NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 417 K 4.1185 8.3149 120.1021 55.9692 33.1551 175.7909 418 L 3.9815 8.8778 122.4814 54.0839 41.5411 175.9085 419 F 4.8948 8.4736 115.9596 54.5027 39.4098 175.0574 420 I 3.6755 8.5664 127.2302 62.2411 37.0315 176.1555 421 T 4.5675 8.3343 113.8018 61.2280 69.7545 173.2926 422 E 4.5713 7.6637 120.9811 55.7357 33.0270 174.4821 423 G 3.8448 8.3918 110.2911 45.2830 0.0000 171.7950 424 Y 5.3625 7.9027 116.2622 57.9649 42.0708 174.3045 425 E 4.8108 8.6098 119.4658 55.4298 34.0485 174.7041 426 V 3.9324 8.3988 123.7817 63.5890 32.7846 177.1714 427 G 3.9892 9.0894 114.6099 45.7802 0.0000 172.3164 428 R 5.1878 7.4565 120.0378 54.5558 31.7677 175.4585 429 V 4.4956 8.4329 124.5104 61.4254 35.9990 173.7473 430 N 5.0393 8.7767 123.7962 51.9445 39.6570 174.9207 431 G 4.7291 8.5137 112.1862 45.3822 0.0000 171.1554 432 L 5.4195 8.0744 119.4232 52.9815 45.3940 175.7417 433 A 4.5528 8.6573 120.3281 51.2012 23.1530 175.9482 434 V 4.8699 7.8854 113.1133 58.0689 31.9172 174.7943 435 I 3.4211 8.2814 123.7713 60.8307 40.0065 177.4061 436 G 3.6475 8.0705 113.6459 46.4871 0.0000 172.4386 437 E 3.9720 8.1402 120.9421 56.8148 30.3142 177.8339 438 S 4.4272 7.5351 116.7860 59.9268 65.7123 174.8304 439 A 3.6526 6.8584 121.9811 48.2193 17.6005 175.8599 440 G 4.4351 8.4023 110.9378 45.2065 0.0000 172.5547 441 I 4.5282 8.3786 116.0123 58.5244 41.5300 174.3878 442 V 4.2877 7.8123 123.0396 61.8786 32.2322 175.1756 443 L 4.7497 8.5002 131.0080 52.7274 43.4765 173.3191 444 P 4.8585 0.0000 0.0000 62.0909 33.3661 175.1139 445 I 4.7710 8.9947 123.8078 59.6847 40.0638 174.7347 446 I 4.9276 8.7824 126.4532 59.6710 39.5338 174.4574 447 A 5.0410 9.4475 130.6612 50.8153 21.1798 175.4379 448 E 4.7719 8.8437 120.9827 54.9693 33.7009 174.3950 449 V 5.0381 8.3450 118.5666 59.9830 35.4335 174.6545 450 T 4.7202 9.1881 119.5945 59.6084 70.9375 170.7429 451 P 5.0011 0.0000 0.0000 61.4745 32.3308 175.8534 452 S 4.6947 10.7700 120.4940 57.7025 63.8193 174.9963 453 M 4.7940 8.4416 123.0329 54.7301 31.2741 176.4065 *457 E 4.2006 7.9003 119.1582 56.2741 31.7368 175.0233 458 G 4.6981 8.0691 104.6765 44.6256 0.0000 171.5994 459 R 4.8151 9.2760 115.8508 54.6039 33.0639 174.5965 460 V 4.0003 8.3528 121.3177 63.0409 32.7689 175.5692 461 I 4.4912 9.7514 127.4812 59.8446 40.0039 173.9686 462 A 4.9742 8.2332 128.7175 51.4834 22.3505 174.5352 463 T 4.4913 8.6952 104.6928 62.0008 71.8891 175.0790 464 G 3.8146 8.6726 111.0545 44.7823 0.0000 173.8508 465 R 3.9499 8.4549 116.5891 58.5661 30.4076 177.3564 466 L 4.6594 7.4806 116.9011 54.4195 42.2709 178.3778 467 Q 4.1850 8.0328 121.1422 59.3228 28.4155 177.7799 468 E 3.9348 8.2138 120.0013 59.4008 29.5263 178.7121 469 I 3.6680 7.9662 118.9130 64.7842 37.1080 177.9284 470 A 4.0922 8.0343 120.5340 55.5032 18.2904 179.5474 471 R 4.0431 8.5589 116.9566 59.2419 30.2870 178.7043 472 E 3.8323 8.8279 119.0075 59.7089 29.7990 179.4373 473 A 4.0768 8.9769 121.6294 54.9832 18.3837 179.7870 474 V 3.5965 8.6899 118.1523 65.9375 31.5881 177.7116 475 M 3.9675 8.4845 118.5406 58.9901 31.9935 178.1145 476 N 4.3957 8.0671 116.0806 55.9918 38.7708 177.5858 477 V 3.6472 7.6208 120.2182 65.2708 31.2679 178.2380 478 S 4.0678 8.0232 116.2836 61.1799 62.5179 176.5242 479 A 3.9746 7.5308 121.0731 55.5756 18.3133 179.6206 480 I 3.8812 7.5455 117.3661 64.5881 37.1842 178.6182 