NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 417 K 4.1530 8.3149 119.9740 56.4915 33.7562 175.6744 418 L 3.9890 7.9164 119.4801 54.4030 41.9922 175.8932 419 F 5.0621 7.3000 112.8135 54.7585 41.8787 173.4722 420 I 4.4825 8.3353 121.3916 59.9720 38.7123 176.1408 421 T 4.4886 8.4347 113.2538 61.9103 69.9487 174.0930 422 E 4.5332 7.7531 120.4062 55.5805 33.6162 176.0930 423 G 3.9137 8.7749 108.5824 44.7130 0.0000 171.1905 424 Y 5.3011 8.2373 114.4782 56.3050 41.4920 175.4423 425 E 4.7938 9.1093 121.7138 54.3348 34.2868 175.0703 426 V 3.7328 8.4852 124.2185 64.1662 32.7362 176.8082 427 G 4.0530 9.4273 115.2489 46.2690 0.0000 172.3244 428 R 5.1721 7.3954 118.5209 54.1747 32.5590 175.5269 429 V 4.4043 8.5450 123.2169 60.9565 35.5187 174.3196 430 N 4.7192 8.8528 124.9397 53.0821 39.3128 175.0065 431 G 4.3856 8.7933 113.2252 44.6766 0.0000 170.9501 432 L 5.2969 8.1373 117.7905 53.0950 45.7564 175.9595 433 A 4.7309 9.1827 123.6433 50.8064 23.7843 174.6789 434 V 4.9233 8.1163 110.9150 59.6703 34.6023 175.4806 435 I 4.6491 8.6299 118.1843 60.2474 39.8251 176.5703 436 G 3.9141 8.2909 114.6920 46.5041 0.0000 173.4499 437 E 4.1476 8.7572 117.5512 58.9697 29.7318 177.0489 438 S 4.5028 7.5389 112.6074 59.3264 68.1429 173.8774 439 A 4.0437 7.7866 121.7506 52.1235 19.4423 175.8375 440 G 4.5564 8.5626 106.3546 44.5992 0.0000 172.8722 441 I 4.8360 8.8702 114.0090 58.6164 41.5109 174.5419 442 V 3.7429 8.3319 124.7873 63.1980 31.9982 175.6785 443 L 4.4113 8.9358 131.3655 52.1463 42.4289 172.2893 444 P 4.9374 0.0000 0.0000 62.3151 33.0973 175.5502 445 I 4.8675 8.7459 123.4924 59.3972 40.9738 174.2333 446 I 5.1628 8.5396 124.6954 59.1451 41.2411 173.8243 447 A 5.2643 9.1461 130.2956 50.2951 22.3181 174.8646 448 E 4.7554 9.0495 119.5517 54.7957 34.2495 174.8760 449 V 5.1598 8.5566 116.4810 59.7682 34.6908 175.0626 450 T 4.8741 8.6909 113.9911 58.6475 72.2141 171.3600 451 P 4.3629 0.0000 0.0000 64.1368 30.9899 176.0738 452 S 4.0939 8.6237 117.8469 60.9723 62.4347 173.2674 453 M 3.5322 8.3119 119.6028 55.4497 30.3649 175.4386 *457 E 4.1349 7.6559 115.9024 55.4040 30.8220 175.2814 458 G 4.4676 9.3303 110.6835 46.0622 0.0000 172.6626 459 R 4.8951 8.8464 116.4525 54.1629 33.8091 173.9739 460 V 4.6310 8.3324 118.8628 61.2558 33.6188 174.4917 461 I 4.5216 8.8820 129.6090 59.8198 38.8002 174.6891 462 A 5.2583 8.6587 127.5580 51.4295 22.1445 174.8439 463 T 4.5304 8.4526 110.0463 60.4176 72.2661 173.7237 464 G 3.9145 8.5144 109.0186 44.5962 0.0000 174.2460 465 R 3.9224 8.4687 116.3372 58.6197 29.9218 177.8290 466 L 4.3831 7.5401 116.0485 54.2819 42.0852 178.0149 467 Q 4.2280 7.9537 120.7403 59.3221 28.2315 178.5050 468 E 3.9850 8.1275 119.1990 59.3005 29.6939 178.9551 469 I 3.6927 7.8215 120.1069 63.9439 37.1874 177.9187 470 A 4.0739 7.9768 121.2669 55.3602 18.2454 179.6184 471 R 3.8776 8.1874 116.5042 59.5049 30.1293 178.8365 472 E 3.8948 8.4176 118.5728 59.2830 29.6728 178.4561 473 A 3.9957 8.2275 120.9942 55.4793 18.3498 179.8499 474 V 3.5714 7.8770 116.5637 66.0917 29.9927 177.8992 475 M 4.0122 8.4443 118.4598 58.9016 31.3390 178.0873 476 N 4.6898 8.4976 117.0895 56.0659 38.7220 177.5328 477 V 3.9365 7.9595 119.9202 63.8258 31.6157 178.7203 478 S 4.0804 7.9133 116.2773 61.5839 62.6615 176.2764 479 A 3.9564 7.4597 121.9070 55.1394 18.0708 179.5362 480 I 3.7822 7.2996 113.9240 64.3313 38.0292 177.7342 481 I 3.7447 8.4141 120.9422 