NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 439 N 4.7034 8.4249 119.2140 53.4061 39.6629 176.7597 440 T 3.7294 9.1873 107.3064 62.9739 70.0051 172.4940 441 N 4.8449 8.8608 123.8676 51.9678 39.5489 175.3213 442 W 4.7078 7.8684 116.8800 57.9419 29.9293 177.4442 443 K 5.1474 9.1757 123.2294 55.1531 36.0452 176.3907 444 T 4.3238 9.9494 115.1579 61.1399 70.5382 176.0169 445 L 3.7396 8.9289 122.2631 58.0551 41.6189 179.2380 446 Y 4.2870 7.9334 118.5847 60.1762 38.4892 177.8548 447 E 4.0642 7.7867 119.6254 59.1228 29.6526 178.7927 448 V 3.3510 7.5164 118.2944 66.0908 31.3973 178.0124 449 K 3.9461 8.4523 118.5160 59.6831 31.6948 178.8204 450 S 3.7085 7.6794 111.6794 62.2666 62.4454 175.8810 451 E 4.0037 8.5191 121.7413 56.7026 29.3517 176.7271 452 N 4.2126 8.8365 116.4426 53.6289 36.9064 174.2091 453 L 4.1110 7.4018 117.3525 55.8008 42.2110 177.0172 454 G 4.2338 9.0122 111.8377 46.1809 0.0000 175.5107 455 Q 4.0497 8.0766 118.4442 58.8900 28.9317 176.7461 456 G 4.0833 7.8819 104.8825 44.6585 0.0000 172.8340 457 D 4.3978 8.6904 119.3495 55.9990 41.5108 176.5102 458 K 4.6236 7.5941 116.6796 53.3432 34.6092 173.7467 459 P 4.8283 0.0000 0.0000 63.2979 32.4049 174.6359 460 D 5.1819 8.3437 116.9605 53.2932 45.6227 174.3553 461 Y 5.5950 9.0065 117.0400 55.3718 41.8830 174.5144 462 F 5.1291 7.9225 116.9232 55.7421 42.4306 172.9648 463 S 5.5496 8.4877 112.1162 57.1413 67.4354 173.4754 464 S 5.3092 8.4722 116.4507 58.2472 67.8391 173.2492 465 V 4.7112 8.4928 120.3186 61.3629 33.0827 174.2542 466 A 4.8866 8.7089 128.3720 51.1339 23.7163 174.1456 467 T 4.9998 8.7386 115.7349 61.5494 71.5042 174.6853 468 V 3.9511 8.8132 126.7581 63.4289 31.8589 176.3348 469 V 3.3739 8.7184 128.2721 63.6468 32.9763 174.8392 470 Y 4.6444 7.1124 118.5247 56.6856 41.9117 172.8390 471 L 5.0579 7.3250 123.1632 52.9649 45.8121 176.4067 472 R 4.8259 8.6019 121.7181 54.4225 30.4976 176.4943 473 K 4.2995 9.0219 124.2516 58.5990 33.2229 179.2908 474 E 3.9903 8.0910 119.3849 59.0708 29.7777 177.7107 475 N 4.6986 8.1963 112.1339 53.7296 40.0314 177.6536 476 C 3.7480 7.2043 116.5124 59.6272 33.5460 172.5969 477 M 5.7482 8.4336 118.6775 53.3852 34.5111 174.8230 478 Y 4.8141 7.6705 115.5157 56.2610 41.4414 173.3185 479 Q 3.4653 8.5452 120.2733 55.3841 30.0425 174.8514 480 A 5.7262 7.9741 125.0192 48.5311 22.5820 175.0056 481 C 3.4971 8.7370 119.7327 58.9818 32.4473 172.1939 482 P 4.4682 0.0000 0.0000 63.0665 31.5755 175.3967 483 T 4.3693 6.9749 109.4344 60.5042 70.2484 174.1441 484 Q 3.9103 8.4010 124.0506 57.6852 29.1711 176.6992 485 D 4.6112 8.8609 119.8328 54.5800 38.6326 173.3407 486 C 4.9387 7.4311 118.7212 58.0321 34.1790 173.6037 487 N 4.9937 8.1060 120.2004 51.6021 39.4970 174.6991 488 K 4.1602 7.9158 119.2401 55.6372 34.3214 176.5944 489 K 5.6205 8.2455 126.5620 54.8089 29.5156 175.8226 490 V 3.9296 7.8811 115.2478 61.1030 32.9491 175.6819 491 I 4.3180 9.3827 125.8565 60.4226 38.9855 174.9358 492 D 5.1884 8.7780 126.0154 53.6348 41.1057 175.9833 493 Q 4.1360 9.0514 125.8548 56.0803 28.6440 178.0533 494 Q 3.6976 8.5264 116.3021 56.4436 27.5412 173.6205 495 N 4.7140 7.8231 114.3868 52.2725 37.4048 174.8900 496 G 3.6254 8.3993 104.7569 46.6067 0.0000 173.7942 497 L 4.6113 6.8712 116.8257 52.9514 46.5187 174.8646 498 Y 5.3390 9.8627 119.9589 56.4101 42.0826 174.4228 499 R 5.1427 9.3834 123.1718 54.7640 33.6563 174.0628 500 C 4.8942 9.0867 126.6774 57.5524 32.7801 173.9848 501 E 4.1205 9.0097 124.1502 57.6090 29.0616 177.6568 502 K 4.3159 7.8560 119.7010 58.5985 33.1121 177.4724 503 C 4.2028 8.0852 114.0604 60.4935 28.8814 172.7702 504 D 4.3974 7.9653 118.3989 54.9295 39.2420 173.0607 505 T 4.5527 7.1626 115.3807 62.2117 73.7514 174.2840 506 E 4.9959 