NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 535 E 4.1425 8.4449 120.2182 56.1859 30.5371 175.8036 536 E 4.1720 8.3952 125.1953 54.8414 30.2751 175.5331 537 T 3.9229 9.2145 123.7443 66.3771 68.8851 176.6028 538 R 3.8916 7.8570 119.8972 59.1328 30.1211 178.3188 539 E 3.8706 7.9851 118.6591 59.0411 29.6690 178.4549 540 L 3.8513 7.8427 120.3026 58.1649 42.2623 178.4488 541 Q 3.9139 7.9546 119.5104 59.3379 28.7942 178.2775 542 S 4.0301 8.1403 113.9131 61.4883 62.1964 175.9873 543 L 3.9366 7.9552 121.3834 58.1999 41.9709 178.5468 544 A 4.1348 8.4430 119.5399 54.6749 18.3593 178.7501 545 A 4.2523 7.8276 117.4668 52.6354 19.4677 177.8528 546 A 4.1210 6.9800 120.2436 51.9097 19.1093 177.5316 547 V 3.7815 8.0880 119.9843 62.4103 32.3711 176.1306 548 V 4.2148 8.0185 125.5414 60.1250 31.7622 173.7171 549 P 4.4681 0.0000 0.0000 62.1884 31.9982 176.7866 550 S 4.3448 8.4227 114.1040 58.2404 64.3112 175.1589 551 A 3.9572 8.4773 124.0311 55.3368 18.2545 179.7673 552 Q 3.9707 8.0791 117.5487 59.7809 29.0075 178.5032 553 T 3.9523 7.9624 115.6770 66.5080 68.5984 176.0716 554 L 4.2808 7.9714 118.5058 54.7841 42.2216 177.7561 555 K 4.0399 7.8671 117.4241 57.0523 30.1131 177.2357 556 I 3.6030 7.4202 111.6489 62.4542 37.5492 176.7487 557 T 4.2435 7.7990 110.2716 62.4451 69.5799 174.0866 558 D 4.6680 7.8741 123.9861 53.1518 41.7197 177.5874 559 F 4.3141 8.6848 123.1174 60.5800 39.0921 176.2158 560 S 4.5794 8.1115 114.1128 58.1380 62.8590 173.8277 561 F 4.0317 7.9095 123.1777 58.9088 39.4640 174.4359 562 S 4.2746 7.1899 119.8327 56.4173 65.5519 173.0213 563 D 4.7288 7.6171 122.4295 52.8468 39.9066 177.7793 564 F 4.4882 7.2945 120.1595 60.8255 38.8930 176.0588 565 E 4.3221 8.1038 115.4771 56.6905 30.1542 176.1507 566 L 4.7050 7.5971 120.6300 53.8802 43.1003 177.2368 567 S 4.5810 9.3500 118.3219 57.5261 65.7275 175.2839 568 D 4.3827 8.4641 121.1757 57.3485 40.4648 178.7731 569 L 3.9237 7.8165 120.3811 58.2195 42.1902 178.7188 570 E 4.0238 8.2890 118.8042 59.6069 29.3640 179.4771 571 T 3.4242 7.8828 109.6994 64.4262 68.6862 176.5891 572 A 4.0762 7.9949 123.6922 54.9529 18.3963 179.6092 573 L 4.0287 8.1289 117.5879 58.1405 41.6903 179.5030 574 C 4.2343 8.3106 116.7380 63.1743 28.1478 176.3520 575 T 4.1511 8.2638 117.4233 66.6604 68.0328 176.8021 576 I 3.8601 8.0515 121.8221 64.5788 37.1063 178.4498 577 R 3.9204 8.1583 119.4125 59.5042 29.5881 178.5114 578 M 3.4265 7.9234 118.5697 58.2768 31.9761 178.6905 579 F 4.0922 8.3310 117.7072 60.7783 39.0542 177.9562 580 T 3.9696 8.3499 115.3877 66.9465 68.1956 176.5300 581 D 4.6215 8.4399 118.7794 56.2146 40.9079 177.6107 582 L 4.5023 7.5522 118.3328 53.6792 42.0200 175.9671 583 N 4.3670 8.2228 116.5044 54.7182 38.4015 176.0379 584 L 4.3371 8.1264 119.5623 57.3196 41.6072 179.3988 585 V 3.7093 7.9205 117.9906 65.9243 31.4346 177.7305 586 Q 3.8666 8.0016 118.7621 59.4598 28.9426 177.6140 587 N 4.0189 7.9920 116.1455 55.5066 38.6091 176.0184 588 F 4.7914 7.6518 114.2601 56.9505 40.1856 175.9753 589 Q 3.2443 7.6301 116.8472 57.3050 26.2022 174.4014 590 M 4.3286 8.0336 118.0037 54.6595 33.6137 177.9006 591 K 4.2653 8.4023 122.9063 55.8586 34.3059 177.3466 592 H 4.0605 8.8430 123.2852 59.7596 29.7724 177.2371 593 E 3.8528 8.1998 120.2715 59.1313 29.3324 178.8621 594 V 3.7186 7.6486 118.0097 65.8001 31.6778 177.6138 595 L 3.8476 7.8943 120.1141 58.2451 41.8905 178.6751 596 C 4.0458 8.2150 116.9331 62.8502 28.0550 176.1018 597 R 3.8401 8.2205 120.4677 59.0803 29.6049 178.3105 598 W 4.5750 8.3799 129.7246 60.0169 30.6950 177.9422 599 I 3.3910 8.0827 119.8302 64.4443 36.5791 178.4963 600 L 3.7055 7.7431 119.6339 57.6180 41.1041 179.8658 601 S 3.9429 7.6543 114.6245 61.2673 63.0232 176.4309 602 V 3.4164 7.2121 120.9582 65.8307 31.0830 177.6809 603 K 3.3397 7.3332 119.1488 59.4946 31.5505 178.5646 604 K 3.9724 7.7115 118.1686 58.8756 32.2459 176.8320 605 N 4.7069 7.8064 115.8896 53.2014 38.4880 173.8980 606 Y 4.6885 7.4736 115.8885 56.2790 40.4503 175.5192 607 R 4.5331 8.4469 121.6494 54.5669 30.9265 177.9400 608 K 4.1593 8.7436 123.3941 59.3208 32.8458 177.4820 609 N 4.5682 8.1266 114.9111 53.1617 37.8213 174.6562 610 V 4.8942 7.7884 119.2924 60.9406 32.2787 175.0580 611 A 4.2185 10.1837 131.5207 55.2889 18.5223 177.0316 612 Y 4.4958 8.2713 113.0160 59.7159 40.4098 176.5583 613 H 4.3446 8.7444 118.2709 54.5679 27.1589 173.6202 614 N 5.2170 7.2364 119.0511 50.0457 41.0405 175.1805 615 W 3.6659 8.9780 125.8392 61.1764 30.3634 178.4510 616 R 3.5746 7.7843 117.5855 59.2343 29.3273 178.5772 617 H 3.8058 7.8434 