64.8369 37.0979 178.4597 482 K 4.0738 8.2942 120.3026 58.7828 31.6294 179.0643 483 K 3.6176 8.1146 119.4911 59.7700 32.1716 177.9960 484 Y 4.1263 7.9560 116.1061 59.3560 38.1895 176.4440 485 T 4.3635 7.9562 113.8801 62.1341 70.7549 174.4555 486 G 4.3196 8.0557 112.9565 45.6649 0.0000 174.8492 487 R 3.7774 7.6145 117.7459 56.5313 30.8452 174.7490 488 D 4.9874 8.4364 120.8373 52.2552 42.5766 176.9296 489 I 3.8240 8.3662 128.1465 64.1075 37.7201 178.3098 490 S 4.0989 8.5811 117.1348 62.0473 62.9182 175.4374 491 N 4.8281 8.1543 114.6489 54.0134 39.3306 174.9244 492 M 5.2809 8.2875 118.8127 53.6109 36.9645 173.8609 493 D 5.1418 8.8910 121.6305 53.1624 43.1842 175.5517 494 V 4.7301 8.5491 123.5004 61.3702 34.2368 173.8400 495 H 5.2600 9.4161 125.5065 54.2471 31.1034 172.8822 496 I 4.9891 8.8104 125.0026 59.4638 40.0947 175.0226 497 Q 4.7791 8.8565 124.8492 54.0650 32.8616 174.2815 498 F 4.8525 8.8914 120.8167 56.3536 40.4257 175.7759 499 V 3.8742 8.9530 125.6579 66.0626 31.4204 173.9584 500 G 3.7688 8.8792 115.5051 44.0558 0.0000 171.1488 501 T 4.3954 7.5968 107.9708 60.0343 71.4782 173.7115 502 Y 4.7052 7.8245 120.1221 56.6420 38.5580 175.1248 503 E 3.9165 7.9522 120.4835 57.3325 30.8864 176.3105 504 G 3.9025 8.7594 112.2611 46.1270 0.0000 172.2637 505 V 4.3890 7.3731 119.4180 61.3975 32.4056 174.7338 506 E 4.4740 8.7507 129.0276 54.6691 31.5521 175.8950 507 G 4.1810 8.3996 115.0902 45.5072 0.0000 171.6649 508 D 4.9146 8.4038 119.1739 52.2068 42.1406 176.4628 509 S 3.9831 8.8991 116.8294 60.5383 63.0252 174.2582 510 A 3.6440 9.3321 128.7556 51.9950 16.7429 176.8428 511 S 4.4612 8.1153 115.0322 60.0523 63.5347 173.6462 512 I 3.7508 8.5793 123.8263 64.2132 37.1404 178.5013 513 S 4.1066 8.0423 115.4999 61.2359 62.8116 176.4597 514 I 3.5340 7.7213 122.6203 64.0385 36.9765 177.6773 515 A 3.9954 7.7175 121.1817 55.9067 18.0542 179.8718 516 T 3.7872 8.0831 113.5825 66.5602 68.4089 176.6682 517 A 3.9644 7.9287 122.7316 55.2310 18.3633 179.8898 518 V 3.5100 7.7304 116.5467 66.1816 31.6639 178.2417 519 I 3.7181 7.9165 119.5962 64.4225 36.9716 178.0240 520 S 4.1809 8.3876 114.1054 61.6486 61.8904 176.3350 521 A 3.9819 7.9208 121.8846 55.2156 18.2396 179.4594 522 I 3.8465 7.9242 117.5273 64.6693 37.3609 178.4046 523 E 4.1778 8.7559 118.0529 56.7026 29.6055 177.0226 524 G 3.9031 8.0462 106.7142 46.9181 0.0000 173.5415 525 I 4.5275 7.6397 119.1737 58.2102 39.7466 174.7657 526 P 4.6027 0.0000 0.0000 62.8683 32.8553 175.2279 527 V 4.8287 8.4897 123.1707 61.0237 33.6834 174.4600 528 D 3.9512 9.2065 128.2984 54.5785 41.4630 176.8336 529 Q 4.0206 8.7892 125.6600 57.1845 29.3800 177.1000 530 S 4.4108 8.3072 112.2285 58.7665 63.4463 173.4731 531 V 4.7465 6.8650 121.0535 60.9532 31.9872 175.0914 532 A 4.9758 8.7082 129.8087 51.6522 19.8197 175.7119 533 M 5.2376 8.1888 114.8955 54.5293 34.7196 173.6453 534 T 4.6881 9.1707 114.7347 60.2238 71.2985 172.6548 535 G 4.3615 7.9498 115.8716 44.7087 0.0000 171.4454 536 S 5.2757 8.1777 117.7828 55.6637 65.5410 172.9504 537 L 4.9526 8.6083 127.2238 53.8647 43.0248 176.2235 538 S 4.6840 8.7755 121.4859 57.2386 64.4506 175.6912 539 V 3.9213 8.5859 121.1183 64.9106 31.0196 177.1818 540 K 4.0631 7.9934 118.9035 57.1546 32.3067 177.1335 541 G 3.9658 8.9247 107.0790 46.1989 0.0000 172.7426 542 E 4.5931 8.1404 121.0195 55.7612 31.0527 175.6427 543 V 4.6345 8.7615 126.7707 61.8873 32.5079 175.1508 