NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 424 E 4.3585 8.4449 118.7993 57.5022 30.9912 174.5813 425 T 3.0014 8.8669 114.6931 64.1982 66.0221 171.1359 426 A 4.2970 8.6915 125.6704 51.8346 20.9478 177.5764 427 I 4.9578 8.4950 122.7050 59.4445 41.2337 174.4523 428 I 5.0172 8.5266 126.9431 59.7729 40.3815 174.5323 429 T 5.1702 8.7510 123.2795 61.7711 71.5156 173.2630 430 L 5.4377 8.8990 125.5287 52.7048 45.1773 176.8363 431 S 4.5179 8.9189 117.8694 57.4791 63.8735 175.2674 432 K 2.9085 8.3388 119.3347 58.7868 31.6086 177.7464 433 D 4.4572 7.8304 116.3402 53.9170 41.3699 177.1033 434 G 3.9192 8.2956 108.8530 45.2020 0.0000 173.4879 435 R 4.6724 7.5775 118.4918 54.9726 31.3409 175.6381 436 I 4.4789 8.7944 123.8114 61.8802 37.3110 176.5013 437 T 4.4935 9.1098 117.9433 61.9761 70.7948 174.4460 438 E 4.8396 7.9369 120.1160 54.8167 34.5816 174.9113 439 W 5.0911 8.5271 130.2129 57.1186 32.4435 173.5328 440 N 4.7768 8.6349 126.5032 51.5423 38.8750 176.3731 441 K 4.0313 8.7191 117.3730 59.6100 31.9165 179.6266 442 K 3.8928 8.0666 118.1267 59.3298 31.9170 179.0406 443 A 3.7535 8.3506 121.2616 54.9109 18.0309 179.5568 444 E 4.7517 8.2002 118.5008 59.1838 29.3682 179.2944 445 Q 3.9547 8.0625 118.5098 59.2041 29.2354 177.8740 446 L 3.9012 8.0507 120.2678 57.4672 42.1857 177.9665 447 F 5.1224 8.3638 115.1789 56.4454 40.2208 176.7771 448 G 4.0548 8.5772 106.3616 45.7795 0.0000 172.9733 449 L 4.8146 7.9640 118.9005 52.2476 44.3746 176.0555 450 K 4.5233 8.3871 122.3867 55.7861 33.2328 177.5004 451 K 3.5892 9.6562 126.0020 59.9369 31.8403 178.8467 452 E 3.9523 8.0994 115.2435 59.2248 29.4802 178.0237 453 N 4.4665 7.8200 115.9930 54.4437 39.1337 176.0295 454 V 3.9378 7.0220 111.7339 60.8310 33.7776 175.4948 455 L 4.1787 7.4153 122.0977 56.6391 42.0765 177.3173 456 G 3.9425 9.1024 114.7695 45.3418 0.0000 173.6374 457 R 4.3865 7.5327 118.7580 54.5889 31.8234 175.8910 458 R 4.4834 8.1692 119.5294 55.7515 30.8771 177.5034 459 L 3.8720 8.6927 125.9571 57.9900 42.1778 179.1532 460 K 4.1436 7.9396 115.5610 59.1343 32.6620 177.4422 461 D 4.4859 7.8534 118.9379 55.9881 41.2106 176.3711 462 L 4.3376 7.9804 121.1697 52.8890 42.3742 174.6076 463 P 5.0087 0.0000 0.0000 63.8318 31.6343 176.5741 464 D 4.6806 8.9349 120.7824 55.1695 39.8560 175.4008 465 F 4.5822 8.2514 117.4172 57.2392 39.2482 177.1440 466 E 4.0407 8.0722 120.8738 59.4834 29.2959 178.7851 467 E 3.9662 8.1311 118.6923 59.4638 29.8432 178.6627 468 I 4.0866 7.9887 119.5725 64.3578 37.2404 178.3677 469 G 3.7785 8.7717 107.3166 47.9915 0.0000 175.8901 470 S 4.1963 8.2483 116.8423 60.9409 63.0561 176.6267 471 V 3.3440 8.2761 122.0866 65.6631 31.1954 177.8370 472 A 4.0624 8.2937 120.7433 55.1159 18.2384 179.1762 473 E 3.9088 8.3153 117.8057 59.4317 29.6470 179.0220 474 S 4.0635 8.0788 113.0879 61.5066 62.5013 176.2435 475 V 3.5360 7.9525 121.1850 65.8762 30.9452 177.8166 476 F 4.0132 8.1336 119.6037 61.3743 39.3814 176.7446 477 E 4.0865 8.2908 116.9763 59.1038 29.2570 178.3646 478 N 4.5530 8.5111 115.1891 52.5607 38.7205 176.2547 479 K 4.1533 7.7367 118.0964 56.8923 30.3204 174.8238 480 E 4.7009 7.5125 117.4670 53.3818 32.5010 174.1782 481 P 4.7270 0.0000 0.0000 63.4190 32.2431 175.5680 482 V 4.5637 8.6887 120.6735 61.1378 34.7468 174.0459 483 F 5.6788 8.9995 128.7915 56.7728 41.7058 173.5252 484 L 4.5537 8.8606 126.8961 53.3258 43.9057 175.8283 485 N 5.3762 8.4141 120.9861 50.5070 39.0644 171.7339 *487 Y 4.4186 7.9453 122.1519 57.0356 40.3907 174.3575 488 K 5.0637 7.5806 