NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 475 G 3.8849 8.3549 109.7281 45.3505 0.0000 172.7599 476 L 4.3487 8.0939 119.5111 51.8280 43.4025 175.2303 477 F 4.2272 8.6464 125.0673 57.0282 41.5496 175.0382 478 D 4.7176 7.4345 127.0122 52.6116 41.7286 176.5375 479 L 4.4249 8.4459 128.1603 57.4135 41.8042 179.1279 480 K 3.9566 8.2087 119.0356 59.6161 32.1053 178.3261 481 A 4.0403 8.1375 119.4677 55.3603 18.3411 179.1376 482 A 4.2168 7.8818 117.4988 53.5082 18.4671 178.4949 483 G 3.7742 8.4336 105.6520 45.4560 0.0000 173.4221 484 F 4.4157 7.8030 117.5946 56.7554 39.7863 175.9237 485 K 4.2882 9.0233 125.1256 58.7317 33.0044 177.3767 486 D 4.9364 8.5258 119.3507 51.9737 41.0888 171.7766 487 P 5.0038 0.0000 0.0000 61.9574 33.2560 176.3062 488 L 4.6908 8.8364 121.8573 53.3589 44.3235 175.2113 489 L 5.0094 8.3355 121.3509 53.1372 43.4934 175.6684 490 A 4.9065 8.5156 125.7111 50.3493 21.6503 175.6072 491 S 5.1098 7.7351 113.7670 56.6647 66.6056 173.2151 492 G 4.2278 8.2469 105.3520 45.8213 0.0000 171.8865 493 T 5.1343 8.4679 115.4236 60.3953 70.4574 172.4428 494 D 4.7735 8.5262 125.6277 53.3668 46.2354 173.9647 495 G 4.4621 8.2991 105.9065 44.6738 0.0000 173.0979 496 V 3.7999 8.6169 119.0712 63.1396 32.4604 177.7534 497 G 3.8694 7.9373 107.9962 45.6455 0.0000 174.3193 498 T 4.3362 8.3939 112.3944 61.8381 69.5293 176.0499 499 K 3.1752 7.9670 124.8783 59.9605 31.6825 178.2773 500 L 3.8579 7.5191 119.0613 57.4921 41.4198 179.4362 501 K 3.9647 7.8144 119.7742 59.3678 32.0265 179.0115 502 I 3.2583 7.5483 119.4136 64.0858 37.1058 177.7974 503 A 3.9329 7.6199 121.3979 55.4652 18.2299 179.8163 504 Q 3.9927 8.1480 116.4058 59.0030 28.5778 178.7304 505 L 4.0468 8.0045 119.0994 57.9429 41.8392 178.7955 506 C 4.2670 7.9341 112.9864 58.7382 29.2556 172.8076 507 N 4.1044 7.6495 118.4905 54.8100 37.2841 175.8581 508 K 4.4211 7.9067 115.9478 54.9286 33.7840 176.3060 509 H 4.8884 8.2642 118.2343 55.2366 30.5500 176.1974 510 D 4.4554 8.1808 120.6383 56.6799 41.1138 177.5635 511 T 4.5909 7.5951 106.1569 60.9625 69.8766 175.5014 512 I 4.0186 6.9198 123.8728 63.6644 37.7633 177.9267 513 G 3.5000 7.9258 106.4750 47.4602 0.0000 175.3830 514 Q 3.8181 7.8085 121.3704 58.9995 29.0710 177.6408 515 D 4.3024 7.7916 119.4696 57.3897 41.0011 178.6986 516 L 3.9987 7.7150 120.3213 58.1987 42.0887 179.0735 517 V 2.9403 7.6918 117.8797 65.6716 31.3284 177.6681 518 A 3.8474 8.1018 120.7718 55.4631 18.0687 179.2728 519 M 4.0761 8.0906 117.0970 59.0187 31.9588 178.9729 520 C 4.2221 7.9597 116.0111 63.0396 28.3755 176.6775 521 V 3.6830 8.0817 114.2539 64.3208 30.5895 178.4659 522 N 4.3886 8.3986 116.5538 56.1464 38.0666 177.2467 523 D 4.4971 7.7064 120.2603 57.2797 41.2616 178.3921 524 I 3.9247 7.6330 113.4148 63.3534 37.8180 177.6021 525 L 3.9676 8.2353 123.4331 57.4185 41.4475 178.9076 526 A 4.1013 7.4348 118.7256 54.7605 18.5448 178.6717 527 Q 4.5451 7.4778 116.2549 55.4062 28.9260 177.2630 528 G 3.9200 7.9961 108.5881 44.9071 0.0000 173.4326 529 A 4.4853 7.5147 122.5570 50.8723 20.1901 176.1633 530 E 4.6032 8.7681 123.1918 54.7613 30.8800 174.1946 531 P 4.4531 0.0000 0.0000 63.2627 31.6754 175.7732 532 L 4.5905 8.9567 124.5112 56.1698 43.6340 176.3780 533 F 5.4737 7.0771 110.9101 56.0825 41.1287 172.7162 534 F 5.4701 9.5998 121.4519 56.7578 43.1483 173.2797 535 L 5.7964 8.6644 123.8665 51.8087 46.1427 175.1128 536 D 5.3541 8.6483 120.4031 51.7283 43.3048 173.6559 537 Y 5.0461 9.2081 122.2294 56.1016 41.3349 174.1111 538 F 5.4154 9.2775 130.8879 56.7290 41.0101 173.6186 539 S 5.1656 8.8921 121.6167 56.6361 65.4418 173.0333 540 C 4.5330 8.6325 116.6318 56.8306 33.2096 174.8612 541 G 3.9693 8.5918 108.2700 45.7290 0.0000 172.5782 542 K 4.2316 8.7405 119.6294 56.6737 32.7622 176.7425 543 L 5.0641 8.2695 124.3890 52.1868 45.2470 176.7466 544 D 4.5344 8.3952 120.4397 54.4318 42.7601 177.9260 545 L 4.0022 8.4509 122.4868 58.0737 41.7491 180.1227 546 S 4.1924 7.9755 113.6255 60.9893 63.0659 176.7245 547 V 3.4460 7.5423 121.6343 66.1219 31.5734 177.6018 548 T 3.9993 7.6518 115.3555 67.0332 68.2625 176.2433 549 E 3.9520 8.1587 119.8102 59.3691 29.6157 179.3528 550 A 3.9274 7.8147 120.3619 54.9188 18.5448 179.6468 551 V 3.2943 7.6677 116.7608 66.2797 31.5147 178.5314 552 V 3.5004 7.5747 117.2198 65.8168 31.2837 177.8316 553 A 4.0807 8.3352 121.0250 55.0708 18.1304 179.8276 554 G 3.5702 7.8404 105.2181 47.2503 0.0000 175.9027 555 I 3.5491 7.5587 121.4356 64.1456 37.2586 178.0970 556 A 4.0117 7.9089 121.4044 55.3017 18.1613 179.8550 557 K 3.8483 8.3406 116.7889 59.5921 32.0781 179.4435 558 A 3.9158 8.1884 121.3215 55.2503 18.2212 179.4026 559 C 4.0253 8.1278 115.3164 62.8124 28.0822 176.3952 560 G 3.6855 7.9054 107.0351 47.9263 0.0000 175.6485 561 K 3.8875 7.7468 119.6551 59.1321 32.2050 179.1404 562 A 4.1604 8.0288 119.5298 53.0021 18.2336 178.3101 563 G 3.8373 7.6723 105.2129 45.9590 0.0000 172.7866 564 C 5.1226 7.7339 112.8261 55.6602 32.6319 173.3528 565 A 4.3206 8.6920 122.4908 51.7447 19.5237 176.8344 566 L 4.7617 8.7132 124.7177 54.9310 41.8859 176.1728 567 L 4.5265 9.6268 126.2318 53.8458 42.6426 177.0399 568 G 4.1458 7.6807 110.2337 45.1522 0.0000 171.0532 569 G 4.3926 7.5520 105.7172 46.0701 0.0000 172.4307 570 E 4.8311 8.7394 120.4064 54.8036 33.5430 173.7873 571 T 4.7583 8.5200 122.6793 61.7192 70.6546 173.6502 572 A 4.4294 8.7951 128.7425 49.8554 21.5257 174.2975 573 E 4.3982 8.5850 123.3337 56.8805 30.7227 176.6981 574 M 4.7660 9.7102 127.0688 52.7039 33.4497 173.7875 575 P 4.2902 0.0000 0.0000 65.4258 31.8837 177.3831 576 D 4.5859 8.0744 115.1515 55.3528 41.1697 176.2379 577 M 4.2924 7.9781 118.1473 55.8438 33.6919 175.4766 578 Y 4.7971 7.5431 114.1851 55.3525 42.1263 173.2446 579 P 4.5671 0.0000 0.0000 61.1750 32.3546 174.0302 580 P 