NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 601 K 4.1674 8.3144 120.1386 54.1760 34.4427 176.1405 602 S 3.9260 8.1007 112.5742 56.5311 61.2082 167.9471 603 I 4.1416 7.2448 112.5090 59.1674 39.9965 173.0966 604 P 4.5278 0.0000 0.0000 62.0402 32.6077 175.0506 605 Q 4.6057 7.9034 116.8928 53.1415 32.0812 173.9483 606 P 4.6500 0.0000 0.0000 62.6003 32.2204 177.2688 607 T 4.0312 8.5163 110.6892 64.3798 68.8758 174.6858 608 N 5.0746 7.9099 116.9743 49.9777 42.1209 173.9202 609 A 4.2376 8.5201 121.6586 52.8733 19.5177 176.6144 610 L 5.2109 8.2743 119.3259 52.3456 44.9378 176.6345 611 K 4.2117 8.6512 120.6842 57.0589 32.6082 177.1128 612 S 4.5314 8.4822 118.0694 57.5293 64.7676 173.3115 613 F 4.7813 8.2157 123.6189 56.7315 40.4931 176.5021 614 N 4.5339 8.6496 130.3816 52.3142 37.1289 173.2635 615 W 4.2238 6.8671 117.8928 55.1883 30.4227 176.4808 616 S 4.5176 8.0777 114.1110 56.3040 64.0229 174.6858 617 K 3.4738 7.9873 125.1815 55.7262 32.4809 176.7738 618 L 4.1290 7.5832 122.5066 53.1028 42.6631 175.3649 619 P 4.2705 0.0000 0.0000 62.7323 32.2166 177.4119 620 E 3.9785 8.6262 120.8228 59.1873 29.6051 178.4276 621 N 4.6122 8.0921 113.7627 53.9650 37.4878 175.3423 622 K 4.4690 7.6880 117.5519 56.3700 33.1353 176.6477 623 L 4.5443 7.5138 121.3159 54.7009 43.4817 175.8395 624 E 4.1509 8.2369 116.8155 56.7363 30.1327 176.5624 625 G 3.9531 7.6503 104.6168 45.3147 0.0000 173.0227 626 T 4.5558 7.4442 110.0460 59.5648 71.4195 175.4948 627 V 3.2417 8.0855 113.7920 64.4867 31.1617 178.8293 628 W 4.2483 7.6698 117.2640 59.7180 28.5970 178.2849 629 T 3.9748 7.3241 115.0220 66.5304 68.0092 175.0369 630 E 4.4333 8.1894 117.2690 55.3944 30.3410 175.8169 631 I 4.4601 7.0155 120.0439 59.6651 39.4543 175.4920 632 D 4.4746 8.1669 123.2397 52.4321 42.0770 175.4026 633 D 4.1527 8.7555 128.1488 55.5003 39.4702 178.0013 634 T 4.3408 8.0908 110.7842 64.3172 69.0902 175.8230 635 K 4.1810 7.6294 121.7431 59.4401 32.9281 179.1329 636 V 3.5893 7.3866 119.2064 65.9628 31.0527 178.0189 637 F 4.5419 7.5933 116.2195 60.5096 38.8725 177.3221 638 K 4.2167 7.7299 116.0822 59.1513 31.8626 179.1467 639 I 3.9772 7.4639 118.9330 63.0144 37.8707 176.7953 640 L 4.1000 7.7427 118.8476 54.6603 42.0119 177.9399 641 D 4.6272 8.4315 121.6386 53.4802 40.0429 176.8154 642 L 4.0484 8.2094 126.1897 57.3091 42.0278 178.0576 643 E 3.9075 8.3341 118.8540 59.6765 29.3865 178.4198 644 D 4.3459 8.1919 117.9324 56.9360 41.2907 177.9308 645 L 4.0854 7.7116 120.9971 58.3059 41.9435 178.7774 646 E 4.0509 8.2643 117.2990 59.5142 29.4880 179.3006 647 R 4.0543 7.6874 116.6656 59.6230 30.3046 178.7359 648 T 3.9417 7.7076 110.5945 63.1951 67.9401 174.2749 649 F 4.9150 8.2220 120.3868 56.7582 40.0805 175.1605 650 S 4.5359 8.1233 113.8884 58.0255 63.9879 174.1862 651 A 4.1259 8.8490 125.6199 55.1151 18.3670 177.4300 652 Y 4.4143 7.4951 113.9416 57.8688 38.3447 171.3731 653 Q 3.4279 9.3709 134.3655 54.8807 28.6326 173.4295 *683 K 4.1062 8.4715 121.5957 56.4776 33.9403 175.0622 684 E 4.6408 8.4641 121.6190 55.0584 32.1631 174.8987 685 L 3.5621 8.7553 125.0737 54.5053 43.3506 175.5348 686 S 4.6090 8.9898 121.4077 57.1823 64.5884 172.7948 687 V 4.1656 8.8816 125.7276 64.2754 33.4193 175.8840 688 I 3.9719 8.0576 118.6064 61.5783 37.5043 176.0380 689 D 4.7137 8.6292 123.9901 53.4272 41.2228 177.9136 690 G 3.5631 8.5749 107.1263 47.7088 0.0000 176.0578 691 R 3.8934 8.0320 120.4745 59.5103 30.2851 178.6586 692 R 3.9995 8.9990 117.8988 59.1043 30.1035 178.8824 693 A 3.9228 8.2493 120.7628 55.3896 18.4226 179.5159 694 Q 3.8811 8.4438 118.3616 59.3077 28.9926 178.1223 695 N 4.2292 8.2041 117.5918 56.3159 38.5428 177.1484 696 C 3.4263 7.6048 117.9233 62.7953 28.2946 175.9470 697 N 4.3622 7.9949 117.8482 56.1295 37.5407 177.6531 698 I 3.5955 7.5612 121.3215 64.2854 37.1673 178.1813 699 L 3.9239 7.4019 120.7813 58.1837 41.9083 179.0369 700 L 3.8572 8.2019 119.5751 57.4674 41.2994 179.3696 701 S 4.1972 7.8126 113.0095 60.3941 63.0861 175.8469 702 R 4.1744 7.1750 121.2712 58.6700 29.2076 177.6128 703 L 4.0471 8.2530 120.5378 55.9782 41.8048 177.6761 704 K 4.0860 7.9372 115.5030 57.2085 30.2050 174.8876 705 L 4.9274 7.1227 117.5314 52.8763 44.1038 177.3985 706 S 4.5831 9.2311 117.8079 57.6403 65.6450 175.2681 707 N 4.4432 8.6355 118.7058 56.3217 38.1587 177.4814 708 D 4.3708 8.0702 119.9920 57.4255 40.9900 178.3174 709 E 3.9977 8.0292 118.4727 59.5012 29.4370 179.4333 710 I 3.7644 8.0525 119.9058 64.4484 37.1727 178.2487 711 K 3.9518 8.2432 