NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 489 L 4.3061 8.1429 120.7609 54.5065 43.8246 179.4845 490 T 3.9094 7.8105 113.6986 65.5056 68.3204 179.0321 491 L 4.1573 8.0310 125.0917 60.3633 41.4398 182.5390 492 D 4.5871 8.1154 124.4405 58.8929 39.7426 180.8680 493 T 4.0825 8.0519 118.1924 66.7434 68.3877 179.4752 494 R 3.9270 7.6497 123.5233 60.9533 29.2860 180.4274 495 L 3.8413 7.5740 121.4401 57.7033 41.9568 178.8739 496 R 3.7906 8.0911 118.9064 59.7338 30.0531 178.4250 497 Q 3.9171 7.9977 117.3675 58.8311 28.6700 178.7486 498 A 4.0508 8.0415 121.8032 55.1784 18.1489 179.6283 499 L 3.6533 8.0347 117.7384 58.0299 41.4721 179.7035 500 E 3.9532 8.2255 117.4681 58.7404 29.4590 178.6484 501 R 4.3506 7.6336 114.8112 54.6900 31.0443 175.7604 502 N 3.9499 7.5022 114.9972 54.7251 36.7759 174.2800 503 E 4.6089 8.5496 113.8335 56.2681 30.9847 176.5272 504 L 5.3623 7.5404 119.2304 53.2302 44.1381 176.1695 505 V 4.9285 8.6951 119.9204 60.2993 35.3033 173.9421 506 L 4.7807 8.6831 122.3218 54.3341 42.7390 175.9461 507 H 5.1004 9.0309 120.7670 54.5619 32.0407 173.3845 508 Y 5.1063 9.0499 117.3098 56.4450 41.7815 174.3224 509 Q 4.8604 9.0192 126.1700 54.0316 30.5899 173.0779 510 P 5.0784 0.0000 0.0000 63.4567 32.3580 175.5964 511 I 4.7035 8.9651 124.7737 59.5783 39.8086 174.7076 512 V 4.8796 8.9105 127.2170 60.7827 34.6888 174.2567 513 E 4.8113 9.5562 128.8841 56.2246 29.6908 177.0314 514 L 4.0436 8.9754 128.3985 57.3845 41.6311 179.1665 515 A 4.1590 8.2121 120.7600 54.4271 18.6279 178.1306 516 S 4.4399 8.2456 108.6968 58.0538 64.3217 175.4560 517 G 3.9987 8.9674 108.0662 44.9194 0.0000 172.9695 518 R 4.2640 7.9365 121.4933 55.8361 31.3172 175.6193 519 I 4.4173 9.0288 128.3800 61.7727 37.2615 176.1718 520 V 4.3777 8.9984 119.8542 61.0913 34.1536 175.2886 521 G 5.0195 7.8155 106.8761 45.6738 0.0000 171.9578 522 G 4.6345 8.4093 104.1782 45.2230 0.0000 172.0146 523 E 4.9615 9.1751 126.6287 54.7298 31.0733 175.1053 524 A 4.3278 9.0220 130.4892 51.9137 19.3208 176.6472 525 L 4.6818 8.6578 122.2607 52.7975 45.9377 176.0367 526 V 4.3818 8.5581 124.2320 62.7909 32.4443 175.2683 527 R 4.7978 9.2015 126.4824 54.1171 33.9536 174.0640 528 W 5.1112 8.9928 134.8239 56.7294 32.2568 175.6130 529 E 4.1990 8.4268 127.8063 54.8372 31.2922 173.5544 530 D 3.3700 7.5332 124.7965 52.0301 39.9176 172.6907 *547 D 4.3766 8.4874 124.0776 53.2252 42.4264 175.5046 548 T 3.9645 8.5663 121.8204 65.2157 67.2959 175.8370 549 G 3.6384 8.1592 107.2713 47.6826 0.0000 175.2265 550 L 3.9276 7.8677 122.7512 57.9101 42.1572 178.9460 551 I 3.6876 7.5747 119.3296 64.4236 36.9938 178.5553 552 V 3.5823 7.9758 118.6017 66.0633 31.5480 177.9546 553 A 4.0130 8.1938 120.6732 54.9770 18.1608 179.3335 554 L 4.0103 8.3059 119.2549 58.4499 42.2014 179.1939 555 S 4.1367 8.2711 113.0695 61.3702 62.3019 175.5148 556 D 4.3911 8.3634 121.8503 57.3505 40.5570 178.9444 557 W 4.0852 8.1509 127.9839 60.4194 30.7716 178.1471 558 V 2.9092 8.2973 118.6096 65.7209 30.9333 177.8995 559 L 3.8315 8.1514 119.0002 57.7507 41.4332 179.1864 560 E 3.7536 