NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 665 N 4.7490 8.5245 117.7864 52.0628 39.1737 178.1325 *666 F 4.1876 9.0493 117.4572 59.7524 38.4059 172.2125 667 E 4.5477 8.0949 120.9632 56.9099 29.7023 176.4182 668 Q 4.4538 7.7611 116.4420 55.0740 31.3293 178.1913 669 S 4.8281 7.9214 112.3754 58.6833 62.7295 179.0688 670 L 4.8284 7.6152 123.2959 54.0561 43.6425 177.6100 671 K 4.1567 9.1350 126.5138 57.0533 32.4744 178.9157 672 N 4.7566 8.4243 116.8286 54.1836 38.5672 178.3519 673 L 4.4922 7.7273 118.1186 54.3747 42.8783 177.1459 674 V 4.1473 8.7242 123.1326 61.2565 33.7410 174.1886 675 V 4.5590 8.1019 128.8687 61.2798 32.4238 175.8340 676 S 4.5390 8.6041 125.9412 58.4560 64.1121 174.7452 677 E 4.1715 8.6626 114.4943 56.3890 30.1607 174.8712 678 K 4.1549 7.8752 120.2382 57.2463 32.2848 175.6918 679 I 4.3866 8.2548 127.7831 60.5752 38.1688 175.7589 680 L 4.2539 8.7162 125.3433 56.5260 42.5362 176.8321 681 G 3.9234 6.8445 104.2936 45.2257 0.0000 171.2374 682 Y 4.9811 8.4691 116.8627 55.9183 40.5998 175.8626 683 G 4.3283 8.8620 114.5916 44.3222 0.0000 173.2933 684 S 4.1859 8.4083 114.7105 59.2121 63.3017 169.7431 685 S 3.9480 9.3535 117.6391 59.6297 59.5924 173.0921 686 G 4.0277 8.2409 103.7924 46.2826 0.0000 173.0562 687 T 4.3226 7.6696 117.8825 63.4042 69.6404 173.6873 688 V 4.3286 8.4101 125.5818 60.8180 35.0857 174.1024 689 V 4.5723 8.1630 127.6851 61.3236 33.2803 174.4955 690 F 5.3129 9.0690 126.9541 55.6319 42.1784 174.8635 691 Q 4.3949 8.9643 123.3275 56.4995 30.3272 175.4405 692 G 4.5069 9.1985 112.6223 45.8120 0.0000 170.9494 693 S 5.1912 8.7299 113.1614 57.0081 66.9353 173.5656 694 F 5.0381 9.2971 125.2153 57.0395 39.6105 174.8131 695 Q 3.3608 9.3675 129.6467 56.5701 25.9708 174.2223 696 G 4.0212 8.3091 106.3378 45.5843 0.0000 175.0054 697 R 3.8496 7.3759 119.6164 55.4505 30.2419 173.9738 698 P 4.7961 0.0000 0.0000 62.6051 32.0428 176.1275 699 V 4.6891 8.6187 116.6718 59.5236 36.8331 174.0079 700 A 5.0723 9.0729 123.9372 50.5455 21.1755 176.0773 701 V 4.6061 9.1386 123.7120 61.3736 33.6392 174.6263 702 K 4.6374 9.4512 131.0699 55.1528 33.5611 175.1139 703 R 4.5878 9.1068 130.2762 55.5581 31.1567 175.1552 704 M 5.1053 8.8747 126.3915 53.2548 35.9009 175.4496 705 L 4.5075 8.7530 123.2917 55.0027 42.5057 179.1380 706 I 3.9985 8.2569 124.0817 63.5332 35.4638 175.3455 707 D 4.5236 7.9249 115.3320 55.3037 39.5307 181.3360 708 F 5.1614 8.4587 119.7610 58.8467 39.6210 178.6110 709 C 4.0192 8.0976 122.9557 61.8381 28.3179 179.4536 710 D 4.4704 8.4260 121.5862 56.8130 39.5433 180.6944 711 I 3.9942 7.3480 115.3318 61.1284 35.6264 177.9729 712 A 4.6180 7.7439 122.5675 54.4248 21.1218 179.5237 713 L 4.0503 7.9311 121.8447 60.4895 40.9212 183.9175 714 M 4.2839 7.9323 120.1254 59.5470 31.5083 180.7190 715 E 4.2929 8.0173 119.8695 59.3134 29.7616 179.0180 716 I 3.1979 8.0081 122.3834 64.8221 36.7065 179.1631 717 K 3.9611 7.8060 124.3000 59.6573 31.5569 180.5316 718 L 4.1272 7.7896 118.3338 56.8688 41.7083 179.3656 719 L 3.6368 7.5851 118.9891 57.9430 41.3128 179.1755 720 T 3.8865 7.7190 114.7321 67.0806 68.5526 175.7515 721 E 4.1132 7.6175 118.5856 58.2484 29.8059 177.7981 722 S 4.7279 7.4441 113.3093 59.5024 64.1556 175.5600 723 D 4.4387 8.1904 120.8146 55.4149 39.0907 177.0558 724 D 4.3790 7.9993 119.3247 56.9475 41.7478 175.8934 725 H 4.1450 7.8166 119.7830 55.0015 30.3237 174.1956 726 P 4.1888 0.0000 0.0000 65.4023 31.2558 176.6849 727 N 5.0638 8.3500 113.4139 51.9383 39.0277 173.4283 728 V 4.6807 7.2387 119.4000 60.5469 33.2720 175.2702 729 I 3.7054 8.1862 128.2462 61.9053 38.7594 174.9027 730 R 4.1887 8.5635 128.3973 55.8110 31.6242 173.9562 731 Y 4.5821 8.2916 127.2356 56.6586 39.5320 174.1814 732 Y 4.1670 8.4971 126.2234 59.0346 38.1217 175.6261 733 C 4.2619 6.8099 110.7959 57.3848 33.4763 171.8267 734 S 5.3260 8.5112 114.5636 56.7287 65.7209 173.4292 735 E 4.8383 9.1558 124.0880 54.6704 32.9826 174.4338 736 T 5.1321 8.6854 121.9963 62.1470 70.0822 173.7634 737 T 4.6411 8.5754 116.4087 59.5013 71.2701 175.0313 738 D 4.4845 8.7647 122.5328 56.1745 39.8565 177.7663 739 R 4.2494 7.5986 117.9735 57.5034 31.9274 181.0255 740 F 5.4662 8.3402 116.3943 55.3593 43.9642 173.9410 741 L 5.1161 8.9168 121.1558 53.7003 45.1209 174.4345 742 Y 5.1879 9.3561 124.2540 56.3290 40.6874 174.6565 743 I 5.0202 8.7759 124.5576 59.4904 40.4812 174.3560 744 A 4.9481 8.9441 129.9946 51.0579 20.2420 176.0828 745 L 5.4631 9.2717 121.9809 52.2202 46.7015 175.5807 746 E 4.5548 8.7150 121.5883 56.7135 30.0047 176.5966 747 L 4.1047 8.8323 129.4889 55.4119 42.6033 175.6743 748 C 5.0081 8.3952 122.9369 57.9327 31.1884 