File: atoms.dat.save

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#Atom Name  #Res Name  #Mol Type   Charge     Mass GBradius El     rVDW     eVDW
   38 N        3 THR      1 N     -0.4157  14.0100   1.5500  N   1.8240   0.1700
   39 H        3 THR      1 H      0.2719   1.0080   1.2000  H   0.6000   0.0157
   40 CA       3 THR      1 CT    -0.0389  12.0100   1.7000  C   1.9080   0.1094
   41 HA       3 THR      1 H1     0.1007   1.0080   1.2000  H   1.3870   0.0157
   42 CB       3 THR      1 CT     0.3654  12.0100   1.7000  C   1.9080   0.1094
   43 HB       3 THR      1 H1     0.0043   1.0080   1.2000  H   1.3870   0.0157
   44 CG2      3 THR      1 CT    -0.2438  12.0100   1.7000  C   1.9080   0.1094
   45 HG21     3 THR      1 HC     0.0642   1.0080   1.2000  H   1.4870   0.0157
   46 HG22     3 THR      1 HC     0.0642   1.0080   1.2000  H   1.4870   0.0157
   47 HG23     3 THR      1 HC     0.0642   1.0080   1.2000  H   1.4870   0.0157
   48 OG1      3 THR      1 OH    -0.6761  16.0000   1.5000  O   1.7210   0.2104
   49 HG1      3 THR      1 HO     0.4102   1.0080   1.2000  H   0.0000   0.0000
   50 C        3 THR      1 C      0.5973  12.0100   1.7000  C   1.9080   0.0860
   51 O        3 THR      1 O     -0.5679  16.0000   1.5000  O   1.6612   0.2100