NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 443 D 4.6456 8.3229 119.5572 52.9168 42.1377 177.9619 444 S 4.1178 8.1004 123.4040 62.4311 62.1750 177.7633 445 S 4.1491 8.7650 117.9010 61.2894 63.2367 176.4210 446 R 4.1259 7.6744 122.5490 58.6439 29.8632 178.7798 447 R 3.8950 7.9724 118.5284 59.2996 29.9566 178.2600 448 Q 3.8917 8.0430 119.5012 59.2367 29.0433 177.6862 449 Y 3.9686 7.8759 120.2957 60.7952 38.8795 177.9343 450 Q 3.9550 8.3307 118.9346 59.2187 28.9659 178.9624 451 E 3.9313 8.3825 119.6598 59.1331 29.4791 179.3547 452 K 3.8341 8.1425 119.8859 59.6619 32.4076 178.3313 453 Y 3.5577 8.2244 122.5869 60.7505 38.5399 178.7146 454 K 3.8617 7.7566 124.9225 59.6606 31.7701 182.5290 455 Q 4.0891 7.7338 118.8547 58.6603 28.4170 178.8001 456 V 3.4862 7.2661 120.3526 66.7925 31.5360 178.0428 457 E 3.9405 7.4570 116.5846 61.4096 29.6633 180.8083 458 Q 4.4047 8.0004 118.9208 58.5441 28.6719 178.1496 459 Y 4.3536 8.3658 120.8940 59.0365 38.6057 178.1758 *461 S 4.4235 8.0111 116.5651 57.5884 64.7793 178.8415 462 F 4.1109 8.5401 122.6485 61.4384 39.0272 175.5009 463 H 4.3057 8.0403 114.4156 54.7513 28.4288 175.1231 464 K 3.8209 7.6596 117.6950 57.0897 30.1191 175.6200 465 L 4.1728 7.8503 116.4682 53.8105 42.6413 176.3956 466 P 4.4079 0.0000 0.0000 62.6861 33.4170 177.4661 467 A 4.1353 8.8314 124.7747 56.3071 18.4302 180.6431 468 D 4.4204 8.1452 118.9793 58.6568 39.8613 180.4643 469 F 4.4645 8.2982 121.6746 61.0865 39.4484 177.3920 470 R 3.9640 8.1714 118.0321 59.2503 29.8101 178.7545 471 Q 4.0712 8.1537 119.0562 58.7190 28.9632 177.9637 472 K 4.0093 7.8460 120.6020 59.4409 32.2165 178.8996 473 I 3.7408 7.7895 120.3630 64.5239 36.8941 177.7055 474 H 4.6879 8.4264 120.5131 59.0833 29.7166 177.0413 475 D 4.4395 8.7894 120.9808 57.3339 40.6594 178.0255 476 Y 4.1637 8.4606 120.2583 61.1718 38.7576 177.8536 477 Y 4.0322 8.5015 117.4783 61.0720 37.9737 178.7179 478 E 3.9064 8.0877 119.3374 59.7786 29.3946 179.1378 479 H 3.8904 7.9157 114.7266 58.6575 28.7977 177.7186 480 R 3.6309 7.8039 119.4915 59.0863 30.2148 177.3250 481 Y 4.5459 7.9352 114.8695 56.7033 39.1604 175.7118 482 Q 3.6258 8.9230 117.9515 56.8635 26.5848 174.8091 483 G 2.8169 7.6452 106.1793 45.7158 0.0000 173.8571 484 K 4.5345 6.9866 118.8829 52.8568 35.8026 180.2769 *486 F 4.5921 8.2684 112.8604 59.3055 40.0755 176.2764 487 D 4.7651 8.5067 125.5830 53.1255 38.6629 176.8969 488 E 4.0344 8.4890 123.7466 61.2390 30.1748 178.7214 489 D 4.6116 8.2305 119.6179 57.1099 40.6500 179.0613 490 S 4.1706 8.2096 114.0222 61.4059 63.4110 176.4271 491 I 4.0066 7.8100 123.5191 64.2408 37.0730 178.5395 492 L 4.1461 8.2317 119.9288 57.6292 41.1874 179.7345 493 G 3.7212 7.8715 104.2008 46.9808 0.0000 174.8885 494 E 4.2710 7.9006 119.2177 59.0439 30.1736 176.6029 495 L 4.4804 7.5453 118.8615 53.6252 44.0864 175.1232 496 N 5.2139 8.2993 116.4340 50.8589 41.6796 175.0293 497 G 3.7219 8.5286 106.2432 47.7276 0.0000 173.7289 498 P 4.2566 0.0000 0.0000 65.2183 31.3690 178.7380 499 L 3.9592 7.8060 117.1513 57.7151 41.6284 179.3730 500 R 3.8690 8.1080 118.7002 59.5058 30.0326 178.4890 501 E 3.9543 8.3444 118.4906 59.2476 29.3954 178.9615 502 E 3.9548 8.1821 119.5144 59.1242 29.6607 178.9649 503 I 3.7157 7.7491 120.2257 64.3732 37.2851 178.8432 504 V 3.6606 7.8650 120.0237 64.8854 30.9846 178.1900 505 N 4.2277 7.9700 116.3631 55.6910 38.6089 177.0220 506 F 4.1887 