NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 435 S 4.4085 8.3344 115.4088 58.0318 64.7044 173.4249 436 T 3.8991 7.7432 114.9568 62.2398 67.6370 173.0672 437 S 4.3072 8.8987 122.2979 58.9003 64.3318 173.9180 438 G 4.1059 7.9555 108.4379 46.5787 0.0000 175.0686 439 R 4.1550 8.1116 119.3219 57.7413 31.5190 177.2061 440 V 4.9833 7.8928 117.4424 61.0127 33.7769 174.8251 441 A 4.7941 8.9518 127.8120 50.0552 23.0126 175.7137 442 V 4.1235 8.3181 120.0149 62.1371 30.8315 175.3394 443 E 4.1873 8.7696 130.3209 58.6721 30.3020 176.5195 444 E 4.7202 7.8665 118.4605 54.5690 33.6800 174.1498 445 V 4.2921 8.0366 124.7110 60.5918 34.3310 174.4509 446 D 3.8363 7.5882 129.0354 54.0735 41.1346 177.0240 447 E 3.8782 8.8126 126.9571 58.8492 29.9302 176.7806 448 E 4.3506 8.3301 116.6625 55.7716 29.6129 176.3627 449 G 4.0443 8.0765 106.2631 46.4305 0.0000 176.3002 450 K 4.4520 8.5788 122.4680 58.9421 33.4151 176.7623 451 F 5.3491 7.0700 112.8164 55.7693 41.5967 173.3446 452 V 4.4240 8.3121 118.3616 60.8777 34.6866 173.8179 453 R 4.9991 9.0859 128.2269 54.5237 32.6932 174.3450 454 L 5.2105 8.8336 125.7983 53.0022 45.1600 175.2686 455 R 4.9991 8.6744 121.5212 54.5781 33.6929 173.7234 456 N 5.0548 9.0459 125.7580 52.7945 39.3864 175.2395 457 K 4.4573 9.2763 126.6819 57.3101 32.8767 177.4113 458 S 4.6503 8.2620 115.6877 57.0442 64.8591 174.0745 459 N 4.6413 8.7322 115.3459 53.9267 38.6986 175.0123 460 E 4.8291 7.6373 117.8271 54.0337 32.4609 175.8911 461 D 4.6291 8.6980 122.2776 54.6498 42.0252 175.4780 462 Q 4.4513 8.7242 123.5393 54.0720 31.3877 174.5066 463 S 4.3855 8.5854 122.1120 58.0512 63.3914 173.5380 464 M 2.8553 9.0995 127.2844 54.0139 32.9064 175.4273 465 G 4.0953 8.1790 107.5922 46.5788 0.0000 173.3105 466 N 4.5874 9.3045 121.6595 54.3395 38.3177 173.8779 467 W 4.6942 8.5517 116.3380 56.5095 30.7566 174.9312 468 Q 4.9274 9.2348 119.4115 54.1950 32.5358 174.7840 469 I 4.9669 8.4017 122.0490 59.6113 40.4170 174.5615 470 K 4.9457 9.1631 127.2397 54.6250 34.6161 175.2655 471 R 5.1414 9.3313 125.6461 54.6112 33.0354 173.6586 472 Q 4.9327 9.1966 128.2641 54.4448 31.5829 173.7111 473 N 5.0072 8.9237 124.2487 50.8352 40.7605 175.7703 474 G 4.1020 8.8151 116.2967 47.1911 0.0000 173.2877 475 D 4.7527 8.7272 123.2973 53.5378 41.1113 175.8232 476 D 4.5785 8.0821 120.1954 53.5934 41.4152 174.6596 477 P 4.4351 0.0000 0.0000 62.0215 31.9834 176.4073 478 L 4.2898 8.4317 123.2311 55.9561 42.7429 176.0564 479 L 5.0414 8.9085 124.3379 53.3301 44.9483 175.5807 480 T 5.0189 8.7415 118.5494 61.9666 72.0339 172.4770 481 Y 3.9520 8.3531 127.1267 55.1781 41.3196 174.1347 482 W 4.7581 6.9319 124.5640 54.4350 31.7116 175.6237 483 F 3.9996 9.1478 123.9394 56.4412 39.4015 173.5446 484 P 4.5930 0.0000 0.0000 62.0185 32.0291 175.8773 485 P 4.3031 0.0000 0.0000 65.1235 31.3178 176.1085 486 K 4.8054 7.8479 117.3312 54.3893 34.9186 175.7478 487 F 4.7416 8.4982 125.1951 57.4342 42.9752 172.5357 488 T 4.6790 7.3490 121.7019 61.4366 71.6827 172.9482 489 L 4.3359 8.3466 128.7583 53.0462 43.6542 175.9545 490 K 4.5784 8.4307 125.8867 55.6587 33.6490 176.6125 491 A 4.0473 8.5283 125.3319 54.2731 18.4493 178.7189 492 G 3.8735 8.5819 110.4454 45.7121 0.0000 173.1556 493 Q 4.6168 7.8857 118.9913 54.5533 31.5991 174.6762 494 V 5.6559 8.4493 112.6311 58.8762 35.2981 175.8118 495 V 4.7680 8.1475 120.3615 60.4998 34.9420 174.1104 496 T 4.7437 8.9202 120.7234 61.8285 71.1964 173.2995 497 I 4.6562 8.5740 128.0031 59.6659 38.9568 174.6243 498 W 5.5503 9.6694 128.3354 55.2360 31.0267 176.3431 