NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 431 Y 4.5010 8.0033 118.3947 57.5781 40.3467 176.6478 432 Q 3.8708 8.1125 121.1223 59.3594 29.4768 176.5328 433 Q 4.2872 8.5204 117.6457 55.1879 30.7328 175.2008 434 D 4.4053 8.4090 120.4269 54.5635 41.3990 176.3415 435 Q 4.3291 8.3074 124.2679 55.1278 31.0324 176.0496 436 V 4.1331 7.8258 121.9298 61.3179 29.9747 174.6100 437 V 4.5659 7.0428 119.9466 59.5861 35.3705 175.2692 438 K 4.1157 8.4947 122.9750 56.7424 33.5899 178.3708 439 E 4.1654 8.8374 122.6568 59.2014 29.3622 179.4143 440 D 4.3736 8.0730 118.9804 57.4612 40.8763 178.0341 441 N 4.3375 8.2276 116.9592 56.6896 38.9536 176.8271 442 I 4.0924 7.4186 121.5561 64.3803 37.2492 178.2167 443 E 4.1843 8.2638 118.9310 59.2918 29.1560 179.2411 444 A 3.8693 7.7642 121.0545 55.1285 18.3547 179.8994 445 V 3.1853 7.4484 116.9076 65.5548 31.4807 178.5804 446 G 2.0000 7.2770 105.7062 46.6944 0.0000 175.9920 447 K 3.7891 7.3747 120.7231 58.9238 31.9054 179.7177 448 K 3.8229 7.2372 118.9518 59.0584 31.8970 178.7847 449 L 3.9614 7.4913 121.0438 58.6384 41.8791 178.5888 450 H 4.6395 7.8117 118.9030 58.8842 29.9745 177.1510 451 K 3.6936 7.9790 120.1956 59.8851 31.9090 178.8921 452 Y 4.1283 8.3080 116.7034 60.5242 37.3581 177.6665 453 N 4.5793 8.5764 118.5260 56.9548 39.0977 177.0548 454 T 3.9576 8.0199 117.1813 66.7521 68.5377 176.6790 455 Q 3.9390 8.0068 119.6315 58.8948 28.7976 178.5030 456 F 4.2361 8.3764 121.6607 61.4439 39.4533 176.8999 457 Q 3.3854 8.3345 119.3741 58.7939 28.8503 177.8738 458 E 3.8540 8.0636 120.3554 59.2757 29.7206 179.0035 459 K 3.9619 7.7332 118.0826 59.3970 32.0929 179.3349 460 S 4.0258 7.7709 113.4175 61.2785 62.3823 176.0607 461 R 3.8790 7.9368 121.4362 59.4873 29.6370 178.1135 462 E 3.9435 8.0330 118.8930 59.4008 29.5646 178.1552 463 Y 4.0408 8.5197 120.0682 60.8376 38.8485 177.7481 464 D 4.4556 8.4200 119.8922 57.2877 40.8166 178.9039 465 R 3.9440 7.9369 118.3431 59.2835 30.1007 179.1246 466 L 3.9724 7.6161 118.7962 57.9124 41.6166 178.8108 467 Y 4.2182 7.9965 119.7717 60.6541 38.7350 177.8667 468 E 3.9398 8.4299 120.1731 59.5499 29.8384 178.7988 469 E 4.0735 8.1085 118.2833 59.3482 29.5826 178.6122 470 Y 4.3088 8.7845 120.1412 61.1438 38.9649 178.5184 471 T 3.9194 8.2911 116.5862 66.7273 68.6372 176.8853 472 R 3.9401 7.9636 120.2679 59.6385 30.0906 178.7054 473 T 3.9117 8.0819 115.7975 66.5230 68.5321 176.7187 474 S 3.6183 7.8189 114.8567 61.0262 62.1118 176.3337 475 Q 3.9093 7.6678 119.7956 58.9849 28.6230 177.9563 476 E 4.0676 7.9215 118.2784 59.4585 29.7288 179.2619 477 I 3.8156 7.6919 119.8558 64.0576 36.9855 178.8781 478 Q 3.9421 7.7049 119.2267 56.3182 28.9686 177.9691 *480 K 4.2864 8.0938 119.6777 56.0767 34.5035 178.6276 481 R 3.9426 8.0568 117.8459 59.4598 29.8840 179.2012 482 T 3.8222 7.7174 115.2061 66.7009 68.5157 176.6739 483 A 3.9785 7.9584 122.0312 54.9388 18.3798 179.6681 484 I 3.8977 7.9311 118.6593 64.6665 37.2672 178.0583 485 E 4.0164 8.2718 119.9645 59.3939 29.3548 178.7284 486 A 4.0749 8.0118 120.6139 54.6060 18.3994 179.7411 487 F 4.1501 8.1975 116.6652 60.8454 39.0596 177.3615 488 N 4.3593 8.7156 116.5828 56.6096 38.2727 177.0661 489 E 4.0508 8.2483 120.3353 59.2695 29.7232 178.8494 490 T 3.9994 8.1580 116.0257 66.7411 68.4547 176.6503 491 I 3.8036 8.3068 122.1174 64.2190 37.0231 178.3660 492 K 4.0815 8.0586 119.3164 59.8855 31.9531 179.3722 493 I 3.8996 7.6867 119.4758 64.5319 37.1603 178.6269 494 F 4.0345 8.6032 