7.9693 118.8371 59.0986 29.5581 178.5000 561 A 3.6520 7.6149 121.1184 55.2011 18.3134 179.1812 562 C 3.9542 8.0654 117.3552 62.8758 31.6426 175.6041 563 C 4.0749 7.8723 118.2989 63.0360 27.5786 176.2626 564 T 3.7368 7.9433 117.5325 66.4234 67.9743 176.5177 565 Q 3.3711 7.8650 121.4988 58.8035 28.9388 178.0701 566 L 3.7528 7.4064 121.1986 58.0192 42.0825 178.7194 567 R 4.0588 8.1950 119.7760 58.7669 29.9994 178.1167 568 A 3.9422 8.0620 120.7216 55.2071 18.3049 179.7020 569 W 4.4383 8.0338 117.2968 59.9196 29.1241 178.8606 570 Q 4.0493 8.4819 118.2469 59.2693 28.0152 178.9323 571 Q 4.1614 8.1355 117.6498 58.4813 28.8009 177.6636 572 Q 4.3646 8.0070 118.1469 55.7014 29.2678 176.1075 573 G 3.9363 7.7929 106.5492 47.0331 0.0000 174.6591 574 R 4.1416 8.2335 119.8631 56.5177 31.0718 176.6354 575 A 4.4262 7.7615 120.5400 50.1693 20.0324 176.7098 576 A 4.2958 8.3066 125.9433 51.9368 19.2608 177.9606 577 D 4.4446 8.5450 119.4071 57.2261 40.9420 177.7422 578 D 4.5541 7.9502 116.1642 53.9939 40.0464 175.9604 579 L 4.5650 7.7087 123.8658 55.3480 42.7354 175.9712 580 T 4.9508 8.6366 114.8927 59.9146 72.6980 172.5871 581 L 5.3621 8.6754 121.2585 53.1464 45.9570 175.7337 582 S 5.3842 9.0664 117.1259 56.8078 66.5603 173.3313 583 V 4.6898 8.6222 122.7810 61.1003 34.6179 174.0760 584 N 5.2228 8.7785 124.4825 52.8398 39.5726 174.4196 585 I 4.6748 8.5678 124.4393 59.3657 40.0615 175.7337 586 S 4.4315 9.3474 122.2125 57.8052 63.0548 175.0793 587 T 4.3191 8.7043 116.1089 64.9676 68.4855 175.9119 588 R 4.2227 8.2260 119.4570 57.7762 30.0556 176.9470 589 Q 4.2981 7.9524 116.4117 56.1596 28.8958 176.2897 590 F 4.4186 7.7714 116.4646 57.6495 39.4972 175.5686 591 E 4.0494 8.1382 123.0589 56.7392 30.2740 177.6897 592 G 3.8289 8.5615 115.5935 45.6260 0.0000 172.7719 593 E 4.4349 8.4724 120.8292 56.5040 30.2831 178.2128 594 H 4.2967 8.0036 118.1238 59.4402 29.8219 176.7531 595 L 3.7360 7.6890 121.8767 58.4597 41.9934 178.8419 596 T 3.8026 7.7826 115.1735 66.6117 68.3173 176.3782 597 R 3.8184 7.7058 119.8865 59.3035 30.0285 178.5031 598 A 3.8696 8.0645 120.9706 55.0127 18.3351 179.8192 599 V 3.4501 7.9973 117.1074 66.1944 31.5472 177.8418 600 D 4.3278 8.2570 118.9029 57.3913 40.6654 178.9043 601 R 3.8080 8.1971 118.8982 59.3418 30.1597 178.2185 602 A 3.9426 8.0603 120.6239 55.3502 18.3461 179.6634 603 L 3.8897 8.0819 117.1566 57.7208 41.4406 179.6369 604 A 3.9500 7.9829 119.9610 55.3525 18.4480 179.6767 605 R 4.0215 7.8866 115.5924 59.2357 30.2249 179.0612 606 S 4.3042 7.9761 113.1753 58.9074 63.3060 175.5231 607 G 3.8526 7.8631 108.8595 45.4205 0.0000 173.2657 608 L 3.9873 7.5397 121.5880 54.1627 42.7056 176.8255 609 R 3.9547 8.5375 125.8939 55.9296 30.6729 175.4515 610 P 4.2279 0.0000 0.0000 65.5762 31.5172 177.6663 611 D 4.8471 7.8368 114.5322 54.3137 39.7597 176.8062 612 C 4.2605 8.4287 118.5573 61.3580 28.6526 172.4301 613 L 5.1807 7.9382 122.9850 53.0983 43.9858 174.6572 614 E 5.1742 8.9776 126.3161 54.3669 33.2077 174.0703 615 L 5.1262 9.0617 126.4456 53.1152 44.5641 175.0970 616 E 5.1078 9.4116 124.3426 