NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 601 K 4.1955 8.3144 120.1379 56.2994 34.2014 175.6475 602 S 4.0952 7.9527 113.0968 55.3554 60.7807 170.1254 603 I 4.0206 8.5557 120.6514 57.7903 39.5329 173.7563 604 P 4.2456 0.0000 0.0000 61.7880 31.2741 175.7437 605 Q 4.5569 8.1880 121.9402 53.1909 30.5604 173.8241 606 P 4.4007 0.0000 0.0000 63.0830 31.8968 176.6798 607 T 3.9916 8.5574 111.1249 63.8745 69.0645 173.8083 608 N 5.0502 7.7778 116.5762 50.5009 42.1760 173.4265 609 A 4.4467 8.4349 120.5770 52.2075 19.8686 176.4814 610 L 5.3547 8.1997 118.8548 52.4263 46.1296 176.4186 611 K 4.2550 8.8229 119.6036 56.8248 32.6174 177.7704 612 S 4.5050 8.1730 119.0220 57.8951 64.2645 174.4725 613 F 4.5619 8.4477 123.1129 60.1519 39.6979 176.3870 614 N 4.1755 7.7285 115.4164 54.1299 36.2588 173.6966 615 W 4.2533 7.1413 114.9569 55.4700 30.6361 175.9079 616 S 4.4951 8.1456 110.9903 56.0078 62.8526 173.7924 617 K 3.3002 7.8105 123.3722 56.1755 32.6203 176.1517 618 L 4.5837 7.5408 119.4837 51.9741 44.1688 175.1207 619 P 4.1895 0.0000 0.0000 62.7561 31.7863 177.0120 620 E 3.9360 8.7471 122.5330 59.1610 29.5906 177.3671 621 N 4.3032 7.9047 115.9967 56.9122 38.8785 176.5934 622 K 4.1193 7.8491 113.7676 57.1443 31.6018 178.0492 623 L 4.4051 7.6074 122.0657 55.9652 42.5007 177.0345 624 E 4.0487 8.1343 118.0782 57.6648 30.0890 176.6217 625 G 3.9798 8.7457 110.4385 47.1011 0.0000 171.9897 626 T 4.7159 7.3776 106.9148 59.2043 72.5318 175.0756 627 V 3.4725 7.9764 113.2441 64.2247 31.7272 178.8085 628 W 4.5411 7.3629 119.5877 59.8664 29.2208 178.2897 629 T 3.9309 7.7585 114.7675 66.4187 67.8812 174.8482 630 E 4.6416 8.2642 117.9279 55.8330 29.7262 175.3895 631 I 4.5125 7.6862 119.7977 59.4849 39.9638 174.9303 632 D 4.6875 8.4791 123.4308 51.5299 43.0733 175.4110 633 D 4.4437 8.8570 128.0814 56.4171 39.0913 178.5384 634 T 4.1929 8.2793 117.8834 66.7828 68.0491 176.3265 635 K 3.9343 7.9943 119.9165 59.6846 31.9837 179.4672 636 V 3.4467 7.5074 117.9707 65.8258 29.9089 178.1443 637 F 4.3280 7.8159 116.9925 60.0253 38.5037 176.9282 638 K 3.9028 7.5365 115.8097 57.5661 31.9963 177.3660 639 I 4.4924 7.6746 118.4973 61.2360 39.6622 176.2218 640 L 4.1603 7.2527 119.5942 54.6906 42.4873 177.4279 641 D 4.6803 8.4530 123.6854 53.0695 40.0688 176.5617 642 L 3.9633 7.8183 125.2405 57.9088 41.9437 178.4644 643 E 3.9120 8.4491 118.5733 59.5890 29.0654 178.3991 644 D 4.3277 8.7021 117.3654 57.2772 41.7189 177.3169 645 L 4.1860 8.0806 120.2609 58.5350 42.0267 178.2928 646 E 4.0378 8.3892 118.4333 59.8734 29.3526 180.0923 647 R 4.0612 7.5936 113.4924 59.2364 29.5908 178.3778 648 T 4.0644 7.8979 115.8095 64.6643 69.9067 174.8625 649 F 4.8084 7.8443 117.7456 56.2805 39.4938 174.8028 650 S 4.5926 7.7822 114.4258 57.8080 63.8229 173.4778 651 A 4.1044 8.8009 128.1536 54.8588 19.2814 177.1696 652 Y 5.5080 8.3292 112.8287 56.6077 39.1814 175.3596 653 Q 4.6766 8.4114 120.5804 54.4962 32.8325 173.9606 654 R 4.1713 8.7652 118.1745 56.3544 30.9672 176.5728 655 Q 3.6872 8.4405 122.4150 55.7325 27.2593 177.2831 656 Q 4.1761 8.8222 122.7831 55.3602 28.2296 177.3106 657 D 4.4904 8.1716 126.8422 53.1115 39.1746 175.1603 *680 L 4.1434 7.3180 120.2385 54.5147 43.8090 177.0244 681 K 5.2987 7.7298 130.7970 56.5983 31.9507 173.4037 682 V 4.3765 6.3283 112.3296 61.9510 37.0587 172.6250 683 K 4.6470 8.4524 122.8211 57.2586 35.6948 176.0818 684 E 4.6143 8.8741 127.2927 55.9490 32.6743 174.3802 685 L 4.8001 7.7747 119.1246 53.3200 44.7965 175.2752 686 S 4.7082 8.6632 120.9790 57.6047 64.6355 173.3185 687 V 4.1045 8.5887 120.1924 62.7588 33.1484 176.5632 688 I 3.7934 8.1348 119.6225 61.5167 37.7170 176.1881 689 D 4.6199 8.6675 124.0049 53.1842 41.0927 177.4750 690 G 3.8922 8.8210 109.2193 49.0551 0.0000 174.9625 691 R 3.8968 8.2694 120.1721 59.5475 29.8409 178.1178 692 R 4.0221 8.6698 116.4997 59.3985 30.4958 178.8462 693 A 4.0401 8.5266 120.7562 55.3478 18.2730 179.4320 694 Q 3.8502 8.3736 117.9137 59.6356 29.3167 178.0844 695 N 4.3804 8.1790 116.9911 56.5760 38.4787 176.9535 696 C 3.5881 8.0984 120.1513 62.1917 31.7090 175.3313 697 N 4.2306 7.9755 118.0574 56.1298 37.8740 177.4157 698 I 3.7101 7.9490 123.0201 63.5567 37.2919 178.1475 699 L 3.7735 7.3432 120.4386 58.2336 41.9334 179.0516 700 L 3.7844 7.8056 119.2685 57.5164 41.0235 179.7728 701 S 4.0596 7.9750 114.3452 61.5881 62.7779 176.6929 702 R 4.0879 7.4259 119.8332 57.6987 29.9130 178.2868 703 L 3.9991 7.4435 119.6287 55.9412 43.4931 176.7288 704 K 3.8141 7.8134 