117.2493 59.0324 29.7517 177.1846 618 A 3.6837 7.1823 121.9791 54.9435 18.1190 179.1009 619 F 3.4863 7.5421 119.3088 61.3761 39.2818 177.1803 620 N 3.9100 8.0137 116.1968 56.2585 38.2361 177.6392 621 T 3.7501 7.8261 117.4431 66.4250 68.4121 176.5821 622 A 3.9009 7.9585 122.9418 55.1012 18.2980 179.4435 623 Q 3.5175 7.6789 118.2292 59.2802 28.9294 178.0864 624 C 4.1109 8.0409 119.7692 62.4996 31.5922 175.1373 625 M 3.9959 7.9960 119.9094 58.5674 31.7792 177.9302 626 F 3.9635 8.4260 120.7515 61.3178 39.5441 176.9701 627 A 3.5820 8.2929 120.4196 54.8971 18.1627 179.4594 628 A 4.3228 8.4734 119.7871 55.3940 18.4473 179.9281 629 L 4.0483 8.0083 117.5591 58.1016 41.6386 178.4622 630 K 4.0366 8.1088 118.6187 57.7235 31.4702 178.7172 631 A 3.8813 7.7156 126.9833 55.5075 18.6189 179.2648 632 G 4.3166 8.5869 103.2424 45.4248 0.0000 174.0142 633 K 3.8754 7.8617 118.4313 57.5911 30.2662 176.4749 634 I 4.1485 7.1415 117.2426 62.9123 38.2051 178.2277 635 Q 3.9620 8.2391 122.5284 59.2050 28.6879 178.2448 636 N 4.5858 8.1007 111.5861 54.3125 37.4756 175.3065 637 K 4.3196 8.0492 117.9991 56.6609 32.7344 175.9739 638 L 5.0060 7.5968 118.3821 52.3775 45.2774 176.6657 639 T 4.3791 8.6733 111.2965 61.2038 71.1737 175.6352 640 D 4.4970 8.6004 121.1501 57.6427 40.7693 179.1209 641 L 4.0071 8.0077 119.0949 57.7170 41.6164 179.1881 642 E 3.9790 8.2519 118.6230 59.2511 29.3716 179.4959 643 I 3.6977 7.8101 119.9362 64.1920 37.2940 178.0255 644 L 3.8866 8.0822 120.9983 58.2399 41.8531 178.9925 645 A 3.9702 8.1651 120.6712 55.1603 18.2892 179.5688 646 L 3.9722 8.1521 117.7886 57.8143 41.6708 179.6225 647 L 3.9055 7.9704 120.2830 58.1352 42.0454 179.0698 648 I 4.0929 7.7682 119.4824 64.3583 37.0455 178.3018 649 A 4.1271 8.6435 121.8931 55.1376 18.0258 179.4400 650 A 3.9710 8.0067 118.2068 55.5247 18.5398 179.6600 651 L 4.2382 8.0540 116.2022 57.2090 42.1819 178.8296 652 S 4.8446 8.3054 113.3593 58.7885 63.3263 175.5860 653 H 4.4696 8.5663 118.2547 57.7382 28.3682 175.6190 654 D 4.4503 7.8207 120.4108 53.4480 41.6186 175.3002 655 L 2.9114 7.3874 118.8753 56.4875 41.8262 176.8007 656 D 4.4046 8.1730 121.0003 55.1087 40.2432 173.0668 657 H 4.3196 8.0670 116.5501 56.3233 30.1603 175.1913 658 R 4.5254 8.8533 123.5887 55.7822 30.8136 176.7663 659 G 4.1394 8.5631 106.1713 45.7498 0.0000 175.5570 660 V 3.6917 8.9110 116.5202 64.1225 31.6821 176.8465 661 N 4.5583 9.0263 116.3279 53.5454 38.8049 173.9747 662 N 4.8877 8.0124 115.4351 51.5329 39.7566 174.7055 663 S 4.1209 8.6827 118.6291 58.7296 63.3330 173.2614 664 Y 4.1781 8.6113 125.8966 56.5322 39.1058 173.9004 665 I 4.1303 7.5042 127.5207 59.2395 39.6501 175.2312 666 Q 4.2196 9.3937 130.4105 54.5545 27.4291 176.0190 667 R 4.0209 8.0862 123.0407 58.0280 30.4270 177.8350 668 S 4.5345 7.9362 110.7157 58.3561 63.5607 173.4791 669 E 4.8410 7.7590 119.8295 54.3388 32.9222 175.1366 670 H 4.1239 8.7994 120.7084 55.8084 30.3436 174.5049 671 P 4.2004 0.0000 0.0000 65.4895 30.9813 176.9288 672 L 4.3990 8.2275 115.7419 54.8463 42.5849 175.9273 673 A 4.7982 8.0740 121.4035 51.9416 18.9624 176.2619 674 Q 4.8756 7.8925 114.1518 56.2456 30.1962 176.3879 675 L 4.8712 7.4927 115.1166 54.7183 43.1128 176.7249 676 Y 3.9506 8.3233 117.8655 60.2829 38.2249 177.4594 677 C 3.9857 8.3934 114.5018 60.3525 31.0283 172.9729 678 H 4.4780 8.1908 118.2100 57.4123 28.3110 175.3885 679 S 4.0352 7.8087 117.2527 58.2309 61.1526 174.5351 680 I 3.6964 7.6495 122.9935 64.8803 37.4199 177.9722 681 M 2.9953 7.6872 118.3844 58.2270 31.9555 177.9359 682 E 4.0424 7.9762 118.3906 59.6022 29.6662 178.7946 683 H 4.2622 8.3367 116.4390 58.9985 28.7185 177.3341 684 H 4.2178 7.8623 119.9937 59.4824 29.6553 177.0989 685 H 4.1909 8.0474 118.0943 58.8057 28.4631 177.5611 686 F 4.1692 8.5128 122.6446 61.2370 39.2384 176.5442 687 D 4.0910 8.2971 117.7090 57.4706 41.0260 178.3464 688 Q 3.8831 7.9528 118.4173 58.8688 28.5701 178.2821 689 C 4.0321 7.9269 119.6748 62.4902 31.7461 175.3481 690 L 3.7993 7.5908 122.1431 58.3753 41.3270 178.7767 691 M 4.0422 7.7509 117.5764 58.5093 32.1903 178.5607 692 I 3.9056 7.7310 119.8038 64.3769 37.1820 178.5040 693 L 4.2774 8.5356 119.9562 57.1445 41.2139 178.2454 694 N 4.8276 7.7333 113.9874 52.1469 39.7743 175.4903 695 S 4.3317 7.5067 116.9797 56.8252 63.9188 172.0315 696 P 4.3194 0.0000 0.0000 64.5906 31.1362 176.5352 697 G 3.9315 8.9527 108.7187 46.1709 0.0000 173.3459 698 N 5.0789 8.0705 114.7572 52.7829 40.4360 175.0661 699 Q 4.7453 8.0005 119.1810 54.8708 26.4988 176.5123 700 I 3.7914 7.5080 112.8797 62.2794 38.4582 