NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 501 R 4.2694 8.1085 117.2838 55.6316 31.7164 176.7520 502 A 3.4305 7.9996 121.1250 53.7826 18.0240 174.0533 503 V 3.7172 8.5806 118.3824 65.8901 32.0099 176.3431 504 R 3.9790 8.9791 118.8691 59.3698 29.7827 178.6050 505 A 4.1088 8.1329 118.4462 55.5572 18.4113 179.3610 506 V 3.7724 7.6646 114.9251 66.1108 31.7742 177.8447 507 F 4.2892 8.7492 117.9684 59.7330 38.6940 177.2941 508 E 4.7688 8.8331 114.9564 56.3738 29.6519 177.7712 509 E 4.6794 7.9906 116.4587 56.9782 31.6201 177.1844 510 K 3.8848 8.4332 122.6651 60.1715 32.5810 178.7261 511 E 3.8937 8.1987 118.0321 59.3791 29.4136 178.5117 512 R 3.4759 7.6800 116.5702 57.7481 29.9919 176.4846 513 F 4.6558 7.3299 116.0132 54.6816 40.6148 173.3189 514 P 4.3003 0.0000 0.0000 65.8603 31.5977 178.6391 515 G 3.8353 7.9208 106.8144 46.6122 0.0000 172.3866 516 L 3.8830 7.4157 122.7887 56.2595 42.1457 175.1948 517 V 4.3144 8.1165 121.0083 61.6870 33.1157 174.8075 518 D 4.7478 7.4109 116.6054 54.0655 44.2090 176.2546 519 V 4.4463 7.6121 115.9756 60.5714 32.3037 176.6982 520 V 3.5988 8.2726 122.3273 66.4016 31.9026 178.8697 521 S 4.1022 8.3613 115.3631 61.6516 63.2979 175.9765 522 N 4.4801 7.8171 118.2777 55.9612 38.3590 177.2670 523 L 4.5363 7.6123 116.7070 56.0540 40.9563 176.3863 524 I 4.7841 7.6743 117.7042 60.4962 41.6476 173.6909 525 E 4.7771 8.6910 127.5903 54.4486 32.3660 175.1253 526 V 4.4795 8.2451 124.2481 59.2665 33.7187 174.1674 527 D 4.2306 8.4174 125.2002 54.8177 41.7632 176.6115 528 E 3.6953 8.9843 128.2256 59.1357 29.3294 178.0396 529 K 3.3468 6.7221 116.9721 59.6616 32.7969 176.7564 530 Y 4.6895 6.4175 114.8872 57.8544 39.1517 178.2159 531 S 4.0798 7.8037 115.8677 61.5085 62.8701 174.3812 532 L 3.9102 7.9836 122.2578 58.1238 41.7954 178.5408 533 A 3.9496 7.9883 120.0220 55.2150 18.3950 179.4821 534 V 3.4803 7.6074 116.1629 66.1698 31.6053 177.7033 535 S 4.1085 8.3114 113.1510 62.0391 61.9341 176.9215 536 V 3.7008 7.5396 113.0164 64.1629 31.3045 178.1124 537 L 4.1418 7.6674 119.5999 57.8993 41.9367 178.8287 538 L 4.1088 8.2242 119.0916 58.5543 41.9884 178.5570 539 G 3.9650 8.8128 107.9457 45.4629 0.0000 176.1697 540 G 3.6583 8.6712 108.5579 48.4036 0.0000 174.8840 541 T 4.0969 8.1105 109.4881 63.8753 68.8710 174.9604 542 A 4.2174 7.8265 123.2934 53.4802 19.2823 178.5723 543 Q 4.5506 8.3291 114.0325 55.5005 30.3289 175.4982 544 N 4.7551 8.0601 117.5332 53.2910 39.4660 174.3185 545 I 4.4699 8.6019 124.6092 60.5058 39.0769 174.8808 546 V 4.5144 8.5653 127.3453 61.6659 32.8444 175.1382 547 V 4.5459 8.1034 120.5749 59.7301 34.4895 177.2076 548 R 4.1330 8.9578 122.0031 58.1803 30.8932 176.7970 549 N 5.9796 7.7696 113.8379 49.2738 40.4534 175.3431 550 V 3.5637 8.5445 118.8472 66.3130 31.6264 178.0025 551 D 4.3642 8.1236 118.2065 57.8506 40.6712 178.8623 552 T 4.0223 10.0960 116.1027 66.1792 68.3012 176.8218 553 A 3.9092 7.5935 122.5275 55.2546 18.4561 179.8897 554 K 3.9011 8.3408 116.9146 59.3895 32.0365 179.5272 555 A 4.1143 7.9825 121.1875 55.1600 18.2586 179.7569 556 I 3.6484 7.8870 118.2888 64.4922 37.1056 178.5133 557 V 3.6555 7.9559 119.2496 66.4736 31.4361 177.9711 558 E 4.0088 8.6907 118.3803 59.1459 29.2348 179.2107 559 F 4.3587 8.7277 121.1856 61.4443 39.5629 177.2289 560 L 3.5875 8.7259 119.1922 57.6170 41.1864 179.4813 561 K 3.8921 8.0754 117.6108 60.2059 32.0451 178.7812 562 Q 4.0722 7.7745 117.0238 58.7821 28.5002 177.9432 563 N 4.3585 8.2988 117.2685 53.9398 38.6409 175.7489 564 E 3.7521 8.4785 119.1708 56.9383 27.8768 175.9247 565 A 3.9707 7.2702 117.5495 52.9359 18.2582 176.8993 566 G 3.7076 7.1740 101.6200 44.3095 0.0000 173.5304 567 R 4.6888 8.1971 116.6676 54.7444 32.8890 175.1536 568 V 4.5046 7.7853 111.5725 60.8293 36.0246 173.7980 569 T 4.7089 8.3233 116.1890 62.0178 71.6199 173.4349 570 I 4.8397 8.4758 126.2392 