115.7609 56.6971 29.7714 174.4783 705 L 4.7632 7.0598 115.9457 52.1851 46.4038 177.2423 706 S 4.4773 10.5677 117.4957 57.9004 65.2317 175.2220 707 N 4.4239 8.7310 120.1613 56.9213 38.3399 177.3880 708 D 4.3935 8.1027 119.6272 57.3699 40.9664 178.5741 709 E 4.0402 8.2777 119.2083 59.2396 29.3873 179.2271 710 I 3.7087 8.0641 120.0602 64.4280 37.3523 177.8191 711 K 3.8692 8.2999 120.3888 60.0848 31.9818 178.2042 712 R 3.9140 8.2513 118.1225 59.4825 29.9058 178.1385 713 A 4.0261 8.4514 120.8571 55.3327 18.3121 179.4998 714 I 3.9764 7.9838 109.1525 62.9397 38.1272 177.3352 715 L 4.4502 7.9519 120.6136 56.1179 41.5607 177.7457 716 T 4.3903 7.6681 113.6175 62.5945 69.3033 174.0941 717 M 3.1284 8.3208 119.5467 57.7516 29.8226 176.7833 718 D 4.3131 8.6917 115.0137 55.4258 40.4393 173.2187 719 E 3.8647 7.9613 120.0799 59.6486 30.2629 177.5706 720 Q 4.2277 8.0678 113.8382 55.2135 29.0441 175.4471 721 E 3.9475 7.4428 117.5481 57.4842 28.2085 174.6177 722 D 4.5877 9.0277 117.1110 54.8627 42.0207 177.6248 723 L 4.5652 8.0816 119.6723 51.7602 41.3541 174.2507 724 P 4.4575 0.0000 0.0000 61.9979 32.3668 177.9445 725 K 3.9964 8.9911 120.7369 60.1860 31.4760 178.9436 726 D 4.8066 8.0456 119.2289 55.4972 39.4961 178.3510 727 M 4.0809 8.2502 121.0299 58.3484 32.2142 178.2744 728 L 4.0979 8.0925 118.5996 57.8538 41.4203 179.0829 729 E 3.4510 8.0042 119.1062 59.2407 29.6032 179.0378 730 Q 4.1140 7.6557 116.8438 59.0498 28.8633 178.2991 731 L 4.1721 8.4819 120.3289 58.3004 41.5746 179.7091 732 L 4.1995 7.8123 116.8456 57.4681 41.5579 179.1401 733 K 4.1844 8.4821 117.3010 56.8772 33.5891 176.9989 734 F 4.8597 8.5376 117.5096 55.7401 38.8696 174.7421 735 V 4.4285 7.4128 114.0888 58.4545 33.7479 174.5058 736 P 4.2899 0.0000 0.0000 62.9289 31.1657 176.6217 737 E 4.2205 9.1771 123.9826 55.4473 31.5824 177.9572 738 K 3.9414 8.4950 120.8936 59.6534 32.1273 178.6160 739 S 4.2719 8.1517 114.1148 61.7857 62.5662 176.1349 740 D 4.3253 8.0716 121.9000 57.2382 40.6336 178.1374 741 I 3.7322 7.5289 119.5251 65.0102 35.9467 177.7404 742 D 4.4067 8.0981 118.5343 57.5639 40.5851 178.8882 743 L 4.0793 7.9630 119.3764 58.2750 42.1971 178.6456 744 L 4.2762 8.5771 117.3568 56.5882 41.9478 177.8877 745 E 4.2597 8.5547 119.6213 59.8261 29.5505 179.3850 746 E 4.2210 7.5194 109.8120 57.6229 29.0313 177.1150 747 H 4.6576 8.4856 114.3237 55.5411 31.0079 175.3613 748 K 3.5024 8.0579 121.6988 59.9348 32.1149 177.8924 749 H 4.3025 7.8392 114.5931 58.5185 29.5658 175.7895 750 E 4.7737 7.8074 116.6923 55.1732 29.3154 177.1181 751 L 4.0732 7.5257 117.4115 57.1917 41.5197 178.0098 752 D 4.2858 7.4871 119.0719 55.9460 41.0789 176.9128 753 R 3.4546 8.3527 116.1998 57.6571 27.6694 172.7733 754 M 4.6921 7.6610 118.4557 53.9983 35.2994 173.9970 755 A 3.7129 8.9502 128.2433 50.0542 19.0713 177.2624 756 K 3.8583 8.9847 123.6426 59.8146 32.1659 178.5792 757 A 4.0595 8.1070 119.8804 55.8228 18.3267 179.3098 758 D 4.3593 8.0898 116.4690 57.5549 40.8816 178.8853 759 R 4.0567 8.6190 119.4842 58.7684 29.9568 178.4737 760 F 4.3596 8.2596 120.8900 61.2775 39.4489 176.9198 761 L 3.4631 7.6696 118.1241 57.8188 41.5601 179.0752 762 F 3.9331 8.0211 119.7711 61.1752 39.0846 176.5856 763 E 3.8726 8.3549 117.7854 60.0321 29.6863 179.5109 764 M 3.8392 7.8743 118.7662 58.1458 31.6890 178.9113 765 S 3.9483 7.6634 113.3373 61.0741 62.9405 175.9955 766 R 3.9389 7.0523 119.2184 55.9965 30.2829 176.1968 767 I 4.1623 7.4449 121.2748 59.6531 38.1967 175.2828 768 N 4.3265 8.7531 124.0174 55.2789 39.4635 174.0438 769 H 3.9451 8.9950 122.2437 56.3092 26.4889 176.0867 770 Y 4.0742 7.9200 118.3692 61.3130 38.3672 176.3488 771 Q 3.7351 8.2848 119.3926 59.3955 29.1133 179.2368 772 Q 3.8813 7.8478 117.6019 59.4434 28.6222 178.3859 773 R 4.1579 8.2618 120.8189 59.2163 30.0361 178.3317 774 L 3.8474 8.2709 120.3385 57.9029 42.0595 178.4220 775 Q 4.0157 8.5343 119.7083 59.6567 28.9628 179.5319 776 S 4.2941 8.6127 116.5248 61.2719 62.9347 176.2274 777 L 3.9332 8.0248 123.0888 58.2631 41.8098 178.2106 778 Y 4.1533 8.3601 119.6679 60.8882 38.5447 177.6799 779 F 4.0153 8.2650 119.9939 61.4766 39.4849 176.5928 780 K 3.4891 8.0603 117.6947 59.4759 32.0190 178.3587 781 K 3.8495 7.7459 118.1314 57.9202 33.3872 177.4663 782 K 4.3257 7.4237 119.9868 54.5586 31.3282 174.5817 783 F 4.2871 7.5819 121.8654 58.4152 42.6800 176.4207 784 A 3.8585 8.0701 121.8019 55.8283 18.2188 178.4915 785 E 3.6281 8.2547 114.8466 60.2302 29.5258 179.5106 786 R 4.7012 8.0323 118.2262 59.1052 