NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 519 T 4.4368 8.0333 117.3327 63.6509 70.7272 172.4996 520 T 4.4856 8.3674 121.6557 62.7412 70.1521 172.3373 521 G 4.4104 9.6509 114.5822 45.2070 0.0000 172.2187 522 L 5.6785 9.0264 122.4450 52.7820 45.5545 175.5010 523 I 5.0603 8.3316 123.6756 59.9170 40.1244 174.0414 524 Y 4.6049 8.3651 124.0019 57.1720 42.6809 172.5571 525 D 4.2395 6.9070 122.7763 52.7139 44.3546 176.3387 526 S 3.7830 8.0040 119.1326 60.4083 63.8523 176.2138 527 V 3.1429 6.8990 121.1738 65.9592 30.9437 177.6267 528 M 4.1043 7.3032 118.1382 57.2004 32.1471 178.4601 529 L 3.9114 7.4965 118.4836 57.4731 41.7987 178.6303 530 K 3.8609 7.2032 115.9594 58.3013 32.1046 176.5351 531 H 4.2634 7.4714 118.9764 56.2926 29.1433 174.3532 532 Q 4.3459 7.9607 121.1656 55.0134 30.9650 173.6429 533 C 4.1264 8.3367 122.1833 59.3217 32.3577 174.5700 534 S 4.2180 8.6901 119.9541 61.2517 61.3706 176.2449 535 C 4.1046 8.1709 115.8061 59.1368 29.6139 174.9430 536 G 3.7701 7.8854 107.3739 46.0358 0.0000 172.7360 537 D 4.6886 7.4057 118.9908 52.4315 41.0978 176.1864 538 N 4.7989 8.6988 123.4757 53.7693 38.6004 176.0557 539 S 4.6355 8.0487 112.2805 58.0576 63.9110 174.7455 540 R 4.3825 7.5205 115.0154 56.2780 30.3155 175.9669 541 H 4.8517 7.7570 115.5884 52.9258 29.3807 171.1904 542 P 4.3016 0.0000 0.0000 65.1020 31.4975 177.4015 543 E 3.9844 7.2741 120.4728 54.4523 28.0118 174.2857 544 H 4.9946 7.5291 118.0285 52.1192 32.1301 175.4622 545 A 4.1341 8.6042 121.4317 55.0823 18.0902 180.0874 546 G 3.7151 8.3950 103.7646 47.5646 0.0000 175.6925 547 R 3.9693 8.0400 120.9643 59.6081 30.1720 178.9939 548 I 3.9679 7.7295 112.0702 63.8689 37.9601 177.7240 549 Q 4.1579 8.0856 121.8735 58.9391 28.8667 178.3563 550 S 4.1764 8.3751 115.5230 61.4354 63.1751 176.4350 551 I 3.7615 7.6317 123.7648 63.8515 36.6015 178.1064 552 W 4.2362 8.2765 129.3283 60.5994 30.3731 178.1969 553 S 4.0282 8.1662 114.1960 61.2741 62.5472 176.3765 554 R 4.6306 8.0593 123.6864 58.7833 29.7109 178.4441 555 L 4.0263 7.8686 118.6105 57.1379 41.4422 179.0625 556 Q 3.7157 7.4691 119.8210 59.0870 29.1062 177.5470 557 E 3.8528 8.2363 119.6805 59.1851 29.5166 179.1648 558 R 4.3311 7.9558 115.3369 55.7796 29.3250 177.7255 559 G 3.9967 8.3988 106.2976 46.2784 0.0000 176.1454 560 L 4.2254 7.3698 120.8191 57.3362 41.5563 179.1483 561 R 3.7888 8.1135 118.4576 59.4992 29.6980 179.1013 562 S 4.1300 7.2555 111.0906 61.4591 62.9029 176.0263 563 Q 4.3057 7.7770 118.1101 56.0596 28.9684 175.0343 564 C 4.9381 7.1370 117.2468 57.6680 31.7104 173.3568 565 E 4.3233 9.0608 121.8822 55.7602 29.8585 175.0576 566 C 5.1280 8.7278 126.0778 58.9951 29.1822 173.3219 567 L 4.8781 9.3407 124.2378 53.3286 44.5822 178.1347 568 R 4.5080 8.2003 118.8885 57.8690 31.1488 176.5806 569 G 3.7770 9.2266 100.9200 46.3281 0.0000 171.8327 570 R 2.8539 6.4442 112.5763 54.5047 32.3392 174.1084 571 K 4.3179 7.8659 119.6867 55.9026 32.5534 177.1319 572 A 4.1588 8.6906 128.1635 51.9607 18.9117 177.7316 573 S 4.1965 8.7351 116.8731 57.9463 63.9637 175.5581 574 L 3.9247 8.4200 121.4297 58.1291 41.0379 179.7439 575 E 4.0253 7.9988 117.3475 59.1004 29.8042 178.6893 576 E 4.2254 7.9729 118.3673 59.4243 29.4588 179.2232 577 L 3.9449 7.7665 118.9652 57.9570 41.4701 179.4025 578 Q 4.6889 8.0821 117.4974 57.3016 28.7404 177.9947 579 S 4.3543 7.8011 114.1724 59.9137 63.0530 174.8335 580 V 4.1110 7.6909 120.6514 63.4515 33.9164 174.5396 581 H 5.1288 8.2233 116.2212 53.3858 31.1426 174.2984 582 S 4.6126 7.9235 116.7323 58.0820 63.8697 175.5198 583 E 3.9375 8.8253 120.4662 59.5830 29.1276 179.3148 584 R 3.8451 8.0438 118.2293 59.9105 30.0674 177.7040 585 H 4.1464 8.2414 117.7608 59.3316 29.8613 177.4196 586 V 3.8649 8.1600 120.0993 66.0522 31.4504 178.0532 587 L 3.9943 8.1175 118.8628 57.5758 41.2176 179.3126 588 L 3.6490 7.8845 119.5144 57.8172 42.1431 177.8360 589 Y 4.6283 7.4293 113.1070 58.1064 38.6570 177.0290 590 G 4.4542 8.4415 108.2479 46.7051 0.0000 173.4093 591 T 4.7821 7.4261 107.1834 59.7346 71.9793 172.4341 592 N 4.8622 8.4663 118.6795 51.5002 40.4326 174.9504 *616 L 4.1592 8.1669 121.3726 54.0760 42.8790 176.3475 