| 6d40_ligand | |
| -I-interpret- | |
| 216223 0 0 0 0 0 0 0 0999 V2000 | |
| 58.6280 15.7660 115.7360 N 0 0 0 0 0 | |
| 59.5800 16.1220 114.7020 C 0 0 0 0 0 | |
| 59.0120 16.0100 113.3000 C 0 0 0 0 0 | |
| 59.5540 16.5880 112.3590 O 0 0 0 0 0 | |
| 57.9200 15.2610 113.1620 N 0 0 0 0 0 | |
| 57.2880 15.0950 111.8570 C 0 0 0 0 0 | |
| 56.6960 16.4110 111.3800 C 0 0 0 0 0 | |
| 56.0280 17.1250 112.1310 O 0 0 0 0 0 | |
| 56.1520 14.0730 111.9350 C 0 0 0 0 0 | |
| 56.5680 12.6500 112.2550 C 0 0 0 0 0 | |
| 55.4920 11.6710 111.7950 C 0 0 0 0 0 | |
| 54.1920 11.9740 112.3890 N 0 0 0 0 0 | |
| 53.0610 12.0880 111.7010 C 0 0 0 0 0 | |
| 53.0630 11.9140 110.3830 N 0 0 0 0 0 | |
| 51.9250 12.3670 112.3340 N 0 0 0 0 0 | |
| 56.9190 16.7260 110.1110 N 0 0 0 0 0 | |
| 56.2410 17.8550 109.4930 C 0 0 0 0 0 | |
| 55.6530 17.3960 108.1720 C 0 0 0 0 0 | |
| 56.3590 16.8110 107.3430 O 0 0 0 0 0 | |
| 57.1850 19.0380 109.2600 C 0 0 0 0 0 | |
| 57.6910 19.9000 110.7540 S 0 0 0 0 0 | |
| 54.3590 17.6350 107.9990 N 0 0 0 0 0 | |
| 53.7260 17.4150 106.7070 C 0 0 0 0 0 | |
| 54.1240 18.5520 105.7790 C 0 0 0 0 0 | |
| 54.2350 19.7040 106.2010 O 0 0 0 0 0 | |
| 52.2070 17.3340 106.8840 C 0 0 0 0 0 | |
| 51.7740 16.0440 107.5620 C 0 0 0 0 0 | |
| 51.7350 15.9440 108.9450 C 0 0 0 0 0 | |
| 51.4320 14.9190 106.8210 C 0 0 0 0 0 | |
| 51.3640 14.7660 109.5700 C 0 0 0 0 0 | |
| 51.0570 13.7310 107.4420 C 0 0 0 0 0 | |
| 51.0210 13.6670 108.8250 C 0 0 0 0 0 | |
| 50.6580 12.5120 109.4890 O 0 0 0 0 0 | |
| 54.3530 18.2180 104.5050 N 0 0 0 0 0 | |
| 55.0260 19.1120 103.5520 C 0 0 0 0 0 | |
| 54.0880 20.0480 102.7870 C 0 0 0 0 0 | |
| 54.2940 20.3060 101.5970 O 0 0 0 0 0 | |
| 55.9040 18.2870 102.6110 C 0 0 0 0 0 | |
| 57.0720 17.6430 103.3670 C 0 0 0 0 0 | |
| 57.8420 16.6300 102.5350 C 0 0 0 0 0 | |
| 59.0700 16.1250 103.3110 C 0 0 0 0 0 | |
| 59.7560 15.0450 102.5460 N 0 3 0 0 0 | |
| 53.0470 20.5620 103.4370 N 0 0 0 0 0 | |
| 52.2070 21.6160 102.8920 C 0 0 0 0 0 | |
| 52.8290 22.9900 103.1540 C 0 0 0 0 0 | |
| 53.8400 23.1240 103.8550 O 0 0 0 0 0 | |
| 50.8210 21.5530 103.5350 C 0 0 0 0 0 | |
| 50.9390 21.4710 104.9580 O 0 0 0 0 0 | |
| 52.2110 24.0260 102.5860 N 0 0 0 0 0 | |
| 52.5070 25.4160 102.9100 C 0 0 0 0 0 | |
| 51.2640 26.0150 103.5700 C 0 0 0 0 0 | |
| 50.2300 26.1650 102.9060 O 0 0 0 0 0 | |
| 52.9090 26.2400 101.6780 C 0 0 0 0 0 | |
