NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 592 S 4.4199 8.3349 115.4118 58.2061 64.5210 171.9761 593 L 4.5939 7.8728 119.2424 51.4298 45.8296 175.5559 594 R 3.6195 8.4693 118.9130 60.0497 30.0168 177.0658 595 Y 4.4517 8.4541 118.6894 61.0340 38.6279 178.0979 596 A 3.9252 8.0192 119.5344 54.9488 18.5452 179.1792 597 S 4.2120 7.7407 113.1187 60.8550 63.3798 174.8166 598 D 4.5655 8.3577 119.5773 54.0765 42.1779 176.4079 599 F 5.2395 8.0514 116.2899 55.3952 43.3135 174.4896 600 E 4.5633 8.8443 121.6350 54.0656 31.9520 174.5423 601 E 4.3972 8.7759 126.1174 56.8042 29.9665 176.3845 602 I 4.2380 9.3641 127.0846 62.6119 37.1781 175.4307 603 A 4.7778 7.5576 122.1400 50.0185 23.3053 174.5342 604 V 4.0193 8.4298 120.8028 62.9217 31.3851 175.8862 605 L 4.3302 9.0423 129.8299 57.4488 42.5161 177.2211 606 G 4.2805 7.7266 103.5359 45.3886 0.0000 171.9590 607 Q 4.9165 8.4942 118.0120 53.9943 32.5812 174.9629 608 G 3.7941 8.1847 110.5087 43.2597 0.0000 172.5454 609 A 4.0518 7.8658 121.1443 53.4310 18.8101 178.2086 610 F 5.0247 6.5557 108.9881 56.6955 40.5143 174.5361 611 G 4.6593 6.3168 112.9662 46.2336 0.0000 175.5250 612 Q 4.6431 7.7974 127.2310 55.9673 30.6466 171.1997 613 V 4.8379 7.9566 118.5547 61.3447 34.7776 174.6323 614 V 5.0214 8.9973 120.5642 59.4546 35.9141 174.1517 615 K 4.9526 9.1874 123.6819 55.0281 33.7484 175.0678 616 A 5.2923 9.1958 128.5292 50.2984 23.3220 174.2346 617 R 4.6301 8.5518 120.7665 54.6262 32.2310 174.8525 618 N 4.4729 9.2156 126.0118 52.9628 39.6659 175.1939 619 A 4.1001 8.9982 128.5139 53.3905 18.0480 177.6842 620 L 4.3056 7.6543 115.0677 55.0828 43.0042 176.8334 621 D 4.7116 7.5208 113.7130 51.9564 40.3946 176.6772 622 S 3.7929 8.3472 114.7042 59.0884 61.7850 171.4421 623 R 4.2951 8.0822 120.0394 56.1530 31.1941 175.3655 624 Y 4.9498 8.4000 118.7343 57.5885 39.6096 174.4964 625 Y 4.9926 9.1752 118.5399 56.5948 43.5731 173.8439 626 A 5.0254 9.1959 123.6851 50.8359 21.0589 176.0958 627 I 4.7737 8.9610 124.5398 59.5952 39.7028 174.8114 628 K 4.7670 8.7437 129.2395 54.9531 34.1946 175.1537 629 K 4.3568 8.8990 126.4996 54.4165 35.2240 175.0722 630 I 4.7420 8.3847 126.1257 59.5658 39.7606 174.3308 631 R 4.7351 8.0797 128.1240 55.5606 31.2033 175.0664 632 H 4.4924 8.3867 124.8797 56.1785 34.9155 173.1480 633 T 4.5347 8.3336 108.6118 61.4113 69.5168 175.3316 634 E 4.0043 8.6650 122.3171 59.1455 29.2158 179.2431 635 E 3.9065 8.0563 118.5985 59.3834 29.9788 178.6105 636 K 4.0951 8.1026 118.2726 59.0218 32.0635 179.4903 637 L 3.9590 8.0963 119.9446 57.5284 41.3627 179.3109 638 S 4.3035 8.0156 113.2550 60.9735 62.8177 175.9630 639 T 4.1419 7.4112 112.5716 62.9961 69.1496 175.4079 640 I 4.3649 7.8275 115.0022 60.4776 38.5333 177.1536 641 L 3.9367 7.7891 121.5512 57.9978 41.4783 178.7433 642 S 4.0360 8.0219 112.5372 61.6014 62.2902 175.8575 643 E 3.8770 8.0329 121.3201 59.1275 29.4691 178.6953 644 V 3.5055 7.9134 118.4670 66.2445 31.3629 178.0069 645 M 4.1304 8.2667 117.9790 58.2270 32.0248 178.4518 646 L 4.0874 7.7831 119.3737 57.5995 41.8766 179.4173 647 L 3.5759 7.9017 118.8447 57.4938 41.2754 179.1226 648 