30.5534 179.4575 787 V 3.6165 7.6183 118.1925 64.3446 31.1313 178.3705 788 A 3.9682 8.0162 121.7190 54.7343 18.5607 178.8828 789 E 4.0589 8.5894 115.2483 57.9279 29.7818 178.8937 790 V 3.7448 7.1382 118.4446 65.3713 32.1134 177.3846 791 K 3.8335 7.5785 117.9969 59.0928 31.7124 176.8399 792 P 4.1866 0.0000 0.0000 66.1550 30.9647 178.1770 793 K 3.9575 8.0810 118.4470 58.9638 31.8770 179.5107 794 V 3.6023 7.8005 119.2908 64.6609 31.3934 178.0625 795 E 3.8354 8.6245 120.3044 58.9539 29.5400 178.4198 796 A 4.0090 8.9600 121.8434 55.4671 18.2326 179.7105 797 I 3.9142 7.5607 117.7213 64.1438 37.2093 178.4375 798 R 3.9369 8.1909 120.1653 59.5437 29.8741 178.8178 799 S 4.2113 8.7259 114.4111 61.2650 63.2002 176.1140 800 G 3.3696 7.8817 109.6051 47.6376 0.0000 175.2920 801 S 4.6502 8.4980 118.3795 61.4051 63.0173 176.8163 802 E 4.0797 8.0429 121.1415 59.3356 29.3690 178.2672 803 E 3.9325 8.8621 119.2841 59.8371 29.3934 179.5689 804 V 3.3640 7.5684 116.5421 66.1194 31.4921 177.4810 805 F 4.5418 8.0532 119.3404 60.7020 39.3217 176.9416 806 R 4.1903 7.8804 116.6802 56.6651 30.4989 176.3108 807 S 4.1697 8.0770 114.3093 58.5045 62.5299 174.9762 808 G 3.5822 8.7481 115.6183 47.4292 0.0000 174.5839 809 A 4.0259 9.5415 124.2280 55.0687 18.3977 179.5367 810 L 4.0037 8.9130 119.6105 57.9402 42.1686 178.8685 811 K 3.8487 8.1626 119.6846 59.8361 32.2311 178.6549 812 Q 3.9287 8.4959 119.9481 58.6244 28.9924 177.8735 813 L 3.8421 7.9191 121.7220 57.9928 42.1002 178.7714 814 L 4.0784 8.0190 118.9146 57.8667 41.5284 178.8736 815 E 3.8539 7.9856 119.1077 59.5399 29.4171 179.1313 816 V 3.3688 7.4192 117.7938 65.9822 31.4235 178.1564 817 V 3.4309 7.6009 117.6569 65.5527 31.3052 177.6857 818 L 4.0965 8.3650 120.2786 58.2561 41.9302 178.8156 819 A 4.1126 7.8595 120.2699 55.1710 18.2114 179.3808 820 F 4.3229 8.7537 116.5764 60.9941 39.1922 178.2081 821 G 3.5367 8.5724 105.3696 48.0004 0.0000 175.4847 822 N 4.4728 8.6071 118.3763 56.0147 38.5833 176.6561 823 Y 4.1390 8.3225 120.6931 59.1602 39.2275 177.2956 824 M 4.2366 9.2811 116.6435 56.9519 32.6984 178.7916 825 N 4.5386 5.7700 125.3728 52.8442 36.5582 176.1536 826 K 4.2294 7.8171 126.3828 56.5944 35.4447 177.7774 827 G 3.9229 8.5372 104.1145 45.3691 0.0000 174.3896 828 Q 4.2275 8.5529 120.9118 57.0314 29.5203 177.4958 829 R 4.3369 8.0003 115.1330 58.1386 31.2994 177.3716 830 G 4.0631 7.0406 105.1477 43.6620 0.0000 174.6018 831 N 4.0523 8.8362 115.6775 53.2635 36.1926 174.0095 832 A 4.5684 8.0257 120.3794 52.9974 19.9464 177.7567 833 Y 4.2763 8.4256 116.7608 57.1690 39.4035 175.6797 834 G 3.9574 7.5232 107.9953 45.7249 0.0000 171.8868 835 F 5.0021 7.5408 112.7881 54.6877 40.7997 174.4254 836 K 4.0913 8.8200 121.7391 56.5301 32.5537 178.3712 837 I 3.8460 8.5534 117.7513 63.8884 37.0673 178.2111 838 S 4.1307 7.9858 115.1648 60.6563 61.8631 176.1051 839 S 4.0474 8.6817 119.8581 61.4309 62.3432 176.0132 840 L 3.7136 7.5935 121.6481 58.1731 41.1459 180.0346 841 N 4.9575 7.7905 112.8908 53.5956 37.8180 176.2647 842 K 4.7066 8.1622 117.8667 56.0130 34.3731 178.5158 843 I 3.6533 7.6057 118.5473 64.4996 37.0613 178.2520 844 A 4.8356 7.9949 120.2049 53.9299 18.3457 178.2856 845 D 4.3873 7.5216 114.5847 57.3454 41.1771 176.7736 846 T 4.2187 8.3639 117.6042 63.0628 68.9651 174.9486 847 K 4.6711 8.4911 126.1136 55.3329 33.7423 176.8501 848 S 4.4454 8.2832 117.0565 58.1109 62.7464 174.3390 849 S 4.3554 8.5437 118.1900 60.7296 63.4193 175.7319 850 I 3.7693 7.4397 121.2060 63.2307 37.4433 175.1362 851 D 4.8758 7.6530 117.7551 52.1176 43.4373 176.5351 852 K 4.2763 8.8569 124.6124 57.9789 32.1162 176.9435 853 N 4.7216 8.1106 116.0342 53.7874 40.5238 175.0682 854 I 4.0689 7.4848 119.1684 60.7520 36.2917 175.3922 855 T 4.4731 8.5389 119.8769 61.1580 69.5344 174.5956 856 L 4.2182 8.6211 126.4370 57.4146 41.9443 179.3099 857 L 3.9823 7.8370 120.2339 58.6711 42.1460 177.8031 858 H 4.1674 8.1337 115.7106 59.3869 28.6929 176.5675 859 Y 3.9772 8.1652 120.7676 60.7948 38.6239 177.9849 860 L 4.1072 8.4347 121.1278 58.3198 42.1308 179.0943 861 I 3.6833 8.0568 119.7294 65.1856 36.9391 177.7806 862 T 3.7643 8.2175 116.4089 67.5862 67.8633 176.2904 863 I 3.6814 7.9950 114.8768 63.8687 37.6628 178.8032 864 V 3.7585 7.9161 121.1080 64.9751 31.0200 178.3148 865 E 4.0817 8.1795 118.3802 58.3836 29.3507 177.8566 866 N 4.7491 7.6105 114.2683 53.5896 39.2512 175.2405 867 K 4.4793 7.6923 114.5146 56.9486 35.8556 176.7274 868 Y 4.7493 8.5840 116.8928 54.9942 39.8640 173.4952 