499 A 4.4741 9.6905 126.6671 51.6194 18.3820 178.5140 500 A 3.9985 8.8434 124.0192 55.2690 18.5887 180.0495 501 G 3.7997 8.0611 102.6010 46.9240 0.0000 174.4606 502 A 4.1581 8.3505 123.2979 52.8585 18.7172 178.8514 503 G 3.6577 7.7503 102.0125 46.1740 0.0000 174.0565 504 A 3.7113 7.0410 118.5628 51.3734 18.9840 177.9653 505 T 4.3095 7.5401 116.4354 61.8694 69.6354 174.7023 506 H 4.3457 8.7170 127.0497 56.4210 30.5599 175.7706 507 S 4.6277 9.0319 121.6046 56.3846 63.3890 171.3980 508 P 4.8068 0.0000 0.0000 61.6304 31.9841 174.7485 509 P 4.9453 0.0000 0.0000 63.3405 32.0291 176.7969 510 T 4.2896 7.8347 110.3536 63.7469 69.7550 174.1367 511 D 5.4447 8.5269 121.8392 52.4820 45.0530 174.6874 512 L 5.1132 9.3087 123.5300 52.9000 45.1230 175.5008 513 V 4.8022 8.9171 123.1573 61.2537 33.1828 175.5534 514 W 4.8927 9.6932 135.0000 55.8185 29.4874 176.1895 515 K 3.8671 8.9177 126.9312 59.1410 31.8047 177.5988 516 A 4.1828 7.9616 118.5285 52.7864 19.1273 176.5974 517 Q 3.9141 6.9467 117.5107 53.4699 31.7444 175.2799 518 N 4.2043 8.4999 123.9398 56.4762 39.3685 174.2439 519 T 4.8739 6.9712 109.0321 60.2290 70.3867 173.3851 520 W 4.1472 8.9134 126.1015 57.8125 29.5221 175.9580 521 G 3.6597 7.8182 103.3355 43.8296 0.0000 172.7599 *523 G 3.7230 8.1482 107.1305 45.6868 0.0000 172.3800 524 N 4.6320 8.5064 114.6727 52.6077 37.9845 175.1854 525 S 4.5978 7.5737 114.6341 57.4087 64.8563 172.2493 526 L 5.3572 8.8135 126.6003 52.9545 46.3891 175.8700 527 R 4.7834 9.0666 121.2126 55.1032 33.7247 173.7267 528 T 5.1042 9.0497 122.7963 61.7092 71.5821 172.9480 529 A 5.1326 9.1973 127.9308 49.9478 22.8998 174.1426 530 L 5.0943 9.0184 123.6805 53.4965 44.2983 175.1607 531 I 4.8116 8.9851 127.4206 59.4925 40.3470 176.0205 532 N 3.1400 8.1340 124.3021 51.0665 38.9463 175.4457 533 S 4.3764 7.7743 111.4354 60.2482 63.4322 174.5260 534 T 4.3786 8.1830 111.1231 61.4206 68.5567 175.1426 535 G 3.8520 7.8680 108.8233 46.0511 0.0000 173.7248 536 E 4.1804 7.7483 119.5789 54.9237 30.5171 175.2055 537 E 4.3642 8.5838 124.5283 56.1606 29.7933 176.2770 538 V 4.3206 8.2464 119.4495 61.7348 33.2163 175.7334 539 A 4.7443 7.6853 120.5861 51.5475 22.3349 174.8030 540 M 5.0323 8.2169 115.0575 54.5741 34.2450 174.1148 541 R 4.5578 9.0792 120.4341 54.6922 33.6531 173.4759 542 K 4.9284 8.7388 127.1521 54.4785 35.1628 174.4496 543 L 4.5877 8.8280 129.7415 53.4952 43.9246 174.8531 544 V 4.5068 8.1708 126.2361 61.0854 32.7064 175.3353 545 R 4.0678 8.8687 128.8273 59.0959 30.3330 176.6748 546 S 4.6800 7.4656 108.8185 57.1894 65.4493 174.0606 547 V 4.4982 8.1374 121.6602 60.1754 34.2545 174.6105 548 T 4.5097 8.4631 118.1190 61.8153 70.6141 173.6214 549 V 4.4305 8.2821 125.8869 61.0877 33.6222 175.0133 550 V 4.5374 8.0209 117.8689 59.6172 35.4354 174.9669 551 E 4.6193 8.5518 120.9546 54.8681 31.9872 175.7676 552 D 4.2294 8.5347 122.6166 53.7850 39.0494 175.1209 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 435 S 8.33 4.41 0.00 3.99 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 0.00 436 T 7.74 3.90 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 1.20 0.00 0.00 437 S 8.90 4.31 0.00 3.97 3.94 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 0.00 438 G 7.96 4.11 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 0.00 0.00 0.00 439 R 8.11 4.15 0.00 1.92 2.18 0.00 3.37 0.00 0.00 3.41 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.67 0.00 440 V 7.89 4.98 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 0.87 0.00 0.00 0.87 0.00 0.00 441 A 8.95 4.79 1.20 