NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 541 P 4.3587 0.0000 0.0000 62.5745 33.4609 177.4757 542 G 3.9122 7.9718 104.3361 43.9807 0.0000 172.1010 543 S 4.7371 7.8186 113.6904 57.5889 64.3093 171.6353 544 S 5.3036 7.6479 113.0009 57.3183 65.9126 173.4605 545 V 4.8535 9.0179 114.5345 59.9755 36.0850 174.3898 546 S 5.2342 8.5029 115.2002 57.6917 66.3281 172.8896 547 G 4.0664 9.1722 106.6494 46.0814 0.0000 171.9807 548 T 5.2643 7.9253 116.5880 61.6299 70.7700 174.1847 549 F 4.9361 9.7146 124.4872 55.9880 43.5873 174.9978 550 G 4.3285 8.5319 110.9634 43.8823 0.0000 173.3412 551 C 4.3544 8.2293 112.0317 59.9324 30.1133 175.1022 552 L 4.4983 7.4820 119.4001 54.4910 42.3364 178.0638 553 G 4.1414 8.3963 108.5253 46.4789 0.0000 172.4599 554 G 4.3953 7.3430 107.6734 44.5953 0.0000 170.7959 555 R 4.8782 8.6606 119.7216 54.3459 33.5662 174.0757 556 L 5.3297 8.9038 128.2543 53.8355 44.7057 175.1562 557 T 5.0105 9.0115 121.7594 62.1467 73.3534 173.1319 558 I 4.4405 8.4099 127.3338 59.0878 37.9679 173.6647 559 P 4.1755 0.0000 0.0000 64.0879 31.6391 177.1931 560 G 3.9642 9.0581 110.1966 45.8925 0.0000 173.7588 561 T 4.3867 7.7423 108.8578 60.6068 70.5457 175.5443 562 G 3.8429 8.4604 108.3138 44.6890 0.0000 172.5141 563 V 4.9468 7.8987 120.9185 60.7897 33.0819 174.9192 564 S 5.0152 8.3918 120.6718 57.0467 66.8733 172.5390 565 L 4.9717 9.1401 123.4061 53.3237 44.6536 174.7329 566 L 4.7613 8.9788 129.9276 53.7627 43.8846 175.2816 567 V 4.4078 8.8406 127.8969 60.6030 32.8660 173.4106 568 P 4.7525 0.0000 0.0000 61.5224 33.3061 175.6405 569 N 4.4181 8.2203 119.2845 55.8543 38.8892 175.7210 570 G 4.0039 9.2282 113.9517 45.3068 0.0000 174.1847 571 A 4.1639 7.8995 123.0118 54.4556 18.5611 177.7946 572 I 4.2278 7.3805 116.8658 58.9900 38.6034 173.5759 573 P 4.2581 0.0000 0.0000 62.6369 31.7931 175.8391 574 Q 4.0639 8.4223 120.8089 57.4766 29.0206 177.3615 575 G 3.7185 8.5392 109.0138 45.6210 0.0000 173.1325 576 K 4.4502 7.2666 118.9713 54.5247 35.2258 175.3320 577 F 5.2017 8.4575 119.4192 56.1902 42.7380 173.7686 578 Y 5.1638 9.4528 121.2885 56.3971 41.0262 174.5657 579 D 5.3209 9.0026 123.9089 53.6931 41.6952 175.7570 580 L 5.3543 9.6411 124.0873 53.0843 45.7901 175.1291 581 Y 5.5104 8.9279 118.4527 55.5124 42.3198 173.9302 582 L 5.0840 9.1822 121.5283 53.7067 45.8039 174.7904 583 R 5.1680 9.3854 126.1786 54.8082 34.0073 173.5057 584 I 4.7415 8.5112 126.7788 60.5649 38.1402 175.4400 585 N 4.8871 8.8710 124.5743 51.5707 40.3573 175.2984 586 K 3.8050 8.7139 119.2791 57.4341 32.6946 178.0561 587 T 3.8422 8.8026 119.7707 66.7334 68.7684 175.4965 588 E 4.2839 8.0885 119.0841 57.3722 30.0211 178.0707 589 S 4.3952 8.1753 113.5337 60.2009 63.4233 174.9223 590 T 4.4843 7.7480 110.6066 61.1367 69.2363 175.4684 591 L 3.8900 7.9601 126.4740 58.2397 42.0083 177.5131 592 P 4.2764 0.0000 0.0000 64.9693 31.2925 176.8642 593 L 4.2387 8.1202 116.5026 55.1095 41.9042 177.3456 594 S 4.7646 7.6407 116.2481 56.1201 62.4467 172.3796 595 E 4.6734 8.8639 120.6422 55.9052 33.7869 176.2143 596 G 3.5295 8.0938 111.0865 46.8547 0.0000 176.7640 597 S 4.4169 8.7089 121.5995 59.8535 62.9904 173.3214 598 Q 4.6699 8.2390 121.8792 55.5320 30.0601 174.9132 599 T 4.6871 8.8685 117.3205 60.2701 71.5448 172.3556 600 V 4.2738 8.0502 126.2785 62.0104 32.1650 175.6458 601 L 4.5760 8.9805 127.2593 54.9280 43.7043 176.0453 602 S 5.2792 8.0276 111.4903 53.9629 66.4583 172.0646 603 P 4.4442 0.0000 0.0000 62.9710 32.0098 175.7062 604 S 4.6602 8.5894 116.2281 58.1908 63.8407 172.8342 605 V 4.9348 9.0825 126.5133 61.5040 34.9306 173.9046 606 T 5.1874 9.1549 124.8090 61.9210 71.0894 173.1496 607 C 4.8764 8.5674 120.9390 56.7200 32.9246 173.8283 608 G 4.2160 6.9828 106.3251 45.8768 0.0000 171.1712 609 P 4.9082 0.0000 0.0000 62.5867 32.1034 176.0216 610 T 4.0826 8.0894 109.7843 62.0231 69.5355 174.8577 611 G 3.9283 8.9030 109.5755 45.1711 0.0000 173.2591 612 L 4.3070 7.1852 118.8389 52.6962 43.0720 175.9733 613 L 4.2024 8.4317 124.6903 54.7884 42.4833 175.8821 614 L 5.0284 8.4469 125.9540 53.4286 43.6873 176.2803 615 C 4.4316 9.0436 120.4337 60.9102 28.8660 173.9676 616 R 4.7185 7.4718 116.1356 53.4226 33.8278 172.8231 617 P 4.7304 0.0000 0.0000 63.0966 32.3597 176.2333 618 V 4.3883 8.4592 115.0464 59.9201 35.1404 174.9906 619 V 4.7016 8.5227 122.0363 61.2949 33.6854 173.9934 620 L 4.8851 8.9883 131.5682 54.0828 43.7367 174.9928 621 T 5.0318 8.8068 123.8908 62.1097 70.7184 174.2684 622 V 4.7833 8.2908 118.8678 58.7502 36.1825 173.5921 623 P 4.8998 0.0000 0.0000 62.8793 33.0754 174.2941 624 H 5.8481 8.8353 115.9444 52.9183 32.2103 172.5233 625 C 4.8339 8.4557 110.4119 57.9556 30.8146 173.0047 