NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 405 Q 4.3300 8.3449 121.9753 56.2994 29.0566 174.0886 406 E 4.4229 9.0740 124.1897 54.1376 32.2603 173.2620 407 M 5.2383 8.5669 120.1507 53.9936 35.8048 174.3253 408 V 4.6750 8.7496 124.1622 61.3620 35.9646 173.5853 409 Q 4.8531 9.0503 126.1404 54.0672 31.2963 174.5293 410 V 4.6054 8.5224 124.6143 60.9819 34.0916 174.1452 411 F 5.0219 8.7615 127.7219 56.4465 39.7563 175.3823 412 I 4.6195 8.5632 117.3987 57.9094 41.1045 173.2533 413 P 4.4385 0.0000 0.0000 63.0506 31.7391 177.4324 414 A 3.9485 8.9537 127.4285 55.2456 18.4738 179.1629 415 Q 4.2093 8.0131 110.8632 57.5315 29.0198 176.8294 416 A 4.2194 7.6819 120.4846 51.8859 19.3648 178.6117 417 V 3.5472 7.4833 118.2015 65.8696 31.5547 177.8270 418 G 3.7519 8.1977 104.6400 48.1402 0.0000 174.8610 419 A 4.0005 8.0569 122.1722 54.9252 18.4384 179.2531 420 I 3.9292 7.5029 116.3425 63.5556 37.5844 178.1933 421 I 4.0595 7.8772 121.5471 62.9507 37.3304 175.8912 422 G 4.1033 7.8458 104.9694 43.9616 0.0000 173.2855 423 K 4.1387 8.1605 118.2284 58.9152 30.6697 177.0222 424 K 4.0031 8.4903 121.9495 56.1557 29.2185 177.9036 425 G 3.9551 8.2045 106.5620 45.9735 0.0000 175.8324 426 Q 3.9514 8.0383 119.1860 59.4537 28.6405 178.3079 427 H 4.2638 8.3566 118.2909 58.1668 29.8648 176.6469 428 I 3.9003 7.5432 119.6188 63.4101 38.4530 177.4211 429 K 4.1509 7.7859 120.2987 58.5435 31.8929 178.7596 430 Q 4.1218 8.0564 118.9850 57.6546 28.5501 176.5915 431 L 4.5638 7.3425 119.8763 55.8295 42.5616 177.7091 432 S 4.6250 7.9643 115.0323 59.9296 63.2698 176.4377 433 R 3.9961 7.8032 122.5227 59.1903 29.6853 177.9533 434 F 4.2608 7.9870 119.2236 61.4008 39.4815 176.1362 435 A 3.7353 7.6933 120.7752 52.6268 19.0421 177.1459 436 S 3.7886 7.4482 110.4431 59.4546 60.5550 171.5876 437 A 4.8987 7.9076 121.0658 50.0544 23.6583 177.1201 438 S 4.2733 8.6576 116.8344 58.7639 64.0782 173.8877 439 I 5.0556 8.2878 124.8153 59.5501 38.8169 173.8496 440 K 4.5255 8.7913 125.9206 54.7451 34.5663 175.4636 441 I 4.7301 8.1345 124.5706 59.4551 38.1410 175.6075 442 A 4.3020 8.3657 130.0354 51.1399 18.9364 175.4748 443 P 4.4660 0.0000 0.0000 61.4885 32.4951 174.2891 444 P 4.5033 0.0000 0.0000 62.2666 32.0580 175.8678 445 E 3.9841 8.7467 123.0909 59.6927 29.7039 178.3952 446 T 4.3226 7.4357 107.2469 60.5708 70.6812 172.4368 447 P 4.7621 0.0000 0.0000 62.9560 31.3783 175.8056 448 D 4.9444 7.9240 118.6828 53.7254 42.0296 176.1493 449 S 4.2786 8.2871 115.5384 58.8275 64.1609 174.7359 450 K 4.1623 8.7366 127.1114 58.2396 32.0777 176.6336 451 V 4.8405 7.6677 111.8909 59.5639 34.4653 174.8390 452 R 4.7700 8.9042 120.2191 54.7142 34.2894 174.5608 453 M 4.3437 8.4388 121.4403 53.9776 34.2271 174.6303 454 V 4.2628 8.7085 127.4052 61.9420 33.5884 174.4349 455 I 4.8493 8.7159 129.1523 59.6340 39.6334 174.5493 456 I 5.0210 8.7675 127.9747 59.7483 40.5171 174.6965 457 T 5.0668 9.7495 123.3142 60.6480 72.0511 174.0294 458 G 4.3877 8.2233 114.1044 45.3729 0.0000 169.8641 459 P 4.9403 0.0000 0.0000 61.1794 32.6118 175.4255 460 P 4.2314 0.0000 0.0000 65.9932 30.9847 178.5218 461 E 3.9543 8.2766 116.4036 59.6090 29.3962 179.2828 462 A 4.1458 7.8355 120.0513 55.0802 18.4911 179.3650 463 Q 3.9920 8.3416 116.8190 59.1570 28.8208 179.0818 464 F 4.1900 8.4571 121.4622 61.2434 39.4118 177.3539 465 K 3.9379 8.0756 117.4666 59.4398 32.0074 179.2922 466 A 4.0348 8.1177 120.9783 55.3452 18.2915 179.7404 467 Q 4.1872 8.5838 117.1142 59.0011 28.7492 179.2057 468 G 2.5408 8.0899 106.7481 47.5855 0.0000 175.9784 469 R 3.9299 8.2021 120.8809 58.7812 30.0097 179.3853 470 I 3.6658 7.5844 119.2249 64.7142 37.1048 177.7473 471 Y 4.0145 8.2344 117.7440 61.1557 37.6578 179.5013 472 G 3.5083 8.2428 106.3961 47.7460 0.0000 175.5942 473 K 3.8946 8.4001 123.1034 59.3685 32.0753 178.7272 474 L 4.2483 8.0129 119.1281 57.5736 41.5206 179.0327 475 K 3.9909 7.9814 119.8449 59.3809 31.9526 178.2818 476 E 3.9599 8.1342 118.3129 59.8750 29.6471 179.1775 477 E 4.1806 