NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 723 L 4.2168 8.1844 120.7662 53.9739 43.2480 176.6007 724 V 3.8842 7.5586 120.8606 59.8522 31.5094 173.0322 725 P 4.3300 0.0000 0.0000 63.0235 32.5189 176.2354 726 Q 4.0369 8.8295 125.2036 59.0319 29.0698 177.0160 727 L 4.1443 7.6139 117.8056 53.5160 39.7101 178.2958 728 S 4.2741 8.3050 119.6262 57.9118 63.1755 174.3457 729 T 3.9928 8.4995 126.8123 66.1838 68.2560 176.7327 730 I 3.7539 7.5974 120.5184 64.0553 38.1138 177.6808 731 S 4.1383 8.4981 116.7470 61.8441 61.9294 177.0186 732 R 3.9308 7.7500 122.4370 61.2405 29.3028 181.1705 733 A 4.4064 7.6095 120.2809 53.7162 18.7928 178.5137 734 L 4.2255 7.9036 117.1149 55.2634 42.8239 176.9223 735 T 4.1203 7.0126 115.7246 63.0657 69.0737 172.7615 736 P 4.4114 0.0000 0.0000 62.2027 32.2564 177.2652 737 S 4.3160 8.4184 116.9246 57.5977 65.1126 173.4471 738 P 4.2007 0.0000 0.0000 66.1929 30.9942 179.1272 739 V 3.7224 7.9114 118.6575 66.8158 31.4899 178.4933 740 M 4.1860 7.8259 120.2495 59.6063 31.2118 181.4239 741 V 3.8856 8.0553 119.3266 65.7813 31.7607 178.2248 742 L 4.0772 8.0933 118.9931 57.7738 41.2455 179.0743 743 E 4.3725 7.9943 118.1923 59.3360 29.6426 178.2765 744 N 4.6239 7.9376 115.8571 55.7015 38.8430 176.7424 745 I 4.2088 8.1055 112.6555 60.6662 38.3660 175.8448 746 E 4.1198 7.7459 122.3927 56.0025 29.8619 174.8962 747 P 4.5216 0.0000 0.0000 62.4891 32.0895 176.0616 748 E 4.3784 8.4800 120.3639 55.5786 30.3289 176.9537 749 I 3.8043 8.2302 121.2513 61.8837 37.6658 175.9107 750 V 4.4323 8.1534 123.4722 61.4696 33.1354 174.5722 751 Y 4.5173 8.5041 123.3394 56.6096 39.3987 175.8560 752 A 4.1461 8.9464 127.0435 53.4664 18.7852 178.4279 753 G 3.8595 9.0665 103.1595 46.5111 0.0000 173.1400 754 Y 4.1449 8.3603 120.4278 57.1391 39.7717 173.8668 755 D 4.6122 7.9352 126.6643 51.9979 41.5116 176.5573 756 S 3.8412 8.2270 121.9213 59.9612 63.0596 176.0899 757 S 4.1606 7.9122 115.3328 60.5247 62.8993 174.9625 758 K 4.1935 7.4385 120.7076 54.7479 32.4419 175.0916 759 P 4.3217 0.0000 0.0000 63.3161 32.0520 177.0527 760 D 4.6652 8.4666 122.5791 53.6245 39.3995 175.8320 761 T 4.5608 7.2592 112.3890 59.6862 73.0106 175.4055 762 A 4.1141 8.4478 123.2600 55.3807 18.2632 179.6772 763 E 3.9409 8.2314 115.5809 59.8033 29.4875 179.0254 764 N 4.4407 7.8337 116.8028 55.7170 38.7632 177.5762 765 L 4.0282 7.9689 120.4888 57.8040 41.6589 179.5522 766 L 4.0537 8.1835 119.0706 57.8366 41.5676 179.7980 767 S 4.2568 7.7993 116.2372 61.3857 62.7867 176.8814 768 T 3.9292 8.1609 118.5821 66.5726 68.1042 176.7026 769 L 3.8469 8.3513 121.2736 57.8428 41.5184 179.3270 770 N 4.3992 8.4938 119.1066 56.9792 38.4160 178.3366 771 R 3.9623 7.9930 122.0222 61.1781 29.4054 180.4811 772 L 4.1507 8.1182 121.0288 58.0298 42.1512 178.7584 773 A 4.2212 8.4619 121.1932 55.3791 17.9070 179.8100 774 G 3.6324 8.3534 104.2173 48.0615 0.0000 176.1320 775 K 4.1816 8.1234 121.0721 59.1199 32.0342 179.6178 776 Q 4.1530 8.4940 118.7443 59.3126 28.6484 178.6554 777 M 4.3477 8.3275 119.6402 58.2416 31.6717 178.8874 778 I 3.7628 7.5090 118.9985 64.5652 37.2111 178.4872 779 Q 4.0806 7.7763 117.5105 58.7632 28.5009 178.6320 780 V 3.6041 8.3199 119.8282 66.2620 31.5272 