NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 401 M 4.6948 8.1633 120.6176 55.4693 34.1980 173.7468 402 I 4.8383 8.5202 125.9432 58.6145 40.4489 172.6008 403 L 5.0511 9.3730 129.5341 53.5129 44.7515 174.6833 404 V 5.0172 9.3712 126.6863 61.5480 33.8625 174.2189 405 T 5.3522 8.8968 122.0507 59.1125 71.4399 172.4659 406 G 4.2966 8.0411 111.4708 46.4183 0.0000 172.6364 407 G 3.9947 7.8932 108.9367 44.1689 0.0000 172.8690 408 A 4.0910 8.4563 122.4080 53.1325 18.9700 177.9950 409 R 3.8496 8.4990 122.1003 57.4302 27.7132 177.0161 410 S 4.4381 8.0667 110.5715 58.0826 64.2303 175.3963 411 G 3.9512 8.2220 109.9222 46.2982 0.0000 175.3639 412 K 3.9629 8.2293 121.8029 60.0196 32.0358 179.0159 413 S 4.2375 8.0312 115.7182 61.3772 62.9262 176.1586 414 R 3.9146 8.1311 120.8930 59.9160 29.5200 177.7768 415 H 4.1066 8.0673 117.5305 59.0423 29.7318 176.9177 416 A 3.8717 8.4917 122.5194 55.4367 18.3303 179.2120 417 E 4.2574 9.9098 116.7255 59.2767 29.3298 179.3072 418 A 3.9918 7.6826 120.4086 54.9041 18.4310 179.0615 419 L 3.9231 7.6851 117.1907 58.8921 41.8072 179.0650 420 I 3.7884 7.4661 119.2591 58.1440 37.2149 179.5142 421 G 4.0767 9.0374 110.1831 45.0786 0.0000 175.7455 422 D 4.8016 8.5976 120.9504 52.3031 37.8924 177.8818 423 A 4.6765 6.8125 123.8934 50.7718 19.5642 176.2306 424 P 4.1934 0.0000 0.0000 62.3181 34.0582 176.2891 425 Q 5.1945 7.9341 120.3696 53.7775 30.4715 175.3423 426 V 4.6037 8.3373 122.6403 59.7241 35.5394 173.8288 427 L 5.1737 8.4229 124.5482 53.5665 44.7121 174.2198 428 Y 5.0437 10.0029 128.7969 56.2919 40.7054 174.3545 429 I 4.4642 8.4650 129.2179 59.8654 39.0362 174.6592 430 A 5.0364 8.2816 130.5405 50.1057 20.3571 177.3202 431 T 4.3944 8.8571 114.1078 63.6497 69.4711 174.8715 432 S 4.7193 7.8308 116.2910 55.5425 66.5964 174.5287 433 Q 3.9846 8.9708 122.8158 59.8270 28.6333 178.6691 434 I 3.6609 7.8504 120.1814 64.6225 36.5829 177.6782 435 L 4.1616 7.7672 118.6838 57.2135 41.7938 178.4566 436 D 4.7382 8.3203 117.8356 57.0480 41.1573 178.0956 437 D 4.4238 8.3662 119.8105 57.2815 40.8118 178.3926 438 E 4.0728 7.7735 118.7316 59.6230 29.4194 179.0229 439 M 3.8663 7.7853 116.8666 58.4268 32.1944 177.7919 440 A 4.1624 7.6243 118.3486 53.5853 19.1167 178.4163 441 A 4.2509 7.4482 119.1923 54.3334 19.2086 179.8095 442 R 3.8086 7.5088 114.0467 58.4378 29.5023 177.9621 443 I 4.1935 7.5354 121.3223 62.0690 36.8945 176.8152 444 Q 4.5111 7.8819 119.7585 55.3401 30.6371 179.9854 445 H 4.7428 7.3595 110.8728 58.0078 29.9696 176.0166 446 H 4.3002 9.0300 114.1881 57.4060 28.2867 176.3651 *448 D 4.5031 8.1455 119.5402 54.2388 42.6401 176.7775 449 G 3.6564 10.4100 108.5795 48.8552 0.0000 174.3423 450 R 4.5585 7.4116 119.1508 53.3379 31.4377 176.3018 451 P 4.7722 0.0000 0.0000 63.2723 31.3450 175.3982 452 A 4.6524 7.6023 121.1163 52.0879 19.7125 178.6217 453 H 4.6938 9.7073 125.5311 54.9507 28.8574 173.3285 454 W 4.8760 8.3369 121.4643 55.7244 30.0359 175.6333 455 R 4.9022 9.7518 123.3347 54.6406 33.4385 174.7436 456 T 5.2754 8.6221 111.7743 59.6436 72.2754 173.3552 457 A 4.3947 8.0680 119.9683 51.1467 22.6776 174.9734 458 E 4.7691 8.9676 124.8812 56.1916 30.2042 175.2353 459 C 4.7502 8.5706 124.4942 57.8711 35.2810 173.9051 460 W 5.2709 7.5177 122.7977 54.7855 27.8741 175.7859 461 R 4.1197 7.9070 111.2789 58.0159 33.8316 174.8169 462 H 3.9741 8.1374 120.6457 56.3009 26.5650 177.0419 463 L 3.9499 8.1497 121.1744 58.1442 41.7618 179.5307 464 D 4.3793 8.2305 117.3911 56.9406 38.7820 178.7724 465 T 4.0038 7.9045 116.5867 65.8487 68.4507 175.7979 466 L 