NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 418 L 4.3713 8.1693 120.5880 54.2643 43.9022 176.0689 419 F 4.8506 6.8258 111.7765 54.6360 40.9767 171.9074 420 I 4.4129 8.2579 122.4935 60.2336 39.5471 177.1565 421 T 4.5212 8.2260 113.0686 61.1282 69.2864 173.4385 422 E 4.4909 8.0193 120.0764 56.8835 32.3931 174.9041 423 G 4.0085 8.8669 110.7884 45.0078 0.0000 171.1382 424 Y 5.1867 8.1568 114.8791 56.2399 41.3481 175.7057 425 E 4.7535 9.1454 121.0989 54.4650 33.0257 174.9993 426 V 3.6849 8.5801 124.5717 64.1061 32.6914 176.5462 427 G 3.9034 9.4936 115.3921 46.2663 0.0000 171.9083 428 R 5.1307 7.3796 118.8184 54.2137 32.4107 175.2206 429 V 4.4117 8.6658 125.0862 61.4206 35.7486 174.1907 430 N 5.0497 8.7840 124.9661 52.0980 38.5827 174.9956 431 G 4.1124 8.5486 112.1235 45.2322 0.0000 169.6348 432 L 5.2599 8.1134 117.8194 53.2460 45.8541 176.0630 433 A 4.6283 8.6710 122.4643 50.9743 23.5628 174.5866 434 V 4.8368 8.0564 109.2582 59.7283 34.7255 175.3488 435 I 4.5271 8.8327 120.0904 60.3087 39.5625 176.2850 436 G 3.8951 9.3389 112.6837 45.9588 0.0000 175.8386 437 E 4.1342 8.9534 126.6866 58.8941 29.8616 176.8773 438 S 5.6301 7.5949 106.4780 58.5758 64.0489 173.6821 439 A 4.6976 8.1603 125.5847 50.0006 22.6692 176.2468 440 G 4.3694 8.4004 107.5440 45.6949 0.0000 172.7389 441 I 4.8724 8.5736 113.0743 58.9257 41.6943 174.2241 442 V 4.0251 8.1992 123.0788 62.3853 32.5096 175.7609 443 L 4.3363 8.4560 131.0633 52.1718 42.3860 172.0368 444 P 5.0824 0.0000 0.0000 62.1544 32.9724 175.5050 445 I 5.0323 8.7428 117.1907 58.8625 40.9615 174.2948 446 I 5.1492 8.3412 116.7252 59.1463 40.6729 174.0988 447 A 5.2663 9.0968 125.4726 50.4000 22.3767 174.9063 448 E 4.9066 9.0133 119.7423 54.7700 34.4610 175.1407 449 V 5.1954 8.2647 113.3224 60.1749 35.7577 175.0237 450 T 4.7942 8.7940 113.4532 59.0125 72.6065 171.3364 451 P 4.6140 0.0000 0.0000 63.4815 31.2996 176.8619 452 S 4.1174 8.7380 118.4390 60.1486 62.9678 174.4262 453 M 3.4065 8.2530 119.5401 55.0888 30.2812 176.3402 *457 E 4.0071 7.9103 117.5805 55.2537 30.4245 175.2155 458 G 4.0871 8.3333 113.8298 46.3561 0.0000 172.6288 459 R 4.8507 9.2826 122.7112 54.2126 34.3994 174.5980 460 V 4.6499 8.2420 120.1059 61.4511 33.3584 174.7238 461 I 4.5258 8.9894 129.3353 59.7380 38.8388 174.6122 462 A 5.1644 8.3565 127.3811 50.5918 22.2882 174.5665 463 T 4.5958 8.4171 112.9943 61.0008 71.0235 174.5698 464 G 3.9417 8.5470 109.6037 44.6121 0.0000 174.3208 465 R 4.0049 8.5779 116.7487 58.5368 30.5755 177.3708 466 L 4.5766 7.7183 115.9243 54.3420 42.3176 177.9802 467 Q 4.1722 7.8824 120.3478 59.4736 28.1981 178.3334 468 E 3.9591 8.1557 120.6971 58.8673 29.7690 178.1466 469 I 3.6768 7.9175 119.3249 64.6256 37.0906 177.5924 470 A 4.1165 8.2030 120.9093 55.5165 18.2050 179.6893 471 R 3.9028 8.1278 116.4594 59.3289 30.1019 179.0193 472 E 3.9275 8.5326 117.2968 59.4693 29.5146 178.8843 473 A 3.9719 8.1518 122.4204 54.6900 18.2629 179.6850 474 V 3.5210 7.8698 115.4449 66.2915 32.0494 177.2346 475 M 4.1347 8.2601 118.4225 58.8600 31.7643 177.7043 476 N 4.4370 8.1851 115.9803 55.7801 37.4964 176.4853 477 V 4.1459 7.4667 118.6800 61.5713 31.8632 177.6836 478 S 4.0611 7.6900 114.7424 61.5891 61.9527 175.9830 479 A 3.9899 7.8998 123.4367 55.0516 17.4990 179.5195 480 I 3.6618 7.6806 111.1703 63.8767 37.2454 178.3665 481 I 3.7538 8.1429 122.3563 64.1390 37.0760 178.1902 482 K 3.9869 