481 I 3.7340 8.1832 120.9757 64.6247 36.7448 178.4081 482 K 4.0637 8.4608 120.8051 58.2136 31.8926 178.0539 483 K 3.8271 8.2536 119.6604 58.5406 31.1995 177.0764 484 Y 4.2014 8.0485 116.6170 59.4238 38.6231 175.5167 485 T 4.4214 7.8413 116.4790 62.5203 71.0777 175.4224 486 G 4.0597 7.9872 109.0050 45.4916 0.0000 174.0032 487 R 4.0282 7.6704 119.9968 56.0212 30.6751 174.2502 488 D 5.0870 8.6127 123.6729 52.5016 43.3977 176.4852 489 I 4.7880 8.1801 121.8538 60.5770 38.3192 176.3549 490 S 4.4067 8.1831 115.9451 60.5013 63.8829 174.7448 491 N 4.9150 7.5908 118.9992 53.1005 38.5817 173.3331 492 M 5.3265 7.5799 115.3693 53.7800 35.4394 174.9743 493 D 4.6684 9.9867 124.3555 54.2555 42.3437 175.8453 494 V 4.5267 8.3452 121.2588 61.5734 34.4450 174.3496 495 H 4.8882 9.3202 127.6598 54.8792 29.7056 175.0438 496 I 4.5868 8.5387 125.8747 59.4037 38.9521 175.3529 497 Q 4.3817 8.9119 129.3706 55.2330 30.6985 174.2864 498 F 5.2900 8.6830 122.6875 55.7437 41.5714 175.1347 499 V 3.9292 8.8305 123.9244 63.2148 32.0512 176.9737 500 G 3.7229 9.0305 112.5230 45.8607 0.0000 173.4674 501 T 4.0350 7.4461 116.1924 61.6258 67.3368 173.8683 502 Y 4.9750 6.6696 122.3983 54.6682 41.3411 175.1055 503 E 4.5895 8.3504 120.6479 55.6072 32.9554 175.2877 504 G 3.7920 8.7198 111.6190 46.6290 0.0000 173.5258 505 V 4.3989 7.5770 118.1366 61.1483 33.2115 175.5231 506 E 4.4206 8.1347 123.1668 54.5465 30.0843 174.2941 507 G 3.8615 8.2065 113.7780 44.2667 0.0000 171.4795 508 D 4.5341 8.4498 122.1585 53.6482 41.2937 176.7242 509 S 4.1417 8.6324 115.3358 59.2877 63.6615 173.8826 510 A 3.5208 9.4440 121.9615 52.3888 16.6133 176.4373 511 S 5.0455 7.8373 115.3620 59.3564 62.7967 174.6724 512 I 3.6694 9.1350 122.0023 65.2439 37.0518 178.8546 513 S 3.9156 7.2605 115.2219 60.6127 63.4480 176.1240 514 I 3.5587 7.9449 120.8241 64.7894 37.0960 178.1234 515 A 4.0257 8.0537 120.4685 55.9868 18.1962 179.7467 516 T 3.8585 8.8321 114.7244 66.5857 68.4930 176.7060 517 A 4.0040 7.9487 122.8217 55.6470 17.5945 179.4127 518 V 3.6267 7.7521 116.4789 65.6779 31.1022 177.7567 519 I 4.1228 7.9110 118.8821 65.4794 37.1696 177.3999 520 S 4.0939 8.6720 113.4478 60.3729 61.7881 176.0744 521 A 3.9290 8.6330 125.9186 55.3150 18.6535 178.8580 522 I 3.9389 8.8728 117.2846 64.1939 37.5528 176.8748 523 E 4.1995 9.7886 117.5348 57.2272 29.4021 178.9549 524 G 4.1019 6.9172 105.0570 47.7902 0.0000 173.8378 525 I 4.4151 7.2964 123.2756 58.8672 39.7567 174.2202 526 P 4.8002 0.0000 0.0000 62.5714 33.5103 175.1335 527 V 4.8116 8.7095 119.2931 60.7109 34.5464 173.2145 528 D 3.3700 9.2810 128.6512 54.8716 41.6289 176.6772 529 Q 4.5553 8.1556 124.4889 56.2693 29.2050 177.1264 530 S 4.4293 7.9639 114.4553 59.6808 64.1777 173.7462 531 V 5.4473 7.5148 119.0442 60.5758 33.4858 174.1698 532 A 5.0611 8.1493 126.5001 50.7160 23.1914 174.1659 533 M 4.7314 9.1212 114.6068 54.9575 34.7149 173.7306 534 T 4.7613 9.5320 114.4175 59.7186 71.0688 173.1453 535 G 4.2955 7.7529 114.3978 46.4581 0.0000 171.0873 536 S 5.2387 7.9136 115.7695 56.4442 66.7982 173.0999 537 L 5.0215 8.3175 126.6227 53.6180 43.1886 176.6133 538 S 4.6203 8.6542 121.3126 57.3097 64.5042 175.5495 539 V 3.7577 8.1658 113.6222 64.1652 31.4766 177.5726 540 K 4.3191 8.1243 117.1996 56.4996 31.9281 177.2861 541 G 4.0023 8.2527 106.4502 46.2610 0.0000 173.6848 542 E 4.4051 8.5667 119.7444 55.7662 31.0245 176.6396 