4.5115 0.0000 0.0000 64.8178 31.4495 177.2942 581 G 4.0105 9.2437 111.5024 45.0802 0.0000 172.5769 582 E 4.9245 8.3093 121.3313 53.9398 31.8348 174.2149 583 Y 4.8497 7.7503 122.5648 55.5908 41.7060 173.1592 584 D 5.1718 9.2067 119.2831 52.4893 45.2171 174.2402 585 L 5.5159 8.6289 121.2019 52.8748 45.1568 175.7536 586 A 4.7696 9.2954 124.8715 50.0037 22.1395 175.2518 587 G 4.3675 8.9404 109.0087 44.3642 0.0000 172.0889 588 F 5.4461 8.2283 118.9353 55.5438 43.4458 173.7144 589 A 5.2456 9.0236 124.4905 50.0629 22.6631 174.7887 590 V 4.3788 8.2695 120.7436 60.9230 34.7296 174.7836 591 G 4.3191 8.9013 113.3732 44.7646 0.0000 170.6123 592 A 5.5446 8.7341 119.4287 51.3196 22.9238 175.2461 593 M 5.2182 8.1014 115.7263 53.9911 35.0749 173.8070 594 E 4.5393 9.6102 119.3692 56.3678 30.3111 178.3667 595 R 3.8775 8.1653 121.8063 59.9868 30.1601 178.4346 596 D 4.5770 8.0094 116.3072 55.5818 39.8543 177.3628 597 Q 4.2884 7.6507 117.8448 55.4512 29.2030 175.8490 598 K 4.2474 7.3576 121.8168 56.5018 32.7308 175.7618 599 L 4.9043 8.7125 124.9143 52.0152 46.1091 174.3760 600 P 4.4615 0.0000 0.0000 62.9302 32.6704 176.5103 601 H 4.8616 8.9041 119.1278 53.6858 27.9450 175.4204 602 L 3.9807 7.9998 123.0069 57.8974 42.1542 179.9793 603 E 4.0527 8.1855 116.4851 59.1440 29.4949 178.1613 604 R 4.1865 7.9601 116.4548 57.4004 30.5960 176.6049 605 I 4.3517 7.3639 119.3617 60.7346 38.1811 175.0894 606 T 4.6765 8.8752 118.4419 59.5737 70.6990 172.4706 607 E 4.2067 8.6273 125.9106 58.0950 29.8689 177.3180 608 G 4.0109 9.2229 114.9449 45.0393 0.0000 173.4839 609 D 4.5778 7.7965 119.4682 54.6332 42.2543 175.5130 610 V 4.2995 9.1853 121.7785 61.5836 34.0112 174.8342 611 V 4.5738 8.5261 127.4757 61.4485 33.1807 174.4223 612 V 4.5901 8.7584 129.5582 61.6276 33.2602 174.6044 613 G 4.2678 9.2138 115.8738 44.7199 0.0000 172.2469 614 I 4.8282 8.3315 125.8499 59.1959 39.1719 175.2398 615 A 4.8505 8.6740 129.6373 52.7747 18.7367 177.6219 616 S 4.8982 8.8730 117.8166 57.6318 64.5419 174.5652 617 S 4.6086 9.5377 113.5052 58.6721 64.4408 174.3938 618 G 3.9852 7.2004 110.7609 44.8411 0.0000 176.1309 619 L 4.2502 8.4102 122.2155 56.2147 43.0223 178.2358 620 H 4.1677 7.5336 113.8795 57.4928 28.1778 175.4854 621 S 4.9066 9.1743 121.2853 59.0518 63.8117 172.8242 622 N 5.2013 8.3367 115.5489 52.9229 42.2345 174.9066 623 G 3.9552 9.1090 108.6875 46.1101 0.0000 175.2028 624 F 4.2845 8.3368 119.2894 59.3726 39.0955 177.6471 625 S 4.1726 8.2087 113.1595 61.2497 62.3246 175.6678 626 L 3.9915 7.9032 122.5953 58.0286 41.8654 178.5100 627 V 3.6809 7.9472 118.2454 66.5746 31.4373 178.2840 628 R 4.2537 8.3405 118.7820 58.6816 29.6551 179.3457 629 K 4.0693 7.8603 117.2604 59.3537 32.3638 179.2827 630 I 3.8266 7.9331 120.0933 64.3508 37.1245 178.4052 631 V 3.6671 8.1151 119.1223 66.2600 31.0462 177.7679 632 A 4.0828 7.8242 118.8751 54.4005 18.2041 178.6684 633 K 4.4517 7.6319 113.6023 55.3778 33.0571 176.5045 634 S 4.6236 7.4843 115.1247 57.1441 64.2738 174.3503 635 S 4.4256 8.5267 113.6070 59.0026 63.2731 173.8768 636 L 4.7087 7.6794 120.9697 53.1388 43.9227 175.6173 637 Q 4.4687 8.3263 122.8430 54.1496 30.7951 176.0524 638 Y 4.1803 8.1852 118.9131 60.9949 37.9207 179.0732 639 S 4.3798 8.0328 112.2804 59.9217 63.9549 174.6150 640 S 4.3351 7.7496 118.1867 57.7411 63.7950 172.0392 641 P 4.4893 0.0000 0.0000 62.9998 31.6522 176.2353 642 A 4.0299 8.4963 125.6349 50.9663 18.6916 175.8745 643 P 4.1860 0.0000 0.0000 62.2313 31.8395 175.2870 644 D 4.4106 8.4983 117.7169 56.4204 40.8141 177.4445 645 G 3.8994 9.0015 112.0630 46.8999 0.0000 173.0894 646 C 4.6505 7.8735 113.7419 58.7640 29.3537 175.3239 647 G 3.9812 8.3989 104.6796 45.6436 0.0000 174.7874 648 D 4.6419 7.9968 119.9683 52.1122 39.3438 175.3027 649 Q 4.5025 7.2789 120.0689 53.7210 32.2356 174.9440 650 T 4.6730 8.4250 109.7253 60.7357 71.0063 175.3640 651 L 3.8146 8.5249 122.9430 58.1482 41.9340 179.0745 652 G 3.8224 8.5406 106.0089 48.0823 0.0000 175.2430 653 D 4.3506 7.6939 119.7307 56.8481 41.2823 178.2658 654 L 4.0527 7.7491 120.6389 58.4431 41.8878 179.1922 655 L 4.1442 7.9866 117.3182 57.3793 41.6475 178.6623 656 L 4.4286 7.8017 116.4651 53.9359 41.9702 176.8381 657 T 3.8096 7.1588 116.0659 63.2194 68.7470 172.1048 658 P 4.5882 0.0000 0.0000 62.3776 32.0997 176.3623 659 T 3.6309 8.9179 117.7194 63.9543 68.8496 174.5371 660 R 3.7851 7.9915 125.0526 56.1722 30.6314 176.1656 661 I 3.9137 7.9388 123.4250 60.7718 37.7737 175.3302 662 Y 4.8047 9.0817 122.9526 58.2432 38.8427 178.1830 663 S 4.0972 8.0118 116.8190 61.6423 63.2868 175.8696 664 H 4.2344 8.2081 118.8186 58.5543 30.0592 176.3023 665 S 4.3205 8.1197 112.8161 60.5035 63.5368 175.3583 666 L 4.3558 8.2015 120.1727 55.1709 41.8399 178.2591 667 L 3.8490 7.2482 120.8349 58.0194 41.7102 177.3124 668 P 4.2831 0.0000 0.0000 65.2450 31.3873 178.6061 669 V 3.7024 7.5362 116.8015 66.0724 31.1339 177.8315 670 L 4.0281 7.9401 118.6719 57.9591 41.2279 179.5331 671 R 4.1037 8.1683 116.9607 58.0387 30.0970 178.4360 672 S 4.2644 7.4728 113.9439 59.6122 62.7594 175.6375 673 G 3.8193 7.7457 108.0722 45.7461 0.0000 173.1981 674 H 4.7384 7.9202 114.2558 55.1486 29.3135 174.1070 675 V 4.1859 7.5413 120.3087 61.4865 32.0632 175.6920 676 K 4.3997 9.0020 127.8706 59.2682 33.3034 176.8591 677 A 4.8203 7.6123 118.5535 51.0368 22.5520 175.0272 678 F 5.2679 8.8229 120.8649 56.3691 42.6856 173.7498 679 A 4.7732 8.1706 126.9663 50.2748 21.8381 174.2973 680 H 4.7414 9.0957 123.1393 55.7963 31.0710 174.6242 681 I 4.3548 8.6284 127.9515 59.3116 37.5920 175.1259 682 T 4.6856 8.2774 121.2863 60.7221 68.4168 176.3996 683 G 3.8336 8.8139 109.5163 46.7968 0.0000 173.1653 684 G 4.1043 8.2586 111.7352 45.0965 0.0000 174.6022 685 G 3.9566 7.9675 108.5419 45.7802 0.0000 175.0281 686 L 3.9413 8.4288 