118.6660 60.3473 38.7513 177.6891 495 E 4.0757 8.5927 118.7338 59.5305 29.3188 179.1756 496 E 4.0179 8.5531 118.9284 59.3858 29.4509 179.1807 497 Q 3.9249 8.0695 119.7186 59.3179 29.0659 178.1138 498 C 4.3378 8.0357 117.5569 63.0349 27.7218 176.1551 499 Q 4.0628 7.9929 119.1766 58.9999 28.1821 178.7666 500 T 3.8695 7.9868 117.1823 66.7051 68.6061 176.6539 501 Q 4.0042 8.0569 119.7402 58.9388 28.7623 178.1811 502 E 3.8110 7.9342 119.3171 59.0220 29.4751 178.7735 503 R 4.0901 7.6145 117.5027 58.2067 28.9406 177.0240 504 Y 4.1731 7.9801 115.8945 59.1324 38.6695 176.8442 505 S 4.0156 7.8259 113.1105 58.2894 63.2133 175.8762 506 K 3.7975 7.7356 124.0619 59.9135 31.4563 177.8047 507 E 3.9391 8.1686 117.9678 60.1565 29.3976 179.0351 508 Y 3.7242 7.5687 114.2521 60.0935 37.8576 178.2167 509 I 3.7072 7.4852 120.9296 64.3118 36.9743 178.1785 510 E 4.0230 7.6062 117.4550 59.0712 29.5117 178.9619 511 K 4.0898 7.6698 118.7755 59.0856 32.1653 179.0363 512 F 4.6444 7.9214 118.5529 60.2117 38.8625 177.5614 513 K 4.2900 7.8242 115.6259 58.7520 32.5381 178.8339 514 R 4.1637 7.9220 119.1778 58.7856 30.2894 177.2233 515 E 4.4881 7.6192 114.4158 55.2370 29.6289 176.4145 516 G 3.9223 7.7448 106.0559 46.9752 0.0000 175.4203 517 N 4.5860 7.7067 119.4530 52.0894 35.8887 174.1878 518 E 4.3032 7.8427 121.4670 56.8482 30.5620 177.3447 519 K 4.0153 7.7957 118.2973 60.2200 32.4161 178.4957 520 E 4.0922 8.0470 119.0520 59.0152 29.4534 178.5364 521 I 3.8805 7.5239 119.5022 64.4263 37.2550 177.6916 522 Q 4.1689 7.6959 119.4367 59.3279 29.1621 178.4579 523 R 4.2083 7.9441 118.7977 59.1661 30.1235 179.5171 524 I 3.6256 7.6986 116.1590 62.6453 37.1708 177.2301 *526 H 4.6874 8.1151 122.0007 56.2912 31.7342 174.9322 527 N 4.3614 8.3917 117.3696 56.7347 38.7126 176.2948 528 Y 4.3903 8.3072 121.0994 60.8563 38.8054 177.7734 529 D 4.1600 7.9750 119.4515 56.9800 40.9631 178.3862 530 K 3.8303 7.8625 120.0493 59.4334 32.1998 178.6329 531 L 4.0457 7.8235 120.4052 58.2059 42.0542 179.1244 532 K 3.9661 7.8638 118.4277 59.0021 31.8922 179.4657 533 S 3.9877 8.1347 113.8687 61.4219 62.4049 176.2258 534 R 3.8584 8.0861 121.3886 59.2344 29.6788 178.5900 535 I 3.4962 7.7487 119.7847 64.5085 37.2873 178.6215 536 S 4.0675 8.0280 115.8855 61.4080 62.5667 176.6930 537 E 3.9156 8.2373 121.4721 59.4439 29.2014 179.4029 538 I 3.6915 7.6576 119.7862 64.4627 37.1212 178.6313 539 I 3.6457 7.8824 120.7303 64.1534 36.8360 178.3595 540 D 4.2102 7.8383 119.5325 57.4636 40.6818 178.8755 541 S 3.9637 7.8441 115.6126 61.4296 62.6763 176.8114 542 R 3.0720 7.1581 121.2922 58.9371 29.7598 178.4464 543 R 3.9246 7.6498 118.4763 59.4757 29.9981 178.3923 544 R 4.0273 7.7761 117.7249 59.5377 30.0665 178.8566 545 L 3.9416 7.7673 119.7028 58.0204 42.0283 178.8219 546 E 3.9584 8.2855 119.1948 59.2554 29.3914 179.1396 547 E 3.9806 8.2807 117.7232 59.6034 29.7375 178.9661 548 D 4.3584 8.3482 120.1042 56.8383 40.8517 178.4476 549 L 3.9505 8.3084 121.4137 57.7944 41.8196 178.9996 550 K 3.9268 8.0051 119.6350 59.5284 32.2475 179.0283 551 K 3.9996 8.0193 118.8060 59.5451 31.9968 179.1928 552 Q 4.1830 8.3333 119.5276 58.8161 29.0803 177.8660 553 A 4.0819 8.1861 121.7912 54.6296 18.3481 179.5188 554 A 4.0155 7.8271 119.6498 55.1687 18.4532 179.3492 555 E 3.9363 8.1066 117.1591 59.9739 29.6346 178.8270 556 Y 4.2803 8.1306 119.1314 61.1761 38.7539 178.6834 557 R 3.9277 8.0996 118.3650 59.2735 30.3063 178.7251 558 E 3.9788 8.4293 119.1428 59.1090 29.3527 