HEADER PROTEIN 24-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 24-JUN-21 0 HETATM 1 O UNK 0 -7.568 -2.187 -1.209 0.00 0.00 O+0 HETATM 2 C UNK 0 -6.548 -1.474 -1.247 0.00 0.00 C+0 HETATM 3 O UNK 0 -6.228 -0.854 -2.457 0.00 0.00 O+0 HETATM 4 C UNK 0 -5.713 -1.288 -0.083 0.00 0.00 C+0 HETATM 5 C UNK 0 -6.016 -1.894 1.115 0.00 0.00 C+0 HETATM 6 C UNK 0 -5.238 -1.733 2.243 0.00 0.00 C+0 HETATM 7 C UNK 0 -4.117 -0.919 2.114 0.00 0.00 C+0 HETATM 8 C UNK 0 -3.798 -0.305 0.925 0.00 0.00 C+0 HETATM 9 C UNK 0 -2.607 0.551 0.863 0.00 0.00 C+0 HETATM 10 O UNK 0 -1.934 0.720 1.904 0.00 0.00 O+0 HETATM 11 C UNK 0 -2.262 1.161 -0.392 0.00 0.00 C+0 HETATM 12 C UNK 0 -0.932 1.773 -0.604 0.00 0.00 C+0 HETATM 13 C UNK 0 0.199 0.858 -0.666 0.00 0.00 C+0 HETATM 14 O UNK 0 1.429 1.596 -0.905 0.00 0.00 O+0 HETATM 15 C UNK 0 2.269 0.503 -1.053 0.00 0.00 C+0 HETATM 16 N UNK 0 3.668 0.922 -1.125 0.00 0.00 N+0 HETATM 17 C UNK 0 4.102 1.904 -1.917 0.00 0.00 C+0 HETATM 18 N UNK 0 5.438 2.064 -1.766 0.00 0.00 N+0 HETATM 19 C UNK 0 5.864 1.161 -0.854 0.00 0.00 C+0 HETATM 20 C UNK 0 7.105 0.876 -0.320 0.00 0.00 C+0 HETATM 21 O UNK 0 8.135 1.510 -0.664 0.00 0.00 O+0 HETATM 22 N UNK 0 7.224 -0.093 0.586 0.00 0.00 N+0 HETATM 23 C UNK 0 6.104 -0.773 0.953 0.00 0.00 C+0 HETATM 24 N UNK 0 4.885 -0.514 0.447 0.00 0.00 N+0 HETATM 25 C UNK 0 4.732 0.458 -0.468 0.00 0.00 C+0 HETATM 26 C UNK 0 2.019 -0.319 0.171 0.00 0.00 C+0 HETATM 27 O UNK 0 2.135 -1.687 -0.073 0.00 0.00 O+0 HETATM 28 C UNK 0 0.543 0.050 0.518 0.00 0.00 C+0 HETATM 29 O UNK 0 -0.124 -1.199 0.557 0.00 0.00 O+0 HETATM 30 C UNK 0 -4.583 -0.481 -0.175 0.00 0.00 C+0 HETATM 31 H UNK 0 -5.961 0.127 -2.457 0.00 0.00 H+0 HETATM 32 H UNK 0 -6.900 -2.521 1.174 0.00 0.00 H+0 HETATM 33 H UNK 0 -5.440 -2.186 3.192 0.00 0.00 H+0 HETATM 34 H UNK 0 -3.461 -0.751 2.970 0.00 0.00 H+0 HETATM 35 H UNK 0 -2.449 0.352 -1.196 0.00 0.00 H+0 HETATM 36 H UNK 0 -3.100 1.889 -0.658 0.00 0.00 H+0 HETATM 37 H UNK 0 -0.937 2.398 -1.548 0.00 0.00 H+0 HETATM 38 H UNK 0 -0.760 2.548 0.232 0.00 0.00 H+0 HETATM 39 H UNK 0 0.158 0.195 -1.575 0.00 0.00 H+0 HETATM 40 H UNK 0 1.985 -0.065 -1.968 0.00 0.00 H+0 HETATM 41 H UNK 0 3.540 2.530 -2.610 0.00 0.00 H+0 HETATM 42 H UNK 0 8.139 -0.371 1.042 0.00 0.00 H+0 HETATM 43 H UNK 0 6.214 -1.555 1.686 0.00 0.00 H+0 HETATM 44 H UNK 0 2.638 0.009 1.013 0.00 0.00 H+0 HETATM 45 H UNK 0 2.465 -2.102 0.761 0.00 0.00 H+0 HETATM 46 H UNK 0 0.555 0.567 1.486 0.00 0.00 H+0 HETATM 47 H UNK 0 -0.484 -1.429 -0.330 0.00 0.00 H+0 HETATM 48 H UNK 0 -4.385 -0.022 -1.128 0.00 0.00 H+0 CONECT 1 2 CONECT 2 1 3 4 CONECT 3 2 31 CONECT 4 2 5 30 CONECT 5 4 6 32 CONECT 6 5 7 33 CONECT 7 6 8 34 CONECT 8 7 9 30 CONECT 9 8 10 11 CONECT 10 9 CONECT 11 9 12 35 36 CONECT 12 11 13 37 38 CONECT 13 12 14 28 39 CONECT 14 13 15 CONECT 15 14 16 26 40 CONECT 16 15 17 25 CONECT 17 16 18 41 CONECT 18 17 19 CONECT 19 18 20 25 CONECT 20 19 21 22 CONECT 21 20 CONECT 22 20 23 42 CONECT 23 22 24 43 CONECT 24 23 25 CONECT 25 24 16 19 CONECT 26 15 27 28 44 CONECT 27 26 45 CONECT 28 26 29 13 46 CONECT 29 28 47 CONECT 30 8 4 48 CONECT 31 3 CONECT 32 5 CONECT 33 6 CONECT 34 7 CONECT 35 11 CONECT 36 11 CONECT 37 12 CONECT 38 12 CONECT 39 13 CONECT 40 15 CONECT 41 17 CONECT 42 22 CONECT 43 23 CONECT 44 26 CONECT 45 27 CONECT 46 28 CONECT 47 29 CONECT 48 30 MASTER 0 0 0 0 0 0 0 0 48 0 102 0 END