117.1790 57.9018 42.0152 179.4691 687 L 4.0717 7.5206 116.6960 57.3422 41.7750 178.4322 688 E 4.2156 8.1629 118.2319 58.5423 29.9208 177.9420 689 N 4.4223 7.9370 116.3243 55.7969 38.7407 177.6758 690 I 3.7838 7.3390 120.3049 63.9230 37.2221 176.5137 691 P 4.2975 0.0000 0.0000 65.7132 30.8383 178.6375 692 R 4.1031 7.5555 114.4898 58.0570 29.9470 177.6884 693 V 4.3430 7.5429 109.6778 60.7903 32.4310 175.2251 694 L 4.6931 7.4032 119.8305 52.1004 43.4753 174.8673 695 P 4.3631 0.0000 0.0000 62.5142 32.0683 177.1773 696 E 3.8332 8.8476 123.3762 59.5389 29.8184 178.3402 697 K 4.2765 8.0592 115.3629 57.0278 32.6932 175.8775 698 L 5.0198 8.0255 119.6333 53.1587 44.3092 176.4207 699 G 4.4517 8.8051 109.1213 44.8648 0.0000 171.2455 700 V 5.0665 8.3723 118.2922 61.3324 35.6536 175.1448 701 D 5.2491 8.9758 127.1317 52.7926 42.9539 175.2066 702 L 5.2869 9.1689 124.1826 52.9576 45.3598 175.3852 703 D 5.1160 9.0757 120.6855 52.4435 43.4038 176.3650 704 A 2.0000 8.6777 129.7316 53.6615 18.4666 178.8268 705 Q 3.8927 7.5933 113.9888 57.7286 28.9711 177.0695 706 T 4.2030 7.4945 108.0518 61.4217 69.5343 174.1183 707 W 3.4225 6.6143 117.0881 53.7165 31.1806 174.4423 708 R 3.9339 6.4695 119.2335 55.4408 30.1636 175.5955 709 I 4.4382 8.0201 126.4546 59.0631 37.9098 173.8413 710 P 4.4703 0.0000 0.0000 63.0182 31.9563 178.0230 711 R 4.0982 8.6248 120.3158 58.7851 29.9670 179.5190 712 V 3.5455 7.7300 119.1530 65.0374 31.0403 178.3116 713 F 4.1555 7.6117 117.6737 60.2040 38.6937 177.8177 714 S 4.1535 8.1532 114.4095 61.2667 62.6452 176.2194 715 W 4.1127 8.3064 130.9701 60.5867 30.4498 177.9550 716 L 3.6764 8.0975 118.7651 57.6726 40.9877 179.2873 717 Q 3.9587 8.0814 119.4164 59.2594 28.5161 178.4508 718 Q 3.7821 7.8714 118.8972 58.9566 28.5563 178.5267 719 E 3.7107 7.5971 118.3656 58.8389 29.5205 178.9075 720 G 3.7875 7.6546 101.9350 43.6309 0.0000 172.9719 721 H 3.9896 7.1726 116.4468 56.5625 26.7112 174.8905 722 L 4.4109 7.9616 118.1898 53.7157 43.1985 178.6382 723 S 4.4472 8.3577 118.1004 57.6880 65.2501 175.1709 724 E 3.9421 8.6432 121.4713 59.6372 29.1339 179.2905 725 E 3.8903 8.1035 118.5687 59.1927 29.6624 178.1610 726 E 3.8498 8.1185 119.2422 59.5660 29.6289 178.4355 727 M 4.1823 8.1646 118.3700 58.7830 31.6667 178.8345 728 A 3.9888 8.3862 120.8889 54.8793 18.6272 179.3182 729 R 4.1675 8.3197 116.8305 58.3283 29.9352 177.9452 730 T 3.9918 7.3021 113.6883 64.1947 70.0103 174.6064 731 F 5.2880 7.6961 118.1367 55.3038 41.6916 175.7229 732 N 4.3339 8.8429 119.7247 54.1729 37.5007 175.7617 733 C 2.4500 8.3480 114.3207 60.5465 25.9304 173.5964 734 G 4.1500 8.2500 108.9408 45.3416 0.0000 174.1804 735 V 4.3599 7.2398 119.3666 61.0090 31.3951 175.2171 736 G 4.2082 9.2905 115.8165 47.7587 0.0000 171.5056 737 A 4.8821 7.3856 120.2071 50.7537 22.8144 175.2287 738 V 4.6318 8.0818 119.0839 60.9247 35.1902 174.3945 739 L 5.2440 8.7866 126.4774 52.9247 45.2082 175.3455 740 V 4.8270 8.4793 122.8705 61.3708 33.3291 175.0134 741 V 4.9452 8.7707 126.9106 59.7214 35.4081 175.3003 742 S 4.8897 8.5144 115.7288 57.3969 64.0423 175.1750 743 K 3.8869 8.8288 121.5219 60.1027 31.5521 179.3345 744 E 4.0128 8.2226 116.7291 58.8895 29.7336 178.3026 745 Q 4.3813 7.7230 115.3965 56.0214 29.2143 177.5496 746 T 3.8180 7.4449 118.1527 66.7379 68.4976 175.5976 747 E 3.8935 8.1299 120.2823 59.6023 29.7252 178.6183 748 Q 3.9390 8.0054 118.8971 58.9154 29.0650 177.8680 749 I 3.6766 7.7094 120.9884 64.4126 37.2226 178.2325 750 L 3.9391 8.0963 119.8404 57.8172 41.4560 179.7752 751 R 3.9948 8.3149 118.2626 59.2276 29.9251 179.1065 752 G 3.7690 8.4701 105.7155 48.0638 0.0000 175.5723 753 I 3.7143 8.0070 122.8926 64.0611 37.1279 178.3211 754 Q 4.0784 8.0856 120.2600 59.4293 28.6635 178.4163 755 Q 4.0904 8.0597 117.8431 58.5385 28.6762 177.1791 756 H 4.6539 7.5962 115.7121 54.7765 29.0801 175.0750 757 K 3.8661 7.8177 118.4348 57.8210 29.8039 175.2405 758 E 4.7985 7.8723 116.2770 54.6970 32.5452 175.1257 759 E 4.5124 8.3946 121.2296 54.5845 32.0232 174.3940 760 A 5.2032 7.2807 125.7808 51.0215 22.4819 175.0656 761 W 5.2092 8.4275 117.7670 54.7506 34.3969 174.7851 762 V 4.4314 8.7330 122.4117 63.3039 31.0169 175.5463 763 I 4.9872 8.6427 122.2226 59.8650 39.3645 176.0936 764 G 4.3624 7.3297 109.4493 46.4229 0.0000 171.3521 765 S 5.0515 7.6556 113.4069 56.8327 67.1870 173.7146 766 V 4.5249 8.9213 122.4752 62.7932 32.4659 175.3477 767 V 4.9975 8.6918 125.9557 59.5034 35.2614 174.7195 768 A 4.4881 9.5407 124.0007 52.4963 19.0632 177.0748 769 R 4.4793 7.7915 117.3754 54.1867 32.4516 174.8327 *774 P 4.1462 0.0000 0.0000 62.2069 32.9023 176.7122 775 R 4.0510 8.7413 123.4250 59.0683 31.0575 175.9921 776 V 4.8442 7.7144 117.4179 61.0426 33.4113 174.7731 777 K 4.5425 8.8583 127.1923 54.7475 34.7507 175.5105 778 V 4.7326 8.3183 125.2421 60.6025 31.7986 174.3638 779 K 3.9526 8.9909 128.4023 56.6403 33.6393 176.4018 780 N 4.7028 8.8212 120.9512 54.1476 36.3631 176.2211 781 L 3.7588 7.8503 120.9913 58.4130 42.1208 178.9209 782 I 3.6762 8.0283 119.5384 64.2932 36.8919 177.9525 783 E 3.8840 8.1643 119.0075 59.8931 29.1162 179.5589 784 S 3.9651 8.1640 111.7041 60.6167 62.4556 174.9980 785 M 4.3884 7.3675 117.0882 54.5440 32.1051 176.4229 786 Q 4.0252 7.8173 120.6940 55.9492 29.2779 175.7871 787 I 4.0380 8.1658 124.2090 60.1019 38.0273 175.2508 788 N 4.3606 8.7455 124.4838 53.6091 39.1051 175.6468 789 G 3.7075 8.7097 114.3976 47.5279 0.0000 173.8922 790 S 4.5281 8.6258 115.5477 57.9695 62.9533 173.9194 791 V 4.2735 7.4757 121.1158 60.9814 32.4541 175.4393 792 L 4.3512 8.4334 126.6672 55.8110 40.4116 176.2709 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 475 G 8.35 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 0.00 0.00 0.00 476 L 8.09 4.35 0.00 1.67 1.56 0.90 