NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 441 Q 4.3193 8.3444 119.6841 55.2824 30.1954 174.4555 442 F 4.1094 8.6346 122.4861 58.1223 40.0127 172.7669 443 H 4.7001 8.4173 125.2259 54.4587 30.9207 174.4669 444 T 4.3811 8.3363 118.2583 61.8966 68.7224 174.7404 445 G 3.9438 8.7911 112.4291 45.4630 0.0000 173.5576 446 I 3.9869 7.3486 120.4201 60.6000 37.8471 175.2658 447 E 4.5474 8.4665 123.5682 54.7755 32.4715 175.4245 448 I 4.3040 8.4917 126.3517 60.1571 36.6806 176.3454 449 K 4.2276 9.3482 126.3370 57.1475 33.0639 177.2468 450 V 4.5494 8.0106 119.1916 60.9688 33.7435 174.4823 451 W 5.7327 8.3473 123.6857 55.2997 31.8449 173.2632 452 A 4.8346 9.0154 121.4123 50.2625 22.8321 174.8301 453 I 5.0604 8.8241 120.0392 59.4426 40.4080 174.8021 454 A 4.8326 9.1959 128.6940 50.4490 21.4864 174.6531 455 C 4.7437 8.7120 124.1621 59.0265 32.3712 173.9417 456 F 5.4372 9.4044 124.7234 57.0303 39.2369 176.6296 457 A 4.3372 8.0287 122.1628 50.7711 19.2806 176.2122 458 P 4.3075 0.0000 0.0000 62.6787 32.5586 177.7409 459 Q 3.6857 8.3948 122.8261 59.1453 28.6268 178.8975 460 R 3.6154 7.8411 115.5143 58.5685 29.4724 177.7151 461 Q 4.5794 7.2976 117.1748 55.6331 30.6952 174.9338 462 C 4.5963 8.0367 119.9720 56.9495 31.7694 173.8450 463 T 4.5217 8.0636 116.6962 60.1931 71.1953 174.8548 464 E 4.0333 8.8297 121.3010 59.6151 29.5132 179.0969 465 V 3.6527 7.8120 118.5775 64.9662 31.4996 177.8873 466 H 4.2042 8.0459 116.9235 58.8220 28.5428 177.7589 467 L 4.1613 8.1269 120.6939 57.8332 41.4760 179.7878 468 K 4.0757 8.4230 118.6936 59.3520 31.9708 179.4768 469 S 4.1295 8.3894 113.6477 61.2469 62.3058 175.8336 470 F 4.1981 8.4993 123.4257 61.7516 39.0592 177.2555 471 T 3.7107 8.3361 115.3379 66.5553 68.2774 176.1865 472 E 3.9390 8.3076 121.2035 59.5255 29.7493 178.9917 473 Q 3.9540 7.9981 118.0161 58.7305 28.7662 178.4147 474 L 3.7398 7.7376 121.5575 57.7717 42.0357 178.7228 475 R 3.9395 8.1464 119.1556 59.5037 29.9631 178.5316 476 K 3.8912 7.8949 117.8464 59.6477 32.1376 179.2955 477 I 3.6914 7.5947 118.7135 64.0002 37.6545 178.0798 478 S 4.1516 7.9169 114.5309 61.1637 63.1517 176.2407 479 R 4.0010 8.0122 122.3505 59.4580 29.6749 178.2439 480 D 4.3674 8.0168 117.1223 57.0197 40.8915 177.8614 481 A 4.2533 7.9059 118.7071 51.1956 20.1602 175.8966 482 G 3.4537 7.6139 107.0406 44.6407 0.0000 170.1822 *484 P 4.1442 0.0000 0.0000 63.0465 33.4483 176.2469 485 I 4.3842 8.2448 125.7215 59.1857 36.9548 175.6122 486 Q 4.0881 8.9871 129.4474 56.2642 29.4513 177.8945 487 G 3.8342 9.1094 114.6578 47.6214 0.0000 172.8511 488 Q 4.3902 7.3683 120.7144 53.2070 29.1734 173.3863 489 P 3.3748 0.0000 0.0000 62.2162 31.8442 176.7919 490 C 4.0097 8.2213 114.8329 59.7894 30.3805 173.3455 491 F 4.4040 7.2943 119.8242 57.6314 43.1549 172.6524 492 C 5.0732 7.6681 126.4854 58.7063 32.8932 172.5649 493 K 4.4636 7.9506 124.4184 54.6265 36.6039 175.0098 494 Y 4.9210 8.4434 118.7400 57.2737 39.6139 174.7584 495 A 4.7278 8.6255 122.9792 50.6823 23.5935 175.0078 496 Q 4.6597 8.5257 119.1471 55.4885 32.1295 175.5434 497 G 4.0991 9.1709 110.6888 45.9840 0.0000 173.8462 498 A 3.8616 8.5825 122.9399 55.0186 18.0321 179.8234 499 D 4.4276 8.0028 115.7931 55.9585 39.6971 178.0034 500 S 4.4271 7.9128 115.3519 59.8541 63.1030 176.1832 501 V 3.5763 7.4182 121.2943 65.8652 31.5290 177.1346 502 E 4.0806 7.9303 118.4333 58.7017 29.5333 177.6532 503 P 4.4300 0.0000 0.0000 63.3619 31.1248 177.9299 *505 F 4.9304 8.1335 119.7475 57.8438 41.0626 177.7271 506 R 3.9681 8.5749 119.9882 59.3912 29.8403 178.5302 507 H 4.1459 8.3301 118.0749 59.1703 29.9064 177.1905 508 L 3.9232 7.8617 120.2080 57.8078 41.2912 179.2392 509 K 3.9073 7.9270 118.0115 59.7291 32.2085 178.2470 510 N 4.4761 8.1700 115.2609 55.5906 38.5392 176.6849 511 T 4.2864 7.3772 115.7077 63.3613 70.3060 174.1013 512 Y 4.3885 7.6441 119.4338 55.3755 37.7016 174.2574 513 A 4.1485 8.1498 127.2606 53.4734 19.0203 178.1355 514 G 