55.0729 31.4252 174.9997 617 I 5.0601 8.8303 126.4673 59.3252 40.2358 175.4953 618 T 4.3416 8.6878 121.7128 62.0132 68.0367 174.2374 619 E 3.9066 8.7539 128.8351 59.8077 29.6106 178.1640 620 N 4.6651 8.1701 112.0348 54.3091 38.9390 176.8529 621 V 3.8358 7.8538 122.1433 61.1427 30.1379 177.8475 *623 L 4.3386 7.7926 119.6326 55.0370 43.7796 177.6978 624 V 4.2311 7.4154 112.0408 59.3560 33.7057 175.8281 *626 T 4.1226 8.1083 114.2863 61.2943 71.0259 174.3963 627 D 4.3205 8.4507 119.9828 57.8404 40.6921 179.1709 628 E 3.9672 8.0771 118.3743 59.1984 29.4895 179.4351 629 V 3.5528 7.5732 118.2380 66.1006 31.6520 178.2385 630 R 3.8115 8.1361 118.1205 59.5971 29.8468 179.2535 631 T 3.8590 8.1169 115.5958 66.6076 68.3713 176.1863 632 C 4.1097 8.2246 120.6144 62.6530 31.5650 175.6986 633 L 3.9835 8.1130 120.4651 57.9602 41.1993 179.2509 634 D 4.2823 8.2082 118.5833 57.1856 40.4743 178.7741 635 A 3.9896 7.9342 120.4755 55.1065 18.7669 179.3748 636 L 4.0585 8.1351 117.7198 57.9406 41.7322 179.6702 637 R 3.8796 8.1755 118.5126 59.4475 29.7932 178.3977 638 A 4.0723 7.9281 119.1724 54.6295 18.4145 178.9490 639 R 4.1918 7.5733 114.3977 56.7413 30.6407 177.5591 640 G 3.9375 8.1766 108.2124 44.6733 0.0000 173.5263 641 V 4.0261 7.2242 119.1855 62.7499 32.4982 175.7428 642 R 4.3748 8.7849 125.7801 55.8696 31.7403 175.3978 643 L 5.4012 8.8542 121.1586 52.9811 45.3535 175.2768 644 A 5.3871 9.4730 124.8459 50.1558 22.9690 174.7660 645 L 4.6760 8.6626 121.3244 53.8541 43.1003 176.0204 646 D 4.9265 9.1869 124.5348 53.0572 43.9980 175.4841 647 D 4.6275 8.7015 117.9583 54.1404 38.8736 173.6035 648 F 4.5333 8.4149 121.5448 59.5604 39.8775 175.5051 649 G 3.7908 8.3006 116.6055 45.5011 0.0000 174.4114 650 T 4.3400 7.6535 107.7778 61.8639 70.0980 175.1739 651 G 4.2620 7.7613 112.0201 44.5264 0.0000 171.5861 652 Y 4.5718 8.7518 118.3637 56.1536 40.7028 175.2027 653 S 4.8360 8.4817 119.6931 56.5594 65.9105 173.9874 654 S 4.4071 8.4352 118.1814 57.4432 63.3625 175.3352 655 L 4.1122 8.4755 129.6109 57.4345 41.6874 179.4308 656 S 4.2830 7.8766 114.1017 61.8338 63.0715 175.9232 657 Y 4.4202 7.9317 121.3593 60.5259 37.4181 178.4952 658 L 4.0645 8.2980 120.5024 58.2216 42.2619 178.6179 659 S 4.4475 7.9257 112.5819 59.7737 63.0542 174.6810 660 Q 4.5466 7.7949 119.0853 56.5845 30.8716 176.3179 661 L 4.2646 8.0325 117.1569 53.8910 42.3953 174.9595 662 P 4.4970 0.0000 0.0000 62.7602 31.4167 176.5374 663 F 4.4051 7.8990 117.0762 58.4635 39.9255 176.0148 664 H 4.6829 8.9879 122.5208 57.1980 29.3690 175.3755 665 G 4.3891 7.9375 104.2311 45.0163 0.0000 171.8103 666 L 5.2402 8.8764 119.7455 52.5148 46.2175 175.9085 667 K 5.1196 9.0079 121.3808 54.4626 35.2161 175.7536 668 I 4.2834 8.7455 127.4430 61.0760 38.1191 175.4305 669 D 4.9552 9.3044 127.0882 53.7687 41.8451 177.2642 670 Q 4.6313 9.5329 125.0899 58.9864 28.1275 179.2855 671 S 3.9568 8.0405 115.1339 60.7171 63.0772 176.1253 672 F 4.5960 7.5291 121.3693 60.0237 39.0169 177.9336 673 V 3.7118 7.9372 117.6474 65.9721 31.1139 177.5598 674 R 4.1955 8.0407 112.3031 57.5085 29.6235 