NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 878 Y 4.7670 8.1449 121.7095 58.0960 39.3513 174.1964 879 H 5.1589 8.6964 115.8061 53.6551 30.7286 172.9427 880 Q 4.6147 9.2752 122.1553 54.5206 33.0722 173.6812 881 S 4.9751 8.6366 119.7710 57.8498 63.8800 172.5116 882 Y 4.7736 8.9997 121.7099 56.6232 41.5427 175.8961 883 D 4.7513 9.0270 120.0911 55.5315 42.7985 176.6434 884 C 4.8510 7.8582 118.1947 57.6755 32.4905 172.0906 885 V 4.5837 9.0453 123.3234 60.5540 34.7083 173.2730 886 C 5.0260 8.7270 128.1647 58.2248 32.8995 172.2620 887 V 4.7182 8.7816 127.3340 61.6046 33.6635 174.1924 888 M 5.2869 8.7390 125.9296 53.8123 35.9730 173.6641 889 F 5.1735 9.3780 123.9030 55.6179 42.5006 173.9600 890 A 5.0237 9.3129 126.3983 50.4907 20.9985 175.4360 891 S 4.8772 9.0254 117.9765 58.2579 65.7192 174.1022 892 I 5.2280 7.5433 122.9139 58.4598 36.3423 174.6705 893 P 4.3114 0.0000 0.0000 65.4730 31.5860 178.0990 894 D 4.7192 8.2456 117.3656 55.4448 41.6970 177.9672 895 F 4.2717 8.7601 122.3726 61.1540 39.0910 176.5089 896 K 3.9420 8.3752 117.8615 59.8739 31.9269 177.7200 897 E 4.1516 8.1868 117.8186 58.8453 29.7727 177.9309 898 F 4.3565 7.7827 120.3398 59.7485 39.6370 174.8786 899 Y 3.8196 7.3106 120.6102 57.2002 39.0570 174.5825 900 T 4.2545 7.0028 115.3521 60.0758 71.8893 172.4176 901 E 4.7126 8.2772 121.3816 54.6118 31.5148 175.6420 902 S 4.6830 8.2570 117.1479 56.2958 66.2966 174.8286 903 D 4.4801 8.5728 120.7842 57.3312 40.8431 178.4620 904 V 3.7151 7.7865 118.3718 65.2467 31.9616 175.9963 905 N 4.7346 8.2683 115.9696 51.8668 37.5298 175.0557 906 K 3.6659 8.5681 115.7906 58.5267 29.8357 174.7401 907 E 3.7636 9.3971 111.6094 57.6302 27.6311 176.4385 908 G 3.8889 9.3304 107.5627 45.1837 0.0000 175.5820 909 L 4.0641 7.7155 121.6999 58.2368 41.5404 178.6397 910 E 4.1422 8.2766 118.3958 59.2288 29.4169 178.9981 911 C 4.5615 8.0786 116.7059 62.7073 28.4181 175.8013 912 L 4.3024 8.3307 120.6777 57.5482 41.0173 179.4872 913 R 3.9534 8.0935 119.1706 59.3115 30.0268 178.3463 914 L 4.0544 7.9377 119.6300 58.0092 42.0312 178.6886 915 L 3.6394 8.1214 120.2849 57.8310 41.9203 178.4708 916 N 4.2364 8.1156 117.2924 56.4594 38.7475 176.8459 917 E 3.9266 7.8524 120.1821 59.1961 29.5868 179.2264 918 I 3.3027 7.4807 119.7511 64.4218 37.1844 178.5284 919 I 3.4815 7.6284 120.5139 64.2364 36.8762 178.4498 920 A 4.0252 7.8518 121.5594 55.3103 18.0051 179.4476 921 D 4.3658 8.0422 116.6194 57.5354 40.9918 178.7724 922 F 4.4219 8.1989 118.4454 60.4852 38.8164 177.5484 923 D 4.5946 8.3487 118.7540 57.5213 40.3592 178.3779 924 D 4.5302 8.2949 119.0577 56.9942 40.6505 178.8353 925 L 4.1989 7.8696 120.0390 57.5169 41.3922 179.0463 926 L 4.2377 8.0364 118.1015 57.3444 41.6152 178.7525 927 S 4.4928 7.6805 112.9112 58.2310 63.6737 174.5381 928 K 4.2635 8.1078 123.6374 55.3652 32.9246 176.1513 929 P 4.2477 0.0000 0.0000 65.6198 31.3494 178.4448 930 K 4.0862 7.8271 114.4793 58.4453 32.7204 177.1247 931 F 5.3055 8.0366 118.7682 57.4200 39.5309 177.2634 932 S 4.2728 8.2118 117.5370 60.6051 62.4153 175.2978 933 G 3.7918 8.0175 108.9779 45.8318 0.0000 173.2296 934 V 3.9516 7.5310 121.0802 62.1111 31.9224 174.5001 935 E 4.4672 9.1042 129.5011 53.9606 31.3531 174.7858 936 K 4.1166 8.5303 129.5332 56.9529 32.3039 176.3620 937 I 4.0124 8.2272 129.2358 62.8294 38.1355 175.7212 938 K 4.1854 6.6254 117.9099 56.9040 35.8790 172.7961 939 T 4.7647 8.4140 109.1796 60.3522 71.6145 174.1051 940 I 4.2633 8.6136 126.8104 60.0223 38.5945 177.8036 941 G 3.8864 8.4075 119.7453 46.7761 0.0000 172.5806 942 S 4.4678 8.9409 118.6077 57.8657 63.5161 172.9508 943 T 4.9319 7.7589 118.1809 62.8774 70.5326 172.8854 944 Y 4.9438 9.0249 126.6254 56.0163 41.5637 173.8952 945 M 4.8451 8.2238 125.4659 53.6740 35.3934 174.1435 946 A 5.0591 