8.0960 119.7494 59.4694 32.6397 179.2260 483 K 4.0880 9.5063 115.2695 56.8079 31.3466 176.1291 484 Y 4.6418 6.9261 113.6958 59.7591 41.2533 177.6409 485 T 3.9411 7.6374 111.3313 63.1068 69.1570 175.5468 486 G 4.0465 6.5435 108.8118 45.9191 0.0000 172.8060 487 R 4.5380 7.7111 118.8513 53.6704 32.2020 175.4712 488 D 4.6210 8.3641 121.0010 53.3982 42.2841 177.4761 489 I 3.8676 8.3882 127.5623 64.1624 37.6491 177.6065 490 S 4.4266 8.3120 113.1975 59.5157 63.2797 174.3440 491 N 4.9794 8.5743 118.6967 53.4563 39.9496 173.9090 492 M 5.3243 7.9274 118.3960 53.4974 36.5740 174.1639 493 D 5.1041 8.7596 121.0905 53.4020 43.0866 175.6611 494 V 4.6164 8.7212 123.5257 61.4371 34.2369 173.8451 495 H 5.2329 9.3677 126.2289 54.3746 30.2850 173.3916 496 I 4.9125 9.0031 125.1499 59.4369 40.0939 175.1227 497 Q 4.6163 8.6313 124.6143 54.0114 32.8081 174.3681 498 F 4.9872 8.7095 120.1356 56.5900 40.5987 175.8422 499 V 4.0105 8.9246 124.7655 65.6267 31.6139 173.7692 500 G 3.6515 8.5467 113.8728 44.2283 0.0000 171.1795 501 T 4.5235 7.7542 112.5658 60.4496 70.0245 173.9664 502 Y 4.6390 8.0580 124.1371 56.2338 38.3111 175.1081 503 E 4.0262 7.8761 120.2004 57.4728 30.8620 177.6441 504 G 3.8804 8.8801 109.1650 46.0291 0.0000 172.3909 505 V 4.7445 7.7010 118.5290 60.6579 33.3665 174.2681 506 E 4.4801 8.9413 129.0885 54.5890 31.1722 175.3121 507 G 3.9164 8.4332 114.1139 44.5461 0.0000 172.8723 508 D 4.5791 8.4417 120.5095 53.7489 41.4726 177.0276 509 S 4.2447 8.7513 118.6530 60.4141 63.6672 174.3546 510 A 3.5630 9.7212 126.0549 52.7645 16.9352 177.2626 511 S 4.6733 7.9748 114.0284 59.4364 64.0965 173.5997 512 I 3.7924 8.6573 123.7570 64.0988 37.3992 178.5922 513 S 4.1067 8.1351 115.5758 61.3790 62.6376 176.5696 514 I 3.7488 7.5093 121.7339 63.8343 36.9532 177.9651 515 A 3.9891 7.8554 121.2952 55.6130 18.2011 179.5789 516 T 3.8084 8.2328 114.2370 66.8807 68.4723 176.4136 517 A 3.9636 7.8718 122.1716 55.3462 18.4200 179.9405 518 V 3.5460 7.7674 116.5763 66.0588 31.6061 178.4222 519 I 3.7434 7.9959 119.7059 64.3746 37.1381 178.0391 520 S 4.0958 8.6346 114.1898 61.5894 62.0858 176.2723 521 A 4.0114 8.2599 123.4297 55.2967 17.9327 179.7110 522 I 3.7878 7.6445 117.1588 64.4471 37.2818 178.0677 523 E 4.2648 8.3101 117.7536 56.0990 29.8780 176.6524 524 G 3.9079 7.6567 105.3212 46.9116 0.0000 173.5512 525 I 4.5155 7.4537 119.1411 58.4243 39.4068 175.1358 526 P 4.8210 0.0000 0.0000 62.5088 33.1388 175.1719 527 V 4.8645 8.4800 121.0581 60.8783 34.4101 174.2389 528 D 3.8587 9.1848 128.0658 54.2964 41.2951 177.1316 529 Q 3.8426 8.6917 126.3622 58.1846 29.1718 177.4841 530 S 4.4513 8.1041 111.5624 58.8355 63.5061 173.4509 531 V 4.5345 6.8936 121.2729 61.1854 31.6320 175.4139 532 A 5.1016 8.7907 130.6721 51.7910 19.6059 175.7968 533 M 5.2284 8.1543 115.2866 54.3895 34.4855 173.6284 534 T 4.6074 9.7161 115.5761 59.6195 71.5246 172.9195 535 G 4.3306 7.4891 118.5662 45.0189 0.0000 171.1226 536 S 5.2875 7.8166 116.5203 55.5914 65.3566 173.3091 537 L 4.7822 9.0389 128.4452 54.0823 42.4479 176.7518 538 S 4.3751 9.0600 122.1104 58.3884 63.6795 176.1221 539 V 3.6723 8.5091 114.2955 64.2099 31.4269 177.3958 540 K 4.1390 7.9077 117.2887 56.5046 32.1454 177.6257 541 G 4.0892 8.3277 108.6464 44.9211 0.0000 173.3463 542 E 4.5933 7.8874 119.3133 56.1720 31.0530 175.9347 543 V 4.5284 8.7294 124.0341 61.8417 32.5454 175.2381 544 L 4.7835 9.1265 129.0639 