NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 407 I 4.1845 8.0093 118.5489 59.3281 36.8427 175.2436 408 S 4.2035 8.3464 121.5778 54.5381 63.8967 172.6348 409 P 4.2881 0.0000 0.0000 67.0404 31.3553 180.4857 410 K 3.9177 8.0489 122.5762 59.7519 31.5971 180.7350 411 E 4.1081 8.2121 120.7324 58.7771 29.4119 179.0776 412 K 3.9833 7.8755 118.3625 59.1644 32.1250 178.6010 413 E 3.9474 8.3174 119.6181 59.7307 29.5200 178.3803 414 K 3.9436 7.7900 118.0995 59.8476 32.0076 178.7503 415 I 3.6673 8.0226 119.0503 64.7941 37.2155 177.8638 416 A 4.0669 8.1982 121.2422 55.6045 18.1633 179.5096 417 I 3.3541 7.9429 117.6126 64.7681 37.0890 177.8581 418 H 4.1992 8.5844 119.0887 59.7738 29.5654 177.1474 419 E 4.1022 9.1672 120.3514 59.2171 29.2278 179.2526 420 A 4.3601 8.5855 121.6329 55.0129 18.4400 179.7932 421 G 3.5877 8.0528 104.2054 48.7893 0.0000 174.9167 422 H 4.0519 8.2604 118.1407 58.4921 28.5936 176.9873 423 A 3.7854 7.9235 121.8713 55.3707 18.2465 179.1477 424 L 3.6575 8.1439 118.8002 58.7250 42.0579 179.1096 425 M 4.0799 8.0980 118.2727 58.3178 31.7092 178.8037 426 G 3.6759 7.9607 104.5630 48.1366 0.0000 175.5211 427 L 3.9609 8.1671 122.0589 56.5517 41.2698 179.2562 428 V 3.9766 7.3948 117.0525 63.0748 31.9798 174.9707 429 S 3.9613 8.2377 116.6018 59.0346 62.0413 174.9468 430 D 4.4366 8.9934 130.1179 56.7107 39.5185 173.8867 431 D 4.6221 7.5205 113.6013 55.6201 42.2762 180.5188 432 D 4.3553 7.4518 128.9393 53.8947 39.4141 175.9761 433 D 4.4673 8.7315 127.9289 53.2506 40.3973 175.0439 434 K 4.3801 8.0664 127.6013 54.1035 34.7870 172.7047 435 V 4.3925 8.1420 119.7424 59.9090 34.3861 173.9300 436 H 4.4055 8.4433 117.1871 57.9261 30.5063 172.7605 437 K 4.6757 8.1474 123.6118 53.6843 32.1762 171.5830 438 I 4.4989 8.3179 115.8159 61.5044 41.7186 173.3641 439 S 5.1140 8.5624 122.7799 57.2066 65.9054 174.0074 440 I 3.6291 8.4146 120.3452 63.2467 36.8029 177.2574 441 I 4.0138 7.6051 123.5706 62.6097 38.3100 178.9623 442 P 4.6972 0.0000 0.0000 63.1074 30.9818 175.8515 *459 H 4.5385 8.3991 114.6922 56.1474 29.6000 172.0413 460 I 3.9700 7.2673 120.0900 61.4425 39.8533 173.7560 461 Y 4.6549 8.1059 123.6247 56.3507 39.9463 175.7980 462 D 4.7164 8.8619 123.8070 51.5590 42.8550 177.4948 463 K 3.6047 8.3186 119.3554 59.4871 31.8801 178.0235 464 K 3.9316 8.0044 119.1180 59.7486 32.0889 177.9181 465 D 4.4402 9.0401 119.2276 57.7499 40.8276 179.1788 466 L 3.9891 7.9077 119.1260 57.7401 41.5935 178.9419 467 Y 4.6026 8.2233 117.1319 61.6795 37.8395 178.8307 468 N 4.4612 8.5429 117.0587 56.1330 38.5539 177.6938 469 K 3.9580 8.2378 120.1394 59.4584 32.1325 179.3524 470 I 3.7421 8.0221 120.1327 64.1775 36.8065 178.0415 471 L 3.9614 7.6968 119.9858 58.2829 42.3511 178.8293 472 V 3.7601 7.9933 118.1182 66.2215 31.2477 177.9711 473 L 4.1029 7.8799 117.2480 57.4279 41.7776 178.7250 474 L 4.5583 8.2449 117.4688 55.4997 41.8619 178.9060 475 G 3.8028 7.9387 106.7097 47.9849 0.0000 175.3523 476 G 3.3383 7.6947 107.2090 47.9560 0.0000 175.2539 477 R 3.9925 7.9144 120.2510 58.6262 30.2580 178.4789 478 A 3.9701 8.7422 120.6676 55.2966 18.3900 179.5505 479 A 4.1095 8.3607 119.4459 55.2125 18.4286 179.5076 480 E 4.2180 8.5063 117.3441 59.9586 29.6694 179.3490 481 E 4.3236 8.5899 119.1182 58.9469 29.4649 178.9891 482 V 3.4932 7.6391 117.7886 66.1331 31.7512 177.8360 483 F 3.8716 8.2331 115.9361 59.0972 38.7871 176.2200 484 F 4.8664 7.7596 113.6803 56.1258 40.5725 175.9873 485 G 4.0247 8.2319 111.5217 44.3363 0.0000 174.8674 486 K 4.2084 8.5553 116.9606 58.6301 32.0143 178.0795 487 D 4.6086 8.1375 117.2868 55.2074 41.3503 177.1627 488 G 3.9630 7.8686 106.1151 45.0717 0.0000 174.1884 489 I 3.9022 7.7459 120.9123 62.2185 37.5393 175.4026 490 T 4.6863 9.0316 121.2440 61.7599 71.1701 175.0865 491 T 4.0143 8.3346 119.3638 65.9798 68.5994 176.6368 492 G 3.6585 8.0779 108.9226 47.0452 0.0000 173.7751 493 A 4.8674 7.7645 