626 A 4.4364 8.1392 120.6606 51.9124 19.2958 177.8537 627 E 4.2680 8.9673 121.8066 56.0107 29.4457 177.1658 628 V 3.9745 8.8395 127.6255 66.5230 32.2318 177.8151 629 I 4.0035 8.1418 115.5406 62.9664 36.0997 179.1633 630 A 4.5968 8.0342 122.5210 50.4390 17.3015 177.4864 631 G 4.0361 8.7443 106.2118 45.7979 0.0000 172.2414 632 D 4.5092 8.4241 119.8362 53.8731 41.2054 176.1117 633 W 4.6162 8.5130 123.5833 54.7755 32.3301 175.4011 634 I 4.2421 8.5285 124.1086 60.0134 38.1905 174.8635 635 F 5.0564 8.4796 126.2081 56.5838 41.1754 175.1818 636 Q 4.8910 8.5218 120.3632 54.4404 33.8099 173.2652 637 L 5.0854 8.8251 125.4537 53.7406 44.0005 175.3537 638 K 5.2310 9.1192 125.2419 54.9686 35.8550 174.9760 639 T 5.5259 9.3605 116.5578 59.3319 71.3837 172.6178 640 Q 4.6059 8.2463 126.5512 53.1853 29.7659 174.9486 641 A 4.0348 8.5721 130.1789 54.7792 18.9667 176.7804 642 H 4.8670 7.2646 108.8913 53.2116 31.8263 172.3750 643 Q 3.9866 8.5724 118.2687 58.0855 28.6975 178.1779 644 G 3.8988 8.8863 109.8038 45.6905 0.0000 172.2976 645 H 4.6704 7.7233 119.2517 53.8193 31.7614 171.9551 646 W 5.2439 8.5349 126.1690 55.0571 31.9211 174.8639 647 E 4.9008 9.1672 121.5350 54.4217 34.0113 174.6151 648 E 4.5152 8.7412 120.9425 56.9002 29.8043 177.3514 649 V 4.0549 9.1968 125.8128 65.4422 32.2400 176.4438 650 V 4.5435 7.5547 117.7220 60.9058 34.7842 172.1842 651 T 4.9226 8.3359 119.2786 61.7850 70.3502 174.4092 652 L 4.3901 8.4921 127.3487 56.7533 42.0320 177.2852 653 D 4.8878 9.6391 123.1398 54.3717 39.2501 174.9931 654 E 4.5889 7.8008 117.0643 55.7647 29.9847 175.9867 655 E 3.7296 7.8614 118.8325 56.8969 29.7817 176.1454 656 T 4.8086 8.3001 111.8233 59.2555 71.7725 174.8448 657 L 4.2588 8.6392 120.5039 57.2917 41.6012 178.1768 658 N 4.6771 8.0376 114.5907 53.9940 39.2501 175.5952 659 T 3.8764 7.5236 115.3883 64.1289 68.9307 171.4792 660 P 5.3146 0.0000 0.0000 62.1067 32.6590 174.7191 661 C 5.0206 7.8360 113.3507 57.8157 33.1422 172.3641 662 Y 4.2766 8.2897 120.0421 55.9600 41.3871 173.9226 663 C 4.2308 8.0466 125.2490 58.5554 28.9384 173.6416 664 Q 3.8068 8.5337 127.9650 54.9505 29.2548 174.4432 665 L 4.1323 8.0923 129.7414 54.0200 42.7271 175.8273 666 E 4.4875 8.6525 126.6891 54.1571 31.9261 176.9379 667 A 4.0120 8.5608 121.9791 55.2130 18.3616 178.3973 668 K 4.5137 7.4896 108.6128 55.7602 34.7649 176.0530 669 S 4.7410 7.4397 114.0754 57.3558 66.9193 172.2136 670 C 4.7698 8.8125 120.6110 57.7053 34.2566 172.1988 671 H 4.8657 8.8902 123.7890 54.4363 30.3813 173.8068 672 I 4.5424 8.5339 126.3903 59.3127 38.8399 175.4030 673 L 4.7237 8.8102 129.1943 54.4462 42.9230 176.2280 674 L 4.9195 9.0252 124.1002 53.0332 44.2861 177.4569 675 D 4.7544 9.1495 123.7711 56.5028 41.9198 176.3332 676 Q 4.5977 7.8328 114.1184 54.1660 31.6001 174.2679 677 L 4.3916 8.3982 119.4105 53.8788 42.8742 177.3413 678 G 3.6944 7.2923 105.3581 46.0658 0.0000 170.5574 679 T 4.9663 7.3726 116.1822 62.3791 70.4085 173.8654 680 Y 5.7021 9.2677 123.3417 56.5821 42.9692 174.6196 681 V 4.7605 9.0110 120.4269 60.2912 35.5438 173.3202 682 F 5.2151 9.1713 126.3965 57.1834 40.8601 174.6416 683 T 4.7857 8.4145 116.0228 59.8541 72.4772 172.9426 684 G 4.4995 8.5894 108.3175 44.7083 0.0000 171.5349 685 E 5.4609 9.2546 120.1845 54.7963 33.3021 174.3261 686 S 4.7775 8.5765 113.6377 58.1184 65.5227 174.2213 687 Y 4.4592 8.6590 121.7049 57.6685 39.0558 176.1868 688 S 4.1198 7.9233 116.8040 58.0698 62.7569 175.2009 689 R 3.9774 8.3945 125.9429 58.0190 30.1530 177.5802 690 S 4.3376 7.8494 113.1993 59.1778 63.7574 173.9371 691 A 4.0083 7.4309 123.8052 51.7736 19.1788 176.6855 692 V 5.2167 8.9179 121.7654 60.9922 35.1429 174.4421 693 K 5.3046 9.7667 126.2667 55.4349 36.1917 174.7447 694 R 4.9994 9.2102 120.4951 54.7681 32.1768 175.7169 695 L 5.3727 9.3331 123.4269 52.8697 45.7717 175.2097 696 Q 5.0758 9.2141 118.6936 54.5068 31.9172 174.1510 697 L 5.3569 9.3996 122.5179 53.1596 44.2060 175.2032 698 A 4.9947 8.9273 125.3497 50.1081 22.2806 174.4680 699 I 4.9539 8.0604 122.8310 59.4906 40.0294 174.7574 700 F 5.2018 9.5740 124.8941 55.6149 42.6428 174.1460 701 A 5.1185 8.1346 121.9523 49.1294 22.8616 173.7268 702 P 4.8513 0.0000 0.0000 62.8840 31.6083 176.7317 703 A 4.1349 9.1778 126.4575 54.1230 18.6451 177.5915 704 L 4.6333 7.9018 117.2470 53.2740 43.6438 174.8885 705 C 4.8557 8.7433 125.7207 58.0025 33.5723 172.9753 706 T 4.4349 8.5991 116.4588 61.9673 70.2424 174.7268 707 S 4.5760 7.8125 117.6257 57.4615 64.1565 173.8562 708 L 4.1504 8.2333 120.1488 57.1842 42.4385 177.1543 709 E 4.8660 8.1559 120.3469 56.2171 30.4141 175.2852 710 Y 5.1984 9.1460 126.7191 56.2819 42.8378 173.8560 711 S 5.0177 7.9367 119.5005 