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|
global_
_lib_name ?
_lib_version ?
_lib_update ?
# ------------------------------------------------
#
# --- LIST OF MONOMERS ---
#
data_comp_list
loop_
_chem_comp.id
_chem_comp.three_letter_code
_chem_comp.name
_chem_comp.group
_chem_comp.number_atoms_all
_chem_comp.number_atoms_nh
_chem_comp.desc_level
S44 S44 '"(2S)-2-(4-propoxy-3-{[({4-[(3S,5S,7' non-polymer 77 37 .
# ------------------------------------------------------
# ------------------------------------------------------
#
# --- DESCRIPTION OF MONOMERS ---
#
data_comp_S44
#
loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.partial_charge
_chem_comp_atom.x
_chem_comp_atom.y
_chem_comp_atom.z
S44 O36 O O 0.000 0.000 0.000 0.000
S44 C13 C C 0.000 -1.189 -0.018 0.247
S44 C14 C CR6 0.000 -2.174 -0.045 -0.855
S44 C19 C CR16 0.000 -3.541 -0.072 -0.573
S44 H19 H H 0.000 -3.884 -0.077 0.454
S44 C18 C CR16 0.000 -4.454 -0.093 -1.607
S44 H18 H H 0.000 -5.515 -0.105 -1.390
S44 C17 C CR6 0.000 -4.018 -0.097 -2.920
S44 C20 C CT 0.000 -5.022 -0.126 -4.044
S44 C26 C CH2 0.000 -4.845 1.119 -4.916
S44 H26 H H 0.000 -3.834 1.133 -5.329
S44 H26A H H 0.000 -5.001 2.014 -4.310
S44 C27 C CH1 0.000 -5.863 1.091 -6.058
S44 H27 H H 0.000 -5.736 1.984 -6.685
S44 C28 C CH2 0.000 -5.644 -0.163 -6.907
S44 H28 H H 0.000 -4.635 -0.149 -7.323
S44 H28A H H 0.000 -6.372 -0.182 -7.721
S44 C24 C CH1 0.000 -5.821 -1.408 -6.034
S44 H24 H H 0.000 -5.664 -2.308 -6.643
S44 C25 C CH2 0.000 -4.802 -1.380 -4.893
S44 H25A H H 0.000 -3.792 -1.367 -5.309
S44 H25 H H 0.000 -4.927 -2.268 -4.272
S44 C23 C CH2 0.000 -7.237 -1.426 -5.453
S44 H23A H H 0.000 -7.363 -2.314 -4.831
S44 H23 H H 0.000 -7.964 -1.447 -6.268
S44 C29 C CH2 0.000 -7.279 1.072 -5.477
S44 H29 H H 0.000 -8.005 1.054 -6.292
S44 H29A H H 0.000 -7.435 1.968 -4.872
S44 C22 C CH1 0.000 -7.456 -0.172 -4.605
S44 H22 H H 0.000 -8.473 -0.186 -4.188
S44 C21 C CH2 0.000 -6.438 -0.144 -3.464
S44 H21A H H 0.000 -6.565 -1.031 -2.840
S44 H21 H H 0.000 -6.596 0.751 -2.858
S44 C16 C CR16 0.000 -2.665 -0.077 -3.206
S44 H16 H H 0.000 -2.330 -0.082 -4.236
S44 C15 C CR16 0.000 -1.740 -0.051 -2.182
S44 H15 H H 0.000 -0.681 -0.036 -2.407
S44 N35 N NH1 0.000 -1.611 -0.013 1.528
S44 HN35 H H 0.000 -2.600 -0.028 1.734
S44 C12 C CH2 0.000 -0.635 0.015 2.621
S44 H12 H H 0.000 -0.024 0.917 2.539
S44 H12A H H 0.000 0.007 -0.866 2.557
S44 C8 C CR6 0.000 -1.360 0.015 3.941
S44 C7 C CR16 0.000 -1.532 1.198 4.636