122.2634 52.0527 19.6611 177.9487 494 E 3.9304 8.2412 120.7666 60.6659 29.5173 179.0907 495 N 4.3621 8.0886 115.7141 56.4075 38.6177 176.9733 496 D 4.3872 8.1299 119.8277 57.4545 40.9215 178.7846 497 L 3.9839 8.0828 119.4958 57.5925 41.5105 179.3705 498 Q 3.9081 7.8863 119.6092 59.2097 29.0709 178.3070 499 R 3.9002 8.6439 119.2241 59.2830 30.0537 178.9496 500 A 4.0330 8.2640 120.6337 55.5472 18.3549 179.9009 501 T 3.8541 8.1109 114.3109 66.6915 68.5269 176.5549 502 D 4.3955 8.3838 121.2659 57.4678 41.0028 178.7944 503 L 3.9918 8.0013 120.2615 58.2887 42.0579 178.9507 504 A 4.1221 8.3859 120.8671 55.2200 18.2764 178.9905 505 Y 3.9909 8.2044 118.3923 60.6612 38.7243 178.2459 506 R 3.3057 7.9086 119.2749 58.9898 29.9909 178.5135 507 M 4.2245 7.6318 118.3192 58.5216 31.7494 178.7639 508 V 3.7711 7.1184 116.6196 64.4400 32.2753 177.2126 509 S 4.3895 7.6379 111.9607 58.3734 63.6147 175.3813 510 M 4.1338 7.6297 121.2231 55.6804 33.6455 176.6652 511 W 4.9197 7.6121 115.9630 55.9189 30.0954 175.3138 512 G 4.0667 8.1413 104.5236 47.0859 0.0000 174.1934 513 M 4.3866 8.4615 116.0600 54.6397 32.4840 176.0777 514 S 4.7516 7.6511 114.8826 56.2641 64.2414 174.1968 515 D 4.3242 9.1603 130.5594 58.2446 40.9370 178.6067 516 K 4.0960 8.2220 118.5772 57.7792 31.8500 180.0479 517 V 3.5957 7.8698 118.6550 64.1893 31.4955 177.1656 518 G 3.9998 8.5421 104.2231 44.2360 0.0000 171.5959 519 P 4.6164 0.0000 0.0000 62.7249 30.3817 176.2399 520 I 4.4629 7.4050 117.3629 60.2929 40.0745 175.3983 521 A 4.8710 8.1503 125.3861 50.2199 21.2012 176.5965 522 I 3.9710 8.5804 123.4115 60.6037 37.3920 175.7955 523 R 3.8121 8.2057 125.5531 58.9134 31.7098 179.6537 524 R 3.8452 8.3442 120.6966 58.0855 28.5805 180.7912 *535 T 4.1015 8.7009 107.6157 61.6822 68.1467 171.8603 536 A 4.1233 8.2212 129.4856 52.6094 19.3277 178.2995 537 V 4.3106 8.0355 119.0067 60.7071 35.0535 177.0695 538 D 4.4825 8.6629 124.5188 53.6715 37.0258 170.4202 539 T 4.6693 7.5301 115.7978 61.8455 71.0381 176.1990 540 S 4.3014 8.4437 120.9103 57.8624 64.9022 173.7514 541 P 4.2801 0.0000 0.0000 66.2868 30.9365 178.4225 542 D 4.3360 8.0916 118.1298 57.1969 40.7714 178.3305 543 L 3.9923 7.7570 120.7432 58.0203 42.0616 179.1079 544 L 4.0014 7.7254 118.5929 57.7422 41.6195 179.1518 545 R 3.9111 8.2754 119.0037 59.6760 29.9303 178.3293 546 E 4.1518 8.2685 118.0714 59.4457 29.4681 179.4833 547 I 3.6803 7.7781 119.7141 64.5981 37.1819 178.1262 548 D 4.4765 8.6808 119.9989 57.4558 40.6092 178.7869 549 E 3.9686 8.3084 118.9009 59.7141 29.4786 179.4248 550 E 4.1099 8.1903 118.4691 59.0434 29.5063 179.4946 551 V 3.5921 8.4292 118.7551 65.8910 31.5912 177.6649 552 K 3.8237 8.1946 119.4643 59.8560 31.9460 178.0329 553 R 3.8767 8.4126 118.8906 59.7782 29.9773 178.0389 554 I 3.7132 8.0863 119.2230 64.8276 37.1883 178.5344 555 I 3.8191 7.9410 120.1047 64.5736 37.0742 178.2373 556 T 3.9700 8.2191 116.9982 66.9668 68.2801 176.3064 557 E 3.9311 8.1718 119.9575 59.6688 29.5454 179.4155 558 Q 3.9490 7.9446 117.9230 59.1752 28.7808 178.3713 559 Y 4.1150 8.5287 120.9541 60.7133 38.8173 177.9171 560 E 3.9168 8.3695 119.6086 58.7023 29.5130 179.2449 561 K 3.8548 8.0534 119.8719 59.2570 32.2315 178.5897 562 A 3.9405 8.0229 121.1667 55.2076 18.2811 179.4299 563 K 3.6455 7.5966 116.4656 59.5951 32.1209 178.9410 564 A 3.9283 7.7432 120.6662 55.5974 18.0278 179.7114 565 I 3.7847 7.9570 116.7339 64.5154 37.6352 178.5777 566 V 3.8582 8.1778 119.2758 66.5410 31.3427 176.9727 567 E 3.7232 8.6938 120.9131 60.6340 29.1079 179.1149 568 E 3.7851 8.5351 119.3162 60.4965 29.9602 179.7234 569 Y 4.9096 7.6676 114.6954 57.5114 39.0551 177.6816 570 K 3.9040 8.4936 125.6630 60.5571 32.2441 178.4785 571 E 3.8754 8.1038 117.9047 60.9028 29.7316 179.2696 572 P 3.1060 0.0000 0.0000 64.4496 30.9865 178.2388 573 L 3.9638 7.6502 120.8105 57.9371 42.0685 178.6911 574 K 3.9274 8.5036 118.7426 