8.3135 124.1697 54.9235 31.2878 175.1929 507 F 5.0062 9.9191 122.7553 55.4439 43.3658 174.0003 508 P 4.5480 0.0000 0.0000 64.6508 32.2989 175.9498 509 N 4.8040 7.9389 114.7196 51.6741 39.5603 171.9583 510 F 5.2411 8.5374 115.6443 57.9981 42.7206 173.3691 511 K 4.7501 7.4127 126.5756 57.2341 34.9549 174.0359 512 Y 4.5007 8.4502 125.7467 57.4632 39.3697 175.4521 513 R 4.6317 8.3159 120.5657 54.7021 34.6621 174.5452 514 M 4.7411 9.9148 123.6924 55.1839 33.1435 176.7372 515 I 4.5925 8.0018 117.4795 60.6882 40.0298 172.7111 516 L 4.2354 8.4853 128.2133 54.5758 44.1429 175.4777 517 S 4.9345 8.7837 121.0121 57.1028 63.8811 172.5372 518 V 4.7539 8.1307 126.1357 61.0559 34.4414 173.6758 519 N 4.6647 8.8954 125.9185 51.5176 40.8479 173.2295 520 I 5.0949 8.3359 119.6555 59.3043 41.0262 174.3241 521 A 5.1864 9.1281 124.4506 50.8277 22.9574 174.5306 522 D 5.2628 9.0961 118.5895 51.2496 43.0969 176.2917 523 F 4.0895 9.2640 112.7388 59.1957 37.5798 175.3910 524 Q 4.3195 9.3768 118.9520 55.5165 30.6497 173.4422 525 E 4.8599 7.5272 115.4962 55.9828 34.8832 173.1870 526 N 5.4062 8.2447 118.1792 51.9926 41.0400 173.3206 527 Q 4.5809 8.8487 117.4503 55.0511 33.0821 172.5046 528 W 4.9708 8.8900 125.2918 55.8585 30.7878 175.8448 529 V 4.7853 8.6717 118.1786 59.7878 35.8035 174.0147 530 T 4.5547 7.8030 109.6669 60.8461 72.1498 172.6079 531 C 4.5821 8.9776 124.0288 57.9352 30.6025 174.2504 532 F 4.3798 8.3792 123.1503 57.1792 40.9002 175.3639 533 Q 3.3036 9.0241 115.1841 58.9562 29.8585 178.9058 534 E 3.8344 8.2227 120.9070 59.9986 30.2755 179.2947 535 S 4.1402 8.1010 112.8886 61.4195 63.2135 175.7656 536 A 3.7851 7.8875 125.3257 54.8011 18.0378 179.5660 537 E 3.9145 8.2163 116.2572 59.2610 29.2059 179.5060 538 A 3.9787 8.5181 121.5347 55.0441 18.5005 179.4027 539 I 3.6705 7.3668 116.9301 63.7621 37.3865 177.6625 540 L 4.2332 7.8888 118.5537 54.5480 42.1038 177.9687 541 G 4.0303 8.7053 106.1135 44.9963 0.0000 173.0674 542 Q 4.6894 7.4405 117.8226 53.3286 32.1764 174.8651 543 N 4.5013 8.9270 119.9998 52.6864 38.1239 175.5779 544 A 3.7879 8.8826 125.4261 55.0674 18.8815 178.8759 545 A 3.8246 7.9883 113.7952 55.8158 17.9151 178.2959 546 Y 4.1697 7.0364 116.7246 60.0717 38.6082 177.7348 547 L 3.2750 8.1130 121.0343 58.0559 42.3729 179.9322 548 G 2.9990 8.1978 106.1855 47.1281 0.0000 175.2963 549 E 3.8607 7.6973 121.3189 59.2308 29.7828 178.9996 550 L 3.9457 7.3377 115.5663 57.5500 41.3231 179.1644 551 K 2.7325 7.2606 119.0563 59.3777 32.0802 177.5003 552 D 4.4272 7.6390 117.8592 56.0980 40.0448 177.4036 553 K 3.6050 7.5736 115.3329 57.9319 31.8804 175.5812 554 N 4.7635 7.3584 123.2091 51.9269 40.2248 175.6423 555 E 4.1618 8.6552 127.6635 58.6188 30.1400 178.4085 556 Q 4.2675 8.0060 116.2045 57.9305 29.3994 177.4507 557 A 4.1863 7.9726 118.6458 54.4737 18.6585 179.1272 558 F 4.2358 7.9784 119.3238 61.5752 39.4430 177.1165 559 E 4.0130 7.6903 115.3265 58.9987 29.6966 178.9765 560 E 4.0756 8.0960 119.4833 59.2893 29.5651 179.1361 561 V 3.6169 7.6006 117.2606 66.0919 31.5398 178.3654 562 F 4.0100 8.1342 111.1687 58.3689 38.4860 174.8909 563 Q 4.4547 8.7094 119.8697 57.7200 30.6156 177.6216 564 N 4.3458 8.1545 114.0111 55.8458 39.2161 175.7302 565 A 4.2050 7.8524 120.1396 54.4080 17.8823 177.4401 566 N 4.3223 7.7328 113.9321 54.4578 39.5569 173.9658 567 F 3.7388 7.5963 118.0114 58.8217 37.5312 175.7150 568 R 4.7606 7.3060 115.0105 54.6056 33.2566 175.9443 569 S 5.1028 7.9752 116.1861 57.1223 66.3827 173.0423 570 F 4.6938 8.6624 119.9776 56.5276 44.3416 173.0338 571 I 4.7077 8.7553 121.0879 59.9869 38.8760 175.1181 572 F 5.5542 9.5029 126.7771 55.7430 41.8016 174.5292 573 R 4.6633 9.0977 124.7892 55.0423 31.7906 175.1402 574 V 4.5000 8.0968 125.6147 