S44 H7 H H 0.000 -1.144 2.124 4.231
S44 C9 C CR6 0.000 -1.858 -1.171 4.461
S44 O37 O O2 0.000 -1.692 -2.335 3.780
S44 C30 C CH2 0.000 -2.230 -3.517 4.375
S44 H30 H H 0.000 -3.308 -3.402 4.503
S44 H30A H H 0.000 -1.764 -3.677 5.350
S44 C31 C CH2 0.000 -1.947 -4.718 3.469
S44 H31 H H 0.000 -0.868 -4.832 3.342
S44 H31A H H 0.000 -2.412 -4.556 2.495
S44 C32 C CH3 0.000 -2.523 -5.984 4.107
S44 H32B H H 0.000 -2.072 -6.144 5.053
S44 H32A H H 0.000 -3.570 -5.877 4.232
S44 H32 H H 0.000 -2.329 -6.819 3.482
S44 C10 C CR16 0.000 -2.526 -1.167 5.678
S44 H10 H H 0.000 -2.918 -2.091 6.084
S44 C11 C CR16 0.000 -2.689 0.017 6.370
S44 H11 H H 0.000 -3.203 0.019 7.324
S44 C6 C CR6 0.000 -2.197 1.199 5.848
S44 C5 C CH2 0.000 -2.382 2.490 6.603
S44 H5 H H 0.000 -1.486 3.105 6.498
S44 H5A H H 0.000 -2.551 2.272 7.660
S44 C2 C CH1 0.000 -3.587 3.243 6.038
S44 H2 H H 0.000 -3.476 3.347 4.949
S44 C1 C C 0.000 -4.848 2.476 6.343
S44 O34 O OC -0.500 -4.786 1.396 6.972
S44 O33 O OC -0.500 -5.956 2.919 5.967
S44 C3 C CH2 0.000 -3.667 4.631 6.677
S44 H3 H H 0.000 -3.672 4.531 7.765
S44 H3A H H 0.000 -4.585 5.128 6.355
S44 C4 C CH3 0.000 -2.457 5.462 6.247
S44 H4B H H 0.000 -1.564 4.947 6.495
S44 H4A H H 0.000 -2.489 5.622 5.199
S44 H4 H H 0.000 -2.472 6.398 6.744
loop_
_chem_comp_tree.comp_id
_chem_comp_tree.atom_id
_chem_comp_tree.atom_back
_chem_comp_tree.atom_forward
_chem_comp_tree.connect_type
S44 O36 n/a C13 START
S44 C13 O36 N35 .
S44 C14 C13 C19 .
S44 C19 C14 C18 .
S44 H19 C19 . .
S44 C18 C19 C17 .
S44 H18 C18 . .
S44 C17 C18 C16 .
S44 C20 C17 C26 .
S44 C26 C20 C27 .
S44 H26 C26 . .
S44 H26A C26 . .
S44 C27 C26 C29 .
S44 H27 C27 . .
S44 C28 C27 C24 .
S44 H28 C28 . .
S44 H28A C28 . .
S44 C24 C28 C23 .
S44 H24 C24 . .
S44 C25 C24 H25 .
S44 H25A C25 . .
S44 H25 C25 . .
S44 C23 C24 H23 .
S44 H23A C23 . .
S44 H23 C23 . .
S44 C29 C27 C22 .
S44 H29 C29 . .
S44 H29A C29 . .
S44 C22 C29 C21 .
S44 H22 C22 . .
S44 C21 C22 H21 .
S44 H21A C21 . .
S44 H21 C21 . .
S44 C16 C17 C15 .
S44 H16 C16 . .
S44 C15 C16 H15 .
S44 H15 C15 . .
S44 N35 C13 C12 .
S44 HN35 N35 . .
S44 C12 N35 C8 .
S44 H12 C12 . .
S44 H12A C12 . .
S44 C8 C12 C9 .
S44 C7 C8 H7 .
S44 H7 C7 . .
S44 C9 C8 C10 .
S44 O37 C9 C30 .
S44 C30 O37 C31 .
S44 H30 C30 . .
S44 H30A C30 . .
S44 C31 C30 C32 .
S44 H31 C31 . .
S44 H31A C31 . .
S44 C32 C31 H32 .
S44 H32B C32 . .
S44 H32A C32 . .
S44 H32 C32 . .
S44 C10 C9 C11 .
S44 H10 C10 . .
S44 C11 C10 C6 .
S44 H11 C11 . .
S44 C6 C11 C5 .
S44 C5 C6 C2 .
S44 H5 C5 . .