173.8601 749 N 4.5649 8.8721 119.5777 55.9382 38.5409 176.0211 750 L 4.3843 7.2187 114.6776 54.6953 42.7820 173.7973 751 N 5.0401 8.7456 118.7139 51.9697 38.5635 176.0036 752 L 4.0576 8.7349 120.5760 58.1018 41.9048 178.9362 753 Q 4.2893 8.1528 121.2437 58.7077 28.8551 177.7819 754 D 4.3807 8.2416 119.6217 57.1783 40.6143 178.6014 755 L 3.9724 7.7627 119.3471 58.1480 42.3465 178.7513 756 V 3.7438 7.7307 116.8546 65.3589 31.6190 176.7402 757 E 4.7174 8.2832 116.3598 59.9694 30.9271 177.8086 758 S 4.3963 6.5735 110.8128 59.8201 65.2728 177.1100 *772 Y 4.4142 8.2388 126.0618 58.5090 37.6116 171.8333 773 N 4.5511 7.8916 121.4814 50.7996 40.2944 172.5311 774 P 3.8809 0.0000 0.0000 65.9452 31.3930 178.4073 775 I 3.6156 7.5349 119.0962 63.9830 37.1245 177.9372 776 S 4.0850 7.8102 112.6597 61.3934 62.1333 176.3661 777 L 3.9186 7.3881 120.4448 57.7122 41.3508 179.1743 778 L 3.5061 7.5639 118.8467 57.9338 41.5167 179.6604 779 R 3.1592 8.0755 118.2451 59.2856 29.8809 178.5961 780 Q 3.9207 7.9051 117.5306 58.8742 28.7285 178.5515 781 I 3.6923 7.7971 120.5683 64.5355 37.2302 178.3241 782 A 4.0690 8.3047 121.5452 55.2052 18.0142 179.6384 783 S 4.1015 8.2010 111.8977 61.3921 62.5503 176.7177 784 G 3.4405 8.1369 108.4752 47.7400 0.0000 175.9407 785 V 3.5160 7.8084 120.7475 65.5782 31.5236 177.9477 786 A 3.9464 8.0881 120.5586 55.2244 17.9980 179.2025 787 H 4.0874 7.8202 116.8955 59.4558 29.9391 177.4425 788 L 4.0214 7.8163 120.6142 58.3142 41.4622 179.3659 789 H 4.3222 8.4786 116.3908 58.7350 28.4228 177.9767 790 S 4.2957 8.0308 115.1191 60.5221 62.8495 175.4280 791 L 4.4555 7.2038 121.2127 53.4098 41.8052 176.2447 792 K 3.8638 7.9794 117.4654 57.5607 30.1644 174.6995 793 I 4.7623 8.0819 119.4603 59.5611 39.1067 175.3429 794 I 4.5101 8.3691 126.7969 59.8069 38.9048 176.4261 795 H 3.7850 9.5765 125.8360 57.6243 29.8500 177.8147 796 R 4.1746 8.7862 115.0737 56.8877 29.2442 175.8551 797 D 4.7783 7.6172 117.1091 53.0798 41.5235 175.2465 798 L 4.0867 8.1462 118.6529 54.2150 42.4534 176.8784 799 K 3.6112 7.8781 120.3858 54.9056 35.0326 174.4461 800 P 3.9143 0.0000 0.0000 65.6670 31.2473 178.7817 801 Q 4.1103 7.6212 115.3835 57.8627 29.0710 176.0929 802 N 4.7986 8.1292 114.3112 52.9804 40.3529 174.2523 803 I 4.7511 7.2958 120.3358 59.7309 39.1209 174.9827 804 L 4.9851 9.3949 128.3314 53.0866 44.8195 175.6634 805 V 4.8726 8.6926 120.7072 61.2341 34.7049 174.2396 806 S 5.3524 9.0928 122.1266 56.8849 65.3184 174.2599 807 T 4.5112 9.3261 115.5081 60.9811 69.7854 174.6910 808 S 4.0733 7.8846 118.0107 58.8735 62.9913 175.4143 809 S 4.2005 8.7467 121.2690 61.2761 63.0218 176.3754 810 R 3.7766 7.8270 119.1044 58.6159 29.9904 177.1422 811 F 4.8864 7.7398 115.0868 59.3566 39.9488 177.2570 812 T 4.2462 7.9221 107.6211 63.0450 69.4345 175.7197 813 A 4.0744 7.9973 125.4230 54.8928 18.5602 177.6232 814 D 4.5989 7.9630 115.1763 54.3304 41.8580 175.8732 815 Q 4.8900 8.4450 126.2246 55.7608 29.9971 177.3211 816 Q 4.1343 8.0518 120.3383 58.9145 29.1270 177.2388 817 T 4.3438 8.1871 108.5074 59.7356 69.3278 178.1753 818 G 4.2295 6.9403 105.3965 44.2636 0.0000 173.8688 819 A 4.3035 8.3103 124.3430 51.5363 19.2430 177.2754 820 E 4.7453 8.3897 121.3021 54.9239 33.5027 175.4345 821 N 4.6518 8.8862 120.0938 54.6272 39.3682 175.0497 822 L 5.1325 7.7378 115.9329 52.6681 45.7706 175.9323 823 R 4.6516 8.7795 121.4911 54.6203 32.7445 174.4393 824 I 4.5290 9.4679 128.4135 60.7005 38.6133 174.8362 825 L 4.9166 9.0507 127.2303 52.9316 44.9939 175.4154 826 I 4.7657 8.4051 124.4749 60.2270 38.8251 174.7574 827 S 5.0972 8.2813 123.6013 58.2846 65.8572 172.6580 828 D 4.3763 8.9566 112.3668 55.8768 38.1100 173.8702 829 F 4.6038 8.0746 119.1311 56.7910 39.9768 178.7312 830 G 3.5541 7.7928 112.5881 48.2955 0.0000 175.4604 831 L 4.3307 7.5003 116.5596 54.3916 42.2297 176.4468 832 C 4.2612 7.1201 116.3033 60.0318 28.8241 173.2637 833 K 4.4183 8.6696 123.2773 54.3928 35.1666 174.6341 834 K 4.7457 8.5181 128.5624 55.2659 33.0509 176.3127 835 L 4.3175 8.8318 130.3622 55.0873 42.4725 177.2713 836 D 4.5975 8.5653 120.1246 52.7993 40.6775 177.4886 837 S 4.3659 8.8805 112.0424 62.4025 62.1865 175.8546 838 G 4.3688 7.8975 109.0928 45.9601 0.0000 172.4342 839 Q 4.3599 7.7017 122.3284 53.6218 29.6239 177.2076 *842 F 4.6156 8.6606 114.4403 58.9884 39.3605 177.0467 843 R 4.0890 8.4910 124.1278 57.0151 27.8121 176.8878 *852 T 4.5229 7.4635 114.6992 60.8085 71.1562 177.2904 853 S 4.8221 7.9425 115.0916 58.1379 63.1298 175.5757 854 G 3.5801 8.0640 109.1074 46.5116 0.0000 174.8551 855 W 4.8077 8.1188 118.2277 56.3444 29.9656 175.0897 856 R 4.6251 7.7984 116.9856 