| 54.2190 25.7250 101.0730 C 0 0 0 0 0 | |
| 53.0630 27.7140 102.0540 C 0 0 0 0 0 | |
| 54.5610 26.3850 99.7520 C 0 0 0 0 0 | |
| 51.3110 26.3760 104.8630 N 0 0 0 0 0 | |
| 52.4300 26.1710 105.7870 C 0 0 0 0 0 | |
| 52.5120 24.7090 106.2180 C 0 0 0 0 0 | |
| 51.5180 23.9850 106.0890 O 0 0 0 0 0 | |
| 52.0630 27.0670 106.9780 C 0 0 0 0 0 | |
| 50.5780 27.1150 106.9610 C 0 0 0 0 0 | |
| 50.1880 27.0840 105.5020 C 0 0 0 0 0 | |
| 53.6790 24.2700 106.6820 N 0 0 0 0 0 | |
| 53.7920 22.8950 107.1720 C 0 0 0 0 0 | |
| 52.9430 22.7020 108.4160 C 0 0 0 0 0 | |
| 52.6830 23.6380 109.1750 O 0 0 0 0 0 | |
| 55.2830 22.7580 107.5010 C 0 0 0 0 0 | |
| 55.7310 24.1690 107.7760 C 0 0 0 0 0 | |
| 54.9550 25.0000 106.7860 C 0 0 0 0 0 | |
| 52.4880 21.4680 108.6030 N 0 0 0 0 0 | |
| 51.8250 21.0410 109.8300 C 0 0 0 0 0 | |
| 52.8240 20.1660 110.5720 C 0 0 0 0 0 | |
| 53.2320 19.1150 110.0650 O 0 0 0 0 0 | |
| 50.5230 20.2810 109.5250 C 0 0 0 0 0 | |
| 49.5820 21.1650 108.6920 C 0 0 0 0 0 | |
| 49.8640 19.7900 110.8090 C 0 0 0 0 0 | |
| 48.5350 20.4060 107.8950 C 0 0 0 0 0 | |
| 53.2360 20.6030 111.7620 N 0 0 0 0 0 | |
| 54.3440 19.9740 112.4660 C 0 0 0 0 0 | |
| 53.9040 19.4210 113.8130 C 0 0 0 0 0 | |
| 52.9370 19.8900 114.4210 O 0 0 0 0 0 | |
| 55.5210 20.9420 112.6410 C 0 0 0 0 0 | |
| 56.3100 21.3790 111.0710 S 0 0 0 0 0 | |
| 54.6470 18.4290 114.2800 N 0 0 0 0 0 | |
| 54.3300 17.6980 115.4960 C 0 0 0 0 0 | |
| 55.5270 17.6690 116.4300 C 0 0 0 0 0 | |
| 56.6720 17.8350 115.9980 O 0 0 0 0 0 | |
| 53.8980 16.2680 115.1350 C 0 0 0 0 0 | |
| 52.6180 16.2170 114.3600 C 0 0 0 0 0 | |
| 52.6100 16.4460 112.9930 C 0 0 0 0 0 | |
| 51.4160 15.9720 114.9970 C 0 0 0 0 0 | |
| 51.4290 16.4210 112.2810 C 0 0 0 0 0 | |
| 50.2310 15.9390 114.2800 C 0 0 0 0 0 | |
| 50.2370 16.1630 112.9300 C 0 0 0 0 0 | |
| 55.2900 17.4750 117.7300 N 0 0 0 0 0 | |
| 56.4000 17.5290 118.6960 C 0 0 0 0 0 | |
| 57.4900 16.5010 118.4470 C 0 0 0 0 0 | |
| 58.6220 16.7050 118.9040 O 0 0 0 0 0 | |
| 55.7070 17.3020 120.0490 C 0 0 0 0 0 | |
| 54.2710 17.6540 119.8080 C 0 0 0 0 0 | |
| 53.9900 17.2730 118.3860 C 0 0 0 0 0 | |
| 57.1940 15.4110 117.7410 N 0 0 0 0 0 | |
| 58.1780 14.3550 117.5110 C 0 0 0 0 0 | |
| 58.9870 14.5890 116.2320 C 0 0 0 0 0 | |
| 59.9020 13.8230 115.9200 O 0 0 0 0 0 | |
| 57.4990 12.9810 117.4650 C 0 0 0 0 0 | |
| 56.9520 12.6370 116.0860 C 0 0 0 0 0 | |