56.7214 67.3985 173.1084 712 L 4.7196 8.8338 123.1743 52.9468 44.7468 175.5741 713 R 4.7651 9.0282 123.1590 54.6149 32.4559 175.4916 714 V 4.5031 8.5247 125.9192 61.4500 32.9382 174.0660 715 Y 4.8560 9.2884 127.0696 57.6623 39.5548 174.9279 716 C 4.7546 9.4738 121.8462 58.0861 29.6802 173.2131 717 L 4.8783 8.6980 123.6658 52.2560 44.6642 176.1216 718 E 4.1428 8.6863 120.4176 56.8279 30.1497 177.4085 719 D 4.8281 8.3158 124.5295 53.0721 38.7845 175.3758 720 T 4.7260 7.5040 111.0812 57.8487 72.7098 174.1748 721 P 4.2074 0.0000 0.0000 65.7053 31.3467 178.5658 722 A 3.9475 8.1411 118.9020 55.4671 17.9514 179.4304 723 A 3.9203 8.0974 118.9281 54.9958 18.3248 179.7363 724 L 3.8733 7.6296 118.2056 58.1499 42.2884 178.6994 725 K 3.7700 8.1996 120.0117 59.7631 31.9965 177.9703 726 E 4.1225 7.9922 120.4564 58.8407 29.4701 179.0599 727 V 3.2846 7.3941 118.0846 65.6765 31.4923 177.8495 728 L 3.9676 8.1120 119.1354 57.9462 41.2707 179.4490 729 E 3.9300 8.1951 118.4173 59.1381 29.4599 179.0962 730 L 3.9473 7.8644 120.3994 58.3196 42.1691 179.0088 731 E 3.8544 8.1979 118.6966 58.8655 28.8794 179.1685 732 R 3.9202 7.9098 119.4610 59.6604 29.8848 178.6906 733 T 3.9157 7.3003 107.0806 64.7011 68.9765 176.0355 734 L 4.2639 7.6385 119.1374 54.5970 41.9659 177.5162 735 G 3.8599 7.7996 107.5685 46.1999 0.0000 173.7765 736 G 5.1152 8.5664 106.8998 44.4651 0.0000 173.3992 737 Y 5.2534 9.0234 117.7154 54.6283 41.9310 174.4549 738 L 3.2218 8.5514 123.5303 55.0845 41.8924 177.1384 739 V 3.6623 7.9218 121.2376 63.5655 31.9095 176.3350 740 E 4.7794 7.3946 116.0759 54.1199 33.5588 174.6785 741 E 4.0700 8.6343 120.0032 56.0487 30.0627 175.6492 742 P 4.8774 0.0000 0.0000 62.9966 32.4273 175.7142 743 K 4.8141 9.0120 120.7014 53.8665 35.7301 174.2444 744 P 5.0215 0.0000 0.0000 62.8678 32.7886 175.3570 745 L 4.7721 8.8964 123.0785 53.6855 45.7356 174.8526 746 L 4.9162 9.0066 126.7306 54.2456 42.9143 176.0253 747 F 5.0109 9.6100 125.8609 56.4193 42.0015 173.7468 748 K 4.7600 8.8373 128.1671 54.3305 33.5871 176.2721 749 D 3.8075 8.0654 126.1878 53.5214 38.5499 176.9639 750 S 4.0022 7.0042 111.2950 57.5014 64.5820 175.1093 751 Y 2.0000 5.4054 116.9144 57.9188 35.0230 168.5193 752 H 4.6584 6.9683 117.1217 54.9437 29.9817 175.2930 753 N 4.9658 8.7443 119.0441 53.0995 40.3625 174.1917 754 L 4.9099 8.6977 120.9004 54.7430 43.3843 176.1286 755 R 5.1874 9.5223 123.1249 54.5385 33.4172 174.0006 756 L 5.6077 9.6319 125.7785 53.1442 45.5052 175.7278 757 S 5.0497 9.0006 117.0789 56.9062 66.9812 172.6786 758 L 4.9489 8.1002 120.2777 53.5538 43.8088 175.3068 759 H 4.9191 8.8374 118.7229 53.8667 34.0202 172.5178 760 D 4.5869 8.7207 115.3171 55.3799 38.3571 174.1845 761 I 3.9121 7.6096 118.2609 60.4934 37.9699 175.2142 762 P 4.5091 0.0000 0.0000 62.5337 29.7400 176.6282 763 H 4.6206 8.9726 121.1258 57.9906 29.0583 178.0385 764 A 3.9668 8.2056 121.2867 54.9006 18.4549 177.4846 765 H 5.0564 8.1058 110.4023 55.1576 32.0022 174.0252 766 W 5.5918 8.9775 118.1096 54.7987 33.0099 174.8526 767 R 4.8515 9.1322 118.2334 54.6823 32.8287 173.9823 768 S 4.9485 8.7824 115.6348 58.1919 63.0080 174.0556 769 K 4.3528 9.2465 125.5327 57.2163 32.5825 176.8766 770 L 4.3776 7.6155 122.2803 53.6934 43.1299 176.2335 771 L 4.0203 8.6220 127.5651 58.0257 42.3664 177.4645 772 A 4.0392 7.7136 119.9263 52.2305 18.7346 177.5817 773 K 4.2276 8.2589 120.6105 58.4425 32.6542 176.2168 774 Y 5.2848 6.9768 114.8326 55.8863 41.4265 173.9641 775 Q 4.9916 9.9840 118.6942 54.2651 32.5265 174.7526 776 E 5.3191 8.7702 119.2200 54.8028 33.8545 175.1217 777 I 4.5373 8.3998 123.2985 58.6943 39.9731 173.8156 778 P 4.7429 0.0000 0.0000 62.6242 32.1728 176.6980 779 F 4.3866 9.4664 125.4758 62.0449 39.5986 177.2645 780 Y 4.2817 8.0994 117.4107 61.3701 37.3771 178.0815 781 H 4.3633 7.9931 116.2564 58.6247 28.8050 177.7054 782 V 3.5656 7.5175 118.9822 65.3254 31.5183 177.4755 783 W 4.3526 7.9674 127.3253 60.7486 30.8413 177.5315 784 N 4.5692 8.4238 116.5655 54.8091 37.4824 176.3386 785 G 3.7911 8.0902 108.0265 45.7527 0.0000 173.5846 786 S 4.1169 8.4416 112.9250 58.4789 60.3165 171.7155 787 Q 4.5209 7.2719 119.4505 53.5787 30.3972 175.5035 788 K 3.8780 8.7693 124.6479 57.1064 33.0308 176.6367 789 A 3.8915 8.7387 130.1891 53.0895 15.8956 176.5373 790 L 4.2961 7.4706 121.7498 54.8951 43.1789 177.9117 791 H 5.1419 8.3548 117.4610 54.8147 31.5463 172.2559 792 C 4.7144 8.6390 116.5184 58.2322 31.3365 173.1024 793 T 4.7982 8.0832 118.6567 62.0205 70.0342 173.8628 794 F 4.7706 9.2020 125.2363 55.9108 41.9686 174.6407 795 T 5.0465 8.5827 119.2350 61.7915 71.6092 173.1238 796 L 5.4192 9.4344 125.5301 52.9557 46.4490 175.0881 797 E 5.3209 