NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 514 G 4.0299 8.3549 108.0297 46.2159 0.0000 172.2855 515 K 4.6952 8.6742 118.7275 53.1025 34.9378 175.2947 516 F 4.6481 9.2282 125.5169 59.4608 40.5341 174.2202 517 S 4.1370 8.3617 119.9850 55.7236 64.5924 174.3216 518 R 3.5797 8.3544 128.1469 59.2031 29.9517 178.0192 519 A 3.8774 7.7461 120.1272 54.9228 18.4804 179.0519 520 L 3.8291 7.8955 118.9167 58.1176 42.1603 178.8337 521 K 2.0000 7.5658 119.3046 59.2746 31.8321 178.4076 522 N 4.2090 7.9717 116.4214 56.0198 38.1531 177.5464 523 R 3.8761 7.5261 119.2514 59.5712 30.5778 178.3679 524 L 4.2529 7.9305 118.7736 57.7724 41.7248 179.1872 525 E 4.1909 8.2790 118.2444 58.5278 29.1623 179.0634 526 S 4.2462 7.6956 113.5116 60.3938 63.1341 175.3192 527 A 4.3495 7.6213 122.5221 51.8388 19.3841 177.1752 528 N 4.5984 7.4371 115.3808 54.1309 39.3487 173.6923 529 Y 4.7604 8.9538 119.1970 56.0926 42.0585 173.9310 530 E 3.7651 8.9524 116.3871 57.4220 26.8458 174.7682 531 E 4.4098 7.8365 118.4595 56.3125 30.8822 177.0735 532 V 4.5850 9.2938 125.7836 59.8587 35.5019 173.6848 533 E 4.9839 8.7449 122.6159 54.6383 31.3453 174.9615 534 L 4.8804 8.8370 127.2025 51.8946 44.8388 174.3152 535 P 4.7926 0.0000 0.0000 62.4359 32.0539 174.0518 536 P 4.8960 0.0000 0.0000 61.3159 31.5397 175.1214 537 P 4.4580 0.0000 0.0000 62.3690 32.2055 176.6040 538 S 4.2479 8.7465 115.1502 61.3712 62.9947 173.9476 539 K 5.0306 6.3771 116.2958 56.5370 34.2335 173.7624 540 G 4.6621 7.7637 106.4720 45.5306 0.0000 172.1190 541 V 4.8023 7.6608 118.1121 60.0640 35.4986 173.8739 542 I 5.1482 8.5609 121.6437 59.8213 40.3521 175.0149 543 V 5.1796 9.0553 118.8194 57.8319 36.0351 172.9654 544 P 5.2094 0.0000 0.0000 61.9417 33.2174 175.0935 545 V 4.4062 8.7071 120.9613 61.1447 34.8934 174.1192 546 V 4.5887 8.2484 126.6935 61.5669 33.4971 174.1960 547 H 4.8397 8.7911 125.2680 54.1481 30.7224 173.7899 548 T 5.1104 8.2938 112.2099 59.9207 72.4306 173.4837 549 V 4.5339 8.0519 120.3968 59.4938 34.6086 176.4881 550 K 3.9573 8.7424 123.0832 59.5399 32.1781 177.8436 551 S 4.3610 8.0420 110.3481 59.1181 63.6424 173.8729 552 A 4.7402 7.7662 123.8863 49.9840 18.4247 173.8370 553 P 4.2510 0.0000 0.0000 62.9608 32.8249 178.4189 554 G 3.9345 8.7506 106.8497 45.9231 0.0000 172.6167 555 E 5.1968 7.5853 118.2425 54.8633 31.6710 175.1133 556 A 5.2800 9.0159 123.3794 51.3985 23.6196 174.7788 557 F 5.3172 8.2964 112.2161 56.1016 41.0343 173.4832 558 G 4.6087 9.1209 107.3673 45.1542 0.0000 172.0674 559 S 4.9706 9.1028 114.5710 57.1805 67.3452 172.2741 560 L 5.2892 8.5903 118.0205 53.0223 44.5866 175.7112 561 A 5.1895 9.0772 123.9291 50.1618 22.3895 174.6868 562 I 4.8258 8.8245 122.2704 59.4855 40.6398 174.2662 563 I 5.0719 8.8400 130.8161 59.7642 39.0739 174.7397 564 I 5.1280 9.0582 120.7113 58.2546 41.0992 173.3547 565 P 4.4606 0.0000 0.0000 63.7714 32.0484 175.8256 566 G 3.6073 8.8554 109.0711 44.8856 0.0000 173.0737 567 E 4.5379 7.6957 117.7926 54.9842 30.5018 176.5693 568 Y 4.9020 8.4717 126.5342 55.8611 38.9760 176.2236 569 P 3.8095 0.0000 0.0000 65.6858 31.3637 178.2522 570 E 3.8700 7.9400 115.5149 58.9057 29.3210 177.5801 571 L 4.2620 8.0441 117.2782 54.9891 42.1039 176.3530 572 L 4.6135 7.4494 119.4417 52.3557 43.5671 175.7956 573 D 4.4956 8.6496 120.8711 54.6976 41.7798 177.6882 574 A 4.1465 8.8152 127.6513 55.2314 18.6341 179.2674 575 N 4.5271 8.4752 112.2685 55.5340 38.8450 175.8225 576 Q 4.4456 8.0524 116.5005 