52.5369 43.6720 174.8609 545 P 4.9367 0.0000 0.0000 63.3330 32.2183 175.3664 546 V 4.4523 8.6795 113.4072 59.8440 35.4954 175.1682 547 G 3.8253 8.3782 110.3266 45.2674 0.0000 174.4431 548 G 4.3368 8.7082 104.1899 46.3583 0.0000 176.0576 549 V 3.6595 7.3112 122.3824 64.9490 31.0470 178.5955 550 T 3.8413 7.7817 115.7409 66.3483 68.5074 176.4597 551 Q 3.9846 8.0378 119.4122 59.0942 28.8385 179.1146 552 K 3.9312 8.4740 119.5840 59.5498 32.0996 179.4841 553 I 3.6883 8.0183 120.2912 64.4539 36.9347 178.2921 554 E 3.9903 8.4269 119.2875 59.3453 29.2541 179.3656 555 A 3.9425 8.0251 120.5286 54.9477 18.4640 179.5202 556 A 3.8611 8.0332 119.3392 55.2123 18.3292 179.7759 557 I 3.5546 8.1718 118.5945 64.8804 37.0474 178.7652 558 Q 3.9819 8.1071 117.2125 58.5645 28.6121 178.0428 559 A 4.5108 7.9445 119.5287 52.0317 18.8019 178.0105 560 G 3.8842 8.1002 105.6873 45.6171 0.0000 174.0008 561 L 4.2694 7.5458 119.0809 54.2242 42.5419 177.4912 562 K 4.2697 8.9305 122.3946 58.7796 33.3291 177.1719 563 K 5.2625 7.8738 117.1653 54.5543 37.2057 176.1218 564 V 4.7361 8.7750 121.5897 60.2306 34.5730 174.4753 565 I 4.6783 8.8398 128.0785 60.7565 38.2917 175.2845 566 I 5.2363 8.8311 119.4415 57.0518 41.7786 172.7867 567 P 4.6153 0.0000 0.0000 62.6927 31.9498 177.3491 568 K 3.8098 9.0586 125.8860 59.8705 32.1695 178.0974 569 D 4.5825 8.0803 115.3910 55.9910 40.8527 176.2322 570 N 5.2245 8.2543 116.5030 52.2324 39.3276 176.7828 571 I 3.6723 7.7628 121.4505 64.4905 37.2094 177.7245 572 D 4.5979 8.0013 116.7430 54.9811 39.5951 176.2720 573 D 4.5140 8.1746 119.8695 54.4317 41.3899 176.0748 574 V 4.0711 7.2201 118.9336 62.1732 31.4509 176.3033 575 L 4.8408 8.1822 129.9693 53.4773 41.6094 177.3424 576 L 4.0945 7.5719 118.7582 54.4882 42.8614 177.4135 577 D 4.4469 9.2747 122.5274 53.1956 39.4073 175.6887 578 A 4.7964 7.4522 124.9413 54.0285 18.0540 174.5457 579 E 4.6845 8.3011 128.0296 57.4736 29.2684 176.7567 580 H 4.4305 8.5840 115.6889 58.6085 29.2015 176.2661 581 E 4.3312 7.9706 117.1930 57.4214 30.1805 176.1496 582 G 3.7584 8.9324 109.1124 45.9010 0.0000 174.9417 583 K 4.1684 7.6618 117.5902 58.3404 32.4021 176.7834 584 I 4.7635 7.1635 117.0851 59.1344 41.4468 173.7645 585 E 4.1982 8.9376 129.4281 55.8570 30.7864 175.2706 586 V 4.5521 8.3943 127.3002 61.6713 32.9922 175.0262 587 I 4.4058 9.0170 131.3531 58.9489 38.5258 173.3136 588 P 5.0716 0.0000 0.0000 62.5107 32.4585 176.0204 589 V 4.6326 8.8778 114.9592 60.1379 35.8744 176.0882 590 S 4.6243 10.3767 118.6698 59.1857 65.2749 174.7664 591 R 5.0930 7.8786 117.0383 53.2276 34.1362 175.8258 592 I 3.7257 8.7887 121.4552 64.0993 37.8749 178.2422 593 N 3.5583 8.1683 117.7560 55.7105 37.1607 176.8719 594 E 3.9394 7.8739 120.9150 58.9921 29.0667 179.5683 595 V 3.5706 7.6454 117.7060 66.0525 31.7667 177.9102 596 L 4.0010 7.6871 118.6134 57.8288 41.1764 179.3329 597 E 3.9113 7.8569 117.4985 59.7808 29.4914 178.8653 598 H 4.3882 7.9472 113.9480 57.6799 29.1399 176.4139 599 V 4.4526 7.3488 111.2414 61.3335 34.8119 176.0786 600 L 4.6549 8.3934 121.1000 54.0784 42.1173 177.0230 601 E 3.8542 8.9457 125.2599 56.2828 29.9253 176.6549 602 D 4.3668 8.7388 126.4155 54.1776 41.6697 176.0466 603 G 4.3150 8.4513 108.9014 43.3698 0.0000 173.9192 604 K 3.8887 8.2747 119.0765 59.3200 31.7373 179.7720 605 K 3.9160 7.9348 118.1347 59.2866 32.0428 178.7247 606 K 3.7846 8.0580 119.2575 59.8393 32.1358 177.8524 