178.1969 781 V 3.7693 8.1040 117.7888 66.1430 30.9698 178.1798 782 K 4.1329 7.9423 118.1504 58.9590 31.6536 179.1716 783 W 4.2535 8.3818 128.0926 60.4583 30.9327 177.5551 784 A 3.5017 8.7182 121.1700 54.7432 17.5449 179.4834 785 K 3.9381 7.6809 115.6471 59.7249 32.2537 179.2035 786 V 4.3796 6.9114 108.0521 60.1070 32.0695 175.8165 787 L 3.8476 7.3078 122.8589 53.1118 41.4791 174.1807 788 P 4.2699 0.0000 0.0000 65.0530 31.7498 175.2202 789 G 4.2006 9.1118 111.3051 45.7548 0.0000 175.0416 790 F 4.1801 8.7088 124.3608 61.4426 39.5315 177.8640 791 K 4.0060 8.1346 123.2211 57.4680 31.7536 181.7499 792 N 4.5842 7.7237 112.6354 54.2937 37.7612 180.0500 793 L 4.4970 6.9920 116.3302 53.4472 43.0531 175.2507 794 P 4.3175 0.0000 0.0000 62.8478 33.3073 177.3603 795 L 4.0159 8.4103 121.9637 58.6005 41.9698 179.3307 796 E 3.9911 8.0283 118.0973 61.2658 29.7869 182.0821 797 D 4.4823 7.9435 119.6938 56.9063 40.9192 178.8072 798 Q 3.7275 7.6432 118.7917 58.8866 28.7487 178.7368 799 I 3.7498 7.5561 120.1524 64.8621 37.2272 178.4399 800 T 4.0262 8.0380 116.4606 66.8917 68.3857 176.5887 801 L 4.0726 8.4942 121.0285 57.8775 41.8081 179.6607 802 I 3.9195 8.0151 119.6975 64.6592 36.8641 178.5771 803 Q 4.2015 8.2056 117.7699 59.2116 28.6003 178.0851 804 Y 4.9265 8.7876 118.6198 59.2980 38.1117 177.0858 805 S 4.7855 8.0705 113.1066 57.8442 63.4457 175.8088 806 W 4.4021 8.0832 121.9178 60.4431 27.6709 177.9614 807 M 3.2126 6.9174 118.5007 57.8047 31.5300 178.1691 808 S 3.9959 7.7348 114.8214 61.6783 63.0789 176.5428 809 L 3.9673 8.0083 121.5937 57.7399 41.2834 179.8596 810 S 4.1487 8.2449 115.4106 61.6271 62.8652 176.9225 811 S 4.0250 8.2209 117.2197 61.3483 62.8847 176.0860 812 F 4.2426 8.5414 124.5366 61.1141 39.1737 177.0283 813 A 4.3922 8.4062 121.7378 54.3640 18.0736 179.3502 814 L 3.7885 7.9336 119.0669 58.5490 42.1331 179.4710 815 S 4.1920 7.9306 116.3185 60.4964 62.4978 176.6147 816 W 4.1346 7.9451 130.8060 60.6595 30.4033 178.3982 817 R 3.6972 8.1205 117.9858 59.2067 29.3680 179.3053 818 S 4.0888 8.1483 115.2286 61.4666 62.8719 176.0403 819 Y 4.4122 7.8725 126.0511 60.7309 38.3737 178.8609 820 K 3.1350 7.1443 123.3727 59.8394 31.8771 180.4812 821 H 4.5191 7.6059 116.0494 56.9094 29.0142 176.2855 822 T 4.5659 6.9303 107.8153 60.2476 69.8277 173.4941 823 N 3.9791 8.3744 117.2358 54.9123 36.5945 174.2137 824 S 3.7354 8.0797 110.3050 59.7726 61.1427 174.5335 825 Q 3.7528 7.7193 123.1211 57.6511 29.0499 174.8596 826 F 4.9320 7.8867 114.0321 55.7547 43.2235 173.7628 827 L 4.3378 8.7583 121.6102 53.8572 41.3181 175.8872 828 Y 4.5242 8.4898 128.3779 55.9263 37.2629 175.8190 829 F 3.8404 8.1500 122.1083 59.6071 39.8403 175.3345 830 A 4.5338 7.5826 120.7018 50.0745 22.2362 175.1973 831 P 3.8102 0.0000 0.0000 64.5550 31.3778 177.4759 832 D 4.7867 7.7479 114.9584 52.9554 39.8438 176.6953 833 L 4.2994 7.6728 123.5521 54.2866 43.9969 172.7999 834 V 4.7659 7.9653 123.5158 60.6420 33.7527 174.2243 835 F 4.8510 9.6965 128.0365 56.8078 40.6627 175.4356 836 N 5.5182 8.4423 121.2601 51.3967 40.3641 175.2564 837 E 4.0317 9.1429 117.2912 59.8834 29.3006 178.9101 838 E 3.9575 8.3028 118.4391 59.6240 29.6084 179.0031 839 K 3.7381 8.0146 117.8788 59.5460 