56.0225 29.7532 175.9152 577 Q 4.8469 7.7799 119.4485 55.1008 27.1993 175.2607 578 V 4.5941 7.6715 119.2384 60.7428 35.9699 174.2417 579 L 4.4321 8.2247 127.8562 53.3570 43.6879 175.5292 580 S 4.5649 8.3294 122.2215 57.0013 66.3005 172.9148 581 H 5.2911 8.7382 117.9431 53.9038 32.3360 173.8786 582 F 4.7230 8.7706 120.7323 56.7461 39.4628 174.9783 583 A 4.0371 8.8593 121.6706 53.1117 19.0398 178.4943 584 N 4.0765 8.7719 115.8774 54.4451 36.8310 175.8952 585 D 4.9348 8.5477 115.1451 53.4183 41.2308 175.9928 586 T 4.5744 8.4421 114.5613 61.2608 69.8191 174.4306 587 G 4.3207 8.9013 107.0395 46.0703 0.0000 172.9073 588 S 5.0844 8.4835 112.9372 57.3468 68.0615 173.6754 589 V 4.9857 8.9262 120.9371 61.1094 34.7261 174.6733 590 W 4.6079 9.5261 128.6878 57.8041 30.3380 177.4886 591 G 4.4923 9.8637 112.1939 46.1357 0.0000 172.6468 592 I 4.7468 7.3820 119.9004 59.3814 39.3203 175.8141 593 G 3.8414 8.7426 113.8469 46.2077 0.0000 173.3181 594 E 4.6983 7.5158 118.4043 54.1052 32.9827 175.5620 595 D 4.4430 8.7036 122.7236 54.6829 41.8659 175.5161 596 I 4.1731 8.1035 122.1287 58.8206 38.7481 175.1074 597 P 4.4428 0.0000 0.0000 63.6514 31.6965 175.1711 598 F 5.0993 6.8762 112.8931 54.7998 40.9195 173.9102 599 E 4.6530 8.9192 119.9063 56.0004 30.4591 177.4100 600 G 3.3438 8.0139 111.3725 44.1492 0.0000 174.0314 601 D 4.7917 8.1234 121.8604 53.1995 40.0078 175.2253 602 N 4.0224 7.5962 112.5780 55.3257 35.8451 174.4040 *604 C 4.6390 7.6726 113.8382 60.0550 30.4423 173.6595 605 Y 5.4080 9.2121 119.2815 56.6109 42.5128 174.3560 606 T 5.3432 9.5159 116.5855 61.9856 72.3828 173.2544 607 A 5.0479 9.3618 129.0363 50.9279 19.8121 176.3791 608 L 4.8398 9.1813 123.0845 52.3215 45.3537 174.7695 609 P 4.6167 0.0000 0.0000 63.1920 32.4627 174.7593 610 L 4.6521 8.8188 127.9017 53.7365 42.3546 175.7820 611 K 4.2744 9.0790 129.3606 58.8719 33.1801 176.7380 612 E 4.8549 7.8812 118.3956 55.2724 33.1917 173.9793 613 I 4.6465 8.2905 127.3991 59.5205 38.7812 176.0123 614 K 4.3826 8.5325 125.4937 55.5569 32.9953 178.5014 615 R 4.0012 8.4200 119.0720 59.3051 30.0315 178.1286 616 N 4.3766 8.0451 112.8871 53.9991 37.2738 175.4921 617 G 4.0194 8.0630 108.4933 45.3151 0.0000 173.5256 618 N 4.8388 8.5239 117.8187 53.3477 40.0286 174.0238 619 I 4.9197 8.3601 115.3496 59.1637 40.5681 174.3606 620 V 4.7242 9.0550 126.4279 61.6409 33.3415 174.7368 621 V 5.0777 9.0131 126.3500 60.7179 35.5629 173.4708 622 E 4.9282 8.3160 121.8345 54.8882 33.1990 173.6732 623 K 4.4863 8.7567 119.1039 54.8751 33.8675 176.2086 624 I 4.8210 8.1163 116.8928 59.1337 40.4747 175.6857 625 F 4.6507 9.1443 126.9997 57.4312 37.9991 174.0359 626 A 4.1529 7.8326 127.8309 50.9257 22.3535 175.9673 627 G 3.8723 8.1617 109.4685 43.8163 0.0000 171.4442 628 P 4.5770 0.0000 0.0000 62.3791 32.2933 176.3422 629 I 3.8449 8.4604 121.3056 61.2381 38.3596 175.6514 *631 G 4.0606 8.3894 110.7583 45.8168 0.0000 170.9853 632 P 4.7751 0.0000 0.0000 62.5693 32.1919 177.5113 633 S 4.3576 7.8396 114.1968 60.5521 63.7531 175.6918 634 A 4.2247 7.9620 122.4459 54.0245 17.9926 179.0776 635 Q 4.1215 7.8752 117.6150 58.7698 28.7901 178.1909 636 L 3.9545 8.1757 121.4556 58.4207 42.1006 179.2656 637 G 3.5942 8.1537 104.8215 47.8372 0.0000 175.3672 638 L 4.0338 8.0297 121.1627 57.6110 41.8143 179.3100 639 S 3.8812 8.6466 113.5632 61.4811 62.2223 176.3510 640 L 4.0497 7.7331 121.5624 57.4044 41.0469 179.1554 641 L 3.8950 7.7151 119.7921 58.0016 42.1045 178.8758 