Gly3-vcPAB
                    3D
 Structure written by MMmdl.
 98 98  0  0  1  0            999 V2000
   -1.0311    5.8837    9.2029 O   0  0  0  0  0  0
   -1.4299    6.7687    8.2542 C   0  0  0  0  0  0
   -2.8334    7.1083    8.4697 N   0  0  0  0  0  0
   -3.5024    8.0486    7.5754 C   0  0  0  0  0  0
   -3.4695    7.5153    6.1737 C   0  0  0  0  0  0
   -4.1385    8.4556    5.2794 N   0  0  0  0  0  0
   -4.2388    8.1609    3.8530 C   0  0  0  0  0  0
   -3.6426    6.9686    3.5976 O   0  0  0  0  0  0
   -3.7472    6.7074    2.2466 C   0  0  0  0  0  0
   -4.7665    8.8479    2.9856 O   0  0  0  0  0  0
   -0.6885    7.1887    7.3729 O   0  0  0  0  0  0
   -3.5677    6.5074    9.5794 C   0  0  0  0  0  0
   -4.7073    9.6905    5.8117 C   0  0  0  0  0  0
   -3.0943    5.3923    1.9396 C   0  0  0  0  0  0
   -3.5569    4.2291    2.5433 C   0  0  0  0  0  0
   -2.9519    3.0106    2.2589 C   0  0  0  0  0  0
   -1.8843    2.9554    1.3707 C   0  0  0  0  0  0
   -1.4217    4.1186    0.7670 C   0  0  0  0  0  0
   -2.0267    5.3371    1.0515 C   0  0  0  0  0  0
   -1.2487    1.6754    1.0719 N   0  0  0  0  0  0
   -0.5000    1.4142    0.0000 C   0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  2  0  0  0
    1.4600    0.0000    0.0000 N   0  0  0  0  0  0
    2.2343   -0.5427   -0.9401 C   0  0  0  0  0  0
    3.6918   -0.3655   -0.6331 C   0  0  2  0  0  0
    4.3273    0.3900   -1.7087 N   0  0  0  0  0  0
    4.7811    1.6401   -1.6134 C   0  0  0  0  0  0
    5.3774    2.1169   -2.9046 C   0  0  0  0  0  0
    6.4937    1.2515   -3.2740 N   0  0  0  0  0  0
    6.8880    0.9855   -4.5196 C   0  0  0  0  0  0
    8.0669    0.0585   -4.5456 C   0  0  0  0  0  0
    8.8793    0.3373   -5.7262 N   0  0  0  0  0  0
   10.1575    0.7169   -5.7146 C   0  0  0  0  0  0
   10.6918    0.9195   -7.1015 C   0  0  0  0  0  0
   11.8172    0.0170   -7.3262 N   0  0  0  0  0  0
   10.7969    0.8742   -4.6787 O   0  0  0  0  0  0
    6.3346    1.4563   -5.5090 O   0  0  0  0  0  0
    4.7071    2.2994   -0.5807 O   0  0  0  0  0  0
    4.3447   -1.7106   -0.5134 C   0  0  0  0  0  0
    3.6918   -2.4868    0.5917 C   0  0  0  0  0  0
    5.8022   -1.5334   -0.2064 C   0  0  0  0  0  0
    1.7824   -1.1134   -1.9285 O   0  0  0  0  0  0
   -0.2638    2.2495   -0.8679 O   0  0  0  0  0  0
   -0.5000   -0.7071   -1.2247 C   0  0  0  0  0  0
   -2.0000   -0.7071   -1.2247 C   0  0  0  0  0  0
   -2.5000   -1.4142   -2.4495 C   0  0  0  0  0  0
   -3.9600   -1.4142   -2.4495 N   0  0  0  0  0  0
   -4.7317   -2.3512   -2.9904 C   0  0  0  0  0  0
   -6.0288   -2.1005   -2.8457 N   0  0  0  0  0  0
   -4.2933   -3.3424   -3.5627 O   0  0  0  0  0  0
   -0.1238    5.6726    9.0528 H   0  0  0  0  0  0
   -2.9905    9.0103    7.6103 H   0  0  0  0  0  0
   -4.5378    8.1765    7.8912 H   0  0  0  0  0  0
   -3.9814    6.5537    6.1388 H   0  0  0  0  0  0
   -2.4341    7.3875    5.8579 H   0  0  0  0  0  0
   -3.2521    7.4990    1.6841 H   0  0  0  0  0  0
   -4.7994    6.6651    1.9651 H   0  0  0  0  0  0
   -2.9080    5.8379   10.1313 H   0  0  0  0  0  0
   -3.9276    7.2925   10.2443 H   0  0  0  0  0  0
   -4.4156    5.9433    9.1909 H   0  0  0  0  0  0
   -5.1615   10.2603    5.0011 H   0  0  0  0  0  0
   -5.4662    9.4496    6.5562 H   0  0  0  0  0  0
   -3.9189   10.2834    6.2753 H   0  0  0  0  0  0