8.2088 122.1801 61.4303 39.4337 177.2487 507 N 4.3500 8.5565 114.7815 55.5060 38.5109 176.1333 508 C 4.5036 7.6766 118.7793 59.8472 28.5643 175.9904 509 R 3.8060 7.4827 125.3525 61.5038 28.5607 182.9162 510 K 4.0297 7.7242 118.5432 59.1968 32.5986 177.9648 511 L 4.1580 7.8509 119.9364 58.3240 41.7808 178.7393 512 V 3.6488 7.8478 116.6550 66.2460 31.5008 177.5630 513 A 4.1794 7.9208 119.1317 54.5828 18.7179 178.4861 514 S 4.3802 7.9612 113.3982 58.3842 63.2221 174.3859 *516 P 4.3835 0.0000 0.0000 63.5027 33.4887 178.7624 517 L 3.7790 8.0387 118.8941 58.3471 42.1769 178.0931 518 F 4.6694 7.8752 115.9543 60.1758 39.5381 177.6974 519 A 4.0101 8.3474 122.1345 55.2046 18.0696 177.8038 520 N 4.7293 8.0510 109.4425 52.9988 38.6268 174.6100 521 A 4.6219 7.5375 122.2506 49.8401 21.4979 176.7594 522 D 4.4465 8.3824 118.6540 53.8582 41.7769 175.0087 523 P 4.2169 0.0000 0.0000 66.1341 31.2600 178.3707 524 N 4.3845 9.1035 115.5040 55.9205 38.1668 177.3668 525 F 3.0714 7.7525 121.5963 60.8999 39.5421 176.8263 526 V 3.2023 7.6213 115.8647 66.3146 31.4249 177.6144 527 T 3.8497 7.8159 114.8887 66.3670 67.7528 176.8599 528 A 4.1405 7.4975 118.3750 53.3275 18.2070 178.8619 *530 L 3.6730 7.8226 121.7484 56.1427 43.5649 179.5345 531 T 3.8463 7.7707 114.0930 66.2355 68.3863 175.4265 532 K 4.2572 7.2785 118.4630 57.3431 32.6143 177.2317 533 L 4.6090 7.5540 121.6037 55.2166 42.6087 177.3584 534 K 4.7544 9.0153 125.5405 53.2054 34.9062 175.3707 535 F 4.7080 9.1094 128.7831 57.3451 40.2179 174.3163 536 E 4.4037 8.7506 124.6757 54.4791 34.1748 174.2584 537 V 4.6924 7.9157 122.4873 61.0967 33.7803 174.5783 538 F 4.8491 9.3641 126.0951 55.8381 42.5172 174.4348 539 Q 4.0900 9.7814 120.9869 53.0035 31.5324 173.5804 540 P 4.1896 0.0000 0.0000 64.7567 31.6377 176.7636 541 G 3.9208 9.0429 112.3518 45.0850 0.0000 173.5730 542 D 4.5021 8.0381 120.5327 54.8678 42.0743 175.4993 543 Y 4.4049 8.6314 120.8528 57.2932 37.8244 175.4380 544 I 3.7232 8.4795 127.1443 63.4401 38.0920 177.1702 545 I 4.7663 7.4916 121.1216 59.4989 41.2485 174.5025 546 R 4.9621 8.4534 124.5853 53.9163 32.6521 175.4344 547 E 3.9577 8.8967 125.4086 57.6714 30.1308 177.3224 548 G 3.9772 8.9741 113.7339 45.5321 0.0000 173.7350 549 T 4.4145 7.2141 109.8622 60.5856 71.1772 174.0927 550 I 4.1866 8.2588 123.4452 61.1633 37.6941 175.8567 551 G 4.0258 8.3277 117.1543 45.3871 0.0000 174.2310 552 K 4.7092 8.6029 126.2806 54.2490 33.7803 173.6521 553 K 5.0965 7.3204 118.7523 55.6749 34.9574 177.8721 *555 Y 4.4305 8.1668 111.3126 59.6622 39.6685 174.3429 556 F 5.1291 9.1578 122.0283 55.8557 41.9622 174.8580 557 I 4.5161 9.2195 128.1956 61.6086 37.4141 177.4075 558 Q 4.3329 9.2463 128.9538 58.6365 28.8658 172.8007 559 H 5.1314 8.1404 118.2782 55.2648 33.5292 172.5294 560 G 4.2623 7.5929 110.4180 43.2863 0.0000 172.1811 561 V 4.6539 8.3754 118.9165 61.0519 34.6645 174.7836 562 V 4.7532 8.7397 120.1749 59.5844 35.6427 174.5018 563 S 4.8325 8.5680 119.3390 56.7723 65.1473 173.2638 564 V 4.3840 8.3049 127.3182 62.0355 33.1555 174.8998 565 L 4.8883 8.9061 130.3229 53.7763 43.8104 173.5061 566 T 4.1162 8.8353 122.6959 64.5754 70.0436 175.7364 *571 E 4.3774 7.8372 116.4256 56.1280 31.1770 177.4171 *573 K 4.4602 8.2237 123.7299 54.9449 33.5840 174.8071 574 L 4.8501 8.5766 119.6898 53.8484 46.2128 176.3656 575 S 5.2233 8.0001 116.5761 56.3239 67.4231 172.0240 576 D 4.7022 8.8090 118.9065 