607 N 4.2895 8.2174 116.4711 56.6518 38.3171 177.3701 608 R 3.9146 7.9381 118.4281 59.2058 30.2042 178.0197 609 L 4.1581 8.0851 120.3053 58.5009 41.7156 178.7151 610 M 3.9599 8.8948 119.7770 58.5100 31.6248 178.9534 611 S 4.2555 7.8771 113.1140 61.2463 63.2805 175.8938 612 K 3.9432 7.7103 120.8332 58.6119 31.9061 177.0418 613 F 3.2263 7.7140 116.0594 56.7676 37.6710 175.5977 614 K 4.2696 8.3694 124.1879 56.5490 32.9946 176.7007 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 418 L 8.17 4.37 0.00 1.77 2.05 0.94 0.47 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 0.00 419 F 6.83 4.85 0.00 3.35 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 0.00 420 I 8.26 4.41 1.91 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 1.51 0.67 0.98 0.00 0.00 421 T 8.23 4.52 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 1.50 0.00 0.00 422 E 8.02 4.49 0.00 1.90 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 0.00 2.17 2.25 0.00 423 G 8.87 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 0.00 0.00 0.00 424 Y 8.16 5.19 0.00 2.84 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 0.00 425 E 9.15 4.75 0.00 1.87 1.81 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 2.25 2.42 0.00 426 V 8.58 3.68 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 0.99 0.00 0.00 0.95 0.00 0.00 427 G 9.49 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 0.00 0.00 0.00 428 R 7.38 5.13 0.00 1.85 1.80 0.00 3.27 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 429 V 8.67 4.41 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 0.91 0.00 0.00 0.98 0.00 0.00 430 N 8.78 5.05 0.00 2.62 2.62 0.00 0.00 7.00 7.59 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 0.00 431 G 8.55 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 0.00 0.00 0.00 432 L 8.11 5.26 0.00 1.41 1.44 0.86 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 433 A 8.67 4.63 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 434 V 8.06 4.84 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 0.82 0.00 0.00 0.91 0.00 0.00 435 I 8.83 4.53 1.89 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 1.20 1.13 0.97 0.00 0.00 436 G 9.34 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 0.00 0.00 0.00 437 E 8.95 4.13 0.00 1.97 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 2.30 2.23 0.00 438 S 7.59 5.63 0.00 3.76 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 0.00 439 A 8.16 4.70 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 0.00 440 G 8.40 4.37 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 0.00 441 I 8.57 4.87 1.91 0.00 0.00 0.73 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 0.90 1.05 0.00 0.00 442 V 8.20 4.03 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 -0.03 0.00 0.00 0.55 0.00 0.00 443 L 8.46 4.34 0.00 1.46 1.35 -0.08 0.70 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 0.00 444 P 0.00 5.08 0.00 2.30 2.50 0.00 3.83 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 2.53 2.37 0.00 445 I 8.74 5.03 1.68 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 1.25 1.18 0.27 0.00 0.00 446 I 8.34 5.15 1.84 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 1.18 1.10 0.95 0.00 0.00 447 A 9.10 5.27 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 0.00 448 E 9.01 4.91 0.00 1.91 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 0.00 2.21 2.25 0.00 