3.9187 8.9495 110.4765 44.6817 0.0000 173.3094 515 L 4.0372 7.3974 121.1596 56.1819 42.2216 176.4871 516 Q 4.5238 8.8367 124.8642 56.9366 30.6373 175.8210 517 L 4.5470 7.5532 117.9431 53.9932 45.8805 173.5491 518 V 4.6429 8.2903 125.8068 61.1445 33.8703 174.3943 519 V 4.6351 9.1933 129.6560 62.2101 32.8889 174.6003 520 V 4.9910 8.9582 128.6987 61.3705 33.9654 174.1076 521 I 4.8647 8.7675 129.1569 60.0571 38.8332 174.5617 522 L 5.0721 8.7258 127.7544 52.4761 43.7036 175.7332 523 P 4.3859 0.0000 0.0000 62.0771 29.8130 178.2268 524 G 3.6378 8.6364 119.2086 46.6599 0.0000 171.6023 525 K 4.3476 8.5806 124.0057 55.6369 33.3058 175.8175 526 T 4.6912 7.8932 112.8040 58.4606 72.1493 172.6512 527 P 4.5226 0.0000 0.0000 63.9568 31.0864 178.7128 528 V 3.3496 7.4808 118.5307 66.0205 31.3511 176.9359 529 Y 3.9690 7.5829 117.4891 60.8272 38.6370 178.0735 530 A 3.8573 8.0556 120.9642 55.1901 18.4362 179.0845 531 E 3.7815 7.9656 117.4725 59.1605 29.6487 179.0244 532 V 3.4062 7.9124 118.7827 66.0353 31.5482 178.2634 533 K 3.9264 7.6839 118.1203 59.0957 31.8470 179.3712 534 R 3.7926 7.9145 119.0288 59.4102 30.0295 178.8017 535 V 3.6973 8.1148 118.4555 65.8704 31.5326 178.1340 536 G 3.6537 8.5876 105.8101 48.2005 0.0000 175.3812 537 D 4.4528 8.4664 120.9953 55.9800 41.0622 177.5537 538 T 4.3643 7.8009 114.3987 64.7107 70.3378 176.0726 539 V 3.8802 7.9016 119.4531 64.9523 31.8914 176.4646 540 L 4.3759 7.9498 116.4920 53.2015 43.3190 174.0570 541 G 3.5347 7.6891 111.3491 44.9092 0.0000 172.4192 *543 A 4.2661 8.0256 126.8741 51.4754 20.1333 175.2643 544 T 5.0830 8.4476 111.3070 59.9772 72.5578 173.2771 545 Q 4.5137 8.9421 123.5896 54.9678 32.2425 173.7667 546 C 5.2794 8.9847 124.3437 59.1716 29.9836 173.4986 547 V 4.4990 8.8131 120.9022 59.7584 34.3970 175.9039 548 Q 4.5318 8.6322 126.6966 55.4783 28.4914 178.3689 *550 K 4.5088 8.5141 118.6264 57.9891 34.4068 177.3718 551 N 4.7841 8.0592 114.7376 54.1585 38.9561 175.9550 552 V 3.8038 7.4894 117.2645 64.6856 32.1688 176.9498 553 Q 4.0593 8.0320 118.4922 58.2350 28.7236 175.6880 554 R 4.6339 7.8624 116.4665 54.4242 32.1959 175.0059 555 T 4.5576 8.4054 113.3138 61.3005 70.2907 174.7104 556 T 4.7680 8.1175 112.3920 58.6014 73.3594 173.1166 557 P 4.2423 0.0000 0.0000 66.0681 31.2755 178.9847 558 Q 4.0150 8.0298 116.3658 59.2480 28.7430 178.8676 559 T 3.9356 7.9812 110.8393 64.7000 68.7599 176.7170 560 L 4.0250 8.1519 121.9215 57.4761 41.5946 179.2863 561 S 4.0686 8.5692 113.4699 61.4989 62.3393 175.7546 562 N 4.2997 8.3936 119.3972 56.4563 38.3525 177.1304 563 L 3.9764 7.9890 121.3761 58.3758 42.1504 178.6454 564 C 4.1098 8.3770 116.9956 62.9152 28.0839 176.2246 565 L 4.0680 8.1798 120.5064 57.7031 41.2076 179.6816 566 K 4.0016 8.0782 118.4631 59.5821 31.9183 179.4871 567 I 3.6865 7.8690 120.0430 64.2742 36.9764 177.9632 568 N 4.1193 8.3643 118.1395 56.5493 37.8941 177.0343 569 V 3.5793 7.8117 119.5379 65.9781 31.4191 178.1923 570 K 4.0040 7.7904 116.7887 59.1425 32.0848 178.6504 571 L 4.4947 7.9261 116.2422 55.8968 42.1245 178.1958 572 G 3.6324 8.0054 106.8629 46.4810 0.0000 173.9803 573 G 3.6188 7.3186 112.3046 44.8569 0.0000 173.0262 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 441 Q 8.34 4.32 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.89 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 442 F 8.63 4.11 0.00 2.99 2.93 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 0.00 443 H 8.42 4.70 0.00 2.94 3.04 0.00 5.69 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 444 T 8.34 4.38 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 1.24 0.00 0.00 445 G 8.79 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 0.00 446 I 7.35 3.99 1.78 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 1.32 0.47 0.83 0.00 0.00 447 E 8.47 4.55 0.00 1.89 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 2.20 2.29 0.00 448 I 8.49 4.30 1.64 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 