544 L 4.8210 9.0435 128.7719 52.3217 43.9313 174.5974 545 P 4.9677 0.0000 0.0000 63.4330 32.1334 175.2781 546 V 4.4547 8.5046 112.7400 59.8734 35.7134 175.2453 547 G 3.8807 8.4383 110.6677 45.1307 0.0000 173.2228 548 G 3.9056 8.5154 104.2093 45.8488 0.0000 176.7672 549 V 3.5180 7.8993 120.5994 65.8380 31.5731 176.9661 550 T 3.8128 7.8602 114.9754 67.0116 68.1608 176.4185 551 Q 4.1316 7.9873 119.1820 58.7980 28.7739 178.8578 552 K 4.0267 8.3215 119.8566 59.3997 32.0714 179.4729 553 I 3.6294 7.6460 119.9242 64.4285 36.9702 178.0312 554 E 3.8758 8.4438 119.5789 59.6195 29.4183 179.4944 555 A 3.9292 8.0669 120.1799 54.9638 18.4370 179.3936 556 A 3.8244 8.4296 119.5510 55.4135 18.4986 179.7481 557 I 3.6216 8.2635 118.4743 64.8215 37.0499 178.5770 558 Q 4.0492 8.2310 118.4943 58.5672 28.9378 177.2643 559 A 4.4415 7.7147 119.9927 52.5901 18.7720 178.0726 560 G 3.8889 7.8656 105.2532 45.4522 0.0000 173.8841 561 L 4.1654 7.3788 118.5883 54.5928 42.3606 177.2642 562 K 4.3507 9.1822 122.2184 58.1139 33.8489 176.9676 563 K 5.1743 7.8426 117.3102 54.4413 36.9887 175.9062 564 V 4.8443 9.2241 122.5348 60.2126 34.5824 174.2695 565 I 4.7909 8.9810 127.4579 60.0915 38.6906 175.0505 566 I 5.0967 8.4083 119.5730 58.1436 41.6559 173.0143 567 P 4.8033 0.0000 0.0000 62.2762 32.1398 177.5074 568 K 3.8108 9.5099 125.4371 59.8789 32.1925 178.7537 569 D 4.4762 7.9713 116.3268 56.7484 41.1205 176.5787 570 N 4.9872 8.1456 115.3990 52.7554 38.9744 176.6484 571 I 3.6658 7.9296 122.2688 64.6377 37.1964 177.3036 572 D 4.6668 7.9799 115.6417 54.2284 39.6601 176.2197 573 D 4.5152 7.9796 119.9170 54.6604 41.5688 176.2184 574 V 3.9192 7.4491 118.8479 62.8557 30.4643 175.3542 575 L 4.5827 7.9310 128.6260 52.3101 41.1848 174.7138 576 L 4.6870 7.8481 120.8750 52.3013 44.3705 176.4070 577 D 4.4841 8.8667 122.6015 54.1326 42.0740 177.0883 578 A 3.9105 8.1163 128.5496 55.3093 18.7618 179.2059 579 E 4.1059 8.2566 112.5990 59.6026 30.2149 178.1003 580 H 4.3777 8.1821 116.3476 58.0878 29.2339 175.6089 581 E 4.2461 8.0745 118.2938 57.3540 29.8190 175.7849 582 G 4.2043 8.9486 109.5372 45.5729 0.0000 174.8099 583 K 4.2791 7.5026 116.3009 57.2513 32.7384 176.4755 584 I 4.7711 7.2050 117.6287 59.2529 41.3946 173.5404 585 E 4.3275 9.0923 130.1154 55.4187 30.7854 174.9729 586 V 4.6009 8.3385 127.4178 61.8900 33.0981 175.0264 587 I 4.5111 8.6623 129.0353 58.5964 39.8072 172.8968 588 P 4.9850 0.0000 0.0000 62.7263 32.0445 176.1975 589 V 4.7504 8.7527 116.1790 59.6526 35.8656 176.0025 590 S 4.7223 9.6068 114.9776 57.9084 64.5675 173.9259 591 R 5.0690 7.9352 119.0518 53.4474 34.0006 175.6949 592 I 3.6392 8.3955 121.0437 64.3897 37.6984 178.1951 593 N 3.6859 7.7954 117.3463 55.6032 37.1451 176.8554 594 E 3.8501 7.7086 119.8180 59.0636 29.3869 179.2890 595 V 3.5572 7.6864 117.6669 66.0531 31.4846 177.8387 596 L 3.8874 7.5969 118.2716 57.9305 41.2734 179.1075 597 E 3.8723 7.8996 117.0880 60.1907 29.5152 179.1931 598 H 4.4243 7.9164 113.9627 57.8710 29.1086 176.4769 599 V 4.4450 7.6888 111.8186 61.0375 34.3807 175.9691 600 L 4.7455 8.1829 121.4088 53.7460 42.3471 176.7053 601 E 3.7522 9.1550 125.1145 56.4401 29.9284 176.6481 602 D 4.3922 8.8412 126.4996 53.6905 41.7466 176.6194 603 G 3.9030 8.0984 109.1328 44.7920 0.0000 172.5798 604 K 3.8841 8.1115 118.9902 59.5377 32.0044 179.1298 605 K 3.9451 7.9863 118.2225 59.4423 31.9638 179.1099 606 K 3.9677 7.9678 