54.0881 31.4689 176.2823 857 A 2.5800 8.1889 124.3162 50.8437 19.2520 176.7423 858 P 3.9733 0.0000 0.0000 65.7818 31.1763 178.0545 859 E 4.0272 7.8033 113.3906 57.1605 29.4212 176.8369 860 L 4.4665 7.6354 119.0209 55.1639 43.3728 177.3570 861 L 4.2719 7.7370 119.5841 56.7520 42.6742 177.8193 862 E 3.8758 8.2469 116.1057 56.8253 29.9722 179.3679 863 E 4.2258 8.5838 119.7413 54.4146 30.5371 174.8817 864 S 4.2003 8.5514 118.0774 57.9463 63.5100 173.1831 865 N 4.8412 8.3745 121.7232 52.2343 40.1443 174.6697 866 N 4.5123 8.6426 121.4806 55.3750 39.0641 175.9288 867 L 4.5144 8.0237 115.8248 54.3195 42.0802 175.8665 868 Q 4.4221 7.7038 121.0037 54.8254 31.5951 175.2978 *893 T 4.2247 8.3473 115.4914 60.6738 70.0529 172.0529 894 K 4.0120 8.5456 126.8539 53.9254 32.1905 175.5033 895 R 4.0635 8.5846 120.4262 55.3119 29.8572 176.3435 896 R 3.4763 8.0031 120.7623 55.8381 30.4505 175.7848 897 L 4.2243 8.0722 123.0612 53.2479 42.0550 175.2181 898 T 4.7281 7.6785 114.2350 58.9176 71.9112 174.6896 899 R 3.9072 8.6458 119.2076 59.7063 29.7805 178.7105 900 S 4.3024 7.8229 113.1147 60.6406 62.6221 176.3363 901 I 3.6989 7.7927 123.2067 64.3293 37.7038 177.4273 902 D 4.4257 8.2729 119.8151 57.3979 40.6082 178.7725 903 I 3.6683 7.7968 119.9150 64.2669 37.2624 177.8315 904 F 4.4055 8.4985 122.9462 60.9002 39.2943 177.2213 905 S 4.3388 8.2862 113.6020 61.8278 62.5873 176.1485 906 M 4.0420 8.5623 122.2604 58.3412 32.0551 178.3698 907 G 3.3483 7.8750 105.9347 47.9378 0.0000 175.4869 908 C 4.2119 7.8534 118.5525 62.5615 28.1686 176.3320 909 V 3.8607 8.0969 119.9754 65.9464 31.1555 177.8706 910 F 4.3205 8.9275 118.1414 61.1446 38.8656 177.1506 911 Y 4.1272 8.2570 118.6454 60.7528 38.0504 176.9678 912 Y 5.0045 8.5623 122.2497 60.2811 38.9711 178.5242 913 I 3.6869 8.1023 120.4439 64.4830 37.4244 178.4424 914 L 4.0678 7.8913 119.1826 56.3501 41.1555 178.4586 915 S 4.4762 7.4136 116.0866 56.2884 64.1357 174.4223 916 K 3.5582 8.7015 122.3716 56.1571 29.0497 180.2168 917 G 3.7011 7.3911 106.7545 45.7187 0.0000 174.6590 918 K 4.4021 7.8440 119.9751 56.1159 33.2684 175.2449 919 H 5.3080 8.5439 120.6072 53.7228 31.9965 173.9453 920 P 4.0473 0.0000 0.0000 64.4467 31.4391 177.7629 921 F 4.5569 8.6498 115.3532 56.9368 39.0548 176.1918 922 G 4.1831 7.9827 110.8844 45.0220 0.0000 174.0007 923 D 4.5209 8.4389 118.7733 53.2098 40.3151 174.2810 924 K 3.7581 8.5024 121.1790 58.5349 31.7645 179.2646 925 Y 4.5878 7.5948 114.9343 61.2071 38.0989 176.6957 926 S 4.6562 7.9299 112.4763 58.4080 63.9207 175.9760 927 R 4.3114 7.8431 123.5354 59.3806 30.0229 177.7947 928 E 3.8325 8.0342 118.5872 59.1972 29.6966 178.3768 929 S 4.0759 8.0564 112.5920 61.7351 62.4401 175.7280 930 N 4.4777 8.0443 118.5585 56.3875 38.0869 177.5969 931 I 3.3839 7.6243 120.7189 64.4389 36.9916 178.5264 932 I 3.7193 7.3220 118.6689 64.2257 36.9689 178.1551 933 R 4.2614 8.0671 117.4548 56.2140 30.2218 177.0188 934 G 3.9332 7.8528 106.3485 46.3944 0.0000 173.1189 935 I 4.4169 8.2910 121.7224 59.2623 38.1287 175.3791 936 F 4.8231 7.9117 121.2158 54.8550 41.3579 174.1105 937 S 4.5138 9.0371 113.9299 56.1498 65.7472 174.3550 938 L 4.1523 8.3414 127.3786 54.5222 42.3961 177.5250 939 D 4.5309 7.7585 121.1259 56.3034 41.5995 177.2269 940 E 4.7023 8.3947 119.4378 55.4549 29.0202 177.2485 941 M 4.5236 7.4939 118.6975 53.8119 31.4857 176.9402 942 K 4.0369 8.1338 122.8432 59.6353 32.6551 178.9098 943 C 4.4464 7.8761 112.3730 60.1514 27.8244 173.2015 944 L 4.6979 7.3402 120.4051 53.2603 43.8253 175.9112 945 H 4.5769 8.6224 119.2667 56.8807 30.7336 174.3860 946 D 4.4213 7.9076 119.3577 53.9520 41.1756 176.6637 947 R 3.9880 8.6355 127.5527 59.2176 30.0219 179.1174 948 S 4.5839 7.8729 114.7104 60.8909 62.9111 176.5928 949 L 3.9620 7.8629 122.1547 57.5149 41.2368 179.4808 950 I 3.6648 7.7177 119.1800 64.2699 36.9857 178.1046 951 A 4.0463 7.8155 121.2448 55.2896 18.2412 179.6165 952 E 3.8924 8.3919 116.9296 59.4351 29.5207 179.4476 953 A 4.0432 8.3265 121.2232 55.1807 18.3838 179.8633 954 T 3.8447 8.3424 114.9168 66.7408 68.4338 176.2952 955 D 4.3285 7.9131 119.8150 57.2137 41.3356 178.1303 956 L 3.7687 7.6967 120.4823 58.1860 42.0387 179.0088 957 I 3.6215 7.8165 119.9472 64.3986 36.9027 178.6857 958 S 3.7094 7.7234 113.3645 61.0824 62.7866 176.2323 959 Q 4.1621 7.6213 121.7091 59.0518 28.4115 178.2112 960 M 4.0281 7.8750 119.8142 57.9489 32.1273 177.6900 961 I 4.1807 7.5248 110.3725 60.3568 37.8694 175.2668 962 D 4.6087 7.9830 119.9749 55.1613 41.5256 175.9785 963 H 4.2514 9.0732 124.9551 58.4586 30.3606 174.4733 964 D 4.6633 8.8880 120.4126 51.8852 41.0286 174.7567 965 P 4.2472 