8.2711 114.0563 55.6864 29.9679 176.5252 478 N 4.4964 8.2967 115.0451 53.3496 36.6053 175.3024 479 F 4.2706 8.3045 116.5196 58.7007 39.6749 176.6974 480 F 4.8689 9.3007 118.3223 54.6278 41.8392 174.5506 481 G 4.8383 8.6994 124.8261 45.7246 0.0000 171.5817 *484 E 4.1090 8.2005 126.5214 55.2634 30.5554 175.3661 485 E 4.1310 8.7099 125.8948 55.8993 30.6402 176.5820 486 V 2.3415 8.2134 123.2994 62.5866 32.5301 174.4932 487 K 5.2857 8.4184 127.3435 54.7298 34.2173 175.6397 488 L 4.9139 8.6793 123.4001 52.7809 46.0570 175.3313 489 E 4.7714 8.7490 122.2729 56.1881 31.5707 175.1899 490 T 5.3372 9.0250 121.5183 62.4101 73.1535 172.4142 491 H 5.6981 9.7098 123.5912 53.9854 31.9626 173.2850 492 I 4.8428 8.4426 115.4340 59.1422 40.5259 174.6660 493 R 4.8406 8.6169 124.0538 55.8062 31.2305 176.2286 494 V 4.5601 9.1198 115.9683 58.7109 36.5432 173.2033 495 P 4.1910 0.0000 0.0000 62.5860 31.1554 177.2018 496 A 4.0760 9.1175 126.4414 54.9613 17.9812 179.7139 497 S 3.8805 8.0382 111.8583 61.4265 63.4752 175.9006 498 A 4.2412 8.0981 123.2539 53.5473 18.4835 178.9746 499 A 4.1625 7.6516 119.2048 54.5723 18.3343 179.6179 500 G 3.6057 7.9894 103.8905 47.3050 0.0000 176.2093 501 R 4.1446 7.7947 119.6704 58.9126 29.8874 178.8726 502 V 3.7373 7.6770 117.9149 65.9446 31.6174 178.0783 503 I 3.5990 7.5236 119.8702 62.2081 37.1631 177.7108 504 G 4.4620 8.0473 103.2876 45.8084 0.0000 172.2651 505 K 4.0295 8.4116 119.7150 57.5361 32.0364 176.8695 506 G 3.9401 9.3547 114.8176 46.6085 0.0000 173.3955 507 G 4.3685 8.1426 105.7445 46.3998 0.0000 176.5193 508 K 4.2204 7.4788 121.3281 58.3485 32.2026 179.2492 509 T 3.9684 7.7719 116.5215 66.5202 68.7561 176.8659 510 V 3.6614 7.4221 120.7029 64.8446 31.1525 177.9128 511 N 4.2677 7.8048 116.4550 56.6658 38.8375 176.5448 512 E 3.9674 7.9604 120.8486 58.9548 29.7048 178.5104 513 L 3.9546 8.0069 119.2047 58.1607 41.6804 179.6480 514 Q 4.2761 7.8714 118.6243 58.3418 28.3661 178.5831 515 N 4.3281 7.8508 116.6787 56.4145 38.7337 177.1339 516 L 4.1663 8.2075 119.5221 57.5281 41.8989 178.8671 517 T 4.2901 8.1791 108.2009 60.9180 69.5655 176.2224 518 A 3.8844 8.2775 122.0935 51.9169 17.3717 177.5379 519 A 4.4044 7.6665 118.7256 51.4425 20.0944 177.1604 520 E 4.4421 8.9950 121.5196 56.4007 30.7680 176.2941 521 V 4.8891 8.4637 124.2917 61.1379 34.3900 174.7636 522 V 4.3715 8.7053 127.3158 61.1367 34.8637 174.3095 523 V 4.4552 8.4136 127.8582 60.1656 32.1283 172.7930 524 P 4.1688 0.0000 0.0000 62.9330 31.6674 176.7531 525 R 3.9718 8.4413 122.4956 57.0706 31.2252 175.3907 526 D 4.2162 8.6009 120.0354 54.9800 38.2661 171.8720 527 Q 4.4951 7.5711 119.4281 54.2841 31.8147 175.8712 528 T 4.3182 8.0630 109.3896 59.4330 68.7204 172.9754 529 P 4.3267 0.0000 0.0000 62.6199 31.9715 176.6181 530 D 4.5856 8.5277 122.6597 53.1016 39.4837 176.6529 531 E 3.9398 8.7395 118.5556 59.2363 29.4829 177.1512 532 N 4.6909 8.2140 113.7842 52.5457 38.7994 173.9783 533 D 4.4470 8.2071 117.1363 55.7072 40.3041 172.8043 534 Q 5.1813 9.0423 115.1839 53.8592 32.4890 175.5191 535 V 4.7154 8.6456 115.1566 59.6365 35.5124 174.2625 536 I 4.9213 8.1900 114.7083 59.5418 39.6739 175.2630 537 V 4.4395 8.5169 124.6080 61.4120 33.5915 174.6316 538 K 4.9582 8.8243 127.4910 55.5699 34.2122 175.8126 539 I 5.0652 8.9206 124.4128 59.7129 41.1203 174.2607 540 I 5.0828 7.7913 127.9958 58.8679 40.2068 175.2060 541 G 4.4525 8.3364 112.6787 45.8156 0.0000 171.9630 542 H 5.7607 8.3101 115.4282 53.9467 29.9340 175.9917 543 F 3.0775 8.6749 120.6323 61.3048 38.7529 176.3171 544 Y 3.6720 8.0767 118.1282 60.5593 38.8450 177.0654 545 A 4.1174 8.0202 122.5707 54.5717 18.2546 179.4173 546 S 3.9556 8.0255 111.3188 61.5623 62.4665 176.3018 547 Q 3.7883 7.5861 120.6777 58.9991 28.3807 178.4459 548 M 3.7251 7.5646 118.7911 58.4661 32.2018 178.1084 549 A 3.8568 7.7642 120.5964 55.2728 18.5357 179.2759 550 Q 3.9108 8.1764 116.9171 59.2856 28.8415 179.2205 551 R 3.8363 7.9594 119.3181 59.8105 30.0213 178.5867 552 K 3.9622 