642 V 4.1335 7.4636 110.1971 62.7755 31.9021 177.2284 643 N 4.7186 7.8233 114.3199 53.6252 39.6770 174.6811 644 D 4.7249 7.7804 116.5495 55.7350 42.9911 176.8546 645 I 3.7918 7.6605 118.5029 61.8131 37.5428 175.3462 646 E 4.5291 8.9066 124.1426 57.3113 31.1671 176.3813 647 D 4.7748 7.5433 116.5847 53.4792 44.9439 176.6903 648 G 3.8294 9.1796 114.0349 44.5345 0.0000 171.5816 649 V 4.8388 7.9233 117.4122 59.0304 33.2852 174.1859 650 P 4.3899 0.0000 0.0000 63.1102 31.6969 177.5729 651 R 4.0862 8.2253 122.9895 54.8174 28.7678 173.9877 *653 V 3.9384 7.6512 119.0879 62.5577 33.0471 173.3483 654 F 5.2777 8.9543 126.9908 56.3013 41.0523 174.9571 655 T 4.9510 9.5178 117.6105 59.1459 70.5385 173.2150 656 G 4.4838 7.9365 123.2812 45.1794 0.0000 170.8643 657 E 4.8192 8.1866 124.0117 55.5142 31.2135 175.0400 658 I 4.8302 8.6234 126.9792 59.7815 39.0241 175.8354 659 A 4.4385 8.8567 129.3201 51.0418 19.8184 178.0420 660 D 4.3944 8.7584 118.2077 57.2006 40.9153 178.0648 661 D 4.3741 7.9568 117.2038 54.2479 39.8089 177.0323 662 E 3.8725 8.3387 118.1526 56.4959 27.9491 174.2192 663 E 4.6030 8.9942 119.1610 56.8886 33.0065 176.5589 664 T 4.3967 8.1844 116.6249 63.3909 69.8228 173.7978 665 I 4.7114 8.3401 127.3654 60.0452 38.8725 175.0069 666 I 4.3827 8.8555 128.8665 59.0251 38.7159 173.8834 667 P 4.9195 0.0000 0.0000 62.9007 32.0194 175.6035 668 I 4.4409 8.4404 115.6932 59.2885 40.1385 174.6376 669 C 4.4952 8.3370 117.8709 59.6371 29.6024 173.4993 670 G 3.9051 8.6363 107.7381 47.0525 0.0000 176.6743 671 V 3.6227 7.9673 121.9742 64.7699 31.4347 176.9719 672 D 4.3057 8.0580 119.0178 56.9276 40.8129 178.5944 673 I 3.7330 7.7811 119.6998 64.3408 37.1219 178.0936 674 A 3.9763 8.1213 121.2960 55.0114 18.1356 179.4460 675 A 3.7262 8.0890 119.3186 55.2824 18.3759 179.7656 676 I 3.4660 7.4589 117.6251 64.4387 36.7277 178.3473 677 A 3.9901 7.8099 120.7102 55.1841 18.2436 179.3435 678 A 3.8151 8.0761 119.2425 55.9327 18.4333 179.6910 679 H 4.2546 8.4226 114.9208 58.9874 28.5196 177.8059 680 E 4.1316 8.3238 119.7999 58.6907 29.2048 178.4435 681 Q 4.6560 7.2263 115.8932 54.9149 29.4249 175.6552 682 G 3.9385 8.3065 107.2422 46.5331 0.0000 173.8924 683 L 4.9617 7.7682 118.3312 51.5996 44.4695 174.9168 684 P 4.6566 0.0000 0.0000 62.6653 32.7215 175.1477 685 L 4.5182 9.9500 125.8505 54.2281 43.7658 175.0282 686 I 4.8628 8.5224 127.6383 59.7969 39.8447 175.3814 687 G 4.2679 7.9007 111.9794 45.8333 0.0000 172.1522 688 N 5.2446 8.0460 115.1375 51.1268 38.7673 173.4785 689 Q 4.5656 7.3434 112.9245 54.8362 32.1603 172.4445 690 P 4.3755 0.0000 0.0000 64.0909 31.8057 177.0840 691 G 4.0328 8.9954 109.6077 45.1162 0.0000 174.0163 692 V 4.2034 6.7576 118.4480 60.4958 33.0257 176.0848 693 D 4.5803 8.6046 121.8866 56.9212 41.4769 177.0022 694 E 4.6906 7.9314 117.0333 54.5066 33.5852 174.6483 695 E 4.9294 8.8858 123.9367 55.4173 29.6968 176.0922 696 V 4.3030 8.6618 117.6778 59.3930 33.9235 176.6804 697 R 4.1507 8.8744 127.2558 58.9064 30.4026 175.9236 698 N 5.0759 7.5217 113.0924 50.8497 41.8997 175.2509 699 T 3.8990 8.3463 110.4764 64.6207 68.6862 176.6302 700 S 4.1533 8.2565 116.2470 61.4457 62.4235 176.2536 701 L 4.0612 8.7883 121.7883 57.5113 41.3283 179.2957 702 A 4.1273 8.1191 120.7840 55.0020 18.3526 179.4855 703 A 3.8706 8.3078 119.6595 55.6144 18.4033 179.1960 704 H 4.0985 8.3830 116.7904 59.5104 29.8589 177.1776 705 L 4.0016 8.0396 123.3198 57.5319 41.6597 179.0055 706 I 3.8046 7.5424 