0.0000 0.0000 65.6428 31.4919 178.6032 966 L 4.1584 7.9584 116.1328 56.6085 41.8435 177.8114 967 K 4.2530 7.9494 116.8379 57.3790 32.4574 177.4502 968 R 4.6479 7.6329 118.9005 54.2549 30.6244 174.8826 969 P 4.5206 0.0000 0.0000 62.6128 32.3420 176.7487 970 T 4.2740 8.2426 109.9132 61.2083 71.0421 175.3520 971 A 3.9878 8.6547 123.7314 55.7342 17.8558 179.9128 972 M 4.0206 8.0012 116.2119 58.7413 32.2561 178.2584 973 K 4.1166 7.7616 118.8594 59.2851 32.7361 178.6722 974 V 3.8941 8.0788 118.8566 66.1305 31.2900 178.0970 975 L 4.0116 7.6840 117.4890 57.1884 41.4546 178.6698 976 R 4.6482 7.4912 115.2023 55.3695 30.9363 176.0202 977 H 4.1899 7.9240 120.5712 54.9443 30.7110 174.4645 978 P 2.0000 0.0000 0.0000 64.4324 30.9608 177.9452 979 L 3.8468 7.5259 119.6471 57.3086 41.6993 177.6808 980 F 4.6965 7.6525 113.7379 57.8412 39.3296 176.2062 981 W 4.4982 7.6501 121.3643 55.7369 29.6872 174.9565 982 P 4.5645 0.0000 0.0000 62.5879 32.8619 177.7740 983 K 3.6940 8.5393 118.5608 59.3895 31.9646 179.6876 984 S 4.0803 8.0117 114.2430 61.3593 62.8102 176.4313 985 K 3.9901 7.9329 122.7444 59.0729 32.0238 178.7357 986 K 4.3485 7.9553 118.3473 59.4503 31.9592 179.1033 987 L 4.0945 7.9535 120.8141 58.2909 42.1012 178.6303 988 E 3.8675 8.6748 119.6839 58.9922 29.4982 178.5420 989 F 3.2407 8.6634 121.2176 61.1269 39.5333 177.1534 990 L 3.8584 7.9978 118.5263 57.6448 41.3818 179.5938 991 L 3.8551 7.8203 118.9564 57.6779 41.5451 179.7145 992 K 3.8764 7.7628 118.4552 59.2262 31.8985 179.6446 993 V 3.3038 7.2821 118.5271 65.9594 31.2035 178.0293 994 S 3.9183 7.5970 111.5594 61.4660 62.5614 175.5962 995 D 4.3972 8.0493 121.6582 57.1706 40.2411 178.6850 996 R 3.9303 7.8433 119.3569 58.9943 29.5827 178.0698 997 L 3.9380 7.7712 117.8948 56.3864 41.5373 178.7716 998 E 3.9950 7.4406 117.2959 59.0148 29.3433 178.8567 999 I 3.8477 7.0142 119.6018 63.1513 37.5926 176.7079 1000 E 3.9646 7.0407 117.1645 56.3007 30.2169 176.4800 1001 N 4.3433 8.8058 122.9285 54.6561 39.5891 176.2181 1002 R 4.0609 8.7530 126.4830 59.1508 29.9425 174.2354 1003 D 4.3436 7.1279 115.7677 54.8186 40.0333 176.4138 1004 P 4.7342 0.0000 0.0000 59.8639 32.0484 173.8546 1005 P 4.3941 0.0000 0.0000 62.8041 31.6437 176.3958 1006 S 4.3569 8.4196 115.7186 57.5212 63.8780 174.8423 1007 A 4.0002 8.6515 122.4105 55.4332 17.9611 179.4039 1008 L 4.1441 7.8439 118.0455 58.4188 42.3333 179.0285 1009 L 4.1250 7.7536 119.0200 58.1147 41.5979 179.4677 1010 M 4.1466 8.1574 118.6028 58.1739 31.6050 178.9102 1011 K 3.9981 7.6619 118.2269 59.3884 32.1689 178.9976 1012 F 4.1855 8.2006 117.5660 60.1023 38.8379 177.2143 1013 D 4.4204 8.4979 117.6826 56.9643 40.7509 178.0458 1014 A 4.1795 7.9139 120.7830 54.4545 18.5205 178.8242 1015 G 3.9017 7.6470 102.2704 45.5678 0.0000 175.8617 1016 S 4.2609 7.9243 118.8779 61.5899 62.7935 176.1772 1017 D 4.4627 8.1824 121.2543 57.4187 40.3964 178.4768 1018 F 4.3635 8.2378 119.8344 60.8357 39.5846 176.6825 1019 V 4.0298 7.5889 116.7481 63.4043 32.8914 175.8031 1020 I 4.6587 7.9948 120.8067 58.6715 37.1190 174.0582 1021 P 4.6119 0.0000 0.0000 64.3063 31.7201 178.1798 1022 S 4.2042 8.0944 111.5664 59.0819 63.3867 175.3891 1023 G 3.9469 8.7653 109.2430 45.4868 0.0000 172.5130 1024 D 4.8603 7.6942 118.8559 51.4289 42.5308 175.4908 1025 W 4.5967 9.0441 125.6658 58.7008 28.4229 178.1273 1026 T 3.8660 7.8124 119.6737 67.5426 67.6047 176.5753 1027 V 3.6412 7.0900 119.5904 66.3352 31.6765 180.0855 1028 K 4.0437 7.6917 116.8099 56.7532 31.9367 176.7248 1029 F 4.6850 7.3027 119.5879 55.5407 41.7309 175.7464 1030 D 4.8091 8.5561 126.5339 55.7313 41.2117 178.3177 1031 K 4.2038 8.5576 122.4641 61.0567 31.2332 178.6860 1032 T 4.3686 7.9255 109.3417 64.0642 68.8837 176.7184 1033 F 4.3347 8.4478 125.3074 62.1388 39.6920 177.0871 1034 M 4.3083 8.0999 122.1638 60.0106 30.9849 180.7727 1035 D 4.5836 7.7747 121.1423 58.4883 39.8929 180.7400 1036 N 4.6037 7.6153 119.2709 55.0330 37.5232 176.7007 1037 L 4.5726 7.3162 126.6562 58.0251 42.3239 184.5016 1038 E 4.3019 8.3690 116.2781 59.7460 29.8194 183.0718 1039 R 4.2323 8.0396 118.1603 59.3560 30.0148 180.9619 *1040 Y 4.2206 7.6451 114.6975 59.9925 36.9798 180.9275 1041 R 4.5492 7.6459 119.6892 54.8147 33.1399 174.8108 1042 K 4.0238 8.3275 123.5083 54.5739 31.9222 176.8516 1043 Y 4.8910 8.3913 122.2926 55.4211 39.4665 175.4667 1044 H 4.5827 9.2235 124.2936 54.9758 28.6236 176.8780 1045 S 3.6725 8.8236 120.6935 59.7997 62.9356 175.6394 1046 S 4.9934 7.9373 112.9637 57.4676 64.3134 175.0487 1047 K 4.3707 7.9002 120.5971 55.8483 33.7219 177.6745 1048 L 3.9808 9.0241 127.6352 58.9924 41.9860 179.9599 1049 M 3.9658 