NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *578 H 4.7495 8.4449 117.3757 54.1684 29.9022 174.1042 579 K 4.3878 8.6049 115.5475 55.2332 33.9295 175.7675 580 T 4.4620 9.2108 113.8844 61.3142 70.9816 174.0529 581 L 4.9681 8.7747 125.0658 52.6958 44.5150 177.4879 582 A 3.9822 8.8206 123.1543 55.5518 18.3091 179.6261 583 M 4.2885 7.6561 111.5078 57.1446 31.3709 176.8087 584 D 4.6325 7.9090 118.6698 54.9367 41.5836 177.0455 585 V 4.2744 7.3387 116.6853 62.8120 33.7076 175.4808 586 M 4.4317 7.8202 116.7807 55.5116 31.8007 176.0975 587 K 4.8307 8.6387 120.0638 54.1362 34.9912 174.1017 588 P 4.7617 0.0000 0.0000 62.4715 32.6870 176.3772 589 R 4.2250 8.5122 121.1105 55.1448 31.0107 176.0630 590 R 4.0200 8.3453 115.4126 58.3556 29.2725 176.1756 591 N 4.3079 8.9412 117.1080 54.1948 35.8642 173.4595 592 D 5.0530 7.5492 116.8876 51.2802 43.5681 174.5662 593 P 4.3962 0.0000 0.0000 62.5267 31.7699 176.3515 594 L 4.1026 8.3326 120.2075 54.5598 42.1366 177.0588 595 L 3.9112 8.3323 120.1990 55.1812 41.5716 177.4087 596 T 3.9686 8.6862 121.3953 64.0348 68.1885 173.6686 597 V 4.7103 8.0808 124.9385 59.7760 35.2146 174.5639 598 L 4.9188 8.4855 120.2828 53.1185 44.7140 176.6892 599 T 5.0174 8.4853 112.8174 60.9455 70.6192 174.5206 600 Q 4.7027 8.6164 119.3505 57.6171 29.3873 177.2126 601 D 4.7166 8.2110 116.1174 54.3982 44.3995 176.0365 602 S 4.6329 7.8949 110.8759 58.4893 64.4350 174.4927 603 M 4.1916 7.9203 122.3073 55.3983 32.3770 176.0399 604 T 5.1636 8.1090 115.3950 59.6241 72.2974 176.1107 605 V 3.5782 8.0958 119.3664 65.8769 31.3355 177.4751 606 E 4.2268 7.9058 118.9333 58.5643 29.1723 178.4530 607 D 4.3396 7.6806 118.4950 57.4788 40.8875 179.2471 608 V 3.6156 7.5469 118.3609 65.8458 31.4122 177.9608 609 E 3.9855 7.9894 118.8715 59.5245 29.0810 179.3732 610 T 4.0729 8.2989 110.1324 64.4643 68.6905 177.0540 611 I 3.6973 7.0626 121.1883 64.1007 36.9874 177.8699 612 I 3.9877 7.8655 121.0421 64.6194 36.7930 178.7001 613 S 4.2162 7.8336 112.9454 60.6873 63.0273 175.2465 614 E 4.4660 7.6761 119.8055 55.4918 29.8269 175.3861 615 T 4.5982 7.0600 108.3031 60.0715 71.8865 173.6610 616 T 4.5718 7.6081 108.4924 61.1839 69.8984 173.7451 617 Y 4.5252 7.3706 119.0643 58.4423 38.6877 176.5228 618 S 4.2032 8.8319 118.4531 61.6723 63.1675 174.1666 619 G 3.7865 7.1241 103.9253 45.3046 0.0000 172.2488 620 F 5.0170 7.7082 117.1957 54.8186 43.2123 173.7005 621 P 5.0444 0.0000 0.0000 62.6066 33.0590 175.4496 622 V 4.8436 8.4161 120.3254 60.1878 34.0330 175.1353 623 V 4.8166 8.5783 118.0412 59.1530 34.8359 176.8190 624 V 3.8119 8.2405 123.2182 66.0141 31.7554 176.2699 625 S 4.6583 7.7558 110.9389 57.1458 65.7177 175.7791 626 R 3.9632 8.5295 120.2273 58.9224 30.1416 178.0923 627 E 4.1678 8.1881 118.2245 58.7248 29.1232 177.7367 628 S 4.1749 8.1541 113.3789 61.1282 63.5367 175.9876 629 Q 3.4631 8.2424 118.7684 56.2259 26.6640 172.9574 630 R 4.4754 7.2946 115.4383 55.6157 31.0834 175.9876 631 L 4.3222 8.5913 127.0124 55.3965 42.3977 175.6785 632 V 4.1639 8.6046 125.3439 64.4392 33.6980 174.9610 633 G 4.1656 7.3973 105.2164 46.0759 0.0000 170.9286 634 F 5.3756 8.6115 121.7395 56.7355 43.3949 175.0156 635 V 4.7410 7.6747 125.0870 59.7208 34.3240 175.2143 636 L 4.4384 8.3894 123.2280 54.0214 43.0398 177.8434 637 R 3.9854 8.8085 122.6731 59.6614 30.0409 179.1213 638 R 3.9478 8.0491 117.2883 59.7824 30.1483 178.6930 639 D 4.4685 8.0913 117.5589 56.8886 40.7544 178.8498 640 L 3.9865 7.7742 119.9217 57.8314 41.8067 179.1193 641 I 3.7045 7.5940 119.2882 64.6269 37.2418 178.4218 642 I 3.6862 7.5799 119.6121 64.7707 36.8122 178.8250 643 S 4.1718 7.8198 114.3208 61.5645 62.3794 176.6620 644 I 3.8906 8.0115 122.7586 64.3720 36.8134 178.3026 645 E 4.0148 8.1247 119.2828 59.4026 29.0754 178.9120 646 