449 V 8.26 5.20 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 0.75 0.00 0.00 0.95 0.00 0.00 450 T 8.79 4.79 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 451 P 0.00 4.61 0.00 1.96 2.06 0.00 3.69 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 452 S 8.74 4.12 0.00 3.88 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 0.00 453 M 8.25 3.41 0.00 2.19 2.42 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 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0.00 0.00 0.00 1.62 0.99 0.93 0.00 0.00 482 K 8.10 3.99 0.00 1.99 2.16 0.00 1.29 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.55 7.81 483 K 9.51 4.09 0.00 1.76 1.88 0.00 1.09 0.00 0.00 1.53 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.51 7.81 484 Y 6.93 4.64 0.00 2.87 2.20 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 0.00 485 T 7.64 3.94 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 1.25 0.00 0.00 486 G 6.54 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 0.00 487 R 7.71 4.54 0.00 1.81 1.86 0.00 3.21 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 488 D 8.36 4.62 0.00 2.75 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 0.00 489 I 8.39 3.87 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 1.47 0.78 0.91 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0.00 0.00 0.00 1.47 0.86 0.92 0.00 0.00 515 A 7.86 3.99 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 0.00 516 T 8.23 3.81 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 0.00 517 A 7.87 3.96 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 518 V 7.77 3.55 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.00 0.00 0.00 519 I 8.00 3.74 1.93 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 1.49 0.70 0.99 0.00 0.00 520 S 8.63 4.10 0.00 3.86 4.09 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 0.00 0.00 0.00 521 A 8.26 4.01 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 522 I 7.64 3.79 1.95 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 1.54 0.66 0.93 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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 0.73 0.00 0.00 0.89 0.00 0.00 532 A 8.79 5.10 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 533 M 8.15 5.23 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.51 0.00 534 T 9.72 4.61 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 1.18 0.00 0.00 535 G 7.49 4.33 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 0.00 536 S 7.82 5.29 0.00 3.81 3.77 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 0.00 537 L 9.04 4.78 0.00 1.62 1.71 1.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 538 S 9.06 4.38 0.00 3.93 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 539 V 8.51 3.67 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 0.79 0.00 0.00 0.92 0.00 0.00 540 K 7.91 4.14 0.00 1.77 1.83 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.36 7.81 541 G 8.33 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 542 E 7.89 4.59 0.00 1.93 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 2.43 2.27 0.00 543 V 8.73 4.53 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 0.75 0.00 0.00 0.99 0.00 0.00 544 L 9.13 4.78 0.00 1.60 1.55 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 545 P 0.00 4.94 0.00 2.07 2.05 0.00 3.71 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 1.98 