59.6172 40.4011 175.8613 571 L 4.5056 9.6042 127.2407 51.8293 42.2345 172.0346 572 P 4.6587 0.0000 0.0000 62.3262 31.8932 177.7186 573 L 3.8208 8.8607 126.7437 56.8514 42.0205 177.8406 574 D 4.6613 7.5381 117.5083 53.2872 40.0521 177.5528 575 L 4.4642 7.8408 120.8502 55.7560 44.2828 176.9257 576 I 3.7635 7.5198 110.3619 60.6987 38.0466 174.3065 577 D 4.9185 8.8493 121.2577 52.8003 42.9839 176.5144 578 G 4.3688 8.6519 114.1072 45.2302 0.0000 173.0842 579 S 4.6725 8.3973 114.5746 57.8896 63.7323 173.4323 580 F 4.7116 7.4807 114.3873 56.8492 39.3616 172.9178 581 N 4.7093 8.7042 118.4430 51.3783 41.9640 175.0323 582 R 4.3027 8.4044 121.4101 56.0902 31.0455 175.8711 583 I 4.4706 8.5078 120.2093 59.3132 38.7577 175.9672 584 S 4.1377 8.6649 122.5521 59.8029 63.3948 173.2399 585 G 4.3042 9.3786 114.1405 46.2689 0.0000 175.7962 586 L 3.5661 7.6376 119.9804 57.3401 41.7337 179.3640 587 E 2.5400 7.5433 115.2383 58.2992 29.4374 177.2704 588 N 4.6190 7.6043 114.4534 53.1868 38.8528 175.2162 589 E 4.2426 7.7200 119.0670 56.0936 30.2127 176.0333 590 R 4.4328 8.3557 120.3342 56.8272 31.2239 176.5845 591 G 4.4225 9.2353 110.3749 46.4073 0.0000 173.1587 592 F 4.0544 7.1797 120.8373 59.1475 39.6785 174.1579 593 V 3.7385 8.0582 127.0680 62.6296 32.4882 176.0370 594 G 3.5541 5.6153 106.2805 45.0928 0.0000 170.6982 595 Y 4.4223 7.8244 116.3261 56.9237 38.5756 176.1448 596 A 3.4788 8.3037 123.6612 54.8206 18.2422 180.6622 597 V 3.4643 7.1987 115.6235 65.0491 31.4104 178.2710 598 D 4.4794 7.4216 117.5943 55.6819 40.3981 176.9380 599 L 4.6084 8.2154 119.9086 54.1685 42.7904 176.0616 600 V 4.7353 7.5145 117.3969 61.1106 35.1793 174.2454 601 K 4.6288 8.6298 125.8132 54.5656 35.5695 174.8230 602 F 5.4234 8.5182 123.7522 54.8049 42.9319 171.5045 603 P 4.0694 0.0000 0.0000 63.5788 30.2554 180.5458 604 S 3.2273 8.4236 117.6619 59.3986 64.9658 173.2469 605 D 4.5153 6.3668 124.2334 56.4819 38.6677 177.7917 606 L 4.3607 8.2254 120.0865 54.8373 41.8317 178.8860 607 E 4.2368 7.9521 121.3487 59.1812 29.9826 178.3070 608 V 3.6751 8.0843 117.6684 66.6762 31.0674 178.1217 609 L 3.8707 7.3091 115.9687 57.5683 41.3253 179.6292 610 G 4.7074 7.9850 105.8456 48.2584 0.0000 175.6950 611 G 4.2429 8.1132 108.6436 47.1103 0.0000 174.6127 612 F 4.5924 8.1876 123.6626 60.1521 39.4607 176.5588 613 L 3.4498 9.0814 121.3094 57.5961 41.5906 176.8815 614 F 4.7343 8.5880 113.9043 54.1156 42.9028 179.2190 615 G 3.9054 7.9386 108.4759 45.1374 0.0000 174.2938 616 N 4.8788 8.8420 120.1089 53.2474 38.2224 175.5485 617 S 4.5661 7.3640 114.5272 58.7287 63.9161 173.9022 618 V 4.5934 8.9181 121.9388 60.9924 35.2664 173.9405 619 V 4.8650 7.9256 122.5051 61.2259 34.6723 174.6017 620 V 4.5997 8.6311 118.5334 59.7664 36.0026 175.4198 621 E 4.0964 8.9679 121.0027 59.3893 29.8557 178.1724 622 T 4.8549 7.6570 106.2144 58.7869 72.7128 174.4387 623 L 3.8815 8.5670 121.6015 58.5685 42.0080 178.1466 624 D 4.4221 8.1061 118.3106 57.6892 40.8910 178.9343 625 D 4.3019 7.7001 118.3094 57.3641 40.8269 178.4355 626 A 3.9927 7.7160 120.6811 55.7685 18.2594 179.4625 627 I 3.6498 8.3779 118.3299 64.2836 36.9808 178.3348 628 R 3.8579 8.3753 119.8031 60.1654 30.0502 177.8608 629 M 4.3187 8.7802 117.8725 58.2986 32.3350 178.0838 630 K 4.0153 8.4285 120.2820 59.3830 32.0890 178.9515 631 K 4.0270 8.2601 118.6002 59.3252 32.2741 178.4225 632 K 3.9896 8.2242 120.3993 58.7535 31.4644 177.3483 633 Y 4.3049 8.6809 112.9721 58.0810 39.4233 176.5406 634 R 4.2570 7.9638 115.0601 56.2318 28.8127 176.9214 635 L 4.0533 7.7676 119.2160 56.2338 42.5464 177.4402 636 N 4.9601 8.8148 118.8502 52.1615 37.9567 174.0878 637 T 4.6070 7.3983 113.9704 60.9494 70.3106 173.5609 638 R 4.8489 8.2078 122.8939 55.1782 32.4405 175.9785 639 I 5.0667 8.1376 121.3264 59.9806 41.2411 173.9554 640 A 5.2397 9.1956 129.4768 50.2651 22.3438 175.0551 641 T 4.9396 