617 P 4.3877 0.0000 0.0000 64.9871 31.5070 176.9575 618 C 4.3200 8.0424 111.1470 58.3753 30.1738 173.9738 619 G 3.9999 8.2428 109.6104 45.3341 0.0000 174.2080 620 G 4.3918 7.6643 105.5319 45.4499 0.0000 173.0421 621 V 4.5777 8.3413 119.5736 61.6581 33.9516 174.5790 622 G 4.5834 8.3523 110.8415 45.5266 0.0000 173.3799 623 V 4.0044 9.1688 114.7076 63.3911 31.8110 175.9915 624 D 4.7305 7.5094 116.9441 51.7702 42.2175 175.3459 625 T 3.9739 8.5312 108.3538 64.3581 68.4213 174.3391 626 D 4.6162 7.7241 119.0165 55.0042 42.5897 176.0855 627 T 4.4363 7.8880 116.5922 62.0423 68.9073 174.5859 628 I 4.3606 8.5166 127.4779 60.7935 38.3716 175.9298 629 W 4.8150 9.1747 135.0000 55.6147 32.6942 174.2396 630 N 4.4767 8.8119 127.8969 52.3862 38.5545 175.8844 631 E 4.0592 8.7137 125.8486 58.4115 29.9164 177.6811 632 L 4.3692 7.7190 117.5809 55.6303 43.4043 177.5320 633 H 4.6862 7.5914 113.9476 56.5345 30.2673 176.7184 634 S 3.6217 7.3022 117.0909 61.4238 62.5155 176.2860 635 S 4.3685 6.9865 115.0543 61.9793 62.0967 176.1503 636 N 4.4256 7.9778 118.0032 56.1698 38.3060 177.2227 637 A 3.9542 8.1635 122.2239 54.9493 17.9323 179.5769 638 A 4.0505 8.2672 119.6499 55.6361 18.5986 180.2344 639 R 3.9614 8.3354 116.4063 58.7078 30.0268 179.2422 640 W 3.9537 8.2104 128.1677 60.4279 30.8864 177.6076 641 A 4.0444 8.5528 120.9345 55.6115 17.6354 179.3307 642 A 4.2421 7.9445 117.6413 54.5380 18.6114 179.9582 643 G 3.8399 7.6188 105.3915 47.0242 0.0000 176.1924 644 S 3.9992 7.8796 117.4396 61.1159 62.9065 176.8984 645 V 3.5558 7.6888 120.8361 66.2779 30.8918 177.8840 646 T 3.9689 7.5267 115.6863 66.8966 68.2081 175.5599 647 D 4.2726 8.2414 119.8284 57.6290 41.2378 178.3750 648 L 4.0353 8.2697 120.3828 57.8354 42.0707 178.5211 649 A 4.2201 8.1698 120.6891 54.5607 18.3212 179.4784 650 F 3.9627 8.4752 115.8270 60.1644 39.3631 177.8179 651 K 4.2102 8.0393 118.6014 59.3526 31.9922 179.5016 652 V 3.7551 7.8702 118.7720 65.9933 31.5768 177.2120 653 A 4.2275 7.9831 118.9109 52.9125 17.5965 177.6217 654 S 4.5750 7.7118 111.7080 57.4991 64.8165 175.1133 655 R 4.3902 7.8433 117.2639 56.4312 27.8519 177.2800 656 E 4.1340 7.7525 121.6988 58.1347 29.9796 176.7864 657 L 4.9309 7.5460 116.9477 52.4488 45.3454 177.2962 658 K 4.0783 9.1977 123.8108 59.2138 33.0351 176.1658 659 N 4.6789 7.1881 116.3403 53.6214 39.2721 172.8432 660 G 4.4554 6.8299 105.5421 45.4104 0.0000 170.6868 661 F 5.6148 8.5927 121.4941 56.8931 42.9245 173.1275 662 A 4.4768 9.1543 129.7238 50.7954 19.9355 176.2000 663 V 4.1582 8.2602 124.5981 61.8844 30.0495 175.4154 664 V 4.5999 7.8053 117.1458 59.0121 35.0856 175.2729 665 R 4.7530 8.0423 117.3432 53.9395 32.1431 173.1189 666 P 4.6855 0.0000 0.0000 61.7785 32.1038 174.0742 667 P 4.6369 0.0000 0.0000 62.8984 32.2142 176.8048 668 G 4.2905 9.0927 104.8987 43.9019 0.0000 174.5153 669 H 4.4804 8.5289 114.1821 57.4874 28.9460 176.3318 670 H 4.4725 7.9872 115.9099 56.6315 29.5563 175.3265 671 A 4.2162 7.9475 124.2993 51.9385 18.9422 176.0601 672 D 5.0407 8.3155 121.3796 52.2137 44.4665 175.7898 673 H 4.0466 7.9037 117.5690 59.1494 30.4319 176.1719 674 S 4.9005 7.6903 113.9494 57.8111 63.7758 173.9755 675 T 4.4653 7.9166 116.6662 62.8904 71.8987 172.8348 676 A 4.6579 8.3234 129.6456 50.5460 20.5576 175.6524 677 M 4.2990 8.5124 118.7178 55.1872 34.3402 174.2698 678 G 3.2340 8.7732 105.2091 46.9622 0.0000 174.6612 679 F 4.0301 7.3772 113.9764 57.5765 37.9468 175.2256 680 C 5.2966 7.4530 118.2191 57.1235 30.7693 174.2123 681 F 3.9884 8.8925 121.0685 58.0740 40.7630 176.0288 682 F 4.9424 7.7854 117.5535 55.0399 42.3299 173.8650 683 N 4.9606 9.0725 122.8869 52.7539 38.7287 175.8519 684 S 4.2036 8.5699 125.0834 61.4461 63.1653 176.6423 685 V 3.6175 7.9245 120.2455 65.8387 31.3185 177.7087 686 A 4.3875 8.4342 120.4892 55.3996 18.2308 179.3943 687 I 3.6635 8.0479 118.1626 64.6555 37.2705 178.1335 688 A 4.1807 7.9738 122.6711 54.6887 18.1618 179.0608 689 C 3.9748 8.1944 116.7350 63.0041 31.6676 176.1314 690 R 4.1013 8.5016 119.6866 59.2276 29.6366 179.2371 691 Q 4.0993 8.5573 118.3352 59.1850 28.8337 178.5945 692 L 3.5924 8.6512 120.2053 57.8150 41.4304 179.6548 693 Q 