1.17 0.72 0.82 0.00 0.00 449 K 9.35 4.23 0.00 1.75 1.91 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.39 7.81 450 V 8.01 4.55 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 1.11 0.00 0.00 0.99 0.00 0.00 451 W 8.35 5.73 0.00 3.58 3.04 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 0.00 452 A 9.02 4.83 1.05 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 0.00 453 I 8.82 5.06 1.78 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 1.48 0.96 0.90 0.00 0.00 454 A 9.20 4.83 1.50 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 0.00 0.00 455 C 8.71 4.74 0.00 2.71 2.30 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 0.00 456 F 9.40 5.44 0.00 3.20 3.14 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 0.00 0.00 0.00 457 A 8.03 4.34 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 0.00 458 P 0.00 4.31 0.00 2.15 1.97 0.00 3.76 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 459 Q 8.39 3.69 0.00 0.93 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.90 0.00 0.00 0.00 0.00 0.00 2.15 1.90 0.00 460 R 7.84 3.62 0.00 1.96 1.99 0.00 3.04 0.00 0.00 3.19 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.69 0.00 461 Q 7.30 4.58 0.00 1.99 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 7.06 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 462 C 8.04 4.60 0.00 2.90 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 0.00 463 T 8.06 4.52 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 1.32 0.00 0.00 464 E 8.83 4.03 0.00 2.16 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 2.40 2.40 0.00 465 V 7.81 3.65 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 0.76 0.00 0.00 0.93 0.00 0.00 466 H 8.05 4.20 0.00 3.57 3.44 0.00 5.81 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 0.00 467 L 8.13 4.16 0.00 1.90 1.78 0.69 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 468 K 8.42 4.08 0.00 1.83 1.89 0.00 1.68 0.00 0.00 1.58 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.61 7.81 469 S 8.39 4.13 0.00 3.98 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 0.00 470 F 8.50 4.20 0.00 3.24 3.38 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 0.00 471 T 8.34 3.71 4.53 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 1.54 0.00 0.00 472 E 8.31 3.94 0.00 2.10 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 2.32 2.40 0.00 473 Q 8.00 3.95 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.56 2.52 0.00 474 L 7.74 3.74 0.00 1.06 1.38 0.74 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 475 R 8.15 3.94 0.00 2.12 1.97 0.00 3.32 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.92 0.00 476 K 7.89 3.89 0.00 1.95 1.81 0.00 1.72 0.00 0.00 1.56 0.00 0.00 3.09 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.58 1.57 7.81 477 I 7.59 3.69 1.83 0.00 0.00 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 1.54 1.31 0.91 0.00 0.00 478 S 7.92 4.15 0.00 4.01 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 0.00 479 R 8.01 4.00 0.00 1.94 2.17 0.00 3.15 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 480 D 8.02 4.37 0.00 2.81 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 0.00 481 A 7.91 4.25 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 0.00 482 G 7.61 3.45 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 0.00 *484 P 0.00 4.14 0.00 2.14 2.24 0.00 3.88 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 485 I 8.24 4.38 1.54 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.39 -0.14 0.00 0.00 486 Q 8.99 4.09 0.00 2.24 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.79 0.00 0.00 0.00 0.00 0.00 2.76 2.44 0.00 487 G 9.11 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 0.00 0.00 0.00 488 Q 7.37 4.39 0.00 2.06 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 2.24 2.21 0.00 489 P 0.00 3.37 0.00 1.66 0.49 0.00 3.54 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.43 0.00 490 C 8.22 4.01 0.00 2.79 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 0.00 491 F 7.29 4.40 0.00 2.49 2.35 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 0.00 492 C 7.67 5.07 0.00 2.72 2.53 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 0.00 493 K 7.95 4.46 0.00 1.41 1.44 0.00 1.53 0.00 0.00 1.66 0.00 0.00 2.61 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.94 0.21 7.81 494 Y 8.44 4.92 0.00 2.80 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 0.00 495 A 8.63 4.