8.0884 119.9725 60.0346 31.2754 180.6022 1050 D 4.7091 8.1346 119.5479 56.8371 41.1631 178.4680 1051 L 2.4400 7.1359 120.2507 57.3489 41.8651 178.8333 1052 L 3.7273 7.7995 120.4675 58.0485 41.9577 178.9553 1053 R 3.8961 8.2497 118.7034 59.1345 29.9791 178.3222 1054 A 4.0131 8.0338 120.8959 54.9559 18.3574 179.2919 1055 L 3.4300 7.6530 118.8337 58.0052 41.9932 179.1255 1056 R 3.9022 7.8509 118.4969 59.7605 30.0793 178.2497 1057 N 4.4655 8.6407 116.5805 56.2961 38.2825 177.6349 1058 K 4.1546 8.1055 119.1972 59.5556 32.2813 178.4280 1059 Y 3.9215 8.1074 118.3105 61.1940 38.8523 177.8099 1060 H 4.3034 8.6403 115.4012 57.7262 28.8454 175.6873 1061 H 5.0314 8.3406 118.6623 55.3006 29.1514 176.5821 1062 F 4.1427 8.2499 124.0131 61.3633 39.6774 176.9323 1063 M 4.1328 8.0942 119.3220 58.2522 31.9232 177.2691 1064 D 4.4753 7.6619 117.4270 56.3803 41.3240 177.1482 1065 L 4.0045 7.0567 118.4856 53.7602 42.3152 175.8802 1066 P 4.3668 0.0000 0.0000 63.1201 33.0813 178.2733 1067 E 3.9884 8.8890 121.3810 61.3682 29.4005 177.6699 1068 D 4.6051 8.0014 118.2907 56.5532 39.5487 178.7552 1069 I 3.7336 7.6428 120.5484 64.1166 37.0829 177.8814 1070 A 3.7992 7.6436 120.3731 54.9654 17.9985 178.9289 1071 E 4.1049 8.2536 117.7311 59.6507 29.5321 179.2020 1072 L 4.1421 7.4461 117.6635 57.7404 41.8662 178.4653 1073 M 4.3365 8.5644 117.1017 54.7204 31.9778 175.5134 1074 G 4.6416 7.7930 108.1749 43.1371 0.0000 170.4414 1075 P 5.0108 0.0000 0.0000 60.5970 33.5139 175.3503 1076 V 4.0761 7.8940 112.7600 61.1380 32.2457 174.1555 1077 P 4.8537 0.0000 0.0000 63.2350 31.6740 176.8908 1078 D 4.9014 8.2507 121.0715 56.0572 41.8766 178.0824 1079 G 3.9132 9.0654 106.7392 46.2764 0.0000 175.6444 1080 F 4.6226 8.3812 123.9191 61.0634 39.4353 176.2876 1081 Y 4.5747 8.1687 118.2755 61.2158 38.6075 177.9790 1082 D 4.5045 8.2215 121.0807 56.7783 39.6538 178.0917 1083 Y 3.8793 8.2599 120.4440 60.6192 38.7502 178.0645 1084 F 4.6464 8.0616 117.2925 60.1819 39.0212 177.8068 1085 T 4.3290 8.0087 111.0920 64.2016 68.5383 177.7770 1086 K 3.9033 7.6465 126.7580 59.8968 31.8294 184.4526 1087 R 3.9368 6.9453 118.5164 57.2304 31.2672 177.1040 1088 F 4.7803 8.0462 117.3324 54.3713 39.8933 173.1384 1089 P 4.3397 0.0000 0.0000 65.3705 31.7365 178.4459 1090 N 4.7793 7.9718 114.4491 53.2373 38.9116 176.4398 1091 L 3.9460 8.0022 121.7800 58.2056 42.1517 178.7274 1092 L 4.1394 7.9096 119.6185 58.3539 42.2629 178.7077 1093 I 3.8462 7.9179 118.2871 63.8259 37.8521 177.9018 1094 G 3.8158 8.4301 106.8794 47.8942 0.0000 175.9406 1095 V 3.7281 8.1006 121.0460 65.6910 31.6244 177.2812 1096 Y 4.3010 8.4146 119.4181 61.2455 38.3958 178.0007 1097 M 3.9018 8.5943 119.7571 58.5120 32.0206 178.9453 1098 I 3.4778 7.3601 119.5715 64.2799 37.1470 178.6901 1099 V 3.6042 8.0850 119.4998 65.8549 31.1467 177.8378 1100 K 3.8242 8.1080 121.1917 60.0269 31.9715 179.0533 1101 E 4.1025 7.6173 117.4038 60.8797 29.9116 180.0589 1102 N 5.0937 8.1020 114.9176 52.9800 39.9873 175.7949 1103 L 4.8755 8.1057 119.5145 54.3334 43.1153 177.7879 1104 S 4.6036 8.3704 111.7993 59.3858 63.0849 174.1451 1105 D 4.7066 7.8603 119.9883 54.0229 40.5639 176.4370 1106 D 4.4883 8.0090 121.0496 54.2496 41.7806 176.9810 1107 Q 4.0950 8.8037 125.1367 59.2339 29.3341 178.6814 1108 I 4.0580 8.1196 118.2174 64.3862 37.3910 178.4771 1109 L 4.3803 8.2191 118.9649 57.7314 41.4401 179.6471 1110 R 4.2014 8.2734 118.4944 59.3997 30.0195 178.8026 1111 E 4.4092 8.3685 119.7090 58.6511 29.1646 179.3930 1112 F 3.8202 8.3293 117.0464 60.2554 39.1898 177.1301 1113 L 4.3860 7.7952 117.2268 56.7690 41.6642 177.3598 1114 Y 5.0378 8.0726 113.2523 57.3127 40.4761 175.7834 1115 S 4.3495 7.8561 119.2700 58.3108 63.2199 173.6974 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 665 N 8.52 4.75 0.00 2.76 1.86 0.00 0.00 6.60 6.55 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 *666 F 9.05 4.19 0.00 2.37 2.23 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 0.00 667 E 8.09 4.55 0.00 1.72 1.72 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 1.99 2.31 0.00 668 Q 7.76 4.45 0.00 2.01 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.59 0.00 0.00 0.00 0.00 0.00 2.16 1.89 0.00 669 S 7.92 4.83 0.00 3.62 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 670 L 7.62 4.83 0.00 1.56 1.53 0.43 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 671 K 9.14 4.16 0.00 1.72 1.64 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.25 7.81 672 N 8.42 4.76 0.00 2.68 2.74 0.00 0.00 7.25 7.64 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 0.00 673 L 7.73 4.49 0.00 1.41 1.53 0.88 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 