Mc-Val-Ala-PABC (pSAR10-Ac)
                    3D
 Structure written by MMmdl.
182183  0  0  1  0            999 V2000
   13.7287    7.7387   -5.9116 C   0  0  0  0  0  0
   14.1170    6.4801   -5.1940 C   0  0  0  0  0  0
   13.0919    5.9565   -4.5212 N   0  0  0  0  0  0
   11.7424    6.5110   -4.4656 C   0  0  0  0  0  0
   11.1711    6.5759   -5.8510 C   0  0  0  0  0  0
   10.3071    7.5827   -5.9844 N   0  0  0  0  0  0
    9.5786    7.9187   -7.2042 C   0  0  0  0  0  0
    8.7068    9.1132   -6.9529 C   0  0  0  0  0  0
    8.5336    9.8415   -8.0563 N   0  0  0  0  0  0
    7.7412   11.0642   -8.1494 C   0  0  0  0  0  0
    6.6194   11.0099   -7.1551 C   0  0  0  0  0  0
    5.8127    9.9711   -7.3739 N   0  0  0  0  0  0
    4.6302    9.6351   -6.5862 C   0  0  0  0  0  0
    5.0211    8.7221   -5.4621 C   0  0  0  0  0  0
    3.9731    8.3846   -4.7102 N   0  0  0  0  0  0
    4.0146    7.5111   -3.5410 C   0  0  0  0  0  0
    2.6346    7.3758   -2.9688 C   0  0  0  0  0  0
    1.9737    6.3497   -3.5055 N   0  0  0  0  0  0
    0.6116    5.9481   -3.1667 C   0  0  0  0  0  0
    0.6477    4.9583   -2.0402 C   0  0  0  0  0  0
   -0.5758    4.5588   -1.6918 N   0  0  0  0  0  0
   -0.8860    3.6025   -0.6331 C   0  0  0  0  0  0
   -0.2331    2.2874   -0.9401 C   0  0  0  0  0  0
   -0.4867    1.3765    0.0000 N   0  0  0  0  0  0
   15.2345    5.9724   -5.2076 O   0  0  0  0  0  0
   13.1376    4.7361   -3.7210 C   0  0  0  0  0  0
   11.4478    5.8088   -6.7685 O   0  0  0  0  0  0
    9.9369    8.5269   -4.9342 C   0  0  0  0  0  0
    8.2018    9.4077   -5.8736 O   0  0  0  0  0  0
    9.1058    9.5450   -9.3664 C   0  0  0  0  0  0
    6.4422   11.8109   -6.2419 O   0  0  0  0  0  0
    5.9693    8.9859   -8.4400 C   0  0  0  0  0  0
    6.1591    8.3196   -5.2389 O   0  0  0  0  0  0
    2.5987    8.8289   -4.9231 C   0  0  0  0  0  0
    2.1484    8.1064   -2.1106 O   0  0  0  0  0  0
    2.4954    5.4463   -4.5270 C   0  0  0  0  0  0
    1.6650    4.5491   -1.4885 O   0  0  0  0  0  0
   -1.8214    5.0070   -2.3074 C   0  0  0  0  0  0
    0.4556    2.0516   -1.9285 O   0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0
   -1.2959    1.5946    1.1955 C   0  0  0  0  0  0
    1.5000    0.0000    0.0000 C   0  0  0  0  0  0
    1.9958   -1.2377    0.0000 N   0  0  0  0  0  0
    2.2088    1.0022   -0.0000 O   0  0  0  0  0  0
    1.2077   -2.4668   -0.0000 C   0  0  0  0  0  0
    3.4145   -1.5828   -0.0000 C   0  0  0  0  0  0
    1.9688   -3.5488   -0.7071 C   0  0  0  0  0  0
    1.6994   -3.5723   -2.0127 N   0  0  0  0  0  0
    2.7502   -4.3305   -0.1733 O   0  0  0  0  0  0
    2.2740   -4.5026   -2.9803 C   0  0  0  0  0  0
    0.7822   -2.6721   -2.7056 C   0  0  0  0  0  0
    3.0177   -3.7340   -4.0320 C   0  0  0  0  0  0
    3.5632   -4.5406   -4.9429 N   0  0  0  0  0  0
    3.1265   -2.5120   -4.0730 O   0  0  0  0  0  0
    4.3501   -4.1093   -6.0946 C   0  0  0  0  0  0
    4.4526   -2.6128   -6.0981 C   0  0  0  0  0  0
    3.4963   -1.8523   -6.7604 C   0  0  0  0  0  0
    3.5913   -0.4658   -6.7636 C   0  0  0  0  0  0
    4.6426    0.1603   -6.1045 C   0  0  0  0  0  0
    5.5989   -0.6002   -5.4422 C   0  0  0  0  0  0
    5.5039   -1.9868   -5.4389 C   0  0  0  0  0  0
    6.5361   -2.8075   -4.7241 C   0  0  0  0  0  0
    7.5650   -3.1106   -5.5924 O   0  0  0  0  0  0
    2.5866    0.3331   -7.4594 N   0  0  0  0  0  0
    1.3649   -0.0814   -7.7960 C   0  0  0  0  0  0
    0.5870    0.9899   -8.5011 C   0  0  1  0  0  0
    0.9514   -1.2099   -7.5466 O   0  0  0  0  0  0
    0.2174    0.5250   -9.8349 N   0  0  0  0  0  0