4.0946 8.1229 117.7849 58.6274 28.6723 178.3626 694 Q 4.0720 8.1077 118.0651 58.5136 28.9553 176.8857 695 Q 4.3055 7.9664 115.3435 55.6989 29.2020 176.9811 696 S 3.5624 7.1773 110.6987 59.5015 61.7115 171.7447 697 K 4.1659 8.1834 123.9117 56.9289 33.4141 175.7554 698 A 4.3614 7.2678 117.0328 52.3211 21.7001 175.9349 699 S 4.3812 9.0471 118.0131 59.9235 64.0193 174.7586 700 K 4.8008 8.5656 121.2759 54.6879 34.2014 175.3248 701 I 5.0514 8.6031 126.3542 59.4126 40.0595 174.4153 702 L 4.9506 8.8337 128.5243 53.4615 44.5110 174.9882 703 I 4.8816 8.7661 126.8104 59.6614 39.9877 174.4419 704 V 4.4790 8.6484 128.2834 61.1894 33.7290 173.9983 705 D 5.1914 8.9873 128.5826 52.2911 42.4818 175.2862 706 W 5.2526 8.0186 121.5845 56.0056 29.2815 176.2157 707 D 4.8520 8.1323 120.0269 54.8741 41.3068 177.8308 708 V 4.0122 9.0694 124.3656 64.0137 31.7481 175.6684 709 H 5.4340 8.6138 117.9103 54.1875 30.4124 174.1669 710 H 4.3836 8.8699 122.5293 56.2183 30.5481 177.3451 711 G 3.9203 8.7808 116.5295 42.7779 0.0000 173.7231 712 N 4.2642 7.9821 123.2860 56.2663 37.6649 177.5765 713 G 4.0547 7.6319 109.2136 47.3268 0.0000 175.8506 714 T 3.8046 7.5830 117.9077 66.1492 68.3189 176.2054 715 Q 3.6860 7.3509 120.1927 59.4637 28.8324 178.3677 716 Q 3.9882 8.0142 118.8180 59.1292 28.4678 178.7675 717 T 3.6092 7.6494 115.9248 65.8742 68.7390 175.7842 718 F 4.8767 7.4404 116.8582 57.4010 39.0159 177.1418 719 Y 4.1074 7.8456 122.8607 60.2985 38.6963 177.3797 720 Q 4.6918 8.1197 115.5550 55.4526 29.6706 174.2233 721 D 4.7932 7.9585 119.7452 51.8939 42.0321 174.9796 722 P 3.5210 0.0000 0.0000 63.7960 32.0824 176.7926 723 S 4.4275 8.0357 113.4537 59.2454 64.3039 173.7112 724 V 4.7481 7.2808 119.9256 61.0457 33.7888 174.1965 725 L 4.6061 8.2861 130.4081 53.7347 43.6398 174.1231 726 Y 5.1286 8.5950 128.4422 56.1197 40.7969 174.1177 727 I 4.5246 8.3527 127.8222 59.3460 40.2749 174.4040 728 S 4.9179 8.4694 121.9905 56.2170 65.2494 172.4245 729 L 5.0574 8.3930 126.5163 53.2539 43.9281 175.6600 730 H 5.1160 8.1895 115.8917 54.4707 32.3157 173.1023 731 R 4.5466 8.9491 122.7197 56.8834 29.7537 175.0231 732 H 4.6994 9.2411 125.8827 57.2330 32.2637 173.8892 733 D 4.4481 9.3345 117.9106 55.9822 38.2770 173.4591 734 D 4.3289 9.2137 112.2988 55.3731 40.2308 173.6237 735 G 3.9367 8.2601 103.4542 45.1078 0.0000 174.2274 736 N 5.0068 7.7209 114.8386 52.3955 39.1650 174.3899 737 F 4.9433 7.7838 119.4308 55.7890 42.6686 173.5037 738 F 4.0191 8.1529 128.5376 58.6238 39.3023 172.9180 739 P 3.6455 0.0000 0.0000 62.1715 31.1187 176.2320 740 G 3.8914 8.1522 107.8846 45.4324 0.0000 173.7743 741 S 4.6141 7.4279 113.6448 57.2663 65.6906 172.8633 742 G 3.2401 8.4078 104.4023 46.6504 0.0000 173.9589 743 A 4.0002 7.9723 121.2136 50.9614 19.5640 179.4604 744 V 3.7936 8.3745 120.1919 65.0786 31.2293 177.6906 745 D 4.3907 8.0208 118.8651 56.6653 40.8759 176.0305 746 E 4.4646 8.0099 118.4592 55.5991 29.1641 176.6890 747 V 4.6952 8.2188 115.6121 59.7570 32.9786 176.1440 748 G 2.6037 8.5824 105.4434 44.2601 0.0000 171.9541 749 A 4.5984 8.0103 120.2689 50.6856 23.4635 177.9112 750 G 3.6935 8.4275 108.0517 46.6563 0.0000 177.5456 751 S 4.1666 8.9387 118.3101 61.1069 63.1454 174.9514 752 G 3.9994 8.2501 108.6808 45.2060 0.0000 172.6161 753 E 3.8467 7.8053 121.6731 57.1968 29.6066 176.8331 754 G 3.1363 8.3719 115.7599 44.8861 0.0000 173.6835 755 F 5.0431 8.0162 117.3317 57.1774 40.5312 174.3733 756 N 5.4313 8.1327 118.3887 51.8268 41.7520 173.1192 757 V 4.2655 9.2558 126.2666 61.3653 34.2653 174.1832 758 N 4.9384 8.7086 126.8506 51.6694 39.4731 175.5599 759 V 3.5420 8.2738 126.1238 61.8695 30.3044 172.5365 760 A 4.2745 7.5412 124.2039 49.7797 19.9314 176.7352 761 W 4.8845 9.2472 123.6797 56.7571 30.5507 175.8843 762 A 5.1584 9.2784 125.4097 50.2164 22.1191 175.7731 763 G 3.8147 8.7740 104.9711 45.3731 0.0000 175.9772 764 G 3.8607 7.9960 107.9188 45.8057 0.0000 174.1633 765 L 4.4840 8.3457 117.1315 54.9153 42.7088 175.4350 766 D 4.7859 7.7138 117.7199 51.5172 43.7239 173.2437 767 P 4.5225 0.0000 0.0000 61.5534 32.2642 173.8308 768 P 4.8778 0.0000 0.0000 62.0721 32.5075 176.3153 769 M 3.8417 8.3348 