119.0855 64.3907 37.1319 178.0189 707 Q 4.1755 7.7765 117.7744 59.3640 28.5562 178.9293 708 T 3.9751 8.1081 111.1255 63.0195 68.5295 175.3336 709 G 4.2148 9.2582 110.2745 45.2126 0.0000 173.1916 710 T 4.6136 7.0847 110.5720 59.4591 70.6640 172.7057 711 L 4.0657 8.3628 127.8062 54.0989 42.5398 175.1674 712 P 4.3156 0.0000 0.0000 63.0153 31.9187 175.5392 713 V 4.2511 8.1257 120.6000 61.3067 32.9574 175.0015 714 Q 4.5357 8.5625 125.3972 53.9988 30.5100 174.8884 715 R 4.4069 8.4264 122.6582 54.0897 31.9709 174.8647 716 A 4.1773 8.6169 127.2913 52.5056 18.4206 176.7384 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 514 G 8.35 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 515 K 8.67 4.70 0.00 1.74 1.76 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.48 7.81 516 F 9.23 4.65 0.00 3.07 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 517 S 8.36 4.14 0.00 3.78 3.57 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 0.00 518 R 8.35 3.58 0.00 2.01 1.86 0.00 3.42 0.00 0.00 3.39 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 519 A 7.75 3.88 1.27 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 0.00 0.00 520 L 7.90 3.83 0.00 1.82 1.86 1.19 0.44 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 0.00 521 K 7.57 2.00 0.00 1.30 1.59 0.00 1.77 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.08 0.71 7.81 522 N 7.97 4.21 0.00 2.67 2.78 0.00 0.00 6.77 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 0.00 523 R 7.53 3.88 0.00 1.85 2.16 0.00 3.27 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 524 L 7.93 4.25 0.00 1.93 1.91 1.17 0.88 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 0.00 525 E 8.28 4.19 0.00 2.02 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 2.38 2.16 0.00 526 S 7.70 4.25 0.00 3.98 4.15 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 0.00 0.00 0.00 527 A 7.62 4.35 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 0.00 528 N 7.44 4.60 0.00 2.96 2.83 0.00 0.00 6.73 7.38 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 0.00 529 Y 8.95 4.76 0.00 3.12 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 530 E 8.95 3.77 0.00 1.96 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.56 0.00 531 E 7.84 4.41 0.00 1.97 1.85 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 2.28 2.30 0.00 532 V 9.29 4.58 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.90 0.00 0.00 533 E 8.74 4.98 0.00 1.96 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.29 0.00 534 L 8.84 4.88 0.00 1.50 1.43 0.76 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 535 P 0.00 4.79 0.00 2.06 2.07 0.00 3.71 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 1.95 2.00 0.00 536 P 0.00 4.90 0.00 1.97 2.05 0.00 3.73 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.04 0.00 537 P 0.00 4.46 0.00 2.48 2.10 0.00 3.79 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 538 S 8.75 4.25 0.00 4.06 4.21 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 0.00 539 K 6.38 5.03 0.00 1.90 1.85 0.00 1.49 0.00 0.00 2.45 0.00 0.00 3.17 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.41 1.51 7.81 540 G 7.76 4.66 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 0.00 0.00 0.00 541 V 7.66 4.80 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 0.94 0.00 0.00 1.06 0.00 0.00 542 I 8.56 5.15 1.92 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 1.39 0.76 0.94 0.00 0.00 543 V 9.06 5.18 