60.9623 35.1459 174.2714 575 R 4.0572 8.3243 127.5811 55.3261 32.5923 175.9116 576 V 4.6139 7.8705 117.2455 60.9901 35.9323 173.3208 577 K 5.3457 8.5013 127.1599 54.5489 36.0888 175.4434 578 V 4.8299 8.2935 118.2861 60.8310 34.4857 174.6463 579 E 4.3829 8.5585 118.1227 56.6359 31.8383 176.2371 *587 I 4.0872 7.4193 110.1955 60.8753 38.4663 175.3988 588 K 4.4365 8.5947 121.6608 54.8364 34.1018 174.4031 589 A 4.4228 8.5333 129.3504 52.1528 19.9994 176.1465 590 T 4.4389 8.3050 117.5811 61.4865 72.4191 173.7905 591 V 3.8902 8.0503 127.6263 63.0482 30.5623 175.5763 592 M 4.3298 8.5037 129.1660 58.3263 32.5673 176.5133 593 D 4.6757 7.6420 115.0554 53.3449 45.0053 174.8160 594 V 5.0957 8.5582 116.6642 59.7788 34.8669 175.1610 595 K 4.8821 8.9924 125.4770 53.4474 35.3387 174.1501 596 P 4.6386 0.0000 0.0000 62.4366 32.0446 176.4052 597 V 3.2296 8.2059 122.1833 63.4700 31.9185 175.2221 598 D 4.6526 8.2062 125.6227 52.9490 42.2393 176.5533 599 Y 4.0968 8.2855 126.1601 60.7599 37.9463 178.3445 600 R 3.8788 8.2440 119.7595 59.6136 30.3293 178.5040 601 E 3.9380 8.2651 118.5165 59.5552 29.4650 178.7584 602 Y 4.1514 8.4700 120.1797 60.3327 38.6314 178.3571 603 G 3.4007 8.0970 107.0420 47.7606 0.0000 175.7214 604 R 3.8441 7.9307 121.1873 59.0309 30.1781 179.2168 605 R 3.8022 7.8690 117.5467 59.4186 30.0827 179.1733 606 L 3.8163 7.5937 118.5802 57.5193 41.6190 179.5919 607 V 3.4911 7.7620 118.3632 66.3779 31.4282 177.9498 608 M 4.0553 8.1099 118.6760 58.4413 31.7752 178.9873 609 S 4.1187 8.0560 114.3867 61.2453 62.9928 176.6455 610 I 3.6327 7.3656 122.3045 64.1676 37.1114 178.2409 611 R 4.0164 7.8167 118.6585 59.4639 30.0418 178.8534 612 R 3.8072 8.1770 118.5898 59.9266 29.6456 178.3116 613 S 4.1322 7.9001 111.6406 60.8723 62.4983 175.2656 614 A 4.2910 8.6096 122.5833 53.1421 18.2317 178.2477 615 L 4.1434 7.7225 115.8039 55.4608 41.8475 177.0503 616 M 3.6521 7.5219 124.6826 55.7840 32.3074 176.5702 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 439 N 8.42 4.70 0.00 2.73 2.59 0.00 0.00 7.04 6.82 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 0.00 440 T 9.19 3.73 4.31 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 0.15 0.00 0.00 441 N 8.86 4.84 0.00 2.70 2.90 0.00 0.00 7.02 7.95 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 0.00 442 W 7.87 4.71 0.00 3.32 3.30 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 0.00 443 K 9.18 5.15 0.00 1.40 1.57 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.18 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.75 7.81 444 T 9.95 4.32 4.17 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 1.40 0.00 0.00 445 L 8.93 3.74 0.00 1.65 1.69 0.94 0.80 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 0.00 446 Y 7.93 4.29 0.00 2.96 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 0.00 447 E 7.79 4.06 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 2.43 2.39 0.00 448 V 7.52 3.35 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 0.80 0.00 0.00 -0.42 0.00 0.00 449 K 8.45 3.95 0.00 1.57 1.64 0.00 1.69 0.00 0.00 1.52 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.36 7.81 450 S 7.68 3.71 0.00 3.43 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 0.00 451 E 8.52 4.00 0.00 1.97 1.99 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 2.35 2.51 0.00 452 N 8.84 4.21 0.00 2.83 2.85 0.00 0.00 6.94 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 453 L 7.40 4.11 0.00 1.67 1.83 0.94 1.05 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 0.00 454 G 9.01 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 0.00 455 Q 8.08 4.05 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.68 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 