8.0947 109.4486 59.9399 71.0684 175.6470 642 L 4.1791 9.0201 123.6433 58.2193 41.6029 178.8385 643 D 4.3492 7.5565 114.9115 55.9364 40.8309 176.9580 644 G 3.9641 8.2761 105.2997 45.2414 0.0000 173.6380 645 E 4.5438 8.2707 120.2727 56.5630 31.2310 175.2593 646 L 4.8802 8.4561 120.4737 54.3770 46.2202 174.1527 647 I 5.0686 8.3714 124.9362 59.1766 40.2719 175.3146 648 S 4.1878 9.0821 123.3491 58.1754 63.2065 176.1186 649 G 3.9683 8.7413 107.8728 47.7922 0.0000 175.2161 650 R 4.2342 7.8089 116.4930 56.1543 30.5631 176.8991 651 G 4.0208 8.1217 106.5933 44.8055 0.0000 173.3269 652 A 4.2834 8.7949 123.2584 51.4748 19.5424 177.0920 653 I 4.9204 8.3364 123.6755 60.2601 39.0980 175.5026 654 T 4.6974 8.7313 122.7895 61.9389 72.5202 173.2090 655 G 4.2004 8.3288 109.1196 45.5775 0.0000 173.6613 656 G 3.8565 8.7366 109.7560 45.5705 0.0000 173.7533 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 501 R 8.11 4.27 0.00 2.06 2.26 0.00 3.01 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 502 A 8.00 3.43 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 0.00 503 V 8.58 3.72 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 1.28 0.00 0.00 1.00 0.00 0.00 504 R 8.98 3.98 0.00 1.94 2.02 0.00 3.30 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 505 A 8.13 4.11 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 0.00 506 V 7.66 3.77 2.28 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 0.34 0.00 0.00 0.91 0.00 0.00 507 F 8.75 4.29 0.00 3.19 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 508 E 8.83 4.77 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.53 0.00 509 E 7.99 4.68 0.00 2.03 1.76 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 2.37 2.43 0.00 510 K 8.43 3.88 0.00 1.91 2.19 0.00 1.39 0.00 0.00 1.84 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.46 7.81 511 E 8.20 3.89 0.00 1.86 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 2.26 2.24 0.00 512 R 7.68 3.48 0.00 0.67 0.74 0.00 2.35 0.00 0.00 2.71 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.31 0.00 513 F 7.33 4.66 0.00 2.83 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 0.00 514 P 0.00 4.30 0.00 2.19 2.26 0.00 3.70 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.93 0.00 515 G 7.92 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 0.00 516 L 7.42 3.88 0.00 1.64 1.54 0.55 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 517 V 8.12 4.31 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.97 0.00 0.00 518 D 7.41 4.75 0.00 2.77 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.61 4.45 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 0.69 0.00 0.00 0.85 0.00 0.00 520 V 8.27 3.60 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 1.09 0.00 0.00 1.06 0.00 0.00 521 S 8.36 4.10 0.00 4.08 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 0.00 522 N 7.82 4.48 0.00 2.99 2.91 0.00 0.00 7.11 7.70 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 0.00 523 L 7.61 4.54 0.00 1.88 1.83 1.04 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 524 I 7.67 4.78 2.30 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.51 1.10 0.00 0.00 525 E 8.69 4.78 0.00 1.92 1.77 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 2.20 2.25 0.00 526 V 8.25 4.48 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 0.71 0.00 0.00 0.94 0.00 0.00 527 D 8.42 4.23 0.00 2.84 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 528 E 8.98 3.70 0.00 2.03 1.88 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 2.34 2.35 0.00 529 K 6.72 3.35 0.00 1.12 0.74 0.00 1.47 0.00 0.00 1.42 0.00 0.00 2.98 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.54 0.88 7.81 530 Y 6.42 4.69 0.00 2.97 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 0.00 531 S 7.80 4.08 0.00 3.95 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 0.00 532 