177.6260 701 L 4.5492 7.5804 120.7575 54.3756 42.0038 177.9748 702 S 4.0291 7.8851 115.8176 61.3773 62.6920 175.9301 703 G 3.7985 7.9580 107.2219 46.5540 0.0000 173.5164 704 L 4.5948 7.6347 120.4184 53.9952 42.6365 177.4371 705 S 4.4851 9.1588 117.2495 57.8169 65.2184 175.2606 706 I 3.7365 8.2654 121.6011 64.3808 37.6395 177.7199 707 E 4.0090 8.1745 118.8705 59.4749 29.4125 178.9371 708 E 4.0079 8.0972 118.2065 59.4914 29.4437 178.7531 709 Y 4.0656 8.4148 119.8428 60.7599 38.8877 178.3969 710 K 3.8419 8.3087 119.3583 59.6819 32.1548 179.5245 711 T 3.8214 8.0123 115.9481 66.8956 68.2984 176.8542 712 T 3.7849 8.2218 117.9479 66.6394 68.3876 176.6317 713 L 3.9168 7.8642 121.1634 57.6579 41.5945 179.5422 714 K 3.7998 7.9248 119.4981 59.5551 32.0354 179.0080 715 I 3.7144 7.7714 120.0950 64.2406 36.9463 178.4612 716 I 3.7095 8.0295 121.0581 64.2559 36.9903 178.3354 717 K 3.2811 8.1121 120.6566 59.5195 31.9026 178.9070 718 Q 3.9109 8.0383 117.9411 58.4531 28.3188 178.5465 719 A 3.9317 7.8753 121.6640 55.2119 18.7705 179.4689 720 I 3.8906 8.1426 118.7853 64.5885 37.2380 178.7612 721 L 3.9919 8.0645 119.5681 57.5525 41.1566 179.3215 722 A 4.0834 7.8664 120.1354 54.7186 18.3367 178.9316 723 T 4.2199 7.5712 106.5805 61.9868 68.8666 174.0477 724 D 4.7129 7.9140 123.0072 53.0147 41.3761 176.3890 725 L 4.0748 8.7804 128.9522 58.1267 41.9814 178.4521 726 A 4.0128 8.6636 121.3077 55.3399 18.2873 179.6478 727 L 3.9598 7.9775 117.3381 57.7519 41.6302 179.1034 728 Y 3.9933 7.8588 119.1340 60.8584 38.6324 178.0760 729 I 3.3231 7.7260 119.4915 64.1023 37.2300 178.0774 730 K 3.9952 7.8839 119.6245 58.8218 32.4225 178.1855 731 R 4.2801 7.7205 116.4263 56.1024 30.5596 178.2921 732 R 3.2777 7.3711 119.4037 59.2825 29.9464 178.2302 733 G 3.8372 7.9029 104.1780 48.4445 0.0000 174.6309 734 E 3.9472 8.1821 120.5205 58.9426 29.6203 178.9564 735 F 4.4042 7.7847 119.2519 61.9157 39.3614 177.6066 736 F 4.3571 8.0885 116.9468 60.5259 38.5472 177.5974 737 E 3.9497 8.6724 118.5546 59.5162 29.2785 179.0546 738 L 4.0299 8.7127 119.7227 58.2512 41.6755 179.9837 739 I 3.5336 7.5452 119.1636 64.3379 36.8176 178.3385 740 R 3.8598 7.8538 118.2745 58.4121 29.6917 177.0092 741 K 4.5051 7.4869 116.2110 55.5758 32.5622 175.4986 742 N 4.2374 7.8864 114.1988 54.8738 36.5925 174.9350 743 Q 4.4366 8.1724 114.0753 55.4220 29.7113 175.9726 744 F 4.3833 8.1780 121.0004 58.3277 39.2236 174.0426 745 N 4.5531 10.1134 128.8918 51.3115 39.1587 174.8812 746 L 3.7358 7.8747 128.0824 56.9694 42.3895 177.7492 747 E 4.0117 7.7850 116.6654 58.7214 29.9383 176.8124 748 D 4.4564 7.9709 119.9270 52.8431 42.0270 174.3887 749 P 4.2155 0.0000 0.0000 66.6142 31.0438 177.7388 750 H 4.1222 8.4462 117.9635 59.0755 29.7140 177.2938 751 Q 4.0823 8.2682 119.2871 58.6681 28.4895 178.4675 752 K 4.0347 8.4335 121.2935 59.4525 32.3406 178.5089 753 E 3.9081 8.2772 119.7053 59.1089 29.5120 178.5603 754 L 3.8593 7.8029 120.4231 58.1322 42.0983 178.7806 755 F 4.0700 8.5954 120.8694 61.2127 39.3335 177.1300 756 L 3.7032 8.3026 118.7234 57.4537 41.4631 179.3447 757 A 3.8726 7.7608 120.6668 55.3661 18.2285 179.6422 758 M 3.8005 7.6000 117.2427 58.1704 31.7973 178.7860 759 L 3.6343 7.4841 120.7462 58.1526 42.1036 178.8837 760 M 3.9227 7.7503 118.6283 58.6817 31.9131 178.8961 761 T 3.6695 7.6044 115.2270 66.4543 68.3425 176.4175 762 A 3.6667 7.6551 121.6145 55.4660 18.7487 179.2435 763 C 4.2859 8.2392 115.1909 62.9280 28.0083 175.7664 764 D 4.3796 8.2539 119.0975 56.7054 41.1016 177.3271 765 L 4.6827 7.9491 117.4727 54.6124 42.1217 178.1438 766 S 4.4238 8.2425 116.5560 59.9395 62.6256 176.0158 767 A 4.1119 8.1768 124.5624 55.0567 17.6762 178.6136 768 I 4.0589 8.1464 116.6277 62.8807 38.2716 176.7643 769 T 4.3258 7.7200 108.5565 61.6554 69.4977 174.8592 770 K 4.4686 7.5357 121.9774 55.3809 32.9483 175.5891 771 P 4.3924 0.0000 0.0000 62.5107 33.1430 177.2167 772 W 4.9115 8.9256 131.4124 60.5894 30.1526 176.6568 773 P 4.0715 0.0000 0.0000 65.7645 30.5299 178.4598 774 I 3.9560 7.6451 119.0368 64.3734 37.1943 177.8718 775 Q 4.0668 8.2483 120.4074 59.3685 28.8104 178.4036 776 Q 3.9672 7.8181 119.0384 58.9077 28.6290 179.0632 777 R 4.0308 7.6314 118.2699 59.3908 30.1180 179.2236 778 I 3.9122 8.2838 119.6675 64.3737 37.0876 178.3732 779 A 3.9071 8.5645 122.1220 54.9029 18.1286 179.2623 780 E 3.8959 8.1574 117.9132 59.4394 29.7642 179.0504 781 L 4.0383 7.9678 118.9375 57.8147 41.7168 179.6617 782 V 3.4226 7.5864 117.8149 65.8838 31.4400 177.7122 783 A 4.1581 8.0474 120.4506 55.7177 18.1922 179.6672 784 T 4.1908 8.1318 