123.1033 54.1147 32.7578 173.8443 770 G 3.7343 8.8326 116.6900 44.6651 0.0000 173.5106 771 D 4.1875 8.8671 119.1889 57.0017 40.9169 176.7139 772 P 4.2904 0.0000 0.0000 65.1865 31.2597 178.6266 773 E 3.8076 7.8662 117.2863 59.6200 29.4338 178.7879 774 Y 3.9169 7.7343 116.9165 60.7786 37.8655 178.4974 775 L 3.8405 8.3246 120.2393 57.5300 41.6528 178.9079 776 A 3.9495 8.1144 120.7687 55.4480 18.1943 179.2746 777 A 3.9468 8.2688 118.8384 55.5463 18.3950 179.9408 778 F 3.8726 8.4898 115.8866 60.6983 38.8068 177.8863 779 R 3.9256 8.2915 116.5857 59.5251 30.0199 178.6920 780 I 4.0115 7.8841 117.7207 63.1205 37.9145 177.1347 781 V 3.9837 7.2827 116.4544 64.5696 32.7286 177.7533 782 V 3.1634 7.6181 117.9037 66.1677 31.2954 178.0057 783 M 3.8978 7.5974 118.3060 57.7336 31.8436 177.0117 784 P 4.1821 0.0000 0.0000 65.7058 31.5291 178.6443 785 I 3.2394 7.3164 117.8401 64.0817 36.8433 178.3973 786 A 3.9023 7.7987 121.4899 55.3161 18.0131 180.0008 787 R 4.0621 7.9923 115.6176 59.1136 30.1275 178.6775 788 E 4.1920 8.1388 118.6939 59.3162 29.8066 178.2601 789 F 4.6468 8.5361 119.8036 59.1873 40.7985 174.6072 790 S 3.6264 8.3160 110.9949 58.4378 60.2906 169.5872 791 P 4.3661 0.0000 0.0000 62.3075 32.4524 177.7604 792 D 4.5391 9.1691 120.4586 56.2349 41.7362 176.7439 793 L 4.7504 7.7291 119.6541 53.5324 46.0777 174.3338 794 V 4.7449 8.7176 125.9901 61.3680 33.4940 174.1625 795 L 5.1683 9.1988 128.2522 52.9840 44.5267 175.5149 796 V 4.4066 8.6322 123.5565 61.1339 33.7104 175.3761 797 S 4.1806 8.7622 125.3914 58.5073 61.5257 172.2668 798 A 3.7459 8.7995 126.7838 50.3865 17.6015 176.2563 799 G 4.4844 7.7361 107.0961 44.0680 0.0000 170.7807 800 F 4.9216 8.5004 120.2276 56.9346 39.7638 176.8847 801 D 4.1566 8.3965 119.4241 54.6931 39.6324 176.5487 802 A 4.3472 8.1259 122.4219 53.0601 19.1284 177.3169 803 A 4.9023 7.8999 119.6417 51.4707 19.1093 176.7357 804 E 4.2323 8.3793 121.6063 57.2358 29.9540 176.7039 805 G 3.6952 8.6740 112.7490 45.6768 0.0000 173.1689 806 H 4.6872 7.9507 118.5611 53.2503 29.1713 173.0044 807 P 4.5865 0.0000 0.0000 62.2845 31.8877 175.5804 808 A 4.6962 8.4768 123.6234 51.3492 19.4435 176.9836 809 P 4.9651 0.0000 0.0000 62.0124 30.3947 175.5894 810 L 4.5421 9.3471 120.8942 54.5686 41.5005 179.5478 811 G 4.3682 7.9364 114.1926 43.8330 0.0000 173.3197 812 G 3.8948 8.6900 108.2459 44.9894 0.0000 172.4565 813 Y 4.8283 7.6352 117.1237 56.7656 40.0763 174.8353 814 H 4.7425 8.7449 116.7342 55.5086 30.1805 174.6896 815 V 3.6494 7.8698 119.8372 62.5303 32.3564 175.2638 816 S 4.6841 9.6346 122.2480 57.4028 64.4157 174.7756 817 A 4.1408 8.9424 124.5784 55.8271 17.9844 180.1935 818 K 3.9768 8.1581 117.1420 59.5558 32.0936 178.5332 819 C 3.9725 8.2959 119.2338 62.5086 31.4598 175.4317 820 F 3.3341 7.7287 119.0610 60.2719 38.4461 178.0122 821 G 3.6402 8.3095 105.4371 47.9769 0.0000 175.2305 822 Y 4.3189 8.5533 122.7222 60.6439 38.8716 177.7547 823 M 3.3867 8.5968 120.7955 58.5115 31.6845 178.8472 824 T 4.1684 7.9030 114.7610 66.7639 68.9299 176.0986 825 Q 4.1523 8.0544 121.1919 59.2582 29.2267 178.0104 826 Q 3.9356 8.0930 119.3864 59.3544 28.9267 179.4767 827 L 4.1949 8.1209 119.1661 57.7330 41.3570 178.8983 828 M 4.3874 7.8965 117.3400 56.8841 31.7590 177.4417 829 N 4.5552 7.9902 115.6858 54.3746 39.4393 175.2053 830 L 4.4384 7.7196 118.5504 53.9793 43.3054 176.0780 831 A 4.0317 8.8946 120.1131 52.0442 16.1200 178.1067 832 G 3.6845 8.7126 103.8773 48.1454 0.0000 175.9729 833 G 3.9555 8.4348 108.3333 44.2429 0.0000 175.6431 834 A 4.5258 7.4994 122.3297 51.8516 16.4381 175.1495 835 V 4.8625 8.0569 119.4677 60.8867 35.4577 173.9474 836 V 4.8553 8.5582 127.0948 60.9991 34.1529 174.4694 837 L 4.7861 8.9493 128.8729 54.6585 43.1629 176.2006 838 A 5.1097 9.1713 124.5129 49.7200 22.1812 175.2187 839 L 4.4991 8.7796 125.7345 56.1458 42.9080 173.9962 840 E 4.3256 8.9132 123.2346 56.9647 31.3836 179.1368 841 G 4.0777 9.2626 122.8126 45.5841 0.0000 172.9712 842 G 4.4238 9.8435 107.5029 46.5471 0.0000 173.1732 843 H 4.7984 8.6801 115.5333 53.8379 30.5769 173.3339 844 D 4.3147 7.8438 120.5368 53.7643 41.4966 175.9462 845 L 4.0421 8.5856 128.5395 58.1182 