2.00 0.00 546 V 8.68 4.45 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 0.75 0.00 0.00 0.98 0.00 0.00 547 G 8.38 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 0.00 548 G 8.71 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 0.00 0.00 0.00 0.00 549 V 7.31 3.66 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 0.86 0.00 0.00 0.91 0.00 0.00 550 T 7.78 3.84 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 1.31 0.00 0.00 551 Q 8.04 3.98 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 552 K 8.47 3.93 0.00 1.93 1.81 0.00 1.75 0.00 0.00 1.61 0.00 0.00 3.12 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.52 7.81 553 I 8.02 3.69 1.85 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 1.49 0.66 0.88 0.00 0.00 554 E 8.43 3.99 0.00 2.09 2.00 0.00 0.00 0.00 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 2.57 0.00 555 A 8.03 3.94 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 556 A 8.03 3.86 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 0.00 557 I 8.17 3.55 1.87 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 1.45 0.74 0.79 0.00 0.00 558 Q 8.11 3.98 0.00 2.08 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.93 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 559 A 7.94 4.51 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 0.00 560 G 8.10 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 561 L 7.55 4.27 0.00 1.63 1.69 0.75 0.89 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 0.00 562 K 8.93 4.27 0.00 1.69 1.83 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.40 7.81 563 K 7.87 5.26 0.00 1.61 1.60 0.00 1.60 0.00 0.00 1.87 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.39 7.81 564 V 8.78 4.74 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 0.82 0.00 0.00 0.89 0.00 0.00 565 I 8.84 4.68 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 1.18 0.59 0.87 0.00 0.00 566 I 8.83 5.24 1.85 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 1.21 1.64 0.88 0.00 0.00 567 P 0.00 4.62 0.00 2.24 2.02 0.00 3.66 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.13 0.00 568 K 9.06 3.81 0.00 1.82 1.82 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.43 7.81 569 D 8.08 4.58 0.00 2.70 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.25 5.22 0.00 2.91 2.81 0.00 0.00 7.22 6.84 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 0.00 571 I 7.76 3.67 1.94 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 1.46 1.41 0.90 0.00 0.00 572 D 8.00 4.60 0.00 2.76 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 0.00 573 D 8.17 4.51 0.00 2.84 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 0.00 574 V 7.22 4.07 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 0.76 0.00 0.00 0.92 0.00 0.00 575 L 8.18 4.84 0.00 1.64 1.57 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 576 L 7.57 4.09 0.00 1.65 1.64 0.92 1.15 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 0.00 577 D 9.27 4.45 0.00 2.78 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 0.00 578 A 7.45 4.80 1.28 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 0.00 579 E 8.30 4.68 0.00 2.07 2.37 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 2.17 2.13 0.00 580 H 8.58 4.43 0.00 3.45 3.33 0.00 5.87 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 581 E 7.97 4.33 0.00 2.12 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 