L 7.98 3.91 0.00 1.74 1.66 0.91 1.32 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 0.00 533 A 7.99 3.95 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 0.00 534 V 7.61 3.48 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 1.05 0.00 0.00 0.90 0.00 0.00 535 S 8.31 4.11 0.00 3.99 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 0.00 536 V 7.54 3.70 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 0.92 0.00 0.00 1.10 0.00 0.00 537 L 7.67 4.14 0.00 1.94 1.90 0.87 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 538 L 8.22 4.11 0.00 1.88 1.73 1.03 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 539 G 8.81 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 0.00 0.00 0.00 540 G 8.67 3.66 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 0.00 0.00 0.00 541 T 8.11 4.10 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 1.25 0.00 0.00 542 A 7.83 4.22 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 0.00 543 Q 8.33 4.55 0.00 1.87 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.78 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 544 N 8.06 4.76 0.00 2.85 2.76 0.00 0.00 7.02 7.20 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 0.00 545 I 8.60 4.47 1.84 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 1.29 0.94 0.85 0.00 0.00 546 V 8.57 4.51 2.15 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 0.86 0.00 0.00 0.91 0.00 0.00 547 V 8.10 4.55 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.89 0.00 0.00 548 R 8.96 4.13 0.00 1.71 1.93 0.00 3.05 0.00 0.00 3.20 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 549 N 7.77 5.98 0.00 2.88 2.85 0.00 0.00 6.37 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 0.00 550 V 8.54 3.56 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 1.12 0.00 0.00 0.94 0.00 0.00 551 D 8.12 4.36 0.00 2.98 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 0.00 552 T 10.10 4.02 4.38 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 1.27 0.00 0.00 553 A 7.59 3.91 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 554 K 8.34 3.90 0.00 1.83 1.90 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.68 7.81 555 A 7.98 4.11 1.53 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 0.00 556 I 7.89 3.65 1.89 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.18 0.73 0.74 0.00 0.00 557 V 7.96 3.66 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.95 0.00 0.00 558 E 8.69 4.01 0.00 2.28 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 559 F 8.73 4.36 0.00 3.36 3.44 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 0.00 560 L 8.73 3.59 0.00 1.78 1.78 0.97 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 561 K 8.08 3.89 0.00 1.89 1.88 0.00 1.71 0.00 0.00 1.84 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.66 7.81 562 Q 7.77 4.07 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.93 0.00 0.00 0.00 0.00 0.00 2.41 2.66 0.00 563 N 8.30 4.36 0.00 2.37 2.66 0.00 0.00 7.29 7.70 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 0.00 564 E 8.48 3.75 0.00 2.06 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 2.20 2.41 0.00 565 A 7.27 3.97 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 0.00 566 G 7.17 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 0.00 567 R 8.20 4.69 0.00 1.77 1.82 0.00 3.20 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 568 V 7.79 4.50 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 0.69 0.00 0.00 0.91 0.00 0.00 569 T 8.32 4.71 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 570 I 8.48 4.84 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.56 0.83 0.00 0.00 571 L 9.60 4.51 0.00 1.40 1.17 0.98 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 572 P 0.00 4.66 0.00 2.18 2.15 0.00 3.65 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 573 L 8.86 3.82 