59.5773 31.9359 178.9102 575 A 3.9972 7.6910 120.3841 55.2689 18.2256 179.8597 576 V 3.4116 7.3829 116.1666 65.9695 31.5485 178.2820 577 V 3.5806 8.0915 120.7046 66.5059 31.3219 178.4959 578 K 3.9490 8.1665 125.7551 60.6652 31.5195 181.4877 579 K 4.2130 7.8312 124.8916 59.2454 31.5331 180.7053 580 L 4.1399 8.0446 121.5581 58.3355 41.8704 179.3130 581 L 4.1334 8.1784 117.5853 57.5491 41.5039 178.9363 582 E 4.0860 7.8791 118.9694 58.9315 30.0391 178.2637 583 K 4.1578 8.8175 117.0122 56.2008 32.5245 178.7709 584 E 4.0427 9.2254 122.5148 56.9328 30.5998 173.9241 585 T 5.1148 8.1701 114.5214 62.1541 72.5595 173.6580 586 I 4.6159 9.3019 127.4840 59.9100 40.2971 175.4636 587 T 4.5545 8.2980 121.0211 62.8098 70.2259 176.3134 588 C 4.1354 8.9828 122.7281 60.1632 41.7004 175.8808 589 E 4.0113 8.2838 121.9173 60.0432 29.0833 179.5501 590 E 4.0119 8.2374 117.8332 61.0654 29.6914 180.1912 591 F 4.1796 8.0523 122.0808 61.3875 39.3215 177.5743 592 V 3.7315 7.9888 117.2915 66.0242 31.3873 177.3880 593 E 3.9849 8.8038 118.8189 59.8714 29.1867 179.5949 594 V 3.7010 7.9877 116.6854 66.3666 31.8228 177.8036 595 F 4.2019 8.4440 119.7623 60.9045 38.7755 178.5737 596 K 4.3109 8.8240 124.0308 59.6513 31.3453 181.4589 597 L 4.3959 8.0605 117.7624 56.4657 41.5678 177.7590 598 Y 4.4822 7.8692 115.3966 56.9157 38.9291 176.4000 599 G 3.9209 8.3404 110.7629 46.1032 0.0000 173.8999 600 I 4.3338 7.8679 119.8239 58.8479 36.6457 179.9719 601 E 4.6627 8.7680 122.2018 53.2288 30.2912 172.3253 602 L 4.3924 8.3519 127.2809 52.8689 42.9698 177.9831 603 K 3.9170 7.8126 123.1301 55.3003 32.1119 177.6844 604 D 4.6706 8.4331 124.0327 53.6478 39.3468 176.1557 605 K 4.6203 7.5887 121.8830 52.4527 33.6411 175.6657 606 C 4.7458 8.3985 122.1183 58.5477 42.9330 175.4075 607 K 4.0774 8.2416 123.3020 55.1402 31.0972 178.1784 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 407 I 8.01 4.18 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.21 0.91 0.00 0.00 408 S 8.35 4.20 0.00 4.07 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 0.00 409 P 0.00 4.29 0.00 2.29 2.39 0.00 3.71 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 2.08 2.06 0.00 410 K 8.05 3.92 0.00 1.78 1.87 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.08 7.81 411 E 8.21 4.11 0.00 2.06 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 2.27 2.30 0.00 412 K 7.88 3.98 0.00 2.03 1.85 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.53 1.49 7.81 413 E 8.32 3.95 0.00 2.10 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 0.00 2.67 2.49 0.00 414 K 7.79 3.94 0.00 1.88 1.77 0.00 1.33 0.00 0.00 0.61 0.00 0.00 2.46 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.46 1.47 7.81 415 I 8.02 3.67 2.02 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 1.43 1.01 0.99 0.00 0.00 416 A 8.20 4.07 1.40 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 0.00 417 I 7.94 3.35 2.04 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.79 0.49 0.00 0.00 418 H 8.58 4.20 0.00 3.37 3.55 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 0.00 419 E 9.17 4.10 0.00 2.05 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 2.55 2.72 0.00 420 A 8.59 4.36 1.46 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 0.00 0.00 421 G 8.05 3.59 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 0.00 0.00 0.00 422 H 8.26 4.05 0.00 3.32 3.27 0.00 5.66 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 423 A 7.92 3.79 0.86 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 0.00 424 L 8.14 3.66 0.00 1.98 1.81 1.07 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 425 M 8.10 4.08 0.00 2.07 2.22 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.91 0.00 426 G 7.96 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 0.00 0.00 0.00 427 L 8.17 3.96 0.00 1.30 1.45 0.31 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 428 V 7.39 3.98 