115.4805 66.3667 68.3283 176.5024 785 E 4.0242 8.1928 120.0100 59.0464 29.7071 178.4359 786 F 4.3451 8.1983 120.0849 61.7782 39.7855 176.1126 787 F 4.4109 8.8337 117.5630 59.0526 38.7946 177.2584 788 D 4.5296 7.9829 112.5942 54.7265 41.0791 176.5880 789 Q 3.1974 8.7967 119.9290 57.2550 27.8288 175.3044 790 G 4.1156 8.4605 101.1195 46.4727 0.0000 175.7263 791 D 4.4782 8.1811 121.3022 56.2595 41.0897 177.7281 792 R 4.5316 7.5670 115.5559 56.2957 31.7599 175.6145 *808 E 4.3225 8.1778 115.6213 56.8571 31.5497 177.1320 809 K 3.6613 7.3647 117.9402 57.7911 31.2838 178.4397 810 K 3.8613 8.5443 125.4936 60.2345 32.5809 177.7880 811 N 4.4029 8.1266 115.5916 55.5701 38.9716 176.3619 812 K 4.3595 8.1564 118.4699 56.9941 32.5949 178.8770 813 I 3.5541 7.2438 121.0649 63.5270 37.0319 176.2079 814 P 4.0292 0.0000 0.0000 66.1858 31.0047 178.4952 815 S 4.1459 8.0303 114.6663 61.4195 62.7998 176.4952 816 M 3.9992 7.8080 120.9069 58.5046 31.5868 178.9194 817 Q 3.8539 7.8631 118.4251 58.6089 28.6478 178.8353 818 V 3.7314 7.8389 119.4936 65.9291 31.5561 178.1917 819 G 3.6897 8.2087 105.5106 47.9512 0.0000 175.3753 820 F 4.3437 8.3335 123.2976 60.9652 39.3111 177.2574 821 I 3.6273 8.1559 119.7341 64.5518 36.7075 178.2438 822 D 4.3081 8.1309 118.3692 57.2879 40.7643 178.3832 823 A 4.2244 8.3075 120.7051 53.9813 17.2454 177.6276 824 I 4.3851 7.7084 115.5134 63.1336 39.8038 177.8233 825 C 3.8952 7.6233 117.1379 62.6277 28.0638 175.3424 826 L 3.9676 8.0220 122.1194 58.7379 41.6225 179.1024 827 Q 3.9620 8.0468 117.0228 58.7192 28.5716 178.6143 828 L 4.2410 7.4332 119.2880 58.6601 41.6848 178.8097 829 Y 4.2133 7.6958 116.2204 60.6026 37.7470 178.3112 830 E 4.0169 8.2067 119.9658 59.3394 29.7170 179.0774 831 A 3.8986 8.1155 120.8712 54.9462 18.3674 179.4783 832 L 4.1929 8.3098 119.0134 58.7464 42.0513 179.3631 833 T 4.1932 8.1252 115.7834 66.8394 68.0950 176.1756 834 H 4.1287 7.8547 119.2380 59.0395 29.9327 177.2491 835 V 4.0630 7.5124 118.9952 64.5448 31.6979 175.9921 836 S 4.4501 8.5567 115.4060 56.4328 64.1363 173.8637 837 E 4.2329 8.8304 128.2904 58.9070 29.3640 178.9589 838 D 4.6639 8.1295 116.2001 56.1396 41.1712 176.8789 839 C 4.3774 8.3699 117.4318 59.5494 28.2942 174.6471 840 F 4.1186 8.2116 124.9078 61.1148 38.8457 175.2682 841 P 3.9608 0.0000 0.0000 65.5394 30.7826 178.4103 842 L 3.5132 7.2308 119.0973 57.1923 41.3477 179.0513 843 L 3.7168 7.2815 119.7765 57.9779 42.1132 178.0813 844 D 4.0618 7.4405 118.4938 57.3437 41.0742 178.5804 845 G 3.8484 7.7125 107.2937 47.3357 0.0000 175.2065 846 C 4.3644 7.5979 122.2905 61.8186 31.4437 175.9276 847 R 3.9228 8.1182 119.9046 59.1899 29.7630 179.2201 848 K 3.9074 8.1855 118.4476 59.4880 31.9214 179.2293 849 N 4.2873 8.1639 116.7553 56.0500 38.3664 177.4656 850 R 4.0495 8.0326 120.2861 59.4989 30.1889 178.4267 851 Q 3.8948 7.8386 119.4036 58.9021 29.0282 178.3096 852 K 3.3860 7.4519 119.1382 59.0251 31.7065 179.4676 853 W 4.6463 8.0875 119.4163 59.8874 28.9873 178.4379 854 Q 4.0266 8.6456 119.7283 58.9238 28.2466 178.0846 855 A 4.2398 7.7287 122.2617 54.8231 18.7277 179.3403 856 L 4.1524 8.0401 117.1565 57.9188 41.4347 179.6851 857 A 4.1299 8.2057 120.4135 55.0252 18.7798 178.7241 858 E 4.3058 8.3155 114.8155 55.2318 29.3708 173.5998 859 Q 3.4434 7.8908 124.7803 55.8061 28.2804 173.7264 860 Q 4.2122 8.6656 120.3451 56.0499 28.9351 175.9596 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 535 E 8.44 4.14 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.29 0.00 536 E 8.40 4.17 0.00 2.04 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 537 T 9.21 3.92 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 1.20 0.00 0.00 538 R 7.86 3.89 0.00 1.83 1.96 0.00 3.12 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 539 E 7.99 3.87 0.00 1.98 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 2.30 2.31 0.00 540 L 7.84 3.85 0.00 1.77 1.78 0.88 0.71 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 0.00 541 Q 7.95 3.91 0.00 2.16 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.54 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 542 S 8.14 4.03 0.00 4.00 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 0.00 543 L 7.96 3.94 0.00 1.66 1.84 0.92 1.24 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 0.00 544 A 8.44 4.13 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 0.00 545 A 7.83 4.25 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 0.00 546 A 6.98 4.12 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 0.00 547 V 8.09 3.78 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 