9.4761 120.7968 54.8685 32.7422 174.4277 798 R 3.8078 8.5449 124.3028 55.1143 30.5546 176.4726 799 H 4.4609 8.3310 119.2179 58.7342 29.2100 175.7246 800 S 4.5866 7.5126 110.2516 56.4738 65.7940 174.6429 801 L 4.0181 8.3595 120.0537 56.9249 41.5575 178.6796 802 A 3.9684 7.5362 121.8415 54.9934 18.3382 177.4639 803 S 4.1582 7.6288 112.0476 59.6368 62.0165 173.7029 804 T 4.7196 8.4811 114.2232 61.1109 70.2854 173.0766 805 E 5.2446 8.2901 120.8471 54.9699 33.2545 174.4365 806 F 4.9422 9.0407 126.6658 56.4402 42.1856 174.0603 807 T 4.8247 7.1998 114.4408 58.9381 71.8630 172.3231 808 C 4.7159 7.6340 116.0545 58.4488 32.8586 171.8016 809 K 4.8835 8.5955 121.5004 54.8637 33.8459 174.8402 810 V 4.6680 8.8848 127.9701 61.2746 33.9375 173.5690 811 C 5.3484 8.9381 128.3809 57.6143 34.2140 172.4573 812 V 5.0556 8.9291 125.8802 61.1636 34.1439 174.3168 813 R 5.1687 8.9033 123.2790 54.9127 33.4983 173.5618 814 Q 4.8729 9.1034 122.8541 54.7348 30.5857 175.3566 815 V 3.6013 8.2017 126.5089 64.6068 31.8700 175.1569 816 E 3.7426 8.9800 125.1451 56.5878 28.9587 174.2271 817 G 4.0936 7.8944 107.0880 45.2500 0.0000 172.9011 818 E 4.3241 8.6662 122.5910 56.4127 30.5244 175.3602 819 G 4.5815 8.0537 105.7107 45.4227 0.0000 172.2117 820 Q 4.8786 9.6524 119.8223 53.7929 33.0853 174.5406 821 I 4.9839 8.0791 121.1012 59.6447 40.4112 174.7719 822 F 4.6499 9.6012 125.9402 55.9456 41.1296 175.0943 823 Q 4.5831 8.7975 123.6653 54.8567 28.6998 174.7298 824 L 4.5376 8.8545 127.6403 54.2571 44.1913 175.4084 825 H 5.0896 8.6909 125.7545 55.7823 32.0199 172.0377 826 T 5.0654 9.2069 116.4586 60.0049 72.3913 172.8182 827 T 5.1142 8.5819 110.8020 60.0117 71.7860 173.9202 828 L 4.6082 9.0416 124.8529 53.3233 42.1667 175.9963 *848 T 4.7538 8.2145 114.4131 61.3755 71.7922 173.7650 849 T 5.1492 7.8796 117.3976 62.1161 72.0086 173.2740 850 Q 4.7694 9.2128 125.7343 54.0015 32.1845 174.8579 851 L 5.0948 8.3017 121.7657 52.6995 44.9015 176.2765 852 G 4.7227 9.1572 109.7645 45.4627 0.0000 171.9398 853 P 5.2195 0.0000 0.0000 63.5140 32.0777 177.7555 *854 Y 4.0975 7.7907 117.4227 59.3320 37.0373 181.6391 855 A 4.0128 7.6140 119.8167 54.0455 18.5620 177.2610 856 F 5.2451 7.3398 113.7830 55.4908 41.4169 176.1636 857 K 4.2228 9.4332 123.3561 58.3327 32.2919 177.4967 858 I 4.4159 8.1990 120.1141 58.8308 38.2805 174.5356 859 P 4.4836 0.0000 0.0000 62.3235 33.1541 177.3126 860 L 3.9818 8.5382 120.9281 57.9523 41.6072 179.9594 861 S 4.0944 8.0631 113.6642 61.6714 62.7355 176.6859 862 I 3.6822 7.6174 122.9826 63.7525 36.9602 177.8103 863 R 3.8054 7.9121 119.6288 59.8800 29.7579 178.4047 864 Q 3.9214 8.2738 117.6652 58.7349 28.7962 178.7621 865 K 3.8824 7.8503 120.1320 59.5475 32.2553 178.9446 866 I 3.6601 7.8690 120.1154 64.5985 36.9492 178.2879 867 C 4.1092 8.2249 117.6918 62.9365 27.7359 175.9177 868 N 4.2833 8.0693 117.0165 56.3278 38.1303 177.1248 869 S 4.2315 7.8528 113.5062 60.6847 62.9335 175.3064 870 L 4.5203 8.0201 119.9836 55.5830 41.9195 178.4091 871 D 4.5519 8.3093 118.7840 55.7263 40.9487 176.8546 872 A 4.1270 7.6275 122.8562 50.9483 18.8650 175.2650 873 P 4.4807 0.0000 0.0000 63.0973 32.0514 175.0864 874 N 4.9507 8.9181 120.0931 51.5131 40.9207 175.5463 875 S 4.0602 8.9543 124.0946 62.0782 63.1092 175.8753 876 R 4.3459 8.1446 116.4238 55.8297 29.0004 179.8049 877 G 3.8502 8.0305 106.6074 46.4262 0.0000 174.4782 878 N 4.6714 7.8251 119.8418 52.1435 38.3928 172.8440 879 D 4.6472 7.0112 124.3804 51.0144 41.5125 177.4624 880 W 4.2663 8.3992 112.7450 59.9888 27.8394 178.5984 881 R 3.3880 6.7452 118.5809 58.8968 29.2875 178.7181 882 L 3.9122 7.5208 119.6195 57.6860 42.1119 178.4630 883 L 3.8692 7.7454 119.7563 58.0580 42.0630 178.7253 884 A 3.9799 8.2675 120.9944 55.2315 18.3114 179.2853 885 Q 4.1558 8.0261 119.1961 58.8792 28.9349 178.6819 886 K 4.0037 8.1223 118.3369 59.2468 32.1636 178.3572 887 L 4.4280 7.9290 116.1406 53.7161 42.1635 176.6874 888 S 3.8568 7.9561 114.0008 60.6583 60.7295 172.5228 889 M 5.5639 9.0105 114.8634 54.6697 32.4735 176.4180 890 D 5.1415 8.0989 116.5828 53.1855 39.9993 178.1587 891 R 4.1126 8.4468 122.5944 60.0873 29.9712 175.9605 892 Y 4.8343 7.7410 118.7067 55.0522 39.6906 174.5209 893 L 4.2594 8.1793 126.6515 57.3012 41.4943 178.3559 894 N 4.3018 7.3117 115.8436 55.9717 38.0766 176.4639 895 Y 4.0374 6.8679 120.0378 60.5737 39.1262 177.7008 896 F 4.2090 7.6111 118.4181 60.2948 38.7542 177.3558 897 A 3.8283 7.9704 119.2585 55.2767 18.2226 178.8888 898 T 4.0255 7.1337 104.3374 61.9980 69.6023 175.3497 899 K 4.0755 6.9404 121.4512 55.5782 32.9507 177.0485 900 A 3.9352 8.4442 124.7114 54.4316 18.5485 178.0176 901 S 4.4684 7.5063 109.6020 55.1903 