176.9123 675 K 4.4873 8.2495 118.0333 56.0507 33.0420 175.5225 676 I 4.4120 7.3102 112.9311 58.8557 39.0469 173.9515 677 P 4.2118 0.0000 0.0000 62.0485 31.8374 176.7865 678 A 3.9437 7.8850 122.7141 55.4329 18.6761 177.6992 679 H 4.6282 8.1173 114.9089 54.1575 29.4986 174.3894 680 P 4.2326 0.0000 0.0000 65.6531 31.2001 178.5425 681 S 4.0498 7.9995 111.1556 61.6420 62.4867 175.9341 682 E 4.0652 8.1743 120.6981 59.6388 29.1083 179.4724 683 T 3.8621 7.9888 116.1474 66.6172 68.4875 176.8630 684 Q 4.2244 8.3149 121.2221 58.6790 28.4859 178.5840 685 I 3.4963 7.7786 121.8256 64.0890 37.0819 178.5384 686 V 3.6017 7.7790 119.2315 66.3095 31.3264 178.2795 687 T 3.9992 8.1742 109.5352 64.8574 68.5132 176.7849 688 T 3.8530 8.1334 118.8041 66.5877 68.4529 176.4430 689 I 3.7963 7.9331 121.8251 64.6124 37.1553 178.4107 690 L 3.9420 8.0662 119.3542 57.7649 41.2805 179.5549 691 A 3.9830 7.9109 120.5428 54.8936 18.4343 179.4897 692 L 3.9043 8.2907 117.7386 58.0942 41.5615 179.6568 693 A 3.9490 7.8955 119.0682 55.1483 18.2857 179.4080 694 R 4.1020 8.0245 116.7028 59.6270 29.9974 179.6420 695 G 3.6260 7.7160 103.7352 47.0650 0.0000 174.7766 696 L 4.6012 7.6175 118.4022 53.0756 42.8367 175.3413 697 G 3.6392 7.3820 111.4731 45.4195 0.0000 172.7791 *699 E 4.3494 7.8747 123.6808 56.2020 32.0041 174.4280 700 V 4.9231 8.9261 121.9847 61.1711 34.7299 174.2367 701 V 4.8795 8.7082 127.3909 61.1623 33.8964 174.1195 702 A 4.7158 9.0228 130.7879 51.1695 20.0264 175.8304 703 E 4.3612 9.0091 124.6068 56.2489 31.4606 176.8798 704 G 3.8055 8.8703 113.0549 46.2425 0.0000 173.4615 705 I 3.8442 7.9270 121.4104 61.4930 37.2328 176.6603 706 E 4.5886 9.6505 125.4068 56.4436 31.8815 176.7991 707 T 4.7746 7.7340 107.5439 58.9945 73.3391 174.5959 708 A 4.0898 8.4958 123.4501 55.1772 18.3492 179.9738 709 Q 3.9985 8.0865 118.0297 59.3725 29.1372 178.2584 710 Q 4.0477 7.9903 119.0464 59.1274 28.6214 177.8332 711 Y 3.9849 8.0489 120.0775 60.8756 38.8039 178.3425 712 A 4.1544 8.3287 121.4449 55.0502 17.8931 179.0334 713 F 3.9991 8.6280 119.6370 61.7281 39.5077 177.3937 714 L 4.0364 8.3491 118.4470 57.7994 41.4710 179.5912 715 R 3.7995 8.0045 118.5910 59.3808 29.8752 177.6870 716 D 4.6410 7.8843 115.1043 55.2722 40.7110 176.7957 717 R 4.3314 6.7596 114.2201 55.4806 31.1411 176.2796 718 G 3.7159 8.1409 104.9175 45.8186 0.0000 173.6663 719 C 4.0431 7.5831 119.6867 59.2358 31.8612 173.1805 720 E 3.7791 8.7730 127.3496 58.8950 29.8505 176.9696 721 F 5.7021 8.1117 116.3121 56.0083 43.8402 174.1592 722 G 4.6926 9.1560 106.4437 45.3865 0.0000 171.8772 723 Q 5.0254 9.0321 118.7109 53.9814 32.2972 174.1002 724 G 4.4115 8.3843 109.7688 46.3439 0.0000 172.7346 725 N 4.5795 8.3292 117.5172 55.6239 38.7082 177.0178 726 L 3.8573 7.5717 118.6646 56.9500 42.3181 176.5433 *728 S 4.1777 7.7999 111.5959 58.6464 63.0504 173.1360 729 T 4.5324 8.2836 117.3839 60.2188 69.7370 172.0274 730 P 4.6648 0.0000 0.0000 63.4422 31.9906 176.0764 731 Q 4.8570 9.1900 122.3026 53.5881 32.4466 175.4681 732 A 4.2138 8.5287 124.6314 51.9858 19.4956 178.2731 733 A 4.4908 