4.3911 7.7764 119.3699 56.3236 43.8953 178.3477 467 I 4.0311 7.4407 118.0458 61.4257 34.6675 174.8410 468 T 4.2728 7.3723 113.2175 60.9241 70.4502 175.5470 469 A 4.6843 8.0969 121.2706 51.8414 19.7358 177.8035 470 D 4.7589 7.6667 113.5826 54.4380 40.8229 176.0572 471 L 4.6272 7.1432 118.4876 52.5911 43.6281 176.4480 472 A 4.1800 8.3075 125.0053 51.6428 18.8430 176.8455 473 P 4.7089 0.0000 0.0000 63.2467 31.2512 176.9598 474 D 4.6751 7.7779 118.0814 55.0321 42.0403 176.4059 475 D 4.9387 8.1149 119.7108 53.6767 42.5245 175.4574 476 A 5.2371 8.1185 121.9745 50.3469 23.0907 175.0310 477 I 4.9050 9.9926 119.1043 59.3038 41.4076 174.5896 478 L 4.9020 9.0498 128.6127 53.3845 44.4533 174.4420 479 L 5.0688 9.0361 129.5988 53.2689 44.6084 174.8345 480 E 4.9493 8.7163 125.9615 55.2594 33.3092 173.1536 481 C 5.2348 9.2606 126.9028 57.1648 35.0260 174.6706 482 I 3.8394 8.6458 126.2826 64.9122 36.7401 178.9734 483 T 4.0602 7.9649 109.9743 65.3397 68.6745 176.5080 484 T 3.8963 7.9431 117.8696 65.9215 68.4545 176.3458 485 M 3.9764 7.6096 119.3762 58.6371 32.3453 177.9798 486 V 3.6347 7.7968 118.2854 66.6635 31.6818 177.7837 487 T 3.9117 8.1840 115.0798 66.8912 68.4645 176.1030 488 N 4.0078 7.9900 117.8732 56.3304 38.4220 177.1898 489 L 4.2259 8.2094 120.5331 57.9982 41.7589 179.5211 490 L 3.8303 8.4226 118.9223 57.9759 41.4062 179.5002 491 F 4.1603 7.7294 115.6230 60.7598 39.3865 177.4130 492 A 4.2528 8.0460 119.7001 54.9752 18.0910 179.7096 493 L 3.9269 8.1658 117.2139 57.8232 41.6264 179.8084 494 G 2.0000 7.8050 105.5661 46.5639 0.0000 174.7276 495 G 3.9646 7.5075 108.6796 45.7099 0.0000 173.6579 496 E 4.5887 8.7533 119.3484 56.8269 30.2606 175.9109 497 N 5.0707 7.5432 115.9186 52.2250 41.0650 174.1914 498 D 4.3970 8.4396 119.5148 53.2636 41.7141 175.3718 499 P 2.0000 0.0000 0.0000 64.3097 31.4271 177.0869 500 E 4.0061 7.8239 118.2406 57.9104 30.1880 176.8184 501 Q 4.7366 8.5756 117.1693 54.6016 28.0109 174.6175 502 W 4.9065 7.5651 118.1725 55.6727 33.1050 176.3753 503 D 4.6813 7.9368 121.3919 52.9033 39.1216 176.4018 504 Y 4.2485 7.9542 120.9572 60.4057 38.3527 177.6827 505 A 4.0772 8.0827 121.4107 54.8360 18.8031 179.2846 506 A 4.0824 7.7751 119.0507 55.2759 18.5927 179.7590 507 M 3.9239 8.3131 117.6172 58.4925 32.0229 178.2729 508 E 3.9741 7.9707 119.5664 59.6139 29.6669 179.2999 509 R 3.8868 7.5723 116.5118 59.1716 30.1529 178.8306 510 A 4.1357 7.8568 120.1631 55.2705 18.3679 179.6901 511 I 3.6774 7.8327 118.2404 64.6079 37.1489 178.1333 512 D 4.3990 8.0718 119.6893 57.8812 40.6194 178.2988 513 D 4.3589 8.0087 118.8701 57.7733 40.8880 178.4538 514 E 3.8719 8.3565 119.2468 59.6681 29.5809 179.3850 515 I 3.7198 8.1720 120.0594 64.4746 37.1443 178.2036 516 Q 4.1424 8.6863 120.6679 58.9783 28.7024 178.4494 517 I 3.6485 7.9586 121.1719 64.1367 37.1870 177.8559 518 L 4.0874 7.8634 121.0433 58.5378 41.7218 179.0491 519 I 3.7091 8.0627 118.1916 64.2419 37.2765 178.1891 520 A 4.0815 8.0907 121.4699 55.2699 18.2769 179.5533 521 A 3.9857 8.7724 120.2013 55.5648 18.1120 179.6434 522 C 4.2523 7.8983 114.5836 62.8622 28.2019 175.8546 523 Q 4.1782 7.9477 119.1418 58.1652 28.7661 177.6122 524 R 4.3605 7.5940 115.6984 55.2480 30.4412 175.0546 525 C 4.7246 7.6262 119.4983 56.3869 33.1068 171.6985 526 P 4.3470 0.0000 0.0000 64.8729 31.6557 176.1438 527 A 4.4692 7.6211 119.9994 51.1191 19.5072 176.9648 528 K 4.0939 8.7997 121.7798 56.3505 33.5960 175.9463 529 V 4.7523 8.4726 127.0438 61.1306 34.5098 173.8722 530 V 4.9926 9.1628 128.5296 61.0783 34.1685 174.0532 531 L 5.2412 8.9866 