A 4.8515 8.1064 120.3077 53.5373 18.3614 178.7940 649 S 4.3746 7.6323 111.7196 58.7635 64.0243 174.8445 650 L 4.3471 7.0940 122.5179 54.8859 41.8989 176.9541 651 N 4.8254 8.6106 120.6800 52.5826 40.1113 172.5563 652 H 4.5548 8.2483 123.3472 53.2440 33.1517 174.2671 653 Q 3.9377 8.1830 123.5229 58.8485 28.5608 176.8216 654 Y 5.8710 7.8439 114.4071 56.8577 38.4421 174.4256 655 V 5.0941 7.7606 119.1158 60.8793 34.4607 175.4358 656 V 4.0207 9.0050 128.6196 63.2892 32.2365 175.7588 657 R 4.1815 9.1417 126.8487 56.2719 31.8039 175.3412 658 Y 4.4641 8.4475 120.8351 56.7837 38.8415 175.9714 659 Y 4.4161 8.8744 123.4101 60.7981 38.6570 176.1907 660 A 4.8275 7.9145 117.3389 51.3355 22.6163 174.9619 661 A 5.2601 8.7118 120.0967 50.6136 22.6990 175.4422 662 W 5.1504 8.5591 115.5231 55.4839 32.1387 172.9093 663 L 5.2382 8.8105 123.0087 53.4948 43.8231 175.0191 664 E 4.7260 9.3625 126.2459 54.8210 31.8082 175.9564 *768 R 4.4793 8.4823 122.6655 56.4633 31.6088 175.9641 769 R 4.5982 7.8314 117.5413 53.6084 30.3673 175.9993 770 N 4.4584 8.6617 118.2658 54.4704 37.5155 176.3645 771 F 4.9580 7.9186 112.3427 56.6028 40.2520 175.3842 772 V 3.6490 7.4174 121.2448 63.1252 29.5575 178.5714 *780 K 4.0986 9.0100 112.0298 56.0252 33.2945 174.8071 781 K 4.8283 8.4565 121.8316 54.7980 35.8313 175.5929 782 S 4.8889 8.9129 119.3769 57.0580 67.0224 172.7472 783 T 4.9115 8.5697 116.5210 61.8592 71.4783 173.3368 784 L 4.7153 8.5898 129.3039 54.0902 43.7820 175.1125 785 F 4.6596 8.9579 125.0838 55.4631 41.9169 174.7184 786 I 4.7350 8.1716 122.9411 59.5074 40.7061 174.2467 787 Q 4.5653 9.5185 130.2919 55.5027 30.0558 174.4942 788 M 5.1568 9.1676 126.0816 52.8379 36.1005 174.9179 789 E 4.6901 9.0054 122.4737 56.9368 30.5975 175.5361 790 Y 4.6248 8.6182 127.0451 56.4002 39.6362 175.0735 791 C 4.3117 7.6269 125.5819 57.6302 28.0454 174.0403 792 E 3.4857 7.4456 121.4887 57.5719 29.8112 177.3881 793 N 4.6745 7.1116 117.9936 52.2607 40.2237 174.5400 794 G 4.0619 8.6130 107.7524 46.9479 0.0000 171.6909 795 T 4.9447 9.5975 110.5387 59.0272 71.9877 175.0473 796 L 3.9519 8.8206 122.4878 58.2332 41.8097 177.9777 797 Y 3.9551 7.9888 119.1467 60.9952 38.5115 177.6769 798 D 4.4630 7.8032 118.1876 57.4154 41.2719 178.5328 799 L 4.0791 7.8662 120.5836 58.2740 41.9183 179.0546 800 I 3.6307 7.8928 118.8248 64.1556 37.0285 177.1817 801 H 4.7798 7.5917 114.1122 55.3259 28.8508 175.6482 802 S 4.6620 7.6140 113.3136 57.8569 64.0199 173.0327 803 E 4.6222 7.6911 118.8646 55.8571 34.0903 175.1174 804 N 4.7026 8.2246 117.6903 51.6696 37.5451 176.0728 805 L 4.0957 7.6696 122.8976 58.0921 42.8256 178.5684 806 N 4.1990 8.1098 114.9118 54.9058 37.2080 175.3134 807 Q 4.5013 8.1141 115.3429 55.9567 29.3726 176.2819 808 Q 4.4652 7.8671 119.9951 53.6120 28.4094 175.6697 809 R 2.5100 8.1163 121.9209 59.3161 30.5128 177.2233 810 D 4.4096 7.9436 117.6432 57.3056 40.7921 178.4833 811 E 4.1371 7.9210 118.8491 59.0375 29.8029 178.1679 812 Y 4.3839 7.6368 117.1551 59.0579 38.1801 177.8965 813 W 4.6747 7.8452 121.6777 59.6032 29.5142 178.3570 814 R 4.0742 8.1528 118.3968 59.4598 29.5107 178.6629 815 L 