119.3441 59.3518 32.3075 178.3591 607 N 4.2897 8.1577 116.8851 56.3369 38.2961 177.0112 608 R 3.8937 7.8183 118.5498 59.6019 30.4646 177.9326 609 L 4.1675 8.1684 119.9543 58.5554 41.9119 178.8551 610 M 4.3046 8.5971 119.3263 58.2752 31.6157 178.8860 611 S 4.2015 7.8709 113.4186 61.1846 63.2906 176.3792 612 K 4.1569 7.8986 120.8358 57.9684 32.2210 177.0300 613 F 4.2296 7.7252 118.4043 57.4703 39.2976 176.0231 614 K 4.2278 8.0617 124.7008 56.6146 32.2893 176.6313 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 417 K 8.31 4.15 0.00 1.42 1.69 0.00 0.97 0.00 0.00 1.54 0.00 0.00 2.81 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.12 1.14 7.81 418 L 7.92 3.99 0.00 1.94 2.09 1.03 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 419 F 7.30 5.06 0.00 3.27 3.07 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 0.00 420 I 8.34 4.48 2.07 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 1.48 0.66 0.96 0.00 0.00 421 T 8.43 4.49 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 422 E 7.75 4.53 0.00 1.92 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 2.19 2.28 0.00 423 G 8.77 3.91 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 0.00 0.00 0.00 424 Y 8.24 5.30 0.00 2.81 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 0.00 425 E 9.11 4.79 0.00 1.87 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 2.26 2.41 0.00 426 V 8.49 3.73 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 1.01 0.00 0.00 0.95 0.00 0.00 427 G 9.43 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 0.00 428 R 7.40 5.17 0.00 1.63 1.84 0.00 3.27 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.69 0.00 429 V 8.54 4.40 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 1.02 0.00 0.00 0.94 0.00 0.00 430 N 8.85 4.72 0.00 2.63 2.64 0.00 0.00 6.98 7.62 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 0.00 431 G 8.79 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 0.00 432 L 8.14 5.30 0.00 1.41 1.44 0.86 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 433 A 9.18 4.73 1.09 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 0.00 434 V 8.12 4.92 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 0.84 0.00 0.00 0.97 0.00 0.00 435 I 8.63 4.65 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 0.95 0.00 0.00 436 G 8.29 3.91 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 0.00 0.00 0.00 437 E 8.76 4.15 0.00 1.97 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 2.31 2.32 0.00 438 S 7.54 4.50 0.00 3.91 3.78 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 0.00 439 A 7.79 4.04 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 0.00 440 G 8.56 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.87 4.84 1.93 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 1.15 1.19 1.00 0.00 0.00 442 V 8.33 3.74 1.15 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 0.15 0.00 0.00 0.43 0.00 0.00 443 L 8.94 4.41 0.00 1.51 1.39 -0.04 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 444 P 0.00 4.94 0.00 2.27 2.47 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 445 I 8.75 4.87 1.75 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.19 0.55 0.00 0.00 446 I 8.54 5.16 1.86 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 1.14 1.97 0.90 0.00 0.00 447 A 9.15 5.26 1.21 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 0.00 0.00 0.00 0.00 0.00 448 E 9.05 4.76 