N 4.3831 7.9496 114.3551 55.2500 38.6115 176.7227 647 A 4.2271 7.6744 121.8911 54.4815 18.6418 179.2576 648 R 3.9237 7.5088 114.4339 57.5855 30.2349 177.1915 649 K 4.4438 7.2024 118.5272 55.8320 32.4277 176.0161 650 K 4.1963 7.9644 118.7813 55.9473 33.9854 175.8893 651 Q 3.4140 7.8703 115.8864 57.2309 25.5331 172.9729 652 D 4.7571 7.8653 111.6540 53.7646 41.6756 177.2827 653 G 3.8374 8.0296 105.8006 46.5452 0.0000 174.4723 654 V 3.7708 7.9177 119.6191 62.1933 31.7261 175.1832 655 V 4.6341 7.7383 119.8160 59.5123 34.6743 175.8702 656 S 4.2476 8.5968 113.3407 60.8917 62.4040 175.6426 657 T 4.5736 7.6467 108.2200 61.5091 69.2027 174.3437 658 S 4.3791 7.5758 118.1351 58.9484 64.2416 173.5109 659 I 4.4452 8.3396 124.2213 61.1664 38.4625 174.6484 660 I 4.8279 8.5640 128.3433 59.8565 38.6527 174.8220 661 Y 5.0981 8.0135 123.9321 55.3085 41.1463 175.7783 662 F 4.8257 9.0159 119.1498 57.5585 40.1733 175.9239 663 T 4.4336 8.0705 109.7407 60.3991 70.1444 174.4663 664 E 4.0529 8.8688 122.1018 58.8574 29.7098 176.1345 665 H 5.0883 7.7349 112.6056 53.4090 32.2467 173.2596 666 S 2.7900 8.0273 115.5339 56.5782 62.8324 172.2648 667 P 4.2673 0.0000 0.0000 61.5935 31.7238 174.3715 668 P 4.1988 0.0000 0.0000 63.1036 31.4227 175.9512 669 L 4.7760 8.0085 122.5659 51.5352 45.5231 174.7825 670 P 4.2569 0.0000 0.0000 62.2180 31.4645 175.7018 671 P 4.2691 0.0000 0.0000 65.2732 31.3519 176.5465 672 Y 4.4919 7.3332 115.2721 57.4479 38.6542 175.7385 673 T 4.0913 6.9583 118.4008 62.3022 69.1806 172.8071 674 P 4.4072 0.0000 0.0000 62.1869 31.8029 174.2758 675 P 4.5092 0.0000 0.0000 63.5191 32.0597 176.0974 676 T 4.5418 8.3272 112.5658 60.7125 71.5419 173.4935 677 L 4.5009 8.5892 122.6525 52.8867 44.5545 175.1486 678 K 3.4384 8.2944 128.5531 55.3303 32.9162 176.5090 679 L 4.6713 7.7934 127.2049 54.3312 43.1862 178.8083 680 R 4.0315 7.9664 122.3006 59.2838 30.1544 177.3727 681 N 4.7556 8.1001 112.6798 53.4022 37.5782 175.0345 682 I 4.4249 7.5920 111.7951 60.4610 37.9310 174.5567 683 L 4.4550 7.6329 122.8029 53.4030 43.1071 175.5147 684 D 4.4326 8.7428 126.7920 54.5611 40.6699 176.2414 685 L 4.4575 8.4425 126.1470 55.5103 42.6510 177.2881 686 S 4.7505 8.4854 114.4633 56.5054 63.2276 172.2829 687 P 4.4980 0.0000 0.0000 62.0973 33.0076 176.1935 688 F 4.3428 8.5341 123.1487 58.1254 40.4608 174.1651 689 T 5.2180 7.7351 115.3642 59.9703 71.6027 173.3533 690 V 4.6547 8.8047 122.3366 61.3579 35.5903 174.5450 691 T 4.7678 8.4286 116.3179 60.8805 69.9215 175.3485 692 D 4.3829 8.9174 123.4866 56.4144 39.3813 177.9927 693 L 4.3540 7.2229 117.7955 55.1889 42.1226 176.8190 694 T 4.0982 8.1680 118.9044 62.1868 68.8308 172.5739 695 P 4.7175 0.0000 0.0000 63.2222 33.2315 177.2500 696 M 4.0263 8.9526 120.2431 58.3129 31.9549 178.4965 697 E 3.8902 8.2996 119.2258 59.8137 29.5629 179.1519 698 I 3.7874 7.6962 118.8917 64.2062 37.2346 178.4630 699 V 3.6828 7.5906 119.0383 66.0603 31.3968 178.2925 700 V 3.5836 8.5010 118.3977 65.8496 31.3033 177.4716 701 D 4.3110 8.0526 117.6103 57.4953 41.0932 178.3878 702 I 3.6127 8.0322 120.4244 64.3491 36.9203 178.4226 703 F 3.7648 8.4943 118.7383 60.4454 38.4782 177.7183 704 R 3.9584 7.9362 117.4696 59.1355 30.0365 178.2213 705 K 4.1738 8.0835 116.9773 57.6985 32.3315 177.5507 706 L 4.3414 7.5787 116.4407 53.2214 43.4237 176.1332 707 G 3.8856 7.4440 107.1234 46.4192 0.0000 173.7577 708 L 4.1215 7.1030 116.4291 54.2439 42.8202 178.0999 709 R 4.2428 8.0870 119.6993 57.8719 30.8084 176.0179 710 Q 4.7722 7.0139 113.0973 56.0765 30.6923 172.6114 711 C 4.9290 9.4179 119.7491 57.8345 35.6781 172.4461 712 L 5.1759 8.6700 123.3696 53.0030 44.7348 175.4142 713 V 5.0119 8.5999 122.0970 61.4208 33.9999 174.7262 714 T 5.0808 8.8901 117.6188 60.2190 72.4163 172.8571 715 H 4.7979 9.0392 