 515 L 7.48 3.98 0.00 1.76 1.62 0.94 0.56 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 0.00 516 Q 8.85 4.56 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.31 0.00 0.00 0.00 0.00 0.00 2.31 2.53 0.00 517 L 7.62 4.58 0.00 1.73 1.51 0.96 0.71 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 0.00 518 V 8.51 4.78 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 0.87 0.00 0.00 0.62 0.00 0.00 519 V 9.34 4.58 2.46 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 1.19 0.00 0.00 1.08 0.00 0.00 520 V 9.03 4.99 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 1.23 0.00 0.00 1.24 0.00 0.00 521 I 8.68 4.68 1.92 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 1.26 0.93 0.87 0.00 0.00 522 L 8.72 5.12 0.00 1.54 1.60 1.09 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 523 P 0.00 4.40 0.00 2.11 2.13 0.00 3.92 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 2.02 2.25 0.00 524 G 8.75 3.77 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 0.00 0.00 0.00 525 K 8.53 4.24 0.00 1.74 1.74 0.00 1.75 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.33 7.81 526 T 7.95 4.57 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 1.31 0.00 0.00 527 P 0.00 4.44 0.00 2.17 2.07 0.00 3.66 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 2.11 2.13 0.00 528 V 8.02 3.37 1.93 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 0.26 0.00 0.00 0.82 0.00 0.00 529 Y 7.77 3.93 0.00 2.96 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 0.00 530 A 8.12 3.91 1.34 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 0.00 0.00 531 E 7.88 3.80 0.00 1.93 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.14 0.00 532 V 7.75 3.35 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 1.20 0.00 0.00 0.73 0.00 0.00 533 K 7.67 3.85 0.00 1.71 1.69 0.00 1.74 0.00 0.00 1.40 0.00 0.00 2.58 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.76 1.05 7.81 534 R 7.86 3.81 0.00 1.84 1.99 0.00 3.07 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 535 V 7.97 3.69 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 1.13 0.00 0.00 0.88 0.00 0.00 536 G 8.48 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 0.00 537 D 8.18 4.49 0.00 2.85 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 0.00 538 T 7.88 4.39 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 0.00 539 V 7.81 3.83 2.26 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 0.77 0.00 0.00 0.97 0.00 0.00 540 L 7.99 4.39 0.00 1.79 1.69 1.04 0.83 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 0.00 541 G 7.68 3.54 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 0.00 0.00 0.00 *543 A 8.09 4.27 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 0.00 544 T 8.46 5.15 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 1.15 0.00 0.00 545 Q 9.04 4.55 0.00 2.17 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.92 0.00 0.00 0.00 0.00 0.00 2.27 2.42 0.00 546 C 8.97 5.31 0.00 3.13 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 0.00 547 V 8.76 4.54 2.16 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 0.65 0.00 0.00 0.89 0.00 0.00 548 Q 8.53 4.64 0.00 2.09 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.51 0.00 0.00 0.00 0.00 0.00 2.43 2.26 0.00 *550 K 8.50 4.49 0.00 1.95 2.10 0.00 1.65 0.00 0.00 1.77 0.00 0.00 2.86 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.38 1.43 7.81 551 N 7.91 4.79 0.00 2.88 2.95 0.00 0.00 6.94 7.82 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 0.00 552 V 7.53 3.56 1.86 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 0.58 0.00 0.00 0.21 0.00 0.00 553 Q 8.16 4.05 0.00 2.26 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 6.62 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 554 R 7.83 4.71 0.00 1.79 1.86 0.00 3.36 0.00 0.00 3.31 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 555 T 8.44 4.63 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 1.50 0.00 0.00 556 T 8.20 4.77 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 0.00 557 P 0.00 4.22 0.00 2.18 2.15 0.00 3.61 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 2.16 0.00 558 Q 8.04 3.97 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 559 T 8.01 3.98 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 560 L 8.21 4.05 0.00 1.85 1.73 0.94 0.57 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 0.00 561 S 8.45 4.08 0.00 3.86 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 0.00 562 N 8.31 4.32 0.00 3.03 2.89 0.00 0.00 6.69 6.33 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 0.00 563 L 7.83 3.98 0.00 1.86 1.90 0.99 1.14 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 0.00 564 C 8.27 4.06 0.00 3.19 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 0.00 565 L 8.12 4.11 0.00 1.88 1.75 0.95 0.82 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 0.00 566 K 8.01 3.98 0.00 2.01 2.06 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.69 7.81 567 I 7.97 3.68 1.94 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 1.37 0.70 0.82 0.00 0.00 568 N 8.61 4.14 0.00 2.70 2.87 0.00 0.00 6.86 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 0.00 569 V 7.59 3.60 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 0.90 0.00 0.00 0.99 0.00 0.00 570 K 7.81 4.10 0.00 1.90 1.84 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.29 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.62 7.81 571 L 7.82 4.47 0.00 1.53 1.64 0.86 0.82 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 0.00 572 G 7.80 3.62 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 0.00 573 G 7.63 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 0.00 574 V 7.66 3.89 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 0.93 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.