120.2897 59.7264 31.9218 178.9208 712 R 3.9305 8.1715 117.9900 59.1825 29.9817 178.8630 713 A 4.0335 8.2972 120.6865 55.1694 18.3741 179.7426 714 I 3.6946 8.0491 118.3138 64.7138 37.3001 178.7428 715 L 4.1585 8.3310 120.2876 57.6020 41.1979 178.7020 716 T 4.3200 7.9624 106.4515 60.8721 69.1793 174.4298 717 M 3.0587 8.6082 120.2515 57.5022 30.8918 176.5297 718 D 4.3889 8.5988 113.9585 55.4469 40.2657 174.1605 719 E 4.0719 8.0506 116.8013 58.9300 30.3570 178.3550 720 Q 4.2699 8.0586 116.2120 55.1003 29.4761 174.8110 721 E 3.9584 7.6650 116.0550 57.8021 27.0173 174.6720 722 D 4.7503 9.2405 116.6498 54.5310 41.8830 177.9274 723 L 4.6782 7.8048 119.7676 51.3486 41.8313 174.9633 724 P 4.5123 0.0000 0.0000 61.6734 33.6678 176.4227 725 K 4.0802 8.7475 119.0208 60.2324 31.8622 179.2394 726 D 4.4939 8.1235 118.3797 56.4945 39.5067 178.3602 727 M 4.1367 8.0349 119.9309 58.1295 32.0294 178.4048 728 L 4.0362 8.1996 119.3480 57.5319 41.5440 178.9157 729 E 3.3366 7.7747 118.2800 59.4633 29.9600 178.6901 730 Q 4.0635 7.7986 117.5756 58.9125 28.7629 178.6716 731 L 4.2649 8.4973 121.7427 58.1014 41.9030 178.8534 732 L 4.0003 7.7826 117.9305 56.8507 41.5552 178.9533 733 K 3.9343 7.4252 117.9343 57.8667 32.8908 177.6720 734 F 4.9049 7.1748 117.8273 56.6653 38.6940 176.2440 735 V 4.2948 7.4413 119.7648 61.0668 32.8006 173.5171 736 P 4.3920 0.0000 0.0000 62.6189 31.9832 176.5154 737 E 4.4946 8.8534 122.1989 54.7460 32.3471 177.3451 738 K 3.7708 8.5912 121.6689 60.2209 32.0775 178.8935 739 S 4.2644 7.9966 113.4858 61.1305 63.2689 175.9978 740 D 4.3861 8.0609 122.4174 57.1866 40.6702 178.5940 741 I 3.7714 7.9922 113.7274 64.0050 37.4954 177.6352 742 D 4.4014 7.9046 119.8545 57.1695 41.0107 178.7108 743 L 4.1190 7.7800 119.7919 58.3686 42.1921 179.1140 744 L 4.1100 8.0738 118.9313 57.5432 41.2959 178.7371 745 E 4.1036 8.6685 119.1766 59.7540 29.5214 178.6763 746 E 4.1347 7.8556 116.4722 58.4839 29.5676 177.0881 747 H 5.2133 8.5810 116.2598 53.9694 30.0776 175.5444 748 K 3.5769 8.2136 120.2385 59.3755 32.5023 176.9632 749 H 4.8659 7.9549 115.2081 55.9136 28.7443 174.7413 750 E 4.7955 8.2283 119.7946 55.8294 30.9553 177.9729 751 L 3.7943 8.1531 121.9485 57.9433 41.7316 179.3112 752 D 4.4968 7.9587 115.9914 55.3344 39.7510 177.0746 753 R 4.3047 7.9520 118.6875 57.2877 30.8130 176.4715 754 M 4.3433 7.4608 118.0247 54.7310 32.5445 176.2518 755 A 4.3266 8.8148 125.6386 51.2884 19.5123 178.4326 756 K 3.8271 8.8612 119.9327 59.9337 32.0255 179.0080 757 A 4.0621 7.9265 120.2222 55.1657 18.3767 179.1915 758 D 4.3028 8.0203 116.9429 57.5940 40.9970 178.8418 759 R 3.9420 8.2165 119.3232 59.1829 29.9810 178.0893 760 F 4.3031 8.5574 120.7701 61.6310 39.3021 177.1590 761 L 3.5240 8.2735 118.6035 57.4483 41.1183 179.5018 762 F 3.9259 8.0545 119.8375 61.2393 39.8111 176.7359 763 E 4.0538 8.6005 118.6444 59.8438 29.0906 179.3650 764 M 3.4566 7.7415 118.9550 57.9550 31.5268 178.8964 765 S 3.9213 7.0292 113.2968 60.8548 63.3111 176.3193 766 R 3.8819 7.0497 120.0809 57.0158 30.0316 176.6570 767 I 4.0256 6.6310 120.4723 59.9222 37.9065 175.3437 768 N 4.1672 8.8674 123.7498 55.7220 39.8259 174.3438 769 H 4.2320 8.9225 122.0240 55.7793 26.5881 175.1061 770 Y 4.0316 7.7392 122.7438 60.9181 39.2097 176.4428 771 Q 3.6908 8.0583 120.1129 59.1532 29.1511 177.9503 772 Q 4.1022 7.7899 117.0975 58.2574 29.0331 178.1405 773 R 4.0198 7.8742 120.8698 59.0506 30.1079 178.5033 774 L 3.8610 7.9182 120.4833 58.0109 41.9448 178.8195 775 Q 4.0168 8.3929 119.9882 59.3019 28.9969 178.3307 776 S 4.1683 7.9811 115.8225 61.5298 62.9250 176.4545 777 L 3.8714 8.1722 123.0478 58.1629 41.8298 178.3466 778 Y 4.1209 8.0433 119.4452 60.7101 38.5675 177.6159 779 F 3.8260 8.2770 120.3314 61.1966 39.2959 176.5468 780 K 3.2430 8.0403 119.0059 59.4188 31.6690 178.9511 781 K 3.9972 7.7559 117.0461 58.5191 32.2567 178.5184 782 K 4.3290 7.4851 116.9692 56.2999 32.1606 178.3176 783 F 3.7451 7.7057 122.2518 61.0147 39.3933 176.8750 784 A 3.9959 8.1070 120.2295 55.2416 18.3130 179.3217 785 E 3.9175 7.9949 115.6227 59.5000 29.5897 179.3796 786 R 3.7978 7.7482 119.0766 58.8649 30.0193 179.1814 787 V 3.3745 7.6050 118.0740 65.8044 31.2908 178.0208 788 A 3.9520 7.7072 119.2814 54.6976 18.1639 178.9429 789 E 4.0026 7.7377 117.8715 59.0872 29.9798 178.6922 790 V 3.8736 7.4117 118.7733 64.0640 31.9485 178.3836 791 K 3.8246 8.0514 119.1672 58.9900 32.0149 177.4580 792 P 4.2651 0.0000 0.0000 65.4729 31.2350 178.7968 793 K 3.9907 7.8945 117.0457 59.2376 32.2330 