0.81 0.00 0.00 0.94 0.00 0.00 548 V 8.02 4.21 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 0.99 0.00 0.00 0.99 0.00 0.00 549 P 0.00 4.47 0.00 2.25 2.07 0.00 3.86 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 2.02 1.99 0.00 550 S 8.42 4.34 0.00 4.10 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 551 A 8.48 3.96 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 552 Q 8.08 3.97 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.85 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 553 T 7.96 3.95 4.41 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 1.24 0.00 0.00 554 L 7.97 4.28 0.00 1.66 1.81 0.99 0.77 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 0.00 555 K 7.87 4.04 0.00 2.27 2.21 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.60 7.81 556 I 7.42 3.60 1.39 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.36 0.52 0.00 0.00 557 T 7.80 4.24 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 1.40 0.00 0.00 558 D 7.87 4.67 0.00 2.98 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 0.00 559 F 8.68 4.31 0.00 3.06 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 0.00 560 S 8.11 4.58 0.00 3.93 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 0.00 561 F 7.91 4.03 0.00 3.09 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 562 S 7.19 4.27 0.00 3.55 3.36 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 0.00 563 D 7.62 4.73 0.00 2.97 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 564 F 7.29 4.49 0.00 3.04 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 0.00 565 E 8.10 4.32 0.00 2.09 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 2.24 2.26 0.00 566 L 7.60 4.71 0.00 1.80 1.65 1.21 0.78 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 0.00 567 S 9.35 4.58 0.00 4.00 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 0.00 568 D 8.46 4.38 0.00 2.67 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 569 L 7.82 3.92 0.00 1.65 1.65 0.92 0.97 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 0.00 570 E 8.29 4.02 0.00 2.31 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 2.33 0.00 571 T 7.88 3.42 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 0.96 0.00 0.00 572 A 7.99 4.08 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 573 L 8.13 4.03 0.00 1.92 1.77 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 574 C 8.31 4.23 0.00 3.52 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 575 T 8.26 4.15 4.71 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 1.75 0.00 0.00 576 I 8.05 3.86 2.12 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 1.44 0.84 1.00 0.00 0.00 577 R 8.16 3.92 0.00 1.94 2.06 0.00 3.37 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 578 M 7.92 3.43 0.00 1.96 2.23 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 1.69 0.00 579 F 8.33 4.09 0.00 3.39 3.17 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 0.00 580 T 8.35 3.97 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 1.27 0.00 0.00 581 D 8.44 4.62 0.00 2.99 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 582 L 7.55 4.50 0.00 1.74 1.74 1.03 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 583 N 8.22 4.37 0.00 2.99 2.85 0.00 0.00 7.22 6.24 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 0.00 584 L 8.13 4.34 0.00 2.20 2.05 0.82 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 585 V 7.92 3.71 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 1.08 0.00 0.00 1.05 0.00 0.00 586 Q 8.00 3.87 0.00 2.21 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.64 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 587 N 7.99 4.02 0.00 2.22 1.69 0.00 0.00 6.96 7.01 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 0.00 588 F 7.65 4.79 0.00 3.23 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 589 Q 7.63 3.24 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.08 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 590 M 8.03 4.33 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.69 0.00 591 K 8.40 4.27 0.00 1.79 1.72 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.49 7.81 592 H 8.84 4.06 0.00 3.23 3.33 0.00 5.87 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 593 E 8.20 3.85 0.00 2.08 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 2.36 2.36 0.00 594 V 7.65 3.72 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 1.04 0.00 0.00 0.92 0.00 0.00 595 L 7.89 3.85 0.00 1.65 1.68 0.04 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 596 C 8.21 