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 477 F 8.65 4.23 0.00 2.68 2.97 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 0.00 478 D 7.43 4.72 0.00 2.60 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 0.00 0.00 0.00 0.00 479 L 8.45 4.42 0.00 1.87 1.91 0.96 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 480 K 8.21 3.96 0.00 1.86 1.95 0.00 1.76 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.55 7.81 481 A 8.14 4.04 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 0.00 482 A 7.88 4.22 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 0.00 0.00 0.00 0.00 0.00 483 G 8.43 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 0.00 484 F 7.80 4.42 0.00 3.15 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 0.00 485 K 9.02 4.29 0.00 1.79 1.89 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.43 7.81 486 D 8.53 4.94 0.00 2.78 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 0.00 487 P 0.00 5.00 0.00 1.86 1.74 0.00 3.83 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.01 0.00 488 L 8.84 4.69 0.00 1.53 1.56 0.91 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 489 L 8.34 5.01 0.00 1.43 1.46 0.89 0.58 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 0.00 490 A 8.52 4.91 1.17 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 0.00 0.00 491 S 7.74 5.11 0.00 3.80 3.70 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 0.00 492 G 8.25 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 0.00 0.00 0.00 0.00 493 T 8.47 5.13 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 1.24 0.00 0.00 494 D 8.53 4.77 0.00 2.64 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 0.00 495 G 8.30 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 496 V 8.62 3.80 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 0.68 0.00 0.00 0.90 0.00 0.00 497 G 7.94 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 0.00 0.00 0.00 498 T 8.39 4.34 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 1.26 0.00 0.00 499 K 7.97 3.18 0.00 0.79 1.50 0.00 0.97 0.00 0.00 1.56 0.00 0.00 2.76 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.07 0.54 7.81 500 L 7.52 3.86 0.00 1.49 1.32 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 501 K 7.81 3.96 0.00 1.92 1.81 0.00 1.50 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.49 7.81 502 I 7.55 3.26 1.87 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.48 0.60 0.00 0.00 503 A 7.62 3.93 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 504 Q 8.15 3.99 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.72 0.00 0.00 0.00 0.00 0.00 2.39 2.25 0.00 505 L 8.00 4.05 0.00 1.43 1.58 0.88 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 506 C 7.93 4.27 0.00 2.82 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 0.00 507 N 7.65 4.10 0.00 2.79 2.82 0.00 0.00 6.90 6.42 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 0.00 508 K 7.91 4.42 0.00 1.64 1.64 0.00 1.66 0.00 0.00 1.82 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.44 7.81 509 H 8.26 4.89 0.00 3.13 3.25 0.00 5.62 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 510 D 8.18 4.46 0.00 2.76 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 0.00 511 T 7.60 4.59 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 512 I 6.92 4.02 1.87 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.56 0.97 0.00 0.00 513 G 7.93 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 514 Q 7.81 3.82 0.00 2.04 2.19 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 2.44 2.34 0.00 515 D 7.79 4.30 0.00 2.86 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 0.00 516 L 7.71 4.00 0.00 1.77 1.79 0.95 1.06 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 0.00 517 V 7.69 2.94 1.75 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 0.66 0.00 0.00 0.09 0.00 0.00 518 A 8.10 3.85 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 0.00 519 M 8.09 4.08 0.00 2.10 2.36 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.95 0.00 520 C 7.96 4.22 0.00 3.22 3.13 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 0.00 521 V 8.08 3.68 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 0.80 0.00 0.00 0.93 0.00 0.00 522 N 8.40 4.39 0.00 2.49 2.64 0.00 0.00 6.95 7.90 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 0.00 523 D 7.71 4.50 0.00 2.89 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 0.00 524 I 7.63 3.92 1.80 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 1.61 0.73 0.87 0.00 0.00 525 L 8.24 3.97 0.00 1.73 1.67 0.71 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 526 A 7.43 4.10 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 527 Q 7.48 4.55 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.31 0.00 0.00 0.00 0.00 0.00 2.34 2.22 0.00 528 G 8.00 3.92 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 0.00 0.00 0.00 529 A 7.51 4.49 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 0.00 530 E 8.77 4.60 0.00 2.16 2.17 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 2.39 2.35 0.00 531 P 0.00 4.45 0.00 1.96 1.94 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 532 L 8.96 4.59 0.00 0.93 0.57 0.46 1.18 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 0.00 533 F 7.08 5.47 0.00 3.21 3.11 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 0.00 0.00 0.00 534 F 9.60 5.47 0.00 3.07 2.94 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 0.00 535 L 8.66 5.80 0.00 1.59 1.50 1.10 0.75 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 0.00 536 D 8.65 5.35 0.00 2.84 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 0.00 537 Y 9.21 5.05 0.00 3.32 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 0.00 538 F 9.28 5.42 0.00 3.04 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 0.00 539 S 8.89 