179.3751 794 V 3.6079 7.6177 118.3023 65.6384 31.2980 177.8003 795 E 3.8990 8.1913 119.2243 58.8473 29.3995 178.4945 796 A 3.8634 7.8383 120.7860 55.2853 18.4745 179.6814 797 I 3.5293 7.4615 117.7858 64.4167 37.2589 178.7420 798 R 3.8885 7.8482 119.2954 59.3407 29.8765 178.5979 799 S 4.1198 8.4165 113.3960 61.4009 62.5148 176.1168 800 G 3.3366 8.0584 108.7221 47.9643 0.0000 175.6756 801 S 4.6745 8.2264 117.4828 61.4380 62.9589 176.4982 802 E 4.0178 8.2005 121.5431 59.2312 29.4618 178.5290 803 E 3.9907 8.5976 119.2977 59.5969 29.3944 179.7209 804 V 3.5609 7.7851 117.5834 64.9799 31.3082 177.8082 805 F 4.1236 8.1668 120.1304 59.8097 39.3855 175.7842 806 R 4.4542 7.7868 111.5879 55.3728 30.3430 176.1396 807 S 4.2954 8.3015 114.9665 58.9533 63.2236 174.7104 808 G 3.6006 8.8252 116.6748 47.5086 0.0000 174.7769 809 A 4.0635 8.4155 123.2245 54.9538 18.3165 179.5225 810 L 3.9998 7.8427 118.6359 58.1929 42.0518 179.0916 811 K 3.9492 7.8743 119.7922 59.4250 32.0941 178.6072 812 Q 3.8543 8.0404 119.7775 58.6760 28.8651 177.7653 813 L 3.8187 7.8313 121.3668 58.0734 42.0968 178.8728 814 L 4.0782 8.0734 119.0365 57.8616 41.5435 179.2081 815 E 3.8470 7.8421 119.1864 59.1013 29.4895 179.0968 816 V 3.2999 7.4522 118.3493 65.8649 31.5534 178.2703 817 V 3.2963 7.9393 118.4169 65.4883 31.2208 177.6861 818 L 4.1479 8.3766 120.2217 58.1924 41.9856 178.4734 819 A 4.0536 7.8432 120.5953 55.5225 18.2066 179.4346 820 F 4.5318 8.4450 116.1585 61.0575 39.0352 178.3215 821 G 3.6144 8.4237 105.1538 47.9197 0.0000 175.5918 822 N 4.5595 8.3924 118.1276 55.8475 38.5375 176.5910 823 Y 4.3324 7.9233 120.5027 60.8044 39.1214 177.0136 824 M 4.2115 8.2676 118.4098 56.7785 33.6161 177.0168 825 N 4.6389 8.3249 119.2302 50.5753 37.2795 173.3378 826 K 3.7341 7.8621 117.8652 58.2753 34.4208 175.5609 827 G 3.8761 8.9098 113.1364 45.2488 0.0000 176.4496 828 Q 4.2850 8.7511 121.7376 55.7816 30.2257 174.8848 829 R 4.2221 10.6400 120.1124 56.4617 29.6023 177.6918 830 G 4.3065 7.2920 104.5261 45.5534 0.0000 173.7359 831 N 4.8364 7.7804 114.3597 51.7913 39.2570 173.3347 832 A 4.3621 9.2268 123.2890 52.0233 19.9982 177.5144 833 Y 4.3808 8.1590 117.1261 57.5036 39.2220 175.8560 834 G 3.9018 7.2068 106.9667 45.1945 0.0000 172.1600 835 F 5.0757 7.5736 113.8495 54.2560 41.3629 174.6518 836 K 4.2698 8.5652 120.6256 56.0108 32.7092 178.7054 837 I 3.6724 8.3600 116.6867 63.8489 37.2952 178.5708 838 S 4.0301 7.9625 115.6500 61.2019 62.7056 176.2988 839 S 4.0346 8.1486 119.1445 61.4001 62.2840 176.2993 840 L 3.6435 7.5221 121.2852 57.6875 40.7828 178.3820 841 N 4.8982 7.9047 113.8856 53.5741 38.4506 176.1927 842 K 4.6903 7.8384 119.8710 56.2766 33.0122 178.1173 843 I 3.7141 7.5366 121.5975 64.3053 36.9055 177.7611 844 A 4.2267 7.9442 118.9480 54.1913 18.4305 178.7390 845 D 4.5028 7.5980 117.3094 56.2685 41.1922 177.0023 846 T 4.1530 7.4899 117.6956 63.3375 69.3665 174.1201 847 K 4.8487 8.4352 125.5833 54.2192 34.7869 176.1456 848 S 4.3144 8.8857 119.6380 58.4294 62.5977 174.5419 849 S 4.3168 8.7369 120.0028 59.7631 63.2995 175.0517 850 I 4.0054 7.4683 122.2895 62.6609 37.6814 174.8741 851 D 4.9087 7.5739 117.8237 52.2407 43.3120 176.8285 852 K 4.2993 8.6868 125.1652 58.3075 32.4075 177.3649 853 N 4.5183 8.0618 114.8679 53.6874 39.1989 175.2144 854 I 3.9335 7.4745 121.0925 60.4471 36.9733 175.8975 855 T 4.7016 8.2519 117.2535 60.4297 71.9480 174.8425 856 L 4.2021 8.6874 121.4921 57.3029 41.8180 178.4734 857 L 4.1164 7.9724 120.5775 58.4863 42.3029 177.9273 858 H 4.0855 8.3161 115.7358 59.4009 28.6076 176.8453 859 Y 4.1024 8.1592 120.7791 60.4272 38.6037 177.7147 860 L 4.1223 8.0920 121.0789 58.5220 42.1096 178.9968 861 I 3.7442 7.8051 118.3554 64.6221 36.8747 178.4127 862 T 4.2131 7.8273 116.2695 66.6818 68.6126 176.9108 863 I 3.6276 7.5670 121.7801 64.5993 37.0020 178.6566 864 V 3.8659 7.9204 118.8206 65.4779 31.0661 177.6016 865 E 3.9526 7.4609 116.8643 59.5229 29.5515 178.5482 866 N 4.7434 7.9224 111.6508 53.1247 39.2428 175.3656 867 K 4.2520 7.3949 118.0946 57.6053 34.6566 176.5572 868 Y 4.7862 7.9990 115.6876 54.6307 38.7148 173.9598 869 P 4.3252 0.0000 0.0000 65.7516 31.7670 178.5958 870 S 4.1422 8.2855 113.6105 61.5532 62.4079 176.5721 871 V 3.6758 7.7467 121.5009 65.7130 30.9988 177.3425 872 L 4.2881 7.7890 116.6585 55.9706 41.7179 177.4505 873 N 4.6718 7.8829 116.8808 53.7791 38.9296 175.9295 874 L 3.9751 7.7175 122.9172 58.7445 41.9773 178.6598 875 N 4.3785 8.0492 115.4456 55.7124 37.3136 176.4569 876 E 4.0747 