4.0037 8.2717 118.7978 57.6182 41.7316 178.9796 816 F 4.1644 8.3943 120.6999 61.2528 39.1500 177.1160 817 R 3.7674 8.7062 118.5535 59.6774 29.9550 178.2617 818 Q 3.8949 7.8352 117.4219 59.2882 28.5365 179.4292 819 I 3.6555 7.6698 120.4823 64.2413 36.9906 178.5328 820 L 3.8329 7.5424 119.9160 57.6254 41.3941 179.4017 821 E 3.9923 8.5887 118.7677 59.3501 29.4359 179.2639 822 A 4.0094 8.2980 120.8739 55.2804 18.4866 179.7655 823 L 3.8963 8.2985 117.7944 57.5149 41.6109 179.7660 824 S 4.0670 8.2975 113.8367 61.3987 62.5364 175.4959 825 Y 4.1214 8.0873 122.1647 60.8280 38.6670 177.9887 826 I 3.6740 7.9524 120.6670 64.9239 37.3037 178.2832 827 H 4.5465 8.4046 117.0517 58.6071 28.2672 177.9080 828 S 4.2579 8.0289 115.2461 60.5200 62.8470 175.4366 829 Q 4.3931 7.0989 119.2602 54.7024 28.7314 175.4146 830 G 3.8889 7.9507 107.5380 46.8725 0.0000 174.0365 831 I 4.5842 7.4863 118.4229 58.9810 39.8098 175.4745 832 I 4.6977 7.4600 123.6742 59.7808 40.1550 175.5818 833 H 4.1578 9.7681 125.7384 59.2474 29.8017 177.8400 834 R 4.2095 9.0302 115.3277 56.5908 29.2596 176.1008 835 D 4.7610 7.7329 116.9401 52.9640 41.4973 174.8663 836 L 3.7980 8.0361 120.4740 54.4794 42.7573 175.5527 837 K 3.8332 7.9162 123.1308 54.7775 35.0613 174.5066 838 P 4.1010 0.0000 0.0000 66.1183 31.2553 178.3365 839 M 4.0556 7.7017 114.8630 56.6070 32.2272 176.3973 840 N 4.3093 8.0353 116.3074 53.3311 39.7235 174.2279 841 I 4.4404 6.8541 119.9027 59.6636 38.1110 175.4147 842 F 4.7267 9.0232 126.5596 56.9022 40.7740 174.9950 843 I 5.1250 8.3224 121.3533 59.7024 40.1694 175.8013 844 D 4.7695 8.9495 127.1034 51.7183 40.8554 177.0398 845 E 4.1139 8.6910 116.7878 59.4558 29.2620 178.0308 846 S 4.4153 8.1646 112.7672 58.2817 63.0915 173.8152 847 R 3.9652 8.4076 118.7011 57.5906 27.7054 175.5335 848 N 5.2048 8.7189 114.4714 51.5919 41.6952 175.3920 849 V 4.5952 8.5824 115.7268 61.2843 33.8340 176.0271 850 K 4.9022 9.0677 121.9829 55.0187 35.7337 175.6866 851 I 4.2310 9.2810 128.2469 61.4868 38.1243 176.0471 852 G 4.5837 8.9757 114.4444 45.8361 0.0000 170.9730 853 D 4.7295 9.1362 114.9674 55.0052 38.3168 174.1173 854 F 3.5308 8.8976 116.6527 57.6579 40.0393 175.9793 855 G 4.0062 8.6809 113.4886 44.7938 0.0000 173.8996 856 L 4.2346 8.4371 123.8451 54.9515 42.7854 176.2499 *885 I 3.7337 7.5846 118.3700 63.3702 38.3761 173.4559 886 G 4.3971 9.1979 119.8801 46.6303 0.0000 174.1555 887 T 4.2998 7.9439 113.9282 63.4692 67.6055 176.2690 888 A 4.0807 8.0572 123.9614 54.9850 18.6173 179.0173 889 M 3.9033 8.0679 114.8179 58.2265 32.0764 176.2836 890 Y 4.6244 8.0475 114.2422 57.5277 38.6369 175.4827 891 V 3.7825 7.2641 119.4855 62.0806 31.9561 175.7410 892 A 2.8606 8.0098 129.0111 51.4121 19.3453 178.2708 893 T 3.7031 7.8071 111.7433 64.7905 68.7767 176.0069 894 E 3.8763 8.2165 119.3965 58.7180 29.4440 178.1924 895 V 3.6838 7.2435 117.2562 65.8853 31.4164 177.5189 896 L 4.0156 7.5623 114.3433 55.8055 40.6758 176.0510 *902 Y 4.5069 7.5450 116.9318 56.8539 39.1754 172.7456 903 N 5.2177 8.1924 116.2220 50.2194 40.5720 174.4913 904 E 4.0498 8.7073 115.3148 59.1634 29.2763 178.7839 905 K 4.1295 