456 G 7.88 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 457 D 8.69 4.40 0.00 2.64 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 0.00 458 K 7.59 4.62 0.00 1.79 1.74 0.00 1.82 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.41 7.81 459 P 0.00 4.83 0.00 2.09 2.10 0.00 3.78 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 2.20 2.11 0.00 460 D 8.34 5.18 0.00 2.69 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 461 Y 9.01 5.60 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 0.00 462 F 7.92 5.13 0.00 3.18 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 463 S 8.49 5.55 0.00 2.84 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 0.00 464 S 8.47 5.31 0.00 4.04 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 0.00 465 V 8.49 4.71 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.55 0.00 0.00 466 A 8.71 4.89 1.42 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 0.00 467 T 8.74 5.00 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 1.32 0.00 0.00 468 V 8.81 3.95 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 0.80 0.00 0.00 1.31 0.00 0.00 469 V 8.72 3.37 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.86 0.00 0.00 470 Y 7.11 4.64 0.00 2.97 2.50 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 0.00 471 L 7.33 5.06 0.00 1.30 1.35 0.71 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 472 R 8.60 4.83 0.00 1.96 2.05 0.00 3.12 0.00 0.00 3.83 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.20 0.00 473 K 9.02 4.30 0.00 1.74 0.87 0.00 1.35 0.00 0.00 1.50 0.00 0.00 2.90 0.00 0.00 3.44 0.00 0.00 0.00 0.00 1.43 1.41 7.81 474 E 8.09 3.99 0.00 2.02 2.11 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 2.40 2.46 0.00 475 N 8.20 4.70 0.00 2.90 3.02 0.00 0.00 6.68 7.56 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 0.00 476 C 7.20 3.75 0.00 3.31 3.64 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 0.00 0.00 0.00 0.00 477 M 8.43 5.75 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 478 Y 7.67 4.81 0.00 2.98 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 0.00 479 Q 8.55 3.47 0.00 1.90 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.88 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 480 A 7.97 5.73 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 0.00 481 C 8.74 3.50 0.00 3.02 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 0.00 482 P 0.00 4.47 0.00 2.07 2.10 0.00 3.08 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.95 0.00 483 T 6.97 4.37 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 1.21 0.00 0.00 484 Q 8.40 3.91 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 5.99 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 485 D 8.86 4.61 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 0.00 486 C 7.43 4.94 0.00 2.87 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 0.00 487 N 8.11 4.99 0.00 2.74 2.84 0.00 0.00 6.90 7.61 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 0.00 488 K 7.92 4.16 0.00 1.82 1.69 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.73 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.39 7.81 489 K 8.25 5.62 0.00 1.49 1.62 0.00 1.55 0.00 0.00 2.31 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.31 7.81 490 V 7.88 3.93 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 0.92 0.00 0.00 1.04 0.00 0.00 491 I 9.38 4.32 1.95 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 1.17 0.81 0.97 0.00 0.00 492 D 8.78 5.19 0.00 2.90 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 0.00 493 Q 9.05 4.14 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.29 5.75 0.00 0.00 0.00 0.00 0.00 2.37 2.69 0.00 494 Q 8.53 3.70 