869 P 4.2813 0.0000 0.0000 65.2678 31.8403 177.9198 870 S 4.0992 8.2018 112.8917 61.6792 62.6852 176.5649 871 V 3.6760 7.6974 121.4425 65.3596 30.8357 177.6771 872 L 4.0261 7.7911 118.5659 58.0420 41.7801 178.7999 873 N 5.5426 7.9712 113.7745 54.4853 38.2080 175.9737 874 L 3.9384 7.8367 120.4999 58.0980 42.2330 178.0030 875 N 4.3542 8.1707 115.3548 56.7183 38.5837 177.1563 876 E 4.0162 8.0810 119.2202 59.2774 29.4980 178.3307 877 E 4.4423 7.8781 113.7916 56.5280 30.1496 176.5452 878 L 4.9208 7.6380 120.1404 54.5593 43.3117 179.0364 879 R 3.8942 8.3255 117.5087 59.3899 29.2738 176.9750 880 D 4.5934 8.7996 116.5254 54.4559 41.3007 178.2767 881 I 3.3710 7.6211 121.7612 63.8588 37.8829 176.7678 882 P 5.0741 0.0000 0.0000 65.1891 31.3710 177.1327 883 Q 5.0676 7.3138 115.7535 55.6000 28.5866 176.3672 884 A 4.6162 7.7074 117.9366 52.7792 24.3379 178.3560 885 A 4.5687 7.9629 118.2979 53.2602 18.8536 178.6701 886 K 4.4183 7.2520 113.1572 56.1663 33.0325 176.8343 887 V 3.6820 7.4248 119.8100 62.2938 31.9152 174.2361 888 N 4.5655 8.5343 125.9116 52.1683 39.4275 174.2601 889 M 3.8484 8.5372 128.4587 59.6226 32.1984 177.5773 890 T 3.8491 7.9108 114.9748 66.3774 68.7945 175.5702 891 E 3.8987 8.1904 120.2930 59.5917 29.6192 178.9554 892 L 3.9404 8.2934 120.3127 58.3876 42.1841 178.4705 893 D 4.4159 8.2664 119.0101 57.4177 40.6358 179.0956 894 K 3.9356 7.9301 118.6039 59.7696 31.7852 179.0610 895 E 3.9940 8.0689 118.1627 59.7121 29.2638 179.7495 896 I 3.9999 7.8917 119.7635 64.3143 37.0869 178.5971 897 S 4.1675 8.1200 116.0345 62.1744 62.6367 176.6562 898 T 3.6606 8.2443 118.5811 66.8372 68.0584 176.5377 899 L 4.3214 7.7007 120.4001 57.5461 41.7971 179.4847 900 R 3.6177 8.1325 116.6413 59.1971 29.3615 178.9467 901 S 4.0976 8.9435 116.5395 61.0056 63.1458 176.3076 902 G 3.5208 7.7445 110.4293 47.1545 0.0000 175.4602 903 L 3.3718 7.7106 120.9573 57.2775 41.6700 179.4438 904 K 3.8356 7.9849 119.4268 59.3318 32.0301 178.6334 905 A 3.9037 8.1646 121.6189 55.1313 18.3097 179.8118 906 V 3.6157 7.3708 116.5177 65.8750 31.4775 178.1403 907 E 4.0361 8.2056 118.6073 59.2784 29.2688 179.0825 908 T 3.8436 7.9866 115.9688 66.7224 68.5182 176.0802 909 E 3.9864 8.3591 121.0407 59.2386 29.4957 178.8650 910 L 4.2472 8.0643 120.1853 58.3274 42.0646 178.6078 911 E 3.9550 8.1255 117.1533 60.0072 29.7568 178.1715 912 Y 4.0139 8.4846 119.4315 61.3218 38.3562 178.3017 913 Q 4.2404 8.9515 119.1588 58.7226 28.6945 179.2231 914 K 4.1811 8.0771 118.8354 57.9152 32.0933 178.1195 915 S 4.6710 7.9468 114.2467 57.2239 64.5564 173.3393 916 Q 4.4893 6.8919 121.7554 53.8979 31.3444 173.3654 917 P 4.2282 0.0000 0.0000 62.1484 31.8233 174.5919 918 P 4.4423 0.0000 0.0000 63.4649 31.7381 175.1266 919 Q 4.5696 7.9192 115.8997 54.3152 32.3852 172.1503 920 P 4.4149 0.0000 0.0000 64.1841 31.5641 176.8894 921 G 3.9705 9.0744 112.5522 45.2176 0.0000 173.2770 922 D 4.8240 7.1821 118.8956 53.4666 39.5972 175.8243 923 K 4.5115 8.8491 120.8914 56.5786 32.6310 177.6789 924 F 3.8607 8.2561 121.6931 61.4401 39.0236 176.9453 925 V 3.9971 8.1874 117.4399 66.2171 30.9214 178.4228 926 S 4.0810 8.0217 112.3544 61.2694 62.4595 175.9778 927 V 3.5579 7.8933 120.8928 66.2142 31.3069 178.3173 928 V 3.6698 8.0668 118.4958 65.7602 30.9032 178.1231 929 S 4.1161 7.9549 114.4035 61.0595 62.7793 176.4074 930 Q 3.9380 7.7737 122.0931 59.5289 28.8291 177.1307 931 F 4.2927 8.4102 121.2164 61.6076 39.1370 176.8437 932 I 3.1178 8.0394 118.7487 65.0979 37.2382 177.8929 933 T 3.9932 7.5708 115.5890 66.6367 68.3134 176.2568 934 V 3.6936 7.8712 118.9099 66.4213 31.5518 178.3251 935 A 4.0900 8.5545 120.5046 55.3495 18.1912 179.5196 936 S 4.0969 8.7226 112.5425 61.2638 62.0172 176.2957 937 F 4.4075 8.2466 123.1274 61.5878 39.4425 177.2766 938 S 4.0673 8.2701 114.6589 61.6357 62.6325 176.6172 939 F 4.1837 8.8704 123.5076 60.9880 39.0763 177.3149 940 S 4.1596 8.1018 111.8337 60.9646 62.2219 175.5409 941 D 4.2426 7.5683 119.6968 57.1720 40.9966 177.8315 942 V 3.3414 7.2607 118.2217 66.2271 31.3946 177.5520 943 E 3.6390 7.5671 118.5383 59.2430 29.3283 178.5902 944 D 4.2758 8.0131 118.9063 57.4007 40.8785 178.7377 945 L 4.0850 7.7071 118.9012 57.6065 41.6293 179.1412 946 L 3.8484 8.0680 120.2067 58.1465 42.0368 178.7717 947 A 3.9540 7.9507 120.6274 55.3740 18.1878 178.7827 948 E 3.7768 8.1371 117.4307 59.3180 29.5953 178.5667 949 A 4.0231 8.8122 120.7875 55.5102 18.6001 179.7361 950 K 3.9262 8.6788 116.9616 59.5643 32.0647 179.1272 951 D 4.2589 8.1322 118.1838 