NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 460 Y 4.7766 8.1293 121.6924 57.3741 39.9229 174.4297 461 K 4.3962 8.7410 125.4942 55.6372 35.2640 171.9902 462 E 4.8137 9.0930 119.9198 55.8841 35.4221 176.0662 463 E 4.6968 8.1273 130.6648 55.8545 28.1338 178.4337 464 D 4.4362 8.6535 127.3879 55.4811 39.0639 176.7660 465 S 4.3445 7.7189 114.8068 59.4879 62.8033 173.6142 466 T 4.6761 8.1289 117.9858 63.2462 70.1077 173.6404 467 V 4.1990 7.5591 121.8019 61.5398 32.4440 175.1970 468 S 4.5226 8.0059 119.5630 57.6388 65.1242 174.4865 469 I 3.8836 8.1696 122.2850 60.1355 37.2800 175.7200 470 L 4.0159 8.5257 127.9483 54.4774 41.4836 174.9949 471 P 4.2923 0.0000 0.0000 66.2266 30.9215 178.2016 472 T 4.1877 7.9060 105.9668 62.6133 68.8566 174.6403 473 S 4.5645 8.2116 116.5291 58.3917 64.1273 175.0557 474 L 4.1252 7.6857 123.5361 53.8535 42.7770 175.1684 475 P 4.1964 0.0000 0.0000 66.6405 30.8538 178.4245 476 Q 3.9826 8.0701 117.7749 58.2266 28.6550 178.9053 477 I 3.7396 7.7293 120.0617 64.8562 37.1977 177.8708 478 H 4.1279 8.2588 118.9359 58.9669 29.6593 177.2107 479 R 3.7973 8.4453 120.8263 59.3679 30.0121 178.0976 480 A 3.9696 8.6016 121.2502 55.6036 18.4665 179.4442 481 N 4.3190 8.4996 115.0565 56.6094 38.5316 177.6165 482 M 4.0367 8.1314 120.3491 58.3317 32.0091 178.8159 483 L 3.9615 7.9250 118.9191 57.6637 41.6009 179.3513 484 A 4.0961 7.8561 119.5651 54.6888 18.3699 179.0471 485 Q 4.1210 7.8573 115.1573 55.8442 30.1261 175.6093 486 G 3.6745 7.6916 107.6613 46.1124 0.0000 173.9722 487 S 4.5971 7.4596 111.0705 55.8000 64.1410 172.3075 488 P 4.2129 0.0000 0.0000 66.2485 31.2092 178.1750 489 A 4.0250 8.2648 120.2482 54.7246 18.4228 178.9111 490 A 3.9870 7.7117 119.5693 55.7657 18.1347 179.9628 491 S 4.2240 7.6309 109.4589 60.7448 63.1628 176.0171 492 K 4.3315 8.1311 121.5874 56.8069 32.4770 177.1913 493 I 3.8627 6.9209 119.8547 61.2817 37.3506 175.5485 494 S 4.8604 8.2894 121.3331 55.5436 65.4480 172.3281 495 P 4.4180 0.0000 0.0000 62.7319 31.7563 175.4173 496 L 4.4721 8.1273 121.1431 53.8471 43.2649 175.7563 497 V 4.4555 7.3479 123.1346 61.6809 34.7531 173.9907 498 T 3.6512 7.2960 117.3229 60.2016 72.4059 173.7477 *503 T 4.1442 7.9003 117.5193 64.4935 68.6992 176.9159 504 R 4.3487 8.1695 122.0058 55.2074 29.1648 174.6188 505 W 4.6556 8.0691 121.2539 56.6441 30.0204 175.4531 506 H 5.0364 8.6746 121.5846 53.8407 32.5484 172.4933 507 F 4.3230 8.8356 127.0615 59.2041 40.8480 175.6066 508 G 3.9684 7.9395 116.8370 46.7944 0.0000 174.9207 509 I 4.8459 9.0697 123.9101 59.5274 41.1696 173.5810 510 R 5.1930 8.6095 124.7891 55.4028 32.1268 176.0672 511 S 4.5178 8.5968 113.6172 57.3553 66.3678 175.5396 512 R 4.3130 8.6914 126.8183 56.7294 29.9820 175.5547 513 S 4.7114 7.7276 111.4463 56.9302 66.3476 172.8320 514 Y 4.0006 8.3259 117.9678 57.5760 37.5060 175.9405 515 P 4.2357 0.0000 0.0000 64.5846 31.1492 178.0056 516 L 4.3493 7.8256 118.9053 57.3098 42.0863 178.0421 517 D 4.4704 7.9820 118.2534 56.2352 40.7343 178.9023 518 V 3.7123 7.6472 118.9924 66.0471 31.9470 177.3958 519 M 4.1488 7.8446 117.3446 58.4636 31.9781 178.5603 520 G 3.5166 8.2965 106.0002 47.8690 0.0000 175.4931 521 E 4.2107 7.9051 122.0194 58.5995 29.4924 179.0697 522 I 3.6474 7.7005 120.0673 64.5802 37.1864 177.9047 523 Y 3.4228 7.5793 116.9715 61.1267 37.4485 178.2638 524 I 3.7046 8.3863 120.7139 64.5546 37.0003 177.9062 525 A 4.0279 8.3591 121.9216 56.2550 18.2137 178.9207 526 L 3.8230 8.3903 117.7808 56.5029 41.4120 179.7033 527 K 4.1704 9.1169 118.5277 60.7239 32.6330 178.6416 528 N 4.4360 7.8177 116.5265 55.3088 38.5520 176.5511 529 L 4.3261 8.6728 119.1966 55.0027 42.0532 177.6895 530 G 3.7893 7.6781 107.7520 44.6066 0.0000 173.6652 531 A 4.1209 6.7105 120.8224 51.5109 19.5104 176.2928 532 E 4.2081 8.7318 116.0104 54.3715 33.4205 174.3509 533 W 5.7317 7.3538 116.5294 54.7675 31.8653 174.0835 534 A 4.5358 8.4356 122.2588 50.5890 19.7907 177.4341 535 K 4.1995 8.5176 120.7527 55.3846 32.8975 176.6927 