543 V 4.2461 8.4740 124.5820 62.0432 31.2850 175.5515 544 L 4.5834 8.9469 129.0219 53.4558 43.2873 174.6807 545 P 4.7823 0.0000 0.0000 62.2388 33.2429 175.2614 546 V 4.5244 8.5606 114.3143 59.6489 35.0295 174.7691 547 G 4.0379 8.3212 108.4504 44.3418 0.0000 173.1468 548 G 4.0381 8.5960 103.5829 45.0757 0.0000 175.7029 549 V 3.5230 7.3332 119.7234 66.3406 31.2961 177.8623 550 T 3.8215 7.7972 114.3869 66.8872 68.2888 176.4362 551 Q 3.9985 8.0518 119.2980 58.9173 28.8302 179.1866 552 K 3.9431 7.9647 119.2382 59.5124 32.1394 179.0677 553 I 3.6459 7.5490 119.5878 64.6610 37.0153 177.9002 554 E 3.9535 8.2204 118.8145 59.8989 28.8978 179.7774 555 A 3.9547 8.4756 120.0824 54.6163 18.3800 179.4706 556 A 4.0383 7.9633 119.5735 54.9622 18.4429 179.8423 557 I 3.6324 8.2161 118.8379 64.8162 37.1254 178.6317 558 Q 4.1038 8.2643 116.4826 57.8310 28.6409 176.9895 559 A 4.5594 7.6772 118.6902 51.2717 19.4253 177.7029 560 G 3.9000 8.7507 103.9302 45.6402 0.0000 174.0858 561 L 3.9766 7.6342 119.3156 54.9983 41.9759 177.7700 562 K 4.2941 8.7576 123.7232 58.7859 33.1359 176.6638 563 K 5.0350 8.8553 118.6770 55.2149 36.8430 175.5446 564 V 4.7663 8.9311 120.7330 60.0853 34.1550 174.4662 565 I 4.6897 9.4909 127.8000 60.0550 38.9168 174.9645 566 I 4.9426 8.5733 118.9174 58.2275 41.4922 173.0358 567 P 4.5297 0.0000 0.0000 62.7289 32.1164 177.3145 568 K 3.9410 8.7654 123.9512 59.9472 32.0233 178.9037 569 D 4.4809 8.2054 116.9213 57.1724 40.9281 177.7051 570 N 4.6798 7.7301 115.4465 53.5434 38.6612 176.7906 571 I 3.7216 8.2953 123.9427 64.2037 37.0932 177.0661 572 D 4.6775 7.9181 115.2988 54.0562 39.8581 176.2043 573 D 4.6877 7.5134 118.7051 54.3057 41.3548 177.8711 574 V 3.8395 7.1186 119.9638 62.8345 29.7486 176.1444 575 L 4.3326 8.2867 130.2571 53.5140 39.7727 177.1526 576 L 4.5256 7.3734 118.5261 53.2795 43.5969 177.3801 577 D 4.6875 8.4611 127.6634 53.3457 40.7203 175.7269 578 A 4.4324 8.4297 118.8969 53.3862 20.2079 178.5196 579 E 4.0691 8.3497 116.2153 59.7077 29.8603 177.3275 580 H 4.7172 12.0000 113.1133 55.8993 28.6961 176.3521 581 E 4.3956 9.2612 121.8996 53.3948 27.8769 174.0085 582 G 3.2505 7.7795 114.5070 45.0676 0.0000 172.1624 583 K 4.2871 7.7637 122.3081 57.2245 33.1955 176.8442 584 I 4.3374 7.2716 116.3548 59.2658 41.1917 173.2719 585 E 3.9030 8.4990 129.0643 57.0408 30.5069 175.5622 586 V 4.4526 8.2864 127.7555 61.9154 32.9066 175.2202 587 I 4.2644 8.7356 130.1523 59.0408 38.4068 173.2087 588 P 4.8523 0.0000 0.0000 62.3725 32.1007 176.6896 589 V 4.4731 8.8436 117.8694 59.8639 35.2799 176.3060 590 S 4.5692 9.6991 119.4557 59.3667 64.2170 174.0569 591 R 5.0552 7.9857 117.2444 53.3285 34.1060 175.3672 592 I 3.6522 8.3601 121.5727 64.5488 37.1578 177.9918 593 N 3.8949 8.0502 117.2664 55.8116 37.3591 177.0078 594 E 4.0881 8.0196 120.5577 58.8761 29.4154 178.9253 595 V 3.6072 7.4505 117.2612 66.3277 31.7488 177.8712 596 L 4.0632 7.9944 118.3818 57.7997 41.3157 179.0023 597 E 3.8777 8.7830 117.7579 59.3987 29.4397 178.5204 598 H 4.9534 7.6091 112.1269 55.7211 29.3951 175.5091 599 V 4.5337 8.0377 113.1064 61.4587 36.1947 175.6699 600 L 4.4502 8.1307 119.3074 54.9912 42.4028 176.2891 601 E 4.4209 8.0994 123.0974 54.6882 30.5428 175.4279 602 D 4.2847 8.8848 127.2411 55.4711 40.9378 176.1610 603 G 3.9269 7.7811 111.8302 44.7793 0.0000 172.7031 604 K 4.1338 8.0815 117.3345 58.3650 31.7509 178.8190 