| 56.3790 13.5250 115.4130 O 0 0 0 0 0 | |
| 57.1000 11.4680 115.6720 O 0 0 0 0 0 | |
| 58.7340 15.5470 115.4970 O 0 0 0 0 0 | |
| 60.5501 16.5616 114.4701 H 0 0 0 0 0 | |
| 57.5203 14.7977 113.9781 H 0 0 0 0 0 | |
| 58.0559 14.7525 111.1634 H 0 0 0 0 0 | |
| 55.6932 14.0455 110.9466 H 0 0 0 0 0 | |
| 55.5025 14.3951 112.7490 H 0 0 0 0 0 | |
| 56.7035 12.5513 113.3320 H 0 0 0 0 0 | |
| 57.5001 12.4254 111.7366 H 0 0 0 0 0 | |
| 55.7855 10.6686 112.1066 H 0 0 0 0 0 | |
| 55.3997 11.7480 110.7116 H 0 0 0 0 0 | |
| 54.1498 12.1069 113.3994 H 0 0 0 0 0 | |
| 53.9332 11.6928 109.8991 H 0 0 0 0 0 | |
| 51.0547 12.4476 111.8082 H 0 0 0 0 0 | |
| 51.9241 12.5004 113.3452 H 0 0 0 0 0 | |
| 57.5740 16.1697 109.5616 H 0 0 0 0 0 | |
| 55.4574 18.2002 110.1674 H 0 0 0 0 0 | |
| 56.6454 19.7584 108.6452 H 0 0 0 0 0 | |
| 58.0897 18.6370 108.8030 H 0 0 0 0 0 | |
| 53.8011 17.9772 108.7814 H 0 0 0 0 0 | |
| 54.0549 16.4725 106.2692 H 0 0 0 0 0 | |
| 51.7488 17.3672 105.8955 H 0 0 0 0 0 | |
| 51.8945 18.1680 107.5123 H 0 0 0 0 0 | |
| 52.0016 16.8097 109.5512 H 0 0 0 0 0 | |
| 51.4579 14.9679 105.7324 H 0 0 0 0 0 | |
| 51.3444 14.7117 110.6585 H 0 0 0 0 0 | |
| 50.7938 12.8581 106.8446 H 0 0 0 0 0 | |
| 50.4453 11.8294 108.8484 H 0 0 0 0 0 | |
| 54.0468 17.3011 104.1795 H 0 0 0 0 0 | |
| 55.6501 19.7858 104.1391 H 0 0 0 0 0 | |
| 56.3076 18.9469 101.8430 H 0 0 0 0 0 | |
| 55.2960 17.4968 102.1705 H 0 0 0 0 0 | |
| 56.6574 17.1161 104.2264 H 0 0 0 0 0 | |
| 57.7649 18.4383 103.6416 H 0 0 0 0 0 | |
| 58.1750 17.1064 101.6129 H 0 0 0 0 0 | |
| 57.1908 15.7852 102.3106 H 0 0 0 0 0 | |
| 58.7452 15.7289 104.2731 H 0 0 0 0 0 | |
| 59.7635 16.9529 103.4582 H 0 0 0 0 0 | |
| 60.5673 14.7202 103.0719 H 0 0 0 0 0 | |
| 59.1098 14.2690 102.4018 H 0 0 0 0 0 | |
| 60.0586 15.4094 101.6426 H 0 0 0 0 0 | |
| 52.8273 20.1983 104.3643 H 0 0 0 0 0 | |
| 52.1204 21.4697 101.8153 H 0 0 0 0 0 | |
| 50.2982 20.6693 103.1692 H 0 0 0 0 0 | |
| 50.2660 22.4543 103.2747 H 0 0 0 0 0 | |
| 50.0630 21.4321 105.3489 H 0 0 0 0 0 | |
| 51.4926 23.8357 101.8873 H 0 0 0 0 0 | |
| 53.3635 25.4449 103.5836 H 0 0 0 0 0 | |
| 52.1189 26.1360 100.9343 H 0 0 0 0 0 | |
| 54.1030 24.6567 100.8903 H 0 0 0 0 0 | |
| 55.0211 25.9523 101.7752 H 0 0 0 0 0 | |
| 52.1159 28.0898 102.4411 H 0 0 0 0 0 | |
| 53.8344 27.8142 102.8175 H 0 0 0 0 0 | |
| 53.3481 28.2851 101.1705 H 0 0 0 0 0 | |