5.17 0.00 4.12 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 0.00 540 C 8.63 4.53 0.00 2.77 2.63 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 0.00 541 G 8.59 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 0.00 0.00 0.00 542 K 8.74 4.23 0.00 1.74 1.76 0.00 1.62 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.67 1.49 7.81 543 L 8.27 5.06 0.00 1.52 1.51 0.81 1.32 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 0.00 544 D 8.40 4.53 0.00 2.69 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 0.00 545 L 8.45 4.00 0.00 1.67 1.70 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 546 S 7.98 4.19 0.00 4.04 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 0.00 547 V 7.54 3.45 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 0.81 0.00 0.00 0.95 0.00 0.00 548 T 7.65 4.00 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 1.21 0.00 0.00 549 E 8.16 3.95 0.00 2.01 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 2.51 0.00 550 A 7.81 3.93 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 0.00 551 V 7.67 3.29 1.74 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 -0.02 0.00 0.00 0.40 0.00 0.00 552 V 7.57 3.50 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 0.97 0.00 0.00 1.08 0.00 0.00 553 A 8.34 4.08 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 0.00 554 G 7.84 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 555 I 7.56 3.55 1.99 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 1.40 0.86 1.00 0.00 0.00 556 A 7.91 4.01 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 0.00 557 K 8.34 3.85 0.00 1.92 1.82 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.65 7.81 558 A 8.19 3.92 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.13 4.03 0.00 3.14 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 560 G 7.91 3.69 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 0.00 0.00 0.00 561 K 7.75 3.89 0.00 1.85 1.84 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.63 7.81 562 A 8.03 4.16 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 0.00 563 G 7.67 3.84 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 0.00 0.00 0.00 564 C 7.73 5.12 0.00 3.09 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 0.00 565 A 8.69 4.32 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.71 4.76 0.00 1.77 1.72 1.24 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 567 L 9.63 4.53 0.00 1.61 1.59 0.32 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 568 G 7.68 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 569 G 7.55 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 0.00 0.00 0.00 0.00 570 E 8.74 4.83 0.00 2.12 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 2.11 2.28 0.00 571 T 8.52 4.76 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 0.65 0.00 0.00 572 A 8.80 4.43 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 573 E 8.58 4.40 0.00 1.85 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 2.24 2.42 0.00 574 M 9.71 4.77 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.57 0.00 575 P 0.00 4.29 0.00 2.05 2.16 0.00 3.69 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 576 D 8.07 4.59 0.00 2.67 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 0.00 577 M 7.98 4.29 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.38 0.00 578 Y 7.54 4.80 0.00 3.04 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 0.00 579 P 0.00 4.57 0.00 2.23 2.00 0.00 3.78 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.14 0.00 580 P 0.00 4.51 0.00 2.06 2.05 0.00 3.73 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 2.06 2.14 0.00 581 G 9.24 4.01 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 0.00 582 E 8.31 4.92 0.00 2.11 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 0.00 2.24 2.24 0.00 583 Y 7.75 4.85 0.00 3.18 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 0.00 584 D 9.21 5.17 0.00 2.91 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 0.00 585 L 8.63 5.52 0.00 1.56 1.54 0.89 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 586 A 9.30 4.77 1.15 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 0.00 0.00 587 G 8.94 4.37 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 0.00 588 F 8.23 5.45 0.00 2.71 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 0.00 589 A 9.02 5.25 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 590 V 8.27 4.38 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 0.53 0.00 0.00 0.66 0.00 0.00 591 G 8.90 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 592 A 8.73 5.54 0.29 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 0.00 0.00 593 M 8.10 5.22 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.53 0.00 594 E 9.61 4.54 0.00 2.27 2.10 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 2.38 2.37 0.00 595 R 8.17 3.88 0.00 1.87 2.00 0.00 3.27 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 596 D 8.01 4.58 0.00 2.87 2.80 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 0.00 597 Q 7.65 4.29 0.00 2.27 2.20 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 2.40 2.38 0.00 598 K 7.36 4.25 0.00 1.75 1.68 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.54 1.39 7.81 599 L 8.71 4.90 0.00 1.69 1.48 0.94 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 600 P 0.00 4.46 0.00 2.08 2.07 0.00 3.72 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 2.00 0.00 601 H 8.90 4.86 0.00 3.16 3.28 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 602 L 8.00 3.98 0.00 1.71 1.75 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 603 E 8.19 4.05 0.00 1.95 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 0.00 2.33 2.42 0.00 604 R 7.96 4.19 0.00 1.93 1.99 0.00 3.10 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 