605 K 4.2065 7.8549 117.9483 57.7218 33.1762 177.9190 606 K 3.8640 8.0252 119.4256 60.2079 31.7527 178.1425 607 N 4.3842 7.9220 115.0177 56.2543 38.2289 177.7331 608 R 4.0278 7.5426 118.8653 59.3209 30.4433 177.4868 609 L 4.1056 9.9828 121.3419 56.4962 41.6990 178.1831 610 M 3.9094 8.9105 119.6350 58.8496 32.2307 179.1683 611 S 4.2162 7.6914 113.3267 61.2641 63.5080 176.4347 612 K 4.2279 8.1659 120.5949 57.8897 32.0568 177.6093 613 F 4.7033 7.6871 118.4844 56.5574 40.0987 175.8665 614 K 4.1684 7.9031 122.9256 57.0663 32.9640 176.1648 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 4.12 0.00 1.33 1.28 0.00 1.26 0.00 0.00 1.32 0.00 0.00 2.75 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 418 L 8.88 3.98 0.00 1.95 1.89 0.98 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 419 F 8.47 4.89 0.00 3.14 2.97 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 0.00 420 I 8.57 3.68 2.05 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 1.50 0.58 0.95 0.00 0.00 421 T 8.33 4.57 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 1.30 0.00 0.00 422 E 7.66 4.57 0.00 1.89 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 2.23 0.00 423 G 8.39 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 424 Y 7.90 5.36 0.00 2.76 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 0.00 425 E 8.61 4.81 0.00 1.86 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 2.30 2.22 0.00 426 V 8.40 3.93 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 0.96 0.00 0.00 0.96 0.00 0.00 427 G 9.09 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 0.00 428 R 7.46 5.19 0.00 1.83 1.83 0.00 3.25 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.56 0.00 429 V 8.43 4.50 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 0.93 0.00 0.00 0.95 0.00 0.00 430 N 8.78 5.04 0.00 2.86 2.76 0.00 0.00 6.88 7.95 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 0.00 431 G 8.51 4.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 432 L 8.07 5.42 0.00 1.42 1.50 0.90 0.93 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 0.00 433 A 8.66 4.55 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 7.89 4.87 2.04 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 0.65 0.00 0.00 0.90 0.00 0.00 435 I 8.28 3.42 1.79 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 1.30 0.70 0.80 0.00 0.00 436 G 8.07 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 437 E 8.14 3.97 0.00 1.93 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 438 S 7.54 4.43 0.00 3.85 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 439 A 6.86 3.65 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 440 G 8.40 4.44 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 0.00 441 I 8.38 4.53 1.22 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.65 0.48 0.00 0.00 442 V 7.81 4.29 1.58 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 0.69 0.00 0.00 0.82 0.00 0.00 443 L 8.50 4.75 0.00 1.86 1.53 1.09 0.76 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 0.00 444 P 0.00 4.86 0.00 2.19 2.19 0.00 3.90 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.17 0.00 445 I 8.99 4.77 1.80 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.38 0.60 0.00 0.00 446 I 8.78 4.93 1.84 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 1.16 0.73 0.90 0.00 0.00 447 A 9.45 5.04 1.19 