57.5192 41.2973 178.1490 952 L 3.9888 8.1339 119.6169 58.2215 41.5263 178.9062 953 F 4.8377 8.9629 122.4938 60.7190 39.3401 176.8349 954 T 3.5036 8.2175 108.9969 65.1805 68.3535 176.3226 955 K 3.9108 8.0767 120.6638 58.9521 32.1351 179.2571 956 A 4.1685 7.8761 121.1760 55.2257 17.8298 179.7950 957 V 2.9189 7.7564 117.0802 65.8781 31.5327 178.3823 958 K 4.0814 8.0081 118.0308 59.2381 31.6973 178.7513 959 H 4.3087 8.3223 117.8398 58.1331 29.7229 176.2530 960 F 4.5620 7.9844 116.3146 56.9053 39.4757 176.5892 961 G 4.0211 8.0330 108.2874 45.2689 0.0000 174.6081 962 E 4.1401 7.4805 118.0873 56.0533 30.3239 176.8499 963 E 4.0826 9.1758 121.2855 57.2296 31.6206 176.6545 964 A 3.6721 7.1911 116.7205 51.6358 21.3264 179.1629 965 G 4.0986 8.8918 106.7346 46.8975 0.0000 174.2144 966 K 4.3902 7.7177 116.6244 55.9399 33.2142 177.1132 967 I 4.6176 7.3280 118.3884 58.5927 41.1122 174.8415 968 Q 4.7372 8.3815 125.4414 53.5065 31.9709 175.1290 969 P 4.2418 0.0000 0.0000 66.3834 31.2804 178.3123 970 D 4.8856 7.7871 119.0792 54.7358 38.8759 177.8300 971 E 4.2978 8.0693 119.8207 58.7385 30.1782 176.6355 972 F 4.1298 8.7268 120.5304 62.2867 39.2770 176.8761 973 F 4.6709 8.9152 117.4822 59.5649 38.8055 178.0873 974 G 3.7113 7.6573 107.3517 47.3091 0.0000 175.4311 975 I 3.6177 7.9035 123.3408 64.3319 37.1597 178.4825 976 F 4.1899 7.8603 117.5728 60.3716 38.7960 176.9023 977 D 4.4006 8.4839 117.8260 57.8429 41.0570 178.5655 978 Q 4.0823 8.5049 118.6052 58.7472 28.6370 178.7638 979 F 4.5279 8.0630 122.9270 61.0315 39.3480 177.0820 980 L 3.8780 8.3733 117.6038 58.7159 41.5980 178.7328 981 Q 3.9839 8.4939 118.3531 57.2712 28.4155 178.0764 982 A 3.8537 8.3284 123.3458 55.4095 18.6885 180.1059 983 V 3.4584 7.5675 116.7060 65.9534 31.8105 178.0784 984 S 4.0344 7.9933 113.2918 61.3534 62.2329 175.7100 985 E 4.1456 8.0986 118.5856 58.2229 29.6988 178.5266 986 A 4.1287 7.4477 121.1451 54.8584 18.5597 179.1813 987 K 3.8524 8.4348 117.6314 59.6035 32.4210 178.7597 988 Q 4.0818 7.9931 117.4291 59.6159 28.6649 178.1147 989 E 3.9116 8.2922 121.3788 59.0255 29.1968 179.3258 990 N 4.3329 8.4617 116.0303 55.8241 38.7155 176.7753 991 E 4.0804 8.7523 121.3292 59.1058 29.7781 178.0182 992 N 4.2250 8.2154 116.1574 57.0039 38.7442 176.8682 993 M 4.0562 7.8291 119.0448 58.4076 31.9390 178.1637 994 R 3.9716 8.2241 119.3331 58.6554 30.1578 178.6013 995 K 4.0405 7.7513 117.9950 59.1114 31.9993 178.7894 996 K 3.8499 8.3172 120.1524 59.4598 31.7416 178.4322 997 K 4.4901 7.7328 118.3179 57.4477 32.3991 178.5837 998 E 4.0837 7.6806 118.9225 59.3541 29.5807 178.5945 999 E 3.9932 8.3451 118.5466 59.1285 29.2387 178.5421 1000 E 4.1732 7.9242 116.3266 57.7923 29.7649 178.4437 1001 E 4.1587 8.2369 119.5564 58.4489 29.8551 178.6505 1002 R 4.0289 7.7305 117.2597 58.7804 30.7992 178.3260 1003 R 3.8867 8.1764 118.5936 59.8325 29.7377 178.1307 1004 A 4.0622 7.5994 120.0323 54.8451 18.3911 179.3603 1005 R 4.0435 7.7344 115.4883 58.7983 30.3420 177.8474 1006 M 4.2919 8.5190 118.6209 57.7910 32.0965 177.5977 1007 E 4.1657 8.1814 116.6895 57.5720 29.4291 177.8283 1008 A 5.2751 7.3113 120.1355 51.9790 19.2912 177.8195 1009 Q 4.4316 8.0128 115.6092 57.1348 30.8389 177.6715 1010 L 4.1644 7.6708 119.1926 57.7049 41.7903 179.0668 1011 K 4.3513 7.4891 113.9867 57.7357 32.5197 177.0663 1012 E 4.2452 7.8240 123.4537 56.5516 30.5708 175.0443 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 601 K 8.31 4.20 0.00 1.77 1.95 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.38 7.81 602 S 7.95 4.10 0.00 3.91 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 0.00 603 I 8.56 4.02 1.75 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 1.55 0.75 0.91 0.00 0.00 604 P 0.00 4.25 0.00 1.65 1.87 0.00 2.35 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.83 0.00 605 Q 8.19 4.56 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.94 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 606 P 0.00 4.40 0.00 2.47 2.12 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 607 T 8.56 3.99 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 0.00 608 N 7.78 5.05 0.00 2.75 2.82 0.00 0.00 6.87 7.35 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 0.00 609 A 8.43 4.45 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 0.00 610 L 8.20 5.35 0.00 1.51 1.76 0.95 1.06 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 0.00 611 K 8.82 4.26 0.00 1.80 1.83 0.00 1.76 0.00 0.00 1.89 0.00 0.00 2.80 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.68 