7.9844 117.8188 59.4019 31.9856 179.4761 553 I 3.6822 7.8801 120.1317 64.4979 37.0364 178.4563 554 R 3.9478 8.2592 119.1619 59.7453 29.7995 178.5617 555 D 4.3248 8.1279 118.6176 56.9658 40.7824 178.5808 556 I 3.8062 8.0131 120.0948 64.7456 37.0428 178.2978 557 L 3.9426 7.7198 117.9335 57.7928 41.5003 178.8570 558 A 4.1275 7.7886 120.2396 55.5183 18.1365 179.7997 559 Q 3.9827 7.9344 115.8970 59.1472 28.6088 178.9230 560 V 3.6241 7.3799 117.8396 65.9630 31.5477 177.7538 561 K 4.1051 7.4961 115.2582 58.2646 31.8863 176.9087 562 Q 4.1593 8.1586 123.7390 56.1109 28.6711 175.7373 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 405 Q 8.34 4.33 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.88 0.00 0.00 0.00 0.00 0.00 2.24 2.46 0.00 406 E 9.07 4.42 0.00 1.97 1.85 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 2.28 2.32 0.00 407 M 8.57 5.24 0.00 1.97 1.88 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.56 0.00 408 V 8.75 4.67 2.22 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 1.03 0.00 0.00 0.95 0.00 0.00 409 Q 9.05 4.85 0.00 1.89 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.53 0.00 0.00 0.00 0.00 0.00 2.19 2.22 0.00 410 V 8.52 4.61 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 0.88 0.00 0.00 0.92 0.00 0.00 411 F 8.76 5.02 0.00 3.01 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 0.00 412 I 8.56 4.62 1.75 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 1.33 1.15 0.80 0.00 0.00 413 P 0.00 4.44 0.00 1.76 1.92 0.00 3.49 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 2.09 0.00 414 A 8.95 3.95 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 0.00 415 Q 8.01 4.21 0.00 2.32 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.64 0.00 416 A 7.68 4.22 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 417 V 7.48 3.55 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 1.06 0.00 0.00 0.97 0.00 0.00 418 G 8.20 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 419 A 8.06 4.00 1.45 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 0.00 420 I 7.50 3.93 1.84 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 1.70 0.77 0.93 0.00 0.00 421 I 7.88 4.06 1.88 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 1.46 1.02 0.92 0.00 0.00 422 G 7.85 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 423 K 8.16 4.14 0.00 1.76 1.82 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.46 7.81 424 K 8.49 4.00 0.00 1.84 2.19 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.29 1.39 7.81 425 G 8.20 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 0.00 0.00 0.00 426 Q 8.04 3.95 0.00 2.12 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.86 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 427 H 8.36 4.26 0.00 3.20 3.47 0.00 5.57 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 428 I 7.54 3.90 1.89 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 1.64 1.24 0.95 0.00 0.00 429 K 7.79 4.15 0.00 1.80 1.85 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.44 7.81 430 Q 8.06 4.12 0.00 2.19 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.62 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 431 L 7.34 4.56 0.00 1.95 1.60 1.13 0.79 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 0.00 432 S 7.96 4.63 0.00 4.27 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 0.00 433 R 7.80 4.00 0.00 2.04 2.10 0.00 3.12 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 434 F 7.99 4.26 0.00 3.04 3.08 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 0.00 435 A 7.69 3.74 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 0.00 436 S 7.45 3.79 0.00 4.11 3.90 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 0.00 0.00 0.00 437 A 7.91 4.90 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 438 S 8.66 4.27 0.00 3.82 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 0.00 439 I 8.29 5.06 1.87 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.76 0.90 0.00 0.00 440 K 