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 0.00 0.00 448 E 8.84 4.77 0.00 2.08 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 2.19 2.36 0.00 449 V 8.35 5.04 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 0.75 0.00 0.00 0.95 0.00 0.00 450 T 9.19 4.72 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 1.27 0.00 0.00 451 P 0.00 5.00 0.00 2.10 2.07 0.00 3.59 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 1.96 2.08 0.00 452 S 10.77 4.69 0.00 4.05 4.16 0.00 0.00 0.00 0.00 0.00 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0.00 472 E 8.83 3.83 0.00 2.09 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 2.34 2.40 0.00 473 A 8.98 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 0.00 474 V 8.69 3.60 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 0.99 0.00 0.00 0.95 0.00 0.00 475 M 8.48 3.97 0.00 2.25 2.07 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 2.61 2.61 0.00 476 N 8.07 4.40 0.00 2.92 2.87 0.00 0.00 6.84 6.99 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 0.00 477 V 7.62 3.65 2.35 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 1.02 0.00 0.00 0.99 0.00 0.00 478 S 8.02 4.07 0.00 4.24 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 0.00 479 A 7.53 3.97 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 0.00 480 I 7.55 3.88 2.22 0.00 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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 0.00 514 I 7.94 3.56 2.08 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.52 0.89 0.00 0.00 515 A 8.05 4.03 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 0.00 516 T 8.83 3.86 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 1.19 0.00 0.00 517 A 7.95 4.00 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 0.00 518 V 7.75 3.63 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 1.07 0.00 0.00 0.99 0.00 0.00 519 I 7.91 4.12 2.01 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 1.50 0.83 0.94 0.00 0.00 520 S 8.67 4.09 0.00 3.99 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 0.00 521 A 8.63 3.93 1.36 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 2.47 2.43 0.00 530 S 7.96 4.43 0.00 3.92 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 0.00 531 V 7.51 5.45 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 0.87 0.00 0.00 0.91 0.00 0.00 532 A 8.15 5.06 1.19 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 0.00 0.00 533 M 9.12 4.73 0.00 2.00 2.11 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 2.47 2.59 0.00 534 T 9.53 4.76 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 0.00 535 G 7.75 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 0.00 536 S 7.91 5.24 0.00 3.83 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 537 L 8.32 5.02 0.00 1.64 1.59 0.95 1.44 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 8.65 4.62 0.00 4.08 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 0.00 539 V 8.17 3.76 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 0.94 0.00 0.00 540 K 8.12 4.32 0.00 1.78 1.87 0.00 1.85 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.46 7.81 541 G 8.25 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 0.00 0.00 0.00 542 E 8.57 4.41 0.00 1.88 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 2.36 2.42 0.00 543 V 8.47 4.25 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 0.94 0.00 0.00 