41.7395 179.6756 846 T 3.8540 7.9389 108.8587 64.6413 69.0958 176.1510 847 A 3.9588 8.2766 124.5146 55.0606 18.3815 179.7723 848 I 3.6579 7.9541 110.6655 63.5952 37.6382 178.2044 849 C 4.0464 7.7085 118.8052 62.6892 28.3553 175.1714 850 D 4.3262 8.4123 120.5922 57.7041 40.4374 179.1592 851 A 3.8742 7.7147 120.4691 54.5159 18.4674 179.8306 852 S 3.5964 7.2758 113.6923 61.4423 62.8745 176.1531 853 E 3.8346 8.0897 121.7295 59.4046 29.2425 178.4975 854 A 3.9857 7.6537 119.9173 55.6412 18.3234 179.4203 855 C 4.1267 7.9057 114.8602 63.0333 27.9971 176.6165 856 V 3.5932 7.8786 118.7569 65.7013 31.3070 177.4315 857 A 4.1385 8.4119 120.8183 55.4097 18.3536 179.4034 858 A 4.2610 8.1680 120.4257 54.8611 18.2364 179.7761 859 L 4.1020 8.1175 116.6153 57.5904 41.7054 178.7565 860 L 4.5019 7.8824 117.0134 54.5579 41.6963 177.4779 861 G 3.9533 7.9301 107.1474 45.2758 0.0000 173.5083 862 N 4.6006 7.8989 118.1299 53.0121 39.7564 174.0039 863 R 4.7198 8.3583 122.5132 54.3142 33.3303 175.0937 864 V 4.2233 8.3766 120.3491 61.0412 33.2838 174.5921 865 D 4.5774 8.3585 126.8228 52.7448 41.2656 174.9888 866 P 4.3462 0.0000 0.0000 64.4161 31.5885 177.1375 867 L 4.3119 8.2715 117.6654 55.1655 41.8391 177.4260 868 S 4.2716 7.4243 112.6615 58.5297 63.6889 173.7763 869 E 4.3403 7.2885 121.6952 54.3244 31.0173 176.7026 870 E 3.9781 8.6557 123.9646 58.9383 29.8696 179.2983 871 G 3.7129 7.9011 106.4772 47.4756 0.0000 174.1915 872 W 4.6059 7.8404 118.3658 57.0947 29.3664 176.7599 873 K 4.2959 7.6695 119.5632 57.3779 32.4106 176.7228 874 Q 4.3028 7.8164 115.6645 55.3435 29.5161 175.2786 875 K 4.3215 8.2009 118.3552 54.5087 33.1238 175.4866 876 P 4.3683 0.0000 0.0000 62.9368 31.7167 176.3810 877 N 4.5663 8.8873 119.1254 52.6453 39.3074 176.1111 878 L 4.0044 8.2502 121.6629 58.0716 42.2273 178.1422 879 N 4.2650 8.3064 115.9333 56.4947 38.3775 176.9698 880 A 4.1823 8.3317 121.8258 54.9905 18.4868 179.4268 881 I 3.6799 7.7896 118.4059 65.0172 37.3832 178.8668 882 R 4.0498 8.3240 118.7074 59.3475 29.7050 179.4030 883 S 4.2219 8.3829 115.1012 61.5138 62.7557 176.7653 884 L 3.9399 8.2387 121.9001 57.7072 41.3447 179.0384 885 E 3.9205 8.6546 118.8192 59.4639 29.4316 179.2659 886 A 3.9563 7.8343 119.9582 55.2194 18.4983 179.5387 887 V 3.5366 7.3980 116.5576 66.3825 31.4939 178.0076 888 I 3.6670 7.8612 119.3693 64.5236 36.7772 178.0932 889 R 3.8634 7.8639 117.9084 59.6179 29.7473 178.4215 890 V 3.7375 7.8816 117.6517 66.2463 31.6340 177.1759 891 H 4.5999 8.8899 114.6147 56.6449 28.6383 177.2039 892 S 4.4132 8.2385 118.4264 60.9035 62.5594 176.2829 893 K 3.7384 7.3335 121.5825 58.4515 31.8216 176.7908 894 Y 4.3602 7.9389 114.7869 57.0632 40.3193 175.6435 895 W 4.8988 7.8956 119.6216 54.3228 32.1990 175.9703 896 G 3.8918 9.3965 113.2533 48.6898 0.0000 174.8262 897 C 4.3322 8.5590 113.2597 60.1043 29.7500 174.0315 898 M 4.5137 8.1230 119.3519 55.1722 32.2500 176.0684 899 Q 4.1668 7.9932 124.4451 56.1687 28.9043 175.7480 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 519 T 8.03 4.44 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 0.00 520 T 8.37 4.49 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 1.36 0.00 0.00 521 G 9.65 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 0.00 0.00 0.00 0.00 522 L 9.03 5.68 0.00 1.94 1.97 0.99 1.06 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 0.00 523 I 8.33 5.06 1.86 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 1.17 1.15 0.98 0.00 0.00 524 Y 8.37 4.60 0.00 1.81 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 0.00 525 D 6.91 4.24 0.00 2.97 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 0.00 0.00 0.00 526 S 8.00 3.78 0.00 3.88 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 527 V 6.90 3.14 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.28 0.00 0.00 528 M 7.30 4.10 0.00 2.12 1.94 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.75 0.00 529 L 7.50 3.91 0.00 1.56 1.68 0.90 0.82 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 0.00 530 K 7.20 3.86 0.00 1.75 1.46 0.00 1.38 0.00 0.00 1.22 0.00 0.00 2.72 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.25 1.12 