S44 H5A C5 . .
S44 C2 C5 C3 .
S44 H2 C2 . .
S44 C1 C2 O33 .
S44 O34 C1 . .
S44 O33 C1 . .
S44 C3 C2 C4 .
S44 H3 C3 . .
S44 H3A C3 . .
S44 C4 C3 H4 .
S44 H4B C4 . .
S44 H4A C4 . .
S44 H4 C4 . END
S44 C6 C7 . ADD
S44 C14 C15 . ADD
S44 C20 C21 . ADD
S44 C20 C25 . ADD
S44 C22 C23 . ADD
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
S44 O33 C1 deloc 1.250 0.020
S44 O34 C1 deloc 1.250 0.020
S44 C1 C2 single 1.500 0.020
S44 C3 C2 single 1.524 0.020
S44 C2 C5 single 1.524 0.020
S44 C4 C3 single 1.513 0.020
S44 C5 C6 single 1.511 0.020
S44 C6 C7 double 1.390 0.020
S44 C6 C11 single 1.390 0.020
S44 C7 C8 single 1.390 0.020
S44 C9 C8 double 1.487 0.020
S44 C8 C12 single 1.511 0.020
S44 C10 C9 single 1.390 0.020
S44 O37 C9 single 1.370 0.020
S44 C11 C10 double 1.390 0.020
S44 C30 O37 single 1.426 0.020
S44 C31 C30 single 1.524 0.020
S44 C32 C31 single 1.513 0.020
S44 C12 N35 single 1.450 0.020
S44 N35 C13 single 1.330 0.020
S44 C13 O36 double 1.220 0.020
S44 C14 C13 single 1.500 0.020
S44 C14 C15 double 1.390 0.020
S44 C19 C14 single 1.390 0.020
S44 C15 C16 single 1.390 0.020
S44 C16 C17 double 1.390 0.020
S44 C17 C18 single 1.390 0.020
S44 C20 C17 single 1.500 0.020
S44 C18 C19 double 1.390 0.020
S44 C20 C21 single 1.524 0.020
S44 C20 C25 single 1.524 0.020
S44 C26 C20 single 1.524 0.020
S44 C21 C22 single 1.524 0.020
S44 C22 C23 single 1.524 0.020
S44 C22 C29 single 1.524 0.020
S44 C23 C24 single 1.524 0.020
S44 C25 C24 single 1.524 0.020
S44 C24 C28 single 1.524 0.020
S44 C27 C26 single 1.524 0.020
S44 C28 C27 single 1.524 0.020
S44 C29 C27 single 1.524 0.020
S44 H2 C2 single 1.099 0.020
S44 H3 C3 single 1.092 0.020
S44 H3A C3 single 1.092 0.020
S44 H4 C4 single 1.059 0.020
S44 H4A C4 single 1.059 0.020
S44 H4B C4 single 1.059 0.020
S44 H5 C5 single 1.092 0.020
S44 H5A C5 single 1.092 0.020
S44 H7 C7 single 1.083 0.020
S44 H10 C10 single 1.083 0.020
S44 H11 C11 single 1.083 0.020
S44 H30 C30 single 1.092 0.020
S44 H30A C30 single 1.092 0.020
S44 H31 C31 single 1.092 0.020
S44 H31A C31 single 1.092 0.020
S44 H32 C32 single 1.059 0.020
S44 H32A C32 single 1.059 0.020
S44 H32B C32 single 1.059 0.020
S44 H12 C12 single 1.092 0.020
S44 H12A C12 single 1.092 0.020
S44 HN35 N35 single 1.010 0.020
S44 H15 C15 single 1.083 0.020
S44 H16 C16 single 1.083 0.020
S44 H18 C18 single 1.083 0.020
S44 H19 C19 single 1.083 0.020
S44 H21 C21 single 1.092 0.020
S44 H21A C21 single 1.092 0.020
S44 H22 C22 single 1.099 0.020
S44 H23 C23 single 1.092 0.020
S44 H23A C23 single 1.092 0.020
S44 H24 C24 single 1.099 0.020
S44 H25 C25 single 1.092 0.020