63.8324 172.1198 902 P 3.8880 0.0000 0.0000 65.4191 30.8506 178.4424 903 T 3.8405 8.1456 114.8441 66.4215 68.3813 176.7506 904 G 3.6345 7.9229 107.6798 48.0686 0.0000 175.8203 905 V 3.8717 7.4879 120.4742 65.5546 31.4550 178.2652 906 I 3.4237 7.3296 119.2515 64.3009 36.8911 178.4104 907 L 4.0584 8.1771 120.0865 57.7771 41.3815 179.3154 908 D 4.4318 8.1349 118.9972 57.2063 40.7447 178.5321 909 L 4.0054 7.9921 120.6842 57.8618 42.1539 178.7062 910 W 4.0903 8.5177 128.4991 60.5848 30.4227 177.4494 911 E 3.8695 8.6974 117.3433 59.6932 29.4344 179.0554 912 A 4.0356 8.0651 120.3600 55.2248 18.3317 179.9339 913 R 3.7835 7.6168 116.5807 59.2690 29.8582 179.0621 914 Q 3.8109 7.2438 118.5574 58.6091 28.7034 178.6859 915 Q 4.1696 7.5257 122.4771 58.3298 28.2573 182.2624 916 D 4.6302 8.3794 117.8715 54.3039 40.1364 182.5549 917 D 4.8539 8.8780 118.2372 54.2620 43.3724 180.0927 918 G 3.9569 7.5860 106.0305 45.6665 0.0000 171.8825 919 D 4.7916 8.2747 116.4324 50.6682 42.2020 176.0480 920 L 4.6990 8.8397 120.3835 58.1922 41.5032 179.3522 921 N 4.5532 8.3303 115.9029 55.4851 38.5396 177.2079 922 S 4.2668 8.5928 116.5367 61.1759 63.0545 176.4290 923 L 3.6098 7.9546 123.1747 57.8485 41.8452 178.5544 924 A 4.0216 7.5262 122.0243 54.6114 18.2148 179.7199 925 S 4.0314 8.5353 113.8668 61.6388 62.9911 176.7491 926 A 3.9620 7.7522 122.9281 55.3240 18.0656 179.7296 927 L 3.9198 7.8981 117.4341 57.6954 41.6668 179.4345 928 E 3.8865 8.4644 119.6436 59.4563 29.4439 178.8616 929 E 4.0502 8.1458 117.0685 59.2536 29.5578 178.5664 930 M 4.2936 7.6770 116.6523 55.4268 32.1732 176.9343 931 G 3.8339 7.6638 106.8764 46.1502 0.0000 174.1759 932 K 4.2120 7.6472 118.2685 55.0188 33.1503 177.2747 933 S 3.9198 8.4163 112.9203 58.7498 63.3427 175.3125 934 E 4.0453 8.9189 128.2478 59.5090 29.2843 179.2599 935 M 4.0518 7.8488 119.1440 58.2528 31.8187 178.6722 936 L 3.9843 7.7044 118.8076 57.5440 41.8653 179.5549 937 V 3.5211 7.7515 117.8596 65.8527 31.3016 177.6323 938 A 3.9669 8.2037 119.5598 55.8790 18.2736 179.4396 939 M 4.1539 8.0440 115.4580 57.6577 31.7603 177.9973 940 T 4.3553 7.3803 108.3020 61.1279 69.9621 174.8654 941 T 4.1437 7.2834 121.1463 64.4810 69.1986 174.7255 942 D 4.4364 8.5470 121.9330 53.5824 40.9396 176.1199 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 541 P 0.00 4.36 0.00 2.19 2.14 0.00 3.55 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 542 G 7.97 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 0.00 543 S 7.82 4.74 0.00 4.03 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 0.00 544 S 7.65 5.30 0.00 4.05 3.87 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 0.00 545 V 9.02 4.85 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.11 0.00 0.00 546 S 8.50 5.23 0.00 4.05 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 0.00 547 G 9.17 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 0.00 0.00 0.00 548 T 7.93 5.26 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 1.26 0.00 0.00 549 F 9.71 4.94 0.00 2.96 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 0.00 550 G 8.53 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 551 C 8.23 4.35 0.00 3.04 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 0.00 552 L 7.48 4.50 0.00 1.86 1.89 1.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 553 G 8.40 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 0.00 0.00 0.00 554 G 7.34 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 555 R 8.66 4.88 0.00 1.66 1.65 0.00 2.99 0.00 0.00 3.03 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.49 0.00 556 L 8.90 5.33 0.00 1.74 1.49 1.31 0.67 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 0.00 557 T 9.01 5.01 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 1.20 0.00 0.00 558 I 8.41 4.44 1.88 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 1.26 1.23 0.93 0.00 0.00 559 P 0.00 4.18 0.00 2.04 2.00 0.00 3.73 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 560 G 9.06 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 0.00 0.00 0.00 561 T 7.74 4.39 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 1.24 0.00 0.00 562 G 8.46 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 0.00 563 V 7.90 4.95 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 0.99 0.00 0.00 0.92 0.00 0.00 564 S 8.39 5.02 0.00 3.96 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 565 L 9.14 4.97 0.00 1.65 1.47 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 566 L 8.98 4.76 0.00 1.77 1.53 1.11 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 567 V 8.84 4.41 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 0.87 0.00 0.00 0.54 0.00 0.00 568 P 