4.05 0.00 3.06 2.90 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 0.00 597 R 8.22 3.84 0.00 1.97 2.18 0.00 3.26 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.61 0.00 598 W 8.38 4.58 0.00 3.57 3.29 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 0.00 599 I 8.08 3.39 1.98 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 1.83 0.90 0.84 0.00 0.00 600 L 7.74 3.71 0.00 1.71 1.55 0.84 0.78 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 0.00 601 S 7.65 3.94 0.00 3.72 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 0.00 602 V 7.21 3.42 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 1.16 0.00 0.00 -0.44 0.00 0.00 603 K 7.33 3.34 0.00 0.79 1.26 0.00 1.16 0.00 0.00 0.61 0.00 0.00 2.58 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.96 0.49 7.81 604 K 7.71 3.97 0.00 1.73 1.84 0.00 1.77 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.41 7.81 605 N 7.81 4.71 0.00 2.62 2.61 0.00 0.00 6.75 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 606 Y 7.47 4.69 0.00 3.20 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 607 R 8.45 4.53 0.00 1.97 2.17 0.00 3.41 0.00 0.00 3.44 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 608 K 8.74 4.16 0.00 1.91 2.00 0.00 1.61 0.00 0.00 1.80 0.00 0.00 3.10 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.40 7.81 609 N 8.13 4.57 0.00 2.89 3.00 0.00 0.00 5.93 7.68 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 0.00 610 V 7.79 4.89 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.14 0.00 0.00 611 A 10.18 4.22 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.27 4.50 0.00 2.86 3.09 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 0.00 613 H 8.74 4.34 0.00 3.00 3.12 0.00 5.85 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 614 N 7.24 5.22 0.00 2.96 3.23 0.00 0.00 5.72 8.88 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 0.00 615 W 8.98 3.67 0.00 3.33 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 0.00 616 R 7.78 3.57 0.00 1.88 2.00 0.00 3.57 0.00 0.00 2.89 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.86 0.00 617 H 7.84 3.81 0.00 2.55 3.07 0.00 5.79 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 0.00 618 A 7.18 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 619 F 7.54 3.49 0.00 1.51 2.45 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 0.00 620 N 8.01 3.91 0.00 2.83 2.75 0.00 0.00 7.07 7.89 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 0.00 621 T 7.83 3.75 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 622 A 7.96 3.90 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 623 Q 7.68 3.52 0.00 1.12 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 1.56 1.16 0.00 624 C 8.04 4.11 0.00 3.04 3.05 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 0.00 625 M 8.00 4.00 0.00 2.31 2.01 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 626 F 8.43 3.96 0.00 3.02 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 627 A 8.29 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 628 A 8.47 4.32 1.55 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 0.00 0.00 629 L 8.01 4.05 0.00 1.64 1.61 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 630 K 8.11 4.04 0.00 1.30 1.35 0.00 1.47 0.00 0.00 1.54 0.00 0.00 2.72 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.48 0.39 7.81 631 A 7.72 3.88 1.04 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 0.00 632 G 8.59 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 633 K 7.86 3.88 0.00 1.93 1.91 0.00 2.02 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.38 1.66 7.81 634 I 7.14 4.15 2.07 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.11 1.20 0.00 0.00 635 Q 8.24 3.96 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.86 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 636 N 8.10 4.59 0.00 2.85 2.93 0.00 0.00 5.98 7.13 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 0.00 637 K 8.05 4.32 0.00 1.93 1.85 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.40 7.81 638 L 7.60 5.01 0.00 1.66 1.73 1.03 1.08 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 0.00 639 T 8.67 4.38 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 1.28 0.00 0.00 640 D 8.60 4.50 0.00 2.91 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 0.00 641 L 8.01 4.01 0.00 1.72 1.69 0.