| 53.7648 26.1908 99.0334 H 0 0 0 0 0 | |
| 54.6641 27.4599 99.9003 H 0 0 0 0 0 | |
| 55.4992 25.9772 99.3757 H 0 0 0 0 0 | |
| 53.3994 26.4103 105.3499 H 0 0 0 0 0 | |
| 52.5056 28.0596 106.8951 H 0 0 0 0 0 | |
| 52.4491 26.6754 107.9191 H 0 0 0 0 0 | |
| 50.2024 28.0110 107.4552 H 0 0 0 0 0 | |
| 50.1457 26.2766 107.5072 H 0 0 0 0 0 | |
| 49.2315 26.5888 105.3348 H 0 0 0 0 0 | |
| 50.0323 28.0807 105.0891 H 0 0 0 0 0 | |
| 53.4463 22.1521 106.4532 H 0 0 0 0 0 | |
| 55.8438 22.2995 106.6865 H 0 0 0 0 0 | |
| 55.4581 22.0977 108.3504 H 0 0 0 0 0 | |
| 56.8082 24.2895 107.6607 H 0 0 0 0 0 | |
| 55.5392 24.4691 108.8062 H 0 0 0 0 0 | |
| 54.8287 26.0346 107.1052 H 0 0 0 0 0 | |
| 55.4640 25.1062 105.8280 H 0 0 0 0 0 | |
| 52.6079 20.7870 107.8532 H 0 0 0 0 0 | |
| 51.5331 21.8971 110.4383 H 0 0 0 0 0 | |
| 50.7579 19.3955 108.9344 H 0 0 0 0 0 | |
| 50.2031 21.6979 107.9720 H 0 0 0 0 0 | |
| 49.0447 21.8038 109.3929 H 0 0 0 0 0 | |
| 50.5461 19.1203 111.3328 H 0 0 0 0 0 | |
| 49.6306 20.6435 111.4454 H 0 0 0 0 0 | |
| 48.9458 19.2563 110.5635 H 0 0 0 0 0 | |
| 49.0303 19.7295 107.1985 H 0 0 0 0 0 | |
| 47.9070 19.8321 108.5765 H 0 0 0 0 0 | |
| 47.9191 21.1137 107.3401 H 0 0 0 0 0 | |
| 52.7627 21.3986 112.1903 H 0 0 0 0 0 | |
| 54.6816 19.1399 111.8508 H 0 0 0 0 0 | |
| 56.2678 20.4501 113.2642 H 0 0 0 0 0 | |
| 55.1356 21.8587 113.0873 H 0 0 0 0 0 | |
| 55.4839 18.1646 113.7602 H 0 0 0 0 0 | |
| 53.5119 18.2020 116.0107 H 0 0 0 0 0 | |
| 53.7419 15.7247 116.0670 H 0 0 0 0 0 | |
| 54.6795 15.8342 114.5112 H 0 0 0 0 0 | |
| 53.5475 16.6481 112.4749 H 0 0 0 0 0 | |
| 51.4003 15.8031 116.0737 H 0 0 0 0 0 | |
| 51.4361 16.6047 111.2066 H 0 0 0 0 0 | |
| 49.2912 15.7340 114.7927 H 0 0 0 0 0 | |
| 49.3034 16.1379 112.3680 H 0 0 0 0 0 | |
| 56.9356 18.4760 118.6297 H 0 0 0 0 0 | |
| 56.1473 17.9122 120.8376 H 0 0 0 0 0 | |
| 55.8201 16.2747 120.3953 H 0 0 0 0 0 | |
| 54.0892 18.7153 119.9774 H 0 0 0 0 0 | |
| 53.6123 17.1259 120.4975 H 0 0 0 0 0 | |
| 53.6190 16.2530 118.2861 H 0 0 0 0 0 | |
| 53.1927 17.8662 117.9381 H 0 0 0 0 0 | |
| 56.2569 15.3107 117.3510 H 0 0 0 0 0 | |
| 58.8742 14.3796 118.3494 H 0 0 0 0 0 | |
| 56.6602 13.0004 118.1608 H 0 0 0 0 0 | |
| 58.2466 12.2311 117.7235 H 0 0 0 0 0 | |
| 56.3711 14.3464 115.9099 H 0 0 0 0 0 | |
| 1 2 1 0 0 0 | |
| 1105 1 0 0 0 | |
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| M END | |
| $$$$ | |