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 0.91 0.00 0.00 1.01 0.00 0.00 544 P 0.00 5.21 0.00 2.06 2.03 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 545 V 8.71 4.41 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.93 0.00 0.00 546 V 8.25 4.59 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 0.79 0.00 0.00 0.89 0.00 0.00 547 H 8.79 4.84 0.00 1.40 2.55 0.00 5.61 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 548 T 8.29 5.11 4.21 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 1.22 0.00 0.00 549 V 8.05 4.53 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 0.81 0.00 0.00 0.97 0.00 0.00 550 K 8.74 3.96 0.00 1.74 1.89 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.43 7.81 551 S 8.04 4.36 0.00 4.04 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 552 A 7.77 4.74 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 0.00 553 P 0.00 4.25 0.00 2.19 2.07 0.00 3.88 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 554 G 8.75 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 555 E 7.59 5.20 0.00 2.02 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.78 -0.29 0.00 0.00 597 P 0.00 4.44 0.00 2.22 2.14 0.00 3.32 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.96 0.00 598 F 6.88 5.10 0.00 3.37 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 0.00 599 E 8.92 4.65 0.00 2.04 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 2.55 2.38 0.00 600 G 8.01 3.34 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 0.00 601 D 8.12 4.79 0.00 2.74 2.84 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 0.00 602 N 7.60 4.02 0.00 2.94 3.01 0.00 0.00 6.83 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *604 C 7.67 4.64 0.00 2.88 2.95 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 0.00 605 Y 9.21 5.41 0.00 2.98 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 606 T 9.52 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 623 K 8.76 4.49 0.00 0.79 0.97 0.00 1.22 0.00 0.00 1.54 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.05 7.81 624 I 8.12 4.82 1.95 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.87 1.00 0.00 0.00 625 F 9.14 4.65 0.00 3.09 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 626 A 7.83 4.15 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 0.00 627 G 8.16 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 0.00 0.00 0.00 628 P 0.00 4.58 0.00 2.17 2.09 0.00 3.74 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 629 I 8.46 3.84 1.85 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 1.15 0.79 0.88 0.00 0.00 *631 G 8.39 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 632 P 0.00 4.78 0.00 2.23 2.27 0.00 3.67 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.93 0.00 633 S 7.84 4.36 0.00 4.04 4.16 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 0.00 634 A 7.96 4.22 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 0.00 635 Q 7.88 4.12 0.00 2.39 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.71 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 636 L 8.18 3.95 0.00 1.89 1.74 0.85 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 637 G 8.15 3.59 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 0.00 638 L 8.03 4.03 0.00 2.20 2.12 0.88 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 639 S 8.65 3.88 0.00 3.31 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 640 L 7.73 4.05 0.00 1.50 1.38 -0.18 0.35 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 0.00 641 L 7.72 3.90 0.00 1.61 1.78 0.96 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 642 V 7.46 4.