178.9513 559 I 3.6821 7.8312 119.7134 64.3752 37.2769 177.4887 560 D 3.9978 7.7461 117.6555 57.0132 41.3380 177.9412 561 K 4.1035 8.0020 120.1982 59.3439 32.0089 179.4364 562 R 3.7906 7.5445 113.8838 57.4233 29.4615 178.0625 *564 N 4.6094 8.0675 118.2472 53.3407 40.5051 176.4607 565 S 4.2365 7.8221 111.4343 60.8560 62.6371 175.7497 566 I 3.9984 7.5101 122.6579 63.4950 37.0807 177.7262 567 K 3.4389 8.0126 120.0629 59.3165 32.0356 176.7838 568 P 4.2420 0.0000 0.0000 65.3758 31.2086 178.2402 569 D 4.5535 7.8695 117.7769 56.7223 41.4670 177.5419 570 L 4.0309 8.2227 121.2797 58.6144 42.0069 179.1663 571 I 3.7238 8.0926 119.8731 64.3162 36.8164 178.2379 572 Q 3.9866 8.0472 120.2216 58.8811 28.8221 178.0309 573 L 4.1373 8.1511 120.2335 57.7584 41.6034 179.3952 574 R 3.3563 7.9286 118.4206 59.1898 29.8548 178.7165 575 K 3.9274 7.8063 117.7699 59.3081 32.1236 179.5789 576 T 3.5319 7.6631 115.9784 66.2058 68.1761 176.5987 577 R 3.9745 8.1398 120.9339 59.6856 29.8829 178.1997 578 D 4.3431 8.0331 117.5304 57.5932 40.8819 178.4882 579 Q 4.0563 8.0122 117.7091 59.1933 28.9130 178.3424 580 Y 4.5186 7.7379 117.5445 60.6868 37.8625 177.8909 581 L 3.9035 8.0885 117.3351 56.1433 41.7838 178.0492 *583 W 4.6079 7.8645 128.4691 57.2074 32.4167 177.3801 584 L 4.1499 8.3306 118.1675 58.1324 41.6378 179.6279 585 T 3.9669 8.4942 115.7939 66.7573 68.5530 176.7127 586 Q 3.5886 7.7118 118.8063 58.4478 28.7756 176.7866 587 K 4.0417 7.3906 116.2026 56.1728 31.8042 177.1609 588 G 4.1335 7.7613 104.3013 44.7716 0.0000 174.8474 589 V 3.7316 7.3364 119.1210 62.2064 32.3651 176.8946 590 R 4.0962 8.3617 125.5367 56.0848 31.9553 177.8568 591 Q 4.0163 8.6286 123.2078 59.1533 29.0812 178.8341 592 K 3.9844 7.9543 119.3459 59.5306 32.2588 178.9984 593 K 3.7756 7.6494 122.0287 58.6173 32.2789 178.6835 594 L 4.3237 7.6922 118.7193 57.6905 41.2467 179.2495 595 N 4.4399 8.0132 116.1046 56.1709 38.8974 176.8281 596 E 4.0431 7.7734 120.2206 59.2496 29.3606 179.3627 597 W 4.7186 7.8111 117.3530 59.0447 29.2125 177.8628 598 L 4.8953 7.5952 118.4161 54.7684 41.1734 178.5524 599 G 3.7296 7.7166 104.4967 46.5280 0.0000 173.4957 600 N 4.6388 7.7747 122.8014 53.6067 39.8675 174.0639 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 431 Y 8.00 4.50 0.00 3.00 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 0.00 432 Q 8.11 3.87 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 7.02 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 433 Q 8.52 4.29 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.25 7.10 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 434 D 8.41 4.41 0.00 2.63 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 435 Q 8.31 4.33 0.00 1.87 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.42 0.00 0.00 0.00 0.00 0.00 2.12 2.40 0.00 436 V 7.83 4.13 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 0.84 0.00 0.00 0.92 0.00 0.00 437 V 7.04 4.57 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 0.97 0.00 0.00 0.97 0.00 0.00 438 K 8.49 4.12 0.00 1.89 1.92 0.00 1.74 0.00 0.00 1.99 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.56 1.57 7.81 439 E 8.84 4.17 0.00 2.05 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 0.00 2.45 2.43 0.00 440 D 8.07 4.37 0.00 2.71 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 0.00 441 N 8.23 4.34 0.00 2.84 3.00 0.00 0.00 7.18 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 0.00 442 I 7.42 4.09 2.16 