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 642 E 8.25 3.98 0.00 2.22 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 0.00 2.35 2.37 0.00 643 I 7.81 3.70 2.09 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 1.43 0.99 0.93 0.00 0.00 644 L 8.08 3.89 0.00 1.77 1.78 0.89 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 645 A 8.17 3.97 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 0.00 646 L 8.15 3.97 0.00 1.86 1.71 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 647 L 7.97 3.91 0.00 1.60 1.37 0.82 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 648 I 7.77 4.09 1.94 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 1.36 0.90 1.17 0.00 0.00 649 A 8.64 4.13 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 650 A 8.01 3.97 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 684 H 7.86 4.22 0.00 3.13 3.23 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 685 H 8.05 4.19 0.00 3.40 3.35 0.00 5.68 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 686 F 8.51 4.17 0.00 3.14 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 0.00 687 D 8.30 4.09 0.00 2.95 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 0.00 688 Q 7.95 3.88 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 689 C 7.93 4.03 0.00 3.01 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 690 L 7.59 3.80 0.00 1.01 1.44 0.94 0.93 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 0.00 691 M 7.75 4.04 0.00 2.01 2.19 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 2.83 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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 0.60 0.04 0.56 0.00 0.00 701 L 7.58 4.55 0.00 1.85 1.84 0.95 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 702 S 7.89 4.03 0.00 3.96 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 703 G 7.96 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 704 L 7.63 4.59 0.00 1.87 1.70 0.87 0.72 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 0.00 705 S 9.16 4.49 0.00 4.06 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 0.00 706 I 8.27 3.74 1.89 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.27 0.95 0.00 0.00 707 E 8.17 4.01 0.00 2.06 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 2.43 2.37 0.00 708 E 8.10 4.01 0.00 2.34 2.06 0.00 0.00 0.00 0.00 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0.00 0.00 725 L 8.78 4.07 0.00 1.88 1.75 0.94 1.25 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 0.00 726 A 8.66 4.01 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 0.00 727 L 7.98 3.96 0.00 1.90 1.70 0.96 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 728 Y 7.86 3.99 0.00 3.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 729 I 7.73 3.32 1.98 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 1.41 0.84 0.86 0.00 0.00 730 K 7.88 4.00 0.00 1.77 1.93 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.43 7.81 731 R 7.72 4.28 0.00 1.74 1.81 0.00 3.16 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 732 R 7.37 3.28 0.00 1.42 1.25 0.00 3.09 0.00 0.00 2.61 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.65 0.00 733 G 7.90 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 0.00 734 E 8.18 3.95 0.00 2.06 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 2.44 2.39 0.00 735 F 7.78 4.40 0.00 3.00 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 0.00 736 F 8.09 4.36 0.00 3.19 2.88 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 0.00 737 E 8.67 3.95 0.00 2.14 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 2.61 2.52 0.00 738 L 8.71 4.03 0.00 1.97 1.96 1.16 0.35 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 0.00 739 I 7.55 3.53 1.70 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.14 0.36 0.00 0.00 740 R 7.85 3.86 0.00 1.89 2.15 0.00 3.21 0.00 0.00 3.20 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 741 K 7.49 4.51 0.00 1.72 1.77 0.00 1.92 0.00 0.00 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0.00 0.00 791 D 8.18 4.48 0.00 2.80 2.98 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 0.00 792 R 7.57 4.53 0.00 1.75 1.88 0.00 3.29 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 *808 E 8.18 4.32 0.00 1.85 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 2.15 2.28 0.00 809 K 7.36 3.66 0.00 1.68 1.53 0.00 1.58 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.06 1.07 7.81 810 K 8.54 3.86 0.00 1.80 1.84 0.00 1.81 0.00 0.00 1.92 0.00 0.00 3.18 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.62 1.54 7.81 811 N 8.13 4.40 0.00 2.71 2.87 0.00 0.00 6.86 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 812 K 8.16 4.36 0.00 1.84 1.86 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.57 7.81 813 I 7.24 3.55 1.95 