0.00 1.90 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 2.22 2.27 0.00 449 V 8.56 5.16 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 0.76 0.00 0.00 0.95 0.00 0.00 450 T 8.69 4.87 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 1.20 0.00 0.00 451 P 0.00 4.36 0.00 2.10 2.14 0.00 3.77 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 2.01 2.01 0.00 452 S 8.62 4.09 0.00 3.98 3.96 0.00 0.00 0.00 0.00 0.00 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0.00 472 E 8.42 3.89 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 473 A 8.23 4.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 474 V 7.88 3.57 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 0.99 0.00 0.00 1.04 0.00 0.00 475 M 8.44 4.01 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.60 0.00 476 N 8.50 4.69 0.00 2.86 2.88 0.00 0.00 6.85 8.54 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 0.00 477 V 7.96 3.94 2.12 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 0.93 0.00 0.00 1.00 0.00 0.00 478 S 7.91 4.08 0.00 4.02 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 0.00 479 A 7.46 3.96 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 0.00 480 I 7.30 3.78 2.14 0.00 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4.14 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 0.00 514 I 7.72 3.53 2.02 0.00 0.00 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 1.45 0.57 0.88 0.00 0.00 515 A 7.72 4.00 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 8.08 3.79 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 517 A 7.93 3.96 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 0.00 518 V 7.73 3.51 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 1.09 0.00 0.00 0.94 0.00 0.00 519 I 7.92 3.72 1.91 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 0.54 1.02 0.00 0.00 520 S 8.39 4.18 0.00 3.96 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 7.92 3.98 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 2.46 2.43 0.00 530 S 8.31 4.41 0.00 3.95 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 0.00 531 V 6.86 4.75 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 0.73 0.00 0.00 0.92 0.00 0.00 532 A 8.71 4.98 1.18 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 0.00 0.00 533 M 8.19 5.24 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 534 T 9.17 4.69 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 7.95 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 0.00 0.00 0.00 0.00 536 S 8.18 5.28 0.00 3.77 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 0.00 537 L 8.61 4.95 0.00 1.61 1.70 0.98 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 538 S 8.78 4.68 0.00 3.97 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 0.00 539 V 8.59 3.92 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 0.72 0.00 0.00 0.95 0.00 0.00 540 K 7.99 4.06 0.00 1.77 1.91 0.00 1.84 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.50 7.81 541 G 8.92 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 0.00 0.00 0.00 542 E 8.14 4.59 0.00 2.15 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 2.31 2.41 0.00 543 V 8.76 4.63 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 0.79 0.00 0.00 0.89 0.00 0.00 544 L 9.04 4.82 0.00 1.60 1.55 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 545 P 0.00 4.97 0.00 2.06 2.06 0.00 3.72 