127.4897 52.9751 44.8396 175.3390 532 V 4.7703 8.7692 123.9851 61.7359 33.6850 174.5370 533 T 4.9826 9.2962 121.4622 60.7261 71.6869 171.5255 534 N 5.5591 8.6379 119.0552 51.5125 42.3123 174.1860 535 E 4.4102 9.2348 122.3611 55.2947 30.3616 176.6889 536 V 4.4695 8.4829 116.3567 60.9829 33.1786 176.0267 537 G 4.0820 8.2209 106.6607 45.7743 0.0000 173.9638 538 M 4.5239 8.2060 116.8255 54.6622 32.4695 176.0282 539 G 4.2755 7.6559 109.5692 44.0876 0.0000 173.5667 540 I 4.1318 7.9320 119.4248 59.7641 38.3918 175.8950 541 V 3.6266 8.1208 122.2099 62.2612 31.3240 174.2238 542 P 4.3360 0.0000 0.0000 63.1505 31.9259 176.1984 543 E 4.0779 8.7200 121.8266 58.8179 29.7235 176.9358 544 N 4.3851 8.1080 118.8438 54.6225 39.7888 176.1623 545 R 3.9609 8.5895 124.7796 61.2740 29.7752 179.3356 546 L 4.2956 8.2032 122.1859 57.3117 42.0656 178.4444 547 A 4.0922 8.8527 120.8177 55.5709 18.1170 179.4977 548 R 3.7996 7.6187 115.8888 59.8598 29.9975 178.5490 549 H 3.9906 7.7388 115.9512 58.7292 28.6860 177.1839 550 F 4.1559 8.8162 122.9637 61.5971 39.1648 177.1195 551 R 3.5108 8.0097 117.7861 59.5225 29.7486 178.0801 552 D 4.1989 7.5918 118.5900 57.3619 40.9099 178.5534 553 I 3.6082 8.0026 120.1912 64.5825 37.0842 178.2796 554 A 3.9166 8.1344 121.7879 55.1469 17.8119 179.9881 555 G 3.4666 7.5159 103.1204 47.8782 0.0000 175.9880 556 R 4.0762 8.2596 120.7002 58.8648 30.1869 179.2334 557 V 3.6181 7.8885 118.2332 66.0925 31.5311 177.9162 558 N 4.4327 7.9722 116.2739 56.1432 38.0558 177.4855 559 Q 4.0056 7.6376 118.7439 58.8552 29.1510 178.4255 560 R 4.0275 7.9569 118.5810 59.2796 30.1984 178.4144 561 L 3.9185 7.8350 117.8383 58.2597 41.5803 179.3785 562 A 3.9813 8.1713 119.8824 55.6364 17.9981 179.6202 563 A 3.9278 7.7401 117.2109 54.9514 18.6039 179.0454 564 A 4.1790 7.7834 116.4787 52.1875 19.3290 177.6394 565 A 4.3487 6.9585 121.0174 51.9548 19.2832 177.5580 566 D 4.7165 9.3531 123.2030 56.5406 41.7215 176.9593 567 E 4.7161 8.1044 114.7971 54.3479 33.6394 174.9668 568 V 4.9066 7.8331 120.4553 61.0951 35.1249 173.6964 569 W 5.0809 9.3775 128.1666 54.7718 31.9827 174.3800 570 L 5.1056 9.2337 127.5941 53.4464 43.6415 174.9471 571 V 4.8306 8.6483 127.7432 61.3463 32.9963 175.6252 572 V 4.3245 8.3604 126.9796 60.9453 33.4761 175.7193 573 S 3.8092 9.7872 121.2021 59.5338 60.1693 173.4287 574 G 3.8503 8.6069 107.2447 45.5747 0.0000 174.1169 575 I 4.2463 7.6406 121.9792 59.5603 38.4362 175.4055 576 G 4.0248 8.6059 115.3549 45.8951 0.0000 172.5541 577 V 4.5336 9.0521 123.8538 60.5712 34.5173 174.4932 578 K 3.6719 8.6170 130.6188 56.1045 31.5819 176.1263 579 I 4.0667 8.5282 122.6682 61.7524 39.0526 176.0161 580 K 4.0160 7.3754 127.4491 56.3742 32.4046 175.3266 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 401 M 8.16 4.69 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.68 0.00 402 I 8.52 4.84 2.02 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.90 1.37 0.00 0.00 403 L 9.37 5.05 0.00 1.76 1.57 0.97 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 404 V 9.37 5.02 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 0.95 0.00 0.00 1.03 0.00 0.00 405 T 8.90 5.35 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 1.30 0.00 0.00 406 G 8.04 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 0.00 0.00 0.00 0.00 407 G 7.89 3.99 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 0.00 0.00 0.00 408 A 8.46 4.09 1.27 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 0.00 0.00 409 R 8.50 3.85 0.00 1.95 2.02 0.00 3.26 0.00 0.00 3.29 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 