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.28 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 495 N 7.82 4.71 0.00 2.77 2.80 0.00 0.00 6.93 6.98 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 0.00 496 G 8.40 3.63 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 0.00 0.00 0.00 497 L 6.87 4.61 0.00 1.38 1.38 0.90 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 498 Y 9.86 5.34 0.00 2.93 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 0.00 499 R 9.38 5.14 0.00 1.84 1.79 0.00 3.04 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.69 0.00 500 C 9.09 4.89 0.00 3.25 3.06 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 0.00 501 E 9.01 4.12 0.00 2.02 1.99 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 2.35 2.33 0.00 502 K 7.86 4.32 0.00 1.72 1.84 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.45 7.81 503 C 8.09 4.20 0.00 3.19 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 0.00 504 D 7.97 4.40 0.00 2.80 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 0.00 505 T 7.16 4.55 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 0.39 0.00 0.00 506 E 8.31 5.00 0.00 1.70 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 0.00 507 F 9.92 5.01 0.00 3.01 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 508 P 0.00 4.55 0.00 2.20 2.18 0.00 4.02 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 509 N 7.94 4.80 0.00 2.92 2.98 0.00 0.00 5.78 7.43 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 0.00 510 F 8.54 5.24 0.00 2.78 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 0.00 511 K 7.41 4.75 0.00 1.77 1.69 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.80 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.16 1.17 7.81 512 Y 8.45 4.50 0.00 2.72 2.56 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 0.00 0.00 0.00 513 R 8.32 4.63 0.00 0.67 1.28 0.00 3.20 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.31 0.00 514 M 9.91 4.74 0.00 1.78 2.08 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.60 0.00 515 I 8.00 4.59 2.20 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.51 1.30 0.00 0.00 516 L 8.49 4.24 0.00 1.82 1.43 1.05 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 517 S 8.78 4.93 0.00 3.99 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 0.00 518 V 8.13 4.75 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 0.88 0.00 0.00 0.78 0.00 0.00 519 N 8.90 4.66 0.00 1.44 2.05 0.00 0.00 6.73 7.42 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 0.00 520 I 8.34 5.09 2.07 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 1.28 1.03 0.77 0.00 0.00 521 A 9.13 5.19 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 0.00 522 D 9.10 5.26 0.00 2.73 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 0.00 523 F 9.26 4.09 0.00 3.19 3.32 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 0.00 524 Q 9.38 4.32 0.00 1.52 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.66 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 525 E 7.53 4.86 0.00 1.76 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 2.37 2.51 0.00 526 N 8.24 5.41 0.00 2.68 2.66 0.00 0.00 6.73 7.28 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 0.00 527 Q 8.85 4.58 0.00 2.10 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.88 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 528 W 8.89 4.97 0.00 3.20 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 0.00 529 V 8.67 4.79 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.67 0.00 0.00 530 T 7.80 4.55 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 1.15 0.00 0.00 531 C 8.98 4.58 0.00 2.64 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 0.00 532 F 8.38 4.38 0.00 3.09 