9.1876 122.0640 55.9916 18.3243 180.2329 734 D 4.4122 8.3427 116.3286 57.5073 40.8452 178.7409 735 A 4.0110 8.0718 120.8437 55.0036 18.5140 179.2438 736 F 3.8963 8.6673 119.1862 61.4865 39.4880 177.3221 737 A 3.3893 8.2202 120.3707 54.8071 18.0137 179.6595 738 S 3.9796 7.9645 113.9585 61.8373 62.8672 176.9202 739 L 3.8451 7.4243 121.6344 57.6124 41.2918 179.5508 740 L 3.7538 7.2876 118.4175 57.7223 41.5254 179.2276 741 D 4.2901 8.0077 118.8171 57.5619 40.7948 179.2200 742 R 3.9063 7.8600 118.4868 59.0743 29.7907 178.9065 743 Q 3.9059 7.7504 118.7598 58.9612 29.1203 177.8481 744 K 4.0212 7.8491 119.4842 59.4626 32.3047 178.3910 745 A 4.1218 7.7289 120.0519 54.9686 18.4009 178.0232 746 S 4.3509 7.9627 117.2237 58.9888 63.0384 174.1699 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 489 L 8.14 4.31 0.00 1.59 1.75 0.92 0.45 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 0.00 490 T 7.81 3.91 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 1.21 0.00 0.00 491 L 8.03 4.16 0.00 1.64 1.70 0.92 1.07 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 0.00 492 D 8.12 4.59 0.00 2.68 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 493 T 8.05 4.08 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 1.21 0.00 0.00 494 R 7.65 3.93 0.00 1.85 1.97 0.00 3.24 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 495 L 7.57 3.84 0.00 1.58 1.71 0.81 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 496 R 8.09 3.79 0.00 1.92 2.02 0.00 3.11 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.63 0.00 497 Q 8.00 3.92 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 498 A 8.04 4.05 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 0.00 499 L 8.03 3.65 0.00 1.86 1.61 0.91 0.65 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 0.00 500 E 8.23 3.95 0.00 2.05 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 2.31 2.52 0.00 501 R 7.63 4.35 0.00 1.89 2.02 0.00 3.34 0.00 0.00 3.34 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 502 N 7.50 3.95 0.00 2.80 2.84 0.00 0.00 6.84 7.37 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 0.00 503 E 8.55 4.61 0.00 2.02 2.18 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 2.25 2.46 0.00 504 L 7.54 5.36 0.00 0.57 1.39 0.60 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 505 V 8.70 4.93 2.18 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 0.95 0.00 0.00 1.07 0.00 0.00 506 L 8.68 4.78 0.00 1.22 0.85 0.58 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 507 H 9.03 5.10 0.00 3.00 3.21 0.00 5.57 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 508 Y 9.05 5.11 0.00 2.43 2.37 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 0.00 509 Q 9.02 4.86 0.00 2.24 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 510 P 0.00 5.08 0.00 2.02 1.92 0.00 3.83 0.00 0.