536 P 4.5722 0.0000 0.0000 64.3609 30.9885 176.1035 537 S 3.5867 8.3812 109.0311 59.3491 59.2356 168.2145 *541 L 3.9704 7.3848 123.7680 54.4935 43.1773 175.6311 542 W 4.7839 8.3975 118.1628 56.4558 31.0667 174.6678 543 T 4.7930 8.0009 116.3368 61.8444 70.6137 173.3985 544 I 4.2672 8.6885 127.7750 59.4622 39.7164 174.7796 545 K 4.8005 8.7844 129.0142 54.7143 33.0040 174.8349 546 L 5.0986 8.5443 127.3438 54.0587 43.9273 175.3676 547 R 5.0742 8.9950 119.2439 54.5102 32.7572 173.6308 548 W 5.6285 9.5095 135.0000 56.1463 35.0161 174.0054 549 K 4.7427 8.9918 121.2064 56.4002 34.4929 174.2862 *564 D 4.6845 8.2951 117.3929 54.4969 41.9969 174.8086 565 L 4.9871 8.8858 123.0144 53.5090 44.1505 175.0516 566 M 3.9572 9.9654 124.3639 54.0085 33.4861 175.4394 567 K 4.6765 8.3587 126.3046 56.4501 33.8080 175.7173 568 M 4.7327 8.2573 120.0555 54.9143 36.7241 173.5245 569 V 4.9144 8.7836 122.2620 61.4193 35.3247 173.7922 570 I 5.3760 8.8689 128.5366 58.9662 39.8396 174.6884 571 Q 4.8179 8.2254 123.5761 53.9332 32.8328 173.7466 572 L 4.9586 7.8098 124.5453 53.4053 44.3475 175.5719 573 F 5.1207 8.9305 122.6738 55.8582 43.3115 174.2959 574 Q 4.5410 8.7860 122.5385 55.0958 31.1650 175.8568 *578 N 4.6286 8.0363 118.5804 53.0960 39.2386 174.0256 579 N 4.8395 7.5430 113.9619 51.8671 42.2091 172.9051 580 Y 5.1742 8.5337 121.3598 56.3186 43.0148 173.9048 581 L 5.3669 9.1164 122.5080 53.4645 46.0431 175.1401 582 V 4.6417 9.2486 126.1829 61.3159 33.6236 173.6046 583 D 5.1890 8.9444 128.4650 52.8191 43.2540 174.7707 584 F 5.1922 9.0158 123.8296 55.6066 41.5211 174.6663 585 K 4.7026 8.8646 124.2645 54.3182 35.3597 175.3164 586 F 4.1266 8.2684 129.2008 58.1424 40.0341 174.6392 587 D 4.2782 7.0895 120.0693 54.0708 43.0841 173.3024 588 G 3.6066 5.3800 103.4220 43.8545 0.0000 172.6409 589 W 5.3258 8.1538 117.8735 55.2724 33.1690 173.8263 590 E 4.7909 8.7331 118.2327 57.6631 32.2124 173.4701 591 S 4.4849 8.3434 113.2915 57.9075 67.5916 176.2977 *606 E 4.1241 7.6339 119.9864 56.0384 31.3460 175.8269 607 M 4.6154 8.5499 122.8163 58.0167 32.5391 178.7719 608 S 3.8764 8.0908 115.3032 61.9707 62.8719 176.1786 609 T 3.6172 6.8329 116.5881 66.8946 68.2794 176.4468 610 F 4.3599 7.2988 117.3459 59.1628 40.1050 176.1426 611 S 4.8239 7.6780 114.7134 57.3767 62.7342 174.1960 612 A 4.1195 7.2863 125.6622 54.5493 19.7630 178.8032 613 Y 4.1800 7.0438 114.5260 60.8786 38.2400 175.9258 614 P 4.3440 0.0000 0.0000 66.0292 31.5038 177.7165 615 F 4.2074 8.4705 118.2424 61.9635 39.2426 177.0860 616 L 3.7059 7.8231 118.9184 57.1263 41.3708 179.2227 617 H 3.9785 8.7576 118.4972 59.3594 29.9413 177.3154 618 L 3.5241 7.7293 120.9064 57.7995 41.1046 179.7300 619 T 3.8504 7.5355 109.5219 64.5146 68.6126 177.1495 620 T 3.7284 7.3859 118.7798 66.4402 68.5029 176.6446 621 K 3.8962 7.8829 120.3738 59.6080 31.6902 179.1817 622 L 4.2135 8.2092 120.1211 57.7865 41.8509 179.1177 623 I 3.8882 7.3688 120.1755 64.5004 37.2363 178.0555 624 M 4.0539 7.9954 119.5259 58.2501 31.7872 178.4798 625 E 3.9593 8.2701 119.6111 59.1216 29.8081 178.8127 626 L 3.9540 7.7095 117.5527 57.9517 41.5442 178.8178 627 A 3.9759 7.9791 119.2662 55.7691 18.3091 179.5353 628 V 3.7399 7.6206 109.2088 64.7156 31.8413 178.0975 629 N 4.4880 7.7126 114.2921 55.7920 38.5753 175.1861 630 S 4.3593 8.0618 117.5712 58.3128 63.1951 173.5664 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 460 Y 8.13 4.78 0.00 2.90 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 0.00 461 K 8.74 4.40 0.00 1.98 1.80 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.52 7.81 462 E 9.09 4.81 0.00 2.06 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 2.30 2.33 0.00 463 E 8.13 4.70 0.00 2.00 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 2.37 2.23 0.00 464 D 8.65 4.44 0.00 2.78 2.79 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 0.00 465 S 7.72 4.34 0.00 3.89 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 0.00 466 T 8.13 