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.84 1.20 0.00 0.00 443 E 8.26 4.18 0.00 2.04 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 2.64 2.57 0.00 444 A 7.76 3.87 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 0.00 445 V 7.45 3.19 1.95 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 0.91 0.00 0.00 0.44 0.00 0.00 446 G 7.28 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 0.00 0.00 0.00 0.00 0.00 0.00 447 K 7.37 3.79 0.00 1.81 1.75 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.55 7.81 448 K 7.24 3.82 0.00 1.12 1.18 0.00 1.44 0.00 0.00 1.09 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.32 7.81 449 L 7.49 3.96 0.00 1.64 1.63 1.08 1.34 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 0.00 450 H 7.81 4.64 0.00 3.43 3.42 0.00 5.89 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 0.00 451 K 7.98 3.69 0.00 1.79 1.53 0.00 1.72 0.00 0.00 1.50 0.00 0.00 2.87 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.31 1.35 7.81 452 Y 8.31 4.13 0.00 3.19 3.07 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 0.00 453 N 8.58 4.58 0.00 3.01 3.14 0.00 0.00 7.08 6.74 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 0.00 454 T 8.02 3.96 4.33 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 1.24 0.00 0.00 455 Q 8.01 3.94 0.00 2.30 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 456 F 8.38 4.24 0.00 3.20 3.40 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 0.00 457 Q 8.33 3.39 0.00 2.38 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.23 0.00 458 E 8.06 3.85 0.00 2.13 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 2.28 2.33 0.00 459 K 7.73 3.96 0.00 1.89 1.82 0.00 1.74 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.57 1.60 7.81 460 S 7.77 4.03 0.00 3.24 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 0.00 461 R 7.94 3.88 0.00 2.06 1.99 0.00 3.13 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 462 E 8.03 3.94 0.00 2.29 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 2.31 2.32 0.00 463 Y 8.52 4.04 0.00 3.12 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 0.00 464 D 8.42 4.46 0.00 3.00 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 0.00 465 R 7.94 3.94 0.00 2.03 1.98 0.00 3.13 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 466 L 7.62 3.97 0.00 1.63 1.56 0.90 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 467 Y 8.00 4.22 0.00 2.86 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 0.00 468 E 8.43 3.94 0.00 2.09 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 0.00 2.33 2.36 0.00 469 E 8.11 4.07 0.00 2.17 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 0.00 2.36 2.49 0.00 470 Y 8.78 4.31 0.00 3.10 3.34 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 0.00 471 T 8.29 3.92 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 472 R 7.96 3.94 0.00 1.92 2.12 0.00 3.10 0.00 0.00 3.32 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 473 T 8.08 3.91 4.57 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 1.29 0.00 0.00 474 S 7.82 3.62 0.00 3.82 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 0.00 475 Q 7.67 3.91 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 476 E 7.92 4.07 0.00 1.90 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 0.00 2.32 2.52 0.00 477 I 7.69 3.82 1.75 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.67 0.70 0.00 0.00 478 Q 7.70 3.94 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.38 