31.6577 179.2815 840 M 4.3818 7.7768 118.2473 58.7670 32.2495 178.2767 841 H 4.4786 8.3585 116.4062 59.0491 28.7208 177.9437 842 Q 4.1066 8.1879 119.0473 58.5557 28.5674 178.3855 843 S 4.2998 8.0438 113.5858 58.7705 63.2434 174.7080 844 A 3.9289 7.9325 124.0765 53.0081 17.0606 177.4286 845 M 4.6396 7.7667 113.7616 54.5901 31.5532 176.7352 846 Y 4.1085 8.3094 121.8467 62.0268 39.2794 176.1235 847 E 3.6994 8.2560 119.4508 59.3293 29.7173 178.6411 848 L 3.8499 7.6489 118.3115 57.9968 41.7050 179.1146 849 C 4.0914 8.0051 116.6114 62.8475 27.9978 176.2365 850 Q 3.9179 7.8565 119.9023 58.5413 27.6674 178.8410 851 G 3.5737 7.9434 106.8503 48.3275 0.0000 175.7386 852 M 4.0186 7.9273 121.6034 57.9364 31.7971 178.4196 853 H 4.0860 8.2465 118.6374 59.1424 29.9798 177.3465 854 Q 3.8035 7.9961 120.0568 58.7513 28.4769 178.8151 855 I 3.4942 7.0978 119.8698 64.3927 36.6100 178.5581 856 S 3.4106 7.3635 115.6795 61.3736 62.7054 176.8246 857 L 3.9216 7.7640 121.8405 57.8653 41.3392 179.6217 858 Q 4.0324 7.9829 117.9022 58.7797 28.5381 178.7605 859 F 4.1041 7.8190 119.1076 60.2244 38.7007 177.8890 860 V 3.7842 7.4997 119.2248 66.8478 31.2467 178.9069 861 R 3.9734 7.5758 118.4870 61.3108 29.2881 179.9724 862 L 4.4067 7.9649 116.9760 54.2956 42.7001 176.5575 863 Q 3.5367 7.8536 117.1971 56.1050 26.7281 173.8454 864 L 4.0936 7.6156 118.2008 55.8430 43.0653 176.4781 865 T 4.9226 8.3370 114.1443 59.7666 72.5024 175.5163 866 F 3.7473 9.0600 125.7837 62.0351 39.3227 177.6938 867 E 3.8899 8.3268 117.4137 61.1770 29.5527 180.5791 868 E 4.1125 8.0248 119.5217 59.2730 29.0099 178.6766 869 Y 3.9668 7.8771 119.8949 61.0127 38.6052 178.5337 870 T 3.2214 7.3441 110.4274 64.4555 68.6466 176.5898 871 I 3.7383 7.2661 122.5919 64.2882 37.2624 178.0057 872 M 3.8749 8.2635 119.9806 58.2475 31.7676 178.6902 873 K 3.5587 7.8872 119.7527 59.3791 32.0814 178.9033 874 V 3.5609 7.1583 116.8421 66.0814 31.7086 177.6417 875 L 4.0978 7.8572 118.6429 57.7896 41.1723 179.5698 876 L 3.9839 7.4227 119.5999 56.9551 41.5632 178.8845 877 L 4.2458 7.6439 120.8787 56.2767 42.1825 177.1782 878 L 5.1250 7.6320 118.4387 54.6861 42.3527 176.8395 879 S 4.8142 8.2067 112.5756 58.5550 65.2818 173.5726 880 T 5.0804 7.9403 116.9989 61.9160 71.8004 173.0380 881 I 4.2996 8.7636 118.5851 58.1073 41.9572 172.6807 882 P 4.8396 0.0000 0.0000 63.0606 31.7096 178.5270 883 K 4.1010 8.6682 127.3283 58.3811 31.5791 177.5520 884 D 4.3067 8.1746 117.8105 54.4336 39.9935 175.3394 885 G 3.6065 7.9089 104.9026 44.2585 0.0000 172.1080 886 L 4.5510 8.8572 119.5760 52.2105 44.2257 176.9974 887 K 3.9660 9.4745 121.3950 59.1621 32.2737 177.0496 888 S 4.5931 8.3725 116.0492 55.7037 62.1257 173.6201 889 Q 4.0515 8.2927 126.5064 58.4248 29.0600 177.1792 890 A 4.0202 7.9842 121.4508 54.9818 18.6977 179.2662 891 A 3.9621 7.9749 118.9088 55.0789 18.4483 179.5229 892 F 4.0486 8.2250 119.0838 61.5326 39.5872 176.9500 893 E 3.8096 8.4730 118.9909 59.0940 29.2414 178.4997 894 E 3.8165 8.1096 119.3272 59.3730 29.7201 178.3655 895 M 3.9898 7.7566 117.8337 58.6684 32.3346 177.9750 896 R 3.7751 7.9189 119.0928 59.8609 30.1913 178.5483 897 T 3.9081 8.1956 115.7062 66.6522 68.4249 176.4466 898 N 4.2554 8.4753 118.7408 