674 V 8.72 4.15 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.89 0.00 0.00 675 V 8.10 4.56 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.78 0.00 0.00 676 S 8.60 4.54 0.00 3.93 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 0.00 677 E 8.66 4.17 0.00 2.01 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 2.20 1.86 0.00 678 K 7.88 4.15 0.00 1.77 1.78 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.43 7.81 679 I 8.25 4.39 1.73 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 1.14 0.97 0.21 0.00 0.00 680 L 8.72 4.25 0.00 1.57 1.65 0.96 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 681 G 6.84 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 682 Y 8.47 4.98 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 0.00 683 G 8.86 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 0.00 0.00 0.00 0.00 684 S 8.41 4.19 0.00 3.67 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 685 S 9.35 3.95 0.00 4.22 4.37 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 0.00 686 G 8.24 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 687 T 7.67 4.32 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 688 V 8.41 4.33 1.58 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 -0.10 0.00 0.00 1.01 0.00 0.00 689 V 8.16 4.57 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 0.90 0.00 0.00 0.83 0.00 0.00 690 F 9.07 5.31 0.00 3.02 2.99 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 0.00 691 Q 8.96 4.39 0.00 2.17 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.44 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 692 G 9.20 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 0.00 0.00 0.00 0.00 693 S 8.73 5.19 0.00 3.82 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 0.00 694 F 9.30 5.04 0.00 2.80 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 695 Q 9.37 3.36 0.00 1.59 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.37 0.00 0.00 0.00 0.00 0.00 1.96 1.60 0.00 696 G 8.31 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 0.00 697 R 7.38 3.85 0.00 1.86 1.64 0.00 3.14 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.47 0.00 698 P 0.00 4.80 0.00 1.91 1.97 0.00 3.55 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.07 0.00 699 V 8.62 4.69 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 0.92 0.00 0.00 700 A 9.07 5.07 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 701 V 9.14 4.61 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.99 0.00 0.00 702 K 9.45 4.64 0.00 1.86 1.84 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.75 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.34 7.81 703 R 9.11 4.59 0.00 1.96 1.86 0.00 2.21 0.00 0.00 2.94 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.50 0.00 704 M 8.87 5.11 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 705 L 8.75 4.51 0.00 1.83 1.57 1.08 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 706 I 8.26 4.00 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.72 0.91 0.00 0.00 707 D 7.92 4.52 0.00 2.69 2.61 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 0.00 0.00 0.00 0.00 708 F 8.46 5.16 0.00 3.21 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 0.00 709 C 8.10 4.02 0.00 2.74 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 0.00 710 D 8.43 4.47 0.00 2.60 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 711 I 7.35 3.99 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.10 0.91 0.00 0.00 712 A 7.74 4.62 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 0.00 713 L 7.93 4.05 0.00 1.70 1.69 0.92 0.83 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 0.00 714 M 7.93 4.28 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.16 0.00 715 E 8.02 4.29 0.00 2.00 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 2.31 2.50 0.00 716 I 8.01 3.20 1.67 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.17 0.48 0.00 0.00 717 K 7.81 3.96 0.00 1.79 1.83 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.36 7.81 718 L 7.79 4.13 0.00 1.80 1.86 0.91 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 719 L 7.59 3.64 0.00 1.58 1.40 0.66 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 720 T 7.72 3.89 4.36 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 1.23 0.00 0.00 721 E 7.62 4.11 0.00 1.85 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 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0.00 0.00 0.00 0.00 0.00 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 0.00 853 S 7.94 4.82 0.00 4.05 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 0.00 854 