S44 H25A C25 single 1.092 0.020
S44 H26 C26 single 1.092 0.020
S44 H26A C26 single 1.092 0.020
S44 H27 C27 single 1.099 0.020
S44 H28 C28 single 1.092 0.020
S44 H28A C28 single 1.092 0.020
S44 H29 C29 single 1.092 0.020
S44 H29A C29 single 1.092 0.020
loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
S44 O36 C13 C14 120.500 3.000
S44 O36 C13 N35 123.000 3.000
S44 C14 C13 N35 120.000 3.000
S44 C13 C14 C19 120.000 3.000
S44 C13 C14 C15 120.000 3.000
S44 C19 C14 C15 120.000 3.000
S44 C14 C19 H19 120.000 3.000
S44 C14 C19 C18 120.000 3.000
S44 H19 C19 C18 120.000 3.000
S44 C19 C18 H18 120.000 3.000
S44 C19 C18 C17 120.000 3.000
S44 H18 C18 C17 120.000 3.000
S44 C18 C17 C20 120.000 3.000
S44 C18 C17 C16 120.000 3.000
S44 C20 C17 C16 120.000 3.000
S44 C17 C20 C26 109.500 3.000
S44 C17 C20 C21 109.500 3.000
S44 C17 C20 C25 109.500 3.000
S44 C21 C20 C25 111.000 3.000
S44 C26 C20 C21 111.000 3.000
S44 C26 C20 C25 111.000 3.000
S44 C20 C26 H26 109.470 3.000
S44 C20 C26 H26A 109.470 3.000
S44 C20 C26 C27 111.000 3.000
S44 H26 C26 H26A 107.900 3.000
S44 H26 C26 C27 109.470 3.000
S44 H26A C26 C27 109.470 3.000
S44 C26 C27 H27 108.340 3.000
S44 C26 C27 C28 109.470 3.000
S44 C26 C27 C29 109.470 3.000
S44 H27 C27 C28 108.340 3.000
S44 H27 C27 C29 108.340 3.000
S44 C28 C27 C29 109.470 3.000
S44 C27 C28 H28 109.470 3.000
S44 C27 C28 H28A 109.470 3.000
S44 C27 C28 C24 111.000 3.000
S44 H28 C28 H28A 107.900 3.000
S44 H28 C28 C24 109.470 3.000
S44 H28A C28 C24 109.470 3.000
S44 C28 C24 H24 108.340 3.000
S44 C28 C24 C25 109.470 3.000
S44 C28 C24 C23 109.470 3.000
S44 H24 C24 C25 108.340 3.000
S44 H24 C24 C23 108.340 3.000
S44 C25 C24 C23 109.470 3.000
S44 C24 C25 H25A 109.470 3.000
S44 C24 C25 H25 109.470 3.000
S44 C24 C25 C20 111.000 3.000
S44 H25A C25 H25 107.900 3.000
S44 H25A C25 C20 109.470 3.000
S44 H25 C25 C20 109.470 3.000
S44 C24 C23 H23A 109.470 3.000
S44 C24 C23 H23 109.470 3.000
S44 C24 C23 C22 111.000 3.000
S44 H23A C23 H23 107.900 3.000
S44 H23A C23 C22 109.470 3.000
S44 H23 C23 C22 109.470 3.000
S44 C27 C29 H29 109.470 3.000
S44 C27 C29 H29A 109.470 3.000
S44 C27 C29 C22 111.000 3.000
S44 H29 C29 H29A 107.900 3.000
S44 H29 C29 C22 109.470 3.000
S44 H29A C29 C22 109.470 3.000
S44 C29 C22 H22 108.340 3.000
S44 C29 C22 C21 109.470 3.000
S44 C29 C22 C23 109.470 3.000
S44 H22 C22 C21 108.340 3.000
S44 H22 C22 C23 108.340 3.000
S44 C21 C22 C23 109.470 3.000
S44 C22 C21 H21A 109.470 3.000
S44 C22 C21 H21 109.470 3.000
S44 C22 C21 C20 111.000 3.000
S44 H21A C21 H21 107.900 3.000
S44 H21A C21 C20 109.470 3.000
S44 H21 C21 C20 109.470 3.000