56.6484 38.4824 177.2158 899 Y 3.9917 8.2109 118.0041 60.7007 37.8447 178.6501 900 I 3.9904 7.9904 123.7806 64.9055 37.1893 179.0337 901 K 3.9876 8.1660 124.5875 59.8657 31.4982 180.6725 902 E 4.1087 8.2422 119.6041 59.3481 29.4824 179.3542 903 L 4.0950 7.8883 122.9218 58.6837 41.9560 179.8126 904 R 3.6894 8.1102 122.3151 61.8763 29.3710 181.4834 905 K 4.2461 8.1114 123.6144 59.2406 31.7673 180.6018 906 M 4.3590 7.5368 116.3407 57.7625 32.3740 176.9145 907 V 3.8444 6.8217 110.7826 60.2565 33.0868 175.7545 *913 N 4.5073 8.2198 118.8423 53.3061 38.7049 174.5354 914 S 4.3027 8.4607 120.2434 60.8453 63.3152 176.4153 915 G 3.7733 8.3808 111.2937 48.6045 0.0000 176.2084 916 Q 4.1407 8.2986 123.5561 59.6928 28.2377 180.5576 917 S 4.3793 7.9189 116.3866 61.4231 62.7411 176.8310 918 W 4.5023 8.2230 121.5686 59.6382 28.9923 178.7546 919 Q 4.1693 8.3376 118.1789 58.8604 28.0375 178.7733 920 R 4.0341 8.0905 119.3807 59.1805 30.2252 178.0778 921 F 4.1504 8.2454 120.2263 61.4255 39.2759 176.5368 922 Y 4.1856 8.5116 120.5716 60.2532 38.6141 177.9553 923 Q 3.6990 7.9953 118.3790 58.9627 28.8905 178.8674 924 L 3.8822 8.1089 120.5238 58.0092 41.1003 179.8039 925 T 3.3399 7.6654 112.1520 64.9668 68.6190 177.5816 926 K 4.0655 7.8633 126.6364 59.1549 31.4176 181.7389 927 L 4.1333 7.7607 120.5117 58.1417 42.3377 178.7303 928 L 4.0146 7.8034 118.8342 58.0358 41.5606 179.2880 929 D 4.3874 8.1440 118.9471 57.3421 40.5778 178.9403 930 S 4.3140 8.1582 114.2977 61.1744 62.8682 176.3137 931 M 4.1713 7.9012 122.6423 58.2418 31.5357 178.2330 932 H 4.1772 8.0265 116.9614 58.8322 28.8410 177.5195 933 D 4.3671 8.0596 120.2255 57.1581 40.7210 178.2527 934 L 3.8722 7.4751 119.4483 58.3294 42.1049 179.2699 935 V 3.4353 8.0445 118.4497 65.7627 31.3995 177.7982 936 S 4.0374 8.1841 112.9929 61.6467 62.3442 176.0274 937 D 4.3773 8.1016 121.4498 57.2454 40.4283 178.7570 938 L 3.9358 8.0679 119.8848 57.8103 41.5348 179.6188 939 L 3.4355 8.1310 119.3327 57.3324 41.5375 179.0287 940 E 3.8712 8.0490 119.3643 59.3253 29.4737 178.7945 941 F 4.1143 8.1353 120.1622 61.1942 39.4630 176.5684 942 C 4.3796 8.4353 118.7043 62.9174 31.3518 175.6337 943 F 4.6713 8.6459 119.7186 60.7659 38.4203 177.1618 944 Y 4.0931 8.1746 118.7664 61.2444 38.4803 178.2813 945 T 3.7674 8.0658 115.3128 66.3108 68.6446 176.3335 946 F 3.7809 8.6044 122.8476 61.2161 39.2196 177.4589 947 R 3.8563 8.2582 116.7865 58.4230 30.0599 178.0949 948 E 4.4902 7.8156 117.4624 55.8628 30.7857 178.1075 949 S 4.2364 7.6030 118.9016 62.7827 62.0957 176.1226 *950 H 4.1482 7.9129 119.5293 59.5610 27.9524 178.3276 951 A 4.3072 7.7425 123.2843 55.0719 18.8993 178.6275 952 L 4.1555 8.3417 115.0015 55.2297 41.9933 177.7157 953 K 4.3064 7.6509 116.9974 57.3374 29.8090 175.5179 954 V 4.1754 7.1579 117.1673 61.4362 32.5003 174.9238 955 E 4.6732 8.6109 127.3360 55.2810 30.7331 175.3925 956 F 4.7755 8.6380 120.3640 54.4965 42.3966 174.0992 957 P 4.6091 0.0000 0.0000 62.1048 33.3901 177.1614 958 A 4.0292 8.5955 120.1380 55.8056 18.1874 179.4781 959 M 3.9057 8.1167 115.9266 58.9663 32.2418 178.2975 960 L 3.7823 7.8388 118.4749 57.4734 42.0002 179.3114 961 V 3.8560 8.0460 118.3194 65.7224 31.2580 177.8461 962 E 3.8485 