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 0.00 442 V 8.32 4.12 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 0.67 0.00 0.00 0.91 0.00 0.00 443 E 8.77 4.19 0.00 2.04 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 2.30 2.24 0.00 444 E 7.87 4.72 0.00 2.09 1.79 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 2.41 2.41 0.00 445 V 8.04 4.29 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 0.58 0.00 0.00 0.72 0.00 0.00 446 D 7.59 3.84 0.00 1.58 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 0.00 0.00 0.00 0.00 447 E 8.81 3.88 0.00 1.87 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 2.25 2.36 0.00 448 E 8.33 4.35 0.00 2.12 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 449 G 8.08 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 0.00 0.00 0.00 450 K 8.58 4.45 0.00 2.08 2.44 0.00 2.02 0.00 0.00 1.88 0.00 0.00 3.46 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.64 1.67 7.81 451 F 7.07 5.35 0.00 2.40 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 0.00 0.00 0.00 452 V 8.31 4.42 1.09 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 0.57 0.00 0.00 -0.95 0.00 0.00 453 R 9.09 5.00 0.00 1.71 1.69 0.00 3.02 0.00 0.00 2.99 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.64 0.00 454 L 8.83 5.21 0.00 1.66 1.56 1.15 0.95 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 0.00 455 R 8.67 5.00 0.00 1.96 1.72 0.00 3.12 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 456 N 9.05 5.05 0.00 2.75 2.80 0.00 0.00 6.86 6.28 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 0.00 457 K 9.28 4.46 0.00 1.63 1.83 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.38 7.81 458 S 8.26 4.65 0.00 3.86 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 0.00 459 N 8.73 4.64 0.00 2.73 2.88 0.00 0.00 6.67 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 0.00 460 E 7.64 4.83 0.00 1.82 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 2.21 2.23 0.00 461 D 8.70 4.63 0.00 2.49 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 0.00 462 Q 8.72 4.45 0.00 2.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.01 0.00 0.00 0.00 0.00 0.00 1.91 1.67 0.00 463 S 8.59 4.39 0.00 3.86 3.72 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 0.00 464 M 9.10 2.86 0.00 0.78 1.49 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.81 0.00 465 G 8.18 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 0.00 466 N 9.30 4.59 0.00 3.01 3.10 0.00 0.00 7.29 7.80 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 0.00 467 W 8.55 4.69 0.00 3.34 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 468 Q 9.23 4.93 0.00 1.63 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.75 0.00 0.00 0.00 0.00 0.00 1.16 2.02 0.00 469 I 8.40 4.97 2.08 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 1.40 1.04 0.96 0.00 0.00 470 K 9.16 4.95 0.00 1.65 1.71 0.00 1.54 0.00 0.00 1.54 0.00 0.00 2.73 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.30 1.23 7.81 471 R 9.33 5.14 0.00 2.36 2.13 0.00 3.25 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.79 0.00 472 Q 9.20 4.93 0.00 2.21 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.53 0.00 0.00 0.00 0.00 0.00 2.27 2.44 0.00 473 N 8.92 5.01 0.00 2.70 2.75 0.00 0.00 7.11 7.59 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 0.00 474 G 8.82 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 0.00 475 D 8.73 4.75 0.00 2.67 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 0.00 476 D 8.08 4.58 0.00 2.74 2.64 