1.70 7.81 612 S 8.17 4.50 0.00 3.88 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 613 F 8.45 4.56 0.00 2.40 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 614 N 7.73 4.18 0.00 2.80 2.77 0.00 0.00 6.98 7.95 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 0.00 615 W 7.14 4.25 0.00 3.28 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 0.00 616 S 8.15 4.50 0.00 3.78 3.76 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 0.00 617 K 7.81 3.30 0.00 1.48 1.38 0.00 1.40 0.00 0.00 1.73 0.00 0.00 2.85 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.30 1.08 7.81 618 L 7.54 4.58 0.00 1.28 1.41 0.89 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 619 P 0.00 4.19 0.00 2.13 1.95 0.00 3.55 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 620 E 8.75 3.94 0.00 1.88 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 2.28 2.30 0.00 621 N 7.90 4.30 0.00 2.77 2.79 0.00 0.00 7.19 7.22 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 0.00 622 K 7.85 4.12 0.00 1.87 1.84 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.36 7.81 623 L 7.61 4.41 0.00 1.80 1.86 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 624 E 8.13 4.05 0.00 2.01 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.26 0.00 625 G 8.75 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 0.00 0.00 0.00 626 T 7.38 4.72 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 1.32 0.00 0.00 627 V 7.98 3.47 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 0.49 0.00 0.00 0.39 0.00 0.00 628 W 7.36 4.54 0.00 3.38 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 0.00 629 T 7.76 3.93 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 630 E 8.26 4.64 0.00 1.89 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 2.25 2.29 0.00 631 I 7.69 4.51 2.23 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.74 1.18 0.00 0.00 632 D 8.48 4.69 0.00 2.66 2.52 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 0.00 633 D 8.86 4.44 0.00 2.86 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 0.00 634 T 8.28 4.19 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 635 K 7.99 3.93 0.00 1.83 1.89 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.70 7.81 636 V 7.51 3.45 1.86 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 0.80 0.00 0.00 0.84 0.00 0.00 637 F 7.82 4.33 0.00 3.34 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 0.00 638 K 7.54 3.90 0.00 1.73 1.89 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.56 7.81 639 I 7.67 4.49 1.86 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 0.74 0.91 0.00 0.00 640 L 7.25 4.16 0.00 1.72 1.64 0.82 0.96 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 0.00 641 D 8.45 4.68 0.00 2.77 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 642 L 7.82 3.96 0.00 1.77 1.76 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 643 E 8.45 3.91 0.00 2.09 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 2.40 2.48 0.00 644 D 8.70 4.33 0.00 3.07 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 0.00 645 L 8.08 4.19 0.00 1.82 1.89 0.78 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 646 E 8.39 4.04 0.00 2.26 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 2.39 2.53 0.00 647 R 7.59 4.06 0.00 1.97 2.08 0.00 3.07 0.00 0.00 3.25 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.75 0.00 648 T 7.90 4.06 4.54 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 0.82 0.00 0.00 649 F 7.84 4.81 0.00 3.20 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 0.00 650 S 7.78 4.59 0.00 4.02 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 0.00 651 A 8.80 4.10 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 652 Y 8.33 5.51 0.00 2.84 2.94 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 0.00 653 Q 8.41 4.68 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.07 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 654 R 8.77 4.17 0.00 1.70 1.91 0.00 3.30 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 655 Q 8.44 3.69 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.18 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 656 Q 8.82 4.18 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 7.49 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 657 D 8.17 4.49 0.00 2.66 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *680 L 7.32 4.14 0.00 1.66 1.69 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 681 K 7.73 5.30 0.00 1.96 1.92 