    0.5712    1.1044  -10.9825 C   0  0  0  0  0  0
    0.0227    0.3706  -12.1702 C   0  0  1  0  0  0
   -1.2898    0.9107  -12.5124 N   0  0  0  0  0  0
   -2.4349    0.6097  -11.8991 C   0  0  0  0  0  0
   -3.5986    1.3408  -12.5003 C   0  0  0  0  0  0
   -3.7828    2.6525  -11.7962 C   0  0  0  0  0  0
   -0.6541    1.3035   -7.7192 C   0  0  0  0  0  0
    0.9522    0.5395  -13.3353 C   0  0  0  0  0  0
    1.2636    2.1167  -11.0325 O   0  0  0  0  0  0
   -2.5406    3.4797  -11.9471 C   0  0  0  0  0  0
   -2.5007   -0.1751  -10.9576 O   0  0  0  0  0  0
   -2.2779    3.7264  -13.4031 C   0  0  0  0  0  0
   -1.0358    4.5536  -13.5540 C   0  0  0  0  0  0
   -1.2151    5.8302  -12.8687 N   0  0  0  0  0  0
   -1.7137    6.9143  -13.4579 C   0  0  0  0  0  0
   -1.7181    7.9248  -12.4506 C   0  0  0  0  0  0
   -1.2253    7.3900  -11.3253 C   0  0  0  0  0  0
   -0.8964    6.0274  -11.5917 C   0  0  0  0  0  0
    0.4037   -0.1943  -14.5230 C   0  0  0  0  0  0
    2.3007   -0.0154  -12.9837 C   0  0  0  0  0  0
   -2.0862    7.0033  -14.6273 O   0  0  0  0  0  0
   -0.4195    5.1946  -10.8216 O   0  0  0  0  0  0
    3.4700   -5.9976   -4.9495 C   0  0  0  0  0  0
   12.6769    7.9543   -5.7237 H   0  0  0  0  0  0
   14.3394    8.5662   -5.5503 H   0  0  0  0  0  0
   13.8876    7.6103   -6.9823 H   0  0  0  0  0  0
   11.7790    7.5140   -4.0403 H   0  0  0  0  0  0
   11.1136    5.8750   -3.8427 H   0  0  0  0  0  0
    8.9589    7.0729   -7.5020 H   0  0  0  0  0  0
   10.2878    8.1474   -7.9997 H   0  0  0  0  0  0
    7.3311   11.1557   -9.1551 H   0  0  0  0  0  0
    8.3748   11.9250   -7.9356 H   0  0  0  0  0  0
    3.8996    9.1358   -7.2225 H   0  0  0  0  0  0
    4.1941   10.5471   -6.1786 H   0  0  0  0  0  0
    4.6787    7.9399   -2.7905 H   0  0  0  0  0  0
    4.3842    6.5286   -3.8344 H   0  0  0  0  0  0
    0.1404    5.4911   -4.0369 H   0  0  0  0  0  0
    0.0395    6.8245   -2.8621 H   0  0  0  0  0  0
   -1.9657    3.4664   -0.5713 H   0  0  0  0  0  0
   -0.5124    3.9802    0.3187 H   0  0  0  0  0  0
   14.1424    4.3154   -3.7572 H   0  0  0  0  0  0
   12.8781    4.9689   -2.6883 H   0  0  0  0  0  0
   12.4263    4.0130   -4.1203 H   0  0  0  0  0  0
   10.4768    8.2829   -4.0194 H   0  0  0  0  0  0
   10.1932    9.5387   -5.2485 H   0  0  0  0  0  0
    8.8643    8.4642   -4.7508 H   0  0  0  0  0  0
    9.6994    8.6329   -9.3056 H   0  0  0  0  0  0
    8.3030    9.4085  -10.0910 H   0  0  0  0  0  0
    9.7421   10.3724   -9.6806 H   0  0  0  0  0  0
    6.8506    9.2296   -9.0333 H   0  0  0  0  0  0
    6.0879    7.9941   -8.0037 H   0  0  0  0  0  0
    5.0863    8.9985   -9.0789 H   0  0  0  0  0  0
    2.5589    9.4820   -5.7948 H   0  0  0  0  0  0
    1.9583    7.9625   -5.0886 H   0  0  0  0  0  0
    2.2528    9.3738   -4.0447 H   0  0  0  0  0  0
    3.5129    5.7394   -4.7859 H   0  0  0  0  0  0
    2.4977    4.4262   -4.1429 H   0  0  0  0  0  0
    1.8651    5.4989   -5.4147 H   0  0  0  0  0  0
   -1.5986    5.7218   -3.0996 H   0  0  0  0  0  0
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   -0.3633   -0.5138   -0.8900 H   0  0  0  0  0  0
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   -1.6634    2.6207    1.2033 H   0  0  0  0  0  0
   -2.1408    0.9060    1.1929 H   0  0  0  0  0  0
   -0.6875    1.4198    2.0829 H   0  0  0  0  0  0
    0.2624   -2.2922   -0.5138 H   0  0  0  0  0  0
    1.0116   -2.7726    1.0277 H   0  0  0  0  0  0
    4.0104   -0.6701    0.0000 H   0  0  0  0  0  0
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M  END
> <s_m_entry_id>
46

> <s_m_entry_name>
entry

> <r_f3d_energy>
0

> <i_f3d_flags>
0

$$$$