605 I 7.36 4.35 1.88 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 1.20 0.51 0.92 0.00 0.00 606 T 8.88 4.68 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 0.00 607 E 8.63 4.21 0.00 1.97 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 2.30 2.48 0.00 608 G 9.22 4.01 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 0.00 609 D 7.80 4.58 0.00 2.78 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 610 V 9.19 4.30 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 1.02 0.00 0.00 0.95 0.00 0.00 611 V 8.53 4.57 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 0.88 0.00 0.00 0.92 0.00 0.00 612 V 8.76 4.59 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 0.92 0.00 0.00 0.93 0.00 0.00 613 G 9.21 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 0.00 614 I 8.33 4.83 1.41 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.54 0.74 0.00 0.00 615 A 8.67 4.85 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 0.00 616 S 8.87 4.90 0.00 3.60 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 0.00 617 S 9.54 4.61 0.00 4.07 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 0.00 618 G 7.20 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 0.00 619 L 8.41 4.25 0.00 1.84 1.75 0.59 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 620 H 7.53 4.17 0.00 3.58 2.59 0.00 5.61 0.00 0.00 0.00 0.00 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 621 S 9.17 4.91 0.00 3.88 3.98 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 0.00 622 N 8.34 5.20 0.00 2.89 2.76 0.00 0.00 7.04 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 0.00 623 G 9.11 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 0.00 624 F 8.34 4.28 0.00 3.24 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 625 S 8.21 4.17 0.00 3.96 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 0.00 626 L 7.90 3.99 0.00 1.78 1.84 0.95 0.85 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 0.00 627 V 7.95 3.68 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.71 0.00 0.00 628 R 8.34 4.25 0.00 2.08 2.14 0.00 3.48 0.00 0.00 3.56 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.89 0.00 629 K 7.86 4.07 0.00 1.97 1.90 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.82 7.81 630 I 7.93 3.83 2.02 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 1.36 1.12 0.62 0.00 0.00 631 V 8.12 3.67 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 0.18 0.00 0.00 1.09 0.00 0.00 632 A 7.82 4.08 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 633 K 7.63 4.45 0.00 1.71 1.82 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.65 7.81 634 S 7.48 4.62 0.00 4.21 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 635 S 8.53 4.43 0.00 4.04 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 0.00 636 L 7.68 4.71 0.00 1.70 1.52 0.69 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 637 Q 8.33 4.47 0.00 2.10 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 638 Y 8.19 4.18 0.00 3.18 2.97 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 0.00 639 S 8.03 4.38 0.00 4.00 4.03 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 0.00 0.00 0.00 0.00 640 S 7.75 4.34 0.00 3.85 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 0.00 641 P 0.00 4.49 0.00 1.88 1.96 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 642 A 8.50 4.03 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 643 P 0.00 4.19 0.00 2.11 1.97 0.00 3.29 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.46 0.00 644 D 8.50 4.41 0.00 2.70 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 0.00 645 G 9.00 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 0.00 0.00 0.00 646 C 7.87 4.65 0.00 2.95 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 647 G 8.40 3.98 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 0.00 0.00 0.00 648 D 8.00 4.64 0.00 2.66 2.63 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 0.00 649 Q 7.28 4.50 0.00 2.32 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.96 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 650 T 8.43 4.67 4.47 0.00 0.00 0.00 0.00 0.00 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 0.00 651 L 8.52 3.81 0.00 1.50 1.83 0.09 0.83 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 0.00 652 G 8.54 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 653 D 7.69 4.35 0.00 2.84 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 0.00 654 L 7.75 4.05 0.00 1.68 1.72 0.83 0.46 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 0.00 655 L 7.99 4.14 0.00 1.94 2.01 1.14 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 656 L 7.80 4.43 0.00 1.80 1.67 0.90 0.66 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 0.00 657 T 7.16 3.81 4.28 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 1.28 0.00 0.00 658 P 0.00 4.59 0.00 2.12 2.14 0.00 3.78 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 1.96 1.95 0.00 659 T 8.92 3.63 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 1.00 0.00 0.00 660 R 7.99 3.79 0.00 1.37 1.36 0.00 3.31 0.00 0.00 3.57 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.75 0.00 661 I 7.94 3.91 1.77 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 1.28 0.35 0.87 0.00 0.00 662 Y 9.08 4.80 0.00 3.15 2.97 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 0.00 663 S 8.01 4.10 0.00 3.86 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 0.00 664 H 8.21 4.23 0.00 3.08 3.35 0.00 5.92 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 665 S 8.12 4.32 0.00 4.23 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 0.00 666 L 8.20 4.36 0.00 1.84 1.75 0.91 0.77 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 0.00 667 L 7.25 3.85 0.00 1.92 1.62 0.87 