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 0.00 533 Q 9.02 3.30 0.00 2.18 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.50 6.75 0.00 0.00 0.00 0.00 0.00 2.42 2.64 0.00 534 E 8.22 3.83 0.00 1.99 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 0.00 2.32 2.48 0.00 535 S 8.10 4.14 0.00 3.99 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 536 A 7.89 3.79 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 537 E 8.22 3.91 0.00 2.19 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 2.51 2.31 0.00 538 A 8.52 3.98 1.26 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 0.00 0.00 539 I 7.37 3.67 1.64 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.43 0.74 0.00 0.00 540 L 7.89 4.23 0.00 1.48 1.53 0.47 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 541 G 8.71 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 0.00 0.00 0.00 542 Q 7.44 4.69 0.00 1.95 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 543 N 8.93 4.50 0.00 2.99 3.02 0.00 0.00 6.12 7.25 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 0.00 544 A 8.88 3.79 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 0.00 545 A 7.99 3.82 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 0.00 546 Y 7.04 4.17 0.00 3.05 3.46 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 0.00 547 L 8.11 3.27 0.00 1.46 1.71 0.91 1.45 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 0.00 548 G 8.20 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 0.00 0.00 0.00 549 E 7.70 3.86 0.00 2.12 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 0.00 2.34 2.42 0.00 550 L 7.34 3.95 0.00 1.75 1.73 0.86 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 551 K 7.26 2.73 0.00 0.87 1.56 0.00 1.20 0.00 0.00 1.48 0.00 0.00 2.84 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.04 0.54 7.81 552 D 7.64 4.43 0.00 2.81 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 553 K 7.57 3.61 0.00 1.87 1.79 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.16 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.51 1.69 7.81 554 N 7.36 4.76 0.00 2.88 2.73 0.00 0.00 7.07 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 0.00 555 E 8.66 4.16 0.00 2.01 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 2.38 2.28 0.00 556 Q 8.01 4.27 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 557 A 7.97 4.19 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 0.00 558 F 7.98 4.24 0.00 3.03 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 0.00 559 E 7.69 4.01 0.00 2.31 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.56 0.00 560 E 8.10 4.08 0.00 2.21 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 2.49 2.50 0.00 561 V 7.60 3.62 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 0.87 0.00 0.00 0.90 0.00 0.00 562 F 8.13 4.01 0.00 2.84 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 563 Q 8.71 4.45 0.00 2.22 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.80 0.00 0.00 0.00 0.00 0.00 2.56 2.39 0.00 564 N 8.15 4.35 0.00 2.71 2.85 0.00 0.00 7.30 7.36 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 0.00 565 A 7.85 4.20 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 0.00 566 N 7.73 4.32 0.00 2.74 2.95 0.00 0.00 7.31 7.57 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 0.00 567 F 7.60 3.74 0.00 3.29 3.20 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 0.00 568 R 7.31 4.76 0.00 1.88 1.52 0.00 3.15 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.75 0.00 569 S 7.98 5.10 0.00 3.61 3.58 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 0.00 570 F 8.66 4.69 0.00 1.60 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 0.00 571 I 8.76 4.71 1.96 