8.3997 119.4571 59.2784 29.5628 178.9024 963 I 3.6010 7.4577 119.7622 64.4467 37.0268 178.6316 964 I 3.5906 7.7540 120.9927 64.2134 36.5687 178.6767 965 S 4.0140 7.5503 115.2801 61.2000 61.3357 175.7555 966 D 4.4345 7.5634 119.3040 56.8796 41.2478 178.4536 967 Q 3.8893 7.9909 118.5499 58.6579 28.7338 177.6603 968 L 2.4607 7.7225 121.8612 57.6625 41.9572 177.4574 969 P 4.1066 0.0000 0.0000 65.6417 31.1907 178.5046 970 K 4.0526 7.3522 116.5530 59.1626 31.8938 179.5172 971 V 3.6085 8.0275 118.9530 66.0265 31.3530 177.6409 972 E 4.1943 8.2456 116.3119 57.9981 29.4872 177.4641 973 S 4.5059 7.6371 111.4095 57.6326 63.3107 174.7631 974 G 3.8961 7.9265 108.2807 46.7555 0.0000 174.1562 975 N 4.7949 8.3082 115.2904 53.2349 39.7343 174.2040 976 A 5.1084 7.9466 121.8253 50.2969 20.7528 176.3607 977 K 4.4755 9.5477 125.7282 54.2819 34.0361 173.5625 978 P 4.7912 0.0000 0.0000 62.1805 32.3106 175.6440 979 L 4.6748 8.6977 124.7761 53.4573 42.9118 175.8641 980 Y 4.8577 8.6825 120.6835 56.4379 40.7388 175.4073 981 F 4.4763 9.4527 119.6534 58.3870 40.2170 176.2775 982 H 4.6577 8.7356 121.8439 55.9098 29.1725 173.2074 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 723 L 8.18 4.22 0.00 1.68 1.65 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 724 V 7.56 3.88 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 0.93 0.00 0.00 0.93 0.00 0.00 725 P 0.00 4.33 0.00 2.07 1.99 0.00 3.72 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 726 Q 8.83 4.04 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.86 7.28 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 727 L 7.61 4.14 0.00 1.66 1.51 0.92 0.78 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 0.00 728 S 8.31 4.27 0.00 3.88 3.78 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 0.00 729 T 8.50 3.99 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 730 I 7.60 3.75 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 1.52 1.60 0.91 0.00 0.00 731 S 8.50 4.14 0.00 3.91 3.83 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 0.00 732 R 7.75 3.93 0.00 1.99 1.83 0.00 3.31 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 733 A 7.61 4.41 1.31 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 0.00 0.00 734 L 7.90 4.23 0.00 1.79 1.70 0.92 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 735 T 7.01 4.12 4.35 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 1.20 0.00 0.00 736 P 0.00 4.41 0.00 2.04 1.99 0.00 3.68 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 737 S 8.42 4.32 0.00 4.03 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 738 P 0.00 4.20 0.00 2.09 2.01 0.00 3.55 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.06 0.00 739 V 7.91 3.72 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 1.04 0.00 0.00 0.93 0.00 0.00 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905 K 8.11 4.25 0.00 1.83 1.75 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.31 7.81 906 M 7.54 4.36 0.00 2.08 2.27 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.61 0.00 907 V 6.82 3.84 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 0.81 0.00 0.00 1.01 0.00 0.00 *913 N 8.22 4.51 0.00 2.75 2.77 0.00 0.00 6.62 7.25 