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 *480 K 8.09 4.29 0.00 2.01 1.88 0.00 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0.00 0.00 2.33 2.33 0.00 497 Q 8.07 3.92 0.00 2.11 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.23 2.42 0.00 498 C 8.04 4.34 0.00 3.39 3.14 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 0.00 499 Q 7.99 4.06 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.64 0.00 500 T 7.99 3.87 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 0.90 0.00 0.00 501 Q 8.06 4.00 0.00 2.24 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.81 0.00 0.00 0.00 0.00 0.00 2.18 2.26 0.00 502 E 7.93 3.81 0.00 2.15 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 2.27 2.49 0.00 503 R 7.61 4.09 0.00 1.96 2.08 0.00 3.34 0.00 0.00 3.26 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 504 Y 7.98 4.17 0.00 3.10 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 0.00 505 S 7.83 4.02 0.00 4.01 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 0.00 506 K 7.74 3.80 0.00 1.94 1.82 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.46 7.81 507 E 8.17 3.94 0.00 2.33 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 2.37 2.37 0.00 508 Y 7.57 3.72 0.00 2.68 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 509 I 7.49 3.71 1.92 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 1.54 1.41 0.93 0.00 0.00 510 E 7.61 4.02 0.00 2.06 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 0.00 2.33 2.48 0.00 511 K 7.67 4.09 0.00 1.65 1.70 0.00 1.43 0.00 0.00 1.19 0.00 0.00 3.19 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.37 7.81 512 F 7.92 4.64 0.00 3.18 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 0.00 513 K 7.82 4.29 0.00 1.91 2.00 0.00 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0.00 0.00 1.43 1.41 7.81 531 L 7.82 4.05 0.00 1.92 1.87 1.11 0.70 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 0.00 532 K 7.86 3.97 0.00 1.70 1.65 0.00 1.49 0.00 0.00 0.99 0.00 0.00 2.16 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.11 0.64 7.81 533 S 8.13 3.99 0.00 3.94 3.96 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 0.00 534 R 8.09 3.86 0.00 2.04 2.08 0.00 3.15 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.49 0.00 535 I 7.75 3.50 2.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.59 0.90 0.00 0.00 536 S 8.03 4.07 0.00 4.02 3.86 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 0.00 537 E 8.24 3.92 0.00 2.11 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 0.00 2.29 2.42 0.00 538 I 7.66 3.69 1.81 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.48 1.00 0.00 0.00 539 I 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 556 Y 8.13 4.28 0.00 3.13 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 0.00 557 R 8.10 3.93 0.00 2.15 1.99 0.00 3.22 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.99 0.00 558 E 8.43 3.98 0.00 2.06 2.14 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 2.31 2.35 0.00 559 I 7.83 3.68 2.15 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 1.71 1.07 0.93 0.00 0.00 560 D 7.75 4.00 0.00 2.62 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 0.00 561 K 8.00 4.10 0.00 1.97 1.75 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.45 7.81 562 R 7.54 3.79 0.00 2.09 1.88 0.00 3.35 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 *564 N 8.07 4.61 0.00 2.83 2.88 0.00 0.00 7.04 7.57 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 