G 8.06 3.58 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 0.00 0.00 0.00 855 W 8.12 4.81 0.00 3.26 3.24 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 0.00 856 R 7.80 4.63 0.00 1.76 1.82 0.00 3.41 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 857 A 8.19 2.58 0.95 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 0.00 858 P 0.00 3.97 0.00 2.00 2.38 0.00 2.55 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 859 E 7.80 4.03 0.00 1.96 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 2.12 2.13 0.00 860 L 7.64 4.47 0.00 1.72 1.70 0.93 0.79 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1025 W 9.04 4.60 0.00 4.07 3.51 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 0.00 1026 T 7.81 3.87 4.36 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 1.15 0.00 0.00 1027 V 7.09 3.64 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.93 0.00 0.00 1028 K 7.69 4.04 0.00 1.23 0.99 0.00 0.99 0.00 0.00 1.33 0.00 0.00 2.84 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.25 0.93 7.81 1029 F 7.30 4.69 0.00 2.99 2.55 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 0.00 0.00 0.00 0.00 1030 D 8.56 4.81 0.00 2.68 2.56 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 1031 K 8.56 4.20 0.00 1.76 1.84 0.00 1.75 0.00 0.00 1.87 0.00 0.00 2.92 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.44 1.06 7.81 1032 T 7.93 4.37 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 1033 F 8.45 4.33 0.00 3.14 3.37 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 1034 M 8.10 4.31 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.42 0.00 1035 D 7.77 4.58 0.00 2.71 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 1036 N 7.62 4.60 0.00 2.95 2.92 0.00 0.00 6.86 7.67 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 1037 L 7.32 4.57 0.00 1.61 1.68 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 1038 E 8.37 4.30 0.00 1.97 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 2.26 2.13 0.00 1039 R 8.04 4.23 0.00 1.83 1.87 0.00 3.24 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.19 0.00 *1040 Y 7.65 4.22 0.00 2.30 2.24 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 1041 R 7.65 4.55 0.00 1.62 1.39 0.00 3.04 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.48 0.00 1042 K 8.33 4.02 0.00 1.82 1.60 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.71 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.36 1.03 7.81 1043 Y 8.39 4.89 0.00 3.00 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 1044 H 9.22 4.58 0.00 3.52 3.37 0.00 5.62 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1045 S 8.82 3.67 0.00 3.72 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 1046 S 7.94 4.99 0.00 4.28 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1047 K 7.90 4.37 0.00 2.06 1.86 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.71 1.53 7.81 1048 L 9.02 3.98 0.00 1.80 1.87 0.87 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 1049 M 8.09 3.97 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.21 0.00 1050 D 8.13 4.71 0.00 3.22 3.37 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 1051 L 7.14 2.44 0.00 0.27 1.11 0.39 -0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 1052 L 7.80 3.73 0.00 1.84 1.66 0.82 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 1053 R 8.25 3.90 0.00 1.95 2.04 0.00 3.26 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 1054 A 8.03 4.01 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1055 L 7.65 3.43 0.00 1.14 1.58 0.46 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 1056 R 7.85 3.90 0.00 1.87 2.10 0.00 3.31 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 1057 N 8.64 4.47 0.00 2.96 2.99 0.00 0.00 7.13 7.28 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 1058 K 8.11 4.15 0.00 2.25 2.35 0.00 1.62 0.00 0.00 1.59 0.00 0.00 2.50 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.60 1.81 7.81 1059 Y 8.11 3.92 0.00 2.72 3.17 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 1060 H 8.64 4.30 0.00 3.29 3.27 0.00 5.86 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 1061 H 8.34 5.03 0.00 3.41 3.27 0.00 5.81 0.00 0.00 0.00 0.00 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1062 F 8.25 4.14 0.00 3.19 2.90 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 1063 M 8.09 4.13 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.63 0.00 1064 D 7.66 4.48 0.00 2.79 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1065 L 7.06 4.00 0.00 1.34 1.37 0.63 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 1066 P 0.00 4.37 0.00 2.11 1.94 0.00 3.53 