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 0.00 914 S 8.46 4.30 0.00 4.33 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 0.00 915 G 8.38 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 916 Q 8.30 4.14 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.75 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 917 S 7.92 4.38 0.00 3.65 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 0.00 918 W 8.22 4.50 0.00 3.49 3.28 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 0.00 919 Q 8.34 4.17 0.00 2.38 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.84 0.00 0.00 0.00 0.00 0.00 2.43 2.61 0.00 920 R 8.09 4.03 0.00 1.96 1.95 0.00 3.12 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 921 F 8.25 4.15 0.00 3.16 3.38 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 0.00 922 Y 8.51 4.19 0.00 3.33 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 0.00 923 Q 8.00 3.70 0.00 2.34 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.57 0.00 0.00 0.00 0.00 0.00 2.44 2.71 0.00 924 L 8.11 3.88 0.00 1.56 1.55 0.88 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 925 T 7.67 3.34 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 926 K 7.86 4.07 0.00 1.79 1.86 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.31 7.81 927 L 7.76 4.13 0.00 1.70 1.94 1.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 928 L 7.80 4.01 0.00 1.82 1.66 0.62 0.60 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 0.00 929 D 8.14 4.39 0.00 3.05 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 0.00 930 S 8.16 4.31 0.00 4.07 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 0.00 931 M 7.90 4.17 0.00 1.93 2.15 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.87 0.00 932 H 8.03 4.18 0.00 3.28 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 933 D 8.06 4.37 0.00 2.80 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 934 L 7.48 3.87 0.00 1.75 1.76 0.80 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 935 V 8.04 3.44 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 0.79 0.00 0.00 0.87 0.00 0.00 936 S 8.18 4.04 0.00 4.04 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 0.00 937 D 8.10 4.38 0.00 2.86 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 0.00 938 L 8.07 3.94 0.00 1.62 1.54 0.78 0.55 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 0.00 939 L 8.13 3.44 0.00 1.47 0.57 0.87 0.43 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 0.00 940 E 8.05 3.87 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 941 F 8.14 4.11 0.00 3.23 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 0.00 942 C 8.44 4.38 0.00 3.17 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 0.00 943 F 8.65 4.67 0.00 3.15 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 944 Y 8.17 4.09 0.00 3.17 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 0.00 945 T 8.07 3.77 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 946 F 8.60 3.78 0.00 3.01 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 947 R 8.26 3.86 0.00 2.06 1.87 0.00 3.22 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 948 E 7.82 4.49 0.00 1.48 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.99 