127.3115 55.1223 34.5148 178.6807 *490 G 4.1187 7.8359 110.5278 45.6939 0.0000 173.5531 491 E 4.5840 9.1214 121.4929 55.5033 30.2739 175.2224 492 R 4.5260 7.6657 116.9451 54.4462 33.5407 173.9237 493 Y 5.0222 7.9158 117.3876 57.0160 39.4396 174.9925 494 F 5.1633 9.0808 120.4710 56.0465 43.7925 173.6700 495 N 5.1408 9.2756 118.2764 52.0947 40.8087 174.4425 496 I 4.9969 8.7493 123.4847 59.6498 41.1409 174.1417 497 R 5.2776 9.0332 127.9492 54.6802 32.8276 174.7115 498 F 5.1983 9.7314 124.8575 56.0897 41.7829 174.7092 499 S 4.8084 9.2144 122.2747 55.8490 64.4046 172.2787 500 P 5.1378 0.0000 0.0000 62.8321 32.1435 175.6953 501 F 5.1935 8.7195 115.8224 55.4653 41.7436 173.4417 502 R 5.1464 8.6031 118.1776 54.0716 33.2074 175.3331 503 N 4.5655 9.2036 121.7176 53.8105 39.5642 175.3535 504 A 4.0496 9.0800 129.6831 55.5515 18.7505 178.9494 505 K 4.1836 8.3358 113.7368 59.5108 32.3448 178.8679 506 T 4.0557 8.1286 106.4199 62.0958 69.3258 175.3031 507 Q 3.6793 8.2390 118.7975 56.2923 27.1474 173.1936 508 L 4.1353 7.7541 119.7710 54.3558 42.6788 176.1880 509 L 4.2881 8.6180 126.4362 55.7572 41.8041 175.7553 510 E 4.3440 9.5314 128.0435 55.4741 31.4489 176.2287 511 G 3.6666 6.3122 104.5285 45.8703 0.0000 170.2252 512 V 5.0967 7.7112 119.1943 61.5876 35.3120 175.4939 513 I 4.6125 9.1454 129.1775 60.4281 38.9644 174.6211 514 I 4.6818 8.8409 128.4667 59.7406 39.6033 174.6621 515 T 5.0466 8.5715 123.7888 61.6764 71.6374 173.1271 516 I 4.9950 8.8367 127.1774 59.6529 40.3360 174.4868 517 D 5.2766 9.2725 125.7104 52.4868 45.6052 175.9024 518 D 4.4536 8.6885 118.6894 54.7351 41.0483 176.7531 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 424 E 8.44 4.36 0.00 2.20 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 0.00 2.18 2.34 0.00 425 T 8.87 3.00 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 1.18 0.00 0.00 426 A 8.69 4.30 1.08 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 0.00 427 I 8.50 4.96 1.80 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.97 0.90 0.00 0.00 428 I 8.53 5.02 1.81 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.43 1.09 0.00 0.00 429 T 8.75 5.17 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 1.39 0.00 0.00 430 L 8.90 5.44 0.00 1.59 1.53 0.99 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 431 S 8.92 4.52 0.00 3.93 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 0.00 432 K 8.34 2.91 0.00 1.55 1.56 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.27 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.52 1.40 7.81 433 D 7.83 4.46 0.00 2.59 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 434 G 8.30 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 435 R 7.58 4.67 0.00 1.86 1.82 0.00 3.10 0.00 0.00 3.55 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 436 I 8.79 4.48 1.98 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.78 1.07 0.00 0.00 437 T 9.11 4.49 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 1.32 0.00 0.00 438 E 7.94 4.84 0.00 1.89 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 0.00 2.33 2.24 0.00 439 W 8.53 5.09 0.00 3.36 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 440 N 8.63 4.78 0.00 2.81 2.93 0.00 0.00 6.76 6.04 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 0.00 441 K 8.72 4.03 0.00 1.79 1.92 0.00 1.72 0.00 0.00 1.99 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.56 1.50 7.81 442 K 8.07 3.89 0.00 1.93 1.77 0.00 1.65 0.00 0.00 1.92 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.66 