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 0.00 467 V 7.56 4.20 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 0.80 0.00 0.00 0.94 0.00 0.00 468 S 8.01 4.52 0.00 4.02 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 469 I 8.17 3.88 1.83 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.50 0.89 0.00 0.00 470 L 8.53 4.02 0.00 1.72 1.60 0.93 0.90 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 0.00 471 P 0.00 4.29 0.00 2.26 2.35 0.00 3.76 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.01 0.00 472 T 7.91 4.19 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 473 S 8.21 4.56 0.00 3.91 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 0.00 474 L 7.69 4.13 0.00 1.79 1.64 0.92 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 475 P 0.00 4.20 0.00 2.26 2.35 0.00 3.70 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.09 0.00 476 Q 8.07 3.98 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.93 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 477 I 7.73 3.74 2.03 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 1.53 0.71 0.93 0.00 0.00 478 H 8.26 4.13 0.00 3.44 3.31 0.00 5.59 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 479 R 8.45 3.80 0.00 2.07 2.10 0.00 3.17 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 480 A 8.60 3.97 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 0.00 481 N 8.50 4.32 0.00 2.66 2.85 0.00 0.00 7.09 7.29 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 0.00 482 M 8.13 4.04 0.00 1.97 2.24 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 2.49 2.51 0.00 483 L 7.93 3.96 0.00 1.89 1.70 0.91 0.81 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 0.00 484 A 7.86 4.10 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 0.00 485 Q 7.86 4.12 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.53 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 486 G 7.69 3.67 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 0.00 487 S 7.46 4.60 0.00 3.93 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 488 P 0.00 4.21 0.00 2.25 2.32 0.00 3.75 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 2.08 2.00 0.00 489 A 8.26 4.03 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 0.00 490 A 7.71 3.99 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 491 S 7.63 4.22 0.00 4.08 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 0.00 492 K 8.13 4.33 0.00 1.84 1.90 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.46 7.81 493 I 6.92 3.86 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.67 0.92 0.00 0.00 494 S 8.29 4.86 0.00 3.82 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 495 P 0.00 4.42 0.00 2.17 2.06 0.00 3.75 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 1.98 1.95 0.00 496 L 8.13 4.47 0.00 1.62 1.59 0.92 0.84 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 0.00 497 V 7.35 4.46 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 0.89 0.00 0.00 0.93 0.00 0.00 498 T 7.30 3.65 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 1.20 0.00 0.00 *503 T 7.90 4.14 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 0.00 504 R 8.17 4.35 0.00 1.80 1.90 0.00 3.19 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 505 W 8.07 4.66 0.00 3.51 2.99 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 0.00 506 H 8.67 5.04 0.00 3.14 3.26 0.00 5.92 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 0.00 507 F 8.84 4.32 0.00 2.95 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 0.00 508 G 7.94 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 0.00 509 I 9.07 4.85 2.15 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.26 1.03 0.00 0.00 510 R 8.61 5.19 0.00 1.75 1.91 0.00 3.25 0.00 0.00 3.19 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 511 S 8.60 4.52 0.00 3.97 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 0.00 512 R 8.69 4.31 0.00 1.95 2.00 0.00 3.02 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 513 S 7.73 4.71 