NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 423 G 3.9775 8.3393 109.7360 45.3782 0.0000 173.3469 424 S 3.9293 8.5755 113.1312 60.6592 63.1658 172.6202 425 H 4.7541 8.1197 119.0228 55.2060 28.6386 175.7697 426 M 4.3550 8.4555 123.2850 53.9985 34.3784 174.1295 427 A 4.3791 7.9284 128.5833 52.4787 19.4347 176.4145 428 V 4.2421 8.6843 121.3096 61.0922 33.9998 174.5415 429 I 4.5157 8.3913 129.6008 60.7139 38.0787 175.4419 430 T 4.6963 8.4316 116.4094 58.6430 71.7386 173.2299 431 P 3.6084 0.0000 0.0000 65.1192 31.3372 177.9876 432 Q 4.3892 7.6855 115.5269 55.6638 28.8487 175.2620 433 G 3.8169 7.9017 105.7317 44.1031 0.0000 173.2470 434 V 4.1718 8.0688 118.4735 62.7472 32.0942 175.2295 435 T 4.6872 8.9238 116.2681 60.0280 71.8919 172.8018 436 N 4.2881 8.7378 115.5760 53.3991 35.6819 176.7174 437 W 5.1962 7.8667 126.9699 56.1751 31.9231 173.8664 438 T 4.3959 8.7184 117.0338 60.0691 71.3942 174.8861 439 Y 3.7919 8.2713 121.7278 60.8362 38.7212 177.8744 440 Q 3.6852 7.9100 119.8811 59.0978 29.1807 178.1255 441 E 3.5550 7.5898 119.2854 59.0075 29.3964 178.9713 442 L 3.4552 6.6366 120.2054 57.8990 41.9882 178.5674 443 E 3.6112 7.8129 119.1562 59.1761 29.4674 178.6401 444 A 3.8871 7.6529 120.7026 55.3913 18.3075 179.7869 445 T 3.8008 7.7467 114.1714 66.8956 68.4621 176.3163 446 H 3.9879 8.5754 120.5801 59.4438 29.8414 177.3403 447 Q 3.9282 8.3510 119.7349 58.7832 28.5373 178.5297 448 A 3.9456 7.9366 121.7791 55.2240 18.4265 179.5982 449 L 3.8196 7.9243 117.5080 58.1460 41.6013 179.8583 450 T 4.0458 8.0097 115.6925 66.9077 68.2226 176.6296 451 R 3.9469 7.8687 118.4780 59.3214 30.2341 178.0281 452 E 4.3092 7.9862 115.8394 56.6181 29.8447 176.9627 453 G 3.8211 8.3613 106.5493 46.6493 0.0000 172.3931 454 Y 4.9714 7.9050 116.0877 56.2046 40.0801 175.4993 455 V 4.5766 8.8314 121.7558 60.8360 34.9757 174.5359 456 F 3.9380 9.0195 130.2692 58.4016 39.4923 174.8997 457 V 3.9605 8.9947 117.4749 59.9034 33.5966 175.7305 458 G 3.7725 5.3800 109.5033 44.6955 0.0000 170.5473 459 Y 5.2176 8.3574 117.7996 57.1330 40.1310 174.7635 460 H 5.1068 9.7014 122.6898 54.5082 32.7689 172.2906 461 G 4.4848 8.6937 113.0209 45.4122 0.0000 172.1295 462 T 4.9902 8.7486 117.0587 61.6313 71.8873 172.2499 463 N 4.9778 8.6824 120.7789 52.2759 37.8985 175.6767 464 H 4.3242 8.6403 114.3518 58.4196 28.4424 177.9339 465 V 3.4889 7.5316 120.4825 65.9521 31.6089 177.6273 466 A 4.0010 8.4300 120.3019 55.1455 18.1775 179.3836 467 A 4.0133 8.2026 119.3018 55.4077 18.4683 179.6575 468 Q 3.9233 7.8452 117.1267 59.5194 29.1034 178.4953 469 T 3.8788 7.6860 116.9340 66.8441 68.2922 176.6940 470 I 3.8041 7.6937 120.3996 64.3045 37.2180 178.3508 471 V 3.7321 7.7068 118.2448 65.8147 31.3681 177.4531 472 N 4.4566 7.9717 115.4862 54.2198 38.7951 175.4132 473 R 4.2861 7.0810 114.0667 55.5159 33.8742 173.8148 474 I 4.0946 8.6281 126.6697 60.9627 37.7799 175.1490 475 A 4.5661 8.2093 127.0543 49.6382 21.9729 174.0121 476 P 2.0000 0.0000 0.0000 61.7744 32.0663 175.6196 *487 E 4.4131 8.5844 116.9475 56.3991 31.0675 177.3457 488 K 3.6331 8.1646 119.0705 59.1087 32.0553 177.9194 489 W 4.7549 8.0602 115.3328 56.2813 29.3924 176.5497 490 G 3.9528 8.2041 108.0081 44.9608 0.0000 174.7525 491 G 2.8575 7.9721 108.7785 44.3208 0.0000 170.6611 492 L 4.2352 6.7107 122.0841 53.8784 43.2099 175.3245 493 Y 4.9094 8.7738 124.3271 57.2639 39.2519 175.2026 494 V 4.9794 8.9079 115.9818 59.8833 37.2317 174.0275 495 A 5.1132 9.1407 122.8091 50.7245 21.9068 177.8707 496 T 4.1921 8.9703 111.9402 64.1022 69.6911 174.1238 497 H 4.6691 8.3428 122.4907 54.7253 30.0555 174.8892 498 A 3.7488 8.7662 130.1169 55.4449 18.0029 178.5292 499 E 3.7785 7.8644 117.0032 59.1744 29.3926 179.0797 500 V 3.5993 