8.4158 125.8647 51.1822 23.7989 174.0185 947 A 5.5341 8.5400 118.4144 52.1871 23.1343 175.7382 948 T 4.8690 7.7719 108.5723 59.4417 72.6060 174.7292 949 G 3.6290 8.9754 110.4407 45.7477 0.0000 174.2177 950 L 3.7358 7.4685 118.1385 55.4194 42.0999 177.4278 951 S 4.5279 7.8690 113.3107 58.2737 63.0981 174.0957 952 A 4.3436 7.5581 124.1118 51.3135 20.7530 176.9664 *963 E 4.2657 8.2830 112.6378 56.6533 30.6278 178.0499 964 R 4.0849 7.9834 118.8580 58.7619 30.7647 176.9487 965 Q 4.1216 7.9332 115.3452 57.9412 29.1019 176.5284 966 Y 4.7754 7.6766 114.3108 57.8450 38.3134 176.9527 967 M 4.1085 8.0430 121.8667 59.0413 32.3577 177.5930 968 H 4.2548 8.4618 114.7179 58.9272 28.0210 177.4362 969 I 3.7596 7.3862 122.7145 64.1570 36.9558 178.5570 970 G 3.6302 8.1919 106.5841 47.8356 0.0000 176.0448 971 T 4.1409 7.8371 117.6735 66.5889 68.6396 176.3118 972 M 4.0387 8.1141 120.3968 58.6358 32.2756 178.4316 973 V 3.5665 7.4885 118.0082 66.1290 31.6736 177.8464 974 E 4.3499 8.4247 118.1982 59.5122 29.2998 179.1411 975 F 3.4855 8.5017 120.6097 60.7098 39.4040 177.1840 976 A 3.7074 7.8268 120.3099 55.2884 18.2103 179.1812 977 Y 3.9513 7.9247 115.0707 61.1113 37.8944 178.7852 978 A 4.0714 8.0420 121.7138 55.0579 18.4132 179.6101 979 L 3.0994 7.1821 117.4529 57.5820 41.4918 179.8626 980 V 3.6390 7.4253 117.7704 65.9607 31.3760 178.3369 981 G 3.6192 7.8792 105.1509 47.7245 0.0000 175.9161 982 K 4.0725 7.9457 120.9117 59.1818 32.1483 179.3166 983 L 4.1542 8.5664 121.0733 58.1180 42.0431 178.7694 984 D 4.3963 8.4121 119.0261 56.9436 40.5786 178.4925 985 A 3.9626 7.8796 121.0151 55.2633 18.3736 179.5999 986 I 3.6816 7.7458 118.3080 64.7224 37.0567 178.2932 987 N 4.2740 8.2586 117.1025 56.3403 38.1504 177.4475 988 K 3.7215 7.6278 118.4249 59.8437 32.2125 178.6589 989 H 4.2656 7.6876 115.2643 57.3702 28.8079 176.8989 990 S 4.7900 7.9230 114.0219 56.9840 63.3340 173.7324 991 F 3.6726 7.2522 117.8737 58.9024 36.5108 174.3449 992 N 4.8495 7.4496 119.1194 52.1648 41.4878 173.2586 993 D 4.6689 7.3274 114.4662 53.0585 41.2064 175.7942 994 F 4.5803 8.5894 118.7715 57.3952 40.0068 175.8975 995 K 4.7262 8.5733 123.3994 54.4422 35.4024 175.3287 996 L 4.7383 8.1590 123.1943 54.2343 44.4351 175.4592 997 R 4.7949 8.7412 123.9078 54.8288 32.9046 173.8128 998 V 4.8626 8.4773 126.6884 61.1861 34.3440 174.7129 999 G 4.5480 9.2580 113.4970 44.6329 0.0000 171.4498 1000 I 5.2853 8.7416 125.1326 59.7664 41.4975 174.0461 1001 N 5.3699 9.2331 123.2196 52.8085 43.0896 172.2513 1002 H 5.9489 7.9866 115.5242 53.8638 31.8320 174.6112 1003 G 3.8071 8.2310 104.8602 45.2046 0.0000 169.4498 1004 P 5.1428 0.0000 0.0000 62.3058 32.1977 176.3414 1005 V 4.8032 8.4163 115.3788 60.0318 37.1807 173.8244 1006 I 5.0592 8.8063 121.5169 59.7601 40.1344 174.7730 1007 A 4.8547 9.5816 129.3222 49.4409 21.5360 177.0168 1008 G 4.3458 6.9416 106.8157 46.2588 0.0000 171.2249 1009 V 4.9262 8.2926 120.3005 61.0255 34.4503 175.6140 1010 I 4.5246 8.7266 119.0502 59.3396 40.7558 174.7904 1011 G 3.8322 9.3222 105.2448 44.4486 0.0000 172.9816 1012 A 4.6429 8.2413 118.5188 51.6310 20.8187 177.1196 1013 Q 4.3211 7.8522 113.7013 56.5396 29.8706 175.5538 1014 K 4.6808 7.4571 118.9475 53.2682 35.4476 175.3141 1015 P 4.5256 0.0000 0.0000 62.1694 29.2748 173.8441 1016 Q 4.5598 8.0726 119.3518 53.5948 30.2308 175.0956 1017 Y 4.5809 8.5166 125.2704 57.9038 39.8130 174.1642 1018 D 4.2798 8.2166 124.8555 52.7217 45.5771 173.3265 1019 I 4.5406 6.9410 113.3877 58.5939 40.4897 174.6167 1020 W 5.0174 9.8243 123.0486 54.9677 33.9240 173.9610 1021 G 4.6592 9.1161 106.6920 43.1156 0.0000 174.0790 1022 N 4.2824 8.7389 118.9292 56.9972 38.7243 176.9488 1023 T 3.8523 7.9428 116.5386 66.8011 68.6996 176.4971 1024 V 3.7142 7.7783 119.4860 65.9484 31.6214 177.6772 1025 N 4.2792 