0.00 4.04 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 0.00 514 Y 8.33 4.00 0.00 3.27 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 0.00 515 P 0.00 4.24 0.00 1.74 1.27 0.00 3.62 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.55 0.00 516 L 7.83 4.35 0.00 1.77 1.75 0.92 1.05 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 0.00 517 D 7.98 4.47 0.00 2.86 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 0.00 518 V 7.65 3.71 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 1.05 0.00 0.00 1.01 0.00 0.00 519 M 7.84 4.15 0.00 2.21 2.45 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.53 0.00 520 G 8.30 3.52 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 0.00 0.00 0.00 521 E 7.91 4.21 0.00 2.27 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 522 I 7.70 3.65 1.82 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.63 0.63 0.00 0.00 523 Y 7.58 3.42 0.00 2.90 2.43 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 0.00 524 I 8.39 3.70 2.11 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 1.48 0.72 0.93 0.00 0.00 525 A 8.36 4.03 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 0.00 526 L 8.39 3.82 0.00 1.92 1.87 0.61 0.57 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 0.00 527 K 9.12 4.17 0.00 2.09 2.62 0.00 1.39 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.86 1.60 7.81 528 N 7.82 4.44 0.00 2.79 2.94 0.00 0.00 7.11 7.71 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 0.00 529 L 8.67 4.33 0.00 1.08 1.59 1.09 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 530 G 7.68 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 0.00 531 A 6.71 4.12 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 0.00 532 E 8.73 4.21 0.00 1.71 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 0.00 2.11 2.29 0.00 533 W 7.35 5.73 0.00 3.30 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 0.00 534 A 8.44 4.54 1.28 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 0.00 0.00 535 K 8.52 4.20 0.00 1.75 1.77 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.48 7.81 536 P 0.00 4.57 0.00 2.02 1.85 0.00 3.79 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.22 0.00 537 S 8.38 3.59 0.00 3.97 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 *541 L 7.38 3.97 0.00 1.56 1.48 0.97 1.05 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 0.00 542 W 8.40 4.78 0.00 3.20 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 543 T 8.00 4.79 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 1.28 0.00 0.00 544 I 8.69 4.27 1.62 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.30 0.63 0.00 0.00 545 K 8.78 4.80 0.00 1.89 1.73 0.00 1.58 0.00 0.00 1.87 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.46 7.81 546 L 8.54 5.10 0.00 2.18 1.88 1.21 0.74 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 0.00 547 R 8.99 5.07 0.00 1.86 1.76 0.00 3.06 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 548 W 9.51 5.63 0.00 3.43 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 0.00 549 K 8.99 4.74 0.00 2.29 1.93 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.42 1.65 7.81 *564 D 8.30 4.68 0.00 2.74 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 565 L 8.89 4.99 0.00 1.64 1.65 0.97 0.74 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 0.00 566 M 9.97 3.96 0.00 1.76 1.05 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.86 0.00 567 K 8.36 4.68 0.00 1.35 1.51 0.00 1.75 0.00 0.00 1.52 0.00 0.00 2.87 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.26 7.81 568 M 8.26 4.73 0.00 2.23 1.94 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 2.89 2.73 0.00 569 V 8.78 4.91 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 0.90 0.00 0.00 0.96 0.00 0.00 570 I 8.87 5.38 1.64 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.25 0.58 0.00 0.00 571 Q 8.23 4.82 0.00 1.72 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.87 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 