7.9746 120.5143 59.2010 30.0767 178.1370 877 E 4.2107 8.3772 116.9885 57.7817 30.0617 177.2375 878 L 4.9412 7.7411 120.0535 53.9856 42.5645 178.9749 879 R 4.0241 8.1873 117.0975 58.9540 29.8604 176.8213 880 D 4.6875 8.2490 116.4593 54.2828 41.4316 178.2656 881 I 3.5618 7.6727 122.1907 63.9710 36.8112 176.4088 882 P 4.4761 0.0000 0.0000 65.1472 31.3256 178.3345 883 Q 4.1152 7.9735 116.1493 58.6955 28.8083 178.2157 884 A 3.8571 7.9613 121.6549 54.8095 18.2485 179.4845 885 A 4.2151 8.3285 119.6217 54.9320 18.2327 179.0981 886 K 4.4660 7.4778 114.7190 56.0314 32.5286 177.1610 887 V 3.7231 7.1930 119.9738 62.0611 31.4464 175.4095 888 N 4.7100 8.6016 126.7873 53.4943 39.9006 175.0149 889 M 4.0639 8.1643 124.8644 58.6825 32.5492 178.2877 890 T 3.8465 7.8660 115.6859 66.6807 68.6926 175.9520 891 E 3.9998 8.0631 120.1159 58.7731 29.5944 178.3547 892 L 4.0514 8.0241 120.5171 58.5270 42.1826 178.8004 893 D 4.3800 8.3256 118.7579 57.2213 40.8131 178.8841 894 K 3.9897 7.9416 119.9622 59.3548 32.2962 178.8737 895 E 4.0025 8.2939 119.0439 59.5195 29.3715 179.3922 896 I 3.9611 8.0562 119.9768 64.2216 37.1134 178.5222 897 S 4.1505 8.3926 114.6594 61.6341 62.2825 176.3529 898 T 4.0402 7.9043 112.0904 64.3953 68.6862 176.5811 899 L 4.0336 7.8801 122.9892 57.9195 42.1529 178.8805 900 R 3.4697 8.0256 118.9124 59.4971 30.2364 178.7270 901 S 4.2580 8.2172 114.1945 61.2571 63.2073 176.5757 902 G 3.3710 8.0983 109.4457 47.1759 0.0000 175.5973 903 L 3.4455 7.4364 122.4140 57.6261 42.1333 178.8788 904 K 3.8469 7.8956 119.3902 59.4184 32.0618 178.6596 905 A 3.9832 7.7010 121.0366 54.7936 18.1508 179.8900 906 V 3.5425 7.4532 116.5323 66.2352 31.6674 177.9749 907 E 3.9873 8.3058 118.4879 59.8872 29.2904 179.6954 908 T 3.8884 7.9902 115.5748 66.7050 68.5977 176.5491 909 E 4.0573 8.2624 121.1331 58.9358 29.5071 178.5926 910 L 4.3046 8.4957 121.1589 58.0946 41.9305 178.7717 911 E 3.9787 8.0743 117.8194 59.4073 29.6930 178.2632 912 Y 4.1607 8.0928 119.5513 60.9497 38.6640 178.1724 913 Q 3.8389 8.1209 118.8678 58.9979 29.2191 177.8379 914 K 4.1704 8.2626 119.4475 58.8176 32.0922 177.8447 915 S 4.5916 7.3650 112.7952 57.8095 64.7120 173.9140 916 Q 4.4180 7.2304 119.5887 53.8788 32.4347 173.3788 917 P 4.2929 0.0000 0.0000 61.8576 31.8831 174.5072 918 P 4.2507 0.0000 0.0000 63.1658 31.8394 175.5482 919 Q 4.7301 8.4012 121.5595 52.8206 31.3786 173.4038 920 P 4.3201 0.0000 0.0000 64.3088 31.6394 176.8716 921 G 3.7914 8.8360 108.1948 45.7410 0.0000 172.6494 922 D 4.8752 7.7595 119.4093 52.9399 41.3391 175.6508 923 K 4.6171 8.6538 126.6415 56.2314 32.9937 178.8796 924 F 3.9338 8.6228 123.1021 61.4396 39.5718 177.6765 925 V 3.7626 8.1401 119.4987 66.1264 31.0410 177.6945 926 S 4.0702 8.0524 111.5212 60.9370 62.5982 175.4997 927 V 3.8939 7.3863 119.9240 65.2669 31.7070 178.2033 928 V 3.5187 7.9297 118.2465 65.7242 31.3363 178.2723 929 S 4.1002 7.7787 115.1110 61.6796 62.7957 176.3884 930 Q 4.0064 8.1117 120.2155 59.0170 28.3595 178.9440 931 F 4.1985 8.0616 121.2375 61.4567 39.4773 177.2200 932 I 3.2999 8.1814 119.8495 64.5273 36.9011 178.4258 933 T 3.8382 7.6901 116.3395 66.6398 68.3121 176.9992 934 V 3.8022 7.2707 119.1884 64.8180 31.6883 178.2148 935 A 3.3150 7.9925 122.3450 54.4632 18.0336 179.5693 936 S 4.1532 8.5434 112.0703 61.1436 62.5428 176.2478 937 F 4.2393 7.9288 122.2397 61.3249 39.2236 177.1640 938 S 3.6901 8.5560 113.2537 61.2992 62.1795 175.9075 939 F 4.3133 8.6389 123.4776 61.0321 39.0221 176.9444 940 S 3.9181 7.9791 112.5936 61.4889 62.0297 175.8583 941 D 4.1013 7.6311 119.9192 57.1654 40.9648 178.0969 942 V 3.4197 7.3975 118.7097 66.2815 31.4662 177.9001 943 E 3.7423 7.9321 118.2308 59.0601 29.1083 179.3031 944 D 4.1969 7.5617 118.9593 57.3826 41.0575 178.5627 945 L 3.9451 7.9123 119.5576 57.7925 41.5353 179.5689 946 L 3.8933 8.0076 119.9544 57.9275 41.7852 178.7475 947 A 3.9760 7.8799 121.0368 55.1762 18.3235 179.4607 948 E 3.9213 8.3032 115.9170 59.2597 29.8192 179.1395 949 A 4.0005 8.0116 121.7935 55.0451 18.5326 179.8264 950 K 4.1104 8.1307 116.8973 59.3667 32.0208 179.5374 951 D 4.3054 7.7527 119.2353 57.4386 40.7410 178.6787 952 L 3.9211 7.9188 119.4899 57.6299 41.5989 179.3415 953 F 4.3921 8.3341 121.9072 61.2152 39.4082 177.2233 954 T 3.6961 7.8761 115.1082 66.6375 68.1773 176.7296 955 K 4.0162 7.9425 120.1111 59.1800 31.8094 179.3524 956 A 4.4281 8.2229 121.5628 54.9235 18.4471 179.8701 957 V 2.7722 7.6464 117.1042 66.0055 31.5690 178.4986 958 K 3.9791 7.7307 117.6672 59.6852 