8.1452 119.5091 59.1205 32.0771 178.7147 906 I 3.8339 7.7862 113.4589 63.8999 37.3099 178.0611 907 D 4.4304 8.2750 121.0251 57.4330 40.4240 178.4576 908 M 4.1333 7.9844 118.1160 58.3735 32.2264 177.7726 909 Y 4.6663 7.8818 120.6526 60.5365 39.0244 177.9373 910 S 4.5847 8.2518 117.3935 61.1601 62.9690 176.7410 911 L 4.1524 8.3491 122.9751 57.8618 41.7636 179.2501 912 G 3.6088 8.2520 105.8969 47.8781 0.0000 175.5039 913 I 3.6323 7.6487 122.5106 64.0465 36.9594 178.2914 914 I 3.9362 7.9793 119.1101 64.5778 37.3094 177.8596 915 F 4.5862 8.8437 121.7947 61.2366 39.0638 176.7406 916 F 3.6950 8.3350 120.2083 61.4446 39.0024 177.0061 917 E 3.9447 8.2469 116.2150 59.3474 29.2649 178.8707 918 M 4.0869 7.6388 118.3412 56.8441 32.2184 176.9809 919 I 3.5198 6.7220 109.7287 60.3478 38.9298 174.7027 920 Y 3.9064 7.1394 122.0562 54.4030 38.9594 172.9076 921 P 4.1097 0.0000 0.0000 62.0147 32.4045 175.9492 922 F 4.9764 8.2192 117.6723 56.0767 41.9650 175.5455 923 S 4.5562 10.0340 119.7557 60.2169 63.8077 175.4080 924 T 4.8675 7.7206 108.8138 58.6929 72.9639 174.8412 925 G 3.5881 8.5826 108.4538 48.3683 0.0000 175.8035 926 M 3.9965 7.9529 120.7858 57.9097 32.0449 178.1741 927 E 3.9201 7.9438 118.9565 59.3067 29.7686 178.7271 928 R 2.5100 7.6382 118.4911 58.9471 30.0048 178.4471 929 V 3.3923 7.6712 118.0016 66.0588 31.2602 177.5028 930 N 4.2324 8.0863 114.9476 56.4416 38.6649 176.8929 931 I 3.7738 7.7082 120.7911 64.6451 37.2721 178.1898 932 L 3.6995 7.8970 119.4756 58.0511 41.5106 179.9673 933 K 3.9178 7.9773 117.8674 59.2320 31.3608 179.6327 934 K 3.9374 8.0494 119.1401 59.3178 31.9433 179.3279 935 L 3.7268 7.4251 118.7367 57.7702 41.2213 179.6957 936 R 4.0320 8.0472 117.8817 57.9689 30.5461 177.4666 937 S 4.3215 7.3885 112.9783 57.9746 63.3849 175.4314 938 V 3.3443 8.2450 120.2201 65.7806 31.4211 177.5415 939 S 4.1469 7.6509 114.1874 60.0789 63.1131 174.4685 940 I 3.6271 7.2827 117.4197 61.7341 34.3171 173.9239 941 E 4.3928 7.7656 118.1779 55.7483 30.5060 177.2899 942 F 4.3149 8.7069 122.5501 55.0232 40.7001 173.8990 943 P 4.3276 0.0000 0.0000 62.2956 31.3300 175.5076 944 P 4.2477 0.0000 0.0000 65.5275 30.9398 176.2567 945 D 4.8106 8.1345 116.6633 52.9283 39.5894 175.4259 946 F 4.6969 8.3590 123.0061 57.7785 39.8824 174.5886 947 D 4.4356 8.0832 129.8472 54.1816 39.4039 176.8993 948 D 4.3865 8.1116 121.7560 56.2127 40.7679 176.5097 949 N 4.5810 7.1441 114.9849 53.7419 40.1977 175.6753 950 K 3.8635 7.8154 122.5269 59.5263 33.4552 177.0038 951 M 5.1151 7.6419 116.2529 52.3646 32.5651 176.2416 952 K 4.1847 7.9269 122.9863 59.3793 33.0575 178.1302 953 V 3.7344 7.8607 119.3795 64.8232 31.1561 178.0807 954 E 4.3326 8.5357 118.0277 59.0269 29.4051 178.8938 955 K 4.2950 8.0013 119.7551 59.0362 32.2595 178.7403 956 K 3.8467 7.8835 119.6262 59.5894 32.1317 178.7547 957 I 3.8268 8.0381 120.0790 64.7200 37.0559 178.6029 958 I 3.8633 8.5033 120.9450 64.2406 36.6583 178.4986 959 R 4.0004 8.1844 119.1019 59.3803 30.2305 178.3124 960 L 4.1605 8.0287 118.6700 57.9699 41.8457 179.2999 961 L 4.1513 8.4299 119.3993 57.3785 41.3323 178.7872 962 I 3.7457 7.4627 