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 1.09 0.00 0.00 643 N 7.82 4.72 0.00 2.70 2.77 0.00 0.00 6.83 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 644 D 7.78 4.72 0.00 2.67 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 645 I 7.66 3.79 1.87 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.51 0.95 0.00 0.00 646 E 8.91 4.53 0.00 1.95 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 2.41 2.25 0.00 647 D 7.54 4.77 0.00 2.61 2.53 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 0.00 648 G 9.18 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 0.00 649 V 7.92 4.84 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 1.15 0.00 0.00 0.98 0.00 0.00 650 P 0.00 4.39 0.00 2.36 2.15 0.00 3.92 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 651 R 8.23 4.09 0.00 1.80 1.88 0.00 3.24 0.00 0.00 3.16 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 *653 V 7.65 3.94 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 0.97 0.00 0.00 0.89 0.00 0.00 654 F 8.95 5.28 0.00 3.02 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 0.00 655 T 9.52 4.95 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 1.23 0.00 0.00 656 G 7.94 4.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 657 E 8.19 4.82 0.00 2.10 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 0.00 658 I 8.62 4.83 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.80 0.79 0.00 0.00 659 A 8.86 4.44 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 0.00 660 D 8.76 4.39 0.00 2.70 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 0.00 661 D 7.96 4.37 0.00 2.75 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 0.00 662 E 8.34 3.87 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.26 0.00 663 E 8.99 4.60 0.00 1.87 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.20 0.00 664 T 8.18 4.40 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 0.00 665 I 8.34 4.71 1.88 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 1.34 0.67 0.94 0.00 0.00 666 I 8.86 4.38 1.89 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 1.24 0.90 0.92 0.00 0.00 667 P 0.00 4.92 0.00 1.94 2.00 0.00 3.64 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.26 0.00 668 I 8.44 4.44 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 1.31 0.66 0.97 0.00 0.00 669 C 8.34 4.50 0.00 2.97 2.89 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 0.00 670 G 8.64 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 0.00 671 V 7.97 3.62 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 0.86 0.00 0.00 0.92 0.00 0.00 672 D 8.06 4.31 0.00 2.71 2.74 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 0.00 673 I 7.78 3.73 2.06 0.00 0.00 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 1.64 1.46 1.01 0.00 0.00 674 A 8.12 3.98 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 0.00 675 A 8.09 3.73 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 676 I 7.46 3.47 1.82 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.46 0.63 0.00 0.00 677 A 7.81 3.99 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 0.00 678 A 8.08 3.82 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 679 H 8.42 4.25 0.00 3.12 3.32 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 680 E 8.32 4.13 0.00 2.24 