156

N   15.622000  -0.973000   2.061000 N    MET   51
H   16.332001  -1.307000   1.426000 H    MET   51
C   15.052000   0.350000   1.843000 CA   MET   51
H   15.098000   0.918000   2.771000 HA   MET   51
C   15.791000   1.088000   0.721000 CB   MET   51
H   15.791000   0.472000  -0.179000 HB2  MET   51
H   15.243000   2.001000   0.486000 HB3  MET   51
C   17.231001   1.458000   1.057000 CG   MET   51
H   17.840000   0.554000   1.051000 HG2  MET   51
H   17.606001   2.127000   0.282000 HG3  MET   51
S   17.424000   2.262000   2.674000 SD   MET   51
C   16.150999   3.526000   2.570000 CE   MET   51
H   15.158000   3.083000   2.618000 HE1  MET   51
H   16.268999   4.215000   3.405000 HE2  MET   51
H   16.259001   4.078000   1.636000 HE3  MET   51
C   13.582000   0.181000   1.474000 C    MET   51
O   12.746000   1.017000   1.816000 O    MET   51
N   19.854000  10.173000   0.778000 N    CYM   76
H   19.546000  10.331000  -0.170000 H    CYM   76
C   20.677000   8.996000   1.047000 CA   CYM   76
H   20.059999   8.249000   1.549000 HA   CYM   76
C   21.207001   8.406000  -0.260000 CB   CYM   76
H   21.969000   9.073000  -0.665000 HB2  CYM   76
H   21.683001   7.448000  -0.047000 HB3  CYM   76
S   19.962999   8.161000  -1.562000 SG   CYM   76
C   21.870001   9.326000   1.935000 C    CYM   76
O   22.167999   8.607000   2.891000 O    CYM   76
N   21.898001   9.274000   5.986000 N    CYM   79
H   21.478001   9.257000   5.068000 H    CYM   79
C   22.040001   8.021000   6.722000 CA   CYM   79
H   22.205999   8.221000   7.782000 HA   CYM   79
C   20.753000   7.208000   6.624000 CB   CYM   79
H   20.601000   6.926000   5.581000 HB2  CYM   79
H   20.871000   6.293000   7.206000 HB3  CYM   79
S   19.253000   8.064000   7.205000 SG   CYM   79
C   23.212000   7.178000   6.229000 C    CYM   79
O   23.688999   6.291000   6.938000 O    CYM   79
N   23.660999   7.453000   5.009000 N    HID   80
H   23.240000   8.204000   4.481000 H    HID   80
C   24.784000   6.745000   4.400000 CA   HID   80
H   25.167000   5.948000   5.035000 HA   HID   80
C   24.368999   6.151000   3.047000 CB   HID   80
H   24.004999   6.935000   2.384000 HB2  HID   80
H   25.253000   5.717000   2.578000 HB3  HID   80
C   23.326000   5.078000   3.135000 CG   HID   80
N   23.606001   3.741000   3.303000 ND1  HID   80
H   24.532000   3.344000   3.404000 HD1  HID   80
C   22.445000   3.066000   3.287000 CE1  HID   80
H   22.361000   1.994000   3.384000 HE1  HID   80
N   21.421000   3.879000   3.124000 NE2  HID   80
C   21.975000   5.158000   3.030000 CD2  HID   80
H   21.417999   6.071000   2.875000 HD2  HID   80
C   25.881001   7.789000   4.172000 C    HID   80
O   26.172001   8.152000   3.033000 O    HID   80
FE  19.579000   3.123000   2.869000 FE   HEC   92
C   20.165001  -0.118000   3.715000 CHA  HEC   92
C   20.653999   2.512000  -0.312000 CHB  HEC   92
C   18.476000   6.238000   1.942000 CHC  HEC   92
C   19.117001   3.922000   6.171000 CHD  HEC   92
N   20.224001   1.537000   1.906000 NA   HEC   92
C   20.285999   0.236000   2.376000 C1A  HEC   92
C   20.728001  -0.673000   1.332000 C2A  HEC   92
C   21.021000   0.090000   0.254000 C3A  HEC   92
C   20.691000   1.454000   0.595000 C4A  HEC   92
C   21.579000  -0.426000  -1.073000 CMA  HEC   92
C   20.701000  -2.202000   1.394000 CAA  HEC   92
C   19.283001  -2.768000   1.348000 CBA  HEC   92
C   18.544001  -2.374000   0.082000 CGA  HEC   92
O   19.000999  -2.753000  -1.015000 O1A  HEC   92
O   17.511000  -1.680000   0.180000 O2A  HEC   92
N   19.509001   4.120000   1.182000 NB   HEC   92
C   20.091999   3.765000  -0.026000 C1B  HEC   92
C   19.927999   4.821000  -1.002000 C2B  HEC   92
C   19.202000   5.808000  -0.411000 C3B  HEC   92
C   18.972000   5.386000   0.960000 C4B  HEC   92
C   20.528000   4.838000  -2.405000 CMB  HEC   92
C   18.618999   7.068000  -1.047000 CAB  HEC   92
C   17.632999   6.815000  -2.178000 CBB  HEC   92
N   18.889999   4.707000   3.831000 NC   HEC   92
C   18.444000   5.923000   3.300000 C1C  HEC   92