8.79 4.53 0.00 1.68 1.69 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.53 7.81 441 I 8.13 4.73 1.85 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 1.23 0.52 0.88 0.00 0.00 442 A 8.37 4.30 1.21 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 0.00 0.00 443 P 0.00 4.47 0.00 2.19 2.06 0.00 3.77 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 444 P 0.00 4.50 0.00 2.37 2.10 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 445 E 8.75 3.98 0.00 1.99 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 2.34 2.34 0.00 446 T 7.44 4.32 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 447 P 0.00 4.76 0.00 2.06 2.11 0.00 3.62 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.09 0.00 448 D 7.92 4.94 0.00 2.62 2.60 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 0.00 0.00 0.00 0.00 449 S 8.29 4.28 0.00 4.21 3.88 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 0.00 450 K 8.74 4.16 0.00 1.47 1.85 0.00 1.76 0.00 0.00 1.82 0.00 0.00 2.75 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.44 1.04 7.81 451 V 7.67 4.84 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 0.91 0.00 0.00 0.99 0.00 0.00 452 R 8.90 4.77 0.00 1.64 1.75 0.00 3.27 0.00 0.00 3.09 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 453 M 8.44 4.34 0.00 2.00 1.87 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 1.63 2.19 0.00 454 V 8.71 4.26 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 0.76 0.00 0.00 0.84 0.00 0.00 455 I 8.72 4.85 1.83 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.82 0.88 0.00 0.00 456 I 8.77 5.02 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.99 1.00 0.00 0.00 457 T 9.75 5.07 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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4.03 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 0.00 467 Q 8.58 4.19 0.00 2.40 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.49 2.59 0.00 468 G 8.09 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 0.00 0.00 0.00 469 R 8.20 3.93 0.00 2.07 2.04 0.00 3.31 0.00 0.00 2.96 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 470 I 7.58 3.67 2.00 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 1.51 0.89 0.80 0.00 0.00 471 Y 8.23 4.01 0.00 2.85 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 0.00 472 G 8.24 3.51 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 0.00 0.00 0.00 473 K 8.40 3.89 0.00 1.98 1.86 0.00 1.52 0.00 0.00 1.65 0.00 0.00 2.77 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.39 1.56 7.81 474 L 8.01 4.25 0.00 1.94 1.97 0.86 0.40 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0.00 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 0.00 510 V 7.42 3.66 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 0.81 0.00 0.00 0.96 0.00 0.00 511 N 7.80 4.27 0.00 3.02 2.94 0.00 0.00 6.73 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 512 E 7.96 3.97 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 513 L 8.01 3.95 0.00 1.94 1.70 0.91 0.71 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 0.00 514 Q 7.87 4.28 0.00 2.30 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.81 0.00 0.00 0.00 0.00 0.00 2.57 2.46 0.00 515 N 7.85 4.33 0.00 2.89 2.89 0.00 0.00 7.08 7.97 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 0.00 516 L 8.21 4.17 0.00 1.71 1.74 0.92 0.82 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 0.00 517 T 8.18 4.29 4.27 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 1.16 0.00 0.00 518 A 8.28 3.88 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 519 A 7.67 4.40 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 0.00 520 E 8.99 4.44 0.00 1.97 1.91 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 2.35 2.28 0.00 521 V 8.46 4.89 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 0.74 0.00 0.00 0.97 0.00 0.00 522 V 8.71 4.37 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 0.95 0.00 0.00 0.93 0.00 0.00 523 V 8.41 4.46 