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 0.00 2.37 2.37 0.00 681 Q 7.23 4.66 0.00 1.94 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.62 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 682 G 8.31 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 0.00 0.00 683 L 7.77 4.96 0.00 1.60 1.51 0.92 0.86 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 0.00 684 P 0.00 4.66 0.00 2.00 2.00 0.00 3.78 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.89 0.00 685 L 9.95 4.52 0.00 1.64 1.53 0.95 0.99 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 0.00 686 I 8.52 4.86 1.47 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.17 0.95 0.00 0.00 687 G 7.90 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 0.00 0.00 0.00 0.00 688 N 8.05 5.24 0.00 2.85 2.74 0.00 0.00 6.72 7.08 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 0.00 689 Q 7.34 4.57 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.83 6.74 0.00 0.00 0.00 0.00 0.00 2.16 2.23 0.00 690 P 0.00 4.38 0.00 2.06 2.03 0.00 3.64 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 691 G 9.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 692 V 6.76 4.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.93 0.00 0.00 693 D 8.60 4.58 0.00 2.69 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 0.00 694 E 7.93 4.69 0.00 1.83 1.78 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 2.27 2.29 0.00 695 E 8.89 4.93 0.00 1.86 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 696 V 8.66 4.30 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.08 0.00 0.00 697 R 8.87 4.15 0.00 1.75 1.97 0.00 3.29 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 698 N 7.52 5.08 0.00 3.07 2.86 0.00 0.00 6.62 7.10 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 0.00 699 T 8.35 3.90 4.12 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 1.20 0.00 0.00 700 S 8.26 4.15 0.00 4.01 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 701 L 8.79 4.06 0.00 1.85 1.74 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 702 A 8.12 4.13 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 0.00 703 A 8.31 3.87 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 704 H 8.38 4.10 0.00 3.25 3.53 0.00 5.79 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 0.00 705 L 8.04 4.00 0.00 1.96 1.97 0.98 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 706 I 7.54 3.80 2.08 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.00 0.95 0.00 0.00 707 Q 7.78 4.18 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.41 2.58 0.00 708 T 8.11 3.98 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 1.05 0.00 0.00 709 G 9.26 4.21 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 0.00 710 T 7.08 4.61 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 711 L 8.36 4.07 0.00 1.62 1.56 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 712 P 0.00 4.32 0.00 2.10 2.00 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00 713 V 8.13 4.25 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 0.82 0.00 0.00 0.93 0.00 0.00 714 Q 8.56 4.54 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.54 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 715 R 8.43 4.41 0.00 1.71 1.79 0.00 3.23 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 716 A 8.62 4.18 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 * Residues marked with a * may have inaccurate shift predictions.