C   17.982000   6.820000   4.334000 C2C  HEC   92
C   18.177999   6.177000   5.523000 C3C  HEC   92
C   18.733000   4.866000   5.207000 C4C  HEC   92
C   17.455000   8.237000   4.132000 CMC  HEC   92
C   18.018999   6.758000   6.935000 CAC  HEC   92
C   16.624001   7.241000   7.317000 CBC  HEC   92
N   19.743000   2.149000   4.565000 ND   HEC   92
C   19.608000   2.655000   5.852000 C1D  HEC   92
C   19.871000   1.612000   6.826000 C2D  HEC   92
C   20.083000   0.469000   6.140000 C3D  HEC   92
C   19.997000   0.801000   4.736000 C4D  HEC   92
C   19.948999   1.779000   8.332000 CMD  HEC   92
C   20.340000  -0.922000   6.708000 CAD  HEC   92
C   19.152000  -1.574000   7.394000 CBD  HEC   92
C   19.466000  -2.971000   7.900000 CGD  HEC   92
O   18.701000  -3.479000   8.749000 O1D  HEC   92
O   20.471001  -3.563000   7.444000 O2D  HEC   92
H   20.266001   2.671000   8.543000 HMD3 HEC   92
H   19.069000   1.649000   8.718000 HMD2 HEC   92
H   20.563000   1.124000   8.699000 HMD1 HEC   92
H   17.879999   8.633000   3.355000 HMC3 HEC   92
H   16.495001   8.209000   3.995000 HMC2 HEC   92
H   17.653999   8.771000   4.917000 HMC1 HEC   92
H   21.363001   4.344000  -2.406000 HMB3 HEC   92
H   19.908001   4.426000  -3.027000 HMB2 HEC   92
H   20.694000   5.755000  -2.675000 HMB1 HEC   92
H   21.275999   0.146000  -1.796000 HMA3 HEC   92
H   22.548000  -0.420000  -1.041000 HMA2 HEC   92
H   21.267000  -1.332000  -1.225000 HMA1 HEC   92
H   18.868000  -1.020000   8.138000 HBD2 HEC   92
H   18.408001  -1.618000   6.773000 HBD1 HEC   92
H   16.347000   7.943000   6.708000 HBC3 HEC   92
H   15.999000   6.501000   7.263000 HBC2 HEC   92
H   16.638000   7.586000   8.223000 HBC1 HEC   92
H   18.073999   6.322000  -2.888000 HBB3 HEC   92
H   16.882999   6.298000  -1.844000 HBB2 HEC   92
H   17.313000   7.663000  -2.524000 HBB1 HEC   92
H   19.320999  -3.735000   1.409000 HBA2 HEC   92
H   18.787001  -2.454000   2.120000 HBA1 HEC   92
H   20.635000  -1.500000   5.987000 HAD2 HEC   92
H   21.070999  -0.866000   7.344000 HAD1 HEC   92
H   21.212999  -2.561000   0.653000 HAA2 HEC   92
H   21.136999  -2.497000   2.209000 HAA1 HEC   92
H   19.037001   4.162000   7.107000 HHD  HEC   92
H   18.132000   7.102000   1.666000 HHC  HEC   92
H   21.039000   2.374000  -1.192000 HHB  HEC   92
H   20.200001  -1.059000   3.946000 HHA  HEC   92
H   18.766001   6.815000   7.551000 HAC  HEC   92
H   18.858999   7.961000  -0.753000 HAB  HEC   92
C   15.248544  -1.769103   3.065478 CAC  MET   51  CAPPING
O   14.388676  -1.413928   3.868545 OAC  MET   51  CAPPING
C   16.258997  -2.735495   2.500559 CME  MET   51  CAPPING
H   15.775064  -3.380579   1.767227 HM1  MET   51  CAPPING
H   17.064375  -2.180163   2.019858 HM2  MET   51  CAPPING
H   16.668959  -3.345256   3.305683 HM3  MET   51  CAPPING
N   13.192890  -0.898914   0.763451 NT   MET   51  CAPPING
H   13.884900  -1.513492   0.359079 HT1  MET   51  CAPPING
H   12.209769  -1.092272   0.636228 HT2  MET   51  CAPPING
C   19.495150  11.041448   1.726288 CAC  CYM   76  CAPPING
O   19.848606  10.886438   2.893113 OAC  CYM   76  CAPPING
C   18.783806  11.764191   0.610181 CME  CYM   76  CAPPING
H   19.459892  12.489362   0.157265 HM1  CYM   76  CAPPING
H   18.465136  11.044807  -0.144164 HM2  CYM   76  CAPPING
H   17.911491  12.281552   1.009561 HM3  CYM   76  CAPPING
N   22.612106  10.422402   1.671022 NT   CYM   76  CAPPING
H   23.620383  10.365074   1.684825 HT1  CYM   76  CAPPING
H   22.159033  11.300000   1.459725 HT2  CYM   76  CAPPING
C   22.299355  10.451407   6.470614 CAC  CYM   79  CAPPING
O   22.817490  10.535088   7.581908 OAC  CYM   79  CAPPING
C   21.792337  11.012257   5.165836 CME  CYM   79  CAPPING
H   22.596315  11.005168   4.429855 HM1  CYM   79  CAPPING
H   20.964485  10.402049   4.804714 HM2  CYM   79  CAPPING
H   21.449211  12.035517   5.318491 HM3  CYM   79  CAPPING
N   26.534223   8.315434   5.229671 NT   HID   80  CAPPING
H   26.957804   7.706917   5.915518 HT1  HID   80  CAPPING
H   26.599348   9.317801   5.335119 HT2  HID   80  CAPPING