7.6421 117.4854 66.1005 31.9565 177.6463 501 A 4.3812 8.0946 119.9914 55.4567 18.4097 178.8954 502 H 4.2197 8.7173 117.2370 59.2107 29.6585 177.6023 503 G 3.5476 7.9338 106.8326 47.0342 0.0000 174.0612 504 Y 4.6272 7.9289 116.4776 57.2935 39.8929 175.6466 505 A 4.7969 7.7183 126.2117 49.7569 17.4487 176.5865 506 R 4.7957 7.0696 115.9343 54.4409 32.6587 175.7270 507 I 3.9379 8.2828 120.5547 61.7470 37.6172 176.9806 508 K 4.6785 8.6908 122.3798 56.5618 33.7484 176.3165 509 E 4.8950 7.9926 117.1988 54.4825 33.4419 175.0649 510 G 3.6788 8.6677 112.0745 45.4005 0.0000 173.5027 511 T 4.3669 8.5240 110.9097 60.9265 69.4433 174.6556 512 G 3.8662 8.0499 113.1976 44.3076 0.0000 172.8152 513 E 3.5934 8.4651 116.6029 57.9357 29.5431 176.8089 514 Y 3.7018 8.7942 118.0143 59.0563 35.4458 170.5961 515 G 3.9571 8.0144 106.0214 45.8144 0.0000 174.5681 516 L 4.2355 7.9020 120.2243 53.3788 42.2422 175.1955 517 P 4.4548 0.0000 0.0000 62.4570 32.1463 176.8121 518 T 4.1699 8.8864 111.8059 61.1117 70.9882 175.6972 519 R 3.8365 8.4490 120.3675 59.5713 29.8972 178.1328 520 A 4.0126 7.9522 120.0130 55.2383 18.1759 179.3099 521 E 3.9108 7.8300 115.8087 59.6095 29.5753 179.4771 522 R 4.1253 7.8581 117.1848 59.2867 30.2278 178.4190 523 D 4.5420 8.0793 116.7797 55.3033 41.2070 176.7336 524 A 4.5226 7.0457 120.6379 52.0146 19.2693 177.0855 525 R 4.7806 8.7578 118.1022 54.2698 34.1863 176.4733 526 G 4.0320 8.8944 110.1784 45.9558 0.0000 171.9841 527 V 4.8822 8.8641 118.9111 61.3045 35.1098 174.4507 528 M 4.9220 8.7890 126.9527 54.3761 33.5334 175.0540 529 L 5.3268 9.2067 124.1463 53.1682 45.4293 175.5439 530 R 5.1240 9.4071 121.0075 54.7077 32.5641 175.2196 531 V 4.9754 8.6011 124.5047 61.4207 33.9776 173.9746 532 Y 5.3347 9.3271 125.2008 56.1419 41.5586 174.6435 533 I 5.0258 8.4962 115.9796 58.1680 41.3507 173.3831 534 P 4.0247 0.0000 0.0000 62.0028 32.0624 177.8895 535 R 3.7161 8.6421 119.6964 59.5547 29.1760 179.1415 536 A 3.9634 7.8378 120.5906 54.8981 18.3444 179.3419 537 S 4.1885 8.0942 113.3827 60.9102 62.6038 176.4387 538 L 3.9156 7.5862 121.2579 57.2302 41.2917 178.5452 539 E 4.0361 7.8787 118.4796 58.0101 30.0711 176.6717 540 R 3.9266 7.9742 118.4956 55.8114 31.2467 175.8052 541 F 4.6938 7.7054 122.7550 56.6797 40.3674 173.7541 542 Y 4.9778 8.0254 122.9404 56.3873 40.2809 174.4383 543 R 4.9017 8.3825 120.4944 55.1522 33.0681 173.9960 544 T 4.8548 9.0013 119.0419 60.4965 70.8999 174.1172 545 N 4.6610 8.8310 121.6046 54.2120 39.2731 175.7852 546 T 4.1534 7.5509 116.3470 61.9750 69.3952 172.8907 547 P 4.3587 0.0000 0.0000 62.9178 32.2075 176.9417 548 L 3.8943 8.7430 125.4520 58.1090 42.0710 178.7020 549 E 3.2938 7.7851 113.9015 57.8167 29.6456 176.7768 550 N 4.8089 8.0635 116.2278 53.1251 38.9020 174.7751 551 A 4.7139 7.9269 120.6495 51.8266 19.6757 178.7142 552 E 3.8938 8.4891 122.0820 60.8413 29.5300 178.8242 553 E 3.8638 8.0334 117.9853 59.5437 29.6804 178.4156 554 H 4.0300 8.1440 117.7329 59.3695 29.9133 177.0502 555 I 2.9216 7.7571 121.9649 64.3955 36.8647 178.6141 556 T 3.9092 7.7750 112.0011 64.1417 68.2676 176.3085 557 Q 3.8482 7.7208 121.6783 58.9190 29.1418 178.1685 558 V 3.5879 7.4653 118.4614 65.6711 31.6967 177.5564 559 I 3.9906 7.5868 110.8666 61.1612 37.8135 176.8456 560 G 3.8640 9.2960 108.5382 45.6930 0.0000 172.2649 561 H 4.7295 7.1579 113.7656 53.9196 31.1052 172.9944 562 S 4.3364 8.2983 114.5776 57.5188 63.6132 174.1295 563 L 3.9604 7.9192 121.4463 54.1005 41.8384 175.5048 564 P 4.6674 0.0000 0.0000 61.0645 32.3811 176.0507 565 L 4.2701 8.1560 118.8543 55.3170 43.5415 175.8873 566 R 4.4623 8.9855 118.9178 56.7159 29.4784 178.6234 567 N 4.9922 8.9928 123.1429 51.7603 37.4669 171.6794 568 E 5.0045 7.3033 118.4057 