0.00 1.56 1.71 0.89 0.80 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 0.00 574 D 7.54 4.66 0.00 2.88 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 0.00 575 L 7.84 4.46 0.00 1.51 1.60 0.91 1.33 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 0.00 576 I 7.52 3.76 1.17 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.54 0.48 0.00 0.00 577 D 8.85 4.92 0.00 2.77 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 0.00 578 G 8.65 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 0.00 579 S 8.40 4.67 0.00 4.03 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 0.00 580 F 7.48 4.71 0.00 3.19 3.09 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 0.00 581 N 8.70 4.71 0.00 2.65 2.65 0.00 0.00 6.99 7.66 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 0.00 582 R 8.40 4.30 0.00 1.68 1.63 0.00 3.00 0.00 0.00 2.92 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.58 0.00 583 I 8.51 4.47 1.87 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 1.38 0.94 0.99 0.00 0.00 584 S 8.66 4.14 0.00 3.90 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 0.00 585 G 9.38 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 0.00 0.00 0.00 0.00 586 L 7.64 3.57 0.00 1.37 1.30 0.69 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 587 E 7.54 2.54 0.00 1.84 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 0.00 2.13 2.20 0.00 588 N 7.60 4.62 0.00 2.82 2.88 0.00 0.00 7.04 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 589 E 7.72 4.24 0.00 2.23 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 2.45 2.53 0.00 590 R 8.36 4.43 0.00 1.83 1.90 0.00 3.49 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 591 G 9.24 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 592 F 7.18 4.05 0.00 2.92 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 593 V 8.06 3.74 1.69 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 0.54 0.00 0.00 0.85 0.00 0.00 594 G 5.62 3.55 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 0.00 595 Y 7.82 4.42 0.00 3.21 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 596 A 8.30 3.48 0.66 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 0.00 0.00 597 V 7.20 3.46 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 0.58 0.00 0.00 0.88 0.00 0.00 598 D 7.42 4.48 0.00 2.61 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 599 L 8.22 4.61 0.00 1.29 1.42 0.37 0.12 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 0.00 600 V 7.51 4.74 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 0.29 0.00 0.00 0.70 0.00 0.00 601 K 8.63 4.63 0.00 1.70 1.48 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.50 7.81 602 F 8.52 5.42 0.00 3.02 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 0.00 603 P 0.00 4.07 0.00 2.27 2.35 0.00 4.17 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 2.19 2.10 0.00 604 S 8.42 3.23 0.00 3.99 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 0.00 605 D 6.37 4.52 0.00 2.92 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 0.00 606 L 8.23 4.36 0.00 1.73 1.56 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 607 E 7.95 4.24 0.00 2.34 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 608 V 8.08 3.68 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 1.02 0.00 0.00 0.92 0.00 0.00 609 L 7.31 3.87 0.00 0.80 0.90 0.72 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 610 G 7.98 4.71 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 0.00 611 G 8.11 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 0.00 0.00 0.00 0.00 612 F 8.19 4.59 0.00 3.06 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 0.00 613 L 9.08 3.45 0.00 1.05 0.63 0.89 0.81 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 0.00 614 F 8.59 4.73 0.00 2.99 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 615 G 7.94 