121.4114 54.1934 32.3360 172.9617 716 N 3.9851 9.5054 126.4090 54.3772 35.6468 175.6776 717 G 3.9204 8.3069 103.7789 45.1640 0.0000 172.6516 718 R 4.5365 7.3228 120.3634 53.7545 32.1111 174.5881 719 L 4.4988 8.5912 127.9348 55.2877 42.7101 175.6235 720 L 4.5251 8.7379 125.8027 56.0845 44.0048 176.3096 721 G 4.0800 7.1978 102.6066 46.0598 0.0000 171.7157 722 I 5.2237 8.5654 119.0817 59.2789 42.0423 174.8364 723 I 5.1708 8.9515 127.8350 59.8312 41.0017 175.0071 724 T 4.7600 8.2650 116.0054 59.6126 71.7524 175.4735 725 K 3.8348 8.5428 121.3421 59.4748 31.9803 178.5089 726 K 3.8908 8.0252 119.4221 59.5087 32.1583 178.1084 727 D 4.3168 7.8005 119.1162 57.5606 40.8143 179.0875 728 V 3.4207 7.4580 118.4152 65.8743 31.3915 178.0840 729 L 3.9630 8.0285 118.7769 57.8267 40.9842 179.6972 730 K 4.0379 8.2918 118.4736 59.3936 31.7390 179.0400 731 H 4.2020 8.1644 118.8922 59.3624 29.6216 177.4536 732 I 3.7340 7.5801 120.1546 64.1808 36.9167 178.0028 733 A 4.1006 8.0259 121.9339 55.0961 17.7723 179.4026 734 Q 3.9180 7.8303 117.0095 59.1383 28.8671 178.1200 735 M 4.0600 7.5498 119.2632 58.0753 32.0191 178.0768 736 A 3.7086 7.2869 119.5262 53.8673 18.4544 177.6628 737 N 4.5182 7.3016 113.1305 53.5893 38.9629 175.6880 *745 F 4.8325 7.8915 122.6530 58.1898 41.3714 175.8275 746 N 4.3318 8.0359 115.8852 53.5534 36.9134 176.4246 747 E 3.9560 7.9520 121.5615 59.5296 29.6561 178.4161 748 F 4.2227 7.8426 121.0303 61.1785 39.1957 177.2264 749 L 3.6871 7.3732 116.9208 57.1000 41.5877 178.3463 750 E 4.0071 7.6796 117.6689 57.8122 29.5976 176.8466 751 V 3.8796 7.0107 116.6950 61.7058 31.8594 175.4287 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 *578 H 8.44 4.75 0.00 2.95 2.81 0.00 7.18 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 579 K 8.60 4.39 0.00 1.72 1.78 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.51 7.81 580 T 9.21 4.46 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 1.24 0.00 0.00 581 L 8.77 4.97 0.00 1.63 1.76 0.93 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 582 A 8.82 3.98 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 0.00 583 M 7.66 4.29 0.00 2.13 2.20 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.65 0.00 584 D 7.91 4.63 0.00 2.83 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 0.00 585 V 7.34 4.27 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 0.78 0.00 0.00 0.79 0.00 0.00 586 M 7.82 4.43 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 587 K 8.64 4.83 0.00 1.66 1.71 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.49 7.81 588 P 0.00 4.76 0.00 2.08 2.15 0.00 3.76 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 589 R 8.51 4.23 0.00 1.87 1.91 0.00 3.53 0.00 0.00 3.39 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.57 0.00 590 R 8.35 4.02 0.00 1.90 1.97 0.00 3.20 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 591 N 8.94 4.31 0.00 2.92 2.99 0.00 0.00 6.92 8.06 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 0.00 592 D 7.55 5.05 0.00 2.89 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 0.00 593 P 0.00 4.40 0.00 2.23 2.10 0.00 3.82 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 594 L 8.33 4.10 0.00 1.68 1.69 0.93 1.00 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 0.00 595 L 8.33 3.91 0.00 1.65 1.67 0.94 0.84 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 0.00 596 T 8.69 3.97 4.64 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 1.26 0.00 0.00 597 V 8.08 4.71 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 0.75 0.00 0.00 0.99 0.00 0.00 598 L 8.49 4.92 0.00 1.62 1.53 0.98 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 599 T 8.49 5.02 4.28 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 1.23 0.00 0.00 600 Q 8.62 4.70 0.00 2.30 