55.6182 33.5561 175.3037 569 A 5.0622 8.6867 120.9062 50.0840 23.0225 174.8436 570 F 4.8778 8.9125 121.2606 56.6680 42.9988 173.7484 571 T 4.9694 8.3186 122.2221 62.0462 71.7195 173.4722 572 G 4.3883 8.4309 110.5203 44.7460 0.0000 170.6313 573 P 4.8789 0.0000 0.0000 62.8835 31.5891 178.0116 574 E 4.3614 9.3936 123.0506 59.1664 30.2830 176.8045 575 S 4.4868 7.7909 112.6797 56.3705 65.8789 173.0547 576 A 4.1063 8.3924 124.2725 53.5881 18.3349 178.2231 577 G 3.8404 8.8585 109.9409 45.7435 0.0000 173.6055 578 G 4.0499 7.9956 107.3600 44.6138 0.0000 173.7936 579 E 4.3984 8.5214 119.0286 56.0368 30.7967 176.6927 580 D 5.0958 8.6349 121.3051 54.5545 41.8661 175.5886 581 E 5.0154 9.2396 118.7277 54.9342 33.7061 174.4798 582 T 4.9002 8.8853 117.3409 61.7904 72.0960 173.0882 583 V 3.8608 8.4173 126.8328 61.1716 33.3919 174.4839 584 I 4.3066 8.2934 130.6133 59.5673 38.4535 175.9521 585 G 3.9779 8.6265 115.2128 45.4623 0.0000 174.3369 586 W 4.6024 8.8761 122.5798 59.9023 28.8829 178.6652 587 D 4.5445 8.2785 117.3776 57.0192 40.5162 177.6865 588 M 4.3375 8.0720 118.1186 58.0355 32.5899 177.8080 589 A 4.1168 8.4496 121.5985 54.8952 18.3245 179.3360 590 I 4.0222 7.8722 110.4984 63.5452 37.7622 177.1332 591 H 4.7089 8.1132 116.3730 55.5918 29.1632 174.7565 592 A 4.9783 7.6935 123.6426 51.2268 20.1796 176.9445 593 V 4.6474 8.9285 117.1292 60.1554 35.0611 174.3716 594 A 5.6231 8.7265 123.8347 50.3010 21.7936 175.4862 595 I 4.6927 8.7674 113.4905 58.2036 41.4832 173.1064 596 P 4.8187 0.0000 0.0000 63.0124 31.8506 176.2725 597 S 4.9074 9.2665 119.5050 58.2822 63.5614 173.7794 598 T 4.6438 9.5938 110.9416 61.3475 68.8769 174.7723 599 I 4.0102 7.9345 124.6009 60.3589 37.5188 174.3551 600 P 4.3860 0.0000 0.0000 62.6418 31.7539 176.4782 601 G 4.2804 8.3255 108.4652 45.6345 0.0000 171.2532 602 N 5.0720 8.5085 118.0676 52.8078 41.8858 173.1868 603 A 4.9667 8.2309 117.9882 51.0414 22.2784 176.3507 604 Y 4.3036 8.8557 119.2398 59.8130 38.7900 176.3828 605 E 4.2903 8.0253 119.0405 54.5325 30.2529 175.9323 606 E 4.3390 8.5376 123.9699 56.3202 30.2523 176.4011 607 L 4.8089 8.7939 121.6969 52.4483 45.0635 176.7159 608 A 4.1365 8.3648 124.5223 51.7027 19.0564 177.6127 609 I 3.3931 7.9190 121.3057 60.9016 38.8049 176.4342 610 D 4.5638 8.2827 125.3399 53.3226 40.7474 176.6929 611 E 3.9478 8.4777 127.5547 58.9518 29.6342 178.4151 612 E 3.8420 8.3048 118.8637 59.4082 29.6039 178.7286 613 A 3.9713 8.0236 120.5955 54.8294 18.1831 179.6293 614 V 3.4578 7.4825 115.7938 66.2447 31.8828 177.8337 615 A 4.0807 8.1466 120.5183 55.0387 17.9883 179.3961 616 K 3.5853 7.8056 117.0707 59.4195 32.3660 178.1022 617 E 4.3381 7.9213 116.6119 57.2202 29.6809 178.2019 618 Q 3.9976 7.8193 121.2399 59.3053 28.9033 178.3476 619 S 4.3224 8.0519 113.2294 60.0864 63.2625 175.1287 620 I 4.3192 7.1073 115.2140 60.4636 37.6458 175.5749 621 S 3.7721 7.6122 115.4261 58.3464 63.8857 174.5983 622 T 4.1906 7.8916 109.5625 61.1153 69.2760 174.1235 623 K 4.2034 8.4384 122.7062 55.7871 32.7037 175.5312 624 P 4.3409 0.0000 0.0000 61.3281 32.1396 174.2772 625 P 4.2727 0.0000 0.0000 62.8556 32.0047 175.1167 626 Y 5.0565 8.0760 117.2402 56.1819 41.2863 175.7804 627 K 4.3371 8.9864 122.7828 56.0884 33.0331 176.8476 628 E 4.3636 8.5298 125.5365 56.5634 29.2277 174.6622 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 423 G 8.34 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 0.00 0.00 0.00 424 S 8.58 3.93 0.00 4.01 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 0.00 425 H 8.12 4.75 0.00 3.29 3.47 0.00 5.74 0.00 0.00 0.00 0.00 6.