56.9101 40.7771 177.6681 577 G 4.2036 9.1239 112.0124 46.7363 0.0000 173.1361 578 S 4.9586 8.0889 115.8916 57.0699 65.5443 172.4570 579 Y 5.4718 7.7413 118.3404 55.7456 41.7149 173.6892 580 F 5.3097 8.2237 114.2521 57.1385 40.5841 174.7025 581 G 4.0854 9.3790 107.0214 45.7998 0.0000 175.1749 582 E 3.8563 8.0313 119.1758 58.6771 29.6309 178.9071 583 I 3.7162 7.7749 120.7676 64.8195 37.2335 177.9606 584 C 4.1528 8.0047 116.5466 62.4829 27.7540 175.9121 585 L 3.9869 7.0359 116.7105 56.9737 41.0889 178.6516 586 L 4.3781 7.3258 118.5100 56.7183 42.1283 178.2912 587 T 4.2603 8.1084 108.4153 61.3025 69.4815 175.5444 588 R 4.0389 8.1321 118.9211 57.0239 28.9502 176.8094 589 G 4.2720 7.8579 107.4445 46.2414 0.0000 173.6268 590 R 5.1278 8.4384 122.0980 54.2347 32.7628 176.8136 591 R 4.1282 9.0082 121.3774 57.1913 30.6770 177.8820 592 T 4.0617 8.7981 112.6797 62.7387 69.5175 173.4699 593 A 4.4348 7.3038 121.8846 51.8457 22.1449 175.4188 594 S 4.8945 8.8882 115.6254 57.4144 65.5641 174.3121 595 V 4.5140 8.8108 122.3198 61.3999 34.1556 174.3814 596 R 4.8008 8.1882 126.8091 53.9691 33.2998 175.4299 597 A 4.1502 8.6071 124.9512 52.2478 18.9661 178.1219 598 D 4.4755 9.0932 123.4707 56.1325 42.1178 176.1414 599 T 4.7996 7.3498 105.9807 59.7498 72.1634 173.1935 600 Y 4.1459 8.7700 118.4469 58.6734 38.7670 175.7225 601 C 5.0921 9.2886 120.4553 58.1487 32.2465 173.2004 602 R 4.8269 9.3972 123.7841 54.8634 31.3498 175.3717 603 L 5.4606 9.0662 123.7079 53.0228 46.6500 175.2495 604 Y 5.3236 9.0997 117.2989 56.5614 41.1259 175.5683 605 S 4.8792 9.3993 119.5559 56.7815 66.3092 172.9776 606 L 5.0281 7.7469 122.0225 53.4460 45.2089 175.9704 607 S 4.5902 8.7742 120.8935 57.5628 64.2941 175.3838 608 V 3.5813 8.4155 122.4175 65.1905 30.8892 178.5178 609 D 4.3582 8.0210 118.9134 57.3841 40.8195 178.3629 610 N 4.4249 8.1500 116.5577 55.9067 38.5112 177.2546 611 F 4.1464 8.5942 122.6341 61.6616 39.3209 177.1145 612 N 4.3033 8.4093 114.6648 55.8340 38.6282 176.9265 613 E 4.3266 8.1743 122.3985 58.7807 29.7857 178.9948 614 V 3.7019 7.8787 118.2447 66.0882 31.5619 177.7487 615 L 4.4143 7.8120 117.5467 56.8305 41.3027 179.1249 616 E 3.9403 8.0218 119.4255 58.9810 29.1444 178.3376 617 E 4.0345 8.0026 117.6901 57.0605 31.3031 175.7598 618 Y 4.6935 7.4225 114.7007 55.2313 38.0561 174.0937 619 P 4.6853 0.0000 0.0000 61.8227 31.2331 176.1518 *622 R 4.5954 8.1259 122.5383 55.9984 32.2568 177.4972 623 R 4.3903 8.3186 118.3403 58.6907 29.6622 178.1212 624 A 3.9198 7.8957 120.1507 55.2040 18.3305 179.5063 625 F 4.4285 7.9829 117.1253 60.1132 38.9922 177.7072 626 E 4.0900 8.5786 118.3897 59.6139 29.2666 179.3901 627 T 3.8778 8.1382 115.8197 66.7988 68.5816 176.7048 628 V 3.5911 7.6187 119.6092 65.8762 31.4346 177.8628 629 A 4.0291 8.4102 120.6319 55.2976 18.2922 179.6195 630 I 3.6631 8.3184 118.5883 64.7600 37.0787 178.3932 631 D 4.3842 8.2202 119.6024 57.5678 40.4089 179.1716 632 R 3.9974 7.8677 117.5585 58.9879 30.1875 178.7132 633 L 4.2154 8.2210 120.9582 58.2102 41.6016 179.6720 634 D 4.5235 7.8755 120.5526 58.4150 39.9439 179.4837 635 R 4.2946 7.5146 122.9947 56.2916 30.0299 176.5168 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 443 D 8.32 4.65 0.00 2.62 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 0.00 444 S 8.10 4.12 0.00 3.81 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 0.00 445 S 8.76 4.15 0.00 3.23 