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 511 I 8.97 4.70 1.77 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.95 0.84 0.00 0.00 512 V 8.91 4.88 2.22 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 1.13 0.00 0.00 1.00 0.00 0.00 513 E 9.56 4.81 0.00 2.24 1.95 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 1.37 0.00 0.00 0.00 0.00 0.00 0.00 596 T 7.78 3.80 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 1.19 0.00 0.00 597 R 7.71 3.82 0.00 1.87 2.07 0.00 3.21 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 598 A 8.06 3.87 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 0.00 599 V 8.00 3.45 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.92 0.00 0.00 600 D 8.26 4.33 0.00 2.89 2.69 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 0.00 601 R 8.20 3.81 0.00 1.91 2.05 0.00 3.11 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 602 A 8.06 3.94 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 0.00 603 L 8.08 3.89 0.00 1.80 1.70 0.89 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 604 A 7.98 3.95 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 0.00 605 R 7.89 4.02 0.00 1.77 1.98 0.00 3.15 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 606 S 7.98 4.30 0.00 4.10 3.95 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 0.00 0.00 0.00 0.00 607 G 7.86 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 0.00 608 L 7.54 3.99 0.00 1.58 1.54 0.89 0.83 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 0.00 609 R 8.54 3.95 0.00 1.87 1.79 0.00 3.24 0.00 0.00 3.33 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.65 0.00 610 P 0.00 4.23 0.00 2.26 2.08 0.00 3.63 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.06 0.00 611 D 7.84 4.85 0.00 2.75 2.86 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 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0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 697 G 7.38 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *699 E 7.87 4.35 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 700 V 8.93 4.92 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.90 0.00 0.00 701 V 8.71 4.88 2.18 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 1.10 0.00 0.00 1.05 0.00 0.00 702 A 9.02 4.72 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 0.00 703 E 9.01 4.36 0.00 2.17 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 2.31 2.31 0.00 704 G 8.87 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 0.00 705 I 7.93 3.84 1.99 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.11 1.08 0.00 0.00 706 E 9.65 4.59 0.00 2.05 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 2.26 2.43 0.00 707 T 7.73 4.77 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 708 A 8.50 4.09 1.34 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 0.00 0.00 709 Q 8.09 4.00 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.86 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 710 Q 7.99 4.05 0.00 2.39 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.52 0.00 0.00 0.00 0.00 0.00 2.57 2.39 0.00 711 Y 8.05 3.98 0.00 3.19 3.14 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 0.00 712 A 8.33 4.15 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 0.00 713 F 8.63 4.00 0.00 3.26 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 714 L 8.35 4.04 0.00 1.81 1.66 1.