0.00 565 S 7.82 4.24 0.00 3.88 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 0.00 566 I 7.51 4.00 2.00 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 1.43 0.54 0.95 0.00 0.00 567 K 8.01 3.44 0.00 1.73 1.73 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.10 7.81 568 P 0.00 4.24 0.00 2.17 2.06 0.00 3.68 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 2.08 2.11 0.00 569 D 7.87 4.55 0.00 2.76 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 0.00 570 L 8.22 4.03 0.00 1.69 1.71 0.64 1.15 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 0.00 571 I 8.09 3.72 1.82 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 1.35 0.95 0.86 0.00 0.00 572 Q 8.05 3.99 0.00 2.10 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 573 L 8.15 4.14 0.00 1.94 1.93 1.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 574 R 7.93 3.36 0.00 1.62 1.81 0.00 2.79 0.00 0.00 2.88 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.50 0.00 575 K 7.81 3.93 0.00 1.74 1.73 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.60 7.81 576 T 7.66 3.53 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 0.17 0.00 0.00 577 R 8.14 3.97 0.00 2.02 2.06 0.00 3.32 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.00 0.00 578 D 8.03 4.34 0.00 2.76 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 0.00 579 Q 8.01 4.06 0.00 1.74 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.99 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 580 Y 7.74 4.52 0.00 3.12 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 0.00 581 L 8.09 3.90 0.00 1.93 1.84 1.06 1.32 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 *583 W 7.86 4.61 0.00 3.58 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 0.00 584 L 8.33 4.15 0.00 2.16 1.97 1.05 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 585 T 8.49 3.97 4.35 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 1.41 0.00 0.00 586 Q 7.71 3.59 0.00 1.71 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 7.62 0.00 0.00 0.00 0.00 0.00 1.65 1.16 0.00 587 K 7.39 4.04 0.00 1.37 1.54 0.00 1.44 0.00 0.00 1.08 0.00 0.00 2.13 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.34 0.38 7.81 588 G 7.76 4.13 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 0.00 589 V 7.34 3.73 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 0.88 0.00 0.00 1.08 0.00 0.00 590 R 8.36 4.10 0.00 1.83 1.79 0.00 3.16 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.65 0.00 591 Q 8.63 4.02 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 592 K 7.95 3.98 0.00 1.96 2.01 0.00 1.50 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.40 7.81 593 K 7.65 3.78 0.00 1.63 1.61 0.00 1.38 0.00 0.00 1.58 0.00 0.00 2.96 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.78 0.25 7.81 594 L 7.69 4.32 0.00 1.95 1.84 1.02 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 595 N 8.01 4.44 0.00 2.81 2.87 0.00 0.00 7.03 6.97 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 0.00 596 E 7.77 4.04 0.00 1.73 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 2.22 2.35 0.00 597 W 7.81 4.72 0.00 3.68 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 0.00 598 L 7.60 4.90 0.00 2.05 1.79 1.08 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 599 G 7.72 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 0.00 600 N 7.77 4.64 0.00 2.90 2.72 0.00 0.00 6.80 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.