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 496 Q 8.53 4.66 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.47 0.00 0.00 0.00 0.00 0.00 2.28 2.39 0.00 497 G 9.17 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 0.00 498 A 8.58 3.86 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 0.00 499 D 8.00 4.43 0.00 2.84 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 0.00 500 S 7.91 4.43 0.00 4.29 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 0.00 501 V 7.42 3.58 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 -0.05 0.00 0.00 0.48 0.00 0.00 502 E 7.93 4.08 0.00 2.02 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 2.39 2.42 0.00 503 P 0.00 4.43 0.00 2.25 2.07 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 2.13 2.13 0.00 *505 F 8.13 4.93 0.00 3.13 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 0.00 506 R 8.57 3.97 0.00 2.03 2.02 0.00 3.32 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.96 0.00 507 H 8.33 4.15 0.00 3.31 3.34 0.00 5.79 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 0.00 508 L 7.86 3.92 0.00 1.75 1.52 0.63 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 509 K 7.93 3.91 0.00 1.73 1.97 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.47 7.81 510 N 8.17 4.48 0.00 2.73 2.82 0.00 0.00 7.01 7.04 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 0.00 511 T 7.38 4.29 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 0.52 0.00 0.00 512 Y 7.64 4.39 0.00 3.03 2.88 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 0.00 513 A 8.15 4.15 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 0.00 514 G 8.95 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 0.00 515 L 7.40 4.04 0.00 1.85 1.63 0.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 516 Q 8.84 4.52 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.36 0.00 0.00 0.00 0.00 0.00 2.32 2.54 0.00 517 L 7.55 4.55 0.00 1.72 1.51 0.97 0.77 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 0.00 518 V 8.29 4.64 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 0.79 0.00 0.00 0.61 0.00 0.00 519 V 9.19 4.64 2.48 0.00 0.00 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 1.08 0.00 0.00 520 V 8.96 4.99 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 1.36 0.00 0.00 1.29 0.00 0.00 521 I 8.77 4.86 1.90 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.59 0.87 0.00 0.00 522 L 8.73 5.07 0.00 1.54 1.61 1.07 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 523 P 0.00 4.39 0.00 2.11 2.14 0.00 3.96 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 2.02 2.31 0.00 524 G 8.64 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 0.00 0.00 0.00 525 K 8.58 4.35 0.00 1.83 1.82 0.00 1.44 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.45 7.81 526 T 7.89 4.69 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 1.27 0.00 0.00 527 P 0.00 4.52 0.00 2.15 2.11 0.00 3.60 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 528 V 7.48 3.35 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 0.30 0.00 0.00 0.77 0.00 0.00 529 Y 7.58 3.97 0.00 3.14 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 0.00 530 A 8.06 3.86 1.33 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 0.00 0.00 0.00 0.00 0.00 0.00 531 E 7.97 3.78 0.00 2.02 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 2.37 2.15 0.00 532 V 7.91 3.41 2.03 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 