HMDB0028791 RDKit 3D Glutaminylarginine 43 42 0 0 0 0 0 0 0 0999 V2000 6.5552 0.7277 -0.0992 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4093 1.2342 -0.3623 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9898 2.4452 0.2504 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5094 0.6280 -1.2634 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 0.3827 -0.8659 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0449 -0.6781 0.2016 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6201 -0.8514 0.5728 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7651 -1.2793 -0.5798 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5916 -1.4041 -0.0004 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6464 -0.6341 -0.5444 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4229 0.1526 -1.5188 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9907 -0.7780 0.0528 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9773 -1.7052 1.1314 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4683 0.5973 0.4483 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8347 0.5814 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2121 1.9606 1.4202 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4568 2.2007 2.0138 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4341 2.9013 1.1894 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -2.5745 -1.1798 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3525 -3.5318 -1.1026 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3652 -2.7967 -1.8217 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1804 1.2155 0.5727 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9155 2.5632 1.2934 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7242 3.3061 -0.3002 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 0.3640 -2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6476 1.2917 -0.4478 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5201 0.0790 -1.7442 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6178 -0.3495 1.1121 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4771 -1.6551 -0.1421 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 0.1609 0.8847 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -1.4919 1.4742 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6998 -0.5349 -1.3898 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7432 -2.0522 0.7915 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6617 -1.1581 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3288 -1.4281 1.8968 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6850 -2.6464 0.8004 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5302 1.2551 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7658 1.0453 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7783 -0.0400 2.0133 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5595 0.1035 0.3809 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9340 3.1021 1.8668 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8992 1.4779 2.5989 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6967 -2.1866 -2.5635 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 16 18 2 0 8 19 1 0 19 20 2 0 19 21 1 0 1 22 1 0 3 23 1 0 3 24 1 0 4 25 1 0 5 26 1 0 5 27 1 0 6 28 1 0 6 29 1 0 7 30 1 0 7 31 1 0 8 32 1 6 9 33 1 0 12 34 1 6 13 35 1 0 13 36 1 0 14 37 1 0 14 38 1 0 15 39 1 0 15 40 1 0 17 41 1 0 17 42 1 0 21 43 1 0 M END