S44 C17 C16 H16 120.000 3.000
S44 C17 C16 C15 120.000 3.000
S44 H16 C16 C15 120.000 3.000
S44 C16 C15 H15 120.000 3.000
S44 C16 C15 C14 120.000 3.000
S44 H15 C15 C14 120.000 3.000
S44 C13 N35 HN35 120.000 3.000
S44 C13 N35 C12 121.500 3.000
S44 HN35 N35 C12 118.500 3.000
S44 N35 C12 H12 109.470 3.000
S44 N35 C12 H12A 109.470 3.000
S44 N35 C12 C8 109.500 3.000
S44 H12 C12 H12A 107.900 3.000
S44 H12 C12 C8 109.470 3.000
S44 H12A C12 C8 109.470 3.000
S44 C12 C8 C7 120.000 3.000
S44 C12 C8 C9 120.000 3.000
S44 C7 C8 C9 120.000 3.000
S44 C8 C7 H7 120.000 3.000
S44 C8 C7 C6 120.000 3.000
S44 H7 C7 C6 120.000 3.000
S44 C8 C9 O37 120.000 3.000
S44 C8 C9 C10 120.000 3.000
S44 O37 C9 C10 120.000 3.000
S44 C9 O37 C30 120.000 3.000
S44 O37 C30 H30 109.470 3.000
S44 O37 C30 H30A 109.470 3.000
S44 O37 C30 C31 109.470 3.000
S44 H30 C30 H30A 107.900 3.000
S44 H30 C30 C31 109.470 3.000
S44 H30A C30 C31 109.470 3.000
S44 C30 C31 H31 109.470 3.000
S44 C30 C31 H31A 109.470 3.000
S44 C30 C31 C32 111.000 3.000
S44 H31 C31 H31A 107.900 3.000
S44 H31 C31 C32 109.470 3.000
S44 H31A C31 C32 109.470 3.000
S44 C31 C32 H32B 109.470 3.000
S44 C31 C32 H32A 109.470 3.000
S44 C31 C32 H32 109.470 3.000
S44 H32B C32 H32A 109.470 3.000
S44 H32B C32 H32 109.470 3.000
S44 H32A C32 H32 109.470 3.000
S44 C9 C10 H10 120.000 3.000
S44 C9 C10 C11 120.000 3.000
S44 H10 C10 C11 120.000 3.000
S44 C10 C11 H11 120.000 3.000
S44 C10 C11 C6 120.000 3.000
S44 H11 C11 C6 120.000 3.000
S44 C11 C6 C5 120.000 3.000
S44 C11 C6 C7 120.000 3.000
S44 C5 C6 C7 120.000 3.000
S44 C6 C5 H5 109.470 3.000
S44 C6 C5 H5A 109.470 3.000
S44 C6 C5 C2 109.470 3.000
S44 H5 C5 H5A 107.900 3.000
S44 H5 C5 C2 109.470 3.000
S44 H5A C5 C2 109.470 3.000
S44 C5 C2 H2 108.340 3.000
S44 C5 C2 C1 109.470 3.000
S44 C5 C2 C3 109.470 3.000
S44 H2 C2 C1 108.810 3.000
S44 H2 C2 C3 108.340 3.000
S44 C1 C2 C3 109.470 3.000
S44 C2 C1 O34 118.500 3.000
S44 C2 C1 O33 118.500 3.000
S44 O34 C1 O33 123.000 3.000
S44 C2 C3 H3 109.470 3.000
S44 C2 C3 H3A 109.470 3.000
S44 C2 C3 C4 111.000 3.000
S44 H3 C3 H3A 107.900 3.000
S44 H3 C3 C4 109.470 3.000
S44 H3A C3 C4 109.470 3.000
S44 C3 C4 H4B 109.470 3.000
S44 C3 C4 H4A 109.470 3.000
S44 C3 C4 H4 109.470 3.000
S44 H4B C4 H4A 109.470 3.000
S44 H4B C4 H4 109.470 3.000
S44 H4A C4 H4 109.470 3.000
loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
S44 var_1 O36 C13 C14 C19 179.696 20.000 1
S44 CONST_1 C13 C14 C15 C16 180.000 0.000 0
S44 CONST_2 C13 C14 C19 C18 180.000 0.000 0
S44 CONST_3 C14 C19 C18 C17 0.000 0.000 0
S44 CONST_4 C19 C18 C17 C16 0.000 0.000 0