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 P 0.00 4.44 0.00 2.06 2.00 0.00 3.71 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 478 L 8.43 4.29 0.00 1.67 1.63 1.03 0.94 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 0.00 479 L 8.91 5.04 0.00 1.83 1.81 0.92 0.46 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 0.00 480 T 8.74 5.02 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 0.47 0.00 0.00 481 Y 8.35 3.95 0.00 1.43 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 0.00 0.00 0.00 482 W 6.93 4.76 0.00 2.88 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 483 F 9.15 4.00 0.00 3.23 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 0.00 484 P 0.00 4.59 0.00 2.46 2.11 0.00 3.70 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.19 0.00 485 P 0.00 4.30 0.00 2.27 2.36 0.00 3.70 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 2.13 2.03 0.00 486 K 7.85 4.81 0.00 1.66 1.78 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.48 7.81 487 F 8.50 4.74 0.00 3.24 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 0.00 488 T 7.35 4.68 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 1.07 0.00 0.00 489 L 8.35 4.34 0.00 1.77 1.38 0.99 0.75 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 0.00 490 K 8.43 4.58 0.00 1.69 1.65 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.75 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.42 1.32 7.81 491 A 8.53 4.05 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 0.00 492 G 8.58 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 0.00 493 Q 7.89 4.62 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.59 0.00 0.00 0.00 0.00 0.00 2.52 2.43 0.00 494 V 8.45 5.66 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 0.59 0.00 0.00 0.93 0.00 0.00 495 V 8.15 4.77 2.39 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 0.99 0.00 0.00 1.19 0.00 0.00 496 T 8.92 4.74 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 0.01 0.00 0.00 497 I 8.57 4.66 1.78 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 0.40 0.23 -0.13 0.00 0.00 498 W 9.67 5.55 0.00 3.36 3.27 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 0.00 499 A 9.69 4.47 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 0.00 500 A 8.84 4.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 501 G 8.06 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 0.00 0.00 0.00 502 A 8.35 4.16 1.70 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 0.00 0.00 503 G 7.75 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 0.00 504 A 7.04 3.71 0.04 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 0.00 0.00 505 T 7.54 4.31 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 1.18 0.00 0.00 506 H 8.72 4.35 0.00 3.14 3.26 0.00 5.73 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 0.00 507 S 9.03 4.63 0.00 3.79 3.68 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 0.00 508 P 0.00 4.81 0.00 2.18 2.18 0.00 3.74 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 509 P 0.00 4.95 0.00 2.10 2.07 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 1.97 1.90 0.00 510 T 7.83 4.29 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 1.25 0.00 0.00 511 D 8.53 5.44 0.00 2.76 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 0.00 512 L 9.31 5.11 0.00 1.55 1.66 0.62 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 513 V 8.92 4.80 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.11 0.00 0.00 514 W 9.69 4.89 0.00 3.17 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 