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 0.79 0.00 0.00 0.65 0.00 0.00 429 S 8.24 3.96 0.00 4.07 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 0.00 430 D 8.99 4.44 0.00 2.73 2.62 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 0.00 431 D 7.52 4.62 0.00 2.60 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 0.00 432 D 7.45 4.36 0.00 2.65 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 0.00 433 D 8.73 4.47 0.00 2.74 2.46 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 0.00 434 K 8.07 4.38 0.00 1.75 1.57 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.11 0.79 7.81 435 V 8.14 4.39 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 0.91 0.00 0.00 0.93 0.00 0.00 436 H 8.44 4.41 0.00 3.03 2.97 0.00 5.61 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 0.00 437 K 8.15 4.68 0.00 1.85 1.87 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.68 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.16 0.77 7.81 438 I 8.32 4.50 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 1.38 0.98 1.11 0.00 0.00 439 S 8.56 5.11 0.00 4.01 3.79 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 0.00 440 I 8.41 3.63 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.56 0.92 0.00 0.00 441 I 7.61 4.01 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.47 0.91 0.00 0.00 442 P 0.00 4.70 0.00 2.18 1.75 0.00 3.81 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 *459 H 8.40 4.54 0.00 2.98 2.74 0.00 5.73 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 460 I 7.27 3.97 1.68 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 1.27 0.12 0.75 0.00 0.00 461 Y 8.11 4.65 0.00 2.75 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 0.00 462 D 8.86 4.72 0.00 2.86 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 0.00 463 K 8.32 3.60 0.00 1.70 1.67 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.61 1.08 7.81 464 K 8.00 3.93 0.00 1.88 1.97 0.00 1.83 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.57 1.64 7.81 465 D 9.04 4.44 0.00 2.93 2.86 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 0.00 466 L 7.91 3.99 0.00 1.70 1.79 0.85 0.79 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 0.00 467 Y 8.22 4.60 0.00 3.26 2.94 0.00 0.00 0.00 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0.00 0.00 0.00 484 F 7.76 4.87 0.00 3.19 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 0.00 485 G 8.23 4.02 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 0.00 0.00 0.00 486 K 8.56 4.21 0.00 1.80 1.93 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.57 1.57 7.81 487 D 8.14 4.61 0.00 2.70 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 0.00 488 G 7.87 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 0.00 0.00 0.00 489 I 7.75 3.90 2.05 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 1.52 0.68 0.94 0.00 0.00 490 T 9.03 4.69 4.58 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 1.20 0.00 0.00 491 T 8.33 4.01 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 1.20 0.00 0.00 492 G 8.08 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 0.00 493 A 7.76 4.87 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 0.00 494 E 8.24 3.93 0.00 2.20 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 2.30 2.36 0.00 495 N 8.09 4.36 0.00 2.78 2.85 0.00 0.00 7.05 8.08 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 0.00 496 D 8.13 4.39 0.00 2.87 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 0.00 497 L 8.08 3.98 0.00 1.69 1.68 0.87 0.59 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 0.00 498 Q 7.89 3.91 0.00 2.02 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 499 R 8.64 3.90 0.00 1.96 1.98 0.00 3.18 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 500 A 8.26 4.03 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 0.00 501 T 8.11 3.85 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 