7.81 531 H 7.47 4.26 0.00 2.79 3.19 0.00 5.98 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 532 Q 7.96 4.35 0.00 2.09 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.70 0.00 0.00 0.00 0.00 0.00 2.28 2.21 0.00 533 C 8.34 4.13 0.00 2.73 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 0.00 534 S 8.69 4.22 0.00 4.04 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 535 C 8.17 4.10 0.00 3.16 3.40 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 0.00 536 G 7.89 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 537 D 7.41 4.69 0.00 2.69 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 538 N 8.70 4.80 0.00 2.65 2.58 0.00 0.00 7.06 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 0.00 539 S 8.05 4.64 0.00 3.98 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 0.00 540 R 7.52 4.38 0.00 1.86 2.00 0.00 2.97 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.25 0.00 541 H 7.76 4.85 0.00 3.14 3.27 0.00 5.71 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 542 P 0.00 4.30 0.00 1.85 2.00 0.00 3.81 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.93 0.00 543 E 7.27 3.98 0.00 1.16 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 544 H 7.53 4.99 0.00 3.45 3.55 0.00 5.71 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 545 A 8.60 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 0.00 546 G 8.39 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 0.00 547 R 8.04 3.97 0.00 1.93 2.03 0.00 3.14 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.44 0.00 548 I 7.73 3.97 2.08 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.88 0.99 0.00 0.00 549 Q 8.09 4.16 0.00 2.29 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00 550 S 8.38 4.18 0.00 4.14 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 0.00 551 I 7.63 3.76 2.05 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.82 1.22 0.00 0.00 552 W 8.28 4.24 0.00 2.87 2.87 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 0.00 553 S 8.17 4.03 0.00 4.10 4.26 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 0.00 554 R 8.06 4.63 0.00 1.94 2.11 0.00 3.15 0.00 0.00 3.24 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 555 L 7.87 4.03 0.00 1.43 1.54 1.12 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 556 Q 7.47 3.72 0.00 1.84 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.69 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 557 E 8.24 3.85 0.00 2.14 1.98 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 2.30 2.36 0.00 558 R 7.96 4.33 0.00 1.77 1.86 0.00 3.32 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.65 0.00 559 G 8.40 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 0.00 560 L 7.37 4.23 0.00 1.57 1.71 0.91 0.87 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 0.00 561 R 8.11 3.79 0.00 1.56 1.72 0.00 2.35 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.13 0.00 562 S 7.26 4.13 0.00 3.89 3.92 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 0.00 563 Q 7.78 4.31 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.71 0.00 0.00 0.00 0.00 0.00 2.37 2.65 0.00 564 C 7.14 4.94 0.00 2.83 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 0.00 565 E 9.06 4.32 0.00 2.14 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 2.40 0.00 566 C 8.73 5.13 0.00 3.05 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 567 L 9.34 4.88 0.00 1.73 1.59 0.98 0.84 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 0.00 568 R 8.20 4.51 0.00 1.92 2.21 0.00 3.50 0.00 0.00 2.25 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 569 G 9.23 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 570 R 6.44 2.85 0.00 1.40 1.58 0.00 2.75 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.20 0.00 571 K 7.87 4.32 0.00 1.58 1.75 0.00 1.83 0.00 0.00 1.85 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.61 1.78 7.81 572 A 8.69 4.16 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 573 S 8.74 4.20 0.00 4.13 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 0.00 574 L 8.42 3.92 0.00 1.71 1.73 0.89 0.88 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 0.00 575 E 