8.0869 116.2735 56.3572 38.3459 177.5903 1026 V 3.5666 8.0546 119.5382 65.7954 31.5492 177.7356 1027 A 4.0361 8.0721 120.6507 55.4135 18.1538 179.5961 1028 S 3.3357 7.8169 110.9890 61.3023 62.3397 176.6346 1029 R 4.2365 7.7933 122.0931 58.9026 29.5248 178.8867 1030 M 4.0929 8.0347 118.0689 57.8404 32.0263 177.9686 1031 D 4.5399 7.5883 117.1600 57.0727 41.8753 178.5569 1032 S 4.1976 8.3110 114.8539 60.5042 62.5059 175.3933 1033 T 4.4426 7.6775 110.9864 61.1920 68.9061 174.7796 1034 G 4.1282 7.9334 112.3271 45.0013 0.0000 173.3707 1035 V 4.4876 7.9995 116.8649 60.3209 34.5707 175.5388 1036 L 4.2733 8.3342 125.2027 56.4643 41.8617 177.0847 1037 D 4.5691 9.3325 121.8021 54.5718 39.2718 173.6983 1038 K 4.6230 7.7064 117.7323 54.5483 36.5114 175.4944 1039 I 4.5321 8.2668 123.1769 59.8648 39.2820 174.2115 1040 Q 5.0423 9.2232 130.2883 55.2353 30.3821 175.0266 1041 V 5.4462 9.2627 119.0904 58.3652 36.3003 175.5819 1042 T 4.4709 8.3380 112.6243 60.9368 70.2032 175.2508 1043 E 3.9682 8.9815 121.8365 59.7393 29.1310 178.4745 1044 E 3.9413 8.2053 117.8672 59.9167 29.1485 179.5152 1045 T 3.9282 7.6374 114.5609 66.5416 68.3090 177.0199 1046 S 4.0039 8.0483 115.5399 61.1809 63.0577 176.4516 1047 L 3.9576 7.6050 122.3057 57.8268 41.1905 179.4466 1048 I 3.4570 7.1868 119.1165 64.3612 36.9302 178.5898 1049 L 4.0970 7.9704 119.7619 57.5781 41.4220 179.3129 1050 Q 4.7764 8.1822 121.4657 58.6711 28.8204 177.6405 1051 T 4.1907 7.4633 107.3035 63.0878 69.1465 175.4379 1052 L 4.5838 7.5082 120.3286 54.0724 42.6649 176.5861 1053 G 4.0006 7.6957 105.7922 45.1894 0.0000 173.8255 1054 Y 4.3549 8.2922 118.3611 57.8118 39.5552 174.3572 1055 T 4.9233 8.6135 116.6832 60.6508 70.2041 172.6458 1056 C 5.5693 8.7218 123.9930 58.3162 32.4545 173.1940 1057 T 4.7598 8.8232 117.3579 61.7297 71.2527 173.1365 1058 C 3.8603 8.8235 127.3608 59.3300 31.4210 173.3194 1059 R 3.8544 8.0995 127.7618 57.5718 30.6129 175.2095 1060 G 3.5388 7.7527 103.3645 43.9473 0.0000 171.3938 1061 I 4.5816 7.9597 120.0092 60.0864 37.8686 175.7754 1062 I 4.4805 8.3619 121.1788 58.7053 40.5634 174.5875 1063 N 4.7635 8.8009 124.2161 53.4999 39.2055 173.9151 1064 V 4.1071 8.9640 128.3560 60.9415 33.2191 175.1656 1065 K 3.8298 8.7266 128.9597 58.6124 32.2197 175.2515 1066 G 4.1432 9.1978 114.4062 45.0812 0.0000 173.8515 1067 K 4.2776 7.9259 116.8828 56.6968 34.4510 176.0015 1068 G 3.8420 8.6036 105.3449 43.8532 0.0000 173.1322 1069 D 4.8392 8.5296 124.4133 54.5946 41.2853 175.8579 1070 L 4.7362 8.8040 124.6362 52.4997 44.7631 175.8409 1071 K 4.7364 8.6908 125.5952 55.9305 33.1063 175.6686 1072 T 4.8848 8.2649 116.7959 60.1388 72.6514 172.1394 1073 Y 4.9949 8.8975 118.1293 56.3524 43.0724 174.3473 1074 F 5.6095 9.1128 120.1443 55.6524 41.8927 175.2458 1075 V 4.1242 8.5819 124.7774 62.9363 31.9060 175.4718 1076 N 4.7609 9.1288 126.0036 53.4130 39.4903 175.5642 1077 T 4.5952 8.4168 117.2820 63.0654 68.9002 174.6187 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 878 Y 8.14 4.77 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 0.00 879 H 8.70 5.16 0.00 3.09 3.18 0.00 5.72 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 880 Q 9.28 4.61 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.87 0.00 0.00 0.00 0.00 0.00 1.97 2.20 0.00 881 S 8.64 4.98 0.00 3.94 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 882 Y 9.00 4.77 0.00 3.12 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 0.00 883 D 9.03 4.75 0.00 2.69 2.75 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 0.00 884 C 7.86 4.85 0.00 3.04 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 885 V 9.05 4.58 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 0.82 0.00 0.00 0.79 0.00 0.00 886 C 8.73 5.03 0.00 3.10 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 