410 S 8.07 4.44 0.00 4.13 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 0.00 411 G 8.22 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 412 K 8.23 3.96 0.00 2.06 2.15 0.00 1.58 0.00 0.00 1.83 0.00 0.00 3.15 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.54 1.59 7.81 413 S 8.03 4.24 0.00 3.94 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 0.00 414 R 8.13 3.91 0.00 1.87 2.13 0.00 3.16 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 415 H 8.07 4.11 0.00 3.19 3.42 0.00 5.85 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 0.00 416 A 8.49 3.87 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.91 4.26 0.00 2.10 2.23 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 2.74 2.59 0.00 418 A 7.68 3.99 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 0.00 419 L 7.69 3.92 0.00 1.70 1.64 0.26 0.33 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 0.00 420 I 7.47 3.79 2.12 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 1.76 0.76 0.80 0.00 0.00 421 G 9.04 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 0.00 0.00 0.00 422 D 8.60 4.80 0.00 2.83 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 0.00 423 A 6.81 4.68 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 0.00 424 P 0.00 4.19 0.00 2.28 2.49 0.00 3.44 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.21 0.00 425 Q 7.93 5.19 0.00 2.22 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 426 V 8.34 4.60 1.30 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 -0.92 0.00 0.00 0.32 0.00 0.00 427 L 8.42 5.17 0.00 1.67 1.47 0.89 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 428 Y 10.00 5.04 0.00 3.16 3.03 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 0.00 0.00 0.00 0.00 429 I 8.47 4.46 1.75 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.71 0.86 0.00 0.00 430 A 8.28 5.04 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 0.00 431 T 8.86 4.39 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 1.38 0.00 0.00 432 S 7.83 4.72 0.00 4.04 3.90 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 0.00 433 Q 8.97 3.98 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.77 0.00 0.00 0.00 0.00 0.00 2.46 2.70 0.00 434 I 7.85 3.66 1.89 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 1.64 0.56 0.93 0.00 0.00 435 L 7.77 4.16 0.00 1.89 1.89 0.97 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 436 D 8.32 4.74 0.00 2.91 2.91 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 0.00 0.00 0.00 437 D 8.37 4.42 0.00 2.85 2.71 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 0.00 438 E 7.77 4.07 0.00 2.11 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 0.00 2.33 2.53 0.00 439 M 7.79 3.87 0.00 1.95 1.36 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 1.95 0.00 440 A 7.62 4.16 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 0.00 441 A 7.45 4.25 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 0.00 442 R 7.51 3.81 0.00 1.71 2.00 0.00 2.62 0.00 0.00 3.19 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.41 0.00 443 I 7.54 4.19 1.86 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 1.21 1.57 0.00 2.21 0.00 0.00 2.60 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.90 0.00 462 H 8.14 3.97 0.00 3.21 3.35 0.00 5.84 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 463 L 8.15 3.95 0.00 1.74 1.74 0.91 1.00 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 0.00 464 D 8.23 4.38 0.00 2.79 2.83 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 0.00 465 