1.20 0.00 0.00 502 D 8.38 4.40 0.00 3.00 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 0.00 503 L 8.00 3.99 0.00 2.08 1.82 0.95 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 504 A 8.39 4.12 1.44 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 0.00 0.00 505 Y 8.20 3.99 0.00 3.14 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 7.91 3.31 0.00 1.13 0.66 0.00 3.17 0.00 0.00 2.95 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.77 0.00 507 M 7.63 4.22 0.00 2.16 2.36 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.06 2.85 0.00 508 V 7.12 3.77 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 0.78 0.00 0.00 0.99 0.00 0.00 509 S 7.64 4.39 0.00 3.65 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 0.00 510 M 7.63 4.13 0.00 1.34 1.24 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 2.18 2.26 0.00 511 W 7.61 4.92 0.00 3.39 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 0.00 512 G 8.14 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 0.00 0.00 0.00 513 M 8.46 4.39 0.00 1.95 2.26 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.99 2.49 0.00 514 S 7.65 4.75 0.00 3.84 3.69 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 0.00 515 D 9.16 4.32 0.00 2.71 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 0.00 516 K 8.22 4.10 0.00 1.77 1.73 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 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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 1.21 0.00 0.00 536 A 8.22 4.12 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 0.00 537 V 8.04 4.31 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 0.79 0.00 0.00 0.93 0.00 0.00 538 D 8.66 4.48 0.00 2.80 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 0.00 539 T 7.53 4.67 4.25 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 1.22 0.00 0.00 540 S 8.44 4.30 0.00 4.04 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 0.00 541 P 0.00 4.28 0.00 2.28 2.36 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 542 D 8.09 4.34 0.00 2.71 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 0.00 543 L 7.76 3.99 0.00 1.66 1.66 0.91 0.86 0.00 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0.00 0.00 0.00 1.07 0.00 0.00 1.11 0.00 0.00 552 K 8.19 3.82 0.00 1.93 2.00 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.48 7.81 553 R 8.41 3.88 0.00 2.02 2.12 0.00 3.22 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 554 I 8.09 3.71 2.10 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.07 1.16 0.00 0.00 555 I 7.94 3.82 2.02 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 1.57 0.74 0.91 0.00 0.00 556 T 8.22 3.97 4.51 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 1.25 0.00 0.00 557 E 8.17 3.93 0.00 2.23 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 2.29 2.33 0.00 558 Q 7.94 3.95 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 559 Y 8.53 4.12 0.00 3.08 3.18 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 0.00 560 E 8.37 3.92 0.00 2.25 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 2.33 2.45 0.00 561 K 8.05 3.85 0.00 1.79 1.92 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.43 7.81 562 A 8.02 3.94 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 0.00 563 K 7.60 3.65 0.00 1.71 1.73 0.00 0.81 0.00 0.00 1.21 0.00 0.00 2.88 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.26 0.93 7.81 564 A 7.74 3.93 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 0.00 565 I 7.96 3.78 2.05 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 1.53 0.79 1.05 0.00 0.00 566 V 8.18 3.86 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 1.20 0.00 0.00 1.02 0.00 0.00 567 E 8.69 3.72 0.00 2.20 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 2.25 2.32 0.00 568 E 8.54 3.79 0.00 2.06 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 