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 426 M 8.46 4.36 0.00 1.92 2.03 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 427 A 7.93 4.38 0.36 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 0.00 428 V 8.68 4.24 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 0.97 0.00 0.00 0.99 0.00 0.00 429 I 8.39 4.52 2.03 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.61 0.99 0.00 0.00 430 T 8.43 4.70 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 1.22 0.00 0.00 431 P 0.00 3.61 0.00 2.11 1.97 0.00 3.54 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 2.08 2.06 0.00 432 Q 7.69 4.39 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.44 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 433 G 7.90 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 0.00 0.00 0.00 434 V 8.07 4.17 2.19 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 0.87 0.00 0.00 0.97 0.00 0.00 435 T 8.92 4.69 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 1.24 0.00 0.00 436 N 8.74 4.29 0.00 2.94 3.02 0.00 0.00 6.61 7.68 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 0.00 437 W 7.87 5.20 0.00 3.35 3.01 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 0.00 438 T 8.72 4.40 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 1.21 0.00 0.00 439 Y 8.27 3.79 0.00 3.07 3.01 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 0.00 440 Q 7.91 3.69 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.69 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 441 E 7.59 3.55 0.00 1.43 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 2.12 2.11 0.00 442 L 6.64 3.46 0.00 1.11 1.21 1.17 0.87 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 0.00 443 E 7.81 3.61 0.00 1.16 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 2.19 2.42 0.00 444 A 7.65 3.89 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 0.00 445 T 7.75 3.80 4.50 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 1.25 0.00 0.00 446 H 8.58 3.99 0.00 3.31 3.48 0.00 5.78 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 0.00 447 Q 8.35 3.93 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.64 2.51 0.00 448 A 7.94 3.95 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 0.00 449 L 7.92 3.82 0.00 1.56 1.41 0.07 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 450 T 8.01 4.05 4.39 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 1.22 0.00 0.00 451 R 7.87 3.95 0.00 1.92 2.01 0.00 3.15 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 452 E 7.99 4.31 0.00 2.12 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 0.00 2.46 2.60 0.00 453 G 8.36 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 0.00 0.00 0.00 454 Y 7.91 4.97 0.00 3.00 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 0.00 455 V 8.83 4.58 1.94 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 0.82 0.00 0.00 0.86 0.00 0.00 456 F 9.02 3.94 0.00 2.55 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 0.00 457 V 8.99 3.96 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 0.08 0.00 0.00 0.84 0.00 0.00 458 G 5.38 3.77 0.00 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0.00 0.00 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 R 8.38 4.90 0.00 1.05 1.66 0.00 2.21 0.00 0.00 3.01 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.40 0.00 544 T 9.00 4.85 4.54 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 1.43 0.00 0.00 545 N 8.83 4.66 0.00 2.74 2.83 0.00 0.00 7.00 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 0.00 546 T 7.55 4.15 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 1.22 0.00 0.00 547 P 0.00 4.36 0.00 2.12 1.95 0.00 3.57 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 548 L 8.74 3.89 0.00 1.66 1.47 1.01 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 549 E 7.79 3.29 0.00 1.68 