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.16 1.16 7.81 682 V 6.33 4.38 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 0.63 0.00 0.00 0.93 0.00 0.00 683 K 8.45 4.65 0.00 1.71 1.61 0.00 1.83 0.00 0.00 1.72 0.00 0.00 2.75 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.34 1.45 7.81 684 E 8.87 4.61 0.00 1.88 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 2.25 2.24 0.00 685 L 7.77 4.80 0.00 1.52 1.30 0.71 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 686 S 8.66 4.71 0.00 3.99 3.62 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 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0.00 3.00 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 0.00 894 K 7.93 3.94 0.00 2.04 1.89 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.67 7.81 895 E 8.07 3.99 0.00 2.22 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 2.35 2.50 0.00 896 I 7.89 4.00 2.11 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.99 1.13 0.00 0.00 897 S 8.12 4.17 0.00 4.09 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 0.00 898 T 8.24 3.66 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 1.34 0.00 0.00 899 L 7.70 4.32 0.00 1.89 1.27 1.11 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 900 R 8.13 3.62 0.00 2.07 2.36 0.00 2.83 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.70 0.00 901 S 8.94 4.10 0.00 3.99 4.15 0.00 0.00 0.00 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0.00 3.95 4.01 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 0.00 927 V 7.89 3.56 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 0.83 0.00 0.00 0.96 0.00 0.00 928 V 8.07 3.67 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 1.08 0.00 0.00 -0.11 0.00 0.00 929 S 7.95 4.12 0.00 4.05 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 930 Q 7.77 3.94 0.00 2.24 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 931 F 8.41 4.29 0.00 2.97 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 932 I 8.04 3.12 1.89 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.40 0.83 0.00 0.00 933 T 7.57 3.99 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 934 V 7.87 3.69 2.38 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.82 0.00 0.00 0.85 0.00 0.00 943 E 7.57 3.64 0.00 1.83 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 944 D 8.01 4.28 0.00 2.87 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 0.00 945 L 7.71 4.09 0.00 1.73 1.65 0.85 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 946 L 8.07 3.85 0.00 1.74 1.81 0.88 1.35 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 0.00 947 A 7.95 3.95 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 0.00 948 E 8.14 3.78 0.00 2.15 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 0.00 2.30 2.32 0.00 949 A 8.81 4.02 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 0.00 950 K 8.68 3.93 0.00 1.95 1.90 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.64 7.81 951 D 8.13 4.26 0.00 2.90 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 952 L 8.13 3.99 0.00 2.08 1.81 0.89 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 953 F 8.96 4.84 0.00 3.21 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 0.00 954 T 8.22 3.50 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 1.18 0.00 0.00 955 K 8.08 3.91 0.00 1.88 1.75 0.00 1.55 0.00 0.00 1.52 0.00 0.00 2.93 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.38 1.59 7.81 956 A 7.88 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 957 V 7.76 2.92 1.67 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 0.51 0.00 0.00 -0.93 0.00 0.00 958 K 8.01 4.08 0.00 2.07 1.82 0.00 1.51 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.41 1.45 7.81 959 H 8.32 4.31 0.00 3.43 3.82 0.00 5.91 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 960 F 7.98 4.56 0.00 3.37 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 961 G 8.03 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 962 E 7.48 4.14 0.00 2.26 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 2.53 2.70 0.00 963 E 9.18 4.08 0.00 2.02 1.86 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 2.40 2.32 0.00 964 A 7.19 3.67 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 965 G 8.89 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 966 K 7.72 4.39 0.00 1.87 1.85 0.00 1.53 0.00 0.00 1.62 0.00 0.00 3.07 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.57 1.40 7.81 967 I 7.33 4.62 1.87 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 