31.6085 178.7752 959 H 4.1106 8.2500 117.7528 58.1278 29.6239 175.7514 960 F 4.6189 7.5412 117.4814 56.9432 39.1772 175.6664 961 G 3.8822 8.0039 107.3044 46.6205 0.0000 174.3312 962 E 4.5162 7.8060 117.7472 54.5286 31.3097 175.8239 963 E 4.2086 8.4445 120.3184 55.2588 30.1478 176.3898 964 A 4.1009 8.3425 127.7635 53.4355 19.1812 175.2709 965 G 4.2328 9.1084 110.3870 45.8169 0.0000 174.5551 966 K 4.3707 7.4881 115.3449 56.2129 32.4097 176.4736 967 I 4.6533 7.3276 118.5696 58.6135 41.1156 174.6395 968 Q 4.7540 8.5010 125.5506 53.7303 32.0263 174.9908 969 P 4.3301 0.0000 0.0000 66.0300 31.2410 178.4100 970 D 5.2758 8.2595 118.6410 55.9231 38.8957 178.3822 971 E 4.0938 8.1412 119.6545 58.7265 30.1682 177.8261 972 F 4.0276 8.5566 120.9322 61.6193 39.4649 177.1058 973 F 4.9471 8.6111 116.8529 59.8735 38.7325 177.9702 974 G 3.6574 7.8967 104.7048 47.4185 0.0000 175.8770 975 I 3.5355 7.6019 122.0829 64.4987 37.0930 178.4963 976 F 4.3167 7.3977 117.2225 60.6033 38.3237 177.3716 977 D 4.4168 8.6967 118.1056 57.4450 41.0672 178.3176 978 Q 4.1011 8.1895 118.6993 58.7969 28.6859 178.4924 979 F 4.5101 8.1256 122.8058 60.8708 39.3978 177.1924 980 L 3.8239 8.2146 118.6558 57.8555 41.4208 179.4072 981 Q 3.9304 8.3405 117.8963 58.9192 28.5229 179.0272 982 A 3.9417 7.9329 121.6667 55.0428 18.4750 179.8066 983 V 3.2704 7.8470 117.1005 65.9328 31.3830 178.1527 984 S 3.9995 8.1207 112.9945 61.4449 62.2877 175.9869 985 E 3.9221 8.1735 120.9435 59.3343 29.1474 179.2535 986 A 3.8569 8.1753 120.9744 54.9623 18.4183 179.4606 987 K 3.7724 8.0912 117.2425 59.9585 32.1161 179.0002 988 Q 3.8921 7.8484 118.9389 59.2959 29.1919 177.7457 989 E 3.9562 8.2870 119.4188 59.7355 29.5021 179.2748 990 N 4.3446 8.6109 116.5548 56.5299 38.5022 177.0581 991 E 3.9221 8.1224 120.4767 59.3743 29.4459 178.5917 992 N 4.4035 8.2650 115.9713 56.0724 38.8401 177.2102 993 M 4.1900 7.8616 120.0359 58.4525 31.6695 178.5185 994 R 3.9212 8.2256 119.0602 59.4709 30.0581 178.1585 995 K 4.1964 7.8677 116.8577 57.9949 32.1127 179.2814 996 K 4.0688 8.0107 119.7663 58.9012 31.8500 178.3627 997 K 4.4759 7.4446 115.1140 56.9074 32.4354 177.5941 998 E 4.4815 7.8235 119.9323 57.7497 29.5312 177.4125 999 E 3.9549 7.9222 119.4300 58.7802 29.7019 177.8154 1000 E 3.9623 8.3829 116.1632 56.4324 30.1889 177.1251 1001 E 4.1329 7.8518 119.9484 58.4909 29.9047 178.1436 1002 R 3.9930 7.9583 118.0743 58.9428 30.0950 179.1087 1003 R 3.9123 7.4571 117.0438 59.0760 29.8378 178.6332 1004 A 4.2424 7.7540 121.8796 54.8202 18.1672 180.5012 1005 R 3.8876 7.9990 119.7126 61.4694 29.6784 183.4745 1006 M 4.2212 8.3372 119.6424 58.5183 32.2486 177.9952 1007 E 4.2217 8.1851 118.5458 58.5292 29.8598 178.5555 1008 A 4.0655 7.7374 123.4774 55.8239 18.3547 180.0236 1009 Q 4.1415 7.8295 118.5019 59.6398 28.4034 179.9445 1010 L 4.2669 8.5711 121.3076 57.5584 41.8485 178.9420 1011 K 3.9723 7.8387 120.1107 59.5251 32.2449 178.6432 1012 E 4.0474 7.8546 117.5678 58.7539 28.8973 179.0903 1013 Q 3.9441 7.8439 120.2547 59.2719 29.0166 178.2916 1014 R 4.0203 7.6395 118.2104 58.7690 30.1981 178.5592 1015 E 4.0751 7.8572 119.3908 59.0917 29.4407 178.8917 1016 R 4.0531 8.0770 118.1217 58.4671 30.3051 177.7247 1017 E 4.3697 7.9237 116.0659 56.9235 29.6920 177.7238 1018 R 4.2846 7.3999 118.1205 58.2258 30.9837 178.1578 1019 K 4.0147 7.9333 117.6645 59.0972 31.8987 179.1070 1020 M 4.1118 7.9421 121.5963 59.2488 31.9903 179.1024 1021 R 4.0818 7.5367 120.7340 61.3922 29.5824 181.3858 1022 K 4.3341 8.1726 122.1558 60.0429 31.9110 183.1127 1023 A 4.2430 7.6655 123.1282 55.2670 18.5010 178.2174 *1024 K 4.0679 8.1315 122.1494 55.0198 33.7151 178.2354 *1025 E 4.2236 8.4392 117.7690 56.2257 30.3413 175.4053 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 4.17 0.00 1.78 1.88 0.00 1.78 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 1.36 1.45 7.81 602 S 8.10 3.93 0.00 4.15 4.11 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 0.00 603 I 7.24 4.14 1.36 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 1.49 0.57 1.15 0.00 0.00 604 P 0.00 4.53 0.00 2.05 1.95 0.00 2.20 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.77 0.00 605 Q 7.90 4.61 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.07 0.00 0.00 0.00 0.00 0.00 2.15 2.23 0.00 606 P 0.00 4.65 0.00 2.19 2.11 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 607 T 8.52 4.03 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 7.91 5.07 0.00 2.72 2.79 0.00 0.00 6.83 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 