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 668 P 0.00 4.28 0.00 1.87 2.06 0.00 3.66 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.07 0.00 669 V 7.54 3.70 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 1.08 0.00 0.00 0.87 0.00 0.00 670 L 7.94 4.03 0.00 1.82 1.67 0.61 0.85 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 0.00 671 R 8.17 4.10 0.00 1.86 1.97 0.00 3.34 0.00 0.00 3.28 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.76 0.00 672 S 7.47 4.26 0.00 4.06 4.04 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 0.00 673 G 7.75 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 674 H 7.92 4.74 0.00 3.18 3.30 0.00 5.65 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 675 V 7.54 4.19 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 0.93 0.00 0.00 1.04 0.00 0.00 676 K 9.00 4.40 0.00 1.94 1.87 0.00 1.77 0.00 0.00 1.78 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.42 7.81 677 A 7.61 4.82 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 678 F 8.82 5.27 0.00 2.97 2.80 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 0.00 679 A 8.17 4.77 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 680 H 9.10 4.74 0.00 3.49 3.37 0.00 5.74 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 0.00 681 I 8.63 4.35 1.95 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.96 0.88 0.00 0.00 682 T 8.28 4.69 4.37 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 1.04 0.00 0.00 683 G 8.81 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 684 G 8.26 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 0.00 685 G 7.97 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 0.00 686 L 8.43 3.94 0.00 1.70 1.68 0.89 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 687 L 7.52 4.07 0.00 1.66 1.72 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 688 E 8.16 4.22 0.00 2.18 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 2.26 2.33 0.00 689 N 7.94 4.42 0.00 2.81 2.81 0.00 0.00 7.00 8.39 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 0.00 690 I 7.34 3.78 1.83 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 1.43 0.72 0.87 0.00 0.00 691 P 0.00 4.30 0.00 2.14 2.11 0.00 3.66 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 2.21 2.18 0.00 692 R 7.56 4.10 0.00 2.05 2.01 0.00 3.12 0.00 0.00 3.38 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 693 V 7.54 4.34 2.10 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 0.81 0.00 0.00 0.95 0.00 0.00 694 L 7.40 4.69 0.00 1.61 1.58 0.96 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 695 P 0.00 4.36 0.00 2.18 1.97 0.00 3.64 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 2.25 2.23 0.00 696 E 8.85 3.83 0.00 1.90 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 0.00 2.31 2.45 0.00 697 K 8.06 4.28 0.00 1.86 1.82 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.51 1.46 7.81 698 L 8.03 5.02 0.00 1.47 1.56 0.93 0.74 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 0.00 699 G 8.81 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 0.00 700 V 8.37 5.07 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 0.96 0.00 0.00 0.97 0.00 0.00 701 D 8.98 5.25 0.00 2.72 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 0.00 702 L 9.17 5.29 0.00 1.79 1.83 0.89 0.74 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 0.00 703 D 9.08 5.12 0.00 2.67 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 704 A 8.68 2.00 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 0.00 705 Q 7.59 3.89 0.00 1.93 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.78 0.00 0.00 0.00 0.00 0.00 2.18 2.37 0.00 706 T 7.49 4.20 4.44 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 0.00 0.00 0.00 1.21 0.00 0.00 707 W 6.61 3.42 0.00 1.94 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 0.00 708 R 6.47 3.93 0.00 1.83 2.03 0.00 3.36 0.00 0.00 3.32 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 709 I 8.02 4.44 1.85 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.34 1.06 0.00 0.00 710 P 0.00 4.47 0.00 2.28 2.08 0.00 4.10 0.00 0.00 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.36 0.00 711 R 8.62 4.10 0.00 2.00 2.00 0.00 3.22 0.00 0.00 3.53 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 712 V 7.73 3.55 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 0.09 0.00 0.00 0.67 0.00 0.00 713 F 7.61 4.16 0.00 3.21 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 0.00 714 S 8.15 4.15 0.00 3.92 4.02 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 0.00 715 W 8.31 4.11 0.00 3.34 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 0.00 716 L 8.10 3.68 0.00 1.78 1.63 0.39 0.64 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 0.00 717 Q 8.08 3.96 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.51 2.56 0.00 718 Q 7.87 3.78 0.00 2.19 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 719 E 7.60 3.71 0.00 1.17 1.43 0.00 0.00 0.00 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 1.47 0.00 720 G 7.65 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 721 H 7.17 3.99 0.00 3.23 3.31 0.00 5.85 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 0.00 722 L 7.96 4.41 0.00 1.68 1.65 1.15 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 723 S 8.36 4.45 0.00 4.04 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 724 E 8.64 3.94 0.00 2.03 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 2.39 2.37 0.00 725 E 8.10 3.89 0.00 2.02 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 0.00 2.36 2.35 0.00 726 E 8.12 3.85 0.00 2.07 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 0.00 2.31 2.28 0.00 727 M 8.16 4.18 0.00 2.18 2.30 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.96 0.00 728 A 8.39 3.99 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 