0.00 515 K 8.92 3.87 0.00 1.82 1.93 0.00 1.85 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.46 7.81 516 A 7.96 4.18 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 0.00 517 Q 6.95 3.91 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.75 0.00 0.00 0.00 0.00 0.00 1.16 1.45 0.00 518 N 8.50 4.20 0.00 2.64 2.67 0.00 0.00 6.59 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 0.00 519 T 6.97 4.87 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 1.17 0.00 0.00 520 W 8.91 4.15 0.00 3.37 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 0.00 521 G 7.82 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 *523 G 8.15 3.72 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 0.00 0.00 0.00 524 N 8.51 4.63 0.00 2.83 2.92 0.00 0.00 5.72 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 0.00 525 S 7.57 4.60 0.00 3.86 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 0.00 526 L 8.81 5.36 0.00 1.59 1.48 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 527 R 9.07 4.78 0.00 1.82 1.72 0.00 3.03 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 528 T 9.05 5.10 4.13 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 0.98 0.00 0.00 529 A 9.20 5.13 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 0.00 530 L 9.02 5.09 0.00 1.81 1.60 1.34 1.11 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 0.00 531 I 8.99 4.81 1.71 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 1.18 0.83 0.82 0.00 0.00 532 N 8.13 3.14 0.00 1.49 1.57 0.00 0.00 6.51 8.73 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 0.00 533 S 7.77 4.38 0.00 4.13 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 0.00 534 T 8.18 4.38 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 1.21 0.00 0.00 535 G 7.87 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 0.00 0.00 0.00 536 E 7.75 4.18 0.00 1.87 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 2.30 2.19 0.00 537 E 8.58 4.36 0.00 1.87 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 2.25 2.28 0.00 538 V 8.25 4.32 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 0.50 0.00 0.00 0.97 0.00 0.00 539 A 7.69 4.74 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 0.00 540 M 8.22 5.03 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.56 0.00 541 R 9.08 4.56 0.00 1.78 1.68 0.00 2.95 0.00 0.00 3.03 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.52 0.00 542 K 8.74 4.93 0.00 1.74 1.61 0.00 1.80 0.00 0.00 1.62 0.00 0.00 2.67 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.29 1.52 7.81 543 L 8.83 4.59 0.00 1.76 1.48 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 544 V 8.17 4.51 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 0.85 0.00 0.00 0.92 0.00 0.00 545 R 8.87 4.07 0.00 1.93 1.94 0.00 3.51 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 546 S 7.47 4.68 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 0.00 547 V 8.14 4.50 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 0.78 0.00 0.00 0.93 0.00 0.00 548 T 8.46 4.51 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 0.00 549 V 8.28 4.43 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 0.83 0.00 0.00 0.93 0.00 0.00 550 V 8.02 4.54 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 0.80 0.00 0.00 0.93 0.00 0.00 551 E 8.55 4.62 0.00 1.89 1.83 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 2.19 2.25 0.00 552 D 8.53 4.23 0.00 2.73 2.57 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 * Residues marked with a * may have inaccurate shift predictions.