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.68 1.09 0.00 0.00 572 F 9.50 5.55 0.00 2.98 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 573 R 9.10 4.66 0.00 1.85 1.85 0.00 3.16 0.00 0.00 2.97 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 574 V 8.10 4.50 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 0.43 0.00 0.00 0.62 0.00 0.00 575 R 8.32 4.06 0.00 1.39 1.49 0.00 3.09 0.00 0.00 3.11 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.04 0.00 576 V 7.87 4.61 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 0.96 0.00 0.00 1.05 0.00 0.00 577 K 8.50 5.35 0.00 1.65 1.70 0.00 1.60 0.00 0.00 1.86 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.35 7.81 578 V 8.29 4.83 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.96 0.00 0.00 579 E 8.56 4.38 0.00 1.92 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 2.18 2.18 0.00 *587 I 7.42 4.09 1.88 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 1.31 0.55 0.91 0.00 0.00 588 K 8.59 4.44 0.00 1.79 1.66 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.38 7.81 589 A 8.53 4.42 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 0.00 590 T 8.30 4.44 4.18 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 1.44 0.00 0.00 591 V 8.05 3.89 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 0.60 0.00 0.00 0.40 0.00 0.00 592 M 8.50 4.33 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.70 0.00 593 D 7.64 4.68 0.00 2.68 2.44 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 0.00 594 V 8.56 5.10 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 1.01 0.00 0.00 0.87 0.00 0.00 595 K 8.99 4.88 0.00 1.69 1.70 0.00 1.69 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.52 7.81 596 P 0.00 4.64 0.00 2.06 2.09 0.00 3.82 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 597 V 8.21 3.23 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.00 0.00 0.62 0.00 0.00 598 D 8.21 4.65 0.00 2.75 2.50 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 0.00 599 Y 8.29 4.10 0.00 3.19 3.06 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 0.00 600 R 8.24 3.88 0.00 2.04 1.93 0.00 3.10 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 601 E 8.27 3.94 0.00 2.08 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 2.34 2.44 0.00 602 Y 8.47 4.15 0.00 2.79 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 0.00 603 G 8.10 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 604 R 7.93 3.84 0.00 1.91 1.95 0.00 3.13 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.87 0.00 605 R 7.87 3.80 0.00 1.83 1.76 0.00 2.21 0.00 0.00 2.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.44 0.00 606 L 7.59 3.82 0.00 1.55 1.46 -0.13 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 607 V 7.76 3.49 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 0.98 0.00 0.00 0.88 0.00 0.00 608 M 8.11 4.06 0.00 2.04 2.06 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 2.60 2.78 0.00 609 S 8.06 4.12 0.00 4.05 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 0.00 610 I 7.37 3.63 1.92 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 0.71 0.85 0.00 0.00 611 R 7.82 4.02 0.00 1.97 1.96 0.00 3.29 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.76 0.00 612 R 8.18 3.81 0.00 2.07 2.17 0.00 3.16 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 613 S 7.90 4.13 0.00 4.15 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 0.00 614 A 8.61 4.29 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 0.00 615 L 7.72 4.14 0.00 1.80 1.71 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 616 M 7.52 3.65 0.00 2.07 2.25 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.48 0.00 * Residues marked with a * may have inaccurate shift predictions.