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 1067 E 8.89 3.99 0.00 1.97 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 1.95 0.00 1068 D 8.00 4.61 0.00 2.87 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 1069 I 7.64 3.73 1.90 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 1.55 0.82 0.90 0.00 0.00 1070 A 7.64 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1071 E 8.25 4.10 0.00 2.26 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 2.34 2.45 0.00 1072 L 7.45 4.14 0.00 1.85 1.86 0.99 0.98 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 1073 M 8.56 4.34 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.81 0.00 1074 G 7.79 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1075 P 0.00 5.01 0.00 2.26 2.24 0.00 3.79 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.02 0.00 1076 V 7.89 4.08 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.57 0.00 0.00 1077 P 0.00 4.85 0.00 2.26 2.28 0.00 3.70 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.99 0.00 1078 D 8.25 4.90 0.00 2.86 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1079 G 9.07 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1080 F 8.38 4.62 0.00 3.13 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1081 Y 8.17 4.57 0.00 3.48 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 1082 D 8.22 4.50 0.00 2.99 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 1083 Y 8.26 3.88 0.00 3.06 2.90 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 1084 F 8.06 4.65 0.00 3.15 3.17 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 1085 T 8.01 4.33 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 1086 K 7.65 3.90 0.00 1.90 1.77 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.35 7.81 1087 R 6.95 3.94 0.00 1.55 0.73 0.00 2.21 0.00 0.00 2.29 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.02 0.00 1088 F 8.05 4.78 0.00 3.10 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 1089 P 0.00 4.34 0.00 2.16 2.25 0.00 3.59 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.90 0.00 1090 N 7.97 4.78 0.00 2.47 2.15 0.00 0.00 6.80 6.74 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 1091 L 8.00 3.95 0.00 1.92 1.83 0.84 0.53 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 1092 L 7.91 4.14 0.00 1.96 1.77 0.64 1.21 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 1093 I 7.92 3.85 1.90 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.99 1.22 0.00 0.00 1094 G 8.43 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 0.00 0.00 0.00 1095 V 8.10 3.73 2.32 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 1.18 0.00 0.00 1.13 0.00 0.00 1096 Y 8.41 4.30 0.00 3.05 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 1097 M 8.59 3.90 0.00 1.92 2.11 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.57 0.00 1098 I 7.36 3.48 1.46 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.47 -0.26 0.00 0.00 1099 V 8.09 3.60 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 1.14 0.00 0.00 1100 K 8.11 3.82 0.00 1.11 1.54 0.00 1.55 0.00 0.00 1.69 0.00 0.00 3.13 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.42 1.31 7.81 1101 E 7.62 4.10 0.00 2.10 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 2.26 2.22 0.00 1102 N 8.10 5.09 0.00 2.72 2.90 0.00 0.00 6.89 7.37 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 1103 L 8.11 4.88 0.00 1.84 1.66 1.09 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 1104 S 8.37 4.60 0.00 4.46 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1105 D 7.86 4.71 0.00 2.84 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 1106 D 8.01 4.49 0.00 2.81 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1107 Q 8.80 4.10 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.84 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 1108 I 8.12 4.06 1.94 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 1.58 0.60 1.09 0.00 0.00 1109 L 8.22 4.38 0.00 1.77 1.91 0.69 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 1110 R 8.27 4.20 0.00 1.98 2.21 0.00 3.41 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.85 0.00 1111 E 8.37 4.41 0.00 2.06 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 2.54 2.35 0.00 1112 F 8.33 3.82 0.00 3.37 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 1113 L 7.80 4.39 0.00 1.20 0.28 1.24 1.03 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 1114 Y 8.07 5.04 0.00 3.16 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 1115 S 7.86 4.35 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 * Residues marked with a * may have inaccurate shift predictions.