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 1.54 0.86 0.40 0.00 0.00 814 P 0.00 4.03 0.00 2.53 2.87 0.00 3.77 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 2.27 2.27 0.00 815 S 8.03 4.15 0.00 3.88 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 0.00 816 M 7.81 4.00 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.56 0.00 817 Q 7.86 3.85 0.00 0.93 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 1.61 1.16 0.00 818 V 7.84 3.73 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.10 0.00 0.00 819 G 8.21 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 820 F 8.33 4.34 0.00 3.08 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 821 I 8.16 3.63 2.08 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.80 0.95 0.00 0.00 822 D 8.13 4.31 0.00 2.78 2.73 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 0.00 823 A 8.31 4.22 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 0.00 824 I 7.71 4.39 1.21 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.26 0.68 0.00 0.00 825 C 7.62 3.90 0.00 2.92 3.12 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 0.00 826 L 8.02 3.97 0.00 1.83 1.67 0.93 1.04 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 0.00 827 Q 8.05 3.96 0.00 2.10 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.69 0.00 0.00 0.00 0.00 0.00 2.07 2.27 0.00 828 L 7.43 4.24 0.00 1.79 1.53 0.99 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 829 Y 7.70 4.21 0.00 3.14 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 0.00 830 E 8.21 4.02 0.00 2.13 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 831 A 8.12 3.90 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 0.00 832 L 8.31 4.19 0.00 2.00 1.98 1.21 0.84 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 0.00 833 T 8.13 4.19 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 834 H 7.85 4.13 0.00 3.13 3.42 0.00 5.76 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 835 V 7.51 4.06 2.42 0.00 0.00 0.00 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 0.90 0.00 0.00 836 S 8.56 4.45 0.00 3.88 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 837 E 8.83 4.23 0.00 2.08 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 0.00 2.39 2.29 0.00 838 D 8.13 4.66 0.00 2.94 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 0.00 839 C 8.37 4.38 0.00 3.23 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 840 F 8.21 4.12 0.00 3.22 3.12 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 0.00 841 P 0.00 3.96 0.00 2.19 2.32 0.00 3.83 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.27 0.00 842 L 7.23 3.51 0.00 1.50 1.05 0.86 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 843 L 7.28 3.72 0.00 1.86 1.55 0.93 1.25 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 0.00 844 D 7.44 4.06 0.00 1.58 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 0.00 845 G 7.71 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 0.00 846 C 7.60 4.36 0.00 2.82 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 0.00 847 R 8.12 3.92 0.00 1.97 1.92 0.00 3.15 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 1.63 1.72 0.00 848 K 8.19 3.91 0.00 1.85 1.74 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.38 1.54 7.81 849 N 8.16 4.29 0.00 3.04 3.19 0.00 0.00 6.63 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 0.00 850 R 8.03 4.05 0.00 1.97 2.06 0.00 3.11 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 851 Q 7.84 3.89 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.59 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 852 K 7.45 3.39 0.00 0.79 0.74 0.00 0.62 0.00 0.00 1.03 0.00 0.00 2.55 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.96 0.21 7.81 853 W 8.09 4.65 0.00 3.49 3.36 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 0.00 854 Q 8.65 4.03 0.00 2.27 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 855 A 7.73 4.24 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 0.00 856 L 8.04 4.15 0.00 2.22 1.97 1.20 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 857 A 8.21 4.13 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 0.00 858 E 8.32 4.31 0.00 2.19 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 2.35 2.72 0.00 859 Q 7.89 3.44 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.88 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 860 Q 8.67 4.21 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.65 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 * Residues marked with a * may have inaccurate shift predictions.