1.53 0.85 0.84 0.00 0.00 968 Q 8.38 4.74 0.00 2.28 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.65 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 969 P 0.00 4.24 0.00 2.28 1.59 0.00 3.53 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.65 0.00 970 D 7.79 4.89 0.00 3.07 3.15 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 0.00 971 E 8.07 4.30 0.00 2.10 2.19 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 2.36 2.38 0.00 972 F 8.73 4.13 0.00 3.17 2.93 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 0.00 973 F 8.92 4.67 0.00 3.44 3.11 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 0.00 974 G 7.66 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 0.00 975 I 7.90 3.62 1.66 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.08 0.30 0.00 0.00 976 F 7.86 4.19 0.00 3.17 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 0.00 977 D 8.48 4.40 0.00 3.10 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 978 Q 8.50 4.08 0.00 2.32 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.59 0.00 0.00 0.00 0.00 0.00 2.41 2.52 0.00 979 F 8.06 4.53 0.00 3.22 3.36 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 0.00 980 L 8.37 3.88 0.00 1.77 1.73 0.95 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 981 Q 8.49 3.98 0.00 2.34 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.61 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 982 A 8.33 3.85 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 0.00 983 V 7.57 3.46 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 0.83 0.00 0.00 0.20 0.00 0.00 984 S 7.99 4.03 0.00 3.88 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 0.00 985 E 8.10 4.15 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.37 0.00 986 A 7.45 4.13 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 0.00 987 K 8.43 3.85 0.00 1.76 2.04 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.19 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.44 7.81 988 Q 7.99 4.08 0.00 2.35 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.49 0.00 0.00 0.00 0.00 0.00 2.49 2.39 0.00 989 E 8.29 3.91 0.00 2.11 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 0.00 2.34 2.79 0.00 990 N 8.46 4.33 0.00 2.83 2.87 0.00 0.00 6.97 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 991 E 8.75 4.08 0.00 1.98 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 2.33 0.00 992 N 8.22 4.22 0.00 2.75 2.87 0.00 0.00 6.73 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 0.00 993 M 7.83 4.06 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.54 0.00 994 R 8.22 3.97 0.00 2.01 2.05 0.00 3.13 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 995 K 7.75 4.04 0.00 1.96 1.82 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.62 7.81 996 K 8.32 3.85 0.00 1.86 1.82 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.49 7.81 997 K 7.73 4.49 0.00 2.06 1.85 0.00 1.68 0.00 0.00 1.48 0.00 0.00 3.29 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.34 7.81 998 E 7.68 4.08 0.00 2.36 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 2.30 2.34 0.00 999 E 8.35 3.99 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 2.33 2.51 0.00 1000 E 7.92 4.17 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 2.32 2.53 0.00 1001 E 8.24 4.16 0.00 2.26 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 2.30 2.47 0.00 1002 R 7.73 4.03 0.00 1.85 1.95 0.00 3.16 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 1003 R 8.18 3.89 0.00 1.96 2.00 0.00 3.08 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.68 0.00 1004 A 7.60 4.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1005 R 7.73 4.04 0.00 2.08 1.97 0.00 3.25 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 1006 M 8.52 4.29 0.00 2.04 2.29 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 2.65 2.56 0.00 1007 E 8.18 4.17 0.00 2.04 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 2.61 0.00 1008 A 7.31 5.28 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 1009 Q 8.01 4.43 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.92 0.00 0.00 0.00 0.00 0.00 2.28 2.49 0.00 1010 L 7.67 4.16 0.00 1.69 1.70 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 1011 K 7.49 4.35 0.00 1.98 1.86 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.43 7.81 1012 E 7.82 4.25 0.00 2.20 1.75 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 2.21 2.23 0.00 * Residues marked with a * may have inaccurate shift predictions.