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 0.86 0.00 0.00 0.93 0.00 0.00 524 P 0.00 4.17 0.00 2.05 2.00 0.00 3.89 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.10 0.00 525 R 8.44 3.97 0.00 1.79 1.86 0.00 3.46 0.00 0.00 3.35 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 526 D 8.60 4.22 0.00 2.79 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 0.00 527 Q 7.57 4.50 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.71 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 528 T 8.06 4.32 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 529 P 0.00 4.33 0.00 2.06 1.97 0.00 3.70 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 530 D 8.53 4.59 0.00 2.85 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 0.00 531 E 8.74 3.94 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 532 N 8.21 4.69 0.00 2.92 2.82 0.00 0.00 6.87 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 533 D 8.21 4.45 0.00 2.94 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 0.00 534 Q 9.04 5.18 0.00 2.14 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.55 6.35 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 535 V 8.65 4.72 2.22 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 0.83 0.00 0.00 0.93 0.00 0.00 536 I 8.19 4.92 1.86 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.55 0.94 0.00 0.00 537 V 8.52 4.44 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 1.00 0.00 0.00 0.93 0.00 0.00 538 K 8.82 4.96 0.00 1.73 1.72 0.00 1.53 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.21 7.81 539 I 8.92 5.07 1.93 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.06 0.93 0.00 0.00 540 I 7.79 5.08 1.92 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 1.15 1.65 0.98 0.00 0.00 541 G 8.34 4.45 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 0.00 542 H 8.31 5.76 0.00 3.44 3.56 0.00 5.84 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 543 F 8.67 3.08 0.00 2.14 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 0.00 544 Y 8.08 3.67 0.00 3.17 3.05 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 0.00 545 A 8.02 4.12 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 546 S 8.03 3.96 0.00 3.95 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 547 Q 7.59 3.79 0.00 1.79 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.56 0.00 0.00 0.00 0.00 0.00 1.46 1.59 0.00 548 M 7.56 3.73 0.00 1.87 1.61 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.26 0.00 549 A 7.76 3.86 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 0.00 550 Q 8.18 3.91 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.68 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 551 R 7.96 3.84 0.00 1.91 2.13 0.00 3.10 0.00 0.00 3.11 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 552 K 7.98 3.96 0.00 1.79 1.82 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.59 1.59 7.81 553 I 7.88 3.68 2.04 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 1.51 0.64 0.91 0.00 0.00 554 R 8.26 3.95 0.00 1.99 1.98 0.00 3.28 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.82 0.00 555 D 8.13 4.32 0.00 2.90 2.65 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 0.00 0.00 0.00 0.00 556 I 8.01 3.81 2.02 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 1.51 1.61 0.90 0.00 0.00 557 L 7.72 3.94 0.00 1.80 1.72 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 558 A 7.79 4.13 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 0.00 559 Q 7.93 3.98 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.70 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 560 V 7.38 3.62 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 0.83 0.00 0.00 0.98 0.00 0.00 561 K 7.50 4.11 0.00 2.05 1.85 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.48 7.81 562 Q 8.16 4.16 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.55 0.00 0.00 0.00 0.00 0.00 2.39 2.32 0.00 * Residues marked with a * may have inaccurate shift predictions.