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 2.08 2.18 0.00 550 N 8.06 4.81 0.00 2.77 2.84 0.00 0.00 6.71 6.91 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 0.00 551 A 7.93 4.71 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 0.00 552 E 8.49 3.89 0.00 2.22 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 2.28 2.18 0.00 553 E 8.03 3.86 0.00 2.04 1.95 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 2.37 2.35 0.00 554 H 8.14 4.03 0.00 3.20 3.38 0.00 5.87 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 0.00 555 I 7.76 2.92 1.69 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.00 0.46 0.00 0.00 556 T 7.78 3.91 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 1.08 0.00 0.00 557 Q 7.72 3.85 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 7.00 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 558 V 7.47 3.59 1.95 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 0.18 0.00 0.00 0.76 0.00 0.00 559 I 7.59 3.99 2.11 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.39 0.93 0.00 0.00 560 G 9.30 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 0.00 0.00 0.00 561 H 7.16 4.73 0.00 3.31 3.38 0.00 5.66 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 562 S 8.30 4.34 0.00 3.93 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 0.00 563 L 7.92 3.96 0.00 1.31 1.43 -0.35 0.61 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 0.00 564 P 0.00 4.67 0.00 2.20 2.32 0.00 3.35 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 565 L 8.16 4.27 0.00 1.63 1.67 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 566 R 8.99 4.46 0.00 2.03 1.12 0.00 2.88 0.00 0.00 3.01 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 567 N 8.99 4.99 0.00 2.74 2.80 0.00 0.00 6.68 7.65 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 0.00 568 E 7.30 5.00 0.00 2.37 2.19 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 2.33 2.43 0.00 569 A 8.69 5.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 570 F 8.91 4.88 0.00 3.12 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 0.00 571 T 8.32 4.97 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 1.01 0.00 0.00 572 G 8.43 4.39 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 0.00 573 P 0.00 4.88 0.00 2.08 2.03 0.00 3.69 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 2.24 2.08 0.00 574 E 9.39 4.36 0.00 1.93 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 2.36 2.54 0.00 575 S 7.79 4.49 0.00 3.95 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 0.00 576 A 8.39 4.11 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 0.00 577 G 8.86 3.84 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 0.00 578 G 8.00 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 0.00 579 E 8.52 4.40 0.00 1.95 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 2.31 0.00 580 D 8.63 5.10 0.00 2.60 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 581 E 9.24 5.02 0.00 2.07 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 0.00 2.32 2.24 0.00 582 T 8.89 4.90 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 1.05 0.00 0.00 583 V 8.42 3.86 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.31 0.00 0.00 584 I 8.29 4.31 1.70 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.47 0.94 0.00 0.00 585 G 8.63 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 0.00 0.00 0.00 586 W 8.88 4.60 0.00 3.43 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 0.00 587 D 8.28 4.54 0.00 2.85 2.82 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 0.00 588 M 8.07 4.34 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.70 0.00 589 A 8.45 4.12 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 0.00 590 I 7.87 4.02 