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.61 0.00 0.00 0.00 0.00 0.00 2.55 2.42 0.00 601 D 8.21 4.72 0.00 2.66 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 0.00 602 S 7.89 4.63 0.00 4.01 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 0.00 603 M 7.92 4.19 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.52 0.00 604 T 8.11 5.16 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 1.26 0.00 0.00 605 V 8.10 3.58 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.96 0.00 0.00 606 E 7.91 4.23 0.00 2.20 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 2.42 2.20 0.00 607 D 7.68 4.34 0.00 3.01 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 0.00 608 V 7.55 3.62 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 1.01 0.00 0.00 0.95 0.00 0.00 609 E 7.99 3.99 0.00 2.19 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 2.33 2.40 0.00 610 T 8.30 4.07 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 0.00 611 I 7.06 3.70 1.83 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 1.43 0.65 0.47 0.00 0.00 612 I 7.87 3.99 2.06 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 1.70 1.17 0.97 0.00 0.00 613 S 7.83 4.22 0.00 4.05 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 0.00 614 E 7.68 4.47 0.00 1.99 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 0.00 2.27 2.38 0.00 615 T 7.06 4.60 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 1.32 0.00 0.00 616 T 7.61 4.57 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 1.14 0.00 0.00 617 Y 7.37 4.53 0.00 2.81 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 0.00 618 S 8.83 4.20 0.00 3.93 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 0.00 619 G 7.12 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 0.00 0.00 0.00 620 F 7.71 5.02 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 0.00 621 P 0.00 5.04 0.00 2.13 2.09 0.00 3.78 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 2.20 2.29 0.00 622 V 8.42 4.84 1.60 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 0.38 0.00 0.00 0.64 0.00 0.00 623 V 8.58 4.82 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 0.71 0.00 0.00 1.02 0.00 0.00 624 V 8.24 3.81 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 0.77 0.00 0.00 1.00 0.00 0.00 625 S 7.76 4.66 0.00 4.06 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 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0.00 2.13 2.13 0.00 3.18 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.90 0.00 668 P 0.00 4.20 0.00 2.01 2.02 0.00 3.56 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.06 0.00 669 L 8.01 4.78 0.00 1.44 1.37 0.84 1.06 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 0.00 670 P 0.00 4.26 0.00 1.10 1.99 0.00 3.52 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.72 0.00 671 P 0.00 4.27 0.00 2.23 2.23 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 2.09 1.99 0.00 672 Y 7.33 4.49 0.00 3.08 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 673 T 6.96 4.09 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 1.13 0.00 0.00 674 P 0.00 4.41 0.00 2.18 2.08 0.00 3.78 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 675 P 0.00 4.51 0.00 1.96 2.05 0.00 3.67 0.00 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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 0.92 0.00 0.00 0.96 0.00 0.00 701 D 8.05 4.31 0.00 3.06 2.82 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 0.00 702 I 8.03 3.61 1.99 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.54 0.35 0.00 0.00 703 F 8.49 3.76 0.00 3.31 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 0.00 704 R 7.94 3.96 0.00 1.98 2.07 0.00 3.23 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 705 K 8.08 4.17 0.00 1.81 1.78 