T 7.90 4.00 4.36 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 1.18 0.00 0.00 466 L 7.78 4.39 0.00 1.69 1.68 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 467 I 7.44 4.03 1.86 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 1.45 0.59 0.90 0.00 0.00 468 T 7.37 4.27 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 1.29 0.00 0.00 469 A 8.10 4.68 1.39 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 511 I 7.83 3.68 2.11 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 1.57 0.81 0.96 0.00 0.00 512 D 8.07 4.40 0.00 2.95 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 0.00 513 D 8.01 4.36 0.00 2.89 2.69 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 0.00 514 E 8.36 3.87 0.00 2.12 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 2.33 2.39 0.00 515 I 8.17 3.72 1.98 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.65 0.92 0.00 0.00 516 Q 8.69 4.14 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 517 I 7.96 3.65 2.04 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 1.36 0.94 0.89 0.00 0.00 518 L 7.86 4.09 0.00 1.87 1.96 0.93 0.93 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 0.00 519 I 8.06 3.71 1.87 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 1.46 0.87 0.91 0.00 0.00 520 A 8.09 4.08 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 0.00 521 A 8.77 3.99 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 0.00 522 C 7.90 4.25 0.00 3.18 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 0.00 523 Q 7.95 4.18 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.88 0.00 0.00 0.00 0.00 0.00 2.48 2.63 0.00 524 R 7.59 4.36 0.00 1.89 1.94 0.00 3.10 0.00 0.00 3.09 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 525 C 7.63 4.72 0.00 3.05 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 0.00 526 P 0.00 4.35 0.00 2.25 2.28 0.00 3.79 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 1.95 0.00 527 A 7.62 4.47 1.30 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 0.00 0.00 528 K 8.80 4.09 0.00 1.84 1.68 0.00 1.57 0.00 0.00 1.58 0.00 0.00 2.78 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.40 7.81 529 V 8.47 4.75 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 nan 0.00 0.00 0.96 0.00 0.00 530 V 9.16 4.99 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 0.77 0.00 0.00 1.02 0.00 0.00 531 L 8.99 5.24 0.00 1.63 1.55 0.94 0.80 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 0.00 532 V 8.77 4.77 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 0.99 0.00 0.00 1.01 0.00 0.00 533 T 9.30 4.98 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 1.29 0.00 0.00 534 N 8.64 5.56 0.00 2.67 2.72 0.00 0.00 6.84 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 0.00 535 E 9.23 4.41 0.00 1.83 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 2.33 2.44 0.00 536 V 8.48 4.47 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 0.88 0.00 0.00 0.84 0.00 0.00 537 G 8.22 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 0.00 0.00 0.00 538 M 8.21 4.52 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 539 G 7.66 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 0.00 540 I 7.93 4.13 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 1.30 0.88 0.91 0.00 0.00 541 V 8.12 3.63 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 0.76 0.00 0.00 0.91 0.00 0.00 542 P 0.00 4.34 0.00 2.08 2.01 0.00 3.70 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 2.19 2.13 0.00 543 E 8.72 4.08 0.00 1.90 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 