S44 var_2 C18 C17 C20 C26 120.012 20.000 1
S44 var_3 C17 C20 C21 C22 180.000 20.000 1
S44 var_4 C17 C20 C25 C24 180.000 20.000 1
S44 var_5 C17 C20 C26 C27 179.977 20.000 1
S44 var_6 C20 C26 C27 C29 60.038 20.000 3
S44 var_7 C26 C27 C28 C24 59.957 20.000 3
S44 var_8 C27 C28 C24 C23 60.050 20.000 3
S44 var_9 C28 C24 C25 C20 60.000 20.000 3
S44 var_10 C28 C24 C23 C22 -60.000 20.000 3
S44 var_11 C26 C27 C29 C22 -60.038 20.000 3
S44 var_12 C27 C29 C22 C21 60.041 20.000 3
S44 var_13 C29 C22 C23 C24 60.000 20.000 3
S44 var_14 C29 C22 C21 C20 -60.000 20.000 3
S44 CONST_5 C18 C17 C16 C15 0.000 0.000 0
S44 CONST_6 C17 C16 C15 C14 0.000 0.000 0
S44 CONST_7 O36 C13 N35 C12 0.000 0.000 0
S44 var_15 C13 N35 C12 C8 179.987 20.000 3
S44 var_16 N35 C12 C8 C9 79.924 20.000 2
S44 CONST_8 C12 C8 C7 C6 180.000 0.000 0
S44 CONST_9 C12 C8 C9 C10 180.000 0.000 0
S44 var_17 C8 C9 O37 C30 179.956 20.000 1
S44 var_18 C9 O37 C30 C31 -179.991 20.000 1
S44 var_19 O37 C30 C31 C32 -179.989 20.000 3
S44 var_20 C30 C31 C32 H32 179.980 20.000 3
S44 CONST_10 C8 C9 C10 C11 0.000 0.000 0
S44 CONST_11 C9 C10 C11 C6 0.000 0.000 0
S44 CONST_12 C10 C11 C6 C5 180.000 0.000 0
S44 CONST_13 C11 C6 C7 C8 0.000 0.000 0
S44 var_21 C11 C6 C5 C2 -98.026 20.000 2
S44 var_22 C6 C5 C2 C3 -172.692 20.000 3
S44 var_23 C5 C2 C1 O33 179.959 20.000 3
S44 var_24 C5 C2 C3 C4 65.896 20.000 3
S44 var_25 C2 C3 C4 H4 -175.847 20.000 3
loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
S44 chir_01 C2 C1 C3 C5 negativ
S44 chir_02 C20 C17 C21 C25 positiv
S44 chir_03 C22 C21 C23 C29 positiv
S44 chir_04 C24 C23 C25 C28 positiv
S44 chir_05 C27 C26 C28 C29 negativ
loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
S44 plan-1 C1 0.020
S44 plan-1 O33 0.020
S44 plan-1 O34 0.020
S44 plan-1 C2 0.020
S44 plan-2 C6 0.020
S44 plan-2 C5 0.020
S44 plan-2 C7 0.020
S44 plan-2 C11 0.020
S44 plan-2 C8 0.020
S44 plan-2 C9 0.020
S44 plan-2 C10 0.020
S44 plan-2 H7 0.020
S44 plan-2 C12 0.020
S44 plan-2 O37 0.020
S44 plan-2 H10 0.020
S44 plan-2 H11 0.020
S44 plan-3 N35 0.020
S44 plan-3 C12 0.020
S44 plan-3 C13 0.020
S44 plan-3 HN35 0.020
S44 plan-4 C13 0.020
S44 plan-4 N35 0.020
S44 plan-4 O36 0.020
S44 plan-4 C14 0.020
S44 plan-4 HN35 0.020
S44 plan-5 C14 0.020
S44 plan-5 C13 0.020
S44 plan-5 C15 0.020
S44 plan-5 C19 0.020
S44 plan-5 C16 0.020
S44 plan-5 C17 0.020
S44 plan-5 C18 0.020
S44 plan-5 H15 0.020
S44 plan-5 H16 0.020
S44 plan-5 C20 0.020
S44 plan-5 H18 0.020
S44 plan-5 H19 0.020
# ------------------------------------------------------
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