8.00 4.03 0.00 1.88 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 2.29 2.44 0.00 576 E 7.97 4.23 0.00 2.12 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 2.25 2.26 0.00 577 L 7.77 3.94 0.00 1.72 1.47 0.32 0.56 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 0.00 578 Q 8.08 4.69 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.97 0.00 0.00 0.00 0.00 0.00 2.41 2.23 0.00 579 S 7.80 4.35 0.00 4.06 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 0.00 580 V 7.69 4.11 1.98 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 0.69 0.00 0.00 0.88 0.00 0.00 581 H 8.22 5.13 0.00 3.45 3.30 0.00 5.67 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 582 S 7.92 4.61 0.00 4.01 3.67 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 0.00 583 E 8.83 3.94 0.00 2.04 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 0.00 2.56 2.38 0.00 584 R 8.04 3.85 0.00 1.86 1.94 0.00 3.16 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 585 H 8.24 4.15 0.00 3.39 3.58 0.00 5.84 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 0.00 586 V 8.16 3.86 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.11 0.00 0.00 587 L 8.12 3.99 0.00 1.83 1.66 0.91 0.37 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 0.00 588 L 7.88 3.65 0.00 1.40 1.08 0.48 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 589 Y 7.43 4.63 0.00 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0.00 0.00 0.00 0.76 0.36 0.60 0.00 0.00 728 S 8.47 4.92 0.00 3.32 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 729 L 8.39 5.06 0.00 1.80 1.58 1.08 0.87 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 0.00 730 H 8.19 5.12 0.00 3.60 3.55 0.00 5.46 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 731 R 8.95 4.55 0.00 1.20 1.27 0.00 2.39 0.00 0.00 2.25 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.26 0.00 732 H 9.24 4.70 0.00 3.23 3.46 0.00 5.83 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 733 D 9.33 4.45 0.00 2.90 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 734 D 9.21 4.33 0.00 2.82 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 0.00 735 G 8.26 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 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.99 0.00 0.00 745 D 8.02 4.39 0.00 2.72 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 746 E 8.01 4.46 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.29 0.00 747 V 8.22 4.70 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.80 0.00 0.00 748 G 8.58 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 0.00 0.00 0.00 749 A 8.01 4.60 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 0.00 750 G 8.43 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 0.00 751 S 8.94 4.17 0.00 3.86 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 0.00 752 G 8.25 4.00 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 0.00 761 W 9.25 4.88 0.00 3.46 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 0.00 762 A 9.28 5.16 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 0.00 763 G 8.77 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 764 G 8.00 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 0.00 765 L 8.35 4.48 0.00 1.81 1.76 1.05 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 766 D 7.71 4.79 0.00 2.56 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 767 P 0.00 4.52 0.00 2.01 1.94 0.00 3.68 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.07 0.00 768 P 0.00 4.88 0.00 1.80 1.86 0.00 3.63 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 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0.00 0.00 0.00 0.00 0.00 1.96 1.91 0.00 827 L 8.12 4.19 0.00 2.04 1.84 1.16 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 828 M 7.90 4.39 0.00 2.10 2.32 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.65 0.00 829 N 7.99 4.56 0.00 2.91 2.89 0.00 0.00 6.91 7.32 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 0.00 830 L 7.72 4.44 0.00 1.89 1.59 0.92 0.65 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 0.00 831 A 8.89 4.03 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 0.00 832 G 8.71 