1.88 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 1.84 0.42 1.14 0.00 0.00 591 H 8.11 4.71 0.00 3.36 3.45 0.00 5.84 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 592 A 7.69 4.98 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 0.00 593 V 8.93 4.65 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 0.60 0.00 0.00 0.84 0.00 0.00 594 A 8.73 5.62 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 0.00 595 I 8.77 4.69 1.91 0.00 0.00 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 1.50 1.22 0.86 0.00 0.00 596 P 0.00 4.82 0.00 1.45 1.94 0.00 3.12 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.91 0.00 597 S 9.27 4.91 0.00 4.29 4.22 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 0.00 598 T 9.59 4.64 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 1.22 0.00 0.00 599 I 7.93 4.01 1.86 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.59 0.86 0.00 0.00 600 P 0.00 4.39 0.00 2.08 2.03 0.00 3.69 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 601 G 8.33 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 0.00 0.00 0.00 602 N 8.51 5.07 0.00 2.59 2.76 0.00 0.00 7.30 7.74 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 0.00 603 A 8.23 4.97 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 0.00 604 Y 8.86 4.30 0.00 2.93 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 0.00 605 E 8.03 4.29 0.00 2.04 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 0.00 2.19 2.47 0.00 606 E 8.54 4.34 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 2.23 2.22 0.00 607 L 8.79 4.81 0.00 1.59 1.55 0.95 0.66 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 0.00 608 A 8.36 4.14 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 0.00 609 I 7.92 3.39 1.78 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.56 0.81 0.00 0.00 610 D 8.28 4.56 0.00 2.81 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 0.00 611 E 8.48 3.95 0.00 1.99 1.95 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 2.36 2.28 0.00 612 E 8.30 3.84 0.00 2.00 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 2.34 2.35 0.00 613 A 8.02 3.97 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 0.00 614 V 7.48 3.46 2.18 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 0.81 0.00 0.00 0.87 0.00 0.00 615 A 8.15 4.08 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 0.00 616 K 7.81 3.59 0.00 1.68 1.57 0.00 1.57 0.00 0.00 1.33 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.35 1.05 7.81 617 E 7.92 4.34 0.00 2.12 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 2.57 2.45 0.00 618 Q 7.82 4.00 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 619 S 8.05 4.32 0.00 4.06 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 0.00 620 I 7.11 4.32 1.24 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.53 0.88 0.00 0.00 621 S 7.61 3.77 0.00 3.78 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 0.00 622 T 7.89 4.19 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 1.23 0.00 0.00 623 K 8.44 4.20 0.00 1.86 1.92 0.00 2.02 0.00 0.00 1.91 0.00 0.00 3.12 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.62 1.56 7.81 624 P 0.00 4.34 0.00 1.64 1.82 0.00 3.73 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 1.30 1.72 0.00 625 P 0.00 4.27 0.00 2.10 2.00 0.00 3.44 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.87 0.00 626 Y 8.08 5.06 0.00 2.90 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 0.00 627 K 8.99 4.34 0.00 1.62 1.85 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.28 1.44 7.81 628 E 8.53 4.36 0.00 2.00 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 2.24 2.57 0.00 * Residues marked with a * may have inaccurate shift predictions.