110.6522 59.7207 38.8053 175.2943 963 D 4.5660 7.5693 119.9709 55.1530 41.5360 176.3471 964 H 4.2339 9.0018 122.4092 57.7954 29.0024 174.7648 965 D 4.7803 9.9138 119.8978 51.5861 41.5051 173.8429 966 P 4.4679 0.0000 0.0000 66.0912 31.2106 178.3210 967 N 4.4972 8.2158 114.6413 55.2983 38.6291 175.8750 968 K 4.2962 8.6449 116.5224 57.2420 32.7436 177.1496 969 R 4.3872 7.6274 119.3177 54.9266 30.4499 174.4599 970 P 4.5677 0.0000 0.0000 61.8927 32.5912 177.0717 971 G 3.8609 8.5833 107.8833 44.4599 0.0000 174.3752 972 A 4.0145 8.5616 122.7386 55.0090 18.3051 180.2546 973 R 3.8296 7.9453 116.6623 60.0378 30.2736 178.1113 974 T 3.7748 8.0471 114.7959 67.0716 68.1978 175.7947 975 L 4.0119 7.8684 120.1553 58.2885 41.9229 179.5662 976 L 4.1066 7.6448 116.8782 57.2168 41.5933 178.3932 977 N 4.6942 7.8311 114.4920 53.5168 39.0904 177.1040 978 S 3.6625 7.4835 115.7315 59.3169 62.7956 175.5548 979 G 3.8677 7.2138 109.5741 44.9333 0.0000 174.4769 980 W 4.5035 7.2959 119.7088 59.6410 29.2458 177.2840 981 L 3.4792 7.7943 116.5325 53.5834 41.5732 175.0527 982 P 4.0041 0.0000 0.0000 62.4449 31.4181 176.9383 983 V 3.7485 8.3210 122.1059 62.0045 31.1058 175.9718 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 592 S 8.33 4.42 0.00 4.00 3.99 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 0.00 593 L 7.87 4.59 0.00 1.91 1.63 1.05 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 594 R 8.47 3.62 0.00 1.37 1.18 0.00 2.31 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.17 0.00 595 Y 8.45 4.45 0.00 2.57 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 0.00 596 A 8.02 3.93 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 0.00 597 S 7.74 4.21 0.00 3.76 3.82 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 0.00 598 D 8.36 4.57 0.00 2.24 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 0.00 0.00 0.00 599 F 8.05 5.24 0.00 2.47 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 0.00 600 E 8.84 4.56 0.00 1.97 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 2.19 2.21 0.00 601 E 8.78 4.40 0.00 2.19 2.26 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 2.42 2.45 0.00 602 I 9.36 4.24 2.06 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 1.39 1.18 1.01 0.00 0.00 603 A 7.56 4.78 1.22 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 0.00 0.00 604 V 8.43 4.02 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 0.84 0.00 0.00 0.96 0.00 0.00 605 L 9.04 4.33 0.00 1.77 1.79 1.11 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 606 G 7.73 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 0.00 0.00 0.00 0.00 607 Q 8.49 4.92 0.00 1.83 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.74 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 608 G 8.18 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 0.00 609 A 7.87 4.05 1.20 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 0.00 0.00 610 F 6.56 5.02 0.00 3.19 3.32 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 0.00 611 G 6.32 4.