7.81 443 A 8.35 3.75 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 444 E 8.20 4.75 0.00 2.34 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.97 2.68 0.00 445 Q 8.06 3.95 0.00 2.11 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 446 L 8.05 3.90 0.00 1.37 1.09 0.81 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 447 F 8.36 5.12 0.00 3.55 3.43 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 0.00 448 G 8.58 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 449 L 7.96 4.81 0.00 1.72 1.35 0.83 0.74 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 0.00 450 K 8.39 4.52 0.00 1.97 1.70 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.46 7.81 451 K 9.66 3.59 0.00 2.21 1.96 0.00 1.90 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.56 7.81 452 E 8.10 3.95 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 453 N 7.82 4.47 0.00 2.69 2.78 0.00 0.00 6.84 7.19 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 0.00 454 V 7.02 3.94 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 0.12 0.00 0.00 -0.26 0.00 0.00 455 L 7.42 4.18 0.00 1.69 1.53 1.04 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 456 G 9.10 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 0.00 0.00 0.00 457 R 7.53 4.39 0.00 1.86 1.74 0.00 2.96 0.00 0.00 3.06 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 458 R 8.17 4.48 0.00 1.92 1.83 0.00 3.26 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.53 0.00 459 L 8.69 3.87 0.00 1.75 1.71 0.66 0.80 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 0.00 460 K 7.94 4.14 0.00 1.94 1.97 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.47 7.81 461 D 7.85 4.49 0.00 2.86 2.74 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 0.00 0.00 0.00 462 L 7.98 4.34 0.00 1.79 1.63 0.38 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 463 P 0.00 5.01 0.00 2.10 2.05 0.00 3.85 0.00 0.00 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 464 D 8.93 4.68 0.00 2.63 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 0.00 465 F 8.25 4.58 0.00 3.37 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 0.00 466 E 8.07 4.04 0.00 2.09 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 0.00 2.43 2.64 0.00 467 E 8.13 3.97 0.00 2.10 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 2.51 2.48 0.00 468 I 7.99 4.09 2.07 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.74 1.15 0.00 0.00 469 G 8.77 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 470 S 8.25 4.20 0.00 4.08 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 471 V 8.28 3.34 1.67 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 -0.04 0.00 0.00 0.87 0.00 0.00 472 A 8.29 4.06 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 473 E 8.32 3.91 0.00 2.07 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 2.49 2.34 0.00 474 S 8.08 4.06 0.00 3.91 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 0.00 475 V 7.95 3.54 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 1.05 0.00 0.00 0.80 0.00 0.00 476 F 8.13 4.01 0.00 3.15 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 0.00 477 E 8.29 4.09 0.00 2.17 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 2.45 2.66 0.00 478 N 8.51 4.55 0.00 2.74 2.82 0.00 0.00 6.99 8.35 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 0.00 479 K 7.74 4.15 0.00 1.84 1.79 0.00 1.52 0.00 0.00 1.53 0.00 0.00 2.92 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.08 1.22 7.81 480 E 7.51 4.70 0.00 1.76 