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 1.98 2.00 0.00 546 V 8.50 4.45 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 0.75 0.00 0.00 0.91 0.00 0.00 547 G 8.44 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 0.00 548 G 8.52 3.91 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 0.00 0.00 0.00 549 V 7.90 3.52 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 1.04 0.00 0.00 0.99 0.00 0.00 550 T 7.86 3.81 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 1.25 0.00 0.00 551 Q 7.99 4.13 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.91 0.00 0.00 0.00 0.00 0.00 2.53 2.49 0.00 552 K 8.32 4.03 0.00 1.75 1.81 0.00 1.78 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.58 7.81 553 I 7.65 3.63 1.97 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 1.49 0.75 0.89 0.00 0.00 554 E 8.44 3.88 0.00 2.08 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 2.21 2.50 0.00 555 A 8.07 3.93 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 0.00 556 A 8.43 3.82 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 0.00 557 I 8.26 3.62 2.03 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 1.42 0.99 0.96 0.00 0.00 558 Q 8.23 4.05 0.00 2.20 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.94 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 559 A 7.71 4.44 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 0.00 560 G 7.87 3.89 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 0.00 0.00 0.00 561 L 7.38 4.17 0.00 1.74 1.56 0.74 1.11 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 0.00 562 K 9.18 4.35 0.00 1.60 1.82 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.54 7.81 563 K 7.84 5.17 0.00 1.61 1.60 0.00 1.59 0.00 0.00 1.85 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.38 7.81 564 V 9.22 4.84 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 0.83 0.00 0.00 0.88 0.00 0.00 565 I 8.98 4.79 1.82 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 1.17 0.65 0.86 0.00 0.00 566 I 8.41 5.10 1.84 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 1.19 0.90 0.88 0.00 0.00 567 P 0.00 4.80 0.00 2.21 1.99 0.00 3.76 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.15 0.00 568 K 9.51 3.81 0.00 1.69 1.99 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.57 7.81 569 D 7.97 4.48 0.00 2.70 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 0.00 570 N 8.15 4.99 0.00 2.93 2.81 0.00 0.00 7.21 7.10 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 0.00 571 I 7.93 3.67 1.86 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 1.63 1.25 0.90 0.00 0.00 572 D 7.98 4.67 0.00 2.76 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 0.00 573 D 7.98 4.52 0.00 2.82 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 0.00 574 V 7.45 3.92 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 0.74 0.00 0.00 0.95 0.00 0.00 575 L 7.93 4.58 0.00 1.62 1.57 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 576 L 7.85 4.69 0.00 1.59 1.56 0.92 1.09 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 0.00 577 D 8.87 4.48 0.00 2.70 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 0.00 578 A 8.12 3.91 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 0.00 579 E 8.26 4.11 0.00 2.03 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 0.00 2.26 2.27 0.00 580 H 8.18 4.38 0.00 3.39 3.38 0.00 5.82 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 