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.76 0.06 -0.84 0.00 0.00 920 Y 7.14 3.91 0.00 1.64 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 0.00 921 P 0.00 4.11 0.00 1.97 1.77 0.00 3.13 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.69 0.00 922 F 8.22 4.98 0.00 3.00 3.08 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 0.00 923 S 10.03 4.56 0.00 3.92 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 0.00 924 T 7.72 4.87 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 1.22 0.00 0.00 925 G 8.58 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 0.00 926 M 7.95 4.00 0.00 2.06 2.11 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 2.67 2.57 0.00 927 E 7.94 3.92 0.00 2.09 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 0.00 2.62 2.49 0.00 928 R 7.64 2.51 0.00 0.92 1.65 0.00 2.97 0.00 0.00 2.91 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.50 0.00 929 V 7.67 3.39 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 0.90 0.00 0.00 0.86 0.00 0.00 930 N 8.09 4.23 0.00 2.83 2.84 0.00 0.00 7.11 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 0.00 931 I 7.71 3.77 2.05 0.00 0.00 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 1.60 0.90 0.86 0.00 0.00 932 L 7.90 3.70 0.00 1.54 1.54 0.72 1.08 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 0.00 933 K 7.98 3.92 0.00 1.91 1.80 0.00 1.59 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.61 7.81 934 K 8.05 3.94 0.00 1.90 1.88 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.57 7.81 935 L 7.43 3.73 0.00 1.44 1.21 -0.92 -0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 936 R 8.05 4.03 0.00 1.86 2.00 0.00 3.26 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 937 S 7.39 4.32 0.00 4.00 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 938 V 8.24 3.34 2.02 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 0.71 0.00 0.00 0.88 0.00 0.00 939 S 7.65 4.15 0.00 3.94 3.90 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 0.00 940 I 7.28 3.63 1.93 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.71 1.08 0.00 0.00 941 E 7.77 4.39 0.00 1.98 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 2.33 2.27 0.00 942 F 8.71 4.31 0.00 2.81 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 0.00 943 P 0.00 4.33 0.00 2.54 2.13 0.00 3.39 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.82 0.00 944 P 0.00 4.25 0.00 2.24 2.31 0.00 3.81 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 945 D 8.13 4.81 0.00 2.88 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 946 F 8.36 4.70 0.00 3.14 3.21 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 0.00 947 D 8.08 4.44 0.00 2.24 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.11 4.39 0.00 2.62 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 0.00 949 N 7.14 4.58 0.00 2.64 2.71 0.00 0.00 6.84 7.61 0.00 0.00 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 7.82 3.86 0.00 1.64 1.75 0.00 1.67 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.41 1.49 7.81 951 M 7.64 5.12 0.00 2.07 1.52 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 952 K 7.93 4.18 0.00 2.05 1.81 0.00 1.70 0.00 0.00 1.86 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.47 