8.52 4.24 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 0.00 610 L 8.27 5.21 0.00 1.51 1.60 1.02 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 611 K 8.65 4.21 0.00 1.90 1.82 0.00 1.82 0.00 0.00 1.92 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.61 1.61 7.81 612 S 8.48 4.53 0.00 3.84 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 613 F 8.22 4.78 0.00 2.55 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 8.65 4.53 0.00 2.81 2.76 0.00 0.00 7.22 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 6.87 4.22 0.00 2.98 1.74 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 0.00 616 S 8.08 4.52 0.00 3.75 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 617 K 7.99 3.47 0.00 1.40 1.32 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.75 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.45 0.21 7.81 618 L 7.58 4.13 0.00 1.21 1.37 0.89 0.98 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 0.00 619 P 0.00 4.27 0.00 2.24 1.91 0.00 3.50 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 2.05 2.04 0.00 620 E 8.63 3.98 0.00 2.03 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 2.34 2.26 0.00 621 N 8.09 4.61 0.00 2.79 2.91 0.00 0.00 5.91 7.13 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 0.00 622 K 7.69 4.47 0.00 1.91 1.84 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.35 7.81 623 L 7.51 4.54 0.00 1.76 1.68 0.89 0.57 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 8.24 4.15 0.00 2.07 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 2.19 2.38 0.00 625 G 7.65 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 0.00 0.00 0.00 626 T 7.44 4.56 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 627 V 8.09 3.24 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.04 0.00 0.00 628 W 7.67 4.25 0.00 3.48 3.23 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 0.00 629 T 7.32 3.97 4.45 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 1.23 0.00 0.00 630 E 8.19 4.43 0.00 1.95 1.94 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 2.26 2.30 0.00 631 I 7.02 4.46 2.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.54 1.10 0.00 0.00 632 D 8.17 4.47 0.00 2.74 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 8.76 4.15 0.00 2.71 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 0.00 634 T 8.09 4.34 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 1.42 0.00 0.00 635 K 7.63 4.18 0.00 1.98 2.11 0.00 1.32 0.00 0.00 1.58 0.00 0.00 3.00 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.56 1.56 7.81 636 V 7.39 3.59 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 0.75 0.00 0.00 0.81 0.00 0.00 637 F 7.59 4.54 0.00 3.13 3.04 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 0.00 638 K 7.73 4.22 0.00 1.97 1.91 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.58 7.81 639 I 7.46 3.98 2.00 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 1.64 0.49 0.91 0.00 0.00 640 L 7.74 4.10 0.00 1.72 1.66 0.90 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 641 D 8.43 4.63 0.00 2.73 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 642 L 8.21 4.05 0.00 1.77 1.75 1.04 0.99 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 8.33 3.91 0.00 2.05 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 2.40 2.40 0.00 644 D 8.19 4.35 0.00 2.91 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 7.71 4.09 0.00 1.95 1.90 0.96 1.18 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 0.00 646 E 8.26 4.05 0.00 2.17 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 2.39 2.60 0.00 647 R 7.69 4.05 0.00 1.96 1.97 0.00 3.16 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 648 T 7.71 3.94 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 1.18 0.00 0.00 649 F 8.22 4.92 0.00 3.28 2.97 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 0.00 650 S 8.12 4.54 0.00 4.04 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 0.00 651 A 8.85 4.13 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 0.00 652 Y 7.50 4.41 0.00 2.89 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 0.00 653 Q 9.37 3.43 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.41 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 *683 K 8.47 4.11 0.00 2.06 1.93 0.00 1.38 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.48 7.81 684 E 8.46 4.64 0.00 2.15 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 0.00 2.30 2.23 0.00 685 L 8.76 3.56 0.00 1.41 1.27 0.65 