0.00 4.75 0.00 2.06 2.07 0.00 3.68 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.11 0.00 569 N 8.22 4.42 0.00 2.52 2.51 0.00 0.00 6.96 8.36 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 0.00 570 G 9.23 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 0.00 571 A 7.90 4.16 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 0.00 572 I 7.38 4.23 1.73 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 0.98 1.07 0.21 0.00 0.00 573 P 0.00 4.26 0.00 2.09 1.95 0.00 3.25 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.14 0.00 574 Q 8.42 4.06 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.03 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 575 G 8.54 3.72 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 0.00 0.00 0.00 576 K 7.27 4.45 0.00 1.65 1.56 0.00 1.65 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.31 7.81 577 F 8.46 5.20 0.00 2.94 2.92 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 0.00 0.00 0.00 578 Y 9.45 5.16 0.00 2.92 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 0.00 579 D 9.00 5.32 0.00 2.66 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 0.00 580 L 9.64 5.35 0.00 1.75 1.68 0.98 0.72 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 0.00 581 Y 8.93 5.51 0.00 3.10 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 0.00 582 L 9.18 5.08 0.00 1.73 1.55 0.96 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 583 R 9.39 5.17 0.00 2.04 1.87 0.00 3.18 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 584 I 8.51 4.74 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.72 0.93 0.00 0.00 585 N 8.87 4.89 0.00 2.70 2.81 0.00 0.00 7.03 7.44 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 0.00 586 K 8.71 3.80 0.00 1.85 2.00 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.53 7.81 587 T 8.80 3.84 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 588 E 8.09 4.28 0.00 2.09 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 2.37 2.35 0.00 589 S 8.18 4.40 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 0.00 590 T 7.75 4.48 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 0.98 0.00 0.00 591 L 7.96 3.89 0.00 1.94 1.75 0.92 1.01 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 0.00 592 P 0.00 4.28 0.00 2.17 2.17 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.17 0.00 593 L 8.12 4.24 0.00 1.42 1.45 -0.46 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 594 S 7.64 4.76 0.00 3.93 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 0.00 595 E 8.86 4.67 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.23 0.00 596 G 8.09 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 597 S 8.71 4.42 0.00 3.79 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 0.00 598 Q 8.24 4.67 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.74 0.00 0.00 0.00 0.00 0.00 2.54 2.31 0.00 599 T 8.87 4.69 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 1.12 0.00 0.00 600 V 8.05 4.27 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 0.68 0.00 0.00 0.71 0.00 0.00 601 L 8.98 4.58 0.00 1.67 1.63 0.53 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 602 S 8.03 5.28 0.00 3.93 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 0.00 603 P 0.00 4.44 0.00 2.11 2.10 0.00 3.90 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 604 S 8.59 4.66 0.00 4.05 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 0.00 605 V 9.08 4.93 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 1.09 0.00 0.00 0.97 0.00 0.00 606 T 9.15 5.19 4.38 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 1.27 0.00 0.00 607 C 8.57 4.88 0.00 2.82 2.92 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 0.00 0.00 0.00 608 G 6.98 4.22 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 1.48 1.74 0.00 617 P 0.00 4.73 0.00 2.07 2.23 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 618 V 8.46 4.39 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 0.66 0.00 0.00 0.98 0.00 0.00 619 V 8.52 4.70 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 0.98 0.00 0.00 0.98 0.00 0.00 620 L 8.99 4.89 0.00 1.66 1.37 0.91 0.68 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 0.00 621 T 8.81 5.03 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 1.24 0.00 0.00 622 V 8.29 4.78 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 0.74 0.00 0.00 0.81 0.00 0.00 623 P 0.00 4.90 0.00 2.04 2.09 0.00 3.59 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.19 0.00 624 H 8.84 5.85 0.00 3.12 3.20 0.00 5.70 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 625 C 8.46 4.83 0.00 3.18 3.10 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 0.00 0.00 