7.81 953 V 7.86 3.73 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 1.20 0.00 0.00 1.07 0.00 0.00 954 E 8.54 4.33 0.00 2.00 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 2.66 2.14 0.00 955 K 8.00 4.29 0.00 2.52 2.12 0.00 1.87 0.00 0.00 1.50 0.00 0.00 2.27 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.10 0.87 7.81 956 K 7.88 3.85 0.00 1.90 1.94 0.00 1.16 0.00 0.00 1.07 0.00 0.00 2.66 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.18 1.30 7.81 957 I 8.04 3.83 2.26 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.84 1.19 0.00 0.00 958 I 8.50 3.86 2.11 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.04 0.82 0.00 0.00 959 R 8.18 4.00 0.00 1.88 2.14 0.00 3.40 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 960 L 8.03 4.16 0.00 2.05 1.80 0.88 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 961 L 8.43 4.15 0.00 1.73 1.97 1.23 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 962 I 7.46 3.75 1.27 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.50 0.57 0.00 0.00 963 D 7.57 4.57 0.00 2.96 2.72 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 0.00 964 H 9.00 4.23 0.00 3.19 3.41 0.00 5.93 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 965 D 9.91 4.78 0.00 2.68 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 0.00 966 P 0.00 4.47 0.00 2.30 2.60 0.00 3.79 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 2.12 2.04 0.00 967 N 8.22 4.50 0.00 2.89 2.96 0.00 0.00 6.88 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 968 K 8.64 4.30 0.00 1.90 1.91 0.00 1.87 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.62 7.81 969 R 7.63 4.39 0.00 2.12 1.97 0.00 3.55 0.00 0.00 3.50 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.91 0.00 970 P 0.00 4.57 0.00 2.34 2.23 0.00 3.89 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 2.15 2.17 0.00 971 G 8.58 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 972 A 8.56 4.01 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 0.00 973 R 7.95 3.83 0.00 1.95 1.95 0.00 3.28 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 974 T 8.05 3.77 4.51 0.00 0.00 0.00 0.00 0.00 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 0.00 975 L 7.87 4.01 0.00 1.70 1.87 1.15 1.58 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 0.00 976 L 7.64 4.11 0.00 1.84 1.73 1.04 0.99 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 0.00 977 N 7.83 4.69 0.00 2.63 2.75 0.00 0.00 6.68 8.92 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 0.00 978 S 7.48 3.66 0.00 2.72 3.03 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 0.00 979 G 7.21 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 0.00 980 W 7.30 4.50 0.00 3.49 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 0.00 981 L 7.79 3.48 0.00 1.57 1.45 1.20 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 982 P 0.00 4.00 0.00 1.67 1.76 0.00 2.25 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.40 0.00 983 V 8.32 3.75 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 0.64 0.00 0.00 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.