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 0.00 0.00 0.00 616 N 8.84 4.88 0.00 3.13 3.45 0.00 0.00 5.84 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 617 S 7.36 4.57 0.00 3.77 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 0.00 618 V 8.92 4.59 1.88 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 0.57 0.00 0.00 0.56 0.00 0.00 619 V 7.93 4.86 1.71 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 0.75 0.00 0.00 0.72 0.00 0.00 620 V 8.63 4.60 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 0.62 0.00 0.00 0.96 0.00 0.00 621 E 8.97 4.10 0.00 2.15 1.97 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 2.54 2.43 0.00 622 T 7.66 4.85 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 0.00 623 L 8.57 3.88 0.00 1.73 1.70 0.92 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 624 D 8.11 4.42 0.00 2.73 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 625 D 7.70 4.30 0.00 2.95 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 0.00 626 A 7.72 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 0.00 627 I 8.38 3.65 2.00 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 1.41 0.89 0.92 0.00 0.00 628 R 8.38 3.86 0.00 1.82 2.28 0.00 3.47 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.85 0.00 629 M 8.78 4.32 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.56 0.00 630 K 8.43 4.02 0.00 1.96 1.89 0.00 1.70 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.51 7.81 631 K 8.26 4.03 0.00 1.96 1.87 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.62 7.81 632 K 8.22 3.99 0.00 1.92 1.93 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.52 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.76 1.26 7.81 633 Y 8.68 4.30 0.00 2.92 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 634 R 7.96 4.26 0.00 2.02 2.21 0.00 3.10 0.00 0.00 3.10 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 635 L 7.77 4.05 0.00 1.69 1.76 0.87 1.07 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 0.00 636 N 8.81 4.96 0.00 2.96 3.05 0.00 0.00 6.27 7.22 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 0.00 637 T 7.40 4.61 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 638 R 8.21 4.85 0.00 1.82 1.82 0.00 3.41 0.00 0.00 3.28 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.50 0.00 639 I 8.14 5.07 1.84 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 1.23 1.21 0.85 0.00 0.00 640 A 9.20 5.24 1.19 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 0.00 0.00 0.00 641 T 8.09 4.94 4.22 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 1.23 0.00 0.00 642 L 9.02 4.18 0.00 1.62 1.80 0.99 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 643 D 7.56 4.35 0.00 2.94 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 644 G 8.28 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 0.00 645 E 8.27 4.54 0.00 1.99 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.30 0.00 646 L 8.46 4.88 0.00 1.74 1.44 0.96 1.13 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 0.00 647 I 8.37 5.07 1.86 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 1.28 0.63 0.91 0.00 0.00 648 S 9.08 4.19 0.00 3.86 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 0.00 649 G 8.74 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 0.00 650 R 7.81 4.23 0.00 1.81 1.98 0.00 3.18 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 651 G 8.12 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 0.00 0.00 0.00 652 A 8.79 4.28 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 0.00 653 I 8.34 4.92 1.87 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 1.35 0.81 0.91 0.00 0.00 654 T 8.73 4.70 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 0.00 655 G 8.33 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 0.00 656 G 8.74 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 0.00 0.00 0.00