0.00 887 V 8.78 4.72 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.88 0.00 0.00 888 M 8.74 5.29 0.00 1.99 1.78 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.50 0.00 889 F 9.38 5.17 0.00 3.06 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 890 A 9.31 5.02 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 891 S 9.03 4.88 0.00 4.01 3.85 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 0.00 892 I 7.54 5.23 1.82 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 1.34 0.76 0.87 0.00 0.00 893 P 0.00 4.31 0.00 2.24 2.27 0.00 3.84 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 894 D 8.25 4.72 0.00 3.06 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 0.00 895 F 8.76 4.27 0.00 3.02 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 0.00 896 K 8.38 3.94 0.00 1.90 1.94 0.00 1.87 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.59 7.81 897 E 8.19 4.15 0.00 2.07 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 2.33 2.39 0.00 898 F 7.78 4.36 0.00 3.13 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 899 Y 7.31 3.82 0.00 2.71 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 900 T 7.00 4.25 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 1.01 0.00 0.00 901 E 8.28 4.71 0.00 1.83 1.82 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 2.10 1.96 0.00 902 S 8.26 4.68 0.00 3.86 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 903 D 8.57 4.48 0.00 2.66 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 0.00 904 V 7.79 3.72 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 0.79 0.00 0.00 0.90 0.00 0.00 905 N 8.27 4.73 0.00 2.92 2.90 0.00 0.00 7.04 6.63 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 0.00 906 K 8.57 3.67 0.00 1.98 1.90 0.00 1.83 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.44 7.81 907 E 9.40 3.76 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 908 G 9.33 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 909 L 7.72 4.06 0.00 1.82 1.71 0.97 1.18 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 0.00 910 E 8.28 4.14 0.00 2.06 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 2.48 2.51 0.00 911 C 8.08 4.56 0.00 3.32 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 0.00 912 L 8.33 4.30 0.00 1.99 1.81 1.01 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 913 R 8.09 3.95 0.00 1.96 2.19 0.00 3.13 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 914 L 7.94 4.05 0.00 2.04 2.14 0.98 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 1.00 0.00 0.00 940 I 8.61 4.26 1.94 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.88 0.93 0.00 0.00 941 G 8.41 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 942 S 8.94 4.47 0.00 3.69 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 943 T 7.76 4.93 4.50 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 944 Y 9.02 4.94 0.00 3.17 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 0.00 945 M 8.22 4.85 0.00 1.88 1.32 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.98 0.00 946 A 8.42 5.06 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 947 A 8.54 5.53 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 1.56 1.61 7.81 983 L 8.57 4.15 0.00 2.07 1.75 0.97 1.30 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 0.00 984 D 8.41 4.40 0.00 2.92 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 0.00 985 A 7.88 3.96 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 986 I 7.75 3.68 2.09 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.80 0.97 0.00 0.00 987 N 8.26 4.27 0.00 2.92 2.95 0.00 0.00 7.06 6.32 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 0.00 988 K 7.63 3.72 0.00 1.81 1.60 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.40 7.81 989 H 7.69 