2.36 2.25 0.00 582 G 8.93 3.76 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 0.00 0.00 0.00 583 K 7.66 4.17 0.00 1.94 1.87 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.79 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.63 1.60 7.81 584 I 7.16 4.76 1.84 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 1.20 0.85 0.88 0.00 0.00 585 E 8.94 4.20 0.00 2.10 1.79 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 2.28 2.24 0.00 586 V 8.39 4.55 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 0.83 0.00 0.00 0.91 0.00 0.00 587 I 9.02 4.41 1.77 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 1.23 0.41 0.68 0.00 0.00 588 P 0.00 5.07 0.00 2.06 2.02 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.98 0.00 589 V 8.88 4.63 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 0.66 0.00 0.00 0.97 0.00 0.00 590 S 10.38 4.62 0.00 3.79 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 0.00 591 R 7.88 5.09 0.00 1.80 2.12 0.00 3.21 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 592 I 8.79 3.73 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 1.74 1.33 1.28 0.00 0.00 593 N 8.17 3.56 0.00 2.48 2.68 0.00 0.00 6.30 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 0.00 594 E 7.87 3.94 0.00 2.19 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 2.34 2.31 0.00 595 V 7.65 3.57 2.20 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 1.06 0.00 0.00 0.93 0.00 0.00 596 L 7.69 4.00 0.00 1.58 1.56 0.79 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 597 E 7.86 3.91 0.00 2.07 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.40 0.00 598 H 7.95 4.39 0.00 3.09 3.36 0.00 5.79 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 599 V 7.35 4.45 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 0.70 0.00 0.00 1.00 0.00 0.00 600 L 8.39 4.65 0.00 1.55 1.61 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 601 E 8.95 3.85 0.00 1.51 1.68 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 1.98 1.47 0.00 602 D 8.74 4.37 0.00 2.63 2.55 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 0.00 603 G 8.45 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 0.00 0.00 0.00 0.00 604 K 8.27 3.89 0.00 1.79 1.87 0.00 1.66 0.00 0.00 1.80 0.00 0.00 3.18 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.52 7.81 605 K 7.93 3.92 0.00 1.78 1.85 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.49 7.81 606 K 8.06 3.78 0.00 1.87 1.95 0.00 1.69 0.00 0.00 1.84 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.51 7.81 607 N 8.22 4.29 0.00 2.89 2.86 0.00 0.00 6.75 7.30 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 0.00 608 R 7.94 3.91 0.00 1.90 2.14 0.00 3.44 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 609 L 8.09 4.16 0.00 1.92 1.80 1.04 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 610 M 8.89 3.96 0.00 1.95 2.16 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.69 0.00 611 S 7.88 4.26 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 0.00 612 K 7.71 3.94 0.00 2.01 1.81 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.58 7.81 613 F 7.71 3.23 0.00 2.96 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 0.00 614 K 8.37 4.27 0.00 1.75 1.68 0.00 1.82 0.00 0.00 1.79 0.00 0.00 3.33 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.38 7.81 * Residues marked with a * may have inaccurate shift predictions.