0.00 0.00 626 A 8.14 4.44 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 627 E 8.97 4.27 0.00 2.31 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 2.45 2.55 0.00 628 V 8.84 3.97 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 0.79 0.00 0.00 0.75 0.00 0.00 629 I 8.14 4.00 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 1.35 0.80 0.91 0.00 0.00 630 A 8.03 4.60 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 0.00 631 G 8.74 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 0.00 632 D 8.42 4.51 0.00 2.63 2.61 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 0.00 0.00 0.00 0.00 633 W 8.51 4.62 0.00 2.00 1.77 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 0.00 634 I 8.53 4.24 1.97 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 1.24 0.71 0.97 0.00 0.00 635 F 8.48 5.06 0.00 2.99 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 0.00 636 Q 8.52 4.89 0.00 1.82 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.81 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 637 L 8.83 5.09 0.00 1.91 1.61 1.12 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 638 K 9.12 5.23 0.00 1.62 1.90 0.00 1.46 0.00 0.00 1.57 0.00 0.00 2.75 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.29 7.81 639 T 9.36 5.53 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 1.22 0.00 0.00 640 Q 8.25 4.61 0.00 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.80 0.00 0.00 0.00 0.00 0.00 1.64 1.16 0.00 641 A 8.57 4.03 1.21 0.00 0.00 0.00 0.00 0.00 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0.00 2.01 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.34 0.00 667 A 8.56 4.01 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 0.00 668 K 7.49 4.51 0.00 1.63 1.63 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.26 1.28 7.81 669 S 7.44 4.74 0.00 3.78 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 670 C 8.81 4.77 0.00 2.18 2.27 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 0.00 671 H 8.89 4.87 0.00 3.04 3.15 0.00 5.64 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 672 I 8.53 4.54 1.72 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.35 0.63 0.00 0.00 673 L 8.81 4.72 0.00 1.44 1.73 1.29 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 674 L 9.03 4.92 0.00 1.45 1.63 0.61 0.14 0.00 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0.00 2.07 2.04 0.00 3.10 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 733 T 7.30 3.92 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 1.25 0.00 0.00 734 L 7.64 4.26 0.00 1.64 1.74 0.88 0.88 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 0.00 735 G 7.80 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 736 G 8.57 5.12 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 0.00 737 Y 9.02 5.25 0.00 3.03 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 738 L 8.55 3.22 0.00 1.28 1.49 0.40 0.88 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 0.00 739 V 7.92 3.66 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.75 0.00 0.00 740 E 7.39 4.78 0.00 2.03 1.90 0.00 0.00 0.00 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0.00 0.00 0.00 875 S 8.95 4.06 0.00 3.88 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 0.00 876 R 8.14 4.35 0.00 1.85 1.79 0.00 3.28 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.43 0.00 877 G 8.03 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 0.00 878 N 7.83 4.67 0.00 2.64 2.80 0.00 0.00 6.81 8.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 879 D 7.01 4.65 0.00 3.02 2.66 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 0.00 0.00 0.00 0.00 880 W 8.40 4.27 0.00 3.53 3.32 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 0.00 881 R 6.75 3.39 0.00 1.46 1.58 0.00 2.71 0.00 0.00 2.54 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 882 L 7.52 3.91 0.00 1.82 1.71 0.88 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 883 L 7.75 3.87 0.00 1.78 1.81 0.83 0.95 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 0.00 884 A 8.27 3.98 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 885 Q 8.03 4.16 0.00 2.14 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 886 K 8.12 4.00 0.00 1.92 1.87 0.00 1.87 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.69 1.61 7.81 887 L 7.93 4.43 0.00 1.69 1.82 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 888 S 7.96 3.86 0.00 4.09 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 0.00 889 M 9.01 5.56 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.70 0.00 890 D 8.10 5.14 0.00 2.89 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 0.00 891 R 8.45 4.11 0.00 1.98 2.32 0.00 