HMDB0028916 RDKit 3D Isoleucyl-Serine 33 32 0 0 0 0 0 0 0 0999 V2000 -4.3143 -0.1947 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0523 -0.9379 -0.4682 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9938 0.0387 0.0705 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5621 0.6960 1.2599 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7581 -0.7722 0.2837 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -1.3237 -1.0316 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3809 -0.0736 0.8336 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 0.4888 1.9478 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6033 0.0082 0.1249 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7808 0.6920 0.6185 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9593 -0.2527 0.7449 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -1.2915 1.6233 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1652 1.7452 -0.3457 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4797 1.8999 -1.3827 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 2.5493 -0.0895 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0713 -0.9598 -1.0965 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0564 0.4395 -1.7284 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7214 0.4142 -0.0336 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6268 -1.4032 -1.3562 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2366 -1.7183 0.2988 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8014 0.7527 -0.7542 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2210 0.0146 1.8726 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8809 1.1724 1.9496 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2702 1.5002 0.9022 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0412 -1.6344 0.9436 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1579 -0.5815 -1.6983 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3607 -1.9988 -0.8821 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6917 -0.4482 -0.8254 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5499 1.1171 1.6084 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8720 0.2863 1.0612 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1987 -0.7187 -0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 -1.7954 1.3288 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9186 2.2897 0.6491 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 3 5 1 0 5 6 1 0 5 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 10 13 1 0 13 14 2 0 13 15 1 0 1 16 1 0 1 17 1 0 1 18 1 0 2 19 1 0 2 20 1 0 3 21 1 0 4 22 1 0 4 23 1 0 4 24 1 0 5 25 1 0 6 26 1 0 6 27 1 0 9 28 1 0 10 29 1 0 11 30 1 0 11 31 1 0 12 32 1 0 15 33 1 0 M END