0.00 1.82 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.44 7.81 706 L 7.58 4.34 0.00 1.36 1.41 0.27 0.84 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 0.00 707 G 7.44 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 0.00 708 L 7.10 4.12 0.00 0.57 1.04 0.06 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 709 R 8.09 4.24 0.00 1.80 1.95 0.00 3.16 0.00 0.00 3.39 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.56 0.00 710 Q 7.01 4.77 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.78 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 711 C 9.42 4.93 0.00 2.78 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 712 L 8.67 5.18 0.00 1.62 1.53 0.95 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 713 V 8.60 5.01 2.10 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 0.94 0.00 0.00 0.96 0.00 0.00 714 T 8.89 5.08 4.31 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 1.19 0.00 0.00 715 H 9.04 4.80 0.00 3.32 3.18 0.00 5.93 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 716 N 9.51 3.99 0.00 2.78 2.79 0.00 0.00 7.29 7.65 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 0.00 717 G 8.31 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 0.00 0.00 0.00 718 R 7.32 4.54 0.00 1.82 2.01 0.00 3.14 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 719 L 8.59 4.50 0.00 1.64 1.66 0.99 0.89 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 0.00 720 L 8.74 4.53 0.00 1.68 1.67 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 721 G 7.20 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 0.00 722 I 8.57 5.22 1.89 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 1.22 1.65 0.86 0.00 0.00 723 I 8.95 5.17 1.98 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 1.27 0.90 0.76 0.00 0.00 724 T 8.26 4.76 4.28 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 1.22 0.00 0.00 725 K 8.54 3.83 0.00 2.02 1.90 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.59 7.81 726 K 8.03 3.89 0.00 1.87 1.79 0.00 1.81 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.54 7.81 727 D 7.80 4.32 0.00 2.79 2.64 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 0.00 728 V 7.46 3.42 1.83 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 0.78 0.00 0.00 -0.07 0.00 0.00 729 L 8.03 3.96 0.00 1.87 1.69 0.92 0.58 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 0.00 730 K 8.29 4.04 0.00 2.01 1.86 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.44 7.81 731 H 8.16 4.20 0.00 3.22 3.47 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 732 I 7.58 3.73 2.03 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.88 1.07 0.00 0.00 733 A 8.03 4.10 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 734 Q 7.83 3.92 0.00 2.29 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 735 M 7.55 4.06 0.00 1.99 2.33 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.67 0.00 736 A 7.29 3.71 0.70 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 0.00 0.00 737 N 7.30 4.52 0.00 2.70 2.81 0.00 0.00 6.87 7.11 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 *745 F 7.89 4.83 0.00 3.11 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 746 N 8.04 4.33 0.00 3.00 3.05 0.00 0.00 6.30 7.66 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 0.00 747 E 7.95 3.96 0.00 1.93 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 2.30 2.36 0.00 748 F 7.84 4.22 0.00 2.75 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.37 3.69 0.00 1.67 1.62 1.01 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 750 E 7.68 4.01 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 751 V 7.01 3.88 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 0.67 0.00 0.00 0.76 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.