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 446 R 7.67 4.13 0.00 2.06 2.02 0.00 3.40 0.00 0.00 3.22 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.51 0.00 447 R 7.97 3.90 0.00 1.90 2.07 0.00 3.09 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 448 Q 8.04 3.89 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.58 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 449 Y 7.88 3.97 0.00 3.07 3.17 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 0.00 450 Q 8.33 3.95 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.59 0.00 0.00 0.00 0.00 0.00 2.54 2.81 0.00 451 E 8.38 3.93 0.00 1.96 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 0.00 2.31 2.57 0.00 452 K 8.14 3.83 0.00 1.90 1.77 0.00 1.44 0.00 0.00 1.52 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.40 7.81 453 Y 8.22 3.56 0.00 2.30 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 0.00 454 K 7.76 3.86 0.00 1.83 1.80 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.35 7.81 455 Q 7.73 4.09 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.74 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 456 V 7.27 3.49 1.48 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 0.59 0.00 0.00 0.64 0.00 0.00 457 E 7.46 3.94 0.00 2.09 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.24 0.00 458 Q 8.00 4.40 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.05 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 459 Y 8.37 4.35 0.00 3.03 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 *461 S 8.01 4.42 0.00 3.72 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 0.00 462 F 8.54 4.11 0.00 2.89 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 0.00 463 H 8.04 4.31 0.00 3.02 3.16 0.00 5.86 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 464 K 7.66 3.82 0.00 1.79 1.80 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.29 1.37 7.81 465 L 7.85 4.17 0.00 1.78 1.81 0.97 1.40 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 0.00 466 P 0.00 4.41 0.00 2.24 2.03 0.00 3.62 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 2.11 2.17 0.00 467 A 8.83 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 0.00 468 D 8.15 4.42 0.00 2.70 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 469 F 8.30 4.46 0.00 3.16 3.29 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 0.00 470 R 8.17 3.96 0.00 2.16 2.05 0.00 3.24 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.04 0.00 471 Q 8.15 4.07 0.00 2.25 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 472 K 7.85 4.01 0.00 1.97 1.64 0.00 1.75 0.00 0.00 1.61 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.46 7.81 473 I 7.79 3.74 2.09 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 0.83 0.94 1.18 0.00 0.00 474 H 8.43 4.69 0.00 3.48 3.53 0.00 5.83 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 0.00 475 D 8.79 4.44 0.00 3.02 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 0.00 476 Y 8.46 4.16 0.00 3.31 3.25 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 0.00 477 Y 8.50 4.03 0.00 3.19 3.28 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 0.00 478 E 8.09 3.91 0.00 1.99 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 0.00 2.22 2.43 0.00 479 H 7.92 3.89 0.00 3.22 3.21 0.00 5.65 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 0.00 480 R 7.80 3.63 0.00 0.67 0.80 0.00 2.90 0.00 0.00 2.70 