572 L 7.81 4.96 0.00 1.60 1.48 0.91 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 573 F 8.93 5.12 0.00 3.17 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 0.00 574 Q 8.79 4.54 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.24 2.11 0.00 *578 N 8.04 4.63 0.00 2.66 1.96 0.00 0.00 6.70 7.79 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 0.00 579 N 7.54 4.84 0.00 2.51 2.40 0.00 0.00 6.58 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 580 Y 8.53 5.17 0.00 2.99 2.95 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 0.00 0.00 0.00 581 L 9.12 5.37 0.00 1.82 1.68 1.19 1.26 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 0.00 582 V 9.25 4.64 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 0.36 0.00 0.00 0.93 0.00 0.00 583 D 8.94 5.19 0.00 3.13 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 584 F 9.02 5.19 0.00 2.91 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 0.00 585 K 8.86 4.70 0.00 1.90 1.63 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.38 7.81 586 F 8.27 4.13 0.00 1.51 2.34 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 0.00 587 D 7.09 4.28 0.00 2.39 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 588 G 5.38 3.61 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 0.00 589 W 8.15 5.33 0.00 3.29 3.18 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 0.00 590 E 8.73 4.79 0.00 2.06 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 2.21 2.30 0.00 591 S 8.34 4.48 0.00 4.03 3.95 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 0.00 0.00 0.00 *606 E 7.63 4.12 0.00 2.09 1.81 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 2.27 2.57 0.00 607 M 8.55 4.62 0.00 2.42 2.21 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.89 0.00 608 S 8.09 3.88 0.00 3.82 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 0.00 609 T 6.83 3.62 3.85 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 0.89 0.00 0.00 610 F 7.30 4.36 0.00 3.21 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 611 S 7.68 4.82 0.00 3.60 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 612 A 7.29 4.12 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 613 Y 7.04 4.18 0.00 3.11 2.99 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 0.00 614 P 0.00 4.34 0.00 2.53 2.45 0.00 3.70 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 615 F 8.47 4.21 0.00 3.16 3.26 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 0.00 616 L 7.82 3.71 0.00 1.90 1.61 0.93 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 617 H 8.76 3.98 0.00 3.18 3.45 0.00 5.60 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 0.00 618 L 7.73 3.52 0.00 1.11 0.13 -0.32 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 619 T 7.54 3.85 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 0.47 0.00 0.00 620 T 7.39 3.73 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 1.13 0.00 0.00 621 K 7.88 3.90 0.00 2.06 2.01 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.43 1.37 7.81 622 L 8.21 4.21 0.00 2.22 2.07 1.01 1.23 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 0.00 623 I 7.37 3.89 1.93 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.62 0.88 0.00 0.00 624 M 8.00 4.05 0.00 2.09 2.24 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 2.71 2.54 0.00 625 E 8.27 3.96 0.00 2.23 2.16 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 2.52 2.43 0.00 626 L 7.71 3.95 0.00 2.04 1.74 1.08 0.71 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 0.00 627 A 7.98 3.98 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 0.00 628 V 7.62 3.74 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 0.86 0.00 0.00 1.02 0.00 0.00 629 N 7.71 4.49 0.00 2.91 2.92 0.00 0.00 6.91 7.46 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 0.00 630 S 8.06 4.36 0.00 3.96 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 * Residues marked with a * may have inaccurate shift predictions.