   -4.3880    4.2721    3.2348 H   0  0  0  0  0  0
   -3.3120    2.1050    2.7289 H   0  0  0  0  0  0
   -0.5905    4.0756    0.0755 H   0  0  0  0  0  0
   -1.6665    6.2428    0.5815 H   0  0  0  0  0  0
   -1.4678    1.0197    1.8082 H   0  0  0  0  0  0
   -0.3633   -0.5138    0.8900 H   0  0  0  0  0  0
    1.7888    0.4775    0.8270 H   0  0  0  0  0  0
    3.8020    0.1767    0.3061 H   0  0  0  0  0  0
    4.3678   -0.1872   -2.5365 H   0  0  0  0  0  0
    5.7350    3.1395   -2.7839 H   0  0  0  0  0  0
    4.6198    2.0869   -3.6877 H   0  0  0  0  0  0
    6.9191    0.8868   -2.4337 H   0  0  0  0  0  0
    7.7172   -0.9733   -4.5806 H   0  0  0  0  0  0
    8.6669    0.2085   -3.6480 H   0  0  0  0  0  0
    8.3169    0.1963   -6.5532 H   0  0  0  0  0  0
   11.0250    1.9511   -7.2153 H   0  0  0  0  0  0
    9.9066    0.7091   -7.8277 H   0  0  0  0  0  0
   11.5089   -0.9390   -7.2208 H   0  0  0  0  0  0
   12.1780    0.1539   -8.2595 H   0  0  0  0  0  0
    4.2346   -2.2528   -1.4525 H   0  0  0  0  0  0
    3.8020   -1.9446    1.5308 H   0  0  0  0  0  0
    2.6327   -2.6156    0.3686 H   0  0  0  0  0  0
    4.1663   -3.4643    0.6786 H   0  0  0  0  0  0
    5.9124   -0.9912    0.7327 H   0  0  0  0  0  0
    6.2767   -2.5108   -0.1194 H   0  0  0  0  0  0
    6.2767   -0.9693   -1.0094 H   0  0  0  0  0  0
   -0.1367   -1.7348   -1.2247 H   0  0  0  0  0  0
   -0.1367   -0.1933   -2.1147 H   0  0  0  0  0  0
   -2.3633    0.3206   -1.2247 H   0  0  0  0  0  0
   -2.3633   -1.2209   -0.3348 H   0  0  0  0  0  0
   -2.1367   -2.4419   -2.4495 H   0  0  0  0  0  0
   -2.1367   -0.9004   -3.3395 H   0  0  0  0  0  0
   -4.2881   -0.5889   -1.9730 H   0  0  0  0  0  0
   -6.7793   -2.6841   -3.1827 H   0  0  0  0  0  0
   -6.4213   -1.2965   -2.3816 H   0  0  0  0  0  0
  1  2  1  0  0  0
  1 51  1  0  0  0
  2  3  1  0  0  0
  2 11  2  0  0  0
  3  4  1  0  0  0
  3 12  1  0  0  0
  4  5  1  0  0  0
  4 52  1  0  0  0
  4 53  1  0  0  0
  5  6  1  0  0  0
  5 54  1  0  0  0
  5 55  1  0  0  0
  6  7  1  0  0  0
  6 13  1  0  0  0
  7  8  1  0  0  0
  7 10  2  0  0  0
  8  9  1  0  0  0
  9 14  1  0  0  0
  9 56  1  0  0  0
  9 57  1  0  0  0
 12 58  1  0  0  0
 12 59  1  0  0  0
 12 60  1  0  0  0
 13 61  1  0  0  0
 13 62  1  0  0  0
 13 63  1  0  0  0
 14 19  1  0  0  0
 14 15  2  0  0  0
 15 16  1  0  0  0
 15 64  1  0  0  0
 16 17  2  0  0  0
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 17 18  1  0  0  0
 17 20  1  0  0  0
 18 19  2  0  0  0
 18 66  1  0  0  0
 19 67  1  0  0  0
 20 21  1  0  0  0
 20 68  1  0  0  0
 21 22  1  0  0  0
 21 43  2  0  0  0
 22 23  1  0  0  0
 22 44  1  0  0  0
 22 69  1  0  0  0
 23 24  1  0  0  0
 23 70  1  0  0  0
 24 25  1  0  0  0
 24 42  2  0  0  0
 25 26  1  0  0  0
 25 39  1  0  0  0
 25 71  1  0  0  0
 26 27  1  0  0  0
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 27 28  1  0  0  0
 27 38  2  0  0  0
 28 29  1  0  0  0
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 29 30  1  0  0  0
 29 75  1  0  0  0
 30 31  1  0  0  0
 30 37  2  0  0  0
 31 32  1  0  0  0
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 47 96  1  0  0  0
 48 49  1  0  0  0
 48 50  2  0  0  0
 49 97  1  0  0  0
 49 98  1  0  0  0
M  END
> <s_m_entry_id>
85

> <s_m_entry_name>
entry

> <i_f3d_flags>
0

> <r_f3d_energy>
0

$$$$