544 L 8.95 4.58 0.00 1.63 1.57 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 545 P 0.00 4.78 0.00 2.12 2.04 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 1.94 1.99 0.00 546 V 8.56 4.52 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 0.72 0.00 0.00 0.98 0.00 0.00 547 G 8.32 4.04 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 0.00 0.00 0.00 548 G 8.60 4.04 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 0.00 0.00 0.00 549 V 7.33 3.52 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 1.01 0.00 0.00 0.97 0.00 0.00 550 T 7.80 3.82 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 1.26 0.00 0.00 551 Q 8.05 4.00 0.00 2.04 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.91 0.00 0.00 0.00 0.00 0.00 2.56 2.46 0.00 552 K 7.96 3.94 0.00 2.04 1.82 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.61 1.62 7.81 553 I 7.55 3.65 1.99 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 1.51 0.71 0.92 0.00 0.00 554 E 8.22 3.95 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 2.35 2.57 0.00 555 A 8.48 3.95 1.24 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 0.00 0.00 0.00 556 A 7.96 4.04 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 0.00 557 I 8.22 3.63 2.10 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 1.52 0.92 0.88 0.00 0.00 558 Q 8.26 4.10 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 559 A 7.68 4.56 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 560 G 8.75 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 0.00 561 L 7.63 3.98 0.00 1.65 1.81 1.06 1.09 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 0.00 562 K 8.76 4.29 0.00 1.66 1.85 0.00 1.65 0.00 0.00 1.86 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.38 7.81 563 K 8.86 5.03 0.00 1.76 1.90 0.00 1.20 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.34 7.81 564 V 8.93 4.77 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 0.92 0.00 0.00 0.91 0.00 0.00 565 I 9.49 4.69 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 1.19 0.52 0.94 0.00 0.00 566 I 8.57 4.94 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 1.28 0.98 0.90 0.00 0.00 567 P 0.00 4.53 0.00 2.37 2.09 0.00 3.65 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.08 0.00 568 K 8.77 3.94 0.00 1.95 1.80 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.49 7.81 569 D 8.21 4.48 0.00 2.68 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 0.00 570 N 7.73 4.68 0.00 2.98 2.83 0.00 0.00 6.82 6.80 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 0.00 571 I 8.30 3.72 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 1.51 1.75 0.91 0.00 0.00 572 D 7.92 4.68 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 7.51 4.69 0.00 2.65 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 7.12 3.84 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 0.75 0.00 0.00 1.05 0.00 0.00 575 L 8.29 4.33 0.00 1.66 1.62 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 576 L 7.37 4.53 0.00 1.61 1.62 0.98 1.23 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 0.00 577 D 8.46 4.69 0.00 2.76 2.64 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 0.00 0.00 0.00 0.00 578 A 8.43 4.43 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 0.00 579 E 8.35 4.07 0.00 1.98 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 580 H 12.00 4.72 0.00 3.37 3.29 0.00 