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 481 Y 7.94 4.55 0.00 3.38 3.33 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 0.00 482 Q 8.92 3.63 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.72 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 483 G 7.65 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 0.00 0.00 0.00 484 K 6.99 4.53 0.00 1.73 1.56 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.75 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.28 1.26 7.81 *486 F 8.27 4.59 0.00 3.04 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 564 V 8.30 4.38 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 0.87 0.00 0.00 0.73 0.00 0.00 565 L 8.91 4.89 0.00 1.30 1.47 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 566 T 8.84 4.12 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 1.26 0.00 0.00 *571 E 7.84 4.38 0.00 2.01 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 0.00 2.13 1.84 0.00 *573 K 8.22 4.46 0.00 1.56 1.67 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.05 7.81 574 L 8.58 4.85 0.00 1.50 1.56 0.93 0.71 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 0.00 575 S 8.00 5.22 0.00 3.73 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 0.00 576 D 8.81 4.70 0.00 2.72 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 0.00 577 G 9.12 4.20 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 0.00 578 S 8.09 4.96 0.00 3.99 3.76 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 0.00 579 Y 7.74 5.47 0.00 2.55 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 580 F 8.22 5.31 0.00 2.98 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 0.00 581 G 9.38 4.09 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 0.00 582 E 8.03 3.86 0.00 2.13 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 0.00 2.50 2.70 0.00 583 I 7.77 3.72 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.73 0.93 0.00 0.00 584 C 8.00 4.15 0.00 2.94 3.12 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 0.00 585 L 7.04 3.99 0.00 1.20 0.91 0.76 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 586 L 7.33 4.38 0.00 1.75 1.77 1.06 1.09 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 0.00 587 T 8.11 4.26 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 1.25 0.00 0.00 588 R 8.13 4.04 0.00 1.97 2.10 0.00 3.16 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 589 G 7.86 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 0.00 0.00 0.00 0.00 590 R 8.44 5.13 0.00 1.70 1.94 0.00 3.58 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 591 R 9.01 4.13 0.00 1.87 2.05 0.00 3.34 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.89 0.00 592 T 8.80 4.06 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 1.22 0.00 0.00 593 A 7.30 4.43 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 0.00 594 S 8.89 4.89 0.00 3.81 3.97 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 0.00 595 V 8.81 4.51 1.67 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 0.04 0.00 0.00 0.67 0.00 0.00 596 R 8.19 4.80 0.00 1.45 1.36 0.00 2.43 0.00 0.00 2.77 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.90 0.00 597 A 8.61 4.15 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 0.00 598 D 9.09 4.48 0.00 2.58 2.67 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 0.00 599 T 7.35 4.80 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 1.21 