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 715 R 8.00 3.80 0.00 1.84 1.92 0.00 3.14 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 716 D 7.88 4.64 0.00 2.62 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 717 R 6.76 4.33 0.00 1.61 1.70 0.00 2.30 0.00 0.00 2.53 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.22 0.00 718 G 8.14 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 0.00 719 C 7.58 4.04 0.00 2.93 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 0.00 720 E 8.77 3.78 0.00 1.32 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.05 0.00 721 F 8.11 5.70 0.00 3.12 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 0.00 722 G 9.16 4.69 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 0.00 723 Q 9.03 5.03 0.00 2.38 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.90 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 724 G 8.38 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 0.00 725 N 8.33 4.58 0.00 2.88 2.92 0.00 0.00 6.42 6.74 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 0.00 726 L 7.57 3.86 0.00 1.77 1.85 0.97 0.81 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 *728 S 7.80 4.18 0.00 3.90 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 0.00 729 T 8.28 4.53 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 730 P 0.00 4.66 0.00 2.06 2.13 0.00 3.68 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.20 0.00 731 Q 9.19 4.86 0.00 2.32 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.91 0.00 0.00 0.00 0.00 0.00 2.61 2.51 0.00 732 A 8.53 4.21 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 733 A 9.19 4.49 1.59 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 0.00 0.00 734 D 8.34 4.41 0.00 2.79 2.80 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 0.00 735 A 8.07 4.01 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 736 F 8.67 3.90 0.00 3.27 3.16 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 0.00 0.00 0.00 737 A 8.22 3.39 1.08 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 0.00 738 S 7.96 3.98 0.00 4.04 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 0.00 739 L 7.42 3.85 0.00 1.32 1.43 0.71 0.48 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 0.00 740 L 7.29 3.75 0.00 1.55 1.65 0.33 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 741 D 8.01 4.29 0.00 2.79 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 742 R 7.86 3.91 0.00 1.79 1.91 0.00 3.06 0.00 0.00 3.04 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 743 Q 7.75 3.91 0.00 1.97 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.96 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 744 K 7.85 4.02 0.00 1.85 1.93 0.00 1.82 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.43 7.81 745 A 7.73 4.12 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 0.00 746 S 7.96 4.35 0.00 3.99 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 * Residues marked with a * may have inaccurate shift predictions.