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 833 G 8.43 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 0.00 834 A 7.50 4.53 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 0.00 835 V 8.06 4.86 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.04 0.00 0.00 836 V 8.56 4.86 2.13 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 1.01 0.00 0.00 0.98 0.00 0.00 837 L 8.95 4.79 0.00 2.14 1.78 1.13 0.65 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 0.00 838 A 9.17 5.11 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 0.00 839 L 8.78 4.50 0.00 1.95 1.79 1.13 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 840 E 8.91 4.33 0.00 1.93 1.16 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 2.30 2.16 0.00 841 G 9.26 4.08 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 0.00 0.00 0.00 842 G 9.84 4.42 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 0.00 843 H 8.68 4.80 0.00 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0.00 0.00 868 S 7.42 4.27 0.00 3.77 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 0.00 869 E 7.29 4.34 0.00 1.16 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 1.47 1.47 0.00 870 E 8.66 3.98 0.00 1.94 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 2.33 2.21 0.00 871 G 7.90 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 872 W 7.84 4.61 0.00 3.25 3.13 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 0.00 0.00 0.00 0.00 873 K 7.67 4.30 0.00 1.74 1.84 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.38 7.81 874 Q 7.82 4.30 0.00 2.20 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.67 0.00 0.00 0.00 0.00 0.00 2.50 2.38 0.00 875 K 8.20 4.32 0.00 1.75 1.76 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.41 7.81 876 P 0.00 4.37 0.00 2.13 2.01 0.00 3.75 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 877 N 8.89 4.57 0.00 2.94 2.91 0.00 0.00 6.59 7.02 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 0.00 878 L 8.25 4.00 0.00 1.77 1.68 0.93 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 879 N 8.31 4.27 0.00 2.94 3.13 0.00 0.00 7.05 7.18 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 0.00 880 A 8.33 4.18 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 881 I 7.79 3.68 2.06 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 1.78 0.83 0.93 0.00 0.00 882 R 8.32 4.05 0.00 2.08 2.01 0.00 3.14 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 883 S 8.38 4.22 0.00 4.33 4.17 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 0.00 884 L 8.24 3.94 0.00 1.88 1.71 1.02 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 885 E 8.65 3.92 0.00 2.16 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 2.62 0.00 886 A 7.83 3.96 1.40 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 0.00 887 V 7.40 3.54 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 0.92 0.00 0.00 0.86 0.00 0.00 888 I 7.86 3.67 2.02 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 1.40 0.52 0.92 0.00 0.00 889 R 7.86 3.86 0.00 1.97 2.17 0.00 3.26 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 890 V 7.88 3.74 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 1.02 0.00 0.00 0.98 0.00 0.00 891 H 8.89 4.60 0.00 3.41 3.63 0.00 5.70 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 892 S 8.24 4.41 0.00 3.96 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 0.00 893 K 7.33 3.74 0.00 1.37 1.17 0.00 1.45 0.00 0.00 1.18 0.00 0.00 2.83 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.30 1.00 7.81 894 Y 7.94 4.36 0.00 2.71 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 895 W 7.90 4.90 0.00 3.39 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 0.00 896 G 9.40 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 897 C 8.56 4.33 0.00 3.13 3.20 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 0.00 898 M 8.12 4.51 0.00 2.13 2.34 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.66 0.00 899 Q 7.99 4.17 0.00 2.30 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.55 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 * Residues marked with a * may have inaccurate shift predictions.