0.39 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 8.99 4.61 0.00 3.72 3.63 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 0.00 687 V 8.88 4.17 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 0.95 0.00 0.00 0.84 0.00 0.00 688 I 8.06 3.97 1.88 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 1.66 0.96 0.94 0.00 0.00 689 D 8.63 4.71 0.00 3.00 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 690 G 8.57 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 691 R 8.03 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0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 799 S 8.42 4.12 0.00 4.02 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 0.00 800 G 8.06 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 0.00 801 S 8.23 4.67 0.00 4.24 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 0.00 802 E 8.20 4.02 0.00 2.19 2.15 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 2.35 2.36 0.00 803 E 8.60 3.99 0.00 2.22 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 0.00 2.39 2.48 0.00 804 V 7.79 3.56 1.51 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 1.14 0.00 0.00 -0.21 0.00 0.00 805 F 8.17 4.12 0.00 3.32 3.31 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 0.00 806 R 7.79 4.45 0.00 2.04 2.17 0.00 3.18 0.00 0.00 3.20 7.25 0.00 0.00 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0.00 0.00 0.00 0.00 947 A 7.88 3.98 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 8.30 3.92 0.00 2.20 2.27 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 2.41 2.30 0.00 949 A 8.01 4.00 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 0.00 950 K 8.13 4.11 0.00 2.01 1.93 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.70 7.81 951 D 7.75 4.31 0.00 2.87 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 7.92 3.92 0.00 1.90 1.75 0.95 0.87 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 0.00 953 F 8.33 4.39 0.00 3.24 3.25 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 0.00 954 T 7.88 3.70 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 1.15 0.00 0.00 955 K 7.94 4.02 0.00 1.82 1.63 0.00 1.68 0.00 0.00 1.40 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.37 7.81 956 A 8.22 4.43 1.66 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 0.00 957 V 7.65 2.77 1.49 0.00 0.00 0.00 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 -0.80 0.00 0.00 958 K 7.73 3.98 0.00 1.85 1.84 0.00 1.77 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.46 7.81 959 H 8.25 4.11 0.00 3.43 3.39 0.00 5.90 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 0.00 960 F 7.54 4.62 0.00 3.45 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 0.00 961 G 8.00 3.88 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 0.00 0.00 0.00 962 E 7.81 4.52 0.00 2.16 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 2.50 2.74 0.00 963 E 8.44 4.21 0.00 1.99 1.87 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 2.38 2.25 0.00 964 A 8.34 4.10 1.17 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 0.00 0.00 0.00 0.00 0.00 965 G 9.11 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 0.00 0.00 0.00 0.00 966 K 7.49 4.37 0.00 1.92 1.87 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.37 7.81 967 I 7.33 4.65 1.93 0.00 0.00 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 1.61 1.10 0.88 0.00 0.00 968 Q 8.50 4.75 0.00 2.29 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.63 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 969 P 0.00 4.33 0.00 2.14 2.20 0.00 3.48 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.69 0.00 970 D 8.26 5.28 0.00 3.00 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 0.00 971 E 8.14 4.09 0.00 2.13 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 2.39 2.39 0.00 972 F 8.56 4.03 0.00 3.14 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 8.61 4.95 0.00 3.51 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 974 G 7.90 3.66 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 0.00 975 I 7.60 3.54 1.42 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.10 0.35 0.00 0.00 976 F 7.40 4.32 0.00 3.43 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 0.00 977 D 8.70 4.42 0.00 2.96 2.78 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 0.00 0.00 0.00 978 Q 8.19 4.10 0.00 2.44 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 979 F 8.13 4.51 0.00 3.08 3.31 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 0.00 980 L 8.21 3.82 0.00 