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 2.21 2.34 0.00 481 P 0.00 4.73 0.00 2.13 2.13 0.00 3.72 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 482 V 8.69 4.56 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 0.90 0.00 0.00 0.90 0.00 0.00 483 F 9.00 5.68 0.00 2.92 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 0.00 484 L 8.86 4.55 0.00 1.59 1.61 0.78 0.38 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 0.00 485 N 8.41 5.38 0.00 2.45 2.66 0.00 0.00 7.18 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 *487 Y 7.95 4.42 0.00 3.25 3.23 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 0.00 488 K 7.58 5.06 0.00 1.30 1.39 0.00 1.40 0.00 0.00 2.15 0.00 0.00 2.75 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.14 0.82 7.81 *490 G 7.84 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 0.00 0.00 0.00 491 E 9.12 4.58 0.00 1.90 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.25 0.00 492 R 7.67 4.53 0.00 1.79 1.14 0.00 3.11 0.00 0.00 3.41 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.53 0.00 493 Y 7.92 5.02 0.00 2.71 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 0.00 494 F 9.08 5.16 0.00 3.20 3.08 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 0.00 495 N 9.28 5.14 0.00 2.79 2.84 0.00 0.00 7.10 7.41 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 0.00 496 I 8.75 5.00 1.72 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 1.11 0.79 0.40 0.00 0.00 497 R 9.03 5.28 0.00 1.97 1.76 0.00 2.93 0.00 0.00 3.06 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 498 F 9.73 5.20 0.00 3.00 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 S 9.21 4.81 0.00 3.82 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 0.00 500 P 0.00 5.14 0.00 2.06 2.08 0.00 3.80 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 501 F 8.72 5.19 0.00 3.10 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 0.00 502 R 8.60 5.15 0.00 1.73 1.88 0.00 3.22 0.00 0.00 3.35 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 503 N 9.20 4.57 0.00 2.94 2.74 0.00 0.00 7.12 7.38 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 0.00 504 A 9.08 4.05 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 0.00 505 K 8.34 4.18 0.00 1.80 1.88 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.48 7.81 506 T 8.13 4.06 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 1.23 0.00 0.00 507 Q 8.24 3.68 0.00 2.25 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.85 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 508 L 7.75 4.14 0.00 1.64 1.62 0.94 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 509 L 8.62 4.29 0.00 1.46 1.43 0.81 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 510 E 9.53 4.34 0.00 2.07 1.59 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 2.23 2.25 0.00 511 G 6.31 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 0.00 512 V 7.71 5.10 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 1.32 0.00 0.00 1.14 0.00 0.00 513 I 9.15 4.61 1.92 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.58 0.88 0.00 0.00 514 I 8.84 4.68 1.85 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.13 0.42 0.00 0.00 515 T 8.57 5.05 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 1.19 0.00 0.00 516 I 8.84 4.99 1.75 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.57 0.70 0.00 0.00 517 D 9.27 5.28 0.00 2.66 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 518 D 8.69 4.45 0.00 2.66 2.54 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.