4.27 0.00 3.00 3.30 0.00 5.83 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 990 S 7.92 4.79 0.00 4.11 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 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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 0.00 0.00 1000 I 8.74 5.29 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.52 0.93 0.00 0.00 1001 N 9.23 5.37 0.00 2.84 2.64 0.00 0.00 6.59 8.02 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 1002 H 7.99 5.95 0.00 3.29 3.20 0.00 5.29 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1003 G 8.23 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1004 P 0.00 5.14 0.00 2.00 2.05 0.00 3.71 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.00 0.00 1005 V 8.42 4.80 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 0.75 0.00 0.00 0.89 0.00 0.00 1006 I 8.81 5.06 2.07 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.06 1.00 0.00 0.00 1007 A 9.58 4.85 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1008 G 6.94 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 0.00 0.00 0.00 0.00 1009 V 8.29 4.93 2.20 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 1.07 0.00 0.00 1.11 0.00 0.00 1010 I 8.73 4.52 1.66 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.88 0.17 0.00 0.00 1011 G 9.32 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 0.00 0.00 0.00 1012 A 8.24 4.64 1.25 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 0.00 0.00 1013 Q 7.85 4.32 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.68 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 1014 K 7.46 4.68 0.00 1.86 1.80 0.00 1.59 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.31 1.44 7.81 1015 P 0.00 4.53 0.00 2.10 2.12 0.00 3.66 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 1016 Q 8.07 4.56 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.92 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 1017 Y 8.52 4.58 0.00 2.87 2.82 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 1018 D 8.22 4.28 0.00 2.34 1.54 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 0.00 1019 I 6.94 4.54 1.60 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.50 0.45 0.00 0.00 1020 W 9.82 5.02 0.00 3.28 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 1021 G 9.12 4.66 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 1022 N 8.74 4.28 0.00 2.78 2.86 0.00 0.00 6.87 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1023 T 7.94 3.85 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 1.26 0.00 0.00 1024 V 7.78 3.71 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 1.15 0.00 0.00 0.95 0.00 0.00 1025 N 8.09 4.28 0.00 2.95 2.83 0.00 0.00 6.64 7.69 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 1026 V 8.05 3.57 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 1.09 0.00 0.00 0.99 0.00 0.00 1027 A 8.07 4.04 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1028 S 7.82 3.34 0.00 2.77 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1029 R 7.79 4.24 0.00 1.98 1.92 0.00 3.31 0.00 0.00 3.19 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.63 0.00 1030 M 8.03 4.09 0.00 2.20 2.35 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.95 0.00 1031 D 7.59 4.54 0.00 2.93 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 1032 S 8.31 4.20 0.00 4.04 4.05 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 1033 T 7.68 4.44 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 1034 G 7.93 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1035 V 8.00 4.49 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.98 0.00 0.00 1036 L 8.33 4.27 0.00 1.66 1.60 1.01 1.12 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 1037 D 9.33 4.57 0.00 2.75 2.77 