1.91 1.68 0.97 0.95 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 0.00 981 Q 8.34 3.93 0.00 2.33 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 982 A 7.93 3.94 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 983 V 7.85 3.27 1.66 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 0.89 0.00 0.00 -0.10 0.00 0.00 984 S 8.12 4.00 0.00 3.88 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 0.00 985 E 8.17 3.92 0.00 2.19 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 2.32 2.38 0.00 986 A 8.18 3.86 1.17 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 0.00 0.00 0.00 0.00 0.00 987 K 8.09 3.77 0.00 2.04 1.88 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.43 7.81 988 Q 7.85 3.89 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.72 0.00 0.00 0.00 0.00 0.00 2.36 2.60 0.00 989 E 8.29 3.96 0.00 2.33 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 2.37 2.56 0.00 990 N 8.61 4.34 0.00 3.02 2.90 0.00 0.00 6.67 7.20 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 0.00 991 E 8.12 3.92 0.00 2.26 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 0.00 2.31 2.35 0.00 992 N 8.27 4.40 0.00 2.86 2.87 0.00 0.00 7.07 7.87 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 0.00 993 M 7.86 4.19 0.00 2.07 2.28 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.74 0.00 994 R 8.23 3.92 0.00 1.98 2.07 0.00 3.09 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 995 K 7.87 4.20 0.00 1.82 1.83 0.00 1.85 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.47 7.81 996 K 8.01 4.07 0.00 1.91 1.85 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.69 1.62 7.81 997 K 7.44 4.48 0.00 1.88 1.84 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.66 7.81 998 E 7.82 4.48 0.00 1.98 1.95 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 2.32 2.47 0.00 999 E 7.92 3.95 0.00 2.02 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 2.31 2.36 0.00 1000 E 8.38 3.96 0.00 2.12 1.94 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 2.25 2.37 0.00 1001 E 7.85 4.13 0.00 2.21 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 2.35 2.34 0.00 1002 R 7.96 3.99 0.00 2.10 1.96 0.00 3.30 0.00 0.00 3.17 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 1003 R 7.46 3.91 0.00 2.04 1.98 0.00 3.28 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 1.84 1.79 0.00 1004 A 7.75 4.24 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 1005 R 8.00 3.89 0.00 1.84 1.94 0.00 3.27 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.50 0.00 1006 M 8.34 4.22 0.00 2.12 2.08 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 2.54 0.00 1007 E 8.19 4.22 0.00 2.20 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 2.30 2.32 0.00 1008 A 7.74 4.07 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.83 4.14 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 1010 L 8.57 4.27 0.00 1.84 1.68 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 1011 K 7.84 3.97 0.00 1.95 1.80 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.48 7.81 1012 E 7.85 4.05 0.00 2.17 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 2.44 0.00 1013 Q 7.84 3.94 0.00 2.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.81 0.00 0.00 0.00 0.00 0.00 2.52 2.40 0.00 1014 R 7.64 4.02 0.00 2.03 1.96 0.00 3.18 0.00 0.00 3.09 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 1015 E 7.86 4.08 0.00 2.17 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 0.00 2.30 2.34 0.00 1016 R 8.08 4.05 0.00 2.08 1.96 0.00 3.16 0.00 0.00 3.17 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 1017 E 7.92 4.37 0.00 2.02 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 2.29 2.44 0.00 1018 R 7.40 4.28 0.00 2.09 1.90 0.00 3.09 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 1019 K 7.93 4.01 0.00 1.88 1.84 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.55 7.81 1020 M 7.94 4.11 0.00 2.05 2.18 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 2.55 0.00 1021 R 7.54 4.08 0.00 2.01 1.83 0.00 3.32 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 1022 K 8.17 4.33 0.00 1.83 1.75 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.39 1.32 7.81 1023 A 7.67 4.24 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 *1024 K 8.13 4.07 0.00 1.57 1.71 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.29 1.44 7.81 *1025 E 8.44 4.22 0.00 1.73 1.79 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 2.13 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.