HMDB0029027 RDKit 3D Prolyl-Threonine 31 31 0 0 0 0 0 0 0 0999 V2000 -3.9039 -0.7177 0.1129 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5351 -0.6156 -0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -1.7595 -0.2566 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7907 0.5386 0.1677 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 0.6304 -0.4286 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 0.4348 0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5649 0.1882 1.6261 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0464 0.5204 -0.1695 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2351 -0.6054 -1.1844 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7386 -0.7662 -1.1623 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0369 -0.5713 0.3113 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0276 0.2919 0.8425 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5503 1.7995 -0.0282 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0318 2.7579 -0.6445 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8316 1.9032 0.4755 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8919 -0.3360 1.1429 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5948 -0.0873 -0.4886 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2537 -1.7699 0.0669 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5853 -0.3840 -1.5719 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3162 -2.4864 0.1322 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7104 0.3183 1.2379 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3535 0.8339 -1.4422 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1497 1.4986 -0.6781 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7937 -1.5110 -0.7269 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8371 -0.3594 -2.1674 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0298 -1.8039 -1.4509 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 -0.0158 -1.7879 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0698 -0.1983 0.4837 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9479 -1.5776 0.8054 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3811 1.1451 1.3073 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1955 2.7045 0.9522 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 4 13 1 0 13 14 2 0 13 15 1 0 12 8 1 0 1 16 1 0 1 17 1 0 1 18 1 0 2 19 1 0 3 20 1 0 4 21 1 0 5 22 1 0 8 23 1 0 9 24 1 0 9 25 1 0 10 26 1 0 10 27 1 0 11 28 1 0 11 29 1 0 12 30 1 0 15 31 1 0 M END