3.44 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.76 0.00 892 Y 7.74 4.83 0.00 3.15 2.99 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 0.00 893 L 8.18 4.26 0.00 1.73 1.91 0.87 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 0.00 894 N 7.31 4.30 0.00 1.69 2.65 0.00 0.00 6.80 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 895 Y 6.87 4.04 0.00 3.11 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 896 F 7.61 4.21 0.00 2.95 2.38 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 0.00 897 A 7.97 3.83 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 898 T 7.13 4.03 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 1.22 0.00 0.00 899 K 6.94 4.08 0.00 1.65 1.60 0.00 1.53 0.00 0.00 1.45 0.00 0.00 2.13 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.24 1.29 7.81 900 A 8.44 3.94 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 0.00 901 S 7.51 4.47 0.00 3.75 3.61 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 0.00 0.00 0.00 0.00 902 P 0.00 3.89 0.00 0.49 0.49 0.00 3.46 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.68 0.00 903 T 8.15 3.84 4.19 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 1.15 0.00 0.00 904 G 7.92 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 905 V 7.49 3.87 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 1.38 0.00 0.00 0.91 0.00 0.00 906 I 7.33 3.42 1.76 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 -0.36 0.77 0.00 0.00 907 L 8.18 4.06 0.00 1.79 1.72 0.82 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 908 D 8.13 4.43 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 0.00 909 L 7.99 4.01 0.00 2.19 1.91 1.08 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 910 W 8.52 4.09 0.00 3.43 3.39 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 0.00 911 E 8.70 3.87 0.00 2.27 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 0.00 2.82 2.67 0.00 912 A 8.07 4.04 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 0.00 913 R 7.62 3.78 0.00 1.77 1.72 0.00 3.13 0.00 0.00 3.14 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 914 Q 7.24 3.81 0.00 1.76 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.98 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 915 Q 7.53 4.17 0.00 2.26 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 916 D 8.38 4.63 0.00 2.67 2.31 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 0.00 917 D 8.88 4.85 0.00 2.66 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 918 G 7.59 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 0.00 0.00 0.00 919 D 8.27 4.79 0.00 2.84 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 0.00 920 L 8.84 4.70 0.00 1.87 1.92 1.05 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 921 N 8.33 4.55 0.00 3.04 2.91 0.00 0.00 6.92 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 922 S 8.59 4.27 0.00 4.22 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 0.00 923 L 7.95 3.61 0.00 0.58 1.35 0.37 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 924 A 7.53 4.02 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 925 S 8.54 4.03 0.00 3.85 3.94 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 0.00 926 A 7.75 3.96 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 0.00 927 L 7.90 3.92 0.00 1.78 1.67 0.80 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 928 E 8.46 3.89 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 929 E 8.15 4.05 0.00 2.09 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 2.34 2.56 0.00 930 M 7.68 4.29 0.00 2.15 2.22 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 2.81 2.51 0.00 931 G 7.66 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 932 K 7.65 4.21 0.00 1.84 1.72 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.48 7.81 933 S 8.42 3.92 0.00 3.86 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 934 E 8.92 4.05 0.00 2.00 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 2.39 2.33 0.00 935 M 7.85 4.05 0.00 1.96 2.09 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 2.61 2.71 0.00 936 L 7.70 3.98 0.00 1.88 1.66 0.88 0.81 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 0.00 937 V 7.75 3.52 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 1.03 0.00 0.00 938 A 8.20 3.97 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 0.00 939 M 8.04 4.15 0.00 1.98 2.29 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 2.75 2.53 0.00 940 T 7.38 4.36 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 1.09 0.00 0.00 941 T 7.28 4.14 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 942 D 8.55 4.44 0.00 2.58 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.