2.27 2.34 0.00 544 N 8.11 4.39 0.00 2.75 2.68 0.00 0.00 7.30 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 0.00 545 R 8.59 3.96 0.00 1.86 1.91 0.00 3.32 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.25 0.00 546 L 8.20 4.30 0.00 1.70 1.74 0.73 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 547 A 8.85 4.09 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 548 R 7.62 3.80 0.00 2.08 1.70 0.00 3.19 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 549 H 7.74 3.99 0.00 3.07 2.93 0.00 5.90 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 550 F 8.82 4.16 0.00 3.19 3.40 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 0.00 551 R 8.01 3.51 0.00 2.02 2.08 0.00 3.14 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 552 D 7.59 4.20 0.00 2.77 2.63 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 0.00 553 I 8.00 3.61 1.99 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.09 0.92 0.00 0.00 554 A 8.13 3.92 0.60 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 0.00 0.00 555 G 7.52 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 556 R 8.26 4.08 0.00 1.83 1.97 0.00 3.12 0.00 0.00 3.08 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 557 V 7.89 3.62 2.23 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 1.05 0.00 0.00 0.95 0.00 0.00 558 N 7.97 4.43 0.00 2.86 2.85 0.00 0.00 7.03 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 0.00 559 Q 7.64 4.01 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.62 0.00 560 R 7.96 4.03 0.00 2.07 1.98 0.00 3.16 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 561 L 7.84 3.92 0.00 1.89 1.76 0.94 0.69 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 0.00 562 A 8.17 3.98 1.39 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 0.00 563 A 7.74 3.93 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 0.00 564 A 7.78 4.18 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 0.00 565 A 6.96 4.35 1.39 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 0.00 566 D 9.35 4.72 0.00 2.65 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 0.00 567 E 8.10 4.72 0.00 1.94 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 2.28 2.38 0.00 568 V 7.83 4.91 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 0.82 0.00 0.00 0.97 0.00 0.00 569 W 9.38 5.08 0.00 3.47 3.25 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 0.00 570 L 9.23 5.11 0.00 1.74 1.56 1.01 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 571 V 8.65 4.83 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 0.85 0.00 0.00 0.92 0.00 0.00 572 V 8.36 4.32 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 0.79 0.00 0.00 0.95 0.00 0.00 573 S 9.79 3.81 0.00 4.04 3.99 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 0.00 574 G 8.61 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 0.00 575 I 7.64 4.25 2.03 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 1.17 0.98 0.94 0.00 0.00 576 G 8.61 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 0.00 577 V 9.05 4.53 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 0.99 0.00 0.00 1.07 0.00 0.00 578 K 8.62 3.67 0.00 1.01 1.33 0.00 1.53 0.00 0.00 1.49 0.00 0.00 2.68 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.73 0.21 7.81 579 I 8.53 4.07 1.80 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 1.11 0.68 0.86 0.00 0.00 580 K 7.38 4.02 0.00 1.58 1.61 0.00 1.76 0.00 0.00 1.92 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.24 1.35 7.81 * Residues marked with a * may have inaccurate shift predictions.