0.00 949 S 7.60 4.24 0.00 3.83 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *950 H 7.91 4.15 0.00 3.05 2.96 0.00 7.26 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 951 A 7.74 4.31 1.24 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 0.00 0.00 952 L 8.34 4.16 0.00 1.70 1.75 0.82 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 953 K 7.65 4.31 0.00 1.95 1.93 0.00 1.70 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.36 7.81 954 V 7.16 4.18 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 0.70 0.00 0.00 1.05 0.00 0.00 955 E 8.61 4.67 0.00 2.09 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 2.32 2.29 0.00 956 F 8.64 4.78 0.00 3.07 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 0.00 957 P 0.00 4.61 0.00 2.31 2.23 0.00 3.84 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.26 0.00 958 A 8.60 4.03 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 0.00 959 M 8.12 3.91 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.70 0.00 960 L 7.84 3.78 0.00 1.99 1.94 0.77 1.14 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 0.00 961 V 8.05 3.86 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 1.12 0.00 0.00 1.17 0.00 0.00 962 E 8.40 3.85 0.00 2.13 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 0.00 2.26 2.32 0.00 963 I 7.46 3.60 1.18 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.55 0.01 0.00 0.00 964 I 7.75 3.59 0.92 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.39 0.15 0.00 0.00 965 S 7.55 4.01 0.00 3.85 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 0.00 966 D 7.56 4.43 0.00 2.79 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 967 Q 7.99 3.89 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.48 0.00 0.00 0.00 0.00 0.00 2.47 2.76 0.00 968 L 7.72 2.46 0.00 1.11 1.31 0.87 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 969 P 0.00 4.11 0.00 2.23 2.21 0.00 3.43 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.06 0.00 970 K 7.35 4.05 0.00 1.74 1.86 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.47 1.51 7.81 971 V 8.03 3.61 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 1.25 0.00 0.00 0.99 0.00 0.00 972 E 8.25 4.19 0.00 1.99 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 2.43 2.26 0.00 973 S 7.64 4.51 0.00 4.02 3.97 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 0.00 974 G 7.93 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 0.00 0.00 0.00 975 N 8.31 4.79 0.00 2.92 2.93 0.00 0.00 6.82 7.12 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 0.00 976 A 7.95 5.11 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 977 K 9.55 4.48 0.00 1.82 1.81 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.42 7.81 978 P 0.00 4.79 0.00 1.93 1.42 0.00 3.79 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.12 0.00 979 L 8.70 4.67 0.00 1.40 1.51 1.15 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 980 Y 8.68 4.86 0.00 2.86 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 0.00 981 F 9.45 4.48 0.00 3.13 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 0.00 982 H 8.74 4.66 0.00 3.23 3.25 0.00 5.69 0.00 0.00 0.00 0.00 6.91 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.