0.00 2.27 2.26 0.00 569 Y 7.67 4.91 0.00 3.28 3.18 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 0.00 570 K 8.49 3.90 0.00 1.85 1.67 0.00 1.29 0.00 0.00 1.40 0.00 0.00 2.47 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.07 0.85 7.81 571 E 8.10 3.88 0.00 2.01 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 2.32 1.96 0.00 572 P 0.00 3.11 0.00 0.49 0.59 0.00 3.43 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.51 0.00 573 L 7.65 3.96 0.00 2.26 1.98 1.19 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 574 K 8.50 3.93 0.00 2.02 1.91 0.00 1.82 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.88 1.73 7.81 575 A 7.69 4.00 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 0.00 576 V 7.38 3.41 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 0.74 0.00 0.00 0.56 0.00 0.00 577 V 8.09 3.58 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 0.78 0.00 0.00 0.79 0.00 0.00 578 K 8.17 3.95 0.00 1.82 1.82 0.00 1.87 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.38 1.34 7.81 579 K 7.83 4.21 0.00 1.72 1.85 0.00 1.79 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.37 1.32 7.81 580 L 8.04 4.14 0.00 1.98 1.76 0.98 0.73 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 0.00 581 L 8.18 4.13 0.00 1.76 1.73 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 582 E 7.88 4.09 0.00 2.10 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 0.00 2.33 2.35 0.00 583 K 8.82 4.16 0.00 1.91 1.84 0.00 1.83 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.45 7.81 584 E 9.23 4.04 0.00 2.15 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 2.20 2.28 0.00 585 T 8.17 5.11 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 1.27 0.00 0.00 586 I 9.30 4.62 1.98 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.12 1.02 0.00 0.00 587 T 8.30 4.55 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 0.00 588 C 8.98 4.14 0.00 2.96 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 0.00 589 E 8.28 4.01 0.00 2.12 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 2.42 2.46 0.00 590 E 8.24 4.01 0.00 1.97 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 2.32 1.94 0.00 591 F 8.05 4.18 0.00 3.13 3.19 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 0.00 592 V 7.99 3.73 2.28 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 1.04 0.00 0.00 0.99 0.00 0.00 593 E 8.80 3.98 0.00 2.20 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 2.38 2.53 0.00 594 V 7.99 3.70 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 0.82 0.00 0.00 1.03 0.00 0.00 595 F 8.44 4.20 0.00 3.28 3.33 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 0.00 596 K 8.82 4.31 0.00 1.72 1.82 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.35 7.81 597 L 8.06 4.40 0.00 1.78 1.61 0.91 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 598 Y 7.87 4.48 0.00 2.95 2.89 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 0.00 0.00 0.00 0.00 599 G 8.34 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 0.00 600 I 7.87 4.33 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.79 0.91 0.00 0.00 601 E 8.77 4.66 0.00 1.96 1.78 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 2.14 1.87 0.00 602 L 8.35 4.39 0.00 1.55 1.61 0.54 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 603 K 7.81 3.92 0.00 1.73 1.63 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.28 7.81 604 D 8.43 4.67 0.00 2.60 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 0.00 605 K 7.59 4.62 0.00 1.75 1.53 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.25 1.02 7.81 606 C 8.40 4.75 0.00 2.89 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 0.00 607 K 8.24 4.08 0.00 1.77 1.63 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.86 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.37 1.05 7.81 * Residues marked with a * may have inaccurate shift predictions.