0.00 0.00 600 Y 8.77 4.15 0.00 2.88 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 0.00 601 C 9.29 5.09 0.00 2.92 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 0.00 602 R 9.40 4.83 0.00 1.91 2.20 0.00 3.18 0.00 0.00 3.32 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 603 L 9.07 5.46 0.00 1.74 1.87 0.86 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 604 Y 9.10 5.32 0.00 3.15 2.98 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 0.00 0.00 0.00 605 S 9.40 4.88 0.00 3.36 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 0.00 606 L 7.75 5.03 0.00 1.95 1.57 1.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 607 S 8.77 4.59 0.00 4.04 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 0.00 608 V 8.42 3.58 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 0.80 0.00 0.00 0.95 0.00 0.00 609 D 8.02 4.36 0.00 2.81 2.78 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 0.00 0.00 0.00 0.00 610 N 8.15 4.42 0.00 2.82 2.91 0.00 0.00 6.70 7.45 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 0.00 611 F 8.59 4.15 0.00 3.06 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 0.00 612 N 8.41 4.30 0.00 2.78 2.89 0.00 0.00 7.08 8.44 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 0.00 613 E 8.17 4.33 0.00 2.19 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 2.18 0.00 614 V 7.88 3.70 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 1.22 0.00 0.00 0.98 0.00 0.00 615 L 7.81 4.41 0.00 1.57 1.59 0.06 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 616 E 8.02 3.94 0.00 2.22 1.96 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 2.31 2.58 0.00 617 E 8.00 4.03 0.00 1.80 1.84 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 1.47 1.98 0.00 618 Y 7.42 4.69 0.00 3.08 2.66 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 0.00 0.00 0.00 0.00 619 P 0.00 4.69 0.00 2.01 2.04 0.00 3.72 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.24 0.00 *622 R 8.13 4.60 0.00 1.88 2.10 0.00 3.24 0.00 0.00 3.48 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.80 0.00 623 R 8.32 4.39 0.00 1.93 1.91 0.00 3.28 0.00 0.00 3.30 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.58 0.00 624 A 7.90 3.92 1.01 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 0.00 0.00 625 F 7.98 4.43 0.00 3.45 3.25 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 0.00 626 E 8.58 4.09 0.00 2.27 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 2.44 2.64 0.00 627 T 8.14 3.88 4.41 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 1.22 0.00 0.00 628 V 7.62 3.59 2.41 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 0.99 0.00 0.00 0.90 0.00 0.00 629 A 8.41 4.03 1.48 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 0.00 0.00 630 I 8.32 3.66 2.03 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.85 0.93 0.00 0.00 631 D 8.22 4.38 0.00 2.92 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 0.00 632 R 7.87 4.00 0.00 1.95 2.00 0.00 3.30 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 633 L 8.22 4.22 0.00 1.79 1.75 0.95 1.33 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 0.00 634 D 7.88 4.52 0.00 2.80 2.58 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 0.00 0.00 0.00 0.00 635 R 7.51 4.29 0.00 1.89 1.87 0.00 3.15 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 * Residues marked with a * may have inaccurate shift predictions.