5.71 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 581 E 9.26 4.40 0.00 2.16 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 2.24 2.29 0.00 582 G 7.78 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 0.00 0.00 0.00 583 K 7.76 4.29 0.00 1.70 1.81 0.00 1.76 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.23 7.81 584 I 7.27 4.34 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 1.21 0.69 0.90 0.00 0.00 585 E 8.50 3.90 0.00 2.17 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 586 V 8.29 4.45 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 0.83 0.00 0.00 0.96 0.00 0.00 587 I 8.74 4.26 1.76 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.33 0.70 0.00 0.00 588 P 0.00 4.85 0.00 1.94 2.00 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 589 V 8.84 4.47 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 0.91 0.00 0.00 1.01 0.00 0.00 590 S 9.70 4.57 0.00 3.86 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 591 R 7.99 5.06 0.00 2.01 1.76 0.00 3.23 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 592 I 8.36 3.65 1.92 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 1.40 1.06 0.00 0.00 593 N 8.05 3.89 0.00 2.69 2.83 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 8.02 4.09 0.00 2.10 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 2.37 2.34 0.00 595 V 7.45 3.61 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 0.81 0.00 0.00 0.99 0.00 0.00 596 L 7.99 4.06 0.00 1.64 1.50 0.50 1.11 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 0.00 597 E 8.78 3.88 0.00 2.01 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 2.33 2.44 0.00 598 H 7.61 4.95 0.00 3.45 3.22 0.00 5.63 0.00 0.00 0.00 0.00 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 599 V 8.04 4.53 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 0.78 0.00 0.00 1.02 0.00 0.00 600 L 8.13 4.45 0.00 1.67 1.62 0.86 0.90 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 0.00 601 E 8.10 4.42 0.00 2.00 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 2.06 1.82 0.00 602 D 8.88 4.28 0.00 2.62 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 603 G 7.78 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 604 K 8.08 4.13 0.00 1.80 1.87 0.00 1.64 0.00 0.00 1.81 0.00 0.00 3.14 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.51 7.81 605 K 7.85 4.21 0.00 1.79 1.84 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.46 7.81 606 K 8.03 3.86 0.00 1.80 2.00 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.55 7.81 607 N 7.92 4.38 0.00 2.82 2.85 0.00 0.00 7.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 608 R 7.54 4.03 0.00 1.89 2.02 0.00 3.18 0.00 0.00 3.17 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 609 L 9.98 4.11 0.00 1.93 1.70 1.19 0.96 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 0.00 610 M 8.91 3.91 0.00 1.97 2.18 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.73 0.00 611 S 7.69 4.22 0.00 4.04 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 0.00 612 K 8.17 4.23 0.00 1.91 2.18 0.00 1.85 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.67 7.81 613 F 7.69 4.70 0.00 2.80 2.85 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 0.00 614 K 7.90 4.17 0.00 1.73 1.67 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.65 7.81 * Residues marked with a * may have inaccurate shift predictions.