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 1038 K 7.71 4.62 0.00 1.52 1.32 0.00 1.23 0.00 0.00 1.46 0.00 0.00 2.72 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.27 0.84 7.81 1039 I 8.27 4.53 1.85 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.51 0.87 0.00 0.00 1040 Q 9.22 5.04 0.00 2.38 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.69 0.00 0.00 0.00 0.00 0.00 2.22 2.08 0.00 1041 V 9.26 5.45 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 0.95 0.00 0.00 1.02 0.00 0.00 1042 T 8.34 4.47 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 1.26 0.00 0.00 1043 E 8.98 3.97 0.00 2.39 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 0.00 2.40 2.44 0.00 1044 E 8.21 3.94 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 1045 T 7.64 3.93 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 1.17 0.00 0.00 1046 S 8.05 4.00 0.00 3.53 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1047 L 7.61 3.96 0.00 1.78 1.64 0.86 0.65 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 1048 I 7.19 3.46 1.54 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.14 0.58 0.00 0.00 1049 L 7.97 4.10 0.00 1.78 1.67 0.77 0.20 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 1050 Q 8.18 4.78 0.00 2.35 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 1051 T 7.46 4.19 4.25 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 1.24 0.00 0.00 1052 L 7.51 4.58 0.00 2.03 1.91 1.06 1.07 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 1053 G 7.70 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 0.00 0.00 0.00 0.00 1054 Y 8.29 4.35 0.00 3.05 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 1055 T 8.61 4.92 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 1056 C 8.72 5.57 0.00 2.84 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1057 T 8.82 4.76 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 1.32 0.00 0.00 1058 C 8.82 3.86 0.00 2.91 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1059 R 8.10 3.85 0.00 0.84 1.54 0.00 3.33 0.00 0.00 3.07 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.23 0.00 1060 G 7.75 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 0.00 0.00 0.00 0.00 1061 I 7.96 4.58 1.83 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.44 0.91 0.00 0.00 1062 I 8.36 4.48 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.77 0.87 0.00 0.00 1063 N 8.80 4.76 0.00 2.74 2.79 0.00 0.00 6.97 7.71 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 1064 V 8.96 4.11 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.94 0.00 0.00 1065 K 8.73 3.83 0.00 1.73 1.73 0.00 1.81 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.46 7.81 1066 G 9.20 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1067 K 7.93 4.28 0.00 1.83 1.84 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.34 1.33 7.81 1068 G 8.60 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 0.00 0.00 0.00 1069 D 8.53 4.84 0.00 2.54 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1070 L 8.80 4.74 0.00 1.52 1.51 0.90 0.92 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 1071 K 8.69 4.74 0.00 1.73 1.73 0.00 1.91 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.16 1.23 7.81 1072 T 8.26 4.88 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1073 Y 8.90 4.99 0.00 2.84 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 1074 F 9.11 5.61 0.00 3.02 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 1075 V 8.58 4.12 2.16 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 0.93 0.00 0.00 0.94 0.00 0.00 1076 N 9.13 4.76 0.00 2.88 2.81 0.00 0.00 6.96 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 1077 T 8.42 4.60 4.34 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 1.31 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.