1.15 0.00 0.00 0.70 0.00 0.00 533 K 7.68 3.93 0.00 1.66 1.67 0.00 1.62 0.00 0.00 1.42 0.00 0.00 2.76 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.71 1.05 7.81 534 R 7.91 3.79 0.00 1.92 1.99 0.00 3.07 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 535 V 8.11 3.70 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 1.12 0.00 0.00 0.90 0.00 0.00 536 G 8.59 3.65 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 0.00 0.00 0.00 537 D 8.47 4.45 0.00 2.73 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 0.00 538 T 7.80 4.36 4.43 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 1.21 0.00 0.00 539 V 7.90 3.88 2.27 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 0.82 0.00 0.00 0.93 0.00 0.00 540 L 7.95 4.38 0.00 1.78 1.70 1.07 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 541 G 7.69 3.53 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 0.00 *543 A 8.03 4.27 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 0.00 544 T 8.45 5.08 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 1.07 0.00 0.00 545 Q 8.94 4.51 0.00 2.18 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.92 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 546 C 8.98 5.28 0.00 3.10 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 0.00 547 V 8.81 4.50 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 0.81 0.00 0.00 0.89 0.00 0.00 548 Q 8.63 4.53 0.00 2.10 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.51 0.00 0.00 0.00 0.00 0.00 2.43 2.27 0.00 *550 K 8.51 4.51 0.00 1.96 2.11 0.00 1.66 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.39 1.44 7.81 551 N 8.06 4.78 0.00 2.90 2.96 0.00 0.00 6.89 7.06 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 0.00 552 V 7.49 3.80 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 0.50 0.00 0.00 0.30 0.00 0.00 553 Q 8.03 4.06 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.63 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 554 R 7.86 4.63 0.00 1.80 1.86 0.00 3.18 0.00 0.00 3.30 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 555 T 8.41 4.56 4.35 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 1.55 0.00 0.00 556 T 8.12 4.77 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 1.24 0.00 0.00 557 P 0.00 4.24 0.00 2.18 2.15 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 558 Q 8.03 4.01 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 559 T 7.98 3.94 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 1.24 0.00 0.00 560 L 8.15 4.02 0.00 1.87 1.73 0.89 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 561 S 8.57 4.07 0.00 3.86 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 0.00 562 N 8.39 4.30 0.00 2.97 2.89 0.00 0.00 6.72 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 0.00 563 L 7.99 3.98 0.00 1.85 1.88 0.99 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 564 C 8.38 4.11 0.00 3.17 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 0.00 565 L 8.18 4.07 0.00 1.88 1.76 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 566 K 8.08 4.00 0.00 2.00 2.06 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.64 7.81 567 I 7.87 3.69 1.96 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.79 0.82 0.00 0.00 568 N 8.36 4.12 0.00 2.74 2.87 0.00 0.00 6.86 8.29 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 0.00 569 V 7.81 3.58 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 0.98 0.00 0.00 1.01 0.00 0.00 570 K 7.79 4.00 0.00 1.91 1.83 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.34 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.48 7.81 571 L 7.93 4.49 0.00 1.52 1.64 0.93 1.25 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 0.00 572 G 8.01 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 0.00 573 G 7.32 3.62 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 0.00 * Residues marked with a * may have inaccurate shift predictions.