581 E 8.07 4.25 0.00 2.16 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 2.35 2.39 0.00 582 G 8.95 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 0.00 0.00 0.00 583 K 7.50 4.28 0.00 2.03 1.87 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.71 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.42 1.54 7.81 584 I 7.20 4.77 1.87 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 1.24 0.79 0.90 0.00 0.00 585 E 9.09 4.33 0.00 2.07 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 2.25 2.24 0.00 586 V 8.34 4.60 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 0.00 587 I 8.66 4.51 1.75 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 1.21 0.82 0.61 0.00 0.00 588 P 0.00 4.99 0.00 2.05 2.03 0.00 3.66 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 589 V 8.75 4.75 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 0.78 0.00 0.00 0.94 0.00 0.00 590 S 9.61 4.72 0.00 3.94 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 0.00 591 R 7.94 5.07 0.00 1.83 1.81 0.00 3.12 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.73 0.00 592 I 8.40 3.64 1.84 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 1.57 1.11 0.85 0.00 0.00 593 N 7.80 3.69 0.00 2.50 2.44 0.00 0.00 6.28 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 7.71 3.85 0.00 2.24 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 2.31 2.27 0.00 595 V 7.69 3.56 2.17 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 1.03 0.00 0.00 0.93 0.00 0.00 596 L 7.60 3.89 0.00 1.66 1.57 0.50 0.91 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 0.00 597 E 7.90 3.87 0.00 1.75 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 2.19 2.57 0.00 598 H 7.92 4.42 0.00 3.34 3.35 0.00 5.79 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 599 V 7.69 4.45 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 0.74 0.00 0.00 0.99 0.00 0.00 600 L 8.18 4.75 0.00 1.59 1.62 0.93 1.11 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 0.00 601 E 9.16 3.75 0.00 1.49 1.69 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 2.01 1.47 0.00 602 D 8.84 4.39 0.00 2.65 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 8.10 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 0.00 604 K 8.11 3.88 0.00 1.87 1.81 0.00 1.61 0.00 0.00 1.81 0.00 0.00 3.29 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.59 7.81 605 K 7.99 3.95 0.00 1.83 1.85 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.50 7.81 606 K 7.97 3.97 0.00 1.91 1.93 0.00 2.02 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.53 7.81 607 N 8.16 4.29 0.00 2.96 2.86 0.00 0.00 6.63 7.80 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 0.00 608 R 7.82 3.89 0.00 2.08 2.05 0.00 3.32 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 609 L 8.17 4.17 0.00 1.94 1.95 1.08 1.14 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 0.00 610 M 8.60 4.30 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.82 0.00 611 S 7.87 4.20 0.00 4.07 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 0.00 612 K 7.90 4.16 0.00 1.84 1.97 0.00 1.67 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.64 7.81 613 F 7.73 4.23 0.00 3.17 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 0.00 614 K 8.06 4.23 0.00 1.87 1.72 0.00 1.99 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.43 7.81 * Residues marked with a * may have inaccurate shift predictions.