0.00 729 R 8.32 4.17 0.00 2.11 1.85 0.00 3.03 0.00 0.00 3.14 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 730 T 7.30 3.99 3.13 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 0.50 0.00 0.00 731 F 7.70 5.29 0.00 3.06 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 0.00 732 N 8.84 4.33 0.00 3.18 3.12 0.00 0.00 6.07 7.68 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 0.00 733 C 8.35 2.45 0.00 3.14 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 0.00 734 G 8.25 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 735 V 7.24 4.36 1.51 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 0.48 0.00 0.00 -0.60 0.00 0.00 736 G 9.29 4.21 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 0.00 737 A 7.39 4.88 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 738 V 8.08 4.63 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 0.84 0.00 0.00 0.72 0.00 0.00 739 L 8.79 5.24 0.00 1.54 1.51 0.95 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 740 V 8.48 4.83 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 0.99 0.00 0.00 0.91 0.00 0.00 741 V 8.77 4.95 2.10 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 0.76 0.00 0.00 0.95 0.00 0.00 742 S 8.51 4.89 0.00 4.14 4.04 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 0.00 743 K 8.83 3.89 0.00 1.82 1.92 0.00 1.68 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.55 1.66 7.81 744 E 8.22 4.01 0.00 1.91 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 0.00 2.31 2.47 0.00 745 Q 7.72 4.38 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.76 0.00 0.00 0.00 0.00 0.00 2.28 2.50 0.00 746 T 7.44 3.82 4.43 0.00 0.00 0.00 0.00 0.00 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 0.00 747 E 8.13 3.89 0.00 2.07 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 2.38 2.43 0.00 748 Q 8.01 3.94 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.68 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 749 I 7.71 3.68 2.02 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 1.67 0.84 0.91 0.00 0.00 750 L 8.10 3.94 0.00 1.82 1.69 0.94 1.13 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 0.00 751 R 8.31 3.99 0.00 1.99 1.98 0.00 3.14 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 1.64 1.75 0.00 752 G 8.47 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 0.00 753 I 8.01 3.71 1.95 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.20 0.89 0.00 0.00 754 Q 8.09 4.08 0.00 2.08 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 755 Q 8.06 4.09 0.00 2.18 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.11 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 756 H 7.60 4.65 0.00 3.05 3.41 0.00 5.99 0.00 0.00 0.00 0.00 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 757 K 7.82 3.87 0.00 1.95 1.92 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.39 7.81 758 E 7.87 4.80 0.00 1.86 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 2.32 2.46 0.00 759 E 8.39 4.51 0.00 1.91 1.56 0.00 0.00 0.00 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 1.96 0.00 760 A 7.28 5.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 761 W 8.43 5.21 0.00 3.41 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 0.00 762 V 8.73 4.43 2.18 0.00 0.00 0.00 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 0.98 0.00 0.00 763 I 8.64 4.99 2.17 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.09 1.20 0.00 0.00 764 G 7.33 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 0.00 0.00 0.00 0.00 765 S 7.66 5.05 0.00 3.98 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 766 V 8.92 4.52 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.98 0.00 0.00 767 V 8.69 5.00 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 0.91 0.00 0.00 0.97 0.00 0.00 768 A 9.54 4.49 1.29 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 0.00 0.00 769 R 7.79 4.48 0.00 1.92 1.85 0.00 3.37 0.00 0.00 3.31 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 *774 P 0.00 4.15 0.00 2.22 2.02 0.00 3.69 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.07 0.00 775 R 8.74 4.05 0.00 1.89 1.92 0.00 3.14 0.00 0.00 3.26 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 776 V 7.71 4.84 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 0.97 0.00 0.00 777 K 8.86 4.54 0.00 1.75 1.68 0.00 1.82 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.47 7.81 778 V 8.32 4.73 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 0.95 0.00 0.00 1.01 0.00 0.00 779 K 8.99 3.95 0.00 1.95 1.62 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.40 7.81 780 N 8.82 4.70 0.00 2.91 2.77 0.00 0.00 7.25 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 0.00 781 L 7.85 3.76 0.00 1.71 1.63 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 782 I 8.03 3.68 1.84 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 1.66 0.78 0.89 0.00 0.00 783 E 8.16 3.88 0.00 2.11 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 2.36 2.41 0.00 784 S 8.16 3.97 0.00 3.56 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 0.00 785 M 7.37 4.39 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.66 0.00 786 Q 7.82 4.03 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 787 I 8.17 4.04 1.88 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 1.31 0.78 0.92 0.00 0.00 788 N 8.75 4